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+]1CC[C@H](CC(=O)NC[C@@H]2CCN2CCCCc2ccccc2)C1 ZINC001569379764 1085159381 /nfs/dbraw/zinc/15/93/81/1085159381.db2.gz IFNZNTBYMLBUNS-UXHICEINSA-N 1 3 343.515 2.542 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@@H]2CCN2CCCCc2ccccc2)C1 ZINC001569379764 1085159387 /nfs/dbraw/zinc/15/93/87/1085159387.db2.gz IFNZNTBYMLBUNS-UXHICEINSA-N 1 3 343.515 2.542 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]CCC2=CCCCC2)CC1 ZINC001569431878 1085201495 /nfs/dbraw/zinc/20/14/95/1085201495.db2.gz GRLOXRSADSRCCL-IAGOWNOFSA-N 1 3 333.520 2.988 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]CCCc2ccccc2)CC1 ZINC001569432154 1085201758 /nfs/dbraw/zinc/20/17/58/1085201758.db2.gz NOPRQXGUGVIGRG-QZTJIDSGSA-N 1 3 343.515 2.730 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001569466855 1085263176 /nfs/dbraw/zinc/26/31/76/1085263176.db2.gz GRPLAATUNRNTPP-GVZHBMFQSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001569466855 1085263187 /nfs/dbraw/zinc/26/31/87/1085263187.db2.gz GRPLAATUNRNTPP-GVZHBMFQSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001569466856 1085264068 /nfs/dbraw/zinc/26/40/68/1085264068.db2.gz GRPLAATUNRNTPP-MHEFIBMXSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001569466856 1085264072 /nfs/dbraw/zinc/26/40/72/1085264072.db2.gz GRPLAATUNRNTPP-MHEFIBMXSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001569466854 1085264834 /nfs/dbraw/zinc/26/48/34/1085264834.db2.gz GRPLAATUNRNTPP-CNTHDYSMSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001569466854 1085264844 /nfs/dbraw/zinc/26/48/44/1085264844.db2.gz GRPLAATUNRNTPP-CNTHDYSMSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@]2(CCN(C(=O)CN3CCC(C)CC3)C2)C1 ZINC001569479442 1085288155 /nfs/dbraw/zinc/28/81/55/1085288155.db2.gz WNHUGNHOEPNOFO-KTBYTZPXSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@]2(CCN(C(=O)CN3CCC(C)CC3)C2)C1 ZINC001569479442 1085288162 /nfs/dbraw/zinc/28/81/62/1085288162.db2.gz WNHUGNHOEPNOFO-KTBYTZPXSA-N 1 3 347.547 2.999 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC[C@H]2C[NH2+]CCC2CC2)C1 ZINC001569556276 1085372707 /nfs/dbraw/zinc/37/27/07/1085372707.db2.gz ZNDPBYJMDVWBTF-QFBILLFUSA-N 1 3 339.499 2.580 10 0 EFAEHO O=C(CN1CCCC1)N1CCC[C@H]1C[NH2+]CCc1ccc(Cl)cc1 ZINC001569564490 1085380695 /nfs/dbraw/zinc/38/06/95/1085380695.db2.gz BZBLCJIIEHVABO-SFHVURJKSA-N 1 3 349.906 2.559 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@](C)(C[NH2+]CC2=CCCCC2)C1)N(C)C ZINC001569683775 1085515443 /nfs/dbraw/zinc/51/54/43/1085515443.db2.gz QVSPFVFFZJDJHU-QUCCMNQESA-N 1 3 335.536 2.901 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CC[C@H](C[NH2+]CCC3CC3)CC2)CCC1 ZINC001569863921 1085689666 /nfs/dbraw/zinc/68/96/66/1085689666.db2.gz BVBUNWLUXOVMIB-IYARVYRRSA-N 1 3 335.536 2.783 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@H]2CN(C(=O)C(C)(C)N3CCCCC3)C[C@H]2C1 ZINC001569875377 1085705777 /nfs/dbraw/zinc/70/57/77/1085705777.db2.gz BJJRQMPXHNNDMP-WOQGQJNTSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@H]2CN(C(=O)C(C)(C)N3CCCCC3)C[C@H]2C1 ZINC001569875377 1085705781 /nfs/dbraw/zinc/70/57/81/1085705781.db2.gz BJJRQMPXHNNDMP-WOQGQJNTSA-N 1 3 347.547 2.997 10 0 EFAEHO CCC/C=C\CC[N@H+]1C[C@H]2CN(C(=O)[C@@H](C(C)C)N(C)C)C[C@H]2C1 ZINC001569882144 1085716660 /nfs/dbraw/zinc/71/66/60/1085716660.db2.gz PARDWYKRQNKXKQ-VXARMHRZSA-N 1 3 335.536 2.709 10 0 EFAEHO CCC/C=C\CC[N@@H+]1C[C@H]2CN(C(=O)[C@@H](C(C)C)N(C)C)C[C@H]2C1 ZINC001569882144 1085716665 /nfs/dbraw/zinc/71/66/65/1085716665.db2.gz PARDWYKRQNKXKQ-VXARMHRZSA-N 1 3 335.536 2.709 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](CC[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001569984321 1085818686 /nfs/dbraw/zinc/81/86/86/1085818686.db2.gz RPGGLIRPMJRVJW-MJGOQNOKSA-N 1 3 349.563 2.981 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](CC[NH2+]Cc2ccc(C)cc2C)C1)N(C)C ZINC001569986442 1085821755 /nfs/dbraw/zinc/82/17/55/1085821755.db2.gz JBLRSQYMOJTQHT-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CCCC[NH2+]CC[C@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001570001984 1085843027 /nfs/dbraw/zinc/84/30/27/1085843027.db2.gz JMCDCWYIFFRUQG-LPHOPBHVSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001570005824 1085847422 /nfs/dbraw/zinc/84/74/22/1085847422.db2.gz NZGGJEQTHGVRJD-RBUKOAKNSA-N 1 3 343.515 2.665 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](CC[NH2+]Cc2cccc(Cl)c2)C1 ZINC001570019688 1085867661 /nfs/dbraw/zinc/86/76/61/1085867661.db2.gz VQPILLDVXRLNGX-INIZCTEOSA-N 1 3 349.906 2.764 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CC[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001570018387 1085867808 /nfs/dbraw/zinc/86/78/08/1085867808.db2.gz DGKSXOVKKHPPLB-QGZVFWFLSA-N 1 3 347.478 2.558 10 0 EFAEHO Cc1cccnc1CN1CCC[C@H](NC(=O)CCCC[NH+](C)C)CC1 ZINC001570185722 1086032799 /nfs/dbraw/zinc/03/27/99/1086032799.db2.gz QGIFRNZSXKFPSU-SFHVURJKSA-N 1 3 346.519 2.593 10 0 EFAEHO CCCCC[N@@H+]1CC[C@]2(C1)CCCN(C(=O)CN(C)C1CCC1)C2 ZINC001570272950 1086111424 /nfs/dbraw/zinc/11/14/24/1086111424.db2.gz JOZBSFGDRMTTPS-FQEVSTJZSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCC[N@H+]1CC[C@]2(C1)CCCN(C(=O)CN(C)C1CCC1)C2 ZINC001570272950 1086111428 /nfs/dbraw/zinc/11/14/28/1086111428.db2.gz JOZBSFGDRMTTPS-FQEVSTJZSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CC/C=C\c2ccccc2)[C@@H](C)C1 ZINC001570362264 1086168483 /nfs/dbraw/zinc/16/84/83/1086168483.db2.gz RNCSOUGAHQCWOI-KPHVFVAGSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001570363948 1086171075 /nfs/dbraw/zinc/17/10/75/1086171075.db2.gz KQIKRUMLMRULCA-QUCCMNQESA-N 1 3 345.531 2.704 10 0 EFAEHO CCC[NH2+]CC1(c2ccccc2)CCN(C(=O)CN2CCCC2)CC1 ZINC001570405967 1086209992 /nfs/dbraw/zinc/20/99/92/1086209992.db2.gz OXNTUXSFGQMZNW-UHFFFAOYSA-N 1 3 343.515 2.642 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)CCCC[NH+](C)C)CCN1Cc1ccsc1 ZINC001570449067 1086250199 /nfs/dbraw/zinc/25/01/99/1086250199.db2.gz LVRORSNTPNZPPP-NVXWUHKLSA-N 1 3 337.533 2.949 10 0 EFAEHO CN(CC(=O)N1CCCC[C@H]1C[NH2+]CCc1ccccc1)C1CCC1 ZINC001570510480 1086296159 /nfs/dbraw/zinc/29/61/59/1086296159.db2.gz BRMRHXKWHGPWTR-FQEVSTJZSA-N 1 3 343.515 2.684 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@H]1C[NH2+]CCCC1CCCC1 ZINC001570514130 1086299315 /nfs/dbraw/zinc/29/93/15/1086299315.db2.gz DLROKJLTCLJZLP-SFHVURJKSA-N 1 3 332.492 2.893 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@H]1CCCCC[N@@H+]1CC=C(C)C ZINC001570822864 1086543716 /nfs/dbraw/zinc/54/37/16/1086543716.db2.gz MVVLWCLVSYGJSL-MSOLQXFVSA-N 1 3 341.515 2.993 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@H]1CCCCC[N@H+]1CC=C(C)C ZINC001570822864 1086543717 /nfs/dbraw/zinc/54/37/17/1086543717.db2.gz MVVLWCLVSYGJSL-MSOLQXFVSA-N 1 3 341.515 2.993 10 0 EFAEHO CC(C)=CC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)[C@@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001570955843 1086622446 /nfs/dbraw/zinc/62/24/46/1086622446.db2.gz SZSTWBOYDVYACO-MKXGPGLRSA-N 1 3 333.520 2.511 10 0 EFAEHO CC(C)=CC[N@H+]1C[C@@H]2[C@@H](CNC(=O)[C@@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001570955843 1086622449 /nfs/dbraw/zinc/62/24/49/1086622449.db2.gz SZSTWBOYDVYACO-MKXGPGLRSA-N 1 3 333.520 2.511 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CCCC2(CN(C(=O)CN(C)CCC)C2)C1 ZINC001571049203 1086654505 /nfs/dbraw/zinc/65/45/05/1086654505.db2.gz RAJKGKNZGWLHDN-FPLPWBNLSA-N 1 3 335.536 2.999 10 0 EFAEHO CCC/C=C\CC[N@H+]1CCCC2(CN(C(=O)CN(C)CCC)C2)C1 ZINC001571049203 1086654508 /nfs/dbraw/zinc/65/45/08/1086654508.db2.gz RAJKGKNZGWLHDN-FPLPWBNLSA-N 1 3 335.536 2.999 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2ccccc2)[C@H]1C ZINC001571465915 1086840853 /nfs/dbraw/zinc/84/08/53/1086840853.db2.gz MVVFTTPMXCERGV-IEBWSBKVSA-N 1 3 331.504 2.540 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CCCCCF)CN1C(=O)CN(C)CC(C)(C)C ZINC001571487593 1086876619 /nfs/dbraw/zinc/87/66/19/1086876619.db2.gz UPXCXLQILFELGB-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)[C@H](C(=O)N1C[C@H]([NH2+]CCCCCF)C(C)(C)C1)N(C)C ZINC001571567149 1086967067 /nfs/dbraw/zinc/96/70/67/1086967067.db2.gz HSWXSIHUCCJVDO-JKSUJKDBSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)N(CCN(C)CC1=CCCCC1)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001571616155 1086988665 /nfs/dbraw/zinc/98/86/65/1086988665.db2.gz SLOVUVHQALZYNZ-LJQANCHMSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)N(CCN(C)CC1=CCCCC1)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001571616155 1086988672 /nfs/dbraw/zinc/98/86/72/1086988672.db2.gz SLOVUVHQALZYNZ-LJQANCHMSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)(C)[C@H](CNCCF)NC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001571630313 1087001388 /nfs/dbraw/zinc/00/13/88/1087001388.db2.gz FBULLQSFWCFOKB-IRXDYDNUSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)(C)[C@H](CNCCF)NC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001571630313 1087001393 /nfs/dbraw/zinc/00/13/93/1087001393.db2.gz FBULLQSFWCFOKB-IRXDYDNUSA-N 1 3 341.515 2.874 10 0 EFAEHO CCCC[NH2+][C@@H]1CN(C(=O)CN(C)C2CCC2)CC[C@H]1C(F)(F)F ZINC001571652091 1087023077 /nfs/dbraw/zinc/02/30/77/1087023077.db2.gz HYAQEOQREBJORP-HUUCEWRRSA-N 1 3 349.441 2.640 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N(CCN(C)C)Cc3ccsc3)C[N@@H+]2C1 ZINC001646974725 1088692167 /nfs/dbraw/zinc/69/21/67/1088692167.db2.gz PESFLDQRSREBQT-KBAYOESNSA-N 1 3 349.544 2.759 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N(CCN(C)C)Cc3ccsc3)C[N@H+]2C1 ZINC001646974725 1088692174 /nfs/dbraw/zinc/69/21/74/1088692174.db2.gz PESFLDQRSREBQT-KBAYOESNSA-N 1 3 349.544 2.759 10 0 EFAEHO CCN(C(=O)C[NH2+]CC(C)C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC001647248397 1089162127 /nfs/dbraw/zinc/16/21/27/1089162127.db2.gz HPPVTDBZBNGBEJ-IEBWSBKVSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)CCC[NH2+][C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001266970581 1092217143 /nfs/dbraw/zinc/21/71/43/1092217143.db2.gz FLAZODPQFCVQLT-CRAIPNDOSA-N 1 3 329.504 2.729 10 0 EFAEHO C[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1=CCCCC1 ZINC001266971674 1092222356 /nfs/dbraw/zinc/22/23/56/1092222356.db2.gz NYTSWSFSOMXOOJ-DNVCBOLYSA-N 1 3 339.499 2.794 10 0 EFAEHO Cc1cc(CNCCN(C)C(=O)[C@H]2CCC[C@H]([NH+](C)C)C2)cs1 ZINC001266979707 1092232861 /nfs/dbraw/zinc/23/28/61/1092232861.db2.gz IKVRAJRRRCIPPD-IRXDYDNUSA-N 1 3 337.533 2.725 10 0 EFAEHO CN(CC(=O)N1CCC[C@H]1C[NH2+]CCC1=CCCCC1)C1CCC1 ZINC001671309070 1092385562 /nfs/dbraw/zinc/38/55/62/1092385562.db2.gz XUPMTYNGQGMXIQ-IBGZPJMESA-N 1 3 333.520 2.942 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@H]([NH2+]CCCCC(F)(F)F)C1 ZINC001267026550 1092398904 /nfs/dbraw/zinc/39/89/04/1092398904.db2.gz PPALERBMIYRJML-LSDHHAIUSA-N 1 3 349.441 2.784 10 0 EFAEHO CC[N@H+](CCCNC(=O)C1(N(C)C)CCC1)CC1CC2(CCC2)C1 ZINC001649436637 1092457695 /nfs/dbraw/zinc/45/76/95/1092457695.db2.gz GSDCWQBCTGWPTE-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[N@@H+](CCCNC(=O)C1(N(C)C)CCC1)CC1CC2(CCC2)C1 ZINC001649436637 1092457702 /nfs/dbraw/zinc/45/77/02/1092457702.db2.gz GSDCWQBCTGWPTE-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](C[NH2+]CCCc2cccc(F)c2)C1)N(C)C ZINC001267059085 1092498370 /nfs/dbraw/zinc/49/83/70/1092498370.db2.gz SFWKZUALRXXTQK-MJGOQNOKSA-N 1 3 349.494 2.537 10 0 EFAEHO Cc1n[nH]c(C)c1C(C)C(=O)NCc1ccc(CC[NH2+]CCF)cc1 ZINC001267097974 1092693645 /nfs/dbraw/zinc/69/36/45/1092693645.db2.gz AVGXRBWCZKAAGX-CYBMUJFWSA-N 1 3 346.450 2.548 10 0 EFAEHO CCC[NH2+]CCc1ccc(CNC(=O)CN2[C@H](C)CC[C@H]2C)cc1 ZINC001267098448 1092697241 /nfs/dbraw/zinc/69/72/41/1092697241.db2.gz QTYIAIXRRXURQU-IAGOWNOFSA-N 1 3 331.504 2.718 10 0 EFAEHO Cc1ccc(F)c(C[N@@H+](CCCNC(=O)CN2CCCC2)C(C)C)c1 ZINC001267340842 1093619446 /nfs/dbraw/zinc/61/94/46/1093619446.db2.gz PHYMCYLXGMOBSA-UHFFFAOYSA-N 1 3 349.494 2.947 10 0 EFAEHO Cc1ccc(F)c(C[N@H+](CCCNC(=O)CN2CCCC2)C(C)C)c1 ZINC001267340842 1093619456 /nfs/dbraw/zinc/61/94/56/1093619456.db2.gz PHYMCYLXGMOBSA-UHFFFAOYSA-N 1 3 349.494 2.947 10 0 EFAEHO CN(CCNCc1cccc(F)c1)C(=O)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001267384544 1094441933 /nfs/dbraw/zinc/44/19/33/1094441933.db2.gz WQLYDWZFWZLKBY-IBGZPJMESA-N 1 3 347.478 2.781 10 0 EFAEHO CN(CCNCc1cccc(F)c1)C(=O)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001267384544 1094441938 /nfs/dbraw/zinc/44/19/38/1094441938.db2.gz WQLYDWZFWZLKBY-IBGZPJMESA-N 1 3 347.478 2.781 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@H+](CCCCC(F)(F)F)C1)C1CCC1 ZINC001481095346 1094459030 /nfs/dbraw/zinc/45/90/30/1094459030.db2.gz IFUPPTIZUVFJOF-CQSZACIVSA-N 1 3 349.441 2.641 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@@H+](CCCCC(F)(F)F)C1)C1CCC1 ZINC001481095346 1094459034 /nfs/dbraw/zinc/45/90/34/1094459034.db2.gz IFUPPTIZUVFJOF-CQSZACIVSA-N 1 3 349.441 2.641 10 0 EFAEHO CN(CC[NH2+]CCC(C)(C)C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001267429315 1094515023 /nfs/dbraw/zinc/51/50/23/1094515023.db2.gz WZPMBLPAYGEGNM-SFHVURJKSA-N 1 3 329.504 2.683 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001481462763 1094713023 /nfs/dbraw/zinc/71/30/23/1094713023.db2.gz VXZHEYIVSKIYNK-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001481462763 1094713036 /nfs/dbraw/zinc/71/30/36/1094713036.db2.gz VXZHEYIVSKIYNK-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@H+](Cc2ccc(C)cc2C)C1)N(C)C ZINC001481119317 1094736348 /nfs/dbraw/zinc/73/63/48/1094736348.db2.gz SYJRRJPBOKDIEQ-IEBWSBKVSA-N 1 3 331.504 2.582 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@@H+](Cc2ccc(C)cc2C)C1)N(C)C ZINC001481119317 1094736360 /nfs/dbraw/zinc/73/63/60/1094736360.db2.gz SYJRRJPBOKDIEQ-IEBWSBKVSA-N 1 3 331.504 2.582 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]Cc1ccccc1C1CC1 ZINC001267473635 1094763232 /nfs/dbraw/zinc/76/32/32/1094763232.db2.gz HUGSMSOOPNYVRX-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO Cc1cccc(C)c1C[N@H+]1CC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001481127144 1094854512 /nfs/dbraw/zinc/85/45/12/1094854512.db2.gz PCJSAJAZEHNRIR-SFHVURJKSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+]1CC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001481127144 1094854525 /nfs/dbraw/zinc/85/45/25/1094854525.db2.gz PCJSAJAZEHNRIR-SFHVURJKSA-N 1 3 331.504 2.582 10 0 EFAEHO CCC[N@H+](CCNC(=O)C1(N(C)C)CCC1)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001481137618 1094922310 /nfs/dbraw/zinc/92/23/10/1094922310.db2.gz TYIXKFJPNAEFGR-FGTMMUONSA-N 1 3 335.536 2.735 10 0 EFAEHO CCC[N@@H+](CCNC(=O)C1(N(C)C)CCC1)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001481137618 1094922327 /nfs/dbraw/zinc/92/23/27/1094922327.db2.gz TYIXKFJPNAEFGR-FGTMMUONSA-N 1 3 335.536 2.735 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1CC[C@@H](C)C1)CC1CCC(C)CC1 ZINC001481147680 1094977399 /nfs/dbraw/zinc/97/73/99/1094977399.db2.gz JEWPTHRZERJSGU-JLAWEPINSA-N 1 3 337.552 2.983 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1CC[C@@H](C)C1)CC1CCC(C)CC1 ZINC001481147680 1094977406 /nfs/dbraw/zinc/97/74/06/1094977406.db2.gz JEWPTHRZERJSGU-JLAWEPINSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@H+](C)CC2CCC(C)CC2)C1 ZINC001481507630 1094992219 /nfs/dbraw/zinc/99/22/19/1094992219.db2.gz CTUFVXHCONDATH-ACBHZAAOSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@@H+](C)CC2CCC(C)CC2)C1 ZINC001481507630 1094992229 /nfs/dbraw/zinc/99/22/29/1094992229.db2.gz CTUFVXHCONDATH-ACBHZAAOSA-N 1 3 337.552 2.933 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001481510097 1095007521 /nfs/dbraw/zinc/00/75/21/1095007521.db2.gz TXYMCUBIQILTSW-SJLPKXTDSA-N 1 3 349.494 2.890 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001481510097 1095007536 /nfs/dbraw/zinc/00/75/36/1095007536.db2.gz TXYMCUBIQILTSW-SJLPKXTDSA-N 1 3 349.494 2.890 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NC[C@H](NCC2=CCCCC2)c2ccccc2)C1 ZINC001267526538 1095306880 /nfs/dbraw/zinc/30/68/80/1095306880.db2.gz VXFFDNVXYLQUER-PMACEKPBSA-N 1 3 341.499 2.886 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NC[C@H](NCC2=CCCCC2)c2ccccc2)C1 ZINC001267526538 1095306890 /nfs/dbraw/zinc/30/68/90/1095306890.db2.gz VXFFDNVXYLQUER-PMACEKPBSA-N 1 3 341.499 2.886 10 0 EFAEHO C[C@@H](C[NH2+]CC[C@H]1CCc2ccccc21)N(C)C(=O)CN1CCCC1 ZINC001268099026 1095350778 /nfs/dbraw/zinc/35/07/78/1095350778.db2.gz BEZIBUVWFBOFPU-PKOBYXMFSA-N 1 3 343.515 2.639 10 0 EFAEHO CC[C@H](F)C[NH2+]CC[C@@H]1CCCCN1C(=O)CN(C)C1CCC1 ZINC001268152966 1095545550 /nfs/dbraw/zinc/54/55/50/1095545550.db2.gz BPTUKKHUVPQQRS-RDJZCZTQSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+]CC[C@H]1CCCCN1C(=O)Cc1c[nH]cn1 ZINC001268162057 1095596121 /nfs/dbraw/zinc/59/61/21/1095596121.db2.gz SUCHRWWCZCXRFH-FUHWJXTLSA-N 1 3 334.508 2.995 10 0 EFAEHO CCN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1ccc(C)c(F)c1 ZINC001480991953 1095692851 /nfs/dbraw/zinc/69/28/51/1095692851.db2.gz ILGJWDBWJVESDD-UHFFFAOYSA-N 1 3 349.494 2.947 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[N@H+](C)C1)Cc1ccc(C(C)C)cc1 ZINC001481016741 1095865375 /nfs/dbraw/zinc/86/53/75/1095865375.db2.gz RJIDDWPRUBQQCW-IBGZPJMESA-N 1 3 331.504 2.700 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[N@@H+](C)C1)Cc1ccc(C(C)C)cc1 ZINC001481016741 1095865388 /nfs/dbraw/zinc/86/53/88/1095865388.db2.gz RJIDDWPRUBQQCW-IBGZPJMESA-N 1 3 331.504 2.700 10 0 EFAEHO CCC(CC)C[NH+]1CC(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001481644247 1096132845 /nfs/dbraw/zinc/13/28/45/1096132845.db2.gz DBZFCZMRRNDUDL-IBGZPJMESA-N 1 3 341.515 2.683 10 0 EFAEHO CC1CCC(C[NH+]2CC(CNC(=O)CN(C)CC(C)(C)C)C2)CC1 ZINC001481644521 1096137424 /nfs/dbraw/zinc/13/74/24/1096137424.db2.gz LWDZVXDJLXANBA-UHFFFAOYSA-N 1 3 337.552 2.839 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)CC[C@H]21 ZINC001268263802 1096200632 /nfs/dbraw/zinc/20/06/32/1096200632.db2.gz BZYCDWKMNCQNMM-WEPWYQGCSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)CC[C@H]21 ZINC001268263802 1096200643 /nfs/dbraw/zinc/20/06/43/1096200643.db2.gz BZYCDWKMNCQNMM-WEPWYQGCSA-N 1 3 347.547 2.997 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NCC1CN([C@H]2CCc3ccccc32)C1 ZINC001481669015 1096273908 /nfs/dbraw/zinc/27/39/08/1096273908.db2.gz CASNLJLVKWZTQN-FQEVSTJZSA-N 1 3 341.499 2.598 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@@H]2CCN(CCCCCF)C2)CCCCC1 ZINC001481704689 1096343635 /nfs/dbraw/zinc/34/36/35/1096343635.db2.gz IYIBXEAKQAUNTP-QGZVFWFLSA-N 1 3 341.515 2.829 10 0 EFAEHO C[C@@H](CC[NH2+]CCc1ccccc1)NC(=O)C(C)(C)N1CCCCC1 ZINC001268366966 1096397782 /nfs/dbraw/zinc/39/77/82/1096397782.db2.gz PYQALTPVJPCSIT-SFHVURJKSA-N 1 3 345.531 2.978 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]CCc1ccccc1 ZINC001268368648 1096402934 /nfs/dbraw/zinc/40/29/34/1096402934.db2.gz ZWDUQQUDJOVANN-HKUYNNGSSA-N 1 3 331.504 2.586 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001268372103 1096410784 /nfs/dbraw/zinc/41/07/84/1096410784.db2.gz BNTWFVYFYZKIOV-WFASDCNBSA-N 1 3 345.940 2.972 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccccc1Cl)NC(=O)CN1CC[C@H](C)C1 ZINC001268399709 1096492620 /nfs/dbraw/zinc/49/26/20/1096492620.db2.gz KBHIIHFRRQFKSS-GJZGRUSLSA-N 1 3 337.895 2.666 10 0 EFAEHO CN(C(=O)C[C@H]1CC[N@H+](C)C1)[C@H]1CCN(CCCCC(F)(F)F)C1 ZINC001481747172 1096509068 /nfs/dbraw/zinc/50/90/68/1096509068.db2.gz NHFXTTLYLSFVJG-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO CN(C(=O)C[C@H]1CC[N@@H+](C)C1)[C@H]1CCN(CCCCC(F)(F)F)C1 ZINC001481747172 1096509075 /nfs/dbraw/zinc/50/90/75/1096509075.db2.gz NHFXTTLYLSFVJG-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(C(=O)[C@@H]1CCCN1C(C)C)[C@H]1CC[N@H+](CCCCCF)C1 ZINC001481766586 1096642673 /nfs/dbraw/zinc/64/26/73/1096642673.db2.gz MIDQQQURTNSUDX-ROUUACIJSA-N 1 3 341.515 2.922 10 0 EFAEHO CCN(C(=O)[C@@H]1CCCN1C(C)C)[C@H]1CC[N@@H+](CCCCCF)C1 ZINC001481766586 1096642675 /nfs/dbraw/zinc/64/26/75/1096642675.db2.gz MIDQQQURTNSUDX-ROUUACIJSA-N 1 3 341.515 2.922 10 0 EFAEHO CCN(C(=O)[C@H]1CCCN1C(C)C)[C@@H]1CC[N@H+](CCCCCF)C1 ZINC001481766585 1096642747 /nfs/dbraw/zinc/64/27/47/1096642747.db2.gz MIDQQQURTNSUDX-QZTJIDSGSA-N 1 3 341.515 2.922 10 0 EFAEHO CCN(C(=O)[C@H]1CCCN1C(C)C)[C@@H]1CC[N@@H+](CCCCCF)C1 ZINC001481766585 1096642752 /nfs/dbraw/zinc/64/27/52/1096642752.db2.gz MIDQQQURTNSUDX-QZTJIDSGSA-N 1 3 341.515 2.922 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(F)cc1C)C(=O)CN(C)C1CCC1 ZINC001268453333 1096671642 /nfs/dbraw/zinc/67/16/42/1096671642.db2.gz IUYPGZLLARGEDC-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]CCc1ccccc1F ZINC001481811464 1096736826 /nfs/dbraw/zinc/73/68/26/1096736826.db2.gz SKAIBCLTLHFQON-MJGOQNOKSA-N 1 3 349.494 2.725 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCc1cccs1 ZINC001481838398 1096775438 /nfs/dbraw/zinc/77/54/38/1096775438.db2.gz BIAPCNUKVSSLAD-OAHLLOKOSA-N 1 3 337.533 2.649 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc(F)cc1 ZINC001481838616 1096776910 /nfs/dbraw/zinc/77/69/10/1096776910.db2.gz DMEMVVIMVBIZTD-KRWDZBQOSA-N 1 3 335.467 2.685 10 0 EFAEHO CCN(CCNC/C=C/Cl)C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001268466828 1096794240 /nfs/dbraw/zinc/79/42/40/1096794240.db2.gz AYLBHCRPAXZLFT-DHZHZOJOSA-N 1 3 329.916 2.689 10 0 EFAEHO CCN(CC[NH2+]C[C@@H]1CCCC(F)(F)C1)C(=O)[C@@H](C(C)C)N(C)C ZINC001268476113 1096878545 /nfs/dbraw/zinc/87/85/45/1096878545.db2.gz FDPIMCCDXPRAQV-HZPDHXFCSA-N 1 3 347.494 2.836 10 0 EFAEHO CCN(CC[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)CN1CCC(C)CC1 ZINC001268486826 1096938607 /nfs/dbraw/zinc/93/86/07/1096938607.db2.gz MZURWEVMKWAMMX-QRVBRYPASA-N 1 3 335.536 2.593 10 0 EFAEHO CCN(CC[NH2+]C[C@H]1CCCC(F)(F)C1)C(=O)CN(C)C(C)C ZINC001268499056 1096994239 /nfs/dbraw/zinc/99/42/39/1096994239.db2.gz DZNYNQLDXQLUON-HNNXBMFYSA-N 1 3 333.467 2.590 10 0 EFAEHO CC1CC(C[NH2+]CC[C@@H]2CCCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001481976632 1097034248 /nfs/dbraw/zinc/03/42/48/1097034248.db2.gz KHNWYTLJNDZGCY-ADKAHSJRSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)CC[NH2+]CC[C@H]1CCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001481976420 1097034607 /nfs/dbraw/zinc/03/46/07/1097034607.db2.gz IWZQRLSSGAQYLV-MSOLQXFVSA-N 1 3 325.541 2.837 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H](CC[NH2+]C/C=C/Cl)C1 ZINC001481990434 1097054891 /nfs/dbraw/zinc/05/48/91/1097054891.db2.gz AAVYMKHWEROZHF-HYMNUWHNSA-N 1 3 341.927 2.832 10 0 EFAEHO CC/C=C\CC[NH2+]CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001482003567 1097076752 /nfs/dbraw/zinc/07/67/52/1097076752.db2.gz GTQWGLPYNQTSSL-PYTPGESOSA-N 1 3 335.536 2.903 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC(CC[NH2+]Cc2ccsc2)CC1 ZINC001482003695 1097077385 /nfs/dbraw/zinc/07/73/85/1097077385.db2.gz NGCLAQRRGCTGJU-QGZVFWFLSA-N 1 3 335.517 2.561 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(CC[NH2+]Cc2ccc(F)cc2)CC1 ZINC001482006746 1097084208 /nfs/dbraw/zinc/08/42/08/1097084208.db2.gz IHLUWZLIONMGJO-UHFFFAOYSA-N 1 3 349.494 2.886 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC(CC[NH2+]CCCF)CC2)c1 ZINC001482008293 1097087129 /nfs/dbraw/zinc/08/71/29/1097087129.db2.gz NNFIKEMVXWDKKL-UHFFFAOYSA-N 1 3 349.494 2.940 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCc2ccc(CNC/C=C/Cl)cc2)CC[N@@H+]1C ZINC001482031504 1097121227 /nfs/dbraw/zinc/12/12/27/1097121227.db2.gz PRQXNHOHOCHBLG-XVSUHRFUSA-N 1 3 349.906 2.875 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCc2ccc(CNC/C=C/Cl)cc2)CC[N@H+]1C ZINC001482031504 1097121229 /nfs/dbraw/zinc/12/12/29/1097121229.db2.gz PRQXNHOHOCHBLG-XVSUHRFUSA-N 1 3 349.906 2.875 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)[C@@H]2CCC[N@H+]2C(C)C)c(C)s1 ZINC001268541766 1097155499 /nfs/dbraw/zinc/15/54/99/1097155499.db2.gz LWWQCZUSKAUNIG-QWNKOJSDSA-N 1 3 349.544 3.000 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)[C@@H]2CCC[N@@H+]2C(C)C)c(C)s1 ZINC001268541766 1097155501 /nfs/dbraw/zinc/15/55/01/1097155501.db2.gz LWWQCZUSKAUNIG-QWNKOJSDSA-N 1 3 349.544 3.000 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H]1CCCN1C(=O)C(C)(C)N1CCCCC1 ZINC001482055837 1097193489 /nfs/dbraw/zinc/19/34/89/1097193489.db2.gz ISTIRBUFTCWJNX-JKSUJKDBSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)C[NH2+]CC1CC2(CCC2)C1 ZINC001482101711 1097262046 /nfs/dbraw/zinc/26/20/46/1097262046.db2.gz PCTWQZUCWHMRSQ-SJLPKXTDSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\C[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001268587302 1097306329 /nfs/dbraw/zinc/30/63/29/1097306329.db2.gz IKTDYBQRGOVREA-ILNYKDOHSA-N 1 3 345.478 2.660 10 0 EFAEHO Cc1cc(Cl)ccc1CNC/C=C/CNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001268612618 1097461822 /nfs/dbraw/zinc/46/18/22/1097461822.db2.gz GXCXXANCAJGHMU-CWDCEQMOSA-N 1 3 349.906 2.752 10 0 EFAEHO Cc1cc(Cl)ccc1CNC/C=C/CNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001268612618 1097461825 /nfs/dbraw/zinc/46/18/25/1097461825.db2.gz GXCXXANCAJGHMU-CWDCEQMOSA-N 1 3 349.906 2.752 10 0 EFAEHO CC[C@H](C(=O)NC/C=C/C[NH2+][C@H](C)c1ccc2c(c1)CCC2)N(C)C ZINC001268615995 1097465116 /nfs/dbraw/zinc/46/51/16/1097465116.db2.gz FKFBVJHAUYJIER-BGJVTSJYSA-N 1 3 343.515 2.839 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/C[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001268619351 1097470122 /nfs/dbraw/zinc/47/01/22/1097470122.db2.gz ZTNCRYWAJFSEKY-UEKDZROGSA-N 1 3 342.487 2.516 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NC/C=C/CNCc1ccc(Cl)cc1 ZINC001268628571 1097482033 /nfs/dbraw/zinc/48/20/33/1097482033.db2.gz OEGNZTXEBANAML-OBMMGQTPSA-N 1 3 349.906 2.975 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\CNCc1cccc(F)c1)[NH+]1CCCC1 ZINC001268630149 1097483961 /nfs/dbraw/zinc/48/39/61/1097483961.db2.gz GFPHLJFFQDMGEB-LLHWWHOWSA-N 1 3 347.478 2.708 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@H](C)NC(=O)[C@H]1CCCN1C(C)C ZINC001268689067 1097542867 /nfs/dbraw/zinc/54/28/67/1097542867.db2.gz QVCKQACXDSYFHB-FXAWDEMLSA-N 1 3 345.531 2.759 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CCCc1cccc(F)c1 ZINC001268689311 1097543097 /nfs/dbraw/zinc/54/30/97/1097543097.db2.gz VLNSFZZCUPIACG-LPHOPBHVSA-N 1 3 349.494 2.725 10 0 EFAEHO CC(C)Oc1ccccc1C[NH2+]CCCN(C)C(=O)[C@H]1CCCN1C ZINC001268783351 1097633079 /nfs/dbraw/zinc/63/30/79/1097633079.db2.gz HPMRONWBMSQBBF-GOSISDBHSA-N 1 3 347.503 2.506 10 0 EFAEHO CN(CCC[NH2+]Cc1sccc1Cl)C(=O)[C@@H]1CCCCN1C ZINC001268810524 1097656673 /nfs/dbraw/zinc/65/66/73/1097656673.db2.gz GQSAVJPMGWKIAC-AWEZNQCLSA-N 1 3 343.924 2.824 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+][C@@H]1CCc2ccc(F)cc21)N(C)C ZINC001268915006 1097723602 /nfs/dbraw/zinc/72/36/02/1097723602.db2.gz HHSABMBFVCBBOW-QZTJIDSGSA-N 1 3 335.467 2.591 10 0 EFAEHO CCCCCN1C[C@@H]2C[C@H]1CN2C(=O)C1CC[NH+](CC2CC2)CC1 ZINC001268978523 1097767568 /nfs/dbraw/zinc/76/75/68/1097767568.db2.gz CKULMBYSIDQJKN-OALUTQOASA-N 1 3 333.520 2.584 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@@H]2C[C@H]1CN2CCC1=CCCCC1 ZINC001268983882 1097770259 /nfs/dbraw/zinc/77/02/59/1097770259.db2.gz JYLUAUDFURDSSZ-OALUTQOASA-N 1 3 333.520 2.894 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@@H]2C[C@H]1CN2CCC1=CCCCC1 ZINC001268983882 1097770263 /nfs/dbraw/zinc/77/02/63/1097770263.db2.gz JYLUAUDFURDSSZ-OALUTQOASA-N 1 3 333.520 2.894 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@@](C)(C[NH2+]CC=C(Cl)Cl)C2CC2)C1 ZINC001269633797 1098311993 /nfs/dbraw/zinc/31/19/93/1098311993.db2.gz GAHSGKSEDHVWEJ-LRDDRELGSA-N 1 3 348.318 2.522 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001269740366 1098413502 /nfs/dbraw/zinc/41/35/02/1098413502.db2.gz DYPBTZJQEFFRMI-ICSRJNTNSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCCC[N@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001269740366 1098413508 /nfs/dbraw/zinc/41/35/08/1098413508.db2.gz DYPBTZJQEFFRMI-ICSRJNTNSA-N 1 3 335.536 2.833 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269742166 1098416566 /nfs/dbraw/zinc/41/65/66/1098416566.db2.gz QUPXOBOJWIVWAW-LAYSSIRVSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269742166 1098416570 /nfs/dbraw/zinc/41/65/70/1098416570.db2.gz QUPXOBOJWIVWAW-LAYSSIRVSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[NH+]1CC2(C1)CCN(C(=O)CN1CC[C@H](C)C1)CC2 ZINC001482245237 1098467743 /nfs/dbraw/zinc/46/77/43/1098467743.db2.gz UHNWPTLTDUCIBB-XDXAGZTOSA-N 1 3 333.520 2.609 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[C@H]([NH2+]CCCc2ccccc2)CC1)N(C)C ZINC001269997033 1098581510 /nfs/dbraw/zinc/58/15/10/1098581510.db2.gz AEUPTYFVSTWQTL-VAMGGRTRSA-N 1 3 345.531 2.976 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@@H]1CCCN1C(=O)[C@H]1CCCN1C ZINC001270022117 1098602985 /nfs/dbraw/zinc/60/29/85/1098602985.db2.gz KXEFNJIKVUIKOZ-VQTJNVASSA-N 1 3 343.515 2.602 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC(CC[NH2+]CC[C@@H](C)F)CC1)N(C)C ZINC001267914352 1098614288 /nfs/dbraw/zinc/61/42/88/1098614288.db2.gz HAEFCSWKOZAPRB-NVXWUHKLSA-N 1 3 329.504 2.539 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(CC[NH2+]CC3CCCC3)CC2)C1 ZINC001267914578 1098623868 /nfs/dbraw/zinc/62/38/68/1098623868.db2.gz KIJPXHFPGACTET-QGZVFWFLSA-N 1 3 335.536 2.737 10 0 EFAEHO Cc1cc(C[NH2+]CCN(C)C(=O)CN(C)CC(C)(C)C)cs1 ZINC001481280054 1098637967 /nfs/dbraw/zinc/63/79/67/1098637967.db2.gz SXIIEHBLLOKRFP-UHFFFAOYSA-N 1 3 325.522 2.582 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C(=O)[C@H]1CCCN1C ZINC001482265469 1098699673 /nfs/dbraw/zinc/69/96/73/1098699673.db2.gz HHKKPZCXDDXLNU-OXQOHEQNSA-N 1 3 343.515 2.985 10 0 EFAEHO Cc1cccc(CCC[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001270194565 1098788996 /nfs/dbraw/zinc/78/89/96/1098788996.db2.gz UFATZJAABZBDNV-HXUWFJFHSA-N 1 3 345.531 2.848 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[NH2+]C/C=C\c1ccccc1)N(C)C ZINC001270228826 1098831985 /nfs/dbraw/zinc/83/19/85/1098831985.db2.gz RIAZBNUUPWMNLS-RCQSFFKASA-N 1 3 329.488 2.621 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@@H]1C[NH2+]CCCCc1ccccc1 ZINC001267961148 1098924875 /nfs/dbraw/zinc/92/48/75/1098924875.db2.gz XFGGLMIIGJKTCJ-WOJBJXKFSA-N 1 3 343.515 2.684 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@@H]1C[NH2+]CCc1cccs1 ZINC001267969222 1098984944 /nfs/dbraw/zinc/98/49/44/1098984944.db2.gz IJLVQGBWZSMAAG-AEFFLSMTSA-N 1 3 349.544 2.746 10 0 EFAEHO CN(CCNCc1cc2ccccc2o1)C(=O)C12CCC[NH+]1CCC2 ZINC001481251119 1099001215 /nfs/dbraw/zinc/00/12/15/1099001215.db2.gz DQFUMMYBLRUBKY-UHFFFAOYSA-N 1 3 341.455 2.609 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001482285185 1099039165 /nfs/dbraw/zinc/03/91/65/1099039165.db2.gz UQTHKOBTLBTASH-CRAIPNDOSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001482285185 1099039176 /nfs/dbraw/zinc/03/91/76/1099039176.db2.gz UQTHKOBTLBTASH-CRAIPNDOSA-N 1 3 335.467 2.635 10 0 EFAEHO O=C(N[C@@H](CNCCF)C1CCCC1)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001270404254 1099059625 /nfs/dbraw/zinc/05/96/25/1099059625.db2.gz VDLXSRLAYQPWLV-ZWKOTPCHSA-N 1 3 339.499 2.628 10 0 EFAEHO O=C(N[C@@H](CNCCF)C1CCCC1)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001270404254 1099059637 /nfs/dbraw/zinc/05/96/37/1099059637.db2.gz VDLXSRLAYQPWLV-ZWKOTPCHSA-N 1 3 339.499 2.628 10 0 EFAEHO O=C(N[C@H](CNCCF)C1CCCC1)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001270404251 1099060304 /nfs/dbraw/zinc/06/03/04/1099060304.db2.gz VDLXSRLAYQPWLV-MSOLQXFVSA-N 1 3 339.499 2.628 10 0 EFAEHO O=C(N[C@H](CNCCF)C1CCCC1)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001270404251 1099060313 /nfs/dbraw/zinc/06/03/13/1099060313.db2.gz VDLXSRLAYQPWLV-MSOLQXFVSA-N 1 3 339.499 2.628 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H](C)N(C)C(=O)CN(C)C2CCC2)c1 ZINC001482293288 1099152797 /nfs/dbraw/zinc/15/27/97/1099152797.db2.gz UTNCVRMIGALVKN-OAHLLOKOSA-N 1 3 335.467 2.555 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@]2(C1)CCCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001270512523 1099160499 /nfs/dbraw/zinc/16/04/99/1099160499.db2.gz JAELDHXWONBUHZ-LJQANCHMSA-N 1 3 332.492 2.847 10 0 EFAEHO CCCCC[N@H+]1CC[C@@]2(C1)CCCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001270512523 1099160503 /nfs/dbraw/zinc/16/05/03/1099160503.db2.gz JAELDHXWONBUHZ-LJQANCHMSA-N 1 3 332.492 2.847 10 0 EFAEHO CN(CCNCc1cccc(F)c1)C(=O)CCC[NH+]1CCCCC1 ZINC001481318335 1099267250 /nfs/dbraw/zinc/26/72/50/1099267250.db2.gz ZKYIFBHTRDYZFB-UHFFFAOYSA-N 1 3 335.467 2.640 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]Cc1ccc(Cl)cc1 ZINC001481320219 1099278838 /nfs/dbraw/zinc/27/88/38/1099278838.db2.gz WWKNJVBIJZALGE-KRWDZBQOSA-N 1 3 337.895 2.762 10 0 EFAEHO CCCC[NH2+][C@@H](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001481341374 1099376962 /nfs/dbraw/zinc/37/69/62/1099376962.db2.gz HAKLZOAMOXQGAC-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H](C[NH2+]C/C=C/c1ccc(Cl)cc1)N(C)C(=O)[C@H]1CCCN1C ZINC001482318951 1099479240 /nfs/dbraw/zinc/47/92/40/1099479240.db2.gz HUBHSZYAYXYZIP-IWAYODKASA-N 1 3 349.906 2.884 10 0 EFAEHO CN(CC(=O)N1CC[C@](C)(C[NH2+]CC2=CCCCC2)C1)C1CCC1 ZINC001270736891 1099506058 /nfs/dbraw/zinc/50/60/58/1099506058.db2.gz DCLWCBPDTWATJY-HXUWFJFHSA-N 1 3 333.520 2.799 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC(C)C1)N(CC)CC ZINC001481385817 1099551244 /nfs/dbraw/zinc/55/12/44/1099551244.db2.gz YMUWWCWWUDMPRK-DUBPFDJUSA-N 1 3 335.536 2.828 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC(C)C1)N(CC)CC ZINC001481385817 1099551255 /nfs/dbraw/zinc/55/12/55/1099551255.db2.gz YMUWWCWWUDMPRK-DUBPFDJUSA-N 1 3 335.536 2.828 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@](C)(C[NH2+]CCc2ccccc2F)C1)N(C)C ZINC001270796093 1099567964 /nfs/dbraw/zinc/56/79/64/1099567964.db2.gz CPWXQYFQOIAMHU-ICSRJNTNSA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001270796644 1099569752 /nfs/dbraw/zinc/56/97/52/1099569752.db2.gz IHFVEQYDHNWEPQ-CRAIPNDOSA-N 1 3 329.504 2.541 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NC2(C[NH2+]CCCF)CCCC2)c1 ZINC001267846702 1099617924 /nfs/dbraw/zinc/61/79/24/1099617924.db2.gz JWSCPGBQKZUOHI-UHFFFAOYSA-N 1 3 335.467 2.740 10 0 EFAEHO CN1CC2(C[C@H]1C(=O)N1CCCC1)CC[NH+](Cc1cccs1)CC2 ZINC000675010053 1099624326 /nfs/dbraw/zinc/62/43/26/1099624326.db2.gz HJALKINBUKLWSQ-KRWDZBQOSA-N 1 3 347.528 2.657 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@H](C)N(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001482330583 1099628267 /nfs/dbraw/zinc/62/82/67/1099628267.db2.gz KJNYQUBAFJSYCK-KJYTYGLYSA-N 1 3 341.515 2.992 10 0 EFAEHO Cc1cccnc1CNC[C@@H](C)N(C)C(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC001482336383 1099667004 /nfs/dbraw/zinc/66/70/04/1099667004.db2.gz HYAPBPMKIHWPAM-QZTJIDSGSA-N 1 3 346.519 2.591 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@H](CC[NH2+]Cc2cccc(F)c2)C1 ZINC001267883065 1099832776 /nfs/dbraw/zinc/83/27/76/1099832776.db2.gz XGEYKYWFEGPEEX-VQIMIIECSA-N 1 3 347.478 2.638 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@H](CC[NH2+]CC2CC3(CCC3)C2)C1 ZINC001267893531 1099894569 /nfs/dbraw/zinc/89/45/69/1099894569.db2.gz NWTCAWKOVHEATA-MRXNPFEDSA-N 1 3 344.503 2.751 10 0 EFAEHO CC(C)C[C@H](C[NH2+]C/C=C\Cl)NC(=O)[C@@H]1CCCN1C(C)C ZINC001482384314 1099968781 /nfs/dbraw/zinc/96/87/81/1099968781.db2.gz NWXUAXSBSKRADF-ICFKLAHKSA-N 1 3 329.916 2.732 10 0 EFAEHO CC(C)C[C@H](C[NH2+]Cc1cccnc1)NC(=O)C(C)(C)N1CCCC1 ZINC001482389843 1099982157 /nfs/dbraw/zinc/98/21/57/1099982157.db2.gz BCSJFCRJMOQNSG-GOSISDBHSA-N 1 3 346.519 2.577 10 0 EFAEHO CC(C)C[C@@H](CNCc1ccccc1F)NC(=O)C12CC[NH+](CC1)C2 ZINC001482396414 1100014353 /nfs/dbraw/zinc/01/43/53/1100014353.db2.gz LEPUMWSESDEQHV-KRWDZBQOSA-N 1 3 347.478 2.542 10 0 EFAEHO Cc1ccc(C[NH2+]CCC2CCN(C(=O)[C@@H]3CCCN3C)CC2)cc1 ZINC001267907121 1100029185 /nfs/dbraw/zinc/02/91/85/1100029185.db2.gz QSMFRJVQZUVAJN-FQEVSTJZSA-N 1 3 343.515 2.808 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N[C@H](CNCCF)C2CCCCC2)C1 ZINC001482410632 1100067997 /nfs/dbraw/zinc/06/79/97/1100067997.db2.gz YQIHTOYOJDVIGN-QZTJIDSGSA-N 1 3 341.515 2.733 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N[C@H](CNCCF)C2CCCCC2)C1 ZINC001482410632 1100068001 /nfs/dbraw/zinc/06/80/01/1100068001.db2.gz YQIHTOYOJDVIGN-QZTJIDSGSA-N 1 3 341.515 2.733 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCC(C)(C)C)[C@@H](C)C1 ZINC001482431751 1100179107 /nfs/dbraw/zinc/17/91/07/1100179107.db2.gz CKPFCLCZNVAERS-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CCCC(C)(C)C)[C@@H](C)C1 ZINC001482431765 1100179461 /nfs/dbraw/zinc/17/94/61/1100179461.db2.gz CKPFCLCZNVAERS-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO O=C(NCCN(CC1=CCCCC1)C1CC1)C12CCC[NH+](CCC1)C2 ZINC001266596433 1101331594 /nfs/dbraw/zinc/33/15/94/1101331594.db2.gz DVQPVLCJSADRCC-UHFFFAOYSA-N 1 3 345.531 2.943 10 0 EFAEHO CC[C@H]1CN(C(=O)C2(N(C)C)CCC2)CC[C@H]1[NH2+]CCCCCF ZINC001670580827 1101358669 /nfs/dbraw/zinc/35/86/69/1101358669.db2.gz BLSKTCRDZCEBHR-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C[NH2+]C/C=C\Cl)C1CCCCC1)N(C)C ZINC001271355613 1101432768 /nfs/dbraw/zinc/43/27/68/1101432768.db2.gz YFHDVFRSCLDKHM-RIDHJDLKSA-N 1 3 343.943 2.980 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)C2CCC2)CC[C@H]1[NH2+]CCCC1CCC1 ZINC001271405113 1101508306 /nfs/dbraw/zinc/50/83/06/1101508306.db2.gz STWCYSVQNORSKK-QFBILLFUSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001266619920 1101536807 /nfs/dbraw/zinc/53/68/07/1101536807.db2.gz FYSRSRZSTYWUHD-VAMGGRTRSA-N 1 3 345.531 2.751 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H]1CC[N@H+](CCC2=CCCCC2)C1 ZINC001266322365 1101547107 /nfs/dbraw/zinc/54/71/07/1101547107.db2.gz GFKGFWWVFNYMHL-QZTJIDSGSA-N 1 3 339.499 2.747 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H]1CC[N@@H+](CCC2=CCCCC2)C1 ZINC001266322365 1101547116 /nfs/dbraw/zinc/54/71/16/1101547116.db2.gz GFKGFWWVFNYMHL-QZTJIDSGSA-N 1 3 339.499 2.747 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1C[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001266639564 1101627140 /nfs/dbraw/zinc/62/71/40/1101627140.db2.gz CZYNZUBOKHGHBL-WGSAOQKQSA-N 1 3 331.504 2.505 10 0 EFAEHO Cc1ccccc1[C@H](C)N1CC[C@H]1CNC(=O)CCCC[NH+](C)C ZINC001670714668 1101636047 /nfs/dbraw/zinc/63/60/47/1101636047.db2.gz UGCADLXJDNQUFV-ROUUACIJSA-N 1 3 331.504 2.978 10 0 EFAEHO c1ccc(CN2CC3(C2)CN(Cc2ccc4c(c2)C[NH2+]CC4)C3)cc1 ZINC000706716572 1101656009 /nfs/dbraw/zinc/65/60/09/1101656009.db2.gz RPDHZWZRWSHSGS-UHFFFAOYSA-N 1 3 333.479 2.650 10 0 EFAEHO C[C@@H]1CCCN(C(=O)c2ccc(C[NH+](C)C)cc2)[C@@H]1CNCCF ZINC001482491242 1101951456 /nfs/dbraw/zinc/95/14/56/1101951456.db2.gz ACIVQKCSRGGRGA-CRAIPNDOSA-N 1 3 335.467 2.548 10 0 EFAEHO CCC[N@@H+]1CC[C@H](CN[C@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)C1 ZINC000693030715 1101987227 /nfs/dbraw/zinc/98/72/27/1101987227.db2.gz JHYNZISIDJVLDR-ZACQAIPSSA-N 1 3 339.524 2.953 10 0 EFAEHO CCC[N@H+]1CC[C@H](CN[C@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)C1 ZINC000693030715 1101987235 /nfs/dbraw/zinc/98/72/35/1101987235.db2.gz JHYNZISIDJVLDR-ZACQAIPSSA-N 1 3 339.524 2.953 10 0 EFAEHO CCCN1CC[C@H](C[NH2+][C@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)C1 ZINC000693030715 1101987243 /nfs/dbraw/zinc/98/72/43/1101987243.db2.gz JHYNZISIDJVLDR-ZACQAIPSSA-N 1 3 339.524 2.953 10 0 EFAEHO 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CCN1CCCC[C@H]1C(=O)N1CCC[C@H](C[N@H+](C)CC=C(C)C)C1 ZINC001266472136 1102215215 /nfs/dbraw/zinc/21/52/15/1102215215.db2.gz DAQXIVXFJTUSTE-MOPGFXCFSA-N 1 3 335.536 2.997 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@H](C[N@@H+](C)CC=C(C)C)C1 ZINC001266472136 1102215222 /nfs/dbraw/zinc/21/52/22/1102215222.db2.gz DAQXIVXFJTUSTE-MOPGFXCFSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)OCCC[NH2+][C@H]1CCCCCN(C(=O)CN(C)C(C)C)C1 ZINC001656909940 1102257666 /nfs/dbraw/zinc/25/76/66/1102257666.db2.gz TYGIGOPWFWPZAN-SFHVURJKSA-N 1 3 341.540 2.503 10 0 EFAEHO CC(C)CN1CCC[C@@H]1C(=O)N[C@H]1CC[N@H+](CCCCCF)[C@@H]1C ZINC001656969399 1102275545 /nfs/dbraw/zinc/27/55/45/1102275545.db2.gz ADUHXKRWRIRNQN-FGTMMUONSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CN1CCC[C@@H]1C(=O)N[C@H]1CC[N@@H+](CCCCCF)[C@@H]1C ZINC001656969399 1102275557 /nfs/dbraw/zinc/27/55/57/1102275557.db2.gz ADUHXKRWRIRNQN-FGTMMUONSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H]1CCCN(C(=O)CN(C)C2CCC2)[C@@H]1C[NH2+]CCC(F)(F)F ZINC001271714224 1102286710 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EFAEHO CC(C)=CC[NH2+]CCN(Cc1ccccc1)C(=O)CN1CC[C@@H](C)C1 ZINC001271819795 1102797405 /nfs/dbraw/zinc/79/74/05/1102797405.db2.gz UREVWGMJMAKJAJ-LJQANCHMSA-N 1 3 343.515 2.913 10 0 EFAEHO CC(C)[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001482531437 1102822413 /nfs/dbraw/zinc/82/24/13/1102822413.db2.gz ACYLOCGRAJHWKG-GJZGRUSLSA-N 1 3 345.478 2.637 10 0 EFAEHO CC[N@H+](CCCNC(=O)C1(N(C)C)CCC1)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001660537655 1102832573 /nfs/dbraw/zinc/83/25/73/1102832573.db2.gz YTOPWOOKICTKJJ-FGTMMUONSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[N@@H+](CCCNC(=O)C1(N(C)C)CCC1)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001660537655 1102832588 /nfs/dbraw/zinc/83/25/88/1102832588.db2.gz YTOPWOOKICTKJJ-FGTMMUONSA-N 1 3 335.536 2.735 10 0 EFAEHO CCCC[N@H+](CC)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001660589203 1102872793 /nfs/dbraw/zinc/87/27/93/1102872793.db2.gz MMGUVZOMBSXEKX-GOSISDBHSA-N 1 3 329.504 2.827 10 0 EFAEHO CCCC[N@@H+](CC)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001660589203 1102872807 /nfs/dbraw/zinc/87/28/07/1102872807.db2.gz MMGUVZOMBSXEKX-GOSISDBHSA-N 1 3 329.504 2.827 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@H]1CCCC[N@@H+]1C(C)C ZINC001660599317 1102879443 /nfs/dbraw/zinc/87/94/43/1102879443.db2.gz VOEYOSBTLZNYQV-OJXHRBAXSA-N 1 3 329.916 2.830 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@H]1CCCC[N@H+]1C(C)C ZINC001660599317 1102879447 /nfs/dbraw/zinc/87/94/47/1102879447.db2.gz VOEYOSBTLZNYQV-OJXHRBAXSA-N 1 3 329.916 2.830 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](CC)Cc1ccccc1 ZINC001660631657 1102899647 /nfs/dbraw/zinc/89/96/47/1102899647.db2.gz KLYBDDAMNXATHJ-IBGZPJMESA-N 1 3 331.504 2.889 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](CC)Cc1ccccc1 ZINC001660631657 1102899651 /nfs/dbraw/zinc/89/96/51/1102899651.db2.gz KLYBDDAMNXATHJ-IBGZPJMESA-N 1 3 331.504 2.889 10 0 EFAEHO C[NH+]1CCC(C(=O)NCCCN(Cc2ccsc2)C2CC2)CC1 ZINC001660719360 1102946280 /nfs/dbraw/zinc/94/62/80/1102946280.db2.gz MSFDXWCHZBMXOW-UHFFFAOYSA-N 1 3 335.517 2.561 10 0 EFAEHO CC(C)[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCC(F)(F)F ZINC001482545398 1103096207 /nfs/dbraw/zinc/09/62/07/1103096207.db2.gz QQZKHHKBVUTZMU-ZDUSSCGKSA-N 1 3 337.430 2.544 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001483254611 1103165130 /nfs/dbraw/zinc/16/51/30/1103165130.db2.gz IAWFEVHKBANHQU-AWEZNQCLSA-N 1 3 337.895 2.809 10 0 EFAEHO CCc1ccc(CC[NH2+]C[C@H](C)NC(=O)C(C)(C)N2CCCC2)cc1 ZINC001483256594 1103170039 /nfs/dbraw/zinc/17/00/39/1103170039.db2.gz ZIIBYOBCQTZFQG-KRWDZBQOSA-N 1 3 345.531 2.760 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C[C@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001483266235 1103192267 /nfs/dbraw/zinc/19/22/67/1103192267.db2.gz HZWNABVRGAMQLN-IRXDYDNUSA-N 1 3 331.504 2.746 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@@H]2CN(C/C=C\Cl)CC[C@@H]21 ZINC001661554884 1103315595 /nfs/dbraw/zinc/31/55/95/1103315595.db2.gz HPTOJIARLQYYDD-XRMLWCHGSA-N 1 3 341.927 2.784 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@@H]2CN(C/C=C/Cl)CC[C@@H]21 ZINC001661554883 1103316020 /nfs/dbraw/zinc/31/60/20/1103316020.db2.gz HPTOJIARLQYYDD-OGNIYVCYSA-N 1 3 341.927 2.784 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC/C=C/c2ccccc2)C1)N(C)C ZINC001661678840 1103354347 /nfs/dbraw/zinc/35/43/47/1103354347.db2.gz URJABVUMACHGJG-KRABFRDWSA-N 1 3 329.488 2.667 10 0 EFAEHO CCc1cccc(CN(C)C[C@H](C)NC(=O)[C@@H]2C[NH+]3CCC2CC3)c1 ZINC001483339725 1103429843 /nfs/dbraw/zinc/42/98/43/1103429843.db2.gz SGUVXTYTUQBCFB-OXJNMPFZSA-N 1 3 343.515 2.527 10 0 EFAEHO C[C@@H](C[N@H+](C)C[C@H]1CCCC(F)(F)C1)NC(=O)CN(C)C1CCC1 ZINC001483347721 1103450020 /nfs/dbraw/zinc/45/00/20/1103450020.db2.gz NAWUBDBIYUIFTB-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[N@@H+](C)C[C@H]1CCCC(F)(F)C1)NC(=O)CN(C)C1CCC1 ZINC001483347721 1103450026 /nfs/dbraw/zinc/45/00/26/1103450026.db2.gz NAWUBDBIYUIFTB-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](CN(C)[C@@H]1CCc2c1cccc2F)NC(=O)CCCC[NH+](C)C ZINC001483407361 1103628230 /nfs/dbraw/zinc/62/82/30/1103628230.db2.gz BLTWFAWPKCZMAX-HNAYVOBHSA-N 1 3 349.494 2.981 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]([NH2+]CCC1CCCCC1)C(C)C ZINC001482568925 1103651471 /nfs/dbraw/zinc/65/14/71/1103651471.db2.gz XLEVRLYOAOMCEX-SFHVURJKSA-N 1 3 334.508 2.961 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H]2CCN(C(=O)[C@H](C(C)C)N(C)C)C2)cc1 ZINC001662646551 1103743777 /nfs/dbraw/zinc/74/37/77/1103743777.db2.gz SVSZZSPRZCXZPJ-UXHICEINSA-N 1 3 345.531 2.562 10 0 EFAEHO CC[C@H]([NH2+]CCCN(C)C(=O)[C@H]1CCCN1C)c1ccc(F)cc1 ZINC001483456463 1103750275 /nfs/dbraw/zinc/75/02/75/1103750275.db2.gz WOPCZXUCHVHWPK-ZWKOTPCHSA-N 1 3 335.467 2.809 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CCCN(C)C(=O)[C@H](C(C)C)N(C)C)c1 ZINC001483470636 1103773584 /nfs/dbraw/zinc/77/35/84/1103773584.db2.gz HQHKVNZXYGRUTL-SFHVURJKSA-N 1 3 337.483 2.658 10 0 EFAEHO CN(CCC[NH2+]Cc1ccccc1C1CC1)C(=O)CN1CCCC1 ZINC001483509515 1103879294 /nfs/dbraw/zinc/87/92/94/1103879294.db2.gz LHZOKDCYQHYYHK-UHFFFAOYSA-N 1 3 329.488 2.598 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@H](NC(=O)CN(C)C(C)C)C2CC2)c(C)c1 ZINC001483607367 1104059113 /nfs/dbraw/zinc/05/91/13/1104059113.db2.gz KUQVPWDVJRBVKK-FQEVSTJZSA-N 1 3 345.531 2.936 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)c1 ZINC001482605867 1104468881 /nfs/dbraw/zinc/46/88/81/1104468881.db2.gz HIGIDNIEFPAESR-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)c1 ZINC001482605867 1104468891 /nfs/dbraw/zinc/46/88/91/1104468891.db2.gz HIGIDNIEFPAESR-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)c1 ZINC001482605868 1104469560 /nfs/dbraw/zinc/46/95/60/1104469560.db2.gz HIGIDNIEFPAESR-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)c1 ZINC001482605868 1104469565 /nfs/dbraw/zinc/46/95/65/1104469565.db2.gz HIGIDNIEFPAESR-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccc(CN(C)[C@H](C)CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1F ZINC001409610012 1104479990 /nfs/dbraw/zinc/47/99/90/1104479990.db2.gz GPVWFDHQNRVPPW-JZXOWHBKSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(CN(C)[C@H](C)CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1F ZINC001409610012 1104479994 /nfs/dbraw/zinc/47/99/94/1104479994.db2.gz GPVWFDHQNRVPPW-JZXOWHBKSA-N 1 3 349.494 2.801 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H](C)[N@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001409623532 1104533746 /nfs/dbraw/zinc/53/37/46/1104533746.db2.gz BDHINBDNAJMRFN-ZWKOTPCHSA-N 1 3 345.531 2.570 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H](C)[N@@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001409623532 1104533753 /nfs/dbraw/zinc/53/37/53/1104533753.db2.gz BDHINBDNAJMRFN-ZWKOTPCHSA-N 1 3 345.531 2.570 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H](C[N@H+](C)CCCCCF)C2)CC1 ZINC001664849064 1104577355 /nfs/dbraw/zinc/57/73/55/1104577355.db2.gz NFMASUIXVRCDGP-GOSISDBHSA-N 1 3 341.515 2.638 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H](C[N@@H+](C)CCCCCF)C2)CC1 ZINC001664849064 1104577360 /nfs/dbraw/zinc/57/73/60/1104577360.db2.gz NFMASUIXVRCDGP-GOSISDBHSA-N 1 3 341.515 2.638 10 0 EFAEHO Cc1cc(CN(C)[C@@H](C)CNC(=O)C[C@@H]2CC[N@H+](C)C2)c(C)s1 ZINC001409651413 1104600561 /nfs/dbraw/zinc/60/05/61/1104600561.db2.gz SJXBAQINCUOSFT-BBRMVZONSA-N 1 3 337.533 2.643 10 0 EFAEHO Cc1cc(CN(C)[C@@H](C)CNC(=O)C[C@@H]2CC[N@@H+](C)C2)c(C)s1 ZINC001409651413 1104600565 /nfs/dbraw/zinc/60/05/65/1104600565.db2.gz SJXBAQINCUOSFT-BBRMVZONSA-N 1 3 337.533 2.643 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)CC1CCC(C)(C)CC1 ZINC001409695622 1104673847 /nfs/dbraw/zinc/67/38/47/1104673847.db2.gz UMBHOTXDCKBTSB-MRXNPFEDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)CC1CCC(C)(C)CC1 ZINC001409695622 1104673849 /nfs/dbraw/zinc/67/38/49/1104673849.db2.gz UMBHOTXDCKBTSB-MRXNPFEDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[N@H+](C)CCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001482628136 1104687749 /nfs/dbraw/zinc/68/77/49/1104687749.db2.gz FUTAZYDNEPQTKA-SFHVURJKSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)CC[N@@H+](C)CCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001482628136 1104687751 /nfs/dbraw/zinc/68/77/51/1104687751.db2.gz FUTAZYDNEPQTKA-SFHVURJKSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N(C)CCN(C)CC2=CCCCC2)CC1 ZINC001482639246 1104711251 /nfs/dbraw/zinc/71/12/51/1104711251.db2.gz BTYBWHHUUYINCN-UHFFFAOYSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCC[NH2+]C[C@](C)(NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001666021733 1104832021 /nfs/dbraw/zinc/83/20/21/1104832021.db2.gz KJHCKENUWAVKIB-RBUKOAKNSA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H](CC[NH2+]CC3CCCC3)C2)C1 ZINC001666146947 1104883010 /nfs/dbraw/zinc/88/30/10/1104883010.db2.gz VFNADXJHLKPORJ-MJGOQNOKSA-N 1 3 335.536 2.737 10 0 EFAEHO CC1CC(C[NH2+]CC[C@H]2CCCN(C(=O)CN3CCC(C)CC3)C2)C1 ZINC001666158028 1104887532 /nfs/dbraw/zinc/88/75/32/1104887532.db2.gz VLPCJHWHGBJZHN-IOJLRTSASA-N 1 3 349.563 2.983 10 0 EFAEHO C[C@H](C[NH2+]C/C=C/c1ccc(Cl)cc1)N(C)C(=O)CN1CCCC1 ZINC001667054968 1105043424 /nfs/dbraw/zinc/04/34/24/1105043424.db2.gz VXZLYOYBXUORPT-SQRWCISFSA-N 1 3 349.906 2.886 10 0 EFAEHO CC(C)c1cccc(C[NH2+]CC[C@H](C)NC(=O)C2(N(C)C)CCC2)n1 ZINC001482840702 1105081033 /nfs/dbraw/zinc/08/10/33/1105081033.db2.gz ZFRKBSCKZCNCGS-INIZCTEOSA-N 1 3 346.519 2.674 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]Cc1ccccc1F ZINC001667239171 1105092790 /nfs/dbraw/zinc/09/27/90/1105092790.db2.gz UEGZFSALSNDLQW-MJGOQNOKSA-N 1 3 347.478 2.781 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001482870819 1105120948 /nfs/dbraw/zinc/12/09/48/1105120948.db2.gz HFNXEWBVLVECFL-IAGOWNOFSA-N 1 3 331.504 2.575 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H](C)NC(=O)[C@H](C(C)C)N(C)C)c(C)s1 ZINC001482887661 1105137500 /nfs/dbraw/zinc/13/75/00/1105137500.db2.gz BVAWILZWHCLOJJ-GUYCJALGSA-N 1 3 339.549 2.936 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001482887642 1105137957 /nfs/dbraw/zinc/13/79/57/1105137957.db2.gz BSYUFMKKNGCRGN-DNVCBOLYSA-N 1 3 344.503 2.739 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]Cc1cccc(OC)c1 ZINC001482900771 1105145262 /nfs/dbraw/zinc/14/52/62/1105145262.db2.gz GNMFJIHTBCVASR-VQIMIIECSA-N 1 3 347.503 2.554 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001482888915 1105147363 /nfs/dbraw/zinc/14/73/63/1105147363.db2.gz NJNPALDOACURGE-WMLDXEAASA-N 1 3 339.911 2.911 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CC[NH2+]Cc1cc(F)ccc1C ZINC001482902521 1105159861 /nfs/dbraw/zinc/15/98/61/1105159861.db2.gz RPEILGQQNNVDQA-APWZRJJASA-N 1 3 349.494 2.993 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(CC(C)C)cc1)C(=O)[C@H]1CCCN1C ZINC001482914920 1105176707 /nfs/dbraw/zinc/17/67/07/1105176707.db2.gz WXTFYTCKEHZTCK-HXUWFJFHSA-N 1 3 345.531 2.917 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@H]2C[NH2+]CCCC2CCC2)CCC1 ZINC001667726117 1105188797 /nfs/dbraw/zinc/18/87/97/1105188797.db2.gz DKLLCKNJHVMTES-ZWKOTPCHSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(CC[NH2+]CC[C@H](C)NC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001668062079 1105229028 /nfs/dbraw/zinc/22/90/28/1105229028.db2.gz ZIVDUSQGFGNOPN-AZUAARDMSA-N 1 3 345.531 2.895 10 0 EFAEHO CCc1ccc(C[NH2+]CC[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001668215152 1105258792 /nfs/dbraw/zinc/25/87/92/1105258792.db2.gz XFDUGVJEFWILPS-DLBZAZTESA-N 1 3 331.504 2.575 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@H](C)NC(=O)Cc2nc[nH]c2C)c1 ZINC001668287738 1105274286 /nfs/dbraw/zinc/27/42/86/1105274286.db2.gz BQSQNDGACYOJAX-AWEZNQCLSA-N 1 3 328.460 2.508 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C(C)C)nc1C)C(=O)[C@@H]1CCCN1C ZINC001668382078 1105289762 /nfs/dbraw/zinc/28/97/62/1105289762.db2.gz RYNAHGXNURESON-IBGZPJMESA-N 1 3 346.519 2.546 10 0 EFAEHO CCN(CC[NH2+]CC[C@@H]1CCc2ccccc21)C(=O)[C@H]1CCCN1C ZINC001668382150 1105291000 /nfs/dbraw/zinc/29/10/00/1105291000.db2.gz UXAOQISLWPUZLA-AZUAARDMSA-N 1 3 343.515 2.639 10 0 EFAEHO CCN(CC[NH2+]Cc1cc2ccccc2o1)C(=O)CN(C)C1CCC1 ZINC001668453499 1105300713 /nfs/dbraw/zinc/30/07/13/1105300713.db2.gz SGFPIKWBYJLAKI-UHFFFAOYSA-N 1 3 343.471 2.855 10 0 EFAEHO CCN(CC[NH2+]CC[C@@H]1CCCC1(F)F)C(=O)CN1CC[C@H](C)C1 ZINC001668555092 1105319662 /nfs/dbraw/zinc/31/96/62/1105319662.db2.gz IGJREYLBCHSGKW-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc(C)c1)C(=O)[C@H]1CCCCN1CC ZINC001668652727 1105341049 /nfs/dbraw/zinc/34/10/49/1105341049.db2.gz VJNLAZFYFASWHH-LJQANCHMSA-N 1 3 331.504 2.808 10 0 EFAEHO CCN(CC[NH2+]Cc1c(C)cc(C)cc1C)C(=O)CN(C)C(C)C ZINC001668652133 1105341782 /nfs/dbraw/zinc/34/17/82/1105341782.db2.gz IXAWZEAZJHLIGR-UHFFFAOYSA-N 1 3 333.520 2.890 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C/C=C/CNC(=O)[C@H]2CCCN2C)c1 ZINC001668746445 1105360695 /nfs/dbraw/zinc/36/06/95/1105360695.db2.gz YIACXAUWQQMJQE-IIMPKJCBSA-N 1 3 329.488 2.721 10 0 EFAEHO CN(C)C1(C(=O)NC/C=C\C[NH2+][C@@H]2CCc3ccc(F)cc32)CCC1 ZINC001668864548 1105388094 /nfs/dbraw/zinc/38/80/94/1105388094.db2.gz HSMAAAZUFCHWHE-DDKKJVIOSA-N 1 3 345.462 2.559 10 0 EFAEHO O=C(NC/C=C\CNCc1cccc(F)c1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001668884280 1105393969 /nfs/dbraw/zinc/39/39/69/1105393969.db2.gz ZXRKJJQVAOAIRX-YJZIAQIGSA-N 1 3 345.462 2.605 10 0 EFAEHO O=C(NC/C=C\CNCc1cccc(F)c1)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001668884280 1105393975 /nfs/dbraw/zinc/39/39/75/1105393975.db2.gz ZXRKJJQVAOAIRX-YJZIAQIGSA-N 1 3 345.462 2.605 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/C[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001669027507 1105420534 /nfs/dbraw/zinc/42/05/34/1105420534.db2.gz SEKRULPKJGPQGG-SQRWCISFSA-N 1 3 345.478 2.660 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C\C[NH2+][C@@H]1CCc2ccccc21 ZINC001669206381 1105457366 /nfs/dbraw/zinc/45/73/66/1105457366.db2.gz COWDDHOSWUIBOS-KJYWSYJISA-N 1 3 341.499 2.810 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C/C=C/CNC(=O)[C@@H]1CCCN1C ZINC001482991467 1105493248 /nfs/dbraw/zinc/49/32/48/1105493248.db2.gz RLXOJAPGWPDUTJ-GHOSXJJBSA-N 1 3 329.488 2.666 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]C/C=C\c1ccccc1 ZINC001669750114 1105514947 /nfs/dbraw/zinc/51/49/47/1105514947.db2.gz DYIZRRYGBLYCFW-QVIVTLILSA-N 1 3 329.488 2.669 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C/CNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001483019879 1105563245 /nfs/dbraw/zinc/56/32/45/1105563245.db2.gz QJRZAZMKLJVKGH-RTLBZRNLSA-N 1 3 347.478 2.771 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C/CNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001483019879 1105563249 /nfs/dbraw/zinc/56/32/49/1105563249.db2.gz QJRZAZMKLJVKGH-RTLBZRNLSA-N 1 3 347.478 2.771 10 0 EFAEHO CN(CCCNCc1cc(Cl)ccc1Cl)C(=O)CC[NH+](C)C ZINC001670233475 1105601193 /nfs/dbraw/zinc/60/11/93/1105601193.db2.gz UEOPPFHVVKLJCQ-UHFFFAOYSA-N 1 3 346.302 2.883 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[NH2+]Cc2cccc(Cl)c2)C1 ZINC001670245830 1105603668 /nfs/dbraw/zinc/60/36/68/1105603668.db2.gz GKBPIDSWVNSWLH-HNNXBMFYSA-N 1 3 337.895 2.620 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)NC/C=C/CNCc1cccc(F)c1 ZINC001483028854 1105662229 /nfs/dbraw/zinc/66/22/29/1105662229.db2.gz RUXFTPYICFTIIW-RTLBZRNLSA-N 1 3 347.478 2.708 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)NC/C=C/CNCc1cccc(F)c1 ZINC001483028854 1105662230 /nfs/dbraw/zinc/66/22/30/1105662230.db2.gz RUXFTPYICFTIIW-RTLBZRNLSA-N 1 3 347.478 2.708 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@](C)(C[NH2+]CCC3CCCC3)C2)CCC1 ZINC001671748728 1105695834 /nfs/dbraw/zinc/69/58/34/1105695834.db2.gz XGFHBSOASBLNBP-IBGZPJMESA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@H]1CC[C@@H](CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001672377330 1105816737 /nfs/dbraw/zinc/81/67/37/1105816737.db2.gz USSQZBZGWGIEAZ-MHORFTMASA-N 1 3 341.515 2.589 10 0 EFAEHO CC[NH2+]CCN(Cc1ccccc1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001672395966 1105822561 /nfs/dbraw/zinc/82/25/61/1105822561.db2.gz AFBIOKJHOIIQHT-FQEVSTJZSA-N 1 3 349.494 2.837 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N(CC[NH2+]CC1CC1)Cc1ccccc1 ZINC001672400485 1105823156 /nfs/dbraw/zinc/82/31/56/1105823156.db2.gz FOMQHLQFFSRJQI-QZTJIDSGSA-N 1 3 343.515 2.888 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@@H]2[C@@H]1CCN2CCC(F)(F)F ZINC001672538450 1105863782 /nfs/dbraw/zinc/86/37/82/1105863782.db2.gz QYNRZTPKTXUERV-CABCVRRESA-N 1 3 349.441 2.736 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@H]1CCN(C(=O)CN(C)C2CCC2)C1 ZINC001672805021 1105907639 /nfs/dbraw/zinc/90/76/39/1105907639.db2.gz IPEYKIVYSAOEJL-SFHVURJKSA-N 1 3 343.515 2.808 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H](CC[NH2+]CCc3cccs3)C2)CCC1 ZINC001672806193 1105908081 /nfs/dbraw/zinc/90/80/81/1105908081.db2.gz UIUVWQMWFMGUBE-INIZCTEOSA-N 1 3 349.544 2.603 10 0 EFAEHO CC[C@H](F)C[NH2+]CC[C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001672863569 1105923299 /nfs/dbraw/zinc/92/32/99/1105923299.db2.gz OMIDNTXPOJSNMR-HOTGVXAUSA-N 1 3 329.504 2.541 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001672863570 1105923357 /nfs/dbraw/zinc/92/33/57/1105923357.db2.gz OMIDNTXPOJSNMR-HZPDHXFCSA-N 1 3 329.504 2.541 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](CC[NH2+]Cc2ccc(CF)cc2)C1)N(C)C ZINC001672896956 1105930911 /nfs/dbraw/zinc/93/09/11/1105930911.db2.gz LQNFECYXMVRAOC-RBUKOAKNSA-N 1 3 349.494 2.825 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H](C[NH2+]CCC(F)(F)F)CC2)CCC1 ZINC001672965481 1105949627 /nfs/dbraw/zinc/94/96/27/1105949627.db2.gz BRHIEKFBYQOVRI-HDJSIYSDSA-N 1 3 349.441 2.688 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1CC[C@H](C[NH2+]C/C=C/Cl)CC1 ZINC001672994955 1105956419 /nfs/dbraw/zinc/95/64/19/1105956419.db2.gz NWBJJVVMOAUAEH-UMQIJCBISA-N 1 3 341.927 2.876 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@H]1Cc2ccccc2CN1CC1CC1 ZINC001673633821 1106059938 /nfs/dbraw/zinc/05/99/38/1106059938.db2.gz LDOHGMGLEAKDQU-HXUWFJFHSA-N 1 3 343.515 2.671 10 0 EFAEHO C[C@H]1CN(C(=O)[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)CCN(C2CC2)C1 ZINC000897866254 1106122831 /nfs/dbraw/zinc/12/28/31/1106122831.db2.gz VEDNNAYBMRCQNG-NSISKUIASA-N 1 3 341.499 2.622 10 0 EFAEHO C[C@H]1CN(C(=O)[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)CCN(C2CC2)C1 ZINC000897866254 1106122834 /nfs/dbraw/zinc/12/28/34/1106122834.db2.gz VEDNNAYBMRCQNG-NSISKUIASA-N 1 3 341.499 2.622 10 0 EFAEHO C[NH+](C)CCc1ccc(C(=O)NC2(CNCCF)CCCCC2)cc1 ZINC001675201665 1106315494 /nfs/dbraw/zinc/31/54/94/1106315494.db2.gz NLMRGYLBSYKNAZ-UHFFFAOYSA-N 1 3 349.494 2.783 10 0 EFAEHO Cc1ccccc1CN1CC([C@H](C)NC(=O)CCCC[NH+](C)C)C1 ZINC001675360273 1106347171 /nfs/dbraw/zinc/34/71/71/1106347171.db2.gz VYUXIHVQTALULQ-KRWDZBQOSA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CCc2ccccc2)C1 ZINC001675739601 1106417962 /nfs/dbraw/zinc/41/79/62/1106417962.db2.gz HTOVAWQJFJJSDW-UFYCRDLUSA-N 1 3 343.515 2.586 10 0 EFAEHO C[C@H](CCC[NH2+]CCC1CC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001675973347 1106457482 /nfs/dbraw/zinc/45/74/82/1106457482.db2.gz JDCAERVGLDAUHV-DNVCBOLYSA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@@H](CCC[NH2+]CCC1CC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001675973348 1106458203 /nfs/dbraw/zinc/45/82/03/1106458203.db2.gz JDCAERVGLDAUHV-HNAYVOBHSA-N 1 3 341.515 2.874 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC([N@H+](C)CCCCC(F)(F)F)CC1 ZINC001676036970 1106473285 /nfs/dbraw/zinc/47/32/85/1106473285.db2.gz BUEWOIIYRKAACK-HNNXBMFYSA-N 1 3 349.441 2.736 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC([N@@H+](C)CCCCC(F)(F)F)CC1 ZINC001676036970 1106473288 /nfs/dbraw/zinc/47/32/88/1106473288.db2.gz BUEWOIIYRKAACK-HNNXBMFYSA-N 1 3 349.441 2.736 10 0 EFAEHO CN(C)C1(C(=O)N(C)[C@@H](C[NH2+]CC2=CCCCC2)C2CC2)CCC1 ZINC001676221206 1106501430 /nfs/dbraw/zinc/50/14/30/1106501430.db2.gz BICYKVJNYWOGMF-SFHVURJKSA-N 1 3 333.520 2.798 10 0 EFAEHO C[C@@H]1[C@@H](NCc2ccccc2F)CCN1C(=O)CCCC[NH+](C)C ZINC001676680298 1106557501 /nfs/dbraw/zinc/55/75/01/1106557501.db2.gz KIGZAOVUVSDVLC-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2cccc(F)c2)C[C@H]1C ZINC001676774148 1106577674 /nfs/dbraw/zinc/57/76/74/1106577674.db2.gz KGXWOXNDQXVIBP-VQIMIIECSA-N 1 3 349.494 2.679 10 0 EFAEHO CC(C)=CC[NH2+][C@H]1C[C@@H](C)N(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001676784523 1106579840 /nfs/dbraw/zinc/57/98/40/1106579840.db2.gz WKNJSKDHJUBMNA-APWZRJJASA-N 1 3 329.488 2.907 10 0 EFAEHO CC(C)=CC[NH2+][C@H]1C[C@H](C)N(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001676784524 1106580118 /nfs/dbraw/zinc/58/01/18/1106580118.db2.gz WKNJSKDHJUBMNA-LPHOPBHVSA-N 1 3 329.488 2.907 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[C@H](C[NH2+]CCC(F)(F)F)C1)N1CCCC1 ZINC001676946158 1106633819 /nfs/dbraw/zinc/63/38/19/1106633819.db2.gz USUOCBQZBFJNQW-KBPBESRZSA-N 1 3 349.441 2.688 10 0 EFAEHO CC(C)CC[NH2+]C[C@@H]1CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C1 ZINC001676959157 1106636775 /nfs/dbraw/zinc/63/67/75/1106636775.db2.gz RVKMSQNTCMROGE-IAGOWNOFSA-N 1 3 325.541 2.885 10 0 EFAEHO CC[C@H](C(=O)N1C[C@@H]([NH2+]CCCC(C)(C)C)C(C)(C)C1)N(C)C ZINC001677033053 1106653466 /nfs/dbraw/zinc/65/34/66/1106653466.db2.gz RDOHHMICOMMOBT-HZPDHXFCSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)cs1 ZINC001483049705 1106656951 /nfs/dbraw/zinc/65/69/51/1106656951.db2.gz ADKDQDHILIIQKZ-RMLGOWPTSA-N 1 3 335.517 2.549 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cs1 ZINC001483049705 1106656954 /nfs/dbraw/zinc/65/69/54/1106656954.db2.gz ADKDQDHILIIQKZ-RMLGOWPTSA-N 1 3 335.517 2.549 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H](CNCC=C(Cl)Cl)C(C)(C)C ZINC001677276711 1106689933 /nfs/dbraw/zinc/68/99/33/1106689933.db2.gz GKPNXZRUIRZABH-GFCCVEGCSA-N 1 3 338.323 2.768 10 0 EFAEHO CC/C=C\CC[NH+]1CCC([C@H](C)NC(=O)Cc2nc[nH]c2C)CC1 ZINC001677368340 1106706847 /nfs/dbraw/zinc/70/68/47/1106706847.db2.gz ZZSBHUQXXWPIOP-YVACAVLKSA-N 1 3 332.492 2.834 10 0 EFAEHO CCc1cccc(CN2CC=C(CNC(=O)CC[N@@H+](C)CC)CC2)c1 ZINC001677621753 1106786182 /nfs/dbraw/zinc/78/61/82/1106786182.db2.gz WXFFTBKOFAEMFT-UHFFFAOYSA-N 1 3 343.515 2.839 10 0 EFAEHO CCc1cccc(CN2CC=C(CNC(=O)CC[N@H+](C)CC)CC2)c1 ZINC001677621753 1106786196 /nfs/dbraw/zinc/78/61/96/1106786196.db2.gz WXFFTBKOFAEMFT-UHFFFAOYSA-N 1 3 343.515 2.839 10 0 EFAEHO Cc1ccc(C[N@H+]2CC=C(CNC(=O)[C@H](C(C)C)N(C)C)CC2)cc1 ZINC001677624578 1106789943 /nfs/dbraw/zinc/78/99/43/1106789943.db2.gz SVXUSZQZJDYCBW-FQEVSTJZSA-N 1 3 343.515 2.830 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC=C(CNC(=O)[C@H](C(C)C)N(C)C)CC2)cc1 ZINC001677624578 1106789952 /nfs/dbraw/zinc/78/99/52/1106789952.db2.gz SVXUSZQZJDYCBW-FQEVSTJZSA-N 1 3 343.515 2.830 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1=CC[N@H+](CC2CCCC2)CC1 ZINC001677632203 1106795853 /nfs/dbraw/zinc/79/58/53/1106795853.db2.gz IGZANQQCVZLBOT-CALCHBBNSA-N 1 3 333.520 2.798 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1=CC[N@@H+](CC2CCCC2)CC1 ZINC001677632203 1106795865 /nfs/dbraw/zinc/79/58/65/1106795865.db2.gz IGZANQQCVZLBOT-CALCHBBNSA-N 1 3 333.520 2.798 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CNCc2ccc(Cl)s2)CC[N@@H+]1C ZINC001483228664 1107507404 /nfs/dbraw/zinc/50/74/04/1107507404.db2.gz VILPQMYOOGUCBW-FPMFFAJLSA-N 1 3 343.924 2.726 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CNCc2ccc(Cl)s2)CC[N@H+]1C ZINC001483228664 1107507413 /nfs/dbraw/zinc/50/74/13/1107507413.db2.gz VILPQMYOOGUCBW-FPMFFAJLSA-N 1 3 343.924 2.726 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/C[NH2+][C@H](C)c1ccc(F)cc1)N(C)C ZINC001483055705 1107692847 /nfs/dbraw/zinc/69/28/47/1107692847.db2.gz BJHBPADZPFLHDD-YOBDTOFLSA-N 1 3 335.467 2.735 10 0 EFAEHO Cn1cc(CN2CCC3(CO[C@@H](C[NH3+])C3)CC2)c(C2CCCCC2)n1 ZINC000904391839 1107879019 /nfs/dbraw/zinc/87/90/19/1107879019.db2.gz KUWAYIPYSQTRJS-GOSISDBHSA-N 1 3 346.519 2.798 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)c(C)c1 ZINC001409364393 1107909755 /nfs/dbraw/zinc/90/97/55/1107909755.db2.gz LCFSTGKYQRCEQS-IRXDYDNUSA-N 1 3 331.504 2.771 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001409363600 1107916213 /nfs/dbraw/zinc/91/62/13/1107916213.db2.gz KKIZFIIBKCEZGJ-HOTGVXAUSA-N 1 3 331.504 2.716 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC[C@@H]1CCN1C[C@@H]1CCCC(F)(F)C1 ZINC001483693280 1107937674 /nfs/dbraw/zinc/93/76/74/1107937674.db2.gz LVSBLCMFHPEFLQ-CVEARBPZSA-N 1 3 345.478 2.734 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC[C@@H]1CCN1C[C@@H]1CCCC(F)(F)C1 ZINC001483693280 1107937686 /nfs/dbraw/zinc/93/76/86/1107937686.db2.gz LVSBLCMFHPEFLQ-CVEARBPZSA-N 1 3 345.478 2.734 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC[C@H]1CCN1C[C@@H]1CCCC(F)(F)C1 ZINC001483693284 1107938258 /nfs/dbraw/zinc/93/82/58/1107938258.db2.gz LVSBLCMFHPEFLQ-HZPDHXFCSA-N 1 3 345.478 2.734 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC[C@H]1CCN1C[C@@H]1CCCC(F)(F)C1 ZINC001483693284 1107938265 /nfs/dbraw/zinc/93/82/65/1107938265.db2.gz LVSBLCMFHPEFLQ-HZPDHXFCSA-N 1 3 345.478 2.734 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]C/C=C\c1ccccc1 ZINC001409369582 1107961087 /nfs/dbraw/zinc/96/10/87/1107961087.db2.gz MLDFCUCYHYWNKB-VIMDQOKKSA-N 1 3 329.488 2.667 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]C/C=C/c1ccccc1 ZINC001272344068 1108011266 /nfs/dbraw/zinc/01/12/66/1108011266.db2.gz PVYXBNMPTNKMEZ-RHYMJRRZSA-N 1 3 343.515 2.915 10 0 EFAEHO C[C@H](NCc1ccccn1)[C@H](C)NC(=O)CC[N@H+](C)C1CCCCC1 ZINC001409380511 1108071949 /nfs/dbraw/zinc/07/19/49/1108071949.db2.gz QTAXZJQTSVDBDW-IRXDYDNUSA-N 1 3 346.519 2.719 10 0 EFAEHO C[C@H](NCc1ccccn1)[C@H](C)NC(=O)CC[N@@H+](C)C1CCCCC1 ZINC001409380511 1108071965 /nfs/dbraw/zinc/07/19/65/1108071965.db2.gz QTAXZJQTSVDBDW-IRXDYDNUSA-N 1 3 346.519 2.719 10 0 EFAEHO C[C@H](C(=O)NC/C=C/CNCc1ccsc1)[NH+]1CCCCCC1 ZINC001483071301 1108333840 /nfs/dbraw/zinc/33/38/40/1108333840.db2.gz VDMHQZWJGVSCCE-DWTRPJMMSA-N 1 3 335.517 2.775 10 0 EFAEHO CC(C)CN1CCC([NH2+]C[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2)CC1 ZINC000715109843 1108607169 /nfs/dbraw/zinc/60/71/69/1108607169.db2.gz OMUOZDYAFVZNHB-JCNLHEQBSA-N 1 3 339.524 3.000 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C/C[NH2+]Cc1ccc(CF)cc1 ZINC001483097169 1108624796 /nfs/dbraw/zinc/62/47/96/1108624796.db2.gz ISQQYUUWSUKKHH-VZSQWMKGSA-N 1 3 347.478 2.793 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@H]2CCN(C(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001272554705 1108651125 /nfs/dbraw/zinc/65/11/25/1108651125.db2.gz GNRREEVDPUVFDE-AZUAARDMSA-N 1 3 345.531 2.909 10 0 EFAEHO CC(C)[C@@H]1COCC[C@@H]1[NH2+]Cc1ccc(CN2CCN(C)CC2)cc1 ZINC000924723748 1108871613 /nfs/dbraw/zinc/87/16/13/1108871613.db2.gz ULZBZLWRIOFMFZ-SFTDATJTSA-N 1 3 345.531 2.585 10 0 EFAEHO CC(C)[C@H]1COCC[C@H]1[NH2+]Cc1ccc(CN2CCN(C)CC2)cc1 ZINC000924723734 1108872204 /nfs/dbraw/zinc/87/22/04/1108872204.db2.gz ULZBZLWRIOFMFZ-NHCUHLMSSA-N 1 3 345.531 2.585 10 0 EFAEHO CC(C)[C@@H]1COCC[C@H]1[NH2+]Cc1ccc(CN2CCN(C)CC2)cc1 ZINC000924723729 1108872933 /nfs/dbraw/zinc/87/29/33/1108872933.db2.gz ULZBZLWRIOFMFZ-LEWJYISDSA-N 1 3 345.531 2.585 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001409299798 1109457704 /nfs/dbraw/zinc/45/77/04/1109457704.db2.gz WIRRTGWEZWTYJY-ACBHZAAOSA-N 1 3 331.504 2.628 10 0 EFAEHO Cc1ccc(CCC[NH2+]C[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001483135766 1109602492 /nfs/dbraw/zinc/60/24/92/1109602492.db2.gz QKFKJOLLZAZAFV-QGZVFWFLSA-N 1 3 331.504 2.506 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1ccccc1F ZINC001483142853 1109667169 /nfs/dbraw/zinc/66/71/69/1109667169.db2.gz AERYRIDBQQLAJR-CRAIPNDOSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1ccccc1F ZINC001483142853 1109667172 /nfs/dbraw/zinc/66/71/72/1109667172.db2.gz AERYRIDBQQLAJR-CRAIPNDOSA-N 1 3 335.467 2.540 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N[C@H](C)CNCc2ccccc2F)C1 ZINC001483159513 1109899287 /nfs/dbraw/zinc/89/92/87/1109899287.db2.gz JONKCAQAVFDPFV-NVXWUHKLSA-N 1 3 335.467 2.542 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N[C@H](C)CNCc2ccccc2F)C1 ZINC001483159513 1109899291 /nfs/dbraw/zinc/89/92/91/1109899291.db2.gz JONKCAQAVFDPFV-NVXWUHKLSA-N 1 3 335.467 2.542 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N[C@H](C)CNCc2ccccc2F)C1 ZINC001483159514 1109899490 /nfs/dbraw/zinc/89/94/90/1109899490.db2.gz JONKCAQAVFDPFV-WBVHZDCISA-N 1 3 335.467 2.542 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N[C@H](C)CNCc2ccccc2F)C1 ZINC001483159514 1109899492 /nfs/dbraw/zinc/89/94/92/1109899492.db2.gz JONKCAQAVFDPFV-WBVHZDCISA-N 1 3 335.467 2.542 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@@H]1CCN(C(=O)[C@@H](CC)N(C)C)C1 ZINC001272616749 1111749704 /nfs/dbraw/zinc/74/97/04/1111749704.db2.gz OXBGTXGUVPDGSV-YLJYHZDGSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](CC[NH2+]CCCC(C)(C)C)C1 ZINC001272652203 1111885110 /nfs/dbraw/zinc/88/51/10/1111885110.db2.gz JZYMAMONENOGQE-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)NCC2(NCc3ccc(F)cc3)CC2)C1 ZINC001483784838 1112447400 /nfs/dbraw/zinc/44/74/00/1112447400.db2.gz VDXYDUFNHJYTND-SJLPKXTDSA-N 1 3 347.478 2.685 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H]3CCC[C@H]([NH+](C)C)C3)CC2)cs1 ZINC001483783014 1112456797 /nfs/dbraw/zinc/45/67/97/1112456797.db2.gz IINFXHCDSCCTCX-IRXDYDNUSA-N 1 3 349.544 2.915 10 0 EFAEHO CCCCC[N@@H+]1CCC[C@@]2(CCN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001483830259 1112490588 /nfs/dbraw/zinc/49/05/88/1112490588.db2.gz MOBBJKJIUXPHEN-HXUWFJFHSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCC[N@H+]1CCC[C@@]2(CCN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001483830259 1112490590 /nfs/dbraw/zinc/49/05/90/1112490590.db2.gz MOBBJKJIUXPHEN-HXUWFJFHSA-N 1 3 335.536 2.975 10 0 EFAEHO CN(CC(=O)N1CCC[C@H]1C[NH2+]Cc1ccsc1)CC(C)(C)C ZINC001483944705 1112585508 /nfs/dbraw/zinc/58/55/08/1112585508.db2.gz CYMXGYBSFRJIFH-INIZCTEOSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H]1C[NH2+]CCCc1ccsc1)N(C)C ZINC001483952575 1112595792 /nfs/dbraw/zinc/59/57/92/1112595792.db2.gz YOLPPHQDEYBDOK-IRXDYDNUSA-N 1 3 337.533 2.602 10 0 EFAEHO C[C@@H](F)CC[NH+]1CCC(C)(NC(=O)[C@H](C)N2CCCCCC2)CC1 ZINC001483973037 1112614712 /nfs/dbraw/zinc/61/47/12/1112614712.db2.gz QEJIUESUCRISBM-SJORKVTESA-N 1 3 341.515 2.970 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H](CC[NH2+]CC3=CCCCC3)C2)CCC1 ZINC001484523157 1112978906 /nfs/dbraw/zinc/97/89/06/1112978906.db2.gz PUPIGZCJYLALJS-GOSISDBHSA-N 1 3 333.520 2.799 10 0 EFAEHO CCC(CC)C[NH2+]CC[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001484543613 1112990578 /nfs/dbraw/zinc/99/05/78/1112990578.db2.gz OACXZBXHWBDWNR-LJQANCHMSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](CC[NH2+]CCCC(C)(C)C)C2)C1 ZINC001484537928 1112992201 /nfs/dbraw/zinc/99/22/01/1112992201.db2.gz PYEUFWGCTHHHQL-ZWKOTPCHSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@H]([NH2+]CC[C@@H]1CCN(C(=O)CN2CCCC2)C1)c1cccc(F)c1 ZINC001484550041 1113002264 /nfs/dbraw/zinc/00/22/64/1113002264.db2.gz PWALAGAOWUEIOI-DLBZAZTESA-N 1 3 347.478 2.811 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+]C[C@H]2CCC(F)(F)C2)C1 ZINC001484550127 1113002655 /nfs/dbraw/zinc/00/26/55/1113002655.db2.gz QCMVWCWUZNAOTI-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@H](CC[NH2+]Cc2ccsc2)C1 ZINC001484551238 1113003018 /nfs/dbraw/zinc/00/30/18/1113003018.db2.gz FAHUCLAAJCXUAO-WMZOPIPTSA-N 1 3 349.544 2.951 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001484572403 1113024862 /nfs/dbraw/zinc/02/48/62/1113024862.db2.gz GLUPWUPICKMLSS-ULQDDVLXSA-N 1 3 343.531 2.977 10 0 EFAEHO Cc1ccc(F)c(CN2CCC3(CN(C(=O)CC[NH+](C)C)C3)CC2)c1 ZINC001484580612 1113033573 /nfs/dbraw/zinc/03/35/73/1113033573.db2.gz MGCYIMUPBWTOQV-UHFFFAOYSA-N 1 3 347.478 2.510 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+]C[C@@H]2CCCC(F)(F)C2)CCC1 ZINC001484659424 1113099404 /nfs/dbraw/zinc/09/94/04/1113099404.db2.gz IFJKHANCAMLJGE-OAHLLOKOSA-N 1 3 345.478 2.782 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1([NH2+]CCCc2ccsc2)CCC1 ZINC001484659999 1113100313 /nfs/dbraw/zinc/10/03/13/1113100313.db2.gz OGBVBBUCIUDCKV-UHFFFAOYSA-N 1 3 346.500 2.583 10 0 EFAEHO CCCCC[N@@H+]1CC[C@]2(C1)CCCN(C(=O)CN1CC[C@H](C)C1)C2 ZINC001484828809 1117746904 /nfs/dbraw/zinc/74/69/04/1117746904.db2.gz DCKQWONQPJRGAG-ICSRJNTNSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCC[N@H+]1CC[C@]2(C1)CCCN(C(=O)CN1CC[C@H](C)C1)C2 ZINC001484828809 1117746910 /nfs/dbraw/zinc/74/69/10/1117746910.db2.gz DCKQWONQPJRGAG-ICSRJNTNSA-N 1 3 335.536 2.833 10 0 EFAEHO CC/C=C\CCN1Cc2ccc(CNC(=O)CC[NH+](C)C)cc2C1 ZINC001484875562 1117791056 /nfs/dbraw/zinc/79/10/56/1117791056.db2.gz JSCODEKKBRWTQU-WAYWQWQTSA-N 1 3 329.488 2.926 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(C)([NH2+]C/C=C\c2ccccc2)CC1 ZINC001484913552 1117826475 /nfs/dbraw/zinc/82/64/75/1117826475.db2.gz RNTQXUVTHIEJLY-SMTIMMHKSA-N 1 3 341.499 2.765 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(C)([NH2+]C/C=C/c2ccccc2)CC1 ZINC001484913551 1117826527 /nfs/dbraw/zinc/82/65/27/1117826527.db2.gz RNTQXUVTHIEJLY-IUYMFKLXSA-N 1 3 341.499 2.765 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCN(C/C=C/c2ccccc2)CC1(C)C ZINC001484937215 1117850790 /nfs/dbraw/zinc/85/07/90/1117850790.db2.gz LNYGRERIAFTGBP-UFUQCMIWSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@H]([NH2+]CC=C(Cl)Cl)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001493851642 1117850970 /nfs/dbraw/zinc/85/09/70/1117850970.db2.gz WMUAZFYVCHOXQY-ZDUSSCGKSA-N 1 3 348.318 2.618 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@H](NC(=O)Cc2nc[nH]c2C)C[C@H]1C ZINC001484986447 1117912878 /nfs/dbraw/zinc/91/28/78/1117912878.db2.gz RLAULFAXNCPQEL-TWIRLKNGSA-N 1 3 332.492 2.976 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@H](NC(=O)Cc2nc[nH]c2C)C[C@H]1C ZINC001484986447 1117912882 /nfs/dbraw/zinc/91/28/82/1117912882.db2.gz RLAULFAXNCPQEL-TWIRLKNGSA-N 1 3 332.492 2.976 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@H+](C)CCc1ccccc1F ZINC001485078016 1118022045 /nfs/dbraw/zinc/02/20/45/1118022045.db2.gz DVKBVDYMKZCRKK-SFHVURJKSA-N 1 3 349.494 2.631 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@@H+](C)CCc1ccccc1F ZINC001485078016 1118022049 /nfs/dbraw/zinc/02/20/49/1118022049.db2.gz DVKBVDYMKZCRKK-SFHVURJKSA-N 1 3 349.494 2.631 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1CC(C[NH2+]CCC2=CCCCC2)C1)N(C)C ZINC001485108515 1118056004 /nfs/dbraw/zinc/05/60/04/1118056004.db2.gz NIXGGKDUQFBFOH-ACBHZAAOSA-N 1 3 335.536 2.948 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@@H]2CCc3ccccc32)C1 ZINC001485109201 1118056391 /nfs/dbraw/zinc/05/63/91/1118056391.db2.gz VHSOTXMFQCMOME-GXOAENINSA-N 1 3 329.488 2.500 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+][C@H]2CCc3ccc(F)cc32)C1 ZINC001485110838 1118057401 /nfs/dbraw/zinc/05/74/01/1118057401.db2.gz YCABNJGJIOGABW-YVNUBYTISA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(Cl)s1)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001485157834 1118100660 /nfs/dbraw/zinc/10/06/60/1118100660.db2.gz VMWPBMFSDQBCNA-NEPJUHHUSA-N 1 3 343.924 2.869 10 0 EFAEHO C[C@@H](NCc1ccccc1F)[C@H](C)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001485165071 1118107673 /nfs/dbraw/zinc/10/76/73/1118107673.db2.gz UMOFFKWRSPJKBL-CVEARBPZSA-N 1 3 347.478 2.685 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@@H](C)[NH2+]CCc1ccccc1 ZINC001485183109 1118116985 /nfs/dbraw/zinc/11/69/85/1118116985.db2.gz ZKYWHCCEIOYAJH-IAGOWNOFSA-N 1 3 331.504 2.586 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)[C@H](C)[NH2+]CCc1ccccc1 ZINC001485183111 1118117238 /nfs/dbraw/zinc/11/72/38/1118117238.db2.gz ZKYWHCCEIOYAJH-IRXDYDNUSA-N 1 3 331.504 2.586 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@H](C)[NH2+]CCc1ccccc1 ZINC001485183108 1118117246 /nfs/dbraw/zinc/11/72/46/1118117246.db2.gz ZKYWHCCEIOYAJH-DLBZAZTESA-N 1 3 331.504 2.586 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)cc1C ZINC001485218600 1118137981 /nfs/dbraw/zinc/13/79/81/1118137981.db2.gz XACSQVYROZPISJ-HUUCEWRRSA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001485219558 1118139521 /nfs/dbraw/zinc/13/95/21/1118139521.db2.gz YDLFPOFOSCQOSJ-KBPBESRZSA-N 1 3 332.492 2.714 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC(C)(C)C[NH2+]CCC2CCCC2)C1 ZINC001485259684 1118179265 /nfs/dbraw/zinc/17/92/65/1118179265.db2.gz BJZPWAVNQZKRLE-QGZVFWFLSA-N 1 3 337.552 2.983 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001485298637 1118216290 /nfs/dbraw/zinc/21/62/90/1118216290.db2.gz BINGVHGQWVPFKE-HKUYNNGSSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001485298637 1118216293 /nfs/dbraw/zinc/21/62/93/1118216293.db2.gz BINGVHGQWVPFKE-HKUYNNGSSA-N 1 3 331.504 2.804 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1cccc(F)c1 ZINC001485311165 1118223376 /nfs/dbraw/zinc/22/33/76/1118223376.db2.gz YEWHGAVCLJSROY-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1cccc(F)c1 ZINC001485311165 1118223378 /nfs/dbraw/zinc/22/33/78/1118223378.db2.gz YEWHGAVCLJSROY-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+]CC/C=C\c2ccccc2)CCC1 ZINC001493574981 1118384361 /nfs/dbraw/zinc/38/43/61/1118384361.db2.gz PKNCRYJPLWADMV-GHXNOFRVSA-N 1 3 329.488 2.622 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C1C[NH+](CC[C@@H]2CCCC2(F)F)C1 ZINC001485532939 1118444271 /nfs/dbraw/zinc/44/42/71/1118444271.db2.gz LQEVOEGCSGSYLO-ZBFHGGJFSA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@@H](NC(=O)CCCC[NH+](C)C)C1CN([C@H](C)c2ccccc2)C1 ZINC001485533946 1118444638 /nfs/dbraw/zinc/44/46/38/1118444638.db2.gz WYNHZZHZEANFHW-IAGOWNOFSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCCC3CCCC3)C[C@H]21)N(C)C ZINC001485622705 1118492491 /nfs/dbraw/zinc/49/24/91/1118492491.db2.gz COFLHWWOSZACPO-HAGHYFMRSA-N 1 3 349.563 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCCC3CCCC3)C[C@H]21)N(C)C ZINC001485622705 1118492493 /nfs/dbraw/zinc/49/24/93/1118492493.db2.gz COFLHWWOSZACPO-HAGHYFMRSA-N 1 3 349.563 2.837 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CCCC3CCCC3)C[C@H]21 ZINC001485622588 1118492548 /nfs/dbraw/zinc/49/25/48/1118492548.db2.gz ADXICORKABMNRD-NNZMDNLPSA-N 1 3 344.503 2.525 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1[C@H]2C[N@H+](CCCC3CCCC3)C[C@H]21 ZINC001485622588 1118492550 /nfs/dbraw/zinc/49/25/50/1118492550.db2.gz ADXICORKABMNRD-NNZMDNLPSA-N 1 3 344.503 2.525 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c(C)c1 ZINC001485703675 1118529207 /nfs/dbraw/zinc/52/92/07/1118529207.db2.gz ZVEVNEOAYPMSOL-MISYRCLQSA-N 1 3 345.531 2.874 10 0 EFAEHO CCCN[C@H](CC[N@H+](C)CCO)c1cccc(Br)c1 ZINC000053940397 214205927 /nfs/dbraw/zinc/20/59/27/214205927.db2.gz FSDKXUOVFZEGPO-OAHLLOKOSA-N 1 3 329.282 2.804 10 0 EFAEHO CCCN[C@H](CC[N@@H+](C)CCO)c1cccc(Br)c1 ZINC000053940397 214205928 /nfs/dbraw/zinc/20/59/28/214205928.db2.gz FSDKXUOVFZEGPO-OAHLLOKOSA-N 1 3 329.282 2.804 10 0 EFAEHO C[N@H+](CC[C@@H](N)c1cccc(Br)c1)C[C@@H]1CCCO1 ZINC000053941151 214205937 /nfs/dbraw/zinc/20/59/37/214205937.db2.gz HJNFBUVJIQGQLU-LSDHHAIUSA-N 1 3 327.266 2.950 10 0 EFAEHO C[N@@H+](CC[C@@H](N)c1cccc(Br)c1)C[C@@H]1CCCO1 ZINC000053941151 214205940 /nfs/dbraw/zinc/20/59/40/214205940.db2.gz HJNFBUVJIQGQLU-LSDHHAIUSA-N 1 3 327.266 2.950 10 0 EFAEHO C[NH2+][C@@H](CCN(CCO)C(C)C)c1ccc(Br)cc1 ZINC000053972073 214207584 /nfs/dbraw/zinc/20/75/84/214207584.db2.gz BFCWNCYPHOXYJY-HNNXBMFYSA-N 1 3 329.282 2.802 10 0 EFAEHO CC(C)[NH2+]Cc1ccc(Br)cc1N(C)CCN(C)C ZINC000104204279 219360677 /nfs/dbraw/zinc/36/06/77/219360677.db2.gz PLFDTEMQCMGVBK-UHFFFAOYSA-N 1 3 328.298 2.945 10 0 EFAEHO [NH3+]CCCN[C@H](c1cccc(Br)c1)C1CCOCC1 ZINC000423197253 303379697 /nfs/dbraw/zinc/37/96/97/303379697.db2.gz YPQUWRYBDMVSRO-HNNXBMFYSA-N 1 3 327.266 2.855 10 0 EFAEHO C[N@@H+]1CC[C@H](CNC(=O)c2cccc(CN3CCCCCC3)c2)C1 ZINC000067934139 283115154 /nfs/dbraw/zinc/11/51/54/283115154.db2.gz FEUACNBZWKOUGO-GOSISDBHSA-N 1 3 329.488 2.744 10 0 EFAEHO C[N@H+]1CC[C@H](CNC(=O)c2cccc(CN3CCCCCC3)c2)C1 ZINC000067934139 283115157 /nfs/dbraw/zinc/11/51/57/283115157.db2.gz FEUACNBZWKOUGO-GOSISDBHSA-N 1 3 329.488 2.744 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)NC[C@@H](C)[NH+](CC)CC ZINC000355593184 283245644 /nfs/dbraw/zinc/24/56/44/283245644.db2.gz CASAIYVRWTZYLZ-QGZVFWFLSA-N 1 3 326.529 2.624 10 0 EFAEHO C[C@@H](NC[C@H]1CC[N@H+](C)C1)c1ccc(I)cc1 ZINC000037646835 202349328 /nfs/dbraw/zinc/34/93/28/202349328.db2.gz MRTPJLWNQUUFAC-VXGBXAGGSA-N 1 3 344.240 2.894 10 0 EFAEHO C[C@@H](NC[C@H]1CC[N@@H+](C)C1)c1ccc(I)cc1 ZINC000037646835 202349329 /nfs/dbraw/zinc/34/93/29/202349329.db2.gz MRTPJLWNQUUFAC-VXGBXAGGSA-N 1 3 344.240 2.894 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)N(C)[C@H](C)C2CCN(C)CC2)cc1 ZINC000418490861 296030197 /nfs/dbraw/zinc/03/01/97/296030197.db2.gz NLJDBSMECGQSAW-HUUCEWRRSA-N 1 3 332.492 2.578 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)c1ccc(C[NH3+])cc1)c1ccccc1 ZINC000236887402 201147325 /nfs/dbraw/zinc/14/73/25/201147325.db2.gz NSMLUMDBCKOPAN-LJQANCHMSA-N 1 3 325.456 2.958 10 0 EFAEHO C[C@@H](CC1CCOCC1)[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000414299008 244077689 /nfs/dbraw/zinc/07/76/89/244077689.db2.gz HSJHOGAXWXVTNU-SFHVURJKSA-N 1 3 346.515 2.808 10 0 EFAEHO C[C@H](c1cc2ccccc2o1)[N@H+](C)C[C@@H]1CCCN(C(=O)CN)C1 ZINC000414675844 244288388 /nfs/dbraw/zinc/28/83/88/244288388.db2.gz GSLVLFGOSDXEAW-CABCVRRESA-N 1 3 329.444 2.623 10 0 EFAEHO C[C@H](c1cc2ccccc2o1)[N@@H+](C)C[C@@H]1CCCN(C(=O)CN)C1 ZINC000414675844 244288394 /nfs/dbraw/zinc/28/83/94/244288394.db2.gz GSLVLFGOSDXEAW-CABCVRRESA-N 1 3 329.444 2.623 10 0 EFAEHO C[C@@H]1C[C@H](CN(CCO)Cc2cc(Br)cs2)CC[NH2+]1 ZINC000414752789 244326793 /nfs/dbraw/zinc/32/67/93/244326793.db2.gz CRUFYQBBVVBSQR-VXGBXAGGSA-N 1 3 347.322 2.693 10 0 EFAEHO Cn1cc(CNCCC[NH2+]Cc2cccnc2)c(-c2ccccc2)n1 ZINC000414872523 244379055 /nfs/dbraw/zinc/37/90/55/244379055.db2.gz FOTUIFARSZQGFZ-UHFFFAOYSA-N 1 3 335.455 2.752 10 0 EFAEHO c1csc(-c2n[nH]cc2CNCCC[NH2+]Cc2cccnc2)c1 ZINC000414882904 244387676 /nfs/dbraw/zinc/38/76/76/244387676.db2.gz SMWJWJYIWSGRHF-UHFFFAOYSA-N 1 3 327.457 2.803 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)NCCN(C)Cc2ccccc2)cc1 ZINC000417229531 245055076 /nfs/dbraw/zinc/05/50/76/245055076.db2.gz IOEWTQGLKXPYFI-INIZCTEOSA-N 1 3 340.471 2.638 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)N(C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000418359778 245135004 /nfs/dbraw/zinc/13/50/04/245135004.db2.gz SMIFDDWFOWYHGL-ZZJWQFMZSA-N 1 3 344.503 2.734 10 0 EFAEHO CCN(C(=O)NC[C@H](C)C[NH2+]C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418369017 245138244 /nfs/dbraw/zinc/13/82/44/245138244.db2.gz STNYVWAMNUEZOZ-ZIFCJYIRSA-N 1 3 346.519 2.709 10 0 EFAEHO CCN(C(=O)NC[C@@H]1CCC[NH2+]1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418379834 245139834 /nfs/dbraw/zinc/13/98/34/245139834.db2.gz WJNSROVSQNPBCZ-NEWSRXKRSA-N 1 3 344.503 2.605 10 0 EFAEHO CCN(C(=O)NC[C@H]([NH3+])C(C)C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418389847 245143093 /nfs/dbraw/zinc/14/30/93/245143093.db2.gz RZTJTKKPCMAEES-WDSOQIARSA-N 1 3 346.519 2.837 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000418488510 245171291 /nfs/dbraw/zinc/17/12/91/245171291.db2.gz KUPLWLBYBQMOQC-MRXNPFEDSA-N 1 3 332.492 2.724 10 0 EFAEHO CCCN(CC[NH+]1CCCCCC1)C(=O)NC[C@H](N)c1ccccc1 ZINC000418459390 245166609 /nfs/dbraw/zinc/16/66/09/245166609.db2.gz YENZSGRBZVAWEF-IBGZPJMESA-N 1 3 346.519 2.984 10 0 EFAEHO CCCN(CCC[NH+](C)C)C(=O)NC[C@H](N)c1ccccc1CC ZINC000418656717 245230680 /nfs/dbraw/zinc/23/06/80/245230680.db2.gz SURCKADUYNPOLO-SFHVURJKSA-N 1 3 334.508 2.622 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000418656868 245231545 /nfs/dbraw/zinc/23/15/45/245231545.db2.gz SYEHRQNUGHDMHC-PKOBYXMFSA-N 1 3 344.503 2.519 10 0 EFAEHO C[C@H](CCC[NH3+])NC(=O)N1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000418700182 245250705 /nfs/dbraw/zinc/25/07/05/245250705.db2.gz JDAPXLSCATUDJX-OAHLLOKOSA-N 1 3 326.529 2.656 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCN(C(=O)N[C@@H]2CC[C@H](C[NH3+])C2)CC1 ZINC000418789989 245294096 /nfs/dbraw/zinc/29/40/96/245294096.db2.gz MKFDCRIEQGOUIK-JKSUJKDBSA-N 1 3 338.540 2.656 10 0 EFAEHO C[NH+](C)CC1CCN([C@@H](CN)c2cc(Br)cs2)CC1 ZINC000042392299 204093687 /nfs/dbraw/zinc/09/36/87/204093687.db2.gz VFDJGOOYVWANNX-ZDUSSCGKSA-N 1 3 346.338 2.784 10 0 EFAEHO C[C@@H]1CC[C@@H](C[NH3+])CN1CCOc1cccc(Br)c1 ZINC000042427535 204097388 /nfs/dbraw/zinc/09/73/88/204097388.db2.gz COYZVGUJSYIONJ-OLZOCXBDSA-N 1 3 327.266 2.887 10 0 EFAEHO CC(C)CN(CC[NH+](C)C)c1cc(Br)ccc1CN ZINC000042777774 204144663 /nfs/dbraw/zinc/14/46/63/204144663.db2.gz BWQGISYNVFFEAK-UHFFFAOYSA-N 1 3 328.298 2.932 10 0 EFAEHO CN(c1ccccc1C[N@H+]1[C@@H]2CC[C@H]1CC(O)C2)C1CCN(C)CC1 ZINC000126709668 205068735 /nfs/dbraw/zinc/06/87/35/205068735.db2.gz QWXNINJZZPAYKX-YOFSQIOKSA-N 1 3 343.515 2.705 10 0 EFAEHO CN(c1ccccc1C[N@@H+]1[C@@H]2CC[C@H]1CC(O)C2)C1CCN(C)CC1 ZINC000126709668 205068740 /nfs/dbraw/zinc/06/87/40/205068740.db2.gz QWXNINJZZPAYKX-YOFSQIOKSA-N 1 3 343.515 2.705 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@@H](c2ccccc2)N(C)C)[C@H](C)C1 ZINC000127828948 205118226 /nfs/dbraw/zinc/11/82/26/205118226.db2.gz AGTIGYIWTBRGPV-NEWSRXKRSA-N 1 3 346.519 2.661 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NC[C@@H](c2ccccc2)N(C)C)[C@H](C)C1 ZINC000127828948 205118229 /nfs/dbraw/zinc/11/82/29/205118229.db2.gz AGTIGYIWTBRGPV-NEWSRXKRSA-N 1 3 346.519 2.661 10 0 EFAEHO CCC[C@H](N)C(=O)N(C)C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000246183162 205183327 /nfs/dbraw/zinc/18/33/27/205183327.db2.gz CIJXXOMZUFTTKH-NUJGCVRESA-N 1 3 331.504 2.729 10 0 EFAEHO C[C@@H]([NH2+]C[C@H]1CC[C@H](C(N)=O)CC1)c1ccc(OCCN(C)C)cc1 ZINC000421850043 246136974 /nfs/dbraw/zinc/13/69/74/246136974.db2.gz COXGTNOPBRCQIT-JFIYKMOQSA-N 1 3 347.503 2.569 10 0 EFAEHO C[C@@H]([NH2+]C[C@H]1CC[C@H](C(N)=O)CC1)c1cccc(OCCN(C)C)c1 ZINC000421850012 246139000 /nfs/dbraw/zinc/13/90/00/246139000.db2.gz CLBMIWLRJBMVRV-BRWVUGGUSA-N 1 3 347.503 2.569 10 0 EFAEHO OC1(CN2CC[C@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)CCOCC1 ZINC000157173510 206121569 /nfs/dbraw/zinc/12/15/69/206121569.db2.gz CTTDULMLPKPJNF-UXHICEINSA-N 1 3 344.499 2.514 10 0 EFAEHO OC1(CN2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)CCOCC1 ZINC000157173510 206121574 /nfs/dbraw/zinc/12/15/74/206121574.db2.gz CTTDULMLPKPJNF-UXHICEINSA-N 1 3 344.499 2.514 10 0 EFAEHO C[NH+](C)C1CCC(NC(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000422005016 246213239 /nfs/dbraw/zinc/21/32/39/246213239.db2.gz IDUKUCFMSDFPRU-UHFFFAOYSA-N 1 3 329.488 2.885 10 0 EFAEHO CC(C)N(CCN(C)C)C(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000157317463 206129159 /nfs/dbraw/zinc/12/91/59/206129159.db2.gz GWGBGGUWIFVEFF-UHFFFAOYSA-N 1 3 346.519 2.764 10 0 EFAEHO CN1CCN(CC[NH2+]Cc2ccccc2OCC2CC2)CC1(C)C ZINC000441340664 250022133 /nfs/dbraw/zinc/02/21/33/250022133.db2.gz KNDPWPZKRDCLQE-UHFFFAOYSA-N 1 3 331.504 2.591 10 0 EFAEHO CC[N@H+](C)C[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000174511570 207026099 /nfs/dbraw/zinc/02/60/99/207026099.db2.gz DAIQKZIWQDECCG-SFHVURJKSA-N 1 3 329.488 2.696 10 0 EFAEHO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000174511570 207026103 /nfs/dbraw/zinc/02/61/03/207026103.db2.gz DAIQKZIWQDECCG-SFHVURJKSA-N 1 3 329.488 2.696 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@@H](CO)[C@@H]2CC)CC1 ZINC000449431916 251023202 /nfs/dbraw/zinc/02/32/02/251023202.db2.gz ZPXXAHVGWZEUMD-PMACEKPBSA-N 1 3 345.531 2.811 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@@H](CO)[C@@H]2CC)CC1 ZINC000449431916 251023206 /nfs/dbraw/zinc/02/32/06/251023206.db2.gz ZPXXAHVGWZEUMD-PMACEKPBSA-N 1 3 345.531 2.811 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)c1cccc(SC)c1 ZINC000449825619 251169787 /nfs/dbraw/zinc/16/97/87/251169787.db2.gz PSQQVLDNJBBHET-QGZVFWFLSA-N 1 3 349.544 2.897 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)c1cccc(SC)c1 ZINC000449825619 251169789 /nfs/dbraw/zinc/16/97/89/251169789.db2.gz PSQQVLDNJBBHET-QGZVFWFLSA-N 1 3 349.544 2.897 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@H](NC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000177468029 207340322 /nfs/dbraw/zinc/34/03/22/207340322.db2.gz BFNKGIGREKEIOY-OALUTQOASA-N 1 3 329.488 2.885 10 0 EFAEHO COC[C@@H](O)C[N@@H+]1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000453026481 252021092 /nfs/dbraw/zinc/02/10/92/252021092.db2.gz UTLZODZUBSXREQ-PMACEKPBSA-N 1 3 346.515 2.616 10 0 EFAEHO COC[C@@H](O)C[N@H+]1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000453026481 252021094 /nfs/dbraw/zinc/02/10/94/252021094.db2.gz UTLZODZUBSXREQ-PMACEKPBSA-N 1 3 346.515 2.616 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CCN(C2CC2)C1 ZINC000268798736 252251658 /nfs/dbraw/zinc/25/16/58/252251658.db2.gz GXNFOJNIIPBCQI-SLYNCCJLSA-N 1 3 327.516 2.971 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCCN1CCSCC1 ZINC000268863709 252311894 /nfs/dbraw/zinc/31/18/94/252311894.db2.gz GUVMPENYKNLXJW-PKOBYXMFSA-N 1 3 333.545 2.535 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCCN1CCSCC1 ZINC000268863709 252311896 /nfs/dbraw/zinc/31/18/96/252311896.db2.gz GUVMPENYKNLXJW-PKOBYXMFSA-N 1 3 333.545 2.535 10 0 EFAEHO OC1(CN2CC[C@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)CCOCC1 ZINC000157173346 285237846 /nfs/dbraw/zinc/23/78/46/285237846.db2.gz CTTDULMLPKPJNF-PMACEKPBSA-N 1 3 344.499 2.514 10 0 EFAEHO OC1(CN2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)CCOCC1 ZINC000157173346 285237848 /nfs/dbraw/zinc/23/78/48/285237848.db2.gz CTTDULMLPKPJNF-PMACEKPBSA-N 1 3 344.499 2.514 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)C1CCC(F)(F)CC1 ZINC000340135493 285275539 /nfs/dbraw/zinc/27/55/39/285275539.db2.gz USGKPCGQPZQXOM-INIZCTEOSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)C1CCC(F)(F)CC1 ZINC000340135493 285275544 /nfs/dbraw/zinc/27/55/44/285275544.db2.gz USGKPCGQPZQXOM-INIZCTEOSA-N 1 3 345.478 2.686 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN2CC[C@@H](C(C)(C)C)[C@H](O)C2)cc1 ZINC000680476841 549331459 /nfs/dbraw/zinc/33/14/59/549331459.db2.gz URBKBWIIHVFXKA-RTBURBONSA-N 1 3 334.504 2.856 10 0 EFAEHO C[C@@H](O)C[NH+]1CCC(CN(C)Cc2ccc(Br)o2)CC1 ZINC000191338112 533665559 /nfs/dbraw/zinc/66/55/59/533665559.db2.gz WDYGYHCRLVRGDS-GFCCVEGCSA-N 1 3 345.281 2.567 10 0 EFAEHO CC[NH+](CC)CCO[C@H]1CCN(Cc2cc(-n3ccnc3)cs2)C1 ZINC000346232892 142172638 /nfs/dbraw/zinc/17/26/38/142172638.db2.gz YXTBCVVVNGOKQD-KRWDZBQOSA-N 1 3 348.516 2.867 10 0 EFAEHO COC(C)(C)CCN1CCN(c2ccccc2OCC[NH+](C)C)CC1 ZINC000346432911 142203813 /nfs/dbraw/zinc/20/38/13/142203813.db2.gz KPEBBEUHMRXOJT-UHFFFAOYSA-N 1 3 349.519 2.564 10 0 EFAEHO COCCN1CCC[C@@H]1C[NH2+][C@H](C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000348047518 142313584 /nfs/dbraw/zinc/31/35/84/142313584.db2.gz STISDUKCNDULBK-HMXCVIKNSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCCCNC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000349660297 142344168 /nfs/dbraw/zinc/34/41/68/142344168.db2.gz BENDOWNLBRWXHY-WMZOPIPTSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCCCNC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000349660297 142344169 /nfs/dbraw/zinc/34/41/69/142344169.db2.gz BENDOWNLBRWXHY-WMZOPIPTSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000349660290 142344266 /nfs/dbraw/zinc/34/42/66/142344266.db2.gz BENDOWNLBRWXHY-AEFFLSMTSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000349660290 142344269 /nfs/dbraw/zinc/34/42/69/142344269.db2.gz BENDOWNLBRWXHY-AEFFLSMTSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN1CC[C@H](C[NH2+]Cc2ccc(OC)c3oc(C(=O)OC)cc32)C1 ZINC000343553815 145236562 /nfs/dbraw/zinc/23/65/62/145236562.db2.gz DJNJPOPLEHTYDV-CYBMUJFWSA-N 1 3 346.427 2.659 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CNC1CC[NH+](C2CCC2)CC1 ZINC000344139179 145377513 /nfs/dbraw/zinc/37/75/13/145377513.db2.gz YVEWSXOLSNWUNA-UHFFFAOYSA-N 1 3 325.460 2.682 10 0 EFAEHO O=C(CCN1CCc2ccccc2C1)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000348909249 146023148 /nfs/dbraw/zinc/02/31/48/146023148.db2.gz IKOCHCXHJRJBDP-FQEVSTJZSA-N 1 3 341.499 2.522 10 0 EFAEHO CCCC[NH+]1CCC(NC(=O)CCN2CCc3ccccc3C2)CC1 ZINC000348912807 146023517 /nfs/dbraw/zinc/02/35/17/146023517.db2.gz PZWMAFQCNURMMF-UHFFFAOYSA-N 1 3 343.515 2.816 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000350733274 146085702 /nfs/dbraw/zinc/08/57/02/146085702.db2.gz ZGYZCOBSZSRBHS-MJGOQNOKSA-N 1 3 346.519 2.633 10 0 EFAEHO CCOC(=O)COCCN1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000351531106 146140054 /nfs/dbraw/zinc/14/00/54/146140054.db2.gz CRXJPSNVGSTHGG-KRWDZBQOSA-N 1 3 340.508 2.543 10 0 EFAEHO CCOC(=O)COCCN1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000351531106 146140055 /nfs/dbraw/zinc/14/00/55/146140055.db2.gz CRXJPSNVGSTHGG-KRWDZBQOSA-N 1 3 340.508 2.543 10 0 EFAEHO C(=C/C[N@@H+]1CC[C@@]2(C1)CCCOC2)\CN1CC[C@@]2(C1)CCCOC2 ZINC000368504007 150135071 /nfs/dbraw/zinc/13/50/71/150135071.db2.gz OJURGGIHSNYSIN-RHZFVVMASA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C/C[N@H+]1CC[C@@]2(C1)CCCOC2)\CN1CC[C@@]2(C1)CCCOC2 ZINC000368504007 150135074 /nfs/dbraw/zinc/13/50/74/150135074.db2.gz OJURGGIHSNYSIN-RHZFVVMASA-N 1 3 334.504 2.548 10 0 EFAEHO O=C(NC[C@@H]1CCCCN1C1CC1)N1CCC(C[NH+]2CCCC2)CC1 ZINC000373121099 151116949 /nfs/dbraw/zinc/11/69/49/151116949.db2.gz KDEBAFAOWORKBI-IBGZPJMESA-N 1 3 348.535 2.521 10 0 EFAEHO C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]C1CC(N2CCCCC2)C1 ZINC000373522644 151183861 /nfs/dbraw/zinc/18/38/61/151183861.db2.gz NJWVRXZVMDQXHP-VWEINGBSSA-N 1 3 342.531 2.899 10 0 EFAEHO CCO[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCN(CC(C)C)C2)C12CCOCC2 ZINC000186426007 286283631 /nfs/dbraw/zinc/28/36/31/286283631.db2.gz LTEHKLOXUJKWBU-IPMKNSEASA-N 1 3 338.536 2.918 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]CC2(N3CCCCC3)CCN(C)CC2)C12CCC2 ZINC000181827560 286384484 /nfs/dbraw/zinc/38/44/84/286384484.db2.gz SYHJNFHVDALQRD-RBUKOAKNSA-N 1 3 349.563 2.874 10 0 EFAEHO Cc1ccc(OC(F)F)c(CNCCC[N@H+]2CCCN(C)CC2)c1 ZINC000176228259 544883917 /nfs/dbraw/zinc/88/39/17/544883917.db2.gz WQALVGBEBOFLAY-UHFFFAOYSA-N 1 3 341.446 2.714 10 0 EFAEHO Cc1ccc(OC(F)F)c(CNCCC[N@@H+]2CCCN(C)CC2)c1 ZINC000176228259 544883919 /nfs/dbraw/zinc/88/39/19/544883919.db2.gz WQALVGBEBOFLAY-UHFFFAOYSA-N 1 3 341.446 2.714 10 0 EFAEHO CCO[C@@H]1C[C@@H]([NH2+]C2CCN(C3CCCC3)CC2)C12CCOCC2 ZINC000186374523 265064010 /nfs/dbraw/zinc/06/40/10/265064010.db2.gz YQBMPMKRXZZIDT-RTBURBONSA-N 1 3 336.520 2.957 10 0 EFAEHO CCO[C@@H]1C[C@@H](NC2CC[NH+](C3CCCC3)CC2)C12CCOCC2 ZINC000186374523 265064012 /nfs/dbraw/zinc/06/40/12/265064012.db2.gz YQBMPMKRXZZIDT-RTBURBONSA-N 1 3 336.520 2.957 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+](CCc2nccs2)C(C)C)CC1 ZINC000192778080 265308543 /nfs/dbraw/zinc/30/85/43/265308543.db2.gz YFPUQHKKTGNEKT-UHFFFAOYSA-N 1 3 338.565 2.812 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+](CCc2nccs2)C(C)C)CC1 ZINC000192778080 265308545 /nfs/dbraw/zinc/30/85/45/265308545.db2.gz YFPUQHKKTGNEKT-UHFFFAOYSA-N 1 3 338.565 2.812 10 0 EFAEHO c1ccc(CN2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCN2CCSCC2)C3)cc1 ZINC000272444560 266266714 /nfs/dbraw/zinc/26/67/14/266266714.db2.gz UMGQBUSJUGZNLS-OWZKRDHZSA-N 1 3 345.556 2.820 10 0 EFAEHO c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H](NCCN2CCSCC2)C3)cc1 ZINC000272444560 266266716 /nfs/dbraw/zinc/26/67/16/266266716.db2.gz UMGQBUSJUGZNLS-OWZKRDHZSA-N 1 3 345.556 2.820 10 0 EFAEHO c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H](NCCN2CCSCC2)C3)cc1 ZINC000272444560 266266718 /nfs/dbraw/zinc/26/67/18/266266718.db2.gz UMGQBUSJUGZNLS-OWZKRDHZSA-N 1 3 345.556 2.820 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)c1cc2cc(Cl)ccc2o1 ZINC000103211175 273000949 /nfs/dbraw/zinc/00/09/49/273000949.db2.gz LXNAWJRKUMXMCE-UHFFFAOYSA-N 1 3 337.851 2.652 10 0 EFAEHO CC[NH+](CC)Cc1ccc(CNC(=O)CC2CCN(C)CC2)cc1 ZINC000273262330 266474945 /nfs/dbraw/zinc/47/49/45/266474945.db2.gz NEIXHEYRXXHUCQ-UHFFFAOYSA-N 1 3 331.504 2.877 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000107835464 273008392 /nfs/dbraw/zinc/00/83/92/273008392.db2.gz BSDJEBVKXYIQQW-ZWKOTPCHSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@H](c2ccccc2)N2CCCC2)CC[N@@H+]1C ZINC000279256528 273194117 /nfs/dbraw/zinc/19/41/17/273194117.db2.gz UMIRASZHQMLQBU-YTQUADARSA-N 1 3 329.488 2.670 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@H](c2ccccc2)N2CCCC2)CC[N@H+]1C ZINC000279256528 273194118 /nfs/dbraw/zinc/19/41/18/273194118.db2.gz UMIRASZHQMLQBU-YTQUADARSA-N 1 3 329.488 2.670 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000356384684 276006416 /nfs/dbraw/zinc/00/64/16/276006416.db2.gz CRLJZCZZJXZSKV-GUDVDZBRSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000356384684 276006417 /nfs/dbraw/zinc/00/64/17/276006417.db2.gz CRLJZCZZJXZSKV-GUDVDZBRSA-N 1 3 335.536 2.974 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000245903692 276364701 /nfs/dbraw/zinc/36/47/01/276364701.db2.gz LRYWWVGGRIEBEZ-OALUTQOASA-N 1 3 335.536 2.975 10 0 EFAEHO CN(c1ccccc1C[NH2+][C@@H]1CCC[C@H](CO)C1)C1CCN(C)CC1 ZINC000414574097 276870217 /nfs/dbraw/zinc/87/02/17/276870217.db2.gz MHGGUHGJRNEZEF-PKOBYXMFSA-N 1 3 345.531 2.858 10 0 EFAEHO CN(c1ccccc1C[NH2+]C[C@H]1CCCC[C@H]1O)C1CCN(C)CC1 ZINC000246585085 277003251 /nfs/dbraw/zinc/00/32/51/277003251.db2.gz SRHOJJIENAJGQB-WIYYLYMNSA-N 1 3 345.531 2.858 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCN1C[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)[C@H]2C1 ZINC000248558061 277061672 /nfs/dbraw/zinc/06/16/72/277061672.db2.gz BWXOTKKORZZSEF-VVLHAWIVSA-N 1 3 337.508 2.706 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCN1C[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)[C@H]2C1 ZINC000248558061 277061673 /nfs/dbraw/zinc/06/16/73/277061673.db2.gz BWXOTKKORZZSEF-VVLHAWIVSA-N 1 3 337.508 2.706 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@@H]1CSc2ccc(Br)cc21 ZINC000423088897 277563818 /nfs/dbraw/zinc/56/38/18/277563818.db2.gz RFADXNAOPUBSEW-DGCLKSJQSA-N 1 3 345.306 2.939 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@@H]1CCN(C2CC2)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000358105947 278237113 /nfs/dbraw/zinc/23/71/13/278237113.db2.gz WVHUJIVCXJUTBP-FRQCXROJSA-N 1 3 348.535 2.518 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@@H]1CCN(C2CC2)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000358105947 278237114 /nfs/dbraw/zinc/23/71/14/278237114.db2.gz WVHUJIVCXJUTBP-FRQCXROJSA-N 1 3 348.535 2.518 10 0 EFAEHO C[C@@H](CNC(=O)CCN1CCc2ccccc2C1)[N@@H+]1CCCC[C@@H]1C ZINC000416132308 278269426 /nfs/dbraw/zinc/26/94/26/278269426.db2.gz KSACXBREMKBVMG-ROUUACIJSA-N 1 3 343.515 2.814 10 0 EFAEHO C[C@@H](CNC(=O)CCN1CCc2ccccc2C1)[N@H+]1CCCC[C@@H]1C ZINC000416132308 278269429 /nfs/dbraw/zinc/26/94/29/278269429.db2.gz KSACXBREMKBVMG-ROUUACIJSA-N 1 3 343.515 2.814 10 0 EFAEHO C[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)[C@@H]1CCCC[NH2+]1 ZINC000422771502 278341797 /nfs/dbraw/zinc/34/17/97/278341797.db2.gz VRKQXBLWRQTLAB-APWZRJJASA-N 1 3 329.488 2.659 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)NC[C@H](N)c2ccccc2)C1 ZINC000417216038 278884364 /nfs/dbraw/zinc/88/43/64/278884364.db2.gz AVGZPPVHIFUHST-NUJGCVRESA-N 1 3 346.519 2.742 10 0 EFAEHO CCN1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H]2CN(C)C[C@H]2C)CC1 ZINC000361182722 279375101 /nfs/dbraw/zinc/37/51/01/279375101.db2.gz HDVJEYBTTVFDQT-JTDSTZFVSA-N 1 3 348.510 2.568 10 0 EFAEHO C[C@@H]1CN(CC2CC[NH+](C[C@@](C)(O)c3ccccc3)CC2)C[C@@H](C)O1 ZINC000246199711 288153599 /nfs/dbraw/zinc/15/35/99/288153599.db2.gz LMVANNWIGARSIW-DBXWQHBBSA-N 1 3 346.515 2.715 10 0 EFAEHO O=C(Nc1ccc2c(c1)CNC2)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000415993662 280025839 /nfs/dbraw/zinc/02/58/39/280025839.db2.gz FTSVNPDOPCQGIN-HNAYVOBHSA-N 1 3 340.471 2.770 10 0 EFAEHO O=C(Nc1ccc2c(c1)CNC2)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000415993662 280025841 /nfs/dbraw/zinc/02/58/41/280025841.db2.gz FTSVNPDOPCQGIN-HNAYVOBHSA-N 1 3 340.471 2.770 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)N(C)C ZINC000130342925 280174933 /nfs/dbraw/zinc/17/49/33/280174933.db2.gz PTWKWQXRPKWVDP-OIISXLGYSA-N 1 3 337.533 2.833 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)N(C)C ZINC000130342925 280174934 /nfs/dbraw/zinc/17/49/34/280174934.db2.gz PTWKWQXRPKWVDP-OIISXLGYSA-N 1 3 337.533 2.833 10 0 EFAEHO COCC[C@H]1CCC[C@@H]1[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000367078852 292716838 /nfs/dbraw/zinc/71/68/38/292716838.db2.gz SFYWQFVHMLNCHA-MOPGFXCFSA-N 1 3 337.552 2.732 10 0 EFAEHO CN(C)[C@H](CC(=O)N1CCC[C@H]1C[NH+]1CCCC1)c1ccccc1 ZINC000416142074 289350312 /nfs/dbraw/zinc/35/03/12/289350312.db2.gz FNCZUFZMLFGMCY-RBUKOAKNSA-N 1 3 329.488 2.766 10 0 EFAEHO C[C@H]1CC2(CN1CC(=O)NC13CC4CC(CC(C4)C1)C3)CC[NH2+]CC2 ZINC000424288660 290363310 /nfs/dbraw/zinc/36/33/10/290363310.db2.gz KWQBGXQLXCENQM-SIHNGCNOSA-N 1 3 345.531 2.535 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000129076004 293123559 /nfs/dbraw/zinc/12/35/59/293123559.db2.gz SGQBOWROLRUCOD-MSOLQXFVSA-N 1 3 340.556 2.630 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NC[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000129076004 293123560 /nfs/dbraw/zinc/12/35/60/293123560.db2.gz SGQBOWROLRUCOD-MSOLQXFVSA-N 1 3 340.556 2.630 10 0 EFAEHO C[C@@H](C[NH2+]C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)CN1CCCC1 ZINC000130007098 293150692 /nfs/dbraw/zinc/15/06/92/293150692.db2.gz QFNQDSFYSXXDCT-DLBZAZTESA-N 1 3 339.524 2.955 10 0 EFAEHO CCCC[NH+]1CCC(NC(=O)N[C@H](CC(C)C)CN(C)C)CC1 ZINC000158680361 293582187 /nfs/dbraw/zinc/58/21/87/293582187.db2.gz IVAKVYSISDYTQU-QGZVFWFLSA-N 1 3 326.529 2.526 10 0 EFAEHO COc1ccc(C)cc1C1(C[NH2+][C@H]2CCC[C@@H]2CN)CCOCC1 ZINC000422897684 295104399 /nfs/dbraw/zinc/10/43/99/295104399.db2.gz KDCVUTXEUSAGIX-AEFFLSMTSA-N 1 3 332.488 2.769 10 0 EFAEHO CC[C@H](N[C@@H](C)c1ccc(OCC[NH+](C)C)cc1)[C@H](O)C(F)F ZINC000295865374 295388419 /nfs/dbraw/zinc/38/84/19/295388419.db2.gz BUAZPEZPSBRVOF-RCBQFDQVSA-N 1 3 330.419 2.682 10 0 EFAEHO O=C(C[NH2+][C@H]1CCCCC12CCCC2)NC1CCN(C2CC2)CC1 ZINC000361595972 295522698 /nfs/dbraw/zinc/52/26/98/295522698.db2.gz QEYPHTYEIFEOTE-SFHVURJKSA-N 1 3 333.520 2.822 10 0 EFAEHO CN1CCN(CCCC[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000166146791 310733571 /nfs/dbraw/zinc/73/35/71/310733571.db2.gz BYBMSZIDOGRVJX-PZJWPPBQSA-N 1 3 345.531 2.772 10 0 EFAEHO CCOc1cc(C[NH2+]CCCC[NH+](C)C)cc(Br)c1[O-] ZINC000298316768 310978148 /nfs/dbraw/zinc/97/81/48/310978148.db2.gz IBJIRBPRCFGZCC-UHFFFAOYSA-N 1 3 345.281 2.985 10 0 EFAEHO CC[NH+](CC)CCOc1ccccc1NC(=O)NC[C@@H]1CCCN1C ZINC000299238965 311064553 /nfs/dbraw/zinc/06/45/53/311064553.db2.gz JFLPYKFJRCPZRZ-INIZCTEOSA-N 1 3 348.491 2.623 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@H](O)COc2c(Cl)cccc2Cl)CC[N@@H+]1C ZINC000316874814 311235566 /nfs/dbraw/zinc/23/55/66/311235566.db2.gz WWGPNWALDHJHRI-AGIUHOORSA-N 1 3 347.286 2.805 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@H](O)COc2c(Cl)cccc2Cl)CC[N@H+]1C ZINC000316874814 311235567 /nfs/dbraw/zinc/23/55/67/311235567.db2.gz WWGPNWALDHJHRI-AGIUHOORSA-N 1 3 347.286 2.805 10 0 EFAEHO COC1(C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCCC1 ZINC000397562375 311960661 /nfs/dbraw/zinc/96/06/61/311960661.db2.gz YHDKROUWSGRQNT-UHFFFAOYSA-N 1 3 332.488 2.562 10 0 EFAEHO CC(C)[C@H]1C[C@@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCO1 ZINC000397576655 311960691 /nfs/dbraw/zinc/96/06/91/311960691.db2.gz CRJFHSDEXCNTSK-VQTJNVASSA-N 1 3 346.515 2.807 10 0 EFAEHO OC1(C[NH2+][C@@H]2CCOC3(CCC3)C2)CCN(Cc2ccccc2)CC1 ZINC000397656845 311961028 /nfs/dbraw/zinc/96/10/28/311961028.db2.gz YSEQEGRLVGFCIU-LJQANCHMSA-N 1 3 344.499 2.705 10 0 EFAEHO Clc1ccc(OC[C@@H]2CCCO2)c(CNCC[C@H]2CC[NH2+]C2)c1 ZINC000414824523 312054596 /nfs/dbraw/zinc/05/45/96/312054596.db2.gz AUMPCARJUJLLIZ-PBHICJAKSA-N 1 3 338.879 2.987 10 0 EFAEHO COc1cc(Br)c(CNCC[C@@H]2CC[NH2+]C2)c(OC)c1 ZINC000414827177 312054984 /nfs/dbraw/zinc/05/49/84/312054984.db2.gz GUIKQYLSLBNKTP-NSHDSACASA-N 1 3 343.265 2.556 10 0 EFAEHO COCC1(CNCc2ncc(-c3ccccc3)s2)CC[NH2+]CC1 ZINC000414965859 312068346 /nfs/dbraw/zinc/06/83/46/312068346.db2.gz AVGPKEPKPXUZEJ-UHFFFAOYSA-N 1 3 331.485 2.916 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+][C@@H]1CCCCNC1 ZINC000415064616 312086603 /nfs/dbraw/zinc/08/66/03/312086603.db2.gz DAROQHHNLFHCRE-RHSMWYFYSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+][C@H]1CCCCNC1 ZINC000415064615 312086774 /nfs/dbraw/zinc/08/67/74/312086774.db2.gz DAROQHHNLFHCRE-PBHICJAKSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+][C@@H]1CCCCNC1 ZINC000415070556 312087943 /nfs/dbraw/zinc/08/79/43/312087943.db2.gz QYGMGNWSIBCUTG-GDBMZVCRSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+][C@H]1CCCCNC1 ZINC000415070559 312087997 /nfs/dbraw/zinc/08/79/97/312087997.db2.gz QYGMGNWSIBCUTG-ZBFHGGJFSA-N 1 3 337.895 2.809 10 0 EFAEHO CN(C)CCc1ccccc1NC(=O)N1CCC2(CC[NH2+]CC2)CC1 ZINC000415554028 312151583 /nfs/dbraw/zinc/15/15/83/312151583.db2.gz AXRDELAXVVUQFE-UHFFFAOYSA-N 1 3 344.503 2.788 10 0 EFAEHO O=C(Nc1ccc2c(c1F)CCNC2)N1CCC[C@H]1C[NH+]1CCCC1 ZINC000415953078 312184209 /nfs/dbraw/zinc/18/42/09/312184209.db2.gz HZXPBWAXSOGZNL-HNNXBMFYSA-N 1 3 346.450 2.564 10 0 EFAEHO CC[NH2+]Cc1ccccc1NC(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000415958721 312185275 /nfs/dbraw/zinc/18/52/75/312185275.db2.gz RHEGTEQSLBNWNS-KRWDZBQOSA-N 1 3 330.476 2.888 10 0 EFAEHO O=C(Nc1ccc2c(c1F)CCNC2)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000415960587 312185296 /nfs/dbraw/zinc/18/52/96/312185296.db2.gz QIKOUKNDVOVENB-HNNXBMFYSA-N 1 3 346.450 2.564 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)[C@@H](C)C1 ZINC000415963886 312186544 /nfs/dbraw/zinc/18/65/44/312186544.db2.gz WKQVQIUGDIIXEJ-GUYCJALGSA-N 1 3 348.466 2.665 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)[C@@H](C)C1 ZINC000415963886 312186545 /nfs/dbraw/zinc/18/65/45/312186545.db2.gz WKQVQIUGDIIXEJ-GUYCJALGSA-N 1 3 348.466 2.665 10 0 EFAEHO C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415976034 312188570 /nfs/dbraw/zinc/18/85/70/312188570.db2.gz QPTIIQRGMPBESI-CYBMUJFWSA-N 1 3 348.466 2.665 10 0 EFAEHO FC(F)CN1CC[C@@H](NC2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000417378422 312216402 /nfs/dbraw/zinc/21/64/02/312216402.db2.gz FHSMOTYNQPFEHX-GOSISDBHSA-N 1 3 337.458 2.623 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)NC[C@H](N)c1ccccc1 ZINC000417556756 312239644 /nfs/dbraw/zinc/23/96/44/312239644.db2.gz PXLSWLOIVSAUCL-MSOLQXFVSA-N 1 3 332.492 2.640 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)NC[C@H](N)c1ccccc1 ZINC000417556756 312239645 /nfs/dbraw/zinc/23/96/45/312239645.db2.gz PXLSWLOIVSAUCL-MSOLQXFVSA-N 1 3 332.492 2.640 10 0 EFAEHO C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N2CCNC(C)(C)C2)CC1 ZINC000417677553 312255563 /nfs/dbraw/zinc/25/55/63/312255563.db2.gz FZQOSHGPPWDSJC-MRXNPFEDSA-N 1 3 344.503 2.605 10 0 EFAEHO Cc1cc(NC(=O)CC2CCN(C)CC2)ccc1OCC[NH+](C)C ZINC000458224566 313087402 /nfs/dbraw/zinc/08/74/02/313087402.db2.gz XGZXXKNISPBDFO-UHFFFAOYSA-N 1 3 333.476 2.606 10 0 EFAEHO Cc1cc(NC(=O)CC2CC[NH+](C)CC2)ccc1OCCN(C)C ZINC000458224566 313087405 /nfs/dbraw/zinc/08/74/05/313087405.db2.gz XGZXXKNISPBDFO-UHFFFAOYSA-N 1 3 333.476 2.606 10 0 EFAEHO CCCC[N@H+](C)CCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475116280 313218302 /nfs/dbraw/zinc/21/83/02/313218302.db2.gz JJTWRLIPIBACBP-IBGZPJMESA-N 1 3 346.519 2.634 10 0 EFAEHO CCCC[N@@H+](C)CCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475116280 313218304 /nfs/dbraw/zinc/21/83/04/313218304.db2.gz JJTWRLIPIBACBP-IBGZPJMESA-N 1 3 346.519 2.634 10 0 EFAEHO CCCN1CC[C@H](C[NH2+][C@@H](C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1 ZINC000496297958 315017735 /nfs/dbraw/zinc/01/77/35/315017735.db2.gz YDBCTEVGSWYVRO-BBWFWOEESA-N 1 3 339.524 2.953 10 0 EFAEHO CCC[NH+](CCC)CCCNC(=O)N1CCc2ccccc2[C@@H]1CN ZINC000516649677 315694447 /nfs/dbraw/zinc/69/44/47/315694447.db2.gz YMQSBLOKXTZNRK-IBGZPJMESA-N 1 3 346.519 2.766 10 0 EFAEHO FC(F)(F)[C@H](C[NH2+]C1CCN(c2ccncc2)CC1)n1cccn1 ZINC000529636593 316935969 /nfs/dbraw/zinc/93/59/69/316935969.db2.gz DKPUPZIFQCPSJZ-HNNXBMFYSA-N 1 3 339.365 2.640 10 0 EFAEHO Clc1ccc(OCCN2CCC(CO[C@H]3CC[NH2+]C3)CC2)cc1 ZINC000530237266 317088141 /nfs/dbraw/zinc/08/81/41/317088141.db2.gz CTYUAKAAMNPLLB-SFHVURJKSA-N 1 3 338.879 2.809 10 0 EFAEHO Fc1cc2cccnc2c(CN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)c1 ZINC000530241272 317089070 /nfs/dbraw/zinc/08/90/70/317089070.db2.gz PCTLYRQRTOSPAS-LJQANCHMSA-N 1 3 343.446 2.964 10 0 EFAEHO C[C@@H]1[C@H](NCC(=O)NCC[NH+]2CCCCCC2)C[C@H]1c1ccccc1 ZINC000552064778 318241048 /nfs/dbraw/zinc/24/10/48/318241048.db2.gz OGROKZIUBZCLNJ-DFQSSKMNSA-N 1 3 343.515 2.760 10 0 EFAEHO Cc1ccccc1[C@H]([C@@H](C)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)N(C)C ZINC000555098156 318345547 /nfs/dbraw/zinc/34/55/47/318345547.db2.gz BKWOAQAPPJENDC-ZMMAXQRCSA-N 1 3 331.504 2.833 10 0 EFAEHO Cc1ccccc1[C@H]([C@@H](C)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)N(C)C ZINC000555098156 318345549 /nfs/dbraw/zinc/34/55/49/318345549.db2.gz BKWOAQAPPJENDC-ZMMAXQRCSA-N 1 3 331.504 2.833 10 0 EFAEHO CCCC[N@H+](C)C[C@@H](C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000555154051 318347072 /nfs/dbraw/zinc/34/70/72/318347072.db2.gz NELRGZWITHODIA-NZSAHSFTSA-N 1 3 346.519 2.851 10 0 EFAEHO CCCC[N@@H+](C)C[C@@H](C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000555154051 318347075 /nfs/dbraw/zinc/34/70/75/318347075.db2.gz NELRGZWITHODIA-NZSAHSFTSA-N 1 3 346.519 2.851 10 0 EFAEHO CC[C@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)C1CCOCC1 ZINC000563346380 318771392 /nfs/dbraw/zinc/77/13/92/318771392.db2.gz YSYCHDYLPHTQDT-FQEVSTJZSA-N 1 3 346.515 2.808 10 0 EFAEHO CN1CCC(C[NH2+][C@H]2CCCC(C)(C)CC2)(N2CCOCC2)CC1 ZINC000563441356 318785870 /nfs/dbraw/zinc/78/58/70/318785870.db2.gz RALYSHMZBSWDBX-SFHVURJKSA-N 1 3 337.552 2.732 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)Nc1cccc2c1CCNC2 ZINC000563498903 318789459 /nfs/dbraw/zinc/78/94/59/318789459.db2.gz CYHATCMVOHEZOR-HUUCEWRRSA-N 1 3 330.476 2.717 10 0 EFAEHO Cc1ccc(OC[C@@H](O)CNCc2cccc(C[NH+](C)C)c2)cc1 ZINC000564321683 318854389 /nfs/dbraw/zinc/85/43/89/318854389.db2.gz RADSGSULEZRGNE-IBGZPJMESA-N 1 3 328.456 2.586 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)c2ccccc2CC[NH3+])N(C)C)cc1 ZINC000565151317 318937686 /nfs/dbraw/zinc/93/76/86/318937686.db2.gz KXZVGXWMBGZWBD-LJQANCHMSA-N 1 3 325.456 2.529 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NCCc2ncc(C)cc2C)[C@@H](C)C1 ZINC000566971329 319127114 /nfs/dbraw/zinc/12/71/14/319127114.db2.gz JAKHQAUJNBFCCJ-ICSRJNTNSA-N 1 3 333.520 2.968 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NCCc2ncc(C)cc2C)[C@@H](C)C1 ZINC000566971329 319127116 /nfs/dbraw/zinc/12/71/16/319127116.db2.gz JAKHQAUJNBFCCJ-ICSRJNTNSA-N 1 3 333.520 2.968 10 0 EFAEHO COC(=O)[C@@H](C)[C@H](NCc1ccc2c(c1)C[NH2+]CC2)c1ccccc1 ZINC000566978355 319128209 /nfs/dbraw/zinc/12/82/09/319128209.db2.gz HTDZKHACXYBQFU-YWZLYKJASA-N 1 3 338.451 2.972 10 0 EFAEHO CCN(CC)C(=O)C1(NCc2ccc3c(c2)C[NH2+]CC3)CCCCC1 ZINC000567359489 319164481 /nfs/dbraw/zinc/16/44/81/319164481.db2.gz WRXTTXASJVVRCN-UHFFFAOYSA-N 1 3 343.515 2.993 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CN(C)C(=O)CN3CC[C@@H](C)C3)C2)s1 ZINC000567750834 319207321 /nfs/dbraw/zinc/20/73/21/319207321.db2.gz JOYQAHYCOOCYJT-NVXWUHKLSA-N 1 3 349.544 2.679 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CN(C)C(=O)CN3CC[C@@H](C)C3)C2)s1 ZINC000567750834 319207324 /nfs/dbraw/zinc/20/73/24/319207324.db2.gz JOYQAHYCOOCYJT-NVXWUHKLSA-N 1 3 349.544 2.679 10 0 EFAEHO CCO[C@@H]1C[C@H](N[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)[C@@H]1n1cccn1 ZINC000569330376 319370584 /nfs/dbraw/zinc/37/05/84/319370584.db2.gz VGTYYAOMEVRINN-QWFUGVESSA-N 1 3 332.492 2.502 10 0 EFAEHO CC(C)CCc1ccc(NC(=O)N(CCN(C)C)CC[NH+](C)C)nc1 ZINC000574158259 319835777 /nfs/dbraw/zinc/83/57/77/319835777.db2.gz VRBGWERSVXBFRX-UHFFFAOYSA-N 1 3 349.523 2.627 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)NCc2ccccc2CN2CCCCC2)CC[NH2+]1 ZINC000575898485 319964292 /nfs/dbraw/zinc/96/42/92/319964292.db2.gz BCAUVPULJWLKNW-APWZRJJASA-N 1 3 344.503 2.612 10 0 EFAEHO C[C@H](O)[C@@H](NC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1F ZINC000576759692 320046492 /nfs/dbraw/zinc/04/64/92/320046492.db2.gz BUMARBXRKOAKKC-IFXJQAMLSA-N 1 3 329.419 2.901 10 0 EFAEHO CN(C(=O)CCN1CCc2ccccc2C1)C(C)(C)C[NH+]1CCCC1 ZINC000577269033 320094522 /nfs/dbraw/zinc/09/45/22/320094522.db2.gz KJCBKIAUQQPLFA-UHFFFAOYSA-N 1 3 343.515 2.768 10 0 EFAEHO CC(C)OC[C@H](O)CNCc1ccccc1C[NH+]1CCC(C)CC1 ZINC000577484942 320115132 /nfs/dbraw/zinc/11/51/32/320115132.db2.gz NUMRYHDQYZCFQA-HXUWFJFHSA-N 1 3 334.504 2.794 10 0 EFAEHO [NH3+]C[C@@H]1CC[C@H](NC(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000577604629 320126444 /nfs/dbraw/zinc/12/64/44/320126444.db2.gz OYNGGHMNBGLKDV-APWZRJJASA-N 1 3 344.503 2.599 10 0 EFAEHO C[NH+](C)CC[C@@H](NC(=O)N1CCc2ccccc2[C@H]1CN)C(C)(C)C ZINC000577847607 320150325 /nfs/dbraw/zinc/15/03/25/320150325.db2.gz YLIDETAHCBWGLC-QZTJIDSGSA-N 1 3 346.519 2.621 10 0 EFAEHO [NH3+][C@@H]1C[C@@H](N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)c2ccccc21 ZINC000578617098 320222164 /nfs/dbraw/zinc/22/21/64/320222164.db2.gz VPDSFJILXJUJTJ-WTLGNFPFSA-N 1 3 327.472 2.902 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccnc(OCCN(C)C)c1)Cc1ccccc1 ZINC000182077128 323263257 /nfs/dbraw/zinc/26/32/57/323263257.db2.gz DYXFMXISQLOIRV-KRWDZBQOSA-N 1 3 327.472 2.990 10 0 EFAEHO COCC[C@H](COC)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000579770531 324025939 /nfs/dbraw/zinc/02/59/39/324025939.db2.gz NDGLNMQASBLJKJ-YSTOQKLRSA-N 1 3 332.488 2.823 10 0 EFAEHO COCC[C@H](COC)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000579770531 324025941 /nfs/dbraw/zinc/02/59/41/324025941.db2.gz NDGLNMQASBLJKJ-YSTOQKLRSA-N 1 3 332.488 2.823 10 0 EFAEHO COCC[C@H](COC)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000579770530 324026126 /nfs/dbraw/zinc/02/61/26/324026126.db2.gz NDGLNMQASBLJKJ-WTGUMLROSA-N 1 3 332.488 2.823 10 0 EFAEHO COCC[C@H](COC)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000579770530 324026128 /nfs/dbraw/zinc/02/61/28/324026128.db2.gz NDGLNMQASBLJKJ-WTGUMLROSA-N 1 3 332.488 2.823 10 0 EFAEHO CC(C)(C(=O)NC1CC([NH+]2CCCCC2)C1)[C@H](N)c1ccccc1 ZINC000579825464 324038927 /nfs/dbraw/zinc/03/89/27/324038927.db2.gz AAFXOZAUMBOYQL-DAWZGUTISA-N 1 3 329.488 2.846 10 0 EFAEHO Cc1cc(NC(=O)CC[C@H](C)[NH3+])cc(N2CCN(C(C)C)CC2)c1 ZINC000579830362 324041038 /nfs/dbraw/zinc/04/10/38/324041038.db2.gz YZNFVIIEDSGWTE-INIZCTEOSA-N 1 3 332.492 2.591 10 0 EFAEHO OC[C@H](CNC1CC[NH+](CC2CC2)CC1)Cc1ccc(F)c(F)c1 ZINC000580927062 324267275 /nfs/dbraw/zinc/26/72/75/324267275.db2.gz GWGRZPCYEFZMKL-INIZCTEOSA-N 1 3 338.442 2.580 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NCCc2cncn2C)CC1 ZINC000580934439 324269063 /nfs/dbraw/zinc/26/90/63/324269063.db2.gz QQAWYDUXXFPSLU-QGZVFWFLSA-N 1 3 326.488 2.648 10 0 EFAEHO CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)CCCC[NH3+] ZINC000581427593 324375828 /nfs/dbraw/zinc/37/58/28/324375828.db2.gz ANZFXYKNSQYIRR-UHFFFAOYSA-N 1 3 345.409 2.725 10 0 EFAEHO CN1CC[C@@H](C[N@H+](C)Cc2ccc(I)cc2)C1 ZINC000088185742 472344829 /nfs/dbraw/zinc/34/48/29/472344829.db2.gz HHWNMHNFOFWAPY-CYBMUJFWSA-N 1 3 344.240 2.675 10 0 EFAEHO CN1CC[C@@H](C[N@@H+](C)Cc2ccc(I)cc2)C1 ZINC000088185742 472344833 /nfs/dbraw/zinc/34/48/33/472344833.db2.gz HHWNMHNFOFWAPY-CYBMUJFWSA-N 1 3 344.240 2.675 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000111816735 473229027 /nfs/dbraw/zinc/22/90/27/473229027.db2.gz YEGULEHGXNRTRA-IAGOWNOFSA-N 1 3 334.508 2.536 10 0 EFAEHO C[C@@H](Cc1ccccc1)C(=O)NC1CCN(C2CC[NH+](C)CC2)CC1 ZINC000112044938 473240823 /nfs/dbraw/zinc/24/08/23/473240823.db2.gz DQXSIICOGXDIBW-KRWDZBQOSA-N 1 3 343.515 2.540 10 0 EFAEHO COC1(C[NH2+][C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CCOCC1 ZINC000096003187 473252595 /nfs/dbraw/zinc/25/25/95/473252595.db2.gz GXXSENNDAGGEPV-SLFFLAALSA-N 1 3 344.499 2.682 10 0 EFAEHO COc1cc(Br)ccc1C[NH2+]C[C@@H]1CCCN(C)C1 ZINC000096005645 473253231 /nfs/dbraw/zinc/25/32/31/473253231.db2.gz KNXPOPCQXMRNIX-LBPRGKRZSA-N 1 3 327.266 2.889 10 0 EFAEHO CCOC(C[NH+]1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)OCC ZINC000184979337 473289943 /nfs/dbraw/zinc/28/99/43/473289943.db2.gz WZKMVOPNUKAHIO-IAGOWNOFSA-N 1 3 342.524 2.597 10 0 EFAEHO C[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000113232584 473373720 /nfs/dbraw/zinc/37/37/20/473373720.db2.gz LWMFFJPHIBUPSP-QFBILLFUSA-N 1 3 327.472 2.591 10 0 EFAEHO C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000113232584 473373730 /nfs/dbraw/zinc/37/37/30/473373730.db2.gz LWMFFJPHIBUPSP-QFBILLFUSA-N 1 3 327.472 2.591 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N(C[C@@H]1CCC[NH2+]1)C1CC1 ZINC000190744001 473380848 /nfs/dbraw/zinc/38/08/48/473380848.db2.gz MKOQDJDWJZLETP-SFHVURJKSA-N 1 3 327.472 2.639 10 0 EFAEHO C[C@H]([NH2+]CCCCN1C[C@@H](C)O[C@H](C)C1)c1ccc2c(c1)OCCO2 ZINC000162857900 473391909 /nfs/dbraw/zinc/39/19/09/473391909.db2.gz QSRZBBOHOQSPON-ZACQAIPSSA-N 1 3 348.487 2.998 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2C[C@H]3CCC[C@]3([NH3+])C2)CC1 ZINC000622004345 479878424 /nfs/dbraw/zinc/87/84/24/479878424.db2.gz NPVZIOFOLRBNGH-CTNGQTDRSA-N 1 3 342.531 2.532 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+]Cc2ccnn2CC2CCC2)C[C@H](C)O1 ZINC000631075700 479878687 /nfs/dbraw/zinc/87/86/87/479878687.db2.gz SQQDYRTXSHIQMT-CALCHBBNSA-N 1 3 334.508 2.662 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+]Cc2ccc(C(F)F)nc2)C[C@H](C)O1 ZINC000631074971 479878722 /nfs/dbraw/zinc/87/87/22/479878722.db2.gz LOGOAATZOSFRFH-OKILXGFUSA-N 1 3 327.419 2.998 10 0 EFAEHO COCCc1ncc(C[NH2+]C[C@@H]2CN(C)C[C@H]2c2ccccc2)s1 ZINC000631167501 479935389 /nfs/dbraw/zinc/93/53/89/479935389.db2.gz YFZOHZCXVZRJMJ-AEFFLSMTSA-N 1 3 345.512 2.767 10 0 EFAEHO CN(Cc1ccccc1)C[C@H](O)COc1ccc(C[NH2+]C2CC2)cc1 ZINC000012430317 471774895 /nfs/dbraw/zinc/77/48/95/471774895.db2.gz ZQVFVZWQBUSYEO-FQEVSTJZSA-N 1 3 340.467 2.810 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@@H](C(C)C)C3CC3)CC2)CC1 ZINC000620044727 479970203 /nfs/dbraw/zinc/97/02/03/479970203.db2.gz NAZSPRJYUBLGMX-IBGZPJMESA-N 1 3 335.536 2.734 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000031099314 472362620 /nfs/dbraw/zinc/36/26/20/472362620.db2.gz ALHAKHOZOMRFSC-QGZVFWFLSA-N 1 3 346.519 2.681 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000057171945 472390038 /nfs/dbraw/zinc/39/00/38/472390038.db2.gz XETBGHINFDWPOX-SFHVURJKSA-N 1 3 343.515 2.889 10 0 EFAEHO C[NH+](C)C1CCN(C(C)(C)CNCc2cc(F)cc(F)c2)CC1 ZINC000097021672 472410990 /nfs/dbraw/zinc/41/09/90/472410990.db2.gz AFUZJHURDICOFB-UHFFFAOYSA-N 1 3 325.447 2.859 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000155273580 472526809 /nfs/dbraw/zinc/52/68/09/472526809.db2.gz RTJFUMZPONDCEM-QFBILLFUSA-N 1 3 344.503 2.598 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000155273580 472526816 /nfs/dbraw/zinc/52/68/16/472526816.db2.gz RTJFUMZPONDCEM-QFBILLFUSA-N 1 3 344.503 2.598 10 0 EFAEHO Cc1c(F)cccc1-c1ccc(CNCC2(O)CC[NH+](C)CC2)o1 ZINC000077450175 472528597 /nfs/dbraw/zinc/52/85/97/472528597.db2.gz NGRZWOBAWQUQPN-UHFFFAOYSA-N 1 3 332.419 2.940 10 0 EFAEHO CCC[C@H](C(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)N(C)C ZINC000119313839 472545662 /nfs/dbraw/zinc/54/56/62/472545662.db2.gz WMYWWYPUYAPJIR-UXLLHSPISA-N 1 3 337.533 2.978 10 0 EFAEHO CCC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)N(C)C ZINC000119313839 472545670 /nfs/dbraw/zinc/54/56/70/472545670.db2.gz WMYWWYPUYAPJIR-UXLLHSPISA-N 1 3 337.533 2.978 10 0 EFAEHO O=C(CN1CCC2(CCCCC2)CC1)NC1CC[NH+](C2CC2)CC1 ZINC000102410649 472576461 /nfs/dbraw/zinc/57/64/61/472576461.db2.gz NGUQNFDSFSSXPA-UHFFFAOYSA-N 1 3 333.520 2.776 10 0 EFAEHO CC[C@@H]1CCCCN1CCNC(=O)NC1CCC(C[NH+](C)C)CC1 ZINC000119894300 472598681 /nfs/dbraw/zinc/59/86/81/472598681.db2.gz ASOORDSGIAHQBR-DAWZGUTISA-N 1 3 338.540 2.671 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCc1ccc(OCCC[NH+](C)C)cc1 ZINC000103125592 472612792 /nfs/dbraw/zinc/61/27/92/472612792.db2.gz MVOSTWOROUEXLN-IBGZPJMESA-N 1 3 347.503 2.508 10 0 EFAEHO COc1ccc(NC(=O)CCN2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000103482393 472637323 /nfs/dbraw/zinc/63/73/23/472637323.db2.gz DXVBFOBNGGVMJE-UHFFFAOYSA-N 1 3 345.487 2.832 10 0 EFAEHO CN1CCC(NC(=O)NCc2ccccc2C[NH+]2CCCCC2)CC1 ZINC000047885655 472775629 /nfs/dbraw/zinc/77/56/29/472775629.db2.gz ALJYTKOEQOTUNJ-UHFFFAOYSA-N 1 3 344.503 2.566 10 0 EFAEHO Cc1ccc(OC[C@@H](O)CN2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000047972283 472790596 /nfs/dbraw/zinc/79/05/96/472790596.db2.gz ZAOCZGJNXAQKBY-IBGZPJMESA-N 1 3 332.488 2.543 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)N2CCCC[C@@H]2CN(C)C)CC1 ZINC000073380199 472803281 /nfs/dbraw/zinc/80/32/81/472803281.db2.gz TUMQAUSYEOONJQ-GOSISDBHSA-N 1 3 344.503 2.549 10 0 EFAEHO CN(C)Cc1cccc(CNC(=O)NCC[N@H+](C)C2CCCCC2)c1 ZINC000157424630 472820579 /nfs/dbraw/zinc/82/05/79/472820579.db2.gz DKZJOGDOGQRABJ-UHFFFAOYSA-N 1 3 346.519 2.812 10 0 EFAEHO CN(C)Cc1cccc(CNC(=O)NCC[N@@H+](C)C2CCCCC2)c1 ZINC000157424630 472820586 /nfs/dbraw/zinc/82/05/86/472820586.db2.gz DKZJOGDOGQRABJ-UHFFFAOYSA-N 1 3 346.519 2.812 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NCc2ccc(CN(C)C)cc2)CC1 ZINC000073533949 472826245 /nfs/dbraw/zinc/82/62/45/472826245.db2.gz TWPIYYBOMQZUHX-UHFFFAOYSA-N 1 3 346.519 2.669 10 0 EFAEHO CC1CC[NH+](CCCCNC(=O)NCCN2CCCC[C@H]2C)CC1 ZINC000079268752 472841213 /nfs/dbraw/zinc/84/12/13/472841213.db2.gz JUIXNYPNQLMMQT-GOSISDBHSA-N 1 3 338.540 2.672 10 0 EFAEHO Cc1ccccc1[C@H]1CCCN1CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000064508792 472859836 /nfs/dbraw/zinc/85/98/36/472859836.db2.gz UDWPUQNEANAADI-HXUWFJFHSA-N 1 3 341.499 2.875 10 0 EFAEHO COc1cc(CN2CCC(CC[NH+](C)C)CC2)cc2c1OCCO2 ZINC000092381044 472903703 /nfs/dbraw/zinc/90/37/03/472903703.db2.gz WFLOLLPNAZINMH-UHFFFAOYSA-N 1 3 334.460 2.630 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)NCCN2CCCC[C@@H]2C)c1 ZINC000065819788 473015172 /nfs/dbraw/zinc/01/51/72/473015172.db2.gz CIWSFSBYKKEJHG-KRWDZBQOSA-N 1 3 346.519 2.812 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)NCCN2CCCC[C@@H]2C)c1 ZINC000065819788 473015179 /nfs/dbraw/zinc/01/51/79/473015179.db2.gz CIWSFSBYKKEJHG-KRWDZBQOSA-N 1 3 346.519 2.812 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C)CC2(O)CCCC2)CC1 ZINC000093503098 473114092 /nfs/dbraw/zinc/11/40/92/473114092.db2.gz RDJASRAJSNDGNS-UHFFFAOYSA-N 1 3 345.531 2.956 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C)CC2(O)CCCC2)CC1 ZINC000093503098 473114095 /nfs/dbraw/zinc/11/40/95/473114095.db2.gz RDJASRAJSNDGNS-UHFFFAOYSA-N 1 3 345.531 2.956 10 0 EFAEHO CC[C@@](C)(O)C[N@H+](C)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000123547062 473155876 /nfs/dbraw/zinc/15/58/76/473155876.db2.gz QABFQPLOHPIOLT-VQTJNVASSA-N 1 3 334.504 2.525 10 0 EFAEHO CC[C@@](C)(O)C[N@@H+](C)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000123547062 473155879 /nfs/dbraw/zinc/15/58/79/473155879.db2.gz QABFQPLOHPIOLT-VQTJNVASSA-N 1 3 334.504 2.525 10 0 EFAEHO C[C@H]([NH2+]C1(CN[C@H]2CCN(C3CC3)C2)CCOCC1)c1ccccc1 ZINC000095422926 473201222 /nfs/dbraw/zinc/20/12/22/473201222.db2.gz FGJOCSMUWVIRBB-HKUYNNGSSA-N 1 3 343.515 2.713 10 0 EFAEHO CCC[C@@H](C(=O)NC[C@@H](C1CC1)[N@H+](C)Cc1ccccc1)N(C)C ZINC000185332751 473396379 /nfs/dbraw/zinc/39/63/79/473396379.db2.gz ZGQMFGFLBFBOAS-OALUTQOASA-N 1 3 331.504 2.744 10 0 EFAEHO CCC[C@@H](C(=O)NC[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1)N(C)C ZINC000185332751 473396385 /nfs/dbraw/zinc/39/63/85/473396385.db2.gz ZGQMFGFLBFBOAS-OALUTQOASA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@H](O)CN1CCCCC1 ZINC000190849323 473408799 /nfs/dbraw/zinc/40/87/99/473408799.db2.gz CHPYCPUSUDRMSI-INIZCTEOSA-N 1 3 330.394 2.950 10 0 EFAEHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)C1 ZINC000163226331 473425481 /nfs/dbraw/zinc/42/54/81/473425481.db2.gz PGCKBMXEEPENHR-GJZGRUSLSA-N 1 3 330.476 2.963 10 0 EFAEHO CO[C@H]1CC[C@@H]([NH2+]Cc2ccccc2N(C)C2CCN(C)CC2)C1 ZINC000190948100 473437869 /nfs/dbraw/zinc/43/78/69/473437869.db2.gz ICQBFJXUFIKNJP-MJGOQNOKSA-N 1 3 331.504 2.874 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000166145905 473522334 /nfs/dbraw/zinc/52/23/34/473522334.db2.gz XVFYJZFXQREUTO-PZJWPPBQSA-N 1 3 345.531 2.772 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000178734303 473550149 /nfs/dbraw/zinc/55/01/49/473550149.db2.gz IDOUPNXFSQVHIS-ROUUACIJSA-N 1 3 338.540 2.528 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000178734303 473550151 /nfs/dbraw/zinc/55/01/51/473550151.db2.gz IDOUPNXFSQVHIS-ROUUACIJSA-N 1 3 338.540 2.528 10 0 EFAEHO CCO[C@@H]1C[C@@H](NCCC[N@H+]2C[C@H](C)C[C@H](C)C2)C12CCOCC2 ZINC000186249486 473627988 /nfs/dbraw/zinc/62/79/88/473627988.db2.gz HHGNYFMTLPPGRG-FCGDIQPGSA-N 1 3 338.536 2.918 10 0 EFAEHO CCO[C@@H]1C[C@@H](NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)C12CCOCC2 ZINC000186249486 473627990 /nfs/dbraw/zinc/62/79/90/473627990.db2.gz HHGNYFMTLPPGRG-FCGDIQPGSA-N 1 3 338.536 2.918 10 0 EFAEHO CCO[C@@H]1C[C@@H]([NH2+]CCCN2C[C@H](C)C[C@H](C)C2)C12CCOCC2 ZINC000186249486 473627994 /nfs/dbraw/zinc/62/79/94/473627994.db2.gz HHGNYFMTLPPGRG-FCGDIQPGSA-N 1 3 338.536 2.918 10 0 EFAEHO CN(C)[C@@H]1CCN(C(=O)NCC2([NH+]3CCCCC3)CCCCC2)C1 ZINC000170862295 473633050 /nfs/dbraw/zinc/63/30/50/473633050.db2.gz KBJNGQSSPTYHLF-QGZVFWFLSA-N 1 3 336.524 2.521 10 0 EFAEHO C[C@@H]1CC[N@H+](CC(=O)NC2CCN(C3CC3)CC2)[C@H]2CCCC[C@@H]12 ZINC000620278091 480052374 /nfs/dbraw/zinc/05/23/74/480052374.db2.gz BEJXZWMXJPATNA-MNEFBYGVSA-N 1 3 333.520 2.630 10 0 EFAEHO C[C@@H]1CC[N@@H+](CC(=O)NC2CCN(C3CC3)CC2)[C@H]2CCCC[C@@H]12 ZINC000620278091 480052378 /nfs/dbraw/zinc/05/23/78/480052378.db2.gz BEJXZWMXJPATNA-MNEFBYGVSA-N 1 3 333.520 2.630 10 0 EFAEHO C[C@H](NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)C(C)(C)C[NH+](C)C ZINC000179194693 473651747 /nfs/dbraw/zinc/65/17/47/473651747.db2.gz ITJPEKASUGVVHM-RYQLBKOJSA-N 1 3 346.519 2.707 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]3CCCC[C@H]3[NH2+]2)N(C)C)cc1 ZINC000262667378 473707812 /nfs/dbraw/zinc/70/78/12/473707812.db2.gz PYWCESXFKCNVOT-YRXWBPOGSA-N 1 3 329.488 2.635 10 0 EFAEHO CC[C@H](CNC(=O)c1ccc(C[NH3+])cc1)N1CCc2ccccc2C1 ZINC000262682906 473711747 /nfs/dbraw/zinc/71/17/47/473711747.db2.gz YUSKVBRWNZZALR-HXUWFJFHSA-N 1 3 337.467 2.712 10 0 EFAEHO CC[NH+](CC)[C@@H]1CCN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)C1 ZINC000245653390 473731697 /nfs/dbraw/zinc/73/16/97/473731697.db2.gz NOAGADXWKGCSQE-QYZOEREBSA-N 1 3 344.503 2.558 10 0 EFAEHO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)N[C@H](C)CN(C)Cc2ccccc2)C1 ZINC000245650394 473732539 /nfs/dbraw/zinc/73/25/39/473732539.db2.gz HEDODMVUCZFQPH-YQVWRLOYSA-N 1 3 346.519 2.535 10 0 EFAEHO CC(C)[N@@H+]1C[C@H](C)[C@H](NC(=O)N[C@H](C)CN(C)Cc2ccccc2)C1 ZINC000245650394 473732547 /nfs/dbraw/zinc/73/25/47/473732547.db2.gz HEDODMVUCZFQPH-YQVWRLOYSA-N 1 3 346.519 2.535 10 0 EFAEHO C[C@H]([NH2+]CC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccnn1C ZINC000192838599 473735863 /nfs/dbraw/zinc/73/58/63/473735863.db2.gz PAUAVTSJWVQWEG-OXJNMPFZSA-N 1 3 342.487 2.516 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000617007552 480058747 /nfs/dbraw/zinc/05/87/47/480058747.db2.gz VPFYFZQWJDEWKE-OALUTQOASA-N 1 3 343.515 2.855 10 0 EFAEHO OCCCSCCNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180131675 473806778 /nfs/dbraw/zinc/80/67/78/473806778.db2.gz KVFSVALOTWDSPT-YQQQUEKLSA-N 1 3 334.529 2.887 10 0 EFAEHO OCCCSCCNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180131675 473806784 /nfs/dbraw/zinc/80/67/84/473806784.db2.gz KVFSVALOTWDSPT-YQQQUEKLSA-N 1 3 334.529 2.887 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000617014835 480066185 /nfs/dbraw/zinc/06/61/85/480066185.db2.gz QOOBNKLEUCDZEB-RTBURBONSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000617014835 480066191 /nfs/dbraw/zinc/06/61/91/480066191.db2.gz QOOBNKLEUCDZEB-RTBURBONSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@H](CO[C@@H]1CCOC1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180160237 473815234 /nfs/dbraw/zinc/81/52/34/473815234.db2.gz VOOBCLHCFGHEHL-ZMWHVPEISA-N 1 3 344.499 2.966 10 0 EFAEHO C[C@H](CO[C@@H]1CCOC1)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180160237 473815240 /nfs/dbraw/zinc/81/52/40/473815240.db2.gz VOOBCLHCFGHEHL-ZMWHVPEISA-N 1 3 344.499 2.966 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000617008996 480062357 /nfs/dbraw/zinc/06/23/57/480062357.db2.gz PUNSRHWNPOKYEF-SFHVURJKSA-N 1 3 329.488 2.885 10 0 EFAEHO COc1cc2c(cc1F)CC[C@@H]2[NH2+]C1CCN([C@@H]2CCC[C@@H]2O)CC1 ZINC000281734205 473821709 /nfs/dbraw/zinc/82/17/09/473821709.db2.gz VCUNHYNKYMXALR-OTWHNJEPSA-N 1 3 348.462 2.789 10 0 EFAEHO OC1(CN2CC[C@@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)CCOCC1 ZINC000269576600 473838577 /nfs/dbraw/zinc/83/85/77/473838577.db2.gz CTTDULMLPKPJNF-WOJBJXKFSA-N 1 3 344.499 2.514 10 0 EFAEHO OC1(CN2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)CCOCC1 ZINC000269576600 473838581 /nfs/dbraw/zinc/83/85/81/473838581.db2.gz CTTDULMLPKPJNF-WOJBJXKFSA-N 1 3 344.499 2.514 10 0 EFAEHO CC[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NCc1cccc(CN(C)C)c1 ZINC000246413189 473855408 /nfs/dbraw/zinc/85/54/08/473855408.db2.gz SDOYLKUURXSRLK-OALUTQOASA-N 1 3 344.503 2.516 10 0 EFAEHO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1cccc(CN(C)C)c1 ZINC000246413189 473855418 /nfs/dbraw/zinc/85/54/18/473855418.db2.gz SDOYLKUURXSRLK-OALUTQOASA-N 1 3 344.503 2.516 10 0 EFAEHO CC1CC[NH+](CCCCNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)CC1 ZINC000246430350 473861709 /nfs/dbraw/zinc/86/17/09/473861709.db2.gz SYEDXLOKASXTQZ-ROUUACIJSA-N 1 3 338.540 2.623 10 0 EFAEHO CC1CC[NH+](CCCCNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)CC1 ZINC000246430364 473862327 /nfs/dbraw/zinc/86/23/27/473862327.db2.gz SYEDXLOKASXTQZ-ZWKOTPCHSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@H]1CNC(=O)c1ccc(Nc2ccncc2)cc1 ZINC000617012763 480064815 /nfs/dbraw/zinc/06/48/15/480064815.db2.gz GZGTVEPOKHZFIL-SFHVURJKSA-N 1 3 338.455 2.850 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1ccc(Nc2ccncc2)cc1 ZINC000617012763 480064820 /nfs/dbraw/zinc/06/48/20/480064820.db2.gz GZGTVEPOKHZFIL-SFHVURJKSA-N 1 3 338.455 2.850 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)NCC(C)(C)N2CCCCC2)[C@@H](C)C1 ZINC000246479274 473876303 /nfs/dbraw/zinc/87/63/03/473876303.db2.gz QRKXPCIGCGSRLY-DLBZAZTESA-N 1 3 338.540 2.623 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)NCC(C)(C)N2CCCCC2)[C@@H](C)C1 ZINC000246479274 473876306 /nfs/dbraw/zinc/87/63/06/473876306.db2.gz QRKXPCIGCGSRLY-DLBZAZTESA-N 1 3 338.540 2.623 10 0 EFAEHO CC1CC[NH+](CCCCNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)CC1 ZINC000173888032 473951690 /nfs/dbraw/zinc/95/16/90/473951690.db2.gz SYEDXLOKASXTQZ-QZTJIDSGSA-N 1 3 338.540 2.623 10 0 EFAEHO Cc1ccc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c(Cl)c1 ZINC000617507182 480250740 /nfs/dbraw/zinc/25/07/40/480250740.db2.gz LTFOTKSUWGFKJC-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO Cc1ccc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c(Cl)c1 ZINC000617507182 480250744 /nfs/dbraw/zinc/25/07/44/480250744.db2.gz LTFOTKSUWGFKJC-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO Cc1c(Cl)cccc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617507257 480251260 /nfs/dbraw/zinc/25/12/60/480251260.db2.gz OKLNLVLOLDBIOP-ZDUSSCGKSA-N 1 3 325.884 2.650 10 0 EFAEHO Cc1c(Cl)cccc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617507257 480251264 /nfs/dbraw/zinc/25/12/64/480251264.db2.gz OKLNLVLOLDBIOP-ZDUSSCGKSA-N 1 3 325.884 2.650 10 0 EFAEHO C[C@H](N[C@@H]1c2ccccc2C[C@H]1O)c1ccc(OCC[NH+](C)C)cc1 ZINC000247103844 474065533 /nfs/dbraw/zinc/06/55/33/474065533.db2.gz OTFDADHUXONBMY-IWMITWMQSA-N 1 3 340.467 2.936 10 0 EFAEHO C[C@H]1C[N@H+](C)CC[C@H]1N(C)C(=O)c1cccc(CN2CCCC2)c1 ZINC000247256857 474102419 /nfs/dbraw/zinc/10/24/19/474102419.db2.gz DVQJVPFXQDXBAF-QFBILLFUSA-N 1 3 329.488 2.695 10 0 EFAEHO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cccc(CN2CCCC2)c1 ZINC000247256857 474102423 /nfs/dbraw/zinc/10/24/23/474102423.db2.gz DVQJVPFXQDXBAF-QFBILLFUSA-N 1 3 329.488 2.695 10 0 EFAEHO CN(CCC[NH+]1CCCC1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000282587423 474120602 /nfs/dbraw/zinc/12/06/02/474120602.db2.gz LNCXITSYUTYTIX-OALUTQOASA-N 1 3 344.503 2.559 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@H](O)CO[C@H]2CCCc3ccccc32)CC[N@@H+]1C ZINC000247372486 474132081 /nfs/dbraw/zinc/13/20/81/474132081.db2.gz SBTHUEFKXQEDBJ-RBAQFSTRSA-N 1 3 346.515 2.856 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@H](O)CO[C@H]2CCCc3ccccc32)CC[N@H+]1C ZINC000247372486 474132085 /nfs/dbraw/zinc/13/20/85/474132085.db2.gz SBTHUEFKXQEDBJ-RBAQFSTRSA-N 1 3 346.515 2.856 10 0 EFAEHO CC(C)[N@@H+]1CCCN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CC1 ZINC000270561097 474170440 /nfs/dbraw/zinc/17/04/40/474170440.db2.gz SZOQNGJOUMCEEY-OALUTQOASA-N 1 3 344.503 2.558 10 0 EFAEHO CC(C)[N@H+]1CCCN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CC1 ZINC000270561097 474170442 /nfs/dbraw/zinc/17/04/42/474170442.db2.gz SZOQNGJOUMCEEY-OALUTQOASA-N 1 3 344.503 2.558 10 0 EFAEHO CC(C)(C)OC(=O)N1CCC[C@H](C[NH2+]CCCN2CCCC2)C1 ZINC000227657732 474247055 /nfs/dbraw/zinc/24/70/55/474247055.db2.gz CMRHFOOSLUOWBM-MRXNPFEDSA-N 1 3 325.497 2.709 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2ccccc2CCN(C)C)[C@@H](C)C1 ZINC000275611557 474253181 /nfs/dbraw/zinc/25/31/81/474253181.db2.gz IGUGDNOFSLNINJ-QFBILLFUSA-N 1 3 346.519 2.985 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccccc2CCN(C)C)[C@@H](C)C1 ZINC000275611557 474253185 /nfs/dbraw/zinc/25/31/85/474253185.db2.gz IGUGDNOFSLNINJ-QFBILLFUSA-N 1 3 346.519 2.985 10 0 EFAEHO CN1CC[C@H](NC(=O)c2ccc(C[NH+](C)C)cc2)[C@H]1c1ccccc1 ZINC000248072977 474256295 /nfs/dbraw/zinc/25/62/95/474256295.db2.gz QQSYNXWRKHLISE-VQTJNVASSA-N 1 3 337.467 2.923 10 0 EFAEHO C[C@@H](NC(=O)N1CCCN(C2CC2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182877870 474275569 /nfs/dbraw/zinc/27/55/69/474275569.db2.gz AWKBPBMKDNLKBN-IAGOWNOFSA-N 1 3 348.535 2.519 10 0 EFAEHO C[C@@H](NC(=O)N1CCCN(C2CC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182877870 474275575 /nfs/dbraw/zinc/27/55/75/474275575.db2.gz AWKBPBMKDNLKBN-IAGOWNOFSA-N 1 3 348.535 2.519 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)NC(C)(C)C ZINC000248392254 474304328 /nfs/dbraw/zinc/30/43/28/474304328.db2.gz FDOCXLYTSBPJAW-MNZLEMJZSA-N 1 3 331.504 2.647 10 0 EFAEHO COc1ccccc1/C=C/CN(C)CCN(C)C1CC[NH+](C)CC1 ZINC000289565890 474326471 /nfs/dbraw/zinc/32/64/71/474326471.db2.gz ZFHBYNUVQXXWII-VQHVLOKHSA-N 1 3 331.504 2.666 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)[C@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000237409303 474397577 /nfs/dbraw/zinc/39/75/77/474397577.db2.gz OQHLTSXNKWIMHX-BPQIPLTHSA-N 1 3 329.488 2.846 10 0 EFAEHO CO[C@@H]1CC[C@H]([NH2+]Cc2ccccc2N(C)C2CCN(C)CC2)C1 ZINC000248739622 474421109 /nfs/dbraw/zinc/42/11/09/474421109.db2.gz ICQBFJXUFIKNJP-PKOBYXMFSA-N 1 3 331.504 2.874 10 0 EFAEHO C[C@@H](CNC(=O)N[C@H](CN(C)C)c1ccccc1)[N@@H+]1CCC[C@@H](C)C1 ZINC000248753019 474426588 /nfs/dbraw/zinc/42/65/88/474426588.db2.gz HLUZNGHECJLDER-ZIFCJYIRSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@@H](CNC(=O)N[C@H](CN(C)C)c1ccccc1)[N@H+]1CCC[C@@H](C)C1 ZINC000248753019 474426593 /nfs/dbraw/zinc/42/65/93/474426593.db2.gz HLUZNGHECJLDER-ZIFCJYIRSA-N 1 3 346.519 2.709 10 0 EFAEHO O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@@H]1C[C@@H]2CCCC[C@@H]2[NH2+]1 ZINC000237907254 474501152 /nfs/dbraw/zinc/50/11/52/474501152.db2.gz PNNZJDUPZZDWEG-LWYYNNOASA-N 1 3 341.499 2.860 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@]3(C)C[C@H]4C[C@H]4C3)CC2)CC1 ZINC000629048677 480108134 /nfs/dbraw/zinc/10/81/34/480108134.db2.gz UHUVVSXDORRYKL-RMFSNUHRSA-N 1 3 347.547 2.735 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)CC[N@@H+]1C ZINC000631475648 480110532 /nfs/dbraw/zinc/11/05/32/480110532.db2.gz MPCQHKDRDSQMJY-CUSZFKRNSA-N 1 3 349.544 2.978 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)CC[N@H+]1C ZINC000631475648 480110536 /nfs/dbraw/zinc/11/05/36/480110536.db2.gz MPCQHKDRDSQMJY-CUSZFKRNSA-N 1 3 349.544 2.978 10 0 EFAEHO O[C@H](CN1CCC2(C1)CC[NH+](Cc1ccccc1)CC2)C(F)(F)F ZINC000291454802 474604120 /nfs/dbraw/zinc/60/41/20/474604120.db2.gz MMHUARLDRUZLQK-MRXNPFEDSA-N 1 3 342.405 2.898 10 0 EFAEHO CN1CCC(CC(=O)Nc2ccccc2NC2CC[NH+](C)CC2)CC1 ZINC000273159875 474750613 /nfs/dbraw/zinc/75/06/13/474750613.db2.gz BUNUSLHZUHRAGO-UHFFFAOYSA-N 1 3 344.503 2.863 10 0 EFAEHO C[NH+]1CCC(CC(=O)NCC2CCN(Cc3cccs3)CC2)CC1 ZINC000273171260 474756960 /nfs/dbraw/zinc/75/69/60/474756960.db2.gz DXSIOPFWPPBFFV-UHFFFAOYSA-N 1 3 349.544 2.808 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)CC2CC[NH+](C)CC2)N(C)C)cc1 ZINC000273208918 474778126 /nfs/dbraw/zinc/77/81/26/474778126.db2.gz JYLJQKHYGPBKOB-IBGZPJMESA-N 1 3 331.504 2.700 10 0 EFAEHO C[C@@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)NCCN1[C@H](C)CCC[C@H]1C ZINC000344785935 474791842 /nfs/dbraw/zinc/79/18/42/474791842.db2.gz BZCKBRFTXXTFRW-TVFCKZIOSA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@@H](NC[C@@H](O)COCc1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000273253262 474805106 /nfs/dbraw/zinc/80/51/06/474805106.db2.gz JQCCHJOHGSHFHG-YFVAEKQCSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@@H](NC[C@@H](O)COCc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000273253262 474805116 /nfs/dbraw/zinc/80/51/16/474805116.db2.gz JQCCHJOHGSHFHG-YFVAEKQCSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@@H]([NH2+]C[C@@H](O)COCc1ccccc1)[C@@H]1CCCN(C2CCC2)C1 ZINC000273253262 474805122 /nfs/dbraw/zinc/80/51/22/474805122.db2.gz JQCCHJOHGSHFHG-YFVAEKQCSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@@H](NC[C@@H](O)COCc1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000273253259 474805348 /nfs/dbraw/zinc/80/53/48/474805348.db2.gz JQCCHJOHGSHFHG-SLYNCCJLSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@@H](NC[C@@H](O)COCc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000273253259 474805357 /nfs/dbraw/zinc/80/53/57/474805357.db2.gz JQCCHJOHGSHFHG-SLYNCCJLSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@@H]([NH2+]C[C@@H](O)COCc1ccccc1)[C@H]1CCCN(C2CCC2)C1 ZINC000273253259 474805365 /nfs/dbraw/zinc/80/53/65/474805365.db2.gz JQCCHJOHGSHFHG-SLYNCCJLSA-N 1 3 346.515 2.807 10 0 EFAEHO CN(C(=O)CC1CC[NH+](C)CC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000292030639 474810638 /nfs/dbraw/zinc/81/06/38/474810638.db2.gz WQPUAMZRICHANO-FQEVSTJZSA-N 1 3 343.515 2.841 10 0 EFAEHO CN(C(=O)CC1CC[NH+](C)CC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000292030642 474811159 /nfs/dbraw/zinc/81/11/59/474811159.db2.gz WQPUAMZRICHANO-HXUWFJFHSA-N 1 3 343.515 2.841 10 0 EFAEHO O=C(CC[C@H]1CCC[NH2+]1)NC[C@H]1CCCN(Cc2ccccc2)C1 ZINC000310584632 474829169 /nfs/dbraw/zinc/82/91/69/474829169.db2.gz UFTOHMAPTPMAHD-RTBURBONSA-N 1 3 329.488 2.547 10 0 EFAEHO [NH3+]Cc1ccc(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000311201016 474837786 /nfs/dbraw/zinc/83/77/86/474837786.db2.gz KMRROVCWBPPVEV-LJQANCHMSA-N 1 3 337.467 2.787 10 0 EFAEHO C[C@@H]([NH2+]C[C@H]1CCc2nccn2C1)c1ccc(OCCN(C)C)cc1 ZINC000278874915 474886343 /nfs/dbraw/zinc/88/63/43/474886343.db2.gz CBTZGTXLNBINOW-IAGOWNOFSA-N 1 3 342.487 2.737 10 0 EFAEHO CN1CCCN(CCC[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000339069762 474897280 /nfs/dbraw/zinc/89/72/80/474897280.db2.gz VOPWMZYGFAVIMZ-PZJWPPBQSA-N 1 3 345.531 2.772 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@@H](C)[C@H]2Oc3ccccc3[C@H]2C)CC1 ZINC000337325367 474899186 /nfs/dbraw/zinc/89/91/86/474899186.db2.gz VDVKYPBWLSDXTM-LQWHRVPQSA-N 1 3 345.531 2.945 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)NC[C@@H](C)[NH+](CC)CC)N(C)C)cc1 ZINC000337326187 474899373 /nfs/dbraw/zinc/89/93/73/474899373.db2.gz ORNRTGGAHXUVDM-APWZRJJASA-N 1 3 348.535 2.881 10 0 EFAEHO Cc1ccc(OC[C@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c(C)c1 ZINC000325149180 474984338 /nfs/dbraw/zinc/98/43/38/474984338.db2.gz MFIODZPCYGIPSO-XVLXNVKGSA-N 1 3 332.488 2.648 10 0 EFAEHO Cc1ccc(OC[C@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c(C)c1 ZINC000325149180 474984346 /nfs/dbraw/zinc/98/43/46/474984346.db2.gz MFIODZPCYGIPSO-XVLXNVKGSA-N 1 3 332.488 2.648 10 0 EFAEHO C[C@H](CC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1CCC[NH2+]C1 ZINC000261568489 474984993 /nfs/dbraw/zinc/98/49/93/474984993.db2.gz JDYNHRBRIIRIGM-YZGWKJHDSA-N 1 3 343.515 2.745 10 0 EFAEHO CCN1CCN([C@@H](C)C[NH2+][C@@H](C)c2cnn(C3CCCC3)c2)CC1 ZINC000337408659 474986298 /nfs/dbraw/zinc/98/62/98/474986298.db2.gz UQVCNSISRDTJGL-IRXDYDNUSA-N 1 3 333.524 2.675 10 0 EFAEHO Cc1occc1C(=O)NC1CC[NH+](CC[C@@H]2CCCCN2C)CC1 ZINC000268522968 475030308 /nfs/dbraw/zinc/03/03/08/475030308.db2.gz GFOSUYNELFBXJI-KRWDZBQOSA-N 1 3 333.476 2.657 10 0 EFAEHO C[C@H](NCCN1CCC([NH+](C)C)CC1)c1cnn(C2CCCC2)c1 ZINC000337471039 475047286 /nfs/dbraw/zinc/04/72/86/475047286.db2.gz NRCBWNIEAHPLKV-INIZCTEOSA-N 1 3 333.524 2.675 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)NCCC[NH2+]C1CCCCC1 ZINC000341551084 475135655 /nfs/dbraw/zinc/13/56/55/475135655.db2.gz BRQOMDJBURHBAE-IRXDYDNUSA-N 1 3 338.540 2.861 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)N1CCN(C2CCCC2)CC1 ZINC000341551961 475136915 /nfs/dbraw/zinc/13/69/15/475136915.db2.gz CTIPYCFMVHJQCJ-CALCHBBNSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N1CCN(C2CCCC2)CC1 ZINC000341551961 475136921 /nfs/dbraw/zinc/13/69/21/475136921.db2.gz CTIPYCFMVHJQCJ-CALCHBBNSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000341554310 475138276 /nfs/dbraw/zinc/13/82/76/475138276.db2.gz IRSDXRUCAPWQMY-KZNAEPCWSA-N 1 3 336.524 2.519 10 0 EFAEHO Cc1cc(Br)cnc1N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000664194545 481080211 /nfs/dbraw/zinc/08/02/11/481080211.db2.gz GFQGDRIYAXYZCM-ZDUSSCGKSA-N 1 3 343.313 2.836 10 0 EFAEHO Cc1cc(Br)cnc1N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000664194545 481080255 /nfs/dbraw/zinc/08/02/55/481080255.db2.gz GFQGDRIYAXYZCM-ZDUSSCGKSA-N 1 3 343.313 2.836 10 0 EFAEHO [NH3+][C@@H]1CCC[C@@H](C(=O)NC[C@H]2CCCCN2Cc2ccccc2)C1 ZINC000262285862 475214534 /nfs/dbraw/zinc/21/45/34/475214534.db2.gz MIRFJCPRGBMAER-GUDVDZBRSA-N 1 3 329.488 2.675 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000352571111 475421759 /nfs/dbraw/zinc/42/17/59/475421759.db2.gz QHGZLGDWMNOKQE-ICSRJNTNSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000352571111 475421768 /nfs/dbraw/zinc/42/17/68/475421768.db2.gz QHGZLGDWMNOKQE-ICSRJNTNSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@H](CO)c2cccnc2)CC[N@@H+]1Cc1ccccc1 ZINC000348199786 475481710 /nfs/dbraw/zinc/48/17/10/475481710.db2.gz QLCIBXNPVJDEJU-DUXKGJEZSA-N 1 3 339.483 2.800 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@H](CO)c2cccnc2)CC[N@H+]1Cc1ccccc1 ZINC000348199786 475481716 /nfs/dbraw/zinc/48/17/16/475481716.db2.gz QLCIBXNPVJDEJU-DUXKGJEZSA-N 1 3 339.483 2.800 10 0 EFAEHO C[C@H]([NH2+]C[C@@H](CO)c1cccnc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000348202914 475483027 /nfs/dbraw/zinc/48/30/27/475483027.db2.gz BGLJJZNOXAICIX-WMQCIHAUSA-N 1 3 339.483 2.658 10 0 EFAEHO C[C@H](NC[C@@H](CO)c1cccnc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000348202914 475483033 /nfs/dbraw/zinc/48/30/33/475483033.db2.gz BGLJJZNOXAICIX-WMQCIHAUSA-N 1 3 339.483 2.658 10 0 EFAEHO C[C@H](NC[C@@H](CO)c1cccnc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000348202914 475483042 /nfs/dbraw/zinc/48/30/42/475483042.db2.gz BGLJJZNOXAICIX-WMQCIHAUSA-N 1 3 339.483 2.658 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)NCC(C)(C)C[NH+]1CCCC1 ZINC000358240090 475518676 /nfs/dbraw/zinc/51/86/76/475518676.db2.gz SUXZCQSAOZPWOP-IRXDYDNUSA-N 1 3 338.540 2.671 10 0 EFAEHO CC1=CCN(CC[NH2+][C@@H](C)c2ccc(OCCN(C)C)cc2)CC1 ZINC000358249534 475526236 /nfs/dbraw/zinc/52/62/36/475526236.db2.gz KIMHYDUPNZOIGN-SFHVURJKSA-N 1 3 331.504 2.930 10 0 EFAEHO O=S1(=O)CCC(CC[NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000358307523 475578007 /nfs/dbraw/zinc/57/80/07/475578007.db2.gz RGISBAMXVCTFMM-UHFFFAOYSA-N 1 3 342.549 2.588 10 0 EFAEHO CN(C)CCN(Cc1ccc(F)cc1)C(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000355002213 475590723 /nfs/dbraw/zinc/59/07/23/475590723.db2.gz BAOXKTHQQRBWBP-LJQANCHMSA-N 1 3 349.494 2.980 10 0 EFAEHO CN(C)CCN(Cc1ccc(F)cc1)C(=O)CC[C@H]1CCCC[N@H+]1C ZINC000355002213 475590727 /nfs/dbraw/zinc/59/07/27/475590727.db2.gz BAOXKTHQQRBWBP-LJQANCHMSA-N 1 3 349.494 2.980 10 0 EFAEHO CSc1ccc(CN[C@@H](CC(C)C)C(=O)NCC[NH+](C)C)s1 ZINC000352800454 475635605 /nfs/dbraw/zinc/63/56/05/475635605.db2.gz PWSOSJBNUNXETD-AWEZNQCLSA-N 1 3 343.562 2.652 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](NCCc2ncc(CC)s2)[C@H](C)C1 ZINC000361661982 475641010 /nfs/dbraw/zinc/64/10/10/475641010.db2.gz OVPINKOOKLJXAT-NVXWUHKLSA-N 1 3 339.549 2.975 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](NCCc2ncc(CC)s2)[C@H](C)C1 ZINC000361661982 475641016 /nfs/dbraw/zinc/64/10/16/475641016.db2.gz OVPINKOOKLJXAT-NVXWUHKLSA-N 1 3 339.549 2.975 10 0 EFAEHO CC[NH+](CC)Cc1ccc(C(=O)N(C)[C@@H]2CCN(C3CC3)C2)cc1 ZINC000338173509 475649855 /nfs/dbraw/zinc/64/98/55/475649855.db2.gz HBEUUZTZKCWDFW-LJQANCHMSA-N 1 3 329.488 2.837 10 0 EFAEHO COc1ccc([C@@H](CN(C)C)NC(=O)CC[C@H]2CCCC[N@@H+]2C)cc1 ZINC000358423949 475666633 /nfs/dbraw/zinc/66/66/33/475666633.db2.gz HLEWEYFJDSPCDR-IEBWSBKVSA-N 1 3 347.503 2.679 10 0 EFAEHO COc1ccc([C@@H](CN(C)C)NC(=O)CC[C@H]2CCCC[N@H+]2C)cc1 ZINC000358423949 475666638 /nfs/dbraw/zinc/66/66/38/475666638.db2.gz HLEWEYFJDSPCDR-IEBWSBKVSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[C@H](C)[NH2+][C@H](CNC(=O)NCCN1CC=C(C)CC1)c1ccco1 ZINC000355104467 475670581 /nfs/dbraw/zinc/67/05/81/475670581.db2.gz XVHZYQZFWQYUJL-DLBZAZTESA-N 1 3 348.491 2.660 10 0 EFAEHO Cc1ccccc1CN1CCCN(C(=O)C[N@@H+]2CCCC2(C)C)CC1 ZINC000343005070 475692393 /nfs/dbraw/zinc/69/23/93/475692393.db2.gz WQTDOVWSQGQFHD-UHFFFAOYSA-N 1 3 343.515 2.904 10 0 EFAEHO Cc1ccccc1CN1CCCN(C(=O)C[N@H+]2CCCC2(C)C)CC1 ZINC000343005070 475692402 /nfs/dbraw/zinc/69/24/02/475692402.db2.gz WQTDOVWSQGQFHD-UHFFFAOYSA-N 1 3 343.515 2.904 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2CCN(c3ncccc3Cl)C2)[C@H]2CCC[C@@H]21 ZINC000353395125 475933920 /nfs/dbraw/zinc/93/39/20/475933920.db2.gz OPVQHPDVIPXESE-JHNDHUHGSA-N 1 3 334.895 2.776 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2CCN(c3ncccc3Cl)C2)[C@H]2CCC[C@@H]21 ZINC000353395125 475933927 /nfs/dbraw/zinc/93/39/27/475933927.db2.gz OPVQHPDVIPXESE-JHNDHUHGSA-N 1 3 334.895 2.776 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21)N1CCc2sccc2C1 ZINC000353396652 475935506 /nfs/dbraw/zinc/93/55/06/475935506.db2.gz UKFBDHJKOJZGGT-DDBAPUKQSA-N 1 3 333.545 2.957 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@@H+](C)[C@H]2CCC[C@@H]21)N1CCc2sccc2C1 ZINC000353396652 475935512 /nfs/dbraw/zinc/93/55/12/475935512.db2.gz UKFBDHJKOJZGGT-DDBAPUKQSA-N 1 3 333.545 2.957 10 0 EFAEHO C[C@@H](CNC(=O)NCC[N@H+](C)C1CCCCC1)N1CCC(C)CC1 ZINC000338499353 475958647 /nfs/dbraw/zinc/95/86/47/475958647.db2.gz LSSSOHSHTSXKGA-KRWDZBQOSA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@@H](CNC(=O)NCC[N@@H+](C)C1CCCCC1)N1CCC(C)CC1 ZINC000338499353 475958656 /nfs/dbraw/zinc/95/86/56/475958656.db2.gz LSSSOHSHTSXKGA-KRWDZBQOSA-N 1 3 338.540 2.671 10 0 EFAEHO CN1CC[C@H]([NH2+]CCCN2CCc3ccccc3C2)[C@H]2CCC[C@@H]21 ZINC000353444890 475971953 /nfs/dbraw/zinc/97/19/53/475971953.db2.gz GTMZUYHRWAFTGA-HKBOAZHASA-N 1 3 327.516 2.897 10 0 EFAEHO COc1cccc([C@H](CN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)N(C)C)c1 ZINC000353465950 475992872 /nfs/dbraw/zinc/99/28/72/475992872.db2.gz WISVWGGTCOFGMB-YRPNKDGESA-N 1 3 331.504 2.760 10 0 EFAEHO COc1cccc([C@H](CN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@H]32)N(C)C)c1 ZINC000353465950 475992876 /nfs/dbraw/zinc/99/28/76/475992876.db2.gz WISVWGGTCOFGMB-YRPNKDGESA-N 1 3 331.504 2.760 10 0 EFAEHO COc1cccc([C@H](C[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@H]32)N(C)C)c1 ZINC000353465950 475992883 /nfs/dbraw/zinc/99/28/83/475992883.db2.gz WISVWGGTCOFGMB-YRPNKDGESA-N 1 3 331.504 2.760 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)N(C)[C@H]1CCN(C2CC2)C1)CC(C)C ZINC000349753348 475995474 /nfs/dbraw/zinc/99/54/74/475995474.db2.gz CKULADHYZFBUCK-ROUUACIJSA-N 1 3 338.540 2.621 10 0 EFAEHO CN(C(=O)c1ccc(Nc2ccncc2)cc1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000346991464 476015652 /nfs/dbraw/zinc/01/56/52/476015652.db2.gz SYQPKEPGNITXSN-LJQANCHMSA-N 1 3 336.439 2.556 10 0 EFAEHO CN(C(=O)c1ccc(Nc2ccncc2)cc1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000346991464 476015658 /nfs/dbraw/zinc/01/56/58/476015658.db2.gz SYQPKEPGNITXSN-LJQANCHMSA-N 1 3 336.439 2.556 10 0 EFAEHO CN(C(=O)c1ccc(Nc2ccncc2)cc1)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000346991462 476016107 /nfs/dbraw/zinc/01/61/07/476016107.db2.gz SYQPKEPGNITXSN-IBGZPJMESA-N 1 3 336.439 2.556 10 0 EFAEHO CN(C(=O)c1ccc(Nc2ccncc2)cc1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000346991462 476016116 /nfs/dbraw/zinc/01/61/16/476016116.db2.gz SYQPKEPGNITXSN-IBGZPJMESA-N 1 3 336.439 2.556 10 0 EFAEHO CN(C(=O)c1ccc(C[NH+]2CCCCC2)cc1)[C@H]1CCN(C2CC2)C1 ZINC000347007822 476029557 /nfs/dbraw/zinc/02/95/57/476029557.db2.gz HUOJRYSGGLUEBL-FQEVSTJZSA-N 1 3 341.499 2.981 10 0 EFAEHO CCOC[C@H](C)[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340463936 476050500 /nfs/dbraw/zinc/05/05/00/476050500.db2.gz REMCSRVXLMZAMF-ICSRJNTNSA-N 1 3 346.515 2.930 10 0 EFAEHO CCOC[C@H](C)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000340463936 476050506 /nfs/dbraw/zinc/05/05/06/476050506.db2.gz REMCSRVXLMZAMF-ICSRJNTNSA-N 1 3 346.515 2.930 10 0 EFAEHO CCOC[C@H](C)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000340463936 476050515 /nfs/dbraw/zinc/05/05/15/476050515.db2.gz REMCSRVXLMZAMF-ICSRJNTNSA-N 1 3 346.515 2.930 10 0 EFAEHO c1ccc(CN2C[C@H](C[NH2+][C@@H]3CCCOC3)C3(C2)CCOCC3)cc1 ZINC000340468987 476054015 /nfs/dbraw/zinc/05/40/15/476054015.db2.gz HUDCRSOVTBHZDY-VQTJNVASSA-N 1 3 344.499 2.684 10 0 EFAEHO c1ccc(C[N@H+]2C[C@H](CN[C@@H]3CCCOC3)C3(C2)CCOCC3)cc1 ZINC000340468987 476054019 /nfs/dbraw/zinc/05/40/19/476054019.db2.gz HUDCRSOVTBHZDY-VQTJNVASSA-N 1 3 344.499 2.684 10 0 EFAEHO c1ccc(C[N@@H+]2C[C@H](CN[C@@H]3CCCOC3)C3(C2)CCOCC3)cc1 ZINC000340468987 476054026 /nfs/dbraw/zinc/05/40/26/476054026.db2.gz HUDCRSOVTBHZDY-VQTJNVASSA-N 1 3 344.499 2.684 10 0 EFAEHO COC[C@]1(CN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)OCCc2ccccc21 ZINC000353564782 476082625 /nfs/dbraw/zinc/08/26/25/476082625.db2.gz IQAVNTNDQKFWRP-KCLUMXDGSA-N 1 3 344.499 2.563 10 0 EFAEHO COC[C@]1(CN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@H]32)OCCc2ccccc21 ZINC000353564782 476082628 /nfs/dbraw/zinc/08/26/28/476082628.db2.gz IQAVNTNDQKFWRP-KCLUMXDGSA-N 1 3 344.499 2.563 10 0 EFAEHO CCO[C@@H]1C[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)[C@H]1n1cccn1 ZINC000340541356 476096153 /nfs/dbraw/zinc/09/61/53/476096153.db2.gz QGPLBLWGZYXRNI-VAMGGRTRSA-N 1 3 346.519 2.988 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2ccc3cc[nH]c3n2)[C@@H](C)C1 ZINC000353620142 476129580 /nfs/dbraw/zinc/12/95/80/476129580.db2.gz IFLDOERROKSPOU-YJBOKZPZSA-N 1 3 330.476 2.790 10 0 EFAEHO CCN1CC[C@H]([N@H+](C)Cc2cc(OC)c3c(c2)OCCO3)C[C@H]1C ZINC000353754889 476249915 /nfs/dbraw/zinc/24/99/15/476249915.db2.gz RFTXNBBLULTMBI-ZBFHGGJFSA-N 1 3 334.460 2.771 10 0 EFAEHO CCN1CC[C@H]([N@@H+](C)Cc2cc(OC)c3c(c2)OCCO3)C[C@H]1C ZINC000353754889 476249921 /nfs/dbraw/zinc/24/99/21/476249921.db2.gz RFTXNBBLULTMBI-ZBFHGGJFSA-N 1 3 334.460 2.771 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000362532665 476299413 /nfs/dbraw/zinc/29/94/13/476299413.db2.gz YCKCYKPRSBNWNI-VQTJNVASSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000362532665 476299419 /nfs/dbraw/zinc/29/94/19/476299419.db2.gz YCKCYKPRSBNWNI-VQTJNVASSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C1CC1)[N@H+](C)Cc1ccccc1 ZINC000357266970 476309531 /nfs/dbraw/zinc/30/95/31/476309531.db2.gz SIUOXLWEVLYZMC-PMACEKPBSA-N 1 3 343.515 2.888 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000357266970 476309536 /nfs/dbraw/zinc/30/95/36/476309536.db2.gz SIUOXLWEVLYZMC-PMACEKPBSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@H]1C[C@@H](c2nc(-c3ccc(OCC[NH+](C)C)cc3)no2)CCN1C ZINC000351201476 476358108 /nfs/dbraw/zinc/35/81/08/476358108.db2.gz MUHOFQVGXNRHOL-HOCLYGCPSA-N 1 3 344.459 2.875 10 0 EFAEHO CC(C)N1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)CC1=O ZINC000354175148 476479869 /nfs/dbraw/zinc/47/98/69/476479869.db2.gz AHLFKUKAYALYPH-YGFFAISXSA-N 1 3 341.499 2.781 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@@H]2CCC[C@@H]([C@H]3CCOC3)C2)CC1 ZINC000360986457 476525975 /nfs/dbraw/zinc/52/59/75/476525975.db2.gz KWNARJMQNXJGMR-HSALFYBXSA-N 1 3 337.552 2.589 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@@H]2CCC[C@H]([C@@H]3CCOC3)C2)CC1 ZINC000360986460 476526567 /nfs/dbraw/zinc/52/65/67/476526567.db2.gz KWNARJMQNXJGMR-XUVXKRRUSA-N 1 3 337.552 2.589 10 0 EFAEHO C[C@H]1CCC[N@H+](CCCCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000377760036 476566049 /nfs/dbraw/zinc/56/60/49/476566049.db2.gz INCSSORSKDIWSU-LPHOPBHVSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H]1CCC[N@@H+](CCCCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000377760036 476566056 /nfs/dbraw/zinc/56/60/56/476566056.db2.gz INCSSORSKDIWSU-LPHOPBHVSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](CN1CCC[C@@]2(CCOC2)C1)C[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000451900155 476710510 /nfs/dbraw/zinc/71/05/10/476710510.db2.gz LJFHYOWRUDODMD-OWZKRDHZSA-N 1 3 336.520 2.628 10 0 EFAEHO C[C@H](CN1CCC[C@@]2(CCOC2)C1)C[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000451900155 476710515 /nfs/dbraw/zinc/71/05/15/476710515.db2.gz LJFHYOWRUDODMD-OWZKRDHZSA-N 1 3 336.520 2.628 10 0 EFAEHO C[C@@H](CN1CCC[C@]2(CCOC2)C1)C[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000451900155 476710519 /nfs/dbraw/zinc/71/05/19/476710519.db2.gz LJFHYOWRUDODMD-OWZKRDHZSA-N 1 3 336.520 2.628 10 0 EFAEHO C[C@@H](CN1CCC[C@]2(CCOC2)C1)C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000451900155 476710526 /nfs/dbraw/zinc/71/05/26/476710526.db2.gz LJFHYOWRUDODMD-OWZKRDHZSA-N 1 3 336.520 2.628 10 0 EFAEHO CC(C)(CC[NH3+])NC(=O)NCc1ccccc1CN1CCCCC1 ZINC000422595079 476714336 /nfs/dbraw/zinc/71/43/36/476714336.db2.gz UAKSPKPLUXBBRQ-UHFFFAOYSA-N 1 3 332.492 2.599 10 0 EFAEHO O=C(C[C@@H]1CCC[NH2+]C1)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000379663850 476730433 /nfs/dbraw/zinc/73/04/33/476730433.db2.gz MTBPIQWWAQAKDK-OALUTQOASA-N 1 3 329.488 2.547 10 0 EFAEHO O=C(C[C@H]1CCC[NH2+]C1)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000379663849 476731560 /nfs/dbraw/zinc/73/15/60/476731560.db2.gz MTBPIQWWAQAKDK-MOPGFXCFSA-N 1 3 329.488 2.547 10 0 EFAEHO N[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000422725166 476744808 /nfs/dbraw/zinc/74/48/08/476744808.db2.gz ARFJXLYOTWPZHE-XHSDSOJGSA-N 1 3 327.394 2.749 10 0 EFAEHO [NH3+][C@@H]1CCC[C@@H]1N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000422725166 476744814 /nfs/dbraw/zinc/74/48/14/476744814.db2.gz ARFJXLYOTWPZHE-XHSDSOJGSA-N 1 3 327.394 2.749 10 0 EFAEHO C[C@@H]([NH3+])[C@@H](Cc1ccccc1)NCc1ccc(F)c(CN(C)C)c1 ZINC000422748022 476757183 /nfs/dbraw/zinc/75/71/83/476757183.db2.gz RQLPVXDZYKXGBN-FOIQADDNSA-N 1 3 329.463 2.935 10 0 EFAEHO C[C@@H](N)[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(F)c(CN(C)C)c1 ZINC000422748022 476757188 /nfs/dbraw/zinc/75/71/88/476757188.db2.gz RQLPVXDZYKXGBN-FOIQADDNSA-N 1 3 329.463 2.935 10 0 EFAEHO c1cc(CN2CCOCC2)ccc1CN[C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000422774275 476771041 /nfs/dbraw/zinc/77/10/41/476771041.db2.gz WKMWYPSPSBPNNY-PCCBWWKXSA-N 1 3 343.515 2.529 10 0 EFAEHO c1cc(CN2CCOCC2)ccc1CN[C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000422774276 476771426 /nfs/dbraw/zinc/77/14/26/476771426.db2.gz WKMWYPSPSBPNNY-PWRODBHTSA-N 1 3 343.515 2.529 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@@H](C)c1cnn(-c2ccc(F)cc2)c1C ZINC000422788536 476776344 /nfs/dbraw/zinc/77/63/44/476776344.db2.gz SJPRXMSKJHQVTO-BBRMVZONSA-N 1 3 334.439 2.724 10 0 EFAEHO C[C@@H]1CN(C(C)(C)CN[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)C[C@H](C)O1 ZINC000422788440 476776803 /nfs/dbraw/zinc/77/68/03/476776803.db2.gz APQNGSMSLQFVPL-MTHXSQLBSA-N 1 3 337.552 2.775 10 0 EFAEHO C[C@H](C[C@@H]1COCCN1)[NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000390531448 476796177 /nfs/dbraw/zinc/79/61/77/476796177.db2.gz DUSDCHLTGCOLLD-BELYLAKWSA-N 1 3 343.515 2.539 10 0 EFAEHO [NH3+]CCc1ccccc1C(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000390702269 476797953 /nfs/dbraw/zinc/79/79/53/476797953.db2.gz DKUXQMOTNKGYBZ-IBGZPJMESA-N 1 3 337.467 2.582 10 0 EFAEHO O=C(CCN[C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)NCc1ccccc1 ZINC000422840642 476804403 /nfs/dbraw/zinc/80/44/03/476804403.db2.gz BWRTXRSNADZMRK-CEXWTWQISA-N 1 3 329.488 2.593 10 0 EFAEHO O=C(CCN[C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)NCc1ccccc1 ZINC000422840647 476805305 /nfs/dbraw/zinc/80/53/05/476805305.db2.gz BWRTXRSNADZMRK-GBESFXJTSA-N 1 3 329.488 2.593 10 0 EFAEHO CC(C)OC[C@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390849703 476808634 /nfs/dbraw/zinc/80/86/34/476808634.db2.gz CXHGCDOYSDILPZ-RAFMOHDBSA-N 1 3 332.488 2.558 10 0 EFAEHO CC(C)OC[C@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000390849703 476808639 /nfs/dbraw/zinc/80/86/39/476808639.db2.gz CXHGCDOYSDILPZ-RAFMOHDBSA-N 1 3 332.488 2.558 10 0 EFAEHO COc1ccc([C@@H](NCCN2CCC(C)CC2)[C@H]2CCC[NH2+]2)cc1 ZINC000422858441 476813157 /nfs/dbraw/zinc/81/31/57/476813157.db2.gz IQQBLGLPPNONRK-WOJBJXKFSA-N 1 3 331.504 2.810 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@H](CN[C@H](C)[C@@H]3CCCC[NH2+]3)C2)c1 ZINC000422874624 476822185 /nfs/dbraw/zinc/82/21/85/476822185.db2.gz NXTUMWHODXEUMK-QINHECLXSA-N 1 3 347.503 2.650 10 0 EFAEHO CCOc1ccc([C@H](C)NC(=O)CCCN[C@@H]2C[NH2+]CC[C@H]2C)cc1 ZINC000422925669 476848871 /nfs/dbraw/zinc/84/88/71/476848871.db2.gz CAGUBGHYUPORSG-JTDSTZFVSA-N 1 3 347.503 2.630 10 0 EFAEHO OC1(C[NH2+][C@H]2CCOC3(CCC3)C2)CCN(Cc2ccccc2)CC1 ZINC000397656841 476857565 /nfs/dbraw/zinc/85/75/65/476857565.db2.gz YSEQEGRLVGFCIU-IBGZPJMESA-N 1 3 344.499 2.705 10 0 EFAEHO COc1ccccc1CNCC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC000397645355 476858101 /nfs/dbraw/zinc/85/81/01/476858101.db2.gz UVICHHHFRCDXLI-UHFFFAOYSA-N 1 3 340.467 2.812 10 0 EFAEHO C[C@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)c1ccncc1 ZINC000397576323 476858964 /nfs/dbraw/zinc/85/89/64/476858964.db2.gz CMDRSQMHTPGHEN-KRWDZBQOSA-N 1 3 325.456 2.759 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(C(=O)NCCN2CCCC2)cc1)[C@H]1C[C@H]1C ZINC000414069509 476863093 /nfs/dbraw/zinc/86/30/93/476863093.db2.gz BTRHPAWMKVHVCQ-GJYPPUQNSA-N 1 3 329.488 2.646 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C1CCC([NH3+])CC1 ZINC000398068248 476866954 /nfs/dbraw/zinc/86/69/54/476866954.db2.gz OJJNKIDYOZYPDM-HJZRJOMTSA-N 1 3 329.488 2.531 10 0 EFAEHO FC(F)(F)c1ccc(OCCN[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)nc1 ZINC000422987090 476879202 /nfs/dbraw/zinc/87/92/02/476879202.db2.gz FDAIOQPUCXNSOW-ZNMIVQPWSA-N 1 3 343.393 2.990 10 0 EFAEHO Clc1ccc(COCCN[C@@H]2CCOC[C@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000423002108 476886456 /nfs/dbraw/zinc/88/64/56/476886456.db2.gz IVSAHLHJDWBWRV-OKZBNKHCSA-N 1 3 338.879 2.603 10 0 EFAEHO CC(C)N(C)CCC[NH2+][C@H](C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000400459089 476890713 /nfs/dbraw/zinc/89/07/13/476890713.db2.gz QVNYFWJKINHVOZ-HZPDHXFCSA-N 1 3 327.513 2.952 10 0 EFAEHO C[C@H]1CNCC[C@@H]1[NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000414946662 476895932 /nfs/dbraw/zinc/89/59/32/476895932.db2.gz UQCDMSJTKPJZLD-GUYCJALGSA-N 1 3 335.879 2.532 10 0 EFAEHO C[C@H](NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1CCCC[NH2+]1 ZINC000423081078 476921199 /nfs/dbraw/zinc/92/11/99/476921199.db2.gz BBPAIRKVKCWCOF-HOJRLLLISA-N 1 3 333.442 2.912 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2CCC[C@H]2N)ccc1I ZINC000423092331 476926588 /nfs/dbraw/zinc/92/65/88/476926588.db2.gz BJIUSVYJNSRBNT-CHWSQXEVSA-N 1 3 330.213 2.569 10 0 EFAEHO [NH3+]C[C@H]1CCCC[C@@H]1NCc1cc(Cl)ccc1N1CCOCC1 ZINC000423106872 476929973 /nfs/dbraw/zinc/92/99/73/476929973.db2.gz RNVJSRIIQFNAES-PBHICJAKSA-N 1 3 337.895 2.784 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000423105754 476930013 /nfs/dbraw/zinc/93/00/13/476930013.db2.gz IQTUTMFCUXPRNS-SWLSCSKDSA-N 1 3 335.275 2.760 10 0 EFAEHO CC1(C)[C@H](Oc2ccccc2)C[C@@H]1N[C@@H]1CCOC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000423125226 476937497 /nfs/dbraw/zinc/93/74/97/476937497.db2.gz NLRJROPFMNCDGC-UHZRXMQZSA-N 1 3 344.499 2.979 10 0 EFAEHO C[C@@H](NCC[C@H]1CC[NH2+]C1)c1ccccc1I ZINC000423243992 476973518 /nfs/dbraw/zinc/97/35/18/476973518.db2.gz HDIOAMNSTIAQQW-VXGBXAGGSA-N 1 3 344.240 2.941 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1cccc(Br)c1Cl ZINC000423172432 476952352 /nfs/dbraw/zinc/95/23/52/476952352.db2.gz SXJLZTAHBCTMMF-NSHDSACASA-N 1 3 335.673 2.946 10 0 EFAEHO C[NH+](C)CC1CCC(NC(=O)Nc2ccc3c(c2)CNCC3)CC1 ZINC000415903696 476965045 /nfs/dbraw/zinc/96/50/45/476965045.db2.gz XFYDIDAGCHMWBD-UHFFFAOYSA-N 1 3 330.476 2.574 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNC(=O)Nc2ccc3c(c2)CNC3)C1 ZINC000415997329 476984503 /nfs/dbraw/zinc/98/45/03/476984503.db2.gz PAIJWEIPEPIYLD-OAHLLOKOSA-N 1 3 330.476 2.923 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNC(=O)Nc2ccc3c(c2)CNC3)C1 ZINC000415997329 476984507 /nfs/dbraw/zinc/98/45/07/476984507.db2.gz PAIJWEIPEPIYLD-OAHLLOKOSA-N 1 3 330.476 2.923 10 0 EFAEHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000423292716 476985273 /nfs/dbraw/zinc/98/52/73/476985273.db2.gz ODIJSJPZMPGPOQ-UONOGXRCSA-N 1 3 347.484 2.929 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc3c(c2)OCC(=O)N3)cc1 ZINC000423296817 476985309 /nfs/dbraw/zinc/98/53/09/476985309.db2.gz ZXATWUVJGZFEBI-OLZOCXBDSA-N 1 3 325.412 2.888 10 0 EFAEHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000423296818 476985354 /nfs/dbraw/zinc/98/53/54/476985354.db2.gz ZXATWUVJGZFEBI-QWHCGFSZSA-N 1 3 325.412 2.888 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2cccc(NS(C)(=O)=O)c2)cc1 ZINC000423295992 476985396 /nfs/dbraw/zinc/98/53/96/476985396.db2.gz YDIUIECBYXLJEO-KBPBESRZSA-N 1 3 347.484 2.929 10 0 EFAEHO C[C@@H]1CN(C2CC2)C[C@H]1NC[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000423461384 477038427 /nfs/dbraw/zinc/03/84/27/477038427.db2.gz CHPAPIXRZFQQHK-HIBPSGHXSA-N 1 3 331.479 2.591 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)CCN2CCc3ccccc3C2)[C@H](C)C1 ZINC000416157314 477046021 /nfs/dbraw/zinc/04/60/21/477046021.db2.gz QPSCUVALXFJLGF-YLJYHZDGSA-N 1 3 343.515 2.624 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)CCN2CCc3ccccc3C2)[C@H](C)C1 ZINC000416157314 477046026 /nfs/dbraw/zinc/04/60/26/477046026.db2.gz QPSCUVALXFJLGF-YLJYHZDGSA-N 1 3 343.515 2.624 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)C3CC(C(C)(C)C)C3)CC2)CC1 ZINC000457498841 477054020 /nfs/dbraw/zinc/05/40/20/477054020.db2.gz AFSFXUKUFLMDQI-UHFFFAOYSA-N 1 3 335.536 2.734 10 0 EFAEHO COc1ccc(C[C@@H](C)[NH2+]CC2(N)C3CC4CC(C3)CC2C4)cn1 ZINC000423520676 477059735 /nfs/dbraw/zinc/05/97/35/477059735.db2.gz FOGOWTZEILUNHO-ZXJCKZHESA-N 1 3 329.488 2.764 10 0 EFAEHO COc1ccc(C[C@@H](C)NCC2([NH3+])C3CC4CC(C3)CC2C4)cn1 ZINC000423520676 477059740 /nfs/dbraw/zinc/05/97/40/477059740.db2.gz FOGOWTZEILUNHO-ZXJCKZHESA-N 1 3 329.488 2.764 10 0 EFAEHO C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)CCN1CCc2ccccc2C1 ZINC000416185673 477061407 /nfs/dbraw/zinc/06/14/07/477061407.db2.gz WGNUWQRTDMVGTE-KRWDZBQOSA-N 1 3 343.515 2.624 10 0 EFAEHO Cc1nn(C)c(CNC2CCC(C[NH+](C)C)CC2)c1Br ZINC000447893423 477086017 /nfs/dbraw/zinc/08/60/17/477086017.db2.gz MNKQQFHDEZMUCH-UHFFFAOYSA-N 1 3 343.313 2.701 10 0 EFAEHO COC1([C@@H](C)[NH2+]C[C@@H]2CCN(CCc3ccccc3)C2)CCOCC1 ZINC000453114511 477171561 /nfs/dbraw/zinc/17/15/61/477171561.db2.gz VTELHSKRKKVPSD-QUCCMNQESA-N 1 3 346.515 2.725 10 0 EFAEHO COC1([C@H](C)[NH2+]C[C@@H]2CCN(CCc3ccccc3)C2)CCOCC1 ZINC000453114509 477172413 /nfs/dbraw/zinc/17/24/13/477172413.db2.gz VTELHSKRKKVPSD-ICSRJNTNSA-N 1 3 346.515 2.725 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@H]2C)[C@@H](C)C1 ZINC000448518850 477182437 /nfs/dbraw/zinc/18/24/37/477182437.db2.gz AYSBVYGTKSQBHV-MLHJIOFPSA-N 1 3 338.540 2.621 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@H]2C)[C@@H](C)C1 ZINC000448518850 477182442 /nfs/dbraw/zinc/18/24/42/477182442.db2.gz AYSBVYGTKSQBHV-MLHJIOFPSA-N 1 3 338.540 2.621 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000371243451 477196427 /nfs/dbraw/zinc/19/64/27/477196427.db2.gz KGXKOHAJFMRPSH-UXHICEINSA-N 1 3 341.499 2.887 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2c(F)cccc2-n2cccn2)[C@H]2CCC[C@@H]21 ZINC000453349189 477210422 /nfs/dbraw/zinc/21/04/22/477210422.db2.gz JGVGEWYKLSSGJW-JLSDUUJJSA-N 1 3 328.435 2.974 10 0 EFAEHO CN(C)C[C@H](Cc1ccccc1)NC(=O)NC(C)(C)CCC[NH+](C)C ZINC000457914736 477254764 /nfs/dbraw/zinc/25/47/64/477254764.db2.gz QDBZZRCPOYVLAD-SFHVURJKSA-N 1 3 348.535 2.579 10 0 EFAEHO CCN1CCC(NC(=O)C[NH2+][C@H]2CCCC[C@H]2c2ccccc2)CC1 ZINC000411561727 477275989 /nfs/dbraw/zinc/27/59/89/477275989.db2.gz RIAGOSMHVPSSJV-PMACEKPBSA-N 1 3 343.515 2.903 10 0 EFAEHO CC(CCN1CCO[C@H](C2CC2)C1)CC[N@@H+]1CCO[C@H](C2CC2)C1 ZINC000411567470 477278835 /nfs/dbraw/zinc/27/88/35/477278835.db2.gz YYPFZRCVOXBKIF-PMACEKPBSA-N 1 3 336.520 2.624 10 0 EFAEHO CC(CCN1CCO[C@H](C2CC2)C1)CC[N@H+]1CCO[C@H](C2CC2)C1 ZINC000411567470 477278846 /nfs/dbraw/zinc/27/88/46/477278846.db2.gz YYPFZRCVOXBKIF-PMACEKPBSA-N 1 3 336.520 2.624 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+](C)[C@H](C)[C@@H]2Cc3ccccc3O2)CC1 ZINC000367044892 477313842 /nfs/dbraw/zinc/31/38/42/477313842.db2.gz YBMZRYIVSOKMPC-NQIIRXRSSA-N 1 3 345.531 2.727 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+](C)[C@H](C)[C@@H]2Cc3ccccc3O2)CC1 ZINC000367044892 477313851 /nfs/dbraw/zinc/31/38/51/477313851.db2.gz YBMZRYIVSOKMPC-NQIIRXRSSA-N 1 3 345.531 2.727 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1 ZINC000416808994 477317488 /nfs/dbraw/zinc/31/74/88/477317488.db2.gz PLVJKZZFPWQEIR-KXBFYZLASA-N 1 3 340.471 2.808 10 0 EFAEHO C[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)[C@H](C)[NH3+] ZINC000416831108 477326885 /nfs/dbraw/zinc/32/68/85/477326885.db2.gz HIFFMDHFZZVURK-RRFJBIMHSA-N 1 3 338.521 2.556 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCCCC[N@H+](C)C2CC2)[C@@H]1c1ccccc1 ZINC000454720972 477344896 /nfs/dbraw/zinc/34/48/96/477344896.db2.gz KLDVSDQYCJAGMN-MOPGFXCFSA-N 1 3 344.503 2.605 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCCCC[N@@H+](C)C2CC2)[C@@H]1c1ccccc1 ZINC000454720972 477344900 /nfs/dbraw/zinc/34/49/00/477344900.db2.gz KLDVSDQYCJAGMN-MOPGFXCFSA-N 1 3 344.503 2.605 10 0 EFAEHO CCC1(CNC(=O)NCCN(C)C)CC[NH+](Cc2ccccc2)CC1 ZINC000367118287 477350169 /nfs/dbraw/zinc/35/01/69/477350169.db2.gz ZTGNTTLJQPRBDM-UHFFFAOYSA-N 1 3 346.519 2.540 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@H]([NH2+]Cc3ccccc3CN3CC[C@@H](O)C3)C[C@H]2C1 ZINC000424281476 477354893 /nfs/dbraw/zinc/35/48/93/477354893.db2.gz NMVRNIKVQBQRQE-IFLJBQAJSA-N 1 3 344.499 2.546 10 0 EFAEHO C[C@@H](Cc1ccoc1)[NH2+]Cc1ccc(CN2CCC(O)CC2)cc1 ZINC000449058101 477415410 /nfs/dbraw/zinc/41/54/10/477415410.db2.gz GIQDQAXYLOIRMX-INIZCTEOSA-N 1 3 328.456 2.957 10 0 EFAEHO CC(C)[C@@H](CNC(=O)NC[C@H](N)c1ccccc1)[NH+]1CCC(C)CC1 ZINC000416999931 477416017 /nfs/dbraw/zinc/41/60/17/477416017.db2.gz CNBXFBQHJVAUJM-RBUKOAKNSA-N 1 3 346.519 2.742 10 0 EFAEHO CC(C)NC(=O)CCNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449078022 477424839 /nfs/dbraw/zinc/42/48/39/477424839.db2.gz TVGKUYOZUPBCQG-QGZVFWFLSA-N 1 3 331.504 2.586 10 0 EFAEHO C[C@H](Cn1cccn1)NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449078352 477425511 /nfs/dbraw/zinc/42/55/11/477425511.db2.gz ULTJIQXAYRKVIA-QZTJIDSGSA-N 1 3 326.488 2.957 10 0 EFAEHO CC(C)COC[C@H](O)CNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449095555 477436616 /nfs/dbraw/zinc/43/66/16/477436616.db2.gz ZJLOTEFBKOOXQG-GHTZIAJQSA-N 1 3 348.531 2.705 10 0 EFAEHO CC[C@H](C)NC(=O)CCNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449093786 477436719 /nfs/dbraw/zinc/43/67/19/477436719.db2.gz YLAWCDSYOTXBFK-ZWKOTPCHSA-N 1 3 345.531 2.976 10 0 EFAEHO COCCN(C)CCNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449113190 477443851 /nfs/dbraw/zinc/44/38/51/477443851.db2.gz VRAWNLORDGSFSL-UHFFFAOYSA-N 1 3 327.557 2.833 10 0 EFAEHO CSC[C@@H](CCO)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449159740 477463816 /nfs/dbraw/zinc/46/38/16/477463816.db2.gz ILRIZPSFTSAVFQ-QFBILLFUSA-N 1 3 336.545 2.786 10 0 EFAEHO CSC[C@@](C)(O)CNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449165091 477465526 /nfs/dbraw/zinc/46/55/26/477465526.db2.gz SXGQNRHFNKVHCZ-APWZRJJASA-N 1 3 336.545 2.786 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)N(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000418351445 477470829 /nfs/dbraw/zinc/47/08/29/477470829.db2.gz LTYQIYHTGFPYRQ-ZYSHUDEJSA-N 1 3 346.519 2.934 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000418351445 477470834 /nfs/dbraw/zinc/47/08/34/477470834.db2.gz LTYQIYHTGFPYRQ-ZYSHUDEJSA-N 1 3 346.519 2.934 10 0 EFAEHO CC(C)(C)CC(C)(C)[NH+]1CCC(NCCN2CCCOCC2)CC1 ZINC000449324003 477547415 /nfs/dbraw/zinc/54/74/15/477547415.db2.gz CMUJUQMOJVUYNS-UHFFFAOYSA-N 1 3 339.568 2.978 10 0 EFAEHO Cn1c2cccc(F)c2nc1CCN[C@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000367618996 477605022 /nfs/dbraw/zinc/60/50/22/477605022.db2.gz UXKBZWZKYNUNII-VNQPRFMTSA-N 1 3 330.451 2.717 10 0 EFAEHO Cn1c2cccc(F)c2nc1CCN[C@H]1CC[N@@H+](C)[C@@H]2CCC[C@@H]21 ZINC000367618996 477605025 /nfs/dbraw/zinc/60/50/25/477605025.db2.gz UXKBZWZKYNUNII-VNQPRFMTSA-N 1 3 330.451 2.717 10 0 EFAEHO Cn1c2ccc(F)cc2nc1CCN[C@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000367627164 477608640 /nfs/dbraw/zinc/60/86/40/477608640.db2.gz RYBFILVWUAELMV-VYDXJSESSA-N 1 3 330.451 2.717 10 0 EFAEHO Cn1c2ccc(F)cc2nc1CCN[C@H]1CC[N@@H+](C)[C@H]2CCC[C@@H]21 ZINC000367627164 477608649 /nfs/dbraw/zinc/60/86/49/477608649.db2.gz RYBFILVWUAELMV-VYDXJSESSA-N 1 3 330.451 2.717 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)CC(C)(C)C(F)(F)F)CC2)CC1 ZINC000377086161 477635531 /nfs/dbraw/zinc/63/55/31/477635531.db2.gz IGNIDHUKFZRMPZ-UHFFFAOYSA-N 1 3 349.441 2.640 10 0 EFAEHO CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCN2CCC1CC2 ZINC000377111545 477649822 /nfs/dbraw/zinc/64/98/22/477649822.db2.gz IEOWMKHXBAIHSG-UHFFFAOYSA-N 1 3 344.503 2.518 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cc3ccccc3n(C)c2=O)[C@H]2CCC[C@H]21 ZINC000426287197 477703922 /nfs/dbraw/zinc/70/39/22/477703922.db2.gz WSDKVAWKDAJSJR-ZIFCJYIRSA-N 1 3 325.456 2.501 10 0 EFAEHO CCN(C(=O)NC[C@H](C)[NH+](C)C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000459033581 477709261 /nfs/dbraw/zinc/70/92/61/477709261.db2.gz CBBOGRNFMROJEO-LNLFQRSKSA-N 1 3 346.519 2.804 10 0 EFAEHO C[C@@H](NCC(=O)NC1CC[NH+](C2CC2)CC1)c1cccc(C2CC2)c1 ZINC000451111342 477829293 /nfs/dbraw/zinc/82/92/93/477829293.db2.gz GJJUIUWQRHWRGM-OAHLLOKOSA-N 1 3 341.499 2.958 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC2(N(C)C)CCC2)CC1 ZINC000438339058 477829548 /nfs/dbraw/zinc/82/95/48/477829548.db2.gz GMTUXGMMSUWJMG-UHFFFAOYSA-N 1 3 344.547 2.793 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C)[C@H]2C[C@@H](OC)C2)CC1 ZINC000558412630 477864361 /nfs/dbraw/zinc/86/43/61/477864361.db2.gz HKSZZEWOLZGTPY-KDURUIRLSA-N 1 3 331.504 2.828 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C)[C@H]2C[C@@H](OC)C2)CC1 ZINC000558412630 477864368 /nfs/dbraw/zinc/86/43/68/477864368.db2.gz HKSZZEWOLZGTPY-KDURUIRLSA-N 1 3 331.504 2.828 10 0 EFAEHO CC(C)C[C@H]([NH2+]CCc1cccc(Cl)c1)C(=O)NCCN(C)C ZINC000459452729 477912132 /nfs/dbraw/zinc/91/21/32/477912132.db2.gz MQHALRUEHGIUAF-KRWDZBQOSA-N 1 3 339.911 2.565 10 0 EFAEHO CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCC[N@H+]1[C@H](C)CCC[C@@H]1C ZINC000439310699 477962087 /nfs/dbraw/zinc/96/20/87/477962087.db2.gz VRABCZNQYXZPHQ-XDNAFOTISA-N 1 3 336.524 2.518 10 0 EFAEHO CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000439310699 477962095 /nfs/dbraw/zinc/96/20/95/477962095.db2.gz VRABCZNQYXZPHQ-XDNAFOTISA-N 1 3 336.524 2.518 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)NCC1CCCCC1 ZINC000465445036 477976216 /nfs/dbraw/zinc/97/62/16/477976216.db2.gz SRMKONLEBPHTQB-SFHVURJKSA-N 1 3 338.540 2.624 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)NCC1CCCCC1 ZINC000465445036 477976221 /nfs/dbraw/zinc/97/62/21/477976221.db2.gz SRMKONLEBPHTQB-SFHVURJKSA-N 1 3 338.540 2.624 10 0 EFAEHO CCOc1ccc(C(=O)N2CCC([NH2+][C@H]3CCC[C@@H](N)C3)CC2)cc1 ZINC000516785855 477987882 /nfs/dbraw/zinc/98/78/82/477987882.db2.gz YFUSWQFHAKSJDL-AEFFLSMTSA-N 1 3 345.487 2.549 10 0 EFAEHO CN1CC[C@]2(CC[N@H+](CCCc3nc(-c4cccs4)no3)C2)C1 ZINC000429018341 478040642 /nfs/dbraw/zinc/04/06/42/478040642.db2.gz HGXVBEBGKKANQF-KRWDZBQOSA-N 1 3 332.473 2.758 10 0 EFAEHO CN1CC[C@]2(CC[N@@H+](CCCc3nc(-c4cccs4)no3)C2)C1 ZINC000429018341 478040649 /nfs/dbraw/zinc/04/06/49/478040649.db2.gz HGXVBEBGKKANQF-KRWDZBQOSA-N 1 3 332.473 2.758 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2C[C@H](C)C[C@H](CO)C2)CC1 ZINC000421357893 478050632 /nfs/dbraw/zinc/05/06/32/478050632.db2.gz AGZVEYSRVHJVLI-MOPGFXCFSA-N 1 3 345.531 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2C[C@H](C)C[C@H](CO)C2)CC1 ZINC000421357893 478050636 /nfs/dbraw/zinc/05/06/36/478050636.db2.gz AGZVEYSRVHJVLI-MOPGFXCFSA-N 1 3 345.531 2.669 10 0 EFAEHO CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+]CC(=O)NC1CCN(C2CC2)CC1 ZINC000440058040 478066372 /nfs/dbraw/zinc/06/63/72/478066372.db2.gz BIWQYYUWRSEPTC-MSOLQXFVSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[N@H+](CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1)CC1CC1 ZINC000517757049 478122726 /nfs/dbraw/zinc/12/27/26/478122726.db2.gz MMXTXMJDYCYGQT-KRWDZBQOSA-N 1 3 335.536 2.689 10 0 EFAEHO CC[N@@H+](CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1)CC1CC1 ZINC000517757049 478122732 /nfs/dbraw/zinc/12/27/32/478122732.db2.gz MMXTXMJDYCYGQT-KRWDZBQOSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)NC1CCC(C[NH+](C)C)CC1 ZINC000440789886 478160768 /nfs/dbraw/zinc/16/07/68/478160768.db2.gz DFHHUYLJKVIZKT-VYMRPNJYSA-N 1 3 338.540 2.669 10 0 EFAEHO CC1(C)COC[C@@H]1NCc1ccccc1C[NH2+][C@@H]1COCC1(C)C ZINC000451812770 478212855 /nfs/dbraw/zinc/21/28/55/478212855.db2.gz PPMYPPXHEWPFGO-HDICACEKSA-N 1 3 332.488 2.716 10 0 EFAEHO CC1(C)COC[C@@H]1[NH2+]Cc1ccccc1CN[C@@H]1COCC1(C)C ZINC000451812770 478212861 /nfs/dbraw/zinc/21/28/61/478212861.db2.gz PPMYPPXHEWPFGO-HDICACEKSA-N 1 3 332.488 2.716 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@H](C)C3CCCC3)CC2)CC1 ZINC000520607134 478331209 /nfs/dbraw/zinc/33/12/09/478331209.db2.gz AMXDEKPONPMBSF-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO c1nnc([C@@H]2CCCN(Cc3ccc4c(c3)C[NH2+]CC4)C2)n1C1CC1 ZINC000570456294 478364205 /nfs/dbraw/zinc/36/42/05/478364205.db2.gz RFDDBENVZKFGAT-QGZVFWFLSA-N 1 3 337.471 2.638 10 0 EFAEHO COC(=O)c1ccc2c(c1)[C@H](NC[C@H]1CC[N@@H+](C3CC3)C1)CCC2 ZINC000594495456 478409762 /nfs/dbraw/zinc/40/97/62/478409762.db2.gz YFBXJQOGBFNWMW-AUUYWEPGSA-N 1 3 328.456 2.925 10 0 EFAEHO COC(=O)c1ccc2c(c1)[C@H](NC[C@H]1CC[N@H+](C3CC3)C1)CCC2 ZINC000594495456 478409771 /nfs/dbraw/zinc/40/97/71/478409771.db2.gz YFBXJQOGBFNWMW-AUUYWEPGSA-N 1 3 328.456 2.925 10 0 EFAEHO COC(=O)c1ccc2c(c1)[C@@H](NC[C@@H]1CC[N@@H+](C3CC3)C1)CCC2 ZINC000594495459 478410566 /nfs/dbraw/zinc/41/05/66/478410566.db2.gz YFBXJQOGBFNWMW-LIRRHRJNSA-N 1 3 328.456 2.925 10 0 EFAEHO COC(=O)c1ccc2c(c1)[C@@H](NC[C@@H]1CC[N@H+](C3CC3)C1)CCC2 ZINC000594495459 478410569 /nfs/dbraw/zinc/41/05/69/478410569.db2.gz YFBXJQOGBFNWMW-LIRRHRJNSA-N 1 3 328.456 2.925 10 0 EFAEHO C[C@@H]1CN(Cc2ccnc3ccccc23)CC[C@H]1[NH+]1CCN(C)CC1 ZINC000539823370 478442593 /nfs/dbraw/zinc/44/25/93/478442593.db2.gz FCFJLFDGGAJTNJ-DYESRHJHSA-N 1 3 338.499 2.693 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)N2CCCN(C(C)(C)C)CC2)cc1 ZINC000581874488 478456446 /nfs/dbraw/zinc/45/64/46/478456446.db2.gz XBAGFUYCIIRMSE-OAHLLOKOSA-N 1 3 332.492 2.722 10 0 EFAEHO CCOC(=O)C1([C@H](C)N[C@H](c2ccccn2)C2CCC2)CC[NH2+]CC1 ZINC000600708951 478479191 /nfs/dbraw/zinc/47/91/91/478479191.db2.gz MAZUEHYHLJXOFJ-YJBOKZPZSA-N 1 3 345.487 2.834 10 0 EFAEHO CNC[C@](C)(O)C[NH+]1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000563267953 478501414 /nfs/dbraw/zinc/50/14/14/478501414.db2.gz GIXKDSFJQUTIEQ-INIZCTEOSA-N 1 3 330.394 2.855 10 0 EFAEHO C[C@@H]1CCC[C@](CNC(=O)CCN(C)c2ccncc2)([NH+](C)C)C1 ZINC000540927316 478511733 /nfs/dbraw/zinc/51/17/33/478511733.db2.gz DLNMZBPKHBTRBQ-APWZRJJASA-N 1 3 332.492 2.535 10 0 EFAEHO CCCN1CCC([N@H+](C)Cc2cc3ccccc3n(C)c2=O)CC1 ZINC000571295196 478564513 /nfs/dbraw/zinc/56/45/13/478564513.db2.gz QXRRAMQRWAFHJF-UHFFFAOYSA-N 1 3 327.472 2.845 10 0 EFAEHO CCCN1CCC([N@@H+](C)Cc2cc3ccccc3n(C)c2=O)CC1 ZINC000571295196 478564520 /nfs/dbraw/zinc/56/45/20/478564520.db2.gz QXRRAMQRWAFHJF-UHFFFAOYSA-N 1 3 327.472 2.845 10 0 EFAEHO O[C@H](CN[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21)[C@H]1CCCO1 ZINC000527955188 478586465 /nfs/dbraw/zinc/58/64/65/478586465.db2.gz QHUBLNPYWWRWNL-PFAUGDHASA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@H](CN[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21)[C@H]1CCCO1 ZINC000527955188 478586472 /nfs/dbraw/zinc/58/64/72/478586472.db2.gz QHUBLNPYWWRWNL-PFAUGDHASA-N 1 3 344.499 2.559 10 0 EFAEHO CCCN1CC[C@@H](C[NH2+]C[C@@H](O)COc2ccccc2C(C)C)C1 ZINC000563618609 478603973 /nfs/dbraw/zinc/60/39/73/478603973.db2.gz YLOXWIGCGQBOGL-ZWKOTPCHSA-N 1 3 334.504 2.871 10 0 EFAEHO C[C@@H](CSCCF)[NH2+]Cc1ccc(CN2CCC(O)CC2)cc1 ZINC000595010385 478627913 /nfs/dbraw/zinc/62/79/13/478627913.db2.gz HNPKOADHJIBQMF-HNNXBMFYSA-N 1 3 340.508 2.824 10 0 EFAEHO C[C@@H](CSCCF)[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000595025742 478633214 /nfs/dbraw/zinc/63/32/14/478633214.db2.gz MDBRKNYDRQAUAH-INIZCTEOSA-N 1 3 331.545 2.618 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)c1ccc(-c2ccccc2)o1 ZINC000542444937 478653465 /nfs/dbraw/zinc/65/34/65/478653465.db2.gz OFWSUNJKXOFDOW-UHFFFAOYSA-N 1 3 329.444 2.512 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3CC(C(C)(C)C)C3)CC2)CC1 ZINC000571895249 478703646 /nfs/dbraw/zinc/70/36/46/478703646.db2.gz PUTJGILLTYIAQH-UHFFFAOYSA-N 1 3 335.536 2.687 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)N[C@H](C)CN2CCC(C)CC2)cc1 ZINC000582856965 478706059 /nfs/dbraw/zinc/70/60/59/478706059.db2.gz VSEPAPKEACDRNP-HZPDHXFCSA-N 1 3 332.492 2.626 10 0 EFAEHO CN(C)CCN(C(=O)CCN(C)c1cc[nH+]cc1)C1CCCCC1 ZINC000543712984 478770788 /nfs/dbraw/zinc/77/07/88/478770788.db2.gz YDCOFDYNJRKBIV-UHFFFAOYSA-N 1 3 332.492 2.631 10 0 EFAEHO CC1CCC(N2CCN(C(=O)CCN(C)c3cc[nH+]cc3)CC2)CC1 ZINC000543715038 478772171 /nfs/dbraw/zinc/77/21/71/478772171.db2.gz WNZDEPGVFNVNIF-UHFFFAOYSA-N 1 3 344.503 2.631 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1CNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000500526442 478792853 /nfs/dbraw/zinc/79/28/53/478792853.db2.gz PJBSEIABWYSTJV-GBESFXJTSA-N 1 3 344.503 2.605 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1CNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000500526442 478792860 /nfs/dbraw/zinc/79/28/60/478792860.db2.gz PJBSEIABWYSTJV-GBESFXJTSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@@H+]1CCC[C@H](C)C1 ZINC000572495810 478851498 /nfs/dbraw/zinc/85/14/98/478851498.db2.gz GCAMZRIEYKBWJO-KBPBESRZSA-N 1 3 348.466 2.713 10 0 EFAEHO C[C@@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@H+]1CCC[C@H](C)C1 ZINC000572495810 478851504 /nfs/dbraw/zinc/85/15/04/478851504.db2.gz GCAMZRIEYKBWJO-KBPBESRZSA-N 1 3 348.466 2.713 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)Nc1ccc2c(c1)OCCNC2 ZINC000528717635 478895438 /nfs/dbraw/zinc/89/54/38/478895438.db2.gz FFYGUTCNLOOBFK-HUUCEWRRSA-N 1 3 346.475 2.553 10 0 EFAEHO CCOC(=O)C1([C@@H](C)NC2(c3ccccc3OC)CC2)CC[NH2+]CC1 ZINC000592470740 478907256 /nfs/dbraw/zinc/90/72/56/478907256.db2.gz GQUATBZDOWJIEX-OAHLLOKOSA-N 1 3 346.471 2.595 10 0 EFAEHO CCO[C@@H]1C[C@H](NC[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)[C@@H]1SC ZINC000592523955 478930754 /nfs/dbraw/zinc/93/07/54/478930754.db2.gz AWLUZHNXVWVSHL-SPOLIRPYSA-N 1 3 334.529 2.830 10 0 EFAEHO CCO[C@@H]1C[C@H](NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)[C@@H]1SC ZINC000592523955 478930763 /nfs/dbraw/zinc/93/07/63/478930763.db2.gz AWLUZHNXVWVSHL-SPOLIRPYSA-N 1 3 334.529 2.830 10 0 EFAEHO N[C@@H]1CCCCC[C@@H]1[NH2+]Cc1ccc(Cn2ccccc2=O)cc1 ZINC000583806463 478946031 /nfs/dbraw/zinc/94/60/31/478946031.db2.gz IZBUEPIXTHNBQD-MOPGFXCFSA-N 1 3 325.456 2.646 10 0 EFAEHO c1ncn2cc(CN[C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)ccc12 ZINC000584714357 479214892 /nfs/dbraw/zinc/21/48/92/479214892.db2.gz KQHDZOJJUFDJQH-AZUAARDMSA-N 1 3 334.423 2.680 10 0 EFAEHO NC[C@@H]1CCC[C@@H]1[NH2+]CCc1ccc(I)cc1 ZINC000596652797 479373645 /nfs/dbraw/zinc/37/36/45/479373645.db2.gz HZSKNVMQORQCEB-JSGCOSHPSA-N 1 3 344.240 2.551 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)NC[C@@H]2CCCCN2C2CC2)cc1 ZINC000575853608 479487240 /nfs/dbraw/zinc/48/72/40/479487240.db2.gz FQKZIYFEPBAZHQ-KSSFIOAISA-N 1 3 330.476 2.522 10 0 EFAEHO CCOC(=O)[C@](C)(CN[C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1 ZINC000600151830 479546793 /nfs/dbraw/zinc/54/67/93/479546793.db2.gz OUEXJCFTISHMGV-YLJYHZDGSA-N 1 3 332.488 2.970 10 0 EFAEHO CCOC(=O)[C@](C)(CN[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1 ZINC000600151830 479546799 /nfs/dbraw/zinc/54/67/99/479546799.db2.gz OUEXJCFTISHMGV-YLJYHZDGSA-N 1 3 332.488 2.970 10 0 EFAEHO CN(C)[C@H](CC(=O)N1CCC2(C1)CC[NH+](C)CC2)c1ccccc1 ZINC000614963761 479562629 /nfs/dbraw/zinc/56/26/29/479562629.db2.gz QISSKCDYJCKHHL-GOSISDBHSA-N 1 3 329.488 2.624 10 0 EFAEHO CCCN1CCN(c2ccccc2CN(C)CCC[NH+](C)C)CC1 ZINC000578918863 479631246 /nfs/dbraw/zinc/63/12/46/479631246.db2.gz DQGQYMXKDHMYRN-UHFFFAOYSA-N 1 3 332.536 2.602 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)CC[N@@H+]1C ZINC000630806973 479716448 /nfs/dbraw/zinc/71/64/48/479716448.db2.gz CMHHLGRDBKTTBP-OQIJWPOYSA-N 1 3 329.488 2.668 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)CC[N@H+]1C ZINC000630806973 479716451 /nfs/dbraw/zinc/71/64/51/479716451.db2.gz CMHHLGRDBKTTBP-OQIJWPOYSA-N 1 3 329.488 2.668 10 0 EFAEHO Cc1cc(C(F)F)oc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000628051274 479747213 /nfs/dbraw/zinc/74/72/13/479747213.db2.gz AIPCOJQRDQHYJH-LBPRGKRZSA-N 1 3 331.407 2.527 10 0 EFAEHO Cc1cc(C(F)F)oc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000628051274 479747217 /nfs/dbraw/zinc/74/72/17/479747217.db2.gz AIPCOJQRDQHYJH-LBPRGKRZSA-N 1 3 331.407 2.527 10 0 EFAEHO Cc1ncc(CNCCCC[NH+]2CCN(c3cccc(C)c3)CC2)o1 ZINC000628201449 479810787 /nfs/dbraw/zinc/81/07/87/479810787.db2.gz GPLYPFKFNDPUJB-UHFFFAOYSA-N 1 3 342.487 2.983 10 0 EFAEHO CN1CCN(Cc2ccc(C[NH2+]C[C@]3(C)CCCS3)cc2)CC1 ZINC000628202218 479810888 /nfs/dbraw/zinc/81/08/88/479810888.db2.gz LQMPRYZNGYNGIA-IBGZPJMESA-N 1 3 333.545 2.809 10 0 EFAEHO CC[NH+]1CCN(Cc2ccc(CNCc3oc(C)nc3C)cc2)CC1 ZINC000628203863 479812065 /nfs/dbraw/zinc/81/20/65/479812065.db2.gz ZMRYLEFMLYPGNG-UHFFFAOYSA-N 1 3 342.487 2.719 10 0 EFAEHO C[C@H]([NH2+]C1CCN([C@@H](C)Cc2ccccc2)CC1)[C@@H](O)C(F)(F)F ZINC000631716098 480235438 /nfs/dbraw/zinc/23/54/38/480235438.db2.gz HONGLZQYNSSRSK-GRDNDAEWSA-N 1 3 344.421 2.983 10 0 EFAEHO CN1CC[C@@H]([NH2+]C[C@H](c2cccs2)N2CCOCC2)CC1(C)C ZINC000623337615 480238667 /nfs/dbraw/zinc/23/86/67/480238667.db2.gz QIVFJGINHGDKKY-HZPDHXFCSA-N 1 3 337.533 2.584 10 0 EFAEHO CN1CC[C@@H]([NH2+]C[C@@H](c2ccc(F)cc2)N2CCOCC2)CC1(C)C ZINC000623337956 480238938 /nfs/dbraw/zinc/23/89/38/480238938.db2.gz DGVRCFPGTKCNTP-MOPGFXCFSA-N 1 3 349.494 2.661 10 0 EFAEHO Cc1ccc(CCC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c(C)c1 ZINC000617503937 480246175 /nfs/dbraw/zinc/24/61/75/480246175.db2.gz BHTIEKARALNIOB-SFHVURJKSA-N 1 3 333.520 2.624 10 0 EFAEHO Cc1ccc(CCC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c(C)c1 ZINC000617503937 480246181 /nfs/dbraw/zinc/24/61/81/480246181.db2.gz BHTIEKARALNIOB-SFHVURJKSA-N 1 3 333.520 2.624 10 0 EFAEHO Cc1ccccc1C(C)(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617504721 480246921 /nfs/dbraw/zinc/24/69/21/480246921.db2.gz HALIUARITKSIGO-KRWDZBQOSA-N 1 3 333.520 2.661 10 0 EFAEHO Cc1ccccc1C(C)(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617504721 480246923 /nfs/dbraw/zinc/24/69/23/480246923.db2.gz HALIUARITKSIGO-KRWDZBQOSA-N 1 3 333.520 2.661 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccccc2CN2CCCC2=O)CC1(C)C ZINC000623355102 480247156 /nfs/dbraw/zinc/24/71/56/480247156.db2.gz ZENNPOVCSBHDHX-SFHVURJKSA-N 1 3 329.488 2.771 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@]1(C)CCc2ccccc2C1 ZINC000617505741 480247273 /nfs/dbraw/zinc/24/72/73/480247273.db2.gz OETQVOOZDIOEIG-UWJYYQICSA-N 1 3 345.531 2.570 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@]1(C)CCc2ccccc2C1 ZINC000617505741 480247278 /nfs/dbraw/zinc/24/72/78/480247278.db2.gz OETQVOOZDIOEIG-UWJYYQICSA-N 1 3 345.531 2.570 10 0 EFAEHO Cc1ccc2c(CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)coc2c1 ZINC000617503519 480247820 /nfs/dbraw/zinc/24/78/20/480247820.db2.gz MWSPLHCYYIXYLD-INIZCTEOSA-N 1 3 345.487 2.672 10 0 EFAEHO Cc1ccc2c(CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)coc2c1 ZINC000617503519 480247827 /nfs/dbraw/zinc/24/78/27/480247827.db2.gz MWSPLHCYYIXYLD-INIZCTEOSA-N 1 3 345.487 2.672 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(OC2CCC2)cc1 ZINC000617505868 480248349 /nfs/dbraw/zinc/24/83/49/480248349.db2.gz STNSOHSUPNTGCX-INIZCTEOSA-N 1 3 347.503 2.620 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(OC2CCC2)cc1 ZINC000617505868 480248353 /nfs/dbraw/zinc/24/83/53/480248353.db2.gz STNSOHSUPNTGCX-INIZCTEOSA-N 1 3 347.503 2.620 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cccc(CN3CCCC3=O)c2)CC1(C)C ZINC000623357039 480248403 /nfs/dbraw/zinc/24/84/03/480248403.db2.gz WVUIPTNTCNSZSU-SFHVURJKSA-N 1 3 329.488 2.771 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1csc2c1CCCC2 ZINC000617504471 480248454 /nfs/dbraw/zinc/24/84/54/480248454.db2.gz XKFKGMCYPBGLNI-AWEZNQCLSA-N 1 3 337.533 2.629 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1csc2c1CCCC2 ZINC000617504471 480248458 /nfs/dbraw/zinc/24/84/58/480248458.db2.gz XKFKGMCYPBGLNI-AWEZNQCLSA-N 1 3 337.533 2.629 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C[C@H](C)c1cccc(F)c1 ZINC000617505684 480248515 /nfs/dbraw/zinc/24/85/15/480248515.db2.gz MPNXTLBIBBRZHM-HOTGVXAUSA-N 1 3 337.483 2.708 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C[C@H](C)c1cccc(F)c1 ZINC000617505684 480248518 /nfs/dbraw/zinc/24/85/18/480248518.db2.gz MPNXTLBIBBRZHM-HOTGVXAUSA-N 1 3 337.483 2.708 10 0 EFAEHO Cc1ccc2cc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)ccc2n1 ZINC000617506465 480250016 /nfs/dbraw/zinc/25/00/16/480250016.db2.gz OKFXPBBVHAOSJH-INIZCTEOSA-N 1 3 342.487 2.545 10 0 EFAEHO Cc1ccc2cc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)ccc2n1 ZINC000617506465 480250020 /nfs/dbraw/zinc/25/00/20/480250020.db2.gz OKFXPBBVHAOSJH-INIZCTEOSA-N 1 3 342.487 2.545 10 0 EFAEHO Cc1ccnc2ccc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc12 ZINC000617507914 480250065 /nfs/dbraw/zinc/25/00/65/480250065.db2.gz OMVPXCMQISOIQB-INIZCTEOSA-N 1 3 342.487 2.545 10 0 EFAEHO Cc1ccnc2ccc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc12 ZINC000617507914 480250068 /nfs/dbraw/zinc/25/00/68/480250068.db2.gz OMVPXCMQISOIQB-INIZCTEOSA-N 1 3 342.487 2.545 10 0 EFAEHO CCc1nc(C(C)C)ccc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617507955 480250223 /nfs/dbraw/zinc/25/02/23/480250223.db2.gz POGHYUBPWXBYFI-INIZCTEOSA-N 1 3 348.535 2.769 10 0 EFAEHO CCc1nc(C(C)C)ccc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617507955 480250227 /nfs/dbraw/zinc/25/02/27/480250227.db2.gz POGHYUBPWXBYFI-INIZCTEOSA-N 1 3 348.535 2.769 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccc(F)cc1 ZINC000617506924 480250355 /nfs/dbraw/zinc/25/03/55/480250355.db2.gz CKAIZMAFLJZQLX-YJBOKZPZSA-N 1 3 337.483 2.708 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccc(F)cc1 ZINC000617506924 480250361 /nfs/dbraw/zinc/25/03/61/480250361.db2.gz CKAIZMAFLJZQLX-YJBOKZPZSA-N 1 3 337.483 2.708 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc2c(c1)CCC=C2 ZINC000617507261 480251073 /nfs/dbraw/zinc/25/10/73/480251073.db2.gz ORYKVCUYTYRGTA-INIZCTEOSA-N 1 3 329.488 2.648 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc2c(c1)CCC=C2 ZINC000617507261 480251080 /nfs/dbraw/zinc/25/10/80/480251080.db2.gz ORYKVCUYTYRGTA-INIZCTEOSA-N 1 3 329.488 2.648 10 0 EFAEHO Cc1ccc(/C=C\CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000617505925 480251492 /nfs/dbraw/zinc/25/14/92/480251492.db2.gz VPEDJZFOCGDBID-POZKEBTKSA-N 1 3 331.504 2.787 10 0 EFAEHO Cc1ccc(/C=C\CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000617505925 480251496 /nfs/dbraw/zinc/25/14/96/480251496.db2.gz VPEDJZFOCGDBID-POZKEBTKSA-N 1 3 331.504 2.787 10 0 EFAEHO Cc1csc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1Cl ZINC000617507333 480251605 /nfs/dbraw/zinc/25/16/05/480251605.db2.gz RXNVEQJETHDDCS-LBPRGKRZSA-N 1 3 331.913 2.712 10 0 EFAEHO Cc1csc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1Cl ZINC000617507333 480251610 /nfs/dbraw/zinc/25/16/10/480251610.db2.gz RXNVEQJETHDDCS-LBPRGKRZSA-N 1 3 331.913 2.712 10 0 EFAEHO CC(C)(CNC(=O)NC[C@H]1CCN1C1CCCC1)[NH+]1CCCCC1 ZINC000623369250 480253269 /nfs/dbraw/zinc/25/32/69/480253269.db2.gz VZFYBPXSTLXDJF-QGZVFWFLSA-N 1 3 336.524 2.567 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@@H](c2cccc(F)c2)N2CCOCC2)CC1(C)C ZINC000623379297 480257064 /nfs/dbraw/zinc/25/70/64/480257064.db2.gz IIIIHVGVPLLMNR-OALUTQOASA-N 1 3 349.494 2.661 10 0 EFAEHO CC[C@H]1CN(C)CCCN1C(=O)C1CCN(c2cc[nH+]cc2C)CC1 ZINC000614332656 480270581 /nfs/dbraw/zinc/27/05/81/480270581.db2.gz XERGLVVZTQEVLS-SFHVURJKSA-N 1 3 344.503 2.549 10 0 EFAEHO C[C@H](N[C@H]1CC[N@H+](C)C(C)(C)C1)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000623429232 480280029 /nfs/dbraw/zinc/28/00/29/480280029.db2.gz UBQXPIWFIOQQRL-YSIASYRMSA-N 1 3 345.531 2.738 10 0 EFAEHO C[C@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000623429232 480280036 /nfs/dbraw/zinc/28/00/36/480280036.db2.gz UBQXPIWFIOQQRL-YSIASYRMSA-N 1 3 345.531 2.738 10 0 EFAEHO C[NH2+]CCOCCN[C@@H]1CCCc2cc(Br)ccc21 ZINC000629530662 480296531 /nfs/dbraw/zinc/29/65/31/480296531.db2.gz MZCXVYPXUGRIHH-OAHLLOKOSA-N 1 3 327.266 2.652 10 0 EFAEHO COc1cccc(-c2nc(CN3CC[C@H]4C[NH2+]C[C@H]4CC3)co2)c1 ZINC000631826025 480286469 /nfs/dbraw/zinc/28/64/69/480286469.db2.gz BTKIYIRYHDCDOY-IYBDPMFKSA-N 1 3 327.428 2.782 10 0 EFAEHO C[C@@H](NC(=O)[C@H](C)N1CCC([C@H]2CCC[NH2+]2)CC1)c1ccccc1 ZINC000631827385 480288888 /nfs/dbraw/zinc/28/88/88/480288888.db2.gz NHBMXYQGVSWQKU-JTDSTZFVSA-N 1 3 329.488 2.716 10 0 EFAEHO C[C@H](N)[C@@H](Cc1ccccc1)[NH2+]C[C@@H](n1cccn1)C(F)(F)F ZINC000629514086 480290486 /nfs/dbraw/zinc/29/04/86/480290486.db2.gz JAWHWEQJZWYBMX-NWANDNLSSA-N 1 3 326.366 2.535 10 0 EFAEHO NC1(C[NH2+][C@@H]2CCc3c2cccc3Br)CCOCC1 ZINC000629523080 480294645 /nfs/dbraw/zinc/29/46/45/480294645.db2.gz FGXIGLLMPQBIEX-CQSZACIVSA-N 1 3 325.250 2.534 10 0 EFAEHO [NH3+]C[C@@H]1CCCC[C@H]1NC[C@@H]1CN(c2ccc(Cl)cc2)CCO1 ZINC000629523677 480295121 /nfs/dbraw/zinc/29/51/21/480295121.db2.gz NKLYUWCINYIVLV-BMGDILEWSA-N 1 3 337.895 2.652 10 0 EFAEHO NC[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1CN(c2ccc(Cl)cc2)CCO1 ZINC000629523677 480295131 /nfs/dbraw/zinc/29/51/31/480295131.db2.gz NKLYUWCINYIVLV-BMGDILEWSA-N 1 3 337.895 2.652 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1ccc(Br)c(F)c1F ZINC000629531998 480296757 /nfs/dbraw/zinc/29/67/57/480296757.db2.gz IAFKOZPNVNHANR-JTQLQIEISA-N 1 3 337.208 2.571 10 0 EFAEHO [NH3+]CCCOCCN[C@H]1CCCOc2cc(Br)ccc21 ZINC000629534859 480297728 /nfs/dbraw/zinc/29/77/28/480297728.db2.gz BVUGZZUNEROSHL-AWEZNQCLSA-N 1 3 343.265 2.618 10 0 EFAEHO O[C@@H](C[NH2+]C1CC(F)(c2cccc(Cl)c2)C1)CN1CCCC1 ZINC000629579616 480313353 /nfs/dbraw/zinc/31/33/53/480313353.db2.gz VEIRKOQOMVRWER-CGZBRXJRSA-N 1 3 326.843 2.714 10 0 EFAEHO C[NH2+]CCOCCN(C)Cc1c(-c2ccccc2)nc2ccccn21 ZINC000629571585 480313898 /nfs/dbraw/zinc/31/38/98/480313898.db2.gz XKXCJIGGTZZLAZ-UHFFFAOYSA-N 1 3 338.455 2.669 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@@H](CO)Cc2ccc(F)c(F)c2)CC1(C)C ZINC000623506155 480316885 /nfs/dbraw/zinc/31/68/85/480316885.db2.gz FBCYQGKTDZTVJV-GJZGRUSLSA-N 1 3 326.431 2.578 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@@H](CO)Cc2ccc(F)c(F)c2)CC1(C)C ZINC000623506155 480316893 /nfs/dbraw/zinc/31/68/93/480316893.db2.gz FBCYQGKTDZTVJV-GJZGRUSLSA-N 1 3 326.431 2.578 10 0 EFAEHO Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCCOCCC[NH3+] ZINC000629659549 480347293 /nfs/dbraw/zinc/34/72/93/480347293.db2.gz BTTKKKZMBBHBHM-UHFFFAOYSA-N 1 3 336.867 2.598 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000623584513 480350104 /nfs/dbraw/zinc/35/01/04/480350104.db2.gz IMIBVWAQLYJZAQ-NUJGCVRESA-N 1 3 336.524 2.565 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000623584512 480350643 /nfs/dbraw/zinc/35/06/43/480350643.db2.gz IMIBVWAQLYJZAQ-JZXOWHBKSA-N 1 3 336.524 2.565 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000623584512 480350648 /nfs/dbraw/zinc/35/06/48/480350648.db2.gz IMIBVWAQLYJZAQ-JZXOWHBKSA-N 1 3 336.524 2.565 10 0 EFAEHO C[C@@H](CN1CCCCC1)NC(=O)NC[C@H]1CC[N@@H+]1C1CCCCC1 ZINC000623707767 480412464 /nfs/dbraw/zinc/41/24/64/480412464.db2.gz JXLMZAQVQWCBGL-FUHWJXTLSA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@@H](CN1CCCCC1)NC(=O)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000623707767 480412471 /nfs/dbraw/zinc/41/24/71/480412471.db2.gz JXLMZAQVQWCBGL-FUHWJXTLSA-N 1 3 336.524 2.567 10 0 EFAEHO CCN(C(=O)c1ccc(C[NH+]2CCCC2)cc1)[C@@H]1CCN(CC)C1 ZINC000617925022 480421342 /nfs/dbraw/zinc/42/13/42/480421342.db2.gz CPEGPVPOAUQVNP-LJQANCHMSA-N 1 3 329.488 2.839 10 0 EFAEHO CC(C)[N@H+](C)Cc1ccccc1CNC[C@H](O)C[C@@](C)(O)C1CC1 ZINC000634700336 480439426 /nfs/dbraw/zinc/43/94/26/480439426.db2.gz XQVNHYYAUKWMHY-WOJBJXKFSA-N 1 3 334.504 2.528 10 0 EFAEHO CC(C)[N@@H+](C)Cc1ccccc1CNC[C@H](O)C[C@@](C)(O)C1CC1 ZINC000634700336 480439428 /nfs/dbraw/zinc/43/94/28/480439428.db2.gz XQVNHYYAUKWMHY-WOJBJXKFSA-N 1 3 334.504 2.528 10 0 EFAEHO CC(C)[N@H+](C)Cc1ccccc1CNC[C@H](O)C[C@](C)(O)C1CC1 ZINC000634700334 480439926 /nfs/dbraw/zinc/43/99/26/480439926.db2.gz XQVNHYYAUKWMHY-UXHICEINSA-N 1 3 334.504 2.528 10 0 EFAEHO CC(C)[N@@H+](C)Cc1ccccc1CNC[C@H](O)C[C@](C)(O)C1CC1 ZINC000634700334 480439937 /nfs/dbraw/zinc/43/99/37/480439937.db2.gz XQVNHYYAUKWMHY-UXHICEINSA-N 1 3 334.504 2.528 10 0 EFAEHO CC(C)[N@H+](C)Cc1ccccc1CNC[C@@H](O)C[C@](C)(O)C1CC1 ZINC000634700333 480440205 /nfs/dbraw/zinc/44/02/05/480440205.db2.gz XQVNHYYAUKWMHY-PMACEKPBSA-N 1 3 334.504 2.528 10 0 EFAEHO CC(C)[N@@H+](C)Cc1ccccc1CNC[C@@H](O)C[C@](C)(O)C1CC1 ZINC000634700333 480440214 /nfs/dbraw/zinc/44/02/14/480440214.db2.gz XQVNHYYAUKWMHY-PMACEKPBSA-N 1 3 334.504 2.528 10 0 EFAEHO C[N@@H+]1CCC[C@@H](CCNCc2ccnn2CCc2ccccc2)C1 ZINC000621362012 480473902 /nfs/dbraw/zinc/47/39/02/480473902.db2.gz NTJKRUSIQSAUMT-IBGZPJMESA-N 1 3 326.488 2.947 10 0 EFAEHO C[N@H+]1CCC[C@@H](CCNCc2ccnn2CCc2ccccc2)C1 ZINC000621362012 480473910 /nfs/dbraw/zinc/47/39/10/480473910.db2.gz NTJKRUSIQSAUMT-IBGZPJMESA-N 1 3 326.488 2.947 10 0 EFAEHO Cc1ccc(Br)cc1[C@@H](C)[NH2+]C[C@H](O)CN1CCCC1 ZINC000623871337 480496319 /nfs/dbraw/zinc/49/63/19/480496319.db2.gz BNOSQHMWZKQCJE-HIFRSBDPSA-N 1 3 341.293 2.865 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)[C@]23CCC[C@H]2C[NH2+]C3)CCN1Cc1ccccc1 ZINC000634767885 480510290 /nfs/dbraw/zinc/51/02/90/480510290.db2.gz ODPIDODMKBDMRU-ROPHOZQPSA-N 1 3 341.499 2.545 10 0 EFAEHO C[C@H]1CCC[N@@H+]1Cc1ccc(-c2cnc(N3CCNCC3)nc2)cc1 ZINC000630051264 480531228 /nfs/dbraw/zinc/53/12/28/480531228.db2.gz OQULXKHYOXDXKU-INIZCTEOSA-N 1 3 337.471 2.538 10 0 EFAEHO C[C@H]1CCC[N@H+]1Cc1ccc(-c2cnc(N3CCNCC3)nc2)cc1 ZINC000630051264 480531231 /nfs/dbraw/zinc/53/12/31/480531231.db2.gz OQULXKHYOXDXKU-INIZCTEOSA-N 1 3 337.471 2.538 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@H]1CC[C@@H](C)[NH2+]C1)c1ccccc1 ZINC000626921461 480581521 /nfs/dbraw/zinc/58/15/21/480581521.db2.gz ATRRWJHIIUGYEV-BPQIPLTHSA-N 1 3 332.492 2.509 10 0 EFAEHO CC[C@@H]1[NH2+]CC[C@H]1NC(=O)NC[C@H](c1ccccc1)N(CC)CC ZINC000626921424 480581706 /nfs/dbraw/zinc/58/17/06/480581706.db2.gz ADZVLQJCCCBZKZ-RCCFBDPRSA-N 1 3 332.492 2.509 10 0 EFAEHO COc1cc2nccc(N3CCC[C@H]4C[NH2+]CC[C@@H]43)c2cc1OC ZINC000630386132 480693939 /nfs/dbraw/zinc/69/39/39/480693939.db2.gz WLPCTGXXXBZGCG-BBRMVZONSA-N 1 3 327.428 2.830 10 0 EFAEHO O=C(NC[C@@H]1CC[N@@H+]1C1CCCCC1)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000624316396 480706007 /nfs/dbraw/zinc/70/60/07/480706007.db2.gz PAAHNVGTSMSKJW-OTWHNJEPSA-N 1 3 348.535 2.710 10 0 EFAEHO O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000624316396 480706011 /nfs/dbraw/zinc/70/60/11/480706011.db2.gz PAAHNVGTSMSKJW-OTWHNJEPSA-N 1 3 348.535 2.710 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)NC[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC000624323934 480708659 /nfs/dbraw/zinc/70/86/59/480708659.db2.gz DBSDJHICVCIAHW-IRXDYDNUSA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000624323934 480708662 /nfs/dbraw/zinc/70/86/62/480708662.db2.gz DBSDJHICVCIAHW-IRXDYDNUSA-N 1 3 336.524 2.565 10 0 EFAEHO Cc1ccc(NC(=O)N2CCCCC[C@@H]([NH3+])C2)c(OCCN(C)C)c1 ZINC000632935766 480807906 /nfs/dbraw/zinc/80/79/06/480807906.db2.gz RSHZMMBTFXDSGB-MRXNPFEDSA-N 1 3 348.491 2.671 10 0 EFAEHO Cc1cccc2c1CC[C@H]2NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000664005818 480965016 /nfs/dbraw/zinc/96/50/16/480965016.db2.gz CJECAITUVRRQSW-QFBILLFUSA-N 1 3 346.519 2.554 10 0 EFAEHO Cc1cccc2c1CC[C@H]2NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000664005818 480965021 /nfs/dbraw/zinc/96/50/21/480965021.db2.gz CJECAITUVRRQSW-QFBILLFUSA-N 1 3 346.519 2.554 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2CC[C@@H]([NH3+])[C@@H](CC)C2)CC1 ZINC000647497387 480967660 /nfs/dbraw/zinc/96/76/60/480967660.db2.gz FMRGAPFQAVDETH-AZUAARDMSA-N 1 3 344.547 2.778 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000661401141 480988234 /nfs/dbraw/zinc/98/82/34/480988234.db2.gz ABCYKCFLLKONTI-JQHSSLGASA-N 1 3 348.535 2.518 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000661401141 480988241 /nfs/dbraw/zinc/98/82/41/480988241.db2.gz ABCYKCFLLKONTI-JQHSSLGASA-N 1 3 348.535 2.518 10 0 EFAEHO C[NH+]1CCC2(CCN(C(=O)[C@@H]3CCCCN3C3CCCC3)C2)CC1 ZINC000647725386 481076311 /nfs/dbraw/zinc/07/63/11/481076311.db2.gz ZOQXCMNNYAYACY-SFHVURJKSA-N 1 3 333.520 2.728 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)[C@@H]1CC[C@H](C2CC2)[NH2+]1)c1ccsc1 ZINC000653109982 481084447 /nfs/dbraw/zinc/08/44/47/481084447.db2.gz UCBDQIOBMWLUIU-IXDOHACOSA-N 1 3 335.517 2.778 10 0 EFAEHO Cc1ccc(C2(NCC(=O)NC3CC[NH+](C(C)C)CC3)CCC2)cc1 ZINC000646131334 481107979 /nfs/dbraw/zinc/10/79/79/481107979.db2.gz MZSNZIGABXYKGC-UHFFFAOYSA-N 1 3 343.515 2.953 10 0 EFAEHO CCN(C(=O)NCCC[NH+](C(C)C)C(C)C)[C@H]1CCN(CC)C1 ZINC000664286000 481149763 /nfs/dbraw/zinc/14/97/63/481149763.db2.gz KEWCVDAFLFZRTN-KRWDZBQOSA-N 1 3 326.529 2.621 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000650567609 481187287 /nfs/dbraw/zinc/18/72/87/481187287.db2.gz DFWIQFZPZFVZCV-IBGZPJMESA-N 1 3 346.519 2.538 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000650567609 481187291 /nfs/dbraw/zinc/18/72/91/481187291.db2.gz DFWIQFZPZFVZCV-IBGZPJMESA-N 1 3 346.519 2.538 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)NCc1cccc(CN(C)C)c1 ZINC000650669051 481249440 /nfs/dbraw/zinc/24/94/40/481249440.db2.gz IGKHDIQZVRGICQ-UHFFFAOYSA-N 1 3 334.508 2.525 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)NCc1cccc(CN(C)C)c1 ZINC000650669051 481249444 /nfs/dbraw/zinc/24/94/44/481249444.db2.gz IGKHDIQZVRGICQ-UHFFFAOYSA-N 1 3 334.508 2.525 10 0 EFAEHO C[NH2+]Cc1ccccc1CNCc1ccccc1N1CCOCC1 ZINC000650719078 481286973 /nfs/dbraw/zinc/28/69/73/481286973.db2.gz CEUAILXFUAGUTN-UHFFFAOYSA-N 1 3 325.456 2.532 10 0 EFAEHO COc1ccc(CN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)cc1OC ZINC000650722452 481289211 /nfs/dbraw/zinc/28/92/11/481289211.db2.gz UERKHUKJCJQMFP-NUJGCVRESA-N 1 3 334.460 2.565 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)C1(N)CC2(CCC2)C1)c1ccccc1 ZINC000659249433 481307331 /nfs/dbraw/zinc/30/73/31/481307331.db2.gz RXYVEGQEGHHYHM-QGZVFWFLSA-N 1 3 329.488 2.847 10 0 EFAEHO CC[C@H](OCCN[C@@H]1CCOC[C@@H]1[C@@H]1CCC[NH2+]1)c1ccccc1 ZINC000650742455 481309176 /nfs/dbraw/zinc/30/91/76/481309176.db2.gz YLDGIICPQDFWBT-WCIQWLHISA-N 1 3 332.488 2.901 10 0 EFAEHO c1ccc2c(c1)C[C@H](N[C@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CN2 ZINC000650747719 481310677 /nfs/dbraw/zinc/31/06/77/481310677.db2.gz GJGALXWARMBCLQ-LRQRDZAKSA-N 1 3 335.451 2.869 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@H](C)c1ccc(NS(C)(=O)=O)cc1 ZINC000650758310 481320969 /nfs/dbraw/zinc/32/09/69/481320969.db2.gz NAIHLEOPFHIIBZ-CQSZACIVSA-N 1 3 347.484 2.628 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@@H](C)CC(=O)Nc1ccccc1OC ZINC000650759067 481321858 /nfs/dbraw/zinc/32/18/58/481321858.db2.gz CKTHYWQXVZXSHO-HNNXBMFYSA-N 1 3 341.455 2.922 10 0 EFAEHO CC(C)c1scnc1NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000667109967 481327570 /nfs/dbraw/zinc/32/75/70/481327570.db2.gz SIKFIFHROQWEDW-ZDUSSCGKSA-N 1 3 341.525 2.660 10 0 EFAEHO CC(C)c1scnc1NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000667109967 481327576 /nfs/dbraw/zinc/32/75/76/481327576.db2.gz SIKFIFHROQWEDW-ZDUSSCGKSA-N 1 3 341.525 2.660 10 0 EFAEHO O=C(C[C@H]1NCc2ccccc21)NCCCCC[NH+]1CCCCC1 ZINC000659279551 481330053 /nfs/dbraw/zinc/33/00/53/481330053.db2.gz BKSDNHWESXMDQZ-LJQANCHMSA-N 1 3 329.488 2.993 10 0 EFAEHO CN1CCN(C(=O)C[C@@H]2[NH2+]Cc3ccccc32)C2(CCCCC2)C1 ZINC000659285748 481335741 /nfs/dbraw/zinc/33/57/41/481335741.db2.gz SJGZWGAAJWHSES-SFHVURJKSA-N 1 3 327.472 2.698 10 0 EFAEHO C[C@H](CCNC(=O)C1(N)CC2(CCC2)C1)[N@H+](C)Cc1ccccc1 ZINC000659285430 481336043 /nfs/dbraw/zinc/33/60/43/481336043.db2.gz OQJFLELIIJLTTR-MRXNPFEDSA-N 1 3 329.488 2.675 10 0 EFAEHO C[C@H](CCNC(=O)C1(N)CC2(CCC2)C1)[N@@H+](C)Cc1ccccc1 ZINC000659285430 481336051 /nfs/dbraw/zinc/33/60/51/481336051.db2.gz OQJFLELIIJLTTR-MRXNPFEDSA-N 1 3 329.488 2.675 10 0 EFAEHO C[C@@H](CCNC(=O)C1(N)CC2(CCC2)C1)[N@H+](C)Cc1ccccc1 ZINC000659285429 481336560 /nfs/dbraw/zinc/33/65/60/481336560.db2.gz OQJFLELIIJLTTR-INIZCTEOSA-N 1 3 329.488 2.675 10 0 EFAEHO C[C@@H](CCNC(=O)C1(N)CC2(CCC2)C1)[N@@H+](C)Cc1ccccc1 ZINC000659285429 481336567 /nfs/dbraw/zinc/33/65/67/481336567.db2.gz OQJFLELIIJLTTR-INIZCTEOSA-N 1 3 329.488 2.675 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)N[C@H](C)CN2CCC(C)CC2)CC1 ZINC000661898026 481400470 /nfs/dbraw/zinc/40/04/70/481400470.db2.gz LHQDXGRHZLDORZ-QGZVFWFLSA-N 1 3 338.540 2.528 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)N[C@@H](C)CN2CCC(C)CC2)CC1 ZINC000661897832 481401362 /nfs/dbraw/zinc/40/13/62/481401362.db2.gz LHQDXGRHZLDORZ-KRWDZBQOSA-N 1 3 338.540 2.528 10 0 EFAEHO CCN(C(=O)NCC[NH2+]C1CC1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000637297648 481437875 /nfs/dbraw/zinc/43/78/75/481437875.db2.gz PXMDJOZKHIZGDM-VQIMIIECSA-N 1 3 344.503 2.605 10 0 EFAEHO c1cnn(-c2cccc(C[N@@H+]3CCCN(c4ccncc4)CC3)c2)c1 ZINC000639706218 481441973 /nfs/dbraw/zinc/44/19/73/481441973.db2.gz WRBOPJKTSJVNEW-UHFFFAOYSA-N 1 3 333.439 2.980 10 0 EFAEHO c1cnn(-c2cccc(C[N@H+]3CCCN(c4ccncc4)CC3)c2)c1 ZINC000639706218 481441984 /nfs/dbraw/zinc/44/19/84/481441984.db2.gz WRBOPJKTSJVNEW-UHFFFAOYSA-N 1 3 333.439 2.980 10 0 EFAEHO Cc1cccc2c1CCC[C@H]2NC(=O)N(CCN(C)C)CC[NH+](C)C ZINC000667275111 481448278 /nfs/dbraw/zinc/44/82/78/481448278.db2.gz AWVDEENZFFGMMO-LJQANCHMSA-N 1 3 346.519 2.507 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1 ZINC000659483700 481464369 /nfs/dbraw/zinc/46/43/69/481464369.db2.gz FEIUBUFMSZLEHK-RTBURBONSA-N 1 3 346.519 2.570 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CN[C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000643463866 481479134 /nfs/dbraw/zinc/47/91/34/481479134.db2.gz FAGBBSSOKNKNSU-IYWMVGAKSA-N 1 3 346.515 2.944 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N[C@H]1C[C@H](c2ccccc2)C1 ZINC000664804600 481489348 /nfs/dbraw/zinc/48/93/48/481489348.db2.gz KMPOQJRPJVKGFJ-WDSOQIARSA-N 1 3 346.519 2.504 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N[C@H]1C[C@H](c2ccccc2)C1 ZINC000664804600 481489358 /nfs/dbraw/zinc/48/93/58/481489358.db2.gz KMPOQJRPJVKGFJ-WDSOQIARSA-N 1 3 346.519 2.504 10 0 EFAEHO O=C(C[N@@H+]1CCC[C@@H]1CC1CCCC1)NC1CCN(C2CC2)CC1 ZINC000653893066 481517901 /nfs/dbraw/zinc/51/79/01/481517901.db2.gz SSWMPLNHFPZIOZ-LJQANCHMSA-N 1 3 333.520 2.774 10 0 EFAEHO O=C(C[N@H+]1CCC[C@@H]1CC1CCCC1)NC1CCN(C2CC2)CC1 ZINC000653893066 481517913 /nfs/dbraw/zinc/51/79/13/481517913.db2.gz SSWMPLNHFPZIOZ-LJQANCHMSA-N 1 3 333.520 2.774 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000659621798 481518881 /nfs/dbraw/zinc/51/88/81/481518881.db2.gz BCXOCMQANMUFIG-RBUKOAKNSA-N 1 3 346.519 2.666 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000646901229 481540970 /nfs/dbraw/zinc/54/09/70/481540970.db2.gz YVJCDUGYYCVMMY-PMACEKPBSA-N 1 3 345.531 2.959 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2CC[C@@H](CO)CC2)CC1 ZINC000648481861 481573088 /nfs/dbraw/zinc/57/30/88/481573088.db2.gz OZIWUVLJLPCBKQ-PUZFROQSSA-N 1 3 345.531 2.859 10 0 EFAEHO Cc1cccc([C@H](C)NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000665072842 481649713 /nfs/dbraw/zinc/64/97/13/481649713.db2.gz ASANZGCDUPCBNW-IRXDYDNUSA-N 1 3 334.508 2.627 10 0 EFAEHO Cc1cccc([C@H](C)NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000665072842 481649715 /nfs/dbraw/zinc/64/97/15/481649715.db2.gz ASANZGCDUPCBNW-IRXDYDNUSA-N 1 3 334.508 2.627 10 0 EFAEHO COc1ccc2cc(CN(C)C[C@H]3CCC4(C[NH2+]C4)O3)ccc2c1 ZINC000662248940 481664232 /nfs/dbraw/zinc/66/42/32/481664232.db2.gz MATAAYNGLAWZLV-LJQANCHMSA-N 1 3 326.440 2.801 10 0 EFAEHO c1cc(C[N@@H+](C[C@@H]2CCC3(CNC3)O2)C2CCCC2)cc2c1OCO2 ZINC000662248622 481664437 /nfs/dbraw/zinc/66/44/37/481664437.db2.gz HZAPRAKGMCIHRU-KRWDZBQOSA-N 1 3 344.455 2.681 10 0 EFAEHO c1cc(C[N@H+](C[C@@H]2CCC3(CNC3)O2)C2CCCC2)cc2c1OCO2 ZINC000662248622 481664444 /nfs/dbraw/zinc/66/44/44/481664444.db2.gz HZAPRAKGMCIHRU-KRWDZBQOSA-N 1 3 344.455 2.681 10 0 EFAEHO CN(Cc1ccc(OC(F)(F)F)cc1)C[C@H]1CCC2(C[NH2+]C2)O1 ZINC000662250469 481666141 /nfs/dbraw/zinc/66/61/41/481666141.db2.gz IVPJRNPYCRALRU-CQSZACIVSA-N 1 3 330.350 2.538 10 0 EFAEHO COc1cc(CN(C)Cc2cccc3c2CC[NH2+]C3)cc(OC)c1 ZINC000662253125 481667292 /nfs/dbraw/zinc/66/72/92/481667292.db2.gz WETSFBLBTRONEF-UHFFFAOYSA-N 1 3 326.440 2.982 10 0 EFAEHO Cc1ccc(CCN(C[C@H]2CCCO2)C[C@H]2CCC3(C[NH2+]C3)O2)cc1 ZINC000662258664 481671866 /nfs/dbraw/zinc/67/18/66/481671866.db2.gz YTMNMCMPTGDLMI-WOJBJXKFSA-N 1 3 344.499 2.540 10 0 EFAEHO CCCNC(=O)C1(NCc2cccc3c2CC[NH2+]C3)CCCCC1 ZINC000662258148 481673429 /nfs/dbraw/zinc/67/34/29/481673429.db2.gz IPCCPWUDAWLTBE-UHFFFAOYSA-N 1 3 329.488 2.651 10 0 EFAEHO c1ccc([C@@H]2C[C@H]3[C@H](CCCN3C[C@H]3CCC4(C[NH2+]C4)O3)O2)cc1 ZINC000662283692 481690571 /nfs/dbraw/zinc/69/05/71/481690571.db2.gz JOOGQIJKCPFTLU-XWSJACJDSA-N 1 3 328.456 2.502 10 0 EFAEHO CCC[N@H+](C[C@@H]1CCC2(CNC2)O1)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000662283528 481691080 /nfs/dbraw/zinc/69/10/80/481691080.db2.gz UTVPEDBOHYEONU-WMZOPIPTSA-N 1 3 345.487 2.637 10 0 EFAEHO CCC[N@@H+](C[C@@H]1CCC2(CNC2)O1)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000662283528 481691089 /nfs/dbraw/zinc/69/10/89/481691089.db2.gz UTVPEDBOHYEONU-WMZOPIPTSA-N 1 3 345.487 2.637 10 0 EFAEHO C[C@H](C(=O)N(C)C1CCCCC1)N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662293449 481697458 /nfs/dbraw/zinc/69/74/58/481697458.db2.gz LDMQTSQPKZPIKQ-SJLPKXTDSA-N 1 3 335.536 2.878 10 0 EFAEHO O=C(CN1CCC[C@H](C2CC[NH2+]CC2)C1)N1CCC[C@H]2CCCC[C@H]21 ZINC000662295844 481699564 /nfs/dbraw/zinc/69/95/64/481699564.db2.gz HZYZPQPPYXRNCB-HSALFYBXSA-N 1 3 347.547 2.879 10 0 EFAEHO C[C@@H](C(=O)NCC1CCCCC1)N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662297789 481705596 /nfs/dbraw/zinc/70/55/96/481705596.db2.gz RSHOMXRLCAFREG-QFBILLFUSA-N 1 3 335.536 2.783 10 0 EFAEHO CC1(C)C[N@H+](C[C@H](O)[C@@H](N)Cc2ccccc2)CCc2ccccc21 ZINC000662299902 481705827 /nfs/dbraw/zinc/70/58/27/481705827.db2.gz ZHKCYZAYMATEJY-SFTDATJTSA-N 1 3 338.495 2.753 10 0 EFAEHO CC1(C)C[N@@H+](C[C@H](O)[C@@H](N)Cc2ccccc2)CCc2ccccc21 ZINC000662299902 481705834 /nfs/dbraw/zinc/70/58/34/481705834.db2.gz ZHKCYZAYMATEJY-SFTDATJTSA-N 1 3 338.495 2.753 10 0 EFAEHO CC1(C)CN(C[C@H](O)[C@@H]([NH3+])Cc2ccccc2)CCc2ccccc21 ZINC000662299902 481705837 /nfs/dbraw/zinc/70/58/37/481705837.db2.gz ZHKCYZAYMATEJY-SFTDATJTSA-N 1 3 338.495 2.753 10 0 EFAEHO C[C@@H](C(=O)NCC1CCCCC1)N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662297787 481705857 /nfs/dbraw/zinc/70/58/57/481705857.db2.gz RSHOMXRLCAFREG-LPHOPBHVSA-N 1 3 335.536 2.783 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)C(C)(C)CC(F)(F)F)CC2)CC1 ZINC000667641950 481706552 /nfs/dbraw/zinc/70/65/52/481706552.db2.gz JRTQWOQQDHYBPO-UHFFFAOYSA-N 1 3 349.441 2.640 10 0 EFAEHO COCc1cccc(OCC2(C[N@@H+]3CC4CC3(CN)C4)CCC2)c1 ZINC000662304411 481711271 /nfs/dbraw/zinc/71/12/71/481711271.db2.gz RMBFGPIKGAPNPZ-UHFFFAOYSA-N 1 3 330.472 2.805 10 0 EFAEHO COCc1cccc(OCC2(C[N@H+]3CC4CC3(CN)C4)CCC2)c1 ZINC000662304411 481711278 /nfs/dbraw/zinc/71/12/78/481711278.db2.gz RMBFGPIKGAPNPZ-UHFFFAOYSA-N 1 3 330.472 2.805 10 0 EFAEHO C[C@@H]1CCCN(CC(=O)N2CCC[C@H](C(F)(F)F)C2)[C@@H]1CCC[NH3+] ZINC000662313176 481716421 /nfs/dbraw/zinc/71/64/21/481716421.db2.gz FVPIRRRYUMGRKE-QLFBSQMISA-N 1 3 349.441 2.627 10 0 EFAEHO CCN(Cc1ccccc1)C(=O)CN1CCC[C@@H](C)[C@H]1CCC[NH3+] ZINC000662313500 481716818 /nfs/dbraw/zinc/71/68/18/481716818.db2.gz SJWFLOQCOORITN-IEBWSBKVSA-N 1 3 331.504 2.875 10 0 EFAEHO CN(C)c1ncc(C[NH2+]C[C@@H]2CN(C)C[C@H]2c2ccccc2)s1 ZINC000647248788 481728200 /nfs/dbraw/zinc/72/82/00/481728200.db2.gz DVEIEGJMMYDIGX-WBVHZDCISA-N 1 3 330.501 2.644 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662337292 481734853 /nfs/dbraw/zinc/73/48/53/481734853.db2.gz KZPYRTVKWCZZIY-SJORKVTESA-N 1 3 333.524 2.681 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662337292 481734859 /nfs/dbraw/zinc/73/48/59/481734859.db2.gz KZPYRTVKWCZZIY-SJORKVTESA-N 1 3 333.524 2.681 10 0 EFAEHO C[C@@H]1CCCC[C@H]1C[N@@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662338923 481736740 /nfs/dbraw/zinc/73/67/40/481736740.db2.gz WXCAOPDHIOQWGJ-SQNIBIBYSA-N 1 3 345.535 2.825 10 0 EFAEHO C[C@@H]1CCCC[C@H]1C[N@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662338923 481736748 /nfs/dbraw/zinc/73/67/48/481736748.db2.gz WXCAOPDHIOQWGJ-SQNIBIBYSA-N 1 3 345.535 2.825 10 0 EFAEHO C[C@H](C[C@H]1CCCCC[NH2+]1)NCc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000665240264 481740036 /nfs/dbraw/zinc/74/00/36/481740036.db2.gz GSEFWIQZEGYKGW-DUXKGJEZSA-N 1 3 345.531 2.654 10 0 EFAEHO CCOc1ccc([C@@H]2CCNC[C@@H]2[NH2+][C@@H]2CCN(C)[C@H](C)C2)cc1 ZINC000665255123 481751303 /nfs/dbraw/zinc/75/13/03/481751303.db2.gz JPTWWOGLPVXTGP-BEKAIBRUSA-N 1 3 331.504 2.603 10 0 EFAEHO C1CC2(C1)[C@H](N[C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)C[C@H]2N1CCOCC1 ZINC000665274159 481762966 /nfs/dbraw/zinc/76/29/66/481762966.db2.gz LDGGGZKXZFWRAF-OMQSBVIBSA-N 1 3 347.547 2.530 10 0 EFAEHO CC[C@H](N[C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21)C(=O)NCc1cccs1 ZINC000647333899 481764416 /nfs/dbraw/zinc/76/44/16/481764416.db2.gz BIFTZZQUJDEFKT-YYIAUSFCSA-N 1 3 335.517 2.605 10 0 EFAEHO CC[C@H](N[C@@H]1CC[N@@H+](C)[C@@H]2CCC[C@@H]21)C(=O)NCc1cccs1 ZINC000647333899 481764426 /nfs/dbraw/zinc/76/44/26/481764426.db2.gz BIFTZZQUJDEFKT-YYIAUSFCSA-N 1 3 335.517 2.605 10 0 EFAEHO CC[C@H]([NH2+][C@@H]1CCN(C)[C@@H]2CCC[C@@H]21)C(=O)NCc1cccs1 ZINC000647333899 481764432 /nfs/dbraw/zinc/76/44/32/481764432.db2.gz BIFTZZQUJDEFKT-YYIAUSFCSA-N 1 3 335.517 2.605 10 0 EFAEHO CCN(CC)C(=O)C[C@@H](C)NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC000647343903 481769375 /nfs/dbraw/zinc/76/93/75/481769375.db2.gz FNNDHWSNAGSHAU-QRQLOZEOSA-N 1 3 331.504 2.568 10 0 EFAEHO CCN(CC)C(=O)C[C@@H](C)NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000647343903 481769387 /nfs/dbraw/zinc/76/93/87/481769387.db2.gz FNNDHWSNAGSHAU-QRQLOZEOSA-N 1 3 331.504 2.568 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(N[C@@H](C)c2ccccc2Cl)CC1 ZINC000665285157 481769720 /nfs/dbraw/zinc/76/97/20/481769720.db2.gz FCIXJUPBMHNFLG-AWEZNQCLSA-N 1 3 337.895 2.981 10 0 EFAEHO CN1C[C@@H](C[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@H]32)[C@H](c2ccccc2)C1 ZINC000647344251 481771980 /nfs/dbraw/zinc/77/19/80/481771980.db2.gz MPQZKBJCDYFTHP-IFLJBQAJSA-N 1 3 327.516 2.794 10 0 EFAEHO C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)N1CC2CC1(C)C2 ZINC000662384123 481776427 /nfs/dbraw/zinc/77/64/27/481776427.db2.gz JYRYZAJLAOMKJW-AFJQURTJSA-N 1 3 341.499 2.640 10 0 EFAEHO CC[NH+](CC)[C@@H](CNC(=O)C1(NC2CC2)CCC1)c1ccccc1 ZINC000662392103 481779952 /nfs/dbraw/zinc/77/99/52/481779952.db2.gz NNRQGKVVRKRZNP-SFHVURJKSA-N 1 3 329.488 2.860 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNC(=O)C[C@@H]2NCc3ccccc32)C1 ZINC000662389589 481780884 /nfs/dbraw/zinc/78/08/84/481780884.db2.gz SXSOVMQBOZIMAC-APWZRJJASA-N 1 3 329.488 2.849 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNC(=O)C[C@@H]2NCc3ccccc32)C1 ZINC000662389589 481780894 /nfs/dbraw/zinc/78/08/94/481780894.db2.gz SXSOVMQBOZIMAC-APWZRJJASA-N 1 3 329.488 2.849 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCCCNC(=O)C[C@H]1NCc2ccccc21 ZINC000662390203 481781141 /nfs/dbraw/zinc/78/11/41/481781141.db2.gz YGASMRMVTARHAH-QFBILLFUSA-N 1 3 329.488 2.992 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCCCNC(=O)C[C@H]1NCc2ccccc21 ZINC000662390203 481781148 /nfs/dbraw/zinc/78/11/48/481781148.db2.gz YGASMRMVTARHAH-QFBILLFUSA-N 1 3 329.488 2.992 10 0 EFAEHO c1cc(OCC[NH+]2CCCC2)ccc1CN[C@H]1CO[C@H](C2CC2)C1 ZINC000667866447 481858473 /nfs/dbraw/zinc/85/84/73/481858473.db2.gz AXBDGKKYBPWGMT-QUCCMNQESA-N 1 3 330.472 2.818 10 0 EFAEHO C[N@H+](CCNC(=O)N[C@H]1CCCN2CCCC[C@@H]12)C1CCCCC1 ZINC000654414883 481859833 /nfs/dbraw/zinc/85/98/33/481859833.db2.gz ZFHQMWSUVIFLAJ-ROUUACIJSA-N 1 3 336.524 2.567 10 0 EFAEHO C[N@@H+](CCNC(=O)N[C@H]1CCCN2CCCC[C@@H]12)C1CCCCC1 ZINC000654414883 481859837 /nfs/dbraw/zinc/85/98/37/481859837.db2.gz ZFHQMWSUVIFLAJ-ROUUACIJSA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000654433729 481869137 /nfs/dbraw/zinc/86/91/37/481869137.db2.gz WGPJNKUBONKPIX-MHORFTMASA-N 1 3 336.524 2.565 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000654433729 481869131 /nfs/dbraw/zinc/86/91/31/481869131.db2.gz WGPJNKUBONKPIX-MHORFTMASA-N 1 3 336.524 2.565 10 0 EFAEHO CC[NH+](CC)Cc1ccccc1CNC(=O)C1(N)CC2(CCC2)C1 ZINC000662668569 481924162 /nfs/dbraw/zinc/92/41/62/481924162.db2.gz GFWVDHZAGFSBRC-UHFFFAOYSA-N 1 3 329.488 2.806 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)N1CCCCCC1 ZINC000649102121 481930439 /nfs/dbraw/zinc/93/04/39/481930439.db2.gz VBJYSYOPKKTGJN-SXLOBPIMSA-N 1 3 343.515 2.713 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)N1CCCCCC1 ZINC000649102121 481930446 /nfs/dbraw/zinc/93/04/46/481930446.db2.gz VBJYSYOPKKTGJN-SXLOBPIMSA-N 1 3 343.515 2.713 10 0 EFAEHO C[NH+](C)Cc1cccc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2)c1 ZINC000662686461 481933309 /nfs/dbraw/zinc/93/33/09/481933309.db2.gz FZISGCNXDSRIOP-IBGZPJMESA-N 1 3 339.439 2.661 10 0 EFAEHO C[NH+](C)Cc1ccc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2)cc1 ZINC000662686359 481933657 /nfs/dbraw/zinc/93/36/57/481933657.db2.gz DNUBTRUAYKZBAO-IBGZPJMESA-N 1 3 339.439 2.661 10 0 EFAEHO O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)C1(NC2CC2)CCC1 ZINC000662692363 481936392 /nfs/dbraw/zinc/93/63/92/481936392.db2.gz DCWVPSKKITVYHQ-UHFFFAOYSA-N 1 3 327.472 2.938 10 0 EFAEHO Cc1ccccc1[C@@H]([C@@H](C)NC(=O)NC[C@H]1C[C@@H]([NH+](C)C)C1)N(C)C ZINC000654562097 481936954 /nfs/dbraw/zinc/93/69/54/481936954.db2.gz VVYZYXRSTKDQQA-VXIBKDFQSA-N 1 3 346.519 2.626 10 0 EFAEHO CC1CC[NH+](C[C@@H]2CCCN(C(=O)C3(NC4CC4)CCC3)C2)CC1 ZINC000662699109 481940186 /nfs/dbraw/zinc/94/01/86/481940186.db2.gz WKGLYODVMLGWEX-KRWDZBQOSA-N 1 3 333.520 2.632 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)C2([NH2+]C3CC3)CCC2)N2CCCC2)cc1 ZINC000662702149 481941660 /nfs/dbraw/zinc/94/16/60/481941660.db2.gz XIDDJPJBSUGOJO-LJQANCHMSA-N 1 3 341.499 2.923 10 0 EFAEHO C[C@H]([NH2+]C(C)(C)CNC(=O)C1(N)CC2(CCC2)C1)c1ccccc1 ZINC000662718573 481946097 /nfs/dbraw/zinc/94/60/97/481946097.db2.gz PQKLBLXKTZRNAP-HNNXBMFYSA-N 1 3 329.488 2.894 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)C2(NC3CC3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000662717971 481946432 /nfs/dbraw/zinc/94/64/32/481946432.db2.gz FYPFFYIYWDWVPZ-VQIMIIECSA-N 1 3 341.499 2.830 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)C2(NC3CC3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000662717971 481946438 /nfs/dbraw/zinc/94/64/38/481946438.db2.gz FYPFFYIYWDWVPZ-VQIMIIECSA-N 1 3 341.499 2.830 10 0 EFAEHO [NH3+]C1(CC(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)CC1 ZINC000662790479 481971418 /nfs/dbraw/zinc/97/14/18/481971418.db2.gz KXTSJGBFVSYSLL-UHFFFAOYSA-N 1 3 335.879 2.646 10 0 EFAEHO NC1(C(=O)N2CCC(CCC[NH+]3CCCC3)CC2)CC2(CCC2)C1 ZINC000662796536 481972693 /nfs/dbraw/zinc/97/26/93/481972693.db2.gz NLSJZUOYTBXZDS-UHFFFAOYSA-N 1 3 333.520 2.763 10 0 EFAEHO CC(C)CN(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)C1CCCC1 ZINC000665639670 481974091 /nfs/dbraw/zinc/97/40/91/481974091.db2.gz AKVORONEKXOYIL-KRWDZBQOSA-N 1 3 340.556 2.869 10 0 EFAEHO CC(C)CN(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)C1CCCC1 ZINC000665639670 481974098 /nfs/dbraw/zinc/97/40/98/481974098.db2.gz AKVORONEKXOYIL-KRWDZBQOSA-N 1 3 340.556 2.869 10 0 EFAEHO OC[C@@]1(C[NH2+]C2CCN(c3ccncc3)CC2)CCc2ccccc21 ZINC000651883810 481989711 /nfs/dbraw/zinc/98/97/11/481989711.db2.gz QIQZNOQOXKQIMB-NRFANRHFSA-N 1 3 337.467 2.517 10 0 EFAEHO CN(CCC[N@H+](C)Cc1ccco1)Cc1ccnn1-c1ccncc1 ZINC000668150607 482000691 /nfs/dbraw/zinc/00/06/91/482000691.db2.gz AUTVFNQIGJWQIZ-UHFFFAOYSA-N 1 3 339.443 2.814 10 0 EFAEHO CN(CCC[N@@H+](C)Cc1ccco1)Cc1ccnn1-c1ccncc1 ZINC000668150607 482000696 /nfs/dbraw/zinc/00/06/96/482000696.db2.gz AUTVFNQIGJWQIZ-UHFFFAOYSA-N 1 3 339.443 2.814 10 0 EFAEHO CN(C)CCOc1ccc(C[NH2+][C@H](C2CC2)C2CCOCC2)cc1 ZINC000651927189 482004628 /nfs/dbraw/zinc/00/46/28/482004628.db2.gz DCLNYMZCFRNLKL-HXUWFJFHSA-N 1 3 332.488 2.922 10 0 EFAEHO C[NH+](C)CCCOc1ccc(NC(=O)[C@H]2NCCCC2(C)C)cc1 ZINC000649329027 482029477 /nfs/dbraw/zinc/02/94/77/482029477.db2.gz YALIUZSQRSFMMD-QGZVFWFLSA-N 1 3 333.476 2.734 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CCCC12CCCCC2 ZINC000665760895 482038892 /nfs/dbraw/zinc/03/88/92/482038892.db2.gz RJGAQDNWPVYPGR-KRWDZBQOSA-N 1 3 338.540 2.767 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CCCC12CCCCC2 ZINC000665760895 482038895 /nfs/dbraw/zinc/03/88/95/482038895.db2.gz RJGAQDNWPVYPGR-KRWDZBQOSA-N 1 3 338.540 2.767 10 0 EFAEHO C[C@H](C1CCCCC1)N(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000665762305 482039902 /nfs/dbraw/zinc/03/99/02/482039902.db2.gz ACEGQEPMASLQHE-DLBZAZTESA-N 1 3 340.556 2.869 10 0 EFAEHO C[C@H](C1CCCCC1)N(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000665762305 482039906 /nfs/dbraw/zinc/03/99/06/482039906.db2.gz ACEGQEPMASLQHE-DLBZAZTESA-N 1 3 340.556 2.869 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NCc1ccc2occc2c1 ZINC000665763660 482040647 /nfs/dbraw/zinc/04/06/47/482040647.db2.gz IFOGLKBEMLLMAF-HNNXBMFYSA-N 1 3 346.475 2.504 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NCc1ccc2occc2c1 ZINC000665763660 482040653 /nfs/dbraw/zinc/04/06/53/482040653.db2.gz IFOGLKBEMLLMAF-HNNXBMFYSA-N 1 3 346.475 2.504 10 0 EFAEHO O=C(N[C@@H]1CC[NH2+]C12CCCC2)c1cccc(CN2CCCC2)c1 ZINC000649372550 482046933 /nfs/dbraw/zinc/04/69/33/482046933.db2.gz CACLCKDUYKXEBA-GOSISDBHSA-N 1 3 327.472 2.687 10 0 EFAEHO O=C(N[C@H]1CC[NH2+]C12CCCC2)C1CCN(Cc2ccccc2)CC1 ZINC000649372508 482047214 /nfs/dbraw/zinc/04/72/14/482047214.db2.gz ATHCFYDXMJXTPY-IBGZPJMESA-N 1 3 341.499 2.690 10 0 EFAEHO [NH3+]CC1(CCNC(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC1 ZINC000652152906 482100799 /nfs/dbraw/zinc/10/07/99/482100799.db2.gz YFCQKZXORWVLRE-GOSISDBHSA-N 1 3 344.503 2.642 10 0 EFAEHO CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NCCC1(C[NH3+])CC1 ZINC000652179083 482115848 /nfs/dbraw/zinc/11/58/48/482115848.db2.gz DSIPPLFJYHTPRY-GOSISDBHSA-N 1 3 346.519 2.571 10 0 EFAEHO CC(C)CN(C)CCC[NH2+][C@@H]1CCN(Cc2ccccn2)C[C@@H]1C ZINC000652221910 482130817 /nfs/dbraw/zinc/13/08/17/482130817.db2.gz AEDXISVTZYFIBQ-AZUAARDMSA-N 1 3 332.536 2.860 10 0 EFAEHO C[C@H]1C[NH+](Cc2ccccc2N(C)C2CCN(C)CC2)C[C@H](C)C1O ZINC000668555245 482166923 /nfs/dbraw/zinc/16/69/23/482166923.db2.gz VNJREVIOPZZSEC-IRXDYDNUSA-N 1 3 345.531 2.666 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2N(C)C2CCN(C)CC2)C[C@H](C)[C@H]1O ZINC000668555247 482167198 /nfs/dbraw/zinc/16/71/98/482167198.db2.gz VNJREVIOPZZSEC-LFUKPOHLSA-N 1 3 345.531 2.666 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2N(C)C2CCN(C)CC2)C[C@H](C)[C@H]1O ZINC000668555247 482167200 /nfs/dbraw/zinc/16/72/00/482167200.db2.gz VNJREVIOPZZSEC-LFUKPOHLSA-N 1 3 345.531 2.666 10 0 EFAEHO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCN(CCOc3ccccc3Cl)C2)C1 ZINC000652345623 482183068 /nfs/dbraw/zinc/18/30/68/482183068.db2.gz GUQBOQIVOLMMMV-RKVPGOIHSA-N 1 3 338.879 2.937 10 0 EFAEHO CCOCC[C@@H](O)C[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000663368839 482186124 /nfs/dbraw/zinc/18/61/24/482186124.db2.gz PCVAOBIUQSMNDG-VQTJNVASSA-N 1 3 346.515 2.666 10 0 EFAEHO CC(C)OC[C@H](O)C[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000663368520 482186352 /nfs/dbraw/zinc/18/63/52/482186352.db2.gz HVGNVLLDJVQODQ-WOJBJXKFSA-N 1 3 346.515 2.664 10 0 EFAEHO CC(C)OC[C@H](O)CNC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000663368520 482186356 /nfs/dbraw/zinc/18/63/56/482186356.db2.gz HVGNVLLDJVQODQ-WOJBJXKFSA-N 1 3 346.515 2.664 10 0 EFAEHO CC(C)OC[C@H](O)CNC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000663368520 482186362 /nfs/dbraw/zinc/18/63/62/482186362.db2.gz HVGNVLLDJVQODQ-WOJBJXKFSA-N 1 3 346.515 2.664 10 0 EFAEHO CCOc1ccccc1OCCN1CCCC[C@@H]1[C@@H]1C[C@@H]([NH3+])CCO1 ZINC000652361424 482192992 /nfs/dbraw/zinc/19/29/92/482192992.db2.gz GVBHGCURPURCFL-QKLQHJQFSA-N 1 3 348.487 2.825 10 0 EFAEHO CCc1cccc(OCCN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)c1 ZINC000652360846 482193250 /nfs/dbraw/zinc/19/32/50/482193250.db2.gz RWLPXGCECAXJGL-RLLQIKCJSA-N 1 3 332.488 2.989 10 0 EFAEHO CN1CC[C@H](NC(=O)NC[C@H]2CC[N@@H+]2C(C)(C)C)[C@@H]1c1ccccc1 ZINC000660960924 482244657 /nfs/dbraw/zinc/24/46/57/482244657.db2.gz WYYQHBNWEXHYLF-SQNIBIBYSA-N 1 3 344.503 2.604 10 0 EFAEHO CN1CC[C@H](NC(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)[C@@H]1c1ccccc1 ZINC000660960924 482244661 /nfs/dbraw/zinc/24/46/61/482244661.db2.gz WYYQHBNWEXHYLF-SQNIBIBYSA-N 1 3 344.503 2.604 10 0 EFAEHO CN1CC[C@H](NC(=O)NC[C@@H]2CC[N@@H+]2C(C)(C)C)[C@H]1c1ccccc1 ZINC000660960923 482245386 /nfs/dbraw/zinc/24/53/86/482245386.db2.gz WYYQHBNWEXHYLF-OKZBNKHCSA-N 1 3 344.503 2.604 10 0 EFAEHO CN1CC[C@H](NC(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)[C@H]1c1ccccc1 ZINC000660960923 482245391 /nfs/dbraw/zinc/24/53/91/482245391.db2.gz WYYQHBNWEXHYLF-OKZBNKHCSA-N 1 3 344.503 2.604 10 0 EFAEHO CN1CC[C@H](NC(=O)N[C@H]2CC[N@@H+](C(C)(C)C)C2)[C@H]1c1ccccc1 ZINC000660960987 482245602 /nfs/dbraw/zinc/24/56/02/482245602.db2.gz YBZCNVUTOBBSHB-OKZBNKHCSA-N 1 3 344.503 2.604 10 0 EFAEHO CN1CC[C@H](NC(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)[C@H]1c1ccccc1 ZINC000660960987 482245609 /nfs/dbraw/zinc/24/56/09/482245609.db2.gz YBZCNVUTOBBSHB-OKZBNKHCSA-N 1 3 344.503 2.604 10 0 EFAEHO CN1CC[C@H](NC(=O)N[C@H]2CC[N@@H+](C(C)(C)C)C2)[C@@H]1c1ccccc1 ZINC000660960983 482245794 /nfs/dbraw/zinc/24/57/94/482245794.db2.gz YBZCNVUTOBBSHB-BZSNNMDCSA-N 1 3 344.503 2.604 10 0 EFAEHO CN1CC[C@H](NC(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)[C@@H]1c1ccccc1 ZINC000660960983 482245799 /nfs/dbraw/zinc/24/57/99/482245799.db2.gz YBZCNVUTOBBSHB-BZSNNMDCSA-N 1 3 344.503 2.604 10 0 EFAEHO Clc1cccc([C@H]2C[NH2+]CCN2Cc2nc3c(s2)CNCC3)c1 ZINC000663494827 482265536 /nfs/dbraw/zinc/26/55/36/482265536.db2.gz SJAGYNBJPOIURS-OAHLLOKOSA-N 1 3 348.903 2.589 10 0 EFAEHO C[C@H](CCNC(=O)NCc1ccccc1CN1CCCCC1)[NH+](C)C ZINC000663517671 482276418 /nfs/dbraw/zinc/27/64/18/482276418.db2.gz HELFDRCKQMZJNR-QGZVFWFLSA-N 1 3 346.519 2.812 10 0 EFAEHO CCC(CC)[C@H](CNC(=O)N(CC)[C@@H]1CCN(C)C1)[NH+]1CCCC1 ZINC000663560381 482299592 /nfs/dbraw/zinc/29/95/92/482299592.db2.gz WOYOFOAXLIOWNN-MSOLQXFVSA-N 1 3 338.540 2.623 10 0 EFAEHO CCN(C(=O)NCc1ccccc1C[N@H+](C)C(C)C)[C@H]1CCN(C)C1 ZINC000663583706 482308572 /nfs/dbraw/zinc/30/85/72/482308572.db2.gz YLIVRLFFYOOMJR-IBGZPJMESA-N 1 3 346.519 2.762 10 0 EFAEHO CCN(C(=O)NCc1ccccc1C[N@@H+](C)C(C)C)[C@H]1CCN(C)C1 ZINC000663583706 482308576 /nfs/dbraw/zinc/30/85/76/482308576.db2.gz YLIVRLFFYOOMJR-IBGZPJMESA-N 1 3 346.519 2.762 10 0 EFAEHO CCN(C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[C@H]1CCN(C)C1 ZINC000663598731 482316008 /nfs/dbraw/zinc/31/60/08/482316008.db2.gz OJWDGXZXWOEWJJ-IBGZPJMESA-N 1 3 344.503 2.518 10 0 EFAEHO CCN(C(=O)NCCC[N@H+](C)C1CCCCC1)[C@H]1CCN(CC)C1 ZINC000663631834 482326264 /nfs/dbraw/zinc/32/62/64/482326264.db2.gz BTGYLMJCKKIFQY-SFHVURJKSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN(C(=O)NCCC[N@@H+](C)C1CCCCC1)[C@H]1CCN(CC)C1 ZINC000663631834 482326265 /nfs/dbraw/zinc/32/62/65/482326265.db2.gz BTGYLMJCKKIFQY-SFHVURJKSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[N@@H+]1CCC[C@@H](C)C1)[C@H]1CCN(CC)C1 ZINC000663787018 482389218 /nfs/dbraw/zinc/38/92/18/482389218.db2.gz FIYLRMWPEUBEKL-SJORKVTESA-N 1 3 338.540 2.623 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1)[C@H]1CCN(CC)C1 ZINC000663787018 482389223 /nfs/dbraw/zinc/38/92/23/482389223.db2.gz FIYLRMWPEUBEKL-SJORKVTESA-N 1 3 338.540 2.623 10 0 EFAEHO Cc1ccc2c(c1)CC[C@H]2NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000663798436 482392669 /nfs/dbraw/zinc/39/26/69/482392669.db2.gz WTYVFODUICMBRW-QFBILLFUSA-N 1 3 346.519 2.554 10 0 EFAEHO Cc1ccc2c(c1)CC[C@H]2NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000663798436 482392671 /nfs/dbraw/zinc/39/26/71/482392671.db2.gz WTYVFODUICMBRW-QFBILLFUSA-N 1 3 346.519 2.554 10 0 EFAEHO CC(C)(C)[NH2+]CCNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000153886886 518756565 /nfs/dbraw/zinc/75/65/65/518756565.db2.gz HWDMLAHKZBSXOJ-MRXNPFEDSA-N 1 3 335.467 2.542 10 0 EFAEHO CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)NC[C@@H](C)N(C)Cc2ccccc2)C1 ZINC000120340896 519692292 /nfs/dbraw/zinc/69/22/92/519692292.db2.gz APZDHLBOFBYGPN-LMMKCTJWSA-N 1 3 346.519 2.535 10 0 EFAEHO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NC[C@@H](C)N(C)Cc2ccccc2)C1 ZINC000120340896 519692294 /nfs/dbraw/zinc/69/22/94/519692294.db2.gz APZDHLBOFBYGPN-LMMKCTJWSA-N 1 3 346.519 2.535 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NCCC[NH2+]C1CCCCC1 ZINC000079116323 519775380 /nfs/dbraw/zinc/77/53/80/519775380.db2.gz VVBGMKJPCLHDGJ-KRWDZBQOSA-N 1 3 326.529 2.574 10 0 EFAEHO CCN1CCC[C@@H]1CN(C)C(=O)NCCCCC[NH+]1CCCCC1 ZINC000177506416 521629030 /nfs/dbraw/zinc/62/90/30/521629030.db2.gz GHCUZXJXYAZTKC-GOSISDBHSA-N 1 3 338.540 2.768 10 0 EFAEHO CCN1CCC[C@@H]1CN(C)C(=O)NCCCC[N@@H+]1CCCC[C@H]1C ZINC000245416744 521629381 /nfs/dbraw/zinc/62/93/81/521629381.db2.gz ISHYMTAMOOMGNE-QZTJIDSGSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN1CCC[C@@H]1CN(C)C(=O)NCCCC[N@H+]1CCCC[C@H]1C ZINC000245416744 521629385 /nfs/dbraw/zinc/62/93/85/521629385.db2.gz ISHYMTAMOOMGNE-QZTJIDSGSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN1CCC[C@H]1CN(C)C(=O)NCCCCC[NH+]1CCCCC1 ZINC000177506438 521650344 /nfs/dbraw/zinc/65/03/44/521650344.db2.gz GHCUZXJXYAZTKC-SFHVURJKSA-N 1 3 338.540 2.768 10 0 EFAEHO CC[N@@H+]1CC[C@H](Nc2ccc(OC3CCN(C)CC3)nc2)[C@@H](C)C1 ZINC000245554116 521721757 /nfs/dbraw/zinc/72/17/57/521721757.db2.gz ADNPNMKNJNLMFU-YJBOKZPZSA-N 1 3 332.492 2.697 10 0 EFAEHO CC[N@H+]1CC[C@H](Nc2ccc(OC3CCN(C)CC3)nc2)[C@@H](C)C1 ZINC000245554116 521721759 /nfs/dbraw/zinc/72/17/59/521721759.db2.gz ADNPNMKNJNLMFU-YJBOKZPZSA-N 1 3 332.492 2.697 10 0 EFAEHO COc1cc([C@H](C)[NH2+]C2CCN(C[C@@H]3CCOC3)CC2)ccc1F ZINC000153877474 522943540 /nfs/dbraw/zinc/94/35/40/522943540.db2.gz RBUZYDPXCIEQND-GJZGRUSLSA-N 1 3 336.451 2.986 10 0 EFAEHO CN(Cc1ccccc1C[N@H+](C)C[C@H]1CCCO1)C[C@H]1CCCO1 ZINC000246191653 523359133 /nfs/dbraw/zinc/35/91/33/523359133.db2.gz WLIKNFQERFYHAE-WOJBJXKFSA-N 1 3 332.488 2.908 10 0 EFAEHO CN(Cc1ccccc1C[N@@H+](C)C[C@H]1CCCO1)C[C@H]1CCCO1 ZINC000246191653 523359143 /nfs/dbraw/zinc/35/91/43/523359143.db2.gz WLIKNFQERFYHAE-WOJBJXKFSA-N 1 3 332.488 2.908 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)[C@H]3CCCCC3(C)C)CC2)CC1 ZINC000193955448 523766149 /nfs/dbraw/zinc/76/61/49/523766149.db2.gz SQPRBFUNNUAOPF-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1oc2ccccc2c1CN(C)C ZINC000245454385 524686955 /nfs/dbraw/zinc/68/69/55/524686955.db2.gz HEVCCZDIFUYLNP-GJZGRUSLSA-N 1 3 341.455 2.803 10 0 EFAEHO C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1oc2ccccc2c1CN(C)C ZINC000245454385 524686970 /nfs/dbraw/zinc/68/69/70/524686970.db2.gz HEVCCZDIFUYLNP-GJZGRUSLSA-N 1 3 341.455 2.803 10 0 EFAEHO C[C@H]([NH2+][C@H]1Cc2ccccc2[C@@H]1O)c1ccc(OCCN(C)C)cc1 ZINC000178352548 525639490 /nfs/dbraw/zinc/63/94/90/525639490.db2.gz ZSJHYYVLRBOTEN-JHVJFLLYSA-N 1 3 340.467 2.936 10 0 EFAEHO c1ncn(-c2ccc(CN3CCC(C[NH+]4CCCC4)CC3)cc2)n1 ZINC000152686797 526614133 /nfs/dbraw/zinc/61/41/33/526614133.db2.gz ZBLCNKCKWXHLOE-UHFFFAOYSA-N 1 3 325.460 2.575 10 0 EFAEHO O=C1C[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)CN1C1CC1 ZINC000245742373 527030928 /nfs/dbraw/zinc/03/09/28/527030928.db2.gz RUYIXCKJMQWNOD-XEYPJELSSA-N 1 3 339.483 2.535 10 0 EFAEHO CCC(=O)CC[N@H+](C)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000190219889 528290622 /nfs/dbraw/zinc/29/06/22/528290622.db2.gz IQZUAHXLDFPGRW-FQEVSTJZSA-N 1 3 332.488 2.733 10 0 EFAEHO CCC(=O)CC[N@@H+](C)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000190219889 528290627 /nfs/dbraw/zinc/29/06/27/528290627.db2.gz IQZUAHXLDFPGRW-FQEVSTJZSA-N 1 3 332.488 2.733 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H](C)CCOC)CC1 ZINC000414479118 534937816 /nfs/dbraw/zinc/93/78/16/534937816.db2.gz HUWBTWDQHZGKLG-SFHVURJKSA-N 1 3 333.520 2.981 10 0 EFAEHO CC(C)(C)OC1CC([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)C1 ZINC000414307757 534964674 /nfs/dbraw/zinc/96/46/74/534964674.db2.gz PLUDOJALSRDXIH-UHFFFAOYSA-N 1 3 346.515 2.949 10 0 EFAEHO CC(C)n1ccc(C[C@@H](C)[NH2+]CCCCN2C[C@H](C)O[C@@H](C)C2)n1 ZINC000341178176 535091307 /nfs/dbraw/zinc/09/13/07/535091307.db2.gz BRLVTKMKSFMXTJ-SQNIBIBYSA-N 1 3 336.524 2.874 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)CCN2CCc3ccccc3C2)CC1 ZINC000348896732 535446532 /nfs/dbraw/zinc/44/65/32/535446532.db2.gz BCCDVCFDEYXIAX-UHFFFAOYSA-N 1 3 343.515 2.673 10 0 EFAEHO CC[NH+](CC)CC1CCN(Cc2cc(-c3cnn(C)c3)no2)CC1 ZINC000346160984 535497076 /nfs/dbraw/zinc/49/70/76/535497076.db2.gz NFOYUJOZVMNGRL-UHFFFAOYSA-N 1 3 331.464 2.629 10 0 EFAEHO CN(C)Cc1ccc(-c2noc(COC3CCC([NH3+])CC3)n2)cc1 ZINC000414623010 535994649 /nfs/dbraw/zinc/99/46/49/535994649.db2.gz NAGQJUFQVDHQHJ-UHFFFAOYSA-N 1 3 330.432 2.585 10 0 EFAEHO COC(=O)c1ccc(CNCCCC[NH+](C)C)c(Br)c1 ZINC000226713738 536704070 /nfs/dbraw/zinc/70/40/70/536704070.db2.gz CRPGKKYOBWQQIX-UHFFFAOYSA-N 1 3 343.265 2.667 10 0 EFAEHO C[C@H](CCN1CC[C@]2(C1)CCCOC2)[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC000341992664 545943303 /nfs/dbraw/zinc/94/33/03/545943303.db2.gz NVYYKZHIEBIYNX-HSALFYBXSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CCN1CC[C@]2(C1)CCCOC2)[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000341992664 545943307 /nfs/dbraw/zinc/94/33/07/545943307.db2.gz NVYYKZHIEBIYNX-HSALFYBXSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@@H+]1CC[C@]2(C1)CCCOC2)N1CC[C@@]2(C1)CCCOC2 ZINC000341992664 545943312 /nfs/dbraw/zinc/94/33/12/545943312.db2.gz NVYYKZHIEBIYNX-HSALFYBXSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@H+]1CC[C@]2(C1)CCCOC2)N1CC[C@@]2(C1)CCCOC2 ZINC000341992664 545943315 /nfs/dbraw/zinc/94/33/15/545943315.db2.gz NVYYKZHIEBIYNX-HSALFYBXSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CCN1CC[C@@]2(C1)CCCOC2)[N@@H+]1CC[C@]2(C1)CCCOC2 ZINC000341992661 545943587 /nfs/dbraw/zinc/94/35/87/545943587.db2.gz NVYYKZHIEBIYNX-AQNXPRMDSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CCN1CC[C@@]2(C1)CCCOC2)[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000341992661 545943592 /nfs/dbraw/zinc/94/35/92/545943592.db2.gz NVYYKZHIEBIYNX-AQNXPRMDSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@@H+]1CC[C@@]2(C1)CCCOC2)N1CC[C@]2(C1)CCCOC2 ZINC000341992661 545943596 /nfs/dbraw/zinc/94/35/96/545943596.db2.gz NVYYKZHIEBIYNX-AQNXPRMDSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@H+]1CC[C@@]2(C1)CCCOC2)N1CC[C@]2(C1)CCCOC2 ZINC000341992661 545943601 /nfs/dbraw/zinc/94/36/01/545943601.db2.gz NVYYKZHIEBIYNX-AQNXPRMDSA-N 1 3 336.520 2.770 10 0 EFAEHO CC1(C[NH2+]Cc2ccc(C(=O)NCCN3CCCC3)cc2)CCC1 ZINC000434774901 546231185 /nfs/dbraw/zinc/23/11/85/546231185.db2.gz ITOPUYRMTMCYDF-UHFFFAOYSA-N 1 3 329.488 2.792 10 0 EFAEHO O=C(NC[C@@H]1CCCCN1Cc1ccccc1)[C@H]1C[C@]12CCC[NH2+]C2 ZINC000655445554 546450193 /nfs/dbraw/zinc/45/01/93/546450193.db2.gz BKTCDBTZSAVZSQ-ZVDOUQERSA-N 1 3 341.499 2.547 10 0 EFAEHO CC[N@H+](Cc1ccc(C(=O)N[C@@H](CN)C(F)(F)F)cc1)C(C)C ZINC000655514488 546469802 /nfs/dbraw/zinc/46/98/02/546469802.db2.gz RHBIWZOPACHQPG-AWEZNQCLSA-N 1 3 331.382 2.536 10 0 EFAEHO CC[N@@H+](Cc1ccc(C(=O)N[C@@H](CN)C(F)(F)F)cc1)C(C)C ZINC000655514488 546469805 /nfs/dbraw/zinc/46/98/05/546469805.db2.gz RHBIWZOPACHQPG-AWEZNQCLSA-N 1 3 331.382 2.536 10 0 EFAEHO CCC[N@H+](CC)Cc1ccc(C(=O)N[C@@H](CN)C(F)(F)F)cc1 ZINC000655514303 546470369 /nfs/dbraw/zinc/47/03/69/546470369.db2.gz PYSFJORWURKLKC-AWEZNQCLSA-N 1 3 331.382 2.538 10 0 EFAEHO CCC[N@@H+](CC)Cc1ccc(C(=O)N[C@@H](CN)C(F)(F)F)cc1 ZINC000655514303 546470371 /nfs/dbraw/zinc/47/03/71/546470371.db2.gz PYSFJORWURKLKC-AWEZNQCLSA-N 1 3 331.382 2.538 10 0 EFAEHO C[C@@H]1CC[C@H]([NH2+]Cc2ccc(CN3CCN(C)CC3)cc2)CS1 ZINC000655697227 546537496 /nfs/dbraw/zinc/53/74/96/546537496.db2.gz OTHOWOHDDCEFTH-APWZRJJASA-N 1 3 333.545 2.808 10 0 EFAEHO C[C@@H]1CC[C@@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CS1 ZINC000655777782 546576932 /nfs/dbraw/zinc/57/69/32/546576932.db2.gz ZEGYRLPPECBECA-SJLPKXTDSA-N 1 3 334.529 2.887 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](CNCc2cn3ccc(Br)cc3n2)C1 ZINC000655824776 546599970 /nfs/dbraw/zinc/59/99/70/546599970.db2.gz PIUCYKRHEDGLKL-VDISTLRHSA-N 1 3 337.265 2.527 10 0 EFAEHO Cn1nnc2c1CC[C@H](NC1CC[NH+](C(C)(C)CC(C)(C)C)CC1)C2 ZINC000655825896 546601355 /nfs/dbraw/zinc/60/13/55/546601355.db2.gz OGHMBXJBBZEDQQ-INIZCTEOSA-N 1 3 347.551 2.941 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](CNCc2cc3c(cc2Br)OCO3)C1 ZINC000655826447 546601824 /nfs/dbraw/zinc/60/18/24/546601824.db2.gz WFLHKXWHPMWHEN-KLPPZKSPSA-N 1 3 341.249 2.608 10 0 EFAEHO COc1ccc(Br)c(CNC[C@H]2C[C@@H]([NH+](C)C)C2)c1 ZINC000655827640 546602375 /nfs/dbraw/zinc/60/23/75/546602375.db2.gz VVWDSGKIIWNGIR-BJHJDKERSA-N 1 3 327.266 2.888 10 0 EFAEHO CCC(C)(C)N1CCN(C(=O)NCc2ccc([C@@H](C)[NH3+])cc2)CC1 ZINC000655962466 546653008 /nfs/dbraw/zinc/65/30/08/546653008.db2.gz BYPVVOKVMJXCDL-OAHLLOKOSA-N 1 3 332.492 2.722 10 0 EFAEHO [NH3+]CCCN(c1cccc(F)c1)C1CCN(C[C@@H]2CCCO2)CC1 ZINC000656255141 546748223 /nfs/dbraw/zinc/74/82/23/546748223.db2.gz HPTIIJDXJOXDKY-IBGZPJMESA-N 1 3 335.467 2.624 10 0 EFAEHO [NH3+][C@@H](Cc1cn([C@H]2CCN(Cc3ccccc3)C2)nn1)c1ccccc1 ZINC000656455947 546806528 /nfs/dbraw/zinc/80/65/28/546806528.db2.gz PXWMLNNCYSXUEK-SFTDATJTSA-N 1 3 347.466 2.968 10 0 EFAEHO COc1cc2c(cc1CN1CCC[C@H](C3CC[NH2+]CC3)C1)OCO2 ZINC000656782320 546922395 /nfs/dbraw/zinc/92/23/95/546922395.db2.gz FCPCUOSZWRRBPI-HNNXBMFYSA-N 1 3 332.444 2.636 10 0 EFAEHO C[C@H]1CCC[C@](C[NH2+]Cc2ccnn2-c2ccncc2)(N(C)C)C1 ZINC000657327804 547113511 /nfs/dbraw/zinc/11/35/11/547113511.db2.gz YNLJHPNSBHBRBM-LPHOPBHVSA-N 1 3 327.476 2.867 10 0 EFAEHO Cc1ccc2cc(C[NH2+][C@@H]3CCN(C4CCN(C)CC4)C3)[nH]c2c1 ZINC000657360138 547129618 /nfs/dbraw/zinc/12/96/18/547129618.db2.gz XQZMHJVEQODROP-QGZVFWFLSA-N 1 3 326.488 2.734 10 0 EFAEHO C[C@H]1CN(CCCC[NH2+]Cc2c(C3CCC3)cnn2C)C[C@H](C)O1 ZINC000657366308 547133511 /nfs/dbraw/zinc/13/35/11/547133511.db2.gz FNTVPBGXWAEBRO-HOTGVXAUSA-N 1 3 334.508 2.667 10 0 EFAEHO CN1CCC(C[NH2+]C2CCC(C3CCC3)CC2)(N2CCOCC2)CC1 ZINC000657491298 547183130 /nfs/dbraw/zinc/18/31/30/547183130.db2.gz XEBAFNHTXUPNOS-UHFFFAOYSA-N 1 3 349.563 2.732 10 0 EFAEHO COc1ccc(C)cc1CNCC1CC[NH+](C2CCOCC2)CC1 ZINC000657536921 547196676 /nfs/dbraw/zinc/19/66/76/547196676.db2.gz UISKCFZHGZGRPQ-UHFFFAOYSA-N 1 3 332.488 2.984 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1cc2cc(Cl)cnc2o1 ZINC000657573168 547212225 /nfs/dbraw/zinc/21/22/25/547212225.db2.gz LAVRTKXRZJSIOM-ZDUSSCGKSA-N 1 3 338.883 2.843 10 0 EFAEHO CO[C@@H]1CCC[C@@H]([C@@H](CO)[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000657576446 547214820 /nfs/dbraw/zinc/21/48/20/547214820.db2.gz KYSZOBNDAMVWJJ-NSISKUIASA-N 1 3 338.536 2.939 10 0 EFAEHO CO[C@@H]1CCC[C@@H]([C@@H](CO)NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000657576446 547214826 /nfs/dbraw/zinc/21/48/26/547214826.db2.gz KYSZOBNDAMVWJJ-NSISKUIASA-N 1 3 338.536 2.939 10 0 EFAEHO COc1ccc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1F ZINC000657593675 547221042 /nfs/dbraw/zinc/22/10/42/547221042.db2.gz BFRNYNOFRRGAMM-SFHVURJKSA-N 1 3 344.430 2.691 10 0 EFAEHO COc1ccc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)cc1F ZINC000657593675 547221046 /nfs/dbraw/zinc/22/10/46/547221046.db2.gz BFRNYNOFRRGAMM-SFHVURJKSA-N 1 3 344.430 2.691 10 0 EFAEHO COCc1csc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000657594405 547222493 /nfs/dbraw/zinc/22/24/93/547222493.db2.gz AAPICLZDLAOBHZ-GOSISDBHSA-N 1 3 346.496 2.751 10 0 EFAEHO COCc1csc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000657594405 547222502 /nfs/dbraw/zinc/22/25/02/547222502.db2.gz AAPICLZDLAOBHZ-GOSISDBHSA-N 1 3 346.496 2.751 10 0 EFAEHO COc1cc(F)cc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1 ZINC000657597637 547223971 /nfs/dbraw/zinc/22/39/71/547223971.db2.gz VYHXCSVLFOGMRJ-IBGZPJMESA-N 1 3 344.430 2.691 10 0 EFAEHO COc1cc(F)cc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1 ZINC000657597637 547223975 /nfs/dbraw/zinc/22/39/75/547223975.db2.gz VYHXCSVLFOGMRJ-IBGZPJMESA-N 1 3 344.430 2.691 10 0 EFAEHO Cc1ccc(F)cc1CNCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000657597004 547224469 /nfs/dbraw/zinc/22/44/69/547224469.db2.gz QLFVAXRSIHEETE-FQEVSTJZSA-N 1 3 328.431 2.991 10 0 EFAEHO Cc1ccc(F)cc1CNCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1 ZINC000657597004 547224473 /nfs/dbraw/zinc/22/44/73/547224473.db2.gz QLFVAXRSIHEETE-FQEVSTJZSA-N 1 3 328.431 2.991 10 0 EFAEHO O[C@H]1C[C@H](NCc2ccc(OCC[NH+]3CCCC3)cc2)C12CCC2 ZINC000657703305 547258136 /nfs/dbraw/zinc/25/81/36/547258136.db2.gz MZCXQONEUPCSMG-OALUTQOASA-N 1 3 330.472 2.554 10 0 EFAEHO CN(c1ccccc1CN[C@@H]1C[C@H](O)C12CCC2)C1CC[NH+](C)CC1 ZINC000657704207 547258674 /nfs/dbraw/zinc/25/86/74/547258674.db2.gz DVOXSIJVPMLVGS-UXHICEINSA-N 1 3 343.515 2.610 10 0 EFAEHO CN(C)CCOc1ccc(C[NH2+]CC2(O)CCC(F)(F)CC2)cc1 ZINC000657776138 547282332 /nfs/dbraw/zinc/28/23/32/547282332.db2.gz NAZKMQFZYNAJRP-UHFFFAOYSA-N 1 3 342.430 2.657 10 0 EFAEHO C[C@H]([NH2+]Cc1cccc(C(=O)NCCN(C)C)c1)C(C)(C)C(F)F ZINC000657868995 547305930 /nfs/dbraw/zinc/30/59/30/547305930.db2.gz SSRBPHYEUZAXLE-ZDUSSCGKSA-N 1 3 341.446 2.747 10 0 EFAEHO CN1CCC(C[NH2+][C@@H]2CCCSCC2)(N2CCCCC2)CC1 ZINC000657892835 547311888 /nfs/dbraw/zinc/31/18/88/547311888.db2.gz NQBWGFSKIZMMOJ-QGZVFWFLSA-N 1 3 325.566 2.812 10 0 EFAEHO OC1CCN(Cc2ccccc2C[NH2+]C2CC(CF)(CF)C2)CC1 ZINC000657900447 547313528 /nfs/dbraw/zinc/31/35/28/547313528.db2.gz IMDJROVDMHSASQ-UHFFFAOYSA-N 1 3 338.442 2.821 10 0 EFAEHO OC1(C[NH2+]C2CC(CF)(CF)C2)CCN(Cc2ccccc2)CC1 ZINC000658033353 547340156 /nfs/dbraw/zinc/34/01/56/547340156.db2.gz AKGAGLNBIRAWKO-UHFFFAOYSA-N 1 3 338.442 2.691 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)N[C@H]1CCc2c1c(F)ccc2F ZINC000658108288 547358734 /nfs/dbraw/zinc/35/87/34/547358734.db2.gz QMHQVXKZQRUORC-GUYCJALGSA-N 1 3 325.447 2.814 10 0 EFAEHO COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000658134303 547367162 /nfs/dbraw/zinc/36/71/62/547367162.db2.gz ACIZERCZXRWYIN-ZCNNSNEGSA-N 1 3 332.488 2.548 10 0 EFAEHO C[C@H](NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cccc(CO)c1 ZINC000658136391 547367560 /nfs/dbraw/zinc/36/75/60/547367560.db2.gz HAVNGOBURQDYMM-KKSFZXQISA-N 1 3 340.467 2.596 10 0 EFAEHO C[C@H](NCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1)c1cccc(CO)c1 ZINC000658136391 547367564 /nfs/dbraw/zinc/36/75/64/547367564.db2.gz HAVNGOBURQDYMM-KKSFZXQISA-N 1 3 340.467 2.596 10 0 EFAEHO COc1cc([C@@H](C)NCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)ccn1 ZINC000658136636 547368085 /nfs/dbraw/zinc/36/80/85/547368085.db2.gz HOIZVXCUMCFEHU-BEFAXECRSA-N 1 3 341.455 2.508 10 0 EFAEHO COc1cc([C@@H](C)NCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)ccn1 ZINC000658136636 547368088 /nfs/dbraw/zinc/36/80/88/547368088.db2.gz HOIZVXCUMCFEHU-BEFAXECRSA-N 1 3 341.455 2.508 10 0 EFAEHO COc1cc([C@H](C)NCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)ccn1 ZINC000658136643 547368181 /nfs/dbraw/zinc/36/81/81/547368181.db2.gz HOIZVXCUMCFEHU-HNAYVOBHSA-N 1 3 341.455 2.508 10 0 EFAEHO COc1cc([C@H](C)NCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)ccn1 ZINC000658136643 547368185 /nfs/dbraw/zinc/36/81/85/547368185.db2.gz HOIZVXCUMCFEHU-HNAYVOBHSA-N 1 3 341.455 2.508 10 0 EFAEHO COC[C@H]([NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1)C1CCCC1 ZINC000658137989 547368245 /nfs/dbraw/zinc/36/82/45/547368245.db2.gz LKLJITFWCVDQCS-UXHICEINSA-N 1 3 332.488 2.548 10 0 EFAEHO O[C@H]1CCN(Cc2ccc(C[NH2+][C@H]3CCCC34CCOCC4)cc2)C1 ZINC000658138036 547368297 /nfs/dbraw/zinc/36/82/97/547368297.db2.gz MCNGJXFZRUKBQG-PMACEKPBSA-N 1 3 344.499 2.692 10 0 EFAEHO CCO[C@@H]1C[C@@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)C1(C)C ZINC000658139189 547369210 /nfs/dbraw/zinc/36/92/10/547369210.db2.gz PHZLMSISTCDNET-IPMKNSEASA-N 1 3 332.488 2.546 10 0 EFAEHO Cc1cncc(CC[NH2+][C@H](C)c2cccc(OCCN(C)C)c2)n1 ZINC000658260933 547399911 /nfs/dbraw/zinc/39/99/11/547399911.db2.gz GBBGAGWNTHIHMD-MRXNPFEDSA-N 1 3 328.460 2.619 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)C[NH2+][C@@H]1CCN(C)[C@H]2CCC[C@@H]21 ZINC000671743135 547664544 /nfs/dbraw/zinc/66/45/44/547664544.db2.gz GDPCMXKCHLNGJI-MKXGPGLRSA-N 1 3 332.488 2.506 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CN[C@@H]1CC[N@@H+](C)[C@H]2CCC[C@@H]21 ZINC000671743135 547664547 /nfs/dbraw/zinc/66/45/47/547664547.db2.gz GDPCMXKCHLNGJI-MKXGPGLRSA-N 1 3 332.488 2.506 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CN[C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000671743135 547664549 /nfs/dbraw/zinc/66/45/49/547664549.db2.gz GDPCMXKCHLNGJI-MKXGPGLRSA-N 1 3 332.488 2.506 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+][C@@H]2CCN(c3ccccc3)C2)C[C@@H](C)O1 ZINC000674880619 548169789 /nfs/dbraw/zinc/16/97/89/548169789.db2.gz RIHNFBUDIYNAJF-GUDVDZBRSA-N 1 3 331.504 2.744 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+][C@H]2CCN(c3ccccc3)C2)C[C@H](C)O1 ZINC000674880621 548169973 /nfs/dbraw/zinc/16/99/73/548169973.db2.gz RIHNFBUDIYNAJF-OTWHNJEPSA-N 1 3 331.504 2.744 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+][C@H]2CCN(c3ccccc3)C2)C[C@@H](C)O1 ZINC000674880622 548170318 /nfs/dbraw/zinc/17/03/18/548170318.db2.gz RIHNFBUDIYNAJF-QRVBRYPASA-N 1 3 331.504 2.744 10 0 EFAEHO O=C(NC1CC1)c1ccc(CN2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000678139004 548851722 /nfs/dbraw/zinc/85/17/22/548851722.db2.gz JEJOMAFJQHGWLH-UHFFFAOYSA-N 1 3 341.499 2.887 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN2CCC(c3c[nH]cn3)CC2)cc1 ZINC000678268019 548882981 /nfs/dbraw/zinc/88/29/81/548882981.db2.gz ZIUXWAGSYXCLMF-UHFFFAOYSA-N 1 3 328.460 2.730 10 0 EFAEHO CCN1CCN(c2ccccc2N[C@@H](C)C2CC[NH+](C)CC2)CC1 ZINC000679086090 549053220 /nfs/dbraw/zinc/05/32/20/549053220.db2.gz GXXLGDLAQIVNLZ-KRWDZBQOSA-N 1 3 330.520 2.971 10 0 EFAEHO c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H](NCCOC[C@@H]2CCCO2)C3)cc1 ZINC000679394210 549118713 /nfs/dbraw/zinc/11/87/13/549118713.db2.gz IJMDPZDOEMZLSW-BURNTYAHSA-N 1 3 344.499 2.967 10 0 EFAEHO c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H](NCCOC[C@@H]2CCCO2)C3)cc1 ZINC000679394210 549118717 /nfs/dbraw/zinc/11/87/17/549118717.db2.gz IJMDPZDOEMZLSW-BURNTYAHSA-N 1 3 344.499 2.967 10 0 EFAEHO c1ccc2c(c1)CC[C@@H](CN1CCN(CC[NH+]3CCCC3)CC1)C2 ZINC000679815309 549199252 /nfs/dbraw/zinc/19/92/52/549199252.db2.gz BZPUMFHNMRYAED-LJQANCHMSA-N 1 3 327.516 2.505 10 0 EFAEHO CC(C)[C@@H](C[N@H+](C)Cc1ccccc1)NC(=O)N[C@H]1CCCN(C)C1 ZINC000681095210 549461257 /nfs/dbraw/zinc/46/12/57/549461257.db2.gz NUIIQSHIWKMNPV-RBUKOAKNSA-N 1 3 346.519 2.536 10 0 EFAEHO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N[C@H]1CCCN(C)C1 ZINC000681095210 549461262 /nfs/dbraw/zinc/46/12/62/549461262.db2.gz NUIIQSHIWKMNPV-RBUKOAKNSA-N 1 3 346.519 2.536 10 0 EFAEHO C/C(=C\c1ccc(Cl)cc1)C(=O)N(CCN(C)C)CC[NH+](C)C ZINC000759014820 575882834 /nfs/dbraw/zinc/88/28/34/575882834.db2.gz STODAZYWUDEHPM-CCEZHUSRSA-N 1 3 337.895 2.695 10 0 EFAEHO Cc1ccccc1[C@H](O)C[NH+]1CCC(N2CCN(C(C)C)CC2)CC1 ZINC000761120260 576116475 /nfs/dbraw/zinc/11/64/75/576116475.db2.gz BUJQRPZBLHRBRE-OAQYLSRUSA-N 1 3 345.531 2.519 10 0 EFAEHO c1ccc(CN2C[C@H]3C[C@@H](C2)C3[NH2+][C@@H]2CCN3CCCC[C@H]23)cc1 ZINC000399640326 577329924 /nfs/dbraw/zinc/32/99/24/577329924.db2.gz GZHRONMUHXYXJS-YNBHDNDASA-N 1 3 325.500 2.723 10 0 EFAEHO CN(Cc1ccc(C[NH+](C)C)cc1)C[C@H](O)COCc1ccccc1 ZINC000769100647 577334252 /nfs/dbraw/zinc/33/42/52/577334252.db2.gz MKEUSSGAVDWDGM-NRFANRHFSA-N 1 3 342.483 2.758 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC[C@H](O)c1cccnc1 ZINC000773083038 581395023 /nfs/dbraw/zinc/39/50/23/581395023.db2.gz RUSUVBJWNDXQMV-AHRSYUTCSA-N 1 3 325.456 2.615 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC[C@H](O)c1cccnc1 ZINC000773083038 581395026 /nfs/dbraw/zinc/39/50/26/581395026.db2.gz RUSUVBJWNDXQMV-AHRSYUTCSA-N 1 3 325.456 2.615 10 0 EFAEHO CC1(C)OCC([NH2+][C@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)CO1 ZINC000774350462 581490008 /nfs/dbraw/zinc/49/00/08/581490008.db2.gz YQQHYBONNDXIQD-GGPHIMKMSA-N 1 3 330.472 2.923 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[NH2+]Cc1ccc2ccccc2c1)N(C)C ZINC001691359862 1248691647 /nfs/dbraw/zinc/69/16/47/1248691647.db2.gz HAIPAWDFROCCEN-LJQANCHMSA-N 1 3 327.472 2.728 10 0 EFAEHO CCN1CC[C@H](c2ccccc2)[C@H](NC(=O)CCCC[NH+](C)C)C1 ZINC001691442154 1249067732 /nfs/dbraw/zinc/06/77/32/1249067732.db2.gz XPPPWFODYMZXQT-RTBURBONSA-N 1 3 331.504 2.713 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2C[C@@H]([NH2+]CCCCC(F)(F)F)C2)CCC1 ZINC001691447255 1249143510 /nfs/dbraw/zinc/14/35/10/1249143510.db2.gz VQIMBENYXGEIBY-OKILXGFUSA-N 1 3 349.441 2.688 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@@H]([NH2+]CCC2=CCCCC2)C1)N(C)C ZINC001691475889 1249198904 /nfs/dbraw/zinc/19/89/04/1249198904.db2.gz KUUXXEBLJGGFHP-CEXWTWQISA-N 1 3 335.536 2.948 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H](F)CN(CC)CC)CC[N@@H+]1CC=C(C)C ZINC001691480201 1249220267 /nfs/dbraw/zinc/22/02/67/1249220267.db2.gz UWRJCIKBEKNHLI-YESZJQIVSA-N 1 3 327.488 2.602 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H](F)CN(CC)CC)CC[N@H+]1CC=C(C)C ZINC001691480201 1249220277 /nfs/dbraw/zinc/22/02/77/1249220277.db2.gz UWRJCIKBEKNHLI-YESZJQIVSA-N 1 3 327.488 2.602 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2C[C@@H]([NH2+]CCCc3ccsc3)C2)C1 ZINC001691114678 1248436533 /nfs/dbraw/zinc/43/65/33/1248436533.db2.gz RSBVAJHZFWRBRU-NXHRZFHOSA-N 1 3 349.544 2.507 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001691159981 1248487106 /nfs/dbraw/zinc/48/71/06/1248487106.db2.gz PIYWPZKRINQQDQ-LPHOPBHVSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCCC[N@H+]1CC[C@@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001691159981 1248487111 /nfs/dbraw/zinc/48/71/11/1248487111.db2.gz PIYWPZKRINQQDQ-LPHOPBHVSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](CNC(=O)CCCC[NH+](C)C)C2)cc1F ZINC001691166405 1248497690 /nfs/dbraw/zinc/49/76/90/1248497690.db2.gz RWICEIJNFSSEAN-SFHVURJKSA-N 1 3 349.494 2.804 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]2C1 ZINC001691558232 1251771231 /nfs/dbraw/zinc/77/12/31/1251771231.db2.gz UDZZDJKOTFGGKO-KKSLTYSGSA-N 1 3 333.520 2.607 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]2C1 ZINC001691558232 1251771242 /nfs/dbraw/zinc/77/12/42/1251771242.db2.gz UDZZDJKOTFGGKO-KKSLTYSGSA-N 1 3 333.520 2.607 10 0 EFAEHO Cc1ccc2ccccc2c1C[NH2+]CCN(C)C(=O)CN1CCCC1 ZINC001691603019 1251813797 /nfs/dbraw/zinc/81/37/97/1251813797.db2.gz OQXKGEJFGYEIOM-UHFFFAOYSA-N 1 3 339.483 2.792 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N[C@@]2(C)CCN(CCCCC(F)(F)F)C2)C1 ZINC001484069086 1252180425 /nfs/dbraw/zinc/18/04/25/1252180425.db2.gz WXNBCFXOWSDJKH-ZBFHGGJFSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N[C@@]2(C)CCN(CCCCC(F)(F)F)C2)C1 ZINC001484069086 1252180427 /nfs/dbraw/zinc/18/04/27/1252180427.db2.gz WXNBCFXOWSDJKH-ZBFHGGJFSA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@](C)(C[NH2+]CCC2CCCC2)C1)N(C)C ZINC001484103543 1252256731 /nfs/dbraw/zinc/25/67/31/1252256731.db2.gz WJJKAMUXXMYBIS-AZUAARDMSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[NH2+]Cc1ccccc1C(F)(F)F ZINC001493770041 1252418998 /nfs/dbraw/zinc/41/89/98/1252418998.db2.gz XWMGEBIZCIMPMR-UHFFFAOYSA-N 1 3 345.409 2.595 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([C@H](C)[NH2+]CCCC(C)(C)C)C1 ZINC001484356276 1252449021 /nfs/dbraw/zinc/44/90/21/1252449021.db2.gz BSIRASLSUGQORW-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CCCCC[NH2+]C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@H]1C ZINC001484376091 1252484326 /nfs/dbraw/zinc/48/43/26/1252484326.db2.gz BSACYYPVUSKCKZ-SJORKVTESA-N 1 3 325.541 2.839 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001484396095 1252518694 /nfs/dbraw/zinc/51/86/94/1252518694.db2.gz QAQNDPCJIAOCBI-XLAORIBOSA-N 1 3 341.515 2.589 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@H](C[NH2+]CCC2CC2)CC1 ZINC001484397945 1252523070 /nfs/dbraw/zinc/52/30/70/1252523070.db2.gz SRNFVXRVWCPKJD-QAQDUYKDSA-N 1 3 332.492 2.573 10 0 EFAEHO CC(C)C[NH2+]CCN(Cc1ccccc1)C(=O)CN1CC[C@H](C)C1 ZINC001484400337 1252539031 /nfs/dbraw/zinc/53/90/31/1252539031.db2.gz QSINYGYRWZSXND-SFHVURJKSA-N 1 3 331.504 2.603 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2ccsc2)CC1 ZINC001484460509 1252650524 /nfs/dbraw/zinc/65/05/24/1252650524.db2.gz BYZFHOYPERLIDA-IAGOWNOFSA-N 1 3 347.528 2.655 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2C/C=C\c1ccccc1 ZINC001484461609 1252655783 /nfs/dbraw/zinc/65/57/83/1252655783.db2.gz JLVAZTYQZCOZHV-HRFKEGQDSA-N 1 3 341.499 2.717 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)c(C)c1 ZINC001484511517 1252734749 /nfs/dbraw/zinc/73/47/49/1252734749.db2.gz JDUSQGPHMJBOJK-QUCCMNQESA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(C[N@H+]2CCC[C@@H](NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001484727612 1252818344 /nfs/dbraw/zinc/81/83/44/1252818344.db2.gz DUHMXXGBOPRYIY-LJQANCHMSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccc(C[N@@H+]2CCC[C@@H](NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001484727612 1252818351 /nfs/dbraw/zinc/81/83/51/1252818351.db2.gz DUHMXXGBOPRYIY-LJQANCHMSA-N 1 3 331.504 2.806 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CCC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001484721092 1252837106 /nfs/dbraw/zinc/83/71/06/1252837106.db2.gz AJVVESJGNUQIPT-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CCC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001484721092 1252837121 /nfs/dbraw/zinc/83/71/21/1252837121.db2.gz AJVVESJGNUQIPT-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CCC[C@@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001484721094 1252837324 /nfs/dbraw/zinc/83/73/24/1252837324.db2.gz AJVVESJGNUQIPT-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CCC[C@@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001484721094 1252837332 /nfs/dbraw/zinc/83/73/32/1252837332.db2.gz AJVVESJGNUQIPT-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO Cc1cccnc1CN(C)CCCN(C)C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001484745680 1252855923 /nfs/dbraw/zinc/85/59/23/1252855923.db2.gz OTSRKVNPBKQKLA-GOSISDBHSA-N 1 3 346.519 2.545 10 0 EFAEHO Cc1cccnc1CN(C)CCCN(C)C(=O)CC[C@H]1CCC[N@H+]1C ZINC001484745680 1252855935 /nfs/dbraw/zinc/85/59/35/1252855935.db2.gz OTSRKVNPBKQKLA-GOSISDBHSA-N 1 3 346.519 2.545 10 0 EFAEHO Cc1ccc(CN2CC([C@@H](C)NC(=O)C[C@H]3CC[N@H+](C)C3)C2)cc1C ZINC001409929448 1255626719 /nfs/dbraw/zinc/62/67/19/1255626719.db2.gz HEYDBOPHGODRLP-IEBWSBKVSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(CN2CC([C@@H](C)NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)cc1C ZINC001409929448 1255626724 /nfs/dbraw/zinc/62/67/24/1255626724.db2.gz HEYDBOPHGODRLP-IEBWSBKVSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(CN2CC([C@H](C)NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)cc1C ZINC001409929440 1255642406 /nfs/dbraw/zinc/64/24/06/1255642406.db2.gz HEYDBOPHGODRLP-HKUYNNGSSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(CN2CC([C@H](C)NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)cc1C ZINC001409929440 1255642410 /nfs/dbraw/zinc/64/24/10/1255642410.db2.gz HEYDBOPHGODRLP-HKUYNNGSSA-N 1 3 343.515 2.582 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H]1CC[C@H](NC(=O)C(C)(C)N2CCCC2)CC1 ZINC001272748927 1256444118 /nfs/dbraw/zinc/44/41/18/1256444118.db2.gz VDJNXNZSODZNJR-BRWVUGGUSA-N 1 3 341.515 2.874 10 0 EFAEHO CCCCC[NH2+][C@H]1CN(C(=O)Cc2c[nH]cn2)CC[C@@H]1C(F)(F)F ZINC001279170555 1258063370 /nfs/dbraw/zinc/06/33/70/1258063370.db2.gz DEZFMFUHWBOPMI-KBPBESRZSA-N 1 3 346.397 2.511 10 0 EFAEHO CC(C)(C)OC(=O)N1CC(C[NH2+]C2CCN(C(C)(C)C)CC2)C1 ZINC000710880836 1259890261 /nfs/dbraw/zinc/89/02/61/1259890261.db2.gz GGXVTEIJQYTGLL-UHFFFAOYSA-N 1 3 325.497 2.706 10 0 EFAEHO c1ccc(CN2CCCC[C@H](C[NH2+][C@H]3CCO[C@@]34CCOC4)C2)cc1 ZINC000903173327 1259895841 /nfs/dbraw/zinc/89/58/41/1259895841.db2.gz YUUAAUBUFRCBSG-QHAWAJNXSA-N 1 3 344.499 2.826 10 0 EFAEHO C[C@@H](CC[NH2+]CC1CCC2(CC2)CC1)NC(=O)C1(N(C)C)CCC1 ZINC001272831012 1261106823 /nfs/dbraw/zinc/10/68/23/1261106823.db2.gz RSVTYPDQHPYZMI-INIZCTEOSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1cc(C)cc(OC[C@H](O)CN2CCCC[C@H]2[C@@H]2CC[NH2+]C2)c1 ZINC000923365823 1261559869 /nfs/dbraw/zinc/55/98/69/1261559869.db2.gz ZPQRYUBRIZYROX-GGPKGHCWSA-N 1 3 332.488 2.507 10 0 EFAEHO CCN1CCN(c2ccc(F)cc2[C@H](C)NCCC[NH2+]C2CC2)CC1 ZINC000923377930 1261577578 /nfs/dbraw/zinc/57/75/78/1261577578.db2.gz YAOFHNFIRBTNON-INIZCTEOSA-N 1 3 348.510 2.760 10 0 EFAEHO Cc1cc(C)cc(OC[C@H](O)CN2CC[C@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000923414659 1261628207 /nfs/dbraw/zinc/62/82/07/1261628207.db2.gz MXHOLQWAGDSSSN-YLJYHZDGSA-N 1 3 334.504 2.740 10 0 EFAEHO Cc1ccc2ncc(CN3CCC4(CO[C@H](C[NH3+])C4)CC3)cc2c1 ZINC000923443611 1261661492 /nfs/dbraw/zinc/66/14/92/1261661492.db2.gz GGQHXGWFWPBNKG-SFHVURJKSA-N 1 3 325.456 2.873 10 0 EFAEHO [NH3+]C[C@H]1CC2(CO1)CCN(CCOc1ccc(F)cc1Cl)CC2 ZINC000923451872 1261690610 /nfs/dbraw/zinc/69/06/10/1261690610.db2.gz QMVSXSQLXWYADX-CQSZACIVSA-N 1 3 342.842 2.688 10 0 EFAEHO CC(C)C[C@H](NC(=O)CN1CC[C@H](C[NH3+])[C@H](C)C1)c1ccccc1 ZINC000923502099 1261781611 /nfs/dbraw/zinc/78/16/11/1261781611.db2.gz YABRXRWYBOHKGU-QRQLOZEOSA-N 1 3 331.504 2.807 10 0 EFAEHO C[C@@H]1CN(Cc2nn(-c3ccc(F)cc3)c3c2CCC3)CC[C@H]1C[NH3+] ZINC000923497876 1261789006 /nfs/dbraw/zinc/78/90/06/1261789006.db2.gz NAZIYUOARJEDKE-CABCVRRESA-N 1 3 342.462 2.917 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C[NH3+])[C@H](C)C1)c1cccc2ccccc21 ZINC000923500071 1261796373 /nfs/dbraw/zinc/79/63/73/1261796373.db2.gz NVNDUEZHNBNOMJ-RYRKJORJSA-N 1 3 339.483 2.934 10 0 EFAEHO C[C@@H]1CN(CC(=O)N(Cc2ccccc2)C(C)(C)C)CC[C@H]1C[NH3+] ZINC000923504374 1261801771 /nfs/dbraw/zinc/80/17/71/1261801771.db2.gz RBVBNPQQPJZCDP-AEFFLSMTSA-N 1 3 331.504 2.730 10 0 EFAEHO c1ccc2c(c1)[C@@H](C[C@H]1COCCN1)CN2CCCC1CC[NH2+]CC1 ZINC000923538706 1261871244 /nfs/dbraw/zinc/87/12/44/1261871244.db2.gz APISHTIWKFHQGS-OALUTQOASA-N 1 3 343.515 2.749 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]CC1CCC(F)(F)CC1 ZINC001485922302 1262501566 /nfs/dbraw/zinc/50/15/66/1262501566.db2.gz IWIOBBFUXYSOOO-GJZGRUSLSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001485929924 1262529243 /nfs/dbraw/zinc/52/92/43/1262529243.db2.gz IDYMYDUVIDEGJD-GOEBONIOSA-N 1 3 345.478 2.731 10 0 EFAEHO C[C@H]1C[C@H](NCc2ccccc2F)CN1C(=O)CCCC[NH+](C)C ZINC001486130373 1262663060 /nfs/dbraw/zinc/66/30/60/1262663060.db2.gz RBSRROGHHUTDPX-RDJZCZTQSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1C[C@H](NCc2cc(C)ccc2F)C[C@H]1C ZINC001486132479 1262665466 /nfs/dbraw/zinc/66/54/66/1262665466.db2.gz ULBKAIVDOOGKDH-NVXWUHKLSA-N 1 3 335.467 2.555 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1C[C@H](NCc2cc(C)ccc2F)C[C@H]1C ZINC001486132479 1262665473 /nfs/dbraw/zinc/66/54/73/1262665473.db2.gz ULBKAIVDOOGKDH-NVXWUHKLSA-N 1 3 335.467 2.555 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1C[C@@H](NCc2cc(C)ccc2F)C[C@@H]1C ZINC001486132480 1262665668 /nfs/dbraw/zinc/66/56/68/1262665668.db2.gz ULBKAIVDOOGKDH-RDJZCZTQSA-N 1 3 335.467 2.555 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1C[C@@H](NCc2cc(C)ccc2F)C[C@@H]1C ZINC001486132480 1262665672 /nfs/dbraw/zinc/66/56/72/1262665672.db2.gz ULBKAIVDOOGKDH-RDJZCZTQSA-N 1 3 335.467 2.555 10 0 EFAEHO Cc1ccc(F)c(CN2CC[C@@]3(NC(=O)CC[NH+](C)C)CCC[C@H]23)c1 ZINC001486148842 1262698817 /nfs/dbraw/zinc/69/88/17/1262698817.db2.gz VCRCZSRXJSUREU-ICSRJNTNSA-N 1 3 347.478 2.699 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN3CCC(C)CC3)C[C@H]21 ZINC001486168792 1262731162 /nfs/dbraw/zinc/73/11/62/1262731162.db2.gz ZLQTYPIDXQMSKH-VAMGGRTRSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CC[C@@H](C[NH2+]C/C=C/Cl)C1)N1CCCCC1 ZINC001486200928 1262784928 /nfs/dbraw/zinc/78/49/28/1262784928.db2.gz PEQKFYKJBCNOIE-HKFHSAMXSA-N 1 3 341.927 2.878 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@@H](C[NH2+]CC3=CCCCC3)C2)CCC1 ZINC001486203400 1262788757 /nfs/dbraw/zinc/78/87/57/1262788757.db2.gz XGUSMCZHRBJMLQ-MSOLQXFVSA-N 1 3 333.520 2.846 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@H](NCc2cccnc2)C(C)(C)C1)[NH+](CC)CC ZINC001486243044 1262845849 /nfs/dbraw/zinc/84/58/49/1262845849.db2.gz PSNZWABKJLHDPQ-ROUUACIJSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccccc2)C(C)(C)C1 ZINC001486250758 1262856575 /nfs/dbraw/zinc/85/65/75/1262856575.db2.gz TXXJXFNRCXXWRO-IBGZPJMESA-N 1 3 345.531 2.786 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C[NH2+]CC=C(C)C)[C@H](C(F)(F)F)C1 ZINC001486253163 1262861435 /nfs/dbraw/zinc/86/14/35/1262861435.db2.gz KKFWYCVHUGXGFQ-LSDHHAIUSA-N 1 3 349.441 2.521 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1ccsc1)C(C)(C)C)N(C)C ZINC001486402593 1263049298 /nfs/dbraw/zinc/04/92/98/1263049298.db2.gz HGQIQJKLLGHLIR-CABCVRRESA-N 1 3 325.522 2.709 10 0 EFAEHO COc1cccc(C[NH2+]C[C@H](NC(=O)CN(C)C(C)C)C(C)(C)C)c1 ZINC001486423442 1263074187 /nfs/dbraw/zinc/07/41/87/1263074187.db2.gz HEHBSIZGLWRSSA-SFHVURJKSA-N 1 3 349.519 2.656 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCCC1)C1CC[NH+](CC2CC2)CC1 ZINC001486446122 1263132650 /nfs/dbraw/zinc/13/26/50/1263132650.db2.gz YXJICIBDTZQIIJ-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C)C1)C1CC[NH+](CCCCCF)CC1 ZINC001486448828 1263139527 /nfs/dbraw/zinc/13/95/27/1263139527.db2.gz CLTYMJYFWVCFHW-IRXDYDNUSA-N 1 3 341.515 2.685 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C1CC[NH+](Cc2ccsc2)CC1 ZINC001486441392 1263152384 /nfs/dbraw/zinc/15/23/84/1263152384.db2.gz QDFHRJCYYXVTKR-OAHLLOKOSA-N 1 3 337.533 2.807 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1cncs1)NC(=O)c1cccc(CN(C)C)c1 ZINC001273205308 1263203123 /nfs/dbraw/zinc/20/31/23/1263203123.db2.gz YOIAXBLESWSVHM-AWEZNQCLSA-N 1 3 346.500 2.503 10 0 EFAEHO C[C@H](CC[NH2+]Cc1cncs1)NC(=O)c1cccc(CN(C)C)c1 ZINC001273205309 1263203631 /nfs/dbraw/zinc/20/36/31/1263203631.db2.gz YOIAXBLESWSVHM-CQSZACIVSA-N 1 3 346.500 2.503 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@]2(C)C[N@H+](CC3CC(C)C3)C[C@]2(C)C1 ZINC001410173824 1264169412 /nfs/dbraw/zinc/16/94/12/1264169412.db2.gz DEZVTJXVBYHNND-HCABLIJQSA-N 1 3 335.536 2.545 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@]2(C)C[N@@H+](CC3CC(C)C3)C[C@]2(C)C1 ZINC001410173824 1264169418 /nfs/dbraw/zinc/16/94/18/1264169418.db2.gz DEZVTJXVBYHNND-HCABLIJQSA-N 1 3 335.536 2.545 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2)C1 ZINC001410215296 1264331814 /nfs/dbraw/zinc/33/18/14/1264331814.db2.gz BZVGQJFJGNPFOZ-MPGHIAIKSA-N 1 3 335.467 2.713 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H]2CCCc3ccccc32)C1)N(C)C ZINC001410217070 1264340282 /nfs/dbraw/zinc/34/02/82/1264340282.db2.gz GONJZHBFQCZZIS-QOJCHSLYSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C)CCc2ccccc2F)CC1 ZINC001410255912 1264557910 /nfs/dbraw/zinc/55/79/10/1264557910.db2.gz FMNBSEDJCHVANZ-UHFFFAOYSA-N 1 3 349.494 2.631 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C)CCc2ccccc2F)CC1 ZINC001410255912 1264557921 /nfs/dbraw/zinc/55/79/21/1264557921.db2.gz FMNBSEDJCHVANZ-UHFFFAOYSA-N 1 3 349.494 2.631 10 0 EFAEHO CC1([NH+]2CCC2)CCC(NC(=O)NC[C@H]2CCCCN2C2CC2)CC1 ZINC000922208028 1264920985 /nfs/dbraw/zinc/92/09/85/1264920985.db2.gz XWPOTLHFUZHBIX-KGXSXCIVSA-N 1 3 348.535 2.710 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)[C@@H]2CCC[N@@H+]2C(C)C)c1 ZINC001410378877 1264950029 /nfs/dbraw/zinc/95/00/29/1264950029.db2.gz GAPKTESUDYXKHO-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)[C@@H]2CCC[N@H+]2C(C)C)c1 ZINC001410378877 1264950041 /nfs/dbraw/zinc/95/00/41/1264950041.db2.gz GAPKTESUDYXKHO-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N(C)C[C@@H](C)NCc1ccccc1F ZINC001410385200 1264970927 /nfs/dbraw/zinc/97/09/27/1264970927.db2.gz MNSKKMHLPJSQDF-CRAIPNDOSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N(C)C[C@@H](C)NCc1ccccc1F ZINC001410385200 1264970940 /nfs/dbraw/zinc/97/09/40/1264970940.db2.gz MNSKKMHLPJSQDF-CRAIPNDOSA-N 1 3 335.467 2.635 10 0 EFAEHO CCO[C@@H](C[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1)CN(C)C ZINC000922754668 1266739267 /nfs/dbraw/zinc/73/92/67/1266739267.db2.gz RGFLVDFFGBWMOD-UXHICEINSA-N 1 3 345.531 2.740 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001273121399 1268525027 /nfs/dbraw/zinc/52/50/27/1268525027.db2.gz BKUQETBDSGZADN-CZUORRHYSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001273121400 1268525962 /nfs/dbraw/zinc/52/59/62/1268525962.db2.gz BKUQETBDSGZADN-XJKSGUPXSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001273123327 1268576753 /nfs/dbraw/zinc/57/67/53/1268576753.db2.gz ROIQIVAVDDVXLK-WMLDXEAASA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001273123325 1268577791 /nfs/dbraw/zinc/57/77/91/1268577791.db2.gz ROIQIVAVDDVXLK-PBHICJAKSA-N 1 3 339.911 2.973 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]Cc2cccc(Cl)c2)C[C@H]1C ZINC001410842349 1269748602 /nfs/dbraw/zinc/74/86/02/1269748602.db2.gz FRFPMHFJPKQCNM-PBHICJAKSA-N 1 3 337.895 2.759 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)c(C)s1 ZINC001410857576 1269882444 /nfs/dbraw/zinc/88/24/44/1269882444.db2.gz RATACKMCSTUHDX-CXAGYDPISA-N 1 3 337.533 2.784 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H]2C)c1 ZINC001410876208 1270009778 /nfs/dbraw/zinc/00/97/78/1270009778.db2.gz YHPZABDLNQEIQU-PKOBYXMFSA-N 1 3 331.504 2.723 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001410946040 1270356387 /nfs/dbraw/zinc/35/63/87/1270356387.db2.gz ADTOZLKYEWPFEG-WOJBJXKFSA-N 1 3 345.531 2.964 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@H]([NH2+]C/C=C\c2ccccc2)C(C)(C)C1)N(C)C ZINC001410980655 1270532634 /nfs/dbraw/zinc/53/26/34/1270532634.db2.gz JOOUSBGHFVUOHC-MIZWOLRVSA-N 1 3 343.515 2.867 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]Cc2csc(C)c2)C(C)(C)C1 ZINC001411083307 1270957835 /nfs/dbraw/zinc/95/78/35/1270957835.db2.gz FFKUUULQWBPVNP-INIZCTEOSA-N 1 3 337.533 2.725 10 0 EFAEHO CC(C)[NH2+]C[C@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)(C)C ZINC001411215491 1272024603 /nfs/dbraw/zinc/02/46/03/1272024603.db2.gz HBOXAFQSJQLPQL-KSSFIOAISA-N 1 3 329.504 2.728 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H](NC(=O)CN(C)C(C)C)C(C)(C)C ZINC001411227521 1272070011 /nfs/dbraw/zinc/07/00/11/1272070011.db2.gz WDAAAUMCVRUKDB-GOSISDBHSA-N 1 3 333.520 2.956 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@@H](C)C1)C1CC[NH+](Cc2ccsc2)CC1 ZINC001411231402 1272083363 /nfs/dbraw/zinc/08/33/63/1272083363.db2.gz FNWQBDBFJTZSRH-HZPDHXFCSA-N 1 3 349.544 2.807 10 0 EFAEHO CC[NH+]1CCC(C2(NC(=O)[C@@]3(F)CCN(C(C)(C)C)C3)CC2)CC1 ZINC001411251612 1272140748 /nfs/dbraw/zinc/14/07/48/1272140748.db2.gz LIGZUZBIZWLYLU-GOSISDBHSA-N 1 3 339.499 2.580 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CCC2(CCCC2)CC1 ZINC000820075011 1277034183 /nfs/dbraw/zinc/03/41/83/1277034183.db2.gz QLHHSAZEEICQHI-KRWDZBQOSA-N 1 3 338.540 2.624 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CCC2(CCCC2)CC1 ZINC000820075011 1277034187 /nfs/dbraw/zinc/03/41/87/1277034187.db2.gz QLHHSAZEEICQHI-KRWDZBQOSA-N 1 3 338.540 2.624 10 0 EFAEHO CC(C)[C@@](C)(C[NH3+])NC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000923296348 1277525366 /nfs/dbraw/zinc/52/53/66/1277525366.db2.gz QRZFGSBGWKFNGN-IAQYHMDHSA-N 1 3 335.275 2.696 10 0 EFAEHO COc1ccc([C@@H](C)[NH2+][C@H]2C[C@@H](C(N)=O)C2)cc1CN1CCCCC1 ZINC000846189978 1280065408 /nfs/dbraw/zinc/06/54/08/1280065408.db2.gz NYJPQECROPFBBA-KYJSFNMBSA-N 1 3 345.487 2.596 10 0 EFAEHO CC[C@H]([NH2+]Cc1ccc(CN2CCN(C)CC2)cc1)[C@@H]1CCCOC1 ZINC000872023048 1287403965 /nfs/dbraw/zinc/40/39/65/1287403965.db2.gz BGCYLDQKOCAQQX-RTWAWAEBSA-N 1 3 345.531 2.729 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@@H]2CCCCc3ccccc3C2)CC1 ZINC000872022815 1287404027 /nfs/dbraw/zinc/40/40/27/1287404027.db2.gz LOUDPBWAUFXLPB-OAQYLSRUSA-N 1 3 329.532 2.941 10 0 EFAEHO C[C@@H](NC(=O)CN(C)CCCCCC[NH3+])c1ccccc1Cl ZINC000872154837 1287449561 /nfs/dbraw/zinc/44/95/61/1287449561.db2.gz BWNWVGBTUNJATI-CQSZACIVSA-N 1 3 325.884 2.968 10 0 EFAEHO C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN(C)CCCCCC[NH3+] ZINC000872155711 1287450054 /nfs/dbraw/zinc/45/00/54/1287450054.db2.gz TYMHKOVIOISEPY-CQSZACIVSA-N 1 3 341.446 2.935 10 0 EFAEHO CC1CC[NH+](Cc2cccc(CNC[C@@H](O)CC(C)(C)O)c2)CC1 ZINC000872200056 1287471676 /nfs/dbraw/zinc/47/16/76/1287471676.db2.gz MUYXEODMEWJHPY-IBGZPJMESA-N 1 3 334.504 2.530 10 0 EFAEHO O=C(NCCCCCCC[NH+]1CCCC1)N1CCN2CCC1CC2 ZINC000806904364 1281177036 /nfs/dbraw/zinc/17/70/36/1281177036.db2.gz BATALAYRSNYOQN-UHFFFAOYSA-N 1 3 336.524 2.522 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001671084517 1281347785 /nfs/dbraw/zinc/34/77/85/1281347785.db2.gz BYEQVCFREAKBBV-QYUKCPRWSA-N 1 3 347.547 2.999 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001671084517 1281347794 /nfs/dbraw/zinc/34/77/94/1281347794.db2.gz BYEQVCFREAKBBV-QYUKCPRWSA-N 1 3 347.547 2.999 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@H+](CCCCCF)CC1)N(C)C ZINC001273446158 1281853172 /nfs/dbraw/zinc/85/31/72/1281853172.db2.gz QDAAEUXCSAOOOF-DLBZAZTESA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@@H+](CCCCCF)CC1)N(C)C ZINC001273446158 1281853178 /nfs/dbraw/zinc/85/31/78/1281853178.db2.gz QDAAEUXCSAOOOF-DLBZAZTESA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000810192221 1283025401 /nfs/dbraw/zinc/02/54/01/1283025401.db2.gz DYOAIVHOPRAATN-DNVCBOLYSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000810192221 1283025408 /nfs/dbraw/zinc/02/54/08/1283025408.db2.gz DYOAIVHOPRAATN-DNVCBOLYSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)C1 ZINC000810368000 1283159016 /nfs/dbraw/zinc/15/90/16/1283159016.db2.gz SNUTZAIJHYVPEF-VQIMIIECSA-N 1 3 339.499 2.676 10 0 EFAEHO CC[C@@H]1CCCC[N@@H+]1CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810400538 1283190149 /nfs/dbraw/zinc/19/01/49/1283190149.db2.gz IEQDTYSZHZXAGZ-QAPCUYQASA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@@H]1CCCC[N@H+]1CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810400538 1283190154 /nfs/dbraw/zinc/19/01/54/1283190154.db2.gz IEQDTYSZHZXAGZ-QAPCUYQASA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC000810465054 1283238853 /nfs/dbraw/zinc/23/88/53/1283238853.db2.gz KJHBQNFUPHBCRY-SFHVURJKSA-N 1 3 329.504 2.824 10 0 EFAEHO Cc1cc(F)ccc1[C@@H](C)N[C@@H](CC(C)C)C(=O)NCC[NH+](C)C ZINC000815608954 1287632763 /nfs/dbraw/zinc/63/27/63/1287632763.db2.gz RWMNJMIERUOUSS-QAPCUYQASA-N 1 3 337.483 2.877 10 0 EFAEHO C[C@H](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH+]1CCCCC1 ZINC000811031565 1283967517 /nfs/dbraw/zinc/96/75/17/1283967517.db2.gz SXVBGFUJGDXLER-CRAIPNDOSA-N 1 3 327.488 2.580 10 0 EFAEHO CCN(CCC[NH+](CC)CC)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000811398371 1284284561 /nfs/dbraw/zinc/28/45/61/1284284561.db2.gz BFCMVRSSHVQWKH-GOSISDBHSA-N 1 3 329.504 2.779 10 0 EFAEHO C[NH+]1CCC2(CCCN(C(=O)[C@@]3(F)CCN(C(C)(C)C)C3)C2)CC1 ZINC000813556316 1285974386 /nfs/dbraw/zinc/97/43/86/1285974386.db2.gz FPJZNDXCAMCECC-LJQANCHMSA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@@H]1C[NH2+]C[C@H]1CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1 ZINC000903432804 1312670737 /nfs/dbraw/zinc/67/07/37/1312670737.db2.gz KYXUPGMKBWMVSP-OAGGEKHMSA-N 1 3 348.466 2.515 10 0 EFAEHO Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@@H]3C[NH2+]C[C@H]3C)C2)cc1 ZINC000903432995 1312671250 /nfs/dbraw/zinc/67/12/50/1312671250.db2.gz PWPUTPGBKWGFLC-KURKYZTESA-N 1 3 344.503 2.684 10 0 EFAEHO C[C@@H]1C[NH2+]C[C@H]1CN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 ZINC000903434850 1312674140 /nfs/dbraw/zinc/67/41/40/1312674140.db2.gz LTSXYCZASAGQAZ-KBMXLJTQSA-N 1 3 344.434 2.911 10 0 EFAEHO C[C@H]1CN(C[C@@H]2CC[C@H]([NH3+])C2)CCN1C(=O)Cc1cccc(Cl)c1 ZINC000903440201 1312684262 /nfs/dbraw/zinc/68/42/62/1312684262.db2.gz WFEBRFXVDYUWPA-LESCRADOSA-N 1 3 349.906 2.543 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CCC[C@@H](NC(=O)Cc2nc[nH]c2C)CC1 ZINC001273465825 1289595034 /nfs/dbraw/zinc/59/50/34/1289595034.db2.gz MIYJFWMNFAIXRJ-KEGWNNHHSA-N 1 3 332.492 2.978 10 0 EFAEHO CCC/C=C\CC[N@H+]1CCC[C@@H](NC(=O)Cc2nc[nH]c2C)CC1 ZINC001273465825 1289595042 /nfs/dbraw/zinc/59/50/42/1289595042.db2.gz MIYJFWMNFAIXRJ-KEGWNNHHSA-N 1 3 332.492 2.978 10 0 EFAEHO C[C@H](C(=O)Nc1ccccc1OC(F)F)N1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903496573 1312771844 /nfs/dbraw/zinc/77/18/44/1312771844.db2.gz SWOGUFGRCJGLOA-JHJVBQTASA-N 1 3 341.402 2.532 10 0 EFAEHO C[C@@H]([NH2+]C[C@@H](O)CN1CCCC1)c1ccc(-c2cccnc2)cc1 ZINC000775540805 1292962837 /nfs/dbraw/zinc/96/28/37/1292962837.db2.gz XZDVCYBAJOERPF-OXQOHEQNSA-N 1 3 325.456 2.856 10 0 EFAEHO C[C@@H]([NH2+]C[C@H](O)CN1CCCC1)c1ccc(-c2cccnc2)cc1 ZINC000775540807 1292963551 /nfs/dbraw/zinc/96/35/51/1292963551.db2.gz XZDVCYBAJOERPF-UZLBHIALSA-N 1 3 325.456 2.856 10 0 EFAEHO COC(=O)C1=CC[C@@H]([NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C1 ZINC000886641846 1295084083 /nfs/dbraw/zinc/08/40/83/1295084083.db2.gz UDEBOQKNLCPZTM-NBYUQASBSA-N 1 3 340.467 2.891 10 0 EFAEHO COC(=O)C1=CC[C@@H](N[C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1 ZINC000886641846 1295084095 /nfs/dbraw/zinc/08/40/95/1295084095.db2.gz UDEBOQKNLCPZTM-NBYUQASBSA-N 1 3 340.467 2.891 10 0 EFAEHO COC(=O)C1=CC[C@@H](N[C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1 ZINC000886641846 1295084108 /nfs/dbraw/zinc/08/41/08/1295084108.db2.gz UDEBOQKNLCPZTM-NBYUQASBSA-N 1 3 340.467 2.891 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\C[NH2+][C@H](C)c1ccc(F)cc1)N(C)C ZINC001274104297 1295456288 /nfs/dbraw/zinc/45/62/88/1295456288.db2.gz BJHBPADZPFLHDD-IMBIPOBTSA-N 1 3 335.467 2.735 10 0 EFAEHO CN(CC(=O)NC1CC(C[NH2+]CC2=CCCCC2)C1)CC(C)(C)C ZINC001275284199 1296248831 /nfs/dbraw/zinc/24/88/31/1296248831.db2.gz GNOPUUXMAWMFBU-UHFFFAOYSA-N 1 3 335.536 2.949 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H](C)[NH2+]CCCc1ccccc1 ZINC001275415314 1296275880 /nfs/dbraw/zinc/27/58/80/1296275880.db2.gz OOQSZTDSESMYQZ-IAGOWNOFSA-N 1 3 331.504 2.586 10 0 EFAEHO C[C@@H]([NH2+]CCCc1ccccc1)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001275415318 1296276024 /nfs/dbraw/zinc/27/60/24/1296276024.db2.gz OOQSZTDSESMYQZ-SJORKVTESA-N 1 3 331.504 2.586 10 0 EFAEHO CN(C(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001412684303 1296645692 /nfs/dbraw/zinc/64/56/92/1296645692.db2.gz HLHKDPVHGOOCSR-XUVXKRRUSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@@H]1CN(C(C)(C)C[NH2+][C@@H]2CCNC[C@H]2C2CCCC2)C[C@@H](C)O1 ZINC000925516257 1296847013 /nfs/dbraw/zinc/84/70/13/1296847013.db2.gz RABHEBLPABABQW-ZAWLATJESA-N 1 3 337.552 2.632 10 0 EFAEHO Cc1cccc2nc(CC[NH2+][C@@H]3CCNC[C@H]3C3CCCC3)cn21 ZINC000925713412 1296869851 /nfs/dbraw/zinc/86/98/51/1296869851.db2.gz RYXRVUSPEGLWCJ-RBUKOAKNSA-N 1 3 326.488 2.943 10 0 EFAEHO Cc1cccc2nc(CCN[C@@H]3CC[NH2+]C[C@H]3C3CCCC3)cn21 ZINC000925713412 1296869866 /nfs/dbraw/zinc/86/98/66/1296869866.db2.gz RYXRVUSPEGLWCJ-RBUKOAKNSA-N 1 3 326.488 2.943 10 0 EFAEHO C[C@@H]([NH2+]CC[S@@](=O)CC(F)(F)F)c1cccc(CN(C)C)c1 ZINC000926684090 1296948189 /nfs/dbraw/zinc/94/81/89/1296948189.db2.gz RNPIASDASHRJJY-VERVWZFWSA-N 1 3 336.423 2.710 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@H]1C[NH2+][C@H]1CCOC12CCOCC2 ZINC000926776436 1296959149 /nfs/dbraw/zinc/95/91/49/1296959149.db2.gz AONYWCVWMMMGCV-RLLQIKCJSA-N 1 3 344.499 2.682 10 0 EFAEHO Cc1noc([C@H]2OCC[C@H]2N[C@H](C)c2cccc(C[NH+](C)C)c2)n1 ZINC000926776264 1296959800 /nfs/dbraw/zinc/95/98/00/1296959800.db2.gz JYONTVPKHQJTOZ-JLZZUVOBSA-N 1 3 330.432 2.620 10 0 EFAEHO Cc1cc(CC[NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)nn1C ZINC000926908289 1296974383 /nfs/dbraw/zinc/97/43/83/1296974383.db2.gz BYJVJECTCDBNLB-JBACZVJFSA-N 1 3 338.499 2.914 10 0 EFAEHO Cc1cc(CCN[C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)nn1C ZINC000926908289 1296974389 /nfs/dbraw/zinc/97/43/89/1296974389.db2.gz BYJVJECTCDBNLB-JBACZVJFSA-N 1 3 338.499 2.914 10 0 EFAEHO Cc1cc(CCN[C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)nn1C ZINC000926908289 1296974402 /nfs/dbraw/zinc/97/44/02/1296974402.db2.gz BYJVJECTCDBNLB-JBACZVJFSA-N 1 3 338.499 2.914 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@@H]1C[NH2+]CCCCc1ccccc1 ZINC001277948466 1313334275 /nfs/dbraw/zinc/33/42/75/1313334275.db2.gz SXJAATLYAFJKPE-LJQANCHMSA-N 1 3 340.471 2.556 10 0 EFAEHO COc1ccccc1[C@H]1CCCN1C[C@H](C[NH3+])Cc1cnn(C)c1C ZINC000903892066 1313362643 /nfs/dbraw/zinc/36/26/43/1313362643.db2.gz PHGKSMYGMIDQLX-QFBILLFUSA-N 1 3 342.487 2.692 10 0 EFAEHO CC[C@@H]1c2ccccc2CCN1C[C@H](C[NH3+])Cc1cnn(C)c1C ZINC000903893239 1313364291 /nfs/dbraw/zinc/36/42/91/1313364291.db2.gz SUNMDKOCYKWKFQ-OXJNMPFZSA-N 1 3 326.488 2.855 10 0 EFAEHO CC[C@H](Cc1ccccc1)N(C)Cc1cnnn1[C@@H]1CCC[NH2+]C1 ZINC000903894860 1313368343 /nfs/dbraw/zinc/36/83/43/1313368343.db2.gz GLBXZICUFDGTOQ-QZTJIDSGSA-N 1 3 327.476 2.656 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+]2CCC[C@@H]2Cc2ccc(C)cc2)cnn1C ZINC000903891304 1313361631 /nfs/dbraw/zinc/36/16/31/1313361631.db2.gz LJMXJSMQGHCODN-PZJWPPBQSA-N 1 3 340.515 2.861 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+]2CCC[C@@H]2Cc2ccc(C)cc2)cnn1C ZINC000903891304 1313361635 /nfs/dbraw/zinc/36/16/35/1313361635.db2.gz LJMXJSMQGHCODN-PZJWPPBQSA-N 1 3 340.515 2.861 10 0 EFAEHO CC[C@@H](Cc1ccc(C)cc1)N(C)Cc1cnnn1[C@@H]1CCC[NH2+]C1 ZINC000903898499 1313375772 /nfs/dbraw/zinc/37/57/72/1313375772.db2.gz NYZJPMRRSMBQRN-RBUKOAKNSA-N 1 3 341.503 2.964 10 0 EFAEHO CN1C[C@@H]2C[N@H+](CCOc3ccccc3C(F)(F)F)C[C@]2(C)C1 ZINC000933742704 1297509973 /nfs/dbraw/zinc/50/99/73/1297509973.db2.gz QUSMQSHIUHIOBR-CJNGLKHVSA-N 1 3 328.378 2.968 10 0 EFAEHO CN1C[C@@H]2C[N@@H+](CCOc3ccccc3C(F)(F)F)C[C@]2(C)C1 ZINC000933742704 1297509979 /nfs/dbraw/zinc/50/99/79/1297509979.db2.gz QUSMQSHIUHIOBR-CJNGLKHVSA-N 1 3 328.378 2.968 10 0 EFAEHO COC(=O)c1nc([C@H]2CCCN2CC2C[C@H]3CC[C@@H](C2)[NH2+]3)sc1C ZINC000903915156 1313407006 /nfs/dbraw/zinc/40/70/06/1313407006.db2.gz NLKZRDGDMBCXRV-JALIKCBVSA-N 1 3 349.500 2.906 10 0 EFAEHO C[C@@H](c1ccccc1)N(C)C(=O)CN(C)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903915835 1313408591 /nfs/dbraw/zinc/40/85/91/1313408591.db2.gz CEWBTNZCYXEUPR-WELJNPPOSA-N 1 3 329.488 2.668 10 0 EFAEHO Cc1c(C[C@@H](CN)C[NH2+]CCc2csc3ccccc23)cnn1C ZINC000903924714 1313425840 /nfs/dbraw/zinc/42/58/40/1313425840.db2.gz HWMOWBGJXVEEJP-HNNXBMFYSA-N 1 3 342.512 2.893 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN2CCc3ccc(F)cc3[C@H](C)C2)cnn1C ZINC000903931627 1313437572 /nfs/dbraw/zinc/43/75/72/1313437572.db2.gz GOIJUWQTPCYMIK-GDBMZVCRSA-N 1 3 344.478 2.647 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN[C@]2(c3ccccc3)CC2(C)C)cnn1C ZINC000903933459 1313441734 /nfs/dbraw/zinc/44/17/34/1313441734.db2.gz RRMHQJHDPFADIU-JXFKEZNVSA-N 1 3 326.488 2.761 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CCCC[NH+](C)C)CCN1Cc1ccc(CF)cc1 ZINC001489304329 1298167565 /nfs/dbraw/zinc/16/75/65/1298167565.db2.gz RYFYBKVRVCKZQU-APWZRJJASA-N 1 3 349.494 2.967 10 0 EFAEHO FC(F)(F)COc1cccc(C[NH2+]C[C@@H]2CNCCC2(F)F)c1 ZINC000903954286 1313478615 /nfs/dbraw/zinc/47/86/15/1313478615.db2.gz CMAACFHLZCCEMS-LBPRGKRZSA-N 1 3 338.320 2.962 10 0 EFAEHO Fc1cccc(F)c1-c1n[nH]cc1C[NH2+]C[C@@H]1CNCCC1(F)F ZINC000903954824 1313480135 /nfs/dbraw/zinc/48/01/35/1313480135.db2.gz GVTNBBPHCRWDEZ-NSHDSACASA-N 1 3 342.340 2.689 10 0 EFAEHO COCC[C@@H](Cc1cccc(F)c1)NC[C@H]1C[NH2+]CCC1(F)F ZINC000903956149 1313484499 /nfs/dbraw/zinc/48/44/99/1313484499.db2.gz HZMKFUIODBLVSQ-ZBFHGGJFSA-N 1 3 330.394 2.608 10 0 EFAEHO C[C@H](CC(=O)Nc1cccc(C(F)(F)F)c1)NC[C@@H]1C[NH2+]C[C@H]1C ZINC000903967752 1313510596 /nfs/dbraw/zinc/51/05/96/1313510596.db2.gz NICNDYBPYVWHMF-UPJWGTAASA-N 1 3 343.393 2.868 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@H+](C)Cc1ccc2c(c1)CCC2)N(C)C ZINC001490244139 1298667715 /nfs/dbraw/zinc/66/77/15/1298667715.db2.gz NWSRRQYCLKJBIU-HXUWFJFHSA-N 1 3 345.531 2.700 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@@H+](C)Cc1ccc2c(c1)CCC2)N(C)C ZINC001490244139 1298667729 /nfs/dbraw/zinc/66/77/29/1298667729.db2.gz NWSRRQYCLKJBIU-HXUWFJFHSA-N 1 3 345.531 2.700 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@H+](C)CCCNC(=O)CN1CC[C@H](C)C1 ZINC001490250615 1298680014 /nfs/dbraw/zinc/68/00/14/1298680014.db2.gz NAWJLGNCLAXBOV-WMZOPIPTSA-N 1 3 331.504 2.836 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@@H+](C)CCCNC(=O)CN1CC[C@H](C)C1 ZINC001490250615 1298680024 /nfs/dbraw/zinc/68/00/24/1298680024.db2.gz NAWJLGNCLAXBOV-WMZOPIPTSA-N 1 3 331.504 2.836 10 0 EFAEHO Cc1ncccc1CN(C)CCCNC(=O)[C@@H]1CCCC[N@H+]1C(C)C ZINC001490256693 1298687970 /nfs/dbraw/zinc/68/79/70/1298687970.db2.gz UFRZFZBTKFGBJA-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1ncccc1CN(C)CCCNC(=O)[C@@H]1CCCC[N@@H+]1C(C)C ZINC001490256693 1298687973 /nfs/dbraw/zinc/68/79/73/1298687973.db2.gz UFRZFZBTKFGBJA-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO CCCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC[NH+](CC)CC1 ZINC001490618948 1299049129 /nfs/dbraw/zinc/04/91/29/1299049129.db2.gz RULNWZPQFYVELB-IBGZPJMESA-N 1 3 341.515 2.922 10 0 EFAEHO CCCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC[NH+](CC)CC1 ZINC001490618949 1299049684 /nfs/dbraw/zinc/04/96/84/1299049684.db2.gz RULNWZPQFYVELB-LJQANCHMSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1ccccc1C)C1CC1 ZINC001490670683 1299070645 /nfs/dbraw/zinc/07/06/45/1299070645.db2.gz FLDZGKQVMBNBHR-VQTJNVASSA-N 1 3 343.515 2.854 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]([NH2+]CC1=CCCCC1)C1CC1 ZINC001490660092 1299101152 /nfs/dbraw/zinc/10/11/52/1299101152.db2.gz DSPKELFMPQJZOW-OALUTQOASA-N 1 3 333.520 2.844 10 0 EFAEHO Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)CCCC[NH+](C)C ZINC000854513559 1300603806 /nfs/dbraw/zinc/60/38/06/1300603806.db2.gz ONUSTOAHBZNNAW-IEBWSBKVSA-N 1 3 329.488 2.861 10 0 EFAEHO CC(C)Cc1ccccc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000855347193 1300924599 /nfs/dbraw/zinc/92/45/99/1300924599.db2.gz XTZZTBIYODFPLC-KRWDZBQOSA-N 1 3 333.520 2.887 10 0 EFAEHO CC(C)Cc1ccccc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000855347193 1300924601 /nfs/dbraw/zinc/92/46/01/1300924601.db2.gz XTZZTBIYODFPLC-KRWDZBQOSA-N 1 3 333.520 2.887 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N[C@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC000855814800 1301129617 /nfs/dbraw/zinc/12/96/17/1301129617.db2.gz LBHCNWQOQVGSTD-HNAYVOBHSA-N 1 3 339.499 2.722 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N[C@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC000855814800 1301129627 /nfs/dbraw/zinc/12/96/27/1301129627.db2.gz LBHCNWQOQVGSTD-HNAYVOBHSA-N 1 3 339.499 2.722 10 0 EFAEHO CN1CCCC[C@@H](C[NH2+]CC2(CNC(=O)OC(C)(C)C)CC2)C1 ZINC000862483144 1302397364 /nfs/dbraw/zinc/39/73/64/1302397364.db2.gz PFAOYTXVBSLBLB-HNNXBMFYSA-N 1 3 325.497 2.613 10 0 EFAEHO CCOC(=O)C(F)(F)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCNC23CCC3)C1 ZINC000863482488 1302628324 /nfs/dbraw/zinc/62/83/24/1302628324.db2.gz IPMVXKMJBPTGEH-MGPQQGTHSA-N 1 3 330.419 2.618 10 0 EFAEHO CN(Cc1ccccc1)CC(C)(C)C[NH2+][C@H]1CCN(CC(C)(C)O)C1 ZINC000865660389 1303356295 /nfs/dbraw/zinc/35/62/95/1303356295.db2.gz ZDZSBZNNDLAMBQ-IBGZPJMESA-N 1 3 347.547 2.579 10 0 EFAEHO Cc1ccc(CN2CCO[C@@H](CN[C@@H]3CC[N@@H+](C)C(C)(C)C3)C2)cc1 ZINC000865800562 1303406402 /nfs/dbraw/zinc/40/64/02/1303406402.db2.gz PCKWONYIKHVIIM-UXHICEINSA-N 1 3 345.531 2.658 10 0 EFAEHO Cc1ccc(CN2CCO[C@@H](CN[C@@H]3CC[N@H+](C)C(C)(C)C3)C2)cc1 ZINC000865800562 1303406407 /nfs/dbraw/zinc/40/64/07/1303406407.db2.gz PCKWONYIKHVIIM-UXHICEINSA-N 1 3 345.531 2.658 10 0 EFAEHO C([NH2+]C1CCN([C@@H]2CCOC2)CC1)[C@@H]1CCN1C1CCCCCC1 ZINC000866562920 1303689245 /nfs/dbraw/zinc/68/92/45/1303689245.db2.gz WYSQPXXNDOCLGJ-VQTJNVASSA-N 1 3 335.536 2.626 10 0 EFAEHO C[C@@H]1C[C@H](N[C@H]2COc3cccc(Br)c3C2)CC[N@@H+]1C ZINC000866594576 1303702626 /nfs/dbraw/zinc/70/26/26/1303702626.db2.gz IAUBFUIZMAIJKW-JHJVBQTASA-N 1 3 339.277 2.825 10 0 EFAEHO C[C@@H]1C[C@H](N[C@H]2COc3cccc(Br)c3C2)CC[N@H+]1C ZINC000866594576 1303702631 /nfs/dbraw/zinc/70/26/31/1303702631.db2.gz IAUBFUIZMAIJKW-JHJVBQTASA-N 1 3 339.277 2.825 10 0 EFAEHO CC(C)[NH+]1CCC(N[C@H]2C[C@H](C(=O)OCc3ccccc3)C2)CC1 ZINC000866604086 1303706749 /nfs/dbraw/zinc/70/67/49/1303706749.db2.gz IEYMWEMPZREBFT-UAPYVXQJSA-N 1 3 330.472 2.971 10 0 EFAEHO CC[N@@H+]1CC[C@H](N[C@H]2C[C@H](C(=O)OCc3ccccc3)C2)[C@H](C)C1 ZINC000866603667 1303707317 /nfs/dbraw/zinc/70/73/17/1303707317.db2.gz DJVVIAVNXLNVMI-OWYHZJEWSA-N 1 3 330.472 2.828 10 0 EFAEHO CC[N@H+]1CC[C@H](N[C@H]2C[C@H](C(=O)OCc3ccccc3)C2)[C@H](C)C1 ZINC000866603667 1303707325 /nfs/dbraw/zinc/70/73/25/1303707325.db2.gz DJVVIAVNXLNVMI-OWYHZJEWSA-N 1 3 330.472 2.828 10 0 EFAEHO CC(C)(C)[C@]1(CN)CC[N@H+](CCC(=O)Nc2cc(F)cc(F)c2)C1 ZINC000866705937 1303759905 /nfs/dbraw/zinc/75/99/05/1303759905.db2.gz KBIPFHPCWMLIHB-SFHVURJKSA-N 1 3 339.430 2.990 10 0 EFAEHO CC(C)(C)[C@]1(CN)CC[N@@H+](CCC(=O)Nc2cc(F)cc(F)c2)C1 ZINC000866705937 1303759908 /nfs/dbraw/zinc/75/99/08/1303759908.db2.gz KBIPFHPCWMLIHB-SFHVURJKSA-N 1 3 339.430 2.990 10 0 EFAEHO CC(C)(C)[C@@]1(CN)CC[N@H+](CCC(=O)N2CCc3sccc3C2)C1 ZINC000866706135 1303760144 /nfs/dbraw/zinc/76/01/44/1303760144.db2.gz MRJFWFHUCCAZOF-LJQANCHMSA-N 1 3 349.544 2.720 10 0 EFAEHO CC(C)(C)[C@@]1(CN)CC[N@@H+](CCC(=O)N2CCc3sccc3C2)C1 ZINC000866706135 1303760153 /nfs/dbraw/zinc/76/01/53/1303760153.db2.gz MRJFWFHUCCAZOF-LJQANCHMSA-N 1 3 349.544 2.720 10 0 EFAEHO O=C(NC[C@H]1CCCCN1Cc1ccccc1)[C@@H]1C[C@@]12CCC[NH2+]C2 ZINC000867997115 1304066806 /nfs/dbraw/zinc/06/68/06/1304066806.db2.gz BKTCDBTZSAVZSQ-SVFBPWRDSA-N 1 3 341.499 2.547 10 0 EFAEHO CCC(C)(C)N1CCN(C(=O)NC2CCC(C)([NH+](C)C)CC2)CC1 ZINC000869010882 1304577111 /nfs/dbraw/zinc/57/71/11/1304577111.db2.gz JCRCMQCMNDSHLQ-UHFFFAOYSA-N 1 3 338.540 2.765 10 0 EFAEHO O=C(CCC12CC(C1)C[NH2+]2)N[C@@H](CN1CCCCC1)c1ccccc1 ZINC000870918622 1305682221 /nfs/dbraw/zinc/68/22/21/1305682221.db2.gz LFWYWMULNWFXIV-BIXGBWIQSA-N 1 3 341.499 2.862 10 0 EFAEHO CC(C)CC[NH2+]C[C@@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001276655345 1314195909 /nfs/dbraw/zinc/19/59/09/1314195909.db2.gz AKUPPYCMTKERHI-VQIMIIECSA-N 1 3 341.515 2.729 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+]CCC(C)(C)C)C1CC1)CC(C)(C)C ZINC001276657059 1314198875 /nfs/dbraw/zinc/19/88/75/1314198875.db2.gz URWSDWWMRIZRNO-MRXNPFEDSA-N 1 3 325.541 2.885 10 0 EFAEHO O=C(NCCCN1CCc2ccccc2C1)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC000900160290 1307727642 /nfs/dbraw/zinc/72/76/42/1307727642.db2.gz UACXJEPQHCDHSE-UXHICEINSA-N 1 3 341.499 2.568 10 0 EFAEHO O=C(NCCCN1CCc2ccccc2C1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC000900160290 1307727647 /nfs/dbraw/zinc/72/76/47/1307727647.db2.gz UACXJEPQHCDHSE-UXHICEINSA-N 1 3 341.499 2.568 10 0 EFAEHO CCCCCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)[C@@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001276669732 1314234435 /nfs/dbraw/zinc/23/44/35/1314234435.db2.gz JNKCGBAIJBWMDM-OKYOBFRVSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCCCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)[C@@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001276669732 1314234438 /nfs/dbraw/zinc/23/44/38/1314234438.db2.gz JNKCGBAIJBWMDM-OKYOBFRVSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H](F)CC1CCCCC1 ZINC001413265863 1309157735 /nfs/dbraw/zinc/15/77/35/1309157735.db2.gz DJXDKCRRKSCEEK-RDJZCZTQSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H](F)CC1CCCCC1 ZINC001413265863 1309157741 /nfs/dbraw/zinc/15/77/41/1309157741.db2.gz DJXDKCRRKSCEEK-RDJZCZTQSA-N 1 3 329.504 2.683 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@H]2C[C@@H](C)Cc3cc(OC)ccc32)CC1 ZINC000902745215 1312070875 /nfs/dbraw/zinc/07/08/75/1312070875.db2.gz LWLHOZJKEUPNSC-UWJYYQICSA-N 1 3 345.531 2.936 10 0 EFAEHO O[C@H](C[NH2+][C@H](CCc1ccccc1)c1cccnc1)CN1CCCC1 ZINC000902762229 1312085036 /nfs/dbraw/zinc/08/50/36/1312085036.db2.gz JCOXNPZQABIIFQ-NHCUHLMSSA-N 1 3 339.483 2.802 10 0 EFAEHO CCC/C=C/CC[N@H+](C)C1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001277429073 1312155152 /nfs/dbraw/zinc/15/51/52/1312155152.db2.gz HQXGPDVOHZWRNU-IPLHWJFFSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[N@@H+](C)C1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001277429073 1312155155 /nfs/dbraw/zinc/15/51/55/1312155155.db2.gz HQXGPDVOHZWRNU-IPLHWJFFSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@H]([NH2+]CCN1CCN(C)C(C)(C)C1)c1cccc(-n2ccnc2)c1 ZINC000902981404 1312258969 /nfs/dbraw/zinc/25/89/69/1312258969.db2.gz NNWQTVOBXCTVNU-KRWDZBQOSA-N 1 3 341.503 2.549 10 0 EFAEHO C1CCC([NH+]2CCC(N[C@H]3CCCN4CCSC[C@H]34)CC2)CC1 ZINC000903272576 1312527843 /nfs/dbraw/zinc/52/78/43/1312527843.db2.gz WMLNLEDOMITZQK-RBUKOAKNSA-N 1 3 337.577 2.953 10 0 EFAEHO CCCN(CC(=O)Nc1ccc(F)c(F)c1F)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903427055 1312662204 /nfs/dbraw/zinc/66/22/04/1312662204.db2.gz RSUFFOMZIOASEB-NEPJUHHUSA-N 1 3 343.393 2.882 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001318374263 1328567175 /nfs/dbraw/zinc/56/71/75/1328567175.db2.gz OCNHKSROQVPIRN-SFFCAUCYSA-N 1 3 329.488 2.909 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001318374263 1328567180 /nfs/dbraw/zinc/56/71/80/1328567180.db2.gz OCNHKSROQVPIRN-SFFCAUCYSA-N 1 3 329.488 2.909 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001278571966 1315213943 /nfs/dbraw/zinc/21/39/43/1315213943.db2.gz KGYZGPDOAVJRIZ-WYUKIMKNSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001278571960 1315214172 /nfs/dbraw/zinc/21/41/72/1315214172.db2.gz KGYZGPDOAVJRIZ-FVXBGVJYSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H](C)[C@H]2CCC[NH2+]CCCF)C1 ZINC001264019892 1316581411 /nfs/dbraw/zinc/58/14/11/1316581411.db2.gz MRTCDMDKKBQQSR-RCCFBDPRSA-N 1 3 341.515 2.685 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)[C@@H](C(C)C)N(C)C)C[C@@H]2C1 ZINC001264096354 1316588790 /nfs/dbraw/zinc/58/87/90/1316588790.db2.gz KDLYLFPAMRFRHB-XCLUONLBSA-N 1 3 335.536 2.709 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)[C@@H](C(C)C)N(C)C)C[C@@H]2C1 ZINC001264096354 1316588792 /nfs/dbraw/zinc/58/87/92/1316588792.db2.gz KDLYLFPAMRFRHB-XCLUONLBSA-N 1 3 335.536 2.709 10 0 EFAEHO CC/C=C/CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCC[N@@H+](CCC)C1 ZINC001264368509 1316606572 /nfs/dbraw/zinc/60/65/72/1316606572.db2.gz GSYCODHNCDKHEV-HMTUNPETSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCC[N@H+](CCC)C1 ZINC001264368509 1316606577 /nfs/dbraw/zinc/60/65/77/1316606577.db2.gz GSYCODHNCDKHEV-HMTUNPETSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C[C@@H]1C)CC[NH+](CC=C(C)C)CC2 ZINC001264496911 1316620967 /nfs/dbraw/zinc/62/09/67/1316620967.db2.gz FTPZPFOCCVBSMJ-SFHVURJKSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](C)C[C@H]2C[NH2+]CCC(C)(C)C)C1 ZINC001264559444 1316631671 /nfs/dbraw/zinc/63/16/71/1316631671.db2.gz FEACMOMCOLPCNL-SQNIBIBYSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@@H]1CCC[NH2+]C/C=C\Cl ZINC001264578109 1316634248 /nfs/dbraw/zinc/63/42/48/1316634248.db2.gz RKGDVVVUOMCDDS-TZPOZWHTSA-N 1 3 338.883 2.702 10 0 EFAEHO CC[N@H+](CCCNC(=O)[C@H]1CCCN1C)Cc1ccc(Cl)s1 ZINC001265127957 1316729054 /nfs/dbraw/zinc/72/90/54/1316729054.db2.gz LJKVENCULPCURG-CQSZACIVSA-N 1 3 343.924 2.824 10 0 EFAEHO CC[N@@H+](CCCNC(=O)[C@H]1CCCN1C)Cc1ccc(Cl)s1 ZINC001265127957 1316729056 /nfs/dbraw/zinc/72/90/56/1316729056.db2.gz LJKVENCULPCURG-CQSZACIVSA-N 1 3 343.924 2.824 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)C[C@H]1CCC(F)(F)C1 ZINC001265133994 1316731782 /nfs/dbraw/zinc/73/17/82/1316731782.db2.gz FPSKANOPTGCQGR-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)C[C@H]1CCC(F)(F)C1 ZINC001265133994 1316731783 /nfs/dbraw/zinc/73/17/83/1316731783.db2.gz FPSKANOPTGCQGR-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)C1CC[NH+](C(C)C)CC1 ZINC001265141305 1316735720 /nfs/dbraw/zinc/73/57/20/1316735720.db2.gz QKRCYRKQGORIQH-WEVVVXLNSA-N 1 3 329.916 2.688 10 0 EFAEHO C[C@@H](c1ccccc1F)[N@H+](CCCNC(=O)[C@H]1CCCN1C)C1CC1 ZINC001265155801 1316741796 /nfs/dbraw/zinc/74/17/96/1316741796.db2.gz DZJDHISIUIGSNP-HNAYVOBHSA-N 1 3 347.478 2.952 10 0 EFAEHO C[C@@H](c1ccccc1F)[N@@H+](CCCNC(=O)[C@H]1CCCN1C)C1CC1 ZINC001265155801 1316741797 /nfs/dbraw/zinc/74/17/97/1316741797.db2.gz DZJDHISIUIGSNP-HNAYVOBHSA-N 1 3 347.478 2.952 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NCCCN(CCC(F)(F)F)C1CC1 ZINC001265183706 1316746364 /nfs/dbraw/zinc/74/63/64/1316746364.db2.gz CQDGXFOCKRWIFB-OKILXGFUSA-N 1 3 349.441 2.782 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCCCN(CCC(F)(F)F)C1CC1 ZINC001265183706 1316746366 /nfs/dbraw/zinc/74/63/66/1316746366.db2.gz CQDGXFOCKRWIFB-OKILXGFUSA-N 1 3 349.441 2.782 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCN(CCCCCF)C1)[NH+]1CCCCC1 ZINC001265320092 1316780718 /nfs/dbraw/zinc/78/07/18/1316780718.db2.gz XSGZVWOHXGYESI-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CCCCCF)C1)N1CCCCC1 ZINC001265320092 1316780720 /nfs/dbraw/zinc/78/07/20/1316780720.db2.gz XSGZVWOHXGYESI-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CCCCCF)C1)N1CCCCC1 ZINC001265320092 1316780722 /nfs/dbraw/zinc/78/07/22/1316780722.db2.gz XSGZVWOHXGYESI-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CC1=CCCCC1)C1CC1 ZINC001265358555 1316789470 /nfs/dbraw/zinc/78/94/70/1316789470.db2.gz LORSFFGKKBZVIU-RTBURBONSA-N 1 3 333.520 2.846 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H](C[NH2+]CCCC(C)(C)C)C2)C1 ZINC001265623784 1316837230 /nfs/dbraw/zinc/83/72/30/1316837230.db2.gz DTUWOTAYRFNFPZ-MSOLQXFVSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]CCCc1cccc(F)c1 ZINC001265774827 1316875601 /nfs/dbraw/zinc/87/56/01/1316875601.db2.gz JZIORPOMFOYHRQ-APWZRJJASA-N 1 3 349.494 2.725 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@@H+](C)CC1CCC(C)CC1)N(C)C ZINC001265919873 1316913854 /nfs/dbraw/zinc/91/38/54/1316913854.db2.gz XXWKCYCUZCEVDU-DAWZGUTISA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@H+](C)CC1CCC(C)CC1)N(C)C ZINC001265919873 1316913852 /nfs/dbraw/zinc/91/38/52/1316913852.db2.gz XXWKCYCUZCEVDU-DAWZGUTISA-N 1 3 325.541 2.837 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001265923825 1316915339 /nfs/dbraw/zinc/91/53/39/1316915339.db2.gz WYNZXCHHFVTZJP-DLBZAZTESA-N 1 3 347.503 2.536 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001265923825 1316915341 /nfs/dbraw/zinc/91/53/41/1316915341.db2.gz WYNZXCHHFVTZJP-DLBZAZTESA-N 1 3 347.503 2.536 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001265954151 1316926890 /nfs/dbraw/zinc/92/68/90/1316926890.db2.gz KYHBCOPOBGCHQT-GJZGRUSLSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001265954151 1316926893 /nfs/dbraw/zinc/92/68/93/1316926893.db2.gz KYHBCOPOBGCHQT-GJZGRUSLSA-N 1 3 333.467 2.590 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001266029620 1316961255 /nfs/dbraw/zinc/96/12/55/1316961255.db2.gz UVYWRWQWXAQWJW-RHYMJRRZSA-N 1 3 343.515 2.724 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC2=CC[N@H+](CCC3CCCC3)CC2)C1 ZINC001279636539 1317340094 /nfs/dbraw/zinc/34/00/94/1317340094.db2.gz OKCNTYRHDFNXAC-QGZVFWFLSA-N 1 3 333.520 2.657 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC2=CC[N@@H+](CCC3CCCC3)CC2)C1 ZINC001279636539 1317340104 /nfs/dbraw/zinc/34/01/04/1317340104.db2.gz OKCNTYRHDFNXAC-QGZVFWFLSA-N 1 3 333.520 2.657 10 0 EFAEHO CC(C)C[N@H+]1CC=C(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001279635925 1317340759 /nfs/dbraw/zinc/34/07/59/1317340759.db2.gz FEIFKRXUFMBZSF-IBGZPJMESA-N 1 3 339.499 2.603 10 0 EFAEHO CC(C)C[N@@H+]1CC=C(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001279635925 1317340768 /nfs/dbraw/zinc/34/07/68/1317340768.db2.gz FEIFKRXUFMBZSF-IBGZPJMESA-N 1 3 339.499 2.603 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC2=CC[N@H+](CCC3CCCC3)CC2)C1 ZINC001279636538 1317341034 /nfs/dbraw/zinc/34/10/34/1317341034.db2.gz OKCNTYRHDFNXAC-KRWDZBQOSA-N 1 3 333.520 2.657 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC2=CC[N@@H+](CCC3CCCC3)CC2)C1 ZINC001279636538 1317341043 /nfs/dbraw/zinc/34/10/43/1317341043.db2.gz OKCNTYRHDFNXAC-KRWDZBQOSA-N 1 3 333.520 2.657 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1CC=C(CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001279637585 1317342374 /nfs/dbraw/zinc/34/23/74/1317342374.db2.gz ZCGVSOFYYGRQBG-MSOLQXFVSA-N 1 3 335.536 2.759 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1CC=C(CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001279637585 1317342383 /nfs/dbraw/zinc/34/23/83/1317342383.db2.gz ZCGVSOFYYGRQBG-MSOLQXFVSA-N 1 3 335.536 2.759 10 0 EFAEHO CCc1ccccc1C[N@H+]1CC=C(CNC(=O)[C@@H](CC)N(C)C)CC1 ZINC001279676036 1317356206 /nfs/dbraw/zinc/35/62/06/1317356206.db2.gz UDIWWDNTDFYYIF-HXUWFJFHSA-N 1 3 343.515 2.838 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CC=C(CNC(=O)[C@@H](CC)N(C)C)CC1 ZINC001279676036 1317356214 /nfs/dbraw/zinc/35/62/14/1317356214.db2.gz UDIWWDNTDFYYIF-HXUWFJFHSA-N 1 3 343.515 2.838 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@@H](CC[NH2+]CC=C(Cl)Cl)C1 ZINC001318777745 1328696749 /nfs/dbraw/zinc/69/67/49/1328696749.db2.gz CNWCRDYPUONKAT-UONOGXRCSA-N 1 3 348.318 2.618 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H]2CCN(C(=O)CN(C)C3CCC3)C2)cs1 ZINC001280073758 1317447683 /nfs/dbraw/zinc/44/76/83/1317447683.db2.gz QHAIMAXFRYZIOV-MRXNPFEDSA-N 1 3 349.544 2.869 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001280184003 1317471391 /nfs/dbraw/zinc/47/13/91/1317471391.db2.gz CNLFDVCKQKENTD-WOJBJXKFSA-N 1 3 345.531 2.909 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@@H]1CCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001280198670 1317473957 /nfs/dbraw/zinc/47/39/57/1317473957.db2.gz VIFDKFMKTMDBNK-IEBWSBKVSA-N 1 3 343.515 2.665 10 0 EFAEHO CN(C[C@H]1CCN1C[C@H]1CCC(F)(F)C1)C(=O)CCCC[NH+](C)C ZINC001316602580 1317498186 /nfs/dbraw/zinc/49/81/86/1317498186.db2.gz ANDTXBPMFPHZCA-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@H](CC[NH2+]CC3CC3)C2)c1 ZINC001280308896 1317504333 /nfs/dbraw/zinc/50/43/33/1317504333.db2.gz WLSPPROJKXIJOQ-KRWDZBQOSA-N 1 3 329.488 2.600 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H](CC[NH2+]Cc2ccccc2)C1)C1CCC1 ZINC001318805287 1328706331 /nfs/dbraw/zinc/70/63/31/1328706331.db2.gz NWPWXZFXGRRYNE-IBGZPJMESA-N 1 3 343.515 2.889 10 0 EFAEHO CCC/C=C/CCN1CC[C@H]1CN(C)C(=O)CC1CC[NH+](C)CC1 ZINC001316605460 1317714050 /nfs/dbraw/zinc/71/40/50/1317714050.db2.gz XRXCZVJAMIIXMT-GHOSXJJBSA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1cccc(C[NH2+]CCC2CCN(C(=O)[C@@H]3CCCN3C)CC2)c1 ZINC001318875024 1328729643 /nfs/dbraw/zinc/72/96/43/1328729643.db2.gz OTTQPRSWWGSWKA-FQEVSTJZSA-N 1 3 343.515 2.808 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC(CC[NH2+]CC[C@@H](C)F)CC1)N(C)C ZINC001318895420 1328734751 /nfs/dbraw/zinc/73/47/51/1328734751.db2.gz HAEFCSWKOZAPRB-WBVHZDCISA-N 1 3 329.504 2.539 10 0 EFAEHO C[C@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@H]1[NH2+]CCCCC(F)(F)F ZINC001281409024 1318274702 /nfs/dbraw/zinc/27/47/02/1318274702.db2.gz SAEPOEPHGGSKIW-UONOGXRCSA-N 1 3 349.441 2.640 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C(C)C)c(C)s1 ZINC001403059948 1364264463 /nfs/dbraw/zinc/26/44/63/1364264463.db2.gz ZOVUTIAWEGNAGX-KGLIPLIRSA-N 1 3 325.522 2.688 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C(C)C)c(C)s1 ZINC001403059957 1364264824 /nfs/dbraw/zinc/26/48/24/1364264824.db2.gz ZOVUTIAWEGNAGX-UONOGXRCSA-N 1 3 325.522 2.688 10 0 EFAEHO CC(C)=CC[N@H+]1C[C@@H]2CC[C@H](NC(=O)C3(N(C)C)CCC3)C[C@H]2C1 ZINC001282947253 1319212417 /nfs/dbraw/zinc/21/24/17/1319212417.db2.gz JYVSQDBBYIYAAJ-BZSNNMDCSA-N 1 3 333.520 2.654 10 0 EFAEHO CC(C)=CC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)C3(N(C)C)CCC3)C[C@H]2C1 ZINC001282947253 1319212426 /nfs/dbraw/zinc/21/24/26/1319212426.db2.gz JYVSQDBBYIYAAJ-BZSNNMDCSA-N 1 3 333.520 2.654 10 0 EFAEHO CC(C)=CC[N@H+]1C[C@@H]2CC[C@H](NC(=O)C3(N(C)C)CCC3)C[C@@H]2C1 ZINC001282947254 1319213130 /nfs/dbraw/zinc/21/31/30/1319213130.db2.gz JYVSQDBBYIYAAJ-KSZLIROESA-N 1 3 333.520 2.654 10 0 EFAEHO CC(C)=CC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)C3(N(C)C)CCC3)C[C@@H]2C1 ZINC001282947254 1319213137 /nfs/dbraw/zinc/21/31/37/1319213137.db2.gz JYVSQDBBYIYAAJ-KSZLIROESA-N 1 3 333.520 2.654 10 0 EFAEHO CCCCC[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)Cc3nc[nH]c3C)C[C@H]2C1 ZINC001282959565 1319218492 /nfs/dbraw/zinc/21/84/92/1319218492.db2.gz VFQPWNUGGPZAOP-YESZJQIVSA-N 1 3 332.492 2.668 10 0 EFAEHO CCCCC[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Cc3nc[nH]c3C)C[C@H]2C1 ZINC001282959565 1319218499 /nfs/dbraw/zinc/21/84/99/1319218499.db2.gz VFQPWNUGGPZAOP-YESZJQIVSA-N 1 3 332.492 2.668 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CCCC2CCC2)C1 ZINC001283040781 1319280412 /nfs/dbraw/zinc/28/04/12/1319280412.db2.gz GFTNQRMUBUSKCH-GUDVDZBRSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@H](CCC[NH2+]CC1CCC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001283239768 1319455268 /nfs/dbraw/zinc/45/52/68/1319455268.db2.gz OPHRRPNIDFMTDK-BEFAXECRSA-N 1 3 341.515 2.874 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@@H](C)C[NH2+]CC=C(Cl)Cl ZINC001319284164 1328832668 /nfs/dbraw/zinc/83/26/68/1328832668.db2.gz FKCHSDKXRWUGST-STQMWFEESA-N 1 3 336.307 2.522 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001283681156 1319954521 /nfs/dbraw/zinc/95/45/21/1319954521.db2.gz WPVLXSFQSFJOPE-RBUKOAKNSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@H](CN(C)C(=O)Cc1c[nH]cn1)[NH2+]Cc1cc2ccccc2s1 ZINC001283680963 1319955127 /nfs/dbraw/zinc/95/51/27/1319955127.db2.gz RDGZNNIUKPIBPM-CYBMUJFWSA-N 1 3 342.468 2.804 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)C(C)(C)N2CCCC2)CCC[N@@H+]1CCCCCF ZINC001284130964 1320219849 /nfs/dbraw/zinc/21/98/49/1320219849.db2.gz OIDJWDBVDFTOJT-SJORKVTESA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)C(C)(C)N2CCCC2)CCC[N@H+]1CCCCCF ZINC001284130964 1320219854 /nfs/dbraw/zinc/21/98/54/1320219854.db2.gz OIDJWDBVDFTOJT-SJORKVTESA-N 1 3 341.515 2.970 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]CC=C(Cl)Cl)C1 ZINC001284241942 1320282179 /nfs/dbraw/zinc/28/21/79/1320282179.db2.gz LULCATUVYSXUBL-STQMWFEESA-N 1 3 336.307 2.522 10 0 EFAEHO CC(C)(C)[C@@H](C[NH2+]C/C=C/Cl)NC(=O)C(C)(C)N1CCCC1 ZINC001284613262 1320439698 /nfs/dbraw/zinc/43/96/98/1320439698.db2.gz CSCAVSWKIBTQSD-MYSGNRETSA-N 1 3 329.916 2.734 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC=C(CNC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001284928119 1320600203 /nfs/dbraw/zinc/60/02/03/1320600203.db2.gz MNTFNPGPFHYYDT-FQEVSTJZSA-N 1 3 343.515 2.830 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC=C(CNC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001284928119 1320600209 /nfs/dbraw/zinc/60/02/09/1320600209.db2.gz MNTFNPGPFHYYDT-FQEVSTJZSA-N 1 3 343.515 2.830 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]CCc1ccc(C)cc1 ZINC001319594051 1328923449 /nfs/dbraw/zinc/92/34/49/1328923449.db2.gz RCJWNUIBGNDYDM-QUCCMNQESA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)C[C@H](CNCCF)NC(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001319609464 1328927962 /nfs/dbraw/zinc/92/79/62/1328927962.db2.gz MVQJSWAREJTNAH-DLBZAZTESA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)C[C@H](CNCCF)NC(=O)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001319609464 1328927969 /nfs/dbraw/zinc/92/79/69/1328927969.db2.gz MVQJSWAREJTNAH-DLBZAZTESA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C[NH2+]C/C=C/Cl)C1CCCCC1)N(C)C ZINC001319658325 1328941592 /nfs/dbraw/zinc/94/15/92/1328941592.db2.gz YFHDVFRSCLDKHM-BAMWUGHESA-N 1 3 343.943 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C[NH2+]C/C=C\Cl)C1CCCCC1)N(C)C ZINC001319659769 1328941626 /nfs/dbraw/zinc/94/16/26/1328941626.db2.gz NIRSLQFLSQVCOG-CFZZFRRISA-N 1 3 329.916 2.734 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C[NH2+]CCF)C1CCCCC1 ZINC001319662267 1328943231 /nfs/dbraw/zinc/94/32/31/1328943231.db2.gz IGZGHKZHXLNEAN-QZTJIDSGSA-N 1 3 341.515 2.874 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@H]1CC[NH2+]CCCCCF ZINC001319735198 1328968799 /nfs/dbraw/zinc/96/87/99/1328968799.db2.gz CALORWNBQCACSF-DLBZAZTESA-N 1 3 327.488 2.581 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]CC1CC(C)(C)C1 ZINC001319735964 1328968522 /nfs/dbraw/zinc/96/85/22/1328968522.db2.gz LGVGDYWSVPGYHY-QZTJIDSGSA-N 1 3 335.536 2.878 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@H]1CC[NH2+]CC1CC(C)(C)C1 ZINC001319735966 1328969021 /nfs/dbraw/zinc/96/90/21/1328969021.db2.gz LGVGDYWSVPGYHY-ZWKOTPCHSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H]1CCCN(C(=O)CCCC[NH+](C)C)[C@@H]1CNCc1ccccn1 ZINC001319862563 1329019081 /nfs/dbraw/zinc/01/90/81/1329019081.db2.gz GVWKFEABRRRCMR-PKOBYXMFSA-N 1 3 346.519 2.530 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CCCC[NH+](C)C)[C@@H]1CNCc1ccccn1 ZINC001319862557 1329019282 /nfs/dbraw/zinc/01/92/82/1329019282.db2.gz GVWKFEABRRRCMR-IEBWSBKVSA-N 1 3 346.519 2.530 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CCC[C@@H]2CCC[N@@H+]21)CC1=CCCCC1 ZINC001320058302 1329066506 /nfs/dbraw/zinc/06/65/06/1329066506.db2.gz LWLSPPPLFVWSLC-RTBURBONSA-N 1 3 333.520 2.894 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CCC[C@@H]2CCC[N@H+]21)CC1=CCCCC1 ZINC001320058302 1329066512 /nfs/dbraw/zinc/06/65/12/1329066512.db2.gz LWLSPPPLFVWSLC-RTBURBONSA-N 1 3 333.520 2.894 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@H]21 ZINC001320112578 1329085123 /nfs/dbraw/zinc/08/51/23/1329085123.db2.gz ULQJPEBMXMAVME-QZTJIDSGSA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@H]21 ZINC001320112578 1329085130 /nfs/dbraw/zinc/08/51/30/1329085130.db2.gz ULQJPEBMXMAVME-QZTJIDSGSA-N 1 3 335.536 2.853 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)[C@H](C)[NH+]2CCCCCC2)c1 ZINC001491599587 1323739197 /nfs/dbraw/zinc/73/91/97/1323739197.db2.gz ADPICZOGGFZSES-SJORKVTESA-N 1 3 349.494 2.993 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]Cc1ccc(C2CCC2)cc1 ZINC001491681990 1323786526 /nfs/dbraw/zinc/78/65/26/1323786526.db2.gz HTNFPWRUHBMIQM-INIZCTEOSA-N 1 3 331.504 2.889 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NC1c2ccccc2-c2ccccc21 ZINC001491674227 1323821914 /nfs/dbraw/zinc/82/19/14/1323821914.db2.gz SLHBTDJVLFSLNG-CVEARBPZSA-N 1 3 349.478 2.802 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NC1c2ccccc2-c2ccccc21 ZINC001491674227 1323821918 /nfs/dbraw/zinc/82/19/18/1323821918.db2.gz SLHBTDJVLFSLNG-CVEARBPZSA-N 1 3 349.478 2.802 10 0 EFAEHO CCCCC[NH2+]C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001491856243 1323950227 /nfs/dbraw/zinc/95/02/27/1323950227.db2.gz PMTORPKBCYKNRC-SFHVURJKSA-N 1 3 331.504 2.990 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H]2CCC[C@H]([NH2+]CCCF)C2)c1 ZINC001491897666 1324007598 /nfs/dbraw/zinc/00/75/98/1324007598.db2.gz ZEZQMOIFHCVLDR-ZWKOTPCHSA-N 1 3 335.467 2.738 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCc1ccc(CC[NH2+]CC2CC2)cc1 ZINC001491904005 1324016163 /nfs/dbraw/zinc/01/61/63/1324016163.db2.gz KNBMAILAGPSJEH-HXUWFJFHSA-N 1 3 343.515 2.719 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC001492129005 1324236457 /nfs/dbraw/zinc/23/64/57/1324236457.db2.gz LCSHOISINWLQSK-ZIAGYGMSSA-N 1 3 341.446 2.850 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cccc(Cl)c1 ZINC001492082362 1324242057 /nfs/dbraw/zinc/24/20/57/1324242057.db2.gz CNSVCONWYWQFRI-HUUCEWRRSA-N 1 3 337.895 2.666 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001492084185 1324244248 /nfs/dbraw/zinc/24/42/48/1324244248.db2.gz SEQRQKPMXPKQSI-IAGOWNOFSA-N 1 3 331.504 2.575 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001492084184 1324244467 /nfs/dbraw/zinc/24/44/67/1324244467.db2.gz SEQRQKPMXPKQSI-DLBZAZTESA-N 1 3 331.504 2.575 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)N(C)CCNC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001492257311 1324382043 /nfs/dbraw/zinc/38/20/43/1324382043.db2.gz NOYPIRWYBRCFKA-KBXCAEBGSA-N 1 3 349.906 2.791 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)c1 ZINC001492303297 1324406021 /nfs/dbraw/zinc/40/60/21/1324406021.db2.gz JRGCRAITEPLSMU-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)c1 ZINC001492303297 1324406025 /nfs/dbraw/zinc/40/60/25/1324406025.db2.gz JRGCRAITEPLSMU-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO CN(CC(=O)NCC[N@H+](C)C[C@H]1CCCC(F)(F)C1)CC(C)(C)C ZINC001492423161 1324501405 /nfs/dbraw/zinc/50/14/05/1324501405.db2.gz MUADXKABBYIQNN-HNNXBMFYSA-N 1 3 347.494 2.838 10 0 EFAEHO CN(CC(=O)NCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1)CC(C)(C)C ZINC001492423161 1324501413 /nfs/dbraw/zinc/50/14/13/1324501413.db2.gz MUADXKABBYIQNN-HNNXBMFYSA-N 1 3 347.494 2.838 10 0 EFAEHO C[C@H](CC[NH2+]Cc1cccc(Cl)c1)NC(=O)CN1CC[C@H](C)C1 ZINC001320551021 1329160264 /nfs/dbraw/zinc/16/02/64/1329160264.db2.gz ZFOZVZIKGZEDSD-LSDHHAIUSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1c(C)cccc1Cl)N(C)C ZINC001320608600 1329176274 /nfs/dbraw/zinc/17/62/74/1329176274.db2.gz PFKIARHJCPSZMB-YOEHRIQHSA-N 1 3 339.911 2.973 10 0 EFAEHO c1nscc1C[NH2+]CCCCN1CCN(c2ccccc2)CC1 ZINC001308207589 1324801959 /nfs/dbraw/zinc/80/19/59/1324801959.db2.gz MVKWOCBJIIFYQL-UHFFFAOYSA-N 1 3 330.501 2.835 10 0 EFAEHO c1nscc1CNCCCC[NH+]1CCN(c2ccccc2)CC1 ZINC001308207589 1324801961 /nfs/dbraw/zinc/80/19/61/1324801961.db2.gz MVKWOCBJIIFYQL-UHFFFAOYSA-N 1 3 330.501 2.835 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)C[C@@H]2C1 ZINC001316758259 1325111897 /nfs/dbraw/zinc/11/18/97/1325111897.db2.gz SZHMQCVAJGTOBJ-UNQUKWGNSA-N 1 3 347.547 2.855 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)C[C@@H]2C1 ZINC001316758259 1325111904 /nfs/dbraw/zinc/11/19/04/1325111904.db2.gz SZHMQCVAJGTOBJ-UNQUKWGNSA-N 1 3 347.547 2.855 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)C[C@@H]2C1 ZINC001316758258 1325111939 /nfs/dbraw/zinc/11/19/39/1325111939.db2.gz SZHMQCVAJGTOBJ-UHDDOPSISA-N 1 3 347.547 2.855 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)C[C@@H]2C1 ZINC001316758258 1325111944 /nfs/dbraw/zinc/11/19/44/1325111944.db2.gz SZHMQCVAJGTOBJ-UHDDOPSISA-N 1 3 347.547 2.855 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](C)Cc2ccc(C3CC3)cc2)C1 ZINC001316851551 1325223018 /nfs/dbraw/zinc/22/30/18/1325223018.db2.gz ZIUGGBMRUVZEDG-QGZVFWFLSA-N 1 3 343.515 2.844 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](C)Cc2ccc(C3CC3)cc2)C1 ZINC001316851551 1325223026 /nfs/dbraw/zinc/22/30/26/1325223026.db2.gz ZIUGGBMRUVZEDG-QGZVFWFLSA-N 1 3 343.515 2.844 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC001316869814 1325237149 /nfs/dbraw/zinc/23/71/49/1325237149.db2.gz KSRZVDRKOFWNRR-LJQANCHMSA-N 1 3 349.494 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC001316869814 1325237156 /nfs/dbraw/zinc/23/71/56/1325237156.db2.gz KSRZVDRKOFWNRR-LJQANCHMSA-N 1 3 349.494 2.981 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](C)Cc1ccccc1C ZINC001316870540 1325238008 /nfs/dbraw/zinc/23/80/08/1325238008.db2.gz PZMQFDHEQKFSRB-IBGZPJMESA-N 1 3 331.504 2.808 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](C)Cc1ccccc1C ZINC001316870540 1325238016 /nfs/dbraw/zinc/23/80/16/1325238016.db2.gz PZMQFDHEQKFSRB-IBGZPJMESA-N 1 3 331.504 2.808 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001316987845 1325451164 /nfs/dbraw/zinc/45/11/64/1325451164.db2.gz OAGMMCKJZDWEMP-CIHFUWIRSA-N 1 3 339.499 2.746 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001316987845 1325451167 /nfs/dbraw/zinc/45/11/67/1325451167.db2.gz OAGMMCKJZDWEMP-CIHFUWIRSA-N 1 3 339.499 2.746 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001316987846 1325451786 /nfs/dbraw/zinc/45/17/86/1325451786.db2.gz OAGMMCKJZDWEMP-FQEKARNZSA-N 1 3 339.499 2.746 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001316987846 1325451794 /nfs/dbraw/zinc/45/17/94/1325451794.db2.gz OAGMMCKJZDWEMP-FQEKARNZSA-N 1 3 339.499 2.746 10 0 EFAEHO CN(CC(=O)N1CC[C@H]([NH2+]CCCCc2ccccc2)C1)C1CCC1 ZINC001317058666 1325531073 /nfs/dbraw/zinc/53/10/73/1325531073.db2.gz FYITXGOCDXHPBT-IBGZPJMESA-N 1 3 343.515 2.684 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(C)cc(C)c1)C(=O)[C@@H](C(C)C)N(C)C ZINC001320843572 1329308909 /nfs/dbraw/zinc/30/89/09/1329308909.db2.gz HSDBOECSSZOBQX-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(C)ccc1C)C(=O)CN1CC[C@@H](C)C1 ZINC001320840988 1329308995 /nfs/dbraw/zinc/30/89/95/1329308995.db2.gz OYSVOPNPKFBAKH-QGZVFWFLSA-N 1 3 331.504 2.583 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC001320864679 1329312085 /nfs/dbraw/zinc/31/20/85/1329312085.db2.gz ZRCVUSURUABHCM-MRXNPFEDSA-N 1 3 337.533 2.951 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001320891397 1329315623 /nfs/dbraw/zinc/31/56/23/1329315623.db2.gz HUVPGXVDITTWEI-IEBWSBKVSA-N 1 3 349.494 2.884 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc2cc[nH]c2c1)C(=O)[C@@H](C(C)C)N(C)C ZINC001320900720 1329316451 /nfs/dbraw/zinc/31/64/51/1329316451.db2.gz DSXXOAMRHFQCJH-LJQANCHMSA-N 1 3 344.503 2.692 10 0 EFAEHO CC[C@H](C(=O)N(CC)CC[NH2+]Cc1ccc(F)c(Cl)c1)N(C)C ZINC001320902517 1329317120 /nfs/dbraw/zinc/31/71/20/1329317120.db2.gz XAKFFFWRSFTCDQ-MRXNPFEDSA-N 1 3 343.874 2.757 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC/C=C/CNCc1csc(C)c1 ZINC001321086138 1329341544 /nfs/dbraw/zinc/34/15/44/1329341544.db2.gz YUTSLCZOEDVNJN-BDUNBXCCSA-N 1 3 335.517 2.693 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC/C=C/CNCc1csc(C)c1 ZINC001321086138 1329341546 /nfs/dbraw/zinc/34/15/46/1329341546.db2.gz YUTSLCZOEDVNJN-BDUNBXCCSA-N 1 3 335.517 2.693 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)CC[C@@H]2CCC[N@H+]2C)cs1 ZINC001321096494 1329342546 /nfs/dbraw/zinc/34/25/46/1329342546.db2.gz IKLDQWQAXWDFDY-IDOMTICXSA-N 1 3 335.517 2.693 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)CC[C@@H]2CCC[N@@H+]2C)cs1 ZINC001321096494 1329342549 /nfs/dbraw/zinc/34/25/49/1329342549.db2.gz IKLDQWQAXWDFDY-IDOMTICXSA-N 1 3 335.517 2.693 10 0 EFAEHO C[NH+](C)CC1(C(=O)NC/C=C/CNCCC(F)(F)F)CCCCC1 ZINC001321172717 1329352468 /nfs/dbraw/zinc/35/24/68/1329352468.db2.gz CESISTQCHBLZIF-VOTSOKGWSA-N 1 3 349.441 2.713 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC/C=C/C[NH2+]Cc2ccccc2C2CC2)C1 ZINC001321248674 1329362711 /nfs/dbraw/zinc/36/27/11/1329362711.db2.gz DDXCLXRAKGXLOQ-BDUNBXCCSA-N 1 3 341.499 2.668 10 0 EFAEHO CCCCC[NH2+]C/C=C\CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001321252169 1329363584 /nfs/dbraw/zinc/36/35/84/1329363584.db2.gz UWDNRDRDAMWYJU-GIFJBRJJSA-N 1 3 327.488 2.651 10 0 EFAEHO CCC/C=C/CC[NH2+]C[C@@H]1CCCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001317157965 1327652528 /nfs/dbraw/zinc/65/25/28/1327652528.db2.gz NWNJHFJBMWYPLY-YSKLNCTFSA-N 1 3 335.536 2.903 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H]2CCCCN2C(=O)CN(C)C(C)C)cc1 ZINC001317200156 1327727892 /nfs/dbraw/zinc/72/78/92/1327727892.db2.gz PDEPGCLGTOSMBV-HXUWFJFHSA-N 1 3 345.531 2.848 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](C[NH2+]CCCc2ccc(C)cc2)C1)N(C)C ZINC001317344421 1327873754 /nfs/dbraw/zinc/87/37/54/1327873754.db2.gz RPOGOWFFVCPTSS-PMACEKPBSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@H](NC/C=C\CNC(=O)[C@H]1CC[N@H+](C)C1)c1ccc(Cl)cc1 ZINC001321404556 1329382998 /nfs/dbraw/zinc/38/29/98/1329382998.db2.gz RKCSGAVELSFPGJ-XJNRFOTBSA-N 1 3 335.879 2.615 10 0 EFAEHO C[C@H](NC/C=C\CNC(=O)[C@H]1CC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC001321404556 1329383000 /nfs/dbraw/zinc/38/30/00/1329383000.db2.gz RKCSGAVELSFPGJ-XJNRFOTBSA-N 1 3 335.879 2.615 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC/C=C\C[NH2+]Cc1cc(F)ccc1C ZINC001321421191 1329384826 /nfs/dbraw/zinc/38/48/26/1329384826.db2.gz VUGXLMKELUYIHE-VOFKWLDRSA-N 1 3 347.478 2.771 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C\C[NH2+]Cc1cc(F)ccc1C ZINC001321421184 1329384965 /nfs/dbraw/zinc/38/49/65/1329384965.db2.gz VUGXLMKELUYIHE-SFFCAUCYSA-N 1 3 347.478 2.771 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NCCC[C@@H]2CCC[N@@H+]2CCF)C1 ZINC001317434793 1328019794 /nfs/dbraw/zinc/01/97/94/1328019794.db2.gz LKYVQNXKISMTKZ-CRAIPNDOSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NCCC[C@@H]2CCC[N@H+]2CCF)C1 ZINC001317434793 1328019800 /nfs/dbraw/zinc/01/98/00/1328019800.db2.gz LKYVQNXKISMTKZ-CRAIPNDOSA-N 1 3 345.478 2.529 10 0 EFAEHO CN(CCNC(=O)[C@H]1CCC[N@@H+]1C1CCCC1)CC1=CCCCC1 ZINC001317450503 1328039742 /nfs/dbraw/zinc/03/97/42/1328039742.db2.gz SMZSSHQVXLJQKF-LJQANCHMSA-N 1 3 333.520 2.942 10 0 EFAEHO CN(CCNC(=O)[C@H]1CCC[N@H+]1C1CCCC1)CC1=CCCCC1 ZINC001317450503 1328039749 /nfs/dbraw/zinc/03/97/49/1328039749.db2.gz SMZSSHQVXLJQKF-LJQANCHMSA-N 1 3 333.520 2.942 10 0 EFAEHO C[C@H](C[NH2+]CCCc1ccccc1)NC(=O)C(C)(C)N1CCCC1 ZINC001321609113 1329398470 /nfs/dbraw/zinc/39/84/70/1329398470.db2.gz KYORNXZTTHBBDH-QGZVFWFLSA-N 1 3 331.504 2.588 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C[NH2+]CCc1ccc(Cl)cc1)N(C)C ZINC001321714299 1329404644 /nfs/dbraw/zinc/40/46/44/1329404644.db2.gz XGYGLHKIVPUICL-RHSMWYFYSA-N 1 3 339.911 2.563 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[NH2+]Cc1ccc(C(F)(F)F)cc1)N(C)C ZINC001317598959 1328179195 /nfs/dbraw/zinc/17/91/95/1328179195.db2.gz NAGJOFQMPKRDPC-OAHLLOKOSA-N 1 3 345.409 2.594 10 0 EFAEHO CN(CC[NH2+]CC1CC(C)(C)C1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001317626185 1328207775 /nfs/dbraw/zinc/20/77/75/1328207775.db2.gz NAQZOANMPJTEKP-IBGZPJMESA-N 1 3 341.515 2.683 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[NH2+]C[C@H]2CCCC(F)(F)C2)CC1 ZINC001317643348 1328228029 /nfs/dbraw/zinc/22/80/29/1328228029.db2.gz YQVPODJYEOXYTM-INIZCTEOSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](C[N@H+](C)CCC2=CCCCC2)C1)N(C)C ZINC001317857264 1328421394 /nfs/dbraw/zinc/42/13/94/1328421394.db2.gz PLTOAROUSXYEGB-MOPGFXCFSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](C[N@@H+](C)CCC2=CCCCC2)C1)N(C)C ZINC001317857264 1328421399 /nfs/dbraw/zinc/42/13/99/1328421399.db2.gz PLTOAROUSXYEGB-MOPGFXCFSA-N 1 3 335.536 2.997 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)N[C@@H]1CCCN(CC2=CCCCC2)C1 ZINC001317955342 1328456251 /nfs/dbraw/zinc/45/62/51/1328456251.db2.gz KVTKTZUUMZJCMR-LJQANCHMSA-N 1 3 333.520 2.943 10 0 EFAEHO CN(CCC[NH2+]C/C=C/c1ccc(Cl)cc1)C(=O)[C@@H]1CCCN1C ZINC001322442987 1329458712 /nfs/dbraw/zinc/45/87/12/1329458712.db2.gz QYCBRQYYEOHCKL-PXPSOEEZSA-N 1 3 349.906 2.886 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]Cc1ccc2ncccc2c1)N(C)C ZINC001322565714 1329467972 /nfs/dbraw/zinc/46/79/72/1329467972.db2.gz HCOLEWNESGFWJI-LJQANCHMSA-N 1 3 342.487 2.513 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+][C@H](C)c1cccc(F)c1)N(C)C ZINC001322683824 1329479199 /nfs/dbraw/zinc/47/91/99/1329479199.db2.gz VPXKKLKKRKGCPI-CRAIPNDOSA-N 1 3 337.483 2.911 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001322756452 1329485266 /nfs/dbraw/zinc/48/52/66/1329485266.db2.gz NCNMLCRAWOHFCX-QRVBRYPASA-N 1 3 335.536 2.593 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001322797326 1329488897 /nfs/dbraw/zinc/48/88/97/1329488897.db2.gz UVHITYGGRUMQJS-KRWDZBQOSA-N 1 3 339.911 2.864 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(Cl)c(F)c1)C(=O)CN1CCCC1 ZINC001322835868 1329492905 /nfs/dbraw/zinc/49/29/05/1329492905.db2.gz PFBNKWNKEBIFLH-UHFFFAOYSA-N 1 3 341.858 2.513 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)N(C)CCCN(C)Cc1ccsc1 ZINC001380987376 1348007610 /nfs/dbraw/zinc/00/76/10/1348007610.db2.gz GYKGYVUQNGSBCW-HZPDHXFCSA-N 1 3 337.533 2.901 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H](C2CCN(C(=O)CN3CCCC3)CC2)C1 ZINC001323637698 1329557074 /nfs/dbraw/zinc/55/70/74/1329557074.db2.gz MQBCISQMRWGXIE-HZQHCPKGSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H](C2CCN(C(=O)CN3CCCC3)CC2)C1 ZINC001323637698 1329557077 /nfs/dbraw/zinc/55/70/77/1329557077.db2.gz MQBCISQMRWGXIE-HZQHCPKGSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001323639410 1329557615 /nfs/dbraw/zinc/55/76/15/1329557615.db2.gz ZIUHTZSUXAIZMF-OAJJDEHYSA-N 1 3 344.503 2.869 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001323639410 1329557617 /nfs/dbraw/zinc/55/76/17/1329557617.db2.gz ZIUHTZSUXAIZMF-OAJJDEHYSA-N 1 3 344.503 2.869 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001323639408 1329557864 /nfs/dbraw/zinc/55/78/64/1329557864.db2.gz ZIUHTZSUXAIZMF-DDKKJVIOSA-N 1 3 344.503 2.869 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001323639408 1329557865 /nfs/dbraw/zinc/55/78/65/1329557865.db2.gz ZIUHTZSUXAIZMF-DDKKJVIOSA-N 1 3 344.503 2.869 10 0 EFAEHO CC(C)=CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)CN1CC[C@H](C)C1 ZINC001323661642 1329559924 /nfs/dbraw/zinc/55/99/24/1329559924.db2.gz ZDCWICYAZLENLB-QBUWPKIASA-N 1 3 333.520 2.796 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C(C)C)N(C)C ZINC001323704658 1329562947 /nfs/dbraw/zinc/56/29/47/1329562947.db2.gz HOOWDHVCRQONGS-HOHRJFBBSA-N 1 3 335.536 2.994 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C(C)C)N(C)C ZINC001323704658 1329562949 /nfs/dbraw/zinc/56/29/49/1329562949.db2.gz HOOWDHVCRQONGS-HOHRJFBBSA-N 1 3 335.536 2.994 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC[C@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001323816852 1329574800 /nfs/dbraw/zinc/57/48/00/1329574800.db2.gz UOZMATUORAYGHV-IELZWVCUSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC[C@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001323816852 1329574801 /nfs/dbraw/zinc/57/48/01/1329574801.db2.gz UOZMATUORAYGHV-IELZWVCUSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@H](F)CN1CCC[C@]2(CCN(C(=O)CCCC[NH+](C)C)C2)C1 ZINC001323817233 1329574808 /nfs/dbraw/zinc/57/48/08/1329574808.db2.gz ZGDXSWGMLVFDQC-HKUYNNGSSA-N 1 3 341.515 2.781 10 0 EFAEHO CN(CC(=O)N1CC[C@]2(CC[N@H+](CCCCCF)C2)C1)C1CCC1 ZINC001323859348 1329579619 /nfs/dbraw/zinc/57/96/19/1329579619.db2.gz VTDYFDUBRQGBEO-IBGZPJMESA-N 1 3 339.499 2.535 10 0 EFAEHO CN(CC(=O)N1CC[C@]2(CC[N@@H+](CCCCCF)C2)C1)C1CCC1 ZINC001323859348 1329579622 /nfs/dbraw/zinc/57/96/22/1329579622.db2.gz VTDYFDUBRQGBEO-IBGZPJMESA-N 1 3 339.499 2.535 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CCCc2ccccc2)CCN1C(=O)CN1CCCC1 ZINC001324098523 1329599935 /nfs/dbraw/zinc/59/99/35/1329599935.db2.gz RPFPHMPGKKEQOE-AZUAARDMSA-N 1 3 343.515 2.684 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@H]2C[NH2+]CCC2=CCCCC2)CCC1 ZINC001324174847 1329605558 /nfs/dbraw/zinc/60/55/58/1329605558.db2.gz JJBBRTNBOPETBW-SFHVURJKSA-N 1 3 333.520 2.942 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[NH2+]CCCc1cccc(C)c1)N(C)C ZINC001324181956 1329606155 /nfs/dbraw/zinc/60/61/55/1329606155.db2.gz RSAYMHMCOOLGBB-VQTJNVASSA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@H](NCc1ccccn1)[C@H](C)NC(=O)C1(C[NH+](C)C)CCCCC1 ZINC001381416521 1348257689 /nfs/dbraw/zinc/25/76/89/1348257689.db2.gz SLFHRDGLSHNACL-IRXDYDNUSA-N 1 3 346.519 2.577 10 0 EFAEHO CC[C@H](C(=O)N(C)CC(C)(C)C[NH2+]CC1CC2(CCC2)C1)N(C)C ZINC001381467887 1348294666 /nfs/dbraw/zinc/29/46/66/1348294666.db2.gz FVFALLQEQAYBBY-QGZVFWFLSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)=CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C2 ZINC001325631006 1329702389 /nfs/dbraw/zinc/70/23/89/1329702389.db2.gz ZGIZDOUUFQIHEM-FCGDIQPGSA-N 1 3 335.536 2.898 10 0 EFAEHO CC(C)=CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C2 ZINC001325631006 1329702391 /nfs/dbraw/zinc/70/23/91/1329702391.db2.gz ZGIZDOUUFQIHEM-FCGDIQPGSA-N 1 3 335.536 2.898 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2C[N@@H+](CCC3=CCCCC3)C[C@@H]2C1 ZINC001325772688 1329712216 /nfs/dbraw/zinc/71/22/16/1329712216.db2.gz RCHMXTZIJOSERI-KDURUIRLSA-N 1 3 333.520 2.609 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2C[N@H+](CCC3=CCCCC3)C[C@@H]2C1 ZINC001325772688 1329712217 /nfs/dbraw/zinc/71/22/17/1329712217.db2.gz RCHMXTZIJOSERI-KDURUIRLSA-N 1 3 333.520 2.609 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]CCCc2ccccc2)C1 ZINC001326329398 1329747590 /nfs/dbraw/zinc/74/75/90/1329747590.db2.gz ARYWINWMFQZVQW-WOJBJXKFSA-N 1 3 343.515 2.542 10 0 EFAEHO C[C@@H](F)CC[NH2+]CC[C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001326364627 1329750596 /nfs/dbraw/zinc/75/05/96/1329750596.db2.gz LCWQKAGQDJGXTP-CVEARBPZSA-N 1 3 329.504 2.541 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](CC[NH2+]CC2CC(C)(C)C2)C1)N(C)C ZINC001326417280 1329754612 /nfs/dbraw/zinc/75/46/12/1329754612.db2.gz BJTFONQJZQBBKN-FUHWJXTLSA-N 1 3 337.552 2.837 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H](C)CN(C)C(=O)CN1CC[C@H](C)C1 ZINC001382112353 1348732343 /nfs/dbraw/zinc/73/23/43/1348732343.db2.gz AKJITKVBGWLBKA-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1CC[C@H](C[NH2+]CC[C@@H](C)F)CC1 ZINC001326512878 1330308545 /nfs/dbraw/zinc/30/85/45/1330308545.db2.gz OPDXFDUMHUWESE-BRSBDYLESA-N 1 3 341.515 2.872 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[C@H](C[NH2+]CC[C@H](C)F)CC1)N(C)C ZINC001326555054 1330316133 /nfs/dbraw/zinc/31/61/33/1330316133.db2.gz KKORIIARWMHPJS-QAETUUGQSA-N 1 3 329.504 2.585 10 0 EFAEHO CN(C)C1(C(=O)N2CC3(C2)CC[NH+](CCCCCF)CC3)CCC1 ZINC001326585571 1330321600 /nfs/dbraw/zinc/32/16/00/1330321600.db2.gz HWJGALOJFBTJKR-UHFFFAOYSA-N 1 3 339.499 2.535 10 0 EFAEHO CC[C@@H](C(=O)NCc1cccc2c1CC[N@H+](CC=C(C)C)C2)N(C)C ZINC001326676846 1330346232 /nfs/dbraw/zinc/34/62/32/1330346232.db2.gz XIICIRLAJZSSRI-FQEVSTJZSA-N 1 3 343.515 2.967 10 0 EFAEHO CC[C@@H](C(=O)NCc1cccc2c1CC[N@@H+](CC=C(C)C)C2)N(C)C ZINC001326676846 1330346237 /nfs/dbraw/zinc/34/62/37/1330346237.db2.gz XIICIRLAJZSSRI-FQEVSTJZSA-N 1 3 343.515 2.967 10 0 EFAEHO CCCCCN1Cc2ccccc2C[C@@H]1CNC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001327510994 1330492004 /nfs/dbraw/zinc/49/20/04/1330492004.db2.gz ALYMJBJYZOTCOI-WOJBJXKFSA-N 1 3 343.515 2.671 10 0 EFAEHO CCCCCN1Cc2ccccc2C[C@@H]1CNC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001327510994 1330492006 /nfs/dbraw/zinc/49/20/06/1330492006.db2.gz ALYMJBJYZOTCOI-WOJBJXKFSA-N 1 3 343.515 2.671 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001329051026 1330661329 /nfs/dbraw/zinc/66/13/29/1330661329.db2.gz AGFSVALCDAQRHQ-QZTJIDSGSA-N 1 3 345.531 2.895 10 0 EFAEHO CC(C)C[NH2+]CCC[C@@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001330915937 1330769932 /nfs/dbraw/zinc/76/99/32/1330769932.db2.gz LCOFLDVTDHGBJL-QAPCUYQASA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)[NH2+]CCC[C@@H](NC(=O)CN1CC[C@@H](C)C1)c1ccccc1 ZINC001331176039 1330802000 /nfs/dbraw/zinc/80/20/00/1330802000.db2.gz FYUHZWAMAUDSND-IEBWSBKVSA-N 1 3 331.504 2.964 10 0 EFAEHO C[C@@H]1[C@H]([NH2+]CCCc2ccsc2)CCN1C(=O)CN(C)C1CCC1 ZINC001331896061 1330886549 /nfs/dbraw/zinc/88/65/49/1330886549.db2.gz KFESCOCGEFUBBF-CRAIPNDOSA-N 1 3 349.544 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CCCCC(F)(F)F)[C@H]1C ZINC001331945150 1330895481 /nfs/dbraw/zinc/89/54/81/1330895481.db2.gz YYIKWORYAZDRIW-KGLIPLIRSA-N 1 3 337.430 2.638 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C[NH2+]CC=C(Cl)Cl)C(C)(C)C ZINC001332893075 1331035422 /nfs/dbraw/zinc/03/54/22/1331035422.db2.gz OAAISHIQMAREHW-GFCCVEGCSA-N 1 3 338.323 2.768 10 0 EFAEHO CC(C)=CC[NH+]1CCC(C2(NC(=O)CN(C)C3CCC3)CC2)CC1 ZINC001333180589 1331089264 /nfs/dbraw/zinc/08/92/64/1331089264.db2.gz GWOVQLNRHJCCTR-UHFFFAOYSA-N 1 3 333.520 2.798 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1CC=C(CNC(=O)CN(C)C2CCC2)CC1 ZINC001333354368 1331124156 /nfs/dbraw/zinc/12/41/56/1331124156.db2.gz HRXNHYZBZIHMKI-KRWDZBQOSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1CC=C(CNC(=O)CN(C)C2CCC2)CC1 ZINC001333354368 1331124160 /nfs/dbraw/zinc/12/41/60/1331124160.db2.gz HRXNHYZBZIHMKI-KRWDZBQOSA-N 1 3 335.536 2.901 10 0 EFAEHO CN(CCC[N@H+](C)CCCCC(F)(F)F)C(=O)[C@@H]1CCCN1C ZINC001570192831 1351398722 /nfs/dbraw/zinc/39/87/22/1351398722.db2.gz SEICNHMLWAIPTI-AWEZNQCLSA-N 1 3 337.430 2.594 10 0 EFAEHO CN(CCC[N@@H+](C)CCCCC(F)(F)F)C(=O)[C@@H]1CCCN1C ZINC001570192831 1351398726 /nfs/dbraw/zinc/39/87/26/1351398726.db2.gz SEICNHMLWAIPTI-AWEZNQCLSA-N 1 3 337.430 2.594 10 0 EFAEHO CCCN(C)CC(=O)NCCC[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC001479810374 1332449043 /nfs/dbraw/zinc/44/90/43/1332449043.db2.gz SSYYANCRMJGGPZ-LJQANCHMSA-N 1 3 331.504 2.844 10 0 EFAEHO CCCN(C)CC(=O)NCCC[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC001479810374 1332449046 /nfs/dbraw/zinc/44/90/46/1332449046.db2.gz SSYYANCRMJGGPZ-LJQANCHMSA-N 1 3 331.504 2.844 10 0 EFAEHO COCC[N@H+](C)CCCC1CCN(Cc2cccc(N(C)C)n2)CC1 ZINC001413966565 1334754544 /nfs/dbraw/zinc/75/45/44/1334754544.db2.gz CNIUUFOMABDHCJ-UHFFFAOYSA-N 1 3 348.535 2.718 10 0 EFAEHO COCC[N@@H+](C)CCCC1CCN(Cc2cccc(N(C)C)n2)CC1 ZINC001413966565 1334754547 /nfs/dbraw/zinc/75/45/47/1334754547.db2.gz CNIUUFOMABDHCJ-UHFFFAOYSA-N 1 3 348.535 2.718 10 0 EFAEHO CC1(C)CC[C@@H](CNC(=[NH2+])NC2CCN(Cc3ccccc3)CC2)O1 ZINC000849098201 1335551331 /nfs/dbraw/zinc/55/13/31/1335551331.db2.gz QGAHUYWNBMYWDC-SFHVURJKSA-N 1 3 344.503 2.723 10 0 EFAEHO CCN1CCC[C@H]1CNC(=[NH2+])NCc1cc(F)c(Cl)cc1F ZINC000849104143 1335552599 /nfs/dbraw/zinc/55/25/99/1335552599.db2.gz FEZXTXDLZWSPMF-NSHDSACASA-N 1 3 330.810 2.716 10 0 EFAEHO C[C@@H](NC(=S)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1cccs1 ZINC000849275145 1335585678 /nfs/dbraw/zinc/58/56/78/1335585678.db2.gz IXZIBRQZMVEMHB-UONOGXRCSA-N 1 3 342.578 2.545 10 0 EFAEHO C[C@@H](NC(=S)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1cccs1 ZINC000849275145 1335585675 /nfs/dbraw/zinc/58/56/75/1335585675.db2.gz IXZIBRQZMVEMHB-UONOGXRCSA-N 1 3 342.578 2.545 10 0 EFAEHO Cc1ccc(C)c(NC(=S)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000849276222 1335586029 /nfs/dbraw/zinc/58/60/29/1335586029.db2.gz CSGWKPQRIZMYAY-INIZCTEOSA-N 1 3 336.549 2.862 10 0 EFAEHO Cc1ccc(C)c(NC(=S)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000849276222 1335586031 /nfs/dbraw/zinc/58/60/31/1335586031.db2.gz CSGWKPQRIZMYAY-INIZCTEOSA-N 1 3 336.549 2.862 10 0 EFAEHO Cc1cccc(NC(=S)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1C ZINC000849277080 1335586160 /nfs/dbraw/zinc/58/61/60/1335586160.db2.gz SVMUBWQIPPRSKL-HNNXBMFYSA-N 1 3 336.549 2.862 10 0 EFAEHO Cc1cccc(NC(=S)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1C ZINC000849277080 1335586162 /nfs/dbraw/zinc/58/61/62/1335586162.db2.gz SVMUBWQIPPRSKL-HNNXBMFYSA-N 1 3 336.549 2.862 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NC[C@H]1C[C@H](C)C[C@H](C)C1 ZINC001413889570 1335839124 /nfs/dbraw/zinc/83/91/24/1335839124.db2.gz AZBBEMLZTRUOHL-XWTMOSNGSA-N 1 3 340.556 2.630 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NC[C@H]1C[C@H](C)C[C@H](C)C1 ZINC001413889570 1335839127 /nfs/dbraw/zinc/83/91/27/1335839127.db2.gz AZBBEMLZTRUOHL-XWTMOSNGSA-N 1 3 340.556 2.630 10 0 EFAEHO C[C@@H]1CCC[C@@H](CC[NH+](C)C)N1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001361813078 1336352103 /nfs/dbraw/zinc/35/21/03/1336352103.db2.gz RHGTWGVWNKHZAQ-GJYPPUQNSA-N 1 3 341.515 2.920 10 0 EFAEHO CN(C)CCN(CC1CCCCC1)C(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001361856076 1336378036 /nfs/dbraw/zinc/37/80/36/1336378036.db2.gz MSGSBUDLEKLLPH-OALUTQOASA-N 1 3 335.536 2.974 10 0 EFAEHO CN(C)CCN(CC1CCCCC1)C(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001361856076 1336378040 /nfs/dbraw/zinc/37/80/40/1336378040.db2.gz MSGSBUDLEKLLPH-OALUTQOASA-N 1 3 335.536 2.974 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)[C@@H](C)CC[NH+](C)C)c1ccsc1 ZINC001361917446 1336415766 /nfs/dbraw/zinc/41/57/66/1336415766.db2.gz HDCMEKROCYRCGZ-GOEBONIOSA-N 1 3 325.522 2.835 10 0 EFAEHO C[C@@H](C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC001362235174 1336566861 /nfs/dbraw/zinc/56/68/61/1336566861.db2.gz WLQRQJXDOWLKOU-HLNWXESRSA-N 1 3 343.515 2.981 10 0 EFAEHO C[C@@H](C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001362235174 1336566865 /nfs/dbraw/zinc/56/68/65/1336566865.db2.gz WLQRQJXDOWLKOU-HLNWXESRSA-N 1 3 343.515 2.981 10 0 EFAEHO C[C@H](C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC001362235177 1336566980 /nfs/dbraw/zinc/56/69/80/1336566980.db2.gz WLQRQJXDOWLKOU-RMJJICAUSA-N 1 3 343.515 2.981 10 0 EFAEHO C[C@H](C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001362235177 1336566983 /nfs/dbraw/zinc/56/69/83/1336566983.db2.gz WLQRQJXDOWLKOU-RMJJICAUSA-N 1 3 343.515 2.981 10 0 EFAEHO CC(C)C[C@@H](CNC(=O)c1ccc(NC2=NCCC2)cc1)[NH+](C)C ZINC001362249858 1336572658 /nfs/dbraw/zinc/57/26/58/1336572658.db2.gz RWCYUTAOTNZGKH-KRWDZBQOSA-N 1 3 330.476 2.997 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)N1CCN(Cc2ccccc2)C[C@H](C)C1 ZINC001362697819 1336708381 /nfs/dbraw/zinc/70/83/81/1336708381.db2.gz YYZNTMPRLOBMJP-ZWKOTPCHSA-N 1 3 331.504 2.555 10 0 EFAEHO CCCN1CCCC[C@@H]1C(=O)NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC001362828180 1336756026 /nfs/dbraw/zinc/75/60/26/1336756026.db2.gz ZBOFIHRAZLKEOW-HSALFYBXSA-N 1 3 343.515 2.713 10 0 EFAEHO CCCN1CCCC[C@@H]1C(=O)NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001362828180 1336756028 /nfs/dbraw/zinc/75/60/28/1336756028.db2.gz ZBOFIHRAZLKEOW-HSALFYBXSA-N 1 3 343.515 2.713 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cccc2c1CCCCC2 ZINC001363230942 1336845812 /nfs/dbraw/zinc/84/58/12/1336845812.db2.gz IDHXDHVKURANRE-KRWDZBQOSA-N 1 3 345.531 2.957 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cccc2c1CCCCC2 ZINC001363230942 1336845815 /nfs/dbraw/zinc/84/58/15/1336845815.db2.gz IDHXDHVKURANRE-KRWDZBQOSA-N 1 3 345.531 2.957 10 0 EFAEHO CC1(C)OC[C@H](CCN2C[C@H]3C[N@H+](Cc4ccccc4)C[C@@]3(C)C2)O1 ZINC001363300901 1336864551 /nfs/dbraw/zinc/86/45/51/1336864551.db2.gz STMGHQKEBZATLO-IRFCIJBXSA-N 1 3 344.499 2.982 10 0 EFAEHO CC1(C)OC[C@H](CCN2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@@]3(C)C2)O1 ZINC001363300901 1336864554 /nfs/dbraw/zinc/86/45/54/1336864554.db2.gz STMGHQKEBZATLO-IRFCIJBXSA-N 1 3 344.499 2.982 10 0 EFAEHO C[C@H](CN1CCOCC1)CN1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001364344446 1337184719 /nfs/dbraw/zinc/18/47/19/1337184719.db2.gz JJVDBODKTCLTNA-AABGKKOBSA-N 1 3 337.552 2.541 10 0 EFAEHO C[C@H](CN1CCOCC1)CN1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC001364344446 1337184721 /nfs/dbraw/zinc/18/47/21/1337184721.db2.gz JJVDBODKTCLTNA-AABGKKOBSA-N 1 3 337.552 2.541 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001366058115 1337353337 /nfs/dbraw/zinc/35/33/37/1337353337.db2.gz HTZXIEHLOBBAQQ-IBGZPJMESA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1cc2ccccc2o1)C1CC1)N(C)C ZINC001366062295 1337355619 /nfs/dbraw/zinc/35/56/19/1337355619.db2.gz MMKNLSWTZNPIEE-QZTJIDSGSA-N 1 3 343.471 2.757 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]([NH2+]Cc1ccccc1)C1CC1)N1CCCCCC1 ZINC001366071248 1337363816 /nfs/dbraw/zinc/36/38/16/1337363816.db2.gz YPMFRBJGSVHVLX-FXAWDEMLSA-N 1 3 343.515 2.936 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366073331 1337365128 /nfs/dbraw/zinc/36/51/28/1337365128.db2.gz JWNLKMRIPBOQIO-MJGOQNOKSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366073331 1337365129 /nfs/dbraw/zinc/36/51/29/1337365129.db2.gz JWNLKMRIPBOQIO-MJGOQNOKSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001366131263 1337392683 /nfs/dbraw/zinc/39/26/83/1337392683.db2.gz MAIFPXOPUJMVTH-UFYCRDLUSA-N 1 3 343.515 2.887 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001366155289 1337405231 /nfs/dbraw/zinc/40/52/31/1337405231.db2.gz LPLJGOHYWHJHNR-CEXWTWQISA-N 1 3 331.504 2.626 10 0 EFAEHO C[C@H]([NH2+][C@H]1C[C@@H](NC(=O)CN(C)CC(C)(C)C)C1)c1ccccc1 ZINC001366158941 1337407322 /nfs/dbraw/zinc/40/73/22/1337407322.db2.gz IDZSLQGOMFBHNN-RYQLBKOJSA-N 1 3 331.504 2.962 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(Cl)cc32)C1 ZINC001366169346 1337411993 /nfs/dbraw/zinc/41/19/93/1337411993.db2.gz OUYVPIIOLWEUOS-SOLBZPMBSA-N 1 3 349.906 2.904 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(CC(C)C)cc2)C1)N(C)C ZINC001366170259 1337412961 /nfs/dbraw/zinc/41/29/61/1337412961.db2.gz NUHQYKLBYINUDM-HSALFYBXSA-N 1 3 345.531 2.962 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](C/C=C/c2ccccc2)C1)N(C)C ZINC001366173431 1337415260 /nfs/dbraw/zinc/41/52/60/1337415260.db2.gz BVYVMCUOIOZWAI-AJAZOWGGSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](C/C=C/c2ccccc2)C1)N(C)C ZINC001366173431 1337415263 /nfs/dbraw/zinc/41/52/63/1337415263.db2.gz BVYVMCUOIOZWAI-AJAZOWGGSA-N 1 3 343.515 2.868 10 0 EFAEHO CCc1ccc(CC[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)cc1 ZINC001366174898 1337416288 /nfs/dbraw/zinc/41/62/88/1337416288.db2.gz ZHUVFCMSLQDUMX-ZCNNSNEGSA-N 1 3 345.531 2.615 10 0 EFAEHO Cc1cc(C[N@H+]2CCC[C@@H](CNC(=O)CN(C)C(C)C)C2)cs1 ZINC001366186281 1337426754 /nfs/dbraw/zinc/42/67/54/1337426754.db2.gz NBEDJCKRGIQJED-INIZCTEOSA-N 1 3 337.533 2.725 10 0 EFAEHO Cc1cc(C[N@@H+]2CCC[C@@H](CNC(=O)CN(C)C(C)C)C2)cs1 ZINC001366186281 1337426756 /nfs/dbraw/zinc/42/67/56/1337426756.db2.gz NBEDJCKRGIQJED-INIZCTEOSA-N 1 3 337.533 2.725 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CCC[N@@H+](CC2CCC(C)CC2)C1 ZINC001366187252 1337428018 /nfs/dbraw/zinc/42/80/18/1337428018.db2.gz LADRJPJXSKJNDC-VMWRSERWSA-N 1 3 346.519 2.915 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CCC[N@H+](CC2CCC(C)CC2)C1 ZINC001366187252 1337428021 /nfs/dbraw/zinc/42/80/21/1337428021.db2.gz LADRJPJXSKJNDC-VMWRSERWSA-N 1 3 346.519 2.915 10 0 EFAEHO CC(C)CCC[N@@H+]1CCCC[C@H]1CNC(=O)[C@@H](C(C)C)N(C)C ZINC001366208630 1337444401 /nfs/dbraw/zinc/44/44/01/1337444401.db2.gz HANLLGBMFJKHQP-ZWKOTPCHSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CCC[N@H+]1CCCC[C@H]1CNC(=O)[C@@H](C(C)C)N(C)C ZINC001366208630 1337444403 /nfs/dbraw/zinc/44/44/03/1337444403.db2.gz HANLLGBMFJKHQP-ZWKOTPCHSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001366209061 1337444965 /nfs/dbraw/zinc/44/49/65/1337444965.db2.gz VURWZVVYYGXKJB-JKSUJKDBSA-N 1 3 329.504 2.541 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CCCC[C@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001366214435 1337449618 /nfs/dbraw/zinc/44/96/18/1337449618.db2.gz SXZWAUDUDWDVSC-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CCCC[C@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001366214435 1337449620 /nfs/dbraw/zinc/44/96/20/1337449620.db2.gz SXZWAUDUDWDVSC-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](NC[C@@H]1CCCCN1C(=O)CC[NH+](C)C)c1ccccc1F ZINC001366215096 1337449773 /nfs/dbraw/zinc/44/97/73/1337449773.db2.gz FVSRRDYTZVHSLP-HOTGVXAUSA-N 1 3 335.467 2.809 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1C[NH2+]Cc1cc(C)ccc1F ZINC001366218620 1337452750 /nfs/dbraw/zinc/45/27/50/1337452750.db2.gz IWPCYZRSANMDSD-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]Cc2cc(C)ccc2F)CC1)N(C)C ZINC001366242515 1337472961 /nfs/dbraw/zinc/47/29/61/1337472961.db2.gz KOMTYGMIAYJWJF-FAFZWHIHSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H](C)CNC(=O)[C@H]1CCCN1C(C)C ZINC001366277198 1337486909 /nfs/dbraw/zinc/48/69/09/1337486909.db2.gz MWBROZKZOYIXCI-MAUKXSAKSA-N 1 3 335.467 2.601 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc(F)cc1C ZINC001366286465 1337491708 /nfs/dbraw/zinc/49/17/08/1337491708.db2.gz OWFGWLWBDIFTLL-CRAIPNDOSA-N 1 3 335.467 2.603 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc(F)cc1C ZINC001366286468 1337491789 /nfs/dbraw/zinc/49/17/89/1337491789.db2.gz OWFGWLWBDIFTLL-MAUKXSAKSA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)NCc1ccccc1Cl ZINC001366291381 1337495227 /nfs/dbraw/zinc/49/52/27/1337495227.db2.gz ZPFXHWCOFCRRLX-WMLDXEAASA-N 1 3 337.895 2.809 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)NCc1ccccc1Cl ZINC001366291381 1337495228 /nfs/dbraw/zinc/49/52/28/1337495228.db2.gz ZPFXHWCOFCRRLX-WMLDXEAASA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]C/C=C\c1ccccc1 ZINC001366314301 1337506144 /nfs/dbraw/zinc/50/61/44/1337506144.db2.gz YMEKQPWURKITOC-QJWNTBNXSA-N 1 3 329.488 2.669 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H](C)[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C ZINC001366321126 1337510772 /nfs/dbraw/zinc/51/07/72/1337510772.db2.gz CWMQSMHDBHUBID-BEFAXECRSA-N 1 3 331.504 2.889 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CC[C@H](NCc2cc(C)ccc2F)C1 ZINC001366391764 1337555484 /nfs/dbraw/zinc/55/54/84/1337555484.db2.gz XZCOHURNSMGNCR-KRWDZBQOSA-N 1 3 335.467 2.557 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CC[C@H](NCc2cc(C)ccc2F)C1 ZINC001366391764 1337555489 /nfs/dbraw/zinc/55/54/89/1337555489.db2.gz XZCOHURNSMGNCR-KRWDZBQOSA-N 1 3 335.467 2.557 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N1CC[C@@H](CNC/C(Cl)=C\Cl)C1 ZINC001366402864 1337560682 /nfs/dbraw/zinc/56/06/82/1337560682.db2.gz NOJZVPUUPNZNFW-FBLKXBDISA-N 1 3 348.318 2.618 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N1CC[C@@H](CNC/C(Cl)=C\Cl)C1 ZINC001366402864 1337560684 /nfs/dbraw/zinc/56/06/84/1337560684.db2.gz NOJZVPUUPNZNFW-FBLKXBDISA-N 1 3 348.318 2.618 10 0 EFAEHO CC[C@@H]([NH2+]C[C@H]1CCN(C(=O)CN2CCCC2)C1)c1ccc(F)cc1 ZINC001366411484 1337564213 /nfs/dbraw/zinc/56/42/13/1337564213.db2.gz PMXWCYOXNRGLHQ-VQIMIIECSA-N 1 3 347.478 2.811 10 0 EFAEHO C[C@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+]CC1CCC2(CC2)CC1 ZINC001366473476 1337616366 /nfs/dbraw/zinc/61/63/66/1337616366.db2.gz LPGGKQZYAKOMCP-MRXNPFEDSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1ccc2ncccc2c1)N(C)C ZINC001366473955 1337616964 /nfs/dbraw/zinc/61/69/64/1337616964.db2.gz KOUPHMPIWYLDMJ-HNAYVOBHSA-N 1 3 342.487 2.559 10 0 EFAEHO CCN(CCNC(=O)C12CC[NH+](CC1)C2)[C@@H](C)c1cccc(Cl)c1 ZINC001366637821 1337783899 /nfs/dbraw/zinc/78/38/99/1337783899.db2.gz HSZWPYXYGLPYIP-HNNXBMFYSA-N 1 3 349.906 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+](Cc2ccc(C3CC3)cc2)C1 ZINC001366706541 1337900631 /nfs/dbraw/zinc/90/06/31/1337900631.db2.gz BCHRLNRJXNTXKD-SFHVURJKSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+](Cc2ccc(C3CC3)cc2)C1 ZINC001366706541 1337900633 /nfs/dbraw/zinc/90/06/33/1337900633.db2.gz BCHRLNRJXNTXKD-SFHVURJKSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+]([C@H](C)c2ccc(F)cc2)C1 ZINC001366710749 1337905708 /nfs/dbraw/zinc/90/57/08/1337905708.db2.gz KLUKCWZPXKUJHR-CVEARBPZSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+]([C@H](C)c2ccc(F)cc2)C1 ZINC001366710749 1337905710 /nfs/dbraw/zinc/90/57/10/1337905710.db2.gz KLUKCWZPXKUJHR-CVEARBPZSA-N 1 3 335.467 2.665 10 0 EFAEHO CCC[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC1CCC1 ZINC001366721076 1337921554 /nfs/dbraw/zinc/92/15/54/1337921554.db2.gz LWOBGEMCCLSOLN-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO CCC[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC1CCC1 ZINC001366721076 1337921557 /nfs/dbraw/zinc/92/15/57/1337921557.db2.gz LWOBGEMCCLSOLN-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](F)CC[N@H+](CCNC(=O)C(C)(C)N1CCCCC1)C1CC1 ZINC001366741721 1337951464 /nfs/dbraw/zinc/95/14/64/1337951464.db2.gz QVTXUKRKEWODJX-OAHLLOKOSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H](F)CC[N@@H+](CCNC(=O)C(C)(C)N1CCCCC1)C1CC1 ZINC001366741721 1337951470 /nfs/dbraw/zinc/95/14/70/1337951470.db2.gz QVTXUKRKEWODJX-OAHLLOKOSA-N 1 3 327.488 2.580 10 0 EFAEHO CCc1ccccc1C[N@H+]1CC[C@@H](CCNC(=O)[C@@H](CC)N(C)C)C1 ZINC001366844572 1338107913 /nfs/dbraw/zinc/10/79/13/1338107913.db2.gz QJDOHWIHPPBFSQ-YLJYHZDGSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CC[C@@H](CCNC(=O)[C@@H](CC)N(C)C)C1 ZINC001366844572 1338107915 /nfs/dbraw/zinc/10/79/15/1338107915.db2.gz QJDOHWIHPPBFSQ-YLJYHZDGSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](C[N@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001366885356 1338165917 /nfs/dbraw/zinc/16/59/17/1338165917.db2.gz UYDJKMXWFWNLBQ-IAGOWNOFSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](C[N@@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001366885356 1338165918 /nfs/dbraw/zinc/16/59/18/1338165918.db2.gz UYDJKMXWFWNLBQ-IAGOWNOFSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001366893407 1338175759 /nfs/dbraw/zinc/17/57/59/1338175759.db2.gz NKIGTPPDBRHWRZ-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001366893407 1338175764 /nfs/dbraw/zinc/17/57/64/1338175764.db2.gz NKIGTPPDBRHWRZ-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@@H]1CCN([C@@H]2CCc3ccc(F)cc32)C1 ZINC001367072354 1338352187 /nfs/dbraw/zinc/35/21/87/1338352187.db2.gz KCFWBIRWOPEOLB-IEBWSBKVSA-N 1 3 347.478 2.688 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@H]1CCN([C@H]2CCc3ccc(F)cc32)C1 ZINC001367072350 1338352202 /nfs/dbraw/zinc/35/22/02/1338352202.db2.gz KCFWBIRWOPEOLB-HKUYNNGSSA-N 1 3 347.478 2.688 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]Cc1cncc(C)c1 ZINC001367125398 1338413875 /nfs/dbraw/zinc/41/38/75/1338413875.db2.gz DVRWOSCYMXPMRP-OALUTQOASA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]Cc1cncc(C)c1 ZINC001367125405 1338414096 /nfs/dbraw/zinc/41/40/96/1338414096.db2.gz DVRWOSCYMXPMRP-RTBURBONSA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@H](C(=O)N[C@@](C)(C[NH2+]Cc1ccccc1F)C1CC1)N(C)C ZINC001367172346 1338472136 /nfs/dbraw/zinc/47/21/36/1338472136.db2.gz RICXHYDDSDREIO-MJGOQNOKSA-N 1 3 335.467 2.540 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CC[C@H](NC(=O)CN(C)C(C)C)CC2)c(C)n1 ZINC001367199291 1338505343 /nfs/dbraw/zinc/50/53/43/1338505343.db2.gz DXPCZCIGUUSOIB-WGSAOQKQSA-N 1 3 346.519 2.556 10 0 EFAEHO CC[C@@H](C(=O)N[C@](C)(C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001367202674 1338509047 /nfs/dbraw/zinc/50/90/47/1338509047.db2.gz YZEXBAGORVRSGG-PKOBYXMFSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001367228637 1338537009 /nfs/dbraw/zinc/53/70/09/1338537009.db2.gz RIRUXSWNGVABIW-QZTJIDSGSA-N 1 3 335.467 2.691 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001367268008 1338567793 /nfs/dbraw/zinc/56/77/93/1338567793.db2.gz QYYQDAMJLBCETA-QGZVFWFLSA-N 1 3 331.504 2.711 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]C/C=C/Cl)CCCC1 ZINC001367327745 1338626964 /nfs/dbraw/zinc/62/69/64/1338626964.db2.gz BUOKRYKXTBDXRT-SHADCFSKSA-N 1 3 327.900 2.630 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)[C@H]2CCCN2C)cc1 ZINC001367373141 1338667847 /nfs/dbraw/zinc/66/78/47/1338667847.db2.gz HQYKNSHSZRAPGW-VQIMIIECSA-N 1 3 331.504 2.841 10 0 EFAEHO C[C@@H](C[NH2+]C[C@@H]1CCC(F)(F)C1)N(C)C(=O)CN(C)CC(C)(C)C ZINC001367387585 1338684402 /nfs/dbraw/zinc/68/44/02/1338684402.db2.gz VQRYHGKZHPSKAX-LSDHHAIUSA-N 1 3 347.494 2.836 10 0 EFAEHO C[C@@H](C[NH2+][C@@H]1CCCc2ccc(F)cc21)N(C)C(=O)CN1CCCC1 ZINC001367404378 1338701941 /nfs/dbraw/zinc/70/19/41/1338701941.db2.gz LPDATBHRYBOTPZ-HNAYVOBHSA-N 1 3 347.478 2.735 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([C@H](C)[NH2+]Cc2ccsc2)C1 ZINC001367434235 1338735805 /nfs/dbraw/zinc/73/58/05/1338735805.db2.gz AXLKYVRXHKUJOZ-RDJZCZTQSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1cccc(F)c1 ZINC001367470499 1338770299 /nfs/dbraw/zinc/77/02/99/1338770299.db2.gz YVCNIVOALISCTF-OALUTQOASA-N 1 3 349.494 2.929 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)[C@H](C(C)C)N(C)C)C(C)C)c(C)n1 ZINC001367486073 1338786238 /nfs/dbraw/zinc/78/62/38/1338786238.db2.gz BBNMJGFRGMRODH-MOPGFXCFSA-N 1 3 348.535 2.515 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccsc1)C(C)C)N(C)C ZINC001367486949 1338787111 /nfs/dbraw/zinc/78/71/11/1338787111.db2.gz CNLREEQRSHUZTA-HZPDHXFCSA-N 1 3 325.522 2.565 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]CC1CCC(F)(F)CC1)C(C)C)N(C)C ZINC001367488302 1338788442 /nfs/dbraw/zinc/78/84/42/1338788442.db2.gz GZTYELGWXFEVMS-JKSUJKDBSA-N 1 3 347.494 2.883 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]CC1CCC(F)(F)CC1)C(C)C)N(C)C ZINC001367488299 1338788501 /nfs/dbraw/zinc/78/85/01/1338788501.db2.gz GZTYELGWXFEVMS-HZPDHXFCSA-N 1 3 347.494 2.883 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)cc1 ZINC001367494415 1338793645 /nfs/dbraw/zinc/79/36/45/1338793645.db2.gz YTILIOGPERJXKA-XLIONFOSSA-N 1 3 345.531 2.821 10 0 EFAEHO CC(C)c1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@H+](C)C2)cc1 ZINC001367549594 1338860034 /nfs/dbraw/zinc/86/00/34/1338860034.db2.gz DITPXUSUDRYUKY-IBGZPJMESA-N 1 3 331.504 2.652 10 0 EFAEHO CC(C)c1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@@H+](C)C2)cc1 ZINC001367549594 1338860040 /nfs/dbraw/zinc/86/00/40/1338860040.db2.gz DITPXUSUDRYUKY-IBGZPJMESA-N 1 3 331.504 2.652 10 0 EFAEHO CCN(CC[NH2+][C@H](C)c1cccc(OC)c1)C(=O)CN1CC[C@@H](C)C1 ZINC001367646667 1338901569 /nfs/dbraw/zinc/90/15/69/1338901569.db2.gz IHMRXWPKIYCTDE-IAGOWNOFSA-N 1 3 347.503 2.536 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)C[C@@H]2CC[N@H+](C)C2)c(Cl)c1 ZINC001367706001 1338944129 /nfs/dbraw/zinc/94/41/29/1338944129.db2.gz LIJXWWNRSKLZOY-CABCVRRESA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)C[C@@H]2CC[N@@H+](C)C2)c(Cl)c1 ZINC001367706001 1338944130 /nfs/dbraw/zinc/94/41/30/1338944130.db2.gz LIJXWWNRSKLZOY-CABCVRRESA-N 1 3 337.895 2.585 10 0 EFAEHO C[C@@H](CN[C@@H](C)c1ccccc1F)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001367755542 1338983028 /nfs/dbraw/zinc/98/30/28/1338983028.db2.gz XFOUCLNBWHHYQT-VGWMRTNUSA-N 1 3 335.467 2.711 10 0 EFAEHO C[C@@H](CN[C@@H](C)c1ccccc1F)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001367755542 1338983034 /nfs/dbraw/zinc/98/30/34/1338983034.db2.gz XFOUCLNBWHHYQT-VGWMRTNUSA-N 1 3 335.467 2.711 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H](C)NC(=O)[C@H]2CCCCN2CC)c1 ZINC001367776240 1339000786 /nfs/dbraw/zinc/00/07/86/1339000786.db2.gz YJYLIRXGZQXRDD-QFBILLFUSA-N 1 3 331.504 2.718 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(Cl)c1)NC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001367802573 1339022794 /nfs/dbraw/zinc/02/27/94/1339022794.db2.gz FGJZOXKVTPWPIR-KSSFIOAISA-N 1 3 349.906 2.618 10 0 EFAEHO C[C@H](CN(C)C/C=C\c1ccccc1)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001367839559 1339056481 /nfs/dbraw/zinc/05/64/81/1339056481.db2.gz YGYFYLAKJKUSIN-WRSCXJRQSA-N 1 3 343.515 2.867 10 0 EFAEHO C[C@H](CN(C)C/C=C\c1ccccc1)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001367839559 1339056484 /nfs/dbraw/zinc/05/64/84/1339056484.db2.gz YGYFYLAKJKUSIN-WRSCXJRQSA-N 1 3 343.515 2.867 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)C[N@H+](C)CC1CC(F)(F)C1 ZINC001367840058 1339056971 /nfs/dbraw/zinc/05/69/71/1339056971.db2.gz XFRNIZJYEIGZRJ-HOCLYGCPSA-N 1 3 345.478 2.731 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)CC1CC(F)(F)C1 ZINC001367840058 1339056973 /nfs/dbraw/zinc/05/69/73/1339056973.db2.gz XFRNIZJYEIGZRJ-HOCLYGCPSA-N 1 3 345.478 2.731 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(C(F)F)c1)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001367854560 1339070537 /nfs/dbraw/zinc/07/05/37/1339070537.db2.gz JIHGGTFUTSIFFF-BBRMVZONSA-N 1 3 339.430 2.512 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(C(F)F)c1)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001367854560 1339070538 /nfs/dbraw/zinc/07/05/38/1339070538.db2.gz JIHGGTFUTSIFFF-BBRMVZONSA-N 1 3 339.430 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001367858923 1339073532 /nfs/dbraw/zinc/07/35/32/1339073532.db2.gz FXHMICIWCDMGEF-LSDHHAIUSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001367858923 1339073533 /nfs/dbraw/zinc/07/35/33/1339073533.db2.gz FXHMICIWCDMGEF-LSDHHAIUSA-N 1 3 333.467 2.589 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H](NC(=O)C(C)(C)N1CCCC1)C1CC1 ZINC001367897010 1339093066 /nfs/dbraw/zinc/09/30/66/1339093066.db2.gz COVGNVXRUDPVFI-IBGZPJMESA-N 1 3 343.515 2.854 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C[NH2+]CC1CCC2(CC2)CC1)C1CC1)N(C)C ZINC001367902818 1339096893 /nfs/dbraw/zinc/09/68/93/1339096893.db2.gz PWVUVJOCVBSTJT-MSOLQXFVSA-N 1 3 335.536 2.781 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@H](CNCc1ccccc1F)C1CC1 ZINC001367909634 1339100695 /nfs/dbraw/zinc/10/06/95/1339100695.db2.gz RJPSJFHUJCIDLX-IEBWSBKVSA-N 1 3 347.478 2.685 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@H](CNCc1ccccc1F)C1CC1 ZINC001367909634 1339100696 /nfs/dbraw/zinc/10/06/96/1339100696.db2.gz RJPSJFHUJCIDLX-IEBWSBKVSA-N 1 3 347.478 2.685 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]Cc1ccc(F)cc1 ZINC001367926383 1339112389 /nfs/dbraw/zinc/11/23/89/1339112389.db2.gz GMVPYACIJOAUPU-IEBWSBKVSA-N 1 3 349.494 2.883 10 0 EFAEHO CCc1ccc(CNC2(CNC(=O)CC[C@H]3CCC[N@@H+]3C)CC2)cc1 ZINC001368003354 1339152531 /nfs/dbraw/zinc/15/25/31/1339152531.db2.gz ONNAATXOCAAASX-LJQANCHMSA-N 1 3 343.515 2.862 10 0 EFAEHO CCc1ccc(CNC2(CNC(=O)CC[C@H]3CCC[N@H+]3C)CC2)cc1 ZINC001368003354 1339152534 /nfs/dbraw/zinc/15/25/34/1339152534.db2.gz ONNAATXOCAAASX-LJQANCHMSA-N 1 3 343.515 2.862 10 0 EFAEHO CC[C@@H]([NH2+]C1(CNC(=O)[C@H](C(C)C)N(C)C)CC1)c1ccccc1 ZINC001368005284 1339153925 /nfs/dbraw/zinc/15/39/25/1339153925.db2.gz CEAXFZUSLHAODF-MSOLQXFVSA-N 1 3 331.504 2.962 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)C(C)(C)[N@H+](C)C2CCCC2)CC1 ZINC001368011423 1339156929 /nfs/dbraw/zinc/15/69/29/1339156929.db2.gz HIHIZDOCZSZBSC-AWEZNQCLSA-N 1 3 327.488 2.626 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)C(C)(C)[N@@H+](C)C2CCCC2)CC1 ZINC001368011423 1339156932 /nfs/dbraw/zinc/15/69/32/1339156932.db2.gz HIHIZDOCZSZBSC-AWEZNQCLSA-N 1 3 327.488 2.626 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CC1)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001368011987 1339157168 /nfs/dbraw/zinc/15/71/68/1339157168.db2.gz HJXQXDBKUFNUSL-JKSUJKDBSA-N 1 3 333.501 2.503 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CC1)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001368011987 1339157170 /nfs/dbraw/zinc/15/71/70/1339157170.db2.gz HJXQXDBKUFNUSL-JKSUJKDBSA-N 1 3 333.501 2.503 10 0 EFAEHO C[NH+](C)CC1(C(=O)NCC2(NCc3ccc(C4CC4)cc3)CC2)CC1 ZINC001368024235 1339163181 /nfs/dbraw/zinc/16/31/81/1339163181.db2.gz WPKLBOIOONKWEJ-UHFFFAOYSA-N 1 3 341.499 2.644 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1(N[C@@H]2CCc3c2cccc3Cl)CC1 ZINC001368031978 1339166530 /nfs/dbraw/zinc/16/65/30/1339166530.db2.gz RHRGRZMRRRNQLM-QGZVFWFLSA-N 1 3 349.906 2.908 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1(N[C@@H]2CCc3c2cccc3Cl)CC1 ZINC001368031978 1339166533 /nfs/dbraw/zinc/16/65/33/1339166533.db2.gz RHRGRZMRRRNQLM-QGZVFWFLSA-N 1 3 349.906 2.908 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NCC2(N[C@H]3CCc4c3cccc4Cl)CC2)C1 ZINC001368035461 1339168440 /nfs/dbraw/zinc/16/84/40/1339168440.db2.gz MDDPIOHBBIDQKY-GUYCJALGSA-N 1 3 347.890 2.517 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NCC2(N[C@H]3CCc4c3cccc4Cl)CC2)C1 ZINC001368035461 1339168441 /nfs/dbraw/zinc/16/84/41/1339168441.db2.gz MDDPIOHBBIDQKY-GUYCJALGSA-N 1 3 347.890 2.517 10 0 EFAEHO CC[C@H](F)C[N@@H+]1CC[C@@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001368042138 1339171873 /nfs/dbraw/zinc/17/18/73/1339171873.db2.gz GVMFQQFNHHNMAE-MSOLQXFVSA-N 1 3 341.515 2.635 10 0 EFAEHO CC[C@H](F)C[N@H+]1CC[C@@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001368042138 1339171874 /nfs/dbraw/zinc/17/18/74/1339171874.db2.gz GVMFQQFNHHNMAE-MSOLQXFVSA-N 1 3 341.515 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2ccc3ccccc3c2)CC1 ZINC001368044797 1339173816 /nfs/dbraw/zinc/17/38/16/1339173816.db2.gz RBNZINLKYFPFAC-UHFFFAOYSA-N 1 3 339.483 2.918 10 0 EFAEHO CC[C@H](C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC1CC1)[NH+](CC)CC ZINC001368054549 1339180119 /nfs/dbraw/zinc/18/01/19/1339180119.db2.gz VTYVCLNPKBGDTB-CEXWTWQISA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]Cc2cc(C)ccc2F)C[C@H]1C ZINC001368105124 1339196182 /nfs/dbraw/zinc/19/61/82/1339196182.db2.gz LEFDYZSDCLMTNO-AEFFLSMTSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)[C@H](C)C1 ZINC001368107975 1339197451 /nfs/dbraw/zinc/19/74/51/1339197451.db2.gz WSUCDSZLYHPWTC-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)cc1 ZINC001368109410 1339197740 /nfs/dbraw/zinc/19/77/40/1339197740.db2.gz RVDRQEWCQMQBDL-PKOBYXMFSA-N 1 3 331.504 2.804 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001368113034 1339198979 /nfs/dbraw/zinc/19/89/79/1339198979.db2.gz CACYQRXJHZDNQC-GOSISDBHSA-N 1 3 342.487 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@@H]1CCc2c1cccc2F ZINC001368124312 1339204582 /nfs/dbraw/zinc/20/45/82/1339204582.db2.gz VADBJVJGGWOXSO-DNVCBOLYSA-N 1 3 347.478 2.734 10 0 EFAEHO CC[C@@H](C(=O)N[C@]1(C)CC[N@H+](CC2CC(F)(F)C2)C1)N(CC)CC ZINC001368168876 1339232945 /nfs/dbraw/zinc/23/29/45/1339232945.db2.gz FCLOHMQLTPKVCP-DOTOQJQBSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H](C(=O)N[C@]1(C)CC[N@@H+](CC2CC(F)(F)C2)C1)N(CC)CC ZINC001368168876 1339232947 /nfs/dbraw/zinc/23/29/47/1339232947.db2.gz FCLOHMQLTPKVCP-DOTOQJQBSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001368195237 1339248290 /nfs/dbraw/zinc/24/82/90/1339248290.db2.gz KDUNWAYRZQSGAE-MAUKXSAKSA-N 1 3 329.504 2.541 10 0 EFAEHO CC[C@H](C)C[NH+]1CCC(C)(CNC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001368209750 1339257101 /nfs/dbraw/zinc/25/71/01/1339257101.db2.gz XPRXXWSECFBJLF-DLBZAZTESA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)N1CCC(F)(F)[C@@H](CNC(=O)CCC[NH+]2CCCCC2)C1 ZINC001368253812 1339284641 /nfs/dbraw/zinc/28/46/41/1339284641.db2.gz UKGONMNHLVCMCE-INIZCTEOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC1CC(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)CN2CC[C@@H](C)C2)C3)C1 ZINC001368344929 1339308360 /nfs/dbraw/zinc/30/83/60/1339308360.db2.gz JSQNZVNFYNDYBJ-AZMWJMFLSA-N 1 3 347.547 2.734 10 0 EFAEHO CC1CC(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)CN2CC[C@@H](C)C2)C3)C1 ZINC001368344929 1339308363 /nfs/dbraw/zinc/30/83/63/1339308363.db2.gz JSQNZVNFYNDYBJ-AZMWJMFLSA-N 1 3 347.547 2.734 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]CC[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001368418513 1339351933 /nfs/dbraw/zinc/35/19/33/1339351933.db2.gz LJAZRLOJIXYLFE-RBUKOAKNSA-N 1 3 343.515 2.980 10 0 EFAEHO CC[C@H](C(=O)N1CC2(C1)CC[NH+](C[C@@H](C)CC(C)C)CC2)N(C)C ZINC001368417948 1339352230 /nfs/dbraw/zinc/35/22/30/1339352230.db2.gz BSPODLNSYGKLMQ-ZWKOTPCHSA-N 1 3 337.552 2.933 10 0 EFAEHO C[C@@H](F)CC[NH+]1CCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)CC1 ZINC001368420263 1339353922 /nfs/dbraw/zinc/35/39/22/1339353922.db2.gz BVUZRFWWNDEXPR-MRXNPFEDSA-N 1 3 341.515 2.637 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H]2CCCCN2C(=O)CN(C)C(C)C)c1 ZINC001368448350 1339384294 /nfs/dbraw/zinc/38/42/94/1339384294.db2.gz DWHTWJOITRDEGN-GOSISDBHSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)C[N@@H+]1CCc2c(CNC(=O)C3(N(C)C)CCC3)cccc2C1 ZINC001368452210 1339389270 /nfs/dbraw/zinc/38/92/70/1339389270.db2.gz YXVCMKPUJCJOMS-UHFFFAOYSA-N 1 3 343.515 2.801 10 0 EFAEHO CC(C)C[N@H+]1CCc2c(CNC(=O)C3(N(C)C)CCC3)cccc2C1 ZINC001368452210 1339389274 /nfs/dbraw/zinc/38/92/74/1339389274.db2.gz YXVCMKPUJCJOMS-UHFFFAOYSA-N 1 3 343.515 2.801 10 0 EFAEHO CN(CCC[N@H+](C)CC[C@@H]1CCCC1(F)F)C(=O)[C@@H]1CCCN1C ZINC001368531911 1339469933 /nfs/dbraw/zinc/46/99/33/1339469933.db2.gz XVUUBUBACMEJHS-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCC[N@@H+](C)CC[C@@H]1CCCC1(F)F)C(=O)[C@@H]1CCCN1C ZINC001368531911 1339469936 /nfs/dbraw/zinc/46/99/36/1339469936.db2.gz XVUUBUBACMEJHS-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO CCC1([NH2+]Cc2cccc(F)c2)CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001368591390 1339537344 /nfs/dbraw/zinc/53/73/44/1339537344.db2.gz PBXJNNFPWWDQPH-GOSISDBHSA-N 1 3 347.478 2.781 10 0 EFAEHO CCC1([NH2+]Cc2csc(C)c2)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001368593176 1339539213 /nfs/dbraw/zinc/53/92/13/1339539213.db2.gz FQCHDJSDHYVZCF-UHFFFAOYSA-N 1 3 346.500 2.883 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2cc(F)ccc2C)C1)N(C)C ZINC001368642686 1339562082 /nfs/dbraw/zinc/56/20/82/1339562082.db2.gz WAIJFNQFHPCRNT-IPELMVKDSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H]1CN(C(=O)CC[NH+](C)C)C[C@H]1C ZINC001368661064 1339573269 /nfs/dbraw/zinc/57/32/69/1339573269.db2.gz ULPINHNUQHXTNM-PBHICJAKSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H]1CN(C(=O)CC[NH+](C)C)C[C@@H]1C ZINC001368661066 1339573629 /nfs/dbraw/zinc/57/36/29/1339573629.db2.gz ULPINHNUQHXTNM-WMLDXEAASA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001368663065 1339575907 /nfs/dbraw/zinc/57/59/07/1339575907.db2.gz ZBJRYEXBMCRHID-PKOBYXMFSA-N 1 3 331.504 2.580 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001368664166 1339576435 /nfs/dbraw/zinc/57/64/35/1339576435.db2.gz PGDJSMZWYDGEJA-KURKYZTESA-N 1 3 335.536 2.735 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CC2CCC3(CC3)CC2)[C@@H](C)C1 ZINC001368671667 1339584694 /nfs/dbraw/zinc/58/46/94/1339584694.db2.gz VHSAUJCXXKFWFX-WMZOPIPTSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1CN(CCCF)CC[C@@H]1c1ccccc1 ZINC001368675432 1339589811 /nfs/dbraw/zinc/58/98/11/1339589811.db2.gz SDWGBPAODNUFHC-RTBURBONSA-N 1 3 349.494 2.662 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1CN(CCCF)CC[C@@H]1c1ccccc1 ZINC001368675432 1339589817 /nfs/dbraw/zinc/58/98/17/1339589817.db2.gz SDWGBPAODNUFHC-RTBURBONSA-N 1 3 349.494 2.662 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]Cc1ccccc1Cl ZINC001368754041 1339679213 /nfs/dbraw/zinc/67/92/13/1339679213.db2.gz JGEQMTAYCXMSMI-AWEZNQCLSA-N 1 3 325.884 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1F ZINC001368756287 1339681578 /nfs/dbraw/zinc/68/15/78/1339681578.db2.gz UOUUJJJJVKIHPL-KBPBESRZSA-N 1 3 341.446 2.850 10 0 EFAEHO CCc1ccc(CN2CC[C@H](NC(=O)[C@H](C(C)C)[NH+](C)C)[C@H]2C)cc1 ZINC001368774535 1339699289 /nfs/dbraw/zinc/69/92/89/1339699289.db2.gz HHJXNKGAEHCWOZ-UXPWSPDFSA-N 1 3 345.531 2.914 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@H]1C[N@H+](C)CCC1CCCCC1 ZINC001368788832 1339716789 /nfs/dbraw/zinc/71/67/89/1339716789.db2.gz LWVHUAAJHBVPGT-RBUKOAKNSA-N 1 3 335.536 2.974 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@H]1C[N@@H+](C)CCC1CCCCC1 ZINC001368788832 1339716792 /nfs/dbraw/zinc/71/67/92/1339716792.db2.gz LWVHUAAJHBVPGT-RBUKOAKNSA-N 1 3 335.536 2.974 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]1C ZINC001368788498 1339717585 /nfs/dbraw/zinc/71/75/85/1339717585.db2.gz CNKUTQNOKQBILF-NEWSRXKRSA-N 1 3 331.504 2.660 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]1C ZINC001368788498 1339717587 /nfs/dbraw/zinc/71/75/87/1339717587.db2.gz CNKUTQNOKQBILF-NEWSRXKRSA-N 1 3 331.504 2.660 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[N@H+](C)CCc1ccc(C)cc1)N(C)C ZINC001368799551 1339733958 /nfs/dbraw/zinc/73/39/58/1339733958.db2.gz JNSXLDPZAQREME-WOJBJXKFSA-N 1 3 345.531 2.801 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[N@@H+](C)CCc1ccc(C)cc1)N(C)C ZINC001368799551 1339733962 /nfs/dbraw/zinc/73/39/62/1339733962.db2.gz JNSXLDPZAQREME-WOJBJXKFSA-N 1 3 345.531 2.801 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CC1CC(NC(=O)CN(C)C2CCC2)C1 ZINC001368806320 1339742139 /nfs/dbraw/zinc/74/21/39/1339742139.db2.gz BBHVWOPGBYVEQU-UHFFFAOYSA-N 1 3 347.478 2.603 10 0 EFAEHO CN(Cc1ccccc1)C[C@@H]1CCCCN1C(=O)C1(C[NH+](C)C)CC1 ZINC001368818538 1339758361 /nfs/dbraw/zinc/75/83/61/1339758361.db2.gz KCYQGSGSGWOLPG-IBGZPJMESA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]Cc2cc(C)ccc2C)C1 ZINC001368823191 1339762908 /nfs/dbraw/zinc/76/29/08/1339762908.db2.gz RGXFVHKCXSLUAP-UHFFFAOYSA-N 1 3 331.504 2.630 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@H+](CCC2CC2)CC(C)(C)C1)N(C)C ZINC001368826878 1339766846 /nfs/dbraw/zinc/76/68/46/1339766846.db2.gz MDQUIQMUGGOUDN-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@@H+](CCC2CC2)CC(C)(C)C1)N(C)C ZINC001368826878 1339766855 /nfs/dbraw/zinc/76/68/55/1339766855.db2.gz MDQUIQMUGGOUDN-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CCC2CC2)CC(C)(C)C1)N(C)C ZINC001368826879 1339767500 /nfs/dbraw/zinc/76/75/00/1339767500.db2.gz MDQUIQMUGGOUDN-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CCC2CC2)CC(C)(C)C1)N(C)C ZINC001368826879 1339767504 /nfs/dbraw/zinc/76/75/04/1339767504.db2.gz MDQUIQMUGGOUDN-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001368840837 1339780663 /nfs/dbraw/zinc/78/06/63/1339780663.db2.gz LUJHEWZFPQOZME-UONOGXRCSA-N 1 3 337.895 2.807 10 0 EFAEHO C[C@H](NCc1ccccc1Cl)[C@H](C)NC(=O)C12CCC[NH+]1CCC2 ZINC001368865070 1339799301 /nfs/dbraw/zinc/79/93/01/1339799301.db2.gz KYVBXIMSANAMJB-GJZGRUSLSA-N 1 3 349.906 2.951 10 0 EFAEHO COc1ccc(CN(C)[C@H](C)CNC(=O)[C@@H]2CCC[N@@H+]2C(C)C)cc1 ZINC001368940458 1339887122 /nfs/dbraw/zinc/88/71/22/1339887122.db2.gz JFBFUBGGVHVKCK-APWZRJJASA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(CN(C)[C@H](C)CNC(=O)[C@@H]2CCC[N@H+]2C(C)C)cc1 ZINC001368940458 1339887128 /nfs/dbraw/zinc/88/71/28/1339887128.db2.gz JFBFUBGGVHVKCK-APWZRJJASA-N 1 3 347.503 2.505 10 0 EFAEHO Cc1ccc(C)c(CN2CC([C@@H](C)NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c1 ZINC001369089953 1339908776 /nfs/dbraw/zinc/90/87/76/1339908776.db2.gz FROAKSFNIIOMPU-MSOLQXFVSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(C)c(CN2CC([C@@H](C)NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c1 ZINC001369089953 1339908777 /nfs/dbraw/zinc/90/87/77/1339908777.db2.gz FROAKSFNIIOMPU-MSOLQXFVSA-N 1 3 343.515 2.582 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C)C1)C1C[NH+](CCCC2CCCC2)C1 ZINC001369094779 1339912048 /nfs/dbraw/zinc/91/20/48/1339912048.db2.gz PUKNSFBDVUATQN-IRXDYDNUSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@H+](CCc2ccccc2)CC1(C)C)N(C)C ZINC001369113318 1339924555 /nfs/dbraw/zinc/92/45/55/1339924555.db2.gz CXWWFIODCWOIHH-OALUTQOASA-N 1 3 345.531 2.642 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@@H+](CCc2ccccc2)CC1(C)C)N(C)C ZINC001369113318 1339924563 /nfs/dbraw/zinc/92/45/63/1339924563.db2.gz CXWWFIODCWOIHH-OALUTQOASA-N 1 3 345.531 2.642 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)[C@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001369140845 1339938683 /nfs/dbraw/zinc/93/86/83/1339938683.db2.gz JIBSTQKSLMDBIG-LWYYNNOASA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)[C@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001369140845 1339938685 /nfs/dbraw/zinc/93/86/85/1339938685.db2.gz JIBSTQKSLMDBIG-LWYYNNOASA-N 1 3 349.563 2.981 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+][C@H](CNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001370275602 1340003082 /nfs/dbraw/zinc/00/30/82/1340003082.db2.gz ODKIRZNLAGGLKS-VQIMIIECSA-N 1 3 331.504 2.881 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1)C1CC1 ZINC001370280150 1340006108 /nfs/dbraw/zinc/00/61/08/1340006108.db2.gz YMUDLBKTJWDJFT-RDTXWAMCSA-N 1 3 335.467 2.711 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[N@H+](C)CC2CC(C)(C)C2)C1 ZINC001370319530 1340033307 /nfs/dbraw/zinc/03/33/07/1340033307.db2.gz ZYCYJJNUEJJJSI-KRWDZBQOSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[N@@H+](C)CC2CC(C)(C)C2)C1 ZINC001370319530 1340033310 /nfs/dbraw/zinc/03/33/10/1340033310.db2.gz ZYCYJJNUEJJJSI-KRWDZBQOSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@H+](CCC(F)(F)F)CC[C@@H]21 ZINC001370592903 1340153374 /nfs/dbraw/zinc/15/33/74/1340153374.db2.gz OOFYDLCFNKOXEU-CABCVRRESA-N 1 3 349.441 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@@H+](CCC(F)(F)F)CC[C@@H]21 ZINC001370592903 1340153376 /nfs/dbraw/zinc/15/33/76/1340153376.db2.gz OOFYDLCFNKOXEU-CABCVRRESA-N 1 3 349.441 2.592 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc3c(c2)CCC3)C1)N(C)C ZINC001370646711 1340179562 /nfs/dbraw/zinc/17/95/62/1340179562.db2.gz DGNLPOMQWQJRMK-VVHHDAOASA-N 1 3 343.515 2.813 10 0 EFAEHO Cc1ccc(C[N@H+]2CCC[C@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001370797048 1340213260 /nfs/dbraw/zinc/21/32/60/1340213260.db2.gz WLNQUWVFAYMDKS-LJQANCHMSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccc(C[N@@H+]2CCC[C@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001370797048 1340213264 /nfs/dbraw/zinc/21/32/64/1340213264.db2.gz WLNQUWVFAYMDKS-LJQANCHMSA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001370972872 1340316787 /nfs/dbraw/zinc/31/67/87/1340316787.db2.gz VREKODATHKJDMI-MJGOQNOKSA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001370972872 1340316790 /nfs/dbraw/zinc/31/67/90/1340316790.db2.gz VREKODATHKJDMI-MJGOQNOKSA-N 1 3 331.504 2.744 10 0 EFAEHO CCCN(C)CC(=O)NC1CCC([NH2+]Cc2cc(C)ccc2F)CC1 ZINC001371072799 1340345311 /nfs/dbraw/zinc/34/53/11/1340345311.db2.gz QCQSBMBGDBXMIZ-UHFFFAOYSA-N 1 3 349.494 2.993 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC2CCC([NH2+]CC=C(Cl)Cl)CC2)C1 ZINC001371079797 1340351492 /nfs/dbraw/zinc/35/14/92/1340351492.db2.gz SOFDODUJUPECGC-IYXRBSQSSA-N 1 3 348.318 2.664 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CC[C@H]1CCCC1(F)F ZINC001371305062 1340486540 /nfs/dbraw/zinc/48/65/40/1340486540.db2.gz HCAWYFRHZCNZAT-HUUCEWRRSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001371306003 1340486791 /nfs/dbraw/zinc/48/67/91/1340486791.db2.gz JSGPMRYZHAAHOP-MRXNPFEDSA-N 1 3 343.515 2.644 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001371305999 1340486899 /nfs/dbraw/zinc/48/68/99/1340486899.db2.gz JSGPMRYZHAAHOP-INIZCTEOSA-N 1 3 343.515 2.644 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)NCc1cc2ccccc2o1 ZINC001371335557 1340506048 /nfs/dbraw/zinc/50/60/48/1340506048.db2.gz QWCCLUIXEXQHKU-ZOBUZTSGSA-N 1 3 343.471 2.757 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)NCc1cc2ccccc2o1 ZINC001371335557 1340506059 /nfs/dbraw/zinc/50/60/59/1340506059.db2.gz QWCCLUIXEXQHKU-ZOBUZTSGSA-N 1 3 343.471 2.757 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001371366117 1340532516 /nfs/dbraw/zinc/53/25/16/1340532516.db2.gz UXDBBSRGZUNGSB-KDOFPFPSSA-N 1 3 331.504 2.548 10 0 EFAEHO CC[C@H](N[C@H]1CCN(C(=O)CC[NH+](C)C)C1)c1ccc(F)cc1F ZINC001371529520 1340634373 /nfs/dbraw/zinc/63/43/73/1340634373.db2.gz MFDUHOFIWYGELT-YOEHRIQHSA-N 1 3 339.430 2.558 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)CC[C@@H]2CCC[N@H+]2C)C2CC2)cc1 ZINC001372806612 1340809886 /nfs/dbraw/zinc/80/98/86/1340809886.db2.gz CAFSHBZTLMJCCL-IBGZPJMESA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)CC[C@@H]2CCC[N@@H+]2C)C2CC2)cc1 ZINC001372806612 1340809890 /nfs/dbraw/zinc/80/98/90/1340809890.db2.gz CAFSHBZTLMJCCL-IBGZPJMESA-N 1 3 343.515 2.950 10 0 EFAEHO C[C@H](F)CC[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001372860174 1340847490 /nfs/dbraw/zinc/84/74/90/1340847490.db2.gz QDKHNZICPUZISV-KSSFIOAISA-N 1 3 345.478 2.528 10 0 EFAEHO C[C@H](F)CC[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001372860174 1340847496 /nfs/dbraw/zinc/84/74/96/1340847496.db2.gz QDKHNZICPUZISV-KSSFIOAISA-N 1 3 345.478 2.528 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CC[C@H](CCNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001373190695 1340940606 /nfs/dbraw/zinc/94/06/06/1340940606.db2.gz LCAKATOIPNBMJV-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CC[C@H](CCNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001373190695 1340940607 /nfs/dbraw/zinc/94/06/07/1340940607.db2.gz LCAKATOIPNBMJV-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@H]1CC[N@H+](Cc2cc(C)ccc2F)C1)N(C)C ZINC001373220997 1340954189 /nfs/dbraw/zinc/95/41/89/1340954189.db2.gz CUPFRQLDKSMRSG-LPHOPBHVSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2cc(C)ccc2F)C1)N(C)C ZINC001373220997 1340954190 /nfs/dbraw/zinc/95/41/90/1340954190.db2.gz CUPFRQLDKSMRSG-LPHOPBHVSA-N 1 3 349.494 2.803 10 0 EFAEHO CCCC[N@@H+]1CC[C@@H](CCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001373226461 1340956862 /nfs/dbraw/zinc/95/68/62/1340956862.db2.gz MCWSGIOUIDXBRK-VQIMIIECSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCC[N@H+]1CC[C@@H](CCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001373226461 1340956863 /nfs/dbraw/zinc/95/68/63/1340956863.db2.gz MCWSGIOUIDXBRK-VQIMIIECSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001373241390 1340963975 /nfs/dbraw/zinc/96/39/75/1340963975.db2.gz BBAWFWRFPRVLFX-GOSISDBHSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001373241390 1340963976 /nfs/dbraw/zinc/96/39/76/1340963976.db2.gz BBAWFWRFPRVLFX-GOSISDBHSA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@H+](CCc2ccccc2F)C1 ZINC001373243775 1340965276 /nfs/dbraw/zinc/96/52/76/1340965276.db2.gz GTAFVJXKXVXOBD-QGZVFWFLSA-N 1 3 349.494 2.537 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@@H+](CCc2ccccc2F)C1 ZINC001373243775 1340965278 /nfs/dbraw/zinc/96/52/78/1340965278.db2.gz GTAFVJXKXVXOBD-QGZVFWFLSA-N 1 3 349.494 2.537 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@H+](C/C=C\c2ccccc2)C1 ZINC001373245656 1340966023 /nfs/dbraw/zinc/96/60/23/1340966023.db2.gz KLPRWARQEAIZHD-SONCPKABSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@@H+](C/C=C\c2ccccc2)C1 ZINC001373245656 1340966024 /nfs/dbraw/zinc/96/60/24/1340966024.db2.gz KLPRWARQEAIZHD-SONCPKABSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[N@H+](C)CCc2ccc(C)cc2)C1)N(C)C ZINC001373306179 1340983966 /nfs/dbraw/zinc/98/39/66/1340983966.db2.gz XXCHDJPSMFPMOU-VQTJNVASSA-N 1 3 345.531 2.658 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[N@@H+](C)CCc2ccc(C)cc2)C1)N(C)C ZINC001373306179 1340983967 /nfs/dbraw/zinc/98/39/67/1340983967.db2.gz XXCHDJPSMFPMOU-VQTJNVASSA-N 1 3 345.531 2.658 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+](C)C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001373317818 1340989199 /nfs/dbraw/zinc/98/91/99/1340989199.db2.gz VIOFCDFSQXPFEW-LJQANCHMSA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1cccc(C)c1C[N@H+](C)C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001373317818 1340989200 /nfs/dbraw/zinc/98/92/00/1340989200.db2.gz VIOFCDFSQXPFEW-LJQANCHMSA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1cccc(C)c1CN1CC(CNC(=O)CC[C@@H]2CCC[N@H+]2C)C1 ZINC001373512744 1341041377 /nfs/dbraw/zinc/04/13/77/1341041377.db2.gz DTAPCIGCAULNMV-IBGZPJMESA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1cccc(C)c1CN1CC(CNC(=O)CC[C@@H]2CCC[N@@H+]2C)C1 ZINC001373512744 1341041378 /nfs/dbraw/zinc/04/13/78/1341041378.db2.gz DTAPCIGCAULNMV-IBGZPJMESA-N 1 3 343.515 2.726 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N1CC[C@@H](N(C)C(=O)CC[NH+](C)C)C1 ZINC001373678030 1341095654 /nfs/dbraw/zinc/09/56/54/1341095654.db2.gz ANRIKLIVOLUMFZ-MSOLQXFVSA-N 1 3 335.467 2.761 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001373678666 1341096103 /nfs/dbraw/zinc/09/61/03/1341096103.db2.gz FFACXTYZZUJEPU-QZTJIDSGSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001373678666 1341096104 /nfs/dbraw/zinc/09/61/04/1341096104.db2.gz FFACXTYZZUJEPU-QZTJIDSGSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)c1ccc(CN2CC[C@H](N(C)C(=O)CC[NH+](C)C)C2)cc1 ZINC001373679621 1341096922 /nfs/dbraw/zinc/09/69/22/1341096922.db2.gz KBPGJHLJNKGWJV-IBGZPJMESA-N 1 3 331.504 2.794 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001373687208 1341101226 /nfs/dbraw/zinc/10/12/26/1341101226.db2.gz FFACXTYZZUJEPU-MSOLQXFVSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001373687208 1341101227 /nfs/dbraw/zinc/10/12/27/1341101227.db2.gz FFACXTYZZUJEPU-MSOLQXFVSA-N 1 3 335.536 2.686 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@H]1CCN([C@H](C)c2cccc(OC)c2)C1 ZINC001373707559 1341113477 /nfs/dbraw/zinc/11/34/77/1341113477.db2.gz HXCNVJCNJYGNSD-AEFFLSMTSA-N 1 3 347.503 2.631 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@@H]1CCN([C@@H](C)c2cccc(OC)c2)C1 ZINC001373707561 1341113572 /nfs/dbraw/zinc/11/35/72/1341113572.db2.gz HXCNVJCNJYGNSD-FUHWJXTLSA-N 1 3 347.503 2.631 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)NCc1cccc(C(C)C)n1 ZINC001373750382 1341133441 /nfs/dbraw/zinc/13/34/41/1341133441.db2.gz ATCJZGNXPQSPDF-SOLBZPMBSA-N 1 3 346.519 2.530 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)NCc1cccc(C(C)C)n1 ZINC001373750382 1341133443 /nfs/dbraw/zinc/13/34/43/1341133443.db2.gz ATCJZGNXPQSPDF-SOLBZPMBSA-N 1 3 346.519 2.530 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](CC)[NH2+]Cc1ccc(C)c(F)c1 ZINC001373759108 1341136991 /nfs/dbraw/zinc/13/69/91/1341136991.db2.gz JNFQCFTYLGPPGI-HKUYNNGSSA-N 1 3 349.494 2.993 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1csc(C)c1 ZINC001373762990 1341138438 /nfs/dbraw/zinc/13/84/38/1341138438.db2.gz VJDIIMZGCBAKFH-IAGOWNOFSA-N 1 3 337.533 2.915 10 0 EFAEHO CC[C@H](CNC(=O)CC[NH+](C)C)NCc1c(C)cccc1Cl ZINC001373789738 1341148133 /nfs/dbraw/zinc/14/81/33/1341148133.db2.gz IDDUHGLKXMSAJJ-CQSZACIVSA-N 1 3 325.884 2.585 10 0 EFAEHO CC[C@@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)NCc1cc(C)ccc1F ZINC001373792644 1341149604 /nfs/dbraw/zinc/14/96/04/1341149604.db2.gz KHSIHMXATXOVHA-ZWKOTPCHSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)NCc1cc(C)ccc1F ZINC001373792644 1341149605 /nfs/dbraw/zinc/14/96/05/1341149605.db2.gz KHSIHMXATXOVHA-ZWKOTPCHSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001373834396 1341167408 /nfs/dbraw/zinc/16/74/08/1341167408.db2.gz IQOGUEXVAATMRY-AEFFLSMTSA-N 1 3 335.467 2.638 10 0 EFAEHO CC[C@H](F)C[NH+]1CCC(CCNC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001373936806 1341221054 /nfs/dbraw/zinc/22/10/54/1341221054.db2.gz DHTNPNODPBYBIX-IRXDYDNUSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001373974403 1341268858 /nfs/dbraw/zinc/26/88/58/1341268858.db2.gz ZHCLYLWUUOZGIY-HZPDHXFCSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC/C(Cl)=C\Cl)CNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001374047007 1341334599 /nfs/dbraw/zinc/33/45/99/1341334599.db2.gz HDCQUIWVZXNKRP-FMNNIJNLSA-N 1 3 336.307 2.522 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(C[NH+](CC3CC4(CCC4)C3)C2)CC1 ZINC001374191429 1341536116 /nfs/dbraw/zinc/53/61/16/1341536116.db2.gz QPIXAPNUKULICY-UHFFFAOYSA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@@H](C[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C(=O)CN(C)C1CCC1 ZINC001374231655 1341583365 /nfs/dbraw/zinc/58/33/65/1341583365.db2.gz FXXMRTQZJKVNPU-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001374249896 1341607906 /nfs/dbraw/zinc/60/79/06/1341607906.db2.gz KMLKVIZWBVOKEM-RHSMWYFYSA-N 1 3 339.911 2.925 10 0 EFAEHO CC[C@@H](F)CNC[C@@H](C)N(C)C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001374259720 1341621799 /nfs/dbraw/zinc/62/17/99/1341621799.db2.gz KWWAKGOEYZTRPK-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC001374325702 1341727355 /nfs/dbraw/zinc/72/73/55/1341727355.db2.gz DHBUEZUFGKBMAU-KBXCAEBGSA-N 1 3 335.467 2.590 10 0 EFAEHO CN(CCN(C)C(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1)Cc1ccccc1 ZINC001392317227 1355976932 /nfs/dbraw/zinc/97/69/32/1355976932.db2.gz YQSKZIJXKTWNEN-HXUWFJFHSA-N 1 3 349.494 2.789 10 0 EFAEHO CN(CCN(C)C(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1)Cc1ccccc1 ZINC001392317227 1355976937 /nfs/dbraw/zinc/97/69/37/1355976937.db2.gz YQSKZIJXKTWNEN-HXUWFJFHSA-N 1 3 349.494 2.789 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2c1cccc2F)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001392319958 1355982011 /nfs/dbraw/zinc/98/20/11/1355982011.db2.gz QVUPMFCMGXTQCS-BEFAXECRSA-N 1 3 347.478 2.545 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2c1cccc2F)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001392319958 1355982016 /nfs/dbraw/zinc/98/20/16/1355982016.db2.gz QVUPMFCMGXTQCS-BEFAXECRSA-N 1 3 347.478 2.545 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C[NH2+]Cc1cc2ccccc2s1)N(C)C ZINC001392525103 1356098265 /nfs/dbraw/zinc/09/82/65/1356098265.db2.gz JLPQEEUDCNANKN-CJNGLKHVSA-N 1 3 333.501 2.836 10 0 EFAEHO CC(C)[C@H](CNC(=O)CC[NH+](C)C)NCc1cccc(F)c1Cl ZINC001374431912 1341914196 /nfs/dbraw/zinc/91/41/96/1341914196.db2.gz PLHRYYIJLDELCX-HNNXBMFYSA-N 1 3 343.874 2.661 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+]CC1CCC(F)(F)CC1 ZINC001374452015 1341934460 /nfs/dbraw/zinc/93/44/60/1341934460.db2.gz KBWAVHJZOMXYKC-INIZCTEOSA-N 1 3 347.494 2.883 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001374504370 1341991823 /nfs/dbraw/zinc/99/18/23/1341991823.db2.gz UTWXPTGRHBRUKU-MRXNPFEDSA-N 1 3 337.533 2.555 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)CC[C@H]1CCC[N@H+]1C ZINC001374504370 1341991825 /nfs/dbraw/zinc/99/18/25/1341991825.db2.gz UTWXPTGRHBRUKU-MRXNPFEDSA-N 1 3 337.533 2.555 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)[N@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001374555854 1342066856 /nfs/dbraw/zinc/06/68/56/1342066856.db2.gz FVEVCKDANRTOFE-GOSISDBHSA-N 1 3 335.467 2.763 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)[N@@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001374555854 1342066864 /nfs/dbraw/zinc/06/68/64/1342066864.db2.gz FVEVCKDANRTOFE-GOSISDBHSA-N 1 3 335.467 2.763 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N[C@H](C)CNCc2cc(C)ccc2F)C1 ZINC001374800199 1342178091 /nfs/dbraw/zinc/17/80/91/1342178091.db2.gz AJMGZIWQABYBEK-SJORKVTESA-N 1 3 349.494 2.850 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N[C@H](C)CNCc2cc(C)ccc2F)C1 ZINC001374800199 1342178092 /nfs/dbraw/zinc/17/80/92/1342178092.db2.gz AJMGZIWQABYBEK-SJORKVTESA-N 1 3 349.494 2.850 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+][C@@H](C)c1ccc(F)c(Cl)c1 ZINC001374848885 1342204449 /nfs/dbraw/zinc/20/44/49/1342204449.db2.gz ISYSSFCYBDMABT-OLZOCXBDSA-N 1 3 343.874 2.975 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CC1CCC2(CC2)CC1 ZINC001374847957 1342204892 /nfs/dbraw/zinc/20/48/92/1342204892.db2.gz BEQJAYJHZMVMTR-SJLPKXTDSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(F)c1 ZINC001375041264 1342340964 /nfs/dbraw/zinc/34/09/64/1342340964.db2.gz XREAFDFMFWBENJ-QAPCUYQASA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(F)c1 ZINC001375041264 1342340972 /nfs/dbraw/zinc/34/09/72/1342340972.db2.gz XREAFDFMFWBENJ-QAPCUYQASA-N 1 3 335.467 2.635 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@@H](C)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001375089629 1342398899 /nfs/dbraw/zinc/39/88/99/1342398899.db2.gz OWOZISKQLBMIFX-MRXNPFEDSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C[N@H+](C)CC1CCC2(CC2)CC1 ZINC001375140330 1342455382 /nfs/dbraw/zinc/45/53/82/1342455382.db2.gz BUNARRFTABOWIJ-AWEZNQCLSA-N 1 3 332.492 2.668 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001375140330 1342455387 /nfs/dbraw/zinc/45/53/87/1342455387.db2.gz BUNARRFTABOWIJ-AWEZNQCLSA-N 1 3 332.492 2.668 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCCC[C@@H]2C[NH2+]Cc2ccsc2)CCC1 ZINC001375179125 1342494362 /nfs/dbraw/zinc/49/43/62/1342494362.db2.gz YMFXOLUMSMHIQE-SJORKVTESA-N 1 3 349.544 2.997 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccsc1 ZINC001393468094 1356868805 /nfs/dbraw/zinc/86/88/05/1356868805.db2.gz UJJGCIYZUKVSTG-IAGOWNOFSA-N 1 3 335.517 2.655 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCC1(NCc2ccsc2)CCC1 ZINC001393545457 1356936411 /nfs/dbraw/zinc/93/64/11/1356936411.db2.gz NJXBCZIVAHLTAX-INIZCTEOSA-N 1 3 335.517 2.751 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCC1(NCc2ccsc2)CCC1 ZINC001393545457 1356936414 /nfs/dbraw/zinc/93/64/14/1356936414.db2.gz NJXBCZIVAHLTAX-INIZCTEOSA-N 1 3 335.517 2.751 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N(C)C[C@H]1CCN1[C@H]1CCc2ccccc21 ZINC001375463167 1342768714 /nfs/dbraw/zinc/76/87/14/1342768714.db2.gz BFWDJHWDXQILRO-QUCCMNQESA-N 1 3 343.515 2.939 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N(C)C[C@H]1CCN1[C@H]1CCc2ccccc21 ZINC001375463167 1342768716 /nfs/dbraw/zinc/76/87/16/1342768716.db2.gz BFWDJHWDXQILRO-QUCCMNQESA-N 1 3 343.515 2.939 10 0 EFAEHO CC[C@@H]([NH2+]C1(CNC(=O)[C@@H](C(C)C)N(C)C)CC1)c1ccccc1 ZINC001375473302 1342781811 /nfs/dbraw/zinc/78/18/11/1342781811.db2.gz CEAXFZUSLHAODF-QZTJIDSGSA-N 1 3 331.504 2.962 10 0 EFAEHO Cc1cc(C)c(CN2CC[C@@H]2CN(C)C(=O)CC[NH+](C)C)c(C)c1 ZINC001375475199 1342783798 /nfs/dbraw/zinc/78/37/98/1342783798.db2.gz PROBKBIKNXFEOE-GOSISDBHSA-N 1 3 331.504 2.596 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H]3CCC[C@H]4CCC[N@@H+]43)CC2)cs1 ZINC001375503992 1342810142 /nfs/dbraw/zinc/81/01/42/1342810142.db2.gz FGLISCJBBYWFHV-DLBZAZTESA-N 1 3 347.528 2.812 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H]3CCC[C@H]4CCC[N@H+]43)CC2)cs1 ZINC001375503992 1342810152 /nfs/dbraw/zinc/81/01/52/1342810152.db2.gz FGLISCJBBYWFHV-DLBZAZTESA-N 1 3 347.528 2.812 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2C[C@H]([NH2+][C@H]3CCc4ccccc43)C2)CCC1 ZINC001375538264 1342850558 /nfs/dbraw/zinc/85/05/58/1342850558.db2.gz MUYDAAAUMPPDEQ-IEZWGBDMSA-N 1 3 341.499 2.643 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1)N1CCCC1 ZINC001375545101 1342857322 /nfs/dbraw/zinc/85/73/22/1342857322.db2.gz VBFLEKLBHZAZNW-IEWDOMPSSA-N 1 3 347.547 2.781 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN3[C@@H](C)CC[C@@H]3C)CC2)cc1F ZINC001375554718 1342869011 /nfs/dbraw/zinc/86/90/11/1342869011.db2.gz QKTJSYYZYWALLK-HOTGVXAUSA-N 1 3 347.478 2.745 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001375574776 1342893262 /nfs/dbraw/zinc/89/32/62/1342893262.db2.gz DDWUCSQTZDJUQD-KIWZCUEISA-N 1 3 343.515 2.915 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2CCC[N@H+](CCC3CC3)[C@@H]2C1(C)C ZINC001375596893 1342914908 /nfs/dbraw/zinc/91/49/08/1342914908.db2.gz GAEJFTIUELMWMG-QRQLOZEOSA-N 1 3 335.536 2.732 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2CCC[N@@H+](CCC3CC3)[C@@H]2C1(C)C ZINC001375596893 1342914912 /nfs/dbraw/zinc/91/49/12/1342914912.db2.gz GAEJFTIUELMWMG-QRQLOZEOSA-N 1 3 335.536 2.732 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)c(C)n1 ZINC001375741388 1342967842 /nfs/dbraw/zinc/96/78/42/1342967842.db2.gz PZLJOWHBPXLFLQ-QFBILLFUSA-N 1 3 346.519 2.508 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC2(C)CC[NH+](CC3CC(C)(C)C3)CC2)C1 ZINC001375777412 1342998970 /nfs/dbraw/zinc/99/89/70/1342998970.db2.gz CBMSFBLDELAOQE-MRXNPFEDSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1ccsc1)C1CCCC1)N(C)C ZINC001375798344 1343026504 /nfs/dbraw/zinc/02/65/04/1343026504.db2.gz WCYKKXCDTYJROE-DLBZAZTESA-N 1 3 337.533 2.853 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]CC3CCCC3)C2)CC1 ZINC001375895001 1343142200 /nfs/dbraw/zinc/14/22/00/1343142200.db2.gz RUKPWHYDQWRJDF-FQEVSTJZSA-N 1 3 335.536 2.737 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@](C)(C[NH2+]CC3CC(C)(C)C3)C2)CC1 ZINC001375896069 1343143301 /nfs/dbraw/zinc/14/33/01/1343143301.db2.gz WCICGVFNFDVDHA-OAQYLSRUSA-N 1 3 349.563 2.983 10 0 EFAEHO CC[C@H](C(=O)NC[C@]1(C)CCC[N@H+](Cc2ccsc2)C1)N(C)C ZINC001375949505 1343202055 /nfs/dbraw/zinc/20/20/55/1343202055.db2.gz XTHFQMSYKKROBL-AEFFLSMTSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@H](C(=O)NC[C@]1(C)CCC[N@@H+](Cc2ccsc2)C1)N(C)C ZINC001375949505 1343202057 /nfs/dbraw/zinc/20/20/57/1343202057.db2.gz XTHFQMSYKKROBL-AEFFLSMTSA-N 1 3 337.533 2.807 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@]1(C)CCC[N@H+](CC2CCCC2)C1 ZINC001375955868 1343212166 /nfs/dbraw/zinc/21/21/66/1343212166.db2.gz DTRNKMKYYGOELC-LJQANCHMSA-N 1 3 332.492 2.669 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@]1(C)CCC[N@@H+](CC2CCCC2)C1 ZINC001375955868 1343212168 /nfs/dbraw/zinc/21/21/68/1343212168.db2.gz DTRNKMKYYGOELC-LJQANCHMSA-N 1 3 332.492 2.669 10 0 EFAEHO CCCN1CCC(F)(F)[C@H](CNC(=O)CCC[NH+]2CCCCC2)C1 ZINC001375988772 1343243180 /nfs/dbraw/zinc/24/31/80/1343243180.db2.gz NFADDSYAQHAMJC-MRXNPFEDSA-N 1 3 345.478 2.736 10 0 EFAEHO CCCc1ccc(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001393742584 1357118740 /nfs/dbraw/zinc/11/87/40/1357118740.db2.gz LOMJJUHDONHERN-FXAWDEMLSA-N 1 3 345.531 2.916 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC23CC[NH+](CCC(C)(C)C)CC3)CCC1 ZINC001376168399 1343370874 /nfs/dbraw/zinc/37/08/74/1343370874.db2.gz AHXZGHGAYMYBTB-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]([NH2+]CCC1CCCC1)C1CC1 ZINC001376223414 1343409168 /nfs/dbraw/zinc/40/91/68/1343409168.db2.gz RVYBUTQZLYYHNY-OALUTQOASA-N 1 3 335.536 2.924 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H](C[N@H+](C)CCCC(C)C)C1)N(C)C ZINC001376298664 1343466797 /nfs/dbraw/zinc/46/67/97/1343466797.db2.gz YQFCSEXDBZJJSZ-ROUUACIJSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H](C[N@@H+](C)CCCC(C)C)C1)N(C)C ZINC001376298664 1343466798 /nfs/dbraw/zinc/46/67/98/1343466798.db2.gz YQFCSEXDBZJJSZ-ROUUACIJSA-N 1 3 325.541 2.933 10 0 EFAEHO C[N@H+](CCC(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(CCF)C2)C1CCCCC1 ZINC001376304322 1343469900 /nfs/dbraw/zinc/46/99/00/1343469900.db2.gz MIDKDNBAHMPECU-BQFCYCMXSA-N 1 3 339.499 2.580 10 0 EFAEHO C[N@@H+](CCC(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(CCF)C2)C1CCCCC1 ZINC001376304322 1343469903 /nfs/dbraw/zinc/46/99/03/1343469903.db2.gz MIDKDNBAHMPECU-BQFCYCMXSA-N 1 3 339.499 2.580 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001376352287 1343506720 /nfs/dbraw/zinc/50/67/20/1343506720.db2.gz LGWCXANELQYBPZ-SFHVURJKSA-N 1 3 331.504 2.643 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001376352445 1343506757 /nfs/dbraw/zinc/50/67/57/1343506757.db2.gz YCWWRSARAYCTII-MOPGFXCFSA-N 1 3 345.531 2.970 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001376364647 1343517798 /nfs/dbraw/zinc/51/77/98/1343517798.db2.gz QMMIVZHTABLPOO-PXNSSMCTSA-N 1 3 345.531 2.773 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@H]2CN(C(=O)CN(C)CC(C)(C)C)C[C@H]2C1 ZINC001376406871 1343561977 /nfs/dbraw/zinc/56/19/77/1343561977.db2.gz AWYUIYPRGNGHHA-HDICACEKSA-N 1 3 337.552 2.791 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@H]2CN(C(=O)CN(C)CC(C)(C)C)C[C@H]2C1 ZINC001376406871 1343561978 /nfs/dbraw/zinc/56/19/78/1343561978.db2.gz AWYUIYPRGNGHHA-HDICACEKSA-N 1 3 337.552 2.791 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)cc2F)C1)N(C)C ZINC001376469748 1343614144 /nfs/dbraw/zinc/61/41/44/1343614144.db2.gz OLBOPYPYIJDXTH-MBMVNNNZSA-N 1 3 339.430 2.603 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc32)C1)CC(C)(C)C ZINC001376480745 1343619284 /nfs/dbraw/zinc/61/92/84/1343619284.db2.gz VORFAPLQIITBBA-ZIFCJYIRSA-N 1 3 343.515 2.889 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(F)c(Cl)c2)C1)N(C)C ZINC001376481357 1343620250 /nfs/dbraw/zinc/62/02/50/1343620250.db2.gz YETBOVPDJJGGPU-ZENOOKHLSA-N 1 3 341.858 2.556 10 0 EFAEHO C[C@@H](C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[NH+]1CCCCCC1 ZINC001376484033 1343621266 /nfs/dbraw/zinc/62/12/66/1343621266.db2.gz DDPXHCOYJQYEMH-MELADBBJSA-N 1 3 348.318 2.807 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC[C@@H]2CCCC2(F)F)C1)N(C)C ZINC001376491735 1343624156 /nfs/dbraw/zinc/62/41/56/1343624156.db2.gz RUPFRDZJFYOOHF-CAOSSQGBSA-N 1 3 345.478 2.635 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](Cc2ccc(CF)cc2)C1)N(C)C ZINC001376508362 1343635766 /nfs/dbraw/zinc/63/57/66/1343635766.db2.gz HRCZVILXZDVJAM-RBUKOAKNSA-N 1 3 349.494 2.825 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccc(CF)cc2)C1)N(C)C ZINC001376508362 1343635768 /nfs/dbraw/zinc/63/57/68/1343635768.db2.gz HRCZVILXZDVJAM-RBUKOAKNSA-N 1 3 349.494 2.825 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001376510268 1343636897 /nfs/dbraw/zinc/63/68/97/1343636897.db2.gz NSDHHPSNSMMFEA-ROUUACIJSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)CCC[N@H+]1CCC[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001376510268 1343636898 /nfs/dbraw/zinc/63/68/98/1343636898.db2.gz NSDHHPSNSMMFEA-ROUUACIJSA-N 1 3 325.541 2.837 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]2CN(C/C=C\c3ccccc3)C[C@H]21 ZINC001376530037 1343654744 /nfs/dbraw/zinc/65/47/44/1343654744.db2.gz KCISGIDDWQMMGG-ZHJYEMEWSA-N 1 3 341.499 2.574 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N1CCC[C@H](CNC(=O)CC[NH+](C)C)C1 ZINC001376542915 1343666567 /nfs/dbraw/zinc/66/65/67/1343666567.db2.gz QUXFAAAUKKBHKQ-JKSUJKDBSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N1CCC[C@@H](CNC(=O)CC[NH+](C)C)C1 ZINC001376542909 1343666624 /nfs/dbraw/zinc/66/66/24/1343666624.db2.gz QUXFAAAUKKBHKQ-HOTGVXAUSA-N 1 3 335.467 2.667 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@H+](CCC(C)(C)C)C1 ZINC001376623638 1343730023 /nfs/dbraw/zinc/73/00/23/1343730023.db2.gz LJXLHCRJTVOXPP-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](CCC(C)(C)C)C1 ZINC001376623638 1343730025 /nfs/dbraw/zinc/73/00/25/1343730025.db2.gz LJXLHCRJTVOXPP-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001376627513 1343733899 /nfs/dbraw/zinc/73/38/99/1343733899.db2.gz QNYXKJCXZVXGEE-AEFFLSMTSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001376627513 1343733900 /nfs/dbraw/zinc/73/39/00/1343733900.db2.gz QNYXKJCXZVXGEE-AEFFLSMTSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H]1CCC[N@H+](CCC(C)(C)C)C1 ZINC001376626132 1343734010 /nfs/dbraw/zinc/73/40/10/1343734010.db2.gz OVLMTRXOBZTHJF-HOCLYGCPSA-N 1 3 334.508 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](CCC(C)(C)C)C1 ZINC001376626132 1343734011 /nfs/dbraw/zinc/73/40/11/1343734011.db2.gz OVLMTRXOBZTHJF-HOCLYGCPSA-N 1 3 334.508 2.914 10 0 EFAEHO Cc1cncc(CN[C@H](C)CNC(=O)C(C)(C)[N@H+](C)C2CCCC2)c1 ZINC001376764854 1343816990 /nfs/dbraw/zinc/81/69/90/1343816990.db2.gz XUTHHTROZDEGER-MRXNPFEDSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1cncc(CN[C@H](C)CNC(=O)C(C)(C)[N@@H+](C)C2CCCC2)c1 ZINC001376764854 1343816997 /nfs/dbraw/zinc/81/69/97/1343816997.db2.gz XUTHHTROZDEGER-MRXNPFEDSA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CCC1)N1CCCC1 ZINC001376770992 1343823178 /nfs/dbraw/zinc/82/31/78/1343823178.db2.gz QYGPNHCPFGAZCH-KURKYZTESA-N 1 3 347.547 2.926 10 0 EFAEHO CCC(CC)C[NH2+][C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001376797070 1343846329 /nfs/dbraw/zinc/84/63/29/1343846329.db2.gz DLHRPGCERRFGKD-RDTXWAMCSA-N 1 3 329.504 2.729 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)CCC[NH+]2CCCC2)c1 ZINC001376877103 1343913249 /nfs/dbraw/zinc/91/32/49/1343913249.db2.gz JJGAVGHGVBQWNE-MRXNPFEDSA-N 1 3 335.467 2.604 10 0 EFAEHO C[C@@H](CNC(=O)c1cccc(CN(C)C)c1)[NH2+]CC1CC(C)(C)C1 ZINC001376879898 1343914573 /nfs/dbraw/zinc/91/45/73/1343914573.db2.gz NSTAQGFMARYFPJ-HNNXBMFYSA-N 1 3 331.504 2.892 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](CCCc2ccccc2)CC1)N(C)C ZINC001376896689 1343936398 /nfs/dbraw/zinc/93/63/98/1343936398.db2.gz OARSSRZXWVPEJI-WOJBJXKFSA-N 1 3 345.531 2.930 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](CCCc2ccccc2)CC1)N(C)C ZINC001376896689 1343936405 /nfs/dbraw/zinc/93/64/05/1343936405.db2.gz OARSSRZXWVPEJI-WOJBJXKFSA-N 1 3 345.531 2.930 10 0 EFAEHO Cc1ccc(F)c(C[N@H+]2CCC[C@H](NC(=O)CN(C)C(C)C)CC2)c1 ZINC001376911591 1343950144 /nfs/dbraw/zinc/95/01/44/1343950144.db2.gz KMVOQPVPPWYHDU-SFHVURJKSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(C[N@@H+]2CCC[C@H](NC(=O)CN(C)C(C)C)CC2)c1 ZINC001376911591 1343950148 /nfs/dbraw/zinc/95/01/48/1343950148.db2.gz KMVOQPVPPWYHDU-SFHVURJKSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CCC[C@H]([NH2+]CCC(F)(F)F)C1)N1CCCC1 ZINC001376977711 1344008669 /nfs/dbraw/zinc/00/86/69/1344008669.db2.gz SCSNIADCYCUBCM-UONOGXRCSA-N 1 3 349.441 2.830 10 0 EFAEHO CN(Cc1ccsc1)[C@H]1CCCN(C(=O)C2(C[NH+](C)C)CC2)C1 ZINC001376982226 1344013527 /nfs/dbraw/zinc/01/35/27/1344013527.db2.gz SNDAWZTXTFHBKH-INIZCTEOSA-N 1 3 335.517 2.513 10 0 EFAEHO COc1cccc(C[N@@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001393791609 1357162161 /nfs/dbraw/zinc/16/21/61/1357162161.db2.gz RILQJGIJWFLOGH-AEFFLSMTSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc(C[N@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001393791609 1357162162 /nfs/dbraw/zinc/16/21/62/1357162162.db2.gz RILQJGIJWFLOGH-AEFFLSMTSA-N 1 3 347.503 2.505 10 0 EFAEHO CCC1([NH2+]Cc2cccc(F)c2)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001377102883 1344136742 /nfs/dbraw/zinc/13/67/42/1344136742.db2.gz PBXJNNFPWWDQPH-SFHVURJKSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNC(=O)C[NH+]1[C@@H](C)CC[C@@H]1C)Cc1ccc(F)cc1C ZINC001377367080 1344152815 /nfs/dbraw/zinc/15/28/15/1344152815.db2.gz NGURNFLYEYYYQZ-IRXDYDNUSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](c1ccc(Cl)cc1)N(CCNC(=O)CC[NH+](C)C)C1CC1 ZINC001377550411 1344169055 /nfs/dbraw/zinc/16/90/55/1344169055.db2.gz ZYTITMHAYOTMFQ-CQSZACIVSA-N 1 3 337.895 2.933 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]CCN(C)C(=O)[C@H](C(C)C)N(C)C)c1 ZINC001377573687 1344184212 /nfs/dbraw/zinc/18/42/12/1344184212.db2.gz KUWSYPOCJLXVRY-HKUYNNGSSA-N 1 3 333.520 2.999 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+][C@@H]1CCc2ccccc21 ZINC001377606590 1344213124 /nfs/dbraw/zinc/21/31/24/1344213124.db2.gz YEGNXDYQPHUEAK-MOPGFXCFSA-N 1 3 329.488 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@H+](C)CC1CC2(CCC2)C1 ZINC001377680174 1344312195 /nfs/dbraw/zinc/31/21/95/1344312195.db2.gz SVJMEVOUXWLRHV-GOSISDBHSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001377680174 1344312204 /nfs/dbraw/zinc/31/22/04/1344312204.db2.gz SVJMEVOUXWLRHV-GOSISDBHSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2cc(C)ccc2F)C1)N(C)C ZINC001377714727 1344360709 /nfs/dbraw/zinc/36/07/09/1344360709.db2.gz CUPFRQLDKSMRSG-VQIMIIECSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2cc(C)ccc2F)C1)N(C)C ZINC001377714727 1344360715 /nfs/dbraw/zinc/36/07/15/1344360715.db2.gz CUPFRQLDKSMRSG-VQIMIIECSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1cc(C[NH2+]CC2CC(NC(=O)[C@@H](C(C)C)N(C)C)C2)cs1 ZINC001377719780 1344366506 /nfs/dbraw/zinc/36/65/06/1344366506.db2.gz RCDAVAGFEXGGQY-BDVYOWHSSA-N 1 3 337.533 2.627 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001377721586 1344368960 /nfs/dbraw/zinc/36/89/60/1344368960.db2.gz LQPWYGVDCKLQAO-MRXNPFEDSA-N 1 3 344.503 2.669 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001377721586 1344368963 /nfs/dbraw/zinc/36/89/63/1344368963.db2.gz LQPWYGVDCKLQAO-MRXNPFEDSA-N 1 3 344.503 2.669 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2cccc(C)c2)C1)N(C)C ZINC001377721612 1344369208 /nfs/dbraw/zinc/36/92/08/1344369208.db2.gz LZZOAIUOSBPBMW-IEBWSBKVSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2cccc(C)c2)C1)N(C)C ZINC001377721612 1344369211 /nfs/dbraw/zinc/36/92/11/1344369211.db2.gz LZZOAIUOSBPBMW-IEBWSBKVSA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]Cc2ccccc2C2CC2)C1 ZINC001377732134 1344380501 /nfs/dbraw/zinc/38/05/01/1344380501.db2.gz BODUWXGFFMPYOP-UHFFFAOYSA-N 1 3 343.515 2.889 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]Cc2cc3ccccc3o2)C1)N(C)C ZINC001377735932 1344384565 /nfs/dbraw/zinc/38/45/65/1344384565.db2.gz MXBYYDOFPSXRPD-PVARCSIZSA-N 1 3 343.471 2.757 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001377776729 1344425087 /nfs/dbraw/zinc/42/50/87/1344425087.db2.gz AYPYACNPCJHGCR-HOTGVXAUSA-N 1 3 345.478 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001377776729 1344425088 /nfs/dbraw/zinc/42/50/88/1344425088.db2.gz AYPYACNPCJHGCR-HOTGVXAUSA-N 1 3 345.478 2.542 10 0 EFAEHO CC(C)CC[NH2+]C1CCC(N(C)C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001377930394 1344591521 /nfs/dbraw/zinc/59/15/21/1344591521.db2.gz AKUIWIGHQSMCBE-DAWZGUTISA-N 1 3 325.541 2.978 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[N@H+](C)CC1CC2(CCC2)C1 ZINC001378046713 1344698034 /nfs/dbraw/zinc/69/80/34/1344698034.db2.gz JVTIYUFGHREKTI-AEFFLSMTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[N@@H+](C)CC1CC2(CCC2)C1 ZINC001378046713 1344698039 /nfs/dbraw/zinc/69/80/39/1344698039.db2.gz JVTIYUFGHREKTI-AEFFLSMTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[N@H+](C)CCc1ccccc1 ZINC001378046539 1344698121 /nfs/dbraw/zinc/69/81/21/1344698121.db2.gz IYDUQFMWVCYDAN-MJGOQNOKSA-N 1 3 331.504 2.538 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[N@@H+](C)CCc1ccccc1 ZINC001378046539 1344698122 /nfs/dbraw/zinc/69/81/22/1344698122.db2.gz IYDUQFMWVCYDAN-MJGOQNOKSA-N 1 3 331.504 2.538 10 0 EFAEHO CCc1ccc(C[N@@H+](C)[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001378148569 1344813358 /nfs/dbraw/zinc/81/33/58/1344813358.db2.gz VSHDGVLRSAXYRH-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(C[N@H+](C)[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001378148569 1344813356 /nfs/dbraw/zinc/81/33/56/1344813356.db2.gz VSHDGVLRSAXYRH-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[N@H+](C)Cc1ccccc1C1CC1 ZINC001378150022 1344814386 /nfs/dbraw/zinc/81/43/86/1344814386.db2.gz WORXLARMXFTLFU-IRXDYDNUSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[N@@H+](C)Cc1ccccc1C1CC1 ZINC001378150022 1344814392 /nfs/dbraw/zinc/81/43/92/1344814392.db2.gz WORXLARMXFTLFU-IRXDYDNUSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@@H](C(=O)N(C)[C@@H]1CCN(CC2CC(F)(F)C2)C1)[NH+](CC)CC ZINC001378167561 1344836272 /nfs/dbraw/zinc/83/62/72/1344836272.db2.gz HWCKGANAQWOCOJ-CVEARBPZSA-N 1 3 345.478 2.685 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H]1CCN(CC2CC(F)(F)C2)C1)[NH+](CC)CC ZINC001378167577 1344837256 /nfs/dbraw/zinc/83/72/56/1344837256.db2.gz HWCKGANAQWOCOJ-JKSUJKDBSA-N 1 3 345.478 2.685 10 0 EFAEHO CCN(C(=O)[C@H](C)N1CCCCCC1)[C@@H]1CC[N@H+](CCC2CC2)C1 ZINC001378205294 1344886905 /nfs/dbraw/zinc/88/69/05/1344886905.db2.gz YWWFFLMXSWMGJZ-PKOBYXMFSA-N 1 3 335.536 2.974 10 0 EFAEHO CCN(C(=O)[C@H](C)N1CCCCCC1)[C@@H]1CC[N@@H+](CCC2CC2)C1 ZINC001378205294 1344886908 /nfs/dbraw/zinc/88/69/08/1344886908.db2.gz YWWFFLMXSWMGJZ-PKOBYXMFSA-N 1 3 335.536 2.974 10 0 EFAEHO CC[C@H](CNC(=O)[C@H](C(C)C)[NH+](C)C)NCc1ccc(F)cc1F ZINC001378254068 1344933486 /nfs/dbraw/zinc/93/34/86/1344933486.db2.gz FDEQNYSRLTYKLV-WBVHZDCISA-N 1 3 341.446 2.535 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1cc(F)ccc1C ZINC001378260643 1344939836 /nfs/dbraw/zinc/93/98/36/1344939836.db2.gz YMLKLKVVCJAOFR-MOPGFXCFSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC1(NC(=O)CN(C)C2CCC2)CCCCC1 ZINC001378401273 1345045820 /nfs/dbraw/zinc/04/58/20/1345045820.db2.gz DZRWOULVFDTNKD-OAHLLOKOSA-N 1 3 327.488 2.628 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)C1C[NH+](CC2CC3(CCC3)C2)C1 ZINC001378530891 1345144592 /nfs/dbraw/zinc/14/45/92/1345144592.db2.gz GXLHGRISUGCZEU-INIZCTEOSA-N 1 3 347.547 2.878 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](CCCc2cccc(F)c2)C1)N(C)C ZINC001378536745 1345147277 /nfs/dbraw/zinc/14/72/77/1345147277.db2.gz VKMXAZGTAUXBHM-HNAYVOBHSA-N 1 3 349.494 2.535 10 0 EFAEHO CCc1ccccc1CC[NH+]1CC([C@@H](C)NC(=O)[C@@H](CC)N(C)C)C1 ZINC001378539117 1345149748 /nfs/dbraw/zinc/14/97/48/1345149748.db2.gz ZISUDRYSGLKPTJ-OXQOHEQNSA-N 1 3 345.531 2.568 10 0 EFAEHO Cc1cc(C)cc(C[NH+]2CC([C@H](C)NC(=O)CN(C)C(C)C)C2)c1 ZINC001378581441 1345177529 /nfs/dbraw/zinc/17/75/29/1345177529.db2.gz AARVJEUSOQPPMT-KRWDZBQOSA-N 1 3 331.504 2.580 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+][C@H]1CCc2ccccc21 ZINC001378582892 1345179092 /nfs/dbraw/zinc/17/90/92/1345179092.db2.gz CCKUCEUKDRNNNW-LPHOPBHVSA-N 1 3 343.515 2.890 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@H+](CCCC2CCC2)CC1(C)C)N(C)C ZINC001378636685 1345215236 /nfs/dbraw/zinc/21/52/36/1345215236.db2.gz ASOBMYPTUCZQQY-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@@H+](CCCC2CCC2)CC1(C)C)N(C)C ZINC001378636685 1345215239 /nfs/dbraw/zinc/21/52/39/1345215239.db2.gz ASOBMYPTUCZQQY-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+]Cc1ccc(F)cc1Cl ZINC001378646169 1345222798 /nfs/dbraw/zinc/22/27/98/1345222798.db2.gz WUCOWCYJACOWHH-CYBMUJFWSA-N 1 3 343.874 2.661 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+]Cc1ccc(F)cc1Cl ZINC001378646173 1345222951 /nfs/dbraw/zinc/22/29/51/1345222951.db2.gz WUCOWCYJACOWHH-ZDUSSCGKSA-N 1 3 343.874 2.661 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@H+](CCC2CCCC2)CC1(C)C)N(C)C ZINC001378655227 1345228444 /nfs/dbraw/zinc/22/84/44/1345228444.db2.gz YDWDLKYDUXHZFT-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@@H+](CCC2CCCC2)CC1(C)C)N(C)C ZINC001378655227 1345228448 /nfs/dbraw/zinc/22/84/48/1345228448.db2.gz YDWDLKYDUXHZFT-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCCC2)cc1 ZINC001378721222 1345274438 /nfs/dbraw/zinc/27/44/38/1345274438.db2.gz XPQSVSUOXBQLEM-UHFFFAOYSA-N 1 3 331.504 2.854 10 0 EFAEHO CC(C)CCC[N@@H+]1CCCC2(CN(C(=O)[C@H](C(C)C)N(C)C)C2)C1 ZINC001378787830 1345317181 /nfs/dbraw/zinc/31/71/81/1345317181.db2.gz LSIQLSHCMPEXPX-SFHVURJKSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CCC[N@H+]1CCCC2(CN(C(=O)[C@H](C(C)C)N(C)C)C2)C1 ZINC001378787830 1345317184 /nfs/dbraw/zinc/31/71/84/1345317184.db2.gz LSIQLSHCMPEXPX-SFHVURJKSA-N 1 3 337.552 2.933 10 0 EFAEHO C[C@@H](CNCc1sccc1Cl)N(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001378840001 1345352892 /nfs/dbraw/zinc/35/28/92/1345352892.db2.gz GSXBEFDJDSPYDC-QWHCGFSZSA-N 1 3 343.924 2.680 10 0 EFAEHO C[C@@H](CNCc1sccc1Cl)N(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001378840001 1345352895 /nfs/dbraw/zinc/35/28/95/1345352895.db2.gz GSXBEFDJDSPYDC-QWHCGFSZSA-N 1 3 343.924 2.680 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H]2CCCc3ccccc32)C1)N(C)C ZINC001378842727 1345355608 /nfs/dbraw/zinc/35/56/08/1345355608.db2.gz GONJZHBFQCZZIS-RARDXLECSA-N 1 3 343.515 2.889 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)C1 ZINC001378844037 1345356913 /nfs/dbraw/zinc/35/69/13/1345356913.db2.gz JLWXRRCYEXKSKM-RUCARUNLSA-N 1 3 343.515 2.718 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H](C)C[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001378848675 1345361782 /nfs/dbraw/zinc/36/17/82/1345361782.db2.gz YTMCEOCHDHHBON-FUHWJXTLSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccccc2F)C1)N(C)C ZINC001378853270 1345365529 /nfs/dbraw/zinc/36/55/29/1345365529.db2.gz OQHUSIHFFOMQSR-IUVQAAGXSA-N 1 3 349.494 2.957 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H](CC(C)C)NC(=O)CN1CC[C@@H](C)C1 ZINC001378882226 1345391710 /nfs/dbraw/zinc/39/17/10/1345391710.db2.gz NNGGWQDPRVWCJU-YLJYHZDGSA-N 1 3 345.531 2.957 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCc2ccccc2F)[C@H](C)C1 ZINC001378894044 1345403864 /nfs/dbraw/zinc/40/38/64/1345403864.db2.gz FDENHBRUVFLWNT-VQIMIIECSA-N 1 3 349.494 2.535 10 0 EFAEHO CC(C)C[NH2+]C[C@H](C1CC1)N(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001379034527 1345516774 /nfs/dbraw/zinc/51/67/74/1345516774.db2.gz SGRJVCUSKYIJEI-APWZRJJASA-N 1 3 341.515 2.682 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C2CC2)N(C)C(=O)CN(C)C(C)C)cc1C ZINC001379064706 1345544536 /nfs/dbraw/zinc/54/45/36/1345544536.db2.gz ZNZQKOGNYMSMNZ-HXUWFJFHSA-N 1 3 345.531 2.970 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@H](C)CN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001379152476 1345628661 /nfs/dbraw/zinc/62/86/61/1345628661.db2.gz WKGZAWDXNOCMDP-HZPDHXFCSA-N 1 3 347.503 2.677 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(F)c(Cl)c1)N(C)C ZINC001379264874 1345686936 /nfs/dbraw/zinc/68/69/36/1345686936.db2.gz ZLXDMSSBVHWYGS-MLGOLLRUSA-N 1 3 343.874 2.756 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@H](C)[NH2+]CCc1ccc(Cl)cc1)N(C)C ZINC001379292303 1345704546 /nfs/dbraw/zinc/70/45/46/1345704546.db2.gz ZFYRZIKTOVQKPE-WMLDXEAASA-N 1 3 339.911 2.659 10 0 EFAEHO C[C@@H](CC[NH2+][C@@H]1CCc2ccccc21)NC(=O)CN(C)C1CCC1 ZINC001379297745 1345707766 /nfs/dbraw/zinc/70/77/66/1345707766.db2.gz NPMRTRMASSGYKN-HNAYVOBHSA-N 1 3 329.488 2.643 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@H](C)CN(C)C(=O)CN(C)C(C)C)c1 ZINC001379323186 1345726325 /nfs/dbraw/zinc/72/63/25/1345726325.db2.gz CGPBBTNTCRKCPT-CVEARBPZSA-N 1 3 335.492 2.533 10 0 EFAEHO Cc1ccc(CN[C@@H](C)CN(C)C(=O)CC[NH+]2CCCCC2)c(C)n1 ZINC001379325775 1345729449 /nfs/dbraw/zinc/72/94/49/1345729449.db2.gz QFRLOGKMOKWSAE-KRWDZBQOSA-N 1 3 346.519 2.511 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]CCc1cccs1 ZINC001379326374 1345730026 /nfs/dbraw/zinc/73/00/26/1345730026.db2.gz IJNHXMYQNFIERZ-DOTOQJQBSA-N 1 3 337.533 2.602 10 0 EFAEHO CC[C@@H]([NH2+]CCN(CC)C(=O)CN1CCCC1)c1ccc(F)cc1 ZINC001379326809 1345730602 /nfs/dbraw/zinc/73/06/02/1345730602.db2.gz JGVQIVLJUPDJGB-GOSISDBHSA-N 1 3 335.467 2.811 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]CCc1ccccc1 ZINC001379331316 1345733259 /nfs/dbraw/zinc/73/32/59/1345733259.db2.gz QBKHRDUFCVXVSC-IEBWSBKVSA-N 1 3 331.504 2.540 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]C[C@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001379514684 1345820584 /nfs/dbraw/zinc/82/05/84/1345820584.db2.gz GOLYBQICIJPXCT-DLBZAZTESA-N 1 3 331.504 2.943 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]Cc1cccc(C(F)F)c1)N(C)C ZINC001379520903 1345825071 /nfs/dbraw/zinc/82/50/71/1345825071.db2.gz HHKMNDTXHPUCRY-SWLSCSKDSA-N 1 3 327.419 2.559 10 0 EFAEHO Cc1cccnc1CNC[C@H](C)NC(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001379522413 1345826118 /nfs/dbraw/zinc/82/61/18/1345826118.db2.gz YOAZSFFZIQGRQA-INIZCTEOSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1cccnc1CNC[C@H](C)NC(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001379522413 1345826119 /nfs/dbraw/zinc/82/61/19/1345826119.db2.gz YOAZSFFZIQGRQA-INIZCTEOSA-N 1 3 346.519 2.637 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccccc1C1CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001379555128 1345856105 /nfs/dbraw/zinc/85/61/05/1345856105.db2.gz YISHIIPYANIXPE-CVEARBPZSA-N 1 3 329.488 2.500 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1C[C@H](C)N(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001379589712 1345897827 /nfs/dbraw/zinc/89/78/27/1345897827.db2.gz TVNRHJWJIOZMIM-QFBILLFUSA-N 1 3 331.504 2.987 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)cc1F ZINC001393953544 1357318778 /nfs/dbraw/zinc/31/87/78/1357318778.db2.gz DYOZDWUQRGXMNN-HZPDHXFCSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001393955629 1357320401 /nfs/dbraw/zinc/32/04/01/1357320401.db2.gz HHZORCBUOVCODZ-LSDHHAIUSA-N 1 3 335.467 2.683 10 0 EFAEHO Cc1ccc(CN2CCC[C@H](NC(=O)CC[NH+](C)C)[C@H]2C)cc1C ZINC001379647407 1347225114 /nfs/dbraw/zinc/22/51/14/1347225114.db2.gz CYTYCLPCJODAHJ-MJGOQNOKSA-N 1 3 331.504 2.724 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]Cc1ccsc1 ZINC001379934810 1347412680 /nfs/dbraw/zinc/41/26/80/1347412680.db2.gz HBQIVHLYARUXHB-IRXDYDNUSA-N 1 3 337.533 2.805 10 0 EFAEHO CC[C@H](C)C[N@H+](C)CCN(C(=O)CN1CCC(C)CC1)C(C)C ZINC001380038136 1347477186 /nfs/dbraw/zinc/47/71/86/1347477186.db2.gz YLXHGBSOOYTYTF-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)CCN(C(=O)CN1CCC(C)CC1)C(C)C ZINC001380038136 1347477187 /nfs/dbraw/zinc/47/71/87/1347477187.db2.gz YLXHGBSOOYTYTF-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C[NH2+]CC1CCCC1)C(C)(C)C)N(C)C ZINC001380083502 1347507776 /nfs/dbraw/zinc/50/77/76/1347507776.db2.gz CBCZBWYGJBJFQJ-IRXDYDNUSA-N 1 3 325.541 2.883 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC001380130645 1347525485 /nfs/dbraw/zinc/52/54/85/1347525485.db2.gz SUMBPCNXRWHGDP-MRXNPFEDSA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]C2(CNC(=O)[C@@H](C(C)C)N(C)C)CC2)c1 ZINC001380138308 1347528803 /nfs/dbraw/zinc/52/88/03/1347528803.db2.gz OLVVBXCVFUVXIA-FUHWJXTLSA-N 1 3 331.504 2.881 10 0 EFAEHO Cc1cc(C[NH2+]C2(CNC(=O)C(C)(C)N3CCCC3)CC2)c(C)s1 ZINC001380143254 1347531799 /nfs/dbraw/zinc/53/17/99/1347531799.db2.gz OYSLGORRMMLTNQ-UHFFFAOYSA-N 1 3 349.544 2.978 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1CC[NH+](CCc2ccccc2)CC1 ZINC001380146423 1347534005 /nfs/dbraw/zinc/53/40/05/1347534005.db2.gz OJMZOBCXHUIUPV-SFHVURJKSA-N 1 3 345.531 2.786 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NCC1(N[C@H]2CCc3ccc(F)cc32)CC1 ZINC001380158849 1347539906 /nfs/dbraw/zinc/53/99/06/1347539906.db2.gz DHQGXJRSFOTNQN-SFHVURJKSA-N 1 3 347.478 2.783 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NCC1(N[C@H]2CCc3ccc(F)cc32)CC1 ZINC001380158849 1347539908 /nfs/dbraw/zinc/53/99/08/1347539908.db2.gz DHQGXJRSFOTNQN-SFHVURJKSA-N 1 3 347.478 2.783 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C2(CNC(=O)[C@H](C(C)C)N(C)C)CC2)c1 ZINC001380159563 1347540197 /nfs/dbraw/zinc/54/01/97/1347540197.db2.gz KKMDSLAGKWPESY-QAPCUYQASA-N 1 3 347.503 2.581 10 0 EFAEHO Cc1cc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@@H]3C)CC2)c(C)s1 ZINC001380169410 1347545837 /nfs/dbraw/zinc/54/58/37/1347545837.db2.gz DYDMYDODJPCLCL-OKILXGFUSA-N 1 3 349.544 2.976 10 0 EFAEHO C[C@H](NC[C@@H]1CCCN1C(=O)CC[NH+](C)C)c1ccccc1Cl ZINC001380290109 1347571295 /nfs/dbraw/zinc/57/12/95/1347571295.db2.gz MOSSEUMVZHPANU-GJZGRUSLSA-N 1 3 337.895 2.933 10 0 EFAEHO C[C@@H](NC[C@H]1CCCN1C(=O)CC[NH+](C)C)c1ccccc1Cl ZINC001380290110 1347571307 /nfs/dbraw/zinc/57/13/07/1347571307.db2.gz MOSSEUMVZHPANU-HUUCEWRRSA-N 1 3 337.895 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC001380293159 1347572561 /nfs/dbraw/zinc/57/25/61/1347572561.db2.gz WJZORXRMMUQOFI-PKOBYXMFSA-N 1 3 347.478 2.734 10 0 EFAEHO CC[C@@H](C(=O)N[C@@]1(C)CC[N@H+](CCc2ccccc2)C1)N(CC)CC ZINC001380359513 1347618207 /nfs/dbraw/zinc/61/82/07/1347618207.db2.gz QBPVIYJLZXYTPA-FPOVZHCZSA-N 1 3 345.531 2.930 10 0 EFAEHO CC[C@@H](C(=O)N[C@@]1(C)CC[N@@H+](CCc2ccccc2)C1)N(CC)CC ZINC001380359513 1347618209 /nfs/dbraw/zinc/61/82/09/1347618209.db2.gz QBPVIYJLZXYTPA-FPOVZHCZSA-N 1 3 345.531 2.930 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@](C)(C[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001380427953 1347664973 /nfs/dbraw/zinc/66/49/73/1347664973.db2.gz VLQGKYQBIQGYAB-HKUYNNGSSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@]1(C)CCC[N@H+](CC2CCC2)C1 ZINC001380472088 1347700340 /nfs/dbraw/zinc/70/03/40/1347700340.db2.gz OYIIRMSUWDIFAE-ICSRJNTNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@]1(C)CCC[N@@H+](CC2CCC2)C1 ZINC001380472088 1347700344 /nfs/dbraw/zinc/70/03/44/1347700344.db2.gz OYIIRMSUWDIFAE-ICSRJNTNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)[C@H](C)NCc1ccccc1Cl ZINC001393999947 1357370439 /nfs/dbraw/zinc/37/04/39/1357370439.db2.gz RWQXQSXABVEGOB-UONOGXRCSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)[C@H](C)NCc1ccccc1Cl ZINC001393999947 1357370442 /nfs/dbraw/zinc/37/04/42/1357370442.db2.gz RWQXQSXABVEGOB-UONOGXRCSA-N 1 3 325.884 2.665 10 0 EFAEHO CC(C)CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)C2 ZINC001380678861 1347807904 /nfs/dbraw/zinc/80/79/04/1347807904.db2.gz HKJPKWUKEPKFBV-AKHDSKFASA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)C2 ZINC001380678861 1347807909 /nfs/dbraw/zinc/80/79/09/1347807909.db2.gz HKJPKWUKEPKFBV-AKHDSKFASA-N 1 3 335.536 2.734 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001380679406 1347808830 /nfs/dbraw/zinc/80/88/30/1347808830.db2.gz OXMGNRCYSUNFDU-ICSRJNTNSA-N 1 3 345.531 2.970 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2ccccc2C)C1 ZINC001380692027 1347816981 /nfs/dbraw/zinc/81/69/81/1347816981.db2.gz SGRLCFXKSMTUPH-HKUYNNGSSA-N 1 3 331.504 2.521 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1C[C@@H]2C[N@@H+](CCCC(C)C)C[C@@H]2C1 ZINC001380705334 1347825396 /nfs/dbraw/zinc/82/53/96/1347825396.db2.gz RUXLYQMDFBGHOF-CEXWTWQISA-N 1 3 335.536 2.687 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1C[C@@H]2C[N@H+](CCCC(C)C)C[C@@H]2C1 ZINC001380705334 1347825397 /nfs/dbraw/zinc/82/53/97/1347825397.db2.gz RUXLYQMDFBGHOF-CEXWTWQISA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[C@@H](C[NH2+]CC2CC(C)C2)CC1 ZINC001380705884 1347826105 /nfs/dbraw/zinc/82/61/05/1347826105.db2.gz KIGMIKQBVYGMDM-LFYFRBEQSA-N 1 3 337.552 2.885 10 0 EFAEHO CC[C@@H](C(=O)NCc1ccccc1C[N@H+](C)CC1CCC1)N(C)C ZINC001380782915 1347874814 /nfs/dbraw/zinc/87/48/14/1347874814.db2.gz YGSVBWKEFYJTNH-IBGZPJMESA-N 1 3 331.504 2.875 10 0 EFAEHO CC[C@@H](C(=O)NCc1ccccc1C[N@@H+](C)CC1CCC1)N(C)C ZINC001380782915 1347874819 /nfs/dbraw/zinc/87/48/19/1347874819.db2.gz YGSVBWKEFYJTNH-IBGZPJMESA-N 1 3 331.504 2.875 10 0 EFAEHO C[C@H](NC(=O)c1cccc(CN(C)C)c1)[C@H](C)[NH2+]CCC(F)(F)F ZINC001394006532 1357379065 /nfs/dbraw/zinc/37/90/65/1357379065.db2.gz SIQXSUNAOPDEFQ-STQMWFEESA-N 1 3 345.409 2.797 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3ccsc3)CCC2)CC[N@@H+]1C ZINC001380855491 1347917235 /nfs/dbraw/zinc/91/72/35/1347917235.db2.gz KBXUBOGQELPHQJ-JKSUJKDBSA-N 1 3 335.517 2.607 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3ccsc3)CCC2)CC[N@H+]1C ZINC001380855491 1347917238 /nfs/dbraw/zinc/91/72/38/1347917238.db2.gz KBXUBOGQELPHQJ-JKSUJKDBSA-N 1 3 335.517 2.607 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+]C[C@H]2CCCC(F)(F)C2)CCC1)N(C)C ZINC001380897533 1347943973 /nfs/dbraw/zinc/94/39/73/1347943973.db2.gz SITMSGCCPXEEFB-LSDHHAIUSA-N 1 3 345.478 2.781 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](Cc2ccc(C)cc2)CC1)N(C)C ZINC001380933208 1347966018 /nfs/dbraw/zinc/96/60/18/1347966018.db2.gz UYQHOQFDNQCYFO-RTBURBONSA-N 1 3 331.504 2.806 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2ccc(C)cc2)CC1)N(C)C ZINC001380933208 1347966021 /nfs/dbraw/zinc/96/60/21/1347966021.db2.gz UYQHOQFDNQCYFO-RTBURBONSA-N 1 3 331.504 2.806 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@@H]1CCC[N@@H+]1C)Cc1ccsc1 ZINC001380957159 1347984275 /nfs/dbraw/zinc/98/42/75/1347984275.db2.gz GBJSADPAQGPRRL-KRWDZBQOSA-N 1 3 337.533 2.903 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@@H]1CCC[N@H+]1C)Cc1ccsc1 ZINC001380957159 1347984278 /nfs/dbraw/zinc/98/42/78/1347984278.db2.gz GBJSADPAQGPRRL-KRWDZBQOSA-N 1 3 337.533 2.903 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001380980741 1348001964 /nfs/dbraw/zinc/00/19/64/1348001964.db2.gz ICNQBUIPWUJHHD-HOTGVXAUSA-N 1 3 347.494 2.932 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001380980741 1348001967 /nfs/dbraw/zinc/00/19/67/1348001967.db2.gz ICNQBUIPWUJHHD-HOTGVXAUSA-N 1 3 347.494 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@H]1CCC[N@H+](CCCF)C1 ZINC001380987146 1348007417 /nfs/dbraw/zinc/00/74/17/1348007417.db2.gz BAQYKRHLQBLIOL-ROUUACIJSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@H]1CCC[N@@H+](CCCF)C1 ZINC001380987146 1348007418 /nfs/dbraw/zinc/00/74/18/1348007418.db2.gz BAQYKRHLQBLIOL-ROUUACIJSA-N 1 3 341.515 2.779 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCC[C@@H]1[C@@H]1CCCN(C/C=C\Cl)C1 ZINC001380991123 1348010139 /nfs/dbraw/zinc/01/01/39/1348010139.db2.gz UQKBGQWIXFWPBI-HJMWAZGYSA-N 1 3 341.927 2.784 10 0 EFAEHO CCC1(NC/C(Cl)=C\Cl)CCN(C(=O)[C@@H]2CC[N@H+](C)C2)CC1 ZINC001381024424 1348026118 /nfs/dbraw/zinc/02/61/18/1348026118.db2.gz YJFNPPZSIIVDNT-PCRWRXJSSA-N 1 3 348.318 2.618 10 0 EFAEHO CCC1(NC/C(Cl)=C\Cl)CCN(C(=O)[C@@H]2CC[N@@H+](C)C2)CC1 ZINC001381024424 1348026120 /nfs/dbraw/zinc/02/61/20/1348026120.db2.gz YJFNPPZSIIVDNT-PCRWRXJSSA-N 1 3 348.318 2.618 10 0 EFAEHO Cc1cc(CN2CC[C@@H](NC(=O)CC[NH+](C)C)C(C)(C)C2)cs1 ZINC001381131227 1348098547 /nfs/dbraw/zinc/09/85/47/1348098547.db2.gz CVTIICOOXVHKBI-MRXNPFEDSA-N 1 3 337.533 2.725 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1c(C)cccc1Cl)N(C)C ZINC001381224224 1348150637 /nfs/dbraw/zinc/15/06/37/1348150637.db2.gz VWTLSLNFLHLBFE-WMLDXEAASA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@H](C)C[N@H+](CC)CC1CCN(C(=O)[C@H](CC)N(C)C)CC1 ZINC001381252980 1348165501 /nfs/dbraw/zinc/16/55/01/1348165501.db2.gz BKJUTKCMZKZPRP-WMZOPIPTSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C)C[N@@H+](CC)CC1CCN(C(=O)[C@H](CC)N(C)C)CC1 ZINC001381252980 1348165502 /nfs/dbraw/zinc/16/55/02/1348165502.db2.gz BKJUTKCMZKZPRP-WMZOPIPTSA-N 1 3 325.541 2.933 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001381274694 1348179048 /nfs/dbraw/zinc/17/90/48/1348179048.db2.gz PSMPUDMAUIURDV-IBGZPJMESA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2sccc2Cl)C1)N(C)C ZINC001394388747 1357760962 /nfs/dbraw/zinc/76/09/62/1357760962.db2.gz HGWHKADKASITCE-YRGRVCCFSA-N 1 3 343.924 2.726 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC1CC(CNC/C(Cl)=C\Cl)C1 ZINC001381325937 1348211394 /nfs/dbraw/zinc/21/13/94/1348211394.db2.gz XVEMYDZDKRXRKY-MLNFYDOXSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC1CC(CNC/C(Cl)=C\Cl)C1 ZINC001381325937 1348211398 /nfs/dbraw/zinc/21/13/98/1348211398.db2.gz XVEMYDZDKRXRKY-MLNFYDOXSA-N 1 3 348.318 2.664 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001381393714 1348239506 /nfs/dbraw/zinc/23/95/06/1348239506.db2.gz QFQIREWIZJXSGH-IRXDYDNUSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)cc1C ZINC001381397485 1348241775 /nfs/dbraw/zinc/24/17/75/1348241775.db2.gz UDWJLDBGKSRCBY-SJORKVTESA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@@H](NCC=C(Cl)Cl)[C@H](C)NC(=O)CC1CC[NH+](C)CC1 ZINC001381446294 1348280834 /nfs/dbraw/zinc/28/08/34/1348280834.db2.gz WQTYBPXVJLIGEN-NEPJUHHUSA-N 1 3 336.307 2.520 10 0 EFAEHO Cc1ccncc1C[NH2+]C1CCC(N(C)C(=O)CN(C)C(C)C)CC1 ZINC001381462132 1348291415 /nfs/dbraw/zinc/29/14/15/1348291415.db2.gz UUSZNGZVQNTWCU-UHFFFAOYSA-N 1 3 346.519 2.589 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@H](C)CNC(=O)[C@H]1CCC[N@H+]1C(C)C ZINC001381513012 1348322834 /nfs/dbraw/zinc/32/28/34/1348322834.db2.gz CVWSUNQPBZCYFQ-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@H](C)CNC(=O)[C@H]1CCC[N@@H+]1C(C)C ZINC001381513012 1348322837 /nfs/dbraw/zinc/32/28/37/1348322837.db2.gz CVWSUNQPBZCYFQ-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@H](C)CNC(=O)[C@@H]1CCC[N@H+]1C(C)C ZINC001381513710 1348323090 /nfs/dbraw/zinc/32/30/90/1348323090.db2.gz FDKBAFJQZXATFM-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@H](C)CNC(=O)[C@@H]1CCC[N@@H+]1C(C)C ZINC001381513710 1348323091 /nfs/dbraw/zinc/32/30/91/1348323091.db2.gz FDKBAFJQZXATFM-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@H+](C)Cc1cccc(C(F)F)c1)N(C)C ZINC001381535969 1348338574 /nfs/dbraw/zinc/33/85/74/1348338574.db2.gz NTKAIDDNZAWTGJ-CZUORRHYSA-N 1 3 341.446 2.901 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@@H+](C)Cc1cccc(C(F)F)c1)N(C)C ZINC001381535969 1348338577 /nfs/dbraw/zinc/33/85/77/1348338577.db2.gz NTKAIDDNZAWTGJ-CZUORRHYSA-N 1 3 341.446 2.901 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1C ZINC001381582021 1348377085 /nfs/dbraw/zinc/37/70/85/1348377085.db2.gz HYRYKHYOBLRIHG-CRAIPNDOSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1C ZINC001381582021 1348377087 /nfs/dbraw/zinc/37/70/87/1348377087.db2.gz HYRYKHYOBLRIHG-CRAIPNDOSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@H](C)CNC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001381583019 1348378284 /nfs/dbraw/zinc/37/82/84/1348378284.db2.gz NMQYOJGOKDJTPO-FUHWJXTLSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@H](C)CNC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001381583019 1348378286 /nfs/dbraw/zinc/37/82/86/1348378286.db2.gz NMQYOJGOKDJTPO-FUHWJXTLSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001381583027 1348378338 /nfs/dbraw/zinc/37/83/38/1348378338.db2.gz NMQYOJGOKDJTPO-WMZOPIPTSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001381583027 1348378340 /nfs/dbraw/zinc/37/83/40/1348378340.db2.gz NMQYOJGOKDJTPO-WMZOPIPTSA-N 1 3 331.504 2.582 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H](C)[N@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001381623884 1348413023 /nfs/dbraw/zinc/41/30/23/1348413023.db2.gz IVSDEWADQYYDOS-FUHWJXTLSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H](C)[N@@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001381623884 1348413024 /nfs/dbraw/zinc/41/30/24/1348413024.db2.gz IVSDEWADQYYDOS-FUHWJXTLSA-N 1 3 337.552 2.980 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@@H](C)[N@H+](C)Cc1ccc(OC)cc1 ZINC001381639261 1348423881 /nfs/dbraw/zinc/42/38/81/1348423881.db2.gz APAGKCJJCZACKH-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc(OC)cc1 ZINC001381639261 1348423887 /nfs/dbraw/zinc/42/38/87/1348423887.db2.gz APAGKCJJCZACKH-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@H](C)[N@H+](C)Cc1ccc(OC)cc1 ZINC001381639258 1348424029 /nfs/dbraw/zinc/42/40/29/1348424029.db2.gz APAGKCJJCZACKH-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@H](C)[N@@H+](C)Cc1ccc(OC)cc1 ZINC001381639258 1348424031 /nfs/dbraw/zinc/42/40/31/1348424031.db2.gz APAGKCJJCZACKH-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC001381639303 1348424114 /nfs/dbraw/zinc/42/41/14/1348424114.db2.gz AVRRHTSEFKSKJV-DNVCBOLYSA-N 1 3 349.494 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC001381639303 1348424115 /nfs/dbraw/zinc/42/41/15/1348424115.db2.gz AVRRHTSEFKSKJV-DNVCBOLYSA-N 1 3 349.494 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)CCc1ccccc1Cl ZINC001381641408 1348425522 /nfs/dbraw/zinc/42/55/22/1348425522.db2.gz FNRAOGNTAKIURP-HNNXBMFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)CCc1ccccc1Cl ZINC001381641408 1348425523 /nfs/dbraw/zinc/42/55/23/1348425523.db2.gz FNRAOGNTAKIURP-HNNXBMFYSA-N 1 3 339.911 2.659 10 0 EFAEHO C[NH+](C)CC1(C(=O)NC[C@H]2CCCCCN2Cc2ccsc2)CC1 ZINC001381755089 1348503316 /nfs/dbraw/zinc/50/33/16/1348503316.db2.gz BXHAMVZDQGJDQS-QGZVFWFLSA-N 1 3 349.544 2.951 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](CC/C=C/c2ccccc2)C1)N(C)C ZINC001381798385 1348533548 /nfs/dbraw/zinc/53/35/48/1348533548.db2.gz WKKCKYBZQSADQP-HRWVHKAXSA-N 1 3 343.515 2.867 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381860050 1348572346 /nfs/dbraw/zinc/57/23/46/1348572346.db2.gz BRGYLZLPDDITBH-DLBZAZTESA-N 1 3 325.541 2.835 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381860050 1348572347 /nfs/dbraw/zinc/57/23/47/1348572347.db2.gz BRGYLZLPDDITBH-DLBZAZTESA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@H+](C[C@@H]1CC[C@@H]3C[C@@H]3C1)C2 ZINC001381940578 1348618127 /nfs/dbraw/zinc/61/81/27/1348618127.db2.gz OXKJDEPRZZKFCU-QRVBRYPASA-N 1 3 347.547 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@@H+](C[C@@H]1CC[C@@H]3C[C@@H]3C1)C2 ZINC001381940578 1348618129 /nfs/dbraw/zinc/61/81/29/1348618129.db2.gz OXKJDEPRZZKFCU-QRVBRYPASA-N 1 3 347.547 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@]2(C)C[N@H+](CC3CC(C)C3)C[C@]2(C)C1 ZINC001381950307 1348623083 /nfs/dbraw/zinc/62/30/83/1348623083.db2.gz WOPKEQAUKTYPDD-HCABLIJQSA-N 1 3 335.536 2.543 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@]2(C)C[N@@H+](CC3CC(C)C3)C[C@]2(C)C1 ZINC001381950307 1348623087 /nfs/dbraw/zinc/62/30/87/1348623087.db2.gz WOPKEQAUKTYPDD-HCABLIJQSA-N 1 3 335.536 2.543 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001382086279 1348708654 /nfs/dbraw/zinc/70/86/54/1348708654.db2.gz FUZWVKAOBXBIAA-XJKSGUPXSA-N 1 3 325.884 2.617 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001382086277 1348708722 /nfs/dbraw/zinc/70/87/22/1348708722.db2.gz FUZWVKAOBXBIAA-CZUORRHYSA-N 1 3 325.884 2.617 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001382098054 1348718487 /nfs/dbraw/zinc/71/84/87/1348718487.db2.gz LANHPTWADAJTEY-KXBFYZLASA-N 1 3 344.503 2.691 10 0 EFAEHO C[C@@H](CN(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1)NCc1cccnc1 ZINC001382105256 1348725081 /nfs/dbraw/zinc/72/50/81/1348725081.db2.gz XELGIVMWZFVWBZ-INIZCTEOSA-N 1 3 346.519 2.671 10 0 EFAEHO C[C@@H](CN(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1)NCc1cccnc1 ZINC001382105256 1348725085 /nfs/dbraw/zinc/72/50/85/1348725085.db2.gz XELGIVMWZFVWBZ-INIZCTEOSA-N 1 3 346.519 2.671 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001382128237 1348749045 /nfs/dbraw/zinc/74/90/45/1348749045.db2.gz SUKVJGWSOUXUAV-HNAYVOBHSA-N 1 3 345.531 2.890 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1cccc(OC)c1 ZINC001382160474 1348782425 /nfs/dbraw/zinc/78/24/25/1348782425.db2.gz BKEHNUOTOKOYLI-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)CN(C)C(=O)CN(C)C(C)C)c(C)s1 ZINC001382165969 1348788151 /nfs/dbraw/zinc/78/81/51/1348788151.db2.gz NFGKGEOTMRAUTR-ZDUSSCGKSA-N 1 3 325.522 2.642 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@H]1CC[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001382351053 1348903375 /nfs/dbraw/zinc/90/33/75/1348903375.db2.gz QDBVRIFHJLSPRN-QFBILLFUSA-N 1 3 349.494 2.849 10 0 EFAEHO CCC(CC)C[NH2+][C@H]1CN(C(=O)[C@@H](C(C)C)N(C)C)CC1(C)C ZINC001382367003 1348918640 /nfs/dbraw/zinc/91/86/40/1348918640.db2.gz GWDLZTJKOLSTSO-DLBZAZTESA-N 1 3 325.541 2.835 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C1CC[NH+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001382551996 1349012554 /nfs/dbraw/zinc/01/25/54/1349012554.db2.gz OTXAILGGUPEHLZ-QAPCUYQASA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](F)CN1CCC([C@@H](C)NC(=O)[C@@H](C(C)C)[NH+](C)C)CC1 ZINC001382557991 1349018357 /nfs/dbraw/zinc/01/83/57/1349018357.db2.gz GIUDRQFDPAPCAE-HYVNUMGLSA-N 1 3 329.504 2.537 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C1CCN(C/C=C/Cl)CC1)[NH+](C)C ZINC001382558618 1349018774 /nfs/dbraw/zinc/01/87/74/1349018774.db2.gz DXJKBDXQOBFABC-BILQUBDUSA-N 1 3 329.916 2.542 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)C1CC[NH+](CC2CC(C)C2)CC1 ZINC001382565124 1349024231 /nfs/dbraw/zinc/02/42/31/1349024231.db2.gz MDYKFEVCNOKZED-CGZBRXJRSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)C1CC[NH+](Cc2ccsc2)CC1 ZINC001382565381 1349024598 /nfs/dbraw/zinc/02/45/98/1349024598.db2.gz NGTVUMGZVMLQTK-HNNXBMFYSA-N 1 3 349.544 2.949 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001420041161 1376358732 /nfs/dbraw/zinc/35/87/32/1376358732.db2.gz AYLUREZKGDFQEH-ZWKOTPCHSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001420041161 1376358744 /nfs/dbraw/zinc/35/87/44/1376358744.db2.gz AYLUREZKGDFQEH-ZWKOTPCHSA-N 1 3 325.541 2.932 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)[C@@H](C)CNC(=O)CC[NH+](C)C ZINC001394100842 1357471751 /nfs/dbraw/zinc/47/17/51/1357471751.db2.gz GZEKDICLLCUWPJ-AWEZNQCLSA-N 1 3 325.884 2.537 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[N@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001394106167 1357476897 /nfs/dbraw/zinc/47/68/97/1357476897.db2.gz KGUXQCUZXZOAQX-GJZGRUSLSA-N 1 3 347.494 2.836 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001394106167 1357476900 /nfs/dbraw/zinc/47/69/00/1357476900.db2.gz KGUXQCUZXZOAQX-GJZGRUSLSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[NH2+][C@@H](CCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001394188134 1357568222 /nfs/dbraw/zinc/56/82/22/1357568222.db2.gz MQARBBKKGZLVHM-MAUKXSAKSA-N 1 3 329.504 2.682 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)C1C[NH+]([C@H]2CCc3ccccc32)C1 ZINC001394226279 1357617590 /nfs/dbraw/zinc/61/75/90/1357617590.db2.gz KQILYIZWQKMBKD-YWZLYKJASA-N 1 3 341.499 2.595 10 0 EFAEHO CCc1ccccc1CN1CC([C@H](C)NC(=O)C[C@@H]2CC[N@H+](C)C2)C1 ZINC001394268091 1357652692 /nfs/dbraw/zinc/65/26/92/1357652692.db2.gz SGGSVULDRUYCQG-IRXDYDNUSA-N 1 3 343.515 2.527 10 0 EFAEHO CCc1ccccc1CN1CC([C@H](C)NC(=O)C[C@@H]2CC[N@@H+](C)C2)C1 ZINC001394268091 1357652704 /nfs/dbraw/zinc/65/27/04/1357652704.db2.gz SGGSVULDRUYCQG-IRXDYDNUSA-N 1 3 343.515 2.527 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](CCCc2ccc(C)cc2)C1)N(C)C ZINC001394268911 1357653503 /nfs/dbraw/zinc/65/35/03/1357653503.db2.gz URDNMLFBPLAWJO-YLJYHZDGSA-N 1 3 345.531 2.704 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001388683628 1352917990 /nfs/dbraw/zinc/91/79/90/1352917990.db2.gz WFPZCQBDBDAYIR-LSTHTHJFSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2C[C@@H]([NH2+][C@@H]3CCc4ccccc43)C2)C1 ZINC001388688106 1352921727 /nfs/dbraw/zinc/92/17/27/1352921727.db2.gz POVHQFOTEJZRNX-JSFADZTLSA-N 1 3 341.499 2.500 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(F)cc2)C1)N(C)C ZINC001388749358 1352975629 /nfs/dbraw/zinc/97/56/29/1352975629.db2.gz JYUHBXJEUHTSRM-CGTJXYLNSA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)CC[N@@H+]1CC1CC(C)(C)C1 ZINC001388774083 1353000033 /nfs/dbraw/zinc/00/00/33/1353000033.db2.gz MWULOMFICLHZLK-RCCFBDPRSA-N 1 3 337.552 2.978 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)CC[N@H+]1CC1CC(C)(C)C1 ZINC001388774083 1353000037 /nfs/dbraw/zinc/00/00/37/1353000037.db2.gz MWULOMFICLHZLK-RCCFBDPRSA-N 1 3 337.552 2.978 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccsc2)[C@@H]1CC ZINC001388774001 1353001182 /nfs/dbraw/zinc/00/11/82/1353001182.db2.gz LNFJROLXWXLNKA-DLBZAZTESA-N 1 3 337.533 2.949 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccsc2)[C@@H]1CC ZINC001388774001 1353001185 /nfs/dbraw/zinc/00/11/85/1353001185.db2.gz LNFJROLXWXLNKA-DLBZAZTESA-N 1 3 337.533 2.949 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+][C@@H]1CCCCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001388796838 1353027817 /nfs/dbraw/zinc/02/78/17/1353027817.db2.gz JBCMDHIBUJUHHJ-DLBZAZTESA-N 1 3 334.508 2.995 10 0 EFAEHO CCCN(C)CC(=O)N1CCCCC[C@@H]([NH2+]CC2CC(F)(F)C2)C1 ZINC001388808675 1353041105 /nfs/dbraw/zinc/04/11/05/1353041105.db2.gz VDGUZCONMDYWPY-MRXNPFEDSA-N 1 3 345.478 2.734 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N1CCC(N(C)C(=O)CC[NH+](C)C)CC1 ZINC001389325435 1353304324 /nfs/dbraw/zinc/30/43/24/1353304324.db2.gz GQDQJUBDKVJONV-HNNXBMFYSA-N 1 3 335.467 2.761 10 0 EFAEHO CC[C@H](C)C[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001394302666 1357686952 /nfs/dbraw/zinc/68/69/52/1357686952.db2.gz RKBOLXMCUJDFQQ-XLAORIBOSA-N 1 3 335.536 2.591 10 0 EFAEHO CC[C@H](C)C[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001394302666 1357686958 /nfs/dbraw/zinc/68/69/58/1357686958.db2.gz RKBOLXMCUJDFQQ-XLAORIBOSA-N 1 3 335.536 2.591 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CC12CCN(C/C=C/Cl)CC2 ZINC001389527625 1353455338 /nfs/dbraw/zinc/45/53/38/1353455338.db2.gz SZXAKNBXPZEBHG-ZRNALYAGSA-N 1 3 339.911 2.584 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CC12CCN(C/C=C/Cl)CC2 ZINC001389527625 1353455341 /nfs/dbraw/zinc/45/53/41/1353455341.db2.gz SZXAKNBXPZEBHG-ZRNALYAGSA-N 1 3 339.911 2.584 10 0 EFAEHO CC(C)CC[NH+]1CCC2(C[C@H]2NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001389529667 1353456532 /nfs/dbraw/zinc/45/65/32/1353456532.db2.gz VBBNMGQLDJSNNN-QGZVFWFLSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC12CC[NH+](CC1CC3(CCC3)C1)CC2 ZINC001389531283 1353459165 /nfs/dbraw/zinc/45/91/65/1353459165.db2.gz QXWVSGSXRZKEAB-GOSISDBHSA-N 1 3 347.547 2.878 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](NCc1ccccc1F)C1CC1 ZINC001389604285 1353503926 /nfs/dbraw/zinc/50/39/26/1353503926.db2.gz FKEMUFIGEFVZQF-MOPGFXCFSA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NC[C@@H](NCc1ccccc1F)C1CC1 ZINC001389604285 1353503928 /nfs/dbraw/zinc/50/39/28/1353503928.db2.gz FKEMUFIGEFVZQF-MOPGFXCFSA-N 1 3 347.478 2.683 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)C(C)(C)N2CCCC2)C2CC2)cc1 ZINC001389645639 1353529463 /nfs/dbraw/zinc/52/94/63/1353529463.db2.gz FVGRJUHURRPFEF-LJQANCHMSA-N 1 3 343.515 2.854 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3CCCCC3)C[C@H]21 ZINC001394324468 1357702447 /nfs/dbraw/zinc/70/24/47/1357702447.db2.gz QPCVQPPBSKXLJP-LDLYASANSA-N 1 3 335.536 2.593 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3CCCCC3)C[C@H]21 ZINC001394324468 1357702463 /nfs/dbraw/zinc/70/24/63/1357702463.db2.gz QPCVQPPBSKXLJP-LDLYASANSA-N 1 3 335.536 2.593 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@H+](C)CC2CC(C)(C)C2)C1 ZINC001389732634 1353588517 /nfs/dbraw/zinc/58/85/17/1353588517.db2.gz FCYVCKWKOHIJHY-KRWDZBQOSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@@H+](C)CC2CC(C)(C)C2)C1 ZINC001389732634 1353588521 /nfs/dbraw/zinc/58/85/21/1353588521.db2.gz FCYVCKWKOHIJHY-KRWDZBQOSA-N 1 3 337.552 2.933 10 0 EFAEHO O=C([C@H]1CC[N@@H+](C2CCCCC2)C1)N1CC[C@H](NC/C=C/Cl)C1 ZINC001389781418 1353617314 /nfs/dbraw/zinc/61/73/14/1353617314.db2.gz LCPASIBPDLTCJV-HSXPWJGJSA-N 1 3 339.911 2.584 10 0 EFAEHO O=C([C@H]1CC[N@H+](C2CCCCC2)C1)N1CC[C@H](NC/C=C/Cl)C1 ZINC001389781418 1353617315 /nfs/dbraw/zinc/61/73/15/1353617315.db2.gz LCPASIBPDLTCJV-HSXPWJGJSA-N 1 3 339.911 2.584 10 0 EFAEHO Cc1ccc(CN[C@H]2C[C@H](NC(=O)CCC[NH+](C)C)C2)c(Cl)c1 ZINC001389889021 1353669994 /nfs/dbraw/zinc/66/99/94/1353669994.db2.gz YMYJOOMVIMHXTA-WKILWMFISA-N 1 3 337.895 2.727 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCc3c2cccc3F)C1)N(C)C ZINC001389983503 1353724850 /nfs/dbraw/zinc/72/48/50/1353724850.db2.gz FDSYLRHVHVAXGY-QABNGEJJSA-N 1 3 347.478 2.636 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@H](C)c3ccc(F)cc3)C[C@H]21 ZINC001394334266 1357709121 /nfs/dbraw/zinc/70/91/21/1357709121.db2.gz DXESPLGLFRCATJ-AXUOBQJMSA-N 1 3 347.478 2.521 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@H](C)c3ccc(F)cc3)C[C@H]21 ZINC001394334266 1357709123 /nfs/dbraw/zinc/70/91/23/1357709123.db2.gz DXESPLGLFRCATJ-AXUOBQJMSA-N 1 3 347.478 2.521 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)c(F)c2)C1)N(C)C ZINC001390004837 1353736714 /nfs/dbraw/zinc/73/67/14/1353736714.db2.gz ASFCVEPWGQGRFB-MBMVNNNZSA-N 1 3 339.430 2.603 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](Cc3ccsc3)C[C@@H]2C1 ZINC001394350697 1357723935 /nfs/dbraw/zinc/72/39/35/1357723935.db2.gz PEIAGOIDBLFAPI-FGTMMUONSA-N 1 3 349.544 2.807 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccsc3)C[C@@H]2C1 ZINC001394350697 1357723938 /nfs/dbraw/zinc/72/39/38/1357723938.db2.gz PEIAGOIDBLFAPI-FGTMMUONSA-N 1 3 349.544 2.807 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]Cc2ccccc2CC)C(C)(C)C1 ZINC001394712211 1358039076 /nfs/dbraw/zinc/03/90/76/1358039076.db2.gz HTAZTUSZEDDTMT-IBGZPJMESA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CCC([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC001390283274 1353976469 /nfs/dbraw/zinc/97/64/69/1353976469.db2.gz RZPSMRMAQTVQFD-FHERZECASA-N 1 3 345.478 2.779 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc(CF)cc1 ZINC001390359821 1354027712 /nfs/dbraw/zinc/02/77/12/1354027712.db2.gz JSFIVPSVZHTONR-YJBOKZPZSA-N 1 3 335.467 2.623 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc(CF)cc1 ZINC001390359812 1354027983 /nfs/dbraw/zinc/02/79/83/1354027983.db2.gz JSFIVPSVZHTONR-MAUKXSAKSA-N 1 3 335.467 2.623 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001390379514 1354046668 /nfs/dbraw/zinc/04/66/68/1354046668.db2.gz UKQDQXJZRKNNKZ-RBSFLKMASA-N 1 3 337.895 2.583 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001390379514 1354046676 /nfs/dbraw/zinc/04/66/76/1354046676.db2.gz UKQDQXJZRKNNKZ-RBSFLKMASA-N 1 3 337.895 2.583 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001390379523 1354047340 /nfs/dbraw/zinc/04/73/40/1354047340.db2.gz UKQDQXJZRKNNKZ-RRFJBIMHSA-N 1 3 337.895 2.583 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001390379523 1354047343 /nfs/dbraw/zinc/04/73/43/1354047343.db2.gz UKQDQXJZRKNNKZ-RRFJBIMHSA-N 1 3 337.895 2.583 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001390397562 1354062913 /nfs/dbraw/zinc/06/29/13/1354062913.db2.gz GLWROARVUAYWPW-HOCLYGCPSA-N 1 3 345.478 2.781 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1F ZINC001390462373 1354097588 /nfs/dbraw/zinc/09/75/88/1354097588.db2.gz SEVAOVYAHCARDW-OAHLLOKOSA-N 1 3 335.467 2.603 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+][C@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001390478530 1354112075 /nfs/dbraw/zinc/11/20/75/1354112075.db2.gz JDLZOLPICZVOJM-QZTJIDSGSA-N 1 3 345.531 2.821 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001390488100 1354119975 /nfs/dbraw/zinc/11/99/75/1354119975.db2.gz ZQHJUGIZKSTIFQ-JXFKEZNVSA-N 1 3 349.494 2.802 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001390488108 1354119986 /nfs/dbraw/zinc/11/99/86/1354119986.db2.gz ZQHJUGIZKSTIFQ-UZLBHIALSA-N 1 3 349.494 2.802 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]Cc1cc2ccccc2s1)N(C)C ZINC001390505246 1354132417 /nfs/dbraw/zinc/13/24/17/1354132417.db2.gz HACHUTPVFJDQCN-XJKSGUPXSA-N 1 3 333.501 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC001390530833 1354153006 /nfs/dbraw/zinc/15/30/06/1354153006.db2.gz DNZBFQLGJPESDJ-KDOFPFPSSA-N 1 3 335.467 2.638 10 0 EFAEHO CC[C@H]([NH2+]C[C@H]1CCN(C(=O)CN2CCCC2)C1)c1ccccc1 ZINC001390607493 1354202100 /nfs/dbraw/zinc/20/21/00/1354202100.db2.gz UCOIXLUVYHWQFT-MJGOQNOKSA-N 1 3 329.488 2.672 10 0 EFAEHO CC(C)CCC[N@H+](C)[C@@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001390633157 1354231517 /nfs/dbraw/zinc/23/15/17/1354231517.db2.gz CGBNAXQTQQLCCM-QZTJIDSGSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)CCC[N@@H+](C)[C@@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001390633157 1354231520 /nfs/dbraw/zinc/23/15/20/1354231520.db2.gz CGBNAXQTQQLCCM-QZTJIDSGSA-N 1 3 325.541 2.932 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]([N@H+](C)C/C=C/c2ccccc2)C1)N(C)C ZINC001390641845 1354240140 /nfs/dbraw/zinc/24/01/40/1354240140.db2.gz ZHANTHOVIUAINO-HQNNKSEMSA-N 1 3 343.515 2.963 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]([N@@H+](C)C/C=C/c2ccccc2)C1)N(C)C ZINC001390641845 1354240143 /nfs/dbraw/zinc/24/01/43/1354240143.db2.gz ZHANTHOVIUAINO-HQNNKSEMSA-N 1 3 343.515 2.963 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]([N@H+](C)C/C=C\c2ccccc2)C1)N(C)C ZINC001390641848 1354240595 /nfs/dbraw/zinc/24/05/95/1354240595.db2.gz ZHANTHOVIUAINO-JORPEJITSA-N 1 3 343.515 2.963 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]([N@@H+](C)C/C=C\c2ccccc2)C1)N(C)C ZINC001390641848 1354240597 /nfs/dbraw/zinc/24/05/97/1354240597.db2.gz ZHANTHOVIUAINO-JORPEJITSA-N 1 3 343.515 2.963 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001390672416 1354265297 /nfs/dbraw/zinc/26/52/97/1354265297.db2.gz PXICUZRCDYCZJU-RHSMWYFYSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@H]2CCc3ccc(F)cc32)CC[N@@H+]1C ZINC001390765549 1354352311 /nfs/dbraw/zinc/35/23/11/1354352311.db2.gz LOEALSYVLAEVHX-UHOSZYNNSA-N 1 3 347.478 2.591 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@H]2CCc3ccc(F)cc32)CC[N@H+]1C ZINC001390765549 1354352314 /nfs/dbraw/zinc/35/23/14/1354352314.db2.gz LOEALSYVLAEVHX-UHOSZYNNSA-N 1 3 347.478 2.591 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@@H+]1C)[C@@H]1CCc2c1cccc2F ZINC001390770688 1354358396 /nfs/dbraw/zinc/35/83/96/1354358396.db2.gz HPXORPKJJSJGAX-DNVCBOLYSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@H+]1C)[C@@H]1CCc2c1cccc2F ZINC001390770688 1354358403 /nfs/dbraw/zinc/35/84/03/1354358403.db2.gz HPXORPKJJSJGAX-DNVCBOLYSA-N 1 3 347.478 2.735 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)C23CCC[NH+](CCC2)C3)c(C)c1 ZINC001390778333 1354365979 /nfs/dbraw/zinc/36/59/79/1354365979.db2.gz LCZHYOHPKZWGPC-UHFFFAOYSA-N 1 3 343.515 2.727 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@@H]2CCC[C@H]([NH+](C)C)C2)c1 ZINC001390849129 1354432282 /nfs/dbraw/zinc/43/22/82/1354432282.db2.gz ZMHBJKGIIMRKAZ-UXHICEINSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C)[C@@H]1CCc2c1cccc2Cl ZINC001390866893 1354449504 /nfs/dbraw/zinc/44/95/04/1354449504.db2.gz WDKACHFFUNRVTJ-QGZVFWFLSA-N 1 3 337.895 2.716 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C)[C@@H]1CCc2c1cccc2Cl ZINC001390866893 1354449506 /nfs/dbraw/zinc/44/95/06/1354449506.db2.gz WDKACHFFUNRVTJ-QGZVFWFLSA-N 1 3 337.895 2.716 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@H+](CCCc2cccc(F)c2)C1)N(C)C ZINC001391105823 1354801052 /nfs/dbraw/zinc/80/10/52/1354801052.db2.gz MFRNCYPQUGTJLY-PKOBYXMFSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@@H+](CCCc2cccc(F)c2)C1)N(C)C ZINC001391105823 1354801057 /nfs/dbraw/zinc/80/10/57/1354801057.db2.gz MFRNCYPQUGTJLY-PKOBYXMFSA-N 1 3 349.494 2.537 10 0 EFAEHO Cc1cccc([C@@H](C)[N@@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001391116055 1354818579 /nfs/dbraw/zinc/81/85/79/1354818579.db2.gz KGYZSHKRUKELTI-MSOLQXFVSA-N 1 3 331.504 2.834 10 0 EFAEHO Cc1cccc([C@@H](C)[N@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001391116055 1354818584 /nfs/dbraw/zinc/81/85/84/1354818584.db2.gz KGYZSHKRUKELTI-MSOLQXFVSA-N 1 3 331.504 2.834 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[N@H+](C[C@@H]1CCC(F)(F)C1)C1CC1)N(C)C ZINC001391200883 1354928861 /nfs/dbraw/zinc/92/88/61/1354928861.db2.gz OSBBINUXUVCVRH-ZBFHGGJFSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[N@@H+](C[C@@H]1CCC(F)(F)C1)C1CC1)N(C)C ZINC001391200883 1354928864 /nfs/dbraw/zinc/92/88/64/1354928864.db2.gz OSBBINUXUVCVRH-ZBFHGGJFSA-N 1 3 345.478 2.589 10 0 EFAEHO CCc1ccc(CN(CCNC(=O)C[C@@H]2CC[N@H+](C)C2)C2CC2)cc1 ZINC001391204116 1354931979 /nfs/dbraw/zinc/93/19/79/1354931979.db2.gz YXWDSDJDEHYUGX-IBGZPJMESA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1ccc(CN(CCNC(=O)C[C@@H]2CC[N@@H+](C)C2)C2CC2)cc1 ZINC001391204116 1354931986 /nfs/dbraw/zinc/93/19/86/1354931986.db2.gz YXWDSDJDEHYUGX-IBGZPJMESA-N 1 3 343.515 2.671 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+][C@@H](C)c1cccc(OC)c1 ZINC001391226262 1354948287 /nfs/dbraw/zinc/94/82/87/1354948287.db2.gz MTVUMQVUMLWWGY-QFBILLFUSA-N 1 3 347.503 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H](C)[NH2+]CC2CC(C)(C)C2)CC1 ZINC001391241855 1354964823 /nfs/dbraw/zinc/96/48/23/1354964823.db2.gz IDQGHOYFCSMVSP-INIZCTEOSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@@H](F)CN(C)C[C@H]1CCN(C(=O)C2CC[NH+](C(C)C)CC2)C1 ZINC001391348638 1355105810 /nfs/dbraw/zinc/10/58/10/1355105810.db2.gz CNTXUJWXFPLVGB-SJLPKXTDSA-N 1 3 341.515 2.635 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)N1CC[C@H](CN(C)C/C=C/Cl)C1 ZINC001391354579 1355116256 /nfs/dbraw/zinc/11/62/56/1355116256.db2.gz IMQCMNMOLXCSSX-QOCAVEGASA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)N1CC[C@H](CN(C)C/C=C/Cl)C1 ZINC001391354579 1355116259 /nfs/dbraw/zinc/11/62/59/1355116259.db2.gz IMQCMNMOLXCSSX-QOCAVEGASA-N 1 3 341.927 2.782 10 0 EFAEHO CN(CCF)CC1CCN(C(=O)C(C)(C)[N@H+](C)C2CCCC2)CC1 ZINC001391363000 1355128597 /nfs/dbraw/zinc/12/85/97/1355128597.db2.gz MLSGZNQYUZKQOK-UHFFFAOYSA-N 1 3 341.515 2.779 10 0 EFAEHO CN(CCF)CC1CCN(C(=O)C(C)(C)[N@@H+](C)C2CCCC2)CC1 ZINC001391363000 1355128601 /nfs/dbraw/zinc/12/86/01/1355128601.db2.gz MLSGZNQYUZKQOK-UHFFFAOYSA-N 1 3 341.515 2.779 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(C[N@H+](C)CC[C@H](C)F)CC1 ZINC001391365928 1355133274 /nfs/dbraw/zinc/13/32/74/1355133274.db2.gz QITHKBGHSCWIJC-FUHWJXTLSA-N 1 3 341.515 2.779 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(C[N@@H+](C)CC[C@H](C)F)CC1 ZINC001391365928 1355133276 /nfs/dbraw/zinc/13/32/76/1355133276.db2.gz QITHKBGHSCWIJC-FUHWJXTLSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2cc3ccccc3o2)C1 ZINC001398586877 1360657624 /nfs/dbraw/zinc/65/76/24/1360657624.db2.gz XCUAXIVZVVDPCY-WKILWMFISA-N 1 3 329.444 2.510 10 0 EFAEHO Cc1ccc(C)c(CN2CC(CNC(=O)C[NH+]3[C@H](C)CC[C@H]3C)C2)c1 ZINC001391523057 1355273326 /nfs/dbraw/zinc/27/33/26/1355273326.db2.gz IMNWIUBNAZONKU-QZTJIDSGSA-N 1 3 343.515 2.724 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001391559593 1355304382 /nfs/dbraw/zinc/30/43/82/1355304382.db2.gz AJOJUIWOJHDEPP-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCN(CCc2cccs2)C1)[NH+]1CCCC1 ZINC001391568114 1355312407 /nfs/dbraw/zinc/31/24/07/1355312407.db2.gz OKBKRVHDVCFYFM-WMZOPIPTSA-N 1 3 349.544 2.602 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@@H]1CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001391594346 1355336146 /nfs/dbraw/zinc/33/61/46/1355336146.db2.gz WEVGHVLBGWVMPF-GOSISDBHSA-N 1 3 342.487 2.590 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@@H]1CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001391594346 1355336150 /nfs/dbraw/zinc/33/61/50/1355336150.db2.gz WEVGHVLBGWVMPF-GOSISDBHSA-N 1 3 342.487 2.590 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](CC)NCc1cc(C)ccc1F ZINC001391690464 1355437367 /nfs/dbraw/zinc/43/73/67/1355437367.db2.gz HBUAEZOBKMSOMW-IEBWSBKVSA-N 1 3 349.494 2.993 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](CC)NCc1cc(C)ccc1F ZINC001391690464 1355437369 /nfs/dbraw/zinc/43/73/69/1355437369.db2.gz HBUAEZOBKMSOMW-IEBWSBKVSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCC[N@@H+]1CC(C)C)NCc1ccccc1F ZINC001391694319 1355441203 /nfs/dbraw/zinc/44/12/03/1355441203.db2.gz BZKQRDZTLJKQBB-IEBWSBKVSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCC[N@H+]1CC(C)C)NCc1ccccc1F ZINC001391694319 1355441206 /nfs/dbraw/zinc/44/12/06/1355441206.db2.gz BZKQRDZTLJKQBB-IEBWSBKVSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCC[N@@H+]1C(C)C)NCc1cc(C)ccc1F ZINC001391696549 1355442628 /nfs/dbraw/zinc/44/26/28/1355442628.db2.gz SXMVLULDWFEHNJ-MJGOQNOKSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCC[N@H+]1C(C)C)NCc1cc(C)ccc1F ZINC001391696549 1355442631 /nfs/dbraw/zinc/44/26/31/1355442631.db2.gz SXMVLULDWFEHNJ-MJGOQNOKSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCC[N@@H+]1C(C)C)NCc1ncccc1C ZINC001391728156 1355472411 /nfs/dbraw/zinc/47/24/11/1355472411.db2.gz MRHHFLMQHJHDIH-MJGOQNOKSA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCC[N@H+]1C(C)C)NCc1ncccc1C ZINC001391728156 1355472413 /nfs/dbraw/zinc/47/24/13/1355472413.db2.gz MRHHFLMQHJHDIH-MJGOQNOKSA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)[NH2+]CC1(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CCCC1 ZINC001391773907 1355518013 /nfs/dbraw/zinc/51/80/13/1355518013.db2.gz QIYTYVJJDRDNTF-GOSISDBHSA-N 1 3 327.488 2.626 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@](C)(CNCc1sccc1Cl)C1CC1 ZINC001391812240 1355555731 /nfs/dbraw/zinc/55/57/31/1355555731.db2.gz JLDLHTNURIKWQL-INIZCTEOSA-N 1 3 343.924 2.728 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1[C@@H](C)[NH2+]Cc1ccsc1 ZINC001436676441 1387279747 /nfs/dbraw/zinc/27/97/47/1387279747.db2.gz XKZBYSYKWKETRN-WBVHZDCISA-N 1 3 337.533 2.949 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cccc2ccccc21)N(C)C(=O)CN1CCCC1 ZINC001392134236 1355792769 /nfs/dbraw/zinc/79/27/69/1355792769.db2.gz NRUCRFKISMWVNU-KRWDZBQOSA-N 1 3 339.483 2.872 10 0 EFAEHO C[C@@H](C[NH2+][C@@H](C)c1cccc(Cl)c1)N(C)C(=O)CN1CCCC1 ZINC001392136884 1355794860 /nfs/dbraw/zinc/79/48/60/1355794860.db2.gz WZDNFEQZWXUBAJ-GJZGRUSLSA-N 1 3 337.895 2.933 10 0 EFAEHO C[C@@H]([NH2+]C[C@H](C)N(C)C(=O)CN1CCCC1)c1cccc(Cl)c1 ZINC001392136886 1355795066 /nfs/dbraw/zinc/79/50/66/1355795066.db2.gz WZDNFEQZWXUBAJ-LSDHHAIUSA-N 1 3 337.895 2.933 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)CC[NH+]2CCCCC2)c1 ZINC001392138661 1355796920 /nfs/dbraw/zinc/79/69/20/1355796920.db2.gz OYZLROFNHYXOGW-KRWDZBQOSA-N 1 3 349.494 2.947 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1F ZINC001392176560 1355830966 /nfs/dbraw/zinc/83/09/66/1355830966.db2.gz FHHGAIKWDKRJKW-LPHOPBHVSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)c1 ZINC001392238468 1355895781 /nfs/dbraw/zinc/89/57/81/1355895781.db2.gz ZPLABTRXFXZSDY-HKUYNNGSSA-N 1 3 331.504 2.567 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H]1CCc2ccccc21 ZINC001392248142 1355904522 /nfs/dbraw/zinc/90/45/22/1355904522.db2.gz GCOSECXEMGOJOS-RBUKOAKNSA-N 1 3 331.504 2.745 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001392277374 1355933401 /nfs/dbraw/zinc/93/34/01/1355933401.db2.gz CKIZDQOBTOSEMT-KXBFYZLASA-N 1 3 347.478 2.619 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001392323531 1355988218 /nfs/dbraw/zinc/98/82/18/1355988218.db2.gz UUUSFBUVPOVKMK-HNNXBMFYSA-N 1 3 333.467 2.544 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001392323531 1355988221 /nfs/dbraw/zinc/98/82/21/1355988221.db2.gz UUUSFBUVPOVKMK-HNNXBMFYSA-N 1 3 333.467 2.544 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2Cc2ccccc2F)C1 ZINC001392340682 1356008173 /nfs/dbraw/zinc/00/81/73/1356008173.db2.gz GIKIPCQNPPECTQ-HKUYNNGSSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2Cc2ccccc2F)C1 ZINC001392340682 1356008176 /nfs/dbraw/zinc/00/81/76/1356008176.db2.gz GIKIPCQNPPECTQ-HKUYNNGSSA-N 1 3 347.478 2.589 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+][C@@H]1CCCc2ccc(F)cc21)N(C)C ZINC001392488725 1356070312 /nfs/dbraw/zinc/07/03/12/1356070312.db2.gz YSMWUPOSFPSEHO-FSPWUOQZSA-N 1 3 335.467 2.638 10 0 EFAEHO C[C@H](C[NH2+]Cc1cccc2ccccc21)NC(=O)CN1CC[C@H](C)C1 ZINC001392511031 1356086916 /nfs/dbraw/zinc/08/69/16/1356086916.db2.gz KUKDQGLIQRCZMY-DLBZAZTESA-N 1 3 339.483 2.776 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)[C@@H](C(C)C)[NH+](C)C)c(Cl)c1 ZINC001392523365 1356096614 /nfs/dbraw/zinc/09/66/14/1356096614.db2.gz BVPNONMKDRGNGZ-RHSMWYFYSA-N 1 3 339.911 2.829 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]Cc1ccc(C(F)(F)F)cc1)N(C)C ZINC001392527371 1356100246 /nfs/dbraw/zinc/10/02/46/1356100246.db2.gz UWFCTGYHPAQQMJ-IUODEOHRSA-N 1 3 345.409 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+][C@H](C)c1ccc2c(c1)CCC2 ZINC001392534942 1356106863 /nfs/dbraw/zinc/10/68/63/1356106863.db2.gz GCQTYAHITNBLRV-HZPDHXFCSA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+][C@H](C)c1ccc2c(c1)CCC2 ZINC001392616261 1356163771 /nfs/dbraw/zinc/16/37/71/1356163771.db2.gz GCQTYAHITNBLRV-JKSUJKDBSA-N 1 3 331.504 2.671 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001392683048 1356232386 /nfs/dbraw/zinc/23/23/86/1356232386.db2.gz HMSQZPRIZORVRF-DNVCBOLYSA-N 1 3 345.531 2.890 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001392683048 1356232389 /nfs/dbraw/zinc/23/23/89/1356232389.db2.gz HMSQZPRIZORVRF-DNVCBOLYSA-N 1 3 345.531 2.890 10 0 EFAEHO Cc1cccc(CCC[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001392691087 1356243409 /nfs/dbraw/zinc/24/34/09/1356243409.db2.gz XYFVQDFVUCCRKG-RTBURBONSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1cccc(CCC[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001392691087 1356243414 /nfs/dbraw/zinc/24/34/14/1356243414.db2.gz XYFVQDFVUCCRKG-RTBURBONSA-N 1 3 345.531 2.706 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)Cc1cccc(OC)c1 ZINC001392725102 1356283599 /nfs/dbraw/zinc/28/35/99/1356283599.db2.gz IEYCGJMSYJAJML-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)Cc1cccc(OC)c1 ZINC001392725102 1356283603 /nfs/dbraw/zinc/28/36/03/1356283603.db2.gz IEYCGJMSYJAJML-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+]CC2CC3(CCC3)C2)C2CC2)CCC1 ZINC001392764914 1356309053 /nfs/dbraw/zinc/30/90/53/1356309053.db2.gz MUEDMYFJYZBLBB-QGZVFWFLSA-N 1 3 333.520 2.535 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]C[C@@H](NC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001392803146 1356340311 /nfs/dbraw/zinc/34/03/11/1356340311.db2.gz SDBDCYXKJODWPH-VQIMIIECSA-N 1 3 331.504 2.881 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+][C@@H]3CCc4c3cccc4F)CC2)CCC1 ZINC001392910392 1356425193 /nfs/dbraw/zinc/42/51/93/1356425193.db2.gz BNKHSTHNCSZSLM-QGZVFWFLSA-N 1 3 345.462 2.536 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+][C@H]2CCc3ccc(Cl)cc32)CC1)N(C)C ZINC001392920758 1356432427 /nfs/dbraw/zinc/43/24/27/1356432427.db2.gz VQCRAKMFMFTECR-DLBZAZTESA-N 1 3 349.906 2.906 10 0 EFAEHO C[C@@H](NC1(CNC(=O)CC2CC[NH+](C)CC2)CC1)c1cccc(F)c1 ZINC001392942333 1356451889 /nfs/dbraw/zinc/45/18/89/1356451889.db2.gz PMBUUAXDWLILCZ-OAHLLOKOSA-N 1 3 347.478 2.857 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NCCN(CCF)C1CCCCCC1 ZINC001392969151 1356475795 /nfs/dbraw/zinc/47/57/95/1356475795.db2.gz OOCWGFAKBSPPFY-CALCHBBNSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCCN(CCF)C1CCCCCC1 ZINC001392969151 1356475798 /nfs/dbraw/zinc/47/57/98/1356475798.db2.gz OOCWGFAKBSPPFY-CALCHBBNSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N(C)CCNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001492816917 1356479627 /nfs/dbraw/zinc/47/96/27/1356479627.db2.gz MPCWNSIYOXQSTE-QAPCUYQASA-N 1 3 335.467 2.667 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N(C)CCNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001492816917 1356479630 /nfs/dbraw/zinc/47/96/30/1356479630.db2.gz MPCWNSIYOXQSTE-QAPCUYQASA-N 1 3 335.467 2.667 10 0 EFAEHO CC[C@H](F)C[N@H+](CC1CC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001392976889 1356483834 /nfs/dbraw/zinc/48/38/34/1356483834.db2.gz ZTXHJCRUYHBDCY-KRWDZBQOSA-N 1 3 339.499 2.533 10 0 EFAEHO CC[C@H](F)C[N@@H+](CC1CC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001392976889 1356483835 /nfs/dbraw/zinc/48/38/35/1356483835.db2.gz ZTXHJCRUYHBDCY-KRWDZBQOSA-N 1 3 339.499 2.533 10 0 EFAEHO CC[C@H](F)C[N@@H+]1CC[C@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001392995374 1356499197 /nfs/dbraw/zinc/49/91/97/1356499197.db2.gz WLMZQALUBOVURW-LPHOPBHVSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](F)C[N@H+]1CC[C@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001392995374 1356499200 /nfs/dbraw/zinc/49/92/00/1356499200.db2.gz WLMZQALUBOVURW-LPHOPBHVSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCc2ccccc2F)C[C@H]1C ZINC001393033390 1356525539 /nfs/dbraw/zinc/52/55/39/1356525539.db2.gz SPOZLNKDPJILPA-SJLPKXTDSA-N 1 3 349.494 2.678 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CCc2ccccc2F)C[C@@H]1C ZINC001393033395 1356525939 /nfs/dbraw/zinc/52/59/39/1356525939.db2.gz SPOZLNKDPJILPA-WMZOPIPTSA-N 1 3 349.494 2.678 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]Cc1sccc1Cl ZINC001393052272 1356540234 /nfs/dbraw/zinc/54/02/34/1356540234.db2.gz JHBWXZBGHRVHES-CYBMUJFWSA-N 1 3 343.924 2.822 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@]1(C)CCN([C@H]2CCCc3ccc(F)cc32)C1 ZINC001393107332 1356602735 /nfs/dbraw/zinc/60/27/35/1356602735.db2.gz LPHXZCXMAVYSAA-ICSRJNTNSA-N 1 3 347.478 2.735 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@]1(C)CCN([C@H]2CCCc3ccc(F)cc32)C1 ZINC001393107328 1356602799 /nfs/dbraw/zinc/60/27/99/1356602799.db2.gz LPHXZCXMAVYSAA-AZUAARDMSA-N 1 3 347.478 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@H+](CC1CC(C)(C)C1)C2 ZINC001394352285 1357726461 /nfs/dbraw/zinc/72/64/61/1357726461.db2.gz YLVYBWQPMJKWBK-UHFFFAOYSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@@H+](CC1CC(C)(C)C1)C2 ZINC001394352285 1357726465 /nfs/dbraw/zinc/72/64/65/1357726465.db2.gz YLVYBWQPMJKWBK-UHFFFAOYSA-N 1 3 335.536 2.687 10 0 EFAEHO CC[C@H](F)C[NH+]1CCC(C)(CNC(=O)C(C)(C)N2CCCC2)CC1 ZINC001393177990 1356683534 /nfs/dbraw/zinc/68/35/34/1356683534.db2.gz HLAAMQSDYWNHPN-INIZCTEOSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@]1(C)CCC[N@H+](Cc2ccsc2)C1 ZINC001393206439 1356719372 /nfs/dbraw/zinc/71/93/72/1356719372.db2.gz HJGJIJVDHHZHAE-SFHVURJKSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@]1(C)CCC[N@@H+](Cc2ccsc2)C1 ZINC001393206439 1356719376 /nfs/dbraw/zinc/71/93/76/1356719376.db2.gz HJGJIJVDHHZHAE-SFHVURJKSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@]1(C)CCC[N@H+](Cc2ccsc2)C1 ZINC001393206434 1356719659 /nfs/dbraw/zinc/71/96/59/1356719659.db2.gz HJGJIJVDHHZHAE-GOSISDBHSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@]1(C)CCC[N@@H+](Cc2ccsc2)C1 ZINC001393206434 1356719663 /nfs/dbraw/zinc/71/96/63/1356719663.db2.gz HJGJIJVDHHZHAE-GOSISDBHSA-N 1 3 337.533 2.807 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]CC2CCCCCC2)C1 ZINC001393395742 1356814917 /nfs/dbraw/zinc/81/49/17/1356814917.db2.gz JQTRSCCFVFQBRD-HKUYNNGSSA-N 1 3 337.552 2.983 10 0 EFAEHO Cc1cccc([C@@H](C)[N@H+]2C[C@H]3CN(C(=O)CN(C)C(C)C)C[C@H]3C2)c1 ZINC001393419005 1356833099 /nfs/dbraw/zinc/83/30/99/1356833099.db2.gz QZJOKOGZGUWXGU-RLLQIKCJSA-N 1 3 343.515 2.786 10 0 EFAEHO Cc1cccc([C@@H](C)[N@@H+]2C[C@H]3CN(C(=O)CN(C)C(C)C)C[C@H]3C2)c1 ZINC001393419005 1356833100 /nfs/dbraw/zinc/83/31/00/1356833100.db2.gz QZJOKOGZGUWXGU-RLLQIKCJSA-N 1 3 343.515 2.786 10 0 EFAEHO Cc1cc(F)ccc1CN1CC[C@@H]2[C@@H]1CCCN2C(=O)CC[NH+](C)C ZINC001393460817 1356862252 /nfs/dbraw/zinc/86/22/52/1356862252.db2.gz JTFOCSOWIVKSBC-RBUKOAKNSA-N 1 3 347.478 2.651 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CC[NH+](CCC1CCCC1)CC2 ZINC001393503050 1356904826 /nfs/dbraw/zinc/90/48/26/1356904826.db2.gz UTFGLPDVXZFAPS-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)NCC2(NCc3ccsc3)CCC2)C1 ZINC001393566257 1356955481 /nfs/dbraw/zinc/95/54/81/1356955481.db2.gz MDRLJCBVBYUABI-DLBZAZTESA-N 1 3 349.544 2.997 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@H+](Cc2ccsc2)CC1)N(C)C ZINC001393593522 1356973632 /nfs/dbraw/zinc/97/36/32/1356973632.db2.gz BHQDOQYAUAKJSV-IRXDYDNUSA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@@H+](Cc2ccsc2)CC1)N(C)C ZINC001393593522 1356973634 /nfs/dbraw/zinc/97/36/34/1356973634.db2.gz BHQDOQYAUAKJSV-IRXDYDNUSA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@H+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001393595264 1356976487 /nfs/dbraw/zinc/97/64/87/1356976487.db2.gz MQSSGLKNTFSADP-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@@H+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001393595264 1356976491 /nfs/dbraw/zinc/97/64/91/1356976491.db2.gz MQSSGLKNTFSADP-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)[C@H](C)[NH+]1CCCCCC1 ZINC001393632635 1357028479 /nfs/dbraw/zinc/02/84/79/1357028479.db2.gz LVCPNQLWQAIZLT-IRXDYDNUSA-N 1 3 329.504 2.779 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@H+](C)[C@H]1CCc2ccccc21)N(C)C ZINC001393643828 1357045109 /nfs/dbraw/zinc/04/51/09/1357045109.db2.gz PNCGEGGLOAABTK-OALUTQOASA-N 1 3 331.504 2.794 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@@H+](C)[C@H]1CCc2ccccc21)N(C)C ZINC001393643828 1357045112 /nfs/dbraw/zinc/04/51/12/1357045112.db2.gz PNCGEGGLOAABTK-OALUTQOASA-N 1 3 331.504 2.794 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)[C@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001394425516 1357803739 /nfs/dbraw/zinc/80/37/39/1357803739.db2.gz DNWMNVIFHOVLCS-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C[NH2+][C@H](C)c1ccccc1)C1CC1 ZINC001394437938 1357818202 /nfs/dbraw/zinc/81/82/02/1357818202.db2.gz CNLRZDFEWYWCOG-VQIMIIECSA-N 1 3 331.504 2.914 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(Cl)s1 ZINC001394530738 1357915794 /nfs/dbraw/zinc/91/57/94/1357915794.db2.gz UAUAZHVRJRXKIG-STQMWFEESA-N 1 3 343.924 2.680 10 0 EFAEHO C[C@H](CN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(Cl)s1 ZINC001394530725 1357915810 /nfs/dbraw/zinc/91/58/10/1357915810.db2.gz UAUAZHVRJRXKIG-CHWSQXEVSA-N 1 3 343.924 2.680 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]CCc1ccccc1Cl ZINC001394570476 1357962101 /nfs/dbraw/zinc/96/21/01/1357962101.db2.gz ZFQYNOVVILULAC-HNNXBMFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(CF)cc1 ZINC001394570433 1357962495 /nfs/dbraw/zinc/96/24/95/1357962495.db2.gz ZAIMHHGBGXIFSE-APWZRJJASA-N 1 3 349.494 2.967 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CC2CCC3(CC3)CC2)[C@H]1C ZINC001394675837 1357994046 /nfs/dbraw/zinc/99/40/46/1357994046.db2.gz KSSWDMQRRNOALG-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc(CF)cc2)C[C@H]1C ZINC001394677801 1357995742 /nfs/dbraw/zinc/99/57/42/1357995742.db2.gz HRZCCKIYUNGJJB-CRAIPNDOSA-N 1 3 335.467 2.575 10 0 EFAEHO CC(C)c1cccc(CN[C@@H]2CCN(C(=O)CCC[NH+](C)C)[C@H]2C)n1 ZINC001394677957 1357996506 /nfs/dbraw/zinc/99/65/06/1357996506.db2.gz XFRZPGGKMCJSTA-QFBILLFUSA-N 1 3 346.519 2.626 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CC3CCCC3)[C@H]2C1 ZINC001394684143 1358003709 /nfs/dbraw/zinc/00/37/09/1358003709.db2.gz GTDGOYNPPNLQKU-FHWLQOOXSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H](C[NH2+]Cc2ccc(CF)cc2)C1 ZINC001394705445 1358032395 /nfs/dbraw/zinc/03/23/95/1358032395.db2.gz ZHOHMTXJIZMXGX-RBUKOAKNSA-N 1 3 349.494 2.871 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C[NH2+]CC1CC(C)(C)C1)C(C)(C)C ZINC001394829944 1358129276 /nfs/dbraw/zinc/12/92/76/1358129276.db2.gz BHMYHPURVQAJSB-INIZCTEOSA-N 1 3 325.541 2.885 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC001394848474 1358154459 /nfs/dbraw/zinc/15/44/59/1358154459.db2.gz YJQFIWHGLXYHRP-MRXNPFEDSA-N 1 3 349.494 2.883 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(F)cc32)C1)C1CCC1 ZINC001436952366 1387342670 /nfs/dbraw/zinc/34/26/70/1387342670.db2.gz IPXQUOSVFLEXCC-JTDSTZFVSA-N 1 3 345.462 2.534 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001437035177 1387376008 /nfs/dbraw/zinc/37/60/08/1387376008.db2.gz QBTLAQPJTSESCO-IBGZPJMESA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001437134370 1387409487 /nfs/dbraw/zinc/40/94/87/1387409487.db2.gz PTSXMZCTJHBSNP-HOCLYGCPSA-N 1 3 345.478 2.779 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001437134367 1387409585 /nfs/dbraw/zinc/40/95/85/1387409585.db2.gz PTSXMZCTJHBSNP-GOEBONIOSA-N 1 3 345.478 2.779 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CCC[NH+](C)C)CCN1Cc1ccc(F)cc1 ZINC001397199259 1359744312 /nfs/dbraw/zinc/74/43/12/1359744312.db2.gz UPBVRTDVGRIJJD-ZWKOTPCHSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@H+](CCC(C)C)CC(C)(C)C1)N(C)C ZINC001397269511 1359803536 /nfs/dbraw/zinc/80/35/36/1359803536.db2.gz JJIPZVMBUIDISU-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@@H+](CCC(C)C)CC(C)(C)C1)N(C)C ZINC001397269511 1359803539 /nfs/dbraw/zinc/80/35/39/1359803539.db2.gz JJIPZVMBUIDISU-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CCC[N@@H+]1C1CCCC1)NCc1ccccc1F ZINC001437149537 1387423139 /nfs/dbraw/zinc/42/31/39/1387423139.db2.gz RWNDGGDLNNIXEM-DNVCBOLYSA-N 1 3 347.478 2.827 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CCC[N@H+]1C1CCCC1)NCc1ccccc1F ZINC001437149537 1387423140 /nfs/dbraw/zinc/42/31/40/1387423140.db2.gz RWNDGGDLNNIXEM-DNVCBOLYSA-N 1 3 347.478 2.827 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]CC3CC(C)(C)C3)C2)C1 ZINC001397731674 1360086068 /nfs/dbraw/zinc/08/60/68/1360086068.db2.gz IUJLPJBHSCHKEJ-XYJFISCASA-N 1 3 335.536 2.639 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]2C1 ZINC001397766559 1360118922 /nfs/dbraw/zinc/11/89/22/1360118922.db2.gz KSXICBPUDKFBEH-MSOLQXFVSA-N 1 3 337.552 2.791 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]2C1 ZINC001397766559 1360118928 /nfs/dbraw/zinc/11/89/28/1360118928.db2.gz KSXICBPUDKFBEH-MSOLQXFVSA-N 1 3 337.552 2.791 10 0 EFAEHO CC(C)c1ccc(CN2CC[C@H](NC(=O)CC[NH+](C)C)[C@H]2C)cc1 ZINC001397799417 1360148974 /nfs/dbraw/zinc/14/89/74/1360148974.db2.gz YZKMVUCVMQLBCC-APWZRJJASA-N 1 3 331.504 2.841 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@H+](CC[C@@H](C)F)CC(C)(C)C1 ZINC001397819020 1360171163 /nfs/dbraw/zinc/17/11/63/1360171163.db2.gz URTOLWYUNUPSSD-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@@H+](CC[C@@H](C)F)CC(C)(C)C1 ZINC001397819020 1360171164 /nfs/dbraw/zinc/17/11/64/1360171164.db2.gz URTOLWYUNUPSSD-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H]1CC[N@H+](CCC2CCCCC2)C1 ZINC001398295854 1360448424 /nfs/dbraw/zinc/44/84/24/1360448424.db2.gz ZUUUFBIACMLTPW-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H]1CC[N@@H+](CCC2CCCCC2)C1 ZINC001398295854 1360448427 /nfs/dbraw/zinc/44/84/27/1360448427.db2.gz ZUUUFBIACMLTPW-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1cc(C)cc(CN2CC[C@@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001398303007 1360453078 /nfs/dbraw/zinc/45/30/78/1360453078.db2.gz XCAAGMNUHIBIBJ-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(CN2CC[C@@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001398303007 1360453081 /nfs/dbraw/zinc/45/30/81/1360453081.db2.gz XCAAGMNUHIBIBJ-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC12CC[NH+](Cc1ccsc1)CC2)N(C)C ZINC001398366155 1360487903 /nfs/dbraw/zinc/48/79/03/1360487903.db2.gz QENHNDWXQQZBQD-JKSUJKDBSA-N 1 3 335.517 2.559 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC12CC[NH+](Cc1ccsc1)CC2)N(C)C ZINC001398366152 1360487992 /nfs/dbraw/zinc/48/79/92/1360487992.db2.gz QENHNDWXQQZBQD-HZPDHXFCSA-N 1 3 335.517 2.559 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC12CC[NH+](Cc1ccsc1)CC2)N(C)C ZINC001398366146 1360488069 /nfs/dbraw/zinc/48/80/69/1360488069.db2.gz QENHNDWXQQZBQD-CVEARBPZSA-N 1 3 335.517 2.559 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@H]1C[C@H](NCc2ccccc2Cl)C1 ZINC001398533365 1360630418 /nfs/dbraw/zinc/63/04/18/1360630418.db2.gz CPNWQFHKOJUOAX-BRWVUGGUSA-N 1 3 349.906 2.951 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@H]1C[C@H](NCc2ccccc2Cl)C1 ZINC001398533365 1360630424 /nfs/dbraw/zinc/63/04/24/1360630424.db2.gz CPNWQFHKOJUOAX-BRWVUGGUSA-N 1 3 349.906 2.951 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC[N@H+](C)CC1CCC2(CC2)CC1 ZINC001492873805 1360640861 /nfs/dbraw/zinc/64/08/61/1360640861.db2.gz UZSSXZHZAWYZHW-IAGOWNOFSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001492873805 1360640866 /nfs/dbraw/zinc/64/08/66/1360640866.db2.gz UZSSXZHZAWYZHW-IAGOWNOFSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001398570619 1360650677 /nfs/dbraw/zinc/65/06/77/1360650677.db2.gz VCULAVUEJBOQGS-WGSAOQKQSA-N 1 3 329.488 2.643 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2cc3ccccc3s2)C1 ZINC001398581156 1360655911 /nfs/dbraw/zinc/65/59/11/1360655911.db2.gz RLDJLHWYEAEIIY-WKILWMFISA-N 1 3 345.512 2.978 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@H+](CCC(F)(F)F)CC[C@H]21 ZINC001398588375 1360658943 /nfs/dbraw/zinc/65/89/43/1360658943.db2.gz SKACHYWEEQUKNY-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@@H+](CCC(F)(F)F)CC[C@H]21 ZINC001398588375 1360658946 /nfs/dbraw/zinc/65/89/46/1360658946.db2.gz SKACHYWEEQUKNY-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@H+](CCC(F)(F)F)CC[C@@H]21 ZINC001398588371 1360659376 /nfs/dbraw/zinc/65/93/76/1360659376.db2.gz SKACHYWEEQUKNY-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@@H+](CCC(F)(F)F)CC[C@@H]21 ZINC001398588371 1360659378 /nfs/dbraw/zinc/65/93/78/1360659378.db2.gz SKACHYWEEQUKNY-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001398607663 1360667556 /nfs/dbraw/zinc/66/75/56/1360667556.db2.gz ABNBSTLJULNXTD-KMMGPNSYSA-N 1 3 329.488 2.523 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001398609045 1360668408 /nfs/dbraw/zinc/66/84/08/1360668408.db2.gz HEUNNHCQKBOEJB-KSZLIROESA-N 1 3 347.478 2.745 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001398609045 1360668411 /nfs/dbraw/zinc/66/84/11/1360668411.db2.gz HEUNNHCQKBOEJB-KSZLIROESA-N 1 3 347.478 2.745 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CCC[N@H+](CC2CCC2)C1)N1CCCCCC1 ZINC001398667994 1360698913 /nfs/dbraw/zinc/69/89/13/1360698913.db2.gz GRADDUSPNZCEMZ-PKOBYXMFSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CCC[N@@H+](CC2CCC2)C1)N1CCCCCC1 ZINC001398667994 1360698918 /nfs/dbraw/zinc/69/89/18/1360698918.db2.gz GRADDUSPNZCEMZ-PKOBYXMFSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2cc3ccccc3s2)C1 ZINC001398668655 1360700222 /nfs/dbraw/zinc/70/02/22/1360700222.db2.gz RLDJLHWYEAEIIY-IYBDPMFKSA-N 1 3 345.512 2.978 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(Cl)cc2)C1)N(C)C ZINC001398669881 1360701101 /nfs/dbraw/zinc/70/11/01/1360701101.db2.gz XOGBVCJTNFFUJW-VZEFYGNVSA-N 1 3 337.895 2.978 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c(C)c1 ZINC001398671477 1360701638 /nfs/dbraw/zinc/70/16/38/1360701638.db2.gz OBJRRWQJNLOWKL-WSTZPKSXSA-N 1 3 345.531 2.935 10 0 EFAEHO C[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC1CCCC1 ZINC001437206755 1387469685 /nfs/dbraw/zinc/46/96/85/1387469685.db2.gz MJWVUYDMFJNGCV-HNAYVOBHSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](CCCc2ccccc2)C1)N(C)C ZINC001398694572 1360723209 /nfs/dbraw/zinc/72/32/09/1360723209.db2.gz LBGFRYQRLCQPKB-WOJBJXKFSA-N 1 3 345.531 2.788 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](CCCc2ccccc2)C1)N(C)C ZINC001398694572 1360723214 /nfs/dbraw/zinc/72/32/14/1360723214.db2.gz LBGFRYQRLCQPKB-WOJBJXKFSA-N 1 3 345.531 2.788 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](Cc2ccc(C)cc2C)C1)N(C)C ZINC001398693843 1360723589 /nfs/dbraw/zinc/72/35/89/1360723589.db2.gz KHAMCJJLOVEDFG-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](Cc2ccc(C)cc2C)C1)N(C)C ZINC001398693843 1360723593 /nfs/dbraw/zinc/72/35/93/1360723593.db2.gz KHAMCJJLOVEDFG-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCCC[C@H]1CNCc1cc(C)ccc1F ZINC001398774080 1360779651 /nfs/dbraw/zinc/77/96/51/1360779651.db2.gz WWTNCIPOJSSBKU-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCCC[C@H]1CNCc1cc(C)ccc1F ZINC001398774080 1360779654 /nfs/dbraw/zinc/77/96/54/1360779654.db2.gz WWTNCIPOJSSBKU-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@H+](Cc2ccccc2F)C1 ZINC001398799249 1360801114 /nfs/dbraw/zinc/80/11/14/1360801114.db2.gz UMSOYZOPBCYVNN-IRXDYDNUSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](Cc2ccccc2F)C1 ZINC001398799249 1360801116 /nfs/dbraw/zinc/80/11/16/1360801116.db2.gz UMSOYZOPBCYVNN-IRXDYDNUSA-N 1 3 349.494 2.883 10 0 EFAEHO C[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]CCc1ccccc1F ZINC001437215393 1387475799 /nfs/dbraw/zinc/47/57/99/1387475799.db2.gz MUTGWIVZZDEFCR-SJORKVTESA-N 1 3 349.494 2.727 10 0 EFAEHO C[C@H](F)CC[NH2+]C1CCC(NC(=O)C(C)(C)N2CCCC2)CC1 ZINC001398833095 1360822008 /nfs/dbraw/zinc/82/20/08/1360822008.db2.gz QQEJHTDZNAOBHC-FHERZECASA-N 1 3 327.488 2.626 10 0 EFAEHO CC[C@@H](C(=O)NC1CCC([NH2+]Cc2cc(C)ccc2F)CC1)N(C)C ZINC001398839571 1360826499 /nfs/dbraw/zinc/82/64/99/1360826499.db2.gz KOMTYGMIAYJWJF-TVPLGVNVSA-N 1 3 349.494 2.991 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](C)[C@H](C)c1cccc(OC)c1 ZINC001492877753 1360860314 /nfs/dbraw/zinc/86/03/14/1360860314.db2.gz CUWGLYQXHRLYGL-VQIMIIECSA-N 1 3 347.503 2.679 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](C)[C@H](C)c1cccc(OC)c1 ZINC001492877753 1360860318 /nfs/dbraw/zinc/86/03/18/1360860318.db2.gz CUWGLYQXHRLYGL-VQIMIIECSA-N 1 3 347.503 2.679 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](C)[C@@H](C)c1cccc(OC)c1 ZINC001492877751 1360860359 /nfs/dbraw/zinc/86/03/59/1360860359.db2.gz CUWGLYQXHRLYGL-QFBILLFUSA-N 1 3 347.503 2.679 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](C)[C@@H](C)c1cccc(OC)c1 ZINC001492877751 1360860363 /nfs/dbraw/zinc/86/03/63/1360860363.db2.gz CUWGLYQXHRLYGL-QFBILLFUSA-N 1 3 347.503 2.679 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc(C)cc1C ZINC001398955579 1360893383 /nfs/dbraw/zinc/89/33/83/1360893383.db2.gz MMTXQZKRRXJLLP-HKUYNNGSSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H](C)[NH2+]Cc1ccc(C2CC2)cc1)N(C)C ZINC001399055820 1360962494 /nfs/dbraw/zinc/96/24/94/1360962494.db2.gz WPXQBRVPPKTESS-HNAYVOBHSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]Cc1ccccc1C(F)(F)F ZINC001399167860 1361044527 /nfs/dbraw/zinc/04/45/27/1361044527.db2.gz QDWGKUBQOMBBSN-ZDUSSCGKSA-N 1 3 345.409 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC001399180668 1361051356 /nfs/dbraw/zinc/05/13/56/1361051356.db2.gz YQKNSTMMFQJBGS-GFCCVEGCSA-N 1 3 346.302 2.928 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[C@@H]([NH2+]Cc2cc(C)ccc2F)C1 ZINC001399270863 1361112753 /nfs/dbraw/zinc/11/27/53/1361112753.db2.gz PXACIZBXSGAAHG-MSOLQXFVSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1cc(C)sc1C)N(C)C ZINC001399410924 1361204179 /nfs/dbraw/zinc/20/41/79/1361204179.db2.gz BZMWKYBXFOFDTA-BLLLJJGKSA-N 1 3 325.522 2.690 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]CCc1cccs1 ZINC001399429619 1361219226 /nfs/dbraw/zinc/21/92/26/1361219226.db2.gz JFTYQSXVXRUMFR-NVXWUHKLSA-N 1 3 337.533 2.649 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(C)cc1 ZINC001399436575 1361224180 /nfs/dbraw/zinc/22/41/80/1361224180.db2.gz UQMCALBZRMOWTN-MJGOQNOKSA-N 1 3 331.504 2.854 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@@H+]1C)Cc1ccc(C2CC2)cc1 ZINC001399507804 1361290219 /nfs/dbraw/zinc/29/02/19/1361290219.db2.gz XOSSECLDXPOZNV-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@H+]1C)Cc1ccc(C2CC2)cc1 ZINC001399507804 1361290221 /nfs/dbraw/zinc/29/02/21/1361290221.db2.gz XOSSECLDXPOZNV-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO CN(CCNC(=O)CC[NH+]1CCCCC1)Cc1ccc2cc[nH]c2c1 ZINC001399655695 1361408326 /nfs/dbraw/zinc/40/83/26/1361408326.db2.gz NACKMMNGZDLWSO-UHFFFAOYSA-N 1 3 342.487 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]CC[C@@H]1CCc2ccccc21 ZINC001437262329 1387514890 /nfs/dbraw/zinc/51/48/90/1387514890.db2.gz OCDHHLZJGGQEJT-WMZOPIPTSA-N 1 3 331.504 2.541 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@@H]2CCCN2Cc2ccc(CF)cc2)C1 ZINC001399859728 1361534515 /nfs/dbraw/zinc/53/45/15/1361534515.db2.gz CCIGQHRLLQSKIA-MOPGFXCFSA-N 1 3 347.478 2.579 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@@H]2CCCN2Cc2ccc(CF)cc2)C1 ZINC001399859728 1361534518 /nfs/dbraw/zinc/53/45/18/1361534518.db2.gz CCIGQHRLLQSKIA-MOPGFXCFSA-N 1 3 347.478 2.579 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@H+](CCCc2ccc(C)cc2)C1)N(C)C ZINC001399935450 1361591965 /nfs/dbraw/zinc/59/19/65/1361591965.db2.gz BUGXHRKGLGHXBN-WOJBJXKFSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@@H+](CCCc2ccc(C)cc2)C1)N(C)C ZINC001399935450 1361591966 /nfs/dbraw/zinc/59/19/66/1361591966.db2.gz BUGXHRKGLGHXBN-WOJBJXKFSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@H+](Cc1ccc2cc[nH]c2c1)C1CC1)N(C)C ZINC001400038801 1361689344 /nfs/dbraw/zinc/68/93/44/1361689344.db2.gz LLPHYZNLNNPOFB-IBGZPJMESA-N 1 3 342.487 2.589 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@@H+](Cc1ccc2cc[nH]c2c1)C1CC1)N(C)C ZINC001400038801 1361689349 /nfs/dbraw/zinc/68/93/49/1361689349.db2.gz LLPHYZNLNNPOFB-IBGZPJMESA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@H](NCCN(C)C(=O)C12CCC[NH+](CCC1)C2)c1ccccc1F ZINC001400052150 1361700296 /nfs/dbraw/zinc/70/02/96/1361700296.db2.gz MUHHYOYAIXDFMO-INIZCTEOSA-N 1 3 347.478 2.811 10 0 EFAEHO CC[C@H](C(=O)N1CCC([C@@H](C)[NH2+]CCC(C)(C)C)CC1)N(C)C ZINC001400085917 1361724882 /nfs/dbraw/zinc/72/48/82/1361724882.db2.gz IGUYNCZZKIKWSN-NVXWUHKLSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001400184240 1361824977 /nfs/dbraw/zinc/82/49/77/1361824977.db2.gz MXHTUPVLKZYIMR-PKOBYXMFSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001400184240 1361824981 /nfs/dbraw/zinc/82/49/81/1361824981.db2.gz MXHTUPVLKZYIMR-PKOBYXMFSA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2CC[N@H+](CCC3CCCC3)C2)C1 ZINC001400188539 1361829742 /nfs/dbraw/zinc/82/97/42/1361829742.db2.gz VVYJBMSJGAOJJR-MJGOQNOKSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2CC[N@@H+](CCC3CCCC3)C2)C1 ZINC001400188539 1361829744 /nfs/dbraw/zinc/82/97/44/1361829744.db2.gz VVYJBMSJGAOJJR-MJGOQNOKSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@H+](Cc2ccc(CF)cc2)C1 ZINC001400189396 1361831813 /nfs/dbraw/zinc/83/18/13/1361831813.db2.gz AQHPSKOPDCCJPP-IBGZPJMESA-N 1 3 349.494 2.825 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC001400189396 1361831816 /nfs/dbraw/zinc/83/18/16/1361831816.db2.gz AQHPSKOPDCCJPP-IBGZPJMESA-N 1 3 349.494 2.825 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+]1CC[C@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001400209517 1361845969 /nfs/dbraw/zinc/84/59/69/1361845969.db2.gz ZKSUEWIPROJMBZ-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+]1CC[C@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001400209517 1361845974 /nfs/dbraw/zinc/84/59/74/1361845974.db2.gz ZKSUEWIPROJMBZ-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@H](F)CC[N@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001400237247 1361872787 /nfs/dbraw/zinc/87/27/87/1361872787.db2.gz CSWFVOMBBMCHDH-KRWDZBQOSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001400237247 1361872792 /nfs/dbraw/zinc/87/27/92/1361872792.db2.gz CSWFVOMBBMCHDH-KRWDZBQOSA-N 1 3 341.515 2.637 10 0 EFAEHO CCCc1ccc(C[NH2+]C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001437320264 1387540182 /nfs/dbraw/zinc/54/01/82/1387540182.db2.gz AKJCMNBJYCNFJW-HXUWFJFHSA-N 1 3 345.531 2.917 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001400657937 1362074613 /nfs/dbraw/zinc/07/46/13/1362074613.db2.gz KAYNDQZIWGCCEW-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001400657937 1362074615 /nfs/dbraw/zinc/07/46/15/1362074615.db2.gz KAYNDQZIWGCCEW-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO CN(C(=O)CCC[NH+](C)C)[C@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001400703550 1362107909 /nfs/dbraw/zinc/10/79/09/1362107909.db2.gz FOLNXNXQHMJFJZ-FQEVSTJZSA-N 1 3 343.515 2.939 10 0 EFAEHO CCc1cccc(CN2CC[C@@H](N(CC)C(=O)CC[NH+](C)C)C2)c1 ZINC001400770761 1362155137 /nfs/dbraw/zinc/15/51/37/1362155137.db2.gz UDURLXRGCNCXJO-LJQANCHMSA-N 1 3 331.504 2.624 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1cccc(F)c1 ZINC001400797274 1362169666 /nfs/dbraw/zinc/16/96/66/1362169666.db2.gz HVIDYFCMZSBINN-MSOLQXFVSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001400930835 1362271794 /nfs/dbraw/zinc/27/17/94/1362271794.db2.gz YKAROSLWPZRAPX-CQSZACIVSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H]([N@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001437342876 1387565809 /nfs/dbraw/zinc/56/58/09/1387565809.db2.gz AZHFXBOJMOMIGQ-IAGOWNOFSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H]([N@@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001437342876 1387565811 /nfs/dbraw/zinc/56/58/11/1387565811.db2.gz AZHFXBOJMOMIGQ-IAGOWNOFSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC001401079278 1362422524 /nfs/dbraw/zinc/42/25/24/1362422524.db2.gz LEZVOPAZIICQJG-UHFFFAOYSA-N 1 3 349.494 2.884 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[NH2+]CC1CCC2(CC2)CC1 ZINC001401090474 1362433352 /nfs/dbraw/zinc/43/33/52/1362433352.db2.gz MCRZZFNMCNENQF-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(Cl)s1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001401247506 1362586095 /nfs/dbraw/zinc/58/60/95/1362586095.db2.gz PLOHSUVPLUYKCA-OLZOCXBDSA-N 1 3 343.924 2.680 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H](C)CNCc1ccccc1F)[NH+]1CCCC1 ZINC001401267316 1362608307 /nfs/dbraw/zinc/60/83/07/1362608307.db2.gz RXEJJZNBPSUKHT-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[NH2+]C[C@@H](CC(C)C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001401269308 1362610477 /nfs/dbraw/zinc/61/04/77/1362610477.db2.gz BQJOOAHONQCTAN-APWZRJJASA-N 1 3 343.531 2.975 10 0 EFAEHO CC(C)C[C@H](C[NH2+]Cc1cccc(F)c1)NC(=O)CN1CC[C@H](C)C1 ZINC001401269761 1362611672 /nfs/dbraw/zinc/61/16/72/1362611672.db2.gz CBEBIMXBAJOZDY-QFBILLFUSA-N 1 3 349.494 2.788 10 0 EFAEHO CC[C@H](F)C[N@H+](C)CCC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001401310060 1362658298 /nfs/dbraw/zinc/65/82/98/1362658298.db2.gz OQBFMTCKQVALJZ-ROUUACIJSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)CCC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001401310060 1362658303 /nfs/dbraw/zinc/65/83/03/1362658303.db2.gz OQBFMTCKQVALJZ-ROUUACIJSA-N 1 3 343.531 2.881 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(CF)cc1 ZINC001401345422 1362692980 /nfs/dbraw/zinc/69/29/80/1362692980.db2.gz VSHUAURFWYVOEW-QFBILLFUSA-N 1 3 349.494 2.728 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(CF)cc1 ZINC001401345423 1362693276 /nfs/dbraw/zinc/69/32/76/1362693276.db2.gz VSHUAURFWYVOEW-VQIMIIECSA-N 1 3 349.494 2.728 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@H+](C)CC2CCC3(CC3)CC2)CCC1 ZINC001401368284 1362718769 /nfs/dbraw/zinc/71/87/69/1362718769.db2.gz LIZJKTMLYUVJMS-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@@H+](C)CC2CCC3(CC3)CC2)CCC1 ZINC001401368284 1362718773 /nfs/dbraw/zinc/71/87/73/1362718773.db2.gz LIZJKTMLYUVJMS-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCN(C)Cc1ccc2cc[nH]c2c1)[NH+](C)C ZINC001401368269 1362719123 /nfs/dbraw/zinc/71/91/23/1362719123.db2.gz UZAGOZVFJXSJTN-IBGZPJMESA-N 1 3 344.503 2.644 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccc(Cl)cc1)C(C)C)N(C)C ZINC001401382497 1362735371 /nfs/dbraw/zinc/73/53/71/1362735371.db2.gz PYDYUUOUWTUZHJ-IAGOWNOFSA-N 1 3 339.911 2.911 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)CC1CCC(C)(C)CC1 ZINC001401438324 1362807172 /nfs/dbraw/zinc/80/71/72/1362807172.db2.gz KZQBVMBNHAJRRF-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)CC1CCC(C)(C)CC1 ZINC001401438324 1362807178 /nfs/dbraw/zinc/80/71/78/1362807178.db2.gz KZQBVMBNHAJRRF-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@H]21 ZINC001401509829 1362898374 /nfs/dbraw/zinc/89/83/74/1362898374.db2.gz XBSOJBQEQGNCGM-QZTJIDSGSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@H]21 ZINC001401509829 1362898379 /nfs/dbraw/zinc/89/83/79/1362898379.db2.gz XBSOJBQEQGNCGM-QZTJIDSGSA-N 1 3 337.552 2.933 10 0 EFAEHO CCN(CCN[C@@H](C)c1ccccc1F)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001401600220 1362962589 /nfs/dbraw/zinc/96/25/89/1362962589.db2.gz ZIONIPDSYNEKQY-HOTGVXAUSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCN[C@@H](C)c1ccccc1F)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001401600220 1362962594 /nfs/dbraw/zinc/96/25/94/1362962594.db2.gz ZIONIPDSYNEKQY-HOTGVXAUSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cc2ccccc2s1)NC(=O)CN(C)C1CCC1 ZINC001401686682 1363025924 /nfs/dbraw/zinc/02/59/24/1363025924.db2.gz QEGOXDAHJXPCOA-AWEZNQCLSA-N 1 3 345.512 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C[NH2+][C@@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001401703008 1363037518 /nfs/dbraw/zinc/03/75/18/1363037518.db2.gz QPNNJRMGDSNQND-VUCTXSBTSA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@H]1C(=O)N[C@@H](C)CNCc1ccccc1F ZINC001401704274 1363038570 /nfs/dbraw/zinc/03/85/70/1363038570.db2.gz FMGLDISFMVPMQI-YJBOKZPZSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@H]1C(=O)N[C@@H](C)CNCc1ccccc1F ZINC001401704274 1363038573 /nfs/dbraw/zinc/03/85/73/1363038573.db2.gz FMGLDISFMVPMQI-YJBOKZPZSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+][C@@H]1CCc2c1cccc2Cl ZINC001401724312 1363056209 /nfs/dbraw/zinc/05/62/09/1363056209.db2.gz PHTMRKOISIVBOY-SUMWQHHRSA-N 1 3 337.895 2.762 10 0 EFAEHO COc1cccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CCC[N@@H+]2C(C)C)c1 ZINC001401747947 1363080849 /nfs/dbraw/zinc/08/08/49/1363080849.db2.gz CZMLQHYBXITVLO-VQIMIIECSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CCC[N@H+]2C(C)C)c1 ZINC001401747947 1363080854 /nfs/dbraw/zinc/08/08/54/1363080854.db2.gz CZMLQHYBXITVLO-VQIMIIECSA-N 1 3 347.503 2.505 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(F)c1 ZINC001401752721 1363085690 /nfs/dbraw/zinc/08/56/90/1363085690.db2.gz HZWDICWIUPJRQR-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(F)c1 ZINC001401752721 1363085693 /nfs/dbraw/zinc/08/56/93/1363085693.db2.gz HZWDICWIUPJRQR-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](C[N@@H+](C)CC1CC(C)(C)C1)NC(=O)CN(C)CC(C)(C)C ZINC001401783645 1363124847 /nfs/dbraw/zinc/12/48/47/1363124847.db2.gz VQIRIPDYHOLDGP-OAHLLOKOSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@H](C[N@H+](C)CC1CC(C)(C)C1)NC(=O)CN(C)CC(C)(C)C ZINC001401783645 1363124846 /nfs/dbraw/zinc/12/48/46/1363124846.db2.gz VQIRIPDYHOLDGP-OAHLLOKOSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@@H](C[N@H+](C)[C@H]1CCc2ccccc21)NC(=O)CN(C)C1CCC1 ZINC001401787265 1363129221 /nfs/dbraw/zinc/12/92/21/1363129221.db2.gz VTSWGWHGNAEQMX-KXBFYZLASA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@@H](C[N@@H+](C)[C@H]1CCc2ccccc21)NC(=O)CN(C)C1CCC1 ZINC001401787265 1363129225 /nfs/dbraw/zinc/12/92/25/1363129225.db2.gz VTSWGWHGNAEQMX-KXBFYZLASA-N 1 3 329.488 2.595 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CN(C)Cc1ccccc1)[NH+]1CCCC1 ZINC001401830434 1363172514 /nfs/dbraw/zinc/17/25/14/1363172514.db2.gz SHWVQLWTLAGFCV-IEBWSBKVSA-N 1 3 331.504 2.744 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C[NH2+]Cc1cccc(F)c1)C1CC1 ZINC001401838795 1363178063 /nfs/dbraw/zinc/17/80/63/1363178063.db2.gz DDRAYKBHRNTLRB-MOPGFXCFSA-N 1 3 347.478 2.685 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C[NH2+]CC1CCCCC1)C1CC1 ZINC001401841522 1363180183 /nfs/dbraw/zinc/18/01/83/1363180183.db2.gz MDXKZWBMFDXSQY-OALUTQOASA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@@H](F)CCN1CC[C@H]1CNC(=O)CC[N@H+](C)C1CCCCC1 ZINC001401903115 1363228812 /nfs/dbraw/zinc/22/88/12/1363228812.db2.gz ZJJQQMDGDNJPKI-WBVHZDCISA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H](F)CCN1CC[C@H]1CNC(=O)CC[N@@H+](C)C1CCCCC1 ZINC001401903115 1363228815 /nfs/dbraw/zinc/22/88/15/1363228815.db2.gz ZJJQQMDGDNJPKI-WBVHZDCISA-N 1 3 327.488 2.580 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NC[C@@H]1CCN1[C@H]1CCc2ccccc21 ZINC001401927277 1363250520 /nfs/dbraw/zinc/25/05/20/1363250520.db2.gz QOOKVCANKDDOAR-ICSRJNTNSA-N 1 3 341.499 2.740 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCC1(NCc2ccc(CF)cc2)CC1 ZINC001401947289 1363267225 /nfs/dbraw/zinc/26/72/25/1363267225.db2.gz NMLCCABWFRBMOD-GOSISDBHSA-N 1 3 347.478 2.769 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCC1(NCc2ccc(CF)cc2)CC1 ZINC001401947289 1363267227 /nfs/dbraw/zinc/26/72/27/1363267227.db2.gz NMLCCABWFRBMOD-GOSISDBHSA-N 1 3 347.478 2.769 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1(N[C@H]2CCc3ccc(F)cc32)CC1)[NH+](C)C ZINC001401976503 1363293099 /nfs/dbraw/zinc/29/30/99/1363293099.db2.gz DWXNWPXCFZIBIE-ZWKOTPCHSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CC[N@@H+](CC[C@@H](C)F)C2)CC1 ZINC001401990986 1363308727 /nfs/dbraw/zinc/30/87/27/1363308727.db2.gz UQYAAHYLNVXGGB-SJLPKXTDSA-N 1 3 341.515 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CC[N@H+](CC[C@@H](C)F)C2)CC1 ZINC001401990986 1363308730 /nfs/dbraw/zinc/30/87/30/1363308730.db2.gz UQYAAHYLNVXGGB-SJLPKXTDSA-N 1 3 341.515 2.635 10 0 EFAEHO C[NH+](C)CCC(=O)NCCN(C/C=C\Cl)C1CCCCCC1 ZINC001401996922 1363314448 /nfs/dbraw/zinc/31/44/48/1363314448.db2.gz OXYCAEWKVWWIBM-XFFZJAGNSA-N 1 3 329.916 2.832 10 0 EFAEHO C[NH+](C)CCC(=O)NCCN(C/C=C/Cl)C1CCCCCC1 ZINC001401996925 1363315196 /nfs/dbraw/zinc/31/51/96/1363315196.db2.gz OXYCAEWKVWWIBM-YRNVUSSQSA-N 1 3 329.916 2.832 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CC=C(Cl)Cl)C[C@@H]1C ZINC001402048302 1363357897 /nfs/dbraw/zinc/35/78/97/1363357897.db2.gz FVTYVORUPXKIOE-QWHCGFSZSA-N 1 3 336.307 2.615 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@H]1CNCc1cccc(C(C)C)n1 ZINC001402070323 1363375331 /nfs/dbraw/zinc/37/53/31/1363375331.db2.gz HDPHHUWQNXGKCI-GOSISDBHSA-N 1 3 346.519 2.627 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@H]1CNCc1cccc(C(C)C)n1 ZINC001402070323 1363375332 /nfs/dbraw/zinc/37/53/32/1363375332.db2.gz HDPHHUWQNXGKCI-GOSISDBHSA-N 1 3 346.519 2.627 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C)CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001402089657 1363394774 /nfs/dbraw/zinc/39/47/74/1363394774.db2.gz ZEYOHFXPDCFSJV-FGTMMUONSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@]2(CC[N@H+](CC3CCC3)C2)C1 ZINC001402118771 1363424619 /nfs/dbraw/zinc/42/46/19/1363424619.db2.gz WKMQBVXOJGGJSE-FQEVSTJZSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@]2(CC[N@@H+](CC3CCC3)C2)C1 ZINC001402118771 1363424622 /nfs/dbraw/zinc/42/46/22/1363424622.db2.gz WKMQBVXOJGGJSE-FQEVSTJZSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N[C@@]2(C)CC[N@H+](CCC3CC3)C2)C1 ZINC001402133886 1363440817 /nfs/dbraw/zinc/44/08/17/1363440817.db2.gz NHSCFKSTNFMAKQ-OALUTQOASA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N[C@@]2(C)CC[N@@H+](CCC3CC3)C2)C1 ZINC001402133886 1363440820 /nfs/dbraw/zinc/44/08/20/1363440820.db2.gz NHSCFKSTNFMAKQ-OALUTQOASA-N 1 3 339.499 2.580 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H]1CC[N@H+](Cc2cc(C)ccc2C)C1 ZINC001402162685 1363470224 /nfs/dbraw/zinc/47/02/24/1363470224.db2.gz HQDIMZSIBBOAAQ-MOPGFXCFSA-N 1 3 349.494 2.674 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H]1CC[N@@H+](Cc2cc(C)ccc2C)C1 ZINC001402162685 1363470227 /nfs/dbraw/zinc/47/02/27/1363470227.db2.gz HQDIMZSIBBOAAQ-MOPGFXCFSA-N 1 3 349.494 2.674 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC12CC[NH+](Cc1csc(C)c1)CC2)N(C)C ZINC001402246936 1363566980 /nfs/dbraw/zinc/56/69/80/1363566980.db2.gz HPGHPPVENUVSOH-SJORKVTESA-N 1 3 349.544 2.867 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1cccc(C)c1)C1CC1 ZINC001402288753 1363587863 /nfs/dbraw/zinc/58/78/63/1363587863.db2.gz GQXYHLZLYHLPEX-PMACEKPBSA-N 1 3 343.515 2.854 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CCNC(=O)CN(C)C(C)C)c(Cl)c1 ZINC001437424150 1387633520 /nfs/dbraw/zinc/63/35/20/1387633520.db2.gz DBCDXRWJRBTNBV-OAHLLOKOSA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]([NH2+]CC1CCC2(CC2)CC1)C1CC1 ZINC001402378759 1363637457 /nfs/dbraw/zinc/63/74/57/1363637457.db2.gz RUBLLPCIFSIEQN-SFHVURJKSA-N 1 3 344.503 2.715 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)C1CC1 ZINC001402388193 1363646457 /nfs/dbraw/zinc/64/64/57/1363646457.db2.gz YUDRIZZKDDVTMT-YJBOKZPZSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](CNC(=O)[C@H]1CC[N@H+](C)C1)C1CC1 ZINC001402388193 1363646459 /nfs/dbraw/zinc/64/64/59/1363646459.db2.gz YUDRIZZKDDVTMT-YJBOKZPZSA-N 1 3 349.906 2.585 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([C@@H](C)[NH2+]Cc2ccc(CF)cc2)C1 ZINC001402395071 1363653459 /nfs/dbraw/zinc/65/34/59/1363653459.db2.gz AIHYCSVOKOXXDC-VQIMIIECSA-N 1 3 349.494 2.823 10 0 EFAEHO CC[NH2+][C@@H](CNC(=O)C(C)(C)N1CCCC1)c1ccccc1CC ZINC001402396967 1363655406 /nfs/dbraw/zinc/65/54/06/1363655406.db2.gz QIQWSLRFBKXWDV-SFHVURJKSA-N 1 3 331.504 2.890 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@H+](C)Cc2ccsc2)C1 ZINC001402400820 1363659822 /nfs/dbraw/zinc/65/98/22/1363659822.db2.gz GZEFHFMJMFYDNR-INIZCTEOSA-N 1 3 337.533 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@@H+](C)Cc2ccsc2)C1 ZINC001402400820 1363659826 /nfs/dbraw/zinc/65/98/26/1363659826.db2.gz GZEFHFMJMFYDNR-INIZCTEOSA-N 1 3 337.533 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([C@H](C)[NH2+]C/C=C\c2ccccc2)C1 ZINC001402407650 1363667295 /nfs/dbraw/zinc/66/72/95/1363667295.db2.gz KZWQNWBSTPJSKB-QQXWZLKESA-N 1 3 343.515 2.867 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2ccc(C)cc2)C1 ZINC001402411643 1363671302 /nfs/dbraw/zinc/67/13/02/1363671302.db2.gz DTCJNXGRBBWJRB-HKUYNNGSSA-N 1 3 331.504 2.521 10 0 EFAEHO CC[NH+]1CCC([C@H]2CCCN(C(=O)CN(C)CC(C)(C)C)C2)CC1 ZINC001402413227 1363673265 /nfs/dbraw/zinc/67/32/65/1363673265.db2.gz OXMDQXIEUKSDLK-SFHVURJKSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C(=O)N(Cc1ccccn1)C1CC[NH+](C(C)C)CC1)N(C)C ZINC001402416003 1363675392 /nfs/dbraw/zinc/67/53/92/1363675392.db2.gz RYEWHWIDSBNBPP-LJQANCHMSA-N 1 3 346.519 2.623 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+][C@@H](C)c2ccc(F)c(F)c2)C1 ZINC001402466435 1363712034 /nfs/dbraw/zinc/71/20/34/1363712034.db2.gz SJDSTYPALKWJQR-ZFWWWQNUSA-N 1 3 339.430 2.557 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccccc2C[N@H+](C)CC2CCC2)C1 ZINC001402483894 1363729071 /nfs/dbraw/zinc/72/90/71/1363729071.db2.gz ZVULHPANEFQIKO-KRWDZBQOSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccccc2C[N@@H+](C)CC2CCC2)C1 ZINC001402483894 1363729078 /nfs/dbraw/zinc/72/90/78/1363729078.db2.gz ZVULHPANEFQIKO-KRWDZBQOSA-N 1 3 343.515 2.877 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc(Cl)cc2F)C1 ZINC001402548522 1363779106 /nfs/dbraw/zinc/77/91/06/1363779106.db2.gz IRSJMWDSKXKJRL-SHTZXODSSA-N 1 3 341.858 2.556 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(CNC(=O)c2cccc(CN(C)C)c2)CCC1 ZINC001402574265 1363802461 /nfs/dbraw/zinc/80/24/61/1363802461.db2.gz FXFPVUQFAUKIFS-QGZVFWFLSA-N 1 3 335.467 2.738 10 0 EFAEHO C[C@@H](N[C@H]1C[C@@H](NC(=O)CCC[NH+](C)C)C1)c1ccccc1Cl ZINC001402601961 1363825915 /nfs/dbraw/zinc/82/59/15/1363825915.db2.gz BQLLVTUOTQKMAS-KFWWJZLASA-N 1 3 337.895 2.980 10 0 EFAEHO COc1cccc(C[N@@H+]2CCC[C@@H](NC(=O)CN(C)C(C)C)CC2)c1 ZINC001402621375 1363845699 /nfs/dbraw/zinc/84/56/99/1363845699.db2.gz PVECGWXUIZTKRW-GOSISDBHSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1cccc(C[N@H+]2CCC[C@@H](NC(=O)CN(C)C(C)C)CC2)c1 ZINC001402621375 1363845703 /nfs/dbraw/zinc/84/57/03/1363845703.db2.gz PVECGWXUIZTKRW-GOSISDBHSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001402626054 1363852058 /nfs/dbraw/zinc/85/20/58/1363852058.db2.gz HGNQYGDOPGELQK-LVQVYYBASA-N 1 3 345.478 2.635 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]C/C=C/c2ccc(Cl)cc2)C1 ZINC001402627570 1363854504 /nfs/dbraw/zinc/85/45/04/1363854504.db2.gz ISFGIAYEJCOVGA-OYIOLJDGSA-N 1 3 349.906 2.932 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC001402629828 1363857366 /nfs/dbraw/zinc/85/73/66/1363857366.db2.gz UAVMSCXUERVGGT-QGZVFWFLSA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(F)cc2)C1)N(C)C ZINC001402630110 1363858732 /nfs/dbraw/zinc/85/87/32/1363858732.db2.gz MBPLHTSNUAXHDB-VIBAHUMZSA-N 1 3 335.467 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc3ccccc32)C1 ZINC001402643727 1363876516 /nfs/dbraw/zinc/87/65/16/1363876516.db2.gz ONFANCUTQMOKHT-KDURUIRLSA-N 1 3 339.483 2.917 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc3c(c2)CCC3)C1 ZINC001402646667 1363880732 /nfs/dbraw/zinc/88/07/32/1363880732.db2.gz VXVBZQGBKQUBPO-YSGRDPCXSA-N 1 3 343.515 2.813 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CCC[N@H+](CCCC3CCC3)C2)C1 ZINC001402663084 1363906862 /nfs/dbraw/zinc/90/68/62/1363906862.db2.gz JWNZSCLWACOKFD-MJGOQNOKSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CCC[N@@H+](CCCC3CCC3)C2)C1 ZINC001402663084 1363906865 /nfs/dbraw/zinc/90/68/65/1363906865.db2.gz JWNZSCLWACOKFD-MJGOQNOKSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](Cc2ccccc2C)C1)N(C)C ZINC001402669394 1363916637 /nfs/dbraw/zinc/91/66/37/1363916637.db2.gz VFSUFTLWHKVQRS-IEBWSBKVSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](Cc2ccccc2C)C1)N(C)C ZINC001402669394 1363916643 /nfs/dbraw/zinc/91/66/43/1363916643.db2.gz VFSUFTLWHKVQRS-IEBWSBKVSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001402668999 1363917352 /nfs/dbraw/zinc/91/73/52/1363917352.db2.gz UJQZIRROLQOKEC-FUHWJXTLSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001402668999 1363917357 /nfs/dbraw/zinc/91/73/57/1363917357.db2.gz UJQZIRROLQOKEC-FUHWJXTLSA-N 1 3 335.536 2.735 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001402683044 1363932046 /nfs/dbraw/zinc/93/20/46/1363932046.db2.gz DATXKUYORVIWRP-QGZVFWFLSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1CCC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001402693591 1363942181 /nfs/dbraw/zinc/94/21/81/1363942181.db2.gz XJVFRBBMVLXMBB-MSOLQXFVSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1CCC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001402693591 1363942187 /nfs/dbraw/zinc/94/21/87/1363942187.db2.gz XJVFRBBMVLXMBB-MSOLQXFVSA-N 1 3 325.541 2.837 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001402712231 1363959137 /nfs/dbraw/zinc/95/91/37/1363959137.db2.gz FGDPHAKRPBKTGC-GOSISDBHSA-N 1 3 345.531 2.917 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001402713595 1363960133 /nfs/dbraw/zinc/96/01/33/1363960133.db2.gz GHQZNEFSYIOKHT-LJQANCHMSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001402719830 1363964796 /nfs/dbraw/zinc/96/47/96/1363964796.db2.gz OCRBLTXKQWUSOS-SFHVURJKSA-N 1 3 349.494 2.803 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@]2(CCN(C/C=C/Cl)C2)C1 ZINC001402718726 1363965026 /nfs/dbraw/zinc/96/50/26/1363965026.db2.gz PFNRISKQXIVYJE-QKYXPGDISA-N 1 3 341.927 2.785 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@]2(CCN(C/C=C/Cl)C2)C1 ZINC001402718726 1363965031 /nfs/dbraw/zinc/96/50/31/1363965031.db2.gz PFNRISKQXIVYJE-QKYXPGDISA-N 1 3 341.927 2.785 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NCc2ccc3c(c2)CN(CC2CCC2)C3)C1 ZINC001402751318 1363998783 /nfs/dbraw/zinc/99/87/83/1363998783.db2.gz VRDSFENEGACQGT-GOSISDBHSA-N 1 3 341.499 2.760 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NCc2ccc3c(c2)CN(CC2CCC2)C3)C1 ZINC001402751318 1363998787 /nfs/dbraw/zinc/99/87/87/1363998787.db2.gz VRDSFENEGACQGT-GOSISDBHSA-N 1 3 341.499 2.760 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](CCCC(C)C)C1 ZINC001402772833 1364021068 /nfs/dbraw/zinc/02/10/68/1364021068.db2.gz FGFYCHZPYJPCPY-DOTOQJQBSA-N 1 3 334.508 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](CCCC(C)C)C1 ZINC001402772833 1364021071 /nfs/dbraw/zinc/02/10/71/1364021071.db2.gz FGFYCHZPYJPCPY-DOTOQJQBSA-N 1 3 334.508 2.914 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]Cc2csc(C)c2)CC1 ZINC001402773586 1364021851 /nfs/dbraw/zinc/02/18/51/1364021851.db2.gz YJTSHMNGTLIAGB-UHFFFAOYSA-N 1 3 337.533 2.869 10 0 EFAEHO CCc1cccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001402777601 1364025828 /nfs/dbraw/zinc/02/58/28/1364025828.db2.gz XHSXSZNFAFVWNA-APWZRJJASA-N 1 3 331.504 2.526 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]Cc1ccsc1 ZINC001402843412 1364085743 /nfs/dbraw/zinc/08/57/43/1364085743.db2.gz ODWMBHGNBYWHAK-DOTOQJQBSA-N 1 3 337.533 2.995 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]CCc1ccccc1F ZINC001402861369 1364097810 /nfs/dbraw/zinc/09/78/10/1364097810.db2.gz LOOUCOQZOXSPQN-LPHOPBHVSA-N 1 3 349.494 2.727 10 0 EFAEHO C[C@H](F)CC[N@H+](C)C[C@@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001402911618 1364127854 /nfs/dbraw/zinc/12/78/54/1364127854.db2.gz AZFMRSHAIFXEEW-HOTGVXAUSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)C[C@@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001402911618 1364127855 /nfs/dbraw/zinc/12/78/55/1364127855.db2.gz AZFMRSHAIFXEEW-HOTGVXAUSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@H](F)CC[N@H+](C)C[C@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001402911630 1364127967 /nfs/dbraw/zinc/12/79/67/1364127967.db2.gz AZFMRSHAIFXEEW-JKSUJKDBSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)C[C@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001402911630 1364127971 /nfs/dbraw/zinc/12/79/71/1364127971.db2.gz AZFMRSHAIFXEEW-JKSUJKDBSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@@H]([NH2+]CC1CC(NC(=O)CN(C)C2CCC2)C1)c1ccccc1F ZINC001402930196 1364144089 /nfs/dbraw/zinc/14/40/89/1364144089.db2.gz XTWNOKPRDQCZFD-QQFBHYJXSA-N 1 3 347.478 2.855 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001402945466 1364152890 /nfs/dbraw/zinc/15/28/90/1364152890.db2.gz DQFJWZHFMPJQJK-UHFFFAOYSA-N 1 3 331.504 2.628 10 0 EFAEHO C[N@H+](CCCC1CCCC1)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001402948251 1364154898 /nfs/dbraw/zinc/15/48/98/1364154898.db2.gz VHXFXBXKCQDOHH-IBGZPJMESA-N 1 3 335.536 2.975 10 0 EFAEHO C[N@@H+](CCCC1CCCC1)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001402948251 1364154901 /nfs/dbraw/zinc/15/49/01/1364154901.db2.gz VHXFXBXKCQDOHH-IBGZPJMESA-N 1 3 335.536 2.975 10 0 EFAEHO Cc1cccc(C[NH2+]CC2CC(NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001402950937 1364157986 /nfs/dbraw/zinc/15/79/86/1364157986.db2.gz GVSONTYBEKXRGM-CTWPCTMYSA-N 1 3 331.504 2.566 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001403035754 1364239268 /nfs/dbraw/zinc/23/92/68/1364239268.db2.gz WMIJTSCXYWNLHC-SJORKVTESA-N 1 3 331.504 2.771 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001403035837 1364239470 /nfs/dbraw/zinc/23/94/70/1364239470.db2.gz WNVIDTSDNSYMSF-CVEARBPZSA-N 1 3 331.504 2.716 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C1CCC1 ZINC001403035872 1364239631 /nfs/dbraw/zinc/23/96/31/1364239631.db2.gz WNVIDTSDNSYMSF-HZPDHXFCSA-N 1 3 331.504 2.716 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)CNC(=O)[C@@H](C)N2CCCCCC2)cc1 ZINC001403040318 1364243882 /nfs/dbraw/zinc/24/38/82/1364243882.db2.gz BGYRHXBJQKUPAE-RBUKOAKNSA-N 1 3 345.531 2.896 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)CNC(=O)[C@@H]2CCCCN2C(C)C)cc1 ZINC001403050095 1364254492 /nfs/dbraw/zinc/25/44/92/1364254492.db2.gz OUKWXTSVYYXOQM-ICSRJNTNSA-N 1 3 345.531 2.895 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)CNC(=O)[C@@H]2CCCCN2C(C)C)cs1 ZINC001403051774 1364255828 /nfs/dbraw/zinc/25/58/28/1364255828.db2.gz PRBLDERVJVUPME-PBHICJAKSA-N 1 3 337.533 2.914 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)[C@H](C)NC(=O)CC[NH+](C)C ZINC001403066370 1364270473 /nfs/dbraw/zinc/27/04/73/1364270473.db2.gz WEMLYBHQBURBIJ-KGLIPLIRSA-N 1 3 325.884 2.583 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC(C)(C)C[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001403083584 1364286881 /nfs/dbraw/zinc/28/68/81/1364286881.db2.gz HOTNUUAHVPVMQE-FGTMMUONSA-N 1 3 337.552 2.837 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)CNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001403083893 1364287562 /nfs/dbraw/zinc/28/75/62/1364287562.db2.gz NXBZPXAPMZVGTN-GJZGRUSLSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)CNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001403083893 1364287569 /nfs/dbraw/zinc/28/75/69/1364287569.db2.gz NXBZPXAPMZVGTN-GJZGRUSLSA-N 1 3 337.895 2.585 10 0 EFAEHO COc1cccc(CN(C)[C@@H](C)CNC(=O)[C@@H]2CCC[N@@H+]2C(C)C)c1 ZINC001403111204 1364321567 /nfs/dbraw/zinc/32/15/67/1364321567.db2.gz DQCRBPRLAQCKRI-LPHOPBHVSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc(CN(C)[C@@H](C)CNC(=O)[C@@H]2CCC[N@H+]2C(C)C)c1 ZINC001403111204 1364321572 /nfs/dbraw/zinc/32/15/72/1364321572.db2.gz DQCRBPRLAQCKRI-LPHOPBHVSA-N 1 3 347.503 2.505 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[N@H+](C)Cc1ccc(C2CC2)cc1 ZINC001403133712 1364349715 /nfs/dbraw/zinc/34/97/15/1364349715.db2.gz HGAONMAPOIGKPT-INIZCTEOSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[N@@H+](C)Cc1ccc(C2CC2)cc1 ZINC001403133712 1364349719 /nfs/dbraw/zinc/34/97/19/1364349719.db2.gz HGAONMAPOIGKPT-INIZCTEOSA-N 1 3 343.515 2.985 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H]1CCN(C(=O)[C@@H](F)CN(CC)CC)C1 ZINC001403168648 1364388595 /nfs/dbraw/zinc/38/85/95/1364388595.db2.gz UZYZJDKCINYBAC-OALUTQOASA-N 1 3 349.494 2.619 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H](C)NCc1ccccc1F)[NH+]1CCCC1 ZINC001403170749 1364392417 /nfs/dbraw/zinc/39/24/17/1364392417.db2.gz UDLAFIACPWSWEK-CRAIPNDOSA-N 1 3 335.467 2.540 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)[C@@H](C)CNC(=O)CN(C)C(C)C)c1 ZINC001403230407 1364447082 /nfs/dbraw/zinc/44/70/82/1364447082.db2.gz PQPSZCIZQVIFTC-HOTGVXAUSA-N 1 3 335.492 2.533 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)[C@@H](C)CNC(=O)CN(C)C(C)C)c1 ZINC001403230407 1364447086 /nfs/dbraw/zinc/44/70/86/1364447086.db2.gz PQPSZCIZQVIFTC-HOTGVXAUSA-N 1 3 335.492 2.533 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]([NH2+]CCc2cccs2)C1 ZINC001403270918 1364482941 /nfs/dbraw/zinc/48/29/41/1364482941.db2.gz FISYLHAUYUWFQF-CVEARBPZSA-N 1 3 337.533 2.648 10 0 EFAEHO CC(C)CC[N@H+](C)[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001403345456 1364558359 /nfs/dbraw/zinc/55/83/59/1364558359.db2.gz WWZRSPKIYSAHNT-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)CC[N@@H+](C)[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001403345456 1364558360 /nfs/dbraw/zinc/55/83/60/1364558360.db2.gz WWZRSPKIYSAHNT-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1C[NH+](CC2CCC(F)(F)CC2)C1 ZINC001403355795 1364566659 /nfs/dbraw/zinc/56/66/59/1364566659.db2.gz SHHPVNBMZGWKKT-AWEZNQCLSA-N 1 3 345.478 2.589 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@@]2(C)CN(C[C@@H](F)CC)C[C@@]2(C)C1 ZINC001403396209 1364600371 /nfs/dbraw/zinc/60/03/71/1364600371.db2.gz CEGZHUFZVCHFNU-YTQUADARSA-N 1 3 341.515 2.637 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@@]2(C)CN(C[C@@H](F)CC)C[C@@]2(C)C1 ZINC001403396209 1364600374 /nfs/dbraw/zinc/60/03/74/1364600374.db2.gz CEGZHUFZVCHFNU-YTQUADARSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@]2(C)CN(C(=O)CN(C)C(C)C)C[C@@]2(C)C1 ZINC001403402592 1364607035 /nfs/dbraw/zinc/60/70/35/1364607035.db2.gz LWAGYLTUTYVIDX-BGYRXZFFSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@]2(C)CN(C(=O)CN(C)C(C)C)C[C@@]2(C)C1 ZINC001403402592 1364607039 /nfs/dbraw/zinc/60/70/39/1364607039.db2.gz LWAGYLTUTYVIDX-BGYRXZFFSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H]2CCc3c2cccc3F)C1)N(C)C ZINC001403415892 1364620398 /nfs/dbraw/zinc/62/03/98/1364620398.db2.gz BBKQOHYBJXFEBG-KODHJQJWSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@H]([NH2+]C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)C1)c1ccccc1F ZINC001403420499 1364625433 /nfs/dbraw/zinc/62/54/33/1364625433.db2.gz SOHAUFRKRIZOFG-JYJNAYRXSA-N 1 3 347.478 2.855 10 0 EFAEHO Cc1cccc([C@@H](C)[N@H+]2C[C@@H]3[C@@H](CNC(=O)CN(C)C(C)C)[C@@H]3C2)c1 ZINC001403428295 1364632683 /nfs/dbraw/zinc/63/26/83/1364632683.db2.gz VYFGLIPWEDCWOX-AFYVEPGGSA-N 1 3 343.515 2.690 10 0 EFAEHO Cc1cccc([C@@H](C)[N@@H+]2C[C@@H]3[C@@H](CNC(=O)CN(C)C(C)C)[C@@H]3C2)c1 ZINC001403428295 1364632688 /nfs/dbraw/zinc/63/26/88/1364632688.db2.gz VYFGLIPWEDCWOX-AFYVEPGGSA-N 1 3 343.515 2.690 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2c(C)cccc2C)C1)N(C)C ZINC001403437118 1364640245 /nfs/dbraw/zinc/64/02/45/1364640245.db2.gz DQWZMOBQXBJDCF-LNLFQRSKSA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)c1cccc(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@H](C)C2)n1 ZINC001403442039 1364644735 /nfs/dbraw/zinc/64/47/35/1364644735.db2.gz GFXBFRNPFGGVOX-DLBZAZTESA-N 1 3 346.519 2.531 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1ccsc1 ZINC001403446234 1364648180 /nfs/dbraw/zinc/64/81/80/1364648180.db2.gz ODWMBHGNBYWHAK-NVXWUHKLSA-N 1 3 337.533 2.995 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]CCc1ccccc1 ZINC001403448386 1364650819 /nfs/dbraw/zinc/65/08/19/1364650819.db2.gz SXCLNMCHRBOEOY-UYAOXDASSA-N 1 3 345.531 2.976 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(C)nc1C ZINC001403487111 1364694586 /nfs/dbraw/zinc/69/45/86/1364694586.db2.gz MRXKZYXQVKQASN-DNVCBOLYSA-N 1 3 346.519 2.557 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]Cc1ccc(C)nc1C ZINC001403487122 1364695158 /nfs/dbraw/zinc/69/51/58/1364695158.db2.gz MRXKZYXQVKQASN-KXBFYZLASA-N 1 3 346.519 2.557 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)[C@@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001403504121 1364710377 /nfs/dbraw/zinc/71/03/77/1364710377.db2.gz CPUIOIWNUBZLKE-UXHICEINSA-N 1 3 343.515 2.888 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C[NH2+]Cc1ccc(F)cc1C)C1CC1)N(C)C ZINC001403533529 1364737300 /nfs/dbraw/zinc/73/73/00/1364737300.db2.gz RXPQYUFEDQHATM-MOPGFXCFSA-N 1 3 349.494 2.801 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C[C@H](C)[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001403554409 1364756786 /nfs/dbraw/zinc/75/67/86/1364756786.db2.gz HQMZFNBIOCLPJG-WMZOPIPTSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@H](CN(C)C(=O)CN(C)C1CCC1)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001403561217 1364763371 /nfs/dbraw/zinc/76/33/71/1364763371.db2.gz VCJFJGPKRWZXDL-OAHLLOKOSA-N 1 3 342.487 2.589 10 0 EFAEHO CN(CCNC(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21)Cc1ccc(CF)cc1 ZINC001403583813 1364785547 /nfs/dbraw/zinc/78/55/47/1364785547.db2.gz DNKOXNPUMJQJLS-MOPGFXCFSA-N 1 3 347.478 2.721 10 0 EFAEHO CN(CCNC(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21)Cc1ccc(CF)cc1 ZINC001403583813 1364785552 /nfs/dbraw/zinc/78/55/52/1364785552.db2.gz DNKOXNPUMJQJLS-MOPGFXCFSA-N 1 3 347.478 2.721 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)cc1 ZINC001403591764 1364794502 /nfs/dbraw/zinc/79/45/02/1364794502.db2.gz PPPYKMMAAZHCSR-OALUTQOASA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)cc1 ZINC001403591764 1364794503 /nfs/dbraw/zinc/79/45/03/1364794503.db2.gz PPPYKMMAAZHCSR-OALUTQOASA-N 1 3 329.488 2.560 10 0 EFAEHO CCCc1ccc(C[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001403596007 1364800094 /nfs/dbraw/zinc/80/00/94/1364800094.db2.gz ICDMNDXLLMWQSR-ZWKOTPCHSA-N 1 3 345.531 2.917 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1cccc(F)c1 ZINC001403622237 1364824407 /nfs/dbraw/zinc/82/44/07/1364824407.db2.gz LHJIMXJWGWVLMC-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc3cc[nH]c3c2)[C@H]1C ZINC001403752669 1364902419 /nfs/dbraw/zinc/90/24/19/1364902419.db2.gz PGZBIZQFSUMYIS-CRAIPNDOSA-N 1 3 342.487 2.587 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@@H+](C)CCNC(=O)[C@H](C(C)C)N(C)C)c1 ZINC001403752987 1364902762 /nfs/dbraw/zinc/90/27/62/1364902762.db2.gz SPHUECBNAZPKLC-MJGOQNOKSA-N 1 3 333.520 2.999 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@H+](C)CCNC(=O)[C@H](C(C)C)N(C)C)c1 ZINC001403752987 1364902765 /nfs/dbraw/zinc/90/27/65/1364902765.db2.gz SPHUECBNAZPKLC-MJGOQNOKSA-N 1 3 333.520 2.999 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@]12CCC[C@H]1N(Cc1cccc(F)c1)CC2 ZINC001403778144 1364928602 /nfs/dbraw/zinc/92/86/02/1364928602.db2.gz RBPHNJKRSQWFRB-UYAOXDASSA-N 1 3 347.478 2.781 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@]12CCC[C@H]1N(Cc1cccc(F)c1)CC2 ZINC001403778144 1364928606 /nfs/dbraw/zinc/92/86/06/1364928606.db2.gz RBPHNJKRSQWFRB-UYAOXDASSA-N 1 3 347.478 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CC(CC)CC)[C@@H]2C1 ZINC001403795007 1364947559 /nfs/dbraw/zinc/94/75/59/1364947559.db2.gz VPSDKGVCGIZFCL-IPMKNSEASA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H]1[C@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc(CF)cc1 ZINC001403807933 1364961730 /nfs/dbraw/zinc/96/17/30/1364961730.db2.gz VJWSAHLNFLADHJ-MAUKXSAKSA-N 1 3 335.467 2.577 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@@H]1CC[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001403830602 1364983259 /nfs/dbraw/zinc/98/32/59/1364983259.db2.gz ZXAGZTZKSVFNPL-XLIONFOSSA-N 1 3 345.531 2.964 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+][C@H](C)c2ccccc2)C(C)(C)C1 ZINC001403834911 1364985723 /nfs/dbraw/zinc/98/57/23/1364985723.db2.gz NBPJAECPTBHCMZ-AEFFLSMTSA-N 1 3 331.504 2.914 10 0 EFAEHO CCN(CCNC(=O)CC[NH+](C)C)Cc1ccc(C(C)(C)C)cc1 ZINC001403912960 1365036393 /nfs/dbraw/zinc/03/63/93/1365036393.db2.gz YDGHAVKQXHXXQW-UHFFFAOYSA-N 1 3 333.520 2.874 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C[NH2+]Cc1ccc(C)nc1C)C(C)(C)C)N(C)C ZINC001403975337 1365122360 /nfs/dbraw/zinc/12/23/60/1365122360.db2.gz YVFFHFHKEKWZAZ-ROUUACIJSA-N 1 3 348.535 2.659 10 0 EFAEHO CC(C)CCC[N@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001437517503 1387720802 /nfs/dbraw/zinc/72/08/02/1387720802.db2.gz PBYMUOGWQZPUOX-GOSISDBHSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)CCC[N@@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001437517503 1387720809 /nfs/dbraw/zinc/72/08/09/1387720809.db2.gz PBYMUOGWQZPUOX-GOSISDBHSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@H](F)CN1CCC([C@H](C)NC(=O)[C@@H](C(C)C)[NH+](C)C)CC1 ZINC001403993546 1365144319 /nfs/dbraw/zinc/14/43/19/1365144319.db2.gz GIUDRQFDPAPCAE-BHYGNILZSA-N 1 3 329.504 2.537 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCCN1Cc1ccccc1)[NH+]1CCCC1 ZINC001404009000 1365163252 /nfs/dbraw/zinc/16/32/52/1365163252.db2.gz WSLRTHJBAIVAIQ-GOSISDBHSA-N 1 3 329.488 2.642 10 0 EFAEHO CN(C(=O)CC[C@H]1CCC[N@@H+]1C)C1CC(NCC=C(Cl)Cl)C1 ZINC001404021412 1365177057 /nfs/dbraw/zinc/17/70/57/1365177057.db2.gz KGHMHXMTLNVLKC-ROKHWSDSSA-N 1 3 348.318 2.759 10 0 EFAEHO CN(C(=O)CC[C@H]1CCC[N@H+]1C)C1CC(NCC=C(Cl)Cl)C1 ZINC001404021412 1365177058 /nfs/dbraw/zinc/17/70/58/1365177058.db2.gz KGHMHXMTLNVLKC-ROKHWSDSSA-N 1 3 348.318 2.759 10 0 EFAEHO CN(C(=O)CC[C@@H]1CCC[N@@H+]1C)C1CC(NCC=C(Cl)Cl)C1 ZINC001404021406 1365177205 /nfs/dbraw/zinc/17/72/05/1365177205.db2.gz KGHMHXMTLNVLKC-MOKVOYLWSA-N 1 3 348.318 2.759 10 0 EFAEHO CN(C(=O)CC[C@@H]1CCC[N@H+]1C)C1CC(NCC=C(Cl)Cl)C1 ZINC001404021406 1365177209 /nfs/dbraw/zinc/17/72/09/1365177209.db2.gz KGHMHXMTLNVLKC-MOKVOYLWSA-N 1 3 348.318 2.759 10 0 EFAEHO Cc1cc(CN2CCC[C@H]2CNC(=O)C[C@H]2CC[N@@H+](C)C2)c(C)s1 ZINC001404021170 1365177638 /nfs/dbraw/zinc/17/76/38/1365177638.db2.gz MTHDYLARBPCXHO-AEFFLSMTSA-N 1 3 349.544 2.787 10 0 EFAEHO Cc1cc(CN2CCC[C@H]2CNC(=O)C[C@H]2CC[N@H+](C)C2)c(C)s1 ZINC001404021170 1365177640 /nfs/dbraw/zinc/17/76/40/1365177640.db2.gz MTHDYLARBPCXHO-AEFFLSMTSA-N 1 3 349.544 2.787 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@H+](CC2CC(C)(C)C2)C1)CC(C)(C)C ZINC001404069532 1365228801 /nfs/dbraw/zinc/22/88/01/1365228801.db2.gz AVHDKIFKIMWXFI-MRXNPFEDSA-N 1 3 337.552 2.839 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@@H+](CC2CC(C)(C)C2)C1)CC(C)(C)C ZINC001404069532 1365228807 /nfs/dbraw/zinc/22/88/07/1365228807.db2.gz AVHDKIFKIMWXFI-MRXNPFEDSA-N 1 3 337.552 2.839 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001404087785 1365247569 /nfs/dbraw/zinc/24/75/69/1365247569.db2.gz OSTDBBNGRSVYCI-MOPGFXCFSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[N@@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001404087785 1365247573 /nfs/dbraw/zinc/24/75/73/1365247573.db2.gz OSTDBBNGRSVYCI-MOPGFXCFSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001404097909 1365258147 /nfs/dbraw/zinc/25/81/47/1365258147.db2.gz SEUZVYCGBKNJFK-APWZRJJASA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001404097909 1365258153 /nfs/dbraw/zinc/25/81/53/1365258153.db2.gz SEUZVYCGBKNJFK-APWZRJJASA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)CC[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001404269400 1365416783 /nfs/dbraw/zinc/41/67/83/1365416783.db2.gz KKEZEJBZVDEJGV-LJQANCHMSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CC[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001404269400 1365416784 /nfs/dbraw/zinc/41/67/84/1365416784.db2.gz KKEZEJBZVDEJGV-LJQANCHMSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@H+](CC2CCC(C)CC2)C2CC2)C1 ZINC001404272185 1365418789 /nfs/dbraw/zinc/41/87/89/1365418789.db2.gz QRLAJFBABIAZOR-ADKAHSJRSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@@H+](CC2CCC(C)CC2)C2CC2)C1 ZINC001404272185 1365418793 /nfs/dbraw/zinc/41/87/93/1365418793.db2.gz QRLAJFBABIAZOR-ADKAHSJRSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC001404290196 1365432240 /nfs/dbraw/zinc/43/22/40/1365432240.db2.gz DOQZQDDQWJASAB-IBGZPJMESA-N 1 3 329.488 2.595 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC001404290196 1365432241 /nfs/dbraw/zinc/43/22/41/1365432241.db2.gz DOQZQDDQWJASAB-IBGZPJMESA-N 1 3 329.488 2.595 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](Cc1ccc2cc[nH]c2c1)C1CC1 ZINC001404294344 1365434961 /nfs/dbraw/zinc/43/49/61/1365434961.db2.gz OMVCSOVQZBFOBA-UHFFFAOYSA-N 1 3 342.487 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](Cc1ccc2cc[nH]c2c1)C1CC1 ZINC001404294344 1365434965 /nfs/dbraw/zinc/43/49/65/1365434965.db2.gz OMVCSOVQZBFOBA-UHFFFAOYSA-N 1 3 342.487 2.589 10 0 EFAEHO Cc1ccccc1CN(CCNC(=O)C[NH+]1[C@@H](C)CC[C@@H]1C)C1CC1 ZINC001404297024 1365435927 /nfs/dbraw/zinc/43/59/27/1365435927.db2.gz MDNFLUBYXLMPNY-ROUUACIJSA-N 1 3 343.515 2.948 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@H](C[N@H+](C)CCC(C)(C)C)C2)CC1 ZINC001404609704 1365711054 /nfs/dbraw/zinc/71/10/54/1365711054.db2.gz JBQZCRPNOVNMQI-SFHVURJKSA-N 1 3 337.552 2.935 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@H](C[N@@H+](C)CCC(C)(C)C)C2)CC1 ZINC001404609704 1365711058 /nfs/dbraw/zinc/71/10/58/1365711058.db2.gz JBQZCRPNOVNMQI-SFHVURJKSA-N 1 3 337.552 2.935 10 0 EFAEHO Cc1ccc(C)c(CN2CC(CNC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001404893799 1365886692 /nfs/dbraw/zinc/88/66/92/1365886692.db2.gz RRGBBYPRAGNEMD-HXUWFJFHSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(C)c(CN2CC(CNC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001404893799 1365886696 /nfs/dbraw/zinc/88/66/96/1365886696.db2.gz RRGBBYPRAGNEMD-HXUWFJFHSA-N 1 3 343.515 2.726 10 0 EFAEHO CC(C)c1ccccc1C[NH+]1CC(CNC(=O)CN(C)C(C)C)C1 ZINC001404950916 1365929835 /nfs/dbraw/zinc/92/98/35/1365929835.db2.gz SQCQSZFGHYPFTA-UHFFFAOYSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001405000421 1365962024 /nfs/dbraw/zinc/96/20/24/1365962024.db2.gz YKWSZRQJZCGZPQ-JYJNAYRXSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001405000421 1365962026 /nfs/dbraw/zinc/96/20/26/1365962026.db2.gz YKWSZRQJZCGZPQ-JYJNAYRXSA-N 1 3 345.478 2.589 10 0 EFAEHO CCc1ccc(CN2CC[C@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)cc1 ZINC001405001633 1365962391 /nfs/dbraw/zinc/96/23/91/1365962391.db2.gz WMYLSDBHHZLYKK-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccc(CN2CC[C@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)cc1 ZINC001405001633 1365962394 /nfs/dbraw/zinc/96/23/94/1365962394.db2.gz WMYLSDBHHZLYKK-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H](C(C)C)[NH+]2CCCC2)cc1 ZINC001437568651 1387778061 /nfs/dbraw/zinc/77/80/61/1387778061.db2.gz CBTDARCPDFRBOX-LJQANCHMSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc(C)cc1 ZINC001405281906 1366131924 /nfs/dbraw/zinc/13/19/24/1366131924.db2.gz WSGOCYGVVCBQLL-GOSISDBHSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@@H](CNC(=O)C1CC[NH+](C)CC1)NCc1cccc(C(C)C)n1 ZINC001405289473 1366134564 /nfs/dbraw/zinc/13/45/64/1366134564.db2.gz LFEQTYVEWCILMD-KRWDZBQOSA-N 1 3 346.519 2.531 10 0 EFAEHO CC[C@H](CNC(=O)C1CC[NH+](C)CC1)NCc1cccc(C(C)C)n1 ZINC001405289479 1366134654 /nfs/dbraw/zinc/13/46/54/1366134654.db2.gz LFEQTYVEWCILMD-QGZVFWFLSA-N 1 3 346.519 2.531 10 0 EFAEHO CCCN(C)CC(=O)NC1(C[NH2+]CC2CC3(CCC3)C2)CCCC1 ZINC001405426002 1366192524 /nfs/dbraw/zinc/19/25/24/1366192524.db2.gz URCNZYODKOAHSE-UHFFFAOYSA-N 1 3 335.536 2.927 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1CC[C@H]([NH2+]C/C=C\Cl)CC1 ZINC001405518174 1366262773 /nfs/dbraw/zinc/26/27/73/1366262773.db2.gz AEUNYEHIXSAYBD-SJZMBVODSA-N 1 3 327.900 2.629 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001405582894 1366306591 /nfs/dbraw/zinc/30/65/91/1366306591.db2.gz REYHDOUFNBWFDP-UHFFFAOYSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCCC1)C[NH2+]Cc1ccsc1 ZINC001405678160 1366331739 /nfs/dbraw/zinc/33/17/39/1366331739.db2.gz PKQYVXZAFHLJBX-OAHLLOKOSA-N 1 3 337.533 2.855 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+][C@@H]1CCCc2ccccc21 ZINC001405724882 1366366102 /nfs/dbraw/zinc/36/61/02/1366366102.db2.gz XTAKSFHRQPAOAC-QFBILLFUSA-N 1 3 331.504 2.746 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]C[C@H](C)N(C)C(=O)[C@@H]2CCCN2C)cc1 ZINC001405802938 1366426436 /nfs/dbraw/zinc/42/64/36/1366426436.db2.gz ZRIAQKKICDNKHG-PXNSSMCTSA-N 1 3 345.531 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CC2CC3(CCC3)C2)[C@@H](C)C1 ZINC001405967875 1367022454 /nfs/dbraw/zinc/02/24/54/1367022454.db2.gz KJKZPLBSVKGRIS-WMZOPIPTSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](C)C[N@H+](C)CCC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001406002562 1367077804 /nfs/dbraw/zinc/07/78/04/1367077804.db2.gz LOLBVEBPKHYRKS-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)CCC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001406002562 1367077809 /nfs/dbraw/zinc/07/78/09/1367077809.db2.gz LOLBVEBPKHYRKS-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)c(C)c1 ZINC001405990642 1367061997 /nfs/dbraw/zinc/06/19/97/1367061997.db2.gz ZWMUUDWEKNSGST-QUCCMNQESA-N 1 3 345.531 2.970 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1ccc(C)c(F)c1)C(C)C)N(C)C ZINC001406061608 1367163308 /nfs/dbraw/zinc/16/33/08/1367163308.db2.gz HTMXOOVIQFNETG-ZWKOTPCHSA-N 1 3 337.483 2.705 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)CCN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001406103133 1367230097 /nfs/dbraw/zinc/23/00/97/1367230097.db2.gz HNAGBGHUWQTJSA-MRXNPFEDSA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)CCN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001406103133 1367230099 /nfs/dbraw/zinc/23/00/99/1367230099.db2.gz HNAGBGHUWQTJSA-MRXNPFEDSA-N 1 3 347.503 2.631 10 0 EFAEHO CN(CCN(C)C(=O)C1(C[NH+](C)C)CC1)Cc1ccc(C2CC2)cc1 ZINC001406120309 1367264288 /nfs/dbraw/zinc/26/42/88/1367264288.db2.gz DAFGHVNZWNLWLY-UHFFFAOYSA-N 1 3 343.515 2.796 10 0 EFAEHO CN(CCc1ccccc1F)CCN(C)C(=O)C(C)(C)[NH+]1CCCC1 ZINC001406120319 1367264651 /nfs/dbraw/zinc/26/46/51/1367264651.db2.gz FFIJPBRBFCSIBE-UHFFFAOYSA-N 1 3 349.494 2.633 10 0 EFAEHO C[C@H](C[NH2+]C[C@H]1CCCC(F)(F)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001406374228 1367532737 /nfs/dbraw/zinc/53/27/37/1367532737.db2.gz CEMLNCPWTVAKTJ-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1cccc(F)c1 ZINC001406413956 1367562260 /nfs/dbraw/zinc/56/22/60/1367562260.db2.gz UZXJYVICWVLIGD-QAPCUYQASA-N 1 3 335.467 2.683 10 0 EFAEHO Cc1cncc(CNC[C@H](C)NC(=O)C(C)(C)[N@H+](C)C2CCCC2)c1 ZINC001406486806 1367639417 /nfs/dbraw/zinc/63/94/17/1367639417.db2.gz GCOYVYMHBBGNCN-INIZCTEOSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1cncc(CNC[C@H](C)NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)c1 ZINC001406486806 1367639423 /nfs/dbraw/zinc/63/94/23/1367639423.db2.gz GCOYVYMHBBGNCN-INIZCTEOSA-N 1 3 346.519 2.637 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cccc(C(F)F)c1)NC(=O)CN1CC[C@@H](C)C1 ZINC001406522339 1367680573 /nfs/dbraw/zinc/68/05/73/1367680573.db2.gz OSZMLJVNXISEDA-KGLIPLIRSA-N 1 3 339.430 2.560 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc2cc[nH]c2c1)NC(=O)CN(C)CC(C)(C)C ZINC001406529619 1367690219 /nfs/dbraw/zinc/69/02/19/1367690219.db2.gz OHUOXUCEGJMUDL-HNNXBMFYSA-N 1 3 344.503 2.740 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001406552583 1367717594 /nfs/dbraw/zinc/71/75/94/1367717594.db2.gz AJGWPAVANZDIBT-KXBFYZLASA-N 1 3 342.487 2.637 10 0 EFAEHO CCc1cccc(CN(C)C[C@H](C)NC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)c1 ZINC001406594928 1367772780 /nfs/dbraw/zinc/77/27/80/1367772780.db2.gz BVFYIORDQGCPAB-FFZOFVMBSA-N 1 3 345.531 2.916 10 0 EFAEHO CCc1cccc(CN(C)C[C@H](C)NC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)c1 ZINC001406594928 1367772788 /nfs/dbraw/zinc/77/27/88/1367772788.db2.gz BVFYIORDQGCPAB-FFZOFVMBSA-N 1 3 345.531 2.916 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)cc1F ZINC001406641658 1367848863 /nfs/dbraw/zinc/84/88/63/1367848863.db2.gz YHBFKTKQSZQWMM-FUHWJXTLSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)cc1F ZINC001406641658 1367848866 /nfs/dbraw/zinc/84/88/66/1367848866.db2.gz YHBFKTKQSZQWMM-FUHWJXTLSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C2CCC2)cc1)NC(=O)CC[NH+](C)C ZINC001406654641 1367872302 /nfs/dbraw/zinc/87/23/02/1367872302.db2.gz NATSYHWCECABIB-INIZCTEOSA-N 1 3 331.504 2.842 10 0 EFAEHO CC(C)Cc1ccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CC[N@H+](C)C2)cc1 ZINC001406697297 1367938949 /nfs/dbraw/zinc/93/89/49/1367938949.db2.gz HINUPZZMVDMYOZ-XLIONFOSSA-N 1 3 345.531 2.773 10 0 EFAEHO CC(C)Cc1ccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CC[N@@H+](C)C2)cc1 ZINC001406697297 1367938951 /nfs/dbraw/zinc/93/89/51/1367938951.db2.gz HINUPZZMVDMYOZ-XLIONFOSSA-N 1 3 345.531 2.773 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001406699293 1367944503 /nfs/dbraw/zinc/94/45/03/1367944503.db2.gz RNRMROPNJMFYHC-GXTWGEPZSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001406699293 1367944514 /nfs/dbraw/zinc/94/45/14/1367944514.db2.gz RNRMROPNJMFYHC-GXTWGEPZSA-N 1 3 342.434 2.523 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)[C@H]1CCc2c1cccc2F ZINC001406726648 1367973372 /nfs/dbraw/zinc/97/33/72/1367973372.db2.gz RBSPMJIRQNRCRM-KSSFIOAISA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)[C@H]1CCc2c1cccc2F ZINC001406726648 1367973380 /nfs/dbraw/zinc/97/33/80/1367973380.db2.gz RBSPMJIRQNRCRM-KSSFIOAISA-N 1 3 335.467 2.590 10 0 EFAEHO C[C@H](C(=O)N[C@@H](C[NH2+]Cc1ccsc1)C1CC1)N1CCCCCC1 ZINC001406793702 1368060957 /nfs/dbraw/zinc/06/09/57/1368060957.db2.gz UGAMAKRTJJQNBP-QAPCUYQASA-N 1 3 349.544 2.997 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCN1CCC1CCCC1)[NH+]1CCCC1 ZINC001406889094 1368173333 /nfs/dbraw/zinc/17/33/33/1368173333.db2.gz CTPINYVPLLCMRB-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)NCC1(NC/C=C\Cl)CC1 ZINC001406940329 1368231583 /nfs/dbraw/zinc/23/15/83/1368231583.db2.gz MWEMMWQBDYDPBS-WDZFZDKYSA-N 1 3 327.900 2.630 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)NCC1(NC/C=C\Cl)CC1 ZINC001406940329 1368231587 /nfs/dbraw/zinc/23/15/87/1368231587.db2.gz MWEMMWQBDYDPBS-WDZFZDKYSA-N 1 3 327.900 2.630 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(NCc3ccc(Cl)cc3)CC2)CC[N@@H+]1C ZINC001406957471 1368247313 /nfs/dbraw/zinc/24/73/13/1368247313.db2.gz LKNJPYIXDOTLRP-HOCLYGCPSA-N 1 3 349.906 2.809 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(NCc3ccc(Cl)cc3)CC2)CC[N@H+]1C ZINC001406957471 1368247317 /nfs/dbraw/zinc/24/73/17/1368247317.db2.gz LKNJPYIXDOTLRP-HOCLYGCPSA-N 1 3 349.906 2.809 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)NCC2(NCc3ccccc3)CC2)C1 ZINC001406992835 1368290250 /nfs/dbraw/zinc/29/02/50/1368290250.db2.gz YANJHLJZMIAQHL-QZTJIDSGSA-N 1 3 329.488 2.545 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CC[N@H+](C/C=C/Cl)C2)CC1 ZINC001407001888 1368305648 /nfs/dbraw/zinc/30/56/48/1368305648.db2.gz MXVINSSTWHCYOK-IOMDMTNGSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CC[N@@H+](C/C=C/Cl)C2)CC1 ZINC001407001888 1368305660 /nfs/dbraw/zinc/30/56/60/1368305660.db2.gz MXVINSSTWHCYOK-IOMDMTNGSA-N 1 3 341.927 2.640 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)c1 ZINC001407093458 1368417661 /nfs/dbraw/zinc/41/76/61/1368417661.db2.gz NGMXBEFDFVNNSG-AEFFLSMTSA-N 1 3 349.494 2.943 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@]1(C)CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001407174194 1368541602 /nfs/dbraw/zinc/54/16/02/1368541602.db2.gz HMGZQPPYKMDPPH-NRFANRHFSA-N 1 3 343.515 2.986 10 0 EFAEHO CC[C@H](F)CN1CCC[C@@](C)(CNC(=O)C(C)(C)[NH+]2CCCC2)C1 ZINC001407289098 1368712206 /nfs/dbraw/zinc/71/22/06/1368712206.db2.gz CQVHDASUOCUMBD-LPHOPBHVSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001407336622 1368789065 /nfs/dbraw/zinc/78/90/65/1368789065.db2.gz VAWRRMSZUWZHMZ-HNNXBMFYSA-N 1 3 347.494 2.838 10 0 EFAEHO CCCC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001407336622 1368789071 /nfs/dbraw/zinc/78/90/71/1368789071.db2.gz VAWRRMSZUWZHMZ-HNNXBMFYSA-N 1 3 347.494 2.838 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1C ZINC001407564503 1368993342 /nfs/dbraw/zinc/99/33/42/1368993342.db2.gz WDKCGIVTWRHWJI-UYAOXDASSA-N 1 3 345.531 2.970 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)C[C@H]21 ZINC001407659285 1369077888 /nfs/dbraw/zinc/07/78/88/1369077888.db2.gz RIRDLXZHNCETMX-ZWKOTPCHSA-N 1 3 349.544 2.903 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)C[C@H]21 ZINC001407659285 1369077900 /nfs/dbraw/zinc/07/79/00/1369077900.db2.gz RIRDLXZHNCETMX-ZWKOTPCHSA-N 1 3 349.544 2.903 10 0 EFAEHO CCCC[N@@H+]1CCc2c(CNC(=O)CN3CC[C@H](C)C3)cccc2C1 ZINC001407747550 1369187765 /nfs/dbraw/zinc/18/77/65/1369187765.db2.gz PGZXXAJYSUJNIM-KRWDZBQOSA-N 1 3 343.515 2.803 10 0 EFAEHO CCCC[N@H+]1CCc2c(CNC(=O)CN3CC[C@H](C)C3)cccc2C1 ZINC001407747550 1369187772 /nfs/dbraw/zinc/18/77/72/1369187772.db2.gz PGZXXAJYSUJNIM-KRWDZBQOSA-N 1 3 343.515 2.803 10 0 EFAEHO CC(C)[C@@H](C(=O)NCc1cccc2c1CC[N@H+](CC1CC1)C2)N(C)C ZINC001407747817 1369189119 /nfs/dbraw/zinc/18/91/19/1369189119.db2.gz PVRZMCUHRUFXQI-FQEVSTJZSA-N 1 3 343.515 2.657 10 0 EFAEHO CC(C)[C@@H](C(=O)NCc1cccc2c1CC[N@@H+](CC1CC1)C2)N(C)C ZINC001407747817 1369189125 /nfs/dbraw/zinc/18/91/25/1369189125.db2.gz PVRZMCUHRUFXQI-FQEVSTJZSA-N 1 3 343.515 2.657 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+]CC2CCC3(CC3)CC2)CCC1)N(C)C ZINC001407784436 1369227594 /nfs/dbraw/zinc/22/75/94/1369227594.db2.gz LRILYUWSMXYZIN-QGZVFWFLSA-N 1 3 335.536 2.926 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001407812887 1369262448 /nfs/dbraw/zinc/26/24/48/1369262448.db2.gz VCSZLMQJWNCDMW-IAGOWNOFSA-N 1 3 347.528 2.894 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001407812887 1369262452 /nfs/dbraw/zinc/26/24/52/1369262452.db2.gz VCSZLMQJWNCDMW-IAGOWNOFSA-N 1 3 347.528 2.894 10 0 EFAEHO CN(CCC[N@H+](C)[C@@H]1CCCc2ccccc21)C(=O)CN1CCCC1 ZINC001407945379 1369442160 /nfs/dbraw/zinc/44/21/60/1369442160.db2.gz DDDGHFDLSTUZFF-HXUWFJFHSA-N 1 3 343.515 2.940 10 0 EFAEHO CN(CCC[N@@H+](C)[C@@H]1CCCc2ccccc21)C(=O)CN1CCCC1 ZINC001407945379 1369442163 /nfs/dbraw/zinc/44/21/63/1369442163.db2.gz DDDGHFDLSTUZFF-HXUWFJFHSA-N 1 3 343.515 2.940 10 0 EFAEHO CCC1([NH2+]Cc2cccc(C)c2)CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001407963343 1369469368 /nfs/dbraw/zinc/46/93/68/1369469368.db2.gz JDCPWJPJLWYXMB-LJQANCHMSA-N 1 3 343.515 2.950 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]([C@H]2CCCN(C/C=C\Cl)C2)C1 ZINC001407968548 1369475840 /nfs/dbraw/zinc/47/58/40/1369475840.db2.gz XWMAMGAVIXROPD-YWJKWWDISA-N 1 3 341.927 2.641 10 0 EFAEHO CC(C)CN1Cc2ccc(CNC(=O)C[C@@H]3CC[N@H+](C)C3)cc2C1 ZINC001408050749 1369562591 /nfs/dbraw/zinc/56/25/91/1369562591.db2.gz DZKOFWJXPCZJOL-KRWDZBQOSA-N 1 3 329.488 2.616 10 0 EFAEHO CC(C)CN1Cc2ccc(CNC(=O)C[C@@H]3CC[N@@H+](C)C3)cc2C1 ZINC001408050749 1369562593 /nfs/dbraw/zinc/56/25/93/1369562593.db2.gz DZKOFWJXPCZJOL-KRWDZBQOSA-N 1 3 329.488 2.616 10 0 EFAEHO C[C@H]1CC[N@H+](CC(=O)N2CCC(C)(NC/C(Cl)=C/Cl)CC2)C1 ZINC001408116334 1369621868 /nfs/dbraw/zinc/62/18/68/1369621868.db2.gz KZTPDTJJWJBFTJ-GFAPJHNFSA-N 1 3 348.318 2.618 10 0 EFAEHO C[C@H]1CC[N@@H+](CC(=O)N2CCC(C)(NC/C(Cl)=C/Cl)CC2)C1 ZINC001408116334 1369621875 /nfs/dbraw/zinc/62/18/75/1369621875.db2.gz KZTPDTJJWJBFTJ-GFAPJHNFSA-N 1 3 348.318 2.618 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@H+](CC2CC(F)(F)C2)CC1(C)C)N(C)C ZINC001408139631 1369640260 /nfs/dbraw/zinc/64/02/60/1369640260.db2.gz LICPJBAYPHEZKB-HUUCEWRRSA-N 1 3 345.478 2.589 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@@H+](CC2CC(F)(F)C2)CC1(C)C)N(C)C ZINC001408139631 1369640267 /nfs/dbraw/zinc/64/02/67/1369640267.db2.gz LICPJBAYPHEZKB-HUUCEWRRSA-N 1 3 345.478 2.589 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)C2(C[NH+](C)C)CC2)CCN1Cc1ccsc1 ZINC001408179387 1369686239 /nfs/dbraw/zinc/68/62/39/1369686239.db2.gz JBBKZPUAWIHMLE-GDBMZVCRSA-N 1 3 335.517 2.559 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+][C@H](C)c1ccc(F)c(F)c1)N(C)C ZINC001408214254 1369719787 /nfs/dbraw/zinc/71/97/87/1369719787.db2.gz YTJKFXZKCWABPY-OGHNNQOOSA-N 1 3 341.446 2.850 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1sccc1Cl)N(C)C ZINC001408228391 1369731813 /nfs/dbraw/zinc/73/18/13/1369731813.db2.gz BOBFBLYGXLJRLG-WCQYABFASA-N 1 3 331.913 2.726 10 0 EFAEHO CCCN(CCNC(=O)C12CC[NH+](CC1)C2)Cc1ccc(C)c(F)c1 ZINC001437763074 1388031156 /nfs/dbraw/zinc/03/11/56/1388031156.db2.gz HZQYEIBXDOJKPH-UHFFFAOYSA-N 1 3 347.478 2.558 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN(C)C(C)C)[C@H]1CCc2ccccc21 ZINC001437766766 1388040526 /nfs/dbraw/zinc/04/05/26/1388040526.db2.gz ICJQJFWIIVHRJK-IBGZPJMESA-N 1 3 331.504 2.842 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN(C)C(C)C)[C@H]1CCc2ccccc21 ZINC001437766766 1388040532 /nfs/dbraw/zinc/04/05/32/1388040532.db2.gz ICJQJFWIIVHRJK-IBGZPJMESA-N 1 3 331.504 2.842 10 0 EFAEHO CCCN(CCNC(=O)C[NH+]1[C@H](C)CC[C@H]1C)Cc1ccsc1 ZINC001437769801 1388046442 /nfs/dbraw/zinc/04/64/42/1388046442.db2.gz SXODJSYSESTBMW-HZPDHXFCSA-N 1 3 337.533 2.949 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC001414654734 1370553386 /nfs/dbraw/zinc/55/33/86/1370553386.db2.gz ZOESYRBRUQLESW-QGZVFWFLSA-N 1 3 348.535 2.927 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC001414654734 1370553389 /nfs/dbraw/zinc/55/33/89/1370553389.db2.gz ZOESYRBRUQLESW-QGZVFWFLSA-N 1 3 348.535 2.927 10 0 EFAEHO Cc1cccc(C)c1CN(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001414697325 1370600573 /nfs/dbraw/zinc/60/05/73/1370600573.db2.gz NHUTUJXSVMWPRW-SFHVURJKSA-N 1 3 348.535 2.717 10 0 EFAEHO Cc1cccc(C)c1CN(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001414697325 1370600583 /nfs/dbraw/zinc/60/05/83/1370600583.db2.gz NHUTUJXSVMWPRW-SFHVURJKSA-N 1 3 348.535 2.717 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@H+](CCC2CCCCC2)C2CC2)C1 ZINC001437808867 1388100536 /nfs/dbraw/zinc/10/05/36/1388100536.db2.gz RZULCNSVRYBHIQ-QGZVFWFLSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@@H+](CCC2CCCCC2)C2CC2)C1 ZINC001437808867 1388100537 /nfs/dbraw/zinc/10/05/37/1388100537.db2.gz RZULCNSVRYBHIQ-QGZVFWFLSA-N 1 3 335.536 2.879 10 0 EFAEHO CCC(CC)C[NH2+][C@@H](C)C1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001437852601 1388142139 /nfs/dbraw/zinc/14/21/39/1388142139.db2.gz NZBRKKBHQKXAID-SJORKVTESA-N 1 3 337.552 2.981 10 0 EFAEHO CCC[NH2+][C@H](C)C1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001437856865 1388144659 /nfs/dbraw/zinc/14/46/59/1388144659.db2.gz WYTRJWMJGJFGPV-DNVCBOLYSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[NH2+][C@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001437857062 1388145585 /nfs/dbraw/zinc/14/55/85/1388145585.db2.gz MRTIVSYWKPSPIT-IRXDYDNUSA-N 1 3 337.895 2.716 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@H]2CC[C@@H](C1)N2CCc1ccc(Cl)cc1 ZINC001437874700 1388160434 /nfs/dbraw/zinc/16/04/34/1388160434.db2.gz BMSULLIXAVVSNN-HDICACEKSA-N 1 3 349.906 2.509 10 0 EFAEHO CN(CC[N@H+](C)C1CCCCC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001417633019 1373110031 /nfs/dbraw/zinc/11/00/31/1373110031.db2.gz VPLOLQLYFDKCFH-IBGZPJMESA-N 1 3 341.515 2.922 10 0 EFAEHO CN(CC[N@@H+](C)C1CCCCC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001417633019 1373110032 /nfs/dbraw/zinc/11/00/32/1373110032.db2.gz VPLOLQLYFDKCFH-IBGZPJMESA-N 1 3 341.515 2.922 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1 ZINC001417646969 1373121272 /nfs/dbraw/zinc/12/12/72/1373121272.db2.gz WRSDTYCGFJLDQF-ZCNNSNEGSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]CCc2ccccc2)C1 ZINC001417797262 1373263838 /nfs/dbraw/zinc/26/38/38/1373263838.db2.gz DFIFDYQNMUSIJH-BMOGMMAESA-N 1 3 343.515 2.586 10 0 EFAEHO CC(C)CC[NH2+][C@H]1C[C@H](CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001417797190 1373264371 /nfs/dbraw/zinc/26/43/71/1373264371.db2.gz CNMVIVHFSNCOPU-UAPYVXQJSA-N 1 3 331.504 2.892 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@H]1C[C@H](CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001417801190 1373270200 /nfs/dbraw/zinc/27/02/00/1373270200.db2.gz WWKKQJMVQULIDK-KBAYOESNSA-N 1 3 335.467 2.594 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccsc2)C1)N1CCCC1 ZINC001417808019 1373278274 /nfs/dbraw/zinc/27/82/74/1373278274.db2.gz OQDRQYSYALCQTA-DOTOQJQBSA-N 1 3 349.544 2.997 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[NH+](C)C)CCN1C/C=C\c1ccccc1 ZINC001417824072 1373299384 /nfs/dbraw/zinc/29/93/84/1373299384.db2.gz CISCZHNELNVIFP-LJJZPKPQSA-N 1 3 329.488 2.621 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CC1CCCC1 ZINC001417823807 1373299422 /nfs/dbraw/zinc/29/94/22/1373299422.db2.gz STWCUYVYDPYUEC-NMLBUPMWSA-N 1 3 347.547 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CC1CCCC1 ZINC001417823807 1373299426 /nfs/dbraw/zinc/29/94/26/1373299426.db2.gz STWCUYVYDPYUEC-NMLBUPMWSA-N 1 3 347.547 2.686 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCCC[C@H](NCC=C(Cl)Cl)C1 ZINC001417841581 1373322478 /nfs/dbraw/zinc/32/24/78/1373322478.db2.gz STIYSLSJVZNJQL-ZDUSSCGKSA-N 1 3 336.307 2.618 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CC[C@H]2C[C@@H](C)C[N@@H+]2C1 ZINC001417886053 1373374365 /nfs/dbraw/zinc/37/43/65/1373374365.db2.gz IMPAUCVGRZXWJZ-LFGUQSLTSA-N 1 3 343.515 2.744 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CC[C@H]2C[C@@H](C)C[N@H+]2C1 ZINC001417886053 1373374369 /nfs/dbraw/zinc/37/43/69/1373374369.db2.gz IMPAUCVGRZXWJZ-LFGUQSLTSA-N 1 3 343.515 2.744 10 0 EFAEHO Cc1ccncc1C[NH2+][C@@H](C)[C@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001417892516 1373380090 /nfs/dbraw/zinc/38/00/90/1373380090.db2.gz PLAWFDPATDHPAO-PKOBYXMFSA-N 1 3 346.519 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H](C)[NH2+]CCc1ccccc1 ZINC001417893356 1373381347 /nfs/dbraw/zinc/38/13/47/1373381347.db2.gz UJYKAFZSSURHOX-UYAOXDASSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@H](CCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001437944956 1388259691 /nfs/dbraw/zinc/25/96/91/1388259691.db2.gz WLGLOWOXQRAZKB-LPHOPBHVSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)C[N@H+]1CC[C@H](CCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001437944956 1388259694 /nfs/dbraw/zinc/25/96/94/1388259694.db2.gz WLGLOWOXQRAZKB-LPHOPBHVSA-N 1 3 341.515 2.683 10 0 EFAEHO Cc1ccccc1CN1CCC[C@@H](NC(=O)CC[C@H]2CCC[N@H+]2C)C1 ZINC001417907324 1373401147 /nfs/dbraw/zinc/40/11/47/1373401147.db2.gz DRGNPZANTWGJMH-WOJBJXKFSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccccc1CN1CCC[C@@H](NC(=O)CC[C@H]2CCC[N@@H+]2C)C1 ZINC001417907324 1373401150 /nfs/dbraw/zinc/40/11/50/1373401150.db2.gz DRGNPZANTWGJMH-WOJBJXKFSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](CNC(=O)C2(N(C)C)CCC2)C2CC2)c1 ZINC001417986405 1373489314 /nfs/dbraw/zinc/48/93/14/1373489314.db2.gz MIETXZWBJKYMCT-GOSISDBHSA-N 1 3 347.478 2.603 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+]Cc1cccc(Cl)c1)C1CC1 ZINC001418008853 1373516256 /nfs/dbraw/zinc/51/62/56/1373516256.db2.gz CAEAXPICRWWOSD-QGZVFWFLSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001418020969 1373532692 /nfs/dbraw/zinc/53/26/92/1373532692.db2.gz MFJNRYOSKDHURG-RBUKOAKNSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001418020969 1373532698 /nfs/dbraw/zinc/53/26/98/1373532698.db2.gz MFJNRYOSKDHURG-RBUKOAKNSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCC[C@H](CN(C)C/C=C/Cl)C2)CC[N@@H+]1C ZINC001418021625 1373534561 /nfs/dbraw/zinc/53/45/61/1373534561.db2.gz QDRVZLZBWMCWBP-QZLPVJBESA-N 1 3 341.927 2.640 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCC[C@H](CN(C)C/C=C/Cl)C2)CC[N@H+]1C ZINC001418021625 1373534567 /nfs/dbraw/zinc/53/45/67/1373534567.db2.gz QDRVZLZBWMCWBP-QZLPVJBESA-N 1 3 341.927 2.640 10 0 EFAEHO C[C@@H]1CCC[C@H](CCN2C[C@H]3CC[C@@H](C2)N3C(=O)CC[NH+](C)C)C1 ZINC001418033588 1373548554 /nfs/dbraw/zinc/54/85/54/1373548554.db2.gz GMVTXWNIXGIIKN-MKXGPGLRSA-N 1 3 335.536 2.830 10 0 EFAEHO CN(C/C=C\Cl)C[C@H]1CCCN(C(=O)C(C)(C)[NH+]2CCCC2)C1 ZINC001418035650 1373550860 /nfs/dbraw/zinc/55/08/60/1373550860.db2.gz WYCUVINACDRZFD-DZFYGRHCSA-N 1 3 341.927 2.784 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+][C@H]1C[C@@H](NC(=O)CN(C)CC(C)(C)C)C1 ZINC001418102717 1373606051 /nfs/dbraw/zinc/60/60/51/1373606051.db2.gz FJHLQRNLXQJDLH-ZACQAIPSSA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(F)c(Cl)c2)C1 ZINC001418112338 1373616509 /nfs/dbraw/zinc/61/65/09/1373616509.db2.gz GJWFKPLFKDHBRV-OKILXGFUSA-N 1 3 341.858 2.556 10 0 EFAEHO C[C@@H]([NH2+][C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)C1)c1ccc(F)cc1 ZINC001418136025 1373660787 /nfs/dbraw/zinc/66/07/87/1373660787.db2.gz YDIWGIYTGRKHFY-XYPHTWIQSA-N 1 3 333.451 2.608 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)NC[C@@H]1CCCN(Cc2ccsc2)C1 ZINC001418140675 1373667527 /nfs/dbraw/zinc/66/75/27/1373667527.db2.gz USMMLJCKQOYXRU-KRWDZBQOSA-N 1 3 349.544 2.952 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001418221900 1373777322 /nfs/dbraw/zinc/77/73/22/1373777322.db2.gz OLHXENCCGOQMMG-SJLPKXTDSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1)NCc1ccsc1 ZINC001418227949 1373783771 /nfs/dbraw/zinc/78/37/71/1373783771.db2.gz PZWUYDYKAAKWJK-DOTOQJQBSA-N 1 3 349.544 2.997 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1)NCc1ccsc1 ZINC001418227949 1373783779 /nfs/dbraw/zinc/78/37/79/1373783779.db2.gz PZWUYDYKAAKWJK-DOTOQJQBSA-N 1 3 349.544 2.997 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001418228943 1373784932 /nfs/dbraw/zinc/78/49/32/1373784932.db2.gz IPCVWJXDVAZZSD-SJLPKXTDSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+][C@@H](C)CNC(=O)CN(C)C2CCC2)c1 ZINC001418234928 1373790517 /nfs/dbraw/zinc/79/05/17/1373790517.db2.gz MFMBMMYHWKUTNE-DLBZAZTESA-N 1 3 331.504 2.943 10 0 EFAEHO CC(C)c1cccc(CN[C@@H](C)CNC(=O)C(C)(C)[NH+]2CCCC2)n1 ZINC001418262847 1373829254 /nfs/dbraw/zinc/82/92/54/1373829254.db2.gz QFVAKAQUDPFIED-INIZCTEOSA-N 1 3 346.519 2.674 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+][C@H]1CCc2ccccc21 ZINC001418277582 1373850468 /nfs/dbraw/zinc/85/04/68/1373850468.db2.gz XMUMSZPIRKQKAF-YJBOKZPZSA-N 1 3 331.504 2.746 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001418314733 1373893778 /nfs/dbraw/zinc/89/37/78/1373893778.db2.gz BEQOKUCSMHAMLC-MAUKXSAKSA-N 1 3 343.471 2.902 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCC[C@@H]([NH2+]Cc2ccsc2)C1)C1CCC1 ZINC001418359421 1373932557 /nfs/dbraw/zinc/93/25/57/1373932557.db2.gz DFEMQCDGIZYZDS-HZPDHXFCSA-N 1 3 335.517 2.749 10 0 EFAEHO C[C@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001418401983 1373982878 /nfs/dbraw/zinc/98/28/78/1373982878.db2.gz KZYJNXAFIHNMDA-HUUCEWRRSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001418438962 1374028381 /nfs/dbraw/zinc/02/83/81/1374028381.db2.gz BNTHCNPJBYDFGR-CYBMUJFWSA-N 1 3 343.874 2.804 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NCCN(C)Cc2ccc(C3CCC3)cc2)CC[N@@H+]1C ZINC001418462662 1374052015 /nfs/dbraw/zinc/05/20/15/1374052015.db2.gz VPHYIYUWFNAJEN-OXQOHEQNSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NCCN(C)Cc2ccc(C3CCC3)cc2)CC[N@H+]1C ZINC001418462662 1374052019 /nfs/dbraw/zinc/05/20/19/1374052019.db2.gz VPHYIYUWFNAJEN-OXQOHEQNSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)c(C)c1 ZINC001418476979 1374071286 /nfs/dbraw/zinc/07/12/86/1374071286.db2.gz RQOCGDSGLIRUAB-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)c(C)c1 ZINC001418476979 1374071290 /nfs/dbraw/zinc/07/12/90/1374071290.db2.gz RQOCGDSGLIRUAB-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001418481553 1374076221 /nfs/dbraw/zinc/07/62/21/1374076221.db2.gz GENPVPOPDPTUIR-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CN(CCNC(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1)Cc1ccc(CF)cc1 ZINC001418511438 1374114003 /nfs/dbraw/zinc/11/40/03/1374114003.db2.gz SKSBACBSEHDRDQ-MOPGFXCFSA-N 1 3 349.494 2.825 10 0 EFAEHO CCN(CCNC(=O)CC[C@H]1CCC[N@@H+]1C)Cc1ccc(F)cc1C ZINC001418550335 1374164639 /nfs/dbraw/zinc/16/46/39/1374164639.db2.gz JUHARHYQJQQLIR-LJQANCHMSA-N 1 3 349.494 2.947 10 0 EFAEHO CCN(CCNC(=O)CC[C@H]1CCC[N@H+]1C)Cc1ccc(F)cc1C ZINC001418550335 1374164641 /nfs/dbraw/zinc/16/46/41/1374164641.db2.gz JUHARHYQJQQLIR-LJQANCHMSA-N 1 3 349.494 2.947 10 0 EFAEHO CCc1ccc(C[N@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001437991512 1388303236 /nfs/dbraw/zinc/30/32/36/1388303236.db2.gz PLUDXHVUJQRPGU-HXUWFJFHSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1ccc(C[N@@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001437991512 1388303242 /nfs/dbraw/zinc/30/32/42/1388303242.db2.gz PLUDXHVUJQRPGU-HXUWFJFHSA-N 1 3 345.531 2.870 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001437991519 1388303523 /nfs/dbraw/zinc/30/35/23/1388303523.db2.gz POWJMDWWZIWILO-IEBWSBKVSA-N 1 3 349.494 2.890 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001437991519 1388303528 /nfs/dbraw/zinc/30/35/28/1388303528.db2.gz POWJMDWWZIWILO-IEBWSBKVSA-N 1 3 349.494 2.890 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001437994820 1388309046 /nfs/dbraw/zinc/30/90/46/1388309046.db2.gz WZRNHYWSSRNYRI-IBGZPJMESA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1ccc(C)c(C[N@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001437994820 1388309050 /nfs/dbraw/zinc/30/90/50/1388309050.db2.gz WZRNHYWSSRNYRI-IBGZPJMESA-N 1 3 345.531 2.924 10 0 EFAEHO CCc1ccccc1CC[N@H+]1CC[C@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001418666550 1374342738 /nfs/dbraw/zinc/34/27/38/1374342738.db2.gz CHUKKNCAVVOMAR-YLJYHZDGSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[N@@H+]1CC[C@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001418666550 1374342745 /nfs/dbraw/zinc/34/27/45/1374342745.db2.gz CHUKKNCAVVOMAR-YLJYHZDGSA-N 1 3 345.531 2.570 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cc1C ZINC001418670025 1374346190 /nfs/dbraw/zinc/34/61/90/1374346190.db2.gz GBMGLMHPEUUTGR-UZLBHIALSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cc1C ZINC001418670025 1374346194 /nfs/dbraw/zinc/34/61/94/1374346194.db2.gz GBMGLMHPEUUTGR-UZLBHIALSA-N 1 3 343.515 2.583 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC001418694462 1374377499 /nfs/dbraw/zinc/37/74/99/1374377499.db2.gz VXJSMLKOTNLPDJ-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC001418694462 1374377502 /nfs/dbraw/zinc/37/75/02/1374377502.db2.gz VXJSMLKOTNLPDJ-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1ccsc1 ZINC001418715923 1374406857 /nfs/dbraw/zinc/40/68/57/1374406857.db2.gz FNRUXKSMKKSTRM-UHFFFAOYSA-N 1 3 337.533 2.951 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC(CN(C)C/C=C\Cl)CC2)CC[N@@H+]1C ZINC001438001947 1388315596 /nfs/dbraw/zinc/31/55/96/1388315596.db2.gz UCLOKABGCGFAGM-QOALNRGFSA-N 1 3 341.927 2.640 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC(CN(C)C/C=C\Cl)CC2)CC[N@H+]1C ZINC001438001947 1388315604 /nfs/dbraw/zinc/31/56/04/1388315604.db2.gz UCLOKABGCGFAGM-QOALNRGFSA-N 1 3 341.927 2.640 10 0 EFAEHO Cc1ccncc1C[NH2+][C@H]1CCCCCN(C(=O)CN(C)C(C)C)C1 ZINC001418777907 1374489992 /nfs/dbraw/zinc/48/99/92/1374489992.db2.gz VWIQWPVWPPIDOJ-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@H](NCCN(C)C(=O)[C@@H]1C[NH+]2CCC1CC2)c1ccccc1Cl ZINC001418809206 1374529379 /nfs/dbraw/zinc/52/93/79/1374529379.db2.gz CYJRWZBYTPKPKE-WMLDXEAASA-N 1 3 349.906 2.791 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+][C@H]2CCc3ccc(Cl)cc32)CCC1 ZINC001418813207 1374534795 /nfs/dbraw/zinc/53/47/95/1374534795.db2.gz UZCOEXCGAHPTKD-KRWDZBQOSA-N 1 3 349.906 2.860 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[N@H+](CC3CCC3)CC(C)(C)C2)CCC1 ZINC001418830551 1374552922 /nfs/dbraw/zinc/55/29/22/1374552922.db2.gz WVGBWXDRXYOMPI-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[N@@H+](CC3CCC3)CC(C)(C)C2)CCC1 ZINC001418830551 1374552926 /nfs/dbraw/zinc/55/29/26/1374552926.db2.gz WVGBWXDRXYOMPI-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CCC(CC)C[NH2+][C@H](C)C1CCN(C(=O)[C@@H](CC)N(C)C)CC1 ZINC001418850016 1374573865 /nfs/dbraw/zinc/57/38/65/1374573865.db2.gz YDVRQXKLQYYPPB-CRAIPNDOSA-N 1 3 325.541 2.980 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@H]2CC[C@@H](C1)N2CC/C=C\c1ccccc1 ZINC001418863478 1374589020 /nfs/dbraw/zinc/58/90/20/1374589020.db2.gz CJKWLBUZDAIUJQ-NOAUSDOKSA-N 1 3 341.499 2.717 10 0 EFAEHO CCCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@H+](CCC)C1 ZINC001418873160 1374605972 /nfs/dbraw/zinc/60/59/72/1374605972.db2.gz ILXPKYPMSGABDG-VQIMIIECSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@@H+](CCC)C1 ZINC001418873160 1374605986 /nfs/dbraw/zinc/60/59/86/1374605986.db2.gz ILXPKYPMSGABDG-VQIMIIECSA-N 1 3 341.515 2.922 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@@H+]([C@H]2CCc3ccccc32)C1 ZINC001418909399 1374673710 /nfs/dbraw/zinc/67/37/10/1374673710.db2.gz XOXPLKOFBQKIGG-PXNSSMCTSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@H+]([C@H]2CCc3ccccc32)C1 ZINC001418909399 1374673715 /nfs/dbraw/zinc/67/37/15/1374673715.db2.gz XOXPLKOFBQKIGG-PXNSSMCTSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](C[N@H+](C)CCCC3CCC3)C2)C1 ZINC001418935675 1374703023 /nfs/dbraw/zinc/70/30/23/1374703023.db2.gz FSMSBFYMUQBCIY-HKUYNNGSSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](C[N@@H+](C)CCCC3CCC3)C2)C1 ZINC001418935675 1374703027 /nfs/dbraw/zinc/70/30/27/1374703027.db2.gz FSMSBFYMUQBCIY-HKUYNNGSSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)C[N@H+](C)C[C@@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001418942744 1374714793 /nfs/dbraw/zinc/71/47/93/1374714793.db2.gz WKTPACFWOKAKRI-LPHOPBHVSA-N 1 3 341.515 2.635 10 0 EFAEHO CC(C)C[N@@H+](C)C[C@@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001418942744 1374714798 /nfs/dbraw/zinc/71/47/98/1374714798.db2.gz WKTPACFWOKAKRI-LPHOPBHVSA-N 1 3 341.515 2.635 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1C[C@@H]2C[C@H]1C[N@@H+]2CC1CCCCC1 ZINC001419050002 1374792332 /nfs/dbraw/zinc/79/23/32/1374792332.db2.gz DZXXSAOYUCWTLD-BZSNNMDCSA-N 1 3 339.499 2.532 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1C[C@@H]2C[C@H]1C[N@H+]2CC1CCCCC1 ZINC001419050002 1374792336 /nfs/dbraw/zinc/79/23/36/1374792336.db2.gz DZXXSAOYUCWTLD-BZSNNMDCSA-N 1 3 339.499 2.532 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC[NH+](C[C@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001419079222 1374819042 /nfs/dbraw/zinc/81/90/42/1374819042.db2.gz YKLHQPDRPYMVPE-GOEBONIOSA-N 1 3 345.478 2.685 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](CC)NCc1ccccc1F ZINC001419199129 1374944828 /nfs/dbraw/zinc/94/48/28/1374944828.db2.gz MVSYMKNQLOSFGB-SJLPKXTDSA-N 1 3 335.467 2.685 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](CC)NCc1ccccc1F ZINC001419199129 1374944835 /nfs/dbraw/zinc/94/48/35/1374944835.db2.gz MVSYMKNQLOSFGB-SJLPKXTDSA-N 1 3 335.467 2.685 10 0 EFAEHO C[C@@H](F)CC[NH+]1CCC2(C[C@@H]2NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001419201894 1374947476 /nfs/dbraw/zinc/94/74/76/1374947476.db2.gz AHXXDUJTCPZULN-CVEARBPZSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]([NH2+]Cc2ccc(Cl)cc2)C2CC2)C1 ZINC001419297873 1375056706 /nfs/dbraw/zinc/05/67/06/1375056706.db2.gz NPQYZCZSJVZTRU-KDOFPFPSSA-N 1 3 349.906 2.666 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](CNC(=O)CN1CC[C@@H](C)C1)C1CC1 ZINC001419301604 1375062692 /nfs/dbraw/zinc/06/26/92/1375062692.db2.gz WPYBJJIJOCCOGO-QRWLVFNGSA-N 1 3 343.515 2.630 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](CNC(=O)CN1CC[C@H](C)C1)C1CC1 ZINC001419301602 1375062800 /nfs/dbraw/zinc/06/28/00/1375062800.db2.gz WPYBJJIJOCCOGO-MGPUTAFESA-N 1 3 343.515 2.630 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)CN2CC[C@@H](C)C2)C2CC2)c(C)c1 ZINC001419302711 1375063784 /nfs/dbraw/zinc/06/37/84/1375063784.db2.gz ZNADKNCQXQIXJH-UZLBHIALSA-N 1 3 343.515 2.630 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H](CN(C)CCF)C1)[NH+]1CCCCC1 ZINC001419334700 1375119797 /nfs/dbraw/zinc/11/97/97/1375119797.db2.gz KEPVTWNYRXEKHI-ZWKOTPCHSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)(C(=O)NCc1ccc(C[NH2+]CC2CC2)cc1)N1CCCC1 ZINC001419389691 1375209486 /nfs/dbraw/zinc/20/94/86/1375209486.db2.gz SKRRHXCEIHODNX-UHFFFAOYSA-N 1 3 329.488 2.677 10 0 EFAEHO CC(C)(C)CC[NH2+][C@H]1C[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001419413009 1375241293 /nfs/dbraw/zinc/24/12/93/1375241293.db2.gz MMBSYPCVCHKKAK-SPYBWZPUSA-N 1 3 341.515 2.872 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]Cc1cc2ccccc2o1 ZINC001419425034 1375256883 /nfs/dbraw/zinc/25/68/83/1375256883.db2.gz ZKDPCBRIWAARPI-QGZVFWFLSA-N 1 3 343.471 2.854 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccc(Cl)cc32)C1)N(C)C ZINC001419426307 1375258531 /nfs/dbraw/zinc/25/85/31/1375258531.db2.gz KIOIRHTXRCTYME-AHCXZYCDSA-N 1 3 349.906 2.904 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2C/C=C/Cl ZINC001419447221 1375285873 /nfs/dbraw/zinc/28/58/73/1375285873.db2.gz KKKIQEXSXWLIQQ-WCFBKCPYSA-N 1 3 345.890 2.530 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C/C=C/Cl ZINC001419447221 1375285880 /nfs/dbraw/zinc/28/58/80/1375285880.db2.gz KKKIQEXSXWLIQQ-WCFBKCPYSA-N 1 3 345.890 2.530 10 0 EFAEHO CN(CC(=O)N1CCC[C@H]2C[N@H+](CCCF)CC[C@@H]21)CC(C)(C)C ZINC001419452107 1375292818 /nfs/dbraw/zinc/29/28/18/1375292818.db2.gz SYCGTEPGLUZHTB-IRXDYDNUSA-N 1 3 341.515 2.637 10 0 EFAEHO CN(CC(=O)N1CCC[C@H]2C[N@@H+](CCCF)CC[C@@H]21)CC(C)(C)C ZINC001419452107 1375292829 /nfs/dbraw/zinc/29/28/29/1375292829.db2.gz SYCGTEPGLUZHTB-IRXDYDNUSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]CC1CCC2(CC2)CC1 ZINC001419470165 1375313414 /nfs/dbraw/zinc/31/34/14/1375313414.db2.gz NIFSFYFZMMVFLD-INIZCTEOSA-N 1 3 335.536 2.783 10 0 EFAEHO CC[C@H]([NH2+][C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)C1)c1ccccc1 ZINC001419470524 1375314567 /nfs/dbraw/zinc/31/45/67/1375314567.db2.gz NQPCURUWNODOBF-KSZLIROESA-N 1 3 329.488 2.859 10 0 EFAEHO CCc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)CC(C)(C)C)C2)cc1 ZINC001419488910 1375336351 /nfs/dbraw/zinc/33/63/51/1375336351.db2.gz DJUWYQQESBFPPB-KDURUIRLSA-N 1 3 345.531 2.964 10 0 EFAEHO C[C@H](c1cccc(F)c1)N1CCC[C@H](CNC(=O)CC[NH+](C)C)C1 ZINC001419555761 1375444866 /nfs/dbraw/zinc/44/48/66/1375444866.db2.gz MKGRXLUQDCLKTK-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N1CCC[C@H](CNC(=O)CC[NH+](C)C)C1 ZINC001419555764 1375445457 /nfs/dbraw/zinc/44/54/57/1375445457.db2.gz MKGRXLUQDCLKTK-JKSUJKDBSA-N 1 3 335.467 2.667 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001419562030 1375453229 /nfs/dbraw/zinc/45/32/29/1375453229.db2.gz DLPQVGXXQMSUMI-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H]2CCCCN2C(=O)CN(C)C(C)C)cs1 ZINC001419622771 1375564012 /nfs/dbraw/zinc/56/40/12/1375564012.db2.gz DIMWCGKGNBREHI-QGZVFWFLSA-N 1 3 337.533 2.867 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001419735551 1375787818 /nfs/dbraw/zinc/78/78/18/1375787818.db2.gz QCBVCGAWNZIBPW-RHSMWYFYSA-N 1 3 337.895 2.807 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001419768771 1375844430 /nfs/dbraw/zinc/84/44/30/1375844430.db2.gz MXXQNJDWEXJQRY-DNVCBOLYSA-N 1 3 342.487 2.637 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]CC1CC(C)(C)C1)NC(=O)CN1CC[C@H](C)C1 ZINC001419794004 1375889215 /nfs/dbraw/zinc/88/92/15/1375889215.db2.gz PLEBSBPTELLKOA-WMZOPIPTSA-N 1 3 337.552 2.885 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1cccc(Cl)c1 ZINC001419829841 1375951073 /nfs/dbraw/zinc/95/10/73/1375951073.db2.gz GEKYMDVGNNWNHH-AWEZNQCLSA-N 1 3 337.895 2.809 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCN(Cc2cc3ccccc3s2)C1 ZINC001438211737 1388416032 /nfs/dbraw/zinc/41/60/32/1388416032.db2.gz UZTZLLCUHIMCSR-OAHLLOKOSA-N 1 3 331.485 2.544 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]C/C=C\Cl ZINC001419906813 1376107973 /nfs/dbraw/zinc/10/79/73/1376107973.db2.gz MSPJJRBWJRSGDL-AISUJJHZSA-N 1 3 329.916 2.734 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](CNC(=O)CN1CC[C@@H](C)C1)C(C)C ZINC001419910356 1376113045 /nfs/dbraw/zinc/11/30/45/1376113045.db2.gz SBNQLUHIPWRNMH-UZLBHIALSA-N 1 3 345.531 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001419931755 1376148776 /nfs/dbraw/zinc/14/87/76/1376148776.db2.gz GEKPJIQCLDWXRW-GUYCJALGSA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001419931748 1376148802 /nfs/dbraw/zinc/14/88/02/1376148802.db2.gz GEKPJIQCLDWXRW-DYVFJYSZSA-N 1 3 337.895 2.762 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@H+](C)[C@@H]2CCc3ccccc32)CCC1 ZINC001419964656 1376199451 /nfs/dbraw/zinc/19/94/51/1376199451.db2.gz CZZZBBXYPVLFND-GOSISDBHSA-N 1 3 329.488 2.548 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@@H+](C)[C@@H]2CCc3ccccc32)CCC1 ZINC001419964656 1376199457 /nfs/dbraw/zinc/19/94/57/1376199457.db2.gz CZZZBBXYPVLFND-GOSISDBHSA-N 1 3 329.488 2.548 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCC[C@H](NC(=O)CN(C)C(C)C)C2)cc1F ZINC001420020214 1376295049 /nfs/dbraw/zinc/29/50/49/1376295049.db2.gz LGLRBUAPTCMAAN-MSOLQXFVSA-N 1 3 349.494 2.991 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@H]([NH2+]Cc3ccsc3)C2)CCC1 ZINC001420022622 1376302406 /nfs/dbraw/zinc/30/24/06/1376302406.db2.gz DZDCVXKHSIKSHN-JKSUJKDBSA-N 1 3 335.517 2.749 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2)C1 ZINC001420022955 1376302986 /nfs/dbraw/zinc/30/29/86/1376302986.db2.gz YLKFYOZUSGDZGQ-JKSUJKDBSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC001420235702 1376592738 /nfs/dbraw/zinc/59/27/38/1376592738.db2.gz CLODSQIJEMIRCQ-KGLIPLIRSA-N 1 3 341.446 2.850 10 0 EFAEHO CCC(CC)C[N@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001420296471 1376683819 /nfs/dbraw/zinc/68/38/19/1376683819.db2.gz PZFHJMAQGZDYOD-GOSISDBHSA-N 1 3 329.504 2.683 10 0 EFAEHO CCC(CC)C[N@@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001420296471 1376683826 /nfs/dbraw/zinc/68/38/26/1376683826.db2.gz PZFHJMAQGZDYOD-GOSISDBHSA-N 1 3 329.504 2.683 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@]2(F)CC[N@@H+](C(C)(C)C)C2)cc1 ZINC001420295668 1376681230 /nfs/dbraw/zinc/68/12/30/1376681230.db2.gz KHUPLDLWTBWLRE-HXUWFJFHSA-N 1 3 349.494 2.756 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)cc1 ZINC001420295668 1376681236 /nfs/dbraw/zinc/68/12/36/1376681236.db2.gz KHUPLDLWTBWLRE-HXUWFJFHSA-N 1 3 349.494 2.756 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C)C[NH2+]CC1CCC(F)(F)CC1 ZINC001420296292 1376684821 /nfs/dbraw/zinc/68/48/21/1376684821.db2.gz DYLHYLNCYQMJHS-ZBFHGGJFSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@H](C[NH2+]Cc1cc2ccccc2s1)NC(=O)CN(C)C1CCC1 ZINC001420300109 1376690046 /nfs/dbraw/zinc/69/00/46/1376690046.db2.gz QEGOXDAHJXPCOA-CQSZACIVSA-N 1 3 345.512 2.980 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001420335381 1376755824 /nfs/dbraw/zinc/75/58/24/1376755824.db2.gz UOINSLUEGKEOTE-PKOBYXMFSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@H](C(C)C)[NH+]1CCCC1 ZINC001420356851 1376795045 /nfs/dbraw/zinc/79/50/45/1376795045.db2.gz GXGSCOPECDAGIJ-IBGZPJMESA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001420375595 1376834931 /nfs/dbraw/zinc/83/49/31/1376834931.db2.gz FXRWMYWKHQXIQY-CXAGYDPISA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](C)NC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)n1 ZINC001420457279 1377009184 /nfs/dbraw/zinc/00/91/84/1377009184.db2.gz JPYLILDHXDWMIO-ULQDDVLXSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](C)NC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)n1 ZINC001420457279 1377009189 /nfs/dbraw/zinc/00/91/89/1377009189.db2.gz JPYLILDHXDWMIO-ULQDDVLXSA-N 1 3 346.519 2.530 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@@H]1CCC[N@@H+]1Cc1cccc(C)c1 ZINC001420479758 1377050922 /nfs/dbraw/zinc/05/09/22/1377050922.db2.gz DNXJJAPBPWNGTE-RBUKOAKNSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@@H]1CCC[N@H+]1Cc1cccc(C)c1 ZINC001420479758 1377050927 /nfs/dbraw/zinc/05/09/27/1377050927.db2.gz DNXJJAPBPWNGTE-RBUKOAKNSA-N 1 3 349.494 2.756 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@H+](CCC(C)(C)C)C1)CC(C)(C)C ZINC001420553340 1377180382 /nfs/dbraw/zinc/18/03/82/1377180382.db2.gz WHEMTQKAHYFVPT-MRXNPFEDSA-N 1 3 325.541 2.839 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@@H+](CCC(C)(C)C)C1)CC(C)(C)C ZINC001420553340 1377180384 /nfs/dbraw/zinc/18/03/84/1377180384.db2.gz WHEMTQKAHYFVPT-MRXNPFEDSA-N 1 3 325.541 2.839 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+](Cc2cc3ccccc3o2)C1 ZINC001420559559 1377196984 /nfs/dbraw/zinc/19/69/84/1377196984.db2.gz REUZDTJPTXBDDZ-INIZCTEOSA-N 1 3 343.471 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+](Cc2cc3ccccc3o2)C1 ZINC001420559559 1377196991 /nfs/dbraw/zinc/19/69/91/1377196991.db2.gz REUZDTJPTXBDDZ-INIZCTEOSA-N 1 3 343.471 2.711 10 0 EFAEHO Cc1ccc(F)c(CN2CC[C@@H](CNC(=O)[C@@H](C(C)C)[NH+](C)C)C2)c1 ZINC001420560394 1377199805 /nfs/dbraw/zinc/19/98/05/1377199805.db2.gz MKKCJCNBMSNTOW-QFBILLFUSA-N 1 3 349.494 2.658 10 0 EFAEHO Cc1ccc(C)c(C[N@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001420561090 1377202236 /nfs/dbraw/zinc/20/22/36/1377202236.db2.gz VGIFTDKLJAZTPD-SFHVURJKSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001420561090 1377202242 /nfs/dbraw/zinc/20/22/42/1377202242.db2.gz VGIFTDKLJAZTPD-SFHVURJKSA-N 1 3 331.504 2.582 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001420574678 1377229789 /nfs/dbraw/zinc/22/97/89/1377229789.db2.gz FDMWCUZYWBLWBF-KSSFIOAISA-N 1 3 349.906 2.618 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1 ZINC001420582232 1377246595 /nfs/dbraw/zinc/24/65/95/1377246595.db2.gz MSIHWBQSOXDWAE-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1 ZINC001420582232 1377246626 /nfs/dbraw/zinc/24/66/26/1377246626.db2.gz MSIHWBQSOXDWAE-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CCc1ccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2C[NH+]3CCC2CC3)cc1 ZINC001420584517 1377252964 /nfs/dbraw/zinc/25/29/64/1377252964.db2.gz XLVKJZRCLNMIHZ-OXQOHEQNSA-N 1 3 343.515 2.527 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C)C[N@H+](C)CC1CC2(CCC2)C1 ZINC001420587464 1377260725 /nfs/dbraw/zinc/26/07/25/1377260725.db2.gz WYDTYBVVFVCFHT-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C)C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001420587464 1377260728 /nfs/dbraw/zinc/26/07/28/1377260728.db2.gz WYDTYBVVFVCFHT-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(F)c1)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001420588774 1377263637 /nfs/dbraw/zinc/26/36/37/1377263637.db2.gz DTMANXCBIZPPGU-MRXNPFEDSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(CF)cc1)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001420607192 1377307759 /nfs/dbraw/zinc/30/77/59/1377307759.db2.gz GVBNXELRIPSOCI-INIZCTEOSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2s1)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001420661343 1377443170 /nfs/dbraw/zinc/44/31/70/1377443170.db2.gz NYJZCXUDZHJYIO-GDBMZVCRSA-N 1 3 345.512 2.790 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2s1)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001420661343 1377443173 /nfs/dbraw/zinc/44/31/73/1377443173.db2.gz NYJZCXUDZHJYIO-GDBMZVCRSA-N 1 3 345.512 2.790 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2s1)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001420661349 1377443206 /nfs/dbraw/zinc/44/32/06/1377443206.db2.gz NYJZCXUDZHJYIO-HOCLYGCPSA-N 1 3 345.512 2.790 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2s1)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001420661349 1377443208 /nfs/dbraw/zinc/44/32/08/1377443208.db2.gz NYJZCXUDZHJYIO-HOCLYGCPSA-N 1 3 345.512 2.790 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)Cc1ccccc1C1CC1 ZINC001420668671 1377466601 /nfs/dbraw/zinc/46/66/01/1377466601.db2.gz BMEOOCYSHFMNRO-INIZCTEOSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)Cc1ccccc1C1CC1 ZINC001420668671 1377466605 /nfs/dbraw/zinc/46/66/05/1377466605.db2.gz BMEOOCYSHFMNRO-INIZCTEOSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001438315242 1388502316 /nfs/dbraw/zinc/50/23/16/1388502316.db2.gz YJDNPKULFIAKGH-LSDHHAIUSA-N 1 3 345.478 2.781 10 0 EFAEHO CC[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]CC[C@H]1CCCC1(F)F ZINC001438314702 1388503034 /nfs/dbraw/zinc/50/30/34/1388503034.db2.gz WRURTFIFOZTVPN-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C[NH2+]Cc1ccccc1C)C1CC1 ZINC001420736869 1377583755 /nfs/dbraw/zinc/58/37/55/1377583755.db2.gz KRCARHOYNJSNSQ-UXHICEINSA-N 1 3 343.515 2.854 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]Cc1cccc(C)c1)C1CC1 ZINC001420746321 1377593588 /nfs/dbraw/zinc/59/35/88/1377593588.db2.gz YCQMTMVKFARAHF-WOJBJXKFSA-N 1 3 343.515 2.854 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C[NH2+]Cc1cccc(C)c1)C1CC1 ZINC001420746309 1377593595 /nfs/dbraw/zinc/59/35/95/1377593595.db2.gz YCQMTMVKFARAHF-UXHICEINSA-N 1 3 343.515 2.854 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1cc(C)sc1C)C1CC1)N(C)C ZINC001420749472 1377596534 /nfs/dbraw/zinc/59/65/34/1377596534.db2.gz KKNYDXYMBWBZAS-DLBZAZTESA-N 1 3 337.533 2.690 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H](NC(=O)CN(C)C(C)C)C2CC2)c(C)s1 ZINC001420800422 1377687001 /nfs/dbraw/zinc/68/70/01/1377687001.db2.gz SCWKZGXMFXSFIV-QGZVFWFLSA-N 1 3 337.533 2.690 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@H+](C)C1)[C@H]1CCN(Cc2cccc(C)c2)C1 ZINC001420830372 1377742178 /nfs/dbraw/zinc/74/21/78/1377742178.db2.gz VRCURNSLICTWBO-PMACEKPBSA-N 1 3 343.515 2.760 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@@H+](C)C1)[C@H]1CCN(Cc2cccc(C)c2)C1 ZINC001420830372 1377742181 /nfs/dbraw/zinc/74/21/81/1377742181.db2.gz VRCURNSLICTWBO-PMACEKPBSA-N 1 3 343.515 2.760 10 0 EFAEHO CCCN(C(=O)C[C@@H]1CC[N@H+](C)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001420831040 1377742437 /nfs/dbraw/zinc/74/24/37/1377742437.db2.gz XVOHSFKUCFNKQK-VQTJNVASSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN(C(=O)C[C@@H]1CC[N@@H+](C)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001420831040 1377742439 /nfs/dbraw/zinc/74/24/39/1377742439.db2.gz XVOHSFKUCFNKQK-VQTJNVASSA-N 1 3 343.515 2.841 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]CC1CCC2(CC2)CC1 ZINC001438334969 1388515175 /nfs/dbraw/zinc/51/51/75/1388515175.db2.gz OQFYEAQHGJZBPE-WMZOPIPTSA-N 1 3 335.536 2.783 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@H]2CCN2CC/C=C/c2ccccc2)C1 ZINC001420878947 1377823306 /nfs/dbraw/zinc/82/33/06/1377823306.db2.gz CIBAIIFOUDSJCD-PEABSYDSSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@H]2CCN2CC/C=C/c2ccccc2)C1 ZINC001420878947 1377823308 /nfs/dbraw/zinc/82/33/08/1377823308.db2.gz CIBAIIFOUDSJCD-PEABSYDSSA-N 1 3 341.499 2.622 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1CC[C@H](CCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001420882366 1377830376 /nfs/dbraw/zinc/83/03/76/1377830376.db2.gz ZGFBIQFPJHGGJQ-JKSUJKDBSA-N 1 3 329.504 2.541 10 0 EFAEHO CC[C@@H](F)C[N@H+]1CC[C@H](CCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001420882366 1377830379 /nfs/dbraw/zinc/83/03/79/1377830379.db2.gz ZGFBIQFPJHGGJQ-JKSUJKDBSA-N 1 3 329.504 2.541 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NCC[C@@H]2CCN(C/C=C/Cl)C2)C1 ZINC001420890164 1377844668 /nfs/dbraw/zinc/84/46/68/1377844668.db2.gz YWGBAXHGISNGLC-CDFMYIFESA-N 1 3 341.927 2.689 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NCC[C@@H]2CCN(C/C=C/Cl)C2)C1 ZINC001420890164 1377844671 /nfs/dbraw/zinc/84/46/71/1377844671.db2.gz YWGBAXHGISNGLC-CDFMYIFESA-N 1 3 341.927 2.689 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(N[C@@H](C)c3cccc(F)c3)CC2)CC[N@@H+]1C ZINC001420939244 1377911817 /nfs/dbraw/zinc/91/18/17/1377911817.db2.gz HETZGQOSRAFRLR-JCGIZDLHSA-N 1 3 347.478 2.855 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(N[C@@H](C)c3cccc(F)c3)CC2)CC[N@H+]1C ZINC001420939244 1377911820 /nfs/dbraw/zinc/91/18/20/1377911820.db2.gz HETZGQOSRAFRLR-JCGIZDLHSA-N 1 3 347.478 2.855 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](C[N@H+](C)CCC3CCCC3)C2)C1 ZINC001420943158 1377917743 /nfs/dbraw/zinc/91/77/43/1377917743.db2.gz LGGWRMACFYUCRU-HKUYNNGSSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](C[N@@H+](C)CCC3CCCC3)C2)C1 ZINC001420943158 1377917744 /nfs/dbraw/zinc/91/77/44/1377917744.db2.gz LGGWRMACFYUCRU-HKUYNNGSSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](C[N@H+](C)CCCC(C)(C)C)C2)C1 ZINC001420948722 1377925906 /nfs/dbraw/zinc/92/59/06/1377925906.db2.gz RFGAVBXXURVBQH-MSOLQXFVSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](C[N@@H+](C)CCCC(C)(C)C)C2)C1 ZINC001420948722 1377925911 /nfs/dbraw/zinc/92/59/11/1377925911.db2.gz RFGAVBXXURVBQH-MSOLQXFVSA-N 1 3 337.552 2.935 10 0 EFAEHO CCc1ccccc1CNC1(CNC(=O)CC[C@@H]2CCC[N@@H+]2C)CC1 ZINC001420956872 1377938662 /nfs/dbraw/zinc/93/86/62/1377938662.db2.gz XXWLUVKWKYLAJG-IBGZPJMESA-N 1 3 343.515 2.862 10 0 EFAEHO CCc1ccccc1CNC1(CNC(=O)CC[C@@H]2CCC[N@H+]2C)CC1 ZINC001420956872 1377938666 /nfs/dbraw/zinc/93/86/66/1377938666.db2.gz XXWLUVKWKYLAJG-IBGZPJMESA-N 1 3 343.515 2.862 10 0 EFAEHO CCc1cccc(CNC2(CNC(=O)[C@H]3CC[N@H+](C)[C@@H](C)C3)CC2)c1 ZINC001420971408 1377958413 /nfs/dbraw/zinc/95/84/13/1377958413.db2.gz DVIZURBXOOXEAA-LPHOPBHVSA-N 1 3 343.515 2.718 10 0 EFAEHO CCc1cccc(CNC2(CNC(=O)[C@H]3CC[N@@H+](C)[C@@H](C)C3)CC2)c1 ZINC001420971408 1377958414 /nfs/dbraw/zinc/95/84/14/1377958414.db2.gz DVIZURBXOOXEAA-LPHOPBHVSA-N 1 3 343.515 2.718 10 0 EFAEHO Cc1cc(Cl)ccc1CNC1(CNC(=O)C[C@H]2CC[N@@H+](C)C2)CC1 ZINC001420991811 1377987324 /nfs/dbraw/zinc/98/73/24/1377987324.db2.gz BQDHSYHYCZBLGZ-OAHLLOKOSA-N 1 3 349.906 2.729 10 0 EFAEHO Cc1cc(Cl)ccc1CNC1(CNC(=O)C[C@H]2CC[N@H+](C)C2)CC1 ZINC001420991811 1377987328 /nfs/dbraw/zinc/98/73/28/1377987328.db2.gz BQDHSYHYCZBLGZ-OAHLLOKOSA-N 1 3 349.906 2.729 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)NCC2(NCc3cccc(F)c3)CC2)C1 ZINC001420995014 1377993575 /nfs/dbraw/zinc/99/35/75/1377993575.db2.gz NDPJVRXQVLDAEM-FUHWJXTLSA-N 1 3 347.478 2.685 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+][C@@H]2CCc3c2cccc3Cl)CC1)N(C)C ZINC001420997169 1377997332 /nfs/dbraw/zinc/99/73/32/1377997332.db2.gz ZTYHBRMPRMGBQK-SJORKVTESA-N 1 3 349.906 2.906 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+][C@H]2CCc3c2cccc3Cl)CC1)N(C)C ZINC001420997168 1377997499 /nfs/dbraw/zinc/99/74/99/1377997499.db2.gz ZTYHBRMPRMGBQK-IRXDYDNUSA-N 1 3 349.906 2.906 10 0 EFAEHO CCc1ccc(C[NH2+]C2(CNC(=O)CN3[C@@H](C)CC[C@@H]3C)CC2)cc1 ZINC001421004223 1378007759 /nfs/dbraw/zinc/00/77/59/1378007759.db2.gz IPQPPPNNIJHURA-IRXDYDNUSA-N 1 3 343.515 2.860 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CC[N@H+](CC3CCC3)C2)CC1 ZINC001421007284 1378011396 /nfs/dbraw/zinc/01/13/96/1378011396.db2.gz MMYUAZIJDJFQMX-IBGZPJMESA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CC[N@@H+](CC3CCC3)C2)CC1 ZINC001421007284 1378011400 /nfs/dbraw/zinc/01/14/00/1378011400.db2.gz MMYUAZIJDJFQMX-IBGZPJMESA-N 1 3 335.536 2.687 10 0 EFAEHO C[C@@H](c1ccccc1F)N1CC[C@]2(CCN(C(=O)CC[NH+](C)C)C2)C1 ZINC001421041240 1378058187 /nfs/dbraw/zinc/05/81/87/1378058187.db2.gz UTTNRHQDJYOWKJ-JXFKEZNVSA-N 1 3 347.478 2.763 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[NH2+]Cc1cc(C)ccc1F ZINC001421135478 1378166123 /nfs/dbraw/zinc/16/61/23/1378166123.db2.gz IRNAKPDNRVDQTP-KRWDZBQOSA-N 1 3 335.467 2.557 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@H]1CNCc1cc(C)ccc1F ZINC001421142040 1378176412 /nfs/dbraw/zinc/17/64/12/1378176412.db2.gz LNEDPQUEMGKPCY-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@H]1CNCc1cc(C)ccc1F ZINC001421142040 1378176416 /nfs/dbraw/zinc/17/64/16/1378176416.db2.gz LNEDPQUEMGKPCY-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO Cc1ccc(CN2CCC(C)(NC(=O)CCC[NH+](C)C)CC2)c(C)n1 ZINC001421148854 1378187915 /nfs/dbraw/zinc/18/79/15/1378187915.db2.gz XPWOUUYPBGCQNJ-UHFFFAOYSA-N 1 3 346.519 2.511 10 0 EFAEHO CC(C)(C(=O)NCC1CN(CCCc2ccsc2)C1)[NH+]1CCCC1 ZINC001421158096 1378201342 /nfs/dbraw/zinc/20/13/42/1378201342.db2.gz YUONDVIBSGNYJZ-UHFFFAOYSA-N 1 3 349.544 2.603 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH+]2CC(CNC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001421184719 1378245317 /nfs/dbraw/zinc/24/53/17/1378245317.db2.gz UURNZNOPOZOTGZ-PXNSSMCTSA-N 1 3 345.531 2.999 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@@H]2C[C@H]1CN2CC1CCCCC1)[NH+](CC)CC ZINC001421215966 1378290924 /nfs/dbraw/zinc/29/09/24/1378290924.db2.gz IDWFHDNEWQYKQP-FHWLQOOXSA-N 1 3 335.536 2.972 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)N[C@@]2(C)CCN(Cc3ccc(CF)cc3)C2)C1 ZINC001421222721 1378305057 /nfs/dbraw/zinc/30/50/57/1378305057.db2.gz MZIBBKWJFHQIBW-ICSRJNTNSA-N 1 3 347.478 2.579 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)N[C@@]2(C)CCN(Cc3ccc(CF)cc3)C2)C1 ZINC001421222721 1378305066 /nfs/dbraw/zinc/30/50/66/1378305066.db2.gz MZIBBKWJFHQIBW-ICSRJNTNSA-N 1 3 347.478 2.579 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2ccc(F)cc2C)C1)N(C)C ZINC001421253215 1378353416 /nfs/dbraw/zinc/35/34/16/1378353416.db2.gz JVOPDCKZPIFHHJ-UYAOXDASSA-N 1 3 349.494 2.803 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1(C)CC[NH+](CC[C@H](C)F)CC1 ZINC001421265721 1378376621 /nfs/dbraw/zinc/37/66/21/1378376621.db2.gz ISVCDBCZHVKZQT-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@@H]1CC[N@H+](Cc2ccccc2C)C1 ZINC001421347141 1378524498 /nfs/dbraw/zinc/52/44/98/1378524498.db2.gz BIMAGIUAUMCSIB-FXAWDEMLSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2C)C1 ZINC001421347141 1378524503 /nfs/dbraw/zinc/52/45/03/1378524503.db2.gz BIMAGIUAUMCSIB-FXAWDEMLSA-N 1 3 343.515 2.760 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)[NH+]1CCCC1)NCC=C(Cl)Cl ZINC001421433200 1378610930 /nfs/dbraw/zinc/61/09/30/1378610930.db2.gz BXUXSGLCWWJXBR-GFCCVEGCSA-N 1 3 336.307 2.664 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]Cc1ccsc1 ZINC001421456146 1378641743 /nfs/dbraw/zinc/64/17/43/1378641743.db2.gz NTRRJMSTTBOEAS-IRXDYDNUSA-N 1 3 337.533 2.995 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)CCC1 ZINC001421515651 1378728163 /nfs/dbraw/zinc/72/81/63/1378728163.db2.gz QWQWLSCOKHTRQG-OTWHNJEPSA-N 1 3 341.499 2.640 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)CCC1 ZINC001421515651 1378728168 /nfs/dbraw/zinc/72/81/68/1378728168.db2.gz QWQWLSCOKHTRQG-OTWHNJEPSA-N 1 3 341.499 2.640 10 0 EFAEHO CCc1ccccc1[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]CC1CC1 ZINC001421530410 1378757287 /nfs/dbraw/zinc/75/72/87/1378757287.db2.gz OBRKSJKZPCMYIQ-IBGZPJMESA-N 1 3 343.515 2.890 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H](C)[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001421542376 1378783750 /nfs/dbraw/zinc/78/37/50/1378783750.db2.gz MILIBVYSBPPZPY-FXAWDEMLSA-N 1 3 345.531 2.916 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@](C)(C[NH2+]CC1CCCC1)C1CC1 ZINC001421545988 1378789912 /nfs/dbraw/zinc/78/99/12/1378789912.db2.gz SHBMDRFOCOACIT-QUCCMNQESA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@@](C)(C[NH2+]Cc2cccc(F)c2)C2CC2)C1 ZINC001421550643 1378795331 /nfs/dbraw/zinc/79/53/31/1378795331.db2.gz JCOLSFAWFXMKMA-YWZLYKJASA-N 1 3 347.478 2.542 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@](C)(C[NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001421581538 1378843366 /nfs/dbraw/zinc/84/33/66/1378843366.db2.gz FITMITKTNZRWJH-IBGZPJMESA-N 1 3 344.503 2.715 10 0 EFAEHO Cc1cc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)CCC[NH+](C)C)cs1 ZINC001421629030 1378907633 /nfs/dbraw/zinc/90/76/33/1378907633.db2.gz CQSIUUBMGJWNSE-ROUUACIJSA-N 1 3 349.544 2.964 10 0 EFAEHO Cc1cc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)CC[NH+](C)C)cs1 ZINC001421633925 1378918223 /nfs/dbraw/zinc/91/82/23/1378918223.db2.gz KMPZINPSNDLDCE-DLBZAZTESA-N 1 3 335.517 2.574 10 0 EFAEHO Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)CC[NH+](C)C)cc1F ZINC001421637202 1378924599 /nfs/dbraw/zinc/92/45/99/1378924599.db2.gz NMYQRMSMYWNAIT-RTBURBONSA-N 1 3 347.478 2.651 10 0 EFAEHO C[C@@H](NC/C=C\Cl)c1ccc(CNC(=O)C23CC[NH+](CC2)C3)cc1 ZINC001421657368 1378958730 /nfs/dbraw/zinc/95/87/30/1378958730.db2.gz YHHJOZPISQGDPC-QPOBUALMSA-N 1 3 347.890 2.802 10 0 EFAEHO CCCC[N@@H+]1CCc2c(CNC(=O)CN(C)CCC)cccc2C1 ZINC001421696203 1379001769 /nfs/dbraw/zinc/00/17/69/1379001769.db2.gz HERJEWIMFBFGTO-UHFFFAOYSA-N 1 3 331.504 2.803 10 0 EFAEHO CCCC[N@H+]1CCc2c(CNC(=O)CN(C)CCC)cccc2C1 ZINC001421696203 1379001773 /nfs/dbraw/zinc/00/17/73/1379001773.db2.gz HERJEWIMFBFGTO-UHFFFAOYSA-N 1 3 331.504 2.803 10 0 EFAEHO C[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)C[NH2+]Cc1ccsc1 ZINC001421740535 1379063669 /nfs/dbraw/zinc/06/36/69/1379063669.db2.gz QSYXDHWSJNCYPG-CVEARBPZSA-N 1 3 337.533 2.855 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+][C@@H](C)c1c(F)cccc1F ZINC001421767934 1379107172 /nfs/dbraw/zinc/10/71/72/1379107172.db2.gz KFSPJYOFLQDQMA-KBPBESRZSA-N 1 3 341.446 2.708 10 0 EFAEHO C[C@@H](c1ccccc1F)N1CCC[C@@H](NC(=O)CC[NH+](C)C)CC1 ZINC001421831532 1379197055 /nfs/dbraw/zinc/19/70/55/1379197055.db2.gz WPHJKYIMGIOXFL-JKSUJKDBSA-N 1 3 335.467 2.809 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]CC3CC(C)(C)C3)CCCC2)CCC1 ZINC001421847485 1379232416 /nfs/dbraw/zinc/23/24/16/1379232416.db2.gz URADIOPYIZUUCG-UHFFFAOYSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)C23CCC[NH+]2CCC3)c1 ZINC001421932228 1379369590 /nfs/dbraw/zinc/36/95/90/1379369590.db2.gz SIMRKMOWOCXTHF-MRXNPFEDSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001421945924 1379391115 /nfs/dbraw/zinc/39/11/15/1379391115.db2.gz PXANHPBHNHEHOB-DNVCBOLYSA-N 1 3 345.531 2.890 10 0 EFAEHO CC(C)N1Cc2ccccc2C[C@H]1CNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001421952317 1379399544 /nfs/dbraw/zinc/39/95/44/1379399544.db2.gz JKLCIVPLXIKWJZ-PMACEKPBSA-N 1 3 343.515 2.812 10 0 EFAEHO CC(C)N1Cc2ccccc2C[C@H]1CNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001421952317 1379399554 /nfs/dbraw/zinc/39/95/54/1379399554.db2.gz JKLCIVPLXIKWJZ-PMACEKPBSA-N 1 3 343.515 2.812 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@]2(CCN(CCC(F)(F)F)C2)C1 ZINC001421953950 1379402456 /nfs/dbraw/zinc/40/24/56/1379402456.db2.gz FURLYHZXQBIJMJ-INIZCTEOSA-N 1 3 349.441 2.595 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@]2(CCN(CCC(F)(F)F)C2)C1 ZINC001421953950 1379402461 /nfs/dbraw/zinc/40/24/61/1379402461.db2.gz FURLYHZXQBIJMJ-INIZCTEOSA-N 1 3 349.441 2.595 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1cc(F)ccc1C ZINC001421989805 1379445002 /nfs/dbraw/zinc/44/50/02/1379445002.db2.gz UNRHVNZCQPDMMP-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@H]([NH2+]CCC(C)(C)C)[C@H](C)C2)CC1 ZINC001422037412 1379523454 /nfs/dbraw/zinc/52/34/54/1379523454.db2.gz ZWCWXZBAIFKSCX-QZTJIDSGSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](F)C[N@H+](C)CCC1CCN(C(=O)[C@H](CC)N(C)C)CC1 ZINC001422038722 1379525725 /nfs/dbraw/zinc/52/57/25/1379525725.db2.gz CUEUZQNPPGGODV-IRXDYDNUSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)CCC1CCN(C(=O)[C@H](CC)N(C)C)CC1 ZINC001422038722 1379525730 /nfs/dbraw/zinc/52/57/30/1379525730.db2.gz CUEUZQNPPGGODV-IRXDYDNUSA-N 1 3 329.504 2.635 10 0 EFAEHO COC(=O)c1cc2cc(C[N@@H+]3C[C@@]4(C)CN(C)C[C@@]4(C)C3)ccc2o1 ZINC001422102661 1379612960 /nfs/dbraw/zinc/61/29/60/1379612960.db2.gz AIWKZCWYYGCSMS-BGYRXZFFSA-N 1 3 342.439 2.993 10 0 EFAEHO COC(=O)c1cc2cc(C[N@H+]3C[C@@]4(C)CN(C)C[C@@]4(C)C3)ccc2o1 ZINC001422102661 1379612962 /nfs/dbraw/zinc/61/29/62/1379612962.db2.gz AIWKZCWYYGCSMS-BGYRXZFFSA-N 1 3 342.439 2.993 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C(C)C)c1 ZINC001422135811 1379668976 /nfs/dbraw/zinc/66/89/76/1379668976.db2.gz NPVVLPNHYQVDNE-LJQANCHMSA-N 1 3 333.520 2.874 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CCc2ccccc2F)[C@@H](C)C1 ZINC001422136552 1379670251 /nfs/dbraw/zinc/67/02/51/1379670251.db2.gz VIHXBKJWFAGEIZ-FUHWJXTLSA-N 1 3 349.494 2.678 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CCc2ccccc2F)[C@@H](C)C1 ZINC001422136552 1379670255 /nfs/dbraw/zinc/67/02/55/1379670255.db2.gz VIHXBKJWFAGEIZ-FUHWJXTLSA-N 1 3 349.494 2.678 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)[NH2+]CC1CC(C)(C)C1 ZINC001422139238 1379672674 /nfs/dbraw/zinc/67/26/74/1379672674.db2.gz YYKJGZILUHDVBH-DLBZAZTESA-N 1 3 325.541 2.739 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)[NH2+]CC1CC(C)(C)C1 ZINC001422139260 1379672993 /nfs/dbraw/zinc/67/29/93/1379672993.db2.gz YYKJGZILUHDVBH-SJORKVTESA-N 1 3 325.541 2.739 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001422158434 1379700163 /nfs/dbraw/zinc/70/01/63/1379700163.db2.gz SEQRQKPMXPKQSI-IRXDYDNUSA-N 1 3 331.504 2.575 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@H+](C)CCN(C)C(=O)[C@H]2CCCN2C)c1 ZINC001422180792 1379738258 /nfs/dbraw/zinc/73/82/58/1379738258.db2.gz GANBJICPABDQMO-IEBWSBKVSA-N 1 3 331.504 2.849 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@@H+](C)CCN(C)C(=O)[C@H]2CCCN2C)c1 ZINC001422180792 1379738260 /nfs/dbraw/zinc/73/82/60/1379738260.db2.gz GANBJICPABDQMO-IEBWSBKVSA-N 1 3 331.504 2.849 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@H+](C)CC[C@H]1CCCC1(F)F)N(C)C ZINC001422232436 1379822656 /nfs/dbraw/zinc/82/26/56/1379822656.db2.gz VNPABGULLFUASI-HZPDHXFCSA-N 1 3 347.494 2.788 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@@H+](C)CC[C@H]1CCCC1(F)F)N(C)C ZINC001422232436 1379822660 /nfs/dbraw/zinc/82/26/60/1379822660.db2.gz VNPABGULLFUASI-HZPDHXFCSA-N 1 3 347.494 2.788 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H]1C[N@H+](C)CCC(C)(C)C)N(C)C ZINC001422248979 1379856973 /nfs/dbraw/zinc/85/69/73/1379856973.db2.gz CKDMSINGYHYSFG-IAGOWNOFSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H]1C[N@@H+](C)CCC(C)(C)C)N(C)C ZINC001422248979 1379856977 /nfs/dbraw/zinc/85/69/77/1379856977.db2.gz CKDMSINGYHYSFG-IAGOWNOFSA-N 1 3 325.541 2.932 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CC1CC(NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001422293153 1379903287 /nfs/dbraw/zinc/90/32/87/1379903287.db2.gz JMLBLMQCSOKXDC-PPSBMQLTSA-N 1 3 349.494 2.705 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001422332066 1379939708 /nfs/dbraw/zinc/93/97/08/1379939708.db2.gz UHAOSNVESIQDSS-HZPDHXFCSA-N 1 3 343.515 2.642 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001422428252 1380080616 /nfs/dbraw/zinc/08/06/16/1380080616.db2.gz UYBSVQOPMYDDHH-CHWSQXEVSA-N 1 3 343.874 2.804 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001422494622 1380197965 /nfs/dbraw/zinc/19/79/65/1380197965.db2.gz KHVNMNDTNSNHKF-IEBWSBKVSA-N 1 3 331.504 2.771 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)Cc2ccc(F)cc2C)CC[N@@H+]1C ZINC001422510988 1380227453 /nfs/dbraw/zinc/22/74/53/1380227453.db2.gz YJSBABPRGNCJOO-ZYSHUDEJSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)Cc2ccc(F)cc2C)CC[N@H+]1C ZINC001422510988 1380227459 /nfs/dbraw/zinc/22/74/59/1380227459.db2.gz YJSBABPRGNCJOO-ZYSHUDEJSA-N 1 3 349.494 2.801 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H](C)[N@@H+](C)CCC1CCCCC1)N(C)C ZINC001422512588 1380230010 /nfs/dbraw/zinc/23/00/10/1380230010.db2.gz BCCDVSRBTVNAJJ-AEFFLSMTSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H](C)[N@H+](C)CCC1CCCCC1)N(C)C ZINC001422512588 1380230009 /nfs/dbraw/zinc/23/00/09/1380230009.db2.gz BCCDVSRBTVNAJJ-AEFFLSMTSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[N@H+](C)Cc1ccccc1C ZINC001422516682 1380238909 /nfs/dbraw/zinc/23/89/09/1380238909.db2.gz JYJKSVHXDCERRM-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccccc1C ZINC001422516682 1380238911 /nfs/dbraw/zinc/23/89/11/1380238911.db2.gz JYJKSVHXDCERRM-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[N@H+](C)Cc1ccccc1C ZINC001422516679 1380239120 /nfs/dbraw/zinc/23/91/20/1380239120.db2.gz JYJKSVHXDCERRM-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccccc1C ZINC001422516679 1380239122 /nfs/dbraw/zinc/23/91/22/1380239122.db2.gz JYJKSVHXDCERRM-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1 ZINC001422527623 1380258187 /nfs/dbraw/zinc/25/81/87/1380258187.db2.gz ZWKPZRCVFKMHEL-QAPCUYQASA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1 ZINC001422527623 1380258191 /nfs/dbraw/zinc/25/81/91/1380258191.db2.gz ZWKPZRCVFKMHEL-QAPCUYQASA-N 1 3 335.467 2.635 10 0 EFAEHO COc1ccc(CN(C)[C@@H](C)CNC(=O)CC[C@@H]2CCC[N@@H+]2C)cc1 ZINC001422530971 1380265967 /nfs/dbraw/zinc/26/59/67/1380265967.db2.gz UTWQRTJEQXOATQ-WMZOPIPTSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1ccc(CN(C)[C@@H](C)CNC(=O)CC[C@@H]2CCC[N@H+]2C)cc1 ZINC001422530971 1380265970 /nfs/dbraw/zinc/26/59/70/1380265970.db2.gz UTWQRTJEQXOATQ-WMZOPIPTSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1ccc(CN(C)[C@H](C)CNC(=O)CC[C@H]2CCC[N@@H+]2C)cc1 ZINC001422530965 1380266053 /nfs/dbraw/zinc/26/60/53/1380266053.db2.gz UTWQRTJEQXOATQ-SJLPKXTDSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1ccc(CN(C)[C@H](C)CNC(=O)CC[C@H]2CCC[N@H+]2C)cc1 ZINC001422530965 1380266058 /nfs/dbraw/zinc/26/60/58/1380266058.db2.gz UTWQRTJEQXOATQ-SJLPKXTDSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[N@H+](C)CCc1ccccc1 ZINC001422572064 1380346052 /nfs/dbraw/zinc/34/60/52/1380346052.db2.gz GRXSRNQDNHKBNN-RTBURBONSA-N 1 3 345.531 2.930 10 0 EFAEHO C[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[N@@H+](C)CCc1ccccc1 ZINC001422572064 1380346055 /nfs/dbraw/zinc/34/60/55/1380346055.db2.gz GRXSRNQDNHKBNN-RTBURBONSA-N 1 3 345.531 2.930 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)C[NH2+][C@@H](C)c1cc(C)ccc1C ZINC001438539045 1388663002 /nfs/dbraw/zinc/66/30/02/1388663002.db2.gz AUFQRTILHUGQLY-HOCLYGCPSA-N 1 3 342.487 2.981 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)C[NH2+][C@@H](C)c1cc(C)ccc1C ZINC001438539053 1388663401 /nfs/dbraw/zinc/66/34/01/1388663401.db2.gz AUFQRTILHUGQLY-ZBFHGGJFSA-N 1 3 342.487 2.981 10 0 EFAEHO CCCC[C@H](CNCc1ccccc1F)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001422690719 1380607182 /nfs/dbraw/zinc/60/71/82/1380607182.db2.gz PQRVZMRGWUDAKO-IAGOWNOFSA-N 1 3 335.467 2.542 10 0 EFAEHO CCCC[C@H](CNCc1ccccc1F)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001422690719 1380607184 /nfs/dbraw/zinc/60/71/84/1380607184.db2.gz PQRVZMRGWUDAKO-IAGOWNOFSA-N 1 3 335.467 2.542 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@@H]1CCCCCN1Cc1ccsc1 ZINC001422722025 1380717075 /nfs/dbraw/zinc/71/70/75/1380717075.db2.gz UVUHNGODDOJCCP-KRWDZBQOSA-N 1 3 337.533 2.951 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@@H]1CCCCCN1Cc1ccsc1 ZINC001422722025 1380717079 /nfs/dbraw/zinc/71/70/79/1380717079.db2.gz UVUHNGODDOJCCP-KRWDZBQOSA-N 1 3 337.533 2.951 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1CN(Cc2ccccc2)C1)[NH+](CC)CC ZINC001422752255 1380758593 /nfs/dbraw/zinc/75/85/93/1380758593.db2.gz OFSGGXRIVNAHAN-QFBILLFUSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1cc(C)cc(CN2CC([C@@H](C)NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c1 ZINC001422755494 1380763865 /nfs/dbraw/zinc/76/38/65/1380763865.db2.gz SCLSOCORUJZNMT-MSOLQXFVSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1cc(C)cc(CN2CC([C@@H](C)NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c1 ZINC001422755494 1380763869 /nfs/dbraw/zinc/76/38/69/1380763869.db2.gz SCLSOCORUJZNMT-MSOLQXFVSA-N 1 3 343.515 2.582 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001422804778 1380832640 /nfs/dbraw/zinc/83/26/40/1380832640.db2.gz YZGTXIXTFUMTKG-SJORKVTESA-N 1 3 337.552 2.835 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001422804778 1380832647 /nfs/dbraw/zinc/83/26/47/1380832647.db2.gz YZGTXIXTFUMTKG-SJORKVTESA-N 1 3 337.552 2.835 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)C[C@@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001422835716 1380888273 /nfs/dbraw/zinc/88/82/73/1380888273.db2.gz PCMLPIRXNCLLGK-CVEARBPZSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)C[C@@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001422835716 1380888280 /nfs/dbraw/zinc/88/82/80/1380888280.db2.gz PCMLPIRXNCLLGK-CVEARBPZSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1ccc(CN(C)C[C@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)cc1 ZINC001422859477 1380957681 /nfs/dbraw/zinc/95/76/81/1380957681.db2.gz IATFRJKIZKXOSJ-INIZCTEOSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2ccccc2F)C1)N(C)C ZINC001422909853 1381037560 /nfs/dbraw/zinc/03/75/60/1381037560.db2.gz SFXQUAACYCJUEO-ATNYBXOESA-N 1 3 335.467 2.711 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([N@H+](C)[C@H]2CCc3ccccc32)CC1 ZINC001422934551 1381088827 /nfs/dbraw/zinc/08/88/27/1381088827.db2.gz VCHDZOMJMXOEKX-FQEVSTJZSA-N 1 3 343.515 2.939 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([N@@H+](C)[C@H]2CCc3ccccc32)CC1 ZINC001422934551 1381088833 /nfs/dbraw/zinc/08/88/33/1381088833.db2.gz VCHDZOMJMXOEKX-FQEVSTJZSA-N 1 3 343.515 2.939 10 0 EFAEHO C[N@H+](CCCc1ccccc1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001422947246 1381105601 /nfs/dbraw/zinc/10/56/01/1381105601.db2.gz KSDUKLHVWOISRC-UHFFFAOYSA-N 1 3 343.515 2.638 10 0 EFAEHO C[N@@H+](CCCc1ccccc1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001422947246 1381105609 /nfs/dbraw/zinc/10/56/09/1381105609.db2.gz KSDUKLHVWOISRC-UHFFFAOYSA-N 1 3 343.515 2.638 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001422992354 1381174073 /nfs/dbraw/zinc/17/40/73/1381174073.db2.gz CFZDYNMLHQVIDJ-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C[NH2+][C@@H]1CCc2ccccc21)C1CC1 ZINC001423001482 1381187049 /nfs/dbraw/zinc/18/70/49/1381187049.db2.gz ZFJQRQFMRMPOIW-UXHICEINSA-N 1 3 343.515 2.841 10 0 EFAEHO C[C@H](CN(C)C(=O)CN(C)C1CCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001423073956 1381305254 /nfs/dbraw/zinc/30/52/54/1381305254.db2.gz CVAIPUYFLWMABB-DNVCBOLYSA-N 1 3 329.488 2.595 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C[C@@H](C)N(C)C(=O)CN(C)C2CCC2)c1 ZINC001438646131 1388716129 /nfs/dbraw/zinc/71/61/29/1388716129.db2.gz BMLPEKIXFSPDDB-CVEARBPZSA-N 1 3 347.503 2.677 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N(C)C[C@H](C)NCc2ccsc2)C1 ZINC001423128941 1381402938 /nfs/dbraw/zinc/40/29/38/1381402938.db2.gz VCRSCSLDVMNQMK-DOTOQJQBSA-N 1 3 337.533 2.807 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N(C)C[C@H](C)NCc2ccsc2)C1 ZINC001423128941 1381402940 /nfs/dbraw/zinc/40/29/40/1381402940.db2.gz VCRSCSLDVMNQMK-DOTOQJQBSA-N 1 3 337.533 2.807 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCN1CCCc1ccccc1 ZINC001423129790 1381403589 /nfs/dbraw/zinc/40/35/89/1381403589.db2.gz XIWQLQCSVOJMBH-UXHICEINSA-N 1 3 343.515 2.684 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCN1CCCc1ccccc1 ZINC001423129790 1381403597 /nfs/dbraw/zinc/40/35/97/1381403597.db2.gz XIWQLQCSVOJMBH-UXHICEINSA-N 1 3 343.515 2.684 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC[C@H]1CCN1[C@@H]1CCc2ccccc21 ZINC001423150531 1381446271 /nfs/dbraw/zinc/44/62/71/1381446271.db2.gz GWHKJKLESKLWBW-IEBWSBKVSA-N 1 3 329.488 2.596 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC[C@H]1CCN1[C@@H]1CCc2ccccc21 ZINC001423150531 1381446283 /nfs/dbraw/zinc/44/62/83/1381446283.db2.gz GWHKJKLESKLWBW-IEBWSBKVSA-N 1 3 329.488 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]CC[C@H]1CCCC1(F)F ZINC001423173694 1381505031 /nfs/dbraw/zinc/50/50/31/1381505031.db2.gz QGQDWAOKWRYNLW-HUUCEWRRSA-N 1 3 333.467 2.589 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccsc1)N(C)C(=O)CN(C)CC(C)(C)C ZINC001438679126 1388734705 /nfs/dbraw/zinc/73/47/05/1388734705.db2.gz GACBBNBBVLIGEG-AWEZNQCLSA-N 1 3 325.522 2.663 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]C/C=C/c2ccccc2)CC1 ZINC001423308258 1381764530 /nfs/dbraw/zinc/76/45/30/1381764530.db2.gz PNZRSSIUERXEJB-ULJNDFNZSA-N 1 3 341.499 2.811 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H]2C)c1 ZINC001423331978 1381795367 /nfs/dbraw/zinc/79/53/67/1381795367.db2.gz SYGVANHTKMKACO-PKOBYXMFSA-N 1 3 331.504 2.723 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CC[C@H](NCc2cc(C)ccc2F)[C@H]1C ZINC001423333350 1381797379 /nfs/dbraw/zinc/79/73/79/1381797379.db2.gz XGGPAPBNFOAZJM-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CC[C@H](NCc2cc(C)ccc2F)[C@H]1C ZINC001423333350 1381797382 /nfs/dbraw/zinc/79/73/82/1381797382.db2.gz XGGPAPBNFOAZJM-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(CF)cc2)[C@H]1C ZINC001423333420 1381798149 /nfs/dbraw/zinc/79/81/49/1381798149.db2.gz XIPQROBFJSRADU-QAPCUYQASA-N 1 3 335.467 2.575 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]Cc3ccccc3)[C@H]2C1 ZINC001423366412 1381855235 /nfs/dbraw/zinc/85/52/35/1381855235.db2.gz WWQPADYMGGCQHO-UFYCRDLUSA-N 1 3 343.515 2.744 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001423407302 1381915669 /nfs/dbraw/zinc/91/56/69/1381915669.db2.gz VALSBYBHJKAEQG-CVEARBPZSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@H](F)C[NH2+][C@H]1CN(C(=O)c2cccc(CN(C)C)c2)CC1(C)C ZINC001423409619 1381918228 /nfs/dbraw/zinc/91/82/28/1381918228.db2.gz XPZIJZUEENLNRD-ROUUACIJSA-N 1 3 349.494 2.937 10 0 EFAEHO CN(CC(=O)N1C[C@@H]([NH2+]Cc2ccccc2)C(C)(C)C1)CC(C)(C)C ZINC001423410284 1381919394 /nfs/dbraw/zinc/91/93/94/1381919394.db2.gz ZWMXZEYXCPQSIH-GOSISDBHSA-N 1 3 345.531 2.991 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(F)cc2)C[C@H]1C ZINC001423447739 1381952417 /nfs/dbraw/zinc/95/24/17/1381952417.db2.gz FXSKZUZYVIQHFB-QAPCUYQASA-N 1 3 335.467 2.635 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C(=O)CN1CCCC1 ZINC001438723214 1388764989 /nfs/dbraw/zinc/76/49/89/1388764989.db2.gz QBHANXXESOJXHT-QGZVFWFLSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)C[NH2+]C[C@H](NC(=O)[C@H](C(C)C)N1CCCC1)C(C)(C)C ZINC001423623939 1382184761 /nfs/dbraw/zinc/18/47/61/1382184761.db2.gz XAQHKRMAMMNTTA-IRXDYDNUSA-N 1 3 325.541 2.883 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H](CNCc1cc(F)cc(F)c1)C(C)(C)C ZINC001423629838 1382195220 /nfs/dbraw/zinc/19/52/20/1382195220.db2.gz XKYSBKMJBVUJRD-MRXNPFEDSA-N 1 3 341.446 2.537 10 0 EFAEHO C[C@H](C(=O)NC[C@@]1(C)CCC[N@H+](CCCF)C1)N1CCCCCC1 ZINC001423705829 1382323407 /nfs/dbraw/zinc/32/34/07/1382323407.db2.gz RECBZZLJMKGTFX-IEBWSBKVSA-N 1 3 341.515 2.829 10 0 EFAEHO C[C@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CCCF)C1)N1CCCCCC1 ZINC001423705829 1382323415 /nfs/dbraw/zinc/32/34/15/1382323415.db2.gz RECBZZLJMKGTFX-IEBWSBKVSA-N 1 3 341.515 2.829 10 0 EFAEHO CC[NH2+]C[C@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CCCCC1 ZINC001438745219 1388782296 /nfs/dbraw/zinc/78/22/96/1388782296.db2.gz IQWQSTVEJVNVJY-LPHOPBHVSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c(C)c1 ZINC001423947886 1382533304 /nfs/dbraw/zinc/53/33/04/1382533304.db2.gz LSFODAVDRDDWQS-ICSRJNTNSA-N 1 3 345.531 2.828 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H](C)[NH2+]Cc2ccccc2)C1 ZINC001438760679 1388791171 /nfs/dbraw/zinc/79/11/71/1388791171.db2.gz BFGTXSZBKYVPAJ-IEBWSBKVSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001423952896 1382541620 /nfs/dbraw/zinc/54/16/20/1382541620.db2.gz YFYPHWKYJTVMNF-AZUAARDMSA-N 1 3 345.531 2.828 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([C@H](C)[NH2+]CCc2ccccc2F)C1 ZINC001423957153 1382545591 /nfs/dbraw/zinc/54/55/91/1382545591.db2.gz QAWOBZRVYNFPFG-FUHWJXTLSA-N 1 3 349.494 2.535 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([C@H](C)[NH2+]CCC(C)(C)C)C1 ZINC001438771974 1388800561 /nfs/dbraw/zinc/80/05/61/1388800561.db2.gz PWACRVZDPLCTHQ-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@H]1C[NH2+]Cc1ccccc1 ZINC001438771837 1388800844 /nfs/dbraw/zinc/80/08/44/1388800844.db2.gz YGIYLHKNSYMADC-IEBWSBKVSA-N 1 3 331.504 2.744 10 0 EFAEHO CCCN(C)CC(=O)N(C)CCC[N@H+](C)[C@H]1CCc2ccccc21 ZINC001424325720 1382937863 /nfs/dbraw/zinc/93/78/63/1382937863.db2.gz ILMAAHOSFZFINI-IBGZPJMESA-N 1 3 331.504 2.796 10 0 EFAEHO CCCN(C)CC(=O)N(C)CCC[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001424325720 1382937867 /nfs/dbraw/zinc/93/78/67/1382937867.db2.gz ILMAAHOSFZFINI-IBGZPJMESA-N 1 3 331.504 2.796 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001424383598 1382974610 /nfs/dbraw/zinc/97/46/10/1382974610.db2.gz JUZUCPXDWQDKNQ-LJQANCHMSA-N 1 3 332.492 2.703 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001424383598 1382974617 /nfs/dbraw/zinc/97/46/17/1382974617.db2.gz JUZUCPXDWQDKNQ-LJQANCHMSA-N 1 3 332.492 2.703 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)c(C)c1 ZINC001438825051 1388842974 /nfs/dbraw/zinc/84/29/74/1388842974.db2.gz COZYNPGYBQHCDX-FXAWDEMLSA-N 1 3 345.531 2.876 10 0 EFAEHO CC(C)CC[NH2+][C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001438825773 1388843062 /nfs/dbraw/zinc/84/30/62/1388843062.db2.gz FYFWYQFTGLZMMQ-VQIMIIECSA-N 1 3 343.531 2.975 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CC[NH+](C)C)NCc1ccccc1Cl ZINC001438825602 1388843334 /nfs/dbraw/zinc/84/33/34/1388843334.db2.gz DUMPFNAXPJWYJX-MRXNPFEDSA-N 1 3 325.884 2.522 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+][C@H]2CCc3c2cccc3F)C1 ZINC001424734187 1383305640 /nfs/dbraw/zinc/30/56/40/1383305640.db2.gz KZCNSEUNTSTAAG-ZOJXTTQQSA-N 1 3 347.478 2.638 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001424794539 1383351408 /nfs/dbraw/zinc/35/14/08/1383351408.db2.gz JRJWQXZNSKFGFQ-JKSUJKDBSA-N 1 3 331.504 2.716 10 0 EFAEHO C[C@@H](NC(=O)CN(C)CC(C)(C)C)[C@H](C)[NH2+]Cc1cccc(F)c1 ZINC001424807517 1383369143 /nfs/dbraw/zinc/36/91/43/1383369143.db2.gz PEPDJOSIXLICNP-LSDHHAIUSA-N 1 3 337.483 2.786 10 0 EFAEHO CCc1ccc(CC[NH2+][C@@H](C)[C@H](C)NC(=O)Cc2nc[nH]c2C)cc1 ZINC001424831691 1383392396 /nfs/dbraw/zinc/39/23/96/1383392396.db2.gz GJNMEKBHOPIMSH-GJZGRUSLSA-N 1 3 342.487 2.549 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)[C@@H](C)NC(=O)CCC[NH+]2CCCC2)c1 ZINC001424845041 1383408456 /nfs/dbraw/zinc/40/84/56/1383408456.db2.gz BMQLWMNEDDRSLL-DLBZAZTESA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](C(=O)N(C)CC(C)(C)C[NH2+]Cc1ccsc1)N(C)C ZINC001424877872 1383454667 /nfs/dbraw/zinc/45/46/67/1383454667.db2.gz NVPHNBLTZHCVTG-OAHLLOKOSA-N 1 3 325.522 2.663 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC2(C[NH2+]Cc3ccccc3)CCCCC2)C1 ZINC001425179915 1383532574 /nfs/dbraw/zinc/53/25/74/1383532574.db2.gz ZWXHWXBYDXPPCI-SFHVURJKSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1C[NH+](C[C@H]2CCCC(F)(F)C2)C1 ZINC001425262184 1383578131 /nfs/dbraw/zinc/57/81/31/1383578131.db2.gz GOEKZXHJMUOVEZ-GJZGRUSLSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1C[NH+](C[C@H]2CCCC(F)(F)C2)C1 ZINC001425262182 1383578249 /nfs/dbraw/zinc/57/82/49/1383578249.db2.gz GOEKZXHJMUOVEZ-CABCVRRESA-N 1 3 345.478 2.589 10 0 EFAEHO CCc1ccccc1CC[NH+]1CC([C@@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001425263645 1383579014 /nfs/dbraw/zinc/57/90/14/1383579014.db2.gz KBEJMNOPFIKUFK-QGZVFWFLSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C1C[NH+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001425268316 1383582958 /nfs/dbraw/zinc/58/29/58/1383582958.db2.gz MNFGRQWGVLAJTA-QFBILLFUSA-N 1 3 349.563 2.980 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C(C)C)cc1C ZINC001438851769 1388865483 /nfs/dbraw/zinc/86/54/83/1388865483.db2.gz QMZVZYSDAIMQCP-LJQANCHMSA-N 1 3 333.520 2.874 10 0 EFAEHO CC(C)C[N@@H+]1C[C@@H](NC(=O)[C@H](C(C)C)N2CCCCC2)C(C)(C)C1 ZINC001425307156 1383602227 /nfs/dbraw/zinc/60/22/27/1383602227.db2.gz XMVOSIOMLULOAB-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)C[N@H+]1C[C@@H](NC(=O)[C@H](C(C)C)N2CCCCC2)C(C)(C)C1 ZINC001425307156 1383602230 /nfs/dbraw/zinc/60/22/30/1383602230.db2.gz XMVOSIOMLULOAB-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)CCC[N@@H+]1CCCC2(CN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001425371889 1383632470 /nfs/dbraw/zinc/63/24/70/1383632470.db2.gz FEGONLUWEKPTSP-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)CCC[N@H+]1CCCC2(CN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001425371889 1383632475 /nfs/dbraw/zinc/63/24/75/1383632475.db2.gz FEGONLUWEKPTSP-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001425426207 1383656932 /nfs/dbraw/zinc/65/69/32/1383656932.db2.gz WIRRTGWEZWTYJY-GUDVDZBRSA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]C/C=C/c2ccccc2)[C@H]1C ZINC001425897789 1383836666 /nfs/dbraw/zinc/83/66/66/1383836666.db2.gz PBQFJWSMJBJMRM-NZVCTJPZSA-N 1 3 329.488 2.619 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CCC(C)(C)C)CN1C(=O)CN(C)CC(C)(C)C ZINC001425903499 1383839339 /nfs/dbraw/zinc/83/93/39/1383839339.db2.gz MSUSGBHUPNJTBF-CVEARBPZSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc3cc[nH]c3c2)C[C@@H]1C ZINC001425907766 1383845138 /nfs/dbraw/zinc/84/51/38/1383845138.db2.gz GZARSQBVDLSWDO-MAUKXSAKSA-N 1 3 342.487 2.589 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)cc1 ZINC001425982764 1383918217 /nfs/dbraw/zinc/91/82/17/1383918217.db2.gz YSCDUCDGPNNNRR-LJQANCHMSA-N 1 3 345.531 2.916 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@H+](C)Cc2ccc3cc[nH]c3c2)CCC1 ZINC001438883983 1388889172 /nfs/dbraw/zinc/88/91/72/1388889172.db2.gz RVHYNDNOXHZHMV-UHFFFAOYSA-N 1 3 342.487 2.542 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@@H+](C)Cc2ccc3cc[nH]c3c2)CCC1 ZINC001438883983 1388889174 /nfs/dbraw/zinc/88/91/74/1388889174.db2.gz RVHYNDNOXHZHMV-UHFFFAOYSA-N 1 3 342.487 2.542 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCN(C(=O)CC[NH+](C)C)C(C)C)c1 ZINC001426118952 1383999925 /nfs/dbraw/zinc/99/99/25/1383999925.db2.gz RLXNASCFMPQBOH-UHFFFAOYSA-N 1 3 333.520 2.924 10 0 EFAEHO CC(C)Oc1ccc([C@H](CNC(=O)[C@H](C)CC[NH+](C)C)N(C)C)cc1 ZINC001434040559 1387069683 /nfs/dbraw/zinc/06/96/83/1387069683.db2.gz MUVBUQILTCIVKO-APWZRJJASA-N 1 3 349.519 2.781 10 0 EFAEHO CN(CCc1ccc2c(c1)OC(F)(F)O2)C[C@H]1CCC[N@H+](C)C1 ZINC001434459267 1387161206 /nfs/dbraw/zinc/16/12/06/1387161206.db2.gz QGWMADPTXWHTDP-AWEZNQCLSA-N 1 3 326.387 2.824 10 0 EFAEHO CN(CCc1ccc2c(c1)OC(F)(F)O2)C[C@H]1CCC[N@@H+](C)C1 ZINC001434459267 1387161209 /nfs/dbraw/zinc/16/12/09/1387161209.db2.gz QGWMADPTXWHTDP-AWEZNQCLSA-N 1 3 326.387 2.824 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1cccc(Cl)c1 ZINC001439183208 1389036582 /nfs/dbraw/zinc/03/65/82/1389036582.db2.gz ZRRMGORDLHNKJS-RHSMWYFYSA-N 1 3 337.895 2.809 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](C)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001439234137 1389063055 /nfs/dbraw/zinc/06/30/55/1389063055.db2.gz AGYJZUSMODCTKJ-RRFJBIMHSA-N 1 3 337.895 2.583 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](C)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001439234137 1389063061 /nfs/dbraw/zinc/06/30/61/1389063061.db2.gz AGYJZUSMODCTKJ-RRFJBIMHSA-N 1 3 337.895 2.583 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@H]2CCCCN2C(C)C)cc1 ZINC001439257627 1389078626 /nfs/dbraw/zinc/07/86/26/1389078626.db2.gz MUCJTMNXWVARJK-PKOBYXMFSA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1cccc(CN(C)C[C@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001439329519 1389147119 /nfs/dbraw/zinc/14/71/19/1389147119.db2.gz BHQJTMRHVUYOHV-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1cccc(CN(C)C[C@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001439329519 1389147125 /nfs/dbraw/zinc/14/71/25/1389147125.db2.gz BHQJTMRHVUYOHV-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO C[C@H](C[N@H+](C)CC[C@@H]1CCCC1(F)F)NC(=O)CN(C)C1CCC1 ZINC001439331341 1389148913 /nfs/dbraw/zinc/14/89/13/1389148913.db2.gz LOEZARFGJAYSSN-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C[N@@H+](C)CC[C@@H]1CCCC1(F)F)NC(=O)CN(C)C1CCC1 ZINC001439331341 1389148928 /nfs/dbraw/zinc/14/89/28/1389148928.db2.gz LOEZARFGJAYSSN-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CC2(C1)CCCN(Cc1ccsc1)C2 ZINC001506864677 1406368998 /nfs/dbraw/zinc/36/89/98/1406368998.db2.gz HQMYTSNHUIVBJX-UHFFFAOYSA-N 1 3 349.544 2.904 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CC2(C1)CCCN(Cc1ccsc1)C2 ZINC001506864677 1406369004 /nfs/dbraw/zinc/36/90/04/1406369004.db2.gz HQMYTSNHUIVBJX-UHFFFAOYSA-N 1 3 349.544 2.904 10 0 EFAEHO C[NH+](C)CC1(C(=O)NC2(C)CCN(Cc3ccsc3)CC2)CC1 ZINC001439803459 1389333582 /nfs/dbraw/zinc/33/35/82/1389333582.db2.gz HKJRJLHAFHHTQR-UHFFFAOYSA-N 1 3 335.517 2.561 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CCCC2(CN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001506864909 1406372334 /nfs/dbraw/zinc/37/23/34/1406372334.db2.gz KPXHVZBJAMAWBW-BLGFXRMMSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[N@H+]1CCCC2(CN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001506864909 1406372345 /nfs/dbraw/zinc/37/23/45/1406372345.db2.gz KPXHVZBJAMAWBW-BLGFXRMMSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001440136474 1389406338 /nfs/dbraw/zinc/40/63/38/1389406338.db2.gz NROKLZBBVPSRCN-PKOBYXMFSA-N 1 3 349.563 2.981 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]CC[C@@H]2CCN(C(=O)CN3CCCC3)C2)c1 ZINC001440224334 1389454452 /nfs/dbraw/zinc/45/44/52/1389454452.db2.gz YGOZKGKJZSIROS-RTBURBONSA-N 1 3 343.515 2.980 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@@H+]2CCC2CCCCC2)C1 ZINC001440240324 1389466828 /nfs/dbraw/zinc/46/68/28/1389466828.db2.gz ILTSELKEIIEFSQ-HKUYNNGSSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@H+]2CCC2CCCCC2)C1 ZINC001440240324 1389466831 /nfs/dbraw/zinc/46/68/31/1389466831.db2.gz ILTSELKEIIEFSQ-HKUYNNGSSA-N 1 3 335.536 2.831 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCC2)cc1F ZINC001440350421 1389555919 /nfs/dbraw/zinc/55/59/19/1389555919.db2.gz CVYVOFMAKWDWOR-UHFFFAOYSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001440415721 1389612799 /nfs/dbraw/zinc/61/27/99/1389612799.db2.gz XUGMSGAXXKSPLJ-XUVXKRRUSA-N 1 3 345.531 2.956 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[N@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001440463460 1389664705 /nfs/dbraw/zinc/66/47/05/1389664705.db2.gz HEQKCMLBNVVCHV-JKSUJKDBSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[N@@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001440463460 1389664709 /nfs/dbraw/zinc/66/47/09/1389664709.db2.gz HEQKCMLBNVVCHV-JKSUJKDBSA-N 1 3 345.478 2.544 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001440463370 1389664986 /nfs/dbraw/zinc/66/49/86/1389664986.db2.gz FVKWBBJIEQMJOB-QAPCUYQASA-N 1 3 347.494 2.727 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001440463370 1389664988 /nfs/dbraw/zinc/66/49/88/1389664988.db2.gz FVKWBBJIEQMJOB-QAPCUYQASA-N 1 3 347.494 2.727 10 0 EFAEHO CN(CC(=O)N1CCCCC[C@H]([NH2+]C/C=C/Cl)C1)C1CCC1 ZINC001440465650 1389668032 /nfs/dbraw/zinc/66/80/32/1389668032.db2.gz UVVKGRJDNWNJKK-WGPYJDKQSA-N 1 3 327.900 2.584 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CCCC(C)(C)C)CC[C@@H]2C1 ZINC001440474072 1389679087 /nfs/dbraw/zinc/67/90/87/1389679087.db2.gz RAXJZPFROGNUER-MSOLQXFVSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CCCC(C)(C)C)CC[C@@H]2C1 ZINC001440474072 1389679092 /nfs/dbraw/zinc/67/90/92/1389679092.db2.gz RAXJZPFROGNUER-MSOLQXFVSA-N 1 3 337.552 2.933 10 0 EFAEHO Cc1cccnc1CN(C)CCCN(C)C(=O)C[N@H+]1[C@H](C)CC[C@@H]1C ZINC001440486835 1389691388 /nfs/dbraw/zinc/69/13/88/1389691388.db2.gz ZYQCUCHGQGPJTD-HDICACEKSA-N 1 3 346.519 2.543 10 0 EFAEHO Cc1cccnc1CN(C)CCCN(C)C(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001440486835 1389691390 /nfs/dbraw/zinc/69/13/90/1389691390.db2.gz ZYQCUCHGQGPJTD-HDICACEKSA-N 1 3 346.519 2.543 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(CC)([NH2+]CCC(F)(F)F)CC1 ZINC001440540222 1389742168 /nfs/dbraw/zinc/74/21/68/1389742168.db2.gz RTHHUGJJLLNTDC-UHFFFAOYSA-N 1 3 337.430 2.641 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@]2(CC[N@H+](Cc3ccsc3)C2)C1 ZINC001440541378 1389744379 /nfs/dbraw/zinc/74/43/79/1389744379.db2.gz YWUKUKCFAZVOQD-IBGZPJMESA-N 1 3 349.544 2.904 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@]2(CC[N@@H+](Cc3ccsc3)C2)C1 ZINC001440541378 1389744384 /nfs/dbraw/zinc/74/43/84/1389744384.db2.gz YWUKUKCFAZVOQD-IBGZPJMESA-N 1 3 349.544 2.904 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)C(C)(C)C1 ZINC001440616910 1389776011 /nfs/dbraw/zinc/77/60/11/1389776011.db2.gz CBJZOMRPFVNKIK-QGZVFWFLSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)C(C)(C)C1 ZINC001440616910 1389776012 /nfs/dbraw/zinc/77/60/12/1389776012.db2.gz CBJZOMRPFVNKIK-QGZVFWFLSA-N 1 3 325.541 2.980 10 0 EFAEHO CN(Cc1cc2ccccc2o1)C[C@H]1CCCN1C(=O)CC[NH+](C)C ZINC001440739034 1389860340 /nfs/dbraw/zinc/86/03/40/1389860340.db2.gz QKLSSIBDHPECOM-QGZVFWFLSA-N 1 3 343.471 2.807 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]Cc2ccc(Cl)cc2)C1 ZINC001440764552 1389877866 /nfs/dbraw/zinc/87/78/66/1389877866.db2.gz VHPHLBBJNLTWJE-UHFFFAOYSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCCC1)[C@@H](C)[NH2+]CCC(F)(F)F ZINC001440794646 1389902904 /nfs/dbraw/zinc/90/29/04/1389902904.db2.gz UHZGGFNPEWVBRS-CHWSQXEVSA-N 1 3 337.430 2.686 10 0 EFAEHO C[C@H](NCc1cc2ccccc2o1)[C@H](C)NC(=O)C1(C[NH+](C)C)CC1 ZINC001440819661 1389923859 /nfs/dbraw/zinc/92/38/59/1389923859.db2.gz NFSLFGHDIKXHDF-GJZGRUSLSA-N 1 3 343.471 2.757 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1cccc2cccnc21 ZINC001440846635 1389946972 /nfs/dbraw/zinc/94/69/72/1389946972.db2.gz GOQZWKXBJINQEA-HOTGVXAUSA-N 1 3 342.487 2.559 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC(C)(C)C[NH2+]CC2CC(C)(C)C2)C1 ZINC001440881946 1389975928 /nfs/dbraw/zinc/97/59/28/1389975928.db2.gz KWYRAFCBGSQMAM-INIZCTEOSA-N 1 3 337.552 2.839 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1C[NH+]2CCC1CC2)N(C)Cc1cccc(Cl)c1 ZINC001440925136 1390012204 /nfs/dbraw/zinc/01/22/04/1390012204.db2.gz LVNMXDVEBYBOMD-KBXCAEBGSA-N 1 3 349.906 2.618 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1C[NH+]2CCC1CC2)N(C)Cc1cccc(Cl)c1 ZINC001440925149 1390012681 /nfs/dbraw/zinc/01/26/81/1390012681.db2.gz LVNMXDVEBYBOMD-RDTXWAMCSA-N 1 3 349.906 2.618 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@H]2C[C@H](C[NH2+]CCC3CCCCC3)C2)C1 ZINC001506896874 1406414933 /nfs/dbraw/zinc/41/49/33/1406414933.db2.gz BDZLTRBUHWCEDP-BHIYHBOVSA-N 1 3 335.536 2.783 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H](C)[N@H+](C)CC1CC(F)(F)C1 ZINC001440973021 1390064389 /nfs/dbraw/zinc/06/43/89/1390064389.db2.gz HHNPNIULFYFODB-GOEBONIOSA-N 1 3 345.478 2.731 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H](C)[N@@H+](C)CC1CC(F)(F)C1 ZINC001440973021 1390064392 /nfs/dbraw/zinc/06/43/92/1390064392.db2.gz HHNPNIULFYFODB-GOEBONIOSA-N 1 3 345.478 2.731 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@H](C)[N@H+](C)CC1CC(F)(F)C1 ZINC001440973032 1390064948 /nfs/dbraw/zinc/06/49/48/1390064948.db2.gz HHNPNIULFYFODB-ZBFHGGJFSA-N 1 3 345.478 2.731 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@H](C)[N@@H+](C)CC1CC(F)(F)C1 ZINC001440973032 1390064954 /nfs/dbraw/zinc/06/49/54/1390064954.db2.gz HHNPNIULFYFODB-ZBFHGGJFSA-N 1 3 345.478 2.731 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)c1 ZINC001440974235 1390066464 /nfs/dbraw/zinc/06/64/64/1390066464.db2.gz SXSRWFFPEYJJKS-YJBOKZPZSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)c1 ZINC001440974235 1390066470 /nfs/dbraw/zinc/06/64/70/1390066470.db2.gz SXSRWFFPEYJJKS-YJBOKZPZSA-N 1 3 331.504 2.582 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CC=C(Cl)Cl)C1 ZINC001506906621 1406424284 /nfs/dbraw/zinc/42/42/84/1406424284.db2.gz MBEJDIPNBDVAND-MGPQQGTHSA-N 1 3 348.318 2.664 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)N(C)Cc1cccc(C(F)F)c1 ZINC001441009163 1391029594 /nfs/dbraw/zinc/02/95/94/1391029594.db2.gz IKFGVNSSUKDPSH-CZUORRHYSA-N 1 3 339.430 2.512 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)N(C)Cc1cccc(C(F)F)c1 ZINC001441009163 1391029600 /nfs/dbraw/zinc/02/96/00/1391029600.db2.gz IKFGVNSSUKDPSH-CZUORRHYSA-N 1 3 339.430 2.512 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001441032533 1391048278 /nfs/dbraw/zinc/04/82/78/1391048278.db2.gz FRFQFCHQVYKWSK-SFHVURJKSA-N 1 3 342.487 2.590 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001441032533 1391048283 /nfs/dbraw/zinc/04/82/83/1391048283.db2.gz FRFQFCHQVYKWSK-SFHVURJKSA-N 1 3 342.487 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)Cc1cccc2cccnc21 ZINC001441038866 1391054926 /nfs/dbraw/zinc/05/49/26/1391054926.db2.gz ROCFGVXDAZHXCK-INIZCTEOSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)Cc1cccc2cccnc21 ZINC001441038866 1391054929 /nfs/dbraw/zinc/05/49/29/1391054929.db2.gz ROCFGVXDAZHXCK-INIZCTEOSA-N 1 3 342.487 2.512 10 0 EFAEHO CCc1ccccc1CN1CC[C@H](NC(=O)CC[C@H]2CCC[N@@H+]2C)C1 ZINC001441100901 1391092906 /nfs/dbraw/zinc/09/29/06/1391092906.db2.gz ZVWFMYQGQWAEKV-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccccc1CN1CC[C@H](NC(=O)CC[C@H]2CCC[N@H+]2C)C1 ZINC001441100901 1391092910 /nfs/dbraw/zinc/09/29/10/1391092910.db2.gz ZVWFMYQGQWAEKV-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@H]2CCCCCN2CCC(F)(F)F)C1 ZINC001441143649 1391140454 /nfs/dbraw/zinc/14/04/54/1391140454.db2.gz ZLTSFYDICSEMGB-LSDHHAIUSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@H]2CCCCCN2CCC(F)(F)F)C1 ZINC001441143649 1391140456 /nfs/dbraw/zinc/14/04/56/1391140456.db2.gz ZLTSFYDICSEMGB-LSDHHAIUSA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@H]([NH2+]CC1CCCC1)C1CC1 ZINC001441231828 1391199092 /nfs/dbraw/zinc/19/90/92/1391199092.db2.gz GFEPQQUZCJPMKO-RTBURBONSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CN(Cc2ccc(C)c(C)c2)CC1(C)C ZINC001441260183 1391215572 /nfs/dbraw/zinc/21/55/72/1391215572.db2.gz LBKRJVLRYSSWLZ-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CN(Cc2ccc(C)c(C)c2)CC1(C)C ZINC001441260183 1391215576 /nfs/dbraw/zinc/21/55/76/1391215576.db2.gz LBKRJVLRYSSWLZ-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO CN(CC(=O)NC[C@@H]1[C@H]2C[N@H+](CCCC3CCC3)C[C@H]21)CC(C)(C)C ZINC001441292386 1391237042 /nfs/dbraw/zinc/23/70/42/1391237042.db2.gz WWWADRWBPHWTQZ-LDLYASANSA-N 1 3 349.563 2.839 10 0 EFAEHO CN(CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CCCC3CCC3)C[C@H]21)CC(C)(C)C ZINC001441292386 1391237039 /nfs/dbraw/zinc/23/70/39/1391237039.db2.gz WWWADRWBPHWTQZ-LDLYASANSA-N 1 3 349.563 2.839 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001441303401 1391242623 /nfs/dbraw/zinc/24/26/23/1391242623.db2.gz RDVPYESUIWGCMO-IAGOWNOFSA-N 1 3 343.531 2.883 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001441303401 1391242625 /nfs/dbraw/zinc/24/26/25/1391242625.db2.gz RDVPYESUIWGCMO-IAGOWNOFSA-N 1 3 343.531 2.883 10 0 EFAEHO CC(C)[C@@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+]Cc1ccc(F)cc1 ZINC001441404759 1391286621 /nfs/dbraw/zinc/28/66/21/1391286621.db2.gz PHBOJRZTJZUNHM-GOSISDBHSA-N 1 3 349.494 2.931 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@H](C)c2cc(C)ccc2C)C1 ZINC001441415274 1391291082 /nfs/dbraw/zinc/29/10/82/1391291082.db2.gz IKJOKRPVJKSJAS-KZNAEPCWSA-N 1 3 331.504 2.943 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H]1C[C@@H](NC(=O)CCC[NH+](C)C)C1 ZINC001441503776 1391337248 /nfs/dbraw/zinc/33/72/48/1391337248.db2.gz KGGXKFJJNUMXOL-GASCZTMLSA-N 1 3 337.895 2.727 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccccc2C(C)C)C1)N(C)C ZINC001441514786 1391344312 /nfs/dbraw/zinc/34/43/12/1391344312.db2.gz ZOPXRPKDVBZHRC-SCTDSRPQSA-N 1 3 331.504 2.887 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc3ccccc32)C1)N(C)C ZINC001441523612 1391351156 /nfs/dbraw/zinc/35/11/56/1391351156.db2.gz KHSJSRQYVNGXGF-NSHGMRRFSA-N 1 3 339.483 2.917 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001441537448 1391353998 /nfs/dbraw/zinc/35/39/98/1391353998.db2.gz LXKBAGVFXDIKOH-AEFFLSMTSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001441537448 1391354003 /nfs/dbraw/zinc/35/40/03/1391354003.db2.gz LXKBAGVFXDIKOH-AEFFLSMTSA-N 1 3 349.494 2.945 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001441587278 1391378919 /nfs/dbraw/zinc/37/89/19/1391378919.db2.gz ASTJEFHVJZLFAO-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001441587297 1391379289 /nfs/dbraw/zinc/37/92/89/1391379289.db2.gz ASTJEFHVJZLFAO-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(Cl)s1 ZINC001443980872 1391455376 /nfs/dbraw/zinc/45/53/76/1391455376.db2.gz JPTKULKVOKPNCX-QWHCGFSZSA-N 1 3 343.924 2.728 10 0 EFAEHO C[C@@H](C[NH2+][C@H]1CCc2ccccc21)N(C)C(=O)C1(N(C)C)CCC1 ZINC001444619648 1391508467 /nfs/dbraw/zinc/50/84/67/1391508467.db2.gz BDZLUFQTHVOTIE-YJBOKZPZSA-N 1 3 329.488 2.595 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CNCc1ccccc1F)[NH+]1CCCCC1 ZINC001445495893 1391530063 /nfs/dbraw/zinc/53/00/63/1391530063.db2.gz DVHXZKINZIRIDJ-APWZRJJASA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@@]1(C)CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001446619858 1391560381 /nfs/dbraw/zinc/56/03/81/1391560381.db2.gz XGQPWMOEFDTYLH-UYAOXDASSA-N 1 3 349.494 2.938 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@]1(C)CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001446677837 1391578696 /nfs/dbraw/zinc/57/86/96/1391578696.db2.gz AAWLBCSPTVGGPK-FQEVSTJZSA-N 1 3 346.519 2.915 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@]1(C)CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001446677837 1391578700 /nfs/dbraw/zinc/57/87/00/1391578700.db2.gz AAWLBCSPTVGGPK-FQEVSTJZSA-N 1 3 346.519 2.915 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001446937703 1391640446 /nfs/dbraw/zinc/64/04/46/1391640446.db2.gz FHKMGGMKBUAXAA-XLIONFOSSA-N 1 3 345.531 2.916 10 0 EFAEHO C[C@@H](NCc1cccnc1)c1ccc(CNC(=O)CC[NH+](C)C)cc1 ZINC001447081579 1391693579 /nfs/dbraw/zinc/69/35/79/1391693579.db2.gz ILCATBLLQFTAAC-MRXNPFEDSA-N 1 3 340.471 2.500 10 0 EFAEHO C[N@H+](CCC1CCCCC1)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001447770808 1391757007 /nfs/dbraw/zinc/75/70/07/1391757007.db2.gz PSKCRKFVRXKWTN-IBGZPJMESA-N 1 3 335.536 2.975 10 0 EFAEHO C[N@@H+](CCC1CCCCC1)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001447770808 1391757008 /nfs/dbraw/zinc/75/70/08/1391757008.db2.gz PSKCRKFVRXKWTN-IBGZPJMESA-N 1 3 335.536 2.975 10 0 EFAEHO C[C@H]([NH2+]CC1CC(NC(=O)CN(C)C2CCC2)C1)c1ccc(F)cc1 ZINC001447798674 1391770544 /nfs/dbraw/zinc/77/05/44/1391770544.db2.gz RGPRXFKSCRKFFJ-SYJJWHGVSA-N 1 3 347.478 2.855 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](C)[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001447884857 1391790246 /nfs/dbraw/zinc/79/02/46/1391790246.db2.gz MJUAKJDNRIDVED-IRXDYDNUSA-N 1 3 331.504 2.852 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)[C@H](C)NCc1sccc1Cl ZINC001447911432 1391799275 /nfs/dbraw/zinc/79/92/75/1391799275.db2.gz QFRIIOZXGGAALK-RYUDHWBXSA-N 1 3 331.913 2.726 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)[C@H](C)NCc1sccc1Cl ZINC001447911432 1391799282 /nfs/dbraw/zinc/79/92/82/1391799282.db2.gz QFRIIOZXGGAALK-RYUDHWBXSA-N 1 3 331.913 2.726 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001448069018 1391929723 /nfs/dbraw/zinc/92/97/23/1391929723.db2.gz JBLBZDHQLXWFDJ-QFBILLFUSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001448069018 1391929729 /nfs/dbraw/zinc/92/97/29/1391929729.db2.gz JBLBZDHQLXWFDJ-QFBILLFUSA-N 1 3 343.515 2.985 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@H](C)CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001448083767 1391939288 /nfs/dbraw/zinc/93/92/88/1391939288.db2.gz XHVHFKMQOHLCAB-BBWFWOEESA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@H](C)CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001448083767 1391939293 /nfs/dbraw/zinc/93/92/93/1391939293.db2.gz XHVHFKMQOHLCAB-BBWFWOEESA-N 1 3 349.494 2.801 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@H]1CCCCCN1Cc1ccc(F)cc1 ZINC001448267247 1392067376 /nfs/dbraw/zinc/06/73/76/1392067376.db2.gz PBRJSRUOCMJEFS-SFHVURJKSA-N 1 3 335.467 2.638 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H]1C[C@@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001449022765 1392213762 /nfs/dbraw/zinc/21/37/62/1392213762.db2.gz RWTSRSCUJPMDMW-QZTJIDSGSA-N 1 3 331.504 2.723 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H]1C[C@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001449022773 1392213840 /nfs/dbraw/zinc/21/38/40/1392213840.db2.gz RWTSRSCUJPMDMW-ZWKOTPCHSA-N 1 3 331.504 2.723 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]Cc3ccsc3)[C@@H]2C1 ZINC001449029121 1392218411 /nfs/dbraw/zinc/21/84/11/1392218411.db2.gz DCLTZILZVUXEOB-KSZLIROESA-N 1 3 349.544 2.807 10 0 EFAEHO CCc1ccc(CN2CCC[C@@H](NC(=O)CC[NH+](C)C)[C@H]2C)cc1 ZINC001449042503 1392229494 /nfs/dbraw/zinc/22/94/94/1392229494.db2.gz QIRYRXOLHQWNJT-VQIMIIECSA-N 1 3 331.504 2.670 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1C[C@@H]([NH2+]CCC(F)(F)F)C(C)(C)C1 ZINC001449056219 1392240837 /nfs/dbraw/zinc/24/08/37/1392240837.db2.gz BIUMFDHDELZUKB-ZIAGYGMSSA-N 1 3 349.441 2.640 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N(C)[C@@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001507012836 1406587861 /nfs/dbraw/zinc/58/78/61/1406587861.db2.gz MWZRCSHCOKAESE-OALUTQOASA-N 1 3 335.536 2.876 10 0 EFAEHO CN(CC(=O)N(C)[C@@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)C1CCC1 ZINC001507012796 1406588014 /nfs/dbraw/zinc/58/80/14/1406588014.db2.gz SWMFKGIQPFJBAY-IBGZPJMESA-N 1 3 347.547 2.878 10 0 EFAEHO CN(C(=O)C(C)(C)N1CCCCC1)[C@H](C[NH2+]C/C=C/Cl)C1CC1 ZINC001507014185 1406590428 /nfs/dbraw/zinc/59/04/28/1406590428.db2.gz WRACJVVQLMQJNX-OJXHRBAXSA-N 1 3 341.927 2.830 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H](C)CN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001507086662 1406682642 /nfs/dbraw/zinc/68/26/42/1406682642.db2.gz BQTLVZLNFFROGG-GOSISDBHSA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@@H](CN(C)C(=O)CC[C@@H]1CCC[N@@H+]1C)NCc1ccccc1F ZINC001507085843 1406682663 /nfs/dbraw/zinc/68/26/63/1406682663.db2.gz PJNNVDKMMYVEII-RDJZCZTQSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CN(C)C(=O)CC[C@@H]1CCC[N@H+]1C)NCc1ccccc1F ZINC001507085843 1406682671 /nfs/dbraw/zinc/68/26/71/1406682671.db2.gz PJNNVDKMMYVEII-RDJZCZTQSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CN(C)C(=O)CN(C)C1CCC1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001507088810 1406685940 /nfs/dbraw/zinc/68/59/40/1406685940.db2.gz KSAUTLCHUMVTJL-MRXNPFEDSA-N 1 3 343.515 2.985 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC(C)(C)C[NH2+]C/C=C/Cl ZINC001717460030 1419402661 /nfs/dbraw/zinc/40/26/61/1419402661.db2.gz WWIPKZNJQUOKFA-HQPKTYMTSA-N 1 3 329.916 2.688 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001507119546 1406728586 /nfs/dbraw/zinc/72/85/86/1406728586.db2.gz VKURDTNXFCDEFO-ULQDDVLXSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001507119546 1406728593 /nfs/dbraw/zinc/72/85/93/1406728593.db2.gz VKURDTNXFCDEFO-ULQDDVLXSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@H](CN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccccc1C1CC1 ZINC001507128951 1406742429 /nfs/dbraw/zinc/74/24/29/1406742429.db2.gz WGWGUKPPJPJGOY-IAGOWNOFSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001507163292 1406794627 /nfs/dbraw/zinc/79/46/27/1406794627.db2.gz UGWWJEFTEOPLJR-HUUCEWRRSA-N 1 3 333.467 2.589 10 0 EFAEHO CN(Cc1ccc(C[NH+](C)C)cc1)C[C@H]1CCC[C@]2(CCOC2)O1 ZINC001459880663 1395988282 /nfs/dbraw/zinc/98/82/82/1395988282.db2.gz XQYIJDZAHRUDCC-WOJBJXKFSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)CCN1Cc1ccccc1 ZINC001468705922 1396981541 /nfs/dbraw/zinc/98/15/41/1396981541.db2.gz ZFXOBQQIONMYKB-GSEOLPGOSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)CCN1Cc1ccccc1 ZINC001468705922 1396981547 /nfs/dbraw/zinc/98/15/47/1396981547.db2.gz ZFXOBQQIONMYKB-GSEOLPGOSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@H](CC1CCCCC1)NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001469985375 1397062889 /nfs/dbraw/zinc/06/28/89/1397062889.db2.gz NKVOSHKORAKVFH-SJORKVTESA-N 1 3 340.556 2.917 10 0 EFAEHO C[C@H](CC1CCCCC1)NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001469985375 1397062896 /nfs/dbraw/zinc/06/28/96/1397062896.db2.gz NKVOSHKORAKVFH-SJORKVTESA-N 1 3 340.556 2.917 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21 ZINC001470025135 1397067494 /nfs/dbraw/zinc/06/74/94/1397067494.db2.gz CCFXLXCYJHKUIB-ZSYWTGECSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21 ZINC001470025135 1397067503 /nfs/dbraw/zinc/06/75/03/1397067503.db2.gz CCFXLXCYJHKUIB-ZSYWTGECSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NC1(C2CCCCC2)CC1 ZINC001470772954 1397120371 /nfs/dbraw/zinc/12/03/71/1397120371.db2.gz SZKMIOOHQMFBHU-INIZCTEOSA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NC1(C2CCCCC2)CC1 ZINC001470772954 1397120378 /nfs/dbraw/zinc/12/03/78/1397120378.db2.gz SZKMIOOHQMFBHU-INIZCTEOSA-N 1 3 338.540 2.671 10 0 EFAEHO CC(C)CN(CC1CC[NH+](C)CC1)C(=O)CN(C)CC(C)(C)C ZINC001471403693 1397168448 /nfs/dbraw/zinc/16/84/48/1397168448.db2.gz PIPAUSCACVPZKW-UHFFFAOYSA-N 1 3 325.541 2.791 10 0 EFAEHO C[C@@H](CN1CCOCC1)CN1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001473148383 1397285353 /nfs/dbraw/zinc/28/53/53/1397285353.db2.gz XPLCWONJZKMFRL-PMACEKPBSA-N 1 3 337.552 2.543 10 0 EFAEHO C[NH+](C)[C@@H]1[C@H]2CN(CCCCCCCNC(=O)OC(C)(C)C)C[C@H]21 ZINC001473689966 1397321591 /nfs/dbraw/zinc/32/15/91/1397321591.db2.gz UHWRGJQBNAPGOA-FVQHAEBGSA-N 1 3 339.524 2.953 10 0 EFAEHO CN(C[C@H]1CCN1[C@H]1CCCc2ccccc21)C(=O)CC[NH+](C)C ZINC001479242868 1397635382 /nfs/dbraw/zinc/63/53/82/1397635382.db2.gz LJLIOVVDHKWTMU-MJGOQNOKSA-N 1 3 329.488 2.548 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@H]2CN(C)C(=O)C[C@@H]2CC[N@H+](C)C2)c1 ZINC001479260177 1397650528 /nfs/dbraw/zinc/65/05/28/1397650528.db2.gz HMYOJCVYKSZMGI-ICSRJNTNSA-N 1 3 343.515 2.678 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@H]2CN(C)C(=O)C[C@@H]2CC[N@@H+](C)C2)c1 ZINC001479260177 1397650533 /nfs/dbraw/zinc/65/05/33/1397650533.db2.gz HMYOJCVYKSZMGI-ICSRJNTNSA-N 1 3 343.515 2.678 10 0 EFAEHO CN(C[C@H]1CCN1[C@H]1CCc2ccccc21)C(=O)CCCC[NH+](C)C ZINC001479261613 1397651591 /nfs/dbraw/zinc/65/15/91/1397651591.db2.gz XTFASDBOLFMTGO-QUCCMNQESA-N 1 3 343.515 2.939 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@H]1C[C@@H](NCc2ccccc2F)C1 ZINC001479301664 1397672433 /nfs/dbraw/zinc/67/24/33/1397672433.db2.gz TVZJENQJDDURCS-JQHSSLGASA-N 1 3 347.478 2.685 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@H]1C[C@@H](NCc2ccccc2F)C1 ZINC001479301664 1397672441 /nfs/dbraw/zinc/67/24/41/1397672441.db2.gz TVZJENQJDDURCS-JQHSSLGASA-N 1 3 347.478 2.685 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2=CCCCC2)C1 ZINC001479346892 1397697602 /nfs/dbraw/zinc/69/76/02/1397697602.db2.gz JCUQDJUDTGUKKF-PBWTXFEYSA-N 1 3 333.520 2.844 10 0 EFAEHO Cc1ccc(CN[C@H]2C[C@H](CNC(=O)CC[NH+](C)C)C2)c(Cl)c1 ZINC001479393032 1397712794 /nfs/dbraw/zinc/71/27/94/1397712794.db2.gz AYIYAZHOZNQQLJ-KOMQPUFPSA-N 1 3 337.895 2.585 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+]CC[C@H]2CCCC2(F)F)C1 ZINC001479417084 1397720299 /nfs/dbraw/zinc/72/02/99/1397720299.db2.gz QPYOTXRFAOJECF-BZUAXINKSA-N 1 3 345.478 2.637 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccccc2C)C1 ZINC001479488387 1397735287 /nfs/dbraw/zinc/73/52/87/1397735287.db2.gz AXDUUFPDKVGEQJ-PKOBYXMFSA-N 1 3 331.504 2.711 10 0 EFAEHO CC[C@H](F)CN1CCC2(C[C@@H](C)N(C(=O)CC[N@H+](C)CC)C2)CC1 ZINC001479500413 1397738705 /nfs/dbraw/zinc/73/87/05/1397738705.db2.gz FDWVCQFFGSGEBK-SJORKVTESA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](F)CN1CCC2(C[C@@H](C)N(C(=O)CC[N@@H+](C)CC)C2)CC1 ZINC001479500413 1397738706 /nfs/dbraw/zinc/73/87/06/1397738706.db2.gz FDWVCQFFGSGEBK-SJORKVTESA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CCCC[NH+](C)C)CCN1CCC(F)(F)F ZINC001479645085 1397759477 /nfs/dbraw/zinc/75/94/77/1397759477.db2.gz IEKULGXCQNCSBQ-UONOGXRCSA-N 1 3 337.430 2.640 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CCCC[NH+](C)C)CCN1Cc1ncccc1C ZINC001479645351 1397759502 /nfs/dbraw/zinc/75/95/02/1397759502.db2.gz OXNVVFOPMYRZNJ-PKOBYXMFSA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001479774693 1397840005 /nfs/dbraw/zinc/84/00/05/1397840005.db2.gz IPQITFLOZQONEL-KRWDZBQOSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001479774693 1397840013 /nfs/dbraw/zinc/84/00/13/1397840013.db2.gz IPQITFLOZQONEL-KRWDZBQOSA-N 1 3 331.504 2.978 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)C[C@@H]1CCc2ccccc2C1)N(C)C ZINC001479797174 1397876769 /nfs/dbraw/zinc/87/67/69/1397876769.db2.gz VKYYHJFLHUDDCC-XLIONFOSSA-N 1 3 345.531 2.570 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)C[C@@H]1CCc2ccccc2C1)N(C)C ZINC001479797174 1397876774 /nfs/dbraw/zinc/87/67/74/1397876774.db2.gz VKYYHJFLHUDDCC-XLIONFOSSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)NCCCN(C)CCC(F)(F)F ZINC001479799969 1397884510 /nfs/dbraw/zinc/88/45/10/1397884510.db2.gz FFLCTMFBYDNCNQ-CQSZACIVSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)NCCCN(C)CCC(F)(F)F ZINC001479799969 1397884514 /nfs/dbraw/zinc/88/45/14/1397884514.db2.gz FFLCTMFBYDNCNQ-CQSZACIVSA-N 1 3 337.430 2.640 10 0 EFAEHO O=C(NCCCN(Cc1ccsc1)C1CC1)[C@@H]1C[NH+]2CCC1CC2 ZINC001479868538 1397976955 /nfs/dbraw/zinc/97/69/55/1397976955.db2.gz ICTCWXYFSJHPTG-GOSISDBHSA-N 1 3 347.528 2.561 10 0 EFAEHO CN(C)C1(C(=O)N(C)C2CC[NH+](C[C@@H]3CC[C@H]4C[C@H]4C3)CC2)CCC1 ZINC001479889253 1398002838 /nfs/dbraw/zinc/00/28/38/1398002838.db2.gz XIDNMVVCFYJAFZ-FGTMMUONSA-N 1 3 347.547 2.830 10 0 EFAEHO CN(C)C1(C(=O)N(C)C2CC[NH+](C[C@@H]3CC[C@@H]4C[C@@H]4C3)CC2)CCC1 ZINC001479889254 1398003175 /nfs/dbraw/zinc/00/31/75/1398003175.db2.gz XIDNMVVCFYJAFZ-KURKYZTESA-N 1 3 347.547 2.830 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCN(CC2=CCCCC2)C1)[NH+]1CCCC1 ZINC001479973142 1398058806 /nfs/dbraw/zinc/05/88/06/1398058806.db2.gz XMPDVSBNYGZFOI-RBUKOAKNSA-N 1 3 333.520 2.798 10 0 EFAEHO CC(C)(C(=O)NC[C@H]([NH2+]Cc1ccsc1)C1CC1)N1CCCCC1 ZINC001480022227 1398098030 /nfs/dbraw/zinc/09/80/30/1398098030.db2.gz WDVNSICTAMTUSW-KRWDZBQOSA-N 1 3 349.544 2.997 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1ccc(F)cc1)C1CC1 ZINC001480023616 1398100072 /nfs/dbraw/zinc/10/00/72/1398100072.db2.gz GQBZOANEXQKDQX-RTBURBONSA-N 1 3 347.478 2.685 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]([NH2+]CCC1CCCCC1)C1CC1 ZINC001480063506 1398108430 /nfs/dbraw/zinc/10/84/30/1398108430.db2.gz QMIUXWYUJPWLTI-GOSISDBHSA-N 1 3 332.492 2.715 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001480160599 1398133724 /nfs/dbraw/zinc/13/37/24/1398133724.db2.gz DLZIFYMUVSBKRB-SYQHCUMBSA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001480160599 1398133728 /nfs/dbraw/zinc/13/37/28/1398133728.db2.gz DLZIFYMUVSBKRB-SYQHCUMBSA-N 1 3 346.302 2.559 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2)C1 ZINC001480173918 1398143161 /nfs/dbraw/zinc/14/31/61/1398143161.db2.gz PIWRGNPHJHCXQE-MXVIHJGJSA-N 1 3 339.483 2.917 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CCCCCF)N(C)C ZINC001480182334 1398151222 /nfs/dbraw/zinc/15/12/22/1398151222.db2.gz PAUVDDBULDHVDY-HMQMGEFJSA-N 1 3 327.488 2.578 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCCCF)N(C)C ZINC001480182334 1398151228 /nfs/dbraw/zinc/15/12/28/1398151228.db2.gz PAUVDDBULDHVDY-HMQMGEFJSA-N 1 3 327.488 2.578 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@H]1C[NH2+]CCc1cccs1)N(C)C ZINC001480365577 1398180172 /nfs/dbraw/zinc/18/01/72/1398180172.db2.gz VKMKMIHDUYMCOP-DOTOQJQBSA-N 1 3 337.533 2.602 10 0 EFAEHO C[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CC(C)(C)C1 ZINC001480536868 1398198768 /nfs/dbraw/zinc/19/87/68/1398198768.db2.gz KJKGKYGKPQWEIF-KUHUBIRLSA-N 1 3 341.515 2.729 10 0 EFAEHO C[C@H](CNC(=O)[C@@H](C)[NH+]1CCCCCC1)NCc1ccccc1F ZINC001480548824 1398202504 /nfs/dbraw/zinc/20/25/04/1398202504.db2.gz OOLSRTNJLGUOAY-HZPDHXFCSA-N 1 3 335.467 2.685 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001480548320 1398202633 /nfs/dbraw/zinc/20/26/33/1398202633.db2.gz JRXGPHTZZFWQSP-QAPCUYQASA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H]([NH2+]CC/C=C/c2ccccc2)C1)N(C)C ZINC001480623596 1398253507 /nfs/dbraw/zinc/25/35/07/1398253507.db2.gz AUBJLJUCNQIFPB-IJQANDGASA-N 1 3 343.515 2.867 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCC[C@@H](NC(=O)CN(C)C(C)C)C2)c(C)n1 ZINC001480710867 1398303705 /nfs/dbraw/zinc/30/37/05/1398303705.db2.gz UCVCGAMWWJMWHH-RTBURBONSA-N 1 3 346.519 2.556 10 0 EFAEHO CC/C=C\CC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)CCC)C[C@H]21 ZINC001507361842 1406952935 /nfs/dbraw/zinc/95/29/35/1406952935.db2.gz DDJYSKAJBVPMFT-YSNLUETFSA-N 1 3 335.536 2.901 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCN(Cc2cccc(F)c2)C1)[NH+](CC)CC ZINC001493237763 1398554409 /nfs/dbraw/zinc/55/44/09/1398554409.db2.gz SOJHOXIDVMZKRY-PKOBYXMFSA-N 1 3 349.494 2.884 10 0 EFAEHO CCCN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)Cc1ccc(F)cc1C ZINC001493324549 1398615088 /nfs/dbraw/zinc/61/50/88/1398615088.db2.gz AKUXWGAUPTYHKE-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO CCCN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)Cc1ccc(F)cc1C ZINC001493324549 1398615093 /nfs/dbraw/zinc/61/50/93/1398615093.db2.gz AKUXWGAUPTYHKE-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO CCC[N@H+](CCNC(=O)Cc1nc[nH]c1C)[C@H]1CCc2ccccc21 ZINC001493331523 1398619361 /nfs/dbraw/zinc/61/93/61/1398619361.db2.gz TVQCXBVDJWEWPW-IBGZPJMESA-N 1 3 340.471 2.776 10 0 EFAEHO CCC[N@@H+](CCNC(=O)Cc1nc[nH]c1C)[C@H]1CCc2ccccc21 ZINC001493331523 1398619363 /nfs/dbraw/zinc/61/93/63/1398619363.db2.gz TVQCXBVDJWEWPW-IBGZPJMESA-N 1 3 340.471 2.776 10 0 EFAEHO C[NH+](C)CCC(=O)NCCN(C1CC1)[C@H]1CCc2c1cccc2Cl ZINC001493408031 1398682398 /nfs/dbraw/zinc/68/23/98/1398682398.db2.gz TZWWYUWZOHWIHM-SFHVURJKSA-N 1 3 349.906 2.860 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+]([C@H](C)c1ccc(F)cc1)C1CC1 ZINC001493450664 1398716875 /nfs/dbraw/zinc/71/68/75/1398716875.db2.gz VCVMUUNHFOSEMM-OAHLLOKOSA-N 1 3 335.467 2.808 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+]([C@H](C)c1ccc(F)cc1)C1CC1 ZINC001493450664 1398716882 /nfs/dbraw/zinc/71/68/82/1398716882.db2.gz VCVMUUNHFOSEMM-OAHLLOKOSA-N 1 3 335.467 2.808 10 0 EFAEHO Cc1cccc([C@@H](C)[N@@H+](CCNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001493451315 1398717934 /nfs/dbraw/zinc/71/79/34/1398717934.db2.gz YWIFGVXFPMOZDM-QGZVFWFLSA-N 1 3 331.504 2.977 10 0 EFAEHO Cc1cccc([C@@H](C)[N@H+](CCNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001493451315 1398717937 /nfs/dbraw/zinc/71/79/37/1398717937.db2.gz YWIFGVXFPMOZDM-QGZVFWFLSA-N 1 3 331.504 2.977 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+]CC[C@@H]2CCc3ccccc32)CCC1 ZINC001493575007 1398758885 /nfs/dbraw/zinc/75/88/85/1398758885.db2.gz QFYHPJMZYWIRHZ-SFHVURJKSA-N 1 3 343.515 2.639 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001493845413 1398918359 /nfs/dbraw/zinc/91/83/59/1398918359.db2.gz XOVXAZPNFYMVTM-FUHWJXTLSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)N1C[C@H]2CC[C@@H](C1)N2CCCCCF ZINC001493931031 1398982929 /nfs/dbraw/zinc/98/29/29/1398982929.db2.gz ZIENISZSDOPDHJ-XLAORIBOSA-N 1 3 339.499 2.674 10 0 EFAEHO CC[NH2+][C@@H](CCNC(=O)[C@@H]1CCCCN1CC)Cc1ccccc1 ZINC001507388661 1407000802 /nfs/dbraw/zinc/00/08/02/1407000802.db2.gz IIBUJZNJZBLYJK-OALUTQOASA-N 1 3 331.504 2.588 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@@H](CCNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001494056832 1399097734 /nfs/dbraw/zinc/09/77/34/1399097734.db2.gz XZNZIWBUUDIBLY-RBUKOAKNSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@@H](CCNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001494056832 1399097735 /nfs/dbraw/zinc/09/77/35/1399097735.db2.gz XZNZIWBUUDIBLY-RBUKOAKNSA-N 1 3 343.515 2.665 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001494178960 1399192298 /nfs/dbraw/zinc/19/22/98/1399192298.db2.gz OIZKXQQAWZJMDZ-ZWKOTPCHSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001494178960 1399192302 /nfs/dbraw/zinc/19/23/02/1399192302.db2.gz OIZKXQQAWZJMDZ-ZWKOTPCHSA-N 1 3 325.541 2.789 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CC[C@@H](C[NH2+]CCCC2CCC2)C1 ZINC001507418148 1407032312 /nfs/dbraw/zinc/03/23/12/1407032312.db2.gz BSYUPUMXVOZXIM-SJORKVTESA-N 1 3 332.492 2.715 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]C/C=C/c1ccccc1 ZINC001495057103 1399632865 /nfs/dbraw/zinc/63/28/65/1399632865.db2.gz DGHZFBFFFLUYJK-FFRPFHMCSA-N 1 3 329.488 2.526 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@](C)(NC(=O)CN2CC[C@@H](C)C2)C2CC2)c1 ZINC001495277847 1399787371 /nfs/dbraw/zinc/78/73/71/1399787371.db2.gz RIUFHDVHOOMBGF-DYESRHJHSA-N 1 3 343.515 2.711 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N[C@@](C)(CNCc2ccccc2F)C2CC2)C1 ZINC001495294875 1399800851 /nfs/dbraw/zinc/80/08/51/1399800851.db2.gz VWXLNCOREVQGTO-QRWLVFNGSA-N 1 3 347.478 2.542 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N[C@@](C)(CNCc2ccccc2F)C2CC2)C1 ZINC001495294875 1399800862 /nfs/dbraw/zinc/80/08/62/1399800862.db2.gz VWXLNCOREVQGTO-QRWLVFNGSA-N 1 3 347.478 2.542 10 0 EFAEHO CCC[NH2+]CCC1CCN(C(=O)c2cccc(CN(C)C)c2)CC1 ZINC001495445860 1399985655 /nfs/dbraw/zinc/98/56/55/1399985655.db2.gz SMRKTUOLMGDUEH-UHFFFAOYSA-N 1 3 331.504 2.990 10 0 EFAEHO O=C(CN1CCCC1)N1CCC(CC[NH2+]CC2CC3(CCC3)C2)CC1 ZINC001495446304 1399985860 /nfs/dbraw/zinc/98/58/60/1399985860.db2.gz VIUGCXVMTAFIIE-UHFFFAOYSA-N 1 3 347.547 2.881 10 0 EFAEHO CC(C)C[NH2+]Cc1ccc(CNC(=O)CN2[C@@H](C)CC[C@@H]2C)cc1 ZINC001495508984 1400040597 /nfs/dbraw/zinc/04/05/97/1400040597.db2.gz LDWKENXIZNVDSD-IRXDYDNUSA-N 1 3 331.504 2.921 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]1C[NH2+]C/C=C/c1ccccc1)C1CCC1 ZINC001495562262 1400083981 /nfs/dbraw/zinc/08/39/81/1400083981.db2.gz PUJPBOKGMCYDDA-CLOLKSBNSA-N 1 3 341.499 2.765 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]C[C@@H]2CCC(F)(F)C2)CCCC1 ZINC001495963610 1400386508 /nfs/dbraw/zinc/38/65/08/1400386508.db2.gz LSBWKANKUOSYGS-OAHLLOKOSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)=CC[NH+]1CC2(C1)CCN(C(=O)CN(C)CC(C)(C)C)CC2 ZINC001495978388 1400394686 /nfs/dbraw/zinc/39/46/86/1400394686.db2.gz OGHAVDCNLPKGAY-UHFFFAOYSA-N 1 3 335.536 2.855 10 0 EFAEHO C[C@H](CNCC=C(Cl)Cl)N(C)C(=O)C12CCC[NH+](CCC1)C2 ZINC001496095500 1400467639 /nfs/dbraw/zinc/46/76/39/1400467639.db2.gz DTBZTFDHWDRDJS-CYBMUJFWSA-N 1 3 348.318 2.618 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](C)N(C)C(=O)[C@@H]1CC[N@H+](C)C1 ZINC001496230379 1400556627 /nfs/dbraw/zinc/55/66/27/1400556627.db2.gz VKTXNWCJJBSXSG-LSDHHAIUSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](C)N(C)C(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001496230379 1400556633 /nfs/dbraw/zinc/55/66/33/1400556633.db2.gz VKTXNWCJJBSXSG-LSDHHAIUSA-N 1 3 337.895 2.537 10 0 EFAEHO C[C@H](C[NH2+]CCC(F)(F)F)N(C)C(=O)c1cccc(CN(C)C)c1 ZINC001496239076 1400564227 /nfs/dbraw/zinc/56/42/27/1400564227.db2.gz PHXQBNSAXCZYEU-CYBMUJFWSA-N 1 3 345.409 2.751 10 0 EFAEHO CC(C)C[C@@H](CNCc1ccccn1)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001496287100 1400602553 /nfs/dbraw/zinc/60/25/53/1400602553.db2.gz ZQKWWZIQDSSCON-SFHVURJKSA-N 1 3 346.519 2.577 10 0 EFAEHO C[C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)CC[C@@H]1[NH2+]CCCF ZINC001496368954 1400678440 /nfs/dbraw/zinc/67/84/40/1400678440.db2.gz JCXXQTRFZWBARA-QAPCUYQASA-N 1 3 335.467 2.548 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)cc1 ZINC001496730491 1400945738 /nfs/dbraw/zinc/94/57/38/1400945738.db2.gz HFPNZFMGUVRBCK-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)cc1 ZINC001496730491 1400945741 /nfs/dbraw/zinc/94/57/41/1400945741.db2.gz HFPNZFMGUVRBCK-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC001496866311 1401062310 /nfs/dbraw/zinc/06/23/10/1401062310.db2.gz GSHAGZQYHTYKIC-MJGOQNOKSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2Cc2ccc(F)cc2)C1 ZINC001496866311 1401062318 /nfs/dbraw/zinc/06/23/18/1401062318.db2.gz GSHAGZQYHTYKIC-MJGOQNOKSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]CCc1ccccc1F ZINC001497186267 1401206501 /nfs/dbraw/zinc/20/65/01/1401206501.db2.gz LICJSXBPDPCCNK-LPHOPBHVSA-N 1 3 349.494 2.725 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]CCc1ccccc1F ZINC001497186269 1401206697 /nfs/dbraw/zinc/20/66/97/1401206697.db2.gz LICJSXBPDPCCNK-VQIMIIECSA-N 1 3 349.494 2.725 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001497205753 1401218470 /nfs/dbraw/zinc/21/84/70/1401218470.db2.gz LYRJJNWLLAOJLO-PBHICJAKSA-N 1 3 339.911 2.911 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1C ZINC001497271147 1401261019 /nfs/dbraw/zinc/26/10/19/1401261019.db2.gz JRVUUEIWUBIJOS-QAPCUYQASA-N 1 3 331.504 2.630 10 0 EFAEHO Cc1ncccc1C[NH2+]CC[C@@H](C)NC(=O)[C@H]1CCCCN1C(C)C ZINC001497277168 1401265096 /nfs/dbraw/zinc/26/50/96/1401265096.db2.gz QHBVOUSBOARUJK-VQIMIIECSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1ncccc1C[NH2+]CC[C@H](C)NC(=O)[C@@H]1CCCCN1C(C)C ZINC001497277162 1401265186 /nfs/dbraw/zinc/26/51/86/1401265186.db2.gz QHBVOUSBOARUJK-LPHOPBHVSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1ncccc1C[NH2+]CC[C@@H](C)NC(=O)[C@@H]1CCCCN1C(C)C ZINC001497277159 1401265270 /nfs/dbraw/zinc/26/52/70/1401265270.db2.gz QHBVOUSBOARUJK-APWZRJJASA-N 1 3 346.519 2.637 10 0 EFAEHO CCN(CCNCc1ccccc1F)C(=O)C[N@H+](C)CC(C)(C)C ZINC001497454071 1401386598 /nfs/dbraw/zinc/38/65/98/1401386598.db2.gz HOPLYYOROQXWNT-UHFFFAOYSA-N 1 3 337.483 2.742 10 0 EFAEHO CCN(CCNCc1ccccc1F)C(=O)C[N@@H+](C)CC(C)(C)C ZINC001497454071 1401386603 /nfs/dbraw/zinc/38/66/03/1401386603.db2.gz HOPLYYOROQXWNT-UHFFFAOYSA-N 1 3 337.483 2.742 10 0 EFAEHO CCc1ccc(C[NH2+]CCN(CC)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001497454712 1401387288 /nfs/dbraw/zinc/38/72/88/1401387288.db2.gz MIYJIAOJXOVLHG-QGZVFWFLSA-N 1 3 331.504 2.529 10 0 EFAEHO CCN(CC[NH2+]CC1CCCCCC1)C(=O)[C@H](C(C)C)N(C)C ZINC001497486268 1401411554 /nfs/dbraw/zinc/41/15/54/1401411554.db2.gz NECFJZUJQZLNCD-SFHVURJKSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C(=O)N(CC)CC[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001497486971 1401411583 /nfs/dbraw/zinc/41/15/83/1401411583.db2.gz SRTBTOGDSMEZHH-ZDUSSCGKSA-N 1 3 331.913 2.680 10 0 EFAEHO CCN(CCNCc1cccnc1)C(=O)[C@@H](C(C)C)[NH+]1CCCCC1 ZINC001497501285 1401423667 /nfs/dbraw/zinc/42/36/67/1401423667.db2.gz QUPIEOVLYUHSJY-LJQANCHMSA-N 1 3 346.519 2.530 10 0 EFAEHO CCN(CC[NH2+]C[C@@H]1CCC(F)(F)C1)C(=O)[C@@H]1CCCCN1CC ZINC001497501263 1401423679 /nfs/dbraw/zinc/42/36/79/1401423679.db2.gz QKTPXYJKCOFUAH-CVEARBPZSA-N 1 3 345.478 2.734 10 0 EFAEHO O=C(NC/C=C/CNCc1ccsc1)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001497612104 1401493602 /nfs/dbraw/zinc/49/36/02/1401493602.db2.gz NEZRTBOOBDIFRI-JQBWTISXSA-N 1 3 333.501 2.527 10 0 EFAEHO O=C(NC/C=C/CNCc1ccsc1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001497612104 1401493610 /nfs/dbraw/zinc/49/36/10/1401493610.db2.gz NEZRTBOOBDIFRI-JQBWTISXSA-N 1 3 333.501 2.527 10 0 EFAEHO Cc1ccc(CNC/C=C\CNC(=O)C(C)(C)[NH+]2CCCC2)cc1F ZINC001497659986 1401529049 /nfs/dbraw/zinc/52/90/49/1401529049.db2.gz ZRWSLLDSLOGLMU-PLNGDYQASA-N 1 3 347.478 2.771 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)NC/C=C/CNCc1ccc(F)cc1 ZINC001497690564 1401554348 /nfs/dbraw/zinc/55/43/48/1401554348.db2.gz GYNUTXDBYMLTAU-VZSQWMKGSA-N 1 3 347.478 2.851 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)NC/C=C/CNCc1ccc(F)cc1 ZINC001497690564 1401554351 /nfs/dbraw/zinc/55/43/51/1401554351.db2.gz GYNUTXDBYMLTAU-VZSQWMKGSA-N 1 3 347.478 2.851 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC/C=C\C[NH2+]CC[C@@H]1CCC[C@@H](C)C1 ZINC001497734869 1401594316 /nfs/dbraw/zinc/59/43/16/1401594316.db2.gz SXPZFTHGUKERLV-MXTKCAFNSA-N 1 3 332.492 2.739 10 0 EFAEHO CC(C)N(C)CC(=O)NC/C=C\C[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001497765667 1401636999 /nfs/dbraw/zinc/63/69/99/1401636999.db2.gz SXFODWAQGMSOIE-PYTPGESOSA-N 1 3 349.906 2.930 10 0 EFAEHO C[C@H](C[NH2+]C/C=C\c1ccc(Cl)cc1)NC(=O)CN(C)C1CCC1 ZINC001497830153 1401682493 /nfs/dbraw/zinc/68/24/93/1401682493.db2.gz WLASHHKNVHYFPW-FOSCPCJNSA-N 1 3 349.906 2.932 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001497831527 1401683438 /nfs/dbraw/zinc/68/34/38/1401683438.db2.gz OQDODJWOHQRKAS-GDBMZVCRSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001497831527 1401683443 /nfs/dbraw/zinc/68/34/43/1401683443.db2.gz OQDODJWOHQRKAS-GDBMZVCRSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CC2)cc1)NC(=O)CN(C)C1CCC1 ZINC001498053375 1401832848 /nfs/dbraw/zinc/83/28/48/1401832848.db2.gz KUDXGBINVQXYRS-HNNXBMFYSA-N 1 3 329.488 2.643 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H](C)NC(=O)[C@H]2CCCCN2C(C)C)cs1 ZINC001498133777 1401871969 /nfs/dbraw/zinc/87/19/69/1401871969.db2.gz YOCJMUOKSXWZOS-WMLDXEAASA-N 1 3 337.533 2.914 10 0 EFAEHO CCCc1ccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)cc1 ZINC001498288692 1401979133 /nfs/dbraw/zinc/97/91/33/1401979133.db2.gz NDOMWBQKYSZIMX-MBOZVWFJSA-N 1 3 345.531 2.916 10 0 EFAEHO CCCc1ccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1 ZINC001498288692 1401979138 /nfs/dbraw/zinc/97/91/38/1401979138.db2.gz NDOMWBQKYSZIMX-MBOZVWFJSA-N 1 3 345.531 2.916 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+]CCc1ccccc1)C(C)(C)C)C1CCC1 ZINC001507950432 1407221060 /nfs/dbraw/zinc/22/10/60/1407221060.db2.gz FGWZWDULLJYTNB-IBGZPJMESA-N 1 3 345.531 2.834 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)C[C@@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001498354907 1402033171 /nfs/dbraw/zinc/03/31/71/1402033171.db2.gz GMRMLPMMDDFYEG-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)C[C@@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001498354907 1402033174 /nfs/dbraw/zinc/03/31/74/1402033174.db2.gz GMRMLPMMDDFYEG-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](C[N@H+](C)CC1CCCC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001498380186 1402053517 /nfs/dbraw/zinc/05/35/17/1402053517.db2.gz FIWFERFXNMZVCF-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC1CCCC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001498380186 1402053522 /nfs/dbraw/zinc/05/35/22/1402053522.db2.gz FIWFERFXNMZVCF-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H](CN(C)[C@H]1CCc2ccc(F)cc21)NC(=O)CCCC[NH+](C)C ZINC001498426790 1402093072 /nfs/dbraw/zinc/09/30/72/1402093072.db2.gz DQMHMBMSQFYNOX-BEFAXECRSA-N 1 3 349.494 2.981 10 0 EFAEHO C[C@H](CN(C)C/C=C/c1ccc(Cl)cc1)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001498450471 1402114508 /nfs/dbraw/zinc/11/45/08/1402114508.db2.gz PQWHMHGJIXGLNZ-LUJIMGINSA-N 1 3 349.906 2.741 10 0 EFAEHO C[C@H](CN(C)C/C=C/c1ccc(Cl)cc1)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001498450471 1402114510 /nfs/dbraw/zinc/11/45/10/1402114510.db2.gz PQWHMHGJIXGLNZ-LUJIMGINSA-N 1 3 349.906 2.741 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+]Cc1cc(F)ccc1Cl ZINC001723204568 1424451664 /nfs/dbraw/zinc/45/16/64/1424451664.db2.gz SBNBWQDGKJSXSO-UHFFFAOYSA-N 1 3 343.874 2.757 10 0 EFAEHO CN(CCC[NH2+][C@H]1CCc2c1cccc2Cl)C(=O)[C@@H]1CCCN1C ZINC001498525733 1402160935 /nfs/dbraw/zinc/16/09/35/1402160935.db2.gz DSMTXACBZVISPN-ROUUACIJSA-N 1 3 349.906 2.860 10 0 EFAEHO CN(CCC[NH2+][C@H]1CCc2c1cccc2F)C(=O)CN(C)C1CCC1 ZINC001498559572 1402175465 /nfs/dbraw/zinc/17/54/65/1402175465.db2.gz IXTAOVHYMAQIEN-IBGZPJMESA-N 1 3 347.478 2.735 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CCCN(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001498612972 1402202477 /nfs/dbraw/zinc/20/24/77/1402202477.db2.gz NVCYNWLWUVLYSF-MRXNPFEDSA-N 1 3 331.504 2.583 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC001498656836 1402231701 /nfs/dbraw/zinc/23/17/01/1402231701.db2.gz AXIHQSWJRTXKLW-CQSZACIVSA-N 1 3 341.446 2.804 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C[NH2+]CCc1ccccc1)C1CC1 ZINC001498761823 1402273422 /nfs/dbraw/zinc/27/34/22/1402273422.db2.gz SMMFKLDJFGULHP-UXHICEINSA-N 1 3 343.515 2.586 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H](NC(=O)CN(C)C2CCC2)C2CC2)c1 ZINC001498770540 1402279422 /nfs/dbraw/zinc/27/94/22/1402279422.db2.gz NZIPUDMONIQKJT-LJQANCHMSA-N 1 3 347.478 2.603 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]Cc1ccc(F)cc1)C(C)(C)C ZINC001508036524 1407257076 /nfs/dbraw/zinc/25/70/76/1407257076.db2.gz QNCFMUXJMIYSQQ-QGZVFWFLSA-N 1 3 337.483 2.786 10 0 EFAEHO C[C@H](NC1(CNC(=O)CC[C@H]2CCC[N@@H+]2C)CC1)c1cccc(F)c1 ZINC001499253689 1402539183 /nfs/dbraw/zinc/53/91/83/1402539183.db2.gz GQXBXJDNXSJHBW-MAUKXSAKSA-N 1 3 347.478 3.000 10 0 EFAEHO C[C@H](NC1(CNC(=O)CC[C@H]2CCC[N@H+]2C)CC1)c1cccc(F)c1 ZINC001499253689 1402539188 /nfs/dbraw/zinc/53/91/88/1402539188.db2.gz GQXBXJDNXSJHBW-MAUKXSAKSA-N 1 3 347.478 3.000 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCC1(NC/C=C\c2ccccc2)CC1 ZINC001499253389 1402539398 /nfs/dbraw/zinc/53/93/98/1402539398.db2.gz BYKODIFKQHSCFN-FVXMCEBTSA-N 1 3 341.499 2.813 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCC1(NC/C=C\c2ccccc2)CC1 ZINC001499253389 1402539403 /nfs/dbraw/zinc/53/94/03/1402539403.db2.gz BYKODIFKQHSCFN-FVXMCEBTSA-N 1 3 341.499 2.813 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)NCC1(NCCC(F)(F)F)CC1 ZINC001499272530 1402546247 /nfs/dbraw/zinc/54/62/47/1402546247.db2.gz NRGAGJQMYHXEBN-UHFFFAOYSA-N 1 3 349.441 2.830 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)NCC1(NCCC(F)(F)F)CC1 ZINC001499272530 1402546251 /nfs/dbraw/zinc/54/62/51/1402546251.db2.gz NRGAGJQMYHXEBN-UHFFFAOYSA-N 1 3 349.441 2.830 10 0 EFAEHO C[C@H](NC1(CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)CC1)c1cccc(F)c1 ZINC001499331309 1402569092 /nfs/dbraw/zinc/56/90/92/1402569092.db2.gz SWJMDANECAJYOW-ZOBUZTSGSA-N 1 3 347.478 2.855 10 0 EFAEHO C[C@H](NC1(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)CC1)c1cccc(F)c1 ZINC001499331309 1402569095 /nfs/dbraw/zinc/56/90/95/1402569095.db2.gz SWJMDANECAJYOW-ZOBUZTSGSA-N 1 3 347.478 2.855 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@H+](C/C=C/Cl)C1 ZINC001499480467 1402635023 /nfs/dbraw/zinc/63/50/23/1402635023.db2.gz HCLFVIIHWNFFAX-QOCAVEGASA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@@H+](C/C=C/Cl)C1 ZINC001499480467 1402635025 /nfs/dbraw/zinc/63/50/25/1402635025.db2.gz HCLFVIIHWNFFAX-QOCAVEGASA-N 1 3 341.927 2.782 10 0 EFAEHO CC/C=C/CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)[C@H]1CCCN1C ZINC001499492319 1402640652 /nfs/dbraw/zinc/64/06/52/1402640652.db2.gz XCWZSNUBAZTKTB-RAFUSEJCSA-N 1 3 333.520 2.939 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)C1CCN(Cc2ccsc2)CC1 ZINC001508065989 1407276920 /nfs/dbraw/zinc/27/69/20/1407276920.db2.gz JWUIIPSTJSEKEH-OAHLLOKOSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)C1CCN(Cc2ccsc2)CC1 ZINC001508065989 1407276924 /nfs/dbraw/zinc/27/69/24/1407276924.db2.gz JWUIIPSTJSEKEH-OAHLLOKOSA-N 1 3 337.533 2.807 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C1CC[NH+](CCCCCF)CC1 ZINC001508070183 1407281449 /nfs/dbraw/zinc/28/14/49/1407281449.db2.gz ULHJXAAMUYXWLF-CQSZACIVSA-N 1 3 338.471 2.617 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCCC1)C1CC[NH+](CCCF)CC1 ZINC001508076665 1407282740 /nfs/dbraw/zinc/28/27/40/1407282740.db2.gz NLSCZGKBEHZIFN-INIZCTEOSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](F)CC[NH+]1CCC([C@H](C)NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001508080282 1407286340 /nfs/dbraw/zinc/28/63/40/1407286340.db2.gz ACVGKKMGGFDXSC-HOTGVXAUSA-N 1 3 343.531 2.929 10 0 EFAEHO CC(C)(C(=O)N1CCC[C@H]1CNCC=C(Cl)Cl)[NH+]1CCCC1 ZINC001499916999 1402852888 /nfs/dbraw/zinc/85/28/88/1402852888.db2.gz YLIFQKBTDLYVPL-ZDUSSCGKSA-N 1 3 348.318 2.760 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]C[C@@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001499955922 1402869636 /nfs/dbraw/zinc/86/96/36/1402869636.db2.gz ZQHJPEPJWKKDSA-MJGOQNOKSA-N 1 3 331.504 2.977 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]C[C@@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001499955921 1402869793 /nfs/dbraw/zinc/86/97/93/1402869793.db2.gz ZQHJPEPJWKKDSA-HKUYNNGSSA-N 1 3 331.504 2.977 10 0 EFAEHO C[C@H](NC(=O)C[C@H]1CC[N@H+](C)C1)C1CCN(Cc2ccsc2)CC1 ZINC001508090041 1407292931 /nfs/dbraw/zinc/29/29/31/1407292931.db2.gz YUWAKPVHXCOYFQ-JKSUJKDBSA-N 1 3 349.544 2.807 10 0 EFAEHO C[C@H](NC(=O)C[C@H]1CC[N@@H+](C)C1)C1CCN(Cc2ccsc2)CC1 ZINC001508090041 1407292935 /nfs/dbraw/zinc/29/29/35/1407292935.db2.gz YUWAKPVHXCOYFQ-JKSUJKDBSA-N 1 3 349.544 2.807 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C[NH2+]CCC1CC1)C1CCCC1 ZINC001500089090 1402932902 /nfs/dbraw/zinc/93/29/02/1402932902.db2.gz RXNKVFGIMKBMIZ-RTBURBONSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H](NC(=O)C(C)(C)N1CCCC1)C1CCCC1 ZINC001500105027 1402938919 /nfs/dbraw/zinc/93/89/19/1402938919.db2.gz GHMODHMJSWLRJT-IRXDYDNUSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H](NC(=O)C(C)(C)N1CCCC1)C1CCCC1 ZINC001500105028 1402939229 /nfs/dbraw/zinc/93/92/29/1402939229.db2.gz GHMODHMJSWLRJT-SJORKVTESA-N 1 3 341.515 2.874 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@]2(CC[N@H+](C[C@@H](F)CC)C2)C1 ZINC001500161383 1402962081 /nfs/dbraw/zinc/96/20/81/1402962081.db2.gz KVBASCSNLDIRPZ-PKOBYXMFSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@]2(CC[N@@H+](C[C@@H](F)CC)C2)C1 ZINC001500161383 1402962085 /nfs/dbraw/zinc/96/20/85/1402962085.db2.gz KVBASCSNLDIRPZ-PKOBYXMFSA-N 1 3 341.515 2.781 10 0 EFAEHO CN(CC(=O)N1CC[C@](C)(C[NH2+]CC2CC(C)(C)C2)C1)C1CCC1 ZINC001500354722 1403071517 /nfs/dbraw/zinc/07/15/17/1403071517.db2.gz XZDUGENGHACFEN-HXUWFJFHSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@]1(C)CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001500405574 1403101605 /nfs/dbraw/zinc/10/16/05/1403101605.db2.gz ZEMHJQZQBOYPKN-UZLBHIALSA-N 1 3 349.494 2.938 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCC1(C)CCN(C/C=C/Cl)CC1 ZINC001500431182 1403118238 /nfs/dbraw/zinc/11/82/38/1403118238.db2.gz MQWRCFVWGYWXHA-WJXUGBSRSA-N 1 3 341.927 2.832 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCC1(C)CCN(C/C=C/Cl)CC1 ZINC001500431182 1403118244 /nfs/dbraw/zinc/11/82/44/1403118244.db2.gz MQWRCFVWGYWXHA-WJXUGBSRSA-N 1 3 341.927 2.832 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@]1(C)CCC[N@H+](CC2CCC2)C1 ZINC001500497809 1403171972 /nfs/dbraw/zinc/17/19/72/1403171972.db2.gz ASGFSCYEZHYCNY-ICSRJNTNSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@]1(C)CCC[N@@H+](CC2CCC2)C1 ZINC001500497809 1403171977 /nfs/dbraw/zinc/17/19/77/1403171977.db2.gz ASGFSCYEZHYCNY-ICSRJNTNSA-N 1 3 335.536 2.879 10 0 EFAEHO CCC(CC)C[N@@H+]1CCC[C@@](C)(CNC(=O)CN(C)C(C)C)C1 ZINC001500552539 1403218226 /nfs/dbraw/zinc/21/82/26/1403218226.db2.gz GUMBFTMVBBSWRL-IBGZPJMESA-N 1 3 325.541 2.981 10 0 EFAEHO CCC(CC)C[N@H+]1CCC[C@@](C)(CNC(=O)CN(C)C(C)C)C1 ZINC001500552539 1403218231 /nfs/dbraw/zinc/21/82/31/1403218231.db2.gz GUMBFTMVBBSWRL-IBGZPJMESA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]Cc2ccc3c(c2)CCC3)C1 ZINC001508155221 1407318128 /nfs/dbraw/zinc/31/81/28/1407318128.db2.gz NRGKVHSANZQXTN-UHFFFAOYSA-N 1 3 343.515 2.595 10 0 EFAEHO CCC[NH2+][C@@H](CNC(=O)CN1CC[C@H](C)C1)c1ccccc1CC ZINC001501021735 1403409702 /nfs/dbraw/zinc/40/97/02/1403409702.db2.gz JRLAZWGUGDZLEH-LPHOPBHVSA-N 1 3 331.504 2.748 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001501091120 1403436792 /nfs/dbraw/zinc/43/67/92/1403436792.db2.gz LDZZJSKIHZYGJP-MJGOQNOKSA-N 1 3 331.504 2.662 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H]2[C@H]1CC[N@@H+]2CC=C(C)C ZINC001501390246 1403582041 /nfs/dbraw/zinc/58/20/41/1403582041.db2.gz HVWOVLQAKOKCDK-OKZBNKHCSA-N 1 3 339.499 2.698 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H]2[C@H]1CC[N@H+]2CC=C(C)C ZINC001501390246 1403582042 /nfs/dbraw/zinc/58/20/42/1403582042.db2.gz HVWOVLQAKOKCDK-OKZBNKHCSA-N 1 3 339.499 2.698 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](CC[NH2+]CC2CCCCCC2)C1 ZINC001501548071 1403622101 /nfs/dbraw/zinc/62/21/01/1403622101.db2.gz PONKFUUGTBXLLY-OALUTQOASA-N 1 3 335.536 2.879 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](CC[NH2+]CC2=CCCCC2)C1)C1CCC1 ZINC001501579026 1403634694 /nfs/dbraw/zinc/63/46/94/1403634694.db2.gz VVXIJIRDIRCFSB-GOSISDBHSA-N 1 3 333.520 2.799 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC2(C1)CC[NH+](CCCCCF)CC2)N(C)C ZINC001501742329 1403758247 /nfs/dbraw/zinc/75/82/47/1403758247.db2.gz WYUVCCULSYTKAU-QGZVFWFLSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)[C@@H](C(C)C)[NH+]2CCCCC2)CCC1 ZINC001502028884 1403959430 /nfs/dbraw/zinc/95/94/30/1403959430.db2.gz DNRUIAAFEVSHLD-IAGOWNOFSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1CCC[C@@H](NC(=O)CN(C)C(C)C)CC1 ZINC001502147460 1404046892 /nfs/dbraw/zinc/04/68/92/1404046892.db2.gz JRDYFDWXIUCIMT-QZTJIDSGSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1CCC[C@@H](NC(=O)CN(C)C(C)C)CC1 ZINC001502147460 1404046896 /nfs/dbraw/zinc/04/68/96/1404046896.db2.gz JRDYFDWXIUCIMT-QZTJIDSGSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1cncc(CN(C)CCCN(C)C(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001502341781 1404083711 /nfs/dbraw/zinc/08/37/11/1404083711.db2.gz CXJFYVIEORIQEZ-LJQANCHMSA-N 1 3 346.519 2.545 10 0 EFAEHO Cc1cncc(CN(C)CCCN(C)C(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001502341781 1404083716 /nfs/dbraw/zinc/08/37/16/1404083716.db2.gz CXJFYVIEORIQEZ-LJQANCHMSA-N 1 3 346.519 2.545 10 0 EFAEHO CN(CCC[N@H+](C)CCCCC(F)(F)F)C(=O)[C@H]1CCCN1C ZINC001502363865 1404104076 /nfs/dbraw/zinc/10/40/76/1404104076.db2.gz SEICNHMLWAIPTI-CQSZACIVSA-N 1 3 337.430 2.594 10 0 EFAEHO CN(CCC[N@@H+](C)CCCCC(F)(F)F)C(=O)[C@H]1CCCN1C ZINC001502363865 1404104090 /nfs/dbraw/zinc/10/40/90/1404104090.db2.gz SEICNHMLWAIPTI-CQSZACIVSA-N 1 3 337.430 2.594 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H]2CCC[N@H+](CC3CC3)C2)C1 ZINC001502404906 1404145999 /nfs/dbraw/zinc/14/59/99/1404145999.db2.gz OUOMNXGIBCRNLB-RBUKOAKNSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H]2CCC[N@@H+](CC3CC3)C2)C1 ZINC001502404906 1404146003 /nfs/dbraw/zinc/14/60/03/1404146003.db2.gz OUOMNXGIBCRNLB-RBUKOAKNSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H]([NH2+]Cc2ccccc2C2CC2)C1 ZINC001502762060 1404330909 /nfs/dbraw/zinc/33/09/09/1404330909.db2.gz JYMRTZXAHMJIOV-UZLBHIALSA-N 1 3 343.515 2.841 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001502762062 1404331520 /nfs/dbraw/zinc/33/15/20/1404331520.db2.gz KBUUDRUGTQSGMV-LPHOPBHVSA-N 1 3 331.504 2.526 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]CC2CCC(C)(C)CC2)[C@@H](C)C1 ZINC001502762927 1404332553 /nfs/dbraw/zinc/33/25/53/1404332553.db2.gz YPMBZRIHOSIOPT-WMZOPIPTSA-N 1 3 337.552 2.980 10 0 EFAEHO CCCC[NH2+]C1(C)CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001502797889 1404350164 /nfs/dbraw/zinc/35/01/64/1404350164.db2.gz UWIVMLSLVNYRPT-LJQANCHMSA-N 1 3 341.515 2.970 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C)c(C)n1 ZINC001503022824 1404463383 /nfs/dbraw/zinc/46/33/83/1404463383.db2.gz GIXYCCVRRBWXRG-VQIMIIECSA-N 1 3 346.519 2.508 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C)c(C)n1 ZINC001503022824 1404463386 /nfs/dbraw/zinc/46/33/86/1404463386.db2.gz GIXYCCVRRBWXRG-VQIMIIECSA-N 1 3 346.519 2.508 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@@H]1c2ccccc2CCN1CC1CC1 ZINC001503692823 1404500864 /nfs/dbraw/zinc/50/08/64/1404500864.db2.gz XONLVINVKNSRHL-HXUWFJFHSA-N 1 3 343.515 2.844 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@H]1c2ccccc2CCN1CC1CC1 ZINC001503692821 1404501167 /nfs/dbraw/zinc/50/11/67/1404501167.db2.gz XONLVINVKNSRHL-FQEVSTJZSA-N 1 3 343.515 2.844 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@H]1C[NH2+]C/C=C/c1ccccc1 ZINC001505403570 1404559284 /nfs/dbraw/zinc/55/92/84/1404559284.db2.gz SFQLTQUMLPRYQR-DVFNVHRYSA-N 1 3 341.499 2.765 10 0 EFAEHO O=C([C@H]1CC[N@@H+](C2CCCCC2)C1)N1CCCC[C@H]1CNCCF ZINC001505404781 1404561918 /nfs/dbraw/zinc/56/19/18/1404561918.db2.gz NSFLIETXBFRUBZ-WMZOPIPTSA-N 1 3 339.499 2.581 10 0 EFAEHO O=C([C@H]1CC[N@H+](C2CCCCC2)C1)N1CCCC[C@H]1CNCCF ZINC001505404781 1404561922 /nfs/dbraw/zinc/56/19/22/1404561922.db2.gz NSFLIETXBFRUBZ-WMZOPIPTSA-N 1 3 339.499 2.581 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CCCF ZINC001505414736 1404573711 /nfs/dbraw/zinc/57/37/11/1404573711.db2.gz RKGNPDMLRZZZTD-CEXWTWQISA-N 1 3 347.478 2.592 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CCCF)N1CCCC1 ZINC001505415933 1404576727 /nfs/dbraw/zinc/57/67/27/1404576727.db2.gz YXXUCIJQXBFWNO-QZTJIDSGSA-N 1 3 347.478 2.592 10 0 EFAEHO CC(C)CCC[NH2+][C@H]1CCN(C(=O)CN(C)CC(C)(C)C)[C@@H]1C ZINC001725561262 1425649300 /nfs/dbraw/zinc/64/93/00/1425649300.db2.gz ASQZBZWZLPJTGE-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1CC(C[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001505531164 1404744395 /nfs/dbraw/zinc/74/43/95/1404744395.db2.gz SGQCLNFCPUONDS-JCYILVPMSA-N 1 3 325.541 2.883 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]CC2CC(NC(=O)CN(C)C(C)C)C2)c1 ZINC001505537900 1404748779 /nfs/dbraw/zinc/74/87/79/1404748779.db2.gz PGADJEUYORHLPA-HJOIGYKYSA-N 1 3 347.503 2.581 10 0 EFAEHO C[C@H](NCC=C(Cl)Cl)[C@H](C)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001505667369 1404915579 /nfs/dbraw/zinc/91/55/79/1404915579.db2.gz LOKJYFUURUNALI-RYUDHWBXSA-N 1 3 336.307 2.663 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H](C)[C@@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001505668370 1404916185 /nfs/dbraw/zinc/91/61/85/1404916185.db2.gz XJQCLJMMROXKQA-JKSUJKDBSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H](C)[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001505668367 1404916205 /nfs/dbraw/zinc/91/62/05/1404916205.db2.gz XJQCLJMMROXKQA-CVEARBPZSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@@H](NC(=O)CC[NH+](C)C)[C@H](C)NCc1ccc(Cl)cc1Cl ZINC001505686052 1404937404 /nfs/dbraw/zinc/93/74/04/1404937404.db2.gz LFYYVWCOTNLIGV-NWDGAFQWSA-N 1 3 346.302 2.928 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)CC(C)(C)C)cc1 ZINC001505694211 1404948140 /nfs/dbraw/zinc/94/81/40/1404948140.db2.gz LICIUCFPUKBFRU-MSOLQXFVSA-N 1 3 347.547 2.998 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)[C@@H](C)NCc1ccc(C)cc1Cl ZINC001505723449 1404983681 /nfs/dbraw/zinc/98/36/81/1404983681.db2.gz AHJYUHUJSYRNAZ-HUUCEWRRSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)[C@@H](C)NCc1ccc(C)cc1Cl ZINC001505723449 1404983686 /nfs/dbraw/zinc/98/36/86/1404983686.db2.gz AHJYUHUJSYRNAZ-HUUCEWRRSA-N 1 3 339.911 2.973 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N(C)CC(C)(C)C[NH2+]Cc1ccccn1 ZINC001505850536 1405140878 /nfs/dbraw/zinc/14/08/78/1405140878.db2.gz ZPRDXJHHDGCGIO-IAGOWNOFSA-N 1 3 346.519 2.529 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1cccc(OC)c1 ZINC001505930518 1405241456 /nfs/dbraw/zinc/24/14/56/1405241456.db2.gz JTAINQNCVIFSHI-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1cccc(OC)c1 ZINC001505930518 1405241462 /nfs/dbraw/zinc/24/14/62/1405241462.db2.gz JTAINQNCVIFSHI-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1cccc(OC)c1 ZINC001505930519 1405242353 /nfs/dbraw/zinc/24/23/53/1405242353.db2.gz JTAINQNCVIFSHI-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1cccc(OC)c1 ZINC001505930519 1405242362 /nfs/dbraw/zinc/24/23/62/1405242362.db2.gz JTAINQNCVIFSHI-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@H](CNC(=O)C12CC[NH+](CC1)C2)N(C)[C@H](C)c1cccc(Cl)c1 ZINC001506037903 1405384646 /nfs/dbraw/zinc/38/46/46/1405384646.db2.gz CFIKERAEFJCJES-HUUCEWRRSA-N 1 3 349.906 2.933 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCF ZINC001506480639 1405825326 /nfs/dbraw/zinc/82/53/26/1405825326.db2.gz OXKLCXLRVCDXMG-YJBOKZPZSA-N 1 3 347.494 2.631 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1C[NH+](CC/C=C/c2ccccc2)C1 ZINC001506676464 1406136470 /nfs/dbraw/zinc/13/64/70/1406136470.db2.gz AUCOWSQVVBNQCR-RXNMKEHESA-N 1 3 343.515 2.867 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]CC2=CCCCC2)C1 ZINC001565877991 1415131213 /nfs/dbraw/zinc/13/12/13/1415131213.db2.gz JCUQDJUDTGUKKF-PSBWJHGTSA-N 1 3 333.520 2.844 10 0 EFAEHO CCC(CC)C[NH2+]CC[C@@H]1[C@@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001565939107 1415457026 /nfs/dbraw/zinc/45/70/26/1415457026.db2.gz OESDHKAOMLIZCR-MAUKXSAKSA-N 1 3 334.508 2.995 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@@H]1CC[NH2+]C/C=C/Cl ZINC001565942910 1415460973 /nfs/dbraw/zinc/46/09/73/1415460973.db2.gz IGAZPJCRPCMGCW-GRLYAWNKSA-N 1 3 329.916 2.686 10 0 EFAEHO C[C@@H]1CCN(C(=O)c2ccc(C[NH+](C)C)cc2)[C@H](CNCCF)C1 ZINC001565974659 1415467881 /nfs/dbraw/zinc/46/78/81/1415467881.db2.gz QICPIGXJZBMLFK-QAPCUYQASA-N 1 3 335.467 2.548 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)[C@H]3CCCCN3CC)C[C@@H]2C1 ZINC001566055289 1415494114 /nfs/dbraw/zinc/49/41/14/1415494114.db2.gz RHZOODSXFGDCAC-WKOLEINNSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)[C@H]3CCCCN3CC)C[C@@H]2C1 ZINC001566055289 1415494115 /nfs/dbraw/zinc/49/41/15/1415494115.db2.gz RHZOODSXFGDCAC-WKOLEINNSA-N 1 3 347.547 2.997 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@H+](C)[C@H]2CCCc3ccccc32)CCC1 ZINC001566461221 1415561227 /nfs/dbraw/zinc/56/12/27/1415561227.db2.gz SGLQTZPWDJQZFB-IBGZPJMESA-N 1 3 343.515 2.986 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@@H+](C)[C@H]2CCCc3ccccc32)CCC1 ZINC001566461221 1415561231 /nfs/dbraw/zinc/56/12/31/1415561231.db2.gz SGLQTZPWDJQZFB-IBGZPJMESA-N 1 3 343.515 2.986 10 0 EFAEHO CCc1ccc(C[N@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001566490781 1415582217 /nfs/dbraw/zinc/58/22/17/1415582217.db2.gz CNVVZWLRGOMHLD-KRWDZBQOSA-N 1 3 331.504 2.529 10 0 EFAEHO CCc1ccc(C[N@@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001566490781 1415582222 /nfs/dbraw/zinc/58/22/22/1415582222.db2.gz CNVVZWLRGOMHLD-KRWDZBQOSA-N 1 3 331.504 2.529 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](C)C[C@H]2CCCC(F)(F)C2)C1 ZINC001566490752 1415582496 /nfs/dbraw/zinc/58/24/96/1415582496.db2.gz BWCYASREOMAWKY-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](C)C[C@H]2CCCC(F)(F)C2)C1 ZINC001566490752 1415582497 /nfs/dbraw/zinc/58/24/97/1415582497.db2.gz BWCYASREOMAWKY-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)cc1C ZINC001566491193 1415583646 /nfs/dbraw/zinc/58/36/46/1415583646.db2.gz PMMUGPJZBHXTAV-INIZCTEOSA-N 1 3 331.504 2.583 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)cc1C ZINC001566491193 1415583649 /nfs/dbraw/zinc/58/36/49/1415583649.db2.gz PMMUGPJZBHXTAV-INIZCTEOSA-N 1 3 331.504 2.583 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC001566512438 1415601094 /nfs/dbraw/zinc/60/10/94/1415601094.db2.gz RHAVXRXJKIRYAQ-CQSZACIVSA-N 1 3 342.434 2.524 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](C)CC[C@H]1CCCC1(F)F ZINC001566512438 1415601098 /nfs/dbraw/zinc/60/10/98/1415601098.db2.gz RHAVXRXJKIRYAQ-CQSZACIVSA-N 1 3 342.434 2.524 10 0 EFAEHO CC[N@H+](CCCNC(=O)[C@H]1CCCN1C)[C@H](C)c1ccccc1F ZINC001566560239 1415643057 /nfs/dbraw/zinc/64/30/57/1415643057.db2.gz IUYBBMLNHRWAOO-CRAIPNDOSA-N 1 3 335.467 2.809 10 0 EFAEHO CC[N@@H+](CCCNC(=O)[C@H]1CCCN1C)[C@H](C)c1ccccc1F ZINC001566560239 1415643071 /nfs/dbraw/zinc/64/30/71/1415643071.db2.gz IUYBBMLNHRWAOO-CRAIPNDOSA-N 1 3 335.467 2.809 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H]([NH2+]CC/C=C/c2ccccc2)C1)N(C)C ZINC001566766567 1415768378 /nfs/dbraw/zinc/76/83/78/1415768378.db2.gz AUBJLJUCNQIFPB-RIZQAGQYSA-N 1 3 343.515 2.867 10 0 EFAEHO CC/C=C\CC[NH2+][C@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001566773858 1415770459 /nfs/dbraw/zinc/77/04/59/1415770459.db2.gz VVDGOEPVXKZHKM-NTWLCTACSA-N 1 3 339.499 2.746 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001566828032 1415791253 /nfs/dbraw/zinc/79/12/53/1415791253.db2.gz XPZZSKMPRHMOIV-FUHWJXTLSA-N 1 3 332.492 2.845 10 0 EFAEHO CCCCCC[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001566828032 1415791257 /nfs/dbraw/zinc/79/12/57/1415791257.db2.gz XPZZSKMPRHMOIV-FUHWJXTLSA-N 1 3 332.492 2.845 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@H]1CCCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001566893919 1415828486 /nfs/dbraw/zinc/82/84/86/1415828486.db2.gz RGGQNNJSYMKDPF-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@@H](C[NH2+]CCC2CCCC2)C1)N(C)C ZINC001566909989 1415838455 /nfs/dbraw/zinc/83/84/55/1415838455.db2.gz JPMOFOKYYSYTDI-OALUTQOASA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)C[NH2+]CCc1ccc(CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001567182049 1415975715 /nfs/dbraw/zinc/97/57/15/1415975715.db2.gz YPLDXHVXFQCYCI-FQEVSTJZSA-N 1 3 345.531 2.964 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccc(CC[NH2+]CC3CCC3)cc2)C1 ZINC001567183615 1415976987 /nfs/dbraw/zinc/97/69/87/1415976987.db2.gz JDDYJKIIJAHPSJ-KRWDZBQOSA-N 1 3 343.515 2.577 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@H]1CCC[N@@H+]1Cc1cncc(C)c1)N(C)C ZINC001567265311 1416042423 /nfs/dbraw/zinc/04/24/23/1416042423.db2.gz VCUSLZNLENGXDD-RBUKOAKNSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@H]1CCC[N@H+]1Cc1cncc(C)c1)N(C)C ZINC001567265311 1416042428 /nfs/dbraw/zinc/04/24/28/1416042428.db2.gz VCUSLZNLENGXDD-RBUKOAKNSA-N 1 3 346.519 2.591 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+]Cc2ccc(Cl)c(F)c2)CCC1 ZINC001567508321 1416166211 /nfs/dbraw/zinc/16/62/11/1416166211.db2.gz UWMAEYKRMBIREP-UHFFFAOYSA-N 1 3 341.858 2.511 10 0 EFAEHO Cc1ccc(C[NH2+]CCN(C)C(=O)CN(C)CC(C)(C)C)cc1C ZINC001567561214 1416188216 /nfs/dbraw/zinc/18/82/16/1416188216.db2.gz FNWVJFVDLKOMIR-UHFFFAOYSA-N 1 3 333.520 2.829 10 0 EFAEHO CCc1ccccc1CC[NH2+]CCN(C)C(=O)CN1CCC(C)CC1 ZINC001567580111 1416195729 /nfs/dbraw/zinc/19/57/29/1416195729.db2.gz LDKNKVKQNBTKAC-UHFFFAOYSA-N 1 3 345.531 2.571 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)N(C)CCNCc1ccc(Cl)s1 ZINC001567611141 1416209435 /nfs/dbraw/zinc/20/94/35/1416209435.db2.gz VYRHDDAJKNJYQA-STQMWFEESA-N 1 3 343.924 2.822 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+]Cc1cccc(C(F)F)c1 ZINC001567611945 1416209815 /nfs/dbraw/zinc/20/98/15/1416209815.db2.gz ZQZRWJULTFHBQX-UHFFFAOYSA-N 1 3 327.419 2.512 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)CC1CC(C)(C)C1 ZINC001567649627 1416228749 /nfs/dbraw/zinc/22/87/49/1416228749.db2.gz YMPGLHIAQUHEQQ-KRWDZBQOSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)CC1CC(C)(C)C1 ZINC001567649627 1416228755 /nfs/dbraw/zinc/22/87/55/1416228755.db2.gz YMPGLHIAQUHEQQ-KRWDZBQOSA-N 1 3 337.552 2.981 10 0 EFAEHO CCC/C=C\CC[N@H+](C)CC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001567744522 1416268762 /nfs/dbraw/zinc/26/87/62/1416268762.db2.gz LPZPLOOFLKLGGE-LIXSYLKWSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@@H+](C)CC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001567744522 1416268763 /nfs/dbraw/zinc/26/87/63/1416268763.db2.gz LPZPLOOFLKLGGE-LIXSYLKWSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@H+](C)CC1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001567744525 1416269029 /nfs/dbraw/zinc/26/90/29/1416269029.db2.gz LPZPLOOFLKLGGE-RURPWVQCSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@@H+](C)CC1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001567744525 1416269032 /nfs/dbraw/zinc/26/90/32/1416269032.db2.gz LPZPLOOFLKLGGE-RURPWVQCSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N(C)[C@H]1CC[N@H+](CCCCCF)C1 ZINC001567921568 1416323965 /nfs/dbraw/zinc/32/39/65/1416323965.db2.gz AWVNOHIRLRMLLV-ROUUACIJSA-N 1 3 341.515 2.922 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N(C)[C@H]1CC[N@@H+](CCCCCF)C1 ZINC001567921568 1416323967 /nfs/dbraw/zinc/32/39/67/1416323967.db2.gz AWVNOHIRLRMLLV-ROUUACIJSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](CC[NH2+]CC2CC(F)(F)C2)C1 ZINC001568073838 1416396409 /nfs/dbraw/zinc/39/64/09/1416396409.db2.gz VPCIXHGCOGXCPB-OAHLLOKOSA-N 1 3 345.478 2.592 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](CC[NH2+]CC2CCC2)C1 ZINC001568076310 1416398397 /nfs/dbraw/zinc/39/83/97/1416398397.db2.gz NFLRCOLWNHIPKZ-RTBURBONSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]C/C=C\c1ccccc1 ZINC001568176745 1416433779 /nfs/dbraw/zinc/43/37/79/1416433779.db2.gz XQIVEJLBXAAUDK-CGICMKJESA-N 1 3 329.488 2.526 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]CC[C@@H]1CCCC1(F)F ZINC001568320335 1416475513 /nfs/dbraw/zinc/47/55/13/1416475513.db2.gz FXUQDMQCISEIOM-CABCVRRESA-N 1 3 333.467 2.589 10 0 EFAEHO CCN(CC[NH2+]CCC1CCCCO1)C(=O)C1(c2ccccn2)CC1 ZINC001568742571 1416545347 /nfs/dbraw/zinc/54/53/47/1416545347.db2.gz VPMQGAWJKRZMFE-KRWDZBQOSA-N 1 3 345.487 2.511 10 0 EFAEHO CC[N@H+](CCCNC(=O)Cc1nc[nH]c1C)Cc1c(C)cccc1C ZINC001689966951 1417109800 /nfs/dbraw/zinc/10/98/00/1417109800.db2.gz LFYJGYMNVYJUSV-UHFFFAOYSA-N 1 3 342.487 2.906 10 0 EFAEHO CC[N@@H+](CCCNC(=O)Cc1nc[nH]c1C)Cc1c(C)cccc1C ZINC001689966951 1417109806 /nfs/dbraw/zinc/10/98/06/1417109806.db2.gz LFYJGYMNVYJUSV-UHFFFAOYSA-N 1 3 342.487 2.906 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](CC)Cc1ccsc1 ZINC001689970135 1417112853 /nfs/dbraw/zinc/11/28/53/1417112853.db2.gz GLQDHQVICVTUNJ-KRWDZBQOSA-N 1 3 337.533 2.951 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](CC)Cc1ccsc1 ZINC001689970135 1417112856 /nfs/dbraw/zinc/11/28/56/1417112856.db2.gz GLQDHQVICVTUNJ-KRWDZBQOSA-N 1 3 337.533 2.951 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](CC)Cc1ccsc1 ZINC001689970136 1417113126 /nfs/dbraw/zinc/11/31/26/1417113126.db2.gz GLQDHQVICVTUNJ-QGZVFWFLSA-N 1 3 337.533 2.951 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](CC)Cc1ccsc1 ZINC001689970136 1417113128 /nfs/dbraw/zinc/11/31/28/1417113128.db2.gz GLQDHQVICVTUNJ-QGZVFWFLSA-N 1 3 337.533 2.951 10 0 EFAEHO O=C([C@@H]1CCCC[N@@H+]1C1CCCC1)N1CCCC[C@H]1CNCCF ZINC001690477705 1417216033 /nfs/dbraw/zinc/21/60/33/1417216033.db2.gz SALJEVXGKUFWPT-ROUUACIJSA-N 1 3 339.499 2.724 10 0 EFAEHO O=C([C@@H]1CCCC[N@H+]1C1CCCC1)N1CCCC[C@H]1CNCCF ZINC001690477705 1417216035 /nfs/dbraw/zinc/21/60/35/1417216035.db2.gz SALJEVXGKUFWPT-ROUUACIJSA-N 1 3 339.499 2.724 10 0 EFAEHO C[C@H](NC(=O)CCCC[NH+](C)C)[C@H]1CCCN(Cc2cccnc2)C1 ZINC001690504708 1417219267 /nfs/dbraw/zinc/21/92/67/1417219267.db2.gz HOHBUHCKYYSUEU-HKUYNNGSSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@](C)(C[NH2+]CCC(F)(F)F)C1CC1 ZINC001698642032 1417308380 /nfs/dbraw/zinc/30/83/80/1417308380.db2.gz BAWKFIAKGNVZKY-ZBFHGGJFSA-N 1 3 349.441 2.686 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001698732133 1417322071 /nfs/dbraw/zinc/32/20/71/1417322071.db2.gz OEDPUHNTGUOQMI-APWZRJJASA-N 1 3 339.499 2.746 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1C(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001698734277 1417322887 /nfs/dbraw/zinc/32/28/87/1417322887.db2.gz JRQMPDNWQMUZIR-ZIAGYGMSSA-N 1 3 348.318 2.760 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1C(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001698734277 1417322890 /nfs/dbraw/zinc/32/28/90/1417322890.db2.gz JRQMPDNWQMUZIR-ZIAGYGMSSA-N 1 3 348.318 2.760 10 0 EFAEHO C[C@@H](C[NH2+]CCCc1cccc(F)c1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001698846232 1417339849 /nfs/dbraw/zinc/33/98/49/1417339849.db2.gz YMWHVCWBJQRAHT-SJORKVTESA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)[C@H]1C[NH2+]C/C=C\Cl ZINC001698948341 1417353502 /nfs/dbraw/zinc/35/35/02/1417353502.db2.gz VNGYRDCGGZMXQP-VTBIRBAPSA-N 1 3 343.943 2.934 10 0 EFAEHO C[C@@H](CC[NH2+]C[C@@H]1CCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001699134506 1417399958 /nfs/dbraw/zinc/39/99/58/1417399958.db2.gz XATXPYUZTFLLRV-LSDHHAIUSA-N 1 3 347.494 2.884 10 0 EFAEHO CCN(CC[NH2+]Cc1c(C)cccc1C)C(=O)CN(C)C1CCC1 ZINC001699186334 1417411814 /nfs/dbraw/zinc/41/18/14/1417411814.db2.gz RFBNFDXNZOTTPQ-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C[NH2+]CC[C@@H]1CCc2ccccc21)N(C)C ZINC001699380149 1417424557 /nfs/dbraw/zinc/42/45/57/1417424557.db2.gz AKKPNDYYONCMAD-AYBZRNKSSA-N 1 3 331.504 2.541 10 0 EFAEHO CC(C)=CC[N@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001699683664 1417450751 /nfs/dbraw/zinc/45/07/51/1417450751.db2.gz AIAUMYYRFMBJPF-IBGZPJMESA-N 1 3 333.520 2.750 10 0 EFAEHO CC(C)=CC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001699683664 1417450753 /nfs/dbraw/zinc/45/07/53/1417450753.db2.gz AIAUMYYRFMBJPF-IBGZPJMESA-N 1 3 333.520 2.750 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC1(C)CC[NH+](CCCCCF)CC1 ZINC001699775267 1417467221 /nfs/dbraw/zinc/46/72/21/1417467221.db2.gz QCISSIRDTIOOGT-IAGOWNOFSA-N 1 3 341.515 2.970 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@H]2CCN(C(=O)C3(N(C)C)CCC3)C2)c1 ZINC001700069048 1417551221 /nfs/dbraw/zinc/55/12/21/1417551221.db2.gz ZATUUTJUDXKFSO-SFHVURJKSA-N 1 3 343.515 2.808 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](CC[NH2+]CCC2=CCCCC2)C1 ZINC001700086720 1417559907 /nfs/dbraw/zinc/55/99/07/1417559907.db2.gz CKDUOWUWJXQXHM-LJQANCHMSA-N 1 3 333.520 2.801 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001700686271 1417614521 /nfs/dbraw/zinc/61/45/21/1417614521.db2.gz YCRGJENZZLHKEW-OCCSQVGLSA-N 1 3 342.434 2.571 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccccc2)C[C@@H]1C ZINC001700853992 1417665812 /nfs/dbraw/zinc/66/58/12/1417665812.db2.gz OZYQBGPANJGEMX-PKOBYXMFSA-N 1 3 331.504 2.538 10 0 EFAEHO C[C@H]([NH2+]CCCF)[C@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001712998857 1418322158 /nfs/dbraw/zinc/32/21/58/1418322158.db2.gz HWYMPQDXVZVXEU-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)CCC[NH2+]C[C@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001713239633 1418408800 /nfs/dbraw/zinc/40/88/00/1418408800.db2.gz WWDDFGALQXQYFI-QZTJIDSGSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCCC[C@@H]2C[NH2+]CCCF)C1 ZINC001713266443 1418433677 /nfs/dbraw/zinc/43/36/77/1418433677.db2.gz XBLSIKVIBDKANE-CRAIPNDOSA-N 1 3 345.478 2.529 10 0 EFAEHO CCC/C=C/CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)CN1[C@H](C)CC[C@@H]1C ZINC001713283689 1418453576 /nfs/dbraw/zinc/45/35/76/1418453576.db2.gz LGJMCXKYTPRHTK-FVSNVHEGSA-N 1 3 333.520 2.652 10 0 EFAEHO CCC/C=C/CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)CN1[C@H](C)CC[C@@H]1C ZINC001713283689 1418453579 /nfs/dbraw/zinc/45/35/79/1418453579.db2.gz LGJMCXKYTPRHTK-FVSNVHEGSA-N 1 3 333.520 2.652 10 0 EFAEHO CC(C)=CC[NH2+]CCc1ccc(CNC(=O)Cc2nc[nH]c2C)cc1 ZINC001713386714 1418500635 /nfs/dbraw/zinc/50/06/35/1418500635.db2.gz MDOKGIIYOJAFCV-UHFFFAOYSA-N 1 3 340.471 2.675 10 0 EFAEHO CCC[NH2+]CCc1ccc(CNC(=O)[C@@H]2CCCCN2CC)cc1 ZINC001713386897 1418501334 /nfs/dbraw/zinc/50/13/34/1418501334.db2.gz QUJGRUIASUMHJP-IBGZPJMESA-N 1 3 331.504 2.719 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[C@@H]1CCC[N@@H+]1CCCF ZINC001713442166 1418538518 /nfs/dbraw/zinc/53/85/18/1418538518.db2.gz HYDISLIQFQICPN-SJORKVTESA-N 1 3 327.488 2.581 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[C@@H]1CCC[N@H+]1CCCF ZINC001713442166 1418538519 /nfs/dbraw/zinc/53/85/19/1418538519.db2.gz HYDISLIQFQICPN-SJORKVTESA-N 1 3 327.488 2.581 10 0 EFAEHO CC1CCC(C[NH2+]CCN(C)C(=O)CN(C)CC(C)(C)C)CC1 ZINC001714757351 1418627660 /nfs/dbraw/zinc/62/76/60/1418627660.db2.gz SOOMIOKHYTWCJV-UHFFFAOYSA-N 1 3 325.541 2.839 10 0 EFAEHO CC/C=C/CC[N@H+](C)C[C@@H]1CCN(C(=O)[C@@H]2CCCCN2CC)C1 ZINC001714910485 1418642609 /nfs/dbraw/zinc/64/26/09/1418642609.db2.gz WZYUJBVQSUQPDE-FNYRVFDFSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@@H]2CCCCN2CC)C1 ZINC001714910485 1418642613 /nfs/dbraw/zinc/64/26/13/1418642613.db2.gz WZYUJBVQSUQPDE-FNYRVFDFSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+](C)C[C@@H]1CCN(C(=O)[C@H]2CCCCN2CC)C1 ZINC001714910487 1418642924 /nfs/dbraw/zinc/64/29/24/1418642924.db2.gz WZYUJBVQSUQPDE-OXUXSNCKSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@H]2CCCCN2CC)C1 ZINC001714910487 1418642930 /nfs/dbraw/zinc/64/29/30/1418642930.db2.gz WZYUJBVQSUQPDE-OXUXSNCKSA-N 1 3 335.536 2.997 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+]C/C=C/Cl)C1CCCCC1)C1CCC1 ZINC001714973910 1418644293 /nfs/dbraw/zinc/64/42/93/1418644293.db2.gz GTQSZUZMZRPYDI-SCBHQAGPSA-N 1 3 341.927 2.878 10 0 EFAEHO O=C(NC1(CNCCF)CCCC1)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001715094772 1418650805 /nfs/dbraw/zinc/65/08/05/1418650805.db2.gz LCMZBENDBYLRPZ-INIZCTEOSA-N 1 3 339.499 2.629 10 0 EFAEHO O=C(NC1(CNCCF)CCCC1)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001715094772 1418650808 /nfs/dbraw/zinc/65/08/08/1418650808.db2.gz LCMZBENDBYLRPZ-INIZCTEOSA-N 1 3 339.499 2.629 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)cs1 ZINC001715833110 1418686292 /nfs/dbraw/zinc/68/62/92/1418686292.db2.gz LEAWBRGNQZDRKB-OOUWWJCLSA-N 1 3 347.528 2.835 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)cs1 ZINC001715833110 1418686293 /nfs/dbraw/zinc/68/62/93/1418686293.db2.gz LEAWBRGNQZDRKB-OOUWWJCLSA-N 1 3 347.528 2.835 10 0 EFAEHO CC(C)c1cccc(C[NH2+]CC[C@H](C)NC(=O)CN2CC[C@H](C)C2)n1 ZINC001716174590 1418713397 /nfs/dbraw/zinc/71/33/97/1418713397.db2.gz VCVYQSSEPMEQQD-IRXDYDNUSA-N 1 3 346.519 2.531 10 0 EFAEHO CC(C)=CC[NH2+]CC[C@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001716174827 1418714241 /nfs/dbraw/zinc/71/42/41/1418714241.db2.gz ZRXKDWSOAYIOPM-MAUKXSAKSA-N 1 3 327.488 2.650 10 0 EFAEHO CCc1cccc(C[NH2+]CCN(CC)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001716240194 1418733564 /nfs/dbraw/zinc/73/35/64/1418733564.db2.gz XWRHRTHPLACOKH-QGZVFWFLSA-N 1 3 331.504 2.529 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C\CNCc2csc(C)c2)CC[N@@H+]1C ZINC001716297118 1418757611 /nfs/dbraw/zinc/75/76/11/1418757611.db2.gz WXPNKRZKFVSXTI-JOGGYFKDSA-N 1 3 335.517 2.549 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C\CNCc2csc(C)c2)CC[N@H+]1C ZINC001716297118 1418757612 /nfs/dbraw/zinc/75/76/12/1418757612.db2.gz WXPNKRZKFVSXTI-JOGGYFKDSA-N 1 3 335.517 2.549 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C/C=C/CNC(=O)CN(C)C2CCC2)c1 ZINC001716304858 1418762534 /nfs/dbraw/zinc/76/25/34/1418762534.db2.gz CKPTUWJBGMGQSK-SNAWJCMRSA-N 1 3 329.488 2.550 10 0 EFAEHO CC[C@H]([NH2+]C/C=C\CNC(=O)CN1CC[C@H](C)C1)c1ccc(F)cc1 ZINC001716344295 1418787862 /nfs/dbraw/zinc/78/78/62/1418787862.db2.gz SZIVMLLKWLHISQ-LIHUFFQZSA-N 1 3 347.478 2.881 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C/C[NH2+][C@H]1CCc2c1cccc2Cl)N(C)C ZINC001716344165 1418787890 /nfs/dbraw/zinc/78/78/90/1418787890.db2.gz RAENWQTXZNFZPG-ZBKUBXTQSA-N 1 3 349.906 2.930 10 0 EFAEHO CC[C@H]([NH2+]C/C=C/CNC(=O)CN1CC[C@@H](C)C1)c1ccc(F)cc1 ZINC001716344297 1418788164 /nfs/dbraw/zinc/78/81/64/1418788164.db2.gz SZIVMLLKWLHISQ-QDYBUIJZSA-N 1 3 347.478 2.881 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C\C[NH2+]CC2CC3(CCC3)C2)CC1 ZINC001716357476 1418797827 /nfs/dbraw/zinc/79/78/27/1418797827.db2.gz OICKGOMZHNSYPZ-IHWYPQMZSA-N 1 3 333.520 2.561 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)cs1 ZINC001716378586 1418860278 /nfs/dbraw/zinc/86/02/78/1418860278.db2.gz JSBHBOVEQBXKHE-ZTXBFCOASA-N 1 3 335.517 2.691 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)cs1 ZINC001716378586 1418860282 /nfs/dbraw/zinc/86/02/82/1418860282.db2.gz JSBHBOVEQBXKHE-ZTXBFCOASA-N 1 3 335.517 2.691 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC/C=C\C[NH2+]CCc1ccccc1F ZINC001716378061 1418860733 /nfs/dbraw/zinc/86/07/33/1418860733.db2.gz FZDZLEIEBQDJLD-RURPWVQCSA-N 1 3 347.478 2.505 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C\CNC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C ZINC001716378669 1418860838 /nfs/dbraw/zinc/86/08/38/1418860838.db2.gz KYGNKYVMDGWNSC-FPXTWJHWSA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C\CNC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001716378669 1418860842 /nfs/dbraw/zinc/86/08/42/1418860842.db2.gz KYGNKYVMDGWNSC-FPXTWJHWSA-N 1 3 347.478 2.769 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]CCc1cccs1 ZINC001716414357 1418875795 /nfs/dbraw/zinc/87/57/95/1418875795.db2.gz BFTSKCZMDBUWCV-WBVHZDCISA-N 1 3 337.533 2.648 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CCCc1ccc(C)cc1 ZINC001716424962 1418878340 /nfs/dbraw/zinc/87/83/40/1418878340.db2.gz ZYHMLBRLWRXSJW-UYAOXDASSA-N 1 3 345.531 2.896 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(Cl)cc1F)C(=O)CN1CCCC1 ZINC001716585818 1418918005 /nfs/dbraw/zinc/91/80/05/1418918005.db2.gz URJUZCQQVMJFOQ-UHFFFAOYSA-N 1 3 341.858 2.513 10 0 EFAEHO CN(CCC[NH2+][C@H]1CCc2ccc(Cl)cc21)C(=O)CN1CCCC1 ZINC001716585815 1418918181 /nfs/dbraw/zinc/91/81/81/1418918181.db2.gz ULHBPMPXHBGMGL-SFHVURJKSA-N 1 3 349.906 2.861 10 0 EFAEHO CC[C@@H]1CN(C(=O)C(C)(C)N2CCCCC2)CC[C@H]1[NH2+]CCCF ZINC001716635672 1418932326 /nfs/dbraw/zinc/93/23/26/1418932326.db2.gz MRLLRWZYPSSVKN-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CCCc2ccccc2)C[C@@H]1C ZINC001716770963 1419001278 /nfs/dbraw/zinc/00/12/78/1419001278.db2.gz PPODWFVBJKTGEI-ICSRJNTNSA-N 1 3 345.531 2.930 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@]1(C)CCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001716864395 1419063132 /nfs/dbraw/zinc/06/31/32/1419063132.db2.gz HZAPFMURBCFKRV-QFBILLFUSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]1CC[C@H](C[NH2+]CCCF)CC1 ZINC001717001554 1419137135 /nfs/dbraw/zinc/13/71/35/1419137135.db2.gz FXQWCWCBVWANDS-KZNAEPCWSA-N 1 3 341.515 2.731 10 0 EFAEHO CCc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)Cc3c[nH]cn3)C2)cc1 ZINC001717100304 1419208009 /nfs/dbraw/zinc/20/80/09/1419208009.db2.gz PIEMJLZPWDPPKR-GOSISDBHSA-N 1 3 340.471 2.543 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CC[C@@H]2CCN(C(=O)CN3CCCC3)C2)c1 ZINC001717110854 1419215453 /nfs/dbraw/zinc/21/54/53/1419215453.db2.gz YQMGFIKGKVIAHW-QGZVFWFLSA-N 1 3 347.478 2.558 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1CC[C@H](C[NH2+]CCC2CC2)CC1 ZINC001717121231 1419223203 /nfs/dbraw/zinc/22/32/03/1419223203.db2.gz SBLURSZSGCTAPM-GUDVDZBRSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@@H](C(=O)N[C@H]1CC[C@H](C[NH2+]CCCF)CC1)N1CCCCCC1 ZINC001717123883 1419224849 /nfs/dbraw/zinc/22/48/49/1419224849.db2.gz ZOKHWIIFONZDRA-BZSNNMDCSA-N 1 3 341.515 2.875 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NC2(C[NH2+]CCF)CCCCC2)C1 ZINC001717527568 1419428595 /nfs/dbraw/zinc/42/85/95/1419428595.db2.gz SWGZHFUEZPGDGA-GOSISDBHSA-N 1 3 345.478 2.577 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@H](NC(=O)C23CCCN2CCC3)C(C)(C)C1 ZINC001717582893 1419455003 /nfs/dbraw/zinc/45/50/03/1419455003.db2.gz RSBSAGXBXBJILM-RTRPANQVSA-N 1 3 333.520 2.798 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@H](NC(=O)C23CCCN2CCC3)C(C)(C)C1 ZINC001717582893 1419455004 /nfs/dbraw/zinc/45/50/04/1419455004.db2.gz RSBSAGXBXBJILM-RTRPANQVSA-N 1 3 333.520 2.798 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@H](C[NH2+]CCCC3CCC3)C2)CCC1 ZINC001717871820 1419595240 /nfs/dbraw/zinc/59/52/40/1419595240.db2.gz CZHVMSRPTIWJML-ZWKOTPCHSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@@H](C[NH2+]CCCC3CCC3)C2)CCC1 ZINC001717871817 1419595251 /nfs/dbraw/zinc/59/52/51/1419595251.db2.gz CZHVMSRPTIWJML-QZTJIDSGSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@H](C(=O)N[C@H](C[NH2+]CCCF)C(C)(C)C)N1CCCCCC1 ZINC001717968784 1419633943 /nfs/dbraw/zinc/63/39/43/1419633943.db2.gz HYKJZSLJYWFTNY-HZPDHXFCSA-N 1 3 329.504 2.731 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1=CCN(Cc2ccc(C3CC3)cc2)CC1 ZINC001718027853 1419666716 /nfs/dbraw/zinc/66/67/16/1419666716.db2.gz XZIXRHDBWRLVLB-UHFFFAOYSA-N 1 3 341.499 2.764 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001723122742 1424429230 /nfs/dbraw/zinc/42/92/30/1424429230.db2.gz JEPSGKPRSHNXCH-CABCVRRESA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@@H]([NH2+]CCCN(C)C(=O)Cc1c[nH]cn1)c1ccc(F)cc1 ZINC001723134031 1424432247 /nfs/dbraw/zinc/43/22/47/1424432247.db2.gz XLMAEKBFDCIOTN-QGZVFWFLSA-N 1 3 332.423 2.681 10 0 EFAEHO Cc1cc(C[NH2+]CCCN(C)C(=O)CN2CCC(C)CC2)cs1 ZINC001723157287 1424437809 /nfs/dbraw/zinc/43/78/09/1424437809.db2.gz OVXJOSODSZSLKS-UHFFFAOYSA-N 1 3 337.533 2.727 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+]Cc1sccc1Cl ZINC001723205607 1424452585 /nfs/dbraw/zinc/45/25/85/1424452585.db2.gz YYTZHIHHANOCGI-UHFFFAOYSA-N 1 3 331.913 2.680 10 0 EFAEHO CC(C)CCC[NH2+]C[C@@]1(C)CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001724255686 1424714794 /nfs/dbraw/zinc/71/47/94/1424714794.db2.gz XQVNJQYYIGUASI-HXUWFJFHSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N(CC[NH2+]CC1CC1)Cc1ccccc1 ZINC001724619798 1424846125 /nfs/dbraw/zinc/84/61/25/1424846125.db2.gz JOHRUFSXTQYPKC-HXUWFJFHSA-N 1 3 343.515 2.888 10 0 EFAEHO CCCCC[N@H+]1C[C@H]2CN(C(=O)C(C)(C)N3CCCCC3)C[C@H]2C1 ZINC001724622221 1424847800 /nfs/dbraw/zinc/84/78/00/1424847800.db2.gz PGXOMACRXUAUOF-HDICACEKSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCCC[N@@H+]1C[C@H]2CN(C(=O)C(C)(C)N3CCCCC3)C[C@H]2C1 ZINC001724622221 1424847810 /nfs/dbraw/zinc/84/78/10/1424847810.db2.gz PGXOMACRXUAUOF-HDICACEKSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2ccccc2)C1)N(C)C ZINC001724710344 1424928655 /nfs/dbraw/zinc/92/86/55/1424928655.db2.gz GXPSOBPEYGFOTL-MOPGFXCFSA-N 1 3 331.504 2.601 10 0 EFAEHO CN(CC(=O)N1CC[C@H](CC[NH2+]CCC2CCCC2)C1)C1CCC1 ZINC001724712070 1424930955 /nfs/dbraw/zinc/93/09/55/1424930955.db2.gz ICJVNWUSDZKPEV-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H]([C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001725063005 1425275965 /nfs/dbraw/zinc/27/59/65/1425275965.db2.gz ZITUVGOGOSIRII-IRXDYDNUSA-N 1 3 332.492 2.703 10 0 EFAEHO CCCCC[N@H+]1CC[C@H]([C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001725063005 1425275969 /nfs/dbraw/zinc/27/59/69/1425275969.db2.gz ZITUVGOGOSIRII-IRXDYDNUSA-N 1 3 332.492 2.703 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H]([C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001725063006 1425276023 /nfs/dbraw/zinc/27/60/23/1425276023.db2.gz ZITUVGOGOSIRII-SJORKVTESA-N 1 3 332.492 2.703 10 0 EFAEHO CCCCC[N@H+]1CC[C@H]([C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001725063006 1425276028 /nfs/dbraw/zinc/27/60/28/1425276028.db2.gz ZITUVGOGOSIRII-SJORKVTESA-N 1 3 332.492 2.703 10 0 EFAEHO CN(CC(=O)NC1CC(C[NH2+]C/C=C/c2ccccc2)C1)C1CCC1 ZINC001725063745 1425277051 /nfs/dbraw/zinc/27/70/51/1425277051.db2.gz PDQKGDLDYKHYAM-RMKNXTFCSA-N 1 3 341.499 2.669 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]1C[N@H+](C)CCCCC(F)(F)F ZINC001725099121 1425299782 /nfs/dbraw/zinc/29/97/82/1425299782.db2.gz KESZVGOMKHVIJC-CABCVRRESA-N 1 3 349.441 2.736 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]1C[N@@H+](C)CCCCC(F)(F)F ZINC001725099121 1425299788 /nfs/dbraw/zinc/29/97/88/1425299788.db2.gz KESZVGOMKHVIJC-CABCVRRESA-N 1 3 349.441 2.736 10 0 EFAEHO CN(CC(=O)N(C)CC(C)(C)C[NH2+]C/C=C/Cl)CC(C)(C)C ZINC001725149948 1425334690 /nfs/dbraw/zinc/33/46/90/1425334690.db2.gz LBVCCRBFAMNAQU-CMDGGOBGSA-N 1 3 331.932 2.791 10 0 EFAEHO CCCCC[N@H+](C)[C@@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001725181781 1425360805 /nfs/dbraw/zinc/36/08/05/1425360805.db2.gz PZUJNXYCMLYYSE-YJBOKZPZSA-N 1 3 329.504 2.826 10 0 EFAEHO CCCCC[N@@H+](C)[C@@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001725181781 1425360809 /nfs/dbraw/zinc/36/08/09/1425360809.db2.gz PZUJNXYCMLYYSE-YJBOKZPZSA-N 1 3 329.504 2.826 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCCC2(CN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001725339387 1425487194 /nfs/dbraw/zinc/48/71/94/1425487194.db2.gz ULPICDKFXWOPOS-SNAWJCMRSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C/CC[N@H+]1CCCC2(CN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001725339387 1425487196 /nfs/dbraw/zinc/48/71/96/1425487196.db2.gz ULPICDKFXWOPOS-SNAWJCMRSA-N 1 3 333.520 2.751 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@H]2C[C@H](C[NH2+]CCC3=CCCCC3)C2)C1 ZINC001725364009 1425509496 /nfs/dbraw/zinc/50/94/96/1425509496.db2.gz LUNPMZAAYZYDRA-WDSOQIARSA-N 1 3 333.520 2.703 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H]1C[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001725373195 1425513764 /nfs/dbraw/zinc/51/37/64/1425513764.db2.gz UKKBODRARJRMAV-UAPYVXQJSA-N 1 3 329.488 2.812 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CCC[NH2+]CCC(F)(F)F ZINC001725455762 1425592885 /nfs/dbraw/zinc/59/28/85/1425592885.db2.gz FEVDAUWJYSSPKZ-UONOGXRCSA-N 1 3 337.430 2.688 10 0 EFAEHO C[C@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]CCCCC(F)(F)F ZINC001725488246 1425615731 /nfs/dbraw/zinc/61/57/31/1425615731.db2.gz HFJDJRKYCOJBRB-CYBMUJFWSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)=CC[NH2+][C@@H](C)CN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001725508183 1425627037 /nfs/dbraw/zinc/62/70/37/1425627037.db2.gz WSYOFTBBFODTIM-YJBOKZPZSA-N 1 3 327.488 2.602 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccc(C)cc2)C[C@H]1C ZINC001725601434 1425688076 /nfs/dbraw/zinc/68/80/76/1425688076.db2.gz XMGNYTDUZYKUAV-UYAOXDASSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]21 ZINC001725632363 1425731974 /nfs/dbraw/zinc/73/19/74/1425731974.db2.gz RKXBLHZIXGPSRE-YTQUADARSA-N 1 3 333.520 2.654 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NCC1=CCN(Cc2ccccc2)CC1 ZINC001725830002 1425896639 /nfs/dbraw/zinc/89/66/39/1425896639.db2.gz NOFMRNHZFRKXRU-UHFFFAOYSA-N 1 3 341.499 2.811 10 0 EFAEHO CCCC[NH2+]Cc1ccc(CNC(=O)Cc2nc[nH]c2C)c(F)c1 ZINC001725834947 1425902337 /nfs/dbraw/zinc/90/23/37/1425902337.db2.gz XHPVEWDLENCEPF-UHFFFAOYSA-N 1 3 332.423 2.606 10 0 EFAEHO CC[C@H]([NH2+]C[C@H]1CNCCC1(F)F)c1ccc(C(=O)OC)cc1 ZINC000925779604 717678120 /nfs/dbraw/zinc/67/81/20/717678120.db2.gz YMMDJDYLHOWOSQ-CABCVRRESA-N 1 3 326.387 2.759 10 0 EFAEHO COC(=O)c1cc(CN[C@H](CCC[NH3+])c2ccccc2)n(C)c1C ZINC000925767896 717734403 /nfs/dbraw/zinc/73/44/03/717734403.db2.gz HLHBLMCYPLMOLV-GOSISDBHSA-N 1 3 329.444 2.690 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1cc(Br)ccc1Cl ZINC000722376210 718066019 /nfs/dbraw/zinc/06/60/19/718066019.db2.gz HASJJQDIOJUDMO-GFCCVEGCSA-N 1 3 335.673 2.946 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1cc(Br)ccc1Cl ZINC000722376237 718066151 /nfs/dbraw/zinc/06/61/51/718066151.db2.gz HASJJQDIOJUDMO-LBPRGKRZSA-N 1 3 335.673 2.946 10 0 EFAEHO C[C@@]1(NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)CN2CCC1CC2 ZINC000892769215 719143075 /nfs/dbraw/zinc/14/30/75/719143075.db2.gz QAUHWKXTUBWGRC-OAQYLSRUSA-N 1 3 341.499 2.887 10 0 EFAEHO O=C(CCN1CCC(C[NH+]2CCCC2)CC1)OCc1ccccc1 ZINC000181433927 720025162 /nfs/dbraw/zinc/02/51/62/720025162.db2.gz ISYLXKOASXRUQW-UHFFFAOYSA-N 1 3 330.472 2.928 10 0 EFAEHO COC(=O)[C@H]1[C@@H](CN2CCC(CCC[NH+]3CCCC3)CC2)C1(F)F ZINC000894070540 720266026 /nfs/dbraw/zinc/26/60/26/720266026.db2.gz BVHZVXGIFWENFN-HZPDHXFCSA-N 1 3 344.446 2.629 10 0 EFAEHO C[C@H](N[C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000925588311 720500723 /nfs/dbraw/zinc/50/07/23/720500723.db2.gz VBLRHNVHCUWJSG-JGGQBBKZSA-N 1 3 339.505 2.615 10 0 EFAEHO O=C(NCCC[NH2+][C@H]1CCNC[C@H]1C1CCCC1)c1ccc(F)cc1 ZINC000925599210 720522541 /nfs/dbraw/zinc/52/25/41/720522541.db2.gz XSANNFJVHITNGA-OALUTQOASA-N 1 3 347.478 2.704 10 0 EFAEHO CC1(C)C[C@@H]([NH3+])C[C@@H](NCCOc2ccc(C(F)(F)F)cn2)C1 ZINC000925619693 720598656 /nfs/dbraw/zinc/59/86/56/720598656.db2.gz QRAXTHCGIIWYFX-QWHCGFSZSA-N 1 3 331.382 2.975 10 0 EFAEHO CC1(C)C[C@@H]([NH3+])C[C@@H](NC[C@H](O)c2cccc(Br)c2)C1 ZINC000925661118 720819069 /nfs/dbraw/zinc/81/90/69/720819069.db2.gz SJLFJOVHQARHQV-ZNMIVQPWSA-N 1 3 341.293 2.978 10 0 EFAEHO CC1(C)[C@H]2NCCC[C@H]2[C@@H]1[NH2+]CCCNC(=O)/C=C\c1ccccc1 ZINC000925664205 720832022 /nfs/dbraw/zinc/83/20/22/720832022.db2.gz CXJNJIPYVLRBPI-SUQLZWFBSA-N 1 3 341.499 2.572 10 0 EFAEHO CC1(C)COC[C@@H]1[NH2+]CCCCN1CCN(Cc2ccccc2)CC1 ZINC000894191243 721189735 /nfs/dbraw/zinc/18/97/35/721189735.db2.gz GNINDOXNFVLRPM-FQEVSTJZSA-N 1 3 345.531 2.599 10 0 EFAEHO CC(C)N1CCC[C@H](C[NH2+]CC2CN(C(=O)OC(C)(C)C)C2)C1 ZINC000894241477 721402010 /nfs/dbraw/zinc/40/20/10/721402010.db2.gz IUROYXPKTPHYLJ-OAHLLOKOSA-N 1 3 325.497 2.563 10 0 EFAEHO Cc1noc2ncc(C[NH2+]CCCCN3C[C@@H](C)O[C@H](C)C3)cc12 ZINC000894299925 722004987 /nfs/dbraw/zinc/00/49/87/722004987.db2.gz RUMOHXKVEIBZII-ZIAGYGMSSA-N 1 3 332.448 2.510 10 0 EFAEHO CC(C)(C[NH2+]CC1CN(C(=O)OC(C)(C)C)C1)CN1CCCC1 ZINC000894552304 722780652 /nfs/dbraw/zinc/78/06/52/722780652.db2.gz BPVHGUAJGKPSHU-UHFFFAOYSA-N 1 3 325.497 2.565 10 0 EFAEHO CC(C)[N@@H+]1CC[C@H](N(C)C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000909436897 723196390 /nfs/dbraw/zinc/19/63/90/723196390.db2.gz WLLYLDKZVFONFZ-KRWDZBQOSA-N 1 3 328.460 2.846 10 0 EFAEHO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000909436897 723196391 /nfs/dbraw/zinc/19/63/91/723196391.db2.gz WLLYLDKZVFONFZ-KRWDZBQOSA-N 1 3 328.460 2.846 10 0 EFAEHO COc1ccc(C2=NO[C@@H](C[NH2+][C@H]3CCN(C)C(C)(C)C3)C2)cc1 ZINC000895497349 724168976 /nfs/dbraw/zinc/16/89/76/724168976.db2.gz HWAHTSFKWHRJJF-DOTOQJQBSA-N 1 3 331.460 2.651 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)CCN1C ZINC000913949142 725964466 /nfs/dbraw/zinc/96/44/66/725964466.db2.gz DFCRNKSHPSIOAU-VQIMIIECSA-N 1 3 344.503 2.564 10 0 EFAEHO CN(CCCN(C)C(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12)Cc1ccco1 ZINC000908184305 727124896 /nfs/dbraw/zinc/12/48/96/727124896.db2.gz XRJOIYQPAMPAOK-FUHWJXTLSA-N 1 3 333.476 2.577 10 0 EFAEHO CN(CCCN(C)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12)Cc1ccco1 ZINC000908184305 727124899 /nfs/dbraw/zinc/12/48/99/727124899.db2.gz XRJOIYQPAMPAOK-FUHWJXTLSA-N 1 3 333.476 2.577 10 0 EFAEHO CN(CCCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21)Cc1ccco1 ZINC000908184304 727125072 /nfs/dbraw/zinc/12/50/72/727125072.db2.gz XRJOIYQPAMPAOK-AEFFLSMTSA-N 1 3 333.476 2.577 10 0 EFAEHO CN(CCCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21)Cc1ccco1 ZINC000908184304 727125075 /nfs/dbraw/zinc/12/50/75/727125075.db2.gz XRJOIYQPAMPAOK-AEFFLSMTSA-N 1 3 333.476 2.577 10 0 EFAEHO C[N@@H+]1CCC[C@]2(CCN(C(=O)c3ccc(NC4=NCCC4)cc3)C2)C1 ZINC000908423827 727183200 /nfs/dbraw/zinc/18/32/00/727183200.db2.gz SWIXPLQTJKSCPT-FQEVSTJZSA-N 1 3 340.471 2.849 10 0 EFAEHO C[N@H+]1CCC[C@]2(CCN(C(=O)c3ccc(NC4=NCCC4)cc3)C2)C1 ZINC000908423827 727183203 /nfs/dbraw/zinc/18/32/03/727183203.db2.gz SWIXPLQTJKSCPT-FQEVSTJZSA-N 1 3 340.471 2.849 10 0 EFAEHO C[C@@]1(NC(=O)c2cccc(C[NH+]3CCCCC3)c2)CN2CCC1CC2 ZINC000912374097 727703121 /nfs/dbraw/zinc/70/31/21/727703121.db2.gz KFDXUHZFYULWMT-OAQYLSRUSA-N 1 3 341.499 2.887 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2CC[N@H+](CCCF)CC2(C)C)c1 ZINC000941236994 727925780 /nfs/dbraw/zinc/92/57/80/727925780.db2.gz FIEMJZCWXNSGIG-SFHVURJKSA-N 1 3 349.494 2.938 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2CC[N@@H+](CCCF)CC2(C)C)c1 ZINC000941236994 727925782 /nfs/dbraw/zinc/92/57/82/727925782.db2.gz FIEMJZCWXNSGIG-SFHVURJKSA-N 1 3 349.494 2.938 10 0 EFAEHO Cc1oc2c(c1C(=O)NC1CC[NH+](C)CC1)CN(CCC(C)C)CC2 ZINC000169752022 728395304 /nfs/dbraw/zinc/39/53/04/728395304.db2.gz KQNQCLJBFUUSNQ-UHFFFAOYSA-N 1 3 347.503 2.816 10 0 EFAEHO CC(C)Oc1ccccc1CN1CCC([C@@H]2C[NH2+]C[C@H]2CO)CC1 ZINC000169789010 728403837 /nfs/dbraw/zinc/40/38/37/728403837.db2.gz VWIDNQGJVCTKAK-OALUTQOASA-N 1 3 332.488 2.514 10 0 EFAEHO C[NH+]1CCC(C(=O)NC[C@H]2CCN2CCCCc2ccccc2)CC1 ZINC001569371831 1085152513 /nfs/dbraw/zinc/15/25/13/1085152513.db2.gz VPUCZZDTQBXVKD-HXUWFJFHSA-N 1 3 343.515 2.542 10 0 EFAEHO CCCCC[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001569419050 1085194116 /nfs/dbraw/zinc/19/41/16/1085194116.db2.gz QVOYQADQCJKWLA-GOSISDBHSA-N 1 3 327.488 2.628 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CCCC2CCCC2)CCN1C(=O)Cc1c[nH]cn1 ZINC001569524164 1085338185 /nfs/dbraw/zinc/33/81/85/1085338185.db2.gz YFCLIOZWQUGHMB-WBVHZDCISA-N 1 3 332.492 2.892 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CCCC2CCCC2)CCN1C(=O)Cc1c[nH]cn1 ZINC001569524162 1085338267 /nfs/dbraw/zinc/33/82/67/1085338267.db2.gz YFCLIOZWQUGHMB-NVXWUHKLSA-N 1 3 332.492 2.892 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[NH2+]CCCc1ccccc1C)N(C)C ZINC001569545024 1085361867 /nfs/dbraw/zinc/36/18/67/1085361867.db2.gz UBSSPECWAKVNPY-VQTJNVASSA-N 1 3 345.531 2.848 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C[NH2+]CCC(C)(C)C)C1CCCC1 ZINC001569614656 1085440540 /nfs/dbraw/zinc/44/05/40/1085440540.db2.gz ZCTNYCFLGKBGJJ-KRWDZBQOSA-N 1 3 334.508 2.961 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@](C)(C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001569683454 1085514721 /nfs/dbraw/zinc/51/47/21/1085514721.db2.gz KGYZGPDOAVJRIZ-PSUSJVNBSA-N 1 3 343.515 2.868 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]CCc2ccc(C)cc2)C1 ZINC001569853306 1085676804 /nfs/dbraw/zinc/67/68/04/1085676804.db2.gz PAMYWKWWHNMATB-ICSRJNTNSA-N 1 3 345.531 2.563 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[C@H](C[NH2+]C/C=C/Cl)CC1)N(C)C ZINC001569865967 1085692708 /nfs/dbraw/zinc/69/27/08/1085692708.db2.gz BTBCZMMJBMUWKZ-PWWABLTLSA-N 1 3 343.943 2.837 10 0 EFAEHO CCCC[NH2+]CC[C@@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001570001983 1085843553 /nfs/dbraw/zinc/84/35/53/1085843553.db2.gz JMCDCWYIFFRUQG-APWZRJJASA-N 1 3 341.515 2.827 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](CC[NH2+]C/C=C\c2ccccc2)C1 ZINC001570018639 1085867186 /nfs/dbraw/zinc/86/71/86/1085867186.db2.gz HEMTXLJXQJDUAY-NSDNCLLMSA-N 1 3 341.499 2.624 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](CC[NH2+]C[C@@H]2CCC(F)(F)C2)C1 ZINC001570021611 1085868794 /nfs/dbraw/zinc/86/87/94/1085868794.db2.gz HWBZPGAUBPCDLX-HZPDHXFCSA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CC2=CCCCC2)CCC1 ZINC001570127470 1085968039 /nfs/dbraw/zinc/96/80/39/1085968039.db2.gz HMIWTWUYIBPOPP-CALCHBBNSA-N 1 3 333.520 2.988 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(C)([NH2+]CCCCCF)CC1 ZINC001570388058 1086188136 /nfs/dbraw/zinc/18/81/36/1086188136.db2.gz WAGUDKZSHHZRKY-QGZVFWFLSA-N 1 3 341.515 2.971 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H](C[NH2+]CCCc3ccccc3)C2)CCC1 ZINC001571126046 1086667894 /nfs/dbraw/zinc/66/78/94/1086667894.db2.gz QURQBEAMLXEMTK-WGSAOQKQSA-N 1 3 343.515 2.588 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H](C[NH2+]CCC3=CCCCC3)C2)CCC1 ZINC001571126364 1086667932 /nfs/dbraw/zinc/66/79/32/1086667932.db2.gz VTFPGOHNDPPYOA-IYARVYRRSA-N 1 3 333.520 2.846 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@H](C[NH2+]CCCC2CCC2)C1 ZINC001571197503 1086675060 /nfs/dbraw/zinc/67/50/60/1086675060.db2.gz BXJIPGJSWSAKLN-CAMMJAKZSA-N 1 3 335.536 2.924 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CCC2CCCC2)C1 ZINC001571197584 1086675327 /nfs/dbraw/zinc/67/53/27/1086675327.db2.gz FIFQILQJZJNTEB-GUDVDZBRSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@@H](CCC[NH2+]C[C@H]1CCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001571271526 1086693533 /nfs/dbraw/zinc/69/35/33/1086693533.db2.gz WZSSIYJIGKDVNZ-GJZGRUSLSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)CCC[NH2+]Cc1cccnc1 ZINC001571315173 1086712726 /nfs/dbraw/zinc/71/27/26/1086712726.db2.gz SEWJSTJJXHIVDF-PKOBYXMFSA-N 1 3 346.519 2.719 10 0 EFAEHO CCCCC[NH2+][C@@H](C)CN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001571406198 1086790835 /nfs/dbraw/zinc/79/08/35/1086790835.db2.gz XBIZEPMPPXVWHB-YJBOKZPZSA-N 1 3 329.504 2.826 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2ccccc2)[C@@H]1C ZINC001571467694 1086843642 /nfs/dbraw/zinc/84/36/42/1086843642.db2.gz PFKUMHBMLQCMHN-PKOBYXMFSA-N 1 3 331.504 2.538 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H]2CC[C@H](C[NH2+]C/C=C/Cl)C2)c1 ZINC001571550937 1086954383 /nfs/dbraw/zinc/95/43/83/1086954383.db2.gz WBUDXRCXCZOTKR-MKQQKPNSSA-N 1 3 349.906 2.989 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCC1=CCN(Cc2ccccc2)CC1 ZINC001571688961 1087052948 /nfs/dbraw/zinc/05/29/48/1087052948.db2.gz GFDCZBQDDJBGKH-FQEVSTJZSA-N 1 3 341.499 2.809 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCC1=CCN(Cc2ccccc2)CC1 ZINC001571688961 1087052954 /nfs/dbraw/zinc/05/29/54/1087052954.db2.gz GFDCZBQDDJBGKH-FQEVSTJZSA-N 1 3 341.499 2.809 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1=CC[N@H+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001571689381 1087053118 /nfs/dbraw/zinc/05/31/18/1087053118.db2.gz VEXBIHCTDZQVJQ-SFHVURJKSA-N 1 3 335.536 2.757 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1=CC[N@@H+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001571689381 1087053123 /nfs/dbraw/zinc/05/31/23/1087053123.db2.gz VEXBIHCTDZQVJQ-SFHVURJKSA-N 1 3 335.536 2.757 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@@H+]([C@@H](C)c2ccccc2)CC1)N(C)C ZINC001571695126 1087063583 /nfs/dbraw/zinc/06/35/83/1087063583.db2.gz DYKKQSDSHZEQNZ-LPHOPBHVSA-N 1 3 329.488 2.836 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@H+]([C@@H](C)c2ccccc2)CC1)N(C)C ZINC001571695126 1087063590 /nfs/dbraw/zinc/06/35/90/1087063590.db2.gz DYKKQSDSHZEQNZ-LPHOPBHVSA-N 1 3 329.488 2.836 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N(CCN(C)C)Cc3ccsc3)C[N@@H+]2C1 ZINC001646974728 1088691459 /nfs/dbraw/zinc/69/14/59/1088691459.db2.gz PESFLDQRSREBQT-NJAFHUGGSA-N 1 3 349.544 2.759 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N(CCN(C)C)Cc3ccsc3)C[N@H+]2C1 ZINC001646974728 1088691464 /nfs/dbraw/zinc/69/14/64/1088691464.db2.gz PESFLDQRSREBQT-NJAFHUGGSA-N 1 3 349.544 2.759 10 0 EFAEHO C[C@@H](NC(=O)[C@H](C)N1CCCC2(CC[NH2+]CC2)C1)c1ccccc1 ZINC001647334636 1089268234 /nfs/dbraw/zinc/26/82/34/1089268234.db2.gz LQFGPSWUCYDGJG-SJORKVTESA-N 1 3 329.488 2.718 10 0 EFAEHO c1[nH]nc(-c2ccc3c(c2)OCO3)c1C[NH2+]CCCN1CCCCC1 ZINC001648725134 1092259970 /nfs/dbraw/zinc/25/99/70/1092259970.db2.gz FXDXFBBKQUDBND-UHFFFAOYSA-N 1 3 342.443 2.771 10 0 EFAEHO C[N@H+](CCCCC(F)(F)F)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001283340024 1092282900 /nfs/dbraw/zinc/28/29/00/1092282900.db2.gz DWVISOFLMDUTBU-UHFFFAOYSA-N 1 3 349.441 2.738 10 0 EFAEHO C[N@@H+](CCCCC(F)(F)F)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001283340024 1092282913 /nfs/dbraw/zinc/28/29/13/1092282913.db2.gz DWVISOFLMDUTBU-UHFFFAOYSA-N 1 3 349.441 2.738 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001267070372 1092540994 /nfs/dbraw/zinc/54/09/94/1092540994.db2.gz LOAMFJLIZKDWLZ-IBGZPJMESA-N 1 3 345.531 2.706 10 0 EFAEHO C[NH+](C)[C@H]1CCCC[C@@H]1NC(=O)c1cccc(CN2CCCC2)c1 ZINC001649698496 1092596452 /nfs/dbraw/zinc/59/64/52/1092596452.db2.gz AOFHYVTVDMRZMX-OALUTQOASA-N 1 3 329.488 2.885 10 0 EFAEHO CC[NH2+]CCc1ccc(CNC(=O)c2cccc(CN(C)C)c2)cc1 ZINC001267098854 1092699116 /nfs/dbraw/zinc/69/91/16/1092699116.db2.gz WUTUTAIOSTXFKJ-UHFFFAOYSA-N 1 3 339.483 2.830 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]Cc1ccc(F)cc1C ZINC001267117169 1092801082 /nfs/dbraw/zinc/80/10/82/1092801082.db2.gz NXXMOKPPJMHXNR-GOSISDBHSA-N 1 3 335.467 2.557 10 0 EFAEHO C[C@H]([NH2+]CCCCCF)C1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001267201670 1093180456 /nfs/dbraw/zinc/18/04/56/1093180456.db2.gz QWFDYOGLPKRJES-SJORKVTESA-N 1 3 341.515 2.685 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H](C[NH2+]CCC(C)(C)C)C1CC1)N(C)C ZINC001283552671 1093627134 /nfs/dbraw/zinc/62/71/34/1093627134.db2.gz JJLASHZHADSZGA-IRXDYDNUSA-N 1 3 325.541 2.835 10 0 EFAEHO CN(CCNC(=O)C1CC[NH+](CC2CC2)CC1)CC1=CCCCC1 ZINC001480934278 1094293865 /nfs/dbraw/zinc/29/38/65/1094293865.db2.gz DYELXRLXLNXASM-UHFFFAOYSA-N 1 3 333.520 2.657 10 0 EFAEHO CCC[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC[C@@H](C)F ZINC001493318260 1094448657 /nfs/dbraw/zinc/44/86/57/1094448657.db2.gz ORTHZNKWLLULPN-CRAIPNDOSA-N 1 3 347.494 2.775 10 0 EFAEHO CCC[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC[C@@H](C)F ZINC001493318260 1094448662 /nfs/dbraw/zinc/44/86/62/1094448662.db2.gz ORTHZNKWLLULPN-CRAIPNDOSA-N 1 3 347.494 2.775 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[NH2+]CC2CCC(C)(C)CC2)CC1 ZINC001267444497 1094534885 /nfs/dbraw/zinc/53/48/85/1094534885.db2.gz GOWCRRSNNPNWJB-UHFFFAOYSA-N 1 3 337.552 2.983 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@H+](CC2=CCCCC2)C1)CC(C)(C)C ZINC001481112885 1094618529 /nfs/dbraw/zinc/61/85/29/1094618529.db2.gz UBUWKFHAADAJEK-SFHVURJKSA-N 1 3 335.536 2.903 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@@H+](CC2=CCCCC2)C1)CC(C)(C)C ZINC001481112885 1094618532 /nfs/dbraw/zinc/61/85/32/1094618532.db2.gz UBUWKFHAADAJEK-SFHVURJKSA-N 1 3 335.536 2.903 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[N@H+](CCC3CCCCC3)C2)C1 ZINC001481112937 1094618550 /nfs/dbraw/zinc/61/85/50/1094618550.db2.gz UQJIWMCYUKVJCL-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[N@@H+](CCC3CCCCC3)C2)C1 ZINC001481112937 1094618554 /nfs/dbraw/zinc/61/85/54/1094618554.db2.gz UQJIWMCYUKVJCL-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CC[N@H+](CCC3CCCCC3)C2)C1 ZINC001481112939 1094618698 /nfs/dbraw/zinc/61/86/98/1094618698.db2.gz UQJIWMCYUKVJCL-MJGOQNOKSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CC[N@@H+](CCC3CCCCC3)C2)C1 ZINC001481112939 1094618702 /nfs/dbraw/zinc/61/87/02/1094618702.db2.gz UQJIWMCYUKVJCL-MJGOQNOKSA-N 1 3 335.536 2.737 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N(C)CC[NH2+]CCc2cccs2)c1 ZINC001267472945 1094760201 /nfs/dbraw/zinc/76/02/01/1094760201.db2.gz CPKOBFSFNMAAFH-UHFFFAOYSA-N 1 3 345.512 2.714 10 0 EFAEHO CCC[N@H+](CCNC(=O)C1(N(C)C)CCC1)C[C@@H]1CCC(F)(F)C1 ZINC001481137892 1094924582 /nfs/dbraw/zinc/92/45/82/1094924582.db2.gz ZKYSLKBYOPYOEE-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CCC[N@@H+](CCNC(=O)C1(N(C)C)CCC1)C[C@@H]1CCC(F)(F)C1 ZINC001481137892 1094924596 /nfs/dbraw/zinc/92/45/96/1094924596.db2.gz ZKYSLKBYOPYOEE-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@H+](C)Cc2ccc(CF)cc2)C1 ZINC001481507671 1094991031 /nfs/dbraw/zinc/99/10/31/1094991031.db2.gz DELCCBGGVZSGPX-LJQANCHMSA-N 1 3 349.494 2.777 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@@H+](C)Cc2ccc(CF)cc2)C1 ZINC001481507671 1094991040 /nfs/dbraw/zinc/99/10/40/1094991040.db2.gz DELCCBGGVZSGPX-LJQANCHMSA-N 1 3 349.494 2.777 10 0 EFAEHO CCCN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)Cc1csc(C)c1 ZINC001481151422 1094999356 /nfs/dbraw/zinc/99/93/56/1094999356.db2.gz FWERAAWPPQCBLZ-MRXNPFEDSA-N 1 3 337.533 2.727 10 0 EFAEHO CCCN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)Cc1csc(C)c1 ZINC001481151422 1094999360 /nfs/dbraw/zinc/99/93/60/1094999360.db2.gz FWERAAWPPQCBLZ-MRXNPFEDSA-N 1 3 337.533 2.727 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[N@@H+](CC1CCC(C)CC1)C1CC1 ZINC001481196222 1095253989 /nfs/dbraw/zinc/25/39/89/1095253989.db2.gz WMGRSBUFSLSXQV-UHFFFAOYSA-N 1 3 332.492 2.668 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[N@H+](CC1CCC(C)CC1)C1CC1 ZINC001481196222 1095254008 /nfs/dbraw/zinc/25/40/08/1095254008.db2.gz WMGRSBUFSLSXQV-UHFFFAOYSA-N 1 3 332.492 2.668 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NC[C@@H](NCC2=CCCCC2)c2ccccc2)C1 ZINC001267526540 1095307620 /nfs/dbraw/zinc/30/76/20/1095307620.db2.gz VXFFDNVXYLQUER-VQTJNVASSA-N 1 3 341.499 2.886 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NC[C@@H](NCC2=CCCCC2)c2ccccc2)C1 ZINC001267526540 1095307636 /nfs/dbraw/zinc/30/76/36/1095307636.db2.gz VXFFDNVXYLQUER-VQTJNVASSA-N 1 3 341.499 2.886 10 0 EFAEHO CC/C=C\CC[NH2+][C@@H]1CCN(C(=O)CN2CCC(C)CC2)C[C@H]1C ZINC001268137508 1095474981 /nfs/dbraw/zinc/47/49/81/1095474981.db2.gz HWUAYIATURFKQH-CQQBRXBZSA-N 1 3 335.536 2.901 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC[C@@H]1CCCCN1C(=O)CN(C)C1CCC1 ZINC001268152967 1095545183 /nfs/dbraw/zinc/54/51/83/1095545183.db2.gz BPTUKKHUVPQQRS-WBVHZDCISA-N 1 3 327.488 2.580 10 0 EFAEHO CCN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1cc(F)ccc1C ZINC001480992704 1095694546 /nfs/dbraw/zinc/69/45/46/1095694546.db2.gz XXKZLZILFRXSSF-UHFFFAOYSA-N 1 3 349.494 2.947 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1CC[NH2+]Cc1ccccc1 ZINC001268166866 1095752269 /nfs/dbraw/zinc/75/22/69/1095752269.db2.gz OOBVMBOCRNYOSB-LJQANCHMSA-N 1 3 331.504 2.888 10 0 EFAEHO CC[N@H+](CCNC(=O)[C@@H](C(C)C)N(C)C)Cc1ccc2cc[nH]c2c1 ZINC001481012954 1095827929 /nfs/dbraw/zinc/82/79/29/1095827929.db2.gz GWXGIWYAYFAEKF-LJQANCHMSA-N 1 3 344.503 2.692 10 0 EFAEHO CC[N@@H+](CCNC(=O)[C@@H](C(C)C)N(C)C)Cc1ccc2cc[nH]c2c1 ZINC001481012954 1095827943 /nfs/dbraw/zinc/82/79/43/1095827943.db2.gz GWXGIWYAYFAEKF-LJQANCHMSA-N 1 3 344.503 2.692 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC[C@H]1CCCCN1C(=O)CN1CCC(C)CC1 ZINC001268168289 1095855249 /nfs/dbraw/zinc/85/52/49/1095855249.db2.gz VOOAPIQSOLEIKQ-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)=CC[NH2+]C1CC(N(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001279288797 1096098776 /nfs/dbraw/zinc/09/87/76/1096098776.db2.gz ZLPVSWKNHVDQFK-LADRWXRNSA-N 1 3 339.499 2.744 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N(C)CCN(C)CC1=CCCCC1 ZINC001268242938 1096166337 /nfs/dbraw/zinc/16/63/37/1096166337.db2.gz RQXXJPQPARTHLD-IBGZPJMESA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N(C)CCN(C)CC1=CCCCC1 ZINC001268242938 1096166345 /nfs/dbraw/zinc/16/63/45/1096166345.db2.gz RQXXJPQPARTHLD-IBGZPJMESA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]CC1CC2(CCC2)C1 ZINC001268364111 1096397975 /nfs/dbraw/zinc/39/79/75/1096397975.db2.gz AUXHBWXOTMOFAN-WMZOPIPTSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccc2c(c1)CCC2)NC(=O)CN1CC[C@H](C)C1 ZINC001268399872 1096493903 /nfs/dbraw/zinc/49/39/03/1096493903.db2.gz NDFRYHQCPIUYJO-DLBZAZTESA-N 1 3 343.515 2.502 10 0 EFAEHO C[C@H](CC[NH2+]Cc1cccc(F)c1)NC(=O)CN(C)CC(C)(C)C ZINC001268403638 1096504649 /nfs/dbraw/zinc/50/46/49/1096504649.db2.gz JWSYKQITKXFACY-OAHLLOKOSA-N 1 3 337.483 2.788 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccsc1)NC(=O)CN(C)CC(C)(C)C ZINC001268403220 1096506510 /nfs/dbraw/zinc/50/65/10/1096506510.db2.gz JHZZXGMTBSUQLD-AWEZNQCLSA-N 1 3 325.522 2.710 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CC[C@H](C)NC(=O)[C@@H](C(C)C)N(C)C ZINC001268418576 1096568431 /nfs/dbraw/zinc/56/84/31/1096568431.db2.gz YMZRMVTWCCFZQY-MAUKXSAKSA-N 1 3 337.483 2.705 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+]Cc1cc2ccccc2o1 ZINC001268427067 1096582830 /nfs/dbraw/zinc/58/28/30/1096582830.db2.gz UNFSJUWVPNXJBP-OAHLLOKOSA-N 1 3 331.460 2.757 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]Cc1cccc(C)c1 ZINC001268425140 1096583663 /nfs/dbraw/zinc/58/36/63/1096583663.db2.gz CNCRFQZUNPLUPE-IEBWSBKVSA-N 1 3 331.504 2.854 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1ccc(F)cc1C ZINC001481816759 1096732892 /nfs/dbraw/zinc/73/28/92/1096732892.db2.gz OWVNGIXXZWBECN-RTBURBONSA-N 1 3 349.494 2.993 10 0 EFAEHO CCN(CC[NH2+]CC1CCCCC1)C(=O)CN(C)CC(C)(C)C ZINC001268479743 1096897339 /nfs/dbraw/zinc/89/73/39/1096897339.db2.gz RRXWZGOUJCNFIU-UHFFFAOYSA-N 1 3 325.541 2.983 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1(C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CCCC1 ZINC001481911706 1096913579 /nfs/dbraw/zinc/91/35/79/1096913579.db2.gz LOWAODZNFIFHHJ-ZACQAIPSSA-N 1 3 344.503 2.715 10 0 EFAEHO CCN(CCNCc1cnccc1C)C(=O)[C@H]1CCCC[N@@H+]1C(C)C ZINC001268482021 1096918914 /nfs/dbraw/zinc/91/89/14/1096918914.db2.gz KRUSPBNRFDZCTI-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO CCN(CCNCc1cnccc1C)C(=O)[C@H]1CCCC[N@H+]1C(C)C ZINC001268482021 1096918918 /nfs/dbraw/zinc/91/89/18/1096918918.db2.gz KRUSPBNRFDZCTI-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H](CC[NH2+]C/C=C\Cl)C1 ZINC001481990436 1097054664 /nfs/dbraw/zinc/05/46/64/1097054664.db2.gz AAVYMKHWEROZHF-IRMRGROASA-N 1 3 341.927 2.832 10 0 EFAEHO CCC[NH2+]CCC1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001482004448 1097078916 /nfs/dbraw/zinc/07/89/16/1097078916.db2.gz RGBVFEYZNSSQPC-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[NH2+]CCC(C)(C)C)CC1)N(C)C ZINC001482006948 1097084639 /nfs/dbraw/zinc/08/46/39/1097084639.db2.gz DXYVZSHCXYFAQS-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@H]([NH2+]C/C=C\CNC(=O)[C@@H]1CCCN1C)c1ccc2c(c1)CCC2 ZINC001268523475 1097126898 /nfs/dbraw/zinc/12/68/98/1097126898.db2.gz QWVLCTYIWSIVPZ-KIOMOSBCSA-N 1 3 341.499 2.593 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)[C@H]2CCC[N@H+]2C(C)C)c(C)s1 ZINC001268541764 1097155355 /nfs/dbraw/zinc/15/53/55/1097155355.db2.gz LWWQCZUSKAUNIG-DUMMIQTOSA-N 1 3 349.544 3.000 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)[C@H]2CCC[N@@H+]2C(C)C)c(C)s1 ZINC001268541764 1097155359 /nfs/dbraw/zinc/15/53/59/1097155359.db2.gz LWWQCZUSKAUNIG-DUMMIQTOSA-N 1 3 349.544 3.000 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]C/C=C\CNC(=O)[C@H](C(C)C)N(C)C ZINC001268552648 1097177704 /nfs/dbraw/zinc/17/77/04/1097177704.db2.gz RRDONWOQSCMKQQ-OSZLDNFMSA-N 1 3 331.504 2.904 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC1CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001482051538 1097183905 /nfs/dbraw/zinc/18/39/05/1097183905.db2.gz FZUQACIRQNTJTH-AQNXPRMDSA-N 1 3 349.563 2.981 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001482059053 1097200404 /nfs/dbraw/zinc/20/04/04/1097200404.db2.gz YPYMBSBQQSRELI-UONOGXRCSA-N 1 3 348.318 2.760 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001482059053 1097200408 /nfs/dbraw/zinc/20/04/08/1097200408.db2.gz YPYMBSBQQSRELI-UONOGXRCSA-N 1 3 348.318 2.760 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]CC[C@@H]1CCCC1(F)F ZINC001482107161 1097268413 /nfs/dbraw/zinc/26/84/13/1097268413.db2.gz FYBZEZNZTFHSEE-GJZGRUSLSA-N 1 3 345.478 2.638 10 0 EFAEHO C[C@@H](NC/C=C\CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(F)c1 ZINC001268584361 1097291046 /nfs/dbraw/zinc/29/10/46/1097291046.db2.gz YTVFZASCFNKGNK-BYFNMEEJSA-N 1 3 347.478 2.879 10 0 EFAEHO C[C@@H](NC/C=C\CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(F)c1 ZINC001268584361 1097291049 /nfs/dbraw/zinc/29/10/49/1097291049.db2.gz YTVFZASCFNKGNK-BYFNMEEJSA-N 1 3 347.478 2.879 10 0 EFAEHO C[C@H](NC/C=C\CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(F)c1 ZINC001268584363 1097291112 /nfs/dbraw/zinc/29/11/12/1097291112.db2.gz YTVFZASCFNKGNK-JDHQYPSRSA-N 1 3 347.478 2.879 10 0 EFAEHO C[C@H](NC/C=C\CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(F)c1 ZINC001268584363 1097291116 /nfs/dbraw/zinc/29/11/16/1097291116.db2.gz YTVFZASCFNKGNK-JDHQYPSRSA-N 1 3 347.478 2.879 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/C[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001268587300 1097306415 /nfs/dbraw/zinc/30/64/15/1097306415.db2.gz IKTDYBQRGOVREA-DOOVEFGSSA-N 1 3 345.478 2.660 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C\C[NH2+][C@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001268593288 1097329319 /nfs/dbraw/zinc/32/93/19/1097329319.db2.gz UBTPSUDKXLDZTK-SLXDBMQSSA-N 1 3 349.906 2.930 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\CNCc1cccc(F)c1)[NH+]1CCCC1 ZINC001268630151 1097484167 /nfs/dbraw/zinc/48/41/67/1097484167.db2.gz GFPHLJFFQDMGEB-ZRHASKPBSA-N 1 3 347.478 2.708 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CCCc1cccc(F)c1 ZINC001268674029 1097527489 /nfs/dbraw/zinc/52/74/89/1097527489.db2.gz NFNRJMHRNSILOQ-VQIMIIECSA-N 1 3 349.494 2.727 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@@H](C)NC(=O)[C@H]1CCCCN1CC ZINC001268673604 1097527689 /nfs/dbraw/zinc/52/76/89/1097527689.db2.gz IKJMWDHSAMVQLY-YLJYHZDGSA-N 1 3 345.531 2.760 10 0 EFAEHO CN(CCC[NH2+]Cc1cccc(C(F)F)c1)C(=O)[C@H]1CCCN1C ZINC001268782533 1097628145 /nfs/dbraw/zinc/62/81/45/1097628145.db2.gz ABZSNBIJYNPVMP-MRXNPFEDSA-N 1 3 339.430 2.657 10 0 EFAEHO CC(C)c1cccc(C[NH2+]CCCN(C)C(=O)[C@@H]2CCCCN2C)n1 ZINC001268803254 1097652487 /nfs/dbraw/zinc/65/24/87/1097652487.db2.gz XSUYHPJOCWCDRD-IBGZPJMESA-N 1 3 346.519 2.627 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CCCN(C)C(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001268840456 1097678227 /nfs/dbraw/zinc/67/82/27/1097678227.db2.gz WJLXCXCEHQRIFH-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CCCN(C)C(=O)[C@H](C(C)C)N(C)C)c1 ZINC001268920800 1097719400 /nfs/dbraw/zinc/71/94/00/1097719400.db2.gz WJLXCXCEHQRIFH-IBGZPJMESA-N 1 3 333.520 2.828 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[NH2+]CCc1cccs1 ZINC001268961769 1097753201 /nfs/dbraw/zinc/75/32/01/1097753201.db2.gz HCTVTCHVIMUNFQ-QGZVFWFLSA-N 1 3 337.533 2.603 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N(C)[C@@H]1CC[N@H+](CCCCCF)C1 ZINC001269240425 1097975966 /nfs/dbraw/zinc/97/59/66/1097975966.db2.gz LDEUUEDIPOFDGC-SJORKVTESA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N(C)[C@@H]1CC[N@@H+](CCCCCF)C1 ZINC001269240425 1097975972 /nfs/dbraw/zinc/97/59/72/1097975972.db2.gz LDEUUEDIPOFDGC-SJORKVTESA-N 1 3 327.488 2.532 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001269740363 1098413084 /nfs/dbraw/zinc/41/30/84/1098413084.db2.gz DYPBTZJQEFFRMI-AZUAARDMSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCCC[N@H+]1CC[C@@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001269740363 1098413087 /nfs/dbraw/zinc/41/30/87/1098413087.db2.gz DYPBTZJQEFFRMI-AZUAARDMSA-N 1 3 335.536 2.833 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269742165 1098416748 /nfs/dbraw/zinc/41/67/48/1098416748.db2.gz QUPXOBOJWIVWAW-CXFSXTNSSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269742165 1098416749 /nfs/dbraw/zinc/41/67/49/1098416749.db2.gz QUPXOBOJWIVWAW-CXFSXTNSSA-N 1 3 335.536 2.997 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@H](CC[NH2+]CCCC2CCC2)C1 ZINC001269771182 1098437170 /nfs/dbraw/zinc/43/71/70/1098437170.db2.gz YTRHKJIZWQTANU-QGZVFWFLSA-N 1 3 332.492 2.751 10 0 EFAEHO Cc1cc(C[NH2+]CCC2CCN(C(=O)CN3CCCC3)CC2)cs1 ZINC001269943410 1098535577 /nfs/dbraw/zinc/53/55/77/1098535577.db2.gz MWSIOEPYXZHMGR-UHFFFAOYSA-N 1 3 349.544 2.871 10 0 EFAEHO Cc1ccccc1C[NH2+]CCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001481279550 1098605134 /nfs/dbraw/zinc/60/51/34/1098605134.db2.gz JGAFMABGQYGPEW-FQEVSTJZSA-N 1 3 349.494 2.756 10 0 EFAEHO C[C@H](C(=O)N[C@H]1CC[C@H]([NH2+]CCCF)CC1)N1CCCCCC1 ZINC001270025101 1098608187 /nfs/dbraw/zinc/60/81/87/1098608187.db2.gz WRYCENIPUHDDDQ-BRWVUGGUSA-N 1 3 327.488 2.628 10 0 EFAEHO Cc1cccc(C[NH2+]CCC2CCN(C(=O)Cc3c[nH]cn3)CC2)c1 ZINC001267915703 1098626995 /nfs/dbraw/zinc/62/69/95/1098626995.db2.gz NRMJOEBJYPPWGH-UHFFFAOYSA-N 1 3 340.471 2.679 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC[NH2+]Cc2ccc(F)cc2)CC1)N(C)C ZINC001267917619 1098638446 /nfs/dbraw/zinc/63/84/46/1098638446.db2.gz NMAVTXNENJLOOA-IBGZPJMESA-N 1 3 349.494 2.884 10 0 EFAEHO CN(CC[NH2+]Cc1ccc(F)c(Cl)c1)C(=O)CN(C)C1CCC1 ZINC001481240712 1098776214 /nfs/dbraw/zinc/77/62/14/1098776214.db2.gz VLNMOQNZSOEHKZ-UHFFFAOYSA-N 1 3 341.858 2.511 10 0 EFAEHO CC(C)=CC[N@@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001267751814 1098790388 /nfs/dbraw/zinc/79/03/88/1098790388.db2.gz ARNLPMGDXVZPIL-UHFFFAOYSA-N 1 3 335.536 2.855 10 0 EFAEHO CC(C)=CC[N@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001267751814 1098790398 /nfs/dbraw/zinc/79/03/98/1098790398.db2.gz ARNLPMGDXVZPIL-UHFFFAOYSA-N 1 3 335.536 2.855 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]CC[C@H]1CCCC1(F)F ZINC001267968771 1098978243 /nfs/dbraw/zinc/97/82/43/1098978243.db2.gz CFZMKEQUPGXSNV-HZPDHXFCSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H]1CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001267969453 1098980988 /nfs/dbraw/zinc/98/09/88/1098980988.db2.gz JBQXTHOBSXEDPE-CRAIPNDOSA-N 1 3 335.467 2.691 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001481290539 1099021270 /nfs/dbraw/zinc/02/12/70/1099021270.db2.gz LWZYRFZNNBMCER-RTBURBONSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001481290539 1099021279 /nfs/dbraw/zinc/02/12/79/1099021279.db2.gz LWZYRFZNNBMCER-RTBURBONSA-N 1 3 347.478 2.699 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C[NH2+]CCCF)C1CCCC1 ZINC001270442368 1099091847 /nfs/dbraw/zinc/09/18/47/1099091847.db2.gz LUFPLZVHNRAGBG-MSOLQXFVSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001268002746 1099140016 /nfs/dbraw/zinc/14/00/16/1099140016.db2.gz DNIZQUHFZPJCDM-QAPCUYQASA-N 1 3 327.488 2.507 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001268002744 1099140034 /nfs/dbraw/zinc/14/00/34/1099140034.db2.gz DNIZQUHFZPJCDM-CRAIPNDOSA-N 1 3 327.488 2.507 10 0 EFAEHO CCCCC[N@@H+]1CC[C@]2(C1)CCCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001270512520 1099160248 /nfs/dbraw/zinc/16/02/48/1099160248.db2.gz JAELDHXWONBUHZ-IBGZPJMESA-N 1 3 332.492 2.847 10 0 EFAEHO CCCCC[N@H+]1CC[C@]2(C1)CCCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001270512520 1099160254 /nfs/dbraw/zinc/16/02/54/1099160254.db2.gz JAELDHXWONBUHZ-IBGZPJMESA-N 1 3 332.492 2.847 10 0 EFAEHO C[C@H](CNC(=O)c1cccc(CN(C)C)c1)C[NH2+]CCC(F)(F)F ZINC001268015533 1099186563 /nfs/dbraw/zinc/18/65/63/1099186563.db2.gz OTGUPZRTNAOZPS-ZDUSSCGKSA-N 1 3 345.409 2.656 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@]1(C)CC[N@H+](CCCCCF)C1 ZINC001270582547 1099231004 /nfs/dbraw/zinc/23/10/04/1099231004.db2.gz IHMCVJSQNSQHFY-WMZOPIPTSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@]1(C)CC[N@@H+](CCCCCF)C1 ZINC001270582547 1099231008 /nfs/dbraw/zinc/23/10/08/1099231008.db2.gz IHMCVJSQNSQHFY-WMZOPIPTSA-N 1 3 327.488 2.580 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]CCCc1ccccc1 ZINC001481319740 1099277608 /nfs/dbraw/zinc/27/76/08/1099277608.db2.gz MAEPPQAGBMFWRF-LJQANCHMSA-N 1 3 331.504 2.542 10 0 EFAEHO CC[NH+](CC)CCCNC1(CC(=O)OC(C)(C)C)CCOCC1 ZINC001618747794 1099315626 /nfs/dbraw/zinc/31/56/26/1099315626.db2.gz KCZAJXWZKMABCD-UHFFFAOYSA-N 1 3 328.497 2.589 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]([NH2+]CC1CC1)c1ccccc1 ZINC001481367476 1099488587 /nfs/dbraw/zinc/48/85/87/1099488587.db2.gz TUUQSRZOVZFIGW-OALUTQOASA-N 1 3 329.488 2.716 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CC1CC1)c1ccccc1 ZINC001481367475 1099488809 /nfs/dbraw/zinc/48/88/09/1099488809.db2.gz TUUQSRZOVZFIGW-MOPGFXCFSA-N 1 3 329.488 2.716 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001270796645 1099568973 /nfs/dbraw/zinc/56/89/73/1099568973.db2.gz IHFVEQYDHNWEPQ-MAUKXSAKSA-N 1 3 329.504 2.541 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC2(C[NH2+]CC=C(Cl)Cl)CCCC2)C1 ZINC001267840566 1099579594 /nfs/dbraw/zinc/57/95/94/1099579594.db2.gz BRJGKLATATWXOR-CYBMUJFWSA-N 1 3 348.318 2.666 10 0 EFAEHO Cc1cccnc1CNC[C@H](C)N(C)C(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC001482336395 1099666799 /nfs/dbraw/zinc/66/67/99/1099666799.db2.gz HYAPBPMKIHWPAM-ZWKOTPCHSA-N 1 3 346.519 2.591 10 0 EFAEHO CCCN(C)CC(=O)N[C@]1(C[NH2+]C/C=C/Cl)CCCC[C@@H]1C ZINC001267874352 1099792876 /nfs/dbraw/zinc/79/28/76/1099792876.db2.gz SXAVDXGOGIUSLB-FIEKWJHISA-N 1 3 329.916 2.735 10 0 EFAEHO C[NH+](C)CCC(=O)NCC[C@@H]1CCN(Cc2ccccc2Cl)C1 ZINC001481446174 1099867959 /nfs/dbraw/zinc/86/79/59/1099867959.db2.gz DISWOXKJEFQAGL-OAHLLOKOSA-N 1 3 337.895 2.620 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+][C@@H]1CCCc2ccccc21 ZINC001482368943 1099870874 /nfs/dbraw/zinc/87/08/74/1099870874.db2.gz JUTPYOKTIKPSKK-VQIMIIECSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)C[C@@H](CNCc1ccccn1)NC(=O)[C@@H]1CCC[N@@H+]1C(C)C ZINC001482384544 1099961196 /nfs/dbraw/zinc/96/11/96/1099961196.db2.gz SLXRZFMZIFDYET-OALUTQOASA-N 1 3 346.519 2.575 10 0 EFAEHO CC(C)C[C@@H](CNCc1ccccn1)NC(=O)[C@@H]1CCC[N@H+]1C(C)C ZINC001482384544 1099961206 /nfs/dbraw/zinc/96/12/06/1099961206.db2.gz SLXRZFMZIFDYET-OALUTQOASA-N 1 3 346.519 2.575 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N[C@@H](CNCCF)C2CCCCC2)C1 ZINC001482410631 1100067597 /nfs/dbraw/zinc/06/75/97/1100067597.db2.gz YQIHTOYOJDVIGN-MSOLQXFVSA-N 1 3 341.515 2.733 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N[C@@H](CNCCF)C2CCCCC2)C1 ZINC001482410631 1100067603 /nfs/dbraw/zinc/06/76/03/1100067603.db2.gz YQIHTOYOJDVIGN-MSOLQXFVSA-N 1 3 341.515 2.733 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H](C)C[NH2+]CCC1CCCCC1)N(C)C ZINC001271090871 1100462730 /nfs/dbraw/zinc/46/27/30/1100462730.db2.gz BVJBGQUJACSKFV-SJLPKXTDSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001271094284 1100475675 /nfs/dbraw/zinc/47/56/75/1100475675.db2.gz WFGJDJAVLKCXAN-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001271094284 1100475679 /nfs/dbraw/zinc/47/56/79/1100475679.db2.gz WFGJDJAVLKCXAN-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001271099919 1100480240 /nfs/dbraw/zinc/48/02/40/1100480240.db2.gz HABQWQGHRJGUHN-HZPDHXFCSA-N 1 3 347.494 2.836 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001271099919 1100480243 /nfs/dbraw/zinc/48/02/43/1100480243.db2.gz HABQWQGHRJGUHN-HZPDHXFCSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC[C@H]2C[NH2+]C/C=C/Cl)C1 ZINC001671346956 1101386970 /nfs/dbraw/zinc/38/69/70/1101386970.db2.gz MHJMTENOSJBCPZ-YUSJOORSSA-N 1 3 345.890 2.532 10 0 EFAEHO Cc1cc(C)c(CN(C)CCNC(=O)[C@@H]2C[NH+]3CCC2CC3)c(C)c1 ZINC001480865696 1101402070 /nfs/dbraw/zinc/40/20/70/1101402070.db2.gz NSTVBWMJUMXGAP-HXUWFJFHSA-N 1 3 343.515 2.502 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C[NH2+]C/C=C/Cl)C1CCCCC1)N(C)C ZINC001271355615 1101433170 /nfs/dbraw/zinc/43/31/70/1101433170.db2.gz YFHDVFRSCLDKHM-ZJJGVRJWSA-N 1 3 343.943 2.980 10 0 EFAEHO C[C@H]([NH2+]CCCF)[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001482483761 1101491277 /nfs/dbraw/zinc/49/12/77/1101491277.db2.gz WNHYPZPPOBUBTP-JKSUJKDBSA-N 1 3 329.504 2.541 10 0 EFAEHO CC(C)=CCN(CCNC(=O)c1ccc(C[NH+](C)C)cc1)C1CC1 ZINC001266615934 1101498416 /nfs/dbraw/zinc/49/84/16/1101498416.db2.gz WASICORNBMWFAB-UHFFFAOYSA-N 1 3 329.488 2.909 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)[N@H+](CC2=CCCCC2)C3)CCC1 ZINC001271416116 1101551340 /nfs/dbraw/zinc/55/13/40/1101551340.db2.gz YTTFDNHAXDZGAZ-OTWHNJEPSA-N 1 3 345.531 2.940 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](CC2=CCCCC2)C3)CCC1 ZINC001271416116 1101551348 /nfs/dbraw/zinc/55/13/48/1101551348.db2.gz YTTFDNHAXDZGAZ-OTWHNJEPSA-N 1 3 345.531 2.940 10 0 EFAEHO CN(CC[N@H+](C)C1CCN(C)CC1)Cc1ccc([Si](C)(C)C)cc1 ZINC001653154151 1101592552 /nfs/dbraw/zinc/59/25/52/1101592552.db2.gz JLRHQOICVJKOMZ-UHFFFAOYSA-N 1 3 347.623 2.690 10 0 EFAEHO CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1ccc([Si](C)(C)C)cc1 ZINC001653154151 1101592564 /nfs/dbraw/zinc/59/25/64/1101592564.db2.gz JLRHQOICVJKOMZ-UHFFFAOYSA-N 1 3 347.623 2.690 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]CCCC(C)(C)C)C1 ZINC001672339438 1101619439 /nfs/dbraw/zinc/61/94/39/1101619439.db2.gz WTKBTUUFVMWFOU-DLBZAZTESA-N 1 3 325.541 2.837 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@H]1CCN1[C@H]1CCCc2ccccc21 ZINC001670713482 1101634907 /nfs/dbraw/zinc/63/49/07/1101634907.db2.gz JEBHYWWJCGSUHQ-QUCCMNQESA-N 1 3 343.515 2.986 10 0 EFAEHO Cc1ccccc1[C@H](C)N1CC[C@@H]1CNC(=O)CCCC[NH+](C)C ZINC001670714669 1101636159 /nfs/dbraw/zinc/63/61/59/1101636159.db2.gz UGCADLXJDNQUFV-ZWKOTPCHSA-N 1 3 331.504 2.978 10 0 EFAEHO CCCCCC[NH+]1CCC2(C[C@@H]2NC(=O)Cc2nc[nH]c2C)CC1 ZINC001266381058 1101791457 /nfs/dbraw/zinc/79/14/57/1101791457.db2.gz WZWOEMNLYVFPHF-KRWDZBQOSA-N 1 3 332.492 2.812 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)cc1 ZINC001266691219 1101913094 /nfs/dbraw/zinc/91/30/94/1101913094.db2.gz ZGYLKDKMHHYRIR-KDURUIRLSA-N 1 3 343.515 2.649 10 0 EFAEHO CCCCCN1CC[C@H]1CN(C)C(=O)C1CC[NH+](CC2CC2)CC1 ZINC001656102612 1101954255 /nfs/dbraw/zinc/95/42/55/1101954255.db2.gz MXRYHMHBCIVDBA-IBGZPJMESA-N 1 3 335.536 2.831 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@@H]1CCCCN1C(=O)[C@H]1CCCN1C ZINC001271567271 1102124918 /nfs/dbraw/zinc/12/49/18/1102124918.db2.gz WXVMBODAIQZSGE-VQTJNVASSA-N 1 3 343.515 2.950 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCCC[C@H]2CC[NH2+]CCC(F)(F)F)C1 ZINC001271578028 1102130321 /nfs/dbraw/zinc/13/03/21/1102130321.db2.gz ZREZHTCYXSHVPP-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@@H]1CC[NH2+]Cc1ccsc1 ZINC001271585798 1102149386 /nfs/dbraw/zinc/14/93/86/1102149386.db2.gz VOUIWUXYPTVOKS-MRXNPFEDSA-N 1 3 332.473 2.575 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001266793154 1102246809 /nfs/dbraw/zinc/24/68/09/1102246809.db2.gz IICUETTWHQDUGO-JDBYYAOJSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](C[NH2+]CCc2ccccc2F)C1)N(C)C ZINC001266793331 1102247838 /nfs/dbraw/zinc/24/78/38/1102247838.db2.gz LABYYVMJEYOPGH-QFBILLFUSA-N 1 3 349.494 2.537 10 0 EFAEHO Cc1cccc([C@H](C)N(C)CCNC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001480876257 1102250568 /nfs/dbraw/zinc/25/05/68/1102250568.db2.gz RZJUZENLXGLXKN-HKUYNNGSSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1cccc([C@H](C)N(C)CCNC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001480876257 1102250582 /nfs/dbraw/zinc/25/05/82/1102250582.db2.gz RZJUZENLXGLXKN-HKUYNNGSSA-N 1 3 331.504 2.978 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]CCC2=CCCCC2)C1 ZINC001271700372 1102265833 /nfs/dbraw/zinc/26/58/33/1102265833.db2.gz QPOMYGQGYBHWEM-PKOBYXMFSA-N 1 3 335.536 2.903 10 0 EFAEHO CC(C)=CCN(C)C[C@@H]1CCCCN1C(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001657063254 1102303556 /nfs/dbraw/zinc/30/35/56/1102303556.db2.gz IFDBQHAMVZMUPI-OALUTQOASA-N 1 3 333.520 2.607 10 0 EFAEHO CC(C)=CCN(C)C[C@@H]1CCCCN1C(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001657063255 1102304579 /nfs/dbraw/zinc/30/45/79/1102304579.db2.gz IFDBQHAMVZMUPI-RBUKOAKNSA-N 1 3 333.520 2.607 10 0 EFAEHO C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@H]1C[NH2+]CCCC(C)(C)C ZINC001271739391 1102556167 /nfs/dbraw/zinc/55/61/67/1102556167.db2.gz MZAFEFIMJYZGIC-WBVHZDCISA-N 1 3 334.508 2.995 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCCC[C@H]1C[NH2+]CCCF ZINC001266877717 1102569211 /nfs/dbraw/zinc/56/92/11/1102569211.db2.gz LTCDYPRZHOGDPK-DLBZAZTESA-N 1 3 327.488 2.580 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCCC[C@H]1CNCC=C(Cl)Cl ZINC001266879709 1102576116 /nfs/dbraw/zinc/57/61/16/1102576116.db2.gz CKSWYBIYDYDSSS-ZDUSSCGKSA-N 1 3 336.307 2.618 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCCC[C@H]1CNCC=C(Cl)Cl ZINC001266879709 1102576121 /nfs/dbraw/zinc/57/61/21/1102576121.db2.gz CKSWYBIYDYDSSS-ZDUSSCGKSA-N 1 3 336.307 2.618 10 0 EFAEHO CC[NH2+]CCN(Cc1ccccc1)C(=O)[C@@H]1CCCCN1C(C)C ZINC001271819923 1102796717 /nfs/dbraw/zinc/79/67/17/1102796717.db2.gz WVWITXSSTIPUFO-IBGZPJMESA-N 1 3 331.504 2.888 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1ccccc1)C(C)C ZINC001482533383 1102875027 /nfs/dbraw/zinc/87/50/27/1102875027.db2.gz PRUCDQXHPJWYDJ-OALUTQOASA-N 1 3 331.504 2.791 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](CC1CC2(CCC2)C1)C1CC1 ZINC001660749036 1102958947 /nfs/dbraw/zinc/95/89/47/1102958947.db2.gz FWWPUFLPFVTFAE-UHFFFAOYSA-N 1 3 344.503 2.812 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](CC1CC2(CCC2)C1)C1CC1 ZINC001660749036 1102958951 /nfs/dbraw/zinc/95/89/51/1102958951.db2.gz FWWPUFLPFVTFAE-UHFFFAOYSA-N 1 3 344.503 2.812 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CCC([NH2+]Cc2cccnc2C)CC1)N(C)C ZINC001409455558 1103090952 /nfs/dbraw/zinc/09/09/52/1103090952.db2.gz ZYGJYWWLQWWDDN-CTWPCTMYSA-N 1 3 346.519 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1cccc(C(F)F)c1 ZINC001409456404 1103105245 /nfs/dbraw/zinc/10/52/45/1103105245.db2.gz GOVIBPIGSOCHBY-KGLIPLIRSA-N 1 3 341.446 2.947 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+]Cc1ccc(C2CCC2)cc1 ZINC001483296325 1103292889 /nfs/dbraw/zinc/29/28/89/1103292889.db2.gz DEJGDHBAFNSVPG-INIZCTEOSA-N 1 3 331.504 2.889 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@H]1CCCN(Cc2ccc(F)cc2)C1 ZINC001661748711 1103405961 /nfs/dbraw/zinc/40/59/61/1103405961.db2.gz VWMKNCZHEIPINX-GOSISDBHSA-N 1 3 349.494 2.886 10 0 EFAEHO C[C@@H](NCc1ccccc1F)[C@H](C)NC(=O)CCC[NH+]1CCCC1 ZINC001409480275 1103442145 /nfs/dbraw/zinc/44/21/45/1103442145.db2.gz VQLJUUXIYKBLHT-CVEARBPZSA-N 1 3 335.467 2.685 10 0 EFAEHO C[C@@H](NCc1ccccc1F)[C@@H](C)NC(=O)CCC[NH+]1CCCC1 ZINC001409480292 1103442402 /nfs/dbraw/zinc/44/24/02/1103442402.db2.gz VQLJUUXIYKBLHT-HZPDHXFCSA-N 1 3 335.467 2.685 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@@H](C)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001483352081 1103459536 /nfs/dbraw/zinc/45/95/36/1103459536.db2.gz VTNRKQLLXGHIEP-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@@H](C)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001483352081 1103459546 /nfs/dbraw/zinc/45/95/46/1103459546.db2.gz VTNRKQLLXGHIEP-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(F)cc1)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001483369451 1103508157 /nfs/dbraw/zinc/50/81/57/1103508157.db2.gz IWONVYVEOZPUQP-HNNXBMFYSA-N 1 3 335.467 2.637 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@H](C)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001483370984 1103522104 /nfs/dbraw/zinc/52/21/04/1103522104.db2.gz RWGUNYHGSFPZNT-INIZCTEOSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H](C)CNC(=O)[C@H]1CCCN1C(C)C ZINC001662220438 1103629524 /nfs/dbraw/zinc/62/95/24/1103629524.db2.gz XXTHBSFXBUJQHX-UYAOXDASSA-N 1 3 345.531 2.895 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C2CCC2)cc1)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001483418323 1103663379 /nfs/dbraw/zinc/66/33/79/1103663379.db2.gz XARWHYNYHLIQNQ-UZLBHIALSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C2CCC2)cc1)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001483418323 1103663384 /nfs/dbraw/zinc/66/33/84/1103663384.db2.gz XARWHYNYHLIQNQ-UZLBHIALSA-N 1 3 343.515 2.842 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@H+](C)CCc1cccs1 ZINC001483419302 1103669309 /nfs/dbraw/zinc/66/93/09/1103669309.db2.gz AGSRZMIRUOTJNM-WBVHZDCISA-N 1 3 337.533 2.602 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@@H+](C)CCc1cccs1 ZINC001483419302 1103669313 /nfs/dbraw/zinc/66/93/13/1103669313.db2.gz AGSRZMIRUOTJNM-WBVHZDCISA-N 1 3 337.533 2.602 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)[C@@H]1CCCN1C)c1cccc(Cl)c1 ZINC001483456213 1103750858 /nfs/dbraw/zinc/75/08/58/1103750858.db2.gz PZESSXNPVIATTL-YOEHRIQHSA-N 1 3 337.895 2.933 10 0 EFAEHO Cc1ccc(C[NH2+]CCCN(C)C(=O)[C@@H]2CCCCN2C)cc1F ZINC001483475498 1103784272 /nfs/dbraw/zinc/78/42/72/1103784272.db2.gz UUPVKYKKCYIWFY-SFHVURJKSA-N 1 3 335.467 2.557 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[NH2+]Cc2sccc2Cl)C1 ZINC001483492226 1103821915 /nfs/dbraw/zinc/82/19/15/1103821915.db2.gz ADJKWJJHDCLPST-CYBMUJFWSA-N 1 3 343.924 2.681 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[NH2+][C@H]2CCc3c2cccc3F)C1 ZINC001483492834 1103825683 /nfs/dbraw/zinc/82/56/83/1103825683.db2.gz KXFVFNURHUSJPT-KXBFYZLASA-N 1 3 347.478 2.593 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CCC[C@@H]1CCCNC(=O)C1(N(C)C)CCC1 ZINC001663072092 1103960530 /nfs/dbraw/zinc/96/05/30/1103960530.db2.gz MIOXDAILEZHVSM-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CCC[C@@H]1CCCNC(=O)C1(N(C)C)CCC1 ZINC001663072092 1103960531 /nfs/dbraw/zinc/96/05/31/1103960531.db2.gz MIOXDAILEZHVSM-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[C@H]1CCC[N@@H+]1CC1CCCC1 ZINC001663119375 1103993973 /nfs/dbraw/zinc/99/39/73/1103993973.db2.gz GXPNGHVKOWGSKV-KRWDZBQOSA-N 1 3 332.492 2.812 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[C@H]1CCC[N@H+]1CC1CCCC1 ZINC001663119375 1103993977 /nfs/dbraw/zinc/99/39/77/1103993977.db2.gz GXPNGHVKOWGSKV-KRWDZBQOSA-N 1 3 332.492 2.812 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1cc(C)cc(C)c1)C1CC1)N(C)C ZINC001483600065 1104032898 /nfs/dbraw/zinc/03/28/98/1104032898.db2.gz CUOFURKZIKDQFG-RTBURBONSA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1cc(C)ccc1C)C1CC1)N(C)C ZINC001483600664 1104035248 /nfs/dbraw/zinc/03/52/48/1104035248.db2.gz JFTDLCMOUMKQJH-RTBURBONSA-N 1 3 331.504 2.628 10 0 EFAEHO CCc1cccc(CN(C)[C@H](C)CNC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)c1 ZINC001409573117 1104307442 /nfs/dbraw/zinc/30/74/42/1104307442.db2.gz LNULQKHXBIPXSY-LSTHTHJFSA-N 1 3 345.531 2.916 10 0 EFAEHO CCc1cccc(CN(C)[C@H](C)CNC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)c1 ZINC001409573117 1104307456 /nfs/dbraw/zinc/30/74/56/1104307456.db2.gz LNULQKHXBIPXSY-LSTHTHJFSA-N 1 3 345.531 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC001664394476 1104375665 /nfs/dbraw/zinc/37/56/65/1104375665.db2.gz CZZWJIHGTJMVJY-UHFFFAOYSA-N 1 3 345.409 2.594 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]Cc1ccc(C)c(F)c1 ZINC001664395236 1104376562 /nfs/dbraw/zinc/37/65/62/1104376562.db2.gz NGWFCPJCGIVYQK-GOSISDBHSA-N 1 3 335.467 2.557 10 0 EFAEHO CC(C)N(C/C=C/Cl)CCCNC(=O)C12CCC[NH+](CCC1)C2 ZINC001664516417 1104424035 /nfs/dbraw/zinc/42/40/35/1104424035.db2.gz BOBVWURPPQZWQH-WEVVVXLNSA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)=CCN[C@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)c1ccccc1 ZINC001664599420 1104467225 /nfs/dbraw/zinc/46/72/25/1104467225.db2.gz RFLNARIEIHIRPT-PKOBYXMFSA-N 1 3 329.488 2.742 10 0 EFAEHO CC(C)=CCN[C@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)c1ccccc1 ZINC001664599420 1104467230 /nfs/dbraw/zinc/46/72/30/1104467230.db2.gz RFLNARIEIHIRPT-PKOBYXMFSA-N 1 3 329.488 2.742 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)c1 ZINC001482605869 1104469172 /nfs/dbraw/zinc/46/91/72/1104469172.db2.gz HIGIDNIEFPAESR-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)c1 ZINC001482605869 1104469180 /nfs/dbraw/zinc/46/91/80/1104469180.db2.gz HIGIDNIEFPAESR-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)n1 ZINC001483236737 1104527858 /nfs/dbraw/zinc/52/78/58/1104527858.db2.gz RMYYHBVHPSREOE-FUHWJXTLSA-N 1 3 346.519 2.674 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)n1 ZINC001483236737 1104527866 /nfs/dbraw/zinc/52/78/66/1104527866.db2.gz RMYYHBVHPSREOE-FUHWJXTLSA-N 1 3 346.519 2.674 10 0 EFAEHO C[C@@H](CNC(=O)CC[NH+](C)C)N(C)C/C=C\c1ccc(Cl)cc1 ZINC001409618336 1104531670 /nfs/dbraw/zinc/53/16/70/1104531670.db2.gz CMDCYEWLAZWARF-YVACAVLKSA-N 1 3 337.895 2.741 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2CC[N@H+](CC3=CCCCC3)C2)C1 ZINC001664740031 1104532327 /nfs/dbraw/zinc/53/23/27/1104532327.db2.gz DQVQEIADWDDOAU-IEBWSBKVSA-N 1 3 333.520 2.657 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2CC[N@@H+](CC3=CCCCC3)C2)C1 ZINC001664740031 1104532331 /nfs/dbraw/zinc/53/23/31/1104532331.db2.gz DQVQEIADWDDOAU-IEBWSBKVSA-N 1 3 333.520 2.657 10 0 EFAEHO C[N@H+](CCC1=CCCCC1)C[C@H]1CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001664842852 1104573478 /nfs/dbraw/zinc/57/34/78/1104573478.db2.gz WWMYVFBGAKOPNU-QGZVFWFLSA-N 1 3 330.476 2.623 10 0 EFAEHO C[N@@H+](CCC1=CCCCC1)C[C@H]1CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001664842852 1104573486 /nfs/dbraw/zinc/57/34/86/1104573486.db2.gz WWMYVFBGAKOPNU-QGZVFWFLSA-N 1 3 330.476 2.623 10 0 EFAEHO CC/C=C/CC[N@H+](C)C[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001664848601 1104575763 /nfs/dbraw/zinc/57/57/63/1104575763.db2.gz HBSQBGSJECWXPH-UEKDZROGSA-N 1 3 335.536 2.855 10 0 EFAEHO CC/C=C/CC[N@@H+](C)C[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001664848601 1104575767 /nfs/dbraw/zinc/57/57/67/1104575767.db2.gz HBSQBGSJECWXPH-UEKDZROGSA-N 1 3 335.536 2.855 10 0 EFAEHO CC/C=C\CC[N@H+](C)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001664891043 1104594071 /nfs/dbraw/zinc/59/40/71/1104594071.db2.gz OQPITAJRKBWSAH-OOFWQKGWSA-N 1 3 335.536 2.855 10 0 EFAEHO CC/C=C\CC[N@@H+](C)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001664891043 1104594076 /nfs/dbraw/zinc/59/40/76/1104594076.db2.gz OQPITAJRKBWSAH-OOFWQKGWSA-N 1 3 335.536 2.855 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)[C@H](C)c1ccc2c(c1)CCC2 ZINC001482651618 1104743346 /nfs/dbraw/zinc/74/33/46/1104743346.db2.gz GMMZJFHZFTWDBW-QGZVFWFLSA-N 1 3 345.531 2.967 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)[C@H](C)c1ccc2c(c1)CCC2 ZINC001482651618 1104743351 /nfs/dbraw/zinc/74/33/51/1104743351.db2.gz GMMZJFHZFTWDBW-QGZVFWFLSA-N 1 3 345.531 2.967 10 0 EFAEHO CCCC[NH2+]C[C@@](C)(NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001666021734 1104832072 /nfs/dbraw/zinc/83/20/72/1104832072.db2.gz KJHCKENUWAVKIB-RTBURBONSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](CC[NH2+]Cc2ccccc2F)C1 ZINC001666172379 1104892431 /nfs/dbraw/zinc/89/24/31/1104892431.db2.gz GRYTUIKTKPQAPN-KRWDZBQOSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]CC1CC2(CCC2)C1 ZINC001482697712 1104954102 /nfs/dbraw/zinc/95/41/02/1104954102.db2.gz HEMYRYRDFFADEV-QZTJIDSGSA-N 1 3 335.536 2.781 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H]1CCC[C@@H]1NC(=O)CN(C)C(C)C ZINC001482698410 1104955152 /nfs/dbraw/zinc/95/51/52/1104955152.db2.gz KWCULQCFJPTJKR-MOPGFXCFSA-N 1 3 331.504 2.710 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001482839166 1105079080 /nfs/dbraw/zinc/07/90/80/1105079080.db2.gz IJCKCGAZVCLBTB-KRWDZBQOSA-N 1 3 331.504 2.772 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H]([NH2+]CCCCCF)[C@H](C)C2)CC1 ZINC001667204724 1105079739 /nfs/dbraw/zinc/07/97/39/1105079739.db2.gz SDLGQCWTUIPMBN-MSOLQXFVSA-N 1 3 341.515 2.685 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@H]1CC[NH2+]Cc1cncc(C)c1)N(C)C ZINC001667284325 1105107263 /nfs/dbraw/zinc/10/72/63/1105107263.db2.gz JJRBOWJCGBBWIO-OALUTQOASA-N 1 3 346.519 2.591 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001482867850 1105118192 /nfs/dbraw/zinc/11/81/92/1105118192.db2.gz LYRJJNWLLAOJLO-RHSMWYFYSA-N 1 3 339.911 2.911 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@H]1C[NH2+]CCC(C)(C)C ZINC001667400683 1105140758 /nfs/dbraw/zinc/14/07/58/1105140758.db2.gz MLGSXZIYVATACC-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CC/C=C\CC[N@H+](C)CCC1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001667409927 1105142336 /nfs/dbraw/zinc/14/23/36/1105142336.db2.gz AWOVHBOIPTXFKD-VOFKWLDRSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](C)CCC1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001667409927 1105142340 /nfs/dbraw/zinc/14/23/40/1105142340.db2.gz AWOVHBOIPTXFKD-VOFKWLDRSA-N 1 3 335.536 2.997 10 0 EFAEHO CCN(CCNC/C=C/Cl)C(=O)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001482930129 1105188792 /nfs/dbraw/zinc/18/87/92/1105188792.db2.gz DISYFNHDNJDSOY-DHINHOHASA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(CCNC/C=C/Cl)C(=O)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001482930129 1105188795 /nfs/dbraw/zinc/18/87/95/1105188795.db2.gz DISYFNHDNJDSOY-DHINHOHASA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(CC[NH2+]CC1CCC(C)(C)CC1)C(=O)CN(C)C(C)C ZINC001482970670 1105268228 /nfs/dbraw/zinc/26/82/28/1105268228.db2.gz WWFQKTGXLYLQFZ-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H](C)NC(=O)CN(C)C(C)C)c(C)s1 ZINC001668319325 1105280471 /nfs/dbraw/zinc/28/04/71/1105280471.db2.gz FZFLPWQXNWEHPZ-ZDUSSCGKSA-N 1 3 325.522 2.690 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1ccccc1F ZINC001668319551 1105281508 /nfs/dbraw/zinc/28/15/08/1105281508.db2.gz IHYKAAHDXQCCGU-MAUKXSAKSA-N 1 3 335.467 2.685 10 0 EFAEHO CC(C)=CCN(C)CCN(C)C(=O)[C@H]1C[N@H+](C)C[C@@H]1c1ccccc1 ZINC001272117999 1105283061 /nfs/dbraw/zinc/28/30/61/1105283061.db2.gz SVLGWMBYVNPCGL-UXHICEINSA-N 1 3 343.515 2.688 10 0 EFAEHO CC(C)=CCN(C)CCN(C)C(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1 ZINC001272117999 1105283065 /nfs/dbraw/zinc/28/30/65/1105283065.db2.gz SVLGWMBYVNPCGL-UXHICEINSA-N 1 3 343.515 2.688 10 0 EFAEHO CCN(CC[NH2+]CC[C@H]1CCCC1(F)F)C(=O)CN1CC[C@@H](C)C1 ZINC001668555093 1105319639 /nfs/dbraw/zinc/31/96/39/1105319639.db2.gz IGJREYLBCHSGKW-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CN(C)C1(C(=O)NC/C=C/C[NH2+]CC2CCC(F)(F)CC2)CCC1 ZINC001668863911 1105388378 /nfs/dbraw/zinc/38/83/78/1105388378.db2.gz AKESXDYLRXJHOO-ONEGZZNKSA-N 1 3 343.462 2.558 10 0 EFAEHO CN(C)C1(C(=O)NC/C=C/C[NH2+]CC2CCC(C)(C)CC2)CCC1 ZINC001668864166 1105388815 /nfs/dbraw/zinc/38/88/15/1105388815.db2.gz CYKIBGATJFMPLP-AATRIKPKSA-N 1 3 335.536 2.949 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/C[NH2+][C@@H]1CCc2ccccc21)N(C)C ZINC001668873613 1105389996 /nfs/dbraw/zinc/38/99/96/1105389996.db2.gz VFFVXHVCIZLHCY-ZSQQTYLHSA-N 1 3 329.488 2.522 10 0 EFAEHO O=C(NC/C=C\CNCc1ccc(Cl)cc1)C12CCC[NH+]1CCC2 ZINC001668911524 1105397103 /nfs/dbraw/zinc/39/71/03/1105397103.db2.gz IGANTEMCFPDITB-UPHRSURJSA-N 1 3 347.890 2.730 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC/C=C\CN[C@H]1CCc2ccc(Cl)cc21 ZINC001669126868 1105439623 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Cc1cc(C[NH2+]C/C=C\CNC(=O)CN(C)C2CCC2)c(C)s1 ZINC001483016695 1105555600 /nfs/dbraw/zinc/55/56/00/1105555600.db2.gz FYXYYWOIFZPFTH-PLNGDYQASA-N 1 3 335.517 2.611 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CCCN(C)C(=O)C1(N(C)C)CCC1 ZINC001670124708 1105584427 /nfs/dbraw/zinc/58/44/27/1105584427.db2.gz ZUMMWGZMJGKIEE-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1cc(C[NH2+]CCCN(C)C(=O)CN2CC[C@H](C)C2)c(C)s1 ZINC001670246124 1105603500 /nfs/dbraw/zinc/60/35/00/1105603500.db2.gz PIDPBKPVSSDFMJ-AWEZNQCLSA-N 1 3 337.533 2.645 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001670315624 1105615859 /nfs/dbraw/zinc/61/58/59/1105615859.db2.gz BNCVOKCATXBVET-QGZVFWFLSA-N 1 3 339.911 2.927 10 0 EFAEHO CN(CCC[NH2+]CC[C@@H]1CCc2ccccc21)C(=O)CN1CCCC1 ZINC001670344651 1105622583 /nfs/dbraw/zinc/62/25/83/1105622583.db2.gz IXWMXIOFQQJWNE-IBGZPJMESA-N 1 3 343.515 2.640 10 0 EFAEHO CN(CCC[NH2+]CC[C@H]1CCc2ccccc21)C(=O)CN1CCCC1 ZINC001670344652 1105622587 /nfs/dbraw/zinc/62/25/87/1105622587.db2.gz IXWMXIOFQQJWNE-LJQANCHMSA-N 1 3 343.515 2.640 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H]2C[NH2+]CCCC2CCCC2)C1 ZINC001671346357 1105628495 /nfs/dbraw/zinc/62/84/95/1105628495.db2.gz GZXMOMHUBYGGCX-HKUYNNGSSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C[NH2+]C/C=C\Cl)C1CCCC1 ZINC001671530546 1105652081 /nfs/dbraw/zinc/65/20/81/1105652081.db2.gz OOWAPDGVTGQMQJ-HJMWAZGYSA-N 1 3 341.927 2.876 10 0 EFAEHO CN(CC(=O)N1CC[C@](C)(C[NH2+]CC=C(Cl)Cl)C1)C1CCC1 ZINC001671746807 1105694932 /nfs/dbraw/zinc/69/49/32/1105694932.db2.gz CIPGIUQJPQUOMO-MRXNPFEDSA-N 1 3 348.318 2.618 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[C@H](C[NH2+]C/C=C\Cl)CC2)C1 ZINC001672376790 1105817438 /nfs/dbraw/zinc/81/74/38/1105817438.db2.gz MHEUJDAFUWVADP-LUCOHNSJSA-N 1 3 341.927 2.593 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H](CC[NH2+]CCc3cccs3)C2)CCC1 ZINC001672806194 1105908797 /nfs/dbraw/zinc/90/87/97/1105908797.db2.gz UIUVWQMWFMGUBE-MRXNPFEDSA-N 1 3 349.544 2.603 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](CC[NH2+]CCc2ccccc2)C1)N(C)C ZINC001672859574 1105922842 /nfs/dbraw/zinc/92/28/42/1105922842.db2.gz UXKQXWUEBPJFSV-VQTJNVASSA-N 1 3 345.531 2.644 10 0 EFAEHO CC/C=C/CC[NH2+]CC[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001672884780 1105927944 /nfs/dbraw/zinc/92/79/44/1105927944.db2.gz DJKMYNAHHAVGPD-VZSQWMKGSA-N 1 3 335.536 2.903 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(C)cc2)C1)N(C)C ZINC001672896347 1105930896 /nfs/dbraw/zinc/93/08/96/1105930896.db2.gz FSZFAGNYCAZXRV-RTBURBONSA-N 1 3 331.504 2.663 10 0 EFAEHO CCCC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN1CC[C@H](C)C1 ZINC001674429453 1106186851 /nfs/dbraw/zinc/18/68/51/1106186851.db2.gz JKHNXXZUYMYTMJ-QKYXUNIQSA-N 1 3 329.488 2.500 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC1(C[NH2+]CCCF)CCCCC1 ZINC001675179548 1106312861 /nfs/dbraw/zinc/31/28/61/1106312861.db2.gz LPDJAWCUVCHFBC-MRXNPFEDSA-N 1 3 327.488 2.628 10 0 EFAEHO CCCC[C@H](C[NH2+]CCC)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001675234362 1106320126 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349.494 2.679 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[C@@H](C[NH2+]CCC(F)(F)F)C1)N1CCCC1 ZINC001676946159 1106633777 /nfs/dbraw/zinc/63/37/77/1106633777.db2.gz USUOCBQZBFJNQW-KGLIPLIRSA-N 1 3 349.441 2.688 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@H]([NH2+]CCCC(C)(C)C)C(C)(C)C1)N(C)C ZINC001677033052 1106653724 /nfs/dbraw/zinc/65/37/24/1106653724.db2.gz RDOHHMICOMMOBT-HOTGVXAUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+](C[C@@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001677623724 1106789112 /nfs/dbraw/zinc/78/91/12/1106789112.db2.gz AXPDFKICCIGXEH-HZPDHXFCSA-N 1 3 343.462 2.510 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+](C[C@@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001677623724 1106789122 /nfs/dbraw/zinc/78/91/22/1106789122.db2.gz AXPDFKICCIGXEH-HZPDHXFCSA-N 1 3 343.462 2.510 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1=CC[N@H+](CC2CCCC2)CC1 ZINC001677632204 1106796900 /nfs/dbraw/zinc/79/69/00/1106796900.db2.gz IGZANQQCVZLBOT-IAGOWNOFSA-N 1 3 333.520 2.798 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1=CC[N@@H+](CC2CCCC2)CC1 ZINC001677632204 1106796914 /nfs/dbraw/zinc/79/69/14/1106796914.db2.gz IGZANQQCVZLBOT-IAGOWNOFSA-N 1 3 333.520 2.798 10 0 EFAEHO C[C@@H](C[NH2+]CCCc1ccccc1)NC(=O)C(C)(C)N1CCCCC1 ZINC001483227613 1107435656 /nfs/dbraw/zinc/43/56/56/1107435656.db2.gz MNJPIXAYGZRUIE-SFHVURJKSA-N 1 3 345.531 2.978 10 0 EFAEHO CC(C)CCCN1CC[C@H]1CNC(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001483682008 1107535662 /nfs/dbraw/zinc/53/56/62/1107535662.db2.gz QJEWTGFNYSAUHT-QFBILLFUSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CCCN1CC[C@H]1CNC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001483682008 1107535665 /nfs/dbraw/zinc/53/56/65/1107535665.db2.gz QJEWTGFNYSAUHT-QFBILLFUSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CCCN1CC[C@@H]1CNC(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001483682009 1107535728 /nfs/dbraw/zinc/53/57/28/1107535728.db2.gz QJEWTGFNYSAUHT-VQIMIIECSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CCCN1CC[C@@H]1CNC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001483682009 1107535735 /nfs/dbraw/zinc/53/57/35/1107535735.db2.gz QJEWTGFNYSAUHT-VQIMIIECSA-N 1 3 341.515 2.826 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CCC[C@@H]1C[NH2+]CCC1CCCC1 ZINC001272331097 1107848894 /nfs/dbraw/zinc/84/88/94/1107848894.db2.gz BYKHELBDSOGCGB-SJORKVTESA-N 1 3 332.492 2.715 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C\C[NH2+][C@H]1CCCc2ccc(F)cc21)N(C)C ZINC001483061053 1107912095 /nfs/dbraw/zinc/91/20/95/1107912095.db2.gz RQNLTBNUITUXHI-DSQZMVHQSA-N 1 3 347.478 2.805 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C/C[NH2+][C@@H]1CCCc2ccc(F)cc21)N(C)C ZINC001483061059 1107913240 /nfs/dbraw/zinc/91/32/40/1107913240.db2.gz RQNLTBNUITUXHI-YSKLNCTFSA-N 1 3 347.478 2.805 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@@H]21 ZINC001272216711 1107919155 /nfs/dbraw/zinc/91/91/55/1107919155.db2.gz WUJWBHKLYALZCG-JSDWAPGTSA-N 1 3 333.520 2.750 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@@H]21 ZINC001272216711 1107919167 /nfs/dbraw/zinc/91/91/67/1107919167.db2.gz WUJWBHKLYALZCG-JSDWAPGTSA-N 1 3 333.520 2.750 10 0 EFAEHO C[C@@H](NCc1ccccc1Cl)[C@@H](C)NC(=O)CCC[NH+](C)C ZINC001409365913 1107920789 /nfs/dbraw/zinc/92/07/89/1107920789.db2.gz AELANTBZRLKUFZ-ZIAGYGMSSA-N 1 3 325.884 2.665 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]C/C=C/c1ccccc1 ZINC001409369441 1107958149 /nfs/dbraw/zinc/95/81/49/1107958149.db2.gz MLDFCUCYHYWNKB-MVIRQZGPSA-N 1 3 329.488 2.667 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]C/C=C/c1ccccc1 ZINC001409369494 1107958609 /nfs/dbraw/zinc/95/86/09/1107958609.db2.gz MLDFCUCYHYWNKB-SCGCXBKJSA-N 1 3 329.488 2.667 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]C/C=C\c1ccccc1 ZINC001272344069 1108012402 /nfs/dbraw/zinc/01/24/02/1108012402.db2.gz PVYXBNMPTNKMEZ-WLTZFMEZSA-N 1 3 343.515 2.915 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCN1CC1CC(C)(C)C1)[NH+]1CCCC1 ZINC001483704928 1108053400 /nfs/dbraw/zinc/05/34/00/1108053400.db2.gz FGEIIBNNFINGQF-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NC[C@@H]1CCN1CC1CC2(CCC2)C1 ZINC001483708093 1108075945 /nfs/dbraw/zinc/07/59/45/1108075945.db2.gz GSIBPYASQIHKIY-SFHVURJKSA-N 1 3 333.520 2.633 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)cc1F ZINC001272384863 1108139623 /nfs/dbraw/zinc/13/96/23/1108139623.db2.gz SPTRREIMEXCFLV-LPHOPBHVSA-N 1 3 347.478 2.557 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@H]2CCc3c2cccc3F)C1 ZINC001409268921 1108181163 /nfs/dbraw/zinc/18/11/63/1108181163.db2.gz BGCQHPBAZPNTPI-ZOJXTTQQSA-N 1 3 347.478 2.639 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N[C@@H](C)[C@H](C)NCc2ccccc2F)CC1 ZINC001409420800 1108262783 /nfs/dbraw/zinc/26/27/83/1108262783.db2.gz DZTKVIQXNOTWOF-HOTGVXAUSA-N 1 3 349.494 2.929 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N[C@@H](C)[C@@H](C)NCc2ccccc2F)CC1 ZINC001409420760 1108263119 /nfs/dbraw/zinc/26/31/19/1108263119.db2.gz DZTKVIQXNOTWOF-CVEARBPZSA-N 1 3 349.494 2.929 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)NC/C=C/CNCc2ccc(F)cc2)CC1 ZINC001483077128 1108414386 /nfs/dbraw/zinc/41/43/86/1108414386.db2.gz ZVGKEJUIDNSWDX-ONEGZZNKSA-N 1 3 347.478 2.708 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC/C=C\CN[C@H]1CCCc2ccc(F)cc21 ZINC001483078714 1108422171 /nfs/dbraw/zinc/42/21/71/1108422171.db2.gz FTEOWUSPMBATPX-HMECNJMJSA-N 1 3 347.478 2.807 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC/C=C\CN[C@H]1CCCc2ccc(F)cc21 ZINC001483078714 1108422176 /nfs/dbraw/zinc/42/21/76/1108422176.db2.gz FTEOWUSPMBATPX-HMECNJMJSA-N 1 3 347.478 2.807 10 0 EFAEHO CC(C)c1ccc(CNC2(CNC(=O)[C@@H]3CC[N@H+](C)[C@@H]3C)CC2)cc1 ZINC001483735351 1108548614 /nfs/dbraw/zinc/54/86/14/1108548614.db2.gz TYRMBJNEIOYGIY-VQIMIIECSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)c1ccc(CNC2(CNC(=O)[C@@H]3CC[N@@H+](C)[C@@H]3C)CC2)cc1 ZINC001483735351 1108548625 /nfs/dbraw/zinc/54/86/25/1108548625.db2.gz TYRMBJNEIOYGIY-VQIMIIECSA-N 1 3 343.515 2.889 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@H]2CCN(C(=O)[C@H]3CCCN3C)C2)c1 ZINC001272524157 1108615104 /nfs/dbraw/zinc/61/51/04/1108615104.db2.gz PDTVUWUNPCUFGT-AZUAARDMSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CC[C@H]1CCN(C(=O)[C@H]2CCCN2C)C1 ZINC001272525141 1108616544 /nfs/dbraw/zinc/61/65/44/1108616544.db2.gz YHWOMAGJJJONNS-QFBILLFUSA-N 1 3 347.478 2.557 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C/C[NH2+][C@H](C)c1ccccc1 ZINC001483098530 1108649104 /nfs/dbraw/zinc/64/91/04/1108649104.db2.gz RMQVAZACPNGSMY-GXLYXMFMSA-N 1 3 329.488 2.884 10 0 EFAEHO CC[C@H]([NH2+]C1(CNC(=O)C2(N(C)C)CCC2)CC1)c1ccc(F)cc1 ZINC001483740628 1108717530 /nfs/dbraw/zinc/71/75/30/1108717530.db2.gz MNARLAFCYMIMCO-KRWDZBQOSA-N 1 3 347.478 3.000 10 0 EFAEHO CC[C@@H]([NH2+]C1(CNC(=O)C2(N(C)C)CCC2)CC1)c1ccc(F)cc1 ZINC001483740629 1108718201 /nfs/dbraw/zinc/71/82/01/1108718201.db2.gz MNARLAFCYMIMCO-QGZVFWFLSA-N 1 3 347.478 3.000 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@@H]3C[C@@H]3[C@H]3C[C@H]3C)CC2)CC1 ZINC000899398790 1109311643 /nfs/dbraw/zinc/31/16/43/1109311643.db2.gz BUJLZGPGQTYVSZ-LQJIQPLVSA-N 1 3 347.547 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+][C@H](C)c2ccccc2F)C1 ZINC001409291305 1109394251 /nfs/dbraw/zinc/39/42/51/1109394251.db2.gz QRVFGBMDRJISBY-QQFBHYJXSA-N 1 3 335.467 2.711 10 0 EFAEHO CC1CCN([C@@H](CNC(=O)C23CC[NH+](CC2)C3)c2cccs2)CC1 ZINC000899964547 1109566004 /nfs/dbraw/zinc/56/60/04/1109566004.db2.gz NGPOTRCYAODKBY-INIZCTEOSA-N 1 3 347.528 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC001483197466 1109996939 /nfs/dbraw/zinc/99/69/39/1109996939.db2.gz KMONKDVMHPYZQA-KDOFPFPSSA-N 1 3 335.467 2.638 10 0 EFAEHO Cc1ccccc1CN1CC([C@@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)C1 ZINC001409890419 1111733301 /nfs/dbraw/zinc/73/33/01/1111733301.db2.gz AWOQDVRJDCPMAA-XLIONFOSSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1ccccc1CN1CC([C@@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)C1 ZINC001409890419 1111733306 /nfs/dbraw/zinc/73/33/06/1111733306.db2.gz AWOQDVRJDCPMAA-XLIONFOSSA-N 1 3 343.515 2.806 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+]Cc2csc(C)c2)C1 ZINC001272624844 1111764474 /nfs/dbraw/zinc/76/44/74/1111764474.db2.gz PRNSYXGDLNHMJF-INIZCTEOSA-N 1 3 337.533 2.727 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+][C@H](C)c2cc(C)ccc2C)CC1)N(C)C ZINC001483784961 1112447340 /nfs/dbraw/zinc/44/73/40/1112447340.db2.gz YXHKLNYIFJJSRQ-AEFFLSMTSA-N 1 3 331.504 2.943 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@H](C(=O)NCC2(NCc3ccc(F)cc3)CC2)C1 ZINC001483784839 1112447843 /nfs/dbraw/zinc/44/78/43/1112447843.db2.gz VDXYDUFNHJYTND-WMZOPIPTSA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](CCC2CC2)CC2CC2)CC1 ZINC001483818753 1112468970 /nfs/dbraw/zinc/46/89/70/1112468970.db2.gz RGEHYWIEMISPIF-UHFFFAOYSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](CCC2CC2)CC2CC2)CC1 ZINC001483818753 1112468972 /nfs/dbraw/zinc/46/89/72/1112468972.db2.gz RGEHYWIEMISPIF-UHFFFAOYSA-N 1 3 335.536 2.830 10 0 EFAEHO CCCCC[N@@H+]1CCC[C@]2(CCN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001483830258 1112490354 /nfs/dbraw/zinc/49/03/54/1112490354.db2.gz MOBBJKJIUXPHEN-FQEVSTJZSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCC[N@H+]1CCC[C@]2(CCN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001483830258 1112490356 /nfs/dbraw/zinc/49/03/56/1112490356.db2.gz MOBBJKJIUXPHEN-FQEVSTJZSA-N 1 3 335.536 2.975 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)c1 ZINC001483913335 1112555325 /nfs/dbraw/zinc/55/53/25/1112555325.db2.gz GZNKIPLNYLEDAS-PKOBYXMFSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)c1 ZINC001483913332 1112555419 /nfs/dbraw/zinc/55/54/19/1112555419.db2.gz GZNKIPLNYLEDAS-HKUYNNGSSA-N 1 3 331.504 2.804 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001483951980 1112594611 /nfs/dbraw/zinc/59/46/11/1112594611.db2.gz OCUOONBMUKPAJD-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)C[C@H](C)C[NH+]1CCC(C)(NC(=O)CN(C)C(C)C)CC1 ZINC001483976335 1112618308 /nfs/dbraw/zinc/61/83/08/1112618308.db2.gz HURFDWARCVNRRI-KRWDZBQOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](CNCCF)C1CCCC1)[NH+]1CCCCC1 ZINC001484014019 1112663774 /nfs/dbraw/zinc/66/37/74/1112663774.db2.gz HIEMHGXTQKQUMN-QZTJIDSGSA-N 1 3 341.515 2.731 10 0 EFAEHO CC[C@H](F)C[N@@H+]1CC[C@]2(C1)CCCCN(C(=O)CN(C)C(C)C)C2 ZINC001484022709 1112675769 /nfs/dbraw/zinc/67/57/69/1112675769.db2.gz NZOGKOLZWDPOIW-HKUYNNGSSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](F)C[N@H+]1CC[C@]2(C1)CCCCN(C(=O)CN(C)C(C)C)C2 ZINC001484022709 1112675770 /nfs/dbraw/zinc/67/57/70/1112675770.db2.gz NZOGKOLZWDPOIW-HKUYNNGSSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@]1(C)CCC[N@H+](CCC(C)(C)C)C1 ZINC001484174779 1112889396 /nfs/dbraw/zinc/88/93/96/1112889396.db2.gz MRNJGEYSFAXRCR-LJQANCHMSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@]1(C)CCC[N@@H+](CCC(C)(C)C)C1 ZINC001484174779 1112889400 /nfs/dbraw/zinc/88/94/00/1112889400.db2.gz MRNJGEYSFAXRCR-LJQANCHMSA-N 1 3 325.541 2.981 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H](CC[NH2+]CC3=CCCCC3)C2)CCC1 ZINC001484523161 1112979161 /nfs/dbraw/zinc/97/91/61/1112979161.db2.gz PUPIGZCJYLALJS-SFHVURJKSA-N 1 3 333.520 2.799 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H]2CCN(C(=O)CN3CC[C@H](C)C3)C2)cs1 ZINC001484537288 1112992107 /nfs/dbraw/zinc/99/21/07/1112992107.db2.gz FUQADGVNVVTUSV-DOTOQJQBSA-N 1 3 349.544 2.727 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(C)cc2)C1)N(C)C ZINC001484537281 1112992364 /nfs/dbraw/zinc/99/23/64/1112992364.db2.gz FSZFAGNYCAZXRV-MOPGFXCFSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001484551315 1113004271 /nfs/dbraw/zinc/00/42/71/1113004271.db2.gz GUZOZOJMZUKAFT-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](C[C@@H](C)CC(C)C)CC2 ZINC001484581044 1113034299 /nfs/dbraw/zinc/03/42/99/1113034299.db2.gz BSGNKIMJPVPFQB-SFHVURJKSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+]C[C@H]2CCCC(F)(F)C2)CCC1 ZINC001484659422 1113099434 /nfs/dbraw/zinc/09/94/34/1113099434.db2.gz IFJKHANCAMLJGE-HNNXBMFYSA-N 1 3 345.478 2.782 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@]2(CC[N@H+](CC3CC(C)C3)C2)C1 ZINC001484832242 1117766772 /nfs/dbraw/zinc/76/67/72/1117766772.db2.gz WDENVQHKDKCXRS-AFMYVXGZSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@]2(CC[N@@H+](CC3CC(C)C3)C2)C1 ZINC001484832242 1117766777 /nfs/dbraw/zinc/76/67/77/1117766777.db2.gz WDENVQHKDKCXRS-AFMYVXGZSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@]2(CC[N@H+](CC3CC(C)C3)C2)C1 ZINC001484832243 1117766830 /nfs/dbraw/zinc/76/68/30/1117766830.db2.gz WDENVQHKDKCXRS-QLOJAFMTSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@]2(CC[N@@H+](CC3CC(C)C3)C2)C1 ZINC001484832243 1117766836 /nfs/dbraw/zinc/76/68/36/1117766836.db2.gz WDENVQHKDKCXRS-QLOJAFMTSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)CCC[NH2+]C1(C)CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001484927679 1117831946 /nfs/dbraw/zinc/83/19/46/1117831946.db2.gz YDJXTNVMNNAJCO-KRWDZBQOSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC(C)([NH2+]CC=C(Cl)Cl)CC2)C1 ZINC001484922994 1117839077 /nfs/dbraw/zinc/83/90/77/1117839077.db2.gz AFDWHZFCQSGTDC-ZDUSSCGKSA-N 1 3 348.318 2.618 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@H](NC(=O)Cc2nc[nH]c2C)C[C@H]1C ZINC001484986449 1117912806 /nfs/dbraw/zinc/91/28/06/1117912806.db2.gz RLAULFAXNCPQEL-TYGQBZDHSA-N 1 3 332.492 2.976 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@H](NC(=O)Cc2nc[nH]c2C)C[C@H]1C ZINC001484986449 1117912808 /nfs/dbraw/zinc/91/28/08/1117912808.db2.gz RLAULFAXNCPQEL-TYGQBZDHSA-N 1 3 332.492 2.976 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001484994660 1117929881 /nfs/dbraw/zinc/92/98/81/1117929881.db2.gz NJQMZQOHSPZOTF-SOUVJXGZSA-N 1 3 333.467 2.637 10 0 EFAEHO CCCCC[NH+]1CCC2(CCN(C(=O)CN3CCCC3)CC2)CC1 ZINC001485011298 1117942875 /nfs/dbraw/zinc/94/28/75/1117942875.db2.gz JQIPEQGUDTYRPH-UHFFFAOYSA-N 1 3 335.536 2.977 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@H+](C)CCc1ccccc1F ZINC001485078015 1118021970 /nfs/dbraw/zinc/02/19/70/1118021970.db2.gz DVKBVDYMKZCRKK-GOSISDBHSA-N 1 3 349.494 2.631 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@@H+](C)CCc1ccccc1F ZINC001485078015 1118021974 /nfs/dbraw/zinc/02/19/74/1118021974.db2.gz DVKBVDYMKZCRKK-GOSISDBHSA-N 1 3 349.494 2.631 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC1CC(C[NH2+]CCC(F)(F)F)C1 ZINC001485104933 1118052649 /nfs/dbraw/zinc/05/26/49/1118052649.db2.gz DCVDSWSBFDYRNI-YMAMQOFZSA-N 1 3 349.441 2.686 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@@H](C)[NH2+]CCc1ccccc1F ZINC001485181228 1118115709 /nfs/dbraw/zinc/11/57/09/1118115709.db2.gz RAKCPCLRYNGSMX-HZPDHXFCSA-N 1 3 349.494 2.725 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)[C@@H](C)NC(=O)CC[NH+]2CCCCC2)c1 ZINC001485227995 1118154354 /nfs/dbraw/zinc/15/43/54/1118154354.db2.gz BCLLDSINCHHCNE-IAGOWNOFSA-N 1 3 349.494 2.993 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)[C@@H](C)NC(=O)CC[NH+]2CCCCC2)c1 ZINC001485227986 1118154448 /nfs/dbraw/zinc/15/44/48/1118154448.db2.gz BCLLDSINCHHCNE-DLBZAZTESA-N 1 3 349.494 2.993 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)CC(C)(C)C[NH2+]C/C=C/Cl ZINC001485253024 1118169181 /nfs/dbraw/zinc/16/91/81/1118169181.db2.gz XITNBEHRJGWSDK-HEWZJLJBSA-N 1 3 329.916 2.688 10 0 EFAEHO C[C@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)N(C)Cc1ccc(F)cc1 ZINC001485314356 1118227291 /nfs/dbraw/zinc/22/72/91/1118227291.db2.gz UEUKUZHBNKEKJY-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)N(C)Cc1ccc(F)cc1 ZINC001485314356 1118227295 /nfs/dbraw/zinc/22/72/95/1118227295.db2.gz UEUKUZHBNKEKJY-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]Cc1ccccc1F ZINC001485429143 1118358778 /nfs/dbraw/zinc/35/87/78/1118358778.db2.gz POOTYUOXZIAPPW-OALUTQOASA-N 1 3 349.494 2.883 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC2(C[NH2+]CCC(F)(F)F)CCCCC2)C1 ZINC001485455069 1118367635 /nfs/dbraw/zinc/36/76/35/1118367635.db2.gz FCJPVSPZJWHELZ-AWEZNQCLSA-N 1 3 349.441 2.689 10 0 EFAEHO CC(C)C[C@@H](C)C[NH+]1CC([C@H](C)NC(=O)C(C)(C)N2CCCC2)C1 ZINC001485519932 1118433261 /nfs/dbraw/zinc/43/32/61/1118433261.db2.gz LIDSIUDBZUKWFI-SJORKVTESA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1ccc(C)c(C[NH+]2CC([C@@H](C)NC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001485526575 1118437279 /nfs/dbraw/zinc/43/72/79/1118437279.db2.gz OZQUYKGIDWBEQM-FUHWJXTLSA-N 1 3 343.515 2.582 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C1C[NH+](CC[C@H]2CCCC2(F)F)C1 ZINC001485532937 1118444278 /nfs/dbraw/zinc/44/42/78/1118444278.db2.gz LQEVOEGCSGSYLO-GOEBONIOSA-N 1 3 345.478 2.590 10 0 EFAEHO Cc1cc(C)cc(CN2C[C@@H](NC(=O)CCC[NH+](C)C)C(C)(C)C2)c1 ZINC001485575986 1118473341 /nfs/dbraw/zinc/47/33/41/1118473341.db2.gz AFQZFGJUJBKHMT-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]CC[C@@H]2CCCC2(F)F)C1)N(C)C ZINC001485695291 1118534079 /nfs/dbraw/zinc/53/40/79/1118534079.db2.gz FFAPLERTGIWSCA-VGWMRTNUSA-N 1 3 345.478 2.637 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H]1C[C@H](NC(=O)CN(C)CC(C)(C)C)C1 ZINC001485695843 1118534154 /nfs/dbraw/zinc/53/41/54/1118534154.db2.gz LFDVYAOQXGIXNK-UAPYVXQJSA-N 1 3 345.531 2.957 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H]2CCc3ccc(F)cc32)C1)N(C)C ZINC001485696038 1118534208 /nfs/dbraw/zinc/53/42/08/1118534208.db2.gz NTCDYNYEBMLCPU-AZFSHXRASA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]CC[C@H]2CCCC2(F)F)C1)N(C)C ZINC001485695290 1118534228 /nfs/dbraw/zinc/53/42/28/1118534228.db2.gz FFAPLERTGIWSCA-FPCVCCKLSA-N 1 3 345.478 2.637 10 0 EFAEHO C[C@H]([NH2+]CCCF)c1ccc(CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001272702142 1118669649 /nfs/dbraw/zinc/66/96/49/1118669649.db2.gz ZPEYIGJDSDADAS-HOTGVXAUSA-N 1 3 335.467 2.655 10 0 EFAEHO C[NH+](C)CCOCCN[C@H]1CCCOc2cc3c(cc21)CCCC3 ZINC000447593733 282108661 /nfs/dbraw/zinc/10/86/61/282108661.db2.gz UQUIBFCZMFTQPS-IBGZPJMESA-N 1 3 332.488 2.947 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@@H]1CC[N@H+](C)[C@@H](C)C1)[C@@H](c1ccccc1)N(C)C ZINC000357278725 299074134 /nfs/dbraw/zinc/07/41/34/299074134.db2.gz WSYYNGGJSKSJSJ-DKKFBQAASA-N 1 3 346.519 2.802 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1)[C@@H](c1ccccc1)N(C)C ZINC000357278725 299074136 /nfs/dbraw/zinc/07/41/36/299074136.db2.gz WSYYNGGJSKSJSJ-DKKFBQAASA-N 1 3 346.519 2.802 10 0 EFAEHO CN(C)[C@@H](CNC(=O)NC1CC([NH+]2CCCCC2)C1)c1ccccc1 ZINC000369722760 282174963 /nfs/dbraw/zinc/17/49/63/282174963.db2.gz NHWOWPDRGLRSGM-ACBHZAAOSA-N 1 3 344.503 2.605 10 0 EFAEHO CCCN1CCN(c2cc(Br)ccc2C[NH2+]C)CC1 ZINC000034824193 534929499 /nfs/dbraw/zinc/92/94/99/534929499.db2.gz BCDCBRWMEARJFH-UHFFFAOYSA-N 1 3 326.282 2.701 10 0 EFAEHO CN(C)[C@H](CNC(=O)C[NH2+][C@@H]1CC2CCC1CC2)c1ccccc1 ZINC000433069527 282238431 /nfs/dbraw/zinc/23/84/31/282238431.db2.gz VMFOVYUNXBCOIY-LRMJVLKBSA-N 1 3 329.488 2.574 10 0 EFAEHO CC(C)[NH+](CCNC(=O)NCCN1[C@H](C)CCC[C@H]1C)C(C)C ZINC000341351838 535069855 /nfs/dbraw/zinc/06/98/55/535069855.db2.gz CMYUYINIFFEHMY-IAGOWNOFSA-N 1 3 326.529 2.667 10 0 EFAEHO CN(Cc1ccc(C[N@H+](C)C[C@@H]2CCCO2)cc1)C[C@@H]1CCCO1 ZINC000103480761 219305141 /nfs/dbraw/zinc/30/51/41/219305141.db2.gz GZBNGQUORQSYLD-PMACEKPBSA-N 1 3 332.488 2.908 10 0 EFAEHO CN(Cc1ccc(C[N@@H+](C)C[C@@H]2CCCO2)cc1)C[C@@H]1CCCO1 ZINC000103480761 219305145 /nfs/dbraw/zinc/30/51/45/219305145.db2.gz GZBNGQUORQSYLD-PMACEKPBSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@@H](CN1CCCCC1)NC(=O)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000341454618 295903356 /nfs/dbraw/zinc/90/33/56/295903356.db2.gz CEEACSTUVVUEBT-ZWKOTPCHSA-N 1 3 336.524 2.521 10 0 EFAEHO CNC(=[NH2+])NC[C@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000363432215 283272953 /nfs/dbraw/zinc/27/29/53/283272953.db2.gz GTHHNAYWSDQQLT-TZMCWYRMSA-N 1 3 328.382 2.832 10 0 EFAEHO O[C@@H](C[NH+]1CCC(CNCc2ccccn2)CC1)c1ccccc1 ZINC000072254119 216084901 /nfs/dbraw/zinc/08/49/01/216084901.db2.gz VANVLKSMTNSDCZ-FQEVSTJZSA-N 1 3 325.456 2.617 10 0 EFAEHO O[C@@H](CN1CCC(C[NH2+]Cc2ccccn2)CC1)c1ccccc1 ZINC000072254119 216084903 /nfs/dbraw/zinc/08/49/03/216084903.db2.gz VANVLKSMTNSDCZ-FQEVSTJZSA-N 1 3 325.456 2.617 10 0 EFAEHO CN(Cc1ccccn1)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000075605658 216644824 /nfs/dbraw/zinc/64/48/24/216644824.db2.gz UBYXCKFXPKMAJE-OAQYLSRUSA-N 1 3 339.483 2.959 10 0 EFAEHO Cn1cnc(CCN[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)c1 ZINC000414121269 244015142 /nfs/dbraw/zinc/01/51/42/244015142.db2.gz GFEOPJDGEJVYMA-PWRODBHTSA-N 1 3 338.499 2.995 10 0 EFAEHO Cn1cnc(CCN[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)c1 ZINC000414121269 244015148 /nfs/dbraw/zinc/01/51/48/244015148.db2.gz GFEOPJDGEJVYMA-PWRODBHTSA-N 1 3 338.499 2.995 10 0 EFAEHO C[C@H](CCC(C)(C)C)[NH2+]CC1(N2CCOCC2)CCN(C)CC1 ZINC000414185630 244035773 /nfs/dbraw/zinc/03/57/73/244035773.db2.gz GVQXTJMTNGFTFE-QGZVFWFLSA-N 1 3 325.541 2.587 10 0 EFAEHO C[C@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)[C@@]1(C)CCCO1 ZINC000414308445 244082873 /nfs/dbraw/zinc/08/28/73/244082873.db2.gz QEUBSDZURXRXHE-PKOBYXMFSA-N 1 3 332.488 2.561 10 0 EFAEHO COC[C@@H](CC(C)C)[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000414308462 244084374 /nfs/dbraw/zinc/08/43/74/244084374.db2.gz QGOYUOPNVUQEIG-LJQANCHMSA-N 1 3 334.504 2.664 10 0 EFAEHO COC[C@H](CC(C)C)[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000414308461 244084717 /nfs/dbraw/zinc/08/47/17/244084717.db2.gz QGOYUOPNVUQEIG-IBGZPJMESA-N 1 3 334.504 2.664 10 0 EFAEHO CC(C)NC(=O)[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000414347932 244100680 /nfs/dbraw/zinc/10/06/80/244100680.db2.gz RLRYPNKSTYRDKM-OWYHZJEWSA-N 1 3 329.488 2.685 10 0 EFAEHO CN(C)c1ncc(C[NH2+]C[C@H]2CCCN(C)[C@@H]2c2cccs2)n1C ZINC000414360545 244106570 /nfs/dbraw/zinc/10/65/70/244106570.db2.gz RDBOQALPGMPPLP-PBHICJAKSA-N 1 3 347.532 2.720 10 0 EFAEHO C[C@@H]1C[C@@H](CN(CCO)Cc2cc(Br)cs2)CC[NH2+]1 ZINC000414752782 244326352 /nfs/dbraw/zinc/32/63/52/244326352.db2.gz CRUFYQBBVVBSQR-NEPJUHHUSA-N 1 3 347.322 2.693 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)CC(=O)NCCc2ccccc2)cc1 ZINC000414808559 244361448 /nfs/dbraw/zinc/36/14/48/244361448.db2.gz FGBVVYPKHVBIHB-IRXDYDNUSA-N 1 3 339.483 2.933 10 0 EFAEHO Cc1cc(N[C@@H]2CC[NH2+]C[C@H]2O)c2cc(C(F)(F)F)ccc2n1 ZINC000077504939 216922951 /nfs/dbraw/zinc/92/29/51/216922951.db2.gz OUYQOIHQTDYHPT-UKRRQHHQSA-N 1 3 325.334 2.697 10 0 EFAEHO CCN(C(=O)N[C@H](C)CC[NH3+])[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418546301 284187993 /nfs/dbraw/zinc/18/79/93/284187993.db2.gz JKEWLFYHUGYODW-JFIYKMOQSA-N 1 3 332.492 2.591 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)NCCN(C)Cc2ccccc2)cc1 ZINC000417229533 245054214 /nfs/dbraw/zinc/05/42/14/245054214.db2.gz IOEWTQGLKXPYFI-MRXNPFEDSA-N 1 3 340.471 2.638 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCN(C(=O)NC2CCC([NH3+])CC2)CC1 ZINC000418395091 245144583 /nfs/dbraw/zinc/14/45/83/245144583.db2.gz GVEHFPBDYSSFGS-UHFFFAOYSA-N 1 3 338.540 2.798 10 0 EFAEHO CC(C)[C@H]([NH3+])CNC(=O)N1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000418415151 245150562 /nfs/dbraw/zinc/15/05/62/245150562.db2.gz UIQUAFBZEFMCCS-OAHLLOKOSA-N 1 3 326.529 2.512 10 0 EFAEHO CCCN(CC[NH+]1CCCCCC1)C(=O)NC[C@@H](N)c1ccccc1 ZINC000418459391 245166437 /nfs/dbraw/zinc/16/64/37/245166437.db2.gz YENZSGRBZVAWEF-LJQANCHMSA-N 1 3 346.519 2.984 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)N(C)[C@H]1CC[N@@H+](CC)C[C@H]1C ZINC000418644568 245224266 /nfs/dbraw/zinc/22/42/66/245224266.db2.gz CHUUIJVUBNLFRO-LZQZEXGQSA-N 1 3 346.519 2.621 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)N(C)[C@H]1CC[N@H+](CC)C[C@H]1C ZINC000418644568 245224270 /nfs/dbraw/zinc/22/42/70/245224270.db2.gz CHUUIJVUBNLFRO-LZQZEXGQSA-N 1 3 346.519 2.621 10 0 EFAEHO CC[C@H]([NH3+])CNC(=O)N(CC)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418711239 245256890 /nfs/dbraw/zinc/25/68/90/245256890.db2.gz WGKRVPAJVOJCLD-NJAFHUGGSA-N 1 3 332.492 2.591 10 0 EFAEHO CCN(C(=O)N[C@H](C)CCC[NH3+])[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418689780 245247639 /nfs/dbraw/zinc/24/76/39/245247639.db2.gz OUZJTPQGIJQKJQ-AOIWGVFYSA-N 1 3 346.519 2.981 10 0 EFAEHO Cc1ccc(CC(C)(C)[NH2+]CC(=O)NC2CCN(C3CC3)CC2)cc1 ZINC000419312851 245373439 /nfs/dbraw/zinc/37/34/39/245373439.db2.gz DASBHLBHULMTIY-UHFFFAOYSA-N 1 3 343.515 2.649 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NCc1cccc(C[NH+](C)C)c1 ZINC000079451462 217226251 /nfs/dbraw/zinc/22/62/51/217226251.db2.gz LXVXUWSECQITDL-SFHVURJKSA-N 1 3 334.508 2.524 10 0 EFAEHO CN(c1ccccc1CN1CCC2(CC[NH2+]2)CC1)C1CCN(C)CC1 ZINC000422559688 246384056 /nfs/dbraw/zinc/38/40/56/246384056.db2.gz DVPLPRAYDJNXHC-UHFFFAOYSA-N 1 3 342.531 2.545 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CCN(C3CCCCC3)CC2)CCCCC1 ZINC000427053865 247312411 /nfs/dbraw/zinc/31/24/11/247312411.db2.gz VHQWLBOAJLTYNT-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO c1cc(-c2ccc(CN3CCC(OCC[NH+]4CCCC4)CC3)o2)n[nH]1 ZINC000435129750 248213382 /nfs/dbraw/zinc/21/33/82/248213382.db2.gz MIPJKXKZICZZJB-UHFFFAOYSA-N 1 3 344.459 2.747 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CC[C@H]([NH+]2CCCCC2)C1 ZINC000264592057 296249531 /nfs/dbraw/zinc/24/95/31/296249531.db2.gz LSDLOUXTCPHNEK-FQEVSTJZSA-N 1 3 341.499 2.983 10 0 EFAEHO C[C@@H]1[C@H](c2ccccc2)CCN1CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000434895916 248195569 /nfs/dbraw/zinc/19/55/69/248195569.db2.gz MLTLRLGHOPFUTN-OXQOHEQNSA-N 1 3 341.499 2.607 10 0 EFAEHO C[C@H]1[C@H](c2ccccc2)CCN1CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000434895915 248196565 /nfs/dbraw/zinc/19/65/65/248196565.db2.gz MLTLRLGHOPFUTN-OXJNMPFZSA-N 1 3 341.499 2.607 10 0 EFAEHO CN(Cc1ccccc1)C[C@@H](O)COc1ccc(C[NH2+]C2CC2)cc1 ZINC000012430316 211378768 /nfs/dbraw/zinc/37/87/68/211378768.db2.gz ZQVFVZWQBUSYEO-HXUWFJFHSA-N 1 3 340.467 2.810 10 0 EFAEHO COc1ccc(CN2CCCC2)cc1OC[C@H](O)C[NH+]1CCCCC1 ZINC000012372835 211359278 /nfs/dbraw/zinc/35/92/78/211359278.db2.gz PUBYKQXLUYALAD-GOSISDBHSA-N 1 3 348.487 2.517 10 0 EFAEHO CCO[C@H](CC[NH+](C)C)CNCc1cnc(-c2ccncc2)s1 ZINC000441706390 250049754 /nfs/dbraw/zinc/04/97/54/250049754.db2.gz WYSVAEQJDLJFAO-OAHLLOKOSA-N 1 3 334.489 2.652 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000340102454 296312166 /nfs/dbraw/zinc/31/21/66/296312166.db2.gz LSAIFRUPVSLRRD-BHIYHBOVSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000340102454 296312167 /nfs/dbraw/zinc/31/21/67/296312167.db2.gz LSAIFRUPVSLRRD-BHIYHBOVSA-N 1 3 344.503 2.605 10 0 EFAEHO CC(C)(C)CC(C)(C)[NH+]1CCC(NC[C@@H](CO)[C@H]2CCOC2)CC1 ZINC000449301753 250989645 /nfs/dbraw/zinc/98/96/45/250989645.db2.gz SLEAULCBXSZIFH-IRXDYDNUSA-N 1 3 340.552 2.900 10 0 EFAEHO COC[C@](C)(O)CC[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000449383720 251004589 /nfs/dbraw/zinc/00/45/89/251004589.db2.gz JNGDTPLMQSEXBT-DOIPELPJSA-N 1 3 346.515 2.664 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H](C)CC(C)(C)O)CC1 ZINC000449453007 251030840 /nfs/dbraw/zinc/03/08/40/251030840.db2.gz VUEMIBGHMNXEIS-QGZVFWFLSA-N 1 3 333.520 2.858 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CCCCN2CCOCC2)CCN1Cc1ccccc1 ZINC000268782068 252232950 /nfs/dbraw/zinc/23/29/50/252232950.db2.gz QEBTXGLZXISHMY-CTNGQTDRSA-N 1 3 345.531 2.742 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)NCCCCC[NH+]1CCCC1 ZINC000454492288 252282671 /nfs/dbraw/zinc/28/26/71/252282671.db2.gz YBIYYGUFOYJBMA-QZTJIDSGSA-N 1 3 338.540 2.815 10 0 EFAEHO CCN1CCCC[C@H]1CNC(=O)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000246699116 285203602 /nfs/dbraw/zinc/20/36/02/285203602.db2.gz XZWJYZNGPLZOLF-ZWKOTPCHSA-N 1 3 336.524 2.521 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)N[C@H](C)C1CCCC1 ZINC000341139676 285278585 /nfs/dbraw/zinc/27/85/85/285278585.db2.gz KCCYYUVUOBPFQN-AEFFLSMTSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)N[C@H](C)C1CCCC1 ZINC000341139676 285278588 /nfs/dbraw/zinc/27/85/88/285278588.db2.gz KCCYYUVUOBPFQN-AEFFLSMTSA-N 1 3 338.540 2.623 10 0 EFAEHO CNC(=O)C[C@H]([NH2+]C1CCN(c2ccncc2)CC1)c1ccccc1 ZINC000459522146 255891687 /nfs/dbraw/zinc/89/16/87/255891687.db2.gz WKZSPLJDEZOGRW-IBGZPJMESA-N 1 3 338.455 2.517 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)c1oc2ccccc2c1CN(C)C ZINC000118771122 221180436 /nfs/dbraw/zinc/18/04/36/221180436.db2.gz OPQJQOQNGGEFJV-CQSZACIVSA-N 1 3 331.460 2.955 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)C[C@H](c2ccccc2)N(C)C)[C@H](C)C1 ZINC000433471980 285385751 /nfs/dbraw/zinc/38/57/51/285385751.db2.gz QROOGPHYUDXNJB-NZSAHSFTSA-N 1 3 331.504 2.868 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)C[C@H](c2ccccc2)N(C)C)[C@H](C)C1 ZINC000433471980 285385752 /nfs/dbraw/zinc/38/57/52/285385752.db2.gz QROOGPHYUDXNJB-NZSAHSFTSA-N 1 3 331.504 2.868 10 0 EFAEHO C[C@@H](NCC1CC[NH+](C[C@H](O)c2ccccc2)CC1)c1nccn1C ZINC000182862370 141377531 /nfs/dbraw/zinc/37/75/31/141377531.db2.gz RQJAMZHNEIZODH-APWZRJJASA-N 1 3 342.487 2.516 10 0 EFAEHO C[C@@H]1CN(C)C[C@H]1[NH2+]CCCOC1CCN(Cc2ccccc2)CC1 ZINC000344728822 142068323 /nfs/dbraw/zinc/06/83/23/142068323.db2.gz WZJZOYUJFVXRMN-WIYYLYMNSA-N 1 3 345.531 2.597 10 0 EFAEHO C[N@H+](CCN1CCN(CC[C@@H]2CCCCO2)CC1)Cc1ccccc1 ZINC000347472500 142222835 /nfs/dbraw/zinc/22/28/35/142222835.db2.gz ZKQNUYPAEMEFAS-NRFANRHFSA-N 1 3 345.531 2.695 10 0 EFAEHO C[N@@H+](CCN1CCN(CC[C@@H]2CCCCO2)CC1)Cc1ccccc1 ZINC000347472500 142222836 /nfs/dbraw/zinc/22/28/36/142222836.db2.gz ZKQNUYPAEMEFAS-NRFANRHFSA-N 1 3 345.531 2.695 10 0 EFAEHO COCCN1CCC[C@@H]1C[NH2+][C@@H](C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000348047520 142313591 /nfs/dbraw/zinc/31/35/91/142313591.db2.gz STISDUKCNDULBK-SESVDKBCSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCCCNC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000349660293 142344545 /nfs/dbraw/zinc/34/45/45/142344545.db2.gz BENDOWNLBRWXHY-FUHWJXTLSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCCCNC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000349660293 142344547 /nfs/dbraw/zinc/34/45/47/142344547.db2.gz BENDOWNLBRWXHY-FUHWJXTLSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)NCC1([NH+](C)C)CCCCC1 ZINC000341236255 145018749 /nfs/dbraw/zinc/01/87/49/145018749.db2.gz NGBGJKGFIYZZQT-IAGOWNOFSA-N 1 3 338.540 2.813 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H](CNC(=O)NCCN2[C@H](C)CCC[C@H]2C)C1 ZINC000341433924 145051413 /nfs/dbraw/zinc/05/14/13/145051413.db2.gz QOCYQCZCGCEWSP-KZNAEPCWSA-N 1 3 338.540 2.669 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H](CNC(=O)NCCN2[C@H](C)CCC[C@H]2C)C1 ZINC000341433924 145051415 /nfs/dbraw/zinc/05/14/15/145051415.db2.gz QOCYQCZCGCEWSP-KZNAEPCWSA-N 1 3 338.540 2.669 10 0 EFAEHO Cc1ccccc1-n1cc(CNC2CCC(C[NH+](C)C)CC2)nn1 ZINC000342195531 145078701 /nfs/dbraw/zinc/07/87/01/145078701.db2.gz XFIWWEFGDPUDDR-UHFFFAOYSA-N 1 3 327.476 2.786 10 0 EFAEHO COC1([C@H](C)[NH2+]CC2(N3CCCCC3)CCN(C)CC2)CCCC1 ZINC000421832344 292145083 /nfs/dbraw/zinc/14/50/83/292145083.db2.gz MJZXJRCYHXTLJK-SFHVURJKSA-N 1 3 337.552 2.874 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000349080946 146048978 /nfs/dbraw/zinc/04/89/78/146048978.db2.gz MJHRWZKABZXNRG-LJQANCHMSA-N 1 3 329.488 2.773 10 0 EFAEHO COc1c(C)cc(CN(C)CC[N@H+](C)C2CCN(C)CC2)cc1C ZINC000349082806 146049579 /nfs/dbraw/zinc/04/95/79/146049579.db2.gz XVXQVLPLVPQGAX-UHFFFAOYSA-N 1 3 333.520 2.770 10 0 EFAEHO COc1c(C)cc(CN(C)CC[N@@H+](C)C2CCN(C)CC2)cc1C ZINC000349082806 146049581 /nfs/dbraw/zinc/04/95/81/146049581.db2.gz XVXQVLPLVPQGAX-UHFFFAOYSA-N 1 3 333.520 2.770 10 0 EFAEHO Cc1cccc(O[C@@H]2CCCC[C@@H]2NC[C@H](O)C[N@@H+](C)C2CC2)c1 ZINC000351601916 146156786 /nfs/dbraw/zinc/15/67/86/146156786.db2.gz GWQZGJDRVIPVTJ-YSIASYRMSA-N 1 3 332.488 2.730 10 0 EFAEHO Cc1cccc(O[C@@H]2CCCC[C@@H]2NC[C@H](O)C[N@H+](C)C2CC2)c1 ZINC000351601916 146156788 /nfs/dbraw/zinc/15/67/88/146156788.db2.gz GWQZGJDRVIPVTJ-YSIASYRMSA-N 1 3 332.488 2.730 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)[C@@H](C)Cc1ccccc1 ZINC000352825136 146325768 /nfs/dbraw/zinc/32/57/68/146325768.db2.gz CBZDSTKTMBKLBL-AZUAARDMSA-N 1 3 345.531 2.740 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)[C@@H](C)Cc1ccccc1 ZINC000352825136 146325770 /nfs/dbraw/zinc/32/57/70/146325770.db2.gz CBZDSTKTMBKLBL-AZUAARDMSA-N 1 3 345.531 2.740 10 0 EFAEHO CN(CCC[NH+](C)C)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1 ZINC000680508803 549335873 /nfs/dbraw/zinc/33/58/73/549335873.db2.gz XUOIFUSQAFRDLZ-IBGZPJMESA-N 1 3 346.519 2.807 10 0 EFAEHO CC[C@H]1C[C@H](C[NH+]2CCC(N3CCN(C(C)C)CC3)CC2)CCO1 ZINC000356994391 147394628 /nfs/dbraw/zinc/39/46/28/147394628.db2.gz OJKLYROKWFETOG-QUCCMNQESA-N 1 3 337.552 2.682 10 0 EFAEHO COC1CCN(C2(C[NH2+][C@@H]3CCN(C)[C@H]4CCC[C@H]43)CCCC2)CC1 ZINC000353531840 292169484 /nfs/dbraw/zinc/16/94/84/292169484.db2.gz PMXFBNLGVSVINR-ZCNNSNEGSA-N 1 3 349.563 2.872 10 0 EFAEHO COc1cc(C)c(CN2CCC(OCC[NH+]3CCCC3)CC2)c(C)n1 ZINC000359237586 148032314 /nfs/dbraw/zinc/03/23/14/148032314.db2.gz PUKZWJGRQKNKHE-UHFFFAOYSA-N 1 3 347.503 2.784 10 0 EFAEHO CN(C)C(=O)CC[NH+]1CCC(N[C@H](c2ccc(F)cc2)C2CC2)CC1 ZINC000359367547 148067521 /nfs/dbraw/zinc/06/75/21/148067521.db2.gz BOTKYPYJROLSKT-FQEVSTJZSA-N 1 3 347.478 2.809 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]CCN2CCCC[C@@H]2C)[C@@H](C)C1 ZINC000359926293 148225480 /nfs/dbraw/zinc/22/54/80/148225480.db2.gz QBRFKXOMYYZEDR-FHWLQOOXSA-N 1 3 325.541 2.587 10 0 EFAEHO CCN1CCC[C@H]1CNC(=[NH2+])NCc1cccc(-c2cccnc2)c1 ZINC000368435410 150116864 /nfs/dbraw/zinc/11/68/64/150116864.db2.gz LRBXEKYANLLPIS-IBGZPJMESA-N 1 3 337.471 2.847 10 0 EFAEHO O=C(CN1CCCC12CCC2)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000373096787 151112516 /nfs/dbraw/zinc/11/25/16/151112516.db2.gz DVIYGDNZISYYJH-UHFFFAOYSA-N 1 3 341.499 2.917 10 0 EFAEHO C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]C1CC(N2CCCCC2)C1 ZINC000373522642 151184228 /nfs/dbraw/zinc/18/42/28/151184228.db2.gz NJWVRXZVMDQXHP-GHOZHQTGSA-N 1 3 342.531 2.899 10 0 EFAEHO CC(C)(C)OC(=O)N1CC[C@](C)(CN[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000373850953 151237554 /nfs/dbraw/zinc/23/75/54/151237554.db2.gz OLTDJDQYPNAXTJ-GPMSIDNRSA-N 1 3 337.508 2.850 10 0 EFAEHO CC(C)(C)OC(=O)N1CC[C@](C)(CN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)C1 ZINC000373850953 151237556 /nfs/dbraw/zinc/23/75/56/151237556.db2.gz OLTDJDQYPNAXTJ-GPMSIDNRSA-N 1 3 337.508 2.850 10 0 EFAEHO CC(C)(C)OC(=O)N1CC[C@](C)(C[NH2+][C@@H]2CCN3CCC[C@@H]3C2)C1 ZINC000373850953 151237557 /nfs/dbraw/zinc/23/75/57/151237557.db2.gz OLTDJDQYPNAXTJ-GPMSIDNRSA-N 1 3 337.508 2.850 10 0 EFAEHO CC[C@@H]1C[C@H](CN2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)CCO1 ZINC000356998346 287303044 /nfs/dbraw/zinc/30/30/44/287303044.db2.gz UBWLVGBXAHKKFV-UAFMIMERSA-N 1 3 337.552 2.682 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000341341105 287390109 /nfs/dbraw/zinc/39/01/09/287390109.db2.gz FEMPRYSIFPBOQW-KZNAEPCWSA-N 1 3 336.524 2.519 10 0 EFAEHO CCCN1CCC([NH2+]Cc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)CC1 ZINC000157134995 544773904 /nfs/dbraw/zinc/77/39/04/544773904.db2.gz KWKFNRUAECYQEO-IRXDYDNUSA-N 1 3 346.519 2.659 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)CCOCC(F)(F)C(F)(F)F)[C@H](C)C1 ZINC000189688547 265197190 /nfs/dbraw/zinc/19/71/90/265197190.db2.gz IDVHUSSEFAISON-VXGBXAGGSA-N 1 3 332.357 2.863 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)CCOCC(F)(F)C(F)(F)F)[C@H](C)C1 ZINC000189688547 265197194 /nfs/dbraw/zinc/19/71/94/265197194.db2.gz IDVHUSSEFAISON-VXGBXAGGSA-N 1 3 332.357 2.863 10 0 EFAEHO Cc1ccc(C)c(OC[C@H](O)CN2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000047972223 272983777 /nfs/dbraw/zinc/98/37/77/272983777.db2.gz OIHXQEGJURDEFQ-HXUWFJFHSA-N 1 3 346.515 2.851 10 0 EFAEHO CCCC[N@H+](C)CC1CCN(C(=O)N[C@H]2CCCN(CC)C2)CC1 ZINC000194170154 265365595 /nfs/dbraw/zinc/36/55/95/265365595.db2.gz HFNWQOIJUIXBAH-SFHVURJKSA-N 1 3 338.540 2.624 10 0 EFAEHO CCCC[N@@H+](C)CC1CCN(C(=O)N[C@H]2CCCN(CC)C2)CC1 ZINC000194170154 265365597 /nfs/dbraw/zinc/36/55/97/265365597.db2.gz HFNWQOIJUIXBAH-SFHVURJKSA-N 1 3 338.540 2.624 10 0 EFAEHO CC(C)N1C[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)CC1=O ZINC000272281482 266213981 /nfs/dbraw/zinc/21/39/81/266213981.db2.gz AHLFKUKAYALYPH-WTGUMLROSA-N 1 3 341.499 2.781 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+]Cc2ccnn2-c2ccccc2)C[C@H](C)O1 ZINC000279169764 273184304 /nfs/dbraw/zinc/18/43/04/273184304.db2.gz QPXLBSBGWFZIFD-HDICACEKSA-N 1 3 342.487 2.851 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)CC[N@@H+]1C ZINC000279265805 273195268 /nfs/dbraw/zinc/19/52/68/273195268.db2.gz VNDMGDZPOLAHLB-BBWFWOEESA-N 1 3 349.544 2.807 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)CC[N@H+]1C ZINC000279265805 273195270 /nfs/dbraw/zinc/19/52/70/273195270.db2.gz VNDMGDZPOLAHLB-BBWFWOEESA-N 1 3 349.544 2.807 10 0 EFAEHO Cc1ccc(NC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c(OCCN(C)C)c1 ZINC000279309900 273201085 /nfs/dbraw/zinc/20/10/85/273201085.db2.gz AQPRXJDPKOOKBM-HOTGVXAUSA-N 1 3 333.476 2.604 10 0 EFAEHO Cc1ccc(NC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c(OCCN(C)C)c1 ZINC000279309900 273201086 /nfs/dbraw/zinc/20/10/86/273201086.db2.gz AQPRXJDPKOOKBM-HOTGVXAUSA-N 1 3 333.476 2.604 10 0 EFAEHO CCC[C@@H](C(=O)NC[C@H](C1CC1)[N@H+](C)Cc1ccccc1)N(C)C ZINC000185332785 276021108 /nfs/dbraw/zinc/02/11/08/276021108.db2.gz ZGQMFGFLBFBOAS-RBUKOAKNSA-N 1 3 331.504 2.744 10 0 EFAEHO CCC[C@@H](C(=O)NC[C@H](C1CC1)[N@@H+](C)Cc1ccccc1)N(C)C ZINC000185332785 276021109 /nfs/dbraw/zinc/02/11/09/276021109.db2.gz ZGQMFGFLBFBOAS-RBUKOAKNSA-N 1 3 331.504 2.744 10 0 EFAEHO CCN(C(=O)NC1CC[NH2+]CC1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418313752 276062297 /nfs/dbraw/zinc/06/22/97/276062297.db2.gz WEYYNQBIYMZZCN-APWZRJJASA-N 1 3 344.503 2.605 10 0 EFAEHO CCN(C(=O)C1CC[NH2+]CC1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000368453751 276298398 /nfs/dbraw/zinc/29/83/98/276298398.db2.gz MLXVQGAHUGDERI-APWZRJJASA-N 1 3 329.488 2.670 10 0 EFAEHO CCN(C(=O)NC1CC[NH2+]CC1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418313759 276299504 /nfs/dbraw/zinc/29/95/04/276299504.db2.gz WEYYNQBIYMZZCN-VQIMIIECSA-N 1 3 344.503 2.605 10 0 EFAEHO CCO[C@H]1C[C@@](O)(CNC2CC[NH+](C3CCCCC3)CC2)C1(C)C ZINC000189432684 276363908 /nfs/dbraw/zinc/36/39/08/276363908.db2.gz AXQSFYRXQZZZKL-AZUAARDMSA-N 1 3 338.536 2.939 10 0 EFAEHO CCO[C@H]1C[C@@](O)(C[NH2+]C2CCN(C3CCCCC3)CC2)C1(C)C ZINC000189432684 276363912 /nfs/dbraw/zinc/36/39/12/276363912.db2.gz AXQSFYRXQZZZKL-AZUAARDMSA-N 1 3 338.536 2.939 10 0 EFAEHO CCOC(=O)[C@@H]1CC[C@H](N[C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423097861 276437419 /nfs/dbraw/zinc/43/74/19/276437419.db2.gz RHSCWSAFJIUVSN-RPWFAHAXSA-N 1 3 344.455 2.564 10 0 EFAEHO C[NH+](C)CCOCCN[C@@H]1CCCc2ncc(C(F)(F)F)cc21 ZINC000447603838 276792186 /nfs/dbraw/zinc/79/21/86/276792186.db2.gz XZGZPBCATBTCQI-CQSZACIVSA-N 1 3 331.382 2.646 10 0 EFAEHO CN1CC[C@H](NC(=O)NC(C)(C)C[NH+]2CCCC2)[C@@H]1c1ccccc1 ZINC000458567569 277166406 /nfs/dbraw/zinc/16/64/06/277166406.db2.gz CWMFPBRVFNXLQG-ROUUACIJSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H](CCC[NH3+])NC(=O)NCc1ccccc1CN1CCCCC1 ZINC000416908266 277562411 /nfs/dbraw/zinc/56/24/11/277562411.db2.gz WATLMVNAUGPQQC-INIZCTEOSA-N 1 3 332.492 2.599 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)[C@@H](C[NH3+])c2ccc(F)cc2)cc1 ZINC000358742219 278049626 /nfs/dbraw/zinc/04/96/26/278049626.db2.gz IZGAQXCAODJDHI-RBUKOAKNSA-N 1 3 343.446 2.808 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21)N1CCc2ccccc2C1 ZINC000353502467 278209906 /nfs/dbraw/zinc/20/99/06/278209906.db2.gz LMPUMBLTDFEVBK-QYRPDUKASA-N 1 3 327.516 2.896 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@@H+](C)[C@@H]2CCC[C@@H]21)N1CCc2ccccc2C1 ZINC000353502467 278209908 /nfs/dbraw/zinc/20/99/08/278209908.db2.gz LMPUMBLTDFEVBK-QYRPDUKASA-N 1 3 327.516 2.896 10 0 EFAEHO CCN1CCC[C@@H]1CN(C)C(=O)NCCCC[N@@H+]1CCC[C@H](C)C1 ZINC000177400312 279297620 /nfs/dbraw/zinc/29/76/20/279297620.db2.gz UNBLXUMLOWWCEW-ZWKOTPCHSA-N 1 3 338.540 2.624 10 0 EFAEHO CCN1CCC[C@@H]1CN(C)C(=O)NCCCC[N@H+]1CCC[C@H](C)C1 ZINC000177400312 279297621 /nfs/dbraw/zinc/29/76/21/279297621.db2.gz UNBLXUMLOWWCEW-ZWKOTPCHSA-N 1 3 338.540 2.624 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)NCCC1CCCC1 ZINC000340956116 279302682 /nfs/dbraw/zinc/30/26/82/279302682.db2.gz RAIUMSNDXKOTRH-GOSISDBHSA-N 1 3 338.540 2.624 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)NCCC1CCCC1 ZINC000340956116 279302683 /nfs/dbraw/zinc/30/26/83/279302683.db2.gz RAIUMSNDXKOTRH-GOSISDBHSA-N 1 3 338.540 2.624 10 0 EFAEHO C[NH+](C)CC1CCC(NC(=O)NCCN2CCCC(C)(C)C2)CC1 ZINC000445221050 289102366 /nfs/dbraw/zinc/10/23/66/289102366.db2.gz VZVAKDRFSOHVPK-UHFFFAOYSA-N 1 3 338.540 2.528 10 0 EFAEHO CN1CC[C@@H](NC(=O)NC(C)(C)CCC[NH+](C)C)[C@@H]1c1ccccc1 ZINC000458575412 289109072 /nfs/dbraw/zinc/10/90/72/289109072.db2.gz IUKQAMNSIDDCOT-MSOLQXFVSA-N 1 3 346.519 2.851 10 0 EFAEHO C[NH+](C)CCOCCN[C@@H]1CCCOc2cc3c(cc21)CCCC3 ZINC000447593734 289170001 /nfs/dbraw/zinc/17/00/01/289170001.db2.gz UQUIBFCZMFTQPS-LJQANCHMSA-N 1 3 332.488 2.947 10 0 EFAEHO CN(C)[C@H](CC(=O)N1CCC[C@@H]1C[NH+]1CCCC1)c1ccccc1 ZINC000416142076 289350045 /nfs/dbraw/zinc/35/00/45/289350045.db2.gz FNCZUFZMLFGMCY-RTBURBONSA-N 1 3 329.488 2.766 10 0 EFAEHO CN1CC[C@H]([NH2+]CC2(N3CCSCC3)CCCC2)[C@@H]2CCC[C@H]21 ZINC000353443975 290216676 /nfs/dbraw/zinc/21/66/76/290216676.db2.gz FDIURMRLODZKEV-OKZBNKHCSA-N 1 3 337.577 2.810 10 0 EFAEHO COC[C@@H](CCC[NH3+])NC1(c2ccc(OC(F)(F)F)cc2)CC1 ZINC000423147235 292804348 /nfs/dbraw/zinc/80/43/48/292804348.db2.gz RLSAURJOCWEIGA-CYBMUJFWSA-N 1 3 332.366 2.918 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)NCCN2CCCCCC2)CC1 ZINC000372607795 292979667 /nfs/dbraw/zinc/97/96/67/292979667.db2.gz WBMLESQRFHINOT-UHFFFAOYSA-N 1 3 344.503 2.599 10 0 EFAEHO C[C@H](C[NH2+]C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)CN1CCCC1 ZINC000130006887 293150645 /nfs/dbraw/zinc/15/06/45/293150645.db2.gz QFNQDSFYSXXDCT-SJORKVTESA-N 1 3 339.524 2.955 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NCc2cccc(CN(C)C)c2)CC1 ZINC000157759943 293553381 /nfs/dbraw/zinc/55/33/81/293553381.db2.gz FYRJMWSTXLBCMW-UHFFFAOYSA-N 1 3 346.519 2.669 10 0 EFAEHO COc1ccc(CN2CCC(C[NH2+]Cc3conc3C)CC2)cc1 ZINC000293571215 295002226 /nfs/dbraw/zinc/00/22/26/295002226.db2.gz NAFISXJWEFRRHP-UHFFFAOYSA-N 1 3 329.444 2.993 10 0 EFAEHO C[N@@H+]1CCC[C@@]2(CCN(C(=O)c3cccc(CN4CCCC4)c3)C2)C1 ZINC000294292382 295142376 /nfs/dbraw/zinc/14/23/76/295142376.db2.gz VKQDXVVECKFWBM-OAQYLSRUSA-N 1 3 341.499 2.840 10 0 EFAEHO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cccc(CN4CCCC4)c3)C2)C1 ZINC000294292382 295142379 /nfs/dbraw/zinc/14/23/79/295142379.db2.gz VKQDXVVECKFWBM-OAQYLSRUSA-N 1 3 341.499 2.840 10 0 EFAEHO NC[C@@H]1CCCC[C@H]1[NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000423085358 295251023 /nfs/dbraw/zinc/25/10/23/295251023.db2.gz KIUUIFWMOJKSRA-HOJRLLLISA-N 1 3 333.442 2.899 10 0 EFAEHO COc1cc(OC)c(C[C@H](C)N[C@H]2CC[N@@H+]3CCC[C@H]3C2)c(OC)c1 ZINC000295080291 295265508 /nfs/dbraw/zinc/26/55/08/295265508.db2.gz RYIDPVBSBTXTEU-JYJNAYRXSA-N 1 3 348.487 2.860 10 0 EFAEHO COc1cc(OC)c(C[C@H](C)N[C@H]2CC[N@H+]3CCC[C@H]3C2)c(OC)c1 ZINC000295080291 295265510 /nfs/dbraw/zinc/26/55/10/295265510.db2.gz RYIDPVBSBTXTEU-JYJNAYRXSA-N 1 3 348.487 2.860 10 0 EFAEHO c1c(CNCC2CC[NH+](Cc3ccccc3)CC2)nc2ncccn12 ZINC000298444416 310990238 /nfs/dbraw/zinc/99/02/38/310990238.db2.gz NQRXJTYTEVPONO-UHFFFAOYSA-N 1 3 335.455 2.731 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)CC[N@@H+]1C ZINC000316874818 311235682 /nfs/dbraw/zinc/23/56/82/311235682.db2.gz WWGPNWALDHJHRI-JHJVBQTASA-N 1 3 347.286 2.805 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)CC[N@H+]1C ZINC000316874818 311235684 /nfs/dbraw/zinc/23/56/84/311235684.db2.gz WWGPNWALDHJHRI-JHJVBQTASA-N 1 3 347.286 2.805 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCOCC(F)F)CC1 ZINC000349214699 311760077 /nfs/dbraw/zinc/76/00/77/311760077.db2.gz FZJRMPMXMIAMMC-UHFFFAOYSA-N 1 3 341.446 2.590 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1ccccc1Cl)N[C@H]1CC[NH2+]C[C@@H]1C ZINC000414940420 312068049 /nfs/dbraw/zinc/06/80/49/312068049.db2.gz KJEXTTSNEPZISI-VBQJREDUSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+][C@H]1CCNC[C@@H]1C ZINC000414940420 312068051 /nfs/dbraw/zinc/06/80/51/312068051.db2.gz KJEXTTSNEPZISI-VBQJREDUSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@H](N)[C@H](C)[NH2+]C1CCN(Cc2ccccc2Br)CC1 ZINC000415023329 312078896 /nfs/dbraw/zinc/07/88/96/312078896.db2.gz WTGYLMNPYGDSTM-STQMWFEESA-N 1 3 340.309 2.739 10 0 EFAEHO C[C@H]([NH3+])[C@H](C)NC1CCN(Cc2ccccc2Br)CC1 ZINC000415023329 312078897 /nfs/dbraw/zinc/07/88/97/312078897.db2.gz WTGYLMNPYGDSTM-STQMWFEESA-N 1 3 340.309 2.739 10 0 EFAEHO [NH3+]C[C@@H]1CC[C@@H](NCc2cn(-c3ccc(Cl)cc3Cl)nn2)C1 ZINC000415027626 312079561 /nfs/dbraw/zinc/07/95/61/312079561.db2.gz BJPCJTJUGJPNBP-ZYHUDNBSSA-N 1 3 340.258 2.791 10 0 EFAEHO C[C@H](CCc1ccc(OC(F)F)cc1)[NH2+]C[C@H]1CNCCCO1 ZINC000415038442 312081400 /nfs/dbraw/zinc/08/14/00/312081400.db2.gz LZKPUGASULQKAI-CZUORRHYSA-N 1 3 328.403 2.577 10 0 EFAEHO C[C@H](CCc1ccc(OC(F)F)cc1)NC[C@H]1C[NH2+]CCCO1 ZINC000415038442 312081403 /nfs/dbraw/zinc/08/14/03/312081403.db2.gz LZKPUGASULQKAI-CZUORRHYSA-N 1 3 328.403 2.577 10 0 EFAEHO C[C@@H](CCCCN1C(=O)c2ccccc2C1=O)N[C@H]1CCCC[NH2+]C1 ZINC000415079222 312089090 /nfs/dbraw/zinc/08/90/90/312089090.db2.gz WPKQXKJOLRBOKJ-HOTGVXAUSA-N 1 3 343.471 2.573 10 0 EFAEHO O=C1N[C@H]2CN(CCCC3CCCCC3)CC[C@@H]2N1C1CC[NH2+]CC1 ZINC000415134381 312100595 /nfs/dbraw/zinc/10/05/95/312100595.db2.gz DRCMZWASVWZWCS-OALUTQOASA-N 1 3 348.535 2.567 10 0 EFAEHO CC[NH+](CC)CCOc1ccc(NC(=O)N2CCNC(C)(C)C2)cc1 ZINC000415155951 312104938 /nfs/dbraw/zinc/10/49/38/312104938.db2.gz ANDYOTFFRHETOF-UHFFFAOYSA-N 1 3 348.491 2.623 10 0 EFAEHO CN(CC[C@H]1CCCC[N@@H+]1C)C(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415954505 312184618 /nfs/dbraw/zinc/18/46/18/312184618.db2.gz KJSUXPPPELHMLY-OAHLLOKOSA-N 1 3 348.466 2.810 10 0 EFAEHO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415954505 312184620 /nfs/dbraw/zinc/18/46/20/312184620.db2.gz KJSUXPPPELHMLY-OAHLLOKOSA-N 1 3 348.466 2.810 10 0 EFAEHO CC(C)CN(CCN(C)C)C(=O)Nc1ccc2c(c1F)CC[NH2+]C2 ZINC000415962261 312186084 /nfs/dbraw/zinc/18/60/84/312186084.db2.gz SLXVLBHJGLIAQT-UHFFFAOYSA-N 1 3 336.455 2.523 10 0 EFAEHO C[C@H](CCC[NH3+])NC(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1 ZINC000417728049 312262482 /nfs/dbraw/zinc/26/24/82/312262482.db2.gz AHMDJWOEJVTQRF-IJEWVQPXSA-N 1 3 338.521 2.558 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)NC[C@H]2N(C)CCCC2(C)C)cc1 ZINC000418096446 312324718 /nfs/dbraw/zinc/32/47/18/312324718.db2.gz IQOQJTARANFBBS-WMLDXEAASA-N 1 3 332.492 2.626 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)NC[C@@H]2N(C)CCCC2(C)C)cc1 ZINC000418096450 312324871 /nfs/dbraw/zinc/32/48/71/312324871.db2.gz IQOQJTARANFBBS-YOEHRIQHSA-N 1 3 332.492 2.626 10 0 EFAEHO CN(CC(C)(C)C[NH3+])C(=O)NCCN1CCC2(CCCCC2)CC1 ZINC000418159644 312336882 /nfs/dbraw/zinc/33/68/82/312336882.db2.gz CRBXZSUTDUXFGB-UHFFFAOYSA-N 1 3 338.540 2.659 10 0 EFAEHO CN(C)CCc1ccccc1NC(=O)NC1CC([NH+]2CCCCC2)C1 ZINC000432589178 312572270 /nfs/dbraw/zinc/57/22/70/312572270.db2.gz UAPMDUHXFFJWBQ-UHFFFAOYSA-N 1 3 344.503 2.929 10 0 EFAEHO CC[C@@H](N[C@@H](CC(C)C)C(=O)NCC[NH+](C)C)c1ccsc1 ZINC000453177322 312875166 /nfs/dbraw/zinc/87/51/66/312875166.db2.gz GMAOFJIOVLDOKL-CVEARBPZSA-N 1 3 325.522 2.881 10 0 EFAEHO C[N@@H+]1CCC[C@@H](CCNC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000458163934 313081777 /nfs/dbraw/zinc/08/17/77/313081777.db2.gz JUMKTWJEWDJEFL-KRWDZBQOSA-N 1 3 329.488 2.744 10 0 EFAEHO C[N@H+]1CCC[C@@H](CCNC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000458163934 313081779 /nfs/dbraw/zinc/08/17/79/313081779.db2.gz JUMKTWJEWDJEFL-KRWDZBQOSA-N 1 3 329.488 2.744 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2CC[C@@H](OC)C2)CC1 ZINC000471814656 313162590 /nfs/dbraw/zinc/16/25/90/313162590.db2.gz DWKPTYPVJUIXPA-RTBURBONSA-N 1 3 331.504 2.876 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000479164091 313261977 /nfs/dbraw/zinc/26/19/77/313261977.db2.gz SQYLPPBGCWATNK-UXHICEINSA-N 1 3 345.531 2.991 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000479164091 313261980 /nfs/dbraw/zinc/26/19/80/313261980.db2.gz SQYLPPBGCWATNK-UXHICEINSA-N 1 3 345.531 2.991 10 0 EFAEHO CC1(C)NC(=O)CC[C@@H]1[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000494878997 314644343 /nfs/dbraw/zinc/64/43/43/314644343.db2.gz OBNARJNWXNAHNR-INIZCTEOSA-N 1 3 335.517 2.607 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)c2ccccc2CC[NH3+])cc1 ZINC000518993822 315838861 /nfs/dbraw/zinc/83/88/61/315838861.db2.gz QLXKPFWIRXLUHO-LJQANCHMSA-N 1 3 325.456 2.741 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)Nc1ccc2c(c1)CNCCO2 ZINC000521214797 316007240 /nfs/dbraw/zinc/00/72/40/316007240.db2.gz SCWGEFVJTWADHI-GASCZTMLSA-N 1 3 346.475 2.553 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)Nc1ccc2c(c1)CNCCO2 ZINC000521214797 316007243 /nfs/dbraw/zinc/00/72/43/316007243.db2.gz SCWGEFVJTWADHI-GASCZTMLSA-N 1 3 346.475 2.553 10 0 EFAEHO Cc1cc(C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)ccn1 ZINC000527722210 316444040 /nfs/dbraw/zinc/44/40/40/316444040.db2.gz RNFGNQVNFUHUHV-UHFFFAOYSA-N 1 3 325.456 2.507 10 0 EFAEHO C[NH+](C)CCc1ccc(C(=O)NC[C@@H]2CCN2C2CCCC2)cc1 ZINC000530028663 317030217 /nfs/dbraw/zinc/03/02/17/317030217.db2.gz QHTMNWBGGHAVLI-IBGZPJMESA-N 1 3 329.488 2.537 10 0 EFAEHO Clc1ccc2c(c1)C[C@@H]1[C@H](N[C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)[C@H]21 ZINC000530208677 317080287 /nfs/dbraw/zinc/08/02/87/317080287.db2.gz GPQKBYCSUYKNCH-FYFSBDKLSA-N 1 3 332.875 2.725 10 0 EFAEHO CCOc1ccc(CN2CCC(CO[C@H]3CC[NH2+]C3)CC2)cc1OC ZINC000530249264 317091300 /nfs/dbraw/zinc/09/13/00/317091300.db2.gz UFUGFRXRGSBVKU-SFHVURJKSA-N 1 3 348.487 2.684 10 0 EFAEHO C[C@H](NC(=O)CCN(C)c1cc[nH+]cc1)[C@H](c1ccccc1)N(C)C ZINC000548104538 318073614 /nfs/dbraw/zinc/07/36/14/318073614.db2.gz UXOJOHRQCVHZJW-OXJNMPFZSA-N 1 3 340.471 2.716 10 0 EFAEHO CN(C)[C@@H](CNC(=O)CC[C@@H]1CCCC[N@@H+]1C)Cc1ccccc1 ZINC000554224642 318304358 /nfs/dbraw/zinc/30/43/58/318304358.db2.gz PYUUTCFSYFEOCH-RBUKOAKNSA-N 1 3 331.504 2.540 10 0 EFAEHO CN(C)[C@@H](CNC(=O)CC[C@@H]1CCCC[N@H+]1C)Cc1ccccc1 ZINC000554224642 318304360 /nfs/dbraw/zinc/30/43/60/318304360.db2.gz PYUUTCFSYFEOCH-RBUKOAKNSA-N 1 3 331.504 2.540 10 0 EFAEHO CCCC[N@H+](C)C[C@@H](C)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000555154052 318347244 /nfs/dbraw/zinc/34/72/44/318347244.db2.gz NELRGZWITHODIA-QRQLOZEOSA-N 1 3 346.519 2.851 10 0 EFAEHO CCCC[N@@H+](C)C[C@@H](C)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000555154052 318347246 /nfs/dbraw/zinc/34/72/46/318347246.db2.gz NELRGZWITHODIA-QRQLOZEOSA-N 1 3 346.519 2.851 10 0 EFAEHO Cc1cccc(C(=O)NCCN[C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000564824533 318896080 /nfs/dbraw/zinc/89/60/80/318896080.db2.gz HBPDZIPDIOTHBG-IPMKNSEASA-N 1 3 329.488 2.625 10 0 EFAEHO C[C@@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)C[NH+]1CCCCC1 ZINC000565998503 319021712 /nfs/dbraw/zinc/02/17/12/319021712.db2.gz QUDKVHGMOIGIOX-AWEZNQCLSA-N 1 3 348.466 2.715 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NCCc2ncc(C)cc2C)[C@H](C)C1 ZINC000566971330 319127177 /nfs/dbraw/zinc/12/71/77/319127177.db2.gz JAKHQAUJNBFCCJ-QUCCMNQESA-N 1 3 333.520 2.968 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NCCc2ncc(C)cc2C)[C@H](C)C1 ZINC000566971330 319127180 /nfs/dbraw/zinc/12/71/80/319127180.db2.gz JAKHQAUJNBFCCJ-QUCCMNQESA-N 1 3 333.520 2.968 10 0 EFAEHO C[C@@H]1CN(C(=O)NCc2ccccc2CN2CCCCC2)CC[C@H]1[NH3+] ZINC000567454210 319172677 /nfs/dbraw/zinc/17/26/77/319172677.db2.gz NRJBRMYBFINDSE-VQIMIIECSA-N 1 3 344.503 2.551 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)CCN(C)c1cc[nH+]cc1 ZINC000567701229 319199923 /nfs/dbraw/zinc/19/99/23/319199923.db2.gz OOZZZLDCJHXZJM-UHFFFAOYSA-N 1 3 346.500 2.560 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CN(C)C(=O)CN3CC[C@H](C)C3)C2)s1 ZINC000567750833 319207230 /nfs/dbraw/zinc/20/72/30/319207230.db2.gz JOYQAHYCOOCYJT-DOTOQJQBSA-N 1 3 349.544 2.679 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CN(C)C(=O)CN3CC[C@H](C)C3)C2)s1 ZINC000567750833 319207233 /nfs/dbraw/zinc/20/72/33/319207233.db2.gz JOYQAHYCOOCYJT-DOTOQJQBSA-N 1 3 349.544 2.679 10 0 EFAEHO O[C@H](CN[C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)C1CCCCC1 ZINC000568617068 319301184 /nfs/dbraw/zinc/30/11/84/319301184.db2.gz AJUZQHQBGPACRS-GGPKGHCWSA-N 1 3 330.472 2.773 10 0 EFAEHO Cc1noc(C2CCC([NH2+][C@@H](C)c3ccc(CN)nc3C)CC2)n1 ZINC000568856500 319324675 /nfs/dbraw/zinc/32/46/75/319324675.db2.gz LMZGFDQTVPOROM-QGLTVNCISA-N 1 3 329.448 2.917 10 0 EFAEHO C[C@H](N[C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cc[nH]c(=O)c1 ZINC000569229388 319360662 /nfs/dbraw/zinc/36/06/62/319360662.db2.gz BVQLFDBPGJNIRG-AXHNFQJDSA-N 1 3 325.412 2.694 10 0 EFAEHO C[C@H](N[C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cc[nH]c(=O)c1 ZINC000569229400 319360747 /nfs/dbraw/zinc/36/07/47/319360747.db2.gz BVQLFDBPGJNIRG-IYJAJMOOSA-N 1 3 325.412 2.694 10 0 EFAEHO [NH3+]C[C@H]1CCCC[C@H]1NCc1ccc(Cn2ccccc2=O)cc1 ZINC000571275855 319558009 /nfs/dbraw/zinc/55/80/09/319558009.db2.gz USNBNXOKRFZXOE-RTBURBONSA-N 1 3 325.456 2.504 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3CC[C@H](C(C)C)C3)CC2)CC1 ZINC000577122981 320079529 /nfs/dbraw/zinc/07/95/29/320079529.db2.gz YPXGTNJOALVOPK-SFHVURJKSA-N 1 3 335.536 2.687 10 0 EFAEHO CCNC(=O)[C@@H](N[C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000577952174 320159545 /nfs/dbraw/zinc/15/95/45/320159545.db2.gz WEDYUJQREFBEPC-OALUTQOASA-N 1 3 343.515 2.934 10 0 EFAEHO CCNC(=O)[C@@H](N[C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000577952174 320159546 /nfs/dbraw/zinc/15/95/46/320159546.db2.gz WEDYUJQREFBEPC-OALUTQOASA-N 1 3 343.515 2.934 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3CCCCC[C@@H]3C)CC2)CC1 ZINC000578246496 320188999 /nfs/dbraw/zinc/18/89/99/320188999.db2.gz SXAPSYVYOJTXPT-KRWDZBQOSA-N 1 3 335.536 2.974 10 0 EFAEHO CN(CC1CCN(C)CC1)C(=O)c1ccccc1CC1CC[NH2+]CC1 ZINC000578537010 320215521 /nfs/dbraw/zinc/21/55/21/320215521.db2.gz TZTCKKDFWONYRG-UHFFFAOYSA-N 1 3 343.515 2.643 10 0 EFAEHO C[C@@H](CCNC(=O)N1CCc2ccccc2[C@H]1CN)[NH+]1CCCCC1 ZINC000580713040 324219658 /nfs/dbraw/zinc/21/96/58/324219658.db2.gz PDRVZOCVDISCCD-QFBILLFUSA-N 1 3 344.503 2.519 10 0 EFAEHO NC[C@@H]1c2ccccc2CCN1C(=O)NCCCCC[NH+]1CCCC1 ZINC000580712857 324219666 /nfs/dbraw/zinc/21/96/66/324219666.db2.gz KKZCQWRBJHMMKX-LJQANCHMSA-N 1 3 344.503 2.520 10 0 EFAEHO CN(C(=O)NCC1([NH3+])CCCCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000580764090 324229864 /nfs/dbraw/zinc/22/98/64/324229864.db2.gz JFFJATQOMISDCQ-GOSISDBHSA-N 1 3 344.503 2.564 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)N[C@@H](C)CN2CCC(C)CC2)cc1 ZINC000582856967 324687185 /nfs/dbraw/zinc/68/71/85/324687185.db2.gz VSEPAPKEACDRNP-JKSUJKDBSA-N 1 3 332.492 2.626 10 0 EFAEHO NC(=O)C1CCN(Cc2ccc(C[NH2+][C@H]3CCCC34CC4)cc2)CC1 ZINC000583824228 324878751 /nfs/dbraw/zinc/87/87/51/324878751.db2.gz WZMWGWFCPGKURA-IBGZPJMESA-N 1 3 341.499 2.806 10 0 EFAEHO CN(C)Cc1ccc(CNC(=O)NC2CCC(C[NH+](C)C)CC2)cc1 ZINC000137531092 473208763 /nfs/dbraw/zinc/20/87/63/473208763.db2.gz QIPGIYPDHFRIKI-UHFFFAOYSA-N 1 3 346.519 2.668 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@H]1CCC[N@H+](CC[C@@H]2CCCN2C)C1 ZINC000124489790 473251663 /nfs/dbraw/zinc/25/16/63/473251663.db2.gz BERXTIBOAILPHK-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@H]1CCC[N@@H+](CC[C@@H]2CCCN2C)C1 ZINC000124489790 473251666 /nfs/dbraw/zinc/25/16/66/473251666.db2.gz BERXTIBOAILPHK-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(CC[C@@H]2CCC[N@@H+]2C)C1 ZINC000124489790 473251670 /nfs/dbraw/zinc/25/16/70/473251670.db2.gz BERXTIBOAILPHK-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(CC[C@@H]2CCC[N@H+]2C)C1 ZINC000124489790 473251675 /nfs/dbraw/zinc/25/16/75/473251675.db2.gz BERXTIBOAILPHK-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@@H]1CCC[N@H+](CC[C@@H]2CCCN2C)C1 ZINC000124489610 473252144 /nfs/dbraw/zinc/25/21/44/473252144.db2.gz BERXTIBOAILPHK-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@@H]1CCC[N@@H+](CC[C@@H]2CCCN2C)C1 ZINC000124489610 473252147 /nfs/dbraw/zinc/25/21/47/473252147.db2.gz BERXTIBOAILPHK-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(CC[C@@H]2CCC[N@@H+]2C)C1 ZINC000124489610 473252151 /nfs/dbraw/zinc/25/21/51/473252151.db2.gz BERXTIBOAILPHK-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(CC[C@@H]2CCC[N@H+]2C)C1 ZINC000124489610 473252156 /nfs/dbraw/zinc/25/21/56/473252156.db2.gz BERXTIBOAILPHK-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CCN1C ZINC000124636339 473277603 /nfs/dbraw/zinc/27/76/03/473277603.db2.gz MBGBYOKQQJHKLJ-RLLQIKCJSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CCN1C ZINC000124636339 473277607 /nfs/dbraw/zinc/27/76/07/473277607.db2.gz MBGBYOKQQJHKLJ-RLLQIKCJSA-N 1 3 343.515 2.840 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)[C@@H]3C[C@H]3C3CCCCC3)CC2)CC1 ZINC000162474622 473344811 /nfs/dbraw/zinc/34/48/11/473344811.db2.gz LPGWJOJJFCIFTF-VQTJNVASSA-N 1 3 347.547 2.878 10 0 EFAEHO C[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000113232582 473373266 /nfs/dbraw/zinc/37/32/66/473373266.db2.gz LWMFFJPHIBUPSP-VQIMIIECSA-N 1 3 327.472 2.591 10 0 EFAEHO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000113232582 473373272 /nfs/dbraw/zinc/37/32/72/473373272.db2.gz LWMFFJPHIBUPSP-VQIMIIECSA-N 1 3 327.472 2.591 10 0 EFAEHO C[C@H]([NH2+]CCCCN1C[C@H](C)O[C@@H](C)C1)c1ccc2c(c1)OCCO2 ZINC000162857768 473391729 /nfs/dbraw/zinc/39/17/29/473391729.db2.gz QSRZBBOHOQSPON-ULQDDVLXSA-N 1 3 348.487 2.998 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC000625361034 479885365 /nfs/dbraw/zinc/88/53/65/479885365.db2.gz DCRPEMJJVBOPLE-IZBJGVDFSA-N 1 3 343.515 2.711 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000625361034 479885369 /nfs/dbraw/zinc/88/53/69/479885369.db2.gz DCRPEMJJVBOPLE-IZBJGVDFSA-N 1 3 343.515 2.711 10 0 EFAEHO Cc1cc(CNCCc2ccc(OCC[NH+]3CCCC3)cc2)on1 ZINC000631107186 479897647 /nfs/dbraw/zinc/89/76/47/479897647.db2.gz IKAHRCGZPWQLML-UHFFFAOYSA-N 1 3 329.444 2.790 10 0 EFAEHO Cc1cc(C)c(CSC2=[NH+]CCN2)c(C)c1CSC1=NCCN1 ZINC000000144930 471328446 /nfs/dbraw/zinc/32/84/46/471328446.db2.gz NKKNIYNAZMIWJW-UHFFFAOYSA-N 1 3 348.541 2.997 10 0 EFAEHO CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@H]1CCCN(CC)C1 ZINC000067408081 472029816 /nfs/dbraw/zinc/02/98/16/472029816.db2.gz QDFLMQZVGSRWID-IBGZPJMESA-N 1 3 346.519 2.764 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC(C)(C3CC3)C3CC3)CC2)CC1 ZINC000620025063 479963894 /nfs/dbraw/zinc/96/38/94/479963894.db2.gz GMHQOHXQPBKRKN-UHFFFAOYSA-N 1 3 347.547 2.878 10 0 EFAEHO C[C@@H]1CN(c2ccccc2C[NH2+]C[C@@H]2CCN(C3CC3)C2)C[C@@H](C)O1 ZINC000088679997 472380079 /nfs/dbraw/zinc/38/00/79/472380079.db2.gz WAZKSGNLJWEUBU-KURKYZTESA-N 1 3 343.515 2.874 10 0 EFAEHO C[C@H]1CC(CC[NH+]2CCC(C(=O)NCCN(C)C)CC2)C[C@H](C)C1 ZINC000089123317 472388261 /nfs/dbraw/zinc/38/82/61/472388261.db2.gz KTSPIWQFTVWFBF-IAGOWNOFSA-N 1 3 337.552 2.839 10 0 EFAEHO COc1cc(C[NH2+]CCCC[NH+](C)C)cc(Br)c1[O-] ZINC000045663621 472442071 /nfs/dbraw/zinc/44/20/71/472442071.db2.gz UPTGOXUQJHPEAC-UHFFFAOYSA-N 1 3 331.254 2.595 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)Nc2ccc(C)cc2OCC[NH+](C)C)C1 ZINC000154591902 472450550 /nfs/dbraw/zinc/45/05/50/472450550.db2.gz UEJIQFJOEQBSIW-MRXNPFEDSA-N 1 3 348.491 2.541 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000057798359 472476927 /nfs/dbraw/zinc/47/69/27/472476927.db2.gz TVJNCYPZPBAEJX-LJQANCHMSA-N 1 3 344.503 2.566 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000046280353 472539509 /nfs/dbraw/zinc/53/95/09/472539509.db2.gz REYTUNBKOOPSLJ-GOSISDBHSA-N 1 3 346.519 2.634 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)N[C@H](C)CN2CCCCC2)CC1 ZINC000072907175 472739572 /nfs/dbraw/zinc/73/95/72/472739572.db2.gz ZFQVIBVVOUNDMS-QGZVFWFLSA-N 1 3 344.503 2.597 10 0 EFAEHO O=C(CCN1CCC(C[NH+]2CCCC2)CC1)N1CCc2ccccc21 ZINC000047972987 472790054 /nfs/dbraw/zinc/79/00/54/472790054.db2.gz HKWUWSQRZPDKLP-UHFFFAOYSA-N 1 3 341.499 2.774 10 0 EFAEHO CC(C)OCC[N@H+](C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000105862832 472792545 /nfs/dbraw/zinc/79/25/45/472792545.db2.gz JODBUFOWFZWAAV-HXUWFJFHSA-N 1 3 334.504 2.789 10 0 EFAEHO CC(C)OCC[N@@H+](C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000105862832 472792549 /nfs/dbraw/zinc/79/25/49/472792549.db2.gz JODBUFOWFZWAAV-HXUWFJFHSA-N 1 3 334.504 2.789 10 0 EFAEHO CN(C)[C@H](CNC(=O)C[NH+]1C[C@H]2CCCC[C@@H]2C1)c1ccccc1 ZINC000158835935 472971321 /nfs/dbraw/zinc/97/13/21/472971321.db2.gz VKDQBBUZKAULKH-GUDVDZBRSA-N 1 3 329.488 2.528 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCc2ccccc2C[N@H+](C)C(C)C)C1 ZINC000052523036 473118414 /nfs/dbraw/zinc/11/84/14/473118414.db2.gz LWQZZYGAYWKROF-IBGZPJMESA-N 1 3 346.519 2.810 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCc2ccccc2C[N@@H+](C)C(C)C)C1 ZINC000052523036 473118418 /nfs/dbraw/zinc/11/84/18/473118418.db2.gz LWQZZYGAYWKROF-IBGZPJMESA-N 1 3 346.519 2.810 10 0 EFAEHO CN(C)C[C@H](NC(=O)c1ccc(C[NH+](C)C)cc1)c1ccccc1 ZINC000123459130 473144033 /nfs/dbraw/zinc/14/40/33/473144033.db2.gz BIAZNAAQBRQUFS-IBGZPJMESA-N 1 3 325.456 2.781 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@@H]([C@@H](C)O)C2)CC1 ZINC000136846121 473179010 /nfs/dbraw/zinc/17/90/10/473179010.db2.gz AHWCJPASTAAWIQ-RTBURBONSA-N 1 3 345.531 2.811 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@@H]([C@@H](C)O)C2)CC1 ZINC000136846121 473179012 /nfs/dbraw/zinc/17/90/12/473179012.db2.gz AHWCJPASTAAWIQ-RTBURBONSA-N 1 3 345.531 2.811 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NCCN2CCCC[C@H]2CC)CC1 ZINC000113609038 473409611 /nfs/dbraw/zinc/40/96/11/473409611.db2.gz SUQCINUYXOPODW-GOSISDBHSA-N 1 3 338.540 2.672 10 0 EFAEHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2ccc(OCc3nccn3C)cc2)C1 ZINC000163242418 473427072 /nfs/dbraw/zinc/42/70/72/473427072.db2.gz LFWNDVSKEYQUPP-IRXDYDNUSA-N 1 3 342.487 2.992 10 0 EFAEHO Cc1nccn1-c1ccc([C@@H](C)[NH2+]C[C@H](O)CN2CCCCC2)cc1 ZINC000151296634 473438596 /nfs/dbraw/zinc/43/85/96/473438596.db2.gz GJWALEDBRXHUBA-UZLBHIALSA-N 1 3 342.487 2.678 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCc2ccccn2)CC1 ZINC000151303696 473439766 /nfs/dbraw/zinc/43/97/66/473439766.db2.gz TZYQCQHLWCMRQY-UHFFFAOYSA-N 1 3 338.499 2.946 10 0 EFAEHO Cc1ccc2[nH+]ccc(N3CCCN(Cc4cnn(C)c4)CC3)c2c1 ZINC000185649216 473476900 /nfs/dbraw/zinc/47/69/00/473476900.db2.gz RZNNOQIACCSMDN-UHFFFAOYSA-N 1 3 335.455 2.989 10 0 EFAEHO CN(C)CCN1CCC([NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000166117702 473521998 /nfs/dbraw/zinc/52/19/98/473521998.db2.gz FQYOCBHPNSKZTE-NQIIRXRSSA-N 1 3 345.531 2.770 10 0 EFAEHO Cc1nn(C)c(C)c1[C@H]1CCC[N@H+]1CCCN1CCN(C(C)C)CC1 ZINC000191487204 473545110 /nfs/dbraw/zinc/54/51/10/473545110.db2.gz NWLXFOODXPPXRK-LJQANCHMSA-N 1 3 347.551 2.590 10 0 EFAEHO Cc1nn(C)c(C)c1[C@H]1CCC[N@@H+]1CCCN1CCN(C(C)C)CC1 ZINC000191487204 473545115 /nfs/dbraw/zinc/54/51/15/473545115.db2.gz NWLXFOODXPPXRK-LJQANCHMSA-N 1 3 347.551 2.590 10 0 EFAEHO C[C@H](NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)C(C)(C)C[NH+](C)C ZINC000245633361 473730131 /nfs/dbraw/zinc/73/01/31/473730131.db2.gz ITJPEKASUGVVHM-JQHSSLGASA-N 1 3 346.519 2.707 10 0 EFAEHO CC[NH+](CC)[C@@H]1CCN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)C1 ZINC000245653386 473731535 /nfs/dbraw/zinc/73/15/35/473731535.db2.gz NOAGADXWKGCSQE-QRVBRYPASA-N 1 3 344.503 2.558 10 0 EFAEHO COc1cccc2c1CC[N@H+](CCCN1CCN(C(C)C)CC1)CC2 ZINC000192850360 473737550 /nfs/dbraw/zinc/73/75/50/473737550.db2.gz LBLQNIXTGOLMKF-UHFFFAOYSA-N 1 3 345.531 2.512 10 0 EFAEHO COc1cccc2c1CC[N@@H+](CCCN1CCN(C(C)C)CC1)CC2 ZINC000192850360 473737557 /nfs/dbraw/zinc/73/75/57/473737557.db2.gz LBLQNIXTGOLMKF-UHFFFAOYSA-N 1 3 345.531 2.512 10 0 EFAEHO CN1CCC(C[NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)(N2CCCCC2)CC1 ZINC000245848392 473749871 /nfs/dbraw/zinc/74/98/71/473749871.db2.gz FXIYPHQLOSHPEJ-IPMKNSEASA-N 1 3 349.563 2.730 10 0 EFAEHO CCSc1ccccc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617504268 480247304 /nfs/dbraw/zinc/24/73/04/480247304.db2.gz NNKRMFHNOLUIPO-HNNXBMFYSA-N 1 3 337.533 2.800 10 0 EFAEHO CCSc1ccccc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617504268 480247309 /nfs/dbraw/zinc/24/73/09/480247309.db2.gz NNKRMFHNOLUIPO-HNNXBMFYSA-N 1 3 337.533 2.800 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000617007551 480059722 /nfs/dbraw/zinc/05/97/22/480059722.db2.gz VPFYFZQWJDEWKE-MOPGFXCFSA-N 1 3 343.515 2.855 10 0 EFAEHO CN1c2ccc(CN3CCC(C[NH+]4CCCC4)CC3)cc2CCC1=O ZINC000186888862 473774647 /nfs/dbraw/zinc/77/46/47/473774647.db2.gz KQUAVOAASYEULG-UHFFFAOYSA-N 1 3 341.499 2.903 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)CCc1ccc(Cl)s1 ZINC000617505006 480248700 /nfs/dbraw/zinc/24/87/00/480248700.db2.gz SXYUCDORHNVDDZ-ZDUSSCGKSA-N 1 3 345.940 2.722 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)CCc1ccc(Cl)s1 ZINC000617505006 480248707 /nfs/dbraw/zinc/24/87/07/480248707.db2.gz SXYUCDORHNVDDZ-ZDUSSCGKSA-N 1 3 345.940 2.722 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](c2ccccc2)N(C)C)[C@H](C)C1 ZINC000246298393 473819621 /nfs/dbraw/zinc/81/96/21/473819621.db2.gz AGTIGYIWTBRGPV-NZSAHSFTSA-N 1 3 346.519 2.661 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NC[C@H](c2ccccc2)N(C)C)[C@H](C)C1 ZINC000246298393 473819625 /nfs/dbraw/zinc/81/96/25/473819625.db2.gz AGTIGYIWTBRGPV-NZSAHSFTSA-N 1 3 346.519 2.661 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)NC[C@H]2CCN2C(C)(C)C)CC1 ZINC000617013510 480062982 /nfs/dbraw/zinc/06/29/82/480062982.db2.gz VRSBMZAQMSMXNP-QGZVFWFLSA-N 1 3 344.503 2.595 10 0 EFAEHO Cc1cccc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1Cl ZINC000617506301 480249748 /nfs/dbraw/zinc/24/97/48/480249748.db2.gz JMJXDUIUTDFJLB-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO Cc1cccc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1Cl ZINC000617506301 480249754 /nfs/dbraw/zinc/24/97/54/480249754.db2.gz JMJXDUIUTDFJLB-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1)CC(C)C ZINC000246577181 473906137 /nfs/dbraw/zinc/90/61/37/473906137.db2.gz ZPULGLVZUMTQGN-KSZLIROESA-N 1 3 340.556 2.867 10 0 EFAEHO C[NH+](C)[C@H](CC(=O)NC[C@H]1CCN1C1CCCC1)c1ccccc1 ZINC000628964719 480075627 /nfs/dbraw/zinc/07/56/27/480075627.db2.gz FRSUZFVGQDEXQH-RTBURBONSA-N 1 3 329.488 2.813 10 0 EFAEHO C[C@H](C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccc(Cl)s1 ZINC000617506033 480250329 /nfs/dbraw/zinc/25/03/29/480250329.db2.gz YMTVBFLKEPKDKV-STQMWFEESA-N 1 3 345.940 2.893 10 0 EFAEHO C[C@@H]([NH2+]CCCCN1CCOCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000274974719 474026377 /nfs/dbraw/zinc/02/63/77/474026377.db2.gz YJIHIYTXWRHDNM-CTNGQTDRSA-N 1 3 345.531 2.599 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000181329771 474026794 /nfs/dbraw/zinc/02/67/94/474026794.db2.gz IMONZYCIMTYXOS-IAGOWNOFSA-N 1 3 334.508 2.536 10 0 EFAEHO CC[N@H+](C)C[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000174511582 474053866 /nfs/dbraw/zinc/05/38/66/474053866.db2.gz DAIQKZIWQDECCG-GOSISDBHSA-N 1 3 329.488 2.696 10 0 EFAEHO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000174511582 474053873 /nfs/dbraw/zinc/05/38/73/474053873.db2.gz DAIQKZIWQDECCG-GOSISDBHSA-N 1 3 329.488 2.696 10 0 EFAEHO CC(C)[N@@H+]1C[C@@H](C)[C@H](NC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000247080974 474060005 /nfs/dbraw/zinc/06/00/05/474060005.db2.gz JFCVLGGPFUKMLK-VQIMIIECSA-N 1 3 329.488 2.741 10 0 EFAEHO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000247080974 474060013 /nfs/dbraw/zinc/06/00/13/474060013.db2.gz JFCVLGGPFUKMLK-VQIMIIECSA-N 1 3 329.488 2.741 10 0 EFAEHO CCO[C@H]1C[C@@H]([NH2+]CC2(N3CCCCC3)CCN(C)CC2)C12CCC2 ZINC000181827618 474066654 /nfs/dbraw/zinc/06/66/54/474066654.db2.gz SYHJNFHVDALQRD-MOPGFXCFSA-N 1 3 349.563 2.874 10 0 EFAEHO Cc1cc(C)c(C[NH+]2CCC(C(=O)NCCN(C)C)CC2)c(C)c1 ZINC000195519334 474087557 /nfs/dbraw/zinc/08/75/57/474087557.db2.gz RQRPXLRCEBRNQT-UHFFFAOYSA-N 1 3 331.504 2.502 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCC(C)(C)[NH2+][C@H](C)c2ccccc2)C1 ZINC000247204079 474087738 /nfs/dbraw/zinc/08/77/38/474087738.db2.gz LTNCNBDHDAXZDY-AEFFLSMTSA-N 1 3 346.519 2.899 10 0 EFAEHO C[N@@H+]1CCC[C@H]2CN(C(=O)c3cccc(CN4CCCC4)c3)CC[C@H]21 ZINC000248014661 474245862 /nfs/dbraw/zinc/24/58/62/474245862.db2.gz LQKJRXYTXRBPOG-VQTJNVASSA-N 1 3 341.499 2.839 10 0 EFAEHO C[N@H+]1CCC[C@H]2CN(C(=O)c3cccc(CN4CCCC4)c3)CC[C@H]21 ZINC000248014661 474245867 /nfs/dbraw/zinc/24/58/67/474245867.db2.gz LQKJRXYTXRBPOG-VQTJNVASSA-N 1 3 341.499 2.839 10 0 EFAEHO CC(C)CN(CC[NH+](C)C)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000248056975 474253825 /nfs/dbraw/zinc/25/38/25/474253825.db2.gz OLZHTZRCWAIXAX-MOPGFXCFSA-N 1 3 346.519 2.661 10 0 EFAEHO C[C@@H]1CN(c2ccccc2C[NH2+]C[C@H]2CCN(C3CC3)C2)C[C@H](C)O1 ZINC000229873027 474257238 /nfs/dbraw/zinc/25/72/38/474257238.db2.gz WAZKSGNLJWEUBU-FGTMMUONSA-N 1 3 343.515 2.874 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)CC[N@@H+]1C ZINC000631452428 480097656 /nfs/dbraw/zinc/09/76/56/480097656.db2.gz SYVPDZXBFHBVDA-YSIASYRMSA-N 1 3 343.515 2.840 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)CC[N@H+]1C ZINC000631452428 480097659 /nfs/dbraw/zinc/09/76/59/480097659.db2.gz SYVPDZXBFHBVDA-YSIASYRMSA-N 1 3 343.515 2.840 10 0 EFAEHO CCN(C)C(=O)[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000248747208 474423617 /nfs/dbraw/zinc/42/36/17/474423617.db2.gz BFJJARNFFBUCGE-KANFNMMFSA-N 1 3 329.488 2.638 10 0 EFAEHO COCCN1CC[C@@H]([NH2+]C[C@@H]2CCCCN(Cc3ccccc3)C2)C1 ZINC000289784336 474426410 /nfs/dbraw/zinc/42/64/10/474426410.db2.gz KUIHOUOREBRPLX-LEWJYISDSA-N 1 3 345.531 2.599 10 0 EFAEHO COCCN1CC[C@@H](NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)C1 ZINC000289784336 474426417 /nfs/dbraw/zinc/42/64/17/474426417.db2.gz KUIHOUOREBRPLX-LEWJYISDSA-N 1 3 345.531 2.599 10 0 EFAEHO COCCN1CC[C@@H](NC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000289784336 474426423 /nfs/dbraw/zinc/42/64/23/474426423.db2.gz KUIHOUOREBRPLX-LEWJYISDSA-N 1 3 345.531 2.599 10 0 EFAEHO Cc1nnc(CCN[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000289830039 474446597 /nfs/dbraw/zinc/44/65/97/474446597.db2.gz PJPLSGLYWOUIJJ-PBHICJAKSA-N 1 3 330.501 2.889 10 0 EFAEHO Cc1nnc(CCN[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000289830039 474446604 /nfs/dbraw/zinc/44/66/04/474446604.db2.gz PJPLSGLYWOUIJJ-PBHICJAKSA-N 1 3 330.501 2.889 10 0 EFAEHO CCC[C@@H]1CN([C@H]2CC[N@H+](Cc3ccccc3)C2)CCN1CCOC ZINC000271356159 474506954 /nfs/dbraw/zinc/50/69/54/474506954.db2.gz MHXFFHLDLKXLAV-RTWAWAEBSA-N 1 3 345.531 2.694 10 0 EFAEHO CCC[C@@H]1CN([C@H]2CC[N@@H+](Cc3ccccc3)C2)CCN1CCOC ZINC000271356159 474506961 /nfs/dbraw/zinc/50/69/61/474506961.db2.gz MHXFFHLDLKXLAV-RTWAWAEBSA-N 1 3 345.531 2.694 10 0 EFAEHO CC[C@@](C)(O)C[N@H+](C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000249122361 474530879 /nfs/dbraw/zinc/53/08/79/474530879.db2.gz QABFQPLOHPIOLT-WOJBJXKFSA-N 1 3 334.504 2.525 10 0 EFAEHO CC[C@@](C)(O)C[N@@H+](C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000249122361 474530888 /nfs/dbraw/zinc/53/08/88/474530888.db2.gz QABFQPLOHPIOLT-WOJBJXKFSA-N 1 3 334.504 2.525 10 0 EFAEHO CN(C[C@@H](O)CC(F)(F)F)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000249290970 474553412 /nfs/dbraw/zinc/55/34/12/474553412.db2.gz MIFFMNHCTZFSPE-HOTGVXAUSA-N 1 3 330.394 2.754 10 0 EFAEHO CN(C[C@@H](O)CC(F)(F)F)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000249290970 474553418 /nfs/dbraw/zinc/55/34/18/474553418.db2.gz MIFFMNHCTZFSPE-HOTGVXAUSA-N 1 3 330.394 2.754 10 0 EFAEHO CCC(CC)[C@@H](CNC(=O)Nc1ccc2c(c1)OCCNC2)[NH+](C)C ZINC000625943066 480114698 /nfs/dbraw/zinc/11/46/98/480114698.db2.gz CZUCJIMRITZEGK-QGZVFWFLSA-N 1 3 348.491 2.657 10 0 EFAEHO CN1CCC(CC(=O)NCc2ccccc2C[NH+]2CCCC2)CC1 ZINC000291519777 474609837 /nfs/dbraw/zinc/60/98/37/474609837.db2.gz YXLDDTZIZKPBRT-UHFFFAOYSA-N 1 3 329.488 2.631 10 0 EFAEHO CN1CCC(CC(=O)Nc2cccc(CC[NH+]3CCCC3)c2)CC1 ZINC000291783159 474685577 /nfs/dbraw/zinc/68/55/77/474685577.db2.gz XQFFYLGFTUXPGS-UHFFFAOYSA-N 1 3 329.488 2.995 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@]2(C)CCOC2)CC1 ZINC000344372693 474696482 /nfs/dbraw/zinc/69/64/82/474696482.db2.gz REZKZGUHHWXSJL-FQEVSTJZSA-N 1 3 331.504 2.735 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)CC1CC[NH+](C)CC1 ZINC000273160625 474750297 /nfs/dbraw/zinc/75/02/97/474750297.db2.gz BXCZWYAEMKQQDZ-GOSISDBHSA-N 1 3 343.515 2.841 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC[C@H]2CCCN(Cc3cccs3)C2)CC1 ZINC000273171436 474756557 /nfs/dbraw/zinc/75/65/57/474756557.db2.gz FAVJCJOHNGPHDL-QGZVFWFLSA-N 1 3 349.544 2.808 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC[C@@H](c2ccccc2)N2CCCC2)CC1 ZINC000273191664 474769005 /nfs/dbraw/zinc/76/90/05/474769005.db2.gz GZLIQRIJMIPVIF-IBGZPJMESA-N 1 3 329.488 2.672 10 0 EFAEHO COCCN1CC[C@H](Nc2ccc(OCC[N@@H+]3CC[C@H](C)C3)cc2)C1 ZINC000273248431 474800466 /nfs/dbraw/zinc/80/04/66/474800466.db2.gz ZZLUSUQZYDFDAA-HKUYNNGSSA-N 1 3 347.503 2.540 10 0 EFAEHO COCCN1CC[C@H](Nc2ccc(OCC[N@H+]3CC[C@H](C)C3)cc2)C1 ZINC000273248431 474800475 /nfs/dbraw/zinc/80/04/75/474800475.db2.gz ZZLUSUQZYDFDAA-HKUYNNGSSA-N 1 3 347.503 2.540 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)NC(C)(C)CN(C)Cc1ccccc1 ZINC000339006312 474825637 /nfs/dbraw/zinc/82/56/37/474825637.db2.gz CVSCIBBAFDMLBS-QGZVFWFLSA-N 1 3 348.535 2.927 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CCN1C ZINC000340981488 474843124 /nfs/dbraw/zinc/84/31/24/474843124.db2.gz FMBZOAPVHOVVPZ-VQIMIIECSA-N 1 3 344.503 2.564 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@@H](C)[C@@H]2Oc3ccccc3[C@H]2C)CC1 ZINC000337325369 474899852 /nfs/dbraw/zinc/89/98/52/474899852.db2.gz VDVKYPBWLSDXTM-LVCYWYKZSA-N 1 3 345.531 2.945 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@]2(CO)C[C@@H](C)CC(C)(C)C2)CC1 ZINC000337329246 474901391 /nfs/dbraw/zinc/90/13/91/474901391.db2.gz ZKYRPYUVKOKUFG-AZUAARDMSA-N 1 3 339.568 2.569 10 0 EFAEHO CN(C(=O)C1CC[NH+](C2CC2)CC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000278952951 474937987 /nfs/dbraw/zinc/93/79/87/474937987.db2.gz HJVGBQHCKDSICW-HXUWFJFHSA-N 1 3 341.499 2.594 10 0 EFAEHO O=C(NC1CCN(Cc2ccccc2)CC1)[C@@H]1C[C@@H]2CCCC[C@H]2[NH2+]1 ZINC000261566610 474984905 /nfs/dbraw/zinc/98/49/05/474984905.db2.gz ZFUAZXVBMFIOJS-SXLOBPIMSA-N 1 3 341.499 2.688 10 0 EFAEHO C[C@H](C(=O)Nc1ccc2c(c1F)CC[NH2+]C2)[C@H](N)c1ccccc1 ZINC000261746549 475046890 /nfs/dbraw/zinc/04/68/90/475046890.db2.gz ORVPBWGMPLZIRH-SGTLLEGYSA-N 1 3 327.403 2.746 10 0 EFAEHO COc1cc2c(cc1F)CC[C@@H]2[NH2+]C1CCN(C[C@H]2CCOC2)CC1 ZINC000281145911 475089128 /nfs/dbraw/zinc/08/91/28/475089128.db2.gz APXXKPLHGLGMSM-KUHUBIRLSA-N 1 3 348.462 2.912 10 0 EFAEHO COc1cc2c(cc1F)CC[C@H]2[NH2+]C1CCN(C[C@@H]2CCOC2)CC1 ZINC000281145898 475089366 /nfs/dbraw/zinc/08/93/66/475089366.db2.gz APXXKPLHGLGMSM-IFXJQAMLSA-N 1 3 348.462 2.912 10 0 EFAEHO CC(C)COc1ccccc1CN[C@@H]1CCC[C@@H]1[C@H]1COCC[NH2+]1 ZINC000261888044 475101623 /nfs/dbraw/zinc/10/16/23/475101623.db2.gz GDGCLBWJVYPBCH-IPMKNSEASA-N 1 3 332.488 2.968 10 0 EFAEHO C[C@H](CCc1ccc(OC(F)F)cc1)[NH2+]CC1(O)CCN(C)CC1 ZINC000268978162 475106686 /nfs/dbraw/zinc/10/66/86/475106686.db2.gz JXUGPZPMNGAPPP-CQSZACIVSA-N 1 3 342.430 2.655 10 0 EFAEHO c1ccc(OCC2CC2)c(CN[C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)c1 ZINC000261920896 475114965 /nfs/dbraw/zinc/11/49/65/475114965.db2.gz KJKNGEWTWHVMOB-IPMKNSEASA-N 1 3 330.472 2.722 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@@H]2CCc3cc(F)c(OC)cc32)CC1 ZINC000281241332 475131993 /nfs/dbraw/zinc/13/19/93/475131993.db2.gz NEZWJFPNWQSROY-LJQANCHMSA-N 1 3 349.494 2.829 10 0 EFAEHO C[C@@H](c1ccccc1)N1CCC(NC(=O)[C@H]2CC[NH2+][C@@H](C)C2)CC1 ZINC000262300228 475215533 /nfs/dbraw/zinc/21/55/33/475215533.db2.gz AFDXMBWWPDYJSI-BQFCYCMXSA-N 1 3 329.488 2.716 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)CC[N@@H+]1C ZINC000631562155 480154703 /nfs/dbraw/zinc/15/47/03/480154703.db2.gz NCBHKQVDTKQJEV-YSIASYRMSA-N 1 3 343.515 2.840 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)CC[N@H+]1C ZINC000631562155 480154708 /nfs/dbraw/zinc/15/47/08/480154708.db2.gz NCBHKQVDTKQJEV-YSIASYRMSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@H](CCNC(=O)NCCN1[C@H](C)CCC[C@H]1C)[NH+]1CCCCC1 ZINC000345559040 475265528 /nfs/dbraw/zinc/26/55/28/475265528.db2.gz IQHDGLROVWZAPY-KZNAEPCWSA-N 1 3 338.540 2.813 10 0 EFAEHO Cc1cc(C)cc([C@@H](C)NCC(=O)NC2CC[NH+](C3CC3)CC2)c1 ZINC000341744057 475268151 /nfs/dbraw/zinc/26/81/51/475268151.db2.gz KUUNGWSBRXNFTC-MRXNPFEDSA-N 1 3 329.488 2.697 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](N[C@@H]2CCN(c3ccccc3)C2)[C@H](C)C1 ZINC000361216945 475277271 /nfs/dbraw/zinc/27/72/71/475277271.db2.gz OXSQIMAOJQNNJS-SBHAEUEKSA-N 1 3 345.531 2.992 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](N[C@@H]2CCN(c3ccccc3)C2)[C@H](C)C1 ZINC000361216945 475277280 /nfs/dbraw/zinc/27/72/80/475277280.db2.gz OXSQIMAOJQNNJS-SBHAEUEKSA-N 1 3 345.531 2.992 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]CCN2[C@H](C)CCC[C@H]2C)[C@@H](C)C1 ZINC000361218487 475277567 /nfs/dbraw/zinc/27/75/67/475277567.db2.gz YTHAFKGHJCVHLW-NMLBUPMWSA-N 1 3 339.568 2.976 10 0 EFAEHO COC(=O)C1(C[N@H+](C)CCC2CCN(c3ccncc3)CC2)CC1 ZINC000296395942 475296045 /nfs/dbraw/zinc/29/60/45/475296045.db2.gz VIRXEFGZDVDJGT-UHFFFAOYSA-N 1 3 331.460 2.573 10 0 EFAEHO COC(=O)C1(C[N@@H+](C)CCC2CCN(c3ccncc3)CC2)CC1 ZINC000296395942 475296052 /nfs/dbraw/zinc/29/60/52/475296052.db2.gz VIRXEFGZDVDJGT-UHFFFAOYSA-N 1 3 331.460 2.573 10 0 EFAEHO Cc1cccc([C@@H](C)NCC(=O)NC2CC[NH+](C3CC3)CC2)c1C ZINC000341867839 475369774 /nfs/dbraw/zinc/36/97/74/475369774.db2.gz FQPRHNXMCOXARY-MRXNPFEDSA-N 1 3 329.488 2.697 10 0 EFAEHO C[C@@H](NC1CC[NH+](CCC(=O)N(C)C)CC1)c1ccc2c(c1)CCC2 ZINC000361350250 475376403 /nfs/dbraw/zinc/37/64/03/475376403.db2.gz DEPWYSPYJNKSFL-MRXNPFEDSA-N 1 3 343.515 2.769 10 0 EFAEHO Cc1cnn(CC[N@H+](C)CCC2CCN(c3ccncc3)CC2)c1 ZINC000341911592 475405408 /nfs/dbraw/zinc/40/54/08/475405408.db2.gz UJRWKROOVHQTAU-UHFFFAOYSA-N 1 3 327.476 2.825 10 0 EFAEHO Cc1cnn(CC[N@@H+](C)CCC2CCN(c3ccncc3)CC2)c1 ZINC000341911592 475405413 /nfs/dbraw/zinc/40/54/13/475405413.db2.gz UJRWKROOVHQTAU-UHFFFAOYSA-N 1 3 327.476 2.825 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000345809823 475471428 /nfs/dbraw/zinc/47/14/28/475471428.db2.gz KOZMYQPIWXPZNV-CEXWTWQISA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@@H](CO)c2cccnc2)CC[N@@H+]1Cc1ccccc1 ZINC000348199788 475481013 /nfs/dbraw/zinc/48/10/13/475481013.db2.gz QLCIBXNPVJDEJU-QMMLZNLJSA-N 1 3 339.483 2.800 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@@H](CO)c2cccnc2)CC[N@H+]1Cc1ccccc1 ZINC000348199788 475481022 /nfs/dbraw/zinc/48/10/22/475481022.db2.gz QLCIBXNPVJDEJU-QMMLZNLJSA-N 1 3 339.483 2.800 10 0 EFAEHO CN(C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CC[C@H]2C2CCC2)c1 ZINC000337992936 475488449 /nfs/dbraw/zinc/48/84/49/475488449.db2.gz RJRGOIZHSXMVRE-RBUKOAKNSA-N 1 3 329.488 2.646 10 0 EFAEHO c1cc(N2CCN(CCC[NH2+][C@H]3CC[C@H]3C3CCC3)CC2)ccn1 ZINC000338004974 475500265 /nfs/dbraw/zinc/50/02/65/475500265.db2.gz YZZWFYMGIHHZPB-PMACEKPBSA-N 1 3 328.504 2.762 10 0 EFAEHO CCO[C@H]1COCC[C@H]1NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000354970939 475568518 /nfs/dbraw/zinc/56/85/18/475568518.db2.gz CKLBVDRYRZCQRP-VKQJQLINSA-N 1 3 344.499 2.966 10 0 EFAEHO CCO[C@H]1COCC[C@H]1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000354970939 475568525 /nfs/dbraw/zinc/56/85/25/475568525.db2.gz CKLBVDRYRZCQRP-VKQJQLINSA-N 1 3 344.499 2.966 10 0 EFAEHO CCO[C@@H]1COCC[C@H]1NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000354970929 475568881 /nfs/dbraw/zinc/56/88/81/475568881.db2.gz CKLBVDRYRZCQRP-JAGQDSLRSA-N 1 3 344.499 2.966 10 0 EFAEHO CCO[C@@H]1COCC[C@H]1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000354970929 475568889 /nfs/dbraw/zinc/56/88/89/475568889.db2.gz CKLBVDRYRZCQRP-JAGQDSLRSA-N 1 3 344.499 2.966 10 0 EFAEHO CCO[C@@H]1COCC[C@@H]1NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000354970931 475568995 /nfs/dbraw/zinc/56/89/95/475568995.db2.gz CKLBVDRYRZCQRP-KKURMSBHSA-N 1 3 344.499 2.966 10 0 EFAEHO CCO[C@@H]1COCC[C@@H]1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000354970931 475569003 /nfs/dbraw/zinc/56/90/03/475569003.db2.gz CKLBVDRYRZCQRP-KKURMSBHSA-N 1 3 344.499 2.966 10 0 EFAEHO CC[N@H+](CCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)C(C)C ZINC000354979204 475574979 /nfs/dbraw/zinc/57/49/79/475574979.db2.gz KIYHVPLXSZDJQH-LJQANCHMSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[N@@H+](CCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)C(C)C ZINC000354979204 475574984 /nfs/dbraw/zinc/57/49/84/475574984.db2.gz KIYHVPLXSZDJQH-LJQANCHMSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[C@H](C)[N@H+](C)CCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000355039703 475616363 /nfs/dbraw/zinc/61/63/63/475616363.db2.gz OYPPAXGHHKRHGB-HKUYNNGSSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[C@H](C)[N@@H+](C)CCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000355039703 475616370 /nfs/dbraw/zinc/61/63/70/475616370.db2.gz OYPPAXGHHKRHGB-HKUYNNGSSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[C@@H](C)[N@H+](C)CCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000355039710 475617351 /nfs/dbraw/zinc/61/73/51/475617351.db2.gz OYPPAXGHHKRHGB-MJGOQNOKSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[C@@H](C)[N@@H+](C)CCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000355039710 475617358 /nfs/dbraw/zinc/61/73/58/475617358.db2.gz OYPPAXGHHKRHGB-MJGOQNOKSA-N 1 3 346.519 2.633 10 0 EFAEHO CC1=CCN(CCNC(=O)N[C@@H](C)[C@@H](c2ccccc2)[NH+](C)C)CC1 ZINC000355079834 475650450 /nfs/dbraw/zinc/65/04/50/475650450.db2.gz QNQPUKHXJFOHCR-HKUYNNGSSA-N 1 3 344.503 2.629 10 0 EFAEHO CC[NH+](CC)Cc1ccc(C(=O)N(C)[C@@H]2CN3CCC2CC3)cc1 ZINC000338191355 475662883 /nfs/dbraw/zinc/66/28/83/475662883.db2.gz QNUOYVDKDWNMMI-LJQANCHMSA-N 1 3 329.488 2.695 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)NCC(C)(C)[N@@H+]1CCC[C@H](C)C1 ZINC000338295885 475757710 /nfs/dbraw/zinc/75/77/10/475757710.db2.gz JJYHLYOHNQKCBJ-DLBZAZTESA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)NCC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC000338295885 475757716 /nfs/dbraw/zinc/75/77/16/475757716.db2.gz JJYHLYOHNQKCBJ-DLBZAZTESA-N 1 3 338.540 2.671 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCC[C@@H](C)CO)CC1 ZINC000340103225 475761017 /nfs/dbraw/zinc/76/10/17/475761017.db2.gz FQJWAURZPOXFAY-GOSISDBHSA-N 1 3 333.520 2.717 10 0 EFAEHO C[C@@H]1C[N@H+](CCCNCc2ccccc2-c2ccnn2C)CCCO1 ZINC000353207394 475772003 /nfs/dbraw/zinc/77/20/03/475772003.db2.gz UQWXQINIKHHEFJ-QGZVFWFLSA-N 1 3 342.487 2.678 10 0 EFAEHO C[C@@H]1C[N@@H+](CCCNCc2ccccc2-c2ccnn2C)CCCO1 ZINC000353207394 475772013 /nfs/dbraw/zinc/77/20/13/475772013.db2.gz UQWXQINIKHHEFJ-QGZVFWFLSA-N 1 3 342.487 2.678 10 0 EFAEHO COc1cccc(CC[NH2+][C@@H](C)c2cccc(OCCN(C)C)c2)n1 ZINC000361925255 475871677 /nfs/dbraw/zinc/87/16/77/475871677.db2.gz ICVUOORLJMZOKQ-INIZCTEOSA-N 1 3 343.471 2.924 10 0 EFAEHO Cn1cncc1CCN1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000297892595 475917020 /nfs/dbraw/zinc/91/70/20/475917020.db2.gz RAJNRKYUSDBROX-CTNGQTDRSA-N 1 3 338.499 2.949 10 0 EFAEHO Cn1cncc1CCN1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000297892595 475917024 /nfs/dbraw/zinc/91/70/24/475917024.db2.gz RAJNRKYUSDBROX-CTNGQTDRSA-N 1 3 338.499 2.949 10 0 EFAEHO Cn1cncc1CC[N@@H+]1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1 ZINC000297892595 475917034 /nfs/dbraw/zinc/91/70/34/475917034.db2.gz RAJNRKYUSDBROX-CTNGQTDRSA-N 1 3 338.499 2.949 10 0 EFAEHO Cn1cncc1CC[N@H+]1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1 ZINC000297892595 475917042 /nfs/dbraw/zinc/91/70/42/475917042.db2.gz RAJNRKYUSDBROX-CTNGQTDRSA-N 1 3 338.499 2.949 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cccc(C(=O)NC3CC3)c2)[C@@H]2CCC[C@@H]21 ZINC000353389761 475929501 /nfs/dbraw/zinc/92/95/01/475929501.db2.gz WOYLMZUPYYCWAM-FHWLQOOXSA-N 1 3 327.472 2.541 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2CCN(c3ncccc3Cl)C2)[C@@H]2CCC[C@@H]21 ZINC000353395126 475933672 /nfs/dbraw/zinc/93/36/72/475933672.db2.gz OPVQHPDVIPXESE-OHFALNGGSA-N 1 3 334.895 2.776 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2CCN(c3ncccc3Cl)C2)[C@@H]2CCC[C@@H]21 ZINC000353395126 475933674 /nfs/dbraw/zinc/93/36/74/475933674.db2.gz OPVQHPDVIPXESE-OHFALNGGSA-N 1 3 334.895 2.776 10 0 EFAEHO CN(C(=O)c1ccc(C[NH+]2CCCC2)cc1)[C@H]1CCN(C2CC2)C1 ZINC000338536009 475992108 /nfs/dbraw/zinc/99/21/08/475992108.db2.gz JSRPFVWBQUSOJA-IBGZPJMESA-N 1 3 327.472 2.591 10 0 EFAEHO CCN(CCC[NH+]1CCCC1)C(=O)NCCN1[C@H](C)CCC[C@H]1C ZINC000349777019 475999812 /nfs/dbraw/zinc/99/98/12/475999812.db2.gz USQHPKQDLALWKZ-QZTJIDSGSA-N 1 3 338.540 2.767 10 0 EFAEHO C[C@H](CNC(=O)CC[C@H]1CCCC[N@@H+]1C)N(C)Cc1ccccc1 ZINC000353505857 476028772 /nfs/dbraw/zinc/02/87/72/476028772.db2.gz ZCYSHFUERJWCAS-IEBWSBKVSA-N 1 3 331.504 2.888 10 0 EFAEHO C[C@H](CNC(=O)CC[C@H]1CCCC[N@H+]1C)N(C)Cc1ccccc1 ZINC000353505857 476028776 /nfs/dbraw/zinc/02/87/76/476028776.db2.gz ZCYSHFUERJWCAS-IEBWSBKVSA-N 1 3 331.504 2.888 10 0 EFAEHO CS[C@@H]1CN([C@H]2CCN(Cc3ccccc3)C2)C[C@@H]1[NH+]1CCCC1 ZINC000298295601 476047765 /nfs/dbraw/zinc/04/77/65/476047765.db2.gz HJJQQMNUWJUAJZ-SLFFLAALSA-N 1 3 345.556 2.773 10 0 EFAEHO CCOC[C@H](C)[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340463935 476050377 /nfs/dbraw/zinc/05/03/77/476050377.db2.gz REMCSRVXLMZAMF-AZUAARDMSA-N 1 3 346.515 2.930 10 0 EFAEHO CCOC[C@H](C)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000340463935 476050383 /nfs/dbraw/zinc/05/03/83/476050383.db2.gz REMCSRVXLMZAMF-AZUAARDMSA-N 1 3 346.515 2.930 10 0 EFAEHO CCOC[C@H](C)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000340463935 476050389 /nfs/dbraw/zinc/05/03/89/476050389.db2.gz REMCSRVXLMZAMF-AZUAARDMSA-N 1 3 346.515 2.930 10 0 EFAEHO COCC[C@@H](C)[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340465924 476053038 /nfs/dbraw/zinc/05/30/38/476053038.db2.gz JUZFCTXJAGDXMK-QUCCMNQESA-N 1 3 346.515 2.930 10 0 EFAEHO CC[C@H](COC)[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340468738 476053885 /nfs/dbraw/zinc/05/38/85/476053885.db2.gz SUKRXYWEWPYMKJ-WOJBJXKFSA-N 1 3 346.515 2.930 10 0 EFAEHO c1ccc(CN2C[C@@H](C[NH2+][C@H]3CCCOC3)C3(C2)CCOCC3)cc1 ZINC000340468986 476054566 /nfs/dbraw/zinc/05/45/66/476054566.db2.gz HUDCRSOVTBHZDY-UXHICEINSA-N 1 3 344.499 2.684 10 0 EFAEHO c1ccc(C[N@H+]2C[C@@H](CN[C@H]3CCCOC3)C3(C2)CCOCC3)cc1 ZINC000340468986 476054571 /nfs/dbraw/zinc/05/45/71/476054571.db2.gz HUDCRSOVTBHZDY-UXHICEINSA-N 1 3 344.499 2.684 10 0 EFAEHO c1ccc(C[N@@H+]2C[C@@H](CN[C@H]3CCCOC3)C3(C2)CCOCC3)cc1 ZINC000340468986 476054577 /nfs/dbraw/zinc/05/45/77/476054577.db2.gz HUDCRSOVTBHZDY-UXHICEINSA-N 1 3 344.499 2.684 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2ccc3cc[nH]c3n2)[C@H](C)C1 ZINC000353620141 476129288 /nfs/dbraw/zinc/12/92/88/476129288.db2.gz IFLDOERROKSPOU-QAPCUYQASA-N 1 3 330.476 2.790 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]Cc2ccc3cc[nH]c3n2)[C@@H](C)C1 ZINC000353620140 476130622 /nfs/dbraw/zinc/13/06/22/476130622.db2.gz IFLDOERROKSPOU-MAUKXSAKSA-N 1 3 330.476 2.790 10 0 EFAEHO CN1CC[C@H]([NH2+]CCOc2ccc(C(F)(F)F)cn2)[C@H]2CCC[C@@H]21 ZINC000353647711 476155415 /nfs/dbraw/zinc/15/54/15/476155415.db2.gz SEMIXBAXCWZRQS-ILXRZTDVSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCOc2ccc(C(F)(F)F)cn2)[C@H]2CCC[C@@H]21 ZINC000353647711 476155426 /nfs/dbraw/zinc/15/54/26/476155426.db2.gz SEMIXBAXCWZRQS-ILXRZTDVSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@H+]1CC[C@H](NCCOc2ccc(C(F)(F)F)cn2)[C@H]2CCC[C@@H]21 ZINC000353647711 476155430 /nfs/dbraw/zinc/15/54/30/476155430.db2.gz SEMIXBAXCWZRQS-ILXRZTDVSA-N 1 3 343.393 2.942 10 0 EFAEHO O=C(N[C@@H]1CCN(C2CC2)C1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000359245186 476218322 /nfs/dbraw/zinc/21/83/22/476218322.db2.gz ZDOUCFZSFAFYOG-QZTJIDSGSA-N 1 3 348.535 2.521 10 0 EFAEHO CC[C@H](CNC(=O)CC1CC[NH+](C)CC1)N1CCc2ccccc2C1 ZINC000362492335 476281466 /nfs/dbraw/zinc/28/14/66/476281466.db2.gz LDDOIIILEZCBCI-HXUWFJFHSA-N 1 3 343.515 2.671 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccc3ccccc3n2)CC[C@@H]1N1CCN(C)CC1 ZINC000362704961 476358416 /nfs/dbraw/zinc/35/84/16/476358416.db2.gz WDOYILMGFMABJJ-UTKZUKDTSA-N 1 3 338.499 2.693 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccc3ccccc3n2)CC[C@@H]1N1CCN(C)CC1 ZINC000362704961 476358422 /nfs/dbraw/zinc/35/84/22/476358422.db2.gz WDOYILMGFMABJJ-UTKZUKDTSA-N 1 3 338.499 2.693 10 0 EFAEHO Cc1cccc(CN2CCCC[C@H]2C(=O)N2CCC([NH+](C)C)CC2)c1 ZINC000363514993 476418118 /nfs/dbraw/zinc/41/81/18/476418118.db2.gz AODPGPHVLWXVKP-FQEVSTJZSA-N 1 3 343.515 2.902 10 0 EFAEHO C[NH+](C)[C@@H](CNC(=O)CN1CCC(C)(C2CC2)CC1)c1ccccc1 ZINC000352189242 476536293 /nfs/dbraw/zinc/53/62/93/476536293.db2.gz LTRPLAWFGOHCDE-IBGZPJMESA-N 1 3 343.515 2.918 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000377760034 476565215 /nfs/dbraw/zinc/56/52/15/476565215.db2.gz INCSSORSKDIWSU-APWZRJJASA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000377760034 476565221 /nfs/dbraw/zinc/56/52/21/476565221.db2.gz INCSSORSKDIWSU-APWZRJJASA-N 1 3 341.515 2.827 10 0 EFAEHO COCCC[NH+]1CCC(NCc2ccccc2-c2ccnn2C)CC1 ZINC000352328040 476639296 /nfs/dbraw/zinc/63/92/96/476639296.db2.gz GNKQPPUMCSGQSH-UHFFFAOYSA-N 1 3 342.487 2.678 10 0 EFAEHO CCC[N@H+](CC)C[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000357874063 476664899 /nfs/dbraw/zinc/66/48/99/476664899.db2.gz SDDRJBYOPMVAQD-QXAKKESOSA-N 1 3 346.519 2.851 10 0 EFAEHO CCC[N@@H+](CC)C[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000357874063 476664903 /nfs/dbraw/zinc/66/49/03/476664903.db2.gz SDDRJBYOPMVAQD-QXAKKESOSA-N 1 3 346.519 2.851 10 0 EFAEHO Cc1cc(C[NH2+]C2CC(N3CCCCC3)C2)ccc1-n1cncn1 ZINC000370133534 476676383 /nfs/dbraw/zinc/67/63/83/476676383.db2.gz RPJOSYXGJCTBLK-UHFFFAOYSA-N 1 3 325.460 2.682 10 0 EFAEHO CC(CN1CCC[C@]2(CCOC2)C1)C[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000451900156 476710640 /nfs/dbraw/zinc/71/06/40/476710640.db2.gz LJFHYOWRUDODMD-PMACEKPBSA-N 1 3 336.520 2.628 10 0 EFAEHO CC(CN1CCC[C@]2(CCOC2)C1)C[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000451900156 476710647 /nfs/dbraw/zinc/71/06/47/476710647.db2.gz LJFHYOWRUDODMD-PMACEKPBSA-N 1 3 336.520 2.628 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)C[C@H]2CCC[NH2+]C2)CCN1Cc1ccccc1 ZINC000379672342 476730033 /nfs/dbraw/zinc/73/00/33/476730033.db2.gz NCRVNOLJZYZKHT-QRQLOZEOSA-N 1 3 329.488 2.545 10 0 EFAEHO [NH3+]C[C@@H]1CCC[C@H]1C(=O)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000379664352 476730860 /nfs/dbraw/zinc/73/08/60/476730860.db2.gz ONKKKKLJYVUOQM-IPMKNSEASA-N 1 3 329.488 2.532 10 0 EFAEHO [NH3+]C[C@@H]1CCC[C@@H]1C(=O)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000379656253 476730938 /nfs/dbraw/zinc/73/09/38/476730938.db2.gz ONKKKKLJYVUOQM-OTWHNJEPSA-N 1 3 329.488 2.532 10 0 EFAEHO C[C@H]([NH2+]C1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C1CNC1 ZINC000422713182 476739891 /nfs/dbraw/zinc/73/98/91/476739891.db2.gz OYBGVYZVWNLHAJ-ZDUSSCGKSA-N 1 3 341.421 2.867 10 0 EFAEHO CC(C)OC[C@H](O)C[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000383658767 476751944 /nfs/dbraw/zinc/75/19/44/476751944.db2.gz FVZBLZWIGIEDQA-VQTJNVASSA-N 1 3 334.504 2.664 10 0 EFAEHO CC(C)OC[C@H](O)CNC[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000383658767 476751953 /nfs/dbraw/zinc/75/19/53/476751953.db2.gz FVZBLZWIGIEDQA-VQTJNVASSA-N 1 3 334.504 2.664 10 0 EFAEHO CC(C)OC[C@H](O)CNC[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000383658767 476751959 /nfs/dbraw/zinc/75/19/59/476751959.db2.gz FVZBLZWIGIEDQA-VQTJNVASSA-N 1 3 334.504 2.664 10 0 EFAEHO C[C@@H]([NH3+])[C@H](Cc1ccccc1)NCc1ccc(F)c(CN(C)C)c1 ZINC000422748024 476757464 /nfs/dbraw/zinc/75/74/64/476757464.db2.gz RQLPVXDZYKXGBN-QRWLVFNGSA-N 1 3 329.463 2.935 10 0 EFAEHO C[C@@H](N)[C@H](Cc1ccccc1)[NH2+]Cc1ccc(F)c(CN(C)C)c1 ZINC000422748024 476757469 /nfs/dbraw/zinc/75/74/69/476757469.db2.gz RQLPVXDZYKXGBN-QRWLVFNGSA-N 1 3 329.463 2.935 10 0 EFAEHO CN(C(=O)C1CCC([NH3+])CC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000388489037 476778562 /nfs/dbraw/zinc/77/85/62/476778562.db2.gz LVYPPTFJEQCPMI-CTWPCTMYSA-N 1 3 329.488 2.627 10 0 EFAEHO CN1CCC(CC(=O)NC[C@@]2(C)CCC[N@@H+]2Cc2ccccc2)CC1 ZINC000365978423 476793576 /nfs/dbraw/zinc/79/35/76/476793576.db2.gz AKPHJXQRVMJYFA-OAQYLSRUSA-N 1 3 343.515 2.889 10 0 EFAEHO CN1CCC(CC(=O)NC[C@@]2(C)CCC[N@H+]2Cc2ccccc2)CC1 ZINC000365978423 476793578 /nfs/dbraw/zinc/79/35/78/476793578.db2.gz AKPHJXQRVMJYFA-OAQYLSRUSA-N 1 3 343.515 2.889 10 0 EFAEHO O=C(CCN[C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)NCc1ccccc1 ZINC000422840651 476804673 /nfs/dbraw/zinc/80/46/73/476804673.db2.gz BWRTXRSNADZMRK-IPMKNSEASA-N 1 3 329.488 2.593 10 0 EFAEHO O=C(CCN[C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)NCc1ccccc1 ZINC000422840649 476805338 /nfs/dbraw/zinc/80/53/38/476805338.db2.gz BWRTXRSNADZMRK-GUDVDZBRSA-N 1 3 329.488 2.593 10 0 EFAEHO CC(C)OC[C@@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390849693 476807739 /nfs/dbraw/zinc/80/77/39/476807739.db2.gz CXHGCDOYSDILPZ-NXEWRWPSSA-N 1 3 332.488 2.558 10 0 EFAEHO CC(C)OC[C@@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000390849693 476807744 /nfs/dbraw/zinc/80/77/44/476807744.db2.gz CXHGCDOYSDILPZ-NXEWRWPSSA-N 1 3 332.488 2.558 10 0 EFAEHO COC[C@H]1CCCN(CCC[N@@H+]2CCC[C@H](COC)CC2)CC1 ZINC000452076290 476808546 /nfs/dbraw/zinc/80/85/46/476808546.db2.gz BMFFVQLVAMXGHA-OALUTQOASA-N 1 3 326.525 2.874 10 0 EFAEHO COC[C@H]1CCCN(CCC[N@H+]2CCC[C@H](COC)CC2)CC1 ZINC000452076290 476808550 /nfs/dbraw/zinc/80/85/50/476808550.db2.gz BMFFVQLVAMXGHA-OALUTQOASA-N 1 3 326.525 2.874 10 0 EFAEHO C[C@@H]1CCCCN1CCN[C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422862908 476816942 /nfs/dbraw/zinc/81/69/42/476816942.db2.gz OEAYKFYYSYNVJX-KPFFTGBYSA-N 1 3 329.488 2.706 10 0 EFAEHO CC(C)(CN1CCCC1)[NH2+]C[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000452091060 476817795 /nfs/dbraw/zinc/81/77/95/476817795.db2.gz ASOTXGNDAWJDLA-HXUWFJFHSA-N 1 3 345.531 2.742 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@H](C[NH2+][C@@H]3CCCC[C@@H]3CN)C2)c1 ZINC000422870195 476820095 /nfs/dbraw/zinc/82/00/95/476820095.db2.gz BKQWVWNPVLOXTG-JXXFODFXSA-N 1 3 347.503 2.637 10 0 EFAEHO COc1ccccc1N1CC[C@@H]([NH2+][C@H](C)c2ccc(CN)nc2C)C1 ZINC000422870167 476820440 /nfs/dbraw/zinc/82/04/40/476820440.db2.gz BGMWIYBQZAYZEO-NVXWUHKLSA-N 1 3 340.471 2.787 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@@H](CN[C@@H](C)[C@H]3CCCC[NH2+]3)C2)c1 ZINC000422874626 476822256 /nfs/dbraw/zinc/82/22/56/476822256.db2.gz NXTUMWHODXEUMK-TWOQFEAHSA-N 1 3 347.503 2.650 10 0 EFAEHO Cc1ccc(C)c(OC[C@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC000392131906 476822442 /nfs/dbraw/zinc/82/24/42/476822442.db2.gz ANBTWBIKPXKKKV-XVLXNVKGSA-N 1 3 332.488 2.648 10 0 EFAEHO Cc1ccc(C)c(OC[C@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC000392131906 476822451 /nfs/dbraw/zinc/82/24/51/476822451.db2.gz ANBTWBIKPXKKKV-XVLXNVKGSA-N 1 3 332.488 2.648 10 0 EFAEHO COc1ccc([C@H](N[C@@H]2CN(C3CC3)C[C@@H]2C)[C@@H]2CCC[NH2+]2)cc1 ZINC000422879122 476825332 /nfs/dbraw/zinc/82/53/32/476825332.db2.gz UOLMYDGYGIMZTG-GAZPGATBSA-N 1 3 329.488 2.561 10 0 EFAEHO COCCOc1cccc(CN[C@H](C)c2ccc(C[NH3+])nc2C)c1 ZINC000422897656 476833052 /nfs/dbraw/zinc/83/30/52/476833052.db2.gz JZGOFPYUKOXWIT-CQSZACIVSA-N 1 3 329.444 2.725 10 0 EFAEHO CC(=O)Nc1cccc(OCCN[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000422937105 476853589 /nfs/dbraw/zinc/85/35/89/476853589.db2.gz CFTVSNBERNAYQL-VAMGGRTRSA-N 1 3 345.487 2.924 10 0 EFAEHO CCc1cc(NCC2(O)CCN(Cc3ccccc3)CC2)cc[nH+]1 ZINC000397508032 476855313 /nfs/dbraw/zinc/85/53/13/476855313.db2.gz FTRLRHZCPXWQRF-UHFFFAOYSA-N 1 3 325.456 2.505 10 0 EFAEHO CC1(C)C[C@@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCO1 ZINC000397498739 476856746 /nfs/dbraw/zinc/85/67/46/476856746.db2.gz DWDBDOVCBPSOBB-SFHVURJKSA-N 1 3 332.488 2.561 10 0 EFAEHO OC1(C[NH2+]Cc2cccc(F)c2)CCN(Cc2ccccc2)CC1 ZINC000397607883 476857980 /nfs/dbraw/zinc/85/79/80/476857980.db2.gz QFHRVUQJMSSRJS-UHFFFAOYSA-N 1 3 328.431 2.942 10 0 EFAEHO CCc1ccc(CNCC2(O)CC[NH+](Cc3ccccc3)CC2)o1 ZINC000397578158 476858544 /nfs/dbraw/zinc/85/85/44/476858544.db2.gz DATGMLFHMHNABK-UHFFFAOYSA-N 1 3 328.456 2.959 10 0 EFAEHO C[C@@H](NCC1(O)CC[NH+](Cc2ccccc2)CC1)c1cncs1 ZINC000397705109 476859705 /nfs/dbraw/zinc/85/97/05/476859705.db2.gz WVGLXPKLZXMACW-OAHLLOKOSA-N 1 3 331.485 2.821 10 0 EFAEHO CCOC(=O)C1([C@H](C)N[C@@H]2COc3c2ccc(C)c3C)CC[NH2+]CC1 ZINC000422959801 476866825 /nfs/dbraw/zinc/86/68/25/476866825.db2.gz UOQIHXDJUANMAD-DOTOQJQBSA-N 1 3 346.471 2.648 10 0 EFAEHO CCOC(=O)C1([C@@H](C)N[C@H]2COc3c2ccc(C)c3C)CC[NH2+]CC1 ZINC000422959804 476866896 /nfs/dbraw/zinc/86/68/96/476866896.db2.gz UOQIHXDJUANMAD-WBVHZDCISA-N 1 3 346.471 2.648 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CC2(N3CCOCC3)CCN(C)CC2)CC(C)(C)C1 ZINC000414197547 476875886 /nfs/dbraw/zinc/87/58/86/476875886.db2.gz PJVKSPYPOMLEFR-ZWKOTPCHSA-N 1 3 337.552 2.587 10 0 EFAEHO NC[C@@H]1CCC[C@@H]1[NH2+]C[C@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422991716 476883690 /nfs/dbraw/zinc/88/36/90/476883690.db2.gz QAQFPVDPRVTLEL-YCPHGPKFSA-N 1 3 330.394 2.573 10 0 EFAEHO [NH3+]C[C@@H]1CCC[C@@H]1NC[C@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422991716 476883694 /nfs/dbraw/zinc/88/36/94/476883694.db2.gz QAQFPVDPRVTLEL-YCPHGPKFSA-N 1 3 330.394 2.573 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)[C@H](C)[NH3+] ZINC000399383121 476884039 /nfs/dbraw/zinc/88/40/39/476884039.db2.gz OVKIKALIBKXAED-AOIWGVFYSA-N 1 3 331.504 2.729 10 0 EFAEHO NC[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422994937 476884816 /nfs/dbraw/zinc/88/48/16/476884816.db2.gz WOYHZKSKIPCSQK-ZOBUZTSGSA-N 1 3 344.421 2.964 10 0 EFAEHO Clc1ccc(COCCN[C@@H]2CCOC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000423002104 476885581 /nfs/dbraw/zinc/88/55/81/476885581.db2.gz IVSAHLHJDWBWRV-FGTMMUONSA-N 1 3 338.879 2.603 10 0 EFAEHO CC(C)N1CC[C@@H](C[NH2+][C@@H](C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1 ZINC000400581112 476891883 /nfs/dbraw/zinc/89/18/83/476891883.db2.gz QSKCVYNLCJFQMR-YESZJQIVSA-N 1 3 339.524 2.952 10 0 EFAEHO COc1cc(Br)ccc1CCCN[C@@H]1CCC[C@@H]1[NH3+] ZINC000423028345 476896876 /nfs/dbraw/zinc/89/68/76/476896876.db2.gz GDGILZYSMGVVAI-UONOGXRCSA-N 1 3 327.266 2.860 10 0 EFAEHO CC1(C)CN(C(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)CCN1 ZINC000414956430 476902382 /nfs/dbraw/zinc/90/23/82/476902382.db2.gz AIUNDVKDLORORD-UHFFFAOYSA-N 1 3 344.503 2.931 10 0 EFAEHO CCOC(=O)c1csc(CC[NH2+][C@H]2C[C@H](N)c3ccccc32)n1 ZINC000423065405 476911774 /nfs/dbraw/zinc/91/17/74/476911774.db2.gz BGLZNDRYPLMWGF-KBPBESRZSA-N 1 3 331.441 2.597 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@H](CO)Cc1ccc(F)c(F)c1 ZINC000423069340 476915148 /nfs/dbraw/zinc/91/51/48/476915148.db2.gz DTILFEYUHJWRJF-IUODEOHRSA-N 1 3 349.425 2.629 10 0 EFAEHO OC[C@H](CN[C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1)Cc1ccc(F)c(F)c1 ZINC000423082172 476920519 /nfs/dbraw/zinc/92/05/19/476920519.db2.gz WGSHQDWGKHTIMR-OSGQAZFXSA-N 1 3 338.442 2.626 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@H]1CSc2ccc(Br)cc21 ZINC000423088899 476923626 /nfs/dbraw/zinc/92/36/26/476923626.db2.gz RFADXNAOPUBSEW-YPMHNXCESA-N 1 3 345.306 2.939 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2CCC[C@@H]2N)ccc1I ZINC000423092334 476925424 /nfs/dbraw/zinc/92/54/24/476925424.db2.gz BJIUSVYJNSRBNT-STQMWFEESA-N 1 3 330.213 2.569 10 0 EFAEHO CCOC(=O)[C@@H]1CC[C@H](N[C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423097858 476927692 /nfs/dbraw/zinc/92/76/92/476927692.db2.gz RHSCWSAFJIUVSN-MJEZEWASSA-N 1 3 344.455 2.564 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000423105752 476928833 /nfs/dbraw/zinc/92/88/33/476928833.db2.gz IQTUTMFCUXPRNS-IUODEOHRSA-N 1 3 335.275 2.760 10 0 EFAEHO C[C@@H](NCc1ccc(OC2CC[NH+](C)CC2)cc1)c1cnccc1N ZINC000423109608 476930599 /nfs/dbraw/zinc/93/05/99/476930599.db2.gz SRJZCNGFIFYVTR-OAHLLOKOSA-N 1 3 340.471 2.818 10 0 EFAEHO c1ccc([C@H]2CC[C@H](CN[C@@H]3CCOC[C@H]3[C@H]3CCC[NH2+]3)O2)cc1 ZINC000423127417 476937621 /nfs/dbraw/zinc/93/76/21/476937621.db2.gz SZERQGNEPROSLS-USYVTKNRSA-N 1 3 330.472 2.653 10 0 EFAEHO c1ccc([C@@H]2CC[C@H](CN[C@@H]3CCOC[C@H]3[C@@H]3CCC[NH2+]3)O2)cc1 ZINC000423127411 476937926 /nfs/dbraw/zinc/93/79/26/476937926.db2.gz SZERQGNEPROSLS-CXQPBAHBSA-N 1 3 330.472 2.653 10 0 EFAEHO c1cc(CN2CCC([NH2+]C3CC(N4CCCCC4)C3)CC2)ccn1 ZINC000366289067 476944052 /nfs/dbraw/zinc/94/40/52/476944052.db2.gz WALNSXKVHULVAL-UHFFFAOYSA-N 1 3 328.504 2.653 10 0 EFAEHO COc1ccc([C@H](CO)CN[C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000423168961 476952039 /nfs/dbraw/zinc/95/20/39/476952039.db2.gz IEUOLTYDRYOSRE-IJXRJRJASA-N 1 3 332.488 2.672 10 0 EFAEHO COc1ccc([C@H](CO)CN[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000423168963 476952291 /nfs/dbraw/zinc/95/22/91/476952291.db2.gz IEUOLTYDRYOSRE-OJAHFUOMSA-N 1 3 332.488 2.672 10 0 EFAEHO C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]CC1(N)CCCCCC1 ZINC000423206974 476964536 /nfs/dbraw/zinc/96/45/36/476964536.db2.gz XLIBIBHINUUAME-HKUYNNGSSA-N 1 3 330.520 2.933 10 0 EFAEHO C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NCC1([NH3+])CCCCCC1 ZINC000423206974 476964539 /nfs/dbraw/zinc/96/45/39/476964539.db2.gz XLIBIBHINUUAME-HKUYNNGSSA-N 1 3 330.520 2.933 10 0 EFAEHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000423292102 476985027 /nfs/dbraw/zinc/98/50/27/476985027.db2.gz LJDDWPPZSIJRNY-UONOGXRCSA-N 1 3 332.469 2.961 10 0 EFAEHO C[C@H](NC[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc2c(s1)CCC2 ZINC000423381724 477012187 /nfs/dbraw/zinc/01/21/87/477012187.db2.gz IIBAVXGDDRVLLY-XHDPSFHLSA-N 1 3 347.450 2.724 10 0 EFAEHO O=C(CCN1CCc2ccccc2C1)NCCC[NH+]1CCCCCC1 ZINC000416121184 477027058 /nfs/dbraw/zinc/02/70/58/477027058.db2.gz GBPXGJBCUHOABK-UHFFFAOYSA-N 1 3 343.515 2.817 10 0 EFAEHO CC(C)Oc1ccc([C@H](O)CN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)cc1 ZINC000375840484 477039964 /nfs/dbraw/zinc/03/99/64/477039964.db2.gz PNCPLPYCQHSSBK-UAFMIMERSA-N 1 3 332.488 2.970 10 0 EFAEHO CC(C)Oc1ccc([C@H](O)CN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@@H]32)cc1 ZINC000375840484 477039969 /nfs/dbraw/zinc/03/99/69/477039969.db2.gz PNCPLPYCQHSSBK-UAFMIMERSA-N 1 3 332.488 2.970 10 0 EFAEHO C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)CCN1CCc2ccccc2C1 ZINC000416185674 477060963 /nfs/dbraw/zinc/06/09/63/477060963.db2.gz WGNUWQRTDMVGTE-QGZVFWFLSA-N 1 3 343.515 2.624 10 0 EFAEHO COc1ccc(C[C@H](C)[NH2+]CC2(N)C3CC4CC(C3)CC2C4)cn1 ZINC000423520675 477060962 /nfs/dbraw/zinc/06/09/62/477060962.db2.gz FOGOWTZEILUNHO-OAMWCXBBSA-N 1 3 329.488 2.764 10 0 EFAEHO COc1ccc(C[C@H](C)NCC2([NH3+])C3CC4CC(C3)CC2C4)cn1 ZINC000423520675 477060966 /nfs/dbraw/zinc/06/09/66/477060966.db2.gz FOGOWTZEILUNHO-OAMWCXBBSA-N 1 3 329.488 2.764 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(N(C)Cc3ccccc3)CCC2)CC[N@@H+]1C ZINC000452731715 477062703 /nfs/dbraw/zinc/06/27/03/477062703.db2.gz OXRQUFPWGSGPJT-HKUYNNGSSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(N(C)Cc3ccccc3)CCC2)CC[N@H+]1C ZINC000452731715 477062709 /nfs/dbraw/zinc/06/27/09/477062709.db2.gz OXRQUFPWGSGPJT-HKUYNNGSSA-N 1 3 343.515 2.888 10 0 EFAEHO COC(=O)C[C@@H]1CC[C@@H]([NH2+]CC2(N)C3CC4CC(C3)CC2C4)[C@@H]1C ZINC000423530303 477066304 /nfs/dbraw/zinc/06/63/04/477066304.db2.gz QZKMTEQAZODVMA-QCWSJVRCSA-N 1 3 334.504 2.707 10 0 EFAEHO O=C([C@@H]1CCCN1Cc1ccccc1)N1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000371020227 477085883 /nfs/dbraw/zinc/08/58/83/477085883.db2.gz XNHBFGMWIFQJNF-AABGKKOBSA-N 1 3 341.499 2.642 10 0 EFAEHO C[N@@H+]1CCCC[C@@H]1CCC(=O)NCCCN1CCc2ccccc2C1 ZINC000431896502 477116770 /nfs/dbraw/zinc/11/67/70/477116770.db2.gz QBVJKPOCRHKESS-HXUWFJFHSA-N 1 3 343.515 2.816 10 0 EFAEHO C[N@H+]1CCCC[C@@H]1CCC(=O)NCCCN1CCc2ccccc2C1 ZINC000431896502 477116775 /nfs/dbraw/zinc/11/67/75/477116775.db2.gz QBVJKPOCRHKESS-HXUWFJFHSA-N 1 3 343.515 2.816 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](C)N2CCCC[C@H]2C)[C@@H](C)C1 ZINC000448462152 477176737 /nfs/dbraw/zinc/17/67/37/477176737.db2.gz QXFFGUBRBBHMRG-MHORFTMASA-N 1 3 338.540 2.621 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NC[C@H](C)N2CCCC[C@H]2C)[C@@H](C)C1 ZINC000448462152 477176744 /nfs/dbraw/zinc/17/67/44/477176744.db2.gz QXFFGUBRBBHMRG-MHORFTMASA-N 1 3 338.540 2.621 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@@H]2C)[C@@H](C)C1 ZINC000448518849 477182883 /nfs/dbraw/zinc/18/28/83/477182883.db2.gz AYSBVYGTKSQBHV-FJIDUMEYSA-N 1 3 338.540 2.621 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@@H]2C)[C@@H](C)C1 ZINC000448518849 477182888 /nfs/dbraw/zinc/18/28/88/477182888.db2.gz AYSBVYGTKSQBHV-FJIDUMEYSA-N 1 3 338.540 2.621 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H]2CC[C@H](C)O2)CC1 ZINC000453638106 477258908 /nfs/dbraw/zinc/25/89/08/477258908.db2.gz ZEGFQBIYGZNOOA-PKOBYXMFSA-N 1 3 331.504 2.876 10 0 EFAEHO CC(CCN1CCO[C@@H](C2CC2)C1)CC[N@@H+]1CCO[C@@H](C2CC2)C1 ZINC000411567472 477279393 /nfs/dbraw/zinc/27/93/93/477279393.db2.gz YYPFZRCVOXBKIF-WOJBJXKFSA-N 1 3 336.520 2.624 10 0 EFAEHO CC(CCN1CCO[C@@H](C2CC2)C1)CC[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000411567472 477279400 /nfs/dbraw/zinc/27/94/00/477279400.db2.gz YYPFZRCVOXBKIF-WOJBJXKFSA-N 1 3 336.520 2.624 10 0 EFAEHO O=C(NCC[C@@H]1CCC[NH2+]C1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000416783950 477309816 /nfs/dbraw/zinc/30/98/16/477309816.db2.gz IMBKARHOOBOCLW-HKUYNNGSSA-N 1 3 344.503 2.512 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@H](c2ccccc2)[C@H]2CCOC2)CC1 ZINC000367045075 477314610 /nfs/dbraw/zinc/31/46/10/477314610.db2.gz ZCRYEUGJRTXJMV-LEWJYISDSA-N 1 3 345.531 2.770 10 0 EFAEHO C[C@@H]([NH3+])[C@H](C)NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000416831106 477327542 /nfs/dbraw/zinc/32/75/42/477327542.db2.gz HIFFMDHFZZVURK-QLFBSQMISA-N 1 3 338.521 2.556 10 0 EFAEHO C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)C[NH2+][C@@H]1CCCC[C@H]1N ZINC000424289839 477357101 /nfs/dbraw/zinc/35/71/01/477357101.db2.gz CLVZFGIFVMRAJI-KFKAGJAMSA-N 1 3 329.488 2.673 10 0 EFAEHO C[C@H](C1CC1)N(Cc1ccccc1)C(=O)C[NH2+][C@@H]1CCCC[C@H]1N ZINC000424289837 477357447 /nfs/dbraw/zinc/35/74/47/477357447.db2.gz CLVZFGIFVMRAJI-ATZDWAIDSA-N 1 3 329.488 2.673 10 0 EFAEHO [NH3+][C@@H]1CCCC[C@H]1NC(=O)NCc1ccccc1CN1CCCCC1 ZINC000424454197 477413233 /nfs/dbraw/zinc/41/32/33/477413233.db2.gz NTAOVGXIOBQECG-RTBURBONSA-N 1 3 344.503 2.742 10 0 EFAEHO CC(C)NC(=O)CCNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449078021 477425639 /nfs/dbraw/zinc/42/56/39/477425639.db2.gz TVGKUYOZUPBCQG-KRWDZBQOSA-N 1 3 331.504 2.586 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@@H](N)c1ccccc1 ZINC000417026478 477429653 /nfs/dbraw/zinc/42/96/53/477429653.db2.gz ANCWEKZTWPAGTI-FUHWJXTLSA-N 1 3 332.492 2.640 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@@H](N)c1ccccc1 ZINC000417026478 477429661 /nfs/dbraw/zinc/42/96/61/477429661.db2.gz ANCWEKZTWPAGTI-FUHWJXTLSA-N 1 3 332.492 2.640 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@H](N)c1ccccc1 ZINC000417026482 477429769 /nfs/dbraw/zinc/42/97/69/477429769.db2.gz ANCWEKZTWPAGTI-WMZOPIPTSA-N 1 3 332.492 2.640 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@H](N)c1ccccc1 ZINC000417026482 477429779 /nfs/dbraw/zinc/42/97/79/477429779.db2.gz ANCWEKZTWPAGTI-WMZOPIPTSA-N 1 3 332.492 2.640 10 0 EFAEHO C[N@H+](CCCNC(=O)NC[C@H](N)c1ccccc1)C1CCCCC1 ZINC000417030174 477432307 /nfs/dbraw/zinc/43/23/07/477432307.db2.gz PMSJJMOBKBNUTC-SFHVURJKSA-N 1 3 332.492 2.640 10 0 EFAEHO C[N@@H+](CCCNC(=O)NC[C@H](N)c1ccccc1)C1CCCCC1 ZINC000417030174 477432312 /nfs/dbraw/zinc/43/23/12/477432312.db2.gz PMSJJMOBKBNUTC-SFHVURJKSA-N 1 3 332.492 2.640 10 0 EFAEHO C[C@H](Cc1ccccc1)N1CCC([NH2+][C@@H](C)C(=O)NC(C)(C)C)CC1 ZINC000449099419 477437527 /nfs/dbraw/zinc/43/75/27/477437527.db2.gz TUUMGHGVGGOIQL-SJORKVTESA-N 1 3 345.531 2.975 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NCCC(=O)NC(C)(C)C)CC1 ZINC000449145847 477457567 /nfs/dbraw/zinc/45/75/67/477457567.db2.gz MKLSKPRFAHTCAJ-QGZVFWFLSA-N 1 3 345.531 2.976 10 0 EFAEHO CS[C@H](CO)[C@@H](C)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449158987 477463680 /nfs/dbraw/zinc/46/36/80/477463680.db2.gz WQPAEKKCBUMPIB-FRQCXROJSA-N 1 3 336.545 2.784 10 0 EFAEHO COc1ccc(-n2cc(C[NH2+]C3C[C@H]4CCC[C@@H](C3)N4C)cn2)cc1 ZINC000449169742 477467834 /nfs/dbraw/zinc/46/78/34/477467834.db2.gz DRMWTDWXNZKHLC-JLYLLQBASA-N 1 3 340.471 2.986 10 0 EFAEHO C[C@H](CO[C@@H]1CCOC1)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449183442 477474419 /nfs/dbraw/zinc/47/44/19/477474419.db2.gz FTOHEEJBVZFMDQ-LVCYWYKZSA-N 1 3 346.515 2.866 10 0 EFAEHO CC[C@H]([NH3+])CNC(=O)N(CC)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418711238 477483858 /nfs/dbraw/zinc/48/38/58/477483858.db2.gz WGKRVPAJVOJCLD-BPQIPLTHSA-N 1 3 332.492 2.591 10 0 EFAEHO C[C@@H](Cc1ccccc1)N1CCC([NH2+]C[C@](C)(O)C(F)(F)F)CC1 ZINC000449217186 477491450 /nfs/dbraw/zinc/49/14/50/477491450.db2.gz XOXFPPVZEUWETP-YOEHRIQHSA-N 1 3 344.421 2.985 10 0 EFAEHO C[C@H](Cc1ccccc1)N1CCC([NH2+]C[C@](C)(O)C(F)(F)F)CC1 ZINC000449217183 477491771 /nfs/dbraw/zinc/49/17/71/477491771.db2.gz XOXFPPVZEUWETP-PBHICJAKSA-N 1 3 344.421 2.985 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NCCN2CCSCC2)CC1 ZINC000449221591 477494717 /nfs/dbraw/zinc/49/47/17/477494717.db2.gz GUCAMUYVWYDEMK-SFHVURJKSA-N 1 3 347.572 2.720 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)CC1 ZINC000371819782 477510986 /nfs/dbraw/zinc/51/09/86/477510986.db2.gz ZCHXWHHGCJNWCQ-FUHWJXTLSA-N 1 3 344.503 2.548 10 0 EFAEHO C[C@H](Cc1ccccc1)N1CCC([NH2+][C@@H]2CCc3nc[nH]c3C2)CC1 ZINC000449341146 477556516 /nfs/dbraw/zinc/55/65/16/477556516.db2.gz YAFMEPRNGIPVDM-VQIMIIECSA-N 1 3 338.499 2.952 10 0 EFAEHO C[C@H](Cc1ccccc1)N1CCC([NH2+][C@@H]2CCc3[nH]cnc3C2)CC1 ZINC000449341146 477556519 /nfs/dbraw/zinc/55/65/19/477556519.db2.gz YAFMEPRNGIPVDM-VQIMIIECSA-N 1 3 338.499 2.952 10 0 EFAEHO C[C@@H](Cc1ccccc1)N1CCC([NH2+][C@@H]2CCc3nc[nH]c3C2)CC1 ZINC000449341142 477556685 /nfs/dbraw/zinc/55/66/85/477556685.db2.gz YAFMEPRNGIPVDM-QFBILLFUSA-N 1 3 338.499 2.952 10 0 EFAEHO C[C@@H](Cc1ccccc1)N1CCC([NH2+][C@@H]2CCc3[nH]cnc3C2)CC1 ZINC000449341142 477556688 /nfs/dbraw/zinc/55/66/88/477556688.db2.gz YAFMEPRNGIPVDM-QFBILLFUSA-N 1 3 338.499 2.952 10 0 EFAEHO CC(C)Oc1cccc([C@H](O)C[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@H]32)c1 ZINC000367618838 477605306 /nfs/dbraw/zinc/60/53/06/477605306.db2.gz OIEROMJYGWWGKW-ZGXWSNOMSA-N 1 3 332.488 2.970 10 0 EFAEHO CC(C)Oc1cccc([C@H](O)CN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)c1 ZINC000367618838 477605312 /nfs/dbraw/zinc/60/53/12/477605312.db2.gz OIEROMJYGWWGKW-ZGXWSNOMSA-N 1 3 332.488 2.970 10 0 EFAEHO CC(C)Oc1cccc([C@H](O)CN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@H]32)c1 ZINC000367618838 477605317 /nfs/dbraw/zinc/60/53/17/477605317.db2.gz OIEROMJYGWWGKW-ZGXWSNOMSA-N 1 3 332.488 2.970 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccnc(OC3CCOCC3)c2)[C@H]2CCC[C@@H]21 ZINC000367625215 477609607 /nfs/dbraw/zinc/60/96/07/477609607.db2.gz XHZAZRNSUGOXMH-QYZOEREBSA-N 1 3 345.487 2.602 10 0 EFAEHO CCCc1ccc([C@H](C)N(CC[C@@H]2CCC[NH2+]C2)CC(N)=O)cc1 ZINC000420296875 477669282 /nfs/dbraw/zinc/66/92/82/477669282.db2.gz CIHLILBRWGTQFT-WMZOPIPTSA-N 1 3 331.504 2.877 10 0 EFAEHO CCCc1ccc([C@H](C)N(CC[C@H]2CCC[NH2+]C2)CC(N)=O)cc1 ZINC000420296873 477669677 /nfs/dbraw/zinc/66/96/77/477669677.db2.gz CIHLILBRWGTQFT-FUHWJXTLSA-N 1 3 331.504 2.877 10 0 EFAEHO CCCc1ccc([C@@H](C)N(CC[C@@H]2CCC[NH2+]C2)CC(N)=O)cc1 ZINC000420296872 477670171 /nfs/dbraw/zinc/67/01/71/477670171.db2.gz CIHLILBRWGTQFT-AEFFLSMTSA-N 1 3 331.504 2.877 10 0 EFAEHO CN(C(=O)c1cccc(C[NH+]2CCCCC2)c1)[C@@H]1CN2CCC1CC2 ZINC000413424628 477674244 /nfs/dbraw/zinc/67/42/44/477674244.db2.gz GQLOGTPVVQAIFX-HXUWFJFHSA-N 1 3 341.499 2.839 10 0 EFAEHO CCN(C(=O)NC[C@H](C)[NH+](C)C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000459033582 477709568 /nfs/dbraw/zinc/70/95/68/477709568.db2.gz CBBOGRNFMROJEO-SCTDSRPQSA-N 1 3 346.519 2.804 10 0 EFAEHO O=C(NC1CC[NH+](C2CCC2)CC1)N1CCN(C2CCCCC2)CC1 ZINC000459093293 477740847 /nfs/dbraw/zinc/74/08/47/477740847.db2.gz GIALMBKSOOQGIA-UHFFFAOYSA-N 1 3 348.535 2.663 10 0 EFAEHO CN(C(=O)NC[C@H]1CCC[N@@H+]1C1CCCCC1)[C@@H]1CCN(C2CC2)C1 ZINC000438318252 477822395 /nfs/dbraw/zinc/82/23/95/477822395.db2.gz CYMRDYMCSSPCAG-RTBURBONSA-N 1 3 348.535 2.662 10 0 EFAEHO CN(C(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1)[C@@H]1CCN(C2CC2)C1 ZINC000438318252 477822402 /nfs/dbraw/zinc/82/24/02/477822402.db2.gz CYMRDYMCSSPCAG-RTBURBONSA-N 1 3 348.535 2.662 10 0 EFAEHO CC(C)[C@@H]1CCN(CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000438501415 477853420 /nfs/dbraw/zinc/85/34/20/477853420.db2.gz MEZNEPMRAZBETK-HXUWFJFHSA-N 1 3 343.515 2.877 10 0 EFAEHO c1ccc2c(c1)OC[C@@H](CC[NH2+]C1CCN(c3ccncc3)CC1)O2 ZINC000459439044 477907308 /nfs/dbraw/zinc/90/73/08/477907308.db2.gz VJUFLKWDWDIFSY-GOSISDBHSA-N 1 3 339.439 2.870 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C(=O)NCCN3CCCC3)cc2)[C@@H]1C ZINC000495056712 478114926 /nfs/dbraw/zinc/11/49/26/478114926.db2.gz CXHLMIOQMYKUEZ-GPMSIDNRSA-N 1 3 329.488 2.646 10 0 EFAEHO CC[N@H+](CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1)CC1CC1 ZINC000517757051 478122397 /nfs/dbraw/zinc/12/23/97/478122397.db2.gz MMXTXMJDYCYGQT-QGZVFWFLSA-N 1 3 335.536 2.689 10 0 EFAEHO CC[N@@H+](CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1)CC1CC1 ZINC000517757051 478122401 /nfs/dbraw/zinc/12/24/01/478122401.db2.gz MMXTXMJDYCYGQT-QGZVFWFLSA-N 1 3 335.536 2.689 10 0 EFAEHO C(CCN1CCO[C@@H](C2CCC2)C1)CN1CCO[C@@H](C2CCC2)C1 ZINC000560725576 478126777 /nfs/dbraw/zinc/12/67/77/478126777.db2.gz PIISPXBEDGCTQL-WOJBJXKFSA-N 1 3 336.520 2.768 10 0 EFAEHO O=C(NCC[NH+]1CCC2(CCCCC2)CC1)N[C@H]1CCN(C2CC2)C1 ZINC000441000972 478185541 /nfs/dbraw/zinc/18/55/41/478185541.db2.gz BWSHURZYMQADEB-KRWDZBQOSA-N 1 3 348.535 2.569 10 0 EFAEHO CC(C)c1ccc([C@@H](N)CNC(=O)c2ccccc2CC[NH3+])cc1 ZINC000518993814 478203141 /nfs/dbraw/zinc/20/31/41/478203141.db2.gz QLXKPFWIRXLUHO-IBGZPJMESA-N 1 3 325.456 2.741 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3C[C@H](C)CC[C@H]3C)CC2)CC1 ZINC000570104845 478284379 /nfs/dbraw/zinc/28/43/79/478284379.db2.gz QFTPFMPPCRLPJR-IAGOWNOFSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)[NH2+][C@@H]1CCCN(C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000590812987 478351311 /nfs/dbraw/zinc/35/13/11/478351311.db2.gz ZKRBWZQMSQGXNV-LJQANCHMSA-N 1 3 329.488 2.885 10 0 EFAEHO CCC[NH+]1CCC(CNCc2cnnn2Cc2ccccc2)CC1 ZINC000490864231 478395549 /nfs/dbraw/zinc/39/55/49/478395549.db2.gz JUSAOMLVMSHSDX-UHFFFAOYSA-N 1 3 327.476 2.538 10 0 EFAEHO C[NH+](C)CCc1ccc(CNCCC(=O)Nc2ccccc2)cc1 ZINC000563003206 478410655 /nfs/dbraw/zinc/41/06/55/478410655.db2.gz PJKGTTLELNJKIV-UHFFFAOYSA-N 1 3 325.456 2.909 10 0 EFAEHO CCN(CC)Cc1cccc(NC(=O)COC2CCC([NH3+])CC2)c1 ZINC000563056703 478434343 /nfs/dbraw/zinc/43/43/43/478434343.db2.gz YYBNZYWEZVMYKO-UHFFFAOYSA-N 1 3 333.476 2.753 10 0 EFAEHO CCOC(=O)C1([C@@H](C)N[C@@H](c2ccccn2)C2CCC2)CC[NH2+]CC1 ZINC000600708948 478478985 /nfs/dbraw/zinc/47/89/85/478478985.db2.gz MAZUEHYHLJXOFJ-CRAIPNDOSA-N 1 3 345.487 2.834 10 0 EFAEHO Cc1cc(CNCc2ccccc2C[N@@H+]2CCC[C@H]2CO)ccn1 ZINC000527693616 478480118 /nfs/dbraw/zinc/48/01/18/478480118.db2.gz XPJOQKUTZPBEEI-FQEVSTJZSA-N 1 3 325.456 2.637 10 0 EFAEHO Cc1cc(CNCc2ccccc2C[N@H+]2CCC[C@H]2CO)ccn1 ZINC000527693616 478480127 /nfs/dbraw/zinc/48/01/27/478480127.db2.gz XPJOQKUTZPBEEI-FQEVSTJZSA-N 1 3 325.456 2.637 10 0 EFAEHO CCC[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(=O)NC1CCN(C)CC1 ZINC000527709472 478487677 /nfs/dbraw/zinc/48/76/77/478487677.db2.gz FVAXSVRPKQFFND-UYAOXDASSA-N 1 3 343.515 2.745 10 0 EFAEHO CCC[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)NC1CCN(C)CC1 ZINC000527709472 478487691 /nfs/dbraw/zinc/48/76/91/478487691.db2.gz FVAXSVRPKQFFND-UYAOXDASSA-N 1 3 343.515 2.745 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)CCN(C)c2cc[nH+]cc2)N(C)C)cc1 ZINC000540929001 478511693 /nfs/dbraw/zinc/51/16/93/478511693.db2.gz MSJSMJHLGUIFDN-IBGZPJMESA-N 1 3 340.471 2.635 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1C[NH2+]C[C@H]1CCN1C1CCCC1 ZINC000527806284 478529011 /nfs/dbraw/zinc/52/90/11/478529011.db2.gz DXVLYGBAXIHESY-LJQANCHMSA-N 1 3 325.460 2.682 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCCC1)NC1CC([NH+]2CCCCC2)C1 ZINC000527891956 478561192 /nfs/dbraw/zinc/56/11/92/478561192.db2.gz FTIMPSOZOKYDSP-CUYAVPTFSA-N 1 3 348.535 2.710 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)N[C@H]2CC[NH2+]C[C@H]2C)CC1 ZINC000571303979 478567648 /nfs/dbraw/zinc/56/76/48/478567648.db2.gz OCQIVRYCBCGHDW-MDZRGWNJSA-N 1 3 344.503 2.509 10 0 EFAEHO CN(CCC(=O)NCC1([NH+](C)C)CCCCCC1)c1ccncc1 ZINC000541857082 478597859 /nfs/dbraw/zinc/59/78/59/478597859.db2.gz COQXAIKMLHXFEI-UHFFFAOYSA-N 1 3 332.492 2.679 10 0 EFAEHO CCN(C(=O)NCC1([NH3+])CCC1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000563601444 478598511 /nfs/dbraw/zinc/59/85/11/478598511.db2.gz HOPHHWVHNBXLNS-FUHWJXTLSA-N 1 3 344.503 2.735 10 0 EFAEHO NC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 ZINC000582481532 478607207 /nfs/dbraw/zinc/60/72/07/478607207.db2.gz QYMYAMKJMFSHDU-QEORTHHSSA-N 1 3 346.425 2.860 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]C[C@H]2CCN2C2CCCC2)[C@@H](C)C1 ZINC000528014947 478613791 /nfs/dbraw/zinc/61/37/91/478613791.db2.gz VZHODDUKUKMVAO-SXLOBPIMSA-N 1 3 337.552 2.730 10 0 EFAEHO CC(C)(C)OC(=O)COCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000601144167 478684409 /nfs/dbraw/zinc/68/44/09/478684409.db2.gz FPQVSVQEDZPWLJ-UHFFFAOYSA-N 1 3 340.508 2.731 10 0 EFAEHO CN(C)CCN(Cc1cccs1)C(=O)CCN(C)c1cc[nH+]cc1 ZINC000542786019 478685331 /nfs/dbraw/zinc/68/53/31/478685331.db2.gz SYJLODOBXPGPLK-UHFFFAOYSA-N 1 3 346.500 2.560 10 0 EFAEHO CN(C)CCN(C(=O)CCN(C)c1cc[nH+]cc1)c1ccccc1 ZINC000542787377 478685732 /nfs/dbraw/zinc/68/57/32/478685732.db2.gz DPGZMKGTARQHQI-UHFFFAOYSA-N 1 3 326.444 2.503 10 0 EFAEHO O=C(Nc1ccc2c(c1F)CCNC2)NC1CC([NH+]2CCCCC2)C1 ZINC000582834204 478697957 /nfs/dbraw/zinc/69/79/57/478697957.db2.gz UKACVVSWLQVWJM-UHFFFAOYSA-N 1 3 346.450 2.610 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)N[C@@H](C)CN2CCC(C)CC2)cc1 ZINC000582856962 478705796 /nfs/dbraw/zinc/70/57/96/478705796.db2.gz VSEPAPKEACDRNP-HOTGVXAUSA-N 1 3 332.492 2.626 10 0 EFAEHO C[N@@H+]1CCCC[C@@H]1CN1CCN(C[C@H]2CCc3ccccc3C2)CC1 ZINC000542916117 478708682 /nfs/dbraw/zinc/70/86/82/478708682.db2.gz WSFHYISJJNMQKK-SIKLNZKXSA-N 1 3 341.543 2.893 10 0 EFAEHO C[N@H+]1CCCC[C@@H]1CN1CCN(C[C@H]2CCc3ccccc3C2)CC1 ZINC000542916117 478708686 /nfs/dbraw/zinc/70/86/86/478708686.db2.gz WSFHYISJJNMQKK-SIKLNZKXSA-N 1 3 341.543 2.893 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)[C@@H]1C[C@H]1c1ccsc1 ZINC000528335129 478724332 /nfs/dbraw/zinc/72/43/32/478724332.db2.gz MPZOJKLKOKBVJS-OKZBNKHCSA-N 1 3 349.544 2.726 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)[C@@H]1C[C@H]1c1ccsc1 ZINC000528335129 478724338 /nfs/dbraw/zinc/72/43/38/478724338.db2.gz MPZOJKLKOKBVJS-OKZBNKHCSA-N 1 3 349.544 2.726 10 0 EFAEHO Cc1noc(CCN[C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)n1 ZINC000583066305 478753202 /nfs/dbraw/zinc/75/32/02/478753202.db2.gz CVJVIRAZFSYLLS-QRVBRYPASA-N 1 3 340.471 2.953 10 0 EFAEHO Cc1noc(CCN[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)n1 ZINC000583066305 478753210 /nfs/dbraw/zinc/75/32/10/478753210.db2.gz CVJVIRAZFSYLLS-QRVBRYPASA-N 1 3 340.471 2.953 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[NH2+]C[C@@H](C)CN1CCCC1 ZINC000564650986 478777583 /nfs/dbraw/zinc/77/75/83/478777583.db2.gz FRSLMQMGGWYVQS-QZTJIDSGSA-N 1 3 334.504 2.871 10 0 EFAEHO C[C@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@@H+]1CCC[C@@H](C)C1 ZINC000572495813 478853406 /nfs/dbraw/zinc/85/34/06/478853406.db2.gz GCAMZRIEYKBWJO-ZIAGYGMSSA-N 1 3 348.466 2.713 10 0 EFAEHO C[C@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@H+]1CCC[C@@H](C)C1 ZINC000572495813 478853409 /nfs/dbraw/zinc/85/34/09/478853409.db2.gz GCAMZRIEYKBWJO-ZIAGYGMSSA-N 1 3 348.466 2.713 10 0 EFAEHO CCOC(=O)C1([C@H](C)NC2(c3ccccc3OC)CC2)CC[NH2+]CC1 ZINC000592470739 478907561 /nfs/dbraw/zinc/90/75/61/478907561.db2.gz GQUATBZDOWJIEX-HNNXBMFYSA-N 1 3 346.471 2.595 10 0 EFAEHO C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccccc2CC[NH3+])C1 ZINC000565151333 478926549 /nfs/dbraw/zinc/92/65/49/478926549.db2.gz LIDHWOUREMZCTG-QFBILLFUSA-N 1 3 337.467 2.753 10 0 EFAEHO CC1=CCN(CC[NH2+]C2CCN(CCc3ccccc3)CC2)CC1 ZINC000545868342 478963336 /nfs/dbraw/zinc/96/33/36/478963336.db2.gz HFUNKYATBIWZFC-UHFFFAOYSA-N 1 3 327.516 2.935 10 0 EFAEHO CC1=CCN(CCNC2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC000545868342 478963343 /nfs/dbraw/zinc/96/33/43/478963343.db2.gz HFUNKYATBIWZFC-UHFFFAOYSA-N 1 3 327.516 2.935 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@H]([C@H](C)O)C2)CC1 ZINC000546655628 479049909 /nfs/dbraw/zinc/04/99/09/479049909.db2.gz AHWCJPASTAAWIQ-OALUTQOASA-N 1 3 345.531 2.811 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@H]([C@H](C)O)C2)CC1 ZINC000546655628 479049920 /nfs/dbraw/zinc/04/99/20/479049920.db2.gz AHWCJPASTAAWIQ-OALUTQOASA-N 1 3 345.531 2.811 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)C1 ZINC000565667795 479058541 /nfs/dbraw/zinc/05/85/41/479058541.db2.gz UNUGOYJVUBSZAP-QUCCMNQESA-N 1 3 343.515 2.747 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000565667795 479058547 /nfs/dbraw/zinc/05/85/47/479058547.db2.gz UNUGOYJVUBSZAP-QUCCMNQESA-N 1 3 343.515 2.747 10 0 EFAEHO CC(C)CC[C@@H]1CCC[C@H]1[NH2+]CC(=O)NC1CCN(C2CC2)CC1 ZINC000493637587 479093026 /nfs/dbraw/zinc/09/30/26/479093026.db2.gz YXTVXKAPUUFHLE-QFBILLFUSA-N 1 3 335.536 2.924 10 0 EFAEHO CN1CC[C@H](NC(=O)NCC2([NH3+])CCCCCC2)[C@@H]1c1ccccc1 ZINC000515047582 479110242 /nfs/dbraw/zinc/11/02/42/479110242.db2.gz IGVRPIIBJQTFIV-ROUUACIJSA-N 1 3 344.503 2.783 10 0 EFAEHO CSC[C@H](O)C[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000596064699 479117148 /nfs/dbraw/zinc/11/71/48/479117148.db2.gz HSMAMHCKMQYIPH-QZTJIDSGSA-N 1 3 334.529 2.602 10 0 EFAEHO CSC[C@H](O)CNC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000596064699 479117154 /nfs/dbraw/zinc/11/71/54/479117154.db2.gz HSMAMHCKMQYIPH-QZTJIDSGSA-N 1 3 334.529 2.602 10 0 EFAEHO CSC[C@H](O)CNC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000596064699 479117158 /nfs/dbraw/zinc/11/71/58/479117158.db2.gz HSMAMHCKMQYIPH-QZTJIDSGSA-N 1 3 334.529 2.602 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000584418533 479129170 /nfs/dbraw/zinc/12/91/70/479129170.db2.gz DGSWHJZFYOFSBW-QGZVFWFLSA-N 1 3 329.488 2.631 10 0 EFAEHO CC(C)c1ccc([C@@H](N)CNC(=O)N2CC[C@@]3(C2)CCC[NH2+]C3)cc1 ZINC000557219662 479267558 /nfs/dbraw/zinc/26/75/58/479267558.db2.gz VNGSXIAUTRMYGS-ICSRJNTNSA-N 1 3 344.503 2.595 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)N2CC[C@]3(C2)CCC[NH2+]C3)cc1 ZINC000557219672 479268280 /nfs/dbraw/zinc/26/82/80/479268280.db2.gz VNGSXIAUTRMYGS-UYAOXDASSA-N 1 3 344.503 2.595 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCCC1)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC000529722080 479269131 /nfs/dbraw/zinc/26/91/31/479269131.db2.gz GFZXZAWFJCKLBZ-OALUTQOASA-N 1 3 333.520 2.917 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCCC1)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC000529722080 479269136 /nfs/dbraw/zinc/26/91/36/479269136.db2.gz GFZXZAWFJCKLBZ-OALUTQOASA-N 1 3 333.520 2.917 10 0 EFAEHO O[C@H](C[NH2+]Cc1ccccc1CN1CCC(O)CC1)CC1CCCC1 ZINC000574393474 479278144 /nfs/dbraw/zinc/27/81/44/479278144.db2.gz XEZXMJMUQGIDLP-NRFANRHFSA-N 1 3 346.515 2.674 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN2CC[C@H](C(=O)OC(C)(C)C)C2)cc1 ZINC000611274319 479333525 /nfs/dbraw/zinc/33/35/25/479333525.db2.gz JOHGSHAYLZDPCK-KRWDZBQOSA-N 1 3 348.487 2.791 10 0 EFAEHO COC(=O)c1ccc(CNCc2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000611433879 479379249 /nfs/dbraw/zinc/37/92/49/479379249.db2.gz HAYUDJOGUMQLDU-UHFFFAOYSA-N 1 3 342.439 2.703 10 0 EFAEHO CN1CCC[C@@H](NC(=O)N[C@@H](C[NH+]2CCCCC2)c2ccccc2)C1 ZINC000604178849 479481041 /nfs/dbraw/zinc/48/10/41/479481041.db2.gz HQULMJPSRPAYBR-MOPGFXCFSA-N 1 3 344.503 2.607 10 0 EFAEHO C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@@H]2CCCN(C)C2)CC1 ZINC000604814147 479575688 /nfs/dbraw/zinc/57/56/88/479575688.db2.gz DBLQUDMZAZFUSA-VQIMIIECSA-N 1 3 344.503 2.605 10 0 EFAEHO COC(=O)[C@H]1C[C@@H](NC2CC[NH+]([C@H](C)Cc3ccccc3)CC2)C1 ZINC000597223943 479630330 /nfs/dbraw/zinc/63/03/30/479630330.db2.gz YDHPSNFIMSSTHJ-SUMDDJOVSA-N 1 3 330.472 2.623 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]Cc2c(C(F)(F)F)nc3n2CCCC3)CCN1C ZINC000606445476 479688147 /nfs/dbraw/zinc/68/81/47/479688147.db2.gz QNQOWCAOHFIWCU-VXGBXAGGSA-N 1 3 330.398 2.811 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NC[C@H]2CCCCN2C2CC2)CC1 ZINC000633190032 479709948 /nfs/dbraw/zinc/70/99/48/479709948.db2.gz IMAQLASBRDKICH-QGZVFWFLSA-N 1 3 336.524 2.519 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)CC[N@@H+]1C ZINC000630806974 479717124 /nfs/dbraw/zinc/71/71/24/479717124.db2.gz CMHHLGRDBKTTBP-WZGPROSRSA-N 1 3 329.488 2.668 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)CC[N@H+]1C ZINC000630806974 479717128 /nfs/dbraw/zinc/71/71/28/479717128.db2.gz CMHHLGRDBKTTBP-WZGPROSRSA-N 1 3 329.488 2.668 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H]1CC[C@H]1c1ccc(F)cc1 ZINC000628050363 479746450 /nfs/dbraw/zinc/74/64/50/479746450.db2.gz BHXFZMHALVNOPH-ZYSHUDEJSA-N 1 3 349.494 2.708 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H]1CC[C@H]1c1ccc(F)cc1 ZINC000628050363 479746456 /nfs/dbraw/zinc/74/64/56/479746456.db2.gz BHXFZMHALVNOPH-ZYSHUDEJSA-N 1 3 349.494 2.708 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H]1CC[C@@H]1c1ccc(F)cc1 ZINC000628050361 479746736 /nfs/dbraw/zinc/74/67/36/479746736.db2.gz BHXFZMHALVNOPH-KFKAGJAMSA-N 1 3 349.494 2.708 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H]1CC[C@@H]1c1ccc(F)cc1 ZINC000628050361 479746738 /nfs/dbraw/zinc/74/67/38/479746738.db2.gz BHXFZMHALVNOPH-KFKAGJAMSA-N 1 3 349.494 2.708 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)CC[N@@H+]1C ZINC000630861891 479749249 /nfs/dbraw/zinc/74/92/49/479749249.db2.gz ZNEVXRLMBFKGKG-BPQIPLTHSA-N 1 3 349.544 2.807 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)CC[N@H+]1C ZINC000630861891 479749254 /nfs/dbraw/zinc/74/92/54/479749254.db2.gz ZNEVXRLMBFKGKG-BPQIPLTHSA-N 1 3 349.544 2.807 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)N[C@H](C)CN2CCC(C)CC2)CC1 ZINC000633355775 479786101 /nfs/dbraw/zinc/78/61/01/479786101.db2.gz ZYVQDERGXZEOLI-QGZVFWFLSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)Nc2ccc(OCCN(C)C)c(C)c2)CC[N@@H+]1C ZINC000633416548 479816090 /nfs/dbraw/zinc/81/60/90/479816090.db2.gz KEKQAYRKNVODPY-DLBZAZTESA-N 1 3 333.476 2.604 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)Nc2ccc(OCCN(C)C)c(C)c2)CC[N@H+]1C ZINC000633416548 479816098 /nfs/dbraw/zinc/81/60/98/479816098.db2.gz KEKQAYRKNVODPY-DLBZAZTESA-N 1 3 333.476 2.604 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC(C)(C)C(F)(F)F)CC2)CC1 ZINC000616203360 479850543 /nfs/dbraw/zinc/85/05/43/479850543.db2.gz VCJKVRXTUDMZBZ-UHFFFAOYSA-N 1 3 349.441 2.640 10 0 EFAEHO O[C@H](CC[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21)C(F)F ZINC000631704823 480229560 /nfs/dbraw/zinc/22/95/60/480229560.db2.gz XVSWYLFDCOKMIR-BRSBDYLESA-N 1 3 338.442 2.893 10 0 EFAEHO C[C@H](Cc1ccccc1)N1CCC([NH2+][C@@H](C)[C@@H](O)C(F)(F)F)CC1 ZINC000631716099 480235146 /nfs/dbraw/zinc/23/51/46/480235146.db2.gz HONGLZQYNSSRSK-JKIFEVAISA-N 1 3 344.421 2.983 10 0 EFAEHO COc1ccc([C@H](CN[C@H]2CC[N@H+](C)C(C)(C)C2)N(C)C)cc1OC ZINC000623338385 480238892 /nfs/dbraw/zinc/23/88/92/480238892.db2.gz XYLBZHKNSPUAOQ-IRXDYDNUSA-N 1 3 349.519 2.769 10 0 EFAEHO COc1ccc([C@H](CN[C@H]2CC[N@@H+](C)C(C)(C)C2)N(C)C)cc1OC ZINC000623338385 480238896 /nfs/dbraw/zinc/23/88/96/480238896.db2.gz XYLBZHKNSPUAOQ-IRXDYDNUSA-N 1 3 349.519 2.769 10 0 EFAEHO COc1ccc([C@H](C[NH2+][C@H]2CCN(C)C(C)(C)C2)N(C)C)cc1OC ZINC000623338385 480238904 /nfs/dbraw/zinc/23/89/04/480238904.db2.gz XYLBZHKNSPUAOQ-IRXDYDNUSA-N 1 3 349.519 2.769 10 0 EFAEHO C[N@@H+]1CC[C@H](NCc2ccnc(N3CCSCC3)c2)[C@H]2CCC[C@H]21 ZINC000631723014 480239681 /nfs/dbraw/zinc/23/96/81/480239681.db2.gz DOEUIWCOYXNBQT-FGTMMUONSA-N 1 3 346.544 2.597 10 0 EFAEHO C[N@H+]1CC[C@H](NCc2ccnc(N3CCSCC3)c2)[C@H]2CCC[C@H]21 ZINC000631723014 480239688 /nfs/dbraw/zinc/23/96/88/480239688.db2.gz DOEUIWCOYXNBQT-FGTMMUONSA-N 1 3 346.544 2.597 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccnc(N3CCSCC3)c2)[C@H]2CCC[C@H]21 ZINC000631723014 480239693 /nfs/dbraw/zinc/23/96/93/480239693.db2.gz DOEUIWCOYXNBQT-FGTMMUONSA-N 1 3 346.544 2.597 10 0 EFAEHO C[C@@H](Cc1ccc(Br)c(F)c1)NCC1([NH3+])CCOCC1 ZINC000629389010 480243901 /nfs/dbraw/zinc/24/39/01/480243901.db2.gz HUJGYRZYGMJOOQ-NSHDSACASA-N 1 3 345.256 2.617 10 0 EFAEHO CSc1cc(Br)ccc1CNCCOCCC[NH3+] ZINC000629399938 480245731 /nfs/dbraw/zinc/24/57/31/480245731.db2.gz MQEDYGZILMFVTD-UHFFFAOYSA-N 1 3 333.295 2.626 10 0 EFAEHO CCC(CC)[C@@H](CN[C@@H]1CC[N@H+](C)C(C)(C)C1)N1CCOCC1 ZINC000623353430 480245856 /nfs/dbraw/zinc/24/58/56/480245856.db2.gz LGSXYWUMSRPFBH-QZTJIDSGSA-N 1 3 325.541 2.586 10 0 EFAEHO CCC(CC)[C@@H](CN[C@@H]1CC[N@@H+](C)C(C)(C)C1)N1CCOCC1 ZINC000623353430 480245862 /nfs/dbraw/zinc/24/58/62/480245862.db2.gz LGSXYWUMSRPFBH-QZTJIDSGSA-N 1 3 325.541 2.586 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(OC(C)(C)C)cc1 ZINC000617505589 480247527 /nfs/dbraw/zinc/24/75/27/480247527.db2.gz IXXGXSHCIQCRCJ-INIZCTEOSA-N 1 3 349.519 2.866 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(OC(C)(C)C)cc1 ZINC000617505589 480247532 /nfs/dbraw/zinc/24/75/32/480247532.db2.gz IXXGXSHCIQCRCJ-INIZCTEOSA-N 1 3 349.519 2.866 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@]1(C)CCCc2ccccc21 ZINC000617504885 480247791 /nfs/dbraw/zinc/24/77/91/480247791.db2.gz NYNBXRBAJCKHCS-LAUBAEHRSA-N 1 3 345.531 2.669 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@]1(C)CCCc2ccccc21 ZINC000617504885 480247797 /nfs/dbraw/zinc/24/77/97/480247797.db2.gz NYNBXRBAJCKHCS-LAUBAEHRSA-N 1 3 345.531 2.669 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccccc1 ZINC000617505749 480248399 /nfs/dbraw/zinc/24/83/99/480248399.db2.gz OJSFOIGCTHVXHS-HKUYNNGSSA-N 1 3 333.520 2.814 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccccc1 ZINC000617505749 480248405 /nfs/dbraw/zinc/24/84/05/480248405.db2.gz OJSFOIGCTHVXHS-HKUYNNGSSA-N 1 3 333.520 2.814 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(C(F)(F)F)cc1 ZINC000617503577 480248748 /nfs/dbraw/zinc/24/87/48/480248748.db2.gz PFVDYCJAEGIINY-ZDUSSCGKSA-N 1 3 345.409 2.707 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(C(F)(F)F)cc1 ZINC000617503577 480248755 /nfs/dbraw/zinc/24/87/55/480248755.db2.gz PFVDYCJAEGIINY-ZDUSSCGKSA-N 1 3 345.409 2.707 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)CCc1cccc(Cl)c1 ZINC000617504245 480248822 /nfs/dbraw/zinc/24/88/22/480248822.db2.gz MGHVHEMKROLBQQ-HNNXBMFYSA-N 1 3 339.911 2.661 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)CCc1cccc(Cl)c1 ZINC000617504245 480248832 /nfs/dbraw/zinc/24/88/32/480248832.db2.gz MGHVHEMKROLBQQ-HNNXBMFYSA-N 1 3 339.911 2.661 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccc(OCC(F)(F)F)nc2)CC1(C)C ZINC000623356939 480249108 /nfs/dbraw/zinc/24/91/08/480249108.db2.gz PNNJAFFCNOHRJB-ZDUSSCGKSA-N 1 3 331.382 2.985 10 0 EFAEHO Cc1cc(C)cc(CCC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000617506131 480249570 /nfs/dbraw/zinc/24/95/70/480249570.db2.gz AMUWDHIZVQKTEI-SFHVURJKSA-N 1 3 333.520 2.624 10 0 EFAEHO Cc1cc(C)cc(CCC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000617506131 480249575 /nfs/dbraw/zinc/24/95/75/480249575.db2.gz AMUWDHIZVQKTEI-SFHVURJKSA-N 1 3 333.520 2.624 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@H]1CCSc2ccccc21 ZINC000617505992 480249615 /nfs/dbraw/zinc/24/96/15/480249615.db2.gz XHBROPPEUFUBPJ-RDJZCZTQSA-N 1 3 349.544 2.654 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@H]1CCSc2ccccc21 ZINC000617505992 480249620 /nfs/dbraw/zinc/24/96/20/480249620.db2.gz XHBROPPEUFUBPJ-RDJZCZTQSA-N 1 3 349.544 2.654 10 0 EFAEHO C[C@H](C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccc(Cl)s1 ZINC000617506033 480250327 /nfs/dbraw/zinc/25/03/27/480250327.db2.gz YMTVBFLKEPKDKV-STQMWFEESA-N 1 3 345.940 2.893 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C/C=C/c1ccc(F)cc1 ZINC000617505988 480251462 /nfs/dbraw/zinc/25/14/62/480251462.db2.gz XEOVVNHLTUBILG-YERXGYGTSA-N 1 3 335.467 2.617 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C/C=C/c1ccc(F)cc1 ZINC000617505988 480251469 /nfs/dbraw/zinc/25/14/69/480251469.db2.gz XEOVVNHLTUBILG-YERXGYGTSA-N 1 3 335.467 2.617 10 0 EFAEHO Cc1nc2ccc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc2s1 ZINC000617506960 480251521 /nfs/dbraw/zinc/25/15/21/480251521.db2.gz DNHGDOUQISKUNO-ZDUSSCGKSA-N 1 3 348.516 2.607 10 0 EFAEHO Cc1nc2ccc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc2s1 ZINC000617506960 480251524 /nfs/dbraw/zinc/25/15/24/480251524.db2.gz DNHGDOUQISKUNO-ZDUSSCGKSA-N 1 3 348.516 2.607 10 0 EFAEHO C[C@@H]1CN(Cc2cccc(CN[C@@H]3CC[N@H+](C)C(C)(C)C3)c2)CCO1 ZINC000623375964 480255014 /nfs/dbraw/zinc/25/50/14/480255014.db2.gz AOCJBOJSBZAMOE-YLJYHZDGSA-N 1 3 345.531 2.870 10 0 EFAEHO C[C@@H]1CN(Cc2cccc(CN[C@@H]3CC[N@@H+](C)C(C)(C)C3)c2)CCO1 ZINC000623375964 480255018 /nfs/dbraw/zinc/25/50/18/480255018.db2.gz AOCJBOJSBZAMOE-YLJYHZDGSA-N 1 3 345.531 2.870 10 0 EFAEHO C[C@@H]1CN(Cc2cccc(C[NH2+][C@@H]3CCN(C)C(C)(C)C3)c2)CCO1 ZINC000623375964 480255021 /nfs/dbraw/zinc/25/50/21/480255021.db2.gz AOCJBOJSBZAMOE-YLJYHZDGSA-N 1 3 345.531 2.870 10 0 EFAEHO COc1cc(OC)c(CCN[C@H]2CC[N@H+](C)C(C)(C)C2)c(OC)c1 ZINC000623410274 480268685 /nfs/dbraw/zinc/26/86/85/480268685.db2.gz IIKNSHUFPRFZOS-AWEZNQCLSA-N 1 3 336.476 2.717 10 0 EFAEHO COc1cc(OC)c(CCN[C@H]2CC[N@@H+](C)C(C)(C)C2)c(OC)c1 ZINC000623410274 480268689 /nfs/dbraw/zinc/26/86/89/480268689.db2.gz IIKNSHUFPRFZOS-AWEZNQCLSA-N 1 3 336.476 2.717 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C)C(C)(C)C2)c(N2CCOCC2)c1 ZINC000623443015 480286604 /nfs/dbraw/zinc/28/66/04/480286604.db2.gz LXCUGUPYICQZDN-GOSISDBHSA-N 1 3 331.504 2.794 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCC([C@H]2CC[NH2+]C2)CC1)c1ccccc1 ZINC000631826016 480286956 /nfs/dbraw/zinc/28/69/56/480286956.db2.gz BKRZYUYGIKZLKA-MDZRGWNJSA-N 1 3 329.488 2.574 10 0 EFAEHO C[N@@H+]1CC[C@@H](N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)CC1(C)C ZINC000623445599 480287461 /nfs/dbraw/zinc/28/74/61/480287461.db2.gz XWPUZYFTGRHOFG-RTBURBONSA-N 1 3 343.515 2.683 10 0 EFAEHO C[N@H+]1CC[C@@H](N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)CC1(C)C ZINC000623445599 480287466 /nfs/dbraw/zinc/28/74/66/480287466.db2.gz XWPUZYFTGRHOFG-RTBURBONSA-N 1 3 343.515 2.683 10 0 EFAEHO CN1CC[C@H]([NH2+][C@H](CO)c2cccc(Br)c2)CC1(C)C ZINC000623452888 480290215 /nfs/dbraw/zinc/29/02/15/480290215.db2.gz SQSJCJZQCBEDOO-LSDHHAIUSA-N 1 3 341.293 2.945 10 0 EFAEHO CN1CC[C@@H]([NH2+][C@H](CO)c2cccc(Br)c2)CC1(C)C ZINC000623452887 480290421 /nfs/dbraw/zinc/29/04/21/480290421.db2.gz SQSJCJZQCBEDOO-HUUCEWRRSA-N 1 3 341.293 2.945 10 0 EFAEHO NC1(C[NH2+][C@@H]2CCCc3ccc(Br)cc32)CCOCC1 ZINC000629522767 480292764 /nfs/dbraw/zinc/29/27/64/480292764.db2.gz AQTSNWIHDWHOBB-OAHLLOKOSA-N 1 3 339.277 2.924 10 0 EFAEHO C[C@H]([NH2+]CC1(N)CCOCC1)c1ccc(OCC(F)(F)F)cc1 ZINC000629521630 480292792 /nfs/dbraw/zinc/29/27/92/480292792.db2.gz PGWLBSGPWUVIHT-LBPRGKRZSA-N 1 3 332.366 2.786 10 0 EFAEHO NC1(C[NH2+][C@H]2CCc3c2cccc3Br)CCOCC1 ZINC000629523079 480294622 /nfs/dbraw/zinc/29/46/22/480294622.db2.gz FGXIGLLMPQBIEX-AWEZNQCLSA-N 1 3 325.250 2.534 10 0 EFAEHO NC1(C[NH2+][C@H]2CCCc3c(Br)cccc32)CCOCC1 ZINC000629525417 480295203 /nfs/dbraw/zinc/29/52/03/480295203.db2.gz UJNIYVKCZVRROS-HNNXBMFYSA-N 1 3 339.277 2.924 10 0 EFAEHO C[NH2+]CCOCCN[C@@H]1C[C@@H](C)c2c1cccc2Br ZINC000629528730 480296318 /nfs/dbraw/zinc/29/63/18/480296318.db2.gz HWWBJQLBBNEDLU-BXUZGUMPSA-N 1 3 327.266 2.823 10 0 EFAEHO C[NH2+]CCOCCN[C@H]1CCCc2cc(Br)ccc21 ZINC000629530661 480296557 /nfs/dbraw/zinc/29/65/57/480296557.db2.gz MZCXVYPXUGRIHH-HNNXBMFYSA-N 1 3 327.266 2.652 10 0 EFAEHO C[NH2+]CCOCCN[C@@H]1CC(C)(C)c2ccc(Br)cc21 ZINC000629530593 480296720 /nfs/dbraw/zinc/29/67/20/480296720.db2.gz KVXSNGLQQVYJEJ-OAHLLOKOSA-N 1 3 341.293 2.997 10 0 EFAEHO [NH3+]CCCOCCN[C@H]1CCCOc2c(Br)cccc21 ZINC000629538779 480297949 /nfs/dbraw/zinc/29/79/49/480297949.db2.gz NAQZEUYHEGNVOO-AWEZNQCLSA-N 1 3 343.265 2.618 10 0 EFAEHO C[C@H](N)[C@H]1COCC[C@H]1[NH2+]CCc1c[nH]c2cc(F)c(Cl)cc12 ZINC000629544853 480299283 /nfs/dbraw/zinc/29/92/83/480299283.db2.gz JUZOZNRZVRQOGP-OWRWGESLSA-N 1 3 339.842 2.845 10 0 EFAEHO CCOCCN(C[C@H]1CCC2(C[NH2+]C2)O1)[C@@H]1CCc2ccccc21 ZINC000629573313 480314863 /nfs/dbraw/zinc/31/48/63/480314863.db2.gz FBQDSECLLVCPPK-IEBWSBKVSA-N 1 3 330.472 2.533 10 0 EFAEHO CCOCC[N@H+](C[C@H]1CCC2(CNC2)O1)[C@@H]1CCc2ccccc21 ZINC000629573313 480314868 /nfs/dbraw/zinc/31/48/68/480314868.db2.gz FBQDSECLLVCPPK-IEBWSBKVSA-N 1 3 330.472 2.533 10 0 EFAEHO CCOCC[N@@H+](C[C@H]1CCC2(CNC2)O1)[C@@H]1CCc2ccccc21 ZINC000629573313 480314875 /nfs/dbraw/zinc/31/48/75/480314875.db2.gz FBQDSECLLVCPPK-IEBWSBKVSA-N 1 3 330.472 2.533 10 0 EFAEHO O[C@@H](CNCC1(O)CCC(c2ccccc2)CC1)C[NH+]1CCCCC1 ZINC000629582921 480315729 /nfs/dbraw/zinc/31/57/29/480315729.db2.gz JSJGRKMNCDIECT-KBWCOIMZSA-N 1 3 346.515 2.512 10 0 EFAEHO C[N@@H+]1CC[C@@H](N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)CC1(C)C ZINC000623525127 480327464 /nfs/dbraw/zinc/32/74/64/480327464.db2.gz XMXWBMFIQOSMHS-ZIAGYGMSSA-N 1 3 349.441 2.782 10 0 EFAEHO C[N@H+]1CC[C@@H](N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)CC1(C)C ZINC000623525127 480327471 /nfs/dbraw/zinc/32/74/71/480327471.db2.gz XMXWBMFIQOSMHS-ZIAGYGMSSA-N 1 3 349.441 2.782 10 0 EFAEHO CNC(=O)[C@H](CN[C@H]1CC[N@H+](C)C(C)(C)C1)Cc1ccc(F)cc1C ZINC000623556646 480339469 /nfs/dbraw/zinc/33/94/69/480339469.db2.gz QZCNMJJVZQUXLF-WMZOPIPTSA-N 1 3 349.494 2.501 10 0 EFAEHO CNC(=O)[C@H](CN[C@H]1CC[N@@H+](C)C(C)(C)C1)Cc1ccc(F)cc1C ZINC000623556646 480339477 /nfs/dbraw/zinc/33/94/77/480339477.db2.gz QZCNMJJVZQUXLF-WMZOPIPTSA-N 1 3 349.494 2.501 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)NC[C@@H]1CCN1C1CCCC1)C(C)C ZINC000623731821 480427881 /nfs/dbraw/zinc/42/78/81/480427881.db2.gz XBBQBQAFNORIIK-SFHVURJKSA-N 1 3 338.540 2.811 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@H](O)C[C@](C)(O)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000634708804 480449607 /nfs/dbraw/zinc/44/96/07/480449607.db2.gz ZHZRMQGYZFAHNH-OTNPHJDUSA-N 1 3 346.515 2.541 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@H](O)C[C@](C)(O)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000634708804 480449619 /nfs/dbraw/zinc/44/96/19/480449619.db2.gz ZHZRMQGYZFAHNH-OTNPHJDUSA-N 1 3 346.515 2.541 10 0 EFAEHO CC(C)(CNC[C@]1(O)CC[N@H+](Cc2ccccc2)C1)C(F)(F)F ZINC000634713674 480456190 /nfs/dbraw/zinc/45/61/90/480456190.db2.gz ZTCKXSRHYKEDHX-MRXNPFEDSA-N 1 3 330.394 2.802 10 0 EFAEHO CC(C)(CNC[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)C(F)(F)F ZINC000634713674 480456196 /nfs/dbraw/zinc/45/61/96/480456196.db2.gz ZTCKXSRHYKEDHX-MRXNPFEDSA-N 1 3 330.394 2.802 10 0 EFAEHO Cc1ccc(Br)cc1[C@@H](C)[NH2+]CC1(O)CCN(C)CC1 ZINC000623898075 480511066 /nfs/dbraw/zinc/51/10/66/480511066.db2.gz YTVBFQKEVRCTDU-CYBMUJFWSA-N 1 3 341.293 2.865 10 0 EFAEHO CN1CCN(Cc2ccc(N[C@@H]3CC[N@H+](C)C(C)(C)C3)cc2)CC1 ZINC000623931173 480528356 /nfs/dbraw/zinc/52/83/56/480528356.db2.gz MUFGMSJCDQUXCG-LJQANCHMSA-N 1 3 330.520 2.719 10 0 EFAEHO CN1CCN(Cc2ccc(N[C@@H]3CC[N@@H+](C)C(C)(C)C3)cc2)CC1 ZINC000623931173 480528361 /nfs/dbraw/zinc/52/83/61/480528361.db2.gz MUFGMSJCDQUXCG-LJQANCHMSA-N 1 3 330.520 2.719 10 0 EFAEHO C[C@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)[C@@H]1CCCCO1 ZINC000624000610 480560284 /nfs/dbraw/zinc/56/02/84/480560284.db2.gz HIPCJNLLIFIIHN-HKUYNNGSSA-N 1 3 332.488 2.561 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@@H]1CC[C@H](C)[NH2+]C1)c1ccccc1 ZINC000626921463 480581557 /nfs/dbraw/zinc/58/15/57/480581557.db2.gz ATRRWJHIIUGYEV-CGTJXYLNSA-N 1 3 332.492 2.509 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@@H]2CN(c3ccc(Cl)cc3)CCO2)CC[N@@H+]1C ZINC000624118861 480617813 /nfs/dbraw/zinc/61/78/13/480617813.db2.gz QNZCXGRFNNPDSK-QGPMSJSTSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@@H]2CN(c3ccc(Cl)cc3)CCO2)CC[N@H+]1C ZINC000624118861 480617820 /nfs/dbraw/zinc/61/78/20/480617820.db2.gz QNZCXGRFNNPDSK-QGPMSJSTSA-N 1 3 337.895 2.618 10 0 EFAEHO c1cc(C[NH2+]CCCCN2CCN(Cc3ccccc3)CC2)sn1 ZINC000638381183 480697152 /nfs/dbraw/zinc/69/71/52/480697152.db2.gz JOSPTJSMEHHPDR-UHFFFAOYSA-N 1 3 344.528 2.831 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NCC(C)(C)N2CCCCC2)CC1 ZINC000632836163 480745497 /nfs/dbraw/zinc/74/54/97/480745497.db2.gz GAOHBTJESDVOSJ-UHFFFAOYSA-N 1 3 338.540 2.767 10 0 EFAEHO C[NH+](C)[C@@H]1C[C@H](NC(=O)C2CCN(Cc3ccccc3)CC2)C1(C)C ZINC000636088803 480788945 /nfs/dbraw/zinc/78/89/45/480788945.db2.gz IOCYBDMGCITVCD-RBUKOAKNSA-N 1 3 343.515 2.744 10 0 EFAEHO CC[C@H]1CCCCN1CCNC(=O)N1CCC(CC)([NH+](C)C)CC1 ZINC000633006368 480844506 /nfs/dbraw/zinc/84/45/06/480844506.db2.gz SUOUDEBWALMHNB-KRWDZBQOSA-N 1 3 338.540 2.767 10 0 EFAEHO c1cc(CNCCc2ccc(OCC[NH+]3CCCC3)cc2)sn1 ZINC000638833159 480889186 /nfs/dbraw/zinc/88/91/86/480889186.db2.gz WDMKNOFGMVIVPN-UHFFFAOYSA-N 1 3 331.485 2.950 10 0 EFAEHO CN(C)CCc1ccccc1NC(=O)N[C@H]1CC[NH2+]C12CCCC2 ZINC000647476054 480956870 /nfs/dbraw/zinc/95/68/70/480956870.db2.gz NBNBFDPBVYGPQE-KRWDZBQOSA-N 1 3 330.476 2.587 10 0 EFAEHO CN(C)CCOc1ccc(CN2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)cc1 ZINC000647480221 480959812 /nfs/dbraw/zinc/95/98/12/480959812.db2.gz HESWIQJEFHFXOH-QUCCMNQESA-N 1 3 331.504 2.591 10 0 EFAEHO C[C@@H](NC(C)(C)CNC(=O)COC1CCC([NH3+])CC1)c1ccccc1 ZINC000645927568 480971144 /nfs/dbraw/zinc/97/11/44/480971144.db2.gz TUBITCUAIGXPOK-FAEJEUNOSA-N 1 3 347.503 2.519 10 0 EFAEHO CCN(C(=O)N[C@H]1CC[N@@H+](C2CCCCC2)C1)[C@H]1CCN(CC)C1 ZINC000666659776 481016087 /nfs/dbraw/zinc/01/60/87/481016087.db2.gz ZVNFYXSGYIYLIT-WMZOPIPTSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN(C(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1)[C@H]1CCN(CC)C1 ZINC000666659776 481016094 /nfs/dbraw/zinc/01/60/94/481016094.db2.gz ZVNFYXSGYIYLIT-WMZOPIPTSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1nc(C2CCCC2)ns1 ZINC000664197044 481081218 /nfs/dbraw/zinc/08/12/18/481081218.db2.gz YFEPDLNBGFFJFK-ZDUSSCGKSA-N 1 3 325.526 2.880 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1nc(C2CCCC2)ns1 ZINC000664197044 481081222 /nfs/dbraw/zinc/08/12/22/481081222.db2.gz YFEPDLNBGFFJFK-ZDUSSCGKSA-N 1 3 325.526 2.880 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)[C@H]1CC[C@H](C2CC2)[NH2+]1)c1ccsc1 ZINC000653109980 481085330 /nfs/dbraw/zinc/08/53/30/481085330.db2.gz UCBDQIOBMWLUIU-BRWVUGGUSA-N 1 3 335.517 2.778 10 0 EFAEHO c1csc(-c2noc(CCC[N@H+](C3CC3)C3CCNCC3)n2)c1 ZINC000647814319 481120335 /nfs/dbraw/zinc/12/03/35/481120335.db2.gz INKHRYMUYZJMEJ-UHFFFAOYSA-N 1 3 332.473 2.947 10 0 EFAEHO c1csc(-c2noc(CCC[N@@H+](C3CC3)C3CCNCC3)n2)c1 ZINC000647814319 481120342 /nfs/dbraw/zinc/12/03/42/481120342.db2.gz INKHRYMUYZJMEJ-UHFFFAOYSA-N 1 3 332.473 2.947 10 0 EFAEHO CO[C@@]1(C[NH2+]C[C@H]2CN(Cc3ccccc3)CC23CCC3)CCOC1 ZINC000639328301 481130079 /nfs/dbraw/zinc/13/00/79/481130079.db2.gz GPWMJYWNQDGRTN-PZJWPPBQSA-N 1 3 344.499 2.684 10 0 EFAEHO Cc1cc2cc[nH]c2cc1NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000666829085 481132232 /nfs/dbraw/zinc/13/22/32/481132232.db2.gz JESGKNVYIWSXRN-HNNXBMFYSA-N 1 3 345.491 2.870 10 0 EFAEHO Cc1cc2cc[nH]c2cc1NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000666829085 481132240 /nfs/dbraw/zinc/13/22/40/481132240.db2.gz JESGKNVYIWSXRN-HNNXBMFYSA-N 1 3 345.491 2.870 10 0 EFAEHO CCN(C(=O)NCCC[NH+](C(C)C)C(C)C)[C@@H]1CCN(CC)C1 ZINC000664286001 481149332 /nfs/dbraw/zinc/14/93/32/481149332.db2.gz KEWCVDAFLFZRTN-QGZVFWFLSA-N 1 3 326.529 2.621 10 0 EFAEHO COc1cc(CCC2CCN(C[C@H]3CC[NH2+]C3)CC2)cc(OC)c1 ZINC000647874157 481150190 /nfs/dbraw/zinc/15/01/90/481150190.db2.gz AGMTWJLBLJCHNT-SFHVURJKSA-N 1 3 332.488 2.958 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1nc2ccccc2s1 ZINC000664314116 481169732 /nfs/dbraw/zinc/16/97/32/481169732.db2.gz GJNRRMILESGXJB-ZDUSSCGKSA-N 1 3 349.504 2.690 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1nc2ccccc2s1 ZINC000664314116 481169742 /nfs/dbraw/zinc/16/97/42/481169742.db2.gz GJNRRMILESGXJB-ZDUSSCGKSA-N 1 3 349.504 2.690 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccc(F)c(Cl)c1 ZINC000664313742 481169823 /nfs/dbraw/zinc/16/98/23/481169823.db2.gz CGCJSEYWEKJISL-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccc(F)c(Cl)c1 ZINC000664313742 481169829 /nfs/dbraw/zinc/16/98/29/481169829.db2.gz CGCJSEYWEKJISL-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO C[C@]1(CNC(=O)N2CCC(C)([NH3+])CC2)CCCN1Cc1ccccc1 ZINC000669565850 481214362 /nfs/dbraw/zinc/21/43/62/481214362.db2.gz MVIAAKSIKXQVBT-HXUWFJFHSA-N 1 3 344.503 2.564 10 0 EFAEHO COc1cc(Br)ccc1CN[C@H]1CC12CC[NH2+]CC2 ZINC000666952345 481216408 /nfs/dbraw/zinc/21/64/08/481216408.db2.gz SDVUZBWOQZWRCY-AWEZNQCLSA-N 1 3 325.250 2.689 10 0 EFAEHO CCN(Cc1ccccc1)C(=O)CN1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647974872 481224836 /nfs/dbraw/zinc/22/48/36/481224836.db2.gz ABXGVNDOGJIPCF-PMACEKPBSA-N 1 3 343.515 2.747 10 0 EFAEHO NCC(=O)N1CCC[C@H](C[NH2+]C2(c3ccccc3Cl)CCC2)C1 ZINC000650704093 481271182 /nfs/dbraw/zinc/27/11/82/481271182.db2.gz HCGGSLDPTLHWJL-CQSZACIVSA-N 1 3 335.879 2.506 10 0 EFAEHO [NH3+][C@@H]1CCO[C@H]([C@H]2CCCN(Cc3ccnn3-c3ccccc3)C2)C1 ZINC000650707723 481277424 /nfs/dbraw/zinc/27/74/24/481277424.db2.gz LVBMIQDRCWWKQY-QKLQHJQFSA-N 1 3 340.471 2.591 10 0 EFAEHO CN(C)CCOc1ccc(C[NH2+][C@@H]2CNc3ccccc3C2)cc1 ZINC000650716959 481284756 /nfs/dbraw/zinc/28/47/56/481284756.db2.gz OCWKXWUPZUAFBK-SFHVURJKSA-N 1 3 325.456 2.753 10 0 EFAEHO CCOc1cc(CN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)ccc1OC ZINC000650722610 481288987 /nfs/dbraw/zinc/28/89/87/481288987.db2.gz XVHKYALLGJKUOH-YQVWRLOYSA-N 1 3 348.487 2.955 10 0 EFAEHO CC[C@H](OCCN[C@@H]1CCOC[C@H]1[C@@H]1CCC[NH2+]1)c1ccccc1 ZINC000650742453 481309588 /nfs/dbraw/zinc/30/95/88/481309588.db2.gz YLDGIICPQDFWBT-HAGHYFMRSA-N 1 3 332.488 2.901 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000664539157 481316860 /nfs/dbraw/zinc/31/68/60/481316860.db2.gz CXBHWWUYYUCQOU-ROUUACIJSA-N 1 3 346.519 2.851 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000664539157 481316868 /nfs/dbraw/zinc/31/68/68/481316868.db2.gz CXBHWWUYYUCQOU-ROUUACIJSA-N 1 3 346.519 2.851 10 0 EFAEHO CCN(C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)[C@H]1CC[N@H+](CC)C1 ZINC000664542174 481320607 /nfs/dbraw/zinc/32/06/07/481320607.db2.gz UDUKOLNGYKSBMR-OTWHNJEPSA-N 1 3 344.503 2.558 10 0 EFAEHO CCN(C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)[C@H]1CC[N@@H+](CC)C1 ZINC000664542174 481320612 /nfs/dbraw/zinc/32/06/12/481320612.db2.gz UDUKOLNGYKSBMR-OTWHNJEPSA-N 1 3 344.503 2.558 10 0 EFAEHO CCN(C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)[C@H]1CC[N@H+](CC)C1 ZINC000664542172 481321594 /nfs/dbraw/zinc/32/15/94/481321594.db2.gz UDUKOLNGYKSBMR-GBESFXJTSA-N 1 3 344.503 2.558 10 0 EFAEHO CCN(C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)[C@H]1CC[N@@H+](CC)C1 ZINC000664542172 481321602 /nfs/dbraw/zinc/32/16/02/481321602.db2.gz UDUKOLNGYKSBMR-GBESFXJTSA-N 1 3 344.503 2.558 10 0 EFAEHO C[C@H]([NH3+])c1ccc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2)cc1 ZINC000659364165 481385114 /nfs/dbraw/zinc/38/51/14/481385114.db2.gz ISVVQFWGWQBJNT-UGSOOPFHSA-N 1 3 325.412 2.620 10 0 EFAEHO c1ccc(OCCOCCN2CCCN(c3cc[nH+]cc3)CC2)cc1 ZINC000639682039 481422927 /nfs/dbraw/zinc/42/29/27/481422927.db2.gz ITYLQVWFNUIYDF-UHFFFAOYSA-N 1 3 341.455 2.689 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)NCC[C@@H]([NH3+])C(C)C)c1ccsc1 ZINC000659433371 481432298 /nfs/dbraw/zinc/43/22/98/481432298.db2.gz BWFCPYZAZKGDPN-CVEARBPZSA-N 1 3 340.537 2.804 10 0 EFAEHO CCN(C(=O)NCC[NH2+]C1CC1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000637297647 481437592 /nfs/dbraw/zinc/43/75/92/481437592.db2.gz PXMDJOZKHIZGDM-QFBILLFUSA-N 1 3 344.503 2.605 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000659465730 481451869 /nfs/dbraw/zinc/45/18/69/481451869.db2.gz RHBIFPYNAPELJY-BHIYHBOVSA-N 1 3 346.519 2.712 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000659483657 481463978 /nfs/dbraw/zinc/46/39/78/481463978.db2.gz DCBDEGBKMJZSJK-UYAOXDASSA-N 1 3 346.519 2.714 10 0 EFAEHO C[C@]1(CNC(=O)NCC2([NH3+])CCCC2)CCCN1Cc1ccccc1 ZINC000659484446 481464012 /nfs/dbraw/zinc/46/40/12/481464012.db2.gz UVANUPDEUTXUST-LJQANCHMSA-N 1 3 344.503 2.612 10 0 EFAEHO [NH3+]C[C@@H]1CCC[C@H]1NCc1ccc(N2CCc3ccccc3C2)nc1 ZINC000643472041 481484519 /nfs/dbraw/zinc/48/45/19/481484519.db2.gz LDIAPYGPFLLAGL-AZUAARDMSA-N 1 3 336.483 2.861 10 0 EFAEHO C[C@@H](N[C@H]1CC12CC[NH2+]CC2)c1ccc(-n2cncn2)cc1Cl ZINC000643534824 481497591 /nfs/dbraw/zinc/49/75/91/481497591.db2.gz DFYUIPSQTYFANJ-WBMJQRKESA-N 1 3 331.851 2.713 10 0 EFAEHO CCCN(CCN1CCCCCC1)C(=O)NCC[C@@H]([NH3+])C(C)C ZINC000659620967 481518726 /nfs/dbraw/zinc/51/87/26/481518726.db2.gz RITABNGEMQKOMN-QGZVFWFLSA-N 1 3 326.529 2.657 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000659622804 481519564 /nfs/dbraw/zinc/51/95/64/481519564.db2.gz WMZBWBKMAGYOKW-LJQANCHMSA-N 1 3 346.519 2.666 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N(CCN(C)C)CC1CCCCC1 ZINC000659624846 481520454 /nfs/dbraw/zinc/52/04/54/481520454.db2.gz YSGLJTJEWVQEDR-QGZVFWFLSA-N 1 3 326.529 2.513 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NC(C1CCC1)C1CCC1 ZINC000664888323 481544509 /nfs/dbraw/zinc/54/45/09/481544509.db2.gz LCBMOWVKGIYDIC-HNNXBMFYSA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NC(C1CCC1)C1CCC1 ZINC000664888323 481544516 /nfs/dbraw/zinc/54/45/16/481544516.db2.gz LCBMOWVKGIYDIC-HNNXBMFYSA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)N1CCC[C@@H]1CN1CCCCC1 ZINC000651192166 481615383 /nfs/dbraw/zinc/61/53/83/481615383.db2.gz DBAOODBZHLRGGV-GOSISDBHSA-N 1 3 338.540 2.624 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)N1CCC[C@@H]1CN1CCCCC1 ZINC000651192166 481615386 /nfs/dbraw/zinc/61/53/86/481615386.db2.gz DBAOODBZHLRGGV-GOSISDBHSA-N 1 3 338.540 2.624 10 0 EFAEHO Cc1ccc(CCN(C[C@H]2CCCO2)C[C@@H]2CCC3(C[NH2+]C3)O2)cc1 ZINC000662258661 481672242 /nfs/dbraw/zinc/67/22/42/481672242.db2.gz YTMNMCMPTGDLMI-UXHICEINSA-N 1 3 344.499 2.540 10 0 EFAEHO CN(Cc1cccc(OC(F)(F)F)c1)C[C@H]1CCC2(C[NH2+]C2)O1 ZINC000662259131 481672378 /nfs/dbraw/zinc/67/23/78/481672378.db2.gz QPBYHGQZJQGAOG-CQSZACIVSA-N 1 3 330.350 2.538 10 0 EFAEHO CC(C)C[N@H+](C[C@@H]1CCC2(CNC2)O1)[C@H]1CCCc2cccnc21 ZINC000662281413 481688277 /nfs/dbraw/zinc/68/82/77/481688277.db2.gz WRNFHWZTOLRVGC-ROUUACIJSA-N 1 3 329.488 2.938 10 0 EFAEHO CC(C)C[N@@H+](C[C@@H]1CCC2(CNC2)O1)[C@H]1CCCc2cccnc21 ZINC000662281413 481688288 /nfs/dbraw/zinc/68/82/88/481688288.db2.gz WRNFHWZTOLRVGC-ROUUACIJSA-N 1 3 329.488 2.938 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NCc2ccccc2CN2CCCCC2)CC[N@@H+]1C ZINC000648720343 481693508 /nfs/dbraw/zinc/69/35/08/481693508.db2.gz KJMPGRSOPGPEFK-VQIMIIECSA-N 1 3 329.488 2.629 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NCc2ccccc2CN2CCCCC2)CC[N@H+]1C ZINC000648720343 481693517 /nfs/dbraw/zinc/69/35/17/481693517.db2.gz KJMPGRSOPGPEFK-VQIMIIECSA-N 1 3 329.488 2.629 10 0 EFAEHO CCO[C@H](CC[NH+](C)C)CNCc1cnn(-c2ccccc2C)c1 ZINC000647190721 481694490 /nfs/dbraw/zinc/69/44/90/481694490.db2.gz MAQDUHCCQTWQLM-GOSISDBHSA-N 1 3 330.476 2.627 10 0 EFAEHO c1cc(C[NH2+]CC2CCN(c3ccncc3)CC2)n(-c2ccccn2)n1 ZINC000647198483 481699348 /nfs/dbraw/zinc/69/93/48/481699348.db2.gz HWMARVMAUJEJOP-UHFFFAOYSA-N 1 3 348.454 2.669 10 0 EFAEHO C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662295409 481700930 /nfs/dbraw/zinc/70/09/30/481700930.db2.gz QZKGRMNYBRHVTL-VQIMIIECSA-N 1 3 341.499 2.676 10 0 EFAEHO O=C1[C@@H](N2CCC[C@@H](C3CC[NH2+]CC3)C2)CCCN1c1ccccc1 ZINC000662294630 481701364 /nfs/dbraw/zinc/70/13/64/481701364.db2.gz CYGMGGCVVMCILE-QUCCMNQESA-N 1 3 341.499 2.894 10 0 EFAEHO COc1ccc([C@@H](NC[C@H]2CCC3(C[NH2+]C3)O2)c2ccccc2)cc1 ZINC000662299626 481705354 /nfs/dbraw/zinc/70/53/54/481705354.db2.gz SPVBKNQCIHQQOP-UXHICEINSA-N 1 3 338.451 2.895 10 0 EFAEHO CN1C[C@@H](C[NH2+]Cc2ccnn2-c2ccccn2)[C@H](c2ccccc2)C1 ZINC000647249281 481727001 /nfs/dbraw/zinc/72/70/01/481727001.db2.gz PLJIZDPAMZPFJS-QUCCMNQESA-N 1 3 347.466 2.702 10 0 EFAEHO CCN(C(=O)NCCC[N@H+](CC)C1CCCCC1)[C@H]1CCN(C)C1 ZINC000665219050 481727542 /nfs/dbraw/zinc/72/75/42/481727542.db2.gz JTTULWPTWPURCD-SFHVURJKSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN(C(=O)NCCC[N@@H+](CC)C1CCCCC1)[C@H]1CCN(C)C1 ZINC000665219050 481727548 /nfs/dbraw/zinc/72/75/48/481727548.db2.gz JTTULWPTWPURCD-SFHVURJKSA-N 1 3 338.540 2.767 10 0 EFAEHO c1ccc2c(CCN[C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)ccnc2c1 ZINC000665239094 481737813 /nfs/dbraw/zinc/73/78/13/481737813.db2.gz LXJMEURHKMSGLY-YZGWKJHDSA-N 1 3 325.456 2.524 10 0 EFAEHO c1ccc2c(CCN[C@@H]3CCOC[C@H]3[C@@H]3CCC[NH2+]3)nsc2c1 ZINC000665276671 481764744 /nfs/dbraw/zinc/76/47/44/481764744.db2.gz JZPSYDIQJGCVCA-HRCADAONSA-N 1 3 331.485 2.586 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(N[C@@H](C)c2ccc(F)cc2F)CC1 ZINC000665285511 481769888 /nfs/dbraw/zinc/76/98/88/481769888.db2.gz OQUSRFMITLGIEL-ZDUSSCGKSA-N 1 3 339.430 2.606 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(N[C@H](C)c2cccc(F)c2F)CC1 ZINC000665287274 481772507 /nfs/dbraw/zinc/77/25/07/481772507.db2.gz HCSUPRJKXCNQQA-CYBMUJFWSA-N 1 3 339.430 2.606 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)c1ccc2c(c1)[C@@H](C[NH3+])CCC2 ZINC000662387939 481777984 /nfs/dbraw/zinc/77/79/84/481777984.db2.gz NJBSESSTOXTAQX-CRAIPNDOSA-N 1 3 329.488 2.669 10 0 EFAEHO CO[C@H](CN(C)CC[N@H+](C)C1CCN(C)CC1)C1CCCCC1 ZINC000660139660 481783308 /nfs/dbraw/zinc/78/33/08/481783308.db2.gz YLZQXSULYWYQNY-LJQANCHMSA-N 1 3 325.541 2.540 10 0 EFAEHO CO[C@H](CN(C)CC[N@@H+](C)C1CCN(C)CC1)C1CCCCC1 ZINC000660139660 481783314 /nfs/dbraw/zinc/78/33/14/481783314.db2.gz YLZQXSULYWYQNY-LJQANCHMSA-N 1 3 325.541 2.540 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)C[C@H]2NCc3ccccc32)c1 ZINC000662404039 481787786 /nfs/dbraw/zinc/78/77/86/481787786.db2.gz BDMULYXCPRAZFZ-HXUWFJFHSA-N 1 3 337.467 2.989 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)C[C@H]2NCc3ccccc32)c1 ZINC000662404039 481787795 /nfs/dbraw/zinc/78/77/95/481787795.db2.gz BDMULYXCPRAZFZ-HXUWFJFHSA-N 1 3 337.467 2.989 10 0 EFAEHO CO[C@@H](C[N@H+](C)CCC1CCN(c2ccncc2)CC1)[C@@H]1CCOC1 ZINC000660165016 481796703 /nfs/dbraw/zinc/79/67/03/481796703.db2.gz BFNOKJYADFQKEG-QUCCMNQESA-N 1 3 347.503 2.671 10 0 EFAEHO CO[C@@H](C[N@@H+](C)CCC1CCN(c2ccncc2)CC1)[C@@H]1CCOC1 ZINC000660165016 481796709 /nfs/dbraw/zinc/79/67/09/481796709.db2.gz BFNOKJYADFQKEG-QUCCMNQESA-N 1 3 347.503 2.671 10 0 EFAEHO O=C(C[C@@H]1NCc2ccccc21)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000662505927 481848640 /nfs/dbraw/zinc/84/86/40/481848640.db2.gz VSQHDMSTBCXMKY-FFZOFVMBSA-N 1 3 339.483 2.696 10 0 EFAEHO O=C(C[C@@H]1NCc2ccccc21)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000662505927 481848649 /nfs/dbraw/zinc/84/86/49/481848649.db2.gz VSQHDMSTBCXMKY-FFZOFVMBSA-N 1 3 339.483 2.696 10 0 EFAEHO c1cc(OCC[NH+]2CCCC2)ccc1CN[C@H]1CO[C@@H](C2CC2)C1 ZINC000667866448 481858998 /nfs/dbraw/zinc/85/89/98/481858998.db2.gz AXBDGKKYBPWGMT-UYAOXDASSA-N 1 3 330.472 2.818 10 0 EFAEHO C[C@@H](NC(C)(C)CNC(=O)NC[C@H]1C[C@@H]([NH+](C)C)C1)c1ccccc1 ZINC000654442615 481874133 /nfs/dbraw/zinc/87/41/33/481874133.db2.gz OBXWOBKBUKXKFJ-NUJGCVRESA-N 1 3 346.519 2.755 10 0 EFAEHO Cc1nc2ccc(NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc2o1 ZINC000665451054 481875848 /nfs/dbraw/zinc/87/58/48/481875848.db2.gz FLSHQNLHYVUREL-ZDUSSCGKSA-N 1 3 347.463 2.530 10 0 EFAEHO Cc1nc2ccc(NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc2o1 ZINC000665451054 481875849 /nfs/dbraw/zinc/87/58/49/481875849.db2.gz FLSHQNLHYVUREL-ZDUSSCGKSA-N 1 3 347.463 2.530 10 0 EFAEHO C[C@@H](NCC1(O)CC[NH+](C)CC1)c1ccc(-c2ccccc2)cn1 ZINC000651720492 481918804 /nfs/dbraw/zinc/91/88/04/481918804.db2.gz AEZRMLYVMOHNJG-MRXNPFEDSA-N 1 3 325.456 2.856 10 0 EFAEHO O=C(NC[C@@H](c1ccccc1)N1CCCC1)C1([NH2+]C2CC2)CCC1 ZINC000662666404 481923353 /nfs/dbraw/zinc/92/33/53/481923353.db2.gz RTOANQIONXPCKS-SFHVURJKSA-N 1 3 327.472 2.614 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)C1(N)CC2(CCC2)C1)Cc1ccccc1 ZINC000662680276 481930053 /nfs/dbraw/zinc/93/00/53/481930053.db2.gz UHUAKFSMFDZHSH-SFHVURJKSA-N 1 3 343.515 2.717 10 0 EFAEHO C[NH+](C)Cc1cccc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)c1 ZINC000662686463 481933385 /nfs/dbraw/zinc/93/33/85/481933385.db2.gz FZISGCNXDSRIOP-LJQANCHMSA-N 1 3 339.439 2.661 10 0 EFAEHO N[C@@H](C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)C1CCC1 ZINC000662716118 481946954 /nfs/dbraw/zinc/94/69/54/481946954.db2.gz QUTPQDCXYKAZEK-RBUKOAKNSA-N 1 3 341.499 2.532 10 0 EFAEHO N[C@@H](C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)C1CCC1 ZINC000662716118 481946958 /nfs/dbraw/zinc/94/69/58/481946958.db2.gz QUTPQDCXYKAZEK-RBUKOAKNSA-N 1 3 341.499 2.532 10 0 EFAEHO C[NH2+][C@@H](C)C(=O)N1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000662755172 481960060 /nfs/dbraw/zinc/96/00/60/481960060.db2.gz CICDLKIDWKEFMU-QFBILLFUSA-N 1 3 343.515 2.744 10 0 EFAEHO CC[C@H](N)C(=O)N1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000662759555 481961536 /nfs/dbraw/zinc/96/15/36/481961536.db2.gz SZRYBQIOJSBOPC-OALUTQOASA-N 1 3 343.515 2.873 10 0 EFAEHO CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)C1(NC2CC2)CCC1 ZINC000662788667 481970216 /nfs/dbraw/zinc/97/02/16/481970216.db2.gz NMUINAKLTAUVLZ-UHFFFAOYSA-N 1 3 329.488 2.771 10 0 EFAEHO CN(CC[N@H+](C)C1CCCCC1)C(=O)C[C@H]1NCc2ccccc21 ZINC000662788705 481970309 /nfs/dbraw/zinc/97/03/09/481970309.db2.gz REAJTMIQKMHTFR-LJQANCHMSA-N 1 3 329.488 2.944 10 0 EFAEHO CN(CC[N@@H+](C)C1CCCCC1)C(=O)C[C@H]1NCc2ccccc21 ZINC000662788705 481970313 /nfs/dbraw/zinc/97/03/13/481970313.db2.gz REAJTMIQKMHTFR-LJQANCHMSA-N 1 3 329.488 2.944 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1C[C@H](C)c2ccccc21 ZINC000665638740 481973927 /nfs/dbraw/zinc/97/39/27/481973927.db2.gz AHYRDJBFXVPLEE-HOTGVXAUSA-N 1 3 332.492 2.592 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1C[C@H](C)c2ccccc21 ZINC000665638740 481973930 /nfs/dbraw/zinc/97/39/30/481973930.db2.gz AHYRDJBFXVPLEE-HOTGVXAUSA-N 1 3 332.492 2.592 10 0 EFAEHO C[C@@H](NC(=O)C1(NC2CC2)CCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000662805334 481978299 /nfs/dbraw/zinc/97/82/99/481978299.db2.gz WOPDBSQXEYKRQW-SJLPKXTDSA-N 1 3 341.499 2.688 10 0 EFAEHO C[C@@H](NC(=O)C1(NC2CC2)CCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000662805334 481978304 /nfs/dbraw/zinc/97/83/04/481978304.db2.gz WOPDBSQXEYKRQW-SJLPKXTDSA-N 1 3 341.499 2.688 10 0 EFAEHO C[C@@H](C(=O)N[C@@H]1C[NH2+]CC[C@@H]1c1ccccc1)N1CCCCCC1 ZINC000662866500 481998901 /nfs/dbraw/zinc/99/89/01/481998901.db2.gz BVYZNWQHLRXDQL-QXAKKESOSA-N 1 3 329.488 2.513 10 0 EFAEHO CN(C)CCOc1ccc(C[NH2+][C@@H](C2CC2)C2CCOCC2)cc1 ZINC000651927188 482004572 /nfs/dbraw/zinc/00/45/72/482004572.db2.gz DCLNYMZCFRNLKL-FQEVSTJZSA-N 1 3 332.488 2.922 10 0 EFAEHO CC(C)[C@@H](C(=O)Nc1ccc([C@H]2CNCCO2)cc1)[NH+]1CCCCC1 ZINC000662884833 482005451 /nfs/dbraw/zinc/00/54/51/482005451.db2.gz PRLOEPKPQFFDMC-MOPGFXCFSA-N 1 3 345.487 2.797 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1C[C@H](C)[C@H]1c1ccccc1 ZINC000665759269 482038098 /nfs/dbraw/zinc/03/80/98/482038098.db2.gz BFLLVZVPTQWTLN-LNLFQRSKSA-N 1 3 346.519 2.661 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1C[C@H](C)[C@H]1c1ccccc1 ZINC000665759269 482038104 /nfs/dbraw/zinc/03/81/04/482038104.db2.gz BFLLVZVPTQWTLN-LNLFQRSKSA-N 1 3 346.519 2.661 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N(C1CC1)C1CCCCC1 ZINC000665760978 482038630 /nfs/dbraw/zinc/03/86/30/482038630.db2.gz UBXAJLYTICHXIG-INIZCTEOSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N(C1CC1)C1CCCCC1 ZINC000665760978 482038636 /nfs/dbraw/zinc/03/86/36/482038636.db2.gz UBXAJLYTICHXIG-INIZCTEOSA-N 1 3 338.540 2.765 10 0 EFAEHO C[NH2+]Cc1ccccc1CNC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000652118007 482082524 /nfs/dbraw/zinc/08/25/24/482082524.db2.gz KGETUHZFVMROBC-LJQANCHMSA-N 1 3 340.471 2.508 10 0 EFAEHO Cc1ccc(CCC[NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)cn1 ZINC000668490239 482142680 /nfs/dbraw/zinc/14/26/80/482142680.db2.gz SZFFIBLCCISWKS-NRFANRHFSA-N 1 3 339.483 2.679 10 0 EFAEHO Cc1ccccc1C1(NCC(=O)NC2CC[NH+](C(C)C)CC2)CCC1 ZINC000649645180 482166630 /nfs/dbraw/zinc/16/66/30/482166630.db2.gz IHQCIFLQQNNEBR-UHFFFAOYSA-N 1 3 343.515 2.953 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2C[C@H]3COC[C@]3(C)C2)CC1 ZINC000668595810 482182662 /nfs/dbraw/zinc/18/26/62/482182662.db2.gz AMSDXNIVCWSQHH-FPOVZHCZSA-N 1 3 343.515 2.687 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2C[C@H]3COC[C@]3(C)C2)CC1 ZINC000668595810 482182666 /nfs/dbraw/zinc/18/26/66/482182666.db2.gz AMSDXNIVCWSQHH-FPOVZHCZSA-N 1 3 343.515 2.687 10 0 EFAEHO CCOCC[C@H](O)C[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000663368837 482186088 /nfs/dbraw/zinc/18/60/88/482186088.db2.gz PCVAOBIUQSMNDG-PMACEKPBSA-N 1 3 346.515 2.666 10 0 EFAEHO O[C@@H](C[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCC2)C(F)(F)F ZINC000663369013 482186536 /nfs/dbraw/zinc/18/65/36/482186536.db2.gz UZRAMESJLOZIQX-CVEARBPZSA-N 1 3 342.405 2.802 10 0 EFAEHO CCOCC[C@H](O)C[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000663368838 482186584 /nfs/dbraw/zinc/18/65/84/482186584.db2.gz PCVAOBIUQSMNDG-UXHICEINSA-N 1 3 346.515 2.666 10 0 EFAEHO CCOc1ccc(OCCN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)cc1 ZINC000652360903 482193211 /nfs/dbraw/zinc/19/32/11/482193211.db2.gz TUIJGUVWIHAEMO-DBVUQKKJSA-N 1 3 348.487 2.825 10 0 EFAEHO CC[NH+](CC)CCCN1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21 ZINC000649751333 482228693 /nfs/dbraw/zinc/22/86/93/482228693.db2.gz ITTOFRSHEGUVCU-NHCUHLMSSA-N 1 3 345.531 2.694 10 0 EFAEHO C[C@@H](CCNC(=O)NCc1ccccc1CN1CCCCC1)[NH+](C)C ZINC000663517667 482276562 /nfs/dbraw/zinc/27/65/62/482276562.db2.gz HELFDRCKQMZJNR-KRWDZBQOSA-N 1 3 346.519 2.812 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N[C@H](c1ccccc1)C1CC1 ZINC000663535919 482286894 /nfs/dbraw/zinc/28/68/94/482286894.db2.gz CSUROULHZSBXIP-QFBILLFUSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N[C@H](c1ccccc1)C1CC1 ZINC000663535919 482286897 /nfs/dbraw/zinc/28/68/97/482286897.db2.gz CSUROULHZSBXIP-QFBILLFUSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@@H]([NH3+])[C@H]1CCN(C(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000668860277 482298891 /nfs/dbraw/zinc/29/88/91/482298891.db2.gz HOZVKNOMXSCFNY-AEFFLSMTSA-N 1 3 344.503 2.551 10 0 EFAEHO C[C@H]([NH3+])[C@H]1CCN(C(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000668860280 482298903 /nfs/dbraw/zinc/29/89/03/482298903.db2.gz HOZVKNOMXSCFNY-WMZOPIPTSA-N 1 3 344.503 2.551 10 0 EFAEHO CCN(C(=O)NCCCC[N@@H+]1CCCC[C@@H]1C)[C@H]1CCN(CC)C1 ZINC000663653720 482331537 /nfs/dbraw/zinc/33/15/37/482331537.db2.gz CCSXOPIWNKNVMS-ROUUACIJSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN(C(=O)NCCCC[N@H+]1CCCC[C@@H]1C)[C@H]1CCN(CC)C1 ZINC000663653720 482331542 /nfs/dbraw/zinc/33/15/42/482331542.db2.gz CCSXOPIWNKNVMS-ROUUACIJSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[N@@H+]1CCC[C@@H](C)C1)[C@@H]1CCN(CC)C1 ZINC000663787016 482389496 /nfs/dbraw/zinc/38/94/96/482389496.db2.gz FIYLRMWPEUBEKL-IAGOWNOFSA-N 1 3 338.540 2.623 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1)[C@@H]1CCN(CC)C1 ZINC000663787016 482389498 /nfs/dbraw/zinc/38/94/98/482389498.db2.gz FIYLRMWPEUBEKL-IAGOWNOFSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)C1CCN(Cc2ccccc2)CC1 ZINC000650178161 482414027 /nfs/dbraw/zinc/41/40/27/482414027.db2.gz DFKSRHUGJRIVIO-UHFFFAOYSA-N 1 3 345.531 2.993 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)C1CCN(Cc2ccccc2)CC1 ZINC000650178161 482414030 /nfs/dbraw/zinc/41/40/30/482414030.db2.gz DFKSRHUGJRIVIO-UHFFFAOYSA-N 1 3 345.531 2.993 10 0 EFAEHO C[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1oc2ccccc2c1CN(C)C ZINC000174849937 534000155 /nfs/dbraw/zinc/00/01/55/534000155.db2.gz HEVCCZDIFUYLNP-LSDHHAIUSA-N 1 3 341.455 2.803 10 0 EFAEHO C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1oc2ccccc2c1CN(C)C ZINC000174849937 534000159 /nfs/dbraw/zinc/00/01/59/534000159.db2.gz HEVCCZDIFUYLNP-LSDHHAIUSA-N 1 3 341.455 2.803 10 0 EFAEHO C[C@H](O)C[NH+]1CCC(CN(C)Cc2ccc(Br)o2)CC1 ZINC000191338098 534076739 /nfs/dbraw/zinc/07/67/39/534076739.db2.gz WDYGYHCRLVRGDS-LBPRGKRZSA-N 1 3 345.281 2.567 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1[C@H]1CCCN(C(=O)CCN(C)c2ccncc2)C1 ZINC000541857505 518179681 /nfs/dbraw/zinc/17/96/81/518179681.db2.gz KXYDUDMUUROVCL-LMMKCTJWSA-N 1 3 344.503 2.772 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000079077028 519337382 /nfs/dbraw/zinc/33/73/82/519337382.db2.gz NZRSZGWOPKYADI-CQSZACIVSA-N 1 3 326.529 2.571 10 0 EFAEHO CC(C)Cc1ncc(CN(C)CC2CC[NH+](C[C@@H](C)O)CC2)s1 ZINC000179518362 519460796 /nfs/dbraw/zinc/46/07/96/519460796.db2.gz NWVHVIUXCANQQT-OAHLLOKOSA-N 1 3 339.549 2.866 10 0 EFAEHO CC(C)[NH+]1CCC(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CC1 ZINC000179084749 519671899 /nfs/dbraw/zinc/67/18/99/519671899.db2.gz ZCVJSSBBZUOLCS-RTBURBONSA-N 1 3 344.503 2.604 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+]2CCC[C@H](c3nccs3)C2)CC1 ZINC000192729067 519681363 /nfs/dbraw/zinc/68/13/63/519681363.db2.gz YWQTVVPJJWJCCK-KRWDZBQOSA-N 1 3 336.549 2.739 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+]2CCC[C@H](c3nccs3)C2)CC1 ZINC000192729067 519681365 /nfs/dbraw/zinc/68/13/65/519681365.db2.gz YWQTVVPJJWJCCK-KRWDZBQOSA-N 1 3 336.549 2.739 10 0 EFAEHO CCCNC(=O)CCNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180112004 519872427 /nfs/dbraw/zinc/87/24/27/519872427.db2.gz CUOLZGTYADEIKJ-YQQQUEKLSA-N 1 3 329.488 2.688 10 0 EFAEHO CCCNC(=O)CCNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180112004 519872428 /nfs/dbraw/zinc/87/24/28/519872428.db2.gz CUOLZGTYADEIKJ-YQQQUEKLSA-N 1 3 329.488 2.688 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H](C)CN(C)Cc1ccccc1 ZINC000181329738 520854914 /nfs/dbraw/zinc/85/49/14/520854914.db2.gz IMONZYCIMTYXOS-DLBZAZTESA-N 1 3 334.508 2.536 10 0 EFAEHO C[N@H+]1C[C@H]2CN(C[C@H](O)Cn3c4ccccc4c4ccccc43)C[C@H]2C1 ZINC000193610613 524016368 /nfs/dbraw/zinc/01/63/68/524016368.db2.gz FTDDALFJNSAASH-KSZLIROESA-N 1 3 349.478 2.649 10 0 EFAEHO C[N@@H+]1C[C@H]2CN(C[C@H](O)Cn3c4ccccc4c4ccccc43)C[C@H]2C1 ZINC000193610613 524016372 /nfs/dbraw/zinc/01/63/72/524016372.db2.gz FTDDALFJNSAASH-KSZLIROESA-N 1 3 349.478 2.649 10 0 EFAEHO Cn1c2ccc(CN3CCC(CC[NH+](C)C)CC3)cc2sc1=O ZINC000194994405 524051602 /nfs/dbraw/zinc/05/16/02/524051602.db2.gz CSRBTORRHHCUNA-UHFFFAOYSA-N 1 3 333.501 2.764 10 0 EFAEHO CSC[C@@H](CCO)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245704880 525645863 /nfs/dbraw/zinc/64/58/63/525645863.db2.gz MHHBTBXORAUYAA-AKHDSKFASA-N 1 3 334.529 2.886 10 0 EFAEHO CSC[C@@H](CCO)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245704880 525645877 /nfs/dbraw/zinc/64/58/77/525645877.db2.gz MHHBTBXORAUYAA-AKHDSKFASA-N 1 3 334.529 2.886 10 0 EFAEHO C[C@@H](O)C[NH+]1CCC(CN(C)Cc2cc(-c3ccccc3)n[nH]2)CC1 ZINC000179518349 525789529 /nfs/dbraw/zinc/78/95/29/525789529.db2.gz SDXIXFDTSOPYHT-MRXNPFEDSA-N 1 3 342.487 2.601 10 0 EFAEHO c1[nH]nc(-c2cccnc2)c1CN1CCC(C[NH+]2CCCC2)CC1 ZINC000152685039 526394097 /nfs/dbraw/zinc/39/40/97/526394097.db2.gz PWBVVAFQMQBOLG-UHFFFAOYSA-N 1 3 325.460 2.780 10 0 EFAEHO O=C1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)CN1C1CC1 ZINC000180175833 527019543 /nfs/dbraw/zinc/01/95/43/527019543.db2.gz RUYIXCKJMQWNOD-CBRIZSKPSA-N 1 3 339.483 2.535 10 0 EFAEHO CCC(=O)CC[N@H+](C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000190219906 528289202 /nfs/dbraw/zinc/28/92/02/528289202.db2.gz IQZUAHXLDFPGRW-HXUWFJFHSA-N 1 3 332.488 2.733 10 0 EFAEHO CCC(=O)CC[N@@H+](C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000190219906 528289208 /nfs/dbraw/zinc/28/92/08/528289208.db2.gz IQZUAHXLDFPGRW-HXUWFJFHSA-N 1 3 332.488 2.733 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCc2ccncc2)CC1 ZINC000344793945 534936190 /nfs/dbraw/zinc/93/61/90/534936190.db2.gz MODFKQSDJZLVLE-UHFFFAOYSA-N 1 3 338.499 2.946 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2CCC[C@@H](CO)C2)CC1 ZINC000414565023 534936236 /nfs/dbraw/zinc/93/62/36/534936236.db2.gz DQKXYSGKHVSJOX-QUCCMNQESA-N 1 3 345.531 2.859 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCn2ccnc2C)CC1 ZINC000343916065 534936636 /nfs/dbraw/zinc/93/66/36/534936636.db2.gz PQYVFPHPJINVNN-UHFFFAOYSA-N 1 3 341.503 2.513 10 0 EFAEHO CCCN1CCN(c2ccccc2CNCC([NH3+])(CC)CC)CC1 ZINC000414805517 534937642 /nfs/dbraw/zinc/93/76/42/534937642.db2.gz GFIWNCUHESOKQV-UHFFFAOYSA-N 1 3 332.536 2.826 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC2(OC)CCC2)CC1 ZINC000355765622 534937660 /nfs/dbraw/zinc/93/76/60/534937660.db2.gz KATAJFWPJQQFBI-UHFFFAOYSA-N 1 3 331.504 2.877 10 0 EFAEHO CC(C)[C@H](CNC(=O)NC[C@@H](N)c1ccccc1)[NH+]1CCC(C)CC1 ZINC000416999928 535003136 /nfs/dbraw/zinc/00/31/36/535003136.db2.gz CNBXFBQHJVAUJM-MOPGFXCFSA-N 1 3 346.519 2.742 10 0 EFAEHO CC(C)[NH+]1CCC(O)(CNCc2ccccc2OCC2CC2)CC1 ZINC000344680575 535164785 /nfs/dbraw/zinc/16/47/85/535164785.db2.gz YXYSQKIOGAYRCV-UHFFFAOYSA-N 1 3 332.488 2.800 10 0 EFAEHO CCCc1ccc([C@H](C)N(CC(N)=O)C[C@@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000414737845 535425982 /nfs/dbraw/zinc/42/59/82/535425982.db2.gz DPTKKKPSDLFSMA-SOLBZPMBSA-N 1 3 331.504 2.876 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NCCN2[C@H](C)CCC[C@H]2C)CC1 ZINC000341123700 535447914 /nfs/dbraw/zinc/44/79/14/535447914.db2.gz NTJZWUFAMJAOAA-IAGOWNOFSA-N 1 3 338.540 2.671 10 0 EFAEHO CN(C(=O)NC1CC[NH+](C2CCCCC2)CC1)[C@H]1CCN(C2CC2)C1 ZINC000356061321 536020956 /nfs/dbraw/zinc/02/09/56/536020956.db2.gz PHYZMQUBQKYHOP-IBGZPJMESA-N 1 3 348.535 2.662 10 0 EFAEHO COc1cccc(N2CCC[C@H](N[C@H]3CC[N@@H+]4CCC[C@H]4C3)C2)c1 ZINC000339067802 545921730 /nfs/dbraw/zinc/92/17/30/545921730.db2.gz ISVPZXXWJJFIJU-BZSNNMDCSA-N 1 3 329.488 2.880 10 0 EFAEHO COc1cccc(N2CCC[C@H](N[C@H]3CC[N@H+]4CCC[C@H]4C3)C2)c1 ZINC000339067802 545921734 /nfs/dbraw/zinc/92/17/34/545921734.db2.gz ISVPZXXWJJFIJU-BZSNNMDCSA-N 1 3 329.488 2.880 10 0 EFAEHO [NH3+][C@@H]1CCC[C@H](NC(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000416899053 546204722 /nfs/dbraw/zinc/20/47/22/546204722.db2.gz DRBZYMAZRMOJPA-MOPGFXCFSA-N 1 3 344.503 2.742 10 0 EFAEHO C[C@H]1CC[C@@H]([NH2+]Cc2ccc(CN3CCN(C)CC3)cc2)CS1 ZINC000655697236 546538798 /nfs/dbraw/zinc/53/87/98/546538798.db2.gz OTHOWOHDDCEFTH-QFBILLFUSA-N 1 3 333.545 2.808 10 0 EFAEHO C[C@@H]1CC[C@H]([NH2+]CC2(N3CCCCC3)CCN(C)CC2)CS1 ZINC000655719196 546548705 /nfs/dbraw/zinc/54/87/05/546548705.db2.gz HUQCYFIKWSXXET-SJORKVTESA-N 1 3 325.566 2.810 10 0 EFAEHO c1c(CNCC2CCN(c3cc[nH+]cc3)CC2)nn2c1CCCC2 ZINC000655756431 546568790 /nfs/dbraw/zinc/56/87/90/546568790.db2.gz FNOZCGCQUWXSIW-UHFFFAOYSA-N 1 3 325.460 2.621 10 0 EFAEHO CC[C@@H](NC1CC[NH+](CCN2CCOCC2)CC1)c1ccccc1F ZINC000655800522 546589593 /nfs/dbraw/zinc/58/95/93/546589593.db2.gz ROXQKFBGPAWIPC-HXUWFJFHSA-N 1 3 349.494 2.663 10 0 EFAEHO [NH3+]Cc1cccc(-c2cn([C@H]3CCN(Cc4ccccc4)C3)nn2)c1 ZINC000656455497 546806276 /nfs/dbraw/zinc/80/62/76/546806276.db2.gz JMTXSTSAYOKCSP-IBGZPJMESA-N 1 3 333.439 2.851 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656782981 546921973 /nfs/dbraw/zinc/92/19/73/546921973.db2.gz KREHWMFOCBGZDH-GOSISDBHSA-N 1 3 339.487 2.787 10 0 EFAEHO COc1cc(CN2CCC[C@@H](C3CC[NH2+]CC3)C2)cc2c1OCO2 ZINC000656786205 546924642 /nfs/dbraw/zinc/92/46/42/546924642.db2.gz PQLTWBQVUHITLR-MRXNPFEDSA-N 1 3 332.444 2.636 10 0 EFAEHO C[NH+](C)[C@H](CNCc1ccnn1-c1ccncc1)C1CCCCC1 ZINC000657312473 547104661 /nfs/dbraw/zinc/10/46/61/547104661.db2.gz KEEJGRHXBBXNLJ-LJQANCHMSA-N 1 3 327.476 2.867 10 0 EFAEHO CN(C)[C@H](C[NH2+]Cc1ccnn1-c1ccncc1)C1CCCCC1 ZINC000657312473 547104665 /nfs/dbraw/zinc/10/46/65/547104665.db2.gz KEEJGRHXBBXNLJ-LJQANCHMSA-N 1 3 327.476 2.867 10 0 EFAEHO Cc1ccc2cc(C[NH2+][C@H]3CCN(C4CCN(C)CC4)C3)[nH]c2c1 ZINC000657360137 547129890 /nfs/dbraw/zinc/12/98/90/547129890.db2.gz XQZMHJVEQODROP-KRWDZBQOSA-N 1 3 326.488 2.734 10 0 EFAEHO Cc1nn(C(C)C)cc1CNCC1CC[NH+](C2CCOCC2)CC1 ZINC000657537165 547196910 /nfs/dbraw/zinc/19/69/10/547196910.db2.gz APPCFKJXYFKFNY-UHFFFAOYSA-N 1 3 334.508 2.753 10 0 EFAEHO Cc1cc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)ccc1F ZINC000657593531 547219873 /nfs/dbraw/zinc/21/98/73/547219873.db2.gz AHOSTNFKQPEQGB-IBGZPJMESA-N 1 3 328.431 2.991 10 0 EFAEHO Cc1cc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)ccc1F ZINC000657593531 547219879 /nfs/dbraw/zinc/21/98/79/547219879.db2.gz AHOSTNFKQPEQGB-IBGZPJMESA-N 1 3 328.431 2.991 10 0 EFAEHO COc1ccc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000657593040 547220684 /nfs/dbraw/zinc/22/06/84/547220684.db2.gz CKPDIKOLVFSYCQ-IBGZPJMESA-N 1 3 326.440 2.552 10 0 EFAEHO COc1ccc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000657593040 547220689 /nfs/dbraw/zinc/22/06/89/547220689.db2.gz CKPDIKOLVFSYCQ-IBGZPJMESA-N 1 3 326.440 2.552 10 0 EFAEHO COCc1ccc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000657595901 547222585 /nfs/dbraw/zinc/22/25/85/547222585.db2.gz SLURNJKFOZOLEF-NRFANRHFSA-N 1 3 340.467 2.689 10 0 EFAEHO COCc1ccc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000657595901 547222591 /nfs/dbraw/zinc/22/25/91/547222591.db2.gz SLURNJKFOZOLEF-NRFANRHFSA-N 1 3 340.467 2.689 10 0 EFAEHO COc1cc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)ccc1C ZINC000657595183 547223041 /nfs/dbraw/zinc/22/30/41/547223041.db2.gz FTPMQGUESQYGDL-HXUWFJFHSA-N 1 3 340.467 2.860 10 0 EFAEHO COc1cc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)ccc1C ZINC000657595183 547223044 /nfs/dbraw/zinc/22/30/44/547223044.db2.gz FTPMQGUESQYGDL-HXUWFJFHSA-N 1 3 340.467 2.860 10 0 EFAEHO Cc1ccc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1F ZINC000657594964 547223067 /nfs/dbraw/zinc/22/30/67/547223067.db2.gz LUHQOWFNBCNUJN-LJQANCHMSA-N 1 3 328.431 2.991 10 0 EFAEHO Cc1ccc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)cc1F ZINC000657594964 547223069 /nfs/dbraw/zinc/22/30/69/547223069.db2.gz LUHQOWFNBCNUJN-LJQANCHMSA-N 1 3 328.431 2.991 10 0 EFAEHO COC[C@H](CC1CCOCC1)NCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000657839416 547298370 /nfs/dbraw/zinc/29/83/70/547298370.db2.gz UXGJSMLYZJBGEL-LMMKCTJWSA-N 1 3 326.525 2.776 10 0 EFAEHO COC[C@H](CC1CCOCC1)[NH2+]CCCN1C[C@H](C)C[C@@H](C)C1 ZINC000657839416 547298377 /nfs/dbraw/zinc/29/83/77/547298377.db2.gz UXGJSMLYZJBGEL-LMMKCTJWSA-N 1 3 326.525 2.776 10 0 EFAEHO C[NH+](C)CCCOc1cnccc1CNC1CC(CF)(CF)C1 ZINC000658012076 547336393 /nfs/dbraw/zinc/33/63/93/547336393.db2.gz AKJLHRSOVWARJN-UHFFFAOYSA-N 1 3 327.419 2.590 10 0 EFAEHO CCOC1CCC([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CC1 ZINC000658035214 547340056 /nfs/dbraw/zinc/34/00/56/547340056.db2.gz OCBLJFYIARVNGE-UHFFFAOYSA-N 1 3 346.515 2.951 10 0 EFAEHO COc1ccc([C@H](C)NCC2CC[NH+](C3CCOCC3)CC2)cc1O ZINC000658070173 547347874 /nfs/dbraw/zinc/34/78/74/547347874.db2.gz NFZIFJZSUITYMR-HNNXBMFYSA-N 1 3 348.487 2.942 10 0 EFAEHO COc1ncc([C@@H](C)N[C@@H](C)CN(C)CCC[NH+](C)C)cc1Cl ZINC000658106264 547357332 /nfs/dbraw/zinc/35/73/32/547357332.db2.gz HHMBDFWRCVZQPT-UONOGXRCSA-N 1 3 342.915 2.666 10 0 EFAEHO COc1ncc([C@H](C)N[C@@H](C)CN(C)CCC[NH+](C)C)cc1Cl ZINC000658106263 547357826 /nfs/dbraw/zinc/35/78/26/547357826.db2.gz HHMBDFWRCVZQPT-KBPBESRZSA-N 1 3 342.915 2.666 10 0 EFAEHO C[C@@H](N[C@@H](C)CN(C)CCC[NH+](C)C)c1ccc(F)cc1N(C)C ZINC000658107597 547358483 /nfs/dbraw/zinc/35/84/83/547358483.db2.gz MCZRAHWVOJKQDP-JKSUJKDBSA-N 1 3 338.515 2.814 10 0 EFAEHO C[C@H](CC1CCOCC1)[NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000658138168 547367936 /nfs/dbraw/zinc/36/79/36/547367936.db2.gz IWHKVRGPWCNBDN-UZLBHIALSA-N 1 3 332.488 2.548 10 0 EFAEHO COc1cc([C@H](C)NCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)ccn1 ZINC000658136647 547367957 /nfs/dbraw/zinc/36/79/57/547367957.db2.gz HOIZVXCUMCFEHU-KXBFYZLASA-N 1 3 341.455 2.508 10 0 EFAEHO COc1cc([C@H](C)NCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)ccn1 ZINC000658136647 547367961 /nfs/dbraw/zinc/36/79/61/547367961.db2.gz HOIZVXCUMCFEHU-KXBFYZLASA-N 1 3 341.455 2.508 10 0 EFAEHO COC[C@@H]([NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1)C1CCCC1 ZINC000658137990 547368235 /nfs/dbraw/zinc/36/82/35/547368235.db2.gz LKLJITFWCVDQCS-VQTJNVASSA-N 1 3 332.488 2.548 10 0 EFAEHO COC1([C@@H](C)[NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)CCCC1 ZINC000658140525 547368649 /nfs/dbraw/zinc/36/86/49/547368649.db2.gz VCDLHLIITWIWTJ-APWZRJJASA-N 1 3 332.488 2.691 10 0 EFAEHO CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)C1(C)C ZINC000658142560 547369765 /nfs/dbraw/zinc/36/97/65/547369765.db2.gz YOKHKPGBEOHIKF-XUVXKRRUSA-N 1 3 346.515 2.935 10 0 EFAEHO COC1(C[C@H](C)[NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)CCC1 ZINC000658142495 547370236 /nfs/dbraw/zinc/37/02/36/547370236.db2.gz YLDGJEWGPRJKOA-LPHOPBHVSA-N 1 3 332.488 2.691 10 0 EFAEHO CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)C1(C)C ZINC000658142557 547370248 /nfs/dbraw/zinc/37/02/48/547370248.db2.gz YOKHKPGBEOHIKF-VAMGGRTRSA-N 1 3 346.515 2.935 10 0 EFAEHO CC(C)O[C@@H]1C[C@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)C1(C)C ZINC000658142554 547370322 /nfs/dbraw/zinc/37/03/22/547370322.db2.gz YOKHKPGBEOHIKF-SLFFLAALSA-N 1 3 346.515 2.935 10 0 EFAEHO C[C@@H]([NH2+]CCO[C@@H]1CC1(F)F)c1ccc(OCCN(C)C)cc1 ZINC000658171498 547379680 /nfs/dbraw/zinc/37/96/80/547379680.db2.gz ZDGMYAQENMPLCZ-CZUORRHYSA-N 1 3 328.403 2.702 10 0 EFAEHO C[C@@H](NCCO[C@@H]1CC1(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000658171498 547379685 /nfs/dbraw/zinc/37/96/85/547379685.db2.gz ZDGMYAQENMPLCZ-CZUORRHYSA-N 1 3 328.403 2.702 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)C[NH2+][C@@H]1CCN(C)[C@H]2CCC[C@H]21 ZINC000671743134 547665325 /nfs/dbraw/zinc/66/53/25/547665325.db2.gz GDPCMXKCHLNGJI-HCXYKTFWSA-N 1 3 332.488 2.506 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CN[C@@H]1CC[N@@H+](C)[C@H]2CCC[C@H]21 ZINC000671743134 547665326 /nfs/dbraw/zinc/66/53/26/547665326.db2.gz GDPCMXKCHLNGJI-HCXYKTFWSA-N 1 3 332.488 2.506 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CN[C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000671743134 547665330 /nfs/dbraw/zinc/66/53/30/547665330.db2.gz GDPCMXKCHLNGJI-HCXYKTFWSA-N 1 3 332.488 2.506 10 0 EFAEHO CN(Cc1ccccc1)[C@@H]1CCN(C(=O)CC[C@H]2CCCC[N@@H+]2C)C1 ZINC000672937577 547831638 /nfs/dbraw/zinc/83/16/38/547831638.db2.gz RCEVZSMSIVHABP-WOJBJXKFSA-N 1 3 343.515 2.984 10 0 EFAEHO CN(Cc1ccccc1)[C@@H]1CCN(C(=O)CC[C@H]2CCCC[N@H+]2C)C1 ZINC000672937577 547831641 /nfs/dbraw/zinc/83/16/41/547831641.db2.gz RCEVZSMSIVHABP-WOJBJXKFSA-N 1 3 343.515 2.984 10 0 EFAEHO CN(C)CCOc1ccc(C[NH2+][C@H]2COc3ccc(F)cc3C2)cc1 ZINC000674224482 548040412 /nfs/dbraw/zinc/04/04/12/548040412.db2.gz YBJIBOZWKBVNNH-GOSISDBHSA-N 1 3 344.430 2.859 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN[C@H]2COc3ccc(F)cc3C2)cc1 ZINC000674224482 548040416 /nfs/dbraw/zinc/04/04/16/548040416.db2.gz YBJIBOZWKBVNNH-GOSISDBHSA-N 1 3 344.430 2.859 10 0 EFAEHO CC(C)[NH2+][C@@H]1CCCN(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)C1 ZINC000677584352 548729211 /nfs/dbraw/zinc/72/92/11/548729211.db2.gz SCTSPZXRUDPUPA-CEXWTWQISA-N 1 3 344.503 2.604 10 0 EFAEHO CC(C)[NH2+][C@@H]1CCCN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)C1 ZINC000677584356 548729348 /nfs/dbraw/zinc/72/93/48/548729348.db2.gz SCTSPZXRUDPUPA-GUDVDZBRSA-N 1 3 344.503 2.604 10 0 EFAEHO CCN1CCN(Cc2ccccc2C[NH2+][C@H]2CCC[C@H](OC)C2)CC1 ZINC000684370265 550031026 /nfs/dbraw/zinc/03/10/26/550031026.db2.gz RGDODAUBLJQCFP-SFTDATJTSA-N 1 3 345.531 2.871 10 0 EFAEHO CCN1CCN(Cc2ccccc2C[NH2+][C@H]2CCC[C@@H](OC)C2)CC1 ZINC000684370262 550031119 /nfs/dbraw/zinc/03/11/19/550031119.db2.gz RGDODAUBLJQCFP-LEWJYISDSA-N 1 3 345.531 2.871 10 0 EFAEHO CN(Cc1cccc2cnccc21)[C@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000685457759 550154504 /nfs/dbraw/zinc/15/45/04/550154504.db2.gz MGYKXTFVMBPGHC-FQEVSTJZSA-N 1 3 338.499 2.835 10 0 EFAEHO CN(Cc1cccc2cnccc21)[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000685457759 550154505 /nfs/dbraw/zinc/15/45/05/550154505.db2.gz MGYKXTFVMBPGHC-FQEVSTJZSA-N 1 3 338.499 2.835 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@@H](O)c2cccnc2)CC[N@@H+]1Cc1ccccc1 ZINC000773081263 581394606 /nfs/dbraw/zinc/39/46/06/581394606.db2.gz LWCLGFKVDIZSJA-NSISKUIASA-N 1 3 325.456 2.758 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@@H](O)c2cccnc2)CC[N@H+]1Cc1ccccc1 ZINC000773081263 581394609 /nfs/dbraw/zinc/39/46/09/581394609.db2.gz LWCLGFKVDIZSJA-NSISKUIASA-N 1 3 325.456 2.758 10 0 EFAEHO C[C@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@H]1CC[NH2+]CC1CC(C)(C)C1 ZINC001691306620 1248642063 /nfs/dbraw/zinc/64/20/63/1248642063.db2.gz VXQYQDRIEHFJII-YJBOKZPZSA-N 1 3 346.519 2.995 10 0 EFAEHO c1ccc(N2CCN(C[C@H]3CCCN(c4cc[nH+]cc4)C3)CC2)nc1 ZINC001772527012 1248033961 /nfs/dbraw/zinc/03/39/61/1248033961.db2.gz HOQYUEJFPGLIFT-GOSISDBHSA-N 1 3 337.471 2.515 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2C[C@@H]([NH2+]CCCc3ccsc3)C2)C1 ZINC001691114679 1248435908 /nfs/dbraw/zinc/43/59/08/1248435908.db2.gz RSBVAJHZFWRBRU-RYQLBKOJSA-N 1 3 349.544 2.507 10 0 EFAEHO Cn1ccc(-c2nc(CNC3CCC(C)([NH+](C)C)CC3)cs2)n1 ZINC000922317961 1265489783 /nfs/dbraw/zinc/48/97/83/1265489783.db2.gz NDEGKCSZQKLMPZ-UHFFFAOYSA-N 1 3 333.505 2.896 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001691556551 1251770639 /nfs/dbraw/zinc/77/06/39/1251770639.db2.gz UZWZEBHPEVQFBN-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO CCc1ccccc1C[NH2+]CCN(C)C(=O)[C@@H]1CCCCN1CC ZINC001691623241 1251841172 /nfs/dbraw/zinc/84/11/72/1251841172.db2.gz PPUXLUJIGMLEAB-IBGZPJMESA-N 1 3 331.504 2.671 10 0 EFAEHO CCc1ccccc1C[NH2+]CCN(C)C(=O)[C@H]1CCCCN1CC ZINC001691623242 1251841677 /nfs/dbraw/zinc/84/16/77/1251841677.db2.gz PPUXLUJIGMLEAB-LJQANCHMSA-N 1 3 331.504 2.671 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@]1(C)CC[N@H+](CC2=CCCCC2)C1 ZINC001484049183 1252117833 /nfs/dbraw/zinc/11/78/33/1252117833.db2.gz OIZFXPVPBJYQPG-HKUYNNGSSA-N 1 3 339.499 2.747 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@]1(C)CC[N@@H+](CC2=CCCCC2)C1 ZINC001484049183 1252117841 /nfs/dbraw/zinc/11/78/41/1252117841.db2.gz OIZFXPVPBJYQPG-HKUYNNGSSA-N 1 3 339.499 2.747 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N1CC[C@@](C)(NC(=O)CC[NH+](C)C)C1 ZINC001484058430 1252120431 /nfs/dbraw/zinc/12/04/31/1252120431.db2.gz RNOVTUSCSWXSLH-IEBWSBKVSA-N 1 3 335.467 2.809 10 0 EFAEHO CCCC[N@@H+]1CC[C@](C)(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001484059249 1252123085 /nfs/dbraw/zinc/12/30/85/1252123085.db2.gz XRBOQPBXEUGRFJ-ROUUACIJSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCC[N@H+]1CC[C@](C)(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001484059249 1252123087 /nfs/dbraw/zinc/12/30/87/1252123087.db2.gz XRBOQPBXEUGRFJ-ROUUACIJSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@](C)(C[NH2+]CC2=CCCCC2)C1)N(C)C ZINC001484103093 1252254686 /nfs/dbraw/zinc/25/46/86/1252254686.db2.gz QVSPFVFFZJDJHU-AZUAARDMSA-N 1 3 335.536 2.901 10 0 EFAEHO CC[NH2+][C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)c1ccccc1CC ZINC001484325172 1252401834 /nfs/dbraw/zinc/40/18/34/1252401834.db2.gz OMNOTTVJEAOOPZ-OALUTQOASA-N 1 3 331.504 2.889 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](C)[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001484355979 1252449393 /nfs/dbraw/zinc/44/93/93/1252449393.db2.gz AICDVEYOPWHYIY-PKOBYXMFSA-N 1 3 331.504 2.662 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](C)[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001484355976 1252449514 /nfs/dbraw/zinc/44/95/14/1252449514.db2.gz AICDVEYOPWHYIY-HKUYNNGSSA-N 1 3 331.504 2.662 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001484359816 1252454672 /nfs/dbraw/zinc/45/46/72/1252454672.db2.gz YOUNMUSAHLCQKZ-PXNSSMCTSA-N 1 3 345.531 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]CCC2CCCCC2)C1 ZINC001484384232 1252489400 /nfs/dbraw/zinc/48/94/00/1252489400.db2.gz KKKQQARDUXQONT-MJGOQNOKSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001484618291 1252768039 /nfs/dbraw/zinc/76/80/39/1252768039.db2.gz NPVODXMSEUITLU-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCCN(C)Cc2ccsc2)CC[N@@H+]1C ZINC001484743422 1252854136 /nfs/dbraw/zinc/85/41/36/1252854136.db2.gz KSDXUMMDFKCJOW-DLBZAZTESA-N 1 3 337.533 2.759 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCCN(C)Cc2ccsc2)CC[N@H+]1C ZINC001484743422 1252854151 /nfs/dbraw/zinc/85/41/51/1252854151.db2.gz KSDXUMMDFKCJOW-DLBZAZTESA-N 1 3 337.533 2.759 10 0 EFAEHO CN(CCCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21)CCC(F)(F)F ZINC001484747232 1252903918 /nfs/dbraw/zinc/90/39/18/1252903918.db2.gz NOHTVYHUHOQLLX-CABCVRRESA-N 1 3 349.441 2.736 10 0 EFAEHO CN(CCCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21)CCC(F)(F)F ZINC001484747232 1252903921 /nfs/dbraw/zinc/90/39/21/1252903921.db2.gz NOHTVYHUHOQLLX-CABCVRRESA-N 1 3 349.441 2.736 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCN(C)C(=O)CN2CCCC2)c(C)c1 ZINC001484768135 1252970191 /nfs/dbraw/zinc/97/01/91/1252970191.db2.gz GYBNEFJDWQNETB-UHFFFAOYSA-N 1 3 331.504 2.680 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCN(C)C(=O)CN2CCCC2)c(C)c1 ZINC001484768135 1252970201 /nfs/dbraw/zinc/97/02/01/1252970201.db2.gz GYBNEFJDWQNETB-UHFFFAOYSA-N 1 3 331.504 2.680 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@H+](C)[C@H]1CCc2ccccc21 ZINC001484768555 1252974631 /nfs/dbraw/zinc/97/46/31/1252974631.db2.gz BDTOYEWNWLPFLL-IBGZPJMESA-N 1 3 331.504 2.794 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001484768555 1252974646 /nfs/dbraw/zinc/97/46/46/1252974646.db2.gz BDTOYEWNWLPFLL-IBGZPJMESA-N 1 3 331.504 2.794 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCN(C)C(=O)CN(C)C(C)C)c(C)c1 ZINC001484768779 1252976558 /nfs/dbraw/zinc/97/65/58/1252976558.db2.gz GCKZFBVYQWSPPL-UHFFFAOYSA-N 1 3 333.520 2.924 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCN(C)C(=O)CN(C)C(C)C)c(C)c1 ZINC001484768779 1252976574 /nfs/dbraw/zinc/97/65/74/1252976574.db2.gz GCKZFBVYQWSPPL-UHFFFAOYSA-N 1 3 333.520 2.924 10 0 EFAEHO Cc1cc(C)c(C[NH2+]CC[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001273017929 1265797781 /nfs/dbraw/zinc/79/77/81/1265797781.db2.gz FBLSGBJFJAGBTL-DNVCBOLYSA-N 1 3 345.531 2.938 10 0 EFAEHO Cc1cc(C)c(C[NH2+]CC[C@H](C)NC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001273017931 1265797870 /nfs/dbraw/zinc/79/78/70/1265797870.db2.gz FBLSGBJFJAGBTL-KXBFYZLASA-N 1 3 345.531 2.938 10 0 EFAEHO CCN(CC[NH2+]Cc1c(C)cc(C)cc1C)C(=O)[C@H]1CCCN1C ZINC001273298621 1265845253 /nfs/dbraw/zinc/84/52/53/1265845253.db2.gz STOTWBZYCIVXCX-LJQANCHMSA-N 1 3 331.504 2.644 10 0 EFAEHO Cc1ccc(CN2CC([C@H](C)NC(=O)C[C@H]3CC[N@H+](C)C3)C2)cc1C ZINC001409929483 1255633781 /nfs/dbraw/zinc/63/37/81/1255633781.db2.gz HEYDBOPHGODRLP-PKOBYXMFSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(CN2CC([C@H](C)NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)cc1C ZINC001409929483 1255633787 /nfs/dbraw/zinc/63/37/87/1255633787.db2.gz HEYDBOPHGODRLP-PKOBYXMFSA-N 1 3 343.515 2.582 10 0 EFAEHO CC[C@@H](C(=O)N(C)[C@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001485825270 1256389714 /nfs/dbraw/zinc/38/97/14/1256389714.db2.gz CFZDYNMLHQVIDJ-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[NH+](CC)CCOc1ccccc1CNCc1cc[nH]c(=O)c1 ZINC000921545734 1257099178 /nfs/dbraw/zinc/09/91/78/1257099178.db2.gz VEGKAHPIUAGSDQ-UHFFFAOYSA-N 1 3 329.444 2.798 10 0 EFAEHO CCCCC[NH2+][C@@H]1CN(C(=O)Cc2c[nH]cn2)CC[C@H]1C(F)(F)F ZINC001279170560 1258066115 /nfs/dbraw/zinc/06/61/15/1258066115.db2.gz DEZFMFUHWBOPMI-ZIAGYGMSSA-N 1 3 346.397 2.511 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[NH2+]Cc1ccc(C2CC2)cc1)N(C)C ZINC001493586408 1258677792 /nfs/dbraw/zinc/67/77/92/1258677792.db2.gz QSOWUFAZQAZEPO-IBGZPJMESA-N 1 3 331.504 2.698 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H](C)NC(=O)CN(C)C2CCC2)c(C)s1 ZINC001272829168 1261089752 /nfs/dbraw/zinc/08/97/52/1261089752.db2.gz GWTNVZIXXGSTTM-CYBMUJFWSA-N 1 3 337.533 2.834 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2cccc3[nH]c(=O)oc32)[C@H](C)C1 ZINC000921746764 1261356562 /nfs/dbraw/zinc/35/65/62/1261356562.db2.gz HXJZIVODMZAQQJ-ZBFHGGJFSA-N 1 3 347.459 2.760 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@H](C2CC2)N(C)C(=O)CN(C)C(C)C)c1 ZINC001485837508 1261373171 /nfs/dbraw/zinc/37/31/71/1261373171.db2.gz OSCNSKRLPZZHNW-HXUWFJFHSA-N 1 3 345.531 2.970 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN2CCCC[C@H]2[C@@H]2CC[NH2+]C2)c(C)c1 ZINC000923365072 1261559543 /nfs/dbraw/zinc/55/95/43/1261559543.db2.gz RWEXPKOCJFVWIJ-QRVBRYPASA-N 1 3 332.488 2.507 10 0 EFAEHO N[C@@H]1CCCC[C@H]1[NH2+]C[C@H](O)COc1c(Cl)cccc1Cl ZINC000923383262 1261580939 /nfs/dbraw/zinc/58/09/39/1261580939.db2.gz WXENOZOMRGPVHS-ZLKJLUDKSA-N 1 3 333.259 2.593 10 0 EFAEHO Cc1ccc(OC[C@@H](O)CN2CC[C@@](C[NH3+])(C(C)(C)C)C2)c(C)c1 ZINC000923413212 1261627269 /nfs/dbraw/zinc/62/72/69/1261627269.db2.gz FAMPAIWEAIONDS-PXNSSMCTSA-N 1 3 334.504 2.740 10 0 EFAEHO COC(=O)c1cncc(CN2CCC[C@H](C[C@H]([NH3+])C3CCCC3)C2)c1 ZINC000923422420 1261629809 /nfs/dbraw/zinc/62/98/09/1261629809.db2.gz RRJXJTRAENJONN-BEFAXECRSA-N 1 3 345.487 2.988 10 0 EFAEHO CCOC(=O)[C@@]1(F)CN(CCC2C[C@H]3CC[C@@H](C2)[NH2+]3)C[C@@H]1CC ZINC000923427911 1261635006 /nfs/dbraw/zinc/63/50/06/1261635006.db2.gz MBCOVWPLIOMWBW-VFNFBSEESA-N 1 3 326.456 2.520 10 0 EFAEHO Cc1ccc(-c2cc(CN3CCC4(CO[C@@H](C[NH3+])C4)CC3)on2)cc1 ZINC000923448285 1261668979 /nfs/dbraw/zinc/66/89/79/1261668979.db2.gz BCHKHPSIAMXPQK-GOSISDBHSA-N 1 3 341.455 2.980 10 0 EFAEHO Cc1cc(CN2CCC3(CO[C@@H](C[NH3+])C3)CC2)c2ccccc2n1 ZINC000923449773 1261686844 /nfs/dbraw/zinc/68/68/44/1261686844.db2.gz BYNPUFFXEBYEKU-QGZVFWFLSA-N 1 3 325.456 2.873 10 0 EFAEHO [NH3+]C[C@@H]1CC2(CO1)CCN(Cc1cc(F)ccc1OC(F)F)CC2 ZINC000923450229 1261687316 /nfs/dbraw/zinc/68/73/16/1261687316.db2.gz FJVBPZQVAGOUQW-AWEZNQCLSA-N 1 3 344.377 2.757 10 0 EFAEHO C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923502311 1261782392 /nfs/dbraw/zinc/78/23/92/1261782392.db2.gz YUWCDXWBFCEGQJ-FMKPAKJESA-N 1 3 337.895 2.776 10 0 EFAEHO C[C@H](NC(=O)[C@H](C)N1CC[C@H](C[NH3+])[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000923497136 1261786684 /nfs/dbraw/zinc/78/66/84/1261786684.db2.gz FNJFEIVAWMHRIP-RZLSGREXSA-N 1 3 337.895 2.822 10 0 EFAEHO CCCN(Cc1ccc(C)cc1)C(=O)CN1CC[C@@H](C[NH3+])[C@@H](C)C1 ZINC000923497804 1261788783 /nfs/dbraw/zinc/78/87/83/1261788783.db2.gz DZFWPOGXBNXPQP-HKUYNNGSSA-N 1 3 331.504 2.650 10 0 EFAEHO CCc1ccc([C@H](C)NC(=O)[C@H](C)N2CC[C@H](C[NH3+])[C@@H](C)C2)cc1 ZINC000923498162 1261790384 /nfs/dbraw/zinc/79/03/84/1261790384.db2.gz JRKVEOWURVRWGI-IUVQAAGXSA-N 1 3 331.504 2.731 10 0 EFAEHO C[C@H](NC(=O)[C@H](C)N1CC[C@H](C[NH3+])[C@H](C)C1)c1cc2ccccc2o1 ZINC000923499950 1261795974 /nfs/dbraw/zinc/79/59/74/1261795974.db2.gz OUSIKIWRBCTQCY-WBTNSWJXSA-N 1 3 343.471 2.915 10 0 EFAEHO CCOC(=O)C1(C(F)(F)F)CCN(CC[C@H]2CCC[NH2+]C2)CC1 ZINC000923525922 1261842505 /nfs/dbraw/zinc/84/25/05/1261842505.db2.gz VQMVZQNMAXZIJS-CYBMUJFWSA-N 1 3 336.398 2.584 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CCC(F)(F)CC1 ZINC001485922301 1262502117 /nfs/dbraw/zinc/50/21/17/1262502117.db2.gz IWIOBBFUXYSOOO-CABCVRRESA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cc2ccccc2o1 ZINC001485922666 1262502989 /nfs/dbraw/zinc/50/29/89/1262502989.db2.gz PGQUYWZPJAJQNE-HOTGVXAUSA-N 1 3 343.471 2.711 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001485929923 1262528937 /nfs/dbraw/zinc/52/89/37/1262528937.db2.gz IDYMYDUVIDEGJD-GDBMZVCRSA-N 1 3 345.478 2.731 10 0 EFAEHO C[C@@H](CN(C)C(=O)C1CC[NH+](CC2CC2)CC1)NCc1ccsc1 ZINC001485941519 1262540794 /nfs/dbraw/zinc/54/07/94/1262540794.db2.gz MZVXNCMKXFHVFV-HNNXBMFYSA-N 1 3 349.544 2.807 10 0 EFAEHO C[C@@H]1[C@@H]([NH2+]CCCCc2ccccc2)CCN1C(=O)Cc1c[nH]cn1 ZINC001486088478 1262610953 /nfs/dbraw/zinc/61/09/53/1262610953.db2.gz HVGGONDCSMEUAV-APWZRJJASA-N 1 3 340.471 2.554 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)cc1 ZINC001486094896 1262617979 /nfs/dbraw/zinc/61/79/79/1262617979.db2.gz DRTDLNJECXJUJC-QUCCMNQESA-N 1 3 345.531 2.847 10 0 EFAEHO C[C@@H]1C[C@H](NCc2ccccc2F)CN1C(=O)CCCC[NH+](C)C ZINC001486130375 1262663705 /nfs/dbraw/zinc/66/37/05/1262663705.db2.gz RBSRROGHHUTDPX-WBVHZDCISA-N 1 3 335.467 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCc2cccc(C)c2)C[C@H]1C ZINC001486129978 1262663741 /nfs/dbraw/zinc/66/37/41/1262663741.db2.gz PJYLXOHMSMDWLI-QUCCMNQESA-N 1 3 345.531 2.848 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H]1C[C@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001486134601 1262668920 /nfs/dbraw/zinc/66/89/20/1262668920.db2.gz LVMKGCYECYEPGV-YJBOKZPZSA-N 1 3 335.467 2.553 10 0 EFAEHO C[C@H](c1ccccc1F)N1CC[C@]2(NC(=O)CC[NH+](C)C)CCC[C@@H]12 ZINC001486148219 1262698603 /nfs/dbraw/zinc/69/86/03/1262698603.db2.gz LDODOVMYZBGEJH-XFQXTVEOSA-N 1 3 347.478 2.952 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N1CC[C@@]2(NC(=O)CC[NH+](C)C)CCC[C@@H]12 ZINC001486151949 1262707200 /nfs/dbraw/zinc/70/72/00/1262707200.db2.gz YWLCWYCFWCFYRB-ZTNFWEORSA-N 1 3 347.478 2.952 10 0 EFAEHO CCCCC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN(C)C3CCC3)C[C@H]21 ZINC001486156530 1262713597 /nfs/dbraw/zinc/71/35/97/1262713597.db2.gz NPRBESYKUMDLKO-QXAKKESOSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@@H](C[NH2+]CCc3ccccc3)C2)CCC1 ZINC001486203392 1262788466 /nfs/dbraw/zinc/78/84/66/1262788466.db2.gz XEUAPDMRCXICSV-MOPGFXCFSA-N 1 3 343.515 2.588 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@@H](C[NH2+]CCc3ccccc3)C2)CCC1 ZINC001486203395 1262788714 /nfs/dbraw/zinc/78/87/14/1262788714.db2.gz XEUAPDMRCXICSV-RTBURBONSA-N 1 3 343.515 2.588 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCc2ccccc2F)C(C)(C)C1 ZINC001486246424 1262850723 /nfs/dbraw/zinc/85/07/23/1262850723.db2.gz KMURBDCRRGMTBO-GOSISDBHSA-N 1 3 349.494 2.537 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]CCCc2ccccc2)C(C)(C)C1 ZINC001486250762 1262856871 /nfs/dbraw/zinc/85/68/71/1262856871.db2.gz TXXJXFNRCXXWRO-LJQANCHMSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(CC[N@H+](C)CCc1cccs1)C(=O)[C@@H]1CCCN1C ZINC001486365739 1262956335 /nfs/dbraw/zinc/95/63/35/1262956335.db2.gz XVGPMRJRXULZGK-KRWDZBQOSA-N 1 3 337.533 2.554 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CCc1cccs1)C(=O)[C@@H]1CCCN1C ZINC001486365739 1262956341 /nfs/dbraw/zinc/95/63/41/1262956341.db2.gz XVGPMRJRXULZGK-KRWDZBQOSA-N 1 3 337.533 2.554 10 0 EFAEHO CC(C)N(CC[N@H+](C)CC1CC(F)(F)C1)C(=O)CN1CC[C@@H](C)C1 ZINC001486375672 1262977711 /nfs/dbraw/zinc/97/77/11/1262977711.db2.gz NGYFZBBEQXGFRB-OAHLLOKOSA-N 1 3 345.478 2.542 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CC1CC(F)(F)C1)C(=O)CN1CC[C@@H](C)C1 ZINC001486375672 1262977715 /nfs/dbraw/zinc/97/77/15/1262977715.db2.gz NGYFZBBEQXGFRB-OAHLLOKOSA-N 1 3 345.478 2.542 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H](NC(=O)C(C)(C)N1CCCC1)C(C)(C)C ZINC001486407628 1263024399 /nfs/dbraw/zinc/02/43/99/1263024399.db2.gz SWILRUVTFNHZOM-GJZGRUSLSA-N 1 3 329.504 2.729 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H](NC(=O)C(C)(C)N1CCCC1)C(C)(C)C ZINC001486407627 1263024496 /nfs/dbraw/zinc/02/44/96/1263024496.db2.gz SWILRUVTFNHZOM-CABCVRRESA-N 1 3 329.504 2.729 10 0 EFAEHO Cc1ccc(F)cc1CN1CCC([C@H](C)NC(=O)CC[NH+](C)C)CC1 ZINC001486448533 1263138536 /nfs/dbraw/zinc/13/85/36/1263138536.db2.gz QZVGUDGWNQCIPY-INIZCTEOSA-N 1 3 349.494 2.803 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CC([NH2+]CC2CCC3(CC3)CC2)C1 ZINC001486481436 1263217058 /nfs/dbraw/zinc/21/70/58/1263217058.db2.gz OAEAMJMAFHFLJN-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001486508577 1263282818 /nfs/dbraw/zinc/28/28/18/1263282818.db2.gz AZOLPMNWXRLGMK-GOSISDBHSA-N 1 3 333.520 2.655 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001486508577 1263282820 /nfs/dbraw/zinc/28/28/20/1263282820.db2.gz AZOLPMNWXRLGMK-GOSISDBHSA-N 1 3 333.520 2.655 10 0 EFAEHO Cn1ccc(-c2nc(CNC3CCC(C[NH+](C)C)CC3)cs2)n1 ZINC000921920483 1263463215 /nfs/dbraw/zinc/46/32/15/1263463215.db2.gz PFGXUTCEFFCQHR-UHFFFAOYSA-N 1 3 333.505 2.754 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1CCCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001410171233 1264161412 /nfs/dbraw/zinc/16/14/12/1264161412.db2.gz NTVXPOVWGPWYKM-QGZVFWFLSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C)C[N@H+]1CCCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001410171233 1264161415 /nfs/dbraw/zinc/16/14/15/1264161415.db2.gz NTVXPOVWGPWYKM-QGZVFWFLSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]CC2CCC3(CC3)CC2)C1)N(C)C ZINC001410212608 1264325877 /nfs/dbraw/zinc/32/58/77/1264325877.db2.gz WXURBSKAACVSNY-KZNAEPCWSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N(C)C[C@H](C)NCc1ccccc1F ZINC001410407520 1265045559 /nfs/dbraw/zinc/04/55/59/1265045559.db2.gz MQHCAFAZCAQVDG-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N(C)C[C@H](C)NCc1ccccc1F ZINC001410407520 1265045566 /nfs/dbraw/zinc/04/55/66/1265045566.db2.gz MQHCAFAZCAQVDG-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO O[C@H](C[C@@H]1CCC[N@@H+]1Cc1ccnn1-c1ccncc1)c1ccco1 ZINC000824927623 1278357553 /nfs/dbraw/zinc/35/75/53/1278357553.db2.gz PPVPLSJEGLOYLA-FUHWJXTLSA-N 1 3 338.411 2.948 10 0 EFAEHO O[C@H](C[C@@H]1CCC[N@H+]1Cc1ccnn1-c1ccncc1)c1ccco1 ZINC000824927623 1278357561 /nfs/dbraw/zinc/35/75/61/1278357561.db2.gz PPVPLSJEGLOYLA-FUHWJXTLSA-N 1 3 338.411 2.948 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)cc1F ZINC001410847900 1269795073 /nfs/dbraw/zinc/79/50/73/1269795073.db2.gz JXGUCYOGYCNZNV-WBVHZDCISA-N 1 3 335.467 2.553 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)c(C)s1 ZINC001410857641 1269881543 /nfs/dbraw/zinc/88/15/43/1269881543.db2.gz RATACKMCSTUHDX-SUMWQHHRSA-N 1 3 337.533 2.784 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)c(C)s1 ZINC001410857599 1269881576 /nfs/dbraw/zinc/88/15/76/1269881576.db2.gz RATACKMCSTUHDX-DYVFJYSZSA-N 1 3 337.533 2.784 10 0 EFAEHO C[C@H]1CCC[N@@H+]1CCNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000742241601 1269951479 /nfs/dbraw/zinc/95/14/79/1269951479.db2.gz PYMVBNSSPNFPMH-WMZOPIPTSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@H]1CCC[N@H+]1CCNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000742241601 1269951490 /nfs/dbraw/zinc/95/14/90/1269951490.db2.gz PYMVBNSSPNFPMH-WMZOPIPTSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@H]1CCC[N@@H+]1CCNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000742241597 1269952004 /nfs/dbraw/zinc/95/20/04/1269952004.db2.gz PYMVBNSSPNFPMH-FUHWJXTLSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@H]1CCC[N@H+]1CCNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000742241597 1269952009 /nfs/dbraw/zinc/95/20/09/1269952009.db2.gz PYMVBNSSPNFPMH-FUHWJXTLSA-N 1 3 347.478 2.638 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)[C@H]1C ZINC001410874525 1269987820 /nfs/dbraw/zinc/98/78/20/1269987820.db2.gz YGFLYRLSQQIVEE-MAUKXSAKSA-N 1 3 335.467 2.553 10 0 EFAEHO C[C@H]1C[C@H](NCc2ccc(F)c(Cl)c2)CN1C(=O)CC[NH+](C)C ZINC001410874717 1269989196 /nfs/dbraw/zinc/98/91/96/1269989196.db2.gz UIYFOIAAOYCIBQ-JSGCOSHPSA-N 1 3 341.858 2.510 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CC3CC3)[C@@H]2C1)CC(C)(C)C ZINC001410909829 1270221971 /nfs/dbraw/zinc/22/19/71/1270221971.db2.gz DFMZPFIKVCHVMP-RCCFBDPRSA-N 1 3 335.536 2.591 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001410946014 1270355655 /nfs/dbraw/zinc/35/56/55/1270355655.db2.gz ADTOZLKYEWPFEG-UXHICEINSA-N 1 3 345.531 2.964 10 0 EFAEHO CC(C)CC[NH2+][C@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001410981021 1270534586 /nfs/dbraw/zinc/53/45/86/1270534586.db2.gz KVWOSNVOWBOWJR-INIZCTEOSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)(C(=O)N1C[C@H]([NH2+]CCC(F)(F)F)C(C)(C)C1)N1CCCC1 ZINC001411002451 1270621672 /nfs/dbraw/zinc/62/16/72/1270621672.db2.gz UAASGGCXQXJBBZ-ZDUSSCGKSA-N 1 3 349.441 2.640 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc(Cl)c1)C(=O)C1(N(C)C)CCC1 ZINC001273420890 1270988050 /nfs/dbraw/zinc/98/80/50/1270988050.db2.gz QXPSKBLEXACIMD-UHFFFAOYSA-N 1 3 337.895 2.762 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc(Cl)c1)C(=O)CN(C)C1CCC1 ZINC001273427527 1271264878 /nfs/dbraw/zinc/26/48/78/1271264878.db2.gz JMZKGVQOGFRJSM-UHFFFAOYSA-N 1 3 337.895 2.762 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H](NC(=O)CN(C)C(C)C)C(C)(C)C)c1 ZINC001411223219 1272055348 /nfs/dbraw/zinc/05/53/48/1272055348.db2.gz LPUFULYZIPMSMK-GOSISDBHSA-N 1 3 333.520 2.956 10 0 EFAEHO Cc1cc([C@H](N)CC(=O)NC[C@@H](CC(C)C)[NH+](C)C)cc(Cl)n1 ZINC000844168527 1278777400 /nfs/dbraw/zinc/77/74/00/1278777400.db2.gz FZGRAJUFVODLKZ-HUUCEWRRSA-N 1 3 340.899 2.526 10 0 EFAEHO CC[NH2+]CC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000844189470 1278783653 /nfs/dbraw/zinc/78/36/53/1278783653.db2.gz NHAPHSFDVWDOMA-UHFFFAOYSA-N 1 3 339.483 2.757 10 0 EFAEHO CC[NH+](CC)CCCC1CCN(C[C@@H]2CN(C3CC3)C(=O)O2)CC1 ZINC000844313232 1278857136 /nfs/dbraw/zinc/85/71/36/1278857136.db2.gz BGQNDECGOZQNLF-GOSISDBHSA-N 1 3 337.508 2.804 10 0 EFAEHO N[C@@H]1CCC[C@@H]1[NH2+]C[C@@H](C(=O)OCc1ccccc1)c1ccccc1 ZINC000817923022 1276378246 /nfs/dbraw/zinc/37/82/46/1276378246.db2.gz CLQYSMOUFVMMAJ-AQNXPRMDSA-N 1 3 338.451 2.983 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NCCCCC[NH+]2CCCC2)C1 ZINC000818343239 1276510424 /nfs/dbraw/zinc/51/04/24/1276510424.db2.gz NIOSVFAQAZPQGB-SFHVURJKSA-N 1 3 327.488 2.581 10 0 EFAEHO CCN1CCN(Cc2ccccc2C[NH2+]CC2(O)CCCCC2)CC1 ZINC000818958555 1276559179 /nfs/dbraw/zinc/55/91/79/1276559179.db2.gz QTLXNVABNHGCBY-UHFFFAOYSA-N 1 3 345.531 2.609 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@H+](CC2CCCCC2)CC1(C)C)N(C)C ZINC001410014667 1276985568 /nfs/dbraw/zinc/98/55/68/1276985568.db2.gz GZBKQRRNRIGZOC-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@@H+](CC2CCCCC2)CC1(C)C)N(C)C ZINC001410014667 1276985571 /nfs/dbraw/zinc/98/55/71/1276985571.db2.gz GZBKQRRNRIGZOC-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(Cc1ccccc1)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000820068144 1276999966 /nfs/dbraw/zinc/99/99/66/1276999966.db2.gz ICKFAVZXLIXJOV-SFHVURJKSA-N 1 3 348.535 2.879 10 0 EFAEHO CC(C)N(Cc1ccccc1)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000820068144 1276999969 /nfs/dbraw/zinc/99/99/69/1276999969.db2.gz ICKFAVZXLIXJOV-SFHVURJKSA-N 1 3 348.535 2.879 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CCCC2(CCCC2)C1 ZINC000820080710 1277015569 /nfs/dbraw/zinc/01/55/69/1277015569.db2.gz JCMLCDVBRZMLFJ-KRWDZBQOSA-N 1 3 338.540 2.624 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CCCC2(CCCC2)C1 ZINC000820080710 1277015578 /nfs/dbraw/zinc/01/55/78/1277015578.db2.gz JCMLCDVBRZMLFJ-KRWDZBQOSA-N 1 3 338.540 2.624 10 0 EFAEHO COC(CCN1C[C@]2(C)C[N@H+](Cc3ccccc3)C[C@]2(C)C1)OC ZINC000585133711 1277480413 /nfs/dbraw/zinc/48/04/13/1277480413.db2.gz RTJIGZCHBOBTAW-BGYRXZFFSA-N 1 3 332.488 2.839 10 0 EFAEHO COC(CCN1C[C@]2(C)C[N@@H+](Cc3ccccc3)C[C@]2(C)C1)OC ZINC000585133711 1277480418 /nfs/dbraw/zinc/48/04/18/1277480418.db2.gz RTJIGZCHBOBTAW-BGYRXZFFSA-N 1 3 332.488 2.839 10 0 EFAEHO CN(CCCCCC[NH3+])Cc1cc2c(cc1OC(F)F)OCO2 ZINC000846218953 1280072569 /nfs/dbraw/zinc/07/25/69/1280072569.db2.gz AAEJGZLZHIWCQB-UHFFFAOYSA-N 1 3 330.375 2.968 10 0 EFAEHO CC[C@H]([NH2+]Cc1ccc(CN2CCN(C)CC2)cc1)[C@H]1CCCOC1 ZINC000872023049 1287403937 /nfs/dbraw/zinc/40/39/37/1287403937.db2.gz BGCYLDQKOCAQQX-SFTDATJTSA-N 1 3 345.531 2.729 10 0 EFAEHO CCN1C[C@H](CN2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)OC1=O ZINC000846819344 1280552103 /nfs/dbraw/zinc/55/21/03/1280552103.db2.gz YVVOYWGGOYBCJS-AEFFLSMTSA-N 1 3 337.508 2.804 10 0 EFAEHO CCN1C[C@H](CN2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)OC1=O ZINC000846819344 1280552111 /nfs/dbraw/zinc/55/21/11/1280552111.db2.gz YVVOYWGGOYBCJS-AEFFLSMTSA-N 1 3 337.508 2.804 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2ccc3oc(=O)[nH]c3c2)[C@H](C)C1 ZINC000872122264 1287435874 /nfs/dbraw/zinc/43/58/74/1287435874.db2.gz DGHYJWAWYXJBFO-ZBFHGGJFSA-N 1 3 347.459 2.760 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]Cc2ccc3oc(=O)[nH]c3c2)[C@H](C)C1 ZINC000872122257 1287436206 /nfs/dbraw/zinc/43/62/06/1287436206.db2.gz DGHYJWAWYXJBFO-GDBMZVCRSA-N 1 3 347.459 2.760 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC[C@@H](O)CC(C)(C)O)C1 ZINC000872199750 1287471821 /nfs/dbraw/zinc/47/18/21/1287471821.db2.gz AZCJFLKSBCCCCI-HLIPFELVSA-N 1 3 348.531 2.776 10 0 EFAEHO CC(C)(O)C[C@H](O)CNCc1ccccc1C[NH+]1CCCCCC1 ZINC000872202062 1287475110 /nfs/dbraw/zinc/47/51/10/1287475110.db2.gz SHZIITRKPGONDR-IBGZPJMESA-N 1 3 334.504 2.674 10 0 EFAEHO O[C@H](C[NH2+][C@@H]1CCCO[C@H]1c1ccc(Cl)cc1)CN1CCCC1 ZINC000872237456 1287492257 /nfs/dbraw/zinc/49/22/57/1287492257.db2.gz JCKJTJXUDVJJGX-KURKYZTESA-N 1 3 338.879 2.606 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CC[C@@]2(CC[N@H+](CC3CC3)C2)C1 ZINC001671084946 1281370109 /nfs/dbraw/zinc/37/01/09/1281370109.db2.gz KAEMFKSHASMOMO-HXUWFJFHSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CC[C@@]2(CC[N@@H+](CC3CC3)C2)C1 ZINC001671084946 1281370119 /nfs/dbraw/zinc/37/01/19/1281370119.db2.gz KAEMFKSHASMOMO-HXUWFJFHSA-N 1 3 335.536 2.833 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000809967599 1282658917 /nfs/dbraw/zinc/65/89/17/1282658917.db2.gz CSSHAAQBQZFKLG-MAUKXSAKSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000809967599 1282658918 /nfs/dbraw/zinc/65/89/18/1282658918.db2.gz CSSHAAQBQZFKLG-MAUKXSAKSA-N 1 3 327.488 2.580 10 0 EFAEHO C[NH+](C)CCN(Cc1ccccc1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810030173 1282790752 /nfs/dbraw/zinc/79/07/52/1282790752.db2.gz QZHBZBWJDTZNMW-HXUWFJFHSA-N 1 3 349.494 2.789 10 0 EFAEHO C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810196042 1283029086 /nfs/dbraw/zinc/02/90/86/1283029086.db2.gz GYIVQCZCHPMKFW-CYJAXWMASA-N 1 3 341.515 2.682 10 0 EFAEHO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810196042 1283029097 /nfs/dbraw/zinc/02/90/97/1283029097.db2.gz GYIVQCZCHPMKFW-CYJAXWMASA-N 1 3 341.515 2.682 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCC[N@@H+](C(C)(C)C)CC2)C1 ZINC000810261820 1283078976 /nfs/dbraw/zinc/07/89/76/1283078976.db2.gz FIHNWTULWMUYSX-SFHVURJKSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)C1 ZINC000810261820 1283078980 /nfs/dbraw/zinc/07/89/80/1283078980.db2.gz FIHNWTULWMUYSX-SFHVURJKSA-N 1 3 327.488 2.532 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)[C@]2(F)CC[N@@H+](C(C)(C)C)C2)N(C)C)cc1 ZINC000810243693 1283097572 /nfs/dbraw/zinc/09/75/72/1283097572.db2.gz JQIXIELNBOHPCN-XLIONFOSSA-N 1 3 349.494 2.926 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)N(C)C)cc1 ZINC000810243693 1283097584 /nfs/dbraw/zinc/09/75/84/1283097584.db2.gz JQIXIELNBOHPCN-XLIONFOSSA-N 1 3 349.494 2.926 10 0 EFAEHO C[NH+](C)CC[C@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)(C)C ZINC000810412757 1283214186 /nfs/dbraw/zinc/21/41/86/1283214186.db2.gz JSIZTMDLMMJGQX-KBXCAEBGSA-N 1 3 329.504 2.682 10 0 EFAEHO CC[N@H+](CCCN1CCN(C(C)C)CC1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812849989 1285476421 /nfs/dbraw/zinc/47/64/21/1285476421.db2.gz SKXIFBDQCIITJI-CTNGQTDRSA-N 1 3 347.547 2.847 10 0 EFAEHO CC[N@@H+](CCCN1CCN(C(C)C)CC1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812849989 1285476424 /nfs/dbraw/zinc/47/64/24/1285476424.db2.gz SKXIFBDQCIITJI-CTNGQTDRSA-N 1 3 347.547 2.847 10 0 EFAEHO C[C@@H]1C[NH2+]C[C@H]1CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1 ZINC000903432805 1312670949 /nfs/dbraw/zinc/67/09/49/1312670949.db2.gz KYXUPGMKBWMVSP-PMPSAXMXSA-N 1 3 348.466 2.515 10 0 EFAEHO O=C(NCCC[NH+]1CCCCC1)c1ccc(NC2=NCCC2)cc1 ZINC001135874342 1288527403 /nfs/dbraw/zinc/52/74/03/1288527403.db2.gz YISHMIZDPOTXHK-UHFFFAOYSA-N 1 3 328.460 2.897 10 0 EFAEHO CC[C@H](C)[C@H]1CN(Cc2ccc(C)nc2)CCN1C[C@@H]1C[NH2+]C[C@H]1C ZINC000903457556 1312711108 /nfs/dbraw/zinc/71/11/08/1312711108.db2.gz WXKLZZDIXCGQAA-KJNZLNQQSA-N 1 3 344.547 2.778 10 0 EFAEHO C[C@@H]1C[NH2+]C[C@H]1CN1CCC[C@@H](c2nc(-c3ccccc3)n[nH]2)C1 ZINC000903457718 1312711548 /nfs/dbraw/zinc/71/15/48/1312711548.db2.gz ZLAVNQDLYSOAKW-OIISXLGYSA-N 1 3 325.460 2.507 10 0 EFAEHO c1ccc(CCN2CCC([NH2+]C[C@@H]3Cc4ccccc4CN3)CC2)cc1 ZINC000873292606 1289707486 /nfs/dbraw/zinc/70/74/86/1289707486.db2.gz CAIUCNQBKUYURS-QHCPKHFHSA-N 1 3 349.522 2.998 10 0 EFAEHO Cc1cc([C@@H](N)CC(=O)NCC[NH+](C(C)C)C(C)C)cc(Cl)n1 ZINC000825738307 1290263161 /nfs/dbraw/zinc/26/31/61/1290263161.db2.gz ZLECTONTNZJSBX-HNNXBMFYSA-N 1 3 340.899 2.668 10 0 EFAEHO C[C@@H]1CN(CC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1CC[NH3+] ZINC000903495149 1312769424 /nfs/dbraw/zinc/76/94/24/1312769424.db2.gz XJAZJVUUNKXIEA-VXGBXAGGSA-N 1 3 329.366 2.561 10 0 EFAEHO C[C@@H]1CN([C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)C[C@H]1CC[NH3+] ZINC000903498708 1312776004 /nfs/dbraw/zinc/77/60/04/1312776004.db2.gz BPDYMNFWVXJUHX-HSMVNMDESA-N 1 3 339.842 2.501 10 0 EFAEHO C[C@@H]1CN([C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C[C@H]1CC[NH3+] ZINC000903498800 1312776279 /nfs/dbraw/zinc/77/62/79/1312776279.db2.gz FALWQPBDIBRGHD-XHBSWPGZSA-N 1 3 339.842 2.501 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N(CC)CCNCc2ccsc2)C1 ZINC001273569149 1291469478 /nfs/dbraw/zinc/46/94/78/1291469478.db2.gz KJTDJXCNOUSYEW-QGZVFWFLSA-N 1 3 337.533 2.808 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N(CC)CCNCc2ccsc2)C1 ZINC001273569149 1291469487 /nfs/dbraw/zinc/46/94/87/1291469487.db2.gz KJTDJXCNOUSYEW-QGZVFWFLSA-N 1 3 337.533 2.808 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@@H]([C@@H]2CCCN(CCF)C2)C1 ZINC001273598540 1292108265 /nfs/dbraw/zinc/10/82/65/1292108265.db2.gz DBNDUPUAHXHGTB-QZTJIDSGSA-N 1 3 341.515 2.638 10 0 EFAEHO CC[C@@H](C(=O)N(CC)CC[NH2+]Cc1ccc(Cl)c(F)c1)N(C)C ZINC001273610523 1292370611 /nfs/dbraw/zinc/37/06/11/1292370611.db2.gz PAXQLEKXULFSGR-INIZCTEOSA-N 1 3 343.874 2.757 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc2ccccc21)C(=O)Cc1c[nH]cn1 ZINC001273628341 1292719732 /nfs/dbraw/zinc/71/97/32/1292719732.db2.gz FAMNAEJKNUSOIN-UHFFFAOYSA-N 1 3 336.439 2.744 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+][C@@H]1CCc2ccccc21)N(C)C ZINC001276339633 1292949350 /nfs/dbraw/zinc/94/93/50/1292949350.db2.gz IHIIUANEWQDNRS-MOPGFXCFSA-N 1 3 331.504 2.698 10 0 EFAEHO C[C@H](CO[C@H]1CCOC1)[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000886539031 1295005380 /nfs/dbraw/zinc/00/53/80/1295005380.db2.gz RSWSGBFSVUNNQQ-VLQCVTHLSA-N 1 3 344.499 2.823 10 0 EFAEHO CO[C@H](C[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)[C@@H]1CCOC1 ZINC000886634580 1295073621 /nfs/dbraw/zinc/07/36/21/1295073621.db2.gz HLOIMZHCOQQKBM-HGJUEJDCSA-N 1 3 344.499 2.681 10 0 EFAEHO COC(=O)C1=CC[C@H]([NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C1 ZINC000886641844 1295083861 /nfs/dbraw/zinc/08/38/61/1295083861.db2.gz UDEBOQKNLCPZTM-FFGOWVMKSA-N 1 3 340.467 2.891 10 0 EFAEHO COC(=O)C1=CC[C@H](N[C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1 ZINC000886641844 1295083875 /nfs/dbraw/zinc/08/38/75/1295083875.db2.gz UDEBOQKNLCPZTM-FFGOWVMKSA-N 1 3 340.467 2.891 10 0 EFAEHO COC(=O)C1=CC[C@H](N[C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1 ZINC000886641844 1295083890 /nfs/dbraw/zinc/08/38/90/1295083890.db2.gz UDEBOQKNLCPZTM-FFGOWVMKSA-N 1 3 340.467 2.891 10 0 EFAEHO COC(=O)[C@@H]1CC[C@H]([NH2+]C[C@H]2CN(Cc3ccccc3)C[C@H]2C)C1 ZINC000886644312 1295084521 /nfs/dbraw/zinc/08/45/21/1295084521.db2.gz AADBCLWTFXJEDO-YSHGAJCASA-N 1 3 330.472 2.686 10 0 EFAEHO C[NH+]1CCC(C(=O)NCCCCCC2CCN(CCF)CC2)CC1 ZINC001273814802 1296058761 /nfs/dbraw/zinc/05/87/61/1296058761.db2.gz SMOCEFCDPNIMAU-UHFFFAOYSA-N 1 3 341.515 2.686 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)C1(N(C)C)CCC1)C2 ZINC001273841059 1296273441 /nfs/dbraw/zinc/27/34/41/1296273441.db2.gz QRVOQXCYBXOKJA-LJQANCHMSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCC[N@H+]1CC[C@@]2(C1)CCCN(C(=O)C1(N(C)C)CCC1)C2 ZINC001273841059 1296273456 /nfs/dbraw/zinc/27/34/56/1296273456.db2.gz QRVOQXCYBXOKJA-LJQANCHMSA-N 1 3 335.536 2.975 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@]2(CC[N@H+](CCCCCF)C2)C1 ZINC001273847769 1296288655 /nfs/dbraw/zinc/28/86/55/1296288655.db2.gz CVOSJGYQNOPHJN-LJQANCHMSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@]2(CC[N@@H+](CCCCCF)C2)C1 ZINC001273847769 1296288667 /nfs/dbraw/zinc/28/86/67/1296288667.db2.gz CVOSJGYQNOPHJN-LJQANCHMSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CCCC[C@H]1C[NH2+]CCC1CC1)N1CCCC1 ZINC001275784740 1296406774 /nfs/dbraw/zinc/40/67/74/1296406774.db2.gz XNHLHYVUCISMQO-ZWKOTPCHSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(C(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC001412684320 1296645100 /nfs/dbraw/zinc/64/51/00/1296645100.db2.gz HLHKDPVHGOOCSR-ZCNNSNEGSA-N 1 3 343.515 2.840 10 0 EFAEHO CN(C(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001412684286 1296646182 /nfs/dbraw/zinc/64/61/82/1296646182.db2.gz HLHKDPVHGOOCSR-VAMGGRTRSA-N 1 3 343.515 2.840 10 0 EFAEHO COc1cc([C@H](C)[NH2+]CC2(O)CCN(C)CC2)cc2ccccc21 ZINC000925117238 1296798950 /nfs/dbraw/zinc/79/89/50/1296798950.db2.gz OBJQQRARNVQORJ-HNNXBMFYSA-N 1 3 328.456 2.956 10 0 EFAEHO COc1cccc(N2CC[C@@H](C[NH2+][C@@H]3[C@@H]4CCCN[C@@H]4C3(C)C)C2)c1 ZINC000925565482 1296854184 /nfs/dbraw/zinc/85/41/84/1296854184.db2.gz RZRCBXBNBLTZHP-JOCLIGHLSA-N 1 3 343.515 2.888 10 0 EFAEHO COc1cccc(N2CC[C@H](C[NH2+][C@H]3[C@@H]4CCCN[C@@H]4C3(C)C)C2)c1 ZINC000925565484 1296855069 /nfs/dbraw/zinc/85/50/69/1296855069.db2.gz RZRCBXBNBLTZHP-XCLNPWKQSA-N 1 3 343.515 2.888 10 0 EFAEHO Cc1ccc([C@H](NC[C@@H]2CC3(CC[NH2+]CC3)C(=O)O2)C2CCC2)o1 ZINC000925851246 1296881901 /nfs/dbraw/zinc/88/19/01/1296881901.db2.gz QWTWRJOJULQRQR-DOTOQJQBSA-N 1 3 332.444 2.704 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN(Cc2cccc(F)c2)C(C)C)cnn1C ZINC000903883243 1313343708 /nfs/dbraw/zinc/34/37/08/1313343708.db2.gz GGJRGEXXDGOPNT-KRWDZBQOSA-N 1 3 332.467 2.896 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NC/C=C\C[NH2+]Cc1cc2ccccc2s1 ZINC001273911003 1297119864 /nfs/dbraw/zinc/11/98/64/1297119864.db2.gz RLSXZNNCZHPBGL-VGOKWCNXSA-N 1 3 343.496 2.758 10 0 EFAEHO Cc1c(C[C@H](CN)C[NH+]2CCC(C)(c3ccccc3)CC2)cnn1C ZINC000903891042 1313360538 /nfs/dbraw/zinc/36/05/38/1313360538.db2.gz IMLROJBBNKVAFA-GOSISDBHSA-N 1 3 340.515 2.900 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN2CCC(C)(c3ccccc3)CC2)cnn1C ZINC000903891042 1313360541 /nfs/dbraw/zinc/36/05/41/1313360541.db2.gz IMLROJBBNKVAFA-GOSISDBHSA-N 1 3 340.515 2.900 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN2CCC[C@@](C)(c3ccccc3)C2)cnn1C ZINC000903893272 1313364505 /nfs/dbraw/zinc/36/45/05/1313364505.db2.gz UHFWIZWFUAEAHW-GHTZIAJQSA-N 1 3 340.515 2.900 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+](CCc2cccc(F)c2)C2CC2)cnn1C ZINC000903893199 1313364882 /nfs/dbraw/zinc/36/48/82/1313364882.db2.gz SGLOWGYEVSCCRJ-KRWDZBQOSA-N 1 3 344.478 2.692 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+](CCc2cccc(F)c2)C2CC2)cnn1C ZINC000903893199 1313364887 /nfs/dbraw/zinc/36/48/87/1313364887.db2.gz SGLOWGYEVSCCRJ-KRWDZBQOSA-N 1 3 344.478 2.692 10 0 EFAEHO CC[C@@H](Cc1ccccc1)N(C)Cc1cnnn1[C@H]1CCC[NH2+]C1 ZINC000903894861 1313368488 /nfs/dbraw/zinc/36/84/88/1313368488.db2.gz GLBXZICUFDGTOQ-ROUUACIJSA-N 1 3 327.476 2.656 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2C[C@H](c3ccccc3)C[C@H]2C)cnn1C ZINC000903895654 1313369538 /nfs/dbraw/zinc/36/95/38/1313369538.db2.gz POAZDESIXXIWAI-WRWLIDTKSA-N 1 3 326.488 2.724 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2C[C@H](c3ccccc3)C[C@H]2C)cnn1C ZINC000903895654 1313369542 /nfs/dbraw/zinc/36/95/42/1313369542.db2.gz POAZDESIXXIWAI-WRWLIDTKSA-N 1 3 326.488 2.724 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CC[C@@H](c3ccccc3)[C@@H](C)C2)cnn1C ZINC000903896726 1313372138 /nfs/dbraw/zinc/37/21/38/1313372138.db2.gz DPUMKQNDYNEUTB-YRISNDGFSA-N 1 3 340.515 2.972 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CC[C@@H](c3ccccc3)[C@@H](C)C2)cnn1C ZINC000903896726 1313372140 /nfs/dbraw/zinc/37/21/40/1313372140.db2.gz DPUMKQNDYNEUTB-YRISNDGFSA-N 1 3 340.515 2.972 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@H]1C[C@@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001488774542 1297740106 /nfs/dbraw/zinc/74/01/06/1297740106.db2.gz VPSPFURCZJTJDR-OAFZBRQQSA-N 1 3 341.515 2.729 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CNCc2ccccc2C(F)(F)F)cnn1C ZINC000903922646 1313424476 /nfs/dbraw/zinc/42/44/76/1313424476.db2.gz BFTKKBBTOYFFHY-CYBMUJFWSA-N 1 3 340.393 2.655 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+](C)[C@@H](C)Cc2cccc(F)c2)cnn1C ZINC000903929978 1313434828 /nfs/dbraw/zinc/43/48/28/1313434828.db2.gz PAILZJQKPVBEOM-WMLDXEAASA-N 1 3 332.467 2.548 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+](C)[C@@H](C)Cc2cccc(F)c2)cnn1C ZINC000903929978 1313434831 /nfs/dbraw/zinc/43/48/31/1313434831.db2.gz PAILZJQKPVBEOM-WMLDXEAASA-N 1 3 332.467 2.548 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN(C)[C@@H](C)Cc2cccc(F)c2)cnn1C ZINC000903929978 1313434833 /nfs/dbraw/zinc/43/48/33/1313434833.db2.gz PAILZJQKPVBEOM-WMLDXEAASA-N 1 3 332.467 2.548 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN[C@@H]2CCc3ccc(Cl)cc32)cnn1C ZINC000903933973 1313442804 /nfs/dbraw/zinc/44/28/04/1313442804.db2.gz CJQAWKIVDMKBIM-FZKQIMNGSA-N 1 3 332.879 2.776 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]CC1CC(F)(F)C1 ZINC001489056214 1297987863 /nfs/dbraw/zinc/98/78/63/1297987863.db2.gz MLTKWCJDERKWNZ-ZBFHGGJFSA-N 1 3 345.478 2.589 10 0 EFAEHO CC1(C)C[C@@H]([NH3+])C[C@H](NCc2ccc(CN3CCCC3=O)cc2)C1 ZINC000925486196 1298158236 /nfs/dbraw/zinc/15/82/36/1298158236.db2.gz QEAFXUPQDLPJSI-ROUUACIJSA-N 1 3 329.488 2.805 10 0 EFAEHO CCc1ccc(CN2CC[C@H](NC(=O)CC[N@@H+](C)CC)[C@H]2C)cc1 ZINC001489301562 1298164910 /nfs/dbraw/zinc/16/49/10/1298164910.db2.gz RDSQGQITCUGMRM-APWZRJJASA-N 1 3 331.504 2.670 10 0 EFAEHO CCc1ccc(CN2CC[C@H](NC(=O)CC[N@H+](C)CC)[C@H]2C)cc1 ZINC001489301562 1298164917 /nfs/dbraw/zinc/16/49/17/1298164917.db2.gz RDSQGQITCUGMRM-APWZRJJASA-N 1 3 331.504 2.670 10 0 EFAEHO FC(F)(F)COc1cccc(C[NH2+]C[C@H]2CNCCC2(F)F)c1 ZINC000903954285 1313478869 /nfs/dbraw/zinc/47/88/69/1313478869.db2.gz CMAACFHLZCCEMS-GFCCVEGCSA-N 1 3 338.320 2.962 10 0 EFAEHO CCCOc1cc(C[NH2+]C[C@@H]2CNCCC2(F)F)ccc1OC ZINC000903955063 1313480844 /nfs/dbraw/zinc/48/08/44/1313480844.db2.gz JVUMOBPUZUCDGG-AWEZNQCLSA-N 1 3 328.403 2.818 10 0 EFAEHO FC1(F)CCNC[C@@H]1C[NH2+]Cc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000903955313 1313482432 /nfs/dbraw/zinc/48/24/32/1313482432.db2.gz OWVOEFBMWUIKAW-WBVHZDCISA-N 1 3 340.414 2.579 10 0 EFAEHO CCCOc1ccc(C[NH2+]C[C@@H]2CNCCC2(F)F)cc1OC ZINC000903955620 1313483170 /nfs/dbraw/zinc/48/31/70/1313483170.db2.gz XRTMOXIEBKRSID-AWEZNQCLSA-N 1 3 328.403 2.818 10 0 EFAEHO C[C@@H]1C[NH2+]C[C@H]1CCNCc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000903975068 1313522704 /nfs/dbraw/zinc/52/27/04/1313522704.db2.gz VVQJPQBYYJIHOB-TZMCWYRMSA-N 1 3 345.468 2.874 10 0 EFAEHO Fc1ccc(/C=C/CN2C[C@H]3CC[C@@H](C2)[N@H+]3C2CCNCC2)c(F)c1 ZINC000903980605 1313531607 /nfs/dbraw/zinc/53/16/07/1313531607.db2.gz VRAGWTMKEVHHLU-DOZUNQOLSA-N 1 3 347.453 2.879 10 0 EFAEHO Fc1ccc(/C=C/CN2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CCNCC2)c(F)c1 ZINC000903980605 1313531611 /nfs/dbraw/zinc/53/16/11/1313531611.db2.gz VRAGWTMKEVHHLU-DOZUNQOLSA-N 1 3 347.453 2.879 10 0 EFAEHO CN(CCCNC(=O)C1CC[NH+](C)CC1)Cc1ccc(Cl)s1 ZINC001490245102 1298671459 /nfs/dbraw/zinc/67/14/59/1298671459.db2.gz JELANEXHFJYOOM-UHFFFAOYSA-N 1 3 343.924 2.681 10 0 EFAEHO CC1CCN(CC(=O)NCCC[N@H+](CCC(F)(F)F)C2CC2)CC1 ZINC001490389873 1298813305 /nfs/dbraw/zinc/81/33/05/1298813305.db2.gz PJQOKBAHTPKEIV-UHFFFAOYSA-N 1 3 349.441 2.641 10 0 EFAEHO CC1CCN(CC(=O)NCCC[N@@H+](CCC(F)(F)F)C2CC2)CC1 ZINC001490389873 1298813315 /nfs/dbraw/zinc/81/33/15/1298813315.db2.gz PJQOKBAHTPKEIV-UHFFFAOYSA-N 1 3 349.441 2.641 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)C1CCN([C@H]2CCc3c2cccc3F)CC1 ZINC001490416592 1298894388 /nfs/dbraw/zinc/89/43/88/1298894388.db2.gz OPXGUDRANUPQBL-IBGZPJMESA-N 1 3 347.478 2.688 10 0 EFAEHO Cc1ccc(CN2CCC3(C[C@H]3NC(=O)CC[NH+](C)C)CC2)cc1F ZINC001490600074 1299025062 /nfs/dbraw/zinc/02/50/62/1299025062.db2.gz VQSOVHQXYYYHSR-GOSISDBHSA-N 1 3 347.478 2.557 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](NCc1ccccc1F)C1CC1 ZINC001490671397 1299070502 /nfs/dbraw/zinc/07/05/02/1299070502.db2.gz IUIDEOFHOFDTAA-MOPGFXCFSA-N 1 3 347.478 2.685 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](NCc1ccccc1F)C1CC1 ZINC001490671397 1299070513 /nfs/dbraw/zinc/07/05/13/1299070513.db2.gz IUIDEOFHOFDTAA-MOPGFXCFSA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CC1=CCCCC1)C1CC1 ZINC001490660089 1299101223 /nfs/dbraw/zinc/10/12/23/1299101223.db2.gz DSPKELFMPQJZOW-MOPGFXCFSA-N 1 3 333.520 2.844 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CC1=CCCCC1)C1CC1 ZINC001490660099 1299101365 /nfs/dbraw/zinc/10/13/65/1299101365.db2.gz DSPKELFMPQJZOW-RTBURBONSA-N 1 3 333.520 2.844 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)CN2CC[C@H](C)C2)C2CC2)cc1C ZINC001490708235 1299115515 /nfs/dbraw/zinc/11/55/15/1299115515.db2.gz AQJIXTOHLWFZPQ-YWZLYKJASA-N 1 3 343.515 2.630 10 0 EFAEHO CCCCC[NH2+][C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001490710067 1299119556 /nfs/dbraw/zinc/11/95/56/1299119556.db2.gz OCMFREBYYUQAMZ-APWZRJJASA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]([NH2+]CC2CCC3(CC3)CC2)C2CC2)C1 ZINC001490711709 1299122339 /nfs/dbraw/zinc/12/23/39/1299122339.db2.gz ZWQSCOCIFKQJSE-LPHOPBHVSA-N 1 3 347.547 2.783 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N1CCC[C@@H](CN(C)C/C=C\Cl)C1 ZINC001490758734 1299199096 /nfs/dbraw/zinc/19/90/96/1299199096.db2.gz MCOIORCJZPLOCT-HYHHROLSSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N1CCC[C@@H](CN(C)C/C=C\Cl)C1 ZINC001490758734 1299199098 /nfs/dbraw/zinc/19/90/98/1299199098.db2.gz MCOIORCJZPLOCT-HYHHROLSSA-N 1 3 341.927 2.782 10 0 EFAEHO CN(C/C=C\Cl)C[C@@H]1CCCN(C(=O)CCCC[NH+](C)C)C1 ZINC001490774426 1299231559 /nfs/dbraw/zinc/23/15/59/1299231559.db2.gz BTQGYKIHIQPXBI-BJIFSAINSA-N 1 3 329.916 2.641 10 0 EFAEHO CCOP(=O)(OCC)[C@H](O)CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000851777786 1299389313 /nfs/dbraw/zinc/38/93/13/1299389313.db2.gz BVWOQUZEOHOCRB-CVEARBPZSA-N 1 3 348.424 2.521 10 0 EFAEHO C[C@@H]1CN(CCCCCC[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)C[C@@H](C)C1=O ZINC000852474306 1299716925 /nfs/dbraw/zinc/71/69/25/1299716925.db2.gz OSKZRSPFDIPDQY-BRSBDYLESA-N 1 3 336.520 2.861 10 0 EFAEHO COC(=O)N(C)CCN(C)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000852566667 1299760434 /nfs/dbraw/zinc/76/04/34/1299760434.db2.gz HZMIFXSYXYNMTG-UHFFFAOYSA-N 1 3 333.476 2.803 10 0 EFAEHO Cc1ccc(N2CC[C@@H](N3CCC[C@H](C4CC[NH2+]CC4)C3)C2=O)cc1 ZINC000852754160 1299865147 /nfs/dbraw/zinc/86/51/47/1299865147.db2.gz QQJFRMUTWDBIDX-AZUAARDMSA-N 1 3 341.499 2.812 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)C=C1CC[NH2+]CC1)c1cccc(OC)c1 ZINC000852856976 1299915994 /nfs/dbraw/zinc/91/59/94/1299915994.db2.gz HWMALFIKPQWJJC-IBGZPJMESA-N 1 3 345.487 2.504 10 0 EFAEHO CN(C)CCN(Cc1cccc(Cl)c1)C(=O)C=C1CC[NH2+]CC1 ZINC000852883876 1299925814 /nfs/dbraw/zinc/92/58/14/1299925814.db2.gz QEBHDJHPJGZUTJ-UHFFFAOYSA-N 1 3 335.879 2.540 10 0 EFAEHO COc1ccc2c(c1)nccc2N1CCO[C@@H](CCC[NH+](C)C)C1 ZINC000853989592 1300379176 /nfs/dbraw/zinc/37/91/76/1300379176.db2.gz DCXJMBCJUVJCDL-INIZCTEOSA-N 1 3 329.444 2.790 10 0 EFAEHO C[S@@](=O)CC[N@@H+]1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000854044309 1300403972 /nfs/dbraw/zinc/40/39/72/1300403972.db2.gz FUYLAOORDKQCJZ-NTKDMRAZSA-N 1 3 348.556 2.988 10 0 EFAEHO C[S@@](=O)CC[N@H+]1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000854044309 1300403976 /nfs/dbraw/zinc/40/39/76/1300403976.db2.gz FUYLAOORDKQCJZ-NTKDMRAZSA-N 1 3 348.556 2.988 10 0 EFAEHO CN1CC[C@@]2(CC[N@H+](C[C@@H](O)COc3ccc4ccccc4c3)C2)C1 ZINC000795333463 1300788767 /nfs/dbraw/zinc/78/87/67/1300788767.db2.gz KXGXICZMBSVEMO-TZIWHRDSSA-N 1 3 340.467 2.607 10 0 EFAEHO CN1CC[C@@]2(CC[N@@H+](C[C@@H](O)COc3ccc4ccccc4c3)C2)C1 ZINC000795333463 1300788776 /nfs/dbraw/zinc/78/87/76/1300788776.db2.gz KXGXICZMBSVEMO-TZIWHRDSSA-N 1 3 340.467 2.607 10 0 EFAEHO CN1CC[C@@]2(CC[N@H+](C[C@H](O)COc3ccc4ccccc4c3)C2)C1 ZINC000795333460 1300788997 /nfs/dbraw/zinc/78/89/97/1300788997.db2.gz KXGXICZMBSVEMO-PZJWPPBQSA-N 1 3 340.467 2.607 10 0 EFAEHO CN1CC[C@@]2(CC[N@@H+](C[C@H](O)COc3ccc4ccccc4c3)C2)C1 ZINC000795333460 1300789002 /nfs/dbraw/zinc/78/90/02/1300789002.db2.gz KXGXICZMBSVEMO-PZJWPPBQSA-N 1 3 340.467 2.607 10 0 EFAEHO C/C(=C\C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1cccc(F)c1 ZINC000855346382 1300924402 /nfs/dbraw/zinc/92/44/02/1300924402.db2.gz ZMKLQQXEHUAHBV-STTHAQSSSA-N 1 3 335.467 2.617 10 0 EFAEHO C/C(=C\C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1cccc(F)c1 ZINC000855346382 1300924409 /nfs/dbraw/zinc/92/44/09/1300924409.db2.gz ZMKLQQXEHUAHBV-STTHAQSSSA-N 1 3 335.467 2.617 10 0 EFAEHO C/C(=C/C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccc(F)cc1 ZINC000855346077 1300924516 /nfs/dbraw/zinc/92/45/16/1300924516.db2.gz NKWQJKYENGTDTD-KGAUPUERSA-N 1 3 335.467 2.617 10 0 EFAEHO C/C(=C/C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccc(F)cc1 ZINC000855346077 1300924520 /nfs/dbraw/zinc/92/45/20/1300924520.db2.gz NKWQJKYENGTDTD-KGAUPUERSA-N 1 3 335.467 2.617 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)/C=C/c1ccccc1Cl ZINC000855345978 1300924626 /nfs/dbraw/zinc/92/46/26/1300924626.db2.gz LSQNFHRIGJTXDP-NKSUMMKUSA-N 1 3 337.895 2.741 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)/C=C/c1ccccc1Cl ZINC000855345978 1300924629 /nfs/dbraw/zinc/92/46/29/1300924629.db2.gz LSQNFHRIGJTXDP-NKSUMMKUSA-N 1 3 337.895 2.741 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Cc1coc2cc(F)ccc12 ZINC000855346102 1300924810 /nfs/dbraw/zinc/92/48/10/1300924810.db2.gz OKYRBBGSMPPGEL-AWEZNQCLSA-N 1 3 349.450 2.503 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Cc1coc2cc(F)ccc12 ZINC000855346102 1300924816 /nfs/dbraw/zinc/92/48/16/1300924816.db2.gz OKYRBBGSMPPGEL-AWEZNQCLSA-N 1 3 349.450 2.503 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N[C@@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC000855814798 1301130300 /nfs/dbraw/zinc/13/03/00/1301130300.db2.gz LBHCNWQOQVGSTD-BEFAXECRSA-N 1 3 339.499 2.722 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC000855814798 1301130306 /nfs/dbraw/zinc/13/03/06/1301130306.db2.gz LBHCNWQOQVGSTD-BEFAXECRSA-N 1 3 339.499 2.722 10 0 EFAEHO CO[C@@H]1CN(C)[C@@](C)(COC(=O)c2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000861350931 1302094836 /nfs/dbraw/zinc/09/48/36/1302094836.db2.gz GEIMFJIAIHCHSL-AZUAARDMSA-N 1 3 346.471 2.548 10 0 EFAEHO CCOC(=O)C(F)(F)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCNC23CCC3)C1 ZINC000863482485 1302627917 /nfs/dbraw/zinc/62/79/17/1302627917.db2.gz IPMVXKMJBPTGEH-HZSPNIEDSA-N 1 3 330.419 2.618 10 0 EFAEHO C[C@H](CCCCN1C(=O)c2ccccc2C1=O)N[C@@H]1CC[C@@H](C)[NH2+]C1 ZINC000863548283 1302645806 /nfs/dbraw/zinc/64/58/06/1302645806.db2.gz WSUMXUHXZFGWPY-BZUAXINKSA-N 1 3 343.471 2.572 10 0 EFAEHO CC[NH+]1CCC(CNCc2cc(Br)cnc2OC)CC1 ZINC000865450847 1303263302 /nfs/dbraw/zinc/26/33/02/1303263302.db2.gz HJUSYRSTPVTNIT-UHFFFAOYSA-N 1 3 342.281 2.674 10 0 EFAEHO CN1CCCC[C@H](C[NH2+]CC23CC(C2)CN3C(=O)OC(C)(C)C)C1 ZINC000865640143 1303344499 /nfs/dbraw/zinc/34/44/99/1303344499.db2.gz DLMKJIKTGQYEJJ-MDCZIUGASA-N 1 3 337.508 2.707 10 0 EFAEHO CCC[NH+]1CCC(NC[C@H]2CN(Cc3ccccc3C)CCO2)CC1 ZINC000866509598 1303667543 /nfs/dbraw/zinc/66/75/43/1303667543.db2.gz ZCEOORQAVWVRNU-NRFANRHFSA-N 1 3 345.531 2.660 10 0 EFAEHO CCCN1CCC([NH2+]C[C@H]2CN(Cc3ccccc3C)CCO2)CC1 ZINC000866509598 1303667553 /nfs/dbraw/zinc/66/75/53/1303667553.db2.gz ZCEOORQAVWVRNU-NRFANRHFSA-N 1 3 345.531 2.660 10 0 EFAEHO CC[NH+]1CCC(N[C@H]2COc3cccc(Br)c3C2)CC1 ZINC000866594151 1303702862 /nfs/dbraw/zinc/70/28/62/1303702862.db2.gz AVJGYTVEQGVAAE-CYBMUJFWSA-N 1 3 339.277 2.827 10 0 EFAEHO CC(C)(C)[C@@]1(CN)CC[N@H+](CCC(=O)Nc2cc(F)cc(F)c2)C1 ZINC000866705936 1303759860 /nfs/dbraw/zinc/75/98/60/1303759860.db2.gz KBIPFHPCWMLIHB-GOSISDBHSA-N 1 3 339.430 2.990 10 0 EFAEHO CC(C)(C)[C@@]1(CN)CC[N@@H+](CCC(=O)Nc2cc(F)cc(F)c2)C1 ZINC000866705936 1303759864 /nfs/dbraw/zinc/75/98/64/1303759864.db2.gz KBIPFHPCWMLIHB-GOSISDBHSA-N 1 3 339.430 2.990 10 0 EFAEHO COc1ccc(NC(=O)CC[N@@H+]2CC[C@@](CN)(C(C)(C)C)C2)cc1 ZINC000866705687 1303760665 /nfs/dbraw/zinc/76/06/65/1303760665.db2.gz HEKYQMMXXRGSEC-IBGZPJMESA-N 1 3 333.476 2.721 10 0 EFAEHO COc1ccc(NC(=O)CC[N@H+]2CC[C@@](CN)(C(C)(C)C)C2)cc1 ZINC000866705687 1303760667 /nfs/dbraw/zinc/76/06/67/1303760667.db2.gz HEKYQMMXXRGSEC-IBGZPJMESA-N 1 3 333.476 2.721 10 0 EFAEHO C[C@@H]1CCN(C(=O)CCC23CC(C2)C[NH2+]3)CCN1Cc1ccccc1 ZINC000870895711 1305666349 /nfs/dbraw/zinc/66/63/49/1305666349.db2.gz IOUSFBMRRJGHDD-FQVISZRSSA-N 1 3 341.499 2.642 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001265073321 1316712153 /nfs/dbraw/zinc/71/21/53/1316712153.db2.gz XBIOWKFCOLHVPQ-HNNXBMFYSA-N 1 3 333.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001265073321 1316712155 /nfs/dbraw/zinc/71/21/55/1316712155.db2.gz XBIOWKFCOLHVPQ-HNNXBMFYSA-N 1 3 333.467 2.590 10 0 EFAEHO CC1CCN([C@@H](CNC(=O)C23CC[NH+](CC2)C3)c2ccccc2)CC1 ZINC000900320586 1307964346 /nfs/dbraw/zinc/96/43/46/1307964346.db2.gz HDRSPSVVIHYJQE-IBGZPJMESA-N 1 3 341.499 2.672 10 0 EFAEHO c1nc2cc(C[NH2+]C3CCN(C[C@H]4CCOC4)CC3)ccc2s1 ZINC001413129128 1308098210 /nfs/dbraw/zinc/09/82/10/1308098210.db2.gz SBVXRQLNBFYCII-OAHLLOKOSA-N 1 3 331.485 2.887 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)CC1C2CC3CC(C2)CC1C3 ZINC001413267239 1309219257 /nfs/dbraw/zinc/21/92/57/1309219257.db2.gz LPFAQOBJVVOLJL-ZZRKNQPCSA-N 1 3 349.563 2.837 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)CC1C2CC3CC(C2)CC1C3 ZINC001413267239 1309219266 /nfs/dbraw/zinc/21/92/66/1309219266.db2.gz LPFAQOBJVVOLJL-ZZRKNQPCSA-N 1 3 349.563 2.837 10 0 EFAEHO C[C@@H]1C[N@@H+](C2CC2)C[C@H]1NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC000901028434 1309230519 /nfs/dbraw/zinc/23/05/19/1309230519.db2.gz ZWVUYNQULLJUGM-CXAGYDPISA-N 1 3 326.444 2.503 10 0 EFAEHO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC000901028434 1309230523 /nfs/dbraw/zinc/23/05/23/1309230523.db2.gz ZWVUYNQULLJUGM-CXAGYDPISA-N 1 3 326.444 2.503 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@H+](CC3CCCC3)CC[C@H]21 ZINC001490984656 1311149212 /nfs/dbraw/zinc/14/92/12/1311149212.db2.gz UTLZWGUXNUKPOP-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@@H+](CC3CCCC3)CC[C@H]21 ZINC001490984656 1311149214 /nfs/dbraw/zinc/14/92/14/1311149214.db2.gz UTLZWGUXNUKPOP-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)NCc1ccc(Cl)s1 ZINC001491487087 1311192237 /nfs/dbraw/zinc/19/22/37/1311192237.db2.gz UHTQLRYARMEMQJ-STQMWFEESA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)NCc1ccc(Cl)s1 ZINC001491487087 1311192239 /nfs/dbraw/zinc/19/22/39/1311192239.db2.gz UHTQLRYARMEMQJ-STQMWFEESA-N 1 3 343.924 2.870 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]CCCCC(F)(F)F)CC1)N1CCCC1 ZINC001277132844 1311677714 /nfs/dbraw/zinc/67/77/14/1311677714.db2.gz KKOBSENSFYYBQO-UHFFFAOYSA-N 1 3 349.441 2.832 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@H](C2CCN(C(=O)[C@H]3CCCN3C)CC2)C1 ZINC001277276423 1311912030 /nfs/dbraw/zinc/91/20/30/1311912030.db2.gz ZVBQFDCNCNKMDU-IKLBINMZSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@H](C2CCN(C(=O)[C@H]3CCCN3C)CC2)C1 ZINC001277276423 1311912033 /nfs/dbraw/zinc/91/20/33/1311912033.db2.gz ZVBQFDCNCNKMDU-IKLBINMZSA-N 1 3 347.547 2.997 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@@H](C)c2cccc(-n3ccnc3)c2)CC1 ZINC000902744672 1312070919 /nfs/dbraw/zinc/07/09/19/1312070919.db2.gz FCRKFQOLCTVYQM-SFHVURJKSA-N 1 3 341.503 2.551 10 0 EFAEHO CC[C@H](F)CN1CC[C@@H](CNC(=O)C2(C[NH+](C)C)CCCCC2)C1 ZINC001493223678 1312085539 /nfs/dbraw/zinc/08/55/39/1312085539.db2.gz OGQRVPCFFBKVFV-IRXDYDNUSA-N 1 3 341.515 2.685 10 0 EFAEHO C[C@@H](NC[C@H](C)C[NH+]1CCCC1)C1(NC(=O)OC(C)(C)C)CC1 ZINC000903071734 1312325487 /nfs/dbraw/zinc/32/54/87/1312325487.db2.gz AQXPFTUOZDHGHW-LSDHHAIUSA-N 1 3 325.497 2.754 10 0 EFAEHO C[C@@H]([NH2+]C[C@H](C)CN1CCCC1)C1(NC(=O)OC(C)(C)C)CC1 ZINC000903071734 1312325489 /nfs/dbraw/zinc/32/54/89/1312325489.db2.gz AQXPFTUOZDHGHW-LSDHHAIUSA-N 1 3 325.497 2.754 10 0 EFAEHO CCCCC[N@@H+]1CCC[C@@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001277465522 1312331897 /nfs/dbraw/zinc/33/18/97/1312331897.db2.gz PIXQUZRAOSGARH-LJQANCHMSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCC[N@H+]1CCC[C@@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001277465522 1312331900 /nfs/dbraw/zinc/33/19/00/1312331900.db2.gz PIXQUZRAOSGARH-LJQANCHMSA-N 1 3 335.536 2.975 10 0 EFAEHO CCN(CC)Cc1cc([C@H](C)[NH2+]C2CC(CC(N)=O)C2)ccc1OC ZINC000903258962 1312514295 /nfs/dbraw/zinc/51/42/95/1312514295.db2.gz FJVBZYDMUABNIR-SYJJWHGVSA-N 1 3 347.503 2.842 10 0 EFAEHO CN(CC(=O)N1CC[C@@](C)(C[NH2+]CCc2cccs2)C1)C1CCC1 ZINC001278505353 1314928701 /nfs/dbraw/zinc/92/87/01/1314928701.db2.gz QQCMNRRXUZUPEO-IBGZPJMESA-N 1 3 349.544 2.603 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@](C)(C[NH2+]CCc3ccccc3)C2)CCC1 ZINC001278505991 1314934527 /nfs/dbraw/zinc/93/45/27/1314934527.db2.gz WHBSGSKASPEVCC-FQEVSTJZSA-N 1 3 343.515 2.542 10 0 EFAEHO CN(C(=O)C(C)(C)N1CCCCC1)[C@@H]1CC[N@H+](CCCCCF)C1 ZINC001318402960 1328575900 /nfs/dbraw/zinc/57/59/00/1328575900.db2.gz OLPMTOJXYGPACG-QGZVFWFLSA-N 1 3 341.515 2.923 10 0 EFAEHO CN(C(=O)C(C)(C)N1CCCCC1)[C@@H]1CC[N@@H+](CCCCCF)C1 ZINC001318402960 1328575907 /nfs/dbraw/zinc/57/59/07/1328575907.db2.gz OLPMTOJXYGPACG-QGZVFWFLSA-N 1 3 341.515 2.923 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H](C[NH2+]CCc2cccs2)C1 ZINC001278613404 1315293581 /nfs/dbraw/zinc/29/35/81/1315293581.db2.gz LBKOXLFQZNVPJT-HZPDHXFCSA-N 1 3 337.533 2.505 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@H](C)C1)C1CC[NH+](CCCCCF)CC1 ZINC001279096620 1316148847 /nfs/dbraw/zinc/14/88/47/1316148847.db2.gz CLTYMJYFWVCFHW-DLBZAZTESA-N 1 3 341.515 2.685 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@@H+]2CCC2=CCCCC2)C1 ZINC001264373637 1316608696 /nfs/dbraw/zinc/60/86/96/1316608696.db2.gz XTQRXPBHWKVNJE-MJGOQNOKSA-N 1 3 333.520 2.751 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@H+]2CCC2=CCCCC2)C1 ZINC001264373637 1316608699 /nfs/dbraw/zinc/60/86/99/1316608699.db2.gz XTQRXPBHWKVNJE-MJGOQNOKSA-N 1 3 333.520 2.751 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]CCC(C)(C)C ZINC001264568421 1316632606 /nfs/dbraw/zinc/63/26/06/1316632606.db2.gz WNBKQVOYYVWBAH-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H](C)[C@H]2CCC[NH2+]CC2CC2)C1 ZINC001264575996 1316633768 /nfs/dbraw/zinc/63/37/68/1316633768.db2.gz CLOJPQXFVARDPY-YQVWRLOYSA-N 1 3 335.536 2.735 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)CCCNC(=O)C2(N(C)C)CCC2)c1 ZINC001264995197 1316683194 /nfs/dbraw/zinc/68/31/94/1316683194.db2.gz XMDAGZJUICLCOK-INIZCTEOSA-N 1 3 347.503 2.679 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)CCCNC(=O)C2(N(C)C)CCC2)c1 ZINC001264995197 1316683198 /nfs/dbraw/zinc/68/31/98/1316683198.db2.gz XMDAGZJUICLCOK-INIZCTEOSA-N 1 3 347.503 2.679 10 0 EFAEHO C[C@H](c1ccccc1F)N(C)CCCNC(=O)C12CCC[NH+]1CCC2 ZINC001265007641 1316687362 /nfs/dbraw/zinc/68/73/62/1316687362.db2.gz ZKXBYPYOHPVSHO-MRXNPFEDSA-N 1 3 347.478 2.953 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@H+](C)[C@@H]1CCc2ccccc21)N(C)C ZINC001265032525 1316695896 /nfs/dbraw/zinc/69/58/96/1316695896.db2.gz XOTIRNAUYXXNKF-RTBURBONSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@@H+](C)[C@@H]1CCc2ccccc21)N(C)C ZINC001265032525 1316695898 /nfs/dbraw/zinc/69/58/98/1316695898.db2.gz XOTIRNAUYXXNKF-RTBURBONSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@H+](C)[C@H]1CCc2ccccc21)N(C)C ZINC001265032524 1316696041 /nfs/dbraw/zinc/69/60/41/1316696041.db2.gz XOTIRNAUYXXNKF-RBUKOAKNSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@@H+](C)[C@H]1CCc2ccccc21)N(C)C ZINC001265032524 1316696044 /nfs/dbraw/zinc/69/60/44/1316696044.db2.gz XOTIRNAUYXXNKF-RBUKOAKNSA-N 1 3 331.504 2.698 10 0 EFAEHO Cc1ncccc1CN(C)CCCNC(=O)[C@H](C)[NH+]1CCCCCC1 ZINC001265043157 1316699543 /nfs/dbraw/zinc/69/95/43/1316699543.db2.gz CQUPRJYDMSNUDV-SFHVURJKSA-N 1 3 346.519 2.593 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1cc(C)ccc1C ZINC001265133924 1316731957 /nfs/dbraw/zinc/73/19/57/1316731957.db2.gz CFYZIMZRPQOOKJ-SFHVURJKSA-N 1 3 345.531 2.973 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1cc(C)ccc1C ZINC001265133924 1316731959 /nfs/dbraw/zinc/73/19/59/1316731959.db2.gz CFYZIMZRPQOOKJ-SFHVURJKSA-N 1 3 345.531 2.973 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](CC)Cc1cnccc1C ZINC001265147535 1316738138 /nfs/dbraw/zinc/73/81/38/1316738138.db2.gz ANTUABYIVHDDPS-LJQANCHMSA-N 1 3 346.519 2.593 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](CC)Cc1cnccc1C ZINC001265147535 1316738143 /nfs/dbraw/zinc/73/81/43/1316738143.db2.gz ANTUABYIVHDDPS-LJQANCHMSA-N 1 3 346.519 2.593 10 0 EFAEHO CCCCC[N@@H+]1CCC[C@@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001265224774 1316759694 /nfs/dbraw/zinc/75/96/94/1316759694.db2.gz KCBSOHSOMLXZAU-VQIMIIECSA-N 1 3 341.515 2.970 10 0 EFAEHO CCCCC[N@H+]1CCC[C@@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001265224774 1316759696 /nfs/dbraw/zinc/75/96/96/1316759696.db2.gz KCBSOHSOMLXZAU-VQIMIIECSA-N 1 3 341.515 2.970 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)N[C@@H]1CCCN(CC2=CCCCC2)C1 ZINC001265235985 1316763634 /nfs/dbraw/zinc/76/36/34/1316763634.db2.gz ZUUZREDURDCEEV-LJQANCHMSA-N 1 3 333.520 2.943 10 0 EFAEHO CCCCC[N@H+](C)C[C@@H]1CCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001265390761 1316795756 /nfs/dbraw/zinc/79/57/56/1316795756.db2.gz MRZWCRJIOGAMLC-ROUUACIJSA-N 1 3 325.541 2.933 10 0 EFAEHO CCCCC[N@@H+](C)C[C@@H]1CCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001265390761 1316795758 /nfs/dbraw/zinc/79/57/58/1316795758.db2.gz MRZWCRJIOGAMLC-ROUUACIJSA-N 1 3 325.541 2.933 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H](C[NH2+]CCC3CCCC3)C2)C1 ZINC001265623914 1316837365 /nfs/dbraw/zinc/83/73/65/1316837365.db2.gz GUATYUMHXDAGPM-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC2CCC([NH2+]CCCC3CCC3)CC2)C1 ZINC001265739639 1316869749 /nfs/dbraw/zinc/86/97/49/1316869749.db2.gz UIXHVDODGPSPSY-IVMQYODDSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@@H](c1ccccc1F)N(C)CCCNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001265848329 1316890857 /nfs/dbraw/zinc/89/08/57/1316890857.db2.gz IKRCEHUEGDNBMS-ZMSDIMECSA-N 1 3 335.467 2.665 10 0 EFAEHO C[C@@H](c1ccccc1F)N(C)CCCNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001265848329 1316890860 /nfs/dbraw/zinc/89/08/60/1316890860.db2.gz IKRCEHUEGDNBMS-ZMSDIMECSA-N 1 3 335.467 2.665 10 0 EFAEHO C[C@@H](c1cccc(F)c1)[N@H+](C)CCCNC(=O)CN(C)C1CCC1 ZINC001265862893 1316895864 /nfs/dbraw/zinc/89/58/64/1316895864.db2.gz KYQJMZMAUNOHJW-HNNXBMFYSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H](c1cccc(F)c1)[N@@H+](C)CCCNC(=O)CN(C)C1CCC1 ZINC001265862893 1316895867 /nfs/dbraw/zinc/89/58/67/1316895867.db2.gz KYQJMZMAUNOHJW-HNNXBMFYSA-N 1 3 335.467 2.809 10 0 EFAEHO CC(C)Oc1cccc(C[N@H+](C)CCCNC(=O)[C@H]2CCCN2C)c1 ZINC001265901718 1316907635 /nfs/dbraw/zinc/90/76/35/1316907635.db2.gz BKYXLBCNVNSIIG-LJQANCHMSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)Oc1cccc(C[N@@H+](C)CCCNC(=O)[C@H]2CCCN2C)c1 ZINC001265901718 1316907637 /nfs/dbraw/zinc/90/76/37/1316907637.db2.gz BKYXLBCNVNSIIG-LJQANCHMSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)Cc1c(C)cc(C)cc1C)N(C)C ZINC001265925673 1316915923 /nfs/dbraw/zinc/91/59/23/1316915923.db2.gz VOOOROQLBIATFB-IBGZPJMESA-N 1 3 333.520 2.890 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)Cc1c(C)cc(C)cc1C)N(C)C ZINC001265925673 1316915927 /nfs/dbraw/zinc/91/59/27/1316915927.db2.gz VOOOROQLBIATFB-IBGZPJMESA-N 1 3 333.520 2.890 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)Cc1cc(C)sc1C)N(C)C ZINC001265954940 1316927432 /nfs/dbraw/zinc/92/74/32/1316927432.db2.gz XRBZPGCVMVIJRH-INIZCTEOSA-N 1 3 325.522 2.643 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)Cc1cc(C)sc1C)N(C)C ZINC001265954940 1316927434 /nfs/dbraw/zinc/92/74/34/1316927434.db2.gz XRBZPGCVMVIJRH-INIZCTEOSA-N 1 3 325.522 2.643 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCCC[N@H+](C)CC2CCCC2)c1 ZINC001265978442 1316936349 /nfs/dbraw/zinc/93/63/49/1316936349.db2.gz NOCHYNWXTJBGMP-UHFFFAOYSA-N 1 3 331.504 2.990 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCCC[N@@H+](C)CC2CCCC2)c1 ZINC001265978442 1316936352 /nfs/dbraw/zinc/93/63/52/1316936352.db2.gz NOCHYNWXTJBGMP-UHFFFAOYSA-N 1 3 331.504 2.990 10 0 EFAEHO CC(C)CC[NH2+]C[C@@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001266015704 1316954249 /nfs/dbraw/zinc/95/42/49/1316954249.db2.gz JRXFVXDMEWOEEU-QFBILLFUSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCCN(CC)Cc2ccccc2F)CC[N@@H+]1C ZINC001266043200 1316970549 /nfs/dbraw/zinc/97/05/49/1316970549.db2.gz VHNFICUKQVNVEW-PKOBYXMFSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCCN(CC)Cc2ccccc2F)CC[N@H+]1C ZINC001266043200 1316970554 /nfs/dbraw/zinc/97/05/54/1316970554.db2.gz VHNFICUKQVNVEW-PKOBYXMFSA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@H]2CCC[C@@H]3CCC[N@@H+]32)c1 ZINC001367540306 1338846211 /nfs/dbraw/zinc/84/62/11/1338846211.db2.gz GIMXFCWSTNRJDC-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@H]2CCC[C@@H]3CCC[N@H+]32)c1 ZINC001367540306 1338846214 /nfs/dbraw/zinc/84/62/14/1338846214.db2.gz GIMXFCWSTNRJDC-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001266049607 1316976425 /nfs/dbraw/zinc/97/64/25/1316976425.db2.gz YBZASIRMHZVCGS-ACAQERRYSA-N 1 3 341.927 2.974 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001266049607 1316976429 /nfs/dbraw/zinc/97/64/29/1316976429.db2.gz YBZASIRMHZVCGS-ACAQERRYSA-N 1 3 341.927 2.974 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1cccc(C)c1 ZINC001266082578 1317007900 /nfs/dbraw/zinc/00/79/00/1317007900.db2.gz KGRNUXNLJFOPEU-SFHVURJKSA-N 1 3 331.504 2.665 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1cccc(C)c1 ZINC001266082578 1317007908 /nfs/dbraw/zinc/00/79/08/1317007908.db2.gz KGRNUXNLJFOPEU-SFHVURJKSA-N 1 3 331.504 2.665 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1ccc(C)c(C)c1 ZINC001266083144 1317010109 /nfs/dbraw/zinc/01/01/09/1317010109.db2.gz VHKLEILNJFXRDV-KRWDZBQOSA-N 1 3 345.531 2.973 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1ccc(C)c(C)c1 ZINC001266083144 1317010116 /nfs/dbraw/zinc/01/01/16/1317010116.db2.gz VHKLEILNJFXRDV-KRWDZBQOSA-N 1 3 345.531 2.973 10 0 EFAEHO CC[C@@H](C(=O)N[C@](C)(C[NH2+]CC=C(Cl)Cl)C1CC1)N(C)C ZINC001318726757 1328677962 /nfs/dbraw/zinc/67/79/62/1328677962.db2.gz BJOCENODTPXIGY-SWLSCSKDSA-N 1 3 336.307 2.520 10 0 EFAEHO CC[C@@H](C(=O)N[C@@](C)(C[NH2+]CC=C(Cl)Cl)C1CC1)N(C)C ZINC001318726758 1328678447 /nfs/dbraw/zinc/67/84/47/1328678447.db2.gz BJOCENODTPXIGY-WFASDCNBSA-N 1 3 336.307 2.520 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@@H]1CCCN(CC2=CCCCC2)C1 ZINC001266222145 1317163009 /nfs/dbraw/zinc/16/30/09/1317163009.db2.gz OMGSSJXKOYMPBK-MOPGFXCFSA-N 1 3 333.520 2.942 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@@H]1CCCN(CC2=CCCCC2)C1 ZINC001266222145 1317163012 /nfs/dbraw/zinc/16/30/12/1317163012.db2.gz OMGSSJXKOYMPBK-MOPGFXCFSA-N 1 3 333.520 2.942 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]CC2CCCCCC2)C1 ZINC001280153079 1317466063 /nfs/dbraw/zinc/46/60/63/1317466063.db2.gz PONKFUUGTBXLLY-RBUKOAKNSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001280184002 1317471247 /nfs/dbraw/zinc/47/12/47/1317471247.db2.gz CNLFDVCKQKENTD-VQTJNVASSA-N 1 3 345.531 2.909 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@@H]1CCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001280198672 1317474251 /nfs/dbraw/zinc/47/42/51/1317474251.db2.gz VIFDKFMKTMDBNK-PKOBYXMFSA-N 1 3 343.515 2.665 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](CC[NH2+]Cc2cc(F)ccc2C)C1)N(C)C ZINC001280263467 1317490475 /nfs/dbraw/zinc/49/04/75/1317490475.db2.gz HOAWZMSRJORJOE-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@H]1CC[C@H](NC(=O)Cc2nc[nH]c2C)CC1 ZINC001280379189 1317533888 /nfs/dbraw/zinc/53/38/88/1317533888.db2.gz XXWNIYYORHPAQT-DBUSCRMASA-N 1 3 332.492 2.882 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CC[NH+](CC1=CCCCC1)CC2 ZINC001280394502 1317541284 /nfs/dbraw/zinc/54/12/84/1317541284.db2.gz PCYKMMJXPIKMOL-UHFFFAOYSA-N 1 3 333.520 2.751 10 0 EFAEHO CCC/C=C\CC[NH+]1CCC2(CN(C(=O)[C@@H](CC)N(C)C)C2)CC1 ZINC001280394784 1317541301 /nfs/dbraw/zinc/54/13/01/1317541301.db2.gz YSPKFTOSUMQULX-CNZFZVQHSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC(CC[NH2+]CC[C@H](C)F)CC1)N(C)C ZINC001318895413 1328734794 /nfs/dbraw/zinc/73/47/94/1328734794.db2.gz HAEFCSWKOZAPRB-RDJZCZTQSA-N 1 3 329.504 2.539 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@@]2(CCN(C/C=C\Cl)C2)C1 ZINC001281098479 1318012642 /nfs/dbraw/zinc/01/26/42/1318012642.db2.gz CQUPCWSSUOHAAE-TWVNLXSWSA-N 1 3 341.927 2.785 10 0 EFAEHO O=C(CN1CCCC1)N1CCC(CC[NH2+]CCCC2CCC2)CC1 ZINC001318930998 1328744198 /nfs/dbraw/zinc/74/41/98/1328744198.db2.gz KLIDVCKRVAJVFA-UHFFFAOYSA-N 1 3 335.536 2.881 10 0 EFAEHO CN(CC(=O)N(C)C1CCC([NH2+]CCCF)CC1)CC(C)(C)C ZINC001282271068 1318819119 /nfs/dbraw/zinc/81/91/19/1318819119.db2.gz OBLKYNBHZSJLDU-UHFFFAOYSA-N 1 3 329.504 2.683 10 0 EFAEHO CN(C(=O)Cc1c[nH]cn1)C1CCC([NH2+]CCCC2CCC2)CC1 ZINC001282271307 1318819191 /nfs/dbraw/zinc/81/91/91/1318819191.db2.gz ULVHOFZJGDPPKT-UHFFFAOYSA-N 1 3 332.492 2.892 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC2(C1)CCN(C(=O)CN1CC[C@H](C)C1)CC2 ZINC001319145107 1328790787 /nfs/dbraw/zinc/79/07/87/1328790787.db2.gz OFZSOHWDZSZZFB-HMECNJMJSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC2(C1)CCN(C(=O)CN1CC[C@H](C)C1)CC2 ZINC001319145107 1328790792 /nfs/dbraw/zinc/79/07/92/1328790792.db2.gz OFZSOHWDZSZZFB-HMECNJMJSA-N 1 3 347.547 2.999 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H](C[NH2+]C/C=C\c3ccccc3)C2)CCC1 ZINC001283051370 1319289222 /nfs/dbraw/zinc/28/92/22/1319289222.db2.gz IMLZIULQRZLCBG-DZPBPQJMSA-N 1 3 341.499 2.669 10 0 EFAEHO C[C@@H]1[C@H](NCC=C(Cl)Cl)CCN1C(=O)CCCC[NH+](C)C ZINC001283925092 1320095717 /nfs/dbraw/zinc/09/57/17/1320095717.db2.gz BTINUYNGXHHDGF-CHWSQXEVSA-N 1 3 336.307 2.616 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@]12CCC[C@H]1N(CCC(F)(F)F)CC2 ZINC001284068279 1320176621 /nfs/dbraw/zinc/17/66/21/1320176621.db2.gz DXQHEKPYBNURRD-ZBFHGGJFSA-N 1 3 349.441 2.784 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)C(C)(C)N2CCCC2)CCC[N@@H+]1CCCCCF ZINC001284130962 1320220609 /nfs/dbraw/zinc/22/06/09/1320220609.db2.gz OIDJWDBVDFTOJT-IAGOWNOFSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)C(C)(C)N2CCCC2)CCC[N@H+]1CCCCCF ZINC001284130962 1320220613 /nfs/dbraw/zinc/22/06/13/1320220613.db2.gz OIDJWDBVDFTOJT-IAGOWNOFSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H]1[C@@H](NC(=O)C(C)(C)N2CCCC2)CCC[N@@H+]1CCCCCF ZINC001284130963 1320220691 /nfs/dbraw/zinc/22/06/91/1320220691.db2.gz OIDJWDBVDFTOJT-IRXDYDNUSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H]1[C@@H](NC(=O)C(C)(C)N2CCCC2)CCC[N@H+]1CCCCCF ZINC001284130963 1320220696 /nfs/dbraw/zinc/22/06/96/1320220696.db2.gz OIDJWDBVDFTOJT-IRXDYDNUSA-N 1 3 341.515 2.970 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H](C[NH2+]CC=C(Cl)Cl)C1 ZINC001284241941 1320282238 /nfs/dbraw/zinc/28/22/38/1320282238.db2.gz LULCATUVYSXUBL-QWHCGFSZSA-N 1 3 336.307 2.522 10 0 EFAEHO CC[C@H](C(=O)N1C[C@H]([NH2+]CCCc2ccccc2)C(C)(C)C1)N(C)C ZINC001284293191 1320307361 /nfs/dbraw/zinc/30/73/61/1320307361.db2.gz NQECUEPKKMPBGB-MOPGFXCFSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)(C)[C@H](C[NH2+]C/C=C/Cl)NC(=O)C(C)(C)N1CCCC1 ZINC001284613264 1320439795 /nfs/dbraw/zinc/43/97/95/1320439795.db2.gz CSCAVSWKIBTQSD-VFNNOXKTSA-N 1 3 329.916 2.734 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2C[C@H]([NH2+]CCCC3CCCC3)C2)C1 ZINC001316637022 1320731573 /nfs/dbraw/zinc/73/15/73/1320731573.db2.gz TXTRCFFPDXPRFF-BHIYHBOVSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1ccc(CCC[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001319533926 1328911119 /nfs/dbraw/zinc/91/11/19/1328911119.db2.gz LJWJOPYMIDRUEC-RBUKOAKNSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H](C)C[NH2+]C/C=C\c1ccccc1)N(C)C ZINC001319563704 1328918962 /nfs/dbraw/zinc/91/89/62/1328918962.db2.gz WTJXDXVRTWGUEC-FXKMFSNRSA-N 1 3 331.504 2.723 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H](NC(=O)C1(N(C)C)CCC1)C1CCCCC1 ZINC001319658046 1328940964 /nfs/dbraw/zinc/94/09/64/1328940964.db2.gz UTMNPSKXHDHLCL-WBVHZDCISA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C[NH2+]CCF)C1CCCCC1 ZINC001319662266 1328943179 /nfs/dbraw/zinc/94/31/79/1328943179.db2.gz IGZGHKZHXLNEAN-MSOLQXFVSA-N 1 3 341.515 2.874 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]Cc1ccc(F)cc1 ZINC001319770523 1328983415 /nfs/dbraw/zinc/98/34/15/1328983415.db2.gz SZIMEEFIPNZJIE-RTBURBONSA-N 1 3 347.478 2.781 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@@H]1CC[NH2+]CCCC1CCC1 ZINC001319778534 1328986284 /nfs/dbraw/zinc/98/62/84/1328986284.db2.gz MTKVIYCTOYMMDJ-GOSISDBHSA-N 1 3 332.492 2.893 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCCCN2C(=O)Cc2c[nH]cn2)cc1 ZINC001319779349 1328987028 /nfs/dbraw/zinc/98/70/28/1328987028.db2.gz SIQNOHHCHQBYCA-IBGZPJMESA-N 1 3 340.471 2.822 10 0 EFAEHO Cc1ncccc1C[NH2+]CC[C@@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001319789624 1328990455 /nfs/dbraw/zinc/99/04/55/1328990455.db2.gz CFUBOQAGPSPFGW-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CC[C@@H]([NH2+]CCCC3CCC3)C2)CCC1 ZINC001316652705 1322194933 /nfs/dbraw/zinc/19/49/33/1322194933.db2.gz OGPFFDLJUMOPRZ-ZWKOTPCHSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@H]1C(=O)NC[C@H](C)NCc1ccccc1F ZINC001491603474 1323781451 /nfs/dbraw/zinc/78/14/51/1323781451.db2.gz UEGOMQDXBABOOY-YJBOKZPZSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@H]1C(=O)NC[C@H](C)NCc1ccccc1F ZINC001491603474 1323781455 /nfs/dbraw/zinc/78/14/55/1323781455.db2.gz UEGOMQDXBABOOY-YJBOKZPZSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@H]1C(=O)NC[C@@H](C)NCc1ccccc1F ZINC001491603472 1323781857 /nfs/dbraw/zinc/78/18/57/1323781857.db2.gz UEGOMQDXBABOOY-QAPCUYQASA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@H]1C(=O)NC[C@@H](C)NCc1ccccc1F ZINC001491603472 1323781864 /nfs/dbraw/zinc/78/18/64/1323781864.db2.gz UEGOMQDXBABOOY-QAPCUYQASA-N 1 3 335.467 2.683 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[NH2+]C[C@H]2CCCC(F)(F)C2)C1 ZINC001491849730 1323944131 /nfs/dbraw/zinc/94/41/31/1323944131.db2.gz LBPCAYARRWIGHA-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]Cc2ccc(Cl)s2)C1 ZINC001491856027 1323950621 /nfs/dbraw/zinc/95/06/21/1323950621.db2.gz NEYVCBCYERZXKK-ZDUSSCGKSA-N 1 3 343.924 2.680 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)[C@@H]1CCCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001491924391 1324039261 /nfs/dbraw/zinc/03/92/61/1324039261.db2.gz BXZMOCRZQOIAEV-IAGOWNOFSA-N 1 3 341.515 2.922 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)[C@@H]1CCCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001491924391 1324039269 /nfs/dbraw/zinc/03/92/69/1324039269.db2.gz BXZMOCRZQOIAEV-IAGOWNOFSA-N 1 3 341.515 2.922 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NCC[C@@H](C)NC/C(Cl)=C\Cl ZINC001492022647 1324134645 /nfs/dbraw/zinc/13/46/45/1324134645.db2.gz VKXCQDSHDQXMIJ-QGBLLJAOSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NCC[C@@H](C)NC/C(Cl)=C\Cl ZINC001492022647 1324134647 /nfs/dbraw/zinc/13/46/47/1324134647.db2.gz VKXCQDSHDQXMIJ-QGBLLJAOSA-N 1 3 336.307 2.663 10 0 EFAEHO CN(C)C1(C(=O)N2CCCC[C@@H]2C[NH2+]CCCCCF)CCC1 ZINC001317189196 1324189428 /nfs/dbraw/zinc/18/94/28/1324189428.db2.gz HULBCZIRZURQQC-MRXNPFEDSA-N 1 3 327.488 2.581 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cccc(Cl)c1 ZINC001492082364 1324242010 /nfs/dbraw/zinc/24/20/10/1324242010.db2.gz CNSVCONWYWQFRI-LSDHHAIUSA-N 1 3 337.895 2.666 10 0 EFAEHO CC(C)(C(=O)NCCC[C@H]1CCC[N@@H+]1CCCF)N1CCCCC1 ZINC001492153936 1324278370 /nfs/dbraw/zinc/27/83/70/1324278370.db2.gz BOSNWUURQUJSIR-KRWDZBQOSA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)(C(=O)NCCC[C@H]1CCC[N@H+]1CCCF)N1CCCCC1 ZINC001492153936 1324278380 /nfs/dbraw/zinc/27/83/80/1324278380.db2.gz BOSNWUURQUJSIR-KRWDZBQOSA-N 1 3 341.515 2.971 10 0 EFAEHO CN(CCNC(=O)C1CC[NH+](C)CC1)Cc1ccc(C2CCC2)cc1 ZINC001492401539 1324485271 /nfs/dbraw/zinc/48/52/71/1324485271.db2.gz BNQJWNIJJUGGJD-UHFFFAOYSA-N 1 3 343.515 2.844 10 0 EFAEHO CC/C=C\CC[N@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001492423235 1324501163 /nfs/dbraw/zinc/50/11/63/1324501163.db2.gz NMAVLZSHFZWJQW-ZEVQVBBLSA-N 1 3 327.488 2.603 10 0 EFAEHO CC/C=C\CC[N@@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001492423235 1324501171 /nfs/dbraw/zinc/50/11/71/1324501171.db2.gz NMAVLZSHFZWJQW-ZEVQVBBLSA-N 1 3 327.488 2.603 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001320548491 1329160598 /nfs/dbraw/zinc/16/05/98/1329160598.db2.gz LJUGMOHNJBYNHR-SJORKVTESA-N 1 3 331.504 2.575 10 0 EFAEHO C[C@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)[C@@H]1CC[NH2+]CCF ZINC001316683444 1324569055 /nfs/dbraw/zinc/56/90/55/1324569055.db2.gz DNAOEPIMQDYXMX-QFBILLFUSA-N 1 3 349.494 2.938 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+](C)CCCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001316850293 1324692772 /nfs/dbraw/zinc/69/27/72/1324692772.db2.gz DMGPKHNJGUIZGQ-QGZVFWFLSA-N 1 3 331.504 2.583 10 0 EFAEHO Cc1ccc(C)c(C[N@H+](C)CCCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001316850293 1324692784 /nfs/dbraw/zinc/69/27/84/1324692784.db2.gz DMGPKHNJGUIZGQ-QGZVFWFLSA-N 1 3 331.504 2.583 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](C)CCCCC(F)(F)F ZINC001317471672 1324770608 /nfs/dbraw/zinc/77/06/08/1324770608.db2.gz NPANTBAJMGBDKW-AWEZNQCLSA-N 1 3 337.430 2.641 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](C)CCCCC(F)(F)F ZINC001317471672 1324770612 /nfs/dbraw/zinc/77/06/12/1324770612.db2.gz NPANTBAJMGBDKW-AWEZNQCLSA-N 1 3 337.430 2.641 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H](C)NC(=O)[C@H](C(C)C)N(C)C)cc1F ZINC001320615735 1329179331 /nfs/dbraw/zinc/17/93/31/1329179331.db2.gz VODIJCVNUFPHPO-QAPCUYQASA-N 1 3 337.483 2.705 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C)c1 ZINC001316861752 1324903441 /nfs/dbraw/zinc/90/34/41/1324903441.db2.gz FTWNUINMUPOCNI-IBGZPJMESA-N 1 3 333.520 2.828 10 0 EFAEHO Cc1ccc(C)c(C[N@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C)c1 ZINC001316861752 1324903447 /nfs/dbraw/zinc/90/34/47/1324903447.db2.gz FTWNUINMUPOCNI-IBGZPJMESA-N 1 3 333.520 2.828 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C)c1 ZINC001316862330 1324912274 /nfs/dbraw/zinc/91/22/74/1324912274.db2.gz NBUIGJBLHOAUEE-IBGZPJMESA-N 1 3 333.520 2.828 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C)c1 ZINC001316862330 1324912279 /nfs/dbraw/zinc/91/22/79/1324912279.db2.gz NBUIGJBLHOAUEE-IBGZPJMESA-N 1 3 333.520 2.828 10 0 EFAEHO Cc1ccc(CN(C)CCCNC(=O)[C@H]2CCC[N@H+]2C(C)C)c(C)n1 ZINC001316826207 1325181407 /nfs/dbraw/zinc/18/14/07/1325181407.db2.gz YZNOXPBMMCUZGL-LJQANCHMSA-N 1 3 346.519 2.509 10 0 EFAEHO Cc1ccc(CN(C)CCCNC(=O)[C@H]2CCC[N@@H+]2C(C)C)c(C)n1 ZINC001316826207 1325181415 /nfs/dbraw/zinc/18/14/15/1325181415.db2.gz YZNOXPBMMCUZGL-LJQANCHMSA-N 1 3 346.519 2.509 10 0 EFAEHO C[C@@H](c1cccc(F)c1)[N@H+](C)CCCNC(=O)CN1CC[C@@H](C)C1 ZINC001316851469 1325222441 /nfs/dbraw/zinc/22/24/41/1325222441.db2.gz XLINNXVDEKGIBI-CVEARBPZSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@@H](c1cccc(F)c1)[N@@H+](C)CCCNC(=O)CN1CC[C@@H](C)C1 ZINC001316851469 1325222451 /nfs/dbraw/zinc/22/24/51/1325222451.db2.gz XLINNXVDEKGIBI-CVEARBPZSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](C)[C@@H]2CCc3ccc(F)cc32)C1 ZINC001316851159 1325222610 /nfs/dbraw/zinc/22/26/10/1325222610.db2.gz QITXDGXBHXAKIG-HNAYVOBHSA-N 1 3 347.478 2.593 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](C)[C@@H]2CCc3ccc(F)cc32)C1 ZINC001316851159 1325222620 /nfs/dbraw/zinc/22/26/20/1325222620.db2.gz QITXDGXBHXAKIG-HNAYVOBHSA-N 1 3 347.478 2.593 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](CC2CC(C)(C)C2)C2CC2)C1 ZINC001316922651 1325358696 /nfs/dbraw/zinc/35/86/96/1325358696.db2.gz CSCQYMGQUYSAJN-INIZCTEOSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](CC2CC(C)(C)C2)C2CC2)C1 ZINC001316922651 1325358705 /nfs/dbraw/zinc/35/87/05/1325358705.db2.gz CSCQYMGQUYSAJN-INIZCTEOSA-N 1 3 335.536 2.735 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C1CC[NH+](CCCCCF)CC1 ZINC001316938026 1325388270 /nfs/dbraw/zinc/38/82/70/1325388270.db2.gz SKMFXDDBBPAANG-SFHVURJKSA-N 1 3 341.515 2.923 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[N@H+](C)CC2=CCCCC2)C1 ZINC001317038155 1325505048 /nfs/dbraw/zinc/50/50/48/1325505048.db2.gz BAVQOOZCEOUBTR-IBGZPJMESA-N 1 3 335.536 2.999 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[N@@H+](C)CC2=CCCCC2)C1 ZINC001317038155 1325505056 /nfs/dbraw/zinc/50/50/56/1325505056.db2.gz BAVQOOZCEOUBTR-IBGZPJMESA-N 1 3 335.536 2.999 10 0 EFAEHO CC(C)=CC[N@@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001317041670 1325509535 /nfs/dbraw/zinc/50/95/35/1325509535.db2.gz VSDXZIOFIRQSLA-LJQANCHMSA-N 1 3 335.536 2.855 10 0 EFAEHO CC(C)=CC[N@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001317041670 1325509542 /nfs/dbraw/zinc/50/95/42/1325509542.db2.gz VSDXZIOFIRQSLA-LJQANCHMSA-N 1 3 335.536 2.855 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@H]([NH2+]CCCc2ccsc2)C1 ZINC001317069944 1325540443 /nfs/dbraw/zinc/54/04/43/1325540443.db2.gz VATUXXPGURRBPK-ROUUACIJSA-N 1 3 349.544 2.746 10 0 EFAEHO CCN(CC[NH2+]Cc1ccccc1C1CC1)C(=O)[C@H]1CCCN1C ZINC001320811756 1329305346 /nfs/dbraw/zinc/30/53/46/1329305346.db2.gz RTPFQZQXUIPZBW-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO CC[C@H](C(=O)N(CC)CC[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001320900527 1329316653 /nfs/dbraw/zinc/31/66/53/1329316653.db2.gz FCWMYRDBRXJWRV-QGZVFWFLSA-N 1 3 339.911 2.927 10 0 EFAEHO CC[C@@H](C(=O)N(CC)CC[NH2+]Cc1ccc(F)c(Cl)c1)N(C)C ZINC001320902511 1329316908 /nfs/dbraw/zinc/31/69/08/1329316908.db2.gz XAKFFFWRSFTCDQ-INIZCTEOSA-N 1 3 343.874 2.757 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C/C=C\CNC(=O)CN(C)C1CCC1 ZINC001321097298 1329342772 /nfs/dbraw/zinc/34/27/72/1329342772.db2.gz VJTJQQVVICDZME-PLNGDYQASA-N 1 3 329.488 2.550 10 0 EFAEHO C[C@@H](NC/C=C\CNC(=O)C12CCC[NH+]1CCC2)c1cccc(F)c1 ZINC001321142476 1329348446 /nfs/dbraw/zinc/34/84/46/1329348446.db2.gz SYCJOEPGJNPPKI-RXYHWBRQSA-N 1 3 345.462 2.777 10 0 EFAEHO O=C(NC/C=C/CNC/C=C\Cl)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001321208988 1329357045 /nfs/dbraw/zinc/35/70/45/1329357045.db2.gz MYYIAYGAXRFWQN-FZRUWKMVSA-N 1 3 339.911 2.798 10 0 EFAEHO O=C(NC/C=C/CNC/C=C\Cl)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001321208988 1329357048 /nfs/dbraw/zinc/35/70/48/1329357048.db2.gz MYYIAYGAXRFWQN-FZRUWKMVSA-N 1 3 339.911 2.798 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC/C=C/C[NH2+]Cc2ccccc2C2CC2)C1 ZINC001321248676 1329362611 /nfs/dbraw/zinc/36/26/11/1329362611.db2.gz DDXCLXRAKGXLOQ-LAQIPUCWSA-N 1 3 341.499 2.668 10 0 EFAEHO CCCCC[NH2+]C/C=C/CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001321252166 1329363685 /nfs/dbraw/zinc/36/36/85/1329363685.db2.gz UWDNRDRDAMWYJU-BLGFXRMMSA-N 1 3 327.488 2.651 10 0 EFAEHO Cc1cc(C[NH2+]C/C=C/CNC(=O)CN2CCC(C)CC2)cs1 ZINC001321302535 1329370158 /nfs/dbraw/zinc/37/01/58/1329370158.db2.gz FKIQVVSZPSRULL-ONEGZZNKSA-N 1 3 335.517 2.550 10 0 EFAEHO CN(CC(=O)N1CC[C@H](C[NH2+]CCc2ccccc2)C1)CC(C)(C)C ZINC001317337946 1327867393 /nfs/dbraw/zinc/86/73/93/1327867393.db2.gz NUDSFSKGKNMUCQ-LJQANCHMSA-N 1 3 345.531 2.645 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@H]([NH2+]CCCCCF)C2)CCC1 ZINC001317352535 1327884676 /nfs/dbraw/zinc/88/46/76/1327884676.db2.gz RENUORMDELNCPI-HOTGVXAUSA-N 1 3 327.488 2.628 10 0 EFAEHO CC1CC(C[N@@H+]2CCC[C@@H]2CCCNC(=O)C2(N(C)C)CCC2)C1 ZINC001317422217 1327982762 /nfs/dbraw/zinc/98/27/62/1327982762.db2.gz FWQICPXFDXUAPN-ABHNRTSZSA-N 1 3 335.536 2.878 10 0 EFAEHO CC1CC(C[N@H+]2CCC[C@@H]2CCCNC(=O)C2(N(C)C)CCC2)C1 ZINC001317422217 1327982768 /nfs/dbraw/zinc/98/27/68/1327982768.db2.gz FWQICPXFDXUAPN-ABHNRTSZSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001321542235 1329394474 /nfs/dbraw/zinc/39/44/74/1329394474.db2.gz RDINHEJKPVZJMU-QGZVFWFLSA-N 1 3 331.504 2.506 10 0 EFAEHO C[C@H](C[NH2+]C/C=C/c1ccccc1)NC(=O)CN(C)CC(C)(C)C ZINC001321652293 1329401374 /nfs/dbraw/zinc/40/13/74/1329401374.db2.gz HBWPRTBNUIGHRF-XLNAKTSKSA-N 1 3 331.504 2.772 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@@H]2CC[N@H+](CC3=CCCCC3)C2)CCC1 ZINC001317788991 1328378414 /nfs/dbraw/zinc/37/84/14/1328378414.db2.gz MPWQJECSBPYKDG-GOSISDBHSA-N 1 3 333.520 2.799 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@@H]2CC[N@@H+](CC3=CCCCC3)C2)CCC1 ZINC001317788991 1328378420 /nfs/dbraw/zinc/37/84/20/1328378420.db2.gz MPWQJECSBPYKDG-GOSISDBHSA-N 1 3 333.520 2.799 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@@H](C[N@H+](C)CCCCCF)C1 ZINC001317861474 1328423209 /nfs/dbraw/zinc/42/32/09/1328423209.db2.gz ASNZBDRQQPMQLQ-ROUUACIJSA-N 1 3 341.515 2.781 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@@H](C[N@@H+](C)CCCCCF)C1 ZINC001317861474 1328423213 /nfs/dbraw/zinc/42/32/13/1328423213.db2.gz ASNZBDRQQPMQLQ-ROUUACIJSA-N 1 3 341.515 2.781 10 0 EFAEHO CN(CC(=O)NCC1C[NH+](CCC2=CCCCC2)C1)CC(C)(C)C ZINC001318155460 1328509463 /nfs/dbraw/zinc/50/94/63/1328509463.db2.gz QGTDMBKHZNVBKA-UHFFFAOYSA-N 1 3 335.536 2.903 10 0 EFAEHO Cc1ccccc1[C@H](C)N1CC(CNC(=O)CCCC[NH+](C)C)C1 ZINC001318168279 1328510615 /nfs/dbraw/zinc/51/06/15/1328510615.db2.gz BYUBKBCBVJVQQV-KRWDZBQOSA-N 1 3 331.504 2.836 10 0 EFAEHO CC(C)=CCN(C)C[C@@H](C)NC(=O)c1ccc(CC[NH+](C)C)cc1 ZINC001322243707 1329440405 /nfs/dbraw/zinc/44/04/05/1329440405.db2.gz IPSKEFIWMRQBMH-QGZVFWFLSA-N 1 3 331.504 2.807 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[NH2+]Cc2ccc(CF)cc2)CCC1 ZINC001322542347 1329466235 /nfs/dbraw/zinc/46/62/35/1329466235.db2.gz AFAQSLUAWWDVDI-UHFFFAOYSA-N 1 3 335.467 2.579 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001322555746 1329467102 /nfs/dbraw/zinc/46/71/02/1329467102.db2.gz VGYANFJUOZDFHL-SFHVURJKSA-N 1 3 337.552 2.981 10 0 EFAEHO CC1CC(C[NH2+]CCCN(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001322694706 1329480636 /nfs/dbraw/zinc/48/06/36/1329480636.db2.gz TUFAVRVIWUOLIW-LADRWXRNSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)CN1CCCC1)c1ccc2c(c1)CCC2 ZINC001322834730 1329492766 /nfs/dbraw/zinc/49/27/66/1329492766.db2.gz GQDNTARAMHSWTP-QGZVFWFLSA-N 1 3 343.515 2.770 10 0 EFAEHO Cc1ccncc1CN(C)CCCN(C)C(=O)C[NH+]1[C@@H](C)CC[C@@H]1C ZINC001380990954 1348010160 /nfs/dbraw/zinc/01/01/60/1348010160.db2.gz WDUGCPZIOKBHNN-ROUUACIJSA-N 1 3 346.519 2.543 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]CCCC(C)C ZINC001323166569 1329518980 /nfs/dbraw/zinc/51/89/80/1329518980.db2.gz DCQYPUYJYHUHAA-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCN1CCC1=CCCCC1)[NH+]1CCCC1 ZINC001323276743 1329530187 /nfs/dbraw/zinc/53/01/87/1329530187.db2.gz IDIIVDAIDULXFN-SFHVURJKSA-N 1 3 333.520 2.942 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)NC[C@H]1CCN1CCC1=CCCCC1 ZINC001323357406 1329537365 /nfs/dbraw/zinc/53/73/65/1329537365.db2.gz NWCDLDWGLLIEFX-LJQANCHMSA-N 1 3 333.520 2.943 10 0 EFAEHO C[C@@H](NCC=C(Cl)Cl)[C@@H](C)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001381410541 1348252421 /nfs/dbraw/zinc/25/24/21/1348252421.db2.gz ZPBMHVJYEOLCGY-CHWSQXEVSA-N 1 3 348.318 2.664 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CCCc2ccccc2)CCN1C(=O)CN1CCCC1 ZINC001324098525 1329599981 /nfs/dbraw/zinc/59/99/81/1329599981.db2.gz RPFPHMPGKKEQOE-QUCCMNQESA-N 1 3 343.515 2.684 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC[C@@H]2CNCC=C(Cl)Cl)CC[N@H+]1C ZINC001324214374 1329608727 /nfs/dbraw/zinc/60/87/27/1329608727.db2.gz XDIPUBUYUCHSID-MELADBBJSA-N 1 3 348.318 2.616 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@H]1C[NH2+]CCc1ccccc1Cl ZINC001324207048 1329607993 /nfs/dbraw/zinc/60/79/93/1329607993.db2.gz NDCPAWYZHARBEH-FUHWJXTLSA-N 1 3 349.906 2.557 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC[C@@H]2CNCC=C(Cl)Cl)CC[N@@H+]1C ZINC001324214374 1329608725 /nfs/dbraw/zinc/60/87/25/1329608725.db2.gz XDIPUBUYUCHSID-MELADBBJSA-N 1 3 348.318 2.616 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+]CCC(F)(F)F)C2CCCC2)CCC1 ZINC001324483309 1329631927 /nfs/dbraw/zinc/63/19/27/1329631927.db2.gz QNRAYBNPZMMTHJ-AWEZNQCLSA-N 1 3 349.441 2.688 10 0 EFAEHO CCCCC[N@@H+]1CCC[C@@](C)(CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001324977656 1329664645 /nfs/dbraw/zinc/66/46/45/1329664645.db2.gz RJLRFDDUDULAJO-HKUYNNGSSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCCC[N@H+]1CCC[C@@](C)(CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001324977656 1329664647 /nfs/dbraw/zinc/66/46/47/1329664647.db2.gz RJLRFDDUDULAJO-HKUYNNGSSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]C/C=C/c2ccccc2)C1 ZINC001325582819 1329698908 /nfs/dbraw/zinc/69/89/08/1329698908.db2.gz SDPNLAWHOUAEDM-QYLKWSRPSA-N 1 3 343.515 2.726 10 0 EFAEHO CCc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@H]3CCCN3C)C2)cc1 ZINC001326334459 1329748160 /nfs/dbraw/zinc/74/81/60/1329748160.db2.gz RXVSVUAVEKMQAY-WOJBJXKFSA-N 1 3 343.515 2.671 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@H]2CCN(C(=O)Cc3c[nH]cn3)C2)c1 ZINC001326372607 1329751014 /nfs/dbraw/zinc/75/10/14/1329751014.db2.gz VPWLYXKZWWILOK-KRWDZBQOSA-N 1 3 340.471 2.597 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CC[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001326436879 1329756596 /nfs/dbraw/zinc/75/65/96/1329756596.db2.gz GPSNNIZCKWAHQB-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001326437261 1329756717 /nfs/dbraw/zinc/75/67/17/1329756717.db2.gz JWEBRIYLFBDQKS-MRXNPFEDSA-N 1 3 337.533 2.725 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1CC[C@H](C[NH2+]CC[C@@H](C)F)CC1 ZINC001326512879 1330308936 /nfs/dbraw/zinc/30/89/36/1330308936.db2.gz OPDXFDUMHUWESE-TVFCKZIOSA-N 1 3 341.515 2.872 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@H]1CC[C@H](NC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001326542774 1330314512 /nfs/dbraw/zinc/31/45/12/1330314512.db2.gz ZNVXSQNJFNQISJ-FNMLWVPJSA-N 1 3 335.536 2.949 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N2CCCC[C@@H]2CNCC=C(Cl)Cl)C1 ZINC001326760069 1330361008 /nfs/dbraw/zinc/36/10/08/1330361008.db2.gz DMIBJHFGTMRISD-ZIAGYGMSSA-N 1 3 348.318 2.618 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N2CCCC[C@@H]2CNCC=C(Cl)Cl)C1 ZINC001326760069 1330361012 /nfs/dbraw/zinc/36/10/12/1330361012.db2.gz DMIBJHFGTMRISD-ZIAGYGMSSA-N 1 3 348.318 2.618 10 0 EFAEHO Cc1cncc(CN2CCC[C@H](NC(=O)CCCC[NH+](C)C)CC2)c1 ZINC001327164894 1330434670 /nfs/dbraw/zinc/43/46/70/1330434670.db2.gz YKOUNJDTCNQZHD-IBGZPJMESA-N 1 3 346.519 2.593 10 0 EFAEHO CCCCCN1Cc2ccccc2C[C@H]1CNC(=O)[C@H]1CC[N@H+](C)C1 ZINC001327510991 1330492568 /nfs/dbraw/zinc/49/25/68/1330492568.db2.gz ALYMJBJYZOTCOI-PMACEKPBSA-N 1 3 343.515 2.671 10 0 EFAEHO CCCCCN1Cc2ccccc2C[C@H]1CNC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001327510991 1330492570 /nfs/dbraw/zinc/49/25/70/1330492570.db2.gz ALYMJBJYZOTCOI-PMACEKPBSA-N 1 3 343.515 2.671 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H](NC(=O)Cc2nc[nH]c2C)C(C)(C)C1 ZINC001328099195 1330555072 /nfs/dbraw/zinc/55/50/72/1330555072.db2.gz SVXQONAHHARUEH-DKRLNXSXSA-N 1 3 332.492 2.834 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H](NC(=O)Cc2nc[nH]c2C)C(C)(C)C1 ZINC001328099195 1330555075 /nfs/dbraw/zinc/55/50/75/1330555075.db2.gz SVXQONAHHARUEH-DKRLNXSXSA-N 1 3 332.492 2.834 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@H](NC(=O)Cc2nc[nH]c2C)C(C)(C)C1 ZINC001328099201 1330555163 /nfs/dbraw/zinc/55/51/63/1330555163.db2.gz SVXQONAHHARUEH-TUYSUELWSA-N 1 3 332.492 2.834 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@H](NC(=O)Cc2nc[nH]c2C)C(C)(C)C1 ZINC001328099201 1330555165 /nfs/dbraw/zinc/55/51/65/1330555165.db2.gz SVXQONAHHARUEH-TUYSUELWSA-N 1 3 332.492 2.834 10 0 EFAEHO Cc1ccncc1CN1CC[C@H](NC(=O)CCCC[NH+](C)C)C[C@H]1C ZINC001328282270 1330581319 /nfs/dbraw/zinc/58/13/19/1330581319.db2.gz GJYDHYIBAMLIMN-MJGOQNOKSA-N 1 3 346.519 2.591 10 0 EFAEHO CCCCC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN1CC[C@H](C)C1 ZINC001328693329 1330616417 /nfs/dbraw/zinc/61/64/17/1330616417.db2.gz HLCMXCCVIWVQST-LDQXTDLNSA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC2CC(C[NH2+]CCCC3CCCC3)C2)C1 ZINC001328915864 1330646104 /nfs/dbraw/zinc/64/61/04/1330646104.db2.gz QRJVHJQMCKCOBH-IVMQYODDSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001329051025 1330661288 /nfs/dbraw/zinc/66/12/88/1330661288.db2.gz AGFSVALCDAQRHQ-MSOLQXFVSA-N 1 3 345.531 2.895 10 0 EFAEHO CN(CC(C)(C)C[NH2+]CCCF)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001329336127 1330695360 /nfs/dbraw/zinc/69/53/60/1330695360.db2.gz WOWWRHFYRUWSMY-GOSISDBHSA-N 1 3 347.494 2.633 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCc2ccsc2)C[C@H]1C ZINC001332048598 1330909220 /nfs/dbraw/zinc/90/92/20/1330909220.db2.gz LGXVBSXZKJXWQI-WBVHZDCISA-N 1 3 337.533 2.602 10 0 EFAEHO CC(C)CCC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]21 ZINC001332157084 1330930360 /nfs/dbraw/zinc/93/03/60/1330930360.db2.gz INEXGZGUMXXKEB-IPMKNSEASA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@@H](F)CN[C@@H]1CN(C(=O)CCCC[NH+]2CCCC2)CC1(C)C ZINC001332451717 1330973391 /nfs/dbraw/zinc/97/33/91/1330973391.db2.gz DZCDSAMPJDTRMZ-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1cc(CN2CC=C(CNC(=O)CC[NH+](C)C)CC2)c(C)s1 ZINC001333389515 1331130802 /nfs/dbraw/zinc/13/08/02/1331130802.db2.gz BYWKYIGJQKEKDS-UHFFFAOYSA-N 1 3 335.517 2.565 10 0 EFAEHO CCCN(C(=O)CN(C)C(C)C)C1CC[NH+](CC[C@H](C)F)CC1 ZINC001479996410 1333019684 /nfs/dbraw/zinc/01/96/84/1333019684.db2.gz HTJRBJWWFSTEIZ-INIZCTEOSA-N 1 3 329.504 2.778 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H]([NH2+]CCCc2ccc(Cl)cc2)C1 ZINC001480122793 1333410295 /nfs/dbraw/zinc/41/02/95/1333410295.db2.gz VPTWVVKBKOJNSB-SFHVURJKSA-N 1 3 349.906 2.559 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC[C@H](C[NH2+]CCC3CC3)C2)c1 ZINC001480305251 1333597692 /nfs/dbraw/zinc/59/76/92/1333597692.db2.gz QTRVPEAGFGVYME-LJQANCHMSA-N 1 3 343.515 2.990 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](C)CNC(=O)[C@H]1CCCN1C(C)C ZINC001480460959 1334066497 /nfs/dbraw/zinc/06/64/97/1334066497.db2.gz ZHDDERGAZYAOMA-VQIMIIECSA-N 1 3 331.504 2.716 10 0 EFAEHO Cc1nn(-c2ccccn2)c(Cl)c1CNC[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000848562652 1334796701 /nfs/dbraw/zinc/79/67/01/1334796701.db2.gz KJNSIMPBJKEWFR-OKILXGFUSA-N 1 3 333.867 2.659 10 0 EFAEHO Cc1cccc(CNC(=[NH2+])NC2CCN(Cc3ccccc3)CC2)n1 ZINC000849061792 1335064249 /nfs/dbraw/zinc/06/42/49/1335064249.db2.gz NTQFDVDMVMAFEC-UHFFFAOYSA-N 1 3 337.471 2.669 10 0 EFAEHO CCc1ccc(NC(=S)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000849275181 1335585764 /nfs/dbraw/zinc/58/57/64/1335585764.db2.gz KDULDPSWLGXPEV-HNNXBMFYSA-N 1 3 336.549 2.807 10 0 EFAEHO CCc1ccc(NC(=S)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000849275181 1335585767 /nfs/dbraw/zinc/58/57/67/1335585767.db2.gz KDULDPSWLGXPEV-HNNXBMFYSA-N 1 3 336.549 2.807 10 0 EFAEHO Cc1cccc(C)c1NC(=S)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000849276502 1335585958 /nfs/dbraw/zinc/58/59/58/1335585958.db2.gz KABJAXSHQDUVLQ-INIZCTEOSA-N 1 3 336.549 2.862 10 0 EFAEHO Cc1cccc(C)c1NC(=S)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000849276502 1335585960 /nfs/dbraw/zinc/58/59/60/1335585960.db2.gz KABJAXSHQDUVLQ-INIZCTEOSA-N 1 3 336.549 2.862 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H]([NH2+]CCCc2ccc(Cl)cc2)C1 ZINC001480612711 1335951014 /nfs/dbraw/zinc/95/10/14/1335951014.db2.gz MNGUARNTZSRCAO-ROUUACIJSA-N 1 3 349.906 2.557 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N(CCN(C)C)Cc3ccccc3)C[N@@H+]2C1 ZINC001361879127 1336393223 /nfs/dbraw/zinc/39/32/23/1336393223.db2.gz DMGWPKKNCRFCKO-MISYRCLQSA-N 1 3 343.515 2.697 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N(CCN(C)C)Cc3ccccc3)C[N@H+]2C1 ZINC001361879127 1336393231 /nfs/dbraw/zinc/39/32/31/1336393231.db2.gz DMGWPKKNCRFCKO-MISYRCLQSA-N 1 3 343.515 2.697 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)N(CCN(C)C)Cc3ccccc3)C[N@@H+]2C1 ZINC001361879135 1336393331 /nfs/dbraw/zinc/39/33/31/1336393331.db2.gz DMGWPKKNCRFCKO-RLLQIKCJSA-N 1 3 343.515 2.697 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)N(CCN(C)C)Cc3ccccc3)C[N@H+]2C1 ZINC001361879135 1336393334 /nfs/dbraw/zinc/39/33/34/1336393334.db2.gz DMGWPKKNCRFCKO-RLLQIKCJSA-N 1 3 343.515 2.697 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)[C@H](C)CC[NH+](C)C)c1ccsc1 ZINC001361917445 1336416082 /nfs/dbraw/zinc/41/60/82/1336416082.db2.gz HDCMEKROCYRCGZ-GDBMZVCRSA-N 1 3 325.522 2.835 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(CCCc2ccccc2)CCN(C)C)CC[N@@H+]1C ZINC001362077008 1336492088 /nfs/dbraw/zinc/49/20/88/1336492088.db2.gz JBZZCLBYTPEQRF-VQTJNVASSA-N 1 3 345.531 2.740 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(CCCc2ccccc2)CCN(C)C)CC[N@H+]1C ZINC001362077008 1336492089 /nfs/dbraw/zinc/49/20/89/1336492089.db2.gz JBZZCLBYTPEQRF-VQTJNVASSA-N 1 3 345.531 2.740 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1)N(C)Cc1ccccc1 ZINC001362170613 1336536588 /nfs/dbraw/zinc/53/65/88/1336536588.db2.gz ATZMPKPDWHYEIR-NZSAHSFTSA-N 1 3 331.504 2.744 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)CC[N@@H+]1C ZINC001362420549 1336602999 /nfs/dbraw/zinc/60/29/99/1336602999.db2.gz QZFIGKOPMBZQFJ-HSALFYBXSA-N 1 3 343.515 2.840 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)CC[N@H+]1C ZINC001362420549 1336603001 /nfs/dbraw/zinc/60/30/01/1336603001.db2.gz QZFIGKOPMBZQFJ-HSALFYBXSA-N 1 3 343.515 2.840 10 0 EFAEHO CN1CCCC(C)(C)[C@H]1CNC(=O)c1cccc(CC[NH+](C)C)c1 ZINC001362493847 1336632494 /nfs/dbraw/zinc/63/24/94/1336632494.db2.gz LFRXNLVSFXSHAF-GOSISDBHSA-N 1 3 331.504 2.641 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001362503551 1336636742 /nfs/dbraw/zinc/63/67/42/1336636742.db2.gz KYCPNUJRCJXTCL-NEWSRXKRSA-N 1 3 331.504 2.744 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)CC[C@@H]1CCc2ccccc21 ZINC001362657294 1336693545 /nfs/dbraw/zinc/69/35/45/1336693545.db2.gz OCYGEYQROJNRLO-HKUYNNGSSA-N 1 3 345.531 2.885 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)CC[C@@H]1CCc2ccccc21 ZINC001362657294 1336693547 /nfs/dbraw/zinc/69/35/47/1336693547.db2.gz OCYGEYQROJNRLO-HKUYNNGSSA-N 1 3 345.531 2.885 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001362668243 1336698305 /nfs/dbraw/zinc/69/83/05/1336698305.db2.gz SVBYQMIZWYPTCW-NZSAHSFTSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001362668243 1336698307 /nfs/dbraw/zinc/69/83/07/1336698307.db2.gz SVBYQMIZWYPTCW-NZSAHSFTSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@@H](CC[NH+](C)C)C(=O)N1CCN(Cc2ccccc2)C[C@H](C)C1 ZINC001362697818 1336708391 /nfs/dbraw/zinc/70/83/91/1336708391.db2.gz YYZNTMPRLOBMJP-ROUUACIJSA-N 1 3 331.504 2.555 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C(C)(C)C1CCCCC1 ZINC001362956064 1336759956 /nfs/dbraw/zinc/75/99/56/1336759956.db2.gz HKGXMYCWNNKCMO-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C(C)(C)C1CCCCC1 ZINC001362956064 1336759958 /nfs/dbraw/zinc/75/99/58/1336759958.db2.gz HKGXMYCWNNKCMO-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)[C@@H]1CC[C@H]2C[C@H](C)C[N@@H+]2C1 ZINC001363192304 1336824792 /nfs/dbraw/zinc/82/47/92/1336824792.db2.gz RIXGDQIRDXNVGI-OTWHNJEPSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)[C@@H]1CC[C@H]2C[C@H](C)C[N@H+]2C1 ZINC001363192304 1336824794 /nfs/dbraw/zinc/82/47/94/1336824794.db2.gz RIXGDQIRDXNVGI-OTWHNJEPSA-N 1 3 335.536 2.831 10 0 EFAEHO CCC[N@H+](CC)Cc1ccc(C(=O)N[C@@H]2CN(C)CC2(C)C)cc1 ZINC001363589327 1336942617 /nfs/dbraw/zinc/94/26/17/1336942617.db2.gz AWLCOUZWTDWKLK-GOSISDBHSA-N 1 3 331.504 2.989 10 0 EFAEHO CCC[N@@H+](CC)Cc1ccc(C(=O)N[C@@H]2CN(C)CC2(C)C)cc1 ZINC001363589327 1336942620 /nfs/dbraw/zinc/94/26/20/1336942620.db2.gz AWLCOUZWTDWKLK-GOSISDBHSA-N 1 3 331.504 2.989 10 0 EFAEHO CC[NH+]1CCC(C(=O)NC[C@H]2CCCCN2C)(c2ccccc2)CC1 ZINC001363654088 1336975271 /nfs/dbraw/zinc/97/52/71/1336975271.db2.gz NWNXDQYOJZAJHY-LJQANCHMSA-N 1 3 343.515 2.641 10 0 EFAEHO CC[C@H](C)N(CCc1ccccc1F)CC(=O)NC1CC[NH+](C)CC1 ZINC001363781761 1337042482 /nfs/dbraw/zinc/04/24/82/1337042482.db2.gz VBMRZMJTBLRGCJ-INIZCTEOSA-N 1 3 349.494 2.679 10 0 EFAEHO CC[N@H+](C)[C@H]1CCN(C(=O)[C@H]2CCCCN2Cc2cccc(C)c2)C1 ZINC001364011092 1337149469 /nfs/dbraw/zinc/14/94/69/1337149469.db2.gz JXOMXHHOVMGIEP-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO CC[N@@H+](C)[C@H]1CCN(C(=O)[C@H]2CCCCN2Cc2cccc(C)c2)C1 ZINC001364011092 1337149473 /nfs/dbraw/zinc/14/94/73/1337149473.db2.gz JXOMXHHOVMGIEP-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO CC[N@H+](C)[C@@H]1CCN(C(=O)[C@@H]2CCCCN2Cc2cccc(C)c2)C1 ZINC001364011086 1337149719 /nfs/dbraw/zinc/14/97/19/1337149719.db2.gz JXOMXHHOVMGIEP-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO CC[N@@H+](C)[C@@H]1CCN(C(=O)[C@@H]2CCCCN2Cc2cccc(C)c2)C1 ZINC001364011086 1337149720 /nfs/dbraw/zinc/14/97/20/1337149720.db2.gz JXOMXHHOVMGIEP-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CCC2CCCC2)C1 ZINC001365828326 1337253910 /nfs/dbraw/zinc/25/39/10/1337253910.db2.gz JRMCOYSWIKNNDY-RWQQGDIJSA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)[C@H]2CCCCN2C(=O)CC[NH+](C)C)c1 ZINC001365932269 1337263777 /nfs/dbraw/zinc/26/37/77/1337263777.db2.gz XUJQNZOJTFYXBQ-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](C[NH2+]CCC2CCCCC2)C1)N(C)C ZINC001480676713 1337278808 /nfs/dbraw/zinc/27/88/08/1337278808.db2.gz NXNIGMLVFLVCDH-MOPGFXCFSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](CNC(=O)[C@H](C(C)C)[NH+](C)C)C2CC2)c1 ZINC001366035117 1337337448 /nfs/dbraw/zinc/33/74/48/1337337448.db2.gz RJFLUYXQKGKPPC-OALUTQOASA-N 1 3 349.494 2.705 10 0 EFAEHO CC[C@H](C)C[N@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366073317 1337365204 /nfs/dbraw/zinc/36/52/04/1337365204.db2.gz JWNLKMRIPBOQIO-HKUYNNGSSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366073317 1337365205 /nfs/dbraw/zinc/36/52/05/1337365205.db2.gz JWNLKMRIPBOQIO-HKUYNNGSSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C)C[N@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366073337 1337365247 /nfs/dbraw/zinc/36/52/47/1337365247.db2.gz JWNLKMRIPBOQIO-PKOBYXMFSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366073337 1337365249 /nfs/dbraw/zinc/36/52/49/1337365249.db2.gz JWNLKMRIPBOQIO-PKOBYXMFSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CC[N@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366078329 1337370247 /nfs/dbraw/zinc/37/02/47/1337370247.db2.gz ZVCUBRIQBPJDAM-LJQANCHMSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CC[N@@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366078329 1337370251 /nfs/dbraw/zinc/37/02/51/1337370251.db2.gz ZVCUBRIQBPJDAM-LJQANCHMSA-N 1 3 337.552 2.935 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001366114615 1337384848 /nfs/dbraw/zinc/38/48/48/1337384848.db2.gz CVTYUWODZBUOCJ-AAVRWANBSA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001366114615 1337384851 /nfs/dbraw/zinc/38/48/51/1337384851.db2.gz CVTYUWODZBUOCJ-AAVRWANBSA-N 1 3 346.302 2.559 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)C1 ZINC001366150659 1337403573 /nfs/dbraw/zinc/40/35/73/1337403573.db2.gz QMZNCWCUYCEZOF-CALCHBBNSA-N 1 3 349.906 2.870 10 0 EFAEHO C[C@@H]1CCC[C@H](CC[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)C1 ZINC001366151720 1337404107 /nfs/dbraw/zinc/40/41/07/1337404107.db2.gz WFLJVZVELMUTHR-TVFCKZIOSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2C)C1)N(C)C ZINC001366159462 1337407310 /nfs/dbraw/zinc/40/73/10/1337407310.db2.gz KEMYOAGNTOSFMM-BBWFWOEESA-N 1 3 337.895 2.725 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(Cl)cc2)C1 ZINC001366167847 1337411631 /nfs/dbraw/zinc/41/16/31/1337411631.db2.gz LSJHRBKJXOPLDK-RRQGHBQHSA-N 1 3 337.895 2.978 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(Cl)cc32)C1 ZINC001366169343 1337412437 /nfs/dbraw/zinc/41/24/37/1337412437.db2.gz OUYVPIIOLWEUOS-JZXOWHBKSA-N 1 3 349.906 2.904 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCCN(CCC(F)(F)F)C1 ZINC001366174019 1337415522 /nfs/dbraw/zinc/41/55/22/1337415522.db2.gz CEPBNESYVGEVKL-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCCN(CCC(F)(F)F)C1 ZINC001366174019 1337415524 /nfs/dbraw/zinc/41/55/24/1337415524.db2.gz CEPBNESYVGEVKL-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO CC1CC(C[N@@H+]2CCC[C@@H](CNC(=O)C(C)(C)N3CCCC3)C2)C1 ZINC001366177242 1337417892 /nfs/dbraw/zinc/41/78/92/1337417892.db2.gz HQQHYUFRWLXLRM-ADKAHSJRSA-N 1 3 335.536 2.735 10 0 EFAEHO CC1CC(C[N@H+]2CCC[C@@H](CNC(=O)C(C)(C)N3CCCC3)C2)C1 ZINC001366177242 1337417893 /nfs/dbraw/zinc/41/78/93/1337417893.db2.gz HQQHYUFRWLXLRM-ADKAHSJRSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](CCCC(C)(C)C)C1)N(C)C ZINC001366181083 1337422267 /nfs/dbraw/zinc/42/22/67/1337422267.db2.gz SGUPRKUIZGWQIR-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](CCCC(C)(C)C)C1)N(C)C ZINC001366181083 1337422268 /nfs/dbraw/zinc/42/22/68/1337422268.db2.gz SGUPRKUIZGWQIR-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](CCc2ccccc2F)C1)N(C)C ZINC001366186894 1337426884 /nfs/dbraw/zinc/42/68/84/1337426884.db2.gz JJBXOWRQFDTMRO-VQIMIIECSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](CCc2ccccc2F)C1)N(C)C ZINC001366186894 1337426888 /nfs/dbraw/zinc/42/68/88/1337426888.db2.gz JJBXOWRQFDTMRO-VQIMIIECSA-N 1 3 349.494 2.537 10 0 EFAEHO Cc1ccc(CC[N@H+]2CCC[C@@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001366188854 1337428666 /nfs/dbraw/zinc/42/86/66/1337428666.db2.gz WJJOQLOXRZIGMC-FQEVSTJZSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CC[N@@H+]2CCC[C@@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001366188854 1337428670 /nfs/dbraw/zinc/42/86/70/1337428670.db2.gz WJJOQLOXRZIGMC-FQEVSTJZSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CCCC[C@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001366214440 1337449139 /nfs/dbraw/zinc/44/91/39/1337449139.db2.gz SXZWAUDUDWDVSC-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](F)CC[N@H+]1CCCC[C@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001366214440 1337449141 /nfs/dbraw/zinc/44/91/41/1337449141.db2.gz SXZWAUDUDWDVSC-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](NC[C@H]1CCCCN1C(=O)CC[NH+](C)C)c1ccccc1F ZINC001366215099 1337449997 /nfs/dbraw/zinc/44/99/97/1337449997.db2.gz FVSRRDYTZVHSLP-JKSUJKDBSA-N 1 3 335.467 2.809 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@@H]1CNCc1ccccn1)[NH+](CC)CC ZINC001366221910 1337454557 /nfs/dbraw/zinc/45/45/57/1337454557.db2.gz ZZLMRYSSNFOTLG-RTBURBONSA-N 1 3 346.519 2.673 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2C[N@H+](CC[C@@H]3CCC[C@H](C)C3)C[C@H]21 ZINC001366237121 1337470481 /nfs/dbraw/zinc/47/04/81/1337470481.db2.gz RQHFSLWJFIQTMU-KVIJGQROSA-N 1 3 335.536 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2C[N@@H+](CC[C@@H]3CCC[C@H](C)C3)C[C@H]21 ZINC001366237121 1337470482 /nfs/dbraw/zinc/47/04/82/1337470482.db2.gz RQHFSLWJFIQTMU-KVIJGQROSA-N 1 3 335.536 2.589 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H](C)CNC(=O)[C@H]1CCCN1C(C)C ZINC001366277184 1337486546 /nfs/dbraw/zinc/48/65/46/1337486546.db2.gz MWBROZKZOYIXCI-CRAIPNDOSA-N 1 3 335.467 2.601 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001366283574 1337489806 /nfs/dbraw/zinc/48/98/06/1337489806.db2.gz JBPQCQPKPHRCCQ-OXJNMPFZSA-N 1 3 343.515 2.644 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)NCc1ccccc1Cl ZINC001366291383 1337495409 /nfs/dbraw/zinc/49/54/09/1337495409.db2.gz ZPFXHWCOFCRRLX-YOEHRIQHSA-N 1 3 337.895 2.809 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)NCc1ccccc1Cl ZINC001366291383 1337495412 /nfs/dbraw/zinc/49/54/12/1337495412.db2.gz ZPFXHWCOFCRRLX-YOEHRIQHSA-N 1 3 337.895 2.809 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]Cc1cccc(C(F)F)c1)N(C)C ZINC001366300848 1337500172 /nfs/dbraw/zinc/50/01/72/1337500172.db2.gz SHGDCUYBMNVWCQ-IUODEOHRSA-N 1 3 327.419 2.559 10 0 EFAEHO CCc1ccc(CC[NH2+][C@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001366313423 1337505572 /nfs/dbraw/zinc/50/55/72/1337505572.db2.gz UYJSVOHQMSACNX-QGZVFWFLSA-N 1 3 345.531 2.760 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001366311993 1337505799 /nfs/dbraw/zinc/50/57/99/1337505799.db2.gz QDOUAGYUKAPBRY-GJZGRUSLSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]C/C=C\c1ccc(Cl)cc1 ZINC001366362736 1337536943 /nfs/dbraw/zinc/53/69/43/1337536943.db2.gz CYKBRSBXMYJNQP-IYKSTZQJSA-N 1 3 337.895 2.788 10 0 EFAEHO Cc1ccc(CN[C@H]2CCN(C(=O)CCC[NH+](C)C)C2)c(Cl)c1 ZINC001366386349 1337552801 /nfs/dbraw/zinc/55/28/01/1337552801.db2.gz RYBBGIJFIBQHPH-INIZCTEOSA-N 1 3 337.895 2.681 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N1CC[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001366402870 1337560414 /nfs/dbraw/zinc/56/04/14/1337560414.db2.gz NOJZVPUUPNZNFW-VEWWLGSESA-N 1 3 348.318 2.618 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N1CC[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001366402870 1337560417 /nfs/dbraw/zinc/56/04/17/1337560417.db2.gz NOJZVPUUPNZNFW-VEWWLGSESA-N 1 3 348.318 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@H+](C)CCCc2ccccc2)C1 ZINC001366432095 1337581635 /nfs/dbraw/zinc/58/16/35/1337581635.db2.gz OETBIQDEFLOTDC-FQEVSTJZSA-N 1 3 345.531 2.882 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@@H+](C)CCCc2ccccc2)C1 ZINC001366432095 1337581639 /nfs/dbraw/zinc/58/16/39/1337581639.db2.gz OETBIQDEFLOTDC-FQEVSTJZSA-N 1 3 345.531 2.882 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([N@H+](C)CC2CC3(CCC3)C2)C1 ZINC001366435905 1337585540 /nfs/dbraw/zinc/58/55/40/1337585540.db2.gz UWYIGRVKJQMLBP-SFHVURJKSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([N@@H+](C)CC2CC3(CCC3)C2)C1 ZINC001366435905 1337585542 /nfs/dbraw/zinc/58/55/42/1337585542.db2.gz UWYIGRVKJQMLBP-SFHVURJKSA-N 1 3 335.536 2.831 10 0 EFAEHO Cc1ccc(CN(C)[C@H]2CCCN(C(=O)CC[NH+](C)C)C2)cc1F ZINC001366438974 1337587501 /nfs/dbraw/zinc/58/75/01/1337587501.db2.gz HGLRNGFVOLKQFK-KRWDZBQOSA-N 1 3 335.467 2.509 10 0 EFAEHO C[C@H](CCNC(=O)CN(C)C1CCC1)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001366469637 1337612804 /nfs/dbraw/zinc/61/28/04/1337612804.db2.gz GSUBJTDSWXUITF-OAHLLOKOSA-N 1 3 342.487 2.637 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001366490647 1337631024 /nfs/dbraw/zinc/63/10/24/1337631024.db2.gz WJPUPRIDVGUKSF-DNVCBOLYSA-N 1 3 345.531 2.938 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]Cc1nsc2ccccc12 ZINC001366508317 1337649293 /nfs/dbraw/zinc/64/92/93/1337649293.db2.gz DGYWABOKEUDKRK-AWEZNQCLSA-N 1 3 348.516 2.621 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H](C)CCNC(=O)CN(C)C(C)C)c(C)c1 ZINC001366513856 1337654255 /nfs/dbraw/zinc/65/42/55/1337654255.db2.gz SBKYHJAERYPFRN-GOSISDBHSA-N 1 3 333.520 2.936 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)c1 ZINC001366539238 1337674887 /nfs/dbraw/zinc/67/48/87/1337674887.db2.gz GYNINOGHNLRFJX-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)c1 ZINC001366539238 1337674893 /nfs/dbraw/zinc/67/48/93/1337674893.db2.gz GYNINOGHNLRFJX-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(C)CCNC(=O)C12CCC[NH+](CCC1)C2 ZINC001366540824 1337676758 /nfs/dbraw/zinc/67/67/58/1337676758.db2.gz MLNJWKUGWCNLMX-MRXNPFEDSA-N 1 3 347.478 2.811 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001366562558 1337696232 /nfs/dbraw/zinc/69/62/32/1337696232.db2.gz CKJHFVYANYBCQL-LPHOPBHVSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001366562558 1337696233 /nfs/dbraw/zinc/69/62/33/1337696233.db2.gz CKJHFVYANYBCQL-LPHOPBHVSA-N 1 3 331.504 2.527 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@H+](C)CCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001366564680 1337699076 /nfs/dbraw/zinc/69/90/76/1337699076.db2.gz FILBPSBFWVOFAB-SJLPKXTDSA-N 1 3 331.504 2.754 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@@H+](C)CCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001366564680 1337699080 /nfs/dbraw/zinc/69/90/80/1337699080.db2.gz FILBPSBFWVOFAB-SJLPKXTDSA-N 1 3 331.504 2.754 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001366567315 1337702235 /nfs/dbraw/zinc/70/22/35/1337702235.db2.gz SPSLKIISRSFWSJ-HXUWFJFHSA-N 1 3 349.494 2.756 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001366567315 1337702237 /nfs/dbraw/zinc/70/22/37/1337702237.db2.gz SPSLKIISRSFWSJ-HXUWFJFHSA-N 1 3 349.494 2.756 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[N@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001366569836 1337705196 /nfs/dbraw/zinc/70/51/96/1337705196.db2.gz HLXOJZZOEVQJFE-JKSUJKDBSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001366569836 1337705201 /nfs/dbraw/zinc/70/52/01/1337705201.db2.gz HLXOJZZOEVQJFE-JKSUJKDBSA-N 1 3 345.478 2.733 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](C)CC[C@@H]1CCCC1(F)F ZINC001366595422 1337732442 /nfs/dbraw/zinc/73/24/42/1337732442.db2.gz JPUDQHTUSLTAIX-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC001366595422 1337732445 /nfs/dbraw/zinc/73/24/45/1337732445.db2.gz JPUDQHTUSLTAIX-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO COc1cccc([C@@H](C)N(C)CCNC(=O)CC[NH+]2CCCCC2)c1 ZINC001366597448 1337734759 /nfs/dbraw/zinc/73/47/59/1337734759.db2.gz SNZAOCPGKAWFPX-QGZVFWFLSA-N 1 3 347.503 2.680 10 0 EFAEHO CC[N@H+](CCNC(=O)[C@H](C(C)C)N(C)C)[C@H]1CCc2ccccc21 ZINC001366640396 1337787364 /nfs/dbraw/zinc/78/73/64/1337787364.db2.gz LBTJZZLWLSHCQE-OALUTQOASA-N 1 3 331.504 2.698 10 0 EFAEHO CC[N@@H+](CCNC(=O)[C@H](C(C)C)N(C)C)[C@H]1CCc2ccccc21 ZINC001366640396 1337787366 /nfs/dbraw/zinc/78/73/66/1337787366.db2.gz LBTJZZLWLSHCQE-OALUTQOASA-N 1 3 331.504 2.698 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](CC)CC1CC2(CCC2)C1 ZINC001366642939 1337790357 /nfs/dbraw/zinc/79/03/57/1337790357.db2.gz DERFMHISUPJGOT-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](CC)CC1CC2(CCC2)C1 ZINC001366642939 1337790359 /nfs/dbraw/zinc/79/03/59/1337790359.db2.gz DERFMHISUPJGOT-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H]1CCN(C/C=C/Cl)C1)[NH+]1CCCC1 ZINC001366851001 1338117229 /nfs/dbraw/zinc/11/72/29/1338117229.db2.gz JIGUHWSUPHXEMW-QBUOGWAXSA-N 1 3 341.927 2.688 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@H]1CC[N@@H+](CC2CCC(C)CC2)C1 ZINC001366853035 1338120647 /nfs/dbraw/zinc/12/06/47/1338120647.db2.gz DLZSSUYDCCONOJ-VJFUWPCTSA-N 1 3 346.519 2.915 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@H]1CC[N@H+](CC2CCC(C)CC2)C1 ZINC001366853035 1338120652 /nfs/dbraw/zinc/12/06/52/1338120652.db2.gz DLZSSUYDCCONOJ-VJFUWPCTSA-N 1 3 346.519 2.915 10 0 EFAEHO CC(C)CC[N@H+](C)C[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001366864359 1338132997 /nfs/dbraw/zinc/13/29/97/1338132997.db2.gz INTZNRKMPALNCM-KRWDZBQOSA-N 1 3 325.541 2.791 10 0 EFAEHO CC(C)CC[N@@H+](C)C[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001366864359 1338133004 /nfs/dbraw/zinc/13/30/04/1338133004.db2.gz INTZNRKMPALNCM-KRWDZBQOSA-N 1 3 325.541 2.791 10 0 EFAEHO CCCC[N@H+](C)C[C@@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001366865926 1338135299 /nfs/dbraw/zinc/13/52/99/1338135299.db2.gz MMTVNSFUYODMLI-LPHOPBHVSA-N 1 3 341.515 2.779 10 0 EFAEHO CCCC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001366865926 1338135300 /nfs/dbraw/zinc/13/53/00/1338135300.db2.gz MMTVNSFUYODMLI-LPHOPBHVSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[N@H+](C)C/C=C\c2ccccc2)C1)N(C)C ZINC001366872379 1338145394 /nfs/dbraw/zinc/14/53/94/1338145394.db2.gz PBOZMQRVEOFKNU-ASOYJQDNSA-N 1 3 343.515 2.820 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[N@@H+](C)C/C=C\c2ccccc2)C1)N(C)C ZINC001366872379 1338145397 /nfs/dbraw/zinc/14/53/97/1338145397.db2.gz PBOZMQRVEOFKNU-ASOYJQDNSA-N 1 3 343.515 2.820 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C[N@H+](C)CCC(C)(C)C)CC1)N(C)C ZINC001366884473 1338163743 /nfs/dbraw/zinc/16/37/43/1338163743.db2.gz MMIHNOTULOLABW-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C[N@@H+](C)CCC(C)(C)C)CC1)N(C)C ZINC001366884473 1338163750 /nfs/dbraw/zinc/16/37/50/1338163750.db2.gz MMIHNOTULOLABW-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO C[C@H](c1ccc2c(c1)CCC2)N1CCC[C@H](NC(=O)CC[NH+](C)C)C1 ZINC001366900865 1338185806 /nfs/dbraw/zinc/18/58/06/1338185806.db2.gz IEZNJFUMJQXACS-UZLBHIALSA-N 1 3 343.515 2.769 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH+]2CC(CNC(=O)CN(C)C3CCC3)C2)c1 ZINC001366967805 1338228709 /nfs/dbraw/zinc/22/87/09/1338228709.db2.gz ALBSHQMWOVQCOO-QGZVFWFLSA-N 1 3 343.515 2.897 10 0 EFAEHO CN(CC(=O)NCC1C[NH+](CCC2CCCCC2)C1)CC(C)(C)C ZINC001366982266 1338240721 /nfs/dbraw/zinc/24/07/21/1338240721.db2.gz AMHZATCZCKJSAD-UHFFFAOYSA-N 1 3 337.552 2.983 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH+]2CC(CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001366988758 1338246178 /nfs/dbraw/zinc/24/61/78/1338246178.db2.gz VKRTYLKQFPAAEZ-SJLPKXTDSA-N 1 3 343.515 2.754 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](CC)[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001367097344 1338383304 /nfs/dbraw/zinc/38/33/04/1338383304.db2.gz CTPOAVVPPDQFLJ-DOTOQJQBSA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1cc(C[NH2+]C[C@](C)(NC(=O)CN2CC[C@H](C)C2)C2CC2)cs1 ZINC001367175963 1338476727 /nfs/dbraw/zinc/47/67/27/1338476727.db2.gz JWAIGJPFYFKXIL-LIRRHRJNSA-N 1 3 349.544 2.773 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1([NH2+]CC2CC(C)(C)C2)CCCC1 ZINC001367324113 1338621668 /nfs/dbraw/zinc/62/16/68/1338621668.db2.gz NAWUWOVFYKZXHC-UHFFFAOYSA-N 1 3 332.492 2.715 10 0 EFAEHO Cc1cccc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCCC2)c1 ZINC001367333163 1338632929 /nfs/dbraw/zinc/63/29/29/1338632929.db2.gz YIEXNKAGUKEOFR-UHFFFAOYSA-N 1 3 331.504 2.854 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C(C)C)c(C)n1 ZINC001367486320 1338786487 /nfs/dbraw/zinc/78/64/87/1338786487.db2.gz BBNMJGFRGMRODH-OALUTQOASA-N 1 3 348.535 2.515 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C(C)C)cc1F ZINC001367492075 1338791247 /nfs/dbraw/zinc/79/12/47/1338791247.db2.gz KDPOPHVKAKRFCB-GOSISDBHSA-N 1 3 337.483 2.705 10 0 EFAEHO CN(CCN(C)C(=O)CC[C@H]1CCC[N@@H+]1C)Cc1ccc(CF)cc1 ZINC001367524654 1338825228 /nfs/dbraw/zinc/82/52/28/1338825228.db2.gz WKEKKOZMLVJCBG-LJQANCHMSA-N 1 3 349.494 2.921 10 0 EFAEHO CN(CCN(C)C(=O)CC[C@H]1CCC[N@H+]1C)Cc1ccc(CF)cc1 ZINC001367524654 1338825232 /nfs/dbraw/zinc/82/52/32/1338825232.db2.gz WKEKKOZMLVJCBG-LJQANCHMSA-N 1 3 349.494 2.921 10 0 EFAEHO CN(CC[N@H+](C)CC[C@H]1CCc2ccccc21)C(=O)CN1CCCC1 ZINC001367549095 1338858868 /nfs/dbraw/zinc/85/88/68/1338858868.db2.gz AKOKPFGKRDPEIN-LJQANCHMSA-N 1 3 343.515 2.593 10 0 EFAEHO CN(CC[N@@H+](C)CC[C@H]1CCc2ccccc21)C(=O)CN1CCCC1 ZINC001367549095 1338858872 /nfs/dbraw/zinc/85/88/72/1338858872.db2.gz AKOKPFGKRDPEIN-LJQANCHMSA-N 1 3 343.515 2.593 10 0 EFAEHO CN(CC[N@H+](C)[C@@H]1CCCc2ccccc21)C(=O)CN1CCCC1 ZINC001367550519 1338860151 /nfs/dbraw/zinc/86/01/51/1338860151.db2.gz ICAHQDQLFPYREO-LJQANCHMSA-N 1 3 329.488 2.550 10 0 EFAEHO CN(CC[N@@H+](C)[C@@H]1CCCc2ccccc21)C(=O)CN1CCCC1 ZINC001367550519 1338860153 /nfs/dbraw/zinc/86/01/53/1338860153.db2.gz ICAHQDQLFPYREO-LJQANCHMSA-N 1 3 329.488 2.550 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)N(C)CCN(C)CCc1ccccc1F ZINC001367551599 1338861875 /nfs/dbraw/zinc/86/18/75/1338861875.db2.gz MNSJRVZNIXQFGG-IRXDYDNUSA-N 1 3 349.494 2.631 10 0 EFAEHO CN(CC[N@H+](C)CC/C=C\c1ccccc1)C(=O)CN1CCCC1 ZINC001367554428 1338864924 /nfs/dbraw/zinc/86/49/24/1338864924.db2.gz TVZODVCMUYYZDL-SDQBBNPISA-N 1 3 329.488 2.576 10 0 EFAEHO CN(CC[N@@H+](C)CC/C=C\c1ccccc1)C(=O)CN1CCCC1 ZINC001367554428 1338864926 /nfs/dbraw/zinc/86/49/26/1338864926.db2.gz TVZODVCMUYYZDL-SDQBBNPISA-N 1 3 329.488 2.576 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2CCCC2CCC2)C1 ZINC001367555136 1338866253 /nfs/dbraw/zinc/86/62/53/1338866253.db2.gz LJLPSISAPMNXCT-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2CCCC2CCC2)C1 ZINC001367555136 1338866258 /nfs/dbraw/zinc/86/62/58/1338866258.db2.gz LJLPSISAPMNXCT-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CCN(CC[NH2+][C@@H](C)c1cc(C)ccc1C)C(=O)[C@H]1CCCN1C ZINC001367639496 1338895198 /nfs/dbraw/zinc/89/51/98/1338895198.db2.gz IPLRNGGCBKNRQV-PKOBYXMFSA-N 1 3 331.504 2.897 10 0 EFAEHO CCN(CCN[C@H](C)c1ccccc1Cl)C(=O)C12CC[NH+](CC1)C2 ZINC001367688973 1338929745 /nfs/dbraw/zinc/92/97/45/1338929745.db2.gz MWGPRGJBDCUCOT-OAHLLOKOSA-N 1 3 349.906 2.935 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@@H](C(C)C)N(C)C)cc1 ZINC001367692015 1338932519 /nfs/dbraw/zinc/93/25/19/1338932519.db2.gz IZPOXJOWAAIHLF-VQIMIIECSA-N 1 3 333.520 2.991 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@H](C)NC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001367731506 1338964175 /nfs/dbraw/zinc/96/41/75/1338964175.db2.gz KHVNMNDTNSNHKF-PKOBYXMFSA-N 1 3 331.504 2.771 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C ZINC001367754050 1338981861 /nfs/dbraw/zinc/98/18/61/1338981861.db2.gz CMRWKGNYOWKHIC-HNAYVOBHSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@H](C)NC(=O)[C@@H](C(C)C)N(C)C)cc1 ZINC001367765934 1338991724 /nfs/dbraw/zinc/99/17/24/1338991724.db2.gz IZPOXJOWAAIHLF-QFBILLFUSA-N 1 3 333.520 2.991 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(C)c(F)c1 ZINC001367802252 1339022155 /nfs/dbraw/zinc/02/21/55/1339022155.db2.gz IYLYYFAQDCYUGL-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(C)c(F)c1 ZINC001367802252 1339022157 /nfs/dbraw/zinc/02/21/57/1339022157.db2.gz IYLYYFAQDCYUGL-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](CN(C)CCc1ccccc1F)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001367834676 1339051259 /nfs/dbraw/zinc/05/12/59/1339051259.db2.gz NEJPTRGISCWELW-RYRKJORJSA-N 1 3 349.494 2.535 10 0 EFAEHO C[C@H](CN(C)CCc1ccccc1F)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001367834676 1339051260 /nfs/dbraw/zinc/05/12/60/1339051260.db2.gz NEJPTRGISCWELW-RYRKJORJSA-N 1 3 349.494 2.535 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001367840340 1339056728 /nfs/dbraw/zinc/05/67/28/1339056728.db2.gz XWCQKZKAGVATND-QAPCUYQASA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001367840340 1339056731 /nfs/dbraw/zinc/05/67/31/1339056731.db2.gz XWCQKZKAGVATND-QAPCUYQASA-N 1 3 331.504 2.582 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NCC2(N[C@@H]3CCc4ccc(Cl)cc43)CC2)C1 ZINC001368034659 1339168010 /nfs/dbraw/zinc/16/80/10/1339168010.db2.gz JMFUNPWLDJHTOM-RHSMWYFYSA-N 1 3 347.890 2.517 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NCC2(N[C@@H]3CCc4ccc(Cl)cc43)CC2)C1 ZINC001368034659 1339168013 /nfs/dbraw/zinc/16/80/13/1339168013.db2.gz JMFUNPWLDJHTOM-RHSMWYFYSA-N 1 3 347.890 2.517 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+][C@H]2CCCc3ccc(F)cc32)CC1 ZINC001368038640 1339169851 /nfs/dbraw/zinc/16/98/51/1339169851.db2.gz TUUKINNYWPPXKI-SFHVURJKSA-N 1 3 347.478 2.783 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+][C@H]2CCc3c2cccc3Cl)CC1 ZINC001368043359 1339172669 /nfs/dbraw/zinc/17/26/69/1339172669.db2.gz ONMVUWNLHZLWJS-KRWDZBQOSA-N 1 3 349.906 2.906 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CC[C@]2(C1)CCCN(Cc1ccsc1)C2 ZINC001368059671 1339182539 /nfs/dbraw/zinc/18/25/39/1339182539.db2.gz AGXBAICKOVIGEV-LJQANCHMSA-N 1 3 349.544 2.904 10 0 EFAEHO CCCN(C)CC(=O)NC1(C)CC[NH+]([C@@H]2CCc3ccccc32)CC1 ZINC001368126862 1339205884 /nfs/dbraw/zinc/20/58/84/1339205884.db2.gz NIVNTQACBMLAKS-LJQANCHMSA-N 1 3 343.515 2.986 10 0 EFAEHO CC[C@H](F)CN1CC[C@]2(C1)CCCCN(C(=O)CCC[NH+](C)C)C2 ZINC001368141471 1339215028 /nfs/dbraw/zinc/21/50/28/1339215028.db2.gz MZQFOBYMBNECKW-HKUYNNGSSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]CC1CC(F)(F)C1)C1CCCC1)N(C)C ZINC001368145753 1339218336 /nfs/dbraw/zinc/21/83/36/1339218336.db2.gz PDOVEJZCGAUFQO-JKSUJKDBSA-N 1 3 345.478 2.637 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@]1(C)CCN([C@H](C)c2cccc(OC)c2)C1 ZINC001368184608 1339241696 /nfs/dbraw/zinc/24/16/96/1339241696.db2.gz YPBHJTKZGCIVOO-OXQOHEQNSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@]1(C)CCN([C@H](C)c2cccc(OC)c2)C1 ZINC001368184608 1339241699 /nfs/dbraw/zinc/24/16/99/1339241699.db2.gz YPBHJTKZGCIVOO-OXQOHEQNSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[C@@H](C)C[NH+]1CCC(C)(CNC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001368209759 1339257069 /nfs/dbraw/zinc/25/70/69/1339257069.db2.gz XPRXXWSECFBJLF-IAGOWNOFSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1C[N@H+](CCCC(C)C)CCC1(F)F)N(C)C ZINC001368244802 1339282280 /nfs/dbraw/zinc/28/22/80/1339282280.db2.gz HMRXJQYRNBFUSY-CVEARBPZSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1C[N@@H+](CCCC(C)C)CCC1(F)F)N(C)C ZINC001368244802 1339282282 /nfs/dbraw/zinc/28/22/82/1339282282.db2.gz HMRXJQYRNBFUSY-CVEARBPZSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCCC1CCC1)C2 ZINC001368325122 1339298324 /nfs/dbraw/zinc/29/83/24/1339298324.db2.gz FXJXXPQIAAGMSL-FHWLQOOXSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCCC1CCC1)C2 ZINC001368325122 1339298328 /nfs/dbraw/zinc/29/83/28/1339298328.db2.gz FXJXXPQIAAGMSL-FHWLQOOXSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@H](C)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C2 ZINC001368337848 1339305414 /nfs/dbraw/zinc/30/54/14/1339305414.db2.gz BTOFPTBIWOYMPT-OYSTVDSJSA-N 1 3 337.552 2.978 10 0 EFAEHO CC[C@H](C)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C2 ZINC001368337848 1339305416 /nfs/dbraw/zinc/30/54/16/1339305416.db2.gz BTOFPTBIWOYMPT-OYSTVDSJSA-N 1 3 337.552 2.978 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001368347937 1339310007 /nfs/dbraw/zinc/31/00/07/1339310007.db2.gz HMENIAWGKYYPJN-PXNSSMCTSA-N 1 3 345.531 2.773 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CCCC2)C1 ZINC001368349608 1339311284 /nfs/dbraw/zinc/31/12/84/1339311284.db2.gz VIFQWEQADCPLQI-FFGOWVMKSA-N 1 3 347.547 2.878 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CCCC2)C1 ZINC001368349608 1339311286 /nfs/dbraw/zinc/31/12/86/1339311286.db2.gz VIFQWEQADCPLQI-FFGOWVMKSA-N 1 3 347.547 2.878 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001368351672 1339311964 /nfs/dbraw/zinc/31/19/64/1339311964.db2.gz MOFYGOKCYNCJEH-OALUTQOASA-N 1 3 345.531 2.828 10 0 EFAEHO CN(C[C@H]1CCN1CC1CCC1)C(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001368403134 1339340543 /nfs/dbraw/zinc/34/05/43/1339340543.db2.gz PTIYGRSIIBSXQW-APWZRJJASA-N 1 3 339.499 2.532 10 0 EFAEHO CN(C[C@H]1CCN1CC1CCC1)C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001368403134 1339340551 /nfs/dbraw/zinc/34/05/51/1339340551.db2.gz PTIYGRSIIBSXQW-APWZRJJASA-N 1 3 339.499 2.532 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](CC1CC(C)(C)C1)CC2 ZINC001368419884 1339353136 /nfs/dbraw/zinc/35/31/36/1339353136.db2.gz AXOZRAJKHCLNRL-UHFFFAOYSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](CC[NH2+][C@H]2CCc3ccccc32)C1 ZINC001368420234 1339354460 /nfs/dbraw/zinc/35/44/60/1339354460.db2.gz MXQPNXSJPNAATO-XLIONFOSSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)[C@H](C(=O)NCc1cccc2c1CC[N@H+](CC1CC1)C2)N(C)C ZINC001368449733 1339384742 /nfs/dbraw/zinc/38/47/42/1339384742.db2.gz PVRZMCUHRUFXQI-HXUWFJFHSA-N 1 3 343.515 2.657 10 0 EFAEHO CC(C)[C@H](C(=O)NCc1cccc2c1CC[N@@H+](CC1CC1)C2)N(C)C ZINC001368449733 1339384747 /nfs/dbraw/zinc/38/47/47/1339384747.db2.gz PVRZMCUHRUFXQI-HXUWFJFHSA-N 1 3 343.515 2.657 10 0 EFAEHO CC[C@@H](C(=O)NCc1cccc2c1CC[N@H+](CC1CCC1)C2)N(C)C ZINC001368449596 1339384959 /nfs/dbraw/zinc/38/49/59/1339384959.db2.gz PFIXAHLSJIMLJO-FQEVSTJZSA-N 1 3 343.515 2.801 10 0 EFAEHO CC[C@@H](C(=O)NCc1cccc2c1CC[N@@H+](CC1CCC1)C2)N(C)C ZINC001368449596 1339384962 /nfs/dbraw/zinc/38/49/62/1339384962.db2.gz PFIXAHLSJIMLJO-FQEVSTJZSA-N 1 3 343.515 2.801 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]Cc2ccc(F)cc2)CCC1)N1CCCC1 ZINC001368490182 1339427638 /nfs/dbraw/zinc/42/76/38/1339427638.db2.gz ZEPTUSYWNUVLAS-UHFFFAOYSA-N 1 3 347.478 2.829 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@@H]3C)CCC2)cc1 ZINC001368493911 1339431526 /nfs/dbraw/zinc/43/15/26/1339431526.db2.gz AQYNUOGKTCMUCK-HDICACEKSA-N 1 3 343.515 2.996 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2ccc(CF)cc2)CCC1 ZINC001368498322 1339436608 /nfs/dbraw/zinc/43/66/08/1339436608.db2.gz QJRVQNUIMLZCNV-UHFFFAOYSA-N 1 3 335.467 2.625 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)CCCN(C)C(=O)[C@@H]2CCCN2C)c1 ZINC001368524222 1339461036 /nfs/dbraw/zinc/46/10/36/1339461036.db2.gz HJVZEFSBNISBPX-APWZRJJASA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)CCCN(C)C(=O)[C@@H]2CCCN2C)c1 ZINC001368524222 1339461037 /nfs/dbraw/zinc/46/10/37/1339461037.db2.gz HJVZEFSBNISBPX-APWZRJJASA-N 1 3 347.503 2.631 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CCC3(CC3)CC2)C1 ZINC001368529275 1339466278 /nfs/dbraw/zinc/46/62/78/1339466278.db2.gz UEGFNVVBABDNLA-HDICACEKSA-N 1 3 335.536 2.783 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001368564061 1339510979 /nfs/dbraw/zinc/51/09/79/1339510979.db2.gz CJGVTHZHTKEOLM-INIZCTEOSA-N 1 3 347.494 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001368564061 1339510982 /nfs/dbraw/zinc/51/09/82/1339510982.db2.gz CJGVTHZHTKEOLM-INIZCTEOSA-N 1 3 347.494 2.932 10 0 EFAEHO CN(CC(=O)NC[C@H]1C[C@H]([NH2+][C@H]2CCc3ccccc32)C1)C1CCC1 ZINC001368569881 1339519694 /nfs/dbraw/zinc/51/96/94/1339519694.db2.gz DALOEHDVZWBGGR-KNBMTAEXSA-N 1 3 341.499 2.643 10 0 EFAEHO CCC1([NH2+]Cc2ccsc2)CCN(C(=O)CN2CCCC2)CC1 ZINC001368604144 1339545940 /nfs/dbraw/zinc/54/59/40/1339545940.db2.gz IDXGFURGXKGLPJ-UHFFFAOYSA-N 1 3 335.517 2.705 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C/Cl)C1)CC(C)(C)C ZINC001368639751 1339560713 /nfs/dbraw/zinc/56/07/13/1339560713.db2.gz AYYJDBKFKHYLLA-YKHJJTLOSA-N 1 3 329.916 2.591 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C[C@@H]1C)CC[NH+](CC[C@H](C)F)CC2 ZINC001368650380 1339566218 /nfs/dbraw/zinc/56/62/18/1339566218.db2.gz HBNKBRNVFSAUEA-IRXDYDNUSA-N 1 3 341.515 2.779 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C[C@@H]1C)CC[NH+](CC[C@@H](C)F)CC2 ZINC001368650385 1339566290 /nfs/dbraw/zinc/56/62/90/1339566290.db2.gz HBNKBRNVFSAUEA-SJORKVTESA-N 1 3 341.515 2.779 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]Cc2ccc(C)nc2C)CC1 ZINC001368662687 1339575162 /nfs/dbraw/zinc/57/51/62/1339575162.db2.gz HQKWZTFAUYPKAG-UHFFFAOYSA-N 1 3 346.519 2.511 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C)([NH2+]CCc2ccccc2F)CC1)N(C)C ZINC001368664539 1339576512 /nfs/dbraw/zinc/57/65/12/1339576512.db2.gz QHZRHQMKKIWQRL-SFHVURJKSA-N 1 3 349.494 2.679 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@H]1CCN(Cc2ccsc2)CC1(C)C ZINC001368673541 1339587148 /nfs/dbraw/zinc/58/71/48/1339587148.db2.gz NLALPUPBLRFBAW-MRXNPFEDSA-N 1 3 337.533 2.807 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]CC1CC(C)(C)C1 ZINC001368676246 1339589780 /nfs/dbraw/zinc/58/97/80/1339589780.db2.gz XJUULARTFRHFBD-AEFFLSMTSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)CN(C)C2CCC2)CC[N@@H+]1Cc1ccsc1 ZINC001368693294 1339608661 /nfs/dbraw/zinc/60/86/61/1339608661.db2.gz LDQZXVPIZXVDDJ-GDBMZVCRSA-N 1 3 335.517 2.702 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)CN(C)C2CCC2)CC[N@H+]1Cc1ccsc1 ZINC001368693294 1339608665 /nfs/dbraw/zinc/60/86/65/1339608665.db2.gz LDQZXVPIZXVDDJ-GDBMZVCRSA-N 1 3 335.517 2.702 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+]1CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]1C ZINC001368695746 1339610887 /nfs/dbraw/zinc/61/08/87/1339610887.db2.gz KDALSRMNUBSUMS-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+]1CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]1C ZINC001368695746 1339610889 /nfs/dbraw/zinc/61/08/89/1339610889.db2.gz KDALSRMNUBSUMS-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+]([C@@H](C)c3ccccc3)CC[C@@H]2C1 ZINC001368735459 1339655912 /nfs/dbraw/zinc/65/59/12/1339655912.db2.gz KLZASEVJFIFYTJ-SXLOBPIMSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+]([C@@H](C)c3ccccc3)CC[C@@H]2C1 ZINC001368735459 1339655915 /nfs/dbraw/zinc/65/59/15/1339655915.db2.gz KLZASEVJFIFYTJ-SXLOBPIMSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@H](C)NCc1c(F)cccc1F)[NH+](C)C ZINC001368751822 1339675300 /nfs/dbraw/zinc/67/53/00/1339675300.db2.gz XANGWNZVJUUHCL-GUYCJALGSA-N 1 3 341.446 2.535 10 0 EFAEHO CC[C@@H]([NH2+]CC1CC(NC(=O)CN(C)C(C)C)C1)c1ccccc1 ZINC001368826402 1339765824 /nfs/dbraw/zinc/76/58/24/1339765824.db2.gz VYYHVWYOHJGUHP-NKELODKYSA-N 1 3 331.504 2.962 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)[C@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001368879095 1339814485 /nfs/dbraw/zinc/81/44/85/1339814485.db2.gz UEZQAXARDXWTCQ-HOTGVXAUSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@@H](NC(=O)CN(C)CC(C)(C)C)[C@H](C)[NH2+]CC1CC(C)(C)C1 ZINC001368882644 1339818075 /nfs/dbraw/zinc/81/80/75/1339818075.db2.gz ULRNWIULHKKCOT-LSDHHAIUSA-N 1 3 325.541 2.883 10 0 EFAEHO C[C@@H](NC(=O)CCC[NH+]1CCCC1)[C@H](C)NCC=C(Cl)Cl ZINC001368890423 1339828463 /nfs/dbraw/zinc/82/84/63/1339828463.db2.gz GJQJPUGMOUTABN-QWHCGFSZSA-N 1 3 336.307 2.664 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CCC([NH2+]Cc2ccccc2)CC1 ZINC001368903766 1339845330 /nfs/dbraw/zinc/84/53/30/1339845330.db2.gz WJFOAOSQYMSBIV-UHFFFAOYSA-N 1 3 331.504 2.886 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC(C)(C)C[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001368923159 1339868631 /nfs/dbraw/zinc/86/86/31/1339868631.db2.gz DMWIINSYHPFFEL-HNNXBMFYSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](C(=O)N(C)CC(C)(C)C[NH2+]CC1CC(C)(C)C1)N(C)C ZINC001368924709 1339870348 /nfs/dbraw/zinc/87/03/48/1339870348.db2.gz UFFGDSCRJRPGKU-MRXNPFEDSA-N 1 3 325.541 2.837 10 0 EFAEHO COc1ccc(CN(C)[C@H](C)CNC(=O)[C@H]2CCC[N@@H+]2C(C)C)cc1 ZINC001368940495 1339886755 /nfs/dbraw/zinc/88/67/55/1339886755.db2.gz JFBFUBGGVHVKCK-VQIMIIECSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(CN(C)[C@H](C)CNC(=O)[C@H]2CCC[N@H+]2C(C)C)cc1 ZINC001368940495 1339886761 /nfs/dbraw/zinc/88/67/61/1339886761.db2.gz JFBFUBGGVHVKCK-VQIMIIECSA-N 1 3 347.503 2.505 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@H+](CCc2ccccc2)CC1(C)C)N(C)C ZINC001369113321 1339924809 /nfs/dbraw/zinc/92/48/09/1339924809.db2.gz CXWWFIODCWOIHH-RTBURBONSA-N 1 3 345.531 2.642 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@@H+](CCc2ccccc2)CC1(C)C)N(C)C ZINC001369113321 1339924811 /nfs/dbraw/zinc/92/48/11/1339924811.db2.gz CXWWFIODCWOIHH-RTBURBONSA-N 1 3 345.531 2.642 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001370275594 1340002887 /nfs/dbraw/zinc/00/28/87/1340002887.db2.gz ODKIRZNLAGGLKS-APWZRJJASA-N 1 3 331.504 2.881 10 0 EFAEHO CCC[N@H+](C)C[C@H]1CCCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001370303320 1340022228 /nfs/dbraw/zinc/02/22/28/1340022228.db2.gz LAQOXJLZIKTJGS-VQIMIIECSA-N 1 3 341.515 2.779 10 0 EFAEHO CCC[N@@H+](C)C[C@H]1CCCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001370303320 1340022232 /nfs/dbraw/zinc/02/22/32/1340022232.db2.gz LAQOXJLZIKTJGS-VQIMIIECSA-N 1 3 341.515 2.779 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CCCC(C)C ZINC001370594520 1340154684 /nfs/dbraw/zinc/15/46/84/1340154684.db2.gz QHAPLSAYTJBPFB-ALOPSCKCSA-N 1 3 332.492 2.808 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCC(C)C ZINC001370594520 1340154685 /nfs/dbraw/zinc/15/46/85/1340154685.db2.gz QHAPLSAYTJBPFB-ALOPSCKCSA-N 1 3 332.492 2.808 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001370646051 1340179460 /nfs/dbraw/zinc/17/94/60/1340179460.db2.gz CVTYUWODZBUOCJ-RQJABVFESA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001370646051 1340179463 /nfs/dbraw/zinc/17/94/63/1340179463.db2.gz CVTYUWODZBUOCJ-RQJABVFESA-N 1 3 346.302 2.559 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc3c(c2)CCC3)C1)N(C)C ZINC001370646700 1340179610 /nfs/dbraw/zinc/17/96/10/1340179610.db2.gz DGNLPOMQWQJRMK-PPRPKMEESA-N 1 3 343.515 2.813 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001370646043 1340179688 /nfs/dbraw/zinc/17/96/88/1340179688.db2.gz CVTYUWODZBUOCJ-CRWXNKLISA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001370646043 1340179690 /nfs/dbraw/zinc/17/96/90/1340179690.db2.gz CVTYUWODZBUOCJ-CRWXNKLISA-N 1 3 346.302 2.559 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(Cl)cc2)C1)N(C)C ZINC001370652531 1340180417 /nfs/dbraw/zinc/18/04/17/1340180417.db2.gz XOGBVCJTNFFUJW-VDNDLQMASA-N 1 3 337.895 2.978 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C(C)C)nc2C)C1)N(C)C ZINC001370684924 1340185260 /nfs/dbraw/zinc/18/52/60/1340185260.db2.gz YITFJTXCBPGOQO-SCTDSRPQSA-N 1 3 346.519 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)C1 ZINC001370787534 1340210432 /nfs/dbraw/zinc/21/04/32/1340210432.db2.gz ILGOLILODNXDBP-XLIONFOSSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@H+]([C@H]2CCc3ccccc32)C1 ZINC001370787534 1340210435 /nfs/dbraw/zinc/21/04/35/1340210435.db2.gz ILGOLILODNXDBP-XLIONFOSSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1cccc(CN2CCCC[C@H]2CNC(=O)C[C@H]2CC[N@@H+](C)C2)c1 ZINC001370913210 1340279974 /nfs/dbraw/zinc/27/99/74/1340279974.db2.gz QTMSIOKLFSJXDT-UXHICEINSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1cccc(CN2CCCC[C@H]2CNC(=O)C[C@H]2CC[N@H+](C)C2)c1 ZINC001370913210 1340279976 /nfs/dbraw/zinc/27/99/76/1340279976.db2.gz QTMSIOKLFSJXDT-UXHICEINSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1ccc(CN2CCC[C@@H]([C@H](C)NC(=O)CC[NH+](C)C)C2)cc1F ZINC001370981907 1340320834 /nfs/dbraw/zinc/32/08/34/1340320834.db2.gz VQVQZXCFTYNNFO-FUHWJXTLSA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@@H](NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)C1CCCCC1 ZINC001371293200 1340478376 /nfs/dbraw/zinc/47/83/76/1340478376.db2.gz XSWDLRCUYKRSGE-JKSUJKDBSA-N 1 3 326.529 2.526 10 0 EFAEHO C[C@@H](NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)C1CCCCC1 ZINC001371293200 1340478381 /nfs/dbraw/zinc/47/83/81/1340478381.db2.gz XSWDLRCUYKRSGE-JKSUJKDBSA-N 1 3 326.529 2.526 10 0 EFAEHO C[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC(C)(C)C ZINC001371364630 1340531098 /nfs/dbraw/zinc/53/10/98/1340531098.db2.gz OUNALXMAVKDNAT-KDOFPFPSSA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]C/C=C\c2ccc(Cl)cc2)C1 ZINC001371554319 1340641583 /nfs/dbraw/zinc/64/15/83/1340641583.db2.gz DQNKRSWRIDAVQP-XDXAGZTOSA-N 1 3 349.906 2.884 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001371610738 1340674234 /nfs/dbraw/zinc/67/42/34/1340674234.db2.gz DDHKIRBUKZARQH-LJQANCHMSA-N 1 3 331.504 2.527 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001371620756 1340680069 /nfs/dbraw/zinc/68/00/69/1340680069.db2.gz SDWYKOKEHSLGKM-SJORKVTESA-N 1 3 347.503 2.535 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@@H](C)[NH2+]Cc1cccc(F)c1Cl)N(C)C ZINC001371828425 1340706253 /nfs/dbraw/zinc/70/62/53/1340706253.db2.gz NVJKWOAQQDSVRH-DOMZBBRYSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001371835172 1340712353 /nfs/dbraw/zinc/71/23/53/1340712353.db2.gz JGEYBTALJXADMU-ZBFHGGJFSA-N 1 3 345.478 2.779 10 0 EFAEHO C[C@H](F)CC[NH2+][C@H](CNC(=O)C1(N(C)C)CCC1)c1ccccc1 ZINC001373055618 1340886997 /nfs/dbraw/zinc/88/69/97/1340886997.db2.gz FCZSTFGIEWXKRK-DOTOQJQBSA-N 1 3 335.467 2.666 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@@H](CNC(=O)C1(N(C)C)CCC1)c1ccccc1 ZINC001373070114 1340891243 /nfs/dbraw/zinc/89/12/43/1340891243.db2.gz ZAUXPFKJPQKKEA-AEFFLSMTSA-N 1 3 331.504 2.964 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@H+](C)C1)[C@@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001373127383 1340917423 /nfs/dbraw/zinc/91/74/23/1340917423.db2.gz JWNIFQQIRXIGEA-VQTJNVASSA-N 1 3 343.515 2.760 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@@H+](C)C1)[C@@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001373127383 1340917424 /nfs/dbraw/zinc/91/74/24/1340917424.db2.gz JWNIFQQIRXIGEA-VQTJNVASSA-N 1 3 343.515 2.760 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@H](CCNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001373220744 1340954287 /nfs/dbraw/zinc/95/42/87/1340954287.db2.gz CFRNRYSPRZMWRO-MJGOQNOKSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@H](CCNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001373220744 1340954288 /nfs/dbraw/zinc/95/42/88/1340954288.db2.gz CFRNRYSPRZMWRO-MJGOQNOKSA-N 1 3 343.515 2.665 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCC[C@H]([NH2+]C/C=C\Cl)C2)C1 ZINC001373356846 1341000958 /nfs/dbraw/zinc/00/09/58/1341000958.db2.gz JARHTDMQXWPYHY-AAIDIHODSA-N 1 3 345.890 2.532 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@@H]1CCN([C@H](C)c2cccc(OC)c2)C1 ZINC001373707563 1341113480 /nfs/dbraw/zinc/11/34/80/1341113480.db2.gz HXCNVJCNJYGNSD-SJLPKXTDSA-N 1 3 347.503 2.631 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]CCc1ccccc1 ZINC001373754001 1341134819 /nfs/dbraw/zinc/13/48/19/1341134819.db2.gz OAJOFDYMTDRFKE-MOPGFXCFSA-N 1 3 331.504 2.586 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1ccc(C)cc1 ZINC001373764139 1341139013 /nfs/dbraw/zinc/13/90/13/1341139013.db2.gz YZZOCJWEHNZWDH-MOPGFXCFSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)NCc1cc(C)ccc1F ZINC001373792641 1341149550 /nfs/dbraw/zinc/14/95/50/1341149550.db2.gz KHSIHMXATXOVHA-QZTJIDSGSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)NCc1cc(C)ccc1F ZINC001373792641 1341149551 /nfs/dbraw/zinc/14/95/51/1341149551.db2.gz KHSIHMXATXOVHA-QZTJIDSGSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccccc1C1CC1 ZINC001373797875 1341152101 /nfs/dbraw/zinc/15/21/01/1341152101.db2.gz NIIRJOMVAAQEPK-VQIMIIECSA-N 1 3 343.515 2.890 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](CC)[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001373823210 1341163312 /nfs/dbraw/zinc/16/33/12/1341163312.db2.gz VQUHLIIOFGOSPO-WCQYABFASA-N 1 3 331.913 2.726 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@]1(C[NH2+]Cc2cccnc2)CCCC[C@@H]1C ZINC001373902986 1341197032 /nfs/dbraw/zinc/19/70/32/1341197032.db2.gz MLPFUDCKJWNPCJ-PXNSSMCTSA-N 1 3 346.519 2.577 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@]1(C[NH2+]Cc2cccnc2)CCCC[C@H]1C ZINC001373902988 1341197061 /nfs/dbraw/zinc/19/70/61/1341197061.db2.gz MLPFUDCKJWNPCJ-XLIONFOSSA-N 1 3 346.519 2.577 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[C@H]([NH2+]Cc2ccc(C)nc2C)CC1)N(C)C ZINC001373922986 1341204999 /nfs/dbraw/zinc/20/49/99/1341204999.db2.gz CXMCSPZXNMLHLN-GUDVDZBRSA-N 1 3 346.519 2.556 10 0 EFAEHO CC[C@H](C)C[NH2+]Cc1ccc(CNC(=O)C2(N(C)C)CCC2)cc1 ZINC001373931401 1341211822 /nfs/dbraw/zinc/21/18/22/1341211822.db2.gz NWEFLKSXTDJYQN-INIZCTEOSA-N 1 3 331.504 2.923 10 0 EFAEHO CC[C@@H](F)CN1CCC(CCNC(=O)CC[NH+]2CCCCC2)CC1 ZINC001373951227 1341243035 /nfs/dbraw/zinc/24/30/35/1341243035.db2.gz GTADZPPIZQVSEU-GOSISDBHSA-N 1 3 341.515 2.829 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H](C)C[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001374028369 1341317827 /nfs/dbraw/zinc/31/78/27/1341317827.db2.gz QZWZUTIWWLMMDL-BEFAXECRSA-N 1 3 344.503 2.596 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)C[NH2+]Cc1ccc(C2CC2)cc1 ZINC001374069736 1341360708 /nfs/dbraw/zinc/36/07/08/1341360708.db2.gz CFEDOKRVZRTICF-SJORKVTESA-N 1 3 343.515 2.748 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]Cc1ccc(C)nc1C ZINC001391715693 1355458447 /nfs/dbraw/zinc/45/84/47/1355458447.db2.gz BEXLUIDKVKWZPX-GOSISDBHSA-N 1 3 348.535 2.661 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+]C[C@@H](F)CC)CCCC1 ZINC001374161621 1341482535 /nfs/dbraw/zinc/48/25/35/1341482535.db2.gz SJDDXCUGJDKRAX-JKSUJKDBSA-N 1 3 327.488 2.628 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+]Cc2ccsc2)CCCC1)N(C)C ZINC001374178298 1341518056 /nfs/dbraw/zinc/51/80/56/1341518056.db2.gz VJQMTNULEHFGAR-MRXNPFEDSA-N 1 3 337.533 2.853 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H](C)N(C)C(=O)[C@@H]2CCCCN2C)c1 ZINC001374248880 1341606421 /nfs/dbraw/zinc/60/64/21/1341606421.db2.gz XCCUKQJZCAOKBK-YJBOKZPZSA-N 1 3 335.467 2.555 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc2ncccc2c1)N(C)C ZINC001374313482 1341702501 /nfs/dbraw/zinc/70/25/01/1341702501.db2.gz OTWXHODPXIXTTA-DNVCBOLYSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]C[C@H]1CCc2ccccc2C1 ZINC001374327437 1341730628 /nfs/dbraw/zinc/73/06/28/1341730628.db2.gz JGZRNAOOYUWDKW-ROUUACIJSA-N 1 3 345.531 2.568 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)c1 ZINC001392237170 1355894105 /nfs/dbraw/zinc/89/41/05/1355894105.db2.gz OYKRLYHXZCXLQG-VQIMIIECSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C(C)C)c1 ZINC001392248898 1355906055 /nfs/dbraw/zinc/90/60/55/1355906055.db2.gz IEXCFLDJCXJUBO-IBGZPJMESA-N 1 3 333.520 2.874 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2c1cccc2F)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001392319959 1355982668 /nfs/dbraw/zinc/98/26/68/1355982668.db2.gz QVUPMFCMGXTQCS-DNVCBOLYSA-N 1 3 347.478 2.545 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2c1cccc2F)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001392319959 1355982670 /nfs/dbraw/zinc/98/26/70/1355982670.db2.gz QVUPMFCMGXTQCS-DNVCBOLYSA-N 1 3 347.478 2.545 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2c1cccc2F)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001392319960 1355983416 /nfs/dbraw/zinc/98/34/16/1355983416.db2.gz QVUPMFCMGXTQCS-HNAYVOBHSA-N 1 3 347.478 2.545 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2c1cccc2F)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001392319960 1355983421 /nfs/dbraw/zinc/98/34/21/1355983421.db2.gz QVUPMFCMGXTQCS-HNAYVOBHSA-N 1 3 347.478 2.545 10 0 EFAEHO CC(C)[C@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)NCc1ccccc1F ZINC001374425774 1341907590 /nfs/dbraw/zinc/90/75/90/1341907590.db2.gz ZWFPOZYNDPLQTN-HKUYNNGSSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)[C@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)NCc1ccccc1F ZINC001374425774 1341907591 /nfs/dbraw/zinc/90/75/91/1341907591.db2.gz ZWFPOZYNDPLQTN-HKUYNNGSSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)[C@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)NCc1ccccc1F ZINC001374425776 1341907634 /nfs/dbraw/zinc/90/76/34/1341907634.db2.gz ZWFPOZYNDPLQTN-MJGOQNOKSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)[C@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)NCc1ccccc1F ZINC001374425776 1341907636 /nfs/dbraw/zinc/90/76/36/1341907636.db2.gz ZWFPOZYNDPLQTN-MJGOQNOKSA-N 1 3 349.494 2.931 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H](CNC(=O)CN1CC[C@@H](C)C1)C(C)C ZINC001374434003 1341916500 /nfs/dbraw/zinc/91/65/00/1341916500.db2.gz NQKPYSIEBWLJMP-DNVCBOLYSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H](CNC(=O)CN1CC[C@H](C)C1)C(C)C ZINC001374434004 1341916755 /nfs/dbraw/zinc/91/67/55/1341916755.db2.gz NQKPYSIEBWLJMP-HNAYVOBHSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](CNC(=O)CN1CC[C@H](C)C1)C(C)C ZINC001374434635 1341917697 /nfs/dbraw/zinc/91/76/97/1341917697.db2.gz WGCCWLGRDZATQK-QFBILLFUSA-N 1 3 331.504 2.567 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1csc(C)c1)C(C)C)N(C)C ZINC001374442131 1341925939 /nfs/dbraw/zinc/92/59/39/1341925939.db2.gz ATQOCKOIKOTLMO-HZPDHXFCSA-N 1 3 325.522 2.627 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H](C)c1ccc(F)cc1 ZINC001374448284 1341930922 /nfs/dbraw/zinc/93/09/22/1341930922.db2.gz BPKIXSYMIWAGDQ-YJBOKZPZSA-N 1 3 337.483 2.957 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC001374455242 1341936477 /nfs/dbraw/zinc/93/64/77/1341936477.db2.gz SLYDXJUTNYBKMT-MOPGFXCFSA-N 1 3 349.494 2.884 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001374504364 1341991928 /nfs/dbraw/zinc/99/19/28/1341991928.db2.gz UTWXPTGRHBRUKU-INIZCTEOSA-N 1 3 337.533 2.555 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001374504364 1341991930 /nfs/dbraw/zinc/99/19/30/1341991930.db2.gz UTWXPTGRHBRUKU-INIZCTEOSA-N 1 3 337.533 2.555 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[N@H+](C)CC[C@@H]1CCCC1(F)F)N(C)C ZINC001374507245 1341997622 /nfs/dbraw/zinc/99/76/22/1341997622.db2.gz QEUHKXOZERGHSY-LSDHHAIUSA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[N@@H+](C)CC[C@@H]1CCCC1(F)F)N(C)C ZINC001374507245 1341997623 /nfs/dbraw/zinc/99/76/23/1341997623.db2.gz QEUHKXOZERGHSY-LSDHHAIUSA-N 1 3 333.467 2.542 10 0 EFAEHO CN(CCN(C)C(=O)C12CC[NH+](CC1)C2)Cc1ccc(C2CC2)cc1 ZINC001374552834 1342062363 /nfs/dbraw/zinc/06/23/63/1342062363.db2.gz ZDSKLJVNSUNQOS-UHFFFAOYSA-N 1 3 341.499 2.550 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)CCc1ccccc1Cl ZINC001374558158 1342069769 /nfs/dbraw/zinc/06/97/69/1342069769.db2.gz UPDFDAUBPWUHNH-UHFFFAOYSA-N 1 3 339.911 2.613 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)CCc1ccccc1Cl ZINC001374558158 1342069772 /nfs/dbraw/zinc/06/97/72/1342069772.db2.gz UPDFDAUBPWUHNH-UHFFFAOYSA-N 1 3 339.911 2.613 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]1C[NH2+]Cc1cccc(F)c1 ZINC001374569559 1342082324 /nfs/dbraw/zinc/08/23/24/1342082324.db2.gz MTODIVIXSIQSOX-WMZOPIPTSA-N 1 3 335.467 2.540 10 0 EFAEHO C[C@H](CC[NH2+][C@H]1CCc2ccccc21)NC(=O)C1(N(C)C)CCC1 ZINC001374691683 1342111833 /nfs/dbraw/zinc/11/18/33/1342111833.db2.gz FVLCUVPXEONPKK-QAPCUYQASA-N 1 3 329.488 2.643 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]CC[C@@H](C)NC(=O)Cc2nc[nH]c2C)c1 ZINC001374702955 1342121019 /nfs/dbraw/zinc/12/10/19/1342121019.db2.gz AWHQABUJKJKGHE-ZIAGYGMSSA-N 1 3 344.459 2.515 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+][C@@H](C)c1ccc(F)c(Cl)c1)N(C)C ZINC001374776651 1342165204 /nfs/dbraw/zinc/16/52/04/1342165204.db2.gz ODQYDOPYGSUGCE-BFQNTYOBSA-N 1 3 343.874 2.975 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C[C@@H](C)NC(=O)CN(C)CC(C)(C)C)c1 ZINC001374814421 1342185984 /nfs/dbraw/zinc/18/59/84/1342185984.db2.gz NAVCPLTUICUPNO-CVEARBPZSA-N 1 3 349.519 2.828 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@H](C)NC(=O)[C@@H]1CCCCN1C(C)C ZINC001374938729 1342253780 /nfs/dbraw/zinc/25/37/80/1342253780.db2.gz ALTNPSHHWCYUPY-LPHOPBHVSA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)CC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001393233495 1356742585 /nfs/dbraw/zinc/74/25/85/1356742585.db2.gz STECWWAKAHBKQG-OAHLLOKOSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)CC[N@H+]1CCC(F)(F)[C@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001393233495 1356742588 /nfs/dbraw/zinc/74/25/88/1356742588.db2.gz STECWWAKAHBKQG-OAHLLOKOSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)CC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001393233478 1356742776 /nfs/dbraw/zinc/74/27/76/1356742776.db2.gz STECWWAKAHBKQG-HNNXBMFYSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)CC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001393233478 1356742783 /nfs/dbraw/zinc/74/27/83/1356742783.db2.gz STECWWAKAHBKQG-HNNXBMFYSA-N 1 3 345.478 2.590 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001375101090 1342410392 /nfs/dbraw/zinc/41/03/92/1342410392.db2.gz HCKIKEJUQAOOEL-AEFFLSMTSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C)c(C[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001375101090 1342410396 /nfs/dbraw/zinc/41/03/96/1342410396.db2.gz HCKIKEJUQAOOEL-AEFFLSMTSA-N 1 3 331.504 2.582 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C(C)(C)C)cc1)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001375153110 1342469036 /nfs/dbraw/zinc/46/90/36/1342469036.db2.gz CFYRNLAQPNWUFQ-WMZOPIPTSA-N 1 3 345.531 2.872 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C(C)(C)C)cc1)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001375153110 1342469039 /nfs/dbraw/zinc/46/90/39/1342469039.db2.gz CFYRNLAQPNWUFQ-WMZOPIPTSA-N 1 3 345.531 2.872 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1c(C)cccc1C)C1CC1)N(C)C ZINC001375272901 1342579336 /nfs/dbraw/zinc/57/93/36/1342579336.db2.gz PRADBEWDABCZJS-RTBURBONSA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001393494817 1356896993 /nfs/dbraw/zinc/89/69/93/1356896993.db2.gz VCSSCKCYHJQVAE-QBPKDAKJSA-N 1 3 329.504 2.585 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CC[N@@H+]1CC1CCC2(CC2)CC1)N(C)C ZINC001375318572 1342624267 /nfs/dbraw/zinc/62/42/67/1342624267.db2.gz OGSXTGXNZVMFPU-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CC[N@H+]1CC1CCC2(CC2)CC1)N(C)C ZINC001375318572 1342624272 /nfs/dbraw/zinc/62/42/72/1342624272.db2.gz OGSXTGXNZVMFPU-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO CC1CCC(C[N@@H+]2CC[C@H]2CNC(=O)C(C)(C)N2CCCC2)CC1 ZINC001375338117 1342644609 /nfs/dbraw/zinc/64/46/09/1342644609.db2.gz WJJZYOFZDPGKKM-ABHNRTSZSA-N 1 3 335.536 2.878 10 0 EFAEHO CC1CCC(C[N@H+]2CC[C@H]2CNC(=O)C(C)(C)N2CCCC2)CC1 ZINC001375338117 1342644613 /nfs/dbraw/zinc/64/46/13/1342644613.db2.gz WJJZYOFZDPGKKM-ABHNRTSZSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[N@@H+]1CC1CCC2(CC2)CC1)N(C)C ZINC001375340951 1342646019 /nfs/dbraw/zinc/64/60/19/1342646019.db2.gz OGSXTGXNZVMFPU-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[N@H+]1CC1CCC2(CC2)CC1)N(C)C ZINC001375340951 1342646022 /nfs/dbraw/zinc/64/60/22/1342646022.db2.gz OGSXTGXNZVMFPU-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]C[C@@H]3CCCC(F)(F)C3)CC2)CCC1 ZINC001375429151 1342732577 /nfs/dbraw/zinc/73/25/77/1342732577.db2.gz LEOPARWHKPSTKE-CQSZACIVSA-N 1 3 343.462 2.535 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+]C[C@H]2CCCC(F)(F)C2)CC1)N(C)C ZINC001375433620 1342737714 /nfs/dbraw/zinc/73/77/14/1342737714.db2.gz RBWVCJONRADEME-GJZGRUSLSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+]C[C@@H]2CCCC(F)(F)C2)CC1)N(C)C ZINC001375433615 1342737949 /nfs/dbraw/zinc/73/79/49/1342737949.db2.gz RBWVCJONRADEME-CABCVRRESA-N 1 3 345.478 2.637 10 0 EFAEHO C[C@@H]([NH2+]C1(CNC(=O)C(C)(C)N2CCCC2)CC1)c1cccc(F)c1 ZINC001375456802 1342759669 /nfs/dbraw/zinc/75/96/69/1342759669.db2.gz XQEWXAZJAHGVDG-OAHLLOKOSA-N 1 3 347.478 3.000 10 0 EFAEHO C[C@@H](NC1(CNC(=O)C(C)(C)[NH+]2CCCC2)CC1)c1cccc(F)c1 ZINC001375456802 1342759671 /nfs/dbraw/zinc/75/96/71/1342759671.db2.gz XQEWXAZJAHGVDG-OAHLLOKOSA-N 1 3 347.478 3.000 10 0 EFAEHO C[C@@H]([NH2+]C1(CNC(=O)CN2CC[C@H](C)C2)CC1)c1ccc(Cl)cc1 ZINC001375493548 1342800634 /nfs/dbraw/zinc/80/06/34/1342800634.db2.gz YXZHEAWYCYSNQY-LSDHHAIUSA-N 1 3 349.906 2.981 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H]3CCC[C@@H]4CCC[N@@H+]43)CC2)cs1 ZINC001375503998 1342809347 /nfs/dbraw/zinc/80/93/47/1342809347.db2.gz FGLISCJBBYWFHV-IAGOWNOFSA-N 1 3 347.528 2.812 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H]3CCC[C@@H]4CCC[N@H+]43)CC2)cs1 ZINC001375503998 1342809354 /nfs/dbraw/zinc/80/93/54/1342809354.db2.gz FGLISCJBBYWFHV-IAGOWNOFSA-N 1 3 347.528 2.812 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001375537989 1342849313 /nfs/dbraw/zinc/84/93/13/1342849313.db2.gz RABVHJKBRXYRHH-SZMVWBNQSA-N 1 3 335.536 2.637 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+][C@H]2C[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001375562308 1342878340 /nfs/dbraw/zinc/87/83/40/1342878340.db2.gz SGBNTOOYLUXRRX-LNLFQRSKSA-N 1 3 331.504 2.881 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+][C@H]2C[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001375562311 1342878823 /nfs/dbraw/zinc/87/88/23/1342878823.db2.gz SGBNTOOYLUXRRX-ZHALLVOQSA-N 1 3 331.504 2.881 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H]2CC[N@H+](CC[C@H](C)F)C2)CC1 ZINC001375573868 1342892736 /nfs/dbraw/zinc/89/27/36/1342892736.db2.gz NVYASDOKFHKNPN-WMZOPIPTSA-N 1 3 341.515 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H]2CC[N@@H+](CC[C@H](C)F)C2)CC1 ZINC001375573868 1342892739 /nfs/dbraw/zinc/89/27/39/1342892739.db2.gz NVYASDOKFHKNPN-WMZOPIPTSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2cccc(F)c2)C1)N(C)C ZINC001375576100 1342895520 /nfs/dbraw/zinc/89/55/20/1342895520.db2.gz ZAUNBQGZDFFSEG-QXAKKESOSA-N 1 3 349.494 2.786 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H]1CC[C@H](CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001375581699 1342901054 /nfs/dbraw/zinc/90/10/54/1342901054.db2.gz YXRXVLWVQLZKPM-SXLOBPIMSA-N 1 3 345.531 2.956 10 0 EFAEHO CCN1CC[C@H](c2ccccc2)[C@H](NC(=O)CC[NH+]2CCCCC2)C1 ZINC001375603800 1342923481 /nfs/dbraw/zinc/92/34/81/1342923481.db2.gz AHNYINOMWKPQAC-WOJBJXKFSA-N 1 3 343.515 2.857 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001375606997 1342927917 /nfs/dbraw/zinc/92/79/17/1342927917.db2.gz SVICIUVGNYTVKT-OTWHNJEPSA-N 1 3 331.504 2.742 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N(C)C)CC[N@H+]1Cc1ccccc1 ZINC001375606997 1342927919 /nfs/dbraw/zinc/92/79/19/1342927919.db2.gz SVICIUVGNYTVKT-OTWHNJEPSA-N 1 3 331.504 2.742 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CC[C@@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001375688907 1342930085 /nfs/dbraw/zinc/93/00/85/1342930085.db2.gz FMTBHRZFSYJJSP-JKSUJKDBSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H](F)CC[N@H+]1CC[C@@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001375688907 1342930086 /nfs/dbraw/zinc/93/00/86/1342930086.db2.gz FMTBHRZFSYJJSP-JKSUJKDBSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCN(C/C=C/Cl)CC(C)(C)C1)[NH+](C)C ZINC001375690776 1342931977 /nfs/dbraw/zinc/93/19/77/1342931977.db2.gz VACRVDILJNFOSJ-JDFMTEHDSA-N 1 3 343.943 2.932 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C[NH2+]CC1CC1)C1CCCC1 ZINC001375795057 1343023695 /nfs/dbraw/zinc/02/36/95/1343023695.db2.gz VKGDXZDHEXGFJI-RTBURBONSA-N 1 3 335.536 2.924 10 0 EFAEHO COc1cccc([C@H](C)N2CC[C@@](C)(NC(=O)CCC[NH+](C)C)C2)c1 ZINC001375834741 1343070027 /nfs/dbraw/zinc/07/00/27/1343070027.db2.gz GVJAYRMFNBLYJV-OXJNMPFZSA-N 1 3 347.503 2.679 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]CC3CC(C)(C)C3)C2)CC1 ZINC001375896067 1343143440 /nfs/dbraw/zinc/14/34/40/1343143440.db2.gz WCICGVFNFDVDHA-NRFANRHFSA-N 1 3 349.563 2.983 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1(C)CC[NH+](Cc2ccc(F)cc2)CC1 ZINC001375937733 1343187647 /nfs/dbraw/zinc/18/76/47/1343187647.db2.gz YSUQWCLOOBGGDR-UHFFFAOYSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@]1(C)CCC[N@H+](CC2CCCC2)C1)N(C)C ZINC001375954660 1343209933 /nfs/dbraw/zinc/20/99/33/1343209933.db2.gz DTPMAMZOBOWKIV-ICSRJNTNSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@]1(C)CCC[N@@H+](CC2CCCC2)C1)N(C)C ZINC001375954660 1343209935 /nfs/dbraw/zinc/20/99/35/1343209935.db2.gz DTPMAMZOBOWKIV-ICSRJNTNSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c(C)c1 ZINC001393738138 1357115554 /nfs/dbraw/zinc/11/55/54/1357115554.db2.gz FWKDXQDERYPBHQ-PKOBYXMFSA-N 1 3 331.504 2.580 10 0 EFAEHO CCCc1ccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001393742590 1357118703 /nfs/dbraw/zinc/11/87/03/1357118703.db2.gz LOMJJUHDONHERN-PXNSSMCTSA-N 1 3 345.531 2.916 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]Cc2ccc(OC)cc2)CC1 ZINC001393747673 1357122566 /nfs/dbraw/zinc/12/25/66/1357122566.db2.gz MZOUCRAMKHEWFJ-UHFFFAOYSA-N 1 3 347.503 2.508 10 0 EFAEHO CC(C)CCC[NH+]1CCC2(C[C@@H]2NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001376174805 1343375003 /nfs/dbraw/zinc/37/50/03/1343375003.db2.gz BZYZGXGPXCVMLR-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](CNC(=O)CN2CC[C@H](C)C2)C2CC2)c1 ZINC001376250277 1343427778 /nfs/dbraw/zinc/42/77/78/1343427778.db2.gz GXSGVIPWPHKEDG-YWZLYKJASA-N 1 3 343.515 2.630 10 0 EFAEHO Cc1ccc(F)c(CN(C)C[C@H]2CCCN(C(=O)CC[NH+](C)C)C2)c1 ZINC001376287387 1343457296 /nfs/dbraw/zinc/45/72/96/1343457296.db2.gz XWCBUELBANLGLI-QGZVFWFLSA-N 1 3 349.494 2.756 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)[N@H+](CC2CCCC2)C3)CCC1 ZINC001376302094 1343468463 /nfs/dbraw/zinc/46/84/63/1343468463.db2.gz IWNRTRCDIYTLKB-BZSNNMDCSA-N 1 3 333.520 2.630 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)[N@@H+](CC2CCCC2)C3)CCC1 ZINC001376302094 1343468465 /nfs/dbraw/zinc/46/84/65/1343468465.db2.gz IWNRTRCDIYTLKB-BZSNNMDCSA-N 1 3 333.520 2.630 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001376337219 1343493849 /nfs/dbraw/zinc/49/38/49/1343493849.db2.gz BESOKLVIRYFTOS-RDJZCZTQSA-N 1 3 337.533 2.723 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2cc(C)ccc2F)C1 ZINC001376360738 1343513445 /nfs/dbraw/zinc/51/34/45/1343513445.db2.gz JGUWUKXNQNGXKX-WMZOPIPTSA-N 1 3 349.494 2.660 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CC2CC(C)(C)C2)CC1(C)C ZINC001393761984 1357135529 /nfs/dbraw/zinc/13/55/29/1357135529.db2.gz VITDDDFVLOGSAP-KRWDZBQOSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CC2CC(C)(C)C2)CC1(C)C ZINC001393761984 1357135530 /nfs/dbraw/zinc/13/55/30/1357135530.db2.gz VITDDDFVLOGSAP-KRWDZBQOSA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1ccc(C[N@@H+]2C[C@H]3CN(C(=O)CN(C)C(C)C)C[C@H]3C2)c(C)c1 ZINC001376411772 1343567016 /nfs/dbraw/zinc/56/70/16/1343567016.db2.gz JZXICDDDXKWNRS-BGYRXZFFSA-N 1 3 343.515 2.534 10 0 EFAEHO Cc1ccc(C[N@H+]2C[C@H]3CN(C(=O)CN(C)C(C)C)C[C@H]3C2)c(C)c1 ZINC001376411772 1343567017 /nfs/dbraw/zinc/56/70/17/1343567017.db2.gz JZXICDDDXKWNRS-BGYRXZFFSA-N 1 3 343.515 2.534 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2F)C1)N(C)C ZINC001376471410 1343614972 /nfs/dbraw/zinc/61/49/72/1343614972.db2.gz WXSZVEQYGNTHEC-IJEWVQPXSA-N 1 3 341.858 2.556 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H](NC(=O)CCC[NH+](C)C)C1)c1cc(F)ccc1F ZINC001376478390 1343618177 /nfs/dbraw/zinc/61/81/77/1343618177.db2.gz NMFFRNGYGWKKMO-AEGPPILISA-N 1 3 339.430 2.604 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2Cl)C1)N(C)C ZINC001376485418 1343621041 /nfs/dbraw/zinc/62/10/41/1343621041.db2.gz BEKIKTDWHFDJQY-IJEWVQPXSA-N 1 3 341.858 2.556 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC[C@H](CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001376510265 1343636952 /nfs/dbraw/zinc/63/69/52/1343636952.db2.gz NSDHHPSNSMMFEA-MSOLQXFVSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)CCC[N@H+]1CCC[C@H](CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001376510265 1343636957 /nfs/dbraw/zinc/63/69/57/1343636957.db2.gz NSDHHPSNSMMFEA-MSOLQXFVSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@@H](N[C@H]1C[C@@H](NC(=O)CC[NH+]2CCCCC2)C1)c1ccccc1F ZINC001376507109 1343633381 /nfs/dbraw/zinc/63/33/81/1343633381.db2.gz YJRMUTFMAHFIAO-ZACQAIPSSA-N 1 3 347.478 3.000 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N1CCC[C@H](CNC(=O)CC[NH+](C)C)C1 ZINC001376542912 1343666513 /nfs/dbraw/zinc/66/65/13/1343666513.db2.gz QUXFAAAUKKBHKQ-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO CCCN(C)CC(=O)NCc1cccc2c1CC[N@H+](CC[C@H](C)F)C2 ZINC001376671389 1343755659 /nfs/dbraw/zinc/75/56/59/1343755659.db2.gz HDKFDEOBDPXADT-INIZCTEOSA-N 1 3 349.494 2.751 10 0 EFAEHO CCCN(C)CC(=O)NCc1cccc2c1CC[N@@H+](CC[C@H](C)F)C2 ZINC001376671389 1343755661 /nfs/dbraw/zinc/75/56/61/1343755661.db2.gz HDKFDEOBDPXADT-INIZCTEOSA-N 1 3 349.494 2.751 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1CCC([NH2+]Cc2ccsc2)CC1)N(C)C ZINC001376680586 1343761638 /nfs/dbraw/zinc/76/16/38/1343761638.db2.gz YRUZYQIITZFFML-JCYILVPMSA-N 1 3 337.533 2.851 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]CCc1ccc(C)cc1 ZINC001376733311 1343790775 /nfs/dbraw/zinc/79/07/75/1343790775.db2.gz XGGBKQCLILAOPX-MJGOQNOKSA-N 1 3 331.504 2.506 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001376781048 1343834108 /nfs/dbraw/zinc/83/41/08/1343834108.db2.gz DSRVRNPWVOBBJM-OAHLLOKOSA-N 1 3 342.487 2.637 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)NCc1ccc(Cl)s1 ZINC001376790581 1343841460 /nfs/dbraw/zinc/84/14/60/1343841460.db2.gz HQOQLBDPRINMAG-AGIUHOORSA-N 1 3 343.924 2.726 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)NCc1ccc(Cl)s1 ZINC001376790581 1343841462 /nfs/dbraw/zinc/84/14/62/1343841462.db2.gz HQOQLBDPRINMAG-AGIUHOORSA-N 1 3 343.924 2.726 10 0 EFAEHO CCc1cccc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCC2)c1 ZINC001376816819 1343868133 /nfs/dbraw/zinc/86/81/33/1343868133.db2.gz FSGHHABWXRMPTD-UHFFFAOYSA-N 1 3 331.504 2.718 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NCC1(NCc2ccccc2F)CCC1 ZINC001376820347 1343871798 /nfs/dbraw/zinc/87/17/98/1343871798.db2.gz SPOSECNQERKMEX-HZPDHXFCSA-N 1 3 347.478 2.827 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[N@H+](C)CCC(C)(C)C)CC1 ZINC001376997236 1344038709 /nfs/dbraw/zinc/03/87/09/1344038709.db2.gz ZJNBZKUNXHMBSE-UHFFFAOYSA-N 1 3 325.541 2.935 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[N@@H+](C)CCC(C)(C)C)CC1 ZINC001376997236 1344038713 /nfs/dbraw/zinc/03/87/13/1344038713.db2.gz ZJNBZKUNXHMBSE-UHFFFAOYSA-N 1 3 325.541 2.935 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+](C)CCCN(C)C(=O)CN(C)C(C)C)c1 ZINC001377015776 1344062562 /nfs/dbraw/zinc/06/25/62/1344062562.db2.gz CFLBPKQZVZVNOM-UHFFFAOYSA-N 1 3 333.520 2.924 10 0 EFAEHO Cc1ccc(C)c(C[N@H+](C)CCCN(C)C(=O)CN(C)C(C)C)c1 ZINC001377015776 1344062566 /nfs/dbraw/zinc/06/25/66/1344062566.db2.gz CFLBPKQZVZVNOM-UHFFFAOYSA-N 1 3 333.520 2.924 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001377019173 1344065739 /nfs/dbraw/zinc/06/57/39/1344065739.db2.gz NBCPJPMBHPKRBM-GOSISDBHSA-N 1 3 331.504 2.932 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001377019173 1344065744 /nfs/dbraw/zinc/06/57/44/1344065744.db2.gz NBCPJPMBHPKRBM-GOSISDBHSA-N 1 3 331.504 2.932 10 0 EFAEHO CN(CCC[N@H+](C)[C@@H]1CCc2ccccc21)C(=O)CN1CCCC1 ZINC001377021793 1344069344 /nfs/dbraw/zinc/06/93/44/1344069344.db2.gz SINOPEWFLOIHOV-LJQANCHMSA-N 1 3 329.488 2.550 10 0 EFAEHO CN(CCC[N@@H+](C)[C@@H]1CCc2ccccc21)C(=O)CN1CCCC1 ZINC001377021793 1344069350 /nfs/dbraw/zinc/06/93/50/1344069350.db2.gz SINOPEWFLOIHOV-LJQANCHMSA-N 1 3 329.488 2.550 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001377067596 1344112251 /nfs/dbraw/zinc/11/22/51/1344112251.db2.gz ORLRTJAMUXEAGZ-IAGOWNOFSA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(Cl)s1 ZINC001377070847 1344114664 /nfs/dbraw/zinc/11/46/64/1344114664.db2.gz WNLOGNAIHUFMRB-STQMWFEESA-N 1 3 343.924 2.728 10 0 EFAEHO C[C@@H](c1ccc(Cl)cc1)N(CCNC(=O)CC[NH+](C)C)C1CC1 ZINC001377550409 1344169213 /nfs/dbraw/zinc/16/92/13/1344169213.db2.gz ZYTITMHAYOTMFQ-AWEZNQCLSA-N 1 3 337.895 2.933 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[NH2+][C@@H]2CCc3ccc(Cl)cc32)C1 ZINC001377590676 1344197042 /nfs/dbraw/zinc/19/70/42/1344197042.db2.gz JRELHDNNHSICKC-KBXCAEBGSA-N 1 3 349.906 2.717 10 0 EFAEHO CC[C@@H](F)C[N@H+](CC)CC1CCN(C(=O)[C@@H](CC)N(C)C)CC1 ZINC001377590255 1344197101 /nfs/dbraw/zinc/19/71/01/1344197101.db2.gz DUFVPFTVQZOUQN-IAGOWNOFSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](F)C[N@@H+](CC)CC1CCN(C(=O)[C@@H](CC)N(C)C)CC1 ZINC001377590255 1344197104 /nfs/dbraw/zinc/19/71/04/1344197104.db2.gz DUFVPFTVQZOUQN-IAGOWNOFSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)C[NH2+][C@@H](CNC(=O)[C@H]1CCCN1C(C)C)c1ccccc1 ZINC001377618728 1344227386 /nfs/dbraw/zinc/22/73/86/1344227386.db2.gz GNAVCWCYROPXJU-RBUKOAKNSA-N 1 3 331.504 2.962 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@@H](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001377619771 1344228772 /nfs/dbraw/zinc/22/87/72/1344228772.db2.gz XPPAVYUXLCIQBQ-DOTOQJQBSA-N 1 3 343.531 2.929 10 0 EFAEHO CCCN(C(=O)[C@H]1CCC[N@H+](CCC)C1)[C@H]1CCN(CCCF)C1 ZINC001377658632 1344278671 /nfs/dbraw/zinc/27/86/71/1344278671.db2.gz UHHJRLJCUJQCDM-ROUUACIJSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C(=O)[C@H]1CCC[N@@H+](CCC)C1)[C@H]1CCN(CCCF)C1 ZINC001377658632 1344278672 /nfs/dbraw/zinc/27/86/72/1344278672.db2.gz UHHJRLJCUJQCDM-ROUUACIJSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C(=O)[C@H]1CCC[N@H+](CCC)C1)[C@@H]1CCN(CCCF)C1 ZINC001377658637 1344278796 /nfs/dbraw/zinc/27/87/96/1344278796.db2.gz UHHJRLJCUJQCDM-ZWKOTPCHSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C(=O)[C@H]1CCC[N@@H+](CCC)C1)[C@@H]1CCN(CCCF)C1 ZINC001377658637 1344278798 /nfs/dbraw/zinc/27/87/98/1344278798.db2.gz UHHJRLJCUJQCDM-ZWKOTPCHSA-N 1 3 341.515 2.781 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(C)C[C@H]1CCCN1C(=O)CC[NH+](C)C ZINC001377659651 1344280378 /nfs/dbraw/zinc/28/03/78/1344280378.db2.gz GMAGGJOGAWVNDS-CRAIPNDOSA-N 1 3 335.467 2.761 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001377681912 1344316370 /nfs/dbraw/zinc/31/63/70/1344316370.db2.gz XRNIKANUINKOLI-UYAOXDASSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001377681912 1344316374 /nfs/dbraw/zinc/31/63/74/1344316374.db2.gz XRNIKANUINKOLI-UYAOXDASSA-N 1 3 343.515 2.937 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2c(C)cccc2C)C1)N(C)C ZINC001377692781 1344330627 /nfs/dbraw/zinc/33/06/27/1344330627.db2.gz DFIDEBDIEGUNLX-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2c(C)cccc2C)C1)N(C)C ZINC001377692781 1344330630 /nfs/dbraw/zinc/33/06/30/1344330630.db2.gz DFIDEBDIEGUNLX-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2CC[N@H+](CCCC3CCC3)C2)C1 ZINC001377713381 1344358063 /nfs/dbraw/zinc/35/80/63/1344358063.db2.gz XPLOSEHIVFZDBT-MJGOQNOKSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2CC[N@@H+](CCCC3CCC3)C2)C1 ZINC001377713381 1344358066 /nfs/dbraw/zinc/35/80/66/1344358066.db2.gz XPLOSEHIVFZDBT-MJGOQNOKSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[N@H+](C)CCCC(C)(C)C)C1)N(C)C ZINC001377750346 1344395464 /nfs/dbraw/zinc/39/54/64/1344395464.db2.gz BVXAJPUZRZGGEA-DLBZAZTESA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[N@@H+](C)CCCC(C)(C)C)C1)N(C)C ZINC001377750346 1344395467 /nfs/dbraw/zinc/39/54/67/1344395467.db2.gz BVXAJPUZRZGGEA-DLBZAZTESA-N 1 3 325.541 2.933 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001377805402 1344456379 /nfs/dbraw/zinc/45/63/79/1344456379.db2.gz ISFDXXCZNKWOAK-UONOGXRCSA-N 1 3 337.895 2.807 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(Cl)s1)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001377809992 1344461574 /nfs/dbraw/zinc/46/15/74/1344461574.db2.gz RJSHYBNNSBDSOX-NEPJUHHUSA-N 1 3 343.924 2.869 10 0 EFAEHO C[C@H](NCc1ccccn1)[C@H](C)NC(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001377822232 1344476929 /nfs/dbraw/zinc/47/69/29/1344476929.db2.gz ZJQPKGCRCKHINX-HOTGVXAUSA-N 1 3 346.519 2.717 10 0 EFAEHO C[C@H](NCc1ccccn1)[C@H](C)NC(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001377822232 1344476932 /nfs/dbraw/zinc/47/69/32/1344476932.db2.gz ZJQPKGCRCKHINX-HOTGVXAUSA-N 1 3 346.519 2.717 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)[C@@H](C)NC(=O)CCC[NH+](C)C ZINC001377836698 1344492962 /nfs/dbraw/zinc/49/29/62/1344492962.db2.gz FWJIUQOCBVVDTH-HUUCEWRRSA-N 1 3 339.911 2.973 10 0 EFAEHO C[C@H](NCc1sccc1Cl)[C@H](C)NC(=O)CCC[NH+](C)C ZINC001377838401 1344493850 /nfs/dbraw/zinc/49/38/50/1344493850.db2.gz JQDSKCHTUCLRMK-RYUDHWBXSA-N 1 3 331.913 2.726 10 0 EFAEHO CC[C@H](C)C[NH2+]CC(C)(C)CN(C)C(=O)C(C)(C)N1CCCC1 ZINC001377952660 1344611142 /nfs/dbraw/zinc/61/11/42/1344611142.db2.gz AIMQFGPZQHFTMT-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC(C)(C)CN(C)C(=O)[C@@H]1CCCCN1CC ZINC001377980474 1344633866 /nfs/dbraw/zinc/63/38/66/1344633866.db2.gz WHNZSZUPSDEDOX-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)C[NH2+]CC(C)(C)CN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001377963251 1344619963 /nfs/dbraw/zinc/61/99/63/1344619963.db2.gz QZCBGMVVJZRQBO-IBGZPJMESA-N 1 3 343.531 2.929 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1CN([C@H](C)c2ccccc2)C1)[NH+]1CCCC1 ZINC001378020195 1344671145 /nfs/dbraw/zinc/67/11/45/1344671145.db2.gz JNNFQDZOLUCSTR-XLIONFOSSA-N 1 3 343.515 2.916 10 0 EFAEHO C[C@H](F)CCN1CC[C@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001378064921 1344719022 /nfs/dbraw/zinc/71/90/22/1344719022.db2.gz UAKVVFKGHQWTAI-GJZGRUSLSA-N 1 3 327.488 2.578 10 0 EFAEHO C[C@H](F)CCN1CC[C@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001378064921 1344719023 /nfs/dbraw/zinc/71/90/23/1344719023.db2.gz UAKVVFKGHQWTAI-GJZGRUSLSA-N 1 3 327.488 2.578 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@H+](C)Cc1ccc(Cl)cc1C)N(C)C ZINC001378073502 1344728814 /nfs/dbraw/zinc/72/88/14/1344728814.db2.gz ORPLMPZIADWGJI-RHSMWYFYSA-N 1 3 339.911 2.925 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc(Cl)cc1C)N(C)C ZINC001378073502 1344728819 /nfs/dbraw/zinc/72/88/19/1344728819.db2.gz ORPLMPZIADWGJI-RHSMWYFYSA-N 1 3 339.911 2.925 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@H+](Cc2cccc(C)c2)C1 ZINC001378185428 1344859795 /nfs/dbraw/zinc/85/97/95/1344859795.db2.gz BFIQPXNRQWLAPY-QUCCMNQESA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@@H+](Cc2cccc(C)c2)C1 ZINC001378185428 1344859800 /nfs/dbraw/zinc/85/98/00/1344859800.db2.gz BFIQPXNRQWLAPY-QUCCMNQESA-N 1 3 343.515 2.760 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC001378236424 1344919414 /nfs/dbraw/zinc/91/94/14/1344919414.db2.gz RGISKWKMAYTIRB-KBXCAEBGSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC001378236424 1344919419 /nfs/dbraw/zinc/91/94/19/1344919419.db2.gz RGISKWKMAYTIRB-KBXCAEBGSA-N 1 3 335.467 2.590 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]CC1CC(F)(F)C1 ZINC001378297490 1344965524 /nfs/dbraw/zinc/96/55/24/1344965524.db2.gz PWYMCRXEVMFZSK-JKSUJKDBSA-N 1 3 345.478 2.779 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCCN1CC)[NH2+]Cc1cc(C)ccc1F ZINC001378341496 1344999336 /nfs/dbraw/zinc/99/93/36/1344999336.db2.gz PCYYZIMVYCUVFI-MJGOQNOKSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](F)C[NH2+]CC1(NC(=O)CN(C)C2CCC2)CCCCC1 ZINC001378401270 1345045525 /nfs/dbraw/zinc/04/55/25/1345045525.db2.gz DZRWOULVFDTNKD-HNNXBMFYSA-N 1 3 327.488 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[NH2+]Cc1ccc(CF)cc1 ZINC001393862260 1357221209 /nfs/dbraw/zinc/22/12/09/1357221209.db2.gz SKIADVACOHALAU-IBGZPJMESA-N 1 3 349.494 2.967 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H]1CC[C@H]([NH2+]C[C@@H](F)CC)CC1 ZINC001378435972 1345074235 /nfs/dbraw/zinc/07/42/35/1345074235.db2.gz BMHVQDUNYFJFLH-QAETUUGQSA-N 1 3 327.488 2.626 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H]([NH2+]CCc2cccs2)CC1 ZINC001378454977 1345091160 /nfs/dbraw/zinc/09/11/60/1345091160.db2.gz SBNBKSOMYGNFKN-WKILWMFISA-N 1 3 337.533 2.648 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccc(C[NH2+]CC3CCCC3)cc2)C1 ZINC001378468099 1345103343 /nfs/dbraw/zinc/10/33/43/1345103343.db2.gz QEOVXFPNBZTHQA-QGZVFWFLSA-N 1 3 343.515 2.924 10 0 EFAEHO Cc1ccc(C[NH+]2CC([C@@H](C)NC(=O)CN3CC[C@@H](C)C3)C2)cc1C ZINC001378540446 1345150349 /nfs/dbraw/zinc/15/03/49/1345150349.db2.gz OQZYVLQLWVCUQH-CRAIPNDOSA-N 1 3 343.515 2.582 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+][C@@H]1CCc2ccccc21 ZINC001378562804 1345164747 /nfs/dbraw/zinc/16/47/47/1345164747.db2.gz FMIWNVIUCXBAMM-CRAIPNDOSA-N 1 3 329.488 2.500 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+]CC[C@H](C)F)CCCC1 ZINC001378735576 1345283402 /nfs/dbraw/zinc/28/34/02/1345283402.db2.gz LURBVCQWVFLVGM-HOTGVXAUSA-N 1 3 327.488 2.628 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1cccc2cccnc21)N(C)C ZINC001378779508 1345309856 /nfs/dbraw/zinc/30/98/56/1345309856.db2.gz PUYOZZAJDNBRGD-CRAIPNDOSA-N 1 3 342.487 2.512 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001378824161 1345342030 /nfs/dbraw/zinc/34/20/30/1345342030.db2.gz DCBAJTZVWIRASM-FUHWJXTLSA-N 1 3 331.504 2.582 10 0 EFAEHO C[C@@H](CNCc1sccc1Cl)N(C)C(=O)C[N@@H+]1CC[C@@H](C)C1 ZINC001378837601 1345350909 /nfs/dbraw/zinc/35/09/09/1345350909.db2.gz WYJKPGXSPVMEMP-OLZOCXBDSA-N 1 3 343.924 2.680 10 0 EFAEHO C[C@@H](CNCc1sccc1Cl)N(C)C(=O)C[N@H+]1CC[C@@H](C)C1 ZINC001378837601 1345350914 /nfs/dbraw/zinc/35/09/14/1345350914.db2.gz WYJKPGXSPVMEMP-OLZOCXBDSA-N 1 3 343.924 2.680 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H](CC)N(C)C)C2)c1 ZINC001378844806 1345356231 /nfs/dbraw/zinc/35/62/31/1345356231.db2.gz WZDSHPFJMWTKIP-GUDVDZBRSA-N 1 3 331.504 2.574 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(F)c(Cl)c1)N(C)C ZINC001378846472 1345359038 /nfs/dbraw/zinc/35/90/38/1345359038.db2.gz RGUNYCQDRZYDFR-MLGOLLRUSA-N 1 3 343.874 2.756 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001378850164 1345362185 /nfs/dbraw/zinc/36/21/85/1345362185.db2.gz DCKNRVPLUNBMMM-SZVBFZGTSA-N 1 3 349.494 2.705 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]C[C@@H](C)N(C)C(=O)CN2CCCC2)c1 ZINC001378856632 1345367920 /nfs/dbraw/zinc/36/79/20/1345367920.db2.gz WORMVDATQAGXGL-QZTJIDSGSA-N 1 3 331.504 2.897 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C[C@@H](C)N(C)C(=O)CN2CCCC2)c1 ZINC001378856628 1345368098 /nfs/dbraw/zinc/36/80/98/1345368098.db2.gz WORMVDATQAGXGL-MSOLQXFVSA-N 1 3 331.504 2.897 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2sccc2Cl)C1 ZINC001378864749 1345374190 /nfs/dbraw/zinc/37/41/90/1345374190.db2.gz DAAYLYSSEJWULJ-JOCQHMNTSA-N 1 3 343.924 2.728 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(C)cc2C)C1)N(C)C ZINC001378865930 1345375221 /nfs/dbraw/zinc/37/52/21/1345375221.db2.gz HZFDTCFMXOUTRL-WDSOQIARSA-N 1 3 331.504 2.628 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001378865619 1345375288 /nfs/dbraw/zinc/37/52/88/1345375288.db2.gz GWSRRFAUAMPDJI-IYARVYRRSA-N 1 3 335.536 2.783 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N[C@H]1C[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001378890264 1345400742 /nfs/dbraw/zinc/40/07/42/1345400742.db2.gz HMWIHHYJZHEFAU-CMUWJHTESA-N 1 3 348.318 2.663 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N[C@H]1C[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001378890264 1345400746 /nfs/dbraw/zinc/40/07/46/1345400746.db2.gz HMWIHHYJZHEFAU-CMUWJHTESA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001378893370 1345403084 /nfs/dbraw/zinc/40/30/84/1345403084.db2.gz XSSLGLBSWRBFTF-IYARVYRRSA-N 1 3 335.536 2.781 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](NCc1ccccc1F)C(C)C ZINC001378962950 1345462153 /nfs/dbraw/zinc/46/21/53/1345462153.db2.gz OMMKIALZTMAQHA-RTBURBONSA-N 1 3 349.494 2.931 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](NCc1ccccc1F)C(C)C ZINC001378962950 1345462155 /nfs/dbraw/zinc/46/21/55/1345462155.db2.gz OMMKIALZTMAQHA-RTBURBONSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1ccc(C)c(C)c1)C(C)C)N(C)C ZINC001378970369 1345468468 /nfs/dbraw/zinc/46/84/68/1345468468.db2.gz UZDOALWEMLKCBQ-RBUKOAKNSA-N 1 3 333.520 2.874 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+][C@H](C)CN(C)C(=O)[C@@H]1CCCN1C ZINC001379099371 1345575559 /nfs/dbraw/zinc/57/55/59/1345575559.db2.gz DOHMCFOGEAMHAW-BEFAXECRSA-N 1 3 346.519 2.544 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001379116055 1345593237 /nfs/dbraw/zinc/59/32/37/1345593237.db2.gz HEJRDQNABCHSHD-GOSISDBHSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001379116055 1345593240 /nfs/dbraw/zinc/59/32/40/1345593240.db2.gz HEJRDQNABCHSHD-GOSISDBHSA-N 1 3 337.552 2.933 10 0 EFAEHO CN(CCN(C)C(=O)C12CC[NH+](CC1)C2)Cc1ccccc1C1CC1 ZINC001379127976 1345606367 /nfs/dbraw/zinc/60/63/67/1345606367.db2.gz RWFLPAYQZLMRMH-UHFFFAOYSA-N 1 3 341.499 2.550 10 0 EFAEHO C[C@H](CN(C)C(=O)C[N@@H+]1CC[C@H](C)C1)NCc1ccccc1Cl ZINC001379227104 1345669536 /nfs/dbraw/zinc/66/95/36/1345669536.db2.gz UYCIXHPZSKJHCN-LSDHHAIUSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CN(C)C(=O)C[N@H+]1CC[C@H](C)C1)NCc1ccccc1Cl ZINC001379227104 1345669539 /nfs/dbraw/zinc/66/95/39/1345669539.db2.gz UYCIXHPZSKJHCN-LSDHHAIUSA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]CCC(F)(F)F ZINC001379252236 1345682209 /nfs/dbraw/zinc/68/22/09/1345682209.db2.gz YJBONABXAUPDID-UONOGXRCSA-N 1 3 337.430 2.638 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]CCC(F)(F)F ZINC001379252229 1345682377 /nfs/dbraw/zinc/68/23/77/1345682377.db2.gz YJBONABXAUPDID-KGLIPLIRSA-N 1 3 337.430 2.638 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N(C)C[C@@H](C)NCc2ccsc2)CC1 ZINC001379261654 1345685413 /nfs/dbraw/zinc/68/54/13/1345685413.db2.gz DSKHDQOCZKFEAE-OAHLLOKOSA-N 1 3 337.533 2.805 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001379280436 1345696423 /nfs/dbraw/zinc/69/64/23/1345696423.db2.gz GBZWOUUIOXJVSD-RHSMWYFYSA-N 1 3 339.911 2.925 10 0 EFAEHO C[C@@H](CC[NH2+][C@H]1CCc2ccccc21)NC(=O)CN(C)C1CCC1 ZINC001379297746 1345707576 /nfs/dbraw/zinc/70/75/76/1345707576.db2.gz NPMRTRMASSGYKN-KXBFYZLASA-N 1 3 329.488 2.643 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]CCc1ccccc1F ZINC001379327909 1345731550 /nfs/dbraw/zinc/73/15/50/1345731550.db2.gz LRFUNGNRTKVEJF-QFBILLFUSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@@H](CN(C)C(=O)CCC[NH+]1CCCCC1)NCc1ccsc1 ZINC001379332597 1345734047 /nfs/dbraw/zinc/73/40/47/1345734047.db2.gz ZMCLFMPHGHZOIU-INIZCTEOSA-N 1 3 337.533 2.951 10 0 EFAEHO C[C@H](CNCc1cc2ccccc2o1)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001379383838 1345757089 /nfs/dbraw/zinc/75/70/89/1345757089.db2.gz LYOPIHKFVGFACC-WBVHZDCISA-N 1 3 343.471 2.902 10 0 EFAEHO C[C@H](CNCc1cc2ccccc2o1)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001379383838 1345757091 /nfs/dbraw/zinc/75/70/91/1345757091.db2.gz LYOPIHKFVGFACC-WBVHZDCISA-N 1 3 343.471 2.902 10 0 EFAEHO C[C@H](CNCc1ccc(Cl)s1)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001379414454 1345771463 /nfs/dbraw/zinc/77/14/63/1345771463.db2.gz KXLPAVJRMXONKL-AGIUHOORSA-N 1 3 343.924 2.726 10 0 EFAEHO C[C@H](CNCc1ccc(Cl)s1)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001379414454 1345771465 /nfs/dbraw/zinc/77/14/65/1345771465.db2.gz KXLPAVJRMXONKL-AGIUHOORSA-N 1 3 343.924 2.726 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc3c(c2)CCC3)C[C@@H]1C ZINC001379589739 1345897845 /nfs/dbraw/zinc/89/78/45/1345897845.db2.gz UACCQBJMPRPEQE-OXJNMPFZSA-N 1 3 343.515 2.595 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)C3(N(C)C)CCC3)C2)c(C)c1 ZINC001393898186 1357268309 /nfs/dbraw/zinc/26/83/09/1357268309.db2.gz CTUHIQBNQIXXSR-UHFFFAOYSA-N 1 3 343.515 2.772 10 0 EFAEHO C[C@@H](CNC1c2ccccc2-c2ccccc21)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001379596523 1345907652 /nfs/dbraw/zinc/90/76/52/1345907652.db2.gz HHIMFEVHRCAABV-HOTGVXAUSA-N 1 3 349.478 2.802 10 0 EFAEHO C[C@@H](CNC1c2ccccc2-c2ccccc21)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001379596523 1345907653 /nfs/dbraw/zinc/90/76/53/1345907653.db2.gz HHIMFEVHRCAABV-HOTGVXAUSA-N 1 3 349.478 2.802 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@@H](NCC=C(Cl)Cl)C1CC1 ZINC001419258845 1375005169 /nfs/dbraw/zinc/00/51/69/1375005169.db2.gz BCLGCPKDSNOYLH-UONOGXRCSA-N 1 3 348.318 2.664 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@@H](NCC=C(Cl)Cl)C1CC1 ZINC001419258845 1375005172 /nfs/dbraw/zinc/00/51/72/1375005172.db2.gz BCLGCPKDSNOYLH-UONOGXRCSA-N 1 3 348.318 2.664 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)cc1F ZINC001393953548 1357318102 /nfs/dbraw/zinc/31/81/02/1357318102.db2.gz DYOZDWUQRGXMNN-JKSUJKDBSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(F)cc1)[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001393955598 1357319955 /nfs/dbraw/zinc/31/99/55/1357319955.db2.gz HHZORCBUOVCODZ-CABCVRRESA-N 1 3 335.467 2.683 10 0 EFAEHO COc1cccc(C[NH2+][C@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)c1 ZINC001393962319 1357328477 /nfs/dbraw/zinc/32/84/77/1357328477.db2.gz RXLVPUJPBFPJKO-CVEARBPZSA-N 1 3 347.503 2.552 10 0 EFAEHO C[C@H](C[N@H+](C)C[C@@H]1CCCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001379676273 1347250873 /nfs/dbraw/zinc/25/08/73/1347250873.db2.gz FIKZMZIJTIGTNZ-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001379676273 1347250877 /nfs/dbraw/zinc/25/08/77/1347250877.db2.gz FIKZMZIJTIGTNZ-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[N@H+](C)CC1CCC2(CC2)CC1)NC(=O)CN(C)C1CCC1 ZINC001379681840 1347255802 /nfs/dbraw/zinc/25/58/02/1347255802.db2.gz RHESRNASSQZMGL-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC1CCC2(CC2)CC1)NC(=O)CN(C)C1CCC1 ZINC001379681840 1347255806 /nfs/dbraw/zinc/25/58/06/1347255806.db2.gz RHESRNASSQZMGL-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(F)cc1)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001379693339 1347264286 /nfs/dbraw/zinc/26/42/86/1347264286.db2.gz ROOVCMDHPMWWMY-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(F)cc1)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001379693339 1347264291 /nfs/dbraw/zinc/26/42/91/1347264291.db2.gz ROOVCMDHPMWWMY-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N(C)C[C@H](C)NC(=O)CC[NH+](C)C ZINC001379744853 1347301959 /nfs/dbraw/zinc/30/19/59/1347301959.db2.gz SDOARJWMUUGRIO-UONOGXRCSA-N 1 3 325.884 2.789 10 0 EFAEHO CCc1cccc(CN(C)C[C@H](C)NC(=O)C[C@@H]2CC[N@H+](C)C2)c1 ZINC001379765093 1347317773 /nfs/dbraw/zinc/31/77/73/1347317773.db2.gz MPOONZHLTIUCOZ-LPHOPBHVSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(CN(C)C[C@H](C)NC(=O)C[C@@H]2CC[N@@H+](C)C2)c1 ZINC001379765093 1347317775 /nfs/dbraw/zinc/31/77/75/1347317775.db2.gz MPOONZHLTIUCOZ-LPHOPBHVSA-N 1 3 331.504 2.527 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1cccc(Cl)c1)C1CC1)N(C)C ZINC001379867985 1347378479 /nfs/dbraw/zinc/37/84/79/1347378479.db2.gz FGEJQZYMUJGUGE-IAGOWNOFSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+][C@H](C)c1ccccc1F)C1CC1 ZINC001379912233 1347401906 /nfs/dbraw/zinc/40/19/06/1347401906.db2.gz DNGHYMRCSJHTNB-RDTXWAMCSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+][C@@H](C)c1ccccc1F)C1CC1 ZINC001379911934 1347402168 /nfs/dbraw/zinc/40/21/68/1347402168.db2.gz DNGHYMRCSJHTNB-KBXCAEBGSA-N 1 3 335.467 2.711 10 0 EFAEHO Cc1cccc(C[N@@H+](C)CCN(C(=O)[C@H]2CCCN2C)C(C)C)c1 ZINC001380003793 1347451816 /nfs/dbraw/zinc/45/18/16/1347451816.db2.gz ZGGHTGAYWYPTFK-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1cccc(C[N@H+](C)CCN(C(=O)[C@H]2CCCN2C)C(C)C)c1 ZINC001380003793 1347451817 /nfs/dbraw/zinc/45/18/17/1347451817.db2.gz ZGGHTGAYWYPTFK-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC001380085238 1347508885 /nfs/dbraw/zinc/50/88/85/1347508885.db2.gz QCHQUEKRMYYZBC-CABCVRRESA-N 1 3 343.462 2.533 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1ccc(OC)cc1)C(C)(C)C)N(C)C ZINC001380092120 1347511990 /nfs/dbraw/zinc/51/19/90/1347511990.db2.gz YEYRWJXUSRXCMJ-QZTJIDSGSA-N 1 3 349.519 2.656 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C[NH2+]C[C@H]1CCC(F)(F)C1)C(C)(C)C ZINC001380092182 1347512035 /nfs/dbraw/zinc/51/20/35/1347512035.db2.gz YHYRWRIAALBATN-LSDHHAIUSA-N 1 3 347.494 2.884 10 0 EFAEHO CC[C@H](F)CN1CCC([C@@H](C)NC(=O)[C@H](C(C)C)[NH+](C)C)CC1 ZINC001380121570 1347522140 /nfs/dbraw/zinc/52/21/40/1347522140.db2.gz GIUDRQFDPAPCAE-PVAVHDDUSA-N 1 3 329.504 2.537 10 0 EFAEHO CC[C@@H](F)CN1CCC([C@@H](C)NC(=O)[C@H](C(C)C)[NH+](C)C)CC1 ZINC001380121564 1347522186 /nfs/dbraw/zinc/52/21/86/1347522186.db2.gz GIUDRQFDPAPCAE-OIISXLGYSA-N 1 3 329.504 2.537 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C1CC[NH+](CC2CC(C)C2)CC1)N(C)C ZINC001380141747 1347531082 /nfs/dbraw/zinc/53/10/82/1347531082.db2.gz DHNYUJZEPBRVQD-OLECLDRESA-N 1 3 337.552 2.835 10 0 EFAEHO C[C@@H](F)CC[NH+]1CCC([C@H](C)NC(=O)C(C)(C)N2CCCC2)CC1 ZINC001380142755 1347532019 /nfs/dbraw/zinc/53/20/19/1347532019.db2.gz KGJHXOWJMUIVNO-CVEARBPZSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+][C@@H]2CCc3ccc(F)cc32)C1 ZINC001380174706 1347548992 /nfs/dbraw/zinc/54/89/92/1347548992.db2.gz DBJWDYABPASCBR-FAFZWHIHSA-N 1 3 347.478 2.732 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CC([NH2+]CC[C@@H]2CCCC2(F)F)C1 ZINC001380177200 1347551307 /nfs/dbraw/zinc/55/13/07/1347551307.db2.gz SBMKAAPUIFQHJT-FHERZECASA-N 1 3 345.478 2.733 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CC([NH2+]CC[C@H]2CCCC2(F)F)C1 ZINC001380177201 1347551348 /nfs/dbraw/zinc/55/13/48/1347551348.db2.gz SBMKAAPUIFQHJT-QQFBHYJXSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+]CC1CCC(F)(F)CC1 ZINC001380293366 1347572621 /nfs/dbraw/zinc/57/26/21/1347572621.db2.gz XRZMQZCUYFCUDP-INIZCTEOSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](C(=O)NC1(C)CC[NH+](C[C@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001380294970 1347573419 /nfs/dbraw/zinc/57/34/19/1347573419.db2.gz QTCAVBVMPAZBKW-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1(C)CC[NH+](CC2CC3(CCC3)C2)CC1 ZINC001380311505 1347583880 /nfs/dbraw/zinc/58/38/80/1347583880.db2.gz HRDQLZZBIUPPDN-UHFFFAOYSA-N 1 3 344.503 2.812 10 0 EFAEHO CC(C)(C(=O)N[C@H](C[NH2+]CC1CCC1)C1CCCC1)N1CCCC1 ZINC001380321504 1347591575 /nfs/dbraw/zinc/59/15/75/1347591575.db2.gz HASRECVKBCRLNX-GOSISDBHSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@H](C(=O)N[C@]1(C)CC[N@H+](CCc2ccccc2)C1)N(CC)CC ZINC001380359802 1347617615 /nfs/dbraw/zinc/61/76/15/1347617615.db2.gz QBPVIYJLZXYTPA-TZIWHRDSSA-N 1 3 345.531 2.930 10 0 EFAEHO CC[C@H](C(=O)N[C@]1(C)CC[N@@H+](CCc2ccccc2)C1)N(CC)CC ZINC001380359802 1347617621 /nfs/dbraw/zinc/61/76/21/1347617621.db2.gz QBPVIYJLZXYTPA-TZIWHRDSSA-N 1 3 345.531 2.930 10 0 EFAEHO CN(CC(=O)N1CC[C@](C)(C[NH2+]Cc2ccsc2)C1)C1CCC1 ZINC001380394718 1347643967 /nfs/dbraw/zinc/64/39/67/1347643967.db2.gz DUFKTNMGCRSTGV-GOSISDBHSA-N 1 3 335.517 2.561 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2ccsc2)C1)N(C)C ZINC001380407526 1347651780 /nfs/dbraw/zinc/65/17/80/1347651780.db2.gz NVZDGWJNMORFKS-FUHWJXTLSA-N 1 3 337.533 2.663 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001380411105 1347653751 /nfs/dbraw/zinc/65/37/51/1347653751.db2.gz WGUNGDKCPUHKGZ-CTNGQTDRSA-N 1 3 345.531 2.972 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@](C)(C[NH2+]C[C@@H]2CCC(F)(F)C2)C1 ZINC001380422422 1347660715 /nfs/dbraw/zinc/66/07/15/1347660715.db2.gz KDOMZUGQQCBFCR-WBVHZDCISA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[N@H+](CC2CCCC2)CCC1(F)F ZINC001380520411 1347738956 /nfs/dbraw/zinc/73/89/56/1347738956.db2.gz MFOVMNMJMACFET-INIZCTEOSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[N@@H+](CC2CCCC2)CCC1(F)F ZINC001380520411 1347738960 /nfs/dbraw/zinc/73/89/60/1347738960.db2.gz MFOVMNMJMACFET-INIZCTEOSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)[C@H](C)NCc1ccccc1Cl ZINC001393999935 1357370618 /nfs/dbraw/zinc/37/06/18/1357370618.db2.gz RWQXQSXABVEGOB-KBPBESRZSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)[C@H](C)NCc1ccccc1Cl ZINC001393999935 1357370622 /nfs/dbraw/zinc/37/06/22/1357370622.db2.gz RWQXQSXABVEGOB-KBPBESRZSA-N 1 3 325.884 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCC1CCCC1)C2 ZINC001380660001 1347795831 /nfs/dbraw/zinc/79/58/31/1347795831.db2.gz PFOAFTSJJMOJJW-FHWLQOOXSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCC1CCCC1)C2 ZINC001380660001 1347795833 /nfs/dbraw/zinc/79/58/33/1347795833.db2.gz PFOAFTSJJMOJJW-FHWLQOOXSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccsc1)N(C)C ZINC001380677173 1347806579 /nfs/dbraw/zinc/80/65/79/1347806579.db2.gz ARSWTGNPOUFXGG-XMTFNYHQSA-N 1 3 349.544 2.948 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccsc1)N(C)C ZINC001380677173 1347806582 /nfs/dbraw/zinc/80/65/82/1347806582.db2.gz ARSWTGNPOUFXGG-XMTFNYHQSA-N 1 3 349.544 2.948 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2cc(C)cc(C)c2)C1 ZINC001380693910 1347818627 /nfs/dbraw/zinc/81/86/27/1347818627.db2.gz YOAIGMUXIVUJKA-AZUAARDMSA-N 1 3 345.531 2.829 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1C[C@@H]2C[N@@H+](CCCC(C)C)C[C@@H]2C1 ZINC001380705337 1347824885 /nfs/dbraw/zinc/82/48/85/1347824885.db2.gz RUXLYQMDFBGHOF-OTWHNJEPSA-N 1 3 335.536 2.687 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1C[C@@H]2C[N@H+](CCCC(C)C)C[C@@H]2C1 ZINC001380705337 1347824890 /nfs/dbraw/zinc/82/48/90/1347824890.db2.gz RUXLYQMDFBGHOF-OTWHNJEPSA-N 1 3 335.536 2.687 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2CCC(F)(F)F ZINC001380754544 1347849550 /nfs/dbraw/zinc/84/95/50/1347849550.db2.gz ARORBSUOZKLDAV-CABCVRRESA-N 1 3 349.441 2.736 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2CCC(F)(F)F ZINC001380754544 1347849551 /nfs/dbraw/zinc/84/95/51/1347849551.db2.gz ARORBSUOZKLDAV-CABCVRRESA-N 1 3 349.441 2.736 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2CCC(F)(F)F ZINC001380754546 1347849680 /nfs/dbraw/zinc/84/96/80/1347849680.db2.gz ARORBSUOZKLDAV-HUUCEWRRSA-N 1 3 349.441 2.736 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2CCC(F)(F)F ZINC001380754546 1347849682 /nfs/dbraw/zinc/84/96/82/1347849682.db2.gz ARORBSUOZKLDAV-HUUCEWRRSA-N 1 3 349.441 2.736 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+]C[C@@H]2CCCC(F)(F)C2)CCC1)N(C)C ZINC001380897532 1347943379 /nfs/dbraw/zinc/94/33/79/1347943379.db2.gz SITMSGCCPXEEFB-HUUCEWRRSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CCC[N@H+](CCCF)C1 ZINC001380987143 1348007184 /nfs/dbraw/zinc/00/71/84/1348007184.db2.gz BAQYKRHLQBLIOL-QZTJIDSGSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CCC[N@@H+](CCCF)C1 ZINC001380987143 1348007187 /nfs/dbraw/zinc/00/71/87/1348007187.db2.gz BAQYKRHLQBLIOL-QZTJIDSGSA-N 1 3 341.515 2.779 10 0 EFAEHO CCC1(NC/C(Cl)=C/Cl)CCN(C(=O)[C@H]2CC[N@H+](C)C2)CC1 ZINC001381024421 1348026053 /nfs/dbraw/zinc/02/60/53/1348026053.db2.gz YJFNPPZSIIVDNT-ODUNQGDFSA-N 1 3 348.318 2.618 10 0 EFAEHO CCC1(NC/C(Cl)=C/Cl)CCN(C(=O)[C@H]2CC[N@@H+](C)C2)CC1 ZINC001381024421 1348026056 /nfs/dbraw/zinc/02/60/56/1348026056.db2.gz YJFNPPZSIIVDNT-ODUNQGDFSA-N 1 3 348.318 2.618 10 0 EFAEHO CC[C@H](C(=O)NCc1ccc2c(c1)C[N@@H+](CCC1CC1)C2)N(C)C ZINC001381071643 1348057776 /nfs/dbraw/zinc/05/77/76/1348057776.db2.gz XWNXMEKBXXFQKP-LJQANCHMSA-N 1 3 329.488 2.759 10 0 EFAEHO CC[C@H](C(=O)NCc1ccc2c(c1)C[N@H+](CCC1CC1)C2)N(C)C ZINC001381071643 1348057783 /nfs/dbraw/zinc/05/77/83/1348057783.db2.gz XWNXMEKBXXFQKP-LJQANCHMSA-N 1 3 329.488 2.759 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N2CCC(C)(NC/C(Cl)=C\Cl)CC2)C1 ZINC001381127864 1348095986 /nfs/dbraw/zinc/09/59/86/1348095986.db2.gz HLTWHNRQJXKKBM-PCRWRXJSSA-N 1 3 348.318 2.618 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N2CCC(C)(NC/C(Cl)=C\Cl)CC2)C1 ZINC001381127864 1348095991 /nfs/dbraw/zinc/09/59/91/1348095991.db2.gz HLTWHNRQJXKKBM-PCRWRXJSSA-N 1 3 348.318 2.618 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]C[C@H](C)CC(C)C)CC1 ZINC001381129373 1348097062 /nfs/dbraw/zinc/09/70/62/1348097062.db2.gz LOENPPVAELXTBW-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@H](F)CC[NH2+]C1(C)CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001381130540 1348097795 /nfs/dbraw/zinc/09/77/95/1348097795.db2.gz ZXLBXRLIMBBVSI-HNNXBMFYSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381135325 1348101949 /nfs/dbraw/zinc/10/19/49/1348101949.db2.gz QGACPZSXQOMKES-DLBZAZTESA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381135325 1348101950 /nfs/dbraw/zinc/10/19/50/1348101950.db2.gz QGACPZSXQOMKES-DLBZAZTESA-N 1 3 325.541 2.835 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCN(CCc2ccccc2F)CC1(C)C ZINC001381137456 1348103114 /nfs/dbraw/zinc/10/31/14/1348103114.db2.gz XKRMVMSZOMZSBW-SFHVURJKSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@H+](CCCC(C)C)CC1(C)C)N(C)C ZINC001381137008 1348103201 /nfs/dbraw/zinc/10/32/01/1348103201.db2.gz CMOKDNJXDCEOCA-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@@H+](CCCC(C)C)CC1(C)C)N(C)C ZINC001381137008 1348103204 /nfs/dbraw/zinc/10/32/04/1348103204.db2.gz CMOKDNJXDCEOCA-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@@H]1CCN(Cc2ccsc2)[C@H](C)C1 ZINC001381173942 1348121764 /nfs/dbraw/zinc/12/17/64/1348121764.db2.gz OVCMETGDJNAZDL-NVXWUHKLSA-N 1 3 337.533 2.949 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@@H]1CCN(Cc2ccsc2)[C@H](C)C1 ZINC001381173942 1348121767 /nfs/dbraw/zinc/12/17/67/1348121767.db2.gz OVCMETGDJNAZDL-NVXWUHKLSA-N 1 3 337.533 2.949 10 0 EFAEHO CC(C)c1cccc(C[NH2+][C@@H](C)CCNC(=O)C2(N(C)C)CCC2)n1 ZINC001381193623 1348132102 /nfs/dbraw/zinc/13/21/02/1348132102.db2.gz IHCYRIFNZQIDLY-INIZCTEOSA-N 1 3 346.519 2.674 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC(C)(C)C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CCC1 ZINC001394019150 1357390971 /nfs/dbraw/zinc/39/09/71/1357390971.db2.gz FWQOWCCBPVKLGA-FGTMMUONSA-N 1 3 349.563 2.981 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CCC(C)C)N(C)C ZINC001381276771 1348180950 /nfs/dbraw/zinc/18/09/50/1348180950.db2.gz QRHMRFMBLDIYEF-GUDVDZBRSA-N 1 3 331.504 2.745 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]1C[N@H+](C)CCCc1ccccc1 ZINC001381283609 1348185822 /nfs/dbraw/zinc/18/58/22/1348185822.db2.gz LEOWZAXHSYFNGQ-UXHICEINSA-N 1 3 343.515 2.636 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]1C[N@@H+](C)CCCc1ccccc1 ZINC001381283609 1348185826 /nfs/dbraw/zinc/18/58/26/1348185826.db2.gz LEOWZAXHSYFNGQ-UXHICEINSA-N 1 3 343.515 2.636 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@H+](C)CCCc1ccccc1 ZINC001381283607 1348185953 /nfs/dbraw/zinc/18/59/53/1348185953.db2.gz LEOWZAXHSYFNGQ-PMACEKPBSA-N 1 3 343.515 2.636 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@@H+](C)CCCc1ccccc1 ZINC001381283607 1348185958 /nfs/dbraw/zinc/18/59/58/1348185958.db2.gz LEOWZAXHSYFNGQ-PMACEKPBSA-N 1 3 343.515 2.636 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC1CC(CNC/C(Cl)=C\Cl)C1 ZINC001381325940 1348211157 /nfs/dbraw/zinc/21/11/57/1348211157.db2.gz XVEMYDZDKRXRKY-WTYWQWDTSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC1CC(CNC/C(Cl)=C\Cl)C1 ZINC001381325940 1348211160 /nfs/dbraw/zinc/21/11/60/1348211160.db2.gz XVEMYDZDKRXRKY-WTYWQWDTSA-N 1 3 348.318 2.664 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]CC2CCC(F)(F)CC2)C1)N(C)C ZINC001381336844 1348214118 /nfs/dbraw/zinc/21/41/18/1348214118.db2.gz CUZHOBBJBDRIAI-UYSNPLJNSA-N 1 3 345.478 2.637 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001381386472 1348235810 /nfs/dbraw/zinc/23/58/10/1348235810.db2.gz IAOMYZUTTOIFRX-LSDHHAIUSA-N 1 3 335.467 2.601 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H](C)[NH2+]Cc1ccc(CF)cc1 ZINC001381389891 1348237349 /nfs/dbraw/zinc/23/73/49/1348237349.db2.gz MCAPSJAHIFSVCM-HUUCEWRRSA-N 1 3 335.467 2.623 10 0 EFAEHO C[C@@H](NCc1cc2ccccc2o1)[C@H](C)NC(=O)C1CC[NH+](C)CC1 ZINC001381427261 1348265653 /nfs/dbraw/zinc/26/56/53/1348265653.db2.gz ZKNDOPNVFHDNNM-CABCVRRESA-N 1 3 343.471 2.757 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@H+](C)Cc1ccc2ncccc2c1)N(C)C ZINC001381530880 1348333957 /nfs/dbraw/zinc/33/39/57/1348333957.db2.gz IGKYAVCRBIFSME-DNVCBOLYSA-N 1 3 342.487 2.512 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc2ncccc2c1)N(C)C ZINC001381530880 1348333960 /nfs/dbraw/zinc/33/39/60/1348333960.db2.gz IGKYAVCRBIFSME-DNVCBOLYSA-N 1 3 342.487 2.512 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC[C@H](C)N(C)Cc2ccccc2)C1 ZINC001381573115 1348369613 /nfs/dbraw/zinc/36/96/13/1348369613.db2.gz KKBYEWCBRASCLO-HKUYNNGSSA-N 1 3 331.504 2.745 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC[C@H](C)N(C)Cc2ccccc2)C1 ZINC001381573115 1348369615 /nfs/dbraw/zinc/36/96/15/1348369615.db2.gz KKBYEWCBRASCLO-HKUYNNGSSA-N 1 3 331.504 2.745 10 0 EFAEHO C[C@@H](CNC(=O)C1(C[NH+](C)C)CC1)N(C)Cc1ccc(C2CC2)cc1 ZINC001381578283 1348374295 /nfs/dbraw/zinc/37/42/95/1348374295.db2.gz SGDICEODWWOCOR-INIZCTEOSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1C ZINC001381582022 1348377434 /nfs/dbraw/zinc/37/74/34/1348377434.db2.gz HYRYKHYOBLRIHG-MAUKXSAKSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1C ZINC001381582022 1348377439 /nfs/dbraw/zinc/37/74/39/1348377439.db2.gz HYRYKHYOBLRIHG-MAUKXSAKSA-N 1 3 331.504 2.582 10 0 EFAEHO C[C@@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)N(C)Cc1cccc(Cl)c1 ZINC001381613917 1348404763 /nfs/dbraw/zinc/40/47/63/1348404763.db2.gz ZQEGVYHPQCMFNB-HOCLYGCPSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)N(C)Cc1cccc(Cl)c1 ZINC001381613917 1348404765 /nfs/dbraw/zinc/40/47/65/1348404765.db2.gz ZQEGVYHPQCMFNB-HOCLYGCPSA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)CC[C@@H]1CCCC1(F)F ZINC001381639333 1348424214 /nfs/dbraw/zinc/42/42/14/1348424214.db2.gz BBMFHVAGSPXOSI-CABCVRRESA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC001381639333 1348424216 /nfs/dbraw/zinc/42/42/16/1348424216.db2.gz BBMFHVAGSPXOSI-CABCVRRESA-N 1 3 333.467 2.589 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@H](C)[N@H+](C)Cc1ccc(OC)cc1 ZINC001381639256 1348424229 /nfs/dbraw/zinc/42/42/29/1348424229.db2.gz APAGKCJJCZACKH-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@H](C)[N@@H+](C)Cc1ccc(OC)cc1 ZINC001381639256 1348424232 /nfs/dbraw/zinc/42/42/32/1348424232.db2.gz APAGKCJJCZACKH-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@H](c1ccccc1)[N@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)C3CCC3)[C@@H]2C1 ZINC001381891965 1348594281 /nfs/dbraw/zinc/59/42/81/1348594281.db2.gz KZDGWYVNVXZDSB-XLNTUCKNSA-N 1 3 341.499 2.526 10 0 EFAEHO C[C@H](c1ccccc1)[N@@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)C3CCC3)[C@@H]2C1 ZINC001381891965 1348594284 /nfs/dbraw/zinc/59/42/84/1348594284.db2.gz KZDGWYVNVXZDSB-XLNTUCKNSA-N 1 3 341.499 2.526 10 0 EFAEHO CC(C)(C)CCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001381907343 1348599960 /nfs/dbraw/zinc/59/99/60/1348599960.db2.gz AWTXXNJHTHCPJE-NNZMDNLPSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)(C)CCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001381907343 1348599963 /nfs/dbraw/zinc/59/99/63/1348599963.db2.gz AWTXXNJHTHCPJE-NNZMDNLPSA-N 1 3 349.563 2.981 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccccc2)C1)CC(C)(C)C ZINC001381970416 1348631002 /nfs/dbraw/zinc/63/10/02/1348631002.db2.gz WUXVTLJTDJECSI-IYARVYRRSA-N 1 3 331.504 2.649 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)NCc1ccc(Cl)s1 ZINC001382067999 1348696039 /nfs/dbraw/zinc/69/60/39/1348696039.db2.gz MINJSODBCYJVOB-OUCADQQQSA-N 1 3 343.924 2.678 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)NCc1ccc(Cl)s1 ZINC001382067999 1348696044 /nfs/dbraw/zinc/69/60/44/1348696044.db2.gz MINJSODBCYJVOB-OUCADQQQSA-N 1 3 343.924 2.678 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001382128246 1348749060 /nfs/dbraw/zinc/74/90/60/1348749060.db2.gz SUKVJGWSOUXUAV-KXBFYZLASA-N 1 3 345.531 2.890 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1cccc(OC)c1 ZINC001382160476 1348782252 /nfs/dbraw/zinc/78/22/52/1348782252.db2.gz BKEHNUOTOKOYLI-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)CN(C)C(=O)CN(C)C(C)C)c(C)s1 ZINC001382165967 1348787639 /nfs/dbraw/zinc/78/76/39/1348787639.db2.gz NFGKGEOTMRAUTR-CYBMUJFWSA-N 1 3 325.522 2.642 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1cc(F)ccc1C ZINC001382166756 1348788491 /nfs/dbraw/zinc/78/84/91/1348788491.db2.gz OTBATKKXYYVQLT-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)c1 ZINC001382310766 1348859851 /nfs/dbraw/zinc/85/98/51/1348859851.db2.gz JVKBGQWWNLSCAI-IEBWSBKVSA-N 1 3 331.504 2.723 10 0 EFAEHO C[C@H](NC(=O)CCC[NH+](C)C)C1CCN(Cc2ccsc2)CC1 ZINC001382560931 1349020322 /nfs/dbraw/zinc/02/03/22/1349020322.db2.gz PANFVXDMAYHHSD-HNNXBMFYSA-N 1 3 337.533 2.807 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)[NH+]1CCCC1)C1CCN(C/C=C/Cl)CC1 ZINC001382560002 1349020689 /nfs/dbraw/zinc/02/06/89/1349020689.db2.gz OFTIXRLCWLAOCQ-PPYMECGQSA-N 1 3 341.927 2.830 10 0 EFAEHO CN(CC(=O)N(C)C1CC([NH2+]Cc2ccsc2)C1)CC(C)(C)C ZINC001382584649 1349033524 /nfs/dbraw/zinc/03/35/24/1349033524.db2.gz ZORNNVGCZGPDSU-UHFFFAOYSA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]CC2CCC(F)(F)CC2)C1 ZINC001382585001 1349034429 /nfs/dbraw/zinc/03/44/29/1349034429.db2.gz PWXKYUWJSBLMHC-UHFFFAOYSA-N 1 3 345.478 2.731 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1C(=O)N(C)C1CC(NCC=C(Cl)Cl)C1 ZINC001382588792 1349036293 /nfs/dbraw/zinc/03/62/93/1349036293.db2.gz GHHZWZLOONZSQZ-JXQTWKCFSA-N 1 3 348.318 2.759 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1C(=O)N(C)C1CC(NCC=C(Cl)Cl)C1 ZINC001382588792 1349036298 /nfs/dbraw/zinc/03/62/98/1349036298.db2.gz GHHZWZLOONZSQZ-JXQTWKCFSA-N 1 3 348.318 2.759 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C1CC([NH2+]CC=C(Cl)Cl)C1 ZINC001382588792 1349036302 /nfs/dbraw/zinc/03/63/02/1349036302.db2.gz GHHZWZLOONZSQZ-JXQTWKCFSA-N 1 3 348.318 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]Cc2ccc(CF)cc2)C1 ZINC001382589542 1349036597 /nfs/dbraw/zinc/03/65/97/1349036597.db2.gz MGYOVSQWYOMSEC-UHFFFAOYSA-N 1 3 335.467 2.575 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001420041158 1376357334 /nfs/dbraw/zinc/35/73/34/1376357334.db2.gz AYLUREZKGDFQEH-ROUUACIJSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001420041158 1376357343 /nfs/dbraw/zinc/35/73/43/1376357343.db2.gz AYLUREZKGDFQEH-ROUUACIJSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]([NH2+]CCc2ccccc2)C1)N1CCCC1 ZINC001388724373 1352952765 /nfs/dbraw/zinc/95/27/65/1352952765.db2.gz FGXHLIDQZUIYII-WGSAOQKQSA-N 1 3 343.515 2.588 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccccc2)C1)N1CCCC1 ZINC001388755239 1352981105 /nfs/dbraw/zinc/98/11/05/1352981105.db2.gz YURIYLDRZVUOCW-RBUKOAKNSA-N 1 3 343.515 2.936 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CCC2CC2)C1)N1CCCCCC1 ZINC001388759415 1352985663 /nfs/dbraw/zinc/98/56/63/1352985663.db2.gz KRDDNTPLAMDLOO-YTQUADARSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@@H](C(=O)N1CCCCC[C@@H]([NH2+]CCC(F)(F)F)C1)N(C)C ZINC001388789166 1353017949 /nfs/dbraw/zinc/01/79/49/1353017949.db2.gz DEWLIWXNSKLCJP-KGLIPLIRSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+][C@@H]1CCCCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001388796845 1353027484 /nfs/dbraw/zinc/02/74/84/1353027484.db2.gz JBCMDHIBUJUHHJ-IAGOWNOFSA-N 1 3 334.508 2.995 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@H+](Cc2cccnc2)CC(C)(C)C1)N(C)C ZINC001388834741 1353071902 /nfs/dbraw/zinc/07/19/02/1353071902.db2.gz GFJDHUZSROUXCF-ROUUACIJSA-N 1 3 346.519 2.529 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@@H+](Cc2cccnc2)CC(C)(C)C1)N(C)C ZINC001388834741 1353071905 /nfs/dbraw/zinc/07/19/05/1353071905.db2.gz GFJDHUZSROUXCF-ROUUACIJSA-N 1 3 346.519 2.529 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)[C@H]2CCCN2C(C)C)C2CC2)cc1 ZINC001389611758 1353510396 /nfs/dbraw/zinc/51/03/96/1353510396.db2.gz OSUHGLCYTCOFKK-WOJBJXKFSA-N 1 3 343.515 2.852 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccccc1Cl)C1CC1)N(C)C ZINC001389699227 1353564267 /nfs/dbraw/zinc/56/42/67/1353564267.db2.gz UQYQXXBEKRFQCK-IAGOWNOFSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@H+](C)Cc2cccc(F)c2)C1 ZINC001389743709 1353595327 /nfs/dbraw/zinc/59/53/27/1353595327.db2.gz NNROFPBYSOXDSO-SFHVURJKSA-N 1 3 349.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@@H+](C)Cc2cccc(F)c2)C1 ZINC001389743709 1353595331 /nfs/dbraw/zinc/59/53/31/1353595331.db2.gz NNROFPBYSOXDSO-SFHVURJKSA-N 1 3 349.494 2.836 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccc(Cl)cc32)C1 ZINC001389900906 1353677143 /nfs/dbraw/zinc/67/71/43/1353677143.db2.gz PHAXOKUHFCEKRS-JFIYKMOQSA-N 1 3 349.906 2.906 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2)C1)C1CCC1 ZINC001389960588 1353711486 /nfs/dbraw/zinc/71/14/86/1353711486.db2.gz PQBHVQNDZFWIRV-IYBDPMFKSA-N 1 3 335.879 2.561 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2C)C1)N(C)C ZINC001389977917 1353720490 /nfs/dbraw/zinc/72/04/90/1353720490.db2.gz KEMYOAGNTOSFMM-IXDOHACOSA-N 1 3 337.895 2.725 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2ccc(F)cc2Cl)C1 ZINC001390000327 1353733774 /nfs/dbraw/zinc/73/37/74/1353733774.db2.gz DDDDVBYGTQNZCJ-GASCZTMLSA-N 1 3 341.858 2.558 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2ccc(F)cc2Cl)C1 ZINC001390000327 1353733779 /nfs/dbraw/zinc/73/37/79/1353733779.db2.gz DDDDVBYGTQNZCJ-GASCZTMLSA-N 1 3 341.858 2.558 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCc3c2cccc3Cl)C1)N(C)C ZINC001390007054 1353738438 /nfs/dbraw/zinc/73/84/38/1353738438.db2.gz GFYGGQQZHBDUPU-RUZGCFLTSA-N 1 3 349.906 2.904 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2cc(C)ccc2F)C1 ZINC001390011574 1353741795 /nfs/dbraw/zinc/74/17/95/1353741795.db2.gz POCPAVCCWAHSFK-CALCHBBNSA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2cc(C)ccc2F)C1 ZINC001390011574 1353741798 /nfs/dbraw/zinc/74/17/98/1353741798.db2.gz POCPAVCCWAHSFK-CALCHBBNSA-N 1 3 335.467 2.603 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2cccc(F)c2)C1)N(C)C ZINC001390012193 1353742262 /nfs/dbraw/zinc/74/22/62/1353742262.db2.gz QVIJNILZOYXSBS-ZSGPHXLJSA-N 1 3 335.467 2.710 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001390014604 1353743589 /nfs/dbraw/zinc/74/35/89/1353743589.db2.gz YIWWZXSMEQELGZ-SCTDSRPQSA-N 1 3 331.504 2.689 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](Cc2cc(C)ccc2C)C1)N(C)C ZINC001390035901 1353755032 /nfs/dbraw/zinc/75/50/32/1353755032.db2.gz ITSGQNNNFASYQX-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](Cc2cc(C)ccc2C)C1)N(C)C ZINC001390035901 1353755036 /nfs/dbraw/zinc/75/50/36/1353755036.db2.gz ITSGQNNNFASYQX-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001390038949 1353758265 /nfs/dbraw/zinc/75/82/65/1353758265.db2.gz UEOUNBLFHCILJT-HDICACEKSA-N 1 3 331.504 2.689 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]CC[C@H]2CCc3ccccc32)C1 ZINC001390040005 1353759980 /nfs/dbraw/zinc/75/99/80/1353759980.db2.gz VEBSVWUTWPJZHH-QRVBRYPASA-N 1 3 343.515 2.684 10 0 EFAEHO CCc1cccc(C[N@H+]2CCC[C@@H](CNC(=O)[C@@H](CC)N(C)C)C2)c1 ZINC001390067045 1353780697 /nfs/dbraw/zinc/78/06/97/1353780697.db2.gz RFHLNSTVDDRBOH-VQTJNVASSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1cccc(C[N@@H+]2CCC[C@@H](CNC(=O)[C@@H](CC)N(C)C)C2)c1 ZINC001390067045 1353780699 /nfs/dbraw/zinc/78/06/99/1353780699.db2.gz RFHLNSTVDDRBOH-VQTJNVASSA-N 1 3 345.531 2.917 10 0 EFAEHO COc1ccc(C[NH2+]C[C@H]2CCCCN2C(=O)CN(C)C(C)C)cc1 ZINC001390159436 1353874234 /nfs/dbraw/zinc/87/42/34/1353874234.db2.gz QFZJOODXIKFWQP-GOSISDBHSA-N 1 3 347.503 2.506 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc3cc[nH]c3c2)[C@H]1C ZINC001394671390 1357989141 /nfs/dbraw/zinc/98/91/41/1357989141.db2.gz DIWFIJHIIPCDAP-CRAIPNDOSA-N 1 3 342.487 2.589 10 0 EFAEHO Cc1ccc(C[NH2+]C2CCC(NC(=O)CN(C)C(C)C)CC2)c(C)n1 ZINC001390272277 1353969361 /nfs/dbraw/zinc/96/93/61/1353969361.db2.gz DXPCZCIGUUSOIB-UHFFFAOYSA-N 1 3 346.519 2.556 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)CNC(=O)[C@H]2CCCN2C(C)C)c(C)s1 ZINC001390359774 1354028049 /nfs/dbraw/zinc/02/80/49/1354028049.db2.gz JNMBAIUNNOBECG-SUMWQHHRSA-N 1 3 337.533 2.832 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCCC1)[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001390371961 1354039991 /nfs/dbraw/zinc/03/99/91/1354039991.db2.gz GRGWQXNHGRAKJZ-GJZGRUSLSA-N 1 3 345.478 2.781 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc(C)c(F)c1 ZINC001390394154 1354060247 /nfs/dbraw/zinc/06/02/47/1354060247.db2.gz AAWUPBOLXLIPLT-QAPCUYQASA-N 1 3 335.467 2.603 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc(C)c(F)c1 ZINC001390394159 1354060610 /nfs/dbraw/zinc/06/06/10/1354060610.db2.gz AAWUPBOLXLIPLT-YJBOKZPZSA-N 1 3 335.467 2.603 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001390395998 1354062197 /nfs/dbraw/zinc/06/21/97/1354062197.db2.gz CVHYNUPZGPXMFF-RHSMWYFYSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)NCc1cc2ccccc2o1 ZINC001390406603 1354067838 /nfs/dbraw/zinc/06/78/38/1354067838.db2.gz USFSULUDISTMSB-NVXWUHKLSA-N 1 3 343.471 2.902 10 0 EFAEHO C[C@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)NCc1cc2ccccc2o1 ZINC001390406603 1354067844 /nfs/dbraw/zinc/06/78/44/1354067844.db2.gz USFSULUDISTMSB-NVXWUHKLSA-N 1 3 343.471 2.902 10 0 EFAEHO C[C@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)NCc1cc2ccccc2o1 ZINC001390406608 1354068279 /nfs/dbraw/zinc/06/82/79/1354068279.db2.gz USFSULUDISTMSB-WBVHZDCISA-N 1 3 343.471 2.902 10 0 EFAEHO C[C@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)NCc1cc2ccccc2o1 ZINC001390406608 1354068286 /nfs/dbraw/zinc/06/82/86/1354068286.db2.gz USFSULUDISTMSB-WBVHZDCISA-N 1 3 343.471 2.902 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1cccc(CC)c1 ZINC001390410290 1354070582 /nfs/dbraw/zinc/07/05/82/1354070582.db2.gz WJXXXHKMDGLICP-LPHOPBHVSA-N 1 3 331.504 2.718 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](C)CNC(=O)C(C)(C)N2CCCC2)c1 ZINC001390451689 1354088867 /nfs/dbraw/zinc/08/88/67/1354088867.db2.gz FWUHVLHRUBEYTI-QGZVFWFLSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+][C@@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001390478534 1354111774 /nfs/dbraw/zinc/11/17/74/1354111774.db2.gz JDLZOLPICZVOJM-ROUUACIJSA-N 1 3 345.531 2.821 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+][C@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001390478538 1354111985 /nfs/dbraw/zinc/11/19/85/1354111985.db2.gz JDLZOLPICZVOJM-ZWKOTPCHSA-N 1 3 345.531 2.821 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC001390607512 1354202138 /nfs/dbraw/zinc/20/21/38/1354202138.db2.gz IQKUCQSWYMIUAU-MSOLQXFVSA-N 1 3 335.467 2.683 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]([N@H+](C)C/C=C/c2ccccc2)C1)N(C)C ZINC001390641851 1354240365 /nfs/dbraw/zinc/24/03/65/1354240365.db2.gz ZHANTHOVIUAINO-LRHIHOEBSA-N 1 3 343.515 2.963 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]([N@@H+](C)C/C=C/c2ccccc2)C1)N(C)C ZINC001390641851 1354240370 /nfs/dbraw/zinc/24/03/70/1354240370.db2.gz ZHANTHOVIUAINO-LRHIHOEBSA-N 1 3 343.515 2.963 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CCC(F)(F)CC1 ZINC001390711235 1354302946 /nfs/dbraw/zinc/30/29/46/1354302946.db2.gz ZHMASZRASVUBJP-HUUCEWRRSA-N 1 3 345.478 2.638 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1cccc(F)c1Cl)N(C)C ZINC001390714004 1354306196 /nfs/dbraw/zinc/30/61/96/1354306196.db2.gz NVJKWOAQQDSVRH-SWLSCSKDSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]Cc1sccc1Cl ZINC001390733470 1354324429 /nfs/dbraw/zinc/32/44/29/1354324429.db2.gz PVWVYZBGVYOJOT-LBPRGKRZSA-N 1 3 331.913 2.726 10 0 EFAEHO CC(C)c1ccc(C[N@H+](C)CCNC(=O)CN(C)C2CCC2)cc1 ZINC001390766906 1354353988 /nfs/dbraw/zinc/35/39/88/1354353988.db2.gz XCZVBDCJUSKBGH-UHFFFAOYSA-N 1 3 331.504 2.842 10 0 EFAEHO CC(C)c1ccc(C[N@@H+](C)CCNC(=O)CN(C)C2CCC2)cc1 ZINC001390766906 1354353992 /nfs/dbraw/zinc/35/39/92/1354353992.db2.gz XCZVBDCJUSKBGH-UHFFFAOYSA-N 1 3 331.504 2.842 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@@H+]1C)[C@H]1CCc2c1cccc2F ZINC001390770687 1354358774 /nfs/dbraw/zinc/35/87/74/1354358774.db2.gz HPXORPKJJSJGAX-BEFAXECRSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@H+]1C)[C@H]1CCc2c1cccc2F ZINC001390770687 1354358778 /nfs/dbraw/zinc/35/87/78/1354358778.db2.gz HPXORPKJJSJGAX-BEFAXECRSA-N 1 3 347.478 2.735 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N(C)CCNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001390846613 1354430579 /nfs/dbraw/zinc/43/05/79/1354430579.db2.gz RLSVNYYHSCTDQC-HUUCEWRRSA-N 1 3 337.895 2.791 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N(C)CCNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001390846613 1354430582 /nfs/dbraw/zinc/43/05/82/1354430582.db2.gz RLSVNYYHSCTDQC-HUUCEWRRSA-N 1 3 337.895 2.791 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C(C)C)Cc1cccc2cccnc21 ZINC001391019540 1354693904 /nfs/dbraw/zinc/69/39/04/1354693904.db2.gz IOSUMLFLVZVTBE-UHFFFAOYSA-N 1 3 342.487 2.513 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C(C)C)Cc1cccc2cccnc21 ZINC001391019540 1354693908 /nfs/dbraw/zinc/69/39/08/1354693908.db2.gz IOSUMLFLVZVTBE-UHFFFAOYSA-N 1 3 342.487 2.513 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1CC[N@H+](CC2CCCC2)C1)N1CCCCCC1 ZINC001391096500 1354789403 /nfs/dbraw/zinc/78/94/03/1354789403.db2.gz MEMCDDSTXSSUJN-MJGOQNOKSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1CC[N@@H+](CC2CCCC2)C1)N1CCCCCC1 ZINC001391096500 1354789408 /nfs/dbraw/zinc/78/94/08/1354789408.db2.gz MEMCDDSTXSSUJN-MJGOQNOKSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c(C)s1 ZINC001391097569 1354790978 /nfs/dbraw/zinc/79/09/78/1354790978.db2.gz BHCMDPZRAYAZCS-PBHICJAKSA-N 1 3 349.544 2.645 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c(C)s1 ZINC001391097569 1354790982 /nfs/dbraw/zinc/79/09/82/1354790982.db2.gz BHCMDPZRAYAZCS-PBHICJAKSA-N 1 3 349.544 2.645 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@H+](Cc2cc3ccccc3o2)C1)N(C)C ZINC001391109392 1354807391 /nfs/dbraw/zinc/80/73/91/1354807391.db2.gz KEQWBSACUBPOIF-CRAIPNDOSA-N 1 3 343.471 2.711 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@@H+](Cc2cc3ccccc3o2)C1)N(C)C ZINC001391109392 1354807396 /nfs/dbraw/zinc/80/73/96/1354807396.db2.gz KEQWBSACUBPOIF-CRAIPNDOSA-N 1 3 343.471 2.711 10 0 EFAEHO Cc1cccc([C@@H](C)[N@@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001391116059 1354817627 /nfs/dbraw/zinc/81/76/27/1354817627.db2.gz KGYZSHKRUKELTI-QZTJIDSGSA-N 1 3 331.504 2.834 10 0 EFAEHO Cc1cccc([C@@H](C)[N@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001391116059 1354817630 /nfs/dbraw/zinc/81/76/30/1354817630.db2.gz KGYZSHKRUKELTI-QZTJIDSGSA-N 1 3 331.504 2.834 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)C1CC1 ZINC001391203182 1354930432 /nfs/dbraw/zinc/93/04/32/1354930432.db2.gz XPOHJTUZRRFDQE-HOTGVXAUSA-N 1 3 347.478 2.809 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)C1CC1 ZINC001391203182 1354930437 /nfs/dbraw/zinc/93/04/37/1354930437.db2.gz XPOHJTUZRRFDQE-HOTGVXAUSA-N 1 3 347.478 2.809 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(CCNC(=O)C[C@H]1CC[N@H+](C)C1)C1CC1 ZINC001391203185 1354930996 /nfs/dbraw/zinc/93/09/96/1354930996.db2.gz XPOHJTUZRRFDQE-HZPDHXFCSA-N 1 3 347.478 2.809 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)C1CC1 ZINC001391203185 1354931000 /nfs/dbraw/zinc/93/10/00/1354931000.db2.gz XPOHJTUZRRFDQE-HZPDHXFCSA-N 1 3 347.478 2.809 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+][C@@H](C)c1cccc(OC)c1 ZINC001391226260 1354948458 /nfs/dbraw/zinc/94/84/58/1354948458.db2.gz MTVUMQVUMLWWGY-LPHOPBHVSA-N 1 3 347.503 2.679 10 0 EFAEHO C[C@H]([NH2+]CCC(C)(C)C)C1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001391235394 1354957987 /nfs/dbraw/zinc/95/79/87/1354957987.db2.gz DKJWOXUDBRWJGL-SJORKVTESA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C(=O)CC[NH+](C)C)[C@@H]1CCN(Cc2ccc(CF)cc2)C1 ZINC001391273311 1355002370 /nfs/dbraw/zinc/00/23/70/1355002370.db2.gz KUDMVUVDTXKDRW-LJQANCHMSA-N 1 3 349.494 2.921 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](C/C=C\c2ccccc2)C1)N(C)C ZINC001391297934 1355038153 /nfs/dbraw/zinc/03/81/53/1355038153.db2.gz KQTCJFVVOZMWMS-JFYHIKNKSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](C/C=C\c2ccccc2)C1)N(C)C ZINC001391297934 1355038159 /nfs/dbraw/zinc/03/81/59/1355038159.db2.gz KQTCJFVVOZMWMS-JFYHIKNKSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CCNC(=O)CN3CC[C@H](C)C3)C2)cc1 ZINC001391323880 1355076271 /nfs/dbraw/zinc/07/62/71/1355076271.db2.gz LLPIRASUGNLMCX-ICSRJNTNSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CCNC(=O)CN3CC[C@H](C)C3)C2)cc1 ZINC001391323880 1355076279 /nfs/dbraw/zinc/07/62/79/1355076279.db2.gz LLPIRASUGNLMCX-ICSRJNTNSA-N 1 3 343.515 2.665 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CC[C@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001391335649 1355090607 /nfs/dbraw/zinc/09/06/07/1355090607.db2.gz KPPJJUVNBFCJPS-IRXDYDNUSA-N 1 3 349.494 2.938 10 0 EFAEHO C[C@H](F)CC[N@H+]1CC[C@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001391335649 1355090608 /nfs/dbraw/zinc/09/06/08/1355090608.db2.gz KPPJJUVNBFCJPS-IRXDYDNUSA-N 1 3 349.494 2.938 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](C[N@H+](C)CCCC2CCCC2)C1 ZINC001391345139 1355102248 /nfs/dbraw/zinc/10/22/48/1355102248.db2.gz VTOXOBILMZTPRC-OALUTQOASA-N 1 3 335.536 2.831 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](C[N@@H+](C)CCCC2CCCC2)C1 ZINC001391345139 1355102252 /nfs/dbraw/zinc/10/22/52/1355102252.db2.gz VTOXOBILMZTPRC-OALUTQOASA-N 1 3 335.536 2.831 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@@H](C[N@H+](C)CCC(F)(F)F)C1 ZINC001391358321 1355120884 /nfs/dbraw/zinc/12/08/84/1355120884.db2.gz PJVVXWHMWCIEEV-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@@H](C[N@@H+](C)CCC(F)(F)F)C1 ZINC001391358321 1355120888 /nfs/dbraw/zinc/12/08/88/1355120888.db2.gz PJVVXWHMWCIEEV-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO Cc1ccccc1CN1CC[C@H](NC(=O)CC[C@@H]2CCC[N@H+]2C)C1 ZINC001391553434 1355299710 /nfs/dbraw/zinc/29/97/10/1355299710.db2.gz MUXHYRYOBOZXNU-OALUTQOASA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccccc1CN1CC[C@H](NC(=O)CC[C@@H]2CCC[N@@H+]2C)C1 ZINC001391553434 1355299714 /nfs/dbraw/zinc/29/97/14/1355299714.db2.gz MUXHYRYOBOZXNU-OALUTQOASA-N 1 3 329.488 2.560 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(F)cc1Cl)N(C)C ZINC001399413097 1361205297 /nfs/dbraw/zinc/20/52/97/1361205297.db2.gz INXURZKZEYIKTJ-MLGOLLRUSA-N 1 3 343.874 2.804 10 0 EFAEHO CCC[N@@H+]1CC[C@H](N(CC)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001391655241 1355407081 /nfs/dbraw/zinc/40/70/81/1355407081.db2.gz MEYNVWNVFMHYGA-YJBOKZPZSA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@H+]1CC[C@H](N(CC)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001391655241 1355407083 /nfs/dbraw/zinc/40/70/83/1355407083.db2.gz MEYNVWNVFMHYGA-YJBOKZPZSA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@@H+]1CC[C@@H](N(CC)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001391655232 1355407209 /nfs/dbraw/zinc/40/72/09/1355407209.db2.gz MEYNVWNVFMHYGA-CRAIPNDOSA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@H+]1CC[C@@H](N(CC)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001391655232 1355407210 /nfs/dbraw/zinc/40/72/10/1355407210.db2.gz MEYNVWNVFMHYGA-CRAIPNDOSA-N 1 3 327.488 2.532 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](C)Cc1ccc2cc[nH]c2c1 ZINC001399653639 1361406746 /nfs/dbraw/zinc/40/67/46/1361406746.db2.gz HQOLRCGGPPJKBQ-LJQANCHMSA-N 1 3 342.487 2.590 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](C)Cc1ccc2cc[nH]c2c1 ZINC001399653639 1361406749 /nfs/dbraw/zinc/40/67/49/1361406749.db2.gz HQOLRCGGPPJKBQ-LJQANCHMSA-N 1 3 342.487 2.590 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCC1 ZINC001391721695 1355464866 /nfs/dbraw/zinc/46/48/66/1355464866.db2.gz QQQFRZOJIJZKRP-QFBILLFUSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H]1CCc2c1cccc2F ZINC001391757612 1355502411 /nfs/dbraw/zinc/50/24/11/1355502411.db2.gz ZXUZJGZDDKPJIS-RDTXWAMCSA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C[NH2+]Cc2ccccc2F)CCCC1 ZINC001391778949 1355521834 /nfs/dbraw/zinc/52/18/34/1355521834.db2.gz IOQKPFYATJMUFV-UHFFFAOYSA-N 1 3 335.467 2.685 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@](C)(NC(=O)CN2CC[C@@H](C)C2)C2CC2)cc1 ZINC001391809648 1355552933 /nfs/dbraw/zinc/55/29/33/1355552933.db2.gz GUEIFNOFKGZFLV-UTKZUKDTSA-N 1 3 343.515 2.711 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@](C)(NC(=O)CN1CC[C@H](C)C1)C1CC1 ZINC001391819385 1355563035 /nfs/dbraw/zinc/56/30/35/1355563035.db2.gz RXYUOLBGXGIWOL-KKSFZXQISA-N 1 3 343.515 2.711 10 0 EFAEHO C[C@@H](C[NH2+][C@H]1CCc2ccccc21)N(C)C(=O)CN1CCC(C)CC1 ZINC001392112908 1355776215 /nfs/dbraw/zinc/77/62/15/1355776215.db2.gz PGNSORNNSHLSFW-PXNSSMCTSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](NC[C@H](C)N(C)C(=O)CC[NH+](C)C)c1ccc(F)cc1F ZINC001392129259 1355789690 /nfs/dbraw/zinc/78/96/90/1355789690.db2.gz XZOTZISFJAGVSS-GUYCJALGSA-N 1 3 341.446 2.804 10 0 EFAEHO C[C@H](C[NH2+]Cc1cccc2ccccc21)N(C)C(=O)CN1CCCC1 ZINC001392134239 1355793205 /nfs/dbraw/zinc/79/32/05/1355793205.db2.gz NRUCRFKISMWVNU-QGZVFWFLSA-N 1 3 339.483 2.872 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@@H](NC(=O)C1(N(C)C)CCC1)C1CCCCC1 ZINC001392163811 1355817144 /nfs/dbraw/zinc/81/71/44/1355817144.db2.gz KKVVFYYFVVLHLC-DLBZAZTESA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H](C)[NH2+]Cc2ccc(F)cc2)C1 ZINC001392188612 1355843610 /nfs/dbraw/zinc/84/36/10/1355843610.db2.gz JREBYAZUWYZMMY-FUHWJXTLSA-N 1 3 349.494 2.883 10 0 EFAEHO CN(C/C=C\Cl)CCC1CCN(C(=O)C[C@H]2CC[N@H+](C)C2)CC1 ZINC001392191907 1355846788 /nfs/dbraw/zinc/84/67/88/1355846788.db2.gz CPAIORZJJZIURQ-MGEKVANASA-N 1 3 341.927 2.641 10 0 EFAEHO CN(C/C=C\Cl)CCC1CCN(C(=O)C[C@H]2CC[N@@H+](C)C2)CC1 ZINC001392191907 1355846792 /nfs/dbraw/zinc/84/67/92/1355846792.db2.gz CPAIORZJJZIURQ-MGEKVANASA-N 1 3 341.927 2.641 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)CCC1CCN(C(=O)[C@H]2CCCCN2C)CC1 ZINC001392195422 1355851434 /nfs/dbraw/zinc/85/14/34/1355851434.db2.gz LTISOPDTJUZLCR-QZTJIDSGSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)CCC1CCN(C(=O)[C@H]2CCCCN2C)CC1 ZINC001392195422 1355851438 /nfs/dbraw/zinc/85/14/38/1355851438.db2.gz LTISOPDTJUZLCR-QZTJIDSGSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccc(F)cc1 ZINC001392225685 1355879226 /nfs/dbraw/zinc/87/92/26/1355879226.db2.gz XZCHAFQDTHKAGE-RBUKOAKNSA-N 1 3 349.494 2.929 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccccc1 ZINC001392229958 1355885664 /nfs/dbraw/zinc/88/56/64/1355885664.db2.gz VHQDVJJMRWOMNJ-GOSISDBHSA-N 1 3 331.504 2.791 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCN(C)C(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001392276741 1355932382 /nfs/dbraw/zinc/93/23/82/1355932382.db2.gz MQHVTBYWDXVIJT-FQEVSTJZSA-N 1 3 343.515 2.535 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2cccc(F)c2)C1)N(C)C ZINC001394373250 1357745823 /nfs/dbraw/zinc/74/58/23/1357745823.db2.gz JCMXWFOWQDHZEZ-DTTOXWODSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)Cc1ccc(C[N@H+](C)CCN(C)C(=O)CN2CCCC2)cc1 ZINC001392326800 1355992198 /nfs/dbraw/zinc/99/21/98/1355992198.db2.gz LIYQKNONSRPGQS-UHFFFAOYSA-N 1 3 345.531 2.871 10 0 EFAEHO CC(C)Cc1ccc(C[N@@H+](C)CCN(C)C(=O)CN2CCCC2)cc1 ZINC001392326800 1355992206 /nfs/dbraw/zinc/99/22/06/1355992206.db2.gz LIYQKNONSRPGQS-UHFFFAOYSA-N 1 3 345.531 2.871 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)[C@@H]1CCc2c1cccc2F ZINC001392332222 1355997899 /nfs/dbraw/zinc/99/78/99/1355997899.db2.gz FPAALZYWYMZXOX-GOSISDBHSA-N 1 3 335.467 2.543 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)[C@@H]1CCc2c1cccc2F ZINC001392332222 1355997900 /nfs/dbraw/zinc/99/79/00/1355997900.db2.gz FPAALZYWYMZXOX-GOSISDBHSA-N 1 3 335.467 2.543 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[N@H+](C)CC1CC2(CCC2)C1 ZINC001392334721 1356002023 /nfs/dbraw/zinc/00/20/23/1356002023.db2.gz VHNOXJCABKIAAA-SFHVURJKSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[N@@H+](C)CC1CC2(CCC2)C1 ZINC001392334721 1356002029 /nfs/dbraw/zinc/00/20/29/1356002029.db2.gz VHNOXJCABKIAAA-SFHVURJKSA-N 1 3 335.536 2.831 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)C[NH+]1[C@H](C)CC[C@H]1C ZINC001392335921 1356002954 /nfs/dbraw/zinc/00/29/54/1356002954.db2.gz OUFDLQFZPQLNOM-QZTJIDSGSA-N 1 3 331.504 2.758 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2Cc2ccccc2F)C1 ZINC001392340684 1356007911 /nfs/dbraw/zinc/00/79/11/1356007911.db2.gz GIKIPCQNPPECTQ-MJGOQNOKSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2Cc2ccccc2F)C1 ZINC001392340684 1356007914 /nfs/dbraw/zinc/00/79/14/1356007914.db2.gz GIKIPCQNPPECTQ-MJGOQNOKSA-N 1 3 347.478 2.589 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCCc2ccc(F)cc21)C(=O)CN1CCCC1 ZINC001392462878 1356055249 /nfs/dbraw/zinc/05/52/49/1356055249.db2.gz XIWLJTXXAITNIE-LJQANCHMSA-N 1 3 347.478 2.737 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCCN2C(C)C)cc1 ZINC001392511998 1356087764 /nfs/dbraw/zinc/08/77/64/1356087764.db2.gz MUCJTMNXWVARJK-MJGOQNOKSA-N 1 3 331.504 2.852 10 0 EFAEHO COc1cccc(C[NH2+]C[C@H](C)NC(=O)[C@H]2CCCCN2C(C)C)c1 ZINC001392594068 1356145311 /nfs/dbraw/zinc/14/53/11/1356145311.db2.gz GXBQOKLKDSIQJC-QFBILLFUSA-N 1 3 347.503 2.552 10 0 EFAEHO C[C@@H](C[N@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)C1(N(C)C)CCC1 ZINC001392660980 1356208095 /nfs/dbraw/zinc/20/80/95/1356208095.db2.gz NALCFAFBCPFFHL-INIZCTEOSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H](C[N@@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)C1(N(C)C)CCC1 ZINC001392660980 1356208100 /nfs/dbraw/zinc/20/81/00/1356208100.db2.gz NALCFAFBCPFFHL-INIZCTEOSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccccc1 ZINC001392679061 1356228039 /nfs/dbraw/zinc/22/80/39/1356228039.db2.gz LNKFICQOPVQJLF-HKUYNNGSSA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccccc1 ZINC001392679061 1356228042 /nfs/dbraw/zinc/22/80/42/1356228042.db2.gz LNKFICQOPVQJLF-HKUYNNGSSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@@H](C)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001392691985 1356244364 /nfs/dbraw/zinc/24/43/64/1356244364.db2.gz JQCAOMWQBRETRM-IKGGRYGDSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@@H](C)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001392691985 1356244368 /nfs/dbraw/zinc/24/43/68/1356244368.db2.gz JQCAOMWQBRETRM-IKGGRYGDSA-N 1 3 349.494 2.801 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@H+](C)Cc1cccc(OC)c1 ZINC001392725098 1356282884 /nfs/dbraw/zinc/28/28/84/1356282884.db2.gz IEYCGJMSYJAJML-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@@H+](C)Cc1cccc(OC)c1 ZINC001392725098 1356282889 /nfs/dbraw/zinc/28/28/89/1356282889.db2.gz IEYCGJMSYJAJML-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+]CC2CC3(CCC3)C2)C2CC2)CCC1 ZINC001392764911 1356308846 /nfs/dbraw/zinc/30/88/46/1356308846.db2.gz MUEDMYFJYZBLBB-KRWDZBQOSA-N 1 3 333.520 2.535 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)C/C=C\c2ccccc2)CC[N@@H+]1C ZINC001401745699 1363078910 /nfs/dbraw/zinc/07/89/10/1363078910.db2.gz CCKLFELOYBSPAQ-ODFMHNGNSA-N 1 3 343.515 2.867 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)C/C=C\c2ccccc2)CC[N@H+]1C ZINC001401745699 1363078913 /nfs/dbraw/zinc/07/89/13/1363078913.db2.gz CCKLFELOYBSPAQ-ODFMHNGNSA-N 1 3 343.515 2.867 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+]CC2CCC(C)CC2)CC1 ZINC001392897409 1356415411 /nfs/dbraw/zinc/41/54/11/1356415411.db2.gz MOYHWYKNGONXRZ-ABHNRTSZSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@@H]([NH2+]C1(CNC(=O)CN(C)C2CCC2)CC1)c1ccc(F)cc1 ZINC001392911637 1356425542 /nfs/dbraw/zinc/42/55/42/1356425542.db2.gz NBBMIDJJRBLHLL-CQSZACIVSA-N 1 3 333.451 2.609 10 0 EFAEHO CC(C)c1ccc(CNC2(CNC(=O)[C@H]3CC[N@H+](C)C3)CC2)cc1 ZINC001392956808 1356464796 /nfs/dbraw/zinc/46/47/96/1356464796.db2.gz KPWWMMDJCKZYPA-SFHVURJKSA-N 1 3 329.488 2.500 10 0 EFAEHO CC(C)c1ccc(CNC2(CNC(=O)[C@H]3CC[N@@H+](C)C3)CC2)cc1 ZINC001392956808 1356464799 /nfs/dbraw/zinc/46/47/99/1356464799.db2.gz KPWWMMDJCKZYPA-SFHVURJKSA-N 1 3 329.488 2.500 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@H+](C/C=C\Cl)C1 ZINC001392965078 1356471579 /nfs/dbraw/zinc/47/15/79/1356471579.db2.gz WXHZPBKFBHJKPY-HYHHROLSSA-N 1 3 341.927 2.784 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@@H+](C/C=C\Cl)C1 ZINC001392965078 1356471581 /nfs/dbraw/zinc/47/15/81/1356471581.db2.gz WXHZPBKFBHJKPY-HYHHROLSSA-N 1 3 341.927 2.784 10 0 EFAEHO CC[C@@H](C(=O)N1CCC([N@H+](CC[C@@H](C)F)CC2CC2)CC1)N(C)C ZINC001392976393 1356483616 /nfs/dbraw/zinc/48/36/16/1356483616.db2.gz VBEWQBMWJNUQNC-QAPCUYQASA-N 1 3 341.515 2.778 10 0 EFAEHO CC[C@@H](C(=O)N1CCC([N@@H+](CC[C@@H](C)F)CC2CC2)CC1)N(C)C ZINC001392976393 1356483619 /nfs/dbraw/zinc/48/36/19/1356483619.db2.gz VBEWQBMWJNUQNC-QAPCUYQASA-N 1 3 341.515 2.778 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1CC[C@@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001392995379 1356498660 /nfs/dbraw/zinc/49/86/60/1356498660.db2.gz WLMZQALUBOVURW-VQIMIIECSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](F)C[N@H+]1CC[C@@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001392995379 1356498663 /nfs/dbraw/zinc/49/86/63/1356498663.db2.gz WLMZQALUBOVURW-VQIMIIECSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](F)C[N@@H+]1CC[C@@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001392995377 1356499244 /nfs/dbraw/zinc/49/92/44/1356499244.db2.gz WLMZQALUBOVURW-QFBILLFUSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](F)C[N@H+]1CC[C@@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001392995377 1356499246 /nfs/dbraw/zinc/49/92/46/1356499246.db2.gz WLMZQALUBOVURW-QFBILLFUSA-N 1 3 341.515 2.637 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001393048931 1356537449 /nfs/dbraw/zinc/53/74/49/1356537449.db2.gz CWIKVVVBLJIOSX-GOSISDBHSA-N 1 3 331.504 2.724 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+]Cc1sccc1Cl ZINC001393052276 1356540264 /nfs/dbraw/zinc/54/02/64/1356540264.db2.gz JHBWXZBGHRVHES-ZDUSSCGKSA-N 1 3 343.924 2.822 10 0 EFAEHO CC[C@H](F)CNC[C@@H]1CCCN1C(=O)CC[N@H+](C)C1CCCCC1 ZINC001393053340 1356540728 /nfs/dbraw/zinc/54/07/28/1356540728.db2.gz VBUGNQQPYYVCMZ-WMZOPIPTSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@H](F)CNC[C@@H]1CCCN1C(=O)CC[N@@H+](C)C1CCCCC1 ZINC001393053340 1356540732 /nfs/dbraw/zinc/54/07/32/1356540732.db2.gz VBUGNQQPYYVCMZ-WMZOPIPTSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H](c1cccc(F)c1)N1CCC(C)(NC(=O)CC[NH+](C)C)CC1 ZINC001393070043 1356557184 /nfs/dbraw/zinc/55/71/84/1356557184.db2.gz XWCFKMSTBUCFTC-OAHLLOKOSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N1CCC(C)(NC(=O)CC[NH+](C)C)CC1 ZINC001393070037 1356557630 /nfs/dbraw/zinc/55/76/30/1356557630.db2.gz XWCFKMSTBUCFTC-HNNXBMFYSA-N 1 3 335.467 2.809 10 0 EFAEHO CCc1cccc(CN2CC[C@](C)(NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c1 ZINC001393121029 1356621815 /nfs/dbraw/zinc/62/18/15/1356621815.db2.gz SZPFAIXFDNNERY-FPOVZHCZSA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1cccc(CN2CC[C@](C)(NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c1 ZINC001393121029 1356621819 /nfs/dbraw/zinc/62/18/19/1356621819.db2.gz SZPFAIXFDNNERY-FPOVZHCZSA-N 1 3 343.515 2.671 10 0 EFAEHO CC[C@@H](F)C[NH+]1CCC(C)(CNC(=O)C(C)(C)N2CCCC2)CC1 ZINC001393177993 1356683298 /nfs/dbraw/zinc/68/32/98/1356683298.db2.gz HLAAMQSDYWNHPN-MRXNPFEDSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](C(=O)NCC1(C)CC[NH+](CCCC(C)C)CC1)N(C)C ZINC001393180787 1356686766 /nfs/dbraw/zinc/68/67/66/1356686766.db2.gz WNQLIYPEWGHNGU-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)CC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001393222859 1356734859 /nfs/dbraw/zinc/73/48/59/1356734859.db2.gz ASWXZBDOOCWFKK-OAHLLOKOSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)CC[N@H+]1CCC(F)(F)[C@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001393222859 1356734863 /nfs/dbraw/zinc/73/48/63/1356734863.db2.gz ASWXZBDOOCWFKK-OAHLLOKOSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@@H](F)CN1CCC([C@@H]2CCCN(C(=O)CC[NH+](C)C)C2)CC1 ZINC001393375633 1356797066 /nfs/dbraw/zinc/79/70/66/1356797066.db2.gz ZUYHSDCTVPCQQZ-QZTJIDSGSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](F)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C2 ZINC001393383472 1356804000 /nfs/dbraw/zinc/80/40/00/1356804000.db2.gz IOVPDTWASYUSTK-JCECYMMASA-N 1 3 341.515 2.680 10 0 EFAEHO CC[C@H](F)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C2 ZINC001393383472 1356804002 /nfs/dbraw/zinc/80/40/02/1356804002.db2.gz IOVPDTWASYUSTK-JCECYMMASA-N 1 3 341.515 2.680 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCC2)cc1C ZINC001393567483 1356956283 /nfs/dbraw/zinc/95/62/83/1356956283.db2.gz GVGPDPAVVCZOMH-UHFFFAOYSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@H+](Cc2ccsc2)CC1)N(C)C ZINC001393593524 1356974349 /nfs/dbraw/zinc/97/43/49/1356974349.db2.gz BHQDOQYAUAKJSV-SJORKVTESA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2ccsc2)CC1)N(C)C ZINC001393593524 1356974352 /nfs/dbraw/zinc/97/43/52/1356974352.db2.gz BHQDOQYAUAKJSV-SJORKVTESA-N 1 3 337.533 2.805 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCCN(Cc2cccnc2)CC1)[NH+](CC)CC ZINC001393598725 1356982353 /nfs/dbraw/zinc/98/23/53/1356982353.db2.gz VOFVXBLUNJDHAL-RBUKOAKNSA-N 1 3 346.519 2.673 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(CC)([NH2+]Cc2ccccc2)CC1 ZINC001393681221 1357075097 /nfs/dbraw/zinc/07/50/97/1357075097.db2.gz YZTHLLWPWPYWGD-UHFFFAOYSA-N 1 3 331.504 2.889 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2cccc(F)c2)C1)N(C)C ZINC001394373232 1357745110 /nfs/dbraw/zinc/74/51/10/1357745110.db2.gz JCMXWFOWQDHZEZ-DFEHZGFQSA-N 1 3 335.467 2.711 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@@H]2CCCc3ccccc32)C1 ZINC001394386716 1357759045 /nfs/dbraw/zinc/75/90/45/1357759045.db2.gz CSTUCKLGUUXXRF-YVWKXTFCSA-N 1 3 343.515 2.890 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C[NH2+][C@@H](C)c1ccccc1)C1CC1 ZINC001394437936 1357818218 /nfs/dbraw/zinc/81/82/18/1357818218.db2.gz CNLRZDFEWYWCOG-QFBILLFUSA-N 1 3 331.504 2.914 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCC1 ZINC001394529264 1357913650 /nfs/dbraw/zinc/91/36/50/1357913650.db2.gz OGNHPRKINBDKKK-BEFAXECRSA-N 1 3 341.515 2.826 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1cccc(F)c1)C1CC1 ZINC001436796084 1387302068 /nfs/dbraw/zinc/30/20/68/1387302068.db2.gz RNKTUYLOQIVHQO-RBUKOAKNSA-N 1 3 347.478 2.685 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1cccc(F)c1)C1CC1 ZINC001436796093 1387302093 /nfs/dbraw/zinc/30/20/93/1387302093.db2.gz RNKTUYLOQIVHQO-RTBURBONSA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)c1cccc(CN[C@H]2CCN(C(=O)CCC[NH+](C)C)[C@@H]2C)n1 ZINC001394677953 1357996652 /nfs/dbraw/zinc/99/66/52/1357996652.db2.gz XFRZPGGKMCJSTA-APWZRJJASA-N 1 3 346.519 2.626 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc3cc[nH]c3c2)C[C@@H]1C ZINC001394689527 1358011901 /nfs/dbraw/zinc/01/19/01/1358011901.db2.gz YBCDDCQEIFMCLV-YJBOKZPZSA-N 1 3 342.487 2.587 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](Cc1ccccc1)[NH2+]C(C)C ZINC001394694205 1358018507 /nfs/dbraw/zinc/01/85/07/1358018507.db2.gz DRJVLSJMVLKHHC-WOJBJXKFSA-N 1 3 345.531 2.976 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]Cc3ccccc3)[C@@H]2C1 ZINC001394697016 1358021266 /nfs/dbraw/zinc/02/12/66/1358021266.db2.gz ZAZNOGADQFWEDD-ZCNNSNEGSA-N 1 3 343.515 2.745 10 0 EFAEHO CC(C)(C)[C@H](CNC/C(Cl)=C\Cl)NC(=O)C[NH+]1CCCC1 ZINC001394831404 1358131220 /nfs/dbraw/zinc/13/12/20/1358131220.db2.gz XELPQHOXFDSAKQ-RPHSKFLZSA-N 1 3 336.307 2.522 10 0 EFAEHO CC(C)(C)[C@H](C[NH2+]C/C(Cl)=C\Cl)NC(=O)CN1CCCC1 ZINC001394831404 1358131221 /nfs/dbraw/zinc/13/12/21/1358131221.db2.gz XELPQHOXFDSAKQ-RPHSKFLZSA-N 1 3 336.307 2.522 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)C1CCN(Cc2ccccc2F)CC1 ZINC001394847523 1358153357 /nfs/dbraw/zinc/15/33/57/1358153357.db2.gz IYHTXADRYKFGBZ-INIZCTEOSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)C1CCN(Cc2ccccc2F)CC1 ZINC001394847523 1358153361 /nfs/dbraw/zinc/15/33/61/1358153361.db2.gz IYHTXADRYKFGBZ-INIZCTEOSA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C1CC[NH+](CC2CC(C)C2)CC1 ZINC001394848140 1358154116 /nfs/dbraw/zinc/15/41/16/1358154116.db2.gz SKKLNNNIYXALDB-NPCAHTBFSA-N 1 3 332.492 2.523 10 0 EFAEHO CCc1ccc(CC[NH2+]C2CC(N(C)C(=O)CN(C)C(C)C)C2)cc1 ZINC001394857989 1358164257 /nfs/dbraw/zinc/16/42/57/1358164257.db2.gz DRBLSDWYOUDFGU-UHFFFAOYSA-N 1 3 345.531 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+][C@H]2CCc3ccccc32)C1 ZINC001394860229 1358167167 /nfs/dbraw/zinc/16/71/67/1358167167.db2.gz IPORDCDWHQPNBK-TVPLGVNVSA-N 1 3 329.488 2.593 10 0 EFAEHO CC[C@H](C)C[NH+]1CCC(C2(NC(=O)Cc3nc[nH]c3C)CC2)CC1 ZINC001394860953 1358168309 /nfs/dbraw/zinc/16/83/09/1358168309.db2.gz POTIJLPLNGJMBF-AWEZNQCLSA-N 1 3 332.492 2.668 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]2CN(Cc3ccccc3F)CC[C@@H]21 ZINC001436943357 1387341358 /nfs/dbraw/zinc/34/13/58/1387341358.db2.gz JIEGQIFQDZZQSF-HKUYNNGSSA-N 1 3 347.478 2.590 10 0 EFAEHO C[C@H](F)CCN1CC[C@@H]1CN(C)C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001397001276 1359605773 /nfs/dbraw/zinc/60/57/73/1359605773.db2.gz UYVPNOXYBLUNID-DLBZAZTESA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)NCc1ccccc1Cl ZINC001437137276 1387410375 /nfs/dbraw/zinc/41/03/75/1387410375.db2.gz ZAOWZXMJNCILMF-YOEHRIQHSA-N 1 3 337.895 2.807 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)NCc1ccccc1Cl ZINC001437137276 1387410380 /nfs/dbraw/zinc/41/03/80/1387410380.db2.gz ZAOWZXMJNCILMF-YOEHRIQHSA-N 1 3 337.895 2.807 10 0 EFAEHO CN(CC(=O)NC[C@H]1C[C@H]([NH2+]CCC(C)(C)C)C1)CC(C)(C)C ZINC001397132273 1359695311 /nfs/dbraw/zinc/69/53/11/1359695311.db2.gz ZKPHSYZLQQCSJM-WKILWMFISA-N 1 3 325.541 2.885 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H]1C[C@H](CNC(=O)CN2[C@@H](C)CC[C@@H]2C)C1 ZINC001397140964 1359701719 /nfs/dbraw/zinc/70/17/19/1359701719.db2.gz RKJTVQGUZHCWRY-JPLJXNOCSA-N 1 3 343.515 2.852 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCCCC[C@H]([NH2+]C/C=C/Cl)C1 ZINC001397229347 1359768822 /nfs/dbraw/zinc/76/88/22/1359768822.db2.gz YCURPZYZMYGAHC-OZVGAOPWSA-N 1 3 347.906 2.780 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001437142119 1387417530 /nfs/dbraw/zinc/41/75/30/1387417530.db2.gz CJWGTAUKZDEREA-UGSOOPFHSA-N 1 3 349.906 2.906 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1)NCc1ccsc1 ZINC001437149582 1387423296 /nfs/dbraw/zinc/42/32/96/1387423296.db2.gz SCCPOVXMGHPWKJ-YOEHRIQHSA-N 1 3 335.517 2.749 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CCC[N@H+]1C1CCCC1)NCc1ccsc1 ZINC001437149582 1387423307 /nfs/dbraw/zinc/42/33/07/1387423307.db2.gz SCCPOVXMGHPWKJ-YOEHRIQHSA-N 1 3 335.517 2.749 10 0 EFAEHO C[C@@H](F)CCN1CCC[C@@H](NC(=O)C2(C[NH+](C)C)CCCCC2)C1 ZINC001398235161 1360403721 /nfs/dbraw/zinc/40/37/21/1360403721.db2.gz PXJQBSSFAUQGBZ-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](F)CCN1CCC[C@@H](NC(=O)C2(C[NH+](C)C)CCCCC2)C1 ZINC001398235152 1360403889 /nfs/dbraw/zinc/40/38/89/1360403889.db2.gz PXJQBSSFAUQGBZ-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1cc(C)cc(CN2CC[C@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001398303003 1360452698 /nfs/dbraw/zinc/45/26/98/1360452698.db2.gz XCAAGMNUHIBIBJ-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(CN2CC[C@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001398303003 1360452700 /nfs/dbraw/zinc/45/27/00/1360452700.db2.gz XCAAGMNUHIBIBJ-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@@H](NCc1ccccc1F)C1CC1 ZINC001398400722 1360517518 /nfs/dbraw/zinc/51/75/18/1360517518.db2.gz OWOKNVZLQYNUCG-IEBWSBKVSA-N 1 3 347.478 2.685 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@@H](NCc1ccccc1F)C1CC1 ZINC001398400722 1360517520 /nfs/dbraw/zinc/51/75/20/1360517520.db2.gz OWOKNVZLQYNUCG-IEBWSBKVSA-N 1 3 347.478 2.685 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](CNC(=O)CN2CC[C@H](C)C2)C2CC2)cc1 ZINC001398455304 1360572994 /nfs/dbraw/zinc/57/29/94/1360572994.db2.gz PPHOVJGQQLFVPL-JXFKEZNVSA-N 1 3 343.515 2.575 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(C2CCC2)cc1 ZINC001437203695 1387464126 /nfs/dbraw/zinc/46/41/26/1387464126.db2.gz JXHBKXVOIONJRP-DLBZAZTESA-N 1 3 343.515 2.890 10 0 EFAEHO CC1CCC(C[NH2+][C@H]2CCN(C(=O)CN(C)CC(C)(C)C)C2)CC1 ZINC001398523679 1360623738 /nfs/dbraw/zinc/62/37/38/1360623738.db2.gz OXGBQYAWOBVJDM-ABHNRTSZSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NCCN(C)Cc1ccc2cc[nH]c2c1 ZINC001492873660 1360636068 /nfs/dbraw/zinc/63/60/68/1360636068.db2.gz OOBHRSBPTWJCNB-IYBDPMFKSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCCN(C)Cc1ccc2cc[nH]c2c1 ZINC001492873660 1360636070 /nfs/dbraw/zinc/63/60/70/1360636070.db2.gz OOBHRSBPTWJCNB-IYBDPMFKSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC[N@H+](C)CC1CCC2(CC2)CC1 ZINC001492873804 1360639865 /nfs/dbraw/zinc/63/98/65/1360639865.db2.gz UZSSXZHZAWYZHW-CALCHBBNSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001492873804 1360639867 /nfs/dbraw/zinc/63/98/67/1360639867.db2.gz UZSSXZHZAWYZHW-CALCHBBNSA-N 1 3 335.536 2.878 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@H]2CN(CCC(F)(F)F)CC[C@H]21 ZINC001398572971 1360651441 /nfs/dbraw/zinc/65/14/41/1360651441.db2.gz AWLFPVGZNPUTHW-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc(F)c(Cl)c2)C1 ZINC001398571850 1360651859 /nfs/dbraw/zinc/65/18/59/1360651859.db2.gz GJWFKPLFKDHBRV-HDJSIYSDSA-N 1 3 341.858 2.556 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)C1 ZINC001398664195 1360696286 /nfs/dbraw/zinc/69/62/86/1360696286.db2.gz IGOPDNCDKXAKAS-UQYDPPGPSA-N 1 3 341.499 2.811 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CCC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001398666822 1360697996 /nfs/dbraw/zinc/69/79/96/1360697996.db2.gz IIXVGVCBWGECGE-MRXNPFEDSA-N 1 3 344.503 2.669 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CCC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001398666822 1360698001 /nfs/dbraw/zinc/69/80/01/1360698001.db2.gz IIXVGVCBWGECGE-MRXNPFEDSA-N 1 3 344.503 2.669 10 0 EFAEHO C[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC1CCCC1 ZINC001437206756 1387469830 /nfs/dbraw/zinc/46/98/30/1387469830.db2.gz MJWVUYDMFJNGCV-KXBFYZLASA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1ccc(CN2CCCC[C@H]2CNC(=O)C[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001398751746 1360762917 /nfs/dbraw/zinc/76/29/17/1360762917.db2.gz BGWPBJFRBZVMME-PMACEKPBSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1ccc(CN2CCCC[C@H]2CNC(=O)C[C@@H]2CC[N@H+](C)C2)cc1 ZINC001398751746 1360762921 /nfs/dbraw/zinc/76/29/21/1360762921.db2.gz BGWPBJFRBZVMME-PMACEKPBSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H]1CCC[N@H+](CC2CCCC2)C1 ZINC001398792200 1360795968 /nfs/dbraw/zinc/79/59/68/1360795968.db2.gz LZFGFNNTBBJEQP-YOEHRIQHSA-N 1 3 332.492 2.668 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](CC2CCCC2)C1 ZINC001398792200 1360795972 /nfs/dbraw/zinc/79/59/72/1360795972.db2.gz LZFGFNNTBBJEQP-YOEHRIQHSA-N 1 3 332.492 2.668 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)[NH+]1CCCC1)[C@H]1CCCN(C/C=C\Cl)C1 ZINC001398800592 1360802201 /nfs/dbraw/zinc/80/22/01/1360802201.db2.gz XSFLWBSXVBPQNW-RDIIQDETSA-N 1 3 341.927 2.830 10 0 EFAEHO C[C@H](C(=O)NC[C@H](C)[NH2+]CCc1cccs1)N1CCCCCC1 ZINC001437217622 1387478513 /nfs/dbraw/zinc/47/85/13/1387478513.db2.gz VJMZXNKEKCFPIV-JKSUJKDBSA-N 1 3 337.533 2.649 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc(C)cc1C ZINC001398955592 1360893721 /nfs/dbraw/zinc/89/37/21/1360893721.db2.gz MMTXQZKRRXJLLP-PKOBYXMFSA-N 1 3 331.504 2.772 10 0 EFAEHO Cc1cccnc1CN[C@@H](C)CNC(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001398968367 1360901875 /nfs/dbraw/zinc/90/18/75/1360901875.db2.gz QXGHKHOIMDSYKQ-INIZCTEOSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1cccnc1CN[C@@H](C)CNC(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001398968367 1360901881 /nfs/dbraw/zinc/90/18/81/1360901881.db2.gz QXGHKHOIMDSYKQ-INIZCTEOSA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC001399180679 1361051611 /nfs/dbraw/zinc/05/16/11/1361051611.db2.gz YQKNSTMMFQJBGS-LBPRGKRZSA-N 1 3 346.302 2.928 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001399225469 1361083644 /nfs/dbraw/zinc/08/36/44/1361083644.db2.gz PDSDHIVHFCRTEA-KRWDZBQOSA-N 1 3 337.895 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001399244730 1361095705 /nfs/dbraw/zinc/09/57/05/1361095705.db2.gz HUAPNJNWKMGZJT-SFHVURJKSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1nsc2ccccc12)N(C)C ZINC001399376712 1361180390 /nfs/dbraw/zinc/18/03/90/1361180390.db2.gz PJXBSZFOQKBYQE-CZUORRHYSA-N 1 3 348.516 2.621 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]CCc1cccs1 ZINC001399429910 1361219004 /nfs/dbraw/zinc/21/90/04/1361219004.db2.gz JFTYQSXVXRUMFR-WBVHZDCISA-N 1 3 337.533 2.649 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+]Cc1ccccc1Cl ZINC001399429923 1361219484 /nfs/dbraw/zinc/21/94/84/1361219484.db2.gz JGEQMTAYCXMSMI-CQSZACIVSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@@H](C)c2ccc(F)cc2)CC[N@@H+]1C ZINC001399480584 1361263558 /nfs/dbraw/zinc/26/35/58/1361263558.db2.gz FQWYUSSDKNMAEH-JCGIZDLHSA-N 1 3 335.467 2.665 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@@H](C)c2ccc(F)cc2)CC[N@H+]1C ZINC001399480584 1361263560 /nfs/dbraw/zinc/26/35/60/1361263560.db2.gz FQWYUSSDKNMAEH-JCGIZDLHSA-N 1 3 335.467 2.665 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@H](C)c2cccc(OC)c2)CC[N@@H+]1C ZINC001399483010 1361266182 /nfs/dbraw/zinc/26/61/82/1361266182.db2.gz PHVHKYOSYYYSAW-AYOQOUSVSA-N 1 3 347.503 2.535 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@H](C)c2cccc(OC)c2)CC[N@H+]1C ZINC001399483010 1361266183 /nfs/dbraw/zinc/26/61/83/1361266183.db2.gz PHVHKYOSYYYSAW-AYOQOUSVSA-N 1 3 347.503 2.535 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001399655692 1361408565 /nfs/dbraw/zinc/40/85/65/1361408565.db2.gz MZWWQUZTVCJOFN-RTBURBONSA-N 1 3 329.488 2.596 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001399655692 1361408567 /nfs/dbraw/zinc/40/85/67/1361408567.db2.gz MZWWQUZTVCJOFN-RTBURBONSA-N 1 3 329.488 2.596 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21)Cc1ccccc1 ZINC001399722723 1361455150 /nfs/dbraw/zinc/45/51/50/1361455150.db2.gz PXGRTLGSMPTIGR-OALUTQOASA-N 1 3 329.488 2.642 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21)Cc1ccccc1 ZINC001399722723 1361455154 /nfs/dbraw/zinc/45/51/54/1361455154.db2.gz PXGRTLGSMPTIGR-OALUTQOASA-N 1 3 329.488 2.642 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12)Cc1ccccc1 ZINC001399722724 1361455252 /nfs/dbraw/zinc/45/52/52/1361455252.db2.gz PXGRTLGSMPTIGR-RBUKOAKNSA-N 1 3 329.488 2.642 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12)Cc1ccccc1 ZINC001399722724 1361455256 /nfs/dbraw/zinc/45/52/56/1361455256.db2.gz PXGRTLGSMPTIGR-RBUKOAKNSA-N 1 3 329.488 2.642 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21)Cc1ccccc1 ZINC001399722722 1361455331 /nfs/dbraw/zinc/45/53/31/1361455331.db2.gz PXGRTLGSMPTIGR-MOPGFXCFSA-N 1 3 329.488 2.642 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21)Cc1ccccc1 ZINC001399722722 1361455332 /nfs/dbraw/zinc/45/53/32/1361455332.db2.gz PXGRTLGSMPTIGR-MOPGFXCFSA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCCN2Cc2ccc(CF)cc2)C1 ZINC001399859756 1361534349 /nfs/dbraw/zinc/53/43/49/1361534349.db2.gz CCIGQHRLLQSKIA-OALUTQOASA-N 1 3 347.478 2.579 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCCN2Cc2ccc(CF)cc2)C1 ZINC001399859756 1361534351 /nfs/dbraw/zinc/53/43/51/1361534351.db2.gz CCIGQHRLLQSKIA-OALUTQOASA-N 1 3 347.478 2.579 10 0 EFAEHO CC[C@@H](C)C[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001400026580 1361677666 /nfs/dbraw/zinc/67/76/66/1361677666.db2.gz CWUQTZCJGHAYQE-BEFAXECRSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@@H](C)C[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001400026580 1361677667 /nfs/dbraw/zinc/67/76/67/1361677667.db2.gz CWUQTZCJGHAYQE-BEFAXECRSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](Cc1ccc2c(c1)CCC2)C1CC1 ZINC001400060829 1361706645 /nfs/dbraw/zinc/70/66/45/1361706645.db2.gz VRDFZWZIJBNXIF-UHFFFAOYSA-N 1 3 343.515 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](Cc1ccc2c(c1)CCC2)C1CC1 ZINC001400060829 1361706648 /nfs/dbraw/zinc/70/66/48/1361706648.db2.gz VRDFZWZIJBNXIF-UHFFFAOYSA-N 1 3 343.515 2.596 10 0 EFAEHO CC[C@H](C)C[NH2+][C@@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001400076800 1361716516 /nfs/dbraw/zinc/71/65/16/1361716516.db2.gz CWVMQYSMNWDVLW-WMZOPIPTSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H]([NH2+]CCN(C)C(=O)CN1CCCC1)c1ccc(F)c(Cl)c1 ZINC001400082243 1361720025 /nfs/dbraw/zinc/72/00/25/1361720025.db2.gz HLHSQWIPLZFXSH-ZDUSSCGKSA-N 1 3 341.858 2.684 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H](C)[NH2+]Cc2ccsc2)CC1 ZINC001400088115 1361726539 /nfs/dbraw/zinc/72/65/39/1361726539.db2.gz VFXVKLZMTWRGRZ-HNNXBMFYSA-N 1 3 337.533 2.807 10 0 EFAEHO C[C@H](C(=O)NCC[C@H]1CCN(C/C=C\Cl)C1)[NH+]1CCCCCC1 ZINC001400182631 1361821211 /nfs/dbraw/zinc/82/12/11/1361821211.db2.gz LEHDNTUSJFDPSJ-NWTSWCFDSA-N 1 3 341.927 2.832 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H]1CC[N@H+](CCC(F)(F)F)C1 ZINC001400193200 1361834147 /nfs/dbraw/zinc/83/41/47/1361834147.db2.gz GAFAFQSZSWZQKX-GJZGRUSLSA-N 1 3 349.441 2.641 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H]1CC[N@@H+](CCC(F)(F)F)C1 ZINC001400193200 1361834152 /nfs/dbraw/zinc/83/41/52/1361834152.db2.gz GAFAFQSZSWZQKX-GJZGRUSLSA-N 1 3 349.441 2.641 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](CCc2ccc(C)cc2)C1)N(C)C ZINC001400194354 1361834935 /nfs/dbraw/zinc/83/49/35/1361834935.db2.gz WPZITCOCCXCYRP-VQTJNVASSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](CCc2ccc(C)cc2)C1)N(C)C ZINC001400194354 1361834938 /nfs/dbraw/zinc/83/49/38/1361834938.db2.gz WPZITCOCCXCYRP-VQTJNVASSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001400246065 1361881248 /nfs/dbraw/zinc/88/12/48/1361881248.db2.gz VWDBABSDIZCSSV-QGZVFWFLSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001400246065 1361881264 /nfs/dbraw/zinc/88/12/64/1361881264.db2.gz VWDBABSDIZCSSV-QGZVFWFLSA-N 1 3 337.552 2.935 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2CCC[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001437320109 1387539973 /nfs/dbraw/zinc/53/99/73/1387539973.db2.gz HUJMPLGADBKTJQ-ROUUACIJSA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)C1)N(C)C ZINC001400279526 1361903879 /nfs/dbraw/zinc/90/38/79/1361903879.db2.gz SAQAKWLUHDEBDJ-RLLQIKCJSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)C1)N(C)C ZINC001400279526 1361903881 /nfs/dbraw/zinc/90/38/81/1361903881.db2.gz SAQAKWLUHDEBDJ-RLLQIKCJSA-N 1 3 343.515 2.841 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c(C)s1 ZINC001437329152 1387551692 /nfs/dbraw/zinc/55/16/92/1387551692.db2.gz OGLVFDDJZJKSEW-MRXNPFEDSA-N 1 3 337.533 2.643 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCN(Cc2ccc(C3CCCC3)cc2)C1 ZINC001400619875 1362054125 /nfs/dbraw/zinc/05/41/25/1362054125.db2.gz DQRCFGPYCZMPNO-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO CCc1ccc(CN2CC[C@H](N(CC)C(=O)CC[NH+](C)C)C2)cc1 ZINC001400774003 1362156915 /nfs/dbraw/zinc/15/69/15/1362156915.db2.gz ZSIKZMISYSHYRU-IBGZPJMESA-N 1 3 331.504 2.624 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](CC)[NH2+]Cc1cccc(F)c1 ZINC001400797288 1362169584 /nfs/dbraw/zinc/16/95/84/1362169584.db2.gz HVIDYFCMZSBINN-ZWKOTPCHSA-N 1 3 335.467 2.685 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC[C@H](CC)NCc2ccccc2F)C1 ZINC001400881138 1362232165 /nfs/dbraw/zinc/23/21/65/1362232165.db2.gz ZEVXJJNPYHFEGL-ROUUACIJSA-N 1 3 349.494 2.932 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC[C@H](CC)NCc2ccccc2F)C1 ZINC001400881138 1362232171 /nfs/dbraw/zinc/23/21/71/1362232171.db2.gz ZEVXJJNPYHFEGL-ROUUACIJSA-N 1 3 349.494 2.932 10 0 EFAEHO CC[C@H](C(=O)N[C@](C)(C[NH2+]Cc1cc(C)ccc1F)C1CC1)N(C)C ZINC001401018137 1362363652 /nfs/dbraw/zinc/36/36/52/1362363652.db2.gz ZTIWJVNAARROLG-UYAOXDASSA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@@H](F)CN1CCC(CCNC(=O)CC[C@@H]2CCC[N@@H+]2C)CC1 ZINC001401075456 1362417687 /nfs/dbraw/zinc/41/76/87/1362417687.db2.gz OAPNAFJFCRHKLP-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](F)CN1CCC(CCNC(=O)CC[C@@H]2CCC[N@H+]2C)CC1 ZINC001401075456 1362417690 /nfs/dbraw/zinc/41/76/90/1362417690.db2.gz OAPNAFJFCRHKLP-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@H]1CCc2ccccc21 ZINC001401090491 1362433834 /nfs/dbraw/zinc/43/38/34/1362433834.db2.gz MIULVCHHNKOHGN-MJGOQNOKSA-N 1 3 329.488 2.596 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001437357462 1387578938 /nfs/dbraw/zinc/57/89/38/1387578938.db2.gz MHXJYYZFOZZWOO-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001437357462 1387578945 /nfs/dbraw/zinc/57/89/45/1387578945.db2.gz MHXJYYZFOZZWOO-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO CC(C)C[C@H](C)C[NH+]1CC2(C1)CCN(C(=O)CN1CCCC1)CC2 ZINC001401194599 1362534791 /nfs/dbraw/zinc/53/47/91/1362534791.db2.gz ORIZUWQOAGRTQC-SFHVURJKSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(C[NH+](C[C@@H]3CC[C@@H]4C[C@@H]4C3)C2)CC1 ZINC001401197471 1362537300 /nfs/dbraw/zinc/53/73/00/1362537300.db2.gz NRQSLONDUTYIGL-QRVBRYPASA-N 1 3 347.547 2.687 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C(=O)[C@@H]1CCCN1C ZINC001401202748 1362542751 /nfs/dbraw/zinc/54/27/51/1362542751.db2.gz NVNSVYCLLHEXJH-KXBFYZLASA-N 1 3 329.488 2.595 10 0 EFAEHO CC[C@@H](F)CNC[C@H](C)N(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001401224169 1362563286 /nfs/dbraw/zinc/56/32/86/1362563286.db2.gz MCTMVSOITQQHGD-LSDHHAIUSA-N 1 3 329.504 2.824 10 0 EFAEHO CC[C@@H](F)CNC[C@H](C)N(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001401224169 1362563284 /nfs/dbraw/zinc/56/32/84/1362563284.db2.gz MCTMVSOITQQHGD-LSDHHAIUSA-N 1 3 329.504 2.824 10 0 EFAEHO C[C@@H](CNCc1ccccc1F)N(C)C(=O)C(C)(C)[NH+]1CCCC1 ZINC001401238103 1362576230 /nfs/dbraw/zinc/57/62/30/1362576230.db2.gz GWBFHZIXGSPHSJ-HNNXBMFYSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1cc2ccccc2o1)N(C)C ZINC001401253835 1362593094 /nfs/dbraw/zinc/59/30/94/1362593094.db2.gz MDXPSFZFQDCQLI-RHSMWYFYSA-N 1 3 331.460 2.710 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(CF)cc1 ZINC001401265610 1362606557 /nfs/dbraw/zinc/60/65/57/1362606557.db2.gz HRMRPBGBWKOXCU-LPHOPBHVSA-N 1 3 349.494 2.967 10 0 EFAEHO CC(C)C[NH2+]C[C@@H](CC(C)C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001401269311 1362610780 /nfs/dbraw/zinc/61/07/80/1362610780.db2.gz BQJOOAHONQCTAN-VQIMIIECSA-N 1 3 343.531 2.975 10 0 EFAEHO CC(C)C[C@H](C[NH2+]CC1CC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001401275380 1362619426 /nfs/dbraw/zinc/61/94/26/1362619426.db2.gz VZJLLIDRYFYBBX-VQIMIIECSA-N 1 3 341.515 2.729 10 0 EFAEHO CC[C@H](F)C[N@H+](C)CCC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001401307092 1362653992 /nfs/dbraw/zinc/65/39/92/1362653992.db2.gz VQMGJKJCJUZQTQ-KRWDZBQOSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)CCC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001401307092 1362653996 /nfs/dbraw/zinc/65/39/96/1362653996.db2.gz VQMGJKJCJUZQTQ-KRWDZBQOSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCc1ccccc1 ZINC001401336225 1362681554 /nfs/dbraw/zinc/68/15/54/1362681554.db2.gz KUQNYMSRKYDSAC-IBGZPJMESA-N 1 3 345.531 2.834 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@H+](C)C[C@@H]2CCCC(F)(F)C2)CCC1 ZINC001401369295 1362719821 /nfs/dbraw/zinc/71/98/21/1362719821.db2.gz NUUAIVPKYXSRNW-OAHLLOKOSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@@H+](C)C[C@@H]2CCCC(F)(F)C2)CCC1 ZINC001401369295 1362719822 /nfs/dbraw/zinc/71/98/22/1362719822.db2.gz NUUAIVPKYXSRNW-OAHLLOKOSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2ccc(F)cc21)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001401425917 1362788675 /nfs/dbraw/zinc/78/86/75/1362788675.db2.gz BUNPLNIAVOTAJQ-BEFAXECRSA-N 1 3 347.478 2.545 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2ccc(F)cc21)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001401425917 1362788676 /nfs/dbraw/zinc/78/86/76/1362788676.db2.gz BUNPLNIAVOTAJQ-BEFAXECRSA-N 1 3 347.478 2.545 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCN(C)Cc1ccc2cc[nH]c2c1)[NH+](C)C ZINC001401427266 1362789360 /nfs/dbraw/zinc/78/93/60/1362789360.db2.gz UZAGOZVFJXSJTN-LJQANCHMSA-N 1 3 344.503 2.644 10 0 EFAEHO CN(CCN(C)C(=O)C[C@H]1CC[N@H+](C)C1)Cc1ccc(C2CC2)cc1 ZINC001401436354 1362803847 /nfs/dbraw/zinc/80/38/47/1362803847.db2.gz VLIBAECLHNCVMA-GOSISDBHSA-N 1 3 343.515 2.796 10 0 EFAEHO CN(CCN(C)C(=O)C[C@H]1CC[N@@H+](C)C1)Cc1ccc(C2CC2)cc1 ZINC001401436354 1362803852 /nfs/dbraw/zinc/80/38/52/1362803852.db2.gz VLIBAECLHNCVMA-GOSISDBHSA-N 1 3 343.515 2.796 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@H]21 ZINC001401509852 1362898215 /nfs/dbraw/zinc/89/82/15/1362898215.db2.gz XBSOJBQEQGNCGM-ZWKOTPCHSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@H]21 ZINC001401509852 1362898221 /nfs/dbraw/zinc/89/82/21/1362898221.db2.gz XBSOJBQEQGNCGM-ZWKOTPCHSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CC1CCC2(CC2)CC1 ZINC001401617149 1362975591 /nfs/dbraw/zinc/97/55/91/1362975591.db2.gz HITKVVFZRCNXTC-SJLPKXTDSA-N 1 3 335.536 2.924 10 0 EFAEHO COc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCCN2C(C)C)cc1 ZINC001401654985 1363003509 /nfs/dbraw/zinc/00/35/09/1363003509.db2.gz ZJGTZMLVNLLKKE-APWZRJJASA-N 1 3 347.503 2.552 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](C)NC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001401682152 1363023120 /nfs/dbraw/zinc/02/31/20/1363023120.db2.gz VLQFZYMYIHNQRO-WMLDXEAASA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)[C@H](C(C)C)[NH+](C)C)c(Cl)c1 ZINC001401685539 1363024375 /nfs/dbraw/zinc/02/43/75/1363024375.db2.gz BVPNONMKDRGNGZ-YOEHRIQHSA-N 1 3 339.911 2.829 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CCC[N@@H+]2C(C)C)cc1F ZINC001401748321 1363080885 /nfs/dbraw/zinc/08/08/85/1363080885.db2.gz DQCXCQKTCNQKLM-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CCC[N@H+]2C(C)C)cc1F ZINC001401748321 1363080888 /nfs/dbraw/zinc/08/08/88/1363080888.db2.gz DQCXCQKTCNQKLM-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)C[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001401769778 1363106413 /nfs/dbraw/zinc/10/64/13/1363106413.db2.gz NRUJFIOVAPDQTQ-HOTGVXAUSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)C[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001401769778 1363106416 /nfs/dbraw/zinc/10/64/16/1363106416.db2.gz NRUJFIOVAPDQTQ-HOTGVXAUSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc(CN(C)C[C@@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001401780058 1363119465 /nfs/dbraw/zinc/11/94/65/1363119465.db2.gz KTHQYDGLOFQPMF-SJLPKXTDSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1cccc(CN(C)C[C@@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001401780058 1363119469 /nfs/dbraw/zinc/11/94/69/1363119469.db2.gz KTHQYDGLOFQPMF-SJLPKXTDSA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@@H](C)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001401785114 1363126116 /nfs/dbraw/zinc/12/61/16/1363126116.db2.gz RJPXIBMNUJGAON-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@@H](C)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001401785114 1363126118 /nfs/dbraw/zinc/12/61/18/1363126118.db2.gz RJPXIBMNUJGAON-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCCC[C@@H]1C[NH2+]Cc1ccsc1 ZINC001401818356 1363166575 /nfs/dbraw/zinc/16/65/75/1363166575.db2.gz IMYPXDDYPQIALH-IAGOWNOFSA-N 1 3 337.533 2.855 10 0 EFAEHO C[C@@H](C(=O)N[C@@H](C[NH2+]CC1CCCC1)C1CC1)N1CCCCCC1 ZINC001401859719 1363195066 /nfs/dbraw/zinc/19/50/66/1363195066.db2.gz QAVZXZQOCHAGFB-LPHOPBHVSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@@H](NC(=O)CN(C)C(C)C)C1CC1 ZINC001401864764 1363198978 /nfs/dbraw/zinc/19/89/78/1363198978.db2.gz HQAPGCOSBXKCEE-LJQANCHMSA-N 1 3 331.504 2.628 10 0 EFAEHO C[C@H](F)CCN1CC[C@H]1CNC(=O)CC[N@H+](C)C1CCCCC1 ZINC001401903111 1363228835 /nfs/dbraw/zinc/22/88/35/1363228835.db2.gz ZJJQQMDGDNJPKI-RDJZCZTQSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](F)CCN1CC[C@H]1CNC(=O)CC[N@@H+](C)C1CCCCC1 ZINC001401903111 1363228839 /nfs/dbraw/zinc/22/88/39/1363228839.db2.gz ZJJQQMDGDNJPKI-RDJZCZTQSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+][C@@H](C)c2cccc(F)c2)CC1 ZINC001401945319 1363265768 /nfs/dbraw/zinc/26/57/68/1363265768.db2.gz SAUSKGVCQRIPCT-YJBOKZPZSA-N 1 3 347.478 2.998 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NCC2(NCc3ccc(C4CC4)cc3)CC2)C1 ZINC001401977953 1363294385 /nfs/dbraw/zinc/29/43/85/1363294385.db2.gz JJANQYYFKOGKJO-QGZVFWFLSA-N 1 3 341.499 2.644 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NCC2(NCc3ccc(C4CC4)cc3)CC2)C1 ZINC001401977953 1363294387 /nfs/dbraw/zinc/29/43/87/1363294387.db2.gz JJANQYYFKOGKJO-QGZVFWFLSA-N 1 3 341.499 2.644 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)NCC2(NCc3ccsc3)CC2)C1 ZINC001401979848 1363296245 /nfs/dbraw/zinc/29/62/45/1363296245.db2.gz RQJFVPGGCWPXPG-HZPDHXFCSA-N 1 3 335.517 2.607 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@H+](CC2CCC2)C1 ZINC001401990541 1363308023 /nfs/dbraw/zinc/30/80/23/1363308023.db2.gz UCCANJUPPXWSLV-RBUKOAKNSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@@H+](CC2CCC2)C1 ZINC001401990541 1363308029 /nfs/dbraw/zinc/30/80/29/1363308029.db2.gz UCCANJUPPXWSLV-RBUKOAKNSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H](NC[C@@H]1CCCN1C(=O)CC[NH+](C)C)c1cc(F)ccc1F ZINC001402064407 1363371097 /nfs/dbraw/zinc/37/10/97/1363371097.db2.gz XTFHEXOIALFIAD-ZFWWWQNUSA-N 1 3 339.430 2.558 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)[C@@H](C)C1 ZINC001402069604 1363375208 /nfs/dbraw/zinc/37/52/08/1363375208.db2.gz UKGPFGAMZDTKMV-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)[NH2+]C[C@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CCCC1 ZINC001402102849 1363409894 /nfs/dbraw/zinc/40/98/94/1363409894.db2.gz RZMXLWZHABYXSG-LPHOPBHVSA-N 1 3 341.515 2.872 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]Cc1cccc(F)c1)C1CCCC1 ZINC001402109052 1363415686 /nfs/dbraw/zinc/41/56/86/1363415686.db2.gz SJRNUXLUQSHATN-LJQANCHMSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)Cc1ccc(CN2CC[C@](C)(NC(=O)CC[NH+](C)C)C2)cc1 ZINC001402126341 1363432765 /nfs/dbraw/zinc/43/27/65/1363432765.db2.gz HCQSBTFLWPSARP-NRFANRHFSA-N 1 3 345.531 2.917 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(CC)CC ZINC001402184209 1363490396 /nfs/dbraw/zinc/49/03/96/1363490396.db2.gz JOARHNRUHDWKPM-MSOLQXFVSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(CC)CC ZINC001402184209 1363490398 /nfs/dbraw/zinc/49/03/98/1363490398.db2.gz JOARHNRUHDWKPM-MSOLQXFVSA-N 1 3 335.536 2.878 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H](CNC(=O)CN1CC[C@H](C)C1)C1CC1 ZINC001402319186 1363603648 /nfs/dbraw/zinc/60/36/48/1363603648.db2.gz AVXJCCIXFVVISG-JXFKEZNVSA-N 1 3 343.515 2.575 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]([NH2+]Cc1ccsc1)C1CC1)N1CCCCCC1 ZINC001402342861 1363615334 /nfs/dbraw/zinc/61/53/34/1363615334.db2.gz LNKQDEZTIFYWBA-YJBOKZPZSA-N 1 3 349.544 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+][C@H]1CCc2ccc(F)cc21)C1CC1 ZINC001402389107 1363647495 /nfs/dbraw/zinc/64/74/95/1363647495.db2.gz XOMFTUCUHRIJKK-RBUKOAKNSA-N 1 3 347.478 2.638 10 0 EFAEHO CN(CCF)C[C@@H]1CCCN(C(=O)[C@@H]2CCC[N@@H+]2C2CCCC2)C1 ZINC001402390904 1363649764 /nfs/dbraw/zinc/64/97/64/1363649764.db2.gz WAEWJIBSHFXUBH-WMZOPIPTSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)C[C@@H]1CCCN(C(=O)[C@@H]2CCC[N@H+]2C2CCCC2)C1 ZINC001402390904 1363649769 /nfs/dbraw/zinc/64/97/69/1363649769.db2.gz WAEWJIBSHFXUBH-WMZOPIPTSA-N 1 3 339.499 2.533 10 0 EFAEHO CCC[NH2+][C@H](CNC(=O)C1(N(C)C)CCC1)c1ccccc1CC ZINC001402393687 1363652742 /nfs/dbraw/zinc/65/27/42/1363652742.db2.gz NKHYADOAXBNNEW-GOSISDBHSA-N 1 3 331.504 2.890 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C(C)C)N(C)C ZINC001402402435 1363662198 /nfs/dbraw/zinc/66/21/98/1363662198.db2.gz GSNHZZHWBINZFI-INDMIFKZSA-N 1 3 337.552 2.930 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C(C)C)N(C)C ZINC001402402435 1363662200 /nfs/dbraw/zinc/66/22/00/1363662200.db2.gz GSNHZZHWBINZFI-INDMIFKZSA-N 1 3 337.552 2.930 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1cccc(F)c1)C2 ZINC001402406957 1363666468 /nfs/dbraw/zinc/66/64/68/1363666468.db2.gz HOJFJVFTAAQRLL-UHOSZYNNSA-N 1 3 347.478 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1cccc(F)c1)C2 ZINC001402406957 1363666471 /nfs/dbraw/zinc/66/64/71/1363666471.db2.gz HOJFJVFTAAQRLL-UHOSZYNNSA-N 1 3 347.478 2.635 10 0 EFAEHO CC[NH+]1CCC([C@@H]2CCCN(C(=O)CN(C)CC(C)(C)C)C2)CC1 ZINC001402413225 1363673015 /nfs/dbraw/zinc/67/30/15/1363673015.db2.gz OXMDQXIEUKSDLK-GOSISDBHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](C[N@H+](C)CCc2ccccc2)C1)N(C)C ZINC001402414231 1363673738 /nfs/dbraw/zinc/67/37/38/1363673738.db2.gz YBBZPAJOBNWHDJ-WOJBJXKFSA-N 1 3 345.531 2.740 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](C[N@@H+](C)CCc2ccccc2)C1)N(C)C ZINC001402414231 1363673740 /nfs/dbraw/zinc/67/37/40/1363673740.db2.gz YBBZPAJOBNWHDJ-WOJBJXKFSA-N 1 3 345.531 2.740 10 0 EFAEHO CC[C@@H](F)CN[C@H]1CCN(C(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001402449249 1363700747 /nfs/dbraw/zinc/70/07/47/1363700747.db2.gz XVEOSEJCDBKWMN-CABCVRRESA-N 1 3 327.488 2.578 10 0 EFAEHO CC[C@@H](F)CN[C@H]1CCN(C(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001402449249 1363700756 /nfs/dbraw/zinc/70/07/56/1363700756.db2.gz XVEOSEJCDBKWMN-CABCVRRESA-N 1 3 327.488 2.578 10 0 EFAEHO CC(C)(C)CC[NH2+][C@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001402450705 1363701349 /nfs/dbraw/zinc/70/13/49/1363701349.db2.gz GRELCBMTLIRQLR-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+][C@@H](C)c2cc(C)ccc2C)C1 ZINC001402463027 1363709006 /nfs/dbraw/zinc/70/90/06/1363709006.db2.gz UUJUTSHVEGYHDB-ROUUACIJSA-N 1 3 331.504 2.897 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@H]([NH2+]CCC(C)(C)C)C2)c1 ZINC001402463827 1363710731 /nfs/dbraw/zinc/71/07/31/1363710731.db2.gz KNQHLLDZXPZLPQ-SFHVURJKSA-N 1 3 331.504 2.989 10 0 EFAEHO CCC[N@@H+]1CCc2c(CNC(=O)CN3[C@H](C)CC[C@@H]3C)cccc2C1 ZINC001402522246 1363757856 /nfs/dbraw/zinc/75/78/56/1363757856.db2.gz UQDVSMPDLIXVKY-CALCHBBNSA-N 1 3 343.515 2.944 10 0 EFAEHO CCC[N@H+]1CCc2c(CNC(=O)CN3[C@H](C)CC[C@@H]3C)cccc2C1 ZINC001402522246 1363757861 /nfs/dbraw/zinc/75/78/61/1363757861.db2.gz UQDVSMPDLIXVKY-CALCHBBNSA-N 1 3 343.515 2.944 10 0 EFAEHO CCC[N@@H+]1CCc2c(CNC(=O)C3(N(C)C)CCC3)cccc2C1 ZINC001402526537 1363760474 /nfs/dbraw/zinc/76/04/74/1363760474.db2.gz LNHGIOHKBVJZNP-UHFFFAOYSA-N 1 3 329.488 2.555 10 0 EFAEHO CCC[N@H+]1CCc2c(CNC(=O)C3(N(C)C)CCC3)cccc2C1 ZINC001402526537 1363760477 /nfs/dbraw/zinc/76/04/77/1363760477.db2.gz LNHGIOHKBVJZNP-UHFFFAOYSA-N 1 3 329.488 2.555 10 0 EFAEHO CC(C)N(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CCc1cccs1 ZINC001402571834 1363800005 /nfs/dbraw/zinc/80/00/05/1363800005.db2.gz IOCMRZPVTABDGU-ALOPSCKCSA-N 1 3 349.544 2.742 10 0 EFAEHO CC(C)N(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCc1cccs1 ZINC001402571834 1363800008 /nfs/dbraw/zinc/80/00/08/1363800008.db2.gz IOCMRZPVTABDGU-ALOPSCKCSA-N 1 3 349.544 2.742 10 0 EFAEHO C[C@@H]([NH2+][C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)C1)c1ccccc1F ZINC001402606962 1363830366 /nfs/dbraw/zinc/83/03/66/1363830366.db2.gz YZXBDKXTWKXZRB-KFWWJZLASA-N 1 3 333.451 2.608 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCCN(Cc2cccnc2)C1)[NH+](CC)CC ZINC001402670103 1363918686 /nfs/dbraw/zinc/91/86/86/1363918686.db2.gz WUVKFZBGKGHCII-RTBURBONSA-N 1 3 346.519 2.530 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001402724901 1363969907 /nfs/dbraw/zinc/96/99/07/1363969907.db2.gz VQXJRZBXYFROAQ-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCC[N@@H+]1CC1CC(C)(C)C1)N(C)C ZINC001402738512 1363983194 /nfs/dbraw/zinc/98/31/94/1363983194.db2.gz SNOGTKXWQHBNEH-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCC[N@H+]1CC1CC(C)(C)C1)N(C)C ZINC001402738512 1363983199 /nfs/dbraw/zinc/98/31/99/1363983199.db2.gz SNOGTKXWQHBNEH-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001402751124 1363998161 /nfs/dbraw/zinc/99/81/61/1363998161.db2.gz MLQUFODWGGVERI-QFBILLFUSA-N 1 3 341.515 2.970 10 0 EFAEHO CCCC[N@H+]1CCCC[C@H]1CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001402751124 1363998164 /nfs/dbraw/zinc/99/81/64/1363998164.db2.gz MLQUFODWGGVERI-QFBILLFUSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)C[NH2+]C1(C)CCN(C(=O)c2cccc(CN(C)C)c2)CC1 ZINC001402783142 1364031363 /nfs/dbraw/zinc/03/13/63/1364031363.db2.gz QWRHHIHKKOCGJM-UHFFFAOYSA-N 1 3 331.504 2.989 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)C1 ZINC001402787552 1364034578 /nfs/dbraw/zinc/03/45/78/1364034578.db2.gz AFSSPUILVJQXGV-HOTGVXAUSA-N 1 3 343.531 2.929 10 0 EFAEHO C[C@H](F)CC[N@H+]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)C1 ZINC001402787552 1364034586 /nfs/dbraw/zinc/03/45/86/1364034586.db2.gz AFSSPUILVJQXGV-HOTGVXAUSA-N 1 3 343.531 2.929 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CCCCN1C(C)C ZINC001402797580 1364044209 /nfs/dbraw/zinc/04/42/09/1364044209.db2.gz YHEKNZQKSYHCOR-UHZRXMQZSA-N 1 3 349.563 2.978 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CCCCN1C(C)C ZINC001402797580 1364044213 /nfs/dbraw/zinc/04/42/13/1364044213.db2.gz YHEKNZQKSYHCOR-UHZRXMQZSA-N 1 3 349.563 2.978 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]Cc1ccsc1 ZINC001402843419 1364085771 /nfs/dbraw/zinc/08/57/71/1364085771.db2.gz ODWMBHGNBYWHAK-RDJZCZTQSA-N 1 3 337.533 2.995 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001402865575 1364100766 /nfs/dbraw/zinc/10/07/66/1364100766.db2.gz XNKLPFPUGPUTQU-KSSFIOAISA-N 1 3 335.467 2.638 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCCC1)[NH2+]CC1CC2(CCC2)C1 ZINC001402893240 1364114806 /nfs/dbraw/zinc/11/48/06/1364114806.db2.gz YMQBKFOUDZPQCV-MRXNPFEDSA-N 1 3 335.536 2.926 10 0 EFAEHO C[N@@H+]1CCCC[C@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1NC/C=C\Cl ZINC001402897574 1364117536 /nfs/dbraw/zinc/11/75/36/1364117536.db2.gz KYYUQKPEANHRGW-MXTQAUAKSA-N 1 3 347.890 2.595 10 0 EFAEHO C[N@H+]1CCCC[C@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1NC/C=C\Cl ZINC001402897574 1364117543 /nfs/dbraw/zinc/11/75/43/1364117543.db2.gz KYYUQKPEANHRGW-MXTQAUAKSA-N 1 3 347.890 2.595 10 0 EFAEHO CCC[N@H+](C)C[C@@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001402911175 1364127400 /nfs/dbraw/zinc/12/74/00/1364127400.db2.gz ANQWDKVXTLINFE-MAUKXSAKSA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@@H+](C)C[C@@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001402911175 1364127402 /nfs/dbraw/zinc/12/74/02/1364127402.db2.gz ANQWDKVXTLINFE-MAUKXSAKSA-N 1 3 327.488 2.532 10 0 EFAEHO Cc1ccncc1C[NH2+][C@@H](C)[C@@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001402971062 1364170852 /nfs/dbraw/zinc/17/08/52/1364170852.db2.gz HDYLOUHBMWCXTI-DLBZAZTESA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H](C)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001402985985 1364183239 /nfs/dbraw/zinc/18/32/39/1364183239.db2.gz CLKCMDGMWSSTLK-GJZGRUSLSA-N 1 3 335.467 2.601 10 0 EFAEHO C[C@@H](NC(=O)C1(C[NH+](C)C)CCCCC1)[C@H](C)NCc1cccnc1 ZINC001402988362 1364186208 /nfs/dbraw/zinc/18/62/08/1364186208.db2.gz DKMYVWPSIMJJPC-DLBZAZTESA-N 1 3 346.519 2.577 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cccc2ccccc21 ZINC001402997122 1364194724 /nfs/dbraw/zinc/19/47/24/1364194724.db2.gz HXPCEMSYXVGDMQ-IRXDYDNUSA-N 1 3 339.483 2.776 10 0 EFAEHO C[C@H](NCc1ccccc1Cl)[C@H](C)NC(=O)C1(C[NH+](C)C)CC1 ZINC001403023513 1364225230 /nfs/dbraw/zinc/22/52/30/1364225230.db2.gz CZBGNOGACHVKBO-KBPBESRZSA-N 1 3 337.895 2.665 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001403035849 1364239839 /nfs/dbraw/zinc/23/98/39/1364239839.db2.gz WNVIDTSDNSYMSF-HOTGVXAUSA-N 1 3 331.504 2.716 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[N@H+](C)CCc1ccc(C)cc1 ZINC001403151118 1364370103 /nfs/dbraw/zinc/37/01/03/1364370103.db2.gz YSLZDKRYUXJRTR-ICSRJNTNSA-N 1 3 345.531 2.848 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[N@@H+](C)CCc1ccc(C)cc1 ZINC001403151118 1364370105 /nfs/dbraw/zinc/37/01/05/1364370105.db2.gz YSLZDKRYUXJRTR-ICSRJNTNSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H](C)[N@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001403166680 1364386525 /nfs/dbraw/zinc/38/65/25/1364386525.db2.gz KZUMACPNXDEKFI-DNVCBOLYSA-N 1 3 344.503 2.691 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001403166680 1364386529 /nfs/dbraw/zinc/38/65/29/1364386529.db2.gz KZUMACPNXDEKFI-DNVCBOLYSA-N 1 3 344.503 2.691 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H](C)NCc1ccccc1F)[NH+]1CCCC1 ZINC001403170769 1364391627 /nfs/dbraw/zinc/39/16/27/1364391627.db2.gz UDLAFIACPWSWEK-YJBOKZPZSA-N 1 3 335.467 2.540 10 0 EFAEHO Cc1cc(C)cc(C[NH+]2CC([C@@H](C)NC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001403332035 1364549354 /nfs/dbraw/zinc/54/93/54/1364549354.db2.gz RKRYROKFLRUYIC-CRAIPNDOSA-N 1 3 343.515 2.582 10 0 EFAEHO COc1cccc([C@@H](C)N2C[C@@H](NC(=O)CC[NH+](C)C)C(C)(C)C2)c1 ZINC001403373920 1364584386 /nfs/dbraw/zinc/58/43/86/1364584386.db2.gz DFEQYYQSGHOKSQ-CRAIPNDOSA-N 1 3 347.503 2.535 10 0 EFAEHO C[C@H](CCNC(=O)C(C)(C)N1CCCCC1)[NH2+]Cc1ccsc1 ZINC001403377909 1364587128 /nfs/dbraw/zinc/58/71/28/1364587128.db2.gz SUUBNUDMYZEVDV-OAHLLOKOSA-N 1 3 337.533 2.997 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001403420252 1364625435 /nfs/dbraw/zinc/62/54/35/1364625435.db2.gz JMLBLMQCSOKXDC-SNRMKQJTSA-N 1 3 349.494 2.705 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001403423297 1364626046 /nfs/dbraw/zinc/62/60/46/1364626046.db2.gz SKRFAIGXPJYAGZ-XUVXKRRUSA-N 1 3 343.515 2.745 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001403423297 1364626050 /nfs/dbraw/zinc/62/60/50/1364626050.db2.gz SKRFAIGXPJYAGZ-XUVXKRRUSA-N 1 3 343.515 2.745 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H]2C[N@H+](CC3CCC3)C[C@@H]2C1)CC(C)(C)C ZINC001403435535 1364638040 /nfs/dbraw/zinc/63/80/40/1364638040.db2.gz WYOCGZUDNCBAOS-GBESFXJTSA-N 1 3 349.563 2.981 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CC3CCC3)C[C@@H]2C1)CC(C)(C)C ZINC001403435535 1364638043 /nfs/dbraw/zinc/63/80/43/1364638043.db2.gz WYOCGZUDNCBAOS-GBESFXJTSA-N 1 3 349.563 2.981 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C2CC2)N(C)C(=O)CN(C)C(C)C)c(C)c1 ZINC001403520417 1364724770 /nfs/dbraw/zinc/72/47/70/1364724770.db2.gz XEQPUCZBALTEEH-HXUWFJFHSA-N 1 3 345.531 2.970 10 0 EFAEHO C[C@@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001403578296 1364780227 /nfs/dbraw/zinc/78/02/27/1364780227.db2.gz JEBPKSAGPYINGU-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001403578270 1364780297 /nfs/dbraw/zinc/78/02/97/1364780297.db2.gz JEBPKSAGPYINGU-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)cc1 ZINC001403591770 1364795892 /nfs/dbraw/zinc/79/58/92/1364795892.db2.gz PPPYKMMAAZHCSR-RTBURBONSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)cc1 ZINC001403591770 1364795894 /nfs/dbraw/zinc/79/58/94/1364795894.db2.gz PPPYKMMAAZHCSR-RTBURBONSA-N 1 3 329.488 2.560 10 0 EFAEHO CCCc1ccc(C[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001403595995 1364799545 /nfs/dbraw/zinc/79/95/45/1364799545.db2.gz ICDMNDXLLMWQSR-MSOLQXFVSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(C[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001403596003 1364799913 /nfs/dbraw/zinc/79/99/13/1364799913.db2.gz ICDMNDXLLMWQSR-ROUUACIJSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@@H](CN(C)C(=O)C[C@H]1CC[N@H+](C)C1)NCc1cc2ccccc2o1 ZINC001403605060 1364808950 /nfs/dbraw/zinc/80/89/50/1364808950.db2.gz CJDBBOKMELVHQY-JKSUJKDBSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@@H](CN(C)C(=O)C[C@H]1CC[N@@H+](C)C1)NCc1cc2ccccc2o1 ZINC001403605060 1364808956 /nfs/dbraw/zinc/80/89/56/1364808956.db2.gz CJDBBOKMELVHQY-JKSUJKDBSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@@H](CN(C)C(=O)C[C@@H]1CC[N@H+](C)C1)NCc1ccccc1Cl ZINC001403615918 1364819465 /nfs/dbraw/zinc/81/94/65/1364819465.db2.gz QIQJNBUDVNPMNU-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1)NCc1ccccc1Cl ZINC001403615918 1364819467 /nfs/dbraw/zinc/81/94/67/1364819467.db2.gz QIQJNBUDVNPMNU-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO Cc1ccc(CN[C@H](C)CN(C)C(=O)CCC[NH+]2CCCC2)c(C)n1 ZINC001403617212 1364820456 /nfs/dbraw/zinc/82/04/56/1364820456.db2.gz CPJBDCUTAZULNF-QGZVFWFLSA-N 1 3 346.519 2.511 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1cccc(F)c1 ZINC001403622229 1364824344 /nfs/dbraw/zinc/82/43/44/1364824344.db2.gz LHJIMXJWGWVLMC-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001403697994 1364871716 /nfs/dbraw/zinc/87/17/16/1364871716.db2.gz BKCGTSSVLSTYIK-UXHICEINSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001403697994 1364871717 /nfs/dbraw/zinc/87/17/17/1364871717.db2.gz BKCGTSSVLSTYIK-UXHICEINSA-N 1 3 343.515 2.985 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C[C@@H]1C ZINC001403739052 1364894086 /nfs/dbraw/zinc/89/40/86/1364894086.db2.gz CEPZKXPRSVLSDV-JXFKEZNVSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CC2CCC3(CC3)CC2)[C@H]1C ZINC001403745274 1364898294 /nfs/dbraw/zinc/89/82/94/1364898294.db2.gz JDUAZUQJVHDBEY-SJLPKXTDSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@H](NCc2cccc(C(C)C)n2)[C@H]1C ZINC001403780491 1364931306 /nfs/dbraw/zinc/93/13/06/1364931306.db2.gz XOTDVPIJPPNVQM-APWZRJJASA-N 1 3 346.519 2.626 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@H](NCc2cccc(C(C)C)n2)[C@H]1C ZINC001403780491 1364931309 /nfs/dbraw/zinc/93/13/09/1364931309.db2.gz XOTDVPIJPPNVQM-APWZRJJASA-N 1 3 346.519 2.626 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001403796594 1364949213 /nfs/dbraw/zinc/94/92/13/1364949213.db2.gz BRBUUBSVKUMOSI-FUHWJXTLSA-N 1 3 335.536 2.783 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001403796599 1364949610 /nfs/dbraw/zinc/94/96/10/1364949610.db2.gz BRBUUBSVKUMOSI-SJLPKXTDSA-N 1 3 335.536 2.783 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@@H](C[NH2+]CC3CC4(CCC4)C3)C2)CCC1 ZINC001403811950 1364967590 /nfs/dbraw/zinc/96/75/90/1364967590.db2.gz XWWNWTPWALNKEC-AEFFLSMTSA-N 1 3 347.547 2.926 10 0 EFAEHO CC(C)c1ccc(CN(C)CCNC(=O)C2CC[NH+](C)CC2)cc1 ZINC001437511092 1387711286 /nfs/dbraw/zinc/71/12/86/1387711286.db2.gz XBZBJMOYIXUCKH-UHFFFAOYSA-N 1 3 331.504 2.700 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+][C@H]1CN(C(=O)CN(C)C(C)C)CC1(C)C ZINC001403844840 1364992367 /nfs/dbraw/zinc/99/23/67/1364992367.db2.gz XSLAJTHLNFHJHM-SJORKVTESA-N 1 3 325.541 2.835 10 0 EFAEHO C[C@@H](NC(=O)CCC[NH+](C)C)C1CCN(Cc2ccccc2F)CC1 ZINC001403974195 1365119774 /nfs/dbraw/zinc/11/97/74/1365119774.db2.gz MKBUJYJUNQDJFS-MRXNPFEDSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C[NH2+]Cc1ccc(C)nc1C)C(C)(C)C)N(C)C ZINC001403975635 1365122257 /nfs/dbraw/zinc/12/22/57/1365122257.db2.gz YVFFHFHKEKWZAZ-ZWKOTPCHSA-N 1 3 348.535 2.659 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](NC(=O)CC[NH+](C)C)C(C)(C)C)n1 ZINC001403976096 1365123185 /nfs/dbraw/zinc/12/31/85/1365123185.db2.gz AHNLTILETZDFEW-GOSISDBHSA-N 1 3 348.535 2.777 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C)C1)C1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001403993617 1365144720 /nfs/dbraw/zinc/14/47/20/1365144720.db2.gz GSRPMZPNGYKKBX-SJORKVTESA-N 1 3 349.563 2.981 10 0 EFAEHO Cc1cccc(Cl)c1CNC1CC(N(C)C(=O)CC[NH+](C)C)C1 ZINC001404020983 1365177461 /nfs/dbraw/zinc/17/74/61/1365177461.db2.gz QUVIZRGXJNHTGE-UHFFFAOYSA-N 1 3 337.895 2.679 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C1CC(N(C)C(=O)CN(C)C(C)C)C1 ZINC001404026734 1365184451 /nfs/dbraw/zinc/18/44/51/1365184451.db2.gz ZYTDKQRWMKNREA-UHFFFAOYSA-N 1 3 331.504 2.723 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CC[C@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001404069901 1365228843 /nfs/dbraw/zinc/22/88/43/1365228843.db2.gz BTQXROWCBOFOOC-QZTJIDSGSA-N 1 3 343.515 2.529 10 0 EFAEHO CCc1ccccc1C[N@H+]1CC[C@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001404069901 1365228847 /nfs/dbraw/zinc/22/88/47/1365228847.db2.gz BTQXROWCBOFOOC-QZTJIDSGSA-N 1 3 343.515 2.529 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC001404090268 1365250924 /nfs/dbraw/zinc/25/09/24/1365250924.db2.gz ULGJPWJGNCSPLB-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@@H+](CC[C@H]2CCCC2(F)F)C1 ZINC001404090268 1365250928 /nfs/dbraw/zinc/25/09/28/1365250928.db2.gz ULGJPWJGNCSPLB-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[N@H+](CCC2CCCCC2)C1)N(C)C ZINC001404094016 1365254081 /nfs/dbraw/zinc/25/40/81/1365254081.db2.gz SIGPAQRLGVIREY-MOPGFXCFSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[N@@H+](CCC2CCCCC2)C1)N(C)C ZINC001404094016 1365254085 /nfs/dbraw/zinc/25/40/85/1365254085.db2.gz SIGPAQRLGVIREY-MOPGFXCFSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(CCNC(=O)C12CC[NH+](CC1)C2)C1CC1 ZINC001404286483 1365429420 /nfs/dbraw/zinc/42/94/20/1365429420.db2.gz OVFNDIFGMDAYLE-OAHLLOKOSA-N 1 3 345.462 2.563 10 0 EFAEHO CCCc1ccc(CN(C)CCNC(=O)C[C@@H]2CC[N@H+](C)C2)cc1 ZINC001437542155 1387746477 /nfs/dbraw/zinc/74/64/77/1387746477.db2.gz RWSORVXOVAGNNE-IBGZPJMESA-N 1 3 331.504 2.529 10 0 EFAEHO CCCc1ccc(CN(C)CCNC(=O)C[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001437542155 1387746484 /nfs/dbraw/zinc/74/64/84/1387746484.db2.gz RWSORVXOVAGNNE-IBGZPJMESA-N 1 3 331.504 2.529 10 0 EFAEHO CCCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@@H+](C(C)C)C1 ZINC001404435400 1365539026 /nfs/dbraw/zinc/53/90/26/1365539026.db2.gz YJELIWUXIMQNDA-QFBILLFUSA-N 1 3 341.515 2.920 10 0 EFAEHO CCCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@H+](C(C)C)C1 ZINC001404435400 1365539030 /nfs/dbraw/zinc/53/90/30/1365539030.db2.gz YJELIWUXIMQNDA-QFBILLFUSA-N 1 3 341.515 2.920 10 0 EFAEHO CCCN(C(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1)[C@H]1CCN(CC)C1 ZINC001404437258 1365541502 /nfs/dbraw/zinc/54/15/02/1365541502.db2.gz HWJMBGUSZSEXLL-MJGOQNOKSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN(C(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1)[C@H]1CCN(CC)C1 ZINC001404437258 1365541505 /nfs/dbraw/zinc/54/15/05/1365541505.db2.gz HWJMBGUSZSEXLL-MJGOQNOKSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@H](c1ccc(Cl)cc1)N(C)CCNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001437543571 1387747951 /nfs/dbraw/zinc/74/79/51/1387747951.db2.gz ZHCYTFDAGWKHNR-CABCVRRESA-N 1 3 337.895 2.791 10 0 EFAEHO C[C@H](c1ccc(Cl)cc1)N(C)CCNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001437543571 1387747954 /nfs/dbraw/zinc/74/79/54/1387747954.db2.gz ZHCYTFDAGWKHNR-CABCVRRESA-N 1 3 337.895 2.791 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2CC[N@H+](CC3CCCCC3)C2)C1 ZINC001404504588 1365607531 /nfs/dbraw/zinc/60/75/31/1365607531.db2.gz AKWPWPZFHPVJFY-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2CC[N@@H+](CC3CCCCC3)C2)C1 ZINC001404504588 1365607535 /nfs/dbraw/zinc/60/75/35/1365607535.db2.gz AKWPWPZFHPVJFY-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H]1CC[N@H+](Cc2ccsc2)C1 ZINC001404538766 1365636779 /nfs/dbraw/zinc/63/67/79/1365636779.db2.gz BUHLDZSKHHQJBJ-WMZOPIPTSA-N 1 3 349.544 2.951 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H]1CC[N@@H+](Cc2ccsc2)C1 ZINC001404538766 1365636784 /nfs/dbraw/zinc/63/67/84/1365636784.db2.gz BUHLDZSKHHQJBJ-WMZOPIPTSA-N 1 3 349.544 2.951 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCC[N@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)c1 ZINC001437561363 1387768578 /nfs/dbraw/zinc/76/85/78/1387768578.db2.gz ALPMHXOOXZCPRB-WSTZPKSXSA-N 1 3 343.515 2.846 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCC[N@@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)c1 ZINC001437561363 1387768584 /nfs/dbraw/zinc/76/85/84/1387768584.db2.gz ALPMHXOOXZCPRB-WSTZPKSXSA-N 1 3 343.515 2.846 10 0 EFAEHO Cc1ccc(C)c(CN2CC(CNC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001404893790 1365886670 /nfs/dbraw/zinc/88/66/70/1365886670.db2.gz RRGBBYPRAGNEMD-FQEVSTJZSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(C)c(CN2CC(CNC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001404893790 1365886676 /nfs/dbraw/zinc/88/66/76/1365886676.db2.gz RRGBBYPRAGNEMD-FQEVSTJZSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1cc(C)c(C[NH+]2CC(CNC(=O)[C@@H](C(C)C)N(C)C)C2)c(C)c1 ZINC001404906347 1365896950 /nfs/dbraw/zinc/89/69/50/1365896950.db2.gz MALLCLHDWAWRFL-HXUWFJFHSA-N 1 3 345.531 2.746 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@H+](C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001405060528 1365993759 /nfs/dbraw/zinc/99/37/59/1365993759.db2.gz YKWSZRQJZCGZPQ-XHSDSOJGSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001405060528 1365993764 /nfs/dbraw/zinc/99/37/64/1365993764.db2.gz YKWSZRQJZCGZPQ-XHSDSOJGSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)NCCN(C)Cc1ccc(CF)cc1)[NH+]1CCCC1 ZINC001437569819 1387781934 /nfs/dbraw/zinc/78/19/34/1387781934.db2.gz LEKZJTDXHMKAAN-LJQANCHMSA-N 1 3 349.494 2.825 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](C)Cc1ccc(C2CC2)cc1 ZINC001437571314 1387784326 /nfs/dbraw/zinc/78/43/26/1387784326.db2.gz VMMMPVUZQGYDKT-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](C)Cc1ccc(C2CC2)cc1 ZINC001437571314 1387784333 /nfs/dbraw/zinc/78/43/33/1387784333.db2.gz VMMMPVUZQGYDKT-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO CCCC[N@@H+]1CC[C@H](N(CC)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001405178539 1366088399 /nfs/dbraw/zinc/08/83/99/1366088399.db2.gz HUWHCKQNERFZHZ-LPHOPBHVSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCC[N@H+]1CC[C@H](N(CC)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001405178539 1366088401 /nfs/dbraw/zinc/08/84/01/1366088401.db2.gz HUWHCKQNERFZHZ-LPHOPBHVSA-N 1 3 341.515 2.922 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@H+](Cc2ccc(C)cc2)C1 ZINC001405183519 1366093910 /nfs/dbraw/zinc/09/39/10/1366093910.db2.gz NETFEYWQZRCSKI-ICSRJNTNSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@@H+](Cc2ccc(C)cc2)C1 ZINC001405183519 1366093914 /nfs/dbraw/zinc/09/39/14/1366093914.db2.gz NETFEYWQZRCSKI-ICSRJNTNSA-N 1 3 343.515 2.760 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(C)cc1C ZINC001405301226 1366139263 /nfs/dbraw/zinc/13/92/63/1366139263.db2.gz JLZVQDCIHHSSSQ-QFBILLFUSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@H](F)C[NH2+][C@H]1CC[C@H](NC(=O)C(C)(C)N2CCCC2)CC1 ZINC001405530531 1366273764 /nfs/dbraw/zinc/27/37/64/1366273764.db2.gz WSXICQCFCDRVHA-JYJNAYRXSA-N 1 3 327.488 2.626 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001405607723 1366312530 /nfs/dbraw/zinc/31/25/30/1366312530.db2.gz QQEDZEVTMHKQAL-GOSISDBHSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc2ccccc2c1)N(C)C(=O)[C@@H]1CCCN1C ZINC001405802097 1366425678 /nfs/dbraw/zinc/42/56/78/1366425678.db2.gz XXZMJXUOGPIFBS-UZLBHIALSA-N 1 3 339.483 2.871 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C[C@H](C)N(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001405833466 1366448803 /nfs/dbraw/zinc/44/88/03/1366448803.db2.gz QLDIBRRDQHNVPP-HOTGVXAUSA-N 1 3 347.503 2.677 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)N(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001405873585 1366481960 /nfs/dbraw/zinc/48/19/60/1366481960.db2.gz PAZUZSIJNMTVMM-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)N(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001405873585 1366481966 /nfs/dbraw/zinc/48/19/66/1366481966.db2.gz PAZUZSIJNMTVMM-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C[C@@H](C)N(C)C(=O)CN1CCCC1 ZINC001405887702 1366493196 /nfs/dbraw/zinc/49/31/96/1366493196.db2.gz KIQCHXGGRLWLSJ-QGZVFWFLSA-N 1 3 331.504 2.842 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21)Cc1ccc(F)cc1 ZINC001437603421 1387816633 /nfs/dbraw/zinc/81/66/33/1387816633.db2.gz UUCUXRMTNWPZEP-OALUTQOASA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21)Cc1ccc(F)cc1 ZINC001437603421 1387816640 /nfs/dbraw/zinc/81/66/40/1387816640.db2.gz UUCUXRMTNWPZEP-OALUTQOASA-N 1 3 347.478 2.781 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H](CC(C)C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001405937447 1366540099 /nfs/dbraw/zinc/54/00/99/1366540099.db2.gz RQMMCPWUABRKNP-UYAOXDASSA-N 1 3 345.531 2.957 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(CC[N@H+](C)CC2CCCC2)CC1 ZINC001405971916 1367028698 /nfs/dbraw/zinc/02/86/98/1367028698.db2.gz RXQRWLLKKOJXKE-IBGZPJMESA-N 1 3 335.536 2.831 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(CC[N@@H+](C)CC2CCCC2)CC1 ZINC001405971916 1367028708 /nfs/dbraw/zinc/02/87/08/1367028708.db2.gz RXQRWLLKKOJXKE-IBGZPJMESA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC(CC[N@H+](C)CC[C@H](C)F)CC1)N(C)C ZINC001405974253 1367033740 /nfs/dbraw/zinc/03/37/40/1367033740.db2.gz PYRZSUMWKSHHMX-WMZOPIPTSA-N 1 3 343.531 2.881 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC(CC[N@@H+](C)CC[C@H](C)F)CC1)N(C)C ZINC001405974253 1367033744 /nfs/dbraw/zinc/03/37/44/1367033744.db2.gz PYRZSUMWKSHHMX-WMZOPIPTSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)CCC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001406002573 1367078403 /nfs/dbraw/zinc/07/84/03/1367078403.db2.gz LOLBVEBPKHYRKS-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)CCC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001406002573 1367078410 /nfs/dbraw/zinc/07/84/10/1367078410.db2.gz LOLBVEBPKHYRKS-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[N@H+](CCNC(=O)CN1CC[C@@H](C)C1)CC[C@H]1CCCC1(F)F ZINC001437624802 1387849251 /nfs/dbraw/zinc/84/92/51/1387849251.db2.gz CELHDDJXHRBBLO-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN1CC[C@@H](C)C1)CC[C@H]1CCCC1(F)F ZINC001437624802 1387849258 /nfs/dbraw/zinc/84/92/58/1387849258.db2.gz CELHDDJXHRBBLO-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]C/C=C\Cl ZINC001406035017 1367122565 /nfs/dbraw/zinc/12/25/65/1367122565.db2.gz CSQUEXTVPNMZPK-RCOUFESZSA-N 1 3 347.906 2.682 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]Cc1ccccn1 ZINC001406054105 1367153766 /nfs/dbraw/zinc/15/37/66/1367153766.db2.gz YEUWTVUYBFSTTH-RBUKOAKNSA-N 1 3 346.519 2.575 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1C ZINC001406133896 1367289743 /nfs/dbraw/zinc/28/97/43/1367289743.db2.gz RNPHFOQOVCWXCB-ICSRJNTNSA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1C ZINC001406133896 1367289751 /nfs/dbraw/zinc/28/97/51/1367289751.db2.gz RNPHFOQOVCWXCB-ICSRJNTNSA-N 1 3 345.531 2.924 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001406140840 1367306240 /nfs/dbraw/zinc/30/62/40/1367306240.db2.gz DLWHVBBLKWMKRX-AEFFLSMTSA-N 1 3 349.544 2.698 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001406140840 1367306243 /nfs/dbraw/zinc/30/62/43/1367306243.db2.gz DLWHVBBLKWMKRX-AEFFLSMTSA-N 1 3 349.544 2.698 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCC[C@@H]2NC(=O)CN(C)C(C)C)cc1 ZINC001406194361 1367392378 /nfs/dbraw/zinc/39/23/78/1367392378.db2.gz LPRBGXYNLXYNCJ-MOPGFXCFSA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2CC2CC(C)(C)C2)C1 ZINC001406203158 1367400047 /nfs/dbraw/zinc/40/00/47/1367400047.db2.gz YZSPHEVGCSHKER-ROUUACIJSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2CC2CC(C)(C)C2)C1 ZINC001406203158 1367400054 /nfs/dbraw/zinc/40/00/54/1367400054.db2.gz YZSPHEVGCSHKER-ROUUACIJSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+][C@H]1CCc2c1cccc2F ZINC001406307708 1367461471 /nfs/dbraw/zinc/46/14/71/1367461471.db2.gz KNNLFGXWFFGOSM-KSSFIOAISA-N 1 3 335.467 2.638 10 0 EFAEHO CCN(CC[NH2+][C@@H](C)c1cc(C)ccc1C)C(=O)CN1CCCC1 ZINC001406332338 1367493843 /nfs/dbraw/zinc/49/38/43/1367493843.db2.gz AKVQNPGIRUJGOD-SFHVURJKSA-N 1 3 331.504 2.898 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCc2ccc(Cl)cc21)C(=O)CN1CCCC1 ZINC001406336817 1367500787 /nfs/dbraw/zinc/50/07/87/1367500787.db2.gz FVEKMOMKUIGZHZ-GOSISDBHSA-N 1 3 349.906 2.861 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](C)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001406357718 1367518634 /nfs/dbraw/zinc/51/86/34/1367518634.db2.gz AGYJZUSMODCTKJ-RBSFLKMASA-N 1 3 337.895 2.583 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](C)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001406357718 1367518637 /nfs/dbraw/zinc/51/86/37/1367518637.db2.gz AGYJZUSMODCTKJ-RBSFLKMASA-N 1 3 337.895 2.583 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]Cc1ccc(Cl)c(Cl)c1)N(C)C ZINC001406423921 1367574897 /nfs/dbraw/zinc/57/48/97/1367574897.db2.gz WMFQSMYXBSLBEB-IAQYHMDHSA-N 1 3 346.302 2.928 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCCN2CC)cc1 ZINC001406428116 1367579145 /nfs/dbraw/zinc/57/91/45/1367579145.db2.gz DYSLNIBWBOWUOB-APWZRJJASA-N 1 3 331.504 2.718 10 0 EFAEHO CCN(CCNC(=O)C[NH+]1[C@@H](C)CC[C@@H]1C)Cc1cccc(F)c1 ZINC001437649673 1387892189 /nfs/dbraw/zinc/89/21/89/1387892189.db2.gz KOVFTHUATGLDRZ-HOTGVXAUSA-N 1 3 335.467 2.637 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CC1CCC2(CC2)CC1 ZINC001406553363 1367717302 /nfs/dbraw/zinc/71/73/02/1367717302.db2.gz BEQJAYJHZMVMTR-WMZOPIPTSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001406555064 1367720323 /nfs/dbraw/zinc/72/03/23/1367720323.db2.gz FXRWMYWKHQXIQY-SUMWQHHRSA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC001406555888 1367722398 /nfs/dbraw/zinc/72/23/98/1367722398.db2.gz HKUARUGCNLNGEG-LBPRGKRZSA-N 1 3 346.302 2.928 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C(C)C)CC1CCC(F)(F)CC1 ZINC001437651900 1387896620 /nfs/dbraw/zinc/89/66/20/1387896620.db2.gz QAYCVYCQLCKUPO-UHFFFAOYSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C(C)C)CC1CCC(F)(F)CC1 ZINC001437651900 1387896630 /nfs/dbraw/zinc/89/66/30/1387896630.db2.gz QAYCVYCQLCKUPO-UHFFFAOYSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)CCc1ccc(Cl)cc1)N(C)C ZINC001406612068 1367804509 /nfs/dbraw/zinc/80/45/09/1367804509.db2.gz FQCSLTURHOQNGZ-WMLDXEAASA-N 1 3 339.911 2.659 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)CCc1ccc(Cl)cc1)N(C)C ZINC001406612068 1367804526 /nfs/dbraw/zinc/80/45/26/1367804526.db2.gz FQCSLTURHOQNGZ-WMLDXEAASA-N 1 3 339.911 2.659 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)cc1F ZINC001406641670 1367849822 /nfs/dbraw/zinc/84/98/22/1367849822.db2.gz YHBFKTKQSZQWMM-WMZOPIPTSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)cc1F ZINC001406641670 1367849827 /nfs/dbraw/zinc/84/98/27/1367849827.db2.gz YHBFKTKQSZQWMM-WMZOPIPTSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@@H]1CNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001406837447 1368111132 /nfs/dbraw/zinc/11/11/32/1368111132.db2.gz GKNCWFZHYONBGE-RBUKOAKNSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@@H]1CNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001406837447 1368111140 /nfs/dbraw/zinc/11/11/40/1368111140.db2.gz GKNCWFZHYONBGE-RBUKOAKNSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](NC(=O)CN(C)C(C)C)C2CC2)c(C)c1 ZINC001406836702 1368111201 /nfs/dbraw/zinc/11/12/01/1368111201.db2.gz XTOAQWCUVOZELA-IBGZPJMESA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1CCN1CC1CC2(CCC2)C1)[NH+](CC)CC ZINC001406845205 1368119656 /nfs/dbraw/zinc/11/96/56/1368119656.db2.gz FQBTWPVTAMHRDH-ROUUACIJSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+]CC[C@H]2CCCC2(F)F)CC1)N(C)C ZINC001407003657 1368309645 /nfs/dbraw/zinc/30/96/45/1368309645.db2.gz UXZKUVHGHWIXMM-HUUCEWRRSA-N 1 3 345.478 2.637 10 0 EFAEHO CCCc1ccc(CN2CCC[C@H]2CNC(=O)CC[NH+](C)C)cc1 ZINC001437681119 1387934010 /nfs/dbraw/zinc/93/40/10/1387934010.db2.gz OQELCLVKFVYDCI-IBGZPJMESA-N 1 3 331.504 2.671 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@]3(CCN(C(=O)CN(C)C(C)C)C3)C2)c1 ZINC001407035447 1368359770 /nfs/dbraw/zinc/35/97/70/1368359770.db2.gz HCZKBIUWQNCVGL-NRFANRHFSA-N 1 3 343.515 2.760 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@]3(CCN(C(=O)CN(C)C(C)C)C3)C2)c1 ZINC001407035447 1368359776 /nfs/dbraw/zinc/35/97/76/1368359776.db2.gz HCZKBIUWQNCVGL-NRFANRHFSA-N 1 3 343.515 2.760 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@](C)(C[NH2+]CC2CC(C)(C)C2)C1)N(C)C ZINC001407231809 1368622831 /nfs/dbraw/zinc/62/28/31/1368622831.db2.gz GXRVGHMESHVBTA-YLJYHZDGSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)[NH+]1CCCC1 ZINC001437704358 1387952196 /nfs/dbraw/zinc/95/21/96/1387952196.db2.gz XCQVFDBUPHWYKQ-UXHICEINSA-N 1 3 343.515 2.888 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@](C)(CNC(=O)CC2CC[NH+](C)CC2)C1 ZINC001407288358 1368710299 /nfs/dbraw/zinc/71/02/99/1368710299.db2.gz DJNCROPQDRNFQR-IEBWSBKVSA-N 1 3 341.515 2.685 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1C[N@H+](CC2CCCC2)CCC1(F)F)N(C)C ZINC001407312389 1368754778 /nfs/dbraw/zinc/75/47/78/1368754778.db2.gz DXSUKYMEWGDMPR-CVEARBPZSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1C[N@@H+](CC2CCCC2)CCC1(F)F)N(C)C ZINC001407312389 1368754783 /nfs/dbraw/zinc/75/47/83/1368754783.db2.gz DXSUKYMEWGDMPR-CVEARBPZSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[N@H+](CCC(C)(C)C)CCC1(F)F)N(C)C ZINC001407337875 1368790559 /nfs/dbraw/zinc/79/05/59/1368790559.db2.gz ZVRFSIWYAHQEEP-LSDHHAIUSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[N@@H+](CCC(C)(C)C)CCC1(F)F)N(C)C ZINC001407337875 1368790564 /nfs/dbraw/zinc/79/05/64/1368790564.db2.gz ZVRFSIWYAHQEEP-LSDHHAIUSA-N 1 3 347.494 2.836 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cs1 ZINC001407529383 1368944841 /nfs/dbraw/zinc/94/48/41/1368944841.db2.gz FNFKUADZPKELGH-YOEHRIQHSA-N 1 3 337.533 2.581 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CCC1CC1)N(C)C ZINC001407534739 1368952163 /nfs/dbraw/zinc/95/21/63/1368952163.db2.gz QWOODCTUEPOOME-FCGDIQPGSA-N 1 3 335.536 2.732 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC1CC1)N(C)C ZINC001407534739 1368952166 /nfs/dbraw/zinc/95/21/66/1368952166.db2.gz QWOODCTUEPOOME-FCGDIQPGSA-N 1 3 335.536 2.732 10 0 EFAEHO CCc1cccc(C[N@@H+]2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001437728235 1387977826 /nfs/dbraw/zinc/97/78/26/1387977826.db2.gz OVSISGMQSZZRTF-YLJYHZDGSA-N 1 3 343.515 2.529 10 0 EFAEHO CCc1cccc(C[N@H+]2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001437728235 1387977834 /nfs/dbraw/zinc/97/78/34/1387977834.db2.gz OVSISGMQSZZRTF-YLJYHZDGSA-N 1 3 343.515 2.529 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]CC2CC(F)(F)C2)CC1 ZINC001407705867 1369141614 /nfs/dbraw/zinc/14/16/14/1369141614.db2.gz YTMHBOGVCBTSNY-KOMQPUFPSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+]Cc2ccsc2)CCC1 ZINC001407774294 1369216310 /nfs/dbraw/zinc/21/63/10/1369216310.db2.gz BFJQVGFNKLNBFE-INIZCTEOSA-N 1 3 335.517 2.749 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CC2CC(F)(F)C2)CCC1 ZINC001407819677 1369269472 /nfs/dbraw/zinc/26/94/72/1369269472.db2.gz GEBAEAKFRIHUAJ-KBPBESRZSA-N 1 3 343.462 2.533 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]CC2CC(F)(F)C2)CCC1 ZINC001407819699 1369270449 /nfs/dbraw/zinc/27/04/49/1369270449.db2.gz GEBAEAKFRIHUAJ-ZIAGYGMSSA-N 1 3 343.462 2.533 10 0 EFAEHO CC[C@H](F)CN1CCC[C@H](NC(=O)CCC[NH+]2CCCC2)CC1 ZINC001407883269 1369346748 /nfs/dbraw/zinc/34/67/48/1369346748.db2.gz IDPDEKSFNFGHHR-IRXDYDNUSA-N 1 3 327.488 2.581 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@H+](Cc2ccc(CF)cc2)CC1 ZINC001407884960 1369349348 /nfs/dbraw/zinc/34/93/48/1369349348.db2.gz JXYFORXRLMRMRP-LJQANCHMSA-N 1 3 349.494 2.967 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@@H+](Cc2ccc(CF)cc2)CC1 ZINC001407884960 1369349354 /nfs/dbraw/zinc/34/93/54/1369349354.db2.gz JXYFORXRLMRMRP-LJQANCHMSA-N 1 3 349.494 2.967 10 0 EFAEHO CN(CCC[N@H+](C)C/C=C\c1ccccc1)C(=O)CN1CCCC1 ZINC001407947962 1369446121 /nfs/dbraw/zinc/44/61/21/1369446121.db2.gz LLHPVQYIOBEPNG-WQLSENKSSA-N 1 3 329.488 2.576 10 0 EFAEHO CN(CCC[N@@H+](C)C/C=C\c1ccccc1)C(=O)CN1CCCC1 ZINC001407947962 1369446125 /nfs/dbraw/zinc/44/61/25/1369446125.db2.gz LLHPVQYIOBEPNG-WQLSENKSSA-N 1 3 329.488 2.576 10 0 EFAEHO CCC1([NH2+]CC[C@H](C)F)CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001407990504 1369501827 /nfs/dbraw/zinc/50/18/27/1369501827.db2.gz BOKYYKXZCBTATM-HOTGVXAUSA-N 1 3 329.504 2.682 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(CC)([NH2+]C/C=C\Cl)CC1 ZINC001408003503 1369516689 /nfs/dbraw/zinc/51/66/89/1369516689.db2.gz PSQBYPLLZWOQEB-UBAGTECSSA-N 1 3 341.927 2.974 10 0 EFAEHO CC(C)CN1Cc2ccc(CNC(=O)C[C@H]3CC[N@H+](C)C3)cc2C1 ZINC001408050750 1369562622 /nfs/dbraw/zinc/56/26/22/1369562622.db2.gz DZKOFWJXPCZJOL-QGZVFWFLSA-N 1 3 329.488 2.616 10 0 EFAEHO CC(C)CN1Cc2ccc(CNC(=O)C[C@H]3CC[N@@H+](C)C3)cc2C1 ZINC001408050750 1369562628 /nfs/dbraw/zinc/56/26/28/1369562628.db2.gz DZKOFWJXPCZJOL-QGZVFWFLSA-N 1 3 329.488 2.616 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H]([NH2+]C/C=C\c3ccccc3)C2)C1 ZINC001408071382 1369581537 /nfs/dbraw/zinc/58/15/37/1369581537.db2.gz ZQAYGYRITJYBGR-JZTZAOQNSA-N 1 3 341.499 2.622 10 0 EFAEHO Cc1ccc(C[NH2+]C2(C)CCN(C(=O)CN(C)C(C)C)CC2)cc1F ZINC001408085156 1369591006 /nfs/dbraw/zinc/59/10/06/1369591006.db2.gz DDGTVLBBUSVMIY-UHFFFAOYSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(C[NH2+]C2(C)CCN(C(=O)CN(C)C(C)C)CC2)cs1 ZINC001408092672 1369598406 /nfs/dbraw/zinc/59/84/06/1369598406.db2.gz ZJCBFSDTQZVYLJ-UHFFFAOYSA-N 1 3 337.533 2.867 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CCC(C)(C)C)CC1(C)C ZINC001408146668 1369645514 /nfs/dbraw/zinc/64/55/14/1369645514.db2.gz QUWRDQXBPPUOIX-MRXNPFEDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CCC(C)(C)C)CC1(C)C ZINC001408146668 1369645520 /nfs/dbraw/zinc/64/55/20/1369645520.db2.gz QUWRDQXBPPUOIX-MRXNPFEDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@@H]1c2ccccc2CCN1CC[C@@H](C)F ZINC001408269693 1369766676 /nfs/dbraw/zinc/76/66/76/1369766676.db2.gz XANSGKPZKLVOOF-VQIMIIECSA-N 1 3 349.494 2.792 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@@H]1c2ccccc2CCN1CC[C@@H](C)F ZINC001408269693 1369766680 /nfs/dbraw/zinc/76/66/80/1369766680.db2.gz XANSGKPZKLVOOF-VQIMIIECSA-N 1 3 349.494 2.792 10 0 EFAEHO Cc1cccc(C[N@@H+](C)C[C@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001408355355 1369867364 /nfs/dbraw/zinc/86/73/64/1369867364.db2.gz IKUIXPDAVANDIE-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1cccc(C[N@H+](C)C[C@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001408355355 1369867367 /nfs/dbraw/zinc/86/73/67/1369867367.db2.gz IKUIXPDAVANDIE-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NCC1(C)CCCCCC1 ZINC001414590677 1370480549 /nfs/dbraw/zinc/48/05/49/1370480549.db2.gz APKOXAAYPBQKFE-KRWDZBQOSA-N 1 3 340.556 2.918 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NCC1(C)CCCCCC1 ZINC001414590677 1370480555 /nfs/dbraw/zinc/48/05/55/1370480555.db2.gz APKOXAAYPBQKFE-KRWDZBQOSA-N 1 3 340.556 2.918 10 0 EFAEHO CN(CC(=O)N(C)CC[NH2+][C@H]1CCc2ccccc21)CC(C)(C)C ZINC001437846536 1388138273 /nfs/dbraw/zinc/13/82/73/1388138273.db2.gz XDVULBLIJKZOHF-SFHVURJKSA-N 1 3 331.504 2.700 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21)N(C)Cc1ccccc1 ZINC001417643807 1373118166 /nfs/dbraw/zinc/11/81/66/1373118166.db2.gz IBQXMYLXORGXSX-BHIYHBOVSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[C@H]2CCCC[N@H+]21)N(C)Cc1ccccc1 ZINC001417643807 1373118169 /nfs/dbraw/zinc/11/81/69/1373118169.db2.gz IBQXMYLXORGXSX-BHIYHBOVSA-N 1 3 329.488 2.640 10 0 EFAEHO O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001417646248 1373120077 /nfs/dbraw/zinc/12/00/77/1373120077.db2.gz AJWPAJHDRWTELQ-UFYCRDLUSA-N 1 3 341.499 2.784 10 0 EFAEHO O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001417646248 1373120081 /nfs/dbraw/zinc/12/00/81/1373120081.db2.gz AJWPAJHDRWTELQ-UFYCRDLUSA-N 1 3 341.499 2.784 10 0 EFAEHO CN(C[C@H]1CCN1CCC1CC1)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001417752603 1373213262 /nfs/dbraw/zinc/21/32/62/1373213262.db2.gz NZGXCBKAQWWOOQ-GOSISDBHSA-N 1 3 335.536 2.972 10 0 EFAEHO CN(C[C@H]1CCN1CCC1CC1)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001417752603 1373213267 /nfs/dbraw/zinc/21/32/67/1373213267.db2.gz NZGXCBKAQWWOOQ-GOSISDBHSA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccccc2)C1)N1CCCC1 ZINC001417770553 1373234948 /nfs/dbraw/zinc/23/49/48/1373234948.db2.gz RSILZEIDJAYJIT-HDICACEKSA-N 1 3 329.488 2.545 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2cccc(F)c2)C1 ZINC001417777855 1373243919 /nfs/dbraw/zinc/24/39/19/1373243919.db2.gz MVTSXDUDQKBEFK-RIVXBTQJSA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)c1cccc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)n1 ZINC001417779136 1373245490 /nfs/dbraw/zinc/24/54/90/1373245490.db2.gz ZQMKLOXNKKBHJB-MAEOIBBWSA-N 1 3 346.519 2.530 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2C[C@H](CNC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001417786193 1373252619 /nfs/dbraw/zinc/25/26/19/1373252619.db2.gz FEIXOTDSIJAJST-IEZWGBDMSA-N 1 3 349.494 2.705 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H]2C[C@H](NCC=C(Cl)Cl)C2)CC[N@@H+]1C ZINC001417788886 1373254887 /nfs/dbraw/zinc/25/48/87/1373254887.db2.gz SKRUVSNJLBFNIH-XDQVBPFNSA-N 1 3 348.318 2.520 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H]2C[C@H](NCC=C(Cl)Cl)C2)CC[N@H+]1C ZINC001417788886 1373254892 /nfs/dbraw/zinc/25/48/92/1373254892.db2.gz SKRUVSNJLBFNIH-XDQVBPFNSA-N 1 3 348.318 2.520 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+]Cc2ccc(Cl)cc2)C1 ZINC001417803016 1373272023 /nfs/dbraw/zinc/27/20/23/1373272023.db2.gz QANOCJBREUBZEL-JCNLHEQBSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C[C@@H]1C)CC[NH+](CC1CCC1)CC2 ZINC001417811802 1373282044 /nfs/dbraw/zinc/28/20/44/1373282044.db2.gz IGLJSFBYPBMOIR-KRWDZBQOSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[NH+](C)C)CCN1C/C=C/c1ccccc1 ZINC001417824073 1373299643 /nfs/dbraw/zinc/29/96/43/1373299643.db2.gz CISCZHNELNVIFP-PBKBVCMISA-N 1 3 329.488 2.621 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@H]1CCCCCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001417846742 1373329711 /nfs/dbraw/zinc/32/97/11/1373329711.db2.gz OQRADPYRBWSHHD-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@@H]1CCCCCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001417846748 1373329806 /nfs/dbraw/zinc/32/98/06/1373329806.db2.gz OQRADPYRBWSHHD-HZPDHXFCSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1CCN(Cc2cccnc2)CC(C)(C)C1 ZINC001417863855 1373357239 /nfs/dbraw/zinc/35/72/39/1373357239.db2.gz XBYYTYFLWYONET-GOSISDBHSA-N 1 3 346.519 2.530 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1CCN(Cc2cccnc2)CC(C)(C)C1 ZINC001417863855 1373357243 /nfs/dbraw/zinc/35/72/43/1373357243.db2.gz XBYYTYFLWYONET-GOSISDBHSA-N 1 3 346.519 2.530 10 0 EFAEHO Cc1cc(F)ccc1CN1CCC(N(C)C(=O)CC[NH+](C)C)CC1 ZINC001417895996 1373384860 /nfs/dbraw/zinc/38/48/60/1373384860.db2.gz GEHUNPGHDZOORX-UHFFFAOYSA-N 1 3 335.467 2.509 10 0 EFAEHO Cc1ccccc1CN1CCC[C@@H](NC(=O)CC[C@@H]2CCC[N@H+]2C)C1 ZINC001417907320 1373401188 /nfs/dbraw/zinc/40/11/88/1373401188.db2.gz DRGNPZANTWGJMH-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccccc1CN1CCC[C@@H](NC(=O)CC[C@@H]2CCC[N@@H+]2C)C1 ZINC001417907320 1373401193 /nfs/dbraw/zinc/40/11/93/1373401193.db2.gz DRGNPZANTWGJMH-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccccc1C[NH+]1CCC2(C[C@H]2NC(=O)CN(C)C(C)C)CC1 ZINC001417957052 1373450910 /nfs/dbraw/zinc/45/09/10/1373450910.db2.gz NNVLTIBRUJLDFH-LJQANCHMSA-N 1 3 343.515 2.806 10 0 EFAEHO CC[C@@H](C)C[NH+]1CCC2(C[C@@H]2NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001417966661 1373467501 /nfs/dbraw/zinc/46/75/01/1373467501.db2.gz VNQBAWIIGDLRAC-SJORKVTESA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+][C@@H](C)c1ccccc1F)C1CC1 ZINC001418009541 1373517169 /nfs/dbraw/zinc/51/71/69/1373517169.db2.gz FFZMNTIPFBUCMK-KSSFIOAISA-N 1 3 335.467 2.711 10 0 EFAEHO C[C@H]1CCC[C@H](CCN2C[C@H]3CC[C@@H](C2)N3C(=O)CC[NH+](C)C)C1 ZINC001418033589 1373548525 /nfs/dbraw/zinc/54/85/25/1373548525.db2.gz GMVTXWNIXGIIKN-ZSYWTGECSA-N 1 3 335.536 2.830 10 0 EFAEHO CN(C/C=C/Cl)C[C@H]1CCCN(C(=O)C(C)(C)[NH+]2CCCC2)C1 ZINC001418035654 1373550849 /nfs/dbraw/zinc/55/08/49/1373550849.db2.gz WYCUVINACDRZFD-MNDMWVCDSA-N 1 3 341.927 2.784 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]([NH2+]CC[C@@H]3CCCC3(F)F)C2)CCC1 ZINC001418063394 1373569020 /nfs/dbraw/zinc/56/90/20/1373569020.db2.gz RILGXYUHTKSFEL-KKUMJFAQSA-N 1 3 343.462 2.533 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001418066056 1373571716 /nfs/dbraw/zinc/57/17/16/1373571716.db2.gz SDONVDIWHIWHIM-GUDVDZBRSA-N 1 3 329.488 2.641 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@H]2CN(C/C=C/Cl)CC[C@H]21 ZINC001418082932 1373590191 /nfs/dbraw/zinc/59/01/91/1373590191.db2.gz PYWJAEOWTWMVOZ-AQBSSDIKSA-N 1 3 341.927 2.784 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@H]2CN(C/C=C/Cl)CC[C@H]21 ZINC001418082932 1373590195 /nfs/dbraw/zinc/59/01/95/1373590195.db2.gz PYWJAEOWTWMVOZ-AQBSSDIKSA-N 1 3 341.927 2.784 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccccc2F)C1)CC(C)(C)C ZINC001418103223 1373606249 /nfs/dbraw/zinc/60/62/49/1373606249.db2.gz JKLNSDGIERINOZ-IYBDPMFKSA-N 1 3 335.467 2.540 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC1CCC([NH2+]C/C=C\Cl)CC1 ZINC001418188073 1373751823 /nfs/dbraw/zinc/75/18/23/1373751823.db2.gz UNWJZNMIVGEANK-OPLYECJVSA-N 1 3 327.900 2.630 10 0 EFAEHO CCCN(C)CC(=O)NC1CCC([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC001418190060 1373753751 /nfs/dbraw/zinc/75/37/51/1373753751.db2.gz VNXLJSPZPRNYJA-FHERZECASA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001418221895 1373776923 /nfs/dbraw/zinc/77/69/23/1373776923.db2.gz OLHXENCCGOQMMG-AEFFLSMTSA-N 1 3 335.536 2.924 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)NCc1cc2ccccc2o1 ZINC001418229792 1373785244 /nfs/dbraw/zinc/78/52/44/1373785244.db2.gz MSEXVLFFJUKGCI-MAUKXSAKSA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)NCc1cc2ccccc2o1 ZINC001418229792 1373785247 /nfs/dbraw/zinc/78/52/47/1373785247.db2.gz MSEXVLFFJUKGCI-MAUKXSAKSA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)NCc1cc2ccccc2o1 ZINC001418229796 1373785881 /nfs/dbraw/zinc/78/58/81/1373785881.db2.gz MSEXVLFFJUKGCI-YJBOKZPZSA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)NCc1cc2ccccc2o1 ZINC001418229796 1373785887 /nfs/dbraw/zinc/78/58/87/1373785887.db2.gz MSEXVLFFJUKGCI-YJBOKZPZSA-N 1 3 343.471 2.902 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@H](C)CNC(=O)CN(C)CC(C)(C)C)c1 ZINC001418276351 1373846636 /nfs/dbraw/zinc/84/66/36/1373846636.db2.gz PWDHOMXBGXLUHD-CVEARBPZSA-N 1 3 349.519 2.828 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001418277624 1373850787 /nfs/dbraw/zinc/85/07/87/1373850787.db2.gz YAAHQLMZLVHDMB-GJZGRUSLSA-N 1 3 347.494 2.884 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001418373746 1373950749 /nfs/dbraw/zinc/95/07/49/1373950749.db2.gz IDQVZYLAFJSBPH-JKSUJKDBSA-N 1 3 345.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001418373746 1373950753 /nfs/dbraw/zinc/95/07/53/1373950753.db2.gz IDQVZYLAFJSBPH-JKSUJKDBSA-N 1 3 345.478 2.685 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1c(C)cccc1Cl)N(C)C ZINC001418408795 1373989263 /nfs/dbraw/zinc/98/92/63/1373989263.db2.gz VWTLSLNFLHLBFE-RHSMWYFYSA-N 1 3 339.911 2.973 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[N@H+](C)CC1CC2(CCC2)C1 ZINC001418504993 1374105142 /nfs/dbraw/zinc/10/51/42/1374105142.db2.gz URVXCWXIRCBSPQ-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[N@@H+](C)CC1CC2(CCC2)C1 ZINC001418504993 1374105144 /nfs/dbraw/zinc/10/51/44/1374105144.db2.gz URVXCWXIRCBSPQ-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(CCNC(=O)[C@H]1CCC[C@H]([NH+](C)C)C1)Cc1ccc(CF)cc1 ZINC001418511439 1374113150 /nfs/dbraw/zinc/11/31/50/1374113150.db2.gz SKSBACBSEHDRDQ-OALUTQOASA-N 1 3 349.494 2.825 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N(C)CCNC(=O)C12CC[NH+](CC1)C2 ZINC001418511359 1374113939 /nfs/dbraw/zinc/11/39/39/1374113939.db2.gz DEPBUXBGJDSPHZ-CQSZACIVSA-N 1 3 335.879 2.545 10 0 EFAEHO CC(C)c1ccc(CN(C)CCNC(=O)[C@@H](C(C)C)[NH+](C)C)cc1 ZINC001418516441 1374120691 /nfs/dbraw/zinc/12/06/91/1374120691.db2.gz OOCUNXTWQZLVPE-LJQANCHMSA-N 1 3 333.520 2.944 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)Cc1ccc(CF)cc1 ZINC001418560806 1374181717 /nfs/dbraw/zinc/18/17/17/1374181717.db2.gz FQGGYZBRFWGBJQ-LPHOPBHVSA-N 1 3 349.494 2.825 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)Cc1ccc(CF)cc1 ZINC001418560806 1374181719 /nfs/dbraw/zinc/18/17/19/1374181719.db2.gz FQGGYZBRFWGBJQ-LPHOPBHVSA-N 1 3 349.494 2.825 10 0 EFAEHO CC[C@H](F)C[N@H+](C)C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001437991518 1388302838 /nfs/dbraw/zinc/30/28/38/1388302838.db2.gz POWJMDWWZIWILO-HKUYNNGSSA-N 1 3 349.494 2.890 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001437991518 1388302845 /nfs/dbraw/zinc/30/28/45/1388302845.db2.gz POWJMDWWZIWILO-HKUYNNGSSA-N 1 3 349.494 2.890 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21)Cc1ccc(F)cc1 ZINC001418571341 1374201925 /nfs/dbraw/zinc/20/19/25/1374201925.db2.gz VOCOGRREHCTTCX-OALUTQOASA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21)Cc1ccc(F)cc1 ZINC001418571341 1374201930 /nfs/dbraw/zinc/20/19/30/1374201930.db2.gz VOCOGRREHCTTCX-OALUTQOASA-N 1 3 347.478 2.781 10 0 EFAEHO CN(C[C@H]1CCN1[C@@H]1CCc2ccccc21)C(=O)C1(C[NH+](C)C)CC1 ZINC001418586692 1374229430 /nfs/dbraw/zinc/22/94/30/1374229430.db2.gz FZPZPMBZWNNLDE-IEBWSBKVSA-N 1 3 341.499 2.548 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@@H]1CCN1CCC1CC1)[NH+]1CCCCC1 ZINC001418599749 1374250473 /nfs/dbraw/zinc/25/04/73/1374250473.db2.gz IZHLWDXXJBCVLJ-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1C[C@H]([NH2+]CC2CC(C)(C)C2)C1)N1CCCC1 ZINC001418648306 1374319483 /nfs/dbraw/zinc/31/94/83/1374319483.db2.gz LUSYIHAGDOTWHK-WOVMCDHWSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@H+](CC2CCC(C)(C)CC2)C1)N(C)C ZINC001418689700 1374372552 /nfs/dbraw/zinc/37/25/52/1374372552.db2.gz YSTHOSSJQSNCIC-ZWKOTPCHSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@@H+](CC2CCC(C)(C)CC2)C1)N(C)C ZINC001418689700 1374372556 /nfs/dbraw/zinc/37/25/56/1374372556.db2.gz YSTHOSSJQSNCIC-ZWKOTPCHSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@H+](CCCC2CCC2)C1)N1CCCC1 ZINC001418694514 1374377618 /nfs/dbraw/zinc/37/76/18/1374377618.db2.gz YWIUQAUWIVBALE-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@@H+](CCCC2CCC2)C1)N1CCCC1 ZINC001418694514 1374377622 /nfs/dbraw/zinc/37/76/22/1374377622.db2.gz YWIUQAUWIVBALE-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[C@@H]([NH2+]CC=C(Cl)Cl)C1)C1CCC1 ZINC001418715347 1374405771 /nfs/dbraw/zinc/40/57/71/1374405771.db2.gz MWLSNOLRMUCFFB-QWHCGFSZSA-N 1 3 348.318 2.664 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC001418724801 1374420261 /nfs/dbraw/zinc/42/02/61/1374420261.db2.gz HLCDPYJYBOGEGY-FUHWJXTLSA-N 1 3 335.467 2.542 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+][C@@H]2CCc3ccc(Cl)cc32)CCC1 ZINC001418813211 1374534731 /nfs/dbraw/zinc/53/47/31/1374534731.db2.gz UZCOEXCGAHPTKD-QGZVFWFLSA-N 1 3 349.906 2.860 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[N@H+](C)CCc1ccccc1 ZINC001418821966 1374542656 /nfs/dbraw/zinc/54/26/56/1374542656.db2.gz QEBXLTCEWAVJES-FQEVSTJZSA-N 1 3 345.531 2.882 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[N@@H+](C)CCc1ccccc1 ZINC001418821966 1374542661 /nfs/dbraw/zinc/54/26/61/1374542661.db2.gz QEBXLTCEWAVJES-FQEVSTJZSA-N 1 3 345.531 2.882 10 0 EFAEHO CC(C)C[N@H+](C)C[C@@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001418824907 1374546230 /nfs/dbraw/zinc/54/62/30/1374546230.db2.gz KXWUCNOJZAZMBL-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)C[N@@H+](C)C[C@@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001418824907 1374546233 /nfs/dbraw/zinc/54/62/33/1374546233.db2.gz KXWUCNOJZAZMBL-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC001418832535 1374554679 /nfs/dbraw/zinc/55/46/79/1374554679.db2.gz PZAYGDNYPPIMJK-SFHVURJKSA-N 1 3 335.467 2.591 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)C1)N(C)C ZINC001438020820 1388324395 /nfs/dbraw/zinc/32/43/95/1388324395.db2.gz POGMSLGLLNLKDK-ARFHVFGLSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@@H+](C[C@H]2CCC(F)(F)C2)C1)N(C)C ZINC001438020820 1388324400 /nfs/dbraw/zinc/32/44/00/1388324400.db2.gz POGMSLGLLNLKDK-ARFHVFGLSA-N 1 3 345.478 2.589 10 0 EFAEHO C[C@@H]([NH2+]CC[C@H](C)F)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001418844120 1374566713 /nfs/dbraw/zinc/56/67/13/1374566713.db2.gz JJDOLRUCIFLJDP-JKSUJKDBSA-N 1 3 343.531 2.929 10 0 EFAEHO CC[NH2+][C@H](CNC(=O)CN1CC[C@H](C)C1)c1ccc(C(C)C)cc1 ZINC001418844707 1374567560 /nfs/dbraw/zinc/56/75/60/1374567560.db2.gz QPHMWZVCLXHEIF-QFBILLFUSA-N 1 3 331.504 2.919 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]([NH2+]CC1CCCC1)c1ccccc1)N(C)C ZINC001418850372 1374573728 /nfs/dbraw/zinc/57/37/28/1374573728.db2.gz ICCVBGVDBPIWJK-OALUTQOASA-N 1 3 331.504 2.964 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@@H]2CC[N@H+](Cc3ccsc3)C2)CCC1 ZINC001418895623 1374648397 /nfs/dbraw/zinc/64/83/97/1374648397.db2.gz ZZLDUTULYFJGMC-OAHLLOKOSA-N 1 3 335.517 2.561 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@@H]2CC[N@@H+](Cc3ccsc3)C2)CCC1 ZINC001418895623 1374648401 /nfs/dbraw/zinc/64/84/01/1374648401.db2.gz ZZLDUTULYFJGMC-OAHLLOKOSA-N 1 3 335.517 2.561 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@@H+]([C@@H]2CCc3ccccc32)C1 ZINC001418909404 1374673233 /nfs/dbraw/zinc/67/32/33/1374673233.db2.gz XOXPLKOFBQKIGG-YLJYHZDGSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@H+]([C@@H]2CCc3ccccc32)C1 ZINC001418909404 1374673237 /nfs/dbraw/zinc/67/32/37/1374673237.db2.gz XOXPLKOFBQKIGG-YLJYHZDGSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@@H+]([C@@H]2CCc3ccccc32)C1 ZINC001418909397 1374673535 /nfs/dbraw/zinc/67/35/35/1374673535.db2.gz XOXPLKOFBQKIGG-FXAWDEMLSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@H+]([C@@H]2CCc3ccccc32)C1 ZINC001418909397 1374673540 /nfs/dbraw/zinc/67/35/40/1374673540.db2.gz XOXPLKOFBQKIGG-FXAWDEMLSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1ccc(F)c(C[N@@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001418945513 1374717589 /nfs/dbraw/zinc/71/75/89/1374717589.db2.gz XXYLSTXOCIUTIQ-KRWDZBQOSA-N 1 3 349.494 2.755 10 0 EFAEHO Cc1ccc(F)c(C[N@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001418945513 1374717592 /nfs/dbraw/zinc/71/75/92/1374717592.db2.gz XXYLSTXOCIUTIQ-KRWDZBQOSA-N 1 3 349.494 2.755 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001418946961 1374720296 /nfs/dbraw/zinc/72/02/96/1374720296.db2.gz BYZOFLWAGJDYTM-GOSISDBHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001418946961 1374720298 /nfs/dbraw/zinc/72/02/98/1374720298.db2.gz BYZOFLWAGJDYTM-GOSISDBHSA-N 1 3 337.552 2.935 10 0 EFAEHO Cc1cccc([C@@H](C)N2CC(CNC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001419022540 1374771008 /nfs/dbraw/zinc/77/10/08/1374771008.db2.gz KQZUZCIKGRPKFD-XLIONFOSSA-N 1 3 343.515 2.978 10 0 EFAEHO Cc1cccc([C@@H](C)N2CC(CNC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001419022540 1374771013 /nfs/dbraw/zinc/77/10/13/1374771013.db2.gz KQZUZCIKGRPKFD-XLIONFOSSA-N 1 3 343.515 2.978 10 0 EFAEHO CCCN(C)CC(=O)NCC1C[NH+]([C@H](C)c2cc(C)ccc2C)C1 ZINC001419044393 1374786840 /nfs/dbraw/zinc/78/68/40/1374786840.db2.gz ZACBRILNEJWIGG-QGZVFWFLSA-N 1 3 331.504 2.754 10 0 EFAEHO Cc1ccc(C)c([C@H](C)N2C[C@@H]3C[C@H]2CN3C(=O)CCC[NH+](C)C)c1 ZINC001419055996 1374797202 /nfs/dbraw/zinc/79/72/02/1374797202.db2.gz YHRCZHBLPCLDFH-FHWLQOOXSA-N 1 3 343.515 2.991 10 0 EFAEHO CC(C)CCCN1C[C@@H]2C[C@H]1CN2C(=O)CCC[NH+]1CCCCC1 ZINC001419056865 1374798059 /nfs/dbraw/zinc/79/80/59/1374798059.db2.gz XQIUGQQGBMKZOP-OALUTQOASA-N 1 3 335.536 2.974 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001419079745 1374819919 /nfs/dbraw/zinc/81/99/19/1374819919.db2.gz MRSMKKJGBDUWQB-GOEBONIOSA-N 1 3 345.478 2.731 10 0 EFAEHO Cc1cccc(CN2CCC[C@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001419095422 1374836840 /nfs/dbraw/zinc/83/68/40/1374836840.db2.gz RQIRHOOAGVRICX-PMACEKPBSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1cccc(CN2CCC[C@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001419095422 1374836845 /nfs/dbraw/zinc/83/68/45/1374836845.db2.gz RQIRHOOAGVRICX-PMACEKPBSA-N 1 3 343.515 2.950 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@H]1CCCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001419095267 1374836889 /nfs/dbraw/zinc/83/68/89/1374836889.db2.gz DBULWHNBAQHSCX-GOSISDBHSA-N 1 3 342.487 2.590 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H]1CC[N@H+](CCC2CC2)C1)N1CCCCC1 ZINC001419123363 1374868996 /nfs/dbraw/zinc/86/89/96/1374868996.db2.gz IFRJEAIHGUFOGF-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H]1CC[N@@H+](CCC2CC2)C1)N1CCCCC1 ZINC001419123363 1374869000 /nfs/dbraw/zinc/86/90/00/1374869000.db2.gz IFRJEAIHGUFOGF-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@@H](CNC(=O)CC[NH+](C)C)NCc1ccc(C)cc1Cl ZINC001419227351 1374974157 /nfs/dbraw/zinc/97/41/57/1374974157.db2.gz XKGQORGZMGVFID-HNNXBMFYSA-N 1 3 325.884 2.585 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001419256330 1375002704 /nfs/dbraw/zinc/00/27/04/1375002704.db2.gz YXTJTGRIWVUCNX-OXQOHEQNSA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@@H](C(=O)N[C@@](C)(C[NH2+]CC1CCC1)C1CC1)N1CCCCCC1 ZINC001419347559 1375141594 /nfs/dbraw/zinc/14/15/94/1375141594.db2.gz UGBZHTQNLXWFDG-JXFKEZNVSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H]([NH2+]Cc3ccsc3)CC2)CCC1 ZINC001419382023 1375199496 /nfs/dbraw/zinc/19/94/96/1375199496.db2.gz YXMXHHRRTXRNHP-WKILWMFISA-N 1 3 335.517 2.749 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]C/C=C\c2ccc(Cl)cc2)C1 ZINC001419428149 1375259994 /nfs/dbraw/zinc/25/99/94/1375259994.db2.gz CPWHBCYXZZWYQM-YFTNUUPDSA-N 1 3 349.906 2.930 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@@H]2CN(Cc3ccsc3)CC[C@H]21 ZINC001419453937 1375294531 /nfs/dbraw/zinc/29/45/31/1375294531.db2.gz YTIKGPQXGCIFOE-QZTJIDSGSA-N 1 3 349.544 2.903 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@H+](Cc3ccsc3)CC[C@@H]21 ZINC001419453888 1375295861 /nfs/dbraw/zinc/29/58/61/1375295861.db2.gz YLWVLERRZHFYIK-ROUUACIJSA-N 1 3 349.544 2.903 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@@H+](Cc3ccsc3)CC[C@@H]21 ZINC001419453888 1375295868 /nfs/dbraw/zinc/29/58/68/1375295868.db2.gz YLWVLERRZHFYIK-ROUUACIJSA-N 1 3 349.544 2.903 10 0 EFAEHO CC[C@H]([NH2+][C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)C1)c1ccc(F)cc1 ZINC001419477612 1375321219 /nfs/dbraw/zinc/32/12/19/1375321219.db2.gz ZRZCLLYWFMYFJZ-SCTDSRPQSA-N 1 3 347.478 2.998 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]Cc1ccc(F)cc1 ZINC001419504387 1375354704 /nfs/dbraw/zinc/35/47/04/1375354704.db2.gz NQEAPGWUOZBMPY-HNNXBMFYSA-N 1 3 335.467 2.542 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C[C@@H](C)CNC(=O)CN(C)C(C)C ZINC001419540125 1375417255 /nfs/dbraw/zinc/41/72/55/1375417255.db2.gz QOROLFDALCGJTO-CQSZACIVSA-N 1 3 339.911 2.831 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1C ZINC001419571475 1375466552 /nfs/dbraw/zinc/46/65/52/1375466552.db2.gz VWIJWPMMLNPTHT-FQEVSTJZSA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001419669207 1375675210 /nfs/dbraw/zinc/67/52/10/1375675210.db2.gz AOPYLWFDIAJGQF-BEFAXECRSA-N 1 3 344.503 2.691 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](C)CNC(=O)[C@@H]1CCCN1C(C)C ZINC001419735797 1375789145 /nfs/dbraw/zinc/78/91/45/1375789145.db2.gz RFEGMKNAKYUWFA-MJGOQNOKSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C[C@H](C)N(C)C(=O)CN(C)C(C)C ZINC001419756767 1375822720 /nfs/dbraw/zinc/82/27/20/1375822720.db2.gz DJBKSNFJOVYSDA-HNNXBMFYSA-N 1 3 339.911 2.925 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(F)cc1C ZINC001419762220 1375832520 /nfs/dbraw/zinc/83/25/20/1375832520.db2.gz IWTLJKWUQZGCGU-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(F)cc1C ZINC001419762216 1375833037 /nfs/dbraw/zinc/83/30/37/1375833037.db2.gz IWTLJKWUQZGCGU-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001419766081 1375838670 /nfs/dbraw/zinc/83/86/70/1375838670.db2.gz MWRFVEINLVYMOG-ZDUSSCGKSA-N 1 3 343.874 2.756 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001419840521 1375971579 /nfs/dbraw/zinc/97/15/79/1375971579.db2.gz PDLURRVLAWJNSJ-KRWDZBQOSA-N 1 3 331.504 2.772 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C)[C@H]1C[NH2+]CC1CC(C)(C)C1 ZINC001419849178 1375995869 /nfs/dbraw/zinc/99/58/69/1375995869.db2.gz SBXNTZRESKZRPN-FUHWJXTLSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1)N(C)C ZINC001438211743 1388415790 /nfs/dbraw/zinc/41/57/90/1388415790.db2.gz VGGFELQNXRIICH-BZUAXINKSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@@H+](CC[C@H]2CCCC2(F)F)C1)N(C)C ZINC001438211743 1388415792 /nfs/dbraw/zinc/41/57/92/1388415792.db2.gz VGGFELQNXRIICH-BZUAXINKSA-N 1 3 345.478 2.589 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](C)CNC(=O)[C@@H]1CCCCN1C(C)C ZINC001419865607 1376029545 /nfs/dbraw/zinc/02/95/45/1376029545.db2.gz JLMLTPCFLCPVTO-HKUYNNGSSA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](NCc2ccccc2F)C(C)C)CC[N@@H+]1C ZINC001419892756 1376083542 /nfs/dbraw/zinc/08/35/42/1376083542.db2.gz LOBPQYQIMZQFTK-YTQUADARSA-N 1 3 349.494 2.786 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](NCc2ccccc2F)C(C)C)CC[N@H+]1C ZINC001419892756 1376083548 /nfs/dbraw/zinc/08/35/48/1376083548.db2.gz LOBPQYQIMZQFTK-YTQUADARSA-N 1 3 349.494 2.786 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]Cc1cccnc1 ZINC001419899406 1376097331 /nfs/dbraw/zinc/09/73/31/1376097331.db2.gz FIXRAYHIGPZWDK-PKOBYXMFSA-N 1 3 346.519 2.577 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(F)c(F)c1 ZINC001419940105 1376162752 /nfs/dbraw/zinc/16/27/52/1376162752.db2.gz XMQLKEPMZFSYEP-KRWDZBQOSA-N 1 3 341.446 2.535 10 0 EFAEHO CCN1CCC[C@H](NC(=O)c2ccc(OCC[NH+](CC)CC)cc2)C1 ZINC001419987898 1376238477 /nfs/dbraw/zinc/23/84/77/1376238477.db2.gz GSIUHUSBGUCQIY-SFHVURJKSA-N 1 3 347.503 2.621 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]Cc2cc3ccccc3o2)C1 ZINC001420005966 1376267925 /nfs/dbraw/zinc/26/79/25/1376267925.db2.gz AMLKQMZSKVFNOD-INIZCTEOSA-N 1 3 343.471 2.711 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001420041150 1376356346 /nfs/dbraw/zinc/35/63/46/1376356346.db2.gz AYLUREZKGDFQEH-MSOLQXFVSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001420041150 1376356354 /nfs/dbraw/zinc/35/63/54/1376356354.db2.gz AYLUREZKGDFQEH-MSOLQXFVSA-N 1 3 325.541 2.932 10 0 EFAEHO CN(Cc1ccc(Cl)cc1)[C@@H]1CCCN(C(=O)CC[NH+](C)C)C1 ZINC001420060616 1376401344 /nfs/dbraw/zinc/40/13/44/1376401344.db2.gz YNUQHAJEELGYTR-QGZVFWFLSA-N 1 3 337.895 2.715 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@@H]21 ZINC001420071995 1376418664 /nfs/dbraw/zinc/41/86/64/1376418664.db2.gz FTTABMJSLKRLIU-MJGOQNOKSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@@H]21 ZINC001420071995 1376418669 /nfs/dbraw/zinc/41/86/69/1376418669.db2.gz FTTABMJSLKRLIU-MJGOQNOKSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]Cc1ccccc1C(F)(F)F)N(C)C ZINC001420311257 1376710920 /nfs/dbraw/zinc/71/09/20/1376710920.db2.gz PVHRWFPUYANCNZ-IUODEOHRSA-N 1 3 345.409 2.640 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)C[N@@H+]2CC[C@@H](C)C2)c(Cl)c1 ZINC001420336914 1376757236 /nfs/dbraw/zinc/75/72/36/1376757236.db2.gz FICMRTPWGATEKB-HUUCEWRRSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)C[N@H+]2CC[C@@H](C)C2)c(Cl)c1 ZINC001420336914 1376757242 /nfs/dbraw/zinc/75/72/42/1376757242.db2.gz FICMRTPWGATEKB-HUUCEWRRSA-N 1 3 337.895 2.585 10 0 EFAEHO C[C@H](C[NH2+]C[C@H]1CCCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001420341192 1376764878 /nfs/dbraw/zinc/76/48/78/1376764878.db2.gz FFXCIHUNDCFMKO-CABCVRRESA-N 1 3 347.494 2.884 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@@H](C)NC(=O)[C@@H]1CCCCN1C(C)C ZINC001420350952 1376786072 /nfs/dbraw/zinc/78/60/72/1376786072.db2.gz ALTNPSHHWCYUPY-APWZRJJASA-N 1 3 349.494 2.991 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@@H]1CC[N@H+](CCc2cccs2)C1 ZINC001438268878 1388468614 /nfs/dbraw/zinc/46/86/14/1388468614.db2.gz RXIPRWBOXFINLU-DLBZAZTESA-N 1 3 349.544 2.555 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@@H]1CC[N@@H+](CCc2cccs2)C1 ZINC001438268878 1388468617 /nfs/dbraw/zinc/46/86/17/1388468617.db2.gz RXIPRWBOXFINLU-DLBZAZTESA-N 1 3 349.544 2.555 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)C23CCC[NH+]2CCC3)c(Cl)c1 ZINC001420441982 1376983642 /nfs/dbraw/zinc/98/36/42/1376983642.db2.gz AMDTVDKYKKNKNI-HNNXBMFYSA-N 1 3 349.906 2.871 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C[NH2+]Cc1cc2ccccc2s1)N(C)C ZINC001420506085 1377097985 /nfs/dbraw/zinc/09/79/85/1377097985.db2.gz JLPQEEUDCNANKN-BBRMVZONSA-N 1 3 333.501 2.836 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@H](C(C)C)[NH+]2CCCC2)c1 ZINC001420517677 1377118018 /nfs/dbraw/zinc/11/80/18/1377118018.db2.gz OELNIKNYBZFLEC-LPHOPBHVSA-N 1 3 349.494 2.849 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001420557745 1377193052 /nfs/dbraw/zinc/19/30/52/1377193052.db2.gz MVNLVUATDVDUQP-IAGOWNOFSA-N 1 3 347.503 2.535 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001420557745 1377193057 /nfs/dbraw/zinc/19/30/57/1377193057.db2.gz MVNLVUATDVDUQP-IAGOWNOFSA-N 1 3 347.503 2.535 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@H+](CC2CCC(F)(F)CC2)C1)N(C)C ZINC001420571768 1377223784 /nfs/dbraw/zinc/22/37/84/1377223784.db2.gz ZJKMKSYBJIUDEE-JKSUJKDBSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@@H+](CC2CCC(F)(F)CC2)C1)N(C)C ZINC001420571768 1377223788 /nfs/dbraw/zinc/22/37/88/1377223788.db2.gz ZJKMKSYBJIUDEE-JKSUJKDBSA-N 1 3 345.478 2.590 10 0 EFAEHO CCc1ccc(CN(C)C[C@H](C)NC(=O)[C@H]2C[NH+]3CCC2CC3)cc1 ZINC001420584506 1377253078 /nfs/dbraw/zinc/25/30/78/1377253078.db2.gz XLVKJZRCLNMIHZ-JXFKEZNVSA-N 1 3 343.515 2.527 10 0 EFAEHO CCCN(CCNC(=O)C12CCC[NH+](CCC1)C2)Cc1ccsc1 ZINC001420590317 1377266346 /nfs/dbraw/zinc/26/63/46/1377266346.db2.gz IADNOCBUGLMPHE-UHFFFAOYSA-N 1 3 349.544 2.952 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(CF)cc1)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001420607203 1377308228 /nfs/dbraw/zinc/30/82/28/1377308228.db2.gz GVBNXELRIPSOCI-MRXNPFEDSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@H](C[N@H+](C)C[C@@H]1CCC(F)(F)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001420616148 1377331103 /nfs/dbraw/zinc/33/11/03/1377331103.db2.gz UUOJGDLPRXESLO-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C[N@@H+](C)C[C@@H]1CCC(F)(F)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001420616148 1377331106 /nfs/dbraw/zinc/33/11/06/1377331106.db2.gz UUOJGDLPRXESLO-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO CCC[N@H+](CCNC(=O)Cc1nc[nH]c1C)CC1CCC(C)CC1 ZINC001420617164 1377335265 /nfs/dbraw/zinc/33/52/65/1377335265.db2.gz BWLSDBPNIKLIMY-UHFFFAOYSA-N 1 3 334.508 2.915 10 0 EFAEHO CCC[N@@H+](CCNC(=O)Cc1nc[nH]c1C)CC1CCC(C)CC1 ZINC001420617164 1377335269 /nfs/dbraw/zinc/33/52/69/1377335269.db2.gz BWLSDBPNIKLIMY-UHFFFAOYSA-N 1 3 334.508 2.915 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C[N@H+](C)CC[C@H]1CCCC1(F)F ZINC001420661833 1377445988 /nfs/dbraw/zinc/44/59/88/1377445988.db2.gz KVAXVRMUQJRDSJ-GXTWGEPZSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC001420661833 1377445990 /nfs/dbraw/zinc/44/59/90/1377445990.db2.gz KVAXVRMUQJRDSJ-GXTWGEPZSA-N 1 3 342.434 2.523 10 0 EFAEHO CC[NH+](CC)CC[C@H](NC(=O)CN1CC[C@H](C)C1)c1ccccc1 ZINC001420662353 1377447743 /nfs/dbraw/zinc/44/77/43/1377447743.db2.gz MWHIFLJMYYOOSP-HKUYNNGSSA-N 1 3 331.504 2.918 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@H+](C)Cc1ccc(C)cc1 ZINC001420673002 1377478470 /nfs/dbraw/zinc/47/84/70/1377478470.db2.gz GKPPKOBBOUGJHF-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc(C)cc1 ZINC001420673002 1377478479 /nfs/dbraw/zinc/47/84/79/1377478479.db2.gz GKPPKOBBOUGJHF-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@@H](CNCc1ccccc1F)C1CC1 ZINC001420738177 1377586390 /nfs/dbraw/zinc/58/63/90/1377586390.db2.gz NFVHFKWMGFLYJN-OALUTQOASA-N 1 3 347.478 2.685 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H](CNCc1ccccc1F)C1CC1 ZINC001420738177 1377586391 /nfs/dbraw/zinc/58/63/91/1377586391.db2.gz NFVHFKWMGFLYJN-OALUTQOASA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001420766541 1377624717 /nfs/dbraw/zinc/62/47/17/1377624717.db2.gz ARJPOJQVHZTJHN-MOPGFXCFSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H](C)[NH2+]Cc2ccccc2F)CC1 ZINC001420773296 1377640011 /nfs/dbraw/zinc/64/00/11/1377640011.db2.gz VYZAODQDYKWWDJ-INIZCTEOSA-N 1 3 349.494 2.883 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1ccc(C)cc1C)C1CC1)N(C)C ZINC001420786798 1377667628 /nfs/dbraw/zinc/66/76/28/1377667628.db2.gz PKKTYKUMPXNGOX-RTBURBONSA-N 1 3 331.504 2.628 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCCN1C(C)C)[C@H]1CC[N@H+](CC2CCC2)C1 ZINC001420808102 1377698182 /nfs/dbraw/zinc/69/81/82/1377698182.db2.gz VDVNNJHDBOVIOJ-OALUTQOASA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCCN1C(C)C)[C@H]1CC[N@@H+](CC2CCC2)C1 ZINC001420808102 1377698185 /nfs/dbraw/zinc/69/81/85/1377698185.db2.gz VDVNNJHDBOVIOJ-OALUTQOASA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CCC2(CC2)CC1 ZINC001438334963 1388514854 /nfs/dbraw/zinc/51/48/54/1388514854.db2.gz OQFYEAQHGJZBPE-SJLPKXTDSA-N 1 3 335.536 2.783 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NCC[C@H]2CCN(C/C=C\Cl)C2)C1 ZINC001420890168 1377845071 /nfs/dbraw/zinc/84/50/71/1377845071.db2.gz YWGBAXHGISNGLC-IYZIGIFBSA-N 1 3 341.927 2.689 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NCC[C@H]2CCN(C/C=C\Cl)C2)C1 ZINC001420890168 1377845075 /nfs/dbraw/zinc/84/50/75/1377845075.db2.gz YWGBAXHGISNGLC-IYZIGIFBSA-N 1 3 341.927 2.689 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2ccc(CF)cc2)C1)N(C)C ZINC001420895168 1377852974 /nfs/dbraw/zinc/85/29/74/1377852974.db2.gz SGAJSPXEONQKCX-RTBURBONSA-N 1 3 349.494 2.825 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2ccc(CF)cc2)C1)N(C)C ZINC001420895168 1377852975 /nfs/dbraw/zinc/85/29/75/1377852975.db2.gz SGAJSPXEONQKCX-RTBURBONSA-N 1 3 349.494 2.825 10 0 EFAEHO C[N@H+](CCC1CCCCC1)C[C@@H]1CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001420932344 1377900927 /nfs/dbraw/zinc/90/09/27/1377900927.db2.gz OKWGNWQPKPGNFW-KRWDZBQOSA-N 1 3 332.492 2.703 10 0 EFAEHO C[N@@H+](CCC1CCCCC1)C[C@@H]1CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001420932344 1377900930 /nfs/dbraw/zinc/90/09/30/1377900930.db2.gz OKWGNWQPKPGNFW-KRWDZBQOSA-N 1 3 332.492 2.703 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](CN(C)C/C=C\Cl)C1)[NH+](CC)CC ZINC001420939608 1377913644 /nfs/dbraw/zinc/91/36/44/1377913644.db2.gz HPHUKIIGXDOGDD-JIHRLENESA-N 1 3 329.916 2.640 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](C[N@H+](C)CCC3CCCC3)C2)C1 ZINC001420943168 1377917709 /nfs/dbraw/zinc/91/77/09/1377917709.db2.gz LGGWRMACFYUCRU-PKOBYXMFSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](C[N@@H+](C)CCC3CCCC3)C2)C1 ZINC001420943168 1377917711 /nfs/dbraw/zinc/91/77/11/1377917711.db2.gz LGGWRMACFYUCRU-PKOBYXMFSA-N 1 3 335.536 2.689 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]Cc1cnccc1C ZINC001438344113 1388522388 /nfs/dbraw/zinc/52/23/88/1388522388.db2.gz ORDYAAJKRXZPKR-OALUTQOASA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1cccc(C[N@@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001420950322 1377928630 /nfs/dbraw/zinc/92/86/30/1377928630.db2.gz NKWXKAIBDBJVBU-LJQANCHMSA-N 1 3 331.504 2.616 10 0 EFAEHO Cc1cccc(C[N@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001420950322 1377928634 /nfs/dbraw/zinc/92/86/34/1377928634.db2.gz NKWXKAIBDBJVBU-LJQANCHMSA-N 1 3 331.504 2.616 10 0 EFAEHO CCc1ccc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@@H]3C)CC2)cc1 ZINC001421004203 1378007426 /nfs/dbraw/zinc/00/74/26/1378007426.db2.gz IPQPPPNNIJHURA-CALCHBBNSA-N 1 3 343.515 2.860 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(CC[N@H+](Cc3ccc(F)cc3)C2)C1 ZINC001421037560 1378054669 /nfs/dbraw/zinc/05/46/69/1378054669.db2.gz IYPGMLMSKNMTPN-HXUWFJFHSA-N 1 3 347.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(CC[N@@H+](Cc3ccc(F)cc3)C2)C1 ZINC001421037560 1378054671 /nfs/dbraw/zinc/05/46/71/1378054671.db2.gz IYPGMLMSKNMTPN-HXUWFJFHSA-N 1 3 347.478 2.590 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@]2(CCN(C(=O)[C@H](C(C)C)N(C)C)C2)C1 ZINC001421040752 1378058029 /nfs/dbraw/zinc/05/80/29/1378058029.db2.gz SWBZGQUACFWJGG-AZUAARDMSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@]2(CCN(C(=O)[C@H](C(C)C)N(C)C)C2)C1 ZINC001421040752 1378058030 /nfs/dbraw/zinc/05/80/30/1378058030.db2.gz SWBZGQUACFWJGG-AZUAARDMSA-N 1 3 337.552 2.933 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@]3(CCN(C(=O)CN(C)C(C)C)C3)C2)cc1 ZINC001421040745 1378058316 /nfs/dbraw/zinc/05/83/16/1378058316.db2.gz STJJHKGYJCBSJX-NRFANRHFSA-N 1 3 343.515 2.760 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@]3(CCN(C(=O)CN(C)C(C)C)C3)C2)cc1 ZINC001421040745 1378058320 /nfs/dbraw/zinc/05/83/20/1378058320.db2.gz STJJHKGYJCBSJX-NRFANRHFSA-N 1 3 343.515 2.760 10 0 EFAEHO C[C@H](c1ccccc1F)N1CC[C@]2(CCN(C(=O)CC[NH+](C)C)C2)C1 ZINC001421041248 1378059596 /nfs/dbraw/zinc/05/95/96/1378059596.db2.gz UTTNRHQDJYOWKJ-UZLBHIALSA-N 1 3 347.478 2.763 10 0 EFAEHO C[C@@H](c1ccccc1F)N1CC[C@@]2(CCN(C(=O)CC[NH+](C)C)C2)C1 ZINC001421041243 1378059690 /nfs/dbraw/zinc/05/96/90/1378059690.db2.gz UTTNRHQDJYOWKJ-OXJNMPFZSA-N 1 3 347.478 2.763 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@@H]1CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001421140933 1378175616 /nfs/dbraw/zinc/17/56/16/1378175616.db2.gz RIRUXSWNGVABIW-ROUUACIJSA-N 1 3 335.467 2.691 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N[C@@]2(C)CCN(Cc3ccc(CF)cc3)C2)C1 ZINC001421222722 1378303639 /nfs/dbraw/zinc/30/36/39/1378303639.db2.gz MZIBBKWJFHQIBW-QUCCMNQESA-N 1 3 347.478 2.579 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N[C@@]2(C)CCN(Cc3ccc(CF)cc3)C2)C1 ZINC001421222722 1378303643 /nfs/dbraw/zinc/30/36/43/1378303643.db2.gz MZIBBKWJFHQIBW-QUCCMNQESA-N 1 3 347.478 2.579 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@]2(C)CCN(C(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001421257600 1378360849 /nfs/dbraw/zinc/36/08/49/1378360849.db2.gz PYUMXEDSPGJHAW-GHTZIAJQSA-N 1 3 343.515 2.665 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CCN(Cc2ccccc2C)C1)[NH+](CC)CC ZINC001421276458 1378400036 /nfs/dbraw/zinc/40/00/36/1378400036.db2.gz PYHQZLDOFOIZTB-MOPGFXCFSA-N 1 3 331.504 2.806 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CCN(CCc2ccccc2)C1)[NH+](CC)CC ZINC001421277099 1378401739 /nfs/dbraw/zinc/40/17/39/1378401739.db2.gz ZPPWKKWECROFKL-MOPGFXCFSA-N 1 3 331.504 2.540 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[N@H+](CCCC(C)C)CCC1(F)F)N(C)C ZINC001421332551 1378508584 /nfs/dbraw/zinc/50/85/84/1378508584.db2.gz HMRXJQYRNBFUSY-JKSUJKDBSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[N@@H+](CCCC(C)C)CCC1(F)F)N(C)C ZINC001421332551 1378508586 /nfs/dbraw/zinc/50/85/86/1378508586.db2.gz HMRXJQYRNBFUSY-JKSUJKDBSA-N 1 3 347.494 2.836 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@H+](CC2CC(C)(C)C2)C1 ZINC001421355987 1378537025 /nfs/dbraw/zinc/53/70/25/1378537025.db2.gz UPLVIIWPDKNTKS-AEFFLSMTSA-N 1 3 335.536 2.687 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001421355987 1378537031 /nfs/dbraw/zinc/53/70/31/1378537031.db2.gz UPLVIIWPDKNTKS-AEFFLSMTSA-N 1 3 335.536 2.687 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1ccccc1C ZINC001421402634 1378584172 /nfs/dbraw/zinc/58/41/72/1378584172.db2.gz IZQWAWIQJXWQLL-MOPGFXCFSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]CCc1ccccc1 ZINC001421459038 1378646402 /nfs/dbraw/zinc/64/64/02/1378646402.db2.gz WOUCUANGICZNNU-PMACEKPBSA-N 1 3 345.531 2.976 10 0 EFAEHO CC[C@@H](CNC(=O)C12CC[NH+](CC1)C2)NCc1cc2ccccc2o1 ZINC001421471522 1378661586 /nfs/dbraw/zinc/66/15/86/1378661586.db2.gz RDVCPFNVIGRVRU-INIZCTEOSA-N 1 3 341.455 2.513 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCc1cccs1)C2 ZINC001421514564 1378726134 /nfs/dbraw/zinc/72/61/34/1378726134.db2.gz INNKGWRPQHGDJT-BBWFWOEESA-N 1 3 349.544 2.600 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCc1cccs1)C2 ZINC001421514564 1378726137 /nfs/dbraw/zinc/72/61/37/1378726137.db2.gz INNKGWRPQHGDJT-BBWFWOEESA-N 1 3 349.544 2.600 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccc(F)cc1)C2 ZINC001421517912 1378732901 /nfs/dbraw/zinc/73/29/01/1378732901.db2.gz UFTLTSUEYBPIPD-UHOSZYNNSA-N 1 3 347.478 2.637 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccc(F)cc1)C2 ZINC001421517912 1378732903 /nfs/dbraw/zinc/73/29/03/1378732903.db2.gz UFTLTSUEYBPIPD-UHOSZYNNSA-N 1 3 347.478 2.637 10 0 EFAEHO CC(C)[NH2+]CCN(Cc1ccccc1)C(=O)CN1[C@H](C)CC[C@H]1C ZINC001421567351 1378822328 /nfs/dbraw/zinc/82/23/28/1378822328.db2.gz WXVIFZVBPNLGQW-QZTJIDSGSA-N 1 3 331.504 2.886 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@](C)(C[NH2+]Cc1ccc(F)cc1)C1CC1 ZINC001421576300 1378837249 /nfs/dbraw/zinc/83/72/49/1378837249.db2.gz ZVTKIXKFQCLHJT-LJQANCHMSA-N 1 3 335.467 2.540 10 0 EFAEHO Cc1cc(CN2CC[C@H]3[C@H]2CCCN3C(=O)CCC[NH+](C)C)cs1 ZINC001421629022 1378907616 /nfs/dbraw/zinc/90/76/16/1378907616.db2.gz CQSIUUBMGJWNSE-MSOLQXFVSA-N 1 3 349.544 2.964 10 0 EFAEHO Cc1cc(CN2CC[C@H]3[C@H]2CCCN3C(=O)CC[NH+](C)C)cs1 ZINC001421633928 1378918083 /nfs/dbraw/zinc/91/80/83/1378918083.db2.gz KMPZINPSNDLDCE-SJORKVTESA-N 1 3 335.517 2.574 10 0 EFAEHO CC(C)C[N@H+](C)Cc1ccccc1CNC(=O)[C@@H](C(C)C)N(C)C ZINC001421654233 1378953991 /nfs/dbraw/zinc/95/39/91/1378953991.db2.gz IXGCJFKIJKVXPG-LJQANCHMSA-N 1 3 333.520 2.977 10 0 EFAEHO CC(C)C[N@@H+](C)Cc1ccccc1CNC(=O)[C@@H](C(C)C)N(C)C ZINC001421654233 1378953992 /nfs/dbraw/zinc/95/39/92/1378953992.db2.gz IXGCJFKIJKVXPG-LJQANCHMSA-N 1 3 333.520 2.977 10 0 EFAEHO Cc1ccccc1C[NH+]1CCC2(CN(C(=O)CN(C)C(C)C)C2)CC1 ZINC001421682169 1378988334 /nfs/dbraw/zinc/98/83/34/1378988334.db2.gz MZUSQIJULGGWDY-UHFFFAOYSA-N 1 3 343.515 2.760 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]Cc1ccccc1F ZINC001421718681 1379032010 /nfs/dbraw/zinc/03/20/10/1379032010.db2.gz JKLGQFSSAMUVJB-HNNXBMFYSA-N 1 3 335.467 2.542 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@@H](C)CNC(=O)C(C)(C)N2CCCC2)c1 ZINC001421720951 1379035170 /nfs/dbraw/zinc/03/51/70/1379035170.db2.gz QPDKMFWERVANPP-QGZVFWFLSA-N 1 3 345.531 2.965 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]CCc2ccccc2)CCC1)N1CCCC1 ZINC001421757867 1379087511 /nfs/dbraw/zinc/08/75/11/1379087511.db2.gz OENOKQFVQFYDFM-UHFFFAOYSA-N 1 3 343.515 2.732 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+][C@H](C)c1c(F)cccc1F ZINC001421767948 1379106872 /nfs/dbraw/zinc/10/68/72/1379106872.db2.gz KFSPJYOFLQDQMA-UONOGXRCSA-N 1 3 341.446 2.708 10 0 EFAEHO CC[C@H](C)C[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CCC1 ZINC001421768968 1379108173 /nfs/dbraw/zinc/10/81/73/1379108173.db2.gz YGDNIZSMZXLKPC-KXBFYZLASA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](Cc2ccc(OC)cc2)CC1)N(C)C ZINC001421815173 1379166183 /nfs/dbraw/zinc/16/61/83/1379166183.db2.gz AJTQYTNZCPXKPJ-IEBWSBKVSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2ccc(OC)cc2)CC1)N(C)C ZINC001421815173 1379166185 /nfs/dbraw/zinc/16/61/85/1379166185.db2.gz AJTQYTNZCPXKPJ-IEBWSBKVSA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1ccc(F)c(CN2CCC[C@@H](NC(=O)CC[NH+](C)C)CC2)c1 ZINC001421821066 1379178760 /nfs/dbraw/zinc/17/87/60/1379178760.db2.gz GPJKKPWYDGZNGB-QGZVFWFLSA-N 1 3 335.467 2.557 10 0 EFAEHO COc1ccc(C[N@@H+]2CCC[C@@H](NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001421835463 1379206629 /nfs/dbraw/zinc/20/66/29/1379206629.db2.gz QXSHYHPKCXIDNK-GOSISDBHSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1ccc(C[N@H+]2CCC[C@@H](NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001421835463 1379206637 /nfs/dbraw/zinc/20/66/37/1379206637.db2.gz QXSHYHPKCXIDNK-GOSISDBHSA-N 1 3 347.503 2.506 10 0 EFAEHO OC[C@H]1[C@@H]2C[N@H+](CCCN3CCC(Cc4ccccc4)CC3)C[C@H]12 ZINC001421851761 1379239398 /nfs/dbraw/zinc/23/93/98/1379239398.db2.gz JBLSTFRIWFSHDO-AERCQKQUSA-N 1 3 328.500 2.501 10 0 EFAEHO OC[C@H]1[C@@H]2C[N@@H+](CCCN3CCC(Cc4ccccc4)CC3)C[C@H]12 ZINC001421851761 1379239406 /nfs/dbraw/zinc/23/94/06/1379239406.db2.gz JBLSTFRIWFSHDO-AERCQKQUSA-N 1 3 328.500 2.501 10 0 EFAEHO Cc1cc(CN(C)CCCN(C)C(=O)[C@@H]2C[NH+]3CCC2CC3)cs1 ZINC001421864755 1379264492 /nfs/dbraw/zinc/26/44/92/1379264492.db2.gz LETHVGNVFWWCJJ-GOSISDBHSA-N 1 3 349.544 2.679 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@H+](C)Cc1ccc(F)c(F)c1)N(C)C ZINC001421893416 1379314261 /nfs/dbraw/zinc/31/42/61/1379314261.db2.gz QQIRPCIAMQPCJT-QGZVFWFLSA-N 1 3 341.446 2.585 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@@H+](C)Cc1ccc(F)c(F)c1)N(C)C ZINC001421893416 1379314264 /nfs/dbraw/zinc/31/42/64/1379314264.db2.gz QQIRPCIAMQPCJT-QGZVFWFLSA-N 1 3 341.446 2.585 10 0 EFAEHO CCC1([NH2+]Cc2ccc(C)cc2)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001421940095 1379381591 /nfs/dbraw/zinc/38/15/91/1379381591.db2.gz OUIYLZRFGDISQF-IBGZPJMESA-N 1 3 343.515 2.950 10 0 EFAEHO CCC1([NH2+]Cc2ccc(F)cc2)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001421944809 1379388033 /nfs/dbraw/zinc/38/80/33/1379388033.db2.gz XFAOXLUYKZPDAJ-SFHVURJKSA-N 1 3 347.478 2.781 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@]2(CCN(CCC(F)(F)F)C2)C1 ZINC001421953953 1379402410 /nfs/dbraw/zinc/40/24/10/1379402410.db2.gz FURLYHZXQBIJMJ-MRXNPFEDSA-N 1 3 349.441 2.595 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@]2(CCN(CCC(F)(F)F)C2)C1 ZINC001421953953 1379402412 /nfs/dbraw/zinc/40/24/12/1379402412.db2.gz FURLYHZXQBIJMJ-MRXNPFEDSA-N 1 3 349.441 2.595 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC001421985346 1379440970 /nfs/dbraw/zinc/44/09/70/1379440970.db2.gz NULKOOGZOBOBDW-KGLIPLIRSA-N 1 3 341.446 2.803 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)CCC[NH+]2CCCC2)c1 ZINC001421989527 1379445494 /nfs/dbraw/zinc/44/54/94/1379445494.db2.gz SZCDPWRQYJVSAP-KRWDZBQOSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[C@@H](F)CNCc1ccc(CNC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)cc1 ZINC001438447375 1388609888 /nfs/dbraw/zinc/60/98/88/1388609888.db2.gz MFDMUWATWQHXQY-CEXWTWQISA-N 1 3 349.494 2.871 10 0 EFAEHO CC[C@@H](F)CNCc1ccc(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)cc1 ZINC001438447375 1388609890 /nfs/dbraw/zinc/60/98/90/1388609890.db2.gz MFDMUWATWQHXQY-CEXWTWQISA-N 1 3 349.494 2.871 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001422028675 1379511965 /nfs/dbraw/zinc/51/19/65/1379511965.db2.gz LWOQACALXDGMDX-LPHOPBHVSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NCCC1CCN(C/C=C/Cl)CC1 ZINC001438451841 1388615289 /nfs/dbraw/zinc/61/52/89/1388615289.db2.gz KQLDVQFLBRZGST-LTWVYSQDSA-N 1 3 341.927 2.830 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H]([NH2+]CCC(C)(C)C)[C@@H](C)C2)CC1 ZINC001422037415 1379522972 /nfs/dbraw/zinc/52/29/72/1379522972.db2.gz ZWCWXZBAIFKSCX-ROUUACIJSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCCC1CCN(C/C=C/Cl)CC1 ZINC001438451841 1388615294 /nfs/dbraw/zinc/61/52/94/1388615294.db2.gz KQLDVQFLBRZGST-LTWVYSQDSA-N 1 3 341.927 2.830 10 0 EFAEHO CN(CC(=O)N1CCC(C)([NH2+]Cc2cccnc2)CC1)CC(C)(C)C ZINC001422057207 1379553050 /nfs/dbraw/zinc/55/30/50/1379553050.db2.gz QRHJIJSAVIDHOF-UHFFFAOYSA-N 1 3 346.519 2.530 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@@H]2CCC[C@@H]([NH+](C)C)C2)CC1 ZINC001422059733 1379554771 /nfs/dbraw/zinc/55/47/71/1379554771.db2.gz DKGXZAXFISXBMY-QZTJIDSGSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001422080258 1379583071 /nfs/dbraw/zinc/58/30/71/1379583071.db2.gz KFPJGJROEBVBAF-IAGOWNOFSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001422080258 1379583080 /nfs/dbraw/zinc/58/30/80/1379583080.db2.gz KFPJGJROEBVBAF-IAGOWNOFSA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1cc(F)ccc1CN1CC[C@@H](NC(=O)CC[NH+](C)C)C[C@H]1C ZINC001422117288 1379635224 /nfs/dbraw/zinc/63/52/24/1379635224.db2.gz BWJJFEBEAVLFOC-CRAIPNDOSA-N 1 3 335.467 2.555 10 0 EFAEHO C[NH+]1CCC2(CCN([C@H]3CCCN(c4ccccc4)C3=O)CC2)CC1 ZINC001422143441 1379679799 /nfs/dbraw/zinc/67/97/99/1379679799.db2.gz MUOVLYASBQRVAM-IBGZPJMESA-N 1 3 341.499 2.990 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@H](C)[NH2+][C@@H]1CCc2ccccc21)N(C)C ZINC001422146726 1379684017 /nfs/dbraw/zinc/68/40/17/1379684017.db2.gz GRPRIQZAQDFRCF-IPELMVKDSA-N 1 3 331.504 2.745 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CCNC(=O)CN(C)C(C)C)c(Cl)c1 ZINC001422171955 1379720949 /nfs/dbraw/zinc/72/09/49/1379720949.db2.gz DBCDXRWJRBTNBV-HNNXBMFYSA-N 1 3 339.911 2.973 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)CCN(C)C(=O)[C@H]2CCCCN2C)c1 ZINC001422176262 1379728983 /nfs/dbraw/zinc/72/89/83/1379728983.db2.gz ROPKOGSJKHXKQX-QFBILLFUSA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)CCN(C)C(=O)[C@H]2CCCCN2C)c1 ZINC001422176262 1379728986 /nfs/dbraw/zinc/72/89/86/1379728986.db2.gz ROPKOGSJKHXKQX-QFBILLFUSA-N 1 3 347.503 2.631 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]Cc1ccc(Cl)s1 ZINC001438469555 1388629257 /nfs/dbraw/zinc/62/92/57/1388629257.db2.gz KUKJATXFTGXLAB-CYBMUJFWSA-N 1 3 343.924 2.822 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CC[N@H+](C)C1)Cc1cc2ccccc2s1 ZINC001422237824 1379835022 /nfs/dbraw/zinc/83/50/22/1379835022.db2.gz ONJRADXXPSBBJM-MRXNPFEDSA-N 1 3 345.512 2.743 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CC[N@@H+](C)C1)Cc1cc2ccccc2s1 ZINC001422237824 1379835026 /nfs/dbraw/zinc/83/50/26/1379835026.db2.gz ONJRADXXPSBBJM-MRXNPFEDSA-N 1 3 345.512 2.743 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H]2C[N@H+](C)CCc2cccs2)C1 ZINC001422241234 1379841940 /nfs/dbraw/zinc/84/19/40/1379841940.db2.gz DJEKQWWFCNEBPP-IRXDYDNUSA-N 1 3 349.544 2.555 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H]2C[N@@H+](C)CCc2cccs2)C1 ZINC001422241234 1379841942 /nfs/dbraw/zinc/84/19/42/1379841942.db2.gz DJEKQWWFCNEBPP-IRXDYDNUSA-N 1 3 349.544 2.555 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]Cc2cc3ccccc3o2)C1 ZINC001422298670 1379906890 /nfs/dbraw/zinc/90/68/90/1379906890.db2.gz XVLWSBNWBYILKJ-UHFFFAOYSA-N 1 3 343.471 2.759 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H](C)CNC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001438481746 1388635455 /nfs/dbraw/zinc/63/54/55/1388635455.db2.gz LBEOMFHWKQRLJW-VQIMIIECSA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001422315259 1379924158 /nfs/dbraw/zinc/92/41/58/1379924158.db2.gz CKHDPUORFPZADT-GJZGRUSLSA-N 1 3 343.471 2.900 10 0 EFAEHO C[C@@H]([NH2+]Cc1cc2ccccc2o1)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001422315250 1379924458 /nfs/dbraw/zinc/92/44/58/1379924458.db2.gz CKHDPUORFPZADT-CABCVRRESA-N 1 3 343.471 2.900 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001422325879 1379933124 /nfs/dbraw/zinc/93/31/24/1379933124.db2.gz NKFKRVPWQOZWHO-JKSUJKDBSA-N 1 3 331.504 2.716 10 0 EFAEHO CC(C)c1cccc(CN[C@@H](C)[C@@H](C)NC(=O)C2CC[NH+](C)CC2)n1 ZINC001422397887 1380037039 /nfs/dbraw/zinc/03/70/39/1380037039.db2.gz YPNGIVQETRBXNX-JKSUJKDBSA-N 1 3 346.519 2.530 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001422416208 1380059985 /nfs/dbraw/zinc/05/99/85/1380059985.db2.gz MJDGAXLYTKCDNK-ZIAGYGMSSA-N 1 3 325.884 2.665 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001422416196 1380060346 /nfs/dbraw/zinc/06/03/46/1380060346.db2.gz MJDGAXLYTKCDNK-KBPBESRZSA-N 1 3 325.884 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001422451810 1380120396 /nfs/dbraw/zinc/12/03/96/1380120396.db2.gz NXABTKDCIORCLG-HOTGVXAUSA-N 1 3 331.504 2.887 10 0 EFAEHO CCN(CC[NH2+][C@H](C)c1ccc2c(c1)CCC2)C(=O)CN1CCCC1 ZINC001422455954 1380131791 /nfs/dbraw/zinc/13/17/91/1380131791.db2.gz FHQQQEZMFIHTGH-QGZVFWFLSA-N 1 3 343.515 2.770 10 0 EFAEHO CCN(CCN[C@@H](C)c1ccccc1Cl)C(=O)CC[NH+](C)C ZINC001422457843 1380135364 /nfs/dbraw/zinc/13/53/64/1380135364.db2.gz GPRYKUXCKKICEM-AWEZNQCLSA-N 1 3 325.884 2.791 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[N@H+](C)CCc1ccccc1 ZINC001422518899 1380242330 /nfs/dbraw/zinc/24/23/30/1380242330.db2.gz NZDMCRCCIWPNHD-IEBWSBKVSA-N 1 3 331.504 2.540 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[N@@H+](C)CCc1ccccc1 ZINC001422518899 1380242332 /nfs/dbraw/zinc/24/23/32/1380242332.db2.gz NZDMCRCCIWPNHD-IEBWSBKVSA-N 1 3 331.504 2.540 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1C ZINC001422520204 1380244652 /nfs/dbraw/zinc/24/46/52/1380244652.db2.gz PYRJMZJKSLAYDH-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1C ZINC001422520204 1380244653 /nfs/dbraw/zinc/24/46/53/1380244653.db2.gz PYRJMZJKSLAYDH-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CCC2)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001422550142 1380302261 /nfs/dbraw/zinc/30/22/61/1380302261.db2.gz PPLBJUGBPXLRNJ-DLBZAZTESA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[N@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001422550143 1380302346 /nfs/dbraw/zinc/30/23/46/1380302346.db2.gz YBRHUHXYQUOMMR-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001422550143 1380302347 /nfs/dbraw/zinc/30/23/47/1380302347.db2.gz YBRHUHXYQUOMMR-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C(=O)NC[C@H](C)[N@H+](C)CCc1ccccc1)N1CCCCCC1 ZINC001422572063 1380346137 /nfs/dbraw/zinc/34/61/37/1380346137.db2.gz GRXSRNQDNHKBNN-RBUKOAKNSA-N 1 3 345.531 2.930 10 0 EFAEHO C[C@H](C(=O)NC[C@H](C)[N@@H+](C)CCc1ccccc1)N1CCCCCC1 ZINC001422572063 1380346138 /nfs/dbraw/zinc/34/61/38/1380346138.db2.gz GRXSRNQDNHKBNN-RBUKOAKNSA-N 1 3 345.531 2.930 10 0 EFAEHO C[C@@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)N(C)Cc1ccc(Cl)cc1 ZINC001422581311 1380363273 /nfs/dbraw/zinc/36/32/73/1380363273.db2.gz SWGNQALIOXXZLK-HOCLYGCPSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(Cl)cc1 ZINC001422581311 1380363274 /nfs/dbraw/zinc/36/32/74/1380363274.db2.gz SWGNQALIOXXZLK-HOCLYGCPSA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@H](C(C)C)N(C)C)cc1 ZINC001422584897 1380368727 /nfs/dbraw/zinc/36/87/27/1380368727.db2.gz IZPOXJOWAAIHLF-APWZRJJASA-N 1 3 333.520 2.991 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)C[NH2+][C@H](C)c1cc(C)ccc1C ZINC001438539039 1388662844 /nfs/dbraw/zinc/66/28/44/1388662844.db2.gz AUFQRTILHUGQLY-GOEBONIOSA-N 1 3 342.487 2.981 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CC1CCC2(CC2)CC1 ZINC001422645515 1380478531 /nfs/dbraw/zinc/47/85/31/1380478531.db2.gz HITKVVFZRCNXTC-FUHWJXTLSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001422743969 1380745434 /nfs/dbraw/zinc/74/54/34/1380745434.db2.gz UKXNJCKXKYXIFQ-CRAIPNDOSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1CN(Cc2ccccc2)C1)[NH+](CC)CC ZINC001422752261 1380758089 /nfs/dbraw/zinc/75/80/89/1380758089.db2.gz OFSGGXRIVNAHAN-VQIMIIECSA-N 1 3 331.504 2.744 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CC1CCC(F)(F)CC1 ZINC001422759858 1380767608 /nfs/dbraw/zinc/76/76/08/1380767608.db2.gz MINRKCLDGDDINC-GOEBONIOSA-N 1 3 345.478 2.781 10 0 EFAEHO CCc1cccc(CN2C[C@H](NC(=O)CCC[NH+](C)C)C(C)(C)C2)c1 ZINC001422781392 1380796096 /nfs/dbraw/zinc/79/60/96/1380796096.db2.gz AIOXLWBTOHWZRA-IBGZPJMESA-N 1 3 345.531 2.917 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CN(Cc2cccc(C)c2)CC1(C)C ZINC001422807374 1380837335 /nfs/dbraw/zinc/83/73/35/1380837335.db2.gz OPWIVTSVGFNSFE-SFHVURJKSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CN(Cc2cccc(C)c2)CC1(C)C ZINC001422807374 1380837340 /nfs/dbraw/zinc/83/73/40/1380837340.db2.gz OPWIVTSVGFNSFE-SFHVURJKSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3CCCCC3)C[C@H]21)N(C)C ZINC001422821905 1380859369 /nfs/dbraw/zinc/85/93/69/1380859369.db2.gz IVOWJDPUVYNHPJ-OKYOBFRVSA-N 1 3 335.536 2.591 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3CCCCC3)C[C@H]21)N(C)C ZINC001422821905 1380859377 /nfs/dbraw/zinc/85/93/77/1380859377.db2.gz IVOWJDPUVYNHPJ-OKYOBFRVSA-N 1 3 335.536 2.591 10 0 EFAEHO C[C@@H](C[N@H+](C)[C@H]1CCc2ccccc21)NC(=O)C1(N(C)C)CCC1 ZINC001422825111 1380863577 /nfs/dbraw/zinc/86/35/77/1380863577.db2.gz PUGUHRYGNNGUBH-YJBOKZPZSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@@H](C[N@@H+](C)[C@H]1CCc2ccccc21)NC(=O)C1(N(C)C)CCC1 ZINC001422825111 1380863582 /nfs/dbraw/zinc/86/35/82/1380863582.db2.gz PUGUHRYGNNGUBH-YJBOKZPZSA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1ccc(CCC[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001422879719 1380991935 /nfs/dbraw/zinc/99/19/35/1380991935.db2.gz RJNOENHEIQQPNT-OALUTQOASA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CCC[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001422879719 1380991941 /nfs/dbraw/zinc/99/19/41/1380991941.db2.gz RJNOENHEIQQPNT-OALUTQOASA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@H]([NH2+]C[C@H]1C[C@H](NC(=O)CN(C)C2CCC2)C1)c1cccc(F)c1 ZINC001422896844 1381021331 /nfs/dbraw/zinc/02/13/31/1381021331.db2.gz VJUBMGROZFTZIG-MPGHIAIKSA-N 1 3 347.478 2.855 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001422906234 1381034097 /nfs/dbraw/zinc/03/40/97/1381034097.db2.gz GRUKERRDTHGROD-WDSOQIARSA-N 1 3 331.504 2.566 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)CCc1ccc(C)cc1 ZINC001422917984 1381053135 /nfs/dbraw/zinc/05/31/35/1381053135.db2.gz NFLWYAJWHCUGLB-UYAOXDASSA-N 1 3 345.531 2.848 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)CCc1ccc(C)cc1 ZINC001422917984 1381053138 /nfs/dbraw/zinc/05/31/38/1381053138.db2.gz NFLWYAJWHCUGLB-UYAOXDASSA-N 1 3 345.531 2.848 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)C2CCN(C(=O)CN(C)C(C)C)CC2)cc1 ZINC001422950707 1381110938 /nfs/dbraw/zinc/11/09/38/1381110938.db2.gz WFVUSXFHYCVVOO-UHFFFAOYSA-N 1 3 345.531 2.801 10 0 EFAEHO Cc1ccc(CC[N@H+](C)C2CCN(C(=O)CN(C)C(C)C)CC2)cc1 ZINC001422950707 1381110947 /nfs/dbraw/zinc/11/09/47/1381110947.db2.gz WFVUSXFHYCVVOO-UHFFFAOYSA-N 1 3 345.531 2.801 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001423000801 1381186183 /nfs/dbraw/zinc/18/61/83/1381186183.db2.gz LJYJSXDJGAHQPH-RTBURBONSA-N 1 3 347.547 2.926 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C[NH2+]Cc1ccc(C)cc1)C1CC1 ZINC001423004468 1381192759 /nfs/dbraw/zinc/19/27/59/1381192759.db2.gz PVKBVSOSGMBCPE-PMACEKPBSA-N 1 3 343.515 2.854 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](NC(=O)[C@H](C(C)C)[NH+](C)C)C2CC2)c1 ZINC001423014580 1381210262 /nfs/dbraw/zinc/21/02/62/1381210262.db2.gz SMUCRTDQLMPFMA-OALUTQOASA-N 1 3 349.494 2.705 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+][C@H]1CCCc2ccccc21)C1CC1 ZINC001423059469 1381283208 /nfs/dbraw/zinc/28/32/08/1381283208.db2.gz MCEKJEJTEYBYBJ-VQTJNVASSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+][C@@H]1CCCc2ccccc21)C1CC1 ZINC001423059463 1381283433 /nfs/dbraw/zinc/28/34/33/1381283433.db2.gz MCEKJEJTEYBYBJ-UXHICEINSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@H](CN(C)C(=O)CN(C)C1CCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001423073950 1381305036 /nfs/dbraw/zinc/30/50/36/1381305036.db2.gz CVAIPUYFLWMABB-BEFAXECRSA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)CC2CC[NH+](C)CC2)c1 ZINC001423128605 1381399997 /nfs/dbraw/zinc/39/99/97/1381399997.db2.gz MHYMZTYKYJFKIZ-MRXNPFEDSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001423128672 1381401094 /nfs/dbraw/zinc/40/10/94/1381401094.db2.gz MERXQNYXPIQYEN-AEFFLSMTSA-N 1 3 331.504 2.582 10 0 EFAEHO CC(C)c1cccc(CN[C@@H](C)CN(C)C(=O)[C@@H](C(C)C)[NH+](C)C)n1 ZINC001423157253 1381463359 /nfs/dbraw/zinc/46/33/59/1381463359.db2.gz KBQAXBBPCSKDCX-QFBILLFUSA-N 1 3 348.535 2.728 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001438670885 1388728313 /nfs/dbraw/zinc/72/83/13/1388728313.db2.gz TUEQRMACIVZZMX-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001438670885 1388728317 /nfs/dbraw/zinc/72/83/17/1388728317.db2.gz TUEQRMACIVZZMX-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+][C@@H](C)c2ccc(F)cc2)CC1 ZINC001423232534 1381639678 /nfs/dbraw/zinc/63/96/78/1381639678.db2.gz TZIJVKNGRSNHGN-MAUKXSAKSA-N 1 3 347.478 3.000 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001438680055 1388735236 /nfs/dbraw/zinc/73/52/36/1388735236.db2.gz HXSDBAYRSLPJOG-CRAIPNDOSA-N 1 3 331.504 2.582 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001423245699 1381674735 /nfs/dbraw/zinc/67/47/35/1381674735.db2.gz PEFODGZOBHGFTP-ZWKOTPCHSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001423245699 1381674743 /nfs/dbraw/zinc/67/47/43/1381674743.db2.gz PEFODGZOBHGFTP-ZWKOTPCHSA-N 1 3 345.462 2.581 10 0 EFAEHO Cc1ccccc1C[NH2+]C1(CNC(=O)C(C)(C)N2CCCC2)CC1 ZINC001423252860 1381694862 /nfs/dbraw/zinc/69/48/62/1381694862.db2.gz UKBBOBSPGQRRSD-UHFFFAOYSA-N 1 3 329.488 2.608 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccsc1)C2 ZINC001423347984 1381823257 /nfs/dbraw/zinc/82/32/57/1381823257.db2.gz DJWBJDHXCPVCRB-SFHVURJKSA-N 1 3 335.517 2.514 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccsc1)C2 ZINC001423355114 1381834706 /nfs/dbraw/zinc/83/47/06/1381834706.db2.gz UTPDFYDOSFYZRU-IBGZPJMESA-N 1 3 349.544 2.904 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccsc1)C2 ZINC001423355114 1381834714 /nfs/dbraw/zinc/83/47/14/1381834714.db2.gz UTPDFYDOSFYZRU-IBGZPJMESA-N 1 3 349.544 2.904 10 0 EFAEHO Cc1ccc(CN[C@@H]2C[C@@H](C)N(C(=O)CC[NH+](C)C)C2)c(Cl)c1 ZINC001423357718 1381839613 /nfs/dbraw/zinc/83/96/13/1381839613.db2.gz QDQVWCBWBJWIJE-GDBMZVCRSA-N 1 3 337.895 2.679 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N1C[C@H]([NH2+]CCC(F)(F)F)C(C)(C)C1 ZINC001423398584 1381904539 /nfs/dbraw/zinc/90/45/39/1381904539.db2.gz RWMZBJWHIWGMRP-KGLIPLIRSA-N 1 3 349.441 2.638 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@H]1C[NH2+]Cc1ccsc1 ZINC001423456953 1381958496 /nfs/dbraw/zinc/95/84/96/1381958496.db2.gz WGPIBMJJQSGREB-JKSUJKDBSA-N 1 3 341.496 2.509 10 0 EFAEHO C[C@H](NC[C@@H]1CCCN1C(=O)CC[NH+](C)C)c1ccc(F)cc1F ZINC001423477086 1381972476 /nfs/dbraw/zinc/97/24/76/1381972476.db2.gz JYSJBCFAVAZEDJ-ZFWWWQNUSA-N 1 3 339.430 2.558 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC2(C)CC[NH+](CC3CC3)CC2)C1 ZINC001423503935 1381993520 /nfs/dbraw/zinc/99/35/20/1381993520.db2.gz ASVHJMPSZGPDDB-IBGZPJMESA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001423570332 1382088397 /nfs/dbraw/zinc/08/83/97/1382088397.db2.gz GCMZUEAUXBGEGN-SJORKVTESA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001423570332 1382088402 /nfs/dbraw/zinc/08/84/02/1382088402.db2.gz GCMZUEAUXBGEGN-SJORKVTESA-N 1 3 327.488 2.532 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H](CNCc1ccccc1Cl)C(C)(C)C ZINC001423614512 1382169705 /nfs/dbraw/zinc/16/97/05/1382169705.db2.gz DGGXIWLVMBPQQS-INIZCTEOSA-N 1 3 339.911 2.912 10 0 EFAEHO Cc1ccc(CN2CCC([C@@H](C)NC(=O)CC[NH+](C)C)CC2)cc1F ZINC001423654005 1382229890 /nfs/dbraw/zinc/22/98/90/1382229890.db2.gz VENDWNRTZLLNTK-MRXNPFEDSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(F)c(CN2CCC(C)(CNC(=O)CC[NH+](C)C)CC2)c1 ZINC001423677649 1382271450 /nfs/dbraw/zinc/27/14/50/1382271450.db2.gz MKOSEFQHMYWTRH-UHFFFAOYSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1cccnc1)C1CCCCC1)N(C)C ZINC001438747379 1388782951 /nfs/dbraw/zinc/78/29/51/1388782951.db2.gz NMUUOSQARYMQOI-RTBURBONSA-N 1 3 346.519 2.577 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCC1CC1)C2)CC(C)(C)C ZINC001423928965 1382509911 /nfs/dbraw/zinc/50/99/11/1382509911.db2.gz YOSPOAMBLUOYTI-BZSNNMDCSA-N 1 3 335.536 2.734 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCC1CC1)C2)CC(C)(C)C ZINC001423928965 1382509918 /nfs/dbraw/zinc/50/99/18/1382509918.db2.gz YOSPOAMBLUOYTI-BZSNNMDCSA-N 1 3 335.536 2.734 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)c(C)c1 ZINC001423947891 1382533756 /nfs/dbraw/zinc/53/37/56/1382533756.db2.gz LSFODAVDRDDWQS-QUCCMNQESA-N 1 3 345.531 2.828 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC(CC[N@H+](C)CC[C@H](C)F)CC1)N(C)C ZINC001438779150 1388808730 /nfs/dbraw/zinc/80/87/30/1388808730.db2.gz PYRZSUMWKSHHMX-FUHWJXTLSA-N 1 3 343.531 2.881 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC(CC[N@@H+](C)CC[C@H](C)F)CC1)N(C)C ZINC001438779150 1388808735 /nfs/dbraw/zinc/80/87/35/1388808735.db2.gz PYRZSUMWKSHHMX-FUHWJXTLSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[N@H+](C)CCC1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001438778533 1388807849 /nfs/dbraw/zinc/80/78/49/1388807849.db2.gz NFDDTDQDAOIPKL-IBGZPJMESA-N 1 3 341.515 2.779 10 0 EFAEHO CC[N@@H+](C)CCC1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001438778533 1388807855 /nfs/dbraw/zinc/80/78/55/1388807855.db2.gz NFDDTDQDAOIPKL-IBGZPJMESA-N 1 3 341.515 2.779 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCc1cccc2c1CC[N@@H+](CC(C)C)C2 ZINC001424122090 1382772852 /nfs/dbraw/zinc/77/28/52/1382772852.db2.gz GWLCPPPNHBETMP-UHFFFAOYSA-N 1 3 340.471 2.591 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCc1cccc2c1CC[N@H+](CC(C)C)C2 ZINC001424122090 1382772855 /nfs/dbraw/zinc/77/28/55/1382772855.db2.gz GWLCPPPNHBETMP-UHFFFAOYSA-N 1 3 340.471 2.591 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(CNC(=O)[C@@H](C)N2CCCCCC2)CCC1 ZINC001424194462 1382848852 /nfs/dbraw/zinc/84/88/52/1382848852.db2.gz AMUXREXWTSBEDK-CVEARBPZSA-N 1 3 327.488 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+][C@@H](C)c1cccc(Cl)c1 ZINC001439182938 1389036962 /nfs/dbraw/zinc/03/69/62/1389036962.db2.gz WQVYBBHOSFYCQB-KGLIPLIRSA-N 1 3 325.884 2.836 10 0 EFAEHO CCC1([NH2+]CCc2ccccc2)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001424358354 1382964980 /nfs/dbraw/zinc/96/49/80/1382964980.db2.gz LSDQECXRKCAPHZ-IBGZPJMESA-N 1 3 343.515 2.684 10 0 EFAEHO CCC1([NH2+]Cc2cccc(F)c2)CCN(C(=O)CN2CCCC2)CC1 ZINC001424383541 1382974716 /nfs/dbraw/zinc/97/47/16/1382974716.db2.gz PVXSHBRELDBMEU-UHFFFAOYSA-N 1 3 347.478 2.782 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@H+](CC2CC(C)(C)C2)CC1(C)C ZINC001424510584 1383061963 /nfs/dbraw/zinc/06/19/63/1383061963.db2.gz GTHSIWXHOATHLC-QGZVFWFLSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@@H+](CC2CC(C)(C)C2)CC1(C)C ZINC001424510584 1383061967 /nfs/dbraw/zinc/06/19/67/1383061967.db2.gz GTHSIWXHOATHLC-QGZVFWFLSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]Cc1ccc(Cl)cc1F ZINC001424624028 1383214016 /nfs/dbraw/zinc/21/40/16/1383214016.db2.gz CPJPIGLUIGNGAW-ZDUSSCGKSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@H+](C)C/C=C/c1ccccc1 ZINC001424697909 1383270197 /nfs/dbraw/zinc/27/01/97/1383270197.db2.gz KLGLQWUIWLAEGJ-GPVYEGESSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@@H+](C)C/C=C/c1ccccc1 ZINC001424697909 1383270200 /nfs/dbraw/zinc/27/02/00/1383270200.db2.gz KLGLQWUIWLAEGJ-GPVYEGESSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)CC[NH2+][C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001438825760 1388843102 /nfs/dbraw/zinc/84/31/02/1388843102.db2.gz FYFWYQFTGLZMMQ-APWZRJJASA-N 1 3 343.531 2.975 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCC1 ZINC001438825975 1388843281 /nfs/dbraw/zinc/84/32/81/1388843281.db2.gz GTCMGRMXHBIMCB-VQIMIIECSA-N 1 3 341.515 2.729 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@@H]2CCc3ccc(F)cc32)C1 ZINC001424758268 1383325387 /nfs/dbraw/zinc/32/53/87/1383325387.db2.gz ZLQTZJBIBCQXEP-ITXXBFQVSA-N 1 3 347.478 2.639 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)[C@@H](C)NC(=O)C23CCC[NH+]2CCC3)c1 ZINC001424786320 1383346113 /nfs/dbraw/zinc/34/61/13/1383346113.db2.gz KIZIXLPHAXLXRL-HZPDHXFCSA-N 1 3 347.478 2.745 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001424794525 1383351550 /nfs/dbraw/zinc/35/15/50/1383351550.db2.gz JRJWQXZNSKFGFQ-HZPDHXFCSA-N 1 3 331.504 2.716 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001424794513 1383351663 /nfs/dbraw/zinc/35/16/63/1383351663.db2.gz JRJWQXZNSKFGFQ-HOTGVXAUSA-N 1 3 331.504 2.716 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001424796315 1383353805 /nfs/dbraw/zinc/35/38/05/1383353805.db2.gz LCYKSWDIZRMZDB-IRXDYDNUSA-N 1 3 331.504 2.505 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1C ZINC001424803438 1383362978 /nfs/dbraw/zinc/36/29/78/1383362978.db2.gz RPUGXPDXGHEOPY-DLBZAZTESA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@@H](NC(=O)CN(C)CC(C)(C)C)[C@@H](C)[NH2+]Cc1cccc(F)c1 ZINC001424807513 1383368380 /nfs/dbraw/zinc/36/83/80/1383368380.db2.gz PEPDJOSIXLICNP-HUUCEWRRSA-N 1 3 337.483 2.786 10 0 EFAEHO C[C@@H](NCc1ccccc1F)[C@@H](C)NC(=O)CC[NH+]1CCCCC1 ZINC001424852422 1383419378 /nfs/dbraw/zinc/41/93/78/1383419378.db2.gz JCHTWSRXSQMXJX-HZPDHXFCSA-N 1 3 335.467 2.685 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1c(C)cccc1Cl ZINC001424855405 1383423854 /nfs/dbraw/zinc/42/38/54/1383423854.db2.gz WYOZVEADYTYSFT-GJZGRUSLSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@H](F)C[NH2+]CC(C)(C)CN(C)C(=O)[C@@H]1CCCN1C(C)C ZINC001424869176 1383443600 /nfs/dbraw/zinc/44/36/00/1383443600.db2.gz KRXNAHHZLCCWRN-HOTGVXAUSA-N 1 3 329.504 2.682 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@@H](C)C1)C1C[NH+](CC2CCC(C)(C)CC2)C1 ZINC001425246765 1383562559 /nfs/dbraw/zinc/56/25/59/1383562559.db2.gz OGRJBEKLIRYECE-IAGOWNOFSA-N 1 3 349.563 2.981 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@H+](C)CCN(C)C(=O)[C@@H]2CCCN2C)c1 ZINC001438862570 1388869293 /nfs/dbraw/zinc/86/92/93/1388869293.db2.gz GANBJICPABDQMO-MJGOQNOKSA-N 1 3 331.504 2.849 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@@H+](C)CCN(C)C(=O)[C@@H]2CCCN2C)c1 ZINC001438862570 1388869295 /nfs/dbraw/zinc/86/92/95/1388869295.db2.gz GANBJICPABDQMO-MJGOQNOKSA-N 1 3 331.504 2.849 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)[C@H](C[NH2+]CC2CC(C)(C)C2)C2CC2)C1 ZINC001425501166 1383672566 /nfs/dbraw/zinc/67/25/66/1383672566.db2.gz WAHQIGMPZROTAN-MAUKXSAKSA-N 1 3 335.536 2.591 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N(C)C[C@@H](C)NCc1cc(C)ccc1F ZINC001425557827 1383691116 /nfs/dbraw/zinc/69/11/16/1383691116.db2.gz LIKXMTBWYDWZNC-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N(C)C[C@@H](C)NCc1cc(C)ccc1F ZINC001425557827 1383691120 /nfs/dbraw/zinc/69/11/20/1383691120.db2.gz LIKXMTBWYDWZNC-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]Cc1cccc2cccnc21 ZINC001425702420 1383780084 /nfs/dbraw/zinc/78/00/84/1383780084.db2.gz UYSOTWFIAVOVBA-INIZCTEOSA-N 1 3 342.487 2.512 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CC3CC(C)(C)C3)[C@@H]2C1 ZINC001425913883 1383850738 /nfs/dbraw/zinc/85/07/38/1383850738.db2.gz FDPDHRKCGMVWDW-IPMKNSEASA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@H]1[C@@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)CCCN1CCCF ZINC001425919460 1383855915 /nfs/dbraw/zinc/85/59/15/1383855915.db2.gz AWKPIYCHIXKHKY-RDJZCZTQSA-N 1 3 341.515 2.968 10 0 EFAEHO C[C@H]1[C@@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)CCCN1CCCF ZINC001425919460 1383855916 /nfs/dbraw/zinc/85/59/16/1383855916.db2.gz AWKPIYCHIXKHKY-RDJZCZTQSA-N 1 3 341.515 2.968 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]Cc2cc(C)cc(C)c2)C(C)(C)C1 ZINC001425968479 1383907305 /nfs/dbraw/zinc/90/73/05/1383907305.db2.gz HBQJTQGHSSOGLH-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]C/C=C\c2ccccc2)C(C)(C)C1 ZINC001425979096 1383914443 /nfs/dbraw/zinc/91/44/43/1383914443.db2.gz UHWWUUNSWKRQJE-ADYPVZHUSA-N 1 3 343.515 2.867 10 0 EFAEHO CCc1ccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)cc1 ZINC001425982744 1383918382 /nfs/dbraw/zinc/91/83/82/1383918382.db2.gz YSCDUCDGPNNNRR-IBGZPJMESA-N 1 3 345.531 2.916 10 0 EFAEHO C[C@H](NC[C@@H](NC(=O)CC[NH+](C)C)C(C)(C)C)c1ccccc1F ZINC001426134488 1384016861 /nfs/dbraw/zinc/01/68/61/1384016861.db2.gz GEPFXJJVAZGCHW-WMLDXEAASA-N 1 3 337.483 2.959 10 0 EFAEHO CC(C)CCC[NH+]1CCC([C@H](C)NC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001426193697 1384059599 /nfs/dbraw/zinc/05/95/99/1384059599.db2.gz PKYRXYHHXULZLQ-MSOLQXFVSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1ccc(C[NH2+]CC2CCC2)cc1F ZINC001426250724 1384094442 /nfs/dbraw/zinc/09/44/42/1384094442.db2.gz DTSHSIBUQMNFMV-UHFFFAOYSA-N 1 3 335.467 2.672 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCc1ccc(C[NH2+]CC2CC2)cc1F ZINC001426251223 1384094580 /nfs/dbraw/zinc/09/45/80/1384094580.db2.gz FIOIBJIVAFKVDH-GASCZTMLSA-N 1 3 347.478 2.814 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC1(C2CCN(CCC(F)(F)F)CC2)CC1 ZINC001426261754 1384115494 /nfs/dbraw/zinc/11/54/94/1384115494.db2.gz KMSVRQXMMACJSU-UHFFFAOYSA-N 1 3 349.441 2.641 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC1(C2CCN(CCC(F)(F)F)CC2)CC1 ZINC001426261754 1384115530 /nfs/dbraw/zinc/11/55/30/1384115530.db2.gz KMSVRQXMMACJSU-UHFFFAOYSA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+][C@H](C)c1cc(F)ccc1F ZINC001439079294 1388983084 /nfs/dbraw/zinc/98/30/84/1388983084.db2.gz WORDIXKGNSBKQW-UONOGXRCSA-N 1 3 341.446 2.850 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@H]2CCC[N@@H+]2C(C)C)c1 ZINC001439109750 1388995995 /nfs/dbraw/zinc/99/59/95/1388995995.db2.gz IORSMBCUCWLUNE-CRAIPNDOSA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@H]2CCC[N@H+]2C(C)C)c1 ZINC001439109750 1388995998 /nfs/dbraw/zinc/99/59/98/1388995998.db2.gz IORSMBCUCWLUNE-CRAIPNDOSA-N 1 3 335.467 2.601 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1CN(CCc2ccccc2F)CC1(C)C ZINC001506749961 1406250881 /nfs/dbraw/zinc/25/08/81/1406250881.db2.gz WEBIJSVYOQKCHS-SFHVURJKSA-N 1 3 349.494 2.537 10 0 EFAEHO CC1(C)CN(Cc2ccccc2)C[C@@H]1NC(=O)CCC[NH+]1CCCC1 ZINC001506752516 1406256027 /nfs/dbraw/zinc/25/60/27/1406256027.db2.gz IYWNFRDRFJLQSW-IBGZPJMESA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3CCCCC3)C[C@H]21 ZINC001506827527 1406304431 /nfs/dbraw/zinc/30/44/31/1406304431.db2.gz BBDSCZSLCWNGAL-LDLYASANSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3CCCCC3)C[C@H]21 ZINC001506827527 1406304437 /nfs/dbraw/zinc/30/44/37/1406304437.db2.gz BBDSCZSLCWNGAL-LDLYASANSA-N 1 3 335.536 2.591 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](CCC3CC3)C[C@H]2C1)CC(C)(C)C ZINC001506851524 1406332183 /nfs/dbraw/zinc/33/21/83/1406332183.db2.gz DLZIFRNLGWYQSK-GUDVDZBRSA-N 1 3 349.563 2.981 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](CCC3CC3)C[C@H]2C1)CC(C)(C)C ZINC001506851524 1406332196 /nfs/dbraw/zinc/33/21/96/1406332196.db2.gz DLZIFRNLGWYQSK-GUDVDZBRSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)Oc1ccc([C@@H](CNC(=O)[C@H](C)CC[NH+](C)C)N(C)C)cc1 ZINC001434040575 1387070057 /nfs/dbraw/zinc/07/00/57/1387070057.db2.gz MUVBUQILTCIVKO-VQIMIIECSA-N 1 3 349.519 2.781 10 0 EFAEHO C[C@@H](CN1CCOCC1)CN1CC[C@H](C)[N@H+](Cc2ccccc2)CC1 ZINC001434460030 1387162433 /nfs/dbraw/zinc/16/24/33/1387162433.db2.gz YMGOUSNAFMHFBF-UXHICEINSA-N 1 3 345.531 2.551 10 0 EFAEHO C[C@@H](CN1CCOCC1)CN1CC[C@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC001434460030 1387162434 /nfs/dbraw/zinc/16/24/34/1387162434.db2.gz YMGOUSNAFMHFBF-UXHICEINSA-N 1 3 345.531 2.551 10 0 EFAEHO C[C@H](C(=O)N[C@@H](C)CNCc1ccccc1F)[NH+]1CCCCCC1 ZINC001439256756 1389077063 /nfs/dbraw/zinc/07/70/63/1389077063.db2.gz ISMHFASGKWHYQK-JKSUJKDBSA-N 1 3 335.467 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+]Cc1ccc(C(C)(C)C)cc1 ZINC001439282945 1389095046 /nfs/dbraw/zinc/09/50/46/1389095046.db2.gz ACWCXIKXMBRDIO-INIZCTEOSA-N 1 3 333.520 2.919 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3nc[nH]c3C)C[C@H]2C1 ZINC001506860185 1406357901 /nfs/dbraw/zinc/35/79/01/1406357901.db2.gz VVZMDSXKNINZHK-PKTYMYEJSA-N 1 3 344.503 2.834 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3nc[nH]c3C)C[C@H]2C1 ZINC001506860185 1406357914 /nfs/dbraw/zinc/35/79/14/1406357914.db2.gz VVZMDSXKNINZHK-PKTYMYEJSA-N 1 3 344.503 2.834 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)CC1CC2(CCC2)C1 ZINC001439321757 1389140212 /nfs/dbraw/zinc/14/02/12/1389140212.db2.gz DFRRDFLLOYTDBX-SJLPKXTDSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001439321757 1389140220 /nfs/dbraw/zinc/14/02/20/1389140220.db2.gz DFRRDFLLOYTDBX-SJLPKXTDSA-N 1 3 335.536 2.876 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1F ZINC001439361883 1389187527 /nfs/dbraw/zinc/18/75/27/1389187527.db2.gz ACMVCIAKKCXKHE-BQFCYCMXSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1F ZINC001439361883 1389187530 /nfs/dbraw/zinc/18/75/30/1389187530.db2.gz ACMVCIAKKCXKHE-BQFCYCMXSA-N 1 3 349.494 2.801 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N[C@@H](C)CN(C)Cc2ccccc2)C1 ZINC001439371690 1389202521 /nfs/dbraw/zinc/20/25/21/1389202521.db2.gz SFBNOPISLGABBT-HKUYNNGSSA-N 1 3 331.504 2.745 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N[C@@H](C)CN(C)Cc2ccccc2)C1 ZINC001439371690 1389202527 /nfs/dbraw/zinc/20/25/27/1389202527.db2.gz SFBNOPISLGABBT-HKUYNNGSSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC001439403315 1389250081 /nfs/dbraw/zinc/25/00/81/1389250081.db2.gz GKWWNHOWSGALTJ-KBXCAEBGSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC001439403315 1389250085 /nfs/dbraw/zinc/25/00/85/1389250085.db2.gz GKWWNHOWSGALTJ-KBXCAEBGSA-N 1 3 335.467 2.590 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)NC[C@H]1CCN1[C@@H]1CCc2ccccc21 ZINC001439576734 1389324463 /nfs/dbraw/zinc/32/44/63/1389324463.db2.gz YWKTZAJTRFOQSH-UYAOXDASSA-N 1 3 341.499 2.740 10 0 EFAEHO CCN1CCC(F)(F)[C@H](CNC(=O)C2(C[NH+](C)C)CCCCC2)C1 ZINC001439972871 1389375862 /nfs/dbraw/zinc/37/58/62/1389375862.db2.gz NFUKNVBWZZITKN-OAHLLOKOSA-N 1 3 345.478 2.592 10 0 EFAEHO CCN1CCC(F)(F)[C@@H](CNC(=O)C2(C[NH+](C)C)CCCCC2)C1 ZINC001439972864 1389376046 /nfs/dbraw/zinc/37/60/46/1389376046.db2.gz NFUKNVBWZZITKN-HNNXBMFYSA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]CC2CCCCCC2)C1 ZINC001440136447 1389406305 /nfs/dbraw/zinc/40/63/05/1389406305.db2.gz NJYSVJFXWSCZEP-PKOBYXMFSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2c(C)cccc2C)C1 ZINC001440137267 1389406988 /nfs/dbraw/zinc/40/69/88/1389406988.db2.gz QLCGRGYIUFPHJF-RBUKOAKNSA-N 1 3 345.531 2.829 10 0 EFAEHO C[C@@H]([NH2+]CC[C@H]1CCN(C(=O)CN2CCCC2)C1)c1ccccc1F ZINC001440224180 1389454185 /nfs/dbraw/zinc/45/41/85/1389454185.db2.gz XKCFYWIPKFDMPV-SJORKVTESA-N 1 3 347.478 2.811 10 0 EFAEHO CN(C[C@H]1CCN1CCCC1CCC1)C(=O)C(C)(C)[NH+]1CCCC1 ZINC001440227416 1389457497 /nfs/dbraw/zinc/45/74/97/1389457497.db2.gz HNZVOMHYBCYBJK-GOSISDBHSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@@H+]2CCC2CCCCC2)C1 ZINC001440240338 1389467036 /nfs/dbraw/zinc/46/70/36/1389467036.db2.gz ILTSELKEIIEFSQ-PKOBYXMFSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@H+]2CCC2CCCCC2)C1 ZINC001440240338 1389467038 /nfs/dbraw/zinc/46/70/38/1389467038.db2.gz ILTSELKEIIEFSQ-PKOBYXMFSA-N 1 3 335.536 2.831 10 0 EFAEHO CN(C[C@@H]1CCN1Cc1cccc2ccccc21)C(=O)CC[NH+](C)C ZINC001440246043 1389472551 /nfs/dbraw/zinc/47/25/51/1389472551.db2.gz QFGSMCGBZKNYIW-IBGZPJMESA-N 1 3 339.483 2.824 10 0 EFAEHO CCc1ccccc1CN1CC[C@@H]1CN(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001440265075 1389487896 /nfs/dbraw/zinc/48/78/96/1389487896.db2.gz OMUBLLPWFPEQSL-YLJYHZDGSA-N 1 3 343.515 2.624 10 0 EFAEHO CCc1ccccc1CN1CC[C@@H]1CN(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001440265075 1389487900 /nfs/dbraw/zinc/48/79/00/1389487900.db2.gz OMUBLLPWFPEQSL-YLJYHZDGSA-N 1 3 343.515 2.624 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(OC)c2)C1)N(C)C ZINC001440300667 1389514867 /nfs/dbraw/zinc/51/48/67/1389514867.db2.gz HGEFAKZIWHCAPP-BVYOLEPJSA-N 1 3 347.503 2.581 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2cccc(Cl)c2)C1 ZINC001440317754 1389530485 /nfs/dbraw/zinc/53/04/85/1389530485.db2.gz JXMVIXDPTCJQKN-WOVMCDHWSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]Cc2ccccc2)CCC1 ZINC001440350483 1389555708 /nfs/dbraw/zinc/55/57/08/1389555708.db2.gz DIMYPQVDAGTFKG-IAGOWNOFSA-N 1 3 329.488 2.688 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2cc3ccccc3o2)CCC1 ZINC001440356659 1389561957 /nfs/dbraw/zinc/56/19/57/1389561957.db2.gz RZQUGSOVBWRJDL-UHFFFAOYSA-N 1 3 343.471 2.902 10 0 EFAEHO CCc1ccc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCC2)cc1 ZINC001440358894 1389563594 /nfs/dbraw/zinc/56/35/94/1389563594.db2.gz XLNSCXIPMPQFBO-UHFFFAOYSA-N 1 3 331.504 2.718 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccc(F)cc32)C1 ZINC001440362037 1389567492 /nfs/dbraw/zinc/56/74/92/1389567492.db2.gz KACINMBUBAPCHZ-LSBZLQRGSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@@H]1CCCN(CCC(F)(F)F)CC1 ZINC001440389836 1389585790 /nfs/dbraw/zinc/58/57/90/1389585790.db2.gz LZARWCGEDVLBLN-CABCVRRESA-N 1 3 349.441 2.784 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@@H]1CCCN(CCC(F)(F)F)CC1 ZINC001440389836 1389585793 /nfs/dbraw/zinc/58/57/93/1389585793.db2.gz LZARWCGEDVLBLN-CABCVRRESA-N 1 3 349.441 2.784 10 0 EFAEHO Cc1ccccc1C[N@H+]1CCC[C@H](NC(=O)CN(C)C(C)C)CC1 ZINC001440394305 1389589717 /nfs/dbraw/zinc/58/97/17/1389589717.db2.gz FMMPLDOKQMFROF-IBGZPJMESA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CCC[C@H](NC(=O)CN(C)C(C)C)CC1 ZINC001440394305 1389589722 /nfs/dbraw/zinc/58/97/22/1389589722.db2.gz FMMPLDOKQMFROF-IBGZPJMESA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@H+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC001440395467 1389591054 /nfs/dbraw/zinc/59/10/54/1389591054.db2.gz IKDDGRVVGGMYBA-CVEARBPZSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@@H+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC001440395467 1389591056 /nfs/dbraw/zinc/59/10/56/1389591056.db2.gz IKDDGRVVGGMYBA-CVEARBPZSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@H+](CCc2cccs2)CC1 ZINC001440400957 1389599004 /nfs/dbraw/zinc/59/90/04/1389599004.db2.gz VJHQBQHDUVOTTH-INIZCTEOSA-N 1 3 337.533 2.602 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@@H+](CCc2cccs2)CC1 ZINC001440400957 1389599009 /nfs/dbraw/zinc/59/90/09/1389599009.db2.gz VJHQBQHDUVOTTH-INIZCTEOSA-N 1 3 337.533 2.602 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)CCCN(C)C(=O)[C@@H]2CCCN2C)c(C)c1 ZINC001440424912 1389622782 /nfs/dbraw/zinc/62/27/82/1389622782.db2.gz DCTDZJZYKMXJFR-FQEVSTJZSA-N 1 3 345.531 2.986 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)CCCN(C)C(=O)[C@@H]2CCCN2C)c(C)c1 ZINC001440424912 1389622785 /nfs/dbraw/zinc/62/27/85/1389622785.db2.gz DCTDZJZYKMXJFR-FQEVSTJZSA-N 1 3 345.531 2.986 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@H+](CC3CCC3)[C@@H]2C1(C)C ZINC001440457218 1389657132 /nfs/dbraw/zinc/65/71/32/1389657132.db2.gz VFODROZCXBQCQD-UHOSZYNNSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@@H+](CC3CCC3)[C@@H]2C1(C)C ZINC001440457218 1389657135 /nfs/dbraw/zinc/65/71/35/1389657135.db2.gz VFODROZCXBQCQD-UHOSZYNNSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCC[C@@H](C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CC)CC1 ZINC001440483428 1389688478 /nfs/dbraw/zinc/68/84/78/1389688478.db2.gz NSNSITBNGLCVOJ-QRQLOZEOSA-N 1 3 335.536 2.972 10 0 EFAEHO CCc1cccc(C[N@H+](C)CCCN(C)C(=O)CN2CCCC2)c1 ZINC001440486857 1389690750 /nfs/dbraw/zinc/69/07/50/1389690750.db2.gz ZPHCWAGCBYYXOC-UHFFFAOYSA-N 1 3 331.504 2.625 10 0 EFAEHO CCc1cccc(C[N@@H+](C)CCCN(C)C(=O)CN2CCCC2)c1 ZINC001440486857 1389690752 /nfs/dbraw/zinc/69/07/52/1389690752.db2.gz ZPHCWAGCBYYXOC-UHFFFAOYSA-N 1 3 331.504 2.625 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC001440486706 1389690762 /nfs/dbraw/zinc/69/07/62/1389690762.db2.gz YRNUAOIPNIQSSE-LJQANCHMSA-N 1 3 349.494 2.934 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC001440486706 1389690763 /nfs/dbraw/zinc/69/07/63/1389690763.db2.gz YRNUAOIPNIQSSE-LJQANCHMSA-N 1 3 349.494 2.934 10 0 EFAEHO Cc1cccnc1CN(C)CCCN(C)C(=O)C[NH+]1[C@@H](C)CC[C@@H]1C ZINC001440486849 1389691012 /nfs/dbraw/zinc/69/10/12/1389691012.db2.gz ZYQCUCHGQGPJTD-ROUUACIJSA-N 1 3 346.519 2.543 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CCC[NH+](C)C)CCN1Cc1ccc2c(c1)CCC2 ZINC001440495929 1389699617 /nfs/dbraw/zinc/69/96/17/1389699617.db2.gz KREBYMZPMCTZLG-UZLBHIALSA-N 1 3 343.515 2.596 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CCCc2ccccc2)[C@@H]1C)N(C)C ZINC001440497956 1389701722 /nfs/dbraw/zinc/70/17/22/1389701722.db2.gz QCHMUVVCHFJMDQ-YZGWKJHDSA-N 1 3 345.531 2.784 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CCCc2ccccc2)[C@@H]1C)N(C)C ZINC001440497956 1389701726 /nfs/dbraw/zinc/70/17/26/1389701726.db2.gz QCHMUVVCHFJMDQ-YZGWKJHDSA-N 1 3 345.531 2.784 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CC2CC(C)C2)CC(C)(C)C1 ZINC001440526573 1389728916 /nfs/dbraw/zinc/72/89/16/1389728916.db2.gz FUSUHQWIPKOXEX-ABHNRTSZSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CC2CC(C)C2)CC(C)(C)C1 ZINC001440526573 1389728919 /nfs/dbraw/zinc/72/89/19/1389728919.db2.gz FUSUHQWIPKOXEX-ABHNRTSZSA-N 1 3 337.552 2.980 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1CCN(Cc2ccccn2)CC(C)(C)C1 ZINC001440539399 1389742591 /nfs/dbraw/zinc/74/25/91/1389742591.db2.gz VTYAJEBGLCIFJT-KRWDZBQOSA-N 1 3 346.519 2.530 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NCc1ccc2c(c1)CN(CC1CC1)C2 ZINC001440579414 1389759307 /nfs/dbraw/zinc/75/93/07/1389759307.db2.gz NQYYXHMSNXXPPF-IYBDPMFKSA-N 1 3 341.499 2.901 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCc1ccc2c(c1)CN(CC1CC1)C2 ZINC001440579414 1389759309 /nfs/dbraw/zinc/75/93/09/1389759309.db2.gz NQYYXHMSNXXPPF-IYBDPMFKSA-N 1 3 341.499 2.901 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001506882930 1406400780 /nfs/dbraw/zinc/40/07/80/1406400780.db2.gz ASRHJRTZWVQLSF-WJQMYRPNSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001506882930 1406400786 /nfs/dbraw/zinc/40/07/86/1406400786.db2.gz ASRHJRTZWVQLSF-WJQMYRPNSA-N 1 3 348.318 2.663 10 0 EFAEHO CC[C@H](F)C[N@H+](CC)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001440706791 1389829497 /nfs/dbraw/zinc/82/94/97/1389829497.db2.gz NOILPBDBXJKDAR-WMZOPIPTSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](F)C[N@@H+](CC)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001440706791 1389829500 /nfs/dbraw/zinc/82/95/00/1389829500.db2.gz NOILPBDBXJKDAR-WMZOPIPTSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001440804466 1389910412 /nfs/dbraw/zinc/91/04/12/1389910412.db2.gz YNSQUOKQOBOVLI-LSDHHAIUSA-N 1 3 343.471 2.900 10 0 EFAEHO CC(C)c1cccc(CN[C@H](C)[C@@H](C)NC(=O)C2(C[NH+](C)C)CC2)n1 ZINC001440826039 1389929164 /nfs/dbraw/zinc/92/91/64/1389929164.db2.gz ZFWKTBWRMWPGKS-HZPDHXFCSA-N 1 3 346.519 2.530 10 0 EFAEHO C[C@@H](NC(=O)CN(C)CC(C)(C)C)[C@H](C)[NH2+]Cc1ccsc1 ZINC001440845269 1389945591 /nfs/dbraw/zinc/94/55/91/1389945591.db2.gz XLLBQNSULSMMMT-UONOGXRCSA-N 1 3 325.522 2.709 10 0 EFAEHO CCc1cccc(CN(C)[C@@H](C)CNC(=O)[C@H]2C[NH+]3CCC2CC3)c1 ZINC001440926085 1390013406 /nfs/dbraw/zinc/01/34/06/1390013406.db2.gz QDYBKHGHLHGGQC-JXFKEZNVSA-N 1 3 343.515 2.527 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC[NH+]([C@@H]2CCc3ccccc32)CC1)N(C)C ZINC001440983921 1391003740 /nfs/dbraw/zinc/00/37/40/1391003740.db2.gz GJNKHFROKMCEHG-WOJBJXKFSA-N 1 3 343.515 2.937 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001440991392 1391010049 /nfs/dbraw/zinc/01/00/49/1391010049.db2.gz KMHXDIJHGMTFJS-TZMCWYRMSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001440991392 1391010054 /nfs/dbraw/zinc/01/00/54/1391010054.db2.gz KMHXDIJHGMTFJS-TZMCWYRMSA-N 1 3 342.434 2.523 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC[NH+]([C@H]2CCc3ccccc32)CC1 ZINC001441008572 1391029234 /nfs/dbraw/zinc/02/92/34/1391029234.db2.gz GHNQDAPSGQTERJ-FQEVSTJZSA-N 1 3 343.515 2.937 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@H+](C)C1)N(C)Cc1cccc(C(F)F)c1 ZINC001441009113 1391030510 /nfs/dbraw/zinc/03/05/10/1391030510.db2.gz IKFGVNSSUKDPSH-BBRMVZONSA-N 1 3 339.430 2.512 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)N(C)Cc1cccc(C(F)F)c1 ZINC001441009113 1391030514 /nfs/dbraw/zinc/03/05/14/1391030514.db2.gz IKFGVNSSUKDPSH-BBRMVZONSA-N 1 3 339.430 2.512 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+]Cc1ccccc1C ZINC001506946880 1406482532 /nfs/dbraw/zinc/48/25/32/1406482532.db2.gz SEUDUJXWVJMDQW-HNNXBMFYSA-N 1 3 328.460 2.644 10 0 EFAEHO C[C@H](NC(=O)[C@H](C)[NH+]1CCCCCC1)C1CN(Cc2ccccc2)C1 ZINC001441177978 1391162229 /nfs/dbraw/zinc/16/22/29/1391162229.db2.gz BJSALROTQUTHPV-ROUUACIJSA-N 1 3 343.515 2.888 10 0 EFAEHO Cc1ccc(C[NH+]2CC([C@@H](C)NC(=O)CN3CC[C@@H](C)C3)C2)c(C)c1 ZINC001441189389 1391169580 /nfs/dbraw/zinc/16/95/80/1391169580.db2.gz ZVRWXRHXDCLERM-SJLPKXTDSA-N 1 3 343.515 2.582 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CC1CC(C)(C)C1)C1CC1 ZINC001441201219 1391177517 /nfs/dbraw/zinc/17/75/17/1391177517.db2.gz LTBQJOBRJFIEQN-ZWKOTPCHSA-N 1 3 335.536 2.781 10 0 EFAEHO Cc1cccc(C)c1C[NH+]1CC([C@@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001441215454 1391187423 /nfs/dbraw/zinc/18/74/23/1391187423.db2.gz UETOJAPEVRHAJJ-QGZVFWFLSA-N 1 3 331.504 2.580 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@H]([NH2+]CC1CCCC1)C1CC1 ZINC001441231370 1391199637 /nfs/dbraw/zinc/19/96/37/1391199637.db2.gz GFEPQQUZCJPMKO-MOPGFXCFSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@@H]1[C@H]2CN([C@@H](C)c3ccccc3F)C[C@H]21 ZINC001441296730 1391239652 /nfs/dbraw/zinc/23/96/52/1391239652.db2.gz NPZXUZHYINGOPE-LEUOFYLZSA-N 1 3 347.478 2.523 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@@H]1[C@H]2CN([C@@H](C)c3ccccc3F)C[C@H]21 ZINC001441296730 1391239656 /nfs/dbraw/zinc/23/96/56/1391239656.db2.gz NPZXUZHYINGOPE-LEUOFYLZSA-N 1 3 347.478 2.523 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@@H]1[C@H]2CN([C@H](C)c3ccccc3F)C[C@H]21 ZINC001441296724 1391239920 /nfs/dbraw/zinc/23/99/20/1391239920.db2.gz NPZXUZHYINGOPE-DDBAPUKQSA-N 1 3 347.478 2.523 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@@H]1[C@H]2CN([C@H](C)c3ccccc3F)C[C@H]21 ZINC001441296724 1391239925 /nfs/dbraw/zinc/23/99/25/1391239925.db2.gz NPZXUZHYINGOPE-DDBAPUKQSA-N 1 3 347.478 2.523 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@H]2CCc3ccccc32)C1 ZINC001441382159 1391274194 /nfs/dbraw/zinc/27/41/94/1391274194.db2.gz VHSOTXMFQCMOME-IEZWGBDMSA-N 1 3 329.488 2.500 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1C[C@H](NCc2c(Cl)oc3ccccc32)C1 ZINC001441417662 1391292799 /nfs/dbraw/zinc/29/27/99/1391292799.db2.gz KQCGZPDTUNUQPC-JOCQHMNTSA-N 1 3 349.862 2.775 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccccc1C1CC1)N(C)C ZINC001441543351 1391357273 /nfs/dbraw/zinc/35/72/73/1391357273.db2.gz VPZCOMXPAVTNRZ-DNVCBOLYSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@H](C)[NH2+]Cc1ccccc1C1CC1)N(C)C ZINC001441543355 1391357540 /nfs/dbraw/zinc/35/75/40/1391357540.db2.gz VPZCOMXPAVTNRZ-HNAYVOBHSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[NH+]1CCCC1 ZINC001441548625 1391358072 /nfs/dbraw/zinc/35/80/72/1391358072.db2.gz KPVPTBDOSUEDBY-VNHYZAJKSA-N 1 3 348.318 2.663 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001441587285 1391379181 /nfs/dbraw/zinc/37/91/81/1391379181.db2.gz ASTJEFHVJZLFAO-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO Cc1cncc(CN[C@H](C)CN(C)C(=O)[C@@H](C)[NH+]2CCCCCC2)c1 ZINC001441587287 1391379507 /nfs/dbraw/zinc/37/95/07/1391379507.db2.gz NBNRNTLXJYDSQX-QZTJIDSGSA-N 1 3 346.519 2.591 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC([N@H+](C)CCCCC(F)(F)F)CC1 ZINC001506959402 1406504245 /nfs/dbraw/zinc/50/42/45/1406504245.db2.gz BUEWOIIYRKAACK-OAHLLOKOSA-N 1 3 349.441 2.736 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CCC([NH2+]Cc2cccc(F)c2)CC1 ZINC001441741213 1391412360 /nfs/dbraw/zinc/41/23/60/1391412360.db2.gz PAFJPWQBDOPSQB-UHFFFAOYSA-N 1 3 335.467 2.683 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001441849376 1391423416 /nfs/dbraw/zinc/42/34/16/1391423416.db2.gz LTTXEINDTOEINS-QFBILLFUSA-N 1 3 331.504 2.716 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](C)CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001441849381 1391423782 /nfs/dbraw/zinc/42/37/82/1391423782.db2.gz LTTXEINDTOEINS-VQIMIIECSA-N 1 3 331.504 2.716 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC([N@@H+](C)CCCCC(F)(F)F)CC1 ZINC001506959402 1406504250 /nfs/dbraw/zinc/50/42/50/1406504250.db2.gz BUEWOIIYRKAACK-OAHLLOKOSA-N 1 3 349.441 2.736 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@@H](C)CNC(=O)CN(C)C2CCC2)c(C)c1 ZINC001444332977 1391472606 /nfs/dbraw/zinc/47/26/06/1391472606.db2.gz WECUUNVYZQMTNU-MRXNPFEDSA-N 1 3 345.531 2.938 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+][C@@H](C)c1cc(F)ccc1F ZINC001444449556 1391492646 /nfs/dbraw/zinc/49/26/46/1391492646.db2.gz UNXJUZOCZXSGLF-KBPBESRZSA-N 1 3 341.446 2.708 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+][C@H](C)c1cc(F)ccc1F ZINC001444450265 1391492717 /nfs/dbraw/zinc/49/27/17/1391492717.db2.gz UNXJUZOCZXSGLF-ZIAGYGMSSA-N 1 3 341.446 2.708 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@@]1(C)CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001446618594 1391560278 /nfs/dbraw/zinc/56/02/78/1391560278.db2.gz XGQPWMOEFDTYLH-AZUAARDMSA-N 1 3 349.494 2.938 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001506962845 1406510904 /nfs/dbraw/zinc/51/09/04/1406510904.db2.gz GFJBSOGGEYMBRA-MRXNPFEDSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001506962845 1406510908 /nfs/dbraw/zinc/51/09/08/1406510908.db2.gz GFJBSOGGEYMBRA-MRXNPFEDSA-N 1 3 325.541 2.933 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H](C2CCN(C/C=C\Cl)CC2)C1 ZINC001446920075 1391636284 /nfs/dbraw/zinc/63/62/84/1391636284.db2.gz BRQHFHNIZXQKMX-INDRUJQFSA-N 1 3 341.927 2.641 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H](C2CCN(C/C=C\Cl)CC2)C1 ZINC001446920071 1391636338 /nfs/dbraw/zinc/63/63/38/1391636338.db2.gz BRQHFHNIZXQKMX-ASRSSLEJSA-N 1 3 341.927 2.641 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]1C[N@H+](C)CCCC1CCCC1 ZINC001447770098 1391755667 /nfs/dbraw/zinc/75/56/67/1391755667.db2.gz JQMFLJWWMMNBHH-MOPGFXCFSA-N 1 3 335.536 2.974 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]1C[N@@H+](C)CCCC1CCCC1 ZINC001447770098 1391755672 /nfs/dbraw/zinc/75/56/72/1391755672.db2.gz JQMFLJWWMMNBHH-MOPGFXCFSA-N 1 3 335.536 2.974 10 0 EFAEHO C[N@H+](CCCc1ccccc1)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001447770178 1391756372 /nfs/dbraw/zinc/75/63/72/1391756372.db2.gz NQLMXRFIZCJQLO-FQEVSTJZSA-N 1 3 343.515 2.638 10 0 EFAEHO C[N@@H+](CCCc1ccccc1)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001447770178 1391756378 /nfs/dbraw/zinc/75/63/78/1391756378.db2.gz NQLMXRFIZCJQLO-FQEVSTJZSA-N 1 3 343.515 2.638 10 0 EFAEHO CN(C/C=C/c1ccccc1)C[C@@H]1CCCN1C(=O)[C@H]1CC[N@H+](C)C1 ZINC001447771888 1391758464 /nfs/dbraw/zinc/75/84/64/1391758464.db2.gz RKFUEYGRBNLDLE-UPBJVAEDSA-N 1 3 341.499 2.574 10 0 EFAEHO CN(C/C=C/c1ccccc1)C[C@@H]1CCCN1C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001447771888 1391758468 /nfs/dbraw/zinc/75/84/68/1391758468.db2.gz RKFUEYGRBNLDLE-UPBJVAEDSA-N 1 3 341.499 2.574 10 0 EFAEHO C[N@H+](CCCc1ccsc1)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001447774254 1391761452 /nfs/dbraw/zinc/76/14/52/1391761452.db2.gz XEIKEIBIHFIWSE-SFHVURJKSA-N 1 3 349.544 2.699 10 0 EFAEHO C[N@@H+](CCCc1ccsc1)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001447774254 1391761457 /nfs/dbraw/zinc/76/14/57/1391761457.db2.gz XEIKEIBIHFIWSE-SFHVURJKSA-N 1 3 349.544 2.699 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C(C)C)c(C)c1 ZINC001447926045 1391818381 /nfs/dbraw/zinc/81/83/81/1391818381.db2.gz AWRZHGPHKYWFOV-MSOLQXFVSA-N 1 3 333.520 2.935 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C1CCC([NH2+]C/C=C\Cl)CC1 ZINC001447943738 1391845945 /nfs/dbraw/zinc/84/59/45/1391845945.db2.gz CLOYHHSSYIPXJO-JBWSJSMZSA-N 1 3 341.927 2.973 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC(C)(C)C[NH2+]Cc1ccsc1)N(C)C ZINC001447971283 1391866070 /nfs/dbraw/zinc/86/60/70/1391866070.db2.gz NVPHNBLTZHCVTG-HNNXBMFYSA-N 1 3 325.522 2.663 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)N(C)Cc1ccc(Cl)cc1 ZINC001448015596 1391897504 /nfs/dbraw/zinc/89/75/04/1391897504.db2.gz MQFZCQLEYYSIIJ-JJRVBVJISA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)N(C)Cc1ccc(Cl)cc1 ZINC001448015596 1391897515 /nfs/dbraw/zinc/89/75/15/1391897515.db2.gz MQFZCQLEYYSIIJ-JJRVBVJISA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001448069029 1391929409 /nfs/dbraw/zinc/92/94/09/1391929409.db2.gz JBLBZDHQLXWFDJ-VQIMIIECSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001448069029 1391929417 /nfs/dbraw/zinc/92/94/17/1391929417.db2.gz JBLBZDHQLXWFDJ-VQIMIIECSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C)C/C=C\c2ccccc2)CC1 ZINC001506977746 1406538016 /nfs/dbraw/zinc/53/80/16/1406538016.db2.gz LSRSRWIHTMYXQJ-FLIBITNWSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C)C/C=C\c2ccccc2)CC1 ZINC001506977746 1406538019 /nfs/dbraw/zinc/53/80/19/1406538019.db2.gz LSRSRWIHTMYXQJ-FLIBITNWSA-N 1 3 343.515 2.963 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1(C[NH2+]CC2CC(C)C2)CCCCC1 ZINC001448229051 1392036288 /nfs/dbraw/zinc/03/62/88/1392036288.db2.gz NCVLNMSFBJARDY-UHFFFAOYSA-N 1 3 332.492 2.715 10 0 EFAEHO CCCC[C@@H](CNCc1ccccc1F)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001448260680 1392057490 /nfs/dbraw/zinc/05/74/90/1392057490.db2.gz FGVJMPNQVQZLMN-BPQIPLTHSA-N 1 3 349.494 2.931 10 0 EFAEHO CCCC[C@@H](CNCc1ccccc1F)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001448260680 1392057496 /nfs/dbraw/zinc/05/74/96/1392057496.db2.gz FGVJMPNQVQZLMN-BPQIPLTHSA-N 1 3 349.494 2.931 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H]1C[C@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001449019280 1392210741 /nfs/dbraw/zinc/21/07/41/1392210741.db2.gz PURBBXZWRGSMFE-QFBILLFUSA-N 1 3 331.504 2.668 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H]1C[C@@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001449022761 1392213816 /nfs/dbraw/zinc/21/38/16/1392213816.db2.gz RWTSRSCUJPMDMW-MSOLQXFVSA-N 1 3 331.504 2.723 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]Cc3ccsc3)[C@H]2C1 ZINC001449029123 1392218547 /nfs/dbraw/zinc/21/85/47/1392218547.db2.gz DCLTZILZVUXEOB-OKZBNKHCSA-N 1 3 349.544 2.807 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H]1C[C@@H](C)N(C(=O)CC[NH+](C)C)C1 ZINC001449028985 1392218966 /nfs/dbraw/zinc/21/89/66/1392218966.db2.gz OXEZZINEFOXGPM-CABCVRRESA-N 1 3 337.895 2.679 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@H]1CN(C(=O)C(C)(C)N2CCCCC2)CC1(C)C ZINC001449065629 1392247888 /nfs/dbraw/zinc/24/78/88/1392247888.db2.gz XQVSIDPYBCLODZ-CVEARBPZSA-N 1 3 341.515 2.826 10 0 EFAEHO CN(CC(=O)N(C)[C@H](C[NH2+]CC=C(Cl)Cl)C1CC1)C1CCC1 ZINC001507013798 1406589032 /nfs/dbraw/zinc/58/90/32/1406589032.db2.gz ZJHQNQAGBIULRV-CQSZACIVSA-N 1 3 348.318 2.616 10 0 EFAEHO C[C@H](CN(C)C(=O)CN(C)C1CCC1)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001507092150 1406691189 /nfs/dbraw/zinc/69/11/89/1406691189.db2.gz XNWGYTCMLUVUEG-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)N(C)C ZINC001457074759 1394956008 /nfs/dbraw/zinc/95/60/08/1394956008.db2.gz YMPWHFJZOBUCJX-WCIQWLHISA-N 1 3 343.515 2.744 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)N(C)C ZINC001457074759 1394956015 /nfs/dbraw/zinc/95/60/15/1394956015.db2.gz YMPWHFJZOBUCJX-WCIQWLHISA-N 1 3 343.515 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001507163293 1406794277 /nfs/dbraw/zinc/79/42/77/1406794277.db2.gz UGWWJEFTEOPLJR-LSDHHAIUSA-N 1 3 333.467 2.589 10 0 EFAEHO C[N@@H+]1C[C@@]23CN(C[C@H](O)CCc4ccccc4)C[C@]2(C1)CCCC3 ZINC001460978053 1396277703 /nfs/dbraw/zinc/27/77/03/1396277703.db2.gz SIBPXIYNJZKFSA-NJYVYQBISA-N 1 3 328.500 2.788 10 0 EFAEHO C[N@H+]1C[C@@]23CN(C[C@H](O)CCc4ccccc4)C[C@]2(C1)CCCC3 ZINC001460978053 1396277706 /nfs/dbraw/zinc/27/77/06/1396277706.db2.gz SIBPXIYNJZKFSA-NJYVYQBISA-N 1 3 328.500 2.788 10 0 EFAEHO C[C@@H]1[C@@H]([NH2+]CCCCC(F)(F)F)CCN1C(=O)CN(C)C1CCC1 ZINC001507284036 1406847532 /nfs/dbraw/zinc/84/75/32/1406847532.db2.gz OICSIVOCVHFYFU-HIFRSBDPSA-N 1 3 349.441 2.782 10 0 EFAEHO C[C@H]1[C@H](NCc2cc(Cl)ccc2F)CCN1C(=O)CC[NH+](C)C ZINC001507289230 1406854111 /nfs/dbraw/zinc/85/41/11/1406854111.db2.gz IZKLHLVXBUZYJE-BLLLJJGKSA-N 1 3 341.858 2.510 10 0 EFAEHO COc1ccc([C@H](CN(C)C)NC(=O)[C@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC001467936223 1396910526 /nfs/dbraw/zinc/91/05/26/1396910526.db2.gz KVKKNUIHFIZNGE-HKUYNNGSSA-N 1 3 347.503 2.535 10 0 EFAEHO COc1ccc([C@H](CN(C)C)NC(=O)[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC001467936223 1396910534 /nfs/dbraw/zinc/91/05/34/1396910534.db2.gz KVKKNUIHFIZNGE-HKUYNNGSSA-N 1 3 347.503 2.535 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12 ZINC001470025131 1397067734 /nfs/dbraw/zinc/06/77/34/1397067734.db2.gz CCFXLXCYJHKUIB-INDMIFKZSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12 ZINC001470025131 1397067736 /nfs/dbraw/zinc/06/77/36/1397067736.db2.gz CCFXLXCYJHKUIB-INDMIFKZSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H]1CCCC[C@@H]1CNC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001470351178 1397087640 /nfs/dbraw/zinc/08/76/40/1397087640.db2.gz DUQKFWZFKWHTBN-OKZBNKHCSA-N 1 3 340.556 2.774 10 0 EFAEHO CC[C@H]1CCCC[C@@H]1CNC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001470351178 1397087643 /nfs/dbraw/zinc/08/76/43/1397087643.db2.gz DUQKFWZFKWHTBN-OKZBNKHCSA-N 1 3 340.556 2.774 10 0 EFAEHO CC[C@H](C)[C@H]1CCCCN1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001470772508 1397120190 /nfs/dbraw/zinc/12/01/90/1397120190.db2.gz PYIYPAWCENJFIF-OKZBNKHCSA-N 1 3 340.556 2.869 10 0 EFAEHO CC[C@H](C)[C@H]1CCCCN1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001470772508 1397120196 /nfs/dbraw/zinc/12/01/96/1397120196.db2.gz PYIYPAWCENJFIF-OKZBNKHCSA-N 1 3 340.556 2.869 10 0 EFAEHO CC[NH+](CC)CC[C@H](NC(=O)N[C@@H]1CCN(C)[C@@H]1C)c1ccccc1 ZINC001471398017 1397167794 /nfs/dbraw/zinc/16/77/94/1397167794.db2.gz MXXQHJKIHIHYNW-QRQLOZEOSA-N 1 3 346.519 2.851 10 0 EFAEHO CC[NH+](CC)CC[C@H](NC(=O)N[C@H]1CCN(C)[C@H]1C)c1ccccc1 ZINC001471398149 1397168468 /nfs/dbraw/zinc/16/84/68/1397168468.db2.gz MXXQHJKIHIHYNW-WDSOQIARSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)CCc2ccc3c(c2)OC(F)(F)O3)CC[N@H+]1C ZINC001473210108 1397289826 /nfs/dbraw/zinc/28/98/26/1397289826.db2.gz CIBAFWNFOAERCX-OCCSQVGLSA-N 1 3 326.387 2.965 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)CCc2ccc3c(c2)OC(F)(F)O3)CC[N@@H+]1C ZINC001473210108 1397289824 /nfs/dbraw/zinc/28/98/24/1397289824.db2.gz CIBAFWNFOAERCX-OCCSQVGLSA-N 1 3 326.387 2.965 10 0 EFAEHO CC[NH+](CC)CCO[C@H]1CCN(Cc2c[nH]c(=O)c3ccccc23)C1 ZINC001473212990 1397290424 /nfs/dbraw/zinc/29/04/24/1397290424.db2.gz FXAKFSHKKXOMAY-KRWDZBQOSA-N 1 3 343.471 2.873 10 0 EFAEHO CCCNC(=O)CCCN1C[C@H]2C[N@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001473778228 1397331047 /nfs/dbraw/zinc/33/10/47/1397331047.db2.gz VUPOBNKYPBCHCA-PZJWPPBQSA-N 1 3 343.515 2.747 10 0 EFAEHO CCCNC(=O)CCCN1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001473778228 1397331048 /nfs/dbraw/zinc/33/10/48/1397331048.db2.gz VUPOBNKYPBCHCA-PZJWPPBQSA-N 1 3 343.515 2.747 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CC/C=C\c2ccccc2)CN1C(=O)CN1CCCC1 ZINC001507331122 1406895893 /nfs/dbraw/zinc/89/58/93/1406895893.db2.gz MOFBKMDGRIGGSI-XUFRIQMSSA-N 1 3 341.499 2.765 10 0 EFAEHO CC(C)CC1CCN(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)CC1 ZINC001478958125 1397597353 /nfs/dbraw/zinc/59/73/53/1397597353.db2.gz ZXQBVIPJYSMCIR-KRWDZBQOSA-N 1 3 340.556 2.726 10 0 EFAEHO CC(C)CC1CCN(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)CC1 ZINC001478958125 1397597357 /nfs/dbraw/zinc/59/73/57/1397597357.db2.gz ZXQBVIPJYSMCIR-KRWDZBQOSA-N 1 3 340.556 2.726 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N[C@@H](C)[C@@]12C[C@@H]1CCCC2 ZINC001478956785 1397597408 /nfs/dbraw/zinc/59/74/08/1397597408.db2.gz HKJMNLANZKADOF-LSTDLKDCSA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N[C@@H](C)[C@@]12C[C@@H]1CCCC2 ZINC001478956785 1397597412 /nfs/dbraw/zinc/59/74/12/1397597412.db2.gz HKJMNLANZKADOF-LSTDLKDCSA-N 1 3 338.540 2.526 10 0 EFAEHO CN(C(=O)NC[C@@H]1CC[N@@H+]1C1CCCCCC1)[C@@H]1CCCN(C)C1 ZINC001479142366 1397613087 /nfs/dbraw/zinc/61/30/87/1397613087.db2.gz JDUVFAFMSKZETM-ZWKOTPCHSA-N 1 3 336.524 2.519 10 0 EFAEHO CN(C(=O)NC[C@@H]1CC[N@H+]1C1CCCCCC1)[C@@H]1CCCN(C)C1 ZINC001479142366 1397613091 /nfs/dbraw/zinc/61/30/91/1397613091.db2.gz JDUVFAFMSKZETM-ZWKOTPCHSA-N 1 3 336.524 2.519 10 0 EFAEHO CC1CCC(C[NH2+][C@H]2C[C@@H](CNC(=O)C3(N(C)C)CCC3)C2)CC1 ZINC001479299178 1397671398 /nfs/dbraw/zinc/67/13/98/1397671398.db2.gz IIYLVWXNQKRSKT-OWCVQMPJSA-N 1 3 335.536 2.781 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CCc2ccccc2)C1 ZINC001479346162 1397697545 /nfs/dbraw/zinc/69/75/45/1397697545.db2.gz DFIFDYQNMUSIJH-TZRIAGMCSA-N 1 3 343.515 2.586 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2C[C@H]([NH2+]CCC3CCCCC3)C2)C1 ZINC001479398915 1397715072 /nfs/dbraw/zinc/71/50/72/1397715072.db2.gz JZNQVBLYUGEMBE-BHIYHBOVSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H]2C[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001479417695 1397721159 /nfs/dbraw/zinc/72/11/59/1397721159.db2.gz XHAKWEVMYAJKPR-WGSAOQKQSA-N 1 3 331.504 2.628 10 0 EFAEHO C[C@H](F)CC[NH2+][C@@H]1CC[C@H](CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001479494600 1397736628 /nfs/dbraw/zinc/73/66/28/1397736628.db2.gz IUHTXCINWODITF-TXPKVOOTSA-N 1 3 349.494 2.984 10 0 EFAEHO CC[C@@H](C(=O)N1CCCCC[C@H]([NH2+]CCCOC(C)C)C1)N(C)C ZINC001479695291 1397767216 /nfs/dbraw/zinc/76/72/16/1397767216.db2.gz VIONIMWIXSJXMO-ROUUACIJSA-N 1 3 341.540 2.503 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCCC[C@H]1CN(C)Cc1cccc(F)c1 ZINC001479739345 1397792824 /nfs/dbraw/zinc/79/28/24/1397792824.db2.gz VUVZSXBJEJGTDB-IBGZPJMESA-N 1 3 349.494 2.980 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCCC[C@H]1CN(C)Cc1cccc(F)c1 ZINC001479739345 1397792829 /nfs/dbraw/zinc/79/28/29/1397792829.db2.gz VUVZSXBJEJGTDB-IBGZPJMESA-N 1 3 349.494 2.980 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001479774902 1397839650 /nfs/dbraw/zinc/83/96/50/1397839650.db2.gz MGANTQHACYZXMK-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001479774902 1397839656 /nfs/dbraw/zinc/83/96/56/1397839656.db2.gz MGANTQHACYZXMK-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO CN(CC(=O)NCCC[N@H+](C)Cc1cc2ccccc2o1)C1CCC1 ZINC001479775600 1397841825 /nfs/dbraw/zinc/84/18/25/1397841825.db2.gz BUKHCRGWZOMVGW-UHFFFAOYSA-N 1 3 343.471 2.855 10 0 EFAEHO CN(CC(=O)NCCC[N@@H+](C)Cc1cc2ccccc2o1)C1CCC1 ZINC001479775600 1397841831 /nfs/dbraw/zinc/84/18/31/1397841831.db2.gz BUKHCRGWZOMVGW-UHFFFAOYSA-N 1 3 343.471 2.855 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C ZINC001479777506 1397845371 /nfs/dbraw/zinc/84/53/71/1397845371.db2.gz RRRCBVBGAMBTSR-SFHVURJKSA-N 1 3 337.483 2.658 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C ZINC001479777506 1397845377 /nfs/dbraw/zinc/84/53/77/1397845377.db2.gz RRRCBVBGAMBTSR-SFHVURJKSA-N 1 3 337.483 2.658 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001479796080 1397875557 /nfs/dbraw/zinc/87/55/57/1397875557.db2.gz BKAQTNKEJBIBDZ-CRAIPNDOSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001479796080 1397875561 /nfs/dbraw/zinc/87/55/61/1397875561.db2.gz BKAQTNKEJBIBDZ-CRAIPNDOSA-N 1 3 329.504 2.683 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)CCCNC(=O)CN(C)CC(C)(C)C ZINC001479797135 1397876390 /nfs/dbraw/zinc/87/63/90/1397876390.db2.gz UAASAOFXGLKFKY-UHFFFAOYSA-N 1 3 333.520 2.911 10 0 EFAEHO Cc1ccccc1C[N@H+](C)CCCNC(=O)CN(C)CC(C)(C)C ZINC001479797135 1397876398 /nfs/dbraw/zinc/87/63/98/1397876398.db2.gz UAASAOFXGLKFKY-UHFFFAOYSA-N 1 3 333.520 2.911 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@H]1C(=O)NCCCN(C)CCC(F)(F)F ZINC001479799965 1397884863 /nfs/dbraw/zinc/88/48/63/1397884863.db2.gz FFLCTMFBYDNCNQ-AWEZNQCLSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@H]1C(=O)NCCCN(C)CCC(F)(F)F ZINC001479799965 1397884870 /nfs/dbraw/zinc/88/48/70/1397884870.db2.gz FFLCTMFBYDNCNQ-AWEZNQCLSA-N 1 3 337.430 2.640 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](CC)CCC(F)(F)F ZINC001479861080 1397964432 /nfs/dbraw/zinc/96/44/32/1397964432.db2.gz FSJYMVZMFQRMKM-AWEZNQCLSA-N 1 3 337.430 2.641 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](CC)CCC(F)(F)F ZINC001479861080 1397964433 /nfs/dbraw/zinc/96/44/33/1397964433.db2.gz FSJYMVZMFQRMKM-AWEZNQCLSA-N 1 3 337.430 2.641 10 0 EFAEHO CCCCCC[NH+]1CCC2(C[C@H]2NC(=O)CN2CC[C@H](C)C2)CC1 ZINC001479985128 1398070732 /nfs/dbraw/zinc/07/07/32/1398070732.db2.gz KYFQEKQCZLSUIR-ZWKOTPCHSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)CCCC[NH+](C)C)C2)c1 ZINC001480167085 1398138345 /nfs/dbraw/zinc/13/83/45/1398138345.db2.gz HGYAUSYZFICQFE-QAQDUYKDSA-N 1 3 335.467 2.603 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2sccc2Cl)C1)C1CCC1 ZINC001480207824 1398165330 /nfs/dbraw/zinc/16/53/30/1398165330.db2.gz HXDPAQDULOBYHD-TXEJJXNPSA-N 1 3 341.908 2.623 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CNC(=O)[C@@H]2CCCCN2C(C)C)cc1F ZINC001480548982 1398202281 /nfs/dbraw/zinc/20/22/81/1398202281.db2.gz OYHUMJDCDDBIAO-APWZRJJASA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]Cc1ccc2ccccc2c1 ZINC001480595608 1398236092 /nfs/dbraw/zinc/23/60/92/1398236092.db2.gz CKPAROABDHXYDY-INIZCTEOSA-N 1 3 327.472 2.774 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](C[NH2+]CCC(C)(C)C)C1)CC(C)(C)C ZINC001480664649 1398271059 /nfs/dbraw/zinc/27/10/59/1398271059.db2.gz CGFZYJGDYLEMGH-INIZCTEOSA-N 1 3 325.541 2.839 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001480679972 1398278981 /nfs/dbraw/zinc/27/89/81/1398278981.db2.gz FLMNOMOVSBCSSM-WMZOPIPTSA-N 1 3 331.504 2.846 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC001480683177 1398280750 /nfs/dbraw/zinc/28/07/50/1398280750.db2.gz KOPHPJRZWCROGX-HNAYVOBHSA-N 1 3 347.478 2.591 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[N@H+](C)C1)Cc1ccc(C2CCC2)cc1 ZINC001493058503 1398403312 /nfs/dbraw/zinc/40/33/12/1398403312.db2.gz MQVRNSVKWSSVSR-FQEVSTJZSA-N 1 3 343.515 2.844 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[N@@H+](C)C1)Cc1ccc(C2CCC2)cc1 ZINC001493058503 1398403314 /nfs/dbraw/zinc/40/33/14/1398403314.db2.gz MQVRNSVKWSSVSR-FQEVSTJZSA-N 1 3 343.515 2.844 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N1CCC[C@@H]1CNC(=O)CC[NH+](C)C ZINC001493134443 1398469081 /nfs/dbraw/zinc/46/90/81/1398469081.db2.gz WKZJNLJVXYYLJE-MSOLQXFVSA-N 1 3 335.467 2.809 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N1CCCC1 ZINC001493223627 1398543801 /nfs/dbraw/zinc/54/38/01/1398543801.db2.gz QPFSPUNVPDDIAU-QGZVFWFLSA-N 1 3 347.547 2.879 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N1CCCC1 ZINC001493223627 1398543811 /nfs/dbraw/zinc/54/38/11/1398543811.db2.gz QPFSPUNVPDDIAU-QGZVFWFLSA-N 1 3 347.547 2.879 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC001493265949 1398573942 /nfs/dbraw/zinc/57/39/42/1398573942.db2.gz AKZCUYJEZQAWBZ-JKSUJKDBSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+](CC[C@H]2CCCC2(F)F)C1 ZINC001493265949 1398573946 /nfs/dbraw/zinc/57/39/46/1398573946.db2.gz AKZCUYJEZQAWBZ-JKSUJKDBSA-N 1 3 345.478 2.590 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1CC[C@H](C)C1)[C@H]1CCc2ccccc21 ZINC001493317818 1398609675 /nfs/dbraw/zinc/60/96/75/1398609675.db2.gz GZAWIRQURYAPIL-PXNSSMCTSA-N 1 3 343.515 2.844 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1CC[C@H](C)C1)[C@H]1CCc2ccccc21 ZINC001493317818 1398609677 /nfs/dbraw/zinc/60/96/77/1398609677.db2.gz GZAWIRQURYAPIL-PXNSSMCTSA-N 1 3 343.515 2.844 10 0 EFAEHO CCc1ccccc1CN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)C1CC1 ZINC001493436836 1398707032 /nfs/dbraw/zinc/70/70/32/1398707032.db2.gz ZPBWHZNEZALYDA-KRWDZBQOSA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1ccccc1CN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)C1CC1 ZINC001493436836 1398707037 /nfs/dbraw/zinc/70/70/37/1398707037.db2.gz ZPBWHZNEZALYDA-KRWDZBQOSA-N 1 3 343.515 2.671 10 0 EFAEHO CN(CCNC/C=C\Cl)C(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001493670514 1398797253 /nfs/dbraw/zinc/79/72/53/1398797253.db2.gz PUSCZJDKZRWTRE-DIEDAUMRSA-N 1 3 327.900 2.584 10 0 EFAEHO CN(CCNC/C=C\Cl)C(=O)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001493670514 1398797255 /nfs/dbraw/zinc/79/72/55/1398797255.db2.gz PUSCZJDKZRWTRE-DIEDAUMRSA-N 1 3 327.900 2.584 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)[C@H](C)[NH+]2CCCCCC2)c1 ZINC001493716370 1398830816 /nfs/dbraw/zinc/83/08/16/1398830816.db2.gz CQFSKPDZCOAMER-KRWDZBQOSA-N 1 3 349.494 2.947 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N(C)CC[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)c1 ZINC001493803906 1398894642 /nfs/dbraw/zinc/89/46/42/1398894642.db2.gz UTQWEVCSZGWFGD-POAQFYNOSA-N 1 3 343.515 2.846 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]CC1CCC(F)(F)CC1 ZINC001493806079 1398895538 /nfs/dbraw/zinc/89/55/38/1398895538.db2.gz FJFZCHSICPLQMW-MRXNPFEDSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]([NH2+]CCCF)c1ccccc1 ZINC001493889661 1398957078 /nfs/dbraw/zinc/95/70/78/1398957078.db2.gz UXVMBXSSVOYYQF-ROUUACIJSA-N 1 3 335.467 2.666 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCC2=CCCCC2)CC1 ZINC001493922981 1398978477 /nfs/dbraw/zinc/97/84/77/1398978477.db2.gz YLIUBQMBYMZUHM-KDURUIRLSA-N 1 3 345.531 2.894 10 0 EFAEHO CCCN(C(=O)[C@@H](C)[NH+]1CCCCCC1)[C@@H]1CCN(CCCF)C1 ZINC001493968557 1399019797 /nfs/dbraw/zinc/01/97/97/1399019797.db2.gz IYJZOVFAVLHBGI-QZTJIDSGSA-N 1 3 341.515 2.923 10 0 EFAEHO CCCN(C(=O)[C@@H](C)N1CCCCCC1)[C@@H]1CC[N@H+](CCCF)C1 ZINC001493968557 1399019800 /nfs/dbraw/zinc/01/98/00/1399019800.db2.gz IYJZOVFAVLHBGI-QZTJIDSGSA-N 1 3 341.515 2.923 10 0 EFAEHO CCCN(C(=O)[C@@H](C)N1CCCCCC1)[C@@H]1CC[N@@H+](CCCF)C1 ZINC001493968557 1399019803 /nfs/dbraw/zinc/01/98/03/1399019803.db2.gz IYJZOVFAVLHBGI-QZTJIDSGSA-N 1 3 341.515 2.923 10 0 EFAEHO CC[NH2+][C@H](CCNC(=O)[C@H]1CCCCN1CC)Cc1ccccc1 ZINC001507388669 1407001037 /nfs/dbraw/zinc/00/10/37/1407001037.db2.gz IIBUJZNJZBLYJK-RTBURBONSA-N 1 3 331.504 2.588 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2CC[N@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001494056340 1399096072 /nfs/dbraw/zinc/09/60/72/1399096072.db2.gz VPMZCPGWDOSOFA-MSOLQXFVSA-N 1 3 347.547 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2CC[N@@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001494056340 1399096076 /nfs/dbraw/zinc/09/60/76/1399096076.db2.gz VPMZCPGWDOSOFA-MSOLQXFVSA-N 1 3 347.547 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@@H]2CC[N@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001494056354 1399096367 /nfs/dbraw/zinc/09/63/67/1399096367.db2.gz VPMZCPGWDOSOFA-ZWKOTPCHSA-N 1 3 347.547 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@@H]2CC[N@@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001494056354 1399096372 /nfs/dbraw/zinc/09/63/72/1399096372.db2.gz VPMZCPGWDOSOFA-ZWKOTPCHSA-N 1 3 347.547 2.737 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@H](CCNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001494056829 1399097332 /nfs/dbraw/zinc/09/73/32/1399097332.db2.gz XZNZIWBUUDIBLY-OALUTQOASA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@H](CCNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001494056829 1399097339 /nfs/dbraw/zinc/09/73/39/1399097339.db2.gz XZNZIWBUUDIBLY-OALUTQOASA-N 1 3 343.515 2.665 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CCC[N@H+](CCCCCF)C1)N1CCCCC1 ZINC001494270966 1399247823 /nfs/dbraw/zinc/24/78/23/1399247823.db2.gz XEGXGEXHLHECHM-QGZVFWFLSA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CCC[N@@H+](CCCCCF)C1)N1CCCCC1 ZINC001494270966 1399247828 /nfs/dbraw/zinc/24/78/28/1399247828.db2.gz XEGXGEXHLHECHM-QGZVFWFLSA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)c1ccccc1CN1CC(CNC(=O)C[C@H]2CC[N@H+](C)C2)C1 ZINC001494614366 1399400842 /nfs/dbraw/zinc/40/08/42/1399400842.db2.gz FQYVQWDURNWWLI-QGZVFWFLSA-N 1 3 343.515 2.700 10 0 EFAEHO CC(C)c1ccccc1CN1CC(CNC(=O)C[C@H]2CC[N@@H+](C)C2)C1 ZINC001494614366 1399400844 /nfs/dbraw/zinc/40/08/44/1399400844.db2.gz FQYVQWDURNWWLI-QGZVFWFLSA-N 1 3 343.515 2.700 10 0 EFAEHO CCC/C=C\CCN1C[C@@H]2C[C@H]1CN2C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001494658381 1399418479 /nfs/dbraw/zinc/41/84/79/1399418479.db2.gz HKVCZQMNCBMQJW-ITVKQWQRSA-N 1 3 333.520 2.892 10 0 EFAEHO CCC/C=C\CCN1C[C@@H]2C[C@H]1CN2C(=O)CC[C@H]1CCC[N@H+]1C ZINC001494658381 1399418482 /nfs/dbraw/zinc/41/84/82/1399418482.db2.gz HKVCZQMNCBMQJW-ITVKQWQRSA-N 1 3 333.520 2.892 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1)N(C)C ZINC001494723282 1399443404 /nfs/dbraw/zinc/44/34/04/1399443404.db2.gz VGGFELQNXRIICH-HRCADAONSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CC[C@@H]2CCCC2(F)F)C1)N(C)C ZINC001494723282 1399443406 /nfs/dbraw/zinc/44/34/06/1399443406.db2.gz VGGFELQNXRIICH-HRCADAONSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)=CCN1CC[C@H](N(C)C(=O)[C@H](C(C)C)[NH+]2CCCCC2)C1 ZINC001494873446 1399520107 /nfs/dbraw/zinc/52/01/07/1399520107.db2.gz BQTHXYDJBLOPPK-OALUTQOASA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)=CCN1CC[C@H](N(C)C(=O)[C@@H](C(C)C)[NH+]2CCCCC2)C1 ZINC001494873447 1399520207 /nfs/dbraw/zinc/52/02/07/1399520207.db2.gz BQTHXYDJBLOPPK-RBUKOAKNSA-N 1 3 335.536 2.996 10 0 EFAEHO CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@H+](CC2CC2)C1 ZINC001494911631 1399550317 /nfs/dbraw/zinc/55/03/17/1399550317.db2.gz WOWVRRCHMGILCG-LPHOPBHVSA-N 1 3 339.499 2.532 10 0 EFAEHO CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@@H+](CC2CC2)C1 ZINC001494911631 1399550319 /nfs/dbraw/zinc/55/03/19/1399550319.db2.gz WOWVRRCHMGILCG-LPHOPBHVSA-N 1 3 339.499 2.532 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCc1ccccc1F ZINC001495037629 1399618908 /nfs/dbraw/zinc/61/89/08/1399618908.db2.gz ZRNDYPBUIOYBKD-KRWDZBQOSA-N 1 3 349.494 2.727 10 0 EFAEHO C[C@H](F)CC[NH2+][C@H]1CN(C(=O)C(C)(C)N2CCCCC2)CC1(C)C ZINC001507431000 1407045176 /nfs/dbraw/zinc/04/51/76/1407045176.db2.gz IOQPRUKOOSWSEY-HOTGVXAUSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H](C(=O)NC1(C[NH2+]CCCF)CCCC1)N1CCCCCC1 ZINC001495190817 1399725324 /nfs/dbraw/zinc/72/53/24/1399725324.db2.gz FTXHPAOWLDCUQD-MRXNPFEDSA-N 1 3 327.488 2.629 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@@](C)(C[NH2+]CCc2cccs2)C2CC2)C1 ZINC001495278818 1399788038 /nfs/dbraw/zinc/78/80/38/1399788038.db2.gz XPTKNWVKPDOQQY-BEFAXECRSA-N 1 3 349.544 2.507 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)N[C@@](C)(CNCc2ccccc2F)C2CC2)C1 ZINC001495294876 1399800370 /nfs/dbraw/zinc/80/03/70/1399800370.db2.gz VWXLNCOREVQGTO-YWZLYKJASA-N 1 3 347.478 2.542 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)N[C@@](C)(CNCc2ccccc2F)C2CC2)C1 ZINC001495294876 1399800383 /nfs/dbraw/zinc/80/03/83/1399800383.db2.gz VWXLNCOREVQGTO-YWZLYKJASA-N 1 3 347.478 2.542 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@](C)(NC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001495304013 1399814584 /nfs/dbraw/zinc/81/45/84/1399814584.db2.gz SSZOUJPUFGRNCU-FQEVSTJZSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H]2CCCN(C(=O)[C@@H]3CCCN3C)C2)cs1 ZINC001495348078 1399885540 /nfs/dbraw/zinc/88/55/40/1399885540.db2.gz VMJDJNXEQCNZKI-WMZOPIPTSA-N 1 3 349.544 2.869 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](CC[NH2+]CCC(C)(C)C)C1)N(C)C ZINC001495360133 1399904696 /nfs/dbraw/zinc/90/46/96/1399904696.db2.gz RBFGDHHBXBPOCP-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C)C[NH2+]CC[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001495377155 1399923075 /nfs/dbraw/zinc/92/30/75/1399923075.db2.gz JUGKLXVCVGHQJM-MJGOQNOKSA-N 1 3 337.552 2.983 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc(F)cc2C)C(C)(C)C1 ZINC001507451341 1407069071 /nfs/dbraw/zinc/06/90/71/1407069071.db2.gz PMSRSFNYWVXGNY-GOSISDBHSA-N 1 3 349.494 2.803 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(CC[NH2+]CC[C@@H](C)F)CC1 ZINC001495438267 1399980609 /nfs/dbraw/zinc/98/06/09/1399980609.db2.gz TYKIATAPLPKLSR-AEFFLSMTSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(CC[NH2+]Cc2ccsc2)CC1 ZINC001495438254 1399980961 /nfs/dbraw/zinc/98/09/61/1399980961.db2.gz SPZUPCRTBOOYDS-UHFFFAOYSA-N 1 3 337.533 2.807 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)C[NH2+][C@H]1CCc2ccccc21 ZINC001495743280 1400217507 /nfs/dbraw/zinc/21/75/07/1400217507.db2.gz OFXBRNBABMDWHO-LPHOPBHVSA-N 1 3 345.531 2.994 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+]CC1CCC(C)(C)CC1 ZINC001495816273 1400291301 /nfs/dbraw/zinc/29/13/01/1400291301.db2.gz SXAHHWPPGRIZRA-MRXNPFEDSA-N 1 3 325.541 2.885 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]C[C@@H]3CC[C@@H]4C[C@@H]4C3)CCCC2)CCC1 ZINC001495919907 1400355706 /nfs/dbraw/zinc/35/57/06/1400355706.db2.gz XUUQEHPUGTXJBG-KURKYZTESA-N 1 3 347.547 2.926 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCC2([NH2+]CCCF)CCCC2)c1 ZINC001495963181 1400385467 /nfs/dbraw/zinc/38/54/67/1400385467.db2.gz DKAJKYAGPAURQX-UHFFFAOYSA-N 1 3 335.467 2.740 10 0 EFAEHO CCC/C=C/CC[NH+]1CC2(C1)CCN(C(=O)[C@@H]1CCCN1C)CC2 ZINC001495968043 1400388532 /nfs/dbraw/zinc/38/85/32/1400388532.db2.gz APDXYUQNZACRHO-QWNKOJSDSA-N 1 3 333.520 2.751 10 0 EFAEHO C[C@@H](CNCC=C(Cl)Cl)N(C)C(=O)C12CCC[NH+](CCC1)C2 ZINC001496095502 1400467714 /nfs/dbraw/zinc/46/77/14/1400467714.db2.gz DTBZTFDHWDRDJS-ZDUSSCGKSA-N 1 3 348.318 2.618 10 0 EFAEHO C[C@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1)N(C)C(=O)CN1CCCC1 ZINC001496230124 1400556994 /nfs/dbraw/zinc/55/69/94/1400556994.db2.gz QTPSPKYLILSPFG-CABCVRRESA-N 1 3 337.895 2.933 10 0 EFAEHO C[C@@H]([NH2+]C[C@H](C)N(C)C(=O)CN1CCCC1)c1ccc2c(c1)CCC2 ZINC001496230522 1400557403 /nfs/dbraw/zinc/55/74/03/1400557403.db2.gz XQTDJCZWHQRUJW-DLBZAZTESA-N 1 3 343.515 2.769 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+][C@@H]1CCc2c1cccc2F ZINC001496251147 1400572594 /nfs/dbraw/zinc/57/25/94/1400572594.db2.gz UBADHRFYRDNARP-KBXCAEBGSA-N 1 3 335.467 2.590 10 0 EFAEHO CC1CCN(CC(=O)N2CCCC[C@@H]2CC[NH2+]C/C=C\Cl)CC1 ZINC001496412726 1400714314 /nfs/dbraw/zinc/71/43/14/1400714314.db2.gz CPDXIPLPYMWSOC-INDRUJQFSA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1CC[NH2+]CC1CC(F)(F)C1 ZINC001496430676 1400726509 /nfs/dbraw/zinc/72/65/09/1400726509.db2.gz VBPCLOAXENSUPO-INIZCTEOSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H](C)[NH2+]Cc2cccc(F)c2)C1 ZINC001496466191 1400750293 /nfs/dbraw/zinc/75/02/93/1400750293.db2.gz ZRYBBFFZUULDLD-SJLPKXTDSA-N 1 3 349.494 2.883 10 0 EFAEHO CC[C@H](C)C[N@H+](C)CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001496507760 1400782598 /nfs/dbraw/zinc/78/25/98/1400782598.db2.gz CGPCXAOBMVRYPW-ROUUACIJSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001496507760 1400782602 /nfs/dbraw/zinc/78/26/02/1400782602.db2.gz CGPCXAOBMVRYPW-ROUUACIJSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001496507758 1400783115 /nfs/dbraw/zinc/78/31/15/1400783115.db2.gz CGPCXAOBMVRYPW-QZTJIDSGSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001496507758 1400783120 /nfs/dbraw/zinc/78/31/20/1400783120.db2.gz CGPCXAOBMVRYPW-QZTJIDSGSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)CC[C@H]1CCc2ccccc21 ZINC001496846078 1401036062 /nfs/dbraw/zinc/03/60/62/1401036062.db2.gz ZGBCUSDRCKJWGW-LJQANCHMSA-N 1 3 345.531 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)CC[C@H]1CCc2ccccc21 ZINC001496846078 1401036069 /nfs/dbraw/zinc/03/60/69/1401036069.db2.gz ZGBCUSDRCKJWGW-LJQANCHMSA-N 1 3 345.531 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2CC2=CCCCC2)C1 ZINC001496864702 1401060464 /nfs/dbraw/zinc/06/04/64/1401060464.db2.gz AGMBSWQPDNCKBO-RTBURBONSA-N 1 3 333.520 2.750 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2CC2=CCCCC2)C1 ZINC001496864702 1401060470 /nfs/dbraw/zinc/06/04/70/1401060470.db2.gz AGMBSWQPDNCKBO-RTBURBONSA-N 1 3 333.520 2.750 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@H]2C[NH2+]CCC2CCCC2)CCC1 ZINC001496889442 1401079051 /nfs/dbraw/zinc/07/90/51/1401079051.db2.gz SGSMKJUGJDIUOI-ROUUACIJSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@@H](CC[NH2+]C/C=C/c1ccccc1)NC(=O)C1(N(C)C)CCC1 ZINC001497205231 1401218684 /nfs/dbraw/zinc/21/86/84/1401218684.db2.gz INBDBVCERDMFDH-ZBZNSMLMSA-N 1 3 329.488 2.669 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001497205754 1401218791 /nfs/dbraw/zinc/21/87/91/1401218791.db2.gz LYRJJNWLLAOJLO-YOEHRIQHSA-N 1 3 339.911 2.911 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC[C@@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001497271234 1401260718 /nfs/dbraw/zinc/26/07/18/1401260718.db2.gz LQITUKUFIZLTGZ-MAUKXSAKSA-N 1 3 331.504 2.630 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(F)cc1 ZINC001497329827 1401307084 /nfs/dbraw/zinc/30/70/84/1401307084.db2.gz DUTNFQWGJSYTRE-YJBOKZPZSA-N 1 3 335.467 2.685 10 0 EFAEHO CCc1ccc(C[NH2+]CCN(CC)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001497454711 1401387358 /nfs/dbraw/zinc/38/73/58/1401387358.db2.gz MIYJIAOJXOVLHG-KRWDZBQOSA-N 1 3 331.504 2.529 10 0 EFAEHO CCN(CC[NH2+]CC1CCC(F)(F)CC1)C(=O)CN(C)C(C)C ZINC001497501543 1401423642 /nfs/dbraw/zinc/42/36/42/1401423642.db2.gz XNFDCZJOOQXNEY-UHFFFAOYSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@H]([NH2+]C/C=C/CNC(=O)[C@@H]1CCCN1C)c1ccc(F)cc1 ZINC001497550301 1401450652 /nfs/dbraw/zinc/45/06/52/1401450652.db2.gz YQUSFIUOQMUMLQ-JDTHPWDHSA-N 1 3 333.451 2.633 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC/C=C/CNCc1cc(F)ccc1C ZINC001497600104 1401485508 /nfs/dbraw/zinc/48/55/08/1401485508.db2.gz PJOWFFOBKQEISZ-PXPVJAHISA-N 1 3 347.478 2.771 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC/C=C/CNCc1cc(F)ccc1C ZINC001497600104 1401485512 /nfs/dbraw/zinc/48/55/12/1401485512.db2.gz PJOWFFOBKQEISZ-PXPVJAHISA-N 1 3 347.478 2.771 10 0 EFAEHO O=C(NC/C=C\CNCc1ccsc1)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001497612109 1401493072 /nfs/dbraw/zinc/49/30/72/1401493072.db2.gz NEZRTBOOBDIFRI-SNSIWUOESA-N 1 3 333.501 2.527 10 0 EFAEHO O=C(NC/C=C\CNCc1ccsc1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001497612109 1401493076 /nfs/dbraw/zinc/49/30/76/1401493076.db2.gz NEZRTBOOBDIFRI-SNSIWUOESA-N 1 3 333.501 2.527 10 0 EFAEHO CC[C@H](F)CNC/C=C/CNC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001497663120 1401532328 /nfs/dbraw/zinc/53/23/28/1401532328.db2.gz PCIFTKLBQKJIJR-RTQGNFRKSA-N 1 3 339.499 2.794 10 0 EFAEHO CC[C@H](F)CNC/C=C/CNC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001497663120 1401532332 /nfs/dbraw/zinc/53/23/32/1401532332.db2.gz PCIFTKLBQKJIJR-RTQGNFRKSA-N 1 3 339.499 2.794 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\C[NH2+][C@@H]1CCc2ccccc21)N(C)C ZINC001497672773 1401539019 /nfs/dbraw/zinc/53/90/19/1401539019.db2.gz VFFVXHVCIZLHCY-YZBXUTEPSA-N 1 3 329.488 2.522 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/C[NH2+][C@H]1CCc2c1cccc2F)N(C)C ZINC001497673309 1401540100 /nfs/dbraw/zinc/54/01/00/1401540100.db2.gz XMTQDZRCPYRNEI-OBNUAKFSSA-N 1 3 347.478 2.661 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1cc2ccccc2o1 ZINC001497815581 1401670899 /nfs/dbraw/zinc/67/08/99/1401670899.db2.gz BNALZIQUPGHRQV-QAPCUYQASA-N 1 3 343.471 2.900 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1cc2ccccc2o1 ZINC001497815581 1401670908 /nfs/dbraw/zinc/67/09/08/1401670908.db2.gz BNALZIQUPGHRQV-QAPCUYQASA-N 1 3 343.471 2.900 10 0 EFAEHO C[C@H](C[NH2+]CC1CCC(C)CC1)NC(=O)CN(C)CC(C)(C)C ZINC001497910179 1401735132 /nfs/dbraw/zinc/73/51/32/1401735132.db2.gz HKKQZFQSDMOWKP-AQFXKWCLSA-N 1 3 325.541 2.885 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)CCC[NH+]2CCCCC2)c1 ZINC001497985834 1401794006 /nfs/dbraw/zinc/79/40/06/1401794006.db2.gz MOPHTWHKQVBHKN-QGZVFWFLSA-N 1 3 349.494 2.995 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(C)c(C)c1 ZINC001497992926 1401798929 /nfs/dbraw/zinc/79/89/29/1401798929.db2.gz JGKINPIIGSREAO-IEBWSBKVSA-N 1 3 331.504 2.772 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@H]2CCCN2C(C)C)cc1C ZINC001498041508 1401825636 /nfs/dbraw/zinc/82/56/36/1401825636.db2.gz BZTYCSYQTPRHLS-PKOBYXMFSA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@@H](CNCC=C(Cl)Cl)NC(=O)c1cccc(C[NH+](C)C)c1 ZINC001498197299 1401904541 /nfs/dbraw/zinc/90/45/41/1401904541.db2.gz JDSCQKGLQJFHJT-LBPRGKRZSA-N 1 3 344.286 2.775 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)cc1 ZINC001498305696 1401993696 /nfs/dbraw/zinc/99/36/96/1401993696.db2.gz MIYBZGUAVBAWIF-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)cc1 ZINC001498305696 1401993701 /nfs/dbraw/zinc/99/37/01/1401993701.db2.gz MIYBZGUAVBAWIF-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)C[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001498354909 1402032758 /nfs/dbraw/zinc/03/27/58/1402032758.db2.gz GMRMLPMMDDFYEG-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)C[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001498354909 1402032762 /nfs/dbraw/zinc/03/27/62/1402032762.db2.gz GMRMLPMMDDFYEG-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)C[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001498354910 1402032808 /nfs/dbraw/zinc/03/28/08/1402032808.db2.gz GMRMLPMMDDFYEG-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)C[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001498354910 1402032813 /nfs/dbraw/zinc/03/28/13/1402032813.db2.gz GMRMLPMMDDFYEG-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]CCCF)C(C)(C)C ZINC001507969082 1407227163 /nfs/dbraw/zinc/22/71/63/1407227163.db2.gz AUMDAILHPYHHKP-CVEARBPZSA-N 1 3 329.504 2.587 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCCC[C@H]1C[NH2+]CCC(F)(F)F ZINC001498505880 1402151038 /nfs/dbraw/zinc/15/10/38/1402151038.db2.gz UZZXZWDRZRCHPH-KBPBESRZSA-N 1 3 337.430 2.544 10 0 EFAEHO CN(CCC[NH2+][C@@H]1CCc2c1cccc2Cl)C(=O)[C@H]1CCCN1C ZINC001498525732 1402160465 /nfs/dbraw/zinc/16/04/65/1402160465.db2.gz DSMTXACBZVISPN-QZTJIDSGSA-N 1 3 349.906 2.860 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]CCCN(C)C(=O)[C@H]2CCCN2C)c1 ZINC001498525415 1402161047 /nfs/dbraw/zinc/16/10/47/1402161047.db2.gz AAISFULASNKYID-IEBWSBKVSA-N 1 3 331.504 2.897 10 0 EFAEHO CN(CCC[NH2+]CC[C@H]1CCc2ccccc21)C(=O)Cc1c[nH]cn1 ZINC001498618351 1402204735 /nfs/dbraw/zinc/20/47/35/1402204735.db2.gz AHTIHZIOQGMQLG-QGZVFWFLSA-N 1 3 340.471 2.510 10 0 EFAEHO CCCN(C)CC(=O)N(C)CCC[NH2+][C@H]1CCc2c1cccc2F ZINC001498644401 1402222231 /nfs/dbraw/zinc/22/22/31/1402222231.db2.gz YHDPCGWRSAUTIV-SFHVURJKSA-N 1 3 335.467 2.593 10 0 EFAEHO CC(C)c1ccc(C[NH2+]CCCN(C)C(=O)CN2CCCC2)cc1 ZINC001498654568 1402229352 /nfs/dbraw/zinc/22/93/52/1402229352.db2.gz BNBLWRYVAINQPA-UHFFFAOYSA-N 1 3 331.504 2.844 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C[NH2+]CCc1ccccc1)C1CC1 ZINC001498761827 1402273451 /nfs/dbraw/zinc/27/34/51/1402273451.db2.gz SMMFKLDJFGULHP-WOJBJXKFSA-N 1 3 343.515 2.586 10 0 EFAEHO CC(C)(C(=O)N[C@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)N1CCCC1 ZINC001498802982 1402300002 /nfs/dbraw/zinc/30/00/02/1402300002.db2.gz OJAGXLATCNQLOC-GOSISDBHSA-N 1 3 347.547 2.926 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+]CC1CC(C)(C)C1)C1CC1)CC(C)(C)C ZINC001498822006 1402314431 /nfs/dbraw/zinc/31/44/31/1402314431.db2.gz JSTUYWYWWQQOOB-KRWDZBQOSA-N 1 3 337.552 2.885 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C[NH2+][C@H]1CCc2ccccc21)C1CC1 ZINC001498861715 1402341465 /nfs/dbraw/zinc/34/14/65/1402341465.db2.gz MUTJKGWHXYQAFJ-RBUKOAKNSA-N 1 3 329.488 2.500 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@@H](NC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001498875027 1402350787 /nfs/dbraw/zinc/35/07/87/1402350787.db2.gz MLWMJQQNCFUYBR-LJQANCHMSA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]CC1CC(F)(F)C1 ZINC001498906696 1402373020 /nfs/dbraw/zinc/37/30/20/1402373020.db2.gz JNJRLJFGGXONOQ-HZPDHXFCSA-N 1 3 345.478 2.589 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3cccc(Cl)c3)CC2)CC[N@@H+]1C ZINC001499231262 1402530415 /nfs/dbraw/zinc/53/04/15/1402530415.db2.gz XHMXETXKOKRNLT-DLBZAZTESA-N 1 3 349.906 2.809 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3cccc(Cl)c3)CC2)CC[N@H+]1C ZINC001499231262 1402530418 /nfs/dbraw/zinc/53/04/18/1402530418.db2.gz XHMXETXKOKRNLT-DLBZAZTESA-N 1 3 349.906 2.809 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]C2(CNC(=O)CN(C)C3CCC3)CC2)c1 ZINC001499250967 1402537964 /nfs/dbraw/zinc/53/79/64/1402537964.db2.gz QEUKDZQHOHKPTI-INIZCTEOSA-N 1 3 329.488 2.779 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)C1CC[NH+](CCC(F)(F)F)CC1 ZINC001508059972 1407271335 /nfs/dbraw/zinc/27/13/35/1407271335.db2.gz VBZWDFWHQPRGAR-CYBMUJFWSA-N 1 3 349.441 2.640 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+][C@H]2CCc3c2cccc3Cl)CC1 ZINC001499426008 1402608099 /nfs/dbraw/zinc/60/80/99/1402608099.db2.gz ACXZMJSTQVNFAV-KRWDZBQOSA-N 1 3 349.906 2.908 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(C1)CCC[N@H+](CC1CC(C)C1)C2 ZINC001499577430 1402695609 /nfs/dbraw/zinc/69/56/09/1402695609.db2.gz VJEKEVQUJOWULG-AFMYVXGZSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(C1)CCC[N@@H+](CC1CC(C)C1)C2 ZINC001499577430 1402695612 /nfs/dbraw/zinc/69/56/12/1402695612.db2.gz VJEKEVQUJOWULG-AFMYVXGZSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@]2(CC[N@H+](CCCCCF)C2)C1)N(C)C ZINC001499609266 1402714774 /nfs/dbraw/zinc/71/47/74/1402714774.db2.gz CSRCQDDEVQEGIJ-IEBWSBKVSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@]2(CC[N@@H+](CCCCCF)C2)C1)N(C)C ZINC001499609266 1402714775 /nfs/dbraw/zinc/71/47/75/1402714775.db2.gz CSRCQDDEVQEGIJ-IEBWSBKVSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](F)CN1CCC([C@H](C)NC(=O)CC2CC[NH+](C)CC2)CC1 ZINC001508080358 1407286307 /nfs/dbraw/zinc/28/63/07/1407286307.db2.gz CFRYMDRUJCEYLQ-YJBOKZPZSA-N 1 3 341.515 2.683 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001499902211 1402846631 /nfs/dbraw/zinc/84/66/31/1402846631.db2.gz VRXUTUMKPQCDAL-ZIAGYGMSSA-N 1 3 348.318 2.760 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001499902211 1402846633 /nfs/dbraw/zinc/84/66/33/1402846633.db2.gz VRXUTUMKPQCDAL-ZIAGYGMSSA-N 1 3 348.318 2.760 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C1CC[NH+](CCC(C)(C)C)CC1 ZINC001508087935 1407291031 /nfs/dbraw/zinc/29/10/31/1407291031.db2.gz PUCIQTYSVQCAGN-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@H](C(F)(F)F)[C@@H](NCC=C(C)C)C1 ZINC001508087680 1407291307 /nfs/dbraw/zinc/29/13/07/1407291307.db2.gz QQVBNUCRYUQZNR-GJZGRUSLSA-N 1 3 349.441 2.663 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@H](C(F)(F)F)[C@@H](NCC=C(C)C)C1 ZINC001508087680 1407291310 /nfs/dbraw/zinc/29/13/10/1407291310.db2.gz QQVBNUCRYUQZNR-GJZGRUSLSA-N 1 3 349.441 2.663 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H](CNCc1ccccc1F)C1CCCC1 ZINC001500107415 1402940431 /nfs/dbraw/zinc/94/04/31/1402940431.db2.gz RJJHETSQSNOCAH-SFHVURJKSA-N 1 3 335.467 2.542 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@](C)(C[NH2+]C/C=C/Cl)C2)c1 ZINC001500404496 1403101335 /nfs/dbraw/zinc/10/13/35/1403101335.db2.gz DXDJCJFWFDCEBA-NTPDMAOXSA-N 1 3 349.906 2.943 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)C1CC(NCc2cccc(F)c2Cl)C1 ZINC001508136167 1407310372 /nfs/dbraw/zinc/31/03/72/1407310372.db2.gz USCQXROTPAHZJF-UHFFFAOYSA-N 1 3 341.858 2.510 10 0 EFAEHO CCC[NH2+][C@@H](CNC(=O)CN1CC[C@@H](C)C1)c1ccccc1CC ZINC001501021733 1403409078 /nfs/dbraw/zinc/40/90/78/1403409078.db2.gz JRLAZWGUGDZLEH-APWZRJJASA-N 1 3 331.504 2.748 10 0 EFAEHO CCC[NH2+][C@H](CNC(=O)CN1CC[C@H](C)C1)c1ccccc1CC ZINC001501021737 1403409992 /nfs/dbraw/zinc/40/99/92/1403409992.db2.gz JRLAZWGUGDZLEH-QFBILLFUSA-N 1 3 331.504 2.748 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001501091119 1403436661 /nfs/dbraw/zinc/43/66/61/1403436661.db2.gz LDZZJSKIHZYGJP-IEBWSBKVSA-N 1 3 331.504 2.662 10 0 EFAEHO CCCC[NH2+]C[C@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@H]1C ZINC001501153407 1403462341 /nfs/dbraw/zinc/46/23/41/1403462341.db2.gz OUHKVYOECNMQIZ-APWZRJJASA-N 1 3 331.504 2.846 10 0 EFAEHO CC[C@@H](C)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1(N(C)C)CCC1)C2 ZINC001501165933 1403470069 /nfs/dbraw/zinc/47/00/69/1403470069.db2.gz AVUOOSAZPRIQBD-ZJPYXAASSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1(N(C)C)CCC1)C2 ZINC001501165933 1403470072 /nfs/dbraw/zinc/47/00/72/1403470072.db2.gz AVUOOSAZPRIQBD-ZJPYXAASSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N(CCNC/C=C\Cl)Cc2ccccc2)CC[N@@H+]1C ZINC001501193619 1403485796 /nfs/dbraw/zinc/48/57/96/1403485796.db2.gz KNINXIGCCPLTIY-ZQMLZLLSSA-N 1 3 349.906 2.698 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N(CCNC/C=C\Cl)Cc2ccccc2)CC[N@H+]1C ZINC001501193619 1403485799 /nfs/dbraw/zinc/48/57/99/1403485799.db2.gz KNINXIGCCPLTIY-ZQMLZLLSSA-N 1 3 349.906 2.698 10 0 EFAEHO CCCCC[N@H+]1C[C@H]2CN(C(=O)[C@@H]3CCCCN3C(C)C)C[C@H]2C1 ZINC001501233427 1403505852 /nfs/dbraw/zinc/50/58/52/1403505852.db2.gz XMESGVDWRIXZRB-OTWHNJEPSA-N 1 3 335.536 2.830 10 0 EFAEHO CCCCC[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3CCCCN3C(C)C)C[C@H]2C1 ZINC001501233427 1403505856 /nfs/dbraw/zinc/50/58/56/1403505856.db2.gz XMESGVDWRIXZRB-OTWHNJEPSA-N 1 3 335.536 2.830 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]CCC2CCCCC2)C1 ZINC001501604473 1403644000 /nfs/dbraw/zinc/64/40/00/1403644000.db2.gz RPCCVBJDQFBRNW-RTBURBONSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC1=CC[N@H+](CCCCCF)CC1 ZINC001508228026 1407364579 /nfs/dbraw/zinc/36/45/79/1407364579.db2.gz CEHIVSJSCHERPE-SFHVURJKSA-N 1 3 339.499 2.749 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC1=CC[N@@H+](CCCCCF)CC1 ZINC001508228026 1407364582 /nfs/dbraw/zinc/36/45/82/1407364582.db2.gz CEHIVSJSCHERPE-SFHVURJKSA-N 1 3 339.499 2.749 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCC[N@H+](Cc2ccsc2)CC1)C1CCC1 ZINC001502125674 1404018908 /nfs/dbraw/zinc/01/89/08/1404018908.db2.gz IAARCTHPZZWCLH-MRXNPFEDSA-N 1 3 335.517 2.703 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCC[N@@H+](Cc2ccsc2)CC1)C1CCC1 ZINC001502125674 1404018917 /nfs/dbraw/zinc/01/89/17/1404018917.db2.gz IAARCTHPZZWCLH-MRXNPFEDSA-N 1 3 335.517 2.703 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@H](NC(=O)CC[NH+]2CCCCC2)CC1 ZINC001502147456 1404047690 /nfs/dbraw/zinc/04/76/90/1404047690.db2.gz JOPVPCFMUHKEGF-SJORKVTESA-N 1 3 327.488 2.581 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[N@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001502385357 1404124035 /nfs/dbraw/zinc/12/40/35/1404124035.db2.gz QWOCVNFPMHDKNT-AQNXPRMDSA-N 1 3 349.563 2.935 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[N@@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001502385357 1404124043 /nfs/dbraw/zinc/12/40/43/1404124043.db2.gz QWOCVNFPMHDKNT-AQNXPRMDSA-N 1 3 349.563 2.935 10 0 EFAEHO CCC1([NH2+]Cc2cccc(F)c2)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001502508419 1404208918 /nfs/dbraw/zinc/20/89/18/1404208918.db2.gz UUZSIIUBIDYHCD-UHFFFAOYSA-N 1 3 344.434 2.652 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)[C@@H](CC)N(C)C)C2 ZINC001502543691 1404231683 /nfs/dbraw/zinc/23/16/83/1404231683.db2.gz LGHBMXFGBPRHML-HTJOGQSXSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@]2(C1)CCCN(C(=O)[C@@H](CC)N(C)C)C2 ZINC001502543691 1404231687 /nfs/dbraw/zinc/23/16/87/1404231687.db2.gz LGHBMXFGBPRHML-HTJOGQSXSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@]2(CCN(C[C@@H](F)CC)C2)C1 ZINC001502547807 1404240015 /nfs/dbraw/zinc/24/00/15/1404240015.db2.gz FTYSUNPMHYYFFP-HKUYNNGSSA-N 1 3 341.515 2.781 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@]2(CCN(C[C@@H](F)CC)C2)C1 ZINC001502547807 1404240019 /nfs/dbraw/zinc/24/00/19/1404240019.db2.gz FTYSUNPMHYYFFP-HKUYNNGSSA-N 1 3 341.515 2.781 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@H]1[NH2+]CCC(C)(C)C ZINC001502741738 1404320258 /nfs/dbraw/zinc/32/02/58/1404320258.db2.gz KMWUKERLVNUWQV-JKSUJKDBSA-N 1 3 325.541 2.837 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H]([NH2+]CCCc2ccc(C)cc2)C1 ZINC001502754561 1404326084 /nfs/dbraw/zinc/32/60/84/1404326084.db2.gz SUCYQCFACDTTHG-QUCCMNQESA-N 1 3 345.531 2.706 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC(C)([NH2+]CCCCC(F)(F)F)CC1 ZINC001502772242 1404335959 /nfs/dbraw/zinc/33/59/59/1404335959.db2.gz KTKHNZQTKUIMDA-CQSZACIVSA-N 1 3 349.441 2.784 10 0 EFAEHO CCCC[NH2+]C1(C)CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001502797887 1404349588 /nfs/dbraw/zinc/34/95/88/1404349588.db2.gz UWIVMLSLVNYRPT-IBGZPJMESA-N 1 3 341.515 2.970 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001724972852 1425183339 /nfs/dbraw/zinc/18/33/39/1425183339.db2.gz VCKVWWUKPROJRC-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCCC[N@H+]1CC[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001724972852 1425183348 /nfs/dbraw/zinc/18/33/48/1425183348.db2.gz VCKVWWUKPROJRC-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCCCN1CCc2ccccc2[C@H]1CNC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001503690914 1404498803 /nfs/dbraw/zinc/49/88/03/1404498803.db2.gz JHIBPLBEYBXNTI-UYAOXDASSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCCCN1CCc2ccccc2[C@H]1CNC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001503690914 1404498808 /nfs/dbraw/zinc/49/88/08/1404498808.db2.gz JHIBPLBEYBXNTI-UYAOXDASSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@H]1CC[N@H+](C)C1 ZINC001503690912 1404499401 /nfs/dbraw/zinc/49/94/01/1404499401.db2.gz JHIBPLBEYBXNTI-ICSRJNTNSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001503690912 1404499406 /nfs/dbraw/zinc/49/94/06/1404499406.db2.gz JHIBPLBEYBXNTI-ICSRJNTNSA-N 1 3 343.515 2.844 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N2CCC[C@H]2CN(C)CC=C(C)C)C1 ZINC001505443360 1404628530 /nfs/dbraw/zinc/62/85/30/1404628530.db2.gz IWXZQJYOPNJYPJ-OALUTQOASA-N 1 3 335.536 2.997 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N2CCC[C@H]2CN(C)CC=C(C)C)C1 ZINC001505443360 1404628547 /nfs/dbraw/zinc/62/85/47/1404628547.db2.gz IWXZQJYOPNJYPJ-OALUTQOASA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC1CC(NC(=O)CN(C)C2CCC2)C1 ZINC001505501993 1404729662 /nfs/dbraw/zinc/72/96/62/1404729662.db2.gz SPTXOXWXAMWBFJ-UHFFFAOYSA-N 1 3 343.515 2.772 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001505626094 1404870194 /nfs/dbraw/zinc/87/01/94/1404870194.db2.gz QVRVNZBMCLNAEB-HUUCEWRRSA-N 1 3 342.487 2.635 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@@H](C)[NH2+]Cc1cccc(F)c1 ZINC001505667277 1404915286 /nfs/dbraw/zinc/91/52/86/1404915286.db2.gz KKAZYJWSWHQSLR-HUUCEWRRSA-N 1 3 335.467 2.683 10 0 EFAEHO C[C@@H](NCC=C(Cl)Cl)[C@H](C)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001505667367 1404915477 /nfs/dbraw/zinc/91/54/77/1404915477.db2.gz LOKJYFUURUNALI-NEPJUHHUSA-N 1 3 336.307 2.663 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)CC(C)(C)C)cc1 ZINC001505694213 1404947601 /nfs/dbraw/zinc/94/76/01/1404947601.db2.gz LICIUCFPUKBFRU-ROUUACIJSA-N 1 3 347.547 2.998 10 0 EFAEHO C[C@@H](NC(=O)C12CC[NH+](CC1)C2)[C@H](C)NCc1cc2ccccc2o1 ZINC001505733784 1404999030 /nfs/dbraw/zinc/99/90/30/1404999030.db2.gz YAPFRNMVHOPIPN-LSDHHAIUSA-N 1 3 341.455 2.511 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001505735863 1405001944 /nfs/dbraw/zinc/00/19/44/1405001944.db2.gz PFWVWTHTDMUWKF-UONOGXRCSA-N 1 3 333.467 2.637 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[N@H+](C)CC1CC2(CCC2)C1 ZINC001505975865 1405297296 /nfs/dbraw/zinc/29/72/96/1405297296.db2.gz AEUSLLCOZBAXSU-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[N@@H+](C)CC1CC2(CCC2)C1 ZINC001505975865 1405297301 /nfs/dbraw/zinc/29/73/01/1405297301.db2.gz AEUSLLCOZBAXSU-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO CCc1cccc(C[N@H+](C)[C@H](C)CNC(=O)CN2CC[C@H](C)C2)c1 ZINC001506001701 1405329376 /nfs/dbraw/zinc/32/93/76/1405329376.db2.gz GYZXTNWZMNFVFS-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(C[N@@H+](C)[C@H](C)CNC(=O)CN2CC[C@H](C)C2)c1 ZINC001506001701 1405329380 /nfs/dbraw/zinc/32/93/80/1405329380.db2.gz GYZXTNWZMNFVFS-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)[C@@H](C)CNC(=O)CN(C)C(C)C)c(C)c1 ZINC001506065078 1405425046 /nfs/dbraw/zinc/42/50/46/1405425046.db2.gz IQPAKKULOOKGJS-SFHVURJKSA-N 1 3 333.520 2.889 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)[C@@H](C)CNC(=O)CN(C)C(C)C)c(C)c1 ZINC001506065078 1405425052 /nfs/dbraw/zinc/42/50/52/1405425052.db2.gz IQPAKKULOOKGJS-SFHVURJKSA-N 1 3 333.520 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001506065758 1405425883 /nfs/dbraw/zinc/42/58/83/1405425883.db2.gz VKHCOPWOWSLAOJ-ZWKOTPCHSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001506065758 1405425889 /nfs/dbraw/zinc/42/58/89/1405425889.db2.gz VKHCOPWOWSLAOJ-ZWKOTPCHSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]Cc1ccsc1 ZINC001506159090 1405491839 /nfs/dbraw/zinc/49/18/39/1405491839.db2.gz MTPFCPZSFCADDR-IRXDYDNUSA-N 1 3 337.533 2.805 10 0 EFAEHO CCCC[C@H](CNCc1ccccn1)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001506544212 1405935526 /nfs/dbraw/zinc/93/55/26/1405935526.db2.gz IYAZRRJIHSDXRZ-JENIJYKNSA-N 1 3 346.519 2.577 10 0 EFAEHO CCCC[C@H](CNCc1ccccn1)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001506544212 1405935532 /nfs/dbraw/zinc/93/55/32/1405935532.db2.gz IYAZRRJIHSDXRZ-JENIJYKNSA-N 1 3 346.519 2.577 10 0 EFAEHO CC[C@H](F)CN1CCCCC[C@H]1CNC(=O)CC1CC[NH+](C)CC1 ZINC001506576605 1405993675 /nfs/dbraw/zinc/99/36/75/1405993675.db2.gz UCLIRPRSFYOCMS-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CN(Cc2ccccc2)CC1(C)C ZINC001506742321 1406232773 /nfs/dbraw/zinc/23/27/73/1406232773.db2.gz QKYGJEGGQLSUKC-RTBURBONSA-N 1 3 343.515 2.888 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CN(Cc2ccccc2)CC1(C)C ZINC001506742321 1406232776 /nfs/dbraw/zinc/23/27/76/1406232776.db2.gz QKYGJEGGQLSUKC-RTBURBONSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]CC2=CCCCC2)C1 ZINC001565877992 1415131305 /nfs/dbraw/zinc/13/13/05/1415131305.db2.gz JCUQDJUDTGUKKF-YOQCTACHSA-N 1 3 333.520 2.844 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC001564720264 1415380919 /nfs/dbraw/zinc/38/09/19/1415380919.db2.gz XHRGQXBSZROZTI-HKUYNNGSSA-N 1 3 348.535 2.955 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC001564720264 1415380923 /nfs/dbraw/zinc/38/09/23/1415380923.db2.gz XHRGQXBSZROZTI-HKUYNNGSSA-N 1 3 348.535 2.955 10 0 EFAEHO C[C@H]1CC[N@H+](CC(=O)NCCCN(C)Cc2ccc(Cl)s2)C1 ZINC001566490951 1415583451 /nfs/dbraw/zinc/58/34/51/1415583451.db2.gz IKQNCFGXXZIUIR-ZDUSSCGKSA-N 1 3 343.924 2.681 10 0 EFAEHO C[C@H]1CC[N@@H+](CC(=O)NCCCN(C)Cc2ccc(Cl)s2)C1 ZINC001566490951 1415583456 /nfs/dbraw/zinc/58/34/56/1415583456.db2.gz IKQNCFGXXZIUIR-ZDUSSCGKSA-N 1 3 343.924 2.681 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCNC(=O)CN2CC[C@@H](C)C2)cc1C ZINC001566491194 1415583743 /nfs/dbraw/zinc/58/37/43/1415583743.db2.gz PMMUGPJZBHXTAV-MRXNPFEDSA-N 1 3 331.504 2.583 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCNC(=O)CN2CC[C@@H](C)C2)cc1C ZINC001566491194 1415583745 /nfs/dbraw/zinc/58/37/45/1415583745.db2.gz PMMUGPJZBHXTAV-MRXNPFEDSA-N 1 3 331.504 2.583 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC001566512437 1415601375 /nfs/dbraw/zinc/60/13/75/1415601375.db2.gz RHAVXRXJKIRYAQ-AWEZNQCLSA-N 1 3 342.434 2.524 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](C)CC[C@@H]1CCCC1(F)F ZINC001566512437 1415601379 /nfs/dbraw/zinc/60/13/79/1415601379.db2.gz RHAVXRXJKIRYAQ-AWEZNQCLSA-N 1 3 342.434 2.524 10 0 EFAEHO CC[N@H+](CCCNC(=O)Cc1nc[nH]c1C)Cc1cccc(C)c1 ZINC001566574256 1415656382 /nfs/dbraw/zinc/65/63/82/1415656382.db2.gz NXKCRXMAXCCYEK-UHFFFAOYSA-N 1 3 328.460 2.597 10 0 EFAEHO CC[N@@H+](CCCNC(=O)Cc1nc[nH]c1C)Cc1cccc(C)c1 ZINC001566574256 1415656385 /nfs/dbraw/zinc/65/63/85/1415656385.db2.gz NXKCRXMAXCCYEK-UHFFFAOYSA-N 1 3 328.460 2.597 10 0 EFAEHO CC/C=C\CC[NH+]1CCC(N(C)C(=O)CN2CCC(C)CC2)CC1 ZINC001566614102 1415696130 /nfs/dbraw/zinc/69/61/30/1415696130.db2.gz ZVQYJYUNOAKCDK-WAYWQWQTSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CC[C@H]([NH2+]CCCCCF)C1 ZINC001566775023 1415771319 /nfs/dbraw/zinc/77/13/19/1415771319.db2.gz VBFCWEBYHFGXOD-DLBZAZTESA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H]([NH2+]CCCCC(F)(F)F)C1)N(C)C ZINC001566810814 1415782024 /nfs/dbraw/zinc/78/20/24/1415782024.db2.gz HJKXZNCHGLYDJW-IHRRRGAJSA-N 1 3 337.430 2.542 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H](C[NH2+]CC=C(Cl)Cl)C1)C1CCC1 ZINC001566895200 1415828192 /nfs/dbraw/zinc/82/81/92/1415828192.db2.gz DFTFNOBWHVBPJC-ZDUSSCGKSA-N 1 3 348.318 2.618 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@H](C[NH2+]CCCCCF)C2)CC1 ZINC001566908296 1415836921 /nfs/dbraw/zinc/83/69/21/1415836921.db2.gz KJCBOBWDQNITLU-GOSISDBHSA-N 1 3 341.515 2.686 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H]1CCCCN1C(=O)C(C)(C)N1CCCCC1 ZINC001566938691 1415858230 /nfs/dbraw/zinc/85/82/30/1415858230.db2.gz XVLDGSFJPKUMKV-DLBZAZTESA-N 1 3 341.515 2.970 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H]([NH2+]CC/C=C/c3ccccc3)C2)CCC1 ZINC001567097194 1415932416 /nfs/dbraw/zinc/93/24/16/1415932416.db2.gz RQYXBYNDXMAMAC-NJGYHNCTSA-N 1 3 341.499 2.765 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](C[NH2+]CCC3=CCCCC3)C2)C1 ZINC001567141041 1415949561 /nfs/dbraw/zinc/94/95/61/1415949561.db2.gz UFQOSZSTZPUBSO-MJGOQNOKSA-N 1 3 333.520 2.657 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001567155532 1415955965 /nfs/dbraw/zinc/95/59/65/1415955965.db2.gz REQFJFHWWUULTC-NVXWUHKLSA-N 1 3 335.467 2.548 10 0 EFAEHO CC(C)=CC[NH2+]CCc1ccc(CNC(=O)C2(N(C)C)CCC2)cc1 ZINC001567183203 1415975830 /nfs/dbraw/zinc/97/58/30/1415975830.db2.gz VBDOXXKVEFJHCG-UHFFFAOYSA-N 1 3 343.515 2.885 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCCC[C@H]1CCC[N@@H+]1Cc1ccccc1F ZINC001567247261 1416015427 /nfs/dbraw/zinc/01/54/27/1416015427.db2.gz MMDRGOBGSSTJTQ-HKUYNNGSSA-N 1 3 347.478 2.781 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCCC[C@H]1CCC[N@H+]1Cc1ccccc1F ZINC001567247261 1416015433 /nfs/dbraw/zinc/01/54/33/1416015433.db2.gz MMDRGOBGSSTJTQ-HKUYNNGSSA-N 1 3 347.478 2.781 10 0 EFAEHO CN(CCNC(=O)CCCC[NH+](C)C)[C@@H]1CCCc2ccc(F)cc21 ZINC001567314380 1416067789 /nfs/dbraw/zinc/06/77/89/1416067789.db2.gz NVIHUQWVKBCULW-LJQANCHMSA-N 1 3 349.494 2.983 10 0 EFAEHO CCCCCC[NH2+]CCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001567561650 1416187775 /nfs/dbraw/zinc/18/77/75/1416187775.db2.gz XSWVOGNJGLXMAH-GOSISDBHSA-N 1 3 329.504 2.827 10 0 EFAEHO C[C@@H]([NH2+]CCCC1CCC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001567633504 1416218651 /nfs/dbraw/zinc/21/86/51/1416218651.db2.gz CKCVKKASIRAAHH-QGZVFWFLSA-N 1 3 335.536 2.879 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@H](CC[NH2+]CCC(F)(F)F)C2)CCC1 ZINC001568057533 1416383538 /nfs/dbraw/zinc/38/35/38/1416383538.db2.gz GBBSMXCPEFDABI-CQSZACIVSA-N 1 3 349.441 2.641 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@@H](CC[NH2+]CCC(F)(F)F)C2)CCC1 ZINC001568057532 1416383547 /nfs/dbraw/zinc/38/35/47/1416383547.db2.gz GBBSMXCPEFDABI-AWEZNQCLSA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)CC[NH2+]CC[C@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001568067778 1416391437 /nfs/dbraw/zinc/39/14/37/1416391437.db2.gz IWZQRLSSGAQYLV-QZTJIDSGSA-N 1 3 325.541 2.837 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H]2CCCN2C(=O)C2(N(C)C)CCC2)cc1 ZINC001568139122 1416423463 /nfs/dbraw/zinc/42/34/63/1416423463.db2.gz CQXWESRDVGFJIE-LJQANCHMSA-N 1 3 343.515 2.602 10 0 EFAEHO C[C@@H](C[NH2+]CC[C@@H]1CCCC1(F)F)N(C)C(=O)CN(C)C1CCC1 ZINC001568277777 1416463695 /nfs/dbraw/zinc/46/36/95/1416463695.db2.gz FUVYMBPWOVUFMM-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@@H]2CCCCN2C(=O)Cc2c[nH]cn2)c1 ZINC001568393589 1416510821 /nfs/dbraw/zinc/51/08/21/1416510821.db2.gz OJOOCDZCTWEEQZ-IBGZPJMESA-N 1 3 340.471 2.822 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CCC1=CCCCC1 ZINC001568462384 1416539202 /nfs/dbraw/zinc/53/92/02/1416539202.db2.gz IYSUCJSWAHMPPD-MJGOQNOKSA-N 1 3 335.536 2.949 10 0 EFAEHO CC(C)N1CCN(c2cccc(NC(=O)[C@H]3CCCC[C@@H]3[NH3+])c2)CC1 ZINC001645885222 1416579986 /nfs/dbraw/zinc/57/99/86/1416579986.db2.gz VSULZORXBSGWOG-OALUTQOASA-N 1 3 344.503 2.673 10 0 EFAEHO CC(C)OC[C@@H](O)CNC1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001646084600 1416610866 /nfs/dbraw/zinc/61/08/66/1416610866.db2.gz WOVUSNDHNHGFTK-VTHDOGFWSA-N 1 3 346.515 2.948 10 0 EFAEHO CC(C)OC[C@@H](O)CNC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001646084600 1416610871 /nfs/dbraw/zinc/61/08/71/1416610871.db2.gz WOVUSNDHNHGFTK-VTHDOGFWSA-N 1 3 346.515 2.948 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CC/C=C/c2ccccc2)C1 ZINC001690255496 1417179916 /nfs/dbraw/zinc/17/99/16/1417179916.db2.gz PLVZFNFOUQVLJQ-SSVWKNEZSA-N 1 3 329.488 2.622 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@H]2C[C@@H]([NH2+]CC/C=C/c3ccccc3)C2)C1 ZINC001690356787 1417195350 /nfs/dbraw/zinc/19/53/50/1417195350.db2.gz VIXVIKWBCFLXHW-GNGGKJSNSA-N 1 3 341.499 2.669 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CCC[C@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001690388210 1417205545 /nfs/dbraw/zinc/20/55/45/1417205545.db2.gz FEGRXPQQIHKRFT-OBNUAKFSSA-N 1 3 335.536 2.903 10 0 EFAEHO CCC/C=C/CC[N@H+]1CCC[C@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001690388210 1417205546 /nfs/dbraw/zinc/20/55/46/1417205546.db2.gz FEGRXPQQIHKRFT-OBNUAKFSSA-N 1 3 335.536 2.903 10 0 EFAEHO CC(C)CC[NH2+]C[C@@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001690479824 1417217076 /nfs/dbraw/zinc/21/70/76/1417217076.db2.gz WBOZOZFHUUFHIO-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2C[C@@H]3C[C@H]2CN3CCC2=CCCCC2)CC1 ZINC001692375397 1417281507 /nfs/dbraw/zinc/28/15/07/1417281507.db2.gz WZPZCULSOOGEMD-ROUUACIJSA-N 1 3 331.504 2.504 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@H](NC(=O)C23CCCN2CCC3)[C@H]1C ZINC001692374905 1417281921 /nfs/dbraw/zinc/28/19/21/1417281921.db2.gz BXVRCFYFVZYFEC-VGRIIWOTSA-N 1 3 333.520 2.940 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@H](NC(=O)C23CCCN2CCC3)[C@H]1C ZINC001692374905 1417281923 /nfs/dbraw/zinc/28/19/23/1417281923.db2.gz BXVRCFYFVZYFEC-VGRIIWOTSA-N 1 3 333.520 2.940 10 0 EFAEHO CC/C=C/CCN1CC[C@@H]1CNC(=O)c1ccc(C[NH+](C)C)cc1 ZINC001699632497 1417439682 /nfs/dbraw/zinc/43/96/82/1417439682.db2.gz LTSBZYBZVZQHHL-ZMBJWTFHSA-N 1 3 329.488 2.909 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC1(C)CC[NH+](CCCCCF)CC1 ZINC001699775269 1417467423 /nfs/dbraw/zinc/46/74/23/1417467423.db2.gz QCISSIRDTIOOGT-IRXDYDNUSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[C@H](C[NH2+]C/C=C/Cl)CC1 ZINC001699981631 1417536299 /nfs/dbraw/zinc/53/62/99/1417536299.db2.gz MNIQCBSPANQTAJ-OIQFLZLASA-N 1 3 329.916 2.591 10 0 EFAEHO CC1CCC(C[NH2+]CC[C@H]2CCN(C(=O)Cc3c[nH]cn3)C2)CC1 ZINC001700079911 1417556218 /nfs/dbraw/zinc/55/62/18/1417556218.db2.gz UMLYSTMGZLUXFC-JCYILVPMSA-N 1 3 332.492 2.607 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]CCCc2ccccc2)C[C@H]1C ZINC001700853991 1417665483 /nfs/dbraw/zinc/66/54/83/1417665483.db2.gz OZYQBGPANJGEMX-MJGOQNOKSA-N 1 3 331.504 2.538 10 0 EFAEHO C[C@@H]([NH2+]CCCF)[C@@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001712998847 1418322101 /nfs/dbraw/zinc/32/21/01/1418322101.db2.gz HWYMPQDXVZVXEU-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@H]2C[C@H]([NH2+]CCCCc3ccccc3)C2)C1 ZINC001713168229 1418349434 /nfs/dbraw/zinc/34/94/34/1418349434.db2.gz BBVPWEJNWSQWJG-MISYRCLQSA-N 1 3 343.515 2.588 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N[C@H]1C[C@H](NCC=C(Cl)Cl)C1 ZINC001713176502 1418352992 /nfs/dbraw/zinc/35/29/92/1418352992.db2.gz OCNDWJMZZVIGKM-HDJSIYSDSA-N 1 3 348.318 2.808 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1C[C@@H](NC(=O)CN2CC[C@H](C)C2)C1 ZINC001713201235 1418373527 /nfs/dbraw/zinc/37/35/27/1418373527.db2.gz MUHCAOOTQSWUFY-FFZOFVMBSA-N 1 3 343.515 2.506 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H](C[NH2+]CCCC2CCC2)C1)N(C)C ZINC001713238659 1418408262 /nfs/dbraw/zinc/40/82/62/1418408262.db2.gz KJGKBVSJPWWPDP-RBUKOAKNSA-N 1 3 337.552 2.981 10 0 EFAEHO CN(C)C1(C(=O)N2CCCC[C@H]2C[NH2+]CCc2ccccc2)CCC1 ZINC001713263577 1418431678 /nfs/dbraw/zinc/43/16/78/1418431678.db2.gz TXNYLWODEMBXOQ-IBGZPJMESA-N 1 3 343.515 2.684 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]CC[C@@H]2CCCC2(F)F)C1 ZINC001713366244 1418494557 /nfs/dbraw/zinc/49/45/57/1418494557.db2.gz ZJXHHUMWTMGPPM-HOTGVXAUSA-N 1 3 345.478 2.590 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@@H]([N@H+](C)CCCCCF)C1 ZINC001713400939 1418507564 /nfs/dbraw/zinc/50/75/64/1418507564.db2.gz MEIFORPQJIYUHG-MSOLQXFVSA-N 1 3 341.515 2.923 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@@H]([N@@H+](C)CCCCCF)C1 ZINC001713400939 1418507567 /nfs/dbraw/zinc/50/75/67/1418507567.db2.gz MEIFORPQJIYUHG-MSOLQXFVSA-N 1 3 341.515 2.923 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[C@@H]1CCC[N@@H+]1CC1CC(F)(F)C1 ZINC001713442201 1418538925 /nfs/dbraw/zinc/53/89/25/1418538925.db2.gz IPAQPVRFEFVXOU-MRXNPFEDSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[C@@H]1CCC[N@H+]1CC1CC(F)(F)C1 ZINC001713442201 1418538926 /nfs/dbraw/zinc/53/89/26/1418538926.db2.gz IPAQPVRFEFVXOU-MRXNPFEDSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]CCN(C)C(=O)CN1CC[C@@H](C)C1 ZINC001714753566 1418625762 /nfs/dbraw/zinc/62/57/62/1418625762.db2.gz DDBSQQULPGIDOJ-QGZVFWFLSA-N 1 3 331.504 2.700 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]CCc1ccccc1 ZINC001714774585 1418632364 /nfs/dbraw/zinc/63/23/64/1418632364.db2.gz WQPJQMLSVPDGCM-UYAOXDASSA-N 1 3 345.531 2.929 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[NH2+]Cc1ccc2ccccc2c1 ZINC001714783803 1418636629 /nfs/dbraw/zinc/63/66/29/1418636629.db2.gz GDQCUXCNELVIEN-UHFFFAOYSA-N 1 3 327.472 2.730 10 0 EFAEHO CCC/C=C/CC[NH+]1CC2(C1)CCN(C(=O)CN(C)C(C)C)CC2 ZINC001715316569 1418663380 /nfs/dbraw/zinc/66/33/80/1418663380.db2.gz JPMBNHURCRYHIJ-BQYQJAHWSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@@H]21 ZINC001716049108 1418704113 /nfs/dbraw/zinc/70/41/13/1418704113.db2.gz JQNJHIKTVBPPMI-MSOLQXFVSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCCCC[N@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@@H]21 ZINC001716049108 1418704114 /nfs/dbraw/zinc/70/41/14/1418704114.db2.gz JQNJHIKTVBPPMI-MSOLQXFVSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1cc2ccccc2o1)NC(=O)CN1CC[C@@H](C)C1 ZINC001716174512 1418713671 /nfs/dbraw/zinc/71/36/71/1418713671.db2.gz TYSQRWSSVJRVPP-CVEARBPZSA-N 1 3 343.471 2.759 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@H](C)NC(=O)Cc1nc[nH]c1C ZINC001716191958 1418720779 /nfs/dbraw/zinc/72/07/79/1418720779.db2.gz KFGNBTPGWMFRIG-AWEZNQCLSA-N 1 3 328.460 2.508 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(F)cc1)C(=O)[C@@H]1CCCCN1CC ZINC001716256269 1418742729 /nfs/dbraw/zinc/74/27/29/1418742729.db2.gz VNLAJOSLQYLRPF-SFHVURJKSA-N 1 3 335.467 2.638 10 0 EFAEHO CCN(CC[NH2+]CCc1ccccc1F)C(=O)[C@H]1CCCCN1CC ZINC001716255698 1418743040 /nfs/dbraw/zinc/74/30/40/1418743040.db2.gz AMMDCAHSVBPYRQ-LJQANCHMSA-N 1 3 349.494 2.681 10 0 EFAEHO Cc1cc(C[NH2+]C/C=C/CNC(=O)C2(N(C)C)CCC2)c(C)s1 ZINC001716302391 1418761024 /nfs/dbraw/zinc/76/10/24/1418761024.db2.gz DUCWJLHKRLLJPY-AATRIKPKSA-N 1 3 335.517 2.611 10 0 EFAEHO CN(CC(=O)NC/C=C/C[NH2+][C@@H]1CCc2ccc(F)cc21)C1CCC1 ZINC001716306005 1418762045 /nfs/dbraw/zinc/76/20/45/1418762045.db2.gz MQIPDOTXKQPTJJ-LSTKMXGYSA-N 1 3 345.462 2.559 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C/C=C\CNC(=O)CN(C)C2CCC2)c1 ZINC001716304857 1418762485 /nfs/dbraw/zinc/76/24/85/1418762485.db2.gz CKPTUWJBGMGQSK-PLNGDYQASA-N 1 3 329.488 2.550 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C/CNC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C ZINC001716378671 1418860472 /nfs/dbraw/zinc/86/04/72/1418860472.db2.gz KYGNKYVMDGWNSC-PSUYNTKASA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C/CNC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001716378671 1418860474 /nfs/dbraw/zinc/86/04/74/1418860474.db2.gz KYGNKYVMDGWNSC-PSUYNTKASA-N 1 3 347.478 2.769 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]CCCc1ccccc1C ZINC001716424592 1418877879 /nfs/dbraw/zinc/87/78/79/1418877879.db2.gz MCJGBPWPWRPSBS-QUCCMNQESA-N 1 3 345.531 2.896 10 0 EFAEHO CCCCC[NH2+]C[C@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001716620990 1418927483 /nfs/dbraw/zinc/92/74/83/1418927483.db2.gz CKFYLWWAWZDXRI-LPHOPBHVSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@H]1CN(C(=O)C(C)(C)N2CCCCC2)CC[C@H]1[NH2+]CCCF ZINC001716635671 1418932560 /nfs/dbraw/zinc/93/25/60/1418932560.db2.gz MRLLRWZYPSSVKN-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001716703706 1418962727 /nfs/dbraw/zinc/96/27/27/1418962727.db2.gz FSJVXNVIPHOESI-KRWDZBQOSA-N 1 3 332.492 2.703 10 0 EFAEHO CCCCC[N@H+]1CC[C@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001716703706 1418962730 /nfs/dbraw/zinc/96/27/30/1418962730.db2.gz FSJVXNVIPHOESI-KRWDZBQOSA-N 1 3 332.492 2.703 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001716777890 1419004260 /nfs/dbraw/zinc/00/42/60/1419004260.db2.gz ZRZNNUDMELUNAL-KBPBESRZSA-N 1 3 348.318 2.759 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001716777890 1419004262 /nfs/dbraw/zinc/00/42/62/1419004262.db2.gz ZRZNNUDMELUNAL-KBPBESRZSA-N 1 3 348.318 2.759 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(CC[NH2+]C/C=C/Cl)Cc2ccccc2)C1 ZINC001717007146 1419143865 /nfs/dbraw/zinc/14/38/65/1419143865.db2.gz QNBGMTGAEDUJBG-MPNRVQBSSA-N 1 3 349.906 2.699 10 0 EFAEHO CCCCCC[N@H+]1C[C@H]2CN(C(=O)CN3[C@H](C)CC[C@@H]3C)C[C@H]2C1 ZINC001717015250 1419150505 /nfs/dbraw/zinc/15/05/05/1419150505.db2.gz XFNHEOJOBMOXHP-QGFMHUBQSA-N 1 3 335.536 2.830 10 0 EFAEHO CCCCCC[N@@H+]1C[C@H]2CN(C(=O)CN3[C@H](C)CC[C@@H]3C)C[C@H]2C1 ZINC001717015250 1419150510 /nfs/dbraw/zinc/15/05/10/1419150510.db2.gz XFNHEOJOBMOXHP-QGFMHUBQSA-N 1 3 335.536 2.830 10 0 EFAEHO CN(CC(=O)N1CC[C@H](CC[NH2+]CC=C(Cl)Cl)C1)C1CCC1 ZINC001717088629 1419199443 /nfs/dbraw/zinc/19/94/43/1419199443.db2.gz ZEFGAYSPZMHACB-ZDUSSCGKSA-N 1 3 348.318 2.618 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](CC[NH2+]CC2CC3(CCC3)C2)C1)C1CCC1 ZINC001717088411 1419198752 /nfs/dbraw/zinc/19/87/52/1419198752.db2.gz UUVVDRCQQRUIRD-QGZVFWFLSA-N 1 3 347.547 2.879 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](CC[NH2+]CC2CCCCC2)C1)C1CCC1 ZINC001717087700 1419198823 /nfs/dbraw/zinc/19/88/23/1419198823.db2.gz KYHRCWHGXGLDGA-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@@H](CC[NH2+]CCC(F)(F)F)C1 ZINC001717110530 1419215227 /nfs/dbraw/zinc/21/52/27/1419215227.db2.gz FPRLWLBJYDMKBO-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001717124758 1419226020 /nfs/dbraw/zinc/22/60/20/1419226020.db2.gz ANPTVEBBFSYIPU-BZSNNMDCSA-N 1 3 325.541 2.883 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001717247822 1419291326 /nfs/dbraw/zinc/29/13/26/1419291326.db2.gz PQVCNKKFPZJYCV-LJQANCHMSA-N 1 3 332.492 2.847 10 0 EFAEHO CCCCCC[N@H+]1CC[C@@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001717247822 1419291332 /nfs/dbraw/zinc/29/13/32/1419291332.db2.gz PQVCNKKFPZJYCV-LJQANCHMSA-N 1 3 332.492 2.847 10 0 EFAEHO CCC[NH2+]CC1(c2ccccc2)CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001717315158 1419325922 /nfs/dbraw/zinc/32/59/22/1419325922.db2.gz BNSPNAUOMJSCQC-LJQANCHMSA-N 1 3 343.515 2.641 10 0 EFAEHO CC(C)=CCN1C[C@@H](NC(=O)[C@@H](C(C)C)[NH+]2CCCC2)C(C)(C)C1 ZINC001717589905 1419460665 /nfs/dbraw/zinc/46/06/65/1419460665.db2.gz TTYJKSNLEVHFGH-QZTJIDSGSA-N 1 3 335.536 2.900 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@@]2(C)CN(C(=O)C3(N(C)C)CCC3)C[C@@]2(C)C1 ZINC001717631389 1419479059 /nfs/dbraw/zinc/47/90/59/1419479059.db2.gz SSZAFVBBOQJJMH-SCSYBTMDSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@@]2(C)CN(C(=O)C3(N(C)C)CCC3)C[C@@]2(C)C1 ZINC001717631389 1419479062 /nfs/dbraw/zinc/47/90/62/1419479062.db2.gz SSZAFVBBOQJJMH-SCSYBTMDSA-N 1 3 347.547 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@]2(C)C[N@H+](CC3=CCCCC3)C[C@]2(C)C1 ZINC001717632692 1419480810 /nfs/dbraw/zinc/48/08/10/1419480810.db2.gz QLDQXFVEORFCLU-OYRHEFFESA-N 1 3 347.547 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@]2(C)C[N@@H+](CC3=CCCCC3)C[C@]2(C)C1 ZINC001717632692 1419480814 /nfs/dbraw/zinc/48/08/14/1419480814.db2.gz QLDQXFVEORFCLU-OYRHEFFESA-N 1 3 347.547 2.997 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+]Cc1c(C)cccc1C ZINC001717693682 1419510379 /nfs/dbraw/zinc/51/03/79/1419510379.db2.gz WJMGFYZCXYBZTL-MRXNPFEDSA-N 1 3 342.487 2.952 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CCC[NH2+]Cc1ncccc1C ZINC001717695144 1419510882 /nfs/dbraw/zinc/51/08/82/1419510882.db2.gz ATNOIHAGFWZWDD-PKOBYXMFSA-N 1 3 346.519 2.639 10 0 EFAEHO CCCC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]21 ZINC001717850793 1419578742 /nfs/dbraw/zinc/57/87/42/1419578742.db2.gz YQHXZYXFRXIUTN-OKZBNKHCSA-N 1 3 337.552 2.981 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H](C[NH2+]CCCC3CCC3)C2)CCC1 ZINC001717871818 1419595378 /nfs/dbraw/zinc/59/53/78/1419595378.db2.gz CZHVMSRPTIWJML-ROUUACIJSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C[NH2+]CCc1cccs1)C(C)(C)C ZINC001717971455 1419635475 /nfs/dbraw/zinc/63/54/75/1419635475.db2.gz LGWVWELWVRTOHP-MRXNPFEDSA-N 1 3 348.516 2.685 10 0 EFAEHO CN(CC(=O)N(C)CCC[NH2+]C[C@@H]1CCC(F)(F)C1)CC(C)(C)C ZINC001723122678 1424429055 /nfs/dbraw/zinc/42/90/55/1424429055.db2.gz INCUYMHKTNPGSZ-OAHLLOKOSA-N 1 3 347.494 2.838 10 0 EFAEHO CC(C)c1ccc(C[NH2+]CCCN(C)C(=O)Cc2c[nH]cn2)cc1 ZINC001723133696 1424431526 /nfs/dbraw/zinc/43/15/26/1424431526.db2.gz VBEAWSSSPIPRFQ-UHFFFAOYSA-N 1 3 328.460 2.714 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001723722365 1424570045 /nfs/dbraw/zinc/57/00/45/1424570045.db2.gz VGZKSSOBUBRTLO-BBCKOWNQSA-N 1 3 333.520 2.609 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001723722365 1424570048 /nfs/dbraw/zinc/57/00/48/1424570048.db2.gz VGZKSSOBUBRTLO-BBCKOWNQSA-N 1 3 333.520 2.609 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2CC=C(C)C ZINC001724115607 1424663759 /nfs/dbraw/zinc/66/37/59/1424663759.db2.gz XKQNUGBOXOKZPL-SQNIBIBYSA-N 1 3 339.499 2.698 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2CC=C(C)C ZINC001724115607 1424663763 /nfs/dbraw/zinc/66/37/63/1424663763.db2.gz XKQNUGBOXOKZPL-SQNIBIBYSA-N 1 3 339.499 2.698 10 0 EFAEHO CCCCC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)C2 ZINC001724601616 1424817997 /nfs/dbraw/zinc/81/79/97/1424817997.db2.gz HKOILGULURTURD-AKHDSKFASA-N 1 3 335.536 2.878 10 0 EFAEHO CCCCC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)C2 ZINC001724601616 1424818007 /nfs/dbraw/zinc/81/80/07/1424818007.db2.gz HKOILGULURTURD-AKHDSKFASA-N 1 3 335.536 2.878 10 0 EFAEHO CN(CC(=O)N1CC[C@H](CC[NH2+]CC2CC(C)(C)C2)C1)C1CCC1 ZINC001724711195 1424929914 /nfs/dbraw/zinc/92/99/14/1424929914.db2.gz FFCMGOIJSMMWGV-INIZCTEOSA-N 1 3 335.536 2.735 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@H]([C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001725063003 1425275324 /nfs/dbraw/zinc/27/53/24/1425275324.db2.gz ZITUVGOGOSIRII-DLBZAZTESA-N 1 3 332.492 2.703 10 0 EFAEHO CCCCC[N@H+]1CC[C@@H]([C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001725063003 1425275328 /nfs/dbraw/zinc/27/53/28/1425275328.db2.gz ZITUVGOGOSIRII-DLBZAZTESA-N 1 3 332.492 2.703 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001725091064 1425293977 /nfs/dbraw/zinc/29/39/77/1425293977.db2.gz LUBDLGHKNJKTOS-ROUUACIJSA-N 1 3 345.531 2.895 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H](C)[NH2+]CCCc1ccc(C)cc1 ZINC001725122392 1425315057 /nfs/dbraw/zinc/31/50/57/1425315057.db2.gz CWKALFJBIHTENW-JKSUJKDBSA-N 1 3 342.487 2.685 10 0 EFAEHO CCCC[C@H](CNCC=C(Cl)Cl)NC(=O)C12CC[NH+](CC1)C2 ZINC001725232474 1425396567 /nfs/dbraw/zinc/39/65/67/1425396567.db2.gz AURLSMGMIXVUQV-CYBMUJFWSA-N 1 3 348.318 2.666 10 0 EFAEHO CCC/C=C\CC[N@H+]1C[C@@H]2C(CNC(=O)C3(N(C)C)CCC3)[C@@H]2C1 ZINC001725309426 1425458460 /nfs/dbraw/zinc/45/84/60/1425458460.db2.gz MTOGSFAQNBSLIA-AWDJETKZSA-N 1 3 333.520 2.511 10 0 EFAEHO CCC/C=C\CC[N@@H+]1C[C@@H]2C(CNC(=O)C3(N(C)C)CCC3)[C@@H]2C1 ZINC001725309426 1425458464 /nfs/dbraw/zinc/45/84/64/1425458464.db2.gz MTOGSFAQNBSLIA-AWDJETKZSA-N 1 3 333.520 2.511 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCc2ccc(C)cc2)C[C@@H]1C ZINC001725601427 1425687821 /nfs/dbraw/zinc/68/78/21/1425687821.db2.gz XMGNYTDUZYKUAV-ICSRJNTNSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)N(CCN(C)CC1=CCCCC1)C(=O)C12CC[NH+](CC1)C2 ZINC001725733056 1425802569 /nfs/dbraw/zinc/80/25/69/1425802569.db2.gz NBAUFBNAUXXMDQ-UHFFFAOYSA-N 1 3 333.520 2.751 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+]CCC1CC1)C(C)(C)C)CC(C)(C)C ZINC001725752500 1425819538 /nfs/dbraw/zinc/81/95/38/1425819538.db2.gz RELXZKBNRZGWGJ-MRXNPFEDSA-N 1 3 325.541 2.885 10 0 EFAEHO COCCc1nc(C)c([C@@H](C)[NH2+]C[C@H]2CNCCC2(F)F)s1 ZINC000925783918 717898521 /nfs/dbraw/zinc/89/85/21/717898521.db2.gz PIFMCOOOXBPRKR-ZYHUDNBSSA-N 1 3 333.448 2.536 10 0 EFAEHO CN1C[C@@H]2C[N@H+](C[C@H](O)c3cccc(C(F)(F)F)c3)C[C@]2(C)C1 ZINC000933744670 715036768 /nfs/dbraw/zinc/03/67/68/715036768.db2.gz NUPQSPSQTIJMLP-PMPSAXMXSA-N 1 3 328.378 2.622 10 0 EFAEHO CN1C[C@@H]2C[N@@H+](C[C@H](O)c3cccc(C(F)(F)F)c3)C[C@]2(C)C1 ZINC000933744670 715036770 /nfs/dbraw/zinc/03/67/70/715036770.db2.gz NUPQSPSQTIJMLP-PMPSAXMXSA-N 1 3 328.378 2.622 10 0 EFAEHO CN1CC[C@@]2(CC[N@H+](C[C@@H](O)COc3cccc4ccccc43)C2)C1 ZINC000292179647 715813078 /nfs/dbraw/zinc/81/30/78/715813078.db2.gz QLGDQFCNDGSBIR-WIYYLYMNSA-N 1 3 340.467 2.607 10 0 EFAEHO CN1CC[C@@]2(CC[N@@H+](C[C@@H](O)COc3cccc4ccccc43)C2)C1 ZINC000292179647 715813082 /nfs/dbraw/zinc/81/30/82/715813082.db2.gz QLGDQFCNDGSBIR-WIYYLYMNSA-N 1 3 340.467 2.607 10 0 EFAEHO FC(F)(F)C(F)(F)OCCN[C@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925732192 716716129 /nfs/dbraw/zinc/71/61/29/716716129.db2.gz WQHWLOLMLLRDBK-RYUDHWBXSA-N 1 3 330.341 2.916 10 0 EFAEHO C[C@@H](NCCN1CCC([NH3+])CC1)c1ccc(F)cc1OC(F)F ZINC000925814580 718877755 /nfs/dbraw/zinc/87/77/55/718877755.db2.gz JZEWMFXSRQXQEG-LLVKDONJSA-N 1 3 331.382 2.501 10 0 EFAEHO COC(=O)[C@@H]1[C@@H](CN2CCC(CCC[NH+]3CCCC3)CC2)C1(F)F ZINC000894070537 720265993 /nfs/dbraw/zinc/26/59/93/720265993.db2.gz BVHZVXGIFWENFN-CVEARBPZSA-N 1 3 344.446 2.629 10 0 EFAEHO COC(=O)[C@H]1[C@H](CN2CCC(CCC[NH+]3CCCC3)CC2)C1(F)F ZINC000894070541 720266097 /nfs/dbraw/zinc/26/60/97/720266097.db2.gz BVHZVXGIFWENFN-JKSUJKDBSA-N 1 3 344.446 2.629 10 0 EFAEHO CCN1CCN([C@@H](C)C[NH2+]Cc2cc3c(cccc3O)s2)CC1 ZINC000894177083 721170779 /nfs/dbraw/zinc/17/07/79/721170779.db2.gz YXGFUUNROLSZMI-AWEZNQCLSA-N 1 3 333.501 2.723 10 0 EFAEHO CCN1CCN([C@H](C)C[NH2+]Cc2cc3c(cccc3O)s2)CC1 ZINC000894177084 721171137 /nfs/dbraw/zinc/17/11/37/721171137.db2.gz YXGFUUNROLSZMI-CQSZACIVSA-N 1 3 333.501 2.723 10 0 EFAEHO COC(=O)[C@H]1[C@@H](CNCc2cccc(C[N@H+](C)C(C)C)c2)C1(F)F ZINC000894206618 721207557 /nfs/dbraw/zinc/20/75/57/721207557.db2.gz HHGBIPMIKIVNTN-HZPDHXFCSA-N 1 3 340.414 2.671 10 0 EFAEHO COC(=O)[C@H]1[C@@H](CNCc2cccc(C[N@@H+](C)C(C)C)c2)C1(F)F ZINC000894206618 721207560 /nfs/dbraw/zinc/20/75/60/721207560.db2.gz HHGBIPMIKIVNTN-HZPDHXFCSA-N 1 3 340.414 2.671 10 0 EFAEHO CCN1CCN(C[C@H](C)C[NH2+][C@H](C)c2cnn(C3CCC3)c2)CC1 ZINC000924953662 721863976 /nfs/dbraw/zinc/86/39/76/721863976.db2.gz RZXQSMIMADNVGG-IAGOWNOFSA-N 1 3 333.524 2.532 10 0 EFAEHO C[C@H](CC[NH2+]CC1CN(C(=O)OC(C)(C)C)C1)N1CCCCC1 ZINC000894444192 722738477 /nfs/dbraw/zinc/73/84/77/722738477.db2.gz FXILIEGZIVEOTI-OAHLLOKOSA-N 1 3 325.497 2.707 10 0 EFAEHO C[NH+]1CCC(CCO)(NCc2cc3ccnc(Cl)c3s2)CC1 ZINC000894469663 722748491 /nfs/dbraw/zinc/74/84/91/722748491.db2.gz PFDBDPBUPHMLCL-UHFFFAOYSA-N 1 3 339.892 2.886 10 0 EFAEHO CCc1[nH]c(CN2CC[C@H](C3CC[NH+](C)CC3)C2)cc1C(=O)OC ZINC000894779811 722845990 /nfs/dbraw/zinc/84/59/90/722845990.db2.gz PPWJKGRZKBEPFV-HNNXBMFYSA-N 1 3 333.476 2.527 10 0 EFAEHO C[N@@H+]1CC[C@@H]2CN(C[C@H](O)c3cccc(C(F)(F)F)c3)C[C@@H]2C1 ZINC000324474108 723852116 /nfs/dbraw/zinc/85/21/16/723852116.db2.gz NQZFBOHFNQHWJY-YCPHGPKFSA-N 1 3 328.378 2.622 10 0 EFAEHO C[N@H+]1CC[C@@H]2CN(C[C@H](O)c3cccc(C(F)(F)F)c3)C[C@@H]2C1 ZINC000324474108 723852121 /nfs/dbraw/zinc/85/21/21/723852121.db2.gz NQZFBOHFNQHWJY-YCPHGPKFSA-N 1 3 328.378 2.622 10 0 EFAEHO C[C@@H](CN(C)C)[C@@H]1CCCC[N@@H+]1Cc1cccn(C(F)F)c1=O ZINC000895378558 724089141 /nfs/dbraw/zinc/08/91/41/724089141.db2.gz IPJDSOUGJNVNIC-ZFWWWQNUSA-N 1 3 327.419 2.796 10 0 EFAEHO C[C@@H](CN(C)C)[C@@H]1CCCC[N@H+]1Cc1cccn(C(F)F)c1=O ZINC000895378558 724089143 /nfs/dbraw/zinc/08/91/43/724089143.db2.gz IPJDSOUGJNVNIC-ZFWWWQNUSA-N 1 3 327.419 2.796 10 0 EFAEHO COc1ccc(C2=NO[C@@H](C[NH2+][C@H]3CCN(C)C(C)(C)C3)C2)cc1F ZINC000895505208 724164915 /nfs/dbraw/zinc/16/49/15/724164915.db2.gz PAUWFYZKIQRUBQ-LSDHHAIUSA-N 1 3 349.450 2.790 10 0 EFAEHO COc1ccc(C2=NO[C@H](C[NH2+][C@H]3CCN(C)C(C)(C)C3)C2)cc1C ZINC000895500544 724170799 /nfs/dbraw/zinc/17/07/99/724170799.db2.gz AOZMWPBIPODMHY-IRXDYDNUSA-N 1 3 345.487 2.959 10 0 EFAEHO CN1CC[C@@H]([NH2+]C[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)CC1(C)C ZINC000895508517 724173781 /nfs/dbraw/zinc/17/37/81/724173781.db2.gz SORIJIDQMBIICS-IAGOWNOFSA-N 1 3 343.471 2.577 10 0 EFAEHO CN(CCC[NH+]1CCCC1)C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000907960711 727063970 /nfs/dbraw/zinc/06/39/70/727063970.db2.gz VVBFVPUYLMDURS-UHFFFAOYSA-N 1 3 328.460 2.849 10 0 EFAEHO CCCN(C(=O)c1ccc(NC2=NCCC2)cc1)[C@H]1CC[N@H+](C)C1 ZINC000911511485 727553128 /nfs/dbraw/zinc/55/31/28/727553128.db2.gz HCXPDVFEFVDHTR-KRWDZBQOSA-N 1 3 328.460 2.847 10 0 EFAEHO CCCN(C(=O)c1ccc(NC2=NCCC2)cc1)[C@H]1CC[N@@H+](C)C1 ZINC000911511485 727553129 /nfs/dbraw/zinc/55/31/29/727553129.db2.gz HCXPDVFEFVDHTR-KRWDZBQOSA-N 1 3 328.460 2.847 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CC[N@H+](CCCF)CC1(C)C)N1CCCCC1 ZINC000940744292 728229263 /nfs/dbraw/zinc/22/92/63/728229263.db2.gz IEWGFNRKAODQKY-MRXNPFEDSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CC[N@@H+](CCCF)CC1(C)C)N1CCCCC1 ZINC000940744292 728229266 /nfs/dbraw/zinc/22/92/66/728229266.db2.gz IEWGFNRKAODQKY-MRXNPFEDSA-N 1 3 341.515 2.827 10 0 EFAEHO CCOc1cccc(CN2CCC3(C[N@H+](C)C[C@@H]3COC)CC2)c1 ZINC000169789856 728404366 /nfs/dbraw/zinc/40/43/66/728404366.db2.gz UTMFZLSDXKCGKD-GOSISDBHSA-N 1 3 332.488 2.876 10 0 EFAEHO CCOc1cccc(CN2CCC3(C[N@@H+](C)C[C@@H]3COC)CC2)c1 ZINC000169789856 728404370 /nfs/dbraw/zinc/40/43/70/728404370.db2.gz UTMFZLSDXKCGKD-GOSISDBHSA-N 1 3 332.488 2.876 10 0 EFAEHO OC[C@@H]1C[N@@H+](C2CCC2)CC12CCN(Cc1ccc(F)cc1)CC2 ZINC000169782443 728404684 /nfs/dbraw/zinc/40/46/84/728404684.db2.gz LCJNAITZFHCZOH-KRWDZBQOSA-N 1 3 332.463 2.885 10 0 EFAEHO OC[C@@H]1C[N@H+](C2CCC2)CC12CCN(Cc1ccc(F)cc1)CC2 ZINC000169782443 728404687 /nfs/dbraw/zinc/40/46/87/728404687.db2.gz LCJNAITZFHCZOH-KRWDZBQOSA-N 1 3 332.463 2.885 10 0 EFAEHO C[C@@H](C(=O)NCC1([NH2+]CC2=CCCCC2)CC1)N1CCCCCC1 ZINC001569421307 1085193378 /nfs/dbraw/zinc/19/33/78/1085193378.db2.gz RITGFIUBKNNZFD-KRWDZBQOSA-N 1 3 333.520 2.990 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CCCc2ccccc2)CC1 ZINC001569432155 1085201415 /nfs/dbraw/zinc/20/14/15/1085201415.db2.gz NOPRQXGUGVIGRG-ROUUACIJSA-N 1 3 343.515 2.730 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC[C@@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001569466064 1085260896 /nfs/dbraw/zinc/26/08/96/1085260896.db2.gz UOZMATUORAYGHV-PORCLINASA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC[C@@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001569466064 1085260901 /nfs/dbraw/zinc/26/09/01/1085260901.db2.gz UOZMATUORAYGHV-PORCLINASA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)(C(=O)N[C@H](C[NH2+]C/C=C\Cl)C1CCCC1)N1CCCC1 ZINC001569607979 1085434412 /nfs/dbraw/zinc/43/44/12/1085434412.db2.gz YIWASCYTNDICQW-BSDKJSHOSA-N 1 3 341.927 2.878 10 0 EFAEHO CC(C)(C(=O)N1CC[C@@](C)(C[NH2+]CCC2CC2)C1)N1CCCCC1 ZINC001569669732 1085500377 /nfs/dbraw/zinc/50/03/77/1085500377.db2.gz UQOAMNRJORKTTH-FQEVSTJZSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@](C)(C[NH2+]CCCC2CCC2)C1)N(C)C ZINC001569690862 1085522133 /nfs/dbraw/zinc/52/21/33/1085522133.db2.gz QOIAIMYDKKNYHX-ICSRJNTNSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1CN(C(=O)Cc2c[nH]cn2)C[C@@H]1C[NH2+]CCCC1CCCC1 ZINC001569849017 1085672383 /nfs/dbraw/zinc/67/23/83/1085672383.db2.gz RYYKJTISYZBYSX-WBVHZDCISA-N 1 3 332.492 2.607 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@H]2CN(C(=O)[C@H]3CCCCN3CC)C[C@H]2C1 ZINC001569883778 1085717340 /nfs/dbraw/zinc/71/73/40/1085717340.db2.gz ILJDVRSZSVOKQK-DRDDEIGGSA-N 1 3 333.520 2.607 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@H]2CN(C(=O)[C@H]3CCCCN3CC)C[C@H]2C1 ZINC001569883778 1085717349 /nfs/dbraw/zinc/71/73/49/1085717349.db2.gz ILJDVRSZSVOKQK-DRDDEIGGSA-N 1 3 333.520 2.607 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@H]2CCN(C(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001570005819 1085847732 /nfs/dbraw/zinc/84/77/32/1085847732.db2.gz NZGGJEQTHGVRJD-MOPGFXCFSA-N 1 3 343.515 2.665 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@H]2CCN(C(=O)Cc3c[nH]cn3)C2)c1 ZINC001570005417 1085848467 /nfs/dbraw/zinc/84/84/67/1085848467.db2.gz NHBJPSIDUAVSLQ-KRWDZBQOSA-N 1 3 340.471 2.543 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+]CC2CC3(CCC3)C2)C1 ZINC001570016192 1085864873 /nfs/dbraw/zinc/86/48/73/1085864873.db2.gz YUVLRLYJQRAEDM-KRWDZBQOSA-N 1 3 335.536 2.737 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001570018276 1085866353 /nfs/dbraw/zinc/86/63/53/1085866353.db2.gz BFYRRRVUXHMDKL-IBGZPJMESA-N 1 3 343.515 2.727 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](CC[NH2+]C/C=C/c2ccccc2)C1 ZINC001570018641 1085867076 /nfs/dbraw/zinc/86/70/76/1085867076.db2.gz HEMTXLJXQJDUAY-ZGBFETHSSA-N 1 3 341.499 2.624 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[C@H](C[NH2+]CCCF)CC1)CC(C)(C)C ZINC001570045117 1085899366 /nfs/dbraw/zinc/89/93/66/1085899366.db2.gz ZKHFIGPWZAMSHN-WKILWMFISA-N 1 3 329.504 2.589 10 0 EFAEHO CCC/C=C/CC[NH+]1CCC2(CN(C(=O)Cc3c[nH]cn3)C2)CC1 ZINC001570054741 1085908964 /nfs/dbraw/zinc/90/89/64/1085908964.db2.gz CIMSFSLXEAJMRM-SNAWJCMRSA-N 1 3 330.476 2.623 10 0 EFAEHO CC/C(C)=C/C(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CC2CC2)CC1 ZINC001570220981 1086061504 /nfs/dbraw/zinc/06/15/04/1086061504.db2.gz YUFVUXGHJIDVSF-KJKGTHEYSA-N 1 3 345.531 2.892 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@]2(C1)CCCN(C(=O)CN(C)C(C)C)C2 ZINC001570274596 1086116349 /nfs/dbraw/zinc/11/63/49/1086116349.db2.gz HBYDHVLAVZUKRX-YJJPMGAVSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@]2(C1)CCCN(C(=O)CN(C)C(C)C)C2 ZINC001570274596 1086116355 /nfs/dbraw/zinc/11/63/55/1086116355.db2.gz HBYDHVLAVZUKRX-YJJPMGAVSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CC/C=C/c2ccccc2)[C@@H](C)C1 ZINC001570362262 1086168616 /nfs/dbraw/zinc/16/86/16/1086168616.db2.gz RNCSOUGAHQCWOI-FBAPOHRVSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001570363946 1086171271 /nfs/dbraw/zinc/17/12/71/1086171271.db2.gz KQIKRUMLMRULCA-AZUAARDMSA-N 1 3 345.531 2.704 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)CCCC[NH+](C)C)CCN1Cc1ccsc1 ZINC001570449068 1086250815 /nfs/dbraw/zinc/25/08/15/1086250815.db2.gz LVRORSNTPNZPPP-RDJZCZTQSA-N 1 3 337.533 2.949 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N(C)CC(C)(C)C[NH2+]C/C=C\Cl ZINC001570674250 1086453107 /nfs/dbraw/zinc/45/31/07/1086453107.db2.gz VYDGAYODNGCHNT-VIHMKRCTSA-N 1 3 329.916 2.686 10 0 EFAEHO C[NH+](C)CC1(C(=O)NC2(CNCCF)CCCCC2)CCCCC1 ZINC001570799691 1086526918 /nfs/dbraw/zinc/52/69/18/1086526918.db2.gz FTICFOYZZRZGST-UHFFFAOYSA-N 1 3 341.515 2.877 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CCC2CCCC2)C1 ZINC001571197583 1086675540 /nfs/dbraw/zinc/67/55/40/1086675540.db2.gz FIFQILQJZJNTEB-FHWLQOOXSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CCC[C@@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001571308217 1086707820 /nfs/dbraw/zinc/70/78/20/1086707820.db2.gz LNULWTXSGYXVHF-NVXWUHKLSA-N 1 3 349.494 2.850 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)CCC[NH2+]Cc1ccsc1 ZINC001571326203 1086723753 /nfs/dbraw/zinc/72/37/53/1086723753.db2.gz PNLPSSXWCOADSQ-NVXWUHKLSA-N 1 3 337.533 2.997 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C[NH2+]CCCF)C(C)(C)C)N1CCCC1 ZINC001571639306 1087009580 /nfs/dbraw/zinc/00/95/80/1087009580.db2.gz LKOQZESPHZXFPK-HOTGVXAUSA-N 1 3 329.504 2.587 10 0 EFAEHO CCCC[NH2+][C@@H]1CN(C(=O)CN(C)C2CCC2)CC[C@@H]1C(F)(F)F ZINC001571652092 1087022765 /nfs/dbraw/zinc/02/27/65/1087022765.db2.gz HYAQEOQREBJORP-LSDHHAIUSA-N 1 3 349.441 2.640 10 0 EFAEHO CC1CCN(CC(=O)N(C)C2CC([NH2+]CCCC3CCC3)C2)CC1 ZINC001571663968 1087029970 /nfs/dbraw/zinc/02/99/70/1087029970.db2.gz NOOWTULUBBCOPP-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(C[N@H+]2CC=C(CNC(=O)[C@@H](C(C)C)N(C)C)CC2)cc1 ZINC001571694797 1087062757 /nfs/dbraw/zinc/06/27/57/1087062757.db2.gz SVXUSZQZJDYCBW-HXUWFJFHSA-N 1 3 343.515 2.830 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC=C(CNC(=O)[C@@H](C(C)C)N(C)C)CC2)cc1 ZINC001571694797 1087062764 /nfs/dbraw/zinc/06/27/64/1087062764.db2.gz SVXUSZQZJDYCBW-HXUWFJFHSA-N 1 3 343.515 2.830 10 0 EFAEHO C[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1=CCCCC1 ZINC001266971676 1092221991 /nfs/dbraw/zinc/22/19/91/1092221991.db2.gz NYTSWSFSOMXOOJ-KXBFYZLASA-N 1 3 339.499 2.794 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2CCN(C(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001267018844 1092376037 /nfs/dbraw/zinc/37/60/37/1092376037.db2.gz OPCURKTYOXBFDT-VQTJNVASSA-N 1 3 345.531 2.704 10 0 EFAEHO C[C@@H](CCNC/C(Cl)=C\Cl)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001649450923 1092478541 /nfs/dbraw/zinc/47/85/41/1092478541.db2.gz PONALZOCRJNLLG-CVCOIXHCSA-N 1 3 336.307 2.664 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CCC[NH2+]Cc1cnccc1C ZINC001649471886 1092514895 /nfs/dbraw/zinc/51/48/95/1092514895.db2.gz LZDYYNITACJILQ-HKUYNNGSSA-N 1 3 346.519 2.639 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](C[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001267067270 1092524510 /nfs/dbraw/zinc/52/45/10/1092524510.db2.gz OUZQFGIMCOJOES-DLBZAZTESA-N 1 3 325.541 2.837 10 0 EFAEHO CN(CC(=O)NCCC[C@@H]1CCC[N@@H+]1CCC(F)(F)F)C1CCC1 ZINC001267169863 1093044591 /nfs/dbraw/zinc/04/45/91/1093044591.db2.gz YRCWSRHMEDHKGV-OAHLLOKOSA-N 1 3 349.441 2.784 10 0 EFAEHO CN(CC(=O)NCCC[C@@H]1CCC[N@H+]1CCC(F)(F)F)C1CCC1 ZINC001267169863 1093044597 /nfs/dbraw/zinc/04/45/97/1093044597.db2.gz YRCWSRHMEDHKGV-OAHLLOKOSA-N 1 3 349.441 2.784 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001267173592 1093063822 /nfs/dbraw/zinc/06/38/22/1093063822.db2.gz AWWVFZCMXWIKDB-CRAIPNDOSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001267173592 1093063831 /nfs/dbraw/zinc/06/38/31/1093063831.db2.gz AWWVFZCMXWIKDB-CRAIPNDOSA-N 1 3 327.488 2.580 10 0 EFAEHO Cc1cncc(C[N@H+]2CCC[C@H]2CCCNC(=O)CN(C)C(C)C)c1 ZINC001267180639 1093098853 /nfs/dbraw/zinc/09/88/53/1093098853.db2.gz AVJMPZSXEOWWAS-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1cncc(C[N@@H+]2CCC[C@H]2CCCNC(=O)CN(C)C(C)C)c1 ZINC001267180639 1093098863 /nfs/dbraw/zinc/09/88/63/1093098863.db2.gz AVJMPZSXEOWWAS-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO CCN(CC=C(C)C)CCNC(=O)[C@H]1C[N@H+](C)C[C@@H]1c1ccccc1 ZINC001267250867 1093370278 /nfs/dbraw/zinc/37/02/78/1093370278.db2.gz XLLKCYKBRBPGME-UXHICEINSA-N 1 3 343.515 2.736 10 0 EFAEHO CCN(CC=C(C)C)CCNC(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1 ZINC001267250867 1093370282 /nfs/dbraw/zinc/37/02/82/1093370282.db2.gz XLLKCYKBRBPGME-UXHICEINSA-N 1 3 343.515 2.736 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+]CCN(C)C(=O)[C@H]1CCCCN1C ZINC001267391267 1094469842 /nfs/dbraw/zinc/46/98/42/1094469842.db2.gz DTPONBIRFDAMBO-LJQANCHMSA-N 1 3 346.519 2.546 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[N@H+](CCC2=CCCCC2)C1)N(C)C ZINC001481097403 1094473887 /nfs/dbraw/zinc/47/38/87/1094473887.db2.gz DXRAPMUFHZHFRK-MOPGFXCFSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[N@@H+](CCC2=CCCCC2)C1)N(C)C ZINC001481097403 1094473892 /nfs/dbraw/zinc/47/38/92/1094473892.db2.gz DXRAPMUFHZHFRK-MOPGFXCFSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CC[N@H+](CCC2=CCCCC2)C1)N(C)C ZINC001481097404 1094474113 /nfs/dbraw/zinc/47/41/13/1094474113.db2.gz DXRAPMUFHZHFRK-OALUTQOASA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CC[N@@H+](CCC2=CCCCC2)C1)N(C)C ZINC001481097404 1094474114 /nfs/dbraw/zinc/47/41/14/1094474114.db2.gz DXRAPMUFHZHFRK-OALUTQOASA-N 1 3 335.536 2.901 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001481462761 1094712922 /nfs/dbraw/zinc/71/29/22/1094712922.db2.gz VXZHEYIVSKIYNK-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001481462761 1094712938 /nfs/dbraw/zinc/71/29/38/1094712938.db2.gz VXZHEYIVSKIYNK-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](F)C[N@@H+]1CC[C@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001481462991 1094715194 /nfs/dbraw/zinc/71/51/94/1094715194.db2.gz WTYKMFVGIOFVAP-LPHOPBHVSA-N 1 3 349.494 2.938 10 0 EFAEHO CC[C@H](F)C[N@H+]1CC[C@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001481462991 1094715206 /nfs/dbraw/zinc/71/52/06/1094715206.db2.gz WTYKMFVGIOFVAP-LPHOPBHVSA-N 1 3 349.494 2.938 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NCC[C@@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001481465141 1094740450 /nfs/dbraw/zinc/74/04/50/1094740450.db2.gz OWHUSMPWMHJDPX-WBVHZDCISA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NCC[C@@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001481465141 1094740459 /nfs/dbraw/zinc/74/04/59/1094740459.db2.gz OWHUSMPWMHJDPX-WBVHZDCISA-N 1 3 349.906 2.620 10 0 EFAEHO CCC/C=C\CC[NH+]1CC2(C1)CCN(C(=O)CN1CCCC1)CC2 ZINC001268046496 1094859541 /nfs/dbraw/zinc/85/95/41/1094859541.db2.gz COKSSCHVTHZXKE-PLNGDYQASA-N 1 3 333.520 2.753 10 0 EFAEHO C[C@H](F)CC[N@H+](C)C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001481510099 1095007573 /nfs/dbraw/zinc/00/75/73/1095007573.db2.gz TXYMCUBIQILTSW-WMZOPIPTSA-N 1 3 349.494 2.890 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001481510099 1095007588 /nfs/dbraw/zinc/00/75/88/1095007588.db2.gz TXYMCUBIQILTSW-WMZOPIPTSA-N 1 3 349.494 2.890 10 0 EFAEHO CC(C)N(CCF)CCCNC(=O)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001267502933 1095072358 /nfs/dbraw/zinc/07/23/58/1095072358.db2.gz ISKWPBMPJDQSBE-QGZVFWFLSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N(CCF)CCCNC(=O)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001267502933 1095072374 /nfs/dbraw/zinc/07/23/74/1095072374.db2.gz ISKWPBMPJDQSBE-QGZVFWFLSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CCC[N@H+](CCCCCF)C1)N1CCCCC1 ZINC001481534808 1095169664 /nfs/dbraw/zinc/16/96/64/1095169664.db2.gz XEGXGEXHLHECHM-KRWDZBQOSA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CCC[N@@H+](CCCCCF)C1)N1CCCCC1 ZINC001481534808 1095169668 /nfs/dbraw/zinc/16/96/68/1095169668.db2.gz XEGXGEXHLHECHM-KRWDZBQOSA-N 1 3 341.515 2.971 10 0 EFAEHO CCN1CC[C@@H](C[NH2+]CCC2CCN(C(=O)OC(C)(C)C)CC2)C1 ZINC000695194386 1095254460 /nfs/dbraw/zinc/25/44/60/1095254460.db2.gz XJULXHQAZVVGJC-KRWDZBQOSA-N 1 3 339.524 2.955 10 0 EFAEHO CC(C)C[C@H](CNCC=C(Cl)Cl)NC(=O)C12CC[NH+](CC1)C2 ZINC001268115182 1095393280 /nfs/dbraw/zinc/39/32/80/1095393280.db2.gz OPZSCOUVTYBQMD-CYBMUJFWSA-N 1 3 348.318 2.522 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@H](C[NH2+]C/C=C\Cl)C2CCCCC2)C1 ZINC001268118684 1095404891 /nfs/dbraw/zinc/40/48/91/1095404891.db2.gz CWYMRSLFBIXBJH-CTHFIRIDSA-N 1 3 341.927 2.735 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]CCN(C)C(=O)[C@@H]2CCCN2C)cc1 ZINC001481215567 1095689900 /nfs/dbraw/zinc/68/99/00/1095689900.db2.gz LAYZVQKYMGQXIM-IBGZPJMESA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCC[N@@H+]1CC1=CCCCC1)N1CCCC1 ZINC001481052882 1096179473 /nfs/dbraw/zinc/17/94/73/1096179473.db2.gz PFLWGHSJMLNNLP-SFHVURJKSA-N 1 3 333.520 2.942 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCC[N@H+]1CC1=CCCCC1)N1CCCC1 ZINC001481052882 1096179478 /nfs/dbraw/zinc/17/94/78/1096179478.db2.gz PFLWGHSJMLNNLP-SFHVURJKSA-N 1 3 333.520 2.942 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)C[NH+]3[C@H](C)CC[C@H]3C)C2)c(C)c1 ZINC001481660976 1096259009 /nfs/dbraw/zinc/25/90/09/1096259009.db2.gz QVWSBEKGBCRQPA-QZTJIDSGSA-N 1 3 343.515 2.724 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)C[N@H+]3[C@H](C)CC[C@@H]3C)C2)c(C)c1 ZINC001481660974 1096259286 /nfs/dbraw/zinc/25/92/86/1096259286.db2.gz QVWSBEKGBCRQPA-HDICACEKSA-N 1 3 343.515 2.724 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)C[N@@H+]3[C@H](C)CC[C@@H]3C)C2)c(C)c1 ZINC001481660974 1096259292 /nfs/dbraw/zinc/25/92/92/1096259292.db2.gz QVWSBEKGBCRQPA-HDICACEKSA-N 1 3 343.515 2.724 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C)CC[NH2+]CC1CC2(CCC2)C1 ZINC001268364104 1096397208 /nfs/dbraw/zinc/39/72/08/1096397208.db2.gz AUXHBWXOTMOFAN-AEFFLSMTSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccccc1Cl)NC(=O)CN1CC[C@H](C)C1 ZINC001268399711 1096492869 /nfs/dbraw/zinc/49/28/69/1096492869.db2.gz KBHIIHFRRQFKSS-LSDHHAIUSA-N 1 3 337.895 2.666 10 0 EFAEHO CCCCC[NH2+]CC[C@@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001268399770 1096492910 /nfs/dbraw/zinc/49/29/10/1096492910.db2.gz LKAWQFLSYOJFFZ-CRAIPNDOSA-N 1 3 329.504 2.874 10 0 EFAEHO CN(C(=O)CCCC[NH+](C)C)[C@H]1CCN(CCc2ccccc2F)C1 ZINC001481746143 1096501626 /nfs/dbraw/zinc/50/16/26/1096501626.db2.gz AFNOSYFAVWODIO-SFHVURJKSA-N 1 3 349.494 2.633 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)[NH+]1CCCC1 ZINC001481753574 1096534817 /nfs/dbraw/zinc/53/48/17/1096534817.db2.gz WMYRIKLBHGQQHF-PMACEKPBSA-N 1 3 343.515 2.840 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CC[C@@H](C)NC(=O)[C@@H](C(C)C)N(C)C ZINC001268418575 1096568863 /nfs/dbraw/zinc/56/88/63/1096568863.db2.gz YMZRMVTWCCFZQY-CRAIPNDOSA-N 1 3 337.483 2.705 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+]Cc1cccc2cccnc21 ZINC001268425439 1096578302 /nfs/dbraw/zinc/57/83/02/1096578302.db2.gz FRCMAGVWLQBVNT-MRXNPFEDSA-N 1 3 342.487 2.559 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1cc(C)ccc1F ZINC001268425183 1096583902 /nfs/dbraw/zinc/58/39/02/1096583902.db2.gz DAKXDBYWDFCGRK-LPHOPBHVSA-N 1 3 349.494 2.993 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC(C)(C)C[NH2+]CC[C@@H](C)F ZINC001282334789 1096589968 /nfs/dbraw/zinc/58/99/68/1096589968.db2.gz ILSFTMZBRGKYFW-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001481774498 1096672561 /nfs/dbraw/zinc/67/25/61/1096672561.db2.gz KZNCOZRGFNORCG-MJGOQNOKSA-N 1 3 347.547 2.831 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001481774498 1096672568 /nfs/dbraw/zinc/67/25/68/1096672568.db2.gz KZNCOZRGFNORCG-MJGOQNOKSA-N 1 3 347.547 2.831 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001481774496 1096673431 /nfs/dbraw/zinc/67/34/31/1096673431.db2.gz KZNCOZRGFNORCG-HKUYNNGSSA-N 1 3 347.547 2.831 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001481774496 1096673439 /nfs/dbraw/zinc/67/34/39/1096673439.db2.gz KZNCOZRGFNORCG-HKUYNNGSSA-N 1 3 347.547 2.831 10 0 EFAEHO CCN(CCNCc1cc(C)ccc1F)C(=O)[C@H](C(C)C)[NH+](C)C ZINC001268457722 1096718910 /nfs/dbraw/zinc/71/89/10/1096718910.db2.gz ODIVFSKAWONFTN-SFHVURJKSA-N 1 3 337.483 2.658 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1ccc(F)cc1C ZINC001481816756 1096732802 /nfs/dbraw/zinc/73/28/02/1096732802.db2.gz OWVNGIXXZWBECN-MOPGFXCFSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](C(=O)N(CC)CC[NH2+]CC1CCC(C)(C)CC1)N(C)C ZINC001268458306 1096732949 /nfs/dbraw/zinc/73/29/49/1096732949.db2.gz KWIKPTMVRLTPAB-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]CCc1ccccc1F ZINC001481811462 1096736520 /nfs/dbraw/zinc/73/65/20/1096736520.db2.gz SKAIBCLTLHFQON-HKUYNNGSSA-N 1 3 349.494 2.725 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]CC1CCC(F)(F)CC1 ZINC001481881133 1096850685 /nfs/dbraw/zinc/85/06/85/1096850685.db2.gz JBHKPYXHIKDYEX-HNNXBMFYSA-N 1 3 333.467 2.637 10 0 EFAEHO CCN(CCNCc1cc(C)ccc1F)C(=O)[C@@H](C(C)C)[NH+](C)C ZINC001268477221 1096875837 /nfs/dbraw/zinc/87/58/37/1096875837.db2.gz ODIVFSKAWONFTN-GOSISDBHSA-N 1 3 337.483 2.658 10 0 EFAEHO CCN(CC[NH2+]C[C@H]1CCCC(F)(F)C1)C(=O)[C@@H](C(C)C)N(C)C ZINC001268476122 1096878932 /nfs/dbraw/zinc/87/89/32/1096878932.db2.gz FDPIMCCDXPRAQV-JKSUJKDBSA-N 1 3 347.494 2.836 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001268491161 1096959847 /nfs/dbraw/zinc/95/98/47/1096959847.db2.gz LIQOVKARJSRXLW-IAGOWNOFSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@H](C(=O)N(CC)CC[NH2+]Cc1cc(C)sc1C)N(C)C ZINC001268493064 1096967816 /nfs/dbraw/zinc/96/78/16/1096967816.db2.gz QOTHPDGXYKPZCZ-MRXNPFEDSA-N 1 3 325.522 2.643 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc(Cl)c1)C(=O)[C@H](C(C)C)N(C)C ZINC001268493579 1096968640 /nfs/dbraw/zinc/96/86/40/1096968640.db2.gz QUFMYZMYUVSUBE-KRWDZBQOSA-N 1 3 339.911 2.864 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)[C@@H](C(C)C)[NH+]1CCCC1 ZINC001268499380 1096998029 /nfs/dbraw/zinc/99/80/29/1096998029.db2.gz KRQSSRIZUBQITN-LJQANCHMSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[C@H]([NH2+]CCCF)CC1)N1CCCCC1 ZINC001482016029 1097088826 /nfs/dbraw/zinc/08/88/26/1097088826.db2.gz PWVOPLMAVZLXRL-WKILWMFISA-N 1 3 327.488 2.628 10 0 EFAEHO O=C(NC/C=C\CNC/C=C/Cl)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001268538874 1097145138 /nfs/dbraw/zinc/14/51/38/1097145138.db2.gz NVTVRBWDWQSTKE-ITNWBTHSSA-N 1 3 339.911 2.656 10 0 EFAEHO O=C(NC/C=C\CNC/C=C/Cl)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001268538874 1097145140 /nfs/dbraw/zinc/14/51/40/1097145140.db2.gz NVTVRBWDWQSTKE-ITNWBTHSSA-N 1 3 339.911 2.656 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C/C=C/CNC(=O)[C@H](C(C)C)N(C)C ZINC001268552650 1097178122 /nfs/dbraw/zinc/17/81/22/1097178122.db2.gz RRDONWOQSCMKQQ-TXLWSROUSA-N 1 3 331.504 2.904 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\CNCc1ccc(Cl)s1)[NH+](C)C ZINC001268553057 1097182103 /nfs/dbraw/zinc/18/21/03/1097182103.db2.gz WGRMUBLIIWJQPW-YVACAVLKSA-N 1 3 343.924 2.750 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC[C@@H]2C[NH2+]C/C=C/Cl)c1 ZINC001482068686 1097228111 /nfs/dbraw/zinc/22/81/11/1097228111.db2.gz WOHOQVKANLMCLB-HFTQHKIXSA-N 1 3 335.879 2.695 10 0 EFAEHO C[NH+](C)CCCC(=O)NC/C=C/CN[C@@H]1CCc2ccc(Cl)cc21 ZINC001268583536 1097288222 /nfs/dbraw/zinc/28/82/22/1097288222.db2.gz FTAGINPHBCXIRZ-OAJJDEHYSA-N 1 3 349.906 2.931 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC/C=C/C[NH2+]CCC2CCCCCC2)C1 ZINC001268591786 1097315044 /nfs/dbraw/zinc/31/50/44/1097315044.db2.gz UHQSMOFOXAYOOU-IPLHWJFFSA-N 1 3 335.536 2.951 10 0 EFAEHO O=C(NC/C=C/CNCc1ccsc1)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001268602586 1097449833 /nfs/dbraw/zinc/44/98/33/1097449833.db2.gz MDRZNXODFZVRRY-BCGROGQWSA-N 1 3 333.501 2.527 10 0 EFAEHO O=C(NC/C=C/CNCc1ccsc1)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001268602586 1097449837 /nfs/dbraw/zinc/44/98/37/1097449837.db2.gz MDRZNXODFZVRRY-BCGROGQWSA-N 1 3 333.501 2.527 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C/C=C/CNC(=O)CN1CCC(C)CC1 ZINC001268607899 1097454713 /nfs/dbraw/zinc/45/47/13/1097454713.db2.gz KFQLNLKORISLKE-ONEGZZNKSA-N 1 3 347.478 2.628 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C/C[NH2+]CC2CCC3(CC3)CC2)CC1 ZINC001268609422 1097456918 /nfs/dbraw/zinc/45/69/18/1097456918.db2.gz RPOHMXSZJCYREM-NSCUHMNNSA-N 1 3 347.547 2.951 10 0 EFAEHO Cc1cc(C[NH2+]C/C=C/CNC(=O)[C@@H](C(C)C)N(C)C)c(C)s1 ZINC001268618486 1097469441 /nfs/dbraw/zinc/46/94/41/1097469441.db2.gz WRSOEIKHJSKXTG-IWAYRVGRSA-N 1 3 337.533 2.713 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C[NH2+]CCCc1ccc(Cl)cc1 ZINC001268671275 1097526311 /nfs/dbraw/zinc/52/63/11/1097526311.db2.gz UXWMRDCKKODAQR-CYBMUJFWSA-N 1 3 348.878 2.641 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+]CC[C@H]1CCc2ccccc21 ZINC001268674575 1097528974 /nfs/dbraw/zinc/52/89/74/1097528974.db2.gz VMTRFJPGYDSVLH-SJLPKXTDSA-N 1 3 331.504 2.541 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@H](C)NC(=O)[C@@H]1CCCN1C(C)C ZINC001268689069 1097542935 /nfs/dbraw/zinc/54/29/35/1097542935.db2.gz QVCKQACXDSYFHB-PXNSSMCTSA-N 1 3 345.531 2.759 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C[NH2+]CC[C@H]1CCc2ccccc21)N(C)C ZINC001268704395 1097555180 /nfs/dbraw/zinc/55/51/80/1097555180.db2.gz AKKPNDYYONCMAD-WDYCEAGBSA-N 1 3 331.504 2.541 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[NH2+]CC[C@H]2CCCC2(F)F)C1 ZINC001268847120 1097682636 /nfs/dbraw/zinc/68/26/36/1097682636.db2.gz CZBVKNQWAMPHBJ-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)N(C)CCC[NH2+][C@H]1CCCc2ccccc21 ZINC001268920365 1097719637 /nfs/dbraw/zinc/71/96/37/1097719637.db2.gz NMQIGCHWHKMWBG-IBGZPJMESA-N 1 3 331.504 2.844 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@H]2CCN(CCCCCF)C2)CCCCC1 ZINC001269046402 1097805867 /nfs/dbraw/zinc/80/58/67/1097805867.db2.gz IYIBXEAKQAUNTP-KRWDZBQOSA-N 1 3 341.515 2.829 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001269114286 1097866156 /nfs/dbraw/zinc/86/61/56/1097866156.db2.gz AVUYLEIVGRWRBU-LPHOPBHVSA-N 1 3 339.499 2.650 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N(C)[C@@H]1CC[N@H+](CCCCCF)C1 ZINC001269240423 1097976180 /nfs/dbraw/zinc/97/61/80/1097976180.db2.gz LDEUUEDIPOFDGC-IAGOWNOFSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N(C)[C@@H]1CC[N@@H+](CCCCCF)C1 ZINC001269240423 1097976185 /nfs/dbraw/zinc/97/61/85/1097976185.db2.gz LDEUUEDIPOFDGC-IAGOWNOFSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC=C(C)C ZINC001269471118 1098164138 /nfs/dbraw/zinc/16/41/38/1098164138.db2.gz FYFNSVATYIHVAS-YJBOKZPZSA-N 1 3 327.488 2.650 10 0 EFAEHO CC(C)C[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CCCC1 ZINC001482230318 1098235508 /nfs/dbraw/zinc/23/55/08/1098235508.db2.gz PZKXNOIUKJHGQN-LJQANCHMSA-N 1 3 341.515 2.874 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CCCC1 ZINC001482236064 1098333465 /nfs/dbraw/zinc/33/34/65/1098333465.db2.gz CBHMLLLIRWPAFU-FGTMMUONSA-N 1 3 335.536 2.783 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CCCC1 ZINC001482236065 1098333791 /nfs/dbraw/zinc/33/37/91/1098333791.db2.gz CBHMLLLIRWPAFU-KURKYZTESA-N 1 3 335.536 2.783 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+]C[C@@H]2CCC(F)(F)C2)CCCC1 ZINC001482236083 1098334205 /nfs/dbraw/zinc/33/42/05/1098334205.db2.gz CREOFTHAJIORDQ-OAHLLOKOSA-N 1 3 345.478 2.782 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2ccccc2F)CCCC1 ZINC001482238040 1098369567 /nfs/dbraw/zinc/36/95/67/1098369567.db2.gz DTVNWNPQAGWWFU-UHFFFAOYSA-N 1 3 335.467 2.685 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC[C@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269693395 1098372952 /nfs/dbraw/zinc/37/29/52/1098372952.db2.gz UOZMATUORAYGHV-LGYYHMKYSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC[C@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269693395 1098372958 /nfs/dbraw/zinc/37/29/58/1098372958.db2.gz UOZMATUORAYGHV-LGYYHMKYSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[NH+]1CC2(C1)CCN(C(=O)CN1CC[C@@H](C)C1)CC2 ZINC001482245234 1098467853 /nfs/dbraw/zinc/46/78/53/1098467853.db2.gz UHNWPTLTDUCIBB-PYTPGESOSA-N 1 3 333.520 2.609 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(CC[NH2+]CCC(C)(C)C)CC2)C1 ZINC001269907720 1098514107 /nfs/dbraw/zinc/51/41/07/1098514107.db2.gz IAFPZFHTCIECFZ-QGZVFWFLSA-N 1 3 337.552 2.983 10 0 EFAEHO Cc1ccc(C[NH2+]CCC2CCN(C(=O)Cc3c[nH]cn3)CC2)cc1 ZINC001269913692 1098518441 /nfs/dbraw/zinc/51/84/41/1098518441.db2.gz OOOFRFFPDLRGFI-UHFFFAOYSA-N 1 3 340.471 2.679 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[NH2+]Cc2ccccc2F)CC1)N(C)C ZINC001269934900 1098531434 /nfs/dbraw/zinc/53/14/34/1098531434.db2.gz DZJFAWOMBJKNGD-LJQANCHMSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(CC[NH2+]CCC(C)(C)C)CC1 ZINC001269952269 1098543695 /nfs/dbraw/zinc/54/36/95/1098543695.db2.gz UDYJXGCWQKYUFJ-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H](C(=O)N[C@H]1CC[C@H]([NH2+]CCCF)CC1)N1CCCCCC1 ZINC001270025102 1098608365 /nfs/dbraw/zinc/60/83/65/1098608365.db2.gz WRYCENIPUHDDDQ-ULQDDVLXSA-N 1 3 327.488 2.628 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC[NH2+]Cc2ccccc2)CC1)N(C)C ZINC001267918085 1098650154 /nfs/dbraw/zinc/65/01/54/1098650154.db2.gz ZXOKIYYMILJHEQ-IBGZPJMESA-N 1 3 331.504 2.745 10 0 EFAEHO O=C(NCc1ccc(CNC/C=C/Cl)cc1)C12CCC[NH+]1CCC2 ZINC001270065150 1098650770 /nfs/dbraw/zinc/65/07/70/1098650770.db2.gz FXJIHZCQKDEEQW-XCVCLJGOSA-N 1 3 347.890 2.773 10 0 EFAEHO CC(C)=CC[NH2+]Cc1ccc(CNC(=O)[C@@H](C(C)C)N(C)C)cc1 ZINC001270081370 1098669459 /nfs/dbraw/zinc/66/94/59/1098669459.db2.gz BIWPHOMPGWCAJG-LJQANCHMSA-N 1 3 331.504 2.945 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[NH2+]Cc1cccc2ccccc21)N(C)C ZINC001481281241 1098723455 /nfs/dbraw/zinc/72/34/55/1098723455.db2.gz GXRJCAXXHFZKJT-IBGZPJMESA-N 1 3 327.472 2.728 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@@H]1CCCN1C(=O)[C@H](CC)N(C)C ZINC001270136013 1098732581 /nfs/dbraw/zinc/73/25/81/1098732581.db2.gz AIULIVOOKVLNLX-PMACEKPBSA-N 1 3 345.531 2.712 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@@H]1C[NH2+]CCCc1ccccc1)N(C)C ZINC001270222280 1098821296 /nfs/dbraw/zinc/82/12/96/1098821296.db2.gz VRKSFQRZRBDGKP-UXHICEINSA-N 1 3 345.531 2.786 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[NH2+]Cc1ccc(Cl)c(Cl)c1)N(C)C ZINC001481245376 1098886675 /nfs/dbraw/zinc/88/66/75/1098886675.db2.gz IHNGQTHUXUWYED-OAHLLOKOSA-N 1 3 346.302 2.882 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[NH2+]CCCCC(F)(F)F)N(C)C ZINC001267957904 1098897633 /nfs/dbraw/zinc/89/76/33/1098897633.db2.gz BNEUVOXWMIQUFZ-ZIAGYGMSSA-N 1 3 337.430 2.640 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@@H]1C[NH2+]CCc1ccccc1 ZINC001270309037 1098940692 /nfs/dbraw/zinc/94/06/92/1098940692.db2.gz STGSEMXXQJPOJH-UXHICEINSA-N 1 3 343.515 2.684 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC2(C1)CCN(C(=O)[C@@H](CC)N(C)C)CC2 ZINC001270339180 1098980560 /nfs/dbraw/zinc/98/05/60/1098980560.db2.gz CBGMHTMWFNWICV-LKGOPFMKSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC2(C1)CCN(C(=O)[C@@H](CC)N(C)C)CC2 ZINC001270339180 1098980570 /nfs/dbraw/zinc/98/05/70/1098980570.db2.gz CBGMHTMWFNWICV-LKGOPFMKSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[NH2+]CCCc1cccc(F)c1)N(C)C ZINC001267969122 1098984689 /nfs/dbraw/zinc/98/46/89/1098984689.db2.gz FORBJUXXJNBBJQ-RTBURBONSA-N 1 3 349.494 2.679 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N(C)[C@@H](C)CNCc1cc(C)ccc1F ZINC001482294240 1099171444 /nfs/dbraw/zinc/17/14/44/1099171444.db2.gz ZKSWNUXIVQLWFJ-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N(C)[C@@H](C)CNCc1cc(C)ccc1F ZINC001482294240 1099171445 /nfs/dbraw/zinc/17/14/45/1099171445.db2.gz ZKSWNUXIVQLWFJ-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@]1(C)CC[N@H+](CCCCCF)C1 ZINC001270582545 1099231335 /nfs/dbraw/zinc/23/13/35/1099231335.db2.gz IHMCVJSQNSQHFY-SJLPKXTDSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@]1(C)CC[N@@H+](CCCCCF)C1 ZINC001270582545 1099231340 /nfs/dbraw/zinc/23/13/40/1099231340.db2.gz IHMCVJSQNSQHFY-SJLPKXTDSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(C(C)C)nc1C)N(C)C ZINC001482301303 1099271289 /nfs/dbraw/zinc/27/12/89/1099271289.db2.gz ZSILUGWWTVIGJM-DNVCBOLYSA-N 1 3 348.535 2.790 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]Cc1cc(F)ccc1C ZINC001481320461 1099282408 /nfs/dbraw/zinc/28/24/08/1099282408.db2.gz ZMFBTKLCJPHIBS-GOSISDBHSA-N 1 3 335.467 2.557 10 0 EFAEHO C[C@H](C(=O)N[C@@]1(C)CC[N@H+](CCCCCF)C1)N1CCCCCC1 ZINC001270633276 1099331627 /nfs/dbraw/zinc/33/16/27/1099331627.db2.gz RRYFPKLBVHDLPQ-MJGOQNOKSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@H](C(=O)N[C@@]1(C)CC[N@@H+](CCCCCF)C1)N1CCCCCC1 ZINC001270633276 1099331637 /nfs/dbraw/zinc/33/16/37/1099331637.db2.gz RRYFPKLBVHDLPQ-MJGOQNOKSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@H]([NH2+]CCCF)C1CCN(C(=O)c2cccc(CN(C)C)c2)CC1 ZINC001481343727 1099389892 /nfs/dbraw/zinc/38/98/92/1099389892.db2.gz QMZPSKARPFQVJO-INIZCTEOSA-N 1 3 349.494 2.938 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1ccccc1F ZINC001481355129 1099440033 /nfs/dbraw/zinc/44/00/33/1099440033.db2.gz WKXZGYXWLCXDBJ-QGZVFWFLSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1ccccc1F ZINC001481355129 1099440039 /nfs/dbraw/zinc/44/00/39/1099440039.db2.gz WKXZGYXWLCXDBJ-QGZVFWFLSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@](C)(C[NH2+]CCc2ccccc2F)C1)N(C)C ZINC001270796090 1099567794 /nfs/dbraw/zinc/56/77/94/1099567794.db2.gz CPWXQYFQOIAMHU-AZUAARDMSA-N 1 3 349.494 2.537 10 0 EFAEHO CCCN(C(=O)[C@H](C)N1CCCCCC1)[C@@H]1CC[N@H+](CC2CC2)C1 ZINC001481407122 1099653038 /nfs/dbraw/zinc/65/30/38/1099653038.db2.gz PGMVQJRCLWRKDR-PKOBYXMFSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN(C(=O)[C@H](C)N1CCCCCC1)[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC001481407122 1099653047 /nfs/dbraw/zinc/65/30/47/1099653047.db2.gz PGMVQJRCLWRKDR-PKOBYXMFSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN(C(=O)[C@@H](C)N1CCCCCC1)[C@H]1CC[N@H+](CC2CC2)C1 ZINC001481407121 1099653398 /nfs/dbraw/zinc/65/33/98/1099653398.db2.gz PGMVQJRCLWRKDR-MJGOQNOKSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN(C(=O)[C@@H](C)N1CCCCCC1)[C@H]1CC[N@@H+](CC2CC2)C1 ZINC001481407121 1099653402 /nfs/dbraw/zinc/65/34/02/1099653402.db2.gz PGMVQJRCLWRKDR-MJGOQNOKSA-N 1 3 335.536 2.974 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@H](C)N(C)C(=O)Cc2c[nH]cn2)c(C)c1 ZINC001482335438 1099659613 /nfs/dbraw/zinc/65/96/13/1099659613.db2.gz LYTIXXQPMYTBDZ-INIZCTEOSA-N 1 3 328.460 2.514 10 0 EFAEHO CCCC[NH2+]C[C@]1(C)CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001270847415 1099709847 /nfs/dbraw/zinc/70/98/47/1099709847.db2.gz MTKJCYHSFZNNEI-FQEVSTJZSA-N 1 3 331.504 2.990 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[NH2+]CC[C@H]1CCc2ccccc21)N(C)C ZINC001481277132 1099757818 /nfs/dbraw/zinc/75/78/18/1099757818.db2.gz KTULMSUBGMDJHO-UYAOXDASSA-N 1 3 345.531 2.741 10 0 EFAEHO C[C@@H]1CCCC[C@@]1(C[NH2+]CCF)NC(=O)c1cccc(CN(C)C)c1 ZINC001267873596 1099786274 /nfs/dbraw/zinc/78/62/74/1099786274.db2.gz ZESGGEJJFCFIHO-UZLBHIALSA-N 1 3 349.494 2.986 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)NCCCN2CCc3ccccc3C2)C1 ZINC001625490108 1099817104 /nfs/dbraw/zinc/81/71/04/1099817104.db2.gz YJSHWAJXKZMRGY-UYAOXDASSA-N 1 3 343.515 2.671 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[NH2+]CCC1CCCCCC1)N(C)C ZINC001481277716 1099828691 /nfs/dbraw/zinc/82/86/91/1099828691.db2.gz VGGFEKCXBJUSQL-GOSISDBHSA-N 1 3 325.541 2.981 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H](CC[NH2+]Cc2cccc(F)c2)C1 ZINC001267883063 1099833255 /nfs/dbraw/zinc/83/32/55/1099833255.db2.gz XGEYKYWFEGPEEX-LPHOPBHVSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@@H](CNCC=C(Cl)Cl)N(C)C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001270994441 1100346023 /nfs/dbraw/zinc/34/60/23/1100346023.db2.gz FKJBZHPIYPISMW-STQMWFEESA-N 1 3 336.307 2.616 10 0 EFAEHO C[C@@H](CNCC=C(Cl)Cl)N(C)C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001270994441 1100346034 /nfs/dbraw/zinc/34/60/34/1100346034.db2.gz FKJBZHPIYPISMW-STQMWFEESA-N 1 3 336.307 2.616 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)NC[C@@H](c2ccccc2)N(C)C)CC1 ZINC000058038403 1101240434 /nfs/dbraw/zinc/24/04/34/1101240434.db2.gz UXHFTAXQAUTJAK-IBGZPJMESA-N 1 3 331.504 2.774 10 0 EFAEHO C[C@H](C[NH2+]CC/C=C\c1ccccc1)N(C)C(=O)CN1CCCC1 ZINC001271207569 1101286701 /nfs/dbraw/zinc/28/67/01/1101286701.db2.gz NWGTXHZYPNOILH-QPLYDRNXSA-N 1 3 329.488 2.622 10 0 EFAEHO CC/C=C/CC[NH2+][C@H]1C[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001266620473 1101540114 /nfs/dbraw/zinc/54/01/14/1101540114.db2.gz YHSZUYOFFQQRCS-KUGNCMFCSA-N 1 3 339.499 2.792 10 0 EFAEHO CC/C=C\CC[NH2+][C@H]1C[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001266620474 1101540705 /nfs/dbraw/zinc/54/07/05/1101540705.db2.gz YHSZUYOFFQQRCS-LFPJLLAVSA-N 1 3 339.499 2.792 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]CCCC(C)(C)C)C1 ZINC001672339439 1101623286 /nfs/dbraw/zinc/62/32/86/1101623286.db2.gz WTKBTUUFVMWFOU-IRXDYDNUSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@H](C)[C@H]([NH2+]CCCN1CCC(Cc2ccccc2)CC1)C(N)=O ZINC001654772083 1101754874 /nfs/dbraw/zinc/75/48/74/1101754874.db2.gz LKDIOKJFGUINCM-PXNSSMCTSA-N 1 3 345.531 2.821 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@@H]([NH2+]CCCCC(F)(F)F)C1 ZINC001266733204 1102046759 /nfs/dbraw/zinc/04/67/59/1102046759.db2.gz PERZBXHRYJCETK-NMWPEEMBSA-N 1 3 349.441 2.829 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2C[C@@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001266735963 1102057952 /nfs/dbraw/zinc/05/79/52/1102057952.db2.gz ZMNOHLQUJUXRGA-KDURUIRLSA-N 1 3 331.504 2.505 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)cc1F ZINC001266741171 1102074945 /nfs/dbraw/zinc/07/49/45/1102074945.db2.gz LYZRUOZVEHYGEI-IEBWSBKVSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)cc1F ZINC001266741171 1102074957 /nfs/dbraw/zinc/07/49/57/1102074957.db2.gz LYZRUOZVEHYGEI-IEBWSBKVSA-N 1 3 347.478 2.699 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCCC[C@H]2CC[NH2+]CCC(F)(F)F)C1 ZINC001271578029 1102130841 /nfs/dbraw/zinc/13/08/41/1102130841.db2.gz ZREZHTCYXSHVPP-GJZGRUSLSA-N 1 3 349.441 2.641 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@@H]1CC[NH2+]Cc1ccc(F)cc1 ZINC001271584915 1102145787 /nfs/dbraw/zinc/14/57/87/1102145787.db2.gz CJRDHOINZYDCBV-GOSISDBHSA-N 1 3 344.434 2.652 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@@H]1CC[NH2+]CCC(F)(F)F)N(C)C ZINC001271598666 1102149452 /nfs/dbraw/zinc/14/94/52/1102149452.db2.gz BTUXRXUWOIECLM-KGLIPLIRSA-N 1 3 337.430 2.640 10 0 EFAEHO CCCCC[N@H+](C)C[C@@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001266466342 1102185232 /nfs/dbraw/zinc/18/52/32/1102185232.db2.gz MRZWCRJIOGAMLC-ZWKOTPCHSA-N 1 3 325.541 2.933 10 0 EFAEHO CCCCC[N@@H+](C)C[C@@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001266466342 1102185240 /nfs/dbraw/zinc/18/52/40/1102185240.db2.gz MRZWCRJIOGAMLC-ZWKOTPCHSA-N 1 3 325.541 2.933 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1C[C@H]2CCN(Cc3ccsc3)C[C@H]2C1 ZINC001656843173 1102219296 /nfs/dbraw/zinc/21/92/96/1102219296.db2.gz NYYJMEMHBAGVAQ-MSOLQXFVSA-N 1 3 349.544 2.760 10 0 EFAEHO CN(CC(=O)N1CCC[C@H](C[NH2+]CCCC2CCC2)C1)C1CCC1 ZINC001266790728 1102242072 /nfs/dbraw/zinc/24/20/72/1102242072.db2.gz MNFABPYZGJSEDJ-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001266793155 1102246739 /nfs/dbraw/zinc/24/67/39/1102246739.db2.gz IICUETTWHQDUGO-MYPZJPOHSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001266793151 1102247108 /nfs/dbraw/zinc/24/71/08/1102247108.db2.gz IICUETTWHQDUGO-AJAZOWGGSA-N 1 3 343.515 2.868 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H]1CC[N@H+](CCCCCF)[C@@H]1C ZINC001656957474 1102271237 /nfs/dbraw/zinc/27/12/37/1102271237.db2.gz RDAJHHFCQMVTBL-IXDOHACOSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H]1CC[N@@H+](CCCCCF)[C@@H]1C ZINC001656957474 1102271246 /nfs/dbraw/zinc/27/12/46/1102271246.db2.gz RDAJHHFCQMVTBL-IXDOHACOSA-N 1 3 327.488 2.580 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@@H](C[NH2+]CCC2CCCCC2)C1 ZINC001266811920 1102309057 /nfs/dbraw/zinc/30/90/57/1102309057.db2.gz WOMWAXGNFAIYEQ-KRWDZBQOSA-N 1 3 332.492 2.751 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCNCc1cc2ccccc2o1)[NH+](C)C ZINC001266828433 1102375394 /nfs/dbraw/zinc/37/53/94/1102375394.db2.gz ZAQUYIIODQIKOV-GOSISDBHSA-N 1 3 331.460 2.567 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[NH2+]Cc1ccc(C2CC2)cc1)N(C)C ZINC001266828207 1102376145 /nfs/dbraw/zinc/37/61/45/1102376145.db2.gz QSOWUFAZQAZEPO-LJQANCHMSA-N 1 3 331.504 2.698 10 0 EFAEHO c1ncn(-c2ccc(CNCCC[N@@H+]3CCc4ccccc4C3)cc2)n1 ZINC000075734735 1102565626 /nfs/dbraw/zinc/56/56/26/1102565626.db2.gz WZUCXMSPJNWVHS-UHFFFAOYSA-N 1 3 347.466 2.805 10 0 EFAEHO c1ncn(-c2ccc(CNCCC[N@H+]3CCc4ccccc4C3)cc2)n1 ZINC000075734735 1102565640 /nfs/dbraw/zinc/56/56/40/1102565640.db2.gz WZUCXMSPJNWVHS-UHFFFAOYSA-N 1 3 347.466 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1C[NH2+]CCc1cccs1 ZINC001266885667 1102592884 /nfs/dbraw/zinc/59/28/84/1102592884.db2.gz 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CC/C=C\CC[N@@H+](C)C[C@@H]1CCCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001661226699 1103189187 /nfs/dbraw/zinc/18/91/87/1103189187.db2.gz JBHZSQBBXXFJGV-WYNBNGFRSA-N 1 3 335.536 2.855 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]([NH2+]CCCCc3ccccc3)C2)CCC1 ZINC001661435144 1103264362 /nfs/dbraw/zinc/26/43/62/1103264362.db2.gz IDZWFGLMCJKODP-WGSAOQKQSA-N 1 3 343.515 2.730 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001661614231 1103339336 /nfs/dbraw/zinc/33/93/36/1103339336.db2.gz FYSRSRZSTYWUHD-ZCNNSNEGSA-N 1 3 345.531 2.751 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H](C[NH2+]CCc2ccccc2)C1)C1CCC1 ZINC001661789038 1103426579 /nfs/dbraw/zinc/42/65/79/1103426579.db2.gz VSKJDXWBZLAHAX-IBGZPJMESA-N 1 3 343.515 2.542 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@@H](C)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001483352078 1103460720 /nfs/dbraw/zinc/46/07/20/1103460720.db2.gz VTNRKQLLXGHIEP-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@@H](C)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001483352078 1103460723 /nfs/dbraw/zinc/46/07/23/1103460723.db2.gz VTNRKQLLXGHIEP-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO COc1cccc(CN(C)C[C@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001483371412 1103522225 /nfs/dbraw/zinc/52/22/25/1103522225.db2.gz XAWZGPUDYJMJJS-INIZCTEOSA-N 1 3 347.503 2.506 10 0 EFAEHO CCc1cccc(CN(C)C[C@H](C)NC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001483379615 1103545411 /nfs/dbraw/zinc/54/54/11/1103545411.db2.gz VMDFQJKXUYUPCZ-ZWOKBUDYSA-N 1 3 345.531 2.916 10 0 EFAEHO CCc1cccc(CN(C)C[C@H](C)NC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001483379615 1103545420 /nfs/dbraw/zinc/54/54/20/1103545420.db2.gz VMDFQJKXUYUPCZ-ZWOKBUDYSA-N 1 3 345.531 2.916 10 0 EFAEHO C[C@H](C[N@H+](C)CC1CCC(C)(C)CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001483383907 1103551654 /nfs/dbraw/zinc/55/16/54/1103551654.db2.gz LUXCIOARKWTXRR-DLBZAZTESA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H](C[N@@H+](C)CC1CCC(C)(C)CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001483383907 1103551665 /nfs/dbraw/zinc/55/16/65/1103551665.db2.gz LUXCIOARKWTXRR-DLBZAZTESA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C2CCC2)cc1)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001483418322 1103663445 /nfs/dbraw/zinc/66/34/45/1103663445.db2.gz XARWHYNYHLIQNQ-OXQOHEQNSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C2CCC2)cc1)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001483418322 1103663451 /nfs/dbraw/zinc/66/34/51/1103663451.db2.gz XARWHYNYHLIQNQ-OXQOHEQNSA-N 1 3 343.515 2.842 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)CCc1ccccc1 ZINC001483422807 1103678433 /nfs/dbraw/zinc/67/84/33/1103678433.db2.gz ZGCYDUCGHQGXGK-IEBWSBKVSA-N 1 3 331.504 2.540 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)CCc1ccccc1 ZINC001483422807 1103678435 /nfs/dbraw/zinc/67/84/35/1103678435.db2.gz ZGCYDUCGHQGXGK-IEBWSBKVSA-N 1 3 331.504 2.540 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCCC[C@H]1C[NH2+]Cc1ccccc1F ZINC001483446932 1103733902 /nfs/dbraw/zinc/73/39/02/1103733902.db2.gz DZAYEZCORYULCP-PKOBYXMFSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCCC[C@H]1C[NH2+]Cc1ccccc1F ZINC001483446929 1103734039 /nfs/dbraw/zinc/73/40/39/1103734039.db2.gz DZAYEZCORYULCP-HKUYNNGSSA-N 1 3 349.494 2.931 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)[C@@H]1CCCN1C)c1cccc(Cl)c1 ZINC001483456212 1103749660 /nfs/dbraw/zinc/74/96/60/1103749660.db2.gz PZESSXNPVIATTL-PBHICJAKSA-N 1 3 337.895 2.933 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]Cc1cccc(Cl)c1F)N(C)C ZINC001483474953 1103782045 /nfs/dbraw/zinc/78/20/45/1103782045.db2.gz WVFKUVNKACVENI-OAHLLOKOSA-N 1 3 343.874 2.757 10 0 EFAEHO Cc1ccc(C[NH2+]CCCN(C)C(=O)[C@H]2CCCCN2C)cc1F ZINC001483475495 1103784235 /nfs/dbraw/zinc/78/42/35/1103784235.db2.gz UUPVKYKKCYIWFY-GOSISDBHSA-N 1 3 335.467 2.557 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+][C@@H](C)c1cc(F)ccc1F)N(C)C ZINC001483492429 1103824642 /nfs/dbraw/zinc/82/46/42/1103824642.db2.gz PRJHUGDBMDAUBQ-GUYCJALGSA-N 1 3 341.446 2.804 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)CN1CC[C@H](C)C1)c1ccc(F)cc1 ZINC001483492788 1103826724 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10 0 EFAEHO C[C@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)N(C)Cc1ccc(CF)cc1 ZINC001409567726 1104284037 /nfs/dbraw/zinc/28/40/37/1104284037.db2.gz PLGYVYXREWZKQE-APWZRJJASA-N 1 3 349.494 2.967 10 0 EFAEHO CN(CCNCc1ccccc1F)C(=O)c1ccc(C[NH+](C)C)cc1 ZINC001664252612 1104328018 /nfs/dbraw/zinc/32/80/18/1104328018.db2.gz GNKCAAATPZHFPE-UHFFFAOYSA-N 1 3 343.446 2.749 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[NH2+]Cc2ccc(C3CC3)cc2)CC1 ZINC001664267886 1104334772 /nfs/dbraw/zinc/33/47/72/1104334772.db2.gz CYLQJXHUYLYCFW-UHFFFAOYSA-N 1 3 343.515 2.844 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]CCCc1cccc(F)c1 ZINC001664395064 1104377618 /nfs/dbraw/zinc/37/76/18/1104377618.db2.gz KLDSNPOSPRAOIU-IBGZPJMESA-N 1 3 349.494 2.681 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@H]2CC[N@H+](CC3=CCCCC3)C2)C1 ZINC001664740030 1104531272 /nfs/dbraw/zinc/53/12/72/1104531272.db2.gz DQVQEIADWDDOAU-HKUYNNGSSA-N 1 3 333.520 2.657 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@H]2CC[N@@H+](CC3=CCCCC3)C2)C1 ZINC001664740030 1104531277 /nfs/dbraw/zinc/53/12/77/1104531277.db2.gz DQVQEIADWDDOAU-HKUYNNGSSA-N 1 3 333.520 2.657 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)CC1CCC(C)(C)CC1 ZINC001409695614 1104673893 /nfs/dbraw/zinc/67/38/93/1104673893.db2.gz UMBHOTXDCKBTSB-INIZCTEOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)CC1CCC(C)(C)CC1 ZINC001409695614 1104673895 /nfs/dbraw/zinc/67/38/95/1104673895.db2.gz UMBHOTXDCKBTSB-INIZCTEOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@](F)(C(=O)N[C@@H]2CCN(CCCCCF)C2)C1 ZINC001665574281 1104716946 /nfs/dbraw/zinc/71/69/46/1104716946.db2.gz WNSHFBVXXSMRMD-CRAIPNDOSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)N[C@@H]2CCN(CCCCCF)C2)C1 ZINC001665574281 1104716951 /nfs/dbraw/zinc/71/69/51/1104716951.db2.gz WNSHFBVXXSMRMD-CRAIPNDOSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N[C@@H]2CC[N@H+](CCCCCF)C2)C1 ZINC001665574281 1104716955 /nfs/dbraw/zinc/71/69/55/1104716955.db2.gz WNSHFBVXXSMRMD-CRAIPNDOSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N[C@@H]2CC[N@@H+](CCCCCF)C2)C1 ZINC001665574281 1104716962 /nfs/dbraw/zinc/71/69/62/1104716962.db2.gz WNSHFBVXXSMRMD-CRAIPNDOSA-N 1 3 345.478 2.529 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[N@H+](C)[C@H]1CCc2ccccc21 ZINC001482652467 1104744407 /nfs/dbraw/zinc/74/44/07/1104744407.db2.gz XYELRLBBIATINB-VQTJNVASSA-N 1 3 343.515 2.939 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001482652467 1104744413 /nfs/dbraw/zinc/74/44/13/1104744413.db2.gz XYELRLBBIATINB-VQTJNVASSA-N 1 3 343.515 2.939 10 0 EFAEHO C[C@H](F)CC[NH2+]CC[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001666157068 1104886667 /nfs/dbraw/zinc/88/66/67/1104886667.db2.gz JKZCAAIANYKMTK-ZWKOTPCHSA-N 1 3 341.515 2.685 10 0 EFAEHO C[C@H](C(=O)NCC1([NH2+]CCCF)CCCC1)N1CCCCCC1 ZINC001666791308 1104998413 /nfs/dbraw/zinc/99/84/13/1104998413.db2.gz FVFNFUFGAQXFBJ-MRXNPFEDSA-N 1 3 327.488 2.629 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC2(C[NH+](CC=C(C)C)C2)CC1 ZINC001666825675 1105003537 /nfs/dbraw/zinc/00/35/37/1105003537.db2.gz OQFQCGHWTVSASA-KRWDZBQOSA-N 1 3 339.499 2.557 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1cc2ccccc2o1)NC(=O)C1(N(C)C)CCC1 ZINC001482840136 1105079435 /nfs/dbraw/zinc/07/94/35/1105079435.db2.gz RKXMRNODLKFGFJ-HNNXBMFYSA-N 1 3 343.471 2.902 10 0 EFAEHO CC(C)c1cccc(C[NH2+]CC[C@@H](C)NC(=O)C2(N(C)C)CCC2)n1 ZINC001482840703 1105081005 /nfs/dbraw/zinc/08/10/05/1105081005.db2.gz ZFRKBSCKZCNCGS-MRXNPFEDSA-N 1 3 346.519 2.674 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001482846547 1105087938 /nfs/dbraw/zinc/08/79/38/1105087938.db2.gz KXNQPUVHLACRKZ-DGCLKSJQSA-N 1 3 331.913 2.726 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001482870821 1105121264 /nfs/dbraw/zinc/12/12/64/1105121264.db2.gz HFNXEWBVLVECFL-SJORKVTESA-N 1 3 331.504 2.575 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C)[C@H]1C[NH2+]CCC(C)(C)C ZINC001667400682 1105140915 /nfs/dbraw/zinc/14/09/15/1105140915.db2.gz MLGSXZIYVATACC-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001482888913 1105147477 /nfs/dbraw/zinc/14/74/77/1105147477.db2.gz NJNPALDOACURGE-RHSMWYFYSA-N 1 3 339.911 2.911 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001482891378 1105150025 /nfs/dbraw/zinc/15/00/25/1105150025.db2.gz NFDPBIPCFRPGFY-BBRMVZONSA-N 1 3 325.884 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+]Cc1ccccc1Cl ZINC001482902512 1105160014 /nfs/dbraw/zinc/16/00/14/1105160014.db2.gz RJAMUFLVOPPLSC-CQSZACIVSA-N 1 3 325.884 2.665 10 0 EFAEHO CCN(CCNC/C=C/Cl)C(=O)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001482930131 1105188633 /nfs/dbraw/zinc/18/86/33/1105188633.db2.gz DISYFNHDNJDSOY-VGZDNEPHSA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(CCNC/C=C/Cl)C(=O)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001482930131 1105188636 /nfs/dbraw/zinc/18/86/36/1105188636.db2.gz DISYFNHDNJDSOY-VGZDNEPHSA-N 1 3 327.900 2.584 10 0 EFAEHO Cc1ccc(CC[NH2+]CC[C@H](C)NC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001668062081 1105228432 /nfs/dbraw/zinc/22/84/32/1105228432.db2.gz ZIVDUSQGFGNOPN-ICSRJNTNSA-N 1 3 345.531 2.895 10 0 EFAEHO CCN(CC[NH2+]Cc1ccccc1C(C)C)C(=O)CN1CCCC1 ZINC001482967643 1105265129 /nfs/dbraw/zinc/26/51/29/1105265129.db2.gz VKNFVNOKRKPJPN-UHFFFAOYSA-N 1 3 331.504 2.844 10 0 EFAEHO CCN(CC[NH2+]CCc1cccs1)C(=O)[C@@H]1CCCCN1CC ZINC001482969369 1105265533 /nfs/dbraw/zinc/26/55/33/1105265533.db2.gz FARSXVGSTWZZRY-KRWDZBQOSA-N 1 3 337.533 2.603 10 0 EFAEHO CCc1ccc(C[NH2+]CC[C@H](C)NC(=O)Cc2nc[nH]c2C)cc1 ZINC001668287722 1105274085 /nfs/dbraw/zinc/27/40/85/1105274085.db2.gz BIJNLPUOGZBXTG-AWEZNQCLSA-N 1 3 328.460 2.508 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CC[NH2+]CC1CCC2(CC2)CC1 ZINC001668288819 1105274691 /nfs/dbraw/zinc/27/46/91/1105274691.db2.gz OAVSDMIADQMPOF-CQSZACIVSA-N 1 3 332.492 2.715 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CC[NH2+]Cc1ccccc1F ZINC001668319552 1105280957 /nfs/dbraw/zinc/28/09/57/1105280957.db2.gz IHYKAAHDXQCCGU-QAPCUYQASA-N 1 3 335.467 2.685 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CC[NH2+]Cc1ccc(C)c(F)c1 ZINC001668325678 1105281914 /nfs/dbraw/zinc/28/19/14/1105281914.db2.gz KPFYPFHIOHNXTC-APWZRJJASA-N 1 3 349.494 2.993 10 0 EFAEHO C[C@H](CCNCc1nccs1)NC(=O)c1cccc(C[NH+](C)C)c1 ZINC001668321125 1105282263 /nfs/dbraw/zinc/28/22/63/1105282263.db2.gz WWPBXTATNFHKNT-CQSZACIVSA-N 1 3 346.500 2.503 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]Cc1ccc(C)c(F)c1 ZINC001668325681 1105282704 /nfs/dbraw/zinc/28/27/04/1105282704.db2.gz KPFYPFHIOHNXTC-VQIMIIECSA-N 1 3 349.494 2.993 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001668464047 1105301739 /nfs/dbraw/zinc/30/17/39/1105301739.db2.gz BWXTZRJVTPUOGL-RBUKOAKNSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001668464047 1105301745 /nfs/dbraw/zinc/30/17/45/1105301745.db2.gz BWXTZRJVTPUOGL-RBUKOAKNSA-N 1 3 347.478 2.781 10 0 EFAEHO CC[C@H](C(=O)N(CC)CC[NH2+]Cc1cccc2cccnc21)N(C)C ZINC001668619737 1105333799 /nfs/dbraw/zinc/33/37/99/1105333799.db2.gz SQKSJIQYTOPMGE-GOSISDBHSA-N 1 3 342.487 2.513 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C/C=C/CNC(=O)[C@@H]2CCCN2C)c1 ZINC001668746442 1105360328 /nfs/dbraw/zinc/36/03/28/1105360328.db2.gz YIACXAUWQQMJQE-DDUKWOAZSA-N 1 3 329.488 2.721 10 0 EFAEHO CC[C@H](F)CNC/C=C\CNC(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001668828935 1105380489 /nfs/dbraw/zinc/38/04/89/1105380489.db2.gz UKSCPOKONSRBAB-YHLLGKTKSA-N 1 3 339.499 2.651 10 0 EFAEHO CC[C@H](F)CNC/C=C\CNC(=O)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001668828935 1105380495 /nfs/dbraw/zinc/38/04/95/1105380495.db2.gz UKSCPOKONSRBAB-YHLLGKTKSA-N 1 3 339.499 2.651 10 0 EFAEHO CN(C)C1(C(=O)NC/C=C\C[NH2+]C[C@@H]2CCCC(F)(F)C2)CCC1 ZINC001668864182 1105388427 /nfs/dbraw/zinc/38/84/27/1105388427.db2.gz DFKFEMRJNQKPON-ABCZVMIZSA-N 1 3 343.462 2.558 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)NC/C=C/CNCc1ccc(F)cc1 ZINC001668906517 1105397575 /nfs/dbraw/zinc/39/75/75/1105397575.db2.gz ZFPJHASUJSFRNV-RTLBZRNLSA-N 1 3 347.478 2.708 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)NC/C=C/CNCc1ccc(F)cc1 ZINC001668906517 1105397583 /nfs/dbraw/zinc/39/75/83/1105397583.db2.gz ZFPJHASUJSFRNV-RTLBZRNLSA-N 1 3 347.478 2.708 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C/CNC(=O)C12CCC[NH+]1CCC2 ZINC001668912940 1105398167 /nfs/dbraw/zinc/39/81/67/1105398167.db2.gz WULRFIBNGJFQRW-NSCUHMNNSA-N 1 3 345.462 2.525 10 0 EFAEHO C[NH+](C)CCC(=O)NC/C=C/CN[C@@H]1CCc2ccc(Cl)cc21 ZINC001669020807 1105418756 /nfs/dbraw/zinc/41/87/56/1105418756.db2.gz JVVWZBPDSAHABD-REMYHPOOSA-N 1 3 335.879 2.541 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C/C=C/CNC(=O)CN1CC[C@H](C)C1 ZINC001669040509 1105423138 /nfs/dbraw/zinc/42/31/38/1105423138.db2.gz XBAWHTIOODVNMB-RTQGNFRKSA-N 1 3 329.488 2.660 10 0 EFAEHO CC[C@H](C)C[NH2+]C/C=C/CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001669040540 1105423147 /nfs/dbraw/zinc/42/31/47/1105423147.db2.gz XLMNGOSXYZESPP-BUSQMGNYSA-N 1 3 327.488 2.507 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NC/C=C/CNCc1cccc(Cl)c1 ZINC001669201195 1105456377 /nfs/dbraw/zinc/45/63/77/1105456377.db2.gz NNMFXCGAPMOSLT-ZOSBBBERSA-N 1 3 349.906 2.975 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NC/C=C/CNCc1cccc(Cl)c1 ZINC001669201195 1105456379 /nfs/dbraw/zinc/45/63/79/1105456379.db2.gz NNMFXCGAPMOSLT-ZOSBBBERSA-N 1 3 349.906 2.975 10 0 EFAEHO C[C@@H](C[NH2+]C/C=C/c1ccccc1)NC(=O)CN(C)CC(C)(C)C ZINC001669664266 1105506367 /nfs/dbraw/zinc/50/63/67/1105506367.db2.gz HBWPRTBNUIGHRF-KQPPXVQYSA-N 1 3 331.504 2.772 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC/C=C/CNCc1cccc(Cl)c1 ZINC001483016730 1105555250 /nfs/dbraw/zinc/55/52/50/1105555250.db2.gz RTTWOOQNQSFFNM-OAJJDEHYSA-N 1 3 349.906 2.976 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC/C=C/CNCc1cccc(Cl)c1 ZINC001483016730 1105555255 /nfs/dbraw/zinc/55/52/55/1105555255.db2.gz RTTWOOQNQSFFNM-OAJJDEHYSA-N 1 3 349.906 2.976 10 0 EFAEHO Cc1cc(C[NH2+]C/C=C/CNC(=O)CN(C)C2CCC2)c(C)s1 ZINC001483016696 1105555520 /nfs/dbraw/zinc/55/55/20/1105555520.db2.gz FYXYYWOIFZPFTH-SNAWJCMRSA-N 1 3 335.517 2.611 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C/C=C/CNC(=O)C1(N(C)C)CCC1 ZINC001483019525 1105563534 /nfs/dbraw/zinc/56/35/34/1105563534.db2.gz YVLATYXVCDWAJF-AATRIKPKSA-N 1 3 329.488 2.550 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2CCCC[C@H]2C[NH2+]CCCF)c1 ZINC001669985831 1105564896 /nfs/dbraw/zinc/56/48/96/1105564896.db2.gz NDMFXKGFQAJKOC-OALUTQOASA-N 1 3 349.494 2.986 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001670248357 1105604157 /nfs/dbraw/zinc/60/41/57/1105604157.db2.gz BNCVOKCATXBVET-KRWDZBQOSA-N 1 3 339.911 2.927 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)CN1CCCC1)c1cc(F)ccc1F ZINC001670344607 1105622604 /nfs/dbraw/zinc/62/26/04/1105622604.db2.gz HPMVKNDRHBKQFQ-CQSZACIVSA-N 1 3 339.430 2.560 10 0 EFAEHO O=C(CN1CCCC1)N1CCC[C@H]1C[NH2+]CC/C=C/c1ccccc1 ZINC001671384364 1105632501 /nfs/dbraw/zinc/63/25/01/1105632501.db2.gz MAJPBXWLMBSRKR-FZBXERKRSA-N 1 3 341.499 2.766 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)NC/C=C\CNCc1cccc(F)c1 ZINC001483028858 1105662118 /nfs/dbraw/zinc/66/21/18/1105662118.db2.gz RUXFTPYICFTIIW-ZRHASKPBSA-N 1 3 347.478 2.708 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NC/C=C\CNCc1cccc(F)c1 ZINC001483028858 1105662123 /nfs/dbraw/zinc/66/21/23/1105662123.db2.gz RUXFTPYICFTIIW-ZRHASKPBSA-N 1 3 347.478 2.708 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@](C)(C[NH2+]CCc3cccs3)C2)CCC1 ZINC001671748203 1105695443 /nfs/dbraw/zinc/69/54/43/1105695443.db2.gz QGXHYUBOYWQBNI-SFHVURJKSA-N 1 3 349.544 2.603 10 0 EFAEHO C[NH+](C)CC1(C(=O)NC/C=C\CNC/C=C/Cl)CCCCC1 ZINC001483037661 1105737631 /nfs/dbraw/zinc/73/76/31/1105737631.db2.gz PXSPKVTWTSOGDQ-BQGCWICQSA-N 1 3 327.900 2.513 10 0 EFAEHO C[C@H]([NH2+]CCCc1ccsc1)[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001672247473 1105786031 /nfs/dbraw/zinc/78/60/31/1105786031.db2.gz WLNQXJXIHBOFMY-FUHWJXTLSA-N 1 3 349.544 2.603 10 0 EFAEHO CC[C@H](F)CN1CC[C@]2(C1)CCCN(C(=O)CCCC[NH+](C)C)C2 ZINC001673651757 1106068347 /nfs/dbraw/zinc/06/83/47/1106068347.db2.gz ZUTVJRTUOVHPMU-HKUYNNGSSA-N 1 3 341.515 2.781 10 0 EFAEHO Cc1ncccc1CN1CC[C@@H](NC(=O)CCCC[NH+](C)C)C[C@H]1C ZINC001674153499 1106151888 /nfs/dbraw/zinc/15/18/88/1106151888.db2.gz HBQTVYINBWAEKZ-VQIMIIECSA-N 1 3 346.519 2.591 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCCC[C@H]1CNCC=C(Cl)Cl ZINC001674393036 1106180638 /nfs/dbraw/zinc/18/06/38/1106180638.db2.gz KJEACPBBLIXTAM-ZDUSSCGKSA-N 1 3 336.307 2.618 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)CCC[NH2+]C/C=C\Cl ZINC001675985492 1106460674 /nfs/dbraw/zinc/46/06/74/1106460674.db2.gz CNRMWNBRSHRMOJ-LWALAHDXSA-N 1 3 329.916 2.876 10 0 EFAEHO CN(C)C1(C(=O)N(C)[C@H](C[NH2+]CC2=CCCCC2)C2CC2)CCC1 ZINC001676221205 1106501602 /nfs/dbraw/zinc/50/16/02/1106501602.db2.gz BICYKVJNYWOGMF-GOSISDBHSA-N 1 3 333.520 2.798 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccsc2)C[C@@H]1C ZINC001676782586 1106579296 /nfs/dbraw/zinc/57/92/96/1106579296.db2.gz HPFRBQQDLIKHTN-DOTOQJQBSA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]CCCc2ccsc2)C[C@H]1C ZINC001676782589 1106579313 /nfs/dbraw/zinc/57/93/13/1106579313.db2.gz HPFRBQQDLIKHTN-WBVHZDCISA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccsc2)C[C@H]1C ZINC001676782587 1106579373 /nfs/dbraw/zinc/57/93/73/1106579373.db2.gz HPFRBQQDLIKHTN-NVXWUHKLSA-N 1 3 337.533 2.600 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC/C=C\CNCc2cccc(F)c2)C1 ZINC001483049645 1106602408 /nfs/dbraw/zinc/60/24/08/1106602408.db2.gz OSKPSMSNIFPSDU-DDKKJVIOSA-N 1 3 347.478 2.710 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC/C=C\CNCc2cccc(F)c2)C1 ZINC001483049645 1106602411 /nfs/dbraw/zinc/60/24/11/1106602411.db2.gz OSKPSMSNIFPSDU-DDKKJVIOSA-N 1 3 347.478 2.710 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC/C=C/CNCc2cccc(F)c2)C1 ZINC001483049647 1106603305 /nfs/dbraw/zinc/60/33/05/1106603305.db2.gz OSKPSMSNIFPSDU-OAJJDEHYSA-N 1 3 347.478 2.710 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC/C=C/CNCc2cccc(F)c2)C1 ZINC001483049647 1106603306 /nfs/dbraw/zinc/60/33/06/1106603306.db2.gz OSKPSMSNIFPSDU-OAJJDEHYSA-N 1 3 347.478 2.710 10 0 EFAEHO CCc1cccc(C[N@H+]2CC=C(CNC(=O)CN(C)C(C)C)CC2)c1 ZINC001677636705 1106797708 /nfs/dbraw/zinc/79/77/08/1106797708.db2.gz TUNBTJGRIIXWTR-UHFFFAOYSA-N 1 3 343.515 2.838 10 0 EFAEHO CCc1cccc(C[N@@H+]2CC=C(CNC(=O)CN(C)C(C)C)CC2)c1 ZINC001677636705 1106797725 /nfs/dbraw/zinc/79/77/25/1106797725.db2.gz TUNBTJGRIIXWTR-UHFFFAOYSA-N 1 3 343.515 2.838 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)NCC1=CCN(Cc2ccccc2)CC1 ZINC001677636571 1106799364 /nfs/dbraw/zinc/79/93/64/1106799364.db2.gz OYPWOFSHLBFKAI-UHFFFAOYSA-N 1 3 341.499 2.811 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)cc1F ZINC001409344098 1107562501 /nfs/dbraw/zinc/56/25/01/1107562501.db2.gz CJQHYRGTFVGILN-LSDHHAIUSA-N 1 3 335.467 2.601 10 0 EFAEHO CC(C)CCC[NH2+]C/C=C\CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001483060242 1107847564 /nfs/dbraw/zinc/84/75/64/1107847564.db2.gz GMAKLKUBHULSKU-RURPWVQCSA-N 1 3 341.515 2.897 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCN1CC1CC(C)(C)C1)[NH+]1CCCC1 ZINC001483704934 1108052147 /nfs/dbraw/zinc/05/21/47/1108052147.db2.gz FGEIIBNNFINGQF-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@@H](NC(=O)CN(C)CC(C)(C)C)[C@H](C)[NH2+]CCc1cccs1 ZINC001409406984 1108201140 /nfs/dbraw/zinc/20/11/40/1108201140.db2.gz XOGVQRHXODTLSE-LSDHHAIUSA-N 1 3 339.549 2.751 10 0 EFAEHO Cc1ccc(CN[C@@H](C)[C@H](C)NC(=O)C23CC[NH+](CC2)C3)c(Cl)c1 ZINC001409419984 1108254048 /nfs/dbraw/zinc/25/40/48/1108254048.db2.gz LFRJJTIENBKXMU-GJZGRUSLSA-N 1 3 349.906 2.727 10 0 EFAEHO C[C@H](C(=O)NC/C=C\CNCc1ccsc1)[NH+]1CCCCCC1 ZINC001483071303 1108333954 /nfs/dbraw/zinc/33/39/54/1108333954.db2.gz VDMHQZWJGVSCCE-YIEVGGLXSA-N 1 3 335.517 2.775 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1c(C)cc(C)cc1C ZINC001409434046 1108354484 /nfs/dbraw/zinc/35/44/84/1108354484.db2.gz NVSPTMNVIJYGIB-ZWKOTPCHSA-N 1 3 333.520 2.936 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](CC[NH2+]Cc2ccsc2)C1)N(C)C ZINC001272465357 1108413692 /nfs/dbraw/zinc/41/36/92/1108413692.db2.gz DYDLUWGPTGDODU-RDJZCZTQSA-N 1 3 337.533 2.663 10 0 EFAEHO C[C@@H]([NH2+]C/C=C\CNC(=O)CN1CCC(C)CC1)c1ccccc1 ZINC001483078553 1108419700 /nfs/dbraw/zinc/41/97/00/1108419700.db2.gz RBQNUKLIULWYDM-HPFMTEOYSA-N 1 3 329.488 2.742 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](CC[NH2+]CCc2ccc(C)cc2)C1)N(C)C ZINC001272474900 1108433497 /nfs/dbraw/zinc/43/34/97/1108433497.db2.gz KKZWMGDAZZWVJR-WOJBJXKFSA-N 1 3 345.531 2.706 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C/C[NH2+][C@@H](C)c1ccccc1 ZINC001483098532 1108649484 /nfs/dbraw/zinc/64/94/84/1108649484.db2.gz RMQVAZACPNGSMY-RNBODJDXSA-N 1 3 329.488 2.884 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2cccc(C)c2)C1)N(C)C ZINC001272566295 1108675458 /nfs/dbraw/zinc/67/54/58/1108675458.db2.gz UGCMPDWEYLWQTJ-MJGOQNOKSA-N 1 3 331.504 2.663 10 0 EFAEHO C[C@H](C[NH2+]C[C@@H]1CCC(F)(F)C1)NC(=O)C(C)(C)N1CCCCC1 ZINC001483129560 1109438097 /nfs/dbraw/zinc/43/80/97/1109438097.db2.gz XLNBLYVADJYJRK-HUUCEWRRSA-N 1 3 345.478 2.781 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1cc2ccccc2o1 ZINC001483133166 1109549522 /nfs/dbraw/zinc/54/95/22/1109549522.db2.gz RWQLDPBGLMWRGH-CRAIPNDOSA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1cc2ccccc2o1 ZINC001483133166 1109549525 /nfs/dbraw/zinc/54/95/25/1109549525.db2.gz RWQLDPBGLMWRGH-CRAIPNDOSA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1cc2ccccc2o1 ZINC001483133167 1109549573 /nfs/dbraw/zinc/54/95/73/1109549573.db2.gz RWQLDPBGLMWRGH-QAPCUYQASA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1cc2ccccc2o1 ZINC001483133167 1109549576 /nfs/dbraw/zinc/54/95/76/1109549576.db2.gz RWQLDPBGLMWRGH-QAPCUYQASA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1cccc(C(C)C)n1 ZINC001483133352 1109557775 /nfs/dbraw/zinc/55/77/75/1109557775.db2.gz WQXDQEHFINYMGL-VQIMIIECSA-N 1 3 346.519 2.674 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1cccc(C(C)C)n1 ZINC001483133352 1109557777 /nfs/dbraw/zinc/55/77/77/1109557777.db2.gz WQXDQEHFINYMGL-VQIMIIECSA-N 1 3 346.519 2.674 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccccc1C1CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001483167292 1109924234 /nfs/dbraw/zinc/92/42/34/1109924234.db2.gz YISHIIPYANIXPE-HZPDHXFCSA-N 1 3 329.488 2.500 10 0 EFAEHO C[C@H](CNCc1ccccc1F)NC(=O)[C@H](C)[NH+]1CCCCCC1 ZINC001483172111 1109931295 /nfs/dbraw/zinc/93/12/95/1109931295.db2.gz ISMHFASGKWHYQK-CVEARBPZSA-N 1 3 335.467 2.685 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)CC[NH+]2CCCCC2)c1 ZINC001483197243 1110001985 /nfs/dbraw/zinc/00/19/85/1110001985.db2.gz BPZJIGMAWIJEMZ-MRXNPFEDSA-N 1 3 335.467 2.604 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]CCCc2ccccc2)CC1)N1CCCC1 ZINC001483757173 1111984444 /nfs/dbraw/zinc/98/44/44/1111984444.db2.gz SSDRVHDPGXJMHD-UHFFFAOYSA-N 1 3 343.515 2.732 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NCC2(NCc3ccsc3)CC2)C1 ZINC001483760864 1112046011 /nfs/dbraw/zinc/04/60/11/1112046011.db2.gz BCHWHEIUXJTCNF-MRXNPFEDSA-N 1 3 335.517 2.609 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NCC2(NCc3ccsc3)CC2)C1 ZINC001483760864 1112046014 /nfs/dbraw/zinc/04/60/14/1112046014.db2.gz BCHWHEIUXJTCNF-MRXNPFEDSA-N 1 3 335.517 2.609 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(NCc3cccc(Cl)c3)CC2)CC[N@@H+]1C ZINC001483762201 1112088735 /nfs/dbraw/zinc/08/87/35/1112088735.db2.gz OHQHSFGYQUWSGV-HOCLYGCPSA-N 1 3 349.906 2.809 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(NCc3cccc(Cl)c3)CC2)CC[N@H+]1C ZINC001483762201 1112088739 /nfs/dbraw/zinc/08/87/39/1112088739.db2.gz OHQHSFGYQUWSGV-HOCLYGCPSA-N 1 3 349.906 2.809 10 0 EFAEHO C[NH+](C)CCCCC(=O)NCC1(N[C@H]2CCc3c2cccc3F)CC1 ZINC001670890282 1112330255 /nfs/dbraw/zinc/33/02/55/1112330255.db2.gz XEUFSDRODJSVDQ-SFHVURJKSA-N 1 3 347.478 2.783 10 0 EFAEHO Cc1ccc(CNC2(CNC(=O)[C@@H]3CCC[C@H]([NH+](C)C)C3)CC2)cc1 ZINC001483783304 1112456835 /nfs/dbraw/zinc/45/68/35/1112456835.db2.gz LFOXCUQZBGQKIQ-MOPGFXCFSA-N 1 3 343.515 2.854 10 0 EFAEHO Cc1ccc(CN2CC[C@]3(CCN(C(=O)CC[NH+](C)C)C3)C2)cc1F ZINC001483849520 1112511168 /nfs/dbraw/zinc/51/11/68/1112511168.db2.gz XEZOYKAMFSFHKY-FQEVSTJZSA-N 1 3 347.478 2.510 10 0 EFAEHO CC[C@@H](C(=O)N1CCC2(C1)CC[NH+](CCCCCF)CC2)N(C)C ZINC001483836485 1112512577 /nfs/dbraw/zinc/51/25/77/1112512577.db2.gz AOMDHQLQINSCRP-KRWDZBQOSA-N 1 3 341.515 2.781 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CCCc2ccsc2)CCN1C(=O)CN1CCCC1 ZINC001483912581 1112554726 /nfs/dbraw/zinc/55/47/26/1112554726.db2.gz AVHWZKVVQGSUQM-FUHWJXTLSA-N 1 3 349.544 2.746 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)c1 ZINC001483913333 1112555250 /nfs/dbraw/zinc/55/52/50/1112555250.db2.gz GZNKIPLNYLEDAS-IEBWSBKVSA-N 1 3 331.504 2.804 10 0 EFAEHO CC[C@@H](C(=O)NC1(C)CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001483971277 1112602804 /nfs/dbraw/zinc/60/28/04/1112602804.db2.gz QTCAVBVMPAZBKW-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)C[C@@H](C)C[NH+]1CCC(C)(NC(=O)CN(C)C(C)C)CC1 ZINC001483976336 1112618271 /nfs/dbraw/zinc/61/82/71/1112618271.db2.gz HURFDWARCVNRRI-QGZVFWFLSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](C(=O)N[C@@H](C[NH2+]CCCF)C1CCCC1)N1CCCCCC1 ZINC001484008613 1112657155 /nfs/dbraw/zinc/65/71/55/1112657155.db2.gz SRRLQYYGHFCAMT-WMZOPIPTSA-N 1 3 341.515 2.875 10 0 EFAEHO CC[C@H](F)C[N@@H+]1CC[C@@]2(C1)CCCCN(C(=O)CN(C)C(C)C)C2 ZINC001484022714 1112675561 /nfs/dbraw/zinc/67/55/61/1112675561.db2.gz NZOGKOLZWDPOIW-PKOBYXMFSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](F)C[N@H+]1CC[C@@]2(C1)CCCCN(C(=O)CN(C)C(C)C)C2 ZINC001484022714 1112675563 /nfs/dbraw/zinc/67/55/63/1112675563.db2.gz NZOGKOLZWDPOIW-PKOBYXMFSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[N@H+](C)[C@H](C(=O)NC[C@@]1(C)CCCN(CCF)C1)c1ccccc1 ZINC001484174105 1112887238 /nfs/dbraw/zinc/88/72/38/1112887238.db2.gz ONFAQZXFSMJLMB-AZUAARDMSA-N 1 3 349.494 2.867 10 0 EFAEHO CC[N@@H+](C)[C@H](C(=O)NC[C@@]1(C)CCCN(CCF)C1)c1ccccc1 ZINC001484174105 1112887244 /nfs/dbraw/zinc/88/72/44/1112887244.db2.gz ONFAQZXFSMJLMB-AZUAARDMSA-N 1 3 349.494 2.867 10 0 EFAEHO CCN(C)[C@H](C(=O)NC[C@@]1(C)CCC[N@H+](CCF)C1)c1ccccc1 ZINC001484174105 1112887250 /nfs/dbraw/zinc/88/72/50/1112887250.db2.gz ONFAQZXFSMJLMB-AZUAARDMSA-N 1 3 349.494 2.867 10 0 EFAEHO CCN(C)[C@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CCF)C1)c1ccccc1 ZINC001484174105 1112887256 /nfs/dbraw/zinc/88/72/56/1112887256.db2.gz ONFAQZXFSMJLMB-AZUAARDMSA-N 1 3 349.494 2.867 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](CC[NH2+]CCc2cccs2)C1)C1CCC1 ZINC001484523496 1112979806 /nfs/dbraw/zinc/97/98/06/1112979806.db2.gz AJNXARBDQMSRKW-MRXNPFEDSA-N 1 3 349.544 2.603 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]Cc2ccccc2Cl)C1 ZINC001484531431 1112985779 /nfs/dbraw/zinc/98/57/79/1112985779.db2.gz GQKFAFTXHLPLRU-CRAIPNDOSA-N 1 3 349.906 2.762 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](CC[NH2+]CCCC(C)(C)C)C2)C1 ZINC001484537926 1112992036 /nfs/dbraw/zinc/99/20/36/1112992036.db2.gz PYEUFWGCTHHHQL-QZTJIDSGSA-N 1 3 337.552 2.983 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H]2CCN(C(=O)CN3CC[C@@H](C)C3)C2)cs1 ZINC001484537290 1112992286 /nfs/dbraw/zinc/99/22/86/1112992286.db2.gz FUQADGVNVVTUSV-NVXWUHKLSA-N 1 3 349.544 2.727 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H]2CCN(C(=O)CN3CC[C@@H](C)C3)C2)cs1 ZINC001484537294 1112992570 /nfs/dbraw/zinc/99/25/70/1112992570.db2.gz FUQADGVNVVTUSV-WBVHZDCISA-N 1 3 349.544 2.727 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](CC[NH2+]CC3CC(C)(C)C3)C2)C1 ZINC001484538215 1112993030 /nfs/dbraw/zinc/99/30/30/1112993030.db2.gz VOQGPCFUXLQMLR-IRXDYDNUSA-N 1 3 335.536 2.593 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](CC[NH2+]CC3CC(C)(C)C3)C2)C1 ZINC001484538214 1112993094 /nfs/dbraw/zinc/99/30/94/1112993094.db2.gz VOQGPCFUXLQMLR-IAGOWNOFSA-N 1 3 335.536 2.593 10 0 EFAEHO C[C@@H]([NH2+]CC[C@H]1CCN(C(=O)CN2CCCC2)C1)c1cccc(F)c1 ZINC001484550044 1113002747 /nfs/dbraw/zinc/00/27/47/1113002747.db2.gz PWALAGAOWUEIOI-SJORKVTESA-N 1 3 347.478 2.811 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]Cc2ccsc2)C1 ZINC001484551236 1113003092 /nfs/dbraw/zinc/00/30/92/1113003092.db2.gz FAHUCLAAJCXUAO-FUHWJXTLSA-N 1 3 349.544 2.951 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(CF)cc2)C1 ZINC001484551132 1113003413 /nfs/dbraw/zinc/00/34/13/1113003413.db2.gz CFUNAZYCUKPKQW-LJQANCHMSA-N 1 3 349.494 2.825 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NCc1ccc([C@H](C)NCCF)cc1 ZINC001484558315 1113012417 /nfs/dbraw/zinc/01/24/17/1113012417.db2.gz DHXXYTYNKGPOHW-YJBOKZPZSA-N 1 3 335.467 2.797 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NCc1ccc([C@H](C)NCCF)cc1 ZINC001484558315 1113012419 /nfs/dbraw/zinc/01/24/19/1113012419.db2.gz DHXXYTYNKGPOHW-YJBOKZPZSA-N 1 3 335.467 2.797 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+]CC2=CCCCC2)CCC1 ZINC001484637084 1113088994 /nfs/dbraw/zinc/08/89/94/1113088994.db2.gz QFFHJDBOKYTYLA-SFHVURJKSA-N 1 3 333.520 2.990 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC)([NH2+]Cc2cccnc2C)CC1)N(C)C ZINC001484819349 1117753410 /nfs/dbraw/zinc/75/34/10/1117753410.db2.gz MMMDXVLZJLNXGX-SFHVURJKSA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1ccc(CN[C@H]2CN(C(=O)CC[NH+](C)C)C[C@@H]2C)c(Cl)c1 ZINC001484900995 1117805423 /nfs/dbraw/zinc/80/54/23/1117805423.db2.gz WOOZPHZCMWFEBT-YOEHRIQHSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1CN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001484910977 1117824387 /nfs/dbraw/zinc/82/43/87/1117824387.db2.gz ZAVFJPIAGZFGGF-QUCCMNQESA-N 1 3 345.531 2.704 10 0 EFAEHO CC[C@H](C)C[N@H+](CC)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001485033218 1117966166 /nfs/dbraw/zinc/96/61/66/1117966166.db2.gz ZOBKUICAPXQAGM-ZWKOTPCHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C)C[N@@H+](CC)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001485033218 1117966170 /nfs/dbraw/zinc/96/61/70/1117966170.db2.gz ZOBKUICAPXQAGM-ZWKOTPCHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[N@H+](CCC(C)C)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001485032903 1117966274 /nfs/dbraw/zinc/96/62/74/1117966274.db2.gz NSOJGAYAJIUAGX-SFHVURJKSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[N@@H+](CCC(C)C)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001485032903 1117966276 /nfs/dbraw/zinc/96/62/76/1117966276.db2.gz NSOJGAYAJIUAGX-SFHVURJKSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[N@H+](CC[C@@H](C)F)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001485033048 1117966637 /nfs/dbraw/zinc/96/66/37/1117966637.db2.gz UDKPXUDLPGYWJR-DLBZAZTESA-N 1 3 341.515 2.637 10 0 EFAEHO CC[N@@H+](CC[C@@H](C)F)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001485033048 1117966644 /nfs/dbraw/zinc/96/66/44/1117966644.db2.gz UDKPXUDLPGYWJR-DLBZAZTESA-N 1 3 341.515 2.637 10 0 EFAEHO CC[N@H+](CC[C@H](C)F)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001485033051 1117966668 /nfs/dbraw/zinc/96/66/68/1117966668.db2.gz UDKPXUDLPGYWJR-SJORKVTESA-N 1 3 341.515 2.637 10 0 EFAEHO CC[N@@H+](CC[C@H](C)F)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001485033051 1117966674 /nfs/dbraw/zinc/96/66/74/1117966674.db2.gz UDKPXUDLPGYWJR-SJORKVTESA-N 1 3 341.515 2.637 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@@H]1C[N@H+](C)Cc1ccccc1 ZINC001485057555 1117995074 /nfs/dbraw/zinc/99/50/74/1117995074.db2.gz FZIPCGVJJHRELZ-RTBURBONSA-N 1 3 349.494 2.789 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@@H]1C[N@@H+](C)Cc1ccccc1 ZINC001485057555 1117995078 /nfs/dbraw/zinc/99/50/78/1117995078.db2.gz FZIPCGVJJHRELZ-RTBURBONSA-N 1 3 349.494 2.789 10 0 EFAEHO CC(C)[C@H](C(=O)NC1CC(C[NH2+]CCC2=CCCCC2)C1)N(C)C ZINC001485108518 1118055727 /nfs/dbraw/zinc/05/57/27/1118055727.db2.gz NIXGGKDUQFBFOH-CTWPCTMYSA-N 1 3 335.536 2.948 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001485219561 1118139660 /nfs/dbraw/zinc/13/96/60/1118139660.db2.gz YDLFPOFOSCQOSJ-ZIAGYGMSSA-N 1 3 332.492 2.714 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001485230183 1118156021 /nfs/dbraw/zinc/15/60/21/1118156021.db2.gz QSDFLSLAYPJLTM-KGLIPLIRSA-N 1 3 333.467 2.635 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N(C)CC(C)(C)C[NH2+]Cc1cccnc1 ZINC001485265523 1118184107 /nfs/dbraw/zinc/18/41/07/1118184107.db2.gz CXFFBLBQRGXLAD-IRXDYDNUSA-N 1 3 346.519 2.529 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC(C)(C)C[NH2+]CCC(C)C ZINC001485265570 1118184220 /nfs/dbraw/zinc/18/42/20/1118184220.db2.gz FNNWDSUHVZGNLX-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@@H](C)CNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001485337459 1118251675 /nfs/dbraw/zinc/25/16/75/1118251675.db2.gz XLLYWKRPAHVSAZ-INIZCTEOSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@H](C)CNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001485337461 1118252031 /nfs/dbraw/zinc/25/20/31/1118252031.db2.gz XLLYWKRPAHVSAZ-MRXNPFEDSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)[C@H]1CCCc2ccccc21 ZINC001485389777 1118330797 /nfs/dbraw/zinc/33/07/97/1118330797.db2.gz VMASMFCVWNRUOZ-APWZRJJASA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC001485389777 1118330798 /nfs/dbraw/zinc/33/07/98/1118330798.db2.gz VMASMFCVWNRUOZ-APWZRJJASA-N 1 3 331.504 2.841 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@@H]2CCCCCN2Cc2ccsc2)C1 ZINC001485484827 1118418019 /nfs/dbraw/zinc/41/80/19/1118418019.db2.gz LRONTDBCTBFLMO-AEFFLSMTSA-N 1 3 349.544 2.951 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@@H]2CCCCCN2Cc2ccsc2)C1 ZINC001485484827 1118418020 /nfs/dbraw/zinc/41/80/20/1118418020.db2.gz LRONTDBCTBFLMO-AEFFLSMTSA-N 1 3 349.544 2.951 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@H]2CCCCCN2Cc2ccsc2)C1 ZINC001485484828 1118418047 /nfs/dbraw/zinc/41/80/47/1118418047.db2.gz LRONTDBCTBFLMO-FUHWJXTLSA-N 1 3 349.544 2.951 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@H]2CCCCCN2Cc2ccsc2)C1 ZINC001485484828 1118418049 /nfs/dbraw/zinc/41/80/49/1118418049.db2.gz LRONTDBCTBFLMO-FUHWJXTLSA-N 1 3 349.544 2.951 10 0 EFAEHO CC(C)=CCN1CC([C@@H](C)NC(=O)[C@]2(F)CC[N@@H+](C(C)(C)C)C2)C1 ZINC001485526326 1118437092 /nfs/dbraw/zinc/43/70/92/1118437092.db2.gz NBAJWFMMHQOZQY-BEFAXECRSA-N 1 3 339.499 2.602 10 0 EFAEHO CC(C)=CCN1CC([C@@H](C)NC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)C1 ZINC001485526326 1118437093 /nfs/dbraw/zinc/43/70/93/1118437093.db2.gz NBAJWFMMHQOZQY-BEFAXECRSA-N 1 3 339.499 2.602 10 0 EFAEHO CC(C)=CCN1CC([C@H](C)NC(=O)[C@@]2(F)CC[N@@H+](C(C)(C)C)C2)C1 ZINC001485526330 1118437113 /nfs/dbraw/zinc/43/71/13/1118437113.db2.gz NBAJWFMMHQOZQY-HNAYVOBHSA-N 1 3 339.499 2.602 10 0 EFAEHO CC(C)=CCN1CC([C@H](C)NC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)C1 ZINC001485526330 1118437114 /nfs/dbraw/zinc/43/71/14/1118437114.db2.gz NBAJWFMMHQOZQY-HNAYVOBHSA-N 1 3 339.499 2.602 10 0 EFAEHO CCc1ccc(CN2CC([C@@H](C)NC(=O)C[C@H]3CC[N@H+](C)C3)C2)cc1 ZINC001485534123 1118445504 /nfs/dbraw/zinc/44/55/04/1118445504.db2.gz YPMKWLYKPWSDMH-VQIMIIECSA-N 1 3 343.515 2.527 10 0 EFAEHO CCc1ccc(CN2CC([C@@H](C)NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)cc1 ZINC001485534123 1118445505 /nfs/dbraw/zinc/44/55/05/1118445505.db2.gz YPMKWLYKPWSDMH-VQIMIIECSA-N 1 3 343.515 2.527 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@@H](C)C3)C[C@@]2(C)C1 ZINC001485668751 1118517820 /nfs/dbraw/zinc/51/78/20/1118517820.db2.gz DXRPOROWZGESIQ-JJTMIUFFSA-N 1 3 347.547 2.855 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@@H](C)C3)C[C@@]2(C)C1 ZINC001485668751 1118517822 /nfs/dbraw/zinc/51/78/22/1118517822.db2.gz DXRPOROWZGESIQ-JJTMIUFFSA-N 1 3 347.547 2.855 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C3CCC3)C2)cc1F ZINC001485686189 1118527573 /nfs/dbraw/zinc/52/75/73/1118527573.db2.gz KYUSTZLONZBSJE-QAQDUYKDSA-N 1 3 347.478 2.603 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]C[C@H]1C[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001485707156 1118530437 /nfs/dbraw/zinc/53/04/37/1118530437.db2.gz UMRADBQPZAIBKJ-KZNAEPCWSA-N 1 3 331.504 2.881 10 0 EFAEHO CN(C)CCOc1ccccc1C(=O)N(C)CC[C@@H]1CCCC[N@@H+]1C ZINC000266062663 282111082 /nfs/dbraw/zinc/11/10/82/282111082.db2.gz AYGWQOYMVUHSGU-KRWDZBQOSA-N 1 3 347.503 2.573 10 0 EFAEHO CN(C)CCOc1ccccc1C(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000266062663 282111084 /nfs/dbraw/zinc/11/10/84/282111084.db2.gz AYGWQOYMVUHSGU-KRWDZBQOSA-N 1 3 347.503 2.573 10 0 EFAEHO CN[C@H](CC[N@H+](CCO)C1CC1)c1ccc(Br)cc1 ZINC000053972118 214207479 /nfs/dbraw/zinc/20/74/79/214207479.db2.gz GQANJARARPWHFO-OAHLLOKOSA-N 1 3 327.266 2.556 10 0 EFAEHO CN[C@H](CC[N@@H+](CCO)C1CC1)c1ccc(Br)cc1 ZINC000053972118 214207482 /nfs/dbraw/zinc/20/74/82/214207482.db2.gz GQANJARARPWHFO-OAHLLOKOSA-N 1 3 327.266 2.556 10 0 EFAEHO CC(C)[NH+](CCNC(=O)NCCN1[C@@H](C)CCC[C@@H]1C)C(C)C ZINC000341351840 535070608 /nfs/dbraw/zinc/07/06/08/535070608.db2.gz CMYUYINIFFEHMY-IRXDYDNUSA-N 1 3 326.529 2.667 10 0 EFAEHO Cc1ccc(C[N@@H+]2CCC[C@H](CCNC(=O)C3(N)CCC3)C2)cc1 ZINC000067856205 215233808 /nfs/dbraw/zinc/23/38/08/215233808.db2.gz KXYOQUDIUTYOBK-QGZVFWFLSA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1ccc(C[N@H+]2CCC[C@H](CCNC(=O)C3(N)CCC3)C2)cc1 ZINC000067856205 215233810 /nfs/dbraw/zinc/23/38/10/215233810.db2.gz KXYOQUDIUTYOBK-QGZVFWFLSA-N 1 3 329.488 2.595 10 0 EFAEHO CC[C@@H]1CN(c2cc(Br)ccc2C[NH2+]C)CCN1C ZINC000104128515 219349791 /nfs/dbraw/zinc/34/97/91/219349791.db2.gz GKGRCMSUWHTUHT-CQSZACIVSA-N 1 3 326.282 2.699 10 0 EFAEHO O[C@@]1(C[NH2+]CC2CCC(c3nc4ccccc4[nH]3)CC2)CCCNC1 ZINC000072433037 216226926 /nfs/dbraw/zinc/22/69/26/216226926.db2.gz LMHQWAGGIYVXAY-PMTKGXAQSA-N 1 3 342.487 2.541 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000412418472 243306808 /nfs/dbraw/zinc/30/68/08/243306808.db2.gz OPZFNWXOYOIKRV-KRWDZBQOSA-N 1 3 337.533 2.903 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000412418472 243306813 /nfs/dbraw/zinc/30/68/13/243306813.db2.gz OPZFNWXOYOIKRV-KRWDZBQOSA-N 1 3 337.533 2.903 10 0 EFAEHO C[NH+](C)CCNc1cc(N2CCOCC2)nc2ccc(Cl)cc21 ZINC000253495279 244005049 /nfs/dbraw/zinc/00/50/49/244005049.db2.gz TYBQXBZQAWOBII-UHFFFAOYSA-N 1 3 334.851 2.698 10 0 EFAEHO NCC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2)C1 ZINC000414741890 244318459 /nfs/dbraw/zinc/31/84/59/244318459.db2.gz LFIYZKWJAQXPFX-CRAIPNDOSA-N 1 3 333.451 2.550 10 0 EFAEHO NCC(=O)N1CCC[C@H](C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2)C1 ZINC000414741890 244318463 /nfs/dbraw/zinc/31/84/63/244318463.db2.gz LFIYZKWJAQXPFX-CRAIPNDOSA-N 1 3 333.451 2.550 10 0 EFAEHO Cc1cc2c(ncnc2N2CCN(C[C@H]3CC[NH2+][C@@H](C)C3)CC2)s1 ZINC000414752486 244326487 /nfs/dbraw/zinc/32/64/87/244326487.db2.gz KUHSECUXYADUAY-ZFWWWQNUSA-N 1 3 345.516 2.510 10 0 EFAEHO CC[NH+](CC)CCN(CC(C)C)C(=O)NC[C@H](N)c1ccccc1 ZINC000418406080 245146767 /nfs/dbraw/zinc/14/67/67/245146767.db2.gz BQTFASJKUSSGMU-SFHVURJKSA-N 1 3 334.508 2.696 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000418493620 245173354 /nfs/dbraw/zinc/17/33/54/245173354.db2.gz RCTMEEOLFWIZGA-MRXNPFEDSA-N 1 3 344.503 2.866 10 0 EFAEHO [NH3+][C@@H](CNC(=O)N1CCN(CC2CCCCC2)CC1)c1ccccc1 ZINC000418454732 245164011 /nfs/dbraw/zinc/16/40/11/245164011.db2.gz QVIFRWUUWKKPHG-IBGZPJMESA-N 1 3 344.503 2.594 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)N2CCC[C@H]2CN2CCCCC2)cc1 ZINC000418464762 245168060 /nfs/dbraw/zinc/16/80/60/245168060.db2.gz QANZVSIOFHUNCW-APWZRJJASA-N 1 3 344.503 2.866 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)N(C)[C@@H]1CC[N@@H+](CC)C[C@H]1C ZINC000418644562 245223509 /nfs/dbraw/zinc/22/35/09/245223509.db2.gz CHUUIJVUBNLFRO-ATZDWAIDSA-N 1 3 346.519 2.621 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)N(C)[C@@H]1CC[N@H+](CC)C[C@H]1C ZINC000418644562 245223515 /nfs/dbraw/zinc/22/35/15/245223515.db2.gz CHUUIJVUBNLFRO-ATZDWAIDSA-N 1 3 346.519 2.621 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H](CCC[NH3+])c2ccccc2)CCN1C ZINC000418680714 245242494 /nfs/dbraw/zinc/24/24/94/245242494.db2.gz UUAQIFHUCGVMOX-NJAFHUGGSA-N 1 3 332.492 2.591 10 0 EFAEHO C[N@H+](CC(=O)NC1CCN(C2CC2)CC1)[C@H]1CCC[C@H]1C(C)(C)C ZINC000419330876 245382623 /nfs/dbraw/zinc/38/26/23/245382623.db2.gz RADYFFBHNXKUNJ-MSOLQXFVSA-N 1 3 335.536 2.876 10 0 EFAEHO C[N@@H+](CC(=O)NC1CCN(C2CC2)CC1)[C@H]1CCC[C@H]1C(C)(C)C ZINC000419330876 245382629 /nfs/dbraw/zinc/38/26/29/245382629.db2.gz RADYFFBHNXKUNJ-MSOLQXFVSA-N 1 3 335.536 2.876 10 0 EFAEHO Clc1cccnc1N1CC[C@H](N[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)C1 ZINC000422877427 246497441 /nfs/dbraw/zinc/49/74/41/246497441.db2.gz RJFOHJMQDBTZLV-XJNFMUPTSA-N 1 3 334.895 2.824 10 0 EFAEHO CC(C)C[C@H]([NH2+]C[C@H](C)c1ccc(F)cc1)C(=O)NCCN(C)C ZINC000437787893 249709696 /nfs/dbraw/zinc/70/96/96/249709696.db2.gz RYMQYBXOLSURMB-YJBOKZPZSA-N 1 3 337.483 2.611 10 0 EFAEHO CN(C[C@@H](O)Cc1ccccc1C(F)(F)F)C[C@H]1CCC[N@H+](C)C1 ZINC000443604807 250210811 /nfs/dbraw/zinc/21/08/11/250210811.db2.gz LYBOPKKGIWSSBM-HOCLYGCPSA-N 1 3 344.421 2.882 10 0 EFAEHO CN(C[C@@H](O)Cc1ccccc1C(F)(F)F)C[C@H]1CCC[N@@H+](C)C1 ZINC000443604807 250210815 /nfs/dbraw/zinc/21/08/15/250210815.db2.gz LYBOPKKGIWSSBM-HOCLYGCPSA-N 1 3 344.421 2.882 10 0 EFAEHO COC[C@](C)(O)CC[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000449383722 251006196 /nfs/dbraw/zinc/00/61/96/251006196.db2.gz JNGDTPLMQSEXBT-UWHLTILDSA-N 1 3 346.515 2.664 10 0 EFAEHO CN(Cc1ccccc1)CC(C)(C)C[NH2+]C[C@H]1CCCCN1CCO ZINC000449389441 251009295 /nfs/dbraw/zinc/00/92/95/251009295.db2.gz CWTVFPDIUOQMQQ-HXUWFJFHSA-N 1 3 347.547 2.581 10 0 EFAEHO CN(Cc1ccccc1)CC(C)(C)C[NH2+]C[C@@H]1CCCCN1CCO ZINC000449389440 251009574 /nfs/dbraw/zinc/00/95/74/251009574.db2.gz CWTVFPDIUOQMQQ-FQEVSTJZSA-N 1 3 347.547 2.581 10 0 EFAEHO CC(C)Oc1ccc2[nH+]ccc(N3CCN(CCO)[C@@H](C)C3)c2c1 ZINC000450448273 251390077 /nfs/dbraw/zinc/39/00/77/251390077.db2.gz AABNZISYPJPDEG-HNNXBMFYSA-N 1 3 329.444 2.525 10 0 EFAEHO CCc1cc(CCCN2CCC(OCC[NH+]3CCCC3)CC2)on1 ZINC000450454133 251394127 /nfs/dbraw/zinc/39/41/27/251394127.db2.gz RAIPIZNZFTVDIG-UHFFFAOYSA-N 1 3 335.492 2.746 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCCNC(=O)c1ccco1 ZINC000268765416 252215710 /nfs/dbraw/zinc/21/57/10/252215710.db2.gz PQXQYUBHSYTJSJ-WMZOPIPTSA-N 1 3 341.455 2.510 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCCNC(=O)c1ccco1 ZINC000268765416 252215714 /nfs/dbraw/zinc/21/57/14/252215714.db2.gz PQXQYUBHSYTJSJ-WMZOPIPTSA-N 1 3 341.455 2.510 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CCN(C2CC2)C1 ZINC000268798727 252250951 /nfs/dbraw/zinc/25/09/51/252250951.db2.gz GXNFOJNIIPBCQI-LMNJBCLMSA-N 1 3 327.516 2.971 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCCN1CCSCC1 ZINC000268863707 252311352 /nfs/dbraw/zinc/31/13/52/252311352.db2.gz GUVMPENYKNLXJW-IEBWSBKVSA-N 1 3 333.545 2.535 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCCN1CCSCC1 ZINC000268863707 252311359 /nfs/dbraw/zinc/31/13/59/252311359.db2.gz GUVMPENYKNLXJW-IEBWSBKVSA-N 1 3 333.545 2.535 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCCN1CCSCC1 ZINC000268863708 252311909 /nfs/dbraw/zinc/31/19/09/252311909.db2.gz GUVMPENYKNLXJW-MJGOQNOKSA-N 1 3 333.545 2.535 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCCN1CCSCC1 ZINC000268863708 252311912 /nfs/dbraw/zinc/31/19/12/252311912.db2.gz GUVMPENYKNLXJW-MJGOQNOKSA-N 1 3 333.545 2.535 10 0 EFAEHO CCN(Cc1cccc(C[N@H+](CC)[C@@H]2CCOC2)c1)[C@@H]1CCOC1 ZINC000361584937 285105559 /nfs/dbraw/zinc/10/55/59/285105559.db2.gz ARZKTJTYEUSOMI-WOJBJXKFSA-N 1 3 332.488 2.908 10 0 EFAEHO CCN(Cc1cccc(C[N@@H+](CC)[C@@H]2CCOC2)c1)[C@@H]1CCOC1 ZINC000361584937 285105561 /nfs/dbraw/zinc/10/55/61/285105561.db2.gz ARZKTJTYEUSOMI-WOJBJXKFSA-N 1 3 332.488 2.908 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)Cc1ccc(-c2cc[nH]n2)o1 ZINC000349072592 285281784 /nfs/dbraw/zinc/28/17/84/285281784.db2.gz JGFAACZEJXCBHB-INIZCTEOSA-N 1 3 345.491 2.518 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)Cc1ccc(-c2cc[nH]n2)o1 ZINC000349072592 285281787 /nfs/dbraw/zinc/28/17/87/285281787.db2.gz JGFAACZEJXCBHB-INIZCTEOSA-N 1 3 345.491 2.518 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)[C@H](C)Cc1ccccc1 ZINC000352825138 285280212 /nfs/dbraw/zinc/28/02/12/285280212.db2.gz CBZDSTKTMBKLBL-QUCCMNQESA-N 1 3 345.531 2.740 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)[C@H](C)Cc1ccccc1 ZINC000352825138 285280216 /nfs/dbraw/zinc/28/02/16/285280216.db2.gz CBZDSTKTMBKLBL-QUCCMNQESA-N 1 3 345.531 2.740 10 0 EFAEHO OC[C@H]1CCC[N@@H+]1Cc1ccccc1CN[C@@H]1CCCc2n[nH]cc21 ZINC000367640285 285291608 /nfs/dbraw/zinc/29/16/08/285291608.db2.gz ZODVSZCGNDSLPW-IEBWSBKVSA-N 1 3 340.471 2.534 10 0 EFAEHO OC[C@H]1CCC[N@H+]1Cc1ccccc1CN[C@@H]1CCCc2n[nH]cc21 ZINC000367640285 285291609 /nfs/dbraw/zinc/29/16/09/285291609.db2.gz ZODVSZCGNDSLPW-IEBWSBKVSA-N 1 3 340.471 2.534 10 0 EFAEHO CCN1CCN([C@H](C)C[NH2+][C@H]2CCCOc3ccc(C)cc32)CC1 ZINC000155657775 285336096 /nfs/dbraw/zinc/33/60/96/285336096.db2.gz FBEKFSLCRIROOK-MJGOQNOKSA-N 1 3 331.504 2.824 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1cccc(NC(=O)c2ccccc2)c1 ZINC000423005128 285374006 /nfs/dbraw/zinc/37/40/06/285374006.db2.gz QVMHAJOJSYECEL-IBGZPJMESA-N 1 3 341.455 2.782 10 0 EFAEHO C[C@@H]1CCC[C@H]([NH+]2CCC(N[C@@H]3CCC(=O)NC34CCC4)CC2)C1 ZINC000338774017 141675045 /nfs/dbraw/zinc/67/50/45/141675045.db2.gz CLXIBTSJVJOIIV-BPQIPLTHSA-N 1 3 333.520 2.820 10 0 EFAEHO C[C@@H]1CCC[C@H](N2CCC([NH2+][C@@H]3CCC(=O)NC34CCC4)CC2)C1 ZINC000338774017 141675047 /nfs/dbraw/zinc/67/50/47/141675047.db2.gz CLXIBTSJVJOIIV-BPQIPLTHSA-N 1 3 333.520 2.820 10 0 EFAEHO C[NH+]1CCC(CNCc2ccc(Cl)o2)(N2CCCCC2)CC1 ZINC000344608168 142048479 /nfs/dbraw/zinc/04/84/79/142048479.db2.gz PBZQOXFBHMPRBX-UHFFFAOYSA-N 1 3 325.884 2.973 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCC(CC[NH+](C)C)CC1 ZINC000346132359 142151956 /nfs/dbraw/zinc/15/19/56/142151956.db2.gz BSQIMVIPTALJAC-UHFFFAOYSA-N 1 3 327.476 2.739 10 0 EFAEHO CN(C(=O)NCCCCC[NH+]1CCCCC1)[C@H]1CCN(C2CC2)C1 ZINC000350076871 142396688 /nfs/dbraw/zinc/39/66/88/142396688.db2.gz BBVBADKMZWPCJE-SFHVURJKSA-N 1 3 336.524 2.521 10 0 EFAEHO COC1(C[C@H](C)[NH2+]CC2(N3CCCCC3)CCN(C)CC2)CCC1 ZINC000369363577 292125359 /nfs/dbraw/zinc/12/53/59/292125359.db2.gz REAZZDUTDOAKAN-SFHVURJKSA-N 1 3 337.552 2.874 10 0 EFAEHO CN(C)CCOc1cc(C[NH2+][C@@H]2CCC[C@H]([C@@H]3CCOC3)C2)ccn1 ZINC000341396244 145045239 /nfs/dbraw/zinc/04/52/39/145045239.db2.gz HBSFDONYYOQTAV-IPMKNSEASA-N 1 3 347.503 2.707 10 0 EFAEHO CC[C@@H]1CCCC[N@@H+]1CCNC(=O)CCN1CCc2ccccc2C1 ZINC000348901477 146021461 /nfs/dbraw/zinc/02/14/61/146021461.db2.gz QBUDDDCVFBOVTK-HXUWFJFHSA-N 1 3 343.515 2.816 10 0 EFAEHO CC[C@@H]1CCCC[N@H+]1CCNC(=O)CCN1CCc2ccccc2C1 ZINC000348901477 146021463 /nfs/dbraw/zinc/02/14/63/146021463.db2.gz QBUDDDCVFBOVTK-HXUWFJFHSA-N 1 3 343.515 2.816 10 0 EFAEHO CCC[NH+]1CCC(N(C)C(=O)CCN2CCc3ccccc3C2)CC1 ZINC000348897551 146021693 /nfs/dbraw/zinc/02/16/93/146021693.db2.gz CVIPQRAPEXMQOI-UHFFFAOYSA-N 1 3 343.515 2.768 10 0 EFAEHO CC[C@H]1CCCC[N@@H+]1CCNC(=O)CCN1CCc2ccccc2C1 ZINC000348901475 146021774 /nfs/dbraw/zinc/02/17/74/146021774.db2.gz QBUDDDCVFBOVTK-FQEVSTJZSA-N 1 3 343.515 2.816 10 0 EFAEHO CC[C@H]1CCCC[N@H+]1CCNC(=O)CCN1CCc2ccccc2C1 ZINC000348901475 146021776 /nfs/dbraw/zinc/02/17/76/146021776.db2.gz QBUDDDCVFBOVTK-FQEVSTJZSA-N 1 3 343.515 2.816 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)CCN2CCc3ccccc3C2)CC1 ZINC000348911780 146022908 /nfs/dbraw/zinc/02/29/08/146022908.db2.gz NLFUDQCDWMFGJW-UHFFFAOYSA-N 1 3 343.515 2.673 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000350733273 146085493 /nfs/dbraw/zinc/08/54/93/146085493.db2.gz ZGYZCOBSZSRBHS-IEBWSBKVSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[C@@H]1C[C@@H](CN2CCN(C3CC[NH+](C(C)C)CC3)CC2)CCO1 ZINC000356997554 147395419 /nfs/dbraw/zinc/39/54/19/147395419.db2.gz RWGMCIPJVNWXSZ-AZUAARDMSA-N 1 3 337.552 2.682 10 0 EFAEHO CO[C@]1(CNC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCOC1 ZINC000359391409 148073683 /nfs/dbraw/zinc/07/36/83/148073683.db2.gz HFAAABYKYMEDDE-NXEWRWPSSA-N 1 3 330.472 2.577 10 0 EFAEHO CO[C@]1(CNC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCOC1 ZINC000359391409 148073686 /nfs/dbraw/zinc/07/36/86/148073686.db2.gz HFAAABYKYMEDDE-NXEWRWPSSA-N 1 3 330.472 2.577 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)NCC[N@H+]2CCCC[C@H]2C)N(C)C)cc1 ZINC000338295720 292199316 /nfs/dbraw/zinc/19/93/16/292199316.db2.gz KBAZVLBUALTOMX-IEBWSBKVSA-N 1 3 346.519 2.771 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)NCC[N@@H+]2CCCC[C@H]2C)N(C)C)cc1 ZINC000338295720 292199319 /nfs/dbraw/zinc/19/93/19/292199319.db2.gz KBAZVLBUALTOMX-IEBWSBKVSA-N 1 3 346.519 2.771 10 0 EFAEHO CN1CCC[C@@H](CNC(=O)CC[NH3+])[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000364851260 149258555 /nfs/dbraw/zinc/25/85/55/149258555.db2.gz PIYXWVHHZUOQQK-XJKSGUPXSA-N 1 3 343.393 2.553 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000368094052 150034186 /nfs/dbraw/zinc/03/41/86/150034186.db2.gz VTJSJPNPWOWOMN-LPHOPBHVSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000368094052 150034189 /nfs/dbraw/zinc/03/41/89/150034189.db2.gz VTJSJPNPWOWOMN-LPHOPBHVSA-N 1 3 341.515 2.970 10 0 EFAEHO CN1CCN(CC2(C)CC[NH+](CCOc3ccc(F)cc3)CC2)CC1 ZINC000368332586 150095502 /nfs/dbraw/zinc/09/55/02/150095502.db2.gz OJDNJPVDBQDNSO-UHFFFAOYSA-N 1 3 349.494 2.554 10 0 EFAEHO CCN(C(=O)C[NH2+]CC1CC1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000368454964 150121180 /nfs/dbraw/zinc/12/11/80/150121180.db2.gz WYCIZQIBQQBFBA-LPHOPBHVSA-N 1 3 329.488 2.670 10 0 EFAEHO CC(C)N1CCN(CCC[NH+]2CCC(C3CCOCC3)CC2)CC1 ZINC000368952269 150244986 /nfs/dbraw/zinc/24/49/86/150244986.db2.gz UPFLHVVYWDIZPG-UHFFFAOYSA-N 1 3 337.552 2.541 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)NC2CC([NH+]3CCCCC3)C2)c1 ZINC000369212445 150301253 /nfs/dbraw/zinc/30/12/53/150301253.db2.gz BSSVGGMSYDWTAF-UHFFFAOYSA-N 1 3 330.476 2.887 10 0 EFAEHO Cn1c2ccccc2nc1CCN1CCC(C[NH+]2CCCC2)CC1 ZINC000369493386 150368336 /nfs/dbraw/zinc/36/83/36/150368336.db2.gz UCVZUZYEHRHXLJ-UHFFFAOYSA-N 1 3 326.488 2.924 10 0 EFAEHO C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]C1CC(N2CCCCC2)C1 ZINC000373522643 151183739 /nfs/dbraw/zinc/18/37/39/151183739.db2.gz NJWVRXZVMDQXHP-RLHVNXBHSA-N 1 3 342.531 2.899 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC(C[NH+]2CCCC2)CC1)N1CCCCC1 ZINC000374212945 151302222 /nfs/dbraw/zinc/30/22/22/151302222.db2.gz FZDJOBSXPRMYNO-LJQANCHMSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000341554309 287389660 /nfs/dbraw/zinc/38/96/60/287389660.db2.gz IRSDXRUCAPWQMY-KURKYZTESA-N 1 3 336.524 2.519 10 0 EFAEHO O=C(c1ccccc1)N1CCC(CN[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000166660856 544852305 /nfs/dbraw/zinc/85/23/05/544852305.db2.gz SIXTZXNCQDXYPX-WOJBJXKFSA-N 1 3 341.499 2.755 10 0 EFAEHO O=C(c1ccccc1)N1CCC(CN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)CC1 ZINC000166660856 544852309 /nfs/dbraw/zinc/85/23/09/544852309.db2.gz SIXTZXNCQDXYPX-WOJBJXKFSA-N 1 3 341.499 2.755 10 0 EFAEHO O=C(c1ccccc1)N1CCC(C[NH2+][C@@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000166660856 544852314 /nfs/dbraw/zinc/85/23/14/544852314.db2.gz SIXTZXNCQDXYPX-WOJBJXKFSA-N 1 3 341.499 2.755 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1[NH2+]CC(=O)N(C)CC1CC1 ZINC000189959352 265204707 /nfs/dbraw/zinc/20/47/07/265204707.db2.gz UWSQNTIBMHTELZ-IRXDYDNUSA-N 1 3 343.515 2.601 10 0 EFAEHO CC(C)COC1CC[NH+](CCCN2CCN(C(C)C)CC2)CC1 ZINC000191464097 265265189 /nfs/dbraw/zinc/26/51/89/265265189.db2.gz MQRIAAOCUZHKGU-UHFFFAOYSA-N 1 3 325.541 2.540 10 0 EFAEHO COc1ccc([C@@H](C)[NH2+]CCCN2CCN(C(C)C)CC2)cc1F ZINC000192785548 265307498 /nfs/dbraw/zinc/30/74/98/265307498.db2.gz NPPVZNRBNUOUNC-MRXNPFEDSA-N 1 3 337.483 2.901 10 0 EFAEHO CCc1ccc([C@@H](CNC(=O)CC2CC[NH+](C)CC2)N(C)C)cc1 ZINC000273208919 266466055 /nfs/dbraw/zinc/46/60/55/266466055.db2.gz JYLJQKHYGPBKOB-LJQANCHMSA-N 1 3 331.504 2.700 10 0 EFAEHO COC1(C[C@@H](C)[NH2+]Cc2ccccc2CN2CC[C@H](O)C2)CCC1 ZINC000277240514 267136328 /nfs/dbraw/zinc/13/63/28/267136328.db2.gz ZSZISDSCSMJCBF-APWZRJJASA-N 1 3 332.488 2.691 10 0 EFAEHO C[NH+](C)[C@@H]1CCCN(C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000277301680 267150467 /nfs/dbraw/zinc/15/04/67/267150467.db2.gz PDFKURCILUYDAP-LJQANCHMSA-N 1 3 329.488 2.839 10 0 EFAEHO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]C2CCN(CCN(C)C)CC2)cc1 ZINC000284060287 273791989 /nfs/dbraw/zinc/79/19/89/273791989.db2.gz AIFVMRFCULPAGI-ZLGUVYLKSA-N 1 3 345.531 2.803 10 0 EFAEHO C[C@H](Cc1ccccc1)C[NH+]1CCC(CN2CCN(C)CC2)CC1 ZINC000289447075 274762372 /nfs/dbraw/zinc/76/23/72/274762372.db2.gz MRZCVUXWOCSOQR-LJQANCHMSA-N 1 3 329.532 2.825 10 0 EFAEHO C(=C/C[N@@H+]1CCC[C@@H]2COCC[C@@H]21)\CN1CCC[C@@H]2COCC[C@@H]21 ZINC000340195670 275389103 /nfs/dbraw/zinc/38/91/03/275389103.db2.gz CAKBODPLQYRFIH-IYJQCHCFSA-N 1 3 334.504 2.544 10 0 EFAEHO C(=C/C[N@H+]1CCC[C@@H]2COCC[C@@H]21)\CN1CCC[C@@H]2COCC[C@@H]21 ZINC000340195670 275389104 /nfs/dbraw/zinc/38/91/04/275389104.db2.gz CAKBODPLQYRFIH-IYJQCHCFSA-N 1 3 334.504 2.544 10 0 EFAEHO CC(C)C[C@H](N[C@H]1CC(C)(C)Cc2occc21)C(=O)NCC[NH+](C)C ZINC000354005916 275598788 /nfs/dbraw/zinc/59/87/88/275598788.db2.gz JELOVFKKCYBWHH-IRXDYDNUSA-N 1 3 349.519 2.975 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H](OC)C2CC2)CC1 ZINC000339528008 276013114 /nfs/dbraw/zinc/01/31/14/276013114.db2.gz LWECIKOQXDTXHZ-FQEVSTJZSA-N 1 3 331.504 2.733 10 0 EFAEHO CC(C)[C@](C)(O)C[NH+]1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000248591809 276037632 /nfs/dbraw/zinc/03/76/32/276037632.db2.gz ZUCOQKYFSFPLMS-ZHALLVOQSA-N 1 3 326.525 2.605 10 0 EFAEHO CCN(C(=O)N[C@H](C)[C@H](C)[NH3+])[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418729242 276062656 /nfs/dbraw/zinc/06/26/56/276062656.db2.gz QUYCXESRKHJLNH-BVIKNXMNSA-N 1 3 332.492 2.589 10 0 EFAEHO CCN(C(=O)N[C@@H]1CCC[NH2+]C1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418387560 276062737 /nfs/dbraw/zinc/06/27/37/276062737.db2.gz TXZRAELCTZQWIZ-UHOSZYNNSA-N 1 3 344.503 2.605 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCC[C@H](C)[N@H+](C)Cc2ccccc2)C1 ZINC000245437232 276166689 /nfs/dbraw/zinc/16/66/89/276166689.db2.gz WIRXHSXAQRDBPK-PKOBYXMFSA-N 1 3 346.519 2.681 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCC[C@H](C)[N@@H+](C)Cc2ccccc2)C1 ZINC000245437232 276166690 /nfs/dbraw/zinc/16/66/90/276166690.db2.gz WIRXHSXAQRDBPK-PKOBYXMFSA-N 1 3 346.519 2.681 10 0 EFAEHO CCN1CCC[C@H]1CNC(=[NH2+])NC[C@H]1CC[C@@H](c2ccccc2)O1 ZINC000368186504 276184646 /nfs/dbraw/zinc/18/46/46/276184646.db2.gz SOAUZNDUKJMSRY-KSZLIROESA-N 1 3 330.476 2.505 10 0 EFAEHO CN1CCC[C@@H](CNC(=O)[C@@H]2CCC[C@@H]2C[NH3+])[C@H]1c1cccs1 ZINC000261733062 277053297 /nfs/dbraw/zinc/05/32/97/277053297.db2.gz LAQWBJNASKFZSY-DLTWYDFYSA-N 1 3 335.517 2.622 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCN1C[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)[C@H]2C1 ZINC000248558068 277061565 /nfs/dbraw/zinc/06/15/65/277061565.db2.gz BWXOTKKORZZSEF-YVSFHVDLSA-N 1 3 337.508 2.706 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCN1C[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)[C@H]2C1 ZINC000248558068 277061567 /nfs/dbraw/zinc/06/15/67/277061567.db2.gz BWXOTKKORZZSEF-YVSFHVDLSA-N 1 3 337.508 2.706 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCN1C[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H]2C1 ZINC000248558065 277061948 /nfs/dbraw/zinc/06/19/48/277061948.db2.gz BWXOTKKORZZSEF-YLFCFFPRSA-N 1 3 337.508 2.706 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCN1C[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H]2C1 ZINC000248558065 277061949 /nfs/dbraw/zinc/06/19/49/277061949.db2.gz BWXOTKKORZZSEF-YLFCFFPRSA-N 1 3 337.508 2.706 10 0 EFAEHO CC(C)C[NH+]1CCC(NC(=O)N[C@H](CN(C)C)c2ccccc2)CC1 ZINC000045185155 277385216 /nfs/dbraw/zinc/38/52/16/277385216.db2.gz PEGKPYKBRVTVKK-LJQANCHMSA-N 1 3 346.519 2.709 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3[NH2+]2)cc1 ZINC000262423058 278049540 /nfs/dbraw/zinc/04/95/40/278049540.db2.gz GAVTVINRTVTMGB-YRXWBPOGSA-N 1 3 329.488 2.847 10 0 EFAEHO CC1(C)COC[C@H]1NCc1cccc(C[NH2+][C@@H]2COCC2(C)C)c1 ZINC000451811227 278356772 /nfs/dbraw/zinc/35/67/72/278356772.db2.gz MWNDEMDWXVRZRW-QZTJIDSGSA-N 1 3 332.488 2.716 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000175635147 279127341 /nfs/dbraw/zinc/12/73/41/279127341.db2.gz VIOXROXWWDFNCL-QGZVFWFLSA-N 1 3 338.540 2.669 10 0 EFAEHO CC[NH+](CC)Cc1cccc(CNC(=O)N2CCN3CCC[C@@H]3C2)c1 ZINC000171900514 279137782 /nfs/dbraw/zinc/13/77/82/279137782.db2.gz CDYLTXIHIRUVAA-LJQANCHMSA-N 1 3 344.503 2.518 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)N[C@H](C)C1CCCC1 ZINC000341140062 279302452 /nfs/dbraw/zinc/30/24/52/279302452.db2.gz KCCYYUVUOBPFQN-SJLPKXTDSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)N[C@H](C)C1CCCC1 ZINC000341140062 279302453 /nfs/dbraw/zinc/30/24/53/279302453.db2.gz KCCYYUVUOBPFQN-SJLPKXTDSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)N(C)C ZINC000130342721 280172644 /nfs/dbraw/zinc/17/26/44/280172644.db2.gz PTWKWQXRPKWVDP-UAGQMJEPSA-N 1 3 337.533 2.833 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)N(C)C ZINC000130342721 280172647 /nfs/dbraw/zinc/17/26/47/280172647.db2.gz PTWKWQXRPKWVDP-UAGQMJEPSA-N 1 3 337.533 2.833 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)N(C)C ZINC000350060199 280174904 /nfs/dbraw/zinc/17/49/04/280174904.db2.gz PTWKWQXRPKWVDP-DJIMGWMZSA-N 1 3 337.533 2.833 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1)N(C)C ZINC000350060199 280174905 /nfs/dbraw/zinc/17/49/05/280174905.db2.gz PTWKWQXRPKWVDP-DJIMGWMZSA-N 1 3 337.533 2.833 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]C[C@]1(N(C)C)CCSC1 ZINC000269004632 288217605 /nfs/dbraw/zinc/21/76/05/288217605.db2.gz VTTMHGYDBPITOT-MISYRCLQSA-N 1 3 347.572 2.924 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)NC2CCC(C[NH+](C)C)CC2)c1 ZINC000178688628 289226189 /nfs/dbraw/zinc/22/61/89/289226189.db2.gz BQBGTSHBZIURRK-UHFFFAOYSA-N 1 3 332.492 2.990 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NCCCC[NH+]1CCC(C)CC1 ZINC000079389686 292786903 /nfs/dbraw/zinc/78/69/03/292786903.db2.gz UVRZZQSCKJOIIP-GOSISDBHSA-N 1 3 340.556 2.774 10 0 EFAEHO CN1CC[C@H]([NH2+]CC2(N3CCSCC3)CCCC2)[C@H]2CCC[C@H]21 ZINC000353443973 290216516 /nfs/dbraw/zinc/21/65/16/290216516.db2.gz FDIURMRLODZKEV-FGTMMUONSA-N 1 3 337.577 2.810 10 0 EFAEHO CN1CC[C@H]([NH2+]CC2(N3CCSCC3)CCCC2)[C@@H]2CCC[C@@H]21 ZINC000353443967 290216560 /nfs/dbraw/zinc/21/65/60/290216560.db2.gz FDIURMRLODZKEV-BZSNNMDCSA-N 1 3 337.577 2.810 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccccc2CN2CCCC2=O)[C@@H]2CCC[C@H]21 ZINC000375791168 290220437 /nfs/dbraw/zinc/22/04/37/290220437.db2.gz NZTVIKYTNWQJOF-SLFFLAALSA-N 1 3 341.499 2.771 10 0 EFAEHO C[C@@H](CNC(=O)N[C@@H](CN(C)C)c1ccccc1)[NH+]1CCC(C)CC1 ZINC000128974177 293120421 /nfs/dbraw/zinc/12/04/21/293120421.db2.gz XZRIESNESOSMGQ-HKUYNNGSSA-N 1 3 346.519 2.709 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@]1(O)CCC[C@@H](C(F)(F)F)C1 ZINC000423058021 293261639 /nfs/dbraw/zinc/26/16/39/293261639.db2.gz BIGZLIGXJGJRLE-GHJWDPDVSA-N 1 3 345.409 2.983 10 0 EFAEHO COC[C@]1(CN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)OCCc2ccccc21 ZINC000353564784 293294484 /nfs/dbraw/zinc/29/44/84/293294484.db2.gz IQAVNTNDQKFWRP-PBASOCQRSA-N 1 3 344.499 2.563 10 0 EFAEHO COC[C@]1(CN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@@H]32)OCCc2ccccc21 ZINC000353564784 293294486 /nfs/dbraw/zinc/29/44/86/293294486.db2.gz IQAVNTNDQKFWRP-PBASOCQRSA-N 1 3 344.499 2.563 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)NCCC1=CCCC1 ZINC000152255536 293325300 /nfs/dbraw/zinc/32/53/00/293325300.db2.gz CMGOBSKXYLMHSY-GOSISDBHSA-N 1 3 336.524 2.544 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)NCCC1=CCCC1 ZINC000152255536 293325303 /nfs/dbraw/zinc/32/53/03/293325303.db2.gz CMGOBSKXYLMHSY-GOSISDBHSA-N 1 3 336.524 2.544 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@H](C)c2ccc(F)c(OC)c2)CC1 ZINC000152894588 293351759 /nfs/dbraw/zinc/35/17/59/293351759.db2.gz UGHDECKDARVKPW-MRXNPFEDSA-N 1 3 337.483 2.903 10 0 EFAEHO c1cc([C@H]2OCCC[C@@H]2[NH2+]C2CCN(c3ccncc3)CC2)ccn1 ZINC000291505400 294399788 /nfs/dbraw/zinc/39/97/88/294399788.db2.gz WFOQNHVHDGRCMO-VQTJNVASSA-N 1 3 338.455 2.955 10 0 EFAEHO NC(=O)C[C@H]1CCCC[N@@H+]1Cc1cccc(CN2CCCCC2)c1 ZINC000411223506 295058502 /nfs/dbraw/zinc/05/85/02/295058502.db2.gz KFSHPMOIXRPUBF-LJQANCHMSA-N 1 3 329.488 2.902 10 0 EFAEHO NC(=O)C[C@H]1CCCC[N@H+]1Cc1cccc(CN2CCCCC2)c1 ZINC000411223506 295058505 /nfs/dbraw/zinc/05/85/05/295058505.db2.gz KFSHPMOIXRPUBF-LJQANCHMSA-N 1 3 329.488 2.902 10 0 EFAEHO CSc1ccc([C@H](CNC(=O)CC2CC[NH+](C)CC2)N(C)C)cc1 ZINC000294181597 295123998 /nfs/dbraw/zinc/12/39/98/295123998.db2.gz BLQIPHPGAMYENB-SFHVURJKSA-N 1 3 349.544 2.859 10 0 EFAEHO Cn1cc(CNC2CCN(c3cc[nH+]cc3)CC2)c(C(F)(F)F)n1 ZINC000294236502 295132987 /nfs/dbraw/zinc/13/29/87/295132987.db2.gz OSXMFKANEOELCP-UHFFFAOYSA-N 1 3 339.365 2.593 10 0 EFAEHO Cn1cc(C[NH2+]C2CCN(c3ccncc3)CC2)c(C(F)(F)F)n1 ZINC000294236502 295132989 /nfs/dbraw/zinc/13/29/89/295132989.db2.gz OSXMFKANEOELCP-UHFFFAOYSA-N 1 3 339.365 2.593 10 0 EFAEHO NCC(=O)N1CCC[C@H](C[NH2+]C2(c3ccccc3)CCCCC2)C1 ZINC000414699616 303366358 /nfs/dbraw/zinc/36/63/58/303366358.db2.gz FDKIIWPCCMGEEK-QGZVFWFLSA-N 1 3 329.488 2.633 10 0 EFAEHO CN(C)C[C@@H](Cc1ccccc1)[NH2+]C1CCN(c2ccncc2)CC1 ZINC000298610857 311007802 /nfs/dbraw/zinc/00/78/02/311007802.db2.gz ZYEXYGCPLAKCDX-HXUWFJFHSA-N 1 3 338.499 2.813 10 0 EFAEHO CN1CCC[C@H]1CNC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1 ZINC000299259604 311066485 /nfs/dbraw/zinc/06/64/85/311066485.db2.gz UBIPJBHUXZCODE-IBGZPJMESA-N 1 3 344.503 2.931 10 0 EFAEHO C[C@H](C[NH2+][C@H](C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)CN1CCCC1 ZINC000400578828 311970303 /nfs/dbraw/zinc/97/03/03/311970303.db2.gz QAGTZYVCRMEGOD-BRWVUGGUSA-N 1 3 339.524 2.953 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)Nc1ccc2c(c1F)CC[NH2+]C2 ZINC000415963630 312186416 /nfs/dbraw/zinc/18/64/16/312186416.db2.gz VXFQGFLYKDTNSN-UHFFFAOYSA-N 1 3 348.466 2.811 10 0 EFAEHO CCC[N@H+](CC)C[C@@H](C)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415971422 312187712 /nfs/dbraw/zinc/18/77/12/312187712.db2.gz JQVAYFDPDJGNLT-CYBMUJFWSA-N 1 3 336.455 2.713 10 0 EFAEHO CCC[N@@H+](CC)C[C@@H](C)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415971422 312187714 /nfs/dbraw/zinc/18/77/14/312187714.db2.gz JQVAYFDPDJGNLT-CYBMUJFWSA-N 1 3 336.455 2.713 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)N(C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)N(C)C)cc1 ZINC000417318909 312208495 /nfs/dbraw/zinc/20/84/95/312208495.db2.gz ZSAMJTBJGZFCRB-ZZJWQFMZSA-N 1 3 344.503 2.522 10 0 EFAEHO C[C@@H](NC(C)(C)CNC(=O)N(C1CC1)[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000417710869 312259581 /nfs/dbraw/zinc/25/95/81/312259581.db2.gz VHFYKDVDYQKTLE-QAPCUYQASA-N 1 3 344.503 2.652 10 0 EFAEHO C[C@H](NC(C)(C)CNC(=O)N(C1CC1)[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000417710871 312259778 /nfs/dbraw/zinc/25/97/78/312259778.db2.gz VHFYKDVDYQKTLE-YJBOKZPZSA-N 1 3 344.503 2.652 10 0 EFAEHO [NH3+]CCCn1ccc2cc(C(=O)Nc3ccc4c(c3)CNC4)ccc21 ZINC000417826249 312276861 /nfs/dbraw/zinc/27/68/61/312276861.db2.gz DFJCNFCIUJLVHG-UHFFFAOYSA-N 1 3 334.423 2.846 10 0 EFAEHO C[C@H](CCCC[NH3+])NC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000418035674 312313737 /nfs/dbraw/zinc/31/37/37/312313737.db2.gz AVXPBOOMQZQRNY-YLJYHZDGSA-N 1 3 346.519 2.858 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)NC[C@H]([NH3+])c1ccccc1)c1ccco1 ZINC000418168365 312338597 /nfs/dbraw/zinc/33/85/97/312338597.db2.gz OBUFADFEVYCMLT-BHYGNILZSA-N 1 3 344.459 2.708 10 0 EFAEHO CC[C@@H](C)N[C@@H](CNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccco1 ZINC000418171711 312339249 /nfs/dbraw/zinc/33/92/49/312339249.db2.gz VHJLAGCBUPYXKN-BJCAYOAGSA-N 1 3 348.491 2.633 10 0 EFAEHO CC(C)Cc1ccc([C@H](CNC(=O)N[C@@H](C)[C@H](C)[NH3+])N(C)C)cc1 ZINC000418198920 312345630 /nfs/dbraw/zinc/34/56/30/312345630.db2.gz WCBXLXCSHPMQEA-MPGHIAIKSA-N 1 3 334.508 2.523 10 0 EFAEHO CC(C)Cc1ccc([C@H](CNC(=O)N[C@@H](C)[C@@H](C)[NH3+])N(C)C)cc1 ZINC000418198922 312345742 /nfs/dbraw/zinc/34/57/42/312345742.db2.gz WCBXLXCSHPMQEA-VKJFTORMSA-N 1 3 334.508 2.523 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)N[C@@H](C)[C@H](C)[NH3+])N(CC)CC)cc1 ZINC000418221897 312349633 /nfs/dbraw/zinc/34/96/33/312349633.db2.gz WIBLSTNAQVDZST-MPGHIAIKSA-N 1 3 334.508 2.667 10 0 EFAEHO CC[C@@H](NC[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1cccc(OC)c1 ZINC000423378385 312417804 /nfs/dbraw/zinc/41/78/04/312417804.db2.gz FUVLWGUOFBKQDY-CVEARBPZSA-N 1 3 345.409 2.572 10 0 EFAEHO COC(=O)C[C@@H]1CC[C@H]([NH2+]CC2(N)C3CC4CC(C3)CC2C4)[C@@H]1C ZINC000423530301 312430913 /nfs/dbraw/zinc/43/09/13/312430913.db2.gz QZKMTEQAZODVMA-GCOBJAIWSA-N 1 3 334.504 2.707 10 0 EFAEHO CC(C)C[C@H]([NH2+]C1CC(C)(c2ccccc2)C1)C(=O)NCCN(C)C ZINC000459465681 313109131 /nfs/dbraw/zinc/10/91/31/313109131.db2.gz XKOINQRUESZGEW-SCCNAQOGSA-N 1 3 345.531 2.789 10 0 EFAEHO C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](CC(=O)NC[C@H](c2ccccc2)N(C)C)C1 ZINC000475740578 313226229 /nfs/dbraw/zinc/22/62/29/313226229.db2.gz CITAOJFKMZPEKV-SFNKJDCFSA-N 1 3 331.504 2.772 10 0 EFAEHO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](CC(=O)NC[C@H](c2ccccc2)N(C)C)C1 ZINC000475740578 313226234 /nfs/dbraw/zinc/22/62/34/313226234.db2.gz CITAOJFKMZPEKV-SFNKJDCFSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)C[C@H]([NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1)C(=O)NCCN(C)C ZINC000488436747 313484171 /nfs/dbraw/zinc/48/41/71/313484171.db2.gz VGWXEHIXCNCTMA-HRCADAONSA-N 1 3 343.581 2.589 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)Nc1csc2ccccc12 ZINC000525890801 316253292 /nfs/dbraw/zinc/25/32/92/316253292.db2.gz UKRLRWYWHQTNRJ-UHFFFAOYSA-N 1 3 334.489 2.858 10 0 EFAEHO CC(C)C[C@H](NCc1ccc(C(F)F)cc1)C(=O)NCC[NH+](C)C ZINC000525991566 316270053 /nfs/dbraw/zinc/27/00/53/316270053.db2.gz UDVRFCRDCAXHIL-INIZCTEOSA-N 1 3 341.446 2.806 10 0 EFAEHO C[C@]1(C[NH2+]C2CCN(c3ccncc3)CC2)COc2ccccc2O1 ZINC000529637196 316936503 /nfs/dbraw/zinc/93/65/03/316936503.db2.gz PFTZUFVZSXGXLN-FQEVSTJZSA-N 1 3 339.439 2.870 10 0 EFAEHO FC(F)Oc1ccc(CN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)cc1 ZINC000530239925 317089174 /nfs/dbraw/zinc/08/91/74/317089174.db2.gz IVYPFGMXNCIXDD-QGZVFWFLSA-N 1 3 340.414 2.879 10 0 EFAEHO CC(C)N(C)c1ccc(CN2CCC(CO[C@H]3CC[NH2+]C3)CC2)cn1 ZINC000530249280 317091167 /nfs/dbraw/zinc/09/11/67/317091167.db2.gz UPUQYWIIPWRHLP-IBGZPJMESA-N 1 3 346.519 2.517 10 0 EFAEHO COc1c(C)cc(CN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)cc1C ZINC000530248575 317091294 /nfs/dbraw/zinc/09/12/94/317091294.db2.gz MTSQYAUTQKHDBG-LJQANCHMSA-N 1 3 332.488 2.903 10 0 EFAEHO CCOc1cc(CN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)ccc1OC ZINC000530248140 317091494 /nfs/dbraw/zinc/09/14/94/317091494.db2.gz HEVBSAXSHAZCRI-GOSISDBHSA-N 1 3 348.487 2.684 10 0 EFAEHO CC[C@@H]([NH2+]CC1(N2CCCCC2)CCN(C)CC1)C1CCOCC1 ZINC000531981720 317338597 /nfs/dbraw/zinc/33/85/97/317338597.db2.gz CFOTVKGZXCGLKC-LJQANCHMSA-N 1 3 337.552 2.732 10 0 EFAEHO C[C@H]1CCC[C@@](CNC(=O)CCN(C)c2ccncc2)([NH+](C)C)C1 ZINC000540927318 317759057 /nfs/dbraw/zinc/75/90/57/317759057.db2.gz DLNMZBPKHBTRBQ-QFBILLFUSA-N 1 3 332.492 2.535 10 0 EFAEHO C[C@H]([NH2+]CCCCN1C[C@@H](C)O[C@H](C)C1)c1cn2ccccc2n1 ZINC000551308601 318205658 /nfs/dbraw/zinc/20/56/58/318205658.db2.gz HWDGIVKHMYKPKK-ZACQAIPSSA-N 1 3 330.476 2.874 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000552370162 318253857 /nfs/dbraw/zinc/25/38/57/318253857.db2.gz UZKFVMNDHXBFMF-LJQANCHMSA-N 1 3 331.504 2.889 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NCCC3CCCC3)CC2)CC1 ZINC000553305518 318278664 /nfs/dbraw/zinc/27/86/64/318278664.db2.gz VLWZLPGYIPJAAY-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccccc1[C@@H]([C@@H](C)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)N(C)C ZINC000555098155 318345394 /nfs/dbraw/zinc/34/53/94/318345394.db2.gz BKWOAQAPPJENDC-MJQMVNBJSA-N 1 3 331.504 2.833 10 0 EFAEHO Cc1ccccc1[C@@H]([C@@H](C)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)N(C)C ZINC000555098155 318345396 /nfs/dbraw/zinc/34/53/96/318345396.db2.gz BKWOAQAPPJENDC-MJQMVNBJSA-N 1 3 331.504 2.833 10 0 EFAEHO CCCC[N@H+](C)C[C@@H](C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000555154050 318347254 /nfs/dbraw/zinc/34/72/54/318347254.db2.gz NELRGZWITHODIA-NEWSRXKRSA-N 1 3 346.519 2.851 10 0 EFAEHO CCCC[N@@H+](C)C[C@@H](C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000555154050 318347255 /nfs/dbraw/zinc/34/72/55/318347255.db2.gz NELRGZWITHODIA-NEWSRXKRSA-N 1 3 346.519 2.851 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)N1CCCC12CC[NH+](C)CC2 ZINC000563614474 318803085 /nfs/dbraw/zinc/80/30/85/318803085.db2.gz VLSRGONLNLFHRQ-GOSISDBHSA-N 1 3 344.503 2.519 10 0 EFAEHO COc1ccc(CN(C)C)cc1NC(=O)CCN(C)c1cc[nH+]cc1 ZINC000564745533 318887913 /nfs/dbraw/zinc/88/79/13/318887913.db2.gz BWYGRRKBHDVXPS-UHFFFAOYSA-N 1 3 342.443 2.617 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)N1CC[C@]2(C1)CCC[NH2+]C2 ZINC000565954934 319018036 /nfs/dbraw/zinc/01/80/36/319018036.db2.gz ZGTMNXRBLPSBEK-HXUWFJFHSA-N 1 3 341.455 2.710 10 0 EFAEHO C[C@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)C[NH+]1CCCCC1 ZINC000565998504 319021524 /nfs/dbraw/zinc/02/15/24/319021524.db2.gz QUDKVHGMOIGIOX-CQSZACIVSA-N 1 3 348.466 2.715 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)N1CCc2ccccc2[C@H]1CN)C(C)C ZINC000566066988 319028344 /nfs/dbraw/zinc/02/83/44/319028344.db2.gz YFHIKJRJJUZVAD-LJQANCHMSA-N 1 3 346.519 2.763 10 0 EFAEHO FC(F)(F)c1ccc(C2CCN(CCN3CC[NH2+]CC3)CC2)cc1 ZINC000566245200 319051656 /nfs/dbraw/zinc/05/16/56/319051656.db2.gz KMLFEVAPMTWASY-UHFFFAOYSA-N 1 3 341.421 2.790 10 0 EFAEHO CCC[NH+](CCC)CCCC(=O)N1CCc2ccccc2[C@H]1CN ZINC000566295622 319059273 /nfs/dbraw/zinc/05/92/73/319059273.db2.gz BBGZKXYHAWLFGO-LJQANCHMSA-N 1 3 331.504 2.973 10 0 EFAEHO N[C@H]1CCC[C@H]([NH2+]C2CCN(c3ccc(C(F)(F)F)cn3)CC2)C1 ZINC000566480818 319082636 /nfs/dbraw/zinc/08/26/36/319082636.db2.gz AWUMTZZYEHJIFY-ZFWWWQNUSA-N 1 3 342.409 2.929 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)CCN(C)c1cc[nH+]cc1 ZINC000566671743 319100555 /nfs/dbraw/zinc/10/05/55/319100555.db2.gz JCHKARQJHZJQKT-QGZVFWFLSA-N 1 3 340.471 2.545 10 0 EFAEHO CCN(C(=O)[C@H](C)[NH2+]C1CC1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000567046569 319133379 /nfs/dbraw/zinc/13/33/79/319133379.db2.gz HXYTYXWURFWRCV-BXWFABGCSA-N 1 3 329.488 2.811 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[NH2+][C@@H]1C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000567267100 319156209 /nfs/dbraw/zinc/15/62/09/319156209.db2.gz SEZGODUCFXNQCC-KCITZHQASA-N 1 3 329.488 2.668 10 0 EFAEHO [NH3+][C@@H]1CCC[C@@H]1N[C@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 ZINC000567639695 319191438 /nfs/dbraw/zinc/19/14/38/319191438.db2.gz LKRCUBGCNUXRQZ-MAZHCROVSA-N 1 3 332.398 2.613 10 0 EFAEHO CC[N@H+](Cc1ccc(C(=O)N[C@@H]2CNCCC2(F)F)cc1)C(C)C ZINC000567845186 319216777 /nfs/dbraw/zinc/21/67/77/319216777.db2.gz NMCZFZIOFPUSBL-MRXNPFEDSA-N 1 3 339.430 2.644 10 0 EFAEHO CC[N@@H+](Cc1ccc(C(=O)N[C@@H]2CNCCC2(F)F)cc1)C(C)C ZINC000567845186 319216781 /nfs/dbraw/zinc/21/67/81/319216781.db2.gz NMCZFZIOFPUSBL-MRXNPFEDSA-N 1 3 339.430 2.644 10 0 EFAEHO CC(C)OC[C@H](O)CNCc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000569449081 319380987 /nfs/dbraw/zinc/38/09/87/319380987.db2.gz IHWPWIBGGQCXTO-YLJYHZDGSA-N 1 3 334.504 2.794 10 0 EFAEHO CC(C)OC[C@H](O)CNCc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC000569449081 319380989 /nfs/dbraw/zinc/38/09/89/319380989.db2.gz IHWPWIBGGQCXTO-YLJYHZDGSA-N 1 3 334.504 2.794 10 0 EFAEHO OCC1(CN[C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)CC2(CCC2)C1 ZINC000572712671 319697185 /nfs/dbraw/zinc/69/71/85/319697185.db2.gz PAAHQTWDGIUHTH-UWJYYQICSA-N 1 3 342.483 2.775 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3CC(C)=C[C@@H](C)C3)CC2)CC1 ZINC000576477258 320019597 /nfs/dbraw/zinc/01/95/97/320019597.db2.gz CQNWVOMFNIFOKS-MRXNPFEDSA-N 1 3 333.520 2.607 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@H]3CC34CCCC4)CC2)CC1 ZINC000577384712 320106005 /nfs/dbraw/zinc/10/60/05/320106005.db2.gz HKCYMGSCWVEEBV-SFHVURJKSA-N 1 3 333.520 2.632 10 0 EFAEHO [NH3+]C[C@H]1CC[C@H](NC(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000577604630 320126497 /nfs/dbraw/zinc/12/64/97/320126497.db2.gz OYNGGHMNBGLKDV-LPHOPBHVSA-N 1 3 344.503 2.599 10 0 EFAEHO C[NH+](C)CC[C@@H](NC(=O)N1CCc2ccccc2[C@@H]1CN)C(C)(C)C ZINC000577847609 320150469 /nfs/dbraw/zinc/15/04/69/320150469.db2.gz YLIDETAHCBWGLC-ZWKOTPCHSA-N 1 3 346.519 2.621 10 0 EFAEHO CC(C)N1C[C@@H](N[C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1=O ZINC000578768444 320238340 /nfs/dbraw/zinc/23/83/40/320238340.db2.gz BTDQUZNHSSQIOB-MOPGFXCFSA-N 1 3 341.499 2.783 10 0 EFAEHO CC(C)N1C[C@@H](N[C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1=O ZINC000578768444 320238342 /nfs/dbraw/zinc/23/83/42/320238342.db2.gz BTDQUZNHSSQIOB-MOPGFXCFSA-N 1 3 341.499 2.783 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NCC[C@H](C)[NH+]1CCCCC1 ZINC000184866098 323376118 /nfs/dbraw/zinc/37/61/18/323376118.db2.gz VLOSIBXCTGQNGI-DLBZAZTESA-N 1 3 326.529 2.526 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NCC[C@H](C)[NH+]1CCCCC1 ZINC000184866079 323376455 /nfs/dbraw/zinc/37/64/55/323376455.db2.gz VLOSIBXCTGQNGI-IRXDYDNUSA-N 1 3 326.529 2.526 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185733293 323396663 /nfs/dbraw/zinc/39/66/63/323396663.db2.gz XEGWWVLMMLZQGB-QWFCFKBJSA-N 1 3 346.515 2.977 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185733293 323396667 /nfs/dbraw/zinc/39/66/67/323396667.db2.gz XEGWWVLMMLZQGB-QWFCFKBJSA-N 1 3 346.515 2.977 10 0 EFAEHO Cc1ccc(OC[C@H](O)C[NH2+][C@H](C)[C@@H]2CCCN(C3CCC3)C2)cc1 ZINC000185733293 323396671 /nfs/dbraw/zinc/39/66/71/323396671.db2.gz XEGWWVLMMLZQGB-QWFCFKBJSA-N 1 3 346.515 2.977 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185733255 323396688 /nfs/dbraw/zinc/39/66/88/323396688.db2.gz XEGWWVLMMLZQGB-NLWGTHIKSA-N 1 3 346.515 2.977 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000185733255 323396691 /nfs/dbraw/zinc/39/66/91/323396691.db2.gz XEGWWVLMMLZQGB-NLWGTHIKSA-N 1 3 346.515 2.977 10 0 EFAEHO Cc1ccc(OC[C@H](O)C[NH2+][C@@H](C)[C@@H]2CCCN(C3CCC3)C2)cc1 ZINC000185733255 323396694 /nfs/dbraw/zinc/39/66/94/323396694.db2.gz XEGWWVLMMLZQGB-NLWGTHIKSA-N 1 3 346.515 2.977 10 0 EFAEHO [NH3+]C1(CNCc2ccc3c[nH]nc3c2)CCN(Cc2ccccc2)CC1 ZINC000581298307 324346064 /nfs/dbraw/zinc/34/60/64/324346064.db2.gz WRZIEEFQWUAFAL-UHFFFAOYSA-N 1 3 349.482 2.646 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)Nc1ccc2c(c1)CCCC2 ZINC000583608604 324839309 /nfs/dbraw/zinc/83/93/09/324839309.db2.gz POGDYXOXCGEAHS-UHFFFAOYSA-N 1 3 332.492 2.523 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CCN1C ZINC000124635909 473277500 /nfs/dbraw/zinc/27/75/00/473277500.db2.gz MBGBYOKQQJHKLJ-MISYRCLQSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CCN1C ZINC000124635909 473277506 /nfs/dbraw/zinc/27/75/06/473277506.db2.gz MBGBYOKQQJHKLJ-MISYRCLQSA-N 1 3 343.515 2.840 10 0 EFAEHO Cc1ccccc1C(=O)NC1CC[NH+](CC[C@@H]2CCCN2C)CC1 ZINC000124930136 473326935 /nfs/dbraw/zinc/32/69/35/473326935.db2.gz XKTBTJPRUTXTLF-SFHVURJKSA-N 1 3 329.488 2.674 10 0 EFAEHO CO[C@H]1C[C@@H](N(C)Cc2ccccc2C[N@H+](C)[C@H]2C[C@@H](OC)C2)C1 ZINC000510111471 478960701 /nfs/dbraw/zinc/96/07/01/478960701.db2.gz DMDSDVUKEWUNMN-XLLXOSNRSA-N 1 3 332.488 2.905 10 0 EFAEHO CO[C@H]1C[C@@H](N(C)Cc2ccccc2C[N@@H+](C)[C@H]2C[C@@H](OC)C2)C1 ZINC000510111471 478960707 /nfs/dbraw/zinc/96/07/07/478960707.db2.gz DMDSDVUKEWUNMN-XLLXOSNRSA-N 1 3 332.488 2.905 10 0 EFAEHO C[C@@H]1C[C@H](NCc2ccccc2N(C)C2CC[NH+](C)CC2)[C@H](C)O1 ZINC000631223303 479968158 /nfs/dbraw/zinc/96/81/58/479968158.db2.gz SYGQYVXUXDKUBP-GJYPPUQNSA-N 1 3 331.504 2.873 10 0 EFAEHO CCN1CC[C@@H](C[NH2+]Cc2ccc(I)cc2)C1 ZINC000088174359 472344583 /nfs/dbraw/zinc/34/45/83/472344583.db2.gz WMPVNKUBIFJOPA-ZDUSSCGKSA-N 1 3 344.240 2.723 10 0 EFAEHO Cc1noc(C)c1CNCC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000069455213 472347642 /nfs/dbraw/zinc/34/76/42/472347642.db2.gz YZWHQCPMXGTFND-FQEVSTJZSA-N 1 3 343.471 2.827 10 0 EFAEHO C[N@@H+]1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000069520968 472363128 /nfs/dbraw/zinc/36/31/28/472363128.db2.gz ZSLSOKYNNYSTII-PMACEKPBSA-N 1 3 341.499 2.981 10 0 EFAEHO C[N@H+]1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000069520968 472363130 /nfs/dbraw/zinc/36/31/30/472363130.db2.gz ZSLSOKYNNYSTII-PMACEKPBSA-N 1 3 341.499 2.981 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H](C)C[C@H](C)O)CC1 ZINC000088728113 472382100 /nfs/dbraw/zinc/38/21/00/472382100.db2.gz JJTGEMDJUOBYFS-ROUUACIJSA-N 1 3 333.520 2.715 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H]2CCCC[C@H]2O)CC1 ZINC000088728439 472382262 /nfs/dbraw/zinc/38/22/62/472382262.db2.gz HCAZAZOMPLQOCG-PZJWPPBQSA-N 1 3 345.531 2.859 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000057171710 472390715 /nfs/dbraw/zinc/39/07/15/472390715.db2.gz QHGZLGDWMNOKQE-UYAOXDASSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000057171710 472390720 /nfs/dbraw/zinc/39/07/20/472390720.db2.gz QHGZLGDWMNOKQE-UYAOXDASSA-N 1 3 343.515 2.889 10 0 EFAEHO Cc1cc(CN(C)CC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)on1 ZINC000069706247 472404773 /nfs/dbraw/zinc/40/47/73/472404773.db2.gz DOGOJNDMTOTPGE-HXUWFJFHSA-N 1 3 343.471 2.860 10 0 EFAEHO CC(C)N1CCC([NH2+][C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)cc2)CC1 ZINC000097082167 472435725 /nfs/dbraw/zinc/43/57/25/472435725.db2.gz MLTWGLGTTWCIOK-PKOBYXMFSA-N 1 3 333.451 2.560 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000057798354 472477290 /nfs/dbraw/zinc/47/72/90/472477290.db2.gz TVJNCYPZPBAEJX-IBGZPJMESA-N 1 3 344.503 2.566 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@@](C)(O)C2)CC1 ZINC000129484027 472546839 /nfs/dbraw/zinc/54/68/39/472546839.db2.gz YRXRMWKTFIGGDO-HXUWFJFHSA-N 1 3 331.504 2.565 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@@](C)(O)C2)CC1 ZINC000129484027 472546842 /nfs/dbraw/zinc/54/68/42/472546842.db2.gz YRXRMWKTFIGGDO-HXUWFJFHSA-N 1 3 331.504 2.565 10 0 EFAEHO C[C@@H](CN[C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000631269183 479996717 /nfs/dbraw/zinc/99/67/17/479996717.db2.gz IGVHDCXCVKEBLJ-GOEBONIOSA-N 1 3 338.517 2.656 10 0 EFAEHO C[C@@H](CN[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000631269183 479996723 /nfs/dbraw/zinc/99/67/23/479996723.db2.gz IGVHDCXCVKEBLJ-GOEBONIOSA-N 1 3 338.517 2.656 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)N(C)C)cc1 ZINC000119691036 472575380 /nfs/dbraw/zinc/57/53/80/472575380.db2.gz KKCBVBIHNAJJLU-WDSOQIARSA-N 1 3 346.519 2.626 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N[C@H]2C[N@@H+](C(C)C)C[C@@H]2C)N(C)C)cc1 ZINC000119691036 472575388 /nfs/dbraw/zinc/57/53/88/472575388.db2.gz KKCBVBIHNAJJLU-WDSOQIARSA-N 1 3 346.519 2.626 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)N(C)C ZINC000131644660 472682840 /nfs/dbraw/zinc/68/28/40/472682840.db2.gz PTWKWQXRPKWVDP-XIRDDKMYSA-N 1 3 337.533 2.833 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)N(C)C ZINC000131644660 472682842 /nfs/dbraw/zinc/68/28/42/472682842.db2.gz PTWKWQXRPKWVDP-XIRDDKMYSA-N 1 3 337.533 2.833 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000105148821 472728512 /nfs/dbraw/zinc/72/85/12/472728512.db2.gz KHMZDFLJMHJZLR-ROUUACIJSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[NH+](CC)[C@@H](C)CNC(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000078545689 472732161 /nfs/dbraw/zinc/73/21/61/472732161.db2.gz DFDFLAGKFDLTLV-HKUYNNGSSA-N 1 3 346.519 2.853 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CN1CCC(C[NH+]2CCCC2)CC1 ZINC000047972298 472790489 /nfs/dbraw/zinc/79/04/89/472790489.db2.gz UKDASSOQCYQWQR-HXUWFJFHSA-N 1 3 346.515 2.851 10 0 EFAEHO CN(C)C[C@@H](NC(=O)NC1CCC(C[NH+](C)C)CC1)c1ccccc1 ZINC000157207791 472796748 /nfs/dbraw/zinc/79/67/48/472796748.db2.gz YUBVNTAIDGDBBK-NKELODKYSA-N 1 3 346.519 2.709 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)N2CCCC[C@H]2CN(C)C)CC1 ZINC000073380201 472803914 /nfs/dbraw/zinc/80/39/14/472803914.db2.gz TUMQAUSYEOONJQ-SFHVURJKSA-N 1 3 344.503 2.549 10 0 EFAEHO C[N@@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000157304200 472805945 /nfs/dbraw/zinc/80/59/45/472805945.db2.gz DNIFOMYMLOATLK-WOJBJXKFSA-N 1 3 341.499 2.839 10 0 EFAEHO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000157304200 472805947 /nfs/dbraw/zinc/80/59/47/472805947.db2.gz DNIFOMYMLOATLK-WOJBJXKFSA-N 1 3 341.499 2.839 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C)C[C@@H]2CCC[C@@H]2O)CC1 ZINC000091899303 472824532 /nfs/dbraw/zinc/82/45/32/472824532.db2.gz LBMUHPHFZVWDLJ-FPOVZHCZSA-N 1 3 345.531 2.811 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C)C[C@@H]2CCC[C@@H]2O)CC1 ZINC000091899303 472824537 /nfs/dbraw/zinc/82/45/37/472824537.db2.gz LBMUHPHFZVWDLJ-FPOVZHCZSA-N 1 3 345.531 2.811 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NCC(C)(C)N2CCCCC2)CC1 ZINC000157670590 472846733 /nfs/dbraw/zinc/84/67/33/472846733.db2.gz QNCCWNDYBQVROP-UHFFFAOYSA-N 1 3 338.540 2.672 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)N[C@H](CN(C)C)c2ccccc2)CC1 ZINC000157691416 472847913 /nfs/dbraw/zinc/84/79/13/472847913.db2.gz RVBADSWIIGPRQV-LJQANCHMSA-N 1 3 346.519 2.711 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCc2ccccc2C[NH+]2CCCC2)C1 ZINC000052519348 473116825 /nfs/dbraw/zinc/11/68/25/473116825.db2.gz URMOMUDNSOFLSY-LJQANCHMSA-N 1 3 344.503 2.566 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCc2ccccc2C[NH+](CC)CC)C1 ZINC000052519276 473117322 /nfs/dbraw/zinc/11/73/22/473117322.db2.gz LNUUUBIEGINZLD-IBGZPJMESA-N 1 3 346.519 2.812 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C)C[C@@H]2CCOC2)CC1 ZINC000093839955 473151423 /nfs/dbraw/zinc/15/14/23/473151423.db2.gz GQDTXQBBBQOTPA-SFHVURJKSA-N 1 3 331.504 2.687 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C)C[C@@H]2CCOC2)CC1 ZINC000093839955 473151431 /nfs/dbraw/zinc/15/14/31/473151431.db2.gz GQDTXQBBBQOTPA-SFHVURJKSA-N 1 3 331.504 2.687 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCCNC(=O)c1ccccc1OCCN(C)C ZINC000123688357 473174498 /nfs/dbraw/zinc/17/44/98/473174498.db2.gz RKIZYTQXXRIWBE-KRWDZBQOSA-N 1 3 347.503 2.621 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1ccccc1OCCN(C)C ZINC000123688357 473174503 /nfs/dbraw/zinc/17/45/03/473174503.db2.gz RKIZYTQXXRIWBE-KRWDZBQOSA-N 1 3 347.503 2.621 10 0 EFAEHO CC1(C(=O)N2CCN3CCC[C@H]3C2)CC[NH+](Cc2ccccc2)CC1 ZINC000185312438 473392529 /nfs/dbraw/zinc/39/25/29/473392529.db2.gz BFUULOVMZJTGPX-IBGZPJMESA-N 1 3 341.499 2.595 10 0 EFAEHO COc1ccccc1C[C@H]([NH2+]C1CCN(CCN(C)C)CC1)C(C)C ZINC000150997762 473394453 /nfs/dbraw/zinc/39/44/53/473394453.db2.gz ANYTVOZCEZNXFA-FQEVSTJZSA-N 1 3 347.547 2.878 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NCCN2CCCC[C@@H]2CC)CC1 ZINC000113609036 473409306 /nfs/dbraw/zinc/40/93/06/473409306.db2.gz SUQCINUYXOPODW-SFHVURJKSA-N 1 3 338.540 2.672 10 0 EFAEHO CCN1CC[C@H](C[NH2+][C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)C1 ZINC000163226204 473424338 /nfs/dbraw/zinc/42/43/38/473424338.db2.gz PGCKBMXEEPENHR-LSDHHAIUSA-N 1 3 330.476 2.963 10 0 EFAEHO CCN1CC[C@H](C[NH2+][C@@H](C)c2ccc(OC)c(Cn3cccn3)c2)C1 ZINC000163290193 473430944 /nfs/dbraw/zinc/43/09/44/473430944.db2.gz OVEOFSNYGVWLMN-DLBZAZTESA-N 1 3 342.487 2.932 10 0 EFAEHO C[NH+]1CCC(C(=O)N[C@@H]2CCCCCN(Cc3ccccc3)C2)CC1 ZINC000633889467 480039409 /nfs/dbraw/zinc/03/94/09/480039409.db2.gz SPGZXYPDHSVUBN-HXUWFJFHSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)[NH+]1CCC(NC(=O)CN2CCC[C@@]3(CC=CCC3)C2)CC1 ZINC000114494624 473476313 /nfs/dbraw/zinc/47/63/13/473476313.db2.gz HRZKOGLYKJPDAD-FQEVSTJZSA-N 1 3 333.520 2.798 10 0 EFAEHO CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N1CCN2CCC[C@@H]2C1 ZINC000171900392 473477971 /nfs/dbraw/zinc/47/79/71/473477971.db2.gz ZROVYVFRJVWOSB-LJQANCHMSA-N 1 3 344.503 2.516 10 0 EFAEHO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)N1CCN2CCC[C@@H]2C1 ZINC000171900392 473477975 /nfs/dbraw/zinc/47/79/75/473477975.db2.gz ZROVYVFRJVWOSB-LJQANCHMSA-N 1 3 344.503 2.516 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000171898041 473478127 /nfs/dbraw/zinc/47/81/27/473478127.db2.gz KGXHFJBSFNWPFC-RTBURBONSA-N 1 3 344.503 2.559 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000171898041 473478129 /nfs/dbraw/zinc/47/81/29/473478129.db2.gz KGXHFJBSFNWPFC-RTBURBONSA-N 1 3 344.503 2.559 10 0 EFAEHO COc1ccc([C@@H](C)[NH2+]C[C@H]2CCN(C3CC3)C2)cc1NC(C)=O ZINC000152454864 473564770 /nfs/dbraw/zinc/56/47/70/473564770.db2.gz SLUXFFVOGXOOEW-UKRRQHHQSA-N 1 3 331.460 2.789 10 0 EFAEHO O=C(c1ccccc1)N1CCC([NH2+][C@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000178954517 473599189 /nfs/dbraw/zinc/59/91/89/473599189.db2.gz CNXIEXNFYHWZON-RBUKOAKNSA-N 1 3 327.472 2.508 10 0 EFAEHO O=C(c1ccccc1)N1CCC(N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000178954517 473599194 /nfs/dbraw/zinc/59/91/94/473599194.db2.gz CNXIEXNFYHWZON-RBUKOAKNSA-N 1 3 327.472 2.508 10 0 EFAEHO O=C(c1ccccc1)N1CCC(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)CC1 ZINC000178954517 473599207 /nfs/dbraw/zinc/59/92/07/473599207.db2.gz CNXIEXNFYHWZON-RBUKOAKNSA-N 1 3 327.472 2.508 10 0 EFAEHO C[C@@H]1CC[N@@H+](CC(=O)NC2CCN(C3CC3)CC2)[C@@H]2CCCC[C@@H]12 ZINC000620278090 480052289 /nfs/dbraw/zinc/05/22/89/480052289.db2.gz BEJXZWMXJPATNA-AYOQOUSVSA-N 1 3 333.520 2.630 10 0 EFAEHO C[C@H](NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)C(C)(C)C[NH+](C)C ZINC000179194671 473651630 /nfs/dbraw/zinc/65/16/30/473651630.db2.gz ITJPEKASUGVVHM-CGTJXYLNSA-N 1 3 346.519 2.707 10 0 EFAEHO CC(C)[NH+](CCNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)C(C)C ZINC000179270754 473667471 /nfs/dbraw/zinc/66/74/71/473667471.db2.gz BNIPALYSHWMSHB-RBUKOAKNSA-N 1 3 346.519 2.850 10 0 EFAEHO C[C@@H]1CC[N@H+](CC(=O)NC2CCN(C3CC3)CC2)[C@@H]2CCCC[C@@H]12 ZINC000620278090 480052281 /nfs/dbraw/zinc/05/22/81/480052281.db2.gz BEJXZWMXJPATNA-AYOQOUSVSA-N 1 3 333.520 2.630 10 0 EFAEHO CN1CC[C@H](NC(=O)NCC[N@H+](C)C2CCCC2)[C@H]1c1ccccc1 ZINC000245624275 473729224 /nfs/dbraw/zinc/72/92/24/473729224.db2.gz FZZQGZRNPVTVEP-RBUKOAKNSA-N 1 3 344.503 2.605 10 0 EFAEHO CN1CC[C@H](NC(=O)NCC[N@@H+](C)C2CCCC2)[C@H]1c1ccccc1 ZINC000245624275 473729228 /nfs/dbraw/zinc/72/92/28/473729228.db2.gz FZZQGZRNPVTVEP-RBUKOAKNSA-N 1 3 344.503 2.605 10 0 EFAEHO CCC[NH+](CCC)CCCNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000246181573 473793339 /nfs/dbraw/zinc/79/33/39/473793339.db2.gz LVUDSMKRDDTLPV-DLBZAZTESA-N 1 3 326.529 2.623 10 0 EFAEHO C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)C(=O)N1CCCC1 ZINC000281662631 473799121 /nfs/dbraw/zinc/79/91/21/473799121.db2.gz QGUAKZXZDWTNHF-FRYIKTPZSA-N 1 3 341.499 2.783 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CC1 ZINC000180102101 473800387 /nfs/dbraw/zinc/80/03/87/473800387.db2.gz JNGWPKDJOWNPRR-RBUKOAKNSA-N 1 3 329.488 2.668 10 0 EFAEHO CS[C@@H](CO)[C@H](C)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180146115 473809528 /nfs/dbraw/zinc/80/95/28/473809528.db2.gz CVJRKOLTCYALQC-RMPXNZIMSA-N 1 3 334.529 2.884 10 0 EFAEHO CS[C@@H](CO)[C@H](C)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180146115 473809533 /nfs/dbraw/zinc/80/95/33/473809533.db2.gz CVJRKOLTCYALQC-RMPXNZIMSA-N 1 3 334.529 2.884 10 0 EFAEHO CN1CC[C@H](NC(=O)c2ccc(C[NH+](C)C)cc2)[C@@H]1c1ccccc1 ZINC000180177724 473819917 /nfs/dbraw/zinc/81/99/17/473819917.db2.gz QQSYNXWRKHLISE-PMACEKPBSA-N 1 3 337.467 2.923 10 0 EFAEHO C[C@H](CNC(=O)NC1CCC(C[NH+](C)C)CC1)N1CCC[C@@H](C)C1 ZINC000246338086 473833620 /nfs/dbraw/zinc/83/36/20/473833620.db2.gz UHAHAGQZKZRYJN-MRLCAUJQSA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H]1CCC[C@](CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)([NH+](C)C)C1 ZINC000246450975 473867516 /nfs/dbraw/zinc/86/75/16/473867516.db2.gz UPNPRZUVJZWTND-NTDBWNAOSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@@H]1CCC[C@](CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)([NH+](C)C)C1 ZINC000246450964 473868135 /nfs/dbraw/zinc/86/81/35/473868135.db2.gz UPNPRZUVJZWTND-DFEOGRTESA-N 1 3 338.540 2.621 10 0 EFAEHO CCN1CC[C@@H](C[NH2+]C[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000246937718 474009699 /nfs/dbraw/zinc/00/96/99/474009699.db2.gz PCEBWMWZKLHUOZ-CVEARBPZSA-N 1 3 325.497 2.565 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)C(C)C ZINC000174352671 474027566 /nfs/dbraw/zinc/02/75/66/474027566.db2.gz JCSHUBFVLJHGCW-IAGOWNOFSA-N 1 3 326.529 2.619 10 0 EFAEHO CN1CC[C@H](NC(=O)NCC2([NH+](C)C)CCCC2)[C@H]1c1ccccc1 ZINC000270330507 474076064 /nfs/dbraw/zinc/07/60/64/474076064.db2.gz HVQRKVNWDUFMRZ-ZWKOTPCHSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H]1C[N@H+](C)CC[C@H]1N(C)C(=O)c1cccc(CN2CCCC2)c1 ZINC000247256863 474102679 /nfs/dbraw/zinc/10/26/79/474102679.db2.gz DVQJVPFXQDXBAF-VQIMIIECSA-N 1 3 329.488 2.695 10 0 EFAEHO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cccc(CN2CCCC2)c1 ZINC000247256863 474102687 /nfs/dbraw/zinc/10/26/87/474102687.db2.gz DVQJVPFXQDXBAF-VQIMIIECSA-N 1 3 329.488 2.695 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N[C@@H]2C[N@H+](C(C)C)C[C@H]2C)N(C)C)cc1 ZINC000247282802 474107765 /nfs/dbraw/zinc/10/77/65/474107765.db2.gz KKCBVBIHNAJJLU-QRQLOZEOSA-N 1 3 346.519 2.626 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@H]2C)N(C)C)cc1 ZINC000247282802 474107769 /nfs/dbraw/zinc/10/77/69/474107769.db2.gz KKCBVBIHNAJJLU-QRQLOZEOSA-N 1 3 346.519 2.626 10 0 EFAEHO CCN1CCC[C@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC000188532707 474120990 /nfs/dbraw/zinc/12/09/90/474120990.db2.gz VNJBCUMCPHRPJG-IBGZPJMESA-N 1 3 343.515 2.889 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)C2C[C@@H](c3ccccc3)OC2=O)CC1 ZINC000289074553 474139759 /nfs/dbraw/zinc/13/97/59/474139759.db2.gz AMIVKSKMFAYGMF-ROUUACIJSA-N 1 3 344.455 2.529 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)C2C[C@@H](c3ccccc3)OC2=O)CC1 ZINC000289074546 474140288 /nfs/dbraw/zinc/14/02/88/474140288.db2.gz AMIVKSKMFAYGMF-MSOLQXFVSA-N 1 3 344.455 2.529 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000247483972 474160609 /nfs/dbraw/zinc/16/06/09/474160609.db2.gz KGXHFJBSFNWPFC-RBUKOAKNSA-N 1 3 344.503 2.559 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000247483972 474160618 /nfs/dbraw/zinc/16/06/18/474160618.db2.gz KGXHFJBSFNWPFC-RBUKOAKNSA-N 1 3 344.503 2.559 10 0 EFAEHO C[C@H]([NH2+]C(C)(C)CNC(=O)N1CCN2CCC[C@H]2C1)c1ccccc1 ZINC000247497130 474165525 /nfs/dbraw/zinc/16/55/25/474165525.db2.gz USJOXVOTRSUITI-WMZOPIPTSA-N 1 3 344.503 2.605 10 0 EFAEHO CC(C)(C)OC(=O)N1CCC[C@@H](C[NH2+]CCCN2CCCC2)C1 ZINC000227657729 474247066 /nfs/dbraw/zinc/24/70/66/474247066.db2.gz CMRHFOOSLUOWBM-INIZCTEOSA-N 1 3 325.497 2.709 10 0 EFAEHO O=C1OCC[C@@H]1CC[N@@H+]1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1 ZINC000248161045 474272618 /nfs/dbraw/zinc/27/26/18/474272618.db2.gz SCQSEXHVRHZNMB-SLFFLAALSA-N 1 3 342.483 2.926 10 0 EFAEHO O=C1OCC[C@@H]1CC[N@H+]1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1 ZINC000248161045 474272627 /nfs/dbraw/zinc/27/26/27/474272627.db2.gz SCQSEXHVRHZNMB-SLFFLAALSA-N 1 3 342.483 2.926 10 0 EFAEHO c1cn(CCC[NH2+][C@H]2CCC[C@H]3CN(Cc4ccccc4)C[C@@H]32)nn1 ZINC000248450278 474326710 /nfs/dbraw/zinc/32/67/10/474326710.db2.gz FMPMBFNUZVBUHP-UFYCRDLUSA-N 1 3 339.487 2.559 10 0 EFAEHO CCN1CC[C@@H](C[NH2+][C@H](CCn2cncn2)c2ccc(C)cc2)C1 ZINC000275867107 474345870 /nfs/dbraw/zinc/34/58/70/474345870.db2.gz NVENOWYERSREEA-PKOBYXMFSA-N 1 3 327.476 2.649 10 0 EFAEHO CC[N@@H+]1CC[C@@H](CN[C@H](CCn2cncn2)c2ccc(C)cc2)C1 ZINC000275867107 474345874 /nfs/dbraw/zinc/34/58/74/474345874.db2.gz NVENOWYERSREEA-PKOBYXMFSA-N 1 3 327.476 2.649 10 0 EFAEHO CC[N@H+]1CC[C@@H](CN[C@H](CCn2cncn2)c2ccc(C)cc2)C1 ZINC000275867107 474345883 /nfs/dbraw/zinc/34/58/83/474345883.db2.gz NVENOWYERSREEA-PKOBYXMFSA-N 1 3 327.476 2.649 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)NC2CC[NH+](C3CCCC3)CC2)CCN1C ZINC000176021032 474363935 /nfs/dbraw/zinc/36/39/35/474363935.db2.gz WWUYCTAYIQHWAM-YJBOKZPZSA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)C2CCN(Cc3ccccc3)CC2)CC[N@@H+]1C ZINC000265915179 474384410 /nfs/dbraw/zinc/38/44/10/474384410.db2.gz AJQSERUCNZSYIB-YLJYHZDGSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)C2CCN(Cc3ccccc3)CC2)CC[N@H+]1C ZINC000265915179 474384419 /nfs/dbraw/zinc/38/44/19/474384419.db2.gz AJQSERUCNZSYIB-YLJYHZDGSA-N 1 3 343.515 2.840 10 0 EFAEHO CCO[C@@H]1C[C@](O)(CNC2CC[NH+](C3CCCCC3)CC2)C1(C)C ZINC000189432617 474394816 /nfs/dbraw/zinc/39/48/16/474394816.db2.gz AXQSFYRXQZZZKL-QUCCMNQESA-N 1 3 338.536 2.939 10 0 EFAEHO CCO[C@@H]1C[C@](O)(C[NH2+]C2CCN(C3CCCCC3)CC2)C1(C)C ZINC000189432617 474394823 /nfs/dbraw/zinc/39/48/23/474394823.db2.gz AXQSFYRXQZZZKL-QUCCMNQESA-N 1 3 338.536 2.939 10 0 EFAEHO CCO[C@H]1C[C@](O)(CNC2CC[NH+](C3CCCCC3)CC2)C1(C)C ZINC000189432636 474395981 /nfs/dbraw/zinc/39/59/81/474395981.db2.gz AXQSFYRXQZZZKL-ICSRJNTNSA-N 1 3 338.536 2.939 10 0 EFAEHO CCO[C@H]1C[C@](O)(C[NH2+]C2CCN(C3CCCCC3)CC2)C1(C)C ZINC000189432636 474395987 /nfs/dbraw/zinc/39/59/87/474395987.db2.gz AXQSFYRXQZZZKL-ICSRJNTNSA-N 1 3 338.536 2.939 10 0 EFAEHO Cc1nnc(CCN[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000289830045 474445541 /nfs/dbraw/zinc/44/55/41/474445541.db2.gz PJPLSGLYWOUIJJ-RHSMWYFYSA-N 1 3 330.501 2.889 10 0 EFAEHO Cc1nnc(CCN[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000289830045 474445548 /nfs/dbraw/zinc/44/55/48/474445548.db2.gz PJPLSGLYWOUIJJ-RHSMWYFYSA-N 1 3 330.501 2.889 10 0 EFAEHO NC[C@H](NC(=O)[C@@H]1C[C@H]2CCCC[C@H]2[NH2+]1)c1ccc2ccccc2c1 ZINC000248873337 474465854 /nfs/dbraw/zinc/46/58/54/474465854.db2.gz IMXJTAIQEZJJFD-LMCOJAPRSA-N 1 3 337.467 2.877 10 0 EFAEHO CCN1CCC[C@@H]1CN(C)C(=O)NCCC[NH+](C(C)C)C(C)C ZINC000176435149 474473371 /nfs/dbraw/zinc/47/33/71/474473371.db2.gz JPYKQSOKIKGOFM-QGZVFWFLSA-N 1 3 326.529 2.621 10 0 EFAEHO C[C@@H](NC(=O)CC1CCN(C)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000291623210 474634459 /nfs/dbraw/zinc/63/44/59/474634459.db2.gz HBUSCFQYXBFKAD-XLIONFOSSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@@H](NC(=O)CC1CCN(C)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000291623210 474634464 /nfs/dbraw/zinc/63/44/64/474634464.db2.gz HBUSCFQYXBFKAD-XLIONFOSSA-N 1 3 343.515 2.745 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@H](C)[C@H]2C[C@@H]2c2ccc(OC)cc2)CC1 ZINC000284442532 474640624 /nfs/dbraw/zinc/64/06/24/474640624.db2.gz SAQYFLZUVUUSHI-DUXKGJEZSA-N 1 3 345.531 2.804 10 0 EFAEHO Cc1nc(F)ccc1C[NH2+]CCc1ccc(OCCN(C)C)cc1 ZINC000278513349 474672698 /nfs/dbraw/zinc/67/26/98/474672698.db2.gz PBYHNGWHSUDRPA-UHFFFAOYSA-N 1 3 331.435 2.802 10 0 EFAEHO CC[NH+](CC)CC1CCN(Cc2ccc(OCC(=O)OC)cc2)CC1 ZINC000340917134 474774973 /nfs/dbraw/zinc/77/49/73/474774973.db2.gz NKVNEOZXMWYRBD-UHFFFAOYSA-N 1 3 348.487 2.792 10 0 EFAEHO COCCN1CC[C@H](Nc2ccc(OCC[N@@H+]3CC[C@@H](C)C3)cc2)C1 ZINC000273248436 474801309 /nfs/dbraw/zinc/80/13/09/474801309.db2.gz ZZLUSUQZYDFDAA-MJGOQNOKSA-N 1 3 347.503 2.540 10 0 EFAEHO COCCN1CC[C@H](Nc2ccc(OCC[N@H+]3CC[C@@H](C)C3)cc2)C1 ZINC000273248436 474801316 /nfs/dbraw/zinc/80/13/16/474801316.db2.gz ZZLUSUQZYDFDAA-MJGOQNOKSA-N 1 3 347.503 2.540 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CCN1C ZINC000340981483 474842972 /nfs/dbraw/zinc/84/29/72/474842972.db2.gz FMBZOAPVHOVVPZ-APWZRJJASA-N 1 3 344.503 2.564 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CCN1C ZINC000340981484 474844413 /nfs/dbraw/zinc/84/44/13/474844413.db2.gz FMBZOAPVHOVVPZ-LPHOPBHVSA-N 1 3 344.503 2.564 10 0 EFAEHO CN1CCC(n2cc(NC(=O)CC[N@H+](C)C3CCCCC3)cn2)CC1 ZINC000634096341 480129601 /nfs/dbraw/zinc/12/96/01/480129601.db2.gz UZEKQOOPXXVXAB-UHFFFAOYSA-N 1 3 347.507 2.743 10 0 EFAEHO CN1CCC(n2cc(NC(=O)CC[N@@H+](C)C3CCCCC3)cn2)CC1 ZINC000634096341 480129606 /nfs/dbraw/zinc/12/96/06/480129606.db2.gz UZEKQOOPXXVXAB-UHFFFAOYSA-N 1 3 347.507 2.743 10 0 EFAEHO CN1CC[C@@]2(CC[N@H+](C[C@H](O)c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000292227733 474913454 /nfs/dbraw/zinc/91/34/54/474913454.db2.gz VKDBJJGWNPZDNN-JKSUJKDBSA-N 1 3 328.378 2.766 10 0 EFAEHO CN1CC[C@@]2(CC[N@@H+](C[C@H](O)c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000292227733 474913460 /nfs/dbraw/zinc/91/34/60/474913460.db2.gz VKDBJJGWNPZDNN-JKSUJKDBSA-N 1 3 328.378 2.766 10 0 EFAEHO C[C@@H](CN(C)CC(=O)NC1CC[NH+](C2CC2)CC1)C1CCCCC1 ZINC000625987694 480135101 /nfs/dbraw/zinc/13/51/01/480135101.db2.gz YRWDSTACLIRGHV-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)NCCN(C)Cc1ccccc1 ZINC000341102090 474975881 /nfs/dbraw/zinc/97/58/81/474975881.db2.gz QBKUXCRJINAQMK-HDICACEKSA-N 1 3 346.519 2.681 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NCCN(C)Cc1ccccc1 ZINC000341102090 474975884 /nfs/dbraw/zinc/97/58/84/474975884.db2.gz QBKUXCRJINAQMK-HDICACEKSA-N 1 3 346.519 2.681 10 0 EFAEHO CCN1CCCC[C@@H]1CNC(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C(C)C ZINC000341118263 474993139 /nfs/dbraw/zinc/99/31/39/474993139.db2.gz GMQKIUZISCARTO-KURKYZTESA-N 1 3 336.524 2.518 10 0 EFAEHO CCN1CCCC[C@@H]1CNC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000341118263 474993145 /nfs/dbraw/zinc/99/31/45/474993145.db2.gz GMQKIUZISCARTO-KURKYZTESA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CC1(N(C)C)CCOCC1 ZINC000268885951 475052716 /nfs/dbraw/zinc/05/27/16/475052716.db2.gz MRZTUPGGHJYKST-QUCCMNQESA-N 1 3 345.531 2.597 10 0 EFAEHO c1ccc(N2CCC([NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCCN3)CC2)nc1 ZINC000261795077 475065514 /nfs/dbraw/zinc/06/55/14/475065514.db2.gz ZGAQMIIRQVOCIY-GUDVDZBRSA-N 1 3 328.504 2.951 10 0 EFAEHO C[C@@H](CNC(=O)NCCN1[C@H](C)CCC[C@@H]1C)C[NH+]1CCCCC1 ZINC000341471308 475069878 /nfs/dbraw/zinc/06/98/78/475069878.db2.gz ZCNBPNQUGFBXPK-OKZBNKHCSA-N 1 3 338.540 2.671 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261847880 475085360 /nfs/dbraw/zinc/08/53/60/475085360.db2.gz PUTXRXFKTGUBBR-NQIIRXRSSA-N 1 3 347.466 2.750 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCCN(C)CC(F)(F)F ZINC000268961056 475097739 /nfs/dbraw/zinc/09/77/39/475097739.db2.gz XHANIUNYPTWFBM-DOTOQJQBSA-N 1 3 343.437 2.981 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCCN(C)CC(F)(F)F ZINC000268961056 475097747 /nfs/dbraw/zinc/09/77/47/475097747.db2.gz XHANIUNYPTWFBM-DOTOQJQBSA-N 1 3 343.437 2.981 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@@H](C)c2cnn(C3CCCC3)c2)CC1 ZINC000337529471 475098703 /nfs/dbraw/zinc/09/87/03/475098703.db2.gz UGAVIEPTFZCZTE-KRWDZBQOSA-N 1 3 333.524 2.676 10 0 EFAEHO CC(C)COc1ccccc1CN[C@@H]1CCC[C@H]1[C@@H]1COCC[NH2+]1 ZINC000261888046 475101699 /nfs/dbraw/zinc/10/16/99/475101699.db2.gz GDGCLBWJVYPBCH-QRVBRYPASA-N 1 3 332.488 2.968 10 0 EFAEHO CC[C@H](C)[C@@H]1CN(Cc2ccc(C)nc2)CCN1C[C@H]1CCC[NH2+]C1 ZINC000261921761 475114752 /nfs/dbraw/zinc/11/47/52/475114752.db2.gz KOEQILQCCNJADT-CUWPLCDZSA-N 1 3 344.547 2.922 10 0 EFAEHO [NH3+]CCCOCCN[C@H](c1ccc(Br)s1)C1CC1 ZINC000629539552 480297337 /nfs/dbraw/zinc/29/73/37/480297337.db2.gz QCEDMYSQHOUSQC-ZDUSSCGKSA-N 1 3 333.295 2.917 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]C[C@@]1(N(C)C)CCSC1 ZINC000269004633 475123054 /nfs/dbraw/zinc/12/30/54/475123054.db2.gz VTTMHGYDBPITOT-RLLQIKCJSA-N 1 3 347.572 2.924 10 0 EFAEHO C1C[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)[C@H]([C@H]2COCCN2)C1 ZINC000262017446 475146041 /nfs/dbraw/zinc/14/60/41/475146041.db2.gz WDMHNCDAKFDXBY-VAMGGRTRSA-N 1 3 335.536 2.530 10 0 EFAEHO CC1(C[NH2+]C[C@H]2CN(Cc3ccccc3)CC23CCOCC3)COC1 ZINC000339488205 475251048 /nfs/dbraw/zinc/25/10/48/475251048.db2.gz NUQXIOGZYCEWFJ-IBGZPJMESA-N 1 3 344.499 2.541 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CNCCCCC[NH+]1CCCC1 ZINC000339496399 475255449 /nfs/dbraw/zinc/25/54/49/475255449.db2.gz ALIJXQXLKBFTKZ-UHFFFAOYSA-N 1 3 327.476 2.931 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](N[C@@H]2CCN(c3ccccc3)C2)[C@@H](C)C1 ZINC000361216947 475276993 /nfs/dbraw/zinc/27/69/93/475276993.db2.gz OXSQIMAOJQNNJS-ZVDOUQERSA-N 1 3 345.531 2.992 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](N[C@@H]2CCN(c3ccccc3)C2)[C@@H](C)C1 ZINC000361216947 475277001 /nfs/dbraw/zinc/27/70/01/475277001.db2.gz OXSQIMAOJQNNJS-ZVDOUQERSA-N 1 3 345.531 2.992 10 0 EFAEHO O=C(CC(F)(F)F)NC[C@@H]1CCC[N@H+](CCCN2CCCCC2)C1 ZINC000352469377 475325457 /nfs/dbraw/zinc/32/54/57/475325457.db2.gz XFQDJEZBACQANW-HNNXBMFYSA-N 1 3 349.441 2.643 10 0 EFAEHO O=C(CC(F)(F)F)NC[C@@H]1CCC[N@@H+](CCCN2CCCCC2)C1 ZINC000352469377 475325461 /nfs/dbraw/zinc/32/54/61/475325461.db2.gz XFQDJEZBACQANW-HNNXBMFYSA-N 1 3 349.441 2.643 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@@H](CO)CC2)CC1 ZINC000354690107 475340357 /nfs/dbraw/zinc/34/03/57/475340357.db2.gz IDFPBLFDWYTOPR-LJQANCHMSA-N 1 3 345.531 2.813 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@@H](CO)CC2)CC1 ZINC000354690107 475340366 /nfs/dbraw/zinc/34/03/66/475340366.db2.gz IDFPBLFDWYTOPR-LJQANCHMSA-N 1 3 345.531 2.813 10 0 EFAEHO CN(C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CC[C@@H]2C(C)(C)C)c1 ZINC000348112748 475399757 /nfs/dbraw/zinc/39/97/57/475399757.db2.gz RGRUDTBDNJKFMO-ZWKOTPCHSA-N 1 3 331.504 2.892 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000352596507 475445669 /nfs/dbraw/zinc/44/56/69/475445669.db2.gz BGTFZVHRVZXJMC-YZGWKJHDSA-N 1 3 343.515 2.888 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000352596507 475445673 /nfs/dbraw/zinc/44/56/73/475445673.db2.gz BGTFZVHRVZXJMC-YZGWKJHDSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@H](CO)c2cccnc2)CC[N@@H+]1Cc1ccccc1 ZINC000348199789 475481844 /nfs/dbraw/zinc/48/18/44/475481844.db2.gz QLCIBXNPVJDEJU-UIFIKXQLSA-N 1 3 339.483 2.800 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@H](CO)c2cccnc2)CC[N@H+]1Cc1ccccc1 ZINC000348199789 475481851 /nfs/dbraw/zinc/48/18/51/475481851.db2.gz QLCIBXNPVJDEJU-UIFIKXQLSA-N 1 3 339.483 2.800 10 0 EFAEHO CC[C@H](C)[N@H+](C)CCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000355039711 475617761 /nfs/dbraw/zinc/61/77/61/475617761.db2.gz OYPPAXGHHKRHGB-PKOBYXMFSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[C@H](C)[N@@H+](C)CCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000355039711 475617772 /nfs/dbraw/zinc/61/77/72/475617772.db2.gz OYPPAXGHHKRHGB-PKOBYXMFSA-N 1 3 346.519 2.633 10 0 EFAEHO C[C@H]1CCCCCN1C(=O)NC1CCN(C2CC[NH+](C)CC2)CC1 ZINC000358370291 475626174 /nfs/dbraw/zinc/62/61/74/475626174.db2.gz NLFMZEYDJSFNNG-INIZCTEOSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCCN1CCCC[C@@H]1C ZINC000338300242 475761790 /nfs/dbraw/zinc/76/17/90/475761790.db2.gz ZCEXDMUWNNUVCN-MHORFTMASA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCCN1CCCC[C@@H]1C ZINC000338300242 475761797 /nfs/dbraw/zinc/76/17/97/475761797.db2.gz ZCEXDMUWNNUVCN-MHORFTMASA-N 1 3 338.540 2.526 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@@](C)(O)CC2)CC1 ZINC000355291054 475801940 /nfs/dbraw/zinc/80/19/40/475801940.db2.gz MDDRMDGAUHIZCU-OAQYLSRUSA-N 1 3 345.531 2.956 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@@](C)(O)CC2)CC1 ZINC000355291054 475801951 /nfs/dbraw/zinc/80/19/51/475801951.db2.gz MDDRMDGAUHIZCU-OAQYLSRUSA-N 1 3 345.531 2.956 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)[C@H](C[NH3+])c2ccc(F)cc2)cc1 ZINC000358742221 475899201 /nfs/dbraw/zinc/89/92/01/475899201.db2.gz IZGAQXCAODJDHI-RTBURBONSA-N 1 3 343.446 2.808 10 0 EFAEHO O=C(CN[C@@H](c1ccccc1)C1CCC1)NC1CC[NH+](C2CC2)CC1 ZINC000355395912 475899691 /nfs/dbraw/zinc/89/96/91/475899691.db2.gz WNUSNOLNKNNSPT-NRFANRHFSA-N 1 3 341.499 2.860 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2CCN(c3ncccc3Cl)C2)[C@H]2CCC[C@H]21 ZINC000353395127 475933410 /nfs/dbraw/zinc/93/34/10/475933410.db2.gz OPVQHPDVIPXESE-TXCZRRACSA-N 1 3 334.895 2.776 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2CCN(c3ncccc3Cl)C2)[C@H]2CCC[C@H]21 ZINC000353395127 475933419 /nfs/dbraw/zinc/93/34/19/475933419.db2.gz OPVQHPDVIPXESE-TXCZRRACSA-N 1 3 334.895 2.776 10 0 EFAEHO c1ccc(CN2C[C@H](C[NH2+][C@H]3CCCOC3)C3(C2)CCOCC3)cc1 ZINC000340468985 476054351 /nfs/dbraw/zinc/05/43/51/476054351.db2.gz HUDCRSOVTBHZDY-PMACEKPBSA-N 1 3 344.499 2.684 10 0 EFAEHO c1ccc(C[N@H+]2C[C@H](CN[C@H]3CCCOC3)C3(C2)CCOCC3)cc1 ZINC000340468985 476054359 /nfs/dbraw/zinc/05/43/59/476054359.db2.gz HUDCRSOVTBHZDY-PMACEKPBSA-N 1 3 344.499 2.684 10 0 EFAEHO c1ccc(C[N@@H+]2C[C@H](CN[C@H]3CCCOC3)C3(C2)CCOCC3)cc1 ZINC000340468985 476054365 /nfs/dbraw/zinc/05/43/65/476054365.db2.gz HUDCRSOVTBHZDY-PMACEKPBSA-N 1 3 344.499 2.684 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CCN1C ZINC000336693903 476125008 /nfs/dbraw/zinc/12/50/08/476125008.db2.gz IBXRTHRSZSJRAB-KPACCLEDSA-N 1 3 327.516 2.969 10 0 EFAEHO CN1CC[C@H]([NH2+]CCOc2cccc(C(F)(F)F)n2)[C@H]2CCC[C@H]21 ZINC000353615979 476127155 /nfs/dbraw/zinc/12/71/55/476127155.db2.gz XSVYQWNVUMHPBU-HZSPNIEDSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCOc2cccc(C(F)(F)F)n2)[C@H]2CCC[C@H]21 ZINC000353615979 476127158 /nfs/dbraw/zinc/12/71/58/476127158.db2.gz XSVYQWNVUMHPBU-HZSPNIEDSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@H+]1CC[C@H](NCCOc2cccc(C(F)(F)F)n2)[C@H]2CCC[C@H]21 ZINC000353615979 476127167 /nfs/dbraw/zinc/12/71/67/476127167.db2.gz XSVYQWNVUMHPBU-HZSPNIEDSA-N 1 3 343.393 2.942 10 0 EFAEHO Cc1nc(C)c([C@@H](C)N[C@@H](CC(C)C)C(=O)NCC[NH+](C)C)s1 ZINC000347182723 476156120 /nfs/dbraw/zinc/15/61/20/476156120.db2.gz AKEBHLMGQJIXTE-HIFRSBDPSA-N 1 3 340.537 2.503 10 0 EFAEHO C[C@@H]1CCC[C@H]([NH+]2CCC(N[C@H]3CCC(=O)NC34CCC4)CC2)C1 ZINC000338774019 476175938 /nfs/dbraw/zinc/17/59/38/476175938.db2.gz CLXIBTSJVJOIIV-NJAFHUGGSA-N 1 3 333.520 2.820 10 0 EFAEHO C[C@@H]1CCC[C@H](N2CCC([NH2+][C@H]3CCC(=O)NC34CCC4)CC2)C1 ZINC000338774019 476175944 /nfs/dbraw/zinc/17/59/44/476175944.db2.gz CLXIBTSJVJOIIV-NJAFHUGGSA-N 1 3 333.520 2.820 10 0 EFAEHO CC(C)C[C@H](N[C@@H]1CCSc2ccccc21)C(=O)NCC[NH+](C)C ZINC000347230715 476187815 /nfs/dbraw/zinc/18/78/15/476187815.db2.gz OJMFPWHNTOWKGL-SJORKVTESA-N 1 3 349.544 2.906 10 0 EFAEHO CN(c1ccccc1C[NH2+]CC[C@@H]1CCOC1)C1CCN(C)CC1 ZINC000344258942 476193442 /nfs/dbraw/zinc/19/34/42/476193442.db2.gz CILPSSUDWMSFHN-QGZVFWFLSA-N 1 3 331.504 2.733 10 0 EFAEHO CN1CCC[C@@H]1CC[NH+]1CCC2(C[C@H]2C(=O)N2CCCCC2)CC1 ZINC000357082838 476216192 /nfs/dbraw/zinc/21/61/92/476216192.db2.gz JQTUXFVXYSJXCM-MSOLQXFVSA-N 1 3 333.520 2.585 10 0 EFAEHO CC[C@@H]1C[C@H](C[NH+]2CCC(C)(CN3CCN(C)CC3)CC2)CCO1 ZINC000350551358 476239050 /nfs/dbraw/zinc/23/90/50/476239050.db2.gz FENROXLOKZQWJE-RTBURBONSA-N 1 3 337.552 2.541 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]CCN2CCCC[C@H]2C)[C@@H](C)C1 ZINC000359926294 476274136 /nfs/dbraw/zinc/27/41/36/476274136.db2.gz QBRFKXOMYYZEDR-OTWHNJEPSA-N 1 3 325.541 2.587 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)NCCC1CC[NH+](CC)CC1 ZINC000353835562 476295415 /nfs/dbraw/zinc/29/54/15/476295415.db2.gz MSPILJAHZPURBO-UHFFFAOYSA-N 1 3 338.540 2.626 10 0 EFAEHO CC[C@H](C)N[C@@H](CNC(=O)N(C)[C@H]1CC[N@@H+](C2CC2)C1)c1ccco1 ZINC000357551200 476449009 /nfs/dbraw/zinc/44/90/09/476449009.db2.gz WVTYDLVLUDFTPC-XIRDDKMYSA-N 1 3 348.491 2.587 10 0 EFAEHO CC[C@H](C)N[C@@H](CNC(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1)c1ccco1 ZINC000357551200 476449016 /nfs/dbraw/zinc/44/90/16/476449016.db2.gz WVTYDLVLUDFTPC-XIRDDKMYSA-N 1 3 348.491 2.587 10 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ZINC000451912952 476720508 /nfs/dbraw/zinc/72/05/08/476720508.db2.gz VLIBMYYGMMEZBC-XLLYZGMYSA-N 1 3 334.504 2.548 10 0 EFAEHO CC[NH+](CC)CCNC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000429966862 476725928 /nfs/dbraw/zinc/72/59/28/476725928.db2.gz FSDUSBOXLSXKGE-HXUWFJFHSA-N 1 3 346.519 2.682 10 0 EFAEHO Cc1nc(C[NH3+])ccc1[C@H](C)NCc1ccc2c(c1)OCCCO2 ZINC000422699315 476735752 /nfs/dbraw/zinc/73/57/52/476735752.db2.gz CZXAPCZSIXOCFK-ZDUSSCGKSA-N 1 3 327.428 2.861 10 0 EFAEHO CC(C)COC[C@H](O)C[NH2+][C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000381466720 476737705 /nfs/dbraw/zinc/73/77/05/476737705.db2.gz YNANLZIVEGSPTJ-DOIPELPJSA-N 1 3 346.515 2.520 10 0 EFAEHO CC(C)COC[C@H](O)CN[C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000381466720 476737710 /nfs/dbraw/zinc/73/77/10/476737710.db2.gz YNANLZIVEGSPTJ-DOIPELPJSA-N 1 3 346.515 2.520 10 0 EFAEHO CC(C)COC[C@H](O)CN[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000381466720 476737716 /nfs/dbraw/zinc/73/77/16/476737716.db2.gz YNANLZIVEGSPTJ-DOIPELPJSA-N 1 3 346.515 2.520 10 0 EFAEHO CC(C)(C)[C@H](O)C[C@@H](CO)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000375269271 476748676 /nfs/dbraw/zinc/74/86/76/476748676.db2.gz YKKALQCSHLEFMP-FUHWJXTLSA-N 1 3 326.525 2.531 10 0 EFAEHO [NH3+]C1CCC(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CC1 ZINC000383415918 476751835 /nfs/dbraw/zinc/75/18/35/476751835.db2.gz WMMDNQPQXXGFAK-VIQWUECVSA-N 1 3 329.488 2.532 10 0 EFAEHO C(N[C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)C1(N2CCOCC2)CCCCC1 ZINC000422751105 476759855 /nfs/dbraw/zinc/75/98/55/476759855.db2.gz CEZZRAIMCXZQGF-SLFFLAALSA-N 1 3 349.563 2.922 10 0 EFAEHO C[C@H](NCC1CCN(C(=O)c2ccccc2)CC1)[C@H]1CCCC[NH2+]1 ZINC000422771504 476768977 /nfs/dbraw/zinc/76/89/77/476768977.db2.gz VRKQXBLWRQTLAB-QFBILLFUSA-N 1 3 329.488 2.659 10 0 EFAEHO c1ccc2nc(CCN[C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)ccc2c1 ZINC000422779010 476772907 /nfs/dbraw/zinc/77/29/07/476772907.db2.gz IBTZPXOHJPRHRM-MISYRCLQSA-N 1 3 325.456 2.524 10 0 EFAEHO C[C@@H]1CN(C(C)(C)CN[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)C[C@H](C)O1 ZINC000422788441 476776063 /nfs/dbraw/zinc/77/60/63/476776063.db2.gz APQNGSMSLQFVPL-RHQZKXFESA-N 1 3 337.552 2.775 10 0 EFAEHO Cc1nc(CCN[C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cs1 ZINC000422816042 476790897 /nfs/dbraw/zinc/79/08/97/476790897.db2.gz DBGROWCFYPKCNY-AEFFLSMTSA-N 1 3 329.469 2.840 10 0 EFAEHO C[C@@H](C[C@@H]1COCCN1)[NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000390531450 476796663 /nfs/dbraw/zinc/79/66/63/476796663.db2.gz DUSDCHLTGCOLLD-PVCSLBTHSA-N 1 3 343.515 2.539 10 0 EFAEHO CCCCOC[C@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390847739 476808034 /nfs/dbraw/zinc/80/80/34/476808034.db2.gz GWYACMJJEOAJFR-OTYNDTSQSA-N 1 3 346.515 2.949 10 0 EFAEHO CCCCOC[C@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000390847739 476808043 /nfs/dbraw/zinc/80/80/43/476808043.db2.gz GWYACMJJEOAJFR-OTYNDTSQSA-N 1 3 346.515 2.949 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1ccc(Oc2cccc(F)c2)nc1 ZINC000422847545 476808160 /nfs/dbraw/zinc/80/81/60/476808160.db2.gz RRFMJTYNIXCJQZ-INIZCTEOSA-N 1 3 333.407 2.857 10 0 EFAEHO COc1ccc([C@H](N[C@@H]2C[C@H](C)N(C3CC3)C2)[C@H]2CCC[NH2+]2)cc1 ZINC000422861051 476814824 /nfs/dbraw/zinc/81/48/24/476814824.db2.gz IWBFPHMJLVWQBT-NBPAUJCUSA-N 1 3 329.488 2.703 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@H](CN[C@@H](C)[C@H]3CCCC[NH2+]3)C2)c1 ZINC000422874625 476821937 /nfs/dbraw/zinc/82/19/37/476821937.db2.gz NXTUMWHODXEUMK-RZQQEMMASA-N 1 3 347.503 2.650 10 0 EFAEHO Clc1cccnc1N1CC[C@H](N[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)C1 ZINC000422877428 476824322 /nfs/dbraw/zinc/82/43/22/476824322.db2.gz RJFOHJMQDBTZLV-XOSAIJSUSA-N 1 3 334.895 2.824 10 0 EFAEHO OC1(C[NH2+]Cc2ccc(F)cc2)CCN(Cc2ccccc2)CC1 ZINC000397629355 476857758 /nfs/dbraw/zinc/85/77/58/476857758.db2.gz ZPQVNDSGMWRPPX-UHFFFAOYSA-N 1 3 328.431 2.942 10 0 EFAEHO C[C@H](NCC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccccn1 ZINC000397611465 476857818 /nfs/dbraw/zinc/85/78/18/476857818.db2.gz RPRGBQFDAHEBLW-KRWDZBQOSA-N 1 3 325.456 2.759 10 0 EFAEHO OC1(C[NH2+]C2Cc3ccccc3C2)CCN(Cc2ccccc2)CC1 ZINC000397617497 476858578 /nfs/dbraw/zinc/85/85/78/476858578.db2.gz HNMIBNIKETTXFB-UHFFFAOYSA-N 1 3 336.479 2.771 10 0 EFAEHO C[C@H](NCC1(O)CC[NH+](Cc2ccccc2)CC1)c1cncs1 ZINC000397705106 476859557 /nfs/dbraw/zinc/85/95/57/476859557.db2.gz WVGLXPKLZXMACW-HNNXBMFYSA-N 1 3 331.485 2.821 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(C(=O)NCCN2CCCC2)cc1)[C@@H]1C[C@H]1C ZINC000414069513 476862420 /nfs/dbraw/zinc/86/24/20/476862420.db2.gz BTRHPAWMKVHVCQ-GPMSIDNRSA-N 1 3 329.488 2.646 10 0 EFAEHO CCOC(=O)C1([C@H](C)N[C@H]2COc3c2ccc(C)c3C)CC[NH2+]CC1 ZINC000422959803 476867212 /nfs/dbraw/zinc/86/72/12/476867212.db2.gz UOQIHXDJUANMAD-RDJZCZTQSA-N 1 3 346.471 2.648 10 0 EFAEHO C[C@@H]1CC[NH2+]CC[C@H]1NC[C@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422986644 476879621 /nfs/dbraw/zinc/87/96/21/476879621.db2.gz DAJNPXIVJYNHRE-FRFSOERESA-N 1 3 344.421 2.834 10 0 EFAEHO C[C@@H]1CCNCC[C@H]1[NH2+]C[C@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422986644 476879627 /nfs/dbraw/zinc/87/96/27/476879627.db2.gz DAJNPXIVJYNHRE-FRFSOERESA-N 1 3 344.421 2.834 10 0 EFAEHO CCN(CC)CCC[NH2+][C@@H](C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000400333349 476889374 /nfs/dbraw/zinc/88/93/74/476889374.db2.gz FJHFASRVOQUNJB-HOTGVXAUSA-N 1 3 327.513 2.953 10 0 EFAEHO CC(C)N1CC[C@@H](C[NH2+][C@@H](C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1 ZINC000400581111 476892329 /nfs/dbraw/zinc/89/23/29/476892329.db2.gz QSKCVYNLCJFQMR-ULQDDVLXSA-N 1 3 339.524 2.952 10 0 EFAEHO COc1ccc2c(c1)OC[C@H]([NH2+][C@@H](C)c1ccc(CN)nc1C)C2 ZINC000423022070 476894260 /nfs/dbraw/zinc/89/42/60/476894260.db2.gz HADBVGPSKSVEBT-XJKSGUPXSA-N 1 3 327.428 2.512 10 0 EFAEHO Cc1ccc2c(CCN[C@@H]3CCOC[C@H]3[C@@H]3CCC[NH2+]3)cn(C)c2c1 ZINC000423057056 476909005 /nfs/dbraw/zinc/90/90/05/476909005.db2.gz GRTXOUWFDQCZHC-SLFFLAALSA-N 1 3 341.499 2.776 10 0 EFAEHO Cc1cc(N2CCC[C@H](N[C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)C2)n(C)n1 ZINC000423074617 476916353 /nfs/dbraw/zinc/91/63/53/476916353.db2.gz MIJWQRMMAIBYFA-WJFTUGDTSA-N 1 3 345.535 2.598 10 0 EFAEHO Cc1cc(N2CCC[C@H](N[C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)C2)n(C)n1 ZINC000423074618 476916600 /nfs/dbraw/zinc/91/66/00/476916600.db2.gz MIJWQRMMAIBYFA-ZSYWTGECSA-N 1 3 345.535 2.598 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1ccnc(Oc2ccccc2F)c1 ZINC000423081256 476920042 /nfs/dbraw/zinc/92/00/42/476920042.db2.gz CKQNXBMKJNGXPP-HNNXBMFYSA-N 1 3 333.407 2.857 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@H]1CCOc2c(Br)cccc21 ZINC000423112663 476933026 /nfs/dbraw/zinc/93/30/26/476933026.db2.gz JWIKPRVKKMYVDD-RISCZKNCSA-N 1 3 343.265 2.616 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@@H](C)c1ccc(Br)cc1F ZINC000423116191 476934169 /nfs/dbraw/zinc/93/41/69/476934169.db2.gz ZVDSOVDKZSIYME-CMPLNLGQSA-N 1 3 333.245 2.993 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@H]1CCN(c2ccccc2F)C1 ZINC000423123135 476936408 /nfs/dbraw/zinc/93/64/08/476936408.db2.gz DFYAPEHRVXZWGL-ZBFHGGJFSA-N 1 3 328.435 2.917 10 0 EFAEHO COc1c(C)cc(C[N@@H+]2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1C ZINC000370705765 476943876 /nfs/dbraw/zinc/94/38/76/476943876.db2.gz IYDOAJIVKIVATN-UYAOXDASSA-N 1 3 345.531 2.770 10 0 EFAEHO COc1c(C)cc(C[N@H+]2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1C ZINC000370705765 476943884 /nfs/dbraw/zinc/94/38/84/476943884.db2.gz IYDOAJIVKIVATN-UYAOXDASSA-N 1 3 345.531 2.770 10 0 EFAEHO COc1c(C)cc(CN2CC[C@@H]([NH+]3CCN(C)CC3)[C@H](C)C2)cc1C ZINC000370705765 476943890 /nfs/dbraw/zinc/94/38/90/476943890.db2.gz IYDOAJIVKIVATN-UYAOXDASSA-N 1 3 345.531 2.770 10 0 EFAEHO COCC1(CN[C@H](C)c2ncc(-c3ccccc3)n2C)CC[NH2+]CC1 ZINC000423413199 477025245 /nfs/dbraw/zinc/02/52/45/477025245.db2.gz YMQHPUHHGXDJQN-MRXNPFEDSA-N 1 3 342.487 2.754 10 0 EFAEHO CN1CC[C@]2(CC[N@H+](CCc3nc(-c4ccc(Cl)cc4)no3)C2)C1 ZINC000366493285 477038171 /nfs/dbraw/zinc/03/81/71/477038171.db2.gz YADIXRRKNQTXSB-SFHVURJKSA-N 1 3 346.862 2.960 10 0 EFAEHO CN1CC[C@]2(CC[N@@H+](CCc3nc(-c4ccc(Cl)cc4)no3)C2)C1 ZINC000366493285 477038176 /nfs/dbraw/zinc/03/81/76/477038176.db2.gz YADIXRRKNQTXSB-SFHVURJKSA-N 1 3 346.862 2.960 10 0 EFAEHO O=C(CCN1CCc2ccccc2C1)N1CC[C@H]([NH+]2CCCCC2)C1 ZINC000416149433 477040942 /nfs/dbraw/zinc/04/09/42/477040942.db2.gz HANOIYGNBVNTQJ-FQEVSTJZSA-N 1 3 341.499 2.522 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)CCN2CCc3ccccc3C2)C[C@@H]1C ZINC000416153003 477042496 /nfs/dbraw/zinc/04/24/96/477042496.db2.gz ACGHABJZIDEVPF-FXAWDEMLSA-N 1 3 343.515 2.766 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)CCN2CCc3ccccc3C2)C[C@@H]1C ZINC000416153003 477042500 /nfs/dbraw/zinc/04/25/00/477042500.db2.gz ACGHABJZIDEVPF-FXAWDEMLSA-N 1 3 343.515 2.766 10 0 EFAEHO FC1(F)CCNC[C@H]1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000423488739 477046348 /nfs/dbraw/zinc/04/63/48/477046348.db2.gz VPOFURLXLYOJAS-ZJPYXAASSA-N 1 3 335.442 2.769 10 0 EFAEHO FC1(F)CCNC[C@H]1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000423488739 477046356 /nfs/dbraw/zinc/04/63/56/477046356.db2.gz VPOFURLXLYOJAS-ZJPYXAASSA-N 1 3 335.442 2.769 10 0 EFAEHO CC[NH+](CC)C[C@@H]1CCN(C(=O)CCN2CCc3ccccc3C2)C1 ZINC000416161648 477048295 /nfs/dbraw/zinc/04/82/95/477048295.db2.gz NIIYFOUAGINJAS-SFHVURJKSA-N 1 3 343.515 2.625 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCc2nnc(-c3ccccc3)o2)[C@H]2CCC[C@@H]21 ZINC000375855650 477050825 /nfs/dbraw/zinc/05/08/25/477050825.db2.gz BMUQIMLHEXYGIR-IKGGRYGDSA-N 1 3 326.444 2.742 10 0 EFAEHO C[N@H+]1CC[C@H](NCCc2nnc(-c3ccccc3)o2)[C@H]2CCC[C@@H]21 ZINC000375855650 477050828 /nfs/dbraw/zinc/05/08/28/477050828.db2.gz BMUQIMLHEXYGIR-IKGGRYGDSA-N 1 3 326.444 2.742 10 0 EFAEHO CC[C@@H](CC(F)F)C(=O)N(CCN(C)C)C[C@H]1CCC[N@@H+]1CC ZINC000457536345 477074225 /nfs/dbraw/zinc/07/42/25/477074225.db2.gz PCBJOVRDWUAXQS-LSDHHAIUSA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@@H](CC(F)F)C(=O)N(CCN(C)C)C[C@H]1CCC[N@H+]1CC ZINC000457536345 477074233 /nfs/dbraw/zinc/07/42/33/477074233.db2.gz PCBJOVRDWUAXQS-LSDHHAIUSA-N 1 3 333.467 2.542 10 0 EFAEHO O=C([C@@H]1CCCN1Cc1ccccc1)N1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000371020231 477084817 /nfs/dbraw/zinc/08/48/17/477084817.db2.gz XNHBFGMWIFQJNF-UFYCRDLUSA-N 1 3 341.499 2.642 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)[C@H]2CCC[C@@H]21 ZINC000453392315 477220348 /nfs/dbraw/zinc/22/03/48/477220348.db2.gz YUWSWXKODWOVGM-UWVPOSKDSA-N 1 3 346.519 2.843 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)[C@H]2CCC[C@@H]21 ZINC000453392315 477220354 /nfs/dbraw/zinc/22/03/54/477220354.db2.gz YUWSWXKODWOVGM-UWVPOSKDSA-N 1 3 346.519 2.843 10 0 EFAEHO O=C(NCC[C@@H]1CCC[NH2+]C1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000416783953 477309995 /nfs/dbraw/zinc/30/99/95/477309995.db2.gz IMBKARHOOBOCLW-PKOBYXMFSA-N 1 3 344.503 2.512 10 0 EFAEHO C[C@@H]1OCC[C@H]1N(CCO)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000411669346 477318195 /nfs/dbraw/zinc/31/81/95/477318195.db2.gz ZIMFIYFCVICPKU-FXAWDEMLSA-N 1 3 332.488 2.644 10 0 EFAEHO C[NH+](C)C1(CNC(=O)NC[C@@H](N)c2ccccc2)CCCCCC1 ZINC000416853640 477338851 /nfs/dbraw/zinc/33/88/51/477338851.db2.gz VJHYBUFCENQONP-QGZVFWFLSA-N 1 3 332.492 2.640 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@@H]([NH2+]CCc3ccc(OCCN(C)C)cc3)C[C@H]2C1 ZINC000424322977 477370777 /nfs/dbraw/zinc/37/07/77/477370777.db2.gz VQXWDLGITAJXMX-BITOSCEUSA-N 1 3 346.515 2.963 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCNC(=O)CCCc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000424334209 477373017 /nfs/dbraw/zinc/37/30/17/477373017.db2.gz WPQDACDBOWHNAL-SLFFLAALSA-N 1 3 343.515 2.588 10 0 EFAEHO C[N@H+]1CC[C@H](NCCNC(=O)CCCc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000424334209 477373023 /nfs/dbraw/zinc/37/30/23/477373023.db2.gz WPQDACDBOWHNAL-SLFFLAALSA-N 1 3 343.515 2.588 10 0 EFAEHO CCN1CCC(NC(=O)C[NH2+][C@H]2CCCC[C@H]2CC(F)(F)F)CC1 ZINC000411802141 477374887 /nfs/dbraw/zinc/37/48/87/477374887.db2.gz VEIIMGGLIIHBAX-ZFWWWQNUSA-N 1 3 349.441 2.688 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)[C@H]1C[C@@H]1c1ccccc1 ZINC000411825128 477382699 /nfs/dbraw/zinc/38/26/99/477382699.db2.gz REZACVCXBIOIQZ-AQNXPRMDSA-N 1 3 343.515 2.665 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)[C@H]1C[C@@H]1c1ccccc1 ZINC000411825128 477382705 /nfs/dbraw/zinc/38/27/05/477382705.db2.gz REZACVCXBIOIQZ-AQNXPRMDSA-N 1 3 343.515 2.665 10 0 EFAEHO CCC(CC)[C@@H](CNC(=O)NC[C@H](N)c1ccccc1)[NH+]1CCCC1 ZINC000416967549 477392761 /nfs/dbraw/zinc/39/27/61/477392761.db2.gz ZNFBBKYSNNHCOK-RBUKOAKNSA-N 1 3 346.519 2.886 10 0 EFAEHO CC(C)[C@@H](CNC(=O)NC[C@@H](N)c1ccccc1)[NH+]1CCC(C)CC1 ZINC000416999933 477416161 /nfs/dbraw/zinc/41/61/61/477416161.db2.gz CNBXFBQHJVAUJM-RTBURBONSA-N 1 3 346.519 2.742 10 0 EFAEHO CC(C)(C)CC(C)(C)[NH+]1CCC(NCCCN2CCOCC2)CC1 ZINC000449060999 477416379 /nfs/dbraw/zinc/41/63/79/477416379.db2.gz FNCNCFUOCLKTJQ-UHFFFAOYSA-N 1 3 339.568 2.978 10 0 EFAEHO COC(=O)C(C)(C)CNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449062659 477416652 /nfs/dbraw/zinc/41/66/52/477416652.db2.gz ZEAPCUROJXOXCU-MRXNPFEDSA-N 1 3 332.488 2.871 10 0 EFAEHO CC(C)COC[C@H](O)CNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449095558 477436825 /nfs/dbraw/zinc/43/68/25/477436825.db2.gz ZJLOTEFBKOOXQG-WIYYLYMNSA-N 1 3 348.531 2.705 10 0 EFAEHO C[C@H](Cc1ccccc1)N1CCC([NH2+][C@@H]2CCN(C3CC3)C2)CC1 ZINC000449130730 477451716 /nfs/dbraw/zinc/45/17/16/477451716.db2.gz HOFIVPYGFCPZOJ-YLJYHZDGSA-N 1 3 327.516 2.908 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(N[C@@H]2CCN(C3CC3)C2)CC1 ZINC000449130730 477451720 /nfs/dbraw/zinc/45/17/20/477451720.db2.gz HOFIVPYGFCPZOJ-YLJYHZDGSA-N 1 3 327.516 2.908 10 0 EFAEHO CSC[C@@](C)(O)CNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449165092 477465121 /nfs/dbraw/zinc/46/51/21/477465121.db2.gz SXGQNRHFNKVHCZ-LPHOPBHVSA-N 1 3 336.545 2.786 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)N(C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000418351444 477470082 /nfs/dbraw/zinc/47/00/82/477470082.db2.gz LTYQIYHTGFPYRQ-KFKAGJAMSA-N 1 3 346.519 2.934 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000418351444 477470095 /nfs/dbraw/zinc/47/00/95/477470095.db2.gz LTYQIYHTGFPYRQ-KFKAGJAMSA-N 1 3 346.519 2.934 10 0 EFAEHO C[C@H](CO[C@@H]1CCOC1)NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449183440 477474894 /nfs/dbraw/zinc/47/48/94/477474894.db2.gz FTOHEEJBVZFMDQ-DBXWQHBBSA-N 1 3 346.515 2.866 10 0 EFAEHO CCC(=O)N1CC[C@@H](NC2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)C1 ZINC000449194695 477479681 /nfs/dbraw/zinc/47/96/81/477479681.db2.gz VKBBIGFMZLWMBG-FXAWDEMLSA-N 1 3 343.515 2.683 10 0 EFAEHO CN1CC[C@@H](NC(=O)NC(C)(C)CCC[NH+](C)C)[C@H]1c1ccccc1 ZINC000458575413 477489351 /nfs/dbraw/zinc/48/93/51/477489351.db2.gz IUKQAMNSIDDCOT-QZTJIDSGSA-N 1 3 346.519 2.851 10 0 EFAEHO CCO[C@@H]1COCC[C@@H]1NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449238254 477501067 /nfs/dbraw/zinc/50/10/67/477501067.db2.gz QLSPDVJKIPCXEY-JRGCBEDISA-N 1 3 346.515 2.866 10 0 EFAEHO C[C@H](Cc1ccccc1)N1CCC([NH2+]CCN2CC=CCC2)CC1 ZINC000449298708 477532712 /nfs/dbraw/zinc/53/27/12/477532712.db2.gz KPUMGDBNIPHJNJ-LJQANCHMSA-N 1 3 327.516 2.934 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NCCN2CC=CCC2)CC1 ZINC000449298708 477532720 /nfs/dbraw/zinc/53/27/20/477532720.db2.gz KPUMGDBNIPHJNJ-LJQANCHMSA-N 1 3 327.516 2.934 10 0 EFAEHO Cc1cc(CCNCc2ccccc2N(C)C2CC[NH+](C)CC2)on1 ZINC000367589333 477586697 /nfs/dbraw/zinc/58/66/97/477586697.db2.gz ZLUWCOWSCOWXFS-UHFFFAOYSA-N 1 3 342.487 2.846 10 0 EFAEHO COc1cc(NCCN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)cc(OC)c1 ZINC000367614502 477600867 /nfs/dbraw/zinc/60/08/67/477600867.db2.gz HBGLVNCJMWBOMZ-GUDVDZBRSA-N 1 3 333.476 2.578 10 0 EFAEHO COc1cc(NCCN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@@H]32)cc(OC)c1 ZINC000367614502 477600873 /nfs/dbraw/zinc/60/08/73/477600873.db2.gz HBGLVNCJMWBOMZ-GUDVDZBRSA-N 1 3 333.476 2.578 10 0 EFAEHO COc1cc(NCCN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)cc(OC)c1 ZINC000367614504 477601188 /nfs/dbraw/zinc/60/11/88/477601188.db2.gz HBGLVNCJMWBOMZ-OTWHNJEPSA-N 1 3 333.476 2.578 10 0 EFAEHO COc1cc(NCCN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@H]32)cc(OC)c1 ZINC000367614504 477601194 /nfs/dbraw/zinc/60/11/94/477601194.db2.gz HBGLVNCJMWBOMZ-OTWHNJEPSA-N 1 3 333.476 2.578 10 0 EFAEHO C[NH+](C)CCCOc1ccc(CN[C@H]2CCCc3n[nH]cc32)cc1 ZINC000367737763 477664497 /nfs/dbraw/zinc/66/44/97/477664497.db2.gz POJBMJNAWWLEFK-SFHVURJKSA-N 1 3 328.460 2.907 10 0 EFAEHO CCN(C(=O)NC[C@H](C)[NH+](C)C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000459033583 477708817 /nfs/dbraw/zinc/70/88/17/477708817.db2.gz CBBOGRNFMROJEO-YQVWRLOYSA-N 1 3 346.519 2.804 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@@](O)(C3CC3)C2)CC1 ZINC000426539390 477717164 /nfs/dbraw/zinc/71/71/64/477717164.db2.gz MKIOYWSHSRHKSZ-NRFANRHFSA-N 1 3 343.515 2.565 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@@](O)(C3CC3)C2)CC1 ZINC000426539390 477717170 /nfs/dbraw/zinc/71/71/70/477717170.db2.gz MKIOYWSHSRHKSZ-NRFANRHFSA-N 1 3 343.515 2.565 10 0 EFAEHO c1cc(OCCCN2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)cc2c1OCO2 ZINC000420376195 477733761 /nfs/dbraw/zinc/73/37/61/477733761.db2.gz AIDHDPLOKBZAKY-NVXWUHKLSA-N 1 3 332.444 2.648 10 0 EFAEHO CN(C(=O)NC[C@@H]1CCC[N@@H+]1C1CCCCC1)[C@H]1CCN(C2CC2)C1 ZINC000438318248 477823048 /nfs/dbraw/zinc/82/30/48/477823048.db2.gz CYMRDYMCSSPCAG-OALUTQOASA-N 1 3 348.535 2.662 10 0 EFAEHO CN(C(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1)[C@H]1CCN(C2CC2)C1 ZINC000438318248 477823052 /nfs/dbraw/zinc/82/30/52/477823052.db2.gz CYMRDYMCSSPCAG-OALUTQOASA-N 1 3 348.535 2.662 10 0 EFAEHO CN(C)C[C@@H](Cc1ccccc1)NC(=O)C1(C[NH+](C)C)CCCCC1 ZINC000460278957 477857616 /nfs/dbraw/zinc/85/76/16/477857616.db2.gz DHUMIZKGTDBPTI-LJQANCHMSA-N 1 3 345.531 2.788 10 0 EFAEHO CCc1ccc(CN2CCCN(C3CC[NH+](CC)CC3)CC2)nc1 ZINC000420978734 477872289 /nfs/dbraw/zinc/87/22/89/477872289.db2.gz JSMSUVKWGCHNHY-UHFFFAOYSA-N 1 3 330.520 2.636 10 0 EFAEHO CC[NH+]1CCC(N2CCCN(Cc3ccc(C)nc3C)CC2)CC1 ZINC000420984019 477876955 /nfs/dbraw/zinc/87/69/55/477876955.db2.gz RXTZAQFAFDQHDU-UHFFFAOYSA-N 1 3 330.520 2.690 10 0 EFAEHO CCn1c(CNCC2(SC)CC[NH+](C)CC2)nc2ccccc21 ZINC000558494124 477880037 /nfs/dbraw/zinc/88/00/37/477880037.db2.gz ZGYKBBTZUOYFTH-UHFFFAOYSA-N 1 3 332.517 2.973 10 0 EFAEHO CCN1CCN(CCC[NH2+]Cc2ccc3nc(C)sc3c2)CC1 ZINC000494356476 477970876 /nfs/dbraw/zinc/97/08/76/477970876.db2.gz KZNMTEZYDMYTFK-UHFFFAOYSA-N 1 3 332.517 2.722 10 0 EFAEHO O=C(NC1CC([NH+]2CCCCC2)C1)[C@@H]1CCCCN1C1CCCC1 ZINC000451357357 477973118 /nfs/dbraw/zinc/97/31/18/477973118.db2.gz GMFFJFZFTVSDKN-KVZIAJEVSA-N 1 3 333.520 2.917 10 0 EFAEHO CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCCN2[C@H](C)CCC[C@H]2C)C1 ZINC000465894326 477994201 /nfs/dbraw/zinc/99/42/01/477994201.db2.gz AESVLSKESRAEMH-KURKYZTESA-N 1 3 338.540 2.623 10 0 EFAEHO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NCCN2[C@H](C)CCC[C@H]2C)C1 ZINC000465894326 477994207 /nfs/dbraw/zinc/99/42/07/477994207.db2.gz AESVLSKESRAEMH-KURKYZTESA-N 1 3 338.540 2.623 10 0 EFAEHO CN1CC[C@@]2(CC[N@H+](CCCc3nc(-c4cccs4)no3)C2)C1 ZINC000429018473 478040338 /nfs/dbraw/zinc/04/03/38/478040338.db2.gz HGXVBEBGKKANQF-QGZVFWFLSA-N 1 3 332.473 2.758 10 0 EFAEHO CN1CC[C@@]2(CC[N@@H+](CCCc3nc(-c4cccs4)no3)C2)C1 ZINC000429018473 478040349 /nfs/dbraw/zinc/04/03/49/478040349.db2.gz HGXVBEBGKKANQF-QGZVFWFLSA-N 1 3 332.473 2.758 10 0 EFAEHO CC[NH+]1CCC(N2CCCN(Cc3cc4cccnc4o3)CC2)CC1 ZINC000421367645 478057454 /nfs/dbraw/zinc/05/74/54/478057454.db2.gz FMTZQJVJWBELDI-UHFFFAOYSA-N 1 3 342.487 2.820 10 0 EFAEHO CCN1CCC([N@@H+]2CCCN(Cc3cc4cccnc4o3)CC2)CC1 ZINC000421367645 478057464 /nfs/dbraw/zinc/05/74/64/478057464.db2.gz FMTZQJVJWBELDI-UHFFFAOYSA-N 1 3 342.487 2.820 10 0 EFAEHO CCN1CCC([N@H+]2CCCN(Cc3cc4cccnc4o3)CC2)CC1 ZINC000421367645 478057468 /nfs/dbraw/zinc/05/74/68/478057468.db2.gz FMTZQJVJWBELDI-UHFFFAOYSA-N 1 3 342.487 2.820 10 0 EFAEHO COC[C@H](C)C[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000560598567 478115249 /nfs/dbraw/zinc/11/52/49/478115249.db2.gz VQDFVHSNAJXZLR-UYAOXDASSA-N 1 3 346.515 2.787 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N(C)Cc3ccc(C)o3)CC2)CC1 ZINC000561051388 478147569 /nfs/dbraw/zinc/14/75/69/478147569.db2.gz AUPTVQFBTXJRNQ-UHFFFAOYSA-N 1 3 347.503 2.743 10 0 EFAEHO CCN(Cc1ccc2c(c1)C[NH2+]CC2)C[C@H]1COc2ccccc2O1 ZINC000518989297 478203425 /nfs/dbraw/zinc/20/34/25/478203425.db2.gz KXRJGIKHJGFFLC-IBGZPJMESA-N 1 3 338.451 2.994 10 0 EFAEHO C[C@@H](CC[NH+](C)C)NC(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000489081288 478216734 /nfs/dbraw/zinc/21/67/34/478216734.db2.gz VMGRRWSCBWZSAM-PXNSSMCTSA-N 1 3 346.519 2.681 10 0 EFAEHO C[C@@H]1CN(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)CCN(C2CCC2)C1 ZINC000489414557 478243707 /nfs/dbraw/zinc/24/37/07/478243707.db2.gz ULEVKIRPQSLSNY-WELJNPPOSA-N 1 3 348.535 2.518 10 0 EFAEHO C[C@@H]1CN(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)CCN(C2CCC2)C1 ZINC000489414557 478243710 /nfs/dbraw/zinc/24/37/10/478243710.db2.gz ULEVKIRPQSLSNY-WELJNPPOSA-N 1 3 348.535 2.518 10 0 EFAEHO C[C@H]1C[C@@H](C[NH3+])CN1C(=O)NCc1ccccc1CN1CCCCC1 ZINC000570146888 478293108 /nfs/dbraw/zinc/29/31/08/478293108.db2.gz ZJAGEFLZSFQCKR-IRXDYDNUSA-N 1 3 344.503 2.551 10 0 EFAEHO C[C@@H]1C[C@@H](C[NH3+])CN1C(=O)NCc1ccccc1CN1CCCCC1 ZINC000570146889 478293616 /nfs/dbraw/zinc/29/36/16/478293616.db2.gz ZJAGEFLZSFQCKR-SJORKVTESA-N 1 3 344.503 2.551 10 0 EFAEHO COc1ccc([C@@H](CO)N(C)Cc2ccc3c(c2)C[NH2+]CC3)cc1 ZINC000520592765 478328963 /nfs/dbraw/zinc/32/89/63/478328963.db2.gz FLRHXBBECYBFNR-HXUWFJFHSA-N 1 3 326.440 2.506 10 0 EFAEHO C[C@@H]1CN(C(=O)NC2CC([NH+]3CCCCC3)C2)CCN(C2CCC2)C1 ZINC000490349522 478333629 /nfs/dbraw/zinc/33/36/29/478333629.db2.gz ORCNIHBDRJYYHQ-MUYFXNHWSA-N 1 3 348.535 2.519 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)Nc3csc(C)n3)CC2)CC1 ZINC000581675620 478417976 /nfs/dbraw/zinc/41/79/76/478417976.db2.gz YSCASPPPIROTGG-UHFFFAOYSA-N 1 3 336.505 2.586 10 0 EFAEHO C[C@H]([NH2+]CCCN1CCN(c2ccncc2)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000527648948 478460037 /nfs/dbraw/zinc/46/00/37/478460037.db2.gz ABEHALVCBCMVBY-VDGAXYAQSA-N 1 3 328.504 2.618 10 0 EFAEHO C[C@H]1CCC[N@H+](CCCCNC(=O)CCN(C)c2ccncc2)C1 ZINC000540927210 478511950 /nfs/dbraw/zinc/51/19/50/478511950.db2.gz LBPCCXBNZPQLAK-KRWDZBQOSA-N 1 3 332.492 2.536 10 0 EFAEHO C[C@H]1CCC[N@@H+](CCCCNC(=O)CCN(C)c2ccncc2)C1 ZINC000540927210 478511961 /nfs/dbraw/zinc/51/19/61/478511961.db2.gz LBPCCXBNZPQLAK-KRWDZBQOSA-N 1 3 332.492 2.536 10 0 EFAEHO COC(=O)[C@@H]1C[C@@H]1[C@H](C)[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000594928410 478590833 /nfs/dbraw/zinc/59/08/33/478590833.db2.gz VUVWMWPZUJIUMA-IAOVAPTHSA-N 1 3 336.501 2.747 10 0 EFAEHO COc1ccc(CN2CC[C@@H]2CNC2CC[NH+](C(C)C)CC2)cc1 ZINC000527965510 478591937 /nfs/dbraw/zinc/59/19/37/478591937.db2.gz DSYJTQCVNZWUBX-LJQANCHMSA-N 1 3 331.504 2.732 10 0 EFAEHO c1oc(-c2ccccc2)nc1CNC1CCC([NH+]2CCNCC2)CC1 ZINC000571622990 478637966 /nfs/dbraw/zinc/63/79/66/478637966.db2.gz MYXBEAKLLPDFFM-UHFFFAOYSA-N 1 3 340.471 2.648 10 0 EFAEHO CN1CCC[C@H](CNC(=O)CCCC[NH+](C)C)[C@H]1c1cccs1 ZINC000571848324 478688098 /nfs/dbraw/zinc/68/80/98/478688098.db2.gz QCYFLXIAKKZGKD-QAPCUYQASA-N 1 3 337.533 2.979 10 0 EFAEHO CC[NH+](CC)CCO[C@H]1CCN(C[C@H](OC)c2ccc(F)cc2)C1 ZINC000528400927 478755382 /nfs/dbraw/zinc/75/53/82/478755382.db2.gz TUXBTTPODWDDLP-OALUTQOASA-N 1 3 338.467 2.946 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCC1CCN(C[C@H](O)CC2(O)CCC2)CC1 ZINC000528404393 478758937 /nfs/dbraw/zinc/75/89/37/478758937.db2.gz NIINOEZMNIFXSS-PKOBYXMFSA-N 1 3 338.536 2.629 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCC1CCN(C[C@H](O)CC2(O)CCC2)CC1 ZINC000528404393 478758940 /nfs/dbraw/zinc/75/89/40/478758940.db2.gz NIINOEZMNIFXSS-PKOBYXMFSA-N 1 3 338.536 2.629 10 0 EFAEHO CC(C)(CNC(=O)CCN1CCc2ccccc2C1)[NH+]1CCCCC1 ZINC000572184540 478773394 /nfs/dbraw/zinc/77/33/94/478773394.db2.gz YQOWTRGKRMHHDQ-UHFFFAOYSA-N 1 3 343.515 2.816 10 0 EFAEHO COCCOC[C@@H](C)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499255721 478776203 /nfs/dbraw/zinc/77/62/03/478776203.db2.gz ZCMPNZCQNJEBAR-AFYVEPGGSA-N 1 3 332.488 2.823 10 0 EFAEHO COCCOC[C@@H](C)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499255721 478776207 /nfs/dbraw/zinc/77/62/07/478776207.db2.gz ZCMPNZCQNJEBAR-AFYVEPGGSA-N 1 3 332.488 2.823 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1CNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000500526446 478794312 /nfs/dbraw/zinc/79/43/12/478794312.db2.gz PJBSEIABWYSTJV-OTWHNJEPSA-N 1 3 344.503 2.605 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1CNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000500526446 478794321 /nfs/dbraw/zinc/79/43/21/478794321.db2.gz PJBSEIABWYSTJV-OTWHNJEPSA-N 1 3 344.503 2.605 10 0 EFAEHO Cc1cccc(C(=O)NCCN[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000564824530 478822831 /nfs/dbraw/zinc/82/28/31/478822831.db2.gz HBPDZIPDIOTHBG-CEXWTWQISA-N 1 3 329.488 2.625 10 0 EFAEHO Cc1nc(CCN[C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c(C)o1 ZINC000572392046 478825201 /nfs/dbraw/zinc/82/52/01/478825201.db2.gz FJEPGMDOJLEMSV-IEBWSBKVSA-N 1 3 327.428 2.679 10 0 EFAEHO CN(C)[C@H](CNC(=O)[C@@H]1CCCCCC[C@@H]1[NH3+])Cc1ccccc1 ZINC000564889484 478848610 /nfs/dbraw/zinc/84/86/10/478848610.db2.gz DMXDWDMIXSZNMR-OTWHNJEPSA-N 1 3 331.504 2.573 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](N[C@@H]2C[C@@H](OCC)[C@H]2SC)[C@@H](C)C1 ZINC000592393815 478882388 /nfs/dbraw/zinc/88/23/88/478882388.db2.gz DCPOPYIJJIHYDT-AVEIZBFRSA-N 1 3 344.565 2.622 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](N[C@@H]2C[C@@H](OCC)[C@H]2SC)[C@@H](C)C1 ZINC000592393815 478882390 /nfs/dbraw/zinc/88/23/90/478882390.db2.gz DCPOPYIJJIHYDT-AVEIZBFRSA-N 1 3 344.565 2.622 10 0 EFAEHO C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccccc2CC[NH3+])C1 ZINC000565151332 478926494 /nfs/dbraw/zinc/92/64/94/478926494.db2.gz LIDHWOUREMZCTG-LPHOPBHVSA-N 1 3 337.467 2.753 10 0 EFAEHO CCC[C@H](C)NC(=O)[C@H]1CCCN(Cc2ccc3c(c2)C[NH2+]CC3)C1 ZINC000572888538 478945522 /nfs/dbraw/zinc/94/55/22/478945522.db2.gz VQZADHMGMPPSGQ-LPHOPBHVSA-N 1 3 343.515 2.849 10 0 EFAEHO N[C@H]1CCCCC[C@H]1[NH2+]Cc1ccc(Cn2ccccc2=O)cc1 ZINC000583806465 478945901 /nfs/dbraw/zinc/94/59/01/478945901.db2.gz IZBUEPIXTHNBQD-RBUKOAKNSA-N 1 3 325.456 2.646 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@@H]1CCc2cnn(C(C)C)c2C1 ZINC000572951484 478957126 /nfs/dbraw/zinc/95/71/26/478957126.db2.gz ZOORGOVHWHMXQC-CZUORRHYSA-N 1 3 327.476 2.834 10 0 EFAEHO O[C@@H]1CCN(C2CC[NH+](CCCSCc3ccccc3)CC2)C1 ZINC000595864922 479039556 /nfs/dbraw/zinc/03/95/56/479039556.db2.gz XGJXGALPMPLRGE-LJQANCHMSA-N 1 3 334.529 2.841 10 0 EFAEHO [NH3+]C[C@@H]1c2ccccc2CCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000565718033 479070326 /nfs/dbraw/zinc/07/03/26/479070326.db2.gz DWWJVOIDHBMDJB-OAQYLSRUSA-N 1 3 349.478 2.981 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[NH2+][C@H](C)C1=CCN(C)CC1 ZINC000573835381 479154401 /nfs/dbraw/zinc/15/44/01/479154401.db2.gz ZFKZDVYBJKSLCE-SJLPKXTDSA-N 1 3 332.488 2.790 10 0 EFAEHO Clc1ccc(-n2cc(CNCC[C@H]3CC[NH2+]C3)nn2)c(Cl)c1 ZINC000574052996 479206395 /nfs/dbraw/zinc/20/63/95/479206395.db2.gz BNDJVGKCSXVXMW-LLVKDONJSA-N 1 3 340.258 2.663 10 0 EFAEHO FC(F)(F)[C@@H](C[NH2+]C1CCN(c2ccncc2)CC1)n1cccn1 ZINC000529636594 479232982 /nfs/dbraw/zinc/23/29/82/479232982.db2.gz DKPUPZIFQCPSJZ-OAHLLOKOSA-N 1 3 339.365 2.640 10 0 EFAEHO C[C@H]([NH3+])C[C@H](C)NCCc1ccc(I)cc1 ZINC000596653993 479373348 /nfs/dbraw/zinc/37/33/48/479373348.db2.gz MWWIIEGQCMDEKR-QWRGUYRKSA-N 1 3 332.229 2.549 10 0 EFAEHO C[C@H](N)C[C@H](C)[NH2+]CCc1ccc(I)cc1 ZINC000596653993 479373354 /nfs/dbraw/zinc/37/33/54/479373354.db2.gz MWWIIEGQCMDEKR-QWRGUYRKSA-N 1 3 332.229 2.549 10 0 EFAEHO CN(C)[C@@H](CC(=O)N1CCC2(C1)CC[NH+](C)CC2)c1ccccc1 ZINC000614963764 479562159 /nfs/dbraw/zinc/56/21/59/479562159.db2.gz QISSKCDYJCKHHL-SFHVURJKSA-N 1 3 329.488 2.624 10 0 EFAEHO C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@H]2CCCN(C)C2)CC1 ZINC000604814144 479575517 /nfs/dbraw/zinc/57/55/17/479575517.db2.gz DBLQUDMZAZFUSA-APWZRJJASA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@H]2CCCN(C)C2)CC1 ZINC000604814145 479575994 /nfs/dbraw/zinc/57/59/94/479575994.db2.gz DBLQUDMZAZFUSA-LPHOPBHVSA-N 1 3 344.503 2.605 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@](C)(CC)C3CC3)CC2)CC1 ZINC000618959813 479653291 /nfs/dbraw/zinc/65/32/91/479653291.db2.gz BPVYOZKJQYSSEP-HXUWFJFHSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]Cc2c(C(F)(F)F)nc3n2CCCC3)CCN1C ZINC000606445474 479687991 /nfs/dbraw/zinc/68/79/91/479687991.db2.gz QNQOWCAOHFIWCU-NWDGAFQWSA-N 1 3 330.398 2.811 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)CC1CCC(F)(F)CC1 ZINC000628050403 479746336 /nfs/dbraw/zinc/74/63/36/479746336.db2.gz COJJONCGDAFJEZ-AWEZNQCLSA-N 1 3 333.467 2.590 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)CC1CCC(F)(F)CC1 ZINC000628050403 479746338 /nfs/dbraw/zinc/74/63/38/479746338.db2.gz COJJONCGDAFJEZ-AWEZNQCLSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)CC[N@@H+]1C ZINC000630861894 479749537 /nfs/dbraw/zinc/74/95/37/479749537.db2.gz ZNEVXRLMBFKGKG-RYQLBKOJSA-N 1 3 349.544 2.807 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)CC[N@H+]1C ZINC000630861894 479749541 /nfs/dbraw/zinc/74/95/41/479749541.db2.gz ZNEVXRLMBFKGKG-RYQLBKOJSA-N 1 3 349.544 2.807 10 0 EFAEHO CN1CCC(C[NH2+]C[C@@]2(C)CCCS2)(N2CCCCC2)CC1 ZINC000628220585 479818221 /nfs/dbraw/zinc/81/82/21/479818221.db2.gz BKGUEVGCYQWYRF-QGZVFWFLSA-N 1 3 325.566 2.812 10 0 EFAEHO CN(C)CCN1CCC([NH2+]Cc2ccccc2CC(F)(F)F)CC1 ZINC000631039784 479850666 /nfs/dbraw/zinc/85/06/66/479850666.db2.gz LUTAKNUWVSXEFQ-UHFFFAOYSA-N 1 3 343.437 2.907 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)CC[N@@H+]1C ZINC000631655140 480201803 /nfs/dbraw/zinc/20/18/03/480201803.db2.gz ANSGCNLJJJVJEF-RSPOEFSDSA-N 1 3 343.515 2.886 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)CC[N@H+]1C ZINC000631655140 480201810 /nfs/dbraw/zinc/20/18/10/480201810.db2.gz ANSGCNLJJJVJEF-RSPOEFSDSA-N 1 3 343.515 2.886 10 0 EFAEHO C[C@@H](N[C@@H](C)c1ccc(OCC[NH+](C)C)cc1)[C@@H](O)C(F)(F)F ZINC000631716743 480235705 /nfs/dbraw/zinc/23/57/05/480235705.db2.gz BXENEBYLTJLDPJ-YWPYICTPSA-N 1 3 334.382 2.589 10 0 EFAEHO COc1ccc([C@H](CN[C@@H]2CC[N@H+](C)C(C)(C)C2)N(C)C)cc1OC ZINC000623338386 480238565 /nfs/dbraw/zinc/23/85/65/480238565.db2.gz XYLBZHKNSPUAOQ-SJORKVTESA-N 1 3 349.519 2.769 10 0 EFAEHO COc1ccc([C@H](CN[C@@H]2CC[N@@H+](C)C(C)(C)C2)N(C)C)cc1OC ZINC000623338386 480238569 /nfs/dbraw/zinc/23/85/69/480238569.db2.gz XYLBZHKNSPUAOQ-SJORKVTESA-N 1 3 349.519 2.769 10 0 EFAEHO COc1ccc([C@H](C[NH2+][C@@H]2CCN(C)C(C)(C)C2)N(C)C)cc1OC ZINC000623338386 480238580 /nfs/dbraw/zinc/23/85/80/480238580.db2.gz XYLBZHKNSPUAOQ-SJORKVTESA-N 1 3 349.519 2.769 10 0 EFAEHO C[C@H](CNCC1([NH3+])CCOCC1)c1cccc(Br)c1 ZINC000629387428 480242614 /nfs/dbraw/zinc/24/26/14/480242614.db2.gz GTGYVERRJBQZHR-GFCCVEGCSA-N 1 3 327.266 2.650 10 0 EFAEHO CN1CC[C@@H]([NH2+]C[C@H](c2ccccc2)N2CCOCC2)CC1(C)C ZINC000623346326 480243515 /nfs/dbraw/zinc/24/35/15/480243515.db2.gz MQRDBNPIOZKJNV-RTBURBONSA-N 1 3 331.504 2.522 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@]1(C)C[C@@H]1c1ccccc1 ZINC000617502623 480245104 /nfs/dbraw/zinc/24/51/04/480245104.db2.gz WNRALGPLZJMTHX-HQRMLTQVSA-N 1 3 331.504 2.568 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@]1(C)C[C@@H]1c1ccccc1 ZINC000617502623 480245111 /nfs/dbraw/zinc/24/51/11/480245111.db2.gz WNRALGPLZJMTHX-HQRMLTQVSA-N 1 3 331.504 2.568 10 0 EFAEHO Cc1ccc2oc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc2c1 ZINC000617505180 480246850 /nfs/dbraw/zinc/24/68/50/480246850.db2.gz XHTHIYHJDMIPJJ-HNNXBMFYSA-N 1 3 331.460 2.743 10 0 EFAEHO Cc1ccc2oc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc2c1 ZINC000617505180 480246853 /nfs/dbraw/zinc/24/68/53/480246853.db2.gz XHTHIYHJDMIPJJ-HNNXBMFYSA-N 1 3 331.460 2.743 10 0 EFAEHO Cc1c2cccc(F)c2oc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617504253 480247093 /nfs/dbraw/zinc/24/70/93/480247093.db2.gz MNDQWWKANCWJJL-ZDUSSCGKSA-N 1 3 349.450 2.882 10 0 EFAEHO Cc1c2cccc(F)c2oc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617504253 480247096 /nfs/dbraw/zinc/24/70/96/480247096.db2.gz MNDQWWKANCWJJL-ZDUSSCGKSA-N 1 3 349.450 2.882 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@]1(C)CCc2ccccc2C1 ZINC000617505740 480247974 /nfs/dbraw/zinc/24/79/74/480247974.db2.gz OETQVOOZDIOEIG-LAUBAEHRSA-N 1 3 345.531 2.570 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@]1(C)CCc2ccccc2C1 ZINC000617505740 480247982 /nfs/dbraw/zinc/24/79/82/480247982.db2.gz OETQVOOZDIOEIG-LAUBAEHRSA-N 1 3 345.531 2.570 10 0 EFAEHO Cc1ccc2cccc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c2n1 ZINC000617505449 480248234 /nfs/dbraw/zinc/24/82/34/480248234.db2.gz CSBHOWQUOWMCRS-INIZCTEOSA-N 1 3 342.487 2.545 10 0 EFAEHO Cc1ccc2cccc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c2n1 ZINC000617505449 480248240 /nfs/dbraw/zinc/24/82/40/480248240.db2.gz CSBHOWQUOWMCRS-INIZCTEOSA-N 1 3 342.487 2.545 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cc2cccc(F)c2o1 ZINC000617505438 480248260 /nfs/dbraw/zinc/24/82/60/480248260.db2.gz CJXJQYWOYNCQMB-ZDUSSCGKSA-N 1 3 335.423 2.574 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cc2cccc(F)c2o1 ZINC000617505438 480248265 /nfs/dbraw/zinc/24/82/65/480248265.db2.gz CJXJQYWOYNCQMB-ZDUSSCGKSA-N 1 3 335.423 2.574 10 0 EFAEHO Cc1ccc([C@@H]2C[C@H]2C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1C ZINC000617503685 480248323 /nfs/dbraw/zinc/24/83/23/480248323.db2.gz UOKLMFMJTDVJQT-YSIASYRMSA-N 1 3 345.531 2.795 10 0 EFAEHO Cc1ccc([C@@H]2C[C@H]2C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1C ZINC000617503685 480248326 /nfs/dbraw/zinc/24/83/26/480248326.db2.gz UOKLMFMJTDVJQT-YSIASYRMSA-N 1 3 345.531 2.795 10 0 EFAEHO Cc1ccc(C(C)(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000617505836 480248867 /nfs/dbraw/zinc/24/88/67/480248867.db2.gz RNADQAYEFYZMIG-KRWDZBQOSA-N 1 3 333.520 2.661 10 0 EFAEHO Cc1ccc(C(C)(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000617505836 480248870 /nfs/dbraw/zinc/24/88/70/480248870.db2.gz RNADQAYEFYZMIG-KRWDZBQOSA-N 1 3 333.520 2.661 10 0 EFAEHO C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CCN(C)C(C)(C)C3)cn2)C[C@H](C)O1 ZINC000623358130 480249185 /nfs/dbraw/zinc/24/91/85/480249185.db2.gz PASWMDSQTOKUHM-SOLBZPMBSA-N 1 3 346.519 2.658 10 0 EFAEHO Cc1ccsc1[C@@H]1C[C@H]1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617506505 480249699 /nfs/dbraw/zinc/24/96/99/480249699.db2.gz QBNJETOTJNSJNC-ARFHVFGLSA-N 1 3 337.533 2.548 10 0 EFAEHO Cc1ccsc1[C@@H]1C[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617506505 480249706 /nfs/dbraw/zinc/24/97/06/480249706.db2.gz QBNJETOTJNSJNC-ARFHVFGLSA-N 1 3 337.533 2.548 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C/C=C\c1ccc(F)cc1 ZINC000617505987 480251367 /nfs/dbraw/zinc/25/13/67/480251367.db2.gz XEOVVNHLTUBILG-WRLNGNIRSA-N 1 3 335.467 2.617 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C/C=C\c1ccc(F)cc1 ZINC000617505987 480251374 /nfs/dbraw/zinc/25/13/74/480251374.db2.gz XEOVVNHLTUBILG-WRLNGNIRSA-N 1 3 335.467 2.617 10 0 EFAEHO C[C@@H](OC1CCCCCC1)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617506441 480251653 /nfs/dbraw/zinc/25/16/53/480251653.db2.gz NMMRWTKQNBJUGN-DLBZAZTESA-N 1 3 341.540 2.503 10 0 EFAEHO C[C@@H](OC1CCCCCC1)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617506441 480251657 /nfs/dbraw/zinc/25/16/57/480251657.db2.gz NMMRWTKQNBJUGN-DLBZAZTESA-N 1 3 341.540 2.503 10 0 EFAEHO COc1cc(OC)c(CCN[C@@H]2CC[N@H+](C)C(C)(C)C2)c(OC)c1 ZINC000623410275 480269080 /nfs/dbraw/zinc/26/90/80/480269080.db2.gz IIKNSHUFPRFZOS-CQSZACIVSA-N 1 3 336.476 2.717 10 0 EFAEHO COc1cc(OC)c(CCN[C@@H]2CC[N@@H+](C)C(C)(C)C2)c(OC)c1 ZINC000623410275 480269085 /nfs/dbraw/zinc/26/90/85/480269085.db2.gz IIKNSHUFPRFZOS-CQSZACIVSA-N 1 3 336.476 2.717 10 0 EFAEHO COC1CCN(C2(C[NH2+][C@@H]3CCN(C)C(C)(C)C3)CCCC2)CC1 ZINC000623410372 480269429 /nfs/dbraw/zinc/26/94/29/480269429.db2.gz MFWNXMNMVGQSHZ-QGZVFWFLSA-N 1 3 337.552 2.872 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@H](N[C@H]3CC[N@H+](C)C(C)(C)C3)C2)c1 ZINC000623439741 480284832 /nfs/dbraw/zinc/28/48/32/480284832.db2.gz WPLFCHOPPKVZSR-HOTGVXAUSA-N 1 3 347.503 2.745 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@H](N[C@H]3CC[N@@H+](C)C(C)(C)C3)C2)c1 ZINC000623439741 480284835 /nfs/dbraw/zinc/28/48/35/480284835.db2.gz WPLFCHOPPKVZSR-HOTGVXAUSA-N 1 3 347.503 2.745 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCC[C@H](C2CC[NH2+]CC2)C1)c1ccccc1 ZINC000631829604 480287741 /nfs/dbraw/zinc/28/77/41/480287741.db2.gz VUSWCIDTXRLSFZ-HLIPFELVSA-N 1 3 343.515 2.964 10 0 EFAEHO C[C@H](N)[C@H](Cc1ccccc1)[NH2+]C[C@H](n1cccn1)C(F)(F)F ZINC000629514087 480291021 /nfs/dbraw/zinc/29/10/21/480291021.db2.gz JAWHWEQJZWYBMX-QEJZJMRPSA-N 1 3 326.366 2.535 10 0 EFAEHO Cc1cc([C@@H](C)[NH2+]CC2(N)CCOCC2)sc1Br ZINC000629522098 480293166 /nfs/dbraw/zinc/29/31/66/480293166.db2.gz XKCJFGVRXBGDPG-SNVBAGLBSA-N 1 3 333.295 2.978 10 0 EFAEHO NC1(C[NH2+][C@H]2CCc3cc(Br)ccc32)CCOCC1 ZINC000629521000 480293711 /nfs/dbraw/zinc/29/37/11/480293711.db2.gz KINXUNSEJQJPQH-AWEZNQCLSA-N 1 3 325.250 2.534 10 0 EFAEHO Cc1cc([C@H](C)[NH2+]CC2(N)CCOCC2)sc1Br ZINC000629522097 480293753 /nfs/dbraw/zinc/29/37/53/480293753.db2.gz XKCJFGVRXBGDPG-JTQLQIEISA-N 1 3 333.295 2.978 10 0 EFAEHO C[C@@H]1CN(CCC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1C[NH3+] ZINC000631840730 480294915 /nfs/dbraw/zinc/29/49/15/480294915.db2.gz VASJALTVYOMJPB-VXGBXAGGSA-N 1 3 329.366 2.561 10 0 EFAEHO C[C@@H]1C[N@H+](CCC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1CN ZINC000631840730 480294921 /nfs/dbraw/zinc/29/49/21/480294921.db2.gz VASJALTVYOMJPB-VXGBXAGGSA-N 1 3 329.366 2.561 10 0 EFAEHO C[C@@H]1C[N@@H+](CCC(=O)Nc2cccc(C(F)(F)F)c2)C[C@H]1CN ZINC000631840730 480294925 /nfs/dbraw/zinc/29/49/25/480294925.db2.gz VASJALTVYOMJPB-VXGBXAGGSA-N 1 3 329.366 2.561 10 0 EFAEHO C[NH2+]CCOCCN[C@H](C)c1sc(Cc2ccccc2)nc1C ZINC000629529140 480295816 /nfs/dbraw/zinc/29/58/16/480295816.db2.gz SKZOWECTDRZQTA-CQSZACIVSA-N 1 3 333.501 2.929 10 0 EFAEHO C[NH2+]CCOCCN[C@H]1C[C@H](C)c2c1cccc2Br ZINC000629528731 480296996 /nfs/dbraw/zinc/29/69/96/480296996.db2.gz HWWBJQLBBNEDLU-FZMZJTMJSA-N 1 3 327.266 2.823 10 0 EFAEHO [NH3+]CCCOCCN[C@H]1CCc2c1ccc(F)c2Br ZINC000629538470 480297741 /nfs/dbraw/zinc/29/77/41/480297741.db2.gz NAJFVKWYMWHOIW-ZDUSSCGKSA-N 1 3 331.229 2.531 10 0 EFAEHO Cc1cc(Br)cc2c1[C@H](NCCOCCC[NH3+])CC2 ZINC000629541416 480297989 /nfs/dbraw/zinc/29/79/89/480297989.db2.gz ZUOXQQKKRCBMAH-CQSZACIVSA-N 1 3 327.266 2.700 10 0 EFAEHO [NH3+]CCCOCCN[C@@H]1CCCc2cc(Br)ccc21 ZINC000629535283 480298721 /nfs/dbraw/zinc/29/87/21/480298721.db2.gz BXISFOHBTOUXLZ-OAHLLOKOSA-N 1 3 327.266 2.782 10 0 EFAEHO C[C@H](N)[C@@H]1COCC[C@@H]1[NH2+]CCc1c[nH]c2cc(F)c(Cl)cc12 ZINC000629544852 480299915 /nfs/dbraw/zinc/29/99/15/480299915.db2.gz JUZOZNRZVRQOGP-NKFCBESUSA-N 1 3 339.842 2.845 10 0 EFAEHO CCOCCN(C[C@@H]1CCC2(C[NH2+]C2)O1)[C@H]1CCc2ccccc21 ZINC000629573312 480313677 /nfs/dbraw/zinc/31/36/77/480313677.db2.gz FBQDSECLLVCPPK-HKUYNNGSSA-N 1 3 330.472 2.533 10 0 EFAEHO CCOCC[N@H+](C[C@@H]1CCC2(CNC2)O1)[C@H]1CCc2ccccc21 ZINC000629573312 480313681 /nfs/dbraw/zinc/31/36/81/480313681.db2.gz FBQDSECLLVCPPK-HKUYNNGSSA-N 1 3 330.472 2.533 10 0 EFAEHO CCOCC[N@@H+](C[C@@H]1CCC2(CNC2)O1)[C@H]1CCc2ccccc21 ZINC000629573312 480313689 /nfs/dbraw/zinc/31/36/89/480313689.db2.gz FBQDSECLLVCPPK-HKUYNNGSSA-N 1 3 330.472 2.533 10 0 EFAEHO C[N@@H+]1CC[C@@H](NC[C@H](CO)Cc2ccc(F)c(F)c2)CC1(C)C ZINC000623506156 480317213 /nfs/dbraw/zinc/31/72/13/480317213.db2.gz FBCYQGKTDZTVJV-HUUCEWRRSA-N 1 3 326.431 2.578 10 0 EFAEHO C[N@H+]1CC[C@@H](NC[C@H](CO)Cc2ccc(F)c(F)c2)CC1(C)C ZINC000623506156 480317222 /nfs/dbraw/zinc/31/72/22/480317222.db2.gz FBCYQGKTDZTVJV-HUUCEWRRSA-N 1 3 326.431 2.578 10 0 EFAEHO Cc1cc(C)cc(OCCN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)c1 ZINC000629590458 480319741 /nfs/dbraw/zinc/31/97/41/480319741.db2.gz CCAIOKZIQUBOPZ-LJQANCHMSA-N 1 3 332.488 2.773 10 0 EFAEHO C[N@@H+]1CC[C@@H](N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)CC1(C)C ZINC000623515546 480322554 /nfs/dbraw/zinc/32/25/54/480322554.db2.gz FQXIVRFIBWQYAE-IAGOWNOFSA-N 1 3 330.476 2.755 10 0 EFAEHO C[N@H+]1CC[C@@H](N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)CC1(C)C ZINC000623515546 480322559 /nfs/dbraw/zinc/32/25/59/480322559.db2.gz FQXIVRFIBWQYAE-IAGOWNOFSA-N 1 3 330.476 2.755 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)CC1(C)C ZINC000623515832 480322649 /nfs/dbraw/zinc/32/26/49/480322649.db2.gz RUQSRXMJGLOGPI-RBUKOAKNSA-N 1 3 343.515 2.683 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)CC1(C)C ZINC000623515832 480322655 /nfs/dbraw/zinc/32/26/55/480322655.db2.gz RUQSRXMJGLOGPI-RBUKOAKNSA-N 1 3 343.515 2.683 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2C[C@@H](OC(C)(C)C)[C@H]2n2cccn2)CC1(C)C ZINC000623542412 480333646 /nfs/dbraw/zinc/33/36/46/480333646.db2.gz ZOELVBSWHPDESU-HZMVEIRTSA-N 1 3 334.508 2.843 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2C[C@@H](OC(C)(C)C)[C@H]2n2cccn2)CC1(C)C ZINC000623542412 480333651 /nfs/dbraw/zinc/33/36/51/480333651.db2.gz ZOELVBSWHPDESU-HZMVEIRTSA-N 1 3 334.508 2.843 10 0 EFAEHO COc1cc(CN[C@@H](C)CN(C)CCC[NH+](C)C)ccc1Cl ZINC000623563454 480341513 /nfs/dbraw/zinc/34/15/13/480341513.db2.gz YUMMUVLHBGWUGL-AWEZNQCLSA-N 1 3 327.900 2.710 10 0 EFAEHO CC(C)OC[C@H](O)CNCc1cccc(C[NH+]2CCCCCC2)c1 ZINC000644532400 480420649 /nfs/dbraw/zinc/42/06/49/480420649.db2.gz FNPSPCIKHQPLDX-HXUWFJFHSA-N 1 3 334.504 2.938 10 0 EFAEHO CN1CCC[C@@H](NC(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)C1 ZINC000617932359 480431897 /nfs/dbraw/zinc/43/18/97/480431897.db2.gz ZNYUCIPZBZKFGO-LJQANCHMSA-N 1 3 344.503 2.931 10 0 EFAEHO C[C@H](c1ccccc1)[NH+]1CCC(NC[C@@H](O)C[C@](C)(O)C2CC2)CC1 ZINC000634704503 480442823 /nfs/dbraw/zinc/44/28/23/480442823.db2.gz LPNHGIYPWCCVJE-CZAAIQMYSA-N 1 3 346.515 2.714 10 0 EFAEHO CC(C)(CNC[C@@]1(O)CC[N@H+](Cc2ccccc2)C1)C(F)(F)F ZINC000634713673 480456395 /nfs/dbraw/zinc/45/63/95/480456395.db2.gz ZTCKXSRHYKEDHX-INIZCTEOSA-N 1 3 330.394 2.802 10 0 EFAEHO CC(C)(CNC[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)C(F)(F)F ZINC000634713673 480456402 /nfs/dbraw/zinc/45/64/02/480456402.db2.gz ZTCKXSRHYKEDHX-INIZCTEOSA-N 1 3 330.394 2.802 10 0 EFAEHO C[NH+]1CCC(C)(CNCc2ccnn2CCc2ccccc2)CC1 ZINC000621344008 480464362 /nfs/dbraw/zinc/46/43/62/480464362.db2.gz XNOCQIIFITXRNP-UHFFFAOYSA-N 1 3 326.488 2.947 10 0 EFAEHO CCC[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(=O)NC[C@@H](C)N(C)C ZINC000623975382 480549740 /nfs/dbraw/zinc/54/97/40/480549740.db2.gz DECOBBPBMJIYCD-BHIYHBOVSA-N 1 3 331.504 2.601 10 0 EFAEHO CCC[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)NC[C@@H](C)N(C)C ZINC000623975382 480549743 /nfs/dbraw/zinc/54/97/43/480549743.db2.gz DECOBBPBMJIYCD-BHIYHBOVSA-N 1 3 331.504 2.601 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@@H]1CC[C@@H](C)[NH2+]C1)c1ccccc1 ZINC000626921464 480581294 /nfs/dbraw/zinc/58/12/94/480581294.db2.gz ATRRWJHIIUGYEV-KBAYOESNSA-N 1 3 332.492 2.509 10 0 EFAEHO C[C@H]1CC[C@H](NC(=O)NCc2ccccc2CN2CCCCC2)C[NH2+]1 ZINC000626926786 480584775 /nfs/dbraw/zinc/58/47/75/480584775.db2.gz DRZDWYCNBGBTFM-LPHOPBHVSA-N 1 3 344.503 2.612 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N[C@H]2CC[C@H](C)[NH2+]C2)N2CCCC2)cc1 ZINC000626956552 480597453 /nfs/dbraw/zinc/59/74/53/480597453.db2.gz DUQSNUOWXABOHX-WDSOQIARSA-N 1 3 344.503 2.572 10 0 EFAEHO CC[C@@H]1[NH2+]CC[C@H]1NC(=O)NCC(C)(C)N[C@@H](C)c1ccccc1 ZINC000626978861 480607791 /nfs/dbraw/zinc/60/77/91/480607791.db2.gz XXNJXSPJUFMCAV-BHYGNILZSA-N 1 3 332.492 2.556 10 0 EFAEHO CC[C@@H]1[NH2+]CC[C@H]1NC(=O)N[C@@H](CN1CCCCC1)c1ccccc1 ZINC000626979397 480608382 /nfs/dbraw/zinc/60/83/82/480608382.db2.gz YKQPNMGOMWUDNG-OTWHNJEPSA-N 1 3 344.503 2.653 10 0 EFAEHO CC[C@@H]1[NH2+]CC[C@H]1NC(=O)N[C@H](CN1CCCCC1)c1ccccc1 ZINC000626979396 480608833 /nfs/dbraw/zinc/60/88/33/480608833.db2.gz YKQPNMGOMWUDNG-IPMKNSEASA-N 1 3 344.503 2.653 10 0 EFAEHO CC[C@@H]1[NH2+]CC[C@H]1NC(=O)NC1CCN([C@H](C)c2ccccc2)CC1 ZINC000626979634 480608945 /nfs/dbraw/zinc/60/89/45/480608945.db2.gz GCUUGONEHAOGEM-AYOQOUSVSA-N 1 3 344.503 2.652 10 0 EFAEHO CC[C@@H]1[NH2+]CC[C@H]1NC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 ZINC000626979635 480609078 /nfs/dbraw/zinc/60/90/78/480609078.db2.gz GCUUGONEHAOGEM-ZYSHUDEJSA-N 1 3 344.503 2.652 10 0 EFAEHO CC[NH+]1CCC(NC[C@@H]2CN(c3ccc(Cl)cc3)CCO2)CC1 ZINC000624118456 480617100 /nfs/dbraw/zinc/61/71/00/480617100.db2.gz IFDLWBLPLXBOCP-GOSISDBHSA-N 1 3 337.895 2.619 10 0 EFAEHO COc1cc2nccc(N3CCC[C@@H]4C[NH2+]CC[C@H]43)c2cc1OC ZINC000630386137 480693644 /nfs/dbraw/zinc/69/36/44/480693644.db2.gz WLPCTGXXXBZGCG-CZUORRHYSA-N 1 3 327.428 2.830 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)NC[C@H]1CC[N@@H+]1C1CCCCC1 ZINC000624323935 480708484 /nfs/dbraw/zinc/70/84/84/480708484.db2.gz DBSDJHICVCIAHW-SJORKVTESA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000624323935 480708489 /nfs/dbraw/zinc/70/84/89/480708489.db2.gz DBSDJHICVCIAHW-SJORKVTESA-N 1 3 336.524 2.565 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)CC[N@@H+]1C ZINC000632924497 480800175 /nfs/dbraw/zinc/80/01/75/480800175.db2.gz WYJHMUILFLJQSQ-YESZJQIVSA-N 1 3 337.895 2.789 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)CC[N@H+]1C ZINC000632924497 480800182 /nfs/dbraw/zinc/80/01/82/480800182.db2.gz WYJHMUILFLJQSQ-YESZJQIVSA-N 1 3 337.895 2.789 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](CN2CCCC2)c2ccccc2)CC[N@@H+]1C ZINC000630681678 480841475 /nfs/dbraw/zinc/84/14/75/480841475.db2.gz LEBSKIOLJNPEPQ-IPMKNSEASA-N 1 3 329.488 2.670 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](CN2CCCC2)c2ccccc2)CC[N@H+]1C ZINC000630681678 480841478 /nfs/dbraw/zinc/84/14/78/480841478.db2.gz LEBSKIOLJNPEPQ-IPMKNSEASA-N 1 3 329.488 2.670 10 0 EFAEHO CC[C@@H]1CCCCN1CCNC(=O)N1CCC(CC)([NH+](C)C)CC1 ZINC000633006372 480844543 /nfs/dbraw/zinc/84/45/43/480844543.db2.gz SUOUDEBWALMHNB-QGZVFWFLSA-N 1 3 338.540 2.767 10 0 EFAEHO O=C(C[C@@H]1CC[NH2+]C1)N[C@H]1CCCCCN(Cc2ccccc2)C1 ZINC000638850869 480896512 /nfs/dbraw/zinc/89/65/12/480896512.db2.gz HWQUMSRKFWVYDE-OALUTQOASA-N 1 3 329.488 2.547 10 0 EFAEHO O=C(C[C@H]1CCC[NH2+]C1)N[C@H]1CCCCCN(Cc2ccccc2)C1 ZINC000638851549 480896524 /nfs/dbraw/zinc/89/65/24/480896524.db2.gz OHKUULJQPFLJEJ-UXHICEINSA-N 1 3 343.515 2.937 10 0 EFAEHO Cc1cnc(CC[NH+]2CCC(N3CCN(C(C)C)CC3)CC2)c(C)c1 ZINC000645842413 480941488 /nfs/dbraw/zinc/94/14/88/480941488.db2.gz OPIZPOGFWRNVCV-UHFFFAOYSA-N 1 3 344.547 2.731 10 0 EFAEHO CN(C)CCOc1ccc(CN2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)cc1 ZINC000647480220 480959895 /nfs/dbraw/zinc/95/98/95/480959895.db2.gz HESWIQJEFHFXOH-ICSRJNTNSA-N 1 3 331.504 2.591 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000661401143 480988786 /nfs/dbraw/zinc/98/87/86/480988786.db2.gz ABCYKCFLLKONTI-NXHRZFHOSA-N 1 3 348.535 2.518 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000661401143 480988788 /nfs/dbraw/zinc/98/87/88/480988788.db2.gz ABCYKCFLLKONTI-NXHRZFHOSA-N 1 3 348.535 2.518 10 0 EFAEHO CC[C@H](C(=O)N1CCC(N[C@@H]2C[NH2+]C[C@@H](C)C2)CC1)c1ccccc1 ZINC000647550896 480997041 /nfs/dbraw/zinc/99/70/41/480997041.db2.gz NCQDBJBGKMGNME-VDGAXYAQSA-N 1 3 343.515 2.759 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)Nc1cc(C(F)F)ccc1F ZINC000650383116 481059239 /nfs/dbraw/zinc/05/92/39/481059239.db2.gz CHYXFLWLWCYTHF-UHFFFAOYSA-N 1 3 346.397 2.720 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@H]2CC[C@@H](C3CC3)[NH2+]2)N2CCCC2)cc1 ZINC000653113911 481088991 /nfs/dbraw/zinc/08/89/91/481088991.db2.gz RKNIKKJOZJFGKO-ZCNNSNEGSA-N 1 3 341.499 2.779 10 0 EFAEHO C[C@H](CCN1CCOC2(CC[NH+](C)CC2)C1)OCc1ccccc1 ZINC000646105726 481091258 /nfs/dbraw/zinc/09/12/58/481091258.db2.gz FHAOFLPEUZFYLY-GOSISDBHSA-N 1 3 332.488 2.778 10 0 EFAEHO CCN1CCN(c2ccccc2N[C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000647789308 481106523 /nfs/dbraw/zinc/10/65/23/481106523.db2.gz ANUFZLUAIFFITF-OKZBNKHCSA-N 1 3 328.504 2.629 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000664227707 481110473 /nfs/dbraw/zinc/11/04/73/481110473.db2.gz DMHVOBMGOSDIEY-WNRNVDISSA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000664227707 481110479 /nfs/dbraw/zinc/11/04/79/481110479.db2.gz DMHVOBMGOSDIEY-WNRNVDISSA-N 1 3 338.540 2.526 10 0 EFAEHO c1ccc2c(c1)O[C@H](CCN[C@@H]1CCOC[C@H]1[C@H]1CCC[NH2+]1)CS2 ZINC000647800385 481114226 /nfs/dbraw/zinc/11/42/26/481114226.db2.gz AFBUPQOWYNVKRC-YYIAUSFCSA-N 1 3 348.512 2.677 10 0 EFAEHO C[C@@H](c1ccccc1)N1CCC(NC(=O)N[C@H]2C[NH2+]CC[C@H]2C)CC1 ZINC000669486867 481154219 /nfs/dbraw/zinc/15/42/19/481154219.db2.gz IBOZVSOFDCDFSE-GJYPPUQNSA-N 1 3 344.503 2.509 10 0 EFAEHO C[NH2+]Cc1ccccc1CNC(=O)c1cccc(CN2CCCC2)c1 ZINC000653214005 481154410 /nfs/dbraw/zinc/15/44/10/481154410.db2.gz CBMAJFWQZCXONB-UHFFFAOYSA-N 1 3 337.467 2.932 10 0 EFAEHO C[C@@H](c1ccccc1)N1CCC(NC(=O)N[C@@H]2C[NH2+]CC[C@H]2C)CC1 ZINC000669486869 481155304 /nfs/dbraw/zinc/15/53/04/481155304.db2.gz IBOZVSOFDCDFSE-JTDSTZFVSA-N 1 3 344.503 2.509 10 0 EFAEHO CCN(C(=O)NCC[C@H](C)[N@H+](C)Cc1ccccc1)[C@H]1CCN(C)C1 ZINC000664292841 481157296 /nfs/dbraw/zinc/15/72/96/481157296.db2.gz SFWAUSGUYCFYLJ-HKUYNNGSSA-N 1 3 346.519 2.633 10 0 EFAEHO CCN(C(=O)NCC[C@H](C)[N@@H+](C)Cc1ccccc1)[C@H]1CCN(C)C1 ZINC000664292841 481157301 /nfs/dbraw/zinc/15/73/01/481157301.db2.gz SFWAUSGUYCFYLJ-HKUYNNGSSA-N 1 3 346.519 2.633 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1cccc(Cl)c1 ZINC000664314632 481169972 /nfs/dbraw/zinc/16/99/72/481169972.db2.gz NTTKBFJEMMXYJS-ZDUSSCGKSA-N 1 3 326.872 2.734 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1cccc(Cl)c1 ZINC000664314632 481169979 /nfs/dbraw/zinc/16/99/79/481169979.db2.gz NTTKBFJEMMXYJS-ZDUSSCGKSA-N 1 3 326.872 2.734 10 0 EFAEHO COc1sc(CN[C@H]2CC23CC[NH2+]CC3)cc1Br ZINC000666952027 481216469 /nfs/dbraw/zinc/21/64/69/481216469.db2.gz CDWZOSYZAFNPHW-NSHDSACASA-N 1 3 331.279 2.751 10 0 EFAEHO CCCN(C)[C@H](CNC(=O)NC/C=C/C[NH3+])c1ccc(Cl)cc1 ZINC000669583650 481225751 /nfs/dbraw/zinc/22/57/51/481225751.db2.gz PWMMQCWDPFKESQ-DWTRPJMMSA-N 1 3 338.883 2.537 10 0 EFAEHO CN(C)CCOc1ccc(CN2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)cc1 ZINC000666968825 481227508 /nfs/dbraw/zinc/22/75/08/481227508.db2.gz KRZMGZBXRNBIBJ-UYAOXDASSA-N 1 3 331.504 2.591 10 0 EFAEHO COCCNC1CC[NH+](C[C@@H](C)Cc2ccc(OC)c(F)c2)CC1 ZINC000650704774 481273868 /nfs/dbraw/zinc/27/38/68/481273868.db2.gz ZTLGTWQSDLMRAK-HNNXBMFYSA-N 1 3 338.467 2.713 10 0 EFAEHO CN(C)CCOc1ccc(C[NH2+][C@H]2CNc3ccccc3C2)cc1 ZINC000650716958 481285512 /nfs/dbraw/zinc/28/55/12/481285512.db2.gz OCWKXWUPZUAFBK-GOSISDBHSA-N 1 3 325.456 2.753 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@H](C)CC(=O)Nc1ccc(OC)cc1 ZINC000650719649 481286937 /nfs/dbraw/zinc/28/69/37/481286937.db2.gz XNTLBNZLQAZEAF-OAHLLOKOSA-N 1 3 341.455 2.922 10 0 EFAEHO COc1ccc(CN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)cc1OC ZINC000650722449 481288801 /nfs/dbraw/zinc/28/88/01/481288801.db2.gz UERKHUKJCJQMFP-JFIYKMOQSA-N 1 3 334.460 2.565 10 0 EFAEHO CCOc1cc(CN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)ccc1OC ZINC000650722611 481289421 /nfs/dbraw/zinc/28/94/21/481289421.db2.gz XVHKYALLGJKUOH-ZHALLVOQSA-N 1 3 348.487 2.955 10 0 EFAEHO COc1ccc(CN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)cc1OC ZINC000650722451 481289711 /nfs/dbraw/zinc/28/97/11/481289711.db2.gz UERKHUKJCJQMFP-LZLYRXPVSA-N 1 3 334.460 2.565 10 0 EFAEHO COc1cc(CN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)cc(OC)c1 ZINC000650722630 481290380 /nfs/dbraw/zinc/29/03/80/481290380.db2.gz YFRLSIKBFYEUIZ-IPELMVKDSA-N 1 3 334.460 2.565 10 0 EFAEHO c1cncc([C@@H]2C[C@@H]([NH2+]C3CCN(c4ccncc4)CC3)CCO2)c1 ZINC000648064139 481299115 /nfs/dbraw/zinc/29/91/15/481299115.db2.gz NRGCFDCIWIYULG-ICSRJNTNSA-N 1 3 338.455 2.955 10 0 EFAEHO CC[C@H](OCCN[C@@H]1CCOC[C@H]1[C@H]1CCC[NH2+]1)c1ccccc1 ZINC000650742454 481308650 /nfs/dbraw/zinc/30/86/50/481308650.db2.gz YLDGIICPQDFWBT-NMLBUPMWSA-N 1 3 332.488 2.901 10 0 EFAEHO c1ccc2c(c1)C[C@H](N[C@@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CN2 ZINC000650747721 481310771 /nfs/dbraw/zinc/31/07/71/481310771.db2.gz GJGALXWARMBCLQ-SCWSEQNSSA-N 1 3 335.451 2.869 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](N[C@@H]2CNc3ccccc3C2)[C@H](C)C1 ZINC000650750193 481313018 /nfs/dbraw/zinc/31/30/18/481313018.db2.gz AOMQWWRMJYMTCQ-NEWSRXKRSA-N 1 3 331.504 2.750 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](N[C@@H]2CNc3ccccc3C2)[C@H](C)C1 ZINC000650750193 481313028 /nfs/dbraw/zinc/31/30/28/481313028.db2.gz AOMQWWRMJYMTCQ-NEWSRXKRSA-N 1 3 331.504 2.750 10 0 EFAEHO C[NH+](C)CCOc1cccc(NC(=O)C[C@H]2NCc3ccccc32)c1 ZINC000659285829 481335943 /nfs/dbraw/zinc/33/59/43/481335943.db2.gz RVUKYYOJIBOZOF-LJQANCHMSA-N 1 3 339.439 2.800 10 0 EFAEHO [NH3+][C@H](CC1CCCCC1)C(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659366441 481386396 /nfs/dbraw/zinc/38/63/96/481386396.db2.gz KBAYDRAAZXOBNB-QZTJIDSGSA-N 1 3 331.460 2.584 10 0 EFAEHO [NH3+][C@@H](CCC(=O)Nc1ccc([C@H]2CNCCO2)cc1)c1ccccc1 ZINC000659370822 481391528 /nfs/dbraw/zinc/39/15/28/481391528.db2.gz WWBZXUNQCVSTBC-RBUKOAKNSA-N 1 3 339.439 2.766 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)NCC[C@@H]([NH3+])C(C)C)N(C)C)cc1 ZINC000659428144 481428994 /nfs/dbraw/zinc/42/89/94/481428994.db2.gz XOJDBOQQWXVGRW-MSOLQXFVSA-N 1 3 334.508 2.524 10 0 EFAEHO Cc1ccccc1CN1CCC(NC(=O)NCC[C@@H]([NH3+])C(C)C)CC1 ZINC000659430602 481430745 /nfs/dbraw/zinc/43/07/45/481430745.db2.gz DHQLEKMNQDWSDT-LJQANCHMSA-N 1 3 346.519 2.632 10 0 EFAEHO C[C@H](CCNC(=O)NC[C@]1(C)CCCN1Cc1ccccc1)[NH+](C)C ZINC000664715548 481434267 /nfs/dbraw/zinc/43/42/67/481434267.db2.gz QAHLJTFYMAHQBM-XLIONFOSSA-N 1 3 346.519 2.681 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1 ZINC000659483699 481464143 /nfs/dbraw/zinc/46/41/43/481464143.db2.gz FEIUBUFMSZLEHK-MOPGFXCFSA-N 1 3 346.519 2.570 10 0 EFAEHO CN(CC[NH+]1CCCCC1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000650996076 481490481 /nfs/dbraw/zinc/49/04/81/481490481.db2.gz WUAHWYYHABXEGX-MOPGFXCFSA-N 1 3 344.503 2.559 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000650995279 481490995 /nfs/dbraw/zinc/49/09/95/481490995.db2.gz CKYDHFUYPNYJMG-OALUTQOASA-N 1 3 346.519 2.709 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000650995279 481491002 /nfs/dbraw/zinc/49/10/02/481491002.db2.gz CKYDHFUYPNYJMG-OALUTQOASA-N 1 3 346.519 2.709 10 0 EFAEHO CCN(C(=O)NC[C@H]1CCC[N@@H+]1C1CCCCC1)[C@H]1CCN(C)C1 ZINC000664813533 481494636 /nfs/dbraw/zinc/49/46/36/481494636.db2.gz XWGSRPIIFNJJIN-MSOLQXFVSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN(C(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1)[C@H]1CCN(C)C1 ZINC000664813533 481494647 /nfs/dbraw/zinc/49/46/47/481494647.db2.gz XWGSRPIIFNJJIN-MSOLQXFVSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@H]([NH2+]CC(=O)NC1CCN(C2CC2)CC1)C1CCC(F)(F)CC1 ZINC000653868969 481504007 /nfs/dbraw/zinc/50/40/07/481504007.db2.gz NVODZZVSADTJQG-ZDUSSCGKSA-N 1 3 343.462 2.533 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000659621799 481518919 /nfs/dbraw/zinc/51/89/19/481518919.db2.gz BCXOCMQANMUFIG-RTBURBONSA-N 1 3 346.519 2.666 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000659624635 481521306 /nfs/dbraw/zinc/52/13/06/481521306.db2.gz WIJHRYZZHWJZFC-LJQANCHMSA-N 1 3 346.519 2.666 10 0 EFAEHO CCC[N@H+](CC)Cc1ccc(C(=O)N2CC[C@H]3CN(C)C[C@H]32)cc1 ZINC000646912185 481545564 /nfs/dbraw/zinc/54/55/64/481545564.db2.gz OVSPYWJPNKFDQS-RBUKOAKNSA-N 1 3 329.488 2.695 10 0 EFAEHO CCC[N@@H+](CC)Cc1ccc(C(=O)N2CC[C@H]3CN(C)C[C@H]32)cc1 ZINC000646912185 481545569 /nfs/dbraw/zinc/54/55/69/481545569.db2.gz OVSPYWJPNKFDQS-RBUKOAKNSA-N 1 3 329.488 2.695 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NCCOC[C@@H]2CCOC2)CC1 ZINC000648444778 481551847 /nfs/dbraw/zinc/55/18/47/481551847.db2.gz GVMFAAXSGVNZNS-UYAOXDASSA-N 1 3 346.515 2.725 10 0 EFAEHO CC[C@@H](NCc1ccc(OCC[NH+]2CCCC2)cc1)[C@@H](O)C(F)F ZINC000648694041 481671185 /nfs/dbraw/zinc/67/11/85/481671185.db2.gz VGDWYAYZAWOPDA-IAGOWNOFSA-N 1 3 342.430 2.655 10 0 EFAEHO c1ccc2c(c1)CCC[C@@]21CCC[N@@H+](C[C@H]2CCC3(CNC3)O2)C1 ZINC000662259037 481672782 /nfs/dbraw/zinc/67/27/82/481672782.db2.gz OOXJPWSNINJLBO-QUCCMNQESA-N 1 3 326.484 2.878 10 0 EFAEHO c1ccc2c(c1)CCC[C@@]21CCC[N@H+](C[C@H]2CCC3(CNC3)O2)C1 ZINC000662259037 481672786 /nfs/dbraw/zinc/67/27/86/481672786.db2.gz OOXJPWSNINJLBO-QUCCMNQESA-N 1 3 326.484 2.878 10 0 EFAEHO CC[C@@H](NC[C@H]1CCC2(C[NH2+]C2)O1)c1ccccc1OC(F)F ZINC000662280452 481688774 /nfs/dbraw/zinc/68/87/74/481688774.db2.gz DRSYUFIXYOGRCV-TZMCWYRMSA-N 1 3 326.387 2.850 10 0 EFAEHO CCC[N@H+](C[C@H]1CCC2(CNC2)O1)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000662283526 481690668 /nfs/dbraw/zinc/69/06/68/481690668.db2.gz UTVPEDBOHYEONU-FUHWJXTLSA-N 1 3 345.487 2.637 10 0 EFAEHO CCC[N@@H+](C[C@H]1CCC2(CNC2)O1)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000662283526 481690673 /nfs/dbraw/zinc/69/06/73/481690673.db2.gz UTVPEDBOHYEONU-FUHWJXTLSA-N 1 3 345.487 2.637 10 0 EFAEHO c1ccc(OCCOCCN2CCC([C@@H]3CCC[NH2+]C3)CC2)cc1 ZINC000662291198 481695011 /nfs/dbraw/zinc/69/50/11/481695011.db2.gz DFLSRZOLWBUSJW-LJQANCHMSA-N 1 3 332.488 2.794 10 0 EFAEHO c1ccc(OCCOCCN2CCC([C@H]3CCC[NH2+]C3)CC2)cc1 ZINC000662291197 481696153 /nfs/dbraw/zinc/69/61/53/481696153.db2.gz DFLSRZOLWBUSJW-IBGZPJMESA-N 1 3 332.488 2.794 10 0 EFAEHO O=C(CN1CCC[C@@H](C2CC[NH2+]CC2)C1)Nc1ccc2c(c1)CCC2 ZINC000662296329 481703497 /nfs/dbraw/zinc/70/34/97/481703497.db2.gz YJJZWJUSIBUKBS-LJQANCHMSA-N 1 3 341.499 2.825 10 0 EFAEHO CC1CCC(N(C)C(=O)CN2CCC[C@H](C3CC[NH2+]CC3)C2)CC1 ZINC000662295942 481704125 /nfs/dbraw/zinc/70/41/25/481704125.db2.gz JEDLXCHWUPGXFF-AVAKVYKDSA-N 1 3 335.536 2.735 10 0 EFAEHO CN1C[C@@H](C[NH2+]Cc2cccc3c2OCCO3)[C@H](c2ccccc2)C1 ZINC000647248887 481727150 /nfs/dbraw/zinc/72/71/50/481727150.db2.gz MEFCARKSMVGRJU-MOPGFXCFSA-N 1 3 338.451 2.893 10 0 EFAEHO CC(C)Cn1nccc1C[NH2+]C[C@@H]1CN(C)C[C@H]1c1ccccc1 ZINC000647249280 481728385 /nfs/dbraw/zinc/72/83/85/481728385.db2.gz PJFCKRJCBNUVDQ-QUCCMNQESA-N 1 3 326.488 2.974 10 0 EFAEHO C[C@H](C[C@@H]1CCCCC[NH2+]1)NCc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000665240265 481739721 /nfs/dbraw/zinc/73/97/21/481739721.db2.gz GSEFWIQZEGYKGW-JRGCBEDISA-N 1 3 345.531 2.654 10 0 EFAEHO CCOc1ccc([C@@H]2CCNC[C@@H]2[NH2+][C@@H]2CCN(C)[C@@H](C)C2)cc1 ZINC000665255125 481750917 /nfs/dbraw/zinc/75/09/17/481750917.db2.gz JPTWWOGLPVXTGP-RKOGWWSCSA-N 1 3 331.504 2.603 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](N[C@@H]2CCc3cc(N)ccc32)[C@H](C)C1 ZINC000665269261 481757512 /nfs/dbraw/zinc/75/75/12/481757512.db2.gz CKOHZBXHNYXLTO-UIAACRFSSA-N 1 3 331.504 2.983 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](N[C@@H]2CCc3cc(N)ccc32)[C@H](C)C1 ZINC000665269261 481757516 /nfs/dbraw/zinc/75/75/16/481757516.db2.gz CKOHZBXHNYXLTO-UIAACRFSSA-N 1 3 331.504 2.983 10 0 EFAEHO C[NH+](C)C1(CNC(=O)C[C@H]2NCc3ccccc32)CCCCCC1 ZINC000662367478 481759945 /nfs/dbraw/zinc/75/99/45/481759945.db2.gz AOAWKRRGPDHAOQ-GOSISDBHSA-N 1 3 329.488 2.992 10 0 EFAEHO CC[C@H](N[C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21)C(=O)NCc1cccs1 ZINC000647333897 481764862 /nfs/dbraw/zinc/76/48/62/481764862.db2.gz BIFTZZQUJDEFKT-NXOAAHMSSA-N 1 3 335.517 2.605 10 0 EFAEHO CC[C@H](N[C@@H]1CC[N@@H+](C)[C@H]2CCC[C@H]21)C(=O)NCc1cccs1 ZINC000647333897 481764867 /nfs/dbraw/zinc/76/48/67/481764867.db2.gz BIFTZZQUJDEFKT-NXOAAHMSSA-N 1 3 335.517 2.605 10 0 EFAEHO CC[C@H]([NH2+][C@@H]1CCN(C)[C@H]2CCC[C@H]21)C(=O)NCc1cccs1 ZINC000647333897 481764876 /nfs/dbraw/zinc/76/48/76/481764876.db2.gz BIFTZZQUJDEFKT-NXOAAHMSSA-N 1 3 335.517 2.605 10 0 EFAEHO C[C@@H]1CCC[C@@H]([NH+]2CCC(NCC(C)(C)[C@]3(O)CCOC3)CC2)C1 ZINC000647341650 481769725 /nfs/dbraw/zinc/76/97/25/481769725.db2.gz ZKAXXJOJXDCLQQ-POAQFYNOSA-N 1 3 338.536 2.797 10 0 EFAEHO C[C@@H]1CCC[C@@H](N2CCC([NH2+]CC(C)(C)[C@]3(O)CCOC3)CC2)C1 ZINC000647341650 481769741 /nfs/dbraw/zinc/76/97/41/481769741.db2.gz ZKAXXJOJXDCLQQ-POAQFYNOSA-N 1 3 338.536 2.797 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(N[C@@H](C)c2cc(F)ccc2F)CC1 ZINC000665285396 481770231 /nfs/dbraw/zinc/77/02/31/481770231.db2.gz LODIPFKFNQMOKH-ZDUSSCGKSA-N 1 3 339.430 2.606 10 0 EFAEHO C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)N1CC2CC1(C)C2 ZINC000662384124 481777086 /nfs/dbraw/zinc/77/70/86/481777086.db2.gz JYRYZAJLAOMKJW-SRWJYRBRSA-N 1 3 341.499 2.640 10 0 EFAEHO c1cc(CN2CCCCC2)cc(-c2noc(CCC3C[NH2+]C3)n2)c1 ZINC000637795157 481778254 /nfs/dbraw/zinc/77/82/54/481778254.db2.gz RVUPJUXHRPUMLA-UHFFFAOYSA-N 1 3 326.444 2.875 10 0 EFAEHO CSc1cccc(C[N@@H+]2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)c1 ZINC000660156913 481791562 /nfs/dbraw/zinc/79/15/62/481791562.db2.gz SKIKHJUYYXGOPF-LPHOPBHVSA-N 1 3 333.545 2.866 10 0 EFAEHO CSc1cccc(C[N@H+]2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)c1 ZINC000660156913 481791570 /nfs/dbraw/zinc/79/15/70/481791570.db2.gz SKIKHJUYYXGOPF-LPHOPBHVSA-N 1 3 333.545 2.866 10 0 EFAEHO CCCN(CC[NH+](CC)CC)C(=O)NC[C@H]1CCN1C(C)(C)C ZINC000665361220 481820154 /nfs/dbraw/zinc/82/01/54/481820154.db2.gz LMCFTJZLEQWXTM-MRXNPFEDSA-N 1 3 326.529 2.623 10 0 EFAEHO C[N@H+](CCCNC(=O)NC[C@@H]1CCN1C(C)(C)C)Cc1ccccc1 ZINC000660275124 481870080 /nfs/dbraw/zinc/87/00/80/481870080.db2.gz XCUYMQUQJCZVJU-SFHVURJKSA-N 1 3 346.519 2.681 10 0 EFAEHO C[N@@H+](CCCNC(=O)NC[C@@H]1CCN1C(C)(C)C)Cc1ccccc1 ZINC000660275124 481870083 /nfs/dbraw/zinc/87/00/83/481870083.db2.gz XCUYMQUQJCZVJU-SFHVURJKSA-N 1 3 346.519 2.681 10 0 EFAEHO CCC(C)(C)N1CCN(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)CC1 ZINC000654463886 481886052 /nfs/dbraw/zinc/88/60/52/481886052.db2.gz GQJBHJAJIJAMJS-ALOPSCKCSA-N 1 3 336.524 2.518 10 0 EFAEHO CCC(C)(C)N1CCN(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)CC1 ZINC000654463886 481886046 /nfs/dbraw/zinc/88/60/46/481886046.db2.gz GQJBHJAJIJAMJS-ALOPSCKCSA-N 1 3 336.524 2.518 10 0 EFAEHO CCc1ccc([C@@H](CNC(=O)C2([NH2+]C3CC3)CCC2)N(C)C)cc1 ZINC000662663139 481921411 /nfs/dbraw/zinc/92/14/11/481921411.db2.gz LRFWGNJLIPANBQ-GOSISDBHSA-N 1 3 329.488 2.643 10 0 EFAEHO O=C(NCc1ccccc1C[NH+]1CCCCC1)C1(NC2CC2)CCC1 ZINC000662668643 481924256 /nfs/dbraw/zinc/92/42/56/481924256.db2.gz HZNLQDNXBZNPLE-UHFFFAOYSA-N 1 3 341.499 2.963 10 0 EFAEHO CC[NH+](CC)Cc1cccc(CNC(=O)C2(N)CC3(CCC3)C2)c1 ZINC000662674694 481927784 /nfs/dbraw/zinc/92/77/84/481927784.db2.gz DRSCNBHBOUOLTM-UHFFFAOYSA-N 1 3 329.488 2.806 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)C1([NH3+])CC2(CCC2)C1)c1ccsc1 ZINC000662679378 481930101 /nfs/dbraw/zinc/93/01/01/481930101.db2.gz NKQIXJAMSCOSHG-HNNXBMFYSA-N 1 3 335.517 2.909 10 0 EFAEHO C[N@@H+]1CCCC[C@H]1CCC(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000662684846 481933422 /nfs/dbraw/zinc/93/34/22/481933422.db2.gz JZRSWGNSSQVVTD-ROUUACIJSA-N 1 3 331.460 2.551 10 0 EFAEHO C[N@H+]1CCCC[C@H]1CCC(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000662684846 481933428 /nfs/dbraw/zinc/93/34/28/481933428.db2.gz JZRSWGNSSQVVTD-ROUUACIJSA-N 1 3 331.460 2.551 10 0 EFAEHO C[N@@H+]1CCCC[C@H]1CCC(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000662684847 481933691 /nfs/dbraw/zinc/93/36/91/481933691.db2.gz JZRSWGNSSQVVTD-ZWKOTPCHSA-N 1 3 331.460 2.551 10 0 EFAEHO C[N@H+]1CCCC[C@H]1CCC(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000662684847 481933697 /nfs/dbraw/zinc/93/36/97/481933697.db2.gz JZRSWGNSSQVVTD-ZWKOTPCHSA-N 1 3 331.460 2.551 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000660396865 481934514 /nfs/dbraw/zinc/93/45/14/481934514.db2.gz PFFCQRAODSVJBD-ZACQAIPSSA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)(C)N1CC[C@H](NC(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)C1 ZINC000665556567 481935370 /nfs/dbraw/zinc/93/53/70/481935370.db2.gz ZMHIIFOKFQVKLK-IRXDYDNUSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@H](CN1CCC(C)CC1)NC(=O)c1ccc2c(c1)[C@H](C[NH3+])CCC2 ZINC000662695211 481937887 /nfs/dbraw/zinc/93/78/87/481937887.db2.gz XMLSQLLXQOMJPN-APWZRJJASA-N 1 3 343.515 2.915 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000660403091 481937965 /nfs/dbraw/zinc/93/79/65/481937965.db2.gz NMJJPHHQRURNIL-SJORKVTESA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000660403091 481937968 /nfs/dbraw/zinc/93/79/68/481937968.db2.gz NMJJPHHQRURNIL-SJORKVTESA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@H]1CCC[N@H+](CCCCNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000660405104 481940611 /nfs/dbraw/zinc/94/06/11/481940611.db2.gz WJADRZAXIABSTA-DLBZAZTESA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@H]1CCC[N@@H+](CCCCNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000660405104 481940613 /nfs/dbraw/zinc/94/06/13/481940613.db2.gz WJADRZAXIABSTA-DLBZAZTESA-N 1 3 338.540 2.671 10 0 EFAEHO N[C@@H](C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)C1CCC1 ZINC000662716120 481946724 /nfs/dbraw/zinc/94/67/24/481946724.db2.gz QUTPQDCXYKAZEK-RTBURBONSA-N 1 3 341.499 2.532 10 0 EFAEHO N[C@@H](C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)C1CCC1 ZINC000662716120 481946731 /nfs/dbraw/zinc/94/67/31/481946731.db2.gz QUTPQDCXYKAZEK-RTBURBONSA-N 1 3 341.499 2.532 10 0 EFAEHO N[C@H](C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)C1CCC1 ZINC000662716115 481947081 /nfs/dbraw/zinc/94/70/81/481947081.db2.gz QUTPQDCXYKAZEK-MOPGFXCFSA-N 1 3 341.499 2.532 10 0 EFAEHO N[C@H](C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)C1CCC1 ZINC000662716115 481947082 /nfs/dbraw/zinc/94/70/82/481947082.db2.gz QUTPQDCXYKAZEK-MOPGFXCFSA-N 1 3 341.499 2.532 10 0 EFAEHO CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)C1(NC2CC2)CCC1 ZINC000662729350 481951979 /nfs/dbraw/zinc/95/19/79/481951979.db2.gz OOKJQAVYBLCEJL-GOSISDBHSA-N 1 3 341.499 2.642 10 0 EFAEHO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)C1(NC2CC2)CCC1 ZINC000662729350 481951984 /nfs/dbraw/zinc/95/19/84/481951984.db2.gz OOKJQAVYBLCEJL-GOSISDBHSA-N 1 3 341.499 2.642 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccc(Cl)c(F)c1 ZINC000665600473 481955522 /nfs/dbraw/zinc/95/55/22/481955522.db2.gz FDZCSKURKWOMMP-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccc(Cl)c(F)c1 ZINC000665600473 481955524 /nfs/dbraw/zinc/95/55/24/481955524.db2.gz FDZCSKURKWOMMP-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO C[C@@H]([NH3+])CC(=O)N1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000662754782 481960244 /nfs/dbraw/zinc/96/02/44/481960244.db2.gz AFNJPYHSLAWUOE-UZLBHIALSA-N 1 3 343.515 2.873 10 0 EFAEHO CCN(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)C1CCCCC1 ZINC000665636766 481972944 /nfs/dbraw/zinc/97/29/44/481972944.db2.gz IXWWLHFBZLUZGG-INIZCTEOSA-N 1 3 326.529 2.623 10 0 EFAEHO CCN(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)C1CCCCC1 ZINC000665636766 481972947 /nfs/dbraw/zinc/97/29/47/481972947.db2.gz IXWWLHFBZLUZGG-INIZCTEOSA-N 1 3 326.529 2.623 10 0 EFAEHO Cc1ccc([C@H](C)N(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000665638128 481974044 /nfs/dbraw/zinc/97/40/44/481974044.db2.gz ZZUOEKLQZZWTOC-ROUUACIJSA-N 1 3 348.535 2.969 10 0 EFAEHO Cc1ccc([C@H](C)N(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000665638128 481974047 /nfs/dbraw/zinc/97/40/47/481974047.db2.gz ZZUOEKLQZZWTOC-ROUUACIJSA-N 1 3 348.535 2.969 10 0 EFAEHO CCN(Cc1ccc(C)cc1)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000665640074 481974867 /nfs/dbraw/zinc/97/48/67/481974867.db2.gz MVYRDUHIVYFHGG-SFHVURJKSA-N 1 3 348.535 2.799 10 0 EFAEHO CCN(Cc1ccc(C)cc1)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000665640074 481974872 /nfs/dbraw/zinc/97/48/72/481974872.db2.gz MVYRDUHIVYFHGG-SFHVURJKSA-N 1 3 348.535 2.799 10 0 EFAEHO OC[C@]1(C[NH2+]C2CCN(c3ccncc3)CC2)CCc2ccccc21 ZINC000651883811 481989973 /nfs/dbraw/zinc/98/99/73/481989973.db2.gz QIQZNOQOXKQIMB-OAQYLSRUSA-N 1 3 337.467 2.517 10 0 EFAEHO Cc1ccc2cc(CN3CCC(C[NH+]4CCN(C)CC4)CC3)[nH]c2c1 ZINC000668159320 482006599 /nfs/dbraw/zinc/00/65/99/482006599.db2.gz RGOQHOGJYKCAEF-UHFFFAOYSA-N 1 3 340.515 2.936 10 0 EFAEHO CCN(C(=O)[C@@H]1[NH2+]CC1(C)C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000649306014 482021739 /nfs/dbraw/zinc/02/17/39/482021739.db2.gz UBYRZFROXVSJLS-NXHRZFHOSA-N 1 3 329.488 2.668 10 0 EFAEHO CN(Cc1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]3CCCC[C@H]3[NH2+]2)C1 ZINC000649342806 482034594 /nfs/dbraw/zinc/03/45/94/482034594.db2.gz QBEFTSJZDANISB-NMLBUPMWSA-N 1 3 341.499 2.640 10 0 EFAEHO CN(Cc1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]3CCCC[C@@H]3[NH2+]2)C1 ZINC000649342809 482034731 /nfs/dbraw/zinc/03/47/31/482034731.db2.gz QBEFTSJZDANISB-ZRNYENFQSA-N 1 3 341.499 2.640 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CCc2ccccc2[C@H]1C ZINC000665757591 482037061 /nfs/dbraw/zinc/03/70/61/482037061.db2.gz PGUBJBBVJHLHOK-DLBZAZTESA-N 1 3 346.519 2.587 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CCc2ccccc2[C@H]1C ZINC000665757591 482037065 /nfs/dbraw/zinc/03/70/65/482037065.db2.gz PGUBJBBVJHLHOK-DLBZAZTESA-N 1 3 346.519 2.587 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000665759270 482038830 /nfs/dbraw/zinc/03/88/30/482038830.db2.gz BFLLVZVPTQWTLN-ZIFCJYIRSA-N 1 3 346.519 2.661 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000665759270 482038832 /nfs/dbraw/zinc/03/88/32/482038832.db2.gz BFLLVZVPTQWTLN-ZIFCJYIRSA-N 1 3 346.519 2.661 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CCCC[C@@H]1C1CCC1 ZINC000665763631 482040311 /nfs/dbraw/zinc/04/03/11/482040311.db2.gz HOMTVXFMDOJVHE-FUHWJXTLSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CCCC[C@@H]1C1CCC1 ZINC000665763631 482040316 /nfs/dbraw/zinc/04/03/16/482040316.db2.gz HOMTVXFMDOJVHE-FUHWJXTLSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[N@@H+]1CCC[C@@]2(CCN(C)C2)C1 ZINC000660652836 482072046 /nfs/dbraw/zinc/07/20/46/482072046.db2.gz MUPDFWXJPZGMAS-NQIIRXRSSA-N 1 3 346.515 2.967 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@]2(CCN(C)C2)C1 ZINC000660652836 482072051 /nfs/dbraw/zinc/07/20/51/482072051.db2.gz MUPDFWXJPZGMAS-NQIIRXRSSA-N 1 3 346.515 2.967 10 0 EFAEHO [NH3+]CC1(CCNC(=O)NCc2ccccc2CN2CCCCC2)CC1 ZINC000652122271 482084344 /nfs/dbraw/zinc/08/43/44/482084344.db2.gz QGUAIFYFXXNGRK-UHFFFAOYSA-N 1 3 344.503 2.601 10 0 EFAEHO C[NH+](C)CC[C@@H](NC(=O)NC[C@@H]1CCN1C(C)(C)C)C(C)(C)C ZINC000660677745 482090306 /nfs/dbraw/zinc/09/03/06/482090306.db2.gz OTKYYADWIJNYNZ-LSDHHAIUSA-N 1 3 326.529 2.525 10 0 EFAEHO C[NH+](C)CC[C@@H](NC(=O)NC[C@H]1CCN1C(C)(C)C)C(C)(C)C ZINC000660677742 482090480 /nfs/dbraw/zinc/09/04/80/482090480.db2.gz OTKYYADWIJNYNZ-HUUCEWRRSA-N 1 3 326.529 2.525 10 0 EFAEHO C[C@@H](Cc1ccc(O)cc1)[NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000668488570 482141573 /nfs/dbraw/zinc/14/15/73/482141573.db2.gz BUWPGKURKPCMKE-HRAATJIYSA-N 1 3 340.467 2.680 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000660797154 482150869 /nfs/dbraw/zinc/15/08/69/482150869.db2.gz MKRKSDHKHIGMNT-QGZVFWFLSA-N 1 3 336.524 2.565 10 0 EFAEHO c1csc(N2CCCN(Cc3ccc4c(c3)C[NH2+]CC4)CC2)n1 ZINC000652338945 482180399 /nfs/dbraw/zinc/18/03/99/482180399.db2.gz ORZHJVWRSPMRBA-UHFFFAOYSA-N 1 3 328.485 2.501 10 0 EFAEHO CN(C(=O)[C@H](C[NH+]1CCCC1)c1ccccc1)[C@@H]1CCN(C2CC2)C1 ZINC000668599669 482183608 /nfs/dbraw/zinc/18/36/08/482183608.db2.gz XMTSJTRSSLBDTJ-WOJBJXKFSA-N 1 3 341.499 2.561 10 0 EFAEHO CCOCC[C@@H](O)C[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000663368840 482186281 /nfs/dbraw/zinc/18/62/81/482186281.db2.gz PCVAOBIUQSMNDG-WOJBJXKFSA-N 1 3 346.515 2.666 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccc2ccn(C)c2c1 ZINC000666178563 482210904 /nfs/dbraw/zinc/21/09/04/482210904.db2.gz PDVLLHUSFKKUCE-HNNXBMFYSA-N 1 3 345.491 2.572 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccc2ccn(C)c2c1 ZINC000666178563 482210909 /nfs/dbraw/zinc/21/09/09/482210909.db2.gz PDVLLHUSFKKUCE-HNNXBMFYSA-N 1 3 345.491 2.572 10 0 EFAEHO CCCCN(C[C@@H](O)C[N@H+](C)C(C)C)[C@@H]1CCc2ncsc2C1 ZINC000660907957 482211384 /nfs/dbraw/zinc/21/13/84/482211384.db2.gz XAEFIDXTAGOKRX-CVEARBPZSA-N 1 3 339.549 2.804 10 0 EFAEHO CCCCN(C[C@@H](O)C[N@@H+](C)C(C)C)[C@@H]1CCc2ncsc2C1 ZINC000660907957 482211387 /nfs/dbraw/zinc/21/13/87/482211387.db2.gz XAEFIDXTAGOKRX-CVEARBPZSA-N 1 3 339.549 2.804 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@H]3COC[C@@H]3C2)CC1 ZINC000668704092 482220122 /nfs/dbraw/zinc/22/01/22/482220122.db2.gz BVWJRKPXBSGKPY-PMACEKPBSA-N 1 3 343.515 2.687 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@H]3COC[C@@H]3C2)CC1 ZINC000668704092 482220129 /nfs/dbraw/zinc/22/01/29/482220129.db2.gz BVWJRKPXBSGKPY-PMACEKPBSA-N 1 3 343.515 2.687 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](CNC(=O)c2cccc(CN3CCCCC3)c2)C1 ZINC000655242777 482225668 /nfs/dbraw/zinc/22/56/68/482225668.db2.gz KTRMOPQNMZFLHL-IZAXUBKRSA-N 1 3 329.488 2.743 10 0 EFAEHO CC[NH+](CC)CCCN1CCO[C@H]2CCN(Cc3ccccc3)C[C@@H]21 ZINC000649751335 482228773 /nfs/dbraw/zinc/22/87/73/482228773.db2.gz ITTOFRSHEGUVCU-SFTDATJTSA-N 1 3 345.531 2.694 10 0 EFAEHO CCCN1CCN(c2ccccc2CNCC[C@@H]([NH3+])C(C)C)CC1 ZINC000663499230 482265672 /nfs/dbraw/zinc/26/56/72/482265672.db2.gz HCKIOKQRYNRZJT-LJQANCHMSA-N 1 3 332.536 2.682 10 0 EFAEHO CC1([NH3+])CCN(C(=O)NCc2ccccc2CN2CCCCC2)CC1 ZINC000668860255 482298859 /nfs/dbraw/zinc/29/88/59/482298859.db2.gz CIXMWVKHEBQJMK-UHFFFAOYSA-N 1 3 344.503 2.695 10 0 EFAEHO CCN(C(=O)NCc1cccc(C[NH+](CC)CC)c1)[C@@H]1CCN(C)C1 ZINC000663599326 482316856 /nfs/dbraw/zinc/31/68/56/482316856.db2.gz BNYXEPIFXFLYOS-LJQANCHMSA-N 1 3 346.519 2.764 10 0 EFAEHO CCN(C(=O)NCCCC[NH+]1CCC(C)CC1)[C@@H]1CCN(CC)C1 ZINC000663653181 482331428 /nfs/dbraw/zinc/33/14/28/482331428.db2.gz CXABZWRQTNDCCE-GOSISDBHSA-N 1 3 338.540 2.624 10 0 EFAEHO CCN(C(=O)NCCCC[N@@H+]1CCCC[C@@H]1C)[C@@H]1CCN(CC)C1 ZINC000663653721 482332857 /nfs/dbraw/zinc/33/28/57/482332857.db2.gz CCSXOPIWNKNVMS-ZWKOTPCHSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN(C(=O)NCCCC[N@H+]1CCCC[C@@H]1C)[C@@H]1CCN(CC)C1 ZINC000663653721 482332860 /nfs/dbraw/zinc/33/28/60/482332860.db2.gz CCSXOPIWNKNVMS-ZWKOTPCHSA-N 1 3 338.540 2.767 10 0 EFAEHO CC(=O)c1ccc(NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1C ZINC000666461758 482341585 /nfs/dbraw/zinc/34/15/85/482341585.db2.gz NXSUMXLSUVOTJU-HNNXBMFYSA-N 1 3 348.491 2.591 10 0 EFAEHO CC(=O)c1ccc(NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1C ZINC000666461758 482341586 /nfs/dbraw/zinc/34/15/86/482341586.db2.gz NXSUMXLSUVOTJU-HNNXBMFYSA-N 1 3 348.491 2.591 10 0 EFAEHO Cc1ccc([C@@H](C)NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000663745943 482372573 /nfs/dbraw/zinc/37/25/73/482372573.db2.gz GVDRVBQRYYODQP-DLBZAZTESA-N 1 3 334.508 2.627 10 0 EFAEHO Cc1ccc([C@@H](C)NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000663745943 482372575 /nfs/dbraw/zinc/37/25/75/482372575.db2.gz GVDRVBQRYYODQP-DLBZAZTESA-N 1 3 334.508 2.627 10 0 EFAEHO CCN(C(=O)NC[C@H](c1ccc(C)cc1)N(C)C)[C@H]1CC[N@H+](CC)C1 ZINC000663844499 482404571 /nfs/dbraw/zinc/40/45/71/482404571.db2.gz WSUTWZHMDUOPSC-RBUKOAKNSA-N 1 3 346.519 2.723 10 0 EFAEHO CCN(C(=O)NC[C@H](c1ccc(C)cc1)N(C)C)[C@H]1CC[N@@H+](CC)C1 ZINC000663844499 482404572 /nfs/dbraw/zinc/40/45/72/482404572.db2.gz WSUTWZHMDUOPSC-RBUKOAKNSA-N 1 3 346.519 2.723 10 0 EFAEHO CC[C@@H](NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccccc1 ZINC000663856298 482408817 /nfs/dbraw/zinc/40/88/17/482408817.db2.gz QGIIRAHXYILQBJ-FUHWJXTLSA-N 1 3 334.508 2.709 10 0 EFAEHO CC[C@@H](NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccccc1 ZINC000663856298 482408818 /nfs/dbraw/zinc/40/88/18/482408818.db2.gz QGIIRAHXYILQBJ-FUHWJXTLSA-N 1 3 334.508 2.709 10 0 EFAEHO CC(C)C[C@H](CNC(=O)c1cccc(CN2CCCC2)c1)[NH+](C)C ZINC000114377767 519350596 /nfs/dbraw/zinc/35/05/96/519350596.db2.gz XHEVMJLGOWJGRT-LJQANCHMSA-N 1 3 331.504 2.989 10 0 EFAEHO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)N[C@H](C)CN(C)Cc2ccccc2)C1 ZINC000245650386 519692216 /nfs/dbraw/zinc/69/22/16/519692216.db2.gz HEDODMVUCZFQPH-LMMKCTJWSA-N 1 3 346.519 2.535 10 0 EFAEHO CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)N[C@H](C)CN(C)Cc2ccccc2)C1 ZINC000245650386 519692220 /nfs/dbraw/zinc/69/22/20/519692220.db2.gz HEDODMVUCZFQPH-LMMKCTJWSA-N 1 3 346.519 2.535 10 0 EFAEHO CCC[C@H](N)C(=O)N(C)C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000178868972 521104920 /nfs/dbraw/zinc/10/49/20/521104920.db2.gz CIJXXOMZUFTTKH-BQFCYCMXSA-N 1 3 331.504 2.729 10 0 EFAEHO CCC(=O)N1CC[C@H](N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000245781337 521152362 /nfs/dbraw/zinc/15/23/62/521152362.db2.gz YWUIVIFAAYUIOL-LWYYNNOASA-N 1 3 341.499 2.783 10 0 EFAEHO CCC(=O)N1CC[C@H](N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000245781337 521152375 /nfs/dbraw/zinc/15/23/75/521152375.db2.gz YWUIVIFAAYUIOL-LWYYNNOASA-N 1 3 341.499 2.783 10 0 EFAEHO CCC[N@H+](CC)Cc1ccc(-c2nc([C@H]3CNCCN3C)no2)cc1 ZINC000263225219 521613165 /nfs/dbraw/zinc/61/31/65/521613165.db2.gz MRJZBOOWUSGXII-QGZVFWFLSA-N 1 3 343.475 2.545 10 0 EFAEHO CCC[N@@H+](CC)Cc1ccc(-c2nc([C@H]3CNCCN3C)no2)cc1 ZINC000263225219 521613170 /nfs/dbraw/zinc/61/31/70/521613170.db2.gz MRJZBOOWUSGXII-QGZVFWFLSA-N 1 3 343.475 2.545 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(-n3cncn3)c(C)c2)[C@@H](C)C1 ZINC000245783951 521713575 /nfs/dbraw/zinc/71/35/75/521713575.db2.gz UWYFLEHXVYESBT-FUHWJXTLSA-N 1 3 327.476 2.738 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(-n3cncn3)c(C)c2)[C@@H](C)C1 ZINC000245783951 521713576 /nfs/dbraw/zinc/71/35/76/521713576.db2.gz UWYFLEHXVYESBT-FUHWJXTLSA-N 1 3 327.476 2.738 10 0 EFAEHO CCN1CC[C@@H]([N@H+](C)Cc2ccc3c(c2)sc(=O)n3C)[C@H](C)C1 ZINC000195031236 521714352 /nfs/dbraw/zinc/71/43/52/521714352.db2.gz ZDYIEXFDBRMEBM-UKRRQHHQSA-N 1 3 333.501 2.762 10 0 EFAEHO CCN1CC[C@@H]([N@@H+](C)Cc2ccc3c(c2)sc(=O)n3C)[C@H](C)C1 ZINC000195031236 521714354 /nfs/dbraw/zinc/71/43/54/521714354.db2.gz ZDYIEXFDBRMEBM-UKRRQHHQSA-N 1 3 333.501 2.762 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)Cc2ccc(-n3cncn3)c(C)c2)[C@@H](C)C1 ZINC000245783954 521719824 /nfs/dbraw/zinc/71/98/24/521719824.db2.gz UWYFLEHXVYESBT-WMZOPIPTSA-N 1 3 327.476 2.738 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)Cc2ccc(-n3cncn3)c(C)c2)[C@@H](C)C1 ZINC000245783954 521719826 /nfs/dbraw/zinc/71/98/26/521719826.db2.gz UWYFLEHXVYESBT-WMZOPIPTSA-N 1 3 327.476 2.738 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)N1CCC([NH+](C)C)CC1 ZINC000118770660 521885381 /nfs/dbraw/zinc/88/53/81/521885381.db2.gz OZMPJGVPHJHALQ-UHFFFAOYSA-N 1 3 329.444 2.661 10 0 EFAEHO CN1CC[C@@H](NC(=O)N[C@H]2CCC[C@@H]([NH+](C)C)C2)[C@H]1c1ccccc1 ZINC000245612836 522046307 /nfs/dbraw/zinc/04/63/07/522046307.db2.gz CCCZYTLDYZVYFO-WJFTUGDTSA-N 1 3 344.503 2.604 10 0 EFAEHO COc1cc(CN2CCC(C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)ccc1O ZINC000180071099 522368586 /nfs/dbraw/zinc/36/85/86/522368586.db2.gz IIBUJHCQPFBOHB-HOTGVXAUSA-N 1 3 348.487 2.722 10 0 EFAEHO CN(C)CCN(C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)C1CCCC1 ZINC000151340949 524058755 /nfs/dbraw/zinc/05/87/55/524058755.db2.gz RXVIQIDPTFKCGV-ZNXRZULTSA-N 1 3 336.524 2.518 10 0 EFAEHO CN(C)CCN(C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)C1CCCC1 ZINC000151340949 524058757 /nfs/dbraw/zinc/05/87/57/524058757.db2.gz RXVIQIDPTFKCGV-ZNXRZULTSA-N 1 3 336.524 2.518 10 0 EFAEHO Cc1cc(C(C)(C)C)ccc1OC[C@H](O)C[N@@H+]1C[C@H]2CN(C)C[C@H]2C1 ZINC000193636711 524201269 /nfs/dbraw/zinc/20/12/69/524201269.db2.gz WLTPLTGXGAVNAJ-ZIFCJYIRSA-N 1 3 346.515 2.526 10 0 EFAEHO Cc1cc(C(C)(C)C)ccc1OC[C@H](O)C[N@H+]1C[C@H]2CN(C)C[C@H]2C1 ZINC000193636711 524201278 /nfs/dbraw/zinc/20/12/78/524201278.db2.gz WLTPLTGXGAVNAJ-ZIFCJYIRSA-N 1 3 346.515 2.526 10 0 EFAEHO C[C@H](CO[C@@H]1CCOC1)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245760850 524585349 /nfs/dbraw/zinc/58/53/49/524585349.db2.gz VOOBCLHCFGHEHL-QNDFHXLGSA-N 1 3 344.499 2.966 10 0 EFAEHO C[C@H](CO[C@@H]1CCOC1)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245760850 524585364 /nfs/dbraw/zinc/58/53/64/524585364.db2.gz VOOBCLHCFGHEHL-QNDFHXLGSA-N 1 3 344.499 2.966 10 0 EFAEHO C[C@H](CO[C@H]1CCOC1)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245760857 524588875 /nfs/dbraw/zinc/58/88/75/524588875.db2.gz VOOBCLHCFGHEHL-RQXATKFSSA-N 1 3 344.499 2.966 10 0 EFAEHO C[C@H](CO[C@H]1CCOC1)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245760857 524588885 /nfs/dbraw/zinc/58/88/85/524588885.db2.gz VOOBCLHCFGHEHL-RQXATKFSSA-N 1 3 344.499 2.966 10 0 EFAEHO C[C@@H](NC(=O)N1CCCN(C2CC2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182877905 525165847 /nfs/dbraw/zinc/16/58/47/525165847.db2.gz AWKBPBMKDNLKBN-SJORKVTESA-N 1 3 348.535 2.519 10 0 EFAEHO C[C@@H](NC(=O)N1CCCN(C2CC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182877905 525165852 /nfs/dbraw/zinc/16/58/52/525165852.db2.gz AWKBPBMKDNLKBN-SJORKVTESA-N 1 3 348.535 2.519 10 0 EFAEHO CS[C@H](CO)[C@H](C)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245652518 525897738 /nfs/dbraw/zinc/89/77/38/525897738.db2.gz CVJRKOLTCYALQC-BHNDVYRESA-N 1 3 334.529 2.884 10 0 EFAEHO CS[C@H](CO)[C@H](C)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245652518 525897745 /nfs/dbraw/zinc/89/77/45/525897745.db2.gz CVJRKOLTCYALQC-BHNDVYRESA-N 1 3 334.529 2.884 10 0 EFAEHO C[C@@H](c1ccccc1)N1CCC(NC(=O)N2CC[C@H]([NH+](C)C)C2)CC1 ZINC000116561423 526091440 /nfs/dbraw/zinc/09/14/40/526091440.db2.gz TWWUPBWKNASMOW-LPHOPBHVSA-N 1 3 344.503 2.558 10 0 EFAEHO C[C@H](c1ccncc1)N1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)N3C)CC1 ZINC000193040576 526160259 /nfs/dbraw/zinc/16/02/59/526160259.db2.gz BTRPNRZCJPEYIR-MIJOPJBOSA-N 1 3 328.504 2.822 10 0 EFAEHO O=C(NCc1ccccc1)C1CC[NH+](CCCN2CCCCC2)CC1 ZINC000193460175 526731602 /nfs/dbraw/zinc/73/16/02/526731602.db2.gz DOAKDNPVTKZYIM-UHFFFAOYSA-N 1 3 343.515 2.891 10 0 EFAEHO O=c1[nH]c2ccccc2cc1CN1CCC(C[NH+]2CCCC2)CC1 ZINC000111218708 527445017 /nfs/dbraw/zinc/44/50/17/527445017.db2.gz ZZBVBSSIQXCNEK-UHFFFAOYSA-N 1 3 325.456 2.836 10 0 EFAEHO OCCCSCCN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245694679 527543198 /nfs/dbraw/zinc/54/31/98/527543198.db2.gz KVFSVALOTWDSPT-LDLYASANSA-N 1 3 334.529 2.887 10 0 EFAEHO OCCCSCCN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245694679 527543203 /nfs/dbraw/zinc/54/32/03/527543203.db2.gz KVFSVALOTWDSPT-LDLYASANSA-N 1 3 334.529 2.887 10 0 EFAEHO CCC[C@@H](C(=O)NC1CC[NH+](CCc2ccccc2)CC1)N(C)C ZINC000179496479 528840930 /nfs/dbraw/zinc/84/09/30/528840930.db2.gz KNAYJJNZIRZTKA-IBGZPJMESA-N 1 3 331.504 2.540 10 0 EFAEHO CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCc1cccc(CN(C)C)c1 ZINC000173946349 529304124 /nfs/dbraw/zinc/30/41/24/529304124.db2.gz SDOYLKUURXSRLK-RBUKOAKNSA-N 1 3 344.503 2.516 10 0 EFAEHO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1cccc(CN(C)C)c1 ZINC000173946349 529304127 /nfs/dbraw/zinc/30/41/27/529304127.db2.gz SDOYLKUURXSRLK-RBUKOAKNSA-N 1 3 344.503 2.516 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2CCC[C@H](CO)C2)CC1 ZINC000414565021 534936158 /nfs/dbraw/zinc/93/61/58/534936158.db2.gz DQKXYSGKHVSJOX-ICSRJNTNSA-N 1 3 345.531 2.859 10 0 EFAEHO CCC[NH2+]CCNC(=O)N(CC)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418469750 535162453 /nfs/dbraw/zinc/16/24/53/535162453.db2.gz KPSYQBWEYIUQGV-PKOBYXMFSA-N 1 3 346.519 2.853 10 0 EFAEHO CCCC[N@@H+](Cc1ccccc1F)C[C@H]1CCCN(C(=O)CN)C1 ZINC000414695616 535260885 /nfs/dbraw/zinc/26/08/85/535260885.db2.gz PGEOHLQKMIQREB-MRXNPFEDSA-N 1 3 335.467 2.625 10 0 EFAEHO CCCC[N@H+](Cc1ccccc1F)C[C@H]1CCCN(C(=O)CN)C1 ZINC000414695616 535260890 /nfs/dbraw/zinc/26/08/90/535260890.db2.gz PGEOHLQKMIQREB-MRXNPFEDSA-N 1 3 335.467 2.625 10 0 EFAEHO CC[NH+](CC)CC1CCN(Cc2cc(-c3cnn(C)c3C)no2)CC1 ZINC000342274836 535496657 /nfs/dbraw/zinc/49/66/57/535496657.db2.gz PVGBRTNVOKJMSF-UHFFFAOYSA-N 1 3 345.491 2.937 10 0 EFAEHO CN(C)CCNC(=O)c1ccc(C[NH2+][C@@H]2CC[C@H]2C2CCC2)cc1 ZINC000337986103 535890030 /nfs/dbraw/zinc/89/00/30/535890030.db2.gz HLFVWSVJNVMBEZ-RBUKOAKNSA-N 1 3 329.488 2.646 10 0 EFAEHO CN(C)C[C@@H](NC(=O)CC[C@@H]1CCCC[N@@H+]1C)c1ccc(F)cc1 ZINC000360214015 535941306 /nfs/dbraw/zinc/94/13/06/535941306.db2.gz SLAZLEBSSJILRD-ZWKOTPCHSA-N 1 3 335.467 2.809 10 0 EFAEHO CN(C)C[C@@H](NC(=O)CC[C@@H]1CCCC[N@H+]1C)c1ccc(F)cc1 ZINC000360214015 535941312 /nfs/dbraw/zinc/94/13/12/535941312.db2.gz SLAZLEBSSJILRD-ZWKOTPCHSA-N 1 3 335.467 2.809 10 0 EFAEHO CN(C)C[C@@H](NC(=O)CC[C@H]1CCCC[N@@H+]1C)c1ccc(F)cc1 ZINC000360214013 535941682 /nfs/dbraw/zinc/94/16/82/535941682.db2.gz SLAZLEBSSJILRD-QZTJIDSGSA-N 1 3 335.467 2.809 10 0 EFAEHO CN(C)C[C@@H](NC(=O)CC[C@H]1CCCC[N@H+]1C)c1ccc(F)cc1 ZINC000360214013 535941687 /nfs/dbraw/zinc/94/16/87/535941687.db2.gz SLAZLEBSSJILRD-QZTJIDSGSA-N 1 3 335.467 2.809 10 0 EFAEHO CC(CN1CCCCC[C@@H]1CCO)C[N@@H+]1CCCCC[C@@H]1CCO ZINC000342042286 545945016 /nfs/dbraw/zinc/94/50/16/545945016.db2.gz FVDVBLWXQCGNIO-WOJBJXKFSA-N 1 3 340.552 2.877 10 0 EFAEHO CC(CN1CCCCC[C@@H]1CCO)C[N@H+]1CCCCC[C@@H]1CCO ZINC000342042286 545945019 /nfs/dbraw/zinc/94/50/19/545945019.db2.gz FVDVBLWXQCGNIO-WOJBJXKFSA-N 1 3 340.552 2.877 10 0 EFAEHO CC[NH+](CC)C[C@H](C)NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000355056837 546076760 /nfs/dbraw/zinc/07/67/60/546076760.db2.gz RIRPCOMQTYDIOV-PKOBYXMFSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[NH+](CC)C[C@H](C)NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000355056828 546077016 /nfs/dbraw/zinc/07/70/16/546077016.db2.gz RIRPCOMQTYDIOV-HKUYNNGSSA-N 1 3 346.519 2.633 10 0 EFAEHO CCCN1CCN(c2ccccc2CN[C@@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000414926939 546194592 /nfs/dbraw/zinc/19/45/92/546194592.db2.gz OHYNDYHBGNDVDO-RBUKOAKNSA-N 1 3 330.520 2.578 10 0 EFAEHO O=C(NCc1ccccc1CN1CCCCC1)[C@@H]1C[C@@]12CCC[NH2+]C2 ZINC000655442917 546449362 /nfs/dbraw/zinc/44/93/62/546449362.db2.gz GMBPOWKOOAMRRY-PZJWPPBQSA-N 1 3 341.499 2.678 10 0 EFAEHO C[C@H]1CC[C@@H]([NH2+]CC2(N3CCCCC3)CCN(C)CC2)CS1 ZINC000655719193 546548365 /nfs/dbraw/zinc/54/83/65/546548365.db2.gz HUQCYFIKWSXXET-DLBZAZTESA-N 1 3 325.566 2.810 10 0 EFAEHO CCC(C)(C)N1CCN(C(=O)Nc2ccc3c(c2F)CC[NH2+]C3)CC1 ZINC000655910089 546633452 /nfs/dbraw/zinc/63/34/52/546633452.db2.gz SUBQMHNAZRDLKB-UHFFFAOYSA-N 1 3 348.466 2.810 10 0 EFAEHO COC[C@H](CCC[NH3+])NC1(c2cccc(OC(F)(F)F)c2)CC1 ZINC000656200624 546720071 /nfs/dbraw/zinc/72/00/71/546720071.db2.gz BQFZAFOLKNASPJ-ZDUSSCGKSA-N 1 3 332.366 2.918 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C1CCN(C(=O)C(C)(C)C)CC1 ZINC000656200601 546720184 /nfs/dbraw/zinc/72/01/84/546720184.db2.gz APTQDEBUUOHXOS-CYBMUJFWSA-N 1 3 332.492 2.536 10 0 EFAEHO [NH3+]CCCN(c1cccc(F)c1)C1CCN(C[C@H]2CCCO2)CC1 ZINC000656255143 546749193 /nfs/dbraw/zinc/74/91/93/546749193.db2.gz HPTIIJDXJOXDKY-LJQANCHMSA-N 1 3 335.467 2.624 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000656552544 546839905 /nfs/dbraw/zinc/83/99/05/546839905.db2.gz XHLVIFZLPZXDEV-SJORKVTESA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000656552544 546839908 /nfs/dbraw/zinc/83/99/08/546839908.db2.gz XHLVIFZLPZXDEV-SJORKVTESA-N 1 3 336.524 2.567 10 0 EFAEHO COc1cc(CN2CCC[C@H](C3CC[NH2+]CC3)C2)cc(OC)c1OC ZINC000656786633 546924340 /nfs/dbraw/zinc/92/43/40/546924340.db2.gz VGMRXHMWPDJTTN-KRWDZBQOSA-N 1 3 348.487 2.924 10 0 EFAEHO CC1CC[NH+](CCCCNCc2ccnn2-c2ccncc2)CC1 ZINC000657311998 547103446 /nfs/dbraw/zinc/10/34/46/547103446.db2.gz BHPSRKHOAKMHBB-UHFFFAOYSA-N 1 3 327.476 2.869 10 0 EFAEHO CC[C@H]1C[C@H]([NH2+]CCCCN2CCN(c3ccccc3)CC2)CO1 ZINC000657315161 547105973 /nfs/dbraw/zinc/10/59/73/547105973.db2.gz NCTANZQEIVVLCP-ICSRJNTNSA-N 1 3 331.504 2.746 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+]Cc2c(C3CCC3)cnn2C)C[C@H](C)O1 ZINC000657366322 547133748 /nfs/dbraw/zinc/13/37/48/547133748.db2.gz FNTVPBGXWAEBRO-IYBDPMFKSA-N 1 3 334.508 2.667 10 0 EFAEHO CC(C)Cn1nccc1CNCC1CC[NH+](C2CCOCC2)CC1 ZINC000657537632 547196361 /nfs/dbraw/zinc/19/63/61/547196361.db2.gz RRDMOWHJUSTNCA-UHFFFAOYSA-N 1 3 334.508 2.520 10 0 EFAEHO Cn1ncc(C2CCC2)c1CNCC1CC[NH+](C2CCOCC2)CC1 ZINC000657537156 547196409 /nfs/dbraw/zinc/19/64/09/547196409.db2.gz ALISMFOMVKHLGM-UHFFFAOYSA-N 1 3 346.519 2.668 10 0 EFAEHO COc1nc2ccccc2cc1CN[C@@H](C)CN(C)CCC[NH+](C)C ZINC000657572804 547212078 /nfs/dbraw/zinc/21/20/78/547212078.db2.gz GVGPUBVUHUFECH-INIZCTEOSA-N 1 3 344.503 2.605 10 0 EFAEHO CO[C@@H]1CCC[C@@H]([C@H](CO)[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000657576444 547214219 /nfs/dbraw/zinc/21/42/19/547214219.db2.gz KYSZOBNDAMVWJJ-AHRSYUTCSA-N 1 3 338.536 2.939 10 0 EFAEHO CO[C@@H]1CCC[C@@H]([C@H](CO)NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000657576444 547214223 /nfs/dbraw/zinc/21/42/23/547214223.db2.gz KYSZOBNDAMVWJJ-AHRSYUTCSA-N 1 3 338.536 2.939 10 0 EFAEHO CN(C)c1ccccc1CNCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000657593459 547220243 /nfs/dbraw/zinc/22/02/43/547220243.db2.gz AAGMMTMAMZMHGY-HXUWFJFHSA-N 1 3 339.483 2.609 10 0 EFAEHO CN(C)c1ccccc1CNCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000657593459 547220250 /nfs/dbraw/zinc/22/02/50/547220250.db2.gz AAGMMTMAMZMHGY-HXUWFJFHSA-N 1 3 339.483 2.609 10 0 EFAEHO O[C@@H]1CCN(Cc2ccc(C[NH2+][C@@H]3CCc4ccccc4C3)cc2)C1 ZINC000657593954 547220386 /nfs/dbraw/zinc/22/03/86/547220386.db2.gz DMHXBOFWVKDNIR-FGZHOGPDSA-N 1 3 336.479 2.900 10 0 EFAEHO Cc1cc(F)ccc1CNCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000657594324 547221508 /nfs/dbraw/zinc/22/15/08/547221508.db2.gz IKYJJZOCEJRUSD-FQEVSTJZSA-N 1 3 328.431 2.991 10 0 EFAEHO Cc1cc(F)ccc1CNCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1 ZINC000657594324 547221514 /nfs/dbraw/zinc/22/15/14/547221514.db2.gz IKYJJZOCEJRUSD-FQEVSTJZSA-N 1 3 328.431 2.991 10 0 EFAEHO CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)CCO1 ZINC000657595667 547222125 /nfs/dbraw/zinc/22/21/25/547222125.db2.gz JEHATMUXUIMJNQ-ZCNNSNEGSA-N 1 3 332.488 2.546 10 0 EFAEHO Cc1cc(F)ccc1CNCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000657594327 547222975 /nfs/dbraw/zinc/22/29/75/547222975.db2.gz IKYJJZOCEJRUSD-HXUWFJFHSA-N 1 3 328.431 2.991 10 0 EFAEHO Cc1cc(F)ccc1CNCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000657594327 547222979 /nfs/dbraw/zinc/22/29/79/547222979.db2.gz IKYJJZOCEJRUSD-HXUWFJFHSA-N 1 3 328.431 2.991 10 0 EFAEHO CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)CCO1 ZINC000657595654 547223179 /nfs/dbraw/zinc/22/31/79/547223179.db2.gz JEHATMUXUIMJNQ-AQNXPRMDSA-N 1 3 332.488 2.546 10 0 EFAEHO FC1(F)C[C@@H]1OCCNCc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000657618392 547230942 /nfs/dbraw/zinc/23/09/42/547230942.db2.gz LLDXAKMKCRAHKN-KRWDZBQOSA-N 1 3 340.414 2.675 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2C[C@H](O)C23CCC3)CC1 ZINC000657707676 547259652 /nfs/dbraw/zinc/25/96/52/547259652.db2.gz VSKNXAXYHVMNMA-PMACEKPBSA-N 1 3 343.515 2.612 10 0 EFAEHO CN(c1ccccc1C[NH2+]CC1CCC(O)CC1)C1CCN(C)CC1 ZINC000657740166 547269163 /nfs/dbraw/zinc/26/91/63/547269163.db2.gz GVGWWUJIVNHMGV-UHFFFAOYSA-N 1 3 345.531 2.858 10 0 EFAEHO C[C@@H]1CN(C)C[C@H]1[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000657773060 547280876 /nfs/dbraw/zinc/28/08/76/547280876.db2.gz PVUPLTKGZNNTPK-YZGWKJHDSA-N 1 3 327.516 2.828 10 0 EFAEHO C[C@@H]1CN(C)C[C@@H]1[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000657773058 547281505 /nfs/dbraw/zinc/28/15/05/547281505.db2.gz PVUPLTKGZNNTPK-RLLQIKCJSA-N 1 3 327.516 2.828 10 0 EFAEHO CN(C)CCOc1ccc(C[NH2+]CC2(CC(N)=O)CCCCC2)cc1 ZINC000657797106 547287806 /nfs/dbraw/zinc/28/78/06/547287806.db2.gz JMKHHJXGSQJXSO-UHFFFAOYSA-N 1 3 347.503 2.543 10 0 EFAEHO c1c(CNCC2CC[NH+](CC3CC3)CC2)[nH]nc1-c1cccnc1 ZINC000657812500 547292389 /nfs/dbraw/zinc/29/23/89/547292389.db2.gz DWMPBXCRPLTWSC-UHFFFAOYSA-N 1 3 325.460 2.683 10 0 EFAEHO COC[C@@H](CC1CCOCC1)[NH2+]C[C@H]1CCCN(CC(C)C)C1 ZINC000657932982 547319323 /nfs/dbraw/zinc/31/93/23/547319323.db2.gz YAMIHMADSYLSRC-RTBURBONSA-N 1 3 326.525 2.776 10 0 EFAEHO COC[C@@H](CC1CCOCC1)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000657932982 547319327 /nfs/dbraw/zinc/31/93/27/547319327.db2.gz YAMIHMADSYLSRC-RTBURBONSA-N 1 3 326.525 2.776 10 0 EFAEHO COC[C@@H](CC1CCOCC1)NC[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000657932982 547319331 /nfs/dbraw/zinc/31/93/31/547319331.db2.gz YAMIHMADSYLSRC-RTBURBONSA-N 1 3 326.525 2.776 10 0 EFAEHO OC1(C[NH2+][C@H]2CCCSCC2)CCN(Cc2ccccc2)CC1 ZINC000658037829 547339885 /nfs/dbraw/zinc/33/98/85/547339885.db2.gz YULUNZCWCXTUOT-SFHVURJKSA-N 1 3 334.529 2.889 10 0 EFAEHO COC[C@H](CC[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21)OC ZINC000658082240 547352153 /nfs/dbraw/zinc/35/21/53/547352153.db2.gz KNHWYTYOBFZPPC-UWHLTILDSA-N 1 3 346.515 2.928 10 0 EFAEHO CC(C)(C)OC1CC([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)C1 ZINC000658135382 547366850 /nfs/dbraw/zinc/36/68/50/547366850.db2.gz DITVFYOBKMQPPF-XBMUEBEBSA-N 1 3 332.488 2.689 10 0 EFAEHO COC[C@H]([NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1)C1CCCC1 ZINC000658137988 547367365 /nfs/dbraw/zinc/36/73/65/547367365.db2.gz LKLJITFWCVDQCS-PMACEKPBSA-N 1 3 332.488 2.548 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@@H]([NH2+]Cc3ccc(CN4CC[C@H](O)C4)cc3)C[C@H]2C1 ZINC000658137383 547368074 /nfs/dbraw/zinc/36/80/74/547368074.db2.gz KPSFULLYXJAUFS-HGJUEJDCSA-N 1 3 344.499 2.546 10 0 EFAEHO O[C@@H]1CCN(Cc2ccc(C[NH2+]C3CCC4(CCCO4)CC3)cc2)C1 ZINC000658137579 547368170 /nfs/dbraw/zinc/36/81/70/547368170.db2.gz KEMZBVVWTPAPJT-NYLDSWQDSA-N 1 3 344.499 2.835 10 0 EFAEHO COC[C@@H](CC(C)(C)C)[NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000658139790 547368842 /nfs/dbraw/zinc/36/88/42/547368842.db2.gz SBTKHDCYYVMVGX-RTBURBONSA-N 1 3 334.504 2.794 10 0 EFAEHO COC1([C@H](C)[NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)CCCC1 ZINC000658140527 547369050 /nfs/dbraw/zinc/36/90/50/547369050.db2.gz VCDLHLIITWIWTJ-LPHOPBHVSA-N 1 3 332.488 2.691 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)C1(C)C ZINC000658139186 547369245 /nfs/dbraw/zinc/36/92/45/547369245.db2.gz PHZLMSISTCDNET-CEXWTWQISA-N 1 3 332.488 2.546 10 0 EFAEHO COC1(C[C@H](C)[NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)CCC1 ZINC000658142499 547370167 /nfs/dbraw/zinc/37/01/67/547370167.db2.gz YLDGJEWGPRJKOA-QFBILLFUSA-N 1 3 332.488 2.691 10 0 EFAEHO C[C@@H]([NH2+]CCO[C@H]1CC1(F)F)c1ccc(OCCN(C)C)cc1 ZINC000658171496 547379597 /nfs/dbraw/zinc/37/95/97/547379597.db2.gz ZDGMYAQENMPLCZ-CJNGLKHVSA-N 1 3 328.403 2.702 10 0 EFAEHO C[C@@H](NCCO[C@H]1CC1(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000658171496 547379601 /nfs/dbraw/zinc/37/96/01/547379601.db2.gz ZDGMYAQENMPLCZ-CJNGLKHVSA-N 1 3 328.403 2.702 10 0 EFAEHO C(=C\C[N@@H+]1CC[C@@]2(C1)CCCOC2)\CN1CC[C@@]2(C1)CCCOC2 ZINC000671253911 547550920 /nfs/dbraw/zinc/55/09/20/547550920.db2.gz OJURGGIHSNYSIN-JLGNTZPISA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C\C[N@H+]1CC[C@@]2(C1)CCCOC2)\CN1CC[C@@]2(C1)CCCOC2 ZINC000671253911 547550924 /nfs/dbraw/zinc/55/09/24/547550924.db2.gz OJURGGIHSNYSIN-JLGNTZPISA-N 1 3 334.504 2.548 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@H]32)c(N2CCCC2)n1 ZINC000671759973 547667879 /nfs/dbraw/zinc/66/78/79/547667879.db2.gz FPQXMRYGJLGLRT-OTWHNJEPSA-N 1 3 328.504 2.953 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@H]32)c(N2CCCC2)n1 ZINC000671759972 547668702 /nfs/dbraw/zinc/66/87/02/547668702.db2.gz FPQXMRYGJLGLRT-IPMKNSEASA-N 1 3 328.504 2.953 10 0 EFAEHO CC[C@H](CN1CCCC1)NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C(C)C ZINC000675199537 548228765 /nfs/dbraw/zinc/22/87/65/548228765.db2.gz KJWRQMWKSAGPGH-KURKYZTESA-N 1 3 336.524 2.518 10 0 EFAEHO CC[C@H](CN1CCCC1)NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000675199537 548228767 /nfs/dbraw/zinc/22/87/67/548228767.db2.gz KJWRQMWKSAGPGH-KURKYZTESA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCN(CC2CC2)C1 ZINC000675834769 548363043 /nfs/dbraw/zinc/36/30/43/548363043.db2.gz ZSBPRONMJLPTOL-JRGCBEDISA-N 1 3 327.516 2.971 10 0 EFAEHO CC[C@H]([NH2+][C@@H]1CCN(C2CCN(C)CC2)C1)c1cccc(OC)c1 ZINC000675875878 548366421 /nfs/dbraw/zinc/36/64/21/548366421.db2.gz UHQNCJZZQDUWAJ-XLIONFOSSA-N 1 3 331.504 2.904 10 0 EFAEHO CC[C@H](C[NH+]1CCCC1)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000677577217 548728363 /nfs/dbraw/zinc/72/83/63/548728363.db2.gz LLZLLZJQQLVEPQ-GUDVDZBRSA-N 1 3 344.503 2.605 10 0 EFAEHO CN(CCCCOc1ccccc1)[C@@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000678718750 548977099 /nfs/dbraw/zinc/97/70/99/548977099.db2.gz BOHKSUFQVUGDOZ-HXUWFJFHSA-N 1 3 345.531 2.946 10 0 EFAEHO CN(CCCCOc1ccccc1)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000678718750 548977105 /nfs/dbraw/zinc/97/71/05/548977105.db2.gz BOHKSUFQVUGDOZ-HXUWFJFHSA-N 1 3 345.531 2.946 10 0 EFAEHO CN1CCC(N2CC[C@@H]([N@H+](C)CCCCOc3ccccc3)C2)CC1 ZINC000678718750 548977109 /nfs/dbraw/zinc/97/71/09/548977109.db2.gz BOHKSUFQVUGDOZ-HXUWFJFHSA-N 1 3 345.531 2.946 10 0 EFAEHO CN1CCC(N2CC[C@@H]([N@@H+](C)CCCCOc3ccccc3)C2)CC1 ZINC000678718750 548977115 /nfs/dbraw/zinc/97/71/15/548977115.db2.gz BOHKSUFQVUGDOZ-HXUWFJFHSA-N 1 3 345.531 2.946 10 0 EFAEHO c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](NCCOC[C@@H]2CCOC2)C3)cc1 ZINC000679392583 549118359 /nfs/dbraw/zinc/11/83/59/549118359.db2.gz BVYUKJXKZCURHU-MXEMCNAFSA-N 1 3 344.499 2.825 10 0 EFAEHO c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](NCCOC[C@@H]2CCOC2)C3)cc1 ZINC000679392583 549118363 /nfs/dbraw/zinc/11/83/63/549118363.db2.gz BVYUKJXKZCURHU-MXEMCNAFSA-N 1 3 344.499 2.825 10 0 EFAEHO C[C@@H]1CN(C)C[C@@H]1[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000679721425 549190410 /nfs/dbraw/zinc/19/04/10/549190410.db2.gz NUYWWMUINNIOHH-RQXATKFSSA-N 1 3 327.516 2.827 10 0 EFAEHO c1cc(OCC[NH+]2CCCC2)ccc1CN1CCC12CCOCC2 ZINC000683718639 549935708 /nfs/dbraw/zinc/93/57/08/549935708.db2.gz MQDAWTYXNFYQNP-UHFFFAOYSA-N 1 3 330.472 2.916 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NC[C@H]2N(C)CCCC2(C)C)CC1 ZINC000684126372 549995818 /nfs/dbraw/zinc/99/58/18/549995818.db2.gz ULYOSYSOJLVYNP-QGZVFWFLSA-N 1 3 338.540 2.528 10 0 EFAEHO CN1CCN(CC2CC[NH+](Cc3cccc4cnccc43)CC2)CC1 ZINC000685455057 550153740 /nfs/dbraw/zinc/15/37/40/550153740.db2.gz LXBYDWRRWMRPTD-UHFFFAOYSA-N 1 3 338.499 2.694 10 0 EFAEHO C[C@H](CNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)[NH+]1CCCCC1 ZINC000758849503 575878702 /nfs/dbraw/zinc/87/87/02/575878702.db2.gz KKYMWAGYSGCWSE-NZSAHSFTSA-N 1 3 344.503 2.605 10 0 EFAEHO c1ccc(CN2C[C@H]3C[C@@H](C2)C3[NH2+][C@H]2CCN3CCCC[C@@H]23)cc1 ZINC000399640325 577329963 /nfs/dbraw/zinc/32/99/63/577329963.db2.gz GZHRONMUHXYXJS-MLVLIFOTSA-N 1 3 325.500 2.723 10 0 EFAEHO c1ccc(CN2C[C@H]3C[C@@H](C2)C3[NH2+][C@H]2CCN3CCCC[C@H]23)cc1 ZINC000399640324 577329992 /nfs/dbraw/zinc/32/99/92/577329992.db2.gz GZHRONMUHXYXJS-JFROBXPVSA-N 1 3 325.500 2.723 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@H](O)c2cccnc2)CC[N@@H+]1Cc1ccccc1 ZINC000773081260 581394812 /nfs/dbraw/zinc/39/48/12/581394812.db2.gz LWCLGFKVDIZSJA-AHRSYUTCSA-N 1 3 325.456 2.758 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@H](O)c2cccnc2)CC[N@H+]1Cc1ccccc1 ZINC000773081260 581394814 /nfs/dbraw/zinc/39/48/14/581394814.db2.gz LWCLGFKVDIZSJA-AHRSYUTCSA-N 1 3 325.456 2.758 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC[C@@H](O)c1cccnc1 ZINC000773083044 581395045 /nfs/dbraw/zinc/39/50/45/581395045.db2.gz RUSUVBJWNDXQMV-NSISKUIASA-N 1 3 325.456 2.615 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC[C@@H](O)c1cccnc1 ZINC000773083044 581395048 /nfs/dbraw/zinc/39/50/48/581395048.db2.gz RUSUVBJWNDXQMV-NSISKUIASA-N 1 3 325.456 2.615 10 0 EFAEHO Cc1cc(CNCCN(C)C(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)cs1 ZINC001691359733 1248694402 /nfs/dbraw/zinc/69/44/02/1248694402.db2.gz CYXWUWPPAUZOCM-DLBZAZTESA-N 1 3 335.517 2.621 10 0 EFAEHO Cc1cc(CNCCN(C)C(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)cs1 ZINC001691359733 1248694416 /nfs/dbraw/zinc/69/44/16/1248694416.db2.gz CYXWUWPPAUZOCM-DLBZAZTESA-N 1 3 335.517 2.621 10 0 EFAEHO CN(C[C@H]1CCN1CCC1=CCCCC1)C(=O)C1(C[NH+](C)C)CC1 ZINC001691395870 1248730735 /nfs/dbraw/zinc/73/07/35/1248730735.db2.gz QPCBWXPMMVFKCR-GOSISDBHSA-N 1 3 333.520 2.751 10 0 EFAEHO CCN1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)CCCC[NH+](C)C)C1 ZINC001691451899 1249150974 /nfs/dbraw/zinc/15/09/74/1249150974.db2.gz URAXEZSQNPEFRF-RTBURBONSA-N 1 3 349.494 2.852 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\C[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001268551685 1250102284 /nfs/dbraw/zinc/10/22/84/1250102284.db2.gz IKTDYBQRGOVREA-XFCCUVRLSA-N 1 3 345.478 2.660 10 0 EFAEHO CN(C)CCC[NH2+][C@H]1CCN(C(=O)C(F)(F)F)Cc2ccccc21 ZINC000850419912 1250477542 /nfs/dbraw/zinc/47/75/42/1250477542.db2.gz GEGUZBAWYHHASH-HNNXBMFYSA-N 1 3 343.393 2.564 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N(C)CC[NH2+]CC2CC(C)(C)C2)c1 ZINC001691619457 1251834615 /nfs/dbraw/zinc/83/46/15/1251834615.db2.gz OWUWJXHUMUOETI-UHFFFAOYSA-N 1 3 331.504 2.846 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)N[C@@]2(C)CCN(CCCCC(F)(F)F)C2)C1 ZINC001484069085 1252179120 /nfs/dbraw/zinc/17/91/20/1252179120.db2.gz WXNBCFXOWSDJKH-HOCLYGCPSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)N[C@@]2(C)CCN(CCCCC(F)(F)F)C2)C1 ZINC001484069085 1252179125 /nfs/dbraw/zinc/17/91/25/1252179125.db2.gz WXNBCFXOWSDJKH-HOCLYGCPSA-N 1 3 349.441 2.641 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@]1(C)CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001484119033 1252290213 /nfs/dbraw/zinc/29/02/13/1252290213.db2.gz JVVVPNQPLFSCTE-XJDXJNMNSA-N 1 3 335.536 2.903 10 0 EFAEHO CC[NH2+][C@@H](CNC(=O)[C@H]1CCCN1C(C)C)c1ccccc1CC ZINC001484325174 1252402299 /nfs/dbraw/zinc/40/22/99/1252402299.db2.gz OMNOTTVJEAOOPZ-RBUKOAKNSA-N 1 3 331.504 2.889 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001484357965 1252451224 /nfs/dbraw/zinc/45/12/24/1252451224.db2.gz KHGJILVUBOOGGU-QUCCMNQESA-N 1 3 345.531 2.704 10 0 EFAEHO CCCCC[NH2+]C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1C ZINC001484376090 1252484415 /nfs/dbraw/zinc/48/44/15/1252484415.db2.gz BSACYYPVUSKCKZ-IRXDYDNUSA-N 1 3 325.541 2.839 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2ccc(CF)cc2)C1 ZINC001484383853 1252487862 /nfs/dbraw/zinc/48/78/62/1252487862.db2.gz DJWGANHHHFIGDH-QFBILLFUSA-N 1 3 349.494 2.680 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]CCC2CCCCC2)C1 ZINC001484384231 1252489274 /nfs/dbraw/zinc/48/92/74/1252489274.db2.gz KKKQQARDUXQONT-HKUYNNGSSA-N 1 3 337.552 2.981 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)C[C@H]21 ZINC001484472062 1252694231 /nfs/dbraw/zinc/69/42/31/1252694231.db2.gz KKUVVHMYPOGJKV-ZWKOTPCHSA-N 1 3 349.544 2.903 10 0 EFAEHO Cc1ccc(C[N@H+]2CCC[C@H](NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001484727611 1252818784 /nfs/dbraw/zinc/81/87/84/1252818784.db2.gz DUHMXXGBOPRYIY-IBGZPJMESA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccc(C[N@@H+]2CCC[C@H](NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001484727611 1252818791 /nfs/dbraw/zinc/81/87/91/1252818791.db2.gz DUHMXXGBOPRYIY-IBGZPJMESA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+]1CCC[C@H](NC(=O)CN(C)C(C)C)CC1 ZINC001484728551 1252821003 /nfs/dbraw/zinc/82/10/03/1252821003.db2.gz RALXEXIDIMVEJR-IBGZPJMESA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+]1CCC[C@H](NC(=O)CN(C)C(C)C)CC1 ZINC001484728551 1252821019 /nfs/dbraw/zinc/82/10/19/1252821019.db2.gz RALXEXIDIMVEJR-IBGZPJMESA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)C(C)(C)[NH+]1CCCCC1 ZINC001484742956 1252852666 /nfs/dbraw/zinc/85/26/66/1252852666.db2.gz URAPESSLVCVLKK-INIZCTEOSA-N 1 3 329.504 2.779 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@H](C[NH2+]CCCC(C)(C)C)C2CC2)C1 ZINC001485825217 1256382973 /nfs/dbraw/zinc/38/29/73/1256382973.db2.gz BKJGZAZQUMWJLX-SJLPKXTDSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCCC[NH2+][C@@H]1CN(C(=O)Cc2c[nH]cn2)CC[C@@H]1C(F)(F)F ZINC001279170559 1258061119 /nfs/dbraw/zinc/06/11/19/1258061119.db2.gz DEZFMFUHWBOPMI-UONOGXRCSA-N 1 3 346.397 2.511 10 0 EFAEHO CCN(CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)CC(=O)NCc1ccc(F)cc1 ZINC000923297977 1261421857 /nfs/dbraw/zinc/42/18/57/1261421857.db2.gz GZZVAIUGNYANBJ-JLYLLQBASA-N 1 3 347.478 2.685 10 0 EFAEHO COC(=O)[C@@H](C)Oc1ccccc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C ZINC000921791354 1261444651 /nfs/dbraw/zinc/44/46/51/1261444651.db2.gz TXQAQUBCIWQKCI-CCNLRDMRSA-N 1 3 346.471 2.732 10 0 EFAEHO CN(CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@H]1CCN(c2ccccc2F)C1=O ZINC000923315265 1261449499 /nfs/dbraw/zinc/44/94/99/1261449499.db2.gz DVSBOZKZYYGFJY-IYHXRUFHSA-N 1 3 345.462 2.784 10 0 EFAEHO C[C@H]([NH3+])[C@H]1CCN(C[C@@H]2Cc3ccccc3O[C@H]2C(F)(F)F)C1 ZINC000923332200 1261483090 /nfs/dbraw/zinc/48/30/90/1261483090.db2.gz QFLDUTOEWDARSI-ATVPRXPUSA-N 1 3 328.378 2.838 10 0 EFAEHO CC(C)(NCC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cn(-c2ccccc2)nn1 ZINC000903903844 1261518732 /nfs/dbraw/zinc/51/87/32/1261518732.db2.gz XHPUAWWFEZWMAJ-MQVJKMGUSA-N 1 3 325.460 2.623 10 0 EFAEHO Cc1cc(C)cc(OC[C@H](O)CN2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)c1 ZINC000923365826 1261559625 /nfs/dbraw/zinc/55/96/25/1261559625.db2.gz ZPQRYUBRIZYROX-QWFCFKBJSA-N 1 3 332.488 2.507 10 0 EFAEHO C[C@@H]1CN(C[C@@H](O)COc2ccc(-c3ccccc3)cc2)C[C@H]1C[NH3+] ZINC000923409932 1261623990 /nfs/dbraw/zinc/62/39/90/1261623990.db2.gz CPPKMIBWVAJPSS-NSISKUIASA-N 1 3 340.467 2.620 10 0 EFAEHO Cc1ccc(C)c(OC[C@H](O)CN2CC[C@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000923414532 1261628189 /nfs/dbraw/zinc/62/81/89/1261628189.db2.gz LQKLHXWGDPFVMA-YLJYHZDGSA-N 1 3 334.504 2.740 10 0 EFAEHO [NH3+]C[C@@H]1CC2(CO1)CCN(CCc1c(F)cccc1Cl)CC2 ZINC000923449684 1261686420 /nfs/dbraw/zinc/68/64/20/1261686420.db2.gz QANCPQNZVIRMLV-ZDUSSCGKSA-N 1 3 326.843 2.851 10 0 EFAEHO [NH3+]C[C@H]1CC2(CO1)CCN(Cc1cc(-c3ccccc3)no1)CC2 ZINC000923450471 1261688029 /nfs/dbraw/zinc/68/80/29/1261688029.db2.gz VEXZATVTIFEXEZ-QGZVFWFLSA-N 1 3 327.428 2.671 10 0 EFAEHO C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923496329 1261764092 /nfs/dbraw/zinc/76/40/92/1261764092.db2.gz BEMWAICCAJMVQH-KLHDSHLOSA-N 1 3 335.517 2.717 10 0 EFAEHO Cc1cc(F)ccc1N1CCC[C@H](N2CC[C@H](C[NH3+])[C@@H](C)C2)C1=O ZINC000923496395 1261765290 /nfs/dbraw/zinc/76/52/90/1261765290.db2.gz HRRCPVQWRCQKDZ-DAYGRLMNSA-N 1 3 333.451 2.546 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C[NH3+])[C@@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000923502426 1261781357 /nfs/dbraw/zinc/78/13/57/1261781357.db2.gz ZAHZMMRZVSCVKL-FTRWYGJKSA-N 1 3 343.515 2.659 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C[NH3+])[C@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000923502430 1261782820 /nfs/dbraw/zinc/78/28/20/1261782820.db2.gz ZAHZMMRZVSCVKL-GUXCAODWSA-N 1 3 343.515 2.659 10 0 EFAEHO C[C@@H]1CN(CC(=O)NCC2(c3ccccc3)CCCC2)CC[C@H]1C[NH3+] ZINC000923498232 1261790475 /nfs/dbraw/zinc/79/04/75/1261790475.db2.gz KDTQEKARLGMXTC-MSOLQXFVSA-N 1 3 343.515 2.531 10 0 EFAEHO CC(C)[C@H](NC(=O)CN1CC[C@H](C[NH3+])[C@@H](C)C1)c1ccc(F)cc1 ZINC000923500511 1261797412 /nfs/dbraw/zinc/79/74/12/1261797412.db2.gz PICACFGMKSRSJH-GMBSWORKSA-N 1 3 335.467 2.556 10 0 EFAEHO c1cn(-c2ccc(CN3CCC([C@H]4CCC[NH2+]CC4)CC3)cn2)cn1 ZINC000923505911 1261805044 /nfs/dbraw/zinc/80/50/44/1261805044.db2.gz DHTBAFJFKLBQBM-SFHVURJKSA-N 1 3 339.487 2.869 10 0 EFAEHO c1ccc2c(c1)[C@H](C[C@@H]1COCCN1)CN2CCCC1CC[NH2+]CC1 ZINC000923538708 1261871450 /nfs/dbraw/zinc/87/14/50/1261871450.db2.gz APISHTIWKFHQGS-RTBURBONSA-N 1 3 343.515 2.749 10 0 EFAEHO c1ccc2c(c1)[C@@H](C[C@@H]1COCCN1)CN2CCCC1CC[NH2+]CC1 ZINC000923538707 1261871760 /nfs/dbraw/zinc/87/17/60/1261871760.db2.gz APISHTIWKFHQGS-RBUKOAKNSA-N 1 3 343.515 2.749 10 0 EFAEHO CCCN(C)CC(=O)N(C)C[C@@H](C)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001485947129 1262514944 /nfs/dbraw/zinc/51/49/44/1262514944.db2.gz MXNMXHDQDBICAI-HUUCEWRRSA-N 1 3 333.467 2.590 10 0 EFAEHO C[C@@H]1[C@H]([NH2+]CCCCc2ccccc2)CCN1C(=O)Cc1c[nH]cn1 ZINC001486088480 1262610562 /nfs/dbraw/zinc/61/05/62/1262610562.db2.gz HVGGONDCSMEUAV-VQIMIIECSA-N 1 3 340.471 2.554 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCc2cccc(C)c2)C[C@@H]1C ZINC001486129975 1262663162 /nfs/dbraw/zinc/66/31/62/1262663162.db2.gz PJYLXOHMSMDWLI-ICSRJNTNSA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@@H]1C[C@@H](NCc2ccccc2F)CN1C(=O)CCCC[NH+](C)C ZINC001486130371 1262663938 /nfs/dbraw/zinc/66/39/38/1262663938.db2.gz RBSRROGHHUTDPX-NVXWUHKLSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1C[C@H](NCc2cc(C)ccc2F)C[C@@H]1C ZINC001486132478 1262665692 /nfs/dbraw/zinc/66/56/92/1262665692.db2.gz ULBKAIVDOOGKDH-DOTOQJQBSA-N 1 3 335.467 2.555 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1C[C@H](NCc2cc(C)ccc2F)C[C@@H]1C ZINC001486132478 1262665695 /nfs/dbraw/zinc/66/56/95/1262665695.db2.gz ULBKAIVDOOGKDH-DOTOQJQBSA-N 1 3 335.467 2.555 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H]1C[C@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001486134599 1262668507 /nfs/dbraw/zinc/66/85/07/1262668507.db2.gz LVMKGCYECYEPGV-MAUKXSAKSA-N 1 3 335.467 2.553 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H]1C[C@@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001486134600 1262669049 /nfs/dbraw/zinc/66/90/49/1262669049.db2.gz LVMKGCYECYEPGV-QAPCUYQASA-N 1 3 335.467 2.553 10 0 EFAEHO C[C@H](N[C@@H]1CN(C(=O)CC[NH+](C)C)CC1(C)C)c1ccccc1F ZINC001486240676 1262841388 /nfs/dbraw/zinc/84/13/88/1262841388.db2.gz OQSGKTIOKMBQBP-WMLDXEAASA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccccc1)C(=O)C1(C[NH+](C)C)CC1 ZINC001486373846 1262974300 /nfs/dbraw/zinc/97/43/00/1262974300.db2.gz FKCOLQVQKDNCSE-UHFFFAOYSA-N 1 3 331.504 2.697 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](CNCC=C(Cl)Cl)C(C)(C)C ZINC001486414913 1263092593 /nfs/dbraw/zinc/09/25/93/1263092593.db2.gz DMZCRIOVTDWNAO-LBPRGKRZSA-N 1 3 338.323 2.768 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](CNCC=C(Cl)Cl)C(C)(C)C ZINC001486414913 1263092599 /nfs/dbraw/zinc/09/25/99/1263092599.db2.gz DMZCRIOVTDWNAO-LBPRGKRZSA-N 1 3 338.323 2.768 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C)C1)C1CC[NH+](CCCCCF)CC1 ZINC001486448829 1263140101 /nfs/dbraw/zinc/14/01/01/1263140101.db2.gz CLTYMJYFWVCFHW-SJORKVTESA-N 1 3 341.515 2.685 10 0 EFAEHO CCC[NH+]1CCC([C@H](C)NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001486449405 1263141843 /nfs/dbraw/zinc/14/18/43/1263141843.db2.gz WDTJNSGMFWJLRL-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]CCCc2ccccc2)C1)N(C)C ZINC001486480785 1263216086 /nfs/dbraw/zinc/21/60/86/1263216086.db2.gz OAAVARXVRPOISH-CTWPCTMYSA-N 1 3 331.504 2.538 10 0 EFAEHO C[NH+](C)CCC(=O)NC1(C2CCN(Cc3cccc(F)c3)CC2)CC1 ZINC001486491173 1263235934 /nfs/dbraw/zinc/23/59/34/1263235934.db2.gz PDIOLPOCRKMDHS-UHFFFAOYSA-N 1 3 347.478 2.638 10 0 EFAEHO CCc1ccc(C[N@H+]2CC=C(CNC(=O)CN(C)C(C)C)CC2)cc1 ZINC001486521851 1263318213 /nfs/dbraw/zinc/31/82/13/1263318213.db2.gz OMUYSHUKJJCDDL-UHFFFAOYSA-N 1 3 343.515 2.838 10 0 EFAEHO CCc1ccc(C[N@@H+]2CC=C(CNC(=O)CN(C)C(C)C)CC2)cc1 ZINC001486521851 1263318223 /nfs/dbraw/zinc/31/82/23/1263318223.db2.gz OMUYSHUKJJCDDL-UHFFFAOYSA-N 1 3 343.515 2.838 10 0 EFAEHO C[C@H]([NH2+]C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)C1)c1cccc(F)c1 ZINC001410242974 1264475740 /nfs/dbraw/zinc/47/57/40/1264475740.db2.gz SQTUMWXYMURCDA-MPGHIAIKSA-N 1 3 347.478 2.855 10 0 EFAEHO CCCN(C)CC(=O)N(C)[C@H](C[NH2+][C@@H]1CCc2ccccc21)C1CC1 ZINC001410326724 1264811432 /nfs/dbraw/zinc/81/14/32/1264811432.db2.gz MPEQEOWKOYGFLI-WOJBJXKFSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC001410506564 1266985382 /nfs/dbraw/zinc/98/53/82/1266985382.db2.gz KYJKGIWDLJKDNH-KXBFYZLASA-N 1 3 349.494 2.980 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]Cc2cc(C)ccc2F)[C@H]1C ZINC001410861021 1269903991 /nfs/dbraw/zinc/90/39/91/1269903991.db2.gz OTMKEGXFUGIJQT-QAPCUYQASA-N 1 3 335.467 2.555 10 0 EFAEHO C[C@@H]1CCC[N@@H+]1CCNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000742241594 1269951618 /nfs/dbraw/zinc/95/16/18/1269951618.db2.gz PYMVBNSSPNFPMH-AEFFLSMTSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@@H]1CCC[N@H+]1CCNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000742241594 1269951628 /nfs/dbraw/zinc/95/16/28/1269951628.db2.gz PYMVBNSSPNFPMH-AEFFLSMTSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@@H]1C[C@@H](NCc2ccc(F)c(Cl)c2)CN1C(=O)CC[NH+](C)C ZINC001410874730 1269989245 /nfs/dbraw/zinc/98/92/45/1269989245.db2.gz UIYFOIAAOYCIBQ-TZMCWYRMSA-N 1 3 341.858 2.510 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001410981025 1270534234 /nfs/dbraw/zinc/53/42/34/1270534234.db2.gz KVWOSNVOWBOWJR-MRXNPFEDSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)N1C[C@@H]([NH2+]CCC(C)(C)C)C(C)(C)C1)N(C)C ZINC001410977597 1270543239 /nfs/dbraw/zinc/54/32/39/1270543239.db2.gz HPRJMCGVJUTUQX-HZPDHXFCSA-N 1 3 325.541 2.835 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)c1 ZINC001411022680 1270712268 /nfs/dbraw/zinc/71/22/68/1270712268.db2.gz REYPIYBMQXWTKO-GOSISDBHSA-N 1 3 331.504 2.662 10 0 EFAEHO CCc1cccc(C[NH2+]CCN(CC)C(=O)C2(N(C)C)CCC2)c1 ZINC001273420891 1270987661 /nfs/dbraw/zinc/98/76/61/1270987661.db2.gz QZXZRMASSDFGDL-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)N(CC[N@H+](C)CCCc1ccccc1)C(=O)[C@H]1CCCN1C ZINC001411199433 1271914334 /nfs/dbraw/zinc/91/43/34/1271914334.db2.gz NXIIIZAWVNQNLX-HXUWFJFHSA-N 1 3 345.531 2.882 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CCCc1ccccc1)C(=O)[C@H]1CCCN1C ZINC001411199433 1271914340 /nfs/dbraw/zinc/91/43/40/1271914340.db2.gz NXIIIZAWVNQNLX-HXUWFJFHSA-N 1 3 345.531 2.882 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](NC(=O)CC[NH+](C)C)C(C)(C)C)c1 ZINC001411222799 1272054869 /nfs/dbraw/zinc/05/48/69/1272054869.db2.gz LEOBIVBWVJSYEI-QGZVFWFLSA-N 1 3 337.483 2.706 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@H](C)C1)C1CC[NH+](Cc2ccsc2)CC1 ZINC001411231409 1272083681 /nfs/dbraw/zinc/08/36/81/1272083681.db2.gz FNWQBDBFJTZSRH-JKSUJKDBSA-N 1 3 349.544 2.807 10 0 EFAEHO CCC(CC)C[NH+]1CCC([C@H](C)NC(=O)[C@@H](CC)N(C)C)CC1 ZINC001411238799 1272105268 /nfs/dbraw/zinc/10/52/68/1272105268.db2.gz QXGFHGOAGAEBRJ-MAUKXSAKSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C1CC[NH+](CCCC(C)C)CC1 ZINC001411257379 1272163707 /nfs/dbraw/zinc/16/37/07/1272163707.db2.gz FPOBRXOVSBOSLN-HNNXBMFYSA-N 1 3 334.508 2.914 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@]2(CC[N@H+](CCCCCF)C2)C1)N(C)C ZINC001671074736 1278843982 /nfs/dbraw/zinc/84/39/82/1278843982.db2.gz CSRCQDDEVQEGIJ-PKOBYXMFSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@]2(CC[N@@H+](CCCCCF)C2)C1)N(C)C ZINC001671074736 1278843993 /nfs/dbraw/zinc/84/39/93/1278843993.db2.gz CSRCQDDEVQEGIJ-PKOBYXMFSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[NH+](CC)CCO[C@H]1CCN(C[C@H](O)c2ccc(F)cc2C)C1 ZINC000746674829 1275749555 /nfs/dbraw/zinc/74/95/55/1275749555.db2.gz KDCRSRBZPPGMKG-HKUYNNGSSA-N 1 3 338.467 2.600 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C1CCN(C(=O)OC(C)C)CC1 ZINC000817912264 1276374276 /nfs/dbraw/zinc/37/42/76/1276374276.db2.gz OKRFZLDZZAFWFW-CYBMUJFWSA-N 1 3 334.464 2.509 10 0 EFAEHO Cc1cc(C)cc([C@H](O)CNCC2([NH+]3CCCC3)CCOCC2)c1 ZINC000819020729 1276592197 /nfs/dbraw/zinc/59/21/97/1276592197.db2.gz KLVKRDKWWJHAJD-LJQANCHMSA-N 1 3 332.488 2.571 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CCCCCCCC1 ZINC000820087553 1277018946 /nfs/dbraw/zinc/01/89/46/1277018946.db2.gz XYMYPFPBMRCUOL-KRWDZBQOSA-N 1 3 326.529 2.624 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CCCCCCCC1 ZINC000820087553 1277018951 /nfs/dbraw/zinc/01/89/51/1277018951.db2.gz XYMYPFPBMRCUOL-KRWDZBQOSA-N 1 3 326.529 2.624 10 0 EFAEHO C[NH+](C)CCCC(C)(C)NC(=O)[C@@H]1CCN(Cc2ccc(F)cc2)C1 ZINC000585090783 1277194553 /nfs/dbraw/zinc/19/45/53/1277194553.db2.gz IMTZKWNHQNTIAO-QGZVFWFLSA-N 1 3 349.494 2.884 10 0 EFAEHO COC(CCN1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1)OC ZINC000585133712 1277480999 /nfs/dbraw/zinc/48/09/99/1277480999.db2.gz RTJIGZCHBOBTAW-PMACEKPBSA-N 1 3 332.488 2.839 10 0 EFAEHO CC(C)[C@](C)(C[NH3+])NC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000923296346 1277524950 /nfs/dbraw/zinc/52/49/50/1277524950.db2.gz QRZFGSBGWKFNGN-ABAIWWIYSA-N 1 3 335.275 2.696 10 0 EFAEHO COc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](C(N)=O)C2)cc1CN1CCCCC1 ZINC000846189980 1280064770 /nfs/dbraw/zinc/06/47/70/1280064770.db2.gz NYJPQECROPFBBA-QILLFSRXSA-N 1 3 345.487 2.596 10 0 EFAEHO Cc1cc([C@@H](N)CC(=O)NCCC[N@@H+](C)CC(C)C)cc(Cl)n1 ZINC000846685785 1280410636 /nfs/dbraw/zinc/41/06/36/1280410636.db2.gz GJVDLQXHGLRAJX-HNNXBMFYSA-N 1 3 340.899 2.527 10 0 EFAEHO Cc1cc([C@@H](N)CC(=O)NCCC[N@H+](C)CC(C)C)cc(Cl)n1 ZINC000846685785 1280410640 /nfs/dbraw/zinc/41/06/40/1280410640.db2.gz GJVDLQXHGLRAJX-HNNXBMFYSA-N 1 3 340.899 2.527 10 0 EFAEHO CCN1C[C@H](CN2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)OC1=O ZINC000846819347 1280550988 /nfs/dbraw/zinc/55/09/88/1280550988.db2.gz YVVOYWGGOYBCJS-WMZOPIPTSA-N 1 3 337.508 2.804 10 0 EFAEHO CCN1C[C@H](CN2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)OC1=O ZINC000846819347 1280550992 /nfs/dbraw/zinc/55/09/92/1280550992.db2.gz YVVOYWGGOYBCJS-WMZOPIPTSA-N 1 3 337.508 2.804 10 0 EFAEHO COc1ccccc1[C@H]1CSCCCN1C[C@H]1CCC2(C[NH2+]C2)O1 ZINC000872157052 1287451678 /nfs/dbraw/zinc/45/16/78/1287451678.db2.gz HKFDDWZRMDTZOH-NVXWUHKLSA-N 1 3 348.512 2.696 10 0 EFAEHO Cc1ccc(NC(=O)NC(=O)[C@H](C)N(C)CCCCCC[NH3+])c(C)c1 ZINC000872154871 1287449214 /nfs/dbraw/zinc/44/92/14/1287449214.db2.gz CVLQJYOUVBPFBW-INIZCTEOSA-N 1 3 348.491 2.791 10 0 EFAEHO C[NH+](C)C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CCCCC1 ZINC000809938144 1282623693 /nfs/dbraw/zinc/62/36/93/1282623693.db2.gz RVPYHWQCJADFNA-SFHVURJKSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810196048 1283028861 /nfs/dbraw/zinc/02/88/61/1283028861.db2.gz GYIVQCZCHPMKFW-YYAJDYIMSA-N 1 3 341.515 2.682 10 0 EFAEHO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810196048 1283028875 /nfs/dbraw/zinc/02/88/75/1283028875.db2.gz GYIVQCZCHPMKFW-YYAJDYIMSA-N 1 3 341.515 2.682 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC[N@@H+](C(C)(C)C)CC2)C1 ZINC000810261818 1283079749 /nfs/dbraw/zinc/07/97/49/1283079749.db2.gz FIHNWTULWMUYSX-GOSISDBHSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)C1 ZINC000810261818 1283079755 /nfs/dbraw/zinc/07/97/55/1283079755.db2.gz FIHNWTULWMUYSX-GOSISDBHSA-N 1 3 327.488 2.532 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@]2(F)CC[N@@H+](C(C)(C)C)C2)N(C)C)cc1 ZINC000810243691 1283096707 /nfs/dbraw/zinc/09/67/07/1283096707.db2.gz JQIXIELNBOHPCN-FXAWDEMLSA-N 1 3 349.494 2.926 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)N(C)C)cc1 ZINC000810243691 1283096713 /nfs/dbraw/zinc/09/67/13/1283096713.db2.gz JQIXIELNBOHPCN-FXAWDEMLSA-N 1 3 349.494 2.926 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC(C[NH+]3CCCC3)CC2)C1 ZINC000810433952 1283228591 /nfs/dbraw/zinc/22/85/91/1283228591.db2.gz JNILFHGFJRCAIQ-LJQANCHMSA-N 1 3 339.499 2.533 10 0 EFAEHO C[NH+](C)CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CCCC1 ZINC000810549215 1283375037 /nfs/dbraw/zinc/37/50/37/1283375037.db2.gz JGIBKTWFJXIPRZ-GOSISDBHSA-N 1 3 327.488 2.532 10 0 EFAEHO CCN(CCC[NH+](CC)CC)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000811398372 1284284661 /nfs/dbraw/zinc/28/46/61/1284284661.db2.gz BFCMVRSSHVQWKH-SFHVURJKSA-N 1 3 329.504 2.779 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C[C@H]1C ZINC000813462619 1285932218 /nfs/dbraw/zinc/93/22/18/1285932218.db2.gz ZHESMNFDMIGALS-RVKKMQEKSA-N 1 3 327.488 2.530 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C[C@H]1C ZINC000813462619 1285932220 /nfs/dbraw/zinc/93/22/20/1285932220.db2.gz ZHESMNFDMIGALS-RVKKMQEKSA-N 1 3 327.488 2.530 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C[C@@H]1C ZINC000813462618 1285932301 /nfs/dbraw/zinc/93/23/01/1285932301.db2.gz ZHESMNFDMIGALS-RLFYNMQTSA-N 1 3 327.488 2.530 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C[C@@H]1C ZINC000813462618 1285932303 /nfs/dbraw/zinc/93/23/03/1285932303.db2.gz ZHESMNFDMIGALS-RLFYNMQTSA-N 1 3 327.488 2.530 10 0 EFAEHO Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@@H]3C[NH2+]C[C@H]3C)C2)cc1 ZINC000903432996 1312670755 /nfs/dbraw/zinc/67/07/55/1312670755.db2.gz PWPUTPGBKWGFLC-SQNIBIBYSA-N 1 3 344.503 2.684 10 0 EFAEHO C[C@@H](C(=O)Nc1ccc(C(F)(F)F)cc1)N1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903496105 1312770314 /nfs/dbraw/zinc/77/03/14/1312770314.db2.gz GBKWCJACFQRGCQ-FRRDWIJNSA-N 1 3 343.393 2.949 10 0 EFAEHO CCN(c1ccc(NC(=O)CN2C[C@@H](C)[C@H](CC[NH3+])C2)cc1)C(C)C ZINC000903496871 1312772495 /nfs/dbraw/zinc/77/24/95/1312772495.db2.gz IJENPUSUVLUFKK-IAGOWNOFSA-N 1 3 346.519 2.777 10 0 EFAEHO CC(C)C[NH+]1CCC(N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C)CC1 ZINC000721903429 1312796793 /nfs/dbraw/zinc/79/67/93/1312796793.db2.gz NLESKGDWCNBNLQ-RDJZCZTQSA-N 1 3 339.524 2.952 10 0 EFAEHO C([C@@H]1CC2(CO1)CCOCC2)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000878286491 1291601436 /nfs/dbraw/zinc/60/14/36/1291601436.db2.gz PFFNQJLJMIBITD-NZSAHSFTSA-N 1 3 334.504 2.521 10 0 EFAEHO C([C@@H]1CC2(CO1)CCOCC2)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000878286491 1291601445 /nfs/dbraw/zinc/60/14/45/1291601445.db2.gz PFFNQJLJMIBITD-NZSAHSFTSA-N 1 3 334.504 2.521 10 0 EFAEHO C([C@@H]1CCC2(CCOCC2)CO1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000878287368 1291602805 /nfs/dbraw/zinc/60/28/05/1291602805.db2.gz ZSHMBLNGNVIFRP-HOJAQTOUSA-N 1 3 348.531 2.911 10 0 EFAEHO C([C@@H]1CCC2(CCOCC2)CO1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000878287368 1291602807 /nfs/dbraw/zinc/60/28/07/1291602807.db2.gz ZSHMBLNGNVIFRP-HOJAQTOUSA-N 1 3 348.531 2.911 10 0 EFAEHO CCN(CC[NH2+]CCc1ccccc1)C(=O)[C@@H]1CCCCN1C(C)C ZINC001273646860 1293036694 /nfs/dbraw/zinc/03/66/94/1293036694.db2.gz ZHTBOBGBCYKIPW-FQEVSTJZSA-N 1 3 345.531 2.930 10 0 EFAEHO Cc1ccc(CN2CC([C@@H](C)NC(=O)CCCC[NH+](C)C)C2)c(C)c1 ZINC001276453887 1313111618 /nfs/dbraw/zinc/11/16/18/1313111618.db2.gz QWMIJAUSHWNNQU-GOSISDBHSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(CN2CC([C@H](C)NC(=O)CCCC[NH+](C)C)C2)c(C)c1 ZINC001276453888 1313111633 /nfs/dbraw/zinc/11/16/33/1313111633.db2.gz QWMIJAUSHWNNQU-SFHVURJKSA-N 1 3 345.531 2.972 10 0 EFAEHO CO[C@H](C[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)[C@H]1CCOC1 ZINC000886634582 1295072526 /nfs/dbraw/zinc/07/25/26/1295072526.db2.gz HLOIMZHCOQQKBM-UQVNRYHBSA-N 1 3 344.499 2.681 10 0 EFAEHO c1cc([C@H]2CCCN2C[C@@H]2CC3(CO2)CC[NH2+]CC3)cc2c1OCO2 ZINC000903729689 1313130590 /nfs/dbraw/zinc/13/05/90/1313130590.db2.gz QNFCJLZXPDVBBE-DLBZAZTESA-N 1 3 344.455 2.711 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(OC)cc1)C(=O)[C@H]1CCCCN1CC ZINC001273772038 1295244529 /nfs/dbraw/zinc/24/45/29/1295244529.db2.gz QBMHCUUVMOBXPZ-LJQANCHMSA-N 1 3 347.503 2.508 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H]1C[NH2+]CCCCC(F)(F)F)N(C)C ZINC001277940003 1313302859 /nfs/dbraw/zinc/30/28/59/1313302859.db2.gz BNEUVOXWMIQUFZ-KBPBESRZSA-N 1 3 337.430 2.640 10 0 EFAEHO COc1cccc(N2CC[C@@H](C[NH2+][C@H]3[C@@H]4CCCN[C@@H]4C3(C)C)C2)c1 ZINC000925565483 1296856597 /nfs/dbraw/zinc/85/65/97/1296856597.db2.gz RZRCBXBNBLTZHP-LDTOTXGLSA-N 1 3 343.515 2.888 10 0 EFAEHO CC[C@H]([NH2+][C@@H]1C[C@H](N)C12CCC2)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000925627390 1296863068 /nfs/dbraw/zinc/86/30/68/1296863068.db2.gz XTMYHCXQSKHYKY-OKYOBFRVSA-N 1 3 339.487 2.814 10 0 EFAEHO Cn1cc(CC[NH2+][C@H]2CCNC[C@H]2C2CCCC2)c2cccnc21 ZINC000925725858 1296873475 /nfs/dbraw/zinc/87/34/75/1296873475.db2.gz CORFFZBYHNHDML-OALUTQOASA-N 1 3 326.488 2.874 10 0 EFAEHO CCOC(=O)C1([C@H](C)N[C@H]2c3ccccc3CC[C@H]2F)CC[NH2+]CC1 ZINC000925773025 1296878494 /nfs/dbraw/zinc/87/84/94/1296878494.db2.gz WFCPOSLHSCDIOZ-QGTPRVQTSA-N 1 3 348.462 2.923 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@H]1C[NH2+][C@@H]1CCOC12CCOCC2 ZINC000926776435 1296959184 /nfs/dbraw/zinc/95/91/84/1296959184.db2.gz AONYWCVWMMMGCV-MISYRCLQSA-N 1 3 344.499 2.682 10 0 EFAEHO COc1ccc([C@@H]2CCCN2C[C@H](C[NH3+])Cc2cnn(C)c2C)cc1 ZINC000903873022 1313326685 /nfs/dbraw/zinc/32/66/85/1313326685.db2.gz DMGYRXSEMVDKHH-JXFKEZNVSA-N 1 3 342.487 2.692 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NC/C=C/C[NH2+]CCCc1ccc(Cl)cc1 ZINC001273909509 1297114259 /nfs/dbraw/zinc/11/42/59/1297114259.db2.gz GVDNXSSOFFEVFW-ZMUQKWFASA-N 1 3 349.906 2.629 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CCC[C@H]2Cc2ccccc2C)cnn1C ZINC000903892659 1313363396 /nfs/dbraw/zinc/36/33/96/1313363396.db2.gz VSIIFRMJBMBTRX-NQIIRXRSSA-N 1 3 340.515 2.861 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CCC[C@H]2Cc2ccccc2C)cnn1C ZINC000903892659 1313363401 /nfs/dbraw/zinc/36/34/01/1313363401.db2.gz VSIIFRMJBMBTRX-NQIIRXRSSA-N 1 3 340.515 2.861 10 0 EFAEHO CC[C@H]1c2ccccc2CCN1C[C@@H](C[NH3+])Cc1cnn(C)c1C ZINC000903893241 1313364183 /nfs/dbraw/zinc/36/41/83/1313364183.db2.gz SUNMDKOCYKWKFQ-UZLBHIALSA-N 1 3 326.488 2.855 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2C[C@@H](c3ccccc3)C[C@H]2C)cnn1C ZINC000903895652 1313369815 /nfs/dbraw/zinc/36/98/15/1313369815.db2.gz POAZDESIXXIWAI-MDYRTPRTSA-N 1 3 326.488 2.724 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2C[C@@H](c3ccccc3)C[C@H]2C)cnn1C ZINC000903895652 1313369819 /nfs/dbraw/zinc/36/98/19/1313369819.db2.gz POAZDESIXXIWAI-MDYRTPRTSA-N 1 3 326.488 2.724 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CC[C@@H](c3ccccc3)[C@H]2C)cnn1C ZINC000903897256 1313372930 /nfs/dbraw/zinc/37/29/30/1313372930.db2.gz GLNQCSDKGDGIQS-MBOZVWFJSA-N 1 3 326.488 2.724 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CC[C@@H](c3ccccc3)[C@H]2C)cnn1C ZINC000903897256 1313372932 /nfs/dbraw/zinc/37/29/32/1313372932.db2.gz GLNQCSDKGDGIQS-MBOZVWFJSA-N 1 3 326.488 2.724 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CC[C@H](c3ccccc3)[C@@H]2C)cnn1C ZINC000903897259 1313373276 /nfs/dbraw/zinc/37/32/76/1313373276.db2.gz GLNQCSDKGDGIQS-QKLQHJQFSA-N 1 3 326.488 2.724 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CC[C@H](c3ccccc3)[C@@H]2C)cnn1C ZINC000903897259 1313373279 /nfs/dbraw/zinc/37/32/79/1313373279.db2.gz GLNQCSDKGDGIQS-QKLQHJQFSA-N 1 3 326.488 2.724 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CNC(C)(C)c2ccc(F)c(F)c2)cnn1C ZINC000903903626 1313383728 /nfs/dbraw/zinc/38/37/28/1313383728.db2.gz WIPXRWLKJCVZOP-CYBMUJFWSA-N 1 3 336.430 2.649 10 0 EFAEHO C[C@H](c1ccccc1)N(C)C(=O)CN(C)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903915833 1313408255 /nfs/dbraw/zinc/40/82/55/1313408255.db2.gz CEWBTNZCYXEUPR-VBZNHOPUSA-N 1 3 329.488 2.668 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN[C@H]2CCc3c2cccc3Cl)cnn1C ZINC000903926477 1313428226 /nfs/dbraw/zinc/42/82/26/1313428226.db2.gz SQIOYQWQYULWRQ-ACJLOTCBSA-N 1 3 332.879 2.776 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@@H]1CC[C@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001488955719 1297904715 /nfs/dbraw/zinc/90/47/15/1297904715.db2.gz TZCOGGTUESLIOU-ARFHVFGLSA-N 1 3 329.504 2.587 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2CCC[N@H+](CC3CCC3)[C@@H]2C1(C)C ZINC001489088033 1298047794 /nfs/dbraw/zinc/04/77/94/1298047794.db2.gz UEYXDJFZYSMUAC-QRQLOZEOSA-N 1 3 335.536 2.732 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2CCC[N@@H+](CC3CCC3)[C@@H]2C1(C)C ZINC001489088033 1298047807 /nfs/dbraw/zinc/04/78/07/1298047807.db2.gz UEYXDJFZYSMUAC-QRQLOZEOSA-N 1 3 335.536 2.732 10 0 EFAEHO COc1ccc(C[NH2+]C[C@H]2CNCCC2(F)F)cc1Br ZINC000903953491 1313476956 /nfs/dbraw/zinc/47/69/56/1313476956.db2.gz GRJMVPXOTWODTL-LLVKDONJSA-N 1 3 349.219 2.792 10 0 EFAEHO C[C@H](CCc1n[nH]c2ccccc21)N[C@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903971715 1313518839 /nfs/dbraw/zinc/51/88/39/1313518839.db2.gz CFKUEGCFWSPAMH-HZPDHXFCSA-N 1 3 342.487 2.632 10 0 EFAEHO C[C@@H](c1ccccc1F)N(C)CCCNC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001490196797 1298626521 /nfs/dbraw/zinc/62/65/21/1298626521.db2.gz RGMGHBCVXQPMEE-YJBOKZPZSA-N 1 3 347.478 2.667 10 0 EFAEHO Cc1ccc(CN(C)CCCNC(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)c(C)n1 ZINC001490280962 1298706350 /nfs/dbraw/zinc/70/63/50/1298706350.db2.gz CKLMXQVBKSCMGC-CALCHBBNSA-N 1 3 346.519 2.509 10 0 EFAEHO Cc1ccc(CN(C)CCCNC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)c(C)n1 ZINC001490280962 1298706352 /nfs/dbraw/zinc/70/63/52/1298706352.db2.gz CKLMXQVBKSCMGC-CALCHBBNSA-N 1 3 346.519 2.509 10 0 EFAEHO Cc1cncc(C[NH2+][C@@H](C)[C@H]2CCCCN2C(=O)CN(C)C(C)C)c1 ZINC001490309661 1298754076 /nfs/dbraw/zinc/75/40/76/1298754076.db2.gz MHKHGLNLHXQUCG-PKOBYXMFSA-N 1 3 346.519 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H](C)[NH2+]CCC(F)(F)F ZINC001490313373 1298760823 /nfs/dbraw/zinc/76/08/23/1298760823.db2.gz YRRLBIAAUXZNKM-ZIAGYGMSSA-N 1 3 337.430 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H](C)[NH2+]CCC(F)(F)F ZINC001490313372 1298761686 /nfs/dbraw/zinc/76/16/86/1298761686.db2.gz YRRLBIAAUXZNKM-UONOGXRCSA-N 1 3 337.430 2.638 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N[C@@H]1CCN(CCc2cccs2)C1 ZINC001490581206 1299001920 /nfs/dbraw/zinc/00/19/20/1299001920.db2.gz WQVURWHFZJWHNH-QGZVFWFLSA-N 1 3 349.544 2.747 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1ccc(F)cc1)C1CC1 ZINC001490660286 1299100932 /nfs/dbraw/zinc/10/09/32/1299100932.db2.gz FXTWZGRTHPXJKO-RTBURBONSA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CCc1cccs1)C1CC1 ZINC001490662045 1299103167 /nfs/dbraw/zinc/10/31/67/1299103167.db2.gz QHEZQIKCZVNLKG-MSOLQXFVSA-N 1 3 349.544 2.648 10 0 EFAEHO CCCCC[NH2+][C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001490710070 1299119665 /nfs/dbraw/zinc/11/96/65/1299119665.db2.gz OCMFREBYYUQAMZ-VQIMIIECSA-N 1 3 341.515 2.874 10 0 EFAEHO CCCCC[NH2+][C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001490710068 1299119992 /nfs/dbraw/zinc/11/99/92/1299119992.db2.gz OCMFREBYYUQAMZ-LPHOPBHVSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]([NH2+]CC1CCC(C)CC1)C1CC1 ZINC001490736254 1299171140 /nfs/dbraw/zinc/17/11/40/1299171140.db2.gz DBVVXGDFXNTEGA-RWKZGTHUSA-N 1 3 332.492 2.571 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001490773079 1299225601 /nfs/dbraw/zinc/22/56/01/1299225601.db2.gz BKANVMCHKBJIGQ-QZTJIDSGSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001490773079 1299225609 /nfs/dbraw/zinc/22/56/09/1299225609.db2.gz BKANVMCHKBJIGQ-QZTJIDSGSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@H](C[N@H+](C)CCCF)C1 ZINC001490776788 1299242620 /nfs/dbraw/zinc/24/26/20/1299242620.db2.gz RVARGUUPMPUTEN-MSOLQXFVSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@H](C[N@@H+](C)CCCF)C1 ZINC001490776788 1299242631 /nfs/dbraw/zinc/24/26/31/1299242631.db2.gz RVARGUUPMPUTEN-MSOLQXFVSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](C)C[NH2+]CC[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001326363969 1329750379 /nfs/dbraw/zinc/75/03/79/1329750379.db2.gz IXDBXKSRKDYEAT-IAGOWNOFSA-N 1 3 325.541 2.839 10 0 EFAEHO COc1ccc2c(c1)nccc2N1CCC([N@@H+]2CCCOCC2)CC1 ZINC000853688252 1300230728 /nfs/dbraw/zinc/23/07/28/1300230728.db2.gz KJRBBEXRTAOKGJ-UHFFFAOYSA-N 1 3 341.455 2.935 10 0 EFAEHO COc1ccc2c(c1)nccc2N1CCC([N@H+]2CCCOCC2)CC1 ZINC000853688252 1300230736 /nfs/dbraw/zinc/23/07/36/1300230736.db2.gz KJRBBEXRTAOKGJ-UHFFFAOYSA-N 1 3 341.455 2.935 10 0 EFAEHO CCN(C(=O)NC1CCC([NH+]2CCCCC2)CC1)[C@H]1CCN(C)C1 ZINC000853832509 1300300806 /nfs/dbraw/zinc/30/08/06/1300300806.db2.gz AQCIGPUNOVBEEX-ABHNRTSZSA-N 1 3 336.524 2.519 10 0 EFAEHO C[S@@](=O)CC[N@@H+]1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000854044310 1300404135 /nfs/dbraw/zinc/40/41/35/1300404135.db2.gz FUYLAOORDKQCJZ-YADARESESA-N 1 3 348.556 2.988 10 0 EFAEHO C[S@@](=O)CC[N@H+]1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000854044310 1300404142 /nfs/dbraw/zinc/40/41/42/1300404142.db2.gz FUYLAOORDKQCJZ-YADARESESA-N 1 3 348.556 2.988 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)/C=C\c1ccc(Cl)s1 ZINC000855345666 1300924464 /nfs/dbraw/zinc/92/44/64/1300924464.db2.gz FLWHCBHHWMNDKU-JWJUJFCLSA-N 1 3 343.924 2.803 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)/C=C\c1ccc(Cl)s1 ZINC000855345666 1300924471 /nfs/dbraw/zinc/92/44/71/1300924471.db2.gz FLWHCBHHWMNDKU-JWJUJFCLSA-N 1 3 343.924 2.803 10 0 EFAEHO Cc1cccc(Cl)c1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000855346675 1300925462 /nfs/dbraw/zinc/92/54/62/1300925462.db2.gz IVKAWIXDOGLWMD-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO Cc1cccc(Cl)c1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000855346675 1300925471 /nfs/dbraw/zinc/92/54/71/1300925471.db2.gz IVKAWIXDOGLWMD-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO CN(C)C1CC[NH+](CC2CCN(C(=O)OC(C)(C)C)CC2)CC1 ZINC000113500067 1301035758 /nfs/dbraw/zinc/03/57/58/1301035758.db2.gz CISLVWREWTUFHF-UHFFFAOYSA-N 1 3 325.497 2.660 10 0 EFAEHO CCN(Cc1ccc(C[NH+](C)C)cc1)C[C@H]1CN(C2CC2)C(=O)O1 ZINC000859997133 1301668617 /nfs/dbraw/zinc/66/86/17/1301668617.db2.gz IUJGSJSCDJAVPA-SFHVURJKSA-N 1 3 331.460 2.553 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@@H]2C[N@H+](C)CCCCCF)CCC1 ZINC001281940316 1313822727 /nfs/dbraw/zinc/82/27/27/1313822727.db2.gz RVQSESUXJIPNPP-MRXNPFEDSA-N 1 3 327.488 2.533 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@@H]2C[N@@H+](C)CCCCCF)CCC1 ZINC001281940316 1313822731 /nfs/dbraw/zinc/82/27/31/1313822731.db2.gz RVQSESUXJIPNPP-MRXNPFEDSA-N 1 3 327.488 2.533 10 0 EFAEHO CN1CCCC[C@@H](C[NH2+]C[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)C1 ZINC000862483838 1302397254 /nfs/dbraw/zinc/39/72/54/1302397254.db2.gz ZHUPGYAVCSBSBJ-LPHOPBHVSA-N 1 3 339.524 2.955 10 0 EFAEHO C[C@H]1CC[C@@H](NCC2CCN(C(=O)OCc3ccccc3)CC2)C[NH2+]1 ZINC000863649266 1302670099 /nfs/dbraw/zinc/67/00/99/1302670099.db2.gz BFIVRNFFPRPWEO-QFBILLFUSA-N 1 3 345.487 2.765 10 0 EFAEHO CCC[NH2+]C[C@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CCCC1 ZINC001278276898 1313864691 /nfs/dbraw/zinc/86/46/91/1313864691.db2.gz ZCYPFQGHDVXVEN-LPHOPBHVSA-N 1 3 341.515 2.874 10 0 EFAEHO CCN1CCC[C@H](C[NH2+]C[C@H]2CCCN2C(=O)OC(C)(C)C)C1 ZINC000865437459 1303256613 /nfs/dbraw/zinc/25/66/13/1303256613.db2.gz NCSJKEICSBGGSX-HZPDHXFCSA-N 1 3 325.497 2.707 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+]Cc2cnc(Cl)c(F)c2)C[C@H](C)O1 ZINC000865472313 1303273058 /nfs/dbraw/zinc/27/30/58/1303273058.db2.gz XZWCMJAOIWXEON-BETUJISGSA-N 1 3 329.847 2.853 10 0 EFAEHO C[NH+]1CCC(N2CC[C@@H](Nc3nc(Cl)nc4ccccc43)C2)CC1 ZINC000865535457 1303299149 /nfs/dbraw/zinc/29/91/49/1303299149.db2.gz MBRVGSHOATWOCA-CYBMUJFWSA-N 1 3 345.878 2.864 10 0 EFAEHO Cn1ncc(CNCC2(c3ccccc3)CC[NH+](C)CC2)c1Cl ZINC000865775041 1303394839 /nfs/dbraw/zinc/39/48/39/1303394839.db2.gz PJYQZKXZYLWSTP-UHFFFAOYSA-N 1 3 332.879 2.827 10 0 EFAEHO CC(=O)NCC1CCC([NH2+][C@H](C)[C@H]2CCCN(C3CCC3)C2)CC1 ZINC000866335555 1303606407 /nfs/dbraw/zinc/60/64/07/1303606407.db2.gz BKHNQKCWQHNORE-IZIZEDOESA-N 1 3 335.536 2.924 10 0 EFAEHO CC(=O)NCC1CCC([NH2+][C@H](C)[C@@H]2CCCN(C3CCC3)C2)CC1 ZINC000866335557 1303606797 /nfs/dbraw/zinc/60/67/97/1303606797.db2.gz BKHNQKCWQHNORE-ZTRSQXPZSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[N@@H+]1CC[C@H](NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)[C@H](C)C1 ZINC000866557650 1303683952 /nfs/dbraw/zinc/68/39/52/1303683952.db2.gz CCLZSHPVNACKGW-GIVPXCGWSA-N 1 3 345.531 2.516 10 0 EFAEHO CC[N@H+]1CC[C@H](NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)[C@H](C)C1 ZINC000866557650 1303683961 /nfs/dbraw/zinc/68/39/61/1303683961.db2.gz CCLZSHPVNACKGW-GIVPXCGWSA-N 1 3 345.531 2.516 10 0 EFAEHO Cc1ccc(CN2CCO[C@H](C[NH2+]C3CCN(C(C)C)CC3)C2)cc1 ZINC000866558598 1303686234 /nfs/dbraw/zinc/68/62/34/1303686234.db2.gz PQTISSHHVNDFAQ-OAQYLSRUSA-N 1 3 345.531 2.658 10 0 EFAEHO CCCN1CCC([NH2+]C[C@H]2CN(Cc3ccc(C)cc3)CCO2)CC1 ZINC000866558624 1303686251 /nfs/dbraw/zinc/68/62/51/1303686251.db2.gz QDPDWLKGLPOGNX-NRFANRHFSA-N 1 3 345.531 2.660 10 0 EFAEHO COc1ccc(NC(=O)CC[N@@H+]2CC[C@](CN)(C(C)(C)C)C2)cc1 ZINC000866705688 1303760353 /nfs/dbraw/zinc/76/03/53/1303760353.db2.gz HEKYQMMXXRGSEC-LJQANCHMSA-N 1 3 333.476 2.721 10 0 EFAEHO COc1ccc(NC(=O)CC[N@H+]2CC[C@](CN)(C(C)(C)C)C2)cc1 ZINC000866705688 1303760359 /nfs/dbraw/zinc/76/03/59/1303760359.db2.gz HEKYQMMXXRGSEC-LJQANCHMSA-N 1 3 333.476 2.721 10 0 EFAEHO COC(=O)c1ccccc1OCCN1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866707078 1303760576 /nfs/dbraw/zinc/76/05/76/1303760576.db2.gz LRNLEJPGGPVIIE-IBGZPJMESA-N 1 3 334.460 2.549 10 0 EFAEHO O=C(NC[C@H]1CCCCN1Cc1ccccc1)[C@H]1C[C@]12CCC[NH2+]C2 ZINC000867997113 1304066622 /nfs/dbraw/zinc/06/66/22/1304066622.db2.gz BKTCDBTZSAVZSQ-SBHAEUEKSA-N 1 3 341.499 2.547 10 0 EFAEHO C[NH+](C)C1(C)CCC(NC(=O)NC[C@@H]2CCCCN2C2CC2)CC1 ZINC000868545142 1304348324 /nfs/dbraw/zinc/34/83/24/1304348324.db2.gz MZVZPBJPLIYVEG-RMXPPQQLSA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)[NH+]1CCC(CCNC(=O)NC[C@H]2CCN2C(C)(C)C)CC1 ZINC000868757843 1304458271 /nfs/dbraw/zinc/45/82/71/1304458271.db2.gz FQVCAXYHNPSAFW-QGZVFWFLSA-N 1 3 338.540 2.669 10 0 EFAEHO C[N@@H+]1CCN(C(=O)c2cccc(CN3CCCC3)c2)CCC1(C)C ZINC000871152733 1305844276 /nfs/dbraw/zinc/84/42/76/1305844276.db2.gz PRXFCTXPOYOBNN-UHFFFAOYSA-N 1 3 329.488 2.839 10 0 EFAEHO C[N@H+]1CCN(C(=O)c2cccc(CN3CCCC3)c2)CCC1(C)C ZINC000871152733 1305844289 /nfs/dbraw/zinc/84/42/89/1305844289.db2.gz PRXFCTXPOYOBNN-UHFFFAOYSA-N 1 3 329.488 2.839 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)c1 ZINC001278326001 1314100875 /nfs/dbraw/zinc/10/08/75/1314100875.db2.gz MEXHQKIZSPJYPO-UYAOXDASSA-N 1 3 345.531 2.847 10 0 EFAEHO CCCCCC[N@@H+]1C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001276624655 1314117809 /nfs/dbraw/zinc/11/78/09/1314117809.db2.gz LPZZKDFYNNPNBS-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCCCC[N@H+]1C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001276624655 1314117810 /nfs/dbraw/zinc/11/78/10/1314117810.db2.gz LPZZKDFYNNPNBS-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H](C(=O)N(CCN(C)C)Cc2ccsc2)C1 ZINC001413088046 1307707885 /nfs/dbraw/zinc/70/78/85/1307707885.db2.gz YMCWWCZFBVFCPO-QGZVFWFLSA-N 1 3 337.533 2.759 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H](C(=O)N(CCN(C)C)Cc2ccsc2)C1 ZINC001413088046 1307707887 /nfs/dbraw/zinc/70/78/87/1307707887.db2.gz YMCWWCZFBVFCPO-QGZVFWFLSA-N 1 3 337.533 2.759 10 0 EFAEHO O=C(N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(NC2=NCCC2)cc1 ZINC000900239678 1307809101 /nfs/dbraw/zinc/80/91/01/1307809101.db2.gz DVMOINCTWHDXQE-SJORKVTESA-N 1 3 326.444 2.647 10 0 EFAEHO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(NC2=NCCC2)cc1 ZINC000900239678 1307809103 /nfs/dbraw/zinc/80/91/03/1307809103.db2.gz DVMOINCTWHDXQE-SJORKVTESA-N 1 3 326.444 2.647 10 0 EFAEHO CCCCCC[NH2+][C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001265823898 1316884721 /nfs/dbraw/zinc/88/47/21/1316884721.db2.gz OEQIGAJTOGITGK-QAPCUYQASA-N 1 3 329.504 2.874 10 0 EFAEHO O=C(c1ccc(NC2=NCCC2)cc1)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000900792049 1308687561 /nfs/dbraw/zinc/68/75/61/1308687561.db2.gz CGCUQNNCRYCZAZ-MRXNPFEDSA-N 1 3 340.471 2.849 10 0 EFAEHO CC[N@H+](C)C[C@H]1CCN(C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900890057 1308836333 /nfs/dbraw/zinc/83/63/33/1308836333.db2.gz LYFRVYSUNMGVKM-OAHLLOKOSA-N 1 3 328.460 2.705 10 0 EFAEHO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900890057 1308836339 /nfs/dbraw/zinc/83/63/39/1308836339.db2.gz LYFRVYSUNMGVKM-OAHLLOKOSA-N 1 3 328.460 2.705 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900958932 1309040275 /nfs/dbraw/zinc/04/02/75/1309040275.db2.gz NBJPOVIWYMEGNY-IAGOWNOFSA-N 1 3 328.460 2.893 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C[N@@H+]1C1CC1 ZINC000900994089 1309131578 /nfs/dbraw/zinc/13/15/78/1309131578.db2.gz FVUGFXZJXFGZNT-XJKSGUPXSA-N 1 3 326.444 2.646 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C[N@H+]1C1CC1 ZINC000900994089 1309131582 /nfs/dbraw/zinc/13/15/82/1309131582.db2.gz FVUGFXZJXFGZNT-XJKSGUPXSA-N 1 3 326.444 2.646 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCCC[C@@H]1C[NH2+]CCC(F)(F)F ZINC001491270917 1311183490 /nfs/dbraw/zinc/18/34/90/1311183490.db2.gz KKXXIPWYLOOSRK-CABCVRRESA-N 1 3 349.441 2.784 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1C[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001277092332 1311601712 /nfs/dbraw/zinc/60/17/12/1311601712.db2.gz BOKUYYIBBSWXOT-UAPYVXQJSA-N 1 3 331.504 2.892 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@H](C2CCN(C(=O)[C@@H]3CCCN3C)CC2)C1 ZINC001277276425 1311912428 /nfs/dbraw/zinc/91/24/28/1311912428.db2.gz ZVBQFDCNCNKMDU-PSCPARJHSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@H](C2CCN(C(=O)[C@@H]3CCCN3C)CC2)C1 ZINC001277276425 1311912430 /nfs/dbraw/zinc/91/24/30/1311912430.db2.gz ZVBQFDCNCNKMDU-PSCPARJHSA-N 1 3 347.547 2.997 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)c1c[nH]cn1 ZINC001277360533 1312054726 /nfs/dbraw/zinc/05/47/26/1312054726.db2.gz ZRELWNSKLSKJOB-CVEARBPZSA-N 1 3 332.492 2.943 10 0 EFAEHO CCCCC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)c1c[nH]cn1 ZINC001277360533 1312054730 /nfs/dbraw/zinc/05/47/30/1312054730.db2.gz ZRELWNSKLSKJOB-CVEARBPZSA-N 1 3 332.492 2.943 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@@H]2C[C@@H](C)Cc3cc(OC)ccc32)CC1 ZINC000902745213 1312071312 /nfs/dbraw/zinc/07/13/12/1312071312.db2.gz LWLHOZJKEUPNSC-LAUBAEHRSA-N 1 3 345.531 2.936 10 0 EFAEHO O[C@@H](C[NH2+][C@H](CCc1cccnc1)c1ccccc1)CN1CCCC1 ZINC000902763776 1312085809 /nfs/dbraw/zinc/08/58/09/1312085809.db2.gz YWXJMGVNMJAAMK-LEWJYISDSA-N 1 3 339.483 2.802 10 0 EFAEHO CC[C@@H](F)CN1CC[C@H](CNC(=O)C2(C[NH+](C)C)CCCCC2)C1 ZINC001493223677 1312085869 /nfs/dbraw/zinc/08/58/69/1312085869.db2.gz OGQRVPCFFBKVFV-IAGOWNOFSA-N 1 3 341.515 2.685 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(CCN(C(=O)[C@@H](CC)N(C)C)C2)CC1 ZINC001277495915 1312453453 /nfs/dbraw/zinc/45/34/53/1312453453.db2.gz KWSHXYNNFGISBL-JTHGQSKGSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(CCN(C(=O)[C@H](CC)N(C)C)C2)CC1 ZINC001277495922 1312453483 /nfs/dbraw/zinc/45/34/83/1312453483.db2.gz KWSHXYNNFGISBL-ZEVQVBBLSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CCCC2CCC2)CN1C(=O)CN1CCC(C)CC1 ZINC001278411931 1314512044 /nfs/dbraw/zinc/51/20/44/1314512044.db2.gz VRQYLIKWGQFXHN-PKOBYXMFSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(C)C1(C(=O)NCC2(C)CC[NH+](CCCCCF)CC2)CCC1 ZINC001278610685 1315287608 /nfs/dbraw/zinc/28/76/08/1315287608.db2.gz GNFGBKNWIOYQRC-UHFFFAOYSA-N 1 3 341.515 2.829 10 0 EFAEHO CC[N@H+](CCCNC(=O)N(C)[C@@H]1CCCN(C)C1)C1CCCCC1 ZINC001252696612 1315488878 /nfs/dbraw/zinc/48/88/78/1315488878.db2.gz QCDCIWAAYBQHOP-GOSISDBHSA-N 1 3 338.540 2.767 10 0 EFAEHO CC[N@@H+](CCCNC(=O)N(C)[C@@H]1CCCN(C)C1)C1CCCCC1 ZINC001252696612 1315488881 /nfs/dbraw/zinc/48/88/81/1315488881.db2.gz QCDCIWAAYBQHOP-GOSISDBHSA-N 1 3 338.540 2.767 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@H]1CN(C(=O)CN(C)C(C)C)C[C@H]1C(F)(F)F ZINC001278703350 1315580737 /nfs/dbraw/zinc/58/07/37/1315580737.db2.gz GZAGDKGQRVHJRP-HUUCEWRRSA-N 1 3 349.441 2.519 10 0 EFAEHO CC(C)CCC[NH2+][C@H](C)[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001279032214 1316081383 /nfs/dbraw/zinc/08/13/83/1316081383.db2.gz UYNMHGPJMZFPBB-MOPGFXCFSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)CCC[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN1CC[C@@H](C)C1 ZINC001264000312 1316579085 /nfs/dbraw/zinc/57/90/85/1316579085.db2.gz MCHBKPKOSFVGSM-QRVBRYPASA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)=CCN(C)C[C@@H]1CCCCN1C(=O)CC1CC[NH+](C)CC1 ZINC001264185559 1316597467 /nfs/dbraw/zinc/59/74/67/1316597467.db2.gz CPXDHXOHHTZAAR-IBGZPJMESA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@@H+]2CCC2=CCCCC2)C1 ZINC001264373638 1316608313 /nfs/dbraw/zinc/60/83/13/1316608313.db2.gz XTQRXPBHWKVNJE-PKOBYXMFSA-N 1 3 333.520 2.751 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@H+]2CCC2=CCCCC2)C1 ZINC001264373638 1316608315 /nfs/dbraw/zinc/60/83/15/1316608315.db2.gz XTQRXPBHWKVNJE-PKOBYXMFSA-N 1 3 333.520 2.751 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1C[C@@H]([NH2+]CCC2=CCCCC2)C1)N(C)C ZINC001264393765 1316611822 /nfs/dbraw/zinc/61/18/22/1316611822.db2.gz KUUXXEBLJGGFHP-OTWHNJEPSA-N 1 3 335.536 2.948 10 0 EFAEHO COc1ccc(CN(C)CC2CC[NH2+]CC2)c(Br)c1 ZINC000388028882 1316614348 /nfs/dbraw/zinc/61/43/48/1316614348.db2.gz WEPDVFSDXPMFRV-UHFFFAOYSA-N 1 3 327.266 2.889 10 0 EFAEHO CC(C)CC[NH2+]CC[C@@H]1[C@@H](C)CCCN1C(=O)CN(C)C(C)C ZINC001264520859 1316628017 /nfs/dbraw/zinc/62/80/17/1316628017.db2.gz QPERRADJPICJCU-ZWKOTPCHSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[NH2+]CC[C@@H]1[C@@H](C)CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001264521304 1316628417 /nfs/dbraw/zinc/62/84/17/1316628417.db2.gz XVEZXNLTXDPBJK-QFBILLFUSA-N 1 3 331.504 2.989 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CCC3=CCCCC3)CC[C@@H]2C1 ZINC001264658796 1316648945 /nfs/dbraw/zinc/64/89/45/1316648945.db2.gz ZTUIUMVYORNZBN-UXHICEINSA-N 1 3 347.547 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CCC3=CCCCC3)CC[C@@H]2C1 ZINC001264658796 1316648948 /nfs/dbraw/zinc/64/89/48/1316648948.db2.gz ZTUIUMVYORNZBN-UXHICEINSA-N 1 3 347.547 2.997 10 0 EFAEHO CN(CC(=O)N1CCCCC[C@@H]([NH2+]CCCF)C1)CC(C)(C)C ZINC001264681639 1316654657 /nfs/dbraw/zinc/65/46/57/1316654657.db2.gz GHBFQRHVRSBACK-MRXNPFEDSA-N 1 3 329.504 2.685 10 0 EFAEHO CN(CC(=O)N1CCCCC[C@H]([NH2+]CCCF)C1)CC(C)(C)C ZINC001264681638 1316654720 /nfs/dbraw/zinc/65/47/20/1316654720.db2.gz GHBFQRHVRSBACK-INIZCTEOSA-N 1 3 329.504 2.685 10 0 EFAEHO CCc1ccccc1C[N@H+](C)CCCNC(=O)CN1CC[C@H](C)C1 ZINC001265036988 1316696905 /nfs/dbraw/zinc/69/69/05/1316696905.db2.gz OJPAPAMVWBILHL-KRWDZBQOSA-N 1 3 331.504 2.529 10 0 EFAEHO CCc1ccccc1C[N@@H+](C)CCCNC(=O)CN1CC[C@H](C)C1 ZINC001265036988 1316696907 /nfs/dbraw/zinc/69/69/07/1316696907.db2.gz OJPAPAMVWBILHL-KRWDZBQOSA-N 1 3 331.504 2.529 10 0 EFAEHO C[C@@H](c1ccccc1F)N(C)CCCNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001265057936 1316705003 /nfs/dbraw/zinc/70/50/03/1316705003.db2.gz BASRXYCIAKIGEW-HOTGVXAUSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@@H](c1ccccc1F)N(C)CCCNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001265057936 1316705004 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EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](C)[C@@H](C)c1cccc(C)c1 ZINC001265061734 1316706747 /nfs/dbraw/zinc/70/67/47/1316706747.db2.gz AZCCPFDRWSORJG-INIZCTEOSA-N 1 3 328.460 2.768 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@H+](C)[C@@H]1CCc2ccc(F)cc21)N(C)C ZINC001265061181 1316706870 /nfs/dbraw/zinc/70/68/70/1316706870.db2.gz HEWOQKWICPYVLW-MOPGFXCFSA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@@H+](C)[C@@H]1CCc2ccc(F)cc21)N(C)C ZINC001265061181 1316706873 /nfs/dbraw/zinc/70/68/73/1316706873.db2.gz HEWOQKWICPYVLW-MOPGFXCFSA-N 1 3 349.494 2.837 10 0 EFAEHO C[C@H](NCc1ccccn1)[C@H]1CCCCN1C(=O)CCCC[NH+](C)C ZINC001265092924 1316718948 /nfs/dbraw/zinc/71/89/48/1316718948.db2.gz WPTJYXBRSIBREV-PKOBYXMFSA-N 1 3 346.519 2.673 10 0 EFAEHO CCN(CCCNC(=O)[C@H]1CCC[N@@H+]1C(C)C)Cc1ncccc1C ZINC001265113664 1316724620 /nfs/dbraw/zinc/72/46/20/1316724620.db2.gz VRKJAORPUGCLES-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO CCN(CCCNC(=O)[C@H]1CCC[N@H+]1C(C)C)Cc1ncccc1C ZINC001265113664 1316724622 /nfs/dbraw/zinc/72/46/22/1316724622.db2.gz VRKJAORPUGCLES-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)C[C@@H]1CCC(F)(F)C1 ZINC001265133996 1316731834 /nfs/dbraw/zinc/73/18/34/1316731834.db2.gz FPSKANOPTGCQGR-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)C[C@@H]1CCC(F)(F)C1 ZINC001265133996 1316731837 /nfs/dbraw/zinc/73/18/37/1316731837.db2.gz FPSKANOPTGCQGR-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@@H](C)C1)C[C@H]1CCC(F)(F)C1 ZINC001265133993 1316732023 /nfs/dbraw/zinc/73/20/23/1316732023.db2.gz FPSKANOPTGCQGR-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@@H](C)C1)C[C@H]1CCC(F)(F)C1 ZINC001265133993 1316732025 /nfs/dbraw/zinc/73/20/25/1316732025.db2.gz FPSKANOPTGCQGR-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](CC)[C@@H]1CCc2ccc(F)cc21)N(C)C ZINC001265143086 1316736289 /nfs/dbraw/zinc/73/62/89/1316736289.db2.gz WUDSUNDWOYJWLQ-RBUKOAKNSA-N 1 3 349.494 2.981 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](CC)[C@@H]1CCc2ccc(F)cc21)N(C)C ZINC001265143086 1316736290 /nfs/dbraw/zinc/73/62/90/1316736290.db2.gz WUDSUNDWOYJWLQ-RBUKOAKNSA-N 1 3 349.494 2.981 10 0 EFAEHO CCN(CCCNC(=O)[C@H]1CC[N@H+](C)C1)[C@H](C)c1ccccc1F ZINC001265146423 1316738369 /nfs/dbraw/zinc/73/83/69/1316738369.db2.gz XUUGRMQMFWQYBR-CVEARBPZSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCCNC(=O)[C@H]1CC[N@@H+](C)C1)[C@H](C)c1ccccc1F ZINC001265146423 1316738371 /nfs/dbraw/zinc/73/83/71/1316738371.db2.gz XUUGRMQMFWQYBR-CVEARBPZSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCCNC(=O)[C@@H]1CC[N@H+](C)C1)[C@@H](C)c1ccccc1F ZINC001265146426 1316738390 /nfs/dbraw/zinc/73/83/90/1316738390.db2.gz XUUGRMQMFWQYBR-JKSUJKDBSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCCNC(=O)[C@@H]1CC[N@@H+](C)C1)[C@@H](C)c1ccccc1F ZINC001265146426 1316738392 /nfs/dbraw/zinc/73/83/92/1316738392.db2.gz XUUGRMQMFWQYBR-JKSUJKDBSA-N 1 3 335.467 2.667 10 0 EFAEHO CC(C)(C(=O)N1CC[C@H]([NH2+]CCCCCF)C1)N1CCCCC1 ZINC001265430639 1316804993 /nfs/dbraw/zinc/80/49/93/1316804993.db2.gz CSAOJQRFBMTQJA-INIZCTEOSA-N 1 3 327.488 2.581 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H]([NH2+]CCCc3ccsc3)C2)CC1 ZINC001265451008 1316807624 /nfs/dbraw/zinc/80/76/24/1316807624.db2.gz CIBTUDDWBZQGEW-SFHVURJKSA-N 1 3 349.544 2.603 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2C[C@H](NC(=O)C3(N(C)C)CCC3)C2)cc1 ZINC001265481874 1316811841 /nfs/dbraw/zinc/81/18/41/1316811841.db2.gz ZGYLKDKMHHYRIR-WGSAOQKQSA-N 1 3 343.515 2.649 10 0 EFAEHO CCCC[NH2+]C[C@@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001265637078 1316839410 /nfs/dbraw/zinc/83/94/10/1316839410.db2.gz RJLDWLJFQTUFGJ-SFHVURJKSA-N 1 3 331.504 2.990 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@@H]1C[NH2+]CCCCC(F)(F)F ZINC001265683621 1316853061 /nfs/dbraw/zinc/85/30/61/1316853061.db2.gz DEPGGLSYVUWUHS-CQSZACIVSA-N 1 3 346.397 2.656 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@H]1C[NH2+]CCCCC(F)(F)F ZINC001265683620 1316853230 /nfs/dbraw/zinc/85/32/30/1316853230.db2.gz DEPGGLSYVUWUHS-AWEZNQCLSA-N 1 3 346.397 2.656 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCCCC(F)(F)F ZINC001265808310 1316880487 /nfs/dbraw/zinc/88/04/87/1316880487.db2.gz AYJAUZFUIKTTJC-CYBMUJFWSA-N 1 3 337.430 2.688 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@H+](C)CC[C@@H]2CCCC2(F)F)CCC1 ZINC001265862978 1316896296 /nfs/dbraw/zinc/89/62/96/1316896296.db2.gz OMEZVHPJZBQIQU-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@@H+](C)CC[C@@H]2CCCC2(F)F)CCC1 ZINC001265862978 1316896300 /nfs/dbraw/zinc/89/63/00/1316896300.db2.gz OMEZVHPJZBQIQU-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@H+](C)[C@H]2CCc3ccc(F)cc32)CCC1 ZINC001265863179 1316896916 /nfs/dbraw/zinc/89/69/16/1316896916.db2.gz VWLTWJQCYFOHJI-SFHVURJKSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@@H+](C)[C@H]2CCc3ccc(F)cc32)CCC1 ZINC001265863179 1316896919 /nfs/dbraw/zinc/89/69/19/1316896919.db2.gz VWLTWJQCYFOHJI-SFHVURJKSA-N 1 3 347.478 2.735 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@H+](C)CC1CCCCCC1)N(C)C ZINC001265865942 1316897462 /nfs/dbraw/zinc/89/74/62/1316897462.db2.gz AKVVCASOSYRNMW-SFHVURJKSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@@H+](C)CC1CCCCCC1)N(C)C ZINC001265865942 1316897463 /nfs/dbraw/zinc/89/74/63/1316897463.db2.gz AKVVCASOSYRNMW-SFHVURJKSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001265954153 1316927076 /nfs/dbraw/zinc/92/70/76/1316927076.db2.gz KYHBCOPOBGCHQT-LSDHHAIUSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001265954153 1316927079 /nfs/dbraw/zinc/92/70/79/1316927079.db2.gz KYHBCOPOBGCHQT-LSDHHAIUSA-N 1 3 333.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001265978085 1316935698 /nfs/dbraw/zinc/93/56/98/1316935698.db2.gz AFARVXJESFCXPG-GOSISDBHSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001265978085 1316935699 /nfs/dbraw/zinc/93/56/99/1316935699.db2.gz AFARVXJESFCXPG-GOSISDBHSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001266029621 1316961172 /nfs/dbraw/zinc/96/11/72/1316961172.db2.gz UVYWRWQWXAQWJW-WLTZFMEZSA-N 1 3 343.515 2.724 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1ccc(C)c(C)c1 ZINC001266083145 1317009223 /nfs/dbraw/zinc/00/92/23/1317009223.db2.gz VHKLEILNJFXRDV-QGZVFWFLSA-N 1 3 345.531 2.973 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1ccc(C)c(C)c1 ZINC001266083145 1317009232 /nfs/dbraw/zinc/00/92/32/1317009232.db2.gz VHKLEILNJFXRDV-QGZVFWFLSA-N 1 3 345.531 2.973 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCc1ccc(CC[NH2+]CCF)cc1 ZINC001266086456 1317013903 /nfs/dbraw/zinc/01/39/03/1317013903.db2.gz ONRVYZOXNVRBPT-IBGZPJMESA-N 1 3 349.494 2.667 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1Cc1ccccc1)N(C)C ZINC001266240892 1317189323 /nfs/dbraw/zinc/18/93/23/1317189323.db2.gz FPKRBFASXJNBPV-RTBURBONSA-N 1 3 331.504 2.888 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@@H]1CCC[N@H+]1Cc1ccccc1)N(C)C ZINC001266240892 1317189324 /nfs/dbraw/zinc/18/93/24/1317189324.db2.gz FPKRBFASXJNBPV-RTBURBONSA-N 1 3 331.504 2.888 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[C@H]1CCC[N@@H+]1Cc1cccnc1)N(C)C ZINC001266241017 1317190420 /nfs/dbraw/zinc/19/04/20/1317190420.db2.gz IPENUEZIKYCTRT-RBUKOAKNSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[C@H]1CCC[N@H+]1Cc1cccnc1)N(C)C ZINC001266241017 1317190422 /nfs/dbraw/zinc/19/04/22/1317190422.db2.gz IPENUEZIKYCTRT-RBUKOAKNSA-N 1 3 346.519 2.529 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@H+](Cc2ccc(CF)cc2)CC1)N(C)C ZINC001279637414 1317342816 /nfs/dbraw/zinc/34/28/16/1317342816.db2.gz WYBUFRSVMCHYFJ-IBGZPJMESA-N 1 3 347.478 2.745 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@@H+](Cc2ccc(CF)cc2)CC1)N(C)C ZINC001279637414 1317342822 /nfs/dbraw/zinc/34/28/22/1317342822.db2.gz WYBUFRSVMCHYFJ-IBGZPJMESA-N 1 3 347.478 2.745 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@H+](Cc2c(C)cccc2C)CC1)N(C)C ZINC001279675282 1317355606 /nfs/dbraw/zinc/35/56/06/1317355606.db2.gz CRSNPOWUANNEQW-FQEVSTJZSA-N 1 3 343.515 2.892 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@@H+](Cc2c(C)cccc2C)CC1)N(C)C ZINC001279675282 1317355614 /nfs/dbraw/zinc/35/56/14/1317355614.db2.gz CRSNPOWUANNEQW-FQEVSTJZSA-N 1 3 343.515 2.892 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H](CC[NH2+]CC=C(Cl)Cl)C1 ZINC001318777737 1328697298 /nfs/dbraw/zinc/69/72/98/1328697298.db2.gz CNWCRDYPUONKAT-KBPBESRZSA-N 1 3 348.318 2.618 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](CC[NH2+]Cc2cccc(C)c2)C1)N(C)C ZINC001280096116 1317453913 /nfs/dbraw/zinc/45/39/13/1317453913.db2.gz UGCMPDWEYLWQTJ-PKOBYXMFSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2cccc(C)c2)C1)N(C)C ZINC001280096115 1317453975 /nfs/dbraw/zinc/45/39/75/1317453975.db2.gz UGCMPDWEYLWQTJ-IEBWSBKVSA-N 1 3 331.504 2.663 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]C/C=C\c2ccccc2)C1 ZINC001280152124 1317464615 /nfs/dbraw/zinc/46/46/15/1317464615.db2.gz KMDFBKLFVSPJST-GCDVTEQJSA-N 1 3 341.499 2.622 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H]2CCN(C(=O)Cc3c[nH]cn3)C2)c(C)s1 ZINC001280208198 1317477294 /nfs/dbraw/zinc/47/72/94/1317477294.db2.gz SPOHSFYVWGWORP-OAHLLOKOSA-N 1 3 346.500 2.659 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H]2CCN(C(=O)Cc3c[nH]cn3)C2)c(C)s1 ZINC001280208195 1317477392 /nfs/dbraw/zinc/47/73/92/1317477392.db2.gz SPOHSFYVWGWORP-HNNXBMFYSA-N 1 3 346.500 2.659 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(F)cc2C)C1 ZINC001280274366 1317493818 /nfs/dbraw/zinc/49/38/18/1317493818.db2.gz ORZOKVGHNNZFIY-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC[C@@H]2CCN(C(=O)CN3CCCC3)C2)c1 ZINC001280297149 1317499809 /nfs/dbraw/zinc/49/98/09/1317499809.db2.gz RDSIZQWRUBAZKS-LJQANCHMSA-N 1 3 343.515 2.727 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001280309252 1317503712 /nfs/dbraw/zinc/50/37/12/1317503712.db2.gz ZXYSSYYXRHUGOQ-IBGZPJMESA-N 1 3 345.531 2.917 10 0 EFAEHO CC1CC(C[NH2+]CC[C@@H]2CCCN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001318802613 1328705266 /nfs/dbraw/zinc/70/52/66/1328705266.db2.gz AQGHPNKTETUYIH-ADKAHSJRSA-N 1 3 335.536 2.735 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H](CC[NH2+]CCC2CC2)C1)CC(C)(C)C ZINC001318834427 1328715723 /nfs/dbraw/zinc/71/57/23/1328715723.db2.gz DCVMMSSASXFFRA-SFHVURJKSA-N 1 3 337.552 2.983 10 0 EFAEHO CN(C)C1(C(=O)N2CCC(CC[NH2+]Cc3ccccc3)CC2)CCC1 ZINC001318895319 1328734969 /nfs/dbraw/zinc/73/49/69/1328734969.db2.gz DXWXVELJIXUSFH-UHFFFAOYSA-N 1 3 343.515 2.889 10 0 EFAEHO O=C(CN1CCCC1)N1CCC(CC[NH2+]Cc2ccccc2)CC1 ZINC001318930972 1328743931 /nfs/dbraw/zinc/74/39/31/1328743931.db2.gz JXSOCWFBQKRSAR-UHFFFAOYSA-N 1 3 329.488 2.501 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)CN(C)C2CCC2)CC[N@@H+]1CCCCCF ZINC001281664329 1318530189 /nfs/dbraw/zinc/53/01/89/1318530189.db2.gz KLFPEZQKOKDKGG-JKSUJKDBSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)CN(C)C2CCC2)CC[N@H+]1CCCCCF ZINC001281664329 1318530196 /nfs/dbraw/zinc/53/01/96/1318530196.db2.gz KLFPEZQKOKDKGG-JKSUJKDBSA-N 1 3 327.488 2.580 10 0 EFAEHO O=C(CN1CCCC1)N1CCC[C@@H]1C[NH2+]CCCCc1ccccc1 ZINC001319130195 1328785538 /nfs/dbraw/zinc/78/55/38/1328785538.db2.gz PUOZOBSZAIGKED-HXUWFJFHSA-N 1 3 343.515 2.686 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2[C@H]3C[N@@H+](CCC4=CCCCC4)C[C@H]32)CCC1 ZINC001282861815 1319167314 /nfs/dbraw/zinc/16/73/14/1319167314.db2.gz SECGKQGHPQLBDP-LDLYASANSA-N 1 3 345.531 2.655 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2[C@H]3C[N@H+](CCC4=CCCCC4)C[C@H]32)CCC1 ZINC001282861815 1319167322 /nfs/dbraw/zinc/16/73/22/1319167322.db2.gz SECGKQGHPQLBDP-LDLYASANSA-N 1 3 345.531 2.655 10 0 EFAEHO CCCCC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3nc[nH]c3C)C[C@H]2C1 ZINC001282959564 1319218298 /nfs/dbraw/zinc/21/82/98/1319218298.db2.gz VFQPWNUGGPZAOP-ULQDDVLXSA-N 1 3 332.492 2.668 10 0 EFAEHO CCCCC[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3nc[nH]c3C)C[C@H]2C1 ZINC001282959564 1319218305 /nfs/dbraw/zinc/21/83/05/1319218305.db2.gz VFQPWNUGGPZAOP-ULQDDVLXSA-N 1 3 332.492 2.668 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@@]2(C)CN(C(=O)[C@@H](CC)N(C)C)C[C@@]2(C)C1 ZINC001282992863 1319244714 /nfs/dbraw/zinc/24/47/14/1319244714.db2.gz QQHXPDCVCDESNN-SQRRQQJASA-N 1 3 335.536 2.853 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H](CC)N(C)C)C[C@@]2(C)C1 ZINC001282992863 1319244724 /nfs/dbraw/zinc/24/47/24/1319244724.db2.gz QQHXPDCVCDESNN-SQRRQQJASA-N 1 3 335.536 2.853 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H]1C[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001283110241 1319334208 /nfs/dbraw/zinc/33/42/08/1319334208.db2.gz BFHVCGMPMLNHDU-QGPMSJSTSA-N 1 3 335.467 2.594 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CCCCc2ccccc2)CN1C(=O)Cc1c[nH]cn1 ZINC001284015398 1320147702 /nfs/dbraw/zinc/14/77/02/1320147702.db2.gz RSNFBWUUKGIDSW-QFBILLFUSA-N 1 3 340.471 2.554 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@]12CCC[C@@H]1N(CCC(F)(F)F)CC2 ZINC001284068277 1320176750 /nfs/dbraw/zinc/17/67/50/1320176750.db2.gz DXQHEKPYBNURRD-HOCLYGCPSA-N 1 3 349.441 2.784 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C[NH2+]CCc1ccccc1)C(C)(C)C)N(C)C ZINC001284642095 1320454146 /nfs/dbraw/zinc/45/41/46/1320454146.db2.gz CSFGSLJOOBHERK-OALUTQOASA-N 1 3 347.547 2.936 10 0 EFAEHO CC/C=C\CC[NH+]1CCC([C@@H](C)NC(=O)CN2CC[C@H](C)C2)CC1 ZINC001284699909 1320481913 /nfs/dbraw/zinc/48/19/13/1320481913.db2.gz LXVKRTLOVNEXEQ-FDICQLOXSA-N 1 3 335.536 2.901 10 0 EFAEHO Cc1cccc(CCC[NH2+]C[C@@H](C)N(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001319473499 1328896615 /nfs/dbraw/zinc/89/66/15/1328896615.db2.gz UBFKNNAUWDCOTQ-GOSISDBHSA-N 1 3 345.531 2.848 10 0 EFAEHO CCCC[NH2+]Cc1ccc(CNC(=O)C2(N(C)C)CCC2)c(F)c1 ZINC001285004585 1320645939 /nfs/dbraw/zinc/64/59/39/1320645939.db2.gz OUXLISKOKNJFTA-UHFFFAOYSA-N 1 3 335.467 2.816 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+]C/C=C\Cl)C2CCCCC2)CCC1 ZINC001319654437 1328940192 /nfs/dbraw/zinc/94/01/92/1328940192.db2.gz FSOKPJWPSMUTRY-FGLWMGOFSA-N 1 3 341.927 2.878 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]CCCCCF ZINC001319735201 1328968959 /nfs/dbraw/zinc/96/89/59/1328968959.db2.gz CALORWNBQCACSF-SJORKVTESA-N 1 3 327.488 2.581 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@H]1CC[NH2+]CCCC1CCC1 ZINC001319778535 1328986269 /nfs/dbraw/zinc/98/62/69/1328986269.db2.gz MTKVIYCTOYMMDJ-SFHVURJKSA-N 1 3 332.492 2.893 10 0 EFAEHO CCC/C=C/CC[NH2+]C[C@@H]1[C@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001319860589 1329017477 /nfs/dbraw/zinc/01/74/77/1329017477.db2.gz GXZPRLBPHHSRII-WXFDERKXSA-N 1 3 332.492 2.915 10 0 EFAEHO CCCC[NH2+]C[C@H]1[C@@H](C)CCCN1C(=O)CN(C)CC(C)(C)C ZINC001319862288 1329018724 /nfs/dbraw/zinc/01/87/24/1329018724.db2.gz UYTQVSZGZCHSMC-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@H]2CN(C(=O)CN(C)C3CCC3)CC[C@@H]21 ZINC001320105259 1329080832 /nfs/dbraw/zinc/08/08/32/1329080832.db2.gz XSNQHLWKFRXFIL-HKUYNNGSSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCCCC[N@H+]1CC[C@H]2CN(C(=O)CN(C)C3CCC3)CC[C@@H]21 ZINC001320105259 1329080834 /nfs/dbraw/zinc/08/08/34/1329080834.db2.gz XSNQHLWKFRXFIL-HKUYNNGSSA-N 1 3 335.536 2.974 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)[C@@H](C)[NH+]2CCCCCC2)c1 ZINC001491599583 1323739362 /nfs/dbraw/zinc/73/93/62/1323739362.db2.gz ADPICZOGGFZSES-IAGOWNOFSA-N 1 3 349.494 2.993 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]Cc1ccc(C(C)(C)C)cc1 ZINC001491682690 1323788118 /nfs/dbraw/zinc/78/81/18/1323788118.db2.gz OFBLRCXERFXHBM-INIZCTEOSA-N 1 3 333.520 2.919 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]([NH2+]Cc2cccc(F)c2)C1 ZINC001491895179 1324004858 /nfs/dbraw/zinc/00/48/58/1324004858.db2.gz FBRWMVQUUOTLMJ-MSOLQXFVSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]([NH2+]Cc2cccc(F)c2)C1 ZINC001491895182 1324004905 /nfs/dbraw/zinc/00/49/05/1324004905.db2.gz FBRWMVQUUOTLMJ-ZWKOTPCHSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CCNC/C(Cl)=C/Cl ZINC001320416403 1329127482 /nfs/dbraw/zinc/12/74/82/1329127482.db2.gz TXVDQMGIKDQKOX-XWJOTYRJSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CCNC/C(Cl)=C/Cl ZINC001320416403 1329127486 /nfs/dbraw/zinc/12/74/86/1329127486.db2.gz TXVDQMGIKDQKOX-XWJOTYRJSA-N 1 3 336.307 2.663 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]CCc1ccc(C)cc1 ZINC001492128937 1324236258 /nfs/dbraw/zinc/23/62/58/1324236258.db2.gz JCAHREUYFUOFBX-QUCCMNQESA-N 1 3 345.531 2.896 10 0 EFAEHO Cc1c(C)c(C)c(CN(C)CCNC(=O)CC[NH+](C)C)c(C)c1C ZINC001492402335 1324484974 /nfs/dbraw/zinc/48/49/74/1324484974.db2.gz MUBLPOPZDZHKCN-UHFFFAOYSA-N 1 3 333.520 2.728 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001492420974 1324499478 /nfs/dbraw/zinc/49/94/78/1324499478.db2.gz FLKNCJMWKAEVQY-APWZRJJASA-N 1 3 343.531 2.929 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001492420974 1324499481 /nfs/dbraw/zinc/49/94/81/1324499481.db2.gz FLKNCJMWKAEVQY-APWZRJJASA-N 1 3 343.531 2.929 10 0 EFAEHO CCC/C=C/CC[N@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001492425176 1324502531 /nfs/dbraw/zinc/50/25/31/1324502531.db2.gz WSBWZVRJTXQOMG-CSHXORCISA-N 1 3 341.515 2.993 10 0 EFAEHO CCC/C=C/CC[N@@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001492425176 1324502535 /nfs/dbraw/zinc/50/25/35/1324502535.db2.gz WSBWZVRJTXQOMG-CSHXORCISA-N 1 3 341.515 2.993 10 0 EFAEHO CC[N@@H+]1C[C@H](NC(=O)c2ccc(Nc3ccncc3)cc2)C(C)(C)C1 ZINC001304042022 1324634210 /nfs/dbraw/zinc/63/42/10/1324634210.db2.gz CCEAIPHSGFBHJG-SFHVURJKSA-N 1 3 338.455 2.707 10 0 EFAEHO CC[N@H+]1C[C@H](NC(=O)c2ccc(Nc3ccncc3)cc2)C(C)(C)C1 ZINC001304042022 1324634215 /nfs/dbraw/zinc/63/42/15/1324634215.db2.gz CCEAIPHSGFBHJG-SFHVURJKSA-N 1 3 338.455 2.707 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@H+](C)[C@@H]1CCc2c1cccc2F)N(C)C ZINC001316846431 1324684908 /nfs/dbraw/zinc/68/49/08/1324684908.db2.gz FWIDCTBIFVLTOX-RTBURBONSA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@@H+](C)[C@@H]1CCc2c1cccc2F)N(C)C ZINC001316846431 1324684917 /nfs/dbraw/zinc/68/49/17/1324684917.db2.gz FWIDCTBIFVLTOX-RTBURBONSA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@H]1C(=O)NCCCN(C)Cc1ccsc1 ZINC001316853475 1324707977 /nfs/dbraw/zinc/70/79/77/1324707977.db2.gz GFGGYRHFLDGOJV-KRWDZBQOSA-N 1 3 337.533 2.949 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@H]1C(=O)NCCCN(C)Cc1ccsc1 ZINC001316853475 1324707980 /nfs/dbraw/zinc/70/79/80/1324707980.db2.gz GFGGYRHFLDGOJV-KRWDZBQOSA-N 1 3 337.533 2.949 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1sccc1Cl)N(C)C ZINC001320605715 1329176137 /nfs/dbraw/zinc/17/61/37/1329176137.db2.gz DLOXWSCDFAKIOF-AAEUAGOBSA-N 1 3 331.913 2.726 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@H+](C)[C@H]1CCc2c1cccc2F)N(C)C ZINC001316861766 1324902915 /nfs/dbraw/zinc/90/29/15/1324902915.db2.gz FWIDCTBIFVLTOX-OALUTQOASA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@@H+](C)[C@H]1CCc2c1cccc2F)N(C)C ZINC001316861766 1324902917 /nfs/dbraw/zinc/90/29/17/1324902917.db2.gz FWIDCTBIFVLTOX-OALUTQOASA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@H+](C)[C@@H]1CCc2c1cccc2F)N(C)C ZINC001316861763 1324902926 /nfs/dbraw/zinc/90/29/26/1324902926.db2.gz FWIDCTBIFVLTOX-MOPGFXCFSA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@@H+](C)[C@@H]1CCc2c1cccc2F)N(C)C ZINC001316861763 1324902932 /nfs/dbraw/zinc/90/29/32/1324902932.db2.gz FWIDCTBIFVLTOX-MOPGFXCFSA-N 1 3 349.494 2.837 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)[C@H](CC)N(C)C)C[C@@H]2C1 ZINC001316757245 1325110723 /nfs/dbraw/zinc/11/07/23/1325110723.db2.gz QLYLUOZBFZDYNG-YPMANSSXSA-N 1 3 335.536 2.853 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)[C@H](CC)N(C)C)C[C@@H]2C1 ZINC001316757245 1325110724 /nfs/dbraw/zinc/11/07/24/1325110724.db2.gz QLYLUOZBFZDYNG-YPMANSSXSA-N 1 3 335.536 2.853 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](C)CC[C@@H]2CCCC2(F)F)C1 ZINC001316851372 1325221827 /nfs/dbraw/zinc/22/18/27/1325221827.db2.gz VWOLBXLPWRDWNZ-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](C)CC[C@@H]2CCCC2(F)F)C1 ZINC001316851372 1325221834 /nfs/dbraw/zinc/22/18/34/1325221834.db2.gz VWOLBXLPWRDWNZ-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](C)Cc2ccc(C3CC3)cc2)C1 ZINC001316851550 1325222133 /nfs/dbraw/zinc/22/21/33/1325222133.db2.gz ZIUGGBMRUVZEDG-KRWDZBQOSA-N 1 3 343.515 2.844 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](C)Cc2ccc(C3CC3)cc2)C1 ZINC001316851550 1325222144 /nfs/dbraw/zinc/22/21/44/1325222144.db2.gz ZIUGGBMRUVZEDG-KRWDZBQOSA-N 1 3 343.515 2.844 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](C)CCc1ccccc1F ZINC001316869639 1325236093 /nfs/dbraw/zinc/23/60/93/1325236093.db2.gz INZUUSWGTBZUCQ-LJQANCHMSA-N 1 3 349.494 2.681 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](C)CCc1ccccc1F ZINC001316869639 1325236102 /nfs/dbraw/zinc/23/61/02/1325236102.db2.gz INZUUSWGTBZUCQ-LJQANCHMSA-N 1 3 349.494 2.681 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](C)CCc1ccccc1F ZINC001316869636 1325236860 /nfs/dbraw/zinc/23/68/60/1325236860.db2.gz INZUUSWGTBZUCQ-IBGZPJMESA-N 1 3 349.494 2.681 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](C)CCc1ccccc1F ZINC001316869636 1325236870 /nfs/dbraw/zinc/23/68/70/1325236870.db2.gz INZUUSWGTBZUCQ-IBGZPJMESA-N 1 3 349.494 2.681 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](C)CCc1ccc(C)cc1 ZINC001316871359 1325241296 /nfs/dbraw/zinc/24/12/96/1325241296.db2.gz WUDZWKWLSSQDOA-HXUWFJFHSA-N 1 3 345.531 2.850 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](C)CCc1ccc(C)cc1 ZINC001316871359 1325241303 /nfs/dbraw/zinc/24/13/03/1325241303.db2.gz WUDZWKWLSSQDOA-HXUWFJFHSA-N 1 3 345.531 2.850 10 0 EFAEHO CCN(CCCNC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C)CCC(F)(F)F ZINC001316911683 1325330335 /nfs/dbraw/zinc/33/03/35/1325330335.db2.gz TWLXCDCMLPWVFI-OKILXGFUSA-N 1 3 337.430 2.640 10 0 EFAEHO CCN(CCCNC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C)CCC(F)(F)F ZINC001316911683 1325330329 /nfs/dbraw/zinc/33/03/29/1325330329.db2.gz TWLXCDCMLPWVFI-OKILXGFUSA-N 1 3 337.430 2.640 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C1CC[NH+](CCCCCF)CC1 ZINC001316938023 1325388001 /nfs/dbraw/zinc/38/80/01/1325388001.db2.gz SKMFXDDBBPAANG-GOSISDBHSA-N 1 3 341.515 2.923 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC23CC[NH+](CC2=CCCCC2)CC3)CCC1 ZINC001316999542 1325467490 /nfs/dbraw/zinc/46/74/90/1325467490.db2.gz XTIDMKNQRUXVNZ-GOSISDBHSA-N 1 3 345.531 2.942 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H]([NH2+]CC/C=C\c3ccccc3)C2)C1 ZINC001317062645 1325533908 /nfs/dbraw/zinc/53/39/08/1325533908.db2.gz OECDQTVPGROBFJ-NKSPSUOSSA-N 1 3 341.499 2.622 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]CCC(F)(F)F ZINC001374419790 1341898718 /nfs/dbraw/zinc/89/87/18/1341898718.db2.gz PSWFGHXMILSBRH-KBPBESRZSA-N 1 3 337.430 2.542 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(C)ccc1C)C(=O)CN1CC[C@H](C)C1 ZINC001320840987 1329309175 /nfs/dbraw/zinc/30/91/75/1329309175.db2.gz OYSVOPNPKFBAKH-KRWDZBQOSA-N 1 3 331.504 2.583 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(F)ccc1C)C(=O)CN1CCC(C)CC1 ZINC001320876026 1329313186 /nfs/dbraw/zinc/31/31/86/1329313186.db2.gz JVEOQFSXPLCTSY-UHFFFAOYSA-N 1 3 349.494 2.804 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001320891398 1329315696 /nfs/dbraw/zinc/31/56/96/1329315696.db2.gz HUVPGXVDITTWEI-MJGOQNOKSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@@H](C(=O)N(CC)CC[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001320900526 1329316402 /nfs/dbraw/zinc/31/64/02/1329316402.db2.gz FCWMYRDBRXJWRV-KRWDZBQOSA-N 1 3 339.911 2.927 10 0 EFAEHO CCN(CC[NH2+]CCc1ccc(C)cc1)C(=O)[C@H]1CCCCN1CC ZINC001320928961 1329320902 /nfs/dbraw/zinc/32/09/02/1329320902.db2.gz NYWWEDCNBCHXCS-HXUWFJFHSA-N 1 3 345.531 2.850 10 0 EFAEHO CCN(CCNCc1ccc(C)nc1C)C(=O)CC[NH+]1CCCCC1 ZINC001320928139 1329320946 /nfs/dbraw/zinc/32/09/46/1329320946.db2.gz GYSKTTRYQXAHLM-UHFFFAOYSA-N 1 3 346.519 2.513 10 0 EFAEHO CCN(CC[NH2+]C[C@@H]1CCc2ccccc2C1)C(=O)CN(C)C(C)C ZINC001320929560 1329321053 /nfs/dbraw/zinc/32/10/53/1329321053.db2.gz RWUGMXUFKNBHEU-GOSISDBHSA-N 1 3 345.531 2.570 10 0 EFAEHO CN1CCC[C@H]1C(=O)NC/C=C\C[NH2+]Cc1ccc2ccccc2c1 ZINC001320996829 1329328910 /nfs/dbraw/zinc/32/89/10/1329328910.db2.gz GEGGTUNHOZKBSW-FBQMEGEOSA-N 1 3 337.467 2.696 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NC/C=C/C[NH2+]Cc1ccc2ccccc2c1 ZINC001320996828 1329329025 /nfs/dbraw/zinc/32/90/25/1329329025.db2.gz GEGGTUNHOZKBSW-DPZZJQGRSA-N 1 3 337.467 2.696 10 0 EFAEHO CC[C@H](C)C[N@@H+]1CCC[C@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001376537295 1343663505 /nfs/dbraw/zinc/66/35/05/1343663505.db2.gz FVASSAFWSXKFLT-DLBZAZTESA-N 1 3 325.541 2.839 10 0 EFAEHO CC[C@H](C)C[N@H+]1CCC[C@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001376537295 1343663507 /nfs/dbraw/zinc/66/35/07/1343663507.db2.gz FVASSAFWSXKFLT-DLBZAZTESA-N 1 3 325.541 2.839 10 0 EFAEHO C[C@H](NC/C=C/CNC(=O)C12CCC[NH+]1CCC2)c1cccc(F)c1 ZINC001321142472 1329348503 /nfs/dbraw/zinc/34/85/03/1329348503.db2.gz SYCJOEPGJNPPKI-KZSQQDEKSA-N 1 3 345.462 2.777 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C\CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001321208551 1329357110 /nfs/dbraw/zinc/35/71/10/1329357110.db2.gz AGWJIPHFKZIDDU-FEFZKZJHSA-N 1 3 347.478 2.626 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C\CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001321208551 1329357112 /nfs/dbraw/zinc/35/71/12/1329357112.db2.gz AGWJIPHFKZIDDU-FEFZKZJHSA-N 1 3 347.478 2.626 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NC/C=C/C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC001321189458 1329354051 /nfs/dbraw/zinc/35/40/51/1329354051.db2.gz MXPBEZDONUZCNL-WTJLDUFHSA-N 1 3 345.462 2.559 10 0 EFAEHO CCCCC[NH2+]C/C=C/CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001321252168 1329363485 /nfs/dbraw/zinc/36/34/85/1329363485.db2.gz UWDNRDRDAMWYJU-GFOMBABLSA-N 1 3 327.488 2.651 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C\C[NH2+][C@@H](C)c1cc(C)ccc1C)N(C)C ZINC001321253596 1329363750 /nfs/dbraw/zinc/36/37/50/1329363750.db2.gz VXWDJRBKBKSGJU-KTUYXQPPSA-N 1 3 331.504 2.967 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C/C[NH2+][C@H](C)c1cc(C)ccc1C)N(C)C ZINC001321253594 1329363780 /nfs/dbraw/zinc/36/37/80/1329363780.db2.gz VXWDJRBKBKSGJU-DLBUCANVSA-N 1 3 331.504 2.967 10 0 EFAEHO CC[C@H]([NH2+]C/C=C\CNC(=O)CN1CC[C@H](C)C1)c1ccccc1 ZINC001321252668 1329363820 /nfs/dbraw/zinc/36/38/20/1329363820.db2.gz WLWYMUQWEAZNTN-ZYLKZGKVSA-N 1 3 329.488 2.742 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H](C[NH2+]CCc2ccccc2F)C1)N(C)C ZINC001317157697 1327652370 /nfs/dbraw/zinc/65/23/70/1327652370.db2.gz LABYYVMJEYOPGH-LPHOPBHVSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H](C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001317157363 1327652612 /nfs/dbraw/zinc/65/26/12/1327652612.db2.gz IICUETTWHQDUGO-RIZQAGQYSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/CN[C@@H](C)c1cccc(F)c1)[NH+](C)C ZINC001321351610 1329376013 /nfs/dbraw/zinc/37/60/13/1329376013.db2.gz XIOOWNBFFHJFTR-XDWWLABZSA-N 1 3 335.467 2.735 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\CN[C@@H](C)c1cccc(F)c1)[NH+](C)C ZINC001321351611 1329376265 /nfs/dbraw/zinc/37/62/65/1329376265.db2.gz XIOOWNBFFHJFTR-ZNUVNQELSA-N 1 3 335.467 2.735 10 0 EFAEHO CCC[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CCCC1 ZINC001495944113 1327770843 /nfs/dbraw/zinc/77/08/43/1327770843.db2.gz POYHWJVJJNZQNT-GOSISDBHSA-N 1 3 327.488 2.628 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H](C[NH2+]CCCC3CCC3)C2)CC1 ZINC001317336563 1327865730 /nfs/dbraw/zinc/86/57/30/1327865730.db2.gz JSYUASBEAUPFPO-LJQANCHMSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](C[NH2+]CCCc2ccc(C)cc2)C1)N(C)C ZINC001317344422 1327873692 /nfs/dbraw/zinc/87/36/92/1327873692.db2.gz RPOGOWFFVCPTSS-UXHICEINSA-N 1 3 345.531 2.706 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@H]([NH2+]CCCCCF)C2)CCC1 ZINC001317352540 1327884635 /nfs/dbraw/zinc/88/46/35/1327884635.db2.gz RENUORMDELNCPI-JKSUJKDBSA-N 1 3 327.488 2.628 10 0 EFAEHO CC[C@H]([NH2+]C/C=C\CNC(=O)CN1CCCC1)c1ccc(F)cc1 ZINC001321401097 1329382559 /nfs/dbraw/zinc/38/25/59/1329382559.db2.gz GDKFHYTVJQAGCJ-JXCVUKRWSA-N 1 3 333.451 2.635 10 0 EFAEHO CCC[NH2+]CCc1ccc(CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001317367098 1327907375 /nfs/dbraw/zinc/90/73/75/1327907375.db2.gz UQEODIPXQQBNLX-IBGZPJMESA-N 1 3 331.504 2.718 10 0 EFAEHO C[C@H](NC/C=C\CNC(=O)[C@@H]1CC[N@H+](C)C1)c1ccc(Cl)cc1 ZINC001321404553 1329383248 /nfs/dbraw/zinc/38/32/48/1329383248.db2.gz RKCSGAVELSFPGJ-WCQMXNECSA-N 1 3 335.879 2.615 10 0 EFAEHO C[C@H](NC/C=C\CNC(=O)[C@@H]1CC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC001321404553 1329383251 /nfs/dbraw/zinc/38/32/51/1329383251.db2.gz RKCSGAVELSFPGJ-WCQMXNECSA-N 1 3 335.879 2.615 10 0 EFAEHO CC(C)N(C)CC(=O)NC/C=C/C[NH2+][C@H]1CCCc2ccccc21 ZINC001321419368 1329384732 /nfs/dbraw/zinc/38/47/32/1329384732.db2.gz PHJUDIPUDICJPE-GHOSXJJBSA-N 1 3 329.488 2.666 10 0 EFAEHO Cc1cccnc1C[N@H+]1CCC[C@H]1CCCNC(=O)CN(C)C(C)C ZINC001317435859 1328023500 /nfs/dbraw/zinc/02/35/00/1328023500.db2.gz VQDYAUWYKJLBFU-GOSISDBHSA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1cccnc1C[N@@H+]1CCC[C@H]1CCCNC(=O)CN(C)C(C)C ZINC001317435859 1328023509 /nfs/dbraw/zinc/02/35/09/1328023509.db2.gz VQDYAUWYKJLBFU-GOSISDBHSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]CCc1ccc2ccccc2c1)N(C)C ZINC001321564991 1329395758 /nfs/dbraw/zinc/39/57/58/1329395758.db2.gz XNPUVZPMGOLTLQ-OXQOHEQNSA-N 1 3 341.499 2.817 10 0 EFAEHO CN(CC[NH2+]Cc1cccc(C(F)F)c1)C(=O)CN(C)C1CCC1 ZINC001317595705 1328176202 /nfs/dbraw/zinc/17/62/02/1328176202.db2.gz IXMBMYISMUEUGW-UHFFFAOYSA-N 1 3 339.430 2.657 10 0 EFAEHO CN(CC[NH2+]Cc1ccc(F)c(Cl)c1)C(=O)[C@@H]1CCCCN1C ZINC001317619775 1328201383 /nfs/dbraw/zinc/20/13/83/1328201383.db2.gz JCZOXGBGJVWISV-INIZCTEOSA-N 1 3 341.858 2.511 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[NH2+]CCc1ccc2ccccc2c1)N(C)C ZINC001317655646 1328243455 /nfs/dbraw/zinc/24/34/55/1328243455.db2.gz UOFDFJPCKVCBIB-FQEVSTJZSA-N 1 3 341.499 2.771 10 0 EFAEHO Cc1ccc(C[NH2+]CCN(C)C(=O)c2cccc(CN(C)C)c2)cc1 ZINC001317670465 1328263355 /nfs/dbraw/zinc/26/33/55/1328263355.db2.gz STPNPYKHEAMZHM-UHFFFAOYSA-N 1 3 339.483 2.918 10 0 EFAEHO C[C@H](C[NH2+]CCc1ccccc1)NC(=O)c1cccc(CN(C)C)c1 ZINC001321757068 1329406953 /nfs/dbraw/zinc/40/69/53/1329406953.db2.gz UXUDIVMJCJSCNX-QGZVFWFLSA-N 1 3 339.483 2.699 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](C[N@H+](C)CCC3=CCCCC3)C2)C1 ZINC001317852867 1328417948 /nfs/dbraw/zinc/41/79/48/1328417948.db2.gz IVULDWPMJZQDDJ-UYAOXDASSA-N 1 3 347.547 2.999 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](C[N@@H+](C)CCC3=CCCCC3)C2)C1 ZINC001317852867 1328417951 /nfs/dbraw/zinc/41/79/51/1328417951.db2.gz IVULDWPMJZQDDJ-UYAOXDASSA-N 1 3 347.547 2.999 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CCc1cccs1 ZINC001322003756 1329421920 /nfs/dbraw/zinc/42/19/20/1329421920.db2.gz BFTSKCZMDBUWCV-RDJZCZTQSA-N 1 3 337.533 2.648 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CCCC[C@H]1C[NH2+]CCCF)N1CCCCC1 ZINC001322328601 1329447418 /nfs/dbraw/zinc/44/74/18/1329447418.db2.gz CVPCRBZIUOPCFC-IRXDYDNUSA-N 1 3 341.515 2.875 10 0 EFAEHO Cc1ccc(C[NH2+]CCCN(C)C(=O)[C@H](C(C)C)N(C)C)cc1F ZINC001322554254 1329467189 /nfs/dbraw/zinc/46/71/89/1329467189.db2.gz HCVZRWCRZMGPBW-SFHVURJKSA-N 1 3 337.483 2.658 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+][C@@H](C)c1cccc(F)c1)N(C)C ZINC001322683842 1329479160 /nfs/dbraw/zinc/47/91/60/1329479160.db2.gz VPXKKLKKRKGCPI-MAUKXSAKSA-N 1 3 337.483 2.911 10 0 EFAEHO CC1CC(C[NH2+]CCCN(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001322694707 1329480495 /nfs/dbraw/zinc/48/04/95/1329480495.db2.gz TUFAVRVIWUOLIW-RJYAGPCLSA-N 1 3 341.515 2.683 10 0 EFAEHO Cc1cc(C[NH2+]CCCN(C)C(=O)[C@H](C(C)C)N(C)C)c(C)s1 ZINC001322795276 1329489055 /nfs/dbraw/zinc/48/90/55/1329489055.db2.gz CXQAUWGIZIEXFA-KRWDZBQOSA-N 1 3 339.549 2.889 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)CN1CCCC1)c1ccc2c(c1)CCC2 ZINC001322834729 1329492737 /nfs/dbraw/zinc/49/27/37/1329492737.db2.gz GQDNTARAMHSWTP-KRWDZBQOSA-N 1 3 343.515 2.770 10 0 EFAEHO CCC(CC)C[N@@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)C(C)(C)C1 ZINC001381140431 1348105168 /nfs/dbraw/zinc/10/51/68/1348105168.db2.gz DDSBWYHYOCILHY-QGZVFWFLSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCCC[N@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001323720620 1329564827 /nfs/dbraw/zinc/56/48/27/1329564827.db2.gz QBOLVRZRRIQJQE-LJQANCHMSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCCC[N@@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001323720620 1329564830 /nfs/dbraw/zinc/56/48/30/1329564830.db2.gz QBOLVRZRRIQJQE-LJQANCHMSA-N 1 3 335.536 2.974 10 0 EFAEHO CC[C@H](F)CN1CCC[C@@]2(CCN(C(=O)CCCC[NH+](C)C)C2)C1 ZINC001323817236 1329574914 /nfs/dbraw/zinc/57/49/14/1329574914.db2.gz ZGDXSWGMLVFDQC-PKOBYXMFSA-N 1 3 341.515 2.781 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]1C[NH2+]CCCCC(F)(F)F)C1CCC1 ZINC001324175185 1329605617 /nfs/dbraw/zinc/60/56/17/1329605617.db2.gz LPROBZQRANLUCZ-OAHLLOKOSA-N 1 3 349.441 2.784 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@H]1C[NH2+]CCc1ccccc1 ZINC001324286717 1329614052 /nfs/dbraw/zinc/61/40/52/1329614052.db2.gz STGSEMXXQJPOJH-PMACEKPBSA-N 1 3 343.515 2.684 10 0 EFAEHO CCC(CC)C[N@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)C(C)(C)C1 ZINC001381140431 1348105180 /nfs/dbraw/zinc/10/51/80/1348105180.db2.gz DDSBWYHYOCILHY-QGZVFWFLSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](NC(=O)C1(C[NH+](C)C)CCCCC1)[C@H](C)NCc1ccccn1 ZINC001381416510 1348258150 /nfs/dbraw/zinc/25/81/50/1348258150.db2.gz SLFHRDGLSHNACL-DLBZAZTESA-N 1 3 346.519 2.577 10 0 EFAEHO CCC/C=C\CC[NH2+]C[C@@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@@H]1C ZINC001325528157 1329694544 /nfs/dbraw/zinc/69/45/44/1329694544.db2.gz ZCRIRRSTNXYUNX-MZIIKBMYSA-N 1 3 335.536 2.901 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]CCC2CCCCC2)C1 ZINC001325595401 1329699595 /nfs/dbraw/zinc/69/95/95/1329699595.db2.gz JFFPQTHQOMHXNU-PKOBYXMFSA-N 1 3 337.552 2.983 10 0 EFAEHO CCCCCC[N@H+]1C[C@H]2CN(C(=O)[C@@H]3CCCCN3CC)C[C@H]2C1 ZINC001325778390 1329712660 /nfs/dbraw/zinc/71/26/60/1329712660.db2.gz GVMPJIWJRISLIH-OTWHNJEPSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCCCC[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3CCCCN3CC)C[C@H]2C1 ZINC001325778390 1329712661 /nfs/dbraw/zinc/71/26/61/1329712661.db2.gz GVMPJIWJRISLIH-OTWHNJEPSA-N 1 3 335.536 2.831 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC[C@@H](C)N(C)Cc2ccccc2)C1 ZINC001381573118 1348370015 /nfs/dbraw/zinc/37/00/15/1348370015.db2.gz KKBYEWCBRASCLO-IEBWSBKVSA-N 1 3 331.504 2.745 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC[C@@H](C)N(C)Cc2ccccc2)C1 ZINC001381573118 1348370020 /nfs/dbraw/zinc/37/00/20/1348370020.db2.gz KKBYEWCBRASCLO-IEBWSBKVSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2ccsc2)C1)N(C)C ZINC001326351083 1329749394 /nfs/dbraw/zinc/74/93/94/1329749394.db2.gz DYDLUWGPTGDODU-NVXWUHKLSA-N 1 3 337.533 2.663 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](CC[NH2+]CC2CC(C)(C)C2)C1)N(C)C ZINC001326417281 1329754716 /nfs/dbraw/zinc/75/47/16/1329754716.db2.gz BJTFONQJZQBBKN-SJLPKXTDSA-N 1 3 337.552 2.837 10 0 EFAEHO CC[C@H](F)C[NH2+]CC[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001326436599 1329756404 /nfs/dbraw/zinc/75/64/04/1329756404.db2.gz FLMZVIAJJMDHOW-LPHOPBHVSA-N 1 3 349.494 2.938 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@H](CC[NH2+]C/C=C/Cl)C2)c1 ZINC001326440030 1329756994 /nfs/dbraw/zinc/75/69/94/1329756994.db2.gz YWRDZUDBVGXSST-UFNQUYMESA-N 1 3 349.906 2.943 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@H](NC(=O)Cc2nc[nH]c2C)C(C)(C)C1 ZINC001328099199 1330555234 /nfs/dbraw/zinc/55/52/34/1330555234.db2.gz SVXQONAHHARUEH-LXXRFIIISA-N 1 3 332.492 2.834 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@H](NC(=O)Cc2nc[nH]c2C)C(C)(C)C1 ZINC001328099199 1330555237 /nfs/dbraw/zinc/55/52/37/1330555237.db2.gz SVXQONAHHARUEH-LXXRFIIISA-N 1 3 332.492 2.834 10 0 EFAEHO CCCC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)C1(N(C)C)CCC1 ZINC001328686989 1330616308 /nfs/dbraw/zinc/61/63/08/1330616308.db2.gz VHQVAHDUOWMFBM-QZTJIDSGSA-N 1 3 329.488 2.643 10 0 EFAEHO CC(C)=CCN(C)C[C@H]1CCCN1C(=O)[C@H]1CCC[N@H+]1CC(C)C ZINC001328732527 1330622804 /nfs/dbraw/zinc/62/28/04/1330622804.db2.gz GZMSYIHLGQWABV-RTBURBONSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)=CCN(C)C[C@H]1CCCN1C(=O)[C@H]1CCC[N@@H+]1CC(C)C ZINC001328732527 1330622806 /nfs/dbraw/zinc/62/28/06/1330622806.db2.gz GZMSYIHLGQWABV-RTBURBONSA-N 1 3 335.536 2.996 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H](C)[NH2+]CC/C=C\c1ccccc1 ZINC001329173112 1330676434 /nfs/dbraw/zinc/67/64/34/1330676434.db2.gz PJUQXFGISYKJIT-MOJJGNAPSA-N 1 3 340.471 2.847 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@@H]2C[C@H](C)N(C(=O)CN3CCCC3)C2)cc1 ZINC001332046414 1330909125 /nfs/dbraw/zinc/90/91/25/1330909125.db2.gz GWQHRQAKFKWRKU-AZUAARDMSA-N 1 3 343.515 2.602 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H]2C[C@H](C)N(C(=O)CCCC[NH+](C)C)C2)c1 ZINC001332050510 1330909950 /nfs/dbraw/zinc/90/99/50/1330909950.db2.gz PUQMKUMAPBSRDP-FUHWJXTLSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)CCC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]21 ZINC001332157080 1330930141 /nfs/dbraw/zinc/93/01/41/1330930141.db2.gz INEXGZGUMXXKEB-GBESFXJTSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)CCC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@H]21 ZINC001332157082 1330930284 /nfs/dbraw/zinc/93/02/84/1330930284.db2.gz INEXGZGUMXXKEB-GUDVDZBRSA-N 1 3 337.552 2.980 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccccc2)C(C)(C)C1 ZINC001332437263 1330971806 /nfs/dbraw/zinc/97/18/06/1330971806.db2.gz LWVACZZZPUMWLP-IBGZPJMESA-N 1 3 345.531 2.788 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]CCc1ccc(C)cc1)C(C)(C)C)N(C)C ZINC001332882077 1331034808 /nfs/dbraw/zinc/03/48/08/1331034808.db2.gz QNZYAXUFYQDYAR-MOPGFXCFSA-N 1 3 347.547 2.998 10 0 EFAEHO CCCCC[NH+]1CCC(C2(NC(=O)CN3CC[C@@H](C)C3)CC2)CC1 ZINC001333180885 1331089600 /nfs/dbraw/zinc/08/96/00/1331089600.db2.gz UIBUTSAQFSWURP-QGZVFWFLSA-N 1 3 335.536 2.879 10 0 EFAEHO CN(C)C1(C(=O)NCC2=CC[N@H+](CC3CCCCC3)CC2)CCC1 ZINC001333354836 1331124279 /nfs/dbraw/zinc/12/42/79/1331124279.db2.gz QWADRGKIYWYYPZ-UHFFFAOYSA-N 1 3 333.520 2.799 10 0 EFAEHO CN(C)C1(C(=O)NCC2=CC[N@@H+](CC3CCCCC3)CC2)CCC1 ZINC001333354836 1331124283 /nfs/dbraw/zinc/12/42/83/1331124283.db2.gz QWADRGKIYWYYPZ-UHFFFAOYSA-N 1 3 333.520 2.799 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N1CC=C(CNC(=O)CC[NH+](C)C)CC1 ZINC001333391091 1331131705 /nfs/dbraw/zinc/13/17/05/1331131705.db2.gz NMFWNJVDWKFZPR-IBGZPJMESA-N 1 3 347.478 2.977 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@H+](Cc2ccccc2C)CC1)N(C)C ZINC001333406657 1331137069 /nfs/dbraw/zinc/13/70/69/1331137069.db2.gz NPPLROZKVXUILZ-IBGZPJMESA-N 1 3 329.488 2.584 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@@H+](Cc2ccccc2C)CC1)N(C)C ZINC001333406657 1331137072 /nfs/dbraw/zinc/13/70/72/1331137072.db2.gz NPPLROZKVXUILZ-IBGZPJMESA-N 1 3 329.488 2.584 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NCCSc2ccncc2)[C@H](C)C1 ZINC001335813717 1331405799 /nfs/dbraw/zinc/40/57/99/1331405799.db2.gz KEOGIEMAPBWMHA-AEFFLSMTSA-N 1 3 337.533 2.900 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NCCSc2ccncc2)[C@H](C)C1 ZINC001335813717 1331405801 /nfs/dbraw/zinc/40/58/01/1331405801.db2.gz KEOGIEMAPBWMHA-AEFFLSMTSA-N 1 3 337.533 2.900 10 0 EFAEHO CCN(CCCNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)Cc1cc(C)ccc1F ZINC001479846083 1332544456 /nfs/dbraw/zinc/54/44/56/1332544456.db2.gz WFGMQIWIYACMOA-SJLPKXTDSA-N 1 3 349.494 2.803 10 0 EFAEHO CCN(CCCNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)Cc1cc(C)ccc1F ZINC001479846083 1332544458 /nfs/dbraw/zinc/54/44/58/1332544458.db2.gz WFGMQIWIYACMOA-SJLPKXTDSA-N 1 3 349.494 2.803 10 0 EFAEHO O=C(OC[C@@H]1CC[N@@H+]1C1CCCCCC1)C1CCCN(C2CC2)C1=O ZINC001345531093 1332546545 /nfs/dbraw/zinc/54/65/45/1332546545.db2.gz NBBJGQFNWQTEGO-ROUUACIJSA-N 1 3 348.487 2.728 10 0 EFAEHO O=C(OC[C@@H]1CC[N@H+]1C1CCCCCC1)C1CCCN(C2CC2)C1=O ZINC001345531093 1332546548 /nfs/dbraw/zinc/54/65/48/1332546548.db2.gz NBBJGQFNWQTEGO-ROUUACIJSA-N 1 3 348.487 2.728 10 0 EFAEHO CC[NH+]1CCC(N(C)CCc2ccc3c(c2)OC(F)(F)O3)CC1 ZINC001413965718 1334742149 /nfs/dbraw/zinc/74/21/49/1334742149.db2.gz YZCYSGPNNPHRRN-UHFFFAOYSA-N 1 3 326.387 2.967 10 0 EFAEHO O=C1O[C@@]2(CN1CN1CCC[C@H]1CC1CCCC1)C[NH+]1CCC2CC1 ZINC000848507263 1334763892 /nfs/dbraw/zinc/76/38/92/1334763892.db2.gz VEFMGHKJPQSJPN-AZUAARDMSA-N 1 3 347.503 2.905 10 0 EFAEHO O=C1O[C@]2(CN1CN1CCC[C@@H]1CC1CCCC1)C[NH+]1CCC2CC1 ZINC000848507265 1334763982 /nfs/dbraw/zinc/76/39/82/1334763982.db2.gz VEFMGHKJPQSJPN-QUCCMNQESA-N 1 3 347.503 2.905 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](CNCc2cc(Br)cnc2Cl)C1 ZINC000848562385 1334796111 /nfs/dbraw/zinc/79/61/11/1334796111.db2.gz IWKPJGMGVFMYIX-WVSHTKLVSA-N 1 3 332.673 2.927 10 0 EFAEHO CC1(C)SC[C@@H]1NC(=[NH2+])NC1CCN(Cc2ccccc2)CC1 ZINC000848992692 1335028772 /nfs/dbraw/zinc/02/87/72/1335028772.db2.gz PUWZKSIVRQVOPP-INIZCTEOSA-N 1 3 332.517 2.659 10 0 EFAEHO CCC1CCC(N(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)CC1 ZINC001413896062 1335399582 /nfs/dbraw/zinc/39/95/82/1335399582.db2.gz ZSOKUIFHTATUBV-AOCRQIFASA-N 1 3 340.556 2.869 10 0 EFAEHO CCC1CCC(N(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)CC1 ZINC001413896062 1335399585 /nfs/dbraw/zinc/39/95/85/1335399585.db2.gz ZSOKUIFHTATUBV-AOCRQIFASA-N 1 3 340.556 2.869 10 0 EFAEHO CC1(C)CC[C@H](CNC(=[NH2+])NC2CCN(Cc3ccccc3)CC2)O1 ZINC000849098200 1335551418 /nfs/dbraw/zinc/55/14/18/1335551418.db2.gz QGAHUYWNBMYWDC-GOSISDBHSA-N 1 3 344.503 2.723 10 0 EFAEHO Cc1ccc(NC(=S)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1F ZINC000849275018 1335585528 /nfs/dbraw/zinc/58/55/28/1335585528.db2.gz GJIBVMLPFUNSBD-AWEZNQCLSA-N 1 3 340.512 2.693 10 0 EFAEHO Cc1ccc(NC(=S)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1F ZINC000849275018 1335585530 /nfs/dbraw/zinc/58/55/30/1335585530.db2.gz GJIBVMLPFUNSBD-AWEZNQCLSA-N 1 3 340.512 2.693 10 0 EFAEHO C[C@@H]1C[C@@H](CN2Cc3ccc(NC(=O)C(F)(F)F)cc3C2)CC[NH2+]1 ZINC000849349501 1335596981 /nfs/dbraw/zinc/59/69/81/1335596981.db2.gz BNMZMOMSWJXCQW-NEPJUHHUSA-N 1 3 341.377 2.891 10 0 EFAEHO CO[C@@H](Cc1ccccc1)CN1CCC(O)(C[NH+]2CCCCC2)CC1 ZINC001414061822 1335605368 /nfs/dbraw/zinc/60/53/68/1335605368.db2.gz DOJAJINNFRHCSV-FQEVSTJZSA-N 1 3 346.515 2.557 10 0 EFAEHO CCCN(CC[NH+](CC)CC)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001361593970 1336208462 /nfs/dbraw/zinc/20/84/62/1336208462.db2.gz HZWQMMJBFSROSG-SFHVURJKSA-N 1 3 329.504 2.779 10 0 EFAEHO CC(C)CN(C(=O)c1cccc(CC[NH+](C)C)c1)C1CCN(C)CC1 ZINC001361930798 1336422536 /nfs/dbraw/zinc/42/25/36/1336422536.db2.gz ZUHPPMVNCGTTMS-UHFFFAOYSA-N 1 3 345.531 2.983 10 0 EFAEHO C[C@@H](C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC001362235172 1336567131 /nfs/dbraw/zinc/56/71/31/1336567131.db2.gz WLQRQJXDOWLKOU-DMUMMCEESA-N 1 3 343.515 2.981 10 0 EFAEHO C[C@@H](C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001362235172 1336567134 /nfs/dbraw/zinc/56/71/34/1336567134.db2.gz WLQRQJXDOWLKOU-DMUMMCEESA-N 1 3 343.515 2.981 10 0 EFAEHO C[C@H](NC(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1)[C@@H](c1ccccc1)N(C)C ZINC001362412831 1336599778 /nfs/dbraw/zinc/59/97/78/1336599778.db2.gz XHEZHXVEVXKNAK-NQYYFHDYSA-N 1 3 331.504 2.914 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001362668242 1336698103 /nfs/dbraw/zinc/69/81/03/1336698103.db2.gz SVBYQMIZWYPTCW-NEWSRXKRSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001362668242 1336698105 /nfs/dbraw/zinc/69/81/05/1336698105.db2.gz SVBYQMIZWYPTCW-NEWSRXKRSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@@H](CC[NH+](C)C)C(=O)N1CCN(Cc2ccccc2)C[C@@H](C)C1 ZINC001362697815 1336708072 /nfs/dbraw/zinc/70/80/72/1336708072.db2.gz YYZNTMPRLOBMJP-MSOLQXFVSA-N 1 3 331.504 2.555 10 0 EFAEHO CC1(C)OC[C@@H](CCN2C[C@H]3C[N@H+](Cc4ccccc4)C[C@@]3(C)C2)O1 ZINC001363300902 1336864416 /nfs/dbraw/zinc/86/44/16/1336864416.db2.gz STMGHQKEBZATLO-QKNQBKEWSA-N 1 3 344.499 2.982 10 0 EFAEHO CC1(C)OC[C@@H](CCN2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@@]3(C)C2)O1 ZINC001363300902 1336864419 /nfs/dbraw/zinc/86/44/19/1336864419.db2.gz STMGHQKEBZATLO-QKNQBKEWSA-N 1 3 344.499 2.982 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CCN1CCN(CC2(O)CCCCCC2)CC1 ZINC001363771741 1337034701 /nfs/dbraw/zinc/03/47/01/1337034701.db2.gz QIYIYRMCPFOIOJ-KDURUIRLSA-N 1 3 337.552 2.562 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(CC2(O)CCCCCC2)CC1 ZINC001363771741 1337034704 /nfs/dbraw/zinc/03/47/04/1337034704.db2.gz QIYIYRMCPFOIOJ-KDURUIRLSA-N 1 3 337.552 2.562 10 0 EFAEHO CN1CCC[C@@H]1CC[NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)C12CCC2 ZINC001363812986 1337064048 /nfs/dbraw/zinc/06/40/48/1337064048.db2.gz XJCXJDZXAJEQAY-HZPDHXFCSA-N 1 3 337.508 2.992 10 0 EFAEHO CCC1([NH+]2CCCCC2)CCN(C[C@H](C)CN2CCOCC2)CC1 ZINC001363821942 1337068152 /nfs/dbraw/zinc/06/81/52/1337068152.db2.gz ZQEGARUSMPEFSI-IBGZPJMESA-N 1 3 337.552 2.685 10 0 EFAEHO CO[C@@H](CN1CCC(O)(C[NH+]2CCCCC2)CC1)c1ccccc1 ZINC001363855249 1337083319 /nfs/dbraw/zinc/08/33/19/1337083319.db2.gz YNYOATKFFILLNM-IBGZPJMESA-N 1 3 332.488 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+]C/C=C/c2ccccc2)C1 ZINC001365849372 1337256265 /nfs/dbraw/zinc/25/62/65/1337256265.db2.gz MLKSKJZSTRPABH-PAFGZMJHSA-N 1 3 329.488 2.524 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)[C@@H]2CCCCN2C(=O)CC[NH+](C)C)c1 ZINC001365932262 1337264309 /nfs/dbraw/zinc/26/43/09/1337264309.db2.gz XUJQNZOJTFYXBQ-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCN(CCc2ccccc2)C1)[NH+]1CCCC1 ZINC001366006767 1337317120 /nfs/dbraw/zinc/31/71/20/1337317120.db2.gz WCNBFFLCHMHWLV-WOJBJXKFSA-N 1 3 343.515 2.540 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC12CC[NH+](CCCC1CCC1)CC2)N(C)C ZINC001366010670 1337320817 /nfs/dbraw/zinc/32/08/17/1337320817.db2.gz XMWJHPFNDROWGF-QZTJIDSGSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC12CC[NH+](CC1CC(C)(C)C1)CC2 ZINC001366019030 1337327488 /nfs/dbraw/zinc/32/74/88/1337327488.db2.gz QAPDAHJEPDXSDH-QGZVFWFLSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1cc(C)sc1C)C1CC1)N(C)C ZINC001366062271 1337355781 /nfs/dbraw/zinc/35/57/81/1337355781.db2.gz MBFLFJYWPQAGSP-IAGOWNOFSA-N 1 3 337.533 2.690 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+][C@@H]2CCc3ccc(Cl)cc32)C1 ZINC001366103816 1337380838 /nfs/dbraw/zinc/38/08/38/1337380838.db2.gz VZLKGYQAYLGOQL-FUHWJXTLSA-N 1 3 349.906 2.860 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@H]2CN(CCC(F)(F)F)CC[C@@H]21 ZINC001366144172 1337400443 /nfs/dbraw/zinc/40/04/43/1337400443.db2.gz KYANZEBXFMUKGB-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@H]2CN(CCC(F)(F)F)CC[C@@H]21 ZINC001366144172 1337400451 /nfs/dbraw/zinc/40/04/51/1337400451.db2.gz KYANZEBXFMUKGB-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc(OC(C)C)c2)C1)N(C)C ZINC001366168064 1337411724 /nfs/dbraw/zinc/41/17/24/1337411724.db2.gz HAWOMXGDTUKCJM-ZIFCJYIRSA-N 1 3 347.503 2.551 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](C/C=C\c2ccccc2)C1)N(C)C ZINC001366173437 1337415024 /nfs/dbraw/zinc/41/50/24/1337415024.db2.gz BVYVMCUOIOZWAI-JDBYYAOJSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](C/C=C\c2ccccc2)C1)N(C)C ZINC001366173437 1337415027 /nfs/dbraw/zinc/41/50/27/1337415027.db2.gz BVYVMCUOIOZWAI-JDBYYAOJSA-N 1 3 343.515 2.868 10 0 EFAEHO CCc1ccc(CC[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001366174897 1337416220 /nfs/dbraw/zinc/41/62/20/1337416220.db2.gz ZHUVFCMSLQDUMX-HSALFYBXSA-N 1 3 345.531 2.615 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC001366186901 1337427127 /nfs/dbraw/zinc/42/71/27/1337427127.db2.gz PHFADGCRGBLHJY-MSOLQXFVSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@H+]([C@H](C)c2ccccc2)C1 ZINC001366186901 1337427129 /nfs/dbraw/zinc/42/71/29/1337427129.db2.gz PHFADGCRGBLHJY-MSOLQXFVSA-N 1 3 331.504 2.916 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[NH2+][C@@H]2CCc3ccccc32)C1 ZINC001366208869 1337445339 /nfs/dbraw/zinc/44/53/39/1337445339.db2.gz RJURVXXPKCDGOV-YLJYHZDGSA-N 1 3 343.515 2.844 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001366230838 1337464399 /nfs/dbraw/zinc/46/43/99/1337464399.db2.gz MMUGQDPWHKCHMD-PBHICJAKSA-N 1 3 346.519 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001366230838 1337464403 /nfs/dbraw/zinc/46/44/03/1337464403.db2.gz MMUGQDPWHKCHMD-PBHICJAKSA-N 1 3 346.519 2.914 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]Cc2ccc(OC)cc2)CC1)N(C)C ZINC001366250588 1337476942 /nfs/dbraw/zinc/47/69/42/1337476942.db2.gz YAMBJKHYHKJIPE-FAFZWHIHSA-N 1 3 347.503 2.552 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)C(C)(C)[NH+]2CCCCC2)c1 ZINC001366277989 1337487195 /nfs/dbraw/zinc/48/71/95/1337487195.db2.gz PWMZXCNUAANIPR-MRXNPFEDSA-N 1 3 349.494 2.993 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001366314233 1337506074 /nfs/dbraw/zinc/50/60/74/1337506074.db2.gz YFTVFKSBPAVAJQ-MRXNPFEDSA-N 1 3 331.504 2.718 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]C/C=C/c1ccccc1 ZINC001366314305 1337506150 /nfs/dbraw/zinc/50/61/50/1337506150.db2.gz YMEKQPWURKITOC-XLNAKTSKSA-N 1 3 329.488 2.669 10 0 EFAEHO C[C@@H](CNC(=O)C12CC[NH+](CC1)C2)N[C@@H](C)c1ccccc1Cl ZINC001366342979 1337523210 /nfs/dbraw/zinc/52/32/10/1337523210.db2.gz HSSJLKSVALDHJB-KBPBESRZSA-N 1 3 335.879 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]C/C=C/c1ccc(Cl)cc1 ZINC001366362738 1337536843 /nfs/dbraw/zinc/53/68/43/1337536843.db2.gz CYKBRSBXMYJNQP-LLYBFZRZSA-N 1 3 337.895 2.788 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(Cl)c(F)c2)C1 ZINC001366387049 1337553116 /nfs/dbraw/zinc/55/31/16/1337553116.db2.gz ABGBZAHQGMEXNT-AWEZNQCLSA-N 1 3 341.858 2.510 10 0 EFAEHO CC[C@H]([NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)C1)c1ccc(F)cc1 ZINC001366388639 1337553646 /nfs/dbraw/zinc/55/36/46/1337553646.db2.gz KGQQSBYPMKMSKT-ROUUACIJSA-N 1 3 335.467 2.808 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N1CC[C@@H](CNC/C(Cl)=C/Cl)C1 ZINC001366402861 1337560494 /nfs/dbraw/zinc/56/04/94/1337560494.db2.gz NOJZVPUUPNZNFW-DJRMKIQDSA-N 1 3 348.318 2.618 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N1CC[C@@H](CNC/C(Cl)=C/Cl)C1 ZINC001366402861 1337560500 /nfs/dbraw/zinc/56/05/00/1337560500.db2.gz NOJZVPUUPNZNFW-DJRMKIQDSA-N 1 3 348.318 2.618 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[NH2+][C@H](C)c2cccc(OC)c2)C1 ZINC001366411815 1337565000 /nfs/dbraw/zinc/56/50/00/1337565000.db2.gz NDDIHRNYOVPONR-SJORKVTESA-N 1 3 347.503 2.536 10 0 EFAEHO Cc1ccc(CN(C)[C@@H]2CCCN(C(=O)CC[NH+](C)C)C2)cc1F ZINC001366438981 1337586999 /nfs/dbraw/zinc/58/69/99/1337586999.db2.gz HGLRNGFVOLKQFK-QGZVFWFLSA-N 1 3 335.467 2.509 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1ccc2ncccc2c1)N(C)C ZINC001366473953 1337616657 /nfs/dbraw/zinc/61/66/57/1337616657.db2.gz KOUPHMPIWYLDMJ-DNVCBOLYSA-N 1 3 342.487 2.559 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CCNC(=O)CN(C)CC(C)(C)C)c(C)n1 ZINC001366487522 1337628695 /nfs/dbraw/zinc/62/86/95/1337628695.db2.gz PPVPODPBQBOGLG-HNNXBMFYSA-N 1 3 348.535 2.661 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001366503434 1337645262 /nfs/dbraw/zinc/64/52/62/1337645262.db2.gz CVOUAMOGTANKBN-WMLDXEAASA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001366503427 1337645451 /nfs/dbraw/zinc/64/54/51/1337645451.db2.gz CVOUAMOGTANKBN-RHSMWYFYSA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)CCNC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001366530402 1337666734 /nfs/dbraw/zinc/66/67/34/1337666734.db2.gz RJGKSNILLDXODG-SFHVURJKSA-N 1 3 349.906 2.538 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@H+](C)CCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001366564678 1337698114 /nfs/dbraw/zinc/69/81/14/1337698114.db2.gz FILBPSBFWVOFAB-AEFFLSMTSA-N 1 3 331.504 2.754 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@@H+](C)CCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001366564678 1337698118 /nfs/dbraw/zinc/69/81/18/1337698118.db2.gz FILBPSBFWVOFAB-AEFFLSMTSA-N 1 3 331.504 2.754 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@H+](C)[C@@H]2CCc3ccc(Cl)cc32)C1 ZINC001366565659 1337700939 /nfs/dbraw/zinc/70/09/39/1337700939.db2.gz KPYDZBDOTGIZLJ-KBXCAEBGSA-N 1 3 349.906 2.717 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@@H+](C)[C@@H]2CCc3ccc(Cl)cc32)C1 ZINC001366565659 1337700941 /nfs/dbraw/zinc/70/09/41/1337700941.db2.gz KPYDZBDOTGIZLJ-KBXCAEBGSA-N 1 3 349.906 2.717 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@H+](C)[C@H]2CCc3ccc(Cl)cc32)C1 ZINC001366565660 1337701195 /nfs/dbraw/zinc/70/11/95/1337701195.db2.gz KPYDZBDOTGIZLJ-KDOFPFPSSA-N 1 3 349.906 2.717 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@@H+](C)[C@H]2CCc3ccc(Cl)cc32)C1 ZINC001366565660 1337701197 /nfs/dbraw/zinc/70/11/97/1337701197.db2.gz KPYDZBDOTGIZLJ-KDOFPFPSSA-N 1 3 349.906 2.717 10 0 EFAEHO CC(C)c1ccccc1CN(C)CCNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001366586562 1337724131 /nfs/dbraw/zinc/72/41/31/1337724131.db2.gz SUJVFWPOKCMGSN-QGZVFWFLSA-N 1 3 331.504 2.700 10 0 EFAEHO CC(C)c1ccccc1CN(C)CCNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001366586562 1337724132 /nfs/dbraw/zinc/72/41/32/1337724132.db2.gz SUJVFWPOKCMGSN-QGZVFWFLSA-N 1 3 331.504 2.700 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C1CCC1)CC1CCC2(CC2)CC1 ZINC001366617015 1337756390 /nfs/dbraw/zinc/75/63/90/1337756390.db2.gz SBBIBEBSRAGYJX-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C1CCC1)CC1CCC2(CC2)CC1 ZINC001366617015 1337756391 /nfs/dbraw/zinc/75/63/91/1337756391.db2.gz SBBIBEBSRAGYJX-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@H+](CC)C[C@@H]1CCc2ccccc2C1)N(C)C ZINC001366626164 1337766720 /nfs/dbraw/zinc/76/67/20/1337766720.db2.gz AEKRPQJAWCRUCS-XLIONFOSSA-N 1 3 345.531 2.570 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@@H+](CC)C[C@@H]1CCc2ccccc2C1)N(C)C ZINC001366626164 1337766723 /nfs/dbraw/zinc/76/67/23/1337766723.db2.gz AEKRPQJAWCRUCS-XLIONFOSSA-N 1 3 345.531 2.570 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@H+](CC)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001366630244 1337772473 /nfs/dbraw/zinc/77/24/73/1337772473.db2.gz UFMDQJHKDSOLHE-CABCVRRESA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@@H+](CC)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001366630244 1337772477 /nfs/dbraw/zinc/77/24/77/1337772477.db2.gz UFMDQJHKDSOLHE-CABCVRRESA-N 1 3 333.467 2.590 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CCC[C@H]2CCC[N@@H+]21)Cc1ccccc1 ZINC001366633029 1337776172 /nfs/dbraw/zinc/77/61/72/1337776172.db2.gz GXWGHONFWZWODD-RBUKOAKNSA-N 1 3 329.488 2.642 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CCC[C@H]2CCC[N@H+]21)Cc1ccccc1 ZINC001366633029 1337776174 /nfs/dbraw/zinc/77/61/74/1337776174.db2.gz GXWGHONFWZWODD-RBUKOAKNSA-N 1 3 329.488 2.642 10 0 EFAEHO CCN(CCNC(=O)C12CC[NH+](CC1)C2)[C@H](C)c1cccc(Cl)c1 ZINC001366637828 1337783782 /nfs/dbraw/zinc/78/37/82/1337783782.db2.gz HSZWPYXYGLPYIP-OAHLLOKOSA-N 1 3 349.906 2.935 10 0 EFAEHO CC[N@H+](CCNC(=O)Cc1nc[nH]c1C)CC[C@H]1CCCC1(F)F ZINC001366641662 1337788831 /nfs/dbraw/zinc/78/88/31/1337788831.db2.gz QRYUTOMJXJGAFX-CQSZACIVSA-N 1 3 342.434 2.524 10 0 EFAEHO CC[N@@H+](CCNC(=O)Cc1nc[nH]c1C)CC[C@H]1CCCC1(F)F ZINC001366641662 1337788833 /nfs/dbraw/zinc/78/88/33/1337788833.db2.gz QRYUTOMJXJGAFX-CQSZACIVSA-N 1 3 342.434 2.524 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@@H](CNC(=O)C(C)(C)N3CCCC3)C2)c1 ZINC001366700049 1337888472 /nfs/dbraw/zinc/88/84/72/1337888472.db2.gz OOSDYAKUFUCXTR-IBGZPJMESA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@@H](CNC(=O)C(C)(C)N3CCCC3)C2)c1 ZINC001366700049 1337888476 /nfs/dbraw/zinc/88/84/76/1337888476.db2.gz OOSDYAKUFUCXTR-IBGZPJMESA-N 1 3 343.515 2.808 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@H+](Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001366703609 1337895819 /nfs/dbraw/zinc/89/58/19/1337895819.db2.gz GIVKRQGDAKHYOO-AZUAARDMSA-N 1 3 345.531 2.890 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@@H+](Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001366703609 1337895825 /nfs/dbraw/zinc/89/58/25/1337895825.db2.gz GIVKRQGDAKHYOO-AZUAARDMSA-N 1 3 345.531 2.890 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+]([C@@H](C)c2ccc(F)cc2)C1 ZINC001366710751 1337905804 /nfs/dbraw/zinc/90/58/04/1337905804.db2.gz KLUKCWZPXKUJHR-HOTGVXAUSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+]([C@@H](C)c2ccc(F)cc2)C1 ZINC001366710751 1337905805 /nfs/dbraw/zinc/90/58/05/1337905805.db2.gz KLUKCWZPXKUJHR-HOTGVXAUSA-N 1 3 335.467 2.665 10 0 EFAEHO CCC[N@H+](CCNC(=O)[C@H](CC)N(C)C)[C@@H]1CCc2ccccc21 ZINC001366730565 1337937017 /nfs/dbraw/zinc/93/70/17/1337937017.db2.gz BPYUZRPASKNXOF-RBUKOAKNSA-N 1 3 331.504 2.842 10 0 EFAEHO CCC[N@@H+](CCNC(=O)[C@H](CC)N(C)C)[C@@H]1CCc2ccccc21 ZINC001366730565 1337937021 /nfs/dbraw/zinc/93/70/21/1337937021.db2.gz BPYUZRPASKNXOF-RBUKOAKNSA-N 1 3 331.504 2.842 10 0 EFAEHO C[NH+](C)CCC(=O)NCCN(C1CC1)[C@@H]1CCCc2ccc(F)cc21 ZINC001366751865 1337967181 /nfs/dbraw/zinc/96/71/81/1337967181.db2.gz OWFWCVIJKXMGGJ-LJQANCHMSA-N 1 3 347.478 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001366848384 1338113636 /nfs/dbraw/zinc/11/36/36/1338113636.db2.gz DIUVARLLAPVSPA-QGZVFWFLSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001366848384 1338113640 /nfs/dbraw/zinc/11/36/40/1338113640.db2.gz DIUVARLLAPVSPA-QGZVFWFLSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)cc1C ZINC001366849450 1338115802 /nfs/dbraw/zinc/11/58/02/1338115802.db2.gz GWRNYFSDSRTTHC-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)cc1C ZINC001366849450 1338115806 /nfs/dbraw/zinc/11/58/06/1338115806.db2.gz GWRNYFSDSRTTHC-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2ccc(C)c(F)c2)C1)N(C)C ZINC001366850336 1338117173 /nfs/dbraw/zinc/11/71/73/1338117173.db2.gz HBEKWTRWBROHAG-VQIMIIECSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2ccc(C)c(F)c2)C1)N(C)C ZINC001366850336 1338117175 /nfs/dbraw/zinc/11/71/75/1338117175.db2.gz HBEKWTRWBROHAG-VQIMIIECSA-N 1 3 349.494 2.803 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](C[N@H+](C)CCC2CCCCC2)C1 ZINC001366895815 1338179345 /nfs/dbraw/zinc/17/93/45/1338179345.db2.gz AGFMTXNNTOYYEH-OALUTQOASA-N 1 3 335.536 2.831 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](C[N@@H+](C)CCC2CCCCC2)C1 ZINC001366895815 1338179353 /nfs/dbraw/zinc/17/93/53/1338179353.db2.gz AGFMTXNNTOYYEH-OALUTQOASA-N 1 3 335.536 2.831 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](C[N@H+](C)CCC2CCCCC2)C1 ZINC001366895818 1338179871 /nfs/dbraw/zinc/17/98/71/1338179871.db2.gz AGFMTXNNTOYYEH-RTBURBONSA-N 1 3 335.536 2.831 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](C[N@@H+](C)CCC2CCCCC2)C1 ZINC001366895818 1338179874 /nfs/dbraw/zinc/17/98/74/1338179874.db2.gz AGFMTXNNTOYYEH-RTBURBONSA-N 1 3 335.536 2.831 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCC1CN(CCCc2ccsc2)C1 ZINC001366970769 1338230990 /nfs/dbraw/zinc/23/09/90/1338230990.db2.gz MJBICJXTNJJDLR-SFHVURJKSA-N 1 3 349.544 2.603 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCC1CN(CCCc2ccsc2)C1 ZINC001366970769 1338230996 /nfs/dbraw/zinc/23/09/96/1338230996.db2.gz MJBICJXTNJJDLR-SFHVURJKSA-N 1 3 349.544 2.603 10 0 EFAEHO CN(CC(=O)NCC1C[NH+](CC2CCC3(CC3)CC2)C1)CC(C)(C)C ZINC001366982548 1338241053 /nfs/dbraw/zinc/24/10/53/1338241053.db2.gz DBEIRVLCEIIUKY-UHFFFAOYSA-N 1 3 349.563 2.983 10 0 EFAEHO Cc1ccc(C)c([C@H](C)N2C[C@@H]3C[C@H]2CN3C(=O)CC[NH+](C)C)c1 ZINC001366997279 1338255496 /nfs/dbraw/zinc/25/54/96/1338255496.db2.gz SCGCWNQELXGTQM-BZSNNMDCSA-N 1 3 329.488 2.601 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H]1CC[N@H+](CC2CCC2)C1)N1CCCCC1 ZINC001367060547 1338329660 /nfs/dbraw/zinc/32/96/60/1338329660.db2.gz RHSAGVAHVMVOLJ-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H]1CC[N@@H+](CC2CCC2)C1)N1CCCCC1 ZINC001367060547 1338329663 /nfs/dbraw/zinc/32/96/63/1338329663.db2.gz RHSAGVAHVMVOLJ-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@@H]1CCN([C@H]2CCc3ccc(F)cc32)C1 ZINC001367072357 1338352703 /nfs/dbraw/zinc/35/27/03/1338352703.db2.gz KCFWBIRWOPEOLB-MJGOQNOKSA-N 1 3 347.478 2.688 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC)NCc1cc(C)ccc1F ZINC001367090011 1338375268 /nfs/dbraw/zinc/37/52/68/1338375268.db2.gz BCIHRIUCUMWXIG-JENIJYKNSA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC)NCc1cc(C)ccc1F ZINC001367090011 1338375273 /nfs/dbraw/zinc/37/52/73/1338375273.db2.gz BCIHRIUCUMWXIG-JENIJYKNSA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc(F)cc1C ZINC001367109599 1338396607 /nfs/dbraw/zinc/39/66/07/1338396607.db2.gz BXOVBSYAODCKQV-SFHVURJKSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001367147249 1338441660 /nfs/dbraw/zinc/44/16/60/1338441660.db2.gz DWLHNALFHGCNNN-CABCVRRESA-N 1 3 333.467 2.637 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1cc(C)sc1C ZINC001367147739 1338443117 /nfs/dbraw/zinc/44/31/17/1338443117.db2.gz FNHPGISSAGUWIU-INIZCTEOSA-N 1 3 325.522 2.690 10 0 EFAEHO CC[C@H](C(=O)N[C@](C)(C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001367202668 1338509403 /nfs/dbraw/zinc/50/94/03/1338509403.db2.gz YZEXBAGORVRSGG-IEBWSBKVSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@@H](C(=O)N[C@@](C)(C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001367202663 1338509654 /nfs/dbraw/zinc/50/96/54/1338509654.db2.gz YZEXBAGORVRSGG-HKUYNNGSSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@@H]([NH2+]C[C@H]1CCCN1C(=O)CN1CCCC1)c1ccc(F)cc1 ZINC001367225941 1338533863 /nfs/dbraw/zinc/53/38/63/1338533863.db2.gz JQEBBAJQIWZFRN-RTBURBONSA-N 1 3 347.478 2.953 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001367266270 1338565917 /nfs/dbraw/zinc/56/59/17/1338565917.db2.gz MMPLGJXWYCVJJQ-HNNXBMFYSA-N 1 3 349.494 2.850 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@@H](C)CNC(=O)CN(C)C(C)C)c(C)c1 ZINC001367287642 1338587141 /nfs/dbraw/zinc/58/71/41/1338587141.db2.gz LZGQPWYDKRQTSX-MRXNPFEDSA-N 1 3 333.520 2.794 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)[C@H](C(C)C)[NH+](C)C)c1 ZINC001367359535 1338655086 /nfs/dbraw/zinc/65/50/86/1338655086.db2.gz RTZDGLCDTVICAL-QAPCUYQASA-N 1 3 337.483 2.657 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)[C@H](C(C)C)[NH+](C)C)c1 ZINC001367359552 1338655603 /nfs/dbraw/zinc/65/56/03/1338655603.db2.gz RTZDGLCDTVICAL-YJBOKZPZSA-N 1 3 337.483 2.657 10 0 EFAEHO C[C@@H](C[NH2+]CC1CCC(F)(F)CC1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001367383908 1338679912 /nfs/dbraw/zinc/67/99/12/1338679912.db2.gz QKUSARIAGRSCRY-CABCVRRESA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(C(F)F)cc1)N(C)C ZINC001367395103 1338692224 /nfs/dbraw/zinc/69/22/24/1338692224.db2.gz HXPKDSYFDWVKNZ-XJKSGUPXSA-N 1 3 341.446 2.901 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([C@@H](C)[NH2+]Cc2ccsc2)C1 ZINC001367434227 1338735718 /nfs/dbraw/zinc/73/57/18/1338735718.db2.gz AXLKYVRXHKUJOZ-NVXWUHKLSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)[NH2+]CC1CC2(CCC2)C1 ZINC001367478917 1338778971 /nfs/dbraw/zinc/77/89/71/1338778971.db2.gz CQLFENKCPINEKQ-ZWKOTPCHSA-N 1 3 337.552 2.883 10 0 EFAEHO Cc1ccc(CN[C@@H](CNC(=O)CC[NH+](C)C)C(C)C)c(Cl)c1 ZINC001367486908 1338787138 /nfs/dbraw/zinc/78/71/38/1338787138.db2.gz ZIWVNYZHOVDGOM-KRWDZBQOSA-N 1 3 339.911 2.831 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccc2cc[nH]c2c1)C(C)C)N(C)C ZINC001367489815 1338789269 /nfs/dbraw/zinc/78/92/69/1338789269.db2.gz IOHYRJYZRMTIFA-RTBURBONSA-N 1 3 344.503 2.739 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@@H]2CCC[C@@H]3CCC[N@@H+]32)c1 ZINC001367540300 1338844913 /nfs/dbraw/zinc/84/49/13/1338844913.db2.gz GIMXFCWSTNRJDC-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@@H]2CCC[C@@H]3CCC[N@H+]32)c1 ZINC001367540300 1338844917 /nfs/dbraw/zinc/84/49/17/1338844917.db2.gz GIMXFCWSTNRJDC-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)C12CC[NH+](CC1)C2 ZINC001367544841 1338852005 /nfs/dbraw/zinc/85/20/05/1338852005.db2.gz GKEQWQNRXYSINW-SFHVURJKSA-N 1 3 347.478 2.763 10 0 EFAEHO CC(C)c1ccc(CN(C)CCN(C)C(=O)C23CC[NH+](CC2)C3)cc1 ZINC001367546139 1338854131 /nfs/dbraw/zinc/85/41/31/1338854131.db2.gz OCCNJJPXPGGLRZ-UHFFFAOYSA-N 1 3 343.515 2.796 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCc2ccc(Cl)cc21)C(=O)[C@@H]1CCCN1C ZINC001367647202 1338902586 /nfs/dbraw/zinc/90/25/86/1338902586.db2.gz XTRSPECIRYUGQN-MSOLQXFVSA-N 1 3 349.906 2.860 10 0 EFAEHO C[C@H](C[NH2+]CC1CCCCC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001367695740 1338935310 /nfs/dbraw/zinc/93/53/10/1338935310.db2.gz RXJYXLJGJIQMAO-BEFAXECRSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H](C)NC(=O)[C@H]1CCCCN1C(C)C ZINC001367757675 1338984643 /nfs/dbraw/zinc/98/46/43/1338984643.db2.gz WFJPZQPOTKCIDF-QFBILLFUSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@@H](C[NH2+]CC1CCCCC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001367760914 1338987741 /nfs/dbraw/zinc/98/77/41/1338987741.db2.gz RXJYXLJGJIQMAO-HNAYVOBHSA-N 1 3 341.515 2.874 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc2c(c1)CCC2 ZINC001367775937 1339000347 /nfs/dbraw/zinc/00/03/47/1339000347.db2.gz VUMNDBZKEHTJOI-OXJNMPFZSA-N 1 3 343.515 2.644 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1cc(F)ccc1C ZINC001367803271 1339023003 /nfs/dbraw/zinc/02/30/03/1339023003.db2.gz LYEAKYYPEDQTJB-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1cc(F)ccc1C ZINC001367803271 1339023005 /nfs/dbraw/zinc/02/30/05/1339023005.db2.gz LYEAKYYPEDQTJB-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](CN(C)CCc1ccccc1F)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001367834674 1339050656 /nfs/dbraw/zinc/05/06/56/1339050656.db2.gz NEJPTRGISCWELW-BQFCYCMXSA-N 1 3 349.494 2.535 10 0 EFAEHO C[C@@H](CN(C)CCc1ccccc1F)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001367834674 1339050659 /nfs/dbraw/zinc/05/06/59/1339050659.db2.gz NEJPTRGISCWELW-BQFCYCMXSA-N 1 3 349.494 2.535 10 0 EFAEHO C[C@H](CN(C)C/C=C/c1ccccc1)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001367839553 1339056843 /nfs/dbraw/zinc/05/68/43/1339056843.db2.gz YGYFYLAKJKUSIN-PYIXFSLNSA-N 1 3 343.515 2.867 10 0 EFAEHO C[C@H](CN(C)C/C=C/c1ccccc1)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001367839553 1339056848 /nfs/dbraw/zinc/05/68/48/1339056848.db2.gz YGYFYLAKJKUSIN-PYIXFSLNSA-N 1 3 343.515 2.867 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H](NC(=O)C(C)(C)N1CCCC1)C1CC1 ZINC001367897013 1339093398 /nfs/dbraw/zinc/09/33/98/1339093398.db2.gz COVGNVXRUDPVFI-LJQANCHMSA-N 1 3 343.515 2.854 10 0 EFAEHO C[C@H](C(=O)N[C@H](C[NH2+]Cc1ccccc1)C1CC1)N1CCCCCC1 ZINC001367910603 1339101870 /nfs/dbraw/zinc/10/18/70/1339101870.db2.gz IKVSTXMGDJRZNO-YLJYHZDGSA-N 1 3 343.515 2.936 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001367920168 1339108348 /nfs/dbraw/zinc/10/83/48/1339108348.db2.gz LIUBGACVVOBDHW-ROUUACIJSA-N 1 3 335.536 2.637 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]CCC(C)(C)C ZINC001367924473 1339111164 /nfs/dbraw/zinc/11/11/64/1339111164.db2.gz ABJVNGSQQOKAPV-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]Cc1ccc(F)cc1 ZINC001367926380 1339112197 /nfs/dbraw/zinc/11/21/97/1339112197.db2.gz GMVPYACIJOAUPU-HKUYNNGSSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCN1CC1CC2(CCC2)C1)[NH+]1CCCC1 ZINC001367980420 1339142045 /nfs/dbraw/zinc/14/20/45/1339142045.db2.gz STBXOMVYXBOYBT-MOPGFXCFSA-N 1 3 347.547 2.878 10 0 EFAEHO CCc1ccc(CNC2(CNC(=O)CC[C@@H]3CCC[N@@H+]3C)CC2)cc1 ZINC001368003353 1339152964 /nfs/dbraw/zinc/15/29/64/1339152964.db2.gz ONNAATXOCAAASX-IBGZPJMESA-N 1 3 343.515 2.862 10 0 EFAEHO CCc1ccc(CNC2(CNC(=O)CC[C@@H]3CCC[N@H+]3C)CC2)cc1 ZINC001368003353 1339152966 /nfs/dbraw/zinc/15/29/66/1339152966.db2.gz ONNAATXOCAAASX-IBGZPJMESA-N 1 3 343.515 2.862 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)CC[C@H]3CCC[N@H+]3C)CC2)c(C)s1 ZINC001368006707 1339154392 /nfs/dbraw/zinc/15/43/92/1339154392.db2.gz IYKHVKDLQDUXBU-QGZVFWFLSA-N 1 3 349.544 2.978 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)CC[C@H]3CCC[N@@H+]3C)CC2)c(C)s1 ZINC001368006707 1339154395 /nfs/dbraw/zinc/15/43/95/1339154395.db2.gz IYKHVKDLQDUXBU-QGZVFWFLSA-N 1 3 349.544 2.978 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H]2CC[N@H+](C[C@@H](C)CC)C2)CC1 ZINC001368044933 1339173856 /nfs/dbraw/zinc/17/38/56/1339173856.db2.gz NEPMYDGIEABLKU-PKOBYXMFSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H]2CC[N@@H+](C[C@@H](C)CC)C2)CC1 ZINC001368044933 1339173857 /nfs/dbraw/zinc/17/38/57/1339173857.db2.gz NEPMYDGIEABLKU-PKOBYXMFSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H]2CC[N@H+](C[C@H](C)CC)C2)CC1 ZINC001368044928 1339173907 /nfs/dbraw/zinc/17/39/07/1339173907.db2.gz NEPMYDGIEABLKU-MJGOQNOKSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H]2CC[N@@H+](C[C@H](C)CC)C2)CC1 ZINC001368044928 1339173908 /nfs/dbraw/zinc/17/39/08/1339173908.db2.gz NEPMYDGIEABLKU-MJGOQNOKSA-N 1 3 337.552 2.935 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCC(C)(C)C)CC1 ZINC001368058151 1339181474 /nfs/dbraw/zinc/18/14/74/1339181474.db2.gz VPFUFZYDBCVURZ-CALCHBBNSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001368063823 1339183526 /nfs/dbraw/zinc/18/35/26/1339183526.db2.gz MRXNZVZWSPTNKV-HXUWFJFHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001368063823 1339183529 /nfs/dbraw/zinc/18/35/29/1339183529.db2.gz MRXNZVZWSPTNKV-HXUWFJFHSA-N 1 3 337.552 2.935 10 0 EFAEHO COc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)cc1 ZINC001368102372 1339195261 /nfs/dbraw/zinc/19/52/61/1339195261.db2.gz GLDUWTMBZUJGCR-AEFFLSMTSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)cc1 ZINC001368102374 1339195305 /nfs/dbraw/zinc/19/53/05/1339195305.db2.gz GLDUWTMBZUJGCR-FUHWJXTLSA-N 1 3 347.503 2.505 10 0 EFAEHO CC[C@H](F)CN1CC[C@@]2(C1)CCCCN(C(=O)CCC[NH+](C)C)C2 ZINC001368141487 1339215036 /nfs/dbraw/zinc/21/50/36/1339215036.db2.gz MZQFOBYMBNECKW-PKOBYXMFSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[C@@H](C(=O)N[C@]1(C)CCN(Cc2ccccc2)C1)[NH+](CC)CC ZINC001368171886 1339234328 /nfs/dbraw/zinc/23/43/28/1339234328.db2.gz HSPITLOLDZJANY-AZUAARDMSA-N 1 3 331.504 2.888 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@@]2(C)CCN(C(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001368188947 1339244910 /nfs/dbraw/zinc/24/49/10/1339244910.db2.gz IQDAADGZTLANSK-TZIWHRDSSA-N 1 3 345.531 2.917 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2ccc(CF)cc2)C1)N(C)C ZINC001368192587 1339246670 /nfs/dbraw/zinc/24/66/70/1339246670.db2.gz WNJRJNYDUHCBGU-QUCCMNQESA-N 1 3 349.494 2.825 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@]2(C)CCN(C(=O)[C@@H](CC)N(C)C)C2)c1 ZINC001368193816 1339247448 /nfs/dbraw/zinc/24/74/48/1339247448.db2.gz FSGQGIGTDAEHCC-CTNGQTDRSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@@]2(C)CCN(C(=O)[C@@H](CC)N(C)C)C2)c1 ZINC001368193839 1339247652 /nfs/dbraw/zinc/24/76/52/1339247652.db2.gz FSGQGIGTDAEHCC-TZIWHRDSSA-N 1 3 345.531 2.917 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001368195244 1339248432 /nfs/dbraw/zinc/24/84/32/1339248432.db2.gz KDUNWAYRZQSGAE-QAPCUYQASA-N 1 3 329.504 2.541 10 0 EFAEHO CC[C@H](F)CN1CCC(C)(CNC(=O)CC[NH+]2CCCCC2)CC1 ZINC001368209548 1339257384 /nfs/dbraw/zinc/25/73/84/1339257384.db2.gz JYCDILRNXLCRDF-KRWDZBQOSA-N 1 3 341.515 2.829 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(Cl)cc1)C2 ZINC001368325616 1339298643 /nfs/dbraw/zinc/29/86/43/1339298643.db2.gz IIWAQJDBQGYTMQ-JQHSSLGASA-N 1 3 349.906 2.761 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)N[C@@H]1C[C@H]2C[C@@H](C1)N(C/C=C\Cl)C2 ZINC001368328036 1339300199 /nfs/dbraw/zinc/30/01/99/1339300199.db2.gz TYBWBWWSDPNORT-XTGNXVLSSA-N 1 3 339.911 2.584 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001368344927 1339309092 /nfs/dbraw/zinc/30/90/92/1339309092.db2.gz FSNNRTQPAXKZIF-FCGDIQPGSA-N 1 3 337.552 2.887 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]Cc2ccsc2)CC1 ZINC001368415153 1339347850 /nfs/dbraw/zinc/34/78/50/1339347850.db2.gz GDXQPCIDLWRPON-JCNLHEQBSA-N 1 3 337.533 2.853 10 0 EFAEHO CC(C)CCC[NH+]1CCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)CC1 ZINC001368422133 1339356109 /nfs/dbraw/zinc/35/61/09/1339356109.db2.gz JFWQNAAVWWXCOJ-GOSISDBHSA-N 1 3 335.536 2.689 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1([NH2+]CC2CCC(C)CC2)CCC1 ZINC001368487595 1339424183 /nfs/dbraw/zinc/42/41/83/1339424183.db2.gz QKJISMPWWCOTDJ-UHFFFAOYSA-N 1 3 332.492 2.715 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NCC1(NCc2ccsc2)CCC1 ZINC001368499037 1339437486 /nfs/dbraw/zinc/43/74/86/1339437486.db2.gz XASOWMXHVIGQLO-UHFFFAOYSA-N 1 3 335.517 2.753 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@H+](CCC(C)(C)C)CC1)N(C)C ZINC001368532915 1339470934 /nfs/dbraw/zinc/47/09/34/1339470934.db2.gz MEPYUYHMEPFZMC-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@@H+](CCC(C)(C)C)CC1)N(C)C ZINC001368532915 1339470935 /nfs/dbraw/zinc/47/09/35/1339470935.db2.gz MEPYUYHMEPFZMC-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CN(CCC[N@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@H]1CCCN1C ZINC001368550002 1339488363 /nfs/dbraw/zinc/48/83/63/1339488363.db2.gz VCFYTKVHLQTXMC-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO CN(CCC[N@@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@H]1CCCN1C ZINC001368550002 1339488366 /nfs/dbraw/zinc/48/83/66/1339488366.db2.gz VCFYTKVHLQTXMC-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@H+](C)C[C@H]1CCC(F)(F)C1)N(C)C ZINC001368550676 1339488497 /nfs/dbraw/zinc/48/84/97/1339488497.db2.gz WWPPWZRBTXJLKV-LSDHHAIUSA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@@H+](C)C[C@H]1CCC(F)(F)C1)N(C)C ZINC001368550676 1339488500 /nfs/dbraw/zinc/48/85/00/1339488500.db2.gz WWPPWZRBTXJLKV-LSDHHAIUSA-N 1 3 333.467 2.542 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[N@H+](C)CC2CC3(CCC3)C2)C1 ZINC001368560648 1339505552 /nfs/dbraw/zinc/50/55/52/1339505552.db2.gz YPICDZAAVKXXAZ-QGZVFWFLSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[N@@H+](C)CC2CC3(CCC3)C2)C1 ZINC001368560648 1339505554 /nfs/dbraw/zinc/50/55/54/1339505554.db2.gz YPICDZAAVKXXAZ-QGZVFWFLSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[N@H+](C)CC1CC2(CCC2)C1)N(C)C ZINC001368564653 1339511555 /nfs/dbraw/zinc/51/15/55/1339511555.db2.gz MDQMYGYNSOYPTP-SFHVURJKSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[N@@H+](C)CC1CC2(CCC2)C1)N(C)C ZINC001368564653 1339511559 /nfs/dbraw/zinc/51/15/59/1339511559.db2.gz MDQMYGYNSOYPTP-SFHVURJKSA-N 1 3 337.552 2.933 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+](C)CCCN(C)C(=O)CN(C)C(C)C ZINC001368566204 1339514008 /nfs/dbraw/zinc/51/40/08/1339514008.db2.gz JXXXTYDYLAEMSN-UHFFFAOYSA-N 1 3 337.483 2.755 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+](C)CCCN(C)C(=O)CN(C)C(C)C ZINC001368566204 1339514012 /nfs/dbraw/zinc/51/40/12/1339514012.db2.gz JXXXTYDYLAEMSN-UHFFFAOYSA-N 1 3 337.483 2.755 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2C[C@H]([NH2+]CCC3CCCCC3)C2)CCC1 ZINC001368576418 1339526325 /nfs/dbraw/zinc/52/63/25/1339526325.db2.gz ZJNOVZWMINWUMT-IYARVYRRSA-N 1 3 335.536 2.926 10 0 EFAEHO CCC1([NH2+]Cc2cccc(C)c2)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001368592266 1339538462 /nfs/dbraw/zinc/53/84/62/1339538462.db2.gz BLNVRZGBZGJHLW-UHFFFAOYSA-N 1 3 340.471 2.822 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@H]1C[C@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001368594328 1339540218 /nfs/dbraw/zinc/54/02/18/1339540218.db2.gz VPSPFURCZJTJDR-YKTARERQSA-N 1 3 341.515 2.729 10 0 EFAEHO CCC(CC)C[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN(C)C(C)C ZINC001368671161 1339583441 /nfs/dbraw/zinc/58/34/41/1339583441.db2.gz HEKDTZAYFODUHZ-AEFFLSMTSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C)([NH2+]Cc2ccc(CF)cc2)CC1 ZINC001368672150 1339584822 /nfs/dbraw/zinc/58/48/22/1339584822.db2.gz RESOTMDAOWGFSN-UHFFFAOYSA-N 1 3 349.494 2.967 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1CCN(Cc2ccsc2)CC1(C)C ZINC001368673503 1339587074 /nfs/dbraw/zinc/58/70/74/1339587074.db2.gz NLALPUPBLRFBAW-INIZCTEOSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)[NH2+]CC1(c2ccccc2)CCN(C(=O)CN(C)C(C)C)CC1 ZINC001368678899 1339594059 /nfs/dbraw/zinc/59/40/59/1339594059.db2.gz SKWBTLOZBMEZKB-UHFFFAOYSA-N 1 3 345.531 2.885 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CCC3CCCC3)CC[C@@H]2C1 ZINC001368735799 1339656221 /nfs/dbraw/zinc/65/62/21/1339656221.db2.gz MZVGMLDOYVVSOH-MOPGFXCFSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CCC3CCCC3)CC[C@@H]2C1 ZINC001368735799 1339656227 /nfs/dbraw/zinc/65/62/27/1339656227.db2.gz MZVGMLDOYVVSOH-MOPGFXCFSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CC3CCCCC3)CC[C@@H]2C1 ZINC001368737346 1339659846 /nfs/dbraw/zinc/65/98/46/1339659846.db2.gz XHXHANZHZAFEJF-MOPGFXCFSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CC3CCCCC3)CC[C@@H]2C1 ZINC001368737346 1339659852 /nfs/dbraw/zinc/65/98/52/1339659852.db2.gz XHXHANZHZAFEJF-MOPGFXCFSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCCCC[C@H]([NH2+]C/C=C/Cl)C1)N(C)C ZINC001368752234 1339676594 /nfs/dbraw/zinc/67/65/94/1339676594.db2.gz BTBLDSOPHCDZDE-CABXGAGESA-N 1 3 329.916 2.686 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCCCC[C@H]([NH2+]CCC(F)(F)F)C2)C1 ZINC001368764103 1339689766 /nfs/dbraw/zinc/68/97/66/1339689766.db2.gz YKJGOVOJZSSUOK-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCCCC[C@@H]([NH2+]CCC(F)(F)F)C2)C1 ZINC001368764124 1339690383 /nfs/dbraw/zinc/69/03/83/1339690383.db2.gz YKJGOVOJZSSUOK-HUUCEWRRSA-N 1 3 349.441 2.641 10 0 EFAEHO CC[C@H](F)C[N@H+](CC)CC1CCN(C(=O)[C@H](CC)N(C)C)CC1 ZINC001368774510 1339698855 /nfs/dbraw/zinc/69/88/55/1339698855.db2.gz DUFVPFTVQZOUQN-IRXDYDNUSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](F)C[N@@H+](CC)CC1CCN(C(=O)[C@H](CC)N(C)C)CC1 ZINC001368774510 1339698857 /nfs/dbraw/zinc/69/88/57/1339698857.db2.gz DUFVPFTVQZOUQN-IRXDYDNUSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccc(C3CC3)cc2)[C@@H]1C ZINC001368793238 1339723708 /nfs/dbraw/zinc/72/37/08/1339723708.db2.gz IMJSDAKPZGKTKN-UZLBHIALSA-N 1 3 343.515 2.985 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccc(C3CC3)cc2)[C@@H]1C ZINC001368793238 1339723712 /nfs/dbraw/zinc/72/37/12/1339723712.db2.gz IMJSDAKPZGKTKN-UZLBHIALSA-N 1 3 343.515 2.985 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)CN(C)CC(C)(C)C)C2)cc1 ZINC001368817663 1339757035 /nfs/dbraw/zinc/75/70/35/1339757035.db2.gz CBXMYAXCUXQMCE-UHFFFAOYSA-N 1 3 345.531 2.957 10 0 EFAEHO CC[C@H]([NH2+]CC1CC(NC(=O)CN(C)C(C)C)C1)c1ccccc1 ZINC001368826398 1339765644 /nfs/dbraw/zinc/76/56/44/1339765644.db2.gz VYYHVWYOHJGUHP-KVZIAJEVSA-N 1 3 331.504 2.962 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CCC2CC2)CC(C)(C)C1)N(C)C ZINC001368832260 1339773591 /nfs/dbraw/zinc/77/35/91/1339773591.db2.gz MDQUIQMUGGOUDN-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CCC2CC2)CC(C)(C)C1)N(C)C ZINC001368832260 1339773596 /nfs/dbraw/zinc/77/35/96/1339773596.db2.gz MDQUIQMUGGOUDN-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1ncccc1C[NH2+][C@H](C)[C@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001368845925 1339784490 /nfs/dbraw/zinc/78/44/90/1339784490.db2.gz BZXXDTCAUDFMQL-CVEARBPZSA-N 1 3 346.519 2.637 10 0 EFAEHO C[C@@H](NCc1ccccc1F)[C@@H](C)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001368857194 1339793626 /nfs/dbraw/zinc/79/36/26/1339793626.db2.gz BVAFFYKCELHWOL-HUUCEWRRSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001368902735 1339842084 /nfs/dbraw/zinc/84/20/84/1339842084.db2.gz VEJVBGXOMHHQFJ-NEPJUHHUSA-N 1 3 331.913 2.725 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CCC([NH2+]Cc2ncccc2C)CC1)N(C)C ZINC001368902261 1339843282 /nfs/dbraw/zinc/84/32/82/1339843282.db2.gz SIZCNYDBGCYDBG-FAFZWHIHSA-N 1 3 346.519 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC(C)(C)C[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001368923164 1339868712 /nfs/dbraw/zinc/86/87/12/1339868712.db2.gz DMWIINSYHPFFEL-OAHLLOKOSA-N 1 3 347.494 2.836 10 0 EFAEHO Cc1cc(CN2CC([C@H](C)NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c(C)s1 ZINC001369097212 1339913573 /nfs/dbraw/zinc/91/35/73/1339913573.db2.gz PNPTUQDKBZCAFG-HOCLYGCPSA-N 1 3 349.544 2.643 10 0 EFAEHO Cc1cc(CN2CC([C@H](C)NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c(C)s1 ZINC001369097212 1339913575 /nfs/dbraw/zinc/91/35/75/1339913575.db2.gz PNPTUQDKBZCAFG-HOCLYGCPSA-N 1 3 349.544 2.643 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@]2(C)C[N@H+](CC3CC(C)(C)C3)C[C@]2(C)C1 ZINC001369154864 1339948340 /nfs/dbraw/zinc/94/83/40/1339948340.db2.gz OSANOZQOVSSMGW-OYRHEFFESA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@]2(C)C[N@@H+](CC3CC(C)(C)C3)C[C@]2(C)C1 ZINC001369154864 1339948343 /nfs/dbraw/zinc/94/83/43/1339948343.db2.gz OSANOZQOVSSMGW-OYRHEFFESA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)(C(=O)NC[C@H]([NH2+]CCC1CCCC1)C1CC1)N1CCCC1 ZINC001370231940 1339978556 /nfs/dbraw/zinc/97/85/56/1339978556.db2.gz XHHYMHBVVWTDJR-SFHVURJKSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@H](N[C@H]1C[C@H](NC(=O)CC[C@@H]2CCC[N@@H+]2C)C1)c1ccccc1F ZINC001370486260 1340098363 /nfs/dbraw/zinc/09/83/63/1340098363.db2.gz UJFLXUBAIREJPD-QAETUUGQSA-N 1 3 347.478 2.998 10 0 EFAEHO C[C@H](N[C@H]1C[C@H](NC(=O)CC[C@@H]2CCC[N@H+]2C)C1)c1ccccc1F ZINC001370486260 1340098366 /nfs/dbraw/zinc/09/83/66/1340098366.db2.gz UJFLXUBAIREJPD-QAETUUGQSA-N 1 3 347.478 2.998 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2cccc3ccccc32)C1 ZINC001370564964 1340136491 /nfs/dbraw/zinc/13/64/91/1340136491.db2.gz ONFANCUTQMOKHT-WGSAOQKQSA-N 1 3 339.483 2.917 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](Cc2ccc(C)cc2)C1)N(C)C ZINC001370756005 1340200091 /nfs/dbraw/zinc/20/00/91/1340200091.db2.gz VXWDHUCECWCWQJ-RBUKOAKNSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccc(C)cc2)C1)N(C)C ZINC001370756005 1340200095 /nfs/dbraw/zinc/20/00/95/1340200095.db2.gz VXWDHUCECWCWQJ-RBUKOAKNSA-N 1 3 331.504 2.663 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)C1 ZINC001370776723 1340205285 /nfs/dbraw/zinc/20/52/85/1340205285.db2.gz BAJMLMDDHZYMMN-FXAWDEMLSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)C1 ZINC001370776723 1340205288 /nfs/dbraw/zinc/20/52/88/1340205288.db2.gz BAJMLMDDHZYMMN-FXAWDEMLSA-N 1 3 343.515 2.844 10 0 EFAEHO Cc1cccc(C)c1C[N@H+]1CCC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001370794521 1340212630 /nfs/dbraw/zinc/21/26/30/1340212630.db2.gz RUMIVFHWZBKLMA-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+]1CCC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001370794521 1340212631 /nfs/dbraw/zinc/21/26/31/1340212631.db2.gz RUMIVFHWZBKLMA-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(C[N@H+]2CCC[C@@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001370797047 1340213153 /nfs/dbraw/zinc/21/31/53/1340213153.db2.gz WLNQUWVFAYMDKS-IBGZPJMESA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccc(C[N@@H+]2CCC[C@@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001370797047 1340213155 /nfs/dbraw/zinc/21/31/55/1340213155.db2.gz WLNQUWVFAYMDKS-IBGZPJMESA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1cccc(CN2CCCC[C@@H]2CNC(=O)C[C@H]2CC[N@@H+](C)C2)c1 ZINC001370913223 1340280293 /nfs/dbraw/zinc/28/02/93/1340280293.db2.gz QTMSIOKLFSJXDT-WOJBJXKFSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1cccc(CN2CCCC[C@@H]2CNC(=O)C[C@H]2CC[N@H+](C)C2)c1 ZINC001370913223 1340280296 /nfs/dbraw/zinc/28/02/96/1340280296.db2.gz QTMSIOKLFSJXDT-WOJBJXKFSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1cccc(CN2CCCC[C@@H]2CNC(=O)C[C@@H]2CC[N@@H+](C)C2)c1 ZINC001370913217 1340280307 /nfs/dbraw/zinc/28/03/07/1340280307.db2.gz QTMSIOKLFSJXDT-VQTJNVASSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1cccc(CN2CCCC[C@@H]2CNC(=O)C[C@@H]2CC[N@H+](C)C2)c1 ZINC001370913217 1340280310 /nfs/dbraw/zinc/28/03/10/1340280310.db2.gz QTMSIOKLFSJXDT-VQTJNVASSA-N 1 3 343.515 2.808 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001371305059 1340486531 /nfs/dbraw/zinc/48/65/31/1340486531.db2.gz HCAWYFRHZCNZAT-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CC[C@H]1CCCC1(F)F ZINC001371305064 1340486665 /nfs/dbraw/zinc/48/66/65/1340486665.db2.gz HCAWYFRHZCNZAT-LSDHHAIUSA-N 1 3 345.478 2.781 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001371556101 1340643020 /nfs/dbraw/zinc/64/30/20/1340643020.db2.gz OLFKQTJOXHGENN-MSOLQXFVSA-N 1 3 331.504 2.895 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CC(C)(C)CC(C)(C)C1 ZINC001371603210 1340670297 /nfs/dbraw/zinc/67/02/97/1340670297.db2.gz YHZZQABLZNCCNR-INIZCTEOSA-N 1 3 340.556 2.726 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CC(C)(C)CC(C)(C)C1 ZINC001371603210 1340670300 /nfs/dbraw/zinc/67/03/00/1340670300.db2.gz YHZZQABLZNCCNR-INIZCTEOSA-N 1 3 340.556 2.726 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+][C@@H](C)c2cccc(F)c2)C1 ZINC001371622776 1340680930 /nfs/dbraw/zinc/68/09/30/1340680930.db2.gz VACIYPVLVLZGQS-JKSUJKDBSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+][C@H](C)c2cccc(F)c2)C1 ZINC001371622765 1340681073 /nfs/dbraw/zinc/68/10/73/1340681073.db2.gz VACIYPVLVLZGQS-HZPDHXFCSA-N 1 3 335.467 2.665 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001371828907 1340706273 /nfs/dbraw/zinc/70/62/73/1340706273.db2.gz FGMVLKUIRGMPHM-CRAIPNDOSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@H](C(=O)NCC[N@H+](C1CC1)[C@H]1CCc2ccccc21)N(C)C ZINC001372829839 1340824395 /nfs/dbraw/zinc/82/43/95/1340824395.db2.gz CVCCZXFPBZDOGX-MOPGFXCFSA-N 1 3 329.488 2.595 10 0 EFAEHO CC[C@H](C(=O)NCC[N@@H+](C1CC1)[C@H]1CCc2ccccc21)N(C)C ZINC001372829839 1340824401 /nfs/dbraw/zinc/82/44/01/1340824401.db2.gz CVCCZXFPBZDOGX-MOPGFXCFSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCN(CCc2cccs2)C2CC2)CC[N@@H+]1C ZINC001372858942 1340844957 /nfs/dbraw/zinc/84/49/57/1340844957.db2.gz GPIRREFWKNFYEO-HOTGVXAUSA-N 1 3 349.544 2.602 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCN(CCc2cccs2)C2CC2)CC[N@H+]1C ZINC001372858942 1340844963 /nfs/dbraw/zinc/84/49/63/1340844963.db2.gz GPIRREFWKNFYEO-HOTGVXAUSA-N 1 3 349.544 2.602 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@@H](CNC(=O)C1(N(C)C)CCC1)c1ccccc1 ZINC001373055634 1340886969 /nfs/dbraw/zinc/88/69/69/1340886969.db2.gz FCZSTFGIEWXKRK-WBVHZDCISA-N 1 3 335.467 2.666 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@H](CCNC(=O)CN2CC[C@H](C)C2)C1 ZINC001373220733 1340954202 /nfs/dbraw/zinc/95/42/02/1340954202.db2.gz CFRNRYSPRZMWRO-HKUYNNGSSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@H](CCNC(=O)CN2CC[C@H](C)C2)C1 ZINC001373220733 1340954203 /nfs/dbraw/zinc/95/42/03/1340954203.db2.gz CFRNRYSPRZMWRO-HKUYNNGSSA-N 1 3 343.515 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@H+](C/C=C\c2ccccc2)C1 ZINC001373245652 1340966029 /nfs/dbraw/zinc/96/60/29/1340966029.db2.gz KLPRWARQEAIZHD-ROFLEHJCSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@@H+](C/C=C\c2ccccc2)C1 ZINC001373245652 1340966030 /nfs/dbraw/zinc/96/60/30/1340966030.db2.gz KLPRWARQEAIZHD-ROFLEHJCSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(C[N@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001373250397 1340967038 /nfs/dbraw/zinc/96/70/38/1340967038.db2.gz ZGNHCVONUHVCCU-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001373250397 1340967039 /nfs/dbraw/zinc/96/70/39/1340967039.db2.gz ZGNHCVONUHVCCU-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N(C)[C@@H]1CC[N@H+](Cc2ccccc2C)C1 ZINC001373674524 1341093994 /nfs/dbraw/zinc/09/39/94/1341093994.db2.gz VSHKOXQFRHAQCV-MOPGFXCFSA-N 1 3 349.494 2.708 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2C)C1 ZINC001373674524 1341093995 /nfs/dbraw/zinc/09/39/95/1341093995.db2.gz VSHKOXQFRHAQCV-MOPGFXCFSA-N 1 3 349.494 2.708 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N1CC[C@H](N(C)C(=O)CC[NH+](C)C)C1 ZINC001373678039 1341095746 /nfs/dbraw/zinc/09/57/46/1341095746.db2.gz ANRIKLIVOLUMFZ-ROUUACIJSA-N 1 3 335.467 2.761 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](CC)[NH2+]Cc1csc(C)c1 ZINC001373762994 1341138597 /nfs/dbraw/zinc/13/85/97/1341138597.db2.gz VJDIIMZGCBAKFH-IRXDYDNUSA-N 1 3 337.533 2.915 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](CC)[NH2+]Cc1ccc(C)cc1 ZINC001373764141 1341138817 /nfs/dbraw/zinc/13/88/17/1341138817.db2.gz YZZOCJWEHNZWDH-OALUTQOASA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1c(C)cccc1Cl ZINC001373834983 1341167785 /nfs/dbraw/zinc/16/77/85/1341167785.db2.gz KRNCFNXSMWURFW-OAHLLOKOSA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@](C)(NC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001373895375 1341192919 /nfs/dbraw/zinc/19/29/19/1341192919.db2.gz CKCRTUMQSXTEMK-HXUWFJFHSA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@]1(C[NH2+]Cc2cccnc2)CCCC[C@H]1C ZINC001373902991 1341197068 /nfs/dbraw/zinc/19/70/68/1341197068.db2.gz MLPFUDCKJWNPCJ-YLJYHZDGSA-N 1 3 346.519 2.577 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)cc1 ZINC001373970361 1341264258 /nfs/dbraw/zinc/26/42/58/1341264258.db2.gz GDCLPHAWHYYZAB-LJQANCHMSA-N 1 3 331.504 2.670 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)C[NH2+]Cc1ccc(C2CC2)cc1 ZINC001374069722 1341360727 /nfs/dbraw/zinc/36/07/27/1341360727.db2.gz CFEDOKRVZRTICF-IRXDYDNUSA-N 1 3 343.515 2.748 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(CNC(=O)C(C)(C)N2CCCC2)CCCC1 ZINC001374166790 1341494501 /nfs/dbraw/zinc/49/45/01/1341494501.db2.gz TWSMDAIRCFCYRV-HNNXBMFYSA-N 1 3 327.488 2.628 10 0 EFAEHO C[C@H](C[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C(=O)CN(C)C1CCC1 ZINC001374231651 1341583475 /nfs/dbraw/zinc/58/34/75/1341583475.db2.gz FXXMRTQZJKVNPU-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001374276904 1341648090 /nfs/dbraw/zinc/64/80/90/1341648090.db2.gz BOGATCMQUTVRRP-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1c(C)cccc1Cl)N(C)C ZINC001374311560 1341699740 /nfs/dbraw/zinc/69/97/40/1341699740.db2.gz HMPASUDHEMHSLN-WMLDXEAASA-N 1 3 339.911 2.925 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001374325715 1341727345 /nfs/dbraw/zinc/72/73/45/1341727345.db2.gz DHBUEZUFGKBMAU-KSSFIOAISA-N 1 3 335.467 2.590 10 0 EFAEHO C[C@@H](C[NH2+][C@H]1CCCc2ccccc21)N(C)C(=O)CN1CCCC1 ZINC001374326491 1341728886 /nfs/dbraw/zinc/72/88/86/1341728886.db2.gz MPBQMUZNFCAYMY-LPHOPBHVSA-N 1 3 329.488 2.596 10 0 EFAEHO C[C@H](C[NH2+][C@H]1CCCc2ccccc21)N(C)C(=O)CN1CCCC1 ZINC001374326488 1341729261 /nfs/dbraw/zinc/72/92/61/1341729261.db2.gz MPBQMUZNFCAYMY-APWZRJJASA-N 1 3 329.488 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC001374327441 1341730661 /nfs/dbraw/zinc/73/06/61/1341730661.db2.gz JGZRNAOOYUWDKW-ZWKOTPCHSA-N 1 3 345.531 2.568 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)c1 ZINC001392237167 1355893472 /nfs/dbraw/zinc/89/34/72/1355893472.db2.gz OYKRLYHXZCXLQG-APWZRJJASA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)c1 ZINC001392237168 1355894122 /nfs/dbraw/zinc/89/41/22/1355894122.db2.gz OYKRLYHXZCXLQG-LPHOPBHVSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1C ZINC001374383376 1341832994 /nfs/dbraw/zinc/83/29/94/1341832994.db2.gz JNTMJNQVJSKSDP-AZUAARDMSA-N 1 3 345.531 2.970 10 0 EFAEHO CN(CCN(C)C(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1)Cc1ccccc1 ZINC001392316952 1355977484 /nfs/dbraw/zinc/97/74/84/1355977484.db2.gz YQSKZIJXKTWNEN-FQEVSTJZSA-N 1 3 349.494 2.789 10 0 EFAEHO CN(CCN(C)C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1)Cc1ccccc1 ZINC001392316952 1355977487 /nfs/dbraw/zinc/97/74/87/1355977487.db2.gz YQSKZIJXKTWNEN-FQEVSTJZSA-N 1 3 349.494 2.789 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)NCc1ccccc1F ZINC001374425775 1341907640 /nfs/dbraw/zinc/90/76/40/1341907640.db2.gz ZWFPOZYNDPLQTN-IEBWSBKVSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)NCc1ccccc1F ZINC001374425775 1341907642 /nfs/dbraw/zinc/90/76/42/1341907642.db2.gz ZWFPOZYNDPLQTN-IEBWSBKVSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CC[NH+](C)C)N[C@H](C)c1ccc(F)cc1F ZINC001374432580 1341914951 /nfs/dbraw/zinc/91/49/51/1341914951.db2.gz VOUUJTKVHJOQLV-CXAGYDPISA-N 1 3 341.446 2.708 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]C/C=C\c1ccccc1 ZINC001374433972 1341916459 /nfs/dbraw/zinc/91/64/59/1341916459.db2.gz NENABWQKIUCPTE-JZYQWKAOSA-N 1 3 343.515 2.772 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](CNC(=O)CN1CC[C@@H](C)C1)C(C)C ZINC001374434632 1341917628 /nfs/dbraw/zinc/91/76/28/1341917628.db2.gz WGCCWLGRDZATQK-APWZRJJASA-N 1 3 331.504 2.567 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NCc1sccc1Cl ZINC001374444543 1341929345 /nfs/dbraw/zinc/92/93/45/1341929345.db2.gz AFUNGMCPHACVLW-OCCSQVGLSA-N 1 3 343.924 2.584 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NCc1sccc1Cl ZINC001374444543 1341929347 /nfs/dbraw/zinc/92/93/47/1341929347.db2.gz AFUNGMCPHACVLW-OCCSQVGLSA-N 1 3 343.924 2.584 10 0 EFAEHO CN(CC[N@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1CCCN1C ZINC001374471155 1341950550 /nfs/dbraw/zinc/95/05/50/1341950550.db2.gz JRASMWUKGWZGEW-IBGZPJMESA-N 1 3 329.488 2.548 10 0 EFAEHO CN(CC[N@@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1CCCN1C ZINC001374471155 1341950552 /nfs/dbraw/zinc/95/05/52/1341950552.db2.gz JRASMWUKGWZGEW-IBGZPJMESA-N 1 3 329.488 2.548 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)C[N@@H+]2CC[C@@H](C)C2)c(Cl)c1 ZINC001392589850 1356141630 /nfs/dbraw/zinc/14/16/30/1356141630.db2.gz FICMRTPWGATEKB-CABCVRRESA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)C[N@H+]2CC[C@@H](C)C2)c(Cl)c1 ZINC001392589850 1356141631 /nfs/dbraw/zinc/14/16/31/1356141631.db2.gz FICMRTPWGATEKB-CABCVRRESA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2CCC[C@H]3CCC[N@@H+]32)cc1 ZINC001374544422 1342048568 /nfs/dbraw/zinc/04/85/68/1342048568.db2.gz HGQPBSYRWSIICM-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2CCC[C@H]3CCC[N@H+]32)cc1 ZINC001374544422 1342048571 /nfs/dbraw/zinc/04/85/71/1342048571.db2.gz HGQPBSYRWSIICM-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H]2CCC[C@H]2NC(=O)CN(C)C(C)C)cs1 ZINC001374565327 1342078266 /nfs/dbraw/zinc/07/82/66/1342078266.db2.gz BZQLSNYGBYPQRV-IAGOWNOFSA-N 1 3 337.533 2.771 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H]2CCC[C@@H]2NC(=O)CN(C)C(C)C)c1 ZINC001374569001 1342081393 /nfs/dbraw/zinc/08/13/93/1342081393.db2.gz KYFOKXGEQZFTTL-OALUTQOASA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]Cc1cccc(F)c1 ZINC001374569557 1342082458 /nfs/dbraw/zinc/08/24/58/1342082458.db2.gz MTODIVIXSIQSOX-SJLPKXTDSA-N 1 3 335.467 2.540 10 0 EFAEHO C[C@@H](CC[NH2+][C@@H]1CCc2ccccc21)NC(=O)C1(N(C)C)CCC1 ZINC001374691679 1342110755 /nfs/dbraw/zinc/11/07/55/1342110755.db2.gz FVLCUVPXEONPKK-MAUKXSAKSA-N 1 3 329.488 2.643 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+][C@H](C)c1ccc(F)c(Cl)c1)N(C)C ZINC001374776652 1342164984 /nfs/dbraw/zinc/16/49/84/1342164984.db2.gz ODQYDOPYGSUGCE-XHBSWPGZSA-N 1 3 343.874 2.975 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC001374815150 1342186691 /nfs/dbraw/zinc/18/66/91/1342186691.db2.gz VYYINUXHFCLAKP-OXQOHEQNSA-N 1 3 349.494 2.802 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+][C@H](C)c1ccc(F)c(Cl)c1 ZINC001374848881 1342204660 /nfs/dbraw/zinc/20/46/60/1342204660.db2.gz ISYSSFCYBDMABT-CHWSQXEVSA-N 1 3 343.874 2.975 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C(C)(C)C)cc1)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001375153109 1342469282 /nfs/dbraw/zinc/46/92/82/1342469282.db2.gz CFYRNLAQPNWUFQ-SJLPKXTDSA-N 1 3 345.531 2.872 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C(C)(C)C)cc1)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001375153109 1342469285 /nfs/dbraw/zinc/46/92/85/1342469285.db2.gz CFYRNLAQPNWUFQ-SJLPKXTDSA-N 1 3 345.531 2.872 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)Cc1ccc(Cl)cc1 ZINC001375157319 1342474073 /nfs/dbraw/zinc/47/40/73/1342474073.db2.gz HSGDJKPJBQQNHT-AWEZNQCLSA-N 1 3 325.884 2.617 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001375157319 1342474076 /nfs/dbraw/zinc/47/40/76/1342474076.db2.gz HSGDJKPJBQQNHT-AWEZNQCLSA-N 1 3 325.884 2.617 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H](NC(=O)[C@H]1CCCN1C(C)C)C1CC1 ZINC001375226486 1342529167 /nfs/dbraw/zinc/52/91/67/1342529167.db2.gz WVEUDBPLEKKRQH-WOJBJXKFSA-N 1 3 343.515 2.852 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H](NC(=O)[C@H]1CCCN1C(C)C)C1CC1 ZINC001375226484 1342529456 /nfs/dbraw/zinc/52/94/56/1342529456.db2.gz WVEUDBPLEKKRQH-VQTJNVASSA-N 1 3 343.515 2.852 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccsc1 ZINC001393468099 1356868115 /nfs/dbraw/zinc/86/81/15/1356868115.db2.gz UJJGCIYZUKVSTG-SJORKVTESA-N 1 3 335.517 2.655 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@H]2CCCN2C(C)C)CC1 ZINC001393493524 1356895222 /nfs/dbraw/zinc/89/52/22/1356895222.db2.gz KXTTZAUDBGKSIF-TVFCKZIOSA-N 1 3 341.515 2.872 10 0 EFAEHO CCC1([NH2+]CC[C@@H](C)F)CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001393664138 1357060360 /nfs/dbraw/zinc/06/03/60/1357060360.db2.gz JRKINGADIFQSEF-OAHLLOKOSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+][C@H]2CCc3ccccc32)CC1 ZINC001375419941 1342724292 /nfs/dbraw/zinc/72/42/92/1342724292.db2.gz GFCNSMRSRIVFGI-RBUKOAKNSA-N 1 3 341.499 2.785 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC001375425823 1342729250 /nfs/dbraw/zinc/72/92/50/1342729250.db2.gz SSTKFJHQMAUVKE-GJZGRUSLSA-N 1 3 343.462 2.535 10 0 EFAEHO Cc1cccc(CNC2(CNC(=O)C34CCC[NH+](CCC3)C4)CC2)c1 ZINC001375435141 1342739507 /nfs/dbraw/zinc/73/95/07/1342739507.db2.gz GIMAVRJRZVTAHK-UHFFFAOYSA-N 1 3 341.499 2.609 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N(C)C[C@@H]1CCN1[C@@H]1CCc2ccccc21 ZINC001375463160 1342768851 /nfs/dbraw/zinc/76/88/51/1342768851.db2.gz BFWDJHWDXQILRO-AZUAARDMSA-N 1 3 343.515 2.939 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N(C)C[C@@H]1CCN1[C@@H]1CCc2ccccc21 ZINC001375463160 1342768855 /nfs/dbraw/zinc/76/88/55/1342768855.db2.gz BFWDJHWDXQILRO-AZUAARDMSA-N 1 3 343.515 2.939 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N(C)C[C@H]1CCN1[C@@H]1CCc2ccccc21 ZINC001375463170 1342769072 /nfs/dbraw/zinc/76/90/72/1342769072.db2.gz BFWDJHWDXQILRO-UYAOXDASSA-N 1 3 343.515 2.939 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N(C)C[C@H]1CCN1[C@@H]1CCc2ccccc21 ZINC001375463170 1342769075 /nfs/dbraw/zinc/76/90/75/1342769075.db2.gz BFWDJHWDXQILRO-UYAOXDASSA-N 1 3 343.515 2.939 10 0 EFAEHO C[C@H]([NH2+]C1(CNC(=O)CN2CC[C@H](C)C2)CC1)c1cccc(Cl)c1 ZINC001375490983 1342797234 /nfs/dbraw/zinc/79/72/34/1342797234.db2.gz NIBFAGRGBFRRFO-GJZGRUSLSA-N 1 3 349.906 2.981 10 0 EFAEHO C[C@H]([NH2+]C1(CNC(=O)CN2CC[C@@H](C)C2)CC1)c1cccc(Cl)c1 ZINC001375490979 1342797259 /nfs/dbraw/zinc/79/72/59/1342797259.db2.gz NIBFAGRGBFRRFO-CABCVRRESA-N 1 3 349.906 2.981 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2C[C@@H]([NH2+][C@H]3CCc4ccccc43)C2)CCC1 ZINC001375495201 1342801658 /nfs/dbraw/zinc/80/16/58/1342801658.db2.gz MUYDAAAUMPPDEQ-WDYCEAGBSA-N 1 3 341.499 2.643 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+][C@H]2CCCc3ccccc32)C1 ZINC001375508959 1342815911 /nfs/dbraw/zinc/81/59/11/1342815911.db2.gz CTOCPJXDTKDWSU-HQRMLTQVSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+]CC2CCCC2)CC1)N1CCCCC1 ZINC001375552940 1342867263 /nfs/dbraw/zinc/86/72/63/1342867263.db2.gz AXKUZNOBEYPJAT-SFHVURJKSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@@H]3C)CC2)cc1F ZINC001375554726 1342869582 /nfs/dbraw/zinc/86/95/82/1342869582.db2.gz QKTJSYYZYWALLK-IYBDPMFKSA-N 1 3 347.478 2.745 10 0 EFAEHO CC[C@H](C)C[N@@H+]1CC[C@@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001375571817 1342889173 /nfs/dbraw/zinc/88/91/73/1342889173.db2.gz IZAADKDQLGXBEG-PKOBYXMFSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@H](C)C[N@H+]1CC[C@@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001375571817 1342889177 /nfs/dbraw/zinc/88/91/77/1342889177.db2.gz IZAADKDQLGXBEG-PKOBYXMFSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1CC[C@@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001375571809 1342889306 /nfs/dbraw/zinc/88/93/06/1342889306.db2.gz IZAADKDQLGXBEG-IEBWSBKVSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@@H](C)C[N@H+]1CC[C@@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001375571809 1342889314 /nfs/dbraw/zinc/88/93/14/1342889314.db2.gz IZAADKDQLGXBEG-IEBWSBKVSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001375574775 1342893445 /nfs/dbraw/zinc/89/34/45/1342893445.db2.gz DDWUCSQTZDJUQD-HSTYYIRMSA-N 1 3 343.515 2.915 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccccc2)C1)N(C)C ZINC001375577210 1342896395 /nfs/dbraw/zinc/89/63/95/1342896395.db2.gz IVBOTYDMJYEYOJ-OTWHNJEPSA-N 1 3 331.504 2.647 10 0 EFAEHO C[C@H](F)CC[N@H+](CC1CC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001375595899 1342913815 /nfs/dbraw/zinc/91/38/15/1342913815.db2.gz PWXREYVJUNWGAQ-INIZCTEOSA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@H](F)CC[N@@H+](CC1CC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001375595899 1342913820 /nfs/dbraw/zinc/91/38/20/1342913820.db2.gz PWXREYVJUNWGAQ-INIZCTEOSA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CC[C@@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001375688901 1342929829 /nfs/dbraw/zinc/92/98/29/1342929829.db2.gz FMTBHRZFSYJJSP-HZPDHXFCSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CC[C@@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001375688901 1342929832 /nfs/dbraw/zinc/92/98/32/1342929832.db2.gz FMTBHRZFSYJJSP-HZPDHXFCSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@@H](F)CN1CC[C@H](NC(=O)C2(C[NH+](C)C)CC2)CC(C)(C)C1 ZINC001375691739 1342932576 /nfs/dbraw/zinc/93/25/76/1342932576.db2.gz YCDPBYYCRADSJP-CVEARBPZSA-N 1 3 341.515 2.683 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)c(C)n1 ZINC001375741386 1342967871 /nfs/dbraw/zinc/96/78/71/1342967871.db2.gz PZLJOWHBPXLFLQ-LPHOPBHVSA-N 1 3 346.519 2.508 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+][C@H]1CCCc2ccccc21 ZINC001375768037 1342989053 /nfs/dbraw/zinc/98/90/53/1342989053.db2.gz JAFFYELPYOYYEX-ICSRJNTNSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC2(C)CC[NH+](CC3CC(C)(C)C3)CC2)C1 ZINC001375777411 1342998612 /nfs/dbraw/zinc/99/86/12/1342998612.db2.gz CBMSFBLDELAOQE-INIZCTEOSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C[NH2+]CC1CC1)C1CCCC1 ZINC001375795053 1343023713 /nfs/dbraw/zinc/02/37/13/1343023713.db2.gz VKGDXZDHEXGFJI-MOPGFXCFSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@]1(C)CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001375852938 1343097657 /nfs/dbraw/zinc/09/76/57/1343097657.db2.gz YARVTPVXQOFIAR-OAQYLSRUSA-N 1 3 343.515 2.986 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@]1(C)CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001375852938 1343097664 /nfs/dbraw/zinc/09/76/64/1343097664.db2.gz YARVTPVXQOFIAR-OAQYLSRUSA-N 1 3 343.515 2.986 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(C)([NH2+]C/C=C/Cl)CC1 ZINC001393750344 1357124193 /nfs/dbraw/zinc/12/41/93/1357124193.db2.gz JHRABLGVNRGMCM-WGPYJDKQSA-N 1 3 327.900 2.584 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](CNC(=O)CN2CC[C@@H](C)C2)C2CC2)c1 ZINC001376250271 1343427808 /nfs/dbraw/zinc/42/78/08/1343427808.db2.gz GXSGVIPWPHKEDG-QRWLVFNGSA-N 1 3 343.515 2.630 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001376294627 1343463933 /nfs/dbraw/zinc/46/39/33/1343463933.db2.gz YZJZSYKPMOTGOV-SFHVURJKSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001376294627 1343463936 /nfs/dbraw/zinc/46/39/36/1343463936.db2.gz YZJZSYKPMOTGOV-SFHVURJKSA-N 1 3 325.541 2.933 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CCC1)C2)CC(C)(C)C ZINC001376314115 1343476967 /nfs/dbraw/zinc/47/69/67/1343476967.db2.gz NGSXYFSESMDEAW-BZSNNMDCSA-N 1 3 335.536 2.734 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CC1CCC1)C2)CC(C)(C)C ZINC001376314115 1343476969 /nfs/dbraw/zinc/47/69/69/1343476969.db2.gz NGSXYFSESMDEAW-BZSNNMDCSA-N 1 3 335.536 2.734 10 0 EFAEHO CN(CC(=O)N1CC[C@H]([NH2+]C[C@H]2CCC(F)(F)C2)C1)CC(C)(C)C ZINC001376333042 1343489985 /nfs/dbraw/zinc/48/99/85/1343489985.db2.gz SCCCZYTXNMBQMG-GJZGRUSLSA-N 1 3 345.478 2.590 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([C@H](C)[NH2+]CC2CC3(CCC3)C2)C1 ZINC001376350683 1343504888 /nfs/dbraw/zinc/50/48/88/1343504888.db2.gz UMCNUGYSGCZMNW-WMZOPIPTSA-N 1 3 335.536 2.735 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2C[C@@H](F)CC ZINC001376426004 1343581217 /nfs/dbraw/zinc/58/12/17/1343581217.db2.gz FNYZRFNBWLRMDQ-XYTVBORESA-N 1 3 327.488 2.578 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2C[C@@H](F)CC ZINC001376426004 1343581218 /nfs/dbraw/zinc/58/12/18/1343581218.db2.gz FNYZRFNBWLRMDQ-XYTVBORESA-N 1 3 327.488 2.578 10 0 EFAEHO CC[C@H]([NH2+][C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)C1)c1ccc(F)cc1 ZINC001376459133 1343608012 /nfs/dbraw/zinc/60/80/12/1343608012.db2.gz CMSFHVNCCAJJQX-KSZLIROESA-N 1 3 347.478 2.998 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001376477118 1343618143 /nfs/dbraw/zinc/61/81/43/1343618143.db2.gz RWHYYFKIYRTQFA-ITQYTPKQSA-N 1 3 347.503 2.579 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H]1C[C@@H](NC(=O)CN(C)CC(C)(C)C)C1 ZINC001376479779 1343619213 /nfs/dbraw/zinc/61/92/13/1343619213.db2.gz SZHPPXVQEBDSSN-KDURUIRLSA-N 1 3 345.531 2.964 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]C/C=C/c2ccc(Cl)cc2)C1)N(C)C ZINC001376480697 1343619275 /nfs/dbraw/zinc/61/92/75/1343619275.db2.gz VECXUUFQBJCEMO-UWBQZYMWSA-N 1 3 349.906 2.930 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001376492314 1343625071 /nfs/dbraw/zinc/62/50/71/1343625071.db2.gz UZWQTYQMPCZPGO-KANFNMMFSA-N 1 3 331.504 2.879 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(Cl)c2)C1 ZINC001376519586 1343645444 /nfs/dbraw/zinc/64/54/44/1343645444.db2.gz YYMUTOYLFZFPDA-RRQGHBQHSA-N 1 3 337.895 2.978 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2[C@H]1CC[N@@H+]2CC1CCC1)N(CC)CC ZINC001376521885 1343646557 /nfs/dbraw/zinc/64/65/57/1343646557.db2.gz XEXDIBJNKVQRSZ-CEXWTWQISA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2[C@H]1CC[N@H+]2CC1CCC1)N(CC)CC ZINC001376521885 1343646558 /nfs/dbraw/zinc/64/65/58/1343646558.db2.gz XEXDIBJNKVQRSZ-CEXWTWQISA-N 1 3 335.536 2.972 10 0 EFAEHO Cc1ccc(C[N@H+]2CCC[C@@H](CNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001376531168 1343656403 /nfs/dbraw/zinc/65/64/03/1343656403.db2.gz NBPACXWXDXMECE-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(C[N@@H+]2CCC[C@@H](CNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001376531168 1343656405 /nfs/dbraw/zinc/65/64/05/1343656405.db2.gz NBPACXWXDXMECE-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO C[C@H](NCCF)c1ccc(CNC(=O)C(C)(C)[NH+]2CCCC2)cc1 ZINC001376565107 1343681847 /nfs/dbraw/zinc/68/18/47/1343681847.db2.gz CBLUOVLGNUTRNB-HNNXBMFYSA-N 1 3 335.467 2.797 10 0 EFAEHO C[C@H]([NH2+]CC1CC1)c1ccc(CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001376577840 1343696231 /nfs/dbraw/zinc/69/62/31/1343696231.db2.gz SCYXENJNACZITB-CVEARBPZSA-N 1 3 329.488 2.705 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCC[N@@H+]1CCC1CC1)N1CCCC1 ZINC001376589238 1343706780 /nfs/dbraw/zinc/70/67/80/1343706780.db2.gz FZKUXXADJWKHFT-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCC[N@H+]1CCC1CC1)N1CCCC1 ZINC001376589238 1343706782 /nfs/dbraw/zinc/70/67/82/1343706782.db2.gz FZKUXXADJWKHFT-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCC[N@@H+]1CCC1CC1)N1CCCC1 ZINC001376589231 1343706948 /nfs/dbraw/zinc/70/69/48/1343706948.db2.gz FZKUXXADJWKHFT-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCC[N@H+]1CCC1CC1)N1CCCC1 ZINC001376589231 1343706949 /nfs/dbraw/zinc/70/69/49/1343706949.db2.gz FZKUXXADJWKHFT-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001376615198 1343722767 /nfs/dbraw/zinc/72/27/67/1343722767.db2.gz WBJGZEBPRSYVMJ-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C)C[NH+]1CCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)CC1 ZINC001376627086 1343733663 /nfs/dbraw/zinc/73/36/63/1343733663.db2.gz SNIZCKWNNFDATI-KRWDZBQOSA-N 1 3 337.552 2.935 10 0 EFAEHO CCC(CC)C[N@@H+]1CCC[C@@H]([C@@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001376629416 1343735667 /nfs/dbraw/zinc/73/56/67/1343735667.db2.gz SAMDNNWGYIRXRU-SJLPKXTDSA-N 1 3 325.541 2.980 10 0 EFAEHO CCC(CC)C[N@H+]1CCC[C@@H]([C@@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001376629416 1343735668 /nfs/dbraw/zinc/73/56/68/1343735668.db2.gz SAMDNNWGYIRXRU-SJLPKXTDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H](C)N1CCCCCC1 ZINC001376656553 1343747440 /nfs/dbraw/zinc/74/74/40/1343747440.db2.gz BPAHAVCWBJOTFG-WKWVNEEDSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H](C)N1CCCCCC1 ZINC001376656553 1343747451 /nfs/dbraw/zinc/74/74/51/1343747451.db2.gz BPAHAVCWBJOTFG-WKWVNEEDSA-N 1 3 349.563 2.980 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1CCC(NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001376675178 1343757951 /nfs/dbraw/zinc/75/79/51/1343757951.db2.gz WTGMMENAHAKJTJ-QQFBHYJXSA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)C[NH2+]C[C@H]1CCCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001376683580 1343762643 /nfs/dbraw/zinc/76/26/43/1343762643.db2.gz CFLJFEHQAQJJHR-VQIMIIECSA-N 1 3 341.515 2.826 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1C[NH2+]CC1CC2(CCC2)C1 ZINC001376710490 1343777528 /nfs/dbraw/zinc/77/75/28/1343777528.db2.gz XVXZMLBQUBYAFH-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1cc(C)sc1C ZINC001376731356 1343788879 /nfs/dbraw/zinc/78/88/79/1343788879.db2.gz NPQJDAFYTMJDNR-CXAGYDPISA-N 1 3 337.533 2.834 10 0 EFAEHO Cc1cncc(CN[C@@H](C)CNC(=O)C(C)(C)[N@H+](C)C2CCCC2)c1 ZINC001376764848 1343817490 /nfs/dbraw/zinc/81/74/90/1343817490.db2.gz XUTHHTROZDEGER-INIZCTEOSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1cncc(CN[C@@H](C)CNC(=O)C(C)(C)[N@@H+](C)C2CCCC2)c1 ZINC001376764848 1343817493 /nfs/dbraw/zinc/81/74/93/1343817493.db2.gz XUTHHTROZDEGER-INIZCTEOSA-N 1 3 346.519 2.637 10 0 EFAEHO CCC(CC)C[NH2+][C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001376797062 1343846471 /nfs/dbraw/zinc/84/64/71/1343846471.db2.gz DLHRPGCERRFGKD-KDOFPFPSSA-N 1 3 329.504 2.729 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]Cc2ccsc2)CCC1 ZINC001376814808 1343866241 /nfs/dbraw/zinc/86/62/41/1343866241.db2.gz BOGZLVADQZMMTN-GASCZTMLSA-N 1 3 335.517 2.749 10 0 EFAEHO CC(C)CC[N@@H+]1CCC[C@@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001376898101 1343937379 /nfs/dbraw/zinc/93/73/79/1343937379.db2.gz BCLMLUBVZBVKPN-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)CC[N@H+]1CCC[C@@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001376898101 1343937381 /nfs/dbraw/zinc/93/73/81/1343937381.db2.gz BCLMLUBVZBVKPN-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CN(CC(=O)N1CC[C@H]([NH2+]CC2CC3(CCC3)C2)C1)CC(C)(C)C ZINC001376912963 1343951147 /nfs/dbraw/zinc/95/11/47/1343951147.db2.gz TWFRGILVXOCCPL-KRWDZBQOSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001376943303 1343973996 /nfs/dbraw/zinc/97/39/96/1343973996.db2.gz RJBQSYWDNHSKAY-SJLPKXTDSA-N 1 3 341.515 2.922 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001376943303 1343973999 /nfs/dbraw/zinc/97/39/99/1343973999.db2.gz RJBQSYWDNHSKAY-SJLPKXTDSA-N 1 3 341.515 2.922 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001376943306 1343974378 /nfs/dbraw/zinc/97/43/78/1343974378.db2.gz RJBQSYWDNHSKAY-WMZOPIPTSA-N 1 3 341.515 2.922 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001376943306 1343974381 /nfs/dbraw/zinc/97/43/81/1343974381.db2.gz RJBQSYWDNHSKAY-WMZOPIPTSA-N 1 3 341.515 2.922 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001376952055 1343981453 /nfs/dbraw/zinc/98/14/53/1343981453.db2.gz DGDQNABEQCWOCV-SFHVURJKSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001376958342 1343988996 /nfs/dbraw/zinc/98/89/96/1343988996.db2.gz PXCMLEPVOCVFEY-ROUUACIJSA-N 1 3 331.504 2.834 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H]([N@H+](C)CCCC3CCC3)C2)C1 ZINC001376983602 1344016930 /nfs/dbraw/zinc/01/69/30/1344016930.db2.gz VJQCSTHJOPCVMM-IEBWSBKVSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H]([N@@H+](C)CCCC3CCC3)C2)C1 ZINC001376983602 1344016933 /nfs/dbraw/zinc/01/69/33/1344016933.db2.gz VJQCSTHJOPCVMM-IEBWSBKVSA-N 1 3 335.536 2.831 10 0 EFAEHO Cc1cccc([C@@H](C)[N@H+](C)CCCN(C)C(=O)CN2CCCC2)c1 ZINC001377016551 1344063191 /nfs/dbraw/zinc/06/31/91/1344063191.db2.gz FHWSZEZUWRQRFE-GOSISDBHSA-N 1 3 331.504 2.932 10 0 EFAEHO Cc1cccc([C@@H](C)[N@@H+](C)CCCN(C)C(=O)CN2CCCC2)c1 ZINC001377016551 1344063194 /nfs/dbraw/zinc/06/31/94/1344063194.db2.gz FHWSZEZUWRQRFE-GOSISDBHSA-N 1 3 331.504 2.932 10 0 EFAEHO CC(=O)N1C[C@H]2CC[C@@H](C1)[N@H+]2C1CCN(C[C@@H](C)CC(C)C)CC1 ZINC001377031752 1344077909 /nfs/dbraw/zinc/07/79/09/1344077909.db2.gz LATBFAPVWHYQQF-FFZOFVMBSA-N 1 3 335.536 2.828 10 0 EFAEHO CC(=O)N1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CCN(C[C@@H](C)CC(C)C)CC1 ZINC001377031752 1344077913 /nfs/dbraw/zinc/07/79/13/1344077913.db2.gz LATBFAPVWHYQQF-FFZOFVMBSA-N 1 3 335.536 2.828 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CCNC(=O)[C@@H]2CCCN2C)c(Cl)c1 ZINC001393797203 1357165674 /nfs/dbraw/zinc/16/56/74/1357165674.db2.gz LRBBBVXSHPYULA-YOEHRIQHSA-N 1 3 337.895 2.727 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@H+](C1CC1)[C@@H]1CCc2ccccc21)N(C)C ZINC001377563570 1344171923 /nfs/dbraw/zinc/17/19/23/1344171923.db2.gz CVCCZXFPBZDOGX-RBUKOAKNSA-N 1 3 329.488 2.595 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21)N(C)C ZINC001377563570 1344171928 /nfs/dbraw/zinc/17/19/28/1344171928.db2.gz CVCCZXFPBZDOGX-RBUKOAKNSA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1cccc(CN(CCNC(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)C2CC2)c1 ZINC001377572865 1344182949 /nfs/dbraw/zinc/18/29/49/1344182949.db2.gz YUIVTWKGRPNXTB-HDICACEKSA-N 1 3 343.515 2.948 10 0 EFAEHO Cc1cccc(CN(CCNC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)C2CC2)c1 ZINC001377572865 1344182954 /nfs/dbraw/zinc/18/29/54/1344182954.db2.gz YUIVTWKGRPNXTB-HDICACEKSA-N 1 3 343.515 2.948 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C[N@H+](CC)CC[C@H](C)F)CC1)N(C)C ZINC001377592848 1344200029 /nfs/dbraw/zinc/20/00/29/1344200029.db2.gz WCWIYYQYPPVKKD-DOTOQJQBSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C[N@@H+](CC)CC[C@H](C)F)CC1)N(C)C ZINC001377592848 1344200035 /nfs/dbraw/zinc/20/00/35/1344200035.db2.gz WCWIYYQYPPVKKD-DOTOQJQBSA-N 1 3 329.504 2.635 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+][C@@H]1CCc2ccccc21 ZINC001377606599 1344213059 /nfs/dbraw/zinc/21/30/59/1344213059.db2.gz YEGNXDYQPHUEAK-RTBURBONSA-N 1 3 329.488 2.596 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]([NH2+]CC2CCC2)c2ccccc2)C1 ZINC001377609976 1344217732 /nfs/dbraw/zinc/21/77/32/1344217732.db2.gz GOXPKMOUPYYYRS-VQIMIIECSA-N 1 3 329.488 2.575 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[N@H+](C)[C@H]1CCc2ccccc21 ZINC001377675725 1344305681 /nfs/dbraw/zinc/30/56/81/1344305681.db2.gz WTCFFQNNAYQRRF-QUCCMNQESA-N 1 3 343.515 2.939 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001377675725 1344305683 /nfs/dbraw/zinc/30/56/83/1344305683.db2.gz WTCFFQNNAYQRRF-QUCCMNQESA-N 1 3 343.515 2.939 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@H+](C)Cc1ccc(F)cc1 ZINC001377680250 1344313263 /nfs/dbraw/zinc/31/32/63/1344313263.db2.gz TVTKXJPGPPRTAL-SFHVURJKSA-N 1 3 335.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@@H+](C)Cc1ccc(F)cc1 ZINC001377680250 1344313266 /nfs/dbraw/zinc/31/32/66/1344313266.db2.gz TVTKXJPGPPRTAL-SFHVURJKSA-N 1 3 335.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@H+](C)CC1CC2(CCC2)C1 ZINC001377680182 1344313302 /nfs/dbraw/zinc/31/33/02/1344313302.db2.gz SVJMEVOUXWLRHV-SFHVURJKSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001377680182 1344313304 /nfs/dbraw/zinc/31/33/04/1344313304.db2.gz SVJMEVOUXWLRHV-SFHVURJKSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@@H]1CC[N@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001377691062 1344327393 /nfs/dbraw/zinc/32/73/93/1344327393.db2.gz AAXQYINZUNSTMA-AEFFLSMTSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@@H]1CC[N@@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001377691062 1344327398 /nfs/dbraw/zinc/32/73/98/1344327398.db2.gz AAXQYINZUNSTMA-AEFFLSMTSA-N 1 3 337.552 2.837 10 0 EFAEHO C[C@@H](CCNC(=O)CN(C)CC(C)(C)C)[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001393818520 1357182582 /nfs/dbraw/zinc/18/25/82/1357182582.db2.gz WDFRCHPHRKGBOF-LSDHHAIUSA-N 1 3 347.494 2.884 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H](C)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001377824658 1344481504 /nfs/dbraw/zinc/48/15/04/1344481504.db2.gz MPWNZDARTVCLLT-HOTGVXAUSA-N 1 3 331.504 2.716 10 0 EFAEHO C[C@@H](NCc1sccc1Cl)[C@@H](C)NC(=O)CCC[NH+](C)C ZINC001377838404 1344493759 /nfs/dbraw/zinc/49/37/59/1344493759.db2.gz JQDSKCHTUCLRMK-VXGBXAGGSA-N 1 3 331.913 2.726 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)[C@@H](C)NCc1cc(Cl)ccc1F ZINC001377869504 1344531019 /nfs/dbraw/zinc/53/10/19/1344531019.db2.gz IVROOYKEDCIXIP-CHWSQXEVSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)[C@@H](C)NCc1cc(Cl)ccc1F ZINC001377869504 1344531024 /nfs/dbraw/zinc/53/10/24/1344531024.db2.gz IVROOYKEDCIXIP-CHWSQXEVSA-N 1 3 343.874 2.804 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001377885574 1344547544 /nfs/dbraw/zinc/54/75/44/1344547544.db2.gz SRLNGGIJWDJFHB-LSDHHAIUSA-N 1 3 331.460 2.757 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)[C@H](C)NC(=O)C12CC[NH+](CC1)C2 ZINC001377888399 1344549664 /nfs/dbraw/zinc/54/96/64/1344549664.db2.gz YNLJSPSIFYYIJZ-CABCVRRESA-N 1 3 349.906 2.727 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001377915706 1344579661 /nfs/dbraw/zinc/57/96/61/1344579661.db2.gz RPSZGEOURYQMSN-CHWSQXEVSA-N 1 3 343.874 2.802 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]Cc1cccc(OC)c1 ZINC001393831005 1357194620 /nfs/dbraw/zinc/19/46/20/1357194620.db2.gz RDAJPEKCSITNHE-LPHOPBHVSA-N 1 3 347.503 2.554 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC(C)(C)CN(C)C(=O)[C@H]1CCCCN1CC ZINC001377980478 1344635134 /nfs/dbraw/zinc/63/51/34/1344635134.db2.gz WHNZSZUPSDEDOX-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[N@H+](C)CC1CC2(CCC2)C1 ZINC001378046723 1344698169 /nfs/dbraw/zinc/69/81/69/1344698169.db2.gz JVTIYUFGHREKTI-SJLPKXTDSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[N@@H+](C)CC1CC2(CCC2)C1 ZINC001378046723 1344698173 /nfs/dbraw/zinc/69/81/73/1344698173.db2.gz JVTIYUFGHREKTI-SJLPKXTDSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1cccc(F)c1 ZINC001378048259 1344700752 /nfs/dbraw/zinc/70/07/52/1344700752.db2.gz LWQMUWHNCPZYNG-YJBOKZPZSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1cccc(F)c1 ZINC001378048259 1344700755 /nfs/dbraw/zinc/70/07/55/1344700755.db2.gz LWQMUWHNCPZYNG-YJBOKZPZSA-N 1 3 335.467 2.635 10 0 EFAEHO Cc1cc(CN2CC[C@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c(C)s1 ZINC001378062660 1344714683 /nfs/dbraw/zinc/71/46/83/1344714683.db2.gz JPTGXUMOZMAZSF-ZWKOTPCHSA-N 1 3 349.544 2.930 10 0 EFAEHO Cc1cc(CN2CC[C@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c(C)s1 ZINC001378062660 1344714685 /nfs/dbraw/zinc/71/46/85/1344714685.db2.gz JPTGXUMOZMAZSF-ZWKOTPCHSA-N 1 3 349.544 2.930 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N1CCCC1 ZINC001378138111 1344802252 /nfs/dbraw/zinc/80/22/52/1344802252.db2.gz YCWVTGALXDJRDK-RTBURBONSA-N 1 3 347.547 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N1CCCC1 ZINC001378138111 1344802254 /nfs/dbraw/zinc/80/22/54/1344802254.db2.gz YCWVTGALXDJRDK-RTBURBONSA-N 1 3 347.547 2.878 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)NCc1cc2ccccc2o1 ZINC001378248538 1344929517 /nfs/dbraw/zinc/92/95/17/1344929517.db2.gz DTITYQHSZVOGGX-QGPMSJSTSA-N 1 3 343.471 2.757 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)NCc1cc2ccccc2o1 ZINC001378248538 1344929519 /nfs/dbraw/zinc/92/95/19/1344929519.db2.gz DTITYQHSZVOGGX-QGPMSJSTSA-N 1 3 343.471 2.757 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccc(OC)cc1 ZINC001378251799 1344931821 /nfs/dbraw/zinc/93/18/21/1344931821.db2.gz UQMZXGZITWTLCW-HKUYNNGSSA-N 1 3 347.503 2.552 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc(OC)cc1 ZINC001378288951 1344956961 /nfs/dbraw/zinc/95/69/61/1344956961.db2.gz OOMJBUMWOCTRPF-KRWDZBQOSA-N 1 3 347.503 2.554 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]CC1CC(F)(F)C1 ZINC001378297474 1344965252 /nfs/dbraw/zinc/96/52/52/1344965252.db2.gz PWYMCRXEVMFZSK-CVEARBPZSA-N 1 3 345.478 2.779 10 0 EFAEHO CC[C@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)NCc1sccc1Cl ZINC001378316689 1344980456 /nfs/dbraw/zinc/98/04/56/1344980456.db2.gz KVZPUNYAZTWQIO-CHWSQXEVSA-N 1 3 343.924 2.728 10 0 EFAEHO CC[C@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)NCc1sccc1Cl ZINC001378316689 1344980460 /nfs/dbraw/zinc/98/04/60/1344980460.db2.gz KVZPUNYAZTWQIO-CHWSQXEVSA-N 1 3 343.924 2.728 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCCN1CC)[NH2+]Cc1cc(C)ccc1F ZINC001378341492 1344998925 /nfs/dbraw/zinc/99/89/25/1344998925.db2.gz PCYYZIMVYCUVFI-HKUYNNGSSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@@H](C(=O)NC1(C[NH2+]CC2CC(F)(F)C2)CCCCC1)N(C)C ZINC001378403296 1345047856 /nfs/dbraw/zinc/04/78/56/1345047856.db2.gz UKLMUCWCXMVLLA-HNNXBMFYSA-N 1 3 345.478 2.781 10 0 EFAEHO Cc1cccnc1C[NH2+]CC1(NC(=O)CN(C)C(C)C)CCCCC1 ZINC001378414866 1345057443 /nfs/dbraw/zinc/05/74/43/1345057443.db2.gz GQFYYAUAWHGLRO-UHFFFAOYSA-N 1 3 346.519 2.639 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC1CC[NH+](CC[C@H](C)F)CC1)N(C)C ZINC001378475099 1345109467 /nfs/dbraw/zinc/10/94/67/1345109467.db2.gz VVRMGSJHUQSJIW-RDJZCZTQSA-N 1 3 329.504 2.539 10 0 EFAEHO CC[C@@H](C(=O)NCCC1CC[NH+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001378484411 1345116566 /nfs/dbraw/zinc/11/65/66/1345116566.db2.gz QCBIRUYRPZFSMR-SFHVURJKSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)C1C[NH+]([C@H]2CCc3ccccc32)C1 ZINC001378530516 1345144102 /nfs/dbraw/zinc/14/41/02/1345144102.db2.gz MDVZQDSFILZSOI-BEFAXECRSA-N 1 3 341.499 2.595 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+][C@@H]1CCc2ccccc21 ZINC001378582898 1345178557 /nfs/dbraw/zinc/17/85/57/1345178557.db2.gz CCKUCEUKDRNNNW-QFBILLFUSA-N 1 3 343.515 2.890 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@@H](C)C[NH2+]Cc1cc(C)ccc1F ZINC001378632911 1345211444 /nfs/dbraw/zinc/21/14/44/1345211444.db2.gz KOSZXALZFVEIMF-QFBILLFUSA-N 1 3 349.494 2.850 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@H+](CCC2CCCC2)CC1(C)C)N(C)C ZINC001378655228 1345228369 /nfs/dbraw/zinc/22/83/69/1345228369.db2.gz YDWDLKYDUXHZFT-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@@H+](CCC2CCCC2)CC1(C)C)N(C)C ZINC001378655228 1345228375 /nfs/dbraw/zinc/22/83/75/1345228375.db2.gz YDWDLKYDUXHZFT-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CCc1ccc(CN2C[C@@H](NC(=O)CC[N@@H+](C)CC)C(C)(C)C2)cc1 ZINC001378663580 1345235286 /nfs/dbraw/zinc/23/52/86/1345235286.db2.gz MKNQLABHKUWMHS-LJQANCHMSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccc(CN2C[C@@H](NC(=O)CC[N@H+](C)CC)C(C)(C)C2)cc1 ZINC001378663580 1345235290 /nfs/dbraw/zinc/23/52/90/1345235290.db2.gz MKNQLABHKUWMHS-LJQANCHMSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CC1CC(C)C1 ZINC001393871696 1357233129 /nfs/dbraw/zinc/23/31/29/1357233129.db2.gz RLGZZUOFLTUYIU-PBPAMDPTSA-N 1 3 343.515 2.745 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C1(CNC(=O)CN(C)C(C)C)CCCC1 ZINC001378720998 1345274539 /nfs/dbraw/zinc/27/45/39/1345274539.db2.gz VVSMAIYNLFBKRV-UHFFFAOYSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3CCCCCC3)C[C@H]21)N(C)C ZINC001378769166 1345302256 /nfs/dbraw/zinc/30/22/56/1345302256.db2.gz WKRVEPFLIUYDPQ-HAGHYFMRSA-N 1 3 349.563 2.981 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3CCCCCC3)C[C@H]21)N(C)C ZINC001378769166 1345302260 /nfs/dbraw/zinc/30/22/60/1345302260.db2.gz WKRVEPFLIUYDPQ-HAGHYFMRSA-N 1 3 349.563 2.981 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001378786724 1345316481 /nfs/dbraw/zinc/31/64/81/1345316481.db2.gz QGPNPVWJMFQWRG-IPMKNSEASA-N 1 3 337.552 2.980 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001378786724 1345316483 /nfs/dbraw/zinc/31/64/83/1345316483.db2.gz QGPNPVWJMFQWRG-IPMKNSEASA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C(=O)[C@H]1CCCN1C ZINC001378804115 1345326331 /nfs/dbraw/zinc/32/63/31/1345326331.db2.gz NVNSVYCLLHEXJH-HNAYVOBHSA-N 1 3 329.488 2.595 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001378835869 1345350644 /nfs/dbraw/zinc/35/06/44/1345350644.db2.gz XVEMYDZDKRXRKY-QCKOUHBKSA-N 1 3 348.318 2.664 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H](C)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001378828489 1345344886 /nfs/dbraw/zinc/34/48/86/1345344886.db2.gz KXAXIPXHSNDBHQ-QAPCUYQASA-N 1 3 331.504 2.582 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001378835869 1345350642 /nfs/dbraw/zinc/35/06/42/1345350642.db2.gz XVEMYDZDKRXRKY-QCKOUHBKSA-N 1 3 348.318 2.664 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H](C)C[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001378848676 1345361829 /nfs/dbraw/zinc/36/18/29/1345361829.db2.gz YTMCEOCHDHHBON-SJLPKXTDSA-N 1 3 337.552 2.980 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001378848833 1345361864 /nfs/dbraw/zinc/36/18/64/1345361864.db2.gz ZKBBWZAVDWORNM-VDGAXYAQSA-N 1 3 345.531 2.820 10 0 EFAEHO CC[C@@H]([NH2+]C[C@@H]1C[C@@H](NC(=O)[C@H](CC)N(C)C)C1)c1ccccc1 ZINC001378868933 1345378096 /nfs/dbraw/zinc/37/80/96/1345378096.db2.gz IZCCNLLSFJCENL-OWYHZJEWSA-N 1 3 331.504 2.962 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001378869454 1345378101 /nfs/dbraw/zinc/37/81/01/1345378101.db2.gz SCFITUVQSYDYSK-MISYRCLQSA-N 1 3 345.531 2.874 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](CC(C)C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001378886520 1345396223 /nfs/dbraw/zinc/39/62/23/1345396223.db2.gz XMRCWFQNKXGHEX-QUCCMNQESA-N 1 3 345.531 2.957 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CCc2ccccc2F)[C@@H](C)C1 ZINC001378894041 1345403746 /nfs/dbraw/zinc/40/37/46/1345403746.db2.gz FDENHBRUVFLWNT-LPHOPBHVSA-N 1 3 349.494 2.535 10 0 EFAEHO CN(Cc1ccccc1Cl)C1CCN(C(=O)CC[NH+](C)C)CC1 ZINC001378904961 1345413260 /nfs/dbraw/zinc/41/32/60/1345413260.db2.gz OJHKUTWDUFMIIT-UHFFFAOYSA-N 1 3 337.895 2.715 10 0 EFAEHO CC(C)CC[N@H+](C)C[C@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001393880568 1357246301 /nfs/dbraw/zinc/24/63/01/1357246301.db2.gz GPMZDPYDNPOCSB-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)CC[N@@H+](C)C[C@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001393880568 1357246303 /nfs/dbraw/zinc/24/63/03/1357246303.db2.gz GPMZDPYDNPOCSB-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]([NH2+]Cc1cc(C)ccc1F)C(C)C)N(C)C ZINC001378986506 1345481558 /nfs/dbraw/zinc/48/15/58/1345481558.db2.gz GUNWLTRSFPLDDB-ROUUACIJSA-N 1 3 337.483 2.705 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001379110807 1345588048 /nfs/dbraw/zinc/58/80/48/1345588048.db2.gz LIZTZLGVZYOQPU-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001379110807 1345588051 /nfs/dbraw/zinc/58/80/51/1345588051.db2.gz LIZTZLGVZYOQPU-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@@H](C)CN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001379152479 1345628877 /nfs/dbraw/zinc/62/88/77/1345628877.db2.gz WKGZAWDXNOCMDP-JKSUJKDBSA-N 1 3 347.503 2.677 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)c(C)s1 ZINC001379211360 1345661467 /nfs/dbraw/zinc/66/14/67/1345661467.db2.gz BXHBBOODPMWDEW-UONOGXRCSA-N 1 3 337.533 2.643 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CCC(C)(C)CC1 ZINC001379215939 1345663351 /nfs/dbraw/zinc/66/33/51/1345663351.db2.gz HUTFZXXYHBIOQX-SJORKVTESA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(C2CC2)cc1)N(C)C ZINC001379222629 1345667222 /nfs/dbraw/zinc/66/72/22/1345667222.db2.gz CANHJNHRZXDEKG-HNAYVOBHSA-N 1 3 331.504 2.841 10 0 EFAEHO CCN(CC[NH2+][C@@H](C)c1cccc(OC)c1)C(=O)C1(N(C)C)CCC1 ZINC001379305601 1345711656 /nfs/dbraw/zinc/71/16/56/1345711656.db2.gz PPACTKIWAMUSSG-INIZCTEOSA-N 1 3 347.503 2.679 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1sccc1Cl ZINC001379353750 1345744467 /nfs/dbraw/zinc/74/44/67/1345744467.db2.gz HOODQKXALFZLBY-OCCSQVGLSA-N 1 3 343.924 2.869 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1sccc1Cl ZINC001379353750 1345744470 /nfs/dbraw/zinc/74/44/70/1345744470.db2.gz HOODQKXALFZLBY-OCCSQVGLSA-N 1 3 343.924 2.869 10 0 EFAEHO Cc1ccncc1CNC[C@@H](C)NC(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001379381315 1345755861 /nfs/dbraw/zinc/75/58/61/1345755861.db2.gz KEOIPDYJSHIJFD-MRXNPFEDSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1ccncc1CNC[C@@H](C)NC(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001379381315 1345755864 /nfs/dbraw/zinc/75/58/64/1345755864.db2.gz KEOIPDYJSHIJFD-MRXNPFEDSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCCN2C(C)C)c(C)n1 ZINC001379432895 1345782828 /nfs/dbraw/zinc/78/28/28/1345782828.db2.gz LLQMVLTYGPYNAZ-VQIMIIECSA-N 1 3 346.519 2.556 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1sccc1Cl ZINC001379509874 1345818564 /nfs/dbraw/zinc/81/85/64/1345818564.db2.gz NMQBZTFHEKWPBD-JSGCOSHPSA-N 1 3 343.924 2.870 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1sccc1Cl ZINC001379509874 1345818569 /nfs/dbraw/zinc/81/85/69/1345818569.db2.gz NMQBZTFHEKWPBD-JSGCOSHPSA-N 1 3 343.924 2.870 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccccc2C2CC2)C[C@H]1C ZINC001379584041 1345890276 /nfs/dbraw/zinc/89/02/76/1345890276.db2.gz IBCGWJZKOBSJCD-APWZRJJASA-N 1 3 343.515 2.983 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](C)NC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001379583885 1345890482 /nfs/dbraw/zinc/89/04/82/1345890482.db2.gz WDQCQLHEUSIOFK-GJZGRUSLSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](C)NC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001379583885 1345890484 /nfs/dbraw/zinc/89/04/84/1345890484.db2.gz WDQCQLHEUSIOFK-GJZGRUSLSA-N 1 3 337.895 2.585 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1C[C@@H](C)N(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001379589713 1345898134 /nfs/dbraw/zinc/89/81/34/1345898134.db2.gz TVNRHJWJIOZMIM-VQIMIIECSA-N 1 3 331.504 2.987 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@H]([C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001393899927 1357269749 /nfs/dbraw/zinc/26/97/49/1357269749.db2.gz VOVLCXITHRNXMG-MOPGFXCFSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@H]([C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001393899927 1357269752 /nfs/dbraw/zinc/26/97/52/1357269752.db2.gz VOVLCXITHRNXMG-MOPGFXCFSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001418381097 1373962741 /nfs/dbraw/zinc/96/27/41/1373962741.db2.gz VGEVUQGBVMAWFW-SJORKVTESA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001418381097 1373962746 /nfs/dbraw/zinc/96/27/46/1373962746.db2.gz VGEVUQGBVMAWFW-SJORKVTESA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](CNC(=O)CC[NH+](C)C)N[C@H](C)c1ccccc1Cl ZINC001419222161 1374968721 /nfs/dbraw/zinc/96/87/21/1374968721.db2.gz OEZQQKFSPBIQHJ-KGLIPLIRSA-N 1 3 325.884 2.837 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H](C)[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001393966941 1357332538 /nfs/dbraw/zinc/33/25/38/1357332538.db2.gz WSOBMNULCRQDHN-CVEARBPZSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(F)cc1)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001379693332 1347263893 /nfs/dbraw/zinc/26/38/93/1347263893.db2.gz ROOVCMDHPMWWMY-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(F)cc1)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001379693332 1347263897 /nfs/dbraw/zinc/26/38/97/1347263897.db2.gz ROOVCMDHPMWWMY-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001379857486 1347373686 /nfs/dbraw/zinc/37/36/86/1347373686.db2.gz LRPRQWXQAUGSNH-RBUKOAKNSA-N 1 3 347.547 2.924 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1ccccc1Cl)C1CC1)N(C)C ZINC001379910760 1347401195 /nfs/dbraw/zinc/40/11/95/1347401195.db2.gz AMNNNSAAEIDFFY-IAGOWNOFSA-N 1 3 337.895 2.665 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]CCc1ccccc1 ZINC001379940851 1347415242 /nfs/dbraw/zinc/41/52/42/1347415242.db2.gz ORACUWFBPMFCOQ-WOJBJXKFSA-N 1 3 345.531 2.786 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](NC(=O)CN(C)C(C)C)C(C)(C)C)c(C)n1 ZINC001380097261 1347514231 /nfs/dbraw/zinc/51/42/31/1347514231.db2.gz XFUGNWQMCLAUSS-GOSISDBHSA-N 1 3 348.535 2.659 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]Cc2ccc(Cl)s2)C1 ZINC001380175550 1347549535 /nfs/dbraw/zinc/54/95/35/1347549535.db2.gz MXLVSZBAKOLPTE-UHFFFAOYSA-N 1 3 343.924 2.821 10 0 EFAEHO CC(C)c1cccc(CNC[C@H]2CCCN2C(=O)CCC[NH+](C)C)n1 ZINC001380284231 1347568454 /nfs/dbraw/zinc/56/84/54/1347568454.db2.gz YFEXCJLFRYLJRV-GOSISDBHSA-N 1 3 346.519 2.627 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H]2CCCN2C(=O)CCC[NH+](C)C)n1 ZINC001380284232 1347568502 /nfs/dbraw/zinc/56/85/02/1347568502.db2.gz YFEXCJLFRYLJRV-SFHVURJKSA-N 1 3 346.519 2.627 10 0 EFAEHO CN(CC(=O)NC1(C)CC[NH+](Cc2ccsc2)CC1)C1CCC1 ZINC001380294711 1347572976 /nfs/dbraw/zinc/57/29/76/1347572976.db2.gz NNKWLBSLFVLFOA-UHFFFAOYSA-N 1 3 335.517 2.703 10 0 EFAEHO CC(C)[NH+]1CCC(C)(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001380306105 1347580745 /nfs/dbraw/zinc/58/07/45/1347580745.db2.gz LQGXPBQIURASTL-GOSISDBHSA-N 1 3 327.488 2.578 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@](C)(C[NH2+]CC3CC(C)(C)C3)C2)C1 ZINC001380427082 1347664232 /nfs/dbraw/zinc/66/42/32/1347664232.db2.gz XTOKOSGHEPFFBX-OXQOHEQNSA-N 1 3 335.536 2.593 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@]1(C)CCC[N@H+](CC2CCC2)C1 ZINC001380472081 1347700244 /nfs/dbraw/zinc/70/02/44/1347700244.db2.gz OYIIRMSUWDIFAE-AZUAARDMSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@]1(C)CCC[N@@H+](CC2CCC2)C1 ZINC001380472081 1347700246 /nfs/dbraw/zinc/70/02/46/1347700246.db2.gz OYIIRMSUWDIFAE-AZUAARDMSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@]1(C)CCC[N@H+](CC2CCC2)C1 ZINC001380472092 1347700485 /nfs/dbraw/zinc/70/04/85/1347700485.db2.gz OYIIRMSUWDIFAE-QUCCMNQESA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@]1(C)CCC[N@@H+](CC2CCC2)C1 ZINC001380472092 1347700489 /nfs/dbraw/zinc/70/04/89/1347700489.db2.gz OYIIRMSUWDIFAE-QUCCMNQESA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)NC[C@]1(C)CCC[N@H+](CCC(C)(C)C)C1 ZINC001380482764 1347712625 /nfs/dbraw/zinc/71/26/25/1347712625.db2.gz LKIRMUAMBMLFPT-IBGZPJMESA-N 1 3 325.541 2.983 10 0 EFAEHO CCCN(C)CC(=O)NC[C@]1(C)CCC[N@@H+](CCC(C)(C)C)C1 ZINC001380482764 1347712626 /nfs/dbraw/zinc/71/26/26/1347712626.db2.gz LKIRMUAMBMLFPT-IBGZPJMESA-N 1 3 325.541 2.983 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[N@H+](CC2CCCC2)CCC1(F)F)N(C)C ZINC001380515032 1347735378 /nfs/dbraw/zinc/73/53/78/1347735378.db2.gz DXSUKYMEWGDMPR-JKSUJKDBSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[N@@H+](CC2CCCC2)CCC1(F)F)N(C)C ZINC001380515032 1347735382 /nfs/dbraw/zinc/73/53/82/1347735382.db2.gz DXSUKYMEWGDMPR-JKSUJKDBSA-N 1 3 345.478 2.590 10 0 EFAEHO CCN1CCC(F)(F)[C@H](CNC(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001380517418 1347737147 /nfs/dbraw/zinc/73/71/47/1347737147.db2.gz LLMDMXCRGVTISX-CQSZACIVSA-N 1 3 345.478 2.733 10 0 EFAEHO CCN1CCC(F)(F)[C@H](CNC(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001380517418 1347737150 /nfs/dbraw/zinc/73/71/50/1347737150.db2.gz LLMDMXCRGVTISX-CQSZACIVSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CCCC1)N(C)C ZINC001380677292 1347806801 /nfs/dbraw/zinc/80/68/01/1347806801.db2.gz AVTCSXSGMVJBGB-FCGDIQPGSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCCC1)N(C)C ZINC001380677292 1347806805 /nfs/dbraw/zinc/80/68/05/1347806805.db2.gz AVTCSXSGMVJBGB-FCGDIQPGSA-N 1 3 335.536 2.876 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2ccc(F)cc2C)C1 ZINC001380683462 1347811243 /nfs/dbraw/zinc/81/12/43/1347811243.db2.gz BQBKNGTXNJQGOF-AEFFLSMTSA-N 1 3 349.494 2.660 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001380683765 1347811393 /nfs/dbraw/zinc/81/13/93/1347811393.db2.gz VHWCAHGPKRGOMV-IEBWSBKVSA-N 1 3 331.504 2.662 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2CCC(F)(F)F ZINC001380754545 1347849877 /nfs/dbraw/zinc/84/98/77/1347849877.db2.gz ARORBSUOZKLDAV-GJZGRUSLSA-N 1 3 349.441 2.736 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2CCC(F)(F)F ZINC001380754545 1347849881 /nfs/dbraw/zinc/84/98/81/1347849881.db2.gz ARORBSUOZKLDAV-GJZGRUSLSA-N 1 3 349.441 2.736 10 0 EFAEHO CC[N@H+](C)Cc1ccccc1CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001380776740 1347866667 /nfs/dbraw/zinc/86/66/67/1347866667.db2.gz CSFHJDHUSXTMRM-HXUWFJFHSA-N 1 3 349.494 2.967 10 0 EFAEHO CC[N@@H+](C)Cc1ccccc1CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001380776740 1347866669 /nfs/dbraw/zinc/86/66/69/1347866669.db2.gz CSFHJDHUSXTMRM-HXUWFJFHSA-N 1 3 349.494 2.967 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](Cc1ccccc1C)CC2 ZINC001380803803 1347888559 /nfs/dbraw/zinc/88/85/59/1347888559.db2.gz NXWAZGLDBQOUTN-UHFFFAOYSA-N 1 3 343.515 2.761 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(NCc3ccsc3)CCC2)CC[N@@H+]1C ZINC001380877742 1347930814 /nfs/dbraw/zinc/93/08/14/1347930814.db2.gz NVPPMAAXMLOKQN-HOCLYGCPSA-N 1 3 335.517 2.607 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(NCc3ccsc3)CCC2)CC[N@H+]1C ZINC001380877742 1347930817 /nfs/dbraw/zinc/93/08/17/1347930817.db2.gz NVPPMAAXMLOKQN-HOCLYGCPSA-N 1 3 335.517 2.607 10 0 EFAEHO CN(CCC[N@H+](C)CCC1CC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001380964593 1347989921 /nfs/dbraw/zinc/98/99/21/1347989921.db2.gz MNWNDEVISONQNS-LJQANCHMSA-N 1 3 341.515 2.779 10 0 EFAEHO CN(CCC[N@@H+](C)CCC1CC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001380964593 1347989923 /nfs/dbraw/zinc/98/99/23/1347989923.db2.gz MNWNDEVISONQNS-LJQANCHMSA-N 1 3 341.515 2.779 10 0 EFAEHO CCc1ccccc1C[N@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001380978354 1347999353 /nfs/dbraw/zinc/99/93/53/1347999353.db2.gz BRAJGQFIDPBRIT-UHFFFAOYSA-N 1 3 331.504 2.625 10 0 EFAEHO CCc1ccccc1C[N@@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001380978354 1347999355 /nfs/dbraw/zinc/99/93/55/1347999355.db2.gz BRAJGQFIDPBRIT-UHFFFAOYSA-N 1 3 331.504 2.625 10 0 EFAEHO CCC(CC)C[NH2+]C1(C)CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001381127002 1348094351 /nfs/dbraw/zinc/09/43/51/1348094351.db2.gz BUSYKFRIHTXCQL-KRWDZBQOSA-N 1 3 325.541 2.980 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N2CCC(C)(NC/C(Cl)=C/Cl)CC2)C1 ZINC001381127859 1348095866 /nfs/dbraw/zinc/09/58/66/1348095866.db2.gz HLTWHNRQJXKKBM-JFBXQDQPSA-N 1 3 348.318 2.618 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N2CCC(C)(NC/C(Cl)=C/Cl)CC2)C1 ZINC001381127859 1348095869 /nfs/dbraw/zinc/09/58/69/1348095869.db2.gz HLTWHNRQJXKKBM-JFBXQDQPSA-N 1 3 348.318 2.618 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cs1 ZINC001381162949 1348113858 /nfs/dbraw/zinc/11/38/58/1348113858.db2.gz GIVPPLPZGIFNBR-YOEHRIQHSA-N 1 3 337.533 2.866 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cs1 ZINC001381162949 1348113861 /nfs/dbraw/zinc/11/38/61/1348113861.db2.gz GIVPPLPZGIFNBR-YOEHRIQHSA-N 1 3 337.533 2.866 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+][C@H]1CCc2ccc(F)cc21)N(C)C ZINC001381197431 1348134356 /nfs/dbraw/zinc/13/43/56/1348134356.db2.gz YAMDCNDVNMHCGY-DOPJRALCSA-N 1 3 335.467 2.638 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001381213399 1348143995 /nfs/dbraw/zinc/14/39/95/1348143995.db2.gz HCMNECIOJHFLJF-SJORKVTESA-N 1 3 331.504 2.575 10 0 EFAEHO CCCN(C)CC(=O)N1CCC2(CC1)CC[NH+](CC[C@H](C)F)CC2 ZINC001381242420 1348161349 /nfs/dbraw/zinc/16/13/49/1348161349.db2.gz RSFCTLUQUQBPED-KRWDZBQOSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[C@H](C)C[N@H+](CC)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001381252863 1348165060 /nfs/dbraw/zinc/16/50/60/1348165060.db2.gz AEOUEIUPRPBADJ-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C)C[N@@H+](CC)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001381252863 1348165061 /nfs/dbraw/zinc/16/50/61/1348165061.db2.gz AEOUEIUPRPBADJ-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC(C)(C)C[NH2+]Cc2ccsc2)CCC1 ZINC001394021476 1357392451 /nfs/dbraw/zinc/39/24/51/1357392451.db2.gz OEUOUNSYANQTJJ-UHFFFAOYSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H]2CC[N@H+](CCC3CC3)C2)C1 ZINC001381310673 1348204979 /nfs/dbraw/zinc/20/49/79/1348204979.db2.gz DRPPVZHBGOMCAQ-RBUKOAKNSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H]2CC[N@@H+](CCC3CC3)C2)C1 ZINC001381310673 1348204983 /nfs/dbraw/zinc/20/49/83/1348204983.db2.gz DRPPVZHBGOMCAQ-RBUKOAKNSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H]2CC[N@H+](CCC3CC3)C2)C1 ZINC001381310670 1348205188 /nfs/dbraw/zinc/20/51/88/1348205188.db2.gz DRPPVZHBGOMCAQ-OALUTQOASA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H]2CC[N@@H+](CCC3CC3)C2)C1 ZINC001381310670 1348205191 /nfs/dbraw/zinc/20/51/91/1348205191.db2.gz DRPPVZHBGOMCAQ-OALUTQOASA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+][C@@H]2CCCc3ccccc32)C1 ZINC001381340440 1348215657 /nfs/dbraw/zinc/21/56/57/1348215657.db2.gz HTIRLQDPZXWUSH-OUNSHVDWSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)[C@H](C(=O)NC1CC(C[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001381340176 1348215871 /nfs/dbraw/zinc/21/58/71/1348215871.db2.gz QYQWWOZRPCTALS-VMWRSERWSA-N 1 3 335.536 2.637 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001381390285 1348237172 /nfs/dbraw/zinc/23/71/72/1348237172.db2.gz MDCWQNREZQFZRX-CABCVRRESA-N 1 3 335.467 2.601 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]C/C=C\c1ccccc1 ZINC001381394967 1348240385 /nfs/dbraw/zinc/24/03/85/1348240385.db2.gz RNFICWVVUCULAI-BTDPBSJTSA-N 1 3 329.488 2.667 10 0 EFAEHO C[C@H](NCC=C(Cl)Cl)[C@H](C)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001381410544 1348252434 /nfs/dbraw/zinc/25/24/34/1348252434.db2.gz ZPBMHVJYEOLCGY-STQMWFEESA-N 1 3 348.318 2.664 10 0 EFAEHO CC[C@H](C)C[NH2+]CC(C)(C)CN(C)C(=O)[C@@H]1CCCCN1CC ZINC001381484174 1348304360 /nfs/dbraw/zinc/30/43/60/1348304360.db2.gz HLUAFBBRGHNKEV-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(C)c(F)c1 ZINC001381528206 1348332194 /nfs/dbraw/zinc/33/21/94/1348332194.db2.gz DTCIFKFYCWTSSF-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(C)c(F)c1 ZINC001381528206 1348332196 /nfs/dbraw/zinc/33/21/96/1348332196.db2.gz DTCIFKFYCWTSSF-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1C ZINC001381582024 1348377480 /nfs/dbraw/zinc/37/74/80/1348377480.db2.gz HYRYKHYOBLRIHG-QAPCUYQASA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1C ZINC001381582024 1348377484 /nfs/dbraw/zinc/37/74/84/1348377484.db2.gz HYRYKHYOBLRIHG-QAPCUYQASA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1C ZINC001381582026 1348377528 /nfs/dbraw/zinc/37/75/28/1348377528.db2.gz HYRYKHYOBLRIHG-YJBOKZPZSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1C ZINC001381582026 1348377529 /nfs/dbraw/zinc/37/75/29/1348377529.db2.gz HYRYKHYOBLRIHG-YJBOKZPZSA-N 1 3 331.504 2.582 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)[C@@H]3CCCCN3C(C)C)[C@@H]2C1 ZINC001381904383 1348598225 /nfs/dbraw/zinc/59/82/25/1348598225.db2.gz IROJDAVCHARYDW-HAGHYFMRSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)[C@@H]3CCCCN3C(C)C)[C@@H]2C1 ZINC001381904383 1348598227 /nfs/dbraw/zinc/59/82/27/1348598227.db2.gz IROJDAVCHARYDW-HAGHYFMRSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCCC(C)(C)C)C[C@H]21)N(C)C ZINC001381920514 1348605712 /nfs/dbraw/zinc/60/57/12/1348605712.db2.gz QNKGCUFLTUKPAI-ZJPYXAASSA-N 1 3 337.552 2.693 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCCC(C)(C)C)C[C@H]21)N(C)C ZINC001381920514 1348605715 /nfs/dbraw/zinc/60/57/15/1348605715.db2.gz QNKGCUFLTUKPAI-ZJPYXAASSA-N 1 3 337.552 2.693 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001381964224 1348628061 /nfs/dbraw/zinc/62/80/61/1348628061.db2.gz XBDHKYJMXLJZLT-BJLQDIEVSA-N 1 3 345.531 2.874 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1C ZINC001381966948 1348629534 /nfs/dbraw/zinc/62/95/34/1348629534.db2.gz OENHQSXMXNSLQP-VAMGGRTRSA-N 1 3 345.531 2.874 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccccc2Cl)C1)N(C)C ZINC001381971267 1348630932 /nfs/dbraw/zinc/63/09/32/1348630932.db2.gz NFQBBYZCRCCGMZ-FRFSOERESA-N 1 3 337.895 2.665 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2cccc(C(C)C)n2)C1)N(C)C ZINC001381974207 1348633054 /nfs/dbraw/zinc/63/30/54/1348633054.db2.gz UTIPGMHAAMXEPM-IEZWGBDMSA-N 1 3 346.519 2.530 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001382004509 1348654531 /nfs/dbraw/zinc/65/45/31/1348654531.db2.gz DQFJWZHFMPJQJK-UAPYVXQJSA-N 1 3 331.504 2.628 10 0 EFAEHO CCc1ccc(CC[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001382131427 1348752030 /nfs/dbraw/zinc/75/20/30/1348752030.db2.gz ZFPRCVNWACPODI-MSOLQXFVSA-N 1 3 345.531 2.570 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)CCC[NH+]2CCCC2)c1 ZINC001382165472 1348788041 /nfs/dbraw/zinc/78/80/41/1348788041.db2.gz LVBFXQCEYQURSO-QGZVFWFLSA-N 1 3 349.494 2.947 10 0 EFAEHO C[C@H]1[C@H]([NH2+]CCC(C)(C)C)CCN1C(=O)CN(C)CC(C)(C)C ZINC001382283152 1348844877 /nfs/dbraw/zinc/84/48/77/1348844877.db2.gz HDHXLNMWCYVFTF-JKSUJKDBSA-N 1 3 325.541 2.980 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)[C@@H]1C ZINC001382299701 1348852787 /nfs/dbraw/zinc/85/27/87/1348852787.db2.gz AQLCYYAYEIKJKT-APWZRJJASA-N 1 3 331.504 2.668 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)c1 ZINC001382310728 1348859868 /nfs/dbraw/zinc/85/98/68/1348859868.db2.gz JVKBGQWWNLSCAI-HKUYNNGSSA-N 1 3 331.504 2.723 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001382319291 1348866740 /nfs/dbraw/zinc/86/67/40/1348866740.db2.gz XGEAGPVSPWEJDB-HKUYNNGSSA-N 1 3 331.504 2.723 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[N@H+](C)CC1CCC2(CC2)CC1 ZINC001394069140 1357437399 /nfs/dbraw/zinc/43/73/99/1357437399.db2.gz BRIQYVZPXMJUJD-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001394069140 1357437403 /nfs/dbraw/zinc/43/74/03/1357437403.db2.gz BRIQYVZPXMJUJD-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(CC[N@H+](C)CCCF)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001382505468 1348972689 /nfs/dbraw/zinc/97/26/89/1348972689.db2.gz INLXJFRQPYZUDI-SFHVURJKSA-N 1 3 347.494 2.727 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CCCF)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001382505468 1348972692 /nfs/dbraw/zinc/97/26/92/1348972692.db2.gz INLXJFRQPYZUDI-SFHVURJKSA-N 1 3 347.494 2.727 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1ccccc1C)C(C)(C)C)N(C)C ZINC001382530564 1348995962 /nfs/dbraw/zinc/99/59/62/1348995962.db2.gz GROFBTCMLGQPHY-MSOLQXFVSA-N 1 3 333.520 2.956 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@@H](CNCc1ccccn1)C(C)(C)C ZINC001382538963 1349004578 /nfs/dbraw/zinc/00/45/78/1349004578.db2.gz YEPQPDQZYKPJCX-ROUUACIJSA-N 1 3 346.519 2.577 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@@H](CNCc1ccccn1)C(C)(C)C ZINC001382538963 1349004587 /nfs/dbraw/zinc/00/45/87/1349004587.db2.gz YEPQPDQZYKPJCX-ROUUACIJSA-N 1 3 346.519 2.577 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C[NH2+]CC1CC(C)(C)C1)C(C)(C)C)N(C)C ZINC001382542957 1349008969 /nfs/dbraw/zinc/00/89/69/1349008969.db2.gz VWLZIBTXDNNWTR-HOTGVXAUSA-N 1 3 325.541 2.883 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C)C1)C1CC[NH+](CC2CCCC2)CC1 ZINC001382561452 1349021627 /nfs/dbraw/zinc/02/16/27/1349021627.db2.gz RQXXULNDTBUTOX-IRXDYDNUSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@H](NC(=O)CCC[NH+](C)C)C1CCN(Cc2ccc(F)cc2)CC1 ZINC001382562223 1349022131 /nfs/dbraw/zinc/02/21/31/1349022131.db2.gz VZHFLSZVIMZFJC-INIZCTEOSA-N 1 3 349.494 2.884 10 0 EFAEHO CCc1cccc(C[NH2+]C2CC(N(C)C(=O)CN(C)C(C)C)C2)c1 ZINC001382588090 1349035983 /nfs/dbraw/zinc/03/59/83/1349035983.db2.gz CFHTZDNJLAFHBO-UHFFFAOYSA-N 1 3 331.504 2.668 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2cc(C)sc2C)C1)N(C)C ZINC001382589167 1349036573 /nfs/dbraw/zinc/03/65/73/1349036573.db2.gz LDFZYPQQOSRSDV-OFLPRAFFSA-N 1 3 337.533 2.784 10 0 EFAEHO C[C@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)N(C)CCc1ccccc1F ZINC001394079603 1357447746 /nfs/dbraw/zinc/44/77/46/1357447746.db2.gz UHRUVOBNNJYOBR-SJLPKXTDSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)N(C)CCc1ccccc1F ZINC001394079603 1357447749 /nfs/dbraw/zinc/44/77/49/1357447749.db2.gz UHRUVOBNNJYOBR-SJLPKXTDSA-N 1 3 349.494 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)Cc1ccccc1C1CC1 ZINC001394137344 1357519864 /nfs/dbraw/zinc/51/98/64/1357519864.db2.gz CLACVNJXQBGKJI-INIZCTEOSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)Cc1ccccc1C1CC1 ZINC001394137344 1357519868 /nfs/dbraw/zinc/51/98/68/1357519868.db2.gz CLACVNJXQBGKJI-INIZCTEOSA-N 1 3 331.504 2.841 10 0 EFAEHO CCCC[C@@H](CNCc1ccccc1F)NC(=O)C12CC[NH+](CC1)C2 ZINC001394202042 1357585631 /nfs/dbraw/zinc/58/56/31/1357585631.db2.gz IBRUWYYWDGCJJY-KRWDZBQOSA-N 1 3 347.478 2.686 10 0 EFAEHO CCCC[C@@H](CNCc1cc(C)ccc1F)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001394205638 1357592600 /nfs/dbraw/zinc/59/26/00/1357592600.db2.gz RBEBTERROQRWBO-WMZOPIPTSA-N 1 3 349.494 2.850 10 0 EFAEHO CCCC[C@@H](CNCc1cc(C)ccc1F)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001394205638 1357592607 /nfs/dbraw/zinc/59/26/07/1357592607.db2.gz RBEBTERROQRWBO-WMZOPIPTSA-N 1 3 349.494 2.850 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)C1C[NH+]([C@@H]2CCc3ccccc32)C1 ZINC001394226274 1357617700 /nfs/dbraw/zinc/61/77/00/1357617700.db2.gz KQILYIZWQKMBKD-MGPUTAFESA-N 1 3 341.499 2.595 10 0 EFAEHO Cc1ccc(C)c([C@H](C)N2CC[C@H]2CN(C)C(=O)CC[NH+](C)C)c1 ZINC001388651022 1352891150 /nfs/dbraw/zinc/89/11/50/1352891150.db2.gz WGNLLURQKKSRAX-ROUUACIJSA-N 1 3 331.504 2.849 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@@H]([NH2+]CC[C@H]2CCCC2(F)F)C1)N(C)C ZINC001388680721 1352915711 /nfs/dbraw/zinc/91/57/11/1352915711.db2.gz JCYJLBKRMIUYTG-LVQVYYBASA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CCC(F)(F)CC2)C1 ZINC001388702823 1352933313 /nfs/dbraw/zinc/93/33/13/1352933313.db2.gz KHKRHYLTEVACKX-IYBDPMFKSA-N 1 3 345.478 2.637 10 0 EFAEHO CN(CC(=O)NC[C@H]1C[C@H]([NH2+]CC2CC(C)(C)C2)C1)CC(C)(C)C ZINC001388724525 1352952682 /nfs/dbraw/zinc/95/26/82/1352952682.db2.gz HVQMSLAWKONYAS-JCNLHEQBSA-N 1 3 337.552 2.885 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1C[C@@H]([NH2+]CC2CC(C)(C)C2)C1)N1CCCC1 ZINC001388726518 1352954471 /nfs/dbraw/zinc/95/44/71/1352954471.db2.gz LUSYIHAGDOTWHK-JCNLHEQBSA-N 1 3 335.536 2.781 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)CN(C)C3CCC3)C2)c1 ZINC001388751082 1352977646 /nfs/dbraw/zinc/97/76/46/1352977646.db2.gz QROYQVMPKINLBI-RBUKOAKNSA-N 1 3 343.515 2.854 10 0 EFAEHO Cc1cccc(C)c1C[N@H+]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]1C ZINC001388799099 1353030334 /nfs/dbraw/zinc/03/03/34/1353030334.db2.gz MQHOPLXLUYOVKM-HOJAQTOUSA-N 1 3 345.531 2.969 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]1C ZINC001388799099 1353030342 /nfs/dbraw/zinc/03/03/42/1353030342.db2.gz MQHOPLXLUYOVKM-HOJAQTOUSA-N 1 3 345.531 2.969 10 0 EFAEHO Cc1ccc(CN2C[C@H](NC(=O)C3(C[NH+](C)C)CC3)C(C)(C)C2)cc1 ZINC001394290948 1357676688 /nfs/dbraw/zinc/67/66/88/1357676688.db2.gz VBIFDHQRYGFLGW-SFHVURJKSA-N 1 3 343.515 2.663 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N1CCC(N(C)C(=O)CC[NH+](C)C)CC1 ZINC001389325446 1353304293 /nfs/dbraw/zinc/30/42/93/1353304293.db2.gz GQDQJUBDKVJONV-OAHLLOKOSA-N 1 3 335.467 2.761 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@@H](C)[NH2+]Cc1ccsc1 ZINC001389326453 1353305205 /nfs/dbraw/zinc/30/52/05/1353305205.db2.gz SIWYJSBYDRRGBO-WBVHZDCISA-N 1 3 337.533 2.948 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC[NH+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001389329783 1353307381 /nfs/dbraw/zinc/30/73/81/1353307381.db2.gz GZKZPGVDIRSIKJ-GOSISDBHSA-N 1 3 335.536 2.830 10 0 EFAEHO Cc1ccc(CN2CC[C@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c(C)c1 ZINC001389462987 1353408366 /nfs/dbraw/zinc/40/83/66/1353408366.db2.gz QVMRNAOIFOYACW-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(CN2CC[C@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c(C)c1 ZINC001389462987 1353408367 /nfs/dbraw/zinc/40/83/67/1353408367.db2.gz QVMRNAOIFOYACW-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@H](NCc2ccccc2F)C2CC2)CC[N@@H+]1C ZINC001389665470 1353539597 /nfs/dbraw/zinc/53/95/97/1353539597.db2.gz UKWNYTAXXZDMEP-QOKNQOGYSA-N 1 3 347.478 2.540 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@H](NCc2ccccc2F)C2CC2)CC[N@H+]1C ZINC001389665470 1353539600 /nfs/dbraw/zinc/53/96/00/1353539600.db2.gz UKWNYTAXXZDMEP-QOKNQOGYSA-N 1 3 347.478 2.540 10 0 EFAEHO O=C([C@H]1CC[N@@H+](C2CCCCC2)C1)N1CC[C@H](NC/C=C\Cl)C1 ZINC001389781426 1353617463 /nfs/dbraw/zinc/61/74/63/1353617463.db2.gz LCPASIBPDLTCJV-HTSGCBEDSA-N 1 3 339.911 2.584 10 0 EFAEHO O=C([C@H]1CC[N@H+](C2CCCCC2)C1)N1CC[C@H](NC/C=C\Cl)C1 ZINC001389781426 1353617469 /nfs/dbraw/zinc/61/74/69/1353617469.db2.gz LCPASIBPDLTCJV-HTSGCBEDSA-N 1 3 339.911 2.584 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H]1C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001389956166 1353708388 /nfs/dbraw/zinc/70/83/88/1353708388.db2.gz GZYJDWMKDIPBDL-OTWHNJEPSA-N 1 3 331.504 2.572 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H](NCc2ccccc2F)C1)[NH+](CC)CC ZINC001389988253 1353727178 /nfs/dbraw/zinc/72/71/78/1353727178.db2.gz MCGFQHDUERICAS-SOLBZPMBSA-N 1 3 335.467 2.683 10 0 EFAEHO CCc1ccc(C[N@@H+]2CCC[C@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001390054691 1353770933 /nfs/dbraw/zinc/77/09/33/1353770933.db2.gz FAXDSDPLENMYLI-HXUWFJFHSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccc(C[N@H+]2CCC[C@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001390054691 1353770937 /nfs/dbraw/zinc/77/09/37/1353770937.db2.gz FAXDSDPLENMYLI-HXUWFJFHSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001390103658 1353808520 /nfs/dbraw/zinc/80/85/20/1353808520.db2.gz JFXMPLZDTHIGJE-FQEVSTJZSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@](F)(C(=O)NC[C@@H]2CCCCN2CCCF)C1 ZINC001390138314 1353849634 /nfs/dbraw/zinc/84/96/34/1353849634.db2.gz IEUOTQBJMBBFHK-MAUKXSAKSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)NC[C@@H]2CCCCN2CCCF)C1 ZINC001390138314 1353849637 /nfs/dbraw/zinc/84/96/37/1353849637.db2.gz IEUOTQBJMBBFHK-MAUKXSAKSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCC[N@@H+]1CCC(C)(C)C)N(C)C ZINC001390158135 1353872018 /nfs/dbraw/zinc/87/20/18/1353872018.db2.gz SCUZDYKFXMNLAB-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCC[N@H+]1CCC(C)(C)C)N(C)C ZINC001390158135 1353872022 /nfs/dbraw/zinc/87/20/22/1353872022.db2.gz SCUZDYKFXMNLAB-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CCC([NH2+]CC=C(Cl)Cl)CC1 ZINC001390270730 1353968841 /nfs/dbraw/zinc/96/88/41/1353968841.db2.gz BNARRULDXNMVOW-UHFFFAOYSA-N 1 3 336.307 2.663 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H]1CC[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001394699153 1358024604 /nfs/dbraw/zinc/02/46/04/1358024604.db2.gz CKHKHOCXYFWODD-LPHOPBHVSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H]1CC[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001394699154 1358024877 /nfs/dbraw/zinc/02/48/77/1358024877.db2.gz CKHKHOCXYFWODD-QFBILLFUSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001390359495 1354027230 /nfs/dbraw/zinc/02/72/30/1354027230.db2.gz JAIWTPVGNUWANB-HKUYNNGSSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001390359502 1354027498 /nfs/dbraw/zinc/02/74/98/1354027498.db2.gz JAIWTPVGNUWANB-MJGOQNOKSA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+][C@@H](C)c1ccc(F)cc1 ZINC001390453399 1354090730 /nfs/dbraw/zinc/09/07/30/1354090730.db2.gz AITAEHXIOAPIBQ-GJZGRUSLSA-N 1 3 335.467 2.855 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC[C@H](C)NCc2cccc(F)c2)C1 ZINC001390455204 1354091595 /nfs/dbraw/zinc/09/15/95/1354091595.db2.gz GRSAUFGBTYVTSE-DOTOQJQBSA-N 1 3 335.467 2.542 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC[C@H](C)NCc2cccc(F)c2)C1 ZINC001390455204 1354091599 /nfs/dbraw/zinc/09/15/99/1354091599.db2.gz GRSAUFGBTYVTSE-DOTOQJQBSA-N 1 3 335.467 2.542 10 0 EFAEHO C[C@@H](CNC(=O)CC[NH+](C)C)NCc1cc(Cl)cc(Cl)c1 ZINC001390463312 1354098868 /nfs/dbraw/zinc/09/88/68/1354098868.db2.gz AHSXMBSEWCQOFO-NSHDSACASA-N 1 3 332.275 2.539 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001390488105 1354120090 /nfs/dbraw/zinc/12/00/90/1354120090.db2.gz ZQHJUGIZKSTIFQ-OXQOHEQNSA-N 1 3 349.494 2.802 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H]1CCC[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001390605150 1354200310 /nfs/dbraw/zinc/20/03/10/1354200310.db2.gz CVDPNFGXBNNEIH-OALUTQOASA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H]1CCC[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001390605152 1354200584 /nfs/dbraw/zinc/20/05/84/1354200584.db2.gz CVDPNFGXBNNEIH-RTBURBONSA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCC[C@@H]([N@H+](C)CCCF)C1 ZINC001390632233 1354229960 /nfs/dbraw/zinc/22/99/60/1354229960.db2.gz KAHGPCFNEJKXEI-IAGOWNOFSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCC[C@@H]([N@@H+](C)CCCF)C1 ZINC001390632233 1354229965 /nfs/dbraw/zinc/22/99/65/1354229965.db2.gz KAHGPCFNEJKXEI-IAGOWNOFSA-N 1 3 327.488 2.532 10 0 EFAEHO Cc1cccnc1C[NH2+][C@H](C)CCNC(=O)[C@@H]1CCCCN1C(C)C ZINC001390708486 1354299278 /nfs/dbraw/zinc/29/92/78/1354299278.db2.gz ZPFODYXTBOBJHT-MJGOQNOKSA-N 1 3 346.519 2.637 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1cc(C)ccc1F ZINC001390733521 1354324536 /nfs/dbraw/zinc/32/45/36/1354324536.db2.gz QDNFXDCHHMQSET-APWZRJJASA-N 1 3 349.494 2.993 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1cccc(C)c1 ZINC001390739271 1354329151 /nfs/dbraw/zinc/32/91/51/1354329151.db2.gz ZYTHJEIPRBFRKD-MJGOQNOKSA-N 1 3 331.504 2.854 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001390859082 1354442139 /nfs/dbraw/zinc/44/21/39/1354442139.db2.gz AQOQYWGWZUKREE-HZPDHXFCSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001390859082 1354442142 /nfs/dbraw/zinc/44/21/42/1354442142.db2.gz AQOQYWGWZUKREE-HZPDHXFCSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[C@@H](F)CN1CC[C@@H](CNC(=O)CC[N@H+](C)C2CCCCC2)C1 ZINC001391096213 1354789871 /nfs/dbraw/zinc/78/98/71/1354789871.db2.gz INTQRXOOALHFPX-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](F)CN1CC[C@@H](CNC(=O)CC[N@@H+](C)C2CCCCC2)C1 ZINC001391096213 1354789875 /nfs/dbraw/zinc/78/98/75/1354789875.db2.gz INTQRXOOALHFPX-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)c(C)s1 ZINC001391097583 1354790957 /nfs/dbraw/zinc/79/09/57/1354790957.db2.gz BHCMDPZRAYAZCS-WMLDXEAASA-N 1 3 349.544 2.645 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)c(C)s1 ZINC001391097583 1354790959 /nfs/dbraw/zinc/79/09/59/1354790959.db2.gz BHCMDPZRAYAZCS-WMLDXEAASA-N 1 3 349.544 2.645 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c(C)c1 ZINC001391104530 1354799850 /nfs/dbraw/zinc/79/98/50/1354799850.db2.gz WRVWVTCAJACGKE-MJGOQNOKSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c(C)c1 ZINC001391104530 1354799852 /nfs/dbraw/zinc/79/98/52/1354799852.db2.gz WRVWVTCAJACGKE-MJGOQNOKSA-N 1 3 343.515 2.583 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@H]2CCN(Cc3cccc(Cl)c3)C2)C1 ZINC001391117347 1354820123 /nfs/dbraw/zinc/82/01/23/1354820123.db2.gz YOZJKCNUZKUQRB-DLBZAZTESA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@H]2CCN(Cc3cccc(Cl)c3)C2)C1 ZINC001391117347 1354820127 /nfs/dbraw/zinc/82/01/27/1354820127.db2.gz YOZJKCNUZKUQRB-DLBZAZTESA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCN(Cc3cccc(Cl)c3)C2)C1 ZINC001391117353 1354820234 /nfs/dbraw/zinc/82/02/34/1354820234.db2.gz YOZJKCNUZKUQRB-IRXDYDNUSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCN(Cc3cccc(Cl)c3)C2)C1 ZINC001391117353 1354820239 /nfs/dbraw/zinc/82/02/39/1354820239.db2.gz YOZJKCNUZKUQRB-IRXDYDNUSA-N 1 3 349.906 2.620 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N2CCCC2)CC[N@@H+]1CC1CCC1 ZINC001397747761 1360102396 /nfs/dbraw/zinc/10/23/96/1360102396.db2.gz JCBHBKVILYLXAS-OTWHNJEPSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N2CCCC2)CC[N@H+]1CC1CCC1 ZINC001397747761 1360102401 /nfs/dbraw/zinc/10/24/01/1360102401.db2.gz JCBHBKVILYLXAS-OTWHNJEPSA-N 1 3 335.536 2.876 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@H]1CC[N@H+](CC2CC(C)(C)C2)C1 ZINC001391338960 1355096211 /nfs/dbraw/zinc/09/62/11/1355096211.db2.gz NCLOXIOXOMTDCN-HNNXBMFYSA-N 1 3 332.492 2.525 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@H]1CC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001391338960 1355096215 /nfs/dbraw/zinc/09/62/15/1355096215.db2.gz NCLOXIOXOMTDCN-HNNXBMFYSA-N 1 3 332.492 2.525 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@H+](C)CCCC(C)(C)C)C1 ZINC001391350795 1355109852 /nfs/dbraw/zinc/10/98/52/1355109852.db2.gz BLTXHHRFBGYERL-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@@H+](C)CCCC(C)(C)C)C1 ZINC001391350795 1355109857 /nfs/dbraw/zinc/10/98/57/1355109857.db2.gz BLTXHHRFBGYERL-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@H](C[N@H+](C)CCC(F)(F)F)C1 ZINC001391358323 1355120996 /nfs/dbraw/zinc/12/09/96/1355120996.db2.gz PJVVXWHMWCIEEV-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@H](C[N@@H+](C)CCC(F)(F)F)C1 ZINC001391358323 1355120999 /nfs/dbraw/zinc/12/09/99/1355120999.db2.gz PJVVXWHMWCIEEV-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@@H](C[N@H+](C)CCC(F)(F)F)C1 ZINC001391358325 1355121115 /nfs/dbraw/zinc/12/11/15/1355121115.db2.gz PJVVXWHMWCIEEV-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@@H](C[N@@H+](C)CCC(F)(F)F)C1 ZINC001391358325 1355121117 /nfs/dbraw/zinc/12/11/17/1355121117.db2.gz PJVVXWHMWCIEEV-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CCC[N@@H+]1CC[C@H](N(CC)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001391655235 1355407254 /nfs/dbraw/zinc/40/72/54/1355407254.db2.gz MEYNVWNVFMHYGA-MAUKXSAKSA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@H+]1CC[C@H](N(CC)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001391655235 1355407258 /nfs/dbraw/zinc/40/72/58/1355407258.db2.gz MEYNVWNVFMHYGA-MAUKXSAKSA-N 1 3 327.488 2.532 10 0 EFAEHO CCN(C(=O)[C@H](C)N1CCCCCC1)[C@H]1CC[N@H+](CC2CCC2)C1 ZINC001391657125 1355410127 /nfs/dbraw/zinc/41/01/27/1355410127.db2.gz TZADEJOCCNWALS-HKUYNNGSSA-N 1 3 335.536 2.974 10 0 EFAEHO CCN(C(=O)[C@H](C)N1CCCCCC1)[C@H]1CC[N@@H+](CC2CCC2)C1 ZINC001391657125 1355410130 /nfs/dbraw/zinc/41/01/30/1355410130.db2.gz TZADEJOCCNWALS-HKUYNNGSSA-N 1 3 335.536 2.974 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](C)Cc1ccc2cc[nH]c2c1 ZINC001399653637 1361406975 /nfs/dbraw/zinc/40/69/75/1361406975.db2.gz HQOLRCGGPPJKBQ-IBGZPJMESA-N 1 3 342.487 2.590 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](C)Cc1ccc2cc[nH]c2c1 ZINC001399653637 1361406979 /nfs/dbraw/zinc/40/69/79/1361406979.db2.gz HQOLRCGGPPJKBQ-IBGZPJMESA-N 1 3 342.487 2.590 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](CC)NCc1cc(C)ccc1F ZINC001391690474 1355437157 /nfs/dbraw/zinc/43/71/57/1355437157.db2.gz HBUAEZOBKMSOMW-PKOBYXMFSA-N 1 3 349.494 2.993 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](CC)NCc1cc(C)ccc1F ZINC001391690474 1355437160 /nfs/dbraw/zinc/43/71/60/1355437160.db2.gz HBUAEZOBKMSOMW-PKOBYXMFSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](CNC(=O)[C@H](C(C)C)[NH+](C)C)NCc1cc(C)ccc1F ZINC001391693502 1355440343 /nfs/dbraw/zinc/44/03/43/1355440343.db2.gz KFSDNGYMFWAVJS-AEFFLSMTSA-N 1 3 337.483 2.705 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](CC)[NH2+]Cc1cccc(C)c1 ZINC001391695841 1355441819 /nfs/dbraw/zinc/44/18/19/1355441819.db2.gz VVNLKGHJRJKKIW-OALUTQOASA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@H](CNC(=O)CC[NH+](C)C)NCc1ccc(Cl)cc1Cl ZINC001391716724 1355460022 /nfs/dbraw/zinc/46/00/22/1355460022.db2.gz CJLVIWMDLPMUAB-CQSZACIVSA-N 1 3 346.302 2.930 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCC[N@@H+]1C(C)C)NCc1ncccc1C ZINC001391728159 1355471998 /nfs/dbraw/zinc/47/19/98/1355471998.db2.gz MRHHFLMQHJHDIH-PKOBYXMFSA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCC[N@H+]1C(C)C)NCc1ncccc1C ZINC001391728159 1355472006 /nfs/dbraw/zinc/47/20/06/1355472006.db2.gz MRHHFLMQHJHDIH-PKOBYXMFSA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)NCc1ccccc1Cl ZINC001391735316 1355479657 /nfs/dbraw/zinc/47/96/57/1355479657.db2.gz KBKLBHNGANELMU-GDBMZVCRSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)NCc1ccccc1Cl ZINC001391735316 1355479660 /nfs/dbraw/zinc/47/96/60/1355479660.db2.gz KBKLBHNGANELMU-GDBMZVCRSA-N 1 3 337.895 2.666 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@](C)(NC(=O)CN2CC[C@@H](C)C2)C2CC2)cc1 ZINC001391809621 1355552606 /nfs/dbraw/zinc/55/26/06/1355552606.db2.gz GUEIFNOFKGZFLV-DYESRHJHSA-N 1 3 343.515 2.711 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@](C)(CNCc1sccc1Cl)C1CC1 ZINC001391812241 1355555762 /nfs/dbraw/zinc/55/57/62/1355555762.db2.gz JLDLHTNURIKWQL-MRXNPFEDSA-N 1 3 343.924 2.728 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCC2CCN(C/C=C\Cl)CC2)CC[N@@H+]1C ZINC001391841796 1355584685 /nfs/dbraw/zinc/58/46/85/1355584685.db2.gz BZXDDNKACHKQNO-YCFODECYSA-N 1 3 341.927 2.688 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCC2CCN(C/C=C\Cl)CC2)CC[N@H+]1C ZINC001391841796 1355584689 /nfs/dbraw/zinc/58/46/89/1355584689.db2.gz BZXDDNKACHKQNO-YCFODECYSA-N 1 3 341.927 2.688 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@@H](C)[NH2+]Cc1ccsc1 ZINC001436676438 1387279359 /nfs/dbraw/zinc/27/93/59/1387279359.db2.gz XKZBYSYKWKETRN-NVXWUHKLSA-N 1 3 337.533 2.949 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+][C@@H](C)c1ccc(F)cc1F ZINC001391960792 1355683837 /nfs/dbraw/zinc/68/38/37/1355683837.db2.gz CZZOERQHHFQDFM-KGLIPLIRSA-N 1 3 341.446 2.708 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+]Cc2cc(C)ccc2F)CCCC1)N(C)C ZINC001392023542 1355722532 /nfs/dbraw/zinc/72/25/32/1355722532.db2.gz OGDABVLILFHQPP-SFHVURJKSA-N 1 3 349.494 2.993 10 0 EFAEHO C[C@@H](C[NH2+][C@@H]1CCc2ccccc21)N(C)C(=O)CN1CCC(C)CC1 ZINC001392112898 1355776050 /nfs/dbraw/zinc/77/60/50/1355776050.db2.gz PGNSORNNSHLSFW-FXAWDEMLSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](NC[C@@H](C)N(C)C(=O)CC[NH+](C)C)c1ccc(F)cc1F ZINC001392129257 1355789594 /nfs/dbraw/zinc/78/95/94/1355789594.db2.gz XZOTZISFJAGVSS-DYVFJYSZSA-N 1 3 341.446 2.804 10 0 EFAEHO C[C@H](C[NH2+][C@@H](C)c1cccc(Cl)c1)N(C)C(=O)CN1CCCC1 ZINC001392136883 1355795087 /nfs/dbraw/zinc/79/50/87/1355795087.db2.gz WZDNFEQZWXUBAJ-CABCVRRESA-N 1 3 337.895 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(C(F)F)cc1 ZINC001392138133 1355795907 /nfs/dbraw/zinc/79/59/07/1355795907.db2.gz MACUBAFPRQGIJH-AWEZNQCLSA-N 1 3 341.446 2.901 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](CC(C)C)NC(=O)[C@H]2CC[N@H+](C)C2)c1 ZINC001392158183 1355812656 /nfs/dbraw/zinc/81/26/56/1355812656.db2.gz HXPQIECFOLBCQZ-WMZOPIPTSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](CC(C)C)NC(=O)[C@H]2CC[N@@H+](C)C2)c1 ZINC001392158183 1355812661 /nfs/dbraw/zinc/81/26/61/1355812661.db2.gz HXPQIECFOLBCQZ-WMZOPIPTSA-N 1 3 349.494 2.706 10 0 EFAEHO C[C@H](F)CC[N@H+](C)CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001392195249 1355850763 /nfs/dbraw/zinc/85/07/63/1355850763.db2.gz RMGRRVOKSRVEDI-SJORKVTESA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001392195249 1355850767 /nfs/dbraw/zinc/85/07/67/1355850767.db2.gz RMGRRVOKSRVEDI-SJORKVTESA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)CCC1CCN(C(=O)[C@@H]2CCCCN2C)CC1 ZINC001392195418 1355850798 /nfs/dbraw/zinc/85/07/98/1355850798.db2.gz LTISOPDTJUZLCR-MSOLQXFVSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)CCC1CCN(C(=O)[C@@H]2CCCCN2C)CC1 ZINC001392195418 1355850803 /nfs/dbraw/zinc/85/08/03/1355850803.db2.gz LTISOPDTJUZLCR-MSOLQXFVSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC(CCN(C)CCF)CC1)[NH+]1CCCC1 ZINC001392202161 1355858420 /nfs/dbraw/zinc/85/84/20/1355858420.db2.gz OHSCXKTVBUZSHN-GOSISDBHSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]CCc1ccccc1 ZINC001392220010 1355875364 /nfs/dbraw/zinc/87/53/64/1355875364.db2.gz MENRIYJAVXCWFT-UXHICEINSA-N 1 3 345.531 2.832 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001392277368 1355932494 /nfs/dbraw/zinc/93/24/94/1355932494.db2.gz CKIZDQOBTOSEMT-DNVCBOLYSA-N 1 3 347.478 2.619 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)CC1CCC(F)(F)CC1 ZINC001392339518 1356006296 /nfs/dbraw/zinc/00/62/96/1356006296.db2.gz VKVABYYZRKVSBH-UHFFFAOYSA-N 1 3 333.467 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)CC1CCC(F)(F)CC1 ZINC001392339518 1356006303 /nfs/dbraw/zinc/00/63/03/1356006303.db2.gz VKVABYYZRKVSBH-UHFFFAOYSA-N 1 3 333.467 2.542 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCc2ccccc21)C(=O)[C@H]1CCCCN1CC ZINC001392461221 1356053088 /nfs/dbraw/zinc/05/30/88/1356053088.db2.gz TXQRFGPNCARQFJ-WOJBJXKFSA-N 1 3 343.515 2.986 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C[C@@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001392510890 1356086131 /nfs/dbraw/zinc/08/61/31/1356086131.db2.gz IQTOEHGGYHROSY-DZGCQCFKSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@H](C(C)C)[NH+]2CCCC2)c1 ZINC001392537182 1356108543 /nfs/dbraw/zinc/10/85/43/1356108543.db2.gz OELNIKNYBZFLEC-APWZRJJASA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@@H]2CCC[N@@H+]2C(C)C)c1 ZINC001392564636 1356123498 /nfs/dbraw/zinc/12/34/98/1356123498.db2.gz IORSMBCUCWLUNE-YJBOKZPZSA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@@H]2CCC[N@H+]2C(C)C)c1 ZINC001392564636 1356123500 /nfs/dbraw/zinc/12/35/00/1356123500.db2.gz IORSMBCUCWLUNE-YJBOKZPZSA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1ccncc1CNC[C@H](C)NC(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001392570655 1356128613 /nfs/dbraw/zinc/12/86/13/1356128613.db2.gz KEOIPDYJSHIJFD-INIZCTEOSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1ccncc1CNC[C@H](C)NC(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001392570655 1356128615 /nfs/dbraw/zinc/12/86/15/1356128615.db2.gz KEOIPDYJSHIJFD-INIZCTEOSA-N 1 3 346.519 2.637 10 0 EFAEHO COc1ccc(CN(C)C[C@H](C)NC(=O)[C@H]2CCC[N@@H+]2C(C)C)cc1 ZINC001392652550 1356199044 /nfs/dbraw/zinc/19/90/44/1356199044.db2.gz FUPRPKNJQNRGLZ-QFBILLFUSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(CN(C)C[C@H](C)NC(=O)[C@H]2CCC[N@H+]2C(C)C)cc1 ZINC001392652550 1356199047 /nfs/dbraw/zinc/19/90/47/1356199047.db2.gz FUPRPKNJQNRGLZ-QFBILLFUSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(CN(C)C[C@@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)cc1 ZINC001392663115 1356209960 /nfs/dbraw/zinc/20/99/60/1356209960.db2.gz NFRSDQHZQXLPRS-AEFFLSMTSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1ccc(CN(C)C[C@@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)cc1 ZINC001392663115 1356209963 /nfs/dbraw/zinc/20/99/63/1356209963.db2.gz NFRSDQHZQXLPRS-AEFFLSMTSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1 ZINC001392678315 1356227766 /nfs/dbraw/zinc/22/77/66/1356227766.db2.gz JURRRCQMJGAONZ-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1 ZINC001392678315 1356227768 /nfs/dbraw/zinc/22/77/68/1356227768.db2.gz JURRRCQMJGAONZ-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO C[C@H](c1ccc(F)c(Cl)c1)N(C)C[C@H](C)NC(=O)CC[NH+](C)C ZINC001392685881 1356235329 /nfs/dbraw/zinc/23/53/29/1356235329.db2.gz KILQHRBARRXKKY-QWHCGFSZSA-N 1 3 343.874 2.928 10 0 EFAEHO CCc1ccccc1C[N@H+](C)C[C@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001392690147 1356240617 /nfs/dbraw/zinc/24/06/17/1356240617.db2.gz WUHWQFJLGKMZFH-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccccc1C[N@@H+](C)C[C@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001392690147 1356240621 /nfs/dbraw/zinc/24/06/21/1356240621.db2.gz WUHWQFJLGKMZFH-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO CC[C@H](F)C[N@H+](C)C[C@H](C)NC(=O)c1sccc1CN(C)C ZINC001401755950 1363090143 /nfs/dbraw/zinc/09/01/43/1363090143.db2.gz KTMUINOSGYWGNN-JSGCOSHPSA-N 1 3 329.485 2.608 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)C[C@H](C)NC(=O)c1sccc1CN(C)C ZINC001401755950 1363090147 /nfs/dbraw/zinc/09/01/47/1363090147.db2.gz KTMUINOSGYWGNN-JSGCOSHPSA-N 1 3 329.485 2.608 10 0 EFAEHO CC(C)CCCN1CC[C@@H]1CNC(=O)C1CC[NH+](CC2CC2)CC1 ZINC001392858988 1356382580 /nfs/dbraw/zinc/38/25/80/1356382580.db2.gz CHPRLGUTDMBHMS-LJQANCHMSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+]Cc2cc3ccccc3s2)CC1)N(C)C ZINC001392937583 1356447305 /nfs/dbraw/zinc/44/73/05/1356447305.db2.gz ORAJTMYRCNBNSL-INIZCTEOSA-N 1 3 345.512 2.980 10 0 EFAEHO CC(C)c1ccc(CNC2(CNC(=O)[C@@H]3CC[N@H+](C)C3)CC2)cc1 ZINC001392956807 1356465028 /nfs/dbraw/zinc/46/50/28/1356465028.db2.gz KPWWMMDJCKZYPA-GOSISDBHSA-N 1 3 329.488 2.500 10 0 EFAEHO CC(C)c1ccc(CNC2(CNC(=O)[C@@H]3CC[N@@H+](C)C3)CC2)cc1 ZINC001392956807 1356465033 /nfs/dbraw/zinc/46/50/33/1356465033.db2.gz KPWWMMDJCKZYPA-GOSISDBHSA-N 1 3 329.488 2.500 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]Cc2cccc(Cl)c2)CC1 ZINC001392964335 1356471090 /nfs/dbraw/zinc/47/10/90/1356471090.db2.gz UFNRMPGTYMDQMS-HUUCEWRRSA-N 1 3 349.906 2.951 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H]2CC[N@H+](C[C@H](F)CC)C2)CC1 ZINC001392971744 1356478732 /nfs/dbraw/zinc/47/87/32/1356478732.db2.gz RSUPAJBLDXHEPJ-ZWKOTPCHSA-N 1 3 341.515 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H]2CC[N@@H+](C[C@H](F)CC)C2)CC1 ZINC001392971744 1356478735 /nfs/dbraw/zinc/47/87/35/1356478735.db2.gz RSUPAJBLDXHEPJ-ZWKOTPCHSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N(C)CCNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001492816916 1356479425 /nfs/dbraw/zinc/47/94/25/1356479425.db2.gz MPCWNSIYOXQSTE-MAUKXSAKSA-N 1 3 335.467 2.667 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N(C)CCNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001492816916 1356479427 /nfs/dbraw/zinc/47/94/27/1356479427.db2.gz MPCWNSIYOXQSTE-MAUKXSAKSA-N 1 3 335.467 2.667 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(CC[N@H+](Cc3ccsc3)C2)C1 ZINC001392991313 1356496322 /nfs/dbraw/zinc/49/63/22/1356496322.db2.gz LONQXPZPNYNQAI-GOSISDBHSA-N 1 3 335.517 2.513 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(CC[N@@H+](Cc3ccsc3)C2)C1 ZINC001392991313 1356496323 /nfs/dbraw/zinc/49/63/23/1356496323.db2.gz LONQXPZPNYNQAI-GOSISDBHSA-N 1 3 335.517 2.513 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCc2ccccc2F)C[C@@H]1C ZINC001393033385 1356526157 /nfs/dbraw/zinc/52/61/57/1356526157.db2.gz SPOZLNKDPJILPA-FUHWJXTLSA-N 1 3 349.494 2.678 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(CF)cc2)C[C@H]1C ZINC001393035331 1356527746 /nfs/dbraw/zinc/52/77/46/1356527746.db2.gz YQVUSGUPSVWTAP-VQIMIIECSA-N 1 3 349.494 2.965 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+]Cc1cccc(Cl)c1 ZINC001393053169 1356541032 /nfs/dbraw/zinc/54/10/32/1356541032.db2.gz KULAVKVAUBFFOL-KRWDZBQOSA-N 1 3 337.895 2.761 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]Cc1cccc(Cl)c1 ZINC001393053171 1356541062 /nfs/dbraw/zinc/54/10/62/1356541062.db2.gz KULAVKVAUBFFOL-QGZVFWFLSA-N 1 3 337.895 2.761 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[NH2+][C@@H]1CCc2ccccc21 ZINC001402072930 1363378275 /nfs/dbraw/zinc/37/82/75/1363378275.db2.gz MIULVCHHNKOHGN-PKOBYXMFSA-N 1 3 329.488 2.596 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[NH2+][C@H]1CCc2ccccc21 ZINC001402072912 1363378442 /nfs/dbraw/zinc/37/84/42/1363378442.db2.gz MIULVCHHNKOHGN-HKUYNNGSSA-N 1 3 329.488 2.596 10 0 EFAEHO CC(C)C[N@@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)CC(C)(C)C)C[C@H]2C1 ZINC001394352782 1357726039 /nfs/dbraw/zinc/72/60/39/1357726039.db2.gz UZMKSBGGSQILEV-BZSNNMDCSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)C[N@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)CC(C)(C)C)C[C@H]2C1 ZINC001394352782 1357726051 /nfs/dbraw/zinc/72/60/51/1357726051.db2.gz UZMKSBGGSQILEV-BZSNNMDCSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)C[N@@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)CC(C)(C)C)C[C@@H]2C1 ZINC001394352783 1357726174 /nfs/dbraw/zinc/72/61/74/1357726174.db2.gz UZMKSBGGSQILEV-KSZLIROESA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)C[N@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)CC(C)(C)C)C[C@@H]2C1 ZINC001394352783 1357726179 /nfs/dbraw/zinc/72/61/79/1357726179.db2.gz UZMKSBGGSQILEV-KSZLIROESA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)[NH+]1CCC(C)(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001393180020 1356685697 /nfs/dbraw/zinc/68/56/97/1356685697.db2.gz MPXKJCSNTUTZTE-LJQANCHMSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001393246702 1356749316 /nfs/dbraw/zinc/74/93/16/1356749316.db2.gz ZWAYUESJJPDBRZ-HOTGVXAUSA-N 1 3 347.494 2.692 10 0 EFAEHO CC(C)CC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001393246702 1356749321 /nfs/dbraw/zinc/74/93/21/1356749321.db2.gz ZWAYUESJJPDBRZ-HOTGVXAUSA-N 1 3 347.494 2.692 10 0 EFAEHO CCC[N@@H+]1CCc2c(CNC(=O)CN(C)C3CCC3)cccc2C1 ZINC001393523890 1356919061 /nfs/dbraw/zinc/91/90/61/1356919061.db2.gz PTPANGOQMGHFKL-UHFFFAOYSA-N 1 3 329.488 2.555 10 0 EFAEHO CCC[N@H+]1CCc2c(CNC(=O)CN(C)C3CCC3)cccc2C1 ZINC001393523890 1356919064 /nfs/dbraw/zinc/91/90/64/1356919064.db2.gz PTPANGOQMGHFKL-UHFFFAOYSA-N 1 3 329.488 2.555 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC1([NH2+]CC[C@H](C)F)CCC1 ZINC001393565132 1356954083 /nfs/dbraw/zinc/95/40/83/1356954083.db2.gz FSQCXCIMQYXWGQ-HOTGVXAUSA-N 1 3 327.488 2.626 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)NCC2(NCc3ccsc3)CCC2)C1 ZINC001393566258 1356955219 /nfs/dbraw/zinc/95/52/19/1356955219.db2.gz MDRLJCBVBYUABI-IAGOWNOFSA-N 1 3 349.544 2.997 10 0 EFAEHO Cc1cccc(C[NH2+]C2(CNC(=O)CN3[C@@H](C)CC[C@@H]3C)CCC2)c1 ZINC001393567921 1356957139 /nfs/dbraw/zinc/95/71/39/1356957139.db2.gz IAKRHXWVQMHURQ-ROUUACIJSA-N 1 3 343.515 2.996 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCCN(C/C=C/Cl)CC1)[NH+](CC)CC ZINC001393590869 1356970907 /nfs/dbraw/zinc/97/09/07/1356970907.db2.gz AHVKNFNVLGXULT-ZVYLKZBJSA-N 1 3 329.916 2.830 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)[C@H](C)[NH+]1CCCCCC1 ZINC001393632633 1357027930 /nfs/dbraw/zinc/02/79/30/1357027930.db2.gz LVCPNQLWQAIZLT-DLBZAZTESA-N 1 3 329.504 2.779 10 0 EFAEHO CN(CCC[N@H+](C)CC1CCC2(CC2)CC1)C(=O)CN1CCCC1 ZINC001393644773 1357046129 /nfs/dbraw/zinc/04/61/29/1357046129.db2.gz PSNOVXHPGLXSTJ-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO CN(CCC[N@@H+](C)CC1CCC2(CC2)CC1)C(=O)CN1CCCC1 ZINC001393644773 1357046132 /nfs/dbraw/zinc/04/61/32/1357046132.db2.gz PSNOVXHPGLXSTJ-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H]2CCC[N@H+](CCCF)C2)C1 ZINC001393653209 1357052378 /nfs/dbraw/zinc/05/23/78/1357052378.db2.gz XAXBRBDTDUJVJW-MSOLQXFVSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H]2CCC[N@@H+](CCCF)C2)C1 ZINC001393653209 1357052383 /nfs/dbraw/zinc/05/23/83/1357052383.db2.gz XAXBRBDTDUJVJW-MSOLQXFVSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC)([NH2+]CCC(F)(F)F)CC1)N(C)C ZINC001393681384 1357075373 /nfs/dbraw/zinc/07/53/73/1357075373.db2.gz WWWNIUJHYUSZFW-CYBMUJFWSA-N 1 3 337.430 2.640 10 0 EFAEHO Cc1ccc(C[N@@H+](C)C2CCN(C(=O)CN(C)C(C)C)CC2)cc1F ZINC001394397586 1357772203 /nfs/dbraw/zinc/77/22/03/1357772203.db2.gz JVBWYZSIJRUCCA-UHFFFAOYSA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1ccc(C[N@H+](C)C2CCN(C(=O)CN(C)C(C)C)CC2)cc1F ZINC001394397586 1357772205 /nfs/dbraw/zinc/77/22/05/1357772205.db2.gz JVBWYZSIJRUCCA-UHFFFAOYSA-N 1 3 349.494 2.897 10 0 EFAEHO CC(C)CCC[N@H+](C)C1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001394402078 1357778660 /nfs/dbraw/zinc/77/86/60/1357778660.db2.gz XTHONOHQCCTGKB-GOSISDBHSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)CCC[N@@H+](C)C1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001394402078 1357778663 /nfs/dbraw/zinc/77/86/63/1357778663.db2.gz XTHONOHQCCTGKB-GOSISDBHSA-N 1 3 325.541 2.932 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H](C2CC2)N(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001394445964 1357825772 /nfs/dbraw/zinc/82/57/72/1357825772.db2.gz UKCRMRGGJPNDLQ-PXNSSMCTSA-N 1 3 343.515 2.663 10 0 EFAEHO C[C@H](CN(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1)NC/C=C/Cl ZINC001394514809 1357897494 /nfs/dbraw/zinc/89/74/94/1357897494.db2.gz UINHEHQMPDAPGQ-BMGYJQCNSA-N 1 3 329.916 2.828 10 0 EFAEHO C[C@H](CN(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1)NC/C=C/Cl ZINC001394514809 1357897495 /nfs/dbraw/zinc/89/74/95/1357897495.db2.gz UINHEHQMPDAPGQ-BMGYJQCNSA-N 1 3 329.916 2.828 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN(C)CC(C)(C)C)[NH2+]Cc1ccsc1 ZINC001394528478 1357912792 /nfs/dbraw/zinc/91/27/92/1357912792.db2.gz MGSWAGIOJYYZKK-AWEZNQCLSA-N 1 3 325.522 2.663 10 0 EFAEHO CCCN(C)CC(=O)N(C)C[C@@H](C)[NH2+]C[C@H]1CCc2ccccc2C1 ZINC001394538673 1357924124 /nfs/dbraw/zinc/92/41/24/1357924124.db2.gz IJMCYHMGXUBHOW-MSOLQXFVSA-N 1 3 345.531 2.570 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1cccc(F)c1)C1CC1 ZINC001436796075 1387301805 /nfs/dbraw/zinc/30/18/05/1387301805.db2.gz RNKTUYLOQIVHQO-OALUTQOASA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]CC[C@@H]1CCc2ccccc21 ZINC001394566326 1357959453 /nfs/dbraw/zinc/95/94/53/1357959453.db2.gz JXJOKLINWOYROF-MJGOQNOKSA-N 1 3 345.531 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]CC[C@H]1CCc2ccccc21 ZINC001394566323 1357959518 /nfs/dbraw/zinc/95/95/18/1357959518.db2.gz JXJOKLINWOYROF-IEBWSBKVSA-N 1 3 345.531 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc3cc[nH]c3c2)C[C@H]1C ZINC001394689522 1358010111 /nfs/dbraw/zinc/01/01/11/1358010111.db2.gz YBCDDCQEIFMCLV-CRAIPNDOSA-N 1 3 342.487 2.587 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@]12CCC[C@@H]1N(Cc1ccsc1)CC2 ZINC001394691835 1358014800 /nfs/dbraw/zinc/01/48/00/1358014800.db2.gz NYAVEIXAYWUZIB-FUHWJXTLSA-N 1 3 335.517 2.703 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]Cc2ccc(CF)cc2)C1 ZINC001394705439 1358031813 /nfs/dbraw/zinc/03/18/13/1358031813.db2.gz ZHOHMTXJIZMXGX-OALUTQOASA-N 1 3 349.494 2.871 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@@H](C[NH2+]Cc2ccc(CF)cc2)C1 ZINC001394705435 1358032437 /nfs/dbraw/zinc/03/24/37/1358032437.db2.gz ZHOHMTXJIZMXGX-MOPGFXCFSA-N 1 3 349.494 2.871 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H](C[NH2+]CC3CC(C)(C)C3)C2)CCC1 ZINC001394711320 1358038457 /nfs/dbraw/zinc/03/84/57/1358038457.db2.gz UPJHNNVDYKHUPK-RDJZCZTQSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N(CC[N@H+](C)C[C@@H]1CCC(F)(F)C1)C(=O)CN1CCCC1 ZINC001394812417 1358104119 /nfs/dbraw/zinc/10/41/19/1358104119.db2.gz IPFIRWQFZGEACO-MRXNPFEDSA-N 1 3 345.478 2.686 10 0 EFAEHO CC(C)N(CC[N@@H+](C)C[C@@H]1CCC(F)(F)C1)C(=O)CN1CCCC1 ZINC001394812417 1358104124 /nfs/dbraw/zinc/10/41/24/1358104124.db2.gz IPFIRWQFZGEACO-MRXNPFEDSA-N 1 3 345.478 2.686 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C/Cl ZINC001440657370 1389805541 /nfs/dbraw/zinc/80/55/41/1389805541.db2.gz OSRUXMPAURZZIW-HPCSDQSLSA-N 1 3 336.307 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C/Cl ZINC001440657370 1389805546 /nfs/dbraw/zinc/80/55/46/1389805546.db2.gz OSRUXMPAURZZIW-HPCSDQSLSA-N 1 3 336.307 2.664 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC001394846866 1358152578 /nfs/dbraw/zinc/15/25/78/1358152578.db2.gz DWVHYKRFEVWFAI-KRWDZBQOSA-N 1 3 331.504 2.745 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1CC[NH+](Cc2ccccc2)CC1)N(C)C ZINC001394848578 1358155575 /nfs/dbraw/zinc/15/55/75/1358155575.db2.gz VLCHFJHBXPTQQH-QFBILLFUSA-N 1 3 331.504 2.744 10 0 EFAEHO C[C@@H](NC1CC(N(C)C(=O)CC[NH+](C)C)C1)c1ccc(F)cc1F ZINC001394856445 1358162847 /nfs/dbraw/zinc/16/28/47/1358162847.db2.gz AFHHCPBNMJDKJG-LRVUVFPRSA-N 1 3 339.430 2.557 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@H]([NH2+]C/C=C/c2ccccc2)C1 ZINC001436883691 1387336656 /nfs/dbraw/zinc/33/66/56/1387336656.db2.gz QURRDNJNELOPIV-RHYMJRRZSA-N 1 3 341.499 2.765 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+]Cc3cc4ccccc4o3)C2)CCC1 ZINC001436952520 1387342622 /nfs/dbraw/zinc/34/26/22/1387342622.db2.gz JRFFHRYLZVESQY-IYBDPMFKSA-N 1 3 341.455 2.654 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccccc2OC(C)C)C1)N(C)C ZINC001436963745 1387347017 /nfs/dbraw/zinc/34/70/17/1387347017.db2.gz JUOBRWVVIWRGST-KSZLIROESA-N 1 3 347.503 2.551 10 0 EFAEHO Cc1ccccc1C[N@H+]1CCC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001437009297 1387360250 /nfs/dbraw/zinc/36/02/50/1387360250.db2.gz WXPNAYITZUQFBH-GOSISDBHSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CCC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001437009297 1387360257 /nfs/dbraw/zinc/36/02/57/1387360257.db2.gz WXPNAYITZUQFBH-GOSISDBHSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001437036803 1387380052 /nfs/dbraw/zinc/38/00/52/1387380052.db2.gz SHGPONKDRJYVQZ-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H]1CN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001396927082 1359561787 /nfs/dbraw/zinc/56/17/87/1359561787.db2.gz GZOCPSOFOWVBGC-IEBWSBKVSA-N 1 3 331.504 2.580 10 0 EFAEHO CC[C@H]([NH2+][C@H]1C[C@H](CNC(=O)CN(C)C(C)C)C1)c1ccccc1 ZINC001397142051 1359702216 /nfs/dbraw/zinc/70/22/16/1359702216.db2.gz UHZCEVVUCJPPHP-WDSOQIARSA-N 1 3 331.504 2.962 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+][C@H]2CCc3ccccc32)C1 ZINC001397163430 1359716048 /nfs/dbraw/zinc/71/60/48/1359716048.db2.gz DGMASBGSQJXAAE-HQRMLTQVSA-N 1 3 343.515 2.889 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2cnccc2C)[C@@H]1CC ZINC001397207490 1359750891 /nfs/dbraw/zinc/75/08/91/1359750891.db2.gz SYMYXUQFMFYWIJ-RBUKOAKNSA-N 1 3 346.519 2.591 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2cnccc2C)[C@@H]1CC ZINC001397207490 1359750894 /nfs/dbraw/zinc/75/08/94/1359750894.db2.gz SYMYXUQFMFYWIJ-RBUKOAKNSA-N 1 3 346.519 2.591 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@H]2CCN(Cc3ccsc3)C[C@H]2C1 ZINC001397219308 1359759439 /nfs/dbraw/zinc/75/94/39/1359759439.db2.gz QUCNNURDGUAOKO-MSOLQXFVSA-N 1 3 349.544 2.760 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@H]2CCN(Cc3ccsc3)C[C@H]2C1 ZINC001397219308 1359759442 /nfs/dbraw/zinc/75/94/42/1359759442.db2.gz QUCNNURDGUAOKO-MSOLQXFVSA-N 1 3 349.544 2.760 10 0 EFAEHO CN(C)C1(C(=O)N2CCCCC[C@@H]([NH2+]CCC(F)(F)F)C2)CCC1 ZINC001397228352 1359767951 /nfs/dbraw/zinc/76/79/51/1359767951.db2.gz WQFLKQWOAMDZJN-CQSZACIVSA-N 1 3 349.441 2.784 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCCCC[C@@H](NCc2ncccc2C)C1 ZINC001397228822 1359768116 /nfs/dbraw/zinc/76/81/16/1359768116.db2.gz RWJINLISDHKKDN-GOSISDBHSA-N 1 3 346.519 2.593 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCCCC[C@@H](NCc2ncccc2C)C1 ZINC001397228822 1359768124 /nfs/dbraw/zinc/76/81/24/1359768124.db2.gz RWJINLISDHKKDN-GOSISDBHSA-N 1 3 346.519 2.593 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCCCC[C@H]([NH2+]C/C=C\Cl)C1 ZINC001397229351 1359768850 /nfs/dbraw/zinc/76/88/50/1359768850.db2.gz YCURPZYZMYGAHC-PCOVPTDHSA-N 1 3 347.906 2.780 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1)NCc1ccsc1 ZINC001437149574 1387423147 /nfs/dbraw/zinc/42/31/47/1387423147.db2.gz SCCPOVXMGHPWKJ-PBHICJAKSA-N 1 3 335.517 2.749 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CCC[N@H+]1C1CCCC1)NCc1ccsc1 ZINC001437149574 1387423148 /nfs/dbraw/zinc/42/31/48/1387423148.db2.gz SCCPOVXMGHPWKJ-PBHICJAKSA-N 1 3 335.517 2.749 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@@H+]2CC2CCC3(CC3)CC2)C1 ZINC001397579063 1359976516 /nfs/dbraw/zinc/97/65/16/1359976516.db2.gz OYYDOKLWTGWCOM-PKOBYXMFSA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@H+]2CC2CCC3(CC3)CC2)C1 ZINC001397579063 1359976521 /nfs/dbraw/zinc/97/65/21/1359976521.db2.gz OYYDOKLWTGWCOM-PKOBYXMFSA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]Cc2ccsc2)C1 ZINC001397681158 1360046274 /nfs/dbraw/zinc/04/62/74/1360046274.db2.gz SASKGOWMGCGGTH-ZHZCFWQKSA-N 1 3 335.517 2.605 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]C/C=C\c1ccc(Cl)cc1)N(C)C ZINC001437164604 1387433381 /nfs/dbraw/zinc/43/33/81/1387433381.db2.gz GKTOLUITWSUYNG-FIXGOIDJSA-N 1 3 337.895 2.788 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]CC3CC(C)(C)C3)C2)C1 ZINC001397731646 1360086109 /nfs/dbraw/zinc/08/61/09/1360086109.db2.gz IUJLPJBHSCHKEJ-SOLBZPMBSA-N 1 3 335.536 2.639 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2CCCCCN(C(=O)CC[NH+](C)C)C2)c1 ZINC001397779220 1360129255 /nfs/dbraw/zinc/12/92/55/1360129255.db2.gz PFALNHQLOPINPL-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO CCCc1ccc(CN2CC[C@H](NC(=O)CC[NH+](C)C)[C@H]2C)cc1 ZINC001397796306 1360145025 /nfs/dbraw/zinc/14/50/25/1360145025.db2.gz FHWAKSCTZLOLDA-APWZRJJASA-N 1 3 331.504 2.670 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](C/C=C\Cl)CC(C)(C)C1 ZINC001397817417 1360169894 /nfs/dbraw/zinc/16/98/94/1360169894.db2.gz VISHKJUTPRCYPQ-LYASGUKUSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](C/C=C\Cl)CC(C)(C)C1 ZINC001397817417 1360169896 /nfs/dbraw/zinc/16/98/96/1360169896.db2.gz VISHKJUTPRCYPQ-LYASGUKUSA-N 1 3 329.916 2.686 10 0 EFAEHO CN(CC(=O)N(C)C1CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1)C1CCC1 ZINC001398180672 1360359425 /nfs/dbraw/zinc/35/94/25/1360359425.db2.gz BKSKJEYMXZMMKU-FGTMMUONSA-N 1 3 347.547 2.830 10 0 EFAEHO CC(C)CCC[NH+]1CCC(N(C)C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001398200610 1360374465 /nfs/dbraw/zinc/37/44/65/1360374465.db2.gz LVYKMVGXFOGFNY-SFHVURJKSA-N 1 3 325.541 2.932 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCCN([C@H]2CCCc3ccc(F)cc32)C1 ZINC001398225919 1360396308 /nfs/dbraw/zinc/39/63/08/1360396308.db2.gz FFRKFVQIDGELNJ-HKUYNNGSSA-N 1 3 347.478 2.735 10 0 EFAEHO CCCc1ccc(CN2CCC[C@H](NC(=O)CC[NH+](C)C)C2)cc1 ZINC001398245048 1360413461 /nfs/dbraw/zinc/41/34/61/1360413461.db2.gz ZDSWAWKZPGXFJK-IBGZPJMESA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001398331784 1360468420 /nfs/dbraw/zinc/46/84/20/1360468420.db2.gz GJUJPTQSROYXLQ-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001398331784 1360468423 /nfs/dbraw/zinc/46/84/23/1360468423.db2.gz GJUJPTQSROYXLQ-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001398331750 1360468550 /nfs/dbraw/zinc/46/85/50/1360468550.db2.gz GJUJPTQSROYXLQ-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001398331750 1360468555 /nfs/dbraw/zinc/46/85/55/1360468555.db2.gz GJUJPTQSROYXLQ-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC001437197539 1387457894 /nfs/dbraw/zinc/45/78/94/1387457894.db2.gz AATFMFVTCZSSKZ-OXQOHEQNSA-N 1 3 349.494 2.802 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](NCC=C(Cl)Cl)C1CC1 ZINC001398413931 1360532270 /nfs/dbraw/zinc/53/22/70/1360532270.db2.gz SWHOQRLGBMNGMH-ZIAGYGMSSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](NCC=C(Cl)Cl)C1CC1 ZINC001398413931 1360532271 /nfs/dbraw/zinc/53/22/71/1360532271.db2.gz SWHOQRLGBMNGMH-ZIAGYGMSSA-N 1 3 348.318 2.664 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@H](NCc2ccccc2Cl)C2CC2)C1 ZINC001398445585 1360562746 /nfs/dbraw/zinc/56/27/46/1360562746.db2.gz LYYZKGNJPCAUDQ-KDOFPFPSSA-N 1 3 349.906 2.666 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@H](NCc2ccccc2Cl)C2CC2)C1 ZINC001398445585 1360562750 /nfs/dbraw/zinc/56/27/50/1360562750.db2.gz LYYZKGNJPCAUDQ-KDOFPFPSSA-N 1 3 349.906 2.666 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](CNC(=O)CN2CC[C@@H](C)C2)C2CC2)cc1 ZINC001398455325 1360573037 /nfs/dbraw/zinc/57/30/37/1360573037.db2.gz PPHOVJGQQLFVPL-OXQOHEQNSA-N 1 3 343.515 2.575 10 0 EFAEHO O=C([C@H]1CCCC[N@@H+]1C1CCCC1)N1CC[C@H](NC/C=C/Cl)C1 ZINC001398523557 1360623516 /nfs/dbraw/zinc/62/35/16/1360623516.db2.gz CNWICCRMMFKUGV-XLUSBLNCSA-N 1 3 339.911 2.727 10 0 EFAEHO O=C([C@H]1CCCC[N@H+]1C1CCCC1)N1CC[C@H](NC/C=C/Cl)C1 ZINC001398523557 1360623518 /nfs/dbraw/zinc/62/35/18/1360623518.db2.gz CNWICCRMMFKUGV-XLUSBLNCSA-N 1 3 339.911 2.727 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]2CN(Cc3cccc(F)c3)CC[C@H]21 ZINC001398596476 1360663808 /nfs/dbraw/zinc/66/38/08/1360663808.db2.gz SVMCQGGTOJFKDY-PKOBYXMFSA-N 1 3 347.478 2.590 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC[C@@H]2CCc3ccccc32)C1)N(C)C ZINC001398656752 1360691906 /nfs/dbraw/zinc/69/19/06/1360691906.db2.gz CRZJBBGCWSEZEW-GNBUJSLZSA-N 1 3 343.515 2.684 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cc3ccccc3o2)C1)N(C)C ZINC001398673156 1360703590 /nfs/dbraw/zinc/70/35/90/1360703590.db2.gz RYKUWQXPJZZJIX-FCEWJHQRSA-N 1 3 343.471 2.756 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001398706360 1360733439 /nfs/dbraw/zinc/73/34/39/1360733439.db2.gz SPNACYKLRBVEJC-MJGOQNOKSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001398706360 1360733442 /nfs/dbraw/zinc/73/34/42/1360733442.db2.gz SPNACYKLRBVEJC-MJGOQNOKSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[NH2+][C@H](C)c2ccccc2)C1 ZINC001398734614 1360750841 /nfs/dbraw/zinc/75/08/41/1360750841.db2.gz PFNVQNYIKJOOBJ-QZTJIDSGSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)C[NH2+]C[C@H]1CCCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001398738691 1360754476 /nfs/dbraw/zinc/75/44/76/1360754476.db2.gz KHKMMFROBKYEEJ-VQIMIIECSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]CCc1ccccc1 ZINC001437212945 1387473504 /nfs/dbraw/zinc/47/35/04/1387473504.db2.gz HTFBVKJVDCREPO-ROUUACIJSA-N 1 3 331.504 2.588 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCC[N@@H+]1CC1CC(C)(C)C1)N(C)C ZINC001398761353 1360769417 /nfs/dbraw/zinc/76/94/17/1360769417.db2.gz SNOGTKXWQHBNEH-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCC[N@H+]1CC1CC(C)(C)C1)N(C)C ZINC001398761353 1360769422 /nfs/dbraw/zinc/76/94/22/1360769422.db2.gz SNOGTKXWQHBNEH-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]CCc1ccccc1 ZINC001437212941 1387473968 /nfs/dbraw/zinc/47/39/68/1387473968.db2.gz HTFBVKJVDCREPO-MSOLQXFVSA-N 1 3 331.504 2.588 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H](C)[NH2+]CCc1ccccc1 ZINC001437213081 1387474334 /nfs/dbraw/zinc/47/43/34/1387474334.db2.gz ITOFQJOZWMSRNQ-HKUYNNGSSA-N 1 3 331.504 2.586 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC2CCC(NC/C(Cl)=C/Cl)CC2)CC[N@@H+]1C ZINC001398831815 1360820937 /nfs/dbraw/zinc/82/09/37/1360820937.db2.gz AOIZUJKHCOVJOD-DKVLMRQBSA-N 1 3 348.318 2.663 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC2CCC(NC/C(Cl)=C/Cl)CC2)CC[N@H+]1C ZINC001398831815 1360820939 /nfs/dbraw/zinc/82/09/39/1360820939.db2.gz AOIZUJKHCOVJOD-DKVLMRQBSA-N 1 3 348.318 2.663 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[NH2+]Cc2c(C)cc(C)cc2C)C1 ZINC001399252039 1361100167 /nfs/dbraw/zinc/10/01/67/1361100167.db2.gz RDAQZNAUMGBCON-IBGZPJMESA-N 1 3 345.531 2.892 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[C@@H]([NH2+]Cc2cc(C)ccc2F)C1 ZINC001399270864 1361112935 /nfs/dbraw/zinc/11/29/35/1361112935.db2.gz PXACIZBXSGAAHG-QZTJIDSGSA-N 1 3 349.494 2.993 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[C@H]([NH2+]Cc2cc(C)ccc2F)C1 ZINC001399270866 1361112949 /nfs/dbraw/zinc/11/29/49/1361112949.db2.gz PXACIZBXSGAAHG-ZWKOTPCHSA-N 1 3 349.494 2.993 10 0 EFAEHO C[C@H](CCNC(=O)CN(C)CC(C)(C)C)[NH2+]CC1CC(C)(C)C1 ZINC001399384076 1361185992 /nfs/dbraw/zinc/18/59/92/1361185992.db2.gz BERLYKPLRNHYJO-OAHLLOKOSA-N 1 3 325.541 2.885 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+]Cc1cccc(Cl)c1F ZINC001399427296 1361217011 /nfs/dbraw/zinc/21/70/11/1361217011.db2.gz BJZSOYJTVKDNSK-CYBMUJFWSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@H](C(=O)NCC[N@H+](C)[C@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001399501982 1361284193 /nfs/dbraw/zinc/28/41/93/1361284193.db2.gz OWIKGIXHYWKECQ-SJORKVTESA-N 1 3 337.895 2.716 10 0 EFAEHO CC[C@H](C(=O)NCC[N@@H+](C)[C@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001399501982 1361284197 /nfs/dbraw/zinc/28/41/97/1361284197.db2.gz OWIKGIXHYWKECQ-SJORKVTESA-N 1 3 337.895 2.716 10 0 EFAEHO CN(CCNC(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1)CCc1ccccc1F ZINC001399637733 1361392505 /nfs/dbraw/zinc/39/25/05/1361392505.db2.gz GBECAJTWVRKEMM-QZTJIDSGSA-N 1 3 349.494 2.537 10 0 EFAEHO CN(CCNC(=O)[C@H]1CCC[C@H]([NH+](C)C)C1)CCc1ccccc1F ZINC001399637740 1361392542 /nfs/dbraw/zinc/39/25/42/1361392542.db2.gz GBECAJTWVRKEMM-ROUUACIJSA-N 1 3 349.494 2.537 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@@H](C)CNC(=O)CN(C)C(C)C ZINC001437261924 1387515275 /nfs/dbraw/zinc/51/52/75/1387515275.db2.gz MQDUTHFNVKQOCB-AWEZNQCLSA-N 1 3 325.884 2.583 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](CNC(=O)CC[NH+](C)C)C2)c(Cl)c1 ZINC001399932831 1361589556 /nfs/dbraw/zinc/58/95/56/1361589556.db2.gz RRGOBNLSVPSFPX-HNNXBMFYSA-N 1 3 337.895 2.538 10 0 EFAEHO CC[C@H](C)C[NH2+][C@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001400076791 1361716831 /nfs/dbraw/zinc/71/68/31/1361716831.db2.gz CWVMQYSMNWDVLW-FUHWJXTLSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001400204339 1361842569 /nfs/dbraw/zinc/84/25/69/1361842569.db2.gz MXHTUPVLKZYIMR-MJGOQNOKSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001400204339 1361842575 /nfs/dbraw/zinc/84/25/75/1361842575.db2.gz MXHTUPVLKZYIMR-MJGOQNOKSA-N 1 3 349.563 2.981 10 0 EFAEHO C[NH+](C)CCC(=O)N(Cc1ccccc1)[C@@H]1CCCN(CCCF)C1 ZINC001400242878 1361877807 /nfs/dbraw/zinc/87/78/07/1361877807.db2.gz CSUVHQPCCATQFZ-LJQANCHMSA-N 1 3 349.494 2.791 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1C[NH+](CCCC2CCCC2)C1 ZINC001400570310 1362028697 /nfs/dbraw/zinc/02/86/97/1362028697.db2.gz IWNKKSRAPFQDMX-IAGOWNOFSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[C@@H]([NH2+]CC2CC3(CCC3)C2)C1 ZINC001437327765 1387547913 /nfs/dbraw/zinc/54/79/13/1387547913.db2.gz KYFAPUKJAWQQBD-QZTJIDSGSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)[C@H]1CCN(Cc2ccc(C(F)F)cc2)C1 ZINC001400708197 1362110896 /nfs/dbraw/zinc/11/08/96/1362110896.db2.gz MZHSMLYFINECLK-INIZCTEOSA-N 1 3 339.430 2.609 10 0 EFAEHO CCc1cccc(CN2CC[C@H](N(CC)C(=O)CC[NH+](C)C)C2)c1 ZINC001400770758 1362155257 /nfs/dbraw/zinc/15/52/57/1362155257.db2.gz UDURLXRGCNCXJO-IBGZPJMESA-N 1 3 331.504 2.624 10 0 EFAEHO Cc1ccc(C[NH2+]CC2(NC(=O)CN(C)C(C)C)CCCC2)c(C)n1 ZINC001400971605 1362310568 /nfs/dbraw/zinc/31/05/68/1362310568.db2.gz MKMFKKLCVVORBG-UHFFFAOYSA-N 1 3 346.519 2.557 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@](C)(NC(=O)CN(C)C(C)C)C1CC1 ZINC001401021309 1362367594 /nfs/dbraw/zinc/36/75/94/1362367594.db2.gz MBCOXQNKXBIKCG-FQEVSTJZSA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)C[NH2+][C@@H]1CCc2ccccc21 ZINC001401113643 1362452006 /nfs/dbraw/zinc/45/20/06/1362452006.db2.gz JMCNCLRLZSXSIK-DNVCBOLYSA-N 1 3 329.488 2.500 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC2(CN(CCCc3ccsc3)C2)CC1 ZINC001401195431 1362535680 /nfs/dbraw/zinc/53/56/80/1362535680.db2.gz SPSUAYRJUWNCBS-UHFFFAOYSA-N 1 3 349.544 2.557 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@H](C)N(C)C(=O)[C@@H]2CCCN2C)c(C)c1 ZINC001401200597 1362540560 /nfs/dbraw/zinc/54/05/60/1362540560.db2.gz JFEVAEOKDJRFCL-HKUYNNGSSA-N 1 3 331.504 2.643 10 0 EFAEHO CC(C)C[C@H](CNCc1ccccc1F)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001401283734 1362629940 /nfs/dbraw/zinc/62/99/40/1362629940.db2.gz QYRQDRIVLMDRPJ-KBAYOESNSA-N 1 3 349.494 2.786 10 0 EFAEHO CC(C)C[C@H](CNCc1ccccc1F)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001401283734 1362629943 /nfs/dbraw/zinc/62/99/43/1362629943.db2.gz QYRQDRIVLMDRPJ-KBAYOESNSA-N 1 3 349.494 2.786 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)cs1 ZINC001401299579 1362645704 /nfs/dbraw/zinc/64/57/04/1362645704.db2.gz NNSVMZJRYZFISP-YOEHRIQHSA-N 1 3 337.533 2.723 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(CF)cc2)[C@H](C)C1 ZINC001401304203 1362649368 /nfs/dbraw/zinc/64/93/68/1362649368.db2.gz WLXQSRPXPIKZNG-APWZRJJASA-N 1 3 349.494 2.823 10 0 EFAEHO CC[C@H](F)C[N@H+](C)CCC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001401311272 1362659979 /nfs/dbraw/zinc/65/99/79/1362659979.db2.gz WGGNOABFWJBSIP-KRWDZBQOSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)CCC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001401311272 1362659981 /nfs/dbraw/zinc/65/99/81/1362659981.db2.gz WGGNOABFWJBSIP-KRWDZBQOSA-N 1 3 329.504 2.635 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)cc1 ZINC001401344225 1362691478 /nfs/dbraw/zinc/69/14/78/1362691478.db2.gz OYHZRJWLUHOCAX-PKOBYXMFSA-N 1 3 331.504 2.567 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C(C)C ZINC001401351597 1362701906 /nfs/dbraw/zinc/70/19/06/1362701906.db2.gz IBWHCRQMUAPNNB-SFHVURJKSA-N 1 3 337.483 2.705 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@H+](C)C[C@H]2CCCC(F)(F)C2)CCC1 ZINC001401369293 1362719884 /nfs/dbraw/zinc/71/98/84/1362719884.db2.gz NUUAIVPKYXSRNW-HNNXBMFYSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@@H+](C)C[C@H]2CCCC(F)(F)C2)CCC1 ZINC001401369293 1362719886 /nfs/dbraw/zinc/71/98/86/1362719886.db2.gz NUUAIVPKYXSRNW-HNNXBMFYSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CC[N@H+](C)Cc1ccc(C2CC2)cc1)C(=O)CN(C)C1CCC1 ZINC001401371841 1362721399 /nfs/dbraw/zinc/72/13/99/1362721399.db2.gz WOVBGJXRVJQJQM-UHFFFAOYSA-N 1 3 343.515 2.939 10 0 EFAEHO CN(CC[N@@H+](C)Cc1ccc(C2CC2)cc1)C(=O)CN(C)C1CCC1 ZINC001401371841 1362721402 /nfs/dbraw/zinc/72/14/02/1362721402.db2.gz WOVBGJXRVJQJQM-UHFFFAOYSA-N 1 3 343.515 2.939 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](CNC(=O)C[C@@H]2CC[N@H+](C)C2)C(C)C)c1 ZINC001401380184 1362732780 /nfs/dbraw/zinc/73/27/80/1362732780.db2.gz LLXNNRFPUDVUHJ-QFBILLFUSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](CNC(=O)C[C@@H]2CC[N@@H+](C)C2)C(C)C)c1 ZINC001401380184 1362732783 /nfs/dbraw/zinc/73/27/83/1362732783.db2.gz LLXNNRFPUDVUHJ-QFBILLFUSA-N 1 3 349.494 2.706 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[N@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001401433859 1362797778 /nfs/dbraw/zinc/79/77/78/1362797778.db2.gz RCFHIPBBZJCOEJ-GJZGRUSLSA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[N@@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001401433859 1362797780 /nfs/dbraw/zinc/79/77/80/1362797780.db2.gz RCFHIPBBZJCOEJ-GJZGRUSLSA-N 1 3 333.467 2.542 10 0 EFAEHO CN(CCc1ccccc1)CCN(C)C(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001401433520 1362799923 /nfs/dbraw/zinc/79/99/23/1362799923.db2.gz CQUVZJRKJQBUQV-WOJBJXKFSA-N 1 3 345.531 2.740 10 0 EFAEHO CN(CCN(C)C(=O)C[C@@H]1CC[N@H+](C)C1)Cc1ccc(C2CC2)cc1 ZINC001401436363 1362803753 /nfs/dbraw/zinc/80/37/53/1362803753.db2.gz VLIBAECLHNCVMA-SFHVURJKSA-N 1 3 343.515 2.796 10 0 EFAEHO CN(CCN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1)Cc1ccc(C2CC2)cc1 ZINC001401436363 1362803755 /nfs/dbraw/zinc/80/37/55/1362803755.db2.gz VLIBAECLHNCVMA-SFHVURJKSA-N 1 3 343.515 2.796 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@@H](C)NC(=O)CN(C)C2CCC2)cc1 ZINC001401626166 1362980252 /nfs/dbraw/zinc/98/02/52/1362980252.db2.gz MYSZJNWTSAQOEC-MRXNPFEDSA-N 1 3 331.504 2.889 10 0 EFAEHO C[C@H](C[NH2+]CC1CCC(F)(F)CC1)NC(=O)C(C)(C)N1CCCC1 ZINC001401641535 1362992353 /nfs/dbraw/zinc/99/23/53/1362992353.db2.gz UHTJMACTNCNIIX-CQSZACIVSA-N 1 3 345.478 2.781 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)C[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001401769780 1363106180 /nfs/dbraw/zinc/10/61/80/1363106180.db2.gz NRUJFIOVAPDQTQ-JKSUJKDBSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)C[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001401769780 1363106184 /nfs/dbraw/zinc/10/61/84/1363106184.db2.gz NRUJFIOVAPDQTQ-JKSUJKDBSA-N 1 3 347.503 2.677 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@H+](C)Cc1cccc(C)c1 ZINC001401827382 1363170700 /nfs/dbraw/zinc/17/07/00/1363170700.db2.gz PLSNIGOAYZMECR-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)Cc1cccc(C)c1 ZINC001401827382 1363170703 /nfs/dbraw/zinc/17/07/03/1363170703.db2.gz PLSNIGOAYZMECR-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](C)CCNC(=O)CN1CC[C@@H](C)C1 ZINC001437404090 1387613160 /nfs/dbraw/zinc/61/31/60/1387613160.db2.gz RHRDGUSQYIGSSP-CRAIPNDOSA-N 1 3 331.504 2.630 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C[NH2+]Cc1cccc(F)c1)C1CC1 ZINC001401838805 1363177990 /nfs/dbraw/zinc/17/79/90/1363177990.db2.gz DDRAYKBHRNTLRB-OALUTQOASA-N 1 3 347.478 2.685 10 0 EFAEHO C[C@@H](C(=O)N[C@H](C[NH2+]CC1CCCC1)C1CC1)N1CCCCCC1 ZINC001401859731 1363194779 /nfs/dbraw/zinc/19/47/79/1363194779.db2.gz QAVZXZQOCHAGFB-QFBILLFUSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@H](C)[NH2+]Cc1ccccc1 ZINC001402035074 1363346232 /nfs/dbraw/zinc/34/62/32/1363346232.db2.gz GXVGOQKRBNRICS-HKUYNNGSSA-N 1 3 331.504 2.886 10 0 EFAEHO Cc1ccc(CN2CCC[C@@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)cc1 ZINC001402076012 1363381194 /nfs/dbraw/zinc/38/11/94/1363381194.db2.gz GLNLMMNXUQICNT-WOJBJXKFSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(CN2CCC[C@@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)cc1 ZINC001402076012 1363381199 /nfs/dbraw/zinc/38/11/99/1363381199.db2.gz GLNLMMNXUQICNT-WOJBJXKFSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccccc1CN1CC[C@@H](NC(=O)CC[C@@H]2CCC[N@H+]2C)C1 ZINC001402177442 1363484399 /nfs/dbraw/zinc/48/43/99/1363484399.db2.gz MUXHYRYOBOZXNU-MOPGFXCFSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccccc1CN1CC[C@@H](NC(=O)CC[C@@H]2CCC[N@@H+]2C)C1 ZINC001402177442 1363484403 /nfs/dbraw/zinc/48/44/03/1363484403.db2.gz MUXHYRYOBOZXNU-MOPGFXCFSA-N 1 3 329.488 2.560 10 0 EFAEHO CC[C@H](F)C[NH+]1CCC(C)(CNC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001402197719 1363505788 /nfs/dbraw/zinc/50/57/88/1363505788.db2.gz BLRCWFQLPIZQFF-JKSUJKDBSA-N 1 3 329.504 2.539 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@]1(C)CCC[N@H+](Cc2ccsc2)C1)N(C)C ZINC001402216959 1363534170 /nfs/dbraw/zinc/53/41/70/1363534170.db2.gz XTHFQMSYKKROBL-FUHWJXTLSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@]1(C)CCC[N@@H+](Cc2ccsc2)C1)N(C)C ZINC001402216959 1363534172 /nfs/dbraw/zinc/53/41/72/1363534172.db2.gz XTHFQMSYKKROBL-FUHWJXTLSA-N 1 3 337.533 2.807 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C1CC1 ZINC001402369116 1363629046 /nfs/dbraw/zinc/62/90/46/1363629046.db2.gz DRWMQRNBUSJYMG-IBGZPJMESA-N 1 3 331.504 2.628 10 0 EFAEHO CN(CCF)C[C@@H]1CCCN(C(=O)[C@H]2CCC[N@@H+]2C2CCCC2)C1 ZINC001402390902 1363649711 /nfs/dbraw/zinc/64/97/11/1363649711.db2.gz WAEWJIBSHFXUBH-FUHWJXTLSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)C[C@@H]1CCCN(C(=O)[C@H]2CCC[N@H+]2C2CCCC2)C1 ZINC001402390902 1363649714 /nfs/dbraw/zinc/64/97/14/1363649714.db2.gz WAEWJIBSHFXUBH-FUHWJXTLSA-N 1 3 339.499 2.533 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1CC[C@H](CNC(=O)Cc2nc[nH]c2C)CC1 ZINC001402405817 1363665065 /nfs/dbraw/zinc/66/50/65/1363665065.db2.gz DQUCTVCSYIUHMS-BZUAXINKSA-N 1 3 338.471 2.521 10 0 EFAEHO CC(C)c1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001402461248 1363707899 /nfs/dbraw/zinc/70/78/99/1363707899.db2.gz BLVQUYXLEITDCC-IBGZPJMESA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]2[C@H]1CC[N@@H+]2CCCF)N(CC)CC ZINC001402479461 1363723183 /nfs/dbraw/zinc/72/31/83/1363723183.db2.gz QTUMVBUNMAGXSS-BRWVUGGUSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]2[C@H]1CC[N@H+]2CCCF)N(CC)CC ZINC001402479461 1363723186 /nfs/dbraw/zinc/72/31/86/1363723186.db2.gz QTUMVBUNMAGXSS-BRWVUGGUSA-N 1 3 327.488 2.532 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccccc2C[N@H+](C)CC2CCC2)C1 ZINC001402483897 1363729850 /nfs/dbraw/zinc/72/98/50/1363729850.db2.gz ZVULHPANEFQIKO-QGZVFWFLSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccccc2C[N@@H+](C)CC2CCC2)C1 ZINC001402483897 1363729856 /nfs/dbraw/zinc/72/98/56/1363729856.db2.gz ZVULHPANEFQIKO-QGZVFWFLSA-N 1 3 343.515 2.877 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1csc(C)c1 ZINC001402485078 1363730752 /nfs/dbraw/zinc/73/07/52/1363730752.db2.gz ZGPGBORXRYEXKT-ZWKOTPCHSA-N 1 3 349.544 2.964 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1csc(C)c1 ZINC001402485078 1363730754 /nfs/dbraw/zinc/73/07/54/1363730754.db2.gz ZGPGBORXRYEXKT-ZWKOTPCHSA-N 1 3 349.544 2.964 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001437430159 1387641602 /nfs/dbraw/zinc/64/16/02/1387641602.db2.gz XCCPWHRFOAFMRA-CRAIPNDOSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C/Cl)[NH+](CC)CC ZINC001402547061 1363777260 /nfs/dbraw/zinc/77/72/60/1363777260.db2.gz IAWYMMAXHFSWOS-MESVLJAASA-N 1 3 341.927 2.971 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)C2(C[NH+](C)C)CCCCC2)CCC1 ZINC001402564686 1363792148 /nfs/dbraw/zinc/79/21/48/1363792148.db2.gz YMCMGQMBZXDYGW-MRXNPFEDSA-N 1 3 341.515 2.875 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(CNC(=O)c2cccc(CN(C)C)c2)CCC1 ZINC001402574263 1363802045 /nfs/dbraw/zinc/80/20/45/1363802045.db2.gz FXFPVUQFAUKIFS-KRWDZBQOSA-N 1 3 335.467 2.738 10 0 EFAEHO Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C3(C[NH+](C)C)CC3)C2)c(Cl)c1 ZINC001402601670 1363826076 /nfs/dbraw/zinc/82/60/76/1363826076.db2.gz AFUVTCURTGGHJF-IYBDPMFKSA-N 1 3 349.906 2.727 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001402610790 1363833486 /nfs/dbraw/zinc/83/34/86/1363833486.db2.gz OMGXFRVOFISLQL-ZWKOTPCHSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001402610790 1363833488 /nfs/dbraw/zinc/83/34/88/1363833488.db2.gz OMGXFRVOFISLQL-ZWKOTPCHSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2cc(C)ccc2C)C1)N(C)C ZINC001402627616 1363854816 /nfs/dbraw/zinc/85/48/16/1363854816.db2.gz JNCLSVRQOSNZMF-BMFAXAFESA-N 1 3 331.504 2.941 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2cccc(Cl)c2)C1)N(C)C ZINC001402630414 1363859142 /nfs/dbraw/zinc/85/91/42/1363859142.db2.gz MYOGZPDARMELAO-VZEFYGNVSA-N 1 3 337.895 2.978 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)cc2)C1)N(C)C ZINC001402630127 1363859193 /nfs/dbraw/zinc/85/91/93/1363859193.db2.gz MBPLHTSNUAXHDB-ZSGPHXLJSA-N 1 3 335.467 2.710 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccccc2C2CC2)C1)N(C)C ZINC001402636917 1363866609 /nfs/dbraw/zinc/86/66/09/1363866609.db2.gz XDUFPPXKBGQUDJ-WSTZPKSXSA-N 1 3 343.515 2.887 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC001402672614 1363921718 /nfs/dbraw/zinc/92/17/18/1363921718.db2.gz GDYHENIVXSEQBY-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001402672614 1363921720 /nfs/dbraw/zinc/92/17/20/1363921720.db2.gz GDYHENIVXSEQBY-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCC[N@@H+]1CC1CC(C)(C)C1)N(C)C ZINC001402738510 1363983764 /nfs/dbraw/zinc/98/37/64/1363983764.db2.gz SNOGTKXWQHBNEH-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCC[N@H+]1CC1CC(C)(C)C1)N(C)C ZINC001402738510 1363983769 /nfs/dbraw/zinc/98/37/69/1363983769.db2.gz SNOGTKXWQHBNEH-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001402759613 1364007066 /nfs/dbraw/zinc/00/70/66/1364007066.db2.gz TWQIZRCDVFVHMO-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C)([NH2+]Cc2ccccc2F)CC1 ZINC001402781228 1364029496 /nfs/dbraw/zinc/02/94/96/1364029496.db2.gz JUXXGWFEKVKDFK-UHFFFAOYSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H]1CCCCN1C(C)C ZINC001402797573 1364044759 /nfs/dbraw/zinc/04/47/59/1364044759.db2.gz YHEKNZQKSYHCOR-CENDIDJXSA-N 1 3 349.563 2.978 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H]1CCCCN1C(C)C ZINC001402797573 1364044761 /nfs/dbraw/zinc/04/47/61/1364044761.db2.gz YHEKNZQKSYHCOR-CENDIDJXSA-N 1 3 349.563 2.978 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1[C@H]2C[N@@H+]([C@H](CC)c3ccc(F)cc3)C[C@H]21)N(C)C ZINC001402801853 1364050606 /nfs/dbraw/zinc/05/06/06/1364050606.db2.gz YEAGCMZDRKPLGX-ZRSRNVLSSA-N 1 3 347.478 2.663 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1[C@H]2C[N@H+]([C@H](CC)c3ccc(F)cc3)C[C@H]21)N(C)C ZINC001402801853 1364050609 /nfs/dbraw/zinc/05/06/09/1364050609.db2.gz YEAGCMZDRKPLGX-ZRSRNVLSSA-N 1 3 347.478 2.663 10 0 EFAEHO C[C@@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001402822697 1364070075 /nfs/dbraw/zinc/07/00/75/1364070075.db2.gz KZYJNXAFIHNMDA-GJZGRUSLSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@@H](CCNC(=O)CN(C)C1CCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001402823885 1364071147 /nfs/dbraw/zinc/07/11/47/1364071147.db2.gz PCMGPWVDJJFNPG-HNAYVOBHSA-N 1 3 329.488 2.643 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)C[C@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001402911626 1364128199 /nfs/dbraw/zinc/12/81/99/1364128199.db2.gz AZFMRSHAIFXEEW-HZPDHXFCSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)C[C@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001402911626 1364128201 /nfs/dbraw/zinc/12/82/01/1364128201.db2.gz AZFMRSHAIFXEEW-HZPDHXFCSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H]2CC[N@H+](CC3CCC3)C2)C1 ZINC001402919597 1364134430 /nfs/dbraw/zinc/13/44/30/1364134430.db2.gz AKPVRGPMSSZUAM-RBUKOAKNSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H]2CC[N@@H+](CC3CCC3)C2)C1 ZINC001402919597 1364134432 /nfs/dbraw/zinc/13/44/32/1364134432.db2.gz AKPVRGPMSSZUAM-RBUKOAKNSA-N 1 3 335.536 2.687 10 0 EFAEHO CCc1ccc(C[NH2+]CC2CC(NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001402955138 1364160066 /nfs/dbraw/zinc/16/00/66/1364160066.db2.gz ZRBUDTLUYMOYKG-SOAGJPPSSA-N 1 3 345.531 2.820 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@H](C)c2cccc(C)c2)C1 ZINC001402955134 1364160270 /nfs/dbraw/zinc/16/02/70/1364160270.db2.gz ZORVPOUSSDLFOG-LRYGQEGESA-N 1 3 331.504 2.882 10 0 EFAEHO CCc1cccc(C[NH2+]CC2CC(NC(=O)[C@@H](CC)N(C)C)C2)c1 ZINC001402955008 1364160479 /nfs/dbraw/zinc/16/04/79/1364160479.db2.gz WZDSHPFJMWTKIP-CTWPCTMYSA-N 1 3 331.504 2.574 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCCC1)[C@H](C)[NH2+]CCc1ccccc1 ZINC001402989281 1364186388 /nfs/dbraw/zinc/18/63/88/1364186388.db2.gz YZYFFZKCYCZCLU-ZWKOTPCHSA-N 1 3 345.531 2.976 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cccc2ccccc21 ZINC001402997083 1364194568 /nfs/dbraw/zinc/19/45/68/1364194568.db2.gz HXPCEMSYXVGDMQ-DLBZAZTESA-N 1 3 339.483 2.776 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001403020430 1364221405 /nfs/dbraw/zinc/22/14/05/1364221405.db2.gz VELPGMTYEULORO-YJBOKZPZSA-N 1 3 329.488 2.643 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001403022572 1364224482 /nfs/dbraw/zinc/22/44/82/1364224482.db2.gz VWDOCWVFCLCZNI-HNNXBMFYSA-N 1 3 335.467 2.603 10 0 EFAEHO C[C@@H](NCc1ccccc1Cl)[C@H](C)NC(=O)C1(C[NH+](C)C)CC1 ZINC001403023517 1364225126 /nfs/dbraw/zinc/22/51/26/1364225126.db2.gz CZBGNOGACHVKBO-KGLIPLIRSA-N 1 3 337.895 2.665 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)CNC(=O)[C@@H]2CCCCN2C(C)C)cc1 ZINC001403050103 1364254029 /nfs/dbraw/zinc/25/40/29/1364254029.db2.gz OUKWXTSVYYXOQM-QUCCMNQESA-N 1 3 345.531 2.895 10 0 EFAEHO Cc1ccc(CN[C@@H](C)CNC(=O)C2CC[NH+](C)CC2)c(Cl)c1 ZINC001403056783 1364261924 /nfs/dbraw/zinc/26/19/24/1364261924.db2.gz YEANZTZCYWIWGD-AWEZNQCLSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(C[NH2+]CC(C)(C)CN(C)C(=O)CN(C)C(C)C)c(C)n1 ZINC001403085869 1364290433 /nfs/dbraw/zinc/29/04/33/1364290433.db2.gz OGIUTZNNSNOBTD-UHFFFAOYSA-N 1 3 348.535 2.613 10 0 EFAEHO Cc1ccc(C[NH2+]CC(C)(C)CN(C)C(=O)CN(C)C(C)C)cc1 ZINC001403085584 1364291007 /nfs/dbraw/zinc/29/10/07/1364291007.db2.gz MIFSVGAGKBGCLS-UHFFFAOYSA-N 1 3 333.520 2.909 10 0 EFAEHO COc1cccc(CN(C)[C@H](C)CNC(=O)[C@H]2CCC[N@@H+]2C(C)C)c1 ZINC001403111218 1364322490 /nfs/dbraw/zinc/32/24/90/1364322490.db2.gz DQCRBPRLAQCKRI-VQIMIIECSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc(CN(C)[C@H](C)CNC(=O)[C@H]2CCC[N@H+]2C(C)C)c1 ZINC001403111218 1364322495 /nfs/dbraw/zinc/32/24/95/1364322495.db2.gz DQCRBPRLAQCKRI-VQIMIIECSA-N 1 3 347.503 2.505 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001403144657 1364362011 /nfs/dbraw/zinc/36/20/11/1364362011.db2.gz ONYLDSHZGJFKID-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001403144657 1364362015 /nfs/dbraw/zinc/36/20/15/1364362015.db2.gz ONYLDSHZGJFKID-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)[N@H+](C)CC1CCC2(CC2)CC1 ZINC001403194395 1364422311 /nfs/dbraw/zinc/42/23/11/1364422311.db2.gz IHRJAYKEKGMZQW-AWEZNQCLSA-N 1 3 332.492 2.668 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001403194395 1364422314 /nfs/dbraw/zinc/42/23/14/1364422314.db2.gz IHRJAYKEKGMZQW-AWEZNQCLSA-N 1 3 332.492 2.668 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CCCC1 ZINC001403266858 1364479546 /nfs/dbraw/zinc/47/95/46/1364479546.db2.gz VOSREEVYZGBSBI-MJGOQNOKSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]([NH2+]CCc2cccs2)C1 ZINC001403270923 1364483109 /nfs/dbraw/zinc/48/31/09/1364483109.db2.gz FISYLHAUYUWFQF-HOTGVXAUSA-N 1 3 337.533 2.648 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]([NH2+]CCc2ccccc2)C1 ZINC001403274678 1364487825 /nfs/dbraw/zinc/48/78/25/1364487825.db2.gz IFSQSNREQJNIAI-RTBURBONSA-N 1 3 331.504 2.586 10 0 EFAEHO CCc1cccc(CN2CC([C@H](C)NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c1 ZINC001403321556 1364538857 /nfs/dbraw/zinc/53/88/57/1364538857.db2.gz GTECKDQXFOTWPT-LPHOPBHVSA-N 1 3 343.515 2.527 10 0 EFAEHO CCc1cccc(CN2CC([C@H](C)NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c1 ZINC001403321556 1364538861 /nfs/dbraw/zinc/53/88/61/1364538861.db2.gz GTECKDQXFOTWPT-LPHOPBHVSA-N 1 3 343.515 2.527 10 0 EFAEHO Cc1cccc(C[N@@H+](C)[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001403329822 1364547388 /nfs/dbraw/zinc/54/73/88/1364547388.db2.gz UWYAZINRTHWMEW-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1cccc(C[N@H+](C)[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001403329822 1364547393 /nfs/dbraw/zinc/54/73/93/1364547393.db2.gz UWYAZINRTHWMEW-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO C[C@@H](NC(=O)CC[NH+](C)C)C1CN(Cc2ccc(C3CCC3)cc2)C1 ZINC001403330535 1364548119 /nfs/dbraw/zinc/54/81/19/1364548119.db2.gz UBAUZANHNJBHOL-MRXNPFEDSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](CC2CCC(F)(F)CC2)C1)N(C)C ZINC001403341315 1364555970 /nfs/dbraw/zinc/55/59/70/1364555970.db2.gz BFYFGUJHMSPDEP-XJKSGUPXSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@H+](CCC2CC2)CC1(C)C)N1CCCC1 ZINC001403366447 1364578124 /nfs/dbraw/zinc/57/81/24/1364578124.db2.gz WTWOMEUXXGSCJK-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@@H+](CCC2CC2)CC1(C)C)N1CCCC1 ZINC001403366447 1364578126 /nfs/dbraw/zinc/57/81/26/1364578126.db2.gz WTWOMEUXXGSCJK-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@H+](CCC2CC2)CC1(C)C)N1CCCC1 ZINC001403366441 1364578162 /nfs/dbraw/zinc/57/81/62/1364578162.db2.gz WTWOMEUXXGSCJK-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@@H+](CCC2CC2)CC1(C)C)N1CCCC1 ZINC001403366441 1364578164 /nfs/dbraw/zinc/57/81/64/1364578164.db2.gz WTWOMEUXXGSCJK-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@]2(C)C[N@H+](Cc3ccsc3)C[C@]2(C)C1 ZINC001403405858 1364610662 /nfs/dbraw/zinc/61/06/62/1364610662.db2.gz RLRQGNYRORSYHX-KDURUIRLSA-N 1 3 349.544 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@]2(C)C[N@@H+](Cc3ccsc3)C[C@]2(C)C1 ZINC001403405858 1364610664 /nfs/dbraw/zinc/61/06/64/1364610664.db2.gz RLRQGNYRORSYHX-KDURUIRLSA-N 1 3 349.544 2.759 10 0 EFAEHO CC(C)CC[N@H+]1C[C@@H]2[C@@H](CNC(=O)[C@@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001403409692 1364613830 /nfs/dbraw/zinc/61/38/30/1364613830.db2.gz JLVZJADGDPILNI-MKXGPGLRSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)CC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)[C@@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001403409692 1364613836 /nfs/dbraw/zinc/61/38/36/1364613836.db2.gz JLVZJADGDPILNI-MKXGPGLRSA-N 1 3 335.536 2.591 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001403438725 1364641952 /nfs/dbraw/zinc/64/19/52/1364641952.db2.gz AAXPSNSRIXTQLY-SJLPKXTDSA-N 1 3 331.504 2.630 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cc2ccccc2o1 ZINC001403440427 1364642678 /nfs/dbraw/zinc/64/26/78/1364642678.db2.gz CPXSUKJHVDTLRU-JKSUJKDBSA-N 1 3 343.471 2.759 10 0 EFAEHO C[NH+]1CCC(CC(=O)N[C@H]2C[C@H](CNC/C(Cl)=C\Cl)C2)CC1 ZINC001403452329 1364654427 /nfs/dbraw/zinc/65/44/27/1364654427.db2.gz SVXIMUCVLSQYAA-AGQHDUKJSA-N 1 3 348.318 2.522 10 0 EFAEHO COc1cccc([C@H](C)N(C)CCNC(=O)[C@@H]2CCC[N@@H+]2C(C)C)c1 ZINC001403555409 1364758130 /nfs/dbraw/zinc/75/81/30/1364758130.db2.gz GFUFPLCIGCSNAC-LPHOPBHVSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@H](C)N(C)CCNC(=O)[C@@H]2CCC[N@H+]2C(C)C)c1 ZINC001403555409 1364758132 /nfs/dbraw/zinc/75/81/32/1364758132.db2.gz GFUFPLCIGCSNAC-LPHOPBHVSA-N 1 3 347.503 2.677 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN(C)C1CCC1)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001403561212 1364763724 /nfs/dbraw/zinc/76/37/24/1364763724.db2.gz VCJFJGPKRWZXDL-HNNXBMFYSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@@H](CN(C)C(=O)C[C@H]1CC[N@H+](C)C1)NCc1ccccc1Cl ZINC001403615926 1364819572 /nfs/dbraw/zinc/81/95/72/1364819572.db2.gz QIQJNBUDVNPMNU-LSDHHAIUSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CN(C)C(=O)C[C@H]1CC[N@@H+](C)C1)NCc1ccccc1Cl ZINC001403615926 1364819575 /nfs/dbraw/zinc/81/95/75/1364819575.db2.gz QIQJNBUDVNPMNU-LSDHHAIUSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCN(C)Cc2ccccc2C2CC2)CC[N@@H+]1C ZINC001403665121 1364854324 /nfs/dbraw/zinc/85/43/24/1364854324.db2.gz LLGITEZLEOUBTO-WMZOPIPTSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCN(C)Cc2ccccc2C2CC2)CC[N@H+]1C ZINC001403665121 1364854330 /nfs/dbraw/zinc/85/43/30/1364854330.db2.gz LLGITEZLEOUBTO-WMZOPIPTSA-N 1 3 343.515 2.842 10 0 EFAEHO CN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)[C@@H]1CCc2c1cccc2Cl ZINC001403728784 1364887492 /nfs/dbraw/zinc/88/74/92/1364887492.db2.gz DCJLEFBWPRYWRZ-KBXCAEBGSA-N 1 3 349.906 2.717 10 0 EFAEHO CN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)[C@@H]1CCc2c1cccc2Cl ZINC001403728784 1364887495 /nfs/dbraw/zinc/88/74/95/1364887495.db2.gz DCJLEFBWPRYWRZ-KBXCAEBGSA-N 1 3 349.906 2.717 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CC2CCC(F)(F)CC2)[C@@H]1C ZINC001403740933 1364894646 /nfs/dbraw/zinc/89/46/46/1364894646.db2.gz GJNIRZYGCUFUQR-GOEBONIOSA-N 1 3 345.478 2.731 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc3cc[nH]c3c2)[C@@H]1C ZINC001403752676 1364902785 /nfs/dbraw/zinc/90/27/85/1364902785.db2.gz PGZBIZQFSUMYIS-MAUKXSAKSA-N 1 3 342.487 2.587 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CC(CC)CC)[C@H]2C1 ZINC001403795001 1364947028 /nfs/dbraw/zinc/94/70/28/1364947028.db2.gz VPSDKGVCGIZFCL-GBESFXJTSA-N 1 3 337.552 2.981 10 0 EFAEHO CCN(CCNC(=O)CC[NH+](C)C)Cc1ccc(Cl)cc1C ZINC001403908606 1365030388 /nfs/dbraw/zinc/03/03/88/1365030388.db2.gz PXWUZKPWJSCVRV-UHFFFAOYSA-N 1 3 325.884 2.538 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21)Cc1cccc(C)c1 ZINC001403934229 1365064521 /nfs/dbraw/zinc/06/45/21/1365064521.db2.gz YFMBLULCNJLVBM-PMACEKPBSA-N 1 3 343.515 2.950 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21)Cc1cccc(C)c1 ZINC001403934229 1365064524 /nfs/dbraw/zinc/06/45/24/1365064524.db2.gz YFMBLULCNJLVBM-PMACEKPBSA-N 1 3 343.515 2.950 10 0 EFAEHO CCN(CCNC(=O)C[NH+]1[C@H](C)CC[C@H]1C)Cc1ccc(OC)cc1 ZINC001403948783 1365091121 /nfs/dbraw/zinc/09/11/21/1365091121.db2.gz JWXTUCVJKPVGKQ-IAGOWNOFSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C1CC[NH+](CCC(C)(C)C)CC1)N(C)C ZINC001403987965 1365137487 /nfs/dbraw/zinc/13/74/87/1365137487.db2.gz SVOMDXFIBVAPPV-WBVHZDCISA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1cc(CN2CCC[C@H]2CNC(=O)C[C@@H]2CC[N@@H+](C)C2)c(C)s1 ZINC001404021179 1365177563 /nfs/dbraw/zinc/17/75/63/1365177563.db2.gz MTHDYLARBPCXHO-WMZOPIPTSA-N 1 3 349.544 2.787 10 0 EFAEHO Cc1cc(CN2CCC[C@H]2CNC(=O)C[C@@H]2CC[N@H+](C)C2)c(C)s1 ZINC001404021179 1365177566 /nfs/dbraw/zinc/17/75/66/1365177566.db2.gz MTHDYLARBPCXHO-WMZOPIPTSA-N 1 3 349.544 2.787 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC001404090275 1365250230 /nfs/dbraw/zinc/25/02/30/1365250230.db2.gz ULGJPWJGNCSPLB-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@@H+](CC[C@H]2CCCC2(F)F)C1 ZINC001404090275 1365250234 /nfs/dbraw/zinc/25/02/34/1365250234.db2.gz ULGJPWJGNCSPLB-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2F)C1 ZINC001404106786 1365266285 /nfs/dbraw/zinc/26/62/85/1365266285.db2.gz RVASMVVNAWEKIQ-HOTGVXAUSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2F)C1 ZINC001404106786 1365266290 /nfs/dbraw/zinc/26/62/90/1365266290.db2.gz RVASMVVNAWEKIQ-HOTGVXAUSA-N 1 3 335.467 2.665 10 0 EFAEHO CN(CCNC(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21)Cc1ccc(CF)cc1 ZINC001437528540 1387732967 /nfs/dbraw/zinc/73/29/67/1387732967.db2.gz BFMIWECZABLFJY-OALUTQOASA-N 1 3 347.478 2.721 10 0 EFAEHO CN(CCNC(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21)Cc1ccc(CF)cc1 ZINC001437528540 1387732971 /nfs/dbraw/zinc/73/29/71/1387732971.db2.gz BFMIWECZABLFJY-OALUTQOASA-N 1 3 347.478 2.721 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@H+](CC2CCC3(CC3)CC2)C2CC2)C1 ZINC001404267701 1365415084 /nfs/dbraw/zinc/41/50/84/1365415084.db2.gz HFUWZLYTPDJPPN-KRWDZBQOSA-N 1 3 347.547 2.879 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@@H+](CC2CCC3(CC3)CC2)C2CC2)C1 ZINC001404267701 1365415088 /nfs/dbraw/zinc/41/50/88/1365415088.db2.gz HFUWZLYTPDJPPN-KRWDZBQOSA-N 1 3 347.547 2.879 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)C[NH+]2[C@@H](C)CC[C@@H]2C)C2CC2)cc1 ZINC001404298237 1365436375 /nfs/dbraw/zinc/43/63/75/1365436375.db2.gz NLCLQQWMTANWCX-ROUUACIJSA-N 1 3 343.515 2.948 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[NH2+][C@@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001404318621 1365447419 /nfs/dbraw/zinc/44/74/19/1365447419.db2.gz MRTIVSYWKPSPIT-IAGOWNOFSA-N 1 3 337.895 2.716 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1)[C@@H]1CCN(CC)C1 ZINC001404437268 1365541907 /nfs/dbraw/zinc/54/19/07/1365541907.db2.gz HWJMBGUSZSEXLL-PKOBYXMFSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@H+](C2CCCCC2)C1)[C@@H]1CCN(CC)C1 ZINC001404437268 1365541910 /nfs/dbraw/zinc/54/19/10/1365541910.db2.gz HWJMBGUSZSEXLL-PKOBYXMFSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@@H](c1ccc(Cl)cc1)N(C)CCNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001437543574 1387748849 /nfs/dbraw/zinc/74/88/49/1387748849.db2.gz ZHCYTFDAGWKHNR-LSDHHAIUSA-N 1 3 337.895 2.791 10 0 EFAEHO C[C@@H](c1ccc(Cl)cc1)N(C)CCNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001437543574 1387748854 /nfs/dbraw/zinc/74/88/54/1387748854.db2.gz ZHCYTFDAGWKHNR-LSDHHAIUSA-N 1 3 337.895 2.791 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H]1CC[N@H+](Cc2ccsc2)C1 ZINC001404538761 1365636832 /nfs/dbraw/zinc/63/68/32/1365636832.db2.gz BUHLDZSKHHQJBJ-FUHWJXTLSA-N 1 3 349.544 2.951 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H]1CC[N@@H+](Cc2ccsc2)C1 ZINC001404538761 1365636835 /nfs/dbraw/zinc/63/68/35/1365636835.db2.gz BUHLDZSKHHQJBJ-FUHWJXTLSA-N 1 3 349.544 2.951 10 0 EFAEHO CN(C/C=C/Cl)CC1CCN(C(=O)C(C)(C)[NH+]2CCCC2)CC1 ZINC001404619523 1365720665 /nfs/dbraw/zinc/72/06/65/1365720665.db2.gz NKTBFNTWTXQBAQ-RMKNXTFCSA-N 1 3 341.927 2.784 10 0 EFAEHO CC[C@H](C(=O)NCC1CN([C@H]2CCc3ccccc32)C1)[NH+](CC)CC ZINC001404907873 1365899331 /nfs/dbraw/zinc/89/93/31/1365899331.db2.gz OMSCEHMSLJLIQY-UXHICEINSA-N 1 3 343.515 2.842 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@H+](Cc2ccc(C)cc2)C1 ZINC001405183539 1366093755 /nfs/dbraw/zinc/09/37/55/1366093755.db2.gz NETFEYWQZRCSKI-QUCCMNQESA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@@H+](Cc2ccc(C)cc2)C1 ZINC001405183539 1366093758 /nfs/dbraw/zinc/09/37/58/1366093758.db2.gz NETFEYWQZRCSKI-QUCCMNQESA-N 1 3 343.515 2.760 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc(C)nc1C ZINC001405269920 1366126350 /nfs/dbraw/zinc/12/63/50/1366126350.db2.gz HZAJSKDCYKCVIU-SFHVURJKSA-N 1 3 346.519 2.557 10 0 EFAEHO CC[C@H](F)C[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CCCN2C(C)C)CC1 ZINC001405522641 1366265897 /nfs/dbraw/zinc/26/58/97/1366265897.db2.gz RGPYJYSBLDHTHF-QAETUUGQSA-N 1 3 327.488 2.624 10 0 EFAEHO CC(C)CC[NH+]1CCC(CCNC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001405549609 1366286661 /nfs/dbraw/zinc/28/66/61/1366286661.db2.gz ADSVVZBOJWAUPK-SFHVURJKSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@H](F)CNCc1ccc(CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC001405576555 1366305282 /nfs/dbraw/zinc/30/52/82/1366305282.db2.gz XCCJGIGBPINFHU-SNRMKQJTSA-N 1 3 349.494 2.871 10 0 EFAEHO CC[C@H](F)CNCc1ccc(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC001405576555 1366305284 /nfs/dbraw/zinc/30/52/84/1366305284.db2.gz XCCJGIGBPINFHU-SNRMKQJTSA-N 1 3 349.494 2.871 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@H]1CCc2ccccc21 ZINC001405608874 1366312568 /nfs/dbraw/zinc/31/25/68/1366312568.db2.gz VJDPBOQGAARESS-MJGOQNOKSA-N 1 3 329.488 2.595 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(CC[N@H+](CC3CCCC3)C2)CC1 ZINC001405638468 1366320242 /nfs/dbraw/zinc/32/02/42/1366320242.db2.gz ZJXIOLHSBHHJMK-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(CC[N@@H+](CC3CCCC3)C2)CC1 ZINC001405638468 1366320245 /nfs/dbraw/zinc/32/02/45/1366320245.db2.gz ZJXIOLHSBHHJMK-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN(C)CC(C)(C)C)c(C)n1 ZINC001405860758 1366470185 /nfs/dbraw/zinc/47/01/85/1366470185.db2.gz IINPURWLOCKVEA-MRXNPFEDSA-N 1 3 348.535 2.613 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)N(C)C(=O)CN(C)CC(C)(C)C)c(C)n1 ZINC001405860733 1366470316 /nfs/dbraw/zinc/47/03/16/1366470316.db2.gz IINPURWLOCKVEA-INIZCTEOSA-N 1 3 348.535 2.613 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]C[C@H](C)N(C)C(=O)Cc2c[nH]cn2)c1 ZINC001405866417 1366475381 /nfs/dbraw/zinc/47/53/81/1366475381.db2.gz GHRWHLFFJDFYMB-JKSUJKDBSA-N 1 3 328.460 2.767 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)c(C)s1 ZINC001405871498 1366480189 /nfs/dbraw/zinc/48/01/89/1366480189.db2.gz QSPUBAFZYCORDN-ZIAGYGMSSA-N 1 3 337.533 2.643 10 0 EFAEHO C[C@H](F)CC[N@H+](C)CCC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001405973811 1367033239 /nfs/dbraw/zinc/03/32/39/1367033239.db2.gz OBWNFJVCEROGLG-INIZCTEOSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)CCC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001405973811 1367033244 /nfs/dbraw/zinc/03/32/44/1367033244.db2.gz OBWNFJVCEROGLG-INIZCTEOSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CC[NH+](C)C)NCc1sccc1Cl ZINC001406037564 1367126571 /nfs/dbraw/zinc/12/65/71/1367126571.db2.gz LCNMVAUGTFKOGP-CYBMUJFWSA-N 1 3 331.913 2.584 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]Cc1ccccn1 ZINC001406054112 1367153465 /nfs/dbraw/zinc/15/34/65/1367153465.db2.gz YEUWTVUYBFSTTH-RTBURBONSA-N 1 3 346.519 2.575 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccc(C)c(F)c1)C(C)C)N(C)C ZINC001406061590 1367163792 /nfs/dbraw/zinc/16/37/92/1367163792.db2.gz HTMXOOVIQFNETG-QZTJIDSGSA-N 1 3 337.483 2.705 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]([NH2+]CC1CC2(CCC2)C1)C(C)C ZINC001406075055 1367185878 /nfs/dbraw/zinc/18/58/78/1367185878.db2.gz YQWSUVPDSZVROD-KRWDZBQOSA-N 1 3 332.492 2.571 10 0 EFAEHO C[C@@H](c1ccccc1)N(C)CCN(C)C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001406120964 1367266240 /nfs/dbraw/zinc/26/62/40/1367266240.db2.gz CUZIFWZEQKVONJ-LNLFQRSKSA-N 1 3 331.504 2.868 10 0 EFAEHO C[C@@H](c1ccccc1)N(C)CCN(C)C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001406120964 1367266242 /nfs/dbraw/zinc/26/62/42/1367266242.db2.gz CUZIFWZEQKVONJ-LNLFQRSKSA-N 1 3 331.504 2.868 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2ccc(Cl)cc21)C(=O)[C@@H]1CC[N@H+](C)C1 ZINC001406172205 1367364778 /nfs/dbraw/zinc/36/47/78/1367364778.db2.gz XRRITQCGYJBLIK-CRAIPNDOSA-N 1 3 349.906 2.669 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2ccc(Cl)cc21)C(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001406172205 1367364786 /nfs/dbraw/zinc/36/47/86/1367364786.db2.gz XRRITQCGYJBLIK-CRAIPNDOSA-N 1 3 349.906 2.669 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@H]3CN(C(=O)CN(C)C(C)C)CC[C@@H]32)cs1 ZINC001406178189 1367374484 /nfs/dbraw/zinc/37/44/84/1367374484.db2.gz HFNSKXSKDLDTCB-ROUUACIJSA-N 1 3 349.544 2.820 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@H]3CN(C(=O)CN(C)C(C)C)CC[C@@H]32)cs1 ZINC001406178189 1367374485 /nfs/dbraw/zinc/37/44/85/1367374485.db2.gz HFNSKXSKDLDTCB-ROUUACIJSA-N 1 3 349.544 2.820 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCC[C@H]2NC(=O)CN(C)C(C)C)cc1F ZINC001406181118 1367378532 /nfs/dbraw/zinc/37/85/32/1367378532.db2.gz ATNWUUVDHOFBNJ-IEBWSBKVSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2CCC2CCCC2)C1 ZINC001406203058 1367400008 /nfs/dbraw/zinc/40/00/08/1367400008.db2.gz YYBJEKRDIOXZSJ-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2CCC2CCCC2)C1 ZINC001406203058 1367400014 /nfs/dbraw/zinc/40/00/14/1367400014.db2.gz YYBJEKRDIOXZSJ-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CNCc2cc3ccccc3o2)CC[N@@H+]1C ZINC001406363488 1367524511 /nfs/dbraw/zinc/52/45/11/1367524511.db2.gz WCOHNFBIEDGURV-FHLIZLRMSA-N 1 3 343.471 2.757 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CNCc2cc3ccccc3o2)CC[N@H+]1C ZINC001406363488 1367524516 /nfs/dbraw/zinc/52/45/16/1367524516.db2.gz WCOHNFBIEDGURV-FHLIZLRMSA-N 1 3 343.471 2.757 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCCN2C(C)C)cs1 ZINC001406414714 1367563116 /nfs/dbraw/zinc/56/31/16/1367563116.db2.gz YOCJMUOKSXWZOS-RHSMWYFYSA-N 1 3 337.533 2.914 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCCN2CC)cc1 ZINC001406428151 1367579588 /nfs/dbraw/zinc/57/95/88/1367579588.db2.gz DYSLNIBWBOWUOB-VQIMIIECSA-N 1 3 331.504 2.718 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1cc2ccccc2o1 ZINC001406463636 1367616840 /nfs/dbraw/zinc/61/68/40/1367616840.db2.gz BNALZIQUPGHRQV-MAUKXSAKSA-N 1 3 343.471 2.900 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1cc2ccccc2o1 ZINC001406463636 1367616850 /nfs/dbraw/zinc/61/68/50/1367616850.db2.gz BNALZIQUPGHRQV-MAUKXSAKSA-N 1 3 343.471 2.900 10 0 EFAEHO CCN(CCNC(=O)C[NH+]1[C@H](C)CC[C@H]1C)Cc1cc(F)ccc1C ZINC001437648779 1387889596 /nfs/dbraw/zinc/88/95/96/1387889596.db2.gz IJMURNJAEKEICS-IAGOWNOFSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)C2(C[NH+](C)C)CC2)c(Cl)c1 ZINC001406512195 1367668665 /nfs/dbraw/zinc/66/86/65/1367668665.db2.gz AOKBXSFOZIQBBY-AWEZNQCLSA-N 1 3 337.895 2.585 10 0 EFAEHO C[C@@H](C[NH2+]CC1CC(C)(C)C1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001406527312 1367686917 /nfs/dbraw/zinc/68/69/17/1367686917.db2.gz IMSDUJNFOREKEX-IFXJQAMLSA-N 1 3 341.515 2.729 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCCN2C(C)C)c1 ZINC001406531055 1367692569 /nfs/dbraw/zinc/69/25/69/1367692569.db2.gz GGTNPWONPKYKQU-HKUYNNGSSA-N 1 3 331.504 2.852 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(F)cc1)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001406612070 1367804755 /nfs/dbraw/zinc/80/47/55/1367804755.db2.gz FQGNVWITWUOWOM-MRXNPFEDSA-N 1 3 347.478 2.638 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)cc1F ZINC001406641653 1367848822 /nfs/dbraw/zinc/84/88/22/1367848822.db2.gz YHBFKTKQSZQWMM-AEFFLSMTSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)cc1F ZINC001406641653 1367848825 /nfs/dbraw/zinc/84/88/25/1367848825.db2.gz YHBFKTKQSZQWMM-AEFFLSMTSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1sccc1Cl)C1CC1)N(C)C ZINC001406781165 1368042128 /nfs/dbraw/zinc/04/21/28/1368042128.db2.gz JYYGLMSIGCEUIN-UONOGXRCSA-N 1 3 343.924 2.726 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@@H]1CC[N@@H+]1CC1CCCCCC1 ZINC001406836903 1368111029 /nfs/dbraw/zinc/11/10/29/1368111029.db2.gz STEWUTOPEWWEHC-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@@H]1CC[N@H+]1CC1CCCCCC1 ZINC001406836903 1368111034 /nfs/dbraw/zinc/11/10/34/1368111034.db2.gz STEWUTOPEWWEHC-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+][C@@H](C)c1cccc(F)c1)C1CC1 ZINC001406841077 1368115382 /nfs/dbraw/zinc/11/53/82/1368115382.db2.gz ZVBLLECGTFFIMW-KSSFIOAISA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+][C@H](C)c2ccccc2)CC1 ZINC001406923378 1368217480 /nfs/dbraw/zinc/21/74/80/1368217480.db2.gz XJKVOBTXAYPFLC-SJLPKXTDSA-N 1 3 329.488 2.859 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+][C@@H](C)c2ccc(F)cc2)CC1 ZINC001406924023 1368218365 /nfs/dbraw/zinc/21/83/65/1368218365.db2.gz YUDDLEBCTWOZGU-YJBOKZPZSA-N 1 3 347.478 2.998 10 0 EFAEHO C[C@H](C(=O)NCC1(NCc2ccsc2)CC1)[NH+]1CCCCCC1 ZINC001406982824 1368277525 /nfs/dbraw/zinc/27/75/25/1368277525.db2.gz WQWJUTDEGSMPEJ-OAHLLOKOSA-N 1 3 335.517 2.751 10 0 EFAEHO Cc1cccc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@@H]3C)CC2)c1 ZINC001407010225 1368318398 /nfs/dbraw/zinc/31/83/98/1368318398.db2.gz RPYPHIHYRRUTFK-CALCHBBNSA-N 1 3 329.488 2.606 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@]2(CC[N@H+](Cc3ccsc3)C2)C1 ZINC001407030822 1368351893 /nfs/dbraw/zinc/35/18/93/1368351893.db2.gz PXQJIJGHWQWYFW-SFHVURJKSA-N 1 3 335.517 2.514 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@]2(CC[N@@H+](Cc3ccsc3)C2)C1 ZINC001407030822 1368351900 /nfs/dbraw/zinc/35/19/00/1368351900.db2.gz PXQJIJGHWQWYFW-SFHVURJKSA-N 1 3 335.517 2.514 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)CCN1C(=O)CN1CCCC1 ZINC001407082287 1368405541 /nfs/dbraw/zinc/40/55/41/1368405541.db2.gz FXJSIUULVIUZPQ-KIKKHNSFSA-N 1 3 341.499 2.765 10 0 EFAEHO CC(C)C[NH+]1CCC(C)(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001407132834 1368468992 /nfs/dbraw/zinc/46/89/92/1368468992.db2.gz YWGSKPVRPYAKQW-IBGZPJMESA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C[NH2+]CC1CCC1)C1CCCC1 ZINC001407149563 1368498239 /nfs/dbraw/zinc/49/82/39/1368498239.db2.gz QXYOCZGYOKSAHL-MOPGFXCFSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]CC1CCC1)C1CCCC1 ZINC001407149587 1368498772 /nfs/dbraw/zinc/49/87/72/1368498772.db2.gz QXYOCZGYOKSAHL-RBUKOAKNSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]CC1CC(F)(F)C1)C1CCCC1 ZINC001407180527 1368550277 /nfs/dbraw/zinc/55/02/77/1368550277.db2.gz ZXNNBVQGVNGQPF-MRXNPFEDSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@](C)(C[NH2+]CC2CC(C)(C)C2)C1)N(C)C ZINC001407231803 1368622512 /nfs/dbraw/zinc/62/25/12/1368622512.db2.gz GXRVGHMESHVBTA-XLIONFOSSA-N 1 3 337.552 2.837 10 0 EFAEHO CC[C@H](F)CN1CCC[C@](C)(CNC(=O)C(C)(C)[NH+]2CCCC2)C1 ZINC001407289105 1368712111 /nfs/dbraw/zinc/71/21/11/1368712111.db2.gz CQVHDASUOCUMBD-QFBILLFUSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N1CC[C@@H](CNC(=O)CC[NH+](C)C)C1 ZINC001437718136 1387964086 /nfs/dbraw/zinc/96/40/86/1387964086.db2.gz DLPOZSWZJPLIQH-CABCVRRESA-N 1 3 337.895 2.791 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N1CC[C@H](CNC(=O)CC[NH+](C)C)C1 ZINC001437718148 1387964600 /nfs/dbraw/zinc/96/46/00/1387964600.db2.gz DLPOZSWZJPLIQH-HUUCEWRRSA-N 1 3 337.895 2.791 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCN(Cc2cccc(F)c2)C1 ZINC001437721532 1387968789 /nfs/dbraw/zinc/96/87/89/1387968789.db2.gz YTBHSKNGUJGRJV-HKUYNNGSSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCN(Cc2cccc(F)c2)C1 ZINC001437721532 1387968793 /nfs/dbraw/zinc/96/87/93/1387968793.db2.gz YTBHSKNGUJGRJV-HKUYNNGSSA-N 1 3 347.478 2.638 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)cs1 ZINC001407529379 1368945395 /nfs/dbraw/zinc/94/53/95/1368945395.db2.gz FNFKUADZPKELGH-PBHICJAKSA-N 1 3 337.533 2.581 10 0 EFAEHO C[C@H](c1ccccc1Cl)N1CC[C@@H](CNC(=O)CC[NH+](C)C)C1 ZINC001437722916 1387970307 /nfs/dbraw/zinc/97/03/07/1387970307.db2.gz NSWFITVZHMVGOQ-CABCVRRESA-N 1 3 337.895 2.791 10 0 EFAEHO CC[N@H+](CCNC(=O)C1(N(C)C)CCC1)CC[C@@H]1CCCC1(F)F ZINC001492964925 1368985581 /nfs/dbraw/zinc/98/55/81/1368985581.db2.gz GCUZEMGEUIMXFD-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[N@@H+](CCNC(=O)C1(N(C)C)CCC1)CC[C@@H]1CCCC1(F)F ZINC001492964925 1368985584 /nfs/dbraw/zinc/98/55/84/1368985584.db2.gz GCUZEMGEUIMXFD-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[C@H](C[NH2+]CC2CC2)CC1)N1CCCC1 ZINC001407562767 1368991117 /nfs/dbraw/zinc/99/11/17/1368991117.db2.gz NGXNOKAKEMOXJO-IYARVYRRSA-N 1 3 335.536 2.783 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)CC(C)(C)C ZINC001437728835 1387978306 /nfs/dbraw/zinc/97/83/06/1387978306.db2.gz QIESDNRMVZRBJC-QGZVFWFLSA-N 1 3 349.563 2.983 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)CC(C)(C)C ZINC001437728835 1387978308 /nfs/dbraw/zinc/97/83/08/1387978308.db2.gz QIESDNRMVZRBJC-QGZVFWFLSA-N 1 3 349.563 2.983 10 0 EFAEHO CCCC[N@H+](C)Cc1ccccc1CNC(=O)CN1CC[C@@H](C)C1 ZINC001407681614 1369104391 /nfs/dbraw/zinc/10/43/91/1369104391.db2.gz BDIATKNRFHZOSP-QGZVFWFLSA-N 1 3 331.504 2.877 10 0 EFAEHO CCCC[N@@H+](C)Cc1ccccc1CNC(=O)CN1CC[C@@H](C)C1 ZINC001407681614 1369104400 /nfs/dbraw/zinc/10/44/00/1369104400.db2.gz BDIATKNRFHZOSP-QGZVFWFLSA-N 1 3 331.504 2.877 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CC[NH+](CC1CCCCC1)CC2 ZINC001407717396 1369155387 /nfs/dbraw/zinc/15/53/87/1369155387.db2.gz NGMXJDJNJGSRQD-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001407789348 1369234346 /nfs/dbraw/zinc/23/43/46/1369234346.db2.gz ZUXUMMNLWARQTH-SJORKVTESA-N 1 3 347.528 2.894 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001407789348 1369234356 /nfs/dbraw/zinc/23/43/56/1369234356.db2.gz ZUXUMMNLWARQTH-SJORKVTESA-N 1 3 347.528 2.894 10 0 EFAEHO C[C@H](F)CC[NH2+]C1(CNC(=O)c2cccc(CN(C)C)c2)CCC1 ZINC001407829724 1369283732 /nfs/dbraw/zinc/28/37/32/1369283732.db2.gz YFWFJALKISQRLS-HNNXBMFYSA-N 1 3 335.467 2.738 10 0 EFAEHO CN(CCC[N@H+](C)[C@H]1CCCc2ccccc21)C(=O)CN1CCCC1 ZINC001407945378 1369442052 /nfs/dbraw/zinc/44/20/52/1369442052.db2.gz DDDGHFDLSTUZFF-FQEVSTJZSA-N 1 3 343.515 2.940 10 0 EFAEHO CN(CCC[N@@H+](C)[C@H]1CCCc2ccccc21)C(=O)CN1CCCC1 ZINC001407945378 1369442056 /nfs/dbraw/zinc/44/20/56/1369442056.db2.gz DDDGHFDLSTUZFF-FQEVSTJZSA-N 1 3 343.515 2.940 10 0 EFAEHO C[C@@H](F)CCN1Cc2ccccc2C[C@@H]1CNC(=O)CCC[NH+](C)C ZINC001407996086 1369509036 /nfs/dbraw/zinc/50/90/36/1369509036.db2.gz CQKRAQWWHKTLLU-VQIMIIECSA-N 1 3 349.494 2.619 10 0 EFAEHO CCC1([NH2+]Cc2ccsc2)CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001408013638 1369528529 /nfs/dbraw/zinc/52/85/29/1369528529.db2.gz ZDUSLOVYPDPLKX-MRXNPFEDSA-N 1 3 335.517 2.703 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C)([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001408086300 1369591550 /nfs/dbraw/zinc/59/15/50/1369591550.db2.gz IRSJGVJWSOIHLQ-KURKYZTESA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C)([NH2+]CCc2cccs2)CC1)N(C)C ZINC001408095713 1369602248 /nfs/dbraw/zinc/60/22/48/1369602248.db2.gz LNDNYLKIAKRLNZ-MRXNPFEDSA-N 1 3 337.533 2.602 10 0 EFAEHO CN(C/C=C\c1ccccc1)C[C@@H]1CCCN1C(=O)CC[NH+](C)C ZINC001408352217 1369861948 /nfs/dbraw/zinc/86/19/48/1369861948.db2.gz ZIIRUZXVMHKCSV-ABMFHFBKSA-N 1 3 329.488 2.574 10 0 EFAEHO CN(C/C=C\c1ccccc1)C[C@H]1CCCN1C(=O)CC[NH+](C)C ZINC001408352219 1369862416 /nfs/dbraw/zinc/86/24/16/1369862416.db2.gz ZIIRUZXVMHKCSV-KOTDBNOLSA-N 1 3 329.488 2.574 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCC[C@@H]1C[N@H+](C)CCC1CC1 ZINC001408357891 1369870732 /nfs/dbraw/zinc/87/07/32/1369870732.db2.gz SJUJJRBGFXIDQG-RTBURBONSA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCC[C@@H]1C[N@@H+](C)CCC1CC1 ZINC001408357891 1369870737 /nfs/dbraw/zinc/87/07/37/1369870737.db2.gz SJUJJRBGFXIDQG-RTBURBONSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)Cc1cc(F)ccc1C ZINC001437764151 1388036840 /nfs/dbraw/zinc/03/68/40/1388036840.db2.gz LDCWWWUGNQWDJX-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO CCCN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)Cc1cc(F)ccc1C ZINC001437764151 1388036846 /nfs/dbraw/zinc/03/68/46/1388036846.db2.gz LDCWWWUGNQWDJX-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001500621383 1403254677 /nfs/dbraw/zinc/25/46/77/1403254677.db2.gz VAKRJUVRUJBARH-OAHLLOKOSA-N 1 3 333.467 2.590 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001500621383 1403254680 /nfs/dbraw/zinc/25/46/80/1403254680.db2.gz VAKRJUVRUJBARH-OAHLLOKOSA-N 1 3 333.467 2.590 10 0 EFAEHO CCC[NH2+][C@@H](C)C1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001437856870 1388144633 /nfs/dbraw/zinc/14/46/33/1388144633.db2.gz WYTRJWMJGJFGPV-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO CCC[NH2+][C@@H](C)C1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001437856868 1388144775 /nfs/dbraw/zinc/14/47/75/1388144775.db2.gz WYTRJWMJGJFGPV-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@H]2CC[N@H+](CC3CC(C)(C)C3)C2)C1 ZINC001437935785 1388247245 /nfs/dbraw/zinc/24/72/45/1388247245.db2.gz CTYLBXOFLVODTC-IRXDYDNUSA-N 1 3 335.536 2.593 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@H]2CC[N@@H+](CC3CC(C)(C)C3)C2)C1 ZINC001437935785 1388247249 /nfs/dbraw/zinc/24/72/49/1388247249.db2.gz CTYLBXOFLVODTC-IRXDYDNUSA-N 1 3 335.536 2.593 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]CCc2ccccc2)C1 ZINC001417797264 1373264580 /nfs/dbraw/zinc/26/45/80/1373264580.db2.gz DFIFDYQNMUSIJH-HNBVOPMISA-N 1 3 343.515 2.586 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccccc2F)C1 ZINC001417813059 1373284962 /nfs/dbraw/zinc/28/49/62/1373284962.db2.gz MGADMZLAFFFJGK-DOTOQJQBSA-N 1 3 335.467 2.540 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CCC(C)C ZINC001417819700 1373291106 /nfs/dbraw/zinc/29/11/06/1373291106.db2.gz ATVHZTHSPSYLKW-RDGPPVDQSA-N 1 3 335.536 2.543 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CCC(C)C ZINC001417819700 1373291110 /nfs/dbraw/zinc/29/11/10/1373291110.db2.gz ATVHZTHSPSYLKW-RDGPPVDQSA-N 1 3 335.536 2.543 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CCC[NH+](C)C)CCN1Cc1csc(C)c1 ZINC001417825700 1373303470 /nfs/dbraw/zinc/30/34/70/1373303470.db2.gz UNRBQWVPYCWBCX-DLBZAZTESA-N 1 3 337.533 2.867 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[N@H+](C/C=C\Cl)CC(C)(C)C2)CCC1 ZINC001417864436 1373359568 /nfs/dbraw/zinc/35/95/68/1373359568.db2.gz UYBOYFWUAJTSNL-MLBQELRYSA-N 1 3 341.927 2.830 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[N@@H+](C/C=C\Cl)CC(C)(C)C2)CCC1 ZINC001417864436 1373359571 /nfs/dbraw/zinc/35/95/71/1373359571.db2.gz UYBOYFWUAJTSNL-MLBQELRYSA-N 1 3 341.927 2.830 10 0 EFAEHO Cc1ccncc1C[NH2+][C@H](C)[C@@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001417892388 1373380153 /nfs/dbraw/zinc/38/01/53/1373380153.db2.gz PLAWFDPATDHPAO-MJGOQNOKSA-N 1 3 346.519 2.589 10 0 EFAEHO Cc1ccncc1C[NH2+][C@H](C)[C@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001417892387 1373380477 /nfs/dbraw/zinc/38/04/77/1373380477.db2.gz PLAWFDPATDHPAO-IEBWSBKVSA-N 1 3 346.519 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H](C)[NH2+]CCc1ccccc1 ZINC001417893350 1373381149 /nfs/dbraw/zinc/38/11/49/1373381149.db2.gz UJYKAFZSSURHOX-AZUAARDMSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)(C(=O)NC[C@H]([NH2+]Cc1ccccc1)C1CC1)N1CCCC1 ZINC001417991149 1373495527 /nfs/dbraw/zinc/49/55/27/1373495527.db2.gz JWKFBFPNBBGARM-SFHVURJKSA-N 1 3 329.488 2.545 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@@H]1CC[N@H+](CC2CCC2)C1 ZINC001437951829 1388269661 /nfs/dbraw/zinc/26/96/61/1388269661.db2.gz WSVLKCIWOBVPNE-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@@H]1CC[N@@H+](CC2CCC2)C1 ZINC001437951829 1388269664 /nfs/dbraw/zinc/26/96/64/1388269664.db2.gz WSVLKCIWOBVPNE-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+][C@@H](C)c1ccccc1F)C1CC1 ZINC001418009534 1373517373 /nfs/dbraw/zinc/51/73/73/1373517373.db2.gz FFZMNTIPFBUCMK-KBXCAEBGSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+][C@H](C)c1ccccc1F)C1CC1 ZINC001418009545 1373517828 /nfs/dbraw/zinc/51/78/28/1373517828.db2.gz FFZMNTIPFBUCMK-RDTXWAMCSA-N 1 3 335.467 2.711 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@@H](C[N@H+](C)C/C=C\Cl)C1 ZINC001418023361 1373537198 /nfs/dbraw/zinc/53/71/98/1373537198.db2.gz VYRFDVWJRBADTG-RDIIQDETSA-N 1 3 347.906 2.589 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@@H](C[N@@H+](C)C/C=C\Cl)C1 ZINC001418023361 1373537200 /nfs/dbraw/zinc/53/72/00/1373537200.db2.gz VYRFDVWJRBADTG-RDIIQDETSA-N 1 3 347.906 2.589 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@@H](CNC(=O)C(C)(C)[NH+]2CCCCC2)C1 ZINC001418117554 1373623688 /nfs/dbraw/zinc/62/36/88/1373623688.db2.gz BMNRDLJEUWBBJG-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@H](CNC(=O)C(C)(C)[NH+]2CCCCC2)C1 ZINC001418117557 1373624064 /nfs/dbraw/zinc/62/40/64/1373624064.db2.gz BMNRDLJEUWBBJG-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001418124545 1373637866 /nfs/dbraw/zinc/63/78/66/1373637866.db2.gz QSHUXAWMLQSOAT-FUHWJXTLSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001418124545 1373637870 /nfs/dbraw/zinc/63/78/70/1373637870.db2.gz QSHUXAWMLQSOAT-FUHWJXTLSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001418124547 1373638429 /nfs/dbraw/zinc/63/84/29/1373638429.db2.gz QSHUXAWMLQSOAT-SJLPKXTDSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001418124547 1373638436 /nfs/dbraw/zinc/63/84/36/1373638436.db2.gz QSHUXAWMLQSOAT-SJLPKXTDSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC001437956912 1388273497 /nfs/dbraw/zinc/27/34/97/1388273497.db2.gz IJWHSXVTXLXKHW-CVEARBPZSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC001437956912 1388273504 /nfs/dbraw/zinc/27/35/04/1388273504.db2.gz IJWHSXVTXLXKHW-CVEARBPZSA-N 1 3 345.478 2.590 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001437962316 1388277701 /nfs/dbraw/zinc/27/77/01/1388277701.db2.gz VLTXPHANUFKTOX-UXHICEINSA-N 1 3 343.515 2.889 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001437962316 1388277705 /nfs/dbraw/zinc/27/77/05/1388277705.db2.gz VLTXPHANUFKTOX-UXHICEINSA-N 1 3 343.515 2.889 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1[C@H]2C[N@@H+]([C@@H](C)c3cc(C)ccc3C)C[C@H]21)N(C)C ZINC001418179774 1373740942 /nfs/dbraw/zinc/74/09/42/1373740942.db2.gz CYAASWROINUSEO-LFAQGZIKSA-N 1 3 343.515 2.751 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1[C@H]2C[N@H+]([C@@H](C)c3cc(C)ccc3C)C[C@H]21)N(C)C ZINC001418179774 1373740946 /nfs/dbraw/zinc/74/09/46/1373740946.db2.gz CYAASWROINUSEO-LFAQGZIKSA-N 1 3 343.515 2.751 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CCC([NH2+]Cc2ccc(F)cc2)CC1 ZINC001418190035 1373754033 /nfs/dbraw/zinc/75/40/33/1373754033.db2.gz GKPNATSYSXYDIT-UHFFFAOYSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)c1cccc(CN[C@H](C)CNC(=O)[C@@H]2CCC[N@@H+]2C(C)C)n1 ZINC001418221670 1373777465 /nfs/dbraw/zinc/77/74/65/1373777465.db2.gz OBRWTIGJJKPWDT-APWZRJJASA-N 1 3 346.519 2.672 10 0 EFAEHO CC(C)c1cccc(CN[C@H](C)CNC(=O)[C@@H]2CCC[N@H+]2C(C)C)n1 ZINC001418221670 1373777467 /nfs/dbraw/zinc/77/74/67/1373777467.db2.gz OBRWTIGJJKPWDT-APWZRJJASA-N 1 3 346.519 2.672 10 0 EFAEHO C[C@@H](N[C@@H](C)CNC(=O)C12CCC[NH+](CCC1)C2)c1ccccc1F ZINC001418235815 1373791049 /nfs/dbraw/zinc/79/10/49/1373791049.db2.gz LYQKQOQTFVVXMH-JKSUJKDBSA-N 1 3 347.478 2.857 10 0 EFAEHO CC(C)c1ccc(C[NH2+][C@H](C)CNC(=O)[C@@H](C(C)C)N(C)C)cc1 ZINC001418267004 1373835368 /nfs/dbraw/zinc/83/53/68/1373835368.db2.gz DFOSPARWGRZCIJ-VQIMIIECSA-N 1 3 333.520 2.991 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@@H](C)CNC(=O)CN(C)CC(C)(C)C)c1 ZINC001418276356 1373846660 /nfs/dbraw/zinc/84/66/60/1373846660.db2.gz PWDHOMXBGXLUHD-HOTGVXAUSA-N 1 3 349.519 2.828 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@@H](C)CNC(=O)CN(C)CC(C)(C)C)c1 ZINC001418276363 1373847167 /nfs/dbraw/zinc/84/71/67/1373847167.db2.gz PWDHOMXBGXLUHD-JKSUJKDBSA-N 1 3 349.519 2.828 10 0 EFAEHO CN(CC(=O)N1CC[C@H](C[NH2+]CC2CC(C)(C)C2)C1)CC(C)(C)C ZINC001418357272 1373929789 /nfs/dbraw/zinc/92/97/89/1373929789.db2.gz MVAZUDBKMLPXHD-MRXNPFEDSA-N 1 3 337.552 2.839 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]([NH2+]CC=C(Cl)Cl)C1 ZINC001418361907 1373934649 /nfs/dbraw/zinc/93/46/49/1373934649.db2.gz SHTGLTKLEDOMOV-QWHCGFSZSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001418373741 1373950333 /nfs/dbraw/zinc/95/03/33/1373950333.db2.gz IDQVZYLAFJSBPH-HOTGVXAUSA-N 1 3 345.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001418373741 1373950335 /nfs/dbraw/zinc/95/03/35/1373950335.db2.gz IDQVZYLAFJSBPH-HOTGVXAUSA-N 1 3 345.478 2.685 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@H](C)CCNC(=O)C2(N(C)C)CCC2)c1 ZINC001418400873 1373982005 /nfs/dbraw/zinc/98/20/05/1373982005.db2.gz ABKHYDKJEIEXIY-HZPDHXFCSA-N 1 3 347.503 2.725 10 0 EFAEHO Cc1cccc(CN(C)CCNC(=O)[C@]2(F)CC[N@@H+](C(C)(C)C)C2)c1 ZINC001418493109 1374089897 /nfs/dbraw/zinc/08/98/97/1374089897.db2.gz GMDJRWPINPFLFM-FQEVSTJZSA-N 1 3 349.494 2.756 10 0 EFAEHO Cc1cccc(CN(C)CCNC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)c1 ZINC001418493109 1374089900 /nfs/dbraw/zinc/08/99/00/1374089900.db2.gz GMDJRWPINPFLFM-FQEVSTJZSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CCNC(=O)CC[C@H]1CCC[N@@H+]1C)Cc1ccc(C)c(F)c1 ZINC001418549382 1374163648 /nfs/dbraw/zinc/16/36/48/1374163648.db2.gz CUPLNORRPWFITK-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CCN(CCNC(=O)CC[C@H]1CCC[N@H+]1C)Cc1ccc(C)c(F)c1 ZINC001418549382 1374163651 /nfs/dbraw/zinc/16/36/51/1374163651.db2.gz CUPLNORRPWFITK-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CN(C[C@H]1CCN1C[C@@H]1CCCC(F)(F)C1)C(=O)CCC[NH+](C)C ZINC001418586926 1374229598 /nfs/dbraw/zinc/22/95/98/1374229598.db2.gz GMBQODSYNYEGDL-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@@H+]([C@H]2CCc3ccccc32)C1)C1CCC1 ZINC001418656234 1374328593 /nfs/dbraw/zinc/32/85/93/1374328593.db2.gz GTJQFQZOWRHCID-UZLBHIALSA-N 1 3 341.499 2.596 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@H+]([C@H]2CCc3ccccc32)C1)C1CCC1 ZINC001418656234 1374328598 /nfs/dbraw/zinc/32/85/98/1374328598.db2.gz GTJQFQZOWRHCID-UZLBHIALSA-N 1 3 341.499 2.596 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001418681288 1374362888 /nfs/dbraw/zinc/36/28/88/1374362888.db2.gz IPBUPDMRYGFJJD-IRXDYDNUSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001418681288 1374362890 /nfs/dbraw/zinc/36/28/90/1374362890.db2.gz IPBUPDMRYGFJJD-IRXDYDNUSA-N 1 3 349.906 2.620 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@@H+]([C@@H](C)c2cccc(OC)c2)C1 ZINC001418692038 1374374647 /nfs/dbraw/zinc/37/46/47/1374374647.db2.gz QVIKTELWIRWNBP-IRXDYDNUSA-N 1 3 347.503 2.536 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@H+]([C@@H](C)c2cccc(OC)c2)C1 ZINC001418692038 1374374651 /nfs/dbraw/zinc/37/46/51/1374374651.db2.gz QVIKTELWIRWNBP-IRXDYDNUSA-N 1 3 347.503 2.536 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC001418695378 1374378657 /nfs/dbraw/zinc/37/86/57/1374378657.db2.gz CQZFBSZIEXTURU-DNVCBOLYSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC001418695378 1374378662 /nfs/dbraw/zinc/37/86/62/1374378662.db2.gz CQZFBSZIEXTURU-DNVCBOLYSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+](Cc2ccccc2C2CC2)C1 ZINC001418697194 1374382156 /nfs/dbraw/zinc/38/21/56/1374382156.db2.gz HZRQURKOLXDIEN-QGZVFWFLSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2C2CC2)C1 ZINC001418697194 1374382161 /nfs/dbraw/zinc/38/21/61/1374382161.db2.gz HZRQURKOLXDIEN-QGZVFWFLSA-N 1 3 343.515 2.842 10 0 EFAEHO CCc1ccccc1CC[N@@H+]1CC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001418701239 1374386685 /nfs/dbraw/zinc/38/66/85/1374386685.db2.gz VVLNFDHORNWUGV-SFHVURJKSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[N@H+]1CC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001418701239 1374386689 /nfs/dbraw/zinc/38/66/89/1374386689.db2.gz VVLNFDHORNWUGV-SFHVURJKSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC001418701034 1374387285 /nfs/dbraw/zinc/38/72/85/1374387285.db2.gz UKTCNSXABCXNMM-HZPDHXFCSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC001418701034 1374387286 /nfs/dbraw/zinc/38/72/86/1374387286.db2.gz UKTCNSXABCXNMM-HZPDHXFCSA-N 1 3 345.478 2.590 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[N@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001438001207 1388315297 /nfs/dbraw/zinc/31/52/97/1388315297.db2.gz NUHNVUSFZDNAAI-JKSUJKDBSA-N 1 3 345.478 2.544 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[N@@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001438001207 1388315302 /nfs/dbraw/zinc/31/53/02/1388315302.db2.gz NUHNVUSFZDNAAI-JKSUJKDBSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]CCC3CCCC3)C2)C1 ZINC001418733463 1374435153 /nfs/dbraw/zinc/43/51/53/1374435153.db2.gz ORYIFXKSLIERSA-YTQUADARSA-N 1 3 335.536 2.783 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN(C)C(C)C)[C@@H]1CCc2c1cccc2F ZINC001418738490 1374441619 /nfs/dbraw/zinc/44/16/19/1374441619.db2.gz BUSSYHREXFADHN-LJQANCHMSA-N 1 3 349.494 2.981 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN(C)C(C)C)[C@@H]1CCc2c1cccc2F ZINC001418738490 1374441622 /nfs/dbraw/zinc/44/16/22/1374441622.db2.gz BUSSYHREXFADHN-LJQANCHMSA-N 1 3 349.494 2.981 10 0 EFAEHO CN(CC(=O)N1CCCCC[C@H]([NH2+]CCC(F)(F)F)C1)C1CCC1 ZINC001418786281 1374499304 /nfs/dbraw/zinc/49/93/04/1374499304.db2.gz BIWKTXABWCQAGW-AWEZNQCLSA-N 1 3 349.441 2.784 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@H]1CCN(C/C=C/Cl)CC(C)(C)C1 ZINC001418823972 1374544113 /nfs/dbraw/zinc/54/41/13/1374544113.db2.gz HIHRBIIBMZTZST-RZIFZGNASA-N 1 3 329.916 2.688 10 0 EFAEHO CC[C@H](F)CN1CC[C@@H](NC(=O)CCC[NH+](C)C)CC(C)(C)C1 ZINC001418824463 1374546453 /nfs/dbraw/zinc/54/64/53/1374546453.db2.gz JXANYXKAJSRHMN-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)C[C@@H]1CCCCN1C(=O)CN1CCC(C)CC1 ZINC001418829342 1374551934 /nfs/dbraw/zinc/55/19/34/1374551934.db2.gz WLLOGOHUZPCNOE-MSOLQXFVSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)C[C@@H]1CCCCN1C(=O)CN1CCC(C)CC1 ZINC001418829342 1374551939 /nfs/dbraw/zinc/55/19/39/1374551939.db2.gz WLLOGOHUZPCNOE-MSOLQXFVSA-N 1 3 341.515 2.779 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001418840361 1374563211 /nfs/dbraw/zinc/56/32/11/1374563211.db2.gz NHKPSHCEEWXDOM-KRWDZBQOSA-N 1 3 337.895 2.717 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@@H]1CC[N@H+](CC2CCC(C)CC2)C1 ZINC001418912986 1374679032 /nfs/dbraw/zinc/67/90/32/1374679032.db2.gz JOEKAFHXNTVEDQ-CTWPCTMYSA-N 1 3 337.552 2.983 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@@H]1CC[N@@H+](CC2CCC(C)CC2)C1 ZINC001418912986 1374679036 /nfs/dbraw/zinc/67/90/36/1374679036.db2.gz JOEKAFHXNTVEDQ-CTWPCTMYSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)C[N@H+](C)C[C@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001418942741 1374714340 /nfs/dbraw/zinc/71/43/40/1374714340.db2.gz WKTPACFWOKAKRI-APWZRJJASA-N 1 3 341.515 2.635 10 0 EFAEHO CC(C)C[N@@H+](C)C[C@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001418942741 1374714345 /nfs/dbraw/zinc/71/43/45/1374714345.db2.gz WKTPACFWOKAKRI-APWZRJJASA-N 1 3 341.515 2.635 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCCN(Cc2cc3ccccc3s2)C1 ZINC001418958100 1374734158 /nfs/dbraw/zinc/73/41/58/1374734158.db2.gz ZDHZFKSYHCPMNU-INIZCTEOSA-N 1 3 345.512 2.934 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCC1CN([C@H]2CCc3ccccc32)C1 ZINC001419020655 1374768413 /nfs/dbraw/zinc/76/84/13/1374768413.db2.gz FKYMGTLBBHOLQS-QUCCMNQESA-N 1 3 341.499 2.596 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCC1CN([C@H]2CCc3ccccc32)C1 ZINC001419020655 1374768414 /nfs/dbraw/zinc/76/84/14/1374768414.db2.gz FKYMGTLBBHOLQS-QUCCMNQESA-N 1 3 341.499 2.596 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCC1CN([C@@H]2CCc3ccccc32)C1 ZINC001419020657 1374768499 /nfs/dbraw/zinc/76/84/99/1374768499.db2.gz FKYMGTLBBHOLQS-UYAOXDASSA-N 1 3 341.499 2.596 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCC1CN([C@@H]2CCc3ccccc32)C1 ZINC001419020657 1374768502 /nfs/dbraw/zinc/76/85/02/1374768502.db2.gz FKYMGTLBBHOLQS-UYAOXDASSA-N 1 3 341.499 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001419079748 1374820188 /nfs/dbraw/zinc/82/01/88/1374820188.db2.gz MRSMKKJGBDUWQB-ZBFHGGJFSA-N 1 3 345.478 2.731 10 0 EFAEHO COc1cccc([C@H](C)N2CC[C@@H](N(C)C(=O)CCC[NH+](C)C)C2)c1 ZINC001419111959 1374856061 /nfs/dbraw/zinc/85/60/61/1374856061.db2.gz ABWNBFDZXJQXJV-FUHWJXTLSA-N 1 3 347.503 2.631 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@H+](CCC2CCCC2)C1 ZINC001419165264 1374914827 /nfs/dbraw/zinc/91/48/27/1374914827.db2.gz YVXLKQOZCDQSPV-IEBWSBKVSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@@H+](CCC2CCCC2)C1 ZINC001419165264 1374914830 /nfs/dbraw/zinc/91/48/30/1374914830.db2.gz YVXLKQOZCDQSPV-IEBWSBKVSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)NCc1ccccc1F ZINC001419193784 1374939855 /nfs/dbraw/zinc/93/98/55/1374939855.db2.gz KWEABIFPRMMFHN-IRXDYDNUSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)NCc1ccccc1F ZINC001419193784 1374939857 /nfs/dbraw/zinc/93/98/57/1374939857.db2.gz KWEABIFPRMMFHN-IRXDYDNUSA-N 1 3 335.467 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC12CC[NH+](CCc1ccccc1)CC2 ZINC001419204259 1374949711 /nfs/dbraw/zinc/94/97/11/1374949711.db2.gz HFTSEUDIMFGOFI-LJQANCHMSA-N 1 3 343.515 2.540 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC12CC[NH+](CC1CC(C)(C)C1)CC2)N(C)C ZINC001419213098 1374959141 /nfs/dbraw/zinc/95/91/41/1374959141.db2.gz XWKDFLLYTDGATG-ZWKOTPCHSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC12CC[NH+](CC1CC(C)(C)C1)CC2)N(C)C ZINC001419213088 1374959474 /nfs/dbraw/zinc/95/94/74/1374959474.db2.gz XWKDFLLYTDGATG-QZTJIDSGSA-N 1 3 349.563 2.980 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1c(C)cc(C)cc1C ZINC001419246049 1374992668 /nfs/dbraw/zinc/99/26/68/1374992668.db2.gz PNHZKBBSOSOLOL-DNVCBOLYSA-N 1 3 345.531 2.938 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]([NH2+]CCC2CCCCC2)C2CC2)C1 ZINC001419300468 1375060217 /nfs/dbraw/zinc/06/02/17/1375060217.db2.gz RTRAPRJJPBLPPF-APWZRJJASA-N 1 3 335.536 2.783 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]([NH2+]CCC2CCCCC2)C2CC2)C1 ZINC001419300473 1375061820 /nfs/dbraw/zinc/06/18/20/1375061820.db2.gz RTRAPRJJPBLPPF-QFBILLFUSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C2CC2)c(C)c1 ZINC001419326710 1375106082 /nfs/dbraw/zinc/10/60/82/1375106082.db2.gz PWFXYVZUOOASDV-IBGZPJMESA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@H](C(=O)N[C@](C)(C[NH2+]Cc1cccc(F)c1)C1CC1)N(C)C ZINC001419342065 1375132349 /nfs/dbraw/zinc/13/23/49/1375132349.db2.gz QDFVHTKSHJEWDY-IEBWSBKVSA-N 1 3 335.467 2.540 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@](C)(NC(=O)CN(C)C(C)C)C2CC2)cc1F ZINC001419359396 1375161750 /nfs/dbraw/zinc/16/17/50/1375161750.db2.gz OCGOTHHISFFJQV-FQEVSTJZSA-N 1 3 349.494 2.849 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H]1CC[C@H]([NH2+]CC[C@@H](C)F)CC1 ZINC001419377812 1375192550 /nfs/dbraw/zinc/19/25/50/1375192550.db2.gz NCGJNHNTZINAFS-VQHPVUNQSA-N 1 3 327.488 2.626 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1C[C@H](NCc2cccc(F)c2Cl)C1 ZINC001419416614 1375245146 /nfs/dbraw/zinc/24/51/46/1375245146.db2.gz GDSSMCRCBXTKLY-HDJSIYSDSA-N 1 3 341.858 2.558 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC1CC[NH+](CCCC(C)C)CC1 ZINC001419418882 1375250011 /nfs/dbraw/zinc/25/00/11/1375250011.db2.gz VNPPLQZSSFSVOQ-UHFFFAOYSA-N 1 3 334.508 2.915 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]1CNCc1ccc(F)cc1Cl ZINC001419422712 1375253724 /nfs/dbraw/zinc/25/37/24/1375253724.db2.gz LGKXWOFMFRDMKA-OAHLLOKOSA-N 1 3 341.858 2.511 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1C[NH+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001438128316 1388368019 /nfs/dbraw/zinc/36/80/19/1388368019.db2.gz OPHKZEQROVABKD-SFHVURJKSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CCc1ccccc1 ZINC001419455041 1375296350 /nfs/dbraw/zinc/29/63/50/1375296350.db2.gz BHQLSOQBTIYCKX-IHWFROFDSA-N 1 3 343.515 2.681 10 0 EFAEHO CC(C)N(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCc1ccccc1 ZINC001419455041 1375296358 /nfs/dbraw/zinc/29/63/58/1375296358.db2.gz BHQLSOQBTIYCKX-IHWFROFDSA-N 1 3 343.515 2.681 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+]Cc3ccc(C4CC4)cc3)C2)CCC1 ZINC001419477570 1375320976 /nfs/dbraw/zinc/32/09/76/1375320976.db2.gz ZJUZHPMFAAXIHU-KDURUIRLSA-N 1 3 341.499 2.785 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2)C1)N(C)C ZINC001419518828 1375376956 /nfs/dbraw/zinc/37/69/56/1375376956.db2.gz MJRONWQJJIOSND-ZCNNSNEGSA-N 1 3 339.483 2.917 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1C[NH+](CCC2CCCCC2)C1 ZINC001438159550 1388389515 /nfs/dbraw/zinc/38/95/15/1388389515.db2.gz NOEMIGWLRVFDHV-IRXDYDNUSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](C[NH2+]Cc1cc2ccccc2s1)N(C)C(=O)[C@@H]1CCCN1C ZINC001419659032 1375652231 /nfs/dbraw/zinc/65/22/31/1375652231.db2.gz YLNHOIWJRCKNEQ-PBHICJAKSA-N 1 3 345.512 2.932 10 0 EFAEHO C[C@H](C[NH2+]Cc1cc2ccccc2o1)N(C)C(=O)[C@@H]1CCCCN1C ZINC001419681783 1375704386 /nfs/dbraw/zinc/70/43/86/1375704386.db2.gz IFBNBQAVKRPJAI-QAPCUYQASA-N 1 3 343.471 2.854 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N1C[C@@H]2C[C@H]1CN2CCCC(C)(C)C ZINC001438168662 1388397394 /nfs/dbraw/zinc/39/73/94/1388397394.db2.gz IBRSOTPYSXRAHS-BZSNNMDCSA-N 1 3 335.536 2.972 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N1C[C@@H]2C[C@H]1CN2CCCC(C)(C)C ZINC001438168662 1388397401 /nfs/dbraw/zinc/39/74/01/1388397401.db2.gz IBRSOTPYSXRAHS-BZSNNMDCSA-N 1 3 335.536 2.972 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(Cl)cc1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001419722212 1375769054 /nfs/dbraw/zinc/76/90/54/1375769054.db2.gz PYNUNQFXHCPNRY-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]C/C=C\c1ccccc1 ZINC001419754670 1375818424 /nfs/dbraw/zinc/81/84/24/1375818424.db2.gz IJBOXWLWLVCQGN-ARXNCCBWSA-N 1 3 329.488 2.669 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1cccc(F)c1 ZINC001419760408 1375829056 /nfs/dbraw/zinc/82/90/56/1375829056.db2.gz IJNZCJXYHAGZSE-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001419766076 1375838983 /nfs/dbraw/zinc/83/89/83/1375838983.db2.gz MWRFVEINLVYMOG-CYBMUJFWSA-N 1 3 343.874 2.756 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC001419774814 1375854302 /nfs/dbraw/zinc/85/43/02/1375854302.db2.gz YYFZEJWQZOAQJR-KXBFYZLASA-N 1 3 349.494 2.980 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001419817595 1375930459 /nfs/dbraw/zinc/93/04/59/1375930459.db2.gz IFFRHFQVZOREKZ-QUCCMNQESA-N 1 3 345.531 2.704 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)CCC1CCN(C(=O)[C@@H](CC)N(C)C)CC1 ZINC001419844300 1375981941 /nfs/dbraw/zinc/98/19/41/1375981941.db2.gz CUEUZQNPPGGODV-IAGOWNOFSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)CCC1CCN(C(=O)[C@@H](CC)N(C)C)CC1 ZINC001419844300 1375981949 /nfs/dbraw/zinc/98/19/49/1375981949.db2.gz CUEUZQNPPGGODV-IAGOWNOFSA-N 1 3 329.504 2.635 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)CC1 ZINC001419844188 1375982489 /nfs/dbraw/zinc/98/24/89/1375982489.db2.gz CMLIFUITPIOLOZ-QZTJIDSGSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)CC1 ZINC001419844188 1375982494 /nfs/dbraw/zinc/98/24/94/1375982494.db2.gz CMLIFUITPIOLOZ-QZTJIDSGSA-N 1 3 339.499 2.533 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1)N(C)C ZINC001438211742 1388415395 /nfs/dbraw/zinc/41/53/95/1388415395.db2.gz VGGFELQNXRIICH-ARFHVFGLSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@@H+](CC[C@@H]2CCCC2(F)F)C1)N(C)C ZINC001438211742 1388415400 /nfs/dbraw/zinc/41/54/00/1388415400.db2.gz VGGFELQNXRIICH-ARFHVFGLSA-N 1 3 345.478 2.589 10 0 EFAEHO COc1ccc(C[NH2+][C@H](C)CNC(=O)[C@H]2CCCCN2C(C)C)cc1 ZINC001419862360 1376023716 /nfs/dbraw/zinc/02/37/16/1376023716.db2.gz FQBCSDQSRIDNEV-VQIMIIECSA-N 1 3 347.503 2.552 10 0 EFAEHO COc1ccc(C[NH2+][C@H](C)CNC(=O)[C@@H](C)N2CCCCCC2)cc1 ZINC001419876963 1376050564 /nfs/dbraw/zinc/05/05/64/1376050564.db2.gz YZUGGSUZMUATTG-IAGOWNOFSA-N 1 3 347.503 2.554 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]([NH2+][C@H]1CCc2ccccc21)C(C)C ZINC001419933055 1376150538 /nfs/dbraw/zinc/15/05/38/1376150538.db2.gz ZAUJZYINBIMNCS-PKOBYXMFSA-N 1 3 340.471 2.679 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@H+](C)[C@H]2CCc3ccccc32)CCC1 ZINC001419964661 1376199020 /nfs/dbraw/zinc/19/90/20/1376199020.db2.gz CZZZBBXYPVLFND-SFHVURJKSA-N 1 3 329.488 2.548 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@@H+](C)[C@H]2CCc3ccccc32)CCC1 ZINC001419964661 1376199022 /nfs/dbraw/zinc/19/90/22/1376199022.db2.gz CZZZBBXYPVLFND-SFHVURJKSA-N 1 3 329.488 2.548 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12)Cc1ccccc1 ZINC001419989704 1376243950 /nfs/dbraw/zinc/24/39/50/1376243950.db2.gz KYRPVXXYXHXZBL-RBUKOAKNSA-N 1 3 329.488 2.594 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12)Cc1ccccc1 ZINC001419989704 1376243958 /nfs/dbraw/zinc/24/39/58/1376243958.db2.gz KYRPVXXYXHXZBL-RBUKOAKNSA-N 1 3 329.488 2.594 10 0 EFAEHO Cc1cccc(CN2CC[C@@H](N(C)C(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001438234860 1388432255 /nfs/dbraw/zinc/43/22/55/1388432255.db2.gz OLFAJDZCJJOMCU-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN2CC[C@@H](N(C)C(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001438234860 1388432259 /nfs/dbraw/zinc/43/22/59/1388432259.db2.gz OLFAJDZCJJOMCU-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCN(C)C(=O)C[C@H]2CC[N@H+](C)C2)c1 ZINC001420033161 1376330893 /nfs/dbraw/zinc/33/08/93/1376330893.db2.gz AAJAZPPWVZPSPS-GOSISDBHSA-N 1 3 331.504 2.535 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCN(C)C(=O)C[C@H]2CC[N@@H+](C)C2)c1 ZINC001420033161 1376330899 /nfs/dbraw/zinc/33/08/99/1376330899.db2.gz AAJAZPPWVZPSPS-GOSISDBHSA-N 1 3 331.504 2.535 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)C[NH+]2[C@@H](C)CC[C@@H]2C)c1 ZINC001420062816 1376404773 /nfs/dbraw/zinc/40/47/73/1376404773.db2.gz NUUABJRUZHKJDN-ROUUACIJSA-N 1 3 331.504 2.758 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]CCC(F)(F)F ZINC001420127916 1376485359 /nfs/dbraw/zinc/48/53/59/1376485359.db2.gz HPKJNWRZXBAOIU-KGLIPLIRSA-N 1 3 337.430 2.686 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1cccc(OC)c1 ZINC001420166769 1376526123 /nfs/dbraw/zinc/52/61/23/1376526123.db2.gz RDAJPEKCSITNHE-VQIMIIECSA-N 1 3 347.503 2.554 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)Cc2ccc(C)c(C)c2)CC[N@@H+]1C ZINC001420217373 1376568526 /nfs/dbraw/zinc/56/85/26/1376568526.db2.gz GVZIKSWZVPJIEH-RBUKOAKNSA-N 1 3 331.504 2.582 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)Cc2ccc(C)c(C)c2)CC[N@H+]1C ZINC001420217373 1376568533 /nfs/dbraw/zinc/56/85/33/1376568533.db2.gz GVZIKSWZVPJIEH-RBUKOAKNSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001420308801 1376707447 /nfs/dbraw/zinc/70/74/47/1376707447.db2.gz DWZQGSRLYNRLSK-RBUKOAKNSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@H]1CCC[C@H]2CCC[N@H+]21 ZINC001420308801 1376707450 /nfs/dbraw/zinc/70/74/50/1376707450.db2.gz DWZQGSRLYNRLSK-RBUKOAKNSA-N 1 3 329.488 2.560 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NCCN(C)Cc1ccc(C2CC2)cc1 ZINC001420347976 1376780044 /nfs/dbraw/zinc/78/00/44/1376780044.db2.gz BNRPUZBQRPHMJJ-IAGOWNOFSA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CC)Cc2ccc(CF)cc2)CC[N@@H+]1C ZINC001420386572 1376857379 /nfs/dbraw/zinc/85/73/79/1376857379.db2.gz JWCVQUQSPLHOEO-RBUKOAKNSA-N 1 3 349.494 2.825 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CC)Cc2ccc(CF)cc2)CC[N@H+]1C ZINC001420386572 1376857390 /nfs/dbraw/zinc/85/73/90/1376857390.db2.gz JWCVQUQSPLHOEO-RBUKOAKNSA-N 1 3 349.494 2.825 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@H+](CCc2cccs2)C1 ZINC001438268886 1388468476 /nfs/dbraw/zinc/46/84/76/1388468476.db2.gz RXIPRWBOXFINLU-SJORKVTESA-N 1 3 349.544 2.555 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@@H+](CCc2cccs2)C1 ZINC001438268886 1388468479 /nfs/dbraw/zinc/46/84/79/1388468479.db2.gz RXIPRWBOXFINLU-SJORKVTESA-N 1 3 349.544 2.555 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C(C)C)CC1CCC(C)(C)CC1 ZINC001420450581 1376997500 /nfs/dbraw/zinc/99/75/00/1376997500.db2.gz FRJVAIBNLPCQCF-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C(C)C)CC1CCC(C)(C)CC1 ZINC001420450581 1376997502 /nfs/dbraw/zinc/99/75/02/1376997502.db2.gz FRJVAIBNLPCQCF-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H](CNCc1ccc(Cl)s1)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001420457327 1377010173 /nfs/dbraw/zinc/01/01/73/1377010173.db2.gz KXLPAVJRMXONKL-AVGNSLFASA-N 1 3 343.924 2.726 10 0 EFAEHO C[C@@H](CNCc1ccc(Cl)s1)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001420457327 1377010176 /nfs/dbraw/zinc/01/01/76/1377010176.db2.gz KXLPAVJRMXONKL-AVGNSLFASA-N 1 3 343.924 2.726 10 0 EFAEHO CCc1ccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)cc1 ZINC001420573665 1377227683 /nfs/dbraw/zinc/22/76/83/1377227683.db2.gz VXUJQMVOUTYBIO-LSTHTHJFSA-N 1 3 345.531 2.916 10 0 EFAEHO CCc1ccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)cc1 ZINC001420573665 1377227688 /nfs/dbraw/zinc/22/76/88/1377227688.db2.gz VXUJQMVOUTYBIO-LSTHTHJFSA-N 1 3 345.531 2.916 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)Cc1cccc(C(F)F)c1)N(C)C ZINC001420591550 1377268275 /nfs/dbraw/zinc/26/82/75/1377268275.db2.gz JIXUVWLCFFFMSW-XJKSGUPXSA-N 1 3 341.446 2.901 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)Cc1cccc(C(F)F)c1)N(C)C ZINC001420591550 1377268277 /nfs/dbraw/zinc/26/82/77/1377268277.db2.gz JIXUVWLCFFFMSW-XJKSGUPXSA-N 1 3 341.446 2.901 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN(C)C1CCC1)[C@@H]1CCc2ccccc21 ZINC001420593807 1377273380 /nfs/dbraw/zinc/27/33/80/1377273380.db2.gz UKSJKOYIVHMUCB-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN(C)C1CCC1)[C@@H]1CCc2ccccc21 ZINC001420593807 1377273382 /nfs/dbraw/zinc/27/33/82/1377273382.db2.gz UKSJKOYIVHMUCB-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO C[C@@H](CN(C)CCc1ccccc1F)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001420596369 1377281187 /nfs/dbraw/zinc/28/11/87/1377281187.db2.gz HUDGXPFIWABABL-WMZOPIPTSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@@H](CN(C)CCc1ccccc1F)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001420596369 1377281190 /nfs/dbraw/zinc/28/11/90/1377281190.db2.gz HUDGXPFIWABABL-WMZOPIPTSA-N 1 3 349.494 2.679 10 0 EFAEHO Cc1cc(CN(C)C[C@H](C)NC(=O)C[C@H]2CC[N@H+](C)C2)c(C)s1 ZINC001420667261 1377461108 /nfs/dbraw/zinc/46/11/08/1377461108.db2.gz PQTPDCWQBHKYCS-XJKSGUPXSA-N 1 3 337.533 2.643 10 0 EFAEHO Cc1cc(CN(C)C[C@H](C)NC(=O)C[C@H]2CC[N@@H+](C)C2)c(C)s1 ZINC001420667261 1377461109 /nfs/dbraw/zinc/46/11/09/1377461109.db2.gz PQTPDCWQBHKYCS-XJKSGUPXSA-N 1 3 337.533 2.643 10 0 EFAEHO CC[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001438315239 1388502565 /nfs/dbraw/zinc/50/25/65/1388502565.db2.gz YJDNPKULFIAKGH-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](CCNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001420707318 1377542296 /nfs/dbraw/zinc/54/22/96/1377542296.db2.gz MDIXXIANXWSUNL-UHFFFAOYSA-N 1 3 331.504 2.724 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](CCNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001420707318 1377542298 /nfs/dbraw/zinc/54/22/98/1377542298.db2.gz MDIXXIANXWSUNL-UHFFFAOYSA-N 1 3 331.504 2.724 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H](C)[NH2+]CC2CC(F)(F)C2)CC1 ZINC001420758461 1377607744 /nfs/dbraw/zinc/60/77/44/1377607744.db2.gz ACPDKWUQFFKDMU-AWEZNQCLSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H](C)[NH2+]CC2CC(F)(F)C2)CC1 ZINC001420758469 1377607758 /nfs/dbraw/zinc/60/77/58/1377607758.db2.gz ACPDKWUQFFKDMU-CQSZACIVSA-N 1 3 345.478 2.589 10 0 EFAEHO CC[NH2+][C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)c1ccccc1 ZINC001420776407 1377648403 /nfs/dbraw/zinc/64/84/03/1377648403.db2.gz NKJDVXHNEHHGDI-QFBILLFUSA-N 1 3 335.467 2.666 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@H]2CCN2CC/C=C\c2ccccc2)C1 ZINC001420878907 1377823436 /nfs/dbraw/zinc/82/34/36/1377823436.db2.gz CIBAIIFOUDSJCD-GCDVTEQJSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@H]2CCN2CC/C=C\c2ccccc2)C1 ZINC001420878907 1377823438 /nfs/dbraw/zinc/82/34/38/1377823438.db2.gz CIBAIIFOUDSJCD-GCDVTEQJSA-N 1 3 341.499 2.622 10 0 EFAEHO CC[C@H](F)C[N@@H+]1CC[C@@H](CCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001420882361 1377829227 /nfs/dbraw/zinc/82/92/27/1377829227.db2.gz ZGFBIQFPJHGGJQ-CVEARBPZSA-N 1 3 329.504 2.541 10 0 EFAEHO CC[C@H](F)C[N@H+]1CC[C@@H](CCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001420882361 1377829232 /nfs/dbraw/zinc/82/92/32/1377829232.db2.gz ZGFBIQFPJHGGJQ-CVEARBPZSA-N 1 3 329.504 2.541 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]Cc1cnccc1C ZINC001438344120 1388522070 /nfs/dbraw/zinc/52/20/70/1388522070.db2.gz ORDYAAJKRXZPKR-RBUKOAKNSA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]Cc2cccc(Cl)c2)CC1)N1CCCC1 ZINC001420967648 1377953237 /nfs/dbraw/zinc/95/32/37/1377953237.db2.gz FQDKCUWKSHREJK-UHFFFAOYSA-N 1 3 349.906 2.953 10 0 EFAEHO CC(C)(C(=O)NCC1(NCc2cccc(Cl)c2)CC1)[NH+]1CCCC1 ZINC001420967648 1377953238 /nfs/dbraw/zinc/95/32/38/1377953238.db2.gz FQDKCUWKSHREJK-UHFFFAOYSA-N 1 3 349.906 2.953 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+][C@@H]2CCc3ccc(Cl)cc32)CC1 ZINC001420994130 1377992035 /nfs/dbraw/zinc/99/20/35/1377992035.db2.gz JAQJUXWIMJAYBS-QGZVFWFLSA-N 1 3 349.906 2.908 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1(NCc2ccsc2)CC1)[NH+]1CCCC1 ZINC001421003307 1378006396 /nfs/dbraw/zinc/00/63/96/1378006396.db2.gz CAPRLBVFJIVOPS-MRXNPFEDSA-N 1 3 335.517 2.607 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@@H]3C)CC2)c1 ZINC001421006975 1378011355 /nfs/dbraw/zinc/01/13/55/1378011355.db2.gz QWPIZWVYGSBQCC-HDICACEKSA-N 1 3 343.515 2.915 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C1(CNC(=O)CN2[C@H](C)CC[C@H]2C)CC1 ZINC001421007112 1378012064 /nfs/dbraw/zinc/01/20/64/1378012064.db2.gz SANDFNDFLAHLKH-HZPDHXFCSA-N 1 3 347.478 2.745 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCc2ccccc2)C[C@H]1C ZINC001421103745 1378131685 /nfs/dbraw/zinc/13/16/85/1378131685.db2.gz LGSSQMAIAUCRRU-IEBWSBKVSA-N 1 3 331.504 2.538 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1(C)CC[NH+](CC[C@@H](C)F)CC1 ZINC001421265724 1378376937 /nfs/dbraw/zinc/37/69/37/1378376937.db2.gz ISVCDBCZHVKZQT-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)CC[NH+]1CCC(C)(CNC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001421273029 1378390888 /nfs/dbraw/zinc/39/08/88/1378390888.db2.gz AVAZKKMXPYLMJX-QGZVFWFLSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2C)C1)[NH+](CC)CC ZINC001421276459 1378400076 /nfs/dbraw/zinc/40/00/76/1378400076.db2.gz PYHQZLDOFOIZTB-RTBURBONSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccc(CN2CCC[C@](C)(CNC(=O)CC[NH+](C)C)C2)cc1F ZINC001421282243 1378418876 /nfs/dbraw/zinc/41/88/76/1378418876.db2.gz FHVWYXZQWGEMBR-HXUWFJFHSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@]1(C)CCC[N@H+](CCCC(C)C)C1)N(C)C ZINC001421285464 1378429785 /nfs/dbraw/zinc/42/97/85/1378429785.db2.gz BAAARWZKIJZLFH-PKOBYXMFSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CCCC(C)C)C1)N(C)C ZINC001421285464 1378429788 /nfs/dbraw/zinc/42/97/88/1378429788.db2.gz BAAARWZKIJZLFH-PKOBYXMFSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)NC[C@]1(C)CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001421291512 1378443327 /nfs/dbraw/zinc/44/33/27/1378443327.db2.gz PLVPJRWUCUVMNH-FQEVSTJZSA-N 1 3 337.552 2.983 10 0 EFAEHO CCCN(C)CC(=O)NC[C@]1(C)CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001421291512 1378443330 /nfs/dbraw/zinc/44/33/30/1378443330.db2.gz PLVPJRWUCUVMNH-FQEVSTJZSA-N 1 3 337.552 2.983 10 0 EFAEHO CN(C(=O)CC[C@@H]1CCC[N@@H+]1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001421302680 1378465326 /nfs/dbraw/zinc/46/53/26/1378465326.db2.gz OFAMSTGPYFIENJ-RBUKOAKNSA-N 1 3 329.488 2.594 10 0 EFAEHO CN(C(=O)CC[C@@H]1CCC[N@H+]1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001421302680 1378465330 /nfs/dbraw/zinc/46/53/30/1378465330.db2.gz OFAMSTGPYFIENJ-RBUKOAKNSA-N 1 3 329.488 2.594 10 0 EFAEHO CN(C(=O)C(C)(C)[N@H+](C)C1CCCC1)[C@H]1CCN(CCCF)C1 ZINC001421330597 1378503296 /nfs/dbraw/zinc/50/32/96/1378503296.db2.gz SFSJKJDIWNPRQF-INIZCTEOSA-N 1 3 327.488 2.532 10 0 EFAEHO CN(C(=O)C(C)(C)[N@@H+](C)C1CCCC1)[C@H]1CCN(CCCF)C1 ZINC001421330597 1378503299 /nfs/dbraw/zinc/50/32/99/1378503299.db2.gz SFSJKJDIWNPRQF-INIZCTEOSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1cc(F)ccc1C ZINC001421443453 1378623684 /nfs/dbraw/zinc/62/36/84/1378623684.db2.gz VLSUXAYUFUNLTF-GOSISDBHSA-N 1 3 349.494 2.993 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC2(C[NH2+]Cc3ccsc3)CCCC2)C1 ZINC001421513243 1378722581 /nfs/dbraw/zinc/72/25/81/1378722581.db2.gz RLGIDEYLDLVMJQ-OAHLLOKOSA-N 1 3 335.517 2.609 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@](C)(C[NH2+]CC1CCCC1)C1CC1 ZINC001421545979 1378789400 /nfs/dbraw/zinc/78/94/00/1378789400.db2.gz SHBMDRFOCOACIT-AZUAARDMSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@](C)(C[NH2+]CC1CCCC1)C1CC1 ZINC001421545983 1378789684 /nfs/dbraw/zinc/78/96/84/1378789684.db2.gz SHBMDRFOCOACIT-ICSRJNTNSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@@H](NC/C=C/Cl)c1ccc(CNC(=O)C23CC[NH+](CC2)C3)cc1 ZINC001421657378 1378959099 /nfs/dbraw/zinc/95/90/99/1378959099.db2.gz YHHJOZPISQGDPC-VGRIEHBSSA-N 1 3 347.890 2.802 10 0 EFAEHO CC[C@@H](C(=O)N[C@](C)(C[NH2+]Cc1cc(C)ccc1F)C1CC1)N(C)C ZINC001438423547 1388583087 /nfs/dbraw/zinc/58/30/87/1388583087.db2.gz ZTIWJVNAARROLG-AZUAARDMSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@H](C)C[NH2+]Cc1ccsc1 ZINC001421741352 1379063569 /nfs/dbraw/zinc/06/35/69/1379063569.db2.gz UIIVINVDILSYAP-RDJZCZTQSA-N 1 3 337.533 2.853 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@](C)(C[NH2+]Cc1ccccc1F)C1CC1 ZINC001438429751 1388590754 /nfs/dbraw/zinc/59/07/54/1388590754.db2.gz VKAIUCAEYIECLE-IBGZPJMESA-N 1 3 335.467 2.540 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+]CC2CCC3(CC3)CC2)CCC1 ZINC001421777633 1379124088 /nfs/dbraw/zinc/12/40/88/1379124088.db2.gz JHPFNEICORCBGP-UHFFFAOYSA-N 1 3 335.536 2.927 10 0 EFAEHO Cc1ccc(F)c(CN2CCC[C@H](NC(=O)CC[NH+](C)C)CC2)c1 ZINC001421821061 1379178751 /nfs/dbraw/zinc/17/87/51/1379178751.db2.gz GPJKKPWYDGZNGB-KRWDZBQOSA-N 1 3 335.467 2.557 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CCC[N@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001421822399 1379181390 /nfs/dbraw/zinc/18/13/90/1379181390.db2.gz OMGXFRVOFISLQL-ROUUACIJSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CCC[N@@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001421822399 1379181395 /nfs/dbraw/zinc/18/13/95/1379181395.db2.gz OMGXFRVOFISLQL-ROUUACIJSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CCC[N@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001421822396 1379181496 /nfs/dbraw/zinc/18/14/96/1379181496.db2.gz OMGXFRVOFISLQL-MSOLQXFVSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CCC[N@@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001421822396 1379181502 /nfs/dbraw/zinc/18/15/02/1379181502.db2.gz OMGXFRVOFISLQL-MSOLQXFVSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(CNC(=O)[C@H]2CCCN2C(C)C)CCCC1 ZINC001421835356 1379204933 /nfs/dbraw/zinc/20/49/33/1379204933.db2.gz UJYCWBINQALDAS-HZPDHXFCSA-N 1 3 327.488 2.626 10 0 EFAEHO C[C@H](C[NH2+][C@@H]1CCc2ccccc21)N(C)C(=O)CN(C)C1CCC1 ZINC001421900910 1379327080 /nfs/dbraw/zinc/32/70/80/1379327080.db2.gz HSBPGMSRGHGEKJ-DNVCBOLYSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@H](C[NH2+][C@H]1CCc2ccccc21)N(C)C(=O)CN(C)C1CCC1 ZINC001421900907 1379327258 /nfs/dbraw/zinc/32/72/58/1379327258.db2.gz HSBPGMSRGHGEKJ-BEFAXECRSA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](C)N(C)C(=O)CC[NH+](C)C ZINC001421924916 1379357537 /nfs/dbraw/zinc/35/75/37/1379357537.db2.gz DWLAQIQALNOSHA-CQSZACIVSA-N 1 3 325.884 2.537 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001421935007 1379373802 /nfs/dbraw/zinc/37/38/02/1379373802.db2.gz BFPJOUURCMPMMN-DLBZAZTESA-N 1 3 343.515 2.842 10 0 EFAEHO CCC1([NH2+]Cc2ccc(C)cc2)CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001421940102 1379382028 /nfs/dbraw/zinc/38/20/28/1379382028.db2.gz OUIYLZRFGDISQF-LJQANCHMSA-N 1 3 343.515 2.950 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(CC)([NH2+]Cc2cncc(C)c2)CC1 ZINC001421953462 1379402336 /nfs/dbraw/zinc/40/23/36/1379402336.db2.gz URXBFLGUNLYJNG-UHFFFAOYSA-N 1 3 346.519 2.593 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@]2(CC[N@H+](CC3CCCC3)C2)C1 ZINC001421953542 1379402482 /nfs/dbraw/zinc/40/24/82/1379402482.db2.gz DGHHYBNCQVTGLU-HXUWFJFHSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@]2(CC[N@@H+](CC3CCCC3)C2)C1 ZINC001421953542 1379402486 /nfs/dbraw/zinc/40/24/86/1379402486.db2.gz DGHHYBNCQVTGLU-HXUWFJFHSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@]2(CC[N@H+](CC3CCCC3)C2)C1 ZINC001421953537 1379402631 /nfs/dbraw/zinc/40/26/31/1379402631.db2.gz DGHHYBNCQVTGLU-FQEVSTJZSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@]2(CC[N@@H+](CC3CCCC3)C2)C1 ZINC001421953537 1379402634 /nfs/dbraw/zinc/40/26/34/1379402634.db2.gz DGHHYBNCQVTGLU-FQEVSTJZSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1cccc(OC)c1 ZINC001421988468 1379444331 /nfs/dbraw/zinc/44/43/31/1379444331.db2.gz RMBJJGZTBFQUFP-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@H](C[NH2+]Cc1cc2ccccc2s1)N(C)C(=O)CN1CCCC1 ZINC001421994706 1379453769 /nfs/dbraw/zinc/45/37/69/1379453769.db2.gz PCFDWPSDPWFXEM-OAHLLOKOSA-N 1 3 345.512 2.934 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001422029492 1379513049 /nfs/dbraw/zinc/51/30/49/1379513049.db2.gz NGQCAXDDQDASOU-IEBWSBKVSA-N 1 3 331.504 2.662 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC(CC[N@H+](C)Cc2ccsc2)CC1 ZINC001422049335 1379541480 /nfs/dbraw/zinc/54/14/80/1379541480.db2.gz LRJNZBKCYQUBQN-GOSISDBHSA-N 1 3 349.544 2.903 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC(CC[N@@H+](C)Cc2ccsc2)CC1 ZINC001422049335 1379541482 /nfs/dbraw/zinc/54/14/82/1379541482.db2.gz LRJNZBKCYQUBQN-GOSISDBHSA-N 1 3 349.544 2.903 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]CCc2cccs2)CC1 ZINC001422071108 1379571300 /nfs/dbraw/zinc/57/13/00/1379571300.db2.gz YQCGQQFARQTHPR-UHFFFAOYSA-N 1 3 337.533 2.603 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H]2[C@@H](C)CCCN2C(=O)CC[NH+](C)C)c1 ZINC001422070266 1379571648 /nfs/dbraw/zinc/57/16/48/1379571648.db2.gz WWBBNWZCPGBEMW-LPHOPBHVSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C)([NH2+]CCc2ccccc2F)CC1 ZINC001422073667 1379574668 /nfs/dbraw/zinc/57/46/68/1379574668.db2.gz KDUXZFCQODLMGN-UHFFFAOYSA-N 1 3 349.494 2.679 10 0 EFAEHO Cc1cc(F)ccc1CN1CC[C@@H](NC(=O)CC[NH+](C)C)C[C@@H]1C ZINC001422117297 1379636014 /nfs/dbraw/zinc/63/60/14/1379636014.db2.gz BWJJFEBEAVLFOC-MAUKXSAKSA-N 1 3 335.467 2.555 10 0 EFAEHO COc1cccc([C@H](C)N(C)CCN(C)C(=O)[C@H](C(C)C)[NH+](C)C)c1 ZINC001422174700 1379726522 /nfs/dbraw/zinc/72/65/22/1379726522.db2.gz QCFQBQURDYHWFR-LPHOPBHVSA-N 1 3 349.519 2.733 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)CCN(C)C(=O)[C@@H]2CCCCN2C)c1 ZINC001422176256 1379728551 /nfs/dbraw/zinc/72/85/51/1379728551.db2.gz ROPKOGSJKHXKQX-LPHOPBHVSA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)CCN(C)C(=O)[C@@H]2CCCCN2C)c1 ZINC001422176256 1379728553 /nfs/dbraw/zinc/72/85/53/1379728553.db2.gz ROPKOGSJKHXKQX-LPHOPBHVSA-N 1 3 347.503 2.631 10 0 EFAEHO C[N@H+](C/C=C/c1ccccc1)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001422242284 1379842210 /nfs/dbraw/zinc/84/22/10/1379842210.db2.gz HQTNYURCIKOXGR-OEMHODTASA-N 1 3 341.499 2.718 10 0 EFAEHO C[N@@H+](C/C=C/c1ccccc1)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001422242284 1379842213 /nfs/dbraw/zinc/84/22/13/1379842213.db2.gz HQTNYURCIKOXGR-OEMHODTASA-N 1 3 341.499 2.718 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2CC2CC(C)(C)C2)C1 ZINC001422243261 1379845098 /nfs/dbraw/zinc/84/50/98/1379845098.db2.gz GEIKXTAUAXTNHG-QZTJIDSGSA-N 1 3 335.536 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2CC2CC(C)(C)C2)C1 ZINC001422243261 1379845107 /nfs/dbraw/zinc/84/51/07/1379845107.db2.gz GEIKXTAUAXTNHG-QZTJIDSGSA-N 1 3 335.536 2.687 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[N@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001422247536 1379855305 /nfs/dbraw/zinc/85/53/05/1379855305.db2.gz OQPSTXSPMLPVEZ-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001422247536 1379855311 /nfs/dbraw/zinc/85/53/11/1379855311.db2.gz OQPSTXSPMLPVEZ-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2CCc2cccs2)C1 ZINC001422248557 1379857023 /nfs/dbraw/zinc/85/70/23/1379857023.db2.gz OUJNMFPRJKQPMB-SJLPKXTDSA-N 1 3 349.544 2.554 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2CCc2cccs2)C1 ZINC001422248557 1379857028 /nfs/dbraw/zinc/85/70/28/1379857028.db2.gz OUJNMFPRJKQPMB-SJLPKXTDSA-N 1 3 349.544 2.554 10 0 EFAEHO CN(CC(=O)NC1CC(C[NH2+]Cc2ccccc2Cl)C1)C1CCC1 ZINC001422264894 1379881282 /nfs/dbraw/zinc/88/12/82/1379881282.db2.gz IOAGDXPKFSHHRF-UHFFFAOYSA-N 1 3 349.906 2.809 10 0 EFAEHO CCc1ccccc1C[NH2+]CC1CC(NC(=O)C2(N(C)C)CCC2)C1 ZINC001422265028 1379881931 /nfs/dbraw/zinc/88/19/31/1379881931.db2.gz JLWXRRCYEXKSKM-UHFFFAOYSA-N 1 3 343.515 2.718 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001422315276 1379924640 /nfs/dbraw/zinc/92/46/40/1379924640.db2.gz CKHDPUORFPZADT-LSDHHAIUSA-N 1 3 343.471 2.900 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)CC(C)(C)C)cc1 ZINC001422372726 1380001008 /nfs/dbraw/zinc/00/10/08/1380001008.db2.gz DVUOWXFIXGMJFV-IRXDYDNUSA-N 1 3 333.520 2.956 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)[C@@H](C)NC(=O)CC2CC[NH+](C)CC2)c1 ZINC001422380159 1380009390 /nfs/dbraw/zinc/00/93/90/1380009390.db2.gz QLDBNJLKOSODPM-HZPDHXFCSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC001422421495 1380069068 /nfs/dbraw/zinc/06/90/68/1380069068.db2.gz ALFUMFLQFSYNPA-RDTXWAMCSA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001422451813 1380124087 /nfs/dbraw/zinc/12/40/87/1380124087.db2.gz NXABTKDCIORCLG-JKSUJKDBSA-N 1 3 331.504 2.887 10 0 EFAEHO CCN(CC[NH2+][C@@H](C)c1ccc(Cl)cc1)C(=O)CN1CCCC1 ZINC001422458649 1380137823 /nfs/dbraw/zinc/13/78/23/1380137823.db2.gz LCMXSKASCIPOCL-HNNXBMFYSA-N 1 3 337.895 2.935 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCN2C(C)C)cc1C ZINC001422491654 1380193237 /nfs/dbraw/zinc/19/32/37/1380193237.db2.gz BZTYCSYQTPRHLS-IEBWSBKVSA-N 1 3 331.504 2.771 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+]2CCO[C@@H](C(C)(C)C)CC2)CC1 ZINC001422507148 1380218122 /nfs/dbraw/zinc/21/81/22/1380218122.db2.gz WCXXVWFTNHFZPG-GOSISDBHSA-N 1 3 325.541 2.540 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+]2CCO[C@@H](C(C)(C)C)CC2)CC1 ZINC001422507148 1380218131 /nfs/dbraw/zinc/21/81/31/1380218131.db2.gz WCXXVWFTNHFZPG-GOSISDBHSA-N 1 3 325.541 2.540 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[N@H+](C)Cc1ccccc1C ZINC001422516676 1380238850 /nfs/dbraw/zinc/23/88/50/1380238850.db2.gz JYJKSVHXDCERRM-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[N@@H+](C)Cc1ccccc1C ZINC001422516676 1380238851 /nfs/dbraw/zinc/23/88/51/1380238851.db2.gz JYJKSVHXDCERRM-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[N@H+](C)CCc1ccccc1 ZINC001422518907 1380242649 /nfs/dbraw/zinc/24/26/49/1380242649.db2.gz NZDMCRCCIWPNHD-MJGOQNOKSA-N 1 3 331.504 2.540 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[N@@H+](C)CCc1ccccc1 ZINC001422518907 1380242650 /nfs/dbraw/zinc/24/26/50/1380242650.db2.gz NZDMCRCCIWPNHD-MJGOQNOKSA-N 1 3 331.504 2.540 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1C ZINC001422520208 1380244560 /nfs/dbraw/zinc/24/45/60/1380244560.db2.gz PYRJMZJKSLAYDH-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1C ZINC001422520208 1380244561 /nfs/dbraw/zinc/24/45/61/1380244561.db2.gz PYRJMZJKSLAYDH-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1 ZINC001422529246 1380261453 /nfs/dbraw/zinc/26/14/53/1380261453.db2.gz MBQGJCJJNUEHRF-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1 ZINC001422529246 1380261456 /nfs/dbraw/zinc/26/14/56/1380261456.db2.gz MBQGJCJJNUEHRF-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CCCc1ccc(C[NH2+]C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001422547338 1380297249 /nfs/dbraw/zinc/29/72/49/1380297249.db2.gz APWURHNEJLZJSF-DLBZAZTESA-N 1 3 331.504 2.575 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[N@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001422550128 1380302164 /nfs/dbraw/zinc/30/21/64/1380302164.db2.gz YBRHUHXYQUOMMR-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001422550128 1380302168 /nfs/dbraw/zinc/30/21/68/1380302168.db2.gz YBRHUHXYQUOMMR-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)N(C)Cc1ccc(Cl)cc1 ZINC001422581305 1380361847 /nfs/dbraw/zinc/36/18/47/1380361847.db2.gz SWGNQALIOXXZLK-GDBMZVCRSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(Cl)cc1 ZINC001422581305 1380361850 /nfs/dbraw/zinc/36/18/50/1380361850.db2.gz SWGNQALIOXXZLK-GDBMZVCRSA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)CC1CCC(F)(F)CC1 ZINC001422602636 1380405525 /nfs/dbraw/zinc/40/55/25/1380405525.db2.gz LAHKJTFIMXTHAQ-CQSZACIVSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)CC1CCC(F)(F)CC1 ZINC001422602636 1380405527 /nfs/dbraw/zinc/40/55/27/1380405527.db2.gz LAHKJTFIMXTHAQ-CQSZACIVSA-N 1 3 333.467 2.589 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H](C)NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)c1 ZINC001422697064 1380621661 /nfs/dbraw/zinc/62/16/61/1380621661.db2.gz OYHOPHZDCHTINA-OXJNMPFZSA-N 1 3 349.494 2.802 10 0 EFAEHO Cc1ccc(C)c(C[NH+]2CC([C@@H](C)NC(=O)CN(C)C(C)C)C2)c1 ZINC001422759945 1380768605 /nfs/dbraw/zinc/76/86/05/1380768605.db2.gz GRXJNNYXBBVTDF-QGZVFWFLSA-N 1 3 331.504 2.580 10 0 EFAEHO Cc1ccc(C)c(C[NH+]2CC([C@H](C)NC(=O)CN(C)C(C)C)C2)c1 ZINC001422759944 1380768784 /nfs/dbraw/zinc/76/87/84/1380768784.db2.gz GRXJNNYXBBVTDF-KRWDZBQOSA-N 1 3 331.504 2.580 10 0 EFAEHO Cc1cccc([C@@H](C)[NH+]2CC([C@@H](C)NC(=O)CN(C)C(C)C)C2)c1 ZINC001422761308 1380769356 /nfs/dbraw/zinc/76/93/56/1380769356.db2.gz MDVJYIZPAYXBHX-IAGOWNOFSA-N 1 3 331.504 2.833 10 0 EFAEHO CCc1cccc(CN2C[C@@H](NC(=O)CCC[NH+](C)C)C(C)(C)C2)c1 ZINC001422781398 1380795009 /nfs/dbraw/zinc/79/50/09/1380795009.db2.gz AIOXLWBTOHWZRA-LJQANCHMSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@@H](c1ccccc1)N1C[C@@H](NC(=O)C2(C[NH+](C)C)CC2)C(C)(C)C1 ZINC001422789695 1380809499 /nfs/dbraw/zinc/80/94/99/1380809499.db2.gz QDKRBCFDQMQNFM-FUHWJXTLSA-N 1 3 343.515 2.916 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1CN(Cc2cccc(C)c2)CC1(C)C ZINC001422807371 1380837226 /nfs/dbraw/zinc/83/72/26/1380837226.db2.gz OPWIVTSVGFNSFE-GOSISDBHSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1CN(Cc2cccc(C)c2)CC1(C)C ZINC001422807371 1380837233 /nfs/dbraw/zinc/83/72/33/1380837233.db2.gz OPWIVTSVGFNSFE-GOSISDBHSA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCCCCC3)C[C@H]21 ZINC001422862428 1380960605 /nfs/dbraw/zinc/96/06/05/1380960605.db2.gz NUOPUJBSXMLHPV-LDLYASANSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCCCCC3)C[C@H]21 ZINC001422862428 1380960609 /nfs/dbraw/zinc/96/06/09/1380960609.db2.gz NUOPUJBSXMLHPV-LDLYASANSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](CC3CC(C)(C)C3)C[C@H]2C1 ZINC001422863125 1380962300 /nfs/dbraw/zinc/96/23/00/1380962300.db2.gz CAJDOFCOLNJIJE-IPMKNSEASA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CC3CC(C)(C)C3)C[C@H]2C1 ZINC001422863125 1380962305 /nfs/dbraw/zinc/96/23/05/1380962305.db2.gz CAJDOFCOLNJIJE-IPMKNSEASA-N 1 3 349.563 2.980 10 0 EFAEHO Cc1ccc(CCC[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001422879724 1380991883 /nfs/dbraw/zinc/99/18/83/1380991883.db2.gz RJNOENHEIQQPNT-RBUKOAKNSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CCC[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001422879724 1380991886 /nfs/dbraw/zinc/99/18/86/1380991886.db2.gz RJNOENHEIQQPNT-RBUKOAKNSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@@H]([NH2+]C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)C1)c1ccccc1 ZINC001422896710 1381020095 /nfs/dbraw/zinc/02/00/95/1381020095.db2.gz UBSBXEZSWKUIQC-JFIYKMOQSA-N 1 3 329.488 2.716 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@H]2CCc3c2cccc3F)C1 ZINC001422903855 1381031852 /nfs/dbraw/zinc/03/18/52/1381031852.db2.gz BGCQHPBAZPNTPI-DOXZYTNZSA-N 1 3 347.478 2.639 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccccc2F)C1)N(C)C ZINC001422909857 1381038338 /nfs/dbraw/zinc/03/83/38/1381038338.db2.gz SFXQUAACYCJUEO-XSWJXKHESA-N 1 3 335.467 2.711 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCCC2)cc1F ZINC001438609351 1388695885 /nfs/dbraw/zinc/69/58/85/1388695885.db2.gz AICKNEAJIWUKEO-UHFFFAOYSA-N 1 3 349.494 2.993 10 0 EFAEHO C[C@H](C[N@H+](C)CC1CCCC1)NC(=O)c1cccc(CN(C)C)c1 ZINC001422921602 1381062449 /nfs/dbraw/zinc/06/24/49/1381062449.db2.gz WXDUFGGSMLUAHV-MRXNPFEDSA-N 1 3 331.504 2.989 10 0 EFAEHO C[C@H](C[N@@H+](C)CC1CCCC1)NC(=O)c1cccc(CN(C)C)c1 ZINC001422921602 1381062455 /nfs/dbraw/zinc/06/24/55/1381062455.db2.gz WXDUFGGSMLUAHV-MRXNPFEDSA-N 1 3 331.504 2.989 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H](NC(=O)C2(N(C)C)CCC2)C2CC2)c1 ZINC001422997249 1381181213 /nfs/dbraw/zinc/18/12/13/1381181213.db2.gz CPJYQAIRTFISNP-SFHVURJKSA-N 1 3 347.478 2.603 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001423000776 1381185806 /nfs/dbraw/zinc/18/58/06/1381185806.db2.gz LJYJSXDJGAHQPH-OALUTQOASA-N 1 3 347.547 2.926 10 0 EFAEHO C[C@@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001423071278 1381299592 /nfs/dbraw/zinc/29/95/92/1381299592.db2.gz IWSMJBOJHJGGOR-HNNXBMFYSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001423084043 1381319214 /nfs/dbraw/zinc/31/92/14/1381319214.db2.gz VEOFTDYDPONEAS-YJBOKZPZSA-N 1 3 329.488 2.595 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C[C@@H](C)N(C)C(=O)CN(C)C2CCC2)c1 ZINC001438646135 1388716444 /nfs/dbraw/zinc/71/64/44/1388716444.db2.gz BMLPEKIXFSPDDB-HZPDHXFCSA-N 1 3 347.503 2.677 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@@H](C)NC/C=C/Cl)[NH+]1CCCCC1 ZINC001423171407 1381499097 /nfs/dbraw/zinc/49/90/97/1381499097.db2.gz MJSGXUBNXYKEST-GUFYHEMZSA-N 1 3 329.916 2.686 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+]CC2CC3(CCC3)C2)CC1 ZINC001423227578 1381624990 /nfs/dbraw/zinc/62/49/90/1381624990.db2.gz JBXFSUIRVJCGBY-KRWDZBQOSA-N 1 3 333.520 2.680 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001438680060 1388735428 /nfs/dbraw/zinc/73/54/28/1388735428.db2.gz HXSDBAYRSLPJOG-QAPCUYQASA-N 1 3 331.504 2.582 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N(C)[C@H](C)CNCc2ccccc2F)C1 ZINC001438680460 1388736495 /nfs/dbraw/zinc/73/64/95/1388736495.db2.gz JJKMEFYAUNEUQD-AEFFLSMTSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N(C)[C@H](C)CNCc2ccccc2F)C1 ZINC001438680460 1388736497 /nfs/dbraw/zinc/73/64/97/1388736497.db2.gz JJKMEFYAUNEUQD-AEFFLSMTSA-N 1 3 349.494 2.884 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001423245692 1381671237 /nfs/dbraw/zinc/67/12/37/1381671237.db2.gz PEFODGZOBHGFTP-MSOLQXFVSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001423245692 1381671255 /nfs/dbraw/zinc/67/12/55/1381671255.db2.gz PEFODGZOBHGFTP-MSOLQXFVSA-N 1 3 345.462 2.581 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)c(C)s1 ZINC001423328758 1381793014 /nfs/dbraw/zinc/79/30/14/1381793014.db2.gz MZDOBFYUVTUVII-RHSMWYFYSA-N 1 3 337.533 2.784 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)c1 ZINC001423331971 1381795137 /nfs/dbraw/zinc/79/51/37/1381795137.db2.gz SYGVANHTKMKACO-MJGOQNOKSA-N 1 3 331.504 2.723 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)c1 ZINC001423333172 1381797327 /nfs/dbraw/zinc/79/73/27/1381797327.db2.gz WQRCSHXOCIXTJN-QAPCUYQASA-N 1 3 335.467 2.553 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCCC1CCCC1 ZINC001423358656 1381841368 /nfs/dbraw/zinc/84/13/68/1381841368.db2.gz XGVLBMRVQLQOGP-KDURUIRLSA-N 1 3 335.536 2.974 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CC3CCC3)[C@H]2C1)CC(C)(C)C ZINC001423366286 1381854657 /nfs/dbraw/zinc/85/46/57/1381854657.db2.gz WHZICRZQLJGJAB-GBESFXJTSA-N 1 3 349.563 2.981 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CC3CCC3)[C@@H]2C1)CC(C)(C)C ZINC001423366291 1381855662 /nfs/dbraw/zinc/85/56/62/1381855662.db2.gz WHZICRZQLJGJAB-OTWHNJEPSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(CC[N@H+](CC3CC(C)(C)C3)C2)C1 ZINC001423377381 1381874598 /nfs/dbraw/zinc/87/45/98/1381874598.db2.gz LVEWCPQGFAYPQK-HXUWFJFHSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(CC[N@@H+](CC3CC(C)(C)C3)C2)C1 ZINC001423377381 1381874606 /nfs/dbraw/zinc/87/46/06/1381874606.db2.gz LVEWCPQGFAYPQK-HXUWFJFHSA-N 1 3 335.536 2.687 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CC[C@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001423408476 1381917082 /nfs/dbraw/zinc/91/70/82/1381917082.db2.gz CLXKAIMXMNVWBP-OALUTQOASA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001423424363 1381933962 /nfs/dbraw/zinc/93/39/62/1381933962.db2.gz VPLCPVKZDSXEGH-AEFFLSMTSA-N 1 3 335.536 2.781 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H]1CCCN1C(=O)CC[NH+](C)C ZINC001423476743 1381972676 /nfs/dbraw/zinc/97/26/76/1381972676.db2.gz IJJLQLNRCZNEGJ-HNNXBMFYSA-N 1 3 337.895 2.681 10 0 EFAEHO CCCN(C)CC(=O)NC1(C)CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001423524757 1382015993 /nfs/dbraw/zinc/01/59/93/1382015993.db2.gz OIBONEXKOUWZNU-KURKYZTESA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2CCC1CC1)N(CC)CC ZINC001423535212 1382029465 /nfs/dbraw/zinc/02/94/65/1382029465.db2.gz QSBQYGGRBKERTB-QYZOEREBSA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2CCC1CC1)N(CC)CC ZINC001423535212 1382029468 /nfs/dbraw/zinc/02/94/68/1382029468.db2.gz QSBQYGGRBKERTB-QYZOEREBSA-N 1 3 335.536 2.972 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001438715092 1388758248 /nfs/dbraw/zinc/75/82/48/1388758248.db2.gz OTEPENFUSHDBHK-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001438715092 1388758250 /nfs/dbraw/zinc/75/82/50/1388758250.db2.gz OTEPENFUSHDBHK-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]CC1CCC(C)(C)CC1 ZINC001438717985 1388760294 /nfs/dbraw/zinc/76/02/94/1388760294.db2.gz WVEBHNDQTYEBIK-MRXNPFEDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001423570327 1382088604 /nfs/dbraw/zinc/08/86/04/1382088604.db2.gz GCMZUEAUXBGEGN-IAGOWNOFSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001423570327 1382088609 /nfs/dbraw/zinc/08/86/09/1382088609.db2.gz GCMZUEAUXBGEGN-IAGOWNOFSA-N 1 3 327.488 2.532 10 0 EFAEHO CCc1ccc(CN2CC[C@](C)(NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)cc1 ZINC001423583032 1382113359 /nfs/dbraw/zinc/11/33/59/1382113359.db2.gz JGRQFSRHOIHPRN-FPOVZHCZSA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1ccc(CN2CC[C@](C)(NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)cc1 ZINC001423583032 1382113363 /nfs/dbraw/zinc/11/33/63/1382113363.db2.gz JGRQFSRHOIHPRN-FPOVZHCZSA-N 1 3 343.515 2.671 10 0 EFAEHO CC[C@@H](C(=O)NCC1(C)CC[NH+](CCC(C)(C)C)CC1)N(C)C ZINC001423674058 1382263746 /nfs/dbraw/zinc/26/37/46/1382263746.db2.gz XZMIKJOMFXDQON-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H](C(=O)NC[C@]1(C)CCC[N@H+](CCCF)C1)N1CCCCCC1 ZINC001423705824 1382323885 /nfs/dbraw/zinc/32/38/85/1382323885.db2.gz RECBZZLJMKGTFX-HKUYNNGSSA-N 1 3 341.515 2.829 10 0 EFAEHO C[C@@H](C(=O)NC[C@]1(C)CCC[N@@H+](CCCF)C1)N1CCCCCC1 ZINC001423705824 1382323888 /nfs/dbraw/zinc/32/38/88/1382323888.db2.gz RECBZZLJMKGTFX-HKUYNNGSSA-N 1 3 341.515 2.829 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([C@H](C)[NH2+]CCc2ccccc2F)C1 ZINC001423957162 1382545315 /nfs/dbraw/zinc/54/53/15/1382545315.db2.gz QAWOBZRVYNFPFG-WMZOPIPTSA-N 1 3 349.494 2.535 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)CCC1CCN(C(=O)[C@@H](CC)N(C)C)CC1 ZINC001438768280 1388797446 /nfs/dbraw/zinc/79/74/46/1388797446.db2.gz WMAJJDWQLNEWSG-SJLPKXTDSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)CCC1CCN(C(=O)[C@@H](CC)N(C)C)CC1 ZINC001438768280 1388797450 /nfs/dbraw/zinc/79/74/50/1388797450.db2.gz WMAJJDWQLNEWSG-SJLPKXTDSA-N 1 3 325.541 2.933 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([C@H](C)[NH2+]CC2CC(C)(C)C2)C1 ZINC001438773488 1388802984 /nfs/dbraw/zinc/80/29/84/1388802984.db2.gz RRQFVWXLJQDZKI-WMZOPIPTSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)CCC[NH+]1CCC2(CN(C(=O)[C@H](C(C)C)N(C)C)C2)CC1 ZINC001424111477 1382766674 /nfs/dbraw/zinc/76/66/74/1382766674.db2.gz LFQZOXOHNDHJNP-SFHVURJKSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CCC[NH+]1CCC2(CN(C(=O)[C@@H](C(C)C)N(C)C)C2)CC1 ZINC001424111474 1382767012 /nfs/dbraw/zinc/76/70/12/1382767012.db2.gz LFQZOXOHNDHJNP-GOSISDBHSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(CNC(=O)[C@@H](C)N2CCCCCC2)CCC1 ZINC001424194465 1382848595 /nfs/dbraw/zinc/84/85/95/1382848595.db2.gz AMUXREXWTSBEDK-HZPDHXFCSA-N 1 3 327.488 2.628 10 0 EFAEHO CN(CCC[N@H+](C)[C@H]1CCc2ccccc21)C(=O)[C@H]1CCCN1C ZINC001424272576 1382914847 /nfs/dbraw/zinc/91/48/47/1382914847.db2.gz GVHHXHJPLMUQOI-RBUKOAKNSA-N 1 3 329.488 2.548 10 0 EFAEHO CN(CCC[N@@H+](C)[C@H]1CCc2ccccc21)C(=O)[C@H]1CCCN1C ZINC001424272576 1382914851 /nfs/dbraw/zinc/91/48/51/1382914851.db2.gz GVHHXHJPLMUQOI-RBUKOAKNSA-N 1 3 329.488 2.548 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@H+](C)Cc1ccc(Cl)cc1 ZINC001424340866 1382955934 /nfs/dbraw/zinc/95/59/34/1382955934.db2.gz OPMRRPCYAZQPPL-UHFFFAOYSA-N 1 3 339.911 2.961 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001424340866 1382955938 /nfs/dbraw/zinc/95/59/38/1382955938.db2.gz OPMRRPCYAZQPPL-UHFFFAOYSA-N 1 3 339.911 2.961 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+][C@H]1CCCc2ccccc21)N(C)C ZINC001424583841 1383166325 /nfs/dbraw/zinc/16/63/25/1383166325.db2.gz ZUWQQSIHXCPACU-ZYSHUDEJSA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)CC[NH2+][C@@H](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001424597495 1383203071 /nfs/dbraw/zinc/20/30/71/1383203071.db2.gz ZLIZXTKBHKSZKB-YJBOKZPZSA-N 1 3 329.504 2.729 10 0 EFAEHO CC[C@H](F)C[N@H+](CC)CC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001424662866 1383236925 /nfs/dbraw/zinc/23/69/25/1383236925.db2.gz JVZWOBVZMTUMSX-KRWDZBQOSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](F)C[N@@H+](CC)CC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001424662866 1383236931 /nfs/dbraw/zinc/23/69/31/1383236931.db2.gz JVZWOBVZMTUMSX-KRWDZBQOSA-N 1 3 341.515 2.779 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([C@@H]2CC[N@H+](CCC(C)C)C2)C1 ZINC001424696072 1383268435 /nfs/dbraw/zinc/26/84/35/1383268435.db2.gz IHGOGYUGUXUQJF-RTBURBONSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([C@@H]2CC[N@@H+](CCC(C)C)C2)C1 ZINC001424696072 1383268440 /nfs/dbraw/zinc/26/84/40/1383268440.db2.gz IHGOGYUGUXUQJF-RTBURBONSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H]2CC[N@H+](C/C=C\Cl)C2)C1 ZINC001424699427 1383271670 /nfs/dbraw/zinc/27/16/70/1383271670.db2.gz MRSCVKPFBZWXSL-BGHPOGFGSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H]2CC[N@@H+](C/C=C\Cl)C2)C1 ZINC001424699427 1383271672 /nfs/dbraw/zinc/27/16/72/1383271672.db2.gz MRSCVKPFBZWXSL-BGHPOGFGSA-N 1 3 341.927 2.640 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC2CC(NC(=O)CN(C)C3CCC3)C2)c1 ZINC001424725809 1383299169 /nfs/dbraw/zinc/29/91/69/1383299169.db2.gz LZRCHIUCFCDJTJ-UHFFFAOYSA-N 1 3 343.515 2.772 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC1CC(NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001424757725 1383324231 /nfs/dbraw/zinc/32/42/31/1383324231.db2.gz XBDHKYJMXLJZLT-AFMYVXGZSA-N 1 3 345.531 2.874 10 0 EFAEHO C[C@@H](NCc1sccc1Cl)[C@H](C)NC(=O)C1CC[NH+](C)CC1 ZINC001424803309 1383362778 /nfs/dbraw/zinc/36/27/78/1383362778.db2.gz JGGJSHJPCJPPJC-NEPJUHHUSA-N 1 3 343.924 2.726 10 0 EFAEHO C[C@@H](NC(=O)CCC[NH+](C)C)[C@H](C)NCc1cc(Cl)ccc1F ZINC001424823426 1383382961 /nfs/dbraw/zinc/38/29/61/1383382961.db2.gz MFQVKGNDFKNNDI-QWHCGFSZSA-N 1 3 343.874 2.804 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1c(C)cccc1Cl ZINC001424855416 1383423378 /nfs/dbraw/zinc/42/33/78/1383423378.db2.gz WYOZVEADYTYSFT-HUUCEWRRSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CCC([NH2+]Cc2cnccc2C)CC1)N(C)C ZINC001424854934 1383424124 /nfs/dbraw/zinc/42/41/24/1383424124.db2.gz DNEOASRKCREQSF-CTWPCTMYSA-N 1 3 346.519 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC(C)(C)C[NH2+]Cc1ccsc1 ZINC001424902453 1383478933 /nfs/dbraw/zinc/47/89/33/1383478933.db2.gz VARBTHWYIYPFII-UHFFFAOYSA-N 1 3 325.522 2.663 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[N@H+](C)CCCc1ccccc1 ZINC001424937304 1383492067 /nfs/dbraw/zinc/49/20/67/1383492067.db2.gz JBQJNXRWAWEFDD-ICSRJNTNSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[N@@H+](C)CCCc1ccccc1 ZINC001424937304 1383492069 /nfs/dbraw/zinc/49/20/69/1383492069.db2.gz JBQJNXRWAWEFDD-ICSRJNTNSA-N 1 3 345.531 2.929 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC2(C[NH2+]Cc3ccccc3)CCCCC2)C1 ZINC001425179903 1383532877 /nfs/dbraw/zinc/53/28/77/1383532877.db2.gz ZWXHWXBYDXPPCI-GOSISDBHSA-N 1 3 343.515 2.937 10 0 EFAEHO Cc1ccc(CN2CCCCC[C@H]2CNC(=O)CC[NH+](C)C)cc1F ZINC001425192026 1383535928 /nfs/dbraw/zinc/53/59/28/1383535928.db2.gz IKEDZBIJQIFKAO-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C)C1)C1C[NH+](CC2CCC(C)(C)CC2)C1 ZINC001425246776 1383562614 /nfs/dbraw/zinc/56/26/14/1383562614.db2.gz OGRJBEKLIRYECE-IRXDYDNUSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C1C[NH+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001425268320 1383582747 /nfs/dbraw/zinc/58/27/47/1383582747.db2.gz MNFGRQWGVLAJTA-VQIMIIECSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C1C[NH+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001425268311 1383582921 /nfs/dbraw/zinc/58/29/21/1383582921.db2.gz MNFGRQWGVLAJTA-LPHOPBHVSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)C[N@@H+]1C[C@H](NC(=O)[C@H](C(C)C)N2CCCCC2)C(C)(C)C1 ZINC001425307161 1383602150 /nfs/dbraw/zinc/60/21/50/1383602150.db2.gz XMVOSIOMLULOAB-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)C[N@H+]1C[C@H](NC(=O)[C@H](C(C)C)N2CCCCC2)C(C)(C)C1 ZINC001425307161 1383602154 /nfs/dbraw/zinc/60/21/54/1383602154.db2.gz XMVOSIOMLULOAB-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](CC3CC3)C[C@H]2C1)CC(C)(C)C ZINC001425378340 1383637719 /nfs/dbraw/zinc/63/77/19/1383637719.db2.gz FBZACDYSCWVFIN-KZNAEPCWSA-N 1 3 335.536 2.591 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](CC3CC3)C[C@H]2C1)CC(C)(C)C ZINC001425378340 1383637725 /nfs/dbraw/zinc/63/77/25/1383637725.db2.gz FBZACDYSCWVFIN-KZNAEPCWSA-N 1 3 335.536 2.591 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@@H](C)c3ccccc3C)C[C@H]21 ZINC001425383754 1383643306 /nfs/dbraw/zinc/64/33/06/1383643306.db2.gz SXAJENPISNLNSA-FRYIKTPZSA-N 1 3 343.515 2.692 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@@H](C)c3ccccc3C)C[C@H]21 ZINC001425383754 1383643311 /nfs/dbraw/zinc/64/33/11/1383643311.db2.gz SXAJENPISNLNSA-FRYIKTPZSA-N 1 3 343.515 2.692 10 0 EFAEHO C[C@@H]([NH2+]C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)C1)c1ccc(F)cc1 ZINC001425394763 1383646989 /nfs/dbraw/zinc/64/69/89/1383646989.db2.gz VNUAPDVSXZEDJF-IIDMSEBBSA-N 1 3 347.478 2.855 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001425415425 1383651821 /nfs/dbraw/zinc/65/18/21/1383651821.db2.gz PGADJEUYORHLPA-JFIYKMOQSA-N 1 3 347.503 2.581 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CCC(C)(C)C)CN1C(=O)CN(C)CC(C)(C)C ZINC001425903510 1383839848 /nfs/dbraw/zinc/83/98/48/1383839848.db2.gz MSUSGBHUPNJTBF-HZPDHXFCSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H]1[C@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc(C2CC2)cc1 ZINC001425921784 1383858224 /nfs/dbraw/zinc/85/82/24/1383858224.db2.gz DZDFAWDAPIDOFT-OXJNMPFZSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H](NC[C@@H](NC(=O)CC[NH+](C)C)C(C)(C)C)c1ccccc1F ZINC001426134482 1384017115 /nfs/dbraw/zinc/01/71/15/1384017115.db2.gz GEPFXJJVAZGCHW-RHSMWYFYSA-N 1 3 337.483 2.959 10 0 EFAEHO CC(C)CC[NH+]1CCC([C@H](C)NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001426186522 1384053424 /nfs/dbraw/zinc/05/34/24/1384053424.db2.gz CYDDRUADMKQWQP-FUHWJXTLSA-N 1 3 325.541 2.835 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCc1ccc(C[NH2+]CC2CC2)cc1F ZINC001426251228 1384094469 /nfs/dbraw/zinc/09/44/69/1384094469.db2.gz FIOIBJIVAFKVDH-GJZGRUSLSA-N 1 3 347.478 2.814 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(Cl)cc2)C1 ZINC001438947209 1388945191 /nfs/dbraw/zinc/94/51/91/1388945191.db2.gz HHKZZFQXPHVQAK-SJLPKXTDSA-N 1 3 349.906 2.715 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1CCC[C@@H]1NC(=O)CN(C)C(C)C ZINC001438961383 1388954213 /nfs/dbraw/zinc/95/42/13/1388954213.db2.gz LUOHXXIKXJNHES-UXHICEINSA-N 1 3 345.531 2.964 10 0 EFAEHO CCN(CCN[C@H](C)c1ccc(F)c(Cl)c1)C(=O)CC[NH+](C)C ZINC001439080605 1388984371 /nfs/dbraw/zinc/98/43/71/1388984371.db2.gz PVWNVTJEHYPHBN-CYBMUJFWSA-N 1 3 343.874 2.930 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CN([C@@H]2CCc3c2cccc3F)CC1(C)C ZINC001506746995 1406242689 /nfs/dbraw/zinc/24/26/89/1406242689.db2.gz CAWWDVUEQGAMMQ-QZTJIDSGSA-N 1 3 347.478 2.591 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CN([C@H]2CCc3c2cccc3F)CC1(C)C ZINC001506746997 1406242838 /nfs/dbraw/zinc/24/28/38/1406242838.db2.gz CAWWDVUEQGAMMQ-ROUUACIJSA-N 1 3 347.478 2.591 10 0 EFAEHO C[NH+](C)[C@H]1CCCC[C@@H]1NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC001433657584 1386944002 /nfs/dbraw/zinc/94/40/02/1386944002.db2.gz COVYZTYLPCUQJM-IRXDYDNUSA-N 1 3 328.460 2.893 10 0 EFAEHO CC(C)Oc1ccc([C@@H](CNC(=O)[C@@H](C)CC[NH+](C)C)N(C)C)cc1 ZINC001434040570 1387070073 /nfs/dbraw/zinc/07/00/73/1387070073.db2.gz MUVBUQILTCIVKO-QFBILLFUSA-N 1 3 349.519 2.781 10 0 EFAEHO C[C@H](CN1CCOCC1)CN1CC[C@H](C)[N@H+](Cc2ccccc2)CC1 ZINC001434460029 1387162448 /nfs/dbraw/zinc/16/24/48/1387162448.db2.gz YMGOUSNAFMHFBF-PMACEKPBSA-N 1 3 345.531 2.551 10 0 EFAEHO C[C@H](CN1CCOCC1)CN1CC[C@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC001434460029 1387162449 /nfs/dbraw/zinc/16/24/49/1387162449.db2.gz YMGOUSNAFMHFBF-PMACEKPBSA-N 1 3 345.531 2.551 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001439151886 1389017113 /nfs/dbraw/zinc/01/71/13/1389017113.db2.gz FPVNQWCFGSYOSN-UZLBHIALSA-N 1 3 349.494 2.802 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1c(C)cccc1C ZINC001439181582 1389035685 /nfs/dbraw/zinc/03/56/85/1389035685.db2.gz GCQAGHHSDQOAGQ-IEBWSBKVSA-N 1 3 331.504 2.772 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1cc(C)sc1C ZINC001439181937 1389036933 /nfs/dbraw/zinc/03/69/33/1389036933.db2.gz IXIAHMWWZIRAQR-DYVFJYSZSA-N 1 3 337.533 2.834 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CNCc1ccccc1F)[NH+]1CCCCC1 ZINC001439283636 1389094966 /nfs/dbraw/zinc/09/49/66/1389094966.db2.gz DVHXZKINZIRIDJ-LPHOPBHVSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC001439284502 1389096203 /nfs/dbraw/zinc/09/62/03/1389096203.db2.gz KMONKDVMHPYZQA-KSSFIOAISA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C)C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001439321736 1389139319 /nfs/dbraw/zinc/13/93/19/1389139319.db2.gz DFRRDFLLOYTDBX-AEFFLSMTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C)C[N@H+](C)CC1CC2(CCC2)C1 ZINC001439321736 1389139317 /nfs/dbraw/zinc/13/93/17/1389139317.db2.gz DFRRDFLLOYTDBX-AEFFLSMTSA-N 1 3 335.536 2.876 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@@H](C)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001439361948 1389187779 /nfs/dbraw/zinc/18/77/79/1389187779.db2.gz ANAFHPPLXWSBFU-IKGGRYGDSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@@H](C)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001439361948 1389187783 /nfs/dbraw/zinc/18/77/83/1389187783.db2.gz ANAFHPPLXWSBFU-IKGGRYGDSA-N 1 3 349.494 2.801 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1csc(C)c1)C2 ZINC001440106662 1389388820 /nfs/dbraw/zinc/38/88/20/1389388820.db2.gz FKUVLZDOUAPGQZ-JQHSSLGASA-N 1 3 349.544 2.867 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1csc(C)c1)C2 ZINC001440106662 1389388826 /nfs/dbraw/zinc/38/88/26/1389388826.db2.gz FKUVLZDOUAPGQZ-JQHSSLGASA-N 1 3 349.544 2.867 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001506866212 1406374979 /nfs/dbraw/zinc/37/49/79/1406374979.db2.gz RUHHRWWETDVGBS-SHCNBLLESA-N 1 3 333.520 2.609 10 0 EFAEHO CC/C=C/CC[N@H+]1CCCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001506866212 1406374986 /nfs/dbraw/zinc/37/49/86/1406374986.db2.gz RUHHRWWETDVGBS-SHCNBLLESA-N 1 3 333.520 2.609 10 0 EFAEHO CC(C)C[NH2+][C@H](C)c1ccc(CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001440225897 1389456477 /nfs/dbraw/zinc/45/64/77/1389456477.db2.gz SUXGSVLFBMZVLV-IAGOWNOFSA-N 1 3 331.504 2.951 10 0 EFAEHO CN(CC(=O)N1CC2(C1)CC[NH+](CC1CCC1)CC2)CC(C)(C)C ZINC001440230669 1389460750 /nfs/dbraw/zinc/46/07/50/1389460750.db2.gz OUQRUXWPVCRQOI-UHFFFAOYSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@@H](C(=O)N(C)C[C@@H]1CC[N@@H+]1CC1CCCC1)N1CCCCCC1 ZINC001440232477 1389461680 /nfs/dbraw/zinc/46/16/80/1389461680.db2.gz AYONQZDBVPMSOO-HKUYNNGSSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@@H](C(=O)N(C)C[C@@H]1CC[N@H+]1CC1CCCC1)N1CCCCCC1 ZINC001440232477 1389461682 /nfs/dbraw/zinc/46/16/82/1389461682.db2.gz AYONQZDBVPMSOO-HKUYNNGSSA-N 1 3 335.536 2.974 10 0 EFAEHO CN(C[C@@H]1CCN1CCC1CC1)C(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001440240035 1389466689 /nfs/dbraw/zinc/46/66/89/1389466689.db2.gz HSTPUGUGDNVCBW-QFBILLFUSA-N 1 3 339.499 2.532 10 0 EFAEHO CN(C[C@@H]1CCN1CCC1CC1)C(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001440240035 1389466695 /nfs/dbraw/zinc/46/66/95/1389466695.db2.gz HSTPUGUGDNVCBW-QFBILLFUSA-N 1 3 339.499 2.532 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@@H]([NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001440307567 1389520042 /nfs/dbraw/zinc/52/00/42/1389520042.db2.gz RABVHJKBRXYRHH-BPQIPLTHSA-N 1 3 335.536 2.637 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1C[C@H]([NH2+]CC2CCCC2)C1)N1CCCCCC1 ZINC001440355507 1389559643 /nfs/dbraw/zinc/55/96/43/1389559643.db2.gz DDZRQIGHDDERHN-BHIYHBOVSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]Cc2cccc(F)c2)C1 ZINC001440362659 1389567330 /nfs/dbraw/zinc/56/73/30/1389567330.db2.gz MVTSXDUDQKBEFK-FXRXJOCMSA-N 1 3 347.478 2.683 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001440405930 1389605214 /nfs/dbraw/zinc/60/52/14/1389605214.db2.gz JDXDDRRKZHMDCB-QFBILLFUSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H]1CC[C@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001440406854 1389606697 /nfs/dbraw/zinc/60/66/97/1389606697.db2.gz UVVCVHFJVBMHOB-PKOBYXMFSA-N 1 3 343.515 2.854 10 0 EFAEHO C[C@H](F)CC[NH2+][C@H]1CCCCCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001440460669 1389660816 /nfs/dbraw/zinc/66/08/16/1389660816.db2.gz KJHRKSZPTLPALY-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001440463365 1389664379 /nfs/dbraw/zinc/66/43/79/1389664379.db2.gz FVKWBBJIEQMJOB-CRAIPNDOSA-N 1 3 347.494 2.727 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001440463365 1389664381 /nfs/dbraw/zinc/66/43/81/1389664381.db2.gz FVKWBBJIEQMJOB-CRAIPNDOSA-N 1 3 347.494 2.727 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[N@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001440463459 1389664890 /nfs/dbraw/zinc/66/48/90/1389664890.db2.gz HEQKCMLBNVVCHV-HZPDHXFCSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[N@@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001440463459 1389664893 /nfs/dbraw/zinc/66/48/93/1389664893.db2.gz HEQKCMLBNVVCHV-HZPDHXFCSA-N 1 3 345.478 2.544 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CC3CC4(CCC4)C3)CC[C@@H]2C1 ZINC001440472895 1389677873 /nfs/dbraw/zinc/67/78/73/1389677873.db2.gz OTFZFMULOHTANC-MOPGFXCFSA-N 1 3 347.547 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CC3CC4(CCC4)C3)CC[C@@H]2C1 ZINC001440472895 1389677877 /nfs/dbraw/zinc/67/78/77/1389677877.db2.gz OTFZFMULOHTANC-MOPGFXCFSA-N 1 3 347.547 2.687 10 0 EFAEHO Cc1ccc(CN2CC[C@H](NC(=O)CCC[NH+]3CCCC3)[C@H]2C)cc1 ZINC001440501559 1389704372 /nfs/dbraw/zinc/70/43/72/1389704372.db2.gz CKYHROQVSOUGCY-QUCCMNQESA-N 1 3 343.515 2.950 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C)[NH+]1CCCC1 ZINC001440505862 1389707899 /nfs/dbraw/zinc/70/78/99/1389707899.db2.gz BZZFKMYPIISJSZ-HOJAQTOUSA-N 1 3 343.515 2.886 10 0 EFAEHO CCC1([NH2+]CC2CC(C)C2)CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001440535047 1389737729 /nfs/dbraw/zinc/73/77/29/1389737729.db2.gz XOCFOLBIDSYEIG-WWDZGPRUSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@H+](CCCF)CC(C)(C)C1)N(C)C ZINC001440536516 1389738468 /nfs/dbraw/zinc/73/84/68/1389738468.db2.gz PKJGFRVFFQPGDK-CVEARBPZSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@@H+](CCCF)CC(C)(C)C1)N(C)C ZINC001440536516 1389738474 /nfs/dbraw/zinc/73/84/74/1389738474.db2.gz PKJGFRVFFQPGDK-CVEARBPZSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CCCF)CC(C)(C)C1)N(C)C ZINC001440536518 1389738493 /nfs/dbraw/zinc/73/84/93/1389738493.db2.gz PKJGFRVFFQPGDK-HOTGVXAUSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CCCF)CC(C)(C)C1)N(C)C ZINC001440536518 1389738497 /nfs/dbraw/zinc/73/84/97/1389738497.db2.gz PKJGFRVFFQPGDK-HOTGVXAUSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CCc2cccs2)[C@H](C)C1 ZINC001440652956 1389800586 /nfs/dbraw/zinc/80/05/86/1389800586.db2.gz OINQYGRKNRGQCD-CVEARBPZSA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CCc2cccs2)[C@H](C)C1 ZINC001440652956 1389800593 /nfs/dbraw/zinc/80/05/93/1389800593.db2.gz OINQYGRKNRGQCD-CVEARBPZSA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CCCc2ccccc2)[C@@H](C)C1 ZINC001440654177 1389801720 /nfs/dbraw/zinc/80/17/20/1389801720.db2.gz UQLJNWGJNBDZSV-AZUAARDMSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CCCc2ccccc2)[C@@H](C)C1 ZINC001440654177 1389801725 /nfs/dbraw/zinc/80/17/25/1389801725.db2.gz UQLJNWGJNBDZSV-AZUAARDMSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N1CCc2ccccc2[C@H]1CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001440688926 1389818452 /nfs/dbraw/zinc/81/84/52/1389818452.db2.gz LBUYRWWGOWPGHL-UYAOXDASSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N1CCc2ccccc2[C@H]1CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001440688926 1389818457 /nfs/dbraw/zinc/81/84/57/1389818457.db2.gz LBUYRWWGOWPGHL-UYAOXDASSA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@@H](F)C[N@H+](CC)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001440706776 1389829727 /nfs/dbraw/zinc/82/97/27/1389829727.db2.gz NOILPBDBXJKDAR-FUHWJXTLSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](F)C[N@@H+](CC)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001440706776 1389829729 /nfs/dbraw/zinc/82/97/29/1389829729.db2.gz NOILPBDBXJKDAR-FUHWJXTLSA-N 1 3 341.515 2.637 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001440746102 1389867028 /nfs/dbraw/zinc/86/70/28/1389867028.db2.gz IRTBTIKMLAAZBH-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1ccccc1C[N@H+](C)C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001440746102 1389867033 /nfs/dbraw/zinc/86/70/33/1389867033.db2.gz IRTBTIKMLAAZBH-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCCC1)[C@H](C)[NH2+]CCC(F)(F)F ZINC001440794651 1389902809 /nfs/dbraw/zinc/90/28/09/1389902809.db2.gz UHZGGFNPEWVBRS-STQMWFEESA-N 1 3 337.430 2.686 10 0 EFAEHO C[C@@H](NCc1ccccc1Cl)[C@@H](C)NC(=O)C1CC[NH+](C)CC1 ZINC001440834564 1389935050 /nfs/dbraw/zinc/93/50/50/1389935050.db2.gz LMOPLBKNSMMTRD-ZIAGYGMSSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccsc1)[C@H](C)NC(=O)CN(C)CC(C)(C)C ZINC001440845268 1389944390 /nfs/dbraw/zinc/94/43/90/1389944390.db2.gz XLLBQNSULSMMMT-KGLIPLIRSA-N 1 3 325.522 2.709 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1cccc2cccnc21 ZINC001440846650 1389947234 /nfs/dbraw/zinc/94/72/34/1389947234.db2.gz GOQZWKXBJINQEA-JKSUJKDBSA-N 1 3 342.487 2.559 10 0 EFAEHO C[C@@H](NC(=O)CC[NH+]1CCCCC1)[C@H](C)NCC=C(Cl)Cl ZINC001440850487 1389951209 /nfs/dbraw/zinc/95/12/09/1389951209.db2.gz COCJMHLNIDLXQY-QWHCGFSZSA-N 1 3 336.307 2.664 10 0 EFAEHO CCc1cccc(CN(C)[C@H](C)CNC(=O)[C@H]2C[NH+]3CCC2CC3)c1 ZINC001440926092 1390014543 /nfs/dbraw/zinc/01/45/43/1390014543.db2.gz QDYBKHGHLHGGQC-UZLBHIALSA-N 1 3 343.515 2.527 10 0 EFAEHO C[C@H](CNC(=O)CC[NH+](C)C)N(C)Cc1cccc(C(F)F)c1 ZINC001440962218 1390052913 /nfs/dbraw/zinc/05/29/13/1390052913.db2.gz IUZDQSZXDVRMCY-CYBMUJFWSA-N 1 3 327.419 2.512 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H](C)[N@H+](C)CC1CC(F)(F)C1 ZINC001440973027 1390065087 /nfs/dbraw/zinc/06/50/87/1390065087.db2.gz HHNPNIULFYFODB-HOCLYGCPSA-N 1 3 345.478 2.731 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H](C)[N@@H+](C)CC1CC(F)(F)C1 ZINC001440973027 1390065090 /nfs/dbraw/zinc/06/50/90/1390065090.db2.gz HHNPNIULFYFODB-HOCLYGCPSA-N 1 3 345.478 2.731 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]C[C@H]2CCCC(F)(F)C2)C1 ZINC001506903856 1406421990 /nfs/dbraw/zinc/42/19/90/1406421990.db2.gz ROOULDAMFWNELX-JYJNAYRXSA-N 1 3 345.478 2.638 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C)CCC[NH2+]CC1CC(F)(F)C1 ZINC001506921138 1406444736 /nfs/dbraw/zinc/44/47/36/1406444736.db2.gz FBTVGCVMSWPHSQ-GDBMZVCRSA-N 1 3 345.478 2.779 10 0 EFAEHO C[C@H](CCC[NH2+]C/C=C\Cl)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001506938397 1406469057 /nfs/dbraw/zinc/46/90/57/1406469057.db2.gz QNFOWAOOMSUVSC-RBJPWVEASA-N 1 3 347.906 2.826 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@@H]2CCCCCN2CCC(F)(F)F)C1 ZINC001441143621 1391140189 /nfs/dbraw/zinc/14/01/89/1391140189.db2.gz ZLTSFYDICSEMGB-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@@H]2CCCCCN2CCC(F)(F)F)C1 ZINC001441143621 1391140190 /nfs/dbraw/zinc/14/01/90/1391140190.db2.gz ZLTSFYDICSEMGB-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO Cc1ccc(C[NH+]2CC([C@@H](C)NC(=O)CN3CC[C@H](C)C3)C2)c(C)c1 ZINC001441189388 1391169467 /nfs/dbraw/zinc/16/94/67/1391169467.db2.gz ZVRWXRHXDCLERM-FUHWJXTLSA-N 1 3 343.515 2.582 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CC1CC(C)(C)C1)C1CC1 ZINC001441201209 1391177601 /nfs/dbraw/zinc/17/76/01/1391177601.db2.gz LTBQJOBRJFIEQN-QZTJIDSGSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+][C@H]1CCCc2ccccc21)C1CC1 ZINC001441291879 1391236227 /nfs/dbraw/zinc/23/62/27/1391236227.db2.gz FLTOICINNIFYPS-PMACEKPBSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCC[NH+]1CCCCC1 ZINC001441327077 1391251509 /nfs/dbraw/zinc/25/15/09/1391251509.db2.gz SVNBEOITHAUJNS-KDURUIRLSA-N 1 3 335.536 2.974 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+]C[C@H]2CCCC(F)(F)C2)C1 ZINC001441363667 1391267332 /nfs/dbraw/zinc/26/73/32/1391267332.db2.gz FQGZIVFLWBRSOY-JYJNAYRXSA-N 1 3 345.478 2.637 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@H]1C[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001441366501 1391267992 /nfs/dbraw/zinc/26/79/92/1391267992.db2.gz RCPIMMBEAGBAAJ-NNFUDEMPSA-N 1 3 341.515 2.729 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@H]1C[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001441366499 1391268307 /nfs/dbraw/zinc/26/83/07/1391268307.db2.gz RCPIMMBEAGBAAJ-IUVQAAGXSA-N 1 3 341.515 2.729 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H]([NH2+]Cc2cc3ccccc3s2)C1)N(C)C ZINC001441396703 1391281999 /nfs/dbraw/zinc/28/19/99/1391281999.db2.gz GDIHNXSWCRQXHE-BFYDXBDKSA-N 1 3 345.512 2.978 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2cc3ccccc3s2)C1 ZINC001441420606 1391294650 /nfs/dbraw/zinc/29/46/50/1391294650.db2.gz SWKMMHFUAASKNT-WKILWMFISA-N 1 3 345.512 2.980 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2cc(F)ccc2F)C1 ZINC001441522890 1391351206 /nfs/dbraw/zinc/35/12/06/1391351206.db2.gz SQDQVNYUESNHAW-YUELXQCFSA-N 1 3 339.430 2.604 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@H+](Cc2ccc(CF)cc2)C1 ZINC001441577211 1391370468 /nfs/dbraw/zinc/37/04/68/1391370468.db2.gz VIRVMRGDCNDUGK-LJQANCHMSA-N 1 3 349.494 2.825 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC001441577211 1391370474 /nfs/dbraw/zinc/37/04/74/1391370474.db2.gz VIRVMRGDCNDUGK-LJQANCHMSA-N 1 3 349.494 2.825 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(C3CC3)cc2)[C@H]1C ZINC001441825391 1391420839 /nfs/dbraw/zinc/42/08/39/1391420839.db2.gz NZPBYFWVAPEYIG-UZLBHIALSA-N 1 3 343.515 2.985 10 0 EFAEHO Cc1ncccc1CN[C@H](C)CNC(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001441875376 1391427629 /nfs/dbraw/zinc/42/76/29/1391427629.db2.gz NJPWGPVKYBSZDQ-OAHLLOKOSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1ncccc1CN[C@H](C)CNC(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001441875376 1391427633 /nfs/dbraw/zinc/42/76/33/1391427633.db2.gz NJPWGPVKYBSZDQ-OAHLLOKOSA-N 1 3 346.519 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc(C)c(C)c2)C(C)(C)C1 ZINC001441929451 1391440846 /nfs/dbraw/zinc/44/08/46/1391440846.db2.gz HDVMPJOBCKVXJT-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@@H](F)C[NH+]1CCC(CCNC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001444218020 1391462933 /nfs/dbraw/zinc/46/29/33/1391462933.db2.gz DHTNPNODPBYBIX-IAGOWNOFSA-N 1 3 329.504 2.539 10 0 EFAEHO CC[C@H](F)C[NH+]1CCC(CCNC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001444218016 1391462814 /nfs/dbraw/zinc/46/28/14/1391462814.db2.gz DHTNPNODPBYBIX-DLBZAZTESA-N 1 3 329.504 2.539 10 0 EFAEHO C[C@H](C[NH2+][C@@H]1CCc2ccccc21)N(C)C(=O)C1(N(C)C)CCC1 ZINC001444619606 1391508695 /nfs/dbraw/zinc/50/86/95/1391508695.db2.gz BDZLUFQTHVOTIE-CRAIPNDOSA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](NC(=O)C(C)(C)N2CCCC2)C2CC2)cc1 ZINC001445963684 1391545369 /nfs/dbraw/zinc/54/53/69/1391545369.db2.gz VZHMGVPGRNWWSN-LJQANCHMSA-N 1 3 343.515 2.854 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2ccsc2)CC1 ZINC001446501718 1391556216 /nfs/dbraw/zinc/55/62/16/1391556216.db2.gz IWUXACHQHDEXQM-SJORKVTESA-N 1 3 347.528 2.655 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@]2(C)CCN(C(=O)CN3CC[C@@H](C)C3)C2)cs1 ZINC001446620854 1391561939 /nfs/dbraw/zinc/56/19/39/1391561939.db2.gz XSDWPCKCFGWVNL-DNVCBOLYSA-N 1 3 349.544 2.727 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H](C2CCN(C/C=C/Cl)CC2)C1 ZINC001446920079 1391636318 /nfs/dbraw/zinc/63/63/18/1391636318.db2.gz BRQHFHNIZXQKMX-MDGVGCGJSA-N 1 3 341.927 2.641 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001446938198 1391640403 /nfs/dbraw/zinc/64/04/03/1391640403.db2.gz FHKMGGMKBUAXAA-YLJYHZDGSA-N 1 3 345.531 2.916 10 0 EFAEHO CC(C)C[NH2+]C[C@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@@H]1C ZINC001446943232 1391642428 /nfs/dbraw/zinc/64/24/28/1391642428.db2.gz REINCSLNWYMTOK-LPHOPBHVSA-N 1 3 331.504 2.702 10 0 EFAEHO CCC(CC)C[NH2+]C[C@H]1CN(C(=O)CN2CCC(C)CC2)C[C@H]1C ZINC001446973138 1391649418 /nfs/dbraw/zinc/64/94/18/1391649418.db2.gz NQTCLABRWIHQPP-MJGOQNOKSA-N 1 3 337.552 2.839 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CCc2ccccc2)CC1(C)C ZINC001447606818 1391718492 /nfs/dbraw/zinc/71/84/92/1391718492.db2.gz XLNCVTGOLNUEAX-IBGZPJMESA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CCc2ccccc2)CC1(C)C ZINC001447606818 1391718501 /nfs/dbraw/zinc/71/85/01/1391718501.db2.gz XLNCVTGOLNUEAX-IBGZPJMESA-N 1 3 345.531 2.786 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[N@H+](C)CCCc1ccccc1)N(C)C ZINC001447780206 1391765750 /nfs/dbraw/zinc/76/57/50/1391765750.db2.gz KDJVSUGFRAAEAU-WOJBJXKFSA-N 1 3 345.531 2.882 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[N@@H+](C)CCCc1ccccc1)N(C)C ZINC001447780206 1391765755 /nfs/dbraw/zinc/76/57/55/1391765755.db2.gz KDJVSUGFRAAEAU-WOJBJXKFSA-N 1 3 345.531 2.882 10 0 EFAEHO COc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)cc1 ZINC001447894285 1391793990 /nfs/dbraw/zinc/79/39/90/1391793990.db2.gz XLQRXEWXJMSYDX-JKSUJKDBSA-N 1 3 347.503 2.552 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)N(C)Cc1ccc(Cl)cc1 ZINC001448015595 1391897735 /nfs/dbraw/zinc/89/77/35/1391897735.db2.gz MQFZCQLEYYSIIJ-CKEIUWERSA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)N(C)Cc1ccc(Cl)cc1 ZINC001448015595 1391897739 /nfs/dbraw/zinc/89/77/39/1391897739.db2.gz MQFZCQLEYYSIIJ-CKEIUWERSA-N 1 3 337.895 2.617 10 0 EFAEHO CCc1ccccc1CN(C)[C@H](C)CNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC ZINC001448014987 1391898048 /nfs/dbraw/zinc/89/80/48/1391898048.db2.gz KWRIHALBGSZBQP-LSTHTHJFSA-N 1 3 345.531 2.916 10 0 EFAEHO CCc1ccccc1CN(C)[C@H](C)CNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC ZINC001448014987 1391898051 /nfs/dbraw/zinc/89/80/51/1391898051.db2.gz KWRIHALBGSZBQP-LSTHTHJFSA-N 1 3 345.531 2.916 10 0 EFAEHO Cc1ccc(CN(C)[C@H](C)CNC(=O)[C@@H]2CCC[N@H+]2C(C)C)cc1F ZINC001448035501 1391905976 /nfs/dbraw/zinc/90/59/76/1391905976.db2.gz LSVUUGNYWPLMSW-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(CN(C)[C@H](C)CNC(=O)[C@@H]2CCC[N@@H+]2C(C)C)cc1F ZINC001448035501 1391905977 /nfs/dbraw/zinc/90/59/77/1391905977.db2.gz LSVUUGNYWPLMSW-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO CCc1cccc(CN(C)[C@H](C)CNC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)c1 ZINC001448036049 1391907174 /nfs/dbraw/zinc/90/71/74/1391907174.db2.gz KFCUFQKBCPFNLW-GPMSIDNRSA-N 1 3 331.504 2.526 10 0 EFAEHO CCc1cccc(CN(C)[C@H](C)CNC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)c1 ZINC001448036049 1391907177 /nfs/dbraw/zinc/90/71/77/1391907177.db2.gz KFCUFQKBCPFNLW-GPMSIDNRSA-N 1 3 331.504 2.526 10 0 EFAEHO COc1cccc(CN(C)[C@@H](C)CNC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001448036982 1391907913 /nfs/dbraw/zinc/90/79/13/1391907913.db2.gz HWVPPJLXRGKVQF-WMZOPIPTSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1cccc(CN(C)[C@@H](C)CNC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001448036982 1391907915 /nfs/dbraw/zinc/90/79/15/1391907915.db2.gz HWVPPJLXRGKVQF-WMZOPIPTSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[N@H+](C)CCCc1cccc(F)c1 ZINC001448100016 1391958624 /nfs/dbraw/zinc/95/86/24/1391958624.db2.gz SMOFVPIYJHMPHC-IAGOWNOFSA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[N@@H+](C)CCCc1cccc(F)c1 ZINC001448100016 1391958629 /nfs/dbraw/zinc/95/86/29/1391958629.db2.gz SMOFVPIYJHMPHC-IAGOWNOFSA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)N(C)Cc1ccc(C(C)(C)C)cc1 ZINC001448141654 1391984411 /nfs/dbraw/zinc/98/44/11/1391984411.db2.gz ASMCNRLAABMMFC-AEFFLSMTSA-N 1 3 345.531 2.872 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(C(C)(C)C)cc1 ZINC001448141654 1391984414 /nfs/dbraw/zinc/98/44/14/1391984414.db2.gz ASMCNRLAABMMFC-AEFFLSMTSA-N 1 3 345.531 2.872 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)Cc1ccc(C(F)F)cc1 ZINC001448141745 1391984704 /nfs/dbraw/zinc/98/47/04/1391984704.db2.gz GWNWNLXOQXGGKO-CQSZACIVSA-N 1 3 341.446 2.901 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC001448141745 1391984711 /nfs/dbraw/zinc/98/47/11/1391984711.db2.gz GWNWNLXOQXGGKO-CQSZACIVSA-N 1 3 341.446 2.901 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)N(C)Cc1ccc(C(C)(C)C)cc1 ZINC001448141658 1391984767 /nfs/dbraw/zinc/98/47/67/1391984767.db2.gz ASMCNRLAABMMFC-SJLPKXTDSA-N 1 3 345.531 2.872 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(C(C)(C)C)cc1 ZINC001448141658 1391984776 /nfs/dbraw/zinc/98/47/76/1391984776.db2.gz ASMCNRLAABMMFC-SJLPKXTDSA-N 1 3 345.531 2.872 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]Cc1ccc(F)cc1 ZINC001448210238 1392016475 /nfs/dbraw/zinc/01/64/75/1392016475.db2.gz IJZUOYFUSPWGHQ-MOPGFXCFSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]Cc1ccccc1 ZINC001448213518 1392018307 /nfs/dbraw/zinc/01/83/07/1392018307.db2.gz PMSDTNDWDDUFEE-OALUTQOASA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]Cc1ccccc1 ZINC001448213510 1392018382 /nfs/dbraw/zinc/01/83/82/1392018382.db2.gz PMSDTNDWDDUFEE-MOPGFXCFSA-N 1 3 331.504 2.744 10 0 EFAEHO CC[NH2+]CC1(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CCCCC1 ZINC001448222083 1392029299 /nfs/dbraw/zinc/02/92/99/1392029299.db2.gz CMOAGVFDDCXDOG-GOSISDBHSA-N 1 3 327.488 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]Cc2ccc(F)cc2)C1 ZINC001449057868 1392241596 /nfs/dbraw/zinc/24/15/96/1392241596.db2.gz IKRCYAXANIKFSY-WMZOPIPTSA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@H](F)C[NH2+][C@H]1CN(C(=O)C(C)(C)N2CCCCC2)CC1(C)C ZINC001449065632 1392247628 /nfs/dbraw/zinc/24/76/28/1392247628.db2.gz XQVSIDPYBCLODZ-HOTGVXAUSA-N 1 3 341.515 2.826 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001449068474 1392249509 /nfs/dbraw/zinc/24/95/09/1392249509.db2.gz WFGQIYTXQFYHFD-RTBURBONSA-N 1 3 331.504 2.710 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001449068469 1392249731 /nfs/dbraw/zinc/24/97/31/1392249731.db2.gz WFGQIYTXQFYHFD-MOPGFXCFSA-N 1 3 331.504 2.710 10 0 EFAEHO CN(CC(=O)N(C)[C@H](C[NH2+]CC1=CCCCC1)C1CC1)C1CCC1 ZINC001507013783 1406589709 /nfs/dbraw/zinc/58/97/09/1406589709.db2.gz ZHIDONWIBTZGOC-LJQANCHMSA-N 1 3 333.520 2.798 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@H](C1CC1)N(C)C(=O)CN(C)C(C)C ZINC001507035817 1406624229 /nfs/dbraw/zinc/62/42/29/1406624229.db2.gz LWMNVLWRKSPIRQ-LJQANCHMSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@H](CN(C)C(=O)C(C)(C)[NH+]1CCCC1)NCc1ccccc1F ZINC001507106649 1406711512 /nfs/dbraw/zinc/71/15/12/1406711512.db2.gz MMZNKKNNKLUDHG-OAHLLOKOSA-N 1 3 335.467 2.637 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)CN(C)C(=O)CC[NH+](C)C ZINC001507117023 1406724127 /nfs/dbraw/zinc/72/41/27/1406724127.db2.gz FHZFQQAJAHWYNS-CQSZACIVSA-N 1 3 325.884 2.537 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)[C@H](NC(C)C)c1ccc(OC)cc1 ZINC001457952513 1395390765 /nfs/dbraw/zinc/39/07/65/1395390765.db2.gz OPASHRVWFYYEBE-GOSISDBHSA-N 1 3 349.519 2.971 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)[C@H](NC(C)C)c1ccc(OC)cc1 ZINC001457952513 1395390770 /nfs/dbraw/zinc/39/07/70/1395390770.db2.gz OPASHRVWFYYEBE-GOSISDBHSA-N 1 3 349.519 2.971 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]CCCc1ccccc1 ZINC001507161014 1406790744 /nfs/dbraw/zinc/79/07/44/1406790744.db2.gz HOWXXGAYJWZSGI-ICSRJNTNSA-N 1 3 345.531 2.930 10 0 EFAEHO C[C@H]1CCC[N@H+](CCNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC001464145304 1396550971 /nfs/dbraw/zinc/55/09/71/1396550971.db2.gz HVHNSIOPIKHWIH-HNNXBMFYSA-N 1 3 328.460 2.753 10 0 EFAEHO C[C@H]1CCC[N@@H+](CCNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC001464145304 1396550974 /nfs/dbraw/zinc/55/09/74/1396550974.db2.gz HVHNSIOPIKHWIH-HNNXBMFYSA-N 1 3 328.460 2.753 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)N(CCN(C)C)C3CCCCC3)C[N@@H+]2C1 ZINC001464843011 1396617376 /nfs/dbraw/zinc/61/73/76/1396617376.db2.gz ZYHXKQOXUWPRLJ-LMMKCTJWSA-N 1 3 335.536 2.830 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)N(CCN(C)C)C3CCCCC3)C[N@H+]2C1 ZINC001464843011 1396617387 /nfs/dbraw/zinc/61/73/87/1396617387.db2.gz ZYHXKQOXUWPRLJ-LMMKCTJWSA-N 1 3 335.536 2.830 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@H](C(=O)N(CCN(C)C)C3CCCCC3)C[N@@H+]2C1 ZINC001464843015 1396617586 /nfs/dbraw/zinc/61/75/86/1396617586.db2.gz ZYHXKQOXUWPRLJ-ZIFCJYIRSA-N 1 3 335.536 2.830 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@H](C(=O)N(CCN(C)C)C3CCCCC3)C[N@H+]2C1 ZINC001464843015 1396617593 /nfs/dbraw/zinc/61/75/93/1396617593.db2.gz ZYHXKQOXUWPRLJ-ZIFCJYIRSA-N 1 3 335.536 2.830 10 0 EFAEHO COc1ccc([C@@H](CN(C)C)NC(=O)[C@@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC001467936224 1396911097 /nfs/dbraw/zinc/91/10/97/1396911097.db2.gz KVKKNUIHFIZNGE-IEBWSBKVSA-N 1 3 347.503 2.535 10 0 EFAEHO COc1ccc([C@@H](CN(C)C)NC(=O)[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC001467936224 1396911100 /nfs/dbraw/zinc/91/11/00/1396911100.db2.gz KVKKNUIHFIZNGE-IEBWSBKVSA-N 1 3 347.503 2.535 10 0 EFAEHO C[C@@H]1[C@H](NCc2cc(Cl)ccc2F)CCN1C(=O)CC[NH+](C)C ZINC001507289231 1406854531 /nfs/dbraw/zinc/85/45/31/1406854531.db2.gz IZKLHLVXBUZYJE-MLGOLLRUSA-N 1 3 341.858 2.510 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21 ZINC001470025133 1397068004 /nfs/dbraw/zinc/06/80/04/1397068004.db2.gz CCFXLXCYJHKUIB-WJFTUGDTSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21 ZINC001470025133 1397068008 /nfs/dbraw/zinc/06/80/08/1397068008.db2.gz CCFXLXCYJHKUIB-WJFTUGDTSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H]1CCCC[C@H]1CNC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001470351176 1397087469 /nfs/dbraw/zinc/08/74/69/1397087469.db2.gz DUQKFWZFKWHTBN-KSZLIROESA-N 1 3 340.556 2.774 10 0 EFAEHO CC[C@@H]1CCCC[C@H]1CNC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001470351176 1397087478 /nfs/dbraw/zinc/08/74/78/1397087478.db2.gz DUQKFWZFKWHTBN-KSZLIROESA-N 1 3 340.556 2.774 10 0 EFAEHO CC[NH+](CC)CC[C@H](NC(=O)N[C@@H]1CCN(C)[C@H]1C)c1ccccc1 ZINC001471398148 1397167916 /nfs/dbraw/zinc/16/79/16/1397167916.db2.gz MXXQHJKIHIHYNW-UHOSZYNNSA-N 1 3 346.519 2.851 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@@H]2C[C@@H](C)N(C(=O)CN3CCCC3)C2)c1 ZINC001507329922 1406894402 /nfs/dbraw/zinc/89/44/02/1406894402.db2.gz CZXGXJYDMPLCSW-UYAOXDASSA-N 1 3 343.515 2.602 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2C[C@H](C)N(C(=O)CN3CCCC3)C2)c1 ZINC001507329920 1406894815 /nfs/dbraw/zinc/89/48/15/1406894815.db2.gz CZXGXJYDMPLCSW-ICSRJNTNSA-N 1 3 343.515 2.602 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N[C@@H](C)[C@]12C[C@H]1CCCC2 ZINC001478956782 1397595942 /nfs/dbraw/zinc/59/59/42/1397595942.db2.gz HKJMNLANZKADOF-BMFAXAFESA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N[C@@H](C)[C@]12C[C@H]1CCCC2 ZINC001478956782 1397595946 /nfs/dbraw/zinc/59/59/46/1397595946.db2.gz HKJMNLANZKADOF-BMFAXAFESA-N 1 3 338.540 2.526 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@H]2CN(C)C(=O)C[C@H]2CC[N@H+](C)C2)c1 ZINC001479260178 1397650835 /nfs/dbraw/zinc/65/08/35/1397650835.db2.gz HMYOJCVYKSZMGI-QUCCMNQESA-N 1 3 343.515 2.678 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@H]2CN(C)C(=O)C[C@H]2CC[N@@H+](C)C2)c1 ZINC001479260178 1397650837 /nfs/dbraw/zinc/65/08/37/1397650837.db2.gz HMYOJCVYKSZMGI-QUCCMNQESA-N 1 3 343.515 2.678 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccccc2Cl)C1 ZINC001479346910 1397698352 /nfs/dbraw/zinc/69/83/52/1397698352.db2.gz JGQUAJAKMWFZCS-FZNQNYSPSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+]CC[C@@H]2CCCC2(F)F)C1 ZINC001479417085 1397720522 /nfs/dbraw/zinc/72/05/22/1397720522.db2.gz QPYOTXRFAOJECF-JYJNAYRXSA-N 1 3 345.478 2.637 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@@H]1CC[C@H](CNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001479453320 1397728834 /nfs/dbraw/zinc/72/88/34/1397728834.db2.gz WSTLFPJJLMEETH-GVDBMIGSSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)C[NH2+][C@@H]1CC[C@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001479475155 1397733084 /nfs/dbraw/zinc/73/30/84/1397733084.db2.gz GIPYIANPQBCXJD-FCEWJHQRSA-N 1 3 341.515 2.729 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]CC3CCCCC3)C2)C1 ZINC001479475776 1397733171 /nfs/dbraw/zinc/73/31/71/1397733171.db2.gz NAYPCCYUBWBHNP-NZSAHSFTSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001479495041 1397737255 /nfs/dbraw/zinc/73/72/55/1397737255.db2.gz MUZHGIGQBVZGGF-FUHWJXTLSA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@@H](F)CN1CCC2(C[C@@H](C)N(C(=O)CC[N@H+](C)CC)C2)CC1 ZINC001479500410 1397738461 /nfs/dbraw/zinc/73/84/61/1397738461.db2.gz FDWVCQFFGSGEBK-IAGOWNOFSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](F)CN1CCC2(C[C@@H](C)N(C(=O)CC[N@@H+](C)CC)C2)CC1 ZINC001479500410 1397738462 /nfs/dbraw/zinc/73/84/62/1397738462.db2.gz FDWVCQFFGSGEBK-IAGOWNOFSA-N 1 3 341.515 2.779 10 0 EFAEHO CCCN(C)CC(=O)N1CCCCC[C@H]([NH2+]Cc2ccccc2)C1 ZINC001479695580 1397767018 /nfs/dbraw/zinc/76/70/18/1397767018.db2.gz YFDOMEVOPBURSP-IBGZPJMESA-N 1 3 331.504 2.889 10 0 EFAEHO Cc1cccc([C@H](C)[N@H+](C)CCCNC(=O)CN(C)C2CCC2)c1 ZINC001479775424 1397842552 /nfs/dbraw/zinc/84/25/52/1397842552.db2.gz AASQMUKQAYMFKB-KRWDZBQOSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1cccc([C@H](C)[N@@H+](C)CCCNC(=O)CN(C)C2CCC2)c1 ZINC001479775424 1397842555 /nfs/dbraw/zinc/84/25/55/1397842555.db2.gz AASQMUKQAYMFKB-KRWDZBQOSA-N 1 3 331.504 2.978 10 0 EFAEHO CN(CC(=O)NCCC[N@H+](C)Cc1ccc(Cl)cc1)C1CCC1 ZINC001479776631 1397843589 /nfs/dbraw/zinc/84/35/89/1397843589.db2.gz ZGHAMYHWBRTDBY-UHFFFAOYSA-N 1 3 337.895 2.762 10 0 EFAEHO CN(CC(=O)NCCC[N@@H+](C)Cc1ccc(Cl)cc1)C1CCC1 ZINC001479776631 1397843592 /nfs/dbraw/zinc/84/35/92/1397843592.db2.gz ZGHAMYHWBRTDBY-UHFFFAOYSA-N 1 3 337.895 2.762 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C)Cc1ccc(Cl)cc1C)N(C)C ZINC001479778025 1397845546 /nfs/dbraw/zinc/84/55/46/1397845546.db2.gz KKKYEOPIBRGBNW-QGZVFWFLSA-N 1 3 339.911 2.927 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C)Cc1ccc(Cl)cc1C)N(C)C ZINC001479778025 1397845549 /nfs/dbraw/zinc/84/55/49/1397845549.db2.gz KKKYEOPIBRGBNW-QGZVFWFLSA-N 1 3 339.911 2.927 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001479846630 1397944940 /nfs/dbraw/zinc/94/49/40/1397944940.db2.gz NMNXWOMUDJMGPH-HYWCFLMXSA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001479846630 1397944946 /nfs/dbraw/zinc/94/49/46/1397944946.db2.gz NMNXWOMUDJMGPH-HYWCFLMXSA-N 1 3 327.900 2.584 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@]12CCC[C@@H]1N(Cc1cccc(F)c1)CC2 ZINC001507346931 1406922981 /nfs/dbraw/zinc/92/29/81/1406922981.db2.gz FVYBMFOQZLVIJB-ICSRJNTNSA-N 1 3 347.478 2.781 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(C[C@H]2NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001479984715 1398069963 /nfs/dbraw/zinc/06/99/63/1398069963.db2.gz HJVRXCMYRXORTH-HNGSOEQISA-N 1 3 335.536 2.900 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N1CCC[C@H](CN(C)C/C=C/Cl)C1 ZINC001480078716 1398113450 /nfs/dbraw/zinc/11/34/50/1398113450.db2.gz MRLSEJLJVBOLDF-QOCAVEGASA-N 1 3 341.927 2.784 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N1CCC[C@H](CN(C)C/C=C/Cl)C1 ZINC001480078716 1398113454 /nfs/dbraw/zinc/11/34/54/1398113454.db2.gz MRLSEJLJVBOLDF-QOCAVEGASA-N 1 3 341.927 2.784 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@H]([NH2+]C/C=C/c2ccccc2)C1 ZINC001480174679 1398143678 /nfs/dbraw/zinc/14/36/78/1398143678.db2.gz XWDOOCLATZBQPI-ULMGEBSVSA-N 1 3 341.499 2.809 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001480679971 1398279349 /nfs/dbraw/zinc/27/93/49/1398279349.db2.gz FLMNOMOVSBCSSM-SJLPKXTDSA-N 1 3 331.504 2.846 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001480681852 1398279725 /nfs/dbraw/zinc/27/97/25/1398279725.db2.gz AIGVZSQQYYBPAT-SFHVURJKSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCC[C@H](NC(=O)CN(C)C(C)C)C2)c(C)n1 ZINC001480710864 1398303802 /nfs/dbraw/zinc/30/38/02/1398303802.db2.gz UCVCGAMWWJMWHH-MOPGFXCFSA-N 1 3 346.519 2.556 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@@H+]1CC1CCC1)N1CCCCC1 ZINC001493160806 1398489376 /nfs/dbraw/zinc/48/93/76/1398489376.db2.gz JQZXJVATIIVLTQ-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@H+]1CC1CCC1)N1CCCCC1 ZINC001493160806 1398489380 /nfs/dbraw/zinc/48/93/80/1398489380.db2.gz JQZXJVATIIVLTQ-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@@H+]1CC1CCC1)N1CCCCC1 ZINC001493160805 1398490276 /nfs/dbraw/zinc/49/02/76/1398490276.db2.gz JQZXJVATIIVLTQ-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@H+]1CC1CCC1)N1CCCCC1 ZINC001493160805 1398490281 /nfs/dbraw/zinc/49/02/81/1398490281.db2.gz JQZXJVATIIVLTQ-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCN(Cc2cccc(F)c2)C1)[NH+]1CCCC1 ZINC001493224421 1398544769 /nfs/dbraw/zinc/54/47/69/1398544769.db2.gz XPRMFPAOSYGNJH-QGZVFWFLSA-N 1 3 347.478 2.638 10 0 EFAEHO Cc1cc(C)cc(C[N@H+]2CC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001493238455 1398554968 /nfs/dbraw/zinc/55/49/68/1398554968.db2.gz WKOOJOPQQLDWBA-LPHOPBHVSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+]2CC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001493238455 1398554971 /nfs/dbraw/zinc/55/49/71/1398554971.db2.gz WKOOJOPQQLDWBA-LPHOPBHVSA-N 1 3 343.515 2.583 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1CC[C@@H](C)C1)CC1CC2(CCC2)C1 ZINC001493317630 1398610133 /nfs/dbraw/zinc/61/01/33/1398610133.db2.gz CUUKYKKHYBODPK-QGZVFWFLSA-N 1 3 335.536 2.737 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1CC[C@@H](C)C1)CC1CC2(CCC2)C1 ZINC001493317630 1398610140 /nfs/dbraw/zinc/61/01/40/1398610140.db2.gz CUUKYKKHYBODPK-QGZVFWFLSA-N 1 3 335.536 2.737 10 0 EFAEHO CCCN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)Cc1ccc(F)cc1C ZINC001493324548 1398614900 /nfs/dbraw/zinc/61/49/00/1398614900.db2.gz AKUXWGAUPTYHKE-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO CCCN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)Cc1ccc(F)cc1C ZINC001493324548 1398614905 /nfs/dbraw/zinc/61/49/05/1398614905.db2.gz AKUXWGAUPTYHKE-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@H+](CCC2=CCCCC2)C2CC2)C1 ZINC001493413739 1398687785 /nfs/dbraw/zinc/68/77/85/1398687785.db2.gz HYJIGIHVVLWJGM-KRWDZBQOSA-N 1 3 333.520 2.799 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@@H+](CCC2=CCCCC2)C2CC2)C1 ZINC001493413739 1398687789 /nfs/dbraw/zinc/68/77/89/1398687789.db2.gz HYJIGIHVVLWJGM-KRWDZBQOSA-N 1 3 333.520 2.799 10 0 EFAEHO CN(CC[NH2+][C@H]1CCc2ccc(Cl)cc21)C(=O)CN(C)C1CCC1 ZINC001493581752 1398761486 /nfs/dbraw/zinc/76/14/86/1398761486.db2.gz ZJGSLNXPNIOLPC-SFHVURJKSA-N 1 3 349.906 2.860 10 0 EFAEHO Cc1cc(CNCCN(C)C(=O)C2CC[NH+](CC3CC3)CC2)cs1 ZINC001493758526 1398867524 /nfs/dbraw/zinc/86/75/24/1398867524.db2.gz KWGFXAPTEZGVAM-UHFFFAOYSA-N 1 3 349.544 2.727 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N(C)CCNCc1cc2ccccc2o1 ZINC001493804012 1398894860 /nfs/dbraw/zinc/89/48/60/1398894860.db2.gz XRTXYUUNGRTASE-IYBDPMFKSA-N 1 3 343.471 2.854 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N(C)CCNCc1cc2ccccc2o1 ZINC001493804012 1398894864 /nfs/dbraw/zinc/89/48/64/1398894864.db2.gz XRTXYUUNGRTASE-IYBDPMFKSA-N 1 3 343.471 2.854 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCNCc1ccsc1)[NH+]1CCCCC1 ZINC001493807196 1398896431 /nfs/dbraw/zinc/89/64/31/1398896431.db2.gz XIYGRFCPEMRAJP-KRWDZBQOSA-N 1 3 337.533 2.807 10 0 EFAEHO C[C@H]1[C@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc2cc[nH]c2c1 ZINC001507382372 1406988585 /nfs/dbraw/zinc/98/85/85/1406988585.db2.gz KVCIMLFSCLFMEI-MAUKXSAKSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@H]([NH2+]CCCC1CCC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001493838416 1398914042 /nfs/dbraw/zinc/91/40/42/1398914042.db2.gz ZKTVJJZESSESMP-QFBILLFUSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C(=O)[C@H](C)[NH+]1CCCCCC1)[C@@H]1CCN(CCCF)C1 ZINC001493968561 1399019879 /nfs/dbraw/zinc/01/98/79/1399019879.db2.gz IYJZOVFAVLHBGI-ZWKOTPCHSA-N 1 3 341.515 2.923 10 0 EFAEHO CCCN(C(=O)[C@H](C)N1CCCCCC1)[C@@H]1CC[N@H+](CCCF)C1 ZINC001493968561 1399019884 /nfs/dbraw/zinc/01/98/84/1399019884.db2.gz IYJZOVFAVLHBGI-ZWKOTPCHSA-N 1 3 341.515 2.923 10 0 EFAEHO CCCN(C(=O)[C@H](C)N1CCCCCC1)[C@@H]1CC[N@@H+](CCCF)C1 ZINC001493968561 1399019888 /nfs/dbraw/zinc/01/98/88/1399019888.db2.gz IYJZOVFAVLHBGI-ZWKOTPCHSA-N 1 3 341.515 2.923 10 0 EFAEHO C[NH+](C)CCC(=O)NCC[C@@H]1CCN(Cc2sccc2Cl)C1 ZINC001494048568 1399089721 /nfs/dbraw/zinc/08/97/21/1399089721.db2.gz POXMQEUSRJGEPM-CYBMUJFWSA-N 1 3 343.924 2.681 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001494178950 1399191997 /nfs/dbraw/zinc/19/19/97/1399191997.db2.gz OIZKXQQAWZJMDZ-MSOLQXFVSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001494178950 1399192001 /nfs/dbraw/zinc/19/20/01/1399192001.db2.gz OIZKXQQAWZJMDZ-MSOLQXFVSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001494178957 1399191679 /nfs/dbraw/zinc/19/16/79/1399191679.db2.gz OIZKXQQAWZJMDZ-ROUUACIJSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001494178957 1399191682 /nfs/dbraw/zinc/19/16/82/1399191682.db2.gz OIZKXQQAWZJMDZ-ROUUACIJSA-N 1 3 325.541 2.789 10 0 EFAEHO CCc1ccccc1CN1CC(CNC(=O)C[NH+]2[C@H](C)CC[C@H]2C)C1 ZINC001494633644 1399408067 /nfs/dbraw/zinc/40/80/67/1399408067.db2.gz RTDCGVLXBSGINL-IAGOWNOFSA-N 1 3 343.515 2.670 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[C@@H](C[NH2+]Cc2cc(C)ccc2F)C1 ZINC001507418489 1407032545 /nfs/dbraw/zinc/03/25/45/1407032545.db2.gz GFYMXKHLQXSGSA-AEFFLSMTSA-N 1 3 349.494 2.850 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001507428328 1407041794 /nfs/dbraw/zinc/04/17/94/1407041794.db2.gz OSMNGBUSDDMBQQ-WOJBJXKFSA-N 1 3 345.531 2.752 10 0 EFAEHO CC[C@H](CNC(=O)CC1CC[NH+](C)CC1)NCc1cc(C)ccc1F ZINC001495068436 1399641718 /nfs/dbraw/zinc/64/17/18/1399641718.db2.gz DGLUJOOKSZCCQN-GOSISDBHSA-N 1 3 349.494 2.850 10 0 EFAEHO C[C@@H](C(=O)NC1(C[NH2+]CCCF)CCCC1)N1CCCCCC1 ZINC001495190816 1399725164 /nfs/dbraw/zinc/72/51/64/1399725164.db2.gz FTXHPAOWLDCUQD-INIZCTEOSA-N 1 3 327.488 2.629 10 0 EFAEHO Cc1cccc(C[NH2+]CC2(NC(=O)CN(C)C(C)C)CCCC2)c1 ZINC001495212647 1399740878 /nfs/dbraw/zinc/74/08/78/1399740878.db2.gz WRFGHHCGKTWVIQ-UHFFFAOYSA-N 1 3 331.504 2.854 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@@](C)(C[NH2+]Cc2ccc(F)cc2)C2CC2)C1 ZINC001495275879 1399785247 /nfs/dbraw/zinc/78/52/47/1399785247.db2.gz DEKSPUBKZKMEMS-QRWLVFNGSA-N 1 3 347.478 2.542 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@@](C)(C[NH2+]CC2=CCCCC2)C2CC2)C1 ZINC001495278534 1399787885 /nfs/dbraw/zinc/78/78/85/1399787885.db2.gz WHTIFCKWHXGDRU-JXFKEZNVSA-N 1 3 333.520 2.703 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2C[C@H]([NH2+]CCCC3CCC3)C(C)(C)C2)C1 ZINC001507446409 1407063018 /nfs/dbraw/zinc/06/30/18/1407063018.db2.gz VHQPVEHRAZLCOH-AEFFLSMTSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](CC[NH2+]Cc2ccccc2F)C1)N(C)C ZINC001495360085 1399904807 /nfs/dbraw/zinc/90/48/07/1399904807.db2.gz QCGXTLJTESMIHK-QFBILLFUSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](CC[NH2+]Cc2ccccc2F)C1)N(C)C ZINC001495360086 1399904873 /nfs/dbraw/zinc/90/48/73/1399904873.db2.gz QCGXTLJTESMIHK-VQIMIIECSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N2C[C@@H](NC/C=C/Cl)C(C)(C)C2)CC1 ZINC001507449903 1407066664 /nfs/dbraw/zinc/06/66/64/1407066664.db2.gz NFZUWRZCQMVBCS-CDVVCGDMSA-N 1 3 341.927 2.686 10 0 EFAEHO CCCC[NH2+]CC[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001495383978 1399930060 /nfs/dbraw/zinc/93/00/60/1399930060.db2.gz ALZXULGXQRYBQG-QGZVFWFLSA-N 1 3 325.541 2.983 10 0 EFAEHO CC1(C)CC(C[NH2+]CC[C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001495385810 1399931874 /nfs/dbraw/zinc/93/18/74/1399931874.db2.gz HWWXXCJZDDQICS-HNNXBMFYSA-N 1 3 332.492 2.607 10 0 EFAEHO CC1(C)CN(C(=O)CCC[NH+]2CCCCC2)C[C@@H]1NC/C=C\Cl ZINC001507452417 1407071022 /nfs/dbraw/zinc/07/10/22/1407071022.db2.gz MVJBLCMPHMAFQB-GQSKFBFOSA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)C[NH2+]CCc1cccs1 ZINC001495670158 1400154914 /nfs/dbraw/zinc/15/49/14/1400154914.db2.gz YFMMUZUDZBDNJH-RDJZCZTQSA-N 1 3 337.533 2.505 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)C[NH2+]CCc1cccs1 ZINC001495670159 1400154954 /nfs/dbraw/zinc/15/49/54/1400154954.db2.gz YFMMUZUDZBDNJH-WBVHZDCISA-N 1 3 337.533 2.505 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)C[NH2+][C@@H]1CCc2ccccc21 ZINC001495743282 1400217103 /nfs/dbraw/zinc/21/71/03/1400217103.db2.gz OFXBRNBABMDWHO-QFBILLFUSA-N 1 3 345.531 2.994 10 0 EFAEHO CCCN(C)CC(=O)N1CCC2(C[NH+](C[C@@H]3CC[C@@H]4C[C@@H]4C3)C2)CC1 ZINC001495986134 1400398759 /nfs/dbraw/zinc/39/87/59/1400398759.db2.gz IVRGQHQLTUMPEZ-QRVBRYPASA-N 1 3 347.547 2.689 10 0 EFAEHO C[C@H](C[NH2+][C@@H](C)c1ccc(F)c(F)c1)N(C)C(=O)CN1CCCC1 ZINC001496230163 1400557086 /nfs/dbraw/zinc/55/70/86/1400557086.db2.gz RIYJQJUOIXNVIT-KGLIPLIRSA-N 1 3 339.430 2.558 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]CCCc1ccccc1 ZINC001496248109 1400570310 /nfs/dbraw/zinc/57/03/10/1400570310.db2.gz JQORQCTXHXILOJ-QUCCMNQESA-N 1 3 345.531 2.930 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C[NH2+]CCC1CC1)C1CCCCC1 ZINC001496327490 1400643001 /nfs/dbraw/zinc/64/30/01/1400643001.db2.gz UKSQFFSGZHLJKD-GOSISDBHSA-N 1 3 332.492 2.715 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C[NH2+]CCC(C)C)C1CCCCC1 ZINC001496327515 1400643035 /nfs/dbraw/zinc/64/30/35/1400643035.db2.gz UPMKCGIHXUYYJH-GOSISDBHSA-N 1 3 334.508 2.961 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CC2CC3(CCC3)C2)[C@H](C)C1 ZINC001496366763 1400676180 /nfs/dbraw/zinc/67/61/80/1400676180.db2.gz FUQIYTFCCVYSAB-AEFFLSMTSA-N 1 3 335.536 2.735 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]Cc1ccc(F)cc1 ZINC001496390081 1400696930 /nfs/dbraw/zinc/69/69/30/1400696930.db2.gz SZIMEEFIPNZJIE-MOPGFXCFSA-N 1 3 347.478 2.781 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@H]1CC[NH2+]CCc1ccccc1 ZINC001496390176 1400697854 /nfs/dbraw/zinc/69/78/54/1400697854.db2.gz UCDDBPXAURTCJR-PMACEKPBSA-N 1 3 343.515 2.684 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@H]1CC[NH2+]CC1CC(F)(F)C1)N(C)C ZINC001496417848 1400719381 /nfs/dbraw/zinc/71/93/81/1400719381.db2.gz CHMPGCNWQIBAHG-JKSUJKDBSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H](C)[NH2+]CCc2ccccc2)C1 ZINC001496457933 1400743726 /nfs/dbraw/zinc/74/37/26/1400743726.db2.gz ASSGYOBFPHKGAZ-AZUAARDMSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H](C)[NH2+]CC2CC(F)(F)C2)C1 ZINC001496459014 1400744734 /nfs/dbraw/zinc/74/47/34/1400744734.db2.gz HBZKKFIHLRUONT-ZBFHGGJFSA-N 1 3 345.478 2.589 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C)[C@@H]1C[NH2+]Cc1ccsc1 ZINC001496486211 1400764304 /nfs/dbraw/zinc/76/43/04/1400764304.db2.gz IHJNXJJFHUTPIM-WBVHZDCISA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001496562885 1400830324 /nfs/dbraw/zinc/83/03/24/1400830324.db2.gz VDDLJQHESCRIFN-RBUKOAKNSA-N 1 3 343.515 2.889 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](CNC(=O)C2CC[NH+](C)CC2)C(C)C)c1 ZINC001496597974 1400859266 /nfs/dbraw/zinc/85/92/66/1400859266.db2.gz IPTRRWWGCPFZFI-IBGZPJMESA-N 1 3 349.494 2.706 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CC[NH+](C)C)N[C@@H](C)c1cc(F)ccc1F ZINC001496598998 1400859869 /nfs/dbraw/zinc/85/98/69/1400859869.db2.gz VMTVKCXXJHHCBV-SUMWQHHRSA-N 1 3 341.446 2.708 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)cc1 ZINC001496603259 1400863364 /nfs/dbraw/zinc/86/33/64/1400863364.db2.gz QAJMQJNGMHKHPS-AZUAARDMSA-N 1 3 345.531 2.610 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)cc1 ZINC001496603264 1400863570 /nfs/dbraw/zinc/86/35/70/1400863570.db2.gz QAJMQJNGMHKHPS-UYAOXDASSA-N 1 3 345.531 2.610 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1ccccc1F)C(C)C ZINC001496640725 1400893236 /nfs/dbraw/zinc/89/32/36/1400893236.db2.gz CGMXFRZWNULWFN-MOPGFXCFSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2CC2=CCCCC2)C1 ZINC001496864700 1401060142 /nfs/dbraw/zinc/06/01/42/1401060142.db2.gz AGMBSWQPDNCKBO-RBUKOAKNSA-N 1 3 333.520 2.750 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2CC2=CCCCC2)C1 ZINC001496864700 1401060148 /nfs/dbraw/zinc/06/01/48/1401060148.db2.gz AGMBSWQPDNCKBO-RBUKOAKNSA-N 1 3 333.520 2.750 10 0 EFAEHO Cc1ncccc1C[NH2+]CC[C@@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001497188778 1401207916 /nfs/dbraw/zinc/20/79/16/1401207916.db2.gz MYBSDRUOXKHFEQ-MRXNPFEDSA-N 1 3 346.519 2.639 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC[C@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001497271236 1401260434 /nfs/dbraw/zinc/26/04/34/1401260434.db2.gz LQITUKUFIZLTGZ-YJBOKZPZSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)cc1F)N(C)C ZINC001497308139 1401287465 /nfs/dbraw/zinc/28/74/65/1401287465.db2.gz SEKWOXUFLHMGSF-WBMJQRKESA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+][C@@H](C)c1ccc(F)cc1F ZINC001497329726 1401305770 /nfs/dbraw/zinc/30/57/70/1401305770.db2.gz DECDSEUIIPIBNX-KBPBESRZSA-N 1 3 341.446 2.850 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]Cc1ccc(F)cc1 ZINC001497329821 1401307201 /nfs/dbraw/zinc/30/72/01/1401307201.db2.gz DUTNFQWGJSYTRE-CRAIPNDOSA-N 1 3 335.467 2.685 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc(C(F)F)c1)C(=O)[C@@H]1CCCN1C ZINC001497363159 1401327926 /nfs/dbraw/zinc/32/79/26/1401327926.db2.gz ZIUVFZTXBSCEKG-INIZCTEOSA-N 1 3 339.430 2.657 10 0 EFAEHO CC[C@H](F)CNCCN(CC)C(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001497394407 1401346207 /nfs/dbraw/zinc/34/62/07/1401346207.db2.gz OYYMQPIQHRRRLZ-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](F)CNCCN(CC)C(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001497394407 1401346210 /nfs/dbraw/zinc/34/62/10/1401346210.db2.gz OYYMQPIQHRRRLZ-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(CC[N@H+](C)C[C@@H]1CC[C@H]2C[C@H]2C1)C(=O)Cc1c[nH]cn1 ZINC001507842045 1407181226 /nfs/dbraw/zinc/18/12/26/1407181226.db2.gz TZZFBFUAMKEZDD-IXDOHACOSA-N 1 3 332.492 2.557 10 0 EFAEHO CC(C)N(CC[N@@H+](C)C[C@@H]1CC[C@H]2C[C@H]2C1)C(=O)Cc1c[nH]cn1 ZINC001507842045 1407181232 /nfs/dbraw/zinc/18/12/32/1407181232.db2.gz TZZFBFUAMKEZDD-IXDOHACOSA-N 1 3 332.492 2.557 10 0 EFAEHO CC(C)(C(=O)NC/C=C\CNCc1cccc(Cl)c1)[NH+]1CCCC1 ZINC001497658853 1401528290 /nfs/dbraw/zinc/52/82/90/1401528290.db2.gz OKFLOAKXHMOZEA-ARJAWSKDSA-N 1 3 349.906 2.976 10 0 EFAEHO CC[C@H](F)CNC/C=C\CNC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001497663119 1401532271 /nfs/dbraw/zinc/53/22/71/1401532271.db2.gz PCIFTKLBQKJIJR-PRVDXRAFSA-N 1 3 339.499 2.794 10 0 EFAEHO CC[C@H](F)CNC/C=C\CNC(=O)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001497663119 1401532275 /nfs/dbraw/zinc/53/22/75/1401532275.db2.gz PCIFTKLBQKJIJR-PRVDXRAFSA-N 1 3 339.499 2.794 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\CN[C@H](C)c1cccc(F)c1)[NH+](C)C ZINC001497673269 1401539752 /nfs/dbraw/zinc/53/97/52/1401539752.db2.gz XIOOWNBFFHJFTR-QNRLHKFMSA-N 1 3 335.467 2.735 10 0 EFAEHO CCCN(C)CC(=O)NC/C=C\C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001497726689 1401587332 /nfs/dbraw/zinc/58/73/32/1401587332.db2.gz SZHQYXYODXDZBX-PHWHVTFISA-N 1 3 347.478 2.807 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C/C=C/CNC(=O)CN1CCCC1 ZINC001497750134 1401615766 /nfs/dbraw/zinc/61/57/66/1401615766.db2.gz PPCPAEDARHHGLB-NSCUHMNNSA-N 1 3 335.879 2.506 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001497910685 1401735432 /nfs/dbraw/zinc/73/54/32/1401735432.db2.gz MEDNGGMMJJTWAN-ZIEDNJRCSA-N 1 3 327.488 2.650 10 0 EFAEHO C[C@H](C[NH2+]Cc1cccc(C(F)F)c1)NC(=O)CN1CC[C@@H](C)C1 ZINC001497910759 1401735300 /nfs/dbraw/zinc/73/53/00/1401735300.db2.gz OSZMLJVNXISEDA-ZIAGYGMSSA-N 1 3 339.430 2.560 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@@H](C)NC(=O)[C@H]1CCCCN1CC ZINC001497994287 1401799808 /nfs/dbraw/zinc/79/98/08/1401799808.db2.gz ZSIVLNJWFNTKRZ-VQIMIIECSA-N 1 3 331.504 2.718 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCCN2C(C)C)cs1 ZINC001498133778 1401872061 /nfs/dbraw/zinc/87/20/61/1401872061.db2.gz YOCJMUOKSXWZOS-YOEHRIQHSA-N 1 3 337.533 2.914 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CCCc1cccc(C)c1 ZINC001498197698 1401904252 /nfs/dbraw/zinc/90/42/52/1401904252.db2.gz UVMSFFARCUAGQD-AZUAARDMSA-N 1 3 345.531 2.896 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(CF)cc1 ZINC001498281694 1401973489 /nfs/dbraw/zinc/97/34/89/1401973489.db2.gz QYGYSCRQDODBAE-VQIMIIECSA-N 1 3 349.494 2.965 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(CF)cc1 ZINC001498281694 1401973492 /nfs/dbraw/zinc/97/34/92/1401973492.db2.gz QYGYSCRQDODBAE-VQIMIIECSA-N 1 3 349.494 2.965 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(CF)cc1 ZINC001498281692 1401973616 /nfs/dbraw/zinc/97/36/16/1401973616.db2.gz QYGYSCRQDODBAE-LPHOPBHVSA-N 1 3 349.494 2.965 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(CF)cc1 ZINC001498281692 1401973620 /nfs/dbraw/zinc/97/36/20/1401973620.db2.gz QYGYSCRQDODBAE-LPHOPBHVSA-N 1 3 349.494 2.965 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001498424457 1402088718 /nfs/dbraw/zinc/08/87/18/1402088718.db2.gz FUABUOIXPHKWAT-GDBMZVCRSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001498424457 1402088724 /nfs/dbraw/zinc/08/87/24/1402088724.db2.gz FUABUOIXPHKWAT-GDBMZVCRSA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCCC[C@H]1C[NH2+]Cc1ccsc1 ZINC001498504673 1402150361 /nfs/dbraw/zinc/15/03/61/1402150361.db2.gz PDEHYAJJEJLGHF-DLBZAZTESA-N 1 3 337.533 2.853 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCCC[C@@H]1C[NH2+]CCC(F)(F)F ZINC001498505883 1402151473 /nfs/dbraw/zinc/15/14/73/1402151473.db2.gz UZZXZWDRZRCHPH-ZIAGYGMSSA-N 1 3 337.430 2.544 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]Cc1ccc(F)cc1Cl)N(C)C ZINC001498579966 1402185289 /nfs/dbraw/zinc/18/52/89/1402185289.db2.gz ABGKDBPRPLSFJI-MRXNPFEDSA-N 1 3 343.874 2.757 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)Cc1c[nH]cn1)c1ccc(Cl)cc1 ZINC001498618984 1402205472 /nfs/dbraw/zinc/20/54/72/1402205472.db2.gz MJNLWCHOCZLXTH-CYBMUJFWSA-N 1 3 334.851 2.805 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]Cc1ccc2ncccc2c1)N(C)C ZINC001498641549 1402219743 /nfs/dbraw/zinc/21/97/43/1402219743.db2.gz HCOLEWNESGFWJI-IBGZPJMESA-N 1 3 342.487 2.513 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[NH2+]Cc1cc(C)ccc1F ZINC001498658432 1402232306 /nfs/dbraw/zinc/23/23/06/1402232306.db2.gz OOBOTRHMKYQDJT-LJQANCHMSA-N 1 3 349.494 2.947 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)C ZINC001508025105 1407245783 /nfs/dbraw/zinc/24/57/83/1407245783.db2.gz SYTJQODKZZYQRX-GJZGRUSLSA-N 1 3 331.520 2.833 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H](NC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001498872967 1402350425 /nfs/dbraw/zinc/35/04/25/1402350425.db2.gz HXFWWQRIMIIIJO-IBGZPJMESA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]CC1CC(C)(C)C1 ZINC001498906614 1402372608 /nfs/dbraw/zinc/37/26/08/1402372608.db2.gz HOFKOOJZDRQAED-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]CC1CC(F)(F)C1 ZINC001498906694 1402373035 /nfs/dbraw/zinc/37/30/35/1402373035.db2.gz JNJRLJFGGXONOQ-CVEARBPZSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]Cc1ccc(F)cc1)C(C)(C)C ZINC001508036520 1407256765 /nfs/dbraw/zinc/25/67/65/1407256765.db2.gz QNCFMUXJMIYSQQ-KRWDZBQOSA-N 1 3 337.483 2.786 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[N@@H+]1CC1CCCC1)N1CCCCC1 ZINC001499128475 1402486971 /nfs/dbraw/zinc/48/69/71/1402486971.db2.gz XMJNBZKUUZWUFV-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[N@H+]1CC1CCCC1)N1CCCCC1 ZINC001499128475 1402486976 /nfs/dbraw/zinc/48/69/76/1402486976.db2.gz XMJNBZKUUZWUFV-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1(N[C@H](C)c2cccc(F)c2)CC1)[NH+](C)C ZINC001499256460 1402539943 /nfs/dbraw/zinc/53/99/43/1402539943.db2.gz JCCPXNJCXRAOIG-PBHICJAKSA-N 1 3 335.467 2.711 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@@H](C(C)C)[NH+]3CCCC3)CC2)cs1 ZINC001499459070 1402624177 /nfs/dbraw/zinc/62/41/77/1402624177.db2.gz TXYLBHJHXDSWHO-QGZVFWFLSA-N 1 3 349.544 2.915 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCC2([NH2+]CC3CCCC3)CC2)c1 ZINC001499461635 1402624600 /nfs/dbraw/zinc/62/46/00/1402624600.db2.gz MTUVUJPNBSKSNC-UHFFFAOYSA-N 1 3 329.488 2.790 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(C1)CCC[N@H+](CC1CC(C)C1)C2 ZINC001499577431 1402696111 /nfs/dbraw/zinc/69/61/11/1402696111.db2.gz VJEKEVQUJOWULG-QLOJAFMTSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(C1)CCC[N@@H+](CC1CC(C)C1)C2 ZINC001499577431 1402696114 /nfs/dbraw/zinc/69/61/14/1402696114.db2.gz VJEKEVQUJOWULG-QLOJAFMTSA-N 1 3 335.536 2.687 10 0 EFAEHO CC[C@H](F)CN1CC[C@@]2(CCN(C(=O)CCC[NH+]3CCCC3)C2)C1 ZINC001499618654 1402723386 /nfs/dbraw/zinc/72/33/86/1402723386.db2.gz DZGJWPIMRWOQGU-PKOBYXMFSA-N 1 3 339.499 2.535 10 0 EFAEHO CC[C@@H](F)CN1CCC([C@@H](C)NC(=O)CC[NH+]2CCCCC2)CC1 ZINC001508068995 1407279324 /nfs/dbraw/zinc/27/93/24/1407279324.db2.gz JSMQPICWSACXMF-SJLPKXTDSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[NH2+]CCCc1ccc(C)cc1)N(C)C ZINC001499943545 1402864187 /nfs/dbraw/zinc/86/41/87/1402864187.db2.gz DXCHNQFOVCQCCT-WOJBJXKFSA-N 1 3 345.531 2.848 10 0 EFAEHO CC[NH2+]C[C@@H](NC(=O)CN1CC[C@@H](C)C1)c1ccc2ccccc2c1 ZINC001500060855 1402918400 /nfs/dbraw/zinc/91/84/00/1402918400.db2.gz WKGSSVLVTCSTER-OXQOHEQNSA-N 1 3 339.483 2.948 10 0 EFAEHO C[C@H](NC(=O)C[C@@H]1CC[N@H+](C)C1)C1CCN(Cc2ccsc2)CC1 ZINC001508090037 1407292904 /nfs/dbraw/zinc/29/29/04/1407292904.db2.gz YUWAKPVHXCOYFQ-HOTGVXAUSA-N 1 3 349.544 2.807 10 0 EFAEHO C[C@H](NC(=O)C[C@@H]1CC[N@@H+](C)C1)C1CCN(Cc2ccsc2)CC1 ZINC001508090037 1407292910 /nfs/dbraw/zinc/29/29/10/1407292910.db2.gz YUWAKPVHXCOYFQ-HOTGVXAUSA-N 1 3 349.544 2.807 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@@H](NC(=O)C(C)(C)N1CCCC1)C1CCCC1 ZINC001500105023 1402939375 /nfs/dbraw/zinc/93/93/75/1402939375.db2.gz GHMODHMJSWLRJT-DLBZAZTESA-N 1 3 341.515 2.874 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@]2(CC[N@H+](C[C@H](F)CC)C2)C1 ZINC001500161379 1402962449 /nfs/dbraw/zinc/96/24/49/1402962449.db2.gz KVBASCSNLDIRPZ-IEBWSBKVSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@]2(CC[N@@H+](C[C@H](F)CC)C2)C1 ZINC001500161379 1402962451 /nfs/dbraw/zinc/96/24/51/1402962451.db2.gz KVBASCSNLDIRPZ-IEBWSBKVSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@]2(CC[N@H+](CCC3CC3)C2)C1 ZINC001500163766 1402963139 /nfs/dbraw/zinc/96/31/39/1402963139.db2.gz XBJYHXMHULSUHO-FQEVSTJZSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@]2(CC[N@@H+](CCC3CC3)C2)C1 ZINC001500163766 1402963140 /nfs/dbraw/zinc/96/31/40/1402963140.db2.gz XBJYHXMHULSUHO-FQEVSTJZSA-N 1 3 335.536 2.833 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001500378948 1403084761 /nfs/dbraw/zinc/08/47/61/1403084761.db2.gz ZTTAAIISYOXKGI-APWZRJJASA-N 1 3 325.541 2.839 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CC[C@](C)(C[NH2+]C/C=C\Cl)C1 ZINC001500382056 1403087269 /nfs/dbraw/zinc/08/72/69/1403087269.db2.gz JVGAKBRXQGHNGI-UBUVMBRLSA-N 1 3 341.927 2.830 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@](C)(C[NH2+]CC2CCC(C)CC2)C1 ZINC001500396602 1403094955 /nfs/dbraw/zinc/09/49/55/1403094955.db2.gz FEXQROJXKSZIQM-AFMYVXGZSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@](C)(C[NH2+]CCc2ccccc2)C1)N(C)C ZINC001500397237 1403095062 /nfs/dbraw/zinc/09/50/62/1403095062.db2.gz ROFKXGIYJFZWLM-CTNGQTDRSA-N 1 3 345.531 2.644 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001500613679 1403247771 /nfs/dbraw/zinc/24/77/71/1403247771.db2.gz MLYJAHSUBYSPFA-ZJBFNYKTSA-N 1 3 345.478 2.756 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC(F)(F)[C@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001500613679 1403247773 /nfs/dbraw/zinc/24/77/73/1403247773.db2.gz MLYJAHSUBYSPFA-ZJBFNYKTSA-N 1 3 345.478 2.756 10 0 EFAEHO CC(C)C[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001500617550 1403252888 /nfs/dbraw/zinc/25/28/88/1403252888.db2.gz VNBLSIZYQDCOME-HNNXBMFYSA-N 1 3 347.494 2.694 10 0 EFAEHO CC(C)C[N@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001500617550 1403252892 /nfs/dbraw/zinc/25/28/92/1403252892.db2.gz VNBLSIZYQDCOME-HNNXBMFYSA-N 1 3 347.494 2.694 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H]1CN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001501152816 1403462337 /nfs/dbraw/zinc/46/23/37/1403462337.db2.gz FFXVRCKSYBPSIT-MJGOQNOKSA-N 1 3 331.504 2.519 10 0 EFAEHO CCCCC[N@H+]1C[C@H]2CN(C(=O)[C@H]3CCCCN3C(C)C)C[C@H]2C1 ZINC001501233426 1403504948 /nfs/dbraw/zinc/50/49/48/1403504948.db2.gz XMESGVDWRIXZRB-CEXWTWQISA-N 1 3 335.536 2.830 10 0 EFAEHO CCCCC[N@@H+]1C[C@H]2CN(C(=O)[C@H]3CCCCN3C(C)C)C[C@H]2C1 ZINC001501233426 1403504951 /nfs/dbraw/zinc/50/49/51/1403504951.db2.gz XMESGVDWRIXZRB-CEXWTWQISA-N 1 3 335.536 2.830 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(F)cc1 ZINC001501403402 1403590395 /nfs/dbraw/zinc/59/03/95/1403590395.db2.gz IJQJAHVCPNHEJJ-MOPGFXCFSA-N 1 3 347.478 2.733 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(F)cc1 ZINC001501403402 1403590399 /nfs/dbraw/zinc/59/03/99/1403590399.db2.gz IJQJAHVCPNHEJJ-MOPGFXCFSA-N 1 3 347.478 2.733 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@H]1CCN(C(=O)[C@@H]2CCCN2C)C1 ZINC001501544427 1403621023 /nfs/dbraw/zinc/62/10/23/1403621023.db2.gz KWKUZDWCMIZCQP-PXNSSMCTSA-N 1 3 343.515 2.671 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001501637496 1403659236 /nfs/dbraw/zinc/65/92/36/1403659236.db2.gz KIOTZLPHODBCJB-AEFFLSMTSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](CC[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001501637497 1403659874 /nfs/dbraw/zinc/65/98/74/1403659874.db2.gz KIOTZLPHODBCJB-FUHWJXTLSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001501638440 1403660457 /nfs/dbraw/zinc/66/04/57/1403660457.db2.gz WJKXDDWPYVNCJA-QUCCMNQESA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC2(C1)CC[NH+](CCCCCF)CC2)N(C)C ZINC001501737678 1403754423 /nfs/dbraw/zinc/75/44/23/1403754423.db2.gz WYUVCCULSYTKAU-KRWDZBQOSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@@H](c1ccccc1F)N1CCC2(CN(C(=O)CC[NH+](C)C)C2)CC1 ZINC001501742311 1403757970 /nfs/dbraw/zinc/75/79/70/1403757970.db2.gz WMUCCHGGJFPGMD-INIZCTEOSA-N 1 3 347.478 2.763 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@H+](CCCc2ccsc2)CC1)N(C)C ZINC001508227583 1407363729 /nfs/dbraw/zinc/36/37/29/1407363729.db2.gz NSOAAOIPFRXCJQ-SFHVURJKSA-N 1 3 349.544 2.769 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@@H+](CCCc2ccsc2)CC1)N(C)C ZINC001508227583 1407363735 /nfs/dbraw/zinc/36/37/35/1407363735.db2.gz NSOAAOIPFRXCJQ-SFHVURJKSA-N 1 3 349.544 2.769 10 0 EFAEHO Cc1cncc(CN(C)CCCN(C)C(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001502341780 1404083919 /nfs/dbraw/zinc/08/39/19/1404083919.db2.gz CXJFYVIEORIQEZ-IBGZPJMESA-N 1 3 346.519 2.545 10 0 EFAEHO Cc1cncc(CN(C)CCCN(C)C(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001502341780 1404083923 /nfs/dbraw/zinc/08/39/23/1404083923.db2.gz CXJFYVIEORIQEZ-IBGZPJMESA-N 1 3 346.519 2.545 10 0 EFAEHO CC(C)=CC[N@@H+](C)CCCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001502375768 1404114454 /nfs/dbraw/zinc/11/44/54/1404114454.db2.gz TXYNDEYRKAEPPM-LJQANCHMSA-N 1 3 341.515 2.945 10 0 EFAEHO CC(C)=CC[N@H+](C)CCCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001502375768 1404114466 /nfs/dbraw/zinc/11/44/66/1404114466.db2.gz TXYNDEYRKAEPPM-LJQANCHMSA-N 1 3 341.515 2.945 10 0 EFAEHO Cc1cc(C[N@@H+](C)CCCN(C)C(=O)CN(C)C(C)C)c(C)s1 ZINC001502401841 1404142405 /nfs/dbraw/zinc/14/24/05/1404142405.db2.gz UCYLOLDLSGHEQZ-UHFFFAOYSA-N 1 3 339.549 2.985 10 0 EFAEHO Cc1cc(C[N@H+](C)CCCN(C)C(=O)CN(C)C(C)C)c(C)s1 ZINC001502401841 1404142411 /nfs/dbraw/zinc/14/24/11/1404142411.db2.gz UCYLOLDLSGHEQZ-UHFFFAOYSA-N 1 3 339.549 2.985 10 0 EFAEHO CCC1([NH2+]CC[C@H](C)F)CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001502510691 1404210688 /nfs/dbraw/zinc/21/06/88/1404210688.db2.gz ATGSJLWYNLHHQE-KRWDZBQOSA-N 1 3 341.515 2.827 10 0 EFAEHO CN(CC(=O)N1CCC[C@]2(CC[N@H+](CC3CC3)C2)C1)CC(C)(C)C ZINC001502546892 1404238041 /nfs/dbraw/zinc/23/80/41/1404238041.db2.gz ZZGCJOYHTAOFHB-HXUWFJFHSA-N 1 3 335.536 2.689 10 0 EFAEHO CN(CC(=O)N1CCC[C@]2(CC[N@@H+](CC3CC3)C2)C1)CC(C)(C)C ZINC001502546892 1404238050 /nfs/dbraw/zinc/23/80/50/1404238050.db2.gz ZZGCJOYHTAOFHB-HXUWFJFHSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccc(C)cc2)[C@@H](C)C1 ZINC001502754560 1404326013 /nfs/dbraw/zinc/32/60/13/1404326013.db2.gz SUCYQCFACDTTHG-ICSRJNTNSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@H]([NH2+]CC2CCC(C)(C)CC2)C1 ZINC001502762926 1404332014 /nfs/dbraw/zinc/33/20/14/1404332014.db2.gz YPMBZRIHOSIOPT-FUHWJXTLSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1F)N(C)C ZINC001503290607 1404479645 /nfs/dbraw/zinc/47/96/45/1404479645.db2.gz KOWOFRRBILXGNU-GDZNZVCISA-N 1 3 341.446 2.850 10 0 EFAEHO CN(C)C1(C(=O)NC2CC(C[NH2+]C/C=C/c3ccccc3)C2)CCC1 ZINC001505501759 1404729475 /nfs/dbraw/zinc/72/94/75/1404729475.db2.gz IMLZIULQRZLCBG-UXBLZVDNSA-N 1 3 341.499 2.669 10 0 EFAEHO CC(C)[C@H](C(=O)NC1CC(C[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001505531165 1404744334 /nfs/dbraw/zinc/74/43/34/1404744334.db2.gz SGQCLNFCPUONDS-OFLPRAFFSA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](CNCCF)C(C)(C)C)[NH+]1CCCCC1 ZINC001725755734 1425822518 /nfs/dbraw/zinc/82/25/18/1425822518.db2.gz GOJJEFSPQPGOPA-JKSUJKDBSA-N 1 3 329.504 2.587 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@@H](C)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001505621378 1404863509 /nfs/dbraw/zinc/86/35/09/1404863509.db2.gz GPRDGKQNHXZZSP-IRXDYDNUSA-N 1 3 345.531 2.759 10 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1405122144 /nfs/dbraw/zinc/12/21/44/1405122144.db2.gz JUNIISDVPRAWDP-KRWDZBQOSA-N 1 3 349.563 2.983 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H](C)[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001506043303 1405393188 /nfs/dbraw/zinc/39/31/88/1405393188.db2.gz NWOQDWMPQKZDOL-HUUCEWRRSA-N 1 3 333.467 2.590 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H](C)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001506043303 1405393196 /nfs/dbraw/zinc/39/31/96/1405393196.db2.gz NWOQDWMPQKZDOL-HUUCEWRRSA-N 1 3 333.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001506065757 1405425262 /nfs/dbraw/zinc/42/52/62/1405425262.db2.gz VKHCOPWOWSLAOJ-ROUUACIJSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001506065757 1405425266 /nfs/dbraw/zinc/42/52/66/1405425266.db2.gz VKHCOPWOWSLAOJ-ROUUACIJSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001506065755 1405425445 /nfs/dbraw/zinc/42/54/45/1405425445.db2.gz VKHCOPWOWSLAOJ-MSOLQXFVSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001506065755 1405425448 /nfs/dbraw/zinc/42/54/48/1405425448.db2.gz VKHCOPWOWSLAOJ-MSOLQXFVSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]Cc1ccsc1 ZINC001506159091 1405491764 /nfs/dbraw/zinc/49/17/64/1405491764.db2.gz MTPFCPZSFCADDR-SJORKVTESA-N 1 3 337.533 2.805 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NC2(CNCc3ccccc3F)CCCCC2)C1 ZINC001506525726 1405908857 /nfs/dbraw/zinc/90/88/57/1405908857.db2.gz MJRWDOHNBWDWCH-QGZVFWFLSA-N 1 3 347.478 2.686 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NC2(CNCc3ccccc3F)CCCCC2)C1 ZINC001506525726 1405908860 /nfs/dbraw/zinc/90/88/60/1405908860.db2.gz MJRWDOHNBWDWCH-QGZVFWFLSA-N 1 3 347.478 2.686 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H](C)C1C[NH+](Cc2ccccc2C)C1 ZINC001506621640 1406054301 /nfs/dbraw/zinc/05/43/01/1406054301.db2.gz YJJMKVFMKMECHQ-VQIMIIECSA-N 1 3 349.494 2.611 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)C1C[NH+](CC2CC(C)(C)C2)C1 ZINC001506644776 1406090185 /nfs/dbraw/zinc/09/01/85/1406090185.db2.gz ZLACMJQIOVVEQC-OAHLLOKOSA-N 1 3 335.536 2.734 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C1C[NH+](CC2CCC3(CC3)CC2)C1 ZINC001506669585 1406126104 /nfs/dbraw/zinc/12/61/04/1406126104.db2.gz FKNCDMKKOLYDOX-CQSZACIVSA-N 1 3 344.503 2.668 10 0 EFAEHO CC[C@@H](c1ccccc1)[NH+]1CC([C@@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001506678508 1406139253 /nfs/dbraw/zinc/13/92/53/1406139253.db2.gz JEENCNXPSILVBO-APWZRJJASA-N 1 3 331.504 2.914 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)/C(F)=C\C1CCCCC1 ZINC001557450284 1415126274 /nfs/dbraw/zinc/12/62/74/1415126274.db2.gz KVMIOJJIVSAUCP-XOAFGZPJSA-N 1 3 327.488 2.808 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)/C(F)=C\C1CCCCC1 ZINC001557450284 1415126278 /nfs/dbraw/zinc/12/62/78/1415126278.db2.gz KVMIOJJIVSAUCP-XOAFGZPJSA-N 1 3 327.488 2.808 10 0 EFAEHO C[C@@]1(CN2CCC(O)(C[NH+]3CCCCC3)CC2)CC1(Cl)Cl ZINC001560218256 1415268509 /nfs/dbraw/zinc/26/85/09/1415268509.db2.gz XLWKDXRCMYYOES-AWEZNQCLSA-N 1 3 335.319 2.883 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N(C)C[C@H]2CCN2CCCCCF)CC1 ZINC001565829253 1415424437 /nfs/dbraw/zinc/42/44/37/1415424437.db2.gz BGIHJZNTHJCHJG-GOSISDBHSA-N 1 3 341.515 2.779 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]2C1 ZINC001566045297 1415492844 /nfs/dbraw/zinc/49/28/44/1415492844.db2.gz WWWPQHLZCSRYHX-YSKLNCTFSA-N 1 3 347.547 2.997 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]2C1 ZINC001566045297 1415492848 /nfs/dbraw/zinc/49/28/48/1415492848.db2.gz WWWPQHLZCSRYHX-YSKLNCTFSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C/CC[N@H+](C)C[C@@H]1CCCCN1C(=O)CN1CC[C@H](C)C1 ZINC001566124496 1415523284 /nfs/dbraw/zinc/52/32/84/1415523284.db2.gz VQDZKIOEOMIUQR-WLMAVBAVSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](C)C[C@@H]1CCCCN1C(=O)CN1CC[C@H](C)C1 ZINC001566124496 1415523287 /nfs/dbraw/zinc/52/32/87/1415523287.db2.gz VQDZKIOEOMIUQR-WLMAVBAVSA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@H+](C)CCCNC(=O)CN(C)C1CCC1 ZINC001566461016 1415560288 /nfs/dbraw/zinc/56/02/88/1415560288.db2.gz KVQVSSWYGDIUKY-QGZVFWFLSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@@H+](C)CCCNC(=O)CN(C)C1CCC1 ZINC001566461016 1415560291 /nfs/dbraw/zinc/56/02/91/1415560291.db2.gz KVQVSSWYGDIUKY-QGZVFWFLSA-N 1 3 331.504 2.978 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](C)C[C@H]2CCCC(F)(F)C2)C1 ZINC001566490751 1415582153 /nfs/dbraw/zinc/58/21/53/1415582153.db2.gz BWCYASREOMAWKY-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](C)C[C@H]2CCCC(F)(F)C2)C1 ZINC001566490751 1415582157 /nfs/dbraw/zinc/58/21/57/1415582157.db2.gz BWCYASREOMAWKY-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CCc1ccc(C[N@H+](C)CCCNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001566490782 1415582325 /nfs/dbraw/zinc/58/23/25/1415582325.db2.gz CNVVZWLRGOMHLD-QGZVFWFLSA-N 1 3 331.504 2.529 10 0 EFAEHO CCc1ccc(C[N@@H+](C)CCCNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001566490782 1415582332 /nfs/dbraw/zinc/58/23/32/1415582332.db2.gz CNVVZWLRGOMHLD-QGZVFWFLSA-N 1 3 331.504 2.529 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)CCCNC(=O)CN(C)C(C)C)c(C)c1 ZINC001566519788 1415608826 /nfs/dbraw/zinc/60/88/26/1415608826.db2.gz GHXWTJJZWRKTIC-UHFFFAOYSA-N 1 3 333.520 2.890 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)CCCNC(=O)CN(C)C(C)C)c(C)c1 ZINC001566519788 1415608828 /nfs/dbraw/zinc/60/88/28/1415608828.db2.gz GHXWTJJZWRKTIC-UHFFFAOYSA-N 1 3 333.520 2.890 10 0 EFAEHO C[C@H](c1ccccc1F)N(CCCNC(=O)[C@H]1CC[N@H+](C)C1)C1CC1 ZINC001566602893 1415688003 /nfs/dbraw/zinc/68/80/03/1415688003.db2.gz SCJCUVBUTFCDTK-CVEARBPZSA-N 1 3 347.478 2.809 10 0 EFAEHO C[C@H](c1ccccc1F)N(CCCNC(=O)[C@H]1CC[N@@H+](C)C1)C1CC1 ZINC001566602893 1415688007 /nfs/dbraw/zinc/68/80/07/1415688007.db2.gz SCJCUVBUTFCDTK-CVEARBPZSA-N 1 3 347.478 2.809 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(C[C@@H]2NC(=O)C2(N(C)C)CCC2)CC1 ZINC001566689542 1415732403 /nfs/dbraw/zinc/73/24/03/1415732403.db2.gz PHDCPODZGIDACT-RTRPANQVSA-N 1 3 333.520 2.798 10 0 EFAEHO CN(CC(=O)N1CC[C@H]([NH2+]CC/C=C/c2ccccc2)C1)C1CCC1 ZINC001566766740 1415768286 /nfs/dbraw/zinc/76/82/86/1415768286.db2.gz MJLBGFWDFVKTNC-GSXXRBPTSA-N 1 3 341.499 2.765 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2C[C@H](NC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001566803511 1415779719 /nfs/dbraw/zinc/77/97/19/1415779719.db2.gz CCNPMDQOVTVBBR-MISYRCLQSA-N 1 3 343.515 2.506 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N[C@H]1C[C@H](NCc2ccccc2F)C1 ZINC001566815235 1415783804 /nfs/dbraw/zinc/78/38/04/1415783804.db2.gz OBEPXUAACDZDNN-IYARVYRRSA-N 1 3 347.478 2.829 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001566908534 1415836895 /nfs/dbraw/zinc/83/68/95/1415836895.db2.gz MTVLZKFJSXJSGP-VZSQWMKGSA-N 1 3 335.536 2.903 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001566908533 1415836953 /nfs/dbraw/zinc/83/69/53/1415836953.db2.gz MTVLZKFJSXJSGP-PXPVJAHISA-N 1 3 335.536 2.903 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]CC/C=C\c2ccccc2)C1 ZINC001567154175 1415955601 /nfs/dbraw/zinc/95/56/01/1415955601.db2.gz BRGZHTGZMKATJG-RVPHRTOXSA-N 1 3 343.515 2.868 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCCC[C@@H]1CCC[N@@H+]1Cc1ccccc1F ZINC001567247262 1416016257 /nfs/dbraw/zinc/01/62/57/1416016257.db2.gz MMDRGOBGSSTJTQ-MJGOQNOKSA-N 1 3 347.478 2.781 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCCC[C@@H]1CCC[N@H+]1Cc1ccccc1F ZINC001567247262 1416016264 /nfs/dbraw/zinc/01/62/64/1416016264.db2.gz MMDRGOBGSSTJTQ-MJGOQNOKSA-N 1 3 347.478 2.781 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1Cc1ccccn1)N(C)C ZINC001567253539 1416023018 /nfs/dbraw/zinc/02/30/18/1416023018.db2.gz FSZKPAPZMBOITE-MOPGFXCFSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@@H]1CCC[N@H+]1Cc1ccccn1)N(C)C ZINC001567253539 1416023023 /nfs/dbraw/zinc/02/30/23/1416023023.db2.gz FSZKPAPZMBOITE-MOPGFXCFSA-N 1 3 346.519 2.529 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[C@H]1CCC[N@@H+]1C/C=C\Cl ZINC001567265658 1416044420 /nfs/dbraw/zinc/04/44/20/1416044420.db2.gz ALXVXNQVGGJTCP-QNLCYANDSA-N 1 3 341.927 2.974 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[C@H]1CCC[N@H+]1C/C=C\Cl ZINC001567265658 1416044424 /nfs/dbraw/zinc/04/44/24/1416044424.db2.gz ALXVXNQVGGJTCP-QNLCYANDSA-N 1 3 341.927 2.974 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@@H]2CCC[C@@H]3CCC[N@@H+]32)cc1F ZINC001567573845 1416193290 /nfs/dbraw/zinc/19/32/90/1416193290.db2.gz NIBYDCNOOQEAFS-MJGOQNOKSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@@H]2CCC[C@@H]3CCC[N@H+]32)cc1F ZINC001567573845 1416193293 /nfs/dbraw/zinc/19/32/93/1416193293.db2.gz NIBYDCNOOQEAFS-MJGOQNOKSA-N 1 3 347.478 2.699 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]CCCc1ccccc1C ZINC001567611456 1416210195 /nfs/dbraw/zinc/21/01/95/1416210195.db2.gz HMWRZVQMJKJBGL-HXUWFJFHSA-N 1 3 345.531 2.850 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)CCC[NH+]1CCCC1 ZINC001567611473 1416210245 /nfs/dbraw/zinc/21/02/45/1416210245.db2.gz IGADXRAGERNNMU-UHFFFAOYSA-N 1 3 335.467 2.558 10 0 EFAEHO O=C(N[C@@H]1CCN(CCCCCF)C1)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001567891039 1416310986 /nfs/dbraw/zinc/31/09/86/1416310986.db2.gz GQOGMGQURUPCDK-AEFFLSMTSA-N 1 3 339.499 2.724 10 0 EFAEHO O=C(N[C@@H]1CCN(CCCCCF)C1)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001567891039 1416310989 /nfs/dbraw/zinc/31/09/89/1416310989.db2.gz GQOGMGQURUPCDK-AEFFLSMTSA-N 1 3 339.499 2.724 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N(C)[C@@H]1CC[N@H+](CCCCCF)C1 ZINC001567921567 1416323946 /nfs/dbraw/zinc/32/39/46/1416323946.db2.gz AWVNOHIRLRMLLV-QZTJIDSGSA-N 1 3 341.515 2.922 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N(C)[C@@H]1CC[N@@H+](CCCCCF)C1 ZINC001567921567 1416323950 /nfs/dbraw/zinc/32/39/50/1416323950.db2.gz AWVNOHIRLRMLLV-QZTJIDSGSA-N 1 3 341.515 2.922 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[N@H+](C)C1)[C@H]1CCN(CCCCC(F)(F)F)C1 ZINC001567944959 1416338981 /nfs/dbraw/zinc/33/89/81/1416338981.db2.gz FFNVBHKCPVRKAQ-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[N@@H+](C)C1)[C@H]1CCN(CCCCC(F)(F)F)C1 ZINC001567944959 1416338986 /nfs/dbraw/zinc/33/89/86/1416338986.db2.gz FFNVBHKCPVRKAQ-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO CN(CC(=O)N1CCC(CC[NH2+]CCCF)CC1)CC(C)(C)C ZINC001568094201 1416407159 /nfs/dbraw/zinc/40/71/59/1416407159.db2.gz UXGRWEWSJADEAL-UHFFFAOYSA-N 1 3 329.504 2.542 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(CC[NH2+]C/C=C/Cl)CC1 ZINC001568097457 1416408909 /nfs/dbraw/zinc/40/89/09/1416408909.db2.gz BGOZDDLROLIPTM-JSNVTFDYSA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(CC[NH2+]CCc2ccccc2)CC1 ZINC001568097779 1416409317 /nfs/dbraw/zinc/40/93/17/1416409317.db2.gz JUJLMIVPJDIWQK-UHFFFAOYSA-N 1 3 345.531 2.788 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CCC2(C[NH+](CC3CC3)C2)CC1 ZINC001568252624 1416456440 /nfs/dbraw/zinc/45/64/40/1416456440.db2.gz NKJHTEOUXQRMSM-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO CCC/C=C/CC[NH+]1CC2(C1)CCN(C(=O)CN(C)CCC)CC2 ZINC001568253998 1416456903 /nfs/dbraw/zinc/45/69/03/1416456903.db2.gz WGMPWBYOQRIOLK-BQYQJAHWSA-N 1 3 335.536 2.999 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@H]2CCCCN2C(=O)Cc2c[nH]cn2)c1 ZINC001568393590 1416511114 /nfs/dbraw/zinc/51/11/14/1416511114.db2.gz OJOOCDZCTWEEQZ-LJQANCHMSA-N 1 3 340.471 2.822 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1CC[NH2+]CCC(F)(F)F ZINC001568401639 1416516419 /nfs/dbraw/zinc/51/64/19/1416516419.db2.gz WGQHURNHWOFVOE-CQSZACIVSA-N 1 3 337.430 2.640 10 0 EFAEHO CCC/C=C\CC[NH2+][C@H](C)[C@H]1CCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001568412057 1416521155 /nfs/dbraw/zinc/52/11/55/1416521155.db2.gz MZCUJBPYDBPOAA-DJAVDHGHSA-N 1 3 332.492 2.915 10 0 EFAEHO CCC/C=C/CC[NH2+][C@H](C)[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001568412059 1416521334 /nfs/dbraw/zinc/52/13/34/1416521334.db2.gz MZCUJBPYDBPOAA-SDKBWNRFSA-N 1 3 332.492 2.915 10 0 EFAEHO CC(C)C[N@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001690005325 1417129149 /nfs/dbraw/zinc/12/91/49/1417129149.db2.gz AFCNPTAXGCGMCV-LJQANCHMSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)C[N@@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001690005325 1417129155 /nfs/dbraw/zinc/12/91/55/1417129155.db2.gz AFCNPTAXGCGMCV-LJQANCHMSA-N 1 3 341.515 2.826 10 0 EFAEHO CN(C(=O)[C@@H]1CC[N@H+](C)C1)C1CCN(CCCCC(F)(F)F)CC1 ZINC001690029940 1417139602 /nfs/dbraw/zinc/13/96/02/1417139602.db2.gz OBWSPFJOGODJNT-CQSZACIVSA-N 1 3 349.441 2.594 10 0 EFAEHO CN(C(=O)[C@@H]1CC[N@@H+](C)C1)C1CCN(CCCCC(F)(F)F)CC1 ZINC001690029940 1417139607 /nfs/dbraw/zinc/13/96/07/1417139607.db2.gz OBWSPFJOGODJNT-CQSZACIVSA-N 1 3 349.441 2.594 10 0 EFAEHO CCCCC[NH2+]C[C@@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001690739522 1417234539 /nfs/dbraw/zinc/23/45/39/1417234539.db2.gz SFUOIUWFPSAJBK-QFBILLFUSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@@H](C[NH2+]CCC2CCCC2)C1 ZINC001690757564 1417238960 /nfs/dbraw/zinc/23/89/60/1417238960.db2.gz LOXAGPCMPQHRSH-OALUTQOASA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N[C@@](C)(CNCC=C(Cl)Cl)C2CC2)CC[N@@H+]1C ZINC001698641936 1417308064 /nfs/dbraw/zinc/30/80/64/1417308064.db2.gz ADGLLASOFPFETM-KFNAQCHYSA-N 1 3 348.318 2.520 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N[C@@](C)(CNCC=C(Cl)Cl)C2CC2)CC[N@H+]1C ZINC001698641936 1417308068 /nfs/dbraw/zinc/30/80/68/1417308068.db2.gz ADGLLASOFPFETM-KFNAQCHYSA-N 1 3 348.318 2.520 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@](C)(C[NH2+]CCC(F)(F)F)C1CC1 ZINC001698642030 1417308139 /nfs/dbraw/zinc/30/81/39/1417308139.db2.gz BAWKFIAKGNVZKY-GOEBONIOSA-N 1 3 349.441 2.686 10 0 EFAEHO CC(C)CC[NH2+]Cc1ccc(CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001698716067 1417318093 /nfs/dbraw/zinc/31/80/93/1417318093.db2.gz LKDZVXYLYHKNOI-KRWDZBQOSA-N 1 3 331.504 2.780 10 0 EFAEHO C[C@H](CC[NH2+]C[C@H]1CCCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001699108027 1417391771 /nfs/dbraw/zinc/39/17/71/1417391771.db2.gz XQRBEQPIVBBFGV-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@H](CC[NH2+]C[C@@H]1CCCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001699108029 1417392137 /nfs/dbraw/zinc/39/21/37/1417392137.db2.gz XQRBEQPIVBBFGV-HUUCEWRRSA-N 1 3 345.478 2.781 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc2ccccc21)C(=O)[C@H]1CCCN1C ZINC001699172358 1417409911 /nfs/dbraw/zinc/40/99/11/1417409911.db2.gz BLLLOWOWEGOQTH-HXUWFJFHSA-N 1 3 339.483 2.872 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C/C=C\CNC(=O)CN1CC[C@H](C)C1 ZINC001699308737 1417418886 /nfs/dbraw/zinc/41/88/86/1417418886.db2.gz OGLIVRRBWLRKJV-MJRGOJFPSA-N 1 3 343.515 2.914 10 0 EFAEHO CC/C=C\CCN1CC[C@H]1CNC(=O)c1ccc(C[NH+](C)C)cc1 ZINC001699632496 1417439967 /nfs/dbraw/zinc/43/99/67/1417439967.db2.gz LTSBZYBZVZQHHL-VOFKWLDRSA-N 1 3 329.488 2.909 10 0 EFAEHO CC/C=C/CC[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001699662557 1417442554 /nfs/dbraw/zinc/44/25/54/1417442554.db2.gz WSLZVHCYVFDYJZ-OVKVCFKUSA-N 1 3 339.499 2.794 10 0 EFAEHO C[NH+]1CCC(CC(=O)N2CCC[C@H]2CNCC=C(Cl)Cl)CC1 ZINC001699759741 1417465944 /nfs/dbraw/zinc/46/59/44/1417465944.db2.gz CCUIRDITGVVSMQ-AWEZNQCLSA-N 1 3 348.318 2.618 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC1(C)CC[NH+](CCCCCF)CC1 ZINC001699775265 1417467350 /nfs/dbraw/zinc/46/73/50/1417467350.db2.gz QCISSIRDTIOOGT-CALCHBBNSA-N 1 3 341.515 2.970 10 0 EFAEHO CN(C)C1(C(=O)N2CCCC[C@@H]2C[NH2+]CCc2ccccc2)CCC1 ZINC001713263578 1418431634 /nfs/dbraw/zinc/43/16/34/1418431634.db2.gz TXNYLWODEMBXOQ-LJQANCHMSA-N 1 3 343.515 2.684 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@@H]1C[NH2+]CCCC1CCCC1 ZINC001713266621 1418433400 /nfs/dbraw/zinc/43/34/00/1418433400.db2.gz DLROKJLTCLJZLP-GOSISDBHSA-N 1 3 332.492 2.893 10 0 EFAEHO CN(CC(=O)N1CC[C@H](C[NH2+]CCCc2ccsc2)C1)C1CCC1 ZINC001713344050 1418482609 /nfs/dbraw/zinc/48/26/09/1418482609.db2.gz HDUFQXGEGYGWTP-QGZVFWFLSA-N 1 3 349.544 2.603 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](C[NH2+]CC/C=C\c2ccccc2)C1)N(C)C ZINC001713354422 1418487857 /nfs/dbraw/zinc/48/78/57/1418487857.db2.gz NHCQFPPYFIEMRB-IHEKOVBBSA-N 1 3 343.515 2.868 10 0 EFAEHO CN(C)C1(C(=O)NCCC[C@H]2CCC[N@@H+]2CCC(F)(F)F)CCC1 ZINC001713432353 1418525569 /nfs/dbraw/zinc/52/55/69/1418525569.db2.gz AWKFZIVLOBGXLB-AWEZNQCLSA-N 1 3 349.441 2.784 10 0 EFAEHO CN(C)C1(C(=O)NCCC[C@H]2CCC[N@H+]2CCC(F)(F)F)CCC1 ZINC001713432353 1418525570 /nfs/dbraw/zinc/52/55/70/1418525570.db2.gz AWKFZIVLOBGXLB-AWEZNQCLSA-N 1 3 349.441 2.784 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@@H](C)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001714749157 1418623300 /nfs/dbraw/zinc/62/33/00/1418623300.db2.gz IQRVUAYJPYMGIK-ZWKOTPCHSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)CCC[NH2+]CCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001714754360 1418626524 /nfs/dbraw/zinc/62/65/24/1418626524.db2.gz GEULPFJDDWHICF-SFHVURJKSA-N 1 3 329.504 2.683 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+]CCC2CC2)C2CCCCC2)CCC1 ZINC001714973964 1418644194 /nfs/dbraw/zinc/64/41/94/1418644194.db2.gz HGXGADYZUGWFRK-GOSISDBHSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@H](C(=O)NC/C=C/C[NH2+]Cc1ccc2ccccc2c1)N(C)C ZINC001715832196 1418685752 /nfs/dbraw/zinc/68/57/52/1418685752.db2.gz CVTMQRLXTKZGHO-AQKVLALTSA-N 1 3 339.483 2.942 10 0 EFAEHO C[C@H](CC[NH2+]Cc1cc2ccccc2o1)NC(=O)CN1CC[C@H](C)C1 ZINC001716174515 1418714002 /nfs/dbraw/zinc/71/40/02/1418714002.db2.gz TYSQRWSSVJRVPP-JKSUJKDBSA-N 1 3 343.471 2.759 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@@H](C)NC(=O)Cc1nc[nH]c1C ZINC001716191959 1418720596 /nfs/dbraw/zinc/72/05/96/1418720596.db2.gz KFGNBTPGWMFRIG-CQSZACIVSA-N 1 3 328.460 2.508 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(C)ccc1C)C(=O)C1(N(C)C)CCC1 ZINC001716220462 1418726223 /nfs/dbraw/zinc/72/62/23/1418726223.db2.gz FCRONZLNLBSLEF-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc2ccccc21)C(=O)CN1CCCC1 ZINC001716253936 1418741450 /nfs/dbraw/zinc/74/14/50/1418741450.db2.gz NITSBYMLZZGXKW-UHFFFAOYSA-N 1 3 339.483 2.874 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C\CNCc2cc(F)ccc2C)CC[N@@H+]1C ZINC001716294839 1418756226 /nfs/dbraw/zinc/75/62/26/1418756226.db2.gz CTMAXKJZRMNVJH-ZYHOBAKYSA-N 1 3 347.478 2.626 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C\CNCc2cc(F)ccc2C)CC[N@H+]1C ZINC001716294839 1418756229 /nfs/dbraw/zinc/75/62/29/1418756229.db2.gz CTMAXKJZRMNVJH-ZYHOBAKYSA-N 1 3 347.478 2.626 10 0 EFAEHO CN(CC(=O)NC/C=C/C[NH2+][C@H]1CCc2ccc(F)cc21)C1CCC1 ZINC001716306010 1418762631 /nfs/dbraw/zinc/76/26/31/1418762631.db2.gz MQIPDOTXKQPTJJ-PHXNAMCJSA-N 1 3 345.462 2.559 10 0 EFAEHO CC[C@@H]([NH2+]C/C=C\CNC(=O)[C@H]1CCCN1C)c1ccc(F)cc1 ZINC001716330692 1418778974 /nfs/dbraw/zinc/77/89/74/1418778974.db2.gz YQUSFIUOQMUMLQ-IFOCYFHOSA-N 1 3 333.451 2.633 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC/C=C\C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001716343615 1418788154 /nfs/dbraw/zinc/78/81/54/1418788154.db2.gz GTFLQYJMQLBEBJ-KYVUIXNKSA-N 1 3 333.520 2.561 10 0 EFAEHO CC(C)(C)CC[NH2+]C/C=C/CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001716343551 1418788214 /nfs/dbraw/zinc/78/82/14/1418788214.db2.gz FONGKPQDHSSVCD-IHHMQQGQSA-N 1 3 341.515 2.897 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C/C[NH2+]CCc1ccccc1F ZINC001716378060 1418860354 /nfs/dbraw/zinc/86/03/54/1418860354.db2.gz FZDZLEIEBQDJLD-OVKVCFKUSA-N 1 3 347.478 2.505 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C\CNC(=O)C[NH+]1[C@H](C)CC[C@H]1C ZINC001716378670 1418860577 /nfs/dbraw/zinc/86/05/77/1418860577.db2.gz KYGNKYVMDGWNSC-OSNZYPHYSA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001716440184 1418883404 /nfs/dbraw/zinc/88/34/04/1418883404.db2.gz RDINHEJKPVZJMU-KRWDZBQOSA-N 1 3 331.504 2.506 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCCC[C@H]1C[NH2+]C/C=C/Cl)CC(C)(C)C ZINC001716518701 1418904714 /nfs/dbraw/zinc/90/47/14/1418904714.db2.gz RROWHYXCFKIQQZ-UIOUNXJESA-N 1 3 343.943 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+]Cc1ccc(Cl)s1 ZINC001716586616 1418919085 /nfs/dbraw/zinc/91/90/85/1418919085.db2.gz ATMOTJBXOHXBCR-UHFFFAOYSA-N 1 3 331.913 2.680 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@H]1C[NH2+]CC/C=C\c1ccccc1 ZINC001716785051 1419007471 /nfs/dbraw/zinc/00/74/71/1419007471.db2.gz RJPHNZGIMJTNOH-JAFJLQOXSA-N 1 3 338.455 2.636 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@H]1C[NH2+]CC/C=C/c1ccccc1 ZINC001716785052 1419007523 /nfs/dbraw/zinc/00/75/23/1419007523.db2.gz RJPHNZGIMJTNOH-QFXLTXBMSA-N 1 3 338.455 2.636 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H]1C[NH2+]CCCc1ccccc1)N(C)C ZINC001716788785 1419009492 /nfs/dbraw/zinc/00/94/92/1419009492.db2.gz VRKSFQRZRBDGKP-VQTJNVASSA-N 1 3 345.531 2.786 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@@H]1CN(C(=O)CN2CCC(C)CC2)C[C@@H]1C ZINC001716992059 1419129635 /nfs/dbraw/zinc/12/96/35/1419129635.db2.gz LNTZMTBPUCJCBR-ZYHOBAKYSA-N 1 3 335.536 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]C/C=C\c2ccccc2)C1 ZINC001716996871 1419133173 /nfs/dbraw/zinc/13/31/73/1419133173.db2.gz FUCSSZJSARVBCB-POQYLXETSA-N 1 3 343.515 2.724 10 0 EFAEHO CCCCCC[N@H+]1C[C@H]2CN(C(=O)CN3[C@@H](C)CC[C@@H]3C)C[C@H]2C1 ZINC001717015248 1419150722 /nfs/dbraw/zinc/15/07/22/1419150722.db2.gz XFNHEOJOBMOXHP-CADBVGFASA-N 1 3 335.536 2.830 10 0 EFAEHO CCCCCC[N@@H+]1C[C@H]2CN(C(=O)CN3[C@@H](C)CC[C@@H]3C)C[C@H]2C1 ZINC001717015248 1419150724 /nfs/dbraw/zinc/15/07/24/1419150724.db2.gz XFNHEOJOBMOXHP-CADBVGFASA-N 1 3 335.536 2.830 10 0 EFAEHO CCCC[NH2+]CC[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001717110577 1419215218 /nfs/dbraw/zinc/21/52/18/1419215218.db2.gz GKSJRTDQDRATMV-QGZVFWFLSA-N 1 3 331.504 2.990 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[N@H+](CC3=CCCCC3)CC2)CCC1 ZINC001717195463 1419257560 /nfs/dbraw/zinc/25/75/60/1419257560.db2.gz KAFNYZFQZQSIKI-GOSISDBHSA-N 1 3 333.520 2.942 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[N@@H+](CC3=CCCCC3)CC2)CCC1 ZINC001717195463 1419257561 /nfs/dbraw/zinc/25/75/61/1419257561.db2.gz KAFNYZFQZQSIKI-GOSISDBHSA-N 1 3 333.520 2.942 10 0 EFAEHO CCCCCC[NH2+][C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@H]1C ZINC001717285421 1419307821 /nfs/dbraw/zinc/30/78/21/1419307821.db2.gz CJERAQGYKKFJNR-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN1CCc2ccccc2[C@@H]1CNC(=O)CCCC[NH+](C)C ZINC001717344626 1419343768 /nfs/dbraw/zinc/34/37/68/1419343768.db2.gz VCNJKQMYVXXHFU-IBGZPJMESA-N 1 3 331.504 2.844 10 0 EFAEHO CN(CC(C)(C)C[NH2+]C/C=C/c1ccccc1)C(=O)Cc1c[nH]cn1 ZINC001717456753 1419401833 /nfs/dbraw/zinc/40/18/33/1419401833.db2.gz JQYOMVVEPPWKHP-JXMROGBWSA-N 1 3 340.471 2.740 10 0 EFAEHO CN(CC(C)(C)C[NH2+]C/C=C\c1ccccc1)C(=O)Cc1c[nH]cn1 ZINC001717456754 1419401983 /nfs/dbraw/zinc/40/19/83/1419401983.db2.gz JQYOMVVEPPWKHP-YFHOEESVSA-N 1 3 340.471 2.740 10 0 EFAEHO C[C@H](CNC(=O)CCCC[NH+](C)C)N(C)[C@@H]1CCc2c1cccc2F ZINC001717494796 1419416798 /nfs/dbraw/zinc/41/67/98/1419416798.db2.gz MBGPGYWKWXHIGW-DNVCBOLYSA-N 1 3 349.494 2.981 10 0 EFAEHO CC(C)=CCN1C[C@H](NC(=O)[C@@H](C(C)C)[NH+]2CCCC2)C(C)(C)C1 ZINC001717589907 1419460379 /nfs/dbraw/zinc/46/03/79/1419460379.db2.gz TTYJKSNLEVHFGH-ZWKOTPCHSA-N 1 3 335.536 2.900 10 0 EFAEHO CC(C)CCC[NH2+][C@@H]1C[C@@H](C)N(C(=O)CN(C)CC(C)(C)C)C1 ZINC001717821110 1419557275 /nfs/dbraw/zinc/55/72/75/1419557275.db2.gz AMNYQFFWWGCBOS-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)CC(C)(C)C)C[C@H]21 ZINC001717850792 1419578808 /nfs/dbraw/zinc/57/88/08/1419578808.db2.gz YQHXZYXFRXIUTN-KZNAEPCWSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]CCc1cccs1)C(C)(C)C)N(C)C ZINC001717971886 1419635448 /nfs/dbraw/zinc/63/54/48/1419635448.db2.gz VELJKFKFQLTHEH-CVEARBPZSA-N 1 3 339.549 2.751 10 0 EFAEHO CN(C)C1(C(=O)NCC2=CC[N@H+](C[C@@H]3CC[C@@H]4C[C@@H]4C3)CC2)CCC1 ZINC001718022524 1419662184 /nfs/dbraw/zinc/66/21/84/1419662184.db2.gz YAOWNWYRRHMRHH-QRVBRYPASA-N 1 3 345.531 2.655 10 0 EFAEHO CN(C)C1(C(=O)NCC2=CC[N@@H+](C[C@@H]3CC[C@@H]4C[C@@H]4C3)CC2)CCC1 ZINC001718022524 1419662187 /nfs/dbraw/zinc/66/21/87/1419662187.db2.gz YAOWNWYRRHMRHH-QRVBRYPASA-N 1 3 345.531 2.655 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CCCC[C@H]1C[NH2+]CCC(C)(C)C ZINC001722953871 1424381567 /nfs/dbraw/zinc/38/15/67/1424381567.db2.gz LIWCIJCYISVWSW-JKSUJKDBSA-N 1 3 334.508 2.961 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CCCC[C@@H]1C[NH2+]CCC(C)(C)C ZINC001722953862 1424381803 /nfs/dbraw/zinc/38/18/03/1424381803.db2.gz LIWCIJCYISVWSW-CVEARBPZSA-N 1 3 334.508 2.961 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)[C@H]1CCCN1C)c1ccc(Cl)cc1 ZINC001723093003 1424421226 /nfs/dbraw/zinc/42/12/26/1424421226.db2.gz RMNRROXZFZTBSQ-WMLDXEAASA-N 1 3 337.895 2.933 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[NH2+]Cc2ccc(Cl)s2)C1 ZINC001723123720 1424429779 /nfs/dbraw/zinc/42/97/79/1424429779.db2.gz PVMBTFRKSGBOMJ-ZDUSSCGKSA-N 1 3 343.924 2.681 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+]Cc1sccc1Cl)N(C)C ZINC001723181206 1424444272 /nfs/dbraw/zinc/44/42/72/1424444272.db2.gz IKCCLPRRQPKKBZ-HNNXBMFYSA-N 1 3 345.940 2.926 10 0 EFAEHO CN(CCC[NH2+]Cc1cc2ccccc2s1)C(=O)CN1CCCC1 ZINC001723195047 1424448786 /nfs/dbraw/zinc/44/87/86/1424448786.db2.gz WLBKUVLVLMSVPH-UHFFFAOYSA-N 1 3 345.512 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+][C@H](C)c1cc(F)ccc1F ZINC001723205582 1424451348 /nfs/dbraw/zinc/45/13/48/1424451348.db2.gz YLEIRWOGGDAWKS-CQSZACIVSA-N 1 3 341.446 2.804 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[NH2+][C@H]1CCc2ccccc21 ZINC001723203512 1424451502 /nfs/dbraw/zinc/45/15/02/1424451502.db2.gz KXFWZCUNLXMMKX-VQTJNVASSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)(C(=O)N[C@@H](C[NH2+]CCC(F)(F)F)C1CC1)N1CCCCC1 ZINC001723300739 1424461766 /nfs/dbraw/zinc/46/17/66/1424461766.db2.gz MHEGPEXTBLRHBT-AWEZNQCLSA-N 1 3 349.441 2.688 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(CCN(C(=O)CN(C)CCC)C2)CC1 ZINC001723699682 1424562156 /nfs/dbraw/zinc/56/21/56/1424562156.db2.gz NOUSSDXONMCGNO-SREVYHEPSA-N 1 3 335.536 2.999 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@]2(CCN(C(=O)CN3CCC(C)CC3)C2)C1 ZINC001723721774 1424569851 /nfs/dbraw/zinc/56/98/51/1424569851.db2.gz PXUMADSLCWGJBQ-HXUWFJFHSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCC[N@H+]1CC[C@@]2(CCN(C(=O)CN3CCC(C)CC3)C2)C1 ZINC001723721774 1424569856 /nfs/dbraw/zinc/56/98/56/1424569856.db2.gz PXUMADSLCWGJBQ-HXUWFJFHSA-N 1 3 335.536 2.833 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CC[C@]2(CCN(Cc3ccsc3)C2)C1 ZINC001723727447 1424570713 /nfs/dbraw/zinc/57/07/13/1424570713.db2.gz RXGIXZJUDOKSIJ-IBGZPJMESA-N 1 3 349.544 2.904 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@H]2C[NH2+]C/C=C/c2ccccc2)CCC1 ZINC001723905196 1424608035 /nfs/dbraw/zinc/60/80/35/1424608035.db2.gz CVLAFQLRIRAEFI-NJGYHNCTSA-N 1 3 341.499 2.765 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1C(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001723981653 1424616361 /nfs/dbraw/zinc/61/63/61/1424616361.db2.gz JRQMPDNWQMUZIR-UONOGXRCSA-N 1 3 348.318 2.760 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1C(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001723981653 1424616366 /nfs/dbraw/zinc/61/63/66/1424616366.db2.gz JRQMPDNWQMUZIR-UONOGXRCSA-N 1 3 348.318 2.760 10 0 EFAEHO CC/C=C\CC[NH+]1CCC(C)(CNC(=O)Cc2nc[nH]c2C)CC1 ZINC001724301890 1424726010 /nfs/dbraw/zinc/72/60/10/1424726010.db2.gz IBYCNDOMDXWRJS-WAYWQWQTSA-N 1 3 332.492 2.835 10 0 EFAEHO C[C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@@H]1C[NH2+]CCC1CC1 ZINC001724609770 1424828889 /nfs/dbraw/zinc/82/88/89/1424828889.db2.gz RXLGVZJRLAHDMP-UZLBHIALSA-N 1 3 343.515 2.846 10 0 EFAEHO C[C@@H](C(=O)N(CCNCCF)Cc1ccccc1)[NH+]1CCCCCC1 ZINC001724616583 1424840407 /nfs/dbraw/zinc/84/04/07/1424840407.db2.gz GGQNIZATEBECKN-SFHVURJKSA-N 1 3 349.494 2.839 10 0 EFAEHO CN(CC(=O)N1CC[C@H](CC[NH2+]Cc2ccccc2)C1)CC(C)(C)C ZINC001724717472 1424936443 /nfs/dbraw/zinc/93/64/43/1424936443.db2.gz CYWFKEZKEVUSSJ-IBGZPJMESA-N 1 3 345.531 2.993 10 0 EFAEHO CC(C)C[NH2+]CC[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001724745116 1424974402 /nfs/dbraw/zinc/97/44/02/1424974402.db2.gz FDSRAVHTAZBWQH-QGZVFWFLSA-N 1 3 331.504 2.846 10 0 EFAEHO CCC[NH2+]C[C@H]1CC[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001724749980 1424979321 /nfs/dbraw/zinc/97/93/21/1424979321.db2.gz AAIVZEGOJPYADU-BXWFABGCSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)N1CC[NH+](CCCCCNC(=O)C2CC3C=CC2C3)CC1 ZINC001725011280 1425223434 /nfs/dbraw/zinc/22/34/34/1425223434.db2.gz AIDWLZWSIVPOJB-FHWLQOOXSA-N 1 3 333.520 2.511 10 0 EFAEHO CC(C)[NH+]1CCN(CCCCCNC(=O)C2CC3C=CC2C3)CC1 ZINC001725011280 1425223438 /nfs/dbraw/zinc/22/34/38/1425223438.db2.gz AIDWLZWSIVPOJB-FHWLQOOXSA-N 1 3 333.520 2.511 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([C@H]2CC[N@H+](CC=C(C)C)C2)C1 ZINC001725054974 1425265309 /nfs/dbraw/zinc/26/53/09/1425265309.db2.gz CKEDZWYYFWFPGB-OALUTQOASA-N 1 3 335.536 2.855 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([C@H]2CC[N@@H+](CC=C(C)C)C2)C1 ZINC001725054974 1425265313 /nfs/dbraw/zinc/26/53/13/1425265313.db2.gz CKEDZWYYFWFPGB-OALUTQOASA-N 1 3 335.536 2.855 10 0 EFAEHO CCCCC[N@H+](C)[C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001725181779 1425361622 /nfs/dbraw/zinc/36/16/22/1425361622.db2.gz PZUJNXYCMLYYSE-QAPCUYQASA-N 1 3 329.504 2.826 10 0 EFAEHO CCCCC[N@@H+](C)[C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001725181779 1425361628 /nfs/dbraw/zinc/36/16/28/1425361628.db2.gz PZUJNXYCMLYYSE-QAPCUYQASA-N 1 3 329.504 2.826 10 0 EFAEHO Cc1ccc(C[NH2+]CCC[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1F ZINC001725412495 1425556699 /nfs/dbraw/zinc/55/66/99/1425556699.db2.gz DCSFLCOTIDHPDC-NVXWUHKLSA-N 1 3 349.494 2.850 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+]Cc1cccc(Cl)c1 ZINC001725414158 1425558602 /nfs/dbraw/zinc/55/86/02/1425558602.db2.gz PIBURAUSHIZHMC-ZDUSSCGKSA-N 1 3 348.878 2.989 10 0 EFAEHO CC(C)=CC[NH2+][C@@H](C)CN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001725508179 1425627293 /nfs/dbraw/zinc/62/72/93/1425627293.db2.gz WSYOFTBBFODTIM-MAUKXSAKSA-N 1 3 327.488 2.602 10 0 EFAEHO C[C@@H]1[C@H]([NH2+]CC/C=C/c2ccccc2)CCN1C(=O)Cc1c[nH]cn1 ZINC001725569381 1425655534 /nfs/dbraw/zinc/65/55/34/1425655534.db2.gz RJEDHTZGKYYNEJ-DTDSVVEQSA-N 1 3 338.455 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2cccc(F)c2)[C@@H]1C ZINC001725602769 1425690210 /nfs/dbraw/zinc/69/02/10/1425690210.db2.gz GHRIJOJYCKQARJ-QFBILLFUSA-N 1 3 349.494 2.678 10 0 EFAEHO C[C@@H](NC(=O)CCCC[NH+](C)C)C1CCN(Cc2cccnc2)CC1 ZINC001725763840 1425829794 /nfs/dbraw/zinc/82/97/94/1425829794.db2.gz KJFCVRQGVAWJPY-QGZVFWFLSA-N 1 3 346.519 2.530 10 0 EFAEHO CC/C=C/CC[N@H+]1CC=C(CNC(=O)[C@H]2CCCCN2CC)CC1 ZINC001725828573 1425893202 /nfs/dbraw/zinc/89/32/02/1425893202.db2.gz FPENBAFXDYKHOT-ZMBJWTFHSA-N 1 3 333.520 2.965 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC=C(CNC(=O)[C@H]2CCCCN2CC)CC1 ZINC001725828573 1425893208 /nfs/dbraw/zinc/89/32/08/1425893208.db2.gz FPENBAFXDYKHOT-ZMBJWTFHSA-N 1 3 333.520 2.965 10 0 EFAEHO Cc1ccc(CC[N@H+]2CC=C(CNC(=O)CN(C)C(C)C)CC2)cc1 ZINC001725829753 1425896248 /nfs/dbraw/zinc/89/62/48/1425896248.db2.gz MPYUOZRMUPQRPS-UHFFFAOYSA-N 1 3 343.515 2.626 10 0 EFAEHO Cc1ccc(CC[N@@H+]2CC=C(CNC(=O)CN(C)C(C)C)CC2)cc1 ZINC001725829753 1425896251 /nfs/dbraw/zinc/89/62/51/1425896251.db2.gz MPYUOZRMUPQRPS-UHFFFAOYSA-N 1 3 343.515 2.626 10 0 EFAEHO COc1ccc(Br)cc1CN1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723901779 715006397 /nfs/dbraw/zinc/00/63/97/715006397.db2.gz KDOKYDYOYHQGFM-VXGBXAGGSA-N 1 3 327.266 2.874 10 0 EFAEHO CN1CC[C@]2(CC[N@H+](C[C@@H](O)c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000292227724 715834227 /nfs/dbraw/zinc/83/42/27/715834227.db2.gz VKDBJJGWNPZDNN-CVEARBPZSA-N 1 3 328.378 2.766 10 0 EFAEHO CN1CC[C@]2(CC[N@@H+](C[C@@H](O)c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000292227724 715834234 /nfs/dbraw/zinc/83/42/34/715834234.db2.gz VKDBJJGWNPZDNN-CVEARBPZSA-N 1 3 328.378 2.766 10 0 EFAEHO FC(F)(F)C(F)(F)OCCN[C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925732193 716716916 /nfs/dbraw/zinc/71/69/16/716716916.db2.gz WQHWLOLMLLRDBK-VXGBXAGGSA-N 1 3 330.341 2.916 10 0 EFAEHO CCS(=O)(=O)c1ccccc1CC[NH2+][C@@H]1C[C@H](N)CC(C)(C)C1 ZINC000925832074 719451760 /nfs/dbraw/zinc/45/17/60/719451760.db2.gz FOMZLTDOZBZCKQ-JKSUJKDBSA-N 1 3 338.517 2.518 10 0 EFAEHO CCS(=O)(=O)c1ccccc1CCN[C@@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925832074 719451762 /nfs/dbraw/zinc/45/17/62/719451762.db2.gz FOMZLTDOZBZCKQ-JKSUJKDBSA-N 1 3 338.517 2.518 10 0 EFAEHO C[C@H](NC[C@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1ccc(Cl)s1 ZINC000925850969 719818884 /nfs/dbraw/zinc/81/88/84/719818884.db2.gz AUPNTROULMPIPW-WDEREUQCSA-N 1 3 328.865 2.737 10 0 EFAEHO CC[C@@H](C)[C@@H](N)C(=O)Nc1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000183039245 720206798 /nfs/dbraw/zinc/20/67/98/720206798.db2.gz GDWVYAKMNXVSBU-RDTXWAMCSA-N 1 3 332.492 2.529 10 0 EFAEHO COc1ccc(CCN[C@H]2C[C@@H]([NH3+])C23CCC3)cc1OC(F)F ZINC000925557151 720390203 /nfs/dbraw/zinc/39/02/03/720390203.db2.gz KISYJCWWWPWOKZ-CABCVRRESA-N 1 3 326.387 2.699 10 0 EFAEHO CC1(C)[C@H]2NCCC[C@H]2[C@@H]1[NH2+]CCCN(C(=O)C1CCC1)C1CC1 ZINC000925596084 720518430 /nfs/dbraw/zinc/51/84/30/720518430.db2.gz IPVIMRGMIOEVNI-SQNIBIBYSA-N 1 3 333.520 2.534 10 0 EFAEHO c1cc(N2CCC(CNCc3nnc(C4CC4)s3)CC2)cc[nH+]1 ZINC000893304526 720526050 /nfs/dbraw/zinc/52/60/50/720526050.db2.gz MUXXWKGEQMEFCZ-UHFFFAOYSA-N 1 3 329.473 2.817 10 0 EFAEHO CC1(C)C[C@@H]([NH3+])C[C@H](NCCOc2cccc(C(F)(F)F)n2)C1 ZINC000925628420 720627509 /nfs/dbraw/zinc/62/75/09/720627509.db2.gz FRQGESGYKLKMEL-RYUDHWBXSA-N 1 3 331.382 2.975 10 0 EFAEHO FC(F)C(F)(F)COCCN[C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925652826 720753286 /nfs/dbraw/zinc/75/32/86/720753286.db2.gz UELHYCGIRDZODO-QWHCGFSZSA-N 1 3 326.378 2.661 10 0 EFAEHO FC(F)C(F)(F)COCCN[C@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925652825 720753349 /nfs/dbraw/zinc/75/33/49/720753349.db2.gz UELHYCGIRDZODO-OLZOCXBDSA-N 1 3 326.378 2.661 10 0 EFAEHO CC1(C)C[C@H]([NH3+])C[C@@H](NC[C@H](O)c2cccc(Br)c2)C1 ZINC000925661114 720818688 /nfs/dbraw/zinc/81/86/88/720818688.db2.gz SJLFJOVHQARHQV-KFWWJZLASA-N 1 3 341.293 2.978 10 0 EFAEHO CC1(C)C[C@@H](N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)C[C@@H]([NH3+])C1 ZINC000925675614 720866359 /nfs/dbraw/zinc/86/63/59/720866359.db2.gz XAEUXIXTMKACGV-MCIONIFRSA-N 1 3 349.441 2.816 10 0 EFAEHO CCOC(=O)CC(C)(C)CCN1CCC([N@@H+]2CCCOCC2)CC1 ZINC000931287289 721008119 /nfs/dbraw/zinc/00/81/19/721008119.db2.gz PHGJAAAEGOIYFL-UHFFFAOYSA-N 1 3 340.508 2.543 10 0 EFAEHO CCOC(=O)CC(C)(C)CCN1CCC([N@H+]2CCCOCC2)CC1 ZINC000931287289 721008124 /nfs/dbraw/zinc/00/81/24/721008124.db2.gz PHGJAAAEGOIYFL-UHFFFAOYSA-N 1 3 340.508 2.543 10 0 EFAEHO COC(=O)[C@@H]1[C@@H](CNCc2cccc(C[N@H+](C)C(C)C)c2)C1(F)F ZINC000894206615 721207681 /nfs/dbraw/zinc/20/76/81/721207681.db2.gz HHGBIPMIKIVNTN-CVEARBPZSA-N 1 3 340.414 2.671 10 0 EFAEHO COC(=O)[C@@H]1[C@@H](CNCc2cccc(C[N@@H+](C)C(C)C)c2)C1(F)F ZINC000894206615 721207686 /nfs/dbraw/zinc/20/76/86/721207686.db2.gz HHGBIPMIKIVNTN-CVEARBPZSA-N 1 3 340.414 2.671 10 0 EFAEHO COC(=O)[C@@H]1[C@H](CNCc2cccc(C[N@H+](C)C(C)C)c2)C1(F)F ZINC000894206616 721207710 /nfs/dbraw/zinc/20/77/10/721207710.db2.gz HHGBIPMIKIVNTN-HOTGVXAUSA-N 1 3 340.414 2.671 10 0 EFAEHO COC(=O)[C@@H]1[C@H](CNCc2cccc(C[N@@H+](C)C(C)C)c2)C1(F)F ZINC000894206616 721207715 /nfs/dbraw/zinc/20/77/15/721207715.db2.gz HHGBIPMIKIVNTN-HOTGVXAUSA-N 1 3 340.414 2.671 10 0 EFAEHO CCN1CCN(C[C@H](C)C[NH2+][C@@H](C)c2ccnn2CC2CCC2)CC1 ZINC000924953593 721865079 /nfs/dbraw/zinc/86/50/79/721865079.db2.gz RFJAMAYPIOXTFU-MSOLQXFVSA-N 1 3 347.551 2.607 10 0 EFAEHO CC[NH+](CC)CCCC1CCN(C[C@@H]2[C@H](C(=O)OC)C2(F)F)CC1 ZINC000894436138 722736923 /nfs/dbraw/zinc/73/69/23/722736923.db2.gz DIKKHWWNZXJION-HZPDHXFCSA-N 1 3 346.462 2.875 10 0 EFAEHO COCC1([NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)CCOCC1 ZINC000894854935 722897674 /nfs/dbraw/zinc/89/76/74/722897674.db2.gz KUDWCLLBSZTSBJ-ZCNNSNEGSA-N 1 3 344.499 2.825 10 0 EFAEHO C[C@H](CCNC[C@H]1CC(F)(F)CN1C(=O)OC(C)(C)C)[NH+](C)C ZINC000895293045 723997377 /nfs/dbraw/zinc/99/73/77/723997377.db2.gz IVGMASXODDHWFN-CHWSQXEVSA-N 1 3 335.439 2.561 10 0 EFAEHO C[C@H](CC[NH2+]C[C@H]1CC(F)(F)CN1C(=O)OC(C)(C)C)N(C)C ZINC000895293045 723997379 /nfs/dbraw/zinc/99/73/79/723997379.db2.gz IVGMASXODDHWFN-CHWSQXEVSA-N 1 3 335.439 2.561 10 0 EFAEHO COC(=O)[C@H]1C[C@@H]([NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C1 ZINC000895314064 724024717 /nfs/dbraw/zinc/02/47/17/724024717.db2.gz IURMAHIKLLSMLI-FKSLSLAPSA-N 1 3 328.456 2.581 10 0 EFAEHO COC(=O)[C@H]1C[C@@H](N[C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1 ZINC000895314064 724024719 /nfs/dbraw/zinc/02/47/19/724024719.db2.gz IURMAHIKLLSMLI-FKSLSLAPSA-N 1 3 328.456 2.581 10 0 EFAEHO COC(=O)[C@H]1C[C@@H](N[C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1 ZINC000895314064 724024724 /nfs/dbraw/zinc/02/47/24/724024724.db2.gz IURMAHIKLLSMLI-FKSLSLAPSA-N 1 3 328.456 2.581 10 0 EFAEHO COC(=O)[C@H]1C[C@H]([NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C1 ZINC000895349791 724061207 /nfs/dbraw/zinc/06/12/07/724061207.db2.gz IURMAHIKLLSMLI-OYSTVDSJSA-N 1 3 328.456 2.581 10 0 EFAEHO COC(=O)[C@H]1C[C@H](N[C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1 ZINC000895349791 724061212 /nfs/dbraw/zinc/06/12/12/724061212.db2.gz IURMAHIKLLSMLI-OYSTVDSJSA-N 1 3 328.456 2.581 10 0 EFAEHO COC(=O)[C@H]1C[C@H](N[C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1 ZINC000895349791 724061216 /nfs/dbraw/zinc/06/12/16/724061216.db2.gz IURMAHIKLLSMLI-OYSTVDSJSA-N 1 3 328.456 2.581 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC[N@@H+]1C ZINC000918861061 728936346 /nfs/dbraw/zinc/93/63/46/728936346.db2.gz IBOGFWRANDLTSZ-QRQLOZEOSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC[N@H+]1C ZINC000918861061 728936350 /nfs/dbraw/zinc/93/63/50/728936350.db2.gz IBOGFWRANDLTSZ-QRQLOZEOSA-N 1 3 344.503 2.605 10 0 EFAEHO C[NH+](C)C1CCC(NC(=O)c2ccc(NC3=NCCC3)cc2)CC1 ZINC000911190942 727506882 /nfs/dbraw/zinc/50/68/82/727506882.db2.gz UPDDBIHLRSCDNU-UHFFFAOYSA-N 1 3 328.460 2.893 10 0 EFAEHO C[C@@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000913099544 727782197 /nfs/dbraw/zinc/78/21/97/727782197.db2.gz MZSVFQBJGHRXME-LCLWPZTBSA-N 1 3 343.515 2.744 10 0 EFAEHO C[C@@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000913099544 727782199 /nfs/dbraw/zinc/78/21/99/727782199.db2.gz MZSVFQBJGHRXME-LCLWPZTBSA-N 1 3 343.515 2.744 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3CC=CC34CCCC4)CC2)CC1 ZINC000913205093 727798511 /nfs/dbraw/zinc/79/85/11/727798511.db2.gz TWIXDUHAPXOOMY-UHFFFAOYSA-N 1 3 345.531 2.894 10 0 EFAEHO C[NH+]1C[C@@]2(C)CN(C(=O)c3cccc(CN4CCCC4)c3)C[C@]2(C)C1 ZINC000913290093 727817220 /nfs/dbraw/zinc/81/72/20/727817220.db2.gz OGPJWQZOTRLVCF-SFTDATJTSA-N 1 3 341.499 2.696 10 0 EFAEHO COC[C@@H]1CN(Cc2ccc(Cl)c(F)c2)CC12CC[NH2+]CC2 ZINC000169789801 728404126 /nfs/dbraw/zinc/40/41/26/728404126.db2.gz LHRRYIXXRXFCHE-AWEZNQCLSA-N 1 3 326.843 2.927 10 0 EFAEHO COC[C@H]1C[N@@H+](C2CCC2)CC12CCN(Cc1ccncc1)CC2 ZINC000169782612 728404844 /nfs/dbraw/zinc/40/48/44/728404844.db2.gz HDLGOAARSDQKLO-GOSISDBHSA-N 1 3 329.488 2.795 10 0 EFAEHO COC[C@H]1C[N@H+](C2CCC2)CC12CCN(Cc1ccncc1)CC2 ZINC000169782612 728404847 /nfs/dbraw/zinc/40/48/47/728404847.db2.gz HDLGOAARSDQKLO-GOSISDBHSA-N 1 3 329.488 2.795 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCN2CCCCc2ccccc2)C1 ZINC001569379763 1085159542 /nfs/dbraw/zinc/15/95/42/1085159542.db2.gz IFNZNTBYMLBUNS-PMACEKPBSA-N 1 3 343.515 2.542 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCN2CCCCc2ccccc2)C1 ZINC001569379763 1085159549 /nfs/dbraw/zinc/15/95/49/1085159549.db2.gz IFNZNTBYMLBUNS-PMACEKPBSA-N 1 3 343.515 2.542 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CCCc2ccccc2)CC1 ZINC001569432152 1085200964 /nfs/dbraw/zinc/20/09/64/1085200964.db2.gz NOPRQXGUGVIGRG-HDICACEKSA-N 1 3 343.515 2.730 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CCC2=CCCCC2)CC1 ZINC001569431877 1085201573 /nfs/dbraw/zinc/20/15/73/1085201573.db2.gz GRLOXRSADSRCCL-CALCHBBNSA-N 1 3 333.520 2.988 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H]2C[NH2+]CCCc2ccccc2)C1 ZINC001569554907 1085370438 /nfs/dbraw/zinc/37/04/38/1085370438.db2.gz CVCGINIALNCXDX-AZUAARDMSA-N 1 3 343.515 2.542 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCC[C@@H]2C[NH2+]CCC2CC2)C1 ZINC001569556273 1085372469 /nfs/dbraw/zinc/37/24/69/1085372469.db2.gz ZNDPBYJMDVWBTF-APWZRJJASA-N 1 3 339.499 2.580 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC1(C)CCN(Cc2ccsc2)CC1 ZINC001569577439 1085396271 /nfs/dbraw/zinc/39/62/71/1085396271.db2.gz RYPXPWSOWISMSH-UHFFFAOYSA-N 1 3 337.533 2.951 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H](NC(=O)C(C)(C)N1CCCC1)C1CCCC1 ZINC001569606366 1085431740 /nfs/dbraw/zinc/43/17/40/1085431740.db2.gz FFOLVONHLLDBFD-WBVHZDCISA-N 1 3 341.515 2.874 10 0 EFAEHO CN(CC(=O)N1CC[C@](C)(C[NH2+]CCC2CCCC2)C1)C1CCC1 ZINC001569672665 1085504534 /nfs/dbraw/zinc/50/45/34/1085504534.db2.gz MQBIZDCYEBAZAU-HXUWFJFHSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@](C)(C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001569683453 1085514989 /nfs/dbraw/zinc/51/49/89/1085514989.db2.gz KGYZGPDOAVJRIZ-HZXPXBNSSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@](C)(C[NH2+]CCCC2CCC2)C1)N(C)C ZINC001569683762 1085515097 /nfs/dbraw/zinc/51/50/97/1085515097.db2.gz QOIAIMYDKKNYHX-UYAOXDASSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@](C)(C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001569683452 1085515152 /nfs/dbraw/zinc/51/51/52/1085515152.db2.gz KGYZGPDOAVJRIZ-HKAJVESUSA-N 1 3 343.515 2.868 10 0 EFAEHO CN(CC(=O)N1CC[C@@](C)(C[NH2+]C/C=C/Cl)C1)CC(C)(C)C ZINC001569683933 1085515199 /nfs/dbraw/zinc/51/51/99/1085515199.db2.gz UCUGLYIJXCRKNX-JKNJVXJCSA-N 1 3 329.916 2.545 10 0 EFAEHO C[C@H]([NH2+]CCC1=CCCCC1)[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001569824087 1085643942 /nfs/dbraw/zinc/64/39/42/1085643942.db2.gz NBLLHJQQTPGAEN-PKOBYXMFSA-N 1 3 333.520 2.799 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]CCc2ccc(C)cc2)C1 ZINC001569853310 1085677291 /nfs/dbraw/zinc/67/72/91/1085677291.db2.gz PAMYWKWWHNMATB-QUCCMNQESA-N 1 3 345.531 2.563 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@H]2CN(C(=O)[C@H]3CCCCN3CC)C[C@H]2C1 ZINC001569883773 1085716534 /nfs/dbraw/zinc/71/65/34/1085716534.db2.gz ILJDVRSZSVOKQK-BQWVTDQKSA-N 1 3 333.520 2.607 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@H]2CN(C(=O)[C@H]3CCCCN3CC)C[C@H]2C1 ZINC001569883773 1085716543 /nfs/dbraw/zinc/71/65/43/1085716543.db2.gz ILJDVRSZSVOKQK-BQWVTDQKSA-N 1 3 333.520 2.607 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H]2[C@@H]1CC[N@@H+]2CCCCCF)N(C)C ZINC001569912191 1085753499 /nfs/dbraw/zinc/75/34/99/1085753499.db2.gz GARLRKBJJBZBLT-OKZBNKHCSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H]2[C@@H]1CC[N@H+]2CCCCCF)N(C)C ZINC001569912191 1085753506 /nfs/dbraw/zinc/75/35/06/1085753506.db2.gz GARLRKBJJBZBLT-OKZBNKHCSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](CC[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001569984320 1085818860 /nfs/dbraw/zinc/81/88/60/1085818860.db2.gz RPGGLIRPMJRVJW-HKUYNNGSSA-N 1 3 349.563 2.981 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2CN(C(=O)CCCC[NH+](C)C)C[C@H]2C)c1 ZINC001570362464 1086168354 /nfs/dbraw/zinc/16/83/54/1086168354.db2.gz VSKKKQFPOVWGDR-APWZRJJASA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N(C)C1CCC([NH2+]CCCF)CC1 ZINC001570664623 1086446612 /nfs/dbraw/zinc/44/66/12/1086446612.db2.gz UGDQVMMXIMHHLV-DAWZGUTISA-N 1 3 341.515 2.968 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)C1C[NH+](CCC2=CCCCC2)C1 ZINC001570843279 1086560831 /nfs/dbraw/zinc/56/08/31/1086560831.db2.gz FQIXSDLBFUBFGG-INIZCTEOSA-N 1 3 333.520 2.798 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@@H]2CN(CC3=CCCCC3)CC2(C)C)CC1 ZINC001570901877 1086602174 /nfs/dbraw/zinc/60/21/74/1086602174.db2.gz IHEXEURXDZCCAP-QGZVFWFLSA-N 1 3 333.520 2.655 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@H+](CCCCCF)CC1(C)C)N(C)C ZINC001570907667 1086605904 /nfs/dbraw/zinc/60/59/04/1086605904.db2.gz LWPDYVCXEOLYKK-HOTGVXAUSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@@H+](CCCCCF)CC1(C)C)N(C)C ZINC001570907667 1086605907 /nfs/dbraw/zinc/60/59/07/1086605907.db2.gz LWPDYVCXEOLYKK-HOTGVXAUSA-N 1 3 329.504 2.539 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CCC[NH2+]Cc1ccsc1 ZINC001571326204 1086723602 /nfs/dbraw/zinc/72/36/02/1086723602.db2.gz PNLPSSXWCOADSQ-RDJZCZTQSA-N 1 3 337.533 2.997 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CCC[NH2+]Cc1ccsc1 ZINC001571326205 1086723718 /nfs/dbraw/zinc/72/37/18/1086723718.db2.gz PNLPSSXWCOADSQ-WBVHZDCISA-N 1 3 337.533 2.997 10 0 EFAEHO CCCCC[NH2+][C@H](C)CN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001571406197 1086790279 /nfs/dbraw/zinc/79/02/79/1086790279.db2.gz XBIZEPMPPXVWHB-QAPCUYQASA-N 1 3 329.504 2.826 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2ccccc2)[C@@H]1C ZINC001571465917 1086840743 /nfs/dbraw/zinc/84/07/43/1086840743.db2.gz MVVFTTPMXCERGV-PKOBYXMFSA-N 1 3 331.504 2.540 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1CCN(C(=O)CN2CCCC2)[C@@H]1C ZINC001571468021 1086842902 /nfs/dbraw/zinc/84/29/02/1086842902.db2.gz VYFVGJZXNRCYHY-QUCCMNQESA-N 1 3 343.515 2.602 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CC[C@H](C[NH2+]CCCC(C)(C)C)C1 ZINC001571548417 1086952444 /nfs/dbraw/zinc/95/24/44/1086952444.db2.gz ODQMITGPUHPHRB-HOTGVXAUSA-N 1 3 334.508 2.961 10 0 EFAEHO CCCC[NH2+][C@H]1CN(C(=O)CN(C)C2CCC2)CC[C@H]1C(F)(F)F ZINC001571652089 1087023196 /nfs/dbraw/zinc/02/31/96/1087023196.db2.gz HYAQEOQREBJORP-CABCVRRESA-N 1 3 349.441 2.640 10 0 EFAEHO Cc1cc(CNCCN(C)C(=O)[C@H]2CCC[C@@H]([NH+](C)C)C2)cs1 ZINC001266979702 1092232406 /nfs/dbraw/zinc/23/24/06/1092232406.db2.gz IKVRAJRRRCIPPD-DLBZAZTESA-N 1 3 337.533 2.725 10 0 EFAEHO Cc1cc(C)c(C[NH2+]CCN(C)C(=O)[C@H](C(C)C)N(C)C)c(C)c1 ZINC001267004584 1092301083 /nfs/dbraw/zinc/30/10/83/1092301083.db2.gz FMPBGDQFRSBEIK-IBGZPJMESA-N 1 3 333.520 2.746 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[NH2+]Cc1ccccc1C1CC1)N(C)C ZINC001267004326 1092301104 /nfs/dbraw/zinc/30/11/04/1092301104.db2.gz AJNMXROUMSLDCU-LJQANCHMSA-N 1 3 331.504 2.698 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12 ZINC001649357463 1092428433 /nfs/dbraw/zinc/42/84/33/1092428433.db2.gz QGHQWUGXGRCEJF-UKPHBRMFSA-N 1 3 341.455 2.564 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@H]12 ZINC001649357463 1092428440 /nfs/dbraw/zinc/42/84/40/1092428440.db2.gz QGHQWUGXGRCEJF-UKPHBRMFSA-N 1 3 341.455 2.564 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21 ZINC001649357458 1092428485 /nfs/dbraw/zinc/42/84/85/1092428485.db2.gz QGHQWUGXGRCEJF-JLJPHGGASA-N 1 3 341.455 2.564 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@@H]21 ZINC001649357458 1092428495 /nfs/dbraw/zinc/42/84/95/1092428495.db2.gz QGHQWUGXGRCEJF-JLJPHGGASA-N 1 3 341.455 2.564 10 0 EFAEHO C[C@@H](CCNC/C(Cl)=C/Cl)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001649450925 1092479372 /nfs/dbraw/zinc/47/93/72/1092479372.db2.gz PONALZOCRJNLLG-IXJPEXDMSA-N 1 3 336.307 2.664 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[NH2+]CC/C=C/c2ccccc2)C1)N(C)C ZINC001267067094 1092523645 /nfs/dbraw/zinc/52/36/45/1092523645.db2.gz NHCQFPPYFIEMRB-IJQANDGASA-N 1 3 343.515 2.868 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001267116896 1092799536 /nfs/dbraw/zinc/79/95/36/1092799536.db2.gz JINBHZFVZXWMKN-IBGZPJMESA-N 1 3 342.487 2.590 10 0 EFAEHO C[C@@H]([NH2+]CCCCCF)C1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001267201667 1093179739 /nfs/dbraw/zinc/17/97/39/1093179739.db2.gz QWFDYOGLPKRJES-DLBZAZTESA-N 1 3 341.515 2.685 10 0 EFAEHO CC(C)=CCN1CCC[C@@H]1CNC(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001267277074 1093455494 /nfs/dbraw/zinc/45/54/94/1093455494.db2.gz YPYCZLVURCTQJR-VQIMIIECSA-N 1 3 339.499 2.746 10 0 EFAEHO CC(C)=CCN1CCC[C@@H]1CNC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001267277074 1093455501 /nfs/dbraw/zinc/45/55/01/1093455501.db2.gz YPYCZLVURCTQJR-VQIMIIECSA-N 1 3 339.499 2.746 10 0 EFAEHO CC(C)=CCN(CCNC(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1)C1CC1 ZINC001267333023 1093602818 /nfs/dbraw/zinc/60/28/18/1093602818.db2.gz OKHWABSSRNZILN-IBGZPJMESA-N 1 3 339.499 2.746 10 0 EFAEHO CC(C)=CCN(CCNC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1)C1CC1 ZINC001267333023 1093602820 /nfs/dbraw/zinc/60/28/20/1093602820.db2.gz OKHWABSSRNZILN-IBGZPJMESA-N 1 3 339.499 2.746 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[NH2+]Cc2cccc(Cl)c2)CC1 ZINC001267445217 1094535747 /nfs/dbraw/zinc/53/57/47/1094535747.db2.gz ZHOXHEISTQNMFE-UHFFFAOYSA-N 1 3 337.895 2.620 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1CC[C@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001481462993 1094715089 /nfs/dbraw/zinc/71/50/89/1094715089.db2.gz WTYKMFVGIOFVAP-QFBILLFUSA-N 1 3 349.494 2.938 10 0 EFAEHO CC[C@@H](F)C[N@H+]1CC[C@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001481462993 1094715097 /nfs/dbraw/zinc/71/50/97/1094715097.db2.gz WTYKMFVGIOFVAP-QFBILLFUSA-N 1 3 349.494 2.938 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]Cc1cc(C)ccc1C ZINC001267473583 1094761910 /nfs/dbraw/zinc/76/19/10/1094761910.db2.gz HDKOKCBLMDOBSB-LJQANCHMSA-N 1 3 331.504 2.726 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+](CC/C=C/c2ccccc2)C1 ZINC001481125248 1094833255 /nfs/dbraw/zinc/83/32/55/1094833255.db2.gz BSNGRFFOXZSBKX-OEMHODTASA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+](CC/C=C/c2ccccc2)C1 ZINC001481125248 1094833270 /nfs/dbraw/zinc/83/32/70/1094833270.db2.gz BSNGRFFOXZSBKX-OEMHODTASA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)C1(N(C)C)CCC1)Cc1ccccc1 ZINC001267503088 1095077068 /nfs/dbraw/zinc/07/70/68/1095077068.db2.gz OOKZVIXUXVFFIC-UHFFFAOYSA-N 1 3 331.504 2.888 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)C1(N(C)C)CCC1)Cc1ccccc1 ZINC001267503088 1095077086 /nfs/dbraw/zinc/07/70/86/1095077086.db2.gz OOKZVIXUXVFFIC-UHFFFAOYSA-N 1 3 331.504 2.888 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@H+](CC2CCC(C)CC2)C1)N(C)C ZINC001481537141 1095183791 /nfs/dbraw/zinc/18/37/91/1095183791.db2.gz IDYHNCSSXCGGLE-WZOJCFFYSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@@H+](CC2CCC(C)CC2)C1)N(C)C ZINC001481537141 1095183797 /nfs/dbraw/zinc/18/37/97/1095183797.db2.gz IDYHNCSSXCGGLE-WZOJCFFYSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@H](CNCC=C(Cl)Cl)N(C)C(=O)CCC[NH+]1CCCC1 ZINC001268099908 1095352127 /nfs/dbraw/zinc/35/21/27/1095352127.db2.gz RFSLUSGUNFQFCE-CYBMUJFWSA-N 1 3 336.307 2.618 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@@H](C[NH2+]C/C=C\Cl)C2CCCCC2)C1 ZINC001268118689 1095404605 /nfs/dbraw/zinc/40/46/05/1095404605.db2.gz CWYMRSLFBIXBJH-RDQHTGABSA-N 1 3 341.927 2.735 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+]CC[C@@H]1CCCCN1C(=O)Cc1c[nH]cn1 ZINC001268162056 1095596429 /nfs/dbraw/zinc/59/64/29/1095596429.db2.gz SUCHRWWCZCXRFH-AEFFLSMTSA-N 1 3 334.508 2.995 10 0 EFAEHO CCN(CCNC(=O)CC[C@H]1CCC[N@@H+]1C)Cc1cccc(C)c1 ZINC001480980335 1095651846 /nfs/dbraw/zinc/65/18/46/1095651846.db2.gz MLRGOIZMQPXGQV-LJQANCHMSA-N 1 3 331.504 2.808 10 0 EFAEHO CCN(CCNC(=O)CC[C@H]1CCC[N@H+]1C)Cc1cccc(C)c1 ZINC001480980335 1095651851 /nfs/dbraw/zinc/65/18/51/1095651851.db2.gz MLRGOIZMQPXGQV-LJQANCHMSA-N 1 3 331.504 2.808 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)Cc1cc(F)ccc1C ZINC001480996003 1095707644 /nfs/dbraw/zinc/70/76/44/1095707644.db2.gz JKXATLIFTATLFT-IRXDYDNUSA-N 1 3 349.494 2.803 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)Cc1cc(F)ccc1C ZINC001480996003 1095707646 /nfs/dbraw/zinc/70/76/46/1095707646.db2.gz JKXATLIFTATLFT-IRXDYDNUSA-N 1 3 349.494 2.803 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@H]1CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001267732202 1095744519 /nfs/dbraw/zinc/74/45/19/1095744519.db2.gz IGEYMMYXBCYTCI-SFHVURJKSA-N 1 3 342.487 2.590 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]1CCC[N@@H+]1CCCCCF ZINC001481041172 1096124191 /nfs/dbraw/zinc/12/41/91/1096124191.db2.gz ZPBPEAIXVKSPQN-SJORKVTESA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]1CCC[N@H+]1CCCCCF ZINC001481041172 1096124196 /nfs/dbraw/zinc/12/41/96/1096124196.db2.gz ZPBPEAIXVKSPQN-SJORKVTESA-N 1 3 327.488 2.580 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)N[C@@H]1CCN(CCCCCF)C1 ZINC001481703776 1096341727 /nfs/dbraw/zinc/34/17/27/1096341727.db2.gz JKGGNQSUSZXKNP-MRXNPFEDSA-N 1 3 341.515 2.970 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)N[C@@H]1CCN(CCCCCF)C1 ZINC001481703776 1096341731 /nfs/dbraw/zinc/34/17/31/1096341731.db2.gz JKGGNQSUSZXKNP-MRXNPFEDSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]CCc1ccccc1 ZINC001268368651 1096402314 /nfs/dbraw/zinc/40/23/14/1096402314.db2.gz ZWDUQQUDJOVANN-PKOBYXMFSA-N 1 3 331.504 2.586 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)[C@H]1CC[N@H+](CCCCCF)C1 ZINC001481729085 1096431414 /nfs/dbraw/zinc/43/14/14/1096431414.db2.gz PLNYNLDOMBACTF-DLBZAZTESA-N 1 3 327.488 2.533 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)[C@H]1CC[N@@H+](CCCCCF)C1 ZINC001481729085 1096431420 /nfs/dbraw/zinc/43/14/20/1096431420.db2.gz PLNYNLDOMBACTF-DLBZAZTESA-N 1 3 327.488 2.533 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccccc1C1CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001268400167 1096494227 /nfs/dbraw/zinc/49/42/27/1096494227.db2.gz SBTMEULIMWVKMH-IAGOWNOFSA-N 1 3 343.515 2.890 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@H](C)NC(=O)CN(C)CC(C)(C)C)c1 ZINC001268401231 1096496033 /nfs/dbraw/zinc/49/60/33/1096496033.db2.gz AJFZDAADVKSUQR-KRWDZBQOSA-N 1 3 333.520 2.957 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1CC[C@@H](N(C)C(=O)C(C)(C)c2c[nH]cn2)C1 ZINC001481746209 1096502617 /nfs/dbraw/zinc/50/26/17/1096502617.db2.gz BPYDOIPXZHFJLI-JKSUJKDBSA-N 1 3 334.508 2.902 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1CC[C@@H](N(C)C(=O)C(C)(C)c2c[nH]cn2)C1 ZINC001481746209 1096502623 /nfs/dbraw/zinc/50/26/23/1096502623.db2.gz BPYDOIPXZHFJLI-JKSUJKDBSA-N 1 3 334.508 2.902 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)[NH+]1CCCC1 ZINC001481753577 1096534951 /nfs/dbraw/zinc/53/49/51/1096534951.db2.gz WMYRIKLBHGQQHF-WOJBJXKFSA-N 1 3 343.515 2.840 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CCNCc1c(F)cccc1F)[NH+](C)C ZINC001268412716 1096545913 /nfs/dbraw/zinc/54/59/13/1096545913.db2.gz BHGTUDZXHZMSJS-CXAGYDPISA-N 1 3 341.446 2.535 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CCNCc1c(F)cccc1F)[NH+](C)C ZINC001268412717 1096546503 /nfs/dbraw/zinc/54/65/03/1096546503.db2.gz BHGTUDZXHZMSJS-DYVFJYSZSA-N 1 3 341.446 2.535 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1cccc(C)c1 ZINC001268425137 1096583847 /nfs/dbraw/zinc/58/38/47/1096583847.db2.gz CNCRFQZUNPLUPE-HKUYNNGSSA-N 1 3 331.504 2.854 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CC[NH2+]Cc1cc(C)ccc1F ZINC001268425182 1096583996 /nfs/dbraw/zinc/58/39/96/1096583996.db2.gz DAKXDBYWDFCGRK-APWZRJJASA-N 1 3 349.494 2.993 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC(C)(C)C[NH2+]CC[C@H](C)F ZINC001282334785 1096590150 /nfs/dbraw/zinc/59/01/50/1096590150.db2.gz ILSFTMZBRGKYFW-HOTGVXAUSA-N 1 3 329.504 2.683 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@@H]1CCN([C@H]2CCc3c2cccc3F)C1 ZINC001481774355 1096672243 /nfs/dbraw/zinc/67/22/43/1096672243.db2.gz JTUBOKVZHAFQMW-BEFAXECRSA-N 1 3 347.478 2.688 10 0 EFAEHO CC[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]Cc1ccccc1 ZINC001481849265 1096791399 /nfs/dbraw/zinc/79/13/99/1096791399.db2.gz CBHVVPOEHGXFDI-XLIONFOSSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cc(C)ccc1C ZINC001481850672 1096794419 /nfs/dbraw/zinc/79/44/19/1096794419.db2.gz NTODSHSHNKIYRD-APWZRJJASA-N 1 3 331.504 2.630 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C(C)C)cc1)C(=O)[C@H]1CCCN1C ZINC001268471493 1096825100 /nfs/dbraw/zinc/82/51/00/1096825100.db2.gz NPIVHEXGGPDBPC-LJQANCHMSA-N 1 3 331.504 2.842 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]CC1CCC(F)(F)CC1 ZINC001481881134 1096850299 /nfs/dbraw/zinc/85/02/99/1096850299.db2.gz JBHKPYXHIKDYEX-OAHLLOKOSA-N 1 3 333.467 2.637 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1(C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CCCC1 ZINC001481911701 1096913490 /nfs/dbraw/zinc/91/34/90/1096913490.db2.gz LOWAODZNFIFHHJ-IXDOHACOSA-N 1 3 344.503 2.715 10 0 EFAEHO CC[C@H](C(=O)N(CC)CC[NH2+]Cc1ccc2ncccc2c1)N(C)C ZINC001268492775 1096963241 /nfs/dbraw/zinc/96/32/41/1096963241.db2.gz NMRGVMSNBZJSCC-LJQANCHMSA-N 1 3 342.487 2.513 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(C)sc1C)C(=O)[C@H](C(C)C)N(C)C ZINC001268493748 1096966023 /nfs/dbraw/zinc/96/60/23/1096966023.db2.gz SLLXIRZFOUMVPR-KRWDZBQOSA-N 1 3 339.549 2.889 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H](CC[NH2+]Cc2ccsc2)C1)N(C)C ZINC001481983554 1097035261 /nfs/dbraw/zinc/03/52/61/1097035261.db2.gz JCAQTDAEDFGORC-WBVHZDCISA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](CC[NH2+]CCc2ccccc2)C1)N(C)C ZINC001481981120 1097036320 /nfs/dbraw/zinc/03/63/20/1097036320.db2.gz JYIFQLXMPMYDEO-VQTJNVASSA-N 1 3 345.531 2.788 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NC/C=C\C[NH2+]CCCc1ccccc1Cl ZINC001268522100 1097123163 /nfs/dbraw/zinc/12/31/63/1097123163.db2.gz JQVDVAWNGBNFPO-PYTPGESOSA-N 1 3 349.906 2.629 10 0 EFAEHO O=C(NC/C=C/CNC/C=C/Cl)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001268538873 1097145273 /nfs/dbraw/zinc/14/52/73/1097145273.db2.gz NVTVRBWDWQSTKE-CKIPFWLFSA-N 1 3 339.911 2.656 10 0 EFAEHO O=C(NC/C=C/CNC/C=C/Cl)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001268538873 1097145276 /nfs/dbraw/zinc/14/52/76/1097145276.db2.gz NVTVRBWDWQSTKE-CKIPFWLFSA-N 1 3 339.911 2.656 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/C[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001268551788 1097177033 /nfs/dbraw/zinc/17/70/33/1097177033.db2.gz KDLQYEZCGXLCPE-QWNKOJSDSA-N 1 3 335.536 2.805 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC2(CC[N@H+](CCCCCF)C2)CC1 ZINC001482070526 1097232069 /nfs/dbraw/zinc/23/20/69/1097232069.db2.gz SQGYUTFNSFROGM-QGZVFWFLSA-N 1 3 339.499 2.535 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC2(CC[N@@H+](CCCCCF)C2)CC1 ZINC001482070526 1097232074 /nfs/dbraw/zinc/23/20/74/1097232074.db2.gz SQGYUTFNSFROGM-QGZVFWFLSA-N 1 3 339.499 2.535 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/C[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001268587301 1097306007 /nfs/dbraw/zinc/30/60/07/1097306007.db2.gz IKTDYBQRGOVREA-DZEZYYDTSA-N 1 3 345.478 2.660 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC/C=C/C[NH2+]CCC2CCCCCC2)C1 ZINC001268591784 1097315556 /nfs/dbraw/zinc/31/55/56/1097315556.db2.gz UHQSMOFOXAYOOU-DKFQHHCZSA-N 1 3 335.536 2.951 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)C[NH2+]CCC1CCCCCC1 ZINC001482162749 1097418213 /nfs/dbraw/zinc/41/82/13/1097418213.db2.gz DJXFZPVBHAMBFB-HNNXBMFYSA-N 1 3 334.508 2.963 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)NC/C=C\CNCc2ccsc2)C1 ZINC001268612147 1097461230 /nfs/dbraw/zinc/46/12/30/1097461230.db2.gz DQXCWNRISZACHO-OPCNFVSTSA-N 1 3 335.517 2.631 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C/C=C\CNC(=O)CN2CCCC2)c1 ZINC001268625004 1097478390 /nfs/dbraw/zinc/47/83/90/1097478390.db2.gz JTHCZADPMSDVIW-XDXAGZTOSA-N 1 3 329.488 2.722 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+]CC[C@@H]1CCc2ccccc21 ZINC001268674574 1097528706 /nfs/dbraw/zinc/52/87/06/1097528706.db2.gz VMTRFJPGYDSVLH-AEFFLSMTSA-N 1 3 331.504 2.541 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CCCc1ccsc1 ZINC001268717373 1097566985 /nfs/dbraw/zinc/56/69/85/1097566985.db2.gz XQHSRUKUYUJRDO-RDJZCZTQSA-N 1 3 337.533 2.649 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001268799017 1097650399 /nfs/dbraw/zinc/65/03/99/1097650399.db2.gz REYYQOUDFMLACQ-INIZCTEOSA-N 1 3 347.494 2.836 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)[C@H]1CCCN1C)c1cccc(Cl)c1 ZINC001268811690 1097660559 /nfs/dbraw/zinc/66/05/59/1097660559.db2.gz PZESSXNPVIATTL-RHSMWYFYSA-N 1 3 337.895 2.933 10 0 EFAEHO Cc1ccc(C[NH2+]CCCN(C)C(=O)[C@@H](C(C)C)N(C)C)c(C)c1 ZINC001268920435 1097719368 /nfs/dbraw/zinc/71/93/68/1097719368.db2.gz PRIBQARRXLZTQY-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+]Cc1ccccc1Cl)N(C)C ZINC001268919868 1097719681 /nfs/dbraw/zinc/71/96/81/1097719681.db2.gz AWTBQAZILBRPAT-QGZVFWFLSA-N 1 3 339.911 2.864 10 0 EFAEHO CN(CCC[NH2+]Cc1cccc(Cl)c1F)C(=O)CN1CCCC1 ZINC001268950180 1097739708 /nfs/dbraw/zinc/73/97/08/1097739708.db2.gz NWVSNQGOHXKURZ-UHFFFAOYSA-N 1 3 341.858 2.513 10 0 EFAEHO CCCCCN1C[C@@H]2C[C@H]1CN2C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001268956078 1097744161 /nfs/dbraw/zinc/74/41/61/1097744161.db2.gz ZBCIYADLWDAHLA-ROUUACIJSA-N 1 3 335.536 2.974 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001269114284 1097866574 /nfs/dbraw/zinc/86/65/74/1097866574.db2.gz AVUYLEIVGRWRBU-APWZRJJASA-N 1 3 339.499 2.650 10 0 EFAEHO CN(C(=O)C1(C[NH+](C)C)CC1)[C@H]1CCN(CCCCC(F)(F)F)C1 ZINC001269268564 1098002004 /nfs/dbraw/zinc/00/20/04/1098002004.db2.gz NLEOEAIEPWBEIE-AWEZNQCLSA-N 1 3 349.441 2.594 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+]CCCCC(F)(F)F)CC1 ZINC001269411556 1098119232 /nfs/dbraw/zinc/11/92/32/1098119232.db2.gz LIENLXPCGKLGKD-AWEZNQCLSA-N 1 3 349.441 2.830 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1(NCc2ccccc2Cl)CCCC1 ZINC001482227822 1098212449 /nfs/dbraw/zinc/21/24/49/1098212449.db2.gz DKIURHIGEJXCCV-UHFFFAOYSA-N 1 3 337.895 2.810 10 0 EFAEHO C[NH+](C)CC1(C(=O)NC2(CNCC=C(Cl)Cl)CCCC2)CC1 ZINC001269572335 1098259781 /nfs/dbraw/zinc/25/97/81/1098259781.db2.gz PYHJPBDBKYROHY-UHFFFAOYSA-N 1 3 348.318 2.666 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001269740370 1098413232 /nfs/dbraw/zinc/41/32/32/1098413232.db2.gz DYPBTZJQEFFRMI-UYAOXDASSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCCC[N@H+]1CC[C@@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001269740370 1098413235 /nfs/dbraw/zinc/41/32/35/1098413235.db2.gz DYPBTZJQEFFRMI-UYAOXDASSA-N 1 3 335.536 2.833 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)cc1 ZINC001269770372 1098436106 /nfs/dbraw/zinc/43/61/06/1098436106.db2.gz KPFBZAJUOIDWNK-SFHVURJKSA-N 1 3 340.471 2.679 10 0 EFAEHO CC/C=C/CC[NH+]1CC2(C1)CCN(C(=O)CN1CC[C@@H](C)C1)CC2 ZINC001482245235 1098467790 /nfs/dbraw/zinc/46/77/90/1098467790.db2.gz UHNWPTLTDUCIBB-SHCNBLLESA-N 1 3 333.520 2.609 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(CC[NH2+]Cc3ccsc3)CC2)C1 ZINC001267914297 1098614437 /nfs/dbraw/zinc/61/44/37/1098614437.db2.gz FCHDFGJDHXXACL-MRXNPFEDSA-N 1 3 349.544 2.808 10 0 EFAEHO CC[C@H](C)C[NH2+]CCC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001267915006 1098617126 /nfs/dbraw/zinc/61/71/26/1098617126.db2.gz VFRXYDHAVZJCPJ-FUHWJXTLSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@@H](C)C[NH2+]CCC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001267915007 1098617224 /nfs/dbraw/zinc/61/72/24/1098617224.db2.gz VFRXYDHAVZJCPJ-SJLPKXTDSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C(=O)[C@@H]1CCCN1C ZINC001482265463 1098701750 /nfs/dbraw/zinc/70/17/50/1098701750.db2.gz HHKKPZCXDDXLNU-JXFKEZNVSA-N 1 3 343.515 2.985 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@H]1CCCN1C(=O)[C@H](CC)N(C)C ZINC001270136014 1098732179 /nfs/dbraw/zinc/73/21/79/1098732179.db2.gz AIULIVOOKVLNLX-UXHICEINSA-N 1 3 345.531 2.712 10 0 EFAEHO C[C@@H]([NH2+]CC[C@@H]1CCCCN1C)c1cccc(NS(C)(=O)=O)c1 ZINC000781915163 1098769200 /nfs/dbraw/zinc/76/92/00/1098769200.db2.gz XUQHJECNKRVWSK-PBHICJAKSA-N 1 3 339.505 2.583 10 0 EFAEHO Cc1cccc(CCC[NH2+]C[C@@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001270194563 1098789209 /nfs/dbraw/zinc/78/92/09/1098789209.db2.gz UFATZJAABZBDNV-FQEVSTJZSA-N 1 3 345.531 2.848 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H]1C[NH2+]CCc1ccccc1 ZINC001270309038 1098941125 /nfs/dbraw/zinc/94/11/25/1098941125.db2.gz STGSEMXXQJPOJH-WOJBJXKFSA-N 1 3 343.515 2.684 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]1C[NH2+]CCC(C)(C)C)CC(C)(C)C ZINC001267963599 1098941673 /nfs/dbraw/zinc/94/16/73/1098941673.db2.gz QNULYOUXUFISID-MRXNPFEDSA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001270308263 1098942998 /nfs/dbraw/zinc/94/29/98/1098942998.db2.gz FESYHUFLDLSDOJ-HXUWFJFHSA-N 1 3 343.515 2.604 10 0 EFAEHO CN1CCC[C@H]1CC[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 ZINC000709486991 1099005275 /nfs/dbraw/zinc/00/52/75/1099005275.db2.gz PEUIPQGZZFVRDT-YVSFHVDLSA-N 1 3 337.508 2.848 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)[C@H]2CCC[N@H+]2C(C)C)c1 ZINC001482284454 1099030570 /nfs/dbraw/zinc/03/05/70/1099030570.db2.gz NUUYKCCIIRVIMD-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)[C@H]2CCC[N@@H+]2C(C)C)c1 ZINC001482284454 1099030583 /nfs/dbraw/zinc/03/05/83/1099030583.db2.gz NUUYKCCIIRVIMD-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H](C)N(C)C(=O)CN(C)C2CCC2)c1 ZINC001482293284 1099153236 /nfs/dbraw/zinc/15/32/36/1099153236.db2.gz UTNCVRMIGALVKN-HNNXBMFYSA-N 1 3 335.467 2.555 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]Cc1cc(F)ccc1C ZINC001481320462 1099281851 /nfs/dbraw/zinc/28/18/51/1099281851.db2.gz ZMFBTKLCJPHIBS-SFHVURJKSA-N 1 3 335.467 2.557 10 0 EFAEHO C[C@@H](C(=O)N[C@@]1(C)CC[N@H+](CCCCCF)C1)N1CCCCCC1 ZINC001270633273 1099332501 /nfs/dbraw/zinc/33/25/01/1099332501.db2.gz RRYFPKLBVHDLPQ-HKUYNNGSSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@@H](C(=O)N[C@@]1(C)CC[N@@H+](CCCCCF)C1)N1CCCCCC1 ZINC001270633273 1099332510 /nfs/dbraw/zinc/33/25/10/1099332510.db2.gz RRYFPKLBVHDLPQ-HKUYNNGSSA-N 1 3 341.515 2.971 10 0 EFAEHO COc1cccc(OC)c1OCCCCN1C[C@H]2C[N@H+](C)C[C@@]2(C)C1 ZINC001620628291 1099364853 /nfs/dbraw/zinc/36/48/53/1099364853.db2.gz JAFPNPTVCLKUAR-UZLBHIALSA-N 1 3 348.487 2.746 10 0 EFAEHO COc1cccc(OC)c1OCCCCN1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1 ZINC001620628291 1099364863 /nfs/dbraw/zinc/36/48/63/1099364863.db2.gz JAFPNPTVCLKUAR-UZLBHIALSA-N 1 3 348.487 2.746 10 0 EFAEHO CCCCC[NH2+][C@H](C)C1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001481339805 1099369986 /nfs/dbraw/zinc/36/99/86/1099369986.db2.gz NHUGYXJDGGXMCZ-AEFFLSMTSA-N 1 3 325.541 2.980 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@](C)(C[NH2+]CC3=CCCCC3)C2)CCC1 ZINC001270737893 1099509521 /nfs/dbraw/zinc/50/95/21/1099509521.db2.gz VZEUKZZEAMRECR-IBGZPJMESA-N 1 3 333.520 2.799 10 0 EFAEHO CN1CC2(C[C@@H]1C(=O)N1CCCC1)CC[NH+](Cc1cccs1)CC2 ZINC000675010056 1099624515 /nfs/dbraw/zinc/62/45/15/1099624515.db2.gz HJALKINBUKLWSQ-QGZVFWFLSA-N 1 3 347.528 2.657 10 0 EFAEHO Cc1cccnc1CNC[C@H](C)N(C)C(=O)[C@H](C)[NH+]1CCCCCC1 ZINC001482336387 1099667487 /nfs/dbraw/zinc/66/74/87/1099667487.db2.gz HYAPBPMKIHWPAM-ROUUACIJSA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@@H](C[NH2+]CC1CCC(C)CC1)N(C)C(=O)CN1CCC(C)CC1 ZINC001482343098 1099704071 /nfs/dbraw/zinc/70/40/71/1099704071.db2.gz FRBWJUHNJKBGIH-AVAKVYKDSA-N 1 3 337.552 2.981 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1cccc(C)c1 ZINC001482369849 1099872697 /nfs/dbraw/zinc/87/26/97/1099872697.db2.gz PTKYAAVCMZMTMB-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](CC[NH2+]CC2CCC(C)CC2)C1 ZINC001280309150 1099890075 /nfs/dbraw/zinc/89/00/75/1099890075.db2.gz YUPFVNOCZDOQFO-ACBHZAAOSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](CC[NH2+]Cc2ccsc2)C1 ZINC001267899919 1099962642 /nfs/dbraw/zinc/96/26/42/1099962642.db2.gz AZUGOZMGNGPZGA-MRXNPFEDSA-N 1 3 337.533 2.807 10 0 EFAEHO CN(C)C1(C(=O)Nc2ccc(OCCC[NH+](C)C)cc2)CCCC1 ZINC001628678331 1100122836 /nfs/dbraw/zinc/12/28/36/1100122836.db2.gz PJWVUJJSXRGAHX-UHFFFAOYSA-N 1 3 333.476 2.830 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001482439855 1100233487 /nfs/dbraw/zinc/23/34/87/1100233487.db2.gz WKYSYVGNGRWYHA-HKUYNNGSSA-N 1 3 331.504 2.662 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H](C(=O)NCCCN2CCc3ccccc3C2)C1 ZINC001629877653 1100255260 /nfs/dbraw/zinc/25/52/60/1100255260.db2.gz FDDOMHQAVGXMBC-FQEVSTJZSA-N 1 3 343.515 2.671 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H](C(=O)NCCCN2CCc3ccccc3C2)C1 ZINC001629877653 1100255266 /nfs/dbraw/zinc/25/52/66/1100255266.db2.gz FDDOMHQAVGXMBC-FQEVSTJZSA-N 1 3 343.515 2.671 10 0 EFAEHO C[NH+](C)CCCCC(=O)NCC1(C)CCN(Cc2cccnc2)CC1 ZINC001270918825 1100265694 /nfs/dbraw/zinc/26/56/94/1100265694.db2.gz DODMKFPEZSKCTG-UHFFFAOYSA-N 1 3 346.519 2.532 10 0 EFAEHO C[C@@H](CNCC=C(Cl)Cl)N(C)C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001270994440 1100346599 /nfs/dbraw/zinc/34/65/99/1100346599.db2.gz FKJBZHPIYPISMW-QWHCGFSZSA-N 1 3 336.307 2.616 10 0 EFAEHO C[C@@H](CNCC=C(Cl)Cl)N(C)C(=O)CC[C@H]1CCC[N@H+]1C ZINC001270994440 1100346606 /nfs/dbraw/zinc/34/66/06/1100346606.db2.gz FKJBZHPIYPISMW-QWHCGFSZSA-N 1 3 336.307 2.616 10 0 EFAEHO CCC[NH2+]C[C@H](CC(C)C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001271293804 1101345234 /nfs/dbraw/zinc/34/52/34/1101345234.db2.gz LTYOTWXWUPUOHE-YJBOKZPZSA-N 1 3 329.504 2.729 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C[NH2+]CC1=CCCCC1)CC(C)C ZINC001271311079 1101371627 /nfs/dbraw/zinc/37/16/27/1101371627.db2.gz INZOFDWBBYQJNM-KRWDZBQOSA-N 1 3 332.492 2.882 10 0 EFAEHO Cc1cc(C)c(CN(C)CCNC(=O)[C@H]2C[NH+]3CCC2CC3)c(C)c1 ZINC001480865695 1101402159 /nfs/dbraw/zinc/40/21/59/1101402159.db2.gz NSTVBWMJUMXGAP-FQEVSTJZSA-N 1 3 343.515 2.502 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H]1C[C@H]([NH2+]CCCc2ccccc2)C1 ZINC001266640368 1101629846 /nfs/dbraw/zinc/62/98/46/1101629846.db2.gz TZYBKOKANYWKMS-VAMGGRTRSA-N 1 3 343.515 2.730 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@@H]1CCN1[C@@H]1CCCc2ccccc21 ZINC001670713478 1101635060 /nfs/dbraw/zinc/63/50/60/1101635060.db2.gz JEBHYWWJCGSUHQ-AZUAARDMSA-N 1 3 343.515 2.986 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+]CCN(C)C(=O)C1(N(C)C)CCC1 ZINC001266724257 1102032308 /nfs/dbraw/zinc/03/23/08/1102032308.db2.gz JHYZRYYEONMTAB-UHFFFAOYSA-N 1 3 346.519 2.546 10 0 EFAEHO CN(CC[NH2+]CC[C@@H]1CCc2ccccc21)C(=O)CN(C)C1CCC1 ZINC001266726338 1102034102 /nfs/dbraw/zinc/03/41/02/1102034102.db2.gz QZEIKHKFVYJESA-SFHVURJKSA-N 1 3 343.515 2.639 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]CC3=CCCCC3)C2)C1 ZINC001656346320 1102039521 /nfs/dbraw/zinc/03/95/21/1102039521.db2.gz TWJZUXYLMCQCCL-NZSAHSFTSA-N 1 3 333.520 2.703 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)cc1F ZINC001266741170 1102073673 /nfs/dbraw/zinc/07/36/73/1102073673.db2.gz LYZRUOZVEHYGEI-HKUYNNGSSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)cc1F ZINC001266741170 1102073687 /nfs/dbraw/zinc/07/36/87/1102073687.db2.gz LYZRUOZVEHYGEI-HKUYNNGSSA-N 1 3 347.478 2.699 10 0 EFAEHO C[C@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@H]1CC[NH2+]Cc1ccccc1 ZINC001656449174 1102093675 /nfs/dbraw/zinc/09/36/75/1102093675.db2.gz ZSUUKCPXWDQCDX-LPHOPBHVSA-N 1 3 340.471 2.759 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([C@@H](C)[NH2+]CCCC(C)(C)C)C1 ZINC001271550555 1102114282 /nfs/dbraw/zinc/11/42/82/1102114282.db2.gz OSSPRBSQVCRWPY-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCCCC[C@@H]([NH2+]CCCF)C1 ZINC001656903010 1102251295 /nfs/dbraw/zinc/25/12/95/1102251295.db2.gz BMYOVNUWAQXDHQ-MSOLQXFVSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001266807031 1102288896 /nfs/dbraw/zinc/28/88/96/1102288896.db2.gz BODFBOAWDNDTQE-JKSUJKDBSA-N 1 3 329.504 2.541 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H](C[NH2+]CCCC3CCC3)C2)C1 ZINC001266807492 1102291957 /nfs/dbraw/zinc/29/19/57/1102291957.db2.gz MFZDQLHDRLBJAR-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO C[N@@H+]1CC[C@H](NCc2ccc(C(=O)N3CCCC3)cc2)[C@@H]2CCC[C@H]21 ZINC000796715430 1102433433 /nfs/dbraw/zinc/43/34/33/1102433433.db2.gz HWWNFILUFFNUBN-SLFFLAALSA-N 1 3 341.499 2.885 10 0 EFAEHO C[N@H+]1CC[C@H](NCc2ccc(C(=O)N3CCCC3)cc2)[C@@H]2CCC[C@H]21 ZINC000796715430 1102433438 /nfs/dbraw/zinc/43/34/38/1102433438.db2.gz HWWNFILUFFNUBN-SLFFLAALSA-N 1 3 341.499 2.885 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccc(C(=O)N3CCCC3)cc2)[C@@H]2CCC[C@H]21 ZINC000796715430 1102433443 /nfs/dbraw/zinc/43/34/43/1102433443.db2.gz HWWNFILUFFNUBN-SLFFLAALSA-N 1 3 341.499 2.885 10 0 EFAEHO CCOC(=O)/C=C/C[NH2+]C1[C@H](C)CN(Cc2ccccc2)C[C@@H]1C ZINC001658142147 1102438632 /nfs/dbraw/zinc/43/86/32/1102438632.db2.gz DYGOYFQQWFNVLF-FNYAWLCRSA-N 1 3 330.472 2.852 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@@H](C)[NH+]2CCCCCC2)c(C)n1 ZINC001266852534 1102449423 /nfs/dbraw/zinc/44/94/23/1102449423.db2.gz QTNWZANQVUDZSH-GOSISDBHSA-N 1 3 346.519 2.511 10 0 EFAEHO C[C@@H]1CC[N@H+](CC(=O)N2CCCC[C@H]2CNCC=C(Cl)Cl)C1 ZINC001266877064 1102571842 /nfs/dbraw/zinc/57/18/42/1102571842.db2.gz BIQUIKFCADPNPX-KGLIPLIRSA-N 1 3 348.318 2.618 10 0 EFAEHO C[C@@H]1CC[N@@H+](CC(=O)N2CCCC[C@H]2CNCC=C(Cl)Cl)C1 ZINC001266877064 1102571852 /nfs/dbraw/zinc/57/18/52/1102571852.db2.gz BIQUIKFCADPNPX-KGLIPLIRSA-N 1 3 348.318 2.618 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)[C@@H]1C[NH2+]CCCF ZINC001271741182 1102573622 /nfs/dbraw/zinc/57/36/22/1102573622.db2.gz WARDUGQSCJYTFF-HZPDHXFCSA-N 1 3 329.504 2.541 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)[C@H]1C[NH2+]CCCF ZINC001271741180 1102574496 /nfs/dbraw/zinc/57/44/96/1102574496.db2.gz WARDUGQSCJYTFF-CVEARBPZSA-N 1 3 329.504 2.541 10 0 EFAEHO CN(CCCNC(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12)Cc1ccsc1 ZINC001660190144 1102630638 /nfs/dbraw/zinc/63/06/38/1102630638.db2.gz IXOKHQKSLWJGFS-DLBZAZTESA-N 1 3 335.517 2.703 10 0 EFAEHO CN(CCCNC(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12)Cc1ccsc1 ZINC001660190144 1102630641 /nfs/dbraw/zinc/63/06/41/1102630641.db2.gz IXOKHQKSLWJGFS-DLBZAZTESA-N 1 3 335.517 2.703 10 0 EFAEHO CCCN(C)CC(=O)NCCC[N@H+](C)[C@H]1CCc2c1cccc2F ZINC001660372583 1102717965 /nfs/dbraw/zinc/71/79/65/1102717965.db2.gz QKLGNNSCSXWGQV-SFHVURJKSA-N 1 3 335.467 2.593 10 0 EFAEHO CCCN(C)CC(=O)NCCC[N@@H+](C)[C@H]1CCc2c1cccc2F ZINC001660372583 1102717976 /nfs/dbraw/zinc/71/79/76/1102717976.db2.gz QKLGNNSCSXWGQV-SFHVURJKSA-N 1 3 335.467 2.593 10 0 EFAEHO O=C([C@@H]1CC[C@H]2CCCC[N@@H+]21)N(CCNCCF)Cc1ccccc1 ZINC001271805529 1102752301 /nfs/dbraw/zinc/75/23/01/1102752301.db2.gz BWZFXHNNTHJZMB-MOPGFXCFSA-N 1 3 347.478 2.591 10 0 EFAEHO O=C([C@@H]1CC[C@H]2CCCC[N@H+]21)N(CCNCCF)Cc1ccccc1 ZINC001271805529 1102752316 /nfs/dbraw/zinc/75/23/16/1102752316.db2.gz BWZFXHNNTHJZMB-MOPGFXCFSA-N 1 3 347.478 2.591 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CC1CC(F)(F)C1)C(C)C ZINC001482532054 1102844400 /nfs/dbraw/zinc/84/44/00/1102844400.db2.gz IYXDYGGWPZXWLG-CVEARBPZSA-N 1 3 345.478 2.637 10 0 EFAEHO CCCC[N@H+](CC)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001660589209 1102871003 /nfs/dbraw/zinc/87/10/03/1102871003.db2.gz MMGUVZOMBSXEKX-SFHVURJKSA-N 1 3 329.504 2.827 10 0 EFAEHO CCCC[N@@H+](CC)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001660589209 1102871014 /nfs/dbraw/zinc/87/10/14/1102871014.db2.gz MMGUVZOMBSXEKX-SFHVURJKSA-N 1 3 329.504 2.827 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1ccccc1)C(C)C ZINC001482533385 1102876679 /nfs/dbraw/zinc/87/66/79/1102876679.db2.gz PRUCDQXHPJWYDJ-RTBURBONSA-N 1 3 331.504 2.791 10 0 EFAEHO CC1CCN(CC(=O)NCCC[N@H+](Cc2ccsc2)C2CC2)CC1 ZINC001660739527 1102954635 /nfs/dbraw/zinc/95/46/35/1102954635.db2.gz LUOUXUIPVPUJDB-UHFFFAOYSA-N 1 3 349.544 2.951 10 0 EFAEHO CC1CCN(CC(=O)NCCC[N@@H+](Cc2ccsc2)C2CC2)CC1 ZINC001660739527 1102954642 /nfs/dbraw/zinc/95/46/42/1102954642.db2.gz LUOUXUIPVPUJDB-UHFFFAOYSA-N 1 3 349.544 2.951 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCC(F)(F)F ZINC001482545397 1103095838 /nfs/dbraw/zinc/09/58/38/1103095838.db2.gz QQZKHHKBVUTZMU-CYBMUJFWSA-N 1 3 337.430 2.544 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(C[C@@H]2NC(=O)CN(C)C2CCC2)CC1 ZINC001661066959 1103108321 /nfs/dbraw/zinc/10/83/21/1103108321.db2.gz SEXAJBLHQQJTTA-WRFKIARRSA-N 1 3 333.520 2.798 10 0 EFAEHO CC/C=C\CC[N@H+](C)C[C@H]1CCCN(C(=O)CN(C)C2CCC2)C1 ZINC001661213606 1103178365 /nfs/dbraw/zinc/17/83/65/1103178365.db2.gz VFMFUDCGJHMBHA-OOFWQKGWSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](C)C[C@H]1CCCN(C(=O)CN(C)C2CCC2)C1 ZINC001661213606 1103178372 /nfs/dbraw/zinc/17/83/72/1103178372.db2.gz VFMFUDCGJHMBHA-OOFWQKGWSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C(C)(C)C)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001483266402 1103191991 /nfs/dbraw/zinc/19/19/91/1103191991.db2.gz KXIZZMZJYBZECT-SJORKVTESA-N 1 3 345.531 2.920 10 0 EFAEHO CCCC[NH2+][C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001482555091 1103267948 /nfs/dbraw/zinc/26/79/48/1103267948.db2.gz ZLUVTSIAKWFCIM-QAPCUYQASA-N 1 3 329.504 2.729 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1cc(C)cc(C)c1 ZINC001483296324 1103292258 /nfs/dbraw/zinc/29/22/58/1103292258.db2.gz DDXGKVPIZHZSBD-PKOBYXMFSA-N 1 3 331.504 2.772 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC/C=C\c2ccccc2)C1)N(C)C ZINC001661678841 1103354564 /nfs/dbraw/zinc/35/45/64/1103354564.db2.gz URJABVUMACHGJG-UPVMNZJBSA-N 1 3 329.488 2.667 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC/C=C\c1ccccc1 ZINC001662334692 1103666238 /nfs/dbraw/zinc/66/62/38/1103666238.db2.gz KOCQJHSDAJVNEI-JEUJKCLLSA-N 1 3 329.488 2.526 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)CCc1ccccc1F ZINC001483421047 1103672428 /nfs/dbraw/zinc/67/24/28/1103672428.db2.gz NTRZWQRCTSUOCN-VQIMIIECSA-N 1 3 349.494 2.679 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)CCc1ccccc1F ZINC001483421047 1103672431 /nfs/dbraw/zinc/67/24/31/1103672431.db2.gz NTRZWQRCTSUOCN-VQIMIIECSA-N 1 3 349.494 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)CC[C@H]1CCCC1(F)F ZINC001483421974 1103679545 /nfs/dbraw/zinc/67/95/45/1103679545.db2.gz TZWCWUHWSMQGNI-HUUCEWRRSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC001483421974 1103679550 /nfs/dbraw/zinc/67/95/50/1103679550.db2.gz TZWCWUHWSMQGNI-HUUCEWRRSA-N 1 3 333.467 2.589 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](C[NH2+]CCCCc2ccccc2)C1 ZINC001662607570 1103727183 /nfs/dbraw/zinc/72/71/83/1103727183.db2.gz GSTGUJHBGPYKJC-PMACEKPBSA-N 1 3 343.515 2.542 10 0 EFAEHO Cc1ccc(C[NH2+]CCCN(C)C(=O)C2(N(C)C)CCC2)cc1C ZINC001483470375 1103773340 /nfs/dbraw/zinc/77/33/40/1103773340.db2.gz OWEWOJZASGGTIB-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CN(CCC[NH2+]Cc1cc2ccccc2o1)C(=O)CN(C)C1CCC1 ZINC001483470946 1103773409 /nfs/dbraw/zinc/77/34/09/1103773409.db2.gz USPCIJSJPYYWOV-UHFFFAOYSA-N 1 3 343.471 2.855 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)[C@H]1CCCCN1C)c1ccccc1F ZINC001483474621 1103782126 /nfs/dbraw/zinc/78/21/26/1103782126.db2.gz MNPRVCJYUHSTBI-CRAIPNDOSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001483492504 1103824867 /nfs/dbraw/zinc/82/48/67/1103824867.db2.gz DXUOLEAKAXFBLB-QGZVFWFLSA-N 1 3 335.536 2.737 10 0 EFAEHO CCc1ccc(C[NH2+]CCCN(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001483493131 1103826239 /nfs/dbraw/zinc/82/62/39/1103826239.db2.gz TVTNBFKFIIGUFV-QGZVFWFLSA-N 1 3 331.504 2.529 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+]CC1CCCCCC1)N(C)C ZINC001483505195 1103862045 /nfs/dbraw/zinc/86/20/45/1103862045.db2.gz USZXNYDKDIAPQC-SFHVURJKSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001483504115 1103866099 /nfs/dbraw/zinc/86/60/99/1103866099.db2.gz FJRAKUUQOPZLPW-KRWDZBQOSA-N 1 3 339.911 2.927 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CCC[C@@H]1CCCNC(=O)C1(N(C)C)CCC1 ZINC001663072093 1103960348 /nfs/dbraw/zinc/96/03/48/1103960348.db2.gz MIOXDAILEZHVSM-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](F)CC[N@H+]1CCC[C@@H]1CCCNC(=O)C1(N(C)C)CCC1 ZINC001663072093 1103960352 /nfs/dbraw/zinc/96/03/52/1103960352.db2.gz MIOXDAILEZHVSM-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CCC[C@H]1CCCNC(=O)C1(N(C)C)CCC1 ZINC001663072095 1103961698 /nfs/dbraw/zinc/96/16/98/1103961698.db2.gz MIOXDAILEZHVSM-JKSUJKDBSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](F)CC[N@H+]1CCC[C@H]1CCCNC(=O)C1(N(C)C)CCC1 ZINC001663072095 1103961705 /nfs/dbraw/zinc/96/17/05/1103961705.db2.gz MIOXDAILEZHVSM-JKSUJKDBSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H](NC[C@@H](NC(=O)CC[NH+](C)C)C1CC1)c1ccccc1Cl ZINC001483585943 1104008541 /nfs/dbraw/zinc/00/85/41/1104008541.db2.gz LQVSEKFVERKOAR-CXAGYDPISA-N 1 3 337.895 2.837 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H](C[NH2+]C/C=C\Cl)C2CC2)c1 ZINC001483606512 1104056572 /nfs/dbraw/zinc/05/65/72/1104056572.db2.gz DFRUJXCHKLMASB-INDRUJQFSA-N 1 3 335.879 2.599 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@H]1C[NH2+]CCc1cccs1 ZINC001671389141 1104210425 /nfs/dbraw/zinc/21/04/25/1104210425.db2.gz IJLVQGBWZSMAAG-WMZOPIPTSA-N 1 3 349.544 2.746 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)Cc2ccc(CF)cc2)CC[N@@H+]1C ZINC001409568339 1104286328 /nfs/dbraw/zinc/28/63/28/1104286328.db2.gz HPLZOFVQPLDCCR-ZYSHUDEJSA-N 1 3 349.494 2.823 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)Cc2ccc(CF)cc2)CC[N@H+]1C ZINC001409568339 1104286334 /nfs/dbraw/zinc/28/63/34/1104286334.db2.gz HPLZOFVQPLDCCR-ZYSHUDEJSA-N 1 3 349.494 2.823 10 0 EFAEHO CC[C@@H](F)CNCCN(C)C(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001664138096 1104297560 /nfs/dbraw/zinc/29/75/60/1104297560.db2.gz HQDJSPDNSFAEHG-WBVHZDCISA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@@H](F)CNCCN(C)C(=O)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001664138096 1104297569 /nfs/dbraw/zinc/29/75/69/1104297569.db2.gz HQDJSPDNSFAEHG-WBVHZDCISA-N 1 3 327.488 2.580 10 0 EFAEHO CCCc1ccc(C[NH2+]CCN(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001664186545 1104311961 /nfs/dbraw/zinc/31/19/61/1104311961.db2.gz OWOCGRIVIWAHLA-QGZVFWFLSA-N 1 3 331.504 2.529 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[NH2+]C/C=C/c2ccc(Cl)cc2)C1 ZINC001664186731 1104312524 /nfs/dbraw/zinc/31/25/24/1104312524.db2.gz RWXPENMDYAVQIG-CWDCEQMOSA-N 1 3 349.906 2.743 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[NH2+]Cc1cccc(C(F)(F)F)c1)N(C)C ZINC001664313343 1104346426 /nfs/dbraw/zinc/34/64/26/1104346426.db2.gz HWGYJHNUZWSLKQ-HNNXBMFYSA-N 1 3 345.409 2.594 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(C)CCN(C)C(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001482599527 1104417435 /nfs/dbraw/zinc/41/74/35/1104417435.db2.gz WLLINQZPRZHYOU-BEFAXECRSA-N 1 3 347.478 2.619 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001482603674 1104453757 /nfs/dbraw/zinc/45/37/57/1104453757.db2.gz NSFNGXAPHCVUBT-LJQANCHMSA-N 1 3 331.504 2.760 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001482603674 1104453763 /nfs/dbraw/zinc/45/37/63/1104453763.db2.gz NSFNGXAPHCVUBT-LJQANCHMSA-N 1 3 331.504 2.760 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H](C)[N@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001409623529 1104532521 /nfs/dbraw/zinc/53/25/21/1104532521.db2.gz BDHINBDNAJMRFN-QZTJIDSGSA-N 1 3 345.531 2.570 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H](C)[N@@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001409623529 1104532525 /nfs/dbraw/zinc/53/25/25/1104532525.db2.gz BDHINBDNAJMRFN-QZTJIDSGSA-N 1 3 345.531 2.570 10 0 EFAEHO CC/C=C/CC[N@H+](C)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001664891044 1104593993 /nfs/dbraw/zinc/59/39/93/1104593993.db2.gz OQPITAJRKBWSAH-QWNKOJSDSA-N 1 3 335.536 2.855 10 0 EFAEHO CC/C=C/CC[N@@H+](C)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001664891044 1104593999 /nfs/dbraw/zinc/59/39/99/1104593999.db2.gz OQPITAJRKBWSAH-QWNKOJSDSA-N 1 3 335.536 2.855 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(C[N@H+](C)CCCCCF)CC2)C1 ZINC001664891199 1104594888 /nfs/dbraw/zinc/59/48/88/1104594888.db2.gz QKPDMIYIEJUQKD-QGZVFWFLSA-N 1 3 341.515 2.638 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(C[N@@H+](C)CCCCCF)CC2)C1 ZINC001664891199 1104594891 /nfs/dbraw/zinc/59/48/91/1104594891.db2.gz QKPDMIYIEJUQKD-QGZVFWFLSA-N 1 3 341.515 2.638 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)N(C)Cc1ccc(C2CCC2)cc1 ZINC001409678959 1104641718 /nfs/dbraw/zinc/64/17/18/1104641718.db2.gz JYBQMQDDUSSWAG-OXQOHEQNSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(C2CCC2)cc1 ZINC001409678959 1104641724 /nfs/dbraw/zinc/64/17/24/1104641724.db2.gz JYBQMQDDUSSWAG-OXQOHEQNSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2Cc2ccsc2)C1 ZINC001482668392 1104812966 /nfs/dbraw/zinc/81/29/66/1104812966.db2.gz WCBATHQTMJMLLO-SJORKVTESA-N 1 3 335.517 2.511 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2Cc2ccsc2)C1 ZINC001482668392 1104812971 /nfs/dbraw/zinc/81/29/71/1104812971.db2.gz WCBATHQTMJMLLO-SJORKVTESA-N 1 3 335.517 2.511 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](CC[NH2+]Cc2cccc(F)c2)C1 ZINC001666172601 1104892723 /nfs/dbraw/zinc/89/27/23/1104892723.db2.gz JRJXDYOWLLSCJG-KRWDZBQOSA-N 1 3 349.494 2.884 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(CC[NH2+]Cc2ccsc2)CC1 ZINC001666259696 1104914374 /nfs/dbraw/zinc/91/43/74/1104914374.db2.gz UWDJUIUSFDZGON-UHFFFAOYSA-N 1 3 337.533 2.808 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CCC[C@@H]1C[NH2+]CCC(F)(F)F)N1CCCC1 ZINC001482684076 1104922452 /nfs/dbraw/zinc/92/24/52/1104922452.db2.gz KVAQBRVOKXDNLY-ZIAGYGMSSA-N 1 3 349.441 2.688 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@@H]1C[NH2+]CC/C=C\c1ccccc1 ZINC001666462752 1104947067 /nfs/dbraw/zinc/94/70/67/1104947067.db2.gz RJPHNZGIMJTNOH-ZONXLDJSSA-N 1 3 338.455 2.636 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@@H]1CCC[C@@H]1NC(=O)CN(C)C(C)C ZINC001482698759 1104955739 /nfs/dbraw/zinc/95/57/39/1104955739.db2.gz MYOANPSCXYBANB-HKUYNNGSSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001666600047 1104968405 /nfs/dbraw/zinc/96/84/05/1104968405.db2.gz NAHOEHHCNYYSKP-GOSISDBHSA-N 1 3 345.531 2.754 10 0 EFAEHO C[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C[NH2+]CCC(C)(C)C ZINC001666619583 1104970759 /nfs/dbraw/zinc/97/07/59/1104970759.db2.gz GMZLWLLHCZRTID-HNAYVOBHSA-N 1 3 343.531 2.977 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H](C)N(C)C(=O)CN2CCC(C)CC2)cc1 ZINC001667017736 1105037231 /nfs/dbraw/zinc/03/72/31/1105037231.db2.gz FQQSIIVVQLKHNH-IBGZPJMESA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@@H](CNCC=C(Cl)Cl)N(C)C(=O)CC[NH+]1CCCCC1 ZINC001667058384 1105043076 /nfs/dbraw/zinc/04/30/76/1105043076.db2.gz DTXQQWZVNCMCDC-ZDUSSCGKSA-N 1 3 336.307 2.618 10 0 EFAEHO C[C@@H](CC[NH2+]CCC(F)(F)F)NC(=O)C(C)(C)N1CCCCC1 ZINC001482835069 1105071728 /nfs/dbraw/zinc/07/17/28/1105071728.db2.gz ZESAOIUXFYVPKM-ZDUSSCGKSA-N 1 3 337.430 2.688 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H](C)NC(=O)C2(N(C)C)CCC2)c(C)s1 ZINC001482839404 1105078516 /nfs/dbraw/zinc/07/85/16/1105078516.db2.gz JMFKTXJPMFDDAF-ZDUSSCGKSA-N 1 3 337.533 2.834 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H]([NH2+]CCCCCF)[C@@H](C)C2)CC1 ZINC001667204728 1105079682 /nfs/dbraw/zinc/07/96/82/1105079682.db2.gz SDLGQCWTUIPMBN-ROUUACIJSA-N 1 3 341.515 2.685 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H](C)NC(=O)[C@H](C(C)C)N(C)C)c(C)s1 ZINC001482887660 1105137395 /nfs/dbraw/zinc/13/73/95/1105137395.db2.gz BVAWILZWHCLOJJ-DYVFJYSZSA-N 1 3 339.549 2.936 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CC[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001482889266 1105147388 /nfs/dbraw/zinc/14/73/88/1105147388.db2.gz PJHYLUOIBSRZRR-ZBFHGGJFSA-N 1 3 347.494 2.883 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CC[NH2+]Cc1c(C)cc(C)cc1C ZINC001482892278 1105151202 /nfs/dbraw/zinc/15/12/02/1105151202.db2.gz UYURWLFMXVBVFP-INIZCTEOSA-N 1 3 342.487 2.870 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1cc(F)ccc1C ZINC001482902523 1105159971 /nfs/dbraw/zinc/15/99/71/1105159971.db2.gz RPEILGQQNNVDQA-LPHOPBHVSA-N 1 3 349.494 2.993 10 0 EFAEHO CCN(CCNC/C=C\Cl)C(=O)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001482930130 1105188716 /nfs/dbraw/zinc/18/87/16/1105188716.db2.gz DISYFNHDNJDSOY-DIEDAUMRSA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(CCNC/C=C\Cl)C(=O)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001482930130 1105188718 /nfs/dbraw/zinc/18/87/18/1105188718.db2.gz DISYFNHDNJDSOY-DIEDAUMRSA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(CC[NH2+]CC1CCC(F)(F)CC1)C(=O)CN(C)C1CCC1 ZINC001482931424 1105190403 /nfs/dbraw/zinc/19/04/03/1105190403.db2.gz PPZZXBMEWPFFON-UHFFFAOYSA-N 1 3 345.478 2.734 10 0 EFAEHO Cc1ccc(CC[NH2+]CC[C@@H](C)NC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001668062082 1105228849 /nfs/dbraw/zinc/22/88/49/1105228849.db2.gz ZIVDUSQGFGNOPN-QUCCMNQESA-N 1 3 345.531 2.895 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cc(Cl)ccc1F)N(C)C ZINC001668106044 1105236718 /nfs/dbraw/zinc/23/67/18/1105236718.db2.gz KOWJZRKBSRJALD-BLLLJJGKSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1ccsc1 ZINC001668234273 1105263217 /nfs/dbraw/zinc/26/32/17/1105263217.db2.gz HGBDFHUQNHAKKA-RDJZCZTQSA-N 1 3 337.533 2.995 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]Cc1ccsc1 ZINC001668234272 1105263293 /nfs/dbraw/zinc/26/32/93/1105263293.db2.gz HGBDFHUQNHAKKA-NVXWUHKLSA-N 1 3 337.533 2.995 10 0 EFAEHO CCN(CC[NH2+]CC[C@H]1CCc2ccccc21)C(=O)[C@H]1CCCN1C ZINC001668382153 1105291066 /nfs/dbraw/zinc/29/10/66/1105291066.db2.gz UXAOQISLWPUZLA-UYAOXDASSA-N 1 3 343.515 2.639 10 0 EFAEHO CCN(CCNC/C=C/Cl)C(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001668528455 1105314826 /nfs/dbraw/zinc/31/48/26/1105314826.db2.gz HNWUJPJRHZATKL-ZBZNSMLMSA-N 1 3 341.927 2.974 10 0 EFAEHO CCN(CCNC/C=C/Cl)C(=O)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001668528455 1105314833 /nfs/dbraw/zinc/31/48/33/1105314833.db2.gz HNWUJPJRHZATKL-ZBZNSMLMSA-N 1 3 341.927 2.974 10 0 EFAEHO CC[C@H](F)CNC/C=C/CNC(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001668828934 1105380450 /nfs/dbraw/zinc/38/04/50/1105380450.db2.gz UKSCPOKONSRBAB-SGUAIBKKSA-N 1 3 339.499 2.651 10 0 EFAEHO CC[C@H](F)CNC/C=C/CNC(=O)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001668828934 1105380456 /nfs/dbraw/zinc/38/04/56/1105380456.db2.gz UKSCPOKONSRBAB-SGUAIBKKSA-N 1 3 339.499 2.651 10 0 EFAEHO C[NH+](C)CCCC(=O)NC/C=C\CN[C@@H]1CCc2c1cccc2Cl ZINC001669008757 1105415419 /nfs/dbraw/zinc/41/54/19/1105415419.db2.gz LZBJZZDJJQTEPJ-DDKKJVIOSA-N 1 3 349.906 2.931 10 0 EFAEHO C[NH+](C)CCC(=O)NC/C=C/CNCc1cc(Cl)cc(Cl)c1 ZINC001669020851 1105418779 /nfs/dbraw/zinc/41/87/79/1105418779.db2.gz KSCNGHFRUHRDQG-ONEGZZNKSA-N 1 3 344.286 2.707 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\C[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001669027013 1105419983 /nfs/dbraw/zinc/41/99/83/1105419983.db2.gz KDLQYEZCGXLCPE-OOFWQKGWSA-N 1 3 335.536 2.805 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NC/C=C\CNCc1cccc(Cl)c1 ZINC001669201192 1105455822 /nfs/dbraw/zinc/45/58/22/1105455822.db2.gz NNMFXCGAPMOSLT-JGPFYOFESA-N 1 3 349.906 2.975 10 0 EFAEHO CC(C)N(C)CC(=O)NC/C=C/C[NH2+]Cc1cccc2ccccc21 ZINC001669207637 1105458277 /nfs/dbraw/zinc/45/82/77/1105458277.db2.gz NSWYENPWTCAUQB-VOTSOKGWSA-N 1 3 339.483 2.942 10 0 EFAEHO CC(C)N(C)CC(=O)NC/C=C\C[NH2+]Cc1cccc2ccccc21 ZINC001669207636 1105458299 /nfs/dbraw/zinc/45/82/99/1105458299.db2.gz NSWYENPWTCAUQB-SREVYHEPSA-N 1 3 339.483 2.942 10 0 EFAEHO C[C@H](C[NH2+]CC/C=C/c1ccccc1)NC(=O)CN1CC[C@H](C)C1 ZINC001669399742 1105479906 /nfs/dbraw/zinc/47/99/06/1105479906.db2.gz MBEJDRCWEOZPJB-FWOBMTDDSA-N 1 3 329.488 2.526 10 0 EFAEHO C[C@@H](C[NH2+]CCCc1cccc(F)c1)NC(=O)C(C)(C)N1CCCC1 ZINC001669630669 1105502897 /nfs/dbraw/zinc/50/28/97/1105502897.db2.gz WUHTWPJSTZIRDZ-INIZCTEOSA-N 1 3 349.494 2.727 10 0 EFAEHO C[C@@H](C[NH2+]C/C=C\c1ccccc1)NC(=O)CN(C)CC(C)(C)C ZINC001669664263 1105506586 /nfs/dbraw/zinc/50/65/86/1105506586.db2.gz HBWPRTBNUIGHRF-GKUQOKNUSA-N 1 3 331.504 2.772 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C/CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001483019877 1105563136 /nfs/dbraw/zinc/56/31/36/1105563136.db2.gz QJRZAZMKLJVKGH-GNAXCBTBSA-N 1 3 347.478 2.771 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C/CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001483019877 1105563145 /nfs/dbraw/zinc/56/31/45/1105563145.db2.gz QJRZAZMKLJVKGH-GNAXCBTBSA-N 1 3 347.478 2.771 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[NH2+]Cc2cccc(Cl)c2)C1 ZINC001670245831 1105603744 /nfs/dbraw/zinc/60/37/44/1105603744.db2.gz GKBPIDSWVNSWLH-OAHLLOKOSA-N 1 3 337.895 2.620 10 0 EFAEHO Cc1cc(C[NH2+]CCCN(C)C(=O)CN2CC[C@@H](C)C2)c(C)s1 ZINC001670246125 1105603806 /nfs/dbraw/zinc/60/38/06/1105603806.db2.gz PIDPBKPVSSDFMJ-CQSZACIVSA-N 1 3 337.533 2.645 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)Cc1c[nH]cn1)c1ccc2c(c1)CCC2 ZINC001670261721 1105607411 /nfs/dbraw/zinc/60/74/11/1105607411.db2.gz UMOVBCIKXOZZNM-HNNXBMFYSA-N 1 3 340.471 2.640 10 0 EFAEHO CCCN(C)CC(=O)N(C)CCC[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC001670318425 1105616506 /nfs/dbraw/zinc/61/65/06/1105616506.db2.gz IZDAGOSZYHODMC-GOSISDBHSA-N 1 3 335.467 2.593 10 0 EFAEHO O=C(CN1CCCC1)N1CCC[C@H]1C[NH2+]CC/C=C\c1ccccc1 ZINC001671384368 1105632465 /nfs/dbraw/zinc/63/24/65/1105632465.db2.gz MAJPBXWLMBSRKR-VHLMXJOBSA-N 1 3 341.499 2.766 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)N[C@H](CNCCF)C1CCCC1 ZINC001671542818 1105655457 /nfs/dbraw/zinc/65/54/57/1105655457.db2.gz YBBANYOHKXKULK-QGZVFWFLSA-N 1 3 341.515 2.874 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)N[C@H](CNCCF)C1CCCC1 ZINC001671542818 1105655459 /nfs/dbraw/zinc/65/54/59/1105655459.db2.gz YBBANYOHKXKULK-QGZVFWFLSA-N 1 3 341.515 2.874 10 0 EFAEHO C[NH+](C)Cc1ccc(C(=O)N[C@H](CNCCF)C2CCCC2)cc1 ZINC001671558861 1105658882 /nfs/dbraw/zinc/65/88/82/1105658882.db2.gz KQLSJSILLHDAHK-GOSISDBHSA-N 1 3 335.467 2.596 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@](C)(C[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001671804357 1105706279 /nfs/dbraw/zinc/70/62/79/1105706279.db2.gz AJCHLQVAHREUKX-QFBILLFUSA-N 1 3 325.541 2.981 10 0 EFAEHO C[NH+](C)CC1(C(=O)NC/C=C/CNC/C=C/Cl)CCCCC1 ZINC001483037662 1105737560 /nfs/dbraw/zinc/73/75/60/1105737560.db2.gz PXSPKVTWTSOGDQ-HRCSPUOPSA-N 1 3 327.900 2.513 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[C@H](C[NH2+]C/C=C\Cl)CC2)C1 ZINC001672376878 1105817415 /nfs/dbraw/zinc/81/74/15/1105817415.db2.gz MHEUJDAFUWVADP-NVVWYSKVSA-N 1 3 341.927 2.593 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@H]2[C@@H]1CCN2CCC(F)(F)F ZINC001672538451 1105864442 /nfs/dbraw/zinc/86/44/42/1105864442.db2.gz QYNRZTPKTXUERV-GJZGRUSLSA-N 1 3 349.441 2.736 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](CC[NH2+]Cc2ccccc2F)C1)C1CCC1 ZINC001672806628 1105909697 /nfs/dbraw/zinc/90/96/97/1105909697.db2.gz ZHSGAVZTYRKEOF-MRXNPFEDSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@H](F)C[NH2+]CC[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001672863568 1105923153 /nfs/dbraw/zinc/92/31/53/1105923153.db2.gz OMIDNTXPOJSNMR-CVEARBPZSA-N 1 3 329.504 2.541 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1CC[C@H](C[NH2+]C/C=C\Cl)CC1 ZINC001672994952 1105956160 /nfs/dbraw/zinc/95/61/60/1105956160.db2.gz NWBJJVVMOAUAEH-FKMFNOHDSA-N 1 3 341.927 2.876 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(C)([NH2+]CCCC3CCC3)CC2)C1 ZINC001673982296 1106113736 /nfs/dbraw/zinc/11/37/36/1106113736.db2.gz SMNLKQHMUDUTBQ-QGZVFWFLSA-N 1 3 335.536 2.879 10 0 EFAEHO CCC/C=C/CC[N@H+](C)C[C@@H]1CCCN1C(=O)CN1CC[C@@H](C)C1 ZINC001674481297 1106200908 /nfs/dbraw/zinc/20/09/08/1106200908.db2.gz SBMWAODXTSMGDA-KAGICYHLSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[N@@H+](C)C[C@@H]1CCCN1C(=O)CN1CC[C@@H](C)C1 ZINC001674481297 1106200912 /nfs/dbraw/zinc/20/09/12/1106200912.db2.gz SBMWAODXTSMGDA-KAGICYHLSA-N 1 3 335.536 2.997 10 0 EFAEHO C[N@H+](CCC1=CCCCC1)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001674495488 1106204705 /nfs/dbraw/zinc/20/47/05/1106204705.db2.gz JYRGPRRNFYMKBN-LJQANCHMSA-N 1 3 333.520 2.896 10 0 EFAEHO C[N@@H+](CCC1=CCCCC1)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001674495488 1106204708 /nfs/dbraw/zinc/20/47/08/1106204708.db2.gz JYRGPRRNFYMKBN-LJQANCHMSA-N 1 3 333.520 2.896 10 0 EFAEHO C[C@H]1CCCC[C@H]1[NH+]1CCC(NCCc2cccc(C(N)=O)c2)CC1 ZINC000089545548 1106301868 /nfs/dbraw/zinc/30/18/68/1106301868.db2.gz FBLOGIUKGAYUMZ-OXJNMPFZSA-N 1 3 343.515 2.961 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)CCC[NH2+]C/C=C/Cl ZINC001675985495 1106460213 /nfs/dbraw/zinc/46/02/13/1106460213.db2.gz CNRMWNBRSHRMOJ-ZHANPKHBSA-N 1 3 329.916 2.876 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC/C=C\CNCc2csc(C)c2)C1 ZINC001483048957 1106479251 /nfs/dbraw/zinc/47/92/51/1106479251.db2.gz BFRSBMGUMTYHGW-PYTPGESOSA-N 1 3 349.544 2.941 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC/C=C\CNCc2csc(C)c2)C1 ZINC001483048957 1106479255 /nfs/dbraw/zinc/47/92/55/1106479255.db2.gz BFRSBMGUMTYHGW-PYTPGESOSA-N 1 3 349.544 2.941 10 0 EFAEHO CC[NH2+]CCCN(Cc1ccccc1)C(=O)CN1[C@H](C)CC[C@H]1C ZINC001676088641 1106484552 /nfs/dbraw/zinc/48/45/52/1106484552.db2.gz AORFTGBPXYSQHC-QZTJIDSGSA-N 1 3 331.504 2.888 10 0 EFAEHO CN(C(=O)C(C)(C)N1CCCCC1)[C@@H](C[NH2+]CCC1CC1)C1CC1 ZINC001676215006 1106499696 /nfs/dbraw/zinc/49/96/96/1106499696.db2.gz BBXCMCBQCRBSAX-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]CCCc1ccccc1 ZINC001676360155 1106519919 /nfs/dbraw/zinc/51/99/19/1106519919.db2.gz QTYDZTHYWWQAHU-QGZVFWFLSA-N 1 3 331.504 2.540 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1C[C@H](C)N(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001676784525 1106580055 /nfs/dbraw/zinc/58/00/55/1106580055.db2.gz WKNJSKDHJUBMNA-QFBILLFUSA-N 1 3 329.488 2.907 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H](C[NH2+]CCc3cccs3)C2)CCC1 ZINC001676933558 1106630468 /nfs/dbraw/zinc/63/04/68/1106630468.db2.gz YEOWTWLDSLJPAI-HOTGVXAUSA-N 1 3 349.544 2.649 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CC[C@H](C[NH2+]CCC2CCCC2)C1 ZINC001676970233 1106639639 /nfs/dbraw/zinc/63/96/39/1106639639.db2.gz MYMRWGUWWZTPQM-IRXDYDNUSA-N 1 3 332.492 2.715 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2C[C@@H]([NH2+]CCCF)C(C)(C)C2)c1 ZINC001677043945 1106656277 /nfs/dbraw/zinc/65/62/77/1106656277.db2.gz WPKIGKPDCFDCRL-QGZVFWFLSA-N 1 3 335.467 2.548 10 0 EFAEHO Cc1c(C)c(C)c(CN2CC[C@@H]2CNC(=O)CC[NH+](C)C)c(C)c1C ZINC001483675510 1107415591 /nfs/dbraw/zinc/41/55/91/1107415591.db2.gz BJBXCCCTQJKESR-LJQANCHMSA-N 1 3 345.531 2.871 10 0 EFAEHO c1[nH]nc2cc(CN[C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)ccc12 ZINC000904476563 1107964600 /nfs/dbraw/zinc/96/46/00/1107964600.db2.gz UELIOFMDYQWXOK-ICSRJNTNSA-N 1 3 334.423 2.908 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](CC[NH2+]CCCC2CCCC2)C1 ZINC001272385124 1108139702 /nfs/dbraw/zinc/13/97/02/1108139702.db2.gz VHVQAGUSGTWHIY-MOPGFXCFSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)cc1F ZINC001272384862 1108139796 /nfs/dbraw/zinc/13/97/96/1108139796.db2.gz SPTRREIMEXCFLV-APWZRJJASA-N 1 3 347.478 2.557 10 0 EFAEHO C[C@@H]([NH2+]CCc1cccs1)[C@H](C)NC(=O)CN(C)CC(C)(C)C ZINC001409406947 1108201408 /nfs/dbraw/zinc/20/14/08/1108201408.db2.gz XOGVQRHXODTLSE-CABCVRRESA-N 1 3 339.549 2.751 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1c(C)cc(C)cc1C ZINC001409434036 1108353077 /nfs/dbraw/zinc/35/30/77/1108353077.db2.gz NVSPTMNVIJYGIB-ROUUACIJSA-N 1 3 333.520 2.936 10 0 EFAEHO CCCN(C)CC(=O)NC/C=C\C[NH2+][C@H]1CCc2c1cccc2Cl ZINC001483087559 1108486275 /nfs/dbraw/zinc/48/62/75/1108486275.db2.gz QOLXTZCJMRATAH-XDXAGZTOSA-N 1 3 349.906 2.931 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(Cl)cc2)C1 ZINC001272524474 1108616866 /nfs/dbraw/zinc/61/68/66/1108616866.db2.gz RYRCOGWZPSEHPU-SJLPKXTDSA-N 1 3 349.906 2.762 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[C@@H]1CCC[N@@H+]1Cc1ccccc1 ZINC001266244107 1108665250 /nfs/dbraw/zinc/66/52/50/1108665250.db2.gz IRDDKPDTHSSUPL-GOSISDBHSA-N 1 3 340.471 2.822 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC001266244107 1108665256 /nfs/dbraw/zinc/66/52/56/1108665256.db2.gz IRDDKPDTHSSUPL-GOSISDBHSA-N 1 3 340.471 2.822 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[C@H]1CCC[N@@H+]1Cc1ccccc1 ZINC001266244108 1108666001 /nfs/dbraw/zinc/66/60/01/1108666001.db2.gz IRDDKPDTHSSUPL-SFHVURJKSA-N 1 3 340.471 2.822 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC001266244108 1108666002 /nfs/dbraw/zinc/66/60/02/1108666002.db2.gz IRDDKPDTHSSUPL-SFHVURJKSA-N 1 3 340.471 2.822 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)CN(C)C3CCC3)C2)cc1F ZINC001409286655 1109382455 /nfs/dbraw/zinc/38/24/55/1109382455.db2.gz KYUSTZLONZBSJE-UHFFFAOYSA-N 1 3 347.478 2.603 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+][C@@H](C)c2ccccc2F)C1 ZINC001409291304 1109394358 /nfs/dbraw/zinc/39/43/58/1109394358.db2.gz QRVFGBMDRJISBY-FHERZECASA-N 1 3 335.467 2.711 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC3CCC=CCC3)CC2)CC1 ZINC000899805856 1109496202 /nfs/dbraw/zinc/49/62/02/1109496202.db2.gz YMMNOQNLCUYBQU-UHFFFAOYSA-N 1 3 333.520 2.798 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccccc1C1CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001483167294 1109923906 /nfs/dbraw/zinc/92/39/06/1109923906.db2.gz YISHIIPYANIXPE-JKSUJKDBSA-N 1 3 329.488 2.500 10 0 EFAEHO CCc1ccc(CC[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCCN2CC)cc1 ZINC001483197462 1109996831 /nfs/dbraw/zinc/99/68/31/1109996831.db2.gz KHFUDIFIVQSHGM-YLJYHZDGSA-N 1 3 345.531 2.760 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)NCC1(NCc2ccsc2)CC1 ZINC001483745980 1111153066 /nfs/dbraw/zinc/15/30/66/1111153066.db2.gz KZVODQKPSGETRF-MRXNPFEDSA-N 1 3 335.517 2.607 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NCC1(NCc2ccsc2)CC1 ZINC001483745980 1111153069 /nfs/dbraw/zinc/15/30/69/1111153069.db2.gz KZVODQKPSGETRF-MRXNPFEDSA-N 1 3 335.517 2.607 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@H](CC[NH2+]CC3CC(C)(C)C3)C2)CC1 ZINC001272598663 1111533382 /nfs/dbraw/zinc/53/33/82/1111533382.db2.gz IJVJZLCZGBHEIX-GOSISDBHSA-N 1 3 349.563 2.983 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@H]1CCN(C(=O)[C@H](CC)N(C)C)C1 ZINC001272616747 1111749196 /nfs/dbraw/zinc/74/91/96/1111749196.db2.gz OXBGTXGUVPDGSV-PXNSSMCTSA-N 1 3 345.531 2.917 10 0 EFAEHO CC[C@@H](C)C[NH+]1CCC(C)(NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001483971796 1112603466 /nfs/dbraw/zinc/60/34/66/1112603466.db2.gz WFSQUFZZALHBQC-MRXNPFEDSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H](F)CC[NH+]1CCC(C)(NC(=O)[C@@H](C)N2CCCCCC2)CC1 ZINC001483973035 1112614429 /nfs/dbraw/zinc/61/44/29/1112614429.db2.gz QEJIUESUCRISBM-IAGOWNOFSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H](F)CC[NH+]1CCC(C)(NC(=O)[C@H](C)N2CCCCCC2)CC1 ZINC001483973036 1112614570 /nfs/dbraw/zinc/61/45/70/1112614570.db2.gz QEJIUESUCRISBM-IRXDYDNUSA-N 1 3 341.515 2.970 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC1(C)CCN(CCC(F)(F)F)CC1 ZINC001483974942 1112616840 /nfs/dbraw/zinc/61/68/40/1112616840.db2.gz XJONSJQCKCATNJ-UHFFFAOYSA-N 1 3 337.430 2.641 10 0 EFAEHO CC[C@@H](C(=O)NCC1(C)CC[NH+](Cc2ccsc2)CC1)N(C)C ZINC001484145417 1112822889 /nfs/dbraw/zinc/82/28/89/1112822889.db2.gz VRFUBMYEIAKHKU-INIZCTEOSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[N@H+](C)[C@@H](C(=O)NC[C@@]1(C)CCCN(CCF)C1)c1ccccc1 ZINC001484174115 1112888494 /nfs/dbraw/zinc/88/84/94/1112888494.db2.gz ONFAQZXFSMJLMB-UYAOXDASSA-N 1 3 349.494 2.867 10 0 EFAEHO CC[N@@H+](C)[C@@H](C(=O)NC[C@@]1(C)CCCN(CCF)C1)c1ccccc1 ZINC001484174115 1112888497 /nfs/dbraw/zinc/88/84/97/1112888497.db2.gz ONFAQZXFSMJLMB-UYAOXDASSA-N 1 3 349.494 2.867 10 0 EFAEHO CCN(C)[C@@H](C(=O)NC[C@@]1(C)CCC[N@H+](CCF)C1)c1ccccc1 ZINC001484174115 1112888500 /nfs/dbraw/zinc/88/85/00/1112888500.db2.gz ONFAQZXFSMJLMB-UYAOXDASSA-N 1 3 349.494 2.867 10 0 EFAEHO CCN(C)[C@@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CCF)C1)c1ccccc1 ZINC001484174115 1112888502 /nfs/dbraw/zinc/88/85/02/1112888502.db2.gz ONFAQZXFSMJLMB-UYAOXDASSA-N 1 3 349.494 2.867 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001484195940 1112912157 /nfs/dbraw/zinc/91/21/57/1112912157.db2.gz OFBRKDVCIQFEKF-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001484195940 1112912164 /nfs/dbraw/zinc/91/21/64/1112912164.db2.gz OFBRKDVCIQFEKF-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](CC[NH2+]CCCC(C)(C)C)C2)C1 ZINC001484537927 1112992046 /nfs/dbraw/zinc/99/20/46/1112992046.db2.gz PYEUFWGCTHHHQL-ROUUACIJSA-N 1 3 337.552 2.983 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](CC[NH2+]CCc2ccccc2F)C1)N(C)C ZINC001484537984 1112992295 /nfs/dbraw/zinc/99/22/95/1112992295.db2.gz RCQGNFXJMYMZEW-LPHOPBHVSA-N 1 3 349.494 2.537 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+]C[C@@H]2CCC(F)(F)C2)C1 ZINC001484550130 1113002457 /nfs/dbraw/zinc/00/24/57/1113002457.db2.gz QCMVWCWUZNAOTI-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](C[C@H](C)CC(C)C)CC2 ZINC001484581043 1113034256 /nfs/dbraw/zinc/03/42/56/1113034256.db2.gz BSGNKIMJPVPFQB-GOSISDBHSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+]CC2=CCCCC2)CCC1 ZINC001484637083 1113089179 /nfs/dbraw/zinc/08/91/79/1113089179.db2.gz QFFHJDBOKYTYLA-GOSISDBHSA-N 1 3 333.520 2.990 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(CNC(=O)[C@@H]2CCCCN2C(C)C)CCC1 ZINC001484655041 1113094582 /nfs/dbraw/zinc/09/45/82/1113094582.db2.gz JEAMGFNHXULEMH-HOTGVXAUSA-N 1 3 327.488 2.626 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(CNC(=O)[C@H]2CCCCN2C(C)C)CCC1 ZINC001484655043 1113094628 /nfs/dbraw/zinc/09/46/28/1113094628.db2.gz JEAMGFNHXULEMH-JKSUJKDBSA-N 1 3 327.488 2.626 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@]2(CC[N@H+](CCC(F)(F)F)C2)C1 ZINC001484831552 1117766385 /nfs/dbraw/zinc/76/63/85/1117766385.db2.gz SKQHLLZGXWAXSW-INIZCTEOSA-N 1 3 349.441 2.594 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@]2(CC[N@@H+](CCC(F)(F)F)C2)C1 ZINC001484831552 1117766386 /nfs/dbraw/zinc/76/63/86/1117766386.db2.gz SKQHLLZGXWAXSW-INIZCTEOSA-N 1 3 349.441 2.594 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1C ZINC001484909445 1117822910 /nfs/dbraw/zinc/82/29/10/1117822910.db2.gz NHZJGXPMTJIWNV-HKUYNNGSSA-N 1 3 331.504 2.580 10 0 EFAEHO COc1ccc(C[N@@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001484987702 1117913668 /nfs/dbraw/zinc/91/36/68/1117913668.db2.gz GMILYNLVZLDTTR-SJLPKXTDSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(C[N@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001484987702 1117913670 /nfs/dbraw/zinc/91/36/70/1117913670.db2.gz GMILYNLVZLDTTR-SJLPKXTDSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(C[N@@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001484987700 1117914107 /nfs/dbraw/zinc/91/41/07/1117914107.db2.gz GMILYNLVZLDTTR-AEFFLSMTSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(C[N@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001484987700 1117914111 /nfs/dbraw/zinc/91/41/11/1117914111.db2.gz GMILYNLVZLDTTR-AEFFLSMTSA-N 1 3 347.503 2.505 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@H](C)[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001484994338 1117928984 /nfs/dbraw/zinc/92/89/84/1117928984.db2.gz KHTCXSVPCTVNBS-XHSDSOJGSA-N 1 3 347.494 2.883 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCCC[C@H]2C[NH2+]CCCC2CCC2)C1 ZINC001485039726 1117972456 /nfs/dbraw/zinc/97/24/56/1117972456.db2.gz XIURFQGWECLAIX-MJGOQNOKSA-N 1 3 335.536 2.879 10 0 EFAEHO CC1CCN(CC(=O)N2CCCC[C@H]2C[NH2+]CCCCCF)CC1 ZINC001485040575 1117973092 /nfs/dbraw/zinc/97/30/92/1117973092.db2.gz NBVVXDIBQZCVFC-SFHVURJKSA-N 1 3 341.515 2.829 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@H]1C[N@H+](C)Cc1ccccc1 ZINC001485057554 1117994888 /nfs/dbraw/zinc/99/48/88/1117994888.db2.gz FZIPCGVJJHRELZ-RBUKOAKNSA-N 1 3 349.494 2.789 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@H]1C[N@@H+](C)Cc1ccccc1 ZINC001485057554 1117994893 /nfs/dbraw/zinc/99/48/93/1117994893.db2.gz FZIPCGVJJHRELZ-RBUKOAKNSA-N 1 3 349.494 2.789 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+](C)C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001485078443 1118021552 /nfs/dbraw/zinc/02/15/52/1118021552.db2.gz GCHVKBVRELXOFS-LJQANCHMSA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+](C)C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001485078443 1118021557 /nfs/dbraw/zinc/02/15/57/1118021557.db2.gz GCHVKBVRELXOFS-LJQANCHMSA-N 1 3 349.494 2.897 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@H+](C)CCc1cccs1 ZINC001485080270 1118029364 /nfs/dbraw/zinc/02/93/64/1118029364.db2.gz SLEFYAXUJBJLMU-MRXNPFEDSA-N 1 3 337.533 2.554 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@@H+](C)CCc1cccs1 ZINC001485080270 1118029367 /nfs/dbraw/zinc/02/93/67/1118029367.db2.gz SLEFYAXUJBJLMU-MRXNPFEDSA-N 1 3 337.533 2.554 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)[C@H](C)[NH2+]CCc1ccccc1F ZINC001485181227 1118115898 /nfs/dbraw/zinc/11/58/98/1118115898.db2.gz RAKCPCLRYNGSMX-HOTGVXAUSA-N 1 3 349.494 2.725 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)cc1C ZINC001485218599 1118138066 /nfs/dbraw/zinc/13/80/66/1118138066.db2.gz XACSQVYROZPISJ-GJZGRUSLSA-N 1 3 339.911 2.973 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001485214219 1118150903 /nfs/dbraw/zinc/15/09/03/1118150903.db2.gz FKMSBWUTYXTPRE-QWHCGFSZSA-N 1 3 343.874 2.804 10 0 EFAEHO C[C@@H](CNC(=O)c1cccc(CN(C)C)c1)[N@H+](C)CC1CCCC1 ZINC001485390533 1118317381 /nfs/dbraw/zinc/31/73/81/1118317381.db2.gz USYOIBDVKXMJQO-INIZCTEOSA-N 1 3 331.504 2.989 10 0 EFAEHO C[C@@H](CNC(=O)c1cccc(CN(C)C)c1)[N@@H+](C)CC1CCCC1 ZINC001485390533 1118317385 /nfs/dbraw/zinc/31/73/85/1118317385.db2.gz USYOIBDVKXMJQO-INIZCTEOSA-N 1 3 331.504 2.989 10 0 EFAEHO Cc1ccncc1C[NH2+]CC1(NC(=O)CN(C)C(C)C)CCCCC1 ZINC001485459499 1118382803 /nfs/dbraw/zinc/38/28/03/1118382803.db2.gz UHYJHDLAECOXJO-UHFFFAOYSA-N 1 3 346.519 2.639 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C1C[NH+](CC[C@H]2CCCC2(F)F)C1 ZINC001485532936 1118444147 /nfs/dbraw/zinc/44/41/47/1118444147.db2.gz LQEVOEGCSGSYLO-GDBMZVCRSA-N 1 3 345.478 2.590 10 0 EFAEHO CCc1ccc(CN2CC([C@H](C)NC(=O)C[C@H]3CC[N@H+](C)C3)C2)cc1 ZINC001485534121 1118445433 /nfs/dbraw/zinc/44/54/33/1118445433.db2.gz YPMKWLYKPWSDMH-QFBILLFUSA-N 1 3 343.515 2.527 10 0 EFAEHO CCc1ccc(CN2CC([C@H](C)NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)cc1 ZINC001485534121 1118445437 /nfs/dbraw/zinc/44/54/37/1118445437.db2.gz YPMKWLYKPWSDMH-QFBILLFUSA-N 1 3 343.515 2.527 10 0 EFAEHO CC(C)(C)CC[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001485612553 1118487091 /nfs/dbraw/zinc/48/70/91/1118487091.db2.gz QDRNSMXLBLXSCZ-OSYLJGHBSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)(C)CC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001485612553 1118487094 /nfs/dbraw/zinc/48/70/94/1118487094.db2.gz QDRNSMXLBLXSCZ-OSYLJGHBSA-N 1 3 335.536 2.591 10 0 EFAEHO CCCCCC[N@@H+]1CCCC2(CN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001485663120 1118512562 /nfs/dbraw/zinc/51/25/62/1118512562.db2.gz SOZUEBMPIVPOMY-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCCC[N@H+]1CCCC2(CN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001485663120 1118512567 /nfs/dbraw/zinc/51/25/67/1118512567.db2.gz SOZUEBMPIVPOMY-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO CC(C)(C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C\Cl)C1)[NH+]1CCCC1 ZINC001485691557 1118522245 /nfs/dbraw/zinc/52/22/45/1118522245.db2.gz ANPHGIFKSIISOA-ZAECQBEJSA-N 1 3 348.318 2.664 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1C[C@H](C[NH2+]CCC2CCCC2)C1 ZINC001485705151 1118529485 /nfs/dbraw/zinc/52/94/85/1118529485.db2.gz NLRYGNARVCBPNV-PSBWJHGTSA-N 1 3 335.536 2.924 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CCc2ccccc2)C1 ZINC001485706763 1118530709 /nfs/dbraw/zinc/53/07/09/1118530709.db2.gz OLXJQBFQXAOKSC-UFYCRDLUSA-N 1 3 343.515 2.588 10 0 EFAEHO C[C@@H](CCC[NH2+]Cc1ccc(F)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001485739259 1118551555 /nfs/dbraw/zinc/55/15/55/1118551555.db2.gz OTXDBIMRNKMJAL-HOTGVXAUSA-N 1 3 335.467 2.542 10 0 EFAEHO C[C@H](CCC[NH2+]Cc1ccc(F)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001485739260 1118551850 /nfs/dbraw/zinc/55/18/50/1118551850.db2.gz OTXDBIMRNKMJAL-HZPDHXFCSA-N 1 3 335.467 2.542 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1([NH2+]CC/C=C/c2ccccc2)CC1 ZINC001670891927 1120694877 /nfs/dbraw/zinc/69/48/77/1120694877.db2.gz RNXQETXLXMPNPP-WEVVVXLNSA-N 1 3 338.455 2.603 10 0 EFAEHO N[C@H](CC[N@@H+]1CCCC[C@@H]1CO)c1cccc(Br)c1 ZINC000053941662 214206262 /nfs/dbraw/zinc/20/62/62/214206262.db2.gz OZCDHXBKQSQLHG-HUUCEWRRSA-N 1 3 327.266 2.686 10 0 EFAEHO N[C@H](CC[N@H+]1CCCC[C@@H]1CO)c1cccc(Br)c1 ZINC000053941662 214206265 /nfs/dbraw/zinc/20/62/65/214206265.db2.gz OZCDHXBKQSQLHG-HUUCEWRRSA-N 1 3 327.266 2.686 10 0 EFAEHO [NH3+][C@H](CCN1CCCC[C@@H]1CO)c1cccc(Br)c1 ZINC000053941662 214206267 /nfs/dbraw/zinc/20/62/67/214206267.db2.gz OZCDHXBKQSQLHG-HUUCEWRRSA-N 1 3 327.266 2.686 10 0 EFAEHO C[NH+](C)Cc1ccccc1CNCc1ccc(-n2cncn2)c(F)c1 ZINC000055472468 214325712 /nfs/dbraw/zinc/32/57/12/214325712.db2.gz WJMGCSHXUJPTPX-UHFFFAOYSA-N 1 3 339.418 2.758 10 0 EFAEHO O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@@H]1C[C@H]2CCCC[C@H]2[NH2+]1 ZINC000261709971 295677953 /nfs/dbraw/zinc/67/79/53/295677953.db2.gz PNNZJDUPZZDWEG-YSTOQKLRSA-N 1 3 341.499 2.860 10 0 EFAEHO C[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1oc2ccccc2c1CN(C)C ZINC000174849925 231324886 /nfs/dbraw/zinc/32/48/86/231324886.db2.gz HEVCCZDIFUYLNP-HUUCEWRRSA-N 1 3 341.455 2.803 10 0 EFAEHO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1oc2ccccc2c1CN(C)C ZINC000174849925 231324889 /nfs/dbraw/zinc/32/48/89/231324889.db2.gz HEVCCZDIFUYLNP-HUUCEWRRSA-N 1 3 341.455 2.803 10 0 EFAEHO CN(CCN(C)C1CC[NH+](C)CC1)Cc1ccc2ccccc2n1 ZINC000180954391 529903539 /nfs/dbraw/zinc/90/35/39/529903539.db2.gz QXGKWYGTNZTVIG-UHFFFAOYSA-N 1 3 326.488 2.693 10 0 EFAEHO CN1CCC(N2CCC([NH2+][C@@H]3CCC[C@@H]([C@H]4CCOC4)C3)CC2)CC1 ZINC000361895475 282697797 /nfs/dbraw/zinc/69/77/97/282697797.db2.gz XXRRJFHCDIYBDD-WSTZPKSXSA-N 1 3 349.563 2.730 10 0 EFAEHO CN1CC[C@@H](NC(=O)CC[C@H]2CCCC[N@@H+]2C)[C@H]1c1ccccc1 ZINC000355243418 283047557 /nfs/dbraw/zinc/04/75/57/283047557.db2.gz STERXLQTEOAMBG-QWFCFKBJSA-N 1 3 329.488 2.813 10 0 EFAEHO CN1CC[C@@H](NC(=O)CC[C@H]2CCCC[N@H+]2C)[C@H]1c1ccccc1 ZINC000355243418 283047559 /nfs/dbraw/zinc/04/75/59/283047559.db2.gz STERXLQTEOAMBG-QWFCFKBJSA-N 1 3 329.488 2.813 10 0 EFAEHO CN(C)C[C@@H](Cc1ccccc1)NC(=O)CC1(C[NH3+])CCCCC1 ZINC000184227352 235340893 /nfs/dbraw/zinc/34/08/93/235340893.db2.gz XCWAWEQDQKROBO-GOSISDBHSA-N 1 3 331.504 2.575 10 0 EFAEHO CN(C)C[C@H](Cc1ccccc1)NC(=O)CC1(C[NH3+])CCCCC1 ZINC000184227370 235341342 /nfs/dbraw/zinc/34/13/42/235341342.db2.gz XCWAWEQDQKROBO-SFHVURJKSA-N 1 3 331.504 2.575 10 0 EFAEHO CN(CC1([NH+](C)C)CCC1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000186771334 236012959 /nfs/dbraw/zinc/01/29/59/236012959.db2.gz DFANNVUHOSHODZ-MSOLQXFVSA-N 1 3 344.503 2.558 10 0 EFAEHO C[NH+](C)C1CCN([C@H](CN)c2cc(Br)cs2)CC1 ZINC000036191715 213075935 /nfs/dbraw/zinc/07/59/35/213075935.db2.gz NCVPYNIICXCTBZ-GFCCVEGCSA-N 1 3 332.311 2.536 10 0 EFAEHO C[C@H](NC[C@H]1CC[N@H+](C)C1)c1ccc(I)cc1 ZINC000037646834 213160939 /nfs/dbraw/zinc/16/09/39/213160939.db2.gz MRTPJLWNQUUFAC-NWDGAFQWSA-N 1 3 344.240 2.894 10 0 EFAEHO C[C@H](NC[C@H]1CC[N@@H+](C)C1)c1ccc(I)cc1 ZINC000037646834 213160942 /nfs/dbraw/zinc/16/09/42/213160942.db2.gz MRTPJLWNQUUFAC-NWDGAFQWSA-N 1 3 344.240 2.894 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)[C@H]2CC[C@@H]([NH3+])C2)CCN1Cc1ccccc1 ZINC000246714094 243299498 /nfs/dbraw/zinc/29/94/98/243299498.db2.gz XCWMYOAPWSCWKQ-QXCFHYIPSA-N 1 3 329.488 2.625 10 0 EFAEHO C[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000247207668 243395059 /nfs/dbraw/zinc/39/50/59/243395059.db2.gz LWMFFJPHIBUPSP-APWZRJJASA-N 1 3 327.472 2.591 10 0 EFAEHO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000247207668 243395064 /nfs/dbraw/zinc/39/50/64/243395064.db2.gz LWMFFJPHIBUPSP-APWZRJJASA-N 1 3 327.472 2.591 10 0 EFAEHO CN1CCN(c2cc(NCC[NH+](C)C)c3cc(Cl)ccc3n2)CC1 ZINC000253495280 244005207 /nfs/dbraw/zinc/00/52/07/244005207.db2.gz UGZCIJQBSOPDLC-UHFFFAOYSA-N 1 3 347.894 2.614 10 0 EFAEHO C[C@@H](CCC(C)(C)C)[NH2+]CC1(N2CCOCC2)CCN(C)CC1 ZINC000414185628 244037080 /nfs/dbraw/zinc/03/70/80/244037080.db2.gz GVQXTJMTNGFTFE-KRWDZBQOSA-N 1 3 325.541 2.587 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1)C(C)(C)C ZINC000414320821 244088126 /nfs/dbraw/zinc/08/81/26/244088126.db2.gz CUVSERMBVOSCCF-HNNXBMFYSA-N 1 3 331.504 2.908 10 0 EFAEHO CC(C)[C@H](Cc1ccc(F)cc1)[N@H+](C)C[C@@H]1CCCN(C(=O)CN)C1 ZINC000414738419 244319598 /nfs/dbraw/zinc/31/95/98/244319598.db2.gz IJTLWVFDWWJZGL-HKUYNNGSSA-N 1 3 349.494 2.522 10 0 EFAEHO CC(C)[C@H](Cc1ccc(F)cc1)[N@@H+](C)C[C@@H]1CCCN(C(=O)CN)C1 ZINC000414738419 244319606 /nfs/dbraw/zinc/31/96/06/244319606.db2.gz IJTLWVFDWWJZGL-HKUYNNGSSA-N 1 3 349.494 2.522 10 0 EFAEHO Cc1cc2c(ncnc2N2CCN(C[C@@H]3CC[NH2+][C@H](C)C3)CC2)s1 ZINC000414752485 244327255 /nfs/dbraw/zinc/32/72/55/244327255.db2.gz KUHSECUXYADUAY-UKRRQHHQSA-N 1 3 345.516 2.510 10 0 EFAEHO C[C@@H](CC(=O)NCCc1ccccc1)[NH2+]CC1(N)CCCCCC1 ZINC000414858641 244374857 /nfs/dbraw/zinc/37/48/57/244374857.db2.gz KIGJJEMSWMLKPY-KRWDZBQOSA-N 1 3 331.504 2.765 10 0 EFAEHO CCN(C(=O)C1CC[NH2+]CC1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000237033646 284141849 /nfs/dbraw/zinc/14/18/49/284141849.db2.gz MLXVQGAHUGDERI-QFBILLFUSA-N 1 3 329.488 2.670 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCN(C(=O)NC[C@@H]2CCC[NH2+]C2)CC1 ZINC000418325104 245122241 /nfs/dbraw/zinc/12/22/41/245122241.db2.gz WNIDEGWJBFHKCQ-MRXNPFEDSA-N 1 3 338.540 2.528 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)NC[C@@H](N)c1ccc(C(C)C)cc1 ZINC000418120600 245113102 /nfs/dbraw/zinc/11/31/02/245113102.db2.gz VZBNESIVPNGTFG-CRAIPNDOSA-N 1 3 334.508 2.839 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCN(C(=O)NCC[C@@H]2CC[NH2+]C2)CC1 ZINC000418340039 245127233 /nfs/dbraw/zinc/12/72/33/245127233.db2.gz NAYKFJKCDYUVFH-INIZCTEOSA-N 1 3 338.540 2.528 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[NH3+])[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418434620 245157606 /nfs/dbraw/zinc/15/76/06/245157606.db2.gz VXLDCPMKJGMYKA-DOTOQJQBSA-N 1 3 332.492 2.591 10 0 EFAEHO C[N@H+](CCNC(=O)c1cccc(CN2CCCC2)c1)C1CCCC1 ZINC000264179855 246146355 /nfs/dbraw/zinc/14/63/55/246146355.db2.gz MKHWYDNWTPQKMM-UHFFFAOYSA-N 1 3 329.488 2.887 10 0 EFAEHO C[N@@H+](CCNC(=O)c1cccc(CN2CCCC2)c1)C1CCCC1 ZINC000264179855 246146361 /nfs/dbraw/zinc/14/63/61/246146361.db2.gz MKHWYDNWTPQKMM-UHFFFAOYSA-N 1 3 329.488 2.887 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@H](C)c1ccc(Br)cc1F ZINC000423116194 246575007 /nfs/dbraw/zinc/57/50/07/246575007.db2.gz ZVDSOVDKZSIYME-ZYHUDNBSSA-N 1 3 333.245 2.993 10 0 EFAEHO CCN1CCN(Cc2ccc(C[NH2+][C@H]3CC[C@@H]3SC)cc2)CC1 ZINC000425358554 247057559 /nfs/dbraw/zinc/05/75/59/247057559.db2.gz OTPFRNOSGMIZJZ-OALUTQOASA-N 1 3 333.545 2.808 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)c2ccc(C[NH+]3CCCC3)cc2)CCN1C ZINC000265988241 248000267 /nfs/dbraw/zinc/00/02/67/248000267.db2.gz LIBPLTQVWUNUMK-QFBILLFUSA-N 1 3 329.488 2.837 10 0 EFAEHO C[C@H]1[C@@H](c2ccccc2)CCN1CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000434895914 248196479 /nfs/dbraw/zinc/19/64/79/248196479.db2.gz MLTLRLGHOPFUTN-JXFKEZNVSA-N 1 3 341.499 2.607 10 0 EFAEHO COc1cc(CNCc2ccc(C[NH+](C)C)cc2)cc2c1OCO2 ZINC000012904051 211478548 /nfs/dbraw/zinc/47/85/48/211478548.db2.gz GLXNIPOMLCBTPO-UHFFFAOYSA-N 1 3 328.412 2.775 10 0 EFAEHO CCO[C@@H](CC[NH+](C)C)CNCc1cnc(-c2ccncc2)s1 ZINC000441706388 250048983 /nfs/dbraw/zinc/04/89/83/250048983.db2.gz WYSVAEQJDLJFAO-HNNXBMFYSA-N 1 3 334.489 2.652 10 0 EFAEHO CC(C)NC(=O)CC[N@H+](C)CCC1CCN(c2ccncc2)CC1 ZINC000092821579 218171363 /nfs/dbraw/zinc/17/13/63/218171363.db2.gz MATVVNJUWKYUJO-UHFFFAOYSA-N 1 3 332.492 2.535 10 0 EFAEHO CC(C)NC(=O)CC[N@@H+](C)CCC1CCN(c2ccncc2)CC1 ZINC000092821579 218171367 /nfs/dbraw/zinc/17/13/67/218171367.db2.gz MATVVNJUWKYUJO-UHFFFAOYSA-N 1 3 332.492 2.535 10 0 EFAEHO CN1CCN(CC[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)CC1(C)C ZINC000442878701 250134172 /nfs/dbraw/zinc/13/41/72/250134172.db2.gz ULOXWCLVBAXNBM-UYAOXDASSA-N 1 3 345.531 2.770 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NCCN2CCCC(C)(C)C2)CC1 ZINC000445149536 250389682 /nfs/dbraw/zinc/38/96/82/250389682.db2.gz FVYCHTXOGIPLBH-UHFFFAOYSA-N 1 3 338.540 2.530 10 0 EFAEHO CSc1cccc(C(=O)NC2CCN(C3CC[NH+](C)CC3)CC2)c1 ZINC000449823113 251167973 /nfs/dbraw/zinc/16/79/73/251167973.db2.gz ZBJREUIWNCNVPG-UHFFFAOYSA-N 1 3 347.528 2.697 10 0 EFAEHO CCN(Cc1ccccc1N(C)C1CC[NH+](C)CC1)[C@@H]1CCOC1 ZINC000361236167 285118494 /nfs/dbraw/zinc/11/84/94/285118494.db2.gz HRTODHMMOLTGSK-LJQANCHMSA-N 1 3 331.504 2.828 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)Cc1cc2cccnc2o1 ZINC000449325634 285281960 /nfs/dbraw/zinc/28/19/60/285281960.db2.gz OHDZBNQANOHHOA-KRWDZBQOSA-N 1 3 330.476 2.676 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)Cc1cc2cccnc2o1 ZINC000449325634 285281961 /nfs/dbraw/zinc/28/19/61/285281961.db2.gz OHDZBNQANOHHOA-KRWDZBQOSA-N 1 3 330.476 2.676 10 0 EFAEHO Cn1nccc1[C@@H]1OCC[C@H]1C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000328629021 258030403 /nfs/dbraw/zinc/03/04/03/258030403.db2.gz HTZQDFCACMJCFF-OXJNMPFZSA-N 1 3 346.519 2.884 10 0 EFAEHO Cn1nccc1[C@@H]1OCC[C@H]1CNC1CC[NH+](C2CCCCC2)CC1 ZINC000328629021 258030404 /nfs/dbraw/zinc/03/04/04/258030404.db2.gz HTZQDFCACMJCFF-OXJNMPFZSA-N 1 3 346.519 2.884 10 0 EFAEHO CCCN1CC2(C[C@@H]1C(=O)NCCc1ccccc1)CC[NH+](C)CC2 ZINC000072470605 258065062 /nfs/dbraw/zinc/06/50/62/258065062.db2.gz WGRQZWZLFOMKCY-LJQANCHMSA-N 1 3 343.515 2.542 10 0 EFAEHO CCC[NH+]1CCC(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CC1 ZINC000340112603 141744034 /nfs/dbraw/zinc/74/40/34/141744034.db2.gz NJDVSILPEHTKNQ-MOPGFXCFSA-N 1 3 344.503 2.605 10 0 EFAEHO C[N@H+](CCN1CCN(CC[C@H]2CCCCO2)CC1)Cc1ccccc1 ZINC000347472501 142222816 /nfs/dbraw/zinc/22/28/16/142222816.db2.gz ZKQNUYPAEMEFAS-OAQYLSRUSA-N 1 3 345.531 2.695 10 0 EFAEHO C[N@@H+](CCN1CCN(CC[C@H]2CCCCO2)CC1)Cc1ccccc1 ZINC000347472501 142222818 /nfs/dbraw/zinc/22/28/18/142222818.db2.gz ZKQNUYPAEMEFAS-OAQYLSRUSA-N 1 3 345.531 2.695 10 0 EFAEHO C[C@@H]([NH2+]CC(=O)NC1CCN(C2CC2)CC1)[C@H](C)c1ccccc1 ZINC000347684731 142256383 /nfs/dbraw/zinc/25/63/83/142256383.db2.gz PJNBTXFHQBSYME-JKSUJKDBSA-N 1 3 329.488 2.511 10 0 EFAEHO CN(C(=O)NCCC[N@H+](C)C1CCCCC1)[C@@H]1CCN(C2CC2)C1 ZINC000349612317 142340156 /nfs/dbraw/zinc/34/01/56/142340156.db2.gz ANQBXQBFLZWCDX-GOSISDBHSA-N 1 3 336.524 2.519 10 0 EFAEHO CN(C(=O)NCCC[N@@H+](C)C1CCCCC1)[C@@H]1CCN(C2CC2)C1 ZINC000349612317 142340158 /nfs/dbraw/zinc/34/01/58/142340158.db2.gz ANQBXQBFLZWCDX-GOSISDBHSA-N 1 3 336.524 2.519 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC[C@@H](C)[N@H+](C)Cc1ccccc1 ZINC000349648471 142343437 /nfs/dbraw/zinc/34/34/37/142343437.db2.gz ZUIXTLWGLLGDOC-IEBWSBKVSA-N 1 3 331.504 2.888 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000349648471 142343438 /nfs/dbraw/zinc/34/34/38/142343438.db2.gz ZUIXTLWGLLGDOC-IEBWSBKVSA-N 1 3 331.504 2.888 10 0 EFAEHO O=C([C@@H]1CCCN1C1CCCC1)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000439845208 304331192 /nfs/dbraw/zinc/33/11/92/304331192.db2.gz YDABXQHJAXVOFD-MOPGFXCFSA-N 1 3 333.520 2.870 10 0 EFAEHO O=C([C@@H]1CCCN1Cc1ccccc1)N1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000371020229 304331706 /nfs/dbraw/zinc/33/17/06/304331706.db2.gz XNHBFGMWIFQJNF-AQNXPRMDSA-N 1 3 341.499 2.642 10 0 EFAEHO Cc1ncc(CNCCc2ccc(OCC[NH+]3CCCC3)cc2)cn1 ZINC000341254566 145021310 /nfs/dbraw/zinc/02/13/10/145021310.db2.gz FZVSVFNPXBFCAV-UHFFFAOYSA-N 1 3 340.471 2.592 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000341272532 145024188 /nfs/dbraw/zinc/02/41/88/145024188.db2.gz YUPOVGLJYNCNFH-HUUCEWRRSA-N 1 3 338.540 2.858 10 0 EFAEHO C[C@H](N[C@H](CO)C[C@@H](O)C(C)(C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000342813105 145198970 /nfs/dbraw/zinc/19/89/70/145198970.db2.gz GAMKBBFRBBEZJR-OJAHFUOMSA-N 1 3 348.531 2.645 10 0 EFAEHO C[C@H](N[C@H](CO)C[C@@H](O)C(C)(C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000342813105 145198974 /nfs/dbraw/zinc/19/89/74/145198974.db2.gz GAMKBBFRBBEZJR-OJAHFUOMSA-N 1 3 348.531 2.645 10 0 EFAEHO COC1([C@@H](C)[NH2+]CC2(N3CCCCC3)CCN(C)CC2)CCCC1 ZINC000421832342 292134045 /nfs/dbraw/zinc/13/40/45/292134045.db2.gz MJZXJRCYHXTLJK-GOSISDBHSA-N 1 3 337.552 2.874 10 0 EFAEHO C[C@@H](CNC(=O)CCN1CCc2ccccc2C1)C[NH+]1CCCCC1 ZINC000348960733 146030016 /nfs/dbraw/zinc/03/00/16/146030016.db2.gz FDZFZAAZWJWRAL-SFHVURJKSA-N 1 3 343.515 2.673 10 0 EFAEHO CCOC(=O)COCCN1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000351531107 146139554 /nfs/dbraw/zinc/13/95/54/146139554.db2.gz CRXJPSNVGSTHGG-QGZVFWFLSA-N 1 3 340.508 2.543 10 0 EFAEHO CCOC(=O)COCCN1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000351531107 146139556 /nfs/dbraw/zinc/13/95/56/146139556.db2.gz CRXJPSNVGSTHGG-QGZVFWFLSA-N 1 3 340.508 2.543 10 0 EFAEHO CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)CCN1CCc2ccccc2C1 ZINC000352066084 146280996 /nfs/dbraw/zinc/28/09/96/146280996.db2.gz UAVLPKOSIZSHQT-UXHICEINSA-N 1 3 341.499 2.520 10 0 EFAEHO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)CCN1CCc2ccccc2C1 ZINC000352066084 146280997 /nfs/dbraw/zinc/28/09/97/146280997.db2.gz UAVLPKOSIZSHQT-UXHICEINSA-N 1 3 341.499 2.520 10 0 EFAEHO Cc1nccc(CN(C)CCC2CCN(c3cc[nH+]cc3)CC2)n1 ZINC000352881067 146339994 /nfs/dbraw/zinc/33/99/94/146339994.db2.gz CUTNUEMGIIXUFT-UHFFFAOYSA-N 1 3 325.460 2.919 10 0 EFAEHO CC(C)[N@@H+](C)C[C@H](C)NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000360123526 148277547 /nfs/dbraw/zinc/27/75/47/148277547.db2.gz HIOFXKQUNDLPJT-PKOBYXMFSA-N 1 3 346.519 2.631 10 0 EFAEHO CC(C)[N@H+](C)C[C@H](C)NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000360123526 148277549 /nfs/dbraw/zinc/27/75/49/148277549.db2.gz HIOFXKQUNDLPJT-PKOBYXMFSA-N 1 3 346.519 2.631 10 0 EFAEHO Cc1nn(C)c(C)c1C[C@H](C)[NH2+]C1CCN(c2ccncc2)CC1 ZINC000362279498 148791719 /nfs/dbraw/zinc/79/17/19/148791719.db2.gz QPZYAJUNDFXXEX-AWEZNQCLSA-N 1 3 327.476 2.622 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@@H]([NH2+]CC3(N4CCCCC4)CCN(C)CC3)C[C@H]2C1 ZINC000424308700 286113135 /nfs/dbraw/zinc/11/31/35/286113135.db2.gz HAVPLTKOYXILJY-FGYAAKKASA-N 1 3 349.563 2.730 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000368094054 150033508 /nfs/dbraw/zinc/03/35/08/150033508.db2.gz VTJSJPNPWOWOMN-VQIMIIECSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000368094054 150033511 /nfs/dbraw/zinc/03/35/11/150033511.db2.gz VTJSJPNPWOWOMN-VQIMIIECSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC2CC[NH+](C(C)(C)C)CC2)C1 ZINC000368126100 150045240 /nfs/dbraw/zinc/04/52/40/150045240.db2.gz OKZUZXCXAFZHSG-SFHVURJKSA-N 1 3 327.488 2.578 10 0 EFAEHO C(=C/C[N@@H+]1CC[C@@]2(C1)CCCOC2)\CN1CC[C@]2(C1)CCCOC2 ZINC000368504005 150135428 /nfs/dbraw/zinc/13/54/28/150135428.db2.gz OJURGGIHSNYSIN-FWDLARJDSA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C/C[N@H+]1CC[C@@]2(C1)CCCOC2)\CN1CC[C@]2(C1)CCCOC2 ZINC000368504005 150135430 /nfs/dbraw/zinc/13/54/30/150135430.db2.gz OJURGGIHSNYSIN-FWDLARJDSA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C/C[N@@H+]1CC[C@]2(C1)CCCOC2)\CN1CC[C@@]2(C1)CCCOC2 ZINC000368504005 150135432 /nfs/dbraw/zinc/13/54/32/150135432.db2.gz OJURGGIHSNYSIN-FWDLARJDSA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C/C[N@H+]1CC[C@]2(C1)CCCOC2)\CN1CC[C@@]2(C1)CCCOC2 ZINC000368504005 150135435 /nfs/dbraw/zinc/13/54/35/150135435.db2.gz OJURGGIHSNYSIN-FWDLARJDSA-N 1 3 334.504 2.548 10 0 EFAEHO CC(C)NC(=O)CCN1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000374070776 151278569 /nfs/dbraw/zinc/27/85/69/151278569.db2.gz VDAQXERVNUDZRY-OAQYLSRUSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)NC(=O)CCN1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000374070776 151278571 /nfs/dbraw/zinc/27/85/71/151278571.db2.gz VDAQXERVNUDZRY-OAQYLSRUSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC(C[NH+]2CCCC2)CC1)N1CCCCC1 ZINC000374212944 151302632 /nfs/dbraw/zinc/30/26/32/151302632.db2.gz FZDJOBSXPRMYNO-IBGZPJMESA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc(C[NH3+])cc1 ZINC000374461680 151352043 /nfs/dbraw/zinc/35/20/43/151352043.db2.gz YDFUTBOIGXXUCI-UZLBHIALSA-N 1 3 337.467 2.786 10 0 EFAEHO CC[C@@H]1C[C@@H](C[N@H+](CCN(C)C)C[C@@H]2CCCN2CC)CCO1 ZINC000349039057 287281239 /nfs/dbraw/zinc/28/12/39/287281239.db2.gz WUHRPQJRYKDUOX-GBESFXJTSA-N 1 3 325.541 2.540 10 0 EFAEHO CC[C@@H]1C[C@@H](C[N@@H+](CCN(C)C)C[C@@H]2CCCN2CC)CCO1 ZINC000349039057 287281242 /nfs/dbraw/zinc/28/12/42/287281242.db2.gz WUHRPQJRYKDUOX-GBESFXJTSA-N 1 3 325.541 2.540 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN2CCC(C[NH+]3CCCC3)CC2)c(C)c1 ZINC000047972198 272983798 /nfs/dbraw/zinc/98/37/98/272983798.db2.gz MVIXYPSLLHGUFR-HXUWFJFHSA-N 1 3 346.515 2.851 10 0 EFAEHO Cc1ccc(OC[C@@H](O)CN2CCC(C[NH+]3CCCC3)CC2)c(C)c1 ZINC000047972201 272983896 /nfs/dbraw/zinc/98/38/96/272983896.db2.gz MVIXYPSLLHGUFR-FQEVSTJZSA-N 1 3 346.515 2.851 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCc2cccc(C[NH+](CC)CC)c2)C1 ZINC000194143598 265363857 /nfs/dbraw/zinc/36/38/57/265363857.db2.gz WDONTWLJCFQDRK-IBGZPJMESA-N 1 3 346.519 2.812 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCCCC[N@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000194148600 265364067 /nfs/dbraw/zinc/36/40/67/265364067.db2.gz NETAYNTVQSKSCI-FGTMMUONSA-N 1 3 338.540 2.528 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000194148600 265364069 /nfs/dbraw/zinc/36/40/69/265364069.db2.gz NETAYNTVQSKSCI-FGTMMUONSA-N 1 3 338.540 2.528 10 0 EFAEHO C[NH+]1CCC(C)(CNC(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000272490584 266282179 /nfs/dbraw/zinc/28/21/79/266282179.db2.gz DRQAQOFGUGPHKB-UHFFFAOYSA-N 1 3 329.488 2.744 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC[C@H](c2cccs2)N2CCCC2)CC1 ZINC000273310439 266480725 /nfs/dbraw/zinc/48/07/25/266480725.db2.gz WLDHCMIVSKRUPA-MRXNPFEDSA-N 1 3 335.517 2.733 10 0 EFAEHO C[N@H+](Cc1ccccc1)CC(C)(C)CN1CC[C@H](N2CCOCC2)C1 ZINC000121038624 273017559 /nfs/dbraw/zinc/01/75/59/273017559.db2.gz USFHBBOOQHHCBW-FQEVSTJZSA-N 1 3 345.531 2.551 10 0 EFAEHO C[N@@H+](Cc1ccccc1)CC(C)(C)CN1CC[C@H](N2CCOCC2)C1 ZINC000121038624 273017561 /nfs/dbraw/zinc/01/75/61/273017561.db2.gz USFHBBOOQHHCBW-FQEVSTJZSA-N 1 3 345.531 2.551 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)N2CCCC2)cc1 ZINC000279110066 273177709 /nfs/dbraw/zinc/17/77/09/273177709.db2.gz BVKMDGNEEQQJEO-YSIASYRMSA-N 1 3 343.515 2.978 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)N2CCCC2)cc1 ZINC000279110066 273177710 /nfs/dbraw/zinc/17/77/10/273177710.db2.gz BVKMDGNEEQQJEO-YSIASYRMSA-N 1 3 343.515 2.978 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccsc1 ZINC000279235124 273191585 /nfs/dbraw/zinc/19/15/85/273191585.db2.gz QTAFAIJORWDWCG-ZOBUZTSGSA-N 1 3 337.533 2.978 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccsc1 ZINC000279235124 273191586 /nfs/dbraw/zinc/19/15/86/273191586.db2.gz QTAFAIJORWDWCG-ZOBUZTSGSA-N 1 3 337.533 2.978 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N[C@H](CN2CCCC2)c2ccccc2)CC[N@@H+]1C ZINC000279295596 273199159 /nfs/dbraw/zinc/19/91/59/273199159.db2.gz YRELDRISYSYUPE-YTQUADARSA-N 1 3 329.488 2.670 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N[C@H](CN2CCCC2)c2ccccc2)CC[N@H+]1C ZINC000279295596 273199160 /nfs/dbraw/zinc/19/91/60/273199160.db2.gz YRELDRISYSYUPE-YTQUADARSA-N 1 3 329.488 2.670 10 0 EFAEHO C[C@@H]1CC2(CN1CC(=O)N[C@H]1CCCc3ccccc31)CC[NH2+]CC2 ZINC000424289624 274284307 /nfs/dbraw/zinc/28/43/07/274284307.db2.gz MDVZHFNXUPOXFF-APWZRJJASA-N 1 3 341.499 2.644 10 0 EFAEHO CCN(C(=O)N[C@@H]1CCC[NH2+]C1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418387557 276062694 /nfs/dbraw/zinc/06/26/94/276062694.db2.gz TXZRAELCTZQWIZ-BHIYHBOVSA-N 1 3 344.503 2.605 10 0 EFAEHO CC[NH+](CC)CC1CCN([C@@H]2CCc3ccccc3NC2=O)CC1 ZINC000361698109 276095618 /nfs/dbraw/zinc/09/56/18/276095618.db2.gz BPFNUDLQIDTFPS-LJQANCHMSA-N 1 3 329.488 2.994 10 0 EFAEHO C[NH2+]Cc1ccccc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000415919316 277034318 /nfs/dbraw/zinc/03/43/18/277034318.db2.gz HJIDVUVRFGHCJS-RBUKOAKNSA-N 1 3 338.455 2.973 10 0 EFAEHO COc1cc(C)c(C[NH2+]CCCCN2C[C@@H](C)O[C@@H](C)C2)c(C)n1 ZINC000358969060 277372454 /nfs/dbraw/zinc/37/24/54/277372454.db2.gz BBPUCIXUJPFAFC-IYBDPMFKSA-N 1 3 335.492 2.686 10 0 EFAEHO C[C@H](CCNC(=O)NCCN1[C@H](C)CCC[C@@H]1C)[NH+]1CCCCC1 ZINC000345559039 278173183 /nfs/dbraw/zinc/17/31/83/278173183.db2.gz IQHDGLROVWZAPY-KURKYZTESA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@H]1CCOCCN1Cc1ccc(C[N@@H+]2CCOCC[C@@H]2C)cc1 ZINC000378463503 278374325 /nfs/dbraw/zinc/37/43/25/278374325.db2.gz QXKJHGHKLBOFSE-ROUUACIJSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@H]1CCOCCN1Cc1ccc(C[N@H+]2CCOCC[C@@H]2C)cc1 ZINC000378463503 278374327 /nfs/dbraw/zinc/37/43/27/278374327.db2.gz QXKJHGHKLBOFSE-ROUUACIJSA-N 1 3 332.488 2.908 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000156755833 279124250 /nfs/dbraw/zinc/12/42/50/279124250.db2.gz NWQJSVFVAOUOMQ-MSOLQXFVSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)N[C@@H](C)C1CCCC1 ZINC000341139677 279302418 /nfs/dbraw/zinc/30/24/18/279302418.db2.gz KCCYYUVUOBPFQN-FUHWJXTLSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)N[C@@H](C)C1CCCC1 ZINC000341139677 279302421 /nfs/dbraw/zinc/30/24/21/279302421.db2.gz KCCYYUVUOBPFQN-FUHWJXTLSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@H](CNC(=O)NCC[N@H+]1[C@H](C)CCC[C@@H]1C)N1CCC(C)CC1 ZINC000341429652 279334815 /nfs/dbraw/zinc/33/48/15/279334815.db2.gz HYJXGICRYLOQNB-FGTMMUONSA-N 1 3 338.540 2.669 10 0 EFAEHO C[C@H](CNC(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C)N1CCC(C)CC1 ZINC000341429652 279334817 /nfs/dbraw/zinc/33/48/17/279334817.db2.gz HYJXGICRYLOQNB-FGTMMUONSA-N 1 3 338.540 2.669 10 0 EFAEHO CN(C)C1(C[NH2+][C@H]2CCN(C)[C@@H]3CCC[C@@H]32)Cc2ccccc2C1 ZINC000353520655 282045968 /nfs/dbraw/zinc/04/59/68/282045968.db2.gz OJWAZFZXWOEXML-HSALFYBXSA-N 1 3 327.516 2.548 10 0 EFAEHO C[C@H](NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1CCCC[NH2+]1 ZINC000423081080 289934783 /nfs/dbraw/zinc/93/47/83/289934783.db2.gz BBPAIRKVKCWCOF-MFNGEMCRSA-N 1 3 333.442 2.912 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)NCCN1CCCC[C@@H]1C ZINC000127060260 293057666 /nfs/dbraw/zinc/05/76/66/293057666.db2.gz AMYUXLJLPOEGCV-MSOLQXFVSA-N 1 3 338.540 2.815 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NCCN1CCCC[C@@H]1C ZINC000127060260 293057668 /nfs/dbraw/zinc/05/76/68/293057668.db2.gz AMYUXLJLPOEGCV-MSOLQXFVSA-N 1 3 338.540 2.815 10 0 EFAEHO CC[C@@H]1CCCCN1CCNC(=O)N(C)[C@@H]1CC[N@H+](CC)C[C@@H]1C ZINC000129447411 293134706 /nfs/dbraw/zinc/13/47/06/293134706.db2.gz BDJUPJCUGKRVMP-RCCFBDPRSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[C@@H]1CCCCN1CCNC(=O)N(C)[C@@H]1CC[N@@H+](CC)C[C@@H]1C ZINC000129447411 293134707 /nfs/dbraw/zinc/13/47/07/293134707.db2.gz BDJUPJCUGKRVMP-RCCFBDPRSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)N[C@H](CC(C)C)CN(C)C)c1 ZINC000130909426 293182123 /nfs/dbraw/zinc/18/21/23/293182123.db2.gz UPFRNWJUDHFTMM-LJQANCHMSA-N 1 3 348.535 2.914 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)N[C@H](CC(C)C)CN(C)C)c1 ZINC000130909426 293182124 /nfs/dbraw/zinc/18/21/24/293182124.db2.gz UPFRNWJUDHFTMM-LJQANCHMSA-N 1 3 348.535 2.914 10 0 EFAEHO C[NH+](C)CCc1ccc(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC000290629795 294140854 /nfs/dbraw/zinc/14/08/54/294140854.db2.gz ZRXABHUAFLMIES-LJQANCHMSA-N 1 3 335.467 2.942 10 0 EFAEHO CC(C)(O)c1ccc(C[NH2+]C2CCN(C[C@@H]3CCOC3)CC2)cc1 ZINC000291409844 294373992 /nfs/dbraw/zinc/37/39/92/294373992.db2.gz GFVQIUIGCNUPAG-KRWDZBQOSA-N 1 3 332.488 2.505 10 0 EFAEHO CSc1ccc([C@@H](CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)N(C)C)cc1 ZINC000294325934 295147448 /nfs/dbraw/zinc/14/74/48/295147448.db2.gz IZVXDODWKVQRGD-QILLFSRXSA-N 1 3 349.544 2.858 10 0 EFAEHO CSc1ccc([C@@H](CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)N(C)C)cc1 ZINC000294325934 295147449 /nfs/dbraw/zinc/14/74/49/295147449.db2.gz IZVXDODWKVQRGD-QILLFSRXSA-N 1 3 349.544 2.858 10 0 EFAEHO COc1ccc([C@@H](NCCN2CCCC2(C)C)[C@@H]2CCC[NH2+]2)cc1 ZINC000423160481 295215745 /nfs/dbraw/zinc/21/57/45/295215745.db2.gz HLHSTOKBKUAUAH-RBUKOAKNSA-N 1 3 331.504 2.952 10 0 EFAEHO COc1ccc([C@H](NC2CCN(C3CC3)CC2)[C@@H]2CCC[NH2+]2)cc1 ZINC000422798345 295244387 /nfs/dbraw/zinc/24/43/87/295244387.db2.gz QSLVLXGEHAMZFO-PMACEKPBSA-N 1 3 329.488 2.705 10 0 EFAEHO COc1ccc([C@H](NCCN2CCC[C@@H](C)C2)[C@H]2CCC[NH2+]2)cc1 ZINC000422859702 295244781 /nfs/dbraw/zinc/24/47/81/295244781.db2.gz KTBCIKYJPHKSEA-AHRSYUTCSA-N 1 3 331.504 2.810 10 0 EFAEHO COc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)cc1NC(C)=O ZINC000295074473 295264904 /nfs/dbraw/zinc/26/49/04/295264904.db2.gz RIHKQSVHINNOAC-FCLXEUQJSA-N 1 3 331.460 2.929 10 0 EFAEHO CC[C@H](N[C@@H](C)c1ccc(OCC[NH+](C)C)cc1)[C@@H](O)C(F)F ZINC000295865385 295388291 /nfs/dbraw/zinc/38/82/91/295388291.db2.gz BUAZPEZPSBRVOF-VBNZEHGJSA-N 1 3 330.419 2.682 10 0 EFAEHO O=C(C[NH2+][C@@H]1CCCCC12CCCC2)NC1CCN(C2CC2)CC1 ZINC000361595971 295521111 /nfs/dbraw/zinc/52/11/11/295521111.db2.gz QEYPHTYEIFEOTE-GOSISDBHSA-N 1 3 333.520 2.822 10 0 EFAEHO NCC(=O)N1CCC[C@@H](C[NH2+]C2(c3ccccc3)CCCCC2)C1 ZINC000414699615 303365899 /nfs/dbraw/zinc/36/58/99/303365899.db2.gz FDKIIWPCCMGEEK-KRWDZBQOSA-N 1 3 329.488 2.633 10 0 EFAEHO [NH3+]CC1CCC(N[C@@H](CCO)c2ccccc2Br)CC1 ZINC000423027805 303370896 /nfs/dbraw/zinc/37/08/96/303370896.db2.gz DYJVOLYGBQNNEN-ZUEPYMLJSA-N 1 3 341.293 2.980 10 0 EFAEHO CCC[C@@H](C(=O)NC[C@@H](c1ccsc1)N(CC)CC)[NH+](C)C ZINC000161565742 310710587 /nfs/dbraw/zinc/71/05/87/310710587.db2.gz ZIEXJMQOFUZFPW-HOTGVXAUSA-N 1 3 325.522 2.978 10 0 EFAEHO CC[C@H](N[C@@H](C)c1cccc(OCC[NH+](C)C)c1)[C@H](O)C(F)F ZINC000296395604 310814421 /nfs/dbraw/zinc/81/44/21/310814421.db2.gz KGNUXWMNZJNURH-RCBQFDQVSA-N 1 3 330.419 2.682 10 0 EFAEHO C[C@H](C[NH2+][C@@H](C)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)CN(C)C ZINC000309699282 311228426 /nfs/dbraw/zinc/22/84/26/311228426.db2.gz FMYRVBDOMQSEHC-OWCLPIDISA-N 1 3 327.513 2.809 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CNC1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000324877818 311242363 /nfs/dbraw/zinc/24/23/63/311242363.db2.gz JSLFDZHDLDZQOD-XVLXNVKGSA-N 1 3 332.488 2.648 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CNC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000324877818 311242364 /nfs/dbraw/zinc/24/23/64/311242364.db2.gz JSLFDZHDLDZQOD-XVLXNVKGSA-N 1 3 332.488 2.648 10 0 EFAEHO CCOC(=O)COc1ccc(CNCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000414804498 312053544 /nfs/dbraw/zinc/05/35/44/312053544.db2.gz FJUTVKVSLNNWFW-OAHLLOKOSA-N 1 3 342.439 2.938 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1ccccc1Cl)N[C@H]1CC[NH2+]C[C@H]1C ZINC000414940418 312067913 /nfs/dbraw/zinc/06/79/13/312067913.db2.gz KJEXTTSNEPZISI-CPUCHLNUSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+][C@H]1CCNC[C@H]1C ZINC000414940418 312067915 /nfs/dbraw/zinc/06/79/15/312067915.db2.gz KJEXTTSNEPZISI-CPUCHLNUSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@@H]([NH2+]C1CCN(Cc2ccccc2Br)CC1)[C@H](C)N ZINC000415023328 312078638 /nfs/dbraw/zinc/07/86/38/312078638.db2.gz WTGYLMNPYGDSTM-QWHCGFSZSA-N 1 3 340.309 2.739 10 0 EFAEHO C[C@@H](NC1CCN(Cc2ccccc2Br)CC1)[C@H](C)[NH3+] ZINC000415023328 312078639 /nfs/dbraw/zinc/07/86/39/312078639.db2.gz WTGYLMNPYGDSTM-QWHCGFSZSA-N 1 3 340.309 2.739 10 0 EFAEHO [NH3+]C[C@H]1CC[C@H](NCc2cn(-c3ccc(Cl)cc3Cl)nn2)C1 ZINC000415027624 312079262 /nfs/dbraw/zinc/07/92/62/312079262.db2.gz BJPCJTJUGJPNBP-JQWIXIFHSA-N 1 3 340.258 2.791 10 0 EFAEHO O=C1N[C@H]2CN(CCCC3CCCCC3)CC[C@H]2N1C1CC[NH2+]CC1 ZINC000415134382 312100254 /nfs/dbraw/zinc/10/02/54/312100254.db2.gz DRCMZWASVWZWCS-RBUKOAKNSA-N 1 3 348.535 2.567 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2CC[C@@H](C)[C@@H](C[NH3+])C2)CC1 ZINC000415133254 312100632 /nfs/dbraw/zinc/10/06/32/312100632.db2.gz UZNHCCYDFGNXBW-QUCCMNQESA-N 1 3 344.547 2.635 10 0 EFAEHO O=C(Nc1ccc2c(c1F)CCNC2)N1CCC[C@@H]1C[NH+]1CCCC1 ZINC000415953081 312184148 /nfs/dbraw/zinc/18/41/48/312184148.db2.gz HZXPBWAXSOGZNL-OAHLLOKOSA-N 1 3 346.450 2.564 10 0 EFAEHO CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415954503 312184310 /nfs/dbraw/zinc/18/43/10/312184310.db2.gz KJSUXPPPELHMLY-HNNXBMFYSA-N 1 3 348.466 2.810 10 0 EFAEHO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415954503 312184311 /nfs/dbraw/zinc/18/43/11/312184311.db2.gz KJSUXPPPELHMLY-HNNXBMFYSA-N 1 3 348.466 2.810 10 0 EFAEHO CC[NH2+]Cc1ccccc1NC(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000415958724 312185447 /nfs/dbraw/zinc/18/54/47/312185447.db2.gz RHEGTEQSLBNWNS-QGZVFWFLSA-N 1 3 330.476 2.888 10 0 EFAEHO CCCC[N@H+](C)C[C@H](C)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415963415 312186537 /nfs/dbraw/zinc/18/65/37/312186537.db2.gz VLZSDRVKWQTOJM-ZDUSSCGKSA-N 1 3 336.455 2.713 10 0 EFAEHO CCCC[N@@H+](C)C[C@H](C)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415963415 312186538 /nfs/dbraw/zinc/18/65/38/312186538.db2.gz VLZSDRVKWQTOJM-ZDUSSCGKSA-N 1 3 336.455 2.713 10 0 EFAEHO C[NH2+]Cc1ccc(NC(=O)N[C@H](Cc2ccccc2)CN(C)C)cc1 ZINC000415978102 312189166 /nfs/dbraw/zinc/18/91/66/312189166.db2.gz ZZFFRHOLNNKCER-LJQANCHMSA-N 1 3 340.471 2.700 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)NC[C@@H](C)N2CCC(C)CC2)cc1 ZINC000417317343 312208578 /nfs/dbraw/zinc/20/85/78/312208578.db2.gz WJDDVIIJKKYPCU-HZPDHXFCSA-N 1 3 332.492 2.626 10 0 EFAEHO CC[C@@H](C)[N@H+](C)CCNC(=O)NC[C@@H](N)c1ccc(C(C)C)cc1 ZINC000417441144 312224027 /nfs/dbraw/zinc/22/40/27/312224027.db2.gz AKBTZZOJSYCNHG-CRAIPNDOSA-N 1 3 334.508 2.839 10 0 EFAEHO CC[C@@H](C)[N@@H+](C)CCNC(=O)NC[C@@H](N)c1ccc(C(C)C)cc1 ZINC000417441144 312224029 /nfs/dbraw/zinc/22/40/29/312224029.db2.gz AKBTZZOJSYCNHG-CRAIPNDOSA-N 1 3 334.508 2.839 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)NC[C@@H](N)c1ccccc1 ZINC000417556757 312239497 /nfs/dbraw/zinc/23/94/97/312239497.db2.gz PXLSWLOIVSAUCL-QZTJIDSGSA-N 1 3 332.492 2.640 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)NC[C@@H](N)c1ccccc1 ZINC000417556757 312239499 /nfs/dbraw/zinc/23/94/99/312239499.db2.gz PXLSWLOIVSAUCL-QZTJIDSGSA-N 1 3 332.492 2.640 10 0 EFAEHO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC[C@H](N)c2ccccc2)C1 ZINC000417582142 312243632 /nfs/dbraw/zinc/24/36/32/312243632.db2.gz HNMYPVWNQKBSDW-AEFFLSMTSA-N 1 3 346.519 2.886 10 0 EFAEHO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NC[C@H](N)c2ccccc2)C1 ZINC000417582142 312243634 /nfs/dbraw/zinc/24/36/34/312243634.db2.gz HNMYPVWNQKBSDW-AEFFLSMTSA-N 1 3 346.519 2.886 10 0 EFAEHO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC[C@H](N)c2ccccc2)C1 ZINC000417582146 312243801 /nfs/dbraw/zinc/24/38/01/312243801.db2.gz HNMYPVWNQKBSDW-WMZOPIPTSA-N 1 3 346.519 2.886 10 0 EFAEHO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NC[C@H](N)c2ccccc2)C1 ZINC000417582146 312243803 /nfs/dbraw/zinc/24/38/03/312243803.db2.gz HNMYPVWNQKBSDW-WMZOPIPTSA-N 1 3 346.519 2.886 10 0 EFAEHO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC[C@@H](N)c2ccccc2)C1 ZINC000417582144 312243876 /nfs/dbraw/zinc/24/38/76/312243876.db2.gz HNMYPVWNQKBSDW-SJLPKXTDSA-N 1 3 346.519 2.886 10 0 EFAEHO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NC[C@@H](N)c2ccccc2)C1 ZINC000417582144 312243878 /nfs/dbraw/zinc/24/38/78/312243878.db2.gz HNMYPVWNQKBSDW-SJLPKXTDSA-N 1 3 346.519 2.886 10 0 EFAEHO C[C@H](NC(C)(C)CNC(=O)N(C1CC1)[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000417710867 312259640 /nfs/dbraw/zinc/25/96/40/312259640.db2.gz VHFYKDVDYQKTLE-MAUKXSAKSA-N 1 3 344.503 2.652 10 0 EFAEHO CCCN(C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)C1CC[NH2+]CC1 ZINC000417935237 312298292 /nfs/dbraw/zinc/29/82/92/312298292.db2.gz GKJMQFHGPULSHG-OALUTQOASA-N 1 3 344.503 2.605 10 0 EFAEHO CCCN(C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)C1CC[NH2+]CC1 ZINC000417935236 312298441 /nfs/dbraw/zinc/29/84/41/312298441.db2.gz GKJMQFHGPULSHG-MOPGFXCFSA-N 1 3 344.503 2.605 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)N1CCCC[C@@H]1[C@@H](C)[NH3+])c1ccco1 ZINC000418163799 312337756 /nfs/dbraw/zinc/33/77/56/312337756.db2.gz HUDHMSWJAWMFEK-ZJIFWQFVSA-N 1 3 336.480 2.620 10 0 EFAEHO C[C@H](NC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H](c1ccccc1)N(C)C ZINC000418163459 312337945 /nfs/dbraw/zinc/33/79/45/312337945.db2.gz DKYJIANRNZXPBJ-NFEZDNKESA-N 1 3 344.503 2.602 10 0 EFAEHO Cc1ccccc1[C@H]([C@@H](C)NC(=O)N(C1CC1)[C@@H]1CC[NH2+]C1)N(C)C ZINC000418181177 312341362 /nfs/dbraw/zinc/34/13/62/312341362.db2.gz KWLFZSKVHBPVDZ-SUMDDJOVSA-N 1 3 344.503 2.522 10 0 EFAEHO CCCN(C)[C@H](CNC(=O)N[C@@H](C)[C@@H](C)[NH3+])c1ccc(Cl)cc1 ZINC000418191672 312343921 /nfs/dbraw/zinc/34/39/21/312343921.db2.gz XRSNIXWSGWAQQE-DVOMOZLQSA-N 1 3 340.899 2.758 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)NCCCCC[NH+]1CCCC1 ZINC000418217766 312348881 /nfs/dbraw/zinc/34/88/81/312348881.db2.gz NMCOMLYCJIKYGZ-LJQANCHMSA-N 1 3 346.519 2.814 10 0 EFAEHO CN1CC[C@H](NC(=O)NC2CCC([NH+](C)C)CC2)[C@H]1c1ccccc1 ZINC000420823340 312397581 /nfs/dbraw/zinc/39/75/81/312397581.db2.gz VEYRUCNHOIEJEB-WZOJCFFYSA-N 1 3 344.503 2.604 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC(C)(C)COC)CC1 ZINC000491398094 313743042 /nfs/dbraw/zinc/74/30/42/313743042.db2.gz FCQVRLYEQWZJAI-UHFFFAOYSA-N 1 3 333.520 2.981 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)Nc1ccc2c(c1)CNCCO2 ZINC000521214799 316006799 /nfs/dbraw/zinc/00/67/99/316006799.db2.gz SCWGEFVJTWADHI-HUUCEWRRSA-N 1 3 346.475 2.553 10 0 EFAEHO C[NH+](C)CCc1ccc(C(=O)NC[C@H]2CCN2C2CCCC2)cc1 ZINC000530028664 317030173 /nfs/dbraw/zinc/03/01/73/317030173.db2.gz QHTMNWBGGHAVLI-LJQANCHMSA-N 1 3 329.488 2.537 10 0 EFAEHO Clc1ccc(OCCN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)cc1 ZINC000530237265 317088209 /nfs/dbraw/zinc/08/82/09/317088209.db2.gz CTYUAKAAMNPLLB-GOSISDBHSA-N 1 3 338.879 2.809 10 0 EFAEHO Fc1cc2cccnc2c(CN2CCC(CO[C@H]3CC[NH2+]C3)CC2)c1 ZINC000530241271 317088794 /nfs/dbraw/zinc/08/87/94/317088794.db2.gz PCTLYRQRTOSPAS-IBGZPJMESA-N 1 3 343.446 2.964 10 0 EFAEHO c1[nH]nc(-c2ccccc2)c1CN1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530249076 317091377 /nfs/dbraw/zinc/09/13/77/317091377.db2.gz TYJQGIVSYCBECI-IBGZPJMESA-N 1 3 340.471 2.667 10 0 EFAEHO CN(C)C[C@@H](Cc1ccccc1)NC(=O)CC[N@H+](C)C1CCCCC1 ZINC000547733833 318035448 /nfs/dbraw/zinc/03/54/48/318035448.db2.gz ULRWLLADRVURBS-LJQANCHMSA-N 1 3 345.531 2.930 10 0 EFAEHO CN(C)C[C@@H](Cc1ccccc1)NC(=O)CC[N@@H+](C)C1CCCCC1 ZINC000547733833 318035451 /nfs/dbraw/zinc/03/54/51/318035451.db2.gz ULRWLLADRVURBS-LJQANCHMSA-N 1 3 345.531 2.930 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccc(OCC(F)(F)F)nc2)[C@H]2CCC[C@H]21 ZINC000552033334 318238674 /nfs/dbraw/zinc/23/86/74/318238674.db2.gz ZBVFBDSLLWOBQV-QLFBSQMISA-N 1 3 343.393 2.985 10 0 EFAEHO CCc1[nH+]c2ccccc2c(N2CCN([C@H](CC)CO)CC2)c1C ZINC000554490886 318316252 /nfs/dbraw/zinc/31/62/52/318316252.db2.gz BTVVXMVHUYSLLE-MRXNPFEDSA-N 1 3 327.472 2.999 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)C1 ZINC000554597278 318327806 /nfs/dbraw/zinc/32/78/06/318327806.db2.gz GLGOMAZTZZWCLB-GOSISDBHSA-N 1 3 343.515 2.877 10 0 EFAEHO CC(C)OC[C@H](O)CNCc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000566107941 319033251 /nfs/dbraw/zinc/03/32/51/319033251.db2.gz BZKUPKQAIPAOJL-HXUWFJFHSA-N 1 3 334.504 2.938 10 0 EFAEHO N[C@@H]1CCC[C@H]([NH2+]C2CCN(c3ccc(C(F)(F)F)cn3)CC2)C1 ZINC000566480816 319082846 /nfs/dbraw/zinc/08/28/46/319082846.db2.gz AWUMTZZYEHJIFY-HIFRSBDPSA-N 1 3 342.409 2.929 10 0 EFAEHO C[C@@H]1CN(C(=O)NCc2ccccc2CN2CCCCC2)CC[C@@H]1[NH3+] ZINC000567454207 319172565 /nfs/dbraw/zinc/17/25/65/319172565.db2.gz NRJBRMYBFINDSE-APWZRJJASA-N 1 3 344.503 2.551 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)C1 ZINC000568291661 319269462 /nfs/dbraw/zinc/26/94/62/319269462.db2.gz QJVVWPOUHZUTHN-HBFSDRIKSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000568291661 319269465 /nfs/dbraw/zinc/26/94/65/319269465.db2.gz QJVVWPOUHZUTHN-HBFSDRIKSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@H](N[C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cc[nH]c(=O)c1 ZINC000569229403 319360933 /nfs/dbraw/zinc/36/09/33/319360933.db2.gz BVQLFDBPGJNIRG-URKNILKWSA-N 1 3 325.412 2.694 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)Nc2ccc3c(c2F)CCNC3)CC1 ZINC000571147685 319546052 /nfs/dbraw/zinc/54/60/52/319546052.db2.gz OXKTZZNFYXEOSZ-UHFFFAOYSA-N 1 3 348.466 2.715 10 0 EFAEHO C[C@H](CCNC(=O)Nc1ccc2c(c1F)CCNC2)[NH+]1CCCCC1 ZINC000571267048 319556856 /nfs/dbraw/zinc/55/68/56/319556856.db2.gz QWPQPRWLGVNEDM-CQSZACIVSA-N 1 3 348.466 2.857 10 0 EFAEHO O=C(NCc1ccc(C[NH+]2CCCC2)cc1)[C@@H]1CNCc2ccccc21 ZINC000571996245 319626526 /nfs/dbraw/zinc/62/65/26/319626526.db2.gz QOBHURZPENKJQJ-OAQYLSRUSA-N 1 3 349.478 2.786 10 0 EFAEHO [NH3+]CC1CCC(Nc2cccc(CN3CCC(CO)CC3)c2)CC1 ZINC000573108108 319734714 /nfs/dbraw/zinc/73/47/14/319734714.db2.gz DQFGOEUGDNKQTA-UHFFFAOYSA-N 1 3 331.504 2.820 10 0 EFAEHO O=C(NCCN1CCCC1)c1ccc(C[NH2+][C@@H]2CCCC23CC3)cc1 ZINC000577231948 320091934 /nfs/dbraw/zinc/09/19/34/320091934.db2.gz UICWRRPZMMHZGQ-LJQANCHMSA-N 1 3 341.499 2.935 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2cccc3c2CCNC3)[C@H](C)C1 ZINC000578048757 320168412 /nfs/dbraw/zinc/16/84/12/320168412.db2.gz IJAOGXWASXTRJE-KDOFPFPSSA-N 1 3 330.476 2.526 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2cccc3c2CCNC3)[C@H](C)C1 ZINC000578048757 320168414 /nfs/dbraw/zinc/16/84/14/320168414.db2.gz IJAOGXWASXTRJE-KDOFPFPSSA-N 1 3 330.476 2.526 10 0 EFAEHO CC[NH+](CC)CCOc1ccc(NC(=O)[C@]2(C)CCCCN2)cc1 ZINC000180983234 323223945 /nfs/dbraw/zinc/22/39/45/323223945.db2.gz VLTXBWITMIDGRJ-IBGZPJMESA-N 1 3 333.476 2.878 10 0 EFAEHO CN(CCC[NH+](C)C)C(=O)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000185776772 323397382 /nfs/dbraw/zinc/39/73/82/323397382.db2.gz BBJGLIIEDJXJHB-IBGZPJMESA-N 1 3 346.519 2.634 10 0 EFAEHO CC(C)[C@@H](C)NC(=O)C1CCN(Cc2ccc3c(c2)C[NH2+]CC3)CC1 ZINC000579363956 323943143 /nfs/dbraw/zinc/94/31/43/323943143.db2.gz NHIWMWVPEQTEJC-MRXNPFEDSA-N 1 3 343.515 2.705 10 0 EFAEHO CC(C)OCC[C@@H](O)CNCc1ccccc1C[NH+]1CCCCC1 ZINC000580304814 324137683 /nfs/dbraw/zinc/13/76/83/324137683.db2.gz YUBLPAZFTYIRGC-HXUWFJFHSA-N 1 3 334.504 2.938 10 0 EFAEHO C[C@@H](CCNC(=O)N1CCc2ccccc2[C@@H]1CN)[NH+]1CCCCC1 ZINC000580713039 324218919 /nfs/dbraw/zinc/21/89/19/324218919.db2.gz PDRVZOCVDISCCD-LPHOPBHVSA-N 1 3 344.503 2.519 10 0 EFAEHO NC[C@H]1c2ccccc2CCN1C(=O)NCCCCC[NH+]1CCCC1 ZINC000580712856 324218962 /nfs/dbraw/zinc/21/89/62/324218962.db2.gz KKZCQWRBJHMMKX-IBGZPJMESA-N 1 3 344.503 2.520 10 0 EFAEHO [NH3+]CC12CCC(CC1)CN2C(=O)C1CCN(Cc2ccccc2)CC1 ZINC000581376765 324364573 /nfs/dbraw/zinc/36/45/73/324364573.db2.gz BWYDOBUCJSUCQE-UHFFFAOYSA-N 1 3 341.499 2.629 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N(C)CCC[NH+](C)C)c1ccccc1 ZINC000582514917 324609081 /nfs/dbraw/zinc/60/90/81/324609081.db2.gz UMHYVMXEAFZELK-GOSISDBHSA-N 1 3 334.508 2.663 10 0 EFAEHO COc1cc(Br)ccc1C[NH2+]C[C@H]1CCCN(C)C1 ZINC000096005644 473253261 /nfs/dbraw/zinc/25/32/61/473253261.db2.gz KNXPOPCQXMRNIX-GFCCVEGCSA-N 1 3 327.266 2.889 10 0 EFAEHO CCC[C@@H](C(=O)NCC1CC[NH+](Cc2cccs2)CC1)N(C)C ZINC000161840358 473269640 /nfs/dbraw/zinc/26/96/40/473269640.db2.gz CZKIDDXCNDHOBL-KRWDZBQOSA-N 1 3 337.533 2.807 10 0 EFAEHO CCOC(C[NH+]1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1)OCC ZINC000184979365 473290340 /nfs/dbraw/zinc/29/03/40/473290340.db2.gz WZKMVOPNUKAHIO-IRXDYDNUSA-N 1 3 342.524 2.597 10 0 EFAEHO COc1ccc([C@@H](NC2CCN(C3CC3)CC2)[C@H]2CCC[NH2+]2)cc1 ZINC000422798348 476781443 /nfs/dbraw/zinc/78/14/43/476781443.db2.gz QSLVLXGEHAMZFO-WOJBJXKFSA-N 1 3 329.488 2.705 10 0 EFAEHO N[C@H]1CCC[C@H]1[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccncc1 ZINC000422833909 476801291 /nfs/dbraw/zinc/80/12/91/476801291.db2.gz HDNADZDETUKFIA-RBUKOAKNSA-N 1 3 333.439 2.904 10 0 EFAEHO C[C@H]1OCC[C@@H]1N(CCO)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000411658601 477313837 /nfs/dbraw/zinc/31/38/37/477313837.db2.gz CQPANGNYPFXANP-XLIONFOSSA-N 1 3 332.488 2.644 10 0 EFAEHO c1cc(CNCC2CC[NH+](C3CCOCC3)CC2)n(CC2CCC2)n1 ZINC000631171522 479938175 /nfs/dbraw/zinc/93/81/75/479938175.db2.gz JKJPQQKQXHBNGI-UHFFFAOYSA-N 1 3 346.519 2.664 10 0 EFAEHO CCn1c2ccccc2c2cc(C[NH2+]CCCNCCO)ccc21 ZINC000013733122 471841219 /nfs/dbraw/zinc/84/12/19/471841219.db2.gz PPMBLOQOXHKPHC-UHFFFAOYSA-N 1 3 325.456 2.876 10 0 EFAEHO Cc1cc(CNCC2CC[NH+](C[C@H](O)c3ccccc3)CC2)on1 ZINC000075602919 472166061 /nfs/dbraw/zinc/16/60/61/472166061.db2.gz HDLSDRMXFBALJD-IBGZPJMESA-N 1 3 329.444 2.518 10 0 EFAEHO Cc1cc(CNCC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)on1 ZINC000075602920 472166172 /nfs/dbraw/zinc/16/61/72/472166172.db2.gz HDLSDRMXFBALJD-LJQANCHMSA-N 1 3 329.444 2.518 10 0 EFAEHO C[N@H+](CC1CCN(C[C@@H](O)c2ccccc2)CC1)C[C@@H]1CCCCO1 ZINC000069490234 472355101 /nfs/dbraw/zinc/35/51/01/472355101.db2.gz WUWBDSDDWDHEQZ-LEWJYISDSA-N 1 3 346.515 2.933 10 0 EFAEHO C[N@@H+](CC1CCN(C[C@@H](O)c2ccccc2)CC1)C[C@@H]1CCCCO1 ZINC000069490234 472355105 /nfs/dbraw/zinc/35/51/05/472355105.db2.gz WUWBDSDDWDHEQZ-LEWJYISDSA-N 1 3 346.515 2.933 10 0 EFAEHO C[C@H](CNC(=O)N[C@@H](CN(C)C)c1ccccc1)C[NH+]1CCCCC1 ZINC000057042580 472377965 /nfs/dbraw/zinc/37/79/65/472377965.db2.gz ZOXPOYDDZKBFPY-MJGOQNOKSA-N 1 3 346.519 2.711 10 0 EFAEHO CN(Cc1ccccc1N(C)C1CC[NH+](C)CC1)C[C@@H]1CCCO1 ZINC000128065823 472395870 /nfs/dbraw/zinc/39/58/70/472395870.db2.gz FITBLVXATJOUQA-IBGZPJMESA-N 1 3 331.504 2.828 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C ZINC000116410496 472403487 /nfs/dbraw/zinc/40/34/87/472403487.db2.gz LMAWYKIUXNUKJH-HOTGVXAUSA-N 1 3 326.529 2.526 10 0 EFAEHO C[NH+](C)C[C@@H]1CCCCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000069950873 472474365 /nfs/dbraw/zinc/47/43/65/472474365.db2.gz NZRMOCKRDLSWAS-IBGZPJMESA-N 1 3 329.488 2.839 10 0 EFAEHO Cc1c(CCNC[C@@]2(O)CC[NH2+]C2)c2ccccc2n1-c1ccccc1 ZINC000077407482 472522695 /nfs/dbraw/zinc/52/26/95/472522695.db2.gz PGCMEKUICRXGDF-QFIPXVFZSA-N 1 3 349.478 2.795 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NC[C@H](C)N2CCC(C)CC2)CC1 ZINC000102005922 472562089 /nfs/dbraw/zinc/56/20/89/472562089.db2.gz BYSIOHOQLHNFOE-KRWDZBQOSA-N 1 3 338.540 2.528 10 0 EFAEHO CC[C@@H]([NH3+])C(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000130584048 472615078 /nfs/dbraw/zinc/61/50/78/472615078.db2.gz WLXJODJBDRTKJK-HXUWFJFHSA-N 1 3 339.483 2.885 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)N(C)C ZINC000131644887 472682517 /nfs/dbraw/zinc/68/25/17/472682517.db2.gz PTWKWQXRPKWVDP-PVAVHDDUSA-N 1 3 337.533 2.833 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)N(C)C ZINC000131644887 472682521 /nfs/dbraw/zinc/68/25/21/472682521.db2.gz PTWKWQXRPKWVDP-PVAVHDDUSA-N 1 3 337.533 2.833 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000105148825 472728016 /nfs/dbraw/zinc/72/80/16/472728016.db2.gz KHMZDFLJMHJZLR-MSOLQXFVSA-N 1 3 338.540 2.623 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)N[C@@H](C)CN2CCCCC2)CC1 ZINC000072907174 472739363 /nfs/dbraw/zinc/73/93/63/472739363.db2.gz ZFQVIBVVOUNDMS-KRWDZBQOSA-N 1 3 344.503 2.597 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)N[C@@H](CN(C)C)c1ccccc1 ZINC000120785302 472745895 /nfs/dbraw/zinc/74/58/95/472745895.db2.gz VKMTZRRSDFKIPF-MOPGFXCFSA-N 1 3 346.519 2.709 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)N[C@@H](CN(C)C)c1ccccc1 ZINC000120785302 472745899 /nfs/dbraw/zinc/74/58/99/472745899.db2.gz VKMTZRRSDFKIPF-MOPGFXCFSA-N 1 3 346.519 2.709 10 0 EFAEHO CC(C)[NH+](CCNC(=O)N[C@H](CN(C)C)c1ccccc1)C(C)C ZINC000047683807 472757717 /nfs/dbraw/zinc/75/77/17/472757717.db2.gz NZWVXFGFLFRKHY-GOSISDBHSA-N 1 3 334.508 2.707 10 0 EFAEHO CC(C)[C@H](NCc1ccnc(OCC[NH+](C)C)c1)c1cccnc1 ZINC000091408654 472763127 /nfs/dbraw/zinc/76/31/27/472763127.db2.gz QXJONGPMOKWDCU-IBGZPJMESA-N 1 3 328.460 2.904 10 0 EFAEHO CN(C)C[C@H](NC(=O)NCC(C)(C)[NH+]1CCCCC1)c1ccccc1 ZINC000047910414 472779955 /nfs/dbraw/zinc/77/99/55/472779955.db2.gz AHAYRACJQRYBQQ-SFHVURJKSA-N 1 3 346.519 2.853 10 0 EFAEHO Cc1ccc(C)c(OC[C@@H](O)CN2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000047972225 472790268 /nfs/dbraw/zinc/79/02/68/472790268.db2.gz OIHXQEGJURDEFQ-FQEVSTJZSA-N 1 3 346.515 2.851 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000079077024 472815217 /nfs/dbraw/zinc/81/52/17/472815217.db2.gz NZRSZGWOPKYADI-AWEZNQCLSA-N 1 3 326.529 2.571 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NC[C@@H](C)N2CCC[C@H](C)C2)CC1 ZINC000073658877 472847092 /nfs/dbraw/zinc/84/70/92/472847092.db2.gz NZAYZPMAIYJJAX-DLBZAZTESA-N 1 3 338.540 2.528 10 0 EFAEHO Cc1cnn(CCNCc2ccccc2N(C)C2CC[NH+](C)CC2)c1 ZINC000134017332 472864981 /nfs/dbraw/zinc/86/49/81/472864981.db2.gz ZJDSKKMRDMJQBJ-UHFFFAOYSA-N 1 3 341.503 2.512 10 0 EFAEHO CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H](c1ccc(F)c(Cl)c1)N[C@@]2(CC)CO ZINC000065372104 472928258 /nfs/dbraw/zinc/92/82/58/472928258.db2.gz BQXDMIICMMCIAT-GFOFROLCSA-N 1 3 326.843 2.832 10 0 EFAEHO CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H](c1ccc(F)c(Cl)c1)N[C@@]2(CC)CO ZINC000065372104 472928262 /nfs/dbraw/zinc/92/82/62/472928262.db2.gz BQXDMIICMMCIAT-GFOFROLCSA-N 1 3 326.843 2.832 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)Nc1ccc(OCCC[NH+](C)C)cc1 ZINC000107280168 472939571 /nfs/dbraw/zinc/93/95/71/472939571.db2.gz FRXRXVKLAAJHQX-GOSISDBHSA-N 1 3 333.476 2.830 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)N(C)C ZINC000620191720 480020600 /nfs/dbraw/zinc/02/06/00/480020600.db2.gz BYCSDRQRQBFHAP-RBUKOAKNSA-N 1 3 343.515 2.745 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)N(C)C ZINC000620191720 480020606 /nfs/dbraw/zinc/02/06/06/480020606.db2.gz BYCSDRQRQBFHAP-RBUKOAKNSA-N 1 3 343.515 2.745 10 0 EFAEHO Cc1ccc([C@@H](C)NC(=O)NC2CCN(C3CC[NH+](C)CC3)CC2)o1 ZINC000051759474 473066321 /nfs/dbraw/zinc/06/63/21/473066321.db2.gz USEQKANNSSLALZ-OAHLLOKOSA-N 1 3 348.491 2.507 10 0 EFAEHO Cc1ccc([C@H](C)NC(=O)NC2CCN(C3CC[NH+](C)CC3)CC2)o1 ZINC000051759476 473066714 /nfs/dbraw/zinc/06/67/14/473066714.db2.gz USEQKANNSSLALZ-HNNXBMFYSA-N 1 3 348.491 2.507 10 0 EFAEHO C[C@H](N[C@@H](C)[C@H](O)C(F)(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000631716739 480234951 /nfs/dbraw/zinc/23/49/51/480234951.db2.gz BXENEBYLTJLDPJ-HUBLWGQQSA-N 1 3 334.382 2.589 10 0 EFAEHO COc1cc(OC)c(OC)cc1CNCCCNc1cc[nH+]cc1 ZINC000075107978 473125775 /nfs/dbraw/zinc/12/57/75/473125775.db2.gz DCRIPOCHQFJFJO-UHFFFAOYSA-N 1 3 331.416 2.699 10 0 EFAEHO CN(c1ccccc1C[NH2+]CC1(CCO)CCC1)C1CCN(C)CC1 ZINC000136540906 473162668 /nfs/dbraw/zinc/16/26/68/473162668.db2.gz MLFSGJSUAGVVLK-UHFFFAOYSA-N 1 3 345.531 2.859 10 0 EFAEHO CCN1CC[C@@H](C[NH2+]C2CCN(CCc3ccc(F)cc3)CC2)C1 ZINC000163256548 473426988 /nfs/dbraw/zinc/42/69/88/473426988.db2.gz RZODXNOWQSHOON-SFHVURJKSA-N 1 3 333.495 2.764 10 0 EFAEHO C[C@H](NCC1CC[NH+](C[C@@H](O)c2ccccc2)CC1)c1cnccn1 ZINC000151916290 473507212 /nfs/dbraw/zinc/50/72/12/473507212.db2.gz FQOYYZHAJTYOFQ-OXJNMPFZSA-N 1 3 340.471 2.573 10 0 EFAEHO COC(=O)c1ccc(CN2CCC[C@@H]2Cn2ccnc2C)cc1F ZINC000152010273 473516185 /nfs/dbraw/zinc/51/61/85/473516185.db2.gz YOBJNVDCGOBPPW-OAHLLOKOSA-N 1 3 331.391 2.782 10 0 EFAEHO Cc1nn(C)c(C)c1[C@@H]1CCC[N@H+]1CCCN1CCN(C(C)C)CC1 ZINC000191487194 473545024 /nfs/dbraw/zinc/54/50/24/473545024.db2.gz NWLXFOODXPPXRK-IBGZPJMESA-N 1 3 347.551 2.590 10 0 EFAEHO Cc1nn(C)c(C)c1[C@@H]1CCC[N@@H+]1CCCN1CCN(C(C)C)CC1 ZINC000191487194 473545029 /nfs/dbraw/zinc/54/50/29/473545029.db2.gz NWLXFOODXPPXRK-IBGZPJMESA-N 1 3 347.551 2.590 10 0 EFAEHO C[C@H](C[NH+]1CCCCC1)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000179189408 473649689 /nfs/dbraw/zinc/64/96/89/473649689.db2.gz ZOAGBYJFUZVSEM-BHIYHBOVSA-N 1 3 344.503 2.605 10 0 EFAEHO O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1C[C@H]2CCCC[C@H]2[NH2+]1 ZINC000262666685 473708114 /nfs/dbraw/zinc/70/81/14/473708114.db2.gz KIYKNAYZWNKQMD-WCIQWLHISA-N 1 3 341.499 2.688 10 0 EFAEHO O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1C[C@@H]2CCCC[C@H]2[NH2+]1 ZINC000262666684 473708486 /nfs/dbraw/zinc/70/84/86/473708486.db2.gz KIYKNAYZWNKQMD-HAGHYFMRSA-N 1 3 341.499 2.688 10 0 EFAEHO C[C@@H](CO[C@@H]1CCOC1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180160222 473816203 /nfs/dbraw/zinc/81/62/03/473816203.db2.gz VOOBCLHCFGHEHL-KXEVLKFVSA-N 1 3 344.499 2.966 10 0 EFAEHO C[C@@H](CO[C@@H]1CCOC1)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180160222 473816209 /nfs/dbraw/zinc/81/62/09/473816209.db2.gz VOOBCLHCFGHEHL-KXEVLKFVSA-N 1 3 344.499 2.966 10 0 EFAEHO CN1CC[C@@H](NC(=O)c2cccc(C[NH+](C)C)c2)[C@@H]1c1ccccc1 ZINC000180176204 473817985 /nfs/dbraw/zinc/81/79/85/473817985.db2.gz KMICVXMLJUOUTI-UXHICEINSA-N 1 3 337.467 2.923 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@@H](c2ccccc2)N(C)C)[C@@H](C)C1 ZINC000246298407 473819933 /nfs/dbraw/zinc/81/99/33/473819933.db2.gz AGTIGYIWTBRGPV-WDSOQIARSA-N 1 3 346.519 2.661 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NC[C@@H](c2ccccc2)N(C)C)[C@@H](C)C1 ZINC000246298407 473819941 /nfs/dbraw/zinc/81/99/41/473819941.db2.gz AGTIGYIWTBRGPV-WDSOQIARSA-N 1 3 346.519 2.661 10 0 EFAEHO COc1cc2c(cc1F)CC[C@@H]2[NH2+]C1CCN([C@H]2CCC[C@@H]2O)CC1 ZINC000281734121 473822667 /nfs/dbraw/zinc/82/26/67/473822667.db2.gz VCUNHYNKYMXALR-FHWLQOOXSA-N 1 3 348.462 2.789 10 0 EFAEHO OC1(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)CCOCC1 ZINC000269576599 473837816 /nfs/dbraw/zinc/83/78/16/473837816.db2.gz CTTDULMLPKPJNF-VQTJNVASSA-N 1 3 344.499 2.514 10 0 EFAEHO OC1(CN2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)CCOCC1 ZINC000269576599 473837821 /nfs/dbraw/zinc/83/78/21/473837821.db2.gz CTTDULMLPKPJNF-VQTJNVASSA-N 1 3 344.499 2.514 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@@H]1CNC(=O)c1ccc(Nc2ccncc2)cc1 ZINC000617012762 480063689 /nfs/dbraw/zinc/06/36/89/480063689.db2.gz GZGTVEPOKHZFIL-GOSISDBHSA-N 1 3 338.455 2.850 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1ccc(Nc2ccncc2)cc1 ZINC000617012762 480063696 /nfs/dbraw/zinc/06/36/96/480063696.db2.gz GZGTVEPOKHZFIL-GOSISDBHSA-N 1 3 338.455 2.850 10 0 EFAEHO COc1ccccc1-n1nccc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C ZINC000281816547 473848000 /nfs/dbraw/zinc/84/80/00/473848000.db2.gz WGKCKQCCLWTYCT-ALOPSCKCSA-N 1 3 340.471 2.986 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)C1 ZINC000246402737 473852114 /nfs/dbraw/zinc/85/21/14/473852114.db2.gz RQVXZHXOGXHYLY-SQNIBIBYSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)C1 ZINC000246402737 473852124 /nfs/dbraw/zinc/85/21/24/473852124.db2.gz RQVXZHXOGXHYLY-SQNIBIBYSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NCc1cccc(CN(C)C)c1 ZINC000246413177 473856413 /nfs/dbraw/zinc/85/64/13/473856413.db2.gz SDOYLKUURXSRLK-MOPGFXCFSA-N 1 3 344.503 2.516 10 0 EFAEHO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1cccc(CN(C)C)c1 ZINC000246413177 473856415 /nfs/dbraw/zinc/85/64/15/473856415.db2.gz SDOYLKUURXSRLK-MOPGFXCFSA-N 1 3 344.503 2.516 10 0 EFAEHO CC1CCN([C@H](CNC(=O)[C@@H]2CC[C@@H]([NH3+])C2)c2ccccc2)CC1 ZINC000246498793 473881260 /nfs/dbraw/zinc/88/12/60/473881260.db2.gz PSUBIAHOBXGUIY-GUDVDZBRSA-N 1 3 329.488 2.703 10 0 EFAEHO C[C@H](O)C[NH+]1CCC(CN(C)Cc2cnc(-c3ccco3)s2)CC1 ZINC000194385643 473889192 /nfs/dbraw/zinc/88/91/92/473889192.db2.gz FJPWUSVRHYQLNR-AWEZNQCLSA-N 1 3 349.500 2.928 10 0 EFAEHO C[N@@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000246662649 473929456 /nfs/dbraw/zinc/92/94/56/473929456.db2.gz DNIFOMYMLOATLK-VQTJNVASSA-N 1 3 341.499 2.839 10 0 EFAEHO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000246662649 473929463 /nfs/dbraw/zinc/92/94/63/473929463.db2.gz DNIFOMYMLOATLK-VQTJNVASSA-N 1 3 341.499 2.839 10 0 EFAEHO CCC1([NH+]2CCCC2)CCN(C(=O)CCN(C)c2ccncc2)CC1 ZINC000633958372 480072907 /nfs/dbraw/zinc/07/29/07/480072907.db2.gz XYJTYDSHFWVNIT-UHFFFAOYSA-N 1 3 344.503 2.775 10 0 EFAEHO CC[NH+](CC)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000174153379 473996962 /nfs/dbraw/zinc/99/69/62/473996962.db2.gz IJNHNLZNNRCQRE-IBGZPJMESA-N 1 3 329.488 2.839 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)N1CCc2ccccc21 ZINC000174317722 474021320 /nfs/dbraw/zinc/02/13/20/474021320.db2.gz SEXAIJPPXWRYGW-GOSISDBHSA-N 1 3 344.503 2.517 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)N1CCc2ccccc21 ZINC000174317722 474021327 /nfs/dbraw/zinc/02/13/27/474021327.db2.gz SEXAIJPPXWRYGW-GOSISDBHSA-N 1 3 344.503 2.517 10 0 EFAEHO C[C@H]([NH2+]CCCCN1CCOCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000274974722 474026306 /nfs/dbraw/zinc/02/63/06/474026306.db2.gz YJIHIYTXWRHDNM-FPOVZHCZSA-N 1 3 345.531 2.599 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)C(C)C ZINC000174352701 474026950 /nfs/dbraw/zinc/02/69/50/474026950.db2.gz JCSHUBFVLJHGCW-SJORKVTESA-N 1 3 326.529 2.619 10 0 EFAEHO CCN1CC[C@@H](C[NH2+][C@H](C)c2ccc(NC(=O)NC3CC3)cc2)C1 ZINC000247088255 474061691 /nfs/dbraw/zinc/06/16/91/474061691.db2.gz PGCKBMXEEPENHR-CABCVRRESA-N 1 3 330.476 2.963 10 0 EFAEHO CCO[C@H]1C[C@H]([NH2+]CC2(N3CCCCC3)CCN(C)CC2)C12CCC2 ZINC000181827580 474066142 /nfs/dbraw/zinc/06/61/42/474066142.db2.gz SYHJNFHVDALQRD-OALUTQOASA-N 1 3 349.563 2.874 10 0 EFAEHO CCC[NH+](CCC)CCCNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000174680846 474078798 /nfs/dbraw/zinc/07/87/98/474078798.db2.gz LVUDSMKRDDTLPV-IAGOWNOFSA-N 1 3 326.529 2.623 10 0 EFAEHO CCCN1CC[C@@H](C[NH2+]C[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000247238220 474097108 /nfs/dbraw/zinc/09/71/08/474097108.db2.gz YQTLAYHZGHFZBZ-SJORKVTESA-N 1 3 339.524 2.955 10 0 EFAEHO CN(CCC[NH+]1CCCC1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000282587431 474120397 /nfs/dbraw/zinc/12/03/97/474120397.db2.gz LNCXITSYUTYTIX-RBUKOAKNSA-N 1 3 344.503 2.559 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@@H](O)CO[C@H]2CCCc3ccccc32)CC[N@@H+]1C ZINC000247372495 474131462 /nfs/dbraw/zinc/13/14/62/474131462.db2.gz SBTHUEFKXQEDBJ-VELGLUOQSA-N 1 3 346.515 2.856 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@@H](O)CO[C@H]2CCCc3ccccc32)CC[N@H+]1C ZINC000247372495 474131467 /nfs/dbraw/zinc/13/14/67/474131467.db2.gz SBTHUEFKXQEDBJ-VELGLUOQSA-N 1 3 346.515 2.856 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)NCCCCC[NH+]2CCCCC2)CCN1C ZINC000175136683 474148144 /nfs/dbraw/zinc/14/81/44/474148144.db2.gz OVHIXDPNCRACBI-ZWKOTPCHSA-N 1 3 338.540 2.767 10 0 EFAEHO CC[NH+](CC)CCOc1ccc(NC(=O)NC[C@@H]2CCCN2C)cc1 ZINC000265486920 474232915 /nfs/dbraw/zinc/23/29/15/474232915.db2.gz UJISQSRBRAPOAO-KRWDZBQOSA-N 1 3 348.491 2.623 10 0 EFAEHO CN1CC[C@@H](NC(=O)c2cccc(C[NH+](C)C)c2)[C@H]1c1ccccc1 ZINC000248032109 474248382 /nfs/dbraw/zinc/24/83/82/474248382.db2.gz KMICVXMLJUOUTI-WOJBJXKFSA-N 1 3 337.467 2.923 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2ccccc2CCN(C)C)[C@H](C)C1 ZINC000275611551 474252616 /nfs/dbraw/zinc/25/26/16/474252616.db2.gz IGUGDNOFSLNINJ-APWZRJJASA-N 1 3 346.519 2.985 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccccc2CCN(C)C)[C@H](C)C1 ZINC000275611551 474252624 /nfs/dbraw/zinc/25/26/24/474252624.db2.gz IGUGDNOFSLNINJ-APWZRJJASA-N 1 3 346.519 2.985 10 0 EFAEHO O=C1OCC[C@@H]1CC[N@@H+]1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1 ZINC000248161051 474272903 /nfs/dbraw/zinc/27/29/03/474272903.db2.gz SCQSEXHVRHZNMB-XUVXKRRUSA-N 1 3 342.483 2.926 10 0 EFAEHO O=C1OCC[C@@H]1CC[N@H+]1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1 ZINC000248161051 474272910 /nfs/dbraw/zinc/27/29/10/474272910.db2.gz SCQSEXHVRHZNMB-XUVXKRRUSA-N 1 3 342.483 2.926 10 0 EFAEHO O=C1OCC[C@@H]1CC[N@@H+]1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1 ZINC000248161048 474272959 /nfs/dbraw/zinc/27/29/59/474272959.db2.gz SCQSEXHVRHZNMB-UFYCRDLUSA-N 1 3 342.483 2.926 10 0 EFAEHO O=C1OCC[C@@H]1CC[N@H+]1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1 ZINC000248161048 474272963 /nfs/dbraw/zinc/27/29/63/474272963.db2.gz SCQSEXHVRHZNMB-UFYCRDLUSA-N 1 3 342.483 2.926 10 0 EFAEHO COCCOCC[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000248399747 474307370 /nfs/dbraw/zinc/30/73/70/474307370.db2.gz KDEIQCKENJLRKN-XUVXKRRUSA-N 1 3 332.488 2.540 10 0 EFAEHO COCCOCCN[C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248399747 474307374 /nfs/dbraw/zinc/30/73/74/474307374.db2.gz KDEIQCKENJLRKN-XUVXKRRUSA-N 1 3 332.488 2.540 10 0 EFAEHO COCCOCCN[C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248399747 474307382 /nfs/dbraw/zinc/30/73/82/474307382.db2.gz KDEIQCKENJLRKN-XUVXKRRUSA-N 1 3 332.488 2.540 10 0 EFAEHO CC(C)NC(=O)CCN[C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000248400317 474307638 /nfs/dbraw/zinc/30/76/38/474307638.db2.gz QCPJUIKOAYNKDT-YRWFTTLQSA-N 1 3 331.504 2.647 10 0 EFAEHO CC(C)NC(=O)CCN[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000248400317 474307640 /nfs/dbraw/zinc/30/76/40/474307640.db2.gz QCPJUIKOAYNKDT-YRWFTTLQSA-N 1 3 331.504 2.647 10 0 EFAEHO CN(C)C[C@@H](Cc1ccccc1)NC(=O)CC[C@@H]([NH3+])c1ccccc1 ZINC000237012021 474322091 /nfs/dbraw/zinc/32/20/91/474322091.db2.gz LQKVSIFJFFKFRY-WOJBJXKFSA-N 1 3 339.483 2.756 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)NCC[C@H]1CCC[NH2+]C1 ZINC000237046703 474327453 /nfs/dbraw/zinc/32/74/53/474327453.db2.gz DNUZTTWZOAJTMJ-CQSZACIVSA-N 1 3 329.444 2.614 10 0 EFAEHO CCN(C(=O)C1CC[NH2+]CC1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000237046969 474328334 /nfs/dbraw/zinc/32/83/34/474328334.db2.gz MLXVQGAHUGDERI-LPHOPBHVSA-N 1 3 329.488 2.670 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2[NH2+]1)N(C)Cc1ccccc1 ZINC000237447358 474405810 /nfs/dbraw/zinc/40/58/10/474405810.db2.gz XOECPJOQVJPJOR-BVBHFADKSA-N 1 3 329.488 2.544 10 0 EFAEHO CCCN(CCC[NH+](C)C)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000248702075 474408650 /nfs/dbraw/zinc/40/86/50/474408650.db2.gz NEHTZUZRRXIGOY-OALUTQOASA-N 1 3 346.519 2.805 10 0 EFAEHO CN(C[C@H](O)CC(F)(F)F)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000189482991 474414204 /nfs/dbraw/zinc/41/42/04/474414204.db2.gz MIFFMNHCTZFSPE-HZPDHXFCSA-N 1 3 330.394 2.754 10 0 EFAEHO CN(C[C@H](O)CC(F)(F)F)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000189482991 474414208 /nfs/dbraw/zinc/41/42/08/474414208.db2.gz MIFFMNHCTZFSPE-HZPDHXFCSA-N 1 3 330.394 2.754 10 0 EFAEHO CN(C[C@H](O)CC(F)(F)F)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000189482969 474414672 /nfs/dbraw/zinc/41/46/72/474414672.db2.gz MIFFMNHCTZFSPE-JKSUJKDBSA-N 1 3 330.394 2.754 10 0 EFAEHO CN(C[C@H](O)CC(F)(F)F)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000189482969 474414677 /nfs/dbraw/zinc/41/46/77/474414677.db2.gz MIFFMNHCTZFSPE-JKSUJKDBSA-N 1 3 330.394 2.754 10 0 EFAEHO C[C@H]1CN([C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)c2cccs2)CCO1 ZINC000248827445 474447588 /nfs/dbraw/zinc/44/75/88/474447588.db2.gz GPVVPLFGEROVTQ-XWDNEUNKSA-N 1 3 349.544 2.725 10 0 EFAEHO c1c[nH]c(C2CCN(CCC[NH+]3CCC(c4ncc[nH]4)CC3)CC2)n1 ZINC000266692108 474450065 /nfs/dbraw/zinc/45/00/65/474450065.db2.gz AWUOGJCKOAJHHK-UHFFFAOYSA-N 1 3 342.491 2.582 10 0 EFAEHO CCO[C@@H]1C[C@H](NCCC[NH+]2C[C@H](C)C[C@@H](C)C2)C12CCOCC2 ZINC000248974402 474494796 /nfs/dbraw/zinc/49/47/96/474494796.db2.gz HHGNYFMTLPPGRG-AKHDSKFASA-N 1 3 338.536 2.918 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]CCCN2C[C@H](C)C[C@@H](C)C2)C12CCOCC2 ZINC000248974402 474494801 /nfs/dbraw/zinc/49/48/01/474494801.db2.gz HHGNYFMTLPPGRG-AKHDSKFASA-N 1 3 338.536 2.918 10 0 EFAEHO CCO[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCN(CC(C)C)C2)C12CCOCC2 ZINC000248994540 474500856 /nfs/dbraw/zinc/50/08/56/474500856.db2.gz LTEHKLOXUJKWBU-GUDVDZBRSA-N 1 3 338.536 2.918 10 0 EFAEHO O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1C[C@@H]2CCCC[C@@H]2[NH2+]1 ZINC000237928390 474506993 /nfs/dbraw/zinc/50/69/93/474506993.db2.gz KIYKNAYZWNKQMD-MUGJNUQGSA-N 1 3 341.499 2.688 10 0 EFAEHO CC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)OCCCO1 ZINC000249051696 474512672 /nfs/dbraw/zinc/51/26/72/474512672.db2.gz XPLSECWBXXWHTJ-LDLYASANSA-N 1 3 330.472 2.925 10 0 EFAEHO C[C@@H](CCNC(=O)Nc1ccc2c(c1)OCCNC2)[NH+]1CCCCC1 ZINC000625942189 480113496 /nfs/dbraw/zinc/11/34/96/480113496.db2.gz SAOMLBXDDIPXBE-HNNXBMFYSA-N 1 3 346.475 2.555 10 0 EFAEHO CCC(CC)[C@H](CNC(=O)Nc1ccc2c(c1)OCCNC2)[NH+](C)C ZINC000625943065 480114710 /nfs/dbraw/zinc/11/47/10/480114710.db2.gz CZUCJIMRITZEGK-KRWDZBQOSA-N 1 3 348.491 2.657 10 0 EFAEHO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)N[C@H](CN(C)C)c1ccccc1 ZINC000249774125 474613964 /nfs/dbraw/zinc/61/39/64/474613964.db2.gz MHDGFIBWJVWQAT-ZHALLVOQSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N[C@H](CN(C)C)c1ccccc1 ZINC000249774125 474613971 /nfs/dbraw/zinc/61/39/71/474613971.db2.gz MHDGFIBWJVWQAT-ZHALLVOQSA-N 1 3 346.519 2.709 10 0 EFAEHO CN(C)C[C@@H](NC(=O)CC1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000291618431 474632950 /nfs/dbraw/zinc/63/29/50/474632950.db2.gz KFRWWXLUOPXKOH-QGZVFWFLSA-N 1 3 337.895 2.791 10 0 EFAEHO CN1CCC(CC(=O)NC[C@@H](C2CC2)[N@H+](C)Cc2ccccc2)CC1 ZINC000291633660 474637433 /nfs/dbraw/zinc/63/74/33/474637433.db2.gz IBRFRDYLOVHLEO-FQEVSTJZSA-N 1 3 343.515 2.745 10 0 EFAEHO CN1CCC(CC(=O)NC[C@@H](C2CC2)[N@@H+](C)Cc2ccccc2)CC1 ZINC000291633660 474637435 /nfs/dbraw/zinc/63/74/35/474637435.db2.gz IBRFRDYLOVHLEO-FQEVSTJZSA-N 1 3 343.515 2.745 10 0 EFAEHO CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)CC1CC[NH+](C)CC1 ZINC000291772704 474679350 /nfs/dbraw/zinc/67/93/50/474679350.db2.gz WNGMQYCLCQAZFD-HXUWFJFHSA-N 1 3 345.531 2.991 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CC1 ZINC000252801428 474713967 /nfs/dbraw/zinc/71/39/67/474713967.db2.gz JNGWPKDJOWNPRR-MOPGFXCFSA-N 1 3 329.488 2.668 10 0 EFAEHO CN1CCC[C@@H](CNC2=[NH+]CCN2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000253426486 474751092 /nfs/dbraw/zinc/75/10/92/474751092.db2.gz IYXPIOIHCCAWPR-ZFWWWQNUSA-N 1 3 340.393 2.637 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)c1 ZINC000623053302 480124421 /nfs/dbraw/zinc/12/44/21/480124421.db2.gz AMLVIVLCEOORSZ-SJLPKXTDSA-N 1 3 330.476 2.744 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@@]34C[C@@H]3CCCC4)CC2)CC1 ZINC000634089235 480125395 /nfs/dbraw/zinc/12/53/95/480125395.db2.gz IYPPSAVTNXIAQA-PXNSSMCTSA-N 1 3 333.520 2.632 10 0 EFAEHO COC(=O)COc1ccc(CN2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000340928602 474786211 /nfs/dbraw/zinc/78/62/11/474786211.db2.gz YBWAEQQMNCOJCZ-UHFFFAOYSA-N 1 3 346.471 2.546 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NC[C@H](C)N2CCCC[C@H]2C)CC1 ZINC000340940475 474800047 /nfs/dbraw/zinc/80/00/47/474800047.db2.gz RTOVKAPUAVPCSE-SJORKVTESA-N 1 3 338.540 2.671 10 0 EFAEHO C[NH2+]Cc1ccccc1CNC(=O)Nc1cccc(CN(C)C)c1 ZINC000623064210 480126921 /nfs/dbraw/zinc/12/69/21/480126921.db2.gz XKWILWNOAPEYIY-UHFFFAOYSA-N 1 3 326.444 2.789 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCc3ccccc3[C@H]2C[NH3+])c1 ZINC000623066453 480127067 /nfs/dbraw/zinc/12/70/67/480127067.db2.gz IALWXHTWMLHWTL-LJQANCHMSA-N 1 3 338.455 2.838 10 0 EFAEHO C[C@H]1CCN(C(=O)CC2CC[NH+](C)CC2)CCN1Cc1ccccc1 ZINC000273278673 474819812 /nfs/dbraw/zinc/81/98/12/474819812.db2.gz WFFNRUMBAYPVKZ-SFHVURJKSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCCOC[C@H](O)C[NH2+][C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000310940885 474832406 /nfs/dbraw/zinc/83/24/06/474832406.db2.gz JQOZRFSJNZEFPO-JSXRDJHFSA-N 1 3 346.515 2.664 10 0 EFAEHO CCCCOC[C@H](O)CN[C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000310940885 474832415 /nfs/dbraw/zinc/83/24/15/474832415.db2.gz JQOZRFSJNZEFPO-JSXRDJHFSA-N 1 3 346.515 2.664 10 0 EFAEHO CCCCOC[C@H](O)CN[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000310940885 474832419 /nfs/dbraw/zinc/83/24/19/474832419.db2.gz JQOZRFSJNZEFPO-JSXRDJHFSA-N 1 3 346.515 2.664 10 0 EFAEHO CC(C)[C@@H](NCC(=O)NC1CC[NH+](C2CC2)CC1)c1ccc(F)cc1 ZINC000337443054 475024922 /nfs/dbraw/zinc/02/49/22/475024922.db2.gz ZCJNUVMMQAYCTC-HXUWFJFHSA-N 1 3 347.478 2.855 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CCCCN2CCOCC2)CCN1Cc1ccccc1 ZINC000268782070 475041913 /nfs/dbraw/zinc/04/19/13/475041913.db2.gz QEBTXGLZXISHMY-FPOVZHCZSA-N 1 3 345.531 2.742 10 0 EFAEHO C[C@@H](NCCN1CCC([NH+](C)C)CC1)c1cnn(C2CCCC2)c1 ZINC000337471040 475047145 /nfs/dbraw/zinc/04/71/45/475047145.db2.gz NRCBWNIEAHPLKV-MRXNPFEDSA-N 1 3 333.524 2.675 10 0 EFAEHO C[C@@H](C(=O)Nc1ccc2c(c1F)CC[NH2+]C2)[C@H](N)c1ccccc1 ZINC000261746550 475047394 /nfs/dbraw/zinc/04/73/94/475047394.db2.gz ORVPBWGMPLZIRH-XIKOKIGWSA-N 1 3 327.403 2.746 10 0 EFAEHO CN1CCN(CC2(C)CC[NH+](Cc3cccc4c3NCC4)CC2)CC1 ZINC000261768588 475056877 /nfs/dbraw/zinc/05/68/77/475056877.db2.gz DOEFDMCGEJXNHD-UHFFFAOYSA-N 1 3 342.531 2.504 10 0 EFAEHO c1ccc(N2CCC([NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCCN3)CC2)nc1 ZINC000261795068 475065780 /nfs/dbraw/zinc/06/57/80/475065780.db2.gz ZGAQMIIRQVOCIY-CEXWTWQISA-N 1 3 328.504 2.951 10 0 EFAEHO c1ccc(OCC2CC2)c(CN[C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)c1 ZINC000261920900 475114670 /nfs/dbraw/zinc/11/46/70/475114670.db2.gz KJKNGEWTWHVMOB-OTWHNJEPSA-N 1 3 330.472 2.722 10 0 EFAEHO Cc1cc(Cl)cc(CN[C@@H](CC(C)C)C(=O)NCC[NH+](C)C)c1 ZINC000339324525 475139410 /nfs/dbraw/zinc/13/94/10/475139410.db2.gz BLXUTLNRGLSAAI-KRWDZBQOSA-N 1 3 339.911 2.831 10 0 EFAEHO c1ccc(OC2CCC2)c(CN[C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)c1 ZINC000262029051 475151102 /nfs/dbraw/zinc/15/11/02/475151102.db2.gz XHSRKNPZKRLXND-GUDVDZBRSA-N 1 3 330.472 2.865 10 0 EFAEHO C([NH2+][C@@H]1CCC[C@@H]1[C@H]1COCCN1)[C@H]1CCCN1CC1CCCCC1 ZINC000262037269 475154386 /nfs/dbraw/zinc/15/43/86/475154386.db2.gz YDYIARJRGKAEGR-PLACYPQZSA-N 1 3 349.563 2.778 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)[C@@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000262295229 475215959 /nfs/dbraw/zinc/21/59/59/475215959.db2.gz OQHLTSXNKWIMHX-NXHRZFHOSA-N 1 3 329.488 2.846 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)NC1CCC(C[NH+](C)C)CC1 ZINC000354535423 475227608 /nfs/dbraw/zinc/22/76/08/475227608.db2.gz OJOZUOZYFMDSFX-UHFFFAOYSA-N 1 3 338.540 2.624 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@]2(O)CCC[C@H]2C)CC1 ZINC000339554266 475302655 /nfs/dbraw/zinc/30/26/55/475302655.db2.gz BYZLKNLSEKRKKM-NQIIRXRSSA-N 1 3 345.531 2.859 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2CCO[C@@H](C)C2)CC1 ZINC000354687119 475337992 /nfs/dbraw/zinc/33/79/92/475337992.db2.gz DHFTZTZFGDDAKA-PKOBYXMFSA-N 1 3 331.504 2.876 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2CCO[C@H](C)C2)CC1 ZINC000354686689 475338395 /nfs/dbraw/zinc/33/83/95/475338395.db2.gz DHFTZTZFGDDAKA-MJGOQNOKSA-N 1 3 331.504 2.876 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@H](CO)CC2)CC1 ZINC000354690105 475339512 /nfs/dbraw/zinc/33/95/12/475339512.db2.gz IDFPBLFDWYTOPR-IBGZPJMESA-N 1 3 345.531 2.813 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@H](CO)CC2)CC1 ZINC000354690105 475339520 /nfs/dbraw/zinc/33/95/20/475339520.db2.gz IDFPBLFDWYTOPR-IBGZPJMESA-N 1 3 345.531 2.813 10 0 EFAEHO CN(C)C(=O)CC[NH+]1CCC(N[C@H]2CCCc3sccc32)CC1 ZINC000361340719 475368664 /nfs/dbraw/zinc/36/86/64/475368664.db2.gz HVOBGCORPPSDOQ-INIZCTEOSA-N 1 3 335.517 2.658 10 0 EFAEHO C[C@H]([NH2+]C[C@H](CO)c1cccnc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000348202912 475483394 /nfs/dbraw/zinc/48/33/94/475483394.db2.gz BGLJJZNOXAICIX-DZFGPLHGSA-N 1 3 339.483 2.658 10 0 EFAEHO C[C@H](NC[C@H](CO)c1cccnc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000348202912 475483402 /nfs/dbraw/zinc/48/34/02/475483402.db2.gz BGLJJZNOXAICIX-DZFGPLHGSA-N 1 3 339.483 2.658 10 0 EFAEHO C[C@H](NC[C@H](CO)c1cccnc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000348202912 475483407 /nfs/dbraw/zinc/48/34/07/475483407.db2.gz BGLJJZNOXAICIX-DZFGPLHGSA-N 1 3 339.483 2.658 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](NCCc2cnc(C3CC3)nc2)[C@@H](C)C1 ZINC000358221684 475502948 /nfs/dbraw/zinc/50/29/48/475502948.db2.gz HSDMHQQSVMAYEG-QFBILLFUSA-N 1 3 346.519 2.623 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](NCCc2cnc(C3CC3)nc2)[C@@H](C)C1 ZINC000358221684 475502956 /nfs/dbraw/zinc/50/29/56/475502956.db2.gz HSDMHQQSVMAYEG-QFBILLFUSA-N 1 3 346.519 2.623 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000355061564 475635548 /nfs/dbraw/zinc/63/55/48/475635548.db2.gz VNGIRGHMUJCLNM-LJQANCHMSA-N 1 3 349.494 2.980 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)CC[C@H]1CCCC[N@H+]1C ZINC000355061564 475635556 /nfs/dbraw/zinc/63/55/56/475635556.db2.gz VNGIRGHMUJCLNM-LJQANCHMSA-N 1 3 349.494 2.980 10 0 EFAEHO CN(C)CCNC(=O)c1ccc(C[NH2+][C@@H]2CC[C@@H]2C(C)(C)C)cc1 ZINC000348396029 475638820 /nfs/dbraw/zinc/63/88/20/475638820.db2.gz MGQFDEYOOKXVNG-ZWKOTPCHSA-N 1 3 331.504 2.892 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCC[C@H](C)CO)CC1 ZINC000340103226 475760336 /nfs/dbraw/zinc/76/03/36/475760336.db2.gz FQJWAURZPOXFAY-SFHVURJKSA-N 1 3 333.520 2.717 10 0 EFAEHO CN1CC[C@H](NC(=O)CC[C@H]2CCCC[N@@H+]2C)[C@H]1c1ccccc1 ZINC000355243420 475772308 /nfs/dbraw/zinc/77/23/08/475772308.db2.gz STERXLQTEOAMBG-WSTZPKSXSA-N 1 3 329.488 2.813 10 0 EFAEHO CN1CC[C@H](NC(=O)CC[C@H]2CCCC[N@H+]2C)[C@H]1c1ccccc1 ZINC000355243420 475772316 /nfs/dbraw/zinc/77/23/16/475772316.db2.gz STERXLQTEOAMBG-WSTZPKSXSA-N 1 3 329.488 2.813 10 0 EFAEHO CN1CC[C@H]([NH2+]CCCN2CCc3ccccc3C2)[C@@H]2CCC[C@@H]21 ZINC000353444889 475972285 /nfs/dbraw/zinc/97/22/85/475972285.db2.gz GTMZUYHRWAFTGA-ACRUOGEOSA-N 1 3 327.516 2.897 10 0 EFAEHO CN1CC[C@H]([NH2+]CCCN2CCc3ccccc3C2)[C@H]2CCC[C@H]21 ZINC000353444892 475972934 /nfs/dbraw/zinc/97/29/34/475972934.db2.gz GTMZUYHRWAFTGA-QHAWAJNXSA-N 1 3 327.516 2.897 10 0 EFAEHO C[C@@H]([NH2+]C(C)(C)CNC(=O)CC1CCN(C)CC1)c1ccccc1 ZINC000346959345 475990524 /nfs/dbraw/zinc/99/05/24/475990524.db2.gz DRXWOFYCOUYUHZ-MRXNPFEDSA-N 1 3 331.504 2.964 10 0 EFAEHO CC[C@H](Cn1cncn1)NCc1ccccc1C[NH+]1CCCCC1 ZINC000340475735 476057990 /nfs/dbraw/zinc/05/79/90/476057990.db2.gz XYOSQBYVNRBJEX-LJQANCHMSA-N 1 3 327.476 2.832 10 0 EFAEHO CCO[C@@H]1C[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)[C@@H]1n1cccn1 ZINC000340541354 476096083 /nfs/dbraw/zinc/09/60/83/476096083.db2.gz QGPLBLWGZYXRNI-AQNXPRMDSA-N 1 3 346.519 2.988 10 0 EFAEHO CCCN(CCc1cccs1)CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000362245066 476107651 /nfs/dbraw/zinc/10/76/51/476107651.db2.gz HGGONWNCBKIMDW-UHFFFAOYSA-N 1 3 349.544 2.746 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)[C@@H]2CCC[C@H]21 ZINC000353604549 476118044 /nfs/dbraw/zinc/11/80/44/476118044.db2.gz JFUIWJPEQFJYHP-XSDIEEQYSA-N 1 3 327.516 2.971 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)[C@@H]2CCC[C@@H]21 ZINC000353611512 476122637 /nfs/dbraw/zinc/12/26/37/476122637.db2.gz YSOUJNUZDTZODQ-WPVAHCMFSA-N 1 3 332.463 2.754 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)[C@@H]2CCC[C@@H]21 ZINC000353611512 476122648 /nfs/dbraw/zinc/12/26/48/476122648.db2.gz YSOUJNUZDTZODQ-WPVAHCMFSA-N 1 3 332.463 2.754 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)CCN1C ZINC000336693908 476125156 /nfs/dbraw/zinc/12/51/56/476125156.db2.gz IBXRTHRSZSJRAB-RSRIQPTJSA-N 1 3 327.516 2.969 10 0 EFAEHO CC[C@H]1C[C@H](C[NH+]2CCC(C)(CN3CCN(C)CC3)CC2)CCO1 ZINC000350551351 476239618 /nfs/dbraw/zinc/23/96/18/476239618.db2.gz FENROXLOKZQWJE-MOPGFXCFSA-N 1 3 337.552 2.541 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@H]1CCCC[N@@H+]1C)Cc1ccco1 ZINC000360027350 476284469 /nfs/dbraw/zinc/28/44/69/476284469.db2.gz ICZRXBWHUBPXQE-QGZVFWFLSA-N 1 3 335.492 2.824 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@H]1CCCC[N@H+]1C)Cc1ccco1 ZINC000360027350 476284473 /nfs/dbraw/zinc/28/44/73/476284473.db2.gz ICZRXBWHUBPXQE-QGZVFWFLSA-N 1 3 335.492 2.824 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@@H](CNC(=O)NCCN2[C@H](C)CCC[C@@H]2C)C1 ZINC000362508376 476290046 /nfs/dbraw/zinc/29/00/46/476290046.db2.gz GHJJMULFBRCABQ-KSZLIROESA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)C[N@H+]1CC[C@@H](CNC(=O)NCCN2[C@H](C)CCC[C@@H]2C)C1 ZINC000362508376 476290049 /nfs/dbraw/zinc/29/00/49/476290049.db2.gz GHJJMULFBRCABQ-KSZLIROESA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@H](CNC(=O)NCCN2[C@H](C)CCC[C@H]2C)C1 ZINC000362508377 476290087 /nfs/dbraw/zinc/29/00/87/476290087.db2.gz GHJJMULFBRCABQ-KZNAEPCWSA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)C[N@H+]1CC[C@H](CNC(=O)NCCN2[C@H](C)CCC[C@H]2C)C1 ZINC000362508377 476290090 /nfs/dbraw/zinc/29/00/90/476290090.db2.gz GHJJMULFBRCABQ-KZNAEPCWSA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)C[C@H](N[C@@H]1CC(C)(C)Cc2occc21)C(=O)NCC[NH+](C)C ZINC000354005914 476355971 /nfs/dbraw/zinc/35/59/71/476355971.db2.gz JELOVFKKCYBWHH-DLBZAZTESA-N 1 3 349.519 2.975 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccc3ccccc3n2)CC[C@H]1N1CCN(C)CC1 ZINC000362704959 476358939 /nfs/dbraw/zinc/35/89/39/476358939.db2.gz WDOYILMGFMABJJ-DYESRHJHSA-N 1 3 338.499 2.693 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccc3ccccc3n2)CC[C@H]1N1CCN(C)CC1 ZINC000362704959 476358946 /nfs/dbraw/zinc/35/89/46/476358946.db2.gz WDOYILMGFMABJJ-DYESRHJHSA-N 1 3 338.499 2.693 10 0 EFAEHO Cn1c2ccc(CN3CCCC4(CC[NH+](C)CC4)C3)cc2sc1=O ZINC000369720344 476494273 /nfs/dbraw/zinc/49/42/73/476494273.db2.gz HGTDUVNTKCFRRG-UHFFFAOYSA-N 1 3 345.512 2.908 10 0 EFAEHO COCCOC[C@H](C)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000354209865 476506294 /nfs/dbraw/zinc/50/62/94/476506294.db2.gz ZCMPNZCQNJEBAR-OHSMVPPVSA-N 1 3 332.488 2.823 10 0 EFAEHO COCCOC[C@H](C)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000354209865 476506298 /nfs/dbraw/zinc/50/62/98/476506298.db2.gz ZCMPNZCQNJEBAR-OHSMVPPVSA-N 1 3 332.488 2.823 10 0 EFAEHO CC[NH+](CC)CCC[C@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000377747770 476559003 /nfs/dbraw/zinc/55/90/03/476559003.db2.gz HCWVMRKCWZOEAI-YJBOKZPZSA-N 1 3 329.504 2.826 10 0 EFAEHO CC[NH+](CC)CCC[C@@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000377747769 476559150 /nfs/dbraw/zinc/55/91/50/476559150.db2.gz HCWVMRKCWZOEAI-QAPCUYQASA-N 1 3 329.504 2.826 10 0 EFAEHO C[N@@H+]1CCCC[C@@H]1CCC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000352219952 476559878 /nfs/dbraw/zinc/55/98/78/476559878.db2.gz UAFGGKKTDMUJMG-LJQANCHMSA-N 1 3 335.536 2.975 10 0 EFAEHO C[N@H+]1CCCC[C@@H]1CCC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000352219952 476559882 /nfs/dbraw/zinc/55/98/82/476559882.db2.gz UAFGGKKTDMUJMG-LJQANCHMSA-N 1 3 335.536 2.975 10 0 EFAEHO [NH2+]=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCCCC1 ZINC000369877011 476569006 /nfs/dbraw/zinc/56/90/06/476569006.db2.gz FPGXSAFGCKJHGC-UHFFFAOYSA-N 1 3 332.414 2.802 10 0 EFAEHO CC[C@@H](Cc1ccccc1)N(C)CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000357748188 476575458 /nfs/dbraw/zinc/57/54/58/476575458.db2.gz NJQIMBFXWKLPQL-IBGZPJMESA-N 1 3 343.515 2.683 10 0 EFAEHO CC(C)[NH+]1CCC(NC[C@@H](CO)Cc2ccc(F)c(F)c2)CC1 ZINC000357849006 476647252 /nfs/dbraw/zinc/64/72/52/476647252.db2.gz KYXRYLKXGOVZBC-HNNXBMFYSA-N 1 3 326.431 2.578 10 0 EFAEHO CN1CCC[C@@H](CNC(=O)NC(C)(C)CC[NH3+])[C@H]1c1cccs1 ZINC000422605638 476716787 /nfs/dbraw/zinc/71/67/87/476716787.db2.gz QKNNIJYVCCAZLB-ZFWWWQNUSA-N 1 3 338.521 2.558 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)C[C@@H]2CCC[NH2+]C2)CCN1Cc1ccccc1 ZINC000379672340 476730499 /nfs/dbraw/zinc/73/04/99/476730499.db2.gz NCRVNOLJZYZKHT-NEWSRXKRSA-N 1 3 329.488 2.545 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)C[C@@H]2CCC[NH2+]C2)CCN1Cc1ccccc1 ZINC000379672341 476730839 /nfs/dbraw/zinc/73/08/39/476730839.db2.gz NCRVNOLJZYZKHT-NZSAHSFTSA-N 1 3 329.488 2.545 10 0 EFAEHO [NH3+]C[C@@H]1CCC[C@@H]1C(=O)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000379656252 476731210 /nfs/dbraw/zinc/73/12/10/476731210.db2.gz ONKKKKLJYVUOQM-FHWLQOOXSA-N 1 3 329.488 2.532 10 0 EFAEHO CC(C)COC[C@H](O)C[NH2+][C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]12 ZINC000381466726 476737981 /nfs/dbraw/zinc/73/79/81/476737981.db2.gz YNANLZIVEGSPTJ-XRXFAXGQSA-N 1 3 346.515 2.520 10 0 EFAEHO CC(C)COC[C@H](O)CN[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC000381466726 476737988 /nfs/dbraw/zinc/73/79/88/476737988.db2.gz YNANLZIVEGSPTJ-XRXFAXGQSA-N 1 3 346.515 2.520 10 0 EFAEHO CC(C)COC[C@H](O)CN[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC000381466726 476737994 /nfs/dbraw/zinc/73/79/94/476737994.db2.gz YNANLZIVEGSPTJ-XRXFAXGQSA-N 1 3 346.515 2.520 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)C1CCC([NH3+])CC1 ZINC000382716721 476745089 /nfs/dbraw/zinc/74/50/89/476745089.db2.gz FVVJXPRHZBWWOT-IPJUCJBFSA-N 1 3 329.488 2.627 10 0 EFAEHO C([NH2+][C@@H](C1CC1)[C@H]1CNCCO1)C1(N2CCCCC2)CCCCC1 ZINC000422766021 476766709 /nfs/dbraw/zinc/76/67/09/476766709.db2.gz WYEDRJXNTJUJPG-MOPGFXCFSA-N 1 3 335.536 2.532 10 0 EFAEHO C(N[C@@H](C1CC1)[C@H]1CNCCO1)C1([NH+]2CCCCC2)CCCCC1 ZINC000422766021 476766714 /nfs/dbraw/zinc/76/67/14/476766714.db2.gz WYEDRJXNTJUJPG-MOPGFXCFSA-N 1 3 335.536 2.532 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@H](C)c1cnn(-c2ccc(F)cc2)c1C ZINC000422788547 476776376 /nfs/dbraw/zinc/77/63/76/476776376.db2.gz SJPRXMSKJHQVTO-CJNGLKHVSA-N 1 3 334.439 2.724 10 0 EFAEHO CCCCOCCOCCN[C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422802264 476783732 /nfs/dbraw/zinc/78/37/32/476783732.db2.gz DEXUMAPZAVGIIH-UYAOXDASSA-N 1 3 348.487 2.665 10 0 EFAEHO Cc1nc(CCN[C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cs1 ZINC000422816044 476790434 /nfs/dbraw/zinc/79/04/34/476790434.db2.gz DBGROWCFYPKCNY-SJLPKXTDSA-N 1 3 329.469 2.840 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CCc1cnn(-c2ccccc2)c1 ZINC000422815601 476790976 /nfs/dbraw/zinc/79/09/76/476790976.db2.gz CBBCNJBHYONLCL-HNNXBMFYSA-N 1 3 335.455 2.928 10 0 EFAEHO C[C@H](C[C@H]1COCCN1)[NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000390531449 476795980 /nfs/dbraw/zinc/79/59/80/476795980.db2.gz DUSDCHLTGCOLLD-HYCNCBECSA-N 1 3 343.515 2.539 10 0 EFAEHO c1ccc(COCCCCN[C@@H]2CCOC[C@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000422830807 476799548 /nfs/dbraw/zinc/79/95/48/476799548.db2.gz DBNXZLUUGFXTJI-SLFFLAALSA-N 1 3 332.488 2.730 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@H](C[NH2+][C@H]3CCCC[C@@H]3CN)C2)c1 ZINC000422870196 476820203 /nfs/dbraw/zinc/82/02/03/476820203.db2.gz BKQWVWNPVLOXTG-QINHECLXSA-N 1 3 347.503 2.637 10 0 EFAEHO C[C@H]([NH2+]CC1=CCN(C)CC1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000392273234 476823880 /nfs/dbraw/zinc/82/38/80/476823880.db2.gz WPTFTUNOSCJFPS-RDJZCZTQSA-N 1 3 337.508 2.874 10 0 EFAEHO C[C@H]([NH2+]CC1=CCN(C)CC1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000392273231 476824244 /nfs/dbraw/zinc/82/42/44/476824244.db2.gz WPTFTUNOSCJFPS-DOTOQJQBSA-N 1 3 337.508 2.874 10 0 EFAEHO COc1ccccc1N1CC[C@H](N[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000422878119 476824443 /nfs/dbraw/zinc/82/44/43/476824443.db2.gz SKWDAINIFWMHII-XWTMOSNGSA-N 1 3 329.488 2.784 10 0 EFAEHO C[C@@H](Nc1ccc(N2CCC([NH+](C)C)CC2)cn1)c1cnccc1N ZINC000422957853 476866140 /nfs/dbraw/zinc/86/61/40/476866140.db2.gz VMODHOQWILFALB-CQSZACIVSA-N 1 3 340.475 2.593 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)c2ccccc2CC[NH3+])CN1Cc1ccccc1 ZINC000398127734 476868215 /nfs/dbraw/zinc/86/82/15/476868215.db2.gz IODDJVPHKAUUKT-LPHOPBHVSA-N 1 3 337.467 2.581 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)c2ccccc2CC[NH3+])CN1Cc1ccccc1 ZINC000398127741 476868568 /nfs/dbraw/zinc/86/85/68/476868568.db2.gz IODDJVPHKAUUKT-VQIMIIECSA-N 1 3 337.467 2.581 10 0 EFAEHO CC[C@H](CN[C@H](c1ccc(OC)cc1)[C@@H]1CCC[NH2+]1)N1CCCC1 ZINC000422963395 476868637 /nfs/dbraw/zinc/86/86/37/476868637.db2.gz IKDHANTXZBFXFB-YZGWKJHDSA-N 1 3 331.504 2.952 10 0 EFAEHO C[C@@H]1CC[NH2+]CC[C@@H]1NC[C@@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422986645 476880107 /nfs/dbraw/zinc/88/01/07/476880107.db2.gz DAJNPXIVJYNHRE-KMFMINBZSA-N 1 3 344.421 2.834 10 0 EFAEHO C[C@@H]1CCNCC[C@@H]1[NH2+]C[C@@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422986645 476880113 /nfs/dbraw/zinc/88/01/13/476880113.db2.gz DAJNPXIVJYNHRE-KMFMINBZSA-N 1 3 344.421 2.834 10 0 EFAEHO CN(C)c1ncc(C[NH2+]C[C@@H]2CCCN(C)[C@@H]2c2cccs2)n1C ZINC000414360548 476880095 /nfs/dbraw/zinc/88/00/95/476880095.db2.gz RDBOQALPGMPPLP-YOEHRIQHSA-N 1 3 347.532 2.720 10 0 EFAEHO NC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422991709 476882843 /nfs/dbraw/zinc/88/28/43/476882843.db2.gz QAQFPVDPRVTLEL-DZKIICNBSA-N 1 3 330.394 2.573 10 0 EFAEHO [NH3+]C[C@@H]1CCC[C@@H]1NC[C@@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422991709 476882849 /nfs/dbraw/zinc/88/28/49/476882849.db2.gz QAQFPVDPRVTLEL-DZKIICNBSA-N 1 3 330.394 2.573 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C)[C@@H](C)[NH3+] ZINC000399518712 476883938 /nfs/dbraw/zinc/88/39/38/476883938.db2.gz NWSPNICLUXNTAS-RWQQGDIJSA-N 1 3 331.504 2.633 10 0 EFAEHO Clc1ccc(COCCN[C@@H]2CCOC[C@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000423002111 476886137 /nfs/dbraw/zinc/88/61/37/476886137.db2.gz IVSAHLHJDWBWRV-RCCFBDPRSA-N 1 3 338.879 2.603 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@H](Cn1ccnc1)c1ccc(C)cc1C ZINC000423007863 476889517 /nfs/dbraw/zinc/88/95/17/476889517.db2.gz YULGWQXHRCMYAH-PKOBYXMFSA-N 1 3 330.476 2.585 10 0 EFAEHO CC(C)N(C)CCC[NH2+][C@@H](C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000400459091 476890463 /nfs/dbraw/zinc/89/04/63/476890463.db2.gz QVNYFWJKINHVOZ-JKSUJKDBSA-N 1 3 327.513 2.952 10 0 EFAEHO COc1ccc2c(c1)OC[C@@H]([NH2+][C@@H](C)c1ccc(CN)nc1C)C2 ZINC000423022067 476895296 /nfs/dbraw/zinc/89/52/96/476895296.db2.gz HADBVGPSKSVEBT-BBRMVZONSA-N 1 3 327.428 2.512 10 0 EFAEHO COCC1(CNCc2csc(-c3ccccc3)n2)CC[NH2+]CC1 ZINC000414954354 476899796 /nfs/dbraw/zinc/89/97/96/476899796.db2.gz LFERIWYFJCEGGR-UHFFFAOYSA-N 1 3 331.485 2.916 10 0 EFAEHO COC[C@@]1(C[NH2+][C@H](C)CCc2ccc(OC(F)F)cc2)CCCN1 ZINC000414956264 476902777 /nfs/dbraw/zinc/90/27/77/476902777.db2.gz OOWAGRYJYAUZJU-KDOFPFPSSA-N 1 3 342.430 2.967 10 0 EFAEHO Cc1cc(CNCC2(O)CC[NH+](Cc3ccccc3)CC2)sn1 ZINC000404441399 476917681 /nfs/dbraw/zinc/91/76/81/476917681.db2.gz KMAFSXOTNCDOCU-UHFFFAOYSA-N 1 3 331.485 2.568 10 0 EFAEHO OC[C@H](CN[C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1)Cc1ccc(F)c(F)c1 ZINC000423082174 476920239 /nfs/dbraw/zinc/92/02/39/476920239.db2.gz WGSHQDWGKHTIMR-STEAMIEHSA-N 1 3 338.442 2.626 10 0 EFAEHO C[C@H]([NH3+])[C@@H](Cc1ccccc1)NC[C@@H](CO)Cc1ccc(F)c(F)c1 ZINC000423079842 476921154 /nfs/dbraw/zinc/92/11/54/476921154.db2.gz RFVAXGXLECVZJQ-GZRFBZBPSA-N 1 3 348.437 2.664 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2CNCC[C@@H]2C)ccc1I ZINC000423092086 476925840 /nfs/dbraw/zinc/92/58/40/476925840.db2.gz ANSSHJFLMQVCAW-HZMBPMFUSA-N 1 3 344.240 2.687 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCN(c2ccccc2F)C1 ZINC000423123133 476936426 /nfs/dbraw/zinc/93/64/26/476936426.db2.gz DFYAPEHRVXZWGL-GOEBONIOSA-N 1 3 328.435 2.917 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1cccc(Br)c1Cl ZINC000423172431 476951983 /nfs/dbraw/zinc/95/19/83/476951983.db2.gz SXJLZTAHBCTMMF-LLVKDONJSA-N 1 3 335.673 2.946 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@H]1CCN(c2ccc(F)cc2)C1 ZINC000423173967 476953175 /nfs/dbraw/zinc/95/31/75/476953175.db2.gz ASCDDBQEUXMWQN-PBHICJAKSA-N 1 3 328.435 2.917 10 0 EFAEHO C[C@H]([NH3+])[C@@H](Cc1ccccc1)N[C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000423187464 476957681 /nfs/dbraw/zinc/95/76/81/476957681.db2.gz POWQHAZTRPFDQE-QKYXUNIQSA-N 1 3 327.447 2.953 10 0 EFAEHO C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CC1(N)CCCCCC1 ZINC000423206975 476963534 /nfs/dbraw/zinc/96/35/34/476963534.db2.gz XLIBIBHINUUAME-IEBWSBKVSA-N 1 3 330.520 2.933 10 0 EFAEHO C[C@@H]1CN(Cc2ccccn2)CC[C@H]1NCC1([NH3+])CCCCCC1 ZINC000423206975 476963541 /nfs/dbraw/zinc/96/35/41/476963541.db2.gz XLIBIBHINUUAME-IEBWSBKVSA-N 1 3 330.520 2.933 10 0 EFAEHO CNCc1ccccc1NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C(C)C ZINC000415903547 476964847 /nfs/dbraw/zinc/96/48/47/476964847.db2.gz AEJRATRYTFVSQC-SJORKVTESA-N 1 3 330.476 2.885 10 0 EFAEHO CNCc1ccccc1NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000415903547 476964852 /nfs/dbraw/zinc/96/48/52/476964852.db2.gz AEJRATRYTFVSQC-SJORKVTESA-N 1 3 330.476 2.885 10 0 EFAEHO Fc1ccc([C@H](NC[C@H](N2CC[NH2+]CC2)C(F)(F)F)C2CC2)cc1 ZINC000423399136 477017113 /nfs/dbraw/zinc/01/71/13/477017113.db2.gz VYJXZNJCWYANKU-JKSUJKDBSA-N 1 3 345.384 2.703 10 0 EFAEHO CC[NH+](CC)CCCCNC(=O)CCN1CCc2ccccc2C1 ZINC000416156513 477043365 /nfs/dbraw/zinc/04/33/65/477043365.db2.gz GNAGNWROFHEDER-UHFFFAOYSA-N 1 3 331.504 2.673 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCc2nnc(-c3ccccc3)o2)[C@@H]2CCC[C@H]21 ZINC000375855653 477050196 /nfs/dbraw/zinc/05/01/96/477050196.db2.gz BMUQIMLHEXYGIR-YESZJQIVSA-N 1 3 326.444 2.742 10 0 EFAEHO C[N@H+]1CC[C@H](NCCc2nnc(-c3ccccc3)o2)[C@@H]2CCC[C@H]21 ZINC000375855653 477050202 /nfs/dbraw/zinc/05/02/02/477050202.db2.gz BMUQIMLHEXYGIR-YESZJQIVSA-N 1 3 326.444 2.742 10 0 EFAEHO C[N@@H+]1CCCC[C@@H]1CCC(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000431625722 477064089 /nfs/dbraw/zinc/06/40/89/477064089.db2.gz PMKMULSPHHIFNG-HXUWFJFHSA-N 1 3 343.515 2.985 10 0 EFAEHO C[N@H+]1CCCC[C@@H]1CCC(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000431625722 477064097 /nfs/dbraw/zinc/06/40/97/477064097.db2.gz PMKMULSPHHIFNG-HXUWFJFHSA-N 1 3 343.515 2.985 10 0 EFAEHO COc1cc(OC)cc(OCC[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@@H]32)c1 ZINC000375891936 477066644 /nfs/dbraw/zinc/06/66/44/477066644.db2.gz XKAIKBIBZRXQRP-QRVBRYPASA-N 1 3 334.460 2.545 10 0 EFAEHO COc1cc(OC)cc(OCCN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)c1 ZINC000375891936 477066649 /nfs/dbraw/zinc/06/66/49/477066649.db2.gz XKAIKBIBZRXQRP-QRVBRYPASA-N 1 3 334.460 2.545 10 0 EFAEHO COc1cc(OC)cc(OCCN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@@H]32)c1 ZINC000375891936 477066655 /nfs/dbraw/zinc/06/66/55/477066655.db2.gz XKAIKBIBZRXQRP-QRVBRYPASA-N 1 3 334.460 2.545 10 0 EFAEHO C[NH+](C)CC1(CNC(=O)CCN2CCc3ccccc3C2)CCCC1 ZINC000416199795 477069042 /nfs/dbraw/zinc/06/90/42/477069042.db2.gz MACWNACEQIDTOQ-UHFFFAOYSA-N 1 3 343.515 2.673 10 0 EFAEHO CC[C@H](CC(F)F)C(=O)N(CCN(C)C)C[C@H]1CCC[N@@H+]1CC ZINC000457536344 477074324 /nfs/dbraw/zinc/07/43/24/477074324.db2.gz PCBJOVRDWUAXQS-HUUCEWRRSA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@H](CC(F)F)C(=O)N(CCN(C)C)C[C@H]1CCC[N@H+]1CC ZINC000457536344 477074329 /nfs/dbraw/zinc/07/43/29/477074329.db2.gz PCBJOVRDWUAXQS-HUUCEWRRSA-N 1 3 333.467 2.542 10 0 EFAEHO CN(C)[C@H](CC(=O)NC1CCC(C[NH+](C)C)CC1)c1ccccc1 ZINC000431830135 477102014 /nfs/dbraw/zinc/10/20/14/477102014.db2.gz HYXSXXJDHMHVOY-NKELODKYSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@@H](CNC(=O)CCN2CCc3ccccc3C2)C1 ZINC000431849193 477107272 /nfs/dbraw/zinc/10/72/72/477107272.db2.gz CDYKEDZYIXFJKR-SFHVURJKSA-N 1 3 343.515 2.529 10 0 EFAEHO CC(C)C[N@H+]1CC[C@@H](CNC(=O)CCN2CCc3ccccc3C2)C1 ZINC000431849193 477107281 /nfs/dbraw/zinc/10/72/81/477107281.db2.gz CDYKEDZYIXFJKR-SFHVURJKSA-N 1 3 343.515 2.529 10 0 EFAEHO C[N@@H+]1CCCC[C@H]1CCC(=O)NCCCN1CCc2ccccc2C1 ZINC000431896501 477116584 /nfs/dbraw/zinc/11/65/84/477116584.db2.gz QBVJKPOCRHKESS-FQEVSTJZSA-N 1 3 343.515 2.816 10 0 EFAEHO C[N@H+]1CCCC[C@H]1CCC(=O)NCCCN1CCc2ccccc2C1 ZINC000431896501 477116589 /nfs/dbraw/zinc/11/65/89/477116589.db2.gz QBVJKPOCRHKESS-FQEVSTJZSA-N 1 3 343.515 2.816 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](C)N2CCCC[C@H]2C)[C@H](C)C1 ZINC000448462151 477176804 /nfs/dbraw/zinc/17/68/04/477176804.db2.gz QXFFGUBRBBHMRG-BDXSIMOUSA-N 1 3 338.540 2.621 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NC[C@H](C)N2CCCC[C@H]2C)[C@H](C)C1 ZINC000448462151 477176810 /nfs/dbraw/zinc/17/68/10/477176810.db2.gz QXFFGUBRBBHMRG-BDXSIMOUSA-N 1 3 338.540 2.621 10 0 EFAEHO CC[C@@H](CO)N1CCN(Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000411295165 477184982 /nfs/dbraw/zinc/18/49/82/477184982.db2.gz ODTXCPDUCKVVDT-NRFANRHFSA-N 1 3 345.531 2.561 10 0 EFAEHO CCO[C@@H]1COC[C@H]1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000453369262 477215663 /nfs/dbraw/zinc/21/56/63/477215663.db2.gz SXYUWSHXHXZBNT-USYVTKNRSA-N 1 3 330.472 2.576 10 0 EFAEHO CC[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@@H]2CCC[C@H]21)C(=O)NC ZINC000453398933 477221472 /nfs/dbraw/zinc/22/14/72/477221472.db2.gz JTXKYQAIOUCRFP-INDMIFKZSA-N 1 3 329.488 2.544 10 0 EFAEHO CN(C)C[C@@H](Cc1ccccc1)NC(=O)NC(C)(C)CCC[NH+](C)C ZINC000457914735 477254217 /nfs/dbraw/zinc/25/42/17/477254217.db2.gz QDBZZRCPOYVLAD-GOSISDBHSA-N 1 3 348.535 2.579 10 0 EFAEHO C[C@@H]1CC2(CCC2)CN1C(=O)NC1CCN(C2CC[NH+](C)CC2)CC1 ZINC000432906387 477284222 /nfs/dbraw/zinc/28/42/22/477284222.db2.gz NFGJRLIATMESAL-MRXNPFEDSA-N 1 3 348.535 2.519 10 0 EFAEHO C[C@@H]([NH3+])[C@@H](C)NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000416831107 477327176 /nfs/dbraw/zinc/32/71/76/477327176.db2.gz HIFFMDHFZZVURK-RBSFLKMASA-N 1 3 338.521 2.556 10 0 EFAEHO COCCN(Cc1ccc(C[NH+]2CCCCC2)cc1)[C@H]1CCOC1 ZINC000411686428 477327358 /nfs/dbraw/zinc/32/73/58/477327358.db2.gz LDHHYFUVUQNPNR-FQEVSTJZSA-N 1 3 332.488 2.910 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)N(C1CC1)[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000416847924 477335425 /nfs/dbraw/zinc/33/54/25/477335425.db2.gz WCBQYEAVIRCQAO-MOPGFXCFSA-N 1 3 344.503 2.605 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@H]([NH2+]Cc3ccc(OCCN(C)C)cc3)C[C@H]2C1 ZINC000424267536 477348267 /nfs/dbraw/zinc/34/82/67/477348267.db2.gz MNWJGILVTOTAFQ-XGPVDZAGSA-N 1 3 332.488 2.920 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@H]([NH2+]Cc3ccccc3OCCN(C)C)C[C@H]2C1 ZINC000424269040 477350383 /nfs/dbraw/zinc/35/03/83/477350383.db2.gz LWVLGYFIDYXBND-MKQMEDFFSA-N 1 3 332.488 2.920 10 0 EFAEHO C[C@]1(CNC(=O)N[C@@H]2CCCC[C@H]2[NH3+])CCCN1Cc1ccccc1 ZINC000424458529 477415339 /nfs/dbraw/zinc/41/53/39/477415339.db2.gz CLKCMZDEGPARPF-QWFCFKBJSA-N 1 3 344.503 2.610 10 0 EFAEHO C[C@@H](Cc1ccoc1)[NH2+]Cc1ccc(CN2CCN(C)CC2)cc1 ZINC000449081099 477427985 /nfs/dbraw/zinc/42/79/85/477427985.db2.gz BSVVXXVSGLKYFN-KRWDZBQOSA-N 1 3 327.472 2.748 10 0 EFAEHO CC[C@@H](C)NC(=O)CCNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449093783 477435924 /nfs/dbraw/zinc/43/59/24/477435924.db2.gz YLAWCDSYOTXBFK-MSOLQXFVSA-N 1 3 345.531 2.976 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NCCSCCCO)CC1 ZINC000449122900 477448302 /nfs/dbraw/zinc/44/83/02/477448302.db2.gz ATIDFHYEPZJOLN-QGZVFWFLSA-N 1 3 336.545 2.787 10 0 EFAEHO Cc1noc(CCCNC2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)n1 ZINC000449132831 477453231 /nfs/dbraw/zinc/45/32/31/477453231.db2.gz BSFLIGAZCAPRKU-INIZCTEOSA-N 1 3 342.487 2.996 10 0 EFAEHO C[C@H](CO[C@H]1CCOC1)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449183441 477474578 /nfs/dbraw/zinc/47/45/78/477474578.db2.gz FTOHEEJBVZFMDQ-LQWHRVPQSA-N 1 3 346.515 2.866 10 0 EFAEHO CCC(=O)N1CC[C@H](NC2CC[NH+]([C@H](C)Cc3ccccc3)CC2)C1 ZINC000449194697 477480110 /nfs/dbraw/zinc/48/01/10/477480110.db2.gz VKBBIGFMZLWMBG-XLIONFOSSA-N 1 3 343.515 2.683 10 0 EFAEHO CCO[C@@H]1COCC[C@@H]1NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449238252 477501818 /nfs/dbraw/zinc/50/18/18/477501818.db2.gz QLSPDVJKIPCXEY-DZFGPLHGSA-N 1 3 346.515 2.866 10 0 EFAEHO COCC[C@@H](COC)NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449337020 477554712 /nfs/dbraw/zinc/55/47/12/477554712.db2.gz OYTPVFLRSWNNDR-XLIONFOSSA-N 1 3 334.504 2.723 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cccc(N3CCCC3=O)c2)[C@H]2CCC[C@@H]21 ZINC000367612326 477600261 /nfs/dbraw/zinc/60/02/61/477600261.db2.gz ADTDTDKGDFSHHZ-QYZOEREBSA-N 1 3 327.472 2.776 10 0 EFAEHO COc1cc(NCCN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)cc(OC)c1 ZINC000367614503 477601222 /nfs/dbraw/zinc/60/12/22/477601222.db2.gz HBGLVNCJMWBOMZ-IPMKNSEASA-N 1 3 333.476 2.578 10 0 EFAEHO COc1cc(NCCN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@H]32)cc(OC)c1 ZINC000367614503 477601228 /nfs/dbraw/zinc/60/12/28/477601228.db2.gz HBGLVNCJMWBOMZ-IPMKNSEASA-N 1 3 333.476 2.578 10 0 EFAEHO Cn1c2cccc(F)c2nc1CCN[C@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000367618995 477605102 /nfs/dbraw/zinc/60/51/02/477605102.db2.gz UXKBZWZKYNUNII-KBMXLJTQSA-N 1 3 330.451 2.717 10 0 EFAEHO Cn1c2cccc(F)c2nc1CCN[C@H]1CC[N@@H+](C)[C@H]2CCC[C@@H]21 ZINC000367618995 477605105 /nfs/dbraw/zinc/60/51/05/477605105.db2.gz UXKBZWZKYNUNII-KBMXLJTQSA-N 1 3 330.451 2.717 10 0 EFAEHO OC[C@@H]1CCC[N@@H+]1Cc1ccccc1CN[C@@H]1CCCc2n[nH]cc21 ZINC000367640287 477615795 /nfs/dbraw/zinc/61/57/95/477615795.db2.gz ZODVSZCGNDSLPW-PKOBYXMFSA-N 1 3 340.471 2.534 10 0 EFAEHO OC[C@@H]1CCC[N@H+]1Cc1ccccc1CN[C@@H]1CCCc2n[nH]cc21 ZINC000367640287 477615802 /nfs/dbraw/zinc/61/58/02/477615802.db2.gz ZODVSZCGNDSLPW-PKOBYXMFSA-N 1 3 340.471 2.534 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCNC(=O)c2ccccc2Cl)[C@H]2CCC[C@@H]21 ZINC000367750648 477671805 /nfs/dbraw/zinc/67/18/05/477671805.db2.gz BARAAAPENIOXHK-PVAVHDDUSA-N 1 3 335.879 2.532 10 0 EFAEHO C[N@H+]1CC[C@H](NCCNC(=O)c2ccccc2Cl)[C@H]2CCC[C@@H]21 ZINC000367750648 477671812 /nfs/dbraw/zinc/67/18/12/477671812.db2.gz BARAAAPENIOXHK-PVAVHDDUSA-N 1 3 335.879 2.532 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCNC(=O)c2ccccc2Cl)[C@@H]2CCC[C@@H]21 ZINC000367750649 477672084 /nfs/dbraw/zinc/67/20/84/477672084.db2.gz BARAAAPENIOXHK-XIRDDKMYSA-N 1 3 335.879 2.532 10 0 EFAEHO C[N@H+]1CC[C@H](NCCNC(=O)c2ccccc2Cl)[C@@H]2CCC[C@@H]21 ZINC000367750649 477672087 /nfs/dbraw/zinc/67/20/87/477672087.db2.gz BARAAAPENIOXHK-XIRDDKMYSA-N 1 3 335.879 2.532 10 0 EFAEHO CC(C)Oc1ccc2[nH+]ccc(N3CCN(CCO)C[C@H]3C)c2c1 ZINC000450952930 477773601 /nfs/dbraw/zinc/77/36/01/477773601.db2.gz JNFOXJOSXOTAFZ-OAHLLOKOSA-N 1 3 329.444 2.525 10 0 EFAEHO CC(C)Oc1ccc2[nH+]ccc(N3CCN(CCO)C[C@@H]3C)c2c1 ZINC000450952929 477774756 /nfs/dbraw/zinc/77/47/56/477774756.db2.gz JNFOXJOSXOTAFZ-HNNXBMFYSA-N 1 3 329.444 2.525 10 0 EFAEHO CN1CCC(O)(C[NH2+][C@@H]2CCCc3ncc(C(F)(F)F)cc32)CC1 ZINC000427689766 477776540 /nfs/dbraw/zinc/77/65/40/477776540.db2.gz JSIWIJSWACPWGU-OAHLLOKOSA-N 1 3 343.393 2.524 10 0 EFAEHO CCN(C(=O)C1CC[NH2+]CC1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000368453752 477808028 /nfs/dbraw/zinc/80/80/28/477808028.db2.gz MLXVQGAHUGDERI-VQIMIIECSA-N 1 3 329.488 2.670 10 0 EFAEHO CN(C)C[C@H](Cc1ccccc1)NC(=O)C1(C[NH+](C)C)CCCCC1 ZINC000460278956 477857511 /nfs/dbraw/zinc/85/75/11/477857511.db2.gz DHUMIZKGTDBPTI-IBGZPJMESA-N 1 3 345.531 2.788 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)C1 ZINC000558652134 477906659 /nfs/dbraw/zinc/90/66/59/477906659.db2.gz AOHKOPBDWMDKCK-ZWKOTPCHSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)C1 ZINC000558652134 477906669 /nfs/dbraw/zinc/90/66/69/477906669.db2.gz AOHKOPBDWMDKCK-ZWKOTPCHSA-N 1 3 343.515 2.877 10 0 EFAEHO CCC[NH+](CCC)CCCNC(=O)N1CCc2ccccc2[C@H]1CN ZINC000516649680 477969073 /nfs/dbraw/zinc/96/90/73/477969073.db2.gz YMQSBLOKXTZNRK-LJQANCHMSA-N 1 3 346.519 2.766 10 0 EFAEHO CCOc1ccc(C(=O)N2CCC([NH2+][C@@H]3CCC[C@@H](N)C3)CC2)cc1 ZINC000516785857 477988570 /nfs/dbraw/zinc/98/85/70/477988570.db2.gz YFUSWQFHAKSJDL-SJLPKXTDSA-N 1 3 345.487 2.549 10 0 EFAEHO CCC[N@H+](C)C[C@H]1CCN(C(=O)NCCN2[C@H](C)CCC[C@@H]2C)C1 ZINC000465894322 477994430 /nfs/dbraw/zinc/99/44/30/477994430.db2.gz AESVLSKESRAEMH-FGTMMUONSA-N 1 3 338.540 2.623 10 0 EFAEHO CCC[N@@H+](C)C[C@H]1CCN(C(=O)NCCN2[C@H](C)CCC[C@@H]2C)C1 ZINC000465894322 477994438 /nfs/dbraw/zinc/99/44/38/477994438.db2.gz AESVLSKESRAEMH-FGTMMUONSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NCCOC[C@@H]2CCCO2)CC1 ZINC000560112395 478022338 /nfs/dbraw/zinc/02/23/38/478022338.db2.gz DOGLEMZXYBJOJX-NQIIRXRSSA-N 1 3 346.515 2.867 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NCCOC[C@H]2CCCO2)CC1 ZINC000560112397 478022371 /nfs/dbraw/zinc/02/23/71/478022371.db2.gz DOGLEMZXYBJOJX-WIYYLYMNSA-N 1 3 346.515 2.867 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C)[C@H]2CC[C@H](O)CC2)CC1 ZINC000439775818 478028003 /nfs/dbraw/zinc/02/80/03/478028003.db2.gz RSUQXXTXEPGDDH-MXVIHJGJSA-N 1 3 345.531 2.954 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C)[C@H]2CC[C@H](O)CC2)CC1 ZINC000439775818 478028014 /nfs/dbraw/zinc/02/80/14/478028014.db2.gz RSUQXXTXEPGDDH-MXVIHJGJSA-N 1 3 345.531 2.954 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC3(C4(C)CC4)CC3)CC2)CC1 ZINC000516979790 478028470 /nfs/dbraw/zinc/02/84/70/478028470.db2.gz PVSOSKMKTOGREI-UHFFFAOYSA-N 1 3 333.520 2.632 10 0 EFAEHO CC[NH+]1CCC(N2CCCN(Cc3cc(OC)ccc3F)CC2)CC1 ZINC000421365651 478057798 /nfs/dbraw/zinc/05/77/98/478057798.db2.gz BMDNTIXACXEEPN-UHFFFAOYSA-N 1 3 349.494 2.826 10 0 EFAEHO CC1(C)NC(=O)CC[C@@H]1[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000495031039 478107635 /nfs/dbraw/zinc/10/76/35/478107635.db2.gz REIMIOGDJIBVNM-OALUTQOASA-N 1 3 343.515 2.936 10 0 EFAEHO CC1(C)NC(=O)CC[C@H]1[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000495031041 478107868 /nfs/dbraw/zinc/10/78/68/478107868.db2.gz REIMIOGDJIBVNM-RTBURBONSA-N 1 3 343.515 2.936 10 0 EFAEHO C(CCN1CCO[C@@H](C2CCC2)C1)CN1CCO[C@H](C2CCC2)C1 ZINC000560725574 478126951 /nfs/dbraw/zinc/12/69/51/478126951.db2.gz PIISPXBEDGCTQL-BGYRXZFFSA-N 1 3 336.520 2.768 10 0 EFAEHO C[C@H](CC[NH+](C)C)NC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000489081291 478216857 /nfs/dbraw/zinc/21/68/57/478216857.db2.gz VMGRRWSCBWZSAM-YLJYHZDGSA-N 1 3 346.519 2.681 10 0 EFAEHO Cc1cnc(CCN2CCC(OCC[NH+]3CCCC3)CC2)c(C)c1 ZINC000570511729 478376086 /nfs/dbraw/zinc/37/60/86/478376086.db2.gz ZMMAZRHRICLXHL-UHFFFAOYSA-N 1 3 331.504 2.818 10 0 EFAEHO C[C@@H]1CN(Cc2ccnc3ccccc23)CC[C@@H]1[NH+]1CCN(C)CC1 ZINC000539823372 478443246 /nfs/dbraw/zinc/44/32/46/478443246.db2.gz FCFJLFDGGAJTNJ-UTKZUKDTSA-N 1 3 338.499 2.693 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(CN2CCN(C)CC2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000527641222 478458589 /nfs/dbraw/zinc/45/85/89/478458589.db2.gz MIYDLJBIQWUDHQ-CZAAIQMYSA-N 1 3 327.516 2.958 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)CCN(C)c2ccncc2)c1 ZINC000540926421 478512007 /nfs/dbraw/zinc/51/20/07/478512007.db2.gz BPVBGTXDAGFQTH-UHFFFAOYSA-N 1 3 340.471 2.676 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)CCN(C)c2ccncc2)c1 ZINC000540926421 478512015 /nfs/dbraw/zinc/51/20/15/478512015.db2.gz BPVBGTXDAGFQTH-UHFFFAOYSA-N 1 3 340.471 2.676 10 0 EFAEHO CN1CCC(C[NH2+][C@@H]2CCCC(C)(C)CC2)(N2CCOCC2)CC1 ZINC000563441355 478561409 /nfs/dbraw/zinc/56/14/09/478561409.db2.gz RALYSHMZBSWDBX-GOSISDBHSA-N 1 3 337.552 2.732 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)Nc1cccc2c1CCNC2 ZINC000563498901 478570861 /nfs/dbraw/zinc/57/08/61/478570861.db2.gz CYHATCMVOHEZOR-GASCZTMLSA-N 1 3 330.476 2.717 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)Nc1cccc2c1CCNC2 ZINC000563498901 478570867 /nfs/dbraw/zinc/57/08/67/478570867.db2.gz CYHATCMVOHEZOR-GASCZTMLSA-N 1 3 330.476 2.717 10 0 EFAEHO COc1ccc(CN2CC[C@H]2CNC2CC[NH+](CC3CC3)CC2)cc1 ZINC000527971104 478594561 /nfs/dbraw/zinc/59/45/61/478594561.db2.gz RXWVZZPNFGKUTO-FQEVSTJZSA-N 1 3 343.515 2.734 10 0 EFAEHO COc1ccc(CN2CC[C@H]2C[NH2+]C2CCN(CC3CC3)CC2)cc1 ZINC000527971104 478594568 /nfs/dbraw/zinc/59/45/68/478594568.db2.gz RXWVZZPNFGKUTO-FQEVSTJZSA-N 1 3 343.515 2.734 10 0 EFAEHO CCN(C(=O)NCC1([NH3+])CCC1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000563601446 478597956 /nfs/dbraw/zinc/59/79/56/478597956.db2.gz HOPHHWVHNBXLNS-WMZOPIPTSA-N 1 3 344.503 2.735 10 0 EFAEHO CCCN1CC[C@H](C[NH2+]C[C@@H](O)COc2ccccc2C(C)C)C1 ZINC000563618607 478603914 /nfs/dbraw/zinc/60/39/14/478603914.db2.gz YLOXWIGCGQBOGL-QZTJIDSGSA-N 1 3 334.504 2.871 10 0 EFAEHO NC[C@@H]1CCC[C@H]1[NH2+][C@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 ZINC000582481533 478607307 /nfs/dbraw/zinc/60/73/07/478607307.db2.gz QYMYAMKJMFSHDU-RVSPLBMKSA-N 1 3 346.425 2.860 10 0 EFAEHO C[C@H](NC(=O)CCN(C)c1ccncc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541893820 478607999 /nfs/dbraw/zinc/60/79/99/478607999.db2.gz KPRBQDBZYPLTKW-IRXDYDNUSA-N 1 3 344.503 2.677 10 0 EFAEHO C[C@H](NC(=O)CCN(C)c1ccncc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000541893820 478608004 /nfs/dbraw/zinc/60/80/04/478608004.db2.gz KPRBQDBZYPLTKW-IRXDYDNUSA-N 1 3 344.503 2.677 10 0 EFAEHO COC(=O)[C@@H]1C[C@@H]1[C@H](C)[NH2+]C[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000601137650 478681905 /nfs/dbraw/zinc/68/19/05/478681905.db2.gz FSCPQNIESKSGIK-WAARBJQMSA-N 1 3 330.472 2.542 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)[C@@H]3C[C@H]3c3ccsc3)CC2)CC1 ZINC000528313254 478719467 /nfs/dbraw/zinc/71/94/67/478719467.db2.gz BVKMYDHGLRUJIW-ZWKOTPCHSA-N 1 3 347.528 2.526 10 0 EFAEHO O=C(CC[NH2+]C1CC(N2CCCCC2)C1)Nc1cc(F)cc(F)c1 ZINC000582960167 478729073 /nfs/dbraw/zinc/72/90/73/478729073.db2.gz DHGKCSKZWWAUTH-UHFFFAOYSA-N 1 3 337.414 2.900 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)C1 ZINC000582974005 478734579 /nfs/dbraw/zinc/73/45/79/478734579.db2.gz PQOKVVGKMUYKLQ-RVKKMQEKSA-N 1 3 335.517 2.589 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)C1 ZINC000582974005 478734587 /nfs/dbraw/zinc/73/45/87/478734587.db2.gz PQOKVVGKMUYKLQ-RVKKMQEKSA-N 1 3 335.517 2.589 10 0 EFAEHO O[C@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)COCC1CC1 ZINC000499144828 478774452 /nfs/dbraw/zinc/77/44/52/478774452.db2.gz DWJRLELQCASLEY-MXEMCNAFSA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)COCC1CC1 ZINC000499144828 478774459 /nfs/dbraw/zinc/77/44/59/478774459.db2.gz DWJRLELQCASLEY-MXEMCNAFSA-N 1 3 344.499 2.559 10 0 EFAEHO CC(C)C[C@H](CNC(=O)C(N)C(F)(F)F)[NH2+][C@@H](C)c1ccccc1 ZINC000564655200 478778103 /nfs/dbraw/zinc/77/81/03/478778103.db2.gz OAWCNQSJKINIQO-NWANDNLSSA-N 1 3 345.409 2.758 10 0 EFAEHO CCC[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(=O)NC[C@@H]1CCCN1C ZINC000528560718 478833971 /nfs/dbraw/zinc/83/39/71/478833971.db2.gz ACJDDJBUOQVRIS-HSALFYBXSA-N 1 3 343.515 2.745 10 0 EFAEHO CCC[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)NC[C@@H]1CCCN1C ZINC000528560718 478833978 /nfs/dbraw/zinc/83/39/78/478833978.db2.gz ACJDDJBUOQVRIS-HSALFYBXSA-N 1 3 343.515 2.745 10 0 EFAEHO CCN(C)C[C@@H](O)C[NH+]1CCC(c2nc3cccc(C)c3o2)CC1 ZINC000572494307 478851801 /nfs/dbraw/zinc/85/18/01/478851801.db2.gz QUGRIZFTXOQFMT-MRXNPFEDSA-N 1 3 331.460 2.628 10 0 EFAEHO NC(=O)c1ccc(CN(Cc2ccc3c(c2)C[NH2+]CC3)C2CC2)cc1 ZINC000565092431 478910366 /nfs/dbraw/zinc/91/03/66/478910366.db2.gz HUMGUPZYDBYXIA-UHFFFAOYSA-N 1 3 335.451 2.596 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H]2CCOC[C@@H]2C)CC1 ZINC000512884629 479006070 /nfs/dbraw/zinc/00/60/70/479006070.db2.gz GJHRPQLBXOZBBM-OALUTQOASA-N 1 3 345.531 2.981 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CC[C@@H](C(=O)N2CCCCC2)C1 ZINC000514666946 479043679 /nfs/dbraw/zinc/04/36/79/479043679.db2.gz CVEMHFSYBNHFGZ-UAGQMJEPSA-N 1 3 344.503 2.681 10 0 EFAEHO C[C@@H]1C[C@@H](CCNC[C@@H](O)C(F)(F)F)C[N@@H+]1Cc1ccccc1 ZINC000514668402 479044110 /nfs/dbraw/zinc/04/41/10/479044110.db2.gz GTFLCZCNTZUFFS-FVQBIDKESA-N 1 3 330.394 2.800 10 0 EFAEHO C[C@@H]1C[C@@H](CCNC[C@@H](O)C(F)(F)F)C[N@H+]1Cc1ccccc1 ZINC000514668402 479044118 /nfs/dbraw/zinc/04/41/18/479044118.db2.gz GTFLCZCNTZUFFS-FVQBIDKESA-N 1 3 330.394 2.800 10 0 EFAEHO C[NH+](C)CCOc1ccc(CNCCC(=O)Nc2ccccc2)cc1 ZINC000584250608 479068393 /nfs/dbraw/zinc/06/83/93/479068393.db2.gz FINYLZHWAMRJTA-UHFFFAOYSA-N 1 3 341.455 2.745 10 0 EFAEHO OCC1(NCC2CC2)CC[NH+](C[C@H]2CCc3ccccc3C2)CC1 ZINC000573614446 479105236 /nfs/dbraw/zinc/10/52/36/479105236.db2.gz IQWWESOHVBOKGO-SFHVURJKSA-N 1 3 328.500 2.618 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCC2([NH3+])CCCCCC2)[C@@H]1c1ccccc1 ZINC000515047580 479109697 /nfs/dbraw/zinc/10/96/97/479109697.db2.gz IGVRPIIBJQTFIV-MSOLQXFVSA-N 1 3 344.503 2.783 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)Nc2ccc3c(c2F)CCNC3)CC1 ZINC000574140243 479224093 /nfs/dbraw/zinc/22/40/93/479224093.db2.gz SMMWNCIWXCCBEQ-UHFFFAOYSA-N 1 3 348.466 2.715 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]Cc2ccc(CN3CCC(C(N)=O)CC3)cc2)[C@H]1C ZINC000556881904 479232869 /nfs/dbraw/zinc/23/28/69/479232869.db2.gz QZGKMUBJKOLWHS-VCBZYWHSSA-N 1 3 329.488 2.518 10 0 EFAEHO CC1(C)CCCN(CCNC(=O)Nc2ccc3c(c2F)CC[NH2+]C3)C1 ZINC000557050349 479251284 /nfs/dbraw/zinc/25/12/84/479251284.db2.gz WNXIDTMKBMIUBC-UHFFFAOYSA-N 1 3 348.466 2.715 10 0 EFAEHO CC1CC[NH+](CCCCNC(=O)CCN(C)c2ccncc2)CC1 ZINC000574475109 479294257 /nfs/dbraw/zinc/29/42/57/479294257.db2.gz WKUUJIYLUVFFLT-UHFFFAOYSA-N 1 3 332.492 2.536 10 0 EFAEHO NC[C@@H]1CCC[C@H]1[NH2+]CCc1ccc(I)cc1 ZINC000596652796 479373533 /nfs/dbraw/zinc/37/35/33/479373533.db2.gz HZSKNVMQORQCEB-GXTWGEPZSA-N 1 3 344.240 2.551 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1cc(Cl)ccc1Br ZINC000575046884 479394749 /nfs/dbraw/zinc/39/47/49/479394749.db2.gz RCUOTHFOMYLYGK-GFCCVEGCSA-N 1 3 335.673 2.946 10 0 EFAEHO CSCC[C@H](N)C(=O)N[C@H]1CCCCC[N@H+](Cc2ccccc2)C1 ZINC000602594652 479415119 /nfs/dbraw/zinc/41/51/19/479415119.db2.gz ZETXUODRJPSLLT-ROUUACIJSA-N 1 3 349.544 2.628 10 0 EFAEHO CSCC[C@H](N)C(=O)N[C@H]1CCCCC[N@@H+](Cc2ccccc2)C1 ZINC000602594652 479415123 /nfs/dbraw/zinc/41/51/23/479415123.db2.gz ZETXUODRJPSLLT-ROUUACIJSA-N 1 3 349.544 2.628 10 0 EFAEHO CSCC[C@H](N)C(=O)N[C@@H]1CCCCC[N@H+](Cc2ccccc2)C1 ZINC000602594650 479415496 /nfs/dbraw/zinc/41/54/96/479415496.db2.gz ZETXUODRJPSLLT-MSOLQXFVSA-N 1 3 349.544 2.628 10 0 EFAEHO CSCC[C@H](N)C(=O)N[C@@H]1CCCCC[N@@H+](Cc2ccccc2)C1 ZINC000602594650 479415502 /nfs/dbraw/zinc/41/55/02/479415502.db2.gz ZETXUODRJPSLLT-MSOLQXFVSA-N 1 3 349.544 2.628 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NCCCC(C)(F)F)CC2)CC1 ZINC000575328089 479431360 /nfs/dbraw/zinc/43/13/60/479431360.db2.gz KFBRCOFDXPOQLO-UHFFFAOYSA-N 1 3 345.478 2.734 10 0 EFAEHO CCC[N@H+](CC)C[C@@H](C)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000575633545 479460461 /nfs/dbraw/zinc/46/04/61/479460461.db2.gz SDDRJBYOPMVAQD-BHIYHBOVSA-N 1 3 346.519 2.851 10 0 EFAEHO CCC[N@@H+](CC)C[C@@H](C)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000575633545 479460465 /nfs/dbraw/zinc/46/04/65/479460465.db2.gz SDDRJBYOPMVAQD-BHIYHBOVSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)NC[C@@H]2CCCCN2C2CC2)cc1 ZINC000575853607 479487807 /nfs/dbraw/zinc/48/78/07/479487807.db2.gz FQKZIYFEPBAZHQ-KDOFPFPSSA-N 1 3 330.476 2.522 10 0 EFAEHO COC(=O)[C@H]1C[C@H](NC2CC[NH+]([C@H](C)Cc3ccccc3)CC2)C1 ZINC000597247081 479642271 /nfs/dbraw/zinc/64/22/71/479642271.db2.gz YDHPSNFIMSSTHJ-SZVBFZGTSA-N 1 3 330.472 2.623 10 0 EFAEHO Cc1ccccc1C[C@H](C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000628051366 479747539 /nfs/dbraw/zinc/74/75/39/479747539.db2.gz CQJLRYVLBHLLMB-ROUUACIJSA-N 1 3 333.520 2.562 10 0 EFAEHO Cc1ccccc1C[C@H](C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000628051366 479747543 /nfs/dbraw/zinc/74/75/43/479747543.db2.gz CQJLRYVLBHLLMB-ROUUACIJSA-N 1 3 333.520 2.562 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cccc(C(F)F)c1F ZINC000628050798 479747925 /nfs/dbraw/zinc/74/79/25/479747925.db2.gz MYDJVJYEMOGAPQ-LBPRGKRZSA-N 1 3 345.409 2.765 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cccc(C(F)F)c1F ZINC000628050798 479747929 /nfs/dbraw/zinc/74/79/29/479747929.db2.gz MYDJVJYEMOGAPQ-LBPRGKRZSA-N 1 3 345.409 2.765 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@H](C)[C@@H](CO)C2)CC1 ZINC000621738054 479776528 /nfs/dbraw/zinc/77/65/28/479776528.db2.gz YGLMSYPJJGJWQD-AZUAARDMSA-N 1 3 345.531 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@H](C)[C@@H](CO)C2)CC1 ZINC000621738054 479776534 /nfs/dbraw/zinc/77/65/34/479776534.db2.gz YGLMSYPJJGJWQD-AZUAARDMSA-N 1 3 345.531 2.669 10 0 EFAEHO CC[C@@H]1CCCC[C@H]1C[NH2+]CC1(N2CCOCC2)CCN(C)CC1 ZINC000628309952 479851372 /nfs/dbraw/zinc/85/13/72/479851372.db2.gz DKMRVJVZYFDFFI-MOPGFXCFSA-N 1 3 337.552 2.589 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)CC[N@@H+]1C ZINC000631655138 480201019 /nfs/dbraw/zinc/20/10/19/480201019.db2.gz ANSGCNLJJJVJEF-FRYIKTPZSA-N 1 3 343.515 2.886 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)CC[N@H+]1C ZINC000631655138 480201024 /nfs/dbraw/zinc/20/10/24/480201024.db2.gz ANSGCNLJJJVJEF-FRYIKTPZSA-N 1 3 343.515 2.886 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@H](c2ccc(F)cc2)N2CCOCC2)CC1(C)C ZINC000623337958 480238618 /nfs/dbraw/zinc/23/86/18/480238618.db2.gz DGVRCFPGTKCNTP-RBUKOAKNSA-N 1 3 349.494 2.661 10 0 EFAEHO COc1ccc([C@@H](CN[C@H]2CC[N@H+](C)C(C)(C)C2)N(C)C)cc1OC ZINC000623338383 480238710 /nfs/dbraw/zinc/23/87/10/480238710.db2.gz XYLBZHKNSPUAOQ-DLBZAZTESA-N 1 3 349.519 2.769 10 0 EFAEHO COc1ccc([C@@H](CN[C@H]2CC[N@@H+](C)C(C)(C)C2)N(C)C)cc1OC ZINC000623338383 480238714 /nfs/dbraw/zinc/23/87/14/480238714.db2.gz XYLBZHKNSPUAOQ-DLBZAZTESA-N 1 3 349.519 2.769 10 0 EFAEHO COc1ccc([C@@H](C[NH2+][C@H]2CCN(C)C(C)(C)C2)N(C)C)cc1OC ZINC000623338383 480238723 /nfs/dbraw/zinc/23/87/23/480238723.db2.gz XYLBZHKNSPUAOQ-DLBZAZTESA-N 1 3 349.519 2.769 10 0 EFAEHO C[N@@H+]1CC[C@H](NCc2ccnc(N3CCSCC3)c2)[C@@H]2CCC[C@H]21 ZINC000631723015 480239029 /nfs/dbraw/zinc/23/90/29/480239029.db2.gz DOEUIWCOYXNBQT-OKZBNKHCSA-N 1 3 346.544 2.597 10 0 EFAEHO C[N@H+]1CC[C@H](NCc2ccnc(N3CCSCC3)c2)[C@@H]2CCC[C@H]21 ZINC000631723015 480239033 /nfs/dbraw/zinc/23/90/33/480239033.db2.gz DOEUIWCOYXNBQT-OKZBNKHCSA-N 1 3 346.544 2.597 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccnc(N3CCSCC3)c2)[C@@H]2CCC[C@H]21 ZINC000631723015 480239047 /nfs/dbraw/zinc/23/90/47/480239047.db2.gz DOEUIWCOYXNBQT-OKZBNKHCSA-N 1 3 346.544 2.597 10 0 EFAEHO C[N@@H+]1CC[C@H](NCc2ccnc(N3CCSCC3)c2)[C@H]2CCC[C@@H]21 ZINC000631723016 480239603 /nfs/dbraw/zinc/23/96/03/480239603.db2.gz DOEUIWCOYXNBQT-SQNIBIBYSA-N 1 3 346.544 2.597 10 0 EFAEHO C[N@H+]1CC[C@H](NCc2ccnc(N3CCSCC3)c2)[C@H]2CCC[C@@H]21 ZINC000631723016 480239606 /nfs/dbraw/zinc/23/96/06/480239606.db2.gz DOEUIWCOYXNBQT-SQNIBIBYSA-N 1 3 346.544 2.597 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccnc(N3CCSCC3)c2)[C@H]2CCC[C@@H]21 ZINC000631723016 480239611 /nfs/dbraw/zinc/23/96/11/480239611.db2.gz DOEUIWCOYXNBQT-SQNIBIBYSA-N 1 3 346.544 2.597 10 0 EFAEHO NC1(C[NH2+]Cc2ccc(-n3cnc4ccccc43)cc2)CCOCC1 ZINC000629388601 480244112 /nfs/dbraw/zinc/24/41/12/480244112.db2.gz ULYLSVFINBENTG-UHFFFAOYSA-N 1 3 336.439 2.623 10 0 EFAEHO CN1CC[C@@H]([NH2+]Cc2ccccc2CN2CCCC2=O)CC1(C)C ZINC000623355101 480246270 /nfs/dbraw/zinc/24/62/70/480246270.db2.gz ZENNPOVCSBHDHX-GOSISDBHSA-N 1 3 329.488 2.771 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc2ccccc2c1 ZINC000617503480 480247240 /nfs/dbraw/zinc/24/72/40/480247240.db2.gz LEKBIARPGMKHGO-INIZCTEOSA-N 1 3 327.472 2.842 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc2ccccc2c1 ZINC000617503480 480247247 /nfs/dbraw/zinc/24/72/47/480247247.db2.gz LEKBIARPGMKHGO-INIZCTEOSA-N 1 3 327.472 2.842 10 0 EFAEHO Cc1ccccc1C1(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)CCC1 ZINC000617507218 480249463 /nfs/dbraw/zinc/24/94/63/480249463.db2.gz MROXAWOPJVAEAM-SFHVURJKSA-N 1 3 345.531 2.805 10 0 EFAEHO Cc1ccccc1C1(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)CCC1 ZINC000617507218 480249469 /nfs/dbraw/zinc/24/94/69/480249469.db2.gz MROXAWOPJVAEAM-SFHVURJKSA-N 1 3 345.531 2.805 10 0 EFAEHO Cc1ccc2nc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)ccc2c1 ZINC000617507613 480250387 /nfs/dbraw/zinc/25/03/87/480250387.db2.gz CFAOMOJSQXCBIY-INIZCTEOSA-N 1 3 342.487 2.545 10 0 EFAEHO Cc1ccc2nc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)ccc2c1 ZINC000617507613 480250393 /nfs/dbraw/zinc/25/03/93/480250393.db2.gz CFAOMOJSQXCBIY-INIZCTEOSA-N 1 3 342.487 2.545 10 0 EFAEHO Cc1cc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c(Cl)cc1F ZINC000617506257 480251154 /nfs/dbraw/zinc/25/11/54/480251154.db2.gz HKRSOQROZHJMCM-ZDUSSCGKSA-N 1 3 343.874 2.789 10 0 EFAEHO Cc1cc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c(Cl)cc1F ZINC000617506257 480251162 /nfs/dbraw/zinc/25/11/62/480251162.db2.gz HKRSOQROZHJMCM-ZDUSSCGKSA-N 1 3 343.874 2.789 10 0 EFAEHO Cc1ccc(Cl)cc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617506429 480251190 /nfs/dbraw/zinc/25/11/90/480251190.db2.gz NAIYQFJLHKFOAG-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO Cc1ccc(Cl)cc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617506429 480251195 /nfs/dbraw/zinc/25/11/95/480251195.db2.gz NAIYQFJLHKFOAG-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO CCc1c2ccccc2oc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617507732 480251433 /nfs/dbraw/zinc/25/14/33/480251433.db2.gz HKEMGUASXUJCTI-HNNXBMFYSA-N 1 3 345.487 2.997 10 0 EFAEHO CCc1c2ccccc2oc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617507732 480251438 /nfs/dbraw/zinc/25/14/38/480251438.db2.gz HKEMGUASXUJCTI-HNNXBMFYSA-N 1 3 345.487 2.997 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccccc1C(C)(C)C ZINC000617506299 480251782 /nfs/dbraw/zinc/25/17/82/480251782.db2.gz JIIBBOGYNNHXHI-INIZCTEOSA-N 1 3 333.520 2.986 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccccc1C(C)(C)C ZINC000617506299 480251786 /nfs/dbraw/zinc/25/17/86/480251786.db2.gz JIIBBOGYNNHXHI-INIZCTEOSA-N 1 3 333.520 2.986 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCSc2ccccc21 ZINC000617505991 480251948 /nfs/dbraw/zinc/25/19/48/480251948.db2.gz XHBROPPEUFUBPJ-DOTOQJQBSA-N 1 3 349.544 2.654 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCSc2ccccc21 ZINC000617505991 480251954 /nfs/dbraw/zinc/25/19/54/480251954.db2.gz XHBROPPEUFUBPJ-DOTOQJQBSA-N 1 3 349.544 2.654 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccc(Cn3ccccc3=O)cc2)CC1(C)C ZINC000623374671 480255041 /nfs/dbraw/zinc/25/50/41/480255041.db2.gz KUTIXVAHOUDQLK-IBGZPJMESA-N 1 3 339.483 2.859 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cccc(NC(=O)[C@H]3CCCO3)c2)CC1(C)C ZINC000623376020 480255099 /nfs/dbraw/zinc/25/50/99/480255099.db2.gz CBHACJWONVHIKF-ZWKOTPCHSA-N 1 3 345.487 2.767 10 0 EFAEHO CN1CC[C@@H]([NH2+]Cc2cccc(NC(=O)[C@H]3CCCO3)c2)CC1(C)C ZINC000623376018 480255718 /nfs/dbraw/zinc/25/57/18/480255718.db2.gz CBHACJWONVHIKF-QZTJIDSGSA-N 1 3 345.487 2.767 10 0 EFAEHO CN1CC[C@@H]([NH2+]C[C@H](c2cccc(F)c2)N2CCOCC2)CC1(C)C ZINC000623379299 480256713 /nfs/dbraw/zinc/25/67/13/480256713.db2.gz IIIIHVGVPLLMNR-RTBURBONSA-N 1 3 349.494 2.661 10 0 EFAEHO CCN(C(=O)c1ccc(C[NH+]2CCCCC2)cc1)[C@H]1CCN(C)C1 ZINC000617551673 480273241 /nfs/dbraw/zinc/27/32/41/480273241.db2.gz WWFLJLKFLUQJAL-IBGZPJMESA-N 1 3 329.488 2.839 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+][C@H]2CCN(C)C(C)(C)C2)[C@H](C)C1 ZINC000623420601 480276228 /nfs/dbraw/zinc/27/62/28/480276228.db2.gz IIYOWLCKNDWCSQ-SQNIBIBYSA-N 1 3 325.541 2.586 10 0 EFAEHO C[C@@H](NC(=O)[C@H](C)N1CCC([C@@H]2CCC[NH2+]C2)CC1)c1ccccc1 ZINC000631829458 480288163 /nfs/dbraw/zinc/28/81/63/480288163.db2.gz RBRRMPFFNCAIPO-FUHIMQAGSA-N 1 3 343.515 2.964 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1)c1ccccc1 ZINC000631826878 480288498 /nfs/dbraw/zinc/28/84/98/480288498.db2.gz YYSCYCWSYXDUHF-IZBJGVDFSA-N 1 3 343.515 2.964 10 0 EFAEHO COc1ccc(CNCC2(O)CC[NH+](C(C)C)CC2)cc1OC1CC1 ZINC000623448223 480288587 /nfs/dbraw/zinc/28/85/87/480288587.db2.gz QSJHWUPPCPBGAZ-UHFFFAOYSA-N 1 3 348.487 2.561 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCC([C@@H]2CCC[NH2+]C2)CC1)c1ccccc1 ZINC000631829460 480288686 /nfs/dbraw/zinc/28/86/86/480288686.db2.gz RBRRMPFFNCAIPO-MBOZVWFJSA-N 1 3 343.515 2.964 10 0 EFAEHO C[C@H](N)[C@@H](Cc1ccccc1)[NH2+]C[C@H](n1cccn1)C(F)(F)F ZINC000629514085 480290825 /nfs/dbraw/zinc/29/08/25/480290825.db2.gz JAWHWEQJZWYBMX-CFVMTHIKSA-N 1 3 326.366 2.535 10 0 EFAEHO COc1ccc([C@H](C)[NH2+]CC2(N)CCOCC2)cc1Br ZINC000629521851 480293079 /nfs/dbraw/zinc/29/30/79/480293079.db2.gz SLQKYGWULOLUJX-NSHDSACASA-N 1 3 343.265 2.616 10 0 EFAEHO NC1(C[NH2+][C@H]2CCCc3cc(Br)ccc32)CCOCC1 ZINC000629522016 480293509 /nfs/dbraw/zinc/29/35/09/480293509.db2.gz VIDCKIKUKSRPQG-HNNXBMFYSA-N 1 3 339.277 2.924 10 0 EFAEHO C[C@@H]1CN(CCC(=O)Nc2cc(Cl)ccc2Cl)C[C@H]1C[NH3+] ZINC000631840997 480293680 /nfs/dbraw/zinc/29/36/80/480293680.db2.gz HCPVEKPTLLKFTH-GHMZBOCLSA-N 1 3 330.259 2.849 10 0 EFAEHO C[NH2+]CCOCCN[C@@H]1CCCc2c(Br)cccc21 ZINC000629530198 480295680 /nfs/dbraw/zinc/29/56/80/480295680.db2.gz YXJRWBCQXREAIA-OAHLLOKOSA-N 1 3 327.266 2.652 10 0 EFAEHO C[NH2+]CCOCCN[C@H]1CCc2c1cc(Br)cc2Cl ZINC000629529780 480296653 /nfs/dbraw/zinc/29/66/53/480296653.db2.gz MTZGHWMGPHPWQL-AWEZNQCLSA-N 1 3 347.684 2.915 10 0 EFAEHO Cc1cc(Br)cc2c1[C@@H](NCCOCCC[NH3+])CC2 ZINC000629541405 480297384 /nfs/dbraw/zinc/29/73/84/480297384.db2.gz ZUOXQQKKRCBMAH-AWEZNQCLSA-N 1 3 327.266 2.700 10 0 EFAEHO [NH3+]CCCOCCN[C@@H](c1ccc(Br)s1)C1CC1 ZINC000629539551 480297412 /nfs/dbraw/zinc/29/74/12/480297412.db2.gz QCEDMYSQHOUSQC-CYBMUJFWSA-N 1 3 333.295 2.917 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000629540535 480297860 /nfs/dbraw/zinc/29/78/60/480297860.db2.gz VGYMMOALIVETGO-CJNGLKHVSA-N 1 3 348.318 2.940 10 0 EFAEHO C[NH+](C)CC1CCC(NCc2cn(-c3ccc(F)cc3)nn2)CC1 ZINC000623470188 480298931 /nfs/dbraw/zinc/29/89/31/480298931.db2.gz CNXYBJOUVRJXJR-UHFFFAOYSA-N 1 3 331.439 2.616 10 0 EFAEHO CN1CC[C@H]([NH2+][C@@H](CO)c2ccc(Br)cc2)CC1(C)C ZINC000623479230 480303677 /nfs/dbraw/zinc/30/36/77/480303677.db2.gz LFXLEWCUFZNRDJ-GJZGRUSLSA-N 1 3 341.293 2.945 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)NC[C@H]1CCN1C1CCCC1 ZINC000623584511 480350930 /nfs/dbraw/zinc/35/09/30/480350930.db2.gz IMIBVWAQLYJZAQ-JFIYKMOQSA-N 1 3 336.524 2.565 10 0 EFAEHO [NH3+]CCCOCCNCc1cc2ccccc2nc1N1CCCCC1 ZINC000629677888 480354945 /nfs/dbraw/zinc/35/49/45/480354945.db2.gz INIMWKJMQQLZJM-UHFFFAOYSA-N 1 3 342.487 2.680 10 0 EFAEHO CC[C@@H]1CCCC[N@@H+]1CCNC(=O)NC[C@H]1CCN1C1CCCC1 ZINC000623610549 480361176 /nfs/dbraw/zinc/36/11/76/480361176.db2.gz XQARPKNBTGZQQX-SJLPKXTDSA-N 1 3 336.524 2.567 10 0 EFAEHO CC[C@@H]1CCCC[N@H+]1CCNC(=O)NC[C@H]1CCN1C1CCCC1 ZINC000623610549 480361177 /nfs/dbraw/zinc/36/11/77/480361177.db2.gz XQARPKNBTGZQQX-SJLPKXTDSA-N 1 3 336.524 2.567 10 0 EFAEHO CC[NH+](CC)CCOc1ccccc1NC(=O)N[C@@H]1CCCN(C)C1 ZINC000617921767 480418601 /nfs/dbraw/zinc/41/86/01/480418601.db2.gz JFTUTCUOMQLCRZ-MRXNPFEDSA-N 1 3 348.491 2.623 10 0 EFAEHO CCN(C(=O)c1ccc(C[NH+]2CCCC2)cc1)[C@H]1CCN(CC)C1 ZINC000617925021 480420836 /nfs/dbraw/zinc/42/08/36/480420836.db2.gz CPEGPVPOAUQVNP-IBGZPJMESA-N 1 3 329.488 2.839 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2CO[C@H](C3CC3)C2)CC1 ZINC000623752420 480437892 /nfs/dbraw/zinc/43/78/92/480437892.db2.gz GDEUMVIXXQOUHD-FPOVZHCZSA-N 1 3 343.515 2.876 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@@H](O)C[C@](C)(O)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000634708803 480450004 /nfs/dbraw/zinc/45/00/04/480450004.db2.gz ZHZRMQGYZFAHNH-DBOLQNLKSA-N 1 3 346.515 2.541 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@@H](O)C[C@](C)(O)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000634708803 480450014 /nfs/dbraw/zinc/45/00/14/480450014.db2.gz ZHZRMQGYZFAHNH-DBOLQNLKSA-N 1 3 346.515 2.541 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@@H](O)C[C@@](C)(O)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000634708806 480450205 /nfs/dbraw/zinc/45/02/05/480450205.db2.gz ZHZRMQGYZFAHNH-RZXSNQJFSA-N 1 3 346.515 2.541 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@@H](O)C[C@@](C)(O)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000634708806 480450211 /nfs/dbraw/zinc/45/02/11/480450211.db2.gz ZHZRMQGYZFAHNH-RZXSNQJFSA-N 1 3 346.515 2.541 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H]2C[C@@H](OC)C2)CC1 ZINC000623822959 480470976 /nfs/dbraw/zinc/47/09/76/480470976.db2.gz HASPNJOCDWFJSD-IZAXUBKRSA-N 1 3 331.504 2.733 10 0 EFAEHO CN(CCN1CC[NH+](CC2CCSCC2)CC1)Cc1ccccc1 ZINC000638031730 480477321 /nfs/dbraw/zinc/47/73/21/480477321.db2.gz ADYLMNRSLHWIMU-UHFFFAOYSA-N 1 3 347.572 2.879 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccccc1CN1CCC(O)CC1)[C@@H]1CCCCO1 ZINC000623903102 480513543 /nfs/dbraw/zinc/51/35/43/480513543.db2.gz YTDMQLDMXMXEKN-UZLBHIALSA-N 1 3 332.488 2.691 10 0 EFAEHO CC[C@@H]1[NH2+]CC[C@H]1NC(=O)NCc1ccccc1CN1CCCCC1 ZINC000626927683 480585147 /nfs/dbraw/zinc/58/51/47/480585147.db2.gz XVQPLHPDAMWNEV-RBUKOAKNSA-N 1 3 344.503 2.612 10 0 EFAEHO C[C@H]1CC[C@@H](NC(=O)NCc2ccccc2CN2CCCCC2)C[NH2+]1 ZINC000626926788 480585170 /nfs/dbraw/zinc/58/51/70/480585170.db2.gz DRZDWYCNBGBTFM-QFBILLFUSA-N 1 3 344.503 2.612 10 0 EFAEHO C[C@H](NC(C)(C)CNC(=O)N[C@H]1CC[NH2+]C12CCC2)c1ccccc1 ZINC000626978945 480609128 /nfs/dbraw/zinc/60/91/28/480609128.db2.gz ZQSUHPATMQCFKS-RDJZCZTQSA-N 1 3 344.503 2.700 10 0 EFAEHO Clc1ccc(N2CCO[C@@H](CNC3CC[NH+](C4CC4)CC3)C2)cc1 ZINC000624120042 480618335 /nfs/dbraw/zinc/61/83/35/480618335.db2.gz QGZUQSSWFQFXSK-IBGZPJMESA-N 1 3 349.906 2.762 10 0 EFAEHO COc1ncc(Br)cc1CN[C@@H](C)C1CC[NH+](C)CC1 ZINC000624133592 480624562 /nfs/dbraw/zinc/62/45/62/480624562.db2.gz QZBSETDSGJMURW-NSHDSACASA-N 1 3 342.281 2.673 10 0 EFAEHO Brc1ccc2c(c1)C[C@@H]1[C@H]2[C@H]1NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000635006489 480683578 /nfs/dbraw/zinc/68/35/78/480683578.db2.gz ROYMGSGOTNGAFB-ZTTIOWEYSA-N 1 3 333.273 2.960 10 0 EFAEHO C[C@H]([NH2+][C@@H]1CCN(C2CCC2)C1=O)[C@H]1CCN(Cc2ccccc2)C1 ZINC000624343947 480718762 /nfs/dbraw/zinc/71/87/62/480718762.db2.gz DAWIWQQOVMMZAM-XKGZKEIXSA-N 1 3 341.499 2.640 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NCc2cccc(CN(C)C)c2)CC1 ZINC000632866364 480764124 /nfs/dbraw/zinc/76/41/24/480764124.db2.gz SULFDAVJYWXHSJ-UHFFFAOYSA-N 1 3 346.519 2.764 10 0 EFAEHO CN(C)CCOc1cccc(NC(=O)N[C@@H]2CC[NH2+]CC(C)(C)C2)c1 ZINC000632897211 480783243 /nfs/dbraw/zinc/78/32/43/480783243.db2.gz HGRYLYKZKAJCPU-MRXNPFEDSA-N 1 3 348.491 2.527 10 0 EFAEHO Cc1ccc(NC(=O)N2CCCCC[C@H]([NH3+])C2)c(OCCN(C)C)c1 ZINC000632935763 480807512 /nfs/dbraw/zinc/80/75/12/480807512.db2.gz RSHZMMBTFXDSGB-INIZCTEOSA-N 1 3 348.491 2.671 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NCCN2[C@H](C)CCC[C@H]2C)CC1 ZINC000632990423 480836627 /nfs/dbraw/zinc/83/66/27/480836627.db2.gz RTEACXJGEURINF-IAGOWNOFSA-N 1 3 338.540 2.765 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](c2ccsc2)N(CC)CC)CC[N@@H+]1C ZINC000630733719 480864627 /nfs/dbraw/zinc/86/46/27/480864627.db2.gz DPCQDYZKTGRLIC-GVDBMIGSSA-N 1 3 337.533 2.978 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](c2ccsc2)N(CC)CC)CC[N@H+]1C ZINC000630733719 480864634 /nfs/dbraw/zinc/86/46/34/480864634.db2.gz DPCQDYZKTGRLIC-GVDBMIGSSA-N 1 3 337.533 2.978 10 0 EFAEHO N[C@@H](CC(F)F)C(=O)N[C@H]1CCCCC[N@H+](Cc2ccccc2)C1 ZINC000638851691 480897164 /nfs/dbraw/zinc/89/71/64/480897164.db2.gz PMWXTFPBNCCXMG-HOTGVXAUSA-N 1 3 339.430 2.530 10 0 EFAEHO N[C@@H](CC(F)F)C(=O)N[C@H]1CCCCC[N@@H+](Cc2ccccc2)C1 ZINC000638851691 480897165 /nfs/dbraw/zinc/89/71/65/480897165.db2.gz PMWXTFPBNCCXMG-HOTGVXAUSA-N 1 3 339.430 2.530 10 0 EFAEHO CCC(C)(C)N1CCN(C(=O)NC[C@@H]2CC[N@@H+]2C2CCCC2)CC1 ZINC000624783878 480898629 /nfs/dbraw/zinc/89/86/29/480898629.db2.gz ARCLKVYZNMCLPL-KRWDZBQOSA-N 1 3 336.524 2.519 10 0 EFAEHO CCC(C)(C)N1CCN(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)CC1 ZINC000624783878 480898630 /nfs/dbraw/zinc/89/86/30/480898630.db2.gz ARCLKVYZNMCLPL-KRWDZBQOSA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000661405006 480993065 /nfs/dbraw/zinc/99/30/65/480993065.db2.gz BOBVBLZZRKYRTE-WBVHZDCISA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000661405006 480993072 /nfs/dbraw/zinc/99/30/72/480993072.db2.gz BOBVBLZZRKYRTE-WBVHZDCISA-N 1 3 336.524 2.565 10 0 EFAEHO CC[NH+]1CCC(NC(=O)CN2CC[C@@H]([C@@H]3CCCC3(C)C)C2)CC1 ZINC000646049585 481041996 /nfs/dbraw/zinc/04/19/96/481041996.db2.gz OBQRAVQIWGXBQE-AEFFLSMTSA-N 1 3 335.536 2.735 10 0 EFAEHO C[NH+]1CCC2(CCN(C(=O)c3cccc(CN4CCCC4)c3)C2)CC1 ZINC000647723499 481075361 /nfs/dbraw/zinc/07/53/61/481075361.db2.gz ISYLWKREJMGMSY-UHFFFAOYSA-N 1 3 341.499 2.840 10 0 EFAEHO C[C@H](NC(C)(C)CNC(=O)[C@@H]1CC[C@H](C2CC2)[NH2+]1)c1ccccc1 ZINC000653117177 481090014 /nfs/dbraw/zinc/09/00/14/481090014.db2.gz CDUMKYKZBGUYQD-QGTPRVQTSA-N 1 3 329.488 2.763 10 0 EFAEHO CCN(Cc1ccc(CN(C)C)cc1)C(=O)[C@@H]1CC[C@H](C2CC2)[NH2+]1 ZINC000653148938 481111351 /nfs/dbraw/zinc/11/13/51/481111351.db2.gz QNPNSAHBJHQVET-MOPGFXCFSA-N 1 3 329.488 2.627 10 0 EFAEHO c1c(C[NH2+]CC2CCN(Cc3ccncc3)CC2)onc1C1CC1 ZINC000639312278 481119484 /nfs/dbraw/zinc/11/94/84/481119484.db2.gz VCKVABYKVDVGMY-UHFFFAOYSA-N 1 3 326.444 2.949 10 0 EFAEHO C[C@@H]1C[NH2+]CC[C@@H]1NC(=O)N[C@H](CN1CCCCC1)c1ccccc1 ZINC000669483902 481153206 /nfs/dbraw/zinc/15/32/06/481153206.db2.gz RWTISHJLVRDHAC-NZSAHSFTSA-N 1 3 344.503 2.511 10 0 EFAEHO C[NH2+]Cc1ccccc1CNC(=O)C(C)(C)[C@@H](N)c1ccccc1 ZINC000653215410 481155793 /nfs/dbraw/zinc/15/57/93/481155793.db2.gz TWIXYWJNNBJDPX-SFHVURJKSA-N 1 3 325.456 2.748 10 0 EFAEHO C[NH2+]Cc1ccccc1CNC(=O)C(C)(C)[C@H](N)c1ccccc1 ZINC000653215409 481156706 /nfs/dbraw/zinc/15/67/06/481156706.db2.gz TWIXYWJNNBJDPX-GOSISDBHSA-N 1 3 325.456 2.748 10 0 EFAEHO C[C@@H](NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)[C@H](C)c1ccccc1 ZINC000664298744 481160571 /nfs/dbraw/zinc/16/05/71/481160571.db2.gz KHUYEGCAWSIHRM-OKZBNKHCSA-N 1 3 348.535 2.750 10 0 EFAEHO C[C@@H](NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)[C@H](C)c1ccccc1 ZINC000664298744 481160574 /nfs/dbraw/zinc/16/05/74/481160574.db2.gz KHUYEGCAWSIHRM-OKZBNKHCSA-N 1 3 348.535 2.750 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@H]1CCCC[N@@H+]1C)Cc1ccncc1 ZINC000646241271 481176549 /nfs/dbraw/zinc/17/65/49/481176549.db2.gz XETNBGVCXFOTAJ-LJQANCHMSA-N 1 3 346.519 2.626 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@H]1CCCC[N@H+]1C)Cc1ccncc1 ZINC000646241271 481176553 /nfs/dbraw/zinc/17/65/53/481176553.db2.gz XETNBGVCXFOTAJ-LJQANCHMSA-N 1 3 346.519 2.626 10 0 EFAEHO Clc1ccccc1Cn1cc(CN[C@H]2CC23CC[NH2+]CC3)cn1 ZINC000666950691 481215172 /nfs/dbraw/zinc/21/51/72/481215172.db2.gz BIDUVLUQVNJIKT-KRWDZBQOSA-N 1 3 330.863 2.817 10 0 EFAEHO Cc1nn(-c2ccc(F)cc2F)c(C)c1CN[C@@H]1CC12CC[NH2+]CC2 ZINC000666953597 481216594 /nfs/dbraw/zinc/21/65/94/481216594.db2.gz BRUWEMADCKKMLF-GOSISDBHSA-N 1 3 346.425 2.999 10 0 EFAEHO Cc1cc(Br)cn2c(CN[C@H]3CC34CC[NH2+]CC4)cnc12 ZINC000666953581 481216638 /nfs/dbraw/zinc/21/66/38/481216638.db2.gz BMGJBBHIRLGBLA-AWEZNQCLSA-N 1 3 349.276 2.637 10 0 EFAEHO CN(C)CCOc1ccc(CN2CCCC[C@@H]2[C@H]2CC[NH2+]C2)cc1 ZINC000666968822 481228366 /nfs/dbraw/zinc/22/83/66/481228366.db2.gz KRZMGZBXRNBIBJ-AZUAARDMSA-N 1 3 331.504 2.591 10 0 EFAEHO COc1ccc(Cl)c(N2CCN(C[C@@H]3CC[NH2+][C@H](C)C3)CC2)c1 ZINC000650704232 481271610 /nfs/dbraw/zinc/27/16/10/481271610.db2.gz OPTVDCHBSLLJJE-HUUCEWRRSA-N 1 3 337.895 2.859 10 0 EFAEHO COc1ccc(Cl)c(N2CCN(C[C@H]3CC[NH2+][C@H](C)C3)CC2)c1 ZINC000650704230 481271758 /nfs/dbraw/zinc/27/17/58/481271758.db2.gz OPTVDCHBSLLJJE-CABCVRRESA-N 1 3 337.895 2.859 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC[NH2+]1 ZINC000646408903 481281726 /nfs/dbraw/zinc/28/17/26/481281726.db2.gz RQEKGKFMSLNRPX-WDSOQIARSA-N 1 3 329.488 2.718 10 0 EFAEHO C[NH2+]Cc1ccccc1CNCc1ccc2c(c1)sc(=O)n2C ZINC000650720454 481286545 /nfs/dbraw/zinc/28/65/45/481286545.db2.gz PVLLQMXINXGRPD-UHFFFAOYSA-N 1 3 327.453 2.609 10 0 EFAEHO Cc1c2cccc(C)c2oc1C[N@H+](C)C[C@@H]1CCCN(C(=O)CN)C1 ZINC000650720387 481286829 /nfs/dbraw/zinc/28/68/29/481286829.db2.gz NHSFGFHKDOOQKT-INIZCTEOSA-N 1 3 343.471 2.679 10 0 EFAEHO Cc1c2cccc(C)c2oc1C[N@@H+](C)C[C@@H]1CCCN(C(=O)CN)C1 ZINC000650720387 481286834 /nfs/dbraw/zinc/28/68/34/481286834.db2.gz NHSFGFHKDOOQKT-INIZCTEOSA-N 1 3 343.471 2.679 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](N[C@H]2CNc3ccccc3C2)[C@@H](C)C1 ZINC000650750195 481313185 /nfs/dbraw/zinc/31/31/85/481313185.db2.gz AOMQWWRMJYMTCQ-UHOSZYNNSA-N 1 3 331.504 2.750 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](N[C@H]2CNc3ccccc3C2)[C@@H](C)C1 ZINC000650750195 481313194 /nfs/dbraw/zinc/31/31/94/481313194.db2.gz AOMQWWRMJYMTCQ-UHOSZYNNSA-N 1 3 331.504 2.750 10 0 EFAEHO c1ccc2c(c1)CC[C@H](CCN[C@@H]1CCOC[C@@H]1[C@@H]1CCC[NH2+]1)N2 ZINC000650759022 481321552 /nfs/dbraw/zinc/32/15/52/481321552.db2.gz BJYKTRRLILWGTI-IZBJGVDFSA-N 1 3 329.488 2.550 10 0 EFAEHO CN1CCN(C(=O)C[C@H]2[NH2+]Cc3ccccc32)C2(CCCCC2)C1 ZINC000659285747 481335265 /nfs/dbraw/zinc/33/52/65/481335265.db2.gz SJGZWGAAJWHSES-GOSISDBHSA-N 1 3 327.472 2.698 10 0 EFAEHO C[C@H]([NH3+])c1ccc(NC(=O)C(C[C@@H]2COCCO2)C(F)(F)F)cc1 ZINC000659295293 481343280 /nfs/dbraw/zinc/34/32/80/481343280.db2.gz WGWCDRVGQOJQAK-ZLKJLUDKSA-N 1 3 346.349 2.629 10 0 EFAEHO [NH3+][C@@H](CC1CCCCC1)C(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659366443 481386894 /nfs/dbraw/zinc/38/68/94/481386894.db2.gz KBAYDRAAZXOBNB-ZWKOTPCHSA-N 1 3 331.460 2.584 10 0 EFAEHO Cc1ccccc1[C@H]([C@H](C)NC(=O)NCC[C@@H]([NH3+])C(C)C)N(C)C ZINC000659491907 481468497 /nfs/dbraw/zinc/46/84/97/481468497.db2.gz FTAQCTAEATXIJM-JQHSSLGASA-N 1 3 334.508 2.659 10 0 EFAEHO CC[C@H](C(N)=O)N1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664837708 481508364 /nfs/dbraw/zinc/50/83/64/481508364.db2.gz XLELTIPOAMINMZ-MOPGFXCFSA-N 1 3 343.515 2.873 10 0 EFAEHO CC[C@@H](C(N)=O)N1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664837711 481508490 /nfs/dbraw/zinc/50/84/90/481508490.db2.gz XLELTIPOAMINMZ-OALUTQOASA-N 1 3 343.515 2.873 10 0 EFAEHO O=C(C[N@@H+]1CCC[C@H]1CC1CCCC1)NC1CCN(C2CC2)CC1 ZINC000653893065 481518605 /nfs/dbraw/zinc/51/86/05/481518605.db2.gz SSWMPLNHFPZIOZ-IBGZPJMESA-N 1 3 333.520 2.774 10 0 EFAEHO O=C(C[N@H+]1CCC[C@H]1CC1CCCC1)NC1CCN(C2CC2)CC1 ZINC000653893065 481518611 /nfs/dbraw/zinc/51/86/11/481518611.db2.gz SSWMPLNHFPZIOZ-IBGZPJMESA-N 1 3 333.520 2.774 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000659620319 481519587 /nfs/dbraw/zinc/51/95/87/481519587.db2.gz KOBUGLSDEPCBTL-CVEARBPZSA-N 1 3 340.899 2.615 10 0 EFAEHO C[C@@H](CC[NH+]1CCC(N2CC[C@@H](O)C2)CC1)OCc1ccccc1 ZINC000662151790 481597046 /nfs/dbraw/zinc/59/70/46/481597046.db2.gz LIOLYGWYZVSJGC-FXAWDEMLSA-N 1 3 332.488 2.513 10 0 EFAEHO CC[N@H+](CCCNC(=O)N1CCN2CCC1CC2)C1CCCCC1 ZINC000651219080 481635673 /nfs/dbraw/zinc/63/56/73/481635673.db2.gz JUCGFAIHVJNCNT-UHFFFAOYSA-N 1 3 336.524 2.521 10 0 EFAEHO CC[N@@H+](CCCNC(=O)N1CCN2CCC1CC2)C1CCCCC1 ZINC000651219080 481635679 /nfs/dbraw/zinc/63/56/79/481635679.db2.gz JUCGFAIHVJNCNT-UHFFFAOYSA-N 1 3 336.524 2.521 10 0 EFAEHO CC[C@@H](NCc1ccc(OCC[NH+]2CCCC2)cc1)[C@H](O)C(F)F ZINC000648694043 481672201 /nfs/dbraw/zinc/67/22/01/481672201.db2.gz VGDWYAYZAWOPDA-SJORKVTESA-N 1 3 342.430 2.655 10 0 EFAEHO COC[C@H](CN1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2)OC ZINC000659979658 481680025 /nfs/dbraw/zinc/68/00/25/481680025.db2.gz NLCGECRZGUMCKA-PMACEKPBSA-N 1 3 332.488 2.636 10 0 EFAEHO COC[C@H](CN1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2)OC ZINC000659979658 481680030 /nfs/dbraw/zinc/68/00/30/481680030.db2.gz NLCGECRZGUMCKA-PMACEKPBSA-N 1 3 332.488 2.636 10 0 EFAEHO CCN(C(=O)CN1CCC[C@@H](C2CC[NH2+]CC2)C1)C1CCCCC1 ZINC000662295325 481700800 /nfs/dbraw/zinc/70/08/00/481700800.db2.gz QCWVPYLDOMYGHX-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO O=C(CN1CCC[C@H](C2CC[NH2+]CC2)C1)N1CCC[C@@H]2CCCC[C@@H]21 ZINC000662295847 481703400 /nfs/dbraw/zinc/70/34/00/481703400.db2.gz HZYZPQPPYXRNCB-UFYCRDLUSA-N 1 3 347.547 2.879 10 0 EFAEHO C[C@@H]1CCCN(CC(=O)N2CCC[C@@H](C(F)(F)F)C2)[C@@H]1CCC[NH3+] ZINC000662313177 481717251 /nfs/dbraw/zinc/71/72/51/481717251.db2.gz FVPIRRRYUMGRKE-RBSFLKMASA-N 1 3 349.441 2.627 10 0 EFAEHO CCN(C)c1ccc(C[NH2+]C[C@@H]2CN(C)C[C@H]2c2ccccc2)cn1 ZINC000647249196 481726960 /nfs/dbraw/zinc/72/69/60/481726960.db2.gz ILLQJCHBVFJNAY-UXHICEINSA-N 1 3 338.499 2.973 10 0 EFAEHO C[C@H](C[C@H]1CCCCC[NH2+]1)NCc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000665240267 481739668 /nfs/dbraw/zinc/73/96/68/481739668.db2.gz GSEFWIQZEGYKGW-UIFIKXQLSA-N 1 3 345.531 2.654 10 0 EFAEHO CC(C)C[C@@H]([NH2+][C@@H]1CCN(C2CCN(C)CC2)C1)c1ccncc1 ZINC000647288685 481747166 /nfs/dbraw/zinc/74/71/66/481747166.db2.gz KWRAZDWWYYSCNX-UYAOXDASSA-N 1 3 330.520 2.927 10 0 EFAEHO CCOc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@@H]2C[C@H](C)N(C3CC3)C2)cc1 ZINC000665254906 481749361 /nfs/dbraw/zinc/74/93/61/481749361.db2.gz CAGQZCTWUKZHNN-JHOJWFKBSA-N 1 3 343.515 2.746 10 0 EFAEHO CCOc1ccc([C@@H]2CCNC[C@@H]2[NH2+]C2CCN(C3CC3)CC2)cc1 ZINC000665255094 481750806 /nfs/dbraw/zinc/75/08/06/481750806.db2.gz IQTHKYIIOJDJSB-SFTDATJTSA-N 1 3 343.515 2.747 10 0 EFAEHO COc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@@H](C)[C@@H]2CCCOC2)cc1F ZINC000665259761 481755486 /nfs/dbraw/zinc/75/54/86/481755486.db2.gz PCVFSVQERSGXKU-DNMXQMFDSA-N 1 3 336.451 2.685 10 0 EFAEHO C[C@@H](C[C@H]1CCCCC[NH2+]1)N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2 ZINC000665274818 481762674 /nfs/dbraw/zinc/76/26/74/481762674.db2.gz YWAPVUKIMAQWRE-WJFTUGDTSA-N 1 3 335.536 2.530 10 0 EFAEHO C[C@@H]1CCCC[C@@H]1[NH+]1CCC(NCC(C)(C)[C@@]2(O)CCOC2)CC1 ZINC000647340098 481768583 /nfs/dbraw/zinc/76/85/83/481768583.db2.gz DYNFNWKKWGUBNI-IMFGXOCKSA-N 1 3 338.536 2.797 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(N[C@H](C)c2ccc(F)cc2F)CC1 ZINC000665285510 481769224 /nfs/dbraw/zinc/76/92/24/481769224.db2.gz OQUSRFMITLGIEL-CYBMUJFWSA-N 1 3 339.430 2.606 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(N[C@@H](C)c2cccc(F)c2F)CC1 ZINC000665287275 481772572 /nfs/dbraw/zinc/77/25/72/481772572.db2.gz HCSUPRJKXCNQQA-ZDUSSCGKSA-N 1 3 339.430 2.606 10 0 EFAEHO CN1C[C@@H](C[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@H]32)[C@H](c2ccccc2)C1 ZINC000647344252 481772781 /nfs/dbraw/zinc/77/27/81/481772781.db2.gz MPQZKBJCDYFTHP-XDWAVFMPSA-N 1 3 327.516 2.794 10 0 EFAEHO C[C@@H](CNC(=O)c1ccc2c(c1)[C@@H](C[NH3+])CCC2)N1CCC[C@@H](C)C1 ZINC000662389359 481780643 /nfs/dbraw/zinc/78/06/43/481780643.db2.gz WPTIJUBQQCFABD-JTDSTZFVSA-N 1 3 343.515 2.915 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)NC[C@H]1C[C@@H]([NH+](C)C)C1)c1ccccc1 ZINC000654351396 481811587 /nfs/dbraw/zinc/81/15/87/481811587.db2.gz FTAGDNSDULJRHV-NZSAHSFTSA-N 1 3 346.519 2.709 10 0 EFAEHO COc1ccccc1-c1ncc(C[NH2+]C[C@@H]2CCCN(C)C2)cn1 ZINC000644383725 481848981 /nfs/dbraw/zinc/84/89/81/481848981.db2.gz OXHFRQWNARADJQ-HNNXBMFYSA-N 1 3 326.444 2.584 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccccc2C[NH+]2CCCCC2)C1 ZINC000654411960 481857350 /nfs/dbraw/zinc/85/73/50/481857350.db2.gz WPKDGOMLPDRWGI-KRWDZBQOSA-N 1 3 329.488 2.631 10 0 EFAEHO CCCN(C(=O)C1CCN(c2cc[nH+]cc2C)CC1)[C@@H]1CCN(C)C1 ZINC000648998915 481878875 /nfs/dbraw/zinc/87/88/75/481878875.db2.gz VEZVWQSNBXPMTI-GOSISDBHSA-N 1 3 344.503 2.549 10 0 EFAEHO C[C@H](NCC1(O)CC[NH+](C)CC1)c1ccc(-c2ccccc2)cn1 ZINC000651720491 481918441 /nfs/dbraw/zinc/91/84/41/481918441.db2.gz AEZRMLYVMOHNJG-INIZCTEOSA-N 1 3 325.456 2.856 10 0 EFAEHO CC[NH+](CC)Cc1ccccc1CNC(=O)C1(NC2CC2)CCC1 ZINC000662668182 481924688 /nfs/dbraw/zinc/92/46/88/481924688.db2.gz BZOCNXKRELKOGK-UHFFFAOYSA-N 1 3 329.488 2.819 10 0 EFAEHO CC[NH+](CC)[C@@H](CNC(=O)C1(N)CC2(CCC2)C1)Cc1ccccc1 ZINC000662680274 481930248 /nfs/dbraw/zinc/93/02/48/481930248.db2.gz UHUAKFSMFDZHSH-GOSISDBHSA-N 1 3 343.515 2.717 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)N1[C@H](C)CC[C@H]1C ZINC000649101191 481931286 /nfs/dbraw/zinc/93/12/86/481931286.db2.gz PLTOHKZPNHHOGH-VROUVPMXSA-N 1 3 343.515 2.709 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)N1[C@H](C)CC[C@H]1C ZINC000649101191 481931290 /nfs/dbraw/zinc/93/12/90/481931290.db2.gz PLTOHKZPNHHOGH-VROUVPMXSA-N 1 3 343.515 2.709 10 0 EFAEHO CCCN(C(=O)CC1([NH3+])CC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000662686604 481933193 /nfs/dbraw/zinc/93/31/93/481933193.db2.gz HPRYXVCCYGQZOV-SFHVURJKSA-N 1 3 329.488 2.771 10 0 EFAEHO [NH3+]CC1(CC(=O)Nc2ccc([C@@H]3CNCCO3)cc2)CCCCC1 ZINC000662685678 481933842 /nfs/dbraw/zinc/93/38/42/481933842.db2.gz GGYBVCWNXKPQBW-KRWDZBQOSA-N 1 3 331.460 2.585 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccc2ncsc2c1 ZINC000665557722 481934389 /nfs/dbraw/zinc/93/43/89/481934389.db2.gz AMMQSHHGPKZFEN-ZDUSSCGKSA-N 1 3 349.504 2.690 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccc2ncsc2c1 ZINC000665557722 481934394 /nfs/dbraw/zinc/93/43/94/481934394.db2.gz AMMQSHHGPKZFEN-ZDUSSCGKSA-N 1 3 349.504 2.690 10 0 EFAEHO O=C(NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1)C1(NC2CC2)CCC1 ZINC000662694645 481936423 /nfs/dbraw/zinc/93/64/23/481936423.db2.gz ZHNGYDHDXAZIRM-SFHVURJKSA-N 1 3 341.499 2.690 10 0 EFAEHO O=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)C1(NC2CC2)CCC1 ZINC000662694645 481936428 /nfs/dbraw/zinc/93/64/28/481936428.db2.gz ZHNGYDHDXAZIRM-SFHVURJKSA-N 1 3 341.499 2.690 10 0 EFAEHO C[C@H]1CCC[N@H+](CCCCNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000660405106 481940519 /nfs/dbraw/zinc/94/05/19/481940519.db2.gz WJADRZAXIABSTA-IRXDYDNUSA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@H]1CCC[N@@H+](CCCCNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000660405106 481940524 /nfs/dbraw/zinc/94/05/24/481940524.db2.gz WJADRZAXIABSTA-IRXDYDNUSA-N 1 3 338.540 2.671 10 0 EFAEHO CC(C)C[C@H](N)C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662712960 481944840 /nfs/dbraw/zinc/94/48/40/481944840.db2.gz WIETWDFHXNJZLW-OALUTQOASA-N 1 3 343.515 2.778 10 0 EFAEHO CC(C)C[C@H](N)C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662712960 481944846 /nfs/dbraw/zinc/94/48/46/481944846.db2.gz WIETWDFHXNJZLW-OALUTQOASA-N 1 3 343.515 2.778 10 0 EFAEHO C[NH+](C)CCCOc1cccc(NC(=O)C2(NC3CC3)CCC2)c1 ZINC000662731015 481952191 /nfs/dbraw/zinc/95/21/91/481952191.db2.gz WJFQMZPCRXXCJT-UHFFFAOYSA-N 1 3 331.460 2.630 10 0 EFAEHO CN(CC[N@H+](C)C1CCCCC1)C(=O)C[C@@H]1NCc2ccccc21 ZINC000662788703 481970247 /nfs/dbraw/zinc/97/02/47/481970247.db2.gz REAJTMIQKMHTFR-IBGZPJMESA-N 1 3 329.488 2.944 10 0 EFAEHO CN(CC[N@@H+](C)C1CCCCC1)C(=O)C[C@@H]1NCc2ccccc21 ZINC000662788703 481970248 /nfs/dbraw/zinc/97/02/48/481970248.db2.gz REAJTMIQKMHTFR-IBGZPJMESA-N 1 3 329.488 2.944 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CCC[C@@H]1c1ccccc1 ZINC000665637569 481973378 /nfs/dbraw/zinc/97/33/78/481973378.db2.gz HKQMQXPNJPSXBV-PKOBYXMFSA-N 1 3 346.519 2.805 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CCC[C@@H]1c1ccccc1 ZINC000665637569 481973382 /nfs/dbraw/zinc/97/33/82/481973382.db2.gz HKQMQXPNJPSXBV-PKOBYXMFSA-N 1 3 346.519 2.805 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N(C)[C@@H](C)c1cccs1 ZINC000665639302 481974431 /nfs/dbraw/zinc/97/44/31/481974431.db2.gz UKVPUXXTXOSSBM-GJZGRUSLSA-N 1 3 340.537 2.723 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N(C)[C@@H](C)c1cccs1 ZINC000665639302 481974436 /nfs/dbraw/zinc/97/44/36/481974436.db2.gz UKVPUXXTXOSSBM-GJZGRUSLSA-N 1 3 340.537 2.723 10 0 EFAEHO Cc1ccc([C@@H](C)N(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000665638129 481974711 /nfs/dbraw/zinc/97/47/11/481974711.db2.gz ZZUOEKLQZZWTOC-ZWKOTPCHSA-N 1 3 348.535 2.969 10 0 EFAEHO Cc1ccc([C@@H](C)N(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000665638129 481974715 /nfs/dbraw/zinc/97/47/15/481974715.db2.gz ZZUOEKLQZZWTOC-ZWKOTPCHSA-N 1 3 348.535 2.969 10 0 EFAEHO CN(Cc1ccccc1)CC(C)(C)NC(=O)NC[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000654660659 481987206 /nfs/dbraw/zinc/98/72/06/481987206.db2.gz BEOVPJABSQRHLW-HDICACEKSA-N 1 3 346.519 2.536 10 0 EFAEHO CC(C)(C)CC(C)(C)[NH+]1CCC(NCC[C@]2(O)CCOC2)CC1 ZINC000651944753 482010517 /nfs/dbraw/zinc/01/05/17/482010517.db2.gz DISJCOQSOVHGTP-IBGZPJMESA-N 1 3 326.525 2.797 10 0 EFAEHO CCCn1ccnc1CCC[N@H+](C)Cc1ccnn1-c1ccncc1 ZINC000668169045 482012517 /nfs/dbraw/zinc/01/25/17/482012517.db2.gz HKCUONLPJUKEOU-UHFFFAOYSA-N 1 3 338.459 2.938 10 0 EFAEHO CCCn1ccnc1CCC[N@@H+](C)Cc1ccnn1-c1ccncc1 ZINC000668169045 482012521 /nfs/dbraw/zinc/01/25/21/482012521.db2.gz HKCUONLPJUKEOU-UHFFFAOYSA-N 1 3 338.459 2.938 10 0 EFAEHO O=C(N[C@@H]1CCCN2CCCC[C@@H]12)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000654729645 482017884 /nfs/dbraw/zinc/01/78/84/482017884.db2.gz UQHZZPREFYXHRD-QRVBRYPASA-N 1 3 348.535 2.663 10 0 EFAEHO CCC[C@@H]1CCCCN1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000665761104 482038574 /nfs/dbraw/zinc/03/85/74/482038574.db2.gz XFFZXLSLDGAUGY-DLBZAZTESA-N 1 3 326.529 2.623 10 0 EFAEHO CCC[C@@H]1CCCCN1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000665761104 482038580 /nfs/dbraw/zinc/03/85/80/482038580.db2.gz XFFZXLSLDGAUGY-DLBZAZTESA-N 1 3 326.529 2.623 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1[C@H](C)C[C@H]2CCCC[C@H]21 ZINC000665760013 482038909 /nfs/dbraw/zinc/03/89/09/482038909.db2.gz WMSUATLHEZUIHZ-BSDSXHPESA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1[C@H](C)C[C@H]2CCCC[C@H]21 ZINC000665760013 482038911 /nfs/dbraw/zinc/03/89/11/482038911.db2.gz WMSUATLHEZUIHZ-BSDSXHPESA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1Cc2ccccc2[C@H]1C ZINC000665759890 482039043 /nfs/dbraw/zinc/03/90/43/482039043.db2.gz SKVBILHWZNBPLV-JKSUJKDBSA-N 1 3 332.492 2.545 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1Cc2ccccc2[C@H]1C ZINC000665759890 482039047 /nfs/dbraw/zinc/03/90/47/482039047.db2.gz SKVBILHWZNBPLV-JKSUJKDBSA-N 1 3 332.492 2.545 10 0 EFAEHO Cc1ccccc1C(C)(C)NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000665762652 482039929 /nfs/dbraw/zinc/03/99/29/482039929.db2.gz LRLALKAOVFNCMQ-KRWDZBQOSA-N 1 3 348.535 2.801 10 0 EFAEHO Cc1ccccc1C(C)(C)NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000665762652 482039933 /nfs/dbraw/zinc/03/99/33/482039933.db2.gz LRLALKAOVFNCMQ-KRWDZBQOSA-N 1 3 348.535 2.801 10 0 EFAEHO C[NH2+]Cc1ccc(NC(=O)c2ccccc2OCCN(C)C)cc1 ZINC000649365408 482042436 /nfs/dbraw/zinc/04/24/36/482042436.db2.gz JIRKSQLLZAXPHJ-UHFFFAOYSA-N 1 3 327.428 2.599 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)NCCC2(C[NH3+])CC2)CC1 ZINC000652154037 482100604 /nfs/dbraw/zinc/10/06/04/482100604.db2.gz ULWKHWUZJOTPDB-MRXNPFEDSA-N 1 3 344.503 2.640 10 0 EFAEHO C[C@H](Cc1ccc(O)cc1)[NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000668488572 482141644 /nfs/dbraw/zinc/14/16/44/482141644.db2.gz BUWPGKURKPCMKE-IIBYNOLFSA-N 1 3 340.467 2.680 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2C[C@@H]3COC[C@@]3(C)C2)CC1 ZINC000668595812 482182544 /nfs/dbraw/zinc/18/25/44/482182544.db2.gz AMSDXNIVCWSQHH-TZIWHRDSSA-N 1 3 343.515 2.687 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2C[C@@H]3COC[C@@]3(C)C2)CC1 ZINC000668595812 482182547 /nfs/dbraw/zinc/18/25/47/482182547.db2.gz AMSDXNIVCWSQHH-TZIWHRDSSA-N 1 3 343.515 2.687 10 0 EFAEHO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCN(CCOc3ccccc3Cl)C2)C1 ZINC000652345622 482182550 /nfs/dbraw/zinc/18/25/50/482182550.db2.gz GUQBOQIVOLMMMV-IIDMSEBBSA-N 1 3 338.879 2.937 10 0 EFAEHO CCc1cccc(OCCN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)c1 ZINC000652360845 482193438 /nfs/dbraw/zinc/19/34/38/482193438.db2.gz RWLPXGCECAXJGL-MISYRCLQSA-N 1 3 332.488 2.989 10 0 EFAEHO CCOc1ccccc1OCCN1CCCC[C@@H]1[C@H]1C[C@H]([NH3+])CCO1 ZINC000652361423 482193921 /nfs/dbraw/zinc/19/39/21/482193921.db2.gz GVBHGCURPURCFL-MBOZVWFJSA-N 1 3 348.487 2.825 10 0 EFAEHO CCCCN(C[C@H](O)C[N@H+](C)C(C)C)[C@H]1CCc2ncsc2C1 ZINC000660907960 482211693 /nfs/dbraw/zinc/21/16/93/482211693.db2.gz XAEFIDXTAGOKRX-JKSUJKDBSA-N 1 3 339.549 2.804 10 0 EFAEHO CCCCN(C[C@H](O)C[N@@H+](C)C(C)C)[C@H]1CCc2ncsc2C1 ZINC000660907960 482211696 /nfs/dbraw/zinc/21/16/96/482211696.db2.gz XAEFIDXTAGOKRX-JKSUJKDBSA-N 1 3 339.549 2.804 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@H]3COC[C@H]3C2)CC1 ZINC000668704094 482220713 /nfs/dbraw/zinc/22/07/13/482220713.db2.gz BVWJRKPXBSGKPY-VQTJNVASSA-N 1 3 343.515 2.687 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@H]3COC[C@H]3C2)CC1 ZINC000668704094 482220721 /nfs/dbraw/zinc/22/07/21/482220721.db2.gz BVWJRKPXBSGKPY-VQTJNVASSA-N 1 3 343.515 2.687 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN2CCC(c3ccon3)CC2)cc1 ZINC000668714412 482225433 /nfs/dbraw/zinc/22/54/33/482225433.db2.gz WGPZQMZVJBBJJS-UHFFFAOYSA-N 1 3 329.444 2.995 10 0 EFAEHO CCN(C(=O)NC[C@H](c1ccccc1)[NH+](CC)CC)[C@@H]1CCN(C)C1 ZINC000663450418 482243604 /nfs/dbraw/zinc/24/36/04/482243604.db2.gz IUHSDTSANZIADY-RTBURBONSA-N 1 3 346.519 2.805 10 0 EFAEHO CN1CC[C@H](NC(=O)NC[C@H]2CC[N@@H+]2C(C)(C)C)[C@H]1c1ccccc1 ZINC000660960922 482245088 /nfs/dbraw/zinc/24/50/88/482245088.db2.gz WYYQHBNWEXHYLF-FGTMMUONSA-N 1 3 344.503 2.604 10 0 EFAEHO CN1CC[C@H](NC(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)[C@H]1c1ccccc1 ZINC000660960922 482245097 /nfs/dbraw/zinc/24/50/97/482245097.db2.gz WYYQHBNWEXHYLF-FGTMMUONSA-N 1 3 344.503 2.604 10 0 EFAEHO [NH3+]C[C@@H](NCc1nc2c(s1)CNCC2)c1ccc2ccccc2c1 ZINC000663499478 482266923 /nfs/dbraw/zinc/26/69/23/482266923.db2.gz WHWFHZZGJLHFQK-QGZVFWFLSA-N 1 3 338.480 2.732 10 0 EFAEHO CCN(C(=O)NCc1ccc(C[NH+]2CCCC2)cc1)[C@H]1CCN(C)C1 ZINC000663508004 482270880 /nfs/dbraw/zinc/27/08/80/482270880.db2.gz GDJFKFCVNQOXND-IBGZPJMESA-N 1 3 344.503 2.518 10 0 EFAEHO C[C@H](C[N@@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1)C(C)(C)C ZINC000663510220 482272664 /nfs/dbraw/zinc/27/26/64/482272664.db2.gz DUYWKXPMVXOSRG-HZPDHXFCSA-N 1 3 333.524 2.681 10 0 EFAEHO C[C@H](C[N@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1)C(C)(C)C ZINC000663510220 482272675 /nfs/dbraw/zinc/27/26/75/482272675.db2.gz DUYWKXPMVXOSRG-HZPDHXFCSA-N 1 3 333.524 2.681 10 0 EFAEHO C[C@@H]1CCC[C@@H](C[N@@H+]2CCC[C@@H](c3cc(N4CCNCC4)n[nH]3)C2)C1 ZINC000663513654 482273985 /nfs/dbraw/zinc/27/39/85/482273985.db2.gz TUXULSRFYZDDRR-KZNAEPCWSA-N 1 3 345.535 2.825 10 0 EFAEHO C[C@@H]1CCC[C@@H](C[N@H+]2CCC[C@@H](c3cc(N4CCNCC4)n[nH]3)C2)C1 ZINC000663513654 482273989 /nfs/dbraw/zinc/27/39/89/482273989.db2.gz TUXULSRFYZDDRR-KZNAEPCWSA-N 1 3 345.535 2.825 10 0 EFAEHO CCN(C(=O)NC[C@@H](C1CCCCC1)[NH+](C)C)[C@@H]1CCN(CC)C1 ZINC000663629642 482325493 /nfs/dbraw/zinc/32/54/93/482325493.db2.gz PSNXKPLJNSFXTC-MSOLQXFVSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000666427130 482326421 /nfs/dbraw/zinc/32/64/21/482326421.db2.gz NUAAUVLPTOJCOP-UYAOXDASSA-N 1 3 343.515 2.857 10 0 EFAEHO CCN(C(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1)[C@@H]1CCN(CC)C1 ZINC000663654116 482332915 /nfs/dbraw/zinc/33/29/15/482332915.db2.gz DKVVVTBFWBJLKF-QZTJIDSGSA-N 1 3 338.540 2.624 10 0 EFAEHO CCN(C(=O)NCCCC[N@H+]1CCC[C@@H](C)C1)[C@@H]1CCN(CC)C1 ZINC000663654116 482332920 /nfs/dbraw/zinc/33/29/20/482332920.db2.gz DKVVVTBFWBJLKF-QZTJIDSGSA-N 1 3 338.540 2.624 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)Nc1ccccc1CCN(C)C ZINC000650143789 482402478 /nfs/dbraw/zinc/40/24/78/482402478.db2.gz IAMDARNBNAGWJJ-UHFFFAOYSA-N 1 3 334.508 2.890 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)Nc1ccccc1CCN(C)C ZINC000650143789 482402479 /nfs/dbraw/zinc/40/24/79/482402479.db2.gz IAMDARNBNAGWJJ-UHFFFAOYSA-N 1 3 334.508 2.890 10 0 EFAEHO CCN(C(=O)NC[C@H](c1ccc(C)cc1)N(C)C)[C@@H]1CC[N@H+](CC)C1 ZINC000663844500 482404604 /nfs/dbraw/zinc/40/46/04/482404604.db2.gz WSUTWZHMDUOPSC-RTBURBONSA-N 1 3 346.519 2.723 10 0 EFAEHO CCN(C(=O)NC[C@H](c1ccc(C)cc1)N(C)C)[C@@H]1CC[N@@H+](CC)C1 ZINC000663844500 482404605 /nfs/dbraw/zinc/40/46/05/482404605.db2.gz WSUTWZHMDUOPSC-RTBURBONSA-N 1 3 346.519 2.723 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+]2CCCC[C@@H]2c2cccn2C)CC1 ZINC000192751345 519681502 /nfs/dbraw/zinc/68/15/02/519681502.db2.gz IGJNTLJIRZOYDG-HXUWFJFHSA-N 1 3 332.536 2.968 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+]2CCCC[C@@H]2c2cccn2C)CC1 ZINC000192751345 519681504 /nfs/dbraw/zinc/68/15/04/519681504.db2.gz IGJNTLJIRZOYDG-HXUWFJFHSA-N 1 3 332.536 2.968 10 0 EFAEHO CC(C)N1CC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)C1=O ZINC000245744424 519688005 /nfs/dbraw/zinc/68/80/05/519688005.db2.gz SGAXLRBLQGNQRG-IYWMVGAKSA-N 1 3 341.499 2.781 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000078545695 520852572 /nfs/dbraw/zinc/85/25/72/520852572.db2.gz DFDFLAGKFDLTLV-MJGOQNOKSA-N 1 3 346.519 2.853 10 0 EFAEHO CC1CC[NH+](C2CCC(NC(=O)N3CCN4CCC[C@@H]4C3)CC2)CC1 ZINC000179179949 520993637 /nfs/dbraw/zinc/99/36/37/520993637.db2.gz SDTKWWGCTLPWQG-CTWPCTMYSA-N 1 3 348.535 2.519 10 0 EFAEHO CCC(CC)(CNC(=O)C1(N)CCOCC1)[NH2+][C@@H](C)c1ccccc1 ZINC000261945974 521431248 /nfs/dbraw/zinc/43/12/48/521431248.db2.gz YFBOMXDPOUQHMS-INIZCTEOSA-N 1 3 347.503 2.520 10 0 EFAEHO C[NH+](C)C[C@@](C)(O)CNC1CC(c2ccc(Br)cc2)C1 ZINC000194124266 521855091 /nfs/dbraw/zinc/85/50/91/521855091.db2.gz YAEKTZKCHFMXOP-BCLQGDPASA-N 1 3 341.293 2.597 10 0 EFAEHO COc1cc([C@@H](C)[NH2+]C2CCN(C[C@H]3CCOC3)CC2)ccc1F ZINC000153877736 522904212 /nfs/dbraw/zinc/90/42/12/522904212.db2.gz RBUZYDPXCIEQND-HUUCEWRRSA-N 1 3 336.451 2.986 10 0 EFAEHO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)N2CC[C@@H](N3CC=CC3)C2)C1 ZINC000245655166 523088584 /nfs/dbraw/zinc/08/85/84/523088584.db2.gz CLKBQKJDVOFOOX-ZWKOTPCHSA-N 1 3 348.535 2.543 10 0 EFAEHO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CC[C@@H](N3CC=CC3)C2)C1 ZINC000245655166 523088597 /nfs/dbraw/zinc/08/85/97/523088597.db2.gz CLKBQKJDVOFOOX-ZWKOTPCHSA-N 1 3 348.535 2.543 10 0 EFAEHO CN1CCC(C[NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)(N2CCCCC2)CC1 ZINC000181827296 523765706 /nfs/dbraw/zinc/76/57/06/523765706.db2.gz FXIYPHQLOSHPEJ-OTWHNJEPSA-N 1 3 349.563 2.730 10 0 EFAEHO COc1ccc(C[N@H+](C)C[C@H]2CCN(C)C2)cc1Br ZINC000071190407 524005010 /nfs/dbraw/zinc/00/50/10/524005010.db2.gz HNVVXIZSLDCWAA-ZDUSSCGKSA-N 1 3 327.266 2.841 10 0 EFAEHO COc1ccc(C[N@@H+](C)C[C@H]2CCN(C)C2)cc1Br ZINC000071190407 524005014 /nfs/dbraw/zinc/00/50/14/524005014.db2.gz HNVVXIZSLDCWAA-ZDUSSCGKSA-N 1 3 327.266 2.841 10 0 EFAEHO C[N@H+]1C[C@H]2CN(C[C@@H](O)Cn3c4ccccc4c4ccccc43)C[C@H]2C1 ZINC000193610629 524016282 /nfs/dbraw/zinc/01/62/82/524016282.db2.gz FTDDALFJNSAASH-FGTMMUONSA-N 1 3 349.478 2.649 10 0 EFAEHO C[N@@H+]1C[C@H]2CN(C[C@@H](O)Cn3c4ccccc4c4ccccc43)C[C@H]2C1 ZINC000193610629 524016284 /nfs/dbraw/zinc/01/62/84/524016284.db2.gz FTDDALFJNSAASH-FGTMMUONSA-N 1 3 349.478 2.649 10 0 EFAEHO Cc1cccc(NC(=O)[C@@H]2CCC[N@@H+](CC[C@H]3CCCN3C)C2)n1 ZINC000245698264 524647812 /nfs/dbraw/zinc/64/78/12/524647812.db2.gz RELFHCJMDNUIAO-IAGOWNOFSA-N 1 3 330.476 2.525 10 0 EFAEHO Cc1cccc(NC(=O)[C@@H]2CCC[N@H+](CC[C@H]3CCCN3C)C2)n1 ZINC000245698264 524647823 /nfs/dbraw/zinc/64/78/23/524647823.db2.gz RELFHCJMDNUIAO-IAGOWNOFSA-N 1 3 330.476 2.525 10 0 EFAEHO Cc1ccc([C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)N2CCOCC2)s1 ZINC000192984993 525958364 /nfs/dbraw/zinc/95/83/64/525958364.db2.gz NCBYBLSQZMTUIU-FBVQUNGASA-N 1 3 349.544 2.645 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2CCC3(CC[NH2+]3)CC2)CC1 ZINC000422563342 534933840 /nfs/dbraw/zinc/93/38/40/534933840.db2.gz SQRWFHAHKZLHEL-UHFFFAOYSA-N 1 3 342.531 2.547 10 0 EFAEHO CCCN1CCN(c2ccccc2CN(CC)CCC[NH+](C)C)CC1 ZINC000349409599 534935407 /nfs/dbraw/zinc/93/54/07/534935407.db2.gz ROOJZUVCSXKDJM-UHFFFAOYSA-N 1 3 346.563 2.992 10 0 EFAEHO CC[NH+](CC)CC1CCN(Cc2cc(OC)c(O)c(OC)c2)CC1 ZINC000347634909 535496585 /nfs/dbraw/zinc/49/65/85/535496585.db2.gz JPSLITRYCUETRO-UHFFFAOYSA-N 1 3 336.476 2.963 10 0 EFAEHO CN(C)CCOc1ccc(NC(=O)CC[C@H]2CCCC[N@@H+]2C)cc1 ZINC000351874449 535908642 /nfs/dbraw/zinc/90/86/42/535908642.db2.gz GJSZIXHPZRIESZ-QGZVFWFLSA-N 1 3 333.476 2.830 10 0 EFAEHO CN(C)CCOc1ccc(NC(=O)CC[C@H]2CCCC[N@H+]2C)cc1 ZINC000351874449 535908647 /nfs/dbraw/zinc/90/86/47/535908647.db2.gz GJSZIXHPZRIESZ-QGZVFWFLSA-N 1 3 333.476 2.830 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCn1nc(-c2ccc(F)cc2)c2c1CCNC2 ZINC000211645030 536389704 /nfs/dbraw/zinc/38/97/04/536389704.db2.gz GDFMQPCQIXFLGZ-INIZCTEOSA-N 1 3 328.435 2.819 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCn1nc(-c2ccc(F)cc2)c2c1CCNC2 ZINC000211645030 536389709 /nfs/dbraw/zinc/38/97/09/536389709.db2.gz GDFMQPCQIXFLGZ-INIZCTEOSA-N 1 3 328.435 2.819 10 0 EFAEHO Cc1cnccc1C[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000397606383 546170567 /nfs/dbraw/zinc/17/05/67/546170567.db2.gz XGXBTIXSZFRWBV-UHFFFAOYSA-N 1 3 325.456 2.507 10 0 EFAEHO CC(C)[C@@H]1CC[C@@H]1[NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1 ZINC000414347415 546189088 /nfs/dbraw/zinc/18/90/88/546189088.db2.gz WGZZMZYOBHYWHP-PMACEKPBSA-N 1 3 343.515 2.908 10 0 EFAEHO O=C(NC[C@@H]1CCCCN1Cc1ccccc1)[C@@H]1C[C@@]12CCC[NH2+]C2 ZINC000655445551 546450503 /nfs/dbraw/zinc/45/05/03/546450503.db2.gz BKTCDBTZSAVZSQ-IRFCIJBXSA-N 1 3 341.499 2.547 10 0 EFAEHO CC[N@H+](Cc1ccc(C(=O)N[C@H](CN)C(F)(F)F)cc1)C(C)C ZINC000655514489 546469661 /nfs/dbraw/zinc/46/96/61/546469661.db2.gz RHBIWZOPACHQPG-CQSZACIVSA-N 1 3 331.382 2.536 10 0 EFAEHO CC[N@@H+](Cc1ccc(C(=O)N[C@H](CN)C(F)(F)F)cc1)C(C)C ZINC000655514489 546469664 /nfs/dbraw/zinc/46/96/64/546469664.db2.gz RHBIWZOPACHQPG-CQSZACIVSA-N 1 3 331.382 2.536 10 0 EFAEHO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(CN3CCN(C)CC3)cc2)CS1 ZINC000655697237 546538421 /nfs/dbraw/zinc/53/84/21/546538421.db2.gz OTHOWOHDDCEFTH-VQIMIIECSA-N 1 3 333.545 2.808 10 0 EFAEHO COc1cc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc(Br)c1[O-] ZINC000655826209 546601615 /nfs/dbraw/zinc/60/16/15/546601615.db2.gz SMYXEXCJDYRCMS-KLPPZKSPSA-N 1 3 343.265 2.593 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC2(COC)CC2)CC1 ZINC000655836882 546605623 /nfs/dbraw/zinc/60/56/23/546605623.db2.gz OIPOBXGWEVMJIQ-UHFFFAOYSA-N 1 3 331.504 2.735 10 0 EFAEHO [NH3+][C@H](Cc1cn([C@H]2CCN(Cc3ccccc3)C2)nn1)c1ccccc1 ZINC000656455944 546806629 /nfs/dbraw/zinc/80/66/29/546806629.db2.gz PXWMLNNCYSXUEK-LEWJYISDSA-N 1 3 347.466 2.968 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H](CNCc2ccnn2-c2ccncc2)C1 ZINC000657413604 547152440 /nfs/dbraw/zinc/15/24/40/547152440.db2.gz NMELKCCDYMDAAO-KRWDZBQOSA-N 1 3 327.476 2.725 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H](CNCc2ccnn2-c2ccncc2)C1 ZINC000657413604 547152448 /nfs/dbraw/zinc/15/24/48/547152448.db2.gz NMELKCCDYMDAAO-KRWDZBQOSA-N 1 3 327.476 2.725 10 0 EFAEHO COc1cccc(CNCC2CC[NH+](C3CCOCC3)CC2)c1F ZINC000657537804 547197145 /nfs/dbraw/zinc/19/71/45/547197145.db2.gz TXXGRKAPDSHXFR-UHFFFAOYSA-N 1 3 336.451 2.815 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1cc(Cl)cc2c1OCC2 ZINC000657572595 547211201 /nfs/dbraw/zinc/21/12/01/547211201.db2.gz CFUFECAONBCUJR-AWEZNQCLSA-N 1 3 339.911 2.637 10 0 EFAEHO COc1ccc2oc(CN[C@@H](C)CN(C)CCC[NH+](C)C)cc2c1 ZINC000657572808 547211986 /nfs/dbraw/zinc/21/19/86/547211986.db2.gz GZPFTAHAKKTSHV-HNNXBMFYSA-N 1 3 333.476 2.803 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1c(C2CC2)nc2sccn12 ZINC000657573686 547212358 /nfs/dbraw/zinc/21/23/58/547212358.db2.gz ONDMCHNNEIAWDU-AWEZNQCLSA-N 1 3 349.548 2.635 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1cnc(-c2ccncc2)s1 ZINC000657573962 547212435 /nfs/dbraw/zinc/21/24/35/547212435.db2.gz REONUWGUJBEQSK-HNNXBMFYSA-N 1 3 347.532 2.567 10 0 EFAEHO Cc1nn(C(C)(C)C)c(C)c1CN[C@@H](C)CN(C)CCC[NH+](C)C ZINC000657572782 547212555 /nfs/dbraw/zinc/21/25/55/547212555.db2.gz GGSSMMOOBIWWJW-HNNXBMFYSA-N 1 3 337.556 2.617 10 0 EFAEHO O[C@@H]1CCN(Cc2ccc(C[NH2+][C@H]3CCc4ccccc4C3)cc2)C1 ZINC000657593953 547219789 /nfs/dbraw/zinc/21/97/89/547219789.db2.gz DMHXBOFWVKDNIR-FCHUYYIVSA-N 1 3 336.479 2.900 10 0 EFAEHO COCC1CCC([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)CC1 ZINC000657594807 547222662 /nfs/dbraw/zinc/22/26/62/547222662.db2.gz CRYVPFDVCHVFEQ-SOAGJPPSSA-N 1 3 332.488 2.548 10 0 EFAEHO FC1(F)C[C@H]1OCCNCc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000657618393 547231370 /nfs/dbraw/zinc/23/13/70/547231370.db2.gz LLDXAKMKCRAHKN-QGZVFWFLSA-N 1 3 340.414 2.675 10 0 EFAEHO OC1CCN(Cc2ccc(C[NH2+]C3CC(CF)(CF)C3)cc2)CC1 ZINC000657874680 547307656 /nfs/dbraw/zinc/30/76/56/547307656.db2.gz XSYLIVFEXNSDRZ-UHFFFAOYSA-N 1 3 338.442 2.821 10 0 EFAEHO CCOC1CCC([NH2+]CC2(N3CCCCC3)CCN(C)CC2)CC1 ZINC000657890414 547311622 /nfs/dbraw/zinc/31/16/22/547311622.db2.gz DZIAZPUDKZRMIE-UHFFFAOYSA-N 1 3 337.552 2.874 10 0 EFAEHO CN1CCC(C[NH2+][C@H]2CCCSCC2)(N2CCCCC2)CC1 ZINC000657892834 547311736 /nfs/dbraw/zinc/31/17/36/547311736.db2.gz NQBWGFSKIZMMOJ-KRWDZBQOSA-N 1 3 325.566 2.812 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)N[C@H]1CCc2c1cc(F)cc2F ZINC000658105813 547357711 /nfs/dbraw/zinc/35/77/11/547357711.db2.gz FBASROPFCXHNGV-UGSOOPFHSA-N 1 3 325.447 2.814 10 0 EFAEHO C[C@@H](N[C@@H](C)CN(C)CCC[NH+](C)C)c1cnn(C2CCCC2)c1 ZINC000658107736 547358511 /nfs/dbraw/zinc/35/85/11/547358511.db2.gz NWTKLBJTKXEJPF-DLBZAZTESA-N 1 3 335.540 2.921 10 0 EFAEHO Cc1c([C@@H](C)N[C@@H](C)CN(C)CCC[NH+](C)C)cnn1C(C)(C)C ZINC000658109827 547359634 /nfs/dbraw/zinc/35/96/34/547359634.db2.gz YVZZEUVRKPJVAQ-JKSUJKDBSA-N 1 3 337.556 2.869 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)N[C@@H](C)c1ccc(C(F)F)nc1 ZINC000658109759 547359651 /nfs/dbraw/zinc/35/96/51/547359651.db2.gz WRQCQRHYCMBUEZ-KBPBESRZSA-N 1 3 328.451 2.942 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)C12CCC2 ZINC000658135897 547366359 /nfs/dbraw/zinc/36/63/59/547366359.db2.gz FUABOJKXUPJLPD-HSALFYBXSA-N 1 3 344.499 2.691 10 0 EFAEHO C[C@@H](CCc1ccco1)[NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000658137800 547367497 /nfs/dbraw/zinc/36/74/97/547367497.db2.gz IKXPLEYVVVHCCN-LPHOPBHVSA-N 1 3 328.456 2.957 10 0 EFAEHO Cc1cncc([C@H](C)NCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1 ZINC000658138796 547368197 /nfs/dbraw/zinc/36/81/97/547368197.db2.gz OFPTXTNOGWSNEQ-JXFKEZNVSA-N 1 3 325.456 2.807 10 0 EFAEHO Cc1cncc([C@H](C)NCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1 ZINC000658138796 547368199 /nfs/dbraw/zinc/36/81/99/547368199.db2.gz OFPTXTNOGWSNEQ-JXFKEZNVSA-N 1 3 325.456 2.807 10 0 EFAEHO CCO[C@@H]1C[C@@H]([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)C1(C)C ZINC000658139188 547368750 /nfs/dbraw/zinc/36/87/50/547368750.db2.gz PHZLMSISTCDNET-GUDVDZBRSA-N 1 3 332.488 2.546 10 0 EFAEHO COC[C@H](CC(C)(C)C)[NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000658139788 547368763 /nfs/dbraw/zinc/36/87/63/547368763.db2.gz SBTKHDCYYVMVGX-OALUTQOASA-N 1 3 334.504 2.794 10 0 EFAEHO CC[C@@H](NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccncc1 ZINC000658141996 547368966 /nfs/dbraw/zinc/36/89/66/547368966.db2.gz YAAXTTCQZBAYLY-VQTJNVASSA-N 1 3 325.456 2.889 10 0 EFAEHO CC[C@@H](NCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1)c1ccncc1 ZINC000658141996 547368971 /nfs/dbraw/zinc/36/89/71/547368971.db2.gz YAAXTTCQZBAYLY-VQTJNVASSA-N 1 3 325.456 2.889 10 0 EFAEHO CCC1(CC)[C@H]([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)C[C@@H]1OC ZINC000658141892 547369007 /nfs/dbraw/zinc/36/90/07/547369007.db2.gz XOMWUQHBUATAKI-AQNXPRMDSA-N 1 3 346.515 2.937 10 0 EFAEHO CC[C@@H](CN1CCCC1)NC(=O)C1CCN(c2cc[nH+]cc2C)CC1 ZINC000674412875 548088561 /nfs/dbraw/zinc/08/85/61/548088561.db2.gz UWGQAPZTHPPAFA-SFHVURJKSA-N 1 3 344.503 2.597 10 0 EFAEHO CC(C)[NH2+][C@@H]1CCCN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)C1 ZINC000677584359 548729336 /nfs/dbraw/zinc/72/93/36/548729336.db2.gz SCTSPZXRUDPUPA-QRVBRYPASA-N 1 3 344.503 2.604 10 0 EFAEHO c1ncn(-c2ccccc2CN2CCC(C[NH+]3CCCC3)CC2)n1 ZINC000678139322 548851739 /nfs/dbraw/zinc/85/17/39/548851739.db2.gz RILFQVASAIPABN-UHFFFAOYSA-N 1 3 325.460 2.575 10 0 EFAEHO C[C@@H]1CN(C)C[C@@H]1[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000679721423 549190423 /nfs/dbraw/zinc/19/04/23/549190423.db2.gz NUYWWMUINNIOHH-PPQDBTBKSA-N 1 3 327.516 2.827 10 0 EFAEHO CCc1cc(C)nc(NCC2(N3CCCCC3)CC[NH+](C)CC2)n1 ZINC000680956087 549426958 /nfs/dbraw/zinc/42/69/58/549426958.db2.gz NAAJIWOCIPCPSI-UHFFFAOYSA-N 1 3 331.508 2.710 10 0 EFAEHO CCN1CCN(Cc2ccccc2C[NH2+][C@@H]2CCC[C@@H](OC)C2)CC1 ZINC000684370263 550031204 /nfs/dbraw/zinc/03/12/04/550031204.db2.gz RGDODAUBLJQCFP-NHCUHLMSSA-N 1 3 345.531 2.871 10 0 EFAEHO CO[C@H]1CCC[C@H]([NH2+]Cc2ccccc2CN2CCC(O)CC2)C1 ZINC000684383344 550032956 /nfs/dbraw/zinc/03/29/56/550032956.db2.gz MQPLSZFNPDUTLJ-ICSRJNTNSA-N 1 3 332.488 2.691 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NCCSC(F)(F)F)[C@@H](C)C1 ZINC000765240912 577022271 /nfs/dbraw/zinc/02/22/71/577022271.db2.gz ZVPXQHYBDDAFRJ-STQMWFEESA-N 1 3 328.444 2.966 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NCCSC(F)(F)F)[C@@H](C)C1 ZINC000765240912 577022274 /nfs/dbraw/zinc/02/22/74/577022274.db2.gz ZVPXQHYBDDAFRJ-STQMWFEESA-N 1 3 328.444 2.966 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@@H](O)c2cccnc2)CC[N@@H+]1Cc1ccccc1 ZINC000773081261 581394744 /nfs/dbraw/zinc/39/47/44/581394744.db2.gz LWCLGFKVDIZSJA-LSTHTHJFSA-N 1 3 325.456 2.758 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@@H](O)c2cccnc2)CC[N@H+]1Cc1ccccc1 ZINC000773081261 581394747 /nfs/dbraw/zinc/39/47/47/581394747.db2.gz LWCLGFKVDIZSJA-LSTHTHJFSA-N 1 3 325.456 2.758 10 0 EFAEHO CC(C)c1ccc(C[NH2+]CCN(C)C(=O)C2(N(C)C)CCC2)cc1 ZINC001691345961 1248678412 /nfs/dbraw/zinc/67/84/12/1248678412.db2.gz LWDLIKPNGCWMCR-UHFFFAOYSA-N 1 3 331.504 2.842 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+]Cc2cc3ccccc3s2)CCC1 ZINC001691345833 1248678724 /nfs/dbraw/zinc/67/87/24/1248678724.db2.gz KKOLJHALHJCAJL-UHFFFAOYSA-N 1 3 345.512 2.934 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CCCCCF)[C@@H]1C)N1CCCC1 ZINC001691765315 1250092239 /nfs/dbraw/zinc/09/22/39/1250092239.db2.gz OZNVQKOXCFQVST-SQNIBIBYSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CCCCCF)[C@@H]1C)N1CCCC1 ZINC001691765315 1250092248 /nfs/dbraw/zinc/09/22/48/1250092248.db2.gz OZNVQKOXCFQVST-SQNIBIBYSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CCCCCF)[C@@H]1C)N1CCCC1 ZINC001691765314 1250092278 /nfs/dbraw/zinc/09/22/78/1250092278.db2.gz OZNVQKOXCFQVST-FGTMMUONSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CCCCCF)[C@@H]1C)N1CCCC1 ZINC001691765314 1250092288 /nfs/dbraw/zinc/09/22/88/1250092288.db2.gz OZNVQKOXCFQVST-FGTMMUONSA-N 1 3 341.515 2.826 10 0 EFAEHO c1ccc(N2CCN(C[C@@H]3CCCN(c4cc[nH+]cc4)C3)CC2)nc1 ZINC001772527013 1248034086 /nfs/dbraw/zinc/03/40/86/1248034086.db2.gz HOQYUEJFPGLIFT-SFHVURJKSA-N 1 3 337.471 2.515 10 0 EFAEHO Cc1nc(F)ccc1C[NH2+]CC1CCN(Cc2ccncc2)CC1 ZINC000850361823 1250450846 /nfs/dbraw/zinc/45/08/46/1250450846.db2.gz FNKYAQJGNMXUMM-UHFFFAOYSA-N 1 3 328.435 2.926 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN[C@@H]2C[C@@H](O)c3ccccc32)cc1 ZINC000850372738 1250453158 /nfs/dbraw/zinc/45/31/58/1250453158.db2.gz YDJSZMVPHBJXPQ-WOJBJXKFSA-N 1 3 326.440 2.895 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[NH2+]Cc1ccc(C(C)(C)C)cc1)N(C)C ZINC001691558613 1251770214 /nfs/dbraw/zinc/77/02/14/1251770214.db2.gz ONEGWLJYHMJIDY-GOSISDBHSA-N 1 3 333.520 2.872 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001691556553 1251770523 /nfs/dbraw/zinc/77/05/23/1251770523.db2.gz UZWZEBHPEVQFBN-VQIMIIECSA-N 1 3 349.494 2.803 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC001691566717 1251777096 /nfs/dbraw/zinc/77/70/96/1251777096.db2.gz BAYHUFRSRUYVFI-UHFFFAOYSA-N 1 3 345.409 2.595 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N[C@]2(C)CCN(CCCCC(F)(F)F)C2)C1 ZINC001484069083 1252180347 /nfs/dbraw/zinc/18/03/47/1252180347.db2.gz WXNBCFXOWSDJKH-GDBMZVCRSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N[C@]2(C)CCN(CCCCC(F)(F)F)C2)C1 ZINC001484069083 1252180350 /nfs/dbraw/zinc/18/03/50/1252180350.db2.gz WXNBCFXOWSDJKH-GDBMZVCRSA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([C@H](C)[NH2+]CC2CC3(CCC3)C2)C1 ZINC001484358595 1252443827 /nfs/dbraw/zinc/44/38/27/1252443827.db2.gz OEIZCBPOLLUXEJ-WMZOPIPTSA-N 1 3 335.536 2.734 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001484359817 1252455151 /nfs/dbraw/zinc/45/51/51/1252455151.db2.gz YOUNMUSAHLCQKZ-XLIONFOSSA-N 1 3 345.531 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]CCC2CCCCC2)C1 ZINC001484384233 1252488946 /nfs/dbraw/zinc/48/89/46/1252488946.db2.gz KKKQQARDUXQONT-PKOBYXMFSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2ccc(C)cc2C)C1 ZINC001484381848 1252495390 /nfs/dbraw/zinc/49/53/90/1252495390.db2.gz BHRSZAOSXOETEG-ICSRJNTNSA-N 1 3 345.531 2.829 10 0 EFAEHO CC(C)(C(=O)N(CCNCCF)Cc1ccccc1)[NH+]1CCCCC1 ZINC001484400034 1252538527 /nfs/dbraw/zinc/53/85/27/1252538527.db2.gz ZIKIXIGJZTWHEW-UHFFFAOYSA-N 1 3 349.494 2.839 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001484618289 1252767438 /nfs/dbraw/zinc/76/74/38/1252767438.db2.gz NPVODXMSEUITLU-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO Cc1ccc(CC[N@H+]2CCC[C@@H](NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001484728370 1252819717 /nfs/dbraw/zinc/81/97/17/1252819717.db2.gz NGGOZHBAXGSCBA-HXUWFJFHSA-N 1 3 345.531 2.848 10 0 EFAEHO Cc1ccc(CC[N@@H+]2CCC[C@@H](NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001484728370 1252819726 /nfs/dbraw/zinc/81/97/26/1252819726.db2.gz NGGOZHBAXGSCBA-HXUWFJFHSA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@H](CC[NH2+]CC1CCCC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001273018942 1265839203 /nfs/dbraw/zinc/83/92/03/1265839203.db2.gz QHLOFFRLRIMNRP-DNVCBOLYSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1ccc(CN2CC([C@@H](C)NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)cc1C ZINC001409929464 1255633692 /nfs/dbraw/zinc/63/36/92/1255633692.db2.gz HEYDBOPHGODRLP-MJGOQNOKSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(CN2CC([C@@H](C)NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)cc1C ZINC001409929464 1255633700 /nfs/dbraw/zinc/63/37/00/1255633700.db2.gz HEYDBOPHGODRLP-MJGOQNOKSA-N 1 3 343.515 2.582 10 0 EFAEHO CCCCCC[N@@H+]1CCC[C@@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001671038325 1259816275 /nfs/dbraw/zinc/81/62/75/1259816275.db2.gz AHTKGTYABOHDHV-LJQANCHMSA-N 1 3 332.492 2.847 10 0 EFAEHO CCCCCC[N@H+]1CCC[C@@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001671038325 1259816284 /nfs/dbraw/zinc/81/62/84/1259816284.db2.gz AHTKGTYABOHDHV-LJQANCHMSA-N 1 3 332.492 2.847 10 0 EFAEHO c1ccc(CN2CCCC[C@H](C[NH2+][C@@H]3CCO[C@@]34CCOC4)C2)cc1 ZINC000903173325 1259895715 /nfs/dbraw/zinc/89/57/15/1259895715.db2.gz YUUAAUBUFRCBSG-NJDAHSKKSA-N 1 3 344.499 2.826 10 0 EFAEHO CCCCC[NH+]1CCC2(CN(C(=O)CN3[C@@H](C)CC[C@@H]3C)C2)CC1 ZINC001272825913 1261058922 /nfs/dbraw/zinc/05/89/22/1261058922.db2.gz KZTWFYPQOOBOQO-ROUUACIJSA-N 1 3 335.536 2.974 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H](C)NC(=O)CN(C)C2CCC2)c(C)s1 ZINC001272829170 1261089736 /nfs/dbraw/zinc/08/97/36/1261089736.db2.gz GWTNVZIXXGSTTM-ZDUSSCGKSA-N 1 3 337.533 2.834 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1nsc2ccccc12)N(C)C ZINC001272865132 1261192387 /nfs/dbraw/zinc/19/23/87/1261192387.db2.gz JVRMNZKDXWEGPX-XJKSGUPXSA-N 1 3 348.516 2.621 10 0 EFAEHO COC(=O)[C@H](C)Oc1ccccc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C ZINC000921791356 1261444341 /nfs/dbraw/zinc/44/43/41/1261444341.db2.gz TXQAQUBCIWQKCI-MIGBEJBISA-N 1 3 346.471 2.732 10 0 EFAEHO COc1cccc(CN(CCC[NH2+]C2CC2)C2CCC(O)CC2)c1 ZINC000923312874 1261445395 /nfs/dbraw/zinc/44/53/95/1261445395.db2.gz RMWMBETZYDPGOE-UHFFFAOYSA-N 1 3 332.488 2.943 10 0 EFAEHO CCc1ccc([C@H](C)NC(=O)[C@H](C)N2CC[C@H](C[NH3+])[C@H](C)C2)cc1 ZINC000923498164 1261790618 /nfs/dbraw/zinc/79/06/18/1261790618.db2.gz JRKVEOWURVRWGI-PASDCYSWSA-N 1 3 331.504 2.731 10 0 EFAEHO C[C@@H]1CN(CC(=O)N[C@@H](c2ccccc2)C2CCCC2)CC[C@H]1C[NH3+] ZINC000923498440 1261792629 /nfs/dbraw/zinc/79/26/29/1261792629.db2.gz PNUGMGWBKGCHNE-PBEJRMEISA-N 1 3 343.515 2.951 10 0 EFAEHO C[C@@H]1CN(CC(=O)N[C@H](c2ccccc2)C2CCCC2)CC[C@H]1C[NH3+] ZINC000923498436 1261792761 /nfs/dbraw/zinc/79/27/61/1261792761.db2.gz PNUGMGWBKGCHNE-LKUPVBHCSA-N 1 3 343.515 2.951 10 0 EFAEHO C[C@H]1CN(CC(=O)N(Cc2ccccc2)C(C)(C)C)CC[C@@H]1C[NH3+] ZINC000923504375 1261801616 /nfs/dbraw/zinc/80/16/16/1261801616.db2.gz RBVBNPQQPJZCDP-FUHWJXTLSA-N 1 3 331.504 2.730 10 0 EFAEHO [NH3+]CCCCCCCN1C[C@@H](C[C@@H]2COCCN2)c2ccccc21 ZINC000923540407 1261875151 /nfs/dbraw/zinc/87/51/51/1261875151.db2.gz JIHUAOYDXVLTEW-QZTJIDSGSA-N 1 3 331.504 2.878 10 0 EFAEHO CCCCCN1CC[C@H]1CN(C)C(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001691661516 1262209573 /nfs/dbraw/zinc/20/95/73/1262209573.db2.gz UWHDBOROBSCKNH-LPHOPBHVSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCCCN1CC[C@H]1CN(C)C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001691661516 1262209579 /nfs/dbraw/zinc/20/95/79/1262209579.db2.gz UWHDBOROBSCKNH-LPHOPBHVSA-N 1 3 341.515 2.922 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H]2C)cc1 ZINC001486094895 1262616992 /nfs/dbraw/zinc/61/69/92/1262616992.db2.gz DRTDLNJECXJUJC-AZUAARDMSA-N 1 3 345.531 2.847 10 0 EFAEHO C[C@H](c1ccccc1F)N1CC[C@@]2(NC(=O)CC[NH+](C)C)CCC[C@H]12 ZINC001486148210 1262698476 /nfs/dbraw/zinc/69/84/76/1262698476.db2.gz LDODOVMYZBGEJH-BPAFIMBUSA-N 1 3 347.478 2.952 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CC[C@@H](C[NH2+]CCC2CC2)C1)N1CCCCC1 ZINC001486199643 1262783279 /nfs/dbraw/zinc/78/32/79/1262783279.db2.gz CJCITZPJTSDWCU-QZTJIDSGSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@@H](C[NH2+]CC3=CCCCC3)C2)CCC1 ZINC001486203401 1262788512 /nfs/dbraw/zinc/78/85/12/1262788512.db2.gz XGUSMCZHRBJMLQ-QZTJIDSGSA-N 1 3 333.520 2.846 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@H](C[NH2+]CC3=CCCCC3)C2)CCC1 ZINC001486203403 1262788698 /nfs/dbraw/zinc/78/86/98/1262788698.db2.gz XGUSMCZHRBJMLQ-ZWKOTPCHSA-N 1 3 333.520 2.846 10 0 EFAEHO C[C@@H](N[C@H]1CN(C(=O)CC[NH+](C)C)CC1(C)C)c1ccccc1F ZINC001486240674 1262839318 /nfs/dbraw/zinc/83/93/18/1262839318.db2.gz OQSGKTIOKMBQBP-PBHICJAKSA-N 1 3 335.467 2.665 10 0 EFAEHO CC[C@H](C(=O)N1C[C@H](NCc2cccnc2)C(C)(C)C1)[NH+](CC)CC ZINC001486243039 1262845967 /nfs/dbraw/zinc/84/59/67/1262845967.db2.gz PSNZWABKJLHDPQ-MSOLQXFVSA-N 1 3 346.519 2.529 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc(C)cc2)C(C)(C)C1 ZINC001486247166 1262849996 /nfs/dbraw/zinc/84/99/96/1262849996.db2.gz ZGVKIBQXIRFNMI-GOSISDBHSA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)N(CC[N@H+](C)C[C@@H]1CC[C@H]2C[C@H]2C1)C(=O)CN1CCCC1 ZINC001486379556 1262987417 /nfs/dbraw/zinc/98/74/17/1262987417.db2.gz LFXIIOKRVMDPFV-CEXWTWQISA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(CC[N@@H+](C)C[C@@H]1CC[C@H]2C[C@H]2C1)C(=O)CN1CCCC1 ZINC001486379556 1262987419 /nfs/dbraw/zinc/98/74/19/1262987419.db2.gz LFXIIOKRVMDPFV-CEXWTWQISA-N 1 3 335.536 2.687 10 0 EFAEHO CC[C@H](F)CN1CCC([C@H](C)NC(=O)CCC[NH+]2CCCC2)CC1 ZINC001486450585 1263144797 /nfs/dbraw/zinc/14/47/97/1263144797.db2.gz MISYNGUNBUJVCI-WMZOPIPTSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC001486451262 1263146582 /nfs/dbraw/zinc/14/65/82/1263146582.db2.gz YJQFIWHGLXYHRP-INIZCTEOSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)=CC[NH2+][C@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1C(F)(F)F ZINC001486452923 1263164605 /nfs/dbraw/zinc/16/46/05/1263164605.db2.gz RKHGZLFTTUGKCX-GJZGRUSLSA-N 1 3 349.441 2.662 10 0 EFAEHO CC(C)=CC[NH2+][C@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1C(F)(F)F ZINC001486452922 1263164846 /nfs/dbraw/zinc/16/48/46/1263164846.db2.gz RKHGZLFTTUGKCX-CABCVRRESA-N 1 3 349.441 2.662 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2ccc(C)cc2C)C1)N(C)C ZINC001486480316 1263216020 /nfs/dbraw/zinc/21/60/20/1263216020.db2.gz DQOGFVVJOYCUSD-CTWPCTMYSA-N 1 3 331.504 2.723 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]CCCc2ccccc2)C1 ZINC001486483255 1263222961 /nfs/dbraw/zinc/22/29/61/1263222961.db2.gz GFLYANFXZXDYSC-UHFFFAOYSA-N 1 3 331.504 2.538 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C1CC(N(C)C(=O)CN(C)C(C)C)C1 ZINC001486484216 1263224754 /nfs/dbraw/zinc/22/47/54/1263224754.db2.gz XGTHWOVUMWJIRS-AOCRQIFASA-N 1 3 331.504 2.975 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N1C[C@@H]2[C@@H](CNC(=O)CC[NH+](C)C)[C@@H]2C1 ZINC001410120480 1263522004 /nfs/dbraw/zinc/52/20/04/1263522004.db2.gz JLAGWGAPXMHADZ-PILAGYSTSA-N 1 3 349.906 2.647 10 0 EFAEHO CCCC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)CC(C)(C)C)C[C@@H]2C1 ZINC001410190670 1264258415 /nfs/dbraw/zinc/25/84/15/1264258415.db2.gz QBSKPYKTJGORFW-KSZLIROESA-N 1 3 337.552 2.981 10 0 EFAEHO CCCC[N@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)CC(C)(C)C)C[C@@H]2C1 ZINC001410190670 1264258425 /nfs/dbraw/zinc/25/84/25/1264258425.db2.gz QBSKPYKTJGORFW-KSZLIROESA-N 1 3 337.552 2.981 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2C[C@H](NC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001410242968 1264475858 /nfs/dbraw/zinc/47/58/58/1264475858.db2.gz SOBYXVUIPJSCIM-WGSAOQKQSA-N 1 3 343.515 2.718 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001410254617 1264552319 /nfs/dbraw/zinc/55/23/19/1264552319.db2.gz YHCHJKUYSFIEMM-OAHLLOKOSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001410254617 1264552325 /nfs/dbraw/zinc/55/23/25/1264552325.db2.gz YHCHJKUYSFIEMM-OAHLLOKOSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C[NH2+]Cc1cc(F)ccc1C)C1CC1)N(C)C ZINC001410315228 1264761650 /nfs/dbraw/zinc/76/16/50/1264761650.db2.gz PEYQFOPSOBWXTA-RTBURBONSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C2CC2)N(C)C(=O)CN(C)C(C)C)cc1F ZINC001410334797 1264826956 /nfs/dbraw/zinc/82/69/56/1264826956.db2.gz UTAAMKNZKMFINJ-IBGZPJMESA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)NCc1cc2ccccc2o1 ZINC001410391974 1264991794 /nfs/dbraw/zinc/99/17/94/1264991794.db2.gz YBKRRXMOQYLJNH-IIDMSEBBSA-N 1 3 343.471 2.710 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)NCc1cc2ccccc2o1 ZINC001410391974 1264991798 /nfs/dbraw/zinc/99/17/98/1264991798.db2.gz YBKRRXMOQYLJNH-IIDMSEBBSA-N 1 3 343.471 2.710 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@@H](C)CN(C)C(=O)CN1CC[C@@H](C)C1 ZINC001410427933 1265140654 /nfs/dbraw/zinc/14/06/54/1265140654.db2.gz BUFFCGOEUMTVDR-MSOLQXFVSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001410434260 1265176860 /nfs/dbraw/zinc/17/68/60/1265176860.db2.gz LANHPTWADAJTEY-HNAYVOBHSA-N 1 3 344.503 2.691 10 0 EFAEHO CCO[C@H](C[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1)CN(C)C ZINC000922754669 1266738858 /nfs/dbraw/zinc/73/88/58/1266738858.db2.gz RGFLVDFFGBWMOD-VQTJNVASSA-N 1 3 345.531 2.740 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)CN(C)C(=O)[C@@H]1CC[N@H+](C)C1 ZINC001410494581 1266913742 /nfs/dbraw/zinc/91/37/42/1266913742.db2.gz LXXNDMXXQAYQMB-HUUCEWRRSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)CN(C)C(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001410494581 1266913753 /nfs/dbraw/zinc/91/37/53/1266913753.db2.gz LXXNDMXXQAYQMB-HUUCEWRRSA-N 1 3 337.895 2.537 10 0 EFAEHO O[C@@H](C[C@H]1CCC[N@@H+]1Cc1ccnn1-c1ccncc1)c1ccco1 ZINC000824927622 1278357374 /nfs/dbraw/zinc/35/73/74/1278357374.db2.gz PPVPLSJEGLOYLA-AEFFLSMTSA-N 1 3 338.411 2.948 10 0 EFAEHO O[C@@H](C[C@H]1CCC[N@H+]1Cc1ccnn1-c1ccncc1)c1ccco1 ZINC000824927622 1278357383 /nfs/dbraw/zinc/35/73/83/1278357383.db2.gz PPVPLSJEGLOYLA-AEFFLSMTSA-N 1 3 338.411 2.948 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)c(F)c1)N(C)C ZINC001273122922 1268556588 /nfs/dbraw/zinc/55/65/88/1268556588.db2.gz JTUFVIWBBXPYEF-WBMJQRKESA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)c(F)c1)N(C)C ZINC001273122919 1268556610 /nfs/dbraw/zinc/55/66/10/1268556610.db2.gz JTUFVIWBBXPYEF-BLLLJJGKSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)c(F)c1)N(C)C ZINC001273122921 1268557092 /nfs/dbraw/zinc/55/70/92/1268557092.db2.gz JTUFVIWBBXPYEF-MLGOLLRUSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CC3CC(C)(C)C3)[C@H]2C1 ZINC001410916055 1270212763 /nfs/dbraw/zinc/21/27/63/1270212763.db2.gz MLYHUUMNOVFVON-FHWLQOOXSA-N 1 3 349.563 2.980 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@H](NCc2ccccc2Cl)C(C)(C)C1 ZINC001411003709 1270627857 /nfs/dbraw/zinc/62/78/57/1270627857.db2.gz ZEBJWARLPBFPLX-INIZCTEOSA-N 1 3 337.895 2.618 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(Cl)cc1)C(=O)C1(N(C)C)CCC1 ZINC001273419804 1270945217 /nfs/dbraw/zinc/94/52/17/1270945217.db2.gz HCMKSXUGRQTJQM-UHFFFAOYSA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)[NH2+]C[C@@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)(C)C ZINC001411215488 1272024813 /nfs/dbraw/zinc/02/48/13/1272024813.db2.gz HBOXAFQSJQLPQL-KDOFPFPSSA-N 1 3 329.504 2.728 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C)C1)C1CC[NH+](Cc2ccsc2)CC1 ZINC001411233210 1272088882 /nfs/dbraw/zinc/08/88/82/1272088882.db2.gz FNWQBDBFJTZSRH-CVEARBPZSA-N 1 3 349.544 2.807 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C)C1)C1CC[NH+](Cc2ccsc2)CC1 ZINC001411233229 1272091348 /nfs/dbraw/zinc/09/13/48/1272091348.db2.gz FNWQBDBFJTZSRH-HOTGVXAUSA-N 1 3 349.544 2.807 10 0 EFAEHO Cc1ccc(CNC2CC(N(C)C(=O)CC[NH+](C)C)C2)c(Cl)c1 ZINC001411243098 1272115416 /nfs/dbraw/zinc/11/54/16/1272115416.db2.gz AXSWXXPYQBNXST-UHFFFAOYSA-N 1 3 337.895 2.679 10 0 EFAEHO CC[C@@H](C)C[NH2+]Cc1ccc(CNC(=O)Cc2nc[nH]c2C)c(F)c1 ZINC001411256540 1272161128 /nfs/dbraw/zinc/16/11/28/1272161128.db2.gz DVYUXGLQUIJNME-CYBMUJFWSA-N 1 3 346.450 2.852 10 0 EFAEHO OC1(CNCc2ccc(Cl)cn2)CC[NH+](Cc2ccccc2)CC1 ZINC000703861755 1273007676 /nfs/dbraw/zinc/00/76/76/1273007676.db2.gz XRXZOZVVAUNQGW-UHFFFAOYSA-N 1 3 345.874 2.852 10 0 EFAEHO Cc1cc([C@@H](N)CC(=O)NC[C@H](CC(C)C)[NH+](C)C)cc(Cl)n1 ZINC000844168526 1278777121 /nfs/dbraw/zinc/77/71/21/1278777121.db2.gz FZGRAJUFVODLKZ-GJZGRUSLSA-N 1 3 340.899 2.526 10 0 EFAEHO O=C1O[C@H](CN2CCC(C[NH+]3CCCCCC3)CC2)CN1C1CC1 ZINC000844283553 1278861333 /nfs/dbraw/zinc/86/13/33/1278861333.db2.gz ZRNVSOOFEPVMRW-GOSISDBHSA-N 1 3 335.492 2.558 10 0 EFAEHO C[N@@H+]1CCCC[C@H]1CCOC(=O)CCN1CCc2ccccc2C1 ZINC000786822284 1275553794 /nfs/dbraw/zinc/55/37/94/1275553794.db2.gz VSGDLIIEYZOCHZ-IBGZPJMESA-N 1 3 330.472 2.852 10 0 EFAEHO C[N@H+]1CCCC[C@H]1CCOC(=O)CCN1CCc2ccccc2C1 ZINC000786822284 1275553808 /nfs/dbraw/zinc/55/38/08/1275553808.db2.gz VSGDLIIEYZOCHZ-IBGZPJMESA-N 1 3 330.472 2.852 10 0 EFAEHO O[C@H](CN[C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(F)c1 ZINC000817888537 1276347813 /nfs/dbraw/zinc/34/78/13/1276347813.db2.gz HNLXQXDLDUKBQU-NSHGMRRFSA-N 1 3 342.414 2.705 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@@]1(O)CCCc2ccccc21 ZINC000817913139 1276374704 /nfs/dbraw/zinc/37/47/04/1276374704.db2.gz FOMUIJGZZZMUCU-VLIAUNLRSA-N 1 3 325.456 2.723 10 0 EFAEHO Cc1cc(F)ccc1[C@H](O)CNCc1ccccc1OCC[NH+](C)C ZINC000818984809 1276563561 /nfs/dbraw/zinc/56/35/61/1276563561.db2.gz LSLNCKYSRWIWSC-LJQANCHMSA-N 1 3 346.446 2.898 10 0 EFAEHO O[C@@H](CNC[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(F)cn1 ZINC000818988465 1276564148 /nfs/dbraw/zinc/56/41/48/1276564148.db2.gz QJVLMHZECPFYQY-KSSFIOAISA-N 1 3 349.475 2.817 10 0 EFAEHO O[C@@H](CNC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(F)cn1 ZINC000818988465 1276564151 /nfs/dbraw/zinc/56/41/51/1276564151.db2.gz QJVLMHZECPFYQY-KSSFIOAISA-N 1 3 349.475 2.817 10 0 EFAEHO Cc1cc(C)cc([C@H](O)C[NH2+]C2CCN([C@@H]3CCCC[C@@H]3O)CC2)c1 ZINC000819175511 1276657991 /nfs/dbraw/zinc/65/79/91/1276657991.db2.gz ZDIHTFQCPVYBIV-QHAWAJNXSA-N 1 3 346.515 2.694 10 0 EFAEHO Cc1cc2c(cc1C)N(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)CC2 ZINC000820086376 1277017009 /nfs/dbraw/zinc/01/70/09/1277017009.db2.gz AXCDCXLDDJGJFM-KRWDZBQOSA-N 1 3 346.519 2.648 10 0 EFAEHO Cc1cc2c(cc1C)N(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)CC2 ZINC000820086376 1277017017 /nfs/dbraw/zinc/01/70/17/1277017017.db2.gz AXCDCXLDDJGJFM-KRWDZBQOSA-N 1 3 346.519 2.648 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@@H]1CN(Cc2ccccc2)CC1(C)C ZINC001410016631 1277330005 /nfs/dbraw/zinc/33/00/05/1277330005.db2.gz IREDXNZIEHRXFO-GOSISDBHSA-N 1 3 331.504 2.745 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@@H]1CN(Cc2ccccc2)CC1(C)C ZINC001410016631 1277330013 /nfs/dbraw/zinc/33/00/13/1277330013.db2.gz IREDXNZIEHRXFO-GOSISDBHSA-N 1 3 331.504 2.745 10 0 EFAEHO CN(CCCCCC[NH3+])CC(=O)N(C)[C@@H]1CCCc2ccccc21 ZINC000872155275 1287449507 /nfs/dbraw/zinc/44/95/07/1287449507.db2.gz QACSDLQPZJAPLX-LJQANCHMSA-N 1 3 331.504 2.973 10 0 EFAEHO C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)CN(C)CCCCCC[NH3+] ZINC000872155710 1287449869 /nfs/dbraw/zinc/44/98/69/1287449869.db2.gz TYMHKOVIOISEPY-AWEZNQCLSA-N 1 3 341.446 2.935 10 0 EFAEHO C[C@H](C(=O)Nc1ccc2c(c1)OCCCO2)N(C)CCCCCC[NH3+] ZINC000872154848 1287450464 /nfs/dbraw/zinc/45/04/64/1287450464.db2.gz BZIZGGUGZXBNFI-OAHLLOKOSA-N 1 3 349.475 2.626 10 0 EFAEHO [NH3+][C@@H](C[C@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1 ZINC000872157613 1287454081 /nfs/dbraw/zinc/45/40/81/1287454081.db2.gz NUKUULWZVLUDCM-QUCCMNQESA-N 1 3 343.515 2.922 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC[C@@H](O)CC(C)(C)O ZINC000872201237 1287473133 /nfs/dbraw/zinc/47/31/33/1287473133.db2.gz UDHYWYUBKUMHHA-LPHOPBHVSA-N 1 3 334.504 2.673 10 0 EFAEHO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC[C@@H](O)CC(C)(C)O ZINC000872201237 1287473136 /nfs/dbraw/zinc/47/31/36/1287473136.db2.gz UDHYWYUBKUMHHA-LPHOPBHVSA-N 1 3 334.504 2.673 10 0 EFAEHO CC(C)(O)C[C@H](O)CNCc1cccc(C[NH+]2CCCCCC2)c1 ZINC000872199096 1287471566 /nfs/dbraw/zinc/47/15/66/1287471566.db2.gz HJFHTZLFASZFMR-IBGZPJMESA-N 1 3 334.504 2.674 10 0 EFAEHO CC(C)(O)C[C@@H](O)CNCc1cccc(C[NH+]2CCCCCC2)c1 ZINC000872199097 1287472291 /nfs/dbraw/zinc/47/22/91/1287472291.db2.gz HJFHTZLFASZFMR-LJQANCHMSA-N 1 3 334.504 2.674 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+]2CCC[C@H](OC3CCC3)CC2)CC1 ZINC000872281041 1287519006 /nfs/dbraw/zinc/51/90/06/1287519006.db2.gz QLMBJHRKDABWJN-FQEVSTJZSA-N 1 3 337.552 2.826 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+]2CCC[C@H](OC3CCC3)CC2)CC1 ZINC000872281041 1287519009 /nfs/dbraw/zinc/51/90/09/1287519009.db2.gz QLMBJHRKDABWJN-FQEVSTJZSA-N 1 3 337.552 2.826 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+]2CCC[C@@H](OC3CCC3)CC2)CC1 ZINC000872281071 1287519281 /nfs/dbraw/zinc/51/92/81/1287519281.db2.gz QLMBJHRKDABWJN-HXUWFJFHSA-N 1 3 337.552 2.826 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+]2CCC[C@@H](OC3CCC3)CC2)CC1 ZINC000872281071 1287519285 /nfs/dbraw/zinc/51/92/85/1287519285.db2.gz QLMBJHRKDABWJN-HXUWFJFHSA-N 1 3 337.552 2.826 10 0 EFAEHO C[NH+](C)CC1CCC(NC(=O)C2C[C@@H](c3ccccc3)OC2=O)CC1 ZINC000809732918 1282411001 /nfs/dbraw/zinc/41/10/01/1282411001.db2.gz RNMKLWVYCJUBHQ-SYNTWQANSA-N 1 3 344.455 2.527 10 0 EFAEHO C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810196046 1283028459 /nfs/dbraw/zinc/02/84/59/1283028459.db2.gz GYIVQCZCHPMKFW-RCJHGTSTSA-N 1 3 341.515 2.682 10 0 EFAEHO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810196046 1283028471 /nfs/dbraw/zinc/02/84/71/1283028471.db2.gz GYIVQCZCHPMKFW-RCJHGTSTSA-N 1 3 341.515 2.682 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)C1 ZINC000810367994 1283158530 /nfs/dbraw/zinc/15/85/30/1283158530.db2.gz SNUTZAIJHYVPEF-APWZRJJASA-N 1 3 339.499 2.676 10 0 EFAEHO CCC[NH+](CCC)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810340775 1283160262 /nfs/dbraw/zinc/16/02/62/1283160262.db2.gz SLNGAJWYBLLNKE-SFHVURJKSA-N 1 3 329.504 2.827 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCC[C@@H]([NH+]3CCCC3)CC2)C1 ZINC000810425230 1283221003 /nfs/dbraw/zinc/22/10/03/1283221003.db2.gz HLRLLHXKPKFKLP-APWZRJJASA-N 1 3 339.499 2.676 10 0 EFAEHO CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810444880 1283246665 /nfs/dbraw/zinc/24/66/65/1283246665.db2.gz AACAFWPQAOGDQZ-YJBOKZPZSA-N 1 3 327.488 2.532 10 0 EFAEHO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810444880 1283246669 /nfs/dbraw/zinc/24/66/69/1283246669.db2.gz AACAFWPQAOGDQZ-YJBOKZPZSA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC000811525426 1284372026 /nfs/dbraw/zinc/37/20/26/1284372026.db2.gz UTMRZZNMXSJGFD-SFHVURJKSA-N 1 3 327.488 2.533 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC000811525426 1284372034 /nfs/dbraw/zinc/37/20/34/1284372034.db2.gz UTMRZZNMXSJGFD-SFHVURJKSA-N 1 3 327.488 2.533 10 0 EFAEHO C[C@@H]1C[NH2+]C[C@H]1CN1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 ZINC000903435193 1312674972 /nfs/dbraw/zinc/67/49/72/1312674972.db2.gz QXZJKZIFVFOJQQ-PBHICJAKSA-N 1 3 325.460 2.507 10 0 EFAEHO C[C@@H]1CN(C[C@@H]2CC[C@H]([NH3+])C2)CCN1C(=O)Cc1cccc(Cl)c1 ZINC000903440199 1312683904 /nfs/dbraw/zinc/68/39/04/1312683904.db2.gz WFEBRFXVDYUWPA-KYJSFNMBSA-N 1 3 349.906 2.543 10 0 EFAEHO C=COc1ccc(NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000823747150 1289436082 /nfs/dbraw/zinc/43/60/82/1289436082.db2.gz VWJLBSSIZYEOOO-HNNXBMFYSA-N 1 3 334.464 2.602 10 0 EFAEHO C=COc1ccc(NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000823747150 1289436087 /nfs/dbraw/zinc/43/60/87/1289436087.db2.gz VWJLBSSIZYEOOO-HNNXBMFYSA-N 1 3 334.464 2.602 10 0 EFAEHO COC(=O)[C@]12C[C@H]([NH3+])C[C@H]1CN([C@@H](C)c1ccc(F)c(Cl)c1)C2 ZINC000903492333 1312766068 /nfs/dbraw/zinc/76/60/68/1312766068.db2.gz AXEKZBJZRSJJMR-AKENFEQQSA-N 1 3 340.826 2.752 10 0 EFAEHO C[C@@H]1CN(CC(=O)N[C@@H](c2ccccc2)C2CCCC2)C[C@H]1CC[NH3+] ZINC000903496884 1312772346 /nfs/dbraw/zinc/77/23/46/1312772346.db2.gz ITSJULGUXXYASU-BSIFCXSSSA-N 1 3 343.515 2.951 10 0 EFAEHO C[C@@H]1CN([C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C[C@H]1CC[NH3+] ZINC000903498798 1312776469 /nfs/dbraw/zinc/77/64/69/1312776469.db2.gz FALWQPBDIBRGHD-HSMVNMDESA-N 1 3 339.842 2.501 10 0 EFAEHO Clc1ccccc1OCCN1C[C@H]2CC[C@@H](C1)[N@H+]2C1CCNCC1 ZINC000903511766 1312793632 /nfs/dbraw/zinc/79/36/32/1312793632.db2.gz ZAACXGXTCZCNQN-CALCHBBNSA-N 1 3 349.906 2.619 10 0 EFAEHO Clc1ccccc1OCCN1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CCNCC1 ZINC000903511766 1312793634 /nfs/dbraw/zinc/79/36/34/1312793634.db2.gz ZAACXGXTCZCNQN-CALCHBBNSA-N 1 3 349.906 2.619 10 0 EFAEHO Clc1ccccc1OCCN1C[C@H]2CC[C@@H](C1)N2C1CC[NH2+]CC1 ZINC000903511766 1312793637 /nfs/dbraw/zinc/79/36/37/1312793637.db2.gz ZAACXGXTCZCNQN-CALCHBBNSA-N 1 3 349.906 2.619 10 0 EFAEHO CN(C)C[C@H]1CC[N@H+](C[C@H]2CCCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000876731454 1290993862 /nfs/dbraw/zinc/99/38/62/1290993862.db2.gz RCFBPXUYFKOQEN-IAGOWNOFSA-N 1 3 339.524 2.907 10 0 EFAEHO CN(C)C[C@H]1CC[N@@H+](C[C@H]2CCCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000876731454 1290993867 /nfs/dbraw/zinc/99/38/67/1290993867.db2.gz RCFBPXUYFKOQEN-IAGOWNOFSA-N 1 3 339.524 2.907 10 0 EFAEHO CC/C=C(\C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CC2CC2)CC1 ZINC001273599499 1292123911 /nfs/dbraw/zinc/12/39/11/1292123911.db2.gz SBVIWKZZXGAASN-QGXKGWAUSA-N 1 3 345.531 2.892 10 0 EFAEHO C[N@@H+](Cc1ccccc1)C[C@@H](O)CN[C@@H]1CC=CC[C@H]1C(F)(F)F ZINC000879668634 1292224829 /nfs/dbraw/zinc/22/48/29/1292224829.db2.gz UOBASEJHPVTBPA-GVDBMIGSSA-N 1 3 342.405 2.966 10 0 EFAEHO C[N@H+](Cc1ccccc1)C[C@@H](O)CN[C@@H]1CC=CC[C@H]1C(F)(F)F ZINC000879668634 1292224837 /nfs/dbraw/zinc/22/48/37/1292224837.db2.gz UOBASEJHPVTBPA-GVDBMIGSSA-N 1 3 342.405 2.966 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCN(C(=O)OC(C)(C)C)C2CC2)[C@H]2CCC[C@H]21 ZINC000796743642 1292541748 /nfs/dbraw/zinc/54/17/48/1292541748.db2.gz OMTPIUPPJHNQSP-IXDOHACOSA-N 1 3 337.508 2.848 10 0 EFAEHO C[N@H+]1CC[C@H](NCCN(C(=O)OC(C)(C)C)C2CC2)[C@H]2CCC[C@H]21 ZINC000796743642 1292541757 /nfs/dbraw/zinc/54/17/57/1292541757.db2.gz OMTPIUPPJHNQSP-IXDOHACOSA-N 1 3 337.508 2.848 10 0 EFAEHO CCN(CC[NH2+]CC[C@H]1CCc2ccccc21)C(=O)Cc1c[nH]cn1 ZINC001273628692 1292722387 /nfs/dbraw/zinc/72/23/87/1292722387.db2.gz NCJJZOLACXCHKW-QGZVFWFLSA-N 1 3 340.471 2.510 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@H]1C[NH2+]CCCCc1ccccc1 ZINC001277824366 1313033569 /nfs/dbraw/zinc/03/35/69/1313033569.db2.gz XFGGLMIIGJKTCJ-VQTJNVASSA-N 1 3 343.515 2.684 10 0 EFAEHO CCC1([NH2+]CCCCCF)CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001273762518 1294928205 /nfs/dbraw/zinc/92/82/05/1294928205.db2.gz CUXRDFRDRMASGZ-UHFFFAOYSA-N 1 3 341.515 2.971 10 0 EFAEHO COC(=O)[C@@H]1CC[C@H]([NH2+]C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)C1 ZINC000886644309 1295085637 /nfs/dbraw/zinc/08/56/37/1295085637.db2.gz AADBCLWTFXJEDO-AITUJVMLSA-N 1 3 330.472 2.686 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]C/C=C\CNC(=O)CN(C)C2CCC2)c1 ZINC001274089990 1295450359 /nfs/dbraw/zinc/45/03/59/1295450359.db2.gz TZNMVJGVTSIHSJ-CHYADLBTSA-N 1 3 329.488 2.802 10 0 EFAEHO CC[C@H](C(=O)NC/C=C/C[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001274124712 1295485273 /nfs/dbraw/zinc/48/52/73/1295485273.db2.gz JIMREDKUUVOXES-DKRLNXSXSA-N 1 3 337.895 2.751 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C/C=C\CNC(=O)[C@H]1CCCN1C ZINC001274263513 1296047723 /nfs/dbraw/zinc/04/77/23/1296047723.db2.gz RLXOJAPGWPDUTJ-LIXSYLKWSA-N 1 3 329.488 2.666 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C\CNC(=O)[C@@H](C(C)C)N(C)C)c(C)c1 ZINC001274337638 1296067123 /nfs/dbraw/zinc/06/71/23/1296067123.db2.gz AEZNPZKCZBBLHG-QULHZPMSSA-N 1 3 331.504 2.652 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C[NH2+]C/C=C\c1ccc(Cl)cc1)N(C)C ZINC001275410492 1296271894 /nfs/dbraw/zinc/27/18/94/1296271894.db2.gz HGHXIVWBIQFKNV-GMMSVRSPSA-N 1 3 337.895 2.788 10 0 EFAEHO CC(C)CC[NH2+]CC(C)(C)CN(C)C(=O)[C@@H]1CCCN1C(C)C ZINC001275668458 1296347690 /nfs/dbraw/zinc/34/76/90/1296347690.db2.gz NLYLQAIYECGOOD-KRWDZBQOSA-N 1 3 325.541 2.980 10 0 EFAEHO COc1ccc(CN2CCC(C[NH2+][C@@H]3CCC3(OC)OC)CC2)cc1 ZINC000924857333 1296785693 /nfs/dbraw/zinc/78/56/93/1296785693.db2.gz SUNFAPDEVMHYTM-LJQANCHMSA-N 1 3 348.487 2.648 10 0 EFAEHO COc1ccc(CN2CCC(C[NH2+][C@H]3CCC3(OC)OC)CC2)cc1 ZINC000924857331 1296786175 /nfs/dbraw/zinc/78/61/75/1296786175.db2.gz SUNFAPDEVMHYTM-IBGZPJMESA-N 1 3 348.487 2.648 10 0 EFAEHO C[C@@H]1CN(C(C)(C)C[NH2+][C@@H]2CCNC[C@@H]2C2CCCC2)C[C@@H](C)O1 ZINC000925516255 1296845483 /nfs/dbraw/zinc/84/54/83/1296845483.db2.gz RABHEBLPABABQW-PSBWJHGTSA-N 1 3 337.552 2.632 10 0 EFAEHO C(C[NH2+][C@@H]1CCNC[C@@H]1C1CCCC1)Cc1nnc2n1CCCCC2 ZINC000925574629 1296857721 /nfs/dbraw/zinc/85/77/21/1296857721.db2.gz WGYKUNZZWVNGMH-QZTJIDSGSA-N 1 3 345.535 2.695 10 0 EFAEHO CCOC(=O)C1([C@H](C)N[C@H]2c3ccccc3CC[C@@H]2F)CC[NH2+]CC1 ZINC000925773028 1296879844 /nfs/dbraw/zinc/87/98/44/1296879844.db2.gz WFCPOSLHSCDIOZ-WBAXXEDZSA-N 1 3 348.462 2.923 10 0 EFAEHO Cc1cc(CC[NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)nn1C ZINC000926908290 1296973769 /nfs/dbraw/zinc/97/37/69/1296973769.db2.gz BYJVJECTCDBNLB-TYPHKJRUSA-N 1 3 338.499 2.914 10 0 EFAEHO Cc1cc(CCN[C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)nn1C ZINC000926908290 1296973777 /nfs/dbraw/zinc/97/37/77/1296973777.db2.gz BYJVJECTCDBNLB-TYPHKJRUSA-N 1 3 338.499 2.914 10 0 EFAEHO Cc1cc(CCN[C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)nn1C ZINC000926908290 1296973787 /nfs/dbraw/zinc/97/37/87/1296973787.db2.gz BYJVJECTCDBNLB-TYPHKJRUSA-N 1 3 338.499 2.914 10 0 EFAEHO COc1ccc([C@@H](C)N(C)C[C@@H](C[NH3+])Cc2cnn(C)c2C)cc1 ZINC000903877967 1313333978 /nfs/dbraw/zinc/33/39/78/1313333978.db2.gz DHWJIFJVVGIFCC-GDBMZVCRSA-N 1 3 330.476 2.548 10 0 EFAEHO COCCN(C[C@H](C[NH3+])Cc1cnn(C)c1C)[C@@H](C)c1ccccc1 ZINC000903885554 1313348517 /nfs/dbraw/zinc/34/85/17/1313348517.db2.gz LMBHLSWCBCBPED-ROUUACIJSA-N 1 3 344.503 2.556 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CCCC[C@H]2Cc2ccccc2)cnn1C ZINC000903890186 1313359314 /nfs/dbraw/zinc/35/93/14/1313359314.db2.gz ZCHPJLBVULUDHP-CTNGQTDRSA-N 1 3 340.515 2.943 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CCCC[C@H]2Cc2ccccc2)cnn1C ZINC000903890186 1313359315 /nfs/dbraw/zinc/35/93/15/1313359315.db2.gz ZCHPJLBVULUDHP-CTNGQTDRSA-N 1 3 340.515 2.943 10 0 EFAEHO COc1ccccc1[C@@H]1CCCN1C[C@@H](C[NH3+])Cc1cnn(C)c1C ZINC000903892062 1313362875 /nfs/dbraw/zinc/36/28/75/1313362875.db2.gz PHGKSMYGMIDQLX-APWZRJJASA-N 1 3 342.487 2.692 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+]2CCC[C@@H]2Cc2ccccc2C)cnn1C ZINC000903892656 1313363588 /nfs/dbraw/zinc/36/35/88/1313363588.db2.gz VSIIFRMJBMBTRX-GHTZIAJQSA-N 1 3 340.515 2.861 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+]2CCC[C@@H]2Cc2ccccc2C)cnn1C ZINC000903892656 1313363592 /nfs/dbraw/zinc/36/35/92/1313363592.db2.gz VSIIFRMJBMBTRX-GHTZIAJQSA-N 1 3 340.515 2.861 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+](CCc2ccc(F)cc2)C2CC2)cnn1C ZINC000903892682 1313363621 /nfs/dbraw/zinc/36/36/21/1313363621.db2.gz LFDLTAKVXCDIEY-QGZVFWFLSA-N 1 3 344.478 2.692 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+](CCc2ccc(F)cc2)C2CC2)cnn1C ZINC000903892682 1313363624 /nfs/dbraw/zinc/36/36/24/1313363624.db2.gz LFDLTAKVXCDIEY-QGZVFWFLSA-N 1 3 344.478 2.692 10 0 EFAEHO CCN(CC(=O)Nc1c(F)cccc1F)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903905825 1313388704 /nfs/dbraw/zinc/38/87/04/1313388704.db2.gz OOXHZDVRRFNASK-AGUYFDCRSA-N 1 3 337.414 2.756 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+](C)CC2(c3ccccc3)CC2)cnn1C ZINC000903909551 1313395120 /nfs/dbraw/zinc/39/51/20/1313395120.db2.gz FODADYNRVHRXOZ-KRWDZBQOSA-N 1 3 326.488 2.510 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+](C)CC2(c3ccccc3)CC2)cnn1C ZINC000903909551 1313395124 /nfs/dbraw/zinc/39/51/24/1313395124.db2.gz FODADYNRVHRXOZ-KRWDZBQOSA-N 1 3 326.488 2.510 10 0 EFAEHO CC[C@H]1Cc2ccccc2CN1C[C@@H](C[NH3+])Cc1cnn(C)c1C ZINC000903910592 1313397703 /nfs/dbraw/zinc/39/77/03/1313397703.db2.gz OJNQGOOBPSIESS-UZLBHIALSA-N 1 3 326.488 2.683 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CCC[C@]2(C)Cc2ccccc2)cnn1C ZINC000903914609 1313406442 /nfs/dbraw/zinc/40/64/42/1313406442.db2.gz JRTJNUNSOCVRNS-TZIWHRDSSA-N 1 3 340.515 2.943 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CCC[C@]2(C)Cc2ccccc2)cnn1C ZINC000903914609 1313406443 /nfs/dbraw/zinc/40/64/43/1313406443.db2.gz JRTJNUNSOCVRNS-TZIWHRDSSA-N 1 3 340.515 2.943 10 0 EFAEHO COC(=O)c1nc([C@@H]2CCCN2CC2C[C@H]3CC[C@@H](C2)[NH2+]3)sc1C ZINC000903915153 1313407015 /nfs/dbraw/zinc/40/70/15/1313407015.db2.gz NLKZRDGDMBCXRV-DKUMPPAJSA-N 1 3 349.500 2.906 10 0 EFAEHO COc1ccc(-n2ccc(CNCC3C[C@H]4CC[C@@H](C3)[NH2+]4)n2)cc1 ZINC000903924493 1313425792 /nfs/dbraw/zinc/42/57/92/1313425792.db2.gz DVQFCGMBFALETL-MQVJKMGUSA-N 1 3 326.444 2.501 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]([NH2+]Cc2ccsc2)C1)N1CCCCC1 ZINC001488829682 1297811680 /nfs/dbraw/zinc/81/16/80/1297811680.db2.gz ZUGQPRPAEAOFIJ-QAQDUYKDSA-N 1 3 349.544 2.997 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CNC2(c3cccc(C)c3)CCC2)cnn1C ZINC000903931807 1313438285 /nfs/dbraw/zinc/43/82/85/1313438285.db2.gz INRMTEQEAJIZQX-KRWDZBQOSA-N 1 3 326.488 2.823 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N(C)C)CC[N@@H+]1CCc1ccccc1 ZINC001489117030 1298035162 /nfs/dbraw/zinc/03/51/62/1298035162.db2.gz MMIAJEBRQYASRC-ZCNNSNEGSA-N 1 3 345.531 2.784 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N(C)C)CC[N@H+]1CCc1ccccc1 ZINC001489117030 1298035166 /nfs/dbraw/zinc/03/51/66/1298035166.db2.gz MMIAJEBRQYASRC-ZCNNSNEGSA-N 1 3 345.531 2.784 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CC[N@H+](Cc2cccc(C)c2)[C@@H]1C ZINC001489267341 1298136623 /nfs/dbraw/zinc/13/66/23/1298136623.db2.gz ILGPGHAHEHXQLS-QRQLOZEOSA-N 1 3 349.494 2.754 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CC[N@@H+](Cc2cccc(C)c2)[C@@H]1C ZINC001489267341 1298136632 /nfs/dbraw/zinc/13/66/32/1298136632.db2.gz ILGPGHAHEHXQLS-QRQLOZEOSA-N 1 3 349.494 2.754 10 0 EFAEHO Cc1cccnc1C[NH2+][C@@H]1CCCCCN(C(=O)CN(C)C(C)C)C1 ZINC001489242576 1298153797 /nfs/dbraw/zinc/15/37/97/1298153797.db2.gz IXSHPJFCIFDVFA-GOSISDBHSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1CCN(C/C=C/Cl)CC(C)(C)C1 ZINC001489349068 1298206423 /nfs/dbraw/zinc/20/64/23/1298206423.db2.gz CFKWAURQKRRQFJ-RZIFZGNASA-N 1 3 329.916 2.688 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1CCN(C/C=C/Cl)CC(C)(C)C1 ZINC001489349068 1298206431 /nfs/dbraw/zinc/20/64/31/1298206431.db2.gz CFKWAURQKRRQFJ-RZIFZGNASA-N 1 3 329.916 2.688 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CC[NH+]2CCCCC2)CCN1Cc1ccccc1 ZINC001489311505 1298208829 /nfs/dbraw/zinc/20/88/29/1298208829.db2.gz AMGKOTINBCRBIU-MJGOQNOKSA-N 1 3 329.488 2.642 10 0 EFAEHO COc1ccccc1/C=C/CN1C[C@H]2CC[C@@H](C1)[N@H+]2C1CCNCC1 ZINC000903980298 1313530842 /nfs/dbraw/zinc/53/08/42/1313530842.db2.gz NXNQLDDMRITWHE-JKOSIECOSA-N 1 3 341.499 2.609 10 0 EFAEHO COc1ccccc1/C=C/CN1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CCNCC1 ZINC000903980298 1313530844 /nfs/dbraw/zinc/53/08/44/1313530844.db2.gz NXNQLDDMRITWHE-JKOSIECOSA-N 1 3 341.499 2.609 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](C)[C@@H]2CCc3c2cccc3F)C1 ZINC001490250471 1298678921 /nfs/dbraw/zinc/67/89/21/1298678921.db2.gz LFKGRWPCLPSQFS-HNAYVOBHSA-N 1 3 347.478 2.593 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](C)[C@@H]2CCc3c2cccc3F)C1 ZINC001490250471 1298678931 /nfs/dbraw/zinc/67/89/31/1298678931.db2.gz LFKGRWPCLPSQFS-HNAYVOBHSA-N 1 3 347.478 2.593 10 0 EFAEHO Cc1ccccc1CN1CC[C@H](NC(=O)CCCC[NH+]2CCCC2)C1 ZINC001490580941 1298997641 /nfs/dbraw/zinc/99/76/41/1298997641.db2.gz RLZBFOBVTGRKOM-FQEVSTJZSA-N 1 3 343.515 2.952 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]([NH2+]CC1CC(C)(C)C1)C1CC1 ZINC001490661406 1299103224 /nfs/dbraw/zinc/10/32/24/1299103224.db2.gz MRHQITAUJLGLNI-ROUUACIJSA-N 1 3 335.536 2.780 10 0 EFAEHO CCCCC[NH2+][C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001490710069 1299120167 /nfs/dbraw/zinc/12/01/67/1299120167.db2.gz OCMFREBYYUQAMZ-QFBILLFUSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+]C[C@H]1CCCC(F)(F)C1)C1CC1 ZINC001490740006 1299177581 /nfs/dbraw/zinc/17/75/81/1299177581.db2.gz ADLOAZMNUHVQOR-GOEBONIOSA-N 1 3 345.478 2.637 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)/C=C/Sc1ccccc1 ZINC000855346086 1300923916 /nfs/dbraw/zinc/92/39/16/1300923916.db2.gz NUXDKISBMZGYIG-UKYUDJEDSA-N 1 3 335.517 2.681 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)/C=C/Sc1ccccc1 ZINC000855346086 1300923921 /nfs/dbraw/zinc/92/39/21/1300923921.db2.gz NUXDKISBMZGYIG-UKYUDJEDSA-N 1 3 335.517 2.681 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)/C=C/c1ccc(Cl)s1 ZINC000855345667 1300925009 /nfs/dbraw/zinc/92/50/09/1300925009.db2.gz FLWHCBHHWMNDKU-XOVSCCBYSA-N 1 3 343.924 2.803 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)/C=C/c1ccc(Cl)s1 ZINC000855345667 1300925015 /nfs/dbraw/zinc/92/50/15/1300925015.db2.gz FLWHCBHHWMNDKU-XOVSCCBYSA-N 1 3 343.924 2.803 10 0 EFAEHO COc1cc(CNCC2CC[NH+](C)CC2)c(Br)cc1O ZINC000113336310 1300960080 /nfs/dbraw/zinc/96/00/80/1300960080.db2.gz FLSIHFMFPBEEKZ-UHFFFAOYSA-N 1 3 343.265 2.595 10 0 EFAEHO CCOc1cc(F)cc(C[NH2+]C[C@@H](C)CN2CCN(CC)CC2)c1 ZINC000865449465 1303261525 /nfs/dbraw/zinc/26/15/25/1303261525.db2.gz VNRLYSPLFSLBEP-MRXNPFEDSA-N 1 3 337.483 2.588 10 0 EFAEHO CC[N@@H+]1CC[C@H](NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)[C@H](C)C1 ZINC000866557654 1303684447 /nfs/dbraw/zinc/68/44/47/1303684447.db2.gz CCLZSHPVNACKGW-NRSPTQNISA-N 1 3 345.531 2.516 10 0 EFAEHO CC[N@H+]1CC[C@H](NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)[C@H](C)C1 ZINC000866557654 1303684450 /nfs/dbraw/zinc/68/44/50/1303684450.db2.gz CCLZSHPVNACKGW-NRSPTQNISA-N 1 3 345.531 2.516 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]C[C@@H]2c3ccccc3CN2C)[C@H](C)C1 ZINC000866561831 1303687925 /nfs/dbraw/zinc/68/79/25/1303687925.db2.gz MIVJICVCJADRSI-JRGCBEDISA-N 1 3 345.531 2.900 10 0 EFAEHO C([NH2+]C1CCN([C@H]2CCOC2)CC1)[C@H]1CCN1C1CCCCCC1 ZINC000866562919 1303689117 /nfs/dbraw/zinc/68/91/17/1303689117.db2.gz WYSQPXXNDOCLGJ-UXHICEINSA-N 1 3 335.536 2.626 10 0 EFAEHO CC1(C)[C@@H](N)c2ccccc2N1C(=O)[C@H](C[NH3+])c1ccc(F)cc1 ZINC000867988604 1304062410 /nfs/dbraw/zinc/06/24/10/1304062410.db2.gz PPMRIYVNHHAZJY-WBVHZDCISA-N 1 3 327.403 2.693 10 0 EFAEHO O=C(NC[C@H]1CCCCN1Cc1ccccc1)[C@H]1C[C@@]12CCC[NH2+]C2 ZINC000867997114 1304066999 /nfs/dbraw/zinc/06/69/99/1304066999.db2.gz BKTCDBTZSAVZSQ-SFHLNBCPSA-N 1 3 341.499 2.547 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)CCC23CC(C2)C[NH2+]3)N(C)C)cc1 ZINC000870853922 1305628862 /nfs/dbraw/zinc/62/88/62/1305628862.db2.gz IQTKWLNXTGHCHK-IPCDKGFNSA-N 1 3 329.488 2.500 10 0 EFAEHO CCc1ccc([C@@H](CNC(=O)CCC23CC(C2)C[NH2+]3)N(C)C)cc1 ZINC000870853923 1305629109 /nfs/dbraw/zinc/62/91/09/1305629109.db2.gz IQTKWLNXTGHCHK-KGXSXCIVSA-N 1 3 329.488 2.500 10 0 EFAEHO O=C(CCC12CC(C1)C[NH2+]2)NC[C@@H](c1cccs1)N1CCCC1 ZINC000870853856 1305629419 /nfs/dbraw/zinc/62/94/19/1305629419.db2.gz FODNHCJMPOLDAZ-CSLYMUCUSA-N 1 3 333.501 2.533 10 0 EFAEHO CC1CCN([C@@H](CNC(=O)[C@]23C[C@H]2C[C@H]([NH3+])C3)c2ccccc2)CC1 ZINC000870871744 1305642754 /nfs/dbraw/zinc/64/27/54/1305642754.db2.gz LPXBFGFXUGURRJ-JKBKZWBZSA-N 1 3 341.499 2.703 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)CCC23CC(C2)C[NH2+]3)N2CCCC2)cc1 ZINC000870875556 1305645893 /nfs/dbraw/zinc/64/58/93/1305645893.db2.gz GBLIVUMMUOEASI-BIXGBWIQSA-N 1 3 341.499 2.780 10 0 EFAEHO CN(C)CCN(CCCc1ccccc1)C(=O)CCC12CC(C1)C[NH2+]2 ZINC000870892087 1305660618 /nfs/dbraw/zinc/66/06/18/1305660618.db2.gz BNJTURDBRXQDQQ-UHFFFAOYSA-N 1 3 343.515 2.542 10 0 EFAEHO CCN(C(=O)[C@]12C[C@H]1C[C@H]([NH3+])C2)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000870908259 1305673515 /nfs/dbraw/zinc/67/35/15/1305673515.db2.gz YLXABROSEDQFDY-GSFBZFRISA-N 1 3 341.499 2.798 10 0 EFAEHO CCN(C(=O)[C@]12C[C@H]1C[C@H]([NH3+])C2)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000870908261 1305673969 /nfs/dbraw/zinc/67/39/69/1305673969.db2.gz YLXABROSEDQFDY-UVPIGPOJSA-N 1 3 341.499 2.798 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+]CCC(C)(C)C)C1CC1)CC(C)(C)C ZINC001276657058 1314198849 /nfs/dbraw/zinc/19/88/49/1314198849.db2.gz URWSDWWMRIZRNO-INIZCTEOSA-N 1 3 325.541 2.885 10 0 EFAEHO O=C(NC1CC[NH+](C2CC2)CC1)c1ccc(NC2=NCCC2)cc1 ZINC000900054725 1307623676 /nfs/dbraw/zinc/62/36/76/1307623676.db2.gz UYDNUAIHJSSBHC-UHFFFAOYSA-N 1 3 326.444 2.647 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001413085927 1307646367 /nfs/dbraw/zinc/64/63/67/1307646367.db2.gz WVAJCHBFWXBBRQ-IAGOWNOFSA-N 1 3 337.533 2.759 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001413085923 1307646445 /nfs/dbraw/zinc/64/64/45/1307646445.db2.gz WVAJCHBFWXBBRQ-DLBZAZTESA-N 1 3 337.533 2.759 10 0 EFAEHO CC(C)[N@@H+]1CC[C@@H](CNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900409882 1308137386 /nfs/dbraw/zinc/13/73/86/1308137386.db2.gz LWSLNFAHVALNHJ-HNNXBMFYSA-N 1 3 328.460 2.751 10 0 EFAEHO CC(C)[N@H+]1CC[C@@H](CNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900409882 1308137392 /nfs/dbraw/zinc/13/73/92/1308137392.db2.gz LWSLNFAHVALNHJ-HNNXBMFYSA-N 1 3 328.460 2.751 10 0 EFAEHO CC[N@@H+]1CCC[C@@H](CNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900430185 1308156982 /nfs/dbraw/zinc/15/69/82/1308156982.db2.gz SGBSOGJRJYMADK-HNNXBMFYSA-N 1 3 328.460 2.753 10 0 EFAEHO CC[N@H+]1CCC[C@@H](CNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900430185 1308156985 /nfs/dbraw/zinc/15/69/85/1308156985.db2.gz SGBSOGJRJYMADK-HNNXBMFYSA-N 1 3 328.460 2.753 10 0 EFAEHO O=C(c1ccc(NC2=NCCC2)cc1)N1CC[C@H]([NH+]2CCCC2)C1 ZINC000900519409 1308249803 /nfs/dbraw/zinc/24/98/03/1308249803.db2.gz JNAKZCUDNWHOLF-KRWDZBQOSA-N 1 3 326.444 2.601 10 0 EFAEHO O=C(c1ccc(NC2=NCCC2)cc1)N1CC[C@@H]([NH+]2CCCCC2)C1 ZINC000900624440 1308426901 /nfs/dbraw/zinc/42/69/01/1308426901.db2.gz KSEIMMHDCAJRJD-GOSISDBHSA-N 1 3 340.471 2.991 10 0 EFAEHO C[NH+](C)CC1CCN(C(=O)c2ccc(NC3=NCCC3)cc2)CC1 ZINC000900687498 1308530893 /nfs/dbraw/zinc/53/08/93/1308530893.db2.gz UDRWDSUUUKFISF-UHFFFAOYSA-N 1 3 328.460 2.705 10 0 EFAEHO CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000900986047 1309120587 /nfs/dbraw/zinc/12/05/87/1309120587.db2.gz YMIBRTXKOQOIBF-MSOLQXFVSA-N 1 3 340.471 2.990 10 0 EFAEHO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000900986047 1309120590 /nfs/dbraw/zinc/12/05/90/1309120590.db2.gz YMIBRTXKOQOIBF-MSOLQXFVSA-N 1 3 340.471 2.990 10 0 EFAEHO C[C@@H]1C[N@@H+](C2CC2)C[C@@H]1NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC000901028435 1309230434 /nfs/dbraw/zinc/23/04/34/1309230434.db2.gz ZWVUYNQULLJUGM-DYVFJYSZSA-N 1 3 326.444 2.503 10 0 EFAEHO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC000901028435 1309230443 /nfs/dbraw/zinc/23/04/43/1309230443.db2.gz ZWVUYNQULLJUGM-DYVFJYSZSA-N 1 3 326.444 2.503 10 0 EFAEHO C[N@@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000901135337 1309575700 /nfs/dbraw/zinc/57/57/00/1309575700.db2.gz LTWZEUGAUBGYEI-AEFFLSMTSA-N 1 3 340.471 2.847 10 0 EFAEHO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000901135337 1309575705 /nfs/dbraw/zinc/57/57/05/1309575705.db2.gz LTWZEUGAUBGYEI-AEFFLSMTSA-N 1 3 340.471 2.847 10 0 EFAEHO CC(C)N(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccsc1 ZINC001490977267 1311147752 /nfs/dbraw/zinc/14/77/52/1311147752.db2.gz XKYXQIXHTTWDEG-ALOPSCKCSA-N 1 3 335.517 2.700 10 0 EFAEHO CC(C)N(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccsc1 ZINC001490977267 1311147754 /nfs/dbraw/zinc/14/77/54/1311147754.db2.gz XKYXQIXHTTWDEG-ALOPSCKCSA-N 1 3 335.517 2.700 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@H+](CC3CCCC3)CC[C@H]21 ZINC001490984657 1311149768 /nfs/dbraw/zinc/14/97/68/1311149768.db2.gz UTLZWGUXNUKPOP-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@@H+](CC3CCCC3)CC[C@H]21 ZINC001490984657 1311149772 /nfs/dbraw/zinc/14/97/72/1311149772.db2.gz UTLZWGUXNUKPOP-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCCC[C@H]1C[NH2+]CCC(F)(F)F ZINC001491270920 1311183477 /nfs/dbraw/zinc/18/34/77/1311183477.db2.gz KKXXIPWYLOOSRK-LSDHHAIUSA-N 1 3 349.441 2.784 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001491487040 1311192219 /nfs/dbraw/zinc/19/22/19/1311192219.db2.gz TUVFDDJOHATLOU-RDJZCZTQSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001491487040 1311192220 /nfs/dbraw/zinc/19/22/20/1311192220.db2.gz TUVFDDJOHATLOU-RDJZCZTQSA-N 1 3 335.467 2.603 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1C[C@H](C[NH2+]CCc2ccccc2)C1 ZINC001277092662 1311602208 /nfs/dbraw/zinc/60/22/08/1311602208.db2.gz IWSUURAHYYLRJR-HNBVOPMISA-N 1 3 343.515 2.586 10 0 EFAEHO C[C@@H](CCC[NH2+]C/C=C\Cl)NC(=O)C(C)(C)N1CCCCC1 ZINC001277186214 1311771150 /nfs/dbraw/zinc/77/11/50/1311771150.db2.gz DESNXQMUNPFQJB-WWRUEGTHSA-N 1 3 329.916 2.878 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CCC[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001277299512 1311947383 /nfs/dbraw/zinc/94/73/83/1311947383.db2.gz UYGKPQGWSLFOJC-DLBZAZTESA-N 1 3 349.494 2.850 10 0 EFAEHO c1ccc(CCN2CC[C@H](C[NH2+][C@@H]3CC[C@@H]4[C@H]5OCC[C@H]5[C@@H]43)C2)cc1 ZINC000902790399 1312110179 /nfs/dbraw/zinc/11/01/79/1312110179.db2.gz QGHTUULUTQHTPA-VFPNFYTQSA-N 1 3 340.511 2.954 10 0 EFAEHO CN1CCC(O)(C[NH2+][C@@H](CCc2ccccc2)c2cccnc2)CC1 ZINC000902815335 1312128794 /nfs/dbraw/zinc/12/87/94/1312128794.db2.gz UUMMPROBXTWUMQ-FQEVSTJZSA-N 1 3 339.483 2.802 10 0 EFAEHO NC(=O)CC1CC([NH2+][C@@H]2CCC[C@@H]3CN(Cc4ccccc4)C[C@H]32)C1 ZINC000903258926 1312513705 /nfs/dbraw/zinc/51/37/05/1312513705.db2.gz DJFXFDOEQFYBAA-DRRJLQACSA-N 1 3 341.499 2.531 10 0 EFAEHO NC(=O)CC1CC([NH2+][C@@H]2CCC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1 ZINC000903258929 1312514049 /nfs/dbraw/zinc/51/40/49/1312514049.db2.gz DJFXFDOEQFYBAA-ZSDFWYKJSA-N 1 3 341.499 2.531 10 0 EFAEHO Cc1ccc(CN[C@@H]2C[C@H](C)N(C(=O)CCCC[NH+](C)C)C2)c(C)n1 ZINC001278417707 1314537721 /nfs/dbraw/zinc/53/77/21/1314537721.db2.gz WJNOUCCYJYSNPY-QFBILLFUSA-N 1 3 346.519 2.509 10 0 EFAEHO Cc1ccc(CN[C@@H]2C[C@@H](C)N(C(=O)CCCC[NH+](C)C)C2)c(C)n1 ZINC001278417708 1314537891 /nfs/dbraw/zinc/53/78/91/1314537891.db2.gz WJNOUCCYJYSNPY-VQIMIIECSA-N 1 3 346.519 2.509 10 0 EFAEHO CCC/C=C/CC[N@H+]1C[C@@H]2C(CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001276701718 1314553353 /nfs/dbraw/zinc/55/33/53/1314553353.db2.gz WCACZPZZJNVTRM-BQPQQLJHSA-N 1 3 347.547 2.901 10 0 EFAEHO CCC/C=C/CC[N@@H+]1C[C@@H]2C(CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001276701718 1314553357 /nfs/dbraw/zinc/55/33/57/1314553357.db2.gz WCACZPZZJNVTRM-BQPQQLJHSA-N 1 3 347.547 2.901 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@](C)(C[NH2+]C/C=C/c2ccccc2)C1 ZINC001278573814 1315217001 /nfs/dbraw/zinc/21/70/01/1315217001.db2.gz YTOIQFYBBWPKDX-OGECGYFKSA-N 1 3 343.515 2.870 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]CCc1ccccc1)C(C)(C)C)N(C)C ZINC001278973806 1316005941 /nfs/dbraw/zinc/00/59/41/1316005941.db2.gz YTTIVCIFUPVJPN-MSOLQXFVSA-N 1 3 333.520 2.690 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H](NC(=O)CN(C)C(C)C)C(C)(C)C)cc1 ZINC001279034880 1316086544 /nfs/dbraw/zinc/08/65/44/1316086544.db2.gz PKZCFRPDTCLLBK-IBGZPJMESA-N 1 3 347.547 2.998 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H](C)[C@H]2CCC[NH2+]CCCF)C1 ZINC001264019891 1316581358 /nfs/dbraw/zinc/58/13/58/1316581358.db2.gz MRTCDMDKKBQQSR-KZNAEPCWSA-N 1 3 341.515 2.685 10 0 EFAEHO CC/C=C/CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCC[N@@H+](CCC)C1 ZINC001264368510 1316606476 /nfs/dbraw/zinc/60/64/76/1316606476.db2.gz GSYCODHNCDKHEV-LXORQPIJSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCC[N@H+](CCC)C1 ZINC001264368510 1316606479 /nfs/dbraw/zinc/60/64/79/1316606479.db2.gz GSYCODHNCDKHEV-LXORQPIJSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@H](C(=O)N1CCCCC[C@H]([NH2+]CCCCCF)C1)N(C)C ZINC001264683978 1316655816 /nfs/dbraw/zinc/65/58/16/1316655816.db2.gz PINJJFCTZVCKLJ-DLBZAZTESA-N 1 3 329.504 2.827 10 0 EFAEHO [NH3+]CC1CCC(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CC1 ZINC000390764260 1316673938 /nfs/dbraw/zinc/67/39/38/1316673938.db2.gz CXKGFBXVIUQYTC-KVZIAJEVSA-N 1 3 329.488 2.532 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)CCCNC(=O)C2(N(C)C)CCC2)c1 ZINC001264995198 1316683096 /nfs/dbraw/zinc/68/30/96/1316683096.db2.gz XMDAGZJUICLCOK-MRXNPFEDSA-N 1 3 347.503 2.679 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)CCCNC(=O)C2(N(C)C)CCC2)c1 ZINC001264995198 1316683097 /nfs/dbraw/zinc/68/30/97/1316683097.db2.gz XMDAGZJUICLCOK-MRXNPFEDSA-N 1 3 347.503 2.679 10 0 EFAEHO CN(CCCNC(=O)[C@H]1CCC[N@@H+]1C1CCCC1)CCC(F)(F)F ZINC001264995236 1316683394 /nfs/dbraw/zinc/68/33/94/1316683394.db2.gz YHTGJDMMDFHUHL-OAHLLOKOSA-N 1 3 349.441 2.784 10 0 EFAEHO CN(CCCNC(=O)[C@H]1CCC[N@H+]1C1CCCC1)CCC(F)(F)F ZINC001264995236 1316683398 /nfs/dbraw/zinc/68/33/98/1316683398.db2.gz YHTGJDMMDFHUHL-OAHLLOKOSA-N 1 3 349.441 2.784 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](C)[C@H](C)c1cccc(C)c1 ZINC001265061735 1316707132 /nfs/dbraw/zinc/70/71/32/1316707132.db2.gz AZCCPFDRWSORJG-MRXNPFEDSA-N 1 3 328.460 2.768 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](C)[C@H](C)c1cccc(C)c1 ZINC001265061735 1316707134 /nfs/dbraw/zinc/70/71/34/1316707134.db2.gz AZCCPFDRWSORJG-MRXNPFEDSA-N 1 3 328.460 2.768 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001265137294 1316733592 /nfs/dbraw/zinc/73/35/92/1316733592.db2.gz QXIADFGPAWYSHJ-KVQZDWTESA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001265137294 1316733595 /nfs/dbraw/zinc/73/35/95/1316733595.db2.gz QXIADFGPAWYSHJ-KVQZDWTESA-N 1 3 327.900 2.584 10 0 EFAEHO CN(CC(=O)N[C@H]1CC12CC[NH+](CCCCCF)CC2)C1CCC1 ZINC001265328361 1316783197 /nfs/dbraw/zinc/78/31/97/1316783197.db2.gz ZKGAWOWKTKEOLP-KRWDZBQOSA-N 1 3 339.499 2.581 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC12CC[NH+](CC1=CCCCC1)CC2)N(C)C ZINC001265334557 1316785147 /nfs/dbraw/zinc/78/51/47/1316785147.db2.gz URCDXMNVTPBDKU-QZTJIDSGSA-N 1 3 333.520 2.798 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC12CC[NH+](CC1=CCCCC1)CC2)N(C)C ZINC001265334556 1316785238 /nfs/dbraw/zinc/78/52/38/1316785238.db2.gz URCDXMNVTPBDKU-MSOLQXFVSA-N 1 3 333.520 2.798 10 0 EFAEHO CC/C=C\CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[NH+]1CCCCC1 ZINC001265415976 1316802748 /nfs/dbraw/zinc/80/27/48/1316802748.db2.gz JDYNSVFCBMMXNG-FANKGXDISA-N 1 3 333.520 2.894 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@@H]1C[NH2+]CCc1ccccc1F)N(C)C ZINC001265681437 1316852672 /nfs/dbraw/zinc/85/26/72/1316852672.db2.gz ADILGVXAVQXSOD-MJGOQNOKSA-N 1 3 349.494 2.679 10 0 EFAEHO CCCCCC[NH2+][C@@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001265823900 1316884799 /nfs/dbraw/zinc/88/47/99/1316884799.db2.gz OEQIGAJTOGITGK-YJBOKZPZSA-N 1 3 329.504 2.874 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCNC(=O)C2(N(C)C)CCC2)cc1F ZINC001265863067 1316895940 /nfs/dbraw/zinc/89/59/40/1316895940.db2.gz RDVCDCJLDUSGCW-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCNC(=O)C2(N(C)C)CCC2)cc1F ZINC001265863067 1316895943 /nfs/dbraw/zinc/89/59/43/1316895943.db2.gz RDVCDCJLDUSGCW-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C)c(C)c1 ZINC001265866373 1316897434 /nfs/dbraw/zinc/89/74/34/1316897434.db2.gz RHIOCKQGNZQINA-IBGZPJMESA-N 1 3 333.520 2.828 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C)c(C)c1 ZINC001265866373 1316897435 /nfs/dbraw/zinc/89/74/35/1316897435.db2.gz RHIOCKQGNZQINA-IBGZPJMESA-N 1 3 333.520 2.828 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H]([NH2+]CCCCc2ccccc2)C1)N(C)C ZINC001265941604 1316922222 /nfs/dbraw/zinc/92/22/22/1316922222.db2.gz DPLDIEKMGZVRRE-PMACEKPBSA-N 1 3 345.531 2.786 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001265954152 1316926845 /nfs/dbraw/zinc/92/68/45/1316926845.db2.gz KYHBCOPOBGCHQT-HUUCEWRRSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001265954152 1316926848 /nfs/dbraw/zinc/92/68/48/1316926848.db2.gz KYHBCOPOBGCHQT-HUUCEWRRSA-N 1 3 333.467 2.590 10 0 EFAEHO CN(CCCNC(=O)[C@H]1CCC[C@H]([NH+](C)C)C1)Cc1ccsc1 ZINC001265954794 1316927699 /nfs/dbraw/zinc/92/76/99/1316927699.db2.gz WLBIRHRTTBHXHZ-IRXDYDNUSA-N 1 3 337.533 2.807 10 0 EFAEHO CCCC[N@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001266158977 1317109122 /nfs/dbraw/zinc/10/91/22/1317109122.db2.gz AKPHAZGBMDFMKK-IBGZPJMESA-N 1 3 341.515 2.970 10 0 EFAEHO CCCC[N@@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001266158977 1317109129 /nfs/dbraw/zinc/10/91/29/1317109129.db2.gz AKPHAZGBMDFMKK-IBGZPJMESA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1Cc1cccnc1)N(C)C ZINC001266241015 1317190486 /nfs/dbraw/zinc/19/04/86/1317190486.db2.gz IPENUEZIKYCTRT-MOPGFXCFSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@@H]1CCC[N@H+]1Cc1cccnc1)N(C)C ZINC001266241015 1317190489 /nfs/dbraw/zinc/19/04/89/1317190489.db2.gz IPENUEZIKYCTRT-MOPGFXCFSA-N 1 3 346.519 2.529 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC([NH2+]CCCc2ccc(C)cc2)C1)N(C)C ZINC001279287990 1317225932 /nfs/dbraw/zinc/22/59/32/1317225932.db2.gz GCYVTRMKMYEFJL-MHJFOBGBSA-N 1 3 345.531 2.847 10 0 EFAEHO CC(C)CCC[NH2+]C1CC(N(C)C(=O)CN(C)CC(C)(C)C)C1 ZINC001279288584 1317225990 /nfs/dbraw/zinc/22/59/90/1317225990.db2.gz VYULWOHYRCOLQE-UHFFFAOYSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CCC3=CCCCC3)C[C@@H]2C1 ZINC001279416765 1317261402 /nfs/dbraw/zinc/26/14/02/1317261402.db2.gz ZGNHQDJZPYZKTN-KDURUIRLSA-N 1 3 333.520 2.607 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CCC3=CCCCC3)C[C@@H]2C1 ZINC001279416765 1317261409 /nfs/dbraw/zinc/26/14/09/1317261409.db2.gz ZGNHQDJZPYZKTN-KDURUIRLSA-N 1 3 333.520 2.607 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+]([C@@H]2CCc3ccccc32)CC1)N(C)C ZINC001279582163 1317311713 /nfs/dbraw/zinc/31/17/13/1317311713.db2.gz LPGGHERYEBDDNG-WOJBJXKFSA-N 1 3 341.499 2.762 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+]([C@@H]2CCc3ccccc32)CC1)N(C)C ZINC001279582163 1317311721 /nfs/dbraw/zinc/31/17/21/1317311721.db2.gz LPGGHERYEBDDNG-WOJBJXKFSA-N 1 3 341.499 2.762 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1=CCN([C@@H]2CCc3ccc(F)cc32)CC1 ZINC001279629220 1317338380 /nfs/dbraw/zinc/33/83/80/1317338380.db2.gz UMAATUWLYBMIBL-LJQANCHMSA-N 1 3 345.462 2.513 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1=CC[N@H+](CC2CCCCCC2)CC1 ZINC001279675616 1317354800 /nfs/dbraw/zinc/35/48/00/1317354800.db2.gz IJSYSOPXISHBFL-UHFFFAOYSA-N 1 3 344.503 2.979 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1=CC[N@@H+](CC2CCCCCC2)CC1 ZINC001279675616 1317354807 /nfs/dbraw/zinc/35/48/07/1317354807.db2.gz IJSYSOPXISHBFL-UHFFFAOYSA-N 1 3 344.503 2.979 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@H+](CCCc2ccccc2)CC1 ZINC001279695228 1317364405 /nfs/dbraw/zinc/36/44/05/1317364405.db2.gz JXYVJXUIVZDYDE-UHFFFAOYSA-N 1 3 343.515 2.708 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@@H+](CCCc2ccccc2)CC1 ZINC001279695228 1317364414 /nfs/dbraw/zinc/36/44/14/1317364414.db2.gz JXYVJXUIVZDYDE-UHFFFAOYSA-N 1 3 343.515 2.708 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+]Cc2ccc(F)cc2C)C1 ZINC001280274365 1317493753 /nfs/dbraw/zinc/49/37/53/1317493753.db2.gz ORZOKVGHNNZFIY-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2CC[C@H](C[NH2+]CCCF)CC2)c1 ZINC001280381699 1317535300 /nfs/dbraw/zinc/53/53/00/1317535300.db2.gz VOCZKKIAYUVCGH-RUCARUNLSA-N 1 3 349.494 2.986 10 0 EFAEHO CCC/C=C/CC[NH+]1CCC2(CN(C(=O)[C@@H](CC)N(C)C)C2)CC1 ZINC001280394785 1317541168 /nfs/dbraw/zinc/54/11/68/1317541168.db2.gz YSPKFTOSUMQULX-GFOMBABLSA-N 1 3 335.536 2.997 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@]2(CCN(C/C=C\Cl)C2)C1 ZINC001281098260 1318012707 /nfs/dbraw/zinc/01/27/07/1318012707.db2.gz CQUPCWSSUOHAAE-OEPRFQHASA-N 1 3 341.927 2.785 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)CC[N@@H+]1CCCCCF ZINC001281664327 1318529424 /nfs/dbraw/zinc/52/94/24/1318529424.db2.gz KLFPEZQKOKDKGG-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)CC[N@H+]1CCCCCF ZINC001281664327 1318529430 /nfs/dbraw/zinc/52/94/30/1318529430.db2.gz KLFPEZQKOKDKGG-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H](C(C)C)[NH+](C)C ZINC001281912212 1318620929 /nfs/dbraw/zinc/62/09/29/1318620929.db2.gz HFQYMECRIGKTBN-VAMGGRTRSA-N 1 3 343.515 2.911 10 0 EFAEHO CCC/C=C\CC[N@H+]1C[C@@H]2C(CNC(=O)[C@@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001282858982 1319165160 /nfs/dbraw/zinc/16/51/60/1319165160.db2.gz ONJWONNJLOMMOZ-FBWGOHPASA-N 1 3 347.547 2.900 10 0 EFAEHO CCC/C=C\CC[N@@H+]1C[C@@H]2C(CNC(=O)[C@@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001282858982 1319165167 /nfs/dbraw/zinc/16/51/67/1319165167.db2.gz ONJWONNJLOMMOZ-FBWGOHPASA-N 1 3 347.547 2.900 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@@]2(C)CN(C(=O)[C@H](CC)N(C)C)C[C@@]2(C)C1 ZINC001282992862 1319245153 /nfs/dbraw/zinc/24/51/53/1319245153.db2.gz QQHXPDCVCDESNN-SGXGJBTESA-N 1 3 335.536 2.853 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@@]2(C)CN(C(=O)[C@H](CC)N(C)C)C[C@@]2(C)C1 ZINC001282992862 1319245160 /nfs/dbraw/zinc/24/51/60/1319245160.db2.gz QQHXPDCVCDESNN-SGXGJBTESA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CCC2CCCC2)C1 ZINC001283042372 1319280887 /nfs/dbraw/zinc/28/08/87/1319280887.db2.gz WVQORMQRZSNMAQ-GUDVDZBRSA-N 1 3 335.536 2.924 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H](C[NH2+]C/C=C/c3ccccc3)C2)CCC1 ZINC001283051371 1319288768 /nfs/dbraw/zinc/28/87/68/1319288768.db2.gz IMLZIULQRZLCBG-UBEPZTMESA-N 1 3 341.499 2.669 10 0 EFAEHO CCCC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN3CCC(C)CC3)C[C@H]21 ZINC001284095292 1320190559 /nfs/dbraw/zinc/19/05/59/1320190559.db2.gz FSRYIDGJSDGGMD-IPMKNSEASA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@@H](C[NH2+]CCc2ccccc2F)C1 ZINC001284242547 1320283202 /nfs/dbraw/zinc/28/32/02/1320283202.db2.gz FENQNYFEHVSSJZ-AEFFLSMTSA-N 1 3 349.494 2.583 10 0 EFAEHO CC(C)[C@@H](C(=O)N1C[C@@H]([NH2+]CCCC2CCC2)C(C)(C)C1)N(C)C ZINC001284347372 1320329871 /nfs/dbraw/zinc/32/98/71/1320329871.db2.gz MUIIDBAWDGVHKF-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C[NH2+]CCCF)C(C)(C)C)N1CCCCC1 ZINC001284652264 1320458087 /nfs/dbraw/zinc/45/80/87/1320458087.db2.gz HCFSMINMKUDZBP-SJORKVTESA-N 1 3 343.531 2.977 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC=C(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001284921396 1320597420 /nfs/dbraw/zinc/59/74/20/1320597420.db2.gz VFRIKHXGYGBIEZ-UHFFFAOYSA-N 1 3 341.499 2.728 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC=C(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001284921396 1320597423 /nfs/dbraw/zinc/59/74/23/1320597423.db2.gz VFRIKHXGYGBIEZ-UHFFFAOYSA-N 1 3 341.499 2.728 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1=CC[N@H+](CCC2CCCC2)CC1)N(C)C ZINC001284927420 1320599310 /nfs/dbraw/zinc/59/93/10/1320599310.db2.gz DBAVHPQTLDWJHQ-IBGZPJMESA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1=CC[N@@H+](CCC2CCCC2)CC1)N(C)C ZINC001284927420 1320599314 /nfs/dbraw/zinc/59/93/14/1320599314.db2.gz DBAVHPQTLDWJHQ-IBGZPJMESA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@H]([NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001316637673 1320746718 /nfs/dbraw/zinc/74/67/18/1320746718.db2.gz PHMMQWNJZSKAOF-BRWVUGGUSA-N 1 3 325.541 2.883 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]CCc1cccs1 ZINC001319593628 1328923984 /nfs/dbraw/zinc/92/39/84/1328923984.db2.gz OWAACXJEMQCHFV-RDJZCZTQSA-N 1 3 337.533 2.602 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+]C/C=C\Cl)C2CCCCC2)CCC1 ZINC001319654438 1328939598 /nfs/dbraw/zinc/93/95/98/1328939598.db2.gz FSOKPJWPSMUTRY-JQPKSGMCSA-N 1 3 341.927 2.878 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H](C[NH2+]CCF)C2CCCCC2)c1 ZINC001319668778 1328945453 /nfs/dbraw/zinc/94/54/53/1328945453.db2.gz LIYVDBXCURJNMW-IBGZPJMESA-N 1 3 349.494 2.986 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@H]1CC[NH2+]CCc1ccccc1 ZINC001319770556 1328983995 /nfs/dbraw/zinc/98/39/95/1328983995.db2.gz UCDDBPXAURTCJR-VQTJNVASSA-N 1 3 343.515 2.684 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@@H]1CC[NH2+]Cc1cnccc1C)N(C)C ZINC001319789007 1328989994 /nfs/dbraw/zinc/98/99/94/1328989994.db2.gz VYDHPTIGJUYCFG-MOPGFXCFSA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@H]1CCCN(C(=O)CCCC[NH+](C)C)[C@H]1CNCc1ccccn1 ZINC001319862554 1329018967 /nfs/dbraw/zinc/01/89/67/1329018967.db2.gz GVWKFEABRRRCMR-HKUYNNGSSA-N 1 3 346.519 2.530 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)[C@@H]2CCCC[N@@H+]2C(C)C)c1 ZINC001491600738 1323739882 /nfs/dbraw/zinc/73/98/82/1323739882.db2.gz GZGSNWHHPNMJCF-LPHOPBHVSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)[C@@H]2CCCC[N@H+]2C(C)C)c1 ZINC001491600738 1323739887 /nfs/dbraw/zinc/73/98/87/1323739887.db2.gz GZGSNWHHPNMJCF-LPHOPBHVSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@H](CNC(=O)c1cccc(CN(C)C)c1)[NH2+]Cc1ccsc1 ZINC001491681028 1323785948 /nfs/dbraw/zinc/78/59/48/1323785948.db2.gz AZZFEHIOSBGJOY-CQSZACIVSA-N 1 3 331.485 2.718 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NC1c2ccccc2-c2ccccc21 ZINC001491674230 1323821840 /nfs/dbraw/zinc/82/18/40/1323821840.db2.gz SLHBTDJVLFSLNG-JKSUJKDBSA-N 1 3 349.478 2.802 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NC1c2ccccc2-c2ccccc21 ZINC001491674230 1323821844 /nfs/dbraw/zinc/82/18/44/1323821844.db2.gz SLHBTDJVLFSLNG-JKSUJKDBSA-N 1 3 349.478 2.802 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](C[NH2+]CCCc2ccccc2)C1)N(C)C ZINC001491833260 1323927352 /nfs/dbraw/zinc/92/73/52/1323927352.db2.gz MVHZFGODUQJRLF-VQTJNVASSA-N 1 3 345.531 2.644 10 0 EFAEHO CCCCC[NH2+]C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001491856242 1323950735 /nfs/dbraw/zinc/95/07/35/1323950735.db2.gz PMTORPKBCYKNRC-GOSISDBHSA-N 1 3 331.504 2.990 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+][C@@H](C)c2ccccc2F)C1 ZINC001491857383 1323953151 /nfs/dbraw/zinc/95/31/51/1323953151.db2.gz ZPPJMEKCDZPIHL-JKSUJKDBSA-N 1 3 335.467 2.665 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C)nc2C)C1 ZINC001491894756 1324004499 /nfs/dbraw/zinc/00/44/99/1324004499.db2.gz RITSQFSCPNUUED-RTBURBONSA-N 1 3 346.519 2.557 10 0 EFAEHO CN(C/C=C/c1ccccc1)[C@H]1CCCN(C(=O)CC[NH+](C)C)C1 ZINC001491946163 1324062513 /nfs/dbraw/zinc/06/25/13/1324062513.db2.gz APEVLEDRYWEJOA-SSVWKNEZSA-N 1 3 329.488 2.574 10 0 EFAEHO CN(C/C=C/c1ccccc1)[C@@H]1CCCN(C(=O)CC[NH+](C)C)C1 ZINC001491946161 1324062604 /nfs/dbraw/zinc/06/26/04/1324062604.db2.gz APEVLEDRYWEJOA-BQHJZSHBSA-N 1 3 329.488 2.574 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccc2cc[nH]c2c1)NC(=O)CN(C)C1CCC1 ZINC001320444552 1329132307 /nfs/dbraw/zinc/13/23/07/1329132307.db2.gz AGMKSDSKPGYCIQ-HNNXBMFYSA-N 1 3 342.487 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC001492129004 1324235926 /nfs/dbraw/zinc/23/59/26/1324235926.db2.gz LCSHOISINWLQSK-KGLIPLIRSA-N 1 3 341.446 2.850 10 0 EFAEHO C[C@H](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]Cc1ccccc1 ZINC001492084666 1324245286 /nfs/dbraw/zinc/24/52/86/1324245286.db2.gz CCOIGSYVFHUAKU-UZLBHIALSA-N 1 3 349.494 2.884 10 0 EFAEHO CCc1ccccc1CCN(C)CCNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC ZINC001492257434 1324382714 /nfs/dbraw/zinc/38/27/14/1324382714.db2.gz QTYFFGNYHMRZGK-VQTJNVASSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CCN(C)CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC ZINC001492257434 1324382720 /nfs/dbraw/zinc/38/27/20/1324382720.db2.gz QTYFFGNYHMRZGK-VQTJNVASSA-N 1 3 345.531 2.570 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(C)CCNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001492286405 1324401647 /nfs/dbraw/zinc/40/16/47/1324401647.db2.gz MMBVVJXYQBVQOD-QAPCUYQASA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(C)CCNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001492286405 1324401654 /nfs/dbraw/zinc/40/16/54/1324401654.db2.gz MMBVVJXYQBVQOD-QAPCUYQASA-N 1 3 335.467 2.809 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)c1 ZINC001492303295 1324406877 /nfs/dbraw/zinc/40/68/77/1324406877.db2.gz JRGCRAITEPLSMU-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)c1 ZINC001492303295 1324406880 /nfs/dbraw/zinc/40/68/80/1324406880.db2.gz JRGCRAITEPLSMU-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO C[C@H](c1ccccc1)N(C)CCNC(=O)C12CCC[NH+](CCC1)C2 ZINC001492298289 1324439371 /nfs/dbraw/zinc/43/93/71/1324439371.db2.gz BHCQIWFGDRWDES-QGZVFWFLSA-N 1 3 329.488 2.672 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccccc1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001320547253 1329159182 /nfs/dbraw/zinc/15/91/82/1329159182.db2.gz DEJLZJDAPZFFCI-OXQOHEQNSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccccc1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001320547254 1329159404 /nfs/dbraw/zinc/15/94/04/1329159404.db2.gz DEJLZJDAPZFFCI-UZLBHIALSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)[C@H]1CC[NH2+]CCF ZINC001316683443 1324568967 /nfs/dbraw/zinc/56/89/67/1324568967.db2.gz DNAOEPIMQDYXMX-LPHOPBHVSA-N 1 3 349.494 2.938 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@H+](C)[C@H]1CCc2c1cccc2F)N(C)C ZINC001316846430 1324684740 /nfs/dbraw/zinc/68/47/40/1324684740.db2.gz FWIDCTBIFVLTOX-RBUKOAKNSA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@@H+](C)[C@H]1CCc2c1cccc2F)N(C)C ZINC001316846430 1324684745 /nfs/dbraw/zinc/68/47/45/1324684745.db2.gz FWIDCTBIFVLTOX-RBUKOAKNSA-N 1 3 349.494 2.837 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CC[NH2+]Cc1ccccc1C1CC1 ZINC001320623534 1329179818 /nfs/dbraw/zinc/17/98/18/1329179818.db2.gz VBXATLVSRWVTBD-CQSZACIVSA-N 1 3 340.471 2.823 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](C)Cc1ccccc1C ZINC001316870541 1325239565 /nfs/dbraw/zinc/23/95/65/1325239565.db2.gz PZMQFDHEQKFSRB-LJQANCHMSA-N 1 3 331.504 2.808 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](C)Cc1ccccc1C ZINC001316870541 1325239572 /nfs/dbraw/zinc/23/95/72/1325239572.db2.gz PZMQFDHEQKFSRB-LJQANCHMSA-N 1 3 331.504 2.808 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](CC)Cc1cccnc1C ZINC001316910679 1325327630 /nfs/dbraw/zinc/32/76/30/1325327630.db2.gz GGIYPNAIXAPNPB-LJQANCHMSA-N 1 3 346.519 2.593 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](CC)Cc1cccnc1C ZINC001316910679 1325327639 /nfs/dbraw/zinc/32/76/39/1325327639.db2.gz GGIYPNAIXAPNPB-LJQANCHMSA-N 1 3 346.519 2.593 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NCCCN(Cc2ccsc2)C2CC2)CC[N@@H+]1C ZINC001316917149 1325345462 /nfs/dbraw/zinc/34/54/62/1325345462.db2.gz ZUEVCMHTZQTEKD-RHSMWYFYSA-N 1 3 335.517 2.559 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NCCCN(Cc2ccsc2)C2CC2)CC[N@H+]1C ZINC001316917149 1325345471 /nfs/dbraw/zinc/34/54/71/1325345471.db2.gz ZUEVCMHTZQTEKD-RHSMWYFYSA-N 1 3 335.517 2.559 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H]([NH2+]CC/C=C/c3ccccc3)C2)C1 ZINC001317062643 1325534020 /nfs/dbraw/zinc/53/40/20/1325534020.db2.gz OECDQTVPGROBFJ-JAZSWGADSA-N 1 3 341.499 2.622 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc(C(F)F)c1)C(=O)[C@H]1CCCN1C ZINC001320812439 1329305735 /nfs/dbraw/zinc/30/57/35/1329305735.db2.gz ZIUVFZTXBSCEKG-MRXNPFEDSA-N 1 3 339.430 2.657 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(C)sc1C)C(=O)CN1CC[C@H](C)C1 ZINC001320841483 1329308879 /nfs/dbraw/zinc/30/88/79/1329308879.db2.gz YRRGHRKOSJWNRL-AWEZNQCLSA-N 1 3 337.533 2.645 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(Cl)s1)C(=O)CN(C)C(C)C ZINC001320927697 1329320564 /nfs/dbraw/zinc/32/05/64/1329320564.db2.gz BSZFERBMEIZYCT-UHFFFAOYSA-N 1 3 331.913 2.680 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC/C=C\CNCc1csc(C)c1 ZINC001321086139 1329341379 /nfs/dbraw/zinc/34/13/79/1329341379.db2.gz YUTSLCZOEDVNJN-CHYADLBTSA-N 1 3 335.517 2.693 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC/C=C\CNCc1csc(C)c1 ZINC001321086139 1329341382 /nfs/dbraw/zinc/34/13/82/1329341382.db2.gz YUTSLCZOEDVNJN-CHYADLBTSA-N 1 3 335.517 2.693 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]C/C=C\CNC(=O)C1(N(C)C)CCC1 ZINC001321092501 1329341860 /nfs/dbraw/zinc/34/18/60/1329341860.db2.gz ROULJJSKULOZDR-ZPUOCTKUSA-N 1 3 329.488 2.802 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C/CNC(=O)CN(C)C2CCC2)c(C)c1 ZINC001321094870 1329342288 /nfs/dbraw/zinc/34/22/88/1329342288.db2.gz CTVKVYVVUPIIGE-SNAWJCMRSA-N 1 3 329.488 2.550 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C/C=C/CNC(=O)CN(C)C1CCC1 ZINC001321097299 1329342869 /nfs/dbraw/zinc/34/28/69/1329342869.db2.gz VJTJQQVVICDZME-SNAWJCMRSA-N 1 3 329.488 2.550 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)NC/C=C/CNCCC(F)(F)F ZINC001321123183 1329345962 /nfs/dbraw/zinc/34/59/62/1329345962.db2.gz AEENLMNKWNNVLG-VOTSOKGWSA-N 1 3 349.441 2.854 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)NC/C=C/CNCCC(F)(F)F ZINC001321123183 1329345964 /nfs/dbraw/zinc/34/59/64/1329345964.db2.gz AEENLMNKWNNVLG-VOTSOKGWSA-N 1 3 349.441 2.854 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)NC/C=C/CNC/C=C\Cl ZINC001321126755 1329346498 /nfs/dbraw/zinc/34/64/98/1329346498.db2.gz PZRHWIGDIUHBOQ-VEQVDCDKSA-N 1 3 327.900 2.654 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)NC/C=C/CNC/C=C\Cl ZINC001321126755 1329346501 /nfs/dbraw/zinc/34/65/01/1329346501.db2.gz PZRHWIGDIUHBOQ-VEQVDCDKSA-N 1 3 327.900 2.654 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC/C=C\C[NH2+]Cc2ccccc2C2CC2)C1 ZINC001321248675 1329362661 /nfs/dbraw/zinc/36/26/61/1329362661.db2.gz DDXCLXRAKGXLOQ-CHYADLBTSA-N 1 3 341.499 2.668 10 0 EFAEHO CC[C@H]([NH2+]C/C=C\CNC(=O)CN1CC[C@@H](C)C1)c1ccccc1 ZINC001321252666 1329363664 /nfs/dbraw/zinc/36/36/64/1329363664.db2.gz WLWYMUQWEAZNTN-UKPUQTQTSA-N 1 3 329.488 2.742 10 0 EFAEHO CCC/C=C/CC[NH2+]C[C@@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001317157963 1327653175 /nfs/dbraw/zinc/65/31/75/1327653175.db2.gz NWNJHFJBMWYPLY-WLMAVBAVSA-N 1 3 335.536 2.903 10 0 EFAEHO CCC/C=C/CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)CN(C)CC(C)(C)C ZINC001317214293 1327757891 /nfs/dbraw/zinc/75/78/91/1327757891.db2.gz DHTGZESVJGEGPU-HRBWHDEWSA-N 1 3 335.536 2.757 10 0 EFAEHO CCC/C=C/CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)CN(C)CC(C)(C)C ZINC001317214293 1327757900 /nfs/dbraw/zinc/75/79/00/1327757900.db2.gz DHTGZESVJGEGPU-HRBWHDEWSA-N 1 3 335.536 2.757 10 0 EFAEHO CN(C)C1(C(=O)NCc2ccc(CC[NH2+]CC3CCC3)cc2)CCC1 ZINC001317367157 1327907080 /nfs/dbraw/zinc/90/70/80/1327907080.db2.gz VSDJPJMLNXOQME-UHFFFAOYSA-N 1 3 343.515 2.719 10 0 EFAEHO C[C@H](NC/C=C/CNC(=O)[C@H]1CC[N@H+](C)C1)c1ccc(Cl)cc1 ZINC001321404551 1329383046 /nfs/dbraw/zinc/38/30/46/1329383046.db2.gz RKCSGAVELSFPGJ-BVWQNDCPSA-N 1 3 335.879 2.615 10 0 EFAEHO C[C@H](NC/C=C/CNC(=O)[C@H]1CC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC001321404551 1329383049 /nfs/dbraw/zinc/38/30/49/1329383049.db2.gz RKCSGAVELSFPGJ-BVWQNDCPSA-N 1 3 335.879 2.615 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NC/C=C/CNCc1ccc(Cl)cc1 ZINC001321414557 1329383857 /nfs/dbraw/zinc/38/38/57/1329383857.db2.gz AJUUMYRLAAGXJU-NSCUHMNNSA-N 1 3 349.906 2.978 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C\CNC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C ZINC001321417784 1329384241 /nfs/dbraw/zinc/38/42/41/1329384241.db2.gz VDRQYFAQRNZGHF-FPXTWJHWSA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C\CNC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001321417784 1329384244 /nfs/dbraw/zinc/38/42/44/1329384244.db2.gz VDRQYFAQRNZGHF-FPXTWJHWSA-N 1 3 347.478 2.769 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC/C=C/C[NH2+]Cc1cc(F)ccc1C ZINC001321421188 1329385000 /nfs/dbraw/zinc/38/50/00/1329385000.db2.gz VUGXLMKELUYIHE-UEKDZROGSA-N 1 3 347.478 2.771 10 0 EFAEHO CN(CCNC(=O)c1ccccc1CC[NH+](C)C)CC1=CCCCC1 ZINC001317454366 1328044217 /nfs/dbraw/zinc/04/42/17/1328044217.db2.gz FNNSQDSDXMVDRB-UHFFFAOYSA-N 1 3 343.515 2.953 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)NC[C@@H]1CCN(Cc2ccsc2)C1 ZINC001317535018 1328120275 /nfs/dbraw/zinc/12/02/75/1328120275.db2.gz HKCUEJJTDBUJKO-KRWDZBQOSA-N 1 3 349.544 2.952 10 0 EFAEHO CN(CC[NH2+]Cc1ccccc1C1CC1)C(=O)CN(C)C1CCC1 ZINC001317594940 1328174659 /nfs/dbraw/zinc/17/46/59/1328174659.db2.gz BLAMHBFAMRZGCJ-UHFFFAOYSA-N 1 3 329.488 2.596 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]CCN(C)C(=O)C1(N(C)C)CCC1 ZINC001317595441 1328174750 /nfs/dbraw/zinc/17/47/50/1328174750.db2.gz BYYQKVZYADBMFV-UHFFFAOYSA-N 1 3 331.504 2.842 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[NH2+]CC2CCC3(CC3)CC2)CC1 ZINC001317642783 1328227319 /nfs/dbraw/zinc/22/73/19/1328227319.db2.gz UUSFGDBZYQZESF-UHFFFAOYSA-N 1 3 335.536 2.737 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]C/C=C\c1ccccc1 ZINC001321755732 1329407058 /nfs/dbraw/zinc/40/70/58/1329407058.db2.gz DYIZRRYGBLYCFW-OHIPZYOVSA-N 1 3 329.488 2.669 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](Cc1ccc(F)cc1)C(C)C ZINC001317709078 1328318225 /nfs/dbraw/zinc/31/82/25/1328318225.db2.gz IGTYSFIDJHMULB-UHFFFAOYSA-N 1 3 346.450 2.817 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC001317709078 1328318231 /nfs/dbraw/zinc/31/82/31/1328318231.db2.gz IGTYSFIDJHMULB-UHFFFAOYSA-N 1 3 346.450 2.817 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](C[N@H+](C)CCC2=CCCCC2)C1 ZINC001317830806 1328401562 /nfs/dbraw/zinc/40/15/62/1328401562.db2.gz KGJNWAARWLRUFT-OALUTQOASA-N 1 3 333.520 2.751 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](C[N@@H+](C)CCC2=CCCCC2)C1 ZINC001317830806 1328401567 /nfs/dbraw/zinc/40/15/67/1328401567.db2.gz KGJNWAARWLRUFT-OALUTQOASA-N 1 3 333.520 2.751 10 0 EFAEHO CC[C@@H](C)C[NH2+]CCCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001322695091 1329480536 /nfs/dbraw/zinc/48/05/36/1329480536.db2.gz WPLGXJRQMNWREV-CRAIPNDOSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](C[N@H+](C)CCC3=CCCCC3)C2)C1 ZINC001317852863 1328417717 /nfs/dbraw/zinc/41/77/17/1328417717.db2.gz IVULDWPMJZQDDJ-AZUAARDMSA-N 1 3 347.547 2.999 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](C[N@@H+](C)CCC3=CCCCC3)C2)C1 ZINC001317852863 1328417722 /nfs/dbraw/zinc/41/77/22/1328417722.db2.gz IVULDWPMJZQDDJ-AZUAARDMSA-N 1 3 347.547 2.999 10 0 EFAEHO CCC/C=C/CCN1CCC[C@@H](NC(=O)C23CCC[NH+]2CCC3)C1 ZINC001317935624 1328447383 /nfs/dbraw/zinc/44/73/83/1328447383.db2.gz ILHYRPATFPMHFP-SHCNBLLESA-N 1 3 333.520 2.942 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001321945920 1329418185 /nfs/dbraw/zinc/41/81/85/1329418185.db2.gz CTFWEOATGBOJPB-SFHVURJKSA-N 1 3 345.531 2.896 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H]1CCC[N@H+](CCCCCF)C1 ZINC001317947584 1328452337 /nfs/dbraw/zinc/45/23/37/1328452337.db2.gz CLFAGUQBAMWSHE-QZTJIDSGSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H]1CCC[N@@H+](CCCCCF)C1 ZINC001317947584 1328452343 /nfs/dbraw/zinc/45/23/43/1328452343.db2.gz CLFAGUQBAMWSHE-QZTJIDSGSA-N 1 3 341.515 2.970 10 0 EFAEHO CC/C=C\CC[NH+]1CC(CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001318176262 1328513779 /nfs/dbraw/zinc/51/37/79/1328513779.db2.gz MHWRKJQQFYXDJI-WAYWQWQTSA-N 1 3 329.488 2.766 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1C[NH+](CCC2=CCCCC2)C1 ZINC001318176078 1328513848 /nfs/dbraw/zinc/51/38/48/1328513848.db2.gz HXWPFKRMLOCSSN-IRXDYDNUSA-N 1 3 333.520 2.798 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1C[NH+](CCC2=CCCCC2)C1 ZINC001318176077 1328514211 /nfs/dbraw/zinc/51/42/11/1328514211.db2.gz HXWPFKRMLOCSSN-IAGOWNOFSA-N 1 3 333.520 2.798 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CCCC[C@@H]1C[NH2+]CCCF)N1CCCCC1 ZINC001322328600 1329447585 /nfs/dbraw/zinc/44/75/85/1329447585.db2.gz CVPCRBZIUOPCFC-IAGOWNOFSA-N 1 3 341.515 2.875 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[NH2+]Cc1ccc(CF)cc1 ZINC001322852348 1329494177 /nfs/dbraw/zinc/49/41/77/1329494177.db2.gz MSGDOEPBDLZTCU-IBGZPJMESA-N 1 3 349.494 2.969 10 0 EFAEHO CC(C)CCCN1Cc2ccccc2C[C@H]1CNC(=O)CC[NH+](C)C ZINC001381028773 1348030813 /nfs/dbraw/zinc/03/08/13/1348030813.db2.gz DUMJGJANWFNYIJ-FQEVSTJZSA-N 1 3 345.531 2.917 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001323639411 1329557837 /nfs/dbraw/zinc/55/78/37/1329557837.db2.gz ZIUHTZSUXAIZMF-WHLIDYPQSA-N 1 3 344.503 2.869 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001323639411 1329557840 /nfs/dbraw/zinc/55/78/40/1329557840.db2.gz ZIUHTZSUXAIZMF-WHLIDYPQSA-N 1 3 344.503 2.869 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC[C@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001323816853 1329574956 /nfs/dbraw/zinc/57/49/56/1329574956.db2.gz UOZMATUORAYGHV-TWPWWVQHSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC[C@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001323816853 1329574958 /nfs/dbraw/zinc/57/49/58/1329574958.db2.gz UOZMATUORAYGHV-TWPWWVQHSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@@]2(CCN(C(=O)CCCC[NH+](C)C)C2)C1 ZINC001323817234 1329575046 /nfs/dbraw/zinc/57/50/46/1329575046.db2.gz ZGDXSWGMLVFDQC-IEBWSBKVSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2ccccc2)C[C@H]1C ZINC001324096596 1329599219 /nfs/dbraw/zinc/59/92/19/1329599219.db2.gz CWSHSPMYHIPZLI-UYAOXDASSA-N 1 3 345.531 2.929 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CCCc2ccccc2)CCN1C(=O)CN1CCCC1 ZINC001324098524 1329600071 /nfs/dbraw/zinc/60/00/71/1329600071.db2.gz RPFPHMPGKKEQOE-ICSRJNTNSA-N 1 3 343.515 2.684 10 0 EFAEHO O=C(N1CCC[C@H]1CNCC=C(Cl)Cl)C12CCC[NH+]1CCC2 ZINC001324185759 1329606535 /nfs/dbraw/zinc/60/65/35/1329606535.db2.gz CZMZQINUFINVLP-ZDUSSCGKSA-N 1 3 346.302 2.514 10 0 EFAEHO Cc1cccc(CCC[NH2+]C[C@@H]2CCCN2C(=O)[C@H]2CCCN2C)c1 ZINC001324207083 1329608151 /nfs/dbraw/zinc/60/81/51/1329608151.db2.gz NVSQMJGZANYSJI-VQTJNVASSA-N 1 3 343.515 2.602 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001324263423 1329612100 /nfs/dbraw/zinc/61/21/00/1329612100.db2.gz LKSFMTGQVJZEFK-CYBMUJFWSA-N 1 3 336.307 2.618 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001324263423 1329612102 /nfs/dbraw/zinc/61/21/02/1329612102.db2.gz LKSFMTGQVJZEFK-CYBMUJFWSA-N 1 3 336.307 2.618 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2CCCCCF)N(C)C ZINC001324538207 1329637561 /nfs/dbraw/zinc/63/75/61/1329637561.db2.gz XHAOLDOOYYRYLD-FGTMMUONSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2CCCCCF)N(C)C ZINC001324538207 1329637564 /nfs/dbraw/zinc/63/75/64/1329637564.db2.gz XHAOLDOOYYRYLD-FGTMMUONSA-N 1 3 341.515 2.778 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@]1(C)CCC[N@H+](CC=C(C)C)C1 ZINC001324937643 1329661175 /nfs/dbraw/zinc/66/11/75/1329661175.db2.gz YLKDILVHTWTPOZ-MJGOQNOKSA-N 1 3 341.515 2.851 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@]1(C)CCC[N@@H+](CC=C(C)C)C1 ZINC001324937643 1329661177 /nfs/dbraw/zinc/66/11/77/1329661177.db2.gz YLKDILVHTWTPOZ-MJGOQNOKSA-N 1 3 341.515 2.851 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](CC[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001326223514 1329740068 /nfs/dbraw/zinc/74/00/68/1329740068.db2.gz IGBFAXTVJNWBEI-MOPGFXCFSA-N 1 3 347.547 2.879 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](CC[NH2+]CC2CCCCC2)C1)N(C)C ZINC001326290041 1329744661 /nfs/dbraw/zinc/74/46/61/1329744661.db2.gz LBFNGLOKAYMAFL-OALUTQOASA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](CC[NH2+]Cc2ccsc2)C1)N(C)C ZINC001326351082 1329749593 /nfs/dbraw/zinc/74/95/93/1329749593.db2.gz DYDLUWGPTGDODU-DOTOQJQBSA-N 1 3 337.533 2.663 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@@H]2CCN(C(=O)Cc3c[nH]cn3)C2)c1 ZINC001326372608 1329751001 /nfs/dbraw/zinc/75/10/01/1329751001.db2.gz VPWLYXKZWWILOK-QGZVFWFLSA-N 1 3 340.471 2.597 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@H]1CCCC[N@@H+]1C1CCCC1)NC/C=C/Cl ZINC001382110165 1348730098 /nfs/dbraw/zinc/73/00/98/1348730098.db2.gz AOAVLQLMSUHUGW-YMWPRZBKSA-N 1 3 341.927 2.973 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@H]1CCCC[N@H+]1C1CCCC1)NC/C=C/Cl ZINC001382110165 1348730103 /nfs/dbraw/zinc/73/01/03/1348730103.db2.gz AOAVLQLMSUHUGW-YMWPRZBKSA-N 1 3 341.927 2.973 10 0 EFAEHO CCCCCN1Cc2ccccc2C[C@H]1CNC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001327510992 1330491534 /nfs/dbraw/zinc/49/15/34/1330491534.db2.gz ALYMJBJYZOTCOI-UXHICEINSA-N 1 3 343.515 2.671 10 0 EFAEHO CCCCCN1Cc2ccccc2C[C@H]1CNC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001327510992 1330491538 /nfs/dbraw/zinc/49/15/38/1330491538.db2.gz ALYMJBJYZOTCOI-UXHICEINSA-N 1 3 343.515 2.671 10 0 EFAEHO CCCCCN1Cc2ccc(CNC(=O)[C@H]3CC[N@H+](C)C3)cc2C1 ZINC001327695324 1330509737 /nfs/dbraw/zinc/50/97/37/1330509737.db2.gz GIYKJITUPDYSSV-SFHVURJKSA-N 1 3 329.488 2.760 10 0 EFAEHO CCCCCN1Cc2ccc(CNC(=O)[C@H]3CC[N@@H+](C)C3)cc2C1 ZINC001327695324 1330509740 /nfs/dbraw/zinc/50/97/40/1330509740.db2.gz GIYKJITUPDYSSV-SFHVURJKSA-N 1 3 329.488 2.760 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[NH2+]CCCc1ccccc1 ZINC001328673889 1330614667 /nfs/dbraw/zinc/61/46/67/1330614667.db2.gz FHHDHEGBLDZLKQ-FQEVSTJZSA-N 1 3 345.531 2.930 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2C[C@H](C[NH2+]C/C=C\Cl)C2)c1 ZINC001330708488 1330765414 /nfs/dbraw/zinc/76/54/14/1330765414.db2.gz NLGPZBPXQZRJQZ-GENKUXQMSA-N 1 3 335.879 2.599 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CCC[NH2+]Cc1cccnc1C ZINC001330986884 1330779364 /nfs/dbraw/zinc/77/93/64/1330779364.db2.gz HKXLZAIDHGNFFT-LPHOPBHVSA-N 1 3 346.519 2.639 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H](C[NH2+]CC1=CCCCC1)C1CC1)N(C)C ZINC001331327446 1330822792 /nfs/dbraw/zinc/82/27/92/1330822792.db2.gz ZWVIISLXJFPFOQ-RTBURBONSA-N 1 3 335.536 2.900 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@@H]2C[C@@H](C)N(C(=O)CN3CCCC3)C2)cc1 ZINC001332046419 1330908962 /nfs/dbraw/zinc/90/89/62/1330908962.db2.gz GWQHRQAKFKWRKU-UYAOXDASSA-N 1 3 343.515 2.602 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2C[C@H](C)N(C(=O)CN3CCCC3)C2)cc1 ZINC001332046415 1330909027 /nfs/dbraw/zinc/90/90/27/1330909027.db2.gz GWQHRQAKFKWRKU-ICSRJNTNSA-N 1 3 343.515 2.602 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2C[C@H]([NH2+]CCCC(C)(C)C)C(C)(C)C2)C1 ZINC001332422454 1330969963 /nfs/dbraw/zinc/96/99/63/1330969963.db2.gz ILOJCSCTVMNPQY-IRXDYDNUSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H](F)CN[C@H]1CN(C(=O)CCCC[NH+]2CCCC2)CC1(C)C ZINC001332451723 1330973315 /nfs/dbraw/zinc/97/33/15/1330973315.db2.gz DZCDSAMPJDTRMZ-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+](Cc2ccc(C)cc2)CC1)N(C)C ZINC001333364229 1331125646 /nfs/dbraw/zinc/12/56/46/1331125646.db2.gz GKOHXZLQSRIXGG-LJQANCHMSA-N 1 3 329.488 2.584 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+](Cc2ccc(C)cc2)CC1)N(C)C ZINC001333364229 1331125648 /nfs/dbraw/zinc/12/56/48/1331125648.db2.gz GKOHXZLQSRIXGG-LJQANCHMSA-N 1 3 329.488 2.584 10 0 EFAEHO Cc1ccc(CN2CC=C(CNC(=O)C3(C[NH+](C)C)CC3)CC2)cc1 ZINC001333393221 1331133215 /nfs/dbraw/zinc/13/32/15/1331133215.db2.gz ABLWIKWICCRUHS-UHFFFAOYSA-N 1 3 341.499 2.585 10 0 EFAEHO O=C(OC[C@H]1CC[N@@H+]1C1CCCCCC1)C1CCCN(C2CC2)C1=O ZINC001345531089 1332546303 /nfs/dbraw/zinc/54/63/03/1332546303.db2.gz NBBJGQFNWQTEGO-MSOLQXFVSA-N 1 3 348.487 2.728 10 0 EFAEHO O=C(OC[C@H]1CC[N@H+]1C1CCCCCC1)C1CCCN(C2CC2)C1=O ZINC001345531089 1332546308 /nfs/dbraw/zinc/54/63/08/1332546308.db2.gz NBBJGQFNWQTEGO-MSOLQXFVSA-N 1 3 348.487 2.728 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H]([NH2+]CCCCc2ccccc2)C1)N(C)C ZINC001480117535 1333383420 /nfs/dbraw/zinc/38/34/20/1333383420.db2.gz MARZTQYFINFBCU-OALUTQOASA-N 1 3 331.504 2.540 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H](C)CNC(=O)[C@@H]1CCCN1C(C)C ZINC001480460952 1334066772 /nfs/dbraw/zinc/06/67/72/1334066772.db2.gz ZHDDERGAZYAOMA-LPHOPBHVSA-N 1 3 331.504 2.716 10 0 EFAEHO CN1CCN(c2ccc(N[C@H]3CCC[N@@H+]4CCCC[C@H]34)cc2)CC1 ZINC001354235666 1334187707 /nfs/dbraw/zinc/18/77/07/1334187707.db2.gz LFGXAUPEBMRUAA-VQTJNVASSA-N 1 3 328.504 2.867 10 0 EFAEHO CN1CCN(c2ccc(N[C@H]3CCC[N@H+]4CCCC[C@H]34)cc2)CC1 ZINC001354235666 1334187710 /nfs/dbraw/zinc/18/77/10/1334187710.db2.gz LFGXAUPEBMRUAA-VQTJNVASSA-N 1 3 328.504 2.867 10 0 EFAEHO CN1CCN(c2ccc(N[C@H]3CCC[N@@H+]4CCCC[C@@H]34)cc2)CC1 ZINC001354235660 1334188082 /nfs/dbraw/zinc/18/80/82/1334188082.db2.gz LFGXAUPEBMRUAA-PMACEKPBSA-N 1 3 328.504 2.867 10 0 EFAEHO CN1CCN(c2ccc(N[C@H]3CCC[N@H+]4CCCC[C@@H]34)cc2)CC1 ZINC001354235660 1334188086 /nfs/dbraw/zinc/18/80/86/1334188086.db2.gz LFGXAUPEBMRUAA-PMACEKPBSA-N 1 3 328.504 2.867 10 0 EFAEHO Cc1ccc(NC(=S)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1C ZINC000849275686 1335585997 /nfs/dbraw/zinc/58/59/97/1335585997.db2.gz UVUGYYMYMFUSJA-INIZCTEOSA-N 1 3 336.549 2.862 10 0 EFAEHO Cc1ccc(NC(=S)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1C ZINC000849275686 1335585999 /nfs/dbraw/zinc/58/59/99/1335585999.db2.gz UVUGYYMYMFUSJA-INIZCTEOSA-N 1 3 336.549 2.862 10 0 EFAEHO CCc1cccc(NC(=S)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000849275354 1335586132 /nfs/dbraw/zinc/58/61/32/1335586132.db2.gz MGVWKIZKRGIRDQ-HNNXBMFYSA-N 1 3 336.549 2.807 10 0 EFAEHO CCc1cccc(NC(=S)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000849275354 1335586135 /nfs/dbraw/zinc/58/61/35/1335586135.db2.gz MGVWKIZKRGIRDQ-HNNXBMFYSA-N 1 3 336.549 2.807 10 0 EFAEHO CC(C)[C@@H]1[C@@H](C(C)C)CN1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001413893846 1335952595 /nfs/dbraw/zinc/95/25/95/1335952595.db2.gz OXDXGUOUQKRKKA-RCCFBDPRSA-N 1 3 340.556 2.580 10 0 EFAEHO CC(C)[C@@H]1[C@@H](C(C)C)CN1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001413893846 1335952599 /nfs/dbraw/zinc/95/25/99/1335952599.db2.gz OXDXGUOUQKRKKA-RCCFBDPRSA-N 1 3 340.556 2.580 10 0 EFAEHO COc1ccc(CN(C)C)cc1NC(=O)[C@H]1CCC[N@@H+](C(C)C)C1 ZINC001361610919 1336220068 /nfs/dbraw/zinc/22/00/68/1336220068.db2.gz NBUSMLVCQOZXTJ-INIZCTEOSA-N 1 3 333.476 2.816 10 0 EFAEHO COc1ccc(CN(C)C)cc1NC(=O)[C@H]1CCC[N@H+](C(C)C)C1 ZINC001361610919 1336220073 /nfs/dbraw/zinc/22/00/73/1336220073.db2.gz NBUSMLVCQOZXTJ-INIZCTEOSA-N 1 3 333.476 2.816 10 0 EFAEHO C[C@@H]1CCC[C@](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)([NH+](C)C)C1 ZINC001361673506 1336262440 /nfs/dbraw/zinc/26/24/40/1336262440.db2.gz IPZBWEUTSXKVDU-MNEFBYGVSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H]1CCC[C@](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)([NH+](C)C)C1 ZINC001361673500 1336262476 /nfs/dbraw/zinc/26/24/76/1336262476.db2.gz IPZBWEUTSXKVDU-AYOQOUSVSA-N 1 3 341.515 2.826 10 0 EFAEHO CN(C)[C@@H](CNC(=O)c1cccc(CC[NH+](C)C)c1)c1ccccc1 ZINC001361749088 1336310702 /nfs/dbraw/zinc/31/07/02/1336310702.db2.gz VNENBMYFWYGDGK-FQEVSTJZSA-N 1 3 339.483 2.823 10 0 EFAEHO C[C@@H]1CCC[C@H](CC[NH+](C)C)N1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001361813079 1336351992 /nfs/dbraw/zinc/35/19/92/1336351992.db2.gz RHGTWGVWNKHZAQ-GPMSIDNRSA-N 1 3 341.515 2.920 10 0 EFAEHO CCC[N@H+](CC)Cc1ccc(C(=O)N[C@@]23CCN(C2)CCC3)cc1 ZINC001361856633 1336378457 /nfs/dbraw/zinc/37/84/57/1336378457.db2.gz CPLURYHHCXQLJF-FQEVSTJZSA-N 1 3 329.488 2.887 10 0 EFAEHO CCC[N@@H+](CC)Cc1ccc(C(=O)N[C@@]23CCN(C2)CCC3)cc1 ZINC001361856633 1336378459 /nfs/dbraw/zinc/37/84/59/1336378459.db2.gz CPLURYHHCXQLJF-FQEVSTJZSA-N 1 3 329.488 2.887 10 0 EFAEHO CCC[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(=O)N(C)CCN(C)C ZINC001362007475 1336461434 /nfs/dbraw/zinc/46/14/34/1336461434.db2.gz GXVUVGPZBFFEFY-RTBURBONSA-N 1 3 331.504 2.555 10 0 EFAEHO CCC[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)N(C)CCN(C)C ZINC001362007475 1336461436 /nfs/dbraw/zinc/46/14/36/1336461436.db2.gz GXVUVGPZBFFEFY-RTBURBONSA-N 1 3 331.504 2.555 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001362100889 1336503069 /nfs/dbraw/zinc/50/30/69/1336503069.db2.gz VETOLZKPHMKORQ-OALUTQOASA-N 1 3 331.504 2.697 10 0 EFAEHO COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](C)CC[NH+](C)C)cc1 ZINC001362248340 1336571769 /nfs/dbraw/zinc/57/17/69/1336571769.db2.gz DNGDYHSDBKFFMB-LPHOPBHVSA-N 1 3 347.503 2.536 10 0 EFAEHO C[N@H+](CCNC(=O)c1ccc(NC2=NCCC2)cc1)C1CCCC1 ZINC001362263549 1336579443 /nfs/dbraw/zinc/57/94/43/1336579443.db2.gz NZFPKSWQFWEZGR-UHFFFAOYSA-N 1 3 328.460 2.895 10 0 EFAEHO C[N@@H+](CCNC(=O)c1ccc(NC2=NCCC2)cc1)C1CCCC1 ZINC001362263549 1336579446 /nfs/dbraw/zinc/57/94/46/1336579446.db2.gz NZFPKSWQFWEZGR-UHFFFAOYSA-N 1 3 328.460 2.895 10 0 EFAEHO C[C@H](NC(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1)[C@H](c1ccccc1)N(C)C ZINC001362412832 1336599790 /nfs/dbraw/zinc/59/97/90/1336599790.db2.gz XHEZHXVEVXKNAK-WZGPROSRSA-N 1 3 331.504 2.914 10 0 EFAEHO CN(C)CCN(Cc1ccco1)C(=O)c1cccc(CC[NH+](C)C)c1 ZINC001362425266 1336605216 /nfs/dbraw/zinc/60/52/16/1336605216.db2.gz CZDQUXDRKVYXTK-UHFFFAOYSA-N 1 3 343.471 2.588 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001362668241 1336698061 /nfs/dbraw/zinc/69/80/61/1336698061.db2.gz SVBYQMIZWYPTCW-BHIYHBOVSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001362668241 1336698063 /nfs/dbraw/zinc/69/80/63/1336698063.db2.gz SVBYQMIZWYPTCW-BHIYHBOVSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC001362739842 1336723244 /nfs/dbraw/zinc/72/32/44/1336723244.db2.gz KFARKXAJXIDCLE-CJNGLKHVSA-N 1 3 325.884 2.647 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)N[C@H](CN(C)C)c2ccc(F)cc2)CC1 ZINC001362786322 1336742047 /nfs/dbraw/zinc/74/20/47/1336742047.db2.gz NQFYUEMGEQRVFR-LJQANCHMSA-N 1 3 349.494 2.913 10 0 EFAEHO CCCN1CCCC[C@H]1C(=O)NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC001362828179 1336756261 /nfs/dbraw/zinc/75/62/61/1336756261.db2.gz ZBOFIHRAZLKEOW-AABGKKOBSA-N 1 3 343.515 2.713 10 0 EFAEHO CCCN1CCCC[C@H]1C(=O)NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001362828179 1336756264 /nfs/dbraw/zinc/75/62/64/1336756264.db2.gz ZBOFIHRAZLKEOW-AABGKKOBSA-N 1 3 343.515 2.713 10 0 EFAEHO CN(CC[N@H+](C)C1CCN(C)CC1)C[C@H]1CC2(CO1)CCCCC2 ZINC001363215754 1336837729 /nfs/dbraw/zinc/83/77/29/1336837729.db2.gz KJMYPPKIJFJPRJ-LJQANCHMSA-N 1 3 337.552 2.684 10 0 EFAEHO CN(CC[N@@H+](C)C1CCN(C)CC1)C[C@H]1CC2(CO1)CCCCC2 ZINC001363215754 1336837732 /nfs/dbraw/zinc/83/77/32/1336837732.db2.gz KJMYPPKIJFJPRJ-LJQANCHMSA-N 1 3 337.552 2.684 10 0 EFAEHO OC1(C[NH+]2CCCCC2)CCN(C[C@@H]2CCC3(CCCC3)O2)CC1 ZINC001363850952 1337081028 /nfs/dbraw/zinc/08/10/28/1337081028.db2.gz MHJHJQDHCKQJSF-SFHVURJKSA-N 1 3 336.520 2.791 10 0 EFAEHO CC[N@H+](C)[C@@H]1CCN(C(=O)[C@H]2CCCCN2Cc2cccc(C)c2)C1 ZINC001364011096 1337149906 /nfs/dbraw/zinc/14/99/06/1337149906.db2.gz JXOMXHHOVMGIEP-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO CC[N@@H+](C)[C@@H]1CCN(C(=O)[C@H]2CCCCN2Cc2cccc(C)c2)C1 ZINC001364011096 1337149908 /nfs/dbraw/zinc/14/99/08/1337149908.db2.gz JXOMXHHOVMGIEP-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CCC2CCCC2)C1 ZINC001365828311 1337254007 /nfs/dbraw/zinc/25/40/07/1337254007.db2.gz JRMCOYSWIKNNDY-AMBYYYRHSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CCC2CCCC2)C1 ZINC001365828323 1337254061 /nfs/dbraw/zinc/25/40/61/1337254061.db2.gz JRMCOYSWIKNNDY-PBWTXFEYSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[C@H]([NH2+][C@H]1C[C@@H](CNC(=O)CN(C)C(C)C)C1)c1ccccc1 ZINC001365831261 1337255775 /nfs/dbraw/zinc/25/57/75/1337255775.db2.gz UHZCEVVUCJPPHP-UHOSZYNNSA-N 1 3 331.504 2.962 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)[C@H]2CCCCN2C(=O)CC[NH+](C)C)c1 ZINC001365932266 1337264229 /nfs/dbraw/zinc/26/42/29/1337264229.db2.gz XUJQNZOJTFYXBQ-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](C[NH2+]CCC2CCCCC2)C1)N(C)C ZINC001480676714 1337278610 /nfs/dbraw/zinc/27/86/10/1337278610.db2.gz NXNIGMLVFLVCDH-OALUTQOASA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC12CC[NH+](CC1CC3(CCC3)C1)CC2)N(C)C ZINC001366012720 1337321975 /nfs/dbraw/zinc/32/19/75/1337321975.db2.gz DLZUNLLPUDXLJA-MSOLQXFVSA-N 1 3 347.547 2.878 10 0 EFAEHO CC1CCC(C[NH2+][C@@H](CNC(=O)C2(N(C)C)CCC2)C2CC2)CC1 ZINC001366032852 1337336216 /nfs/dbraw/zinc/33/62/16/1337336216.db2.gz FDBQQNKVPRWIDQ-HTWSVDAQSA-N 1 3 335.536 2.781 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@H](NC(=O)C3(N(C)C)CCC3)C2)c(Cl)c1 ZINC001366113296 1337384457 /nfs/dbraw/zinc/38/44/57/1337384457.db2.gz KVFSJSVSMZFABJ-WKILWMFISA-N 1 3 349.906 2.870 10 0 EFAEHO C[NH+](C)CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1Cl ZINC001366131860 1337393137 /nfs/dbraw/zinc/39/31/37/1337393137.db2.gz BVCFMOZYFUSCBB-ALOPSCKCSA-N 1 3 349.906 2.903 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1F)N(C)C ZINC001366138146 1337397335 /nfs/dbraw/zinc/39/73/35/1337397335.db2.gz VKBUEWOTBMHRBH-RGPMPMONSA-N 1 3 347.478 2.778 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1F)N(C)C ZINC001366138146 1337397338 /nfs/dbraw/zinc/39/73/38/1337397338.db2.gz VKBUEWOTBMHRBH-RGPMPMONSA-N 1 3 347.478 2.778 10 0 EFAEHO CC[C@@H]([NH2+][C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)C1)c1ccccc1 ZINC001366148632 1337402531 /nfs/dbraw/zinc/40/25/31/1337402531.db2.gz HSFHSZLJKOIAMQ-ZIFCJYIRSA-N 1 3 329.488 2.859 10 0 EFAEHO C[C@@H]([NH2+][C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)C1)c1cccc(F)c1 ZINC001366149561 1337402961 /nfs/dbraw/zinc/40/29/61/1337402961.db2.gz KEWCDKBBDZDZRO-XYPHTWIQSA-N 1 3 333.451 2.608 10 0 EFAEHO C[C@@H]1CCC[C@@H](CC[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)C1 ZINC001366151722 1337404061 /nfs/dbraw/zinc/40/40/61/1337404061.db2.gz WFLJVZVELMUTHR-XDNAFOTISA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(F)c2)C1)N(C)C ZINC001366156738 1337406147 /nfs/dbraw/zinc/40/61/47/1337406147.db2.gz QVIJNILZOYXSBS-VIBAHUMZSA-N 1 3 335.467 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(Cl)cc2)C1 ZINC001366167854 1337411502 /nfs/dbraw/zinc/41/15/02/1337411502.db2.gz LSJHRBKJXOPLDK-XYPHTWIQSA-N 1 3 337.895 2.978 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2cc(F)ccc2F)C1)N(C)C ZINC001366169974 1337413029 /nfs/dbraw/zinc/41/30/29/1337413029.db2.gz MPCDDTUHHUGLQA-CVGURMSBSA-N 1 3 339.430 2.603 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC[C@@H]1CCCN(Cc2ccsc2)C1 ZINC001366190581 1337429826 /nfs/dbraw/zinc/42/98/26/1337429826.db2.gz VLFWTXKDBVZNTK-INIZCTEOSA-N 1 3 337.533 2.808 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC[C@@H]1CCCN(Cc2ccsc2)C1 ZINC001366190581 1337429829 /nfs/dbraw/zinc/42/98/29/1337429829.db2.gz VLFWTXKDBVZNTK-INIZCTEOSA-N 1 3 337.533 2.808 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001366200942 1337437970 /nfs/dbraw/zinc/43/79/70/1337437970.db2.gz DVOIOGZOJLKYLE-QGZVFWFLSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001366200843 1337438221 /nfs/dbraw/zinc/43/82/21/1337438221.db2.gz DVOIOGZOJLKYLE-KRWDZBQOSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001366230840 1337464914 /nfs/dbraw/zinc/46/49/14/1337464914.db2.gz MMUGQDPWHKCHMD-WMLDXEAASA-N 1 3 346.519 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001366230840 1337464917 /nfs/dbraw/zinc/46/49/17/1337464917.db2.gz MMUGQDPWHKCHMD-WMLDXEAASA-N 1 3 346.519 2.914 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001366285538 1337491256 /nfs/dbraw/zinc/49/12/56/1337491256.db2.gz JOOJTMKJDKHLGO-OAHLLOKOSA-N 1 3 329.488 2.643 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H](C)[NH2+]Cc1cc2ccccc2s1)N(C)C ZINC001366321852 1337511197 /nfs/dbraw/zinc/51/11/97/1337511197.db2.gz HACHUTPVFJDQCN-BBRMVZONSA-N 1 3 333.501 2.836 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](C)CNC(=O)[C@@H]2CCCCN2C(C)C)c1 ZINC001366334237 1337519170 /nfs/dbraw/zinc/51/91/70/1337519170.db2.gz VCTVHEBFHPALJK-HKUYNNGSSA-N 1 3 331.504 2.852 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001366341225 1337522397 /nfs/dbraw/zinc/52/23/97/1337522397.db2.gz VNKPILYXZOVOQM-LSDHHAIUSA-N 1 3 347.494 2.884 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NCc1cc(Cl)cc(Cl)c1 ZINC001366358483 1337533769 /nfs/dbraw/zinc/53/37/69/1337533769.db2.gz OXLVMCGJMJSAHC-WCQYABFASA-N 1 3 344.286 2.539 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NCc1cc(Cl)cc(Cl)c1 ZINC001366358483 1337533773 /nfs/dbraw/zinc/53/37/73/1337533773.db2.gz OXLVMCGJMJSAHC-WCQYABFASA-N 1 3 344.286 2.539 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]Cc2cc3ccccc3s2)C1 ZINC001366390146 1337554037 /nfs/dbraw/zinc/55/40/37/1337554037.db2.gz TXGBGTSYSLPQKD-INIZCTEOSA-N 1 3 345.512 2.934 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N1CC[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001366402867 1337560638 /nfs/dbraw/zinc/56/06/38/1337560638.db2.gz NOJZVPUUPNZNFW-TWBVXLPBSA-N 1 3 348.318 2.618 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N1CC[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001366402867 1337560641 /nfs/dbraw/zinc/56/06/41/1337560641.db2.gz NOJZVPUUPNZNFW-TWBVXLPBSA-N 1 3 348.318 2.618 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([N@H+](C)[C@H]2CCc3ccccc32)C1 ZINC001366423926 1337573659 /nfs/dbraw/zinc/57/36/59/1337573659.db2.gz AATCBEQBHYZZET-ICSRJNTNSA-N 1 3 343.515 2.939 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([N@@H+](C)[C@H]2CCc3ccccc32)C1 ZINC001366423926 1337573663 /nfs/dbraw/zinc/57/36/63/1337573663.db2.gz AATCBEQBHYZZET-ICSRJNTNSA-N 1 3 343.515 2.939 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@H+](C)CCCc2ccccc2)C1 ZINC001366432096 1337581289 /nfs/dbraw/zinc/58/12/89/1337581289.db2.gz OETBIQDEFLOTDC-HXUWFJFHSA-N 1 3 345.531 2.882 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@@H+](C)CCCc2ccccc2)C1 ZINC001366432096 1337581293 /nfs/dbraw/zinc/58/12/93/1337581293.db2.gz OETBIQDEFLOTDC-HXUWFJFHSA-N 1 3 345.531 2.882 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]([N@H+](C)CCCc2ccccc2)C1)N(C)C ZINC001366438133 1337586855 /nfs/dbraw/zinc/58/68/55/1337586855.db2.gz SBJYJGSUWDRAJW-VQTJNVASSA-N 1 3 345.531 2.882 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]([N@@H+](C)CCCc2ccccc2)C1)N(C)C ZINC001366438133 1337586858 /nfs/dbraw/zinc/58/68/58/1337586858.db2.gz SBJYJGSUWDRAJW-VQTJNVASSA-N 1 3 345.531 2.882 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@H+](C)CCc2ccccc2F)C1 ZINC001366439252 1337587965 /nfs/dbraw/zinc/58/79/65/1337587965.db2.gz XUUHCMOBZNBUIU-SFHVURJKSA-N 1 3 349.494 2.631 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@@H+](C)CCc2ccccc2F)C1 ZINC001366439252 1337587968 /nfs/dbraw/zinc/58/79/68/1337587968.db2.gz XUUHCMOBZNBUIU-SFHVURJKSA-N 1 3 349.494 2.631 10 0 EFAEHO C[C@@H](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCC1 ZINC001366485693 1337626196 /nfs/dbraw/zinc/62/61/96/1337626196.db2.gz MMNJDLPKZNERNW-KXBFYZLASA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+][C@@H](C)CCNC(=O)CN(C)C(C)C ZINC001366508389 1337649227 /nfs/dbraw/zinc/64/92/27/1337649227.db2.gz DNPFHOVNPHZRFF-HNNXBMFYSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001366510191 1337651308 /nfs/dbraw/zinc/65/13/08/1337651308.db2.gz NQXZQTUSFBDCBP-CZUORRHYSA-N 1 3 325.884 2.665 10 0 EFAEHO CN(C)Cc1ccsc1C(=O)NCC[N@H+](C)Cc1ccsc1 ZINC001366533759 1337669556 /nfs/dbraw/zinc/66/95/56/1337669556.db2.gz IYTJKLPBEOGDMU-UHFFFAOYSA-N 1 3 337.514 2.733 10 0 EFAEHO CN(C)Cc1ccsc1C(=O)NCC[N@@H+](C)Cc1ccsc1 ZINC001366533759 1337669560 /nfs/dbraw/zinc/66/95/60/1337669560.db2.gz IYTJKLPBEOGDMU-UHFFFAOYSA-N 1 3 337.514 2.733 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001366539310 1337674792 /nfs/dbraw/zinc/67/47/92/1337674792.db2.gz HGPWLYJAIXOGKZ-RBUKOAKNSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001366539310 1337674796 /nfs/dbraw/zinc/67/47/96/1337674796.db2.gz HGPWLYJAIXOGKZ-RBUKOAKNSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001366567314 1337702114 /nfs/dbraw/zinc/70/21/14/1337702114.db2.gz SPSLKIISRSFWSJ-FQEVSTJZSA-N 1 3 349.494 2.756 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001366567314 1337702118 /nfs/dbraw/zinc/70/21/18/1337702118.db2.gz SPSLKIISRSFWSJ-FQEVSTJZSA-N 1 3 349.494 2.756 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[N@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001366569834 1337705326 /nfs/dbraw/zinc/70/53/26/1337705326.db2.gz HLXOJZZOEVQJFE-HZPDHXFCSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001366569834 1337705328 /nfs/dbraw/zinc/70/53/28/1337705328.db2.gz HLXOJZZOEVQJFE-HZPDHXFCSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H]2CCC[C@@H]([NH+](C)C)C2)cc1C ZINC001366585274 1337723194 /nfs/dbraw/zinc/72/31/94/1337723194.db2.gz OKSJYFIVNDKJCF-WOJBJXKFSA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)[C@H](C(=O)NCCN(C)[C@@H](C)c1ccccc1)[NH+]1CCCC1 ZINC001366597745 1337734372 /nfs/dbraw/zinc/73/43/72/1337734372.db2.gz UFCNOHUSVPADNH-PKOBYXMFSA-N 1 3 331.504 2.916 10 0 EFAEHO COc1cccc([C@H](C)N(C)CCNC(=O)CC[NH+]2CCCCC2)c1 ZINC001366597166 1337735038 /nfs/dbraw/zinc/73/50/38/1337735038.db2.gz SNZAOCPGKAWFPX-KRWDZBQOSA-N 1 3 347.503 2.680 10 0 EFAEHO CCc1cccc(CN(CC)CCNC(=O)C[C@H]2CC[N@H+](C)C2)c1 ZINC001366636506 1337781569 /nfs/dbraw/zinc/78/15/69/1337781569.db2.gz BOEJMOBOEFGPQZ-LJQANCHMSA-N 1 3 331.504 2.529 10 0 EFAEHO CCc1cccc(CN(CC)CCNC(=O)C[C@H]2CC[N@@H+](C)C2)c1 ZINC001366636506 1337781572 /nfs/dbraw/zinc/78/15/72/1337781572.db2.gz BOEJMOBOEFGPQZ-LJQANCHMSA-N 1 3 331.504 2.529 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@H](CNC(=O)C(C)(C)N3CCCC3)C2)c1 ZINC001366700051 1337887893 /nfs/dbraw/zinc/88/78/93/1337887893.db2.gz OOSDYAKUFUCXTR-LJQANCHMSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@H](CNC(=O)C(C)(C)N3CCCC3)C2)c1 ZINC001366700051 1337887897 /nfs/dbraw/zinc/88/78/97/1337887897.db2.gz OOSDYAKUFUCXTR-LJQANCHMSA-N 1 3 343.515 2.808 10 0 EFAEHO CCC[N@H+](CCNC(=O)C1(N(C)C)CCC1)CC1CC2(CCC2)C1 ZINC001366717971 1337915336 /nfs/dbraw/zinc/91/53/36/1337915336.db2.gz SGSRIRNZEIYRTL-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CCC[N@@H+](CCNC(=O)C1(N(C)C)CCC1)CC1CC2(CCC2)C1 ZINC001366717971 1337915339 /nfs/dbraw/zinc/91/53/39/1337915339.db2.gz SGSRIRNZEIYRTL-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccccc1CN(CCNC(=O)CC[C@H]1CCC[N@H+]1C)C1CC1 ZINC001366738103 1337946235 /nfs/dbraw/zinc/94/62/35/1337946235.db2.gz AGCAXTFJIWNZMU-LJQANCHMSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccccc1CN(CCNC(=O)CC[C@H]1CCC[N@@H+]1C)C1CC1 ZINC001366738103 1337946239 /nfs/dbraw/zinc/94/62/39/1337946239.db2.gz AGCAXTFJIWNZMU-LJQANCHMSA-N 1 3 343.515 2.950 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)NCCN(Cc2ccccc2)C2CC2)C1 ZINC001366755352 1337972536 /nfs/dbraw/zinc/97/25/36/1337972536.db2.gz CZIOGSDQASHNRX-AZUAARDMSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)CC[NH2+][C@@H](CNC(=O)CN1CC[C@@H](C)C1)c1ccccc1 ZINC001366786807 1338005573 /nfs/dbraw/zinc/00/55/73/1338005573.db2.gz KKRXHUWJJMSSCX-MJGOQNOKSA-N 1 3 331.504 2.821 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1C[C@H]2CC[C@@H](C1)[N@H+]2CCCC(C)C ZINC001366792679 1338012274 /nfs/dbraw/zinc/01/22/74/1338012274.db2.gz PAYAYTUNLRUKHL-CEXWTWQISA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCC(C)C ZINC001366792679 1338012280 /nfs/dbraw/zinc/01/22/80/1338012280.db2.gz PAYAYTUNLRUKHL-CEXWTWQISA-N 1 3 335.536 2.972 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@H]2CC[N@H+](CC3CC(C)(C)C3)C2)CCC1 ZINC001366833058 1338088291 /nfs/dbraw/zinc/08/82/91/1338088291.db2.gz XXBXGZWAFBIZSU-INIZCTEOSA-N 1 3 335.536 2.735 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@H]2CC[N@@H+](CC3CC(C)(C)C3)C2)CCC1 ZINC001366833058 1338088300 /nfs/dbraw/zinc/08/83/00/1338088300.db2.gz XXBXGZWAFBIZSU-INIZCTEOSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2ccc(C)cc2)C1)N(C)C ZINC001366835965 1338092967 /nfs/dbraw/zinc/09/29/67/1338092967.db2.gz DAJZSOKIPVMIRG-RTBURBONSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2ccc(C)cc2)C1)N(C)C ZINC001366835965 1338092973 /nfs/dbraw/zinc/09/29/73/1338092973.db2.gz DAJZSOKIPVMIRG-RTBURBONSA-N 1 3 331.504 2.663 10 0 EFAEHO CCc1ccccc1C[N@H+](C)C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001366875396 1338149949 /nfs/dbraw/zinc/14/99/49/1338149949.db2.gz WVDIZJCGKZXXTO-GOSISDBHSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1ccccc1C[N@@H+](C)C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001366875396 1338149953 /nfs/dbraw/zinc/14/99/53/1338149953.db2.gz WVDIZJCGKZXXTO-GOSISDBHSA-N 1 3 345.531 2.870 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1CCCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001366896538 1338180813 /nfs/dbraw/zinc/18/08/13/1338180813.db2.gz FRFQFCHQVYKWSK-GOSISDBHSA-N 1 3 342.487 2.590 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1CCCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001366896538 1338180815 /nfs/dbraw/zinc/18/08/15/1338180815.db2.gz FRFQFCHQVYKWSK-GOSISDBHSA-N 1 3 342.487 2.590 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@H+](CC2CCCC2)C1)N1CCCC1 ZINC001366911677 1338196012 /nfs/dbraw/zinc/19/60/12/1338196012.db2.gz LAHNKZJMMJEHII-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@@H+](CC2CCCC2)C1)N1CCCC1 ZINC001366911677 1338196017 /nfs/dbraw/zinc/19/60/17/1338196017.db2.gz LAHNKZJMMJEHII-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH+]2CC(CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001366988749 1338246003 /nfs/dbraw/zinc/24/60/03/1338246003.db2.gz VKRTYLKQFPAAEZ-FUHWJXTLSA-N 1 3 343.515 2.754 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@@H]1CCN(Cc2ccc(CF)cc2)C1 ZINC001367078464 1338361716 /nfs/dbraw/zinc/36/17/16/1338361716.db2.gz TWAQQPCCXLYDBM-GOSISDBHSA-N 1 3 335.467 2.531 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC)NCc1cc(C)ccc1F ZINC001367090012 1338375390 /nfs/dbraw/zinc/37/53/90/1338375390.db2.gz BCIHRIUCUMWXIG-ZIFCJYIRSA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC)NCc1cc(C)ccc1F ZINC001367090012 1338375393 /nfs/dbraw/zinc/37/53/93/1338375393.db2.gz BCIHRIUCUMWXIG-ZIFCJYIRSA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001367095806 1338381876 /nfs/dbraw/zinc/38/18/76/1338381876.db2.gz GHBKGYSQWLKQCP-SJLPKXTDSA-N 1 3 329.488 2.643 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C1CCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001367105968 1338392753 /nfs/dbraw/zinc/39/27/53/1338392753.db2.gz YDVUHIQMINMMRM-LPHOPBHVSA-N 1 3 329.488 2.643 10 0 EFAEHO CC[C@@H](CNC(=O)C12CCC[NH+](CCC1)C2)NCC=C(Cl)Cl ZINC001367110083 1338397207 /nfs/dbraw/zinc/39/72/07/1338397207.db2.gz ZJNJJHULFLTWCD-ZDUSSCGKSA-N 1 3 348.318 2.666 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001367124767 1338413136 /nfs/dbraw/zinc/41/31/36/1338413136.db2.gz FSQFYCDWMWHGNY-IEBWSBKVSA-N 1 3 344.503 2.739 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1c(C)cccc1C ZINC001367128145 1338416780 /nfs/dbraw/zinc/41/67/80/1338416780.db2.gz QPSHPKOEFYCXDK-YJBOKZPZSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@H](C(=O)N[C@](C)(C[NH2+]Cc1ccccc1F)C1CC1)N(C)C ZINC001367172344 1338472405 /nfs/dbraw/zinc/47/24/05/1338472405.db2.gz RICXHYDDSDREIO-IEBWSBKVSA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@H](C(=O)N[C@@](C)(C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001367202671 1338509605 /nfs/dbraw/zinc/50/96/05/1338509605.db2.gz YZEXBAGORVRSGG-MJGOQNOKSA-N 1 3 335.536 2.781 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC1CC[NH+](CC[C@H](C)F)CC1 ZINC001367214104 1338523936 /nfs/dbraw/zinc/52/39/36/1338523936.db2.gz OOHSIMCIZSNCSL-WMZOPIPTSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](CNC(=O)c1cccc(CN(C)C)c1)C[NH2+]CC1CCCC1 ZINC001367282384 1338582268 /nfs/dbraw/zinc/58/22/68/1338582268.db2.gz AUNVQTZXKXPARR-MRXNPFEDSA-N 1 3 331.504 2.894 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(Cl)cc1 ZINC001480791565 1338615877 /nfs/dbraw/zinc/61/58/77/1338615877.db2.gz YTHDRZDEUYLIAJ-HUUCEWRRSA-N 1 3 337.895 2.666 10 0 EFAEHO CC1CC(C[N@H+](C)CCC2CCN(C(=O)CN3CCCC3)CC2)C1 ZINC001367442456 1338745841 /nfs/dbraw/zinc/74/58/41/1338745841.db2.gz ZDWKEJGCDVWZOL-UHFFFAOYSA-N 1 3 335.536 2.689 10 0 EFAEHO CC1CC(C[N@@H+](C)CCC2CCN(C(=O)CN3CCCC3)CC2)C1 ZINC001367442456 1338745843 /nfs/dbraw/zinc/74/58/43/1338745843.db2.gz ZDWKEJGCDVWZOL-UHFFFAOYSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H](C(C)C)N(C)C)[NH2+]Cc1ccsc1 ZINC001367486942 1338787070 /nfs/dbraw/zinc/78/70/70/1338787070.db2.gz CNLREEQRSHUZTA-HOTGVXAUSA-N 1 3 325.522 2.565 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1ccc2cc[nH]c2c1)C(C)C)N(C)C ZINC001367489809 1338789004 /nfs/dbraw/zinc/78/90/04/1338789004.db2.gz IOHYRJYZRMTIFA-RBUKOAKNSA-N 1 3 344.503 2.739 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1cc(C)sc1C)C(C)C)N(C)C ZINC001367495299 1338794480 /nfs/dbraw/zinc/79/44/80/1338794480.db2.gz SPOHZRRSMWNODG-IAGOWNOFSA-N 1 3 339.549 2.936 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1cccc(Cl)c1)C(C)C)N(C)C ZINC001367496895 1338795220 /nfs/dbraw/zinc/79/52/20/1338795220.db2.gz XSINXZJHMNSWTE-DLBZAZTESA-N 1 3 339.911 2.911 10 0 EFAEHO CN(CCN(C)C(=O)CC[C@@H]1CCC[N@@H+]1C)Cc1ccc(CF)cc1 ZINC001367524652 1338825015 /nfs/dbraw/zinc/82/50/15/1338825015.db2.gz WKEKKOZMLVJCBG-IBGZPJMESA-N 1 3 349.494 2.921 10 0 EFAEHO CN(CCN(C)C(=O)CC[C@@H]1CCC[N@H+]1C)Cc1ccc(CF)cc1 ZINC001367524652 1338825017 /nfs/dbraw/zinc/82/50/17/1338825017.db2.gz WKEKKOZMLVJCBG-IBGZPJMESA-N 1 3 349.494 2.921 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[N@H+](C)C[C@@H]1CCc2ccccc2C1)N(C)C ZINC001367544368 1338850397 /nfs/dbraw/zinc/85/03/97/1338850397.db2.gz BJJGAFLYCFUWAZ-YLJYHZDGSA-N 1 3 345.531 2.522 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[N@@H+](C)C[C@@H]1CCc2ccccc2C1)N(C)C ZINC001367544368 1338850399 /nfs/dbraw/zinc/85/03/99/1338850399.db2.gz BJJGAFLYCFUWAZ-YLJYHZDGSA-N 1 3 345.531 2.522 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N(C)CCN(C)CCc1ccccc1F ZINC001367551595 1338861499 /nfs/dbraw/zinc/86/14/99/1338861499.db2.gz MNSJRVZNIXQFGG-CALCHBBNSA-N 1 3 349.494 2.631 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N(C)CCN(C)CCc1ccccc1F ZINC001367551595 1338861500 /nfs/dbraw/zinc/86/15/00/1338861500.db2.gz MNSJRVZNIXQFGG-CALCHBBNSA-N 1 3 349.494 2.631 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@H]2CN(C(=O)CN(C)C(C)C)CC[C@H]21 ZINC001367552708 1338862526 /nfs/dbraw/zinc/86/25/26/1338862526.db2.gz FOMJBRINTRZCKV-VQTJNVASSA-N 1 3 343.515 2.758 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@H]2CN(C(=O)CN(C)C(C)C)CC[C@H]21 ZINC001367552708 1338862530 /nfs/dbraw/zinc/86/25/30/1338862530.db2.gz FOMJBRINTRZCKV-VQTJNVASSA-N 1 3 343.515 2.758 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@@H+](C/C=C\Cl)CC(C)(C)C1)N(C)C ZINC001388834694 1353072559 /nfs/dbraw/zinc/07/25/59/1353072559.db2.gz FVVTZLNXXICENK-RJXMKIDGSA-N 1 3 329.916 2.686 10 0 EFAEHO CCN(CC[NH2+][C@@H](C)c1cccc(OC)c1)C(=O)CN1CC[C@@H](C)C1 ZINC001367646672 1338901407 /nfs/dbraw/zinc/90/14/07/1338901407.db2.gz IHMRXWPKIYCTDE-SJORKVTESA-N 1 3 347.503 2.536 10 0 EFAEHO CCN(CC[NH2+][C@H](C)c1cccc(OC)c1)C(=O)CN1CC[C@H](C)C1 ZINC001367646665 1338901648 /nfs/dbraw/zinc/90/16/48/1338901648.db2.gz IHMRXWPKIYCTDE-DLBZAZTESA-N 1 3 347.503 2.536 10 0 EFAEHO C[C@H](C[NH2+]CC1CCCCC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001367695745 1338935456 /nfs/dbraw/zinc/93/54/56/1338935456.db2.gz RXJYXLJGJIQMAO-DNVCBOLYSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C[C@@H](C)NC(=O)CN(C)C(C)C ZINC001367713410 1338952349 /nfs/dbraw/zinc/95/23/49/1338952349.db2.gz AGKPRYQOSMDQPI-CQSZACIVSA-N 1 3 325.884 2.583 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001367760909 1338987640 /nfs/dbraw/zinc/98/76/40/1338987640.db2.gz RUYBFYVVSVLJSX-IRXDYDNUSA-N 1 3 331.504 2.746 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc2c(c1)CCC2 ZINC001367775932 1339000232 /nfs/dbraw/zinc/00/02/32/1339000232.db2.gz VUMNDBZKEHTJOI-JXFKEZNVSA-N 1 3 343.515 2.644 10 0 EFAEHO C[C@@H](C[N@H+](C)CC1CCC2(CC2)CC1)NC(=O)C1(N(C)C)CCC1 ZINC001367809589 1339028601 /nfs/dbraw/zinc/02/86/01/1339028601.db2.gz WUAFYXOMQVFWSE-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC1CCC2(CC2)CC1)NC(=O)C1(N(C)C)CCC1 ZINC001367809589 1339028603 /nfs/dbraw/zinc/02/86/03/1339028603.db2.gz WUAFYXOMQVFWSE-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H](NC(=O)[C@H]2CCCN2C(C)C)C2CC2)c1 ZINC001367908558 1339099301 /nfs/dbraw/zinc/09/93/01/1339099301.db2.gz XYCHDXRNEZPCTN-WOJBJXKFSA-N 1 3 343.515 2.852 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]C/C=C/c2ccccc2)CC1)N1CCCC1 ZINC001368014460 1339158548 /nfs/dbraw/zinc/15/85/48/1339158548.db2.gz VXDMHPQPWPRTTP-DHZHZOJOSA-N 1 3 341.499 2.813 10 0 EFAEHO C[NH+](C)CCCC(=O)NCC1(N[C@@H]2CCc3c2cccc3Cl)CC1 ZINC001368024985 1339163277 /nfs/dbraw/zinc/16/32/77/1339163277.db2.gz ZVTCWZHWDDLQOW-QGZVFWFLSA-N 1 3 349.906 2.908 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NCC2(N[C@H]3CCc4c3cccc4Cl)CC2)C1 ZINC001368035460 1339168562 /nfs/dbraw/zinc/16/85/62/1339168562.db2.gz MDDPIOHBBIDQKY-DYVFJYSZSA-N 1 3 347.890 2.517 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NCC2(N[C@H]3CCc4c3cccc4Cl)CC2)C1 ZINC001368035460 1339168565 /nfs/dbraw/zinc/16/85/65/1339168565.db2.gz MDDPIOHBBIDQKY-DYVFJYSZSA-N 1 3 347.890 2.517 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+][C@H](C)c2ccc3c(c2)CCC3)CC1 ZINC001368041879 1339171992 /nfs/dbraw/zinc/17/19/92/1339171992.db2.gz LRDKUFPUKBHZFX-MRXNPFEDSA-N 1 3 343.515 2.815 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H]2CC[N@@H+](C[C@@H](C)CC)C2)CC1 ZINC001368044917 1339173760 /nfs/dbraw/zinc/17/37/60/1339173760.db2.gz NEPMYDGIEABLKU-HKUYNNGSSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H]2CC[N@H+](C[C@@H](C)CC)C2)CC1 ZINC001368044917 1339173758 /nfs/dbraw/zinc/17/37/58/1339173758.db2.gz NEPMYDGIEABLKU-HKUYNNGSSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H]2CC[N@H+](C[C@H](C)CC)C2)CC1 ZINC001368044922 1339173872 /nfs/dbraw/zinc/17/38/72/1339173872.db2.gz NEPMYDGIEABLKU-IEBWSBKVSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H]2CC[N@@H+](C[C@H](C)CC)C2)CC1 ZINC001368044922 1339173873 /nfs/dbraw/zinc/17/38/73/1339173873.db2.gz NEPMYDGIEABLKU-IEBWSBKVSA-N 1 3 337.552 2.935 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)[C@@H](C)C1 ZINC001368102401 1339195274 /nfs/dbraw/zinc/19/52/74/1339195274.db2.gz GSARUXPKXDHNRT-HKUYNNGSSA-N 1 3 331.504 2.804 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]Cc2cc(C)ccc2F)C[C@@H]1C ZINC001368105133 1339196154 /nfs/dbraw/zinc/19/61/54/1339196154.db2.gz LEFDYZSDCLMTNO-WMZOPIPTSA-N 1 3 349.494 2.945 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]Cc2cc(C)ccc2F)C[C@@H]1C ZINC001368105127 1339196320 /nfs/dbraw/zinc/19/63/20/1339196320.db2.gz LEFDYZSDCLMTNO-FUHWJXTLSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CCc2cccs2)C[C@H]1C ZINC001368109492 1339197930 /nfs/dbraw/zinc/19/79/30/1339197930.db2.gz SCMNYNCDWZCUEQ-CVEARBPZSA-N 1 3 337.533 2.600 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@]2(CC[N@H+](CC[C@@H](C)F)C2)C1 ZINC001368142897 1339216048 /nfs/dbraw/zinc/21/60/48/1339216048.db2.gz FQLUQCNMVWFLGT-MJGOQNOKSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@]2(CC[N@@H+](CC[C@@H](C)F)C2)C1 ZINC001368142897 1339216051 /nfs/dbraw/zinc/21/60/51/1339216051.db2.gz FQLUQCNMVWFLGT-MJGOQNOKSA-N 1 3 341.515 2.781 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1(C)CC[NH+](CC2CCC2)CC1 ZINC001368211128 1339258027 /nfs/dbraw/zinc/25/80/27/1339258027.db2.gz PURBCMJMPLWQRM-IAGOWNOFSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(F)cc1CN1CCC[C@](C)(CNC(=O)CC[NH+](C)C)C1 ZINC001368232044 1339276907 /nfs/dbraw/zinc/27/69/07/1339276907.db2.gz VIRQEJLASMNRHG-HXUWFJFHSA-N 1 3 349.494 2.804 10 0 EFAEHO CCN1CCC(F)(F)[C@H](CNC(=O)[C@H](C(C)C)[NH+]2CCCCC2)C1 ZINC001368252514 1339284488 /nfs/dbraw/zinc/28/44/88/1339284488.db2.gz SCSLFBGEMYGJLT-CVEARBPZSA-N 1 3 345.478 2.590 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)[N@H+](CC2CC(C)(C)C2)C3)CCC1 ZINC001368328541 1339299775 /nfs/dbraw/zinc/29/97/75/1339299775.db2.gz VMKBSQBNIHMCME-JQHSSLGASA-N 1 3 347.547 2.876 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](CC2CC(C)(C)C2)C3)CCC1 ZINC001368328541 1339299777 /nfs/dbraw/zinc/29/97/77/1339299777.db2.gz VMKBSQBNIHMCME-JQHSSLGASA-N 1 3 347.547 2.876 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)N[C@H]1C[C@H]2C[C@@H](C1)N(C/C=C/Cl)C2 ZINC001368328022 1339300175 /nfs/dbraw/zinc/30/01/75/1339300175.db2.gz TYBWBWWSDPNORT-DWAHBXKPSA-N 1 3 339.911 2.584 10 0 EFAEHO CC[C@@H](C)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C2 ZINC001368337844 1339305311 /nfs/dbraw/zinc/30/53/11/1339305311.db2.gz BTOFPTBIWOYMPT-FQBWVUSXSA-N 1 3 337.552 2.978 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C2 ZINC001368337844 1339305313 /nfs/dbraw/zinc/30/53/13/1339305313.db2.gz BTOFPTBIWOYMPT-FQBWVUSXSA-N 1 3 337.552 2.978 10 0 EFAEHO CC1CC(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)CN2CC[C@H](C)C2)C3)C1 ZINC001368344948 1339308616 /nfs/dbraw/zinc/30/86/16/1339308616.db2.gz JSQNZVNFYNDYBJ-TVICGSFNSA-N 1 3 347.547 2.734 10 0 EFAEHO CC1CC(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)CN2CC[C@H](C)C2)C3)C1 ZINC001368344948 1339308618 /nfs/dbraw/zinc/30/86/18/1339308618.db2.gz JSQNZVNFYNDYBJ-TVICGSFNSA-N 1 3 347.547 2.734 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)Cc1ccccc1CNC(=O)C1(N(C)C)CCC1 ZINC001368412520 1339343166 /nfs/dbraw/zinc/34/31/66/1339343166.db2.gz QPPIODYGAUMZIQ-MRXNPFEDSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)Cc1ccccc1CNC(=O)C1(N(C)C)CCC1 ZINC001368412520 1339343172 /nfs/dbraw/zinc/34/31/72/1339343172.db2.gz QPPIODYGAUMZIQ-MRXNPFEDSA-N 1 3 349.494 2.967 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](CC[NH2+][C@H]2CCc3ccccc32)C1 ZINC001368420227 1339354360 /nfs/dbraw/zinc/35/43/60/1339354360.db2.gz MXQPNXSJPNAATO-PXNSSMCTSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C[C@H]1CCN1CC1CCC1)[NH+]1CCCCC1 ZINC001368447786 1339382559 /nfs/dbraw/zinc/38/25/59/1339382559.db2.gz BPFGBSUDIMPJNW-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1([NH2+]CCC2CCCCC2)CCC1 ZINC001368488929 1339425556 /nfs/dbraw/zinc/42/55/56/1339425556.db2.gz VWFNTLUXYLOLLZ-UHFFFAOYSA-N 1 3 332.492 2.860 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CCc2ccccc2)CCC1 ZINC001368498153 1339436085 /nfs/dbraw/zinc/43/60/85/1339436085.db2.gz ZKTMWACJPWYNOS-HDICACEKSA-N 1 3 343.515 2.730 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+]CC[C@H](C)F)CCC1)N1CCCCC1 ZINC001368499076 1339437091 /nfs/dbraw/zinc/43/70/91/1339437091.db2.gz YGJGZTYHIXFJGG-IRXDYDNUSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CCC[N@H+](Cc2cc(C)ccc2F)CC1)N(C)C ZINC001368512334 1339446709 /nfs/dbraw/zinc/44/67/09/1339446709.db2.gz KMPBUAVQFQURCU-HKUYNNGSSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CCC[N@@H+](Cc2cc(C)ccc2F)CC1)N(C)C ZINC001368512334 1339446711 /nfs/dbraw/zinc/44/67/11/1339446711.db2.gz KMPBUAVQFQURCU-HKUYNNGSSA-N 1 3 349.494 2.945 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)CCCN(C)C(=O)[C@@H]2CCCN2C)c1 ZINC001368524232 1339460386 /nfs/dbraw/zinc/46/03/86/1339460386.db2.gz HJVZEFSBNISBPX-LPHOPBHVSA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)CCCN(C)C(=O)[C@@H]2CCCN2C)c1 ZINC001368524232 1339460389 /nfs/dbraw/zinc/46/03/89/1339460389.db2.gz HJVZEFSBNISBPX-LPHOPBHVSA-N 1 3 347.503 2.631 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CCC3(CC3)CC2)C1 ZINC001368534947 1339472804 /nfs/dbraw/zinc/47/28/04/1339472804.db2.gz KVJMVPVQRKAYMF-HDICACEKSA-N 1 3 335.536 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[N@@H+](C)CCC(C)(C)C)C1 ZINC001389762905 1353606904 /nfs/dbraw/zinc/60/69/04/1353606904.db2.gz PACUWIPLYLIOTQ-QGZVFWFLSA-N 1 3 325.541 2.935 10 0 EFAEHO CC1CCC(C[NH2+][C@H]2C[C@H](CNC(=O)C3(N(C)C)CCC3)C2)CC1 ZINC001368571873 1339520918 /nfs/dbraw/zinc/52/09/18/1339520918.db2.gz IIYLVWXNQKRSKT-VNGAXPGBSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC)([NH2+]Cc2cnccc2C)CC1)N(C)C ZINC001368594201 1339540374 /nfs/dbraw/zinc/54/03/74/1339540374.db2.gz JOSKMNDJIURBQR-SFHVURJKSA-N 1 3 346.519 2.591 10 0 EFAEHO CCC1([NH2+]CC2CC(C)(C)C2)CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001368594482 1339541213 /nfs/dbraw/zinc/54/12/13/1339541213.db2.gz NGXCUJFELYLEDS-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(CC)CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001368601645 1339545064 /nfs/dbraw/zinc/54/50/64/1339545064.db2.gz TXMHWKOWLJQGRS-OAHLLOKOSA-N 1 3 327.488 2.580 10 0 EFAEHO CCC1([NH2+]CCF)CCN(C(=O)c2cccc(CN(C)C)c2)CC1 ZINC001368604353 1339545656 /nfs/dbraw/zinc/54/56/56/1339545656.db2.gz JTFYDXUMJBUPRJ-UHFFFAOYSA-N 1 3 335.467 2.692 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]1CC[C@@H]([NH2+]CCC(F)(F)F)C1 ZINC001368639954 1339560248 /nfs/dbraw/zinc/56/02/48/1339560248.db2.gz FHZBQLDKHQZJLH-RRFJBIMHSA-N 1 3 349.441 2.686 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001368663062 1339575854 /nfs/dbraw/zinc/57/58/54/1339575854.db2.gz ZBJRYEXBMCRHID-MJGOQNOKSA-N 1 3 331.504 2.580 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]1C ZINC001368695753 1339610920 /nfs/dbraw/zinc/61/09/20/1339610920.db2.gz KDALSRMNUBSUMS-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]1C ZINC001368695753 1339610924 /nfs/dbraw/zinc/61/09/24/1339610924.db2.gz KDALSRMNUBSUMS-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]C/C=C/c1ccccc1 ZINC001368737129 1339658156 /nfs/dbraw/zinc/65/81/56/1339658156.db2.gz PIRKJBAFZQJGRS-LJFWHQRKSA-N 1 3 329.488 2.526 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1nsc2ccccc12)N(C)C ZINC001368743858 1339667215 /nfs/dbraw/zinc/66/72/15/1339667215.db2.gz PJXBSZFOQKBYQE-XJKSGUPXSA-N 1 3 348.516 2.621 10 0 EFAEHO CCCN(C)CC(=O)N1CCCCC[C@@H]([NH2+]CCc2ccccc2)C1 ZINC001368748915 1339672338 /nfs/dbraw/zinc/67/23/38/1339672338.db2.gz LWPUUXBHIKVFRP-HXUWFJFHSA-N 1 3 345.531 2.932 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001368756924 1339683059 /nfs/dbraw/zinc/68/30/59/1339683059.db2.gz XCCPWHRFOAFMRA-YJBOKZPZSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001368812908 1339752087 /nfs/dbraw/zinc/75/20/87/1339752087.db2.gz WJPIFJIAOSFLSK-RRWXTXHCSA-N 1 3 343.515 2.889 10 0 EFAEHO CN(CC(=O)NC1CC(C[NH2+]Cc2ccsc2)C1)CC(C)(C)C ZINC001368817459 1339757003 /nfs/dbraw/zinc/75/70/03/1339757003.db2.gz AEMFHMJNSJTSGS-UHFFFAOYSA-N 1 3 337.533 2.710 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001368825170 1339764647 /nfs/dbraw/zinc/76/46/47/1339764647.db2.gz ZOMIUXZNVZKKNQ-ACBHZAAOSA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1CC[C@@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001368826918 1339767262 /nfs/dbraw/zinc/76/72/62/1339767262.db2.gz MYPZNAYHFAOTDS-HZPDHXFCSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@@H](F)C[N@H+]1CC[C@@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001368826918 1339767266 /nfs/dbraw/zinc/76/72/66/1339767266.db2.gz MYPZNAYHFAOTDS-HZPDHXFCSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCN(C/C=C\Cl)CC(C)(C)C1)[NH+](C)C ZINC001368828949 1339770368 /nfs/dbraw/zinc/77/03/68/1339770368.db2.gz VACRVDILJNFOSJ-VTBIRBAPSA-N 1 3 343.943 2.932 10 0 EFAEHO Cc1ccc(CN[C@H](C)[C@@H](C)NC(=O)CC[NH+](C)C)c(Cl)c1 ZINC001368856974 1339793758 /nfs/dbraw/zinc/79/37/58/1339793758.db2.gz ANBBFAZEAKOVRP-ZIAGYGMSSA-N 1 3 325.884 2.583 10 0 EFAEHO C[C@@H](NCc1ccccc1Cl)[C@@H](C)NC(=O)C12CCC[NH+]1CCC2 ZINC001368865078 1339799189 /nfs/dbraw/zinc/79/91/89/1339799189.db2.gz KYVBXIMSANAMJB-HUUCEWRRSA-N 1 3 349.906 2.951 10 0 EFAEHO C[C@@H](NCC=C(Cl)Cl)[C@H](C)NC(=O)CCC[NH+]1CCCC1 ZINC001368890421 1339828284 /nfs/dbraw/zinc/82/82/84/1339828284.db2.gz GJQJPUGMOUTABN-OLZOCXBDSA-N 1 3 336.307 2.664 10 0 EFAEHO CC(C)[NH2+]CC(C)(C)CN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001368920198 1339865607 /nfs/dbraw/zinc/86/56/07/1339865607.db2.gz UDWQTCBYHUIMEF-GOSISDBHSA-N 1 3 329.504 2.682 10 0 EFAEHO Cc1cc(CN2CC([C@@H](C)NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c(C)s1 ZINC001369097223 1339913310 /nfs/dbraw/zinc/91/33/10/1339913310.db2.gz PNPTUQDKBZCAFG-ZBFHGGJFSA-N 1 3 349.544 2.643 10 0 EFAEHO Cc1cc(CN2CC([C@@H](C)NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c(C)s1 ZINC001369097223 1339913314 /nfs/dbraw/zinc/91/33/14/1339913314.db2.gz PNPTUQDKBZCAFG-ZBFHGGJFSA-N 1 3 349.544 2.643 10 0 EFAEHO Cc1ccc(CN2C[C@@H](NC(=O)CCC[NH+](C)C)C(C)(C)C2)cc1 ZINC001369115439 1339927702 /nfs/dbraw/zinc/92/77/02/1339927702.db2.gz MCVATLIOZYTUGX-GOSISDBHSA-N 1 3 331.504 2.663 10 0 EFAEHO CCC[N@H+](C)C[C@@H]1CCCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001370303310 1340022481 /nfs/dbraw/zinc/02/24/81/1340022481.db2.gz LAQOXJLZIKTJGS-LPHOPBHVSA-N 1 3 341.515 2.779 10 0 EFAEHO CCC[N@@H+](C)C[C@@H]1CCCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001370303310 1340022485 /nfs/dbraw/zinc/02/24/85/1340022485.db2.gz LAQOXJLZIKTJGS-LPHOPBHVSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc3ccccc3c2)C1 ZINC001370424119 1340070963 /nfs/dbraw/zinc/07/09/63/1340070963.db2.gz BZTJAKGRJGBVOE-FQEVSTJZSA-N 1 3 339.483 2.871 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+][C@@H]2CCCc3ccc(F)cc32)C1 ZINC001370432620 1340075280 /nfs/dbraw/zinc/07/52/80/1340075280.db2.gz VBHMTYCBPCHSKP-PKOBYXMFSA-N 1 3 347.478 2.734 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001370591165 1340152386 /nfs/dbraw/zinc/15/23/86/1340152386.db2.gz LNEPSRMHPXIZBJ-SJLPKXTDSA-N 1 3 332.492 2.701 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001370591165 1340152387 /nfs/dbraw/zinc/15/23/87/1340152387.db2.gz LNEPSRMHPXIZBJ-SJLPKXTDSA-N 1 3 332.492 2.701 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001370641465 1340178822 /nfs/dbraw/zinc/17/88/22/1340178822.db2.gz VHFUIEQAIURINW-OTWHNJEPSA-N 1 3 331.504 2.626 10 0 EFAEHO Cc1cccc(C)c1C[N@H+]1CCC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001370794500 1340212619 /nfs/dbraw/zinc/21/26/19/1340212619.db2.gz RUMIVFHWZBKLMA-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+]1CCC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001370794500 1340212620 /nfs/dbraw/zinc/21/26/20/1340212620.db2.gz RUMIVFHWZBKLMA-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001371183275 1340399509 /nfs/dbraw/zinc/39/95/09/1340399509.db2.gz YHMMNZHYJLULPR-UZLBHIALSA-N 1 3 343.515 2.642 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)NCc1ccccc1F ZINC001371254139 1340444179 /nfs/dbraw/zinc/44/41/79/1340444179.db2.gz CVPVTFHMHMGKQQ-YJBOKZPZSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)NCc1ccccc1F ZINC001371254139 1340444183 /nfs/dbraw/zinc/44/41/83/1340444183.db2.gz CVPVTFHMHMGKQQ-YJBOKZPZSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)NCc1ccccc1F ZINC001371254137 1340444231 /nfs/dbraw/zinc/44/42/31/1340444231.db2.gz CVPVTFHMHMGKQQ-QAPCUYQASA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)NCc1ccccc1F ZINC001371254137 1340444233 /nfs/dbraw/zinc/44/42/33/1340444233.db2.gz CVPVTFHMHMGKQQ-QAPCUYQASA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@@H](N[C@H]1CCN(C(=O)CC[NH+](C)C)C1)c1ccc(F)cc1F ZINC001371529516 1340634169 /nfs/dbraw/zinc/63/41/69/1340634169.db2.gz MFDUHOFIWYGELT-WMLDXEAASA-N 1 3 339.430 2.558 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+][C@@H](C)c2cccc(F)c2)C1 ZINC001371622756 1340681248 /nfs/dbraw/zinc/68/12/48/1340681248.db2.gz VACIYPVLVLZGQS-HOTGVXAUSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)NCC[C@@H]1CCN(C/C=C\Cl)C1 ZINC001373186645 1340938558 /nfs/dbraw/zinc/93/85/58/1340938558.db2.gz BMNWBVYOEUJUTQ-PHCRLAQASA-N 1 3 341.927 2.688 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NCC[C@@H]1CCN(C/C=C\Cl)C1 ZINC001373186645 1340938559 /nfs/dbraw/zinc/93/85/59/1340938559.db2.gz BMNWBVYOEUJUTQ-PHCRLAQASA-N 1 3 341.927 2.688 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@@H]1CCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001373309022 1340985208 /nfs/dbraw/zinc/98/52/08/1340985208.db2.gz DQGFODPARXPVIX-ZWKOTPCHSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001373309022 1340985209 /nfs/dbraw/zinc/98/52/09/1340985209.db2.gz DQGFODPARXPVIX-ZWKOTPCHSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)C[C@H](C)CN1C[C@@H]2C[C@H]1CN2C(=O)C(C)(C)[NH+]1CCCC1 ZINC001373572628 1341057748 /nfs/dbraw/zinc/05/77/48/1341057748.db2.gz MBSLFYJQVNLHSJ-BZSNNMDCSA-N 1 3 335.536 2.828 10 0 EFAEHO CC(C)c1ccc(CN2CC[C@@H](N(C)C(=O)CC[NH+](C)C)C2)cc1 ZINC001373679624 1341096813 /nfs/dbraw/zinc/09/68/13/1341096813.db2.gz KBPGJHLJNKGWJV-LJQANCHMSA-N 1 3 331.504 2.794 10 0 EFAEHO CCN(C(=O)C[C@@H]1CC[N@H+](C)C1)[C@@H]1CCN(Cc2cccc(C)c2)C1 ZINC001373714563 1341117578 /nfs/dbraw/zinc/11/75/78/1341117578.db2.gz FOTOFRSLZFAOGP-VQTJNVASSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)C[C@@H]1CC[N@@H+](C)C1)[C@@H]1CCN(Cc2cccc(C)c2)C1 ZINC001373714563 1341117579 /nfs/dbraw/zinc/11/75/79/1341117579.db2.gz FOTOFRSLZFAOGP-VQTJNVASSA-N 1 3 343.515 2.760 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)NCc1cccc(C(C)C)n1 ZINC001373750381 1341133365 /nfs/dbraw/zinc/13/33/65/1341133365.db2.gz ATCJZGNXPQSPDF-JFIYKMOQSA-N 1 3 346.519 2.530 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)NCc1cccc(C(C)C)n1 ZINC001373750381 1341133367 /nfs/dbraw/zinc/13/33/67/1341133367.db2.gz ATCJZGNXPQSPDF-JFIYKMOQSA-N 1 3 346.519 2.530 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]CC1CC2(CCC2)C1 ZINC001373753297 1341134433 /nfs/dbraw/zinc/13/44/33/1341134433.db2.gz MFYWNMVYSISCTD-ZWKOTPCHSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]CCc1ccccc1 ZINC001373754005 1341134799 /nfs/dbraw/zinc/13/47/99/1341134799.db2.gz OAJOFDYMTDRFKE-RBUKOAKNSA-N 1 3 331.504 2.586 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccc(F)cc1C ZINC001373754950 1341135373 /nfs/dbraw/zinc/13/53/73/1341135373.db2.gz QRGFGOJHGFZBRL-OALUTQOASA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccccc1C ZINC001373779643 1341144290 /nfs/dbraw/zinc/14/42/90/1341144290.db2.gz CTVJDYGBURETBG-SFHVURJKSA-N 1 3 331.504 2.854 10 0 EFAEHO CN(CC(=O)NCCC1CC[NH+](Cc2ccsc2)CC1)C1CCC1 ZINC001373939446 1341225013 /nfs/dbraw/zinc/22/50/13/1341225013.db2.gz XRPWHKKXTDMVGV-UHFFFAOYSA-N 1 3 349.544 2.951 10 0 EFAEHO C[C@@H](CNC/C(Cl)=C\Cl)CNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001374047012 1341334620 /nfs/dbraw/zinc/33/46/20/1341334620.db2.gz HDCQUIWVZXNKRP-OXBCTQFSSA-N 1 3 336.307 2.522 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001374079807 1341373604 /nfs/dbraw/zinc/37/36/04/1341373604.db2.gz QESFNWICJBOLAD-MSOLQXFVSA-N 1 3 345.531 2.994 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H](C)C[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001374096972 1341397502 /nfs/dbraw/zinc/39/75/02/1341397502.db2.gz IQTOJWKXRWEVAJ-YOEHRIQHSA-N 1 3 339.911 2.831 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)C[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001374096967 1341397595 /nfs/dbraw/zinc/39/75/95/1341397595.db2.gz IQTOJWKXRWEVAJ-WMLDXEAASA-N 1 3 339.911 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+]Cc1cccc(Cl)c1 ZINC001374111376 1341420898 /nfs/dbraw/zinc/42/08/98/1341420898.db2.gz CTCDGUOBGBDLOK-AWEZNQCLSA-N 1 3 325.884 2.522 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C[C@H](C)N(C)C(=O)[C@@H]1CCCN1C ZINC001374204208 1341552500 /nfs/dbraw/zinc/55/25/00/1341552500.db2.gz CRMXPMZBIAHHCV-LPHOPBHVSA-N 1 3 331.504 2.841 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(F)c(Cl)c1)N(C)C(=O)[C@@H]1CCCN1C ZINC001374206281 1341553757 /nfs/dbraw/zinc/55/37/57/1341553757.db2.gz NJQSZMJPPNJPLP-LRDDRELGSA-N 1 3 341.858 2.510 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H](C)N(C)C(=O)[C@H]2CCCCN2C)c1 ZINC001374248872 1341606380 /nfs/dbraw/zinc/60/63/80/1341606380.db2.gz XCCUKQJZCAOKBK-MAUKXSAKSA-N 1 3 335.467 2.555 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccccc1C1CC1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001374280184 1341651615 /nfs/dbraw/zinc/65/16/15/1341651615.db2.gz LPYNLHCGVAKCCH-IAGOWNOFSA-N 1 3 343.515 2.842 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1csc(C)c1 ZINC001374327698 1341730711 /nfs/dbraw/zinc/73/07/11/1341730711.db2.gz JSANDMYOBKODOW-YOEHRIQHSA-N 1 3 337.533 2.867 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)c1 ZINC001392237169 1355894064 /nfs/dbraw/zinc/89/40/64/1355894064.db2.gz OYKRLYHXZCXLQG-QFBILLFUSA-N 1 3 349.494 2.706 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC001374455502 1341936199 /nfs/dbraw/zinc/93/61/99/1341936199.db2.gz SLYDXJUTNYBKMT-RTBURBONSA-N 1 3 349.494 2.884 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)C(C)(C)[NH+]1CCCC1 ZINC001374525515 1342019950 /nfs/dbraw/zinc/01/99/50/1342019950.db2.gz VYHXNJFGXTWJSA-UHFFFAOYSA-N 1 3 337.533 2.555 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]Cc1ccc(C(F)F)cc1)N(C)C ZINC001374774813 1342163516 /nfs/dbraw/zinc/16/35/16/1342163516.db2.gz BPSIYZJUDYJDOI-IUODEOHRSA-N 1 3 327.419 2.559 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001374777744 1342165548 /nfs/dbraw/zinc/16/55/48/1342165548.db2.gz XCZPMIGPTZXBAO-OAHLLOKOSA-N 1 3 349.906 2.810 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001374895786 1342228303 /nfs/dbraw/zinc/22/83/03/1342228303.db2.gz VPUSJTYBESEOLQ-IRXDYDNUSA-N 1 3 331.504 2.943 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc(F)cc1 ZINC001374939227 1342254077 /nfs/dbraw/zinc/25/40/77/1342254077.db2.gz DINFGHDYUPKMQS-MAUKXSAKSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(F)c1 ZINC001375041266 1342340687 /nfs/dbraw/zinc/34/06/87/1342340687.db2.gz XREAFDFMFWBENJ-YJBOKZPZSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(F)c1 ZINC001375041266 1342340690 /nfs/dbraw/zinc/34/06/90/1342340690.db2.gz XREAFDFMFWBENJ-YJBOKZPZSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(F)c1 ZINC001375041261 1342341101 /nfs/dbraw/zinc/34/11/01/1342341101.db2.gz XREAFDFMFWBENJ-MAUKXSAKSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(F)c1 ZINC001375041261 1342341111 /nfs/dbraw/zinc/34/11/11/1342341111.db2.gz XREAFDFMFWBENJ-MAUKXSAKSA-N 1 3 335.467 2.635 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCc1cccc(F)c1)NC(=O)CN1CC[C@@H](C)C1 ZINC001375105949 1342415447 /nfs/dbraw/zinc/41/54/47/1342415447.db2.gz UYPVJIYKXUMXSU-SJORKVTESA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCc1cccc(F)c1)NC(=O)CN1CC[C@@H](C)C1 ZINC001375105949 1342415451 /nfs/dbraw/zinc/41/54/51/1342415451.db2.gz UYPVJIYKXUMXSU-SJORKVTESA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@H](C[N@H+](C)CC/C=C/c1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001375105990 1342415842 /nfs/dbraw/zinc/41/58/42/1342415842.db2.gz VKWPVEUOBGHHQV-BLRGSVSVSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@H](C[N@@H+](C)CC/C=C/c1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001375105990 1342415848 /nfs/dbraw/zinc/41/58/48/1342415848.db2.gz VKWPVEUOBGHHQV-BLRGSVSVSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](NC(=O)[C@H]2CCCN2C(C)C)C2CC2)cc1 ZINC001375221800 1342524308 /nfs/dbraw/zinc/52/43/08/1342524308.db2.gz DBNFMANSUYWHDS-WOJBJXKFSA-N 1 3 343.515 2.852 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H](NC(=O)[C@@H]1CCCN1C(C)C)C1CC1 ZINC001375226481 1342529110 /nfs/dbraw/zinc/52/91/10/1342529110.db2.gz WVEUDBPLEKKRQH-PMACEKPBSA-N 1 3 343.515 2.852 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001375228787 1342532142 /nfs/dbraw/zinc/53/21/42/1342532142.db2.gz LEGQQRPIRAEBOT-RTBURBONSA-N 1 3 329.488 2.545 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1c(C)cccc1C)C1CC1)N(C)C ZINC001375272898 1342579743 /nfs/dbraw/zinc/57/97/43/1342579743.db2.gz PRADBEWDABCZJS-RBUKOAKNSA-N 1 3 331.504 2.628 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](NC(=O)CN(C)C(C)C)C2CC2)cc1C ZINC001375277637 1342584111 /nfs/dbraw/zinc/58/41/11/1342584111.db2.gz OLVAPRHJDQSSMH-LJQANCHMSA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]Cc1ccccc1F ZINC001375281004 1342588732 /nfs/dbraw/zinc/58/87/32/1342588732.db2.gz GAHXOGSRDNJNAU-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CC2CC(C)(C)C2)[C@H](CC)C1 ZINC001375285226 1342592774 /nfs/dbraw/zinc/59/27/74/1342592774.db2.gz KXJUSJUDWIECDR-MSOLQXFVSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@@H]3CCC[C@@H]4CCC[N@@H+]43)CC2)cs1 ZINC001375504014 1342809822 /nfs/dbraw/zinc/80/98/22/1342809822.db2.gz FGLISCJBBYWFHV-SJORKVTESA-N 1 3 347.528 2.812 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@@H]3CCC[C@@H]4CCC[N@H+]43)CC2)cs1 ZINC001375504014 1342809827 /nfs/dbraw/zinc/80/98/27/1342809827.db2.gz FGLISCJBBYWFHV-SJORKVTESA-N 1 3 347.528 2.812 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@H]2C[C@@H](NCC=C(Cl)Cl)C2)CC[N@@H+]1C ZINC001375503752 1342810115 /nfs/dbraw/zinc/81/01/15/1342810115.db2.gz UTMKGCNQBIXIDA-XDQVBPFNSA-N 1 3 348.318 2.520 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@H]2C[C@@H](NCC=C(Cl)Cl)C2)CC[N@H+]1C ZINC001375503752 1342810123 /nfs/dbraw/zinc/81/01/23/1342810123.db2.gz UTMKGCNQBIXIDA-XDQVBPFNSA-N 1 3 348.318 2.520 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]Cc2ccc(CF)cc2)CC1 ZINC001375552432 1342867124 /nfs/dbraw/zinc/86/71/24/1342867124.db2.gz JFRYCWCNMTUBNK-HOTGVXAUSA-N 1 3 347.478 2.767 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2cccc3ccccc32)CC1 ZINC001375553060 1342867172 /nfs/dbraw/zinc/86/71/72/1342867172.db2.gz KVAKEVYECNPVFR-UHFFFAOYSA-N 1 3 339.483 2.918 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1C[C@@H]([NH2+]CC2CCCC2)C1)N1CCCCCC1 ZINC001375556383 1342871780 /nfs/dbraw/zinc/87/17/80/1342871780.db2.gz DDZRQIGHDDERHN-QRQLOZEOSA-N 1 3 335.536 2.926 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1C[C@H]([NH2+]CC2CCC3(CC3)CC2)C1 ZINC001375558654 1342874489 /nfs/dbraw/zinc/87/44/89/1342874489.db2.gz UEGFNVVBABDNLA-IYARVYRRSA-N 1 3 335.536 2.783 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@H+](CC2CCC2)C1 ZINC001375568383 1342884779 /nfs/dbraw/zinc/88/47/79/1342884779.db2.gz DWLBFJMLQZYQIW-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@@H+](CC2CCC2)C1 ZINC001375568383 1342884783 /nfs/dbraw/zinc/88/47/83/1342884783.db2.gz DWLBFJMLQZYQIW-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H]1CC[C@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001375574295 1342891949 /nfs/dbraw/zinc/89/19/49/1342891949.db2.gz ATMZLCKDPCAZQW-PWIZWCRZSA-N 1 3 345.531 2.964 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CCc2ccccc2)C1)N(C)C ZINC001375573907 1342892385 /nfs/dbraw/zinc/89/23/85/1342892385.db2.gz PGBWAVCLPWNGGE-XUVXKRRUSA-N 1 3 345.531 2.690 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)CN(C)C3CCC3)C2)cc1 ZINC001375577501 1342896110 /nfs/dbraw/zinc/89/61/10/1342896110.db2.gz QHXYRQSDBKWFCY-RBUKOAKNSA-N 1 3 343.515 2.854 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C/Cl)C1 ZINC001375578512 1342898218 /nfs/dbraw/zinc/89/82/18/1342898218.db2.gz XLZMJJFSGNVVAG-FTMUDOFOSA-N 1 3 341.927 2.876 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001375578478 1342898354 /nfs/dbraw/zinc/89/83/54/1342898354.db2.gz UVHQEVPTIPUOSM-RBUKOAKNSA-N 1 3 343.515 2.854 10 0 EFAEHO CC[N@H+](C)[C@@H](C(=O)N(C)C1CN(CCC(C)C)C1)c1ccccc1 ZINC001375721283 1342952923 /nfs/dbraw/zinc/95/29/23/1342952923.db2.gz WENQWIBMVSWZDD-LJQANCHMSA-N 1 3 331.504 2.868 10 0 EFAEHO CC[N@@H+](C)[C@@H](C(=O)N(C)C1CN(CCC(C)C)C1)c1ccccc1 ZINC001375721283 1342952926 /nfs/dbraw/zinc/95/29/26/1342952926.db2.gz WENQWIBMVSWZDD-LJQANCHMSA-N 1 3 331.504 2.868 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C[NH2+]Cc1ccsc1)C1CCCC1)N(C)C ZINC001375798351 1343026657 /nfs/dbraw/zinc/02/66/57/1343026657.db2.gz WCYKKXCDTYJROE-SJORKVTESA-N 1 3 337.533 2.853 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCC1)N(CC)CC ZINC001375800523 1343028439 /nfs/dbraw/zinc/02/84/39/1343028439.db2.gz DETCLRNRGDXKEB-QYZOEREBSA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2CC1CCC1)N(CC)CC ZINC001375800523 1343028451 /nfs/dbraw/zinc/02/84/51/1343028451.db2.gz DETCLRNRGDXKEB-QYZOEREBSA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)c1ccc(CN2CC[C@@](C)(NC(=O)CC[NH+](C)C)C2)cc1 ZINC001375844099 1343081930 /nfs/dbraw/zinc/08/19/30/1343081930.db2.gz ORMXWOMBOJNMOL-HXUWFJFHSA-N 1 3 331.504 2.842 10 0 EFAEHO Cc1cc(CN2CC[C@](C)(NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c(C)s1 ZINC001375851020 1343094870 /nfs/dbraw/zinc/09/48/70/1343094870.db2.gz RWSNGOODMJXWFK-LPHOPBHVSA-N 1 3 349.544 2.787 10 0 EFAEHO Cc1cc(CN2CC[C@](C)(NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c(C)s1 ZINC001375851020 1343094874 /nfs/dbraw/zinc/09/48/74/1343094874.db2.gz RWSNGOODMJXWFK-LPHOPBHVSA-N 1 3 349.544 2.787 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@]2(C)CCN(C(=O)[C@@H]3CCCN3C)C2)c1 ZINC001375865011 1343112552 /nfs/dbraw/zinc/11/25/52/1343112552.db2.gz AWHYSVJBDHWHSO-ICSRJNTNSA-N 1 3 347.478 2.557 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CC[C@](C)(C[NH2+]CC2CCC2)C1 ZINC001375888424 1343134797 /nfs/dbraw/zinc/13/47/97/1343134797.db2.gz JTHHSFYXHGDDDM-AZUAARDMSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)NC[C@]1(C)CCC[N@H+](CCc2ccccc2)C1)N(C)C ZINC001375962708 1343222368 /nfs/dbraw/zinc/22/23/68/1343222368.db2.gz ZXHBWFHZTXHYRL-CTNGQTDRSA-N 1 3 345.531 2.788 10 0 EFAEHO CC[C@H](C(=O)NC[C@]1(C)CCC[N@@H+](CCc2ccccc2)C1)N(C)C ZINC001375962708 1343222369 /nfs/dbraw/zinc/22/23/69/1343222369.db2.gz ZXHBWFHZTXHYRL-CTNGQTDRSA-N 1 3 345.531 2.788 10 0 EFAEHO Cc1ncccc1C[NH2+][C@@H](C)[C@@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001376007522 1343255320 /nfs/dbraw/zinc/25/53/20/1343255320.db2.gz CDZIACIWKJAYNR-HKUYNNGSSA-N 1 3 346.519 2.589 10 0 EFAEHO CC[C@@H](C)C[NH+]1CCC(N(C)C(=O)CN(C)CC(C)(C)C)CC1 ZINC001376011562 1343258628 /nfs/dbraw/zinc/25/86/28/1343258628.db2.gz DENIXMQCTTYXKW-MRXNPFEDSA-N 1 3 325.541 2.933 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]Cc2ccc(F)cc2C)CC1 ZINC001393745831 1357121159 /nfs/dbraw/zinc/12/11/59/1357121159.db2.gz CHMFPZSOKHWLQT-UHFFFAOYSA-N 1 3 349.494 2.947 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001376028964 1343270727 /nfs/dbraw/zinc/27/07/27/1343270727.db2.gz IAFFXHXIORAGKT-KURKYZTESA-N 1 3 335.536 2.687 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCCN(CCc2ccccc2)C1)[NH+](CC)CC ZINC001376066484 1343299834 /nfs/dbraw/zinc/29/98/34/1343299834.db2.gz BXHGOBFSEYRDHD-WOJBJXKFSA-N 1 3 345.531 2.930 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001393746322 1357121056 /nfs/dbraw/zinc/12/10/56/1357121056.db2.gz SWRJZNBCSPMRIG-QFBILLFUSA-N 1 3 331.504 2.526 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(C)([NH2+]C/C=C\Cl)CC1 ZINC001393750162 1357124048 /nfs/dbraw/zinc/12/40/48/1357124048.db2.gz JHRABLGVNRGMCM-IZIDJEDMSA-N 1 3 327.900 2.584 10 0 EFAEHO CN(CC(=O)N[C@H]1CC12CC[NH+](Cc1ccsc1)CC2)C1CCC1 ZINC001376171668 1343372777 /nfs/dbraw/zinc/37/27/77/1343372777.db2.gz IMVGDEMAMFNQTQ-KRWDZBQOSA-N 1 3 347.528 2.703 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC12CC[NH+](CCC1CCCC1)CC2 ZINC001376182197 1343383847 /nfs/dbraw/zinc/38/38/47/1343383847.db2.gz VUDGQPJBMGKRHT-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1ccsc1)C1CC1 ZINC001376212031 1343402349 /nfs/dbraw/zinc/40/23/49/1343402349.db2.gz BUYHYQVEWHNVKO-SJORKVTESA-N 1 3 335.517 2.605 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]([NH2+][C@H]1CCc2ccccc21)C1CC1 ZINC001376252311 1343429560 /nfs/dbraw/zinc/42/95/60/1343429560.db2.gz CJDIAYBDSHQVAP-RBUKOAKNSA-N 1 3 329.488 2.500 10 0 EFAEHO CCC(CC)C[N@H+](C)C[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001376293959 1343463425 /nfs/dbraw/zinc/46/34/25/1343463425.db2.gz WWRQDJXXOFIMGS-GOSISDBHSA-N 1 3 325.541 2.933 10 0 EFAEHO CCC(CC)C[N@@H+](C)C[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001376293959 1343463426 /nfs/dbraw/zinc/46/34/26/1343463426.db2.gz WWRQDJXXOFIMGS-GOSISDBHSA-N 1 3 325.541 2.933 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2C[C@H](F)CC ZINC001376426001 1343581202 /nfs/dbraw/zinc/58/12/02/1343581202.db2.gz FNYZRFNBWLRMDQ-MGNMYUMUSA-N 1 3 327.488 2.578 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2C[C@H](F)CC ZINC001376426001 1343581204 /nfs/dbraw/zinc/58/12/04/1343581204.db2.gz FNYZRFNBWLRMDQ-MGNMYUMUSA-N 1 3 327.488 2.578 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]2CN(Cc3ccsc3)CC[C@@H]21 ZINC001376451150 1343604120 /nfs/dbraw/zinc/60/41/20/1343604120.db2.gz KOXALVNJBIXSEI-SJORKVTESA-N 1 3 335.517 2.513 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2cc(Cl)ccc2F)C1 ZINC001376487246 1343622348 /nfs/dbraw/zinc/62/23/48/1343622348.db2.gz ABYIOCUIIYQEII-GASCZTMLSA-N 1 3 341.858 2.558 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2cc(Cl)ccc2F)C1 ZINC001376487246 1343622349 /nfs/dbraw/zinc/62/23/49/1343622349.db2.gz ABYIOCUIIYQEII-GASCZTMLSA-N 1 3 341.858 2.558 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H](NCc2ccccc2F)C1)[NH+]1CCCC1 ZINC001376511754 1343639199 /nfs/dbraw/zinc/63/91/99/1343639199.db2.gz KPSSYBOEJQGGQS-SCTDSRPQSA-N 1 3 347.478 2.683 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]2[C@H]1CC[N@@H+]2CC1CCC1)N(CC)CC ZINC001376521892 1343646579 /nfs/dbraw/zinc/64/65/79/1343646579.db2.gz XEXDIBJNKVQRSZ-GUDVDZBRSA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]2[C@H]1CC[N@H+]2CC1CCC1)N(CC)CC ZINC001376521892 1343646580 /nfs/dbraw/zinc/64/65/80/1343646580.db2.gz XEXDIBJNKVQRSZ-GUDVDZBRSA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]2[C@@H]1CC[N@@H+]2CC1CCC1)N(CC)CC ZINC001376521900 1343646676 /nfs/dbraw/zinc/64/66/76/1343646676.db2.gz XEXDIBJNKVQRSZ-QRVBRYPASA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]2[C@@H]1CC[N@H+]2CC1CCC1)N(CC)CC ZINC001376521900 1343646679 /nfs/dbraw/zinc/64/66/79/1343646679.db2.gz XEXDIBJNKVQRSZ-QRVBRYPASA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCC[N@@H+]1CCC(C)(C)C)N(C)C ZINC001376585787 1343705020 /nfs/dbraw/zinc/70/50/20/1343705020.db2.gz SCUZDYKFXMNLAB-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCC[N@H+]1CCC(C)(C)C)N(C)C ZINC001376585787 1343705023 /nfs/dbraw/zinc/70/50/23/1343705023.db2.gz SCUZDYKFXMNLAB-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCC[C@@H]1CNCc1sccc1Cl ZINC001376608031 1343718296 /nfs/dbraw/zinc/71/82/96/1343718296.db2.gz XLBPLPJMDCRLCE-CYBMUJFWSA-N 1 3 343.924 2.824 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+]C[C@@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001376618361 1343725568 /nfs/dbraw/zinc/72/55/68/1343725568.db2.gz RWHVITAPOZQXPU-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C)C[NH+]1CCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)CC1 ZINC001376627093 1343733420 /nfs/dbraw/zinc/73/34/20/1343733420.db2.gz SNIZCKWNNFDATI-QGZVFWFLSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1C[NH2+]CC1CC2(CCC2)C1 ZINC001376709959 1343776771 /nfs/dbraw/zinc/77/67/71/1343776771.db2.gz UZRZNGJYEUUDEV-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)NCc1cc2ccccc2o1 ZINC001376713759 1343778585 /nfs/dbraw/zinc/77/85/85/1343778585.db2.gz BUVSOMKUHPHYCS-QAPCUYQASA-N 1 3 343.471 2.900 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)NCc1cc2ccccc2o1 ZINC001376713759 1343778590 /nfs/dbraw/zinc/77/85/90/1343778590.db2.gz BUVSOMKUHPHYCS-QAPCUYQASA-N 1 3 343.471 2.900 10 0 EFAEHO CC(C)c1ccccc1C[NH2+][C@@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001376800340 1343849864 /nfs/dbraw/zinc/84/98/64/1343849864.db2.gz LLEJOOWVFKAJPH-IRXDYDNUSA-N 1 3 331.504 2.746 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@H]2CCCCN2C(C)C)cc1 ZINC001376826659 1343876053 /nfs/dbraw/zinc/87/60/53/1343876053.db2.gz PZWNMHNRZOEPMR-PKOBYXMFSA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CNC(=O)[C@@H]2CCCCN2C(C)C)cc1 ZINC001376826653 1343876196 /nfs/dbraw/zinc/87/61/96/1343876196.db2.gz PZWNMHNRZOEPMR-MJGOQNOKSA-N 1 3 331.504 2.852 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]Cc1cccc(C(F)F)c1 ZINC001376882799 1343918318 /nfs/dbraw/zinc/91/83/18/1343918318.db2.gz QYPJJSVWPDXGSE-CYBMUJFWSA-N 1 3 327.419 2.559 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[N@H+](Cc2ccc(C)nc2C)CC1 ZINC001376906568 1343945370 /nfs/dbraw/zinc/94/53/70/1343945370.db2.gz BYXUCIHFRRAISF-IBGZPJMESA-N 1 3 346.519 2.511 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[N@@H+](Cc2ccc(C)nc2C)CC1 ZINC001376906568 1343945373 /nfs/dbraw/zinc/94/53/73/1343945373.db2.gz BYXUCIHFRRAISF-IBGZPJMESA-N 1 3 346.519 2.511 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](NCc2ccccc2F)C1)[NH+](CC)CC ZINC001376912283 1343951318 /nfs/dbraw/zinc/95/13/18/1343951318.db2.gz OHTCSWPHRSMSMV-WMZOPIPTSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@H](NCc2ccc(C)cc2Cl)C1 ZINC001376914004 1343952665 /nfs/dbraw/zinc/95/26/65/1343952665.db2.gz FMPVPZDSVUUSPY-INIZCTEOSA-N 1 3 337.895 2.681 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@H](NCc2ccc(C)cc2Cl)C1 ZINC001376914004 1343952670 /nfs/dbraw/zinc/95/26/70/1343952670.db2.gz FMPVPZDSVUUSPY-INIZCTEOSA-N 1 3 337.895 2.681 10 0 EFAEHO CC(C)(C(=O)N1CC[C@H](CNC/C(Cl)=C/Cl)C1)[NH+]1CCCC1 ZINC001376941692 1343972632 /nfs/dbraw/zinc/97/26/32/1343972632.db2.gz OHKOMGOZTAYFFF-CKXDQPNJSA-N 1 3 348.318 2.618 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001376943300 1343974467 /nfs/dbraw/zinc/97/44/67/1343974467.db2.gz RJBQSYWDNHSKAY-FUHWJXTLSA-N 1 3 341.515 2.922 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001376943300 1343974470 /nfs/dbraw/zinc/97/44/70/1343974470.db2.gz RJBQSYWDNHSKAY-FUHWJXTLSA-N 1 3 341.515 2.922 10 0 EFAEHO Cc1ncccc1CN(C)CCCN(C)C(=O)C(C)(C)[NH+]1CCCC1 ZINC001376968214 1343996166 /nfs/dbraw/zinc/99/61/66/1343996166.db2.gz ZYZJKCOISQSFOG-UHFFFAOYSA-N 1 3 346.519 2.545 10 0 EFAEHO Cc1ncccc1CN(C)CCCN(C)C(=O)C[NH+]1[C@@H](C)CC[C@@H]1C ZINC001377017166 1344063272 /nfs/dbraw/zinc/06/32/72/1344063272.db2.gz JKWQLGIOOROXGQ-IRXDYDNUSA-N 1 3 346.519 2.543 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)C[NH+]1[C@H](C)CC[C@H]1C ZINC001377273441 1344145956 /nfs/dbraw/zinc/14/59/56/1344145956.db2.gz MQDCBNSOFWAPHC-QZTJIDSGSA-N 1 3 331.504 2.724 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@@H+]1CCC1CC1)N1CCCCC1 ZINC001377419555 1344161231 /nfs/dbraw/zinc/16/12/31/1344161231.db2.gz UEHBOOVXDQXVEV-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@H+]1CCC1CC1)N1CCCCC1 ZINC001377419555 1344161233 /nfs/dbraw/zinc/16/12/33/1344161233.db2.gz UEHBOOVXDQXVEV-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]CCN(C)C(=O)[C@H](C(C)C)N(C)C)c1 ZINC001377573689 1344184652 /nfs/dbraw/zinc/18/46/52/1344184652.db2.gz KUWSYPOCJLXVRY-MJGOQNOKSA-N 1 3 333.520 2.999 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[NH2+][C@H]2CCc3ccc(Cl)cc32)C1 ZINC001377590686 1344196863 /nfs/dbraw/zinc/19/68/63/1344196863.db2.gz JRELHDNNHSICKC-KDOFPFPSSA-N 1 3 349.906 2.717 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]CCN(C)C(=O)CN2CCC(C)CC2)c1 ZINC001377590990 1344198102 /nfs/dbraw/zinc/19/81/02/1344198102.db2.gz GPHNDYOFVNWEHV-QGZVFWFLSA-N 1 3 347.503 2.536 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H](C)[NH2+]CCC(C)(C)C)CC1 ZINC001377613890 1344222401 /nfs/dbraw/zinc/22/24/01/1344222401.db2.gz WATQNYXXPFUCTR-MRXNPFEDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@H](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001377619772 1344228828 /nfs/dbraw/zinc/22/88/28/1344228828.db2.gz XPPAVYUXLCIQBQ-NVXWUHKLSA-N 1 3 343.531 2.929 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(C)C[C@@H]1CCCN1C(=O)CC[NH+](C)C ZINC001377659663 1344279954 /nfs/dbraw/zinc/27/99/54/1344279954.db2.gz GMAGGJOGAWVNDS-YJBOKZPZSA-N 1 3 335.467 2.761 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H]([C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001377673908 1344302032 /nfs/dbraw/zinc/30/20/32/1344302032.db2.gz HQVXEKDQWBOGHI-QZTJIDSGSA-N 1 3 346.519 2.949 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H]([C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001377673908 1344302036 /nfs/dbraw/zinc/30/20/36/1344302036.db2.gz HQVXEKDQWBOGHI-QZTJIDSGSA-N 1 3 346.519 2.949 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H]([C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001377673915 1344302622 /nfs/dbraw/zinc/30/26/22/1344302622.db2.gz HQVXEKDQWBOGHI-ZWKOTPCHSA-N 1 3 346.519 2.949 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H]([C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001377673915 1344302624 /nfs/dbraw/zinc/30/26/24/1344302624.db2.gz HQVXEKDQWBOGHI-ZWKOTPCHSA-N 1 3 346.519 2.949 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CCC[N@H+](CC3CC3)C2)CC1 ZINC001377679217 1344311322 /nfs/dbraw/zinc/31/13/22/1344311322.db2.gz VGGZOIYEDLDVRB-IBGZPJMESA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CCC[N@@H+](CC3CC3)C2)CC1 ZINC001377679217 1344311324 /nfs/dbraw/zinc/31/13/24/1344311324.db2.gz VGGZOIYEDLDVRB-IBGZPJMESA-N 1 3 335.536 2.687 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@@H]2CC[N@H+](CC3CC4(CCC4)C3)C2)CCC1 ZINC001377690309 1344326905 /nfs/dbraw/zinc/32/69/05/1344326905.db2.gz CNVAVOUAAOIEHP-QGZVFWFLSA-N 1 3 347.547 2.879 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@@H]2CC[N@@H+](CC3CC4(CCC4)C3)C2)CCC1 ZINC001377690309 1344326909 /nfs/dbraw/zinc/32/69/09/1344326909.db2.gz CNVAVOUAAOIEHP-QGZVFWFLSA-N 1 3 347.547 2.879 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CC2CC(NC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001377718941 1344365194 /nfs/dbraw/zinc/36/51/94/1344365194.db2.gz XLMWTJMANVETLU-UHFFFAOYSA-N 1 3 347.478 2.603 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@H]1CC[N@H+](CCC(C)(C)C)C1)N(C)C ZINC001377718126 1344365393 /nfs/dbraw/zinc/36/53/93/1344365393.db2.gz HIVBJJVBSRGBGO-IRXDYDNUSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@H]1CC[N@@H+](CCC(C)(C)C)C1)N(C)C ZINC001377718126 1344365395 /nfs/dbraw/zinc/36/53/95/1344365395.db2.gz HIVBJJVBSRGBGO-IRXDYDNUSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2cccc(C)c2)C1)N(C)C ZINC001377721614 1344369761 /nfs/dbraw/zinc/36/97/61/1344369761.db2.gz LZZOAIUOSBPBMW-PKOBYXMFSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2cccc(C)c2)C1)N(C)C ZINC001377721614 1344369767 /nfs/dbraw/zinc/36/97/67/1344369767.db2.gz LZZOAIUOSBPBMW-PKOBYXMFSA-N 1 3 331.504 2.663 10 0 EFAEHO C[C@@H](CCNC(=O)CN(C)CC(C)(C)C)[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001393818514 1357182406 /nfs/dbraw/zinc/18/24/06/1357182406.db2.gz WDFRCHPHRKGBOF-GJZGRUSLSA-N 1 3 347.494 2.884 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]Cc2ccccc2Cl)C1 ZINC001377733513 1344382694 /nfs/dbraw/zinc/38/26/94/1344382694.db2.gz LYJFVXNNHKJPFX-UHFFFAOYSA-N 1 3 337.895 2.665 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+](C)C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001377782777 1344433282 /nfs/dbraw/zinc/43/32/82/1344433282.db2.gz KUMUZKMPSYACJL-QGZVFWFLSA-N 1 3 349.494 2.755 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+](C)C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001377782777 1344433286 /nfs/dbraw/zinc/43/32/86/1344433286.db2.gz KUMUZKMPSYACJL-QGZVFWFLSA-N 1 3 349.494 2.755 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H]([NH2+]C/C=C/c3ccccc3)C2)C1 ZINC001377798413 1344449928 /nfs/dbraw/zinc/44/99/28/1344449928.db2.gz ZQAYGYRITJYBGR-JAZSWGADSA-N 1 3 341.499 2.622 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001377805398 1344455882 /nfs/dbraw/zinc/45/58/82/1344455882.db2.gz ISFDXXCZNKWOAK-KBPBESRZSA-N 1 3 337.895 2.807 10 0 EFAEHO C[C@@H](NCc1ccccn1)[C@@H](C)NC(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001377822241 1344476551 /nfs/dbraw/zinc/47/65/51/1344476551.db2.gz ZJQPKGCRCKHINX-HZPDHXFCSA-N 1 3 346.519 2.717 10 0 EFAEHO C[C@@H](NCc1ccccn1)[C@@H](C)NC(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001377822241 1344476554 /nfs/dbraw/zinc/47/65/54/1344476554.db2.gz ZJQPKGCRCKHINX-HZPDHXFCSA-N 1 3 346.519 2.717 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@H+](C[C@@H]2CCC(F)(F)C2)C1)N(C)C ZINC001377838351 1344493717 /nfs/dbraw/zinc/49/37/17/1344493717.db2.gz POGMSLGLLNLKDK-PMPSAXMXSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@@H+](C[C@@H]2CCC(F)(F)C2)C1)N(C)C ZINC001377838351 1344493720 /nfs/dbraw/zinc/49/37/20/1344493720.db2.gz POGMSLGLLNLKDK-PMPSAXMXSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)(C(=O)NCC1C[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1)N1CCCCC1 ZINC001377974703 1344628668 /nfs/dbraw/zinc/62/86/68/1344628668.db2.gz WZCUTQKHGBOQGD-QRQLOZEOSA-N 1 3 347.547 2.735 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1C[C@@H]2C[C@H]1C[N@@H+]2CCC1CCCC1 ZINC001378028397 1344678773 /nfs/dbraw/zinc/67/87/73/1344678773.db2.gz SPBHFBJPGPEMGC-OKZBNKHCSA-N 1 3 339.499 2.532 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1C[C@@H]2C[C@H]1C[N@H+]2CCC1CCCC1 ZINC001378028397 1344678777 /nfs/dbraw/zinc/67/87/77/1344678777.db2.gz SPBHFBJPGPEMGC-OKZBNKHCSA-N 1 3 339.499 2.532 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[N@H+](C)CC1CC2(CCC2)C1 ZINC001378046717 1344697203 /nfs/dbraw/zinc/69/72/03/1344697203.db2.gz JVTIYUFGHREKTI-FUHWJXTLSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[N@@H+](C)CC1CC2(CCC2)C1 ZINC001378046717 1344697204 /nfs/dbraw/zinc/69/72/04/1344697204.db2.gz JVTIYUFGHREKTI-FUHWJXTLSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[N@H+](C)Cc1ccc(C2CC2)cc1 ZINC001378064170 1344717201 /nfs/dbraw/zinc/71/72/01/1344717201.db2.gz MEQBVASNHSSXED-INIZCTEOSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[N@@H+](C)Cc1ccc(C2CC2)cc1 ZINC001378064170 1344717205 /nfs/dbraw/zinc/71/72/05/1344717205.db2.gz MEQBVASNHSSXED-INIZCTEOSA-N 1 3 343.515 2.985 10 0 EFAEHO Cc1cccc(CN(C)[C@@H](C)CNC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001378066049 1344719993 /nfs/dbraw/zinc/71/99/93/1344719993.db2.gz DSZCMNRCUUKQKI-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1cccc(CN(C)[C@@H](C)CNC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001378066049 1344719995 /nfs/dbraw/zinc/71/99/95/1344719995.db2.gz DSZCMNRCUUKQKI-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO C[C@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)N(C)Cc1ccccc1C1CC1 ZINC001378181235 1344853812 /nfs/dbraw/zinc/85/38/12/1344853812.db2.gz GANIKYZDDRRPPN-SJORKVTESA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)N(C)Cc1ccccc1C1CC1 ZINC001378181235 1344853818 /nfs/dbraw/zinc/85/38/18/1344853818.db2.gz GANIKYZDDRRPPN-SJORKVTESA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1cccc2cccnc21 ZINC001378334962 1344994785 /nfs/dbraw/zinc/99/47/85/1344994785.db2.gz FXHJEEDMRARAAN-SFHVURJKSA-N 1 3 342.487 2.559 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC1CC[NH+](Cc2ccsc2)CC1 ZINC001378479285 1345112437 /nfs/dbraw/zinc/11/24/37/1345112437.db2.gz JVBUYGULNIFFAP-QGZVFWFLSA-N 1 3 335.517 2.561 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@H](C)c1cccc(F)c1 ZINC001378524095 1345140180 /nfs/dbraw/zinc/14/01/80/1345140180.db2.gz RFBRVTZKFCNBKY-CRAIPNDOSA-N 1 3 335.467 2.808 10 0 EFAEHO CCc1ccc(CC[NH+]2CC([C@@H](C)NC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001378529344 1345143046 /nfs/dbraw/zinc/14/30/46/1345143046.db2.gz LDOBAWXDDNEXNH-OXQOHEQNSA-N 1 3 345.531 2.568 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)C1C[NH+]([C@H]2CCc3ccccc32)C1 ZINC001378530566 1345144191 /nfs/dbraw/zinc/14/41/91/1345144191.db2.gz MDVZQDSFILZSOI-KXBFYZLASA-N 1 3 341.499 2.595 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CC1CC(C)C1)N(C)C ZINC001393866283 1357225848 /nfs/dbraw/zinc/22/58/48/1357225848.db2.gz AATROEFVPNPNMD-JWJBOMGPSA-N 1 3 343.515 2.745 10 0 EFAEHO Cc1ccc(C[NH+]2CC([C@@H](C)NC(=O)CN3CC[C@H](C)C3)C2)cc1C ZINC001378540448 1345150116 /nfs/dbraw/zinc/15/01/16/1345150116.db2.gz OQZYVLQLWVCUQH-MAUKXSAKSA-N 1 3 343.515 2.582 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+][C@@H]1CCc2ccccc21 ZINC001378562816 1345164487 /nfs/dbraw/zinc/16/44/87/1345164487.db2.gz FMIWNVIUCXBAMM-MAUKXSAKSA-N 1 3 329.488 2.500 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+][C@H]1CCc2ccccc21 ZINC001378562834 1345164728 /nfs/dbraw/zinc/16/47/28/1345164728.db2.gz FMIWNVIUCXBAMM-YJBOKZPZSA-N 1 3 329.488 2.500 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C1C[NH+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001378579498 1345175972 /nfs/dbraw/zinc/17/59/72/1345175972.db2.gz DYPXWONHUMJLOZ-QAPCUYQASA-N 1 3 335.536 2.589 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001378583584 1345179604 /nfs/dbraw/zinc/17/96/04/1345179604.db2.gz CWZSLZFXBJMWAU-KRWDZBQOSA-N 1 3 345.531 2.965 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](Cc2c(C)cccc2C)C1)N(C)C ZINC001378587862 1345182669 /nfs/dbraw/zinc/18/26/69/1345182669.db2.gz VEOGBYGRCKQGDT-QFBILLFUSA-N 1 3 331.504 2.580 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)C[NH2+]CC1CCC2(CC2)CC1 ZINC001378601656 1345190897 /nfs/dbraw/zinc/19/08/97/1345190897.db2.gz BYEHZFGWETWHHU-DLBZAZTESA-N 1 3 335.536 2.641 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN(C)C(C)C ZINC001393869717 1357230929 /nfs/dbraw/zinc/23/09/29/1357230929.db2.gz KWDIWCDNHZZNLD-XFQXTVEOSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001378662096 1345234777 /nfs/dbraw/zinc/23/47/77/1345234777.db2.gz YZGTXIXTFUMTKG-DLBZAZTESA-N 1 3 337.552 2.835 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001378662096 1345234779 /nfs/dbraw/zinc/23/47/79/1345234779.db2.gz YZGTXIXTFUMTKG-DLBZAZTESA-N 1 3 337.552 2.835 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H](CC)N(C)C ZINC001393871430 1357233552 /nfs/dbraw/zinc/23/35/52/1357233552.db2.gz QMQJONZQWDRWSV-UTRMSSBJSA-N 1 3 331.504 2.745 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+]C[C@@H]2CCC(F)(F)C2)CCCC1)N(C)C ZINC001378711708 1345266619 /nfs/dbraw/zinc/26/66/19/1345266619.db2.gz ZONQOJKAVSWHGR-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@H](c1ccccc1F)N1C[C@@H]2[C@@H](CNC(=O)CCC[NH+](C)C)[C@@H]2C1 ZINC001378720942 1345274590 /nfs/dbraw/zinc/27/45/90/1345274590.db2.gz IMBCOIJXGQMYJY-DDBAPUKQSA-N 1 3 347.478 2.523 10 0 EFAEHO CC(C)(C)CCC[NH+]1CC2(C1)CCN(C(=O)CN1CCCC1)CC2 ZINC001378729822 1345279527 /nfs/dbraw/zinc/27/95/27/1345279527.db2.gz KISMSXVCFGVRAE-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO CC(C)C[N@@H+]1C[C@@]2(C)CN(C(=O)CN(C)CC(C)(C)C)C[C@@]2(C)C1 ZINC001378802137 1345325209 /nfs/dbraw/zinc/32/52/09/1345325209.db2.gz BPJGXYYRKKQQBB-BGYRXZFFSA-N 1 3 337.552 2.791 10 0 EFAEHO CC(C)C[N@H+]1C[C@@]2(C)CN(C(=O)CN(C)CC(C)(C)C)C[C@@]2(C)C1 ZINC001378802137 1345325211 /nfs/dbraw/zinc/32/52/11/1345325211.db2.gz BPJGXYYRKKQQBB-BGYRXZFFSA-N 1 3 337.552 2.791 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@]2(C)C[N@H+](CC3CC(C)(C)C3)C[C@]2(C)C1 ZINC001378815921 1345335804 /nfs/dbraw/zinc/33/58/04/1345335804.db2.gz KVQKINLLKUITHZ-OYRHEFFESA-N 1 3 349.563 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@]2(C)C[N@@H+](CC3CC(C)(C)C3)C[C@]2(C)C1 ZINC001378815921 1345335806 /nfs/dbraw/zinc/33/58/06/1345335806.db2.gz KVQKINLLKUITHZ-OYRHEFFESA-N 1 3 349.563 2.935 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@H](C)C2)cc1C ZINC001378826923 1345344571 /nfs/dbraw/zinc/34/45/71/1345344571.db2.gz HBSSGWUSGVYFTH-YJBOKZPZSA-N 1 3 331.504 2.582 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)N(C)C(=O)C[N@@H+]1CC[C@@H](C)C1 ZINC001378837600 1345351333 /nfs/dbraw/zinc/35/13/33/1345351333.db2.gz WYJKPGXSPVMEMP-CHWSQXEVSA-N 1 3 343.924 2.680 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)N(C)C(=O)C[N@H+]1CC[C@@H](C)C1 ZINC001378837600 1345351336 /nfs/dbraw/zinc/35/13/36/1345351336.db2.gz WYJKPGXSPVMEMP-CHWSQXEVSA-N 1 3 343.924 2.680 10 0 EFAEHO C[C@@H](C[NH2+][C@@H]1CCc2ccc(Cl)cc21)N(C)C(=O)CN1CCCC1 ZINC001378847968 1345360999 /nfs/dbraw/zinc/36/09/99/1345360999.db2.gz DNXPHGSXWRHCQS-KBXCAEBGSA-N 1 3 349.906 2.860 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1F ZINC001378849974 1345362156 /nfs/dbraw/zinc/36/21/56/1345362156.db2.gz BMWGICDLVOVNQC-ZHALLVOQSA-N 1 3 349.494 2.705 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(OC)cc1 ZINC001378863597 1345374236 /nfs/dbraw/zinc/37/42/36/1345374236.db2.gz XSSKWGVKYLQGCM-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2ccccc2C)C1)N(C)C ZINC001378865591 1345374544 /nfs/dbraw/zinc/37/45/44/1345374544.db2.gz GTYAXWOGUOUBTJ-MTNOOBJLSA-N 1 3 331.504 2.881 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccccc2C)C1)N(C)C ZINC001378865582 1345374785 /nfs/dbraw/zinc/37/47/85/1345374785.db2.gz GTYAXWOGUOUBTJ-LSTDLKDCSA-N 1 3 331.504 2.881 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC[N@@H+](C)CCC(C)C)CC1)N(C)C ZINC001378920494 1345426518 /nfs/dbraw/zinc/42/65/18/1345426518.db2.gz PRFWFBNNPIQVDC-SFHVURJKSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC[N@H+](C)CCC(C)C)CC1)N(C)C ZINC001378920494 1345426512 /nfs/dbraw/zinc/42/65/12/1345426512.db2.gz PRFWFBNNPIQVDC-SFHVURJKSA-N 1 3 325.541 2.933 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](NCc1ccccc1F)C(C)C ZINC001378962923 1345462297 /nfs/dbraw/zinc/46/22/97/1345462297.db2.gz OMMKIALZTMAQHA-MOPGFXCFSA-N 1 3 349.494 2.931 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](NCc1ccccc1F)C(C)C ZINC001378962923 1345462300 /nfs/dbraw/zinc/46/23/00/1345462300.db2.gz OMMKIALZTMAQHA-MOPGFXCFSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccsc1 ZINC001378971287 1345469338 /nfs/dbraw/zinc/46/93/38/1345469338.db2.gz JTCIDISMJJOSLC-MRXNPFEDSA-N 1 3 337.533 2.853 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]([NH2+]Cc1cc(C)ccc1F)C(C)C)N(C)C ZINC001378986503 1345481523 /nfs/dbraw/zinc/48/15/23/1345481523.db2.gz GUNWLTRSFPLDDB-MSOLQXFVSA-N 1 3 337.483 2.705 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N(C)CCN(C)Cc2ccc(C3CC3)cc2)CC[N@@H+]1C ZINC001379044860 1345527647 /nfs/dbraw/zinc/52/76/47/1345527647.db2.gz VENQFXZRSTYRAT-OXQOHEQNSA-N 1 3 343.515 2.794 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N(C)CCN(C)Cc2ccc(C3CC3)cc2)CC[N@H+]1C ZINC001379044860 1345527654 /nfs/dbraw/zinc/52/76/54/1345527654.db2.gz VENQFXZRSTYRAT-OXQOHEQNSA-N 1 3 343.515 2.794 10 0 EFAEHO CN(CC[N@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)[C@@H]1CCCCN1C ZINC001379084803 1345562028 /nfs/dbraw/zinc/56/20/28/1345562028.db2.gz VETKUQRTBJGAQJ-IBGZPJMESA-N 1 3 342.487 2.542 10 0 EFAEHO CN(CC[N@@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)[C@@H]1CCCCN1C ZINC001379084803 1345562031 /nfs/dbraw/zinc/56/20/31/1345562031.db2.gz VETKUQRTBJGAQJ-IBGZPJMESA-N 1 3 342.487 2.542 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001379116073 1345593165 /nfs/dbraw/zinc/59/31/65/1345593165.db2.gz HEJRDQNABCHSHD-SFHVURJKSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001379116073 1345593169 /nfs/dbraw/zinc/59/31/69/1345593169.db2.gz HEJRDQNABCHSHD-SFHVURJKSA-N 1 3 337.552 2.933 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)C[C@@H]2CC[N@H+](C)C2)cc1C ZINC001379123192 1345601559 /nfs/dbraw/zinc/60/15/59/1345601559.db2.gz BRGLRIZMFQUZND-IBGZPJMESA-N 1 3 331.504 2.535 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)C[C@@H]2CC[N@@H+](C)C2)cc1C ZINC001379123192 1345601562 /nfs/dbraw/zinc/60/15/62/1345601562.db2.gz BRGLRIZMFQUZND-IBGZPJMESA-N 1 3 331.504 2.535 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001379128064 1345606446 /nfs/dbraw/zinc/60/64/46/1345606446.db2.gz SSXCKMMYLVXQTM-CVEARBPZSA-N 1 3 335.467 2.619 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001379128064 1345606448 /nfs/dbraw/zinc/60/64/48/1345606448.db2.gz SSXCKMMYLVXQTM-CVEARBPZSA-N 1 3 335.467 2.619 10 0 EFAEHO CCCc1ccc(C[N@H+](C)CCN(C)C(=O)CN2CCCC2)cc1 ZINC001379128609 1345606731 /nfs/dbraw/zinc/60/67/31/1345606731.db2.gz AQUXAMBCHXPLTP-UHFFFAOYSA-N 1 3 331.504 2.625 10 0 EFAEHO CCCc1ccc(C[N@@H+](C)CCN(C)C(=O)CN2CCCC2)cc1 ZINC001379128609 1345606735 /nfs/dbraw/zinc/60/67/35/1345606735.db2.gz AQUXAMBCHXPLTP-UHFFFAOYSA-N 1 3 331.504 2.625 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@H](C)CN(C)C(=O)CN(C)C(C)C)c1 ZINC001379323234 1345725927 /nfs/dbraw/zinc/72/59/27/1345725927.db2.gz CGPBBTNTCRKCPT-HZPDHXFCSA-N 1 3 335.492 2.533 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001379387702 1345759832 /nfs/dbraw/zinc/75/98/32/1345759832.db2.gz XHBIXBCQDQIBGY-NVXWUHKLSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001379387702 1345759835 /nfs/dbraw/zinc/75/98/35/1345759835.db2.gz XHBIXBCQDQIBGY-NVXWUHKLSA-N 1 3 335.467 2.603 10 0 EFAEHO C[C@H](CN[C@H](C)c1cccc(Cl)c1F)NC(=O)CCC[NH+](C)C ZINC001379411906 1345769731 /nfs/dbraw/zinc/76/97/31/1345769731.db2.gz ACWHTADVZUPNKV-CHWSQXEVSA-N 1 3 343.874 2.976 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+][C@@H]1CCc2c1cccc2Cl)N(C)C ZINC001379523906 1345827226 /nfs/dbraw/zinc/82/72/26/1345827226.db2.gz XOIFZYUVQXVKPJ-JCURWCKSSA-N 1 3 337.895 2.762 10 0 EFAEHO CN(CCNC(=O)CC[NH+](C)C)CCc1cc(Cl)cc(Cl)c1 ZINC001418491907 1374087476 /nfs/dbraw/zinc/08/74/76/1374087476.db2.gz IJFXLMYCEAHANQ-UHFFFAOYSA-N 1 3 346.302 2.536 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(CF)cc1)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001379722640 1347286361 /nfs/dbraw/zinc/28/63/61/1347286361.db2.gz IIKRISHQXDBATE-GJYPPUQNSA-N 1 3 349.494 2.823 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(CF)cc1)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001379722640 1347286362 /nfs/dbraw/zinc/28/63/62/1347286362.db2.gz IIKRISHQXDBATE-GJYPPUQNSA-N 1 3 349.494 2.823 10 0 EFAEHO CCc1cccc(C[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001379745321 1347301426 /nfs/dbraw/zinc/30/14/26/1347301426.db2.gz QIYXYRGQFYTDGY-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(C[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001379745321 1347301432 /nfs/dbraw/zinc/30/14/32/1347301432.db2.gz QIYXYRGQFYTDGY-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(C[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001379745331 1347301749 /nfs/dbraw/zinc/30/17/49/1347301749.db2.gz QIYXYRGQFYTDGY-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(C[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001379745331 1347301754 /nfs/dbraw/zinc/30/17/54/1347301754.db2.gz QIYXYRGQFYTDGY-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001379911330 1347401562 /nfs/dbraw/zinc/40/15/62/1347401562.db2.gz YARPEOZQWKFNKV-VQTJNVASSA-N 1 3 343.515 2.934 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+][C@@H](C)c1ccccc1F)C1CC1 ZINC001379912211 1347402124 /nfs/dbraw/zinc/40/21/24/1347402124.db2.gz DNGHYMRCSJHTNB-KSSFIOAISA-N 1 3 335.467 2.711 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]Cc1ccsc1 ZINC001379934802 1347412739 /nfs/dbraw/zinc/41/27/39/1347412739.db2.gz HBQIVHLYARUXHB-DLBZAZTESA-N 1 3 337.533 2.805 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]Cc1ccsc1 ZINC001379934807 1347412751 /nfs/dbraw/zinc/41/27/51/1347412751.db2.gz HBQIVHLYARUXHB-IAGOWNOFSA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC001380085258 1347508732 /nfs/dbraw/zinc/50/87/32/1347508732.db2.gz QCHQUEKRMYYZBC-LSDHHAIUSA-N 1 3 343.462 2.533 10 0 EFAEHO Cc1ccc(F)cc1CN1CCC([C@@H](C)NC(=O)CC[NH+](C)C)CC1 ZINC001380131958 1347526259 /nfs/dbraw/zinc/52/62/59/1347526259.db2.gz QZVGUDGWNQCIPY-MRXNPFEDSA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@H](F)CC[NH+]1CCC([C@H](C)NC(=O)C(C)(C)N2CCCC2)CC1 ZINC001380142774 1347531842 /nfs/dbraw/zinc/53/18/42/1347531842.db2.gz KGJHXOWJMUIVNO-HOTGVXAUSA-N 1 3 341.515 2.826 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C1CC[NH+](CCc2ccccc2)CC1 ZINC001380145055 1347533365 /nfs/dbraw/zinc/53/33/65/1347533365.db2.gz COPGGZMEOKMSDA-SFHVURJKSA-N 1 3 345.531 2.788 10 0 EFAEHO CN(C(=O)CC[C@H]1CCC[N@@H+]1C)C1CC(NCc2ccccc2F)C1 ZINC001380155511 1347538510 /nfs/dbraw/zinc/53/85/10/1347538510.db2.gz BQPWFNKUOIFLJE-LXPRWKDFSA-N 1 3 347.478 2.779 10 0 EFAEHO CN(C(=O)CC[C@H]1CCC[N@H+]1C)C1CC(NCc2ccccc2F)C1 ZINC001380155511 1347538511 /nfs/dbraw/zinc/53/85/11/1347538511.db2.gz BQPWFNKUOIFLJE-LXPRWKDFSA-N 1 3 347.478 2.779 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+]C[C@H]2CCCC(F)(F)C2)CC1)N(C)C ZINC001380160194 1347541147 /nfs/dbraw/zinc/54/11/47/1347541147.db2.gz RBWVCJONRADEME-LSDHHAIUSA-N 1 3 345.478 2.637 10 0 EFAEHO CCCN(C)CC(=O)NC1(C2CC[NH+](CC3CCCC3)CC2)CC1 ZINC001380181470 1347554497 /nfs/dbraw/zinc/55/44/97/1347554497.db2.gz AGQXTFGLUMIORN-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)cc1F ZINC001380275335 1347564919 /nfs/dbraw/zinc/56/49/19/1347564919.db2.gz XNYMEMMIEDTRAL-AEFFLSMTSA-N 1 3 349.494 2.943 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2csc(C)c2)C1)N(C)C ZINC001380411197 1347653599 /nfs/dbraw/zinc/65/35/99/1347653599.db2.gz WGXNEUOMQABWAC-SJLPKXTDSA-N 1 3 337.533 2.725 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@](C)(C[NH2+]C[C@H]2CCC(F)(F)C2)C1 ZINC001380422419 1347660669 /nfs/dbraw/zinc/66/06/69/1347660669.db2.gz KDOMZUGQQCBFCR-DOTOQJQBSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[C@@H](F)C[NH+]1CCC(C)(CNC(=O)CN(C)CC(C)(C)C)CC1 ZINC001380450848 1347680761 /nfs/dbraw/zinc/68/07/61/1347680761.db2.gz VDPQORHRVIGEHC-MRXNPFEDSA-N 1 3 343.531 2.931 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1(C)CC[NH+](Cc2ccccc2)CC1 ZINC001380456066 1347683957 /nfs/dbraw/zinc/68/39/57/1347683957.db2.gz DSSXTZKJHNQWSA-UHFFFAOYSA-N 1 3 331.504 2.745 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCCC1CCC1)C2 ZINC001380661270 1347796427 /nfs/dbraw/zinc/79/64/27/1347796427.db2.gz SCUOHVNUGTVZNK-OTWHNJEPSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCCC1CCC1)C2 ZINC001380661270 1347796430 /nfs/dbraw/zinc/79/64/30/1347796430.db2.gz SCUOHVNUGTVZNK-OTWHNJEPSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001380679399 1347808644 /nfs/dbraw/zinc/80/86/44/1347808644.db2.gz OXMGNRCYSUNFDU-AZUAARDMSA-N 1 3 345.531 2.970 10 0 EFAEHO CC[C@@H](C)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@H](C)C1)C2 ZINC001380686170 1347813248 /nfs/dbraw/zinc/81/32/48/1347813248.db2.gz YJPGGQDVIWWSEQ-MTHXSQLBSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@H](C)C1)C2 ZINC001380686170 1347813250 /nfs/dbraw/zinc/81/32/50/1347813250.db2.gz YJPGGQDVIWWSEQ-MTHXSQLBSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2cc(C)cc(C)c2)C1 ZINC001380693912 1347818493 /nfs/dbraw/zinc/81/84/93/1347818493.db2.gz YOAIGMUXIVUJKA-ICSRJNTNSA-N 1 3 345.531 2.829 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]C/C=C\c2ccccc2)CCC1 ZINC001380901310 1347945987 /nfs/dbraw/zinc/94/59/87/1347945987.db2.gz GGOUFEHYSSMDBJ-XFFZJAGNSA-N 1 3 329.488 2.669 10 0 EFAEHO CC[C@H](C)C[N@@H+]1CCC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001380934337 1347966764 /nfs/dbraw/zinc/96/67/64/1347966764.db2.gz OXGBSBJIWRWPJS-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C)C[N@H+]1CCC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001380934337 1347966767 /nfs/dbraw/zinc/96/67/67/1347966767.db2.gz OXGBSBJIWRWPJS-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](Cc2ccc(F)cc2)CC1)N(C)C ZINC001380940995 1347972778 /nfs/dbraw/zinc/97/27/78/1347972778.db2.gz UJTSVYVSWAUGLZ-QZTJIDSGSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2)CC1)N(C)C ZINC001380940995 1347972780 /nfs/dbraw/zinc/97/27/80/1347972780.db2.gz UJTSVYVSWAUGLZ-QZTJIDSGSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001380980743 1348001324 /nfs/dbraw/zinc/00/13/24/1348001324.db2.gz ICNQBUIPWUJHHD-HZPDHXFCSA-N 1 3 347.494 2.932 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001380980743 1348001328 /nfs/dbraw/zinc/00/13/28/1348001328.db2.gz ICNQBUIPWUJHHD-HZPDHXFCSA-N 1 3 347.494 2.932 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)N(C)CCCN(C)Cc1ccsc1 ZINC001380987375 1348006880 /nfs/dbraw/zinc/00/68/80/1348006880.db2.gz GYKGYVUQNGSBCW-HOTGVXAUSA-N 1 3 337.533 2.901 10 0 EFAEHO CCC1([NH2+]CC=C(Cl)Cl)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001381013621 1348018309 /nfs/dbraw/zinc/01/83/09/1348018309.db2.gz VPIGGGXULBWOQV-ZDUSSCGKSA-N 1 3 348.318 2.760 10 0 EFAEHO CCC1([NH2+]Cc2ccccc2)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001381024075 1348025848 /nfs/dbraw/zinc/02/58/48/1348025848.db2.gz VTVGISRSVCZWPS-UHFFFAOYSA-N 1 3 326.444 2.513 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC)([NH2+]Cc2ncccc2C)CC1)N(C)C ZINC001381027228 1348029216 /nfs/dbraw/zinc/02/92/16/1348029216.db2.gz YHKAGXXILFFNLH-SFHVURJKSA-N 1 3 346.519 2.591 10 0 EFAEHO C[NH+]1CCC(C(=O)N2CCC(C)(NC/C(Cl)=C\Cl)CC2)CC1 ZINC001381128284 1348095889 /nfs/dbraw/zinc/09/58/89/1348095889.db2.gz QOMPBMQVXSFVEH-SDNWHVSQSA-N 1 3 348.318 2.618 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381135329 1348101975 /nfs/dbraw/zinc/10/19/75/1348101975.db2.gz QGACPZSXQOMKES-IAGOWNOFSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381135329 1348101976 /nfs/dbraw/zinc/10/19/76/1348101976.db2.gz QGACPZSXQOMKES-IAGOWNOFSA-N 1 3 325.541 2.835 10 0 EFAEHO C[C@@H](CCNC(=O)[C@@H]1CCCN1C)[NH2+]Cc1cccc(Cl)c1F ZINC001381181808 1348126872 /nfs/dbraw/zinc/12/68/72/1348126872.db2.gz PWBQGHFDZLNPAB-WFASDCNBSA-N 1 3 341.858 2.558 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@H](C)[NH2+]C[C@H]1CCc2ccccc2C1)N(C)C ZINC001381214488 1348144797 /nfs/dbraw/zinc/14/47/97/1348144797.db2.gz PTDXZOMOVIWETB-ZWOKBUDYSA-N 1 3 345.531 2.616 10 0 EFAEHO Cc1ccncc1C[NH2+][C@@H](C)CCNC(=O)[C@H]1CCCCN1C(C)C ZINC001381221036 1348148318 /nfs/dbraw/zinc/14/83/18/1348148318.db2.gz NQAUVLQUZCMHMU-PKOBYXMFSA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN(C)C(C)C ZINC001381277950 1348181480 /nfs/dbraw/zinc/18/14/80/1348181480.db2.gz QWMZIJIHQIMGJE-UYAOXDASSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001381311772 1348205081 /nfs/dbraw/zinc/20/50/81/1348205081.db2.gz HWRBCIRFEOTPJY-QZTJIDSGSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001381311772 1348205083 /nfs/dbraw/zinc/20/50/83/1348205083.db2.gz HWRBCIRFEOTPJY-QZTJIDSGSA-N 1 3 325.541 2.932 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]CC2CCC(F)(F)CC2)C1)N(C)C ZINC001381336840 1348214339 /nfs/dbraw/zinc/21/43/39/1348214339.db2.gz CUZHOBBJBDRIAI-GPANFISMSA-N 1 3 345.478 2.637 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001381386471 1348235854 /nfs/dbraw/zinc/23/58/54/1348235854.db2.gz IAOMYZUTTOIFRX-HUUCEWRRSA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001381393710 1348239465 /nfs/dbraw/zinc/23/94/65/1348239465.db2.gz QFQIREWIZJXSGH-IAGOWNOFSA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@H](NCc1cccnc1)[C@H](C)NC(=O)CC[N@H+](C)C1CCCCC1 ZINC001381420467 1348260971 /nfs/dbraw/zinc/26/09/71/1348260971.db2.gz YSSAMCPMTGXCHJ-IRXDYDNUSA-N 1 3 346.519 2.719 10 0 EFAEHO C[C@H](NCc1cccnc1)[C@H](C)NC(=O)CC[N@@H+](C)C1CCCCC1 ZINC001381420467 1348260973 /nfs/dbraw/zinc/26/09/73/1348260973.db2.gz YSSAMCPMTGXCHJ-IRXDYDNUSA-N 1 3 346.519 2.719 10 0 EFAEHO CC[C@@H](C)C[NH2+]CC(C)(C)CN(C)C(=O)[C@H]1CCCCN1CC ZINC001381484173 1348304108 /nfs/dbraw/zinc/30/41/08/1348304108.db2.gz HLUAFBBRGHNKEV-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@@H](C)CNC(=O)[C@H]1CCC[N@H+]1C(C)C ZINC001381513009 1348322936 /nfs/dbraw/zinc/32/29/36/1348322936.db2.gz CVWSUNQPBZCYFQ-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@@H](C)CNC(=O)[C@H]1CCC[N@@H+]1C(C)C ZINC001381513009 1348322940 /nfs/dbraw/zinc/32/29/40/1348322940.db2.gz CVWSUNQPBZCYFQ-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(C)c(F)c1 ZINC001381528203 1348331980 /nfs/dbraw/zinc/33/19/80/1348331980.db2.gz DTCIFKFYCWTSSF-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(C)c(F)c1 ZINC001381528203 1348331982 /nfs/dbraw/zinc/33/19/82/1348331982.db2.gz DTCIFKFYCWTSSF-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)CC[C@H]1CCCC1(F)F ZINC001381639337 1348424162 /nfs/dbraw/zinc/42/41/62/1348424162.db2.gz BBMFHVAGSPXOSI-HUUCEWRRSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC001381639337 1348424164 /nfs/dbraw/zinc/42/41/64/1348424164.db2.gz BBMFHVAGSPXOSI-HUUCEWRRSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC001381639307 1348424096 /nfs/dbraw/zinc/42/40/96/1348424096.db2.gz AVRRHTSEFKSKJV-KXBFYZLASA-N 1 3 349.494 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC001381639307 1348424098 /nfs/dbraw/zinc/42/40/98/1348424098.db2.gz AVRRHTSEFKSKJV-KXBFYZLASA-N 1 3 349.494 2.980 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381860132 1348572503 /nfs/dbraw/zinc/57/25/03/1348572503.db2.gz BRGYLZLPDDITBH-IRXDYDNUSA-N 1 3 325.541 2.835 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381860132 1348572505 /nfs/dbraw/zinc/57/25/05/1348572505.db2.gz BRGYLZLPDDITBH-IRXDYDNUSA-N 1 3 325.541 2.835 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001382030322 1348672922 /nfs/dbraw/zinc/67/29/22/1348672922.db2.gz BKWCRUCANDHQSU-VQTJNVASSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001382088331 1348710068 /nfs/dbraw/zinc/71/00/68/1348710068.db2.gz GOHQAZFXDPRTCP-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N(C)C[C@H](C)NCc1ccccc1F ZINC001382089351 1348710867 /nfs/dbraw/zinc/71/08/67/1348710867.db2.gz YTIHTSQSWQSHKF-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N(C)C[C@H](C)NCc1ccccc1F ZINC001382089351 1348710870 /nfs/dbraw/zinc/71/08/70/1348710870.db2.gz YTIHTSQSWQSHKF-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001382131507 1348751712 /nfs/dbraw/zinc/75/17/12/1348751712.db2.gz ZIPBRENCOXVCSF-IAGOWNOFSA-N 1 3 343.515 2.842 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1cccc(OC)c1 ZINC001382160472 1348782606 /nfs/dbraw/zinc/78/26/06/1348782606.db2.gz BKEHNUOTOKOYLI-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(C)c(F)c1 ZINC001382170492 1348791777 /nfs/dbraw/zinc/79/17/77/1348791777.db2.gz XPVHMWQBNMIDSF-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(Cl)cc2)[C@H]1C ZINC001382301165 1348855441 /nfs/dbraw/zinc/85/54/41/1348855441.db2.gz CXWLWWFYPIYSTF-PBHICJAKSA-N 1 3 337.895 2.759 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)c1 ZINC001382310774 1348860074 /nfs/dbraw/zinc/86/00/74/1348860074.db2.gz JVKBGQWWNLSCAI-MJGOQNOKSA-N 1 3 331.504 2.723 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001382319296 1348866397 /nfs/dbraw/zinc/86/63/97/1348866397.db2.gz XGEAGPVSPWEJDB-PKOBYXMFSA-N 1 3 331.504 2.723 10 0 EFAEHO Cc1cccc(C[N@@H+](C)[C@H](C)CNC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001394062226 1357431055 /nfs/dbraw/zinc/43/10/55/1357431055.db2.gz YXOFRVLYCNVZGN-IEBWSBKVSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1cccc(C[N@H+](C)[C@H](C)CNC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001394062226 1357431057 /nfs/dbraw/zinc/43/10/57/1357431057.db2.gz YXOFRVLYCNVZGN-IEBWSBKVSA-N 1 3 331.504 2.804 10 0 EFAEHO CN(CC(=O)N1C[C@H]([NH2+]CC2CCCC2)C(C)(C)C1)CC(C)(C)C ZINC001382367787 1348918406 /nfs/dbraw/zinc/91/84/06/1348918406.db2.gz IUDRCUZHGJDSMJ-KRWDZBQOSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[N@H+](C)CC1CCC2(CC2)CC1 ZINC001394069132 1357437811 /nfs/dbraw/zinc/43/78/11/1357437811.db2.gz BRIQYVZPXMJUJD-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001394069132 1357437815 /nfs/dbraw/zinc/43/78/15/1357437815.db2.gz BRIQYVZPXMJUJD-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)CC[NH+]1CCC([C@@H](C)NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001382550226 1349012221 /nfs/dbraw/zinc/01/22/21/1349012221.db2.gz CYDDRUADMKQWQP-SJLPKXTDSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C1CC[NH+](CC[C@@H](C)F)CC1)N(C)C ZINC001382551951 1349013244 /nfs/dbraw/zinc/01/32/44/1349013244.db2.gz SHSRJCYPHMHGPW-INMHGKMJSA-N 1 3 329.504 2.537 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)[C@H](C)CNC(=O)CC[NH+](C)C ZINC001394100843 1357472311 /nfs/dbraw/zinc/47/23/11/1357472311.db2.gz GZEKDICLLCUWPJ-CQSZACIVSA-N 1 3 325.884 2.537 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@H+](C)CCc1ccccc1Cl)N(C)C ZINC001394129675 1357507256 /nfs/dbraw/zinc/50/72/56/1357507256.db2.gz UOJBFGHAVGYPSY-RHSMWYFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@@H+](C)CCc1ccccc1Cl)N(C)C ZINC001394129675 1357507260 /nfs/dbraw/zinc/50/72/60/1357507260.db2.gz UOJBFGHAVGYPSY-RHSMWYFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]C/C=C/Cl ZINC001394194771 1357576492 /nfs/dbraw/zinc/57/64/92/1357576492.db2.gz XDYRCYTYNLSXKW-IDSJHHPBSA-N 1 3 329.916 2.543 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C)C1)C1C[NH+](CC2CCC3(CC3)CC2)C1 ZINC001394253159 1357641101 /nfs/dbraw/zinc/64/11/01/1357641101.db2.gz UGZYRRHSZSQMQU-IRXDYDNUSA-N 1 3 347.547 2.735 10 0 EFAEHO CN(C[C@@H]1CCN1[C@@H]1CCc2ccccc21)C(=O)CCC[NH+](C)C ZINC001388650192 1352889447 /nfs/dbraw/zinc/88/94/47/1352889447.db2.gz URKUZANSDRBSNJ-PKOBYXMFSA-N 1 3 329.488 2.548 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H]2C[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001388747733 1352974998 /nfs/dbraw/zinc/97/49/98/1352974998.db2.gz RQFHSUMGCNVBSS-UAPYVXQJSA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccccc2C)C1)N(C)C ZINC001388758608 1352984028 /nfs/dbraw/zinc/98/40/28/1352984028.db2.gz IAXKORUGYSZMRE-UHOSZYNNSA-N 1 3 331.504 2.710 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C[C@@H]1C)CC[NH+](C[C@@H](F)CC)CC2 ZINC001388764150 1352988871 /nfs/dbraw/zinc/98/88/71/1352988871.db2.gz USLSBFAQDMXUSO-IRXDYDNUSA-N 1 3 341.515 2.779 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccc(OC)cc2)[C@@H]1C ZINC001388784384 1353011210 /nfs/dbraw/zinc/01/12/10/1353011210.db2.gz QPUGJBXBWWRXMV-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccc(OC)cc2)[C@@H]1C ZINC001388784384 1353011214 /nfs/dbraw/zinc/01/12/14/1353011214.db2.gz QPUGJBXBWWRXMV-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@H+](C/C=C\Cl)CC(C)(C)C1)N(C)C ZINC001388834694 1353072557 /nfs/dbraw/zinc/07/25/57/1353072557.db2.gz FVVTZLNXXICENK-RJXMKIDGSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H](C)[NH2+]Cc1ccsc1 ZINC001389326415 1353305005 /nfs/dbraw/zinc/30/50/05/1353305005.db2.gz SIWYJSBYDRRGBO-DOTOQJQBSA-N 1 3 337.533 2.948 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CN(Cc2ccccc2)CC1(C)C)[NH+](C)C ZINC001394298564 1357684214 /nfs/dbraw/zinc/68/42/14/1357684214.db2.gz DRWWZKGIDYUMBW-ZWKOTPCHSA-N 1 3 331.504 2.599 10 0 EFAEHO Cc1ccc(CN2CC[C@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c(C)c1 ZINC001389462985 1353407993 /nfs/dbraw/zinc/40/79/93/1353407993.db2.gz QVMRNAOIFOYACW-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(CN2CC[C@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c(C)c1 ZINC001389462985 1353407998 /nfs/dbraw/zinc/40/79/98/1353407998.db2.gz QVMRNAOIFOYACW-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@H](F)CCN1CC[C@@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001389472542 1353414812 /nfs/dbraw/zinc/41/48/12/1353414812.db2.gz UAKVVFKGHQWTAI-LSDHHAIUSA-N 1 3 327.488 2.578 10 0 EFAEHO C[C@H](F)CCN1CC[C@@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001389472542 1353414818 /nfs/dbraw/zinc/41/48/18/1353414818.db2.gz UAKVVFKGHQWTAI-LSDHHAIUSA-N 1 3 327.488 2.578 10 0 EFAEHO CC(C)c1ccc(CN2CC[C@H](NC(=O)CCC[NH+](C)C)C2)cc1 ZINC001389477188 1353417717 /nfs/dbraw/zinc/41/77/17/1353417717.db2.gz HNNAAADCXYEHRH-IBGZPJMESA-N 1 3 331.504 2.842 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CC12CCN(C/C=C\Cl)CC2 ZINC001389527614 1353454913 /nfs/dbraw/zinc/45/49/13/1353454913.db2.gz SZXAKNBXPZEBHG-MMKBSGOPSA-N 1 3 339.911 2.584 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CC12CCN(C/C=C\Cl)CC2 ZINC001389527614 1353454916 /nfs/dbraw/zinc/45/49/16/1353454916.db2.gz SZXAKNBXPZEBHG-MMKBSGOPSA-N 1 3 339.911 2.584 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC12CC[NH+](CC1CC3(CCC3)C1)CC2 ZINC001389531286 1353459017 /nfs/dbraw/zinc/45/90/17/1353459017.db2.gz QXWVSGSXRZKEAB-SFHVURJKSA-N 1 3 347.547 2.878 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NC[C@H](NCc1ccccc1F)C1CC1 ZINC001389604290 1353503968 /nfs/dbraw/zinc/50/39/68/1353503968.db2.gz FKEMUFIGEFVZQF-OALUTQOASA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NC[C@H](NCc1ccccc1F)C1CC1 ZINC001389604290 1353503970 /nfs/dbraw/zinc/50/39/70/1353503970.db2.gz FKEMUFIGEFVZQF-OALUTQOASA-N 1 3 347.478 2.683 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001389615473 1353512394 /nfs/dbraw/zinc/51/23/94/1353512394.db2.gz WUXHPGWXAKAGBB-OALUTQOASA-N 1 3 347.547 2.926 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)C(C)(C)N2CCCC2)C2CC2)cc1 ZINC001389645634 1353529377 /nfs/dbraw/zinc/52/93/77/1353529377.db2.gz FVGRJUHURRPFEF-IBGZPJMESA-N 1 3 343.515 2.854 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C2CC2)c(C)c1 ZINC001389680890 1353550839 /nfs/dbraw/zinc/55/08/39/1353550839.db2.gz CRWCDKQXMDQSSP-FQEVSTJZSA-N 1 3 345.531 2.936 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1ccccc1F)C1CC1 ZINC001389689897 1353557093 /nfs/dbraw/zinc/55/70/93/1353557093.db2.gz NGINFPXWXYGQHG-OALUTQOASA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)CC[N@H+](C)C[C@@H]1CCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001389710445 1353571840 /nfs/dbraw/zinc/57/18/40/1353571840.db2.gz DFKKKAQOACDSEF-ROUUACIJSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)CC[N@@H+](C)C[C@@H]1CCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001389710445 1353571841 /nfs/dbraw/zinc/57/18/41/1353571841.db2.gz DFKKKAQOACDSEF-ROUUACIJSA-N 1 3 325.541 2.789 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[N@H+](C)CCC(C)(C)C)C1 ZINC001389762905 1353606903 /nfs/dbraw/zinc/60/69/03/1353606903.db2.gz PACUWIPLYLIOTQ-QGZVFWFLSA-N 1 3 325.541 2.935 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001389826100 1353636880 /nfs/dbraw/zinc/63/68/80/1353636880.db2.gz KFVOBDZNAXESHW-SFHVURJKSA-N 1 3 346.519 2.544 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001389901472 1353677081 /nfs/dbraw/zinc/67/70/81/1353677081.db2.gz RWHYYFKIYRTQFA-KLICCBINSA-N 1 3 347.503 2.579 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(C)cc1)N(C)C ZINC001389923407 1353692116 /nfs/dbraw/zinc/69/21/16/1353692116.db2.gz ZWQOAAFTHBQOJC-RAFMOHDBSA-N 1 3 343.515 2.947 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(C)cc1)N(C)C ZINC001389923407 1353692120 /nfs/dbraw/zinc/69/21/20/1353692120.db2.gz ZWQOAAFTHBQOJC-RAFMOHDBSA-N 1 3 343.515 2.947 10 0 EFAEHO C[NH+](C)CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(Cl)c1 ZINC001389931396 1353696076 /nfs/dbraw/zinc/69/60/76/1353696076.db2.gz OGHQKSCIVQXQGC-AYHJJNSGSA-N 1 3 349.906 2.903 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H]1C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001389985425 1353726107 /nfs/dbraw/zinc/72/61/07/1353726107.db2.gz GZYJDWMKDIPBDL-CEXWTWQISA-N 1 3 331.504 2.572 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H]1C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001389992115 1353729329 /nfs/dbraw/zinc/72/93/29/1353729329.db2.gz UGJMHWIAPVZIPS-ZIFCJYIRSA-N 1 3 331.504 2.626 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(F)c(F)c2)C1)N(C)C ZINC001390004806 1353736733 /nfs/dbraw/zinc/73/67/33/1353736733.db2.gz ASFCVEPWGQGRFB-HVOFVXBASA-N 1 3 339.430 2.603 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCCN(Cc2ccsc2)C1)[NH+]1CCCC1 ZINC001390045507 1353763558 /nfs/dbraw/zinc/76/35/58/1353763558.db2.gz RSZDPUZRAGMEJK-INIZCTEOSA-N 1 3 349.544 2.951 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CCC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001390055756 1353771712 /nfs/dbraw/zinc/77/17/12/1353771712.db2.gz GNXMELYSXACQPM-GOSISDBHSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccccc1C[N@H+]1CCC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001390055756 1353771717 /nfs/dbraw/zinc/77/17/17/1353771717.db2.gz GNXMELYSXACQPM-GOSISDBHSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCC[N@H+]1CCC(C)(C)C)N(C)C ZINC001390158132 1353872698 /nfs/dbraw/zinc/87/26/98/1353872698.db2.gz SCUZDYKFXMNLAB-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCC[N@@H+]1CCC(C)(C)C)N(C)C ZINC001390158132 1353872695 /nfs/dbraw/zinc/87/26/95/1353872695.db2.gz SCUZDYKFXMNLAB-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)c1ccc(C[NH2+][C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001390479931 1354113423 /nfs/dbraw/zinc/11/34/23/1354113423.db2.gz KGGRELXCKHYIDS-SJORKVTESA-N 1 3 331.504 2.746 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]([NH2+]CC2CC3(CCC3)C2)C1 ZINC001390608515 1354202608 /nfs/dbraw/zinc/20/26/08/1354202608.db2.gz KOBPXFKMDKUFCK-ZWKOTPCHSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]([NH2+]CC2CC3(CCC3)C2)C1 ZINC001390608510 1354202828 /nfs/dbraw/zinc/20/28/28/1354202828.db2.gz KOBPXFKMDKUFCK-QZTJIDSGSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001390624052 1354221291 /nfs/dbraw/zinc/22/12/91/1354221291.db2.gz KXDIYPYSBCRIKN-HZPDHXFCSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001390624052 1354221292 /nfs/dbraw/zinc/22/12/92/1354221292.db2.gz KXDIYPYSBCRIKN-HZPDHXFCSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)Cc2ccc(C3CC3)cc2)CC[N@@H+]1C ZINC001390770102 1354356984 /nfs/dbraw/zinc/35/69/84/1354356984.db2.gz YIZYZEVZZUMHIV-VQTJNVASSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)Cc2ccc(C3CC3)cc2)CC[N@H+]1C ZINC001390770102 1354356990 /nfs/dbraw/zinc/35/69/90/1354356990.db2.gz YIZYZEVZZUMHIV-VQTJNVASSA-N 1 3 343.515 2.842 10 0 EFAEHO CN(CC(=O)NCC[N@H+](C)Cc1ccc2cc[nH]c2c1)CC(C)(C)C ZINC001390816399 1354402790 /nfs/dbraw/zinc/40/27/90/1354402790.db2.gz ITNOPZYLMRNCEC-UHFFFAOYSA-N 1 3 344.503 2.694 10 0 EFAEHO CN(CC(=O)NCC[N@@H+](C)Cc1ccc2cc[nH]c2c1)CC(C)(C)C ZINC001390816399 1354402792 /nfs/dbraw/zinc/40/27/92/1354402792.db2.gz ITNOPZYLMRNCEC-UHFFFAOYSA-N 1 3 344.503 2.694 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@H]2CCC[C@H]3CCC[N@@H+]32)c1 ZINC001390826147 1354412218 /nfs/dbraw/zinc/41/22/18/1354412218.db2.gz MQQUWVSEVRBEKV-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@H]2CCC[C@H]3CCC[N@H+]32)c1 ZINC001390826147 1354412223 /nfs/dbraw/zinc/41/22/23/1354412223.db2.gz MQQUWVSEVRBEKV-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO CN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)[C@@H]1CCc2ccc(Cl)cc21 ZINC001390847917 1354431622 /nfs/dbraw/zinc/43/16/22/1354431622.db2.gz VJAXTYIKVQZUAD-RDTXWAMCSA-N 1 3 349.906 2.717 10 0 EFAEHO CN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)[C@@H]1CCc2ccc(Cl)cc21 ZINC001390847917 1354431624 /nfs/dbraw/zinc/43/16/24/1354431624.db2.gz VJAXTYIKVQZUAD-RDTXWAMCSA-N 1 3 349.906 2.717 10 0 EFAEHO CN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)[C@H]1CCc2ccc(Cl)cc21 ZINC001390847894 1354431901 /nfs/dbraw/zinc/43/19/01/1354431901.db2.gz VJAXTYIKVQZUAD-KDOFPFPSSA-N 1 3 349.906 2.717 10 0 EFAEHO CN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)[C@H]1CCc2ccc(Cl)cc21 ZINC001390847894 1354431904 /nfs/dbraw/zinc/43/19/04/1354431904.db2.gz VJAXTYIKVQZUAD-KDOFPFPSSA-N 1 3 349.906 2.717 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@H]2CCC[C@@H]([NH+](C)C)C2)c1 ZINC001390849133 1354432585 /nfs/dbraw/zinc/43/25/85/1354432585.db2.gz ZMHBJKGIIMRKAZ-VQTJNVASSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@H+](CC2CC(C)(C)C2)C1)N1CCCC1 ZINC001391095743 1354787992 /nfs/dbraw/zinc/78/79/92/1354787992.db2.gz HZIVLFYVHJFCJN-MRXNPFEDSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@@H+](CC2CC(C)(C)C2)C1)N1CCCC1 ZINC001391095743 1354787995 /nfs/dbraw/zinc/78/79/95/1354787995.db2.gz HZIVLFYVHJFCJN-MRXNPFEDSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CC[N@H+](CC2CCCC2)C1)N1CCCCCC1 ZINC001391096490 1354789950 /nfs/dbraw/zinc/78/99/50/1354789950.db2.gz MEMCDDSTXSSUJN-IEBWSBKVSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CC[N@@H+](CC2CCCC2)C1)N1CCCCCC1 ZINC001391096490 1354789953 /nfs/dbraw/zinc/78/99/53/1354789953.db2.gz MEMCDDSTXSSUJN-IEBWSBKVSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c(C)c1 ZINC001391104526 1354799262 /nfs/dbraw/zinc/79/92/62/1354799262.db2.gz WRVWVTCAJACGKE-IEBWSBKVSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c(C)c1 ZINC001391104526 1354799265 /nfs/dbraw/zinc/79/92/65/1354799265.db2.gz WRVWVTCAJACGKE-IEBWSBKVSA-N 1 3 343.515 2.583 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+]([C@H]2CCCc3ccccc32)C1 ZINC001391120812 1354826120 /nfs/dbraw/zinc/82/61/20/1354826120.db2.gz WNVGPSVYLNMTPG-XLIONFOSSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+]([C@H]2CCCc3ccccc32)C1 ZINC001391120812 1354826122 /nfs/dbraw/zinc/82/61/22/1354826122.db2.gz WNVGPSVYLNMTPG-XLIONFOSSA-N 1 3 343.515 2.842 10 0 EFAEHO CCCN(CCNC(=O)[C@@H]1CCC[N@@H+]1C(C)C)Cc1ccsc1 ZINC001391127524 1354836108 /nfs/dbraw/zinc/83/61/08/1354836108.db2.gz NSHDPDBJOUGZPD-KRWDZBQOSA-N 1 3 337.533 2.949 10 0 EFAEHO CCCN(CCNC(=O)[C@@H]1CCC[N@H+]1C(C)C)Cc1ccsc1 ZINC001391127524 1354836114 /nfs/dbraw/zinc/83/61/14/1354836114.db2.gz NSHDPDBJOUGZPD-KRWDZBQOSA-N 1 3 337.533 2.949 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@H+](C2CC2)[C@@H]2CCc3ccccc32)CCC1 ZINC001391169819 1354894163 /nfs/dbraw/zinc/89/41/63/1354894163.db2.gz SFTHGQKNMJLDJM-LJQANCHMSA-N 1 3 341.499 2.739 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)CCC1 ZINC001391169819 1354894166 /nfs/dbraw/zinc/89/41/66/1354894166.db2.gz SFTHGQKNMJLDJM-LJQANCHMSA-N 1 3 341.499 2.739 10 0 EFAEHO Cc1cccc(C)c1CN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)C1CC1 ZINC001391203041 1354931191 /nfs/dbraw/zinc/93/11/91/1354931191.db2.gz VWRHNLPYJINXQE-SFHVURJKSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1cccc(C)c1CN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)C1CC1 ZINC001391203041 1354931198 /nfs/dbraw/zinc/93/11/98/1354931198.db2.gz VWRHNLPYJINXQE-SFHVURJKSA-N 1 3 343.515 2.726 10 0 EFAEHO CCc1ccc(CN(CCNC(=O)C[C@H]2CC[N@H+](C)C2)C2CC2)cc1 ZINC001391204117 1354932101 /nfs/dbraw/zinc/93/21/01/1354932101.db2.gz YXWDSDJDEHYUGX-LJQANCHMSA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1ccc(CN(CCNC(=O)C[C@H]2CC[N@@H+](C)C2)C2CC2)cc1 ZINC001391204117 1354932106 /nfs/dbraw/zinc/93/21/06/1354932106.db2.gz YXWDSDJDEHYUGX-LJQANCHMSA-N 1 3 343.515 2.671 10 0 EFAEHO CCCN(C(=O)CC[NH+](C)C)[C@@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001391274293 1355003711 /nfs/dbraw/zinc/00/37/11/1355003711.db2.gz MKRYORUEYVINDP-LJQANCHMSA-N 1 3 331.504 2.760 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)N1CC[C@H](NC/C=C/Cl)C1 ZINC001398496716 1360603031 /nfs/dbraw/zinc/60/30/31/1360603031.db2.gz BGXZUNRPNPXRIE-XYYIANASSA-N 1 3 327.900 2.582 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)N1CC[C@H](NC/C=C/Cl)C1 ZINC001398496716 1360603036 /nfs/dbraw/zinc/60/30/36/1360603036.db2.gz BGXZUNRPNPXRIE-XYYIANASSA-N 1 3 327.900 2.582 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)CC1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001391367143 1355134131 /nfs/dbraw/zinc/13/41/31/1355134131.db2.gz MPZOVWDMSMLLSG-MRXNPFEDSA-N 1 3 343.531 2.883 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)CC1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001391367143 1355134135 /nfs/dbraw/zinc/13/41/35/1355134135.db2.gz MPZOVWDMSMLLSG-MRXNPFEDSA-N 1 3 343.531 2.883 10 0 EFAEHO CC1CCC(C[N@@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001398814256 1360811246 /nfs/dbraw/zinc/81/12/46/1360811246.db2.gz GEAHLCKHALCWST-CORAGOJCSA-N 1 3 349.563 2.837 10 0 EFAEHO CC1CCC(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001398814256 1360811249 /nfs/dbraw/zinc/81/12/49/1360811249.db2.gz GEAHLCKHALCWST-CORAGOJCSA-N 1 3 349.563 2.837 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](CC)N(C)C)[NH2+]Cc1ccc(Cl)cc1C ZINC001391694540 1355441000 /nfs/dbraw/zinc/44/10/00/1355441000.db2.gz HOCXDXATAWTWGQ-IAGOWNOFSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCC[N@@H+]1C(C)C)NCc1cc(C)ccc1F ZINC001391696533 1355442289 /nfs/dbraw/zinc/44/22/89/1355442289.db2.gz SXMVLULDWFEHNJ-IEBWSBKVSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCC[N@H+]1C(C)C)NCc1cc(C)ccc1F ZINC001391696533 1355442292 /nfs/dbraw/zinc/44/22/92/1355442292.db2.gz SXMVLULDWFEHNJ-IEBWSBKVSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(Cl)cc1 ZINC001391722273 1355465586 /nfs/dbraw/zinc/46/55/86/1355465586.db2.gz SBRDRDBECIGJBL-WMLDXEAASA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(Cl)cc1 ZINC001391722275 1355465634 /nfs/dbraw/zinc/46/56/34/1355465634.db2.gz SBRDRDBECIGJBL-YOEHRIQHSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H]1CCc2c1cccc2F ZINC001391757608 1355502501 /nfs/dbraw/zinc/50/25/01/1355502501.db2.gz ZXUZJGZDDKPJIS-KBXCAEBGSA-N 1 3 335.467 2.638 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1CC[C@H]([NH2+]CCC(F)(F)F)CC1 ZINC001391829762 1355571962 /nfs/dbraw/zinc/57/19/62/1355571962.db2.gz BUTCSGKCOMBTGV-BIQWYFBQSA-N 1 3 349.441 2.829 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC001391833727 1355576509 /nfs/dbraw/zinc/57/65/09/1355576509.db2.gz RZPSMRMAQTVQFD-BZUAXINKSA-N 1 3 345.478 2.779 10 0 EFAEHO Cc1ccc(CNC[C@H]2CCCN2C(=O)CC[NH+](C)C)c(Cl)c1 ZINC001391863746 1355603241 /nfs/dbraw/zinc/60/32/41/1355603241.db2.gz ADSCSBPXVNCAAA-MRXNPFEDSA-N 1 3 337.895 2.681 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]1CNCc1ccc(Cl)cc1F ZINC001391863790 1355603257 /nfs/dbraw/zinc/60/32/57/1355603257.db2.gz ASCXLBFXFPOMHM-OAHLLOKOSA-N 1 3 341.858 2.511 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+]Cc2cc(C)ccc2F)CCCC1)N(C)C ZINC001392023537 1355722822 /nfs/dbraw/zinc/72/28/22/1355722822.db2.gz OGDABVLILFHQPP-GOSISDBHSA-N 1 3 349.494 2.993 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C[N@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001400253131 1361888679 /nfs/dbraw/zinc/88/86/79/1361888679.db2.gz YOLLUJWBBWRDEE-HSALFYBXSA-N 1 3 349.563 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C[N@@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001400253131 1361888684 /nfs/dbraw/zinc/88/86/84/1361888684.db2.gz YOLLUJWBBWRDEE-HSALFYBXSA-N 1 3 349.563 2.935 10 0 EFAEHO C[C@@H](CNCc1ccccc1F)N(C)C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001392072594 1355749508 /nfs/dbraw/zinc/74/95/08/1355749508.db2.gz FXZYFKSDAJGNNB-DOTOQJQBSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CNCc1ccccc1F)N(C)C(=O)CC[C@H]1CCC[N@H+]1C ZINC001392072594 1355749511 /nfs/dbraw/zinc/74/95/11/1355749511.db2.gz FXZYFKSDAJGNNB-DOTOQJQBSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CNCc1ccccc1F)N(C)C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001392072605 1355749715 /nfs/dbraw/zinc/74/97/15/1355749715.db2.gz FXZYFKSDAJGNNB-WBVHZDCISA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CNCc1ccccc1F)N(C)C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001392072605 1355749722 /nfs/dbraw/zinc/74/97/22/1355749722.db2.gz FXZYFKSDAJGNNB-WBVHZDCISA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](C[NH2+][C@H]1CCc2ccccc21)N(C)C(=O)CN1CCC(C)CC1 ZINC001392112916 1355776013 /nfs/dbraw/zinc/77/60/13/1355776013.db2.gz PGNSORNNSHLSFW-XLIONFOSSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@@H](NC[C@H](C)N(C)C(=O)CC[NH+](C)C)c1ccc(F)cc1F ZINC001392129261 1355790040 /nfs/dbraw/zinc/79/00/40/1355790040.db2.gz XZOTZISFJAGVSS-SUMWQHHRSA-N 1 3 341.446 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(C(F)F)cc1 ZINC001392138136 1355795661 /nfs/dbraw/zinc/79/56/61/1355795661.db2.gz MACUBAFPRQGIJH-CQSZACIVSA-N 1 3 341.446 2.901 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@@H](NC(=O)C1(N(C)C)CCC1)C1CCCCC1 ZINC001392163823 1355816995 /nfs/dbraw/zinc/81/69/95/1355816995.db2.gz KKVVFYYFVVLHLC-IAGOWNOFSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001392185621 1355839603 /nfs/dbraw/zinc/83/96/03/1355839603.db2.gz WGALXGRSUATQDT-ICSRJNTNSA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H](C)[NH2+]CCC(C)(C)C)C1 ZINC001392188705 1355843260 /nfs/dbraw/zinc/84/32/60/1355843260.db2.gz KIPOMEHSJXTCJI-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)[NH2+]CC1CC2(CCC2)C1 ZINC001392221423 1355875754 /nfs/dbraw/zinc/87/57/54/1355875754.db2.gz CQLFENKCPINEKQ-MSOLQXFVSA-N 1 3 337.552 2.883 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccccc1 ZINC001392225708 1355879541 /nfs/dbraw/zinc/87/95/41/1355879541.db2.gz YCSLAWQFJYQZJZ-RTBURBONSA-N 1 3 331.504 2.790 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccc(F)cc1C)C(C)C)N(C)C ZINC001392228887 1355883590 /nfs/dbraw/zinc/88/35/90/1355883590.db2.gz PTNNOOWWBDMBLN-QZTJIDSGSA-N 1 3 337.483 2.705 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)C1 ZINC001394368467 1357742083 /nfs/dbraw/zinc/74/20/83/1357742083.db2.gz YCYOSZWXRFOFON-IYARVYRRSA-N 1 3 343.515 2.772 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)C[NH+]1[C@@H](C)CC[C@@H]1C ZINC001392335926 1356003142 /nfs/dbraw/zinc/00/31/42/1356003142.db2.gz OUFDLQFZPQLNOM-ROUUACIJSA-N 1 3 331.504 2.758 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]CC1CC2(CCC2)C1 ZINC001392353554 1356015192 /nfs/dbraw/zinc/01/51/92/1356015192.db2.gz NAOOUMKXYFMGRP-ZWKOTPCHSA-N 1 3 335.536 2.783 10 0 EFAEHO CCN(CC[NH2+][C@@H](C)c1cccc(Cl)c1)C(=O)CN1CCCC1 ZINC001392453533 1356048780 /nfs/dbraw/zinc/04/87/80/1356048780.db2.gz ADIGWZBZWDHWOU-HNNXBMFYSA-N 1 3 337.895 2.935 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCc2ccccc21)C(=O)[C@@H]1CCCCN1CC ZINC001392461214 1356052983 /nfs/dbraw/zinc/05/29/83/1356052983.db2.gz TXQRFGPNCARQFJ-PMACEKPBSA-N 1 3 343.515 2.986 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@H](C)[NH+]2CCCCCC2)c1 ZINC001392512704 1356088756 /nfs/dbraw/zinc/08/87/56/1356088756.db2.gz OXZLPKRFOSNVBP-SJORKVTESA-N 1 3 349.494 2.993 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1cc(F)ccc1C ZINC001392538406 1356110117 /nfs/dbraw/zinc/11/01/17/1356110117.db2.gz VPKXEQPAIGKLQD-CRAIPNDOSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1cc(C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C(C)C)cs1 ZINC001401355659 1362704812 /nfs/dbraw/zinc/70/48/12/1362704812.db2.gz OMVRYXOZQMGBRN-MRXNPFEDSA-N 1 3 325.522 2.627 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)Cc2cccc(C)c2)CC[N@@H+]1C ZINC001392640437 1356186497 /nfs/dbraw/zinc/18/64/97/1356186497.db2.gz GIKXKAIAKLBUEU-YTQUADARSA-N 1 3 331.504 2.662 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)Cc2cccc(C)c2)CC[N@H+]1C ZINC001392640437 1356186499 /nfs/dbraw/zinc/18/64/99/1356186499.db2.gz GIKXKAIAKLBUEU-YTQUADARSA-N 1 3 331.504 2.662 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1 ZINC001392678318 1356227415 /nfs/dbraw/zinc/22/74/15/1356227415.db2.gz JURRRCQMJGAONZ-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1 ZINC001392678318 1356227417 /nfs/dbraw/zinc/22/74/17/1356227417.db2.gz JURRRCQMJGAONZ-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CCc1ccccc1C[N@H+](C)C[C@@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001392690139 1356240995 /nfs/dbraw/zinc/24/09/95/1356240995.db2.gz WUHWQFJLGKMZFH-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccccc1C[N@@H+](C)C[C@@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001392690139 1356240999 /nfs/dbraw/zinc/24/09/99/1356240999.db2.gz WUHWQFJLGKMZFH-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO Cc1cccc(CCC[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001392691072 1356243456 /nfs/dbraw/zinc/24/34/56/1356243456.db2.gz XYFVQDFVUCCRKG-MOPGFXCFSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1cccc(CCC[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001392691072 1356243461 /nfs/dbraw/zinc/24/34/61/1356243461.db2.gz XYFVQDFVUCCRKG-MOPGFXCFSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@H](C)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001392691988 1356244183 /nfs/dbraw/zinc/24/41/83/1356244183.db2.gz JQCAOMWQBRETRM-ULQDDVLXSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@H](C)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001392691988 1356244185 /nfs/dbraw/zinc/24/41/85/1356244185.db2.gz JQCAOMWQBRETRM-ULQDDVLXSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001392715341 1356269612 /nfs/dbraw/zinc/26/96/12/1356269612.db2.gz DJTVTMZBXYFTLZ-HNAYVOBHSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001392715341 1356269616 /nfs/dbraw/zinc/26/96/16/1356269616.db2.gz DJTVTMZBXYFTLZ-HNAYVOBHSA-N 1 3 331.504 2.841 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]C[C@H](NC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001392803140 1356340281 /nfs/dbraw/zinc/34/02/81/1356340281.db2.gz SDBDCYXKJODWPH-APWZRJJASA-N 1 3 331.504 2.881 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1 ZINC001401746338 1363078702 /nfs/dbraw/zinc/07/87/02/1363078702.db2.gz AVGOHPWMVGTTIK-YJBOKZPZSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1 ZINC001401746338 1363078705 /nfs/dbraw/zinc/07/87/05/1363078705.db2.gz AVGOHPWMVGTTIK-YJBOKZPZSA-N 1 3 335.467 2.635 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]Cc1cccc(F)c1)C1CC1 ZINC001401838813 1363178181 /nfs/dbraw/zinc/17/81/81/1363178181.db2.gz DDRAYKBHRNTLRB-RBUKOAKNSA-N 1 3 347.478 2.685 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+][C@@H]2CCc3ccc(Cl)cc32)CC1)N(C)C ZINC001392920765 1356432324 /nfs/dbraw/zinc/43/23/24/1356432324.db2.gz VQCRAKMFMFTECR-IAGOWNOFSA-N 1 3 349.906 2.906 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H]2CC[N@H+](C[C@@H](F)CC)C2)CC1 ZINC001392971734 1356478804 /nfs/dbraw/zinc/47/88/04/1356478804.db2.gz RSUPAJBLDXHEPJ-MSOLQXFVSA-N 1 3 341.515 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H]2CC[N@@H+](C[C@@H](F)CC)C2)CC1 ZINC001392971734 1356478808 /nfs/dbraw/zinc/47/88/08/1356478808.db2.gz RSUPAJBLDXHEPJ-MSOLQXFVSA-N 1 3 341.515 2.637 10 0 EFAEHO CN(C(=O)CC[C@H]1CCC[N@@H+]1C)C1CN(CC2CCCCCC2)C1 ZINC001392999972 1356502742 /nfs/dbraw/zinc/50/27/42/1356502742.db2.gz AKMIIGONWSYZJV-GOSISDBHSA-N 1 3 335.536 2.974 10 0 EFAEHO CN(C(=O)CC[C@H]1CCC[N@H+]1C)C1CN(CC2CCCCCC2)C1 ZINC001392999972 1356502745 /nfs/dbraw/zinc/50/27/45/1356502745.db2.gz AKMIIGONWSYZJV-GOSISDBHSA-N 1 3 335.536 2.974 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(CF)cc2)C[C@H]1C ZINC001393035325 1356527354 /nfs/dbraw/zinc/52/73/54/1356527354.db2.gz YQVUSGUPSVWTAP-APWZRJJASA-N 1 3 349.494 2.965 10 0 EFAEHO C[NH+](C)CCC(=O)NC1(C)CCN([C@H]2CCc3c2cccc3F)CC1 ZINC001393067903 1356555928 /nfs/dbraw/zinc/55/59/28/1356555928.db2.gz KWXOWRZSDKGUJV-SFHVURJKSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+]CC2CCCC2)C2CCCC2)CCC1 ZINC001393073290 1356561583 /nfs/dbraw/zinc/56/15/83/1356561583.db2.gz QOUBGKAZZDBNLN-SFHVURJKSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCCC[C@@]2(CCN(C/C=C/Cl)C2)C1 ZINC001393084703 1356577464 /nfs/dbraw/zinc/57/74/64/1356577464.db2.gz ACNPRZOBBXTWAL-OPUMOTSWSA-N 1 3 341.927 2.785 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCCC[C@@]2(CCN(C/C=C/Cl)C2)C1 ZINC001393084703 1356577467 /nfs/dbraw/zinc/57/74/67/1356577467.db2.gz ACNPRZOBBXTWAL-OPUMOTSWSA-N 1 3 341.927 2.785 10 0 EFAEHO CC[C@@H](C(=O)NC1(C)CC[NH+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001402084981 1363388977 /nfs/dbraw/zinc/38/89/77/1363388977.db2.gz XAGXMMKOYVQZOR-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2cc(C)ccc2F)C1)N(C)C ZINC001393161725 1356667611 /nfs/dbraw/zinc/66/76/11/1356667611.db2.gz MEEGVROFHDTUSL-QUCCMNQESA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](F)CN1CCC(C)(CNC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)CC1 ZINC001393176751 1356682501 /nfs/dbraw/zinc/68/25/01/1356682501.db2.gz QXGNVRWECVENLN-YESZJQIVSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[C@H](F)CN1CCC(C)(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)CC1 ZINC001393176751 1356682505 /nfs/dbraw/zinc/68/25/05/1356682505.db2.gz QXGNVRWECVENLN-YESZJQIVSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@]1(C)CCC[N@H+](CC2CC2)C1 ZINC001393204730 1356716336 /nfs/dbraw/zinc/71/63/36/1356716336.db2.gz LSDDSOJPNUWSQD-ICSRJNTNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@]1(C)CCC[N@@H+](CC2CC2)C1 ZINC001393204730 1356716339 /nfs/dbraw/zinc/71/63/39/1356716339.db2.gz LSDDSOJPNUWSQD-ICSRJNTNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)CC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001393246700 1356748763 /nfs/dbraw/zinc/74/87/63/1356748763.db2.gz ZWAYUESJJPDBRZ-CVEARBPZSA-N 1 3 347.494 2.692 10 0 EFAEHO CC(C)CC[N@H+]1CCC(F)(F)[C@H](CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001393246700 1356748767 /nfs/dbraw/zinc/74/87/67/1356748767.db2.gz ZWAYUESJJPDBRZ-CVEARBPZSA-N 1 3 347.494 2.692 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1C[N@H+](CCC(C)(C)C)CCC1(F)F)N(C)C ZINC001393246696 1356749138 /nfs/dbraw/zinc/74/91/38/1356749138.db2.gz ZVRFSIWYAHQEEP-CABCVRRESA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1C[N@@H+](CCC(C)(C)C)CCC1(F)F)N(C)C ZINC001393246696 1356749142 /nfs/dbraw/zinc/74/91/42/1356749142.db2.gz ZVRFSIWYAHQEEP-CABCVRRESA-N 1 3 347.494 2.836 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C2CC[NH+](CCCF)CC2)C1 ZINC001393367617 1356790681 /nfs/dbraw/zinc/79/06/81/1356790681.db2.gz LMVDEMIRNCDUAO-SFHVURJKSA-N 1 3 341.515 2.638 10 0 EFAEHO CC(C)CC[NH2+][C@H](C)[C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001402406794 1363665882 /nfs/dbraw/zinc/66/58/82/1363665882.db2.gz YXUDMKINXXLYEE-SJORKVTESA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]Cc2cccc(F)c2)CC1 ZINC001402500872 1363743060 /nfs/dbraw/zinc/74/30/60/1363743060.db2.gz AVDDFASSEJHPSP-RUCARUNLSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC1([NH2+]CC[C@@H](C)F)CCC1 ZINC001393565135 1356954472 /nfs/dbraw/zinc/95/44/72/1356954472.db2.gz FSQCXCIMQYXWGQ-HZPDHXFCSA-N 1 3 327.488 2.626 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001394382494 1357753880 /nfs/dbraw/zinc/75/38/80/1357753880.db2.gz VFLZSHSUMUMVSU-LNLFQRSKSA-N 1 3 331.504 2.881 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001393632042 1357027480 /nfs/dbraw/zinc/02/74/80/1357027480.db2.gz FWCOUELHKABBPY-IBGZPJMESA-N 1 3 344.503 2.788 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001393632042 1357027483 /nfs/dbraw/zinc/02/74/83/1357027483.db2.gz FWCOUELHKABBPY-IBGZPJMESA-N 1 3 344.503 2.788 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@H+](C)[C@@H]1CCc2ccccc21)N(C)C ZINC001393643837 1357044668 /nfs/dbraw/zinc/04/46/68/1357044668.db2.gz PNCGEGGLOAABTK-RTBURBONSA-N 1 3 331.504 2.794 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@@H+](C)[C@@H]1CCc2ccccc21)N(C)C ZINC001393643837 1357044675 /nfs/dbraw/zinc/04/46/75/1357044675.db2.gz PNCGEGGLOAABTK-RTBURBONSA-N 1 3 331.504 2.794 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H]2CCC[N@H+](CCCF)C2)C1 ZINC001393653227 1357052935 /nfs/dbraw/zinc/05/29/35/1357052935.db2.gz XAXBRBDTDUJVJW-ZWKOTPCHSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H]2CCC[N@@H+](CCCF)C2)C1 ZINC001393653227 1357052936 /nfs/dbraw/zinc/05/29/36/1357052936.db2.gz XAXBRBDTDUJVJW-ZWKOTPCHSA-N 1 3 341.515 2.637 10 0 EFAEHO CCC[NH2+]C1(CC)CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001393678567 1357072276 /nfs/dbraw/zinc/07/22/76/1357072276.db2.gz BKXLFCGKCKAGIA-IBGZPJMESA-N 1 3 341.515 2.970 10 0 EFAEHO CCC1([NH2+]CCc2ccccc2)CCN(C(=O)CN2CCCC2)CC1 ZINC001393680553 1357074145 /nfs/dbraw/zinc/07/41/45/1357074145.db2.gz QMBZJERNRFCAMY-UHFFFAOYSA-N 1 3 343.515 2.686 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC)([NH2+]CCC(F)(F)F)CC1)N(C)C ZINC001393681387 1357075135 /nfs/dbraw/zinc/07/51/35/1357075135.db2.gz WWWNIUJHYUSZFW-ZDUSSCGKSA-N 1 3 337.430 2.640 10 0 EFAEHO CCC1([NH2+]CCc2cccs2)CCN(C(=O)CN2CCCC2)CC1 ZINC001393681171 1357075352 /nfs/dbraw/zinc/07/53/52/1357075352.db2.gz XSPOFBLYHXRIBV-UHFFFAOYSA-N 1 3 349.544 2.747 10 0 EFAEHO CC(C)CCC[N@H+](C)C1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001394388099 1357760926 /nfs/dbraw/zinc/76/09/26/1357760926.db2.gz XTHONOHQCCTGKB-SFHVURJKSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)CCC[N@@H+](C)C1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001394388099 1357760932 /nfs/dbraw/zinc/76/09/32/1357760932.db2.gz XTHONOHQCCTGKB-SFHVURJKSA-N 1 3 325.541 2.932 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)[C@@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001394425275 1357802688 /nfs/dbraw/zinc/80/26/88/1357802688.db2.gz DNWMNVIFHOVLCS-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc3cc[nH]c3c2)[C@@H]1C ZINC001394671399 1357988386 /nfs/dbraw/zinc/98/83/86/1357988386.db2.gz DIWFIJHIIPCDAP-MAUKXSAKSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@H](c1cccc(F)c1)N1CC[C@@]2(NC(=O)CC[NH+](C)C)CCC[C@@H]12 ZINC001394693724 1358016732 /nfs/dbraw/zinc/01/67/32/1358016732.db2.gz UIEFTMNUNFLYSL-ZTNFWEORSA-N 1 3 347.478 2.952 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001394706788 1358033308 /nfs/dbraw/zinc/03/33/08/1358033308.db2.gz CTEAIQVXFALLJY-CABCVRRESA-N 1 3 329.504 2.539 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@@H](C[NH2+]CC3CC(C)(C)C3)C2)CCC1 ZINC001394711324 1358037853 /nfs/dbraw/zinc/03/78/53/1358037853.db2.gz UPJHNNVDYKHUPK-WBVHZDCISA-N 1 3 335.536 2.781 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@H](C[NH2+]CC3CC(C)(C)C3)C2)CCC1 ZINC001394711312 1358037873 /nfs/dbraw/zinc/03/78/73/1358037873.db2.gz UPJHNNVDYKHUPK-DOTOQJQBSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@H](F)CN[C@H]1CN(C(=O)C2CC[NH+](C(C)C)CC2)CC1(C)C ZINC001394716699 1358043660 /nfs/dbraw/zinc/04/36/60/1358043660.db2.gz XTCZGNGXJDSQOB-IRXDYDNUSA-N 1 3 341.515 2.682 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001394814829 1358107231 /nfs/dbraw/zinc/10/72/31/1358107231.db2.gz KDAPGHAIZDACQF-SJORKVTESA-N 1 3 329.504 2.635 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@@H](C)C1CCN(Cc2cccnc2)CC1 ZINC001394848029 1358154642 /nfs/dbraw/zinc/15/46/42/1358154642.db2.gz LPNNSQCIUWJGDD-KRWDZBQOSA-N 1 3 346.519 2.530 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@@H](C)C1CCN(Cc2cccnc2)CC1 ZINC001394848029 1358154646 /nfs/dbraw/zinc/15/46/46/1358154646.db2.gz LPNNSQCIUWJGDD-KRWDZBQOSA-N 1 3 346.519 2.530 10 0 EFAEHO CCc1ccc(C[NH2+]C2CC(N(C)C(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001394853925 1358159793 /nfs/dbraw/zinc/15/97/93/1358159793.db2.gz KRWRTCVOTIKNNR-CTWPCTMYSA-N 1 3 331.504 2.668 10 0 EFAEHO CC[C@H](C(=O)NC1(C2CC[NH+](Cc3ccsc3)CC2)CC1)N(C)C ZINC001394864282 1358172801 /nfs/dbraw/zinc/17/28/01/1358172801.db2.gz XBFSZQRDBHVYEH-QGZVFWFLSA-N 1 3 349.544 2.949 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@H]([NH2+]C/C=C\c2ccccc2)C1 ZINC001436883694 1387336115 /nfs/dbraw/zinc/33/61/15/1387336115.db2.gz QURRDNJNELOPIV-SAFBXNTFSA-N 1 3 341.499 2.765 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCCc3ccc(F)cc32)C1 ZINC001436979347 1387349642 /nfs/dbraw/zinc/34/96/42/1387349642.db2.gz SUCJITUABRYDDF-SCTDSRPQSA-N 1 3 347.478 2.780 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001437036795 1387380764 /nfs/dbraw/zinc/38/07/64/1387380764.db2.gz SGLPBSOVOZHNOH-FQEVSTJZSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCC[N@@H+]1CC1CC1)N1CCCCC1 ZINC001437048032 1387387912 /nfs/dbraw/zinc/38/79/12/1387387912.db2.gz WOWGGNWLHOWRIY-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCC[N@H+]1CC1CC1)N1CCCCC1 ZINC001437048032 1387387919 /nfs/dbraw/zinc/38/79/19/1387387919.db2.gz WOWGGNWLHOWRIY-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](F)CC[NH2+][C@H]1C[C@@H](CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001397093163 1359670580 /nfs/dbraw/zinc/67/05/80/1359670580.db2.gz PAXCAICUBMRNKT-QILLFSRXSA-N 1 3 335.467 2.594 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)NCc1ccccc1Cl ZINC001437137273 1387410296 /nfs/dbraw/zinc/41/02/96/1387410296.db2.gz ZAOWZXMJNCILMF-WMLDXEAASA-N 1 3 337.895 2.807 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)NCc1ccccc1Cl ZINC001437137273 1387410309 /nfs/dbraw/zinc/41/03/09/1387410309.db2.gz ZAOWZXMJNCILMF-WMLDXEAASA-N 1 3 337.895 2.807 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]([NH2+]Cc2cccc(F)c2)C1)N1CCCC1 ZINC001397127702 1359691812 /nfs/dbraw/zinc/69/18/12/1359691812.db2.gz BYXITZIKMCKXMO-SAABIXHNSA-N 1 3 347.478 2.685 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H]1C[C@H](CNC(=O)CC[NH+](C)C)C1 ZINC001397130935 1359693663 /nfs/dbraw/zinc/69/36/63/1359693663.db2.gz QCSTUTQLTMSRNW-SHTZXODSSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@@H]([NH2+][C@H]1C[C@H](CNC(=O)CN(C)C(C)C)C1)c1ccccc1 ZINC001397142046 1359702038 /nfs/dbraw/zinc/70/20/38/1359702038.db2.gz UHZCEVVUCJPPHP-BHIYHBOVSA-N 1 3 331.504 2.962 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CC[C@@H]([NH2+]CCc3cccs3)C2)CCC1 ZINC001397157352 1359712879 /nfs/dbraw/zinc/71/28/79/1359712879.db2.gz ITSCDMXRQSSWCI-JKSUJKDBSA-N 1 3 349.544 2.649 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC001397163376 1359716485 /nfs/dbraw/zinc/71/64/85/1359716485.db2.gz CUFCJXZOKHUVNM-FUHWJXTLSA-N 1 3 335.467 2.540 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]Cc3ccccc3F)C2)C1 ZINC001397168806 1359720268 /nfs/dbraw/zinc/72/02/68/1359720268.db2.gz LDOQIDWCHNVJCL-SOLBZPMBSA-N 1 3 347.478 2.542 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CCC(C)(C)C)C1)N(C)C ZINC001397170065 1359721267 /nfs/dbraw/zinc/72/12/67/1359721267.db2.gz MKFDVBLTIQOYNZ-GVDBMIGSSA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCCCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001397211331 1359753232 /nfs/dbraw/zinc/75/32/32/1359753232.db2.gz ARDVTPQCIKFUGP-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@H]2CCN(Cc3ccccc3Cl)C[C@H]2C1 ZINC001397214021 1359754598 /nfs/dbraw/zinc/75/45/98/1359754598.db2.gz KEEIHKZXIIXVKZ-WBVHZDCISA-N 1 3 349.906 2.572 10 0 EFAEHO Cc1ncccc1C[NH2+][C@H]1CCCCCN(C(=O)CN(C)C(C)C)C1 ZINC001397232391 1359771540 /nfs/dbraw/zinc/77/15/40/1359771540.db2.gz NEYHYIQQEQHTKN-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@H]1C[N@H+](C)CCc1cccs1 ZINC001397261695 1359794928 /nfs/dbraw/zinc/79/49/28/1359794928.db2.gz GOASJWCGMWYONI-FUHWJXTLSA-N 1 3 349.544 2.698 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@H]1C[N@@H+](C)CCc1cccs1 ZINC001397261695 1359794937 /nfs/dbraw/zinc/79/49/37/1359794937.db2.gz GOASJWCGMWYONI-FUHWJXTLSA-N 1 3 349.544 2.698 10 0 EFAEHO C[C@H](F)CCN1CC[C@H]1CN(C)C(=O)CCC[NH+]1CCCCC1 ZINC001397554197 1359956611 /nfs/dbraw/zinc/95/66/11/1359956611.db2.gz LMPUHEIFJBTEPF-IRXDYDNUSA-N 1 3 327.488 2.533 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)C[C@@H]1CCN1C[C@@H]1CCCC(F)(F)C1 ZINC001397556307 1359958010 /nfs/dbraw/zinc/95/80/10/1359958010.db2.gz PROYTHALIHRAHD-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)C[C@@H]1CCN1C[C@@H]1CCCC(F)(F)C1 ZINC001397556307 1359958012 /nfs/dbraw/zinc/95/80/12/1359958012.db2.gz PROYTHALIHRAHD-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@@H+]2CC2CCC3(CC3)CC2)C1 ZINC001397579055 1359976434 /nfs/dbraw/zinc/97/64/34/1359976434.db2.gz OYYDOKLWTGWCOM-IEBWSBKVSA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@H+]2CC2CCC3(CC3)CC2)C1 ZINC001397579055 1359976436 /nfs/dbraw/zinc/97/64/36/1359976436.db2.gz OYYDOKLWTGWCOM-IEBWSBKVSA-N 1 3 347.547 2.831 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccccc1CC ZINC001437158727 1387428255 /nfs/dbraw/zinc/42/82/55/1387428255.db2.gz UJWORTKRNHCDHM-QFBILLFUSA-N 1 3 331.504 2.718 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2cccc(C)c2)C1 ZINC001397727487 1360082832 /nfs/dbraw/zinc/08/28/32/1360082832.db2.gz PULQYUMXTMWMRW-RBUKOAKNSA-N 1 3 331.504 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C[C@@H]1C)CC[NH+](CC[C@H](C)F)CC2 ZINC001397727547 1360083106 /nfs/dbraw/zinc/08/31/06/1360083106.db2.gz OIQLASGZEXAPKZ-IRXDYDNUSA-N 1 3 341.515 2.778 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CC(CC)CC ZINC001397737599 1360092118 /nfs/dbraw/zinc/09/21/18/1360092118.db2.gz CBLJVRVVCZNYFO-HAGHYFMRSA-N 1 3 349.563 2.933 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CC(CC)CC ZINC001397737599 1360092121 /nfs/dbraw/zinc/09/21/21/1360092121.db2.gz CBLJVRVVCZNYFO-HAGHYFMRSA-N 1 3 349.563 2.933 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@H+](C/C=C\Cl)CC(C)(C)C1)N(C)C ZINC001397804419 1360155786 /nfs/dbraw/zinc/15/57/86/1360155786.db2.gz FVVTZLNXXICENK-MJYKILKPSA-N 1 3 329.916 2.686 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@@H+](C/C=C\Cl)CC(C)(C)C1)N(C)C ZINC001397804419 1360155789 /nfs/dbraw/zinc/15/57/89/1360155789.db2.gz FVVTZLNXXICENK-MJYKILKPSA-N 1 3 329.916 2.686 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)CCN1CCCF ZINC001397798693 1360148651 /nfs/dbraw/zinc/14/86/51/1360148651.db2.gz WIXJGDAERSIPIF-ZBFHGGJFSA-N 1 3 327.488 2.578 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)CCN1CCCF ZINC001397798693 1360148654 /nfs/dbraw/zinc/14/86/54/1360148654.db2.gz WIXJGDAERSIPIF-ZBFHGGJFSA-N 1 3 327.488 2.578 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)[NH+]1CCCC1)NCc1ccccc1Cl ZINC001437181495 1387445024 /nfs/dbraw/zinc/44/50/24/1387445024.db2.gz AYWTUTRLBMOHNO-AWEZNQCLSA-N 1 3 337.895 2.809 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CC[N@H+](Cc2c(C)cccc2C)C1 ZINC001398287816 1360443249 /nfs/dbraw/zinc/44/32/49/1360443249.db2.gz JQSDBYRXSYSHKE-PKOBYXMFSA-N 1 3 349.494 2.674 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CC[N@@H+](Cc2c(C)cccc2C)C1 ZINC001398287816 1360443250 /nfs/dbraw/zinc/44/32/50/1360443250.db2.gz JQSDBYRXSYSHKE-PKOBYXMFSA-N 1 3 349.494 2.674 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC12CC[NH+](Cc1ccsc1)CC2)N(C)C ZINC001398366149 1360488124 /nfs/dbraw/zinc/48/81/24/1360488124.db2.gz QENHNDWXQQZBQD-HOTGVXAUSA-N 1 3 335.517 2.559 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC12CC[NH+](CCC(C)(C)C)CC2)N(C)C ZINC001398367060 1360489070 /nfs/dbraw/zinc/48/90/70/1360489070.db2.gz SOUVVVDLWHYOSC-IRXDYDNUSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+][C@H]1CCc2c1cccc2F)C1CC1 ZINC001398447383 1360565518 /nfs/dbraw/zinc/56/55/18/1360565518.db2.gz GLTZYIURWSNZSA-OALUTQOASA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@H+](C)CCc2ccccc2)C1 ZINC001398456953 1360574449 /nfs/dbraw/zinc/57/44/49/1360574449.db2.gz CHPGOGVOGNZGNO-HXUWFJFHSA-N 1 3 345.531 2.740 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@@H+](C)CCc2ccccc2)C1 ZINC001398456953 1360574451 /nfs/dbraw/zinc/57/44/51/1360574451.db2.gz CHPGOGVOGNZGNO-HXUWFJFHSA-N 1 3 345.531 2.740 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H](C[N@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001398460975 1360579321 /nfs/dbraw/zinc/57/93/21/1360579321.db2.gz GCHQAFGYOIICIP-SJORKVTESA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H](C[N@@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001398460975 1360579324 /nfs/dbraw/zinc/57/93/24/1360579324.db2.gz GCHQAFGYOIICIP-SJORKVTESA-N 1 3 325.541 2.933 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(C2CCC2)cc1 ZINC001437203702 1387463933 /nfs/dbraw/zinc/46/39/33/1387463933.db2.gz JXHBKXVOIONJRP-IRXDYDNUSA-N 1 3 343.515 2.890 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@@H]2CN(CCC(F)(F)F)CC[C@H]21 ZINC001398572965 1360651621 /nfs/dbraw/zinc/65/16/21/1360651621.db2.gz AWLFPVGZNPUTHW-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)CCC[NH+]3CCCC3)C2)c1 ZINC001398572756 1360651832 /nfs/dbraw/zinc/65/18/32/1360651832.db2.gz IDWQOEWFLVJNIL-IYARVYRRSA-N 1 3 347.478 2.747 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001398607662 1360667830 /nfs/dbraw/zinc/66/78/30/1360667830.db2.gz ABNBSTLJULNXTD-KKHDSEBOSA-N 1 3 329.488 2.523 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(F)c(Cl)c2)C1)N(C)C ZINC001398618263 1360672712 /nfs/dbraw/zinc/67/27/12/1360672712.db2.gz YETBOVPDJJGGPU-DVOMOZLQSA-N 1 3 341.858 2.556 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)C1 ZINC001398629320 1360679007 /nfs/dbraw/zinc/67/90/07/1360679007.db2.gz WJJSYYRJZQOOFI-CALCHBBNSA-N 1 3 329.488 2.525 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC[C@H]2CCc3ccccc32)C1)N(C)C ZINC001398657791 1360692025 /nfs/dbraw/zinc/69/20/25/1360692025.db2.gz CRZJBBGCWSEZEW-XSYGEPLQSA-N 1 3 343.515 2.684 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCCc3ccccc32)C1)N(C)C ZINC001398659644 1360694210 /nfs/dbraw/zinc/69/42/10/1360694210.db2.gz HEVYBNYYRKPHFV-NBMJBFSESA-N 1 3 329.488 2.641 10 0 EFAEHO CCc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)cc1 ZINC001398673137 1360703440 /nfs/dbraw/zinc/70/34/40/1360703440.db2.gz RWELUMZEQDZLTM-OTWHNJEPSA-N 1 3 331.504 2.572 10 0 EFAEHO C[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC1CCCC1 ZINC001437206754 1387469812 /nfs/dbraw/zinc/46/98/12/1387469812.db2.gz MJWVUYDMFJNGCV-DNVCBOLYSA-N 1 3 341.515 2.874 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCCN(Cc2ccsc2)C1 ZINC001398685707 1360715704 /nfs/dbraw/zinc/71/57/04/1360715704.db2.gz FTHWCDSDFPBIDN-SJLPKXTDSA-N 1 3 349.544 2.951 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCCN(Cc2ccsc2)C1 ZINC001398685707 1360715715 /nfs/dbraw/zinc/71/57/15/1360715715.db2.gz FTHWCDSDFPBIDN-SJLPKXTDSA-N 1 3 349.544 2.951 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](CCc2ccc(C)cc2)C1)N(C)C ZINC001398696273 1360725349 /nfs/dbraw/zinc/72/53/49/1360725349.db2.gz OTOWWLKEZFZVLZ-VQTJNVASSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](CCc2ccc(C)cc2)C1)N(C)C ZINC001398696273 1360725366 /nfs/dbraw/zinc/72/53/66/1360725366.db2.gz OTOWWLKEZFZVLZ-VQTJNVASSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)C[NH2+]C[C@@H]1CCCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001398738676 1360754067 /nfs/dbraw/zinc/75/40/67/1360754067.db2.gz KHKMMFROBKYEEJ-LPHOPBHVSA-N 1 3 341.515 2.683 10 0 EFAEHO CCc1cccc(CN2CCCC[C@H]2CNC(=O)CC[NH+](C)C)c1 ZINC001398762850 1360769613 /nfs/dbraw/zinc/76/96/13/1360769613.db2.gz UTMZVSKYDUPFBI-IBGZPJMESA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC001398788054 1360791407 /nfs/dbraw/zinc/79/14/07/1360791407.db2.gz FJAZPTHVOGDGFH-WMZOPIPTSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC001398788054 1360791411 /nfs/dbraw/zinc/79/14/11/1360791411.db2.gz FJAZPTHVOGDGFH-WMZOPIPTSA-N 1 3 349.494 2.883 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](C)[C@@H](C)c1cccc(OC)c1 ZINC001492877750 1360860453 /nfs/dbraw/zinc/86/04/53/1360860453.db2.gz CUWGLYQXHRLYGL-LPHOPBHVSA-N 1 3 347.503 2.679 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](C)[C@@H](C)c1cccc(OC)c1 ZINC001492877750 1360860457 /nfs/dbraw/zinc/86/04/57/1360860457.db2.gz CUWGLYQXHRLYGL-LPHOPBHVSA-N 1 3 347.503 2.679 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CNC(=O)[C@@H]2CCCCN2C(C)C)c(C)n1 ZINC001437217243 1387476969 /nfs/dbraw/zinc/47/69/69/1387476969.db2.gz SWJKOZLJMDAPEF-APWZRJJASA-N 1 3 346.519 2.556 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1cc(C)cc(C)c1 ZINC001398944345 1360886389 /nfs/dbraw/zinc/88/63/89/1360886389.db2.gz CLCDKVIMHPXCOI-PKOBYXMFSA-N 1 3 331.504 2.772 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1cc(C)cc(C)c1 ZINC001398944313 1360886403 /nfs/dbraw/zinc/88/64/03/1360886403.db2.gz CLCDKVIMHPXCOI-IEBWSBKVSA-N 1 3 331.504 2.772 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]Cc1ccc(Cl)c(Cl)c1)N(C)C ZINC001398985465 1360912360 /nfs/dbraw/zinc/91/23/60/1360912360.db2.gz VDEQLQUTHQJQHN-IAQYHMDHSA-N 1 3 346.302 2.928 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H]2CCC[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001399284814 1361126412 /nfs/dbraw/zinc/12/64/12/1361126412.db2.gz WHBFDILOTMDIQP-MOPGFXCFSA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](C)CCNC(=O)CN(C)C2CCC2)c1 ZINC001399345124 1361162867 /nfs/dbraw/zinc/16/28/67/1361162867.db2.gz VHNMPBPIPPEQSM-OAHLLOKOSA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C/Cl ZINC001399346111 1361163491 /nfs/dbraw/zinc/16/34/91/1361163491.db2.gz OSRUXMPAURZZIW-NQAKMWCRSA-N 1 3 336.307 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C/Cl ZINC001399346111 1361163494 /nfs/dbraw/zinc/16/34/94/1361163494.db2.gz OSRUXMPAURZZIW-NQAKMWCRSA-N 1 3 336.307 2.664 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@@H+]1C)Cc1ccc2c(c1)CCC2 ZINC001399499842 1361281485 /nfs/dbraw/zinc/28/14/85/1361281485.db2.gz CEDAZCDBXIJQKW-HXUWFJFHSA-N 1 3 343.515 2.598 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@H+]1C)Cc1ccc2c(c1)CCC2 ZINC001399499842 1361281489 /nfs/dbraw/zinc/28/14/89/1361281489.db2.gz CEDAZCDBXIJQKW-HXUWFJFHSA-N 1 3 343.515 2.598 10 0 EFAEHO CN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)Cc1ccc(C(C)(C)C)cc1 ZINC001399648350 1361402562 /nfs/dbraw/zinc/40/25/62/1361402562.db2.gz YXKCDKRZYISUKI-SFHVURJKSA-N 1 3 345.531 2.874 10 0 EFAEHO CN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)Cc1ccc(C(C)(C)C)cc1 ZINC001399648350 1361402565 /nfs/dbraw/zinc/40/25/65/1361402565.db2.gz YXKCDKRZYISUKI-SFHVURJKSA-N 1 3 345.531 2.874 10 0 EFAEHO CCN(CCNC(=O)C12CCC[NH+](CCC1)C2)Cc1cccc(F)c1 ZINC001399717282 1361450919 /nfs/dbraw/zinc/45/09/19/1361450919.db2.gz DZPONWLESYYQGM-UHFFFAOYSA-N 1 3 347.478 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]CC[C@@H]1CCc2ccccc21 ZINC001437262323 1387515387 /nfs/dbraw/zinc/51/53/87/1387515387.db2.gz OCDHHLZJGGQEJT-AEFFLSMTSA-N 1 3 331.504 2.541 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)[C@@H](C)c1cccc(OC)c1 ZINC001399813257 1361513362 /nfs/dbraw/zinc/51/33/62/1361513362.db2.gz XXVZPZFGCAEJBS-IRXDYDNUSA-N 1 3 347.503 2.536 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)[C@@H](C)c1cccc(OC)c1 ZINC001399813257 1361513368 /nfs/dbraw/zinc/51/33/68/1361513368.db2.gz XXVZPZFGCAEJBS-IRXDYDNUSA-N 1 3 347.503 2.536 10 0 EFAEHO Cc1ccc(CN2CC[C@H](CNC(=O)CC[NH+](C)C)C2)c(Cl)c1 ZINC001399932840 1361589456 /nfs/dbraw/zinc/58/94/56/1361589456.db2.gz RRGOBNLSVPSFPX-OAHLLOKOSA-N 1 3 337.895 2.538 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[N@H+](C1CC1)[C@@H]1CCc2ccccc21)N(C)C ZINC001400038560 1361690014 /nfs/dbraw/zinc/69/00/14/1361690014.db2.gz JNHFLNMRCFLXRR-UXHICEINSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21)N(C)C ZINC001400038560 1361690017 /nfs/dbraw/zinc/69/00/17/1361690017.db2.gz JNHFLNMRCFLXRR-UXHICEINSA-N 1 3 343.515 2.841 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NCC[C@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001400179889 1361819015 /nfs/dbraw/zinc/81/90/15/1361819015.db2.gz COZLFOSXQXLVFA-IRXDYDNUSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NCC[C@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001400179889 1361819021 /nfs/dbraw/zinc/81/90/21/1361819021.db2.gz COZLFOSXQXLVFA-IRXDYDNUSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NCC[C@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001400179861 1361819156 /nfs/dbraw/zinc/81/91/56/1361819156.db2.gz COZLFOSXQXLVFA-DLBZAZTESA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NCC[C@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001400179861 1361819160 /nfs/dbraw/zinc/81/91/60/1361819160.db2.gz COZLFOSXQXLVFA-DLBZAZTESA-N 1 3 349.906 2.620 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)cc1 ZINC001400205128 1361842389 /nfs/dbraw/zinc/84/23/89/1361842389.db2.gz VLLSQXDVJDBPEQ-LJQANCHMSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)cc1 ZINC001400205128 1361842394 /nfs/dbraw/zinc/84/23/94/1361842394.db2.gz VLLSQXDVJDBPEQ-LJQANCHMSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccc(C[N@@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1C ZINC001400239520 1361874954 /nfs/dbraw/zinc/87/49/54/1361874954.db2.gz ABRXUJIDWLBOAG-HXUWFJFHSA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1ccc(C[N@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1C ZINC001400239520 1361874956 /nfs/dbraw/zinc/87/49/56/1361874956.db2.gz ABRXUJIDWLBOAG-HXUWFJFHSA-N 1 3 345.531 2.924 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@H+](C)CCc2ccccc2)CC1 ZINC001400243151 1361878058 /nfs/dbraw/zinc/87/80/58/1361878058.db2.gz ATXAPCBDQDZMQB-UHFFFAOYSA-N 1 3 345.531 2.740 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@@H+](C)CCc2ccccc2)CC1 ZINC001400243151 1361878065 /nfs/dbraw/zinc/87/80/65/1361878065.db2.gz ATXAPCBDQDZMQB-UHFFFAOYSA-N 1 3 345.531 2.740 10 0 EFAEHO C[N@H+](CCC1CCCC1)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001400251870 1361886747 /nfs/dbraw/zinc/88/67/47/1361886747.db2.gz SXIGBYMGVNBRAY-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO C[N@@H+](CCC1CCCC1)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001400251870 1361886748 /nfs/dbraw/zinc/88/67/48/1361886748.db2.gz SXIGBYMGVNBRAY-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001400251927 1361887342 /nfs/dbraw/zinc/88/73/42/1361887342.db2.gz TVEPESATWKLXSD-AQNXPRMDSA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001400251927 1361887347 /nfs/dbraw/zinc/88/73/47/1361887347.db2.gz TVEPESATWKLXSD-AQNXPRMDSA-N 1 3 349.563 2.933 10 0 EFAEHO CCCc1ccc(C[NH2+]C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001437320255 1387540170 /nfs/dbraw/zinc/54/01/70/1387540170.db2.gz AKJCMNBJYCNFJW-FQEVSTJZSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@H](c1ccc2c(c1)CCC2)N1CCC[C@@H](NC(=O)CC[NH+](C)C)C1 ZINC001400288799 1361909343 /nfs/dbraw/zinc/90/93/43/1361909343.db2.gz IEZNJFUMJQXACS-OXQOHEQNSA-N 1 3 343.515 2.769 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[C@H]([NH2+]CC2CC3(CCC3)C2)C1 ZINC001437327770 1387548266 /nfs/dbraw/zinc/54/82/66/1387548266.db2.gz KYFAPUKJAWQQBD-ROUUACIJSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001437334912 1387557441 /nfs/dbraw/zinc/55/74/41/1387557441.db2.gz WZIGUKUKVMHGHT-QZTJIDSGSA-N 1 3 331.504 2.834 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](CC)[NH2+]Cc1ccc(C)nc1C ZINC001400804033 1362173609 /nfs/dbraw/zinc/17/36/09/1362173609.db2.gz OQXDBZMCOWWJKD-RBUKOAKNSA-N 1 3 346.519 2.557 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCc1ccccc1 ZINC001400850733 1362210339 /nfs/dbraw/zinc/21/03/39/1362210339.db2.gz SVZSXYLZPDSYAF-SFHVURJKSA-N 1 3 331.504 2.588 10 0 EFAEHO CC[C@H](CNC(=O)Cc1nc[nH]c1C)[NH2+]CC1CCC2(CC2)CC1 ZINC001400905459 1362245271 /nfs/dbraw/zinc/24/52/71/1362245271.db2.gz PHZWNNUDQUAHRV-MRXNPFEDSA-N 1 3 332.492 2.715 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(Cl)cc1C ZINC001400909194 1362247038 /nfs/dbraw/zinc/24/70/38/1362247038.db2.gz BTLXCWDSMIHPCH-KRWDZBQOSA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@@](C)(NC(=O)CN(C)C(C)C)C1CC1 ZINC001401021314 1362367619 /nfs/dbraw/zinc/36/76/19/1362367619.db2.gz MBCOXQNKXBIKCG-HXUWFJFHSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@](C)(C[NH2+]CC1CC(C)(C)C1)C1CC1 ZINC001401048741 1362394741 /nfs/dbraw/zinc/39/47/41/1362394741.db2.gz UMEHVPRXMVDMJH-IBGZPJMESA-N 1 3 332.492 2.571 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@@H]1C[NH2+]Cc1ccsc1 ZINC001401087413 1362430641 /nfs/dbraw/zinc/43/06/41/1362430641.db2.gz WGPIBMJJQSGREB-HZPDHXFCSA-N 1 3 341.496 2.509 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC001401152706 1362489590 /nfs/dbraw/zinc/48/95/90/1362489590.db2.gz JPRJMRIDWKWHIS-KBPBESRZSA-N 1 3 341.446 2.708 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C(=O)[C@@H]1CCCN1C ZINC001401202746 1362542473 /nfs/dbraw/zinc/54/24/73/1362542473.db2.gz NVNSVYCLLHEXJH-BEFAXECRSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@H](CNCc1ccccc1F)N(C)C(=O)C(C)(C)[NH+]1CCCC1 ZINC001401238108 1362575631 /nfs/dbraw/zinc/57/56/31/1362575631.db2.gz GWBFHZIXGSPHSJ-OAHLLOKOSA-N 1 3 335.467 2.637 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C[C@H](C)N(C)C(=O)CN(C)C(C)C)c1 ZINC001401266268 1362607018 /nfs/dbraw/zinc/60/70/18/1362607018.db2.gz LEBMIEZBRCFMEQ-JKSUJKDBSA-N 1 3 335.492 2.533 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]CC1CC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001401275373 1362619472 /nfs/dbraw/zinc/61/94/72/1362619472.db2.gz VZJLLIDRYFYBBX-LPHOPBHVSA-N 1 3 341.515 2.729 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)cs1 ZINC001401299577 1362645465 /nfs/dbraw/zinc/64/54/65/1362645465.db2.gz NNSVMZJRYZFISP-WMLDXEAASA-N 1 3 337.533 2.723 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@H]1C[NH2+]Cc1ccsc1 ZINC001401306080 1362652934 /nfs/dbraw/zinc/65/29/34/1362652934.db2.gz MTDQDVNOGWUUFE-NVXWUHKLSA-N 1 3 337.533 2.805 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)cc1 ZINC001401344224 1362691580 /nfs/dbraw/zinc/69/15/80/1362691580.db2.gz OYHZRJWLUHOCAX-MJGOQNOKSA-N 1 3 331.504 2.567 10 0 EFAEHO CN(CC[N@H+](C)C[C@H]1CCCC(F)(F)C1)C(=O)CN(C)C1CCC1 ZINC001401368884 1362719526 /nfs/dbraw/zinc/71/95/26/1362719526.db2.gz LSUKQIBCKIYHPA-HNNXBMFYSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CC[N@@H+](C)C[C@H]1CCCC(F)(F)C1)C(=O)CN(C)C1CCC1 ZINC001401368884 1362719528 /nfs/dbraw/zinc/71/95/28/1362719528.db2.gz LSUKQIBCKIYHPA-HNNXBMFYSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2c1cccc2Cl)C(=O)CC[NH+](C)C ZINC001401388430 1362742373 /nfs/dbraw/zinc/74/23/73/1362742373.db2.gz OOLOOEOOFHMIMW-KRWDZBQOSA-N 1 3 337.895 2.669 10 0 EFAEHO CN(CC[N@H+](C)Cc1ccc(C2CCC2)cc1)C(=O)CN1CCCC1 ZINC001401436911 1362805186 /nfs/dbraw/zinc/80/51/86/1362805186.db2.gz IBNOZOXKVGDWOC-UHFFFAOYSA-N 1 3 343.515 2.940 10 0 EFAEHO CN(CC[N@@H+](C)Cc1ccc(C2CCC2)cc1)C(=O)CN1CCCC1 ZINC001401436911 1362805190 /nfs/dbraw/zinc/80/51/90/1362805190.db2.gz IBNOZOXKVGDWOC-UHFFFAOYSA-N 1 3 343.515 2.940 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)CCC[NH+]2CCCC2)c1 ZINC001401676796 1363019932 /nfs/dbraw/zinc/01/99/32/1363019932.db2.gz XVJGJOKJGFWLDR-MRXNPFEDSA-N 1 3 335.467 2.604 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]Cc1cccc(C(F)(F)F)c1)N(C)C ZINC001401711061 1363044909 /nfs/dbraw/zinc/04/49/09/1363044909.db2.gz BIUPFVUUPUCPDK-SWLSCSKDSA-N 1 3 345.409 2.640 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)C[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001401769777 1363106531 /nfs/dbraw/zinc/10/65/31/1363106531.db2.gz NRUJFIOVAPDQTQ-CVEARBPZSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)C[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001401769777 1363106532 /nfs/dbraw/zinc/10/65/32/1363106532.db2.gz NRUJFIOVAPDQTQ-CVEARBPZSA-N 1 3 347.503 2.677 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)Cc1cccc(C)c1 ZINC001401827398 1363170837 /nfs/dbraw/zinc/17/08/37/1363170837.db2.gz PLSNIGOAYZMECR-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)Cc1cccc(C)c1 ZINC001401827398 1363170840 /nfs/dbraw/zinc/17/08/40/1363170840.db2.gz PLSNIGOAYZMECR-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@H+](C)Cc1cccc(C)c1 ZINC001401827392 1363171052 /nfs/dbraw/zinc/17/10/52/1363171052.db2.gz PLSNIGOAYZMECR-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@@H+](C)Cc1cccc(C)c1 ZINC001401827392 1363171056 /nfs/dbraw/zinc/17/10/56/1363171056.db2.gz PLSNIGOAYZMECR-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NC[C@H]1CCN1[C@H]1CCc2ccccc21 ZINC001401927282 1363250131 /nfs/dbraw/zinc/25/01/31/1363250131.db2.gz QOOKVCANKDDOAR-QUCCMNQESA-N 1 3 341.499 2.740 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3cc(C)sc3C)CC2)CC[N@@H+]1C ZINC001401951040 1363269232 /nfs/dbraw/zinc/26/92/32/1363269232.db2.gz ZGFGBSSDJKSXMW-DLBZAZTESA-N 1 3 349.544 2.834 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3cc(C)sc3C)CC2)CC[N@H+]1C ZINC001401951040 1363269236 /nfs/dbraw/zinc/26/92/36/1363269236.db2.gz ZGFGBSSDJKSXMW-DLBZAZTESA-N 1 3 349.544 2.834 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NCC1(N[C@H]2CCc3c2cccc3F)CC1 ZINC001401976345 1363292963 /nfs/dbraw/zinc/29/29/63/1363292963.db2.gz ARVAJZYEXIDPGL-SFHVURJKSA-N 1 3 347.478 2.783 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NCC1(N[C@H]2CCc3c2cccc3F)CC1 ZINC001401976345 1363292968 /nfs/dbraw/zinc/29/29/68/1363292968.db2.gz ARVAJZYEXIDPGL-SFHVURJKSA-N 1 3 347.478 2.783 10 0 EFAEHO CC[C@@H](F)C[N@H+](CC1CC1)C1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001402004254 1363323671 /nfs/dbraw/zinc/32/36/71/1363323671.db2.gz MZVWRNMWCWPYIS-QGZVFWFLSA-N 1 3 341.515 2.778 10 0 EFAEHO CC[C@@H](F)C[N@@H+](CC1CC1)C1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001402004254 1363323675 /nfs/dbraw/zinc/32/36/75/1363323675.db2.gz MZVWRNMWCWPYIS-QGZVFWFLSA-N 1 3 341.515 2.778 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@]3(CCN(C(=O)CN(C)C(C)C)C3)C2)cs1 ZINC001402014203 1363331100 /nfs/dbraw/zinc/33/11/00/1363331100.db2.gz NGIPHETYQWURQS-IBGZPJMESA-N 1 3 349.544 2.821 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@]3(CCN(C(=O)CN(C)C(C)C)C3)C2)cs1 ZINC001402014203 1363331105 /nfs/dbraw/zinc/33/11/05/1363331105.db2.gz NGIPHETYQWURQS-IBGZPJMESA-N 1 3 349.544 2.821 10 0 EFAEHO CC(C)Oc1ccccc1CNC[C@H]1CCCN1C(=O)CC[NH+](C)C ZINC001402062068 1363368933 /nfs/dbraw/zinc/36/89/33/1363368933.db2.gz SGHJBCXSHKCMOV-GOSISDBHSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)c1ccccc1CN1CCC[C@@H](NC(=O)CC[NH+](C)C)C1 ZINC001402091702 1363397769 /nfs/dbraw/zinc/39/77/69/1363397769.db2.gz JPEOCJBEOHREGW-GOSISDBHSA-N 1 3 331.504 2.842 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@]1(C)CCN(Cc2ccc(C(F)F)cc2)C1 ZINC001402142024 1363449488 /nfs/dbraw/zinc/44/94/88/1363449488.db2.gz MNOAWEUCVDLFDM-SFHVURJKSA-N 1 3 339.430 2.657 10 0 EFAEHO CC[C@@H](F)CN1CCC(C)(CNC(=O)CC[C@H]2CCC[N@@H+]2C)CC1 ZINC001402193279 1363501224 /nfs/dbraw/zinc/50/12/24/1363501224.db2.gz WVJAUAIUNPFOGW-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](F)CN1CCC(C)(CNC(=O)CC[C@H]2CCC[N@H+]2C)CC1 ZINC001402193279 1363501228 /nfs/dbraw/zinc/50/12/28/1363501228.db2.gz WVJAUAIUNPFOGW-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@]1(C)CCC[N@H+](CCC(C)(C)C)C1 ZINC001402219149 1363538417 /nfs/dbraw/zinc/53/84/17/1363538417.db2.gz DHQZYVGRCIANRQ-IBGZPJMESA-N 1 3 334.508 2.915 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@]1(C)CCC[N@@H+](CCC(C)(C)C)C1 ZINC001402219149 1363538421 /nfs/dbraw/zinc/53/84/21/1363538421.db2.gz DHQZYVGRCIANRQ-IBGZPJMESA-N 1 3 334.508 2.915 10 0 EFAEHO CCCN(C(=O)[C@H](CC)N(C)C)C1CC[NH+](CC[C@H](C)F)CC1 ZINC001402245487 1363565557 /nfs/dbraw/zinc/56/55/57/1363565557.db2.gz NNJDXAYRPCWNRX-RDJZCZTQSA-N 1 3 329.504 2.778 10 0 EFAEHO C[C@@H](c1ccccc1F)N1CCC2(C[C@@H]2NC(=O)CC[NH+](C)C)CC1 ZINC001402245710 1363566626 /nfs/dbraw/zinc/56/66/26/1363566626.db2.gz QSIDYALZSXWOPM-YJBOKZPZSA-N 1 3 347.478 2.809 10 0 EFAEHO CC[C@H](F)C[NH+]1CCC2(C[C@@H]2NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001402246877 1363567131 /nfs/dbraw/zinc/56/71/31/1363567131.db2.gz SAUPWOSJOWZTBS-HOTGVXAUSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[C@@H](F)C[NH+]1CCC2(C[C@@H]2NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001402246872 1363567282 /nfs/dbraw/zinc/56/72/82/1363567282.db2.gz SAUPWOSJOWZTBS-CVEARBPZSA-N 1 3 341.515 2.683 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](CNC(=O)CN1CC[C@H](C)C1)C1CC1 ZINC001402319189 1363603168 /nfs/dbraw/zinc/60/31/68/1363603168.db2.gz AVXJCCIXFVVISG-OXJNMPFZSA-N 1 3 343.515 2.575 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+][C@@H]1CCc2ccc(F)cc21)C1CC1 ZINC001402389111 1363647567 /nfs/dbraw/zinc/64/75/67/1363647567.db2.gz XOMFTUCUHRIJKK-RTBURBONSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001402401390 1363660546 /nfs/dbraw/zinc/66/05/46/1363660546.db2.gz CCCNICXNZMEULT-WMZOPIPTSA-N 1 3 335.536 2.591 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2ccc(C)cc2)C1 ZINC001402411656 1363671438 /nfs/dbraw/zinc/67/14/38/1363671438.db2.gz DTCJNXGRBBWJRB-PKOBYXMFSA-N 1 3 331.504 2.521 10 0 EFAEHO C[C@H]([NH2+]CCC(C)(C)C)[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001402427463 1363686789 /nfs/dbraw/zinc/68/67/89/1363686789.db2.gz MSGOVGKACNATGA-ZWKOTPCHSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H]([NH2+]CCC(C)(C)C)[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001402427462 1363687038 /nfs/dbraw/zinc/68/70/38/1363687038.db2.gz MSGOVGKACNATGA-ROUUACIJSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CC3CCCCCC3)C[C@@H]2C1 ZINC001402432536 1363689753 /nfs/dbraw/zinc/68/97/53/1363689753.db2.gz NTNMOJCPJIJYFO-KDURUIRLSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CC3CCCCCC3)C[C@@H]2C1 ZINC001402432536 1363689756 /nfs/dbraw/zinc/68/97/56/1363689756.db2.gz NTNMOJCPJIJYFO-KDURUIRLSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CC[NH+](CC1CC(C)(C)C1)CC2 ZINC001402494063 1363737012 /nfs/dbraw/zinc/73/70/12/1363737012.db2.gz JTEFBIUPKHKSQY-UHFFFAOYSA-N 1 3 335.536 2.687 10 0 EFAEHO CCCN(C)CC(=O)NCc1cccc2c1CC[N@H+](CC(C)C)C2 ZINC001402533082 1363766414 /nfs/dbraw/zinc/76/64/14/1363766414.db2.gz ZSLCCIXOHLSPAN-UHFFFAOYSA-N 1 3 331.504 2.659 10 0 EFAEHO CCCN(C)CC(=O)NCc1cccc2c1CC[N@@H+](CC(C)C)C2 ZINC001402533082 1363766419 /nfs/dbraw/zinc/76/64/19/1363766419.db2.gz ZSLCCIXOHLSPAN-UHFFFAOYSA-N 1 3 331.504 2.659 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C\Cl)[NH+](CC)CC ZINC001402547066 1363776963 /nfs/dbraw/zinc/77/69/63/1363776963.db2.gz IAWYMMAXHFSWOS-NOPSARLPSA-N 1 3 341.927 2.971 10 0 EFAEHO Cc1ccccc1C[NH2+]C1(CNC(=O)CN2[C@H](C)CC[C@H]2C)CCC1 ZINC001402578386 1363806712 /nfs/dbraw/zinc/80/67/12/1363806712.db2.gz NIDZZPQGIYMINP-QZTJIDSGSA-N 1 3 343.515 2.996 10 0 EFAEHO Cc1ccccc1C[NH2+]C1(CNC(=O)CN2[C@@H](C)CC[C@@H]2C)CCC1 ZINC001402578389 1363806720 /nfs/dbraw/zinc/80/67/20/1363806720.db2.gz NIDZZPQGIYMINP-ROUUACIJSA-N 1 3 343.515 2.996 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)c(C)s1 ZINC001402604793 1363828287 /nfs/dbraw/zinc/82/82/87/1363828287.db2.gz XICVPMIGZXRTRG-IYBDPMFKSA-N 1 3 335.517 2.586 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001402610787 1363833260 /nfs/dbraw/zinc/83/32/60/1363833260.db2.gz OMGXFRVOFISLQL-QZTJIDSGSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001402610787 1363833266 /nfs/dbraw/zinc/83/32/66/1363833266.db2.gz OMGXFRVOFISLQL-QZTJIDSGSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2F)C1)N(C)C ZINC001402614719 1363837518 /nfs/dbraw/zinc/83/75/18/1363837518.db2.gz WXSZVEQYGNTHEC-LZWOXQAQSA-N 1 3 341.858 2.556 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC001402629822 1363858138 /nfs/dbraw/zinc/85/81/38/1363858138.db2.gz UAVMSCXUERVGGT-KRWDZBQOSA-N 1 3 337.895 2.762 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C(C)C)cc2)C1 ZINC001402635125 1363864029 /nfs/dbraw/zinc/86/40/29/1363864029.db2.gz TZZFFPMTXZOOJE-KDURUIRLSA-N 1 3 331.504 2.889 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001402635295 1363864684 /nfs/dbraw/zinc/86/46/84/1363864684.db2.gz VHFUIEQAIURINW-CEXWTWQISA-N 1 3 331.504 2.626 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CCC[N@H+](CCCC3CCC3)C2)C1 ZINC001402663081 1363907232 /nfs/dbraw/zinc/90/72/32/1363907232.db2.gz JWNZSCLWACOKFD-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CCC[N@@H+](CCCC3CCC3)C2)C1 ZINC001402663081 1363907233 /nfs/dbraw/zinc/90/72/33/1363907233.db2.gz JWNZSCLWACOKFD-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCCN(Cc2cccnc2)C1)[NH+](CC)CC ZINC001402670102 1363918095 /nfs/dbraw/zinc/91/80/95/1363918095.db2.gz WUVKFZBGKGHCII-RBUKOAKNSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC001402672603 1363921753 /nfs/dbraw/zinc/92/17/53/1363921753.db2.gz GDYHENIVXSEQBY-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001402672603 1363921754 /nfs/dbraw/zinc/92/17/54/1363921754.db2.gz GDYHENIVXSEQBY-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(CC)CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001402702659 1363951022 /nfs/dbraw/zinc/95/10/22/1363951022.db2.gz FEGLVNOZZWJGED-CVEARBPZSA-N 1 3 329.504 2.682 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001402751106 1363997829 /nfs/dbraw/zinc/99/78/29/1363997829.db2.gz MLQUFODWGGVERI-APWZRJJASA-N 1 3 341.515 2.970 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001402751106 1363997831 /nfs/dbraw/zinc/99/78/31/1363997831.db2.gz MLQUFODWGGVERI-APWZRJJASA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[NH2+]CC1CC2(CCC2)C1 ZINC001402778199 1364026290 /nfs/dbraw/zinc/02/62/90/1364026290.db2.gz UZRZNGJYEUUDEV-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)C1 ZINC001402787556 1364034305 /nfs/dbraw/zinc/03/43/05/1364034305.db2.gz AFSSPUILVJQXGV-JKSUJKDBSA-N 1 3 343.531 2.929 10 0 EFAEHO C[C@H](F)CC[N@H+]1CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)C1 ZINC001402787556 1364034307 /nfs/dbraw/zinc/03/43/07/1364034307.db2.gz AFSSPUILVJQXGV-JKSUJKDBSA-N 1 3 343.531 2.929 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]CCc1ccccc1F ZINC001402861381 1364097608 /nfs/dbraw/zinc/09/76/08/1364097608.db2.gz LOOUCOQZOXSPQN-QFBILLFUSA-N 1 3 349.494 2.727 10 0 EFAEHO CCC[N@H+](C)C[C@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001402911240 1364127441 /nfs/dbraw/zinc/12/74/41/1364127441.db2.gz ANQWDKVXTLINFE-QAPCUYQASA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@@H+](C)C[C@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001402911240 1364127444 /nfs/dbraw/zinc/12/74/44/1364127444.db2.gz ANQWDKVXTLINFE-QAPCUYQASA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@H+](Cc2ccc(C)nc2C)[C@@H](C)C1 ZINC001402932379 1364140357 /nfs/dbraw/zinc/14/03/57/1364140357.db2.gz KFJNQEVLKSVYPT-QFBILLFUSA-N 1 3 346.519 2.509 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C)nc2C)[C@@H](C)C1 ZINC001402932379 1364140361 /nfs/dbraw/zinc/14/03/61/1364140361.db2.gz KFJNQEVLKSVYPT-QFBILLFUSA-N 1 3 346.519 2.509 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H](C)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001402985983 1364183219 /nfs/dbraw/zinc/18/32/19/1364183219.db2.gz CLKCMDGMWSSTLK-CABCVRRESA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)CC(C)(C)C)c1 ZINC001403003609 1364201620 /nfs/dbraw/zinc/20/16/20/1364201620.db2.gz JVZUHPDPRDMKPR-IAGOWNOFSA-N 1 3 333.520 2.956 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001403020413 1364221321 /nfs/dbraw/zinc/22/13/21/1364221321.db2.gz VELPGMTYEULORO-QAPCUYQASA-N 1 3 329.488 2.643 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001403035734 1364239329 /nfs/dbraw/zinc/23/93/29/1364239329.db2.gz WMIJTSCXYWNLHC-IRXDYDNUSA-N 1 3 331.504 2.771 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[N@H+](C)CCc1ccc(C)cc1 ZINC001403151128 1364369786 /nfs/dbraw/zinc/36/97/86/1364369786.db2.gz YSLZDKRYUXJRTR-QUCCMNQESA-N 1 3 345.531 2.848 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[N@@H+](C)CCc1ccc(C)cc1 ZINC001403151128 1364369789 /nfs/dbraw/zinc/36/97/89/1364369789.db2.gz YSLZDKRYUXJRTR-QUCCMNQESA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[N@H+](C)CC1CCCC1 ZINC001403164517 1364384276 /nfs/dbraw/zinc/38/42/76/1364384276.db2.gz BTHJYIVUOZMNQH-BEFAXECRSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[N@@H+](C)CC1CCCC1 ZINC001403164517 1364384279 /nfs/dbraw/zinc/38/42/79/1364384279.db2.gz BTHJYIVUOZMNQH-BEFAXECRSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H](C)NCc1ccccc1F)[NH+]1CCCC1 ZINC001403170756 1364392430 /nfs/dbraw/zinc/39/24/30/1364392430.db2.gz UDLAFIACPWSWEK-MAUKXSAKSA-N 1 3 335.467 2.540 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)[C@H](C)CNC(=O)CN(C)C(C)C)c1 ZINC001403230409 1364447224 /nfs/dbraw/zinc/44/72/24/1364447224.db2.gz PQPSZCIZQVIFTC-HZPDHXFCSA-N 1 3 335.492 2.533 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)[C@H](C)CNC(=O)CN(C)C(C)C)c1 ZINC001403230409 1364447228 /nfs/dbraw/zinc/44/72/28/1364447228.db2.gz PQPSZCIZQVIFTC-HZPDHXFCSA-N 1 3 335.492 2.533 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]CC2CCC(C)(C)CC2)C1 ZINC001403248039 1364460002 /nfs/dbraw/zinc/46/00/02/1364460002.db2.gz ASGCJCKMMBMDDJ-SFHVURJKSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]CC1CCCC1 ZINC001403266866 1364479660 /nfs/dbraw/zinc/47/96/60/1364479660.db2.gz VOSREEVYZGBSBI-PKOBYXMFSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]([NH2+]CCc2ccccc2)C1 ZINC001403274673 1364488089 /nfs/dbraw/zinc/48/80/89/1364488089.db2.gz IFSQSNREQJNIAI-OALUTQOASA-N 1 3 331.504 2.586 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CCCCC[C@@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001403325101 1364542425 /nfs/dbraw/zinc/54/24/25/1364542425.db2.gz VVBMMFHLEBTSGR-DLBZAZTESA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H](F)CC[N@H+]1CCCCC[C@@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001403325101 1364542428 /nfs/dbraw/zinc/54/24/28/1364542428.db2.gz VVBMMFHLEBTSGR-DLBZAZTESA-N 1 3 341.515 2.970 10 0 EFAEHO Cc1ccc(CN2CC([C@@H](C)NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)cc1 ZINC001403331685 1364549178 /nfs/dbraw/zinc/54/91/78/1364549178.db2.gz ULTJXEWPKOZNJQ-YLJYHZDGSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1ccc(CN2CC([C@@H](C)NC(=O)CC[C@H]3CCC[N@H+]3C)C2)cc1 ZINC001403331685 1364549182 /nfs/dbraw/zinc/54/91/82/1364549182.db2.gz ULTJXEWPKOZNJQ-YLJYHZDGSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1ccc(CN2CC([C@H](C)NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)cc1 ZINC001403331682 1364549290 /nfs/dbraw/zinc/54/92/90/1364549290.db2.gz ULTJXEWPKOZNJQ-FXAWDEMLSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1ccc(CN2CC([C@H](C)NC(=O)CC[C@H]3CCC[N@H+]3C)C2)cc1 ZINC001403331682 1364549293 /nfs/dbraw/zinc/54/92/93/1364549293.db2.gz ULTJXEWPKOZNJQ-FXAWDEMLSA-N 1 3 343.515 2.806 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@H+](CCC2CC2)CC1(C)C)N1CCCC1 ZINC001403366452 1364577802 /nfs/dbraw/zinc/57/78/02/1364577802.db2.gz WTWOMEUXXGSCJK-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@@H+](CCC2CC2)CC1(C)C)N1CCCC1 ZINC001403366452 1364577804 /nfs/dbraw/zinc/57/78/04/1364577804.db2.gz WTWOMEUXXGSCJK-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1C[N@H+](CCC(C)C)CC1(C)C)N(CC)CC ZINC001403381754 1364590165 /nfs/dbraw/zinc/59/01/65/1364590165.db2.gz KVHPEBSBSRSQEI-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1C[N@@H+](CCC(C)C)CC1(C)C)N(CC)CC ZINC001403381754 1364590169 /nfs/dbraw/zinc/59/01/69/1364590169.db2.gz KVHPEBSBSRSQEI-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C3CCC3)C2)c1 ZINC001403416230 1364619821 /nfs/dbraw/zinc/61/98/21/1364619821.db2.gz NLIGNXIDYLQSLS-WGSAOQKQSA-N 1 3 343.515 2.718 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001403421746 1364626319 /nfs/dbraw/zinc/62/63/19/1364626319.db2.gz SKRFAIGXPJYAGZ-VAMGGRTRSA-N 1 3 343.515 2.745 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001403421746 1364626324 /nfs/dbraw/zinc/62/63/24/1364626324.db2.gz SKRFAIGXPJYAGZ-VAMGGRTRSA-N 1 3 343.515 2.745 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2ccc(F)cc2)C1)N(C)C ZINC001403422580 1364627031 /nfs/dbraw/zinc/62/70/31/1364627031.db2.gz MCPWHOZVZONJLB-DTTOXWODSA-N 1 3 335.467 2.711 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2cc(C)sc2C)C1)N(C)C ZINC001403423476 1364627792 /nfs/dbraw/zinc/62/77/92/1364627792.db2.gz NZPUHMSJCZITFV-DJIMGWMZSA-N 1 3 337.533 2.690 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3CCCCC3)C[C@H]21 ZINC001403431101 1364635093 /nfs/dbraw/zinc/63/50/93/1364635093.db2.gz YPXPOZGNQUHBAQ-NNZMDNLPSA-N 1 3 344.503 2.525 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3CCCCC3)C[C@H]21 ZINC001403431101 1364635097 /nfs/dbraw/zinc/63/50/97/1364635097.db2.gz YPXPOZGNQUHBAQ-NNZMDNLPSA-N 1 3 344.503 2.525 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001403432737 1364636727 /nfs/dbraw/zinc/63/67/27/1364636727.db2.gz ZXQRZBQDBSDFPT-CADBVGFASA-N 1 3 349.563 2.837 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001403432737 1364636729 /nfs/dbraw/zinc/63/67/29/1364636729.db2.gz ZXQRZBQDBSDFPT-CADBVGFASA-N 1 3 349.563 2.837 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H]2C[N@H+](CC3CCC3)C[C@H]2C1)CC(C)(C)C ZINC001403435539 1364637872 /nfs/dbraw/zinc/63/78/72/1364637872.db2.gz WYOCGZUDNCBAOS-IPMKNSEASA-N 1 3 349.563 2.981 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CC3CCC3)C[C@H]2C1)CC(C)(C)C ZINC001403435539 1364637874 /nfs/dbraw/zinc/63/78/74/1364637874.db2.gz WYOCGZUDNCBAOS-IPMKNSEASA-N 1 3 349.563 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc3c(c2)CCC3)C1 ZINC001403453697 1364655055 /nfs/dbraw/zinc/65/50/55/1364655055.db2.gz CIJLJWDSZAMTKV-IRJFHVNHSA-N 1 3 343.515 2.502 10 0 EFAEHO 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ZINC001404538759 1365636865 /nfs/dbraw/zinc/63/68/65/1365636865.db2.gz BUHLDZSKHHQJBJ-AEFFLSMTSA-N 1 3 349.544 2.951 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H]1CC[N@@H+](Cc2ccsc2)C1 ZINC001404538759 1365636869 /nfs/dbraw/zinc/63/68/69/1365636869.db2.gz BUHLDZSKHHQJBJ-AEFFLSMTSA-N 1 3 349.544 2.951 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2C[C@@H]3C[C@H]2CN3CCCC(C)(C)C)CC[N@@H+]1C ZINC001404956707 1365933694 /nfs/dbraw/zinc/93/36/94/1365933694.db2.gz APMSZRUBCMWAAE-XLAORIBOSA-N 1 3 335.536 2.828 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2C[C@@H]3C[C@H]2CN3CCCC(C)(C)C)CC[N@H+]1C ZINC001404956707 1365933697 /nfs/dbraw/zinc/93/36/97/1365933697.db2.gz APMSZRUBCMWAAE-XLAORIBOSA-N 1 3 335.536 2.828 10 0 EFAEHO CCCC[N@@H+]1CC[C@H](N(CC)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001405178543 1366088651 /nfs/dbraw/zinc/08/86/51/1366088651.db2.gz HUWHCKQNERFZHZ-QFBILLFUSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCC[N@H+]1CC[C@H](N(CC)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001405178543 1366088655 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3 346.519 2.556 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccc(C)nc1C ZINC001405262046 1366123410 /nfs/dbraw/zinc/12/34/10/1366123410.db2.gz UIGCJGIPBQQODV-MOPGFXCFSA-N 1 3 346.519 2.556 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc(C)nc1C ZINC001405269917 1366126535 /nfs/dbraw/zinc/12/65/35/1366126535.db2.gz HZAJSKDCYKCVIU-GOSISDBHSA-N 1 3 346.519 2.557 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](C(C)C)[NH+](C)C)NCc1ccc(F)cc1F ZINC001405343400 1366154481 /nfs/dbraw/zinc/15/44/81/1366154481.db2.gz FDEQNYSRLTYKLV-NVXWUHKLSA-N 1 3 341.446 2.535 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)NCc1cc2ccccc2o1 ZINC001405348079 1366156835 /nfs/dbraw/zinc/15/68/35/1366156835.db2.gz WKGXKGPGIRNWDH-RDJZCZTQSA-N 1 3 343.471 2.759 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)NCc1cc2ccccc2o1 ZINC001405348079 1366156838 /nfs/dbraw/zinc/15/68/38/1366156838.db2.gz WKGXKGPGIRNWDH-RDJZCZTQSA-N 1 3 343.471 2.759 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NCc1c(C)cccc1Cl ZINC001405352499 1366159403 /nfs/dbraw/zinc/15/94/03/1366159403.db2.gz VBNXOVWIFFRLRO-HUUCEWRRSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NCc1c(C)cccc1Cl ZINC001405352499 1366159407 /nfs/dbraw/zinc/15/94/07/1366159407.db2.gz VBNXOVWIFFRLRO-HUUCEWRRSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H]1CCCc2ccccc21 ZINC001405358830 1366162304 /nfs/dbraw/zinc/16/23/04/1366162304.db2.gz CVRVTSDKZZWAEK-HKUYNNGSSA-N 1 3 331.504 2.889 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@H]1CC[C@H](NC(=O)[C@H]2CCCN2C(C)C)CC1 ZINC001405522642 1366265993 /nfs/dbraw/zinc/26/59/93/1366265993.db2.gz RGPYJYSBLDHTHF-QBPKDAKJSA-N 1 3 327.488 2.624 10 0 EFAEHO CC[C@@H](F)CN1CCC(CCNC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)CC1 ZINC001405565644 1366299603 /nfs/dbraw/zinc/29/96/03/1366299603.db2.gz WLKPVGYOBZTHFZ-FGTMMUONSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[C@@H](F)CN1CCC(CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)CC1 ZINC001405565644 1366299605 /nfs/dbraw/zinc/29/96/05/1366299605.db2.gz WLKPVGYOBZTHFZ-FGTMMUONSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+]Cc1cc(Cl)ccc1F ZINC001405726045 1366366640 /nfs/dbraw/zinc/36/66/40/1366366640.db2.gz YWKNAVHWQQEXHS-ZDUSSCGKSA-N 1 3 343.874 2.661 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)[C@@H]2CCCN2C)cc1 ZINC001405803135 1366426391 /nfs/dbraw/zinc/42/63/91/1366426391.db2.gz ZRIAQKKICDNKHG-XLIONFOSSA-N 1 3 345.531 2.916 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C(=O)CN(C)C1CCC1 ZINC001405838813 1366452851 /nfs/dbraw/zinc/45/28/51/1366452851.db2.gz VQQDGPADUPTCMK-OAHLLOKOSA-N 1 3 342.487 2.589 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)c(C)s1 ZINC001405871487 1366480173 /nfs/dbraw/zinc/48/01/73/1366480173.db2.gz QSPUBAFZYCORDN-KGLIPLIRSA-N 1 3 337.533 2.643 10 0 EFAEHO C[C@H](C[NH2+]CC1CCC(C)(C)CC1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001405873094 1366481367 /nfs/dbraw/zinc/48/13/67/1366481367.db2.gz SRNUSMHASAZGOM-DLBZAZTESA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)N(C)C(=O)C[N@@H+]1CC[C@@H](C)C1 ZINC001405875714 1366483958 /nfs/dbraw/zinc/48/39/58/1366483958.db2.gz YHWUMNAUAFYTEA-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)N(C)C(=O)C[N@H+]1CC[C@@H](C)C1 ZINC001405875714 1366483961 /nfs/dbraw/zinc/48/39/61/1366483961.db2.gz YHWUMNAUAFYTEA-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(F)c(Cl)c1)N(C)C(=O)CN1CCCC1 ZINC001405880956 1366488622 /nfs/dbraw/zinc/48/86/22/1366488622.db2.gz DCTPQWHXGRRPKW-CYBMUJFWSA-N 1 3 341.858 2.511 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]Cc1ccccc1)NC(=O)CN1CC[C@H](C)C1 ZINC001405925286 1366526785 /nfs/dbraw/zinc/52/67/85/1366526785.db2.gz DEOYZNQTKWVAJW-HKUYNNGSSA-N 1 3 331.504 2.649 10 0 EFAEHO CCC[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC(C)C ZINC001493317712 1398609531 /nfs/dbraw/zinc/60/95/31/1398609531.db2.gz GQHZMQYRWVEFLM-SFHVURJKSA-N 1 3 329.504 2.683 10 0 EFAEHO CCC[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC(C)C ZINC001493317712 1398609532 /nfs/dbraw/zinc/60/95/32/1398609532.db2.gz GQHZMQYRWVEFLM-SFHVURJKSA-N 1 3 329.504 2.683 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC(CC[N@H+](C)CC2CCCC2)CC1 ZINC001405971924 1367028994 /nfs/dbraw/zinc/02/89/94/1367028994.db2.gz RXQRWLLKKOJXKE-LJQANCHMSA-N 1 3 335.536 2.831 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC(CC[N@@H+](C)CC2CCCC2)CC1 ZINC001405971924 1367028999 /nfs/dbraw/zinc/02/89/99/1367028999.db2.gz RXQRWLLKKOJXKE-LJQANCHMSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)CC[N@H+](C)CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001405992249 1367062691 /nfs/dbraw/zinc/06/26/91/1367062691.db2.gz NGKFWVKHERACOB-GOSISDBHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CC[N@@H+](C)CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001405992249 1367062693 /nfs/dbraw/zinc/06/26/93/1367062693.db2.gz NGKFWVKHERACOB-GOSISDBHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CC[N@H+](C)CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001405992259 1367063137 /nfs/dbraw/zinc/06/31/37/1367063137.db2.gz NGKFWVKHERACOB-SFHVURJKSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CC[N@@H+](C)CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001405992259 1367063145 /nfs/dbraw/zinc/06/31/45/1367063145.db2.gz NGKFWVKHERACOB-SFHVURJKSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(CC[N@@H+](C)CC[C@@H](C)F)CC1 ZINC001405994714 1367068132 /nfs/dbraw/zinc/06/81/32/1367068132.db2.gz BZACISXAIHOPLW-MRXNPFEDSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(CC[N@H+](C)CC[C@@H](C)F)CC1 ZINC001405994714 1367068141 /nfs/dbraw/zinc/06/81/41/1367068141.db2.gz BZACISXAIHOPLW-MRXNPFEDSA-N 1 3 329.504 2.635 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2ccc(Cl)cc21)C(=O)[C@H]1CC[N@H+](C)C1 ZINC001406172284 1367364333 /nfs/dbraw/zinc/36/43/33/1367364333.db2.gz XRRITQCGYJBLIK-YJBOKZPZSA-N 1 3 349.906 2.669 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2ccc(Cl)cc21)C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001406172284 1367364339 /nfs/dbraw/zinc/36/43/39/1367364339.db2.gz XRRITQCGYJBLIK-YJBOKZPZSA-N 1 3 349.906 2.669 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CCC[C@@H]2NC(=O)CN(C)C(C)C)cc1F ZINC001406181115 1367378347 /nfs/dbraw/zinc/37/83/47/1367378347.db2.gz ATNWUUVDHOFBNJ-HKUYNNGSSA-N 1 3 349.494 2.849 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCc2ccccc21)C(=O)[C@H](C(C)C)N(C)C ZINC001406338531 1367500184 /nfs/dbraw/zinc/50/01/84/1367500184.db2.gz HOIRGIYNYXPJGM-MOPGFXCFSA-N 1 3 331.504 2.698 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1ccccc1Cl ZINC001406360926 1367523051 /nfs/dbraw/zinc/52/30/51/1367523051.db2.gz FWSVKRBIMZLAQK-PBHICJAKSA-N 1 3 337.895 2.809 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1ccccc1Cl ZINC001406360926 1367523056 /nfs/dbraw/zinc/52/30/56/1367523056.db2.gz FWSVKRBIMZLAQK-PBHICJAKSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@H](C[NH2+]C[C@@H]1CCCC(F)(F)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001406374237 1367533512 /nfs/dbraw/zinc/53/35/12/1367533512.db2.gz CEMLNCPWTVAKTJ-HUUCEWRRSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CC2)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001406401111 1367548455 /nfs/dbraw/zinc/54/84/55/1367548455.db2.gz QCUVYPSRLZDSDQ-JKSUJKDBSA-N 1 3 329.488 2.500 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCCN2C(C)C)cs1 ZINC001406414713 1367563152 /nfs/dbraw/zinc/56/31/52/1367563152.db2.gz YOCJMUOKSXWZOS-PBHICJAKSA-N 1 3 337.533 2.914 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](CC)C[C@@H]1CCC(F)(F)C1 ZINC001437647427 1387887564 /nfs/dbraw/zinc/88/75/64/1387887564.db2.gz CSWYFTNLQISCOX-CVEARBPZSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](CC)C[C@@H]1CCC(F)(F)C1 ZINC001437647427 1387887577 /nfs/dbraw/zinc/88/75/77/1387887577.db2.gz CSWYFTNLQISCOX-CVEARBPZSA-N 1 3 345.478 2.734 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)[C@@H]2C[NH+]3CCC2CC3)c(Cl)c1 ZINC001406481096 1367633328 /nfs/dbraw/zinc/63/33/28/1367633328.db2.gz KVGMNTKUPDTECO-WMLDXEAASA-N 1 3 349.906 2.585 10 0 EFAEHO C[C@H](C[N@H+](C)CC[C@@H]1CCCC1(F)F)NC(=O)C1(N(C)C)CCC1 ZINC001406599570 1367781840 /nfs/dbraw/zinc/78/18/40/1367781840.db2.gz FXBITKRVIPVJGU-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C[N@@H+](C)CC[C@@H]1CCCC1(F)F)NC(=O)C1(N(C)C)CCC1 ZINC001406599570 1367781845 /nfs/dbraw/zinc/78/18/45/1367781845.db2.gz FXBITKRVIPVJGU-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C2CCC2)cc1)NC(=O)CC[NH+](C)C ZINC001406654652 1367872622 /nfs/dbraw/zinc/87/26/22/1367872622.db2.gz NATSYHWCECABIB-MRXNPFEDSA-N 1 3 331.504 2.842 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@H+](C)CC1CC2(CCC2)C1 ZINC001406712754 1367963428 /nfs/dbraw/zinc/96/34/28/1367963428.db2.gz FAJMEMWUUGDMKD-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001406712754 1367963430 /nfs/dbraw/zinc/96/34/30/1367963430.db2.gz FAJMEMWUUGDMKD-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)[C@@H]1CCc2c1cccc2F ZINC001406726653 1367973512 /nfs/dbraw/zinc/97/35/12/1367973512.db2.gz RBSPMJIRQNRCRM-RDTXWAMCSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)[C@@H]1CCc2c1cccc2F ZINC001406726653 1367973523 /nfs/dbraw/zinc/97/35/23/1367973523.db2.gz RBSPMJIRQNRCRM-RDTXWAMCSA-N 1 3 335.467 2.590 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1ccc(Cl)cc1)C1CC1)N(C)C ZINC001406775000 1368033883 /nfs/dbraw/zinc/03/38/83/1368033883.db2.gz BNTNISOMQNTSDI-IAGOWNOFSA-N 1 3 337.895 2.665 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1cc2ccccc2o1)C1CC1)N(C)C ZINC001406784199 1368047802 /nfs/dbraw/zinc/04/78/02/1368047802.db2.gz OFZWIORTNVJDRX-ZWKOTPCHSA-N 1 3 343.471 2.757 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN2CCCC2)CC[C@H]1[NH2+]C/C(Cl)=C\Cl ZINC001406806538 1368079698 /nfs/dbraw/zinc/07/96/98/1368079698.db2.gz KMIOHNGNAPEFMZ-VEWWLGSESA-N 1 3 348.318 2.618 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@H]1CNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001406837420 1368110801 /nfs/dbraw/zinc/11/08/01/1368110801.db2.gz GKNCWFZHYONBGE-OALUTQOASA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@H]1CNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001406837420 1368110804 /nfs/dbraw/zinc/11/08/04/1368110804.db2.gz GKNCWFZHYONBGE-OALUTQOASA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCN1CCC1CCCC1)[NH+]1CCCC1 ZINC001406889098 1368172538 /nfs/dbraw/zinc/17/25/38/1368172538.db2.gz CTPINYVPLLCMRB-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+]Cc2ccc(C3CC3)cc2)CC1)N(C)C ZINC001406990534 1368288499 /nfs/dbraw/zinc/28/84/99/1368288499.db2.gz YGFNKQIBVNOJRE-SFHVURJKSA-N 1 3 329.488 2.643 10 0 EFAEHO CCc1ccccc1C[NH2+]C1(CNC(=O)CN2[C@H](C)CC[C@H]2C)CC1 ZINC001407013161 1368323720 /nfs/dbraw/zinc/32/37/20/1368323720.db2.gz WVEJWDNTRLNILA-IAGOWNOFSA-N 1 3 343.515 2.860 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CC[C@@]2(C1)CCCN(C[C@@H](F)CC)C2 ZINC001407026166 1368342713 /nfs/dbraw/zinc/34/27/13/1368342713.db2.gz UNZRKEATRXSZQY-HKUYNNGSSA-N 1 3 341.515 2.781 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CC[C@@]2(C1)CCCN(C[C@@H](F)CC)C2 ZINC001407026166 1368342718 /nfs/dbraw/zinc/34/27/18/1368342718.db2.gz UNZRKEATRXSZQY-HKUYNNGSSA-N 1 3 341.515 2.781 10 0 EFAEHO CN(C(=O)CCC[NH+]1CCCCC1)C1CN(C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC001407078120 1368400903 /nfs/dbraw/zinc/40/09/03/1368400903.db2.gz KYLIXDPKTOVONN-CEXWTWQISA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]C/C=C\c2ccccc2)CCN1C(=O)CN1CCCC1 ZINC001407082297 1368405353 /nfs/dbraw/zinc/40/53/53/1368405353.db2.gz FXJSIUULVIUZPQ-XHKZUWJLSA-N 1 3 341.499 2.765 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCCC[C@@]2(CCN(C/C=C/Cl)C2)C1 ZINC001407174103 1368541450 /nfs/dbraw/zinc/54/14/50/1368541450.db2.gz RREZGKAQEIYYCO-OPUMOTSWSA-N 1 3 341.927 2.785 10 0 EFAEHO CC[C@H](F)CN1CCC[C@@](C)(CNC(=O)CC2CC[NH+](C)CC2)C1 ZINC001407288355 1368710485 /nfs/dbraw/zinc/71/04/85/1368710485.db2.gz DJNCROPQDRNFQR-HKUYNNGSSA-N 1 3 341.515 2.685 10 0 EFAEHO CC[C@@H](C(=O)NC[C@]1(C)CCC[N@H+](CCC(C)(C)C)C1)N(C)C ZINC001407290089 1368713164 /nfs/dbraw/zinc/71/31/64/1368713164.db2.gz CMFUPAJPZHEFNV-LPHOPBHVSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C(=O)NC[C@]1(C)CCC[N@@H+](CCC(C)(C)C)C1)N(C)C ZINC001407290089 1368713167 /nfs/dbraw/zinc/71/31/67/1368713167.db2.gz CMFUPAJPZHEFNV-LPHOPBHVSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1C[N@H+](CCC(C)(C)C)CCC1(F)F ZINC001407316393 1368759938 /nfs/dbraw/zinc/75/99/38/1368759938.db2.gz JAQNODIPVCAJJF-OAHLLOKOSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1C[N@@H+](CCC(C)(C)C)CCC1(F)F ZINC001407316393 1368759939 /nfs/dbraw/zinc/75/99/39/1368759939.db2.gz JAQNODIPVCAJJF-OAHLLOKOSA-N 1 3 347.494 2.836 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1cccc(C)c1)C2 ZINC001407494793 1368910206 /nfs/dbraw/zinc/91/02/06/1368910206.db2.gz NNXZPIJWBPXQJC-UFYCRDLUSA-N 1 3 343.515 2.806 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1cccc(C)c1)C2 ZINC001407494793 1368910210 /nfs/dbraw/zinc/91/02/10/1368910210.db2.gz NNXZPIJWBPXQJC-UFYCRDLUSA-N 1 3 343.515 2.806 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C2CC[NH+](CC(C)C)CC2)C1 ZINC001407495967 1368911210 /nfs/dbraw/zinc/91/12/10/1368911210.db2.gz OHKPWHRCWGAJOG-LJQANCHMSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@H](c1ccccc1Cl)N1CC[C@H](CNC(=O)CC[NH+](C)C)C1 ZINC001437722918 1387971406 /nfs/dbraw/zinc/97/14/06/1387971406.db2.gz NSWFITVZHMVGOQ-HUUCEWRRSA-N 1 3 337.895 2.791 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1C ZINC001407564499 1368993885 /nfs/dbraw/zinc/99/38/85/1368993885.db2.gz WDKCGIVTWRHWJI-ICSRJNTNSA-N 1 3 345.531 2.970 10 0 EFAEHO CCc1cccc(C[N@@H+]2CC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001437728234 1387978242 /nfs/dbraw/zinc/97/82/42/1387978242.db2.gz OVSISGMQSZZRTF-XLIONFOSSA-N 1 3 343.515 2.529 10 0 EFAEHO CCc1cccc(C[N@H+]2CC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001437728234 1387978245 /nfs/dbraw/zinc/97/82/45/1387978245.db2.gz OVSISGMQSZZRTF-XLIONFOSSA-N 1 3 343.515 2.529 10 0 EFAEHO CCCC[N@H+](C)Cc1ccccc1CNC(=O)CN1CC[C@H](C)C1 ZINC001407681600 1369102231 /nfs/dbraw/zinc/10/22/31/1369102231.db2.gz BDIATKNRFHZOSP-KRWDZBQOSA-N 1 3 331.504 2.877 10 0 EFAEHO CCCC[N@@H+](C)Cc1ccccc1CNC(=O)CN1CC[C@H](C)C1 ZINC001407681600 1369102240 /nfs/dbraw/zinc/10/22/40/1369102240.db2.gz BDIATKNRFHZOSP-KRWDZBQOSA-N 1 3 331.504 2.877 10 0 EFAEHO CCCC[N@@H+]1CCc2c(CNC(=O)[C@@H](CC)N(C)C)cccc2C1 ZINC001407746772 1369187357 /nfs/dbraw/zinc/18/73/57/1369187357.db2.gz MNXSQXPHFQUHPY-LJQANCHMSA-N 1 3 331.504 2.801 10 0 EFAEHO CCCC[N@H+]1CCc2c(CNC(=O)[C@@H](CC)N(C)C)cccc2C1 ZINC001407746772 1369187362 /nfs/dbraw/zinc/18/73/62/1369187362.db2.gz MNXSQXPHFQUHPY-LJQANCHMSA-N 1 3 331.504 2.801 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+]Cc2ccsc2)CCC1 ZINC001407774298 1369216586 /nfs/dbraw/zinc/21/65/86/1369216586.db2.gz BFJQVGFNKLNBFE-MRXNPFEDSA-N 1 3 335.517 2.749 10 0 EFAEHO CC(C)CC[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CCC1 ZINC001407795044 1369242292 /nfs/dbraw/zinc/24/22/92/1369242292.db2.gz ACKZSTWSKUDIKV-IBGZPJMESA-N 1 3 341.515 2.874 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001437742207 1387994309 /nfs/dbraw/zinc/99/43/09/1387994309.db2.gz RUIVCZKYJNXIIT-QGZVFWFLSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccccc1C[N@H+]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001437742207 1387994314 /nfs/dbraw/zinc/99/43/14/1387994314.db2.gz RUIVCZKYJNXIIT-QGZVFWFLSA-N 1 3 331.504 2.527 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)CCCN(C)C(=O)CN2CCCC2)c1 ZINC001407949543 1369448548 /nfs/dbraw/zinc/44/85/48/1369448548.db2.gz UZCQICJYFOYGBJ-UHFFFAOYSA-N 1 3 331.504 2.680 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)CCCN(C)C(=O)CN2CCCC2)c1 ZINC001407949543 1369448551 /nfs/dbraw/zinc/44/85/51/1369448551.db2.gz UZCQICJYFOYGBJ-UHFFFAOYSA-N 1 3 331.504 2.680 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)N(C)CCCN(C)CCC(F)(F)F ZINC001407952992 1369454821 /nfs/dbraw/zinc/45/48/21/1369454821.db2.gz BOFOEVGERAQXEK-ZIAGYGMSSA-N 1 3 337.430 2.592 10 0 EFAEHO CCC1([NH2+]CC[C@@H](C)F)CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001407990495 1369501535 /nfs/dbraw/zinc/50/15/35/1369501535.db2.gz BOKYYKXZCBTATM-CVEARBPZSA-N 1 3 329.504 2.682 10 0 EFAEHO C[C@H](F)CCN1Cc2ccccc2C[C@H]1CNC(=O)CCC[NH+](C)C ZINC001407996079 1369509432 /nfs/dbraw/zinc/50/94/32/1369509432.db2.gz CQKRAQWWHKTLLU-LPHOPBHVSA-N 1 3 349.494 2.619 10 0 EFAEHO CCC1([NH2+]C/C(Cl)=C/Cl)CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001408010237 1369524679 /nfs/dbraw/zinc/52/46/79/1369524679.db2.gz RKEJLRFUCARHBF-YBEMTRGBSA-N 1 3 348.318 2.760 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001408080008 1369586627 /nfs/dbraw/zinc/58/66/27/1369586627.db2.gz AKXKNCCLJHUVMZ-UZLBHIALSA-N 1 3 343.515 2.841 10 0 EFAEHO Cc1ccc(CC[NH2+]C2(C)CCN(C(=O)[C@@H]3CCCN3C)CC2)cc1 ZINC001408087976 1369592835 /nfs/dbraw/zinc/59/28/35/1369592835.db2.gz MTYAIQVRSOIGEX-IBGZPJMESA-N 1 3 343.515 2.602 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)C[C@H]1C ZINC001408188546 1369695069 /nfs/dbraw/zinc/69/50/69/1369695069.db2.gz QIFITRLCTSTSFV-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)C[C@H]1C ZINC001408188546 1369695079 /nfs/dbraw/zinc/69/50/79/1369695079.db2.gz QIFITRLCTSTSFV-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CN(C/C=C/c1ccccc1)C[C@@H]1CCCN1C(=O)CC[NH+](C)C ZINC001408352220 1369862027 /nfs/dbraw/zinc/86/20/27/1369862027.db2.gz ZIIRUZXVMHKCSV-SSVWKNEZSA-N 1 3 329.488 2.574 10 0 EFAEHO Cc1cccc(C[N@@H+](C)C[C@@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001408355347 1369867642 /nfs/dbraw/zinc/86/76/42/1369867642.db2.gz IKUIXPDAVANDIE-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1cccc(C[N@H+](C)C[C@@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001408355347 1369867647 /nfs/dbraw/zinc/86/76/47/1369867647.db2.gz IKUIXPDAVANDIE-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO COC(=O)[C@@H]1CCCC[C@@H]1CN1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC001414040949 1370035046 /nfs/dbraw/zinc/03/50/46/1370035046.db2.gz YDWOBIWQAFMKIC-LZLYRXPVSA-N 1 3 331.460 2.572 10 0 EFAEHO C[C@H](NCc1ccc(Cl)cc1Cl)[C@H](C)NC(=O)CC[NH+](C)C ZINC001505686053 1404937021 /nfs/dbraw/zinc/93/70/21/1404937021.db2.gz LFYYVWCOTNLIGV-RYUDHWBXSA-N 1 3 346.302 2.928 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+]CC1CC(C)C1)c1ccccc1 ZINC001437867565 1388156019 /nfs/dbraw/zinc/15/60/19/1388156019.db2.gz DEZIMVPRKNGRFV-FAFZWHIHSA-N 1 3 331.504 2.820 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1C[C@H]2CC[C@@H](C1)[N@H+]2CCC(C)(C)C ZINC001437881282 1388166035 /nfs/dbraw/zinc/16/60/35/1388166035.db2.gz VWSYEUNQMZQDGX-IXDOHACOSA-N 1 3 341.515 2.778 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC(C)(C)C ZINC001437881282 1388166041 /nfs/dbraw/zinc/16/60/41/1388166041.db2.gz VWSYEUNQMZQDGX-IXDOHACOSA-N 1 3 341.515 2.778 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCCN1C(C)C)[C@H]1CC[N@H+](CCCF)C1 ZINC001437896417 1388190346 /nfs/dbraw/zinc/19/03/46/1388190346.db2.gz SDBYCRBGKIIWDM-IRXDYDNUSA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCCN1C(C)C)[C@H]1CC[N@@H+](CCCF)C1 ZINC001437896417 1388190352 /nfs/dbraw/zinc/19/03/52/1388190352.db2.gz SDBYCRBGKIIWDM-IRXDYDNUSA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCC[N@@H+]1C(C)C)[C@H]1CCN(CCCF)C1 ZINC001437896417 1388190363 /nfs/dbraw/zinc/19/03/63/1388190363.db2.gz SDBYCRBGKIIWDM-IRXDYDNUSA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCC[N@H+]1C(C)C)[C@H]1CCN(CCCF)C1 ZINC001437896417 1388190371 /nfs/dbraw/zinc/19/03/71/1388190371.db2.gz SDBYCRBGKIIWDM-IRXDYDNUSA-N 1 3 327.488 2.532 10 0 EFAEHO CN(C)CCN(CCc1ccccc1)C(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001417613531 1373092627 /nfs/dbraw/zinc/09/26/27/1373092627.db2.gz FGICTZYRBNGELW-PMACEKPBSA-N 1 3 343.515 2.636 10 0 EFAEHO CN(C)CCN(CCc1ccccc1)C(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001417613531 1373092630 /nfs/dbraw/zinc/09/26/30/1373092630.db2.gz FGICTZYRBNGELW-PMACEKPBSA-N 1 3 343.515 2.636 10 0 EFAEHO CN(C)CCN(CCc1ccccc1)C(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001417613534 1373092740 /nfs/dbraw/zinc/09/27/40/1373092740.db2.gz FGICTZYRBNGELW-WOJBJXKFSA-N 1 3 343.515 2.636 10 0 EFAEHO CN(C)CCN(CCc1ccccc1)C(=O)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001417613534 1373092743 /nfs/dbraw/zinc/09/27/43/1373092743.db2.gz FGICTZYRBNGELW-WOJBJXKFSA-N 1 3 343.515 2.636 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001417625298 1373103753 /nfs/dbraw/zinc/10/37/53/1373103753.db2.gz MODNCYSLLXRZQX-RBUKOAKNSA-N 1 3 329.488 2.594 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001417625298 1373103757 /nfs/dbraw/zinc/10/37/57/1373103757.db2.gz MODNCYSLLXRZQX-RBUKOAKNSA-N 1 3 329.488 2.594 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21)N(C)Cc1ccccc1 ZINC001417643808 1373117789 /nfs/dbraw/zinc/11/77/89/1373117789.db2.gz IBQXMYLXORGXSX-NEWSRXKRSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21)N(C)Cc1ccccc1 ZINC001417643808 1373117792 /nfs/dbraw/zinc/11/77/92/1373117792.db2.gz IBQXMYLXORGXSX-NEWSRXKRSA-N 1 3 329.488 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2)C1 ZINC001417778257 1373244326 /nfs/dbraw/zinc/24/43/26/1373244326.db2.gz QANOCJBREUBZEL-WOVMCDHWSA-N 1 3 337.895 2.665 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1C[C@H]([NH2+]CC2CCC3(CC3)CC2)C1 ZINC001417795394 1373262165 /nfs/dbraw/zinc/26/21/65/1373262165.db2.gz AMDCQJZGUAWCLM-QAQDUYKDSA-N 1 3 344.503 2.715 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC001417799944 1373268138 /nfs/dbraw/zinc/26/81/38/1373268138.db2.gz ANPFANPVFRKPNA-SPYBWZPUSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2cccc(F)c2)C1)N(C)C ZINC001417808017 1373277769 /nfs/dbraw/zinc/27/77/69/1373277769.db2.gz AMZVMRSZFIHGIG-CGTJXYLNSA-N 1 3 335.467 2.540 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CCC(C)C ZINC001417819693 1373291736 /nfs/dbraw/zinc/29/17/36/1373291736.db2.gz ATVHZTHSPSYLKW-MANSERQUSA-N 1 3 335.536 2.543 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CCC(C)C ZINC001417819693 1373291743 /nfs/dbraw/zinc/29/17/43/1373291743.db2.gz ATVHZTHSPSYLKW-MANSERQUSA-N 1 3 335.536 2.543 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@H]2CCC[N@H+](CCC(C)C)[C@H]2C1(C)C ZINC001417821055 1373292872 /nfs/dbraw/zinc/29/28/72/1373292872.db2.gz HFXPEYGMXJMOAN-BHIYHBOVSA-N 1 3 337.552 2.980 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@H]2CCC[N@@H+](CCC(C)C)[C@H]2C1(C)C ZINC001417821055 1373292877 /nfs/dbraw/zinc/29/28/77/1373292877.db2.gz HFXPEYGMXJMOAN-BHIYHBOVSA-N 1 3 337.552 2.980 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2[N@@H+](CC2CCCC2)C1 ZINC001417822945 1373297867 /nfs/dbraw/zinc/29/78/67/1373297867.db2.gz OKLHWNBYYCXFOC-MUGJNUQGSA-N 1 3 347.547 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2[N@H+](CC2CCCC2)C1 ZINC001417822945 1373297872 /nfs/dbraw/zinc/29/78/72/1373297872.db2.gz OKLHWNBYYCXFOC-MUGJNUQGSA-N 1 3 347.547 2.687 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)C[C@@H]3C2)cc1 ZINC001417841331 1373322906 /nfs/dbraw/zinc/32/29/06/1373322906.db2.gz LOLIDDFZGDOQPU-UXHICEINSA-N 1 3 343.515 2.616 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)C[C@@H]3C2)cc1 ZINC001417841331 1373322912 /nfs/dbraw/zinc/32/29/12/1373322912.db2.gz LOLIDDFZGDOQPU-UXHICEINSA-N 1 3 343.515 2.616 10 0 EFAEHO CC[C@H](F)C[NH2+][C@H]1CCCCCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001417846745 1373329936 /nfs/dbraw/zinc/32/99/36/1373329936.db2.gz OQRADPYRBWSHHD-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO Cc1ccc(CN2CC[C@H](NC(=O)C3(C[NH+](C)C)CC3)[C@H]2C)c(C)c1 ZINC001417849253 1373334204 /nfs/dbraw/zinc/33/42/04/1373334204.db2.gz KYKUHIORXOQMGO-MJGOQNOKSA-N 1 3 343.515 2.724 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]2C)c(C)c1 ZINC001417852889 1373340236 /nfs/dbraw/zinc/34/02/36/1373340236.db2.gz XDZWWIYSIAXILZ-HOJAQTOUSA-N 1 3 345.531 2.969 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]2C)c(C)c1 ZINC001417852889 1373340240 /nfs/dbraw/zinc/34/02/40/1373340240.db2.gz XDZWWIYSIAXILZ-HOJAQTOUSA-N 1 3 345.531 2.969 10 0 EFAEHO Cc1ccncc1C[NH2+][C@@H](C)[C@@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001417892386 1373379814 /nfs/dbraw/zinc/37/98/14/1373379814.db2.gz PLAWFDPATDHPAO-HKUYNNGSSA-N 1 3 346.519 2.589 10 0 EFAEHO C[NH+](C)CCC(=O)NCC[C@@H]1CCN(Cc2ccc(Cl)cc2)C1 ZINC001437944769 1388260381 /nfs/dbraw/zinc/26/03/81/1388260381.db2.gz NRCCALZVYSPFMO-MRXNPFEDSA-N 1 3 337.895 2.620 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1ccc(C)cc1)C1CC1 ZINC001417991297 1373495763 /nfs/dbraw/zinc/49/57/63/1373495763.db2.gz OANFUVYDOHSLMH-VQTJNVASSA-N 1 3 343.515 2.854 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]([NH2+]CCc1cccs1)C1CC1)N1CCCC1 ZINC001417992941 1373496568 /nfs/dbraw/zinc/49/65/68/1373496568.db2.gz OPVOQUQAKXQIDS-QGZVFWFLSA-N 1 3 349.544 2.649 10 0 EFAEHO CC(C)(C(=O)NC[C@H]([NH2+]CCc1cccs1)C1CC1)N1CCCC1 ZINC001417992936 1373496851 /nfs/dbraw/zinc/49/68/51/1373496851.db2.gz OPVOQUQAKXQIDS-KRWDZBQOSA-N 1 3 349.544 2.649 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]([NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001417995424 1373500334 /nfs/dbraw/zinc/50/03/34/1373500334.db2.gz JKWSXOOWWLUBOS-QZTJIDSGSA-N 1 3 335.536 2.637 10 0 EFAEHO CC[C@H](F)CN(C)C[C@H]1CCCN(C(=O)CCC[NH+]2CCCC2)C1 ZINC001418018269 1373529223 /nfs/dbraw/zinc/52/92/23/1373529223.db2.gz CSYIJYHEAIHOTK-MSOLQXFVSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C12CC[NH+](CC1)C2 ZINC001418025734 1373540735 /nfs/dbraw/zinc/54/07/35/1373540735.db2.gz AXKGTYWJRLOOSG-CALCHBBNSA-N 1 3 333.520 2.584 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccc(Cl)cc32)C1)N(C)C ZINC001418063723 1373569134 /nfs/dbraw/zinc/56/91/34/1373569134.db2.gz KIOIRHTXRCTYME-JOCBIADPSA-N 1 3 349.906 2.904 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H]([NH2+]CC[C@@H]2CCCC2(F)F)C1)N(C)C ZINC001418075989 1373580314 /nfs/dbraw/zinc/58/03/14/1373580314.db2.gz RUPFRDZJFYOOHF-VGWMRTNUSA-N 1 3 345.478 2.635 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]21 ZINC001418082803 1373590439 /nfs/dbraw/zinc/59/04/39/1373590439.db2.gz PNCJTXVHAVVXBQ-UXHICEINSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]21 ZINC001418082803 1373590445 /nfs/dbraw/zinc/59/04/45/1373590445.db2.gz PNCJTXVHAVVXBQ-UXHICEINSA-N 1 3 343.515 2.841 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccccc2Cl)C1)C1CCC1 ZINC001418122067 1373632267 /nfs/dbraw/zinc/63/22/67/1373632267.db2.gz IHWXDXWCNGDNNY-GASCZTMLSA-N 1 3 335.879 2.561 10 0 EFAEHO Cc1cccc(C[N@H+]2CCC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001418126084 1373643291 /nfs/dbraw/zinc/64/32/91/1373643291.db2.gz BSXZETGQAOERFN-QUCCMNQESA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1cccc(C[N@@H+]2CCC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001418126084 1373643295 /nfs/dbraw/zinc/64/32/95/1373643295.db2.gz BSXZETGQAOERFN-QUCCMNQESA-N 1 3 343.515 2.665 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)s2)C1)C1CCC1 ZINC001418133261 1373657191 /nfs/dbraw/zinc/65/71/91/1373657191.db2.gz WAROLYQLXBBXSX-TXEJJXNPSA-N 1 3 341.908 2.623 10 0 EFAEHO Cc1ccc(CN2CCCC[C@H]2CNC(=O)CC[NH+](C)C)cc1C ZINC001418157522 1373698053 /nfs/dbraw/zinc/69/80/53/1373698053.db2.gz YLWUDXKNPRNZHD-IBGZPJMESA-N 1 3 331.504 2.726 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001437962313 1388277360 /nfs/dbraw/zinc/27/73/60/1388277360.db2.gz VLTXPHANUFKTOX-PMACEKPBSA-N 1 3 343.515 2.889 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001437962313 1388277361 /nfs/dbraw/zinc/27/73/61/1388277361.db2.gz VLTXPHANUFKTOX-PMACEKPBSA-N 1 3 343.515 2.889 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC1CCC([NH2+]CCC(F)(F)F)CC1 ZINC001418186398 1373750959 /nfs/dbraw/zinc/75/09/59/1373750959.db2.gz FTEHLUFNOOFYKS-YMAMQOFZSA-N 1 3 349.441 2.830 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]Cc2csc(C)c2)CC1)N(C)C ZINC001418188653 1373752588 /nfs/dbraw/zinc/75/25/88/1373752588.db2.gz YOIIHDXXVJXLQI-OFLPRAFFSA-N 1 3 337.533 2.914 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001418228941 1373785294 /nfs/dbraw/zinc/78/52/94/1373785294.db2.gz IPCVWJXDVAZZSD-FUHWJXTLSA-N 1 3 335.536 2.926 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H](C)[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001418301354 1373878739 /nfs/dbraw/zinc/87/87/39/1373878739.db2.gz WCVIKXSHFYPADD-GUYCJALGSA-N 1 3 337.895 2.763 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCC[C@@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001418357155 1373929563 /nfs/dbraw/zinc/92/95/63/1373929563.db2.gz KINMICCUPSMKES-RBUKOAKNSA-N 1 3 331.504 2.852 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001418373743 1373950685 /nfs/dbraw/zinc/95/06/85/1373950685.db2.gz IDQVZYLAFJSBPH-HZPDHXFCSA-N 1 3 345.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001418373743 1373950687 /nfs/dbraw/zinc/95/06/87/1373950687.db2.gz IDQVZYLAFJSBPH-HZPDHXFCSA-N 1 3 345.478 2.685 10 0 EFAEHO CC[C@H](C)C[N@H+](C)[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001418381094 1373962837 /nfs/dbraw/zinc/96/28/37/1373962837.db2.gz VGEVUQGBVMAWFW-DLBZAZTESA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001418381094 1373962839 /nfs/dbraw/zinc/96/28/39/1373962839.db2.gz VGEVUQGBVMAWFW-DLBZAZTESA-N 1 3 325.541 2.933 10 0 EFAEHO C[C@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001418401981 1373982932 /nfs/dbraw/zinc/98/29/32/1373982932.db2.gz KZYJNXAFIHNMDA-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]Cc1cccc(F)c1 ZINC001418440537 1374029914 /nfs/dbraw/zinc/02/99/14/1374029914.db2.gz HGAABOYBSCVAEG-MAUKXSAKSA-N 1 3 335.467 2.685 10 0 EFAEHO C[N@H+](CCNC(=O)C(C)(C)N1CCCCC1)CC1CC2(CCC2)C1 ZINC001418458893 1374046820 /nfs/dbraw/zinc/04/68/20/1374046820.db2.gz DOSIFZWKGIYFRU-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO C[N@@H+](CCNC(=O)C(C)(C)N1CCCCC1)CC1CC2(CCC2)C1 ZINC001418458893 1374046829 /nfs/dbraw/zinc/04/68/29/1374046829.db2.gz DOSIFZWKGIYFRU-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)cc1 ZINC001418476620 1374069546 /nfs/dbraw/zinc/06/95/46/1374069546.db2.gz QCTWESNLDXXMFO-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)cc1 ZINC001418476620 1374069553 /nfs/dbraw/zinc/06/95/53/1374069553.db2.gz QCTWESNLDXXMFO-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)c(C)c1 ZINC001418476975 1374071432 /nfs/dbraw/zinc/07/14/32/1374071432.db2.gz RQOCGDSGLIRUAB-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)c(C)c1 ZINC001418476975 1374071435 /nfs/dbraw/zinc/07/14/35/1374071435.db2.gz RQOCGDSGLIRUAB-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO CN(CCNC(=O)C(C)(C)[NH+]1CCCC1)[C@@H]1CCc2ccc(F)cc21 ZINC001418490606 1374085095 /nfs/dbraw/zinc/08/50/95/1374085095.db2.gz XGXTUBPCBQHTIW-GOSISDBHSA-N 1 3 347.478 2.735 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCCN(C)[C@@H]1CCc2ccc(Cl)cc21 ZINC001418508809 1374109964 /nfs/dbraw/zinc/10/99/64/1374109964.db2.gz AFHCDEACVPKSSY-QGZVFWFLSA-N 1 3 337.895 2.717 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCCN(C)[C@@H]1CCc2ccc(Cl)cc21 ZINC001418508809 1374109968 /nfs/dbraw/zinc/10/99/68/1374109968.db2.gz AFHCDEACVPKSSY-QGZVFWFLSA-N 1 3 337.895 2.717 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C(C)C)[C@H]1CCc2ccc(F)cc21 ZINC001418588147 1374232422 /nfs/dbraw/zinc/23/24/22/1374232422.db2.gz OMJFYXTVTYSFBC-SFHVURJKSA-N 1 3 335.467 2.591 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C(C)C)[C@H]1CCc2ccc(F)cc21 ZINC001418588147 1374232428 /nfs/dbraw/zinc/23/24/28/1374232428.db2.gz OMJFYXTVTYSFBC-SFHVURJKSA-N 1 3 335.467 2.591 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@@H]1CN(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001418598133 1374249284 /nfs/dbraw/zinc/24/92/84/1374249284.db2.gz VSGDGWAFQVOTHD-RTBURBONSA-N 1 3 343.515 2.678 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@@H]1CN(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001418598133 1374249289 /nfs/dbraw/zinc/24/92/89/1374249289.db2.gz VSGDGWAFQVOTHD-RTBURBONSA-N 1 3 343.515 2.678 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001437994821 1388309345 /nfs/dbraw/zinc/30/93/45/1388309345.db2.gz WZRNHYWSSRNYRI-LJQANCHMSA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1ccc(C)c(C[N@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001437994821 1388309352 /nfs/dbraw/zinc/30/93/52/1388309352.db2.gz WZRNHYWSSRNYRI-LJQANCHMSA-N 1 3 345.531 2.924 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@@H+]([C@H]2CCc3ccccc32)C1)C1CCC1 ZINC001418656214 1374329312 /nfs/dbraw/zinc/32/93/12/1374329312.db2.gz GTJQFQZOWRHCID-JXFKEZNVSA-N 1 3 341.499 2.596 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@H+]([C@H]2CCc3ccccc32)C1)C1CCC1 ZINC001418656214 1374329317 /nfs/dbraw/zinc/32/93/17/1374329317.db2.gz GTJQFQZOWRHCID-JXFKEZNVSA-N 1 3 341.499 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2F)C1 ZINC001418663334 1374339673 /nfs/dbraw/zinc/33/96/73/1374339673.db2.gz CKLOXJAOSXYYKE-HRCADAONSA-N 1 3 335.467 2.711 10 0 EFAEHO Cc1ccc(C)c(C[N@H+]2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001418674988 1374352985 /nfs/dbraw/zinc/35/29/85/1374352985.db2.gz RNNXSCYYJPNXHX-IEBWSBKVSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+]2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001418674988 1374352992 /nfs/dbraw/zinc/35/29/92/1374352992.db2.gz RNNXSCYYJPNXHX-IEBWSBKVSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001418701163 1374386617 /nfs/dbraw/zinc/38/66/17/1374386617.db2.gz VKEAUUNQPCFNQO-GOSISDBHSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001418701163 1374386623 /nfs/dbraw/zinc/38/66/23/1374386623.db2.gz VKEAUUNQPCFNQO-GOSISDBHSA-N 1 3 331.504 2.582 10 0 EFAEHO CCC[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CCC1CC1 ZINC001418726495 1374422436 /nfs/dbraw/zinc/42/24/36/1374422436.db2.gz DUNPCKGNISJTFD-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO CCC[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CCC1CC1 ZINC001418726495 1374422439 /nfs/dbraw/zinc/42/24/39/1374422439.db2.gz DUNPCKGNISJTFD-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccsc2)C1)N(C)C ZINC001418734981 1374436760 /nfs/dbraw/zinc/43/67/60/1374436760.db2.gz XLXXPEWHOKDOFI-USXIJHARSA-N 1 3 337.533 2.709 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[N@H+](C)CC)CCN1Cc1ccc(C)nc1C ZINC001418746757 1374451546 /nfs/dbraw/zinc/45/15/46/1374451546.db2.gz OFHSXFQPWPQWQW-RBUKOAKNSA-N 1 3 346.519 2.509 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[N@@H+](C)CC)CCN1Cc1ccc(C)nc1C ZINC001418746757 1374451548 /nfs/dbraw/zinc/45/15/48/1374451548.db2.gz OFHSXFQPWPQWQW-RBUKOAKNSA-N 1 3 346.519 2.509 10 0 EFAEHO CN(CC(=O)NCC[N@H+](C[C@@H]1CC[C@H]2C[C@H]2C1)C1CC1)CC(C)(C)C ZINC001418786257 1374499955 /nfs/dbraw/zinc/49/99/55/1374499955.db2.gz JNDQZKVEUVEPMX-FGTMMUONSA-N 1 3 349.563 2.981 10 0 EFAEHO CN(CC(=O)NCC[N@@H+](C[C@@H]1CC[C@H]2C[C@H]2C1)C1CC1)CC(C)(C)C ZINC001418786257 1374499957 /nfs/dbraw/zinc/49/99/57/1374499957.db2.gz JNDQZKVEUVEPMX-FGTMMUONSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CC2CCCC2)[C@@H]1C)N1CCCC1 ZINC001418811004 1374530996 /nfs/dbraw/zinc/53/09/96/1374530996.db2.gz XYVFZSRLSCFOHQ-NZSAHSFTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CC2CCCC2)[C@@H]1C)N1CCCC1 ZINC001418811004 1374531003 /nfs/dbraw/zinc/53/10/03/1374531003.db2.gz XYVFZSRLSCFOHQ-NZSAHSFTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CC2CCCC2)[C@@H]1C)N1CCCC1 ZINC001418810997 1374531261 /nfs/dbraw/zinc/53/12/61/1374531261.db2.gz XYVFZSRLSCFOHQ-NEWSRXKRSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CC2CCCC2)[C@@H]1C)N1CCCC1 ZINC001418810997 1374531264 /nfs/dbraw/zinc/53/12/64/1374531264.db2.gz XYVFZSRLSCFOHQ-NEWSRXKRSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H](C)[NH2+]Cc2ccccc2)CC1 ZINC001418841035 1374563790 /nfs/dbraw/zinc/56/37/90/1374563790.db2.gz DFTQNBJQEXSMFA-KRWDZBQOSA-N 1 3 331.504 2.744 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@H]2CC[C@@H](C1)N2CC/C=C/c1ccccc1 ZINC001418863477 1374589278 /nfs/dbraw/zinc/58/92/78/1374589278.db2.gz CJKWLBUZDAIUJQ-CSIIFKFVSA-N 1 3 341.499 2.717 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](C[N@H+](C)CCCC3CCC3)C2)C1 ZINC001418935689 1374703607 /nfs/dbraw/zinc/70/36/07/1374703607.db2.gz FSMSBFYMUQBCIY-MJGOQNOKSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](C[N@@H+](C)CCCC3CCC3)C2)C1 ZINC001418935689 1374703612 /nfs/dbraw/zinc/70/36/12/1374703612.db2.gz FSMSBFYMUQBCIY-MJGOQNOKSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)C[N@H+](C)C[C@@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001418942747 1374714574 /nfs/dbraw/zinc/71/45/74/1374714574.db2.gz WKTPACFWOKAKRI-QFBILLFUSA-N 1 3 341.515 2.635 10 0 EFAEHO CC(C)C[N@@H+](C)C[C@@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001418942747 1374714579 /nfs/dbraw/zinc/71/45/79/1374714579.db2.gz WKTPACFWOKAKRI-QFBILLFUSA-N 1 3 341.515 2.635 10 0 EFAEHO CC[C@H](C(=O)N1C[C@@H]2C[C@H]1CN2CC1CC(C)(C)C1)[NH+](CC)CC ZINC001419051410 1374792931 /nfs/dbraw/zinc/79/29/31/1374792931.db2.gz IONLLCWRVTXQBD-OKZBNKHCSA-N 1 3 335.536 2.828 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)C1CCN(Cc2ccc(CF)cc2)CC1 ZINC001419086784 1374827548 /nfs/dbraw/zinc/82/75/48/1374827548.db2.gz WXOVNOKPHLARDK-UHFFFAOYSA-N 1 3 335.467 2.531 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001419090572 1374832635 /nfs/dbraw/zinc/83/26/35/1374832635.db2.gz QSJBIXBJAUESSJ-FGTMMUONSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001419090573 1374832766 /nfs/dbraw/zinc/83/27/66/1374832766.db2.gz QSJBIXBJAUESSJ-KURKYZTESA-N 1 3 335.536 2.686 10 0 EFAEHO COc1cccc([C@@H](C)N2CC[C@H](N(C)C(=O)CCC[NH+](C)C)C2)c1 ZINC001419111955 1374855336 /nfs/dbraw/zinc/85/53/36/1374855336.db2.gz ABWNBFDZXJQXJV-AEFFLSMTSA-N 1 3 347.503 2.631 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H]1CC[N@H+](CCC2CC2)C1)N1CCCCC1 ZINC001419123340 1374869293 /nfs/dbraw/zinc/86/92/93/1374869293.db2.gz IFRJEAIHGUFOGF-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H]1CC[N@@H+](CCC2CC2)C1)N1CCCCC1 ZINC001419123340 1374869298 /nfs/dbraw/zinc/86/92/98/1374869298.db2.gz IFRJEAIHGUFOGF-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CCN(CCc2ccc(C)cc2)C1)[NH+](CC)CC ZINC001419175887 1374924436 /nfs/dbraw/zinc/92/44/36/1374924436.db2.gz ZFBZISVOCSTZKE-PMACEKPBSA-N 1 3 345.531 2.848 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1cccc(F)c1 ZINC001419187180 1374933326 /nfs/dbraw/zinc/93/33/26/1374933326.db2.gz WNJQVWCVOOUIBX-ZWKOTPCHSA-N 1 3 335.467 2.683 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)NCc1sccc1Cl ZINC001419197810 1374943497 /nfs/dbraw/zinc/94/34/97/1374943497.db2.gz LPTCFSFTCOPOGX-JHJVBQTASA-N 1 3 343.924 2.726 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)NCc1sccc1Cl ZINC001419197810 1374943499 /nfs/dbraw/zinc/94/34/99/1374943499.db2.gz LPTCFSFTCOPOGX-JHJVBQTASA-N 1 3 343.924 2.726 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)NCc1sccc1Cl ZINC001419197806 1374943572 /nfs/dbraw/zinc/94/35/72/1374943572.db2.gz LPTCFSFTCOPOGX-FRRDWIJNSA-N 1 3 343.924 2.726 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)NCc1sccc1Cl ZINC001419197806 1374943575 /nfs/dbraw/zinc/94/35/75/1374943575.db2.gz LPTCFSFTCOPOGX-FRRDWIJNSA-N 1 3 343.924 2.726 10 0 EFAEHO CC[C@H](CNC(=O)CC[NH+](C)C)NCc1ccc(C)cc1Cl ZINC001419227357 1374974399 /nfs/dbraw/zinc/97/43/99/1374974399.db2.gz XKGQORGZMGVFID-OAHLLOKOSA-N 1 3 325.884 2.585 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cc(C)sc1C ZINC001419238365 1374983923 /nfs/dbraw/zinc/98/39/23/1374983923.db2.gz FDLVBPJBFSXQMX-DYVFJYSZSA-N 1 3 337.533 2.691 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1c(C)cc(C)cc1C ZINC001419246054 1374993213 /nfs/dbraw/zinc/99/32/13/1374993213.db2.gz PNHZKBBSOSOLOL-KXBFYZLASA-N 1 3 345.531 2.938 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001419256305 1375002937 /nfs/dbraw/zinc/00/29/37/1375002937.db2.gz YXTJTGRIWVUCNX-JXFKEZNVSA-N 1 3 343.515 2.890 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1ccccc1)C1CC1 ZINC001419260027 1375007081 /nfs/dbraw/zinc/00/70/81/1375007081.db2.gz JBDUIEGIOYAJBX-OALUTQOASA-N 1 3 329.488 2.545 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]([NH2+]Cc2ccc(Cl)cc2)C2CC2)C1 ZINC001419297879 1375056970 /nfs/dbraw/zinc/05/69/70/1375056970.db2.gz NPQYZCZSJVZTRU-KSSFIOAISA-N 1 3 349.906 2.666 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1ccccc1)C1CC1 ZINC001419302209 1375064261 /nfs/dbraw/zinc/06/42/61/1375064261.db2.gz YIAGWRVVUNLRJC-VQTJNVASSA-N 1 3 343.515 2.934 10 0 EFAEHO CC(C)c1cccc(CNCC2(NC(=O)CC[NH+](C)C)CCCC2)n1 ZINC001419311163 1375079287 /nfs/dbraw/zinc/07/92/87/1375079287.db2.gz AECSMIDFXGPQIR-UHFFFAOYSA-N 1 3 346.519 2.675 10 0 EFAEHO CC[C@H](c1ccccc1)N1C[C@H]2CC[C@@H](C1)N2C(=O)CC[NH+](C)C ZINC001419340462 1375129389 /nfs/dbraw/zinc/12/93/89/1375129389.db2.gz SVAUWQOPLTZGOQ-CEXWTWQISA-N 1 3 329.488 2.765 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)N[C@](C)(CNCc2ccccc2Cl)C2CC2)C1 ZINC001419362026 1375167203 /nfs/dbraw/zinc/16/72/03/1375167203.db2.gz VWOBLDJQUOUWDW-DNVCBOLYSA-N 1 3 349.906 2.666 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)N[C@](C)(CNCc2ccccc2Cl)C2CC2)C1 ZINC001419362026 1375167216 /nfs/dbraw/zinc/16/72/16/1375167216.db2.gz VWOBLDJQUOUWDW-DNVCBOLYSA-N 1 3 349.906 2.666 10 0 EFAEHO CC(C)[NH2+]CC[C@H]1CCCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001419374040 1375186214 /nfs/dbraw/zinc/18/62/14/1375186214.db2.gz MCLMISYLFPRVTA-VQIMIIECSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H]([NH2+]C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001419405276 1375231228 /nfs/dbraw/zinc/23/12/28/1375231228.db2.gz HGNQYGDOPGELQK-VGWMRTNUSA-N 1 3 345.478 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]C/C=C/c2ccc(Cl)cc2)C1 ZINC001419428147 1375259111 /nfs/dbraw/zinc/25/91/11/1375259111.db2.gz CPWHBCYXZZWYQM-IXFYRXCXSA-N 1 3 349.906 2.930 10 0 EFAEHO CC[C@@H]([NH2+][C@H]1C[C@H](NC(=O)CN(C)C(C)C)C1)c1ccc(F)cc1 ZINC001419435464 1375268065 /nfs/dbraw/zinc/26/80/65/1375268065.db2.gz ZWSAEOCAVGCBML-KZNAEPCWSA-N 1 3 335.467 2.854 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@H+](Cc3ccsc3)CC[C@H]21 ZINC001419453893 1375295228 /nfs/dbraw/zinc/29/52/28/1375295228.db2.gz YLWVLERRZHFYIK-ZWKOTPCHSA-N 1 3 349.544 2.903 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@@H+](Cc3ccsc3)CC[C@H]21 ZINC001419453893 1375295238 /nfs/dbraw/zinc/29/52/38/1375295238.db2.gz YLWVLERRZHFYIK-ZWKOTPCHSA-N 1 3 349.544 2.903 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]CCc2cccs2)C1)CC(C)(C)C ZINC001419492864 1375341592 /nfs/dbraw/zinc/34/15/92/1375341592.db2.gz PQKHFRUADWRMLZ-GASCZTMLSA-N 1 3 337.533 2.505 10 0 EFAEHO CC(C)Oc1cccc(C[NH2+]C[C@@H](C)N(C)C(=O)[C@@H]2CCCN2C)c1 ZINC001419652164 1375639514 /nfs/dbraw/zinc/63/95/14/1375639514.db2.gz PLCXZZVPHXDROV-APWZRJJASA-N 1 3 347.503 2.505 10 0 EFAEHO CC[C@@H](C(=O)NC1CCC([NH2+]CC2CC3(CCC3)C2)CC1)N(C)C ZINC001419683606 1375707513 /nfs/dbraw/zinc/70/75/13/1375707513.db2.gz OLRUGJRSUMODEL-ABHNRTSZSA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)[C@H]2CCC[N@H+]2CC(C)C)c1 ZINC001419793384 1375888569 /nfs/dbraw/zinc/88/85/69/1375888569.db2.gz UZVYSYDYTHEHAE-QFBILLFUSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)[C@H]2CCC[N@@H+]2CC(C)C)c1 ZINC001419793384 1375888582 /nfs/dbraw/zinc/88/85/82/1375888582.db2.gz UZVYSYDYTHEHAE-QFBILLFUSA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCc1ccccc1 ZINC001419848829 1375996328 /nfs/dbraw/zinc/99/63/28/1375996328.db2.gz LDBVGQGKEGJTPT-OXJNMPFZSA-N 1 3 349.494 2.536 10 0 EFAEHO COc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@@H](C)N2CCCCCC2)cc1 ZINC001419876958 1376049010 /nfs/dbraw/zinc/04/90/10/1376049010.db2.gz YZUGGSUZMUATTG-DLBZAZTESA-N 1 3 347.503 2.554 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]Cc1cccnc1 ZINC001419899394 1376096648 /nfs/dbraw/zinc/09/66/48/1376096648.db2.gz FIXRAYHIGPZWDK-HKUYNNGSSA-N 1 3 346.519 2.577 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](CNC(=O)CC[NH+](C)C)C(C)C ZINC001419900081 1376096834 /nfs/dbraw/zinc/09/68/34/1376096834.db2.gz IWUWPADJTAHRKO-KRWDZBQOSA-N 1 3 339.911 2.831 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NCc1ccc(Cl)c(Cl)c1 ZINC001419915565 1376121148 /nfs/dbraw/zinc/12/11/48/1376121148.db2.gz ALQMQPHQZDXZRE-DGCLKSJQSA-N 1 3 344.286 2.539 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NCc1ccc(Cl)c(Cl)c1 ZINC001419915565 1376121152 /nfs/dbraw/zinc/12/11/52/1376121152.db2.gz ALQMQPHQZDXZRE-DGCLKSJQSA-N 1 3 344.286 2.539 10 0 EFAEHO CN(CC(=O)N(C)CC[N@H+](C)CC1CC2(CCC2)C1)CC(C)(C)C ZINC001420002114 1376262744 /nfs/dbraw/zinc/26/27/44/1376262744.db2.gz DTUFEVWDJYXMTF-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO CN(CC(=O)N(C)CC[N@@H+](C)CC1CC2(CCC2)C1)CC(C)(C)C ZINC001420002114 1376262748 /nfs/dbraw/zinc/26/27/48/1376262748.db2.gz DTUFEVWDJYXMTF-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001420012477 1376280911 /nfs/dbraw/zinc/28/09/11/1376280911.db2.gz KDUFGQPHDURJBK-IBGZPJMESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001420012483 1376282259 /nfs/dbraw/zinc/28/22/59/1376282259.db2.gz KDUFGQPHDURJBK-LJQANCHMSA-N 1 3 331.504 2.527 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)c1 ZINC001420062793 1376405272 /nfs/dbraw/zinc/40/52/72/1376405272.db2.gz NUUABJRUZHKJDN-HDICACEKSA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)c1 ZINC001420062793 1376405282 /nfs/dbraw/zinc/40/52/82/1376405282.db2.gz NUUABJRUZHKJDN-HDICACEKSA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+][C@@H](C)CCNC(=O)[C@@H]1CCCN1C ZINC001420068692 1376413878 /nfs/dbraw/zinc/41/38/78/1376413878.db2.gz POOMQXSYTRVKQK-YOEHRIQHSA-N 1 3 337.895 2.727 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]Cc1ccsc1)C1CCC1 ZINC001420108923 1376466561 /nfs/dbraw/zinc/46/65/61/1376466561.db2.gz YHWDMMFOSJLQSY-NVXWUHKLSA-N 1 3 335.517 2.607 10 0 EFAEHO CN(CC(=O)N[C@H]1CCC[C@@H]1C[NH2+]Cc1ccsc1)C1CCC1 ZINC001420109005 1376466591 /nfs/dbraw/zinc/46/65/91/1376466591.db2.gz YHWDMMFOSJLQSY-WBVHZDCISA-N 1 3 335.517 2.607 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001420165876 1376524605 /nfs/dbraw/zinc/52/46/05/1376524605.db2.gz OUAFYZNAXLXBJF-CQSZACIVSA-N 1 3 333.467 2.637 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCc2ccccc21)C(=O)C1(N(C)C)CCC1 ZINC001420232297 1376587745 /nfs/dbraw/zinc/58/77/45/1376587745.db2.gz GXZYPCDYMYXCHX-SFHVURJKSA-N 1 3 329.488 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC001420235706 1376593051 /nfs/dbraw/zinc/59/30/51/1376593051.db2.gz CLODSQIJEMIRCQ-ZIAGYGMSSA-N 1 3 341.446 2.850 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001420308791 1376708110 /nfs/dbraw/zinc/70/81/10/1376708110.db2.gz DWZQGSRLYNRLSK-OALUTQOASA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001420308791 1376708121 /nfs/dbraw/zinc/70/81/21/1376708121.db2.gz DWZQGSRLYNRLSK-OALUTQOASA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1cc(C)c(CN(C)CCNC(=O)C[C@@H]2CC[N@H+](C)C2)c(C)c1 ZINC001420334962 1376752790 /nfs/dbraw/zinc/75/27/90/1376752790.db2.gz SJBCZMVJBMDVKC-SFHVURJKSA-N 1 3 331.504 2.502 10 0 EFAEHO Cc1cc(C)c(CN(C)CCNC(=O)C[C@@H]2CC[N@@H+](C)C2)c(C)c1 ZINC001420334962 1376752793 /nfs/dbraw/zinc/75/27/93/1376752793.db2.gz SJBCZMVJBMDVKC-SFHVURJKSA-N 1 3 331.504 2.502 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NCCN(C)Cc1ccc(C2CC2)cc1 ZINC001420347973 1376779670 /nfs/dbraw/zinc/77/96/70/1376779670.db2.gz BNRPUZBQRPHMJJ-CALCHBBNSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCCN(C)Cc1ccc(C2CC2)cc1 ZINC001420347973 1376779676 /nfs/dbraw/zinc/77/96/76/1376779676.db2.gz BNRPUZBQRPHMJJ-CALCHBBNSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)NCCN(C)Cc1ccc(C2CC2)cc1 ZINC001420347979 1376779781 /nfs/dbraw/zinc/77/97/81/1376779781.db2.gz BNRPUZBQRPHMJJ-IRXDYDNUSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(F)cc1 ZINC001420351105 1376784684 /nfs/dbraw/zinc/78/46/84/1376784684.db2.gz DINFGHDYUPKMQS-CRAIPNDOSA-N 1 3 335.467 2.683 10 0 EFAEHO CCN(C(=O)[C@@H](C)[NH+]1CCCCCC1)[C@H]1CCN(CCCF)C1 ZINC001438265066 1388462764 /nfs/dbraw/zinc/46/27/64/1388462764.db2.gz GIBXYSBDNQYBIL-SJORKVTESA-N 1 3 327.488 2.533 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCN(C)CCc1ccccc1F)[NH+]1CCCC1 ZINC001420358216 1376798550 /nfs/dbraw/zinc/79/85/50/1376798550.db2.gz MMDNKBQPBCFCFJ-IBGZPJMESA-N 1 3 349.494 2.537 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@H+](CCc2cccs2)C1 ZINC001438268883 1388467698 /nfs/dbraw/zinc/46/76/98/1388467698.db2.gz RXIPRWBOXFINLU-IRXDYDNUSA-N 1 3 349.544 2.555 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@@H+](CCc2cccs2)C1 ZINC001438268883 1388467703 /nfs/dbraw/zinc/46/77/03/1388467703.db2.gz RXIPRWBOXFINLU-IRXDYDNUSA-N 1 3 349.544 2.555 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+][C@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001420434133 1376963226 /nfs/dbraw/zinc/96/32/26/1376963226.db2.gz QPNNJRMGDSNQND-AFAVFJNCSA-N 1 3 337.895 2.762 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)Cc1cc2ccccc2o1 ZINC001420438115 1376972412 /nfs/dbraw/zinc/97/24/12/1376972412.db2.gz OJZBVLKVBJVOBL-MRXNPFEDSA-N 1 3 343.471 2.713 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)Cc1cc2ccccc2o1 ZINC001420438115 1376972420 /nfs/dbraw/zinc/97/24/20/1376972420.db2.gz OJZBVLKVBJVOBL-MRXNPFEDSA-N 1 3 343.471 2.713 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001420461091 1377016381 /nfs/dbraw/zinc/01/63/81/1377016381.db2.gz XFKWFBNAEJWZJZ-HNNXBMFYSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1ccc(CN2CCC[C@@H]2CNC(=O)CC[C@@H]2CCC[N@H+]2C)cc1 ZINC001420466640 1377027494 /nfs/dbraw/zinc/02/74/94/1377027494.db2.gz DUSAKSQKARIQMT-VQTJNVASSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(CN2CCC[C@@H]2CNC(=O)CC[C@@H]2CCC[N@@H+]2C)cc1 ZINC001420466640 1377027497 /nfs/dbraw/zinc/02/74/97/1377027497.db2.gz DUSAKSQKARIQMT-VQTJNVASSA-N 1 3 343.515 2.950 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1c(C)cccc1C ZINC001420515256 1377114679 /nfs/dbraw/zinc/11/46/79/1377114679.db2.gz GCQAGHHSDQOAGQ-PKOBYXMFSA-N 1 3 331.504 2.772 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN(C)C1CCC1)[C@H]1CCc2ccccc21 ZINC001420593799 1377273462 /nfs/dbraw/zinc/27/34/62/1377273462.db2.gz UKSJKOYIVHMUCB-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN(C)C1CCC1)[C@H]1CCc2ccccc21 ZINC001420593799 1377273465 /nfs/dbraw/zinc/27/34/65/1377273465.db2.gz UKSJKOYIVHMUCB-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO C[C@@H](CN(C)CCc1ccccc1F)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001420596359 1377281393 /nfs/dbraw/zinc/28/13/93/1377281393.db2.gz HUDGXPFIWABABL-FUHWJXTLSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@@H](CN(C)CCc1ccccc1F)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001420596359 1377281394 /nfs/dbraw/zinc/28/13/94/1377281394.db2.gz HUDGXPFIWABABL-FUHWJXTLSA-N 1 3 349.494 2.679 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccc(F)cc1 ZINC001438307440 1388497659 /nfs/dbraw/zinc/49/76/59/1388497659.db2.gz UALYQOMRPQHGOZ-ZWKOTPCHSA-N 1 3 335.467 2.683 10 0 EFAEHO CC[NH+](CC)CC[C@H](NC(=O)CN1CC[C@@H](C)C1)c1ccccc1 ZINC001420662368 1377447681 /nfs/dbraw/zinc/44/76/81/1377447681.db2.gz MWHIFLJMYYOOSP-MJGOQNOKSA-N 1 3 331.504 2.918 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(Cc2ccc(C)cc2)C2CC2)CC[N@@H+]1C ZINC001420667673 1377463380 /nfs/dbraw/zinc/46/33/80/1377463380.db2.gz XOLCFSHPXGLJSF-VQTJNVASSA-N 1 3 343.515 2.806 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(Cc2ccc(C)cc2)C2CC2)CC[N@H+]1C ZINC001420667673 1377463386 /nfs/dbraw/zinc/46/33/86/1377463386.db2.gz XOLCFSHPXGLJSF-VQTJNVASSA-N 1 3 343.515 2.806 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@H+](Cc2ccsc2)C1)N1CCCCC1 ZINC001420676214 1377484393 /nfs/dbraw/zinc/48/43/93/1377484393.db2.gz TZJGBIPJWUGCLR-MRXNPFEDSA-N 1 3 349.544 2.951 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@@H+](Cc2ccsc2)C1)N1CCCCC1 ZINC001420676214 1377484395 /nfs/dbraw/zinc/48/43/95/1377484395.db2.gz TZJGBIPJWUGCLR-MRXNPFEDSA-N 1 3 349.544 2.951 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H](C)[NH2+]Cc2cccc(F)c2)CC1 ZINC001420768042 1377628505 /nfs/dbraw/zinc/62/85/05/1377628505.db2.gz NFHIOGZXGAQELO-MRXNPFEDSA-N 1 3 349.494 2.883 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CC1CC1)c1ccccc1 ZINC001420779649 1377654519 /nfs/dbraw/zinc/65/45/19/1377654519.db2.gz WYHNJYSDANAXCK-MOPGFXCFSA-N 1 3 329.488 2.718 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]Cc1sccc1Cl)C1CC1 ZINC001420794434 1377678340 /nfs/dbraw/zinc/67/83/40/1377678340.db2.gz FHIJFJXLTSYCGD-CQSZACIVSA-N 1 3 343.924 2.726 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H](NC(=O)CN(C)C(C)C)C2CC2)c(C)s1 ZINC001420800419 1377687151 /nfs/dbraw/zinc/68/71/51/1377687151.db2.gz SCWKZGXMFXSFIV-KRWDZBQOSA-N 1 3 337.533 2.690 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]CC1CCC2(CC2)CC1 ZINC001438334956 1388514483 /nfs/dbraw/zinc/51/44/83/1388514483.db2.gz OQFYEAQHGJZBPE-FUHWJXTLSA-N 1 3 335.536 2.783 10 0 EFAEHO CC[C@H](F)C[N@@H+]1CC[C@H](CCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001420882363 1377828810 /nfs/dbraw/zinc/82/88/10/1377828810.db2.gz ZGFBIQFPJHGGJQ-HOTGVXAUSA-N 1 3 329.504 2.541 10 0 EFAEHO CC[C@H](F)C[N@H+]1CC[C@H](CCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001420882363 1377828812 /nfs/dbraw/zinc/82/88/12/1377828812.db2.gz ZGFBIQFPJHGGJQ-HOTGVXAUSA-N 1 3 329.504 2.541 10 0 EFAEHO CC(C)CCC[N@H+](C)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001420950437 1377928823 /nfs/dbraw/zinc/92/88/23/1377928823.db2.gz DNIDIWFTSSVANB-GOSISDBHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CCC[N@@H+](C)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001420950437 1377928827 /nfs/dbraw/zinc/92/88/27/1377928827.db2.gz DNIDIWFTSSVANB-GOSISDBHSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@@H](NC1(CNC(=O)C23CCC[NH+]2CCC3)CC1)c1ccc(F)cc1 ZINC001420958261 1377940001 /nfs/dbraw/zinc/94/00/01/1377940001.db2.gz BAHJMHAEQCXPDB-OAHLLOKOSA-N 1 3 345.462 2.754 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)C(C)(C)[NH+]3CCCC3)CC2)cs1 ZINC001420969942 1377955871 /nfs/dbraw/zinc/95/58/71/1377955871.db2.gz NUQJYKKWCBJKOV-UHFFFAOYSA-N 1 3 335.517 2.669 10 0 EFAEHO CC[C@@H](F)C[N@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001421020489 1378032004 /nfs/dbraw/zinc/03/20/04/1378032004.db2.gz SBMHLKDBISUORC-AEFFLSMTSA-N 1 3 339.499 2.532 10 0 EFAEHO CC[C@@H](F)C[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001421020489 1378032007 /nfs/dbraw/zinc/03/20/07/1378032007.db2.gz SBMHLKDBISUORC-AEFFLSMTSA-N 1 3 339.499 2.532 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]1CNCc1ccc(F)cc1Cl ZINC001421128849 1378159308 /nfs/dbraw/zinc/15/93/08/1378159308.db2.gz LGKXWOFMFRDMKA-HNNXBMFYSA-N 1 3 341.858 2.511 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+]Cc2ccsc2)C2CCCC2)CCC1 ZINC001421177208 1378233153 /nfs/dbraw/zinc/23/31/53/1378233153.db2.gz VYTRCROKINWVAR-KRWDZBQOSA-N 1 3 349.544 2.997 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@]1(C)CCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001421236912 1378325823 /nfs/dbraw/zinc/32/58/23/1378325823.db2.gz JELYFTJHBITTIZ-APWZRJJASA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@@]1(C)CCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001421236919 1378326192 /nfs/dbraw/zinc/32/61/92/1378326192.db2.gz JELYFTJHBITTIZ-QFBILLFUSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](CNC(=O)C12CC[NH+](CC1)C2)N[C@@H](C)c1ccccc1Cl ZINC001438373982 1388544320 /nfs/dbraw/zinc/54/43/20/1388544320.db2.gz IJQBABZXIRSZQV-LSDHHAIUSA-N 1 3 349.906 2.981 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2ccc(F)cc2C)C1)N(C)C ZINC001421253212 1378353757 /nfs/dbraw/zinc/35/37/57/1378353757.db2.gz JVOPDCKZPIFHHJ-QUCCMNQESA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]CC3CCCCC3)C2)C1 ZINC001421254016 1378354660 /nfs/dbraw/zinc/35/46/60/1378354660.db2.gz KCLICCXUQNOQES-XLIONFOSSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H](F)CC[NH+]1CCC(C)(CNC(=O)CN(C)CC(C)(C)C)CC1 ZINC001421272017 1378388467 /nfs/dbraw/zinc/38/84/67/1378388467.db2.gz KCNTZORLVDVPSL-INIZCTEOSA-N 1 3 343.531 2.931 10 0 EFAEHO CN(C(=O)CC[C@H]1CCC[N@@H+]1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001421302683 1378464855 /nfs/dbraw/zinc/46/48/55/1378464855.db2.gz OFAMSTGPYFIENJ-RTBURBONSA-N 1 3 329.488 2.594 10 0 EFAEHO CN(C(=O)CC[C@H]1CCC[N@H+]1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001421302683 1378464862 /nfs/dbraw/zinc/46/48/62/1378464862.db2.gz OFAMSTGPYFIENJ-RTBURBONSA-N 1 3 329.488 2.594 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](CC)[NH2+]Cc1ccccc1C ZINC001421402636 1378583620 /nfs/dbraw/zinc/58/36/20/1378583620.db2.gz IZQWAWIQJXWQLL-OALUTQOASA-N 1 3 331.504 2.854 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](CC)[NH2+]Cc1ccccc1C ZINC001421402638 1378584101 /nfs/dbraw/zinc/58/41/01/1378584101.db2.gz IZQWAWIQJXWQLL-RBUKOAKNSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]CC1CC(C)(C)C1 ZINC001421454823 1378640120 /nfs/dbraw/zinc/64/01/20/1378640120.db2.gz ZAPGQHJVLFKBJO-INIZCTEOSA-N 1 3 325.541 2.885 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cc(C)cc(C)c1 ZINC001421455122 1378640221 /nfs/dbraw/zinc/64/02/21/1378640221.db2.gz ZETFQHKQFREIKI-KXBFYZLASA-N 1 3 331.504 2.630 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCc1cccs1)C2 ZINC001421514565 1378725900 /nfs/dbraw/zinc/72/59/00/1378725900.db2.gz INNKGWRPQHGDJT-ULQDDVLXSA-N 1 3 349.544 2.600 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCc1cccs1)C2 ZINC001421514565 1378725903 /nfs/dbraw/zinc/72/59/03/1378725903.db2.gz INNKGWRPQHGDJT-ULQDDVLXSA-N 1 3 349.544 2.600 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)CCC1 ZINC001421515649 1378728129 /nfs/dbraw/zinc/72/81/29/1378728129.db2.gz QWQWLSCOKHTRQG-FHWLQOOXSA-N 1 3 341.499 2.640 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)CCC1 ZINC001421515649 1378728134 /nfs/dbraw/zinc/72/81/34/1378728134.db2.gz QWQWLSCOKHTRQG-FHWLQOOXSA-N 1 3 341.499 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C2CC[NH+](CCCF)CC2)C1 ZINC001421517257 1378731599 /nfs/dbraw/zinc/73/15/99/1378731599.db2.gz RRIDOECSUONDMY-SFHVURJKSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@H]([NH2+]CC1CCCC1)[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001421518724 1378734671 /nfs/dbraw/zinc/73/46/71/1378734671.db2.gz CMVBNADZIZSMRF-FUHWJXTLSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@](C)(C[NH2+]CC1CCCC1)C1CC1 ZINC001421545993 1378789613 /nfs/dbraw/zinc/78/96/13/1378789613.db2.gz SHBMDRFOCOACIT-UYAOXDASSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@](C)(C[NH2+]Cc2cccc(F)c2)C2CC2)C1 ZINC001421550628 1378795588 /nfs/dbraw/zinc/79/55/88/1378795588.db2.gz JCOLSFAWFXMKMA-MGPUTAFESA-N 1 3 347.478 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@](C)(C[NH2+]Cc1ccc(F)cc1)C1CC1 ZINC001421576297 1378836612 /nfs/dbraw/zinc/83/66/12/1378836612.db2.gz ZVTKIXKFQCLHJT-IBGZPJMESA-N 1 3 335.467 2.540 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCc1ccc(C[NH2+]CC2CCCC2)cc1 ZINC001421606569 1378873995 /nfs/dbraw/zinc/87/39/95/1378873995.db2.gz MCHMLAVIESSQNI-UHFFFAOYSA-N 1 3 340.471 2.857 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](Cc1ccsc1)CC2 ZINC001421686946 1378992838 /nfs/dbraw/zinc/99/28/38/1378992838.db2.gz XMGBXCOZQIXRON-UHFFFAOYSA-N 1 3 335.517 2.514 10 0 EFAEHO CCCC[N@@H+]1CCc2c(CNC(=O)C3(N(C)C)CCC3)cccc2C1 ZINC001421697387 1379005070 /nfs/dbraw/zinc/00/50/70/1379005070.db2.gz LRMDWDTWCZRQGB-UHFFFAOYSA-N 1 3 343.515 2.945 10 0 EFAEHO CCCC[N@H+]1CCc2c(CNC(=O)C3(N(C)C)CCC3)cccc2C1 ZINC001421697387 1379005073 /nfs/dbraw/zinc/00/50/73/1379005073.db2.gz LRMDWDTWCZRQGB-UHFFFAOYSA-N 1 3 343.515 2.945 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001421718247 1379032176 /nfs/dbraw/zinc/03/21/76/1379032176.db2.gz HDGDTPZTMMYKQJ-KRWDZBQOSA-N 1 3 345.531 2.965 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+][C@@H](C)c1ccc2c(c1)CCC2 ZINC001421767201 1379105639 /nfs/dbraw/zinc/10/56/39/1379105639.db2.gz IEUKXAONBJAONA-SJORKVTESA-N 1 3 345.531 2.918 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NCC2([NH2+]CC3CCC3)CCC2)C1 ZINC001421768508 1379108138 /nfs/dbraw/zinc/10/81/38/1379108138.db2.gz WAAIKUBFLOXZKS-IBGZPJMESA-N 1 3 339.499 2.628 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](CCc2ccc(C)cc2)CC1)N(C)C ZINC001421827283 1379190572 /nfs/dbraw/zinc/19/05/72/1379190572.db2.gz CNROMOVIBOCHLG-WOJBJXKFSA-N 1 3 345.531 2.848 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](CCc2ccc(C)cc2)CC1)N(C)C ZINC001421827283 1379190579 /nfs/dbraw/zinc/19/05/79/1379190579.db2.gz CNROMOVIBOCHLG-WOJBJXKFSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001421923442 1379354896 /nfs/dbraw/zinc/35/48/96/1379354896.db2.gz AOPYLWFDIAJGQF-HNAYVOBHSA-N 1 3 344.503 2.691 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@@H](C)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001421937856 1379379000 /nfs/dbraw/zinc/37/90/00/1379379000.db2.gz DTRNXLAQVNEKKV-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001421945918 1379390395 /nfs/dbraw/zinc/39/03/95/1379390395.db2.gz PXANHPBHNHEHOB-BEFAXECRSA-N 1 3 345.531 2.890 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]Cc1cccc2cccnc21 ZINC001421979092 1379433289 /nfs/dbraw/zinc/43/32/89/1379433289.db2.gz GKKBUVFMSXLGKK-MRXNPFEDSA-N 1 3 342.487 2.512 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)CCC[NH+]2CCCC2)c1 ZINC001421989539 1379445636 /nfs/dbraw/zinc/44/56/36/1379445636.db2.gz SZCDPWRQYJVSAP-QGZVFWFLSA-N 1 3 349.494 2.947 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001422028681 1379511794 /nfs/dbraw/zinc/51/17/94/1379511794.db2.gz LWOQACALXDGMDX-VQIMIIECSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)CCC1CCN(C(=O)[C@H](CC)N(C)C)CC1 ZINC001422038723 1379525794 /nfs/dbraw/zinc/52/57/94/1379525794.db2.gz CUEUZQNPPGGODV-SJORKVTESA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)CCC1CCN(C(=O)[C@H](CC)N(C)C)CC1 ZINC001422038723 1379525797 /nfs/dbraw/zinc/52/57/97/1379525797.db2.gz CUEUZQNPPGGODV-SJORKVTESA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1[NH2+]CC1CC2(CCC2)C1 ZINC001422056560 1379551224 /nfs/dbraw/zinc/55/12/24/1379551224.db2.gz GQQDGXBIOCLYDD-WMZOPIPTSA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(C)([NH2+]CCc3ccccc3)CC2)C1 ZINC001422058858 1379555598 /nfs/dbraw/zinc/55/55/98/1379555598.db2.gz UGNMYJANVSWVHF-GOSISDBHSA-N 1 3 343.515 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H](C)[NH2+]Cc2ccsc2)C1 ZINC001422059485 1379556504 /nfs/dbraw/zinc/55/65/04/1379556504.db2.gz OMESVZPUQIGDAX-RDJZCZTQSA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H](C)[NH2+]Cc2ccsc2)C1 ZINC001422059478 1379556992 /nfs/dbraw/zinc/55/69/92/1379556992.db2.gz OMESVZPUQIGDAX-NVXWUHKLSA-N 1 3 337.533 2.805 10 0 EFAEHO CCC(CC)C[NH2+][C@@H](C)[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001422069178 1379569459 /nfs/dbraw/zinc/56/94/59/1379569459.db2.gz YIFPWKLTYLXUGV-FUHWJXTLSA-N 1 3 325.541 2.980 10 0 EFAEHO CCc1ccc(CC[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001422071064 1379571863 /nfs/dbraw/zinc/57/18/63/1379571863.db2.gz YWTKQCLKGSBHKY-FXAWDEMLSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C)([NH2+]CCc2ccccc2)CC1 ZINC001422078111 1379581099 /nfs/dbraw/zinc/58/10/99/1379581099.db2.gz WBTAJBMNPAGGIU-UHFFFAOYSA-N 1 3 331.504 2.540 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)CC[NH+](C)C)CCN1Cc1cc2ccccc2o1 ZINC001422126064 1379651730 /nfs/dbraw/zinc/65/17/30/1379651730.db2.gz LYXZCEKOHVMTNK-DOTOQJQBSA-N 1 3 343.471 2.854 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)CC[NH+](C)C)CCN1Cc1cc2ccccc2o1 ZINC001422126086 1379651780 /nfs/dbraw/zinc/65/17/80/1379651780.db2.gz LYXZCEKOHVMTNK-WBVHZDCISA-N 1 3 343.471 2.854 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1ccc(Cl)s1)C(C)C)N(C)C ZINC001422130459 1379657750 /nfs/dbraw/zinc/65/77/50/1379657750.db2.gz HBWOFVDVDFFDOR-UONOGXRCSA-N 1 3 345.940 2.972 10 0 EFAEHO CN(CC[N@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)CN(C)C1CCC1 ZINC001422168615 1379716685 /nfs/dbraw/zinc/71/66/85/1379716685.db2.gz NPVAMGINEWBENB-UHFFFAOYSA-N 1 3 342.487 2.542 10 0 EFAEHO CN(CC[N@@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)CN(C)C1CCC1 ZINC001422168615 1379716693 /nfs/dbraw/zinc/71/66/93/1379716693.db2.gz NPVAMGINEWBENB-UHFFFAOYSA-N 1 3 342.487 2.542 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@H+](C)CC[C@H]2CCCC2(F)F)CCC1 ZINC001422170177 1379717787 /nfs/dbraw/zinc/71/77/87/1379717787.db2.gz QUQUBAKOEBFVGV-OAHLLOKOSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@@H+](C)CC[C@H]2CCCC2(F)F)CCC1 ZINC001422170177 1379717796 /nfs/dbraw/zinc/71/77/96/1379717796.db2.gz QUQUBAKOEBFVGV-OAHLLOKOSA-N 1 3 345.478 2.686 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)CCN(C)C(=O)[C@@H]2CCCCN2C)c1 ZINC001422176250 1379728258 /nfs/dbraw/zinc/72/82/58/1379728258.db2.gz ROPKOGSJKHXKQX-APWZRJJASA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)CCN(C)C(=O)[C@@H]2CCCCN2C)c1 ZINC001422176250 1379728262 /nfs/dbraw/zinc/72/82/62/1379728262.db2.gz ROPKOGSJKHXKQX-APWZRJJASA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)CCN(C)C(=O)[C@H]2CCCCN2C)c1 ZINC001422176265 1379728795 /nfs/dbraw/zinc/72/87/95/1379728795.db2.gz ROPKOGSJKHXKQX-VQIMIIECSA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)CCN(C)C(=O)[C@H]2CCCCN2C)c1 ZINC001422176265 1379728798 /nfs/dbraw/zinc/72/87/98/1379728798.db2.gz ROPKOGSJKHXKQX-VQIMIIECSA-N 1 3 347.503 2.631 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(CC1)CC[NH+](C/C=C\Cl)CC2 ZINC001422184654 1379743134 /nfs/dbraw/zinc/74/31/34/1379743134.db2.gz NKVFOQQZJHCJIF-WTKPLQERSA-N 1 3 341.927 2.784 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)CCN(C)C(=O)CN(C)C(C)C)c(C)c1 ZINC001422230443 1379818302 /nfs/dbraw/zinc/81/83/02/1379818302.db2.gz JHEFZCXQTFCBOV-UHFFFAOYSA-N 1 3 333.520 2.842 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)CCN(C)C(=O)CN(C)C(C)C)c(C)c1 ZINC001422230443 1379818309 /nfs/dbraw/zinc/81/83/09/1379818309.db2.gz JHEFZCXQTFCBOV-UHFFFAOYSA-N 1 3 333.520 2.842 10 0 EFAEHO Cc1ccc(C[N@@H+](C)C[C@@H]2CCCN2C(=O)CN(C)C(C)C)cc1F ZINC001422238992 1379837109 /nfs/dbraw/zinc/83/71/09/1379837109.db2.gz ANTJPVTZTDGOQJ-SFHVURJKSA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1ccc(C[N@H+](C)C[C@@H]2CCCN2C(=O)CN(C)C(C)C)cc1F ZINC001422238992 1379837113 /nfs/dbraw/zinc/83/71/13/1379837113.db2.gz ANTJPVTZTDGOQJ-SFHVURJKSA-N 1 3 349.494 2.897 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2Cc2cccc(F)c2)C1 ZINC001422248734 1379856708 /nfs/dbraw/zinc/85/67/08/1379856708.db2.gz PFKIPXFDOGHKCJ-PKOBYXMFSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001422248734 1379856720 /nfs/dbraw/zinc/85/67/20/1379856720.db2.gz PFKIPXFDOGHKCJ-PKOBYXMFSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2Cc2cccc(F)c2)C1 ZINC001422248730 1379856826 /nfs/dbraw/zinc/85/68/26/1379856826.db2.gz PFKIPXFDOGHKCJ-MJGOQNOKSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001422248730 1379856831 /nfs/dbraw/zinc/85/68/31/1379856831.db2.gz PFKIPXFDOGHKCJ-MJGOQNOKSA-N 1 3 347.478 2.589 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[N@H+](C)CCc1cccs1)N(C)C ZINC001422252017 1379863915 /nfs/dbraw/zinc/86/39/15/1379863915.db2.gz KOEALHUNNIAHKJ-NVXWUHKLSA-N 1 3 337.533 2.554 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[N@@H+](C)CCc1cccs1)N(C)C ZINC001422252017 1379863921 /nfs/dbraw/zinc/86/39/21/1379863921.db2.gz KOEALHUNNIAHKJ-NVXWUHKLSA-N 1 3 337.533 2.554 10 0 EFAEHO C[C@@H]([NH2+]CC1CC(NC(=O)C2(N(C)C)CCC2)C1)c1ccccc1F ZINC001422268051 1379884562 /nfs/dbraw/zinc/88/45/62/1379884562.db2.gz SOHAUFRKRIZOFG-QQFBHYJXSA-N 1 3 347.478 2.855 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]Cc2c(C)cccc2C)C1)N(C)C ZINC001422275078 1379890913 /nfs/dbraw/zinc/89/09/13/1379890913.db2.gz DQWZMOBQXBJDCF-TVPLGVNVSA-N 1 3 331.504 2.628 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001422332065 1379940144 /nfs/dbraw/zinc/94/01/44/1379940144.db2.gz UHAOSNVESIQDSS-HOTGVXAUSA-N 1 3 343.515 2.642 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)cc1 ZINC001422384001 1380016423 /nfs/dbraw/zinc/01/64/23/1380016423.db2.gz VONASIJLLOMTFV-IAGOWNOFSA-N 1 3 331.504 2.852 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1ccc(C)cc1Cl ZINC001422410475 1380052251 /nfs/dbraw/zinc/05/22/51/1380052251.db2.gz HITCJUJRRDKQGQ-LSDHHAIUSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)[C@H](C)NCc1ccc(Cl)cc1F ZINC001422413427 1380057022 /nfs/dbraw/zinc/05/70/22/1380057022.db2.gz YLNOQOZCXRVGAX-STQMWFEESA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)[C@H](C)NCc1ccc(Cl)cc1F ZINC001422413427 1380057025 /nfs/dbraw/zinc/05/70/25/1380057025.db2.gz YLNOQOZCXRVGAX-STQMWFEESA-N 1 3 343.874 2.804 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001422416199 1380060496 /nfs/dbraw/zinc/06/04/96/1380060496.db2.gz MJDGAXLYTKCDNK-KGLIPLIRSA-N 1 3 325.884 2.665 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001422428259 1380080894 /nfs/dbraw/zinc/08/08/94/1380080894.db2.gz UYBSVQOPMYDDHH-OLZOCXBDSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001422451808 1380120570 /nfs/dbraw/zinc/12/05/70/1380120570.db2.gz NXABTKDCIORCLG-CVEARBPZSA-N 1 3 331.504 2.887 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[N@H+](C)Cc1ccc(Cl)cc1 ZINC001422559889 1380321900 /nfs/dbraw/zinc/32/19/00/1380321900.db2.gz JEGFYKNUJJMUBW-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001422559889 1380321901 /nfs/dbraw/zinc/32/19/01/1380321901.db2.gz JEGFYKNUJJMUBW-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)C[NH2+]CC1CC2(CCC2)C1 ZINC001438526318 1388656847 /nfs/dbraw/zinc/65/68/47/1388656847.db2.gz CIBSDSPYMRCCNY-MRXNPFEDSA-N 1 3 337.552 2.887 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@@H](C)[N@H+](C)Cc1ccc(F)cc1C ZINC001422595977 1380394749 /nfs/dbraw/zinc/39/47/49/1380394749.db2.gz DNYZJJFKQYEWQB-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc(F)cc1C ZINC001422595977 1380394751 /nfs/dbraw/zinc/39/47/51/1380394751.db2.gz DNYZJJFKQYEWQB-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)N(C)C/C=C\c1ccc(Cl)cc1 ZINC001422603827 1380407153 /nfs/dbraw/zinc/40/71/53/1380407153.db2.gz QLTSWIAYCKLWMI-BUZJKLBMSA-N 1 3 349.906 2.741 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)N(C)C/C=C\c1ccc(Cl)cc1 ZINC001422603827 1380407156 /nfs/dbraw/zinc/40/71/56/1380407156.db2.gz QLTSWIAYCKLWMI-BUZJKLBMSA-N 1 3 349.906 2.741 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]CC1CC(C)(C)C1 ZINC001422674955 1380560925 /nfs/dbraw/zinc/56/09/25/1380560925.db2.gz ZSDZGSBUZBXQKO-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@@H](C)C1)C1C[NH+](CCC2CCCCC2)C1 ZINC001422755422 1380761650 /nfs/dbraw/zinc/76/16/50/1380761650.db2.gz UJTDSKJOAGNLRS-IAGOWNOFSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1cccc([C@@H](C)[NH+]2CC([C@H](C)NC(=O)CN(C)C(C)C)C2)c1 ZINC001422761304 1380769331 /nfs/dbraw/zinc/76/93/31/1380769331.db2.gz MDVJYIZPAYXBHX-DLBZAZTESA-N 1 3 331.504 2.833 10 0 EFAEHO Cc1cccc([C@H](C)[NH+]2CC([C@@H](C)NC(=O)CN(C)C(C)C)C2)c1 ZINC001422761314 1380769467 /nfs/dbraw/zinc/76/94/67/1380769467.db2.gz MDVJYIZPAYXBHX-SJORKVTESA-N 1 3 331.504 2.833 10 0 EFAEHO C[C@H](c1ccccc1)N1C[C@@H](NC(=O)C2(C[NH+](C)C)CC2)C(C)(C)C1 ZINC001422789699 1380810488 /nfs/dbraw/zinc/81/04/88/1380810488.db2.gz QDKRBCFDQMQNFM-SJLPKXTDSA-N 1 3 343.515 2.916 10 0 EFAEHO C[C@@H](C[N@H+](C)[C@@H]1CCc2ccccc21)NC(=O)C1(N(C)C)CCC1 ZINC001422825090 1380864098 /nfs/dbraw/zinc/86/40/98/1380864098.db2.gz PUGUHRYGNNGUBH-MAUKXSAKSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@@H](C[N@@H+](C)[C@@H]1CCc2ccccc21)NC(=O)C1(N(C)C)CCC1 ZINC001422825090 1380864119 /nfs/dbraw/zinc/86/41/19/1380864119.db2.gz PUGUHRYGNNGUBH-MAUKXSAKSA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1ccc(CCC[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001422879731 1380991982 /nfs/dbraw/zinc/99/19/82/1380991982.db2.gz RJNOENHEIQQPNT-RTBURBONSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CCC[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001422879731 1380991985 /nfs/dbraw/zinc/99/19/85/1380991985.db2.gz RJNOENHEIQQPNT-RTBURBONSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C(F)F)cc1)NC(=O)CC[NH+](C)C ZINC001422881690 1380997402 /nfs/dbraw/zinc/99/74/02/1380997402.db2.gz CTMHNGYSEYHHPT-CYBMUJFWSA-N 1 3 327.419 2.512 10 0 EFAEHO C[C@H](CN(C)C/C=C/c1ccc(Cl)cc1)NC(=O)CC[NH+](C)C ZINC001422883781 1381000355 /nfs/dbraw/zinc/00/03/55/1381000355.db2.gz IHZRBKUFELWCON-LLYBFZRZSA-N 1 3 337.895 2.741 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC001422903856 1381030978 /nfs/dbraw/zinc/03/09/78/1381030978.db2.gz BGCQHPBAZPNTPI-SPYBWZPUSA-N 1 3 347.478 2.639 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001422906229 1381034274 /nfs/dbraw/zinc/03/42/74/1381034274.db2.gz GRUKERRDTHGROD-BHIYHBOVSA-N 1 3 331.504 2.566 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@H+](C)CCCc1ccccc1 ZINC001422913746 1381045597 /nfs/dbraw/zinc/04/55/97/1381045597.db2.gz CFXWNZQHBCZPRL-QUCCMNQESA-N 1 3 345.531 2.930 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@@H+](C)CCCc1ccccc1 ZINC001422913746 1381045605 /nfs/dbraw/zinc/04/56/05/1381045605.db2.gz CFXWNZQHBCZPRL-QUCCMNQESA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(Cl)cc2)C1 ZINC001422921010 1381060098 /nfs/dbraw/zinc/06/00/98/1381060098.db2.gz VHPHLBBJNLTWJE-JCNLHEQBSA-N 1 3 337.895 2.665 10 0 EFAEHO CCCc1ccc(C[NH2+]C[C@H](C)N(C)C(=O)[C@@H]2CCCN2C)cc1 ZINC001438636267 1388710136 /nfs/dbraw/zinc/71/01/36/1388710136.db2.gz MVJLVRYYKGSYIW-LPHOPBHVSA-N 1 3 331.504 2.670 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccsc2)[C@@H](CC)C1 ZINC001423067789 1381297545 /nfs/dbraw/zinc/29/75/45/1381297545.db2.gz RGCQZAKSGVQUSV-DLBZAZTESA-N 1 3 337.533 2.807 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001423102725 1381353218 /nfs/dbraw/zinc/35/32/18/1381353218.db2.gz VWZZFDHLNAAHBQ-MRXNPFEDSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC[C@H]1CCN1[C@H]1CCc2ccccc21 ZINC001423150542 1381447205 /nfs/dbraw/zinc/44/72/05/1381447205.db2.gz GWHKJKLESKLWBW-MJGOQNOKSA-N 1 3 329.488 2.596 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC[C@H]1CCN1[C@H]1CCc2ccccc21 ZINC001423150542 1381447223 /nfs/dbraw/zinc/44/72/23/1381447223.db2.gz GWHKJKLESKLWBW-MJGOQNOKSA-N 1 3 329.488 2.596 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H]3CC[C@@H]4CCCC[N@H+]34)CC2)cs1 ZINC001423243897 1381668875 /nfs/dbraw/zinc/66/88/75/1381668875.db2.gz KKCLQFNFWXBWKK-DLBZAZTESA-N 1 3 347.528 2.812 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H]3CC[C@@H]4CCCC[N@@H+]34)CC2)cs1 ZINC001423243897 1381668896 /nfs/dbraw/zinc/66/88/96/1381668896.db2.gz KKCLQFNFWXBWKK-DLBZAZTESA-N 1 3 347.528 2.812 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+][C@H]2CCCc3ccccc32)CC1)N(C)C ZINC001423277403 1381737958 /nfs/dbraw/zinc/73/79/58/1381737958.db2.gz ZMAZDTTVRYEZSR-RBUKOAKNSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]CC2CC3(CCC3)C2)CC1 ZINC001423304235 1381761394 /nfs/dbraw/zinc/76/13/94/1381761394.db2.gz CSPAWXAIKWJPKE-HZPDHXFCSA-N 1 3 333.520 2.678 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@@H]21 ZINC001423351661 1381827946 /nfs/dbraw/zinc/82/79/46/1381827946.db2.gz CLUNIFCAPHCEDK-OKZBNKHCSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2cc3ccccc3o2)C[C@@H]1C ZINC001423353082 1381830475 /nfs/dbraw/zinc/83/04/75/1381830475.db2.gz JYDKZVWGTFMUBH-DOTOQJQBSA-N 1 3 343.471 2.852 10 0 EFAEHO C[C@@H](NC[C@H](C)N(C)C(=O)CC[NH+](C)C)c1ccccc1Cl ZINC001438696626 1388745770 /nfs/dbraw/zinc/74/57/70/1388745770.db2.gz VZTRGKMTLBZONL-UONOGXRCSA-N 1 3 325.884 2.789 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CC3CCC3)[C@@H]2C1)CC(C)(C)C ZINC001423366289 1381855637 /nfs/dbraw/zinc/85/56/37/1381855637.db2.gz WHZICRZQLJGJAB-IPMKNSEASA-N 1 3 349.563 2.981 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1C[C@H]([NH2+]Cc2ccccc2)C(C)(C)C1 ZINC001423393783 1381899385 /nfs/dbraw/zinc/89/93/85/1381899385.db2.gz MDLDWIHQGSVIKF-ROUUACIJSA-N 1 3 349.494 2.693 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1C[C@@H]([NH2+]Cc2ccccc2)C(C)(C)C1 ZINC001423393786 1381899711 /nfs/dbraw/zinc/89/97/11/1381899711.db2.gz MDLDWIHQGSVIKF-ZWKOTPCHSA-N 1 3 349.494 2.693 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)CC1(C)C ZINC001423409617 1381918266 /nfs/dbraw/zinc/91/82/66/1381918266.db2.gz XPZIJZUEENLNRD-QZTJIDSGSA-N 1 3 349.494 2.937 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001423485543 1381978181 /nfs/dbraw/zinc/97/81/81/1381978181.db2.gz ZHCLYLWUUOZGIY-CVEARBPZSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001423485549 1381978198 /nfs/dbraw/zinc/97/81/98/1381978198.db2.gz ZHCLYLWUUOZGIY-HOTGVXAUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NC1(C)CCN(CCC(F)(F)F)CC1 ZINC001423510913 1381998943 /nfs/dbraw/zinc/99/89/43/1381998943.db2.gz DUWXXJSAVIOQAP-ZIAGYGMSSA-N 1 3 349.441 2.782 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)NC1(C)CCN(CCC(F)(F)F)CC1 ZINC001423510908 1381999079 /nfs/dbraw/zinc/99/90/79/1381999079.db2.gz DUWXXJSAVIOQAP-KBPBESRZSA-N 1 3 349.441 2.782 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1ccccc1F)C1CCCC1)N(C)C ZINC001423549413 1382050698 /nfs/dbraw/zinc/05/06/98/1382050698.db2.gz XPGOESRRGZTGMD-RBUKOAKNSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[N@@H+]1CCCC[C@H]1C(=O)N(C)[C@H](C)CNCc1cc(C)ccc1F ZINC001438717186 1388759702 /nfs/dbraw/zinc/75/97/02/1388759702.db2.gz VKBOOTIIQGRXHX-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CC[N@H+]1CCCC[C@H]1C(=O)N(C)[C@H](C)CNCc1cc(C)ccc1F ZINC001438717186 1388759704 /nfs/dbraw/zinc/75/97/04/1388759704.db2.gz VKBOOTIIQGRXHX-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cccc(CN(C)CCN(C(=O)[C@@H]2CC[N@H+](C)C2)C(C)C)c1 ZINC001423578279 1382106335 /nfs/dbraw/zinc/10/63/35/1382106335.db2.gz MCPQVFMXQIVNKS-LJQANCHMSA-N 1 3 331.504 2.616 10 0 EFAEHO Cc1cccc(CN(C)CCN(C(=O)[C@@H]2CC[N@@H+](C)C2)C(C)C)c1 ZINC001423578279 1382106338 /nfs/dbraw/zinc/10/63/38/1382106338.db2.gz MCPQVFMXQIVNKS-LJQANCHMSA-N 1 3 331.504 2.616 10 0 EFAEHO CCc1ccc(CN2CC[C@@](C)(NC(=O)C[C@H]3CC[N@H+](C)C3)C2)cc1 ZINC001423583038 1382114099 /nfs/dbraw/zinc/11/40/99/1382114099.db2.gz JGRQFSRHOIHPRN-TZIWHRDSSA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1ccc(CN2CC[C@@](C)(NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)cc1 ZINC001423583038 1382114102 /nfs/dbraw/zinc/11/41/02/1382114102.db2.gz JGRQFSRHOIHPRN-TZIWHRDSSA-N 1 3 343.515 2.671 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@]1(C)CC[N@H+](Cc2ccccc2C)C1 ZINC001423590193 1382127179 /nfs/dbraw/zinc/12/71/79/1382127179.db2.gz ZDNMSUDUPQYWGG-ICSRJNTNSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@]1(C)CC[N@@H+](Cc2ccccc2C)C1 ZINC001423590193 1382127183 /nfs/dbraw/zinc/12/71/83/1382127183.db2.gz ZDNMSUDUPQYWGG-ICSRJNTNSA-N 1 3 349.494 2.756 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@](C)(C[NH2+]CC3CC4(CCC4)C3)C2)C1 ZINC001423624651 1382186587 /nfs/dbraw/zinc/18/65/87/1382186587.db2.gz CNFZDDRZVIOZBQ-FXAWDEMLSA-N 1 3 347.547 2.737 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@]2(C)CCN(C(=O)CN3CC[C@H](C)C3)C2)cc1 ZINC001423626311 1382190553 /nfs/dbraw/zinc/19/05/53/1382190553.db2.gz HJTXKFZIWMZRKH-RXVVDRJESA-N 1 3 343.515 2.665 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H](CNCc1cc(F)cc(F)c1)C(C)(C)C ZINC001423629831 1382195171 /nfs/dbraw/zinc/19/51/71/1382195171.db2.gz XKYSBKMJBVUJRD-INIZCTEOSA-N 1 3 341.446 2.537 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C1CC[NH+](CC[C@@H](C)F)CC1)N(C)C ZINC001423652956 1382228549 /nfs/dbraw/zinc/22/85/49/1382228549.db2.gz SHSRJCYPHMHGPW-BFYDXBDKSA-N 1 3 329.504 2.537 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC001423656669 1382232372 /nfs/dbraw/zinc/23/23/72/1382232372.db2.gz MNOSARMOVHNNJX-QGZVFWFLSA-N 1 3 343.515 2.888 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001438765044 1388795330 /nfs/dbraw/zinc/79/53/30/1388795330.db2.gz FYUQSZSTMMBSBA-ICSRJNTNSA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)C[N@H+](C)Cc1ccccc1CNC(=O)CN(C)C1CCC1 ZINC001424060265 1382717657 /nfs/dbraw/zinc/71/76/57/1382717657.db2.gz COECLTLFAYBCNJ-UHFFFAOYSA-N 1 3 331.504 2.875 10 0 EFAEHO CC(C)C[N@@H+](C)Cc1ccccc1CNC(=O)CN(C)C1CCC1 ZINC001424060265 1382717661 /nfs/dbraw/zinc/71/76/61/1382717661.db2.gz COECLTLFAYBCNJ-UHFFFAOYSA-N 1 3 331.504 2.875 10 0 EFAEHO CC[N@H+](C)CCC1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001438778536 1388808555 /nfs/dbraw/zinc/80/85/55/1388808555.db2.gz NFDDTDQDAOIPKL-LJQANCHMSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[N@@H+](C)CCC1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001438778536 1388808559 /nfs/dbraw/zinc/80/85/59/1388808559.db2.gz NFDDTDQDAOIPKL-LJQANCHMSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[N@@H+]1CCc2c(CNC(=O)CN(C)CC(C)(C)C)cccc2C1 ZINC001424140443 1382788103 /nfs/dbraw/zinc/78/81/03/1382788103.db2.gz BSEZHACHXRZHGV-UHFFFAOYSA-N 1 3 331.504 2.659 10 0 EFAEHO CC[N@H+]1CCc2c(CNC(=O)CN(C)CC(C)(C)C)cccc2C1 ZINC001424140443 1382788110 /nfs/dbraw/zinc/78/81/10/1382788110.db2.gz BSEZHACHXRZHGV-UHFFFAOYSA-N 1 3 331.504 2.659 10 0 EFAEHO CCCN1Cc2ccccc2C[C@@H]1CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001424395259 1382983685 /nfs/dbraw/zinc/98/36/85/1382983685.db2.gz PALOCVFHXQUTKH-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO CCCN1Cc2ccccc2C[C@@H]1CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001424395259 1382983689 /nfs/dbraw/zinc/98/36/89/1382983689.db2.gz PALOCVFHXQUTKH-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO Cc1ccc(CC[N@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001424556409 1383105275 /nfs/dbraw/zinc/10/52/75/1383105275.db2.gz DZKOXMQAODYVBA-UYAOXDASSA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1ccc(CC[N@@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001424556409 1383105280 /nfs/dbraw/zinc/10/52/80/1383105280.db2.gz DZKOXMQAODYVBA-UYAOXDASSA-N 1 3 345.531 2.847 10 0 EFAEHO CC(C)CC[NH2+][C@@H](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001424597494 1383202944 /nfs/dbraw/zinc/20/29/44/1383202944.db2.gz ZLIZXTKBHKSZKB-MAUKXSAKSA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]CC1CCCC1 ZINC001438829410 1388845766 /nfs/dbraw/zinc/84/57/66/1388845766.db2.gz OYABZSVOXRHKPR-QGZVFWFLSA-N 1 3 325.541 2.885 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]Cc1ccsc1 ZINC001438829782 1388846743 /nfs/dbraw/zinc/84/67/43/1388846743.db2.gz QEMBZABDPJPPCM-MRXNPFEDSA-N 1 3 339.549 2.956 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)[C@H](C)NC(=O)C23CCC[NH+]2CCC3)c1 ZINC001424786316 1383345945 /nfs/dbraw/zinc/34/59/45/1383345945.db2.gz KIZIXLPHAXLXRL-HOTGVXAUSA-N 1 3 347.478 2.745 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)c(C)c1 ZINC001424806521 1383367906 /nfs/dbraw/zinc/36/79/06/1383367906.db2.gz WUWZHENPDCYHNB-IAGOWNOFSA-N 1 3 331.504 2.771 10 0 EFAEHO CCc1ccc(CC[NH2+][C@H](C)[C@@H](C)NC(=O)Cc2nc[nH]c2C)cc1 ZINC001424831705 1383391707 /nfs/dbraw/zinc/39/17/07/1383391707.db2.gz GJNMEKBHOPIMSH-HUUCEWRRSA-N 1 3 342.487 2.549 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001424850801 1383415290 /nfs/dbraw/zinc/41/52/90/1383415290.db2.gz RKSWLMVPSISPJX-NWDGAFQWSA-N 1 3 331.913 2.726 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1c(C)cccc1Cl ZINC001424855422 1383424991 /nfs/dbraw/zinc/42/49/91/1383424991.db2.gz WYOZVEADYTYSFT-LSDHHAIUSA-N 1 3 339.911 2.973 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[N@H+](C)CCCc1ccccc1 ZINC001424937313 1383492534 /nfs/dbraw/zinc/49/25/34/1383492534.db2.gz JBQJNXRWAWEFDD-UYAOXDASSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[N@@H+](C)CCCc1ccccc1 ZINC001424937313 1383492539 /nfs/dbraw/zinc/49/25/39/1383492539.db2.gz JBQJNXRWAWEFDD-UYAOXDASSA-N 1 3 345.531 2.929 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)[N@H+](C)CC[C@H]1CCCC1(F)F ZINC001425060004 1383510840 /nfs/dbraw/zinc/51/08/40/1383510840.db2.gz UKVJAVBVRBLZHL-GXTWGEPZSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC001425060004 1383510845 /nfs/dbraw/zinc/51/08/45/1383510845.db2.gz UKVJAVBVRBLZHL-GXTWGEPZSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)[N@H+](C)CC[C@H]1CCCC1(F)F ZINC001425060013 1383511371 /nfs/dbraw/zinc/51/13/71/1383511371.db2.gz UKVJAVBVRBLZHL-TZMCWYRMSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC001425060013 1383511381 /nfs/dbraw/zinc/51/13/81/1383511381.db2.gz UKVJAVBVRBLZHL-TZMCWYRMSA-N 1 3 342.434 2.523 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@H](C)C1)C1C[NH+](CC2CCC(C)(C)CC2)C1 ZINC001425246753 1383562955 /nfs/dbraw/zinc/56/29/55/1383562955.db2.gz OGRJBEKLIRYECE-DLBZAZTESA-N 1 3 349.563 2.981 10 0 EFAEHO Cc1ccc(C[NH+]2CC([C@@H](C)NC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001425260944 1383577196 /nfs/dbraw/zinc/57/71/96/1383577196.db2.gz FMLOPHQURLDCIO-QGZVFWFLSA-N 1 3 331.504 2.580 10 0 EFAEHO CCc1ccccc1CC[NH+]1CC([C@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001425263642 1383579378 /nfs/dbraw/zinc/57/93/78/1383579378.db2.gz KBEJMNOPFIKUFK-KRWDZBQOSA-N 1 3 345.531 2.568 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C(C)C)cc1C ZINC001438851758 1388865040 /nfs/dbraw/zinc/86/50/40/1388865040.db2.gz QMZVZYSDAIMQCP-IBGZPJMESA-N 1 3 333.520 2.874 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@H]2CN(CCCF)CC2(C)C)CCCCC1 ZINC001425289520 1383594408 /nfs/dbraw/zinc/59/44/08/1383594408.db2.gz KQHUBBOTUJARIP-INIZCTEOSA-N 1 3 341.515 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001425378282 1383637988 /nfs/dbraw/zinc/63/79/88/1383637988.db2.gz FANBCOKJFADUMH-HSALFYBXSA-N 1 3 343.515 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001425378282 1383637991 /nfs/dbraw/zinc/63/79/91/1383637991.db2.gz FANBCOKJFADUMH-HSALFYBXSA-N 1 3 343.515 2.744 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H](C2CC2)N(C)C(=O)CN(C)C(C)C)c1 ZINC001425510457 1383674798 /nfs/dbraw/zinc/67/47/98/1383674798.db2.gz PMWKAWCWMAHZEH-LJQANCHMSA-N 1 3 331.504 2.662 10 0 EFAEHO C[C@H](CN(C)C(=O)CC[NH+](C)C)N[C@H](C)c1ccccc1Cl ZINC001425643742 1383732318 /nfs/dbraw/zinc/73/23/18/1383732318.db2.gz VSTXMUWPSVKZJD-ZIAGYGMSSA-N 1 3 325.884 2.789 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCN(C)C(=O)[C@@H]2C[NH+]3CCC2CC3)c1 ZINC001438872908 1388880932 /nfs/dbraw/zinc/88/09/32/1388880932.db2.gz JEIIKCIOACILCP-HXUWFJFHSA-N 1 3 343.515 2.535 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@@H]1C[C@@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001425882592 1383824913 /nfs/dbraw/zinc/82/49/13/1383824913.db2.gz DWDOKEVHACTGFX-YLJYHZDGSA-N 1 3 345.531 2.711 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@@H](C)N(C(=O)CCC[NH+](C)C)C2)c1 ZINC001425886969 1383829118 /nfs/dbraw/zinc/82/91/18/1383829118.db2.gz CRQRXXPIEPVFPV-WBVHZDCISA-N 1 3 335.467 2.555 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c(C)c1 ZINC001438902801 1388904828 /nfs/dbraw/zinc/90/48/28/1388904828.db2.gz PLHAHYIYQXETSC-OALUTQOASA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c(C)c1 ZINC001438902801 1388904830 /nfs/dbraw/zinc/90/48/30/1388904830.db2.gz PLHAHYIYQXETSC-OALUTQOASA-N 1 3 345.531 2.924 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)CC[C@@H]1CCCC1(F)F ZINC001438937188 1388938166 /nfs/dbraw/zinc/93/81/66/1388938166.db2.gz KTADEWPOCDWWLR-HNNXBMFYSA-N 1 3 333.467 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC001438937188 1388938169 /nfs/dbraw/zinc/93/81/69/1388938169.db2.gz KTADEWPOCDWWLR-HNNXBMFYSA-N 1 3 333.467 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2CC2CC3(CCC3)C2)C1 ZINC001438951766 1388948199 /nfs/dbraw/zinc/94/81/99/1388948199.db2.gz OQUGJBPLRFHVJQ-MOPGFXCFSA-N 1 3 347.547 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2CC2CC3(CCC3)C2)C1 ZINC001438951766 1388948203 /nfs/dbraw/zinc/94/82/03/1388948203.db2.gz OQUGJBPLRFHVJQ-MOPGFXCFSA-N 1 3 347.547 2.830 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCN2C(C)C)c(C)c1 ZINC001439109299 1388996457 /nfs/dbraw/zinc/99/64/57/1388996457.db2.gz HWARPFSQOSLZQC-IEBWSBKVSA-N 1 3 331.504 2.771 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CN([C@H]2CCc3c2cccc3F)CC1(C)C ZINC001506747000 1406241637 /nfs/dbraw/zinc/24/16/37/1406241637.db2.gz CAWWDVUEQGAMMQ-ZWKOTPCHSA-N 1 3 347.478 2.591 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CN([C@@H]2CCc3c2cccc3F)CC1(C)C ZINC001506746993 1406243105 /nfs/dbraw/zinc/24/31/05/1406243105.db2.gz CAWWDVUEQGAMMQ-MSOLQXFVSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@H+](CC2CCC2)CC1(C)C)N1CCCC1 ZINC001506752108 1406254994 /nfs/dbraw/zinc/25/49/94/1406254994.db2.gz GMSRTLRQWZSKBT-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@@H+](CC2CCC2)CC1(C)C)N1CCCC1 ZINC001506752108 1406255002 /nfs/dbraw/zinc/25/50/02/1406255002.db2.gz GMSRTLRQWZSKBT-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001506785670 1406280212 /nfs/dbraw/zinc/28/02/12/1406280212.db2.gz NGEHRICSKBUGPV-LDLYASANSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001506785670 1406280217 /nfs/dbraw/zinc/28/02/17/1406280217.db2.gz NGEHRICSKBUGPV-LDLYASANSA-N 1 3 349.563 2.981 10 0 EFAEHO CC[C@@H](c1ccccc1)[N@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)C(C)C)[C@@H]2C1 ZINC001506827932 1406305582 /nfs/dbraw/zinc/30/55/82/1406305582.db2.gz CRHOMKCKTDZQOW-HAGHYFMRSA-N 1 3 343.515 2.772 10 0 EFAEHO CC[C@@H](c1ccccc1)[N@@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)C(C)C)[C@@H]2C1 ZINC001506827932 1406305593 /nfs/dbraw/zinc/30/55/93/1406305593.db2.gz CRHOMKCKTDZQOW-HAGHYFMRSA-N 1 3 343.515 2.772 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001439212282 1389051286 /nfs/dbraw/zinc/05/12/86/1389051286.db2.gz BDYAWUKOXVMIPJ-INIZCTEOSA-N 1 3 331.504 2.889 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N[C@@H](C)CNCc2cc(C)ccc2F)C1 ZINC001439240593 1389067938 /nfs/dbraw/zinc/06/79/38/1389067938.db2.gz AJMGZIWQABYBEK-DLBZAZTESA-N 1 3 349.494 2.850 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N[C@@H](C)CNCc2cc(C)ccc2F)C1 ZINC001439240593 1389067942 /nfs/dbraw/zinc/06/79/42/1389067942.db2.gz AJMGZIWQABYBEK-DLBZAZTESA-N 1 3 349.494 2.850 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCCN2CC)cc1 ZINC001439283642 1389094890 /nfs/dbraw/zinc/09/48/90/1389094890.db2.gz DYSLNIBWBOWUOB-LPHOPBHVSA-N 1 3 331.504 2.718 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C)C[N@H+](C)CC1CC2(CCC2)C1 ZINC001439321768 1389141174 /nfs/dbraw/zinc/14/11/74/1389141174.db2.gz DFRRDFLLOYTDBX-WMZOPIPTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001439321768 1389141180 /nfs/dbraw/zinc/14/11/80/1389141180.db2.gz DFRRDFLLOYTDBX-WMZOPIPTSA-N 1 3 335.536 2.876 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)Cc1ccc(CF)cc1 ZINC001439400821 1389245186 /nfs/dbraw/zinc/24/51/86/1389245186.db2.gz BKRLHTWLXBFECX-QFBILLFUSA-N 1 3 349.494 2.967 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc(CF)cc1 ZINC001439400821 1389245193 /nfs/dbraw/zinc/24/51/93/1389245193.db2.gz BKRLHTWLXBFECX-QFBILLFUSA-N 1 3 349.494 2.967 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCc1cccs1)C2 ZINC001440107580 1389388910 /nfs/dbraw/zinc/38/89/10/1389388910.db2.gz GMKFQMBHWWTBOC-ULQDDVLXSA-N 1 3 349.544 2.602 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCc1cccs1)C2 ZINC001440107580 1389388917 /nfs/dbraw/zinc/38/89/17/1389388917.db2.gz GMKFQMBHWWTBOC-ULQDDVLXSA-N 1 3 349.544 2.602 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001440219259 1389449693 /nfs/dbraw/zinc/44/96/93/1389449693.db2.gz LAXTVDBRCDBFLS-BRWVUGGUSA-N 1 3 343.531 2.977 10 0 EFAEHO CC(C)C[NH2+][C@@H](C)c1ccc(CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001440225899 1389456696 /nfs/dbraw/zinc/45/66/96/1389456696.db2.gz SUXGSVLFBMZVLV-IRXDYDNUSA-N 1 3 331.504 2.951 10 0 EFAEHO CN(C[C@H]1CCN1CCC1CC1)C(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001440240044 1389467257 /nfs/dbraw/zinc/46/72/57/1389467257.db2.gz HSTPUGUGDNVCBW-VQIMIIECSA-N 1 3 339.499 2.532 10 0 EFAEHO CN(C[C@H]1CCN1CCC1CC1)C(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001440240044 1389467260 /nfs/dbraw/zinc/46/72/60/1389467260.db2.gz HSTPUGUGDNVCBW-VQIMIIECSA-N 1 3 339.499 2.532 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@@H]([NH2+]CCC2CCCC2)C1)N1CCCC1 ZINC001440285090 1389503727 /nfs/dbraw/zinc/50/37/27/1389503727.db2.gz GDKZDICKQMHJDW-HDICACEKSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]CC2CC(C)(C)C2)CCC1)N1CCCC1 ZINC001440326845 1389538186 /nfs/dbraw/zinc/53/81/86/1389538186.db2.gz KZZLLKNWDUEAFM-UHFFFAOYSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@H](CNC(=O)C(C)(C)N3CCCC3)C2)cc1 ZINC001440352951 1389557895 /nfs/dbraw/zinc/55/78/95/1389557895.db2.gz XKDHILUHTZDDHQ-WGSAOQKQSA-N 1 3 343.515 2.854 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001440362008 1389567536 /nfs/dbraw/zinc/56/75/36/1389567536.db2.gz JUVNXZNUJVOWND-IRJFHVNHSA-N 1 3 343.515 2.889 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CN(CC)C[C@H]1c1ccccc1)[NH+](CC)CC ZINC001440373602 1389574636 /nfs/dbraw/zinc/57/46/36/1389574636.db2.gz RBMIROMNGCQBGC-IPMKNSEASA-N 1 3 331.504 2.711 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CCCN(CCC(F)(F)F)CC1 ZINC001440389841 1389586641 /nfs/dbraw/zinc/58/66/41/1389586641.db2.gz LZARWCGEDVLBLN-HUUCEWRRSA-N 1 3 349.441 2.784 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CCCN(CCC(F)(F)F)CC1 ZINC001440389841 1389586646 /nfs/dbraw/zinc/58/66/46/1389586646.db2.gz LZARWCGEDVLBLN-HUUCEWRRSA-N 1 3 349.441 2.784 10 0 EFAEHO CC[C@H](F)CN1CCC[C@@H](NC(=O)CCC[NH+]2CCCCC2)CC1 ZINC001440405093 1389604381 /nfs/dbraw/zinc/60/43/81/1389604381.db2.gz QBBDQTONQBEZJL-ZWKOTPCHSA-N 1 3 341.515 2.971 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(F)cc2C)C1 ZINC001440415432 1389611883 /nfs/dbraw/zinc/61/18/83/1389611883.db2.gz WSBRENSBINRRTD-QFBILLFUSA-N 1 3 349.494 2.850 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[N@H+](C)[C@H]2CCc3ccccc32)CCC1 ZINC001440433004 1389631720 /nfs/dbraw/zinc/63/17/20/1389631720.db2.gz OIFSACOSRWLTQJ-IBGZPJMESA-N 1 3 343.515 2.939 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[N@@H+](C)[C@H]2CCc3ccccc32)CCC1 ZINC001440433004 1389631728 /nfs/dbraw/zinc/63/17/28/1389631728.db2.gz OIFSACOSRWLTQJ-IBGZPJMESA-N 1 3 343.515 2.939 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@H]1CCCCCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001440460656 1389660415 /nfs/dbraw/zinc/66/04/15/1389660415.db2.gz KJHRKSZPTLPALY-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCN(C)CC(=O)N1CCCCC[C@@H]([NH2+]Cc2ccsc2)C1 ZINC001440462381 1389663614 /nfs/dbraw/zinc/66/36/14/1389663614.db2.gz FCUYTOFVVJGBLY-QGZVFWFLSA-N 1 3 337.533 2.951 10 0 EFAEHO CCCC[N@@H+]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)CC(C)(C)C1 ZINC001440528579 1389731593 /nfs/dbraw/zinc/73/15/93/1389731593.db2.gz PLQSHXNLAYOLLT-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CCCC[N@H+]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)CC(C)(C)C1 ZINC001440528579 1389731599 /nfs/dbraw/zinc/73/15/99/1389731599.db2.gz PLQSHXNLAYOLLT-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CCCC[N@@H+]1CC[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)CC(C)(C)C1 ZINC001440528583 1389731727 /nfs/dbraw/zinc/73/17/27/1389731727.db2.gz PLQSHXNLAYOLLT-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCC[N@H+]1CC[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)CC(C)(C)C1 ZINC001440528583 1389731731 /nfs/dbraw/zinc/73/17/31/1389731731.db2.gz PLQSHXNLAYOLLT-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@H]([NH2+]Cc2cccc(Cl)c2)C1 ZINC001440589519 1389762104 /nfs/dbraw/zinc/76/21/04/1389762104.db2.gz BWPXXXMMSNOULX-WMLDXEAASA-N 1 3 337.895 2.617 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NC1CC(CNC/C(Cl)=C/Cl)C1 ZINC001440751155 1389869561 /nfs/dbraw/zinc/86/95/61/1389869561.db2.gz ASRHJRTZWVQLSF-VZGGYQPYSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NC1CC(CNC/C(Cl)=C/Cl)C1 ZINC001440751155 1389869569 /nfs/dbraw/zinc/86/95/69/1389869569.db2.gz ASRHJRTZWVQLSF-VZGGYQPYSA-N 1 3 348.318 2.663 10 0 EFAEHO CN(C)C1(C(=O)NC2CC(C[NH2+]CC3CC4(CCC4)C3)C2)CCC1 ZINC001440756790 1389873292 /nfs/dbraw/zinc/87/32/92/1389873292.db2.gz DCGBTNAGYIJYCT-UHFFFAOYSA-N 1 3 333.520 2.535 10 0 EFAEHO C[C@H]([NH2+]CC1CC(NC(=O)C2(N(C)C)CCC2)C1)c1cccc(F)c1 ZINC001440759709 1389875213 /nfs/dbraw/zinc/87/52/13/1389875213.db2.gz SQTUMWXYMURCDA-SYJJWHGVSA-N 1 3 347.478 2.855 10 0 EFAEHO CC[C@H](C)C[NH2+]CC1CC(NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001440764539 1389877484 /nfs/dbraw/zinc/87/74/84/1389877484.db2.gz VFLSMAPUBQUAJO-DMKPSLHHSA-N 1 3 331.504 2.892 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)c(C)s1 ZINC001440795939 1389903517 /nfs/dbraw/zinc/90/35/17/1389903517.db2.gz JRSMVOSUVDWKBM-KBPBESRZSA-N 1 3 337.533 2.832 10 0 EFAEHO COc1cccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)CC(C)(C)C)c1 ZINC001440828900 1389930866 /nfs/dbraw/zinc/93/08/66/1389930866.db2.gz GIPYUSZDSXJJMI-JKSUJKDBSA-N 1 3 349.519 2.656 10 0 EFAEHO C[C@@H](NC(=O)CN(C)CC(C)(C)C)[C@@H](C)[NH2+]Cc1ccsc1 ZINC001440845270 1389945551 /nfs/dbraw/zinc/94/55/51/1389945551.db2.gz XLLBQNSULSMMMT-ZIAGYGMSSA-N 1 3 325.522 2.709 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001440853631 1389955039 /nfs/dbraw/zinc/95/50/39/1389955039.db2.gz XIBCKPIJGOQELL-NWDGAFQWSA-N 1 3 342.434 2.569 10 0 EFAEHO Cc1cccnc1C[NH2+]C1CCC(N(C)C(=O)CN(C)C(C)C)CC1 ZINC001440857403 1389958277 /nfs/dbraw/zinc/95/82/77/1389958277.db2.gz JANRJYYVOYBMPI-UHFFFAOYSA-N 1 3 346.519 2.589 10 0 EFAEHO CC[C@@H]([NH2+]C[C@H]1C[C@H](NC(=O)CN2CC[C@H](C)C2)C1)c1ccccc1 ZINC001506897064 1406414918 /nfs/dbraw/zinc/41/49/18/1406414918.db2.gz IMTYIMSZJAIXHK-QGZVKYPTSA-N 1 3 343.515 2.964 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001506903228 1406420780 /nfs/dbraw/zinc/42/07/80/1406420780.db2.gz IYTCZAVQTBJFGA-SCNLOKJLSA-N 1 3 329.488 2.524 10 0 EFAEHO C[C@H](CCC[NH2+]C/C=C/Cl)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001506938394 1406469043 /nfs/dbraw/zinc/46/90/43/1406469043.db2.gz QNFOWAOOMSUVSC-GIYGXLGSSA-N 1 3 347.906 2.826 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)Cc1ccc2ncccc2c1 ZINC001441031945 1391047004 /nfs/dbraw/zinc/04/70/04/1391047004.db2.gz IAAFFOGDJBGNLF-MRXNPFEDSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc2ncccc2c1 ZINC001441031945 1391047010 /nfs/dbraw/zinc/04/70/10/1391047010.db2.gz IAAFFOGDJBGNLF-MRXNPFEDSA-N 1 3 342.487 2.512 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1(C[NH2+]CC2CCCC2)CCCCC1 ZINC001441104570 1391097778 /nfs/dbraw/zinc/09/77/78/1391097778.db2.gz BZJHKOUUUBXZCE-UHFFFAOYSA-N 1 3 332.492 2.860 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC12CC[NH+](CC1CC(C)(C)C1)CC2 ZINC001441154499 1391151528 /nfs/dbraw/zinc/15/15/28/1391151528.db2.gz OENOHAQNNBSEGF-QGZVFWFLSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CCc1ccccc1)C1CC1 ZINC001441189055 1391169234 /nfs/dbraw/zinc/16/92/34/1391169234.db2.gz CGLWULBGUGFKDI-UXHICEINSA-N 1 3 343.515 2.586 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CCc1ccccc1)C1CC1 ZINC001441189057 1391169319 /nfs/dbraw/zinc/16/93/19/1391169319.db2.gz CGLWULBGUGFKDI-VQTJNVASSA-N 1 3 343.515 2.586 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CCc1ccccc1)C1CC1 ZINC001441189060 1391169381 /nfs/dbraw/zinc/16/93/81/1391169381.db2.gz CGLWULBGUGFKDI-WOJBJXKFSA-N 1 3 343.515 2.586 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCC4(CC4)CC3)C[C@H]21 ZINC001441321398 1391250675 /nfs/dbraw/zinc/25/06/75/1391250675.db2.gz SPIJJVKUMSZCLT-LDLYASANSA-N 1 3 347.547 2.593 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCC4(CC4)CC3)C[C@H]21 ZINC001441321398 1391250678 /nfs/dbraw/zinc/25/06/78/1391250678.db2.gz SPIJJVKUMSZCLT-LDLYASANSA-N 1 3 347.547 2.593 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](Cc3ccsc3)C[C@@H]2C1 ZINC001441341825 1391259409 /nfs/dbraw/zinc/25/94/09/1391259409.db2.gz QEZGWCVJPCWFCT-FGTMMUONSA-N 1 3 349.544 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccsc3)C[C@@H]2C1 ZINC001441341825 1391259411 /nfs/dbraw/zinc/25/94/11/1391259411.db2.gz QEZGWCVJPCWFCT-FGTMMUONSA-N 1 3 349.544 2.805 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc3ccccc32)C1)N(C)C ZINC001441523621 1391351498 /nfs/dbraw/zinc/35/14/98/1391351498.db2.gz KHSJSRQYVNGXGF-WSTZPKSXSA-N 1 3 339.483 2.917 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@H](C)[NH2+]Cc1cc(C)sc1C)N(C)C ZINC001441548989 1391358474 /nfs/dbraw/zinc/35/84/74/1391358474.db2.gz OPFKHAOWEVIYEI-BLLLJJGKSA-N 1 3 325.522 2.642 10 0 EFAEHO Cc1cncc(CN[C@@H](C)CN(C)C(=O)[C@H](C)[NH+]2CCCCCC2)c1 ZINC001441587295 1391378650 /nfs/dbraw/zinc/37/86/50/1391378650.db2.gz NBNRNTLXJYDSQX-ROUUACIJSA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1ccc(C[NH2+]C2CCC(NC(=O)CN(C)C(C)C)CC2)cc1F ZINC001441742490 1391413010 /nfs/dbraw/zinc/41/30/10/1391413010.db2.gz XHKORMOHUSRILK-UHFFFAOYSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H]1CC[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001441904020 1391435093 /nfs/dbraw/zinc/43/50/93/1391435093.db2.gz VHZZMCYWXCXCCJ-IEBWSBKVSA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+][C@H](C)c1cc(F)ccc1F ZINC001444449565 1391492699 /nfs/dbraw/zinc/49/26/99/1391492699.db2.gz UNXJUZOCZXSGLF-UONOGXRCSA-N 1 3 341.446 2.708 10 0 EFAEHO Cc1cc(C[NH2+]C[C@]2(C)CCN(C(=O)CN3CC[C@H](C)C3)C2)cs1 ZINC001446620861 1391562325 /nfs/dbraw/zinc/56/23/25/1391562325.db2.gz XSDWPCKCFGWVNL-KXBFYZLASA-N 1 3 349.544 2.727 10 0 EFAEHO CC(C)N1Cc2ccc(CNC(=O)CC[C@H]3CCC[N@@H+]3C)cc2C1 ZINC001447497264 1391716710 /nfs/dbraw/zinc/71/67/10/1391716710.db2.gz QIMWLRMMBTXGLA-LJQANCHMSA-N 1 3 329.488 2.901 10 0 EFAEHO CC(C)N1Cc2ccc(CNC(=O)CC[C@H]3CCC[N@H+]3C)cc2C1 ZINC001447497264 1391716715 /nfs/dbraw/zinc/71/67/15/1391716715.db2.gz QIMWLRMMBTXGLA-LJQANCHMSA-N 1 3 329.488 2.901 10 0 EFAEHO C[N@H+](CCCc1ccsc1)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001447774245 1391761264 /nfs/dbraw/zinc/76/12/64/1391761264.db2.gz XEIKEIBIHFIWSE-GOSISDBHSA-N 1 3 349.544 2.699 10 0 EFAEHO C[N@@H+](CCCc1ccsc1)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001447774245 1391761268 /nfs/dbraw/zinc/76/12/68/1391761268.db2.gz XEIKEIBIHFIWSE-GOSISDBHSA-N 1 3 349.544 2.699 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCCC1)[C@@H](C)[NH2+]Cc1ccsc1 ZINC001447848078 1391779966 /nfs/dbraw/zinc/77/99/66/1391779966.db2.gz LQLBYYWEHKLIGE-HUUCEWRRSA-N 1 3 337.533 2.995 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCCC1)[C@H](C)[NH2+]Cc1ccsc1 ZINC001447848081 1391780329 /nfs/dbraw/zinc/78/03/29/1391780329.db2.gz LQLBYYWEHKLIGE-LSDHHAIUSA-N 1 3 337.533 2.995 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C1CCC([NH2+]C/C=C/Cl)CC1 ZINC001447943756 1391845836 /nfs/dbraw/zinc/84/58/36/1391845836.db2.gz CLOYHHSSYIPXJO-UWRAEBMMSA-N 1 3 341.927 2.973 10 0 EFAEHO CN(CC(C)(C)C[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)CN(C)C1CCC1 ZINC001447968773 1391864877 /nfs/dbraw/zinc/86/48/77/1391864877.db2.gz DEXOTZSPEWMHDJ-KURKYZTESA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[N@H+](C)[C@H]1CCc2ccccc21 ZINC001448036546 1391907015 /nfs/dbraw/zinc/90/70/15/1391907015.db2.gz FIYWPEOHRZHPMD-QAPCUYQASA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001448036546 1391907018 /nfs/dbraw/zinc/90/70/18/1391907018.db2.gz FIYWPEOHRZHPMD-QAPCUYQASA-N 1 3 329.488 2.595 10 0 EFAEHO COc1cccc(CN(C)[C@@H](C)CNC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001448036979 1391908652 /nfs/dbraw/zinc/90/86/52/1391908652.db2.gz HWVPPJLXRGKVQF-FUHWJXTLSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1cccc(CN(C)[C@@H](C)CNC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001448036979 1391908657 /nfs/dbraw/zinc/90/86/57/1391908657.db2.gz HWVPPJLXRGKVQF-FUHWJXTLSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]Cc1ccc(F)cc1 ZINC001448210240 1392016862 /nfs/dbraw/zinc/01/68/62/1392016862.db2.gz IJZUOYFUSPWGHQ-OALUTQOASA-N 1 3 349.494 2.883 10 0 EFAEHO COc1cccc(CN2CCCCC[C@H]2CNC(=O)CC[NH+](C)C)c1 ZINC001448270244 1392070360 /nfs/dbraw/zinc/07/03/60/1392070360.db2.gz UVJRHQJZVZFORT-SFHVURJKSA-N 1 3 347.503 2.508 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H](C1CC1)N(C)C(=O)C(C)(C)N1CCCCC1 ZINC001448580649 1392092670 /nfs/dbraw/zinc/09/26/70/1392092670.db2.gz DGSHUIKMONCTCS-IAGOWNOFSA-N 1 3 341.515 2.826 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N1C[C@@H]([NH2+]CCC(F)(F)F)C(C)(C)C1 ZINC001449056216 1392240236 /nfs/dbraw/zinc/24/02/36/1392240236.db2.gz BIUMFDHDELZUKB-UONOGXRCSA-N 1 3 349.441 2.640 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1C[C@H]([NH2+]CCC(F)(F)F)C(C)(C)C1 ZINC001449056214 1392240498 /nfs/dbraw/zinc/24/04/98/1392240498.db2.gz BIUMFDHDELZUKB-KGLIPLIRSA-N 1 3 349.441 2.640 10 0 EFAEHO CC[C@H](F)C[NH2+][C@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001449074497 1392251055 /nfs/dbraw/zinc/25/10/55/1392251055.db2.gz BYBCJJDDJZIJJU-GJZGRUSLSA-N 1 3 329.504 2.539 10 0 EFAEHO CC[C@H](F)C[NH2+][C@@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001449074503 1392251261 /nfs/dbraw/zinc/25/12/61/1392251261.db2.gz BYBCJJDDJZIJJU-LSDHHAIUSA-N 1 3 329.504 2.539 10 0 EFAEHO C[NH+](C)[C@@H]1C[C@@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C1(C)C ZINC001452129449 1392890223 /nfs/dbraw/zinc/89/02/23/1392890223.db2.gz HWJJPNACMVYULY-HZPDHXFCSA-N 1 3 328.460 2.749 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@H]1C[NH+]2CCC1CC2)NCc1ccccc1Cl ZINC001507072454 1406665161 /nfs/dbraw/zinc/66/51/61/1406665161.db2.gz HBJUSHFRMCDCGN-YOEHRIQHSA-N 1 3 349.906 2.618 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@@H](C)CN(C)C(=O)CN(C)C2CCC2)c1 ZINC001507092532 1406691148 /nfs/dbraw/zinc/69/11/48/1406691148.db2.gz YUQBGDLGMRWGRS-JKSUJKDBSA-N 1 3 347.503 2.677 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+][C@@H](C)CN(C)C(=O)Cc2c[nH]cn2)c1 ZINC001507129126 1406743005 /nfs/dbraw/zinc/74/30/05/1406743005.db2.gz NBUWOXJPUSIPFK-HOTGVXAUSA-N 1 3 328.460 2.767 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001507127535 1406740419 /nfs/dbraw/zinc/74/04/19/1406740419.db2.gz QWWCUKPATQQHTQ-MOPGFXCFSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]Cc1ccccc1C1CC1 ZINC001507160767 1406789670 /nfs/dbraw/zinc/78/96/70/1406789670.db2.gz FXEFFERBJPUFGD-INIZCTEOSA-N 1 3 331.504 2.841 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]CCc1ccc(C)cc1 ZINC001507163778 1406795048 /nfs/dbraw/zinc/79/50/48/1406795048.db2.gz VWPGZUIJHQOWIC-UYAOXDASSA-N 1 3 345.531 2.848 10 0 EFAEHO CC1CC[NH+](CC[C@@H]2CCCN2CCc2ccc(C(N)=O)cc2)CC1 ZINC001460626539 1396239285 /nfs/dbraw/zinc/23/92/85/1396239285.db2.gz MYNRUFQNZQCPQF-FQEVSTJZSA-N 1 3 343.515 2.914 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(CCN(C)C)Cc2cccc(C)c2)CC[N@@H+]1C ZINC001464796743 1396607273 /nfs/dbraw/zinc/60/72/73/1396607273.db2.gz IRFJXUSQMNEWGB-RBUKOAKNSA-N 1 3 331.504 2.616 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(CCN(C)C)Cc2cccc(C)c2)CC[N@H+]1C ZINC001464796743 1396607281 /nfs/dbraw/zinc/60/72/81/1396607281.db2.gz IRFJXUSQMNEWGB-RBUKOAKNSA-N 1 3 331.504 2.616 10 0 EFAEHO CN(C)C1(C(=O)Nc2cccc(OCCC[NH+](C)C)c2)CCCC1 ZINC001465189995 1396658345 /nfs/dbraw/zinc/65/83/45/1396658345.db2.gz FWPROHVKMGTPAB-UHFFFAOYSA-N 1 3 333.476 2.830 10 0 EFAEHO CC[NH+]1CCC(C(=O)N(C)[C@H]2CCCN(C)C2)(c2ccccc2)CC1 ZINC001465547272 1396690888 /nfs/dbraw/zinc/69/08/88/1396690888.db2.gz SMWMMLNHYSEQGK-IBGZPJMESA-N 1 3 343.515 2.593 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NCC1CCCCCC1 ZINC001470181050 1397079805 /nfs/dbraw/zinc/07/98/05/1397079805.db2.gz SUHWHVUUNDWTNP-INIZCTEOSA-N 1 3 326.529 2.528 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NCC1CCCCCC1 ZINC001470181050 1397079809 /nfs/dbraw/zinc/07/98/09/1397079809.db2.gz SUHWHVUUNDWTNP-INIZCTEOSA-N 1 3 326.529 2.528 10 0 EFAEHO CC[C@H](C)[C@@H]1CCCCN1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001470772506 1397120671 /nfs/dbraw/zinc/12/06/71/1397120671.db2.gz PYIYPAWCENJFIF-BZSNNMDCSA-N 1 3 340.556 2.869 10 0 EFAEHO CC[C@H](C)[C@@H]1CCCCN1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001470772506 1397120677 /nfs/dbraw/zinc/12/06/77/1397120677.db2.gz PYIYPAWCENJFIF-BZSNNMDCSA-N 1 3 340.556 2.869 10 0 EFAEHO CCN1CCC[C@H](NC(=O)C2(c3ccccc3)CC[NH+](CC)CC2)C1 ZINC001472022913 1397235440 /nfs/dbraw/zinc/23/54/40/1397235440.db2.gz MUTHSWBXUJEJGM-IBGZPJMESA-N 1 3 343.515 2.641 10 0 EFAEHO CC[C@@]1(C(=O)OC(C)(C)C)CCC[N@H+](C[C@@H](O)CN(C)C(C)C)C1 ZINC001473847974 1397339521 /nfs/dbraw/zinc/33/95/21/1397339521.db2.gz NLEIZZZMESYRAL-QFBILLFUSA-N 1 3 342.524 2.521 10 0 EFAEHO CC[C@@]1(C(=O)OC(C)(C)C)CCC[N@@H+](C[C@@H](O)CN(C)C(C)C)C1 ZINC001473847974 1397339526 /nfs/dbraw/zinc/33/95/26/1397339526.db2.gz NLEIZZZMESYRAL-QFBILLFUSA-N 1 3 342.524 2.521 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CC/C=C/c2ccccc2)CN1C(=O)Cc1c[nH]cn1 ZINC001507329265 1406893576 /nfs/dbraw/zinc/89/35/76/1406893576.db2.gz ZUWUWVNJFXILMV-RCCFSGOVSA-N 1 3 338.455 2.635 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@@H]2C[C@H](C)N(C(=O)CN3CCCC3)C2)c1 ZINC001507329919 1406895007 /nfs/dbraw/zinc/89/50/07/1406895007.db2.gz CZXGXJYDMPLCSW-AZUAARDMSA-N 1 3 343.515 2.602 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CC/C=C/c2ccccc2)CN1C(=O)CN1CCCC1 ZINC001507331121 1406896058 /nfs/dbraw/zinc/89/60/58/1406896058.db2.gz MOFBKMDGRIGGSI-OVHFLYOFSA-N 1 3 341.499 2.765 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@H]2C[C@@H](NCc3ccccc3Cl)C2)C1 ZINC001479336929 1397691746 /nfs/dbraw/zinc/69/17/46/1397691746.db2.gz CUZJZJYYGVDPPN-YQQAZPJKSA-N 1 3 349.906 2.666 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@H]2C[C@@H](NCc3ccccc3Cl)C2)C1 ZINC001479336929 1397691754 /nfs/dbraw/zinc/69/17/54/1397691754.db2.gz CUZJZJYYGVDPPN-YQQAZPJKSA-N 1 3 349.906 2.666 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC001479346195 1397697770 /nfs/dbraw/zinc/69/77/70/1397697770.db2.gz DKFPWBTWXVGOON-LFEHRJTNSA-N 1 3 347.478 2.683 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2=CCCCC2)C1 ZINC001479346894 1397698429 /nfs/dbraw/zinc/69/84/29/1397698429.db2.gz JCUQDJUDTGUKKF-RWQQGDIJSA-N 1 3 333.520 2.844 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1C[C@H]([NH2+][C@H]2CCc3ccccc32)C1 ZINC001479407417 1397716640 /nfs/dbraw/zinc/71/66/40/1397716640.db2.gz BZNMJLJIZWBUDA-IEZWGBDMSA-N 1 3 329.488 2.500 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+][C@H]1C[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001479416890 1397720369 /nfs/dbraw/zinc/72/03/69/1397720369.db2.gz NHDRZMQOJPKTBC-KZNAEPCWSA-N 1 3 331.504 2.881 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)[C@@H]1CC[NH2+]CCF ZINC001479520417 1397748074 /nfs/dbraw/zinc/74/80/74/1397748074.db2.gz CEDLLKRTDURFML-HZPDHXFCSA-N 1 3 329.504 2.541 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)[C@H]1CC[NH2+]CCF ZINC001479520410 1397748282 /nfs/dbraw/zinc/74/82/82/1397748282.db2.gz CEDLLKRTDURFML-CVEARBPZSA-N 1 3 329.504 2.541 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCCC[C@@H]([NH2+]CCc2ccccc2)C1 ZINC001479696015 1397767048 /nfs/dbraw/zinc/76/70/48/1397767048.db2.gz RVVGVPVVQDCCJF-HXUWFJFHSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCCC[C@H]([NH2+]CCc2ccccc2)C1 ZINC001479696014 1397767155 /nfs/dbraw/zinc/76/71/55/1397767155.db2.gz RVVGVPVVQDCCJF-FQEVSTJZSA-N 1 3 345.531 2.930 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+](C)CCCNC(=O)C2(N(C)C)CCC2)c1 ZINC001479774913 1397841011 /nfs/dbraw/zinc/84/10/11/1397841011.db2.gz MMRJTRDXKFNGNX-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1ccc(C)c(C[N@H+](C)CCCNC(=O)C2(N(C)C)CCC2)c1 ZINC001479774913 1397841013 /nfs/dbraw/zinc/84/10/13/1397841013.db2.gz MMRJTRDXKFNGNX-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C)cc1F ZINC001479777608 1397846124 /nfs/dbraw/zinc/84/61/24/1397846124.db2.gz WHFOPIDYFZTELB-SFHVURJKSA-N 1 3 337.483 2.658 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C)cc1F ZINC001479777608 1397846133 /nfs/dbraw/zinc/84/61/33/1397846133.db2.gz WHFOPIDYFZTELB-SFHVURJKSA-N 1 3 337.483 2.658 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)C[C@H]1CCc2ccccc2C1)N(C)C ZINC001479797173 1397877585 /nfs/dbraw/zinc/87/75/85/1397877585.db2.gz VKYYHJFLHUDDCC-PXNSSMCTSA-N 1 3 345.531 2.570 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)C[C@H]1CCc2ccccc2C1)N(C)C ZINC001479797173 1397877589 /nfs/dbraw/zinc/87/75/89/1397877589.db2.gz VKYYHJFLHUDDCC-PXNSSMCTSA-N 1 3 345.531 2.570 10 0 EFAEHO CC[N@H+](CCCNC(=O)Cc1nc[nH]c1C)[C@@H](C)c1ccc(F)cc1 ZINC001479859502 1397962145 /nfs/dbraw/zinc/96/21/45/1397962145.db2.gz OGGSALXXMCCDFO-HNNXBMFYSA-N 1 3 346.450 2.989 10 0 EFAEHO CC[N@@H+](CCCNC(=O)Cc1nc[nH]c1C)[C@@H](C)c1ccc(F)cc1 ZINC001479859502 1397962146 /nfs/dbraw/zinc/96/21/46/1397962146.db2.gz OGGSALXXMCCDFO-HNNXBMFYSA-N 1 3 346.450 2.989 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@@H]1CCCN(CCc2ccccc2)C1 ZINC001479912840 1398018173 /nfs/dbraw/zinc/01/81/73/1398018173.db2.gz DBAAQBCNISXSPE-LJQANCHMSA-N 1 3 331.504 2.542 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(C[C@@H]2NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001479984718 1398069714 /nfs/dbraw/zinc/06/97/14/1398069714.db2.gz HJVRXCMYRXORTH-MZIIKBMYSA-N 1 3 335.536 2.900 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1ccc(F)cc1)C1CC1 ZINC001480023612 1398099855 /nfs/dbraw/zinc/09/98/55/1398099855.db2.gz GQBZOANEXQKDQX-RBUKOAKNSA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]CC/C=C\c2ccccc2)C1 ZINC001480173202 1398142388 /nfs/dbraw/zinc/14/23/88/1398142388.db2.gz BGEPTOUPKKZKJR-HZRZEWQQSA-N 1 3 329.488 2.667 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H](C)CNC(=O)[C@@H]1CCCCN1C(C)C ZINC001480547712 1398201248 /nfs/dbraw/zinc/20/12/48/1398201248.db2.gz DIOXJAFMGPQLKJ-APWZRJJASA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](C[NH2+]CCCC2CCCC2)C1)N(C)C ZINC001480664283 1398271358 /nfs/dbraw/zinc/27/13/58/1398271358.db2.gz XKBYNRQEJAPWHY-RBUKOAKNSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1C(=O)N1CC[C@@H](CNC/C(Cl)=C\Cl)C1 ZINC001480681324 1398279834 /nfs/dbraw/zinc/27/98/34/1398279834.db2.gz YPTRJYIWKDDYTO-FBLKXBDISA-N 1 3 348.318 2.618 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1C(=O)N1CC[C@@H](CNC/C(Cl)=C\Cl)C1 ZINC001480681324 1398279837 /nfs/dbraw/zinc/27/98/37/1398279837.db2.gz YPTRJYIWKDDYTO-FBLKXBDISA-N 1 3 348.318 2.618 10 0 EFAEHO CCCCC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@@H]21 ZINC001507358034 1406947281 /nfs/dbraw/zinc/94/72/81/1406947281.db2.gz RKGMGYNEDFKRAL-FGTMMUONSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)[C@@H]1CCc2c1cccc2F ZINC001493042340 1398386160 /nfs/dbraw/zinc/38/61/60/1398386160.db2.gz BTGSRTAYWDGHNL-HNAYVOBHSA-N 1 3 347.478 2.593 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)[C@@H]1CCc2c1cccc2F ZINC001493042340 1398386169 /nfs/dbraw/zinc/38/61/69/1398386169.db2.gz BTGSRTAYWDGHNL-HNAYVOBHSA-N 1 3 347.478 2.593 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N1CCC[C@H]1CNC(=O)CC[NH+](C)C ZINC001493134448 1398468822 /nfs/dbraw/zinc/46/88/22/1398468822.db2.gz WKZJNLJVXYYLJE-ROUUACIJSA-N 1 3 335.467 2.809 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1CCC[N@H+]1CC1CC(F)(F)C1)N(CC)CC ZINC001493136812 1398472171 /nfs/dbraw/zinc/47/21/71/1398472171.db2.gz UVNUVCBTHCRNDR-HOTGVXAUSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1CCC[N@@H+]1CC1CC(F)(F)C1)N(CC)CC ZINC001493136812 1398472167 /nfs/dbraw/zinc/47/21/67/1398472167.db2.gz UVNUVCBTHCRNDR-HOTGVXAUSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[N@@H+](CC[C@H](C)F)C1CC1 ZINC001493424699 1398696960 /nfs/dbraw/zinc/69/69/60/1398696960.db2.gz VJWSRQHYUFDDRG-DOTOQJQBSA-N 1 3 327.488 2.578 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[N@H+](CC[C@H](C)F)C1CC1 ZINC001493424699 1398696965 /nfs/dbraw/zinc/69/69/65/1398696965.db2.gz VJWSRQHYUFDDRG-DOTOQJQBSA-N 1 3 327.488 2.578 10 0 EFAEHO C[C@H](NCCN(C)C(=O)CC[C@@H]1CCC[N@@H+]1C)c1ccccc1F ZINC001493583240 1398762284 /nfs/dbraw/zinc/76/22/84/1398762284.db2.gz GMUZQIVCJOFVKX-HOTGVXAUSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@H](NCCN(C)C(=O)CC[C@@H]1CCC[N@H+]1C)c1ccccc1F ZINC001493583240 1398762288 /nfs/dbraw/zinc/76/22/88/1398762288.db2.gz GMUZQIVCJOFVKX-HOTGVXAUSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)CC[C@H]1CCC[N@@H+]1C)c1ccccc1F ZINC001493583242 1398762342 /nfs/dbraw/zinc/76/23/42/1398762342.db2.gz GMUZQIVCJOFVKX-HZPDHXFCSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)CC[C@H]1CCC[N@H+]1C)c1ccccc1F ZINC001493583242 1398762346 /nfs/dbraw/zinc/76/23/46/1398762346.db2.gz GMUZQIVCJOFVKX-HZPDHXFCSA-N 1 3 335.467 2.809 10 0 EFAEHO CN(CCNC/C=C/Cl)C(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001493670512 1398797342 /nfs/dbraw/zinc/79/73/42/1398797342.db2.gz PUSCZJDKZRWTRE-DHINHOHASA-N 1 3 327.900 2.584 10 0 EFAEHO CN(CCNC/C=C/Cl)C(=O)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001493670512 1398797347 /nfs/dbraw/zinc/79/73/47/1398797347.db2.gz PUSCZJDKZRWTRE-DHINHOHASA-N 1 3 327.900 2.584 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]CCN(C)C(=O)CN(C)CC(C)(C)C)c1 ZINC001493695192 1398814964 /nfs/dbraw/zinc/81/49/64/1398814964.db2.gz FKAFFPQPCVTNJB-MRXNPFEDSA-N 1 3 349.519 2.782 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc2cc[nH]c2c1 ZINC001507382370 1406989535 /nfs/dbraw/zinc/98/95/35/1406989535.db2.gz KVCIMLFSCLFMEI-CRAIPNDOSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@H]1[C@@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc2cc[nH]c2c1 ZINC001507382377 1406989585 /nfs/dbraw/zinc/98/95/85/1406989585.db2.gz KVCIMLFSCLFMEI-YJBOKZPZSA-N 1 3 342.487 2.589 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1C[C@H]2CC[C@@H](C1)[N@H+]2CCCC(C)C ZINC001493915596 1398975441 /nfs/dbraw/zinc/97/54/41/1398975441.db2.gz MCXHEIUQHSVZNE-KSZLIROESA-N 1 3 341.515 2.778 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCC(C)C ZINC001493915596 1398975443 /nfs/dbraw/zinc/97/54/43/1398975443.db2.gz MCXHEIUQHSVZNE-KSZLIROESA-N 1 3 341.515 2.778 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)C(C)(C)[NH+]3CCCC3)C2)c(C)c1 ZINC001494575643 1399385172 /nfs/dbraw/zinc/38/51/72/1399385172.db2.gz AUYWFUUNHFFQKC-UHFFFAOYSA-N 1 3 343.515 2.726 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1C[NH+](CC2CCCCCC2)C1 ZINC001494633477 1399408242 /nfs/dbraw/zinc/40/82/42/1399408242.db2.gz QIDXRHBUPQRMKT-CALCHBBNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1)N(C)C ZINC001494710312 1399439176 /nfs/dbraw/zinc/43/91/76/1399439176.db2.gz VGGFELQNXRIICH-PMPSAXMXSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CC[C@H]2CCCC2(F)F)C1)N(C)C ZINC001494710312 1399439178 /nfs/dbraw/zinc/43/91/78/1399439178.db2.gz VGGFELQNXRIICH-PMPSAXMXSA-N 1 3 345.478 2.589 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CC[C@H](C[NH2+]CCCC2CCC2)C1 ZINC001507418147 1407032044 /nfs/dbraw/zinc/03/20/44/1407032044.db2.gz BSYUPUMXVOZXIM-IRXDYDNUSA-N 1 3 332.492 2.715 10 0 EFAEHO CCN(C(=O)CC[C@@H]1CCC[N@@H+]1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC001494907182 1399546592 /nfs/dbraw/zinc/54/65/92/1399546592.db2.gz XKBPUBYLRWNKTL-PMACEKPBSA-N 1 3 343.515 2.984 10 0 EFAEHO CCN(C(=O)CC[C@@H]1CCC[N@H+]1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC001494907182 1399546595 /nfs/dbraw/zinc/54/65/95/1399546595.db2.gz XKBPUBYLRWNKTL-PMACEKPBSA-N 1 3 343.515 2.984 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)[NH+]1CCCC1)NCc1ccccc1F ZINC001495033181 1399614726 /nfs/dbraw/zinc/61/47/26/1399614726.db2.gz BAEUXGXGBNNFNI-MRXNPFEDSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCc1ccccc1F ZINC001495037630 1399618117 /nfs/dbraw/zinc/61/81/17/1399618117.db2.gz ZRNDYPBUIOYBKD-QGZVFWFLSA-N 1 3 349.494 2.727 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H]2CC[C@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001507428325 1407042264 /nfs/dbraw/zinc/04/22/64/1407042264.db2.gz OSMNGBUSDDMBQQ-PMACEKPBSA-N 1 3 345.531 2.752 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001495147300 1399699826 /nfs/dbraw/zinc/69/98/26/1399699826.db2.gz XNQOJHOHAZDKKZ-AWEZNQCLSA-N 1 3 343.874 2.804 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N1C[C@H]([NH2+]CCCCCF)C(C)(C)C1 ZINC001507435001 1407049449 /nfs/dbraw/zinc/04/94/49/1407049449.db2.gz IIKAYPHJYWQPLP-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@](C)(C[NH2+]Cc2ccc(F)cc2)C2CC2)C1 ZINC001495275878 1399785637 /nfs/dbraw/zinc/78/56/37/1399785637.db2.gz DEKSPUBKZKMEMS-MGPUTAFESA-N 1 3 347.478 2.542 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@](C)(C[NH2+]CC2=CCCCC2)C2CC2)C1 ZINC001495278541 1399787930 /nfs/dbraw/zinc/78/79/30/1399787930.db2.gz WHTIFCKWHXGDRU-OXQOHEQNSA-N 1 3 333.520 2.703 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2C[C@@H]([NH2+]CCCC3CCC3)C(C)(C)C2)C1 ZINC001507446410 1407062465 /nfs/dbraw/zinc/06/24/65/1407062465.db2.gz VHQPVEHRAZLCOH-FUHWJXTLSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2C[C@H]([NH2+]CCCC3CCC3)C(C)(C)C2)C1 ZINC001507446412 1407062696 /nfs/dbraw/zinc/06/26/96/1407062696.db2.gz VHQPVEHRAZLCOH-WMZOPIPTSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H](CC[NH2+]C/C=C\Cl)C1)N(C)C ZINC001495381055 1399927047 /nfs/dbraw/zinc/92/70/47/1399927047.db2.gz RLPHDDGEGIARQK-HPRJGHKQSA-N 1 3 329.916 2.543 10 0 EFAEHO CC1(C)CC(C[NH2+]CC[C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001495385814 1399931645 /nfs/dbraw/zinc/93/16/45/1399931645.db2.gz HWWXXCJZDDQICS-OAHLLOKOSA-N 1 3 332.492 2.607 10 0 EFAEHO CC(C)C[NH2+]Cc1ccc(CNC(=O)CN2[C@H](C)CC[C@@H]2C)cc1 ZINC001495508981 1400041447 /nfs/dbraw/zinc/04/14/47/1400041447.db2.gz LDWKENXIZNVDSD-CALCHBBNSA-N 1 3 331.504 2.921 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC2(C1)CCN(C(=O)CN(C)C(C)C)CC2 ZINC001495604983 1400114654 /nfs/dbraw/zinc/11/46/54/1400114654.db2.gz CKVLCPPDOSXRLQ-VOTSOKGWSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC2(C1)CCN(C(=O)CN(C)C(C)C)CC2 ZINC001495604983 1400114659 /nfs/dbraw/zinc/11/46/59/1400114659.db2.gz CKVLCPPDOSXRLQ-VOTSOKGWSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)C[NH2+]CCc1cccs1 ZINC001495670156 1400155071 /nfs/dbraw/zinc/15/50/71/1400155071.db2.gz YFMMUZUDZBDNJH-DOTOQJQBSA-N 1 3 337.533 2.505 10 0 EFAEHO C[C@H](C[NH2+]CC1CC(C)(C)C1)N(C)C(=O)CN(C)CC(C)(C)C ZINC001496153320 1400505562 /nfs/dbraw/zinc/50/55/62/1400505562.db2.gz HCRVQSRAMHSDBW-OAHLLOKOSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@@H](C[NH2+]CCc1ccccc1)N(C)C(=O)CN(C)CC(C)(C)C ZINC001496154041 1400506622 /nfs/dbraw/zinc/50/66/22/1400506622.db2.gz LYVPJJIBHOPOKV-KRWDZBQOSA-N 1 3 333.520 2.644 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001496156423 1400507948 /nfs/dbraw/zinc/50/79/48/1400507948.db2.gz YCKJUQQSDYPBAO-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@@H](NC[C@H](C)N(C)C(=O)C12CC[NH+](CC1)C2)c1ccccc1Cl ZINC001496207539 1400539946 /nfs/dbraw/zinc/53/99/46/1400539946.db2.gz QNFMTGRYSBRQJF-LSDHHAIUSA-N 1 3 349.906 2.933 10 0 EFAEHO CC(C)Oc1cccc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CCCC2)c1 ZINC001496229499 1400555610 /nfs/dbraw/zinc/55/56/10/1400555610.db2.gz ISDSVBHZOGCDEU-KRWDZBQOSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)C[C@@H](CNCc1ccccc1F)NC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001496300783 1400616762 /nfs/dbraw/zinc/61/67/62/1400616762.db2.gz NWLLUHZCJNHGQU-WMZOPIPTSA-N 1 3 349.494 2.788 10 0 EFAEHO CC(C)C[C@@H](CNCc1ccccc1F)NC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001496300783 1400616769 /nfs/dbraw/zinc/61/67/69/1400616769.db2.gz NWLLUHZCJNHGQU-WMZOPIPTSA-N 1 3 349.494 2.788 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]Cc1cccnc1)C1CCCCC1 ZINC001496327296 1400643366 /nfs/dbraw/zinc/64/33/66/1400643366.db2.gz SDWJZPBZXTWEPT-IBGZPJMESA-N 1 3 346.519 2.577 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]C/C=C\Cl)C1CCCCC1 ZINC001496328706 1400644030 /nfs/dbraw/zinc/64/40/30/1400644030.db2.gz ZTGWNJLFHWVYJC-BJIFSAINSA-N 1 3 329.916 2.734 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]CCc1ccccc1 ZINC001496390179 1400698457 /nfs/dbraw/zinc/69/84/57/1400698457.db2.gz UCDDBPXAURTCJR-UXHICEINSA-N 1 3 343.515 2.684 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@H]1CC[NH2+]CC1=CCCCC1 ZINC001496410044 1400712081 /nfs/dbraw/zinc/71/20/81/1400712081.db2.gz AHLGRVSECONAMS-SFHVURJKSA-N 1 3 330.476 2.813 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1CC[NH2+]Cc1cncc(C)c1 ZINC001496418955 1400720845 /nfs/dbraw/zinc/72/08/45/1400720845.db2.gz MEJHLDGFTGGZOJ-IBGZPJMESA-N 1 3 346.519 2.593 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1CC[NH2+]CC1CC(F)(F)C1 ZINC001496430679 1400726193 /nfs/dbraw/zinc/72/61/93/1400726193.db2.gz VBPCLOAXENSUPO-MRXNPFEDSA-N 1 3 345.478 2.733 10 0 EFAEHO CC/C=C\CC[N@H+](C)CCC1CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001496508126 1400782914 /nfs/dbraw/zinc/78/29/14/1400782914.db2.gz GTRXJFWTMDVSAN-PLNGDYQASA-N 1 3 332.492 2.869 10 0 EFAEHO CC/C=C\CC[N@@H+](C)CCC1CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001496508126 1400782918 /nfs/dbraw/zinc/78/29/18/1400782918.db2.gz GTRXJFWTMDVSAN-PLNGDYQASA-N 1 3 332.492 2.869 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(CC[N@H+](C)CC2CC(C)C2)CC1 ZINC001496513188 1400788244 /nfs/dbraw/zinc/78/82/44/1400788244.db2.gz IULPUAVYSBDPNR-UHFFFAOYSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(CC[N@@H+](C)CC2CC(C)C2)CC1 ZINC001496513188 1400788249 /nfs/dbraw/zinc/78/82/49/1400788249.db2.gz IULPUAVYSBDPNR-UHFFFAOYSA-N 1 3 337.552 2.933 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1cccc(F)c1)C(C)C ZINC001496565127 1400831991 /nfs/dbraw/zinc/83/19/91/1400831991.db2.gz HSLPIKCPAVNULW-MOPGFXCFSA-N 1 3 349.494 2.931 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1ccsc1)C(C)C ZINC001496567604 1400833201 /nfs/dbraw/zinc/83/32/01/1400833201.db2.gz SMGNWNLQRIXCFY-DLBZAZTESA-N 1 3 337.533 2.853 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]([NH2+][C@H]1CCc2ccccc21)C(C)C ZINC001496626222 1400880202 /nfs/dbraw/zinc/88/02/02/1400880202.db2.gz FOONQJOIEDWLFR-RBUKOAKNSA-N 1 3 331.504 2.746 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)cc1 ZINC001496730494 1400946331 /nfs/dbraw/zinc/94/63/31/1400946331.db2.gz HFPNZFMGUVRBCK-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)cc1 ZINC001496730494 1400946337 /nfs/dbraw/zinc/94/63/37/1400946337.db2.gz HFPNZFMGUVRBCK-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21)CC1=CCCCC1 ZINC001496731316 1400946924 /nfs/dbraw/zinc/94/69/24/1400946924.db2.gz OBHCXWGYKBLUML-RTBURBONSA-N 1 3 333.520 2.894 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CC[C@H]2CCCC[N@H+]21)CC1=CCCCC1 ZINC001496731316 1400946928 /nfs/dbraw/zinc/94/69/28/1400946928.db2.gz OBHCXWGYKBLUML-RTBURBONSA-N 1 3 333.520 2.894 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21)CC1=CCCCC1 ZINC001496731310 1400947614 /nfs/dbraw/zinc/94/76/14/1400947614.db2.gz OBHCXWGYKBLUML-MOPGFXCFSA-N 1 3 333.520 2.894 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21)CC1=CCCCC1 ZINC001496731310 1400947615 /nfs/dbraw/zinc/94/76/15/1400947615.db2.gz OBHCXWGYKBLUML-MOPGFXCFSA-N 1 3 333.520 2.894 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N(C)CCN(C)Cc1ccc(CF)cc1 ZINC001496841332 1401030573 /nfs/dbraw/zinc/03/05/73/1401030573.db2.gz FFUCAQRXQRFPRQ-CALCHBBNSA-N 1 3 349.494 2.919 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N(C)CCN(C)Cc1ccc(CF)cc1 ZINC001496841332 1401030579 /nfs/dbraw/zinc/03/05/79/1401030579.db2.gz FFUCAQRXQRFPRQ-CALCHBBNSA-N 1 3 349.494 2.919 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2CC2=CCCCC2)C1 ZINC001496864696 1401059663 /nfs/dbraw/zinc/05/96/63/1401059663.db2.gz AGMBSWQPDNCKBO-MOPGFXCFSA-N 1 3 333.520 2.750 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2CC2=CCCCC2)C1 ZINC001496864696 1401059668 /nfs/dbraw/zinc/05/96/68/1401059668.db2.gz AGMBSWQPDNCKBO-MOPGFXCFSA-N 1 3 333.520 2.750 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]1C[NH2+]CCc1cccs1 ZINC001496922761 1401103868 /nfs/dbraw/zinc/10/38/68/1401103868.db2.gz JYKVFNBXVVJACH-WBVHZDCISA-N 1 3 337.533 2.505 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]CCc1ccccc1F ZINC001497186268 1401206639 /nfs/dbraw/zinc/20/66/39/1401206639.db2.gz LICJSXBPDPCCNK-QFBILLFUSA-N 1 3 349.494 2.725 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H](C)NC(=O)[C@@H](C(C)C)N(C)C)c(C)c1 ZINC001497261138 1401254032 /nfs/dbraw/zinc/25/40/32/1401254032.db2.gz BHEKOAATLYURQG-IEBWSBKVSA-N 1 3 333.520 2.874 10 0 EFAEHO CC[C@@H](F)CNCCN(CC)C(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001497394404 1401346699 /nfs/dbraw/zinc/34/66/99/1401346699.db2.gz OYYMQPIQHRRRLZ-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](F)CNCCN(CC)C(=O)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001497394404 1401346703 /nfs/dbraw/zinc/34/67/03/1401346703.db2.gz OYYMQPIQHRRRLZ-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CC[NH2+]CC1CCC2(CC2)CC1)C(=O)C1(N(C)C)CCC1 ZINC001497400717 1401348174 /nfs/dbraw/zinc/34/81/74/1401348174.db2.gz JPIRVXMKVZYGGG-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H](C(=O)N(CC)CC[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001497455396 1401388172 /nfs/dbraw/zinc/38/81/72/1401388172.db2.gz QDPXGRRDBADARS-INIZCTEOSA-N 1 3 325.884 2.618 10 0 EFAEHO CCN(CCNCc1cccnc1C)C(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC001497464408 1401396107 /nfs/dbraw/zinc/39/61/07/1401396107.db2.gz MVRSFWSRNJOWBT-GOSISDBHSA-N 1 3 346.519 2.593 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\C[NH2+][C@H]1CCc2ccccc21)N(C)C ZINC001497672771 1401539069 /nfs/dbraw/zinc/53/90/69/1401539069.db2.gz VFFVXHVCIZLHCY-AWTIPJNISA-N 1 3 329.488 2.522 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/CN[C@H](C)c1cccc(F)c1)[NH+](C)C ZINC001497673271 1401540282 /nfs/dbraw/zinc/54/02/82/1401540282.db2.gz XIOOWNBFFHJFTR-YOBDTOFLSA-N 1 3 335.467 2.735 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC/C=C\C[NH2+]CC[C@@H]1CCC[C@H](C)C1 ZINC001497734865 1401594517 /nfs/dbraw/zinc/59/45/17/1401594517.db2.gz SXPZFTHGUKERLV-AAAUKVELSA-N 1 3 332.492 2.739 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1cc2ccccc2o1 ZINC001497815580 1401671152 /nfs/dbraw/zinc/67/11/52/1401671152.db2.gz BNALZIQUPGHRQV-CRAIPNDOSA-N 1 3 343.471 2.900 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1cc2ccccc2o1 ZINC001497815580 1401671155 /nfs/dbraw/zinc/67/11/55/1401671155.db2.gz BNALZIQUPGHRQV-CRAIPNDOSA-N 1 3 343.471 2.900 10 0 EFAEHO C[C@H](C[NH2+]C/C=C/c1ccc(Cl)cc1)NC(=O)CN(C)C1CCC1 ZINC001497830154 1401683596 /nfs/dbraw/zinc/68/35/96/1401683596.db2.gz WLASHHKNVHYFPW-MBVDDHJVSA-N 1 3 349.906 2.932 10 0 EFAEHO C[C@H](C[NH2+]Cc1cccc(C(F)F)c1)NC(=O)CN1CC[C@H](C)C1 ZINC001497910758 1401734993 /nfs/dbraw/zinc/73/49/93/1401734993.db2.gz OSZMLJVNXISEDA-UONOGXRCSA-N 1 3 339.430 2.560 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@@H]2CCCC[N@@H+]2C(C)C)c1 ZINC001497926930 1401746145 /nfs/dbraw/zinc/74/61/45/1401746145.db2.gz NYPPZWLGDXTCAR-APWZRJJASA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@@H]2CCCC[N@H+]2C(C)C)c1 ZINC001497926930 1401746148 /nfs/dbraw/zinc/74/61/48/1401746148.db2.gz NYPPZWLGDXTCAR-APWZRJJASA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)NC(=O)CC2CC[NH+](C)CC2)n1 ZINC001497927297 1401746935 /nfs/dbraw/zinc/74/69/35/1401746935.db2.gz USMAMOFMUPHRQH-MRXNPFEDSA-N 1 3 346.519 2.531 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](C)NC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001497963468 1401778244 /nfs/dbraw/zinc/77/82/44/1401778244.db2.gz WDQCQLHEUSIOFK-CABCVRRESA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](C)NC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001497963468 1401778249 /nfs/dbraw/zinc/77/82/49/1401778249.db2.gz WDQCQLHEUSIOFK-CABCVRRESA-N 1 3 337.895 2.585 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(C)c(C)c1 ZINC001497992927 1401798306 /nfs/dbraw/zinc/79/83/06/1401798306.db2.gz JGKINPIIGSREAO-MJGOQNOKSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CCCCC(F)(F)F ZINC001498041725 1401825523 /nfs/dbraw/zinc/82/55/23/1401825523.db2.gz FLORYTPWEWLJAY-KBPBESRZSA-N 1 3 337.430 2.686 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)NC(=O)C(C)(C)N2CCCCC2)c(C)n1 ZINC001498044340 1401826684 /nfs/dbraw/zinc/82/66/84/1401826684.db2.gz TVXSPGTXKJNJHI-INIZCTEOSA-N 1 3 346.519 2.557 10 0 EFAEHO C[C@@H](NC[C@H](C)NC(=O)C(C)(C)[NH+]1CCCC1)c1ccccc1F ZINC001498087581 1401850454 /nfs/dbraw/zinc/85/04/54/1401850454.db2.gz REZLUKUTSDCWRJ-LSDHHAIUSA-N 1 3 335.467 2.855 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)C2CC[NH+](C(C)C)CC2)c1 ZINC001498151808 1401879910 /nfs/dbraw/zinc/87/99/10/1401879910.db2.gz QLXRKFSAJPMPAH-INIZCTEOSA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1C1CC1)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001498289456 1401979403 /nfs/dbraw/zinc/97/94/03/1401979403.db2.gz RZANSSZFNOPTKG-GPMSIDNRSA-N 1 3 343.515 2.841 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1C1CC1)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001498289456 1401979409 /nfs/dbraw/zinc/97/94/09/1401979409.db2.gz RZANSSZFNOPTKG-GPMSIDNRSA-N 1 3 343.515 2.841 10 0 EFAEHO Cc1cccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001498365156 1402040374 /nfs/dbraw/zinc/04/03/74/1402040374.db2.gz BAUKILXFRPPCMH-AOIWGVFYSA-N 1 3 331.504 2.662 10 0 EFAEHO Cc1cccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001498365156 1402040381 /nfs/dbraw/zinc/04/03/81/1402040381.db2.gz BAUKILXFRPPCMH-AOIWGVFYSA-N 1 3 331.504 2.662 10 0 EFAEHO C[C@H](C[N@H+](C)Cc1ccc(Cl)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001498381316 1402054784 /nfs/dbraw/zinc/05/47/84/1402054784.db2.gz OKHGRSCDEOLTOQ-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](C[N@@H+](C)Cc1ccc(Cl)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001498381316 1402054787 /nfs/dbraw/zinc/05/47/87/1402054787.db2.gz OKHGRSCDEOLTOQ-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)Cc1ccc(F)cc1C ZINC001498455743 1402118159 /nfs/dbraw/zinc/11/81/59/1402118159.db2.gz JTWFCYRTHDKLOQ-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc(F)cc1C ZINC001498455743 1402118162 /nfs/dbraw/zinc/11/81/62/1402118162.db2.gz JTWFCYRTHDKLOQ-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCCC[C@H]1C[NH2+]CCC(F)(F)F ZINC001498505882 1402151159 /nfs/dbraw/zinc/15/11/59/1402151159.db2.gz UZZXZWDRZRCHPH-UONOGXRCSA-N 1 3 337.430 2.544 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]CC1=CCCCC1)C1CC1 ZINC001498770052 1402278439 /nfs/dbraw/zinc/27/84/39/1402278439.db2.gz OXMIZFNCFCZHRO-RBUKOAKNSA-N 1 3 333.520 2.846 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]CC1=CCCCC1)C1CC1 ZINC001498770053 1402278693 /nfs/dbraw/zinc/27/86/93/1402278693.db2.gz OXMIZFNCFCZHRO-RTBURBONSA-N 1 3 333.520 2.846 10 0 EFAEHO CC(C)(C(=O)N[C@@H](CNCC=C(Cl)Cl)C1CC1)[NH+]1CCCC1 ZINC001498801493 1402299382 /nfs/dbraw/zinc/29/93/82/1402299382.db2.gz HNTNXKUXVDIUED-ZDUSSCGKSA-N 1 3 348.318 2.664 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]CC1CC(C)(C)C1 ZINC001498906615 1402372681 /nfs/dbraw/zinc/37/26/81/1402372681.db2.gz HOFKOOJZDRQAED-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCC1(NC/C=C/c2ccccc2)CC1 ZINC001499253390 1402539008 /nfs/dbraw/zinc/53/90/08/1402539008.db2.gz BYKODIFKQHSCFN-NTPDMAOXSA-N 1 3 341.499 2.813 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCC1(NC/C=C/c2ccccc2)CC1 ZINC001499253390 1402539012 /nfs/dbraw/zinc/53/90/12/1402539012.db2.gz BYKODIFKQHSCFN-NTPDMAOXSA-N 1 3 341.499 2.813 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NCC2(NCc3ccc(C4CCC4)cc3)CC2)C1 ZINC001499448569 1402619094 /nfs/dbraw/zinc/61/90/94/1402619094.db2.gz MOAGSVCNEMOXIK-LJQANCHMSA-N 1 3 341.499 2.644 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NCC2(NCc3ccc(C4CCC4)cc3)CC2)C1 ZINC001499448569 1402619098 /nfs/dbraw/zinc/61/90/98/1402619098.db2.gz MOAGSVCNEMOXIK-LJQANCHMSA-N 1 3 341.499 2.644 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H](C(C)C)[NH+]3CCCC3)CC2)cs1 ZINC001499459066 1402624077 /nfs/dbraw/zinc/62/40/77/1402624077.db2.gz TXYLBHJHXDSWHO-KRWDZBQOSA-N 1 3 349.544 2.915 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@@H]3C)CC2)c1 ZINC001499461426 1402624519 /nfs/dbraw/zinc/62/45/19/1402624519.db2.gz IITSVSLZLLFNIV-HDICACEKSA-N 1 3 343.515 2.915 10 0 EFAEHO Cc1ccc(CC[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@@H]3C)CC2)cc1 ZINC001499462110 1402625324 /nfs/dbraw/zinc/62/53/24/1402625324.db2.gz YXZXWLISNMNMNA-HDICACEKSA-N 1 3 343.515 2.649 10 0 EFAEHO CC[C@H](F)CN1CCC([C@@H](C)NC(=O)CC[NH+]2CCCCC2)CC1 ZINC001508068992 1407278743 /nfs/dbraw/zinc/27/87/43/1407278743.db2.gz JSMQPICWSACXMF-AEFFLSMTSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CCCc2ccccc2)CCN1C(=O)Cc1c[nH]cn1 ZINC001499849670 1402817810 /nfs/dbraw/zinc/81/78/10/1402817810.db2.gz VIMHZLJFHVJLRZ-WMZOPIPTSA-N 1 3 340.471 2.554 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[NH2+]C/C=C/c1ccccc1)N(C)C ZINC001499904811 1402847655 /nfs/dbraw/zinc/84/76/55/1402847655.db2.gz RIAZBNUUPWMNLS-AFCAKZNGSA-N 1 3 329.488 2.621 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@H](C(F)(F)F)[C@H](NCC=C(C)C)C1 ZINC001508087684 1407291185 /nfs/dbraw/zinc/29/11/85/1407291185.db2.gz QQVBNUCRYUQZNR-LSDHHAIUSA-N 1 3 349.441 2.663 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@H](C(F)(F)F)[C@H](NCC=C(C)C)C1 ZINC001508087684 1407291190 /nfs/dbraw/zinc/29/11/90/1407291190.db2.gz QQVBNUCRYUQZNR-LSDHHAIUSA-N 1 3 349.441 2.663 10 0 EFAEHO CC[NH2+]C[C@@H](NC(=O)CN1CC[C@H](C)C1)c1ccc2ccccc2c1 ZINC001500060854 1402918609 /nfs/dbraw/zinc/91/86/09/1402918609.db2.gz WKGSSVLVTCSTER-OXJNMPFZSA-N 1 3 339.483 2.948 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@]2(CC[N@H+](CCC3CC3)C2)C1 ZINC001500163768 1402963227 /nfs/dbraw/zinc/96/32/27/1402963227.db2.gz XBJYHXMHULSUHO-HXUWFJFHSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@]2(CC[N@@H+](CCC3CC3)C2)C1 ZINC001500163768 1402963231 /nfs/dbraw/zinc/96/32/31/1402963231.db2.gz XBJYHXMHULSUHO-HXUWFJFHSA-N 1 3 335.536 2.833 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCC1(C)CCN(C/C=C\Cl)CC1 ZINC001500431180 1403117827 /nfs/dbraw/zinc/11/78/27/1403117827.db2.gz MQWRCFVWGYWXHA-FIRRRZPPSA-N 1 3 341.927 2.832 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCC1(C)CCN(C/C=C\Cl)CC1 ZINC001500431180 1403117828 /nfs/dbraw/zinc/11/78/28/1403117828.db2.gz MQWRCFVWGYWXHA-FIRRRZPPSA-N 1 3 341.927 2.832 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001500621382 1403255174 /nfs/dbraw/zinc/25/51/74/1403255174.db2.gz VAKRJUVRUJBARH-HNNXBMFYSA-N 1 3 333.467 2.590 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001500621382 1403255180 /nfs/dbraw/zinc/25/51/80/1403255180.db2.gz VAKRJUVRUJBARH-HNNXBMFYSA-N 1 3 333.467 2.590 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)N[C@@H]1C[C@H]2C[C@@H](C1)N(C/C=C/Cl)C2 ZINC001501013260 1403404653 /nfs/dbraw/zinc/40/46/53/1403404653.db2.gz LJKJLJBYSVYRFG-PTCOBTGCSA-N 1 3 339.911 2.584 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)N[C@H]1C[C@H]2C[C@@H](C1)N(C/C=C/Cl)C2 ZINC001501013259 1403404734 /nfs/dbraw/zinc/40/47/34/1403404734.db2.gz LJKJLJBYSVYRFG-DWAHBXKPSA-N 1 3 339.911 2.584 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@@H]2[C@@H]1CC[N@@H+]2CC=C(C)C ZINC001501390245 1403581708 /nfs/dbraw/zinc/58/17/08/1403581708.db2.gz HVWOVLQAKOKCDK-KSZLIROESA-N 1 3 339.499 2.698 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@@H]2[C@@H]1CC[N@H+]2CC=C(C)C ZINC001501390245 1403581714 /nfs/dbraw/zinc/58/17/14/1403581714.db2.gz HVWOVLQAKOKCDK-KSZLIROESA-N 1 3 339.499 2.698 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@H]2CCN(C(=O)CN(C)C3CCC3)C2)c1 ZINC001501578143 1403634640 /nfs/dbraw/zinc/63/46/40/1403634640.db2.gz HXDUMWKQEVKBLG-SFHVURJKSA-N 1 3 343.515 2.808 10 0 EFAEHO C[C@@H]([NH2+]CC[C@H]1CCN(C(=O)CN2CCCC2)C1)c1ccccc1 ZINC001501647087 1403665096 /nfs/dbraw/zinc/66/50/96/1403665096.db2.gz BMKFAKVPKQBWFE-MSOLQXFVSA-N 1 3 329.488 2.672 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](CC[NH2+]CCCC2CCCC2)C1 ZINC001501648258 1403665761 /nfs/dbraw/zinc/66/57/61/1403665761.db2.gz WQPFGYAJLDVMFJ-LJQANCHMSA-N 1 3 335.536 2.881 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)CC1 ZINC001501745426 1403761415 /nfs/dbraw/zinc/76/14/15/1403761415.db2.gz YFAPNSPPHPPZPZ-PYTPGESOSA-N 1 3 333.520 2.609 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCCC[C@@H]1CNCC=C(Cl)Cl ZINC001501886671 1403855831 /nfs/dbraw/zinc/85/58/31/1403855831.db2.gz KJEACPBBLIXTAM-CYBMUJFWSA-N 1 3 336.307 2.618 10 0 EFAEHO CN(CC(=O)NCc1cccc2c1CC[N@H+](CCCF)C2)C1CCC1 ZINC001501854550 1403829008 /nfs/dbraw/zinc/82/90/08/1403829008.db2.gz WEJAXMJVBXZHOB-UHFFFAOYSA-N 1 3 347.478 2.505 10 0 EFAEHO CN(CC(=O)NCc1cccc2c1CC[N@@H+](CCCF)C2)C1CCC1 ZINC001501854550 1403829016 /nfs/dbraw/zinc/82/90/16/1403829016.db2.gz WEJAXMJVBXZHOB-UHFFFAOYSA-N 1 3 347.478 2.505 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1=CC[N@H+](CC2CCCCC2)CC1 ZINC001508229494 1407365685 /nfs/dbraw/zinc/36/56/85/1407365685.db2.gz MBECQVCGPBDUQT-UHFFFAOYSA-N 1 3 330.476 2.589 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1=CC[N@@H+](CC2CCCCC2)CC1 ZINC001508229494 1407365692 /nfs/dbraw/zinc/36/56/92/1407365692.db2.gz MBECQVCGPBDUQT-UHFFFAOYSA-N 1 3 330.476 2.589 10 0 EFAEHO Cc1ccc(CC[NH2+]C2(CNC(=O)CN(C)C(C)C)CCC2)cc1 ZINC001502029120 1403958665 /nfs/dbraw/zinc/95/86/65/1403958665.db2.gz MNYIHHQJQQQYAK-UHFFFAOYSA-N 1 3 331.504 2.506 10 0 EFAEHO CCC1([NH2+]CCC(F)(F)F)CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001502496413 1404198728 /nfs/dbraw/zinc/19/87/28/1404198728.db2.gz SGHPDLOIOODSIB-UHFFFAOYSA-N 1 3 349.441 2.784 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)[C@H](CC)N(C)C)C2 ZINC001502545960 1404234849 /nfs/dbraw/zinc/23/48/49/1404234849.db2.gz LGHBMXFGBPRHML-MJIPRMEISA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@]2(C1)CCCN(C(=O)[C@H](CC)N(C)C)C2 ZINC001502545960 1404234858 /nfs/dbraw/zinc/23/48/58/1404234858.db2.gz LGHBMXFGBPRHML-MJIPRMEISA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@H]([NH2+]Cc2ccccc2C2CC2)C1 ZINC001502762059 1404331461 /nfs/dbraw/zinc/33/14/61/1404331461.db2.gz JYMRTZXAHMJIOV-OXJNMPFZSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]Cc2cccc(OC)c2)CC1 ZINC001502805407 1404354768 /nfs/dbraw/zinc/35/47/68/1404354768.db2.gz FZGQGQUIJFOARA-UHFFFAOYSA-N 1 3 347.503 2.508 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(C)CCN(C(=O)[C@H]2CCCCN2CC)CC1 ZINC001502811205 1404357526 /nfs/dbraw/zinc/35/75/26/1404357526.db2.gz OYAUMQXHMVGMLV-HZPDHXFCSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)[C@H](C)C1 ZINC001503013260 1404458886 /nfs/dbraw/zinc/45/88/86/1404458886.db2.gz DFKPMKSGYKKPFU-SJLPKXTDSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)[C@H](C)C1 ZINC001503013260 1404458890 /nfs/dbraw/zinc/45/88/90/1404458890.db2.gz DFKPMKSGYKKPFU-SJLPKXTDSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](F)C[N@H+](CC)CC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001505398618 1404551898 /nfs/dbraw/zinc/55/18/98/1404551898.db2.gz PAFLQRCTLZDGDP-QZTJIDSGSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[C@@H](F)C[N@@H+](CC)CC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001505398618 1404551906 /nfs/dbraw/zinc/55/19/06/1404551906.db2.gz PAFLQRCTLZDGDP-QZTJIDSGSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[N@H+](CC=C(C)C)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001505399704 1404554697 /nfs/dbraw/zinc/55/46/97/1404554697.db2.gz WVILZCSNFXABNC-SFHVURJKSA-N 1 3 335.536 2.855 10 0 EFAEHO CC[N@@H+](CC=C(C)C)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001505399704 1404554702 /nfs/dbraw/zinc/55/47/02/1404554702.db2.gz WVILZCSNFXABNC-SFHVURJKSA-N 1 3 335.536 2.855 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H](C(C)C)N(C)C ZINC001505415700 1404575115 /nfs/dbraw/zinc/57/51/15/1404575115.db2.gz RJBCLQJYVSDZTH-HUYLIWGRSA-N 1 3 345.531 2.991 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+](C)C[C@@H]1CCCN1C(=O)CN(C)C(C)C ZINC001505466392 1404694043 /nfs/dbraw/zinc/69/40/43/1404694043.db2.gz XVIINGSNSHEMIE-IBGZPJMESA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+](C)C[C@@H]1CCCN1C(=O)CN(C)C(C)C ZINC001505466392 1404694056 /nfs/dbraw/zinc/69/40/56/1404694056.db2.gz XVIINGSNSHEMIE-IBGZPJMESA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](C)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001505622770 1404864958 /nfs/dbraw/zinc/86/49/58/1404864958.db2.gz ZAJRRCQBPDRWDC-IRXDYDNUSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](C)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001505622771 1404865703 /nfs/dbraw/zinc/86/57/03/1404865703.db2.gz ZAJRRCQBPDRWDC-SJORKVTESA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)CC(C)(C)C)cc1 ZINC001505694212 1404947914 /nfs/dbraw/zinc/94/79/14/1404947914.db2.gz LICIUCFPUKBFRU-QZTJIDSGSA-N 1 3 347.547 2.998 10 0 EFAEHO CN(CC(C)(C)C[NH2+]CCCF)C(=O)C(C)(C)N1CCCCC1 ZINC001505812729 1405099179 /nfs/dbraw/zinc/09/91/79/1405099179.db2.gz CFAPTQOHXBYFCT-UHFFFAOYSA-N 1 3 329.504 2.685 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H](C)[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001506043304 1405392402 /nfs/dbraw/zinc/39/24/02/1405392402.db2.gz NWOQDWMPQKZDOL-LSDHHAIUSA-N 1 3 333.467 2.590 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H](C)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001506043304 1405392409 /nfs/dbraw/zinc/39/24/09/1405392409.db2.gz NWOQDWMPQKZDOL-LSDHHAIUSA-N 1 3 333.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)[C@@H]1CCc2c1cccc2F ZINC001506065586 1405426086 /nfs/dbraw/zinc/42/60/86/1405426086.db2.gz RNXIHFCLQOHLFK-RDTXWAMCSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)[C@@H]1CCc2c1cccc2F ZINC001506065586 1405426090 /nfs/dbraw/zinc/42/60/90/1405426090.db2.gz RNXIHFCLQOHLFK-RDTXWAMCSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC001564720266 1415381027 /nfs/dbraw/zinc/38/10/27/1415381027.db2.gz XHRGQXBSZROZTI-MJGOQNOKSA-N 1 3 348.535 2.955 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC001564720266 1415381029 /nfs/dbraw/zinc/38/10/29/1415381029.db2.gz XHRGQXBSZROZTI-MJGOQNOKSA-N 1 3 348.535 2.955 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2C[C@@H]([NH2+]CCCCC(F)(F)F)C2)C1 ZINC001565851658 1415433198 /nfs/dbraw/zinc/43/31/98/1415433198.db2.gz KBUNUHXYWCJXJO-SOUVJXGZSA-N 1 3 349.441 2.545 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2C[C@@H]([NH2+]CCC3=CCCCC3)C2)C1 ZINC001565852003 1415433924 /nfs/dbraw/zinc/43/39/24/1415433924.db2.gz VUBNDSVGQQTWOI-QRQLOZEOSA-N 1 3 333.520 2.703 10 0 EFAEHO CCC(CC)C[NH2+]CC[C@H]1[C@@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001565939109 1415457086 /nfs/dbraw/zinc/45/70/86/1415457086.db2.gz OESDHKAOMLIZCR-YJBOKZPZSA-N 1 3 334.508 2.995 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN(C)CC(C)(C)C ZINC001565972798 1415467313 /nfs/dbraw/zinc/46/73/13/1415467313.db2.gz LKZZVERPZURFTF-ZACQAIPSSA-N 1 3 343.531 2.929 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN(C)CC(C)(C)C ZINC001565972797 1415467543 /nfs/dbraw/zinc/46/75/43/1415467543.db2.gz LKZZVERPZURFTF-IKGGRYGDSA-N 1 3 343.531 2.929 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCCC[N@H+](C)Cc1ccc(F)c(Cl)c1 ZINC001566439868 1415546961 /nfs/dbraw/zinc/54/69/61/1415546961.db2.gz RKQXYKNPHGYWSW-INIZCTEOSA-N 1 3 341.858 2.511 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCCC[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC001566439868 1415546963 /nfs/dbraw/zinc/54/69/63/1415546963.db2.gz RKQXYKNPHGYWSW-INIZCTEOSA-N 1 3 341.858 2.511 10 0 EFAEHO CN(CC(=O)NCCC[N@H+](C)[C@H]1CCc2ccccc21)C1CCC1 ZINC001566462035 1415560988 /nfs/dbraw/zinc/56/09/88/1415560988.db2.gz NOXSCVYZBQZNSX-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CN(CC(=O)NCCC[N@@H+](C)[C@H]1CCc2ccccc21)C1CCC1 ZINC001566462035 1415560991 /nfs/dbraw/zinc/56/09/91/1415560991.db2.gz NOXSCVYZBQZNSX-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CN(CCCNC(=O)C(C)(C)[N@H+](C)C1CCCC1)Cc1cccnc1 ZINC001566469285 1415566793 /nfs/dbraw/zinc/56/67/93/1415566793.db2.gz XTOSTHYKLCLKGV-UHFFFAOYSA-N 1 3 346.519 2.673 10 0 EFAEHO CN(CCCNC(=O)C(C)(C)[N@@H+](C)C1CCCC1)Cc1cccnc1 ZINC001566469285 1415566799 /nfs/dbraw/zinc/56/67/99/1415566799.db2.gz XTOSTHYKLCLKGV-UHFFFAOYSA-N 1 3 346.519 2.673 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](C)C[C@@H]2CCCC(F)(F)C2)C1 ZINC001566490754 1415582748 /nfs/dbraw/zinc/58/27/48/1415582748.db2.gz BWCYASREOMAWKY-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](C)C[C@@H]2CCCC(F)(F)C2)C1 ZINC001566490754 1415582750 /nfs/dbraw/zinc/58/27/50/1415582750.db2.gz BWCYASREOMAWKY-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[N@H+](CCCNC(=O)C1(N(C)C)CCC1)C[C@H]1CCC(F)(F)C1 ZINC001566552609 1415636568 /nfs/dbraw/zinc/63/65/68/1415636568.db2.gz BOMQMDRFPNBUIF-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[N@@H+](CCCNC(=O)C1(N(C)C)CCC1)C[C@H]1CCC(F)(F)C1 ZINC001566552609 1415636574 /nfs/dbraw/zinc/63/65/74/1415636574.db2.gz BOMQMDRFPNBUIF-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@@H]([NH2+]CCCc2ccccc2)C1 ZINC001566862907 1415803584 /nfs/dbraw/zinc/80/35/84/1415803584.db2.gz OGRUZGODNHNCRR-TZRIAGMCSA-N 1 3 343.515 2.729 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@H]1CCCCN1C(=O)C(C)(C)N1CCCCC1 ZINC001566938693 1415858287 /nfs/dbraw/zinc/85/82/87/1415858287.db2.gz XVLDGSFJPKUMKV-IRXDYDNUSA-N 1 3 341.515 2.970 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCCC[C@H]1C[NH2+]CCCCCF ZINC001566954098 1415866628 /nfs/dbraw/zinc/86/66/28/1415866628.db2.gz RKCZSRKHZDNJDL-ROUUACIJSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccc(CC[NH2+]CC3CCC3)cc2)C1 ZINC001567183616 1415977016 /nfs/dbraw/zinc/97/70/16/1415977016.db2.gz JDDYJKIIJAHPSJ-QGZVFWFLSA-N 1 3 343.515 2.577 10 0 EFAEHO CN(CCNC(=O)CCCC[NH+](C)C)[C@H]1CCCc2ccc(F)cc21 ZINC001567314379 1416067457 /nfs/dbraw/zinc/06/74/57/1416067457.db2.gz NVIHUQWVKBCULW-IBGZPJMESA-N 1 3 349.494 2.983 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001567516168 1416169340 /nfs/dbraw/zinc/16/93/40/1416169340.db2.gz KLLZLIPHSKVJPQ-RTBURBONSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001567516168 1416169342 /nfs/dbraw/zinc/16/93/42/1416169342.db2.gz KLLZLIPHSKVJPQ-RTBURBONSA-N 1 3 347.478 2.699 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N(C)CCNCc2ccc(C)c(F)c2)C1 ZINC001567548553 1416183127 /nfs/dbraw/zinc/18/31/27/1416183127.db2.gz NDAXBJSJAKIKIH-SFHVURJKSA-N 1 3 349.494 2.804 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N(C)CCNCc2ccc(C)c(F)c2)C1 ZINC001567548553 1416183128 /nfs/dbraw/zinc/18/31/28/1416183128.db2.gz NDAXBJSJAKIKIH-SFHVURJKSA-N 1 3 349.494 2.804 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@H]2CCC[C@@H]3CCC[N@@H+]32)cc1F ZINC001567573844 1416193230 /nfs/dbraw/zinc/19/32/30/1416193230.db2.gz NIBYDCNOOQEAFS-IEBWSBKVSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@H]2CCC[C@@H]3CCC[N@H+]32)cc1F ZINC001567573844 1416193231 /nfs/dbraw/zinc/19/32/31/1416193231.db2.gz NIBYDCNOOQEAFS-IEBWSBKVSA-N 1 3 347.478 2.699 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)N(C)CCNCc1ccc(Cl)s1 ZINC001567611140 1416209514 /nfs/dbraw/zinc/20/95/14/1416209514.db2.gz VYRHDDAJKNJYQA-CHWSQXEVSA-N 1 3 343.924 2.822 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001567611849 1416209964 /nfs/dbraw/zinc/20/99/64/1416209964.db2.gz XDKGRRGYCQSXDW-CVEARBPZSA-N 1 3 345.478 2.734 10 0 EFAEHO CN(CC(=O)N1CCC(CC[NH2+]Cc2ccsc2)CC1)C1CCC1 ZINC001568087321 1416403747 /nfs/dbraw/zinc/40/37/47/1416403747.db2.gz AEUGSXNYTSUBNQ-UHFFFAOYSA-N 1 3 349.544 2.951 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(CC[NH2+]C/C=C\Cl)CC1 ZINC001568097458 1416409000 /nfs/dbraw/zinc/40/90/00/1416409000.db2.gz BGOZDDLROLIPTM-OCKNTNFFSA-N 1 3 341.927 2.832 10 0 EFAEHO CC[C@@H](C(=O)N1CCC2(CC[N@H+](CCCCCF)C2)CC1)N(C)C ZINC001568155513 1416427316 /nfs/dbraw/zinc/42/73/16/1416427316.db2.gz QMKLXXFLNGWFBI-KRWDZBQOSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[C@@H](C(=O)N1CCC2(CC[N@@H+](CCCCCF)C2)CC1)N(C)C ZINC001568155513 1416427319 /nfs/dbraw/zinc/42/73/19/1416427319.db2.gz QMKLXXFLNGWFBI-KRWDZBQOSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCCCC[NH+]1CC2(C1)CCN(C(=O)CN1CC[C@@H](C)C1)CC2 ZINC001568252567 1416456410 /nfs/dbraw/zinc/45/64/10/1416456410.db2.gz LSNZVBPPXHYYPN-GOSISDBHSA-N 1 3 335.536 2.833 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]CC[C@H]1CCCC1(F)F ZINC001568320337 1416475364 /nfs/dbraw/zinc/47/53/64/1416475364.db2.gz FXUQDMQCISEIOM-HUUCEWRRSA-N 1 3 333.467 2.589 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)CC[C@H]1[NH2+]CCCCCF ZINC001568364780 1416493965 /nfs/dbraw/zinc/49/39/65/1416493965.db2.gz IGOOPRDFQUTNRM-DLBZAZTESA-N 1 3 343.531 2.931 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCCC[C@H]2CC[NH2+]CC2CCCC2)C1 ZINC001568393703 1416511131 /nfs/dbraw/zinc/51/11/31/1416511131.db2.gz QWHJQHAAZYPCHE-MJGOQNOKSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@H]1CC[NH2+]Cc1cccnc1C)N(C)C ZINC001568398104 1416514487 /nfs/dbraw/zinc/51/44/87/1416514487.db2.gz OCZAMTPSLPJQFJ-OALUTQOASA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@H]([NH2+]CCCF)[C@@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001568416977 1416523759 /nfs/dbraw/zinc/52/37/59/1416523759.db2.gz QPAZWOHKFWPFDS-QFBILLFUSA-N 1 3 349.494 2.938 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CCCC(C)(C)C ZINC001568461786 1416539335 /nfs/dbraw/zinc/53/93/35/1416539335.db2.gz DLKYYRGABODPFU-IAGOWNOFSA-N 1 3 325.541 2.885 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CCC1=CCCCC1 ZINC001568462381 1416539237 /nfs/dbraw/zinc/53/92/37/1416539237.db2.gz IYSUCJSWAHMPPD-IEBWSBKVSA-N 1 3 335.536 2.949 10 0 EFAEHO Cc1ccccc1CN1CCCN(C(=O)[C@@H]2CCCC[C@H]2[NH3+])CC1 ZINC001645892269 1416580884 /nfs/dbraw/zinc/58/08/84/1416580884.db2.gz BNAOXBPQYJHBJT-RTBURBONSA-N 1 3 329.488 2.547 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1ccc(F)cc1 ZINC001691751114 1416664769 /nfs/dbraw/zinc/66/47/69/1416664769.db2.gz CEARTMJVZLFOQH-KRWDZBQOSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1ccc(F)cc1 ZINC001691751114 1416664773 /nfs/dbraw/zinc/66/47/73/1416664773.db2.gz CEARTMJVZLFOQH-KRWDZBQOSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)N1CCN(C2CCCCC2)CC1 ZINC001683780917 1416684752 /nfs/dbraw/zinc/68/47/52/1416684752.db2.gz IINWJMYMSPAFNW-UHFFFAOYSA-N 1 3 338.540 2.624 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)N1CCN(C2CCCCC2)CC1 ZINC001683780917 1416684755 /nfs/dbraw/zinc/68/47/55/1416684755.db2.gz IINWJMYMSPAFNW-UHFFFAOYSA-N 1 3 338.540 2.624 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]([NH2+]CCC1=CCCCC1)C1CC1 ZINC001690178132 1417170188 /nfs/dbraw/zinc/17/01/88/1417170188.db2.gz LKWSRQGTQSIMFG-GOSISDBHSA-N 1 3 330.476 2.636 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@@H](C[NH2+]CCCC2CCC2)C1 ZINC001690757326 1417239034 /nfs/dbraw/zinc/23/90/34/1417239034.db2.gz GOAYBMZCEORUTN-OALUTQOASA-N 1 3 335.536 2.879 10 0 EFAEHO CC/C=C\CC[N@H+](C)CC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001692014390 1417252778 /nfs/dbraw/zinc/25/27/78/1417252778.db2.gz VEHMQGYNWCPPJZ-WAYWQWQTSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](C)CC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001692014390 1417252782 /nfs/dbraw/zinc/25/27/82/1417252782.db2.gz VEHMQGYNWCPPJZ-WAYWQWQTSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001698732134 1417322552 /nfs/dbraw/zinc/32/25/52/1417322552.db2.gz OEDPUHNTGUOQMI-VQIMIIECSA-N 1 3 339.499 2.746 10 0 EFAEHO C[C@H](C[NH2+]CCCc1cccc(F)c1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001698846230 1417340180 /nfs/dbraw/zinc/34/01/80/1417340180.db2.gz YMWHVCWBJQRAHT-IAGOWNOFSA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)[C@@H]1C[NH2+]C/C=C/Cl ZINC001698948339 1417353665 /nfs/dbraw/zinc/35/36/65/1417353665.db2.gz VNGYRDCGGZMXQP-JDFMTEHDSA-N 1 3 343.943 2.934 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)[C@H]1C[NH2+]C/C=C/Cl ZINC001698948338 1417353781 /nfs/dbraw/zinc/35/37/81/1417353781.db2.gz VNGYRDCGGZMXQP-FEPMCFLQSA-N 1 3 343.943 2.934 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1C ZINC001699107277 1417391119 /nfs/dbraw/zinc/39/11/19/1417391119.db2.gz SBGVPARWPXNQPY-KRWDZBQOSA-N 1 3 331.504 2.772 10 0 EFAEHO CN(CC(=O)NC/C=C/C[NH2+]CC1CC2(CCC2)C1)CC(C)(C)C ZINC001699308329 1417418626 /nfs/dbraw/zinc/41/86/26/1417418626.db2.gz MNGLFRUKPONAGJ-AATRIKPKSA-N 1 3 335.536 2.807 10 0 EFAEHO CC/C=C/CC[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001699662555 1417442977 /nfs/dbraw/zinc/44/29/77/1417442977.db2.gz WSLZVHCYVFDYJZ-GHOSXJJBSA-N 1 3 339.499 2.794 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@](C)(C[NH2+]CCCc2ccccc2)C1)N(C)C ZINC001699846451 1417475881 /nfs/dbraw/zinc/47/58/81/1417475881.db2.gz UXZKYFOSJCJWDX-PZJWPPBQSA-N 1 3 345.531 2.788 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H](CC[NH2+]CCC3CCCC3)C2)CCC1 ZINC001700064514 1417547627 /nfs/dbraw/zinc/54/76/27/1417547627.db2.gz CZEUUGFHCKLGMF-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001700686270 1417613799 /nfs/dbraw/zinc/61/37/99/1417613799.db2.gz YCRGJENZZLHKEW-JSGCOSHPSA-N 1 3 342.434 2.571 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001700686269 1417614400 /nfs/dbraw/zinc/61/44/00/1417614400.db2.gz YCRGJENZZLHKEW-GXTWGEPZSA-N 1 3 342.434 2.571 10 0 EFAEHO Cc1ncccc1C[N@H+]1CCC[C@@H]1CCCNC(=O)CN(C)C(C)C ZINC001713441900 1418538734 /nfs/dbraw/zinc/53/87/34/1418538734.db2.gz CDDZWKGCIYLHBM-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1ncccc1C[N@@H+]1CCC[C@@H]1CCCNC(=O)CN(C)C(C)C ZINC001713441900 1418538736 /nfs/dbraw/zinc/53/87/36/1418538736.db2.gz CDDZWKGCIYLHBM-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO CC1(C)CC(C[NH2+]CCC2CCN(C(=O)CN3CCCC3)CC2)C1 ZINC001714291566 1418594815 /nfs/dbraw/zinc/59/48/15/1418594815.db2.gz WLAIYWWOXKZTOO-UHFFFAOYSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]CCc1ccccc1 ZINC001714774581 1418632607 /nfs/dbraw/zinc/63/26/07/1418632607.db2.gz WQPJQMLSVPDGCM-AZUAARDMSA-N 1 3 345.531 2.929 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001716174367 1418713316 /nfs/dbraw/zinc/71/33/16/1418713316.db2.gz QLRYHWMFZWQQTR-WMZOPIPTSA-N 1 3 331.504 2.630 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001716174364 1418713822 /nfs/dbraw/zinc/71/38/22/1418713822.db2.gz QLRYHWMFZWQQTR-AEFFLSMTSA-N 1 3 331.504 2.630 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CC[C@@H](C)NC(=O)[C@H](C(C)C)N(C)C)c1 ZINC001716189172 1418718768 /nfs/dbraw/zinc/71/87/68/1418718768.db2.gz UVCNWCYXTOUMKR-QAPCUYQASA-N 1 3 337.483 2.705 10 0 EFAEHO CCc1cccc(C[NH2+]CCN(CC)C(=O)CN2CC[C@H](C)C2)c1 ZINC001716240193 1418733253 /nfs/dbraw/zinc/73/32/53/1418733253.db2.gz XWRHRTHPLACOKH-KRWDZBQOSA-N 1 3 331.504 2.529 10 0 EFAEHO CCN(CC[NH2+]CCc1ccccc1F)C(=O)[C@@H]1CCCCN1CC ZINC001716255697 1418742943 /nfs/dbraw/zinc/74/29/43/1418742943.db2.gz AMMDCAHSVBPYRQ-IBGZPJMESA-N 1 3 349.494 2.681 10 0 EFAEHO CC(C)(C)CC[NH2+]C/C=C/CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001716343553 1418788251 /nfs/dbraw/zinc/78/82/51/1418788251.db2.gz FONGKPQDHSSVCD-UCFODXPJSA-N 1 3 341.515 2.897 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CCCc1ccccc1C ZINC001716424593 1418877916 /nfs/dbraw/zinc/87/79/16/1418877916.db2.gz MCJGBPWPWRPSBS-UYAOXDASSA-N 1 3 345.531 2.896 10 0 EFAEHO CN(CCC[NH2+][C@@H]1CCc2ccc(Cl)cc21)C(=O)CN1CCCC1 ZINC001716585814 1418917958 /nfs/dbraw/zinc/91/79/58/1418917958.db2.gz ULHBPMPXHBGMGL-GOSISDBHSA-N 1 3 349.906 2.861 10 0 EFAEHO CCCCC[NH2+]C[C@@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001716620989 1418927456 /nfs/dbraw/zinc/92/74/56/1418927456.db2.gz CKFYLWWAWZDXRI-APWZRJJASA-N 1 3 341.515 2.874 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001716790948 1419010460 /nfs/dbraw/zinc/01/04/60/1419010460.db2.gz SFRUHVSRAXQZQN-AWEZNQCLSA-N 1 3 348.318 2.762 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+]CCC(F)(F)F)C1CCCC1)C1CCC1 ZINC001716816855 1419028460 /nfs/dbraw/zinc/02/84/60/1419028460.db2.gz CXHJXZXKGCYFHC-OAHLLOKOSA-N 1 3 349.441 2.688 10 0 EFAEHO C[C@H]1CN(C(=O)CN2CCC(C)CC2)C[C@@H]1C[NH2+]CCC1CCCC1 ZINC001716992156 1419129654 /nfs/dbraw/zinc/12/96/54/1419129654.db2.gz MVPBKKHKRIGBCL-ICSRJNTNSA-N 1 3 349.563 2.983 10 0 EFAEHO CN(C)C1(C(=O)N(CC[NH2+]CC2CCC2)Cc2ccccc2)CCC1 ZINC001717005745 1419141453 /nfs/dbraw/zinc/14/14/53/1419141453.db2.gz MSYOYKJGHLBIBV-UHFFFAOYSA-N 1 3 343.515 2.889 10 0 EFAEHO CCCCC[N@H+]1C[C@H]2CN(C(=O)c3cccc(CN(C)C)c3)C[C@H]2C1 ZINC001717015327 1419150644 /nfs/dbraw/zinc/15/06/44/1419150644.db2.gz ZZNNEXOVLNZWGI-BGYRXZFFSA-N 1 3 343.515 2.942 10 0 EFAEHO CCCCC[N@@H+]1C[C@H]2CN(C(=O)c3cccc(CN(C)C)c3)C[C@H]2C1 ZINC001717015327 1419150650 /nfs/dbraw/zinc/15/06/50/1419150650.db2.gz ZZNNEXOVLNZWGI-BGYRXZFFSA-N 1 3 343.515 2.942 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C(C)C)N(C)C ZINC001717035469 1419167363 /nfs/dbraw/zinc/16/73/63/1419167363.db2.gz KNKCLSMDXWVIRZ-NCPJDUFYSA-N 1 3 335.536 2.994 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C(C)C)N(C)C ZINC001717035469 1419167368 /nfs/dbraw/zinc/16/73/68/1419167368.db2.gz KNKCLSMDXWVIRZ-NCPJDUFYSA-N 1 3 335.536 2.994 10 0 EFAEHO CC(C)CC[NH2+]CC[C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001717099588 1419207753 /nfs/dbraw/zinc/20/77/53/1419207753.db2.gz ZDNGVWOPSQMGBO-KRWDZBQOSA-N 1 3 325.541 2.839 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1C ZINC001717111628 1419216180 /nfs/dbraw/zinc/21/61/80/1419216180.db2.gz WUIXOOULQOIKOE-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001717111733 1419216629 /nfs/dbraw/zinc/21/66/29/1419216629.db2.gz YRNGFFOBPSFQOM-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[C@H](C[NH2+]C/C=C\Cl)CC1)CC(C)(C)C ZINC001717123013 1419224182 /nfs/dbraw/zinc/22/41/82/1419224182.db2.gz OIVSLMRXLVLPMT-NGRBPPKXSA-N 1 3 343.943 2.981 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[N@H+](CC3=CCCCC3)CC2)CCC1 ZINC001717195464 1419257589 /nfs/dbraw/zinc/25/75/89/1419257589.db2.gz KAFNYZFQZQSIKI-SFHVURJKSA-N 1 3 333.520 2.942 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[N@@H+](CC3=CCCCC3)CC2)CCC1 ZINC001717195464 1419257592 /nfs/dbraw/zinc/25/75/92/1419257592.db2.gz KAFNYZFQZQSIKI-SFHVURJKSA-N 1 3 333.520 2.942 10 0 EFAEHO CCCCCC[NH2+][C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1C ZINC001717285420 1419307592 /nfs/dbraw/zinc/30/75/92/1419307592.db2.gz CJERAQGYKKFJNR-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H](C)[C@@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001717412788 1419384179 /nfs/dbraw/zinc/38/41/79/1419384179.db2.gz KTCFSENTWMABJE-QZTJIDSGSA-N 1 3 345.531 2.895 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC(C)(C)C[NH2+]C/C=C/Cl ZINC001717460031 1419402901 /nfs/dbraw/zinc/40/29/01/1419402901.db2.gz WWIPKZNJQUOKFA-TUPIDYKKSA-N 1 3 329.916 2.688 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N(C)CC(C)(C)C[NH2+]C/C=C/Cl ZINC001717459577 1419402986 /nfs/dbraw/zinc/40/29/86/1419402986.db2.gz HMBFCMZJJOLRQL-QHLGLPELSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)=CCN1C[C@H](NC(=O)[C@H](C(C)C)[NH+]2CCCC2)C(C)(C)C1 ZINC001717589906 1419460327 /nfs/dbraw/zinc/46/03/27/1419460327.db2.gz TTYJKSNLEVHFGH-ROUUACIJSA-N 1 3 335.536 2.900 10 0 EFAEHO C[C@@H](CCC[NH2+]CC1CC2(CCC2)C1)NC(=O)CN1CC[C@H](C)C1 ZINC001717685859 1419506039 /nfs/dbraw/zinc/50/60/39/1419506039.db2.gz ZLYRAWLQXYALCF-IRXDYDNUSA-N 1 3 335.536 2.783 10 0 EFAEHO CC[NH2+]CCCN(Cc1ccccc1)C(=O)[C@@H]1CCCCN1CC ZINC001717707536 1419519900 /nfs/dbraw/zinc/51/99/00/1419519900.db2.gz XTTBHUBAFINYHX-IBGZPJMESA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)CCC[NH2+][C@H]1C[C@H](C)N(C(=O)CN(C)CC(C)(C)C)C1 ZINC001717821111 1419557616 /nfs/dbraw/zinc/55/76/16/1419557616.db2.gz AMNYQFFWWGCBOS-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN(C)CC(C)(C)C)C[C@H]21 ZINC001717850794 1419578819 /nfs/dbraw/zinc/57/88/19/1419578819.db2.gz YQHXZYXFRXIUTN-RCCFBDPRSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)CCC[NH2+][C@H]1CN(C(=O)[C@@H](C(C)C)N(C)C)CC1(C)C ZINC001717905062 1419612358 /nfs/dbraw/zinc/61/23/58/1419612358.db2.gz FROWXXGCLNEZEH-DLBZAZTESA-N 1 3 325.541 2.835 10 0 EFAEHO C[C@@H](C(=O)N[C@@H](C[NH2+]CCCF)C(C)(C)C)N1CCCCCC1 ZINC001717968783 1419633964 /nfs/dbraw/zinc/63/39/64/1419633964.db2.gz HYKJZSLJYWFTNY-HOTGVXAUSA-N 1 3 329.504 2.731 10 0 EFAEHO C[NH+](C)CCCC(=O)NCC1=CCN(Cc2ccc(CF)cc2)CC1 ZINC001718026323 1419664806 /nfs/dbraw/zinc/66/48/06/1419664806.db2.gz JHZPPCBAKOEZKX-UHFFFAOYSA-N 1 3 347.478 2.746 10 0 EFAEHO Cc1ccc(CN2CC=C(CNC(=O)CCC[NH+](C)C)CC2)cc1 ZINC001718026124 1419665194 /nfs/dbraw/zinc/66/51/94/1419665194.db2.gz FVSNKYFZVQZDFO-UHFFFAOYSA-N 1 3 329.488 2.585 10 0 EFAEHO C[C@@H](c1ccccc1)[N@H+]1CC=C(CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001718028499 1419667362 /nfs/dbraw/zinc/66/73/62/1419667362.db2.gz PARVJOQISKBPKX-MSOLQXFVSA-N 1 3 341.499 2.838 10 0 EFAEHO C[C@@H](c1ccccc1)[N@@H+]1CC=C(CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001718028499 1419667363 /nfs/dbraw/zinc/66/73/63/1419667363.db2.gz PARVJOQISKBPKX-MSOLQXFVSA-N 1 3 341.499 2.838 10 0 EFAEHO C[C@H](c1ccccc1)[N@H+]1CC=C(CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001718028500 1419667383 /nfs/dbraw/zinc/66/73/83/1419667383.db2.gz PARVJOQISKBPKX-QZTJIDSGSA-N 1 3 341.499 2.838 10 0 EFAEHO C[C@H](c1ccccc1)[N@@H+]1CC=C(CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001718028500 1419667384 /nfs/dbraw/zinc/66/73/84/1419667384.db2.gz PARVJOQISKBPKX-QZTJIDSGSA-N 1 3 341.499 2.838 10 0 EFAEHO Cc1cccc(C[NH2+]CCCN(C)C(=O)CN(C)CC(C)(C)C)c1 ZINC001723122659 1424429396 /nfs/dbraw/zinc/42/93/96/1424429396.db2.gz IFNDPPFLLMOYDA-UHFFFAOYSA-N 1 3 333.520 2.911 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[NH2+]Cc2ccc(Cl)s2)C1 ZINC001723123719 1424429642 /nfs/dbraw/zinc/42/96/42/1424429642.db2.gz PVMBTFRKSGBOMJ-CYBMUJFWSA-N 1 3 343.924 2.681 10 0 EFAEHO Cc1ccc(C[NH2+]CCCN(C)C(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001723124134 1424430394 /nfs/dbraw/zinc/43/03/94/1424430394.db2.gz USTDVEMDLKWYRK-QGZVFWFLSA-N 1 3 331.504 2.583 10 0 EFAEHO CC(C)CCC[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001723558252 1424522485 /nfs/dbraw/zinc/52/24/85/1424522485.db2.gz GSPNWYLAUMVSMH-IBGZPJMESA-N 1 3 341.515 2.874 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001723718958 1424566415 /nfs/dbraw/zinc/56/64/15/1424566415.db2.gz NCCUGZLTCGTLPC-SFFCAUCYSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001723718958 1424566424 /nfs/dbraw/zinc/56/64/24/1424566424.db2.gz NCCUGZLTCGTLPC-SFFCAUCYSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001723722368 1424569980 /nfs/dbraw/zinc/56/99/80/1424569980.db2.gz VGZKSSOBUBRTLO-YOYZPVNRSA-N 1 3 333.520 2.609 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001723722368 1424569982 /nfs/dbraw/zinc/56/99/82/1424569982.db2.gz VGZKSSOBUBRTLO-YOYZPVNRSA-N 1 3 333.520 2.609 10 0 EFAEHO CN(C(=O)CCCC[NH+]1CCCC1)C1CN(C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC001723825307 1424585658 /nfs/dbraw/zinc/58/56/58/1424585658.db2.gz GPSSJQAJODVJSY-QRVBRYPASA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@@H]1CN(C(=O)CN2CCC(C)CC2)C[C@@H]1C[NH2+]CCCCCF ZINC001724602552 1424818684 /nfs/dbraw/zinc/81/86/84/1424818684.db2.gz JPZIIKLTNVDILL-MSOLQXFVSA-N 1 3 341.515 2.542 10 0 EFAEHO O=C([C@@H]1CCC[C@H]2CCC[N@@H+]21)N(CCNCCF)Cc1ccccc1 ZINC001724615121 1424837231 /nfs/dbraw/zinc/83/72/31/1424837231.db2.gz DVSSLJXROODMSY-OALUTQOASA-N 1 3 347.478 2.591 10 0 EFAEHO O=C([C@@H]1CCC[C@H]2CCC[N@H+]21)N(CCNCCF)Cc1ccccc1 ZINC001724615121 1424837235 /nfs/dbraw/zinc/83/72/35/1424837235.db2.gz DVSSLJXROODMSY-OALUTQOASA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](CC[NH2+]CCc2ccccc2)C1)N(C)C ZINC001724713090 1424931993 /nfs/dbraw/zinc/93/19/93/1424931993.db2.gz UXKQXWUEBPJFSV-UXHICEINSA-N 1 3 345.531 2.644 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@@H](CC[NH2+]CCCF)C2)c1 ZINC001724746027 1424975711 /nfs/dbraw/zinc/97/57/11/1424975711.db2.gz GYFZESMCZCXQAV-MRXNPFEDSA-N 1 3 335.467 2.550 10 0 EFAEHO CCc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001724753251 1424982222 /nfs/dbraw/zinc/98/22/22/1424982222.db2.gz ZNVQUCFQOYUNQS-FQEVSTJZSA-N 1 3 345.531 2.917 10 0 EFAEHO CC1([NH2+]CCC2=CCCCC2)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001724959005 1425166982 /nfs/dbraw/zinc/16/69/82/1425166982.db2.gz FNQLQWOBQHVIOT-UHFFFAOYSA-N 1 3 330.476 2.813 10 0 EFAEHO CC(C)[C@H](C(=O)NC1CC(C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001725075122 1425284678 /nfs/dbraw/zinc/28/46/78/1425284678.db2.gz QTPYTAIZOKXZIH-LFUZSFIQSA-N 1 3 343.515 2.770 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H](C)[NH2+]CCCc1ccc(C)cc1 ZINC001725122390 1425314632 /nfs/dbraw/zinc/31/46/32/1425314632.db2.gz CWKALFJBIHTENW-HZPDHXFCSA-N 1 3 342.487 2.685 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+]Cc1ccc(C)cc1C ZINC001725414935 1425559577 /nfs/dbraw/zinc/55/95/77/1425559577.db2.gz RWROTMPQDZGHFG-MRXNPFEDSA-N 1 3 342.487 2.952 10 0 EFAEHO Cc1cc(C[NH2+]CCC[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cs1 ZINC001725416403 1425560473 /nfs/dbraw/zinc/56/04/73/1425560473.db2.gz LAOBYFLQVQEUGO-CABCVRRESA-N 1 3 337.533 2.773 10 0 EFAEHO CC/C=C/CC[N@H+](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001725424049 1425569078 /nfs/dbraw/zinc/56/90/78/1425569078.db2.gz HBFAMAYMOFKLLL-AATRIKPKSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001725424049 1425569082 /nfs/dbraw/zinc/56/90/82/1425569082.db2.gz HBFAMAYMOFKLLL-AATRIKPKSA-N 1 3 335.536 2.997 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CCC[NH2+]CCC(F)(F)F ZINC001725455760 1425593135 /nfs/dbraw/zinc/59/31/35/1425593135.db2.gz FEVDAUWJYSSPKZ-KBPBESRZSA-N 1 3 337.430 2.688 10 0 EFAEHO C[C@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]CCCc1ccsc1 ZINC001725489497 1425615551 /nfs/dbraw/zinc/61/55/51/1425615551.db2.gz LUUIHZPRGTWENN-OAHLLOKOSA-N 1 3 337.533 2.602 10 0 EFAEHO C[C@@H]1[C@H]([NH2+]CC/C=C\c2ccccc2)CCN1C(=O)Cc1c[nH]cn1 ZINC001725569384 1425655687 /nfs/dbraw/zinc/65/56/87/1425655687.db2.gz RJEDHTZGKYYNEJ-YCIDRVBSSA-N 1 3 338.455 2.635 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCc2ccc(C)cc2)C[C@H]1C ZINC001725601430 1425688279 /nfs/dbraw/zinc/68/82/79/1425688279.db2.gz XMGNYTDUZYKUAV-QUCCMNQESA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN(C)C3CCC3)C[C@H]21 ZINC001725632360 1425731594 /nfs/dbraw/zinc/73/15/94/1425731594.db2.gz RKXBLHZIXGPSRE-QXAKKESOSA-N 1 3 333.520 2.654 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](Cc2c(C)cccc2C)CC1 ZINC001725826742 1425890592 /nfs/dbraw/zinc/89/05/92/1425890592.db2.gz GLLNHYPMGWQZFW-UHFFFAOYSA-N 1 3 343.515 2.894 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](Cc2c(C)cccc2C)CC1 ZINC001725826742 1425890594 /nfs/dbraw/zinc/89/05/94/1425890594.db2.gz GLLNHYPMGWQZFW-UHFFFAOYSA-N 1 3 343.515 2.894 10 0 EFAEHO CC/C=C/CC[N@H+]1CC=C(CNC(=O)[C@@H]2CCCCN2CC)CC1 ZINC001725828571 1425893900 /nfs/dbraw/zinc/89/39/00/1425893900.db2.gz FPENBAFXDYKHOT-UEKDZROGSA-N 1 3 333.520 2.965 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC=C(CNC(=O)[C@@H]2CCCCN2CC)CC1 ZINC001725828571 1425893908 /nfs/dbraw/zinc/89/39/08/1425893908.db2.gz FPENBAFXDYKHOT-UEKDZROGSA-N 1 3 333.520 2.965 10 0 EFAEHO COCCc1nc(C)c([C@H](C)[NH2+]C[C@@H]2CNCCC2(F)F)s1 ZINC000925783916 717898495 /nfs/dbraw/zinc/89/84/95/717898495.db2.gz PIFMCOOOXBPRKR-JQWIXIFHSA-N 1 3 333.448 2.536 10 0 EFAEHO COCCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CNCCC2(F)F)cc1 ZINC000925784437 717927983 /nfs/dbraw/zinc/92/79/83/717927983.db2.gz RIRHXILBOMJVEW-HIFRSBDPSA-N 1 3 328.403 2.607 10 0 EFAEHO CN1CC[C@@]2(CC[N@H+](C[C@@H](O)c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000292227730 715834632 /nfs/dbraw/zinc/83/46/32/715834632.db2.gz VKDBJJGWNPZDNN-HZPDHXFCSA-N 1 3 328.378 2.766 10 0 EFAEHO CN1CC[C@@]2(CC[N@@H+](C[C@@H](O)c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000292227730 715834637 /nfs/dbraw/zinc/83/46/37/715834637.db2.gz VKDBJJGWNPZDNN-HZPDHXFCSA-N 1 3 328.378 2.766 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC(C)(C)/C=C\Cl)CC2)CC1 ZINC000928927818 724518393 /nfs/dbraw/zinc/51/83/93/724518393.db2.gz KVZIXDJJKJSOQN-KTKRTIGZSA-N 1 3 341.927 2.830 10 0 EFAEHO C[C@]1(NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)CN2CCC1CC2 ZINC000892769212 719142808 /nfs/dbraw/zinc/14/28/08/719142808.db2.gz QAUHWKXTUBWGRC-NRFANRHFSA-N 1 3 341.499 2.887 10 0 EFAEHO CCS(=O)(=O)c1ccccc1CC[NH2+][C@H]1C[C@H](N)CC(C)(C)C1 ZINC000925832042 719450656 /nfs/dbraw/zinc/45/06/56/719450656.db2.gz FOMZLTDOZBZCKQ-HOTGVXAUSA-N 1 3 338.517 2.518 10 0 EFAEHO CCS(=O)(=O)c1ccccc1CCN[C@H]1C[C@H]([NH3+])CC(C)(C)C1 ZINC000925832042 719450658 /nfs/dbraw/zinc/45/06/58/719450658.db2.gz FOMZLTDOZBZCKQ-HOTGVXAUSA-N 1 3 338.517 2.518 10 0 EFAEHO COc1cc(C)cc(CN2CCC(OCC[NH+](C)C)CC2)c1OC ZINC000894017343 720220011 /nfs/dbraw/zinc/22/00/11/720220011.db2.gz MTCRXBSQDPPDGH-UHFFFAOYSA-N 1 3 336.476 2.555 10 0 EFAEHO CC[NH+]1CCN(Cc2ccc(NCc3c(C)ccnc3N)cc2)CC1 ZINC000894102047 720371914 /nfs/dbraw/zinc/37/19/14/720371914.db2.gz HKHWYTPITMRXAV-UHFFFAOYSA-N 1 3 339.487 2.722 10 0 EFAEHO COc1ccc(CCN[C@@H]2C[C@H]([NH3+])C23CCC3)cc1OC(F)F ZINC000925557154 720390340 /nfs/dbraw/zinc/39/03/40/720390340.db2.gz KISYJCWWWPWOKZ-LSDHHAIUSA-N 1 3 326.387 2.699 10 0 EFAEHO CC1(C)C[C@@H]([NH3+])C[C@@H](NCCOc2cccc(C(F)(F)F)n2)C1 ZINC000925628419 720627616 /nfs/dbraw/zinc/62/76/16/720627616.db2.gz FRQGESGYKLKMEL-NWDGAFQWSA-N 1 3 331.382 2.975 10 0 EFAEHO CC[NH+](CC)Cc1ccccc1CNC[C@H]1[C@H](C(=O)OC)C1(F)F ZINC000894158530 720971751 /nfs/dbraw/zinc/97/17/51/720971751.db2.gz SVSVRIWILPDTCU-JKSUJKDBSA-N 1 3 340.414 2.672 10 0 EFAEHO CC[NH+](CC)Cc1cccc(CNC[C@@H]2[C@H](C(=O)OC)C2(F)F)c1 ZINC000894191773 721189903 /nfs/dbraw/zinc/18/99/03/721189903.db2.gz PGHSVDGFYYTIPZ-HZPDHXFCSA-N 1 3 340.414 2.672 10 0 EFAEHO CC[NH+](CC)Cc1cccc(CNC[C@@H]2[C@@H](C(=O)OC)C2(F)F)c1 ZINC000894191770 721190186 /nfs/dbraw/zinc/19/01/86/721190186.db2.gz PGHSVDGFYYTIPZ-CVEARBPZSA-N 1 3 340.414 2.672 10 0 EFAEHO CCN1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2ccnn2C2CCC2)CC1 ZINC000924953159 721862443 /nfs/dbraw/zinc/86/24/43/721862443.db2.gz PWBFMIJHAZGEAR-IRXDYDNUSA-N 1 3 333.524 2.532 10 0 EFAEHO CCN1CCN(C[C@H](C)C[NH2+][C@@H](C)c2ccnn2C2CCC2)CC1 ZINC000924953160 721862783 /nfs/dbraw/zinc/86/27/83/721862783.db2.gz PWBFMIJHAZGEAR-SJORKVTESA-N 1 3 333.524 2.532 10 0 EFAEHO CCN1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2ccnn2CC2CCC2)CC1 ZINC000924953596 721865215 /nfs/dbraw/zinc/86/52/15/721865215.db2.gz RFJAMAYPIOXTFU-ROUUACIJSA-N 1 3 347.551 2.607 10 0 EFAEHO CCN(Cc1ccc(C[NH+](C)C)cc1)C[C@H]1[C@@H](C(=O)OC)C1(F)F ZINC000894764252 722841626 /nfs/dbraw/zinc/84/16/26/722841626.db2.gz GCTWBJPJYMDMIW-HOTGVXAUSA-N 1 3 340.414 2.624 10 0 EFAEHO C[N@@H+]1CC[C@@H]2CN(C[C@@H](O)c3cccc(C(F)(F)F)c3)C[C@@H]2C1 ZINC000324474107 723852149 /nfs/dbraw/zinc/85/21/49/723852149.db2.gz NQZFBOHFNQHWJY-IJEWVQPXSA-N 1 3 328.378 2.622 10 0 EFAEHO C[N@H+]1CC[C@@H]2CN(C[C@@H](O)c3cccc(C(F)(F)F)c3)C[C@@H]2C1 ZINC000324474107 723852152 /nfs/dbraw/zinc/85/21/52/723852152.db2.gz NQZFBOHFNQHWJY-IJEWVQPXSA-N 1 3 328.378 2.622 10 0 EFAEHO c1cn2cc(C[NH2+]CC3CCN(Cc4ccncc4)CC3)sc2n1 ZINC000895347432 724054544 /nfs/dbraw/zinc/05/45/44/724054544.db2.gz HUHIKMDKYWWSPM-UHFFFAOYSA-N 1 3 341.484 2.793 10 0 EFAEHO c1cn(C2CC2)c(CNCC2CC[NH+](Cc3ccncc3)CC2)n1 ZINC000895347777 724058263 /nfs/dbraw/zinc/05/82/63/724058263.db2.gz QHAWCCVHWGHANA-UHFFFAOYSA-N 1 3 325.460 2.615 10 0 EFAEHO c1cn(C2CC2)c(C[NH2+]CC2CCN(Cc3ccncc3)CC2)n1 ZINC000895347777 724058265 /nfs/dbraw/zinc/05/82/65/724058265.db2.gz QHAWCCVHWGHANA-UHFFFAOYSA-N 1 3 325.460 2.615 10 0 EFAEHO C[C@H](CN(C)C)[C@@H]1CCCC[N@@H+]1CC1CN(C(=O)OC(C)(C)C)C1 ZINC000895377579 724087913 /nfs/dbraw/zinc/08/79/13/724087913.db2.gz MMWZBYFAHUTASX-WBVHZDCISA-N 1 3 339.524 2.906 10 0 EFAEHO C[C@H](CN(C)C)[C@@H]1CCCC[N@H+]1CC1CN(C(=O)OC(C)(C)C)C1 ZINC000895377579 724087915 /nfs/dbraw/zinc/08/79/15/724087915.db2.gz MMWZBYFAHUTASX-WBVHZDCISA-N 1 3 339.524 2.906 10 0 EFAEHO COc1ccc(C2=NO[C@H](C[NH2+][C@H]3CCN(C)C(C)(C)C3)C2)cc1F ZINC000895505206 724164831 /nfs/dbraw/zinc/16/48/31/724164831.db2.gz PAUWFYZKIQRUBQ-GJZGRUSLSA-N 1 3 349.450 2.790 10 0 EFAEHO C[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)c1ccc(NC3=NCCC3)cc1)C2 ZINC000908536259 727207903 /nfs/dbraw/zinc/20/79/03/727207903.db2.gz FYICUNPZJXTAQM-HXUWFJFHSA-N 1 3 340.471 2.849 10 0 EFAEHO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1ccc(NC3=NCCC3)cc1)C2 ZINC000908536259 727207911 /nfs/dbraw/zinc/20/79/11/727207911.db2.gz FYICUNPZJXTAQM-HXUWFJFHSA-N 1 3 340.471 2.849 10 0 EFAEHO CC(C)Oc1ccc(CN2CCC3(C[N@H+](C)C[C@@H]3CO)CC2)cc1 ZINC000169783962 728402057 /nfs/dbraw/zinc/40/20/57/728402057.db2.gz JQSXMJPPOPWCHO-GOSISDBHSA-N 1 3 332.488 2.610 10 0 EFAEHO CC(C)Oc1ccc(CN2CCC3(C[N@@H+](C)C[C@@H]3CO)CC2)cc1 ZINC000169783962 728402061 /nfs/dbraw/zinc/40/20/61/728402061.db2.gz JQSXMJPPOPWCHO-GOSISDBHSA-N 1 3 332.488 2.610 10 0 EFAEHO OC[C@H]1C[N@@H+](C2CCC2)CC12CCN(Cc1ccc(F)cc1)CC2 ZINC000169782444 728404798 /nfs/dbraw/zinc/40/47/98/728404798.db2.gz LCJNAITZFHCZOH-QGZVFWFLSA-N 1 3 332.463 2.885 10 0 EFAEHO OC[C@H]1C[N@H+](C2CCC2)CC12CCN(Cc1ccc(F)cc1)CC2 ZINC000169782444 728404799 /nfs/dbraw/zinc/40/47/99/728404799.db2.gz LCJNAITZFHCZOH-QGZVFWFLSA-N 1 3 332.463 2.885 10 0 EFAEHO CC1(C)C[C@@H]([NH3+])C[C@@H](NCc2cccc(CN3CCOCC3)c2)C1 ZINC000925478112 729148457 /nfs/dbraw/zinc/14/84/57/729148457.db2.gz SVASNDOSNCLEIZ-RBUKOAKNSA-N 1 3 331.504 2.514 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@H]2CCN2CCCCc2ccccc2)C1 ZINC001569379765 1085158066 /nfs/dbraw/zinc/15/80/66/1085158066.db2.gz IFNZNTBYMLBUNS-VQTJNVASSA-N 1 3 343.515 2.542 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@H]2CCN2CCCCc2ccccc2)C1 ZINC001569379765 1085158076 /nfs/dbraw/zinc/15/80/76/1085158076.db2.gz IFNZNTBYMLBUNS-VQTJNVASSA-N 1 3 343.515 2.542 10 0 EFAEHO CCCCC[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001569419051 1085194142 /nfs/dbraw/zinc/19/41/42/1085194142.db2.gz QVOYQADQCJKWLA-SFHVURJKSA-N 1 3 327.488 2.628 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1[C@@H]1CC[N@H+](CC=C(C)C)C1 ZINC001569436588 1085212108 /nfs/dbraw/zinc/21/21/08/1085212108.db2.gz JLSSRFQVFJYMJK-MOPGFXCFSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1[C@@H]1CC[N@@H+](CC=C(C)C)C1 ZINC001569436588 1085212118 /nfs/dbraw/zinc/21/21/18/1085212118.db2.gz JLSSRFQVFJYMJK-MOPGFXCFSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)=CC[N@H+](CC1CC1)C1CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001569452243 1085238875 /nfs/dbraw/zinc/23/88/75/1085238875.db2.gz RJZIIKLIDWYKOK-UHFFFAOYSA-N 1 3 330.476 2.621 10 0 EFAEHO CC(C)=CC[N@@H+](CC1CC1)C1CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001569452243 1085238887 /nfs/dbraw/zinc/23/88/87/1085238887.db2.gz RJZIIKLIDWYKOK-UHFFFAOYSA-N 1 3 330.476 2.621 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CCCC2CCCC2)CCN1C(=O)Cc1c[nH]cn1 ZINC001569524161 1085337429 /nfs/dbraw/zinc/33/74/29/1085337429.db2.gz YFCLIOZWQUGHMB-DOTOQJQBSA-N 1 3 332.492 2.892 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H](NC(=O)C(C)(C)N1CCCC1)C1CCCC1 ZINC001569606363 1085431684 /nfs/dbraw/zinc/43/16/84/1085431684.db2.gz FFOLVONHLLDBFD-RDJZCZTQSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)(C(=O)N[C@@H](C[NH2+]C/C=C\Cl)C1CCCC1)N1CCCC1 ZINC001569607978 1085434506 /nfs/dbraw/zinc/43/45/06/1085434506.db2.gz YIWASCYTNDICQW-BJIFSAINSA-N 1 3 341.927 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@](C)(C[NH2+]CCCC2CCC2)C1)N(C)C ZINC001569683761 1085515317 /nfs/dbraw/zinc/51/53/17/1085515317.db2.gz QOIAIMYDKKNYHX-QUCCMNQESA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@](C)(C[NH2+]CCCC2CCC2)C1)N(C)C ZINC001569690861 1085521886 /nfs/dbraw/zinc/52/18/86/1085521886.db2.gz QOIAIMYDKKNYHX-AZUAARDMSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H]([NH2+]CCCC1CCCC1)[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001569824779 1085645277 /nfs/dbraw/zinc/64/52/77/1085645277.db2.gz UCPFULJCBRERDD-HKUYNNGSSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H]1CN(C(=O)CN2CCC(C)CC2)C[C@@H]1C[NH2+]CCC(C)(C)C ZINC001569850519 1085674288 /nfs/dbraw/zinc/67/42/88/1085674288.db2.gz FXCHWMSZPWVBOJ-ROUUACIJSA-N 1 3 337.552 2.839 10 0 EFAEHO CCC/C=C/CC[N@H+]1C[C@H]2CN(C(=O)[C@@H](C(C)C)N(C)C)C[C@H]2C1 ZINC001569882143 1085716056 /nfs/dbraw/zinc/71/60/56/1085716056.db2.gz PARDWYKRQNKXKQ-UMPVYUTHSA-N 1 3 335.536 2.709 10 0 EFAEHO CCC/C=C/CC[N@@H+]1C[C@H]2CN(C(=O)[C@@H](C(C)C)N(C)C)C[C@H]2C1 ZINC001569882143 1085716070 /nfs/dbraw/zinc/71/60/70/1085716070.db2.gz PARDWYKRQNKXKQ-UMPVYUTHSA-N 1 3 335.536 2.709 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@H]2[C@H]1CCCN2C(=O)C(C)(C)c1c[nH]cn1 ZINC001569915865 1085762585 /nfs/dbraw/zinc/76/25/85/1085762585.db2.gz VJQWRIRPKAVLSO-HZPDHXFCSA-N 1 3 332.492 2.943 10 0 EFAEHO CCCCC[N@H+]1CC[C@@H]2[C@H]1CCCN2C(=O)C(C)(C)c1c[nH]cn1 ZINC001569915865 1085762595 /nfs/dbraw/zinc/76/25/95/1085762595.db2.gz VJQWRIRPKAVLSO-HZPDHXFCSA-N 1 3 332.492 2.943 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](CC[NH2+]CC3CC4(CCC4)C3)C2)C1 ZINC001570004508 1085846154 /nfs/dbraw/zinc/84/61/54/1085846154.db2.gz KAXHKYFKDBJCHF-ZWKOTPCHSA-N 1 3 347.547 2.737 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CC[C@H](CC[NH2+]Cc2ccc(Cl)cc2)C1 ZINC001570006204 1085849379 /nfs/dbraw/zinc/84/93/79/1085849379.db2.gz VOSPUGPDTDMVFS-HNNXBMFYSA-N 1 3 346.862 2.634 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[C@H](C[NH2+]CCC(F)(F)F)CC1)N(C)C ZINC001570044766 1085898871 /nfs/dbraw/zinc/89/88/71/1085898871.db2.gz NQEORCYOUMFFCF-IHRRRGAJSA-N 1 3 337.430 2.544 10 0 EFAEHO CN(CC(=O)N1CC2(C1)CC[NH+](CCCCCF)CC2)C1CCC1 ZINC001570053428 1085907366 /nfs/dbraw/zinc/90/73/66/1085907366.db2.gz FEGOSFVJQKHJLR-UHFFFAOYSA-N 1 3 339.499 2.535 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CC2=CCCCC2)CCC1 ZINC001570127472 1085967567 /nfs/dbraw/zinc/96/75/67/1085967567.db2.gz HMIWTWUYIBPOPP-IRXDYDNUSA-N 1 3 333.520 2.988 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H]([NH2+]CC/C=C\c2ccccc2)C1 ZINC001570362265 1086168189 /nfs/dbraw/zinc/16/81/89/1086168189.db2.gz RNCSOUGAHQCWOI-TYLQSNEBSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001570363947 1086171175 /nfs/dbraw/zinc/17/11/75/1086171175.db2.gz KQIKRUMLMRULCA-ICSRJNTNSA-N 1 3 345.531 2.704 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NC2CC(C[NH2+]CCC3CC3)C2)c1 ZINC001570582657 1086380742 /nfs/dbraw/zinc/38/07/42/1086380742.db2.gz RDIJWLBBEQTRLJ-UHFFFAOYSA-N 1 3 329.488 2.646 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N(C)CC(C)(C)C[NH2+]C/C=C\Cl ZINC001570674249 1086453239 /nfs/dbraw/zinc/45/32/39/1086453239.db2.gz VYDGAYODNGCHNT-SOIVGHGOSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N(C)CC(C)(C)C[NH2+]CCCF ZINC001570684300 1086458712 /nfs/dbraw/zinc/45/87/12/1086458712.db2.gz QCSYJEQFVHLDML-MRXNPFEDSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@]2(C)C[N@H+](CCCCCF)C[C@]2(C)C1)N(C)C ZINC001571064618 1086658821 /nfs/dbraw/zinc/65/88/21/1086658821.db2.gz SIPBHDJVCGUBRE-YTQUADARSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@]2(C)C[N@@H+](CCCCCF)C[C@]2(C)C1)N(C)C ZINC001571064618 1086658823 /nfs/dbraw/zinc/65/88/23/1086658823.db2.gz SIPBHDJVCGUBRE-YTQUADARSA-N 1 3 341.515 2.637 10 0 EFAEHO CCCCC[NH2+][C@H](C)CN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001571406195 1086790343 /nfs/dbraw/zinc/79/03/43/1086790343.db2.gz XBIZEPMPPXVWHB-CRAIPNDOSA-N 1 3 329.504 2.826 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CC[C@@H](C[NH2+]CCCC(C)(C)C)C1 ZINC001571548418 1086952922 /nfs/dbraw/zinc/95/29/22/1086952922.db2.gz ODQMITGPUHPHRB-HZPDHXFCSA-N 1 3 334.508 2.961 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H]2CC[C@@H](C[NH2+]C/C=C\Cl)C2)c1 ZINC001571550936 1086954146 /nfs/dbraw/zinc/95/41/46/1086954146.db2.gz WBUDXRCXCZOTKR-AEAPKAQYSA-N 1 3 349.906 2.989 10 0 EFAEHO CC(C)=CCN[C@@H]1CN(C(=O)CCC[NH+](C)C)CC[C@H]1C(F)(F)F ZINC001571652359 1087023090 /nfs/dbraw/zinc/02/30/90/1087023090.db2.gz MOUMSOJJKGLFKA-HUUCEWRRSA-N 1 3 349.441 2.663 10 0 EFAEHO CCCN1CCCC[C@@H]1C(=O)N1CC[C@H](c2ccc(F)cc2)[C@@H]([NH3+])C1 ZINC001647248010 1089162530 /nfs/dbraw/zinc/16/25/30/1089162530.db2.gz LYWOWJPZBKXFGZ-CEXWTWQISA-N 1 3 347.478 2.733 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCCC1)C[NH2+]CCc1ccccc1 ZINC001649447259 1092473375 /nfs/dbraw/zinc/47/33/75/1092473375.db2.gz RJXJNPSDVGKJAA-SFHVURJKSA-N 1 3 345.531 2.836 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001267070373 1092540355 /nfs/dbraw/zinc/54/03/55/1092540355.db2.gz LOAMFJLIZKDWLZ-LJQANCHMSA-N 1 3 345.531 2.706 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001267116897 1092799229 /nfs/dbraw/zinc/79/92/29/1092799229.db2.gz JINBHZFVZXWMKN-LJQANCHMSA-N 1 3 342.487 2.590 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001267173597 1093062415 /nfs/dbraw/zinc/06/24/15/1093062415.db2.gz AWWVFZCMXWIKDB-YJBOKZPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001267173597 1093062426 /nfs/dbraw/zinc/06/24/26/1093062426.db2.gz AWWVFZCMXWIKDB-YJBOKZPZSA-N 1 3 327.488 2.580 10 0 EFAEHO Cc1cncc(C[N@H+]2CCC[C@@H]2CCCNC(=O)CN(C)C(C)C)c1 ZINC001267180638 1093099365 /nfs/dbraw/zinc/09/93/65/1093099365.db2.gz AVJMPZSXEOWWAS-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1cncc(C[N@@H+]2CCC[C@@H]2CCCNC(=O)CN(C)C(C)C)c1 ZINC001267180638 1093099374 /nfs/dbraw/zinc/09/93/74/1093099374.db2.gz AVJMPZSXEOWWAS-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO CCCCC[NH2+][C@H](C)C1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001267201382 1093177787 /nfs/dbraw/zinc/17/77/87/1093177787.db2.gz NHUGYXJDGGXMCZ-SJLPKXTDSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@H]2CCCN2CCCCC(F)(F)F)CC[N@@H+]1C ZINC001267267961 1093425817 /nfs/dbraw/zinc/42/58/17/1093425817.db2.gz UUBWRKRWGGLFTI-RBSFLKMASA-N 1 3 349.441 2.640 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@H]2CCCN2CCCCC(F)(F)F)CC[N@H+]1C ZINC001267267961 1093425821 /nfs/dbraw/zinc/42/58/21/1093425821.db2.gz UUBWRKRWGGLFTI-RBSFLKMASA-N 1 3 349.441 2.640 10 0 EFAEHO CC(C)=CCN1CCC[C@@H]1CNC(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001267277071 1093455718 /nfs/dbraw/zinc/45/57/18/1093455718.db2.gz YPYCZLVURCTQJR-APWZRJJASA-N 1 3 339.499 2.746 10 0 EFAEHO CC(C)=CCN1CCC[C@@H]1CNC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001267277071 1093455719 /nfs/dbraw/zinc/45/57/19/1093455719.db2.gz YPYCZLVURCTQJR-APWZRJJASA-N 1 3 339.499 2.746 10 0 EFAEHO CN(CCNCc1cccc(F)c1)C(=O)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001267384545 1094442481 /nfs/dbraw/zinc/44/24/81/1094442481.db2.gz WQLYDWZFWZLKBY-LJQANCHMSA-N 1 3 347.478 2.781 10 0 EFAEHO CN(CCNCc1cccc(F)c1)C(=O)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001267384545 1094442489 /nfs/dbraw/zinc/44/24/89/1094442489.db2.gz WQLYDWZFWZLKBY-LJQANCHMSA-N 1 3 347.478 2.781 10 0 EFAEHO CN(CC[NH2+]Cc1ccc(Cl)c(F)c1)C(=O)[C@H]1CCCCN1C ZINC001267391135 1094469119 /nfs/dbraw/zinc/46/91/19/1094469119.db2.gz BJZHCERFPONGTO-MRXNPFEDSA-N 1 3 341.858 2.511 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[NH2+]C/C=C/c1ccc(Cl)cc1)N(C)C ZINC001267456600 1094556772 /nfs/dbraw/zinc/55/67/72/1094556772.db2.gz CISMFNVFRPSURR-LXXRFIIISA-N 1 3 337.895 2.741 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@H+](Cc2ccccc2C2CC2)C1)N(C)C ZINC001481119097 1094733222 /nfs/dbraw/zinc/73/32/22/1094733222.db2.gz QYIGOSPDNBUAGZ-OXJNMPFZSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2C2CC2)C1)N(C)C ZINC001481119097 1094733234 /nfs/dbraw/zinc/73/32/34/1094733234.db2.gz QYIGOSPDNBUAGZ-OXJNMPFZSA-N 1 3 343.515 2.842 10 0 EFAEHO CCC/C=C/CC[NH+]1CC2(C1)CCN(C(=O)CN1CCCC1)CC2 ZINC001268046497 1094860527 /nfs/dbraw/zinc/86/05/27/1094860527.db2.gz COKSSCHVTHZXKE-SNAWJCMRSA-N 1 3 333.520 2.753 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001481507805 1094998578 /nfs/dbraw/zinc/99/85/78/1094998578.db2.gz DXJJGLOMORGARY-LJQANCHMSA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001481507805 1094998588 /nfs/dbraw/zinc/99/85/88/1094998588.db2.gz DXJJGLOMORGARY-LJQANCHMSA-N 1 3 345.531 2.924 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)CC1CCN(C(=O)[C@H]2CCCCN2CC)CC1 ZINC001481521678 1095090658 /nfs/dbraw/zinc/09/06/58/1095090658.db2.gz NFWQJEVRLNZNDW-QZTJIDSGSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)CC1CCN(C(=O)[C@H]2CCCCN2CC)CC1 ZINC001481521678 1095090673 /nfs/dbraw/zinc/09/06/73/1095090673.db2.gz NFWQJEVRLNZNDW-QZTJIDSGSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](F)C[N@H+](C)CC1CCN(C(=O)[C@@H]2CCCCN2CC)CC1 ZINC001481521679 1095091113 /nfs/dbraw/zinc/09/11/13/1095091113.db2.gz NFWQJEVRLNZNDW-ROUUACIJSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)CC1CCN(C(=O)[C@@H]2CCCCN2CC)CC1 ZINC001481521679 1095091127 /nfs/dbraw/zinc/09/11/27/1095091127.db2.gz NFWQJEVRLNZNDW-ROUUACIJSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N(CCF)CCCNC(=O)[C@H]1C[N@H+](C)C[C@@H]1c1ccccc1 ZINC001267509086 1095121486 /nfs/dbraw/zinc/12/14/86/1095121486.db2.gz MSLCHTZOJGTSLA-MOPGFXCFSA-N 1 3 349.494 2.518 10 0 EFAEHO CC(C)N(CCF)CCCNC(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1 ZINC001267509086 1095121491 /nfs/dbraw/zinc/12/14/91/1095121491.db2.gz MSLCHTZOJGTSLA-MOPGFXCFSA-N 1 3 349.494 2.518 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]CCc1ccc(Cl)cc1)N(C)C ZINC001268072388 1095169238 /nfs/dbraw/zinc/16/92/38/1095169238.db2.gz UHBQKOVDNIPMNR-RHSMWYFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CC/C=C/CC[NH2+][C@@H]1CCN(C(=O)CN2CCC(C)CC2)C[C@H]1C ZINC001268137507 1095475005 /nfs/dbraw/zinc/47/50/05/1095475005.db2.gz HWUAYIATURFKQH-ASIGSXEYSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+]CC[C@H]1CCCCN1C(=O)Cc1c[nH]cn1 ZINC001268162060 1095596220 /nfs/dbraw/zinc/59/62/20/1095596220.db2.gz SUCHRWWCZCXRFH-SJLPKXTDSA-N 1 3 334.508 2.995 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)N[C@H]1CCN(CCCCCF)C1 ZINC001267725215 1095689761 /nfs/dbraw/zinc/68/97/61/1095689761.db2.gz JKGGNQSUSZXKNP-INIZCTEOSA-N 1 3 341.515 2.970 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)N[C@H]1CCN(CCCCCF)C1 ZINC001267725215 1095689768 /nfs/dbraw/zinc/68/97/68/1095689768.db2.gz JKGGNQSUSZXKNP-INIZCTEOSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1CC[NH2+]Cc1ccccc1 ZINC001268166865 1095751591 /nfs/dbraw/zinc/75/15/91/1095751591.db2.gz OOBVMBOCRNYOSB-IBGZPJMESA-N 1 3 331.504 2.888 10 0 EFAEHO CC[C@H](F)C[NH2+]CC[C@@H]1CCCCN1C(=O)CN1CCC(C)CC1 ZINC001268168290 1095853788 /nfs/dbraw/zinc/85/37/88/1095853788.db2.gz VOOAPIQSOLEIKQ-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CCNC(=O)[C@H](C(C)C)[NH+]1CCCC1)Cc1ccc(F)cc1 ZINC001481019614 1095884723 /nfs/dbraw/zinc/88/47/23/1095884723.db2.gz YZPAHIAYBSRZIV-IBGZPJMESA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H]1CCC[N@@H+]1CCCCCF ZINC001481041169 1096124451 /nfs/dbraw/zinc/12/44/51/1096124451.db2.gz ZPBPEAIXVKSPQN-DLBZAZTESA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H]1CCC[N@H+]1CCCCCF ZINC001481041169 1096124458 /nfs/dbraw/zinc/12/44/58/1096124458.db2.gz ZPBPEAIXVKSPQN-DLBZAZTESA-N 1 3 327.488 2.580 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H]3[C@@H](CC[N@@H+]3CCCCCF)C2)CCC1 ZINC001268265946 1096213571 /nfs/dbraw/zinc/21/35/71/1096213571.db2.gz YFMXMAMYFQFRNS-IRXDYDNUSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3CCCCCF)C2)CCC1 ZINC001268265946 1096213579 /nfs/dbraw/zinc/21/35/79/1096213579.db2.gz YFMXMAMYFQFRNS-IRXDYDNUSA-N 1 3 339.499 2.533 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]CC1CC2(CCC2)C1 ZINC001268364109 1096397609 /nfs/dbraw/zinc/39/76/09/1096397609.db2.gz AUXHBWXOTMOFAN-SJLPKXTDSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C)CC[NH2+]CCc1ccccc1 ZINC001268368650 1096402896 /nfs/dbraw/zinc/40/28/96/1096402896.db2.gz ZWDUQQUDJOVANN-MJGOQNOKSA-N 1 3 331.504 2.586 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccccc1Cl)NC(=O)CN(C)C1CCC1 ZINC001268372836 1096414264 /nfs/dbraw/zinc/41/42/64/1096414264.db2.gz LRDZUCAFJQHFKP-CQSZACIVSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccc2c(c1)CCC2)NC(=O)CN1CC[C@@H](C)C1 ZINC001268399873 1096493779 /nfs/dbraw/zinc/49/37/79/1096493779.db2.gz NDFRYHQCPIUYJO-IAGOWNOFSA-N 1 3 343.515 2.502 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1cccc(F)c1Cl)N(C)C ZINC001268412810 1096542721 /nfs/dbraw/zinc/54/27/21/1096542721.db2.gz AZKTXZMTTBCLSB-DOMZBBRYSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001268414592 1096557826 /nfs/dbraw/zinc/55/78/26/1096557826.db2.gz LKFGTRKACJVKQU-HKUYNNGSSA-N 1 3 333.520 2.936 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+]Cc1cc2ccccc2o1 ZINC001268427066 1096582584 /nfs/dbraw/zinc/58/25/84/1096582584.db2.gz UNFSJUWVPNXJBP-HNNXBMFYSA-N 1 3 331.460 2.757 10 0 EFAEHO CCN(C(=O)[C@H]1CCCN1C(C)C)[C@H]1CC[N@H+](CCCCCF)C1 ZINC001481766587 1096642317 /nfs/dbraw/zinc/64/23/17/1096642317.db2.gz MIDQQQURTNSUDX-ZWKOTPCHSA-N 1 3 341.515 2.922 10 0 EFAEHO CCN(C(=O)[C@H]1CCCN1C(C)C)[C@H]1CC[N@@H+](CCCCCF)C1 ZINC001481766587 1096642322 /nfs/dbraw/zinc/64/23/22/1096642322.db2.gz MIDQQQURTNSUDX-ZWKOTPCHSA-N 1 3 341.515 2.922 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCC[N@@H+]1C(C)C)NCC=C(Cl)Cl ZINC001481810365 1096723708 /nfs/dbraw/zinc/72/37/08/1096723708.db2.gz GACVEWMAFTWKHU-STQMWFEESA-N 1 3 336.307 2.663 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCC[N@H+]1C(C)C)NCC=C(Cl)Cl ZINC001481810365 1096723710 /nfs/dbraw/zinc/72/37/10/1096723710.db2.gz GACVEWMAFTWKHU-STQMWFEESA-N 1 3 336.307 2.663 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCc1cccs1 ZINC001481838397 1096775678 /nfs/dbraw/zinc/77/56/78/1096775678.db2.gz BIAPCNUKVSSLAD-HNNXBMFYSA-N 1 3 337.533 2.649 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(Cl)c(F)c1)C(=O)[C@H]1CCCN1C ZINC001268470870 1096832753 /nfs/dbraw/zinc/83/27/53/1096832753.db2.gz HNBUBTXNSFQGNU-MRXNPFEDSA-N 1 3 341.858 2.511 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC2(CNCc3ccccc3F)CCCC2)C1 ZINC001481910640 1096911120 /nfs/dbraw/zinc/91/11/20/1096911120.db2.gz ULZRJQFPTOOCII-MRXNPFEDSA-N 1 3 347.478 2.686 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC2(CNCc3ccccc3F)CCCC2)C1 ZINC001481910640 1096911125 /nfs/dbraw/zinc/91/11/25/1096911125.db2.gz ULZRJQFPTOOCII-MRXNPFEDSA-N 1 3 347.478 2.686 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001268491164 1096959557 /nfs/dbraw/zinc/95/95/57/1096959557.db2.gz LIQOVKARJSRXLW-SJORKVTESA-N 1 3 337.533 2.807 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)[C@H](C(C)C)[NH+]1CCCC1 ZINC001268499379 1096998213 /nfs/dbraw/zinc/99/82/13/1096998213.db2.gz KRQSSRIZUBQITN-IBGZPJMESA-N 1 3 349.494 2.884 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)cc1)C(=O)[C@@H]1CCCCN1CC ZINC001268499885 1097008241 /nfs/dbraw/zinc/00/82/41/1097008241.db2.gz RTFJUFIDCLJYLQ-IBGZPJMESA-N 1 3 331.504 2.808 10 0 EFAEHO CC(C)CC[NH2+]CC[C@@H]1CCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001481976421 1097034500 /nfs/dbraw/zinc/03/45/00/1097034500.db2.gz IWZQRLSSGAQYLV-ROUUACIJSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](CC[NH2+]CCc2ccccc2)C1)N(C)C ZINC001481981121 1097036398 /nfs/dbraw/zinc/03/63/98/1097036398.db2.gz JYIFQLXMPMYDEO-WOJBJXKFSA-N 1 3 345.531 2.788 10 0 EFAEHO CC[C@H](F)C[NH2+]CCC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001482006250 1097083462 /nfs/dbraw/zinc/08/34/62/1097083462.db2.gz QPLGTTQKRVZCIA-SFHVURJKSA-N 1 3 341.515 2.685 10 0 EFAEHO CC(C)(C(=O)NC/C=C/CNCc1ccc(F)cc1)[NH+]1CCCCC1 ZINC001268537797 1097147205 /nfs/dbraw/zinc/14/72/05/1097147205.db2.gz DIECSVGLMRPAPH-SNAWJCMRSA-N 1 3 347.478 2.852 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001482056690 1097194491 /nfs/dbraw/zinc/19/44/91/1097194491.db2.gz ZRZNNUDMELUNAL-KGLIPLIRSA-N 1 3 348.318 2.759 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001482056690 1097194494 /nfs/dbraw/zinc/19/44/94/1097194494.db2.gz ZRZNNUDMELUNAL-KGLIPLIRSA-N 1 3 348.318 2.759 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)C[NH2+]C/C=C/c1ccccc1 ZINC001482101047 1097258872 /nfs/dbraw/zinc/25/88/72/1097258872.db2.gz KMPDMOPUINKVRO-CNLJBLCWSA-N 1 3 343.515 2.915 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)C[NH2+]CC1CC2(CCC2)C1 ZINC001482101709 1097261869 /nfs/dbraw/zinc/26/18/69/1097261869.db2.gz PCTWQZUCWHMRSQ-AEFFLSMTSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)C[NH2+]CC1CC2(CCC2)C1 ZINC001482101710 1097262079 /nfs/dbraw/zinc/26/20/79/1097262079.db2.gz PCTWQZUCWHMRSQ-FUHWJXTLSA-N 1 3 335.536 2.781 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H](C)CNC(=O)C(C)(C)N2CCCC2)c1 ZINC001482130801 1097299595 /nfs/dbraw/zinc/29/95/95/1097299595.db2.gz RCGSFNVOEVUBFP-INIZCTEOSA-N 1 3 349.494 2.850 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\C[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001268587303 1097306202 /nfs/dbraw/zinc/30/62/02/1097306202.db2.gz IKTDYBQRGOVREA-LGZALOBFSA-N 1 3 345.478 2.660 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C\C[NH2+][C@@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001268593290 1097329644 /nfs/dbraw/zinc/32/96/44/1097329644.db2.gz UBTPSUDKXLDZTK-WIJVFFIESA-N 1 3 349.906 2.930 10 0 EFAEHO CCCCC[NH2+]C[C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001482141448 1097396072 /nfs/dbraw/zinc/39/60/72/1097396072.db2.gz DDPNJDUMVBKXKC-MAUKXSAKSA-N 1 3 329.504 2.731 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C/C[NH2+]CC1CCC(C)CC1 ZINC001268630864 1097485172 /nfs/dbraw/zinc/48/51/72/1097485172.db2.gz RGQWBCSXOZRMMJ-BKBBAENRSA-N 1 3 335.536 2.949 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C[NH2+]CCc1ccccc1Cl)N(C)C ZINC001268649471 1097503204 /nfs/dbraw/zinc/50/32/04/1097503204.db2.gz LGQYSJVBLVVWNA-PBHICJAKSA-N 1 3 339.911 2.563 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CCc1ccc(C)cc1 ZINC001268688684 1097541788 /nfs/dbraw/zinc/54/17/88/1097541788.db2.gz GHKOTZVUOQPNED-PKOBYXMFSA-N 1 3 331.504 2.506 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[NH2+]Cc2cccc(Cl)c2)CCC1 ZINC001268797794 1097644188 /nfs/dbraw/zinc/64/41/88/1097644188.db2.gz XWKHQQBIFRNXRM-UHFFFAOYSA-N 1 3 337.895 2.762 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)CN(C)C1CCC1)c1cccc(F)c1 ZINC001268797829 1097645486 /nfs/dbraw/zinc/64/54/86/1097645486.db2.gz YXLQHDFKMBFZSW-OAHLLOKOSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)[C@H]1CCCN1C)c1cc(F)ccc1F ZINC001268812268 1097660384 /nfs/dbraw/zinc/66/03/84/1097660384.db2.gz UCEIRVCVHHAERD-SUMWQHHRSA-N 1 3 339.430 2.558 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(Cl)c(F)c1)C(=O)[C@H]1CCCN1C ZINC001268811660 1097660521 /nfs/dbraw/zinc/66/05/21/1097660521.db2.gz PHRVMIQWEWBCRD-MRXNPFEDSA-N 1 3 341.858 2.511 10 0 EFAEHO CN(CCC[NH2+]Cc1cccc2ccccc21)C(=O)[C@H]1CCCN1C ZINC001268812690 1097661283 /nfs/dbraw/zinc/66/12/83/1097661283.db2.gz VSZYABHBRHYPBG-HXUWFJFHSA-N 1 3 339.483 2.872 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CCCN(C)C(=O)[C@H](C(C)C)N(C)C)c1 ZINC001268920350 1097719221 /nfs/dbraw/zinc/71/92/21/1097719221.db2.gz NAZUQNIMDAOOCH-IBGZPJMESA-N 1 3 333.520 2.828 10 0 EFAEHO CC[C@H]1CN(C(=O)CN2CCC(C)CC2)CC[C@H]1[NH2+]CC=C(C)C ZINC001269183798 1097929262 /nfs/dbraw/zinc/92/92/62/1097929262.db2.gz VZGRSRTYLQFVDX-RBUKOAKNSA-N 1 3 335.536 2.901 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@@H](CC[NH2+]Cc2ccsc2)C1 ZINC001269712024 1098388206 /nfs/dbraw/zinc/38/82/06/1098388206.db2.gz NHUNIWNAASJEIA-DOTOQJQBSA-N 1 3 335.517 2.561 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H](CC[NH2+]Cc2ccsc2)C1 ZINC001269712027 1098388511 /nfs/dbraw/zinc/38/85/11/1098388511.db2.gz NHUNIWNAASJEIA-WBVHZDCISA-N 1 3 335.517 2.561 10 0 EFAEHO Cc1cc(C[NH2+]CCC2CCN(C(=O)[C@H]3CCCN3C)CC2)cs1 ZINC001269837023 1098470873 /nfs/dbraw/zinc/47/08/73/1098470873.db2.gz AYYHOMXSEXAXCP-GOSISDBHSA-N 1 3 349.544 2.869 10 0 EFAEHO CCCN(C)CC(=O)N1CCC2(C[NH+](CC3CC4(CCC4)C3)C2)CC1 ZINC001482245736 1098474168 /nfs/dbraw/zinc/47/41/68/1098474168.db2.gz NUMGSSZAGXWIST-UHFFFAOYSA-N 1 3 347.547 2.833 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@H]1CCCN1C(=O)[C@@H]1CCCN1C ZINC001270022116 1098603553 /nfs/dbraw/zinc/60/35/53/1098603553.db2.gz KXEFNJIKVUIKOZ-UXHICEINSA-N 1 3 343.515 2.602 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC(CC[NH2+]CC3CCCC3)CC2)C1 ZINC001267914577 1098624797 /nfs/dbraw/zinc/62/47/97/1098624797.db2.gz KIJPXHFPGACTET-KRWDZBQOSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)CC[NH2+]CCC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001267916515 1098635547 /nfs/dbraw/zinc/63/55/47/1098635547.db2.gz BFEGDHYPMXLJFR-UHFFFAOYSA-N 1 3 337.552 2.983 10 0 EFAEHO O=C(NCc1ccc(CNC/C=C\Cl)cc1)C12CCC[NH+]1CCC2 ZINC001270065149 1098650633 /nfs/dbraw/zinc/65/06/33/1098650633.db2.gz FXJIHZCQKDEEQW-KMKOMSMNSA-N 1 3 347.890 2.773 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]CCN(C)C(=O)C2(N(C)C)CCC2)cc1 ZINC001481238619 1098746118 /nfs/dbraw/zinc/74/61/18/1098746118.db2.gz BICZWFLAGRGDGW-UHFFFAOYSA-N 1 3 345.531 2.917 10 0 EFAEHO O=C(CN1CCCC1)N1CCC[C@@H]1C[NH2+]CCc1ccccc1Cl ZINC001270188942 1098780093 /nfs/dbraw/zinc/78/00/93/1098780093.db2.gz UYFFKRRARWOBAH-QGZVFWFLSA-N 1 3 349.906 2.559 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]CC[C@@H]1CCCC1(F)F ZINC001267968779 1098978836 /nfs/dbraw/zinc/97/88/36/1098978836.db2.gz CFZMKEQUPGXSNV-JKSUJKDBSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001482285189 1099038627 /nfs/dbraw/zinc/03/86/27/1099038627.db2.gz UQTHKOBTLBTASH-YJBOKZPZSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001482285189 1099038639 /nfs/dbraw/zinc/03/86/39/1099038639.db2.gz UQTHKOBTLBTASH-YJBOKZPZSA-N 1 3 335.467 2.635 10 0 EFAEHO O=C(N[C@H](CNCCF)C1CCCC1)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001270404252 1099060228 /nfs/dbraw/zinc/06/02/28/1099060228.db2.gz VDLXSRLAYQPWLV-QZTJIDSGSA-N 1 3 339.499 2.628 10 0 EFAEHO O=C(N[C@H](CNCCF)C1CCCC1)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001270404252 1099060242 /nfs/dbraw/zinc/06/02/42/1099060242.db2.gz VDLXSRLAYQPWLV-QZTJIDSGSA-N 1 3 339.499 2.628 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@]1(C)CC[N@H+](CCCCCF)C1 ZINC001270582543 1099230780 /nfs/dbraw/zinc/23/07/80/1099230780.db2.gz IHMCVJSQNSQHFY-FUHWJXTLSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@]1(C)CC[N@@H+](CCCCCF)C1 ZINC001270582543 1099230787 /nfs/dbraw/zinc/23/07/87/1099230787.db2.gz IHMCVJSQNSQHFY-FUHWJXTLSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H](C(=O)N1CCC([C@@H](C)[NH2+]CCCC(C)C)CC1)N(C)C ZINC001481340410 1099372584 /nfs/dbraw/zinc/37/25/84/1099372584.db2.gz QXNORBWQMCMAGZ-SJLPKXTDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)N1CCC([C@H](C)[NH2+]CCCC(C)C)CC1)N(C)C ZINC001481340409 1099372743 /nfs/dbraw/zinc/37/27/43/1099372743.db2.gz QXNORBWQMCMAGZ-FUHWJXTLSA-N 1 3 325.541 2.980 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC([C@H](C)[NH2+]CCC2CC2)CC1 ZINC001481341902 1099375962 /nfs/dbraw/zinc/37/59/62/1099375962.db2.gz BHITYWDOJCXLKW-LPHOPBHVSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](NCCN(C)C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccccc1F ZINC001481271456 1099414946 /nfs/dbraw/zinc/41/49/46/1099414946.db2.gz DDUIMLIKLBTRCB-JYJNAYRXSA-N 1 3 335.467 2.665 10 0 EFAEHO C[C@H](NCCN(C)C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccccc1F ZINC001481271456 1099414956 /nfs/dbraw/zinc/41/49/56/1099414956.db2.gz DDUIMLIKLBTRCB-JYJNAYRXSA-N 1 3 335.467 2.665 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@](C)(C[NH2+]CCC3CCCC3)C2)C1 ZINC001270795842 1099567435 /nfs/dbraw/zinc/56/74/35/1099567435.db2.gz BATNLYZZJVGDOY-YLJYHZDGSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H](C[NH2+]CCc1cccs1)N(C)C(=O)CN(C)CC(C)(C)C ZINC001482329863 1099619530 /nfs/dbraw/zinc/61/95/30/1099619530.db2.gz FKHNWWZZUHUEFV-OAHLLOKOSA-N 1 3 339.549 2.705 10 0 EFAEHO CCCN(C(=O)CC1CC[NH+](C)CC1)[C@H]1CCN(CC=C(C)C)C1 ZINC001481406371 1099655867 /nfs/dbraw/zinc/65/58/67/1099655867.db2.gz IARVVCZTPIHLLB-IBGZPJMESA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@@H](C)N(C)C(=O)Cc2c[nH]cn2)c(C)c1 ZINC001482335441 1099659212 /nfs/dbraw/zinc/65/92/12/1099659212.db2.gz LYTIXXQPMYTBDZ-MRXNPFEDSA-N 1 3 328.460 2.514 10 0 EFAEHO C[C@H](C[NH2+]CCCc1ccccc1)N(C)C(=O)CN1CCC(C)CC1 ZINC001482343183 1099703903 /nfs/dbraw/zinc/70/39/03/1099703903.db2.gz GHPXDEVRUDMZMX-LJQANCHMSA-N 1 3 345.531 2.788 10 0 EFAEHO C[C@@H]1CCCC[C@]1(C[NH2+]CCF)NC(=O)c1cccc(CN(C)C)c1 ZINC001267873594 1099786221 /nfs/dbraw/zinc/78/62/21/1099786221.db2.gz ZESGGEJJFCFIHO-OXQOHEQNSA-N 1 3 349.494 2.986 10 0 EFAEHO CC(C)=CC[NH2+]C[C@]1(NC(=O)Cc2nc[nH]c2C)CCCC[C@H]1C ZINC001267874569 1099795148 /nfs/dbraw/zinc/79/51/48/1099795148.db2.gz WNOUOQZHOXXFAC-DNVCBOLYSA-N 1 3 332.492 2.882 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N[C@H](CNCCF)C2CCCCC2)C1 ZINC001482410634 1100067257 /nfs/dbraw/zinc/06/72/57/1100067257.db2.gz YQIHTOYOJDVIGN-ZWKOTPCHSA-N 1 3 341.515 2.733 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N[C@H](CNCCF)C2CCCCC2)C1 ZINC001482410634 1100067269 /nfs/dbraw/zinc/06/72/69/1100067269.db2.gz YQIHTOYOJDVIGN-ZWKOTPCHSA-N 1 3 341.515 2.733 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001482439857 1100232932 /nfs/dbraw/zinc/23/29/32/1100232932.db2.gz WKYSYVGNGRWYHA-MJGOQNOKSA-N 1 3 331.504 2.662 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@H]2CCCCN2C(=O)[C@@H]2CCCN2C)c1 ZINC001482443780 1100273602 /nfs/dbraw/zinc/27/36/02/1100273602.db2.gz FCALTBKULCRXOF-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO C[C@@H](C[NH2+]C/C=C/c1ccccc1)N(C)C(=O)CN(C)C1CCC1 ZINC001270995415 1100350817 /nfs/dbraw/zinc/35/08/17/1100350817.db2.gz KEBMHEBHHZCVCJ-YRYLYKBFSA-N 1 3 329.488 2.621 10 0 EFAEHO CC(C)CC[NH2+]C[C@@H](C)N(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001271102038 1100480435 /nfs/dbraw/zinc/48/04/35/1100480435.db2.gz PJIMFELLHYSJAJ-QAPCUYQASA-N 1 3 329.504 2.682 10 0 EFAEHO C/C(=C/C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccccc1C ZINC001632635195 1100490424 /nfs/dbraw/zinc/49/04/24/1100490424.db2.gz JLIIIJYUDPHXAT-DNKLCNGGSA-N 1 3 331.504 2.787 10 0 EFAEHO C/C(=C/C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccccc1C ZINC001632635195 1100490427 /nfs/dbraw/zinc/49/04/27/1100490427.db2.gz JLIIIJYUDPHXAT-DNKLCNGGSA-N 1 3 331.504 2.787 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1CC[NH2+]CCC(F)(F)F ZINC001482463134 1100634425 /nfs/dbraw/zinc/63/44/25/1100634425.db2.gz PXSAFSHDPGHOEZ-CQSZACIVSA-N 1 3 337.430 2.641 10 0 EFAEHO CCC[NH2+]C[C@H](CC(C)C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001271293802 1101346541 /nfs/dbraw/zinc/34/65/41/1101346541.db2.gz LTYOTWXWUPUOHE-MAUKXSAKSA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)C[C@H](C[NH2+]CCCF)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001271295850 1101348161 /nfs/dbraw/zinc/34/81/61/1101348161.db2.gz YILZWSWAXSNQPE-CRAIPNDOSA-N 1 3 347.494 2.679 10 0 EFAEHO CC[C@@H]1CN(C(=O)C2(N(C)C)CCC2)CC[C@H]1[NH2+]CCCCCF ZINC001670580829 1101358743 /nfs/dbraw/zinc/35/87/43/1101358743.db2.gz BLSKTCRDZCEBHR-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccccc1[C@@H](C)N1CC[C@@H]1CNC(=O)CCCC[NH+](C)C ZINC001670714667 1101636566 /nfs/dbraw/zinc/63/65/66/1101636566.db2.gz UGCADLXJDNQUFV-QZTJIDSGSA-N 1 3 331.504 2.978 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC/C=C\c2ccccc2)C1)N(C)C ZINC001266711242 1101980046 /nfs/dbraw/zinc/98/00/46/1101980046.db2.gz QBOHDSUPMNCUJE-IPDCARMESA-N 1 3 343.515 2.913 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001266725267 1102033356 /nfs/dbraw/zinc/03/33/56/1102033356.db2.gz ANOFWURTCXVORF-HSALFYBXSA-N 1 3 345.531 2.751 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[NH2+]Cc1ccc(C(F)F)cc1)N(C)C ZINC001266733454 1102051938 /nfs/dbraw/zinc/05/19/38/1102051938.db2.gz VWVGYMHDRXVPCY-INIZCTEOSA-N 1 3 341.446 2.758 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([C@H](C)[NH2+]CCCC(C)(C)C)C1 ZINC001271550549 1102113514 /nfs/dbraw/zinc/11/35/14/1102113514.db2.gz OSSPRBSQVCRWPY-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H]1CCN(C(=O)CN(C)C2CCC2)[C@H](C[NH2+]CCC(F)(F)F)C1 ZINC001656547090 1102119226 /nfs/dbraw/zinc/11/92/26/1102119226.db2.gz VASWIQGEJYAJQA-HIFRSBDPSA-N 1 3 349.441 2.640 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]CCCC(C)C)N(C)C ZINC001656588233 1102129913 /nfs/dbraw/zinc/12/99/13/1102129913.db2.gz LOZRFUOELLHYNE-SQNIBIBYSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCCC[C@@H]2CC[NH2+]CCC(F)(F)F)C1 ZINC001271578031 1102130491 /nfs/dbraw/zinc/13/04/91/1102130491.db2.gz ZREZHTCYXSHVPP-LSDHHAIUSA-N 1 3 349.441 2.641 10 0 EFAEHO CCC/C=C\CC[N@H+](C)C[C@H]1CCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001266469069 1102199160 /nfs/dbraw/zinc/19/91/60/1102199160.db2.gz DOZLSLCNGZQJGA-KEGWNNHHSA-N 1 3 332.492 2.869 10 0 EFAEHO CCC/C=C\CC[N@@H+](C)C[C@H]1CCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001266469069 1102199165 /nfs/dbraw/zinc/19/91/65/1102199165.db2.gz DOZLSLCNGZQJGA-KEGWNNHHSA-N 1 3 332.492 2.869 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](C[NH2+]CCc2ccccc2F)C1)N(C)C ZINC001266793332 1102248067 /nfs/dbraw/zinc/24/80/67/1102248067.db2.gz LABYYVMJEYOPGH-VQIMIIECSA-N 1 3 349.494 2.537 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCCCC[C@H]([NH2+]CCCF)C1 ZINC001656903013 1102252748 /nfs/dbraw/zinc/25/27/48/1102252748.db2.gz BMYOVNUWAQXDHQ-ROUUACIJSA-N 1 3 341.515 2.970 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CC[N@H+](CC2=CCCCC2)[C@@H]1C ZINC001656956913 1102272111 /nfs/dbraw/zinc/27/21/11/1102272111.db2.gz CETCNRUYDGKCQD-NJAFHUGGSA-N 1 3 339.499 2.746 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CC[N@@H+](CC2=CCCCC2)[C@@H]1C ZINC001656956913 1102272122 /nfs/dbraw/zinc/27/21/22/1102272122.db2.gz CETCNRUYDGKCQD-NJAFHUGGSA-N 1 3 339.499 2.746 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001266807030 1102289309 /nfs/dbraw/zinc/28/93/09/1102289309.db2.gz BODFBOAWDNDTQE-HZPDHXFCSA-N 1 3 329.504 2.541 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[NH2+]Cc1ccc(C(F)(F)F)cc1)N(C)C ZINC001266836312 1102389332 /nfs/dbraw/zinc/38/93/32/1102389332.db2.gz NAGJOFQMPKRDPC-HNNXBMFYSA-N 1 3 345.409 2.594 10 0 EFAEHO Cc1cncc(C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)c1 ZINC000397528454 1102397892 /nfs/dbraw/zinc/39/78/92/1102397892.db2.gz XTXLVLVKIMXNGP-UHFFFAOYSA-N 1 3 325.456 2.507 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C)[C@@H]1C[NH2+]CC1CC(C)(C)C1 ZINC001482500481 1102419468 /nfs/dbraw/zinc/41/94/68/1102419468.db2.gz IMYZFAJDHYQQNQ-WMZOPIPTSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@H+](CCCCCF)C1)N1CCCCC1 ZINC001266514693 1102460093 /nfs/dbraw/zinc/46/00/93/1102460093.db2.gz UNMJWEFTLSNFJD-KRWDZBQOSA-N 1 3 341.515 2.829 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@@H+](CCCCCF)C1)N1CCCCC1 ZINC001266514693 1102460098 /nfs/dbraw/zinc/46/00/98/1102460098.db2.gz UNMJWEFTLSNFJD-KRWDZBQOSA-N 1 3 341.515 2.829 10 0 EFAEHO C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@@H]1C[NH2+]CCCC(C)(C)C ZINC001271739389 1102555578 /nfs/dbraw/zinc/55/55/78/1102555578.db2.gz MZAFEFIMJYZGIC-NVXWUHKLSA-N 1 3 334.508 2.995 10 0 EFAEHO C[C@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@H]1C[NH2+]CCCC(C)(C)C ZINC001271739390 1102556118 /nfs/dbraw/zinc/55/61/18/1102556118.db2.gz MZAFEFIMJYZGIC-RDJZCZTQSA-N 1 3 334.508 2.995 10 0 EFAEHO CN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1ccc2c(c1)CCC2 ZINC001480898592 1102629630 /nfs/dbraw/zinc/62/96/30/1102629630.db2.gz RHYSGWQOHUJWEB-UHFFFAOYSA-N 1 3 343.515 2.598 10 0 EFAEHO CC/C=C\CC[N@H+](C)CCC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001271778043 1102661432 /nfs/dbraw/zinc/66/14/32/1102661432.db2.gz AWOVHBOIPTXFKD-SFFCAUCYSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](C)CCC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001271778043 1102661439 /nfs/dbraw/zinc/66/14/39/1102661439.db2.gz AWOVHBOIPTXFKD-SFFCAUCYSA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1CCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001266547223 1102663172 /nfs/dbraw/zinc/66/31/72/1102663172.db2.gz LZYQXIBTDJPSCO-VQTJNVASSA-N 1 3 345.531 2.704 10 0 EFAEHO C[C@H](c1ccccc1F)N(C)CCCNC(=O)C[N@@H+]1CC[C@H](C)C1 ZINC001660304171 1102677534 /nfs/dbraw/zinc/67/75/34/1102677534.db2.gz SFGOAQVCOAGVAT-JKSUJKDBSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@H](c1ccccc1F)N(C)CCCNC(=O)C[N@H+]1CC[C@H](C)C1 ZINC001660304171 1102677541 /nfs/dbraw/zinc/67/75/41/1102677541.db2.gz SFGOAQVCOAGVAT-JKSUJKDBSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](C)[C@@H]2CCCc3ccccc32)C1 ZINC001660303990 1102678211 /nfs/dbraw/zinc/67/82/11/1102678211.db2.gz MIEZCRAHJWXVJW-FXAWDEMLSA-N 1 3 343.515 2.844 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](C)[C@@H]2CCCc3ccccc32)C1 ZINC001660303990 1102678214 /nfs/dbraw/zinc/67/82/14/1102678214.db2.gz MIEZCRAHJWXVJW-FXAWDEMLSA-N 1 3 343.515 2.844 10 0 EFAEHO Cc1ccc(CN(C)CCCNC(=O)CC[NH+]2CCCCC2)c(C)n1 ZINC001660408795 1102746413 /nfs/dbraw/zinc/74/64/13/1102746413.db2.gz NSDWUSSADZWRTD-UHFFFAOYSA-N 1 3 346.519 2.513 10 0 EFAEHO O=C([C@H]1CC[C@@H]2CCCC[N@H+]12)N(CCNCCF)Cc1ccccc1 ZINC001271805533 1102751904 /nfs/dbraw/zinc/75/19/04/1102751904.db2.gz BWZFXHNNTHJZMB-RBUKOAKNSA-N 1 3 347.478 2.591 10 0 EFAEHO O=C([C@H]1CC[C@@H]2CCCC[N@@H+]12)N(CCNCCF)Cc1ccccc1 ZINC001271805533 1102751915 /nfs/dbraw/zinc/75/19/15/1102751915.db2.gz BWZFXHNNTHJZMB-RBUKOAKNSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001482531433 1102819190 /nfs/dbraw/zinc/81/91/90/1102819190.db2.gz ACYLOCGRAJHWKG-CABCVRRESA-N 1 3 345.478 2.637 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@@H]1CCCC[N@@H+]1C(C)C ZINC001660599309 1102878850 /nfs/dbraw/zinc/87/88/50/1102878850.db2.gz VOEYOSBTLZNYQV-BJIFSAINSA-N 1 3 329.916 2.830 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@@H]1CCCC[N@H+]1C(C)C ZINC001660599309 1102878855 /nfs/dbraw/zinc/87/88/55/1102878855.db2.gz VOEYOSBTLZNYQV-BJIFSAINSA-N 1 3 329.916 2.830 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC001660749451 1102958565 /nfs/dbraw/zinc/95/85/65/1102958565.db2.gz NTXKLERBTWSRHB-INIZCTEOSA-N 1 3 340.471 2.993 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC001660749451 1102958573 /nfs/dbraw/zinc/95/85/73/1102958573.db2.gz NTXKLERBTWSRHB-INIZCTEOSA-N 1 3 340.471 2.993 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1cccc(C(F)F)c1 ZINC001409456415 1103106151 /nfs/dbraw/zinc/10/61/51/1103106151.db2.gz GOVIBPIGSOCHBY-UONOGXRCSA-N 1 3 341.446 2.947 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(C[C@H]2NC(=O)CN(C)C2CCC2)CC1 ZINC001661066957 1103107077 /nfs/dbraw/zinc/10/70/77/1103107077.db2.gz SEXAJBLHQQJTTA-PYTPGESOSA-N 1 3 333.520 2.798 10 0 EFAEHO CN(CC(=O)NC[C@H]([NH2+]CC1=CCCCC1)C1CC1)CC(C)(C)C ZINC001661167846 1103156147 /nfs/dbraw/zinc/15/61/47/1103156147.db2.gz KUSJAPXDGZDLPT-SFHVURJKSA-N 1 3 335.536 2.949 10 0 EFAEHO CC/C=C\CC[N@H+](C)C[C@@H]1CCCN(C(=O)CN(C)C2CCC2)C1 ZINC001661213608 1103178220 /nfs/dbraw/zinc/17/82/20/1103178220.db2.gz VFMFUDCGJHMBHA-XFHJGTJQSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](C)C[C@@H]1CCCN(C(=O)CN(C)C2CCC2)C1 ZINC001661213608 1103178231 /nfs/dbraw/zinc/17/82/31/1103178231.db2.gz VFMFUDCGJHMBHA-XFHJGTJQSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cc2ccccc2s1)NC(=O)CN1CC[C@@H](C)C1 ZINC001483266427 1103192169 /nfs/dbraw/zinc/19/21/69/1103192169.db2.gz MCFRWNJFFXBKBX-CABCVRRESA-N 1 3 345.512 2.837 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc(F)cc1C ZINC001483297190 1103282914 /nfs/dbraw/zinc/28/29/14/1103282914.db2.gz ZXALLIHTCWVHSO-YJBOKZPZSA-N 1 3 335.467 2.603 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc(C)cc1C ZINC001483296519 1103291671 /nfs/dbraw/zinc/29/16/71/1103291671.db2.gz JJHVKWAFMKUUHK-HKUYNNGSSA-N 1 3 331.504 2.772 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001661554530 1103312893 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2.540 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCc1ccccc1 ZINC001483422811 1103677859 /nfs/dbraw/zinc/67/78/59/1103677859.db2.gz ZGCYDUCGHQGXGK-PKOBYXMFSA-N 1 3 331.504 2.540 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)Cc1ccc(C(F)F)cc1 ZINC001483422681 1103678247 /nfs/dbraw/zinc/67/82/47/1103678247.db2.gz XXXGYEBJWLUDTN-AWEZNQCLSA-N 1 3 341.446 2.901 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC001483422681 1103678249 /nfs/dbraw/zinc/67/82/49/1103678249.db2.gz XXXGYEBJWLUDTN-AWEZNQCLSA-N 1 3 341.446 2.901 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1sccc1Cl ZINC001482570928 1103679032 /nfs/dbraw/zinc/67/90/32/1103679032.db2.gz HKUPPSAGMDGJGW-AWEZNQCLSA-N 1 3 345.940 2.972 10 0 EFAEHO Cc1ccc(C[NH2+]CCCN(C)C(=O)C2(N(C)C)CCC2)c(C)c1 ZINC001483470582 1103773012 /nfs/dbraw/zinc/77/30/12/1103773012.db2.gz SMGIHHQMZVOURC-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]C[C@@H]1CCc2ccccc2C1)N(C)C ZINC001483475044 1103783132 /nfs/dbraw/zinc/78/31/32/1103783132.db2.gz WYZCEDANRAHHFT-YLJYHZDGSA-N 1 3 345.531 2.570 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[NH2+]Cc2sccc2Cl)C1 ZINC001483492227 1103821462 /nfs/dbraw/zinc/82/14/62/1103821462.db2.gz ADJKWJJHDCLPST-ZDUSSCGKSA-N 1 3 343.924 2.681 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC001483492829 1103827473 /nfs/dbraw/zinc/82/74/73/1103827473.db2.gz KXFVFNURHUSJPT-DNVCBOLYSA-N 1 3 347.478 2.593 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]CCCN(C)C(=O)Cc1c[nH]cn1 ZINC001483495110 1103830516 /nfs/dbraw/zinc/83/05/16/1103830516.db2.gz PPTZWFSMTFEFAG-UHFFFAOYSA-N 1 3 334.851 2.552 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@H]2C[NH2+]CCc2cccs2)CCC1 ZINC001272269679 1104153673 /nfs/dbraw/zinc/15/36/73/1104153673.db2.gz FWTQRBTZFPTMHR-DOTOQJQBSA-N 1 3 349.544 2.649 10 0 EFAEHO CN(CC[NH2+]Cc1cc2ccccc2s1)C(=O)[C@@H]1CCCN1C ZINC001663856392 1104226674 /nfs/dbraw/zinc/22/66/74/1104226674.db2.gz UPTZHQBYNHXJOM-INIZCTEOSA-N 1 3 331.485 2.544 10 0 EFAEHO CC[C@H](F)C[N@H+](C)[C@@H](C)CNC(=O)c1sccc1CN(C)C ZINC001409568300 1104285320 /nfs/dbraw/zinc/28/53/20/1104285320.db2.gz JQGXSRSPTPRPMA-JSGCOSHPSA-N 1 3 329.485 2.608 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)[C@@H](C)CNC(=O)c1sccc1CN(C)C ZINC001409568300 1104285327 /nfs/dbraw/zinc/28/53/27/1104285327.db2.gz JQGXSRSPTPRPMA-JSGCOSHPSA-N 1 3 329.485 2.608 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[NH2+]C/C=C\c2ccc(Cl)cc2)C1 ZINC001664186735 1104311414 /nfs/dbraw/zinc/31/14/14/1104311414.db2.gz RWXPENMDYAVQIG-QGZUEGPWSA-N 1 3 349.906 2.743 10 0 EFAEHO COc1cc(C[NH2+]CCN(C)C(=O)CN(C)CC(C)(C)C)ccc1C ZINC001664186562 1104312590 /nfs/dbraw/zinc/31/25/90/1104312590.db2.gz PFVMOJXVTPGCDC-UHFFFAOYSA-N 1 3 349.519 2.530 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001409584011 1104363079 /nfs/dbraw/zinc/36/30/79/1104363079.db2.gz WQIZVXKJTNKBDH-HNAYVOBHSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001409584011 1104363091 /nfs/dbraw/zinc/36/30/91/1104363091.db2.gz WQIZVXKJTNKBDH-HNAYVOBHSA-N 1 3 331.504 2.841 10 0 EFAEHO CCCN(C)CC(=O)NC1(C[NH2+]CC2CC(F)(F)C2)CCCCC1 ZINC001409809269 1104444483 /nfs/dbraw/zinc/44/44/83/1104444483.db2.gz TYYRYZGUAZXJJA-UHFFFAOYSA-N 1 3 345.478 2.782 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC[C@@H](C)N(C)Cc2cccc(F)c2)C1 ZINC001409607682 1104466376 /nfs/dbraw/zinc/46/63/76/1104466376.db2.gz AUGHYBZTYQAPFU-SJLPKXTDSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC[C@@H](C)N(C)Cc2cccc(F)c2)C1 ZINC001409607682 1104466378 /nfs/dbraw/zinc/46/63/78/1104466378.db2.gz AUGHYBZTYQAPFU-SJLPKXTDSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[N@H+](C)CC1CCC(C)(C)CC1 ZINC001409612536 1104506536 /nfs/dbraw/zinc/50/65/36/1104506536.db2.gz CKFKLJRGNLNBGZ-DLBZAZTESA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[N@@H+](C)CC1CCC(C)(C)CC1 ZINC001409612536 1104506546 /nfs/dbraw/zinc/50/65/46/1104506546.db2.gz CKFKLJRGNLNBGZ-DLBZAZTESA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[N@H+](C)CC1CCC(C)(C)CC1 ZINC001409612588 1104506842 /nfs/dbraw/zinc/50/68/42/1104506842.db2.gz CKFKLJRGNLNBGZ-SJORKVTESA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[N@@H+](C)CC1CCC(C)(C)CC1 ZINC001409612588 1104506853 /nfs/dbraw/zinc/50/68/53/1104506853.db2.gz CKFKLJRGNLNBGZ-SJORKVTESA-N 1 3 337.552 2.981 10 0 EFAEHO CC/C=C\CC[N@H+](C)C[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001664848600 1104574915 /nfs/dbraw/zinc/57/49/15/1104574915.db2.gz HBSQBGSJECWXPH-SFFCAUCYSA-N 1 3 335.536 2.855 10 0 EFAEHO CC/C=C\CC[N@@H+](C)C[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001664848600 1104574919 /nfs/dbraw/zinc/57/49/19/1104574919.db2.gz HBSQBGSJECWXPH-SFFCAUCYSA-N 1 3 335.536 2.855 10 0 EFAEHO C[C@@H](C(=O)N[C@H]1CCC[N@H+](CCCCCF)C1)N1CCCCCC1 ZINC001665074882 1104626814 /nfs/dbraw/zinc/62/68/14/1104626814.db2.gz NGSFOVKCKFGZFK-ROUUACIJSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@@H](C(=O)N[C@H]1CCC[N@@H+](CCCCCF)C1)N1CCCCCC1 ZINC001665074882 1104626817 /nfs/dbraw/zinc/62/68/17/1104626817.db2.gz NGSFOVKCKFGZFK-ROUUACIJSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@@H](C(=O)N[C@H]1CCCN(CCCCCF)C1)[NH+]1CCCCCC1 ZINC001665074882 1104626823 /nfs/dbraw/zinc/62/68/23/1104626823.db2.gz NGSFOVKCKFGZFK-ROUUACIJSA-N 1 3 341.515 2.971 10 0 EFAEHO CC/C=C/CCN1C[C@@H]2C[C@H]1CN2C(=O)CCCC[NH+]1CCCC1 ZINC001665432420 1104694851 /nfs/dbraw/zinc/69/48/51/1104694851.db2.gz ADRBOQLBYYLEHJ-YQHFQFMOSA-N 1 3 333.520 2.894 10 0 EFAEHO CN(C(=O)C1CC[NH+](C)CC1)[C@H]1CCN(CCCCC(F)(F)F)C1 ZINC001665658853 1104742224 /nfs/dbraw/zinc/74/22/24/1104742224.db2.gz DTGIXBODSIYLBO-HNNXBMFYSA-N 1 3 349.441 2.594 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2CC2CC3(CCC3)C2)C1 ZINC001482663756 1104766418 /nfs/dbraw/zinc/76/64/18/1104766418.db2.gz BVPQNILMTHQKKG-RBUKOAKNSA-N 1 3 347.547 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2CC2CC3(CCC3)C2)C1 ZINC001482663756 1104766422 /nfs/dbraw/zinc/76/64/22/1104766422.db2.gz BVPQNILMTHQKKG-RBUKOAKNSA-N 1 3 347.547 2.831 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@H]3CN(C(=O)CN(C)C(C)C)CC[C@@H]32)c1 ZINC001482667255 1104805661 /nfs/dbraw/zinc/80/56/61/1104805661.db2.gz SBFHEGNXCWFVNZ-PMACEKPBSA-N 1 3 343.515 2.758 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@H]3CN(C(=O)CN(C)C(C)C)CC[C@@H]32)c1 ZINC001482667255 1104805668 /nfs/dbraw/zinc/80/56/68/1104805668.db2.gz SBFHEGNXCWFVNZ-PMACEKPBSA-N 1 3 343.515 2.758 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2Cc2ccsc2)C1 ZINC001482668390 1104812404 /nfs/dbraw/zinc/81/24/04/1104812404.db2.gz WCBATHQTMJMLLO-IAGOWNOFSA-N 1 3 335.517 2.511 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2Cc2ccsc2)C1 ZINC001482668390 1104812413 /nfs/dbraw/zinc/81/24/13/1104812413.db2.gz WCBATHQTMJMLLO-IAGOWNOFSA-N 1 3 335.517 2.511 10 0 EFAEHO C[C@@H](F)CC[NH2+]CC[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001666157065 1104886000 /nfs/dbraw/zinc/88/60/00/1104886000.db2.gz JKZCAAIANYKMTK-QZTJIDSGSA-N 1 3 341.515 2.685 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H]1CCC[C@H]1NC(=O)CN(C)C(C)C ZINC001482698413 1104954882 /nfs/dbraw/zinc/95/48/82/1104954882.db2.gz KWCULQCFJPTJKR-RTBURBONSA-N 1 3 331.504 2.710 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1cccc(OC)c1 ZINC001482900770 1105145331 /nfs/dbraw/zinc/14/53/31/1105145331.db2.gz GNMFJIHTBCVASR-QFBILLFUSA-N 1 3 347.503 2.554 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+]Cc1cccc(Cl)c1 ZINC001482901713 1105145933 /nfs/dbraw/zinc/14/59/33/1105145933.db2.gz LNUBEBUVTUPPBX-CQSZACIVSA-N 1 3 325.884 2.665 10 0 EFAEHO CCN(CCNC/C=C\Cl)C(=O)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001482930127 1105188538 /nfs/dbraw/zinc/18/85/38/1105188538.db2.gz DISYFNHDNJDSOY-CXSQMQJXSA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(CCNC/C=C\Cl)C(=O)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001482930127 1105188541 /nfs/dbraw/zinc/18/85/41/1105188541.db2.gz DISYFNHDNJDSOY-CXSQMQJXSA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(CC[NH2+]Cc1cc2ccccc2o1)C(=O)C1(N(C)C)CCC1 ZINC001482930965 1105190239 /nfs/dbraw/zinc/19/02/39/1105190239.db2.gz KBUYZFCAJWTFRR-UHFFFAOYSA-N 1 3 343.471 2.855 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H](C)NC(=O)CN(C)C2CCC2)cc1C ZINC001668091721 1105233452 /nfs/dbraw/zinc/23/34/52/1105233452.db2.gz APIOXDCKRKFNHR-QGZVFWFLSA-N 1 3 331.504 2.772 10 0 EFAEHO CCN(CCNC/C=C/Cl)C(=O)[C@H]1C[N@H+](C)C[C@@H]1c1ccccc1 ZINC001482951933 1105235564 /nfs/dbraw/zinc/23/55/64/1105235564.db2.gz SNEJWWGSUIGCBZ-WGDYAQENSA-N 1 3 349.906 2.522 10 0 EFAEHO CCN(CCNC/C=C/Cl)C(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1 ZINC001482951933 1105235569 /nfs/dbraw/zinc/23/55/69/1105235569.db2.gz SNEJWWGSUIGCBZ-WGDYAQENSA-N 1 3 349.906 2.522 10 0 EFAEHO CCN(CC[NH2+]CC1CC2(CCC2)C1)C(=O)CN1CCC(C)CC1 ZINC001482957764 1105242154 /nfs/dbraw/zinc/24/21/54/1105242154.db2.gz FLOSITLXJALFDV-UHFFFAOYSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)CC[NH2+]CC[C@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001668215045 1105258664 /nfs/dbraw/zinc/25/86/64/1105258664.db2.gz VDAOARYMTJMDBR-YJBOKZPZSA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)CC[NH2+]CC[C@@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001668215044 1105259010 /nfs/dbraw/zinc/25/90/10/1105259010.db2.gz VDAOARYMTJMDBR-QAPCUYQASA-N 1 3 329.504 2.729 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)cc1 ZINC001668288022 1105273993 /nfs/dbraw/zinc/27/39/93/1105273993.db2.gz GXZKIWQLGJTPJT-GFCCVEGCSA-N 1 3 334.851 2.599 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc(OC(C)C)c1)C(=O)[C@H]1CCCN1C ZINC001668521712 1105313531 /nfs/dbraw/zinc/31/35/31/1105313531.db2.gz RYHXDXWMELXEMZ-LJQANCHMSA-N 1 3 347.503 2.506 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C2CC2)cc1)C(=O)CN1CC[C@H](C)C1 ZINC001668554695 1105319323 /nfs/dbraw/zinc/31/93/23/1105319323.db2.gz BEIKAUSKHQVNRC-KRWDZBQOSA-N 1 3 343.515 2.844 10 0 EFAEHO CN(C)C1(C(=O)NC/C=C\C[NH2+]CC2CCC(C)(C)CC2)CCC1 ZINC001668864167 1105388398 /nfs/dbraw/zinc/38/83/98/1105388398.db2.gz CYKIBGATJFMPLP-WAYWQWQTSA-N 1 3 335.536 2.949 10 0 EFAEHO CN(C)C1(C(=O)NC/C=C/C[NH2+]Cc2ccc(C3CC3)cc2)CCC1 ZINC001668864917 1105388618 /nfs/dbraw/zinc/38/86/18/1105388618.db2.gz MJTDTMSIUQWXFQ-ONEGZZNKSA-N 1 3 341.499 2.810 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\C[NH2+][C@H]1CCc2ccccc21)N(C)C ZINC001668873611 1105390094 /nfs/dbraw/zinc/39/00/94/1105390094.db2.gz VFFVXHVCIZLHCY-XSAZBNQGSA-N 1 3 329.488 2.522 10 0 EFAEHO C[NH+](C)CCC(=O)NC/C=C\CN[C@H]1CCc2ccc(Cl)cc21 ZINC001669020806 1105418663 /nfs/dbraw/zinc/41/86/63/1105418663.db2.gz JVVWZBPDSAHABD-LIMHQNJXSA-N 1 3 335.879 2.541 10 0 EFAEHO C[NH+](C)CCC(=O)NC/C=C\CNCc1cc(Cl)cc(Cl)c1 ZINC001669020850 1105418669 /nfs/dbraw/zinc/41/86/69/1105418669.db2.gz KSCNGHFRUHRDQG-ARJAWSKDSA-N 1 3 344.286 2.707 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C/C[NH2+]Cc2cccc(Cl)c2)CC1 ZINC001669106812 1105435673 /nfs/dbraw/zinc/43/56/73/1105435673.db2.gz JDSLAPWFHZCBEX-NSCUHMNNSA-N 1 3 349.906 2.834 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C\C[NH2+]Cc2cccc(Cl)c2)CC1 ZINC001669106811 1105435714 /nfs/dbraw/zinc/43/57/14/1105435714.db2.gz JDSLAPWFHZCBEX-IHWYPQMZSA-N 1 3 349.906 2.834 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NC/C=C\CNCc1cccc(Cl)c1 ZINC001669201194 1105456001 /nfs/dbraw/zinc/45/60/01/1105456001.db2.gz NNMFXCGAPMOSLT-SSGMOAHOSA-N 1 3 349.906 2.975 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NC/C=C\CNCc1cccc(Cl)c1 ZINC001669201194 1105456006 /nfs/dbraw/zinc/45/60/06/1105456006.db2.gz NNMFXCGAPMOSLT-SSGMOAHOSA-N 1 3 349.906 2.975 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC/C=C/C[NH2+]Cc1c(C)cccc1C ZINC001669206720 1105457199 /nfs/dbraw/zinc/45/71/99/1105457199.db2.gz GPFKHOVRRHMYDH-YJJPMGAVSA-N 1 3 343.515 2.940 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/CNC/C=C\Cl)[NH+]1CCCCC1 ZINC001669207871 1105458177 /nfs/dbraw/zinc/45/81/77/1105458177.db2.gz PSJJUEAJBJSOIN-AXLYCRGGSA-N 1 3 327.900 2.511 10 0 EFAEHO CCn1nc(C)c([C@@H](C)NCC2CCN(c3cc[nH+]cc3)CC2)n1 ZINC000925300210 1105563911 /nfs/dbraw/zinc/56/39/11/1105563911.db2.gz IRXNXOAOURQOKH-CQSZACIVSA-N 1 3 328.464 2.569 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+]CCCN(C)C(=O)[C@H]1CCCN1C ZINC001670041957 1105572485 /nfs/dbraw/zinc/57/24/85/1105572485.db2.gz NLVNORGEUCULAJ-QGZVFWFLSA-N 1 3 337.895 2.681 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001670143347 1105587293 /nfs/dbraw/zinc/58/72/93/1105587293.db2.gz CDDMYMGPNQPJRR-OAHLLOKOSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001670248373 1105604651 /nfs/dbraw/zinc/60/46/51/1105604651.db2.gz CDDMYMGPNQPJRR-HNNXBMFYSA-N 1 3 333.467 2.590 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[NH2+]Cc1cccc(C)c1 ZINC001670357871 1105624487 /nfs/dbraw/zinc/62/44/87/1105624487.db2.gz VCQOZQIBTYNRQJ-IBGZPJMESA-N 1 3 331.504 2.808 10 0 EFAEHO C[NH+](C)Cc1ccc(C(=O)N[C@@H](CNCCF)C2CCCC2)cc1 ZINC001671558863 1105658740 /nfs/dbraw/zinc/65/87/40/1105658740.db2.gz KQLSJSILLHDAHK-SFHVURJKSA-N 1 3 335.467 2.596 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1(C)CC[NH+](CC2=CCCCC2)CC1 ZINC001671862748 1105715068 /nfs/dbraw/zinc/71/50/68/1105715068.db2.gz IALIKZXKRBBSOF-UHFFFAOYSA-N 1 3 344.503 2.979 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001672377332 1105817554 /nfs/dbraw/zinc/81/75/54/1105817554.db2.gz USSQZBZGWGIEAZ-XMTFNYHQSA-N 1 3 341.515 2.589 10 0 EFAEHO CC[NH2+]CCN(Cc1ccccc1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001672395967 1105822302 /nfs/dbraw/zinc/82/23/02/1105822302.db2.gz AFBIOKJHOIIQHT-HXUWFJFHSA-N 1 3 349.494 2.837 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N(CC[NH2+]CC1CC1)Cc1ccccc1 ZINC001672400486 1105823765 /nfs/dbraw/zinc/82/37/65/1105823765.db2.gz FOMQHLQFFSRJQI-ROUUACIJSA-N 1 3 343.515 2.888 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]CCCc2ccsc2)C1 ZINC001672761195 1105896888 /nfs/dbraw/zinc/89/68/88/1105896888.db2.gz DUHLIJCVOZELMP-FUHWJXTLSA-N 1 3 349.544 2.603 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CC[C@@H]1CCN(C(=O)[C@@H]2CCCN2C)C1 ZINC001672762528 1105897502 /nfs/dbraw/zinc/89/75/02/1105897502.db2.gz YHWOMAGJJJONNS-APWZRJJASA-N 1 3 347.478 2.557 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)c1 ZINC001672761770 1105897755 /nfs/dbraw/zinc/89/77/55/1105897755.db2.gz PDTVUWUNPCUFGT-ICSRJNTNSA-N 1 3 343.515 2.726 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+]Cc2cc(C)ccc2F)C1 ZINC001672901465 1105932613 /nfs/dbraw/zinc/93/26/13/1105932613.db2.gz HYZQAQIEULXUPE-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1CC[C@H](C[NH2+]C/C=C\Cl)CC1 ZINC001672961101 1105949607 /nfs/dbraw/zinc/94/96/07/1105949607.db2.gz UPTCJVVCIDAGSP-ZNEUWXAGSA-N 1 3 341.927 2.876 10 0 EFAEHO CC[C@@H](F)CN1CC[C@@]2(C1)CCCN(C(=O)CCCC[NH+](C)C)C2 ZINC001673651758 1106068433 /nfs/dbraw/zinc/06/84/33/1106068433.db2.gz ZUTVJRTUOVHPMU-IEBWSBKVSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)CCC[NH2+][C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1C ZINC001673904753 1106100998 /nfs/dbraw/zinc/10/09/98/1106100998.db2.gz NSUVREVEXUMNDL-IRXDYDNUSA-N 1 3 325.541 2.837 10 0 EFAEHO Cc1ncccc1CN1CC[C@@H](NC(=O)CCCC[NH+](C)C)C[C@@H]1C ZINC001674153498 1106151985 /nfs/dbraw/zinc/15/19/85/1106151985.db2.gz HBQTVYINBWAEKZ-QFBILLFUSA-N 1 3 346.519 2.591 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@H]([C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001674505225 1106209206 /nfs/dbraw/zinc/20/92/06/1106209206.db2.gz LUBMQMVGDNFMJQ-ZFRRBFPSSA-N 1 3 344.503 2.869 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@H]([C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001674505225 1106209210 /nfs/dbraw/zinc/20/92/10/1106209210.db2.gz LUBMQMVGDNFMJQ-ZFRRBFPSSA-N 1 3 344.503 2.869 10 0 EFAEHO CN(CC(=O)NC1CC(C[NH2+]CCc2ccccc2)C1)CC(C)(C)C ZINC001674582926 1106218588 /nfs/dbraw/zinc/21/85/88/1106218588.db2.gz CRAJWNQRFPVRRS-UHFFFAOYSA-N 1 3 345.531 2.691 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC1CC(C[NH2+]CCC2CCCC2)C1 ZINC001674611434 1106222099 /nfs/dbraw/zinc/22/20/99/1106222099.db2.gz FIFQILQJZJNTEB-ACBHZAAOSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)Cc1c[nH]cn1)[NH2+]CC1=CCCCC1 ZINC001675136429 1106306708 /nfs/dbraw/zinc/30/67/08/1106306708.db2.gz VLAIPHQJJNWNDC-SFHVURJKSA-N 1 3 332.492 2.915 10 0 EFAEHO CCCC[C@@H](C[NH2+]CCC)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001675234365 1106320029 /nfs/dbraw/zinc/32/00/29/1106320029.db2.gz SOIGYRLPIZRPBF-YJBOKZPZSA-N 1 3 329.504 2.874 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H]2C[C@H](NC(=O)C3(N(C)C)CCC3)C2)cc1 ZINC001675756454 1106419392 /nfs/dbraw/zinc/41/93/92/1106419392.db2.gz PQKMFRNWMYVIRD-WGSAOQKQSA-N 1 3 343.515 2.506 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)CCC[NH2+]C/C=C\Cl ZINC001675985493 1106460333 /nfs/dbraw/zinc/46/03/33/1106460333.db2.gz CNRMWNBRSHRMOJ-SELBCVKXSA-N 1 3 329.916 2.876 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+][C@@H](C)c1ccccc1 ZINC001676014124 1106468972 /nfs/dbraw/zinc/46/89/72/1106468972.db2.gz ZOZFGMBIJFRLCF-CABCVRRESA-N 1 3 328.460 2.896 10 0 EFAEHO CC[NH2+]CCCN(Cc1ccccc1)C(=O)CN1[C@H](C)CC[C@@H]1C ZINC001676088640 1106484188 /nfs/dbraw/zinc/48/41/88/1106484188.db2.gz AORFTGBPXYSQHC-HDICACEKSA-N 1 3 331.504 2.888 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)[C@H](C[NH2+]CC2=CCCCC2)C2CC2)C1 ZINC001676249992 1106505650 /nfs/dbraw/zinc/50/56/50/1106505650.db2.gz RAFDZGQLYCBPIO-QFBILLFUSA-N 1 3 333.520 2.655 10 0 EFAEHO C[C@@H]1[C@H](NCc2ccccc2F)CCN1C(=O)CCCC[NH+](C)C ZINC001676680296 1106557351 /nfs/dbraw/zinc/55/73/51/1106557351.db2.gz KIGZAOVUVSDVLC-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2ccsc2)[C@H]1C ZINC001676686974 1106558792 /nfs/dbraw/zinc/55/87/92/1106558792.db2.gz VNJWRVHISZDQGA-NVXWUHKLSA-N 1 3 337.533 2.602 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CCCc2ccsc2)[C@H]1C ZINC001676686975 1106558951 /nfs/dbraw/zinc/55/89/51/1106558951.db2.gz VNJWRVHISZDQGA-WBVHZDCISA-N 1 3 337.533 2.602 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]CCCc2ccsc2)C[C@@H]1C ZINC001676782588 1106579017 /nfs/dbraw/zinc/57/90/17/1106579017.db2.gz HPFRBQQDLIKHTN-RDJZCZTQSA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)CC[NH2+]C[C@@H]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)C1 ZINC001676959159 1106636645 /nfs/dbraw/zinc/63/66/45/1106636645.db2.gz RVKMSQNTCMROGE-SJORKVTESA-N 1 3 325.541 2.885 10 0 EFAEHO CCCC[NH2+][C@@H]1CN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1(C)C ZINC001677023833 1106651520 /nfs/dbraw/zinc/65/15/20/1106651520.db2.gz PWJAZKPUAGJNSX-DNVCBOLYSA-N 1 3 341.515 2.826 10 0 EFAEHO CCCCCC[NH2+][C@H]1CN(C(=O)[C@H](C(C)C)N(C)C)CC1(C)C ZINC001677032375 1106652969 /nfs/dbraw/zinc/65/29/69/1106652969.db2.gz CLIAJKPDDDZWEZ-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@H+](C[C@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001677602910 1106767317 /nfs/dbraw/zinc/76/73/17/1106767317.db2.gz AXPDFKICCIGXEH-HOTGVXAUSA-N 1 3 343.462 2.510 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@@H+](C[C@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001677602910 1106767328 /nfs/dbraw/zinc/76/73/28/1106767328.db2.gz AXPDFKICCIGXEH-HOTGVXAUSA-N 1 3 343.462 2.510 10 0 EFAEHO Cc1ccc(C[N@H+]2CC=C(CNC(=O)CN(C)C(C)C)CC2)cc1 ZINC001677636064 1106798092 /nfs/dbraw/zinc/79/80/92/1106798092.db2.gz DIHVOKNYGJGBCS-UHFFFAOYSA-N 1 3 329.488 2.584 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC=C(CNC(=O)CN(C)C(C)C)CC2)cc1 ZINC001677636064 1106798106 /nfs/dbraw/zinc/79/81/06/1106798106.db2.gz DIHVOKNYGJGBCS-UHFFFAOYSA-N 1 3 329.488 2.584 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCc1ccc(C[NH2+]CCC(C)C)cc1F ZINC001677648251 1106811453 /nfs/dbraw/zinc/81/14/53/1106811453.db2.gz JLUXVZMKDYUYHN-UHFFFAOYSA-N 1 3 346.450 2.852 10 0 EFAEHO Cc1cc(Cl)ccc1CNC/C=C\CNC(=O)C1CC[NH+](C)CC1 ZINC001483053055 1106980286 /nfs/dbraw/zinc/98/02/86/1106980286.db2.gz BMDSIICEXJSFQH-ARJAWSKDSA-N 1 3 349.906 2.752 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\C[NH2+][C@@H](C)c1ccc(F)cc1)N(C)C ZINC001483055706 1107693094 /nfs/dbraw/zinc/69/30/94/1107693094.db2.gz BJHBPADZPFLHDD-ZNUVNQELSA-N 1 3 335.467 2.735 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NC/C=C\C[NH2+]CC2CCCC2)C1 ZINC001483061968 1107949605 /nfs/dbraw/zinc/94/96/05/1107949605.db2.gz YCDJFGQCYNCYMG-LIXSYLKWSA-N 1 3 339.499 2.651 10 0 EFAEHO C[C@@H](NCc1cccc(Cl)c1F)[C@H](C)NC(=O)CCC[NH+](C)C ZINC001409369850 1107963346 /nfs/dbraw/zinc/96/33/46/1107963346.db2.gz BYHCOHLRXGCJIC-OLZOCXBDSA-N 1 3 343.874 2.804 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC001409268872 1108167268 /nfs/dbraw/zinc/16/72/68/1108167268.db2.gz BGCQHPBAZPNTPI-JFIBYHEFSA-N 1 3 347.478 2.639 10 0 EFAEHO C[C@H](NC(=O)CN(C)CC(C)(C)C)[C@H](C)[NH2+]CCc1cccs1 ZINC001409406965 1108201005 /nfs/dbraw/zinc/20/10/05/1108201005.db2.gz XOGVQRHXODTLSE-GJZGRUSLSA-N 1 3 339.549 2.751 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)NC/C=C\CNCc2ccc(F)cc2)CC1 ZINC001483077125 1108413782 /nfs/dbraw/zinc/41/37/82/1108413782.db2.gz ZVGKEJUIDNSWDX-ARJAWSKDSA-N 1 3 347.478 2.708 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)NC/C=C\CNCc2ccc(F)cc2)C1 ZINC001483082657 1108454781 /nfs/dbraw/zinc/45/47/81/1108454781.db2.gz UBYAASCWAVPYOZ-VKCQWTKXSA-N 1 3 347.478 2.708 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3cc(F)ccc3C)CC2)CC[N@@H+]1C ZINC001483734860 1108518293 /nfs/dbraw/zinc/51/82/93/1108518293.db2.gz HZVZQBGOPLZPTH-ZWKOTPCHSA-N 1 3 347.478 2.603 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3cc(F)ccc3C)CC2)CC[N@H+]1C ZINC001483734860 1108518299 /nfs/dbraw/zinc/51/82/99/1108518299.db2.gz HZVZQBGOPLZPTH-ZWKOTPCHSA-N 1 3 347.478 2.603 10 0 EFAEHO O=C(CN1CCCC1)NC/C=C\C[NH2+]C/C=C/c1ccc(Cl)cc1 ZINC001483093503 1108575515 /nfs/dbraw/zinc/57/55/15/1108575515.db2.gz RJGQOHYAMFOUKF-SVDNXBLGSA-N 1 3 347.890 2.711 10 0 EFAEHO CCc1ccccc1C[NH2+]CC1CC(NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001409301798 1109465260 /nfs/dbraw/zinc/46/52/60/1109465260.db2.gz ZKBBWZAVDWORNM-GQOXECLESA-N 1 3 345.531 2.820 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CC2)cc1)NC(=O)C1(N(C)C)CCC1 ZINC001483135395 1109603551 /nfs/dbraw/zinc/60/35/51/1109603551.db2.gz BZMCYHKPJPOSCK-OAHLLOKOSA-N 1 3 329.488 2.643 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@@H]1CCN(C(=O)[C@H](CC)N(C)C)C1 ZINC001272616748 1111749842 /nfs/dbraw/zinc/74/98/42/1111749842.db2.gz OXBGTXGUVPDGSV-XLIONFOSSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)C1C[NH+](CCCC2CCC2)C1 ZINC001409902906 1112015965 /nfs/dbraw/zinc/01/59/65/1112015965.db2.gz GIKTVSHJRZLDSI-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO C[NH+](C)CCCCC(=O)NCC1(N[C@@H]2CCc3c2cccc3F)CC1 ZINC001670890281 1112330425 /nfs/dbraw/zinc/33/04/25/1112330425.db2.gz XEUFSDRODJSVDQ-GOSISDBHSA-N 1 3 347.478 2.783 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)NCC2(NCc3ccc(F)cc3)CC2)C1 ZINC001483784837 1112447675 /nfs/dbraw/zinc/44/76/75/1112447675.db2.gz VDXYDUFNHJYTND-FUHWJXTLSA-N 1 3 347.478 2.685 10 0 EFAEHO CC[C@H]([NH2+]C1(CNC(=O)CN(C)C(C)C)CC1)c1ccc(F)cc1 ZINC001483794040 1112454564 /nfs/dbraw/zinc/45/45/64/1112454564.db2.gz CVYCKUUGUITGSS-KRWDZBQOSA-N 1 3 335.467 2.855 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@]2(CC[N@H+](CC3=CCCCC3)C2)C1 ZINC001483846958 1112507657 /nfs/dbraw/zinc/50/76/57/1112507657.db2.gz KOENMTKCSGRSDL-FQEVSTJZSA-N 1 3 333.520 2.753 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@]2(CC[N@@H+](CC3=CCCCC3)C2)C1 ZINC001483846958 1112507659 /nfs/dbraw/zinc/50/76/59/1112507659.db2.gz KOENMTKCSGRSDL-FQEVSTJZSA-N 1 3 333.520 2.753 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[NH2+][C@H](C)c1cccc(OC)c1 ZINC001483951540 1112594953 /nfs/dbraw/zinc/59/49/53/1112594953.db2.gz HKYAMXKSRLUEEC-AEFFLSMTSA-N 1 3 347.503 2.679 10 0 EFAEHO Cc1ccccc1C[NH+]1CCC(C)(NC(=O)CN(C)C(C)C)CC1 ZINC001483976158 1112618297 /nfs/dbraw/zinc/61/82/97/1112618297.db2.gz FTQDHLLQFAMPOM-UHFFFAOYSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]C/C=C/Cl)C1CCCC1 ZINC001484001728 1112652752 /nfs/dbraw/zinc/65/27/52/1112652752.db2.gz RYEDZUNGVGUFHC-DTIZEGCPSA-N 1 3 341.927 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1(C)CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001484147231 1112825415 /nfs/dbraw/zinc/82/54/15/1112825415.db2.gz RJELGVDDTQKJGB-UHFFFAOYSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)CC[N@@H+]1CCC[C@](C)(CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001484159976 1112856046 /nfs/dbraw/zinc/85/60/46/1112856046.db2.gz HEQBNQSAUQQVSW-PKOBYXMFSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)CC[N@H+]1CCC[C@](C)(CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001484159976 1112856048 /nfs/dbraw/zinc/85/60/48/1112856048.db2.gz HEQBNQSAUQQVSW-PKOBYXMFSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1CCC(F)(F)[C@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001484194630 1112906807 /nfs/dbraw/zinc/90/68/07/1112906807.db2.gz FUSKYSJDAWZZDT-HUUCEWRRSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@@H](C)C[N@H+]1CCC(F)(F)[C@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001484194630 1112906813 /nfs/dbraw/zinc/90/68/13/1112906813.db2.gz FUSKYSJDAWZZDT-HUUCEWRRSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001484194626 1112907341 /nfs/dbraw/zinc/90/73/41/1112907341.db2.gz FUSKYSJDAWZZDT-CABCVRRESA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@@H](C)C[N@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001484194626 1112907344 /nfs/dbraw/zinc/90/73/44/1112907344.db2.gz FUSKYSJDAWZZDT-CABCVRRESA-N 1 3 345.478 2.590 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001484195942 1112912314 /nfs/dbraw/zinc/91/23/14/1112912314.db2.gz OFBRKDVCIQFEKF-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001484195942 1112912319 /nfs/dbraw/zinc/91/23/19/1112912319.db2.gz OFBRKDVCIQFEKF-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)C3(N(C)C)CCC3)C2)cc1 ZINC001484523018 1112978951 /nfs/dbraw/zinc/97/89/51/1112978951.db2.gz OJJKDLDSBZOUHP-IBGZPJMESA-N 1 3 343.515 2.808 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H](CC[NH2+]Cc3ccc(F)cc3)C2)CCC1 ZINC001484522842 1112978985 /nfs/dbraw/zinc/97/89/85/1112978985.db2.gz LTBZFPYGRQDLPO-KRWDZBQOSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](CC[NH2+]CCc2ccc(C)cc2)C1)N(C)C ZINC001484537661 1112992083 /nfs/dbraw/zinc/99/20/83/1112992083.db2.gz KKZWMGDAZZWVJR-PMACEKPBSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]CCc2ccc(C)cc2)C1)N(C)C ZINC001484537662 1112992437 /nfs/dbraw/zinc/99/24/37/1112992437.db2.gz KKZWMGDAZZWVJR-UXHICEINSA-N 1 3 345.531 2.706 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+]C[C@H]2CCC(F)(F)C2)C1 ZINC001484550128 1113002277 /nfs/dbraw/zinc/00/22/77/1113002277.db2.gz QCMVWCWUZNAOTI-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CC[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001484552267 1113004756 /nfs/dbraw/zinc/00/47/56/1113004756.db2.gz YPHVJNHFOHAOSS-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NCc1ccc([C@H](C)NCCF)cc1 ZINC001484558313 1113012098 /nfs/dbraw/zinc/01/20/98/1113012098.db2.gz DHXXYTYNKGPOHW-MAUKXSAKSA-N 1 3 335.467 2.797 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NCc1ccc([C@H](C)NCCF)cc1 ZINC001484558313 1113012100 /nfs/dbraw/zinc/01/21/00/1113012100.db2.gz DHXXYTYNKGPOHW-MAUKXSAKSA-N 1 3 335.467 2.797 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCc1ccc([C@@H](C)[NH2+]CC[C@H](C)F)cc1 ZINC001484563261 1113019016 /nfs/dbraw/zinc/01/90/16/1113019016.db2.gz LYULLVWUESIEMT-UONOGXRCSA-N 1 3 346.450 2.976 10 0 EFAEHO CC(C)=CCN1CCc2c(CNC(=O)CC[NH+](C)C)cccc2C1 ZINC001484612548 1113054582 /nfs/dbraw/zinc/05/45/82/1113054582.db2.gz GWTKEXOWBVMSJD-UHFFFAOYSA-N 1 3 329.488 2.579 10 0 EFAEHO CC(C)c1cccc(CN2CCC[C@H](NC(=O)CC[NH+](C)C)CC2)n1 ZINC001484722178 1113128129 /nfs/dbraw/zinc/12/81/29/1113128129.db2.gz FRXXKWKIHUHYEZ-KRWDZBQOSA-N 1 3 346.519 2.627 10 0 EFAEHO CC(C)c1cccc(CN2CCC[C@@H](NC(=O)CC[NH+](C)C)CC2)n1 ZINC001484722179 1113128166 /nfs/dbraw/zinc/12/81/66/1113128166.db2.gz FRXXKWKIHUHYEZ-QGZVFWFLSA-N 1 3 346.519 2.627 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)CN1CC[C@H](C)C1)C2 ZINC001484828808 1117747123 /nfs/dbraw/zinc/74/71/23/1117747123.db2.gz DCKQWONQPJRGAG-AZUAARDMSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCC[N@H+]1CC[C@@]2(C1)CCCN(C(=O)CN1CC[C@H](C)C1)C2 ZINC001484828808 1117747127 /nfs/dbraw/zinc/74/71/27/1117747127.db2.gz DCKQWONQPJRGAG-AZUAARDMSA-N 1 3 335.536 2.833 10 0 EFAEHO CCC1([NH2+]CC=C(Cl)Cl)CCN(C(=O)CN2CCCC2)CC1 ZINC001484818862 1117752458 /nfs/dbraw/zinc/75/24/58/1117752458.db2.gz BSPFQIWNMSYWPN-UHFFFAOYSA-N 1 3 348.318 2.762 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCN(C/C=C\c2ccccc2)CC1(C)C ZINC001484937212 1117850363 /nfs/dbraw/zinc/85/03/63/1117850363.db2.gz LNYGRERIAFTGBP-POGDKVGISA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001484987662 1117913709 /nfs/dbraw/zinc/91/37/09/1117913709.db2.gz FAROVTVHAMFWOR-PKOBYXMFSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001484987662 1117913711 /nfs/dbraw/zinc/91/37/11/1117913711.db2.gz FAROVTVHAMFWOR-PKOBYXMFSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001484987661 1117913950 /nfs/dbraw/zinc/91/39/50/1117913950.db2.gz FAROVTVHAMFWOR-MJGOQNOKSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001484987661 1117913951 /nfs/dbraw/zinc/91/39/51/1117913951.db2.gz FAROVTVHAMFWOR-MJGOQNOKSA-N 1 3 331.504 2.804 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@@H]([C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001485081516 1118031016 /nfs/dbraw/zinc/03/10/16/1118031016.db2.gz FBGFMNNFVRLAAU-RTBURBONSA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@@H]([C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001485081516 1118031022 /nfs/dbraw/zinc/03/10/22/1118031022.db2.gz FBGFMNNFVRLAAU-RTBURBONSA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]C/C=C/c2ccccc2)C1 ZINC001485110867 1118057510 /nfs/dbraw/zinc/05/75/10/1118057510.db2.gz YQQOXBGQZBTIPT-JXMROGBWSA-N 1 3 329.488 2.524 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)[C@H](C)NC(=O)CC[NH+]2CCCCC2)c1 ZINC001485228002 1118154214 /nfs/dbraw/zinc/15/42/14/1118154214.db2.gz BCLLDSINCHHCNE-SJORKVTESA-N 1 3 349.494 2.993 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC(C)(C)C[NH2+]CCC2CCCC2)C1 ZINC001485259683 1118179402 /nfs/dbraw/zinc/17/94/02/1118179402.db2.gz BJZPWAVNQZKRLE-KRWDZBQOSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1C[NH+]2CCC1CC2)N(C)Cc1ccc(Cl)cc1 ZINC001485300375 1118217673 /nfs/dbraw/zinc/21/76/73/1118217673.db2.gz DGPGYVYRHJIMTL-KSSFIOAISA-N 1 3 349.906 2.618 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1 ZINC001485308233 1118220850 /nfs/dbraw/zinc/22/08/50/1118220850.db2.gz DQUWNHNWIPYECL-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1 ZINC001485308233 1118220853 /nfs/dbraw/zinc/22/08/53/1118220853.db2.gz DQUWNHNWIPYECL-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CC/C=C/CC[N@H+](C)[C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001485349493 1118271742 /nfs/dbraw/zinc/27/17/42/1118271742.db2.gz GYAJPAOXHFFJEC-ZCLAENRFSA-N 1 3 341.515 2.992 10 0 EFAEHO CC/C=C/CC[N@@H+](C)[C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001485349493 1118271744 /nfs/dbraw/zinc/27/17/44/1118271744.db2.gz GYAJPAOXHFFJEC-ZCLAENRFSA-N 1 3 341.515 2.992 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[N@H+](C)CC1CC(C)(C)C1 ZINC001485350795 1118273553 /nfs/dbraw/zinc/27/35/53/1118273553.db2.gz PZVVOPBRJZQWFD-HNNXBMFYSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[N@@H+](C)CC1CC(C)(C)C1 ZINC001485350795 1118273554 /nfs/dbraw/zinc/27/35/54/1118273554.db2.gz PZVVOPBRJZQWFD-HNNXBMFYSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]Cc1cccc(F)c1 ZINC001485429054 1118358832 /nfs/dbraw/zinc/35/88/32/1118358832.db2.gz OQDOUICOZOJOGC-OALUTQOASA-N 1 3 349.494 2.883 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC2(C[NH2+]CCC(F)(F)F)CCCCC2)C1 ZINC001485455070 1118367019 /nfs/dbraw/zinc/36/70/19/1118367019.db2.gz FCJPVSPZJWHELZ-CQSZACIVSA-N 1 3 349.441 2.689 10 0 EFAEHO CC[C@@H](C(=O)NC1(C[NH2+]Cc2ccccc2)CCCCC1)N(C)C ZINC001485454991 1118367171 /nfs/dbraw/zinc/36/71/71/1118367171.db2.gz CZTVNLGNPTZLDP-SFHVURJKSA-N 1 3 331.504 2.936 10 0 EFAEHO Cc1cc(CN2CCCCC[C@@H]2CNC(=O)CC[NH+](C)C)cs1 ZINC001485482914 1118387932 /nfs/dbraw/zinc/38/79/32/1118387932.db2.gz TUQORGKGAJKZDU-QGZVFWFLSA-N 1 3 337.533 2.869 10 0 EFAEHO C[C@H](NC(=O)CCCC[NH+](C)C)C1CN([C@@H](C)c2ccccc2)C1 ZINC001485533949 1118445004 /nfs/dbraw/zinc/44/50/04/1118445004.db2.gz WYNHZZHZEANFHW-IRXDYDNUSA-N 1 3 331.504 2.916 10 0 EFAEHO CCc1ccc(CN2CC([C@@H](C)NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)cc1 ZINC001485534117 1118445292 /nfs/dbraw/zinc/44/52/92/1118445292.db2.gz YPMKWLYKPWSDMH-APWZRJJASA-N 1 3 343.515 2.527 10 0 EFAEHO CCc1ccc(CN2CC([C@@H](C)NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)cc1 ZINC001485534117 1118445295 /nfs/dbraw/zinc/44/52/95/1118445295.db2.gz YPMKWLYKPWSDMH-APWZRJJASA-N 1 3 343.515 2.527 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@]2(C)CN(C(=O)Cc3c[nH]cn3)C[C@@]2(C)C1 ZINC001485668728 1118517557 /nfs/dbraw/zinc/51/75/57/1118517557.db2.gz DETQWPJCGQFEML-KDURUIRLSA-N 1 3 332.492 2.559 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@]2(C)CN(C(=O)Cc3c[nH]cn3)C[C@@]2(C)C1 ZINC001485668728 1118517559 /nfs/dbraw/zinc/51/75/59/1118517559.db2.gz DETQWPJCGQFEML-KDURUIRLSA-N 1 3 332.492 2.559 10 0 EFAEHO CC(C)(C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C/Cl)C1)[NH+]1CCCC1 ZINC001485691556 1118522208 /nfs/dbraw/zinc/52/22/08/1118522208.db2.gz ANPHGIFKSIISOA-FQNMHCGOSA-N 1 3 348.318 2.664 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001485688530 1118528549 /nfs/dbraw/zinc/52/85/49/1118528549.db2.gz IYTCZAVQTBJFGA-UQLJXIMDSA-N 1 3 329.488 2.524 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@H](C[NH2+]CCC2CCCC2)C1 ZINC001485705150 1118529512 /nfs/dbraw/zinc/52/95/12/1118529512.db2.gz NLRYGNARVCBPNV-CAMMJAKZSA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C[C@H]1C[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001485707154 1118530387 /nfs/dbraw/zinc/53/03/87/1118530387.db2.gz UMRADBQPZAIBKJ-BZSNNMDCSA-N 1 3 331.504 2.881 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CCc2ccccc2)C1 ZINC001485706764 1118530676 /nfs/dbraw/zinc/53/06/76/1118530676.db2.gz OLXJQBFQXAOKSC-VAMGGRTRSA-N 1 3 343.515 2.588 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H](C[NH2+]CC2=CCCCC2)C1)CC(C)(C)C ZINC001485695343 1118534277 /nfs/dbraw/zinc/53/42/77/1118534277.db2.gz GNOPUUXMAWMFBU-IYARVYRRSA-N 1 3 335.536 2.949 10 0 EFAEHO Cc1ccc(C[NH2+]CCC[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1F ZINC001485725280 1118544497 /nfs/dbraw/zinc/54/44/97/1118544497.db2.gz WVTDYQOFIZIYSF-INIZCTEOSA-N 1 3 349.494 2.993 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H]([NH2+]CC1CCCCC1)C(C)C ZINC001485791121 1118596035 /nfs/dbraw/zinc/59/60/35/1118596035.db2.gz CGOVUTKNZRDWTH-QGZVFWFLSA-N 1 3 334.508 2.961 10 0 EFAEHO CCCN(CCO)CC[C@@H]([NH2+]C)c1ccc(Br)cc1 ZINC000053941087 214205616 /nfs/dbraw/zinc/20/56/16/214205616.db2.gz RXXRAFCWUBFUFL-OAHLLOKOSA-N 1 3 329.282 2.804 10 0 EFAEHO C[N@H+](CCC1CCN(c2ccncc2)CC1)C[C@H](O)CC(F)(F)F ZINC000189807301 529877659 /nfs/dbraw/zinc/87/76/59/529877659.db2.gz JPPIKGJSEBSCGL-MRXNPFEDSA-N 1 3 345.409 2.933 10 0 EFAEHO C[N@@H+](CCC1CCN(c2ccncc2)CC1)C[C@H](O)CC(F)(F)F ZINC000189807301 529877660 /nfs/dbraw/zinc/87/76/60/529877660.db2.gz JPPIKGJSEBSCGL-MRXNPFEDSA-N 1 3 345.409 2.933 10 0 EFAEHO C[NH2+]C[C@H]1CCCN1C(=O)NCc1ccccc1CN1CCCCC1 ZINC000416910254 290726289 /nfs/dbraw/zinc/72/62/89/290726289.db2.gz ZCVCOWMMYHISAQ-LJQANCHMSA-N 1 3 344.503 2.566 10 0 EFAEHO C[NH2+][C@@H](CCN(C)CCN(C)C)c1ccc(Br)cc1 ZINC000104192368 219357784 /nfs/dbraw/zinc/35/77/84/219357784.db2.gz KISWXPCBHAXTDN-HNNXBMFYSA-N 1 3 328.298 2.593 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCCCC[NH+]2CCCC2)[C@@H]1c1ccccc1 ZINC000179122530 283051451 /nfs/dbraw/zinc/05/14/51/283051451.db2.gz QJSYCCQUAOEDSM-MOPGFXCFSA-N 1 3 344.503 2.607 10 0 EFAEHO CN1CC[C@H](NC(=O)NCCCC[NH+]2CCCC2)[C@H]1c1ccccc1 ZINC000245663954 283125693 /nfs/dbraw/zinc/12/56/93/283125693.db2.gz QJSYCCQUAOEDSM-RBUKOAKNSA-N 1 3 344.503 2.607 10 0 EFAEHO C[C@H]([NH2+]CC1(N2CCCCC2)CCN(C)CC1)c1cccc(CO)c1 ZINC000305645979 299283264 /nfs/dbraw/zinc/28/32/64/299283264.db2.gz LYSKJCWVHBWWBC-SFHVURJKSA-N 1 3 345.531 2.780 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000069520964 202285259 /nfs/dbraw/zinc/28/52/59/202285259.db2.gz ZSLSOKYNNYSTII-UXHICEINSA-N 1 3 341.499 2.981 10 0 EFAEHO C[N@H+]1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000069520964 202285263 /nfs/dbraw/zinc/28/52/63/202285263.db2.gz ZSLSOKYNNYSTII-UXHICEINSA-N 1 3 341.499 2.981 10 0 EFAEHO CC1CC[NH+](CCCNC(=O)N[C@@H](CN(C)C)c2ccccc2)CC1 ZINC000048190237 201109600 /nfs/dbraw/zinc/10/96/00/201109600.db2.gz BJWQVKCDOKXMEL-IBGZPJMESA-N 1 3 346.519 2.711 10 0 EFAEHO C[C@H](CC[NH2+]C1CCN(c2ccncc2)CC1)NC(=O)OC(C)(C)C ZINC000298580434 201353150 /nfs/dbraw/zinc/35/31/50/201353150.db2.gz XTAZQYVXKDTHAQ-OAHLLOKOSA-N 1 3 348.491 2.943 10 0 EFAEHO Cc1ncsc1CN(C)C[C@@H]1CC[N@H+](CCN2CCCCC2)C1 ZINC000195249515 240211745 /nfs/dbraw/zinc/21/17/45/240211745.db2.gz QVUHGHAEMRDIQB-KRWDZBQOSA-N 1 3 336.549 2.691 10 0 EFAEHO Cc1ncsc1CN(C)C[C@@H]1CC[N@@H+](CCN2CCCCC2)C1 ZINC000195249515 240211752 /nfs/dbraw/zinc/21/17/52/240211752.db2.gz QVUHGHAEMRDIQB-KRWDZBQOSA-N 1 3 336.549 2.691 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000412418473 243306218 /nfs/dbraw/zinc/30/62/18/243306218.db2.gz OPZFNWXOYOIKRV-QGZVFWFLSA-N 1 3 337.533 2.903 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)CC[C@H]1CCCC[N@H+]1C ZINC000412418473 243306224 /nfs/dbraw/zinc/30/62/24/243306224.db2.gz OPZFNWXOYOIKRV-QGZVFWFLSA-N 1 3 337.533 2.903 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1)C(C)(C)C ZINC000414320822 244086034 /nfs/dbraw/zinc/08/60/34/244086034.db2.gz CUVSERMBVOSCCF-OAHLLOKOSA-N 1 3 331.504 2.908 10 0 EFAEHO NC(=O)C1CC[NH+](CCCCNCc2ccc(Cl)c(F)c2)CC1 ZINC000071836986 203123915 /nfs/dbraw/zinc/12/39/15/203123915.db2.gz HIBQDWHLLGADSG-UHFFFAOYSA-N 1 3 341.858 2.546 10 0 EFAEHO CC(C)OC1CC([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)C1 ZINC000414525299 244211584 /nfs/dbraw/zinc/21/15/84/244211584.db2.gz MBLOCXJVBBQICP-UHFFFAOYSA-N 1 3 332.488 2.559 10 0 EFAEHO CC[C@H]1C[C@@H](C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCO1 ZINC000414528529 244215593 /nfs/dbraw/zinc/21/55/93/244215593.db2.gz UHRJIKNFSHYJBB-PMACEKPBSA-N 1 3 346.515 2.808 10 0 EFAEHO CCCN1CC2(C[C@H]1C(=O)NCCc1ccccc1)CC[NH+](C)CC2 ZINC000072470607 203230551 /nfs/dbraw/zinc/23/05/51/203230551.db2.gz WGRQZWZLFOMKCY-IBGZPJMESA-N 1 3 343.515 2.542 10 0 EFAEHO CC(C)[C@H](Cc1ccc(F)cc1)[N@H+](C)C[C@H]1CCCN(C(=O)CN)C1 ZINC000414738927 244319265 /nfs/dbraw/zinc/31/92/65/244319265.db2.gz IJTLWVFDWWJZGL-MJGOQNOKSA-N 1 3 349.494 2.522 10 0 EFAEHO CC(C)[C@H](Cc1ccc(F)cc1)[N@@H+](C)C[C@H]1CCCN(C(=O)CN)C1 ZINC000414738927 244319268 /nfs/dbraw/zinc/31/92/68/244319268.db2.gz IJTLWVFDWWJZGL-MJGOQNOKSA-N 1 3 349.494 2.522 10 0 EFAEHO CN(Cc1ccccn1)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000075605654 203319607 /nfs/dbraw/zinc/31/96/07/203319607.db2.gz UBYXCKFXPKMAJE-NRFANRHFSA-N 1 3 339.483 2.959 10 0 EFAEHO Cc1c(CCNC[C@]2(O)CC[NH2+]C2)c2ccccc2n1-c1ccccc1 ZINC000077407481 203387470 /nfs/dbraw/zinc/38/74/70/203387470.db2.gz PGCMEKUICRXGDF-JOCHJYFZSA-N 1 3 349.478 2.795 10 0 EFAEHO CCN(C(=O)NC[C@@H]1CCC[NH2+]1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418379839 245140211 /nfs/dbraw/zinc/14/02/11/245140211.db2.gz WJNSROVSQNPBCZ-YTQUADARSA-N 1 3 344.503 2.605 10 0 EFAEHO CCN(C(=O)NC[C@H]([NH3+])C(C)C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418389846 245143039 /nfs/dbraw/zinc/14/30/39/245143039.db2.gz RZTJTKKPCMAEES-UHOSZYNNSA-N 1 3 346.519 2.837 10 0 EFAEHO CCN(C(=O)N[C@H]1CCC[NH2+]C1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418491950 245173899 /nfs/dbraw/zinc/17/38/99/245173899.db2.gz TXZRAELCTZQWIZ-YTQUADARSA-N 1 3 344.503 2.605 10 0 EFAEHO CCN(C(=O)NC[C@H]([NH3+])C1CC1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418495856 245174668 /nfs/dbraw/zinc/17/46/68/245174668.db2.gz GRMRCGUCEGFWGF-SNRMKQJTSA-N 1 3 344.503 2.591 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)N(CCN(C)C)Cc2ccco2)cc1 ZINC000418499094 245176121 /nfs/dbraw/zinc/17/61/21/245176121.db2.gz XSIKPMLZASLKMG-OAHLLOKOSA-N 1 3 344.459 2.573 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)N2CCN(CCC(C)(C)C)CC2)cc1 ZINC000418462533 245166738 /nfs/dbraw/zinc/16/67/38/245166738.db2.gz NBRSALDUKNZEFP-MRXNPFEDSA-N 1 3 346.519 2.970 10 0 EFAEHO C[C@H]1C[NH2+]CC[C@@H]1NC(=O)N1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000418602046 245209128 /nfs/dbraw/zinc/20/91/28/245209128.db2.gz UZZHVRHWIPNSRI-HOTGVXAUSA-N 1 3 338.540 2.526 10 0 EFAEHO CC[C@@H](C)[C@@H](N)C(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000236938511 204130445 /nfs/dbraw/zinc/13/04/45/204130445.db2.gz KFGIZTCVECZAHB-CRAIPNDOSA-N 1 3 332.492 2.520 10 0 EFAEHO CC[C@@H](CNC(=O)c1ccc(C[NH3+])cc1)N1CCc2ccccc2C1 ZINC000236977552 204209398 /nfs/dbraw/zinc/20/93/98/204209398.db2.gz YUSKVBRWNZZALR-FQEVSTJZSA-N 1 3 337.467 2.712 10 0 EFAEHO C[N@H+](CCCCCO)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000105915656 204180843 /nfs/dbraw/zinc/18/08/43/204180843.db2.gz VBDUITYXSLJRCT-FQEVSTJZSA-N 1 3 334.504 2.526 10 0 EFAEHO C[N@@H+](CCCCCO)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000105915656 204180848 /nfs/dbraw/zinc/18/08/48/204180848.db2.gz VBDUITYXSLJRCT-FQEVSTJZSA-N 1 3 334.504 2.526 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)c2cccc(CN3CCCC3)c2)CC[N@@H+]1C ZINC000127704816 205113893 /nfs/dbraw/zinc/11/38/93/205113893.db2.gz OEENARYXSNRCAZ-QFBILLFUSA-N 1 3 329.488 2.837 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)c2cccc(CN3CCCC3)c2)CC[N@H+]1C ZINC000127704816 205113896 /nfs/dbraw/zinc/11/38/96/205113896.db2.gz OEENARYXSNRCAZ-QFBILLFUSA-N 1 3 329.488 2.837 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@H]2CCC[C@@H]([NH3+])C2)N2CCCC2)cc1 ZINC000246510415 205206015 /nfs/dbraw/zinc/20/60/15/205206015.db2.gz QLUWHJOAYCCMAD-OTWHNJEPSA-N 1 3 329.488 2.766 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)c2ccc(C[NH+]3CCCC3)cc2)CCN1C ZINC000265988242 248000522 /nfs/dbraw/zinc/00/05/22/248000522.db2.gz LIBPLTQVWUNUMK-VQIMIIECSA-N 1 3 329.488 2.837 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000127420408 296249508 /nfs/dbraw/zinc/24/95/08/296249508.db2.gz DCWBDBJIAJSINK-IBGZPJMESA-N 1 3 341.499 2.840 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000077793530 284806519 /nfs/dbraw/zinc/80/65/19/284806519.db2.gz JXKLSFICCORXOB-IEBWSBKVSA-N 1 3 346.519 2.853 10 0 EFAEHO CN(Cc1ccccc1)CC(C)(C)C[N@H+](C)[C@@H]1CCN2CCO[C@H]1C2 ZINC000449367063 251002019 /nfs/dbraw/zinc/00/20/19/251002019.db2.gz YWJNIUIQXNOYCW-UXHICEINSA-N 1 3 345.531 2.550 10 0 EFAEHO CN(Cc1ccccc1)CC(C)(C)C[N@@H+](C)[C@@H]1CCN2CCO[C@H]1C2 ZINC000449367063 251002024 /nfs/dbraw/zinc/00/20/24/251002024.db2.gz YWJNIUIQXNOYCW-UXHICEINSA-N 1 3 345.531 2.550 10 0 EFAEHO CN(CC(C)(C)C[N@H+](C)Cc1ccccc1)[C@@H]1CCN2CCO[C@H]1C2 ZINC000449367063 251002027 /nfs/dbraw/zinc/00/20/27/251002027.db2.gz YWJNIUIQXNOYCW-UXHICEINSA-N 1 3 345.531 2.550 10 0 EFAEHO CN(CC(C)(C)C[N@@H+](C)Cc1ccccc1)[C@@H]1CCN2CCO[C@H]1C2 ZINC000449367063 251002029 /nfs/dbraw/zinc/00/20/29/251002029.db2.gz YWJNIUIQXNOYCW-UXHICEINSA-N 1 3 345.531 2.550 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H](C)CCCCO)CC1 ZINC000449430069 251023115 /nfs/dbraw/zinc/02/31/15/251023115.db2.gz VZGNRAGNGZEVIQ-GOSISDBHSA-N 1 3 333.520 2.859 10 0 EFAEHO CC[C@@H](CO)[NH+]1CCN(c2ccnc3ccc(OC(C)C)cc32)CC1 ZINC000450364888 251362471 /nfs/dbraw/zinc/36/24/71/251362471.db2.gz ZIUOBMNSHDCIIA-INIZCTEOSA-N 1 3 343.471 2.915 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000341351827 296427877 /nfs/dbraw/zinc/42/78/77/296427877.db2.gz CMENELSPIOTOPK-LMMKCTJWSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@@H](O)C[NH+]1CCC(CN(C)Cc2c[nH]c(-c3ccccc3)n2)CC1 ZINC000179516440 533665065 /nfs/dbraw/zinc/66/50/65/533665065.db2.gz SJTSMFKUVURCCJ-MRXNPFEDSA-N 1 3 342.487 2.601 10 0 EFAEHO C[C@@H](O)C[NH+]1CCC(CN(C)Cc2cnc(-c3ccccc3)[nH]2)CC1 ZINC000179516440 533665076 /nfs/dbraw/zinc/66/50/76/533665076.db2.gz SJTSMFKUVURCCJ-MRXNPFEDSA-N 1 3 342.487 2.601 10 0 EFAEHO C[C@H](NCC1CC[NH+](C)CC1)c1ccc(-n2cncn2)cc1Cl ZINC000126310805 141366435 /nfs/dbraw/zinc/36/64/35/141366435.db2.gz VIRDCMILXYENIJ-ZDUSSCGKSA-N 1 3 333.867 2.913 10 0 EFAEHO C[C@@H]1CN(C)C[C@@H]1[NH2+]CCCOC1CCN(Cc2ccccc2)CC1 ZINC000344728818 142068453 /nfs/dbraw/zinc/06/84/53/142068453.db2.gz WZJZOYUJFVXRMN-NQIIRXRSSA-N 1 3 345.531 2.597 10 0 EFAEHO Cc1ccc(CCCN2CCN(C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)cn1 ZINC000349412289 142328610 /nfs/dbraw/zinc/32/86/10/142328610.db2.gz YWHDXKVEIZWPGD-WCRBZPEASA-N 1 3 342.531 2.565 10 0 EFAEHO Cc1ccc(CCCN2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)cn1 ZINC000349412289 142328611 /nfs/dbraw/zinc/32/86/11/142328611.db2.gz YWHDXKVEIZWPGD-WCRBZPEASA-N 1 3 342.531 2.565 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000349992877 142388028 /nfs/dbraw/zinc/38/80/28/142388028.db2.gz KPTYVXBRSCLLTD-MSOLQXFVSA-N 1 3 336.524 2.519 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000349992877 142388031 /nfs/dbraw/zinc/38/80/31/142388031.db2.gz KPTYVXBRSCLLTD-MSOLQXFVSA-N 1 3 336.524 2.519 10 0 EFAEHO O=C([C@@H]1CCCN1C1CC1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000426484616 304331013 /nfs/dbraw/zinc/33/10/13/304331013.db2.gz GXHXREHDWDZLGW-MJGOQNOKSA-N 1 3 333.520 2.728 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)NCC[N@@H+]1CCCC[C@H]1C ZINC000341151254 145002259 /nfs/dbraw/zinc/00/22/59/145002259.db2.gz ICUGGUPGHVGGJU-QZTJIDSGSA-N 1 3 346.519 2.681 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)NCC[N@H+]1CCCC[C@H]1C ZINC000341151254 145002261 /nfs/dbraw/zinc/00/22/61/145002261.db2.gz ICUGGUPGHVGGJU-QZTJIDSGSA-N 1 3 346.519 2.681 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000341308645 145030888 /nfs/dbraw/zinc/03/08/88/145030888.db2.gz AIEIWHLRPRCHFE-YQVWRLOYSA-N 1 3 346.519 2.679 10 0 EFAEHO COc1ccccc1/C=C\CN(C)CCN(C)C1CC[NH+](C)CC1 ZINC000349039933 146041082 /nfs/dbraw/zinc/04/10/82/146041082.db2.gz ZFHBYNUVQXXWII-CLFYSBASSA-N 1 3 331.504 2.666 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)Cc1cc(OC)ccc1OC ZINC000349048691 146042480 /nfs/dbraw/zinc/04/24/80/146042480.db2.gz ZWVRGVRVKUKKOJ-GOSISDBHSA-N 1 3 349.519 2.552 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)Cc1cc(OC)ccc1OC ZINC000349048691 146042482 /nfs/dbraw/zinc/04/24/82/146042482.db2.gz ZWVRGVRVKUKKOJ-GOSISDBHSA-N 1 3 349.519 2.552 10 0 EFAEHO CN1CCN(CC2CC[NH+](CCCCOc3ccccc3)CC2)CC1 ZINC000349063912 146046691 /nfs/dbraw/zinc/04/66/91/146046691.db2.gz SIYKWRFVGMLXFE-UHFFFAOYSA-N 1 3 345.531 2.805 10 0 EFAEHO COC(C)(C)CCN1CCN([C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000352876564 146338084 /nfs/dbraw/zinc/33/80/84/146338084.db2.gz NWJCPBIRNXQFGI-HXUWFJFHSA-N 1 3 345.531 2.694 10 0 EFAEHO COC(C)(C)CCN1CCN([C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000352876564 146338086 /nfs/dbraw/zinc/33/80/86/146338086.db2.gz NWJCPBIRNXQFGI-HXUWFJFHSA-N 1 3 345.531 2.694 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000352995495 146369602 /nfs/dbraw/zinc/36/96/02/146369602.db2.gz BTQPZZCVAKUOMY-SZNINPNASA-N 1 3 336.524 2.516 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000352995495 146369605 /nfs/dbraw/zinc/36/96/05/146369605.db2.gz BTQPZZCVAKUOMY-SZNINPNASA-N 1 3 336.524 2.516 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000359144780 148007747 /nfs/dbraw/zinc/00/77/47/148007747.db2.gz TYYIVKYEYHJWLJ-IEBWSBKVSA-N 1 3 346.519 2.681 10 0 EFAEHO C[C@H]1C[C@@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)CC[N@@H+]1C ZINC000368317205 150092812 /nfs/dbraw/zinc/09/28/12/150092812.db2.gz WHCBXQBZAUEOGS-RDJZCZTQSA-N 1 3 331.504 2.710 10 0 EFAEHO C[C@H]1C[C@@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)CC[N@H+]1C ZINC000368317205 150092813 /nfs/dbraw/zinc/09/28/13/150092813.db2.gz WHCBXQBZAUEOGS-RDJZCZTQSA-N 1 3 331.504 2.710 10 0 EFAEHO Cn1cc(C[NH2+]C2CC(N3CCCCC3)C2)c(-c2cccnc2)n1 ZINC000369542632 150382512 /nfs/dbraw/zinc/38/25/12/150382512.db2.gz WBFZQQNBKHDDEE-UHFFFAOYSA-N 1 3 325.460 2.589 10 0 EFAEHO COc1ccc([C@H](NCCN2CCCCCC2)[C@H]2CCC[NH2+]2)cc1 ZINC000422804948 286375689 /nfs/dbraw/zinc/37/56/89/286375689.db2.gz INBRLWFJOLUNCG-UXHICEINSA-N 1 3 331.504 2.954 10 0 EFAEHO Cc1cccc(N2CCN(CCCC[NH2+][C@@H]3CCCOC3)CC2)c1 ZINC000125333364 544616842 /nfs/dbraw/zinc/61/68/42/544616842.db2.gz PMRKFAWTXLGFSQ-LJQANCHMSA-N 1 3 331.504 2.666 10 0 EFAEHO Cc1cccc(N2CCN(CCCC[NH2+][C@H]3CCCOC3)CC2)c1 ZINC000125333584 544616867 /nfs/dbraw/zinc/61/68/67/544616867.db2.gz PMRKFAWTXLGFSQ-IBGZPJMESA-N 1 3 331.504 2.666 10 0 EFAEHO OCC[C@H]1CCCCCN1CCC[N@@H+]1CCCCC[C@@H]1CCO ZINC000342039958 545944883 /nfs/dbraw/zinc/94/48/83/545944883.db2.gz AHEWWEHOOOXPLU-RTBURBONSA-N 1 3 326.525 2.631 10 0 EFAEHO OCC[C@H]1CCCCCN1CCC[N@H+]1CCCCC[C@@H]1CCO ZINC000342039958 545944889 /nfs/dbraw/zinc/94/48/89/545944889.db2.gz AHEWWEHOOOXPLU-RTBURBONSA-N 1 3 326.525 2.631 10 0 EFAEHO CCCN1CCC([NH2+]Cc2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)CC1 ZINC000157134697 544773873 /nfs/dbraw/zinc/77/38/73/544773873.db2.gz KWKFNRUAECYQEO-CALCHBBNSA-N 1 3 346.519 2.659 10 0 EFAEHO C[C@@H](CCNC(=O)N[C@@H](CN(C)C)c1ccccc1)[NH+]1CCCCC1 ZINC000184758180 544968119 /nfs/dbraw/zinc/96/81/19/544968119.db2.gz FNUHDJLNPCNISU-HKUYNNGSSA-N 1 3 346.519 2.853 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1[NH2+]CC(=O)N(C)CC1CC1 ZINC000189959375 265204674 /nfs/dbraw/zinc/20/46/74/265204674.db2.gz UWSQNTIBMHTELZ-IAGOWNOFSA-N 1 3 343.515 2.601 10 0 EFAEHO CN1CCN(c2cccc(Cl)c2CNCCCC[NH+](C)C)CC1 ZINC000271536705 266002691 /nfs/dbraw/zinc/00/26/91/266002691.db2.gz RXYRLQMQXFIEJZ-UHFFFAOYSA-N 1 3 338.927 2.523 10 0 EFAEHO O[C@@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCOCC1 ZINC000272460948 266272821 /nfs/dbraw/zinc/27/28/21/266272821.db2.gz YKPQMNLBIGZGLR-BURNTYAHSA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCOCC1 ZINC000272460948 266272824 /nfs/dbraw/zinc/27/28/24/266272824.db2.gz YKPQMNLBIGZGLR-BURNTYAHSA-N 1 3 344.499 2.559 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)CC[N@@H+]1C ZINC000279223454 273190157 /nfs/dbraw/zinc/19/01/57/273190157.db2.gz PIEZFRNQKZZXMZ-BJLQDIEVSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)CC[N@H+]1C ZINC000279223454 273190159 /nfs/dbraw/zinc/19/01/59/273190159.db2.gz PIEZFRNQKZZXMZ-BJLQDIEVSA-N 1 3 343.515 2.840 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccsc1 ZINC000279235122 273191547 /nfs/dbraw/zinc/19/15/47/273191547.db2.gz QTAFAIJORWDWCG-YQQAZPJKSA-N 1 3 337.533 2.978 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccsc1 ZINC000279235122 273191549 /nfs/dbraw/zinc/19/15/49/273191549.db2.gz QTAFAIJORWDWCG-YQQAZPJKSA-N 1 3 337.533 2.978 10 0 EFAEHO C[C@@H]1CC2(CN1Cc1ccn(-c3ccc(F)cc3)n1)CC[NH2+]CC2 ZINC000424299019 274284042 /nfs/dbraw/zinc/28/40/42/274284042.db2.gz VMAKZTUWANXEKP-OAHLLOKOSA-N 1 3 328.435 2.975 10 0 EFAEHO C[C@H](NCC1CC[NH+](C[C@H](O)c2ccccc2)CC1)c1nccn1C ZINC000182862352 274511832 /nfs/dbraw/zinc/51/18/32/274511832.db2.gz RQJAMZHNEIZODH-LPHOPBHVSA-N 1 3 342.487 2.516 10 0 EFAEHO CCN(C(=O)NC[C@H]([NH3+])C1CC1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418495854 276062303 /nfs/dbraw/zinc/06/23/03/276062303.db2.gz GRMRCGUCEGFWGF-LZQZEXGQSA-N 1 3 344.503 2.591 10 0 EFAEHO CCN(C(=O)N[C@H](C)[C@H](C)[NH3+])[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418729244 276062663 /nfs/dbraw/zinc/06/26/63/276062663.db2.gz QUYCXESRKHJLNH-DFGXFYAUSA-N 1 3 332.492 2.589 10 0 EFAEHO CC[NH+](CC)[C@@H](C)CNC(=O)N[C@@H](C)CN(C)Cc1ccccc1 ZINC000181329716 276112045 /nfs/dbraw/zinc/11/20/45/276112045.db2.gz IMONZYCIMTYXOS-IRXDYDNUSA-N 1 3 334.508 2.536 10 0 EFAEHO CCN1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H]2CN(C)C[C@@H]2C)CC1 ZINC000361182723 276203124 /nfs/dbraw/zinc/20/31/24/276203124.db2.gz HDVJEYBTTVFDQT-TXPKVOOTSA-N 1 3 348.510 2.568 10 0 EFAEHO CCN1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H]2CN(C)C[C@@H]2C)CC1 ZINC000361182720 276203302 /nfs/dbraw/zinc/20/33/02/276203302.db2.gz HDVJEYBTTVFDQT-BXWFABGCSA-N 1 3 348.510 2.568 10 0 EFAEHO CN(C)C[C@H](NC(=O)NCC1(C[NH+](C)C)CCCC1)c1ccccc1 ZINC000184911517 276801163 /nfs/dbraw/zinc/80/11/63/276801163.db2.gz VZCQIUWAKZWVNX-SFHVURJKSA-N 1 3 346.519 2.711 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCNC(=O)c2ccc(Cl)cc2)[C@H]2CCC[C@@H]21 ZINC000375898497 277170979 /nfs/dbraw/zinc/17/09/79/277170979.db2.gz UBKAZVVQUKDPKM-IKGGRYGDSA-N 1 3 335.879 2.532 10 0 EFAEHO C[N@H+]1CC[C@H](NCCNC(=O)c2ccc(Cl)cc2)[C@H]2CCC[C@@H]21 ZINC000375898497 277170980 /nfs/dbraw/zinc/17/09/80/277170980.db2.gz UBKAZVVQUKDPKM-IKGGRYGDSA-N 1 3 335.879 2.532 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000156755686 277435565 /nfs/dbraw/zinc/43/55/65/277435565.db2.gz NWQJSVFVAOUOMQ-ROUUACIJSA-N 1 3 338.540 2.623 10 0 EFAEHO COc1cccc([C@H](C)N2CC[C@H]([NH+]3CCN(C)CC3)[C@@H](C)C2)c1 ZINC000343919586 278021459 /nfs/dbraw/zinc/02/14/59/278021459.db2.gz GJVBXZGKWOYLQI-ZWOKBUDYSA-N 1 3 331.504 2.714 10 0 EFAEHO CC1(C)CCC[NH2+][C@H]1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000261786882 278222758 /nfs/dbraw/zinc/22/27/58/278222758.db2.gz YODZOOVDBOHIKB-ROUUACIJSA-N 1 3 329.488 2.718 10 0 EFAEHO C[C@H]([NH2+][C@@H]1CCN2CCC[C@@H]2C1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000373292418 278274701 /nfs/dbraw/zinc/27/47/01/278274701.db2.gz JFOAGEMSYDNPLZ-MWDXBVQZSA-N 1 3 337.508 2.848 10 0 EFAEHO C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000373292418 278274702 /nfs/dbraw/zinc/27/47/02/278274702.db2.gz JFOAGEMSYDNPLZ-MWDXBVQZSA-N 1 3 337.508 2.848 10 0 EFAEHO C[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000373292418 278274705 /nfs/dbraw/zinc/27/47/05/278274705.db2.gz JFOAGEMSYDNPLZ-MWDXBVQZSA-N 1 3 337.508 2.848 10 0 EFAEHO CCN(C(=O)N[C@H](C)CCC[NH3+])[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418689782 279003851 /nfs/dbraw/zinc/00/38/51/279003851.db2.gz OUZJTPQGIJQKJQ-ZHALLVOQSA-N 1 3 346.519 2.981 10 0 EFAEHO C[C@H]([NH2+][C@@H]1CCN2CCC[C@H]2C1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000373292417 290019676 /nfs/dbraw/zinc/01/96/76/290019676.db2.gz JFOAGEMSYDNPLZ-HZMVEIRTSA-N 1 3 337.508 2.848 10 0 EFAEHO C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000373292417 290019678 /nfs/dbraw/zinc/01/96/78/290019678.db2.gz JFOAGEMSYDNPLZ-HZMVEIRTSA-N 1 3 337.508 2.848 10 0 EFAEHO C[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000373292417 290019679 /nfs/dbraw/zinc/01/96/79/290019679.db2.gz JFOAGEMSYDNPLZ-HZMVEIRTSA-N 1 3 337.508 2.848 10 0 EFAEHO C[C@H](N[C@H](CO)C[C@H](O)C(C)(C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000342813104 290036946 /nfs/dbraw/zinc/03/69/46/290036946.db2.gz GAMKBBFRBBEZJR-LEAZDLGRSA-N 1 3 348.531 2.645 10 0 EFAEHO C[C@H](N[C@H](CO)C[C@H](O)C(C)(C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000342813104 290036950 /nfs/dbraw/zinc/03/69/50/290036950.db2.gz GAMKBBFRBBEZJR-LEAZDLGRSA-N 1 3 348.531 2.645 10 0 EFAEHO COC[C@H](CCC[NH3+])NC1(c2ccc(OC(F)(F)F)cc2)CC1 ZINC000423147237 293095404 /nfs/dbraw/zinc/09/54/04/293095404.db2.gz RLSAURJOCWEIGA-ZDUSSCGKSA-N 1 3 332.366 2.918 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@@H](Cn1ccnc1)c1ccc(C)cc1C ZINC000423007860 293097099 /nfs/dbraw/zinc/09/70/99/293097099.db2.gz YULGWQXHRCMYAH-HKUYNNGSSA-N 1 3 330.476 2.585 10 0 EFAEHO C[C@H](CNC(=O)N[C@@H](CN(C)C)c1ccccc1)[NH+]1CCC(C)CC1 ZINC000128974418 293120767 /nfs/dbraw/zinc/12/07/67/293120767.db2.gz XZRIESNESOSMGQ-MJGOQNOKSA-N 1 3 346.519 2.709 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)N[C@@H](CC(C)C)CN(C)C)c1 ZINC000130909229 293182176 /nfs/dbraw/zinc/18/21/76/293182176.db2.gz UPFRNWJUDHFTMM-IBGZPJMESA-N 1 3 348.535 2.914 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)N[C@@H](CC(C)C)CN(C)C)c1 ZINC000130909229 293182177 /nfs/dbraw/zinc/18/21/77/293182177.db2.gz UPFRNWJUDHFTMM-IBGZPJMESA-N 1 3 348.535 2.914 10 0 EFAEHO CCCN1CCN(c2ccccc2CNC[C@H]2CC[N@H+](CC)C2)CC1 ZINC000151571886 293293970 /nfs/dbraw/zinc/29/39/70/293293970.db2.gz MAXKQKNRGMWYAQ-LJQANCHMSA-N 1 3 344.547 2.650 10 0 EFAEHO CCCN1CCN(c2ccccc2CNC[C@H]2CC[N@@H+](CC)C2)CC1 ZINC000151571886 293293972 /nfs/dbraw/zinc/29/39/72/293293972.db2.gz MAXKQKNRGMWYAQ-LJQANCHMSA-N 1 3 344.547 2.650 10 0 EFAEHO C[NH+](C)CCc1ccc(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC000290629793 294140554 /nfs/dbraw/zinc/14/05/54/294140554.db2.gz ZRXABHUAFLMIES-IBGZPJMESA-N 1 3 335.467 2.942 10 0 EFAEHO CC(C)(O)c1ccc(C[NH2+]C2CCN(C[C@H]3CCOC3)CC2)cc1 ZINC000291409845 294373892 /nfs/dbraw/zinc/37/38/92/294373892.db2.gz GFVQIUIGCNUPAG-QGZVFWFLSA-N 1 3 332.488 2.505 10 0 EFAEHO CSc1ccc([C@@H](CNC(=O)CC2CC[NH+](C)CC2)N(C)C)cc1 ZINC000294181592 295124022 /nfs/dbraw/zinc/12/40/22/295124022.db2.gz BLQIPHPGAMYENB-GOSISDBHSA-N 1 3 349.544 2.859 10 0 EFAEHO COc1cc(OC)c(C[C@H](C)N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)c(OC)c1 ZINC000295080288 295265366 /nfs/dbraw/zinc/26/53/66/295265366.db2.gz RYIDPVBSBTXTEU-HRCADAONSA-N 1 3 348.487 2.860 10 0 EFAEHO COc1cc(OC)c(C[C@H](C)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c(OC)c1 ZINC000295080288 295265367 /nfs/dbraw/zinc/26/53/67/295265367.db2.gz RYIDPVBSBTXTEU-HRCADAONSA-N 1 3 348.487 2.860 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](CCCNC(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000337361957 297358037 /nfs/dbraw/zinc/35/80/37/297358037.db2.gz IQRDFZDHEBBGLZ-KSZLIROESA-N 1 3 338.540 2.528 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000337361957 297358040 /nfs/dbraw/zinc/35/80/40/297358040.db2.gz IQRDFZDHEBBGLZ-KSZLIROESA-N 1 3 338.540 2.528 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)NCCN2CCCC(C)(C)C2)cc1 ZINC000418469061 299003530 /nfs/dbraw/zinc/00/35/30/299003530.db2.gz BBMZKQWYHZCZQV-HNNXBMFYSA-N 1 3 332.492 2.628 10 0 EFAEHO [NH3+]CC1CCC(N[C@H](CCO)c2ccccc2Br)CC1 ZINC000423027804 303371322 /nfs/dbraw/zinc/37/13/22/303371322.db2.gz DYJVOLYGBQNNEN-SEEARECTSA-N 1 3 341.293 2.980 10 0 EFAEHO CC[C@H](N[C@H](C)c1cccc(OCC[NH+](C)C)c1)[C@@H](O)C(F)F ZINC000296395606 310814332 /nfs/dbraw/zinc/81/43/32/310814332.db2.gz KGNUXWMNZJNURH-UHOFOFEASA-N 1 3 330.419 2.682 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@H](O)COc2c(Cl)cccc2Cl)CC[N@@H+]1C ZINC000316874820 311235740 /nfs/dbraw/zinc/23/57/40/311235740.db2.gz WWGPNWALDHJHRI-UPJWGTAASA-N 1 3 347.286 2.805 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@H](O)COc2c(Cl)cccc2Cl)CC[N@H+]1C ZINC000316874820 311235742 /nfs/dbraw/zinc/23/57/42/311235742.db2.gz WWGPNWALDHJHRI-UPJWGTAASA-N 1 3 347.286 2.805 10 0 EFAEHO CON1CCC([NH2+][C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]23)CC1 ZINC000323410644 311240152 /nfs/dbraw/zinc/24/01/52/311240152.db2.gz WDQDISGHKQNPPP-MISYRCLQSA-N 1 3 329.488 2.512 10 0 EFAEHO C[C@H](C[NH2+][C@@H](C)[C@H]1CCN(C(=O)OC(C)(C)C)C1)CN1CCCC1 ZINC000400578829 311969935 /nfs/dbraw/zinc/96/99/35/311969935.db2.gz QAGTZYVCRMEGOD-IKGGRYGDSA-N 1 3 339.524 2.953 10 0 EFAEHO C[C@H]([NH2+]CCCN1CCCC1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000400730568 311970380 /nfs/dbraw/zinc/97/03/80/311970380.db2.gz QJWMMZDDSHNBFQ-JKSUJKDBSA-N 1 3 325.497 2.707 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNCc2ccccc2N2CCOCC2)cc1 ZINC000414804950 312053771 /nfs/dbraw/zinc/05/37/71/312053771.db2.gz FQUCZNVCIYLJBQ-MRXNPFEDSA-N 1 3 325.456 2.833 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000415057050 312085058 /nfs/dbraw/zinc/08/50/58/312085058.db2.gz SZFLWACSCASSLW-VQIMIIECSA-N 1 3 325.460 2.540 10 0 EFAEHO C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+][C@H]1CCCCNC1 ZINC000415064618 312086735 /nfs/dbraw/zinc/08/67/35/312086735.db2.gz DAROQHHNLFHCRE-YOEHRIQHSA-N 1 3 337.895 2.809 10 0 EFAEHO C[NH+](C)CCc1ccccc1NC(=O)NC[C@H](N)c1ccccc1 ZINC000415559082 312152201 /nfs/dbraw/zinc/15/22/01/312152201.db2.gz FBTVAZIJYKIRAK-KRWDZBQOSA-N 1 3 326.444 2.612 10 0 EFAEHO C[C@H](NC(=O)Nc1ccc2c(c1F)CCNC2)C(C)(C)C[NH+](C)C ZINC000415948836 312183509 /nfs/dbraw/zinc/18/35/09/312183509.db2.gz ATLXSQHQJDFILZ-LBPRGKRZSA-N 1 3 336.455 2.569 10 0 EFAEHO CCCC[NH+]1CCC(NC(=O)Nc2ccc3c(c2F)CCNC3)CC1 ZINC000415962975 312186283 /nfs/dbraw/zinc/18/62/83/312186283.db2.gz USFOAMKPKMQIST-UHFFFAOYSA-N 1 3 348.466 2.857 10 0 EFAEHO CCC[N@H+](C)C[C@H]1CCN(C(=O)Nc2ccc3c(c2F)CCNC3)C1 ZINC000415964991 312186867 /nfs/dbraw/zinc/18/68/67/312186867.db2.gz YYIWYFUPJQLMPE-CQSZACIVSA-N 1 3 348.466 2.667 10 0 EFAEHO CCC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccc3c(c2F)CCNC3)C1 ZINC000415964991 312186868 /nfs/dbraw/zinc/18/68/68/312186868.db2.gz YYIWYFUPJQLMPE-CQSZACIVSA-N 1 3 348.466 2.667 10 0 EFAEHO CC1(C)CCC[NH2+][C@H]1C(=O)N[C@H](CN)c1ccc2ccccc2c1 ZINC000417826928 312276892 /nfs/dbraw/zinc/27/68/92/312276892.db2.gz NIJGZNMVAVBLFV-MSOLQXFVSA-N 1 3 325.456 2.734 10 0 EFAEHO CC(C)CC[NH+]1CCC(CNC(=O)NC[C@H](N)c2ccccc2)CC1 ZINC000417830949 312277377 /nfs/dbraw/zinc/27/73/77/312277377.db2.gz BWEGBPSAOVRSLD-IBGZPJMESA-N 1 3 346.519 2.744 10 0 EFAEHO CCCN(C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)C1CC[NH2+]CC1 ZINC000417935239 312298217 /nfs/dbraw/zinc/29/82/17/312298217.db2.gz GKJMQFHGPULSHG-RTBURBONSA-N 1 3 344.503 2.605 10 0 EFAEHO CC[C@H](C)N[C@@H](CNC(=O)NC[C@H]([NH3+])c1ccccc1)c1ccco1 ZINC000418168370 312338485 /nfs/dbraw/zinc/33/84/85/312338485.db2.gz OBUFADFEVYCMLT-XIRDDKMYSA-N 1 3 344.459 2.708 10 0 EFAEHO O=C(NCCN1CCC2(CCCCC2)CC1)N(C1CC1)[C@H]1CC[NH2+]C1 ZINC000418181110 312341265 /nfs/dbraw/zinc/34/12/65/312341265.db2.gz ZECSVXSHLJDMNZ-SFHVURJKSA-N 1 3 348.535 2.569 10 0 EFAEHO O=C(NCCN1CCC2(CCCCC2)CC1)N(C1CC1)[C@@H]1CC[NH2+]C1 ZINC000418181106 312341422 /nfs/dbraw/zinc/34/14/22/312341422.db2.gz ZECSVXSHLJDMNZ-GOSISDBHSA-N 1 3 348.535 2.569 10 0 EFAEHO CCCN(C)[C@H](CNC(=O)N[C@@H](C)[C@H](C)[NH3+])c1ccc(Cl)cc1 ZINC000418191674 312343802 /nfs/dbraw/zinc/34/38/02/312343802.db2.gz XRSNIXWSGWAQQE-HEHGZKQESA-N 1 3 340.899 2.758 10 0 EFAEHO CCCN(C)[C@H](CNC(=O)N[C@H](C)[C@@H](C)[NH3+])c1ccc(Cl)cc1 ZINC000418191680 312343962 /nfs/dbraw/zinc/34/39/62/312343962.db2.gz XRSNIXWSGWAQQE-XJKCOSOUSA-N 1 3 340.899 2.758 10 0 EFAEHO CN1CC[C@@H](NC(=O)NC2CCC([NH+](C)C)CC2)[C@@H]1c1ccccc1 ZINC000420823339 312397602 /nfs/dbraw/zinc/39/76/02/312397602.db2.gz VEYRUCNHOIEJEB-GMNCBBECSA-N 1 3 344.503 2.604 10 0 EFAEHO [NH3+]C[C@@H]1CCCC[C@H]1NCc1cc(Cl)ccc1N1CCOCC1 ZINC000423106874 312411378 /nfs/dbraw/zinc/41/13/78/312411378.db2.gz RNVJSRIIQFNAES-WMLDXEAASA-N 1 3 337.895 2.784 10 0 EFAEHO C[C@H](NC[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc2c(s1)CCC2 ZINC000423381722 312417954 /nfs/dbraw/zinc/41/79/54/312417954.db2.gz IIBAVXGDDRVLLY-NHYWBVRUSA-N 1 3 347.450 2.724 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)Nc1ccc(OCC[NH+](C)C)c(C)c1 ZINC000458195099 313082163 /nfs/dbraw/zinc/08/21/63/313082163.db2.gz LDHYWQCAGSBPDN-QGZVFWFLSA-N 1 3 333.476 2.748 10 0 EFAEHO CCc1cccc(F)c1C[N@@H+]1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000474263489 313206408 /nfs/dbraw/zinc/20/64/08/313206408.db2.gz CSGBYVTWBDYXJE-OXQOHEQNSA-N 1 3 333.495 2.846 10 0 EFAEHO CCc1cccc(F)c1C[N@H+]1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000474263489 313206411 /nfs/dbraw/zinc/20/64/11/313206411.db2.gz CSGBYVTWBDYXJE-OXQOHEQNSA-N 1 3 333.495 2.846 10 0 EFAEHO CCc1cccc(F)c1C[N@@H+]1CC[C@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000474263491 313206536 /nfs/dbraw/zinc/20/65/36/313206536.db2.gz CSGBYVTWBDYXJE-UZLBHIALSA-N 1 3 333.495 2.846 10 0 EFAEHO CCc1cccc(F)c1C[N@H+]1CC[C@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000474263491 313206540 /nfs/dbraw/zinc/20/65/40/313206540.db2.gz CSGBYVTWBDYXJE-UZLBHIALSA-N 1 3 333.495 2.846 10 0 EFAEHO CCCN1CC[C@H](C[NH2+][C@@H](C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1 ZINC000496297960 315017698 /nfs/dbraw/zinc/01/76/98/315017698.db2.gz YDBCTEVGSWYVRO-GVDBMIGSSA-N 1 3 339.524 2.953 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@H]1CC[C@@H](C(=O)N2CCCCC2)C1 ZINC000514666944 315550773 /nfs/dbraw/zinc/55/07/73/315550773.db2.gz CVEMHFSYBNHFGZ-OIISXLGYSA-N 1 3 344.503 2.681 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCC1)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC000530030198 317032160 /nfs/dbraw/zinc/03/21/60/317032160.db2.gz YLMSCUURIGGHQX-RBUKOAKNSA-N 1 3 333.520 2.917 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCC1)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC000530030198 317032163 /nfs/dbraw/zinc/03/21/63/317032163.db2.gz YLMSCUURIGGHQX-RBUKOAKNSA-N 1 3 333.520 2.917 10 0 EFAEHO O=C1Nc2ccccc2C12CCC([NH2+][C@@H]1CCNC13CCC3)CC2 ZINC000530221379 317084013 /nfs/dbraw/zinc/08/40/13/317084013.db2.gz PVLDVVGIXOKOFO-LTCLLZNKSA-N 1 3 325.456 2.693 10 0 EFAEHO Clc1ccccc1OCCN1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530239810 317089265 /nfs/dbraw/zinc/08/92/65/317089265.db2.gz VMIULQHBGXVMEN-INIZCTEOSA-N 1 3 338.879 2.809 10 0 EFAEHO CCOc1cc(CN2CCC(CO[C@H]3CC[NH2+]C3)CC2)ccc1OC ZINC000530248141 317091227 /nfs/dbraw/zinc/09/12/27/317091227.db2.gz HEVBSAXSHAZCRI-SFHVURJKSA-N 1 3 348.487 2.684 10 0 EFAEHO CN(CCC(=O)NCCCCC[NH+]1CCCCC1)c1ccncc1 ZINC000540925428 317758606 /nfs/dbraw/zinc/75/86/06/317758606.db2.gz JMVMOUYHSJRZSN-UHFFFAOYSA-N 1 3 332.492 2.680 10 0 EFAEHO C[C@H](NC(=O)CCN(C)c1cc[nH+]cc1)[C@@H](c1ccccc1)N(C)C ZINC000548104537 318073635 /nfs/dbraw/zinc/07/36/35/318073635.db2.gz UXOJOHRQCVHZJW-JXFKEZNVSA-N 1 3 340.471 2.716 10 0 EFAEHO C[C@@H]1[C@@H](NCC(=O)NCC[NH+]2CCCCCC2)C[C@@H]1c1ccccc1 ZINC000552064779 318240825 /nfs/dbraw/zinc/24/08/25/318240825.db2.gz OGROKZIUBZCLNJ-IHPCNDPISA-N 1 3 343.515 2.760 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000552370161 318253802 /nfs/dbraw/zinc/25/38/02/318253802.db2.gz UZKFVMNDHXBFMF-IBGZPJMESA-N 1 3 331.504 2.889 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]3CCCC[C@H]3[NH2+]2)N(C)C)cc1 ZINC000554302508 318307318 /nfs/dbraw/zinc/30/73/18/318307318.db2.gz NYPYJJZKOUFGNV-ZRNYENFQSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000554597693 318327915 /nfs/dbraw/zinc/32/79/15/318327915.db2.gz UGFMMSRNVZOKPO-ROUUACIJSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000554597693 318327918 /nfs/dbraw/zinc/32/79/18/318327918.db2.gz UGFMMSRNVZOKPO-ROUUACIJSA-N 1 3 343.515 2.877 10 0 EFAEHO OC1(C[NH2+][C@H]2CCC23CCOCC3)CCN(Cc2ccccc2)CC1 ZINC000560883978 318580042 /nfs/dbraw/zinc/58/00/42/318580042.db2.gz COMAFNTXCNROFS-IBGZPJMESA-N 1 3 344.499 2.562 10 0 EFAEHO C[C@H]1CCC[C@H](C)[NH+]1CCNC(=O)Nc1cccc2c1CCNC2 ZINC000563498902 318789453 /nfs/dbraw/zinc/78/94/53/318789453.db2.gz CYHATCMVOHEZOR-GJZGRUSLSA-N 1 3 330.476 2.717 10 0 EFAEHO C[C@H](C[C@H](C)[NH3+])NC(=O)N1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000565595149 318985432 /nfs/dbraw/zinc/98/54/32/318985432.db2.gz AYRVAZHTBQSDPH-LSDHHAIUSA-N 1 3 326.529 2.654 10 0 EFAEHO CCN(C(=O)[C@H](C)[NH2+]C1CC1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000567046571 319133386 /nfs/dbraw/zinc/13/33/86/319133386.db2.gz HXYTYXWURFWRCV-FRQCXROJSA-N 1 3 329.488 2.811 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[NH2+][C@@H]1C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000567267101 319156232 /nfs/dbraw/zinc/15/62/32/319156232.db2.gz SEZGODUCFXNQCC-PSBWJHGTSA-N 1 3 329.488 2.668 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[NH2+][C@@H]1C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000567267102 319156241 /nfs/dbraw/zinc/15/62/41/319156241.db2.gz SEZGODUCFXNQCC-UKBAYJJMSA-N 1 3 329.488 2.668 10 0 EFAEHO CC(C)c1ccc([C@@H](N)CNC(=O)N2CCC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC000567597191 319186824 /nfs/dbraw/zinc/18/68/24/319186824.db2.gz YDQLYOYEFHQSIC-ICSRJNTNSA-N 1 3 344.503 2.595 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)C1 ZINC000568291663 319269438 /nfs/dbraw/zinc/26/94/38/319269438.db2.gz QJVVWPOUHZUTHN-WSTZPKSXSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000568291663 319269441 /nfs/dbraw/zinc/26/94/41/319269441.db2.gz QJVVWPOUHZUTHN-WSTZPKSXSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)C1 ZINC000568291660 319269614 /nfs/dbraw/zinc/26/96/14/319269614.db2.gz QJVVWPOUHZUTHN-GGPKGHCWSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000568291660 319269616 /nfs/dbraw/zinc/26/96/16/319269616.db2.gz QJVVWPOUHZUTHN-GGPKGHCWSA-N 1 3 343.515 2.745 10 0 EFAEHO O=C(c1ccccc1CC1CC[NH2+]CC1)N1CC[C@H](N2CCCC2)C1 ZINC000568985631 319337249 /nfs/dbraw/zinc/33/72/49/319337249.db2.gz BSMCEBGWOYOHDA-IBGZPJMESA-N 1 3 341.499 2.539 10 0 EFAEHO CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1ccccc1CC[NH3+] ZINC000571771665 319605934 /nfs/dbraw/zinc/60/59/34/319605934.db2.gz LMLRSAZLJDBAMF-UHFFFAOYSA-N 1 3 339.483 2.912 10 0 EFAEHO Cc1nc(CCN[C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c(C)o1 ZINC000572392047 319665648 /nfs/dbraw/zinc/66/56/48/319665648.db2.gz FJEPGMDOJLEMSV-MJGOQNOKSA-N 1 3 327.428 2.679 10 0 EFAEHO CC(C)OC[C@H](O)CNCc1ccccc1C[NH+]1CCCCCC1 ZINC000572870103 319712762 /nfs/dbraw/zinc/71/27/62/319712762.db2.gz AYETXCCWCLMNOW-HXUWFJFHSA-N 1 3 334.504 2.938 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3CC4(CCC4)C[C@@H]3C)CC2)CC1 ZINC000576647993 320035614 /nfs/dbraw/zinc/03/56/14/320035614.db2.gz VSTQKDMRWUUTMT-KRWDZBQOSA-N 1 3 347.547 2.974 10 0 EFAEHO [NH3+][C@@H]1CCC[C@H](NC[C@@H](CO)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000576886926 320058187 /nfs/dbraw/zinc/05/81/87/320058187.db2.gz BWWJXGDLZNXAHB-IMJJTQAJSA-N 1 3 330.394 2.716 10 0 EFAEHO N[C@@H]1CCC[C@H]([NH2+]C[C@@H](CO)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000576886926 320058189 /nfs/dbraw/zinc/05/81/89/320058189.db2.gz BWWJXGDLZNXAHB-IMJJTQAJSA-N 1 3 330.394 2.716 10 0 EFAEHO [NH3+][C@@H]1CCC[C@@H](NC[C@@H](CO)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000576886927 320058225 /nfs/dbraw/zinc/05/82/25/320058225.db2.gz BWWJXGDLZNXAHB-NUEKZKHPSA-N 1 3 330.394 2.716 10 0 EFAEHO N[C@@H]1CCC[C@@H]([NH2+]C[C@@H](CO)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000576886927 320058227 /nfs/dbraw/zinc/05/82/27/320058227.db2.gz BWWJXGDLZNXAHB-NUEKZKHPSA-N 1 3 330.394 2.716 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3CC[C@@H](C(C)C)C3)CC2)CC1 ZINC000577122980 320079682 /nfs/dbraw/zinc/07/96/82/320079682.db2.gz YPXGTNJOALVOPK-GOSISDBHSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N1C[C@H](N[C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1=O ZINC000578768447 320238292 /nfs/dbraw/zinc/23/82/92/320238292.db2.gz BTDQUZNHSSQIOB-RTBURBONSA-N 1 3 341.499 2.783 10 0 EFAEHO CC(C)N1C[C@H](N[C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1=O ZINC000578768447 320238294 /nfs/dbraw/zinc/23/82/94/320238294.db2.gz BTDQUZNHSSQIOB-RTBURBONSA-N 1 3 341.499 2.783 10 0 EFAEHO N[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000579944640 324062739 /nfs/dbraw/zinc/06/27/39/324062739.db2.gz LMJZZAKBOMERCC-RAIGVLPGSA-N 1 3 348.800 2.802 10 0 EFAEHO CN1CCC[C@H]1CNC(=O)NCc1ccccc1C[NH+]1CCCCC1 ZINC000139440364 473231647 /nfs/dbraw/zinc/23/16/47/473231647.db2.gz GPWNLSWZJYANAM-IBGZPJMESA-N 1 3 344.503 2.566 10 0 EFAEHO CCCC[C@H](COC)[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000124720617 473291088 /nfs/dbraw/zinc/29/10/88/473291088.db2.gz ILDTXKGOBXOJRN-GOSISDBHSA-N 1 3 325.541 2.732 10 0 EFAEHO Cc1ccccc1C(=O)NC1CC[NH+](CC[C@H]2CCCN2C)CC1 ZINC000124930354 473327079 /nfs/dbraw/zinc/32/70/79/473327079.db2.gz XKTBTJPRUTXTLF-GOSISDBHSA-N 1 3 329.488 2.674 10 0 EFAEHO CCC[C@@H](C(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)N(C)C ZINC000162356986 473330670 /nfs/dbraw/zinc/33/06/70/473330670.db2.gz MKEJONLLNMIKRN-OALUTQOASA-N 1 3 331.504 2.697 10 0 EFAEHO CCC[C@@H](C(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N(C)C ZINC000162356986 473330674 /nfs/dbraw/zinc/33/06/74/473330674.db2.gz MKEJONLLNMIKRN-OALUTQOASA-N 1 3 331.504 2.697 10 0 EFAEHO Cc1c(OCCN2CCCCC2)cc(Cl)cc1N1CC[NH2+]CC1 ZINC000149975522 473332445 /nfs/dbraw/zinc/33/24/45/473332445.db2.gz FHCHAWMBEYOCHR-UHFFFAOYSA-N 1 3 337.895 2.923 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)[C@@H]3C[C@@H]3C3CCCCC3)CC2)CC1 ZINC000162474355 473345167 /nfs/dbraw/zinc/34/51/67/473345167.db2.gz LPGWJOJJFCIFTF-WOJBJXKFSA-N 1 3 347.547 2.878 10 0 EFAEHO CCN1CCC[C@H]1CN(C)C(=O)NCCC[N@H+](C)C1CCCCC1 ZINC000177331366 473356272 /nfs/dbraw/zinc/35/62/72/473356272.db2.gz YVOWFEQDXIAFDT-SFHVURJKSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN1CCC[C@H]1CN(C)C(=O)NCCC[N@@H+](C)C1CCCCC1 ZINC000177331366 473356278 /nfs/dbraw/zinc/35/62/78/473356278.db2.gz YVOWFEQDXIAFDT-SFHVURJKSA-N 1 3 338.540 2.767 10 0 EFAEHO C[C@H]([NH2+]CCCCN1C[C@@H](C)O[C@@H](C)C1)c1ccc2c(c1)OCCO2 ZINC000162857644 473391748 /nfs/dbraw/zinc/39/17/48/473391748.db2.gz QSRZBBOHOQSPON-BBWFWOEESA-N 1 3 348.487 2.998 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2cncc(OC)c2C)[C@@H](C)C1 ZINC000631074247 479878925 /nfs/dbraw/zinc/87/89/25/479878925.db2.gz WIXPSHGUQREQNZ-YJBOKZPZSA-N 1 3 335.492 2.625 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)[C@@H](C)[NH3+] ZINC000399354728 476882352 /nfs/dbraw/zinc/88/23/52/476882352.db2.gz FJQBDUAPJXWVHN-NEWSRXKRSA-N 1 3 331.504 2.729 10 0 EFAEHO CN1CCN(CC[NH2+]Cc2ccccc2CC(F)(F)F)CC1(C)C ZINC000631126489 479910527 /nfs/dbraw/zinc/91/05/27/479910527.db2.gz KWIBEQLHICFULC-UHFFFAOYSA-N 1 3 343.437 2.907 10 0 EFAEHO CN1CCN(CCCOc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000022930302 472023756 /nfs/dbraw/zinc/02/37/56/472023756.db2.gz BNIODALAVHNQQG-UHFFFAOYSA-N 1 3 331.504 2.689 10 0 EFAEHO C[N@@H+]1CC[C@@H](CNC(=O)c2cccc(CN3CCCCCC3)c2)C1 ZINC000067934140 472111916 /nfs/dbraw/zinc/11/19/16/472111916.db2.gz FEUACNBZWKOUGO-SFHVURJKSA-N 1 3 329.488 2.744 10 0 EFAEHO C[N@H+]1CC[C@@H](CNC(=O)c2cccc(CN3CCCCCC3)c2)C1 ZINC000067934140 472111919 /nfs/dbraw/zinc/11/19/19/472111919.db2.gz FEUACNBZWKOUGO-SFHVURJKSA-N 1 3 329.488 2.744 10 0 EFAEHO CN(C)CCOc1ccccc1C(=O)NCC[N@H+](C)C1CCCCC1 ZINC000068899254 472261931 /nfs/dbraw/zinc/26/19/31/472261931.db2.gz ZTLFBIDXYQUOJS-UHFFFAOYSA-N 1 3 347.503 2.621 10 0 EFAEHO CN(C)CCOc1ccccc1C(=O)NCC[N@@H+](C)C1CCCCC1 ZINC000068899254 472261938 /nfs/dbraw/zinc/26/19/38/472261938.db2.gz ZTLFBIDXYQUOJS-UHFFFAOYSA-N 1 3 347.503 2.621 10 0 EFAEHO OCC[NH+]1CCC(CNCc2nc(-c3ccccc3)cs2)CC1 ZINC000069431679 472342226 /nfs/dbraw/zinc/34/22/26/472342226.db2.gz MOHMIHRMQDIOEU-UHFFFAOYSA-N 1 3 331.485 2.604 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)NCCC[N@H+](C)Cc1ccccc1 ZINC000045125944 472375258 /nfs/dbraw/zinc/37/52/58/472375258.db2.gz SLQYGWDOOMPPMM-GOSISDBHSA-N 1 3 346.519 2.682 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)NCCC[N@@H+](C)Cc1ccccc1 ZINC000045125944 472375262 /nfs/dbraw/zinc/37/52/62/472375262.db2.gz SLQYGWDOOMPPMM-GOSISDBHSA-N 1 3 346.519 2.682 10 0 EFAEHO COCC[N@@H+]1CC[C@@H](CNCc2ccc(Cl)c3cccnc23)C1 ZINC000089414143 472431853 /nfs/dbraw/zinc/43/18/53/472431853.db2.gz DIMCJTQGDSFOID-AWEZNQCLSA-N 1 3 333.863 2.946 10 0 EFAEHO COCC[N@H+]1CC[C@@H](CNCc2ccc(Cl)c3cccnc23)C1 ZINC000089414143 472431861 /nfs/dbraw/zinc/43/18/61/472431861.db2.gz DIMCJTQGDSFOID-AWEZNQCLSA-N 1 3 333.863 2.946 10 0 EFAEHO CC(C)N1CCC([NH2+][C@@H]2CC(=O)N(C)[C@H]2c2ccc(F)cc2)CC1 ZINC000097082168 472436400 /nfs/dbraw/zinc/43/64/00/472436400.db2.gz MLTWGLGTTWCIOK-MJGOQNOKSA-N 1 3 333.451 2.560 10 0 EFAEHO CC[NH+](CC)CC1CCN(Cc2cc(=O)n3cc(C)ccc3n2)CC1 ZINC000057847176 472483702 /nfs/dbraw/zinc/48/37/02/472483702.db2.gz PFRZFVZKVUGMPR-UHFFFAOYSA-N 1 3 342.487 2.557 10 0 EFAEHO C[C@H](CN[C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000631269185 479996444 /nfs/dbraw/zinc/99/64/44/479996444.db2.gz IGVHDCXCVKEBLJ-ZBFHGGJFSA-N 1 3 338.517 2.656 10 0 EFAEHO C[C@H](CN[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000631269185 479996449 /nfs/dbraw/zinc/99/64/49/479996449.db2.gz IGVHDCXCVKEBLJ-ZBFHGGJFSA-N 1 3 338.517 2.656 10 0 EFAEHO CC(C)C[C@@H](C[NH+](C)C)NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000079121255 472822949 /nfs/dbraw/zinc/82/29/49/472822949.db2.gz FDFBSWQPXJJMEP-ZWKOTPCHSA-N 1 3 334.508 2.565 10 0 EFAEHO C[C@@H](CNC(=O)N[C@@H](CN(C)C)c1ccccc1)[N@@H+]1CCC[C@@H](C)C1 ZINC000048216414 472832804 /nfs/dbraw/zinc/83/28/04/472832804.db2.gz HLUZNGHECJLDER-AOIWGVFYSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@@H](CNC(=O)N[C@@H](CN(C)C)c1ccccc1)[N@H+]1CCC[C@@H](C)C1 ZINC000048216414 472832810 /nfs/dbraw/zinc/83/28/10/472832810.db2.gz HLUZNGHECJLDER-AOIWGVFYSA-N 1 3 346.519 2.709 10 0 EFAEHO CCC[C@@H](C(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1)N(C)C ZINC000092693121 472964841 /nfs/dbraw/zinc/96/48/41/472964841.db2.gz BGTHHVILOICENE-IBGZPJMESA-N 1 3 346.519 2.877 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000620192494 480022305 /nfs/dbraw/zinc/02/23/05/480022305.db2.gz NLSNHRLMENNRMF-IBGZPJMESA-N 1 3 343.515 2.745 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000620192494 480022312 /nfs/dbraw/zinc/02/23/12/480022312.db2.gz NLSNHRLMENNRMF-IBGZPJMESA-N 1 3 343.515 2.745 10 0 EFAEHO CCN(CC)CC(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000620192431 480022590 /nfs/dbraw/zinc/02/25/90/480022590.db2.gz MEIHVKRSCMFCBU-LJQANCHMSA-N 1 3 343.515 2.747 10 0 EFAEHO CCN(CC)CC(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000620192431 480022594 /nfs/dbraw/zinc/02/25/94/480022594.db2.gz MEIHVKRSCMFCBU-LJQANCHMSA-N 1 3 343.515 2.747 10 0 EFAEHO O=C(CCN1CCC(C[NH+]2CCCC2)CC1)NCC1CCCCC1 ZINC000109005048 473073018 /nfs/dbraw/zinc/07/30/18/473073018.db2.gz IVNHBMIJPXKZGZ-UHFFFAOYSA-N 1 3 335.536 2.881 10 0 EFAEHO CN1CCC[C@@H](NC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000052519291 473116342 /nfs/dbraw/zinc/11/63/42/473116342.db2.gz JEXIAVKTQFEQGF-LJQANCHMSA-N 1 3 344.503 2.566 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCc2ccccc2C[NH+]2CCCC2)C1 ZINC000052519347 473116652 /nfs/dbraw/zinc/11/66/52/473116652.db2.gz URMOMUDNSOFLSY-IBGZPJMESA-N 1 3 344.503 2.566 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCc2ccccc2C[N@H+](C)C(C)C)C1 ZINC000052523037 473118238 /nfs/dbraw/zinc/11/82/38/473118238.db2.gz LWQZZYGAYWKROF-LJQANCHMSA-N 1 3 346.519 2.810 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCc2ccccc2C[N@@H+](C)C(C)C)C1 ZINC000052523037 473118245 /nfs/dbraw/zinc/11/82/45/473118245.db2.gz LWQZZYGAYWKROF-LJQANCHMSA-N 1 3 346.519 2.810 10 0 EFAEHO Cc1nccn1-c1ccc([C@H](C)[NH2+]C[C@H](O)CN2CCCCC2)cc1 ZINC000151296698 473439048 /nfs/dbraw/zinc/43/90/48/473439048.db2.gz GJWALEDBRXHUBA-JXFKEZNVSA-N 1 3 342.487 2.678 10 0 EFAEHO C[NH+]1CCC(C(=O)N[C@H]2CCCCCN(Cc3ccccc3)C2)CC1 ZINC000633889466 480039508 /nfs/dbraw/zinc/03/95/08/480039508.db2.gz SPGZXYPDHSVUBN-FQEVSTJZSA-N 1 3 343.515 2.889 10 0 EFAEHO CN1CCN(CCCC[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000166146866 473521414 /nfs/dbraw/zinc/52/14/14/473521414.db2.gz BYBMSZIDOGRVJX-CTNGQTDRSA-N 1 3 345.531 2.772 10 0 EFAEHO CN1CCN(CCCC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000166146695 473521968 /nfs/dbraw/zinc/52/19/68/473521968.db2.gz BYBMSZIDOGRVJX-FPOVZHCZSA-N 1 3 345.531 2.772 10 0 EFAEHO C[C@H]1C[C@@H](c2ccccc2)CN1CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000115553440 473581133 /nfs/dbraw/zinc/58/11/33/473581133.db2.gz JZBAPQGKYQZAMD-FUHWJXTLSA-N 1 3 341.499 2.607 10 0 EFAEHO C[C@H](Cc1ccc(Br)c(F)c1)NCC1([NH3+])CCOCC1 ZINC000629389001 480243805 /nfs/dbraw/zinc/24/38/05/480243805.db2.gz HUJGYRZYGMJOOQ-LLVKDONJSA-N 1 3 345.256 2.617 10 0 EFAEHO CC[NH+](CC)[C@@H]1CCN(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)C1 ZINC000179267460 473665834 /nfs/dbraw/zinc/66/58/34/473665834.db2.gz NOAGADXWKGCSQE-CEXWTWQISA-N 1 3 344.503 2.558 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CC[N@@H+]1C ZINC000179471648 473689219 /nfs/dbraw/zinc/68/92/19/473689219.db2.gz WFDPFAULFVYECF-NXWXRZEISA-N 1 3 344.503 2.556 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CC[N@H+]1C ZINC000179471648 473689221 /nfs/dbraw/zinc/68/92/21/473689221.db2.gz WFDPFAULFVYECF-NXWXRZEISA-N 1 3 344.503 2.556 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3[NH2+]2)CN1Cc1ccccc1 ZINC000262655650 473707084 /nfs/dbraw/zinc/70/70/84/473707084.db2.gz CNMFJCYHGQBFJL-ZKIDJSGLSA-N 1 3 341.499 2.686 10 0 EFAEHO COc1cc2c(cc1F)nccc2N[C@H](C)CC[NH+]1CCN(C)CC1 ZINC000281410152 473712057 /nfs/dbraw/zinc/71/20/57/473712057.db2.gz HVDOIAGBHNGQJN-CQSZACIVSA-N 1 3 346.450 2.820 10 0 EFAEHO CC(C)C[C@H](C[NH+](C)C)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000245704024 473738723 /nfs/dbraw/zinc/73/87/23/473738723.db2.gz ZYJCHSAYEGGPRL-QRVBRYPASA-N 1 3 346.519 2.707 10 0 EFAEHO CC(C)N1CC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)C1=O ZINC000245744436 473743910 /nfs/dbraw/zinc/74/39/10/473743910.db2.gz SGAXLRBLQGNQRG-YSTOQKLRSA-N 1 3 341.499 2.781 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000245848174 473749674 /nfs/dbraw/zinc/74/96/74/473749674.db2.gz FVXQKDIWESXNLD-ZIFCJYIRSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000245848174 473749681 /nfs/dbraw/zinc/74/96/81/473749681.db2.gz FVXQKDIWESXNLD-ZIFCJYIRSA-N 1 3 346.519 2.631 10 0 EFAEHO CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000246183276 473793135 /nfs/dbraw/zinc/79/31/35/473793135.db2.gz LXHRYEUWWMRSBE-CEXWTWQISA-N 1 3 344.503 2.558 10 0 EFAEHO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000246183276 473793140 /nfs/dbraw/zinc/79/31/40/473793140.db2.gz LXHRYEUWWMRSBE-CEXWTWQISA-N 1 3 344.503 2.558 10 0 EFAEHO CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NCC(C)(C)N1CCCCC1 ZINC000246193518 473795916 /nfs/dbraw/zinc/79/59/16/473795916.db2.gz MNHWWXRBWSYUQF-SJORKVTESA-N 1 3 336.524 2.519 10 0 EFAEHO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCC(C)(C)N1CCCCC1 ZINC000246193518 473795924 /nfs/dbraw/zinc/79/59/24/473795924.db2.gz MNHWWXRBWSYUQF-SJORKVTESA-N 1 3 336.524 2.519 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NC[C@H](c2ccccc2)N(C)C)CC1 ZINC000173323310 473806151 /nfs/dbraw/zinc/80/61/51/473806151.db2.gz UXFWQEXCYUHPSN-LJQANCHMSA-N 1 3 346.519 2.711 10 0 EFAEHO CS[C@H](CO)[C@@H](C)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180146100 473810102 /nfs/dbraw/zinc/81/01/02/473810102.db2.gz CVJRKOLTCYALQC-JUFRUHRKSA-N 1 3 334.529 2.884 10 0 EFAEHO CS[C@H](CO)[C@@H](C)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180146100 473810109 /nfs/dbraw/zinc/81/01/09/473810109.db2.gz CVJRKOLTCYALQC-JUFRUHRKSA-N 1 3 334.529 2.884 10 0 EFAEHO Cc1cc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c(C(F)(F)F)o1 ZINC000617507325 480249503 /nfs/dbraw/zinc/24/95/03/480249503.db2.gz RRACFXRGHWRKLE-NSHDSACASA-N 1 3 349.397 2.609 10 0 EFAEHO C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)C1 ZINC000246352388 473836657 /nfs/dbraw/zinc/83/66/57/473836657.db2.gz PIWMGGYYSPIMDS-IKGGRYGDSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)C1 ZINC000246352388 473836665 /nfs/dbraw/zinc/83/66/65/473836665.db2.gz PIWMGGYYSPIMDS-IKGGRYGDSA-N 1 3 338.540 2.621 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2cccc(CN(C)C)c2)[C@@H](C)C1 ZINC000246516799 473888787 /nfs/dbraw/zinc/88/87/87/473888787.db2.gz UNIFPVYSYVCCAB-LPHOPBHVSA-N 1 3 346.519 2.620 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NCc2cccc(CN(C)C)c2)[C@@H](C)C1 ZINC000246516799 473888795 /nfs/dbraw/zinc/88/87/95/473888795.db2.gz UNIFPVYSYVCCAB-LPHOPBHVSA-N 1 3 346.519 2.620 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)NCCCC[N@@H+]2CCCC[C@@H]2C)CCN1C ZINC000173892717 473952063 /nfs/dbraw/zinc/95/20/63/473952063.db2.gz LVHYPADKPMVYEG-RCCFBDPRSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)CCN1C ZINC000173892717 473952071 /nfs/dbraw/zinc/95/20/71/473952071.db2.gz LVHYPADKPMVYEG-RCCFBDPRSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)CCc1cc(Cl)cs1 ZINC000617506006 480250911 /nfs/dbraw/zinc/25/09/11/480250911.db2.gz XPALJDLDYZLMJD-ZDUSSCGKSA-N 1 3 345.940 2.722 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)CCc1cc(Cl)cs1 ZINC000617506006 480250917 /nfs/dbraw/zinc/25/09/17/480250917.db2.gz XPALJDLDYZLMJD-ZDUSSCGKSA-N 1 3 345.940 2.722 10 0 EFAEHO CCN1CC[C@H](C[NH2+][C@H](C)c2ccc(OCc3nccn3C)cc2)C1 ZINC000247011381 474034629 /nfs/dbraw/zinc/03/46/29/474034629.db2.gz LFWNDVSKEYQUPP-IAGOWNOFSA-N 1 3 342.487 2.992 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)Nc2cccc(CN(C)C)c2)CC1 ZINC000195425897 474073935 /nfs/dbraw/zinc/07/39/35/474073935.db2.gz SMZDFSLUNLSLHL-UHFFFAOYSA-N 1 3 332.492 2.992 10 0 EFAEHO C[N@H+](C[C@H]1CCCO1)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000247143978 474075414 /nfs/dbraw/zinc/07/54/14/474075414.db2.gz LCVJAKDIYMBPHR-WOJBJXKFSA-N 1 3 332.488 2.543 10 0 EFAEHO C[N@@H+](C[C@H]1CCCO1)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000247143978 474075422 /nfs/dbraw/zinc/07/54/22/474075422.db2.gz LCVJAKDIYMBPHR-WOJBJXKFSA-N 1 3 332.488 2.543 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCC(C)(C)[NH2+][C@H](C)c2ccccc2)C1 ZINC000247204093 474087821 /nfs/dbraw/zinc/08/78/21/474087821.db2.gz LTNCNBDHDAXZDY-SJLPKXTDSA-N 1 3 346.519 2.899 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCC2CC[NH+](CCC(C)C)CC2)C1 ZINC000175436180 474218914 /nfs/dbraw/zinc/21/89/14/474218914.db2.gz MYTBJYSLXUAMQJ-SFHVURJKSA-N 1 3 338.540 2.528 10 0 EFAEHO C[N@@H+]1CCC[C@@H]2CN(C(=O)c3cccc(CN4CCCC4)c3)CC[C@H]21 ZINC000248014665 474246512 /nfs/dbraw/zinc/24/65/12/474246512.db2.gz LQKJRXYTXRBPOG-WOJBJXKFSA-N 1 3 341.499 2.839 10 0 EFAEHO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cccc(CN4CCCC4)c3)CC[C@H]21 ZINC000248014665 474246521 /nfs/dbraw/zinc/24/65/21/474246521.db2.gz LQKJRXYTXRBPOG-WOJBJXKFSA-N 1 3 341.499 2.839 10 0 EFAEHO CC(C)C(=O)NCCN[C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248411724 474314508 /nfs/dbraw/zinc/31/45/08/474314508.db2.gz ZMEQYRVXWDDRDC-XUVXKRRUSA-N 1 3 343.515 2.649 10 0 EFAEHO CC(C)C(=O)NCCN[C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248411724 474314513 /nfs/dbraw/zinc/31/45/13/474314513.db2.gz ZMEQYRVXWDDRDC-XUVXKRRUSA-N 1 3 343.515 2.649 10 0 EFAEHO CC(C)C(=O)NCC[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000248411724 474314521 /nfs/dbraw/zinc/31/45/21/474314521.db2.gz ZMEQYRVXWDDRDC-XUVXKRRUSA-N 1 3 343.515 2.649 10 0 EFAEHO CN(C)C[C@@H](Cc1ccccc1)NC(=O)CC[C@H]([NH3+])c1ccccc1 ZINC000237012047 474322817 /nfs/dbraw/zinc/32/28/17/474322817.db2.gz LQKVSIFJFFKFRY-UXHICEINSA-N 1 3 339.483 2.756 10 0 EFAEHO CCN1CC[C@H](C[NH2+][C@@H](CCn2cncn2)c2ccc(C)cc2)C1 ZINC000275867102 474345759 /nfs/dbraw/zinc/34/57/59/474345759.db2.gz NVENOWYERSREEA-MJGOQNOKSA-N 1 3 327.476 2.649 10 0 EFAEHO CC[N@@H+]1CC[C@H](CN[C@@H](CCn2cncn2)c2ccc(C)cc2)C1 ZINC000275867102 474345764 /nfs/dbraw/zinc/34/57/64/474345764.db2.gz NVENOWYERSREEA-MJGOQNOKSA-N 1 3 327.476 2.649 10 0 EFAEHO CC[N@H+]1CC[C@H](CN[C@@H](CCn2cncn2)c2ccc(C)cc2)C1 ZINC000275867102 474345772 /nfs/dbraw/zinc/34/57/72/474345772.db2.gz NVENOWYERSREEA-MJGOQNOKSA-N 1 3 327.476 2.649 10 0 EFAEHO CCN1CCC[C@H]1CN(C)C(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000176020438 474364379 /nfs/dbraw/zinc/36/43/79/474364379.db2.gz OMEDXIUYUMVEOA-SFHVURJKSA-N 1 3 336.524 2.519 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN[C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000248609031 474376166 /nfs/dbraw/zinc/37/61/66/474376166.db2.gz XEGWWVLMMLZQGB-CMKODMSKSA-N 1 3 346.515 2.977 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000248609031 474376176 /nfs/dbraw/zinc/37/61/76/474376176.db2.gz XEGWWVLMMLZQGB-CMKODMSKSA-N 1 3 346.515 2.977 10 0 EFAEHO Cc1ccc(OC[C@H](O)C[NH2+][C@@H](C)[C@H]2CCCN(C3CCC3)C2)cc1 ZINC000248609031 474376182 /nfs/dbraw/zinc/37/61/82/474376182.db2.gz XEGWWVLMMLZQGB-CMKODMSKSA-N 1 3 346.515 2.977 10 0 EFAEHO C[C@@H](C(=O)N1CCC(C[NH+]2CCCC2)CC1)[C@@H](N)c1ccccc1 ZINC000237586900 474434803 /nfs/dbraw/zinc/43/48/03/474434803.db2.gz IEFCODUVRIFGCB-VQIMIIECSA-N 1 3 329.488 2.657 10 0 EFAEHO C[C@H]1CN([C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)c2cccs2)CCO1 ZINC000248827436 474448244 /nfs/dbraw/zinc/44/82/44/474448244.db2.gz GPVVPLFGEROVTQ-VGUREELVSA-N 1 3 349.544 2.725 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)CC[N@@H+]1C ZINC000631475869 480110788 /nfs/dbraw/zinc/11/07/88/480110788.db2.gz MPCQHKDRDSQMJY-KYHPRHEASA-N 1 3 349.544 2.978 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)CC[N@H+]1C ZINC000631475869 480110792 /nfs/dbraw/zinc/11/07/92/480110792.db2.gz MPCQHKDRDSQMJY-KYHPRHEASA-N 1 3 349.544 2.978 10 0 EFAEHO CN(c1ccccc1C[NH2+][C@H]1CCC[C@H]1CCO)C1CCN(C)CC1 ZINC000249432200 474572542 /nfs/dbraw/zinc/57/25/42/474572542.db2.gz HLYQEMOGZMLQNU-PXNSSMCTSA-N 1 3 345.531 2.858 10 0 EFAEHO C[N@H+](CC[C@@H]1CCCO1)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000249502441 474580413 /nfs/dbraw/zinc/58/04/13/474580413.db2.gz XPPXYSVKBJGLKH-LEWJYISDSA-N 1 3 346.515 2.933 10 0 EFAEHO C[N@@H+](CC[C@@H]1CCCO1)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000249502441 474580416 /nfs/dbraw/zinc/58/04/16/474580416.db2.gz XPPXYSVKBJGLKH-LEWJYISDSA-N 1 3 346.515 2.933 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000249514923 474584166 /nfs/dbraw/zinc/58/41/66/474584166.db2.gz BKEGQWQDPVUUNW-QZTJIDSGSA-N 1 3 340.556 2.774 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NCCCC[N@H+]1CCC[C@@H](C)C1 ZINC000249514923 474584172 /nfs/dbraw/zinc/58/41/72/474584172.db2.gz BKEGQWQDPVUUNW-QZTJIDSGSA-N 1 3 340.556 2.774 10 0 EFAEHO C[C@H](NC(=O)CC1CCN(C)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000291623205 474634634 /nfs/dbraw/zinc/63/46/34/474634634.db2.gz HBUSCFQYXBFKAD-PXNSSMCTSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@H](NC(=O)CC1CCN(C)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000291623205 474634639 /nfs/dbraw/zinc/63/46/39/474634639.db2.gz HBUSCFQYXBFKAD-PXNSSMCTSA-N 1 3 343.515 2.745 10 0 EFAEHO CN1CCC(CC(=O)NC[C@H](C2CC2)[N@H+](C)Cc2ccccc2)CC1 ZINC000291633661 474637703 /nfs/dbraw/zinc/63/77/03/474637703.db2.gz IBRFRDYLOVHLEO-HXUWFJFHSA-N 1 3 343.515 2.745 10 0 EFAEHO CN1CCC(CC(=O)NC[C@H](C2CC2)[N@@H+](C)Cc2ccccc2)CC1 ZINC000291633661 474637709 /nfs/dbraw/zinc/63/77/09/474637709.db2.gz IBRFRDYLOVHLEO-HXUWFJFHSA-N 1 3 343.515 2.745 10 0 EFAEHO O=C(NCC1CC[NH+](C2CC2)CC1)c1cccc(CN2CCCC2)c1 ZINC000278519673 474677112 /nfs/dbraw/zinc/67/71/12/474677112.db2.gz KYOVWWYBOUPPBH-UHFFFAOYSA-N 1 3 341.499 2.887 10 0 EFAEHO CN1CCC(Oc2ccc(N[C@H]3CC[N@@H+]4CCC[C@H]4C3)cn2)CC1 ZINC000253370929 474730793 /nfs/dbraw/zinc/73/07/93/474730793.db2.gz YHKHCHOJABMSLR-RDJZCZTQSA-N 1 3 330.476 2.593 10 0 EFAEHO CN1CCC(Oc2ccc(N[C@H]3CC[N@H+]4CCC[C@H]4C3)cn2)CC1 ZINC000253370929 474730802 /nfs/dbraw/zinc/73/08/02/474730802.db2.gz YHKHCHOJABMSLR-RDJZCZTQSA-N 1 3 330.476 2.593 10 0 EFAEHO Cc1ccc(NC(=O)CC2CC[NH+](C)CC2)c(OCCN(C)C)c1 ZINC000273233165 474793191 /nfs/dbraw/zinc/79/31/91/474793191.db2.gz OZFCFKLDHWDYFO-UHFFFAOYSA-N 1 3 333.476 2.606 10 0 EFAEHO COCCN1CC[C@@H](Nc2ccc(OCC[N@@H+]3CC[C@H](C)C3)cc2)C1 ZINC000273248440 474800658 /nfs/dbraw/zinc/80/06/58/474800658.db2.gz ZZLUSUQZYDFDAA-PKOBYXMFSA-N 1 3 347.503 2.540 10 0 EFAEHO COCCN1CC[C@@H](Nc2ccc(OCC[N@H+]3CC[C@H](C)C3)cc2)C1 ZINC000273248440 474800668 /nfs/dbraw/zinc/80/06/68/474800668.db2.gz ZZLUSUQZYDFDAA-PKOBYXMFSA-N 1 3 347.503 2.540 10 0 EFAEHO CC[NH+](CC)CCN(Cc1ccccc1)C(=O)N[C@H]1CCCN(C)C1 ZINC000620548341 480133231 /nfs/dbraw/zinc/13/32/31/480133231.db2.gz UBSWZKPRVWPQQI-IBGZPJMESA-N 1 3 346.519 2.634 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC[C@@H](c2cccs2)N2CCCC2)CC1 ZINC000273310438 474835889 /nfs/dbraw/zinc/83/58/89/474835889.db2.gz WLDHCMIVSKRUPA-INIZCTEOSA-N 1 3 335.517 2.733 10 0 EFAEHO CC[NH+](CC)CCC[C@H](C)NCc1c(Br)cnn1C ZINC000311785573 474843435 /nfs/dbraw/zinc/84/34/35/474843435.db2.gz JMWWBMDCHPEFTC-LBPRGKRZSA-N 1 3 331.302 2.783 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000337313333 474886633 /nfs/dbraw/zinc/88/66/33/474886633.db2.gz ABVJBQNAAJXKSG-MJGOQNOKSA-N 1 3 346.519 2.681 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@@]2(CO)C[C@H](C)CC(C)(C)C2)CC1 ZINC000337329248 474901896 /nfs/dbraw/zinc/90/18/96/474901896.db2.gz ZKYRPYUVKOKUFG-QUCCMNQESA-N 1 3 339.568 2.569 10 0 EFAEHO CC[NH+]1CCC(NC(=O)CN[C@@H](c2cccc(C)c2)C(C)C)CC1 ZINC000625984217 480134362 /nfs/dbraw/zinc/13/43/62/480134362.db2.gz OKPQAUYJJXQQNB-HXUWFJFHSA-N 1 3 331.504 2.882 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)NCc1cccc(CN(C)C)c1 ZINC000341086996 474957938 /nfs/dbraw/zinc/95/79/38/474957938.db2.gz GAJVINWJKZOMEL-IAGOWNOFSA-N 1 3 346.519 2.810 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)c1cc[nH]c1C1CCC1 ZINC000345206240 474989121 /nfs/dbraw/zinc/98/91/21/474989121.db2.gz VCNKNWYGIRGXKF-QGZVFWFLSA-N 1 3 346.519 2.770 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)c1cc[nH]c1C1CCC1 ZINC000345206240 474989132 /nfs/dbraw/zinc/98/91/32/474989132.db2.gz VCNKNWYGIRGXKF-QGZVFWFLSA-N 1 3 346.519 2.770 10 0 EFAEHO COc1ccc(OCCN2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)cc1 ZINC000261618062 474997614 /nfs/dbraw/zinc/99/76/14/474997614.db2.gz CPALFDLWWDFDKQ-XLIONFOSSA-N 1 3 326.440 2.748 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)C2(N)CCOCC2)cc1 ZINC000261777634 475059188 /nfs/dbraw/zinc/05/91/88/475059188.db2.gz HCCXREZDSCVASF-OAHLLOKOSA-N 1 3 331.460 2.507 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)C2(N)CCOCC2)cc1 ZINC000261777634 475059193 /nfs/dbraw/zinc/05/91/93/475059193.db2.gz HCCXREZDSCVASF-OAHLLOKOSA-N 1 3 331.460 2.507 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)C2(N)CCOCC2)cc1 ZINC000261777630 475059542 /nfs/dbraw/zinc/05/95/42/475059542.db2.gz HCCXREZDSCVASF-HNNXBMFYSA-N 1 3 331.460 2.507 10 0 EFAEHO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)C2(N)CCOCC2)cc1 ZINC000261777630 475059551 /nfs/dbraw/zinc/05/95/51/475059551.db2.gz HCCXREZDSCVASF-HNNXBMFYSA-N 1 3 331.460 2.507 10 0 EFAEHO O=C(CC[C@@H]1CC[NH2+]C1)NCc1ccccc1CN1CCCCC1 ZINC000261794543 475065397 /nfs/dbraw/zinc/06/53/97/475065397.db2.gz DCCPVAYNBOAHNZ-QGZVFWFLSA-N 1 3 329.488 2.678 10 0 EFAEHO CC1(C)CN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC[C@@H]1[NH3+] ZINC000261816641 475073087 /nfs/dbraw/zinc/07/30/87/475073087.db2.gz HQQOCAZGWPSDAD-WMZOPIPTSA-N 1 3 347.478 2.624 10 0 EFAEHO [NH3+]C[C@@H]1CN(CCOCCOc2ccccc2)C[C@H]1c1ccccc1 ZINC000261886393 475099413 /nfs/dbraw/zinc/09/94/13/475099413.db2.gz ZBHLLFMJWCUAKL-CTNGQTDRSA-N 1 3 340.467 2.756 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)N1CCC(CC[NH+](C)C)CC1 ZINC000341561492 475145211 /nfs/dbraw/zinc/14/52/11/475145211.db2.gz SXFVBRICFBUZAT-CALCHBBNSA-N 1 3 338.540 2.623 10 0 EFAEHO CN(c1ccccc1CN1CCOCC2(CC2)C1)C1CC[NH+](C)CC1 ZINC000341562906 475146180 /nfs/dbraw/zinc/14/61/80/475146180.db2.gz KTVWXRSFAYENGN-UHFFFAOYSA-N 1 3 343.515 2.829 10 0 EFAEHO CCC[NH+]1CCC(N(C)C(=O)NCCN2[C@H](C)CCC[C@@H]2C)CC1 ZINC000341562571 475146593 /nfs/dbraw/zinc/14/65/93/475146593.db2.gz UTOAEAVGGMQALT-CALCHBBNSA-N 1 3 338.540 2.765 10 0 EFAEHO CCC[NH+]1CCC(N(C)C(=O)NCCN2[C@@H](C)CCC[C@@H]2C)CC1 ZINC000341562575 475147473 /nfs/dbraw/zinc/14/74/73/475147473.db2.gz UTOAEAVGGMQALT-IRXDYDNUSA-N 1 3 338.540 2.765 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)Nc1c(C)ccnc1C ZINC000287453681 475152962 /nfs/dbraw/zinc/15/29/62/475152962.db2.gz IHPJITADMFPYSV-KRWDZBQOSA-N 1 3 347.507 2.578 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)Nc1c(C)ccnc1C ZINC000287453681 475152970 /nfs/dbraw/zinc/15/29/70/475152970.db2.gz IHPJITADMFPYSV-KRWDZBQOSA-N 1 3 347.507 2.578 10 0 EFAEHO Cc1ccc(OC(F)F)c(CN[C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)c1 ZINC000262042384 475155459 /nfs/dbraw/zinc/15/54/59/475155459.db2.gz YSGSQPRKHCOZOQ-OAGGEKHMSA-N 1 3 340.414 2.843 10 0 EFAEHO FC(F)COCCN(Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000262148666 475185408 /nfs/dbraw/zinc/18/54/08/475185408.db2.gz QSLWDDLVRCVQTG-AWEZNQCLSA-N 1 3 330.444 2.974 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)[C@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000262295227 475215500 /nfs/dbraw/zinc/21/55/00/475215500.db2.gz OQHLTSXNKWIMHX-NJAFHUGGSA-N 1 3 329.488 2.846 10 0 EFAEHO c1nnn(Cc2ccccc2)c1CNCCCCC[NH+]1CCCC1 ZINC000339498953 475257594 /nfs/dbraw/zinc/25/75/94/475257594.db2.gz WXKMTDGARLNBFD-UHFFFAOYSA-N 1 3 327.476 2.682 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2CCO[C@@H](C)C2)CC1 ZINC000354686686 475338791 /nfs/dbraw/zinc/33/87/91/475338791.db2.gz DHFTZTZFGDDAKA-HKUYNNGSSA-N 1 3 331.504 2.876 10 0 EFAEHO CC[C@H](NC1CC[NH+](CCC(=O)N(C)C)CC1)c1cccc(OC)c1 ZINC000361354907 475381198 /nfs/dbraw/zinc/38/11/98/475381198.db2.gz YPWQMLXRUBAEOW-IBGZPJMESA-N 1 3 347.503 2.679 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000352596504 475446366 /nfs/dbraw/zinc/44/63/66/475446366.db2.gz BGTFZVHRVZXJMC-DFQSSKMNSA-N 1 3 343.515 2.888 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000352596504 475446371 /nfs/dbraw/zinc/44/63/71/475446371.db2.gz BGTFZVHRVZXJMC-DFQSSKMNSA-N 1 3 343.515 2.888 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)NCCN2CC=C(C)CC2)[NH+](C)C)cc1 ZINC000358193298 475477777 /nfs/dbraw/zinc/47/77/77/475477777.db2.gz QNESYFIJWALSKF-IBGZPJMESA-N 1 3 344.503 2.549 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@@H](CO)c2cccnc2)CC[N@@H+]1Cc1ccccc1 ZINC000348199787 475482318 /nfs/dbraw/zinc/48/23/18/475482318.db2.gz QLCIBXNPVJDEJU-JRGCBEDISA-N 1 3 339.483 2.800 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@@H](CO)c2cccnc2)CC[N@H+]1Cc1ccccc1 ZINC000348199787 475482323 /nfs/dbraw/zinc/48/23/23/475482323.db2.gz QLCIBXNPVJDEJU-JRGCBEDISA-N 1 3 339.483 2.800 10 0 EFAEHO C[C@H]([NH2+]C[C@@H](CO)c1cccnc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000348202915 475483250 /nfs/dbraw/zinc/48/32/50/475483250.db2.gz BGLJJZNOXAICIX-YYWHXJBOSA-N 1 3 339.483 2.658 10 0 EFAEHO C[C@H](NC[C@@H](CO)c1cccnc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000348202915 475483256 /nfs/dbraw/zinc/48/32/56/475483256.db2.gz BGLJJZNOXAICIX-YYWHXJBOSA-N 1 3 339.483 2.658 10 0 EFAEHO C[C@H](NC[C@@H](CO)c1cccnc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000348202915 475483262 /nfs/dbraw/zinc/48/32/62/475483262.db2.gz BGLJJZNOXAICIX-YYWHXJBOSA-N 1 3 339.483 2.658 10 0 EFAEHO c1cc(N2CCN(CCC[NH2+][C@@H]3CC[C@H]3C3CCC3)CC2)ccn1 ZINC000338004977 475500552 /nfs/dbraw/zinc/50/05/52/475500552.db2.gz YZZWFYMGIHHZPB-VQTJNVASSA-N 1 3 328.504 2.762 10 0 EFAEHO CC1=CCN(CC[NH2+][C@H](C)c2cccc(OCCN(C)C)c2)CC1 ZINC000358230897 475512709 /nfs/dbraw/zinc/51/27/09/475512709.db2.gz SLINAYSAMBJONQ-GOSISDBHSA-N 1 3 331.504 2.930 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000354923355 475523586 /nfs/dbraw/zinc/52/35/86/475523586.db2.gz QYCDXWAPKIQBKY-UMGGQSCQSA-N 1 3 343.515 2.744 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000354923355 475523591 /nfs/dbraw/zinc/52/35/91/475523591.db2.gz QYCDXWAPKIQBKY-UMGGQSCQSA-N 1 3 343.515 2.744 10 0 EFAEHO CN(C)CCOc1ccccc1CNC(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000352682835 475526476 /nfs/dbraw/zinc/52/64/76/475526476.db2.gz HSNXTFLCWUVIJK-GOSISDBHSA-N 1 3 347.503 2.508 10 0 EFAEHO CN(C)CCOc1ccccc1CNC(=O)CC[C@H]1CCCC[N@H+]1C ZINC000352682835 475526481 /nfs/dbraw/zinc/52/64/81/475526481.db2.gz HSNXTFLCWUVIJK-GOSISDBHSA-N 1 3 347.503 2.508 10 0 EFAEHO COc1cc([C@H](C)[NH2+]C2CCN([C@@H]3CCC[C@@H]3O)CC2)ccc1F ZINC000358301345 475572855 /nfs/dbraw/zinc/57/28/55/475572855.db2.gz PGQSLUMAQRDWEG-VHSSKADRSA-N 1 3 336.451 2.863 10 0 EFAEHO CCCN1CCC[C@@H]1CNC(=O)N1CCC(C[NH+](CC)CC)CC1 ZINC000358304590 475574579 /nfs/dbraw/zinc/57/45/79/475574579.db2.gz CXGXDJRKYLHZIN-GOSISDBHSA-N 1 3 338.540 2.624 10 0 EFAEHO CC[N@H+](CCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)C(C)C ZINC000354979203 475575769 /nfs/dbraw/zinc/57/57/69/475575769.db2.gz KIYHVPLXSZDJQH-IBGZPJMESA-N 1 3 346.519 2.633 10 0 EFAEHO CC[N@@H+](CCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)C(C)C ZINC000354979203 475575774 /nfs/dbraw/zinc/57/57/74/475575774.db2.gz KIYHVPLXSZDJQH-IBGZPJMESA-N 1 3 346.519 2.633 10 0 EFAEHO CCN(Cc1ccc(C[N@H+](CC)[C@H]2CCOC2)cc1)[C@@H]1CCOC1 ZINC000361591519 475577932 /nfs/dbraw/zinc/57/79/32/475577932.db2.gz NVVDDTTZMAEPJE-BGYRXZFFSA-N 1 3 332.488 2.908 10 0 EFAEHO CCN(Cc1ccc(C[N@@H+](CC)[C@H]2CCOC2)cc1)[C@@H]1CCOC1 ZINC000361591519 475577939 /nfs/dbraw/zinc/57/79/39/475577939.db2.gz NVVDDTTZMAEPJE-BGYRXZFFSA-N 1 3 332.488 2.908 10 0 EFAEHO CCN(Cc1ccc(C[N@H+](CC)[C@@H]2CCOC2)cc1)[C@H]1CCOC1 ZINC000361591519 475577945 /nfs/dbraw/zinc/57/79/45/475577945.db2.gz NVVDDTTZMAEPJE-BGYRXZFFSA-N 1 3 332.488 2.908 10 0 EFAEHO CCN(Cc1ccc(C[N@@H+](CC)[C@@H]2CCOC2)cc1)[C@H]1CCOC1 ZINC000361591519 475577949 /nfs/dbraw/zinc/57/79/49/475577949.db2.gz NVVDDTTZMAEPJE-BGYRXZFFSA-N 1 3 332.488 2.908 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2ccc(CO)c(F)c2)[C@@H](C)C1 ZINC000358368108 475624569 /nfs/dbraw/zinc/62/45/69/475624569.db2.gz NDVLMFJXLNNGOA-KXBFYZLASA-N 1 3 338.467 2.545 10 0 EFAEHO C[C@@H](CNC(=O)NCC[N@@H+]1CCCC[C@@H]1C)N(C)Cc1ccccc1 ZINC000348377664 475630024 /nfs/dbraw/zinc/63/00/24/475630024.db2.gz FIIWCOIXTGQACK-ROUUACIJSA-N 1 3 346.519 2.681 10 0 EFAEHO C[C@@H](CNC(=O)NCC[N@H+]1CCCC[C@@H]1C)N(C)Cc1ccccc1 ZINC000348377664 475630027 /nfs/dbraw/zinc/63/00/27/475630027.db2.gz FIIWCOIXTGQACK-ROUUACIJSA-N 1 3 346.519 2.681 10 0 EFAEHO CN(C)CCNC(=O)c1ccc(C[NH2+][C@@H]2CC[C@H]2C(C)(C)C)cc1 ZINC000348396027 475638687 /nfs/dbraw/zinc/63/86/87/475638687.db2.gz MGQFDEYOOKXVNG-QZTJIDSGSA-N 1 3 331.504 2.892 10 0 EFAEHO CC[C@H](C)[NH2+][C@@H](CNC(=O)NCCN1CC=C(C)CC1)c1ccco1 ZINC000355104473 475669616 /nfs/dbraw/zinc/66/96/16/475669616.db2.gz XVHZYQZFWQYUJL-IRXDYDNUSA-N 1 3 348.491 2.660 10 0 EFAEHO C[C@@H]1[C@H]([NH+]2CCCC2)CCN1C(=O)NCCN1[C@H](C)CCC[C@H]1C ZINC000352997128 475678754 /nfs/dbraw/zinc/67/87/54/475678754.db2.gz KLWBGTIMPBXUER-BRSBDYLESA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@H](CN(C)C)NC(=O)N1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000358488808 475718529 /nfs/dbraw/zinc/71/85/29/475718529.db2.gz AVMRXSJPIVKMTN-IAGOWNOFSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@H](CN(C)C)NC(=O)N1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000358488808 475718535 /nfs/dbraw/zinc/71/85/35/475718535.db2.gz AVMRXSJPIVKMTN-IAGOWNOFSA-N 1 3 338.540 2.623 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)NCC[N@H+]2CCCC[C@@H]2C)N(C)C)cc1 ZINC000338295722 475757871 /nfs/dbraw/zinc/75/78/71/475757871.db2.gz KBAZVLBUALTOMX-PKOBYXMFSA-N 1 3 346.519 2.771 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)NCC[N@@H+]2CCCC[C@@H]2C)N(C)C)cc1 ZINC000338295722 475757879 /nfs/dbraw/zinc/75/78/79/475757879.db2.gz KBAZVLBUALTOMX-PKOBYXMFSA-N 1 3 346.519 2.771 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)NCC[N@H+]2CCCC[C@@H]2C)N(C)C)cc1 ZINC000338295719 475759008 /nfs/dbraw/zinc/75/90/08/475759008.db2.gz KBAZVLBUALTOMX-HKUYNNGSSA-N 1 3 346.519 2.771 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)NCC[N@@H+]2CCCC[C@@H]2C)N(C)C)cc1 ZINC000338295719 475759011 /nfs/dbraw/zinc/75/90/11/475759011.db2.gz KBAZVLBUALTOMX-HKUYNNGSSA-N 1 3 346.519 2.771 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NC[C@@H](C)N2CCCC[C@H]2C)CC1 ZINC000338301834 475761659 /nfs/dbraw/zinc/76/16/59/475761659.db2.gz IIURRZSIHJMZRR-IAGOWNOFSA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCCN1CCCC[C@@H]1C ZINC000338300244 475762378 /nfs/dbraw/zinc/76/23/78/475762378.db2.gz ZCEXDMUWNNUVCN-XDNAFOTISA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCCN1CCCC[C@@H]1C ZINC000338300244 475762382 /nfs/dbraw/zinc/76/23/82/475762382.db2.gz ZCEXDMUWNNUVCN-XDNAFOTISA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)c1ccc([C@@H](N)CNC(=O)[C@@H](C[NH3+])c2ccc(F)cc2)cc1 ZINC000358742217 475898855 /nfs/dbraw/zinc/89/88/55/475898855.db2.gz IZGAQXCAODJDHI-OALUTQOASA-N 1 3 343.446 2.808 10 0 EFAEHO Cn1cncc1CCN1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000297892609 475917376 /nfs/dbraw/zinc/91/73/76/475917376.db2.gz RAJNRKYUSDBROX-PZJWPPBQSA-N 1 3 338.499 2.949 10 0 EFAEHO Cn1cncc1CCN1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000297892609 475917384 /nfs/dbraw/zinc/91/73/84/475917384.db2.gz RAJNRKYUSDBROX-PZJWPPBQSA-N 1 3 338.499 2.949 10 0 EFAEHO Cn1cncc1CC[N@@H+]1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1 ZINC000297892609 475917388 /nfs/dbraw/zinc/91/73/88/475917388.db2.gz RAJNRKYUSDBROX-PZJWPPBQSA-N 1 3 338.499 2.949 10 0 EFAEHO Cn1cncc1CC[N@H+]1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1 ZINC000297892609 475917395 /nfs/dbraw/zinc/91/73/95/475917395.db2.gz RAJNRKYUSDBROX-PZJWPPBQSA-N 1 3 338.499 2.949 10 0 EFAEHO CN1CC[C@H]([NH2+]CC2CCN(c3ccncc3)CC2)[C@H]2CCC[C@H]21 ZINC000353397117 475934333 /nfs/dbraw/zinc/93/43/33/475934333.db2.gz WBKIGNGBOANFOO-HSALFYBXSA-N 1 3 328.504 2.760 10 0 EFAEHO COc1ccccc1N1CC[C@H](N[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)C1 ZINC000353400605 475939460 /nfs/dbraw/zinc/93/94/60/475939460.db2.gz FZBIIIHBTOPNHM-WNRNVDISSA-N 1 3 329.488 2.736 10 0 EFAEHO COc1ccccc1N1CC[C@H](N[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@H]32)C1 ZINC000353400605 475939470 /nfs/dbraw/zinc/93/94/70/475939470.db2.gz FZBIIIHBTOPNHM-WNRNVDISSA-N 1 3 329.488 2.736 10 0 EFAEHO CN1CC[C@H]([NH2+]CCCN2CCc3ccccc3C2)[C@@H]2CCC[C@H]21 ZINC000353444891 475972702 /nfs/dbraw/zinc/97/27/02/475972702.db2.gz GTMZUYHRWAFTGA-PCCBWWKXSA-N 1 3 327.516 2.897 10 0 EFAEHO CN(Cc1ccccc1)CC(C)(C)NC(=O)CC1CC[NH+](C)CC1 ZINC000346955854 475988341 /nfs/dbraw/zinc/98/83/41/475988341.db2.gz PESOONSUQCEYEI-UHFFFAOYSA-N 1 3 331.504 2.745 10 0 EFAEHO C[C@H]([NH2+]C(C)(C)CNC(=O)CC1CCN(C)CC1)c1ccccc1 ZINC000346959344 475990503 /nfs/dbraw/zinc/99/05/03/475990503.db2.gz DRXWOFYCOUYUHZ-INIZCTEOSA-N 1 3 331.504 2.964 10 0 EFAEHO COc1cccc([C@H](CN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)N(C)C)c1 ZINC000353465949 475992708 /nfs/dbraw/zinc/99/27/08/475992708.db2.gz WISVWGGTCOFGMB-WTGUMLROSA-N 1 3 331.504 2.760 10 0 EFAEHO COc1cccc([C@H](CN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@@H]32)N(C)C)c1 ZINC000353465949 475992717 /nfs/dbraw/zinc/99/27/17/475992717.db2.gz WISVWGGTCOFGMB-WTGUMLROSA-N 1 3 331.504 2.760 10 0 EFAEHO COc1cccc([C@H](C[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@@H]32)N(C)C)c1 ZINC000353465949 475992722 /nfs/dbraw/zinc/99/27/22/475992722.db2.gz WISVWGGTCOFGMB-WTGUMLROSA-N 1 3 331.504 2.760 10 0 EFAEHO COc1cccc([C@H](CN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)N(C)C)c1 ZINC000353465948 475993484 /nfs/dbraw/zinc/99/34/84/475993484.db2.gz WISVWGGTCOFGMB-NMLBUPMWSA-N 1 3 331.504 2.760 10 0 EFAEHO COc1cccc([C@H](CN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@H]32)N(C)C)c1 ZINC000353465948 475993492 /nfs/dbraw/zinc/99/34/92/475993492.db2.gz WISVWGGTCOFGMB-NMLBUPMWSA-N 1 3 331.504 2.760 10 0 EFAEHO COc1cccc([C@H](C[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@H]32)N(C)C)c1 ZINC000353465948 475993494 /nfs/dbraw/zinc/99/34/94/475993494.db2.gz WISVWGGTCOFGMB-NMLBUPMWSA-N 1 3 331.504 2.760 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21)N1CCc2ccccc2C1 ZINC000353502466 476025160 /nfs/dbraw/zinc/02/51/60/476025160.db2.gz LMPUMBLTDFEVBK-OTNPHJDUSA-N 1 3 327.516 2.896 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@@H+](C)[C@H]2CCC[C@@H]21)N1CCc2ccccc2C1 ZINC000353502466 476025167 /nfs/dbraw/zinc/02/51/67/476025167.db2.gz LMPUMBLTDFEVBK-OTNPHJDUSA-N 1 3 327.516 2.896 10 0 EFAEHO CN(C(=O)C1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCN(C2CC2)C1 ZINC000347020216 476040645 /nfs/dbraw/zinc/04/06/45/476040645.db2.gz SVIPZZIWEWGRAY-HXUWFJFHSA-N 1 3 341.499 2.594 10 0 EFAEHO CN(C)C1(C[NH2+][C@H]2CCN(C)[C@H]3CCC[C@@H]32)Cc2ccccc2C1 ZINC000353520654 476043384 /nfs/dbraw/zinc/04/33/84/476043384.db2.gz OJWAZFZXWOEXML-AABGKKOBSA-N 1 3 327.516 2.548 10 0 EFAEHO COCC[C@@H](C)[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340465925 476052985 /nfs/dbraw/zinc/05/29/85/476052985.db2.gz JUZFCTXJAGDXMK-UYAOXDASSA-N 1 3 346.515 2.930 10 0 EFAEHO CC[C@H](COC)[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340468737 476053984 /nfs/dbraw/zinc/05/39/84/476053984.db2.gz SUKRXYWEWPYMKJ-VQTJNVASSA-N 1 3 346.515 2.930 10 0 EFAEHO CO[C@H](C)[C@@H](C)[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340469972 476054901 /nfs/dbraw/zinc/05/49/01/476054901.db2.gz YBILXYXFDJJVEW-GGPKGHCWSA-N 1 3 346.515 2.928 10 0 EFAEHO CC[NH+](CC)CC1CCN(Cc2cc3c(c(OC)c2)OCO3)CC1 ZINC000350184090 476084910 /nfs/dbraw/zinc/08/49/10/476084910.db2.gz LSVUJHBFZYDGMF-UHFFFAOYSA-N 1 3 334.460 2.978 10 0 EFAEHO CC[C@@H](Cn1cncn1)[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000353576201 476093636 /nfs/dbraw/zinc/09/36/36/476093636.db2.gz MXWOPFXRQVWRKJ-PMACEKPBSA-N 1 3 341.503 2.949 10 0 EFAEHO CC[C@@H](Cn1cncn1)NC[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000353576201 476093643 /nfs/dbraw/zinc/09/36/43/476093643.db2.gz MXWOPFXRQVWRKJ-PMACEKPBSA-N 1 3 341.503 2.949 10 0 EFAEHO CC[C@@H](Cn1cncn1)NC[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000353576201 476093652 /nfs/dbraw/zinc/09/36/52/476093652.db2.gz MXWOPFXRQVWRKJ-PMACEKPBSA-N 1 3 341.503 2.949 10 0 EFAEHO CC(C)C[C@H]([NH2+][C@H](C)[C@@H]1C[C@H]1c1ccccc1)C(=O)NCCN(C)C ZINC000338796651 476193224 /nfs/dbraw/zinc/19/32/24/476193224.db2.gz WPJQMQZVVRDHGW-GTAWCEEGSA-N 1 3 345.531 2.861 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccc3ccccc3n2)CC[C@@H]1N1CCN(C)CC1 ZINC000362704962 476358143 /nfs/dbraw/zinc/35/81/43/476358143.db2.gz WDOYILMGFMABJJ-UWJYYQICSA-N 1 3 338.499 2.693 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccc3ccccc3n2)CC[C@@H]1N1CCN(C)CC1 ZINC000362704962 476358149 /nfs/dbraw/zinc/35/81/49/476358149.db2.gz WDOYILMGFMABJJ-UWJYYQICSA-N 1 3 338.499 2.693 10 0 EFAEHO Cc1cccc(CN2CCCC[C@@H]2C(=O)N2CCC([NH+](C)C)CC2)c1 ZINC000363514994 476418346 /nfs/dbraw/zinc/41/83/46/476418346.db2.gz AODPGPHVLWXVKP-HXUWFJFHSA-N 1 3 343.515 2.902 10 0 EFAEHO Cn1c2ccc(C[N@@H+](C)C3C[C@H]4CC[C@@H](C3)N4C)cc2sc1=O ZINC000377630219 476486984 /nfs/dbraw/zinc/48/69/84/476486984.db2.gz QBXAFRATTLSVET-YIONKMFJSA-N 1 3 331.485 2.657 10 0 EFAEHO Cn1c2ccc(C[N@H+](C)C3C[C@H]4CC[C@@H](C3)N4C)cc2sc1=O ZINC000377630219 476486989 /nfs/dbraw/zinc/48/69/89/476486989.db2.gz QBXAFRATTLSVET-YIONKMFJSA-N 1 3 331.485 2.657 10 0 EFAEHO CC[NH+](CC)CCC[C@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000377747767 476559414 /nfs/dbraw/zinc/55/94/14/476559414.db2.gz HCWVMRKCWZOEAI-MAUKXSAKSA-N 1 3 329.504 2.826 10 0 EFAEHO C[C@@H]1CCOCCN1Cc1ccccc1C[N@@H+]1CCOCC[C@@H]1C ZINC000374986553 476622815 /nfs/dbraw/zinc/62/28/15/476622815.db2.gz JLALQLXYYILGCH-HDICACEKSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@@H]1CCOCCN1Cc1ccccc1C[N@H+]1CCOCC[C@@H]1C ZINC000374986553 476622820 /nfs/dbraw/zinc/62/28/20/476622820.db2.gz JLALQLXYYILGCH-HDICACEKSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@@H]1CCOCC[N@H+]1Cc1ccccc1CN1CCOCC[C@@H]1C ZINC000374986553 476622824 /nfs/dbraw/zinc/62/28/24/476622824.db2.gz JLALQLXYYILGCH-HDICACEKSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@@H]1CCOCC[N@@H+]1Cc1ccccc1CN1CCOCC[C@@H]1C ZINC000374986553 476622829 /nfs/dbraw/zinc/62/28/29/476622829.db2.gz JLALQLXYYILGCH-HDICACEKSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@@H](CC[NH+](C)C)NC(=O)N1CCN(Cc2ccccc2)CC[C@@H]1C ZINC000370004568 476626767 /nfs/dbraw/zinc/62/67/67/476626767.db2.gz CLCHRAKZYVJECF-ROUUACIJSA-N 1 3 346.519 2.633 10 0 EFAEHO Cc1ccc(CCC[NH2+]CC2(N3CCCCC3)CCN(C)CC2)cn1 ZINC000354432539 476658401 /nfs/dbraw/zinc/65/84/01/476658401.db2.gz YZLXLFGVVCVCIQ-UHFFFAOYSA-N 1 3 344.547 2.863 10 0 EFAEHO C[C@H](CCN1CCC[C@]2(CCOC2)C1)[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000451904855 476713648 /nfs/dbraw/zinc/71/36/48/476713648.db2.gz RGJYXYLMMGLRFP-AABGKKOBSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CCN1CCC[C@]2(CCOC2)C1)[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000451904855 476713654 /nfs/dbraw/zinc/71/36/54/476713654.db2.gz RGJYXYLMMGLRFP-AABGKKOBSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@@H+]1CCC[C@]2(CCOC2)C1)N1CCC[C@]2(CCOC2)C1 ZINC000451904855 476713659 /nfs/dbraw/zinc/71/36/59/476713659.db2.gz RGJYXYLMMGLRFP-AABGKKOBSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@H+]1CCC[C@]2(CCOC2)C1)N1CCC[C@]2(CCOC2)C1 ZINC000451904855 476713664 /nfs/dbraw/zinc/71/36/64/476713664.db2.gz RGJYXYLMMGLRFP-AABGKKOBSA-N 1 3 336.520 2.770 10 0 EFAEHO [NH3+]C[C@@H]1CCC[C@H]1C(=O)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000379664351 476730117 /nfs/dbraw/zinc/73/01/17/476730117.db2.gz ONKKKKLJYVUOQM-GBESFXJTSA-N 1 3 329.488 2.532 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@@H]2CCC[C@H]2C[NH3+])CCN1Cc1ccccc1 ZINC000379675892 476730726 /nfs/dbraw/zinc/73/07/26/476730726.db2.gz YDIBHCGJARPJCG-QXCFHYIPSA-N 1 3 329.488 2.531 10 0 EFAEHO Cc1nc(C[NH3+])ccc1[C@@H](C)NCc1ccc2c(c1)OCCCO2 ZINC000422699309 476734921 /nfs/dbraw/zinc/73/49/21/476734921.db2.gz CZXAPCZSIXOCFK-CYBMUJFWSA-N 1 3 327.428 2.861 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@@H](Cc1ccccc1)CN(C)C ZINC000422709141 476737651 /nfs/dbraw/zinc/73/76/51/476737651.db2.gz CWOTVVCRQFIEDH-APWZRJJASA-N 1 3 326.488 2.672 10 0 EFAEHO CC(C)COC[C@H](O)C[NH2+][C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12 ZINC000381466725 476737942 /nfs/dbraw/zinc/73/79/42/476737942.db2.gz YNANLZIVEGSPTJ-MXEMCNAFSA-N 1 3 346.515 2.520 10 0 EFAEHO CC(C)COC[C@H](O)CN[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC000381466725 476737947 /nfs/dbraw/zinc/73/79/47/476737947.db2.gz YNANLZIVEGSPTJ-MXEMCNAFSA-N 1 3 346.515 2.520 10 0 EFAEHO CC(C)COC[C@H](O)CN[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC000381466725 476737956 /nfs/dbraw/zinc/73/79/56/476737956.db2.gz YNANLZIVEGSPTJ-MXEMCNAFSA-N 1 3 346.515 2.520 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1ccc(Br)cc1Cl ZINC000422716073 476740430 /nfs/dbraw/zinc/74/04/30/476740430.db2.gz MWLBEQFMMNGZBC-GFCCVEGCSA-N 1 3 335.673 2.946 10 0 EFAEHO C[C@@H](NCc1ccc(OCCC[NH+](C)C)cc1)c1cnccc1N ZINC000422719399 476742193 /nfs/dbraw/zinc/74/21/93/476742193.db2.gz RBMFORSPTOAFJZ-OAHLLOKOSA-N 1 3 328.460 2.675 10 0 EFAEHO C(N[C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)C1(N2CCOCC2)CCCCC1 ZINC000422751107 476759672 /nfs/dbraw/zinc/75/96/72/476759672.db2.gz CEZZRAIMCXZQGF-XUVXKRRUSA-N 1 3 349.563 2.922 10 0 EFAEHO c1ccc2c(c1)C[C@H](CN[C@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)O2 ZINC000422804037 476784657 /nfs/dbraw/zinc/78/46/57/476784657.db2.gz GXWRSEUEJIFMCS-PLMTUMEDSA-N 1 3 336.435 2.836 10 0 EFAEHO CC(C)CN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC[NH+](C)CC1 ZINC000365991989 476801660 /nfs/dbraw/zinc/80/16/60/476801660.db2.gz JNMIVDQJNJZQFU-IBGZPJMESA-N 1 3 341.515 2.778 10 0 EFAEHO C[C@@H]([NH3+])[C@@H](Cc1ccccc1)NCc1ccc(Cn2ccnc2)cc1 ZINC000422836703 476802798 /nfs/dbraw/zinc/80/27/98/476802798.db2.gz RTNOTPAKTHFEIU-DYESRHJHSA-N 1 3 334.467 2.980 10 0 EFAEHO C[C@@H](N)[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(Cn2ccnc2)cc1 ZINC000422836703 476802806 /nfs/dbraw/zinc/80/28/06/476802806.db2.gz RTNOTPAKTHFEIU-DYESRHJHSA-N 1 3 334.467 2.980 10 0 EFAEHO COC[C@@H]1CCCN(CCC[N@@H+]2CCC[C@H](COC)CC2)CC1 ZINC000452076288 476808760 /nfs/dbraw/zinc/80/87/60/476808760.db2.gz BMFFVQLVAMXGHA-KDURUIRLSA-N 1 3 326.525 2.874 10 0 EFAEHO COC[C@@H]1CCCN(CCC[N@H+]2CCC[C@H](COC)CC2)CC1 ZINC000452076288 476808768 /nfs/dbraw/zinc/80/87/68/476808768.db2.gz BMFFVQLVAMXGHA-KDURUIRLSA-N 1 3 326.525 2.874 10 0 EFAEHO COC[C@@H]1CCC[N@@H+](CCCN2CCC[C@H](COC)CC2)CC1 ZINC000452076288 476808773 /nfs/dbraw/zinc/80/87/73/476808773.db2.gz BMFFVQLVAMXGHA-KDURUIRLSA-N 1 3 326.525 2.874 10 0 EFAEHO COC[C@@H]1CCC[N@H+](CCCN2CCC[C@H](COC)CC2)CC1 ZINC000452076288 476808780 /nfs/dbraw/zinc/80/87/80/476808780.db2.gz BMFFVQLVAMXGHA-KDURUIRLSA-N 1 3 326.525 2.874 10 0 EFAEHO COc1ccc([C@@H](NCCN2CCC(C)CC2)[C@@H]2CCC[NH2+]2)cc1 ZINC000422858439 476814023 /nfs/dbraw/zinc/81/40/23/476814023.db2.gz IQQBLGLPPNONRK-VQTJNVASSA-N 1 3 331.504 2.810 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1cccnc1Oc1cccc(F)c1 ZINC000422862942 476816715 /nfs/dbraw/zinc/81/67/15/476816715.db2.gz OFZJHBWZRAELFW-MRXNPFEDSA-N 1 3 333.407 2.857 10 0 EFAEHO C[C@@H](N)C[C@H](C)[NH2+]C1CCN(c2ccc(C(F)(F)F)cn2)CC1 ZINC000422863424 476817266 /nfs/dbraw/zinc/81/72/66/476817266.db2.gz OZKDZMDRRCVRER-NEPJUHHUSA-N 1 3 330.398 2.785 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@@H](CN[C@H](C)[C@H]3CCCC[NH2+]3)C2)c1 ZINC000422874621 476822354 /nfs/dbraw/zinc/82/23/54/476822354.db2.gz NXTUMWHODXEUMK-GQIGUUNPSA-N 1 3 347.503 2.650 10 0 EFAEHO Clc1cccnc1N1CC[C@H](N[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000422877424 476823338 /nfs/dbraw/zinc/82/33/38/476823338.db2.gz RJFOHJMQDBTZLV-NXNVCVFFSA-N 1 3 334.895 2.824 10 0 EFAEHO CCc1cccc(OC[C@@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC000392218662 476824773 /nfs/dbraw/zinc/82/47/73/476824773.db2.gz QPIPMNXVZJWYFM-IPQPSQTFSA-N 1 3 332.488 2.594 10 0 EFAEHO CCc1cccc(OC[C@@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC000392218662 476824780 /nfs/dbraw/zinc/82/47/80/476824780.db2.gz QPIPMNXVZJWYFM-IPQPSQTFSA-N 1 3 332.488 2.594 10 0 EFAEHO COc1ccc(C)cc1C1(C[NH2+][C@@H]2CCC[C@@H]2CN)CCOCC1 ZINC000422897686 476834255 /nfs/dbraw/zinc/83/42/55/476834255.db2.gz KDCVUTXEUSAGIX-SJLPKXTDSA-N 1 3 332.488 2.769 10 0 EFAEHO C(CN[C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)Cc1nnc2n1CCCCC2 ZINC000422915889 476845847 /nfs/dbraw/zinc/84/58/47/476845847.db2.gz BWRHLIMCFUEUSS-FGTMMUONSA-N 1 3 345.535 2.838 10 0 EFAEHO C(C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCCN1)Cc1nnc2n1CCCCC2 ZINC000422915889 476845853 /nfs/dbraw/zinc/84/58/53/476845853.db2.gz BWRHLIMCFUEUSS-FGTMMUONSA-N 1 3 345.535 2.838 10 0 EFAEHO CCOc1ccc([C@H](C)NC(=O)CCCN[C@H]2C[NH2+]CC[C@H]2C)cc1 ZINC000422925668 476848657 /nfs/dbraw/zinc/84/86/57/476848657.db2.gz CAGUBGHYUPORSG-GJYPPUQNSA-N 1 3 347.503 2.630 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@H]1CCc2cn(C(C)C)nc2C1 ZINC000422933832 476851772 /nfs/dbraw/zinc/85/17/72/476851772.db2.gz DXWCNGJWCUIARO-CJNGLKHVSA-N 1 3 327.476 2.834 10 0 EFAEHO CC(=O)Nc1cccc(OCCN[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000422937103 476854420 /nfs/dbraw/zinc/85/44/20/476854420.db2.gz CFTVSNBERNAYQL-HSALFYBXSA-N 1 3 345.487 2.924 10 0 EFAEHO C[C@H](NCC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cn1 ZINC000397608614 476858590 /nfs/dbraw/zinc/85/85/90/476858590.db2.gz YLCFFABDVUGOQD-INIZCTEOSA-N 1 3 343.446 2.898 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C1CCC([NH3+])CC1 ZINC000398068255 476866533 /nfs/dbraw/zinc/86/65/33/476866533.db2.gz OJJNKIDYOZYPDM-RXQRSOPUSA-N 1 3 329.488 2.531 10 0 EFAEHO C[C@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)c1cnccc1N ZINC000422977596 476875388 /nfs/dbraw/zinc/87/53/88/476875388.db2.gz FYIIEKSLULDPME-HNNXBMFYSA-N 1 3 340.471 2.872 10 0 EFAEHO CC(C)[N@@H+]1CC[C@H](N(C)C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000457119312 476886744 /nfs/dbraw/zinc/88/67/44/476886744.db2.gz NKUWANFMMSZMFP-IBGZPJMESA-N 1 3 329.488 2.837 10 0 EFAEHO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000457119312 476886750 /nfs/dbraw/zinc/88/67/50/476886750.db2.gz NKUWANFMMSZMFP-IBGZPJMESA-N 1 3 329.488 2.837 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1cccc(NC(=O)c2ccccc2)c1 ZINC000423005129 476887558 /nfs/dbraw/zinc/88/75/58/476887558.db2.gz QVMHAJOJSYECEL-LJQANCHMSA-N 1 3 341.455 2.782 10 0 EFAEHO C[C@H](C[NH2+][C@@H](C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)CN1CCCC1 ZINC000400578830 476891770 /nfs/dbraw/zinc/89/17/70/476891770.db2.gz QAGTZYVCRMEGOD-IXDOHACOSA-N 1 3 339.524 2.953 10 0 EFAEHO COc1ccc2c(c1)OC[C@H](N[C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)C2 ZINC000423020840 476895257 /nfs/dbraw/zinc/89/52/57/476895257.db2.gz CWUNVYRUVPVYCO-XGXHKWSGSA-N 1 3 330.472 2.899 10 0 EFAEHO COc1cccc([C@H]2[C@H](NC3C[C@H]4CC[C@@H](C3)[NH2+]4)CCN2C2CC2)c1 ZINC000423043205 476902684 /nfs/dbraw/zinc/90/26/84/476902684.db2.gz NVYHFPSEZGHYRL-VLNCIODFSA-N 1 3 341.499 2.846 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@@H](C)c1ccc(Br)cc1OC ZINC000423074520 476916701 /nfs/dbraw/zinc/91/67/01/476916701.db2.gz UXQDQCBHVUNKFP-WCQYABFASA-N 1 3 345.281 2.862 10 0 EFAEHO C[C@H]([NH3+])[C@H](Cc1ccccc1)NC[C@@H](CO)Cc1ccc(F)c(F)c1 ZINC000423079845 476920472 /nfs/dbraw/zinc/92/04/72/476920472.db2.gz RFVAXGXLECVZJQ-VHFSOBRXSA-N 1 3 348.437 2.664 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2CCC[C@@H]2N)ccc1I ZINC000423092333 476925617 /nfs/dbraw/zinc/92/56/17/476925617.db2.gz BJIUSVYJNSRBNT-QWHCGFSZSA-N 1 3 330.213 2.569 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2CNCC[C@H]2C)ccc1I ZINC000423092089 476926413 /nfs/dbraw/zinc/92/64/13/476926413.db2.gz ANSSHJFLMQVCAW-YGRLFVJLSA-N 1 3 344.240 2.687 10 0 EFAEHO CN(C)Cc1cccc(CNC(=O)NC2CC([NH+]3CCCCC3)C2)c1 ZINC000366260168 476929553 /nfs/dbraw/zinc/92/95/53/476929553.db2.gz SQINULKVJIENJP-UHFFFAOYSA-N 1 3 344.503 2.564 10 0 EFAEHO C[C@@H](NCC[C@@H]1CC[NH2+]C1)c1ccccc1I ZINC000423243989 476974153 /nfs/dbraw/zinc/97/41/53/476974153.db2.gz HDIOAMNSTIAQQW-NEPJUHHUSA-N 1 3 344.240 2.941 10 0 EFAEHO COc1cc(OC)c(C[C@H](C)NC2C[C@H]3CC[C@@H](C2)[NH2+]3)c(OC)c1 ZINC000423159134 476949270 /nfs/dbraw/zinc/94/92/70/476949270.db2.gz OVWYOCKKALAMRC-RDGKXADDSA-N 1 3 334.460 2.516 10 0 EFAEHO C[C@H](NCCC[NH2+]Cc1cccnc1)c1ccc(C(=O)N(C)C)cc1 ZINC000423179828 476955303 /nfs/dbraw/zinc/95/53/03/476955303.db2.gz AIOLDCXYWBWGTG-INIZCTEOSA-N 1 3 340.471 2.614 10 0 EFAEHO C[C@@H](CCc1ccc(I)cc1)[NH2+]CCCN ZINC000423184873 476956884 /nfs/dbraw/zinc/95/68/84/476956884.db2.gz IYAGEBMZMXYUEC-NSHDSACASA-N 1 3 332.229 2.551 10 0 EFAEHO CC[NH+](CC)CC1CCN(C(=O)Nc2cccc(CNC)c2)CC1 ZINC000415925393 476970635 /nfs/dbraw/zinc/97/06/35/476970635.db2.gz AMAKOXUYUHSLMB-UHFFFAOYSA-N 1 3 332.492 2.992 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)cc1 ZINC000423292715 476985337 /nfs/dbraw/zinc/98/53/37/476985337.db2.gz ODIJSJPZMPGPOQ-KGLIPLIRSA-N 1 3 347.484 2.929 10 0 EFAEHO COc1ccc([C@H](Cc2ccncc2)[NH2+][C@@H]2CCNC[C@@H]2C)cc1 ZINC000423387127 477013443 /nfs/dbraw/zinc/01/34/43/477013443.db2.gz HOQHWXHDRYIIKD-BEVDRBHNSA-N 1 3 325.456 2.962 10 0 EFAEHO C[C@H]1CN(C2CC2)C[C@H]1NC[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000423461386 477037814 /nfs/dbraw/zinc/03/78/14/477037814.db2.gz CHPAPIXRZFQQHK-QTLCSOKXSA-N 1 3 331.479 2.591 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)CCN2CCc3ccccc3C2)C[C@@H]1C ZINC000416153004 477042728 /nfs/dbraw/zinc/04/27/28/477042728.db2.gz ACGHABJZIDEVPF-PXNSSMCTSA-N 1 3 343.515 2.766 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)CCN2CCc3ccccc3C2)C[C@@H]1C ZINC000416153004 477042732 /nfs/dbraw/zinc/04/27/32/477042732.db2.gz ACGHABJZIDEVPF-PXNSSMCTSA-N 1 3 343.515 2.766 10 0 EFAEHO CN(CC[C@H]1CCCC[N@@H+]1C)C(=O)CCN1CCc2ccccc2C1 ZINC000416157628 477045257 /nfs/dbraw/zinc/04/52/57/477045257.db2.gz RGDXSRPOOYQGQF-HXUWFJFHSA-N 1 3 343.515 2.768 10 0 EFAEHO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)CCN1CCc2ccccc2C1 ZINC000416157628 477045261 /nfs/dbraw/zinc/04/52/61/477045261.db2.gz RGDXSRPOOYQGQF-HXUWFJFHSA-N 1 3 343.515 2.768 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)NCC1([NH3+])C2CC3CC(C2)CC1C3 ZINC000423522870 477059920 /nfs/dbraw/zinc/05/99/20/477059920.db2.gz HVKOSAGRVDRHPD-BMQYYLHXSA-N 1 3 328.504 2.653 10 0 EFAEHO CN(CCCNC(=O)CC[C@H]1CCCC[N@@H+]1C)Cc1ccccc1 ZINC000431623477 477063718 /nfs/dbraw/zinc/06/37/18/477063718.db2.gz SPZBBDBPTITDKS-LJQANCHMSA-N 1 3 331.504 2.889 10 0 EFAEHO CN(CCCNC(=O)CC[C@H]1CCCC[N@H+]1C)Cc1ccccc1 ZINC000431623477 477063724 /nfs/dbraw/zinc/06/37/24/477063724.db2.gz SPZBBDBPTITDKS-LJQANCHMSA-N 1 3 331.504 2.889 10 0 EFAEHO C[NH+]1CCC2(CCCN2C(=O)CCN2CCc3ccccc3C2)CC1 ZINC000416192204 477064181 /nfs/dbraw/zinc/06/41/81/477064181.db2.gz QBSCSEIECLARIS-UHFFFAOYSA-N 1 3 341.499 2.522 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@H](O)c2ccc(Cl)c(F)c2)[C@@H]2CCC[C@H]21 ZINC000375896077 477068289 /nfs/dbraw/zinc/06/82/89/477068289.db2.gz SOLRZYXFQDOXNP-SJWGOKEGSA-N 1 3 326.843 2.975 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)[C@@H]2CCC[C@H]21 ZINC000375896077 477068292 /nfs/dbraw/zinc/06/82/92/477068292.db2.gz SOLRZYXFQDOXNP-SJWGOKEGSA-N 1 3 326.843 2.975 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)[C@@H]2CCC[C@H]21 ZINC000375896077 477068300 /nfs/dbraw/zinc/06/83/00/477068300.db2.gz SOLRZYXFQDOXNP-SJWGOKEGSA-N 1 3 326.843 2.975 10 0 EFAEHO C[N@@H+]1CCCC[C@@H]1CCC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000431656854 477068486 /nfs/dbraw/zinc/06/84/86/477068486.db2.gz DBOBISGNLLNAPE-RTBURBONSA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@H+]1CCCC[C@@H]1CCC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000431656854 477068488 /nfs/dbraw/zinc/06/84/88/477068488.db2.gz DBOBISGNLLNAPE-RTBURBONSA-N 1 3 329.488 2.642 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)CC[C@@H]2CCCC[N@@H+]2C)N(C)C)cc1 ZINC000431773330 477092037 /nfs/dbraw/zinc/09/20/37/477092037.db2.gz OGOINEJKWVTQQO-OALUTQOASA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)CC[C@@H]2CCCC[N@H+]2C)N(C)C)cc1 ZINC000431773330 477092044 /nfs/dbraw/zinc/09/20/44/477092044.db2.gz OGOINEJKWVTQQO-OALUTQOASA-N 1 3 331.504 2.978 10 0 EFAEHO O=C(CCN1CCc2ccccc2C1)NC1CC[NH+](C2CCC2)CC1 ZINC000416249235 477093478 /nfs/dbraw/zinc/09/34/78/477093478.db2.gz WODLYXKGDYHNTM-UHFFFAOYSA-N 1 3 341.499 2.568 10 0 EFAEHO C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H]2[NH2+]CCCC2(C)C)CC1 ZINC000423850265 477184773 /nfs/dbraw/zinc/18/47/73/477184773.db2.gz POAVHYRMWWWOLK-CRAIPNDOSA-N 1 3 344.503 2.501 10 0 EFAEHO CC[C@H](CO)N1CCN(Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000411295166 477184901 /nfs/dbraw/zinc/18/49/01/477184901.db2.gz ODTXCPDUCKVVDT-OAQYLSRUSA-N 1 3 345.531 2.561 10 0 EFAEHO CC[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@H]2CCC[C@H]21)C(=O)NC ZINC000453398934 477221191 /nfs/dbraw/zinc/22/11/91/477221191.db2.gz JTXKYQAIOUCRFP-OKYOBFRVSA-N 1 3 329.488 2.544 10 0 EFAEHO CC[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@@H]2CCC[C@@H]21)C(=O)NC ZINC000453398931 477221439 /nfs/dbraw/zinc/22/14/39/477221439.db2.gz JTXKYQAIOUCRFP-FCGDIQPGSA-N 1 3 329.488 2.544 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+](C)[C@@H](C)[C@H]2Cc3ccccc3O2)CC1 ZINC000367044887 477313535 /nfs/dbraw/zinc/31/35/35/477313535.db2.gz YBMZRYIVSOKMPC-GHTZIAJQSA-N 1 3 345.531 2.727 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+](C)[C@@H](C)[C@H]2Cc3ccccc3O2)CC1 ZINC000367044887 477313541 /nfs/dbraw/zinc/31/35/41/477313541.db2.gz YBMZRYIVSOKMPC-GHTZIAJQSA-N 1 3 345.531 2.727 10 0 EFAEHO C[C@@H]1OCC[C@@H]1N(CCO)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000411669349 477319055 /nfs/dbraw/zinc/31/90/55/477319055.db2.gz ZIMFIYFCVICPKU-PXNSSMCTSA-N 1 3 332.488 2.644 10 0 EFAEHO COCC[C@@H]1CCC[C@H]1[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000367078854 477331389 /nfs/dbraw/zinc/33/13/89/477331389.db2.gz SFYWQFVHMLNCHA-RBUKOAKNSA-N 1 3 337.552 2.732 10 0 EFAEHO O=C(NC[C@H]1CCCCN1C1CC1)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000434348193 477332756 /nfs/dbraw/zinc/33/27/56/477332756.db2.gz DMSOSYJSQRDCPK-RTBURBONSA-N 1 3 348.535 2.663 10 0 EFAEHO O=C(NC[C@@H]1CCCCN1C1CC1)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000434348192 477333731 /nfs/dbraw/zinc/33/37/31/477333731.db2.gz DMSOSYJSQRDCPK-RBUKOAKNSA-N 1 3 348.535 2.663 10 0 EFAEHO CN1CC[C@H](NC(=O)NCCCC[N@H+](C)C2CC2)[C@@H]1c1ccccc1 ZINC000454720974 477344512 /nfs/dbraw/zinc/34/45/12/477344512.db2.gz KLDVSDQYCJAGMN-OALUTQOASA-N 1 3 344.503 2.605 10 0 EFAEHO CN1CC[C@H](NC(=O)NCCCC[N@@H+](C)C2CC2)[C@@H]1c1ccccc1 ZINC000454720974 477344519 /nfs/dbraw/zinc/34/45/19/477344519.db2.gz KLDVSDQYCJAGMN-OALUTQOASA-N 1 3 344.503 2.605 10 0 EFAEHO C[N@H+](CCCNC(=O)NC[C@H](N)c1ccccc1)Cc1ccccc1 ZINC000416867689 477344882 /nfs/dbraw/zinc/34/48/82/477344882.db2.gz CZNKIQJNPBXBFL-IBGZPJMESA-N 1 3 340.471 2.508 10 0 EFAEHO C[N@@H+](CCCNC(=O)NC[C@H](N)c1ccccc1)Cc1ccccc1 ZINC000416867689 477344893 /nfs/dbraw/zinc/34/48/93/477344893.db2.gz CZNKIQJNPBXBFL-IBGZPJMESA-N 1 3 340.471 2.508 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@H]([NH2+]Cc3cccc(OCCN(C)C)c3)C[C@H]2C1 ZINC000424271825 477352020 /nfs/dbraw/zinc/35/20/20/477352020.db2.gz SMLGFKVGERTBOI-XGPVDZAGSA-N 1 3 332.488 2.920 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)NCc2ccc(CN(C)C)cc2)cc1 ZINC000416885565 477353022 /nfs/dbraw/zinc/35/30/22/477353022.db2.gz MBTMFFISQXTHIP-HNNXBMFYSA-N 1 3 340.471 2.767 10 0 EFAEHO C[C@@H]1CN(C(=O)NCc2ccccc2C[NH+]2CCCCC2)[C@H](C)CN1 ZINC000416901853 477361844 /nfs/dbraw/zinc/36/18/44/477361844.db2.gz KOINRFAJGDFUAJ-IAGOWNOFSA-N 1 3 344.503 2.564 10 0 EFAEHO C[C@@H]1CN[C@@H](C)CN1C(=O)NCc1ccccc1C[NH+]1CCCCC1 ZINC000416901848 477362222 /nfs/dbraw/zinc/36/22/22/477362222.db2.gz KOINRFAJGDFUAJ-DLBZAZTESA-N 1 3 344.503 2.564 10 0 EFAEHO CC[NH+](CC)[C@@H](CNC(=O)NC[C@H](N)c1ccccc1)CC(C)C ZINC000416943093 477380355 /nfs/dbraw/zinc/38/03/55/477380355.db2.gz CBDJJWAOTBHHKI-MSOLQXFVSA-N 1 3 334.508 2.742 10 0 EFAEHO CN(C)Cc1ccc(-c2ccccc2CNC(=O)NCCC[NH3+])cc1 ZINC000416967125 477393001 /nfs/dbraw/zinc/39/30/01/477393001.db2.gz WRLIEVMDBQDHPW-UHFFFAOYSA-N 1 3 340.471 2.563 10 0 EFAEHO C[C@H](Cc1ccoc1)[NH2+]Cc1ccc(CN2CCC(O)CC2)cc1 ZINC000449058102 477415038 /nfs/dbraw/zinc/41/50/38/477415038.db2.gz GIQDQAXYLOIRMX-MRXNPFEDSA-N 1 3 328.456 2.957 10 0 EFAEHO CC(C)COC[C@@H](O)CNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449095556 477436005 /nfs/dbraw/zinc/43/60/05/477436005.db2.gz ZJLOTEFBKOOXQG-NQIIRXRSSA-N 1 3 348.531 2.705 10 0 EFAEHO CSC[C@](C)(O)CNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449165093 477464735 /nfs/dbraw/zinc/46/47/35/477464735.db2.gz SXGQNRHFNKVHCZ-QFBILLFUSA-N 1 3 336.545 2.786 10 0 EFAEHO COCCOC[C@H](C)NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449175564 477471732 /nfs/dbraw/zinc/47/17/32/477471732.db2.gz OMXWOPAIHKNICU-ZWKOTPCHSA-N 1 3 334.504 2.723 10 0 EFAEHO C[C@H](Cc1ccoc1)[NH2+]Cc1ccccc1CN1CCC(O)CC1 ZINC000449178982 477472636 /nfs/dbraw/zinc/47/26/36/477472636.db2.gz USJRCGFAICVZOC-MRXNPFEDSA-N 1 3 328.456 2.957 10 0 EFAEHO CC(C)[N@@H+]1CC[C@H](N(C)C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)C1 ZINC000458581795 477493195 /nfs/dbraw/zinc/49/31/95/477493195.db2.gz MHYUSPPMIGCSSC-IPMKNSEASA-N 1 3 344.503 2.556 10 0 EFAEHO CC(C)[N@H+]1CC[C@H](N(C)C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)C1 ZINC000458581795 477493199 /nfs/dbraw/zinc/49/31/99/477493199.db2.gz MHYUSPPMIGCSSC-IPMKNSEASA-N 1 3 344.503 2.556 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)CC1 ZINC000371819783 477511663 /nfs/dbraw/zinc/51/16/63/477511663.db2.gz ZCHXWHHGCJNWCQ-SJLPKXTDSA-N 1 3 344.503 2.548 10 0 EFAEHO COC(=O)C1(CNC2CC[NH+]([C@H](C)Cc3ccccc3)CC2)CC1 ZINC000449258391 477511711 /nfs/dbraw/zinc/51/17/11/477511711.db2.gz PIIGULNQLUYQGW-MRXNPFEDSA-N 1 3 330.472 2.625 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NCCOCC(F)F)CC1 ZINC000449270512 477516677 /nfs/dbraw/zinc/51/66/77/477516677.db2.gz ADNFSFMXDMEHNE-HNNXBMFYSA-N 1 3 326.431 2.953 10 0 EFAEHO COc1cc(C[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@H]32)cc(OC)c1OC ZINC000367537949 477563967 /nfs/dbraw/zinc/56/39/67/477563967.db2.gz KKMRMHKRUMPSLX-XHSDSOJGSA-N 1 3 334.460 2.675 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccnc(OC3CCOCC3)c2)[C@H]2CCC[C@H]21 ZINC000367625212 477609031 /nfs/dbraw/zinc/60/90/31/477609031.db2.gz XHZAZRNSUGOXMH-CEXWTWQISA-N 1 3 345.487 2.602 10 0 EFAEHO Cn1c2ccc(F)cc2nc1CCN[C@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000367627163 477609906 /nfs/dbraw/zinc/60/99/06/477609906.db2.gz RYBFILVWUAELMV-HLLBOEOZSA-N 1 3 330.451 2.717 10 0 EFAEHO Cn1c2ccc(F)cc2nc1CCN[C@H]1CC[N@@H+](C)[C@@H]2CCC[C@@H]21 ZINC000367627163 477609911 /nfs/dbraw/zinc/60/99/11/477609911.db2.gz RYBFILVWUAELMV-HLLBOEOZSA-N 1 3 330.451 2.717 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccccc2OC2CC2)CC[C@@H]1N1CCN(C)CC1 ZINC000450650631 477669252 /nfs/dbraw/zinc/66/92/52/477669252.db2.gz RJJAQBCLBXSPNT-PXNSSMCTSA-N 1 3 343.515 2.686 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccccc2OC2CC2)CC[C@@H]1N1CCN(C)CC1 ZINC000450650631 477669260 /nfs/dbraw/zinc/66/92/60/477669260.db2.gz RJJAQBCLBXSPNT-PXNSSMCTSA-N 1 3 343.515 2.686 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2OC2CC2)CC[C@H]1N1CCN(C)CC1 ZINC000450650634 477669427 /nfs/dbraw/zinc/66/94/27/477669427.db2.gz RJJAQBCLBXSPNT-YLJYHZDGSA-N 1 3 343.515 2.686 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2OC2CC2)CC[C@H]1N1CCN(C)CC1 ZINC000450650634 477669429 /nfs/dbraw/zinc/66/94/29/477669429.db2.gz RJJAQBCLBXSPNT-YLJYHZDGSA-N 1 3 343.515 2.686 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)N(C)C ZINC000459034437 477709157 /nfs/dbraw/zinc/70/91/57/477709157.db2.gz DFGDVGSAZKOWFU-JENIJYKNSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)N(C)C ZINC000459034437 477709164 /nfs/dbraw/zinc/70/91/64/477709164.db2.gz DFGDVGSAZKOWFU-JENIJYKNSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1)[NH+](C)C ZINC000459034437 477709170 /nfs/dbraw/zinc/70/91/70/477709170.db2.gz DFGDVGSAZKOWFU-JENIJYKNSA-N 1 3 346.519 2.631 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@](O)(C3CC3)C2)CC1 ZINC000426539391 477717825 /nfs/dbraw/zinc/71/78/25/477717825.db2.gz MKIOYWSHSRHKSZ-OAQYLSRUSA-N 1 3 343.515 2.565 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@](O)(C3CC3)C2)CC1 ZINC000426539391 477717828 /nfs/dbraw/zinc/71/78/28/477717828.db2.gz MKIOYWSHSRHKSZ-OAQYLSRUSA-N 1 3 343.515 2.565 10 0 EFAEHO COc1ccc([C@H](C[NH3+])CN[C@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000420395527 477746236 /nfs/dbraw/zinc/74/62/36/477746236.db2.gz DMJKGBOFRYORLM-GIVPXCGWSA-N 1 3 339.483 2.773 10 0 EFAEHO COc1ccc([C@H](CN)C[NH2+][C@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000420395527 477746241 /nfs/dbraw/zinc/74/62/41/477746241.db2.gz DMJKGBOFRYORLM-GIVPXCGWSA-N 1 3 339.483 2.773 10 0 EFAEHO C[NH+](C)CCOCCNCc1cnc(-c2c(F)cccc2F)s1 ZINC000451157223 477852479 /nfs/dbraw/zinc/85/24/79/477852479.db2.gz UWJNDQNUBFPDRL-UHFFFAOYSA-N 1 3 341.427 2.756 10 0 EFAEHO [NH3+]Cc1ccc(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)cc1 ZINC000515842908 477867679 /nfs/dbraw/zinc/86/76/79/477867679.db2.gz HPVYPDTXBKUHGY-SFHVURJKSA-N 1 3 349.438 2.970 10 0 EFAEHO [NH3+]Cc1ccc(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)cc1 ZINC000515842906 477868368 /nfs/dbraw/zinc/86/83/68/477868368.db2.gz HPVYPDTXBKUHGY-GOSISDBHSA-N 1 3 349.438 2.970 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N(C)C3(C)CCCC3)CC2)CC1 ZINC000515867087 477870622 /nfs/dbraw/zinc/87/06/22/477870622.db2.gz OTSSQDHUTCVASZ-UHFFFAOYSA-N 1 3 335.536 2.974 10 0 EFAEHO CC(C)C[C@H]([NH2+]CCc1ccc(Cl)cc1)C(=O)NCCN(C)C ZINC000459453573 477910910 /nfs/dbraw/zinc/91/09/10/477910910.db2.gz MRVWXUJQCHTHMQ-KRWDZBQOSA-N 1 3 339.911 2.565 10 0 EFAEHO C[NH+](C)C1(CNC(=O)N2CCc3ccccc3[C@@H]2CN)CCCCC1 ZINC000516462859 477936647 /nfs/dbraw/zinc/93/66/47/477936647.db2.gz MNECYJHLBKPUBL-SFHVURJKSA-N 1 3 344.503 2.519 10 0 EFAEHO C[NH+](C)C1(CNC(=O)N2CCc3ccccc3[C@H]2CN)CCCCC1 ZINC000516462858 477936925 /nfs/dbraw/zinc/93/69/25/477936925.db2.gz MNECYJHLBKPUBL-GOSISDBHSA-N 1 3 344.503 2.519 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2CCC[C@@H]2CCO)CC1 ZINC000495168264 478133072 /nfs/dbraw/zinc/13/30/72/478133072.db2.gz ATXJDMMCRPJXNV-QUCCMNQESA-N 1 3 345.531 2.859 10 0 EFAEHO C[C@@H]([NH2+]CCCN1CCC[C@H](C(N)=O)C1)c1ccc(Cl)c(F)c1 ZINC000534329002 478146069 /nfs/dbraw/zinc/14/60/69/478146069.db2.gz SFPWZHYDYLNLGL-OCCSQVGLSA-N 1 3 341.858 2.717 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N(CCN2CCCCCC2)C2CCC2)CC[N@@H+]1C ZINC000488873678 478194371 /nfs/dbraw/zinc/19/43/71/478194371.db2.gz CQMDQIBXMHBIIT-ROUUACIJSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N(CCN2CCCCCC2)C2CCC2)CC[N@H+]1C ZINC000488873678 478194377 /nfs/dbraw/zinc/19/43/77/478194377.db2.gz CQMDQIBXMHBIIT-ROUUACIJSA-N 1 3 335.536 2.974 10 0 EFAEHO CCOCC[C@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000570155377 478295056 /nfs/dbraw/zinc/29/50/56/478295056.db2.gz KMUXACFEQBQFHV-NXEWRWPSSA-N 1 3 332.488 2.559 10 0 EFAEHO CCOCC[C@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000570155377 478295059 /nfs/dbraw/zinc/29/50/59/478295059.db2.gz KMUXACFEQBQFHV-NXEWRWPSSA-N 1 3 332.488 2.559 10 0 EFAEHO CC[NH2+]CCCNC(=O)N(CC)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000562814267 478358775 /nfs/dbraw/zinc/35/87/75/478358775.db2.gz OLHMBBRTJGNJIN-HKUYNNGSSA-N 1 3 346.519 2.853 10 0 EFAEHO COC(=O)c1ccc2c(c1)[C@@H](NC[C@H]1CC[N@@H+](C3CC3)C1)CCC2 ZINC000594495458 478410305 /nfs/dbraw/zinc/41/03/05/478410305.db2.gz YFBXJQOGBFNWMW-KUHUBIRLSA-N 1 3 328.456 2.925 10 0 EFAEHO COC(=O)c1ccc2c(c1)[C@@H](NC[C@H]1CC[N@H+](C3CC3)C1)CCC2 ZINC000594495458 478410315 /nfs/dbraw/zinc/41/03/15/478410315.db2.gz YFBXJQOGBFNWMW-KUHUBIRLSA-N 1 3 328.456 2.925 10 0 EFAEHO CC1(NC(=O)NCc2ccccc2CN2CCCCC2)CC[NH2+]CC1 ZINC000571148257 478529463 /nfs/dbraw/zinc/52/94/63/478529463.db2.gz FTEFBTKQGCUBJB-UHFFFAOYSA-N 1 3 344.503 2.614 10 0 EFAEHO C[C@@H](c1ccccc1)N1CCC(NC(=O)N[C@H]2CC[NH2+]C[C@H]2C)CC1 ZINC000571303976 478567697 /nfs/dbraw/zinc/56/76/97/478567697.db2.gz OCQIVRYCBCGHDW-GJYPPUQNSA-N 1 3 344.503 2.509 10 0 EFAEHO COC(=O)[C@@H]1C[C@H]1[C@H](C)[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000594928415 478589940 /nfs/dbraw/zinc/58/99/40/478589940.db2.gz VUVWMWPZUJIUMA-RRQGHBQHSA-N 1 3 336.501 2.747 10 0 EFAEHO CCCN1CC[C@H](C[NH2+]C[C@H](O)COc2ccccc2C(C)C)C1 ZINC000563618606 478603740 /nfs/dbraw/zinc/60/37/40/478603740.db2.gz YLOXWIGCGQBOGL-MSOLQXFVSA-N 1 3 334.504 2.871 10 0 EFAEHO NC[C@@H]1c2ccccc2CCN1C(=O)NCC[NH2+]C1CCCCCC1 ZINC000571760322 478671202 /nfs/dbraw/zinc/67/12/02/478671202.db2.gz UQODVHJFWKAQSA-LJQANCHMSA-N 1 3 344.503 2.567 10 0 EFAEHO COC(=O)[C@@H]1C[C@@H]1[C@H](C)[NH2+]C[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000601137645 478681390 /nfs/dbraw/zinc/68/13/90/478681390.db2.gz FSCPQNIESKSGIK-CSFFLVESSA-N 1 3 330.472 2.542 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)CCN(C)c1ccncc1 ZINC000542785888 478685126 /nfs/dbraw/zinc/68/51/26/478685126.db2.gz UREVLOVFNHDBEQ-QGZVFWFLSA-N 1 3 332.492 2.679 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)CCN(C)c1ccncc1 ZINC000542785888 478685133 /nfs/dbraw/zinc/68/51/33/478685133.db2.gz UREVLOVFNHDBEQ-QGZVFWFLSA-N 1 3 332.492 2.679 10 0 EFAEHO C[N@H+](CCNC(=O)Nc1ccc2c(c1F)CCNC2)C1CCCCC1 ZINC000582834126 478697418 /nfs/dbraw/zinc/69/74/18/478697418.db2.gz OQPWIBOCTLNOJZ-UHFFFAOYSA-N 1 3 348.466 2.857 10 0 EFAEHO C[N@@H+](CCNC(=O)Nc1ccc2c(c1F)CCNC2)C1CCCCC1 ZINC000582834126 478697426 /nfs/dbraw/zinc/69/74/26/478697426.db2.gz OQPWIBOCTLNOJZ-UHFFFAOYSA-N 1 3 348.466 2.857 10 0 EFAEHO CCN(C(=O)N[C@H](C)C[C@H](C)[NH3+])[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000582903661 478714466 /nfs/dbraw/zinc/71/44/66/478714466.db2.gz LVCSOCFGDKDXRX-MJQMVNBJSA-N 1 3 346.519 2.979 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)C1 ZINC000582974004 478734221 /nfs/dbraw/zinc/73/42/21/478734221.db2.gz PQOKVVGKMUYKLQ-RKVPGOIHSA-N 1 3 335.517 2.589 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)C1 ZINC000582974004 478734230 /nfs/dbraw/zinc/73/42/30/478734230.db2.gz PQOKVVGKMUYKLQ-RKVPGOIHSA-N 1 3 335.517 2.589 10 0 EFAEHO Cc1noc(CCN[C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)n1 ZINC000583066304 478754319 /nfs/dbraw/zinc/75/43/19/478754319.db2.gz CVJVIRAZFSYLLS-OTWHNJEPSA-N 1 3 340.471 2.953 10 0 EFAEHO Cc1noc(CCN[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)n1 ZINC000583066304 478754331 /nfs/dbraw/zinc/75/43/31/478754331.db2.gz CVJVIRAZFSYLLS-OTWHNJEPSA-N 1 3 340.471 2.953 10 0 EFAEHO CCOC(=O)C1(C)CC(NC[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)C1 ZINC000601283440 478765211 /nfs/dbraw/zinc/76/52/11/478765211.db2.gz ZQPWJSAAIHFYGV-BHASAWDCSA-N 1 3 330.472 2.653 10 0 EFAEHO CCOC(=O)C1(C)CC(NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)C1 ZINC000601283440 478765215 /nfs/dbraw/zinc/76/52/15/478765215.db2.gz ZQPWJSAAIHFYGV-BHASAWDCSA-N 1 3 330.472 2.653 10 0 EFAEHO CCC[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(=O)N[C@@H]1CCCN(C)C1 ZINC000528439434 478776175 /nfs/dbraw/zinc/77/61/75/478776175.db2.gz VTRGGXVDPNFJBN-VAMGGRTRSA-N 1 3 343.515 2.745 10 0 EFAEHO CCC[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)N[C@@H]1CCCN(C)C1 ZINC000528439434 478776178 /nfs/dbraw/zinc/77/61/78/478776178.db2.gz VTRGGXVDPNFJBN-VAMGGRTRSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@@H+]1CCC[C@@H](C)C1 ZINC000572495811 478851632 /nfs/dbraw/zinc/85/16/32/478851632.db2.gz GCAMZRIEYKBWJO-KGLIPLIRSA-N 1 3 348.466 2.713 10 0 EFAEHO C[C@@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@H+]1CCC[C@@H](C)C1 ZINC000572495811 478851636 /nfs/dbraw/zinc/85/16/36/478851636.db2.gz GCAMZRIEYKBWJO-KGLIPLIRSA-N 1 3 348.466 2.713 10 0 EFAEHO CC[C@H]1CCCC[N@@H+]1CCNC(=O)N1CCc2ccccc2[C@H]1CN ZINC000564937618 478864746 /nfs/dbraw/zinc/86/47/46/478864746.db2.gz LWWGIQHDXVJJMS-PKOBYXMFSA-N 1 3 344.503 2.519 10 0 EFAEHO CC[C@H]1CCCC[N@H+]1CCNC(=O)N1CCc2ccccc2[C@H]1CN ZINC000564937618 478864750 /nfs/dbraw/zinc/86/47/50/478864750.db2.gz LWWGIQHDXVJJMS-PKOBYXMFSA-N 1 3 344.503 2.519 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](N[C@@H]2C[C@@H](OCC)[C@H]2SC)[C@@H](C)C1 ZINC000592393823 478882002 /nfs/dbraw/zinc/88/20/02/478882002.db2.gz DCPOPYIJJIHYDT-TZNCUMHOSA-N 1 3 344.565 2.622 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](N[C@@H]2C[C@@H](OCC)[C@H]2SC)[C@@H](C)C1 ZINC000592393823 478882010 /nfs/dbraw/zinc/88/20/10/478882010.db2.gz DCPOPYIJJIHYDT-TZNCUMHOSA-N 1 3 344.565 2.622 10 0 EFAEHO OCC1(CN[C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)CC2(CCC2)C1 ZINC000572712669 478902350 /nfs/dbraw/zinc/90/23/50/478902350.db2.gz PAAHQTWDGIUHTH-LAUBAEHRSA-N 1 3 342.483 2.775 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](c2ccc(F)cc2)[C@@H]([NH3+])C1)N(CC)CC ZINC000583755803 478934312 /nfs/dbraw/zinc/93/43/12/478934312.db2.gz FIBKDTVVJNLKQS-SQNIBIBYSA-N 1 3 335.467 2.589 10 0 EFAEHO CCN(C(=O)N[C@@H](C)C[NH+](C)C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000512427032 478997344 /nfs/dbraw/zinc/99/73/44/478997344.db2.gz PMIBJIXSMOGOAC-SCTDSRPQSA-N 1 3 346.519 2.804 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(CN3CCC(C(N)=O)CC3)cc2)[C@H]1C ZINC000556881905 479231921 /nfs/dbraw/zinc/23/19/21/479231921.db2.gz QZGKMUBJKOLWHS-ZRGWGRIASA-N 1 3 329.488 2.518 10 0 EFAEHO CC(C)C[C@@H](C[NH+]1CCCC1)NC(=O)CCN(C)c1ccncc1 ZINC000570040886 479235510 /nfs/dbraw/zinc/23/55/10/479235510.db2.gz YPDKQCKUHILHEM-KRWDZBQOSA-N 1 3 332.492 2.535 10 0 EFAEHO N[C@H]1CCC[C@H]([NH2+]CCc2ccc(I)cc2)C1 ZINC000596653481 479373891 /nfs/dbraw/zinc/37/38/91/479373891.db2.gz KYRFOAFJXIMDTM-KBPBESRZSA-N 1 3 344.240 2.693 10 0 EFAEHO [NH3+][C@H]1CCC[C@H](NCCc2ccc(I)cc2)C1 ZINC000596653481 479373895 /nfs/dbraw/zinc/37/38/95/479373895.db2.gz KYRFOAFJXIMDTM-KBPBESRZSA-N 1 3 344.240 2.693 10 0 EFAEHO CN1CCC[C@H](NC(=O)N[C@H](C[NH+]2CCCCC2)c2ccccc2)C1 ZINC000604178851 479480191 /nfs/dbraw/zinc/48/01/91/479480191.db2.gz HQULMJPSRPAYBR-RBUKOAKNSA-N 1 3 344.503 2.607 10 0 EFAEHO COC(=O)[C@H]1C[C@@H](NC2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)C1 ZINC000597223944 479630815 /nfs/dbraw/zinc/63/08/15/479630815.db2.gz YDHPSNFIMSSTHJ-VDZJLULYSA-N 1 3 330.472 2.623 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NC[C@@H]2N(C)CCCC2(C)C)CC1 ZINC000633196142 479711565 /nfs/dbraw/zinc/71/15/65/479711565.db2.gz CQPRHDBSMBSZRG-INIZCTEOSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)CC[N@@H+]1C ZINC000630806971 479716849 /nfs/dbraw/zinc/71/68/49/479716849.db2.gz CMHHLGRDBKTTBP-DSLXNQLJSA-N 1 3 329.488 2.668 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)CC[N@H+]1C ZINC000630806971 479716856 /nfs/dbraw/zinc/71/68/56/479716856.db2.gz CMHHLGRDBKTTBP-DSLXNQLJSA-N 1 3 329.488 2.668 10 0 EFAEHO C[N@H+](CCOC1CCOCC1)CCC1CCN(c2ccncc2)CC1 ZINC000625287165 479851153 /nfs/dbraw/zinc/85/11/53/479851153.db2.gz UEULYKGBEXUDFV-UHFFFAOYSA-N 1 3 347.503 2.816 10 0 EFAEHO C[N@@H+](CCOC1CCOCC1)CCC1CCN(c2ccncc2)CC1 ZINC000625287165 479851156 /nfs/dbraw/zinc/85/11/56/479851156.db2.gz UEULYKGBEXUDFV-UHFFFAOYSA-N 1 3 347.503 2.816 10 0 EFAEHO CCN1CCN(CCC[NH2+]Cc2ccc(CC(F)(F)F)cc2)CC1 ZINC000631042391 479852389 /nfs/dbraw/zinc/85/23/89/479852389.db2.gz ZAJKOJZOSHLUQM-UHFFFAOYSA-N 1 3 343.437 2.909 10 0 EFAEHO CCN1CCN(CCC[NH2+]Cc2ccccc2CC(F)(F)F)CC1 ZINC000631041832 479853218 /nfs/dbraw/zinc/85/32/18/479853218.db2.gz UENXEDPRQQZLIQ-UHFFFAOYSA-N 1 3 343.437 2.909 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCN(Cc3ccccc3)CC[C@@H]2C)CC[N@@H+]1C ZINC000631597350 480174404 /nfs/dbraw/zinc/17/44/04/480174404.db2.gz SIWNLLFJPHGNKI-YSIASYRMSA-N 1 3 343.515 2.840 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCN(Cc3ccccc3)CC[C@@H]2C)CC[N@H+]1C ZINC000631597350 480174411 /nfs/dbraw/zinc/17/44/11/480174411.db2.gz SIWNLLFJPHGNKI-YSIASYRMSA-N 1 3 343.515 2.840 10 0 EFAEHO O[C@H]1CC[N@H+](Cc2ccc(CN[C@H]3CCCc4ncccc43)cc2)C1 ZINC000631647174 480197644 /nfs/dbraw/zinc/19/76/44/480197644.db2.gz QBSCCHLVIOUBLX-RXVVDRJESA-N 1 3 337.467 2.815 10 0 EFAEHO O[C@H]1CC[N@@H+](Cc2ccc(CN[C@H]3CCCc4ncccc43)cc2)C1 ZINC000631647174 480197652 /nfs/dbraw/zinc/19/76/52/480197652.db2.gz QBSCCHLVIOUBLX-RXVVDRJESA-N 1 3 337.467 2.815 10 0 EFAEHO O[C@H](CC[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21)C(F)F ZINC000631704826 480229201 /nfs/dbraw/zinc/22/92/01/480229201.db2.gz XVSWYLFDCOKMIR-BSDSXHPESA-N 1 3 338.442 2.893 10 0 EFAEHO C[N@@H+]1CC[C@H](NCc2ccnc(N3CCSCC3)c2)[C@@H]2CCC[C@@H]21 ZINC000631723013 480238993 /nfs/dbraw/zinc/23/89/93/480238993.db2.gz DOEUIWCOYXNBQT-BZSNNMDCSA-N 1 3 346.544 2.597 10 0 EFAEHO C[N@H+]1CC[C@H](NCc2ccnc(N3CCSCC3)c2)[C@@H]2CCC[C@@H]21 ZINC000631723013 480239001 /nfs/dbraw/zinc/23/90/01/480239001.db2.gz DOEUIWCOYXNBQT-BZSNNMDCSA-N 1 3 346.544 2.597 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccnc(N3CCSCC3)c2)[C@@H]2CCC[C@@H]21 ZINC000631723013 480239008 /nfs/dbraw/zinc/23/90/08/480239008.db2.gz DOEUIWCOYXNBQT-BZSNNMDCSA-N 1 3 346.544 2.597 10 0 EFAEHO C[C@H](CCc1ccc(OC(F)F)cc1)NCC1([NH3+])CCOCC1 ZINC000629387569 480244453 /nfs/dbraw/zinc/24/44/53/480244453.db2.gz JESCIDXTWBFAKQ-CYBMUJFWSA-N 1 3 328.403 2.707 10 0 EFAEHO Cc1nc2ccccc2cc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617502344 480245783 /nfs/dbraw/zinc/24/57/83/480245783.db2.gz MDNRBIBZCRHSGO-HNNXBMFYSA-N 1 3 342.487 2.545 10 0 EFAEHO Cc1nc2ccccc2cc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617502344 480245786 /nfs/dbraw/zinc/24/57/86/480245786.db2.gz MDNRBIBZCRHSGO-HNNXBMFYSA-N 1 3 342.487 2.545 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C[C@@H]1CCc2ccccc2C1 ZINC000617505851 480246414 /nfs/dbraw/zinc/24/64/14/480246414.db2.gz SIJVEGRCHAINKB-ZWKOTPCHSA-N 1 3 345.531 2.570 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C[C@@H]1CCc2ccccc2C1 ZINC000617505851 480246421 /nfs/dbraw/zinc/24/64/21/480246421.db2.gz SIJVEGRCHAINKB-ZWKOTPCHSA-N 1 3 345.531 2.570 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cc(F)c(F)cc1Cl ZINC000617503751 480247138 /nfs/dbraw/zinc/24/71/38/480247138.db2.gz XONQWWXJBMUQJF-NSHDSACASA-N 1 3 347.837 2.620 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cc(F)c(F)cc1Cl ZINC000617503751 480247144 /nfs/dbraw/zinc/24/71/44/480247144.db2.gz XONQWWXJBMUQJF-NSHDSACASA-N 1 3 347.837 2.620 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1sccc1-n1cccc1 ZINC000617504270 480248015 /nfs/dbraw/zinc/24/80/15/480248015.db2.gz NPKUSBIFMCTMNG-HNNXBMFYSA-N 1 3 348.516 2.541 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1sccc1-n1cccc1 ZINC000617504270 480248020 /nfs/dbraw/zinc/24/80/20/480248020.db2.gz NPKUSBIFMCTMNG-HNNXBMFYSA-N 1 3 348.516 2.541 10 0 EFAEHO Cc1cc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c(C(F)(F)F)o1 ZINC000617507325 480249498 /nfs/dbraw/zinc/24/94/98/480249498.db2.gz RRACFXRGHWRKLE-NSHDSACASA-N 1 3 349.397 2.609 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Cc1cccc(C(F)F)c1 ZINC000617507424 480249149 /nfs/dbraw/zinc/24/91/49/480249149.db2.gz WDPDQXWLGIPYKB-AWEZNQCLSA-N 1 3 341.446 2.555 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Cc1cccc(C(F)F)c1 ZINC000617507424 480249155 /nfs/dbraw/zinc/24/91/55/480249155.db2.gz WDPDQXWLGIPYKB-AWEZNQCLSA-N 1 3 341.446 2.555 10 0 EFAEHO Cc1cc(C)n(-c2ccc(C[NH2+][C@H]3CCN(C)C(C)(C)C3)cn2)n1 ZINC000623361947 480249802 /nfs/dbraw/zinc/24/98/02/480249802.db2.gz YGVDJHZMJUACQD-KRWDZBQOSA-N 1 3 327.476 2.847 10 0 EFAEHO CCc1ccccc1[C@@H]1C[C@H]1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617507575 480249863 /nfs/dbraw/zinc/24/98/63/480249863.db2.gz ATXSXMLZZXLMGW-FFZOFVMBSA-N 1 3 345.531 2.741 10 0 EFAEHO CCc1ccccc1[C@@H]1C[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617507575 480249869 /nfs/dbraw/zinc/24/98/69/480249869.db2.gz ATXSXMLZZXLMGW-FFZOFVMBSA-N 1 3 345.531 2.741 10 0 EFAEHO Cc1cccc(Cl)c1CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617507322 480249978 /nfs/dbraw/zinc/24/99/78/480249978.db2.gz RPMWKMFIARQEEM-HNNXBMFYSA-N 1 3 339.911 2.579 10 0 EFAEHO Cc1cccc(Cl)c1CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617507322 480249985 /nfs/dbraw/zinc/24/99/85/480249985.db2.gz RPMWKMFIARQEEM-HNNXBMFYSA-N 1 3 339.911 2.579 10 0 EFAEHO Cc1cc(C)n(-c2ccc(C[NH2+][C@@H]3CCN(C)C(C)(C)C3)cn2)n1 ZINC000623361948 480250594 /nfs/dbraw/zinc/25/05/94/480250594.db2.gz YGVDJHZMJUACQD-QGZVFWFLSA-N 1 3 327.476 2.847 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@H](c1ccccc1)C1CC1 ZINC000617506634 480251548 /nfs/dbraw/zinc/25/15/48/480251548.db2.gz USQWVIDFXVZLNW-QFBILLFUSA-N 1 3 331.504 2.568 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@H](c1ccccc1)C1CC1 ZINC000617506634 480251554 /nfs/dbraw/zinc/25/15/54/480251554.db2.gz USQWVIDFXVZLNW-QFBILLFUSA-N 1 3 331.504 2.568 10 0 EFAEHO Cc1ccc2snc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c2c1 ZINC000617507902 480251580 /nfs/dbraw/zinc/25/15/80/480251580.db2.gz OFMUYFSXXZTZSS-AWEZNQCLSA-N 1 3 348.516 2.607 10 0 EFAEHO Cc1ccc2snc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c2c1 ZINC000617507902 480251586 /nfs/dbraw/zinc/25/15/86/480251586.db2.gz OFMUYFSXXZTZSS-AWEZNQCLSA-N 1 3 348.516 2.607 10 0 EFAEHO CC(C)(CNC(=O)NC[C@@H]1CCN1C1CCCC1)[NH+]1CCCCC1 ZINC000623369249 480252569 /nfs/dbraw/zinc/25/25/69/480252569.db2.gz VZFYBPXSTLXDJF-KRWDZBQOSA-N 1 3 336.524 2.567 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccnc(OC3CCOCC3)c2)CC1(C)C ZINC000623417514 480273514 /nfs/dbraw/zinc/27/35/14/480273514.db2.gz AVXPWOUSDBDWKF-INIZCTEOSA-N 1 3 333.476 2.602 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+][C@@H]2CCN(C)C(C)(C)C2)[C@@H](C)C1 ZINC000623420599 480276645 /nfs/dbraw/zinc/27/66/45/480276645.db2.gz IIYOWLCKNDWCSQ-KSZLIROESA-N 1 3 325.541 2.586 10 0 EFAEHO C[C@@H](NC(=O)[C@H](C)N1CCC([C@H]2CCC[NH2+]C2)CC1)c1ccccc1 ZINC000631829461 480288874 /nfs/dbraw/zinc/28/88/74/480288874.db2.gz RBRRMPFFNCAIPO-UWVAXJGDSA-N 1 3 343.515 2.964 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1)c1ccccc1 ZINC000631826880 480288947 /nfs/dbraw/zinc/28/89/47/480288947.db2.gz YYSCYCWSYXDUHF-LFGUQSLTSA-N 1 3 343.515 2.964 10 0 EFAEHO Cc1cc(Br)cc2c1[C@@H]([NH2+]CC1(N)CCOCC1)CC2 ZINC000629522288 480292746 /nfs/dbraw/zinc/29/27/46/480292746.db2.gz ZEVLDFGJWXHIMI-AWEZNQCLSA-N 1 3 339.277 2.842 10 0 EFAEHO NC1(C[NH2+][C@@H]2CCCc3cc(Br)ccc32)CCOCC1 ZINC000629522017 480293618 /nfs/dbraw/zinc/29/36/18/480293618.db2.gz VIDCKIKUKSRPQG-OAHLLOKOSA-N 1 3 339.277 2.924 10 0 EFAEHO CC[C@H]([NH2+]CC1(N)CCOCC1)c1cccc(Br)c1 ZINC000629523141 480294268 /nfs/dbraw/zinc/29/42/68/480294268.db2.gz ADUKCXOFTMOGMX-AWEZNQCLSA-N 1 3 327.266 2.998 10 0 EFAEHO C[NH2+]CCOCCN[C@H](C)c1cnn(-c2cc(C)ccc2C)c1C ZINC000629528939 480295914 /nfs/dbraw/zinc/29/59/14/480295914.db2.gz NKAAETHRYPNEBH-MRXNPFEDSA-N 1 3 330.476 2.684 10 0 EFAEHO C[NH2+]CCOCCN[C@@H](C)c1cnn(-c2cc(C)ccc2C)c1C ZINC000629528938 480296135 /nfs/dbraw/zinc/29/61/35/480296135.db2.gz NKAAETHRYPNEBH-INIZCTEOSA-N 1 3 330.476 2.684 10 0 EFAEHO C[NH2+]CCOCCN[C@H]1CC(C)(C)c2ccc(Br)cc21 ZINC000629530592 480296151 /nfs/dbraw/zinc/29/61/51/480296151.db2.gz KVXSNGLQQVYJEJ-HNNXBMFYSA-N 1 3 341.293 2.997 10 0 EFAEHO [NH3+]C[C@@H](Cc1ccccc1)[C@H]1CCCCN1CCOC1CCOCC1 ZINC000629527654 480296373 /nfs/dbraw/zinc/29/63/73/480296373.db2.gz BMCRQYHUPIDMBD-TZIWHRDSSA-N 1 3 346.515 2.854 10 0 EFAEHO NC[C@@H](Cc1ccccc1)[C@H]1CCCC[N@@H+]1CCOC1CCOCC1 ZINC000629527654 480296377 /nfs/dbraw/zinc/29/63/77/480296377.db2.gz BMCRQYHUPIDMBD-TZIWHRDSSA-N 1 3 346.515 2.854 10 0 EFAEHO NC[C@@H](Cc1ccccc1)[C@H]1CCCC[N@H+]1CCOC1CCOCC1 ZINC000629527654 480296382 /nfs/dbraw/zinc/29/63/82/480296382.db2.gz BMCRQYHUPIDMBD-TZIWHRDSSA-N 1 3 346.515 2.854 10 0 EFAEHO C[NH2+]CCOCCN[C@@H](c1ccc(Br)s1)C1CC1 ZINC000629530655 480296580 /nfs/dbraw/zinc/29/65/80/480296580.db2.gz MXFMKACCRBZNLZ-CYBMUJFWSA-N 1 3 333.295 2.787 10 0 EFAEHO [NH3+]CCCOCCN[C@H]1CCc2c1cc(Br)cc2F ZINC000629542509 480297872 /nfs/dbraw/zinc/29/78/72/480297872.db2.gz ZOLFPDOAOVNQKI-AWEZNQCLSA-N 1 3 331.229 2.531 10 0 EFAEHO Cc1c([C@@H](C)NCCOCCC[NH3+])cnn1-c1cc(C)ccc1C ZINC000629535669 480298032 /nfs/dbraw/zinc/29/80/32/480298032.db2.gz DWLBMQJXFZZEBU-MRXNPFEDSA-N 1 3 330.476 2.814 10 0 EFAEHO [NH3+]CCCOCCN[C@@H]1CCCOc2cc(Br)ccc21 ZINC000629534868 480298094 /nfs/dbraw/zinc/29/80/94/480298094.db2.gz BVUGZZUNEROSHL-CQSZACIVSA-N 1 3 343.265 2.618 10 0 EFAEHO CNC[C@](C)(O)C[N@@H+]1C[C@H](c2ccc(Br)cc2)C[C@@H]1C ZINC000629581590 480315948 /nfs/dbraw/zinc/31/59/48/480315948.db2.gz DMKKHXATBOCEET-BJJXKVORSA-N 1 3 341.293 2.597 10 0 EFAEHO CNC[C@](C)(O)C[N@H+]1C[C@H](c2ccc(Br)cc2)C[C@@H]1C ZINC000629581590 480315953 /nfs/dbraw/zinc/31/59/53/480315953.db2.gz DMKKHXATBOCEET-BJJXKVORSA-N 1 3 341.293 2.597 10 0 EFAEHO C[NH2+]C[C@](C)(O)CN1C[C@H](c2ccc(Br)cc2)C[C@@H]1C ZINC000629581590 480315958 /nfs/dbraw/zinc/31/59/58/480315958.db2.gz DMKKHXATBOCEET-BJJXKVORSA-N 1 3 341.293 2.597 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2C[C@@H](OC(C)(C)C)[C@@H]2n2cccn2)CC1(C)C ZINC000623542414 480333010 /nfs/dbraw/zinc/33/30/10/480333010.db2.gz ZOELVBSWHPDESU-YLFCFFPRSA-N 1 3 334.508 2.843 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2C[C@@H](OC(C)(C)C)[C@@H]2n2cccn2)CC1(C)C ZINC000623542414 480333015 /nfs/dbraw/zinc/33/30/15/480333015.db2.gz ZOELVBSWHPDESU-YLFCFFPRSA-N 1 3 334.508 2.843 10 0 EFAEHO CNC(=O)[C@@H](CN[C@@H]1CC[N@H+](C)C(C)(C)C1)Cc1ccc(F)cc1C ZINC000623556645 480339636 /nfs/dbraw/zinc/33/96/36/480339636.db2.gz QZCNMJJVZQUXLF-SJLPKXTDSA-N 1 3 349.494 2.501 10 0 EFAEHO CNC(=O)[C@@H](CN[C@@H]1CC[N@@H+](C)C(C)(C)C1)Cc1ccc(F)cc1C ZINC000623556645 480339640 /nfs/dbraw/zinc/33/96/40/480339640.db2.gz QZCNMJJVZQUXLF-SJLPKXTDSA-N 1 3 349.494 2.501 10 0 EFAEHO C[NH2+]CCOCCN(C)Cc1ccc(Br)c(Cl)c1 ZINC000629653281 480344925 /nfs/dbraw/zinc/34/49/25/480344925.db2.gz JXQSNTYVIXGXHL-UHFFFAOYSA-N 1 3 335.673 2.770 10 0 EFAEHO CC(C)([NH2+]C[C@@H]1CCCN(C(=O)CN)C1)c1ccc2ccccc2c1 ZINC000629664446 480350212 /nfs/dbraw/zinc/35/02/12/480350212.db2.gz HTQYEUQDGCDAIO-INIZCTEOSA-N 1 3 339.483 2.862 10 0 EFAEHO [NH3+]CCCOCCNCc1cc(Br)c(Cl)s1 ZINC000629677678 480353921 /nfs/dbraw/zinc/35/39/21/480353921.db2.gz DCVCLTRSVQPXOL-UHFFFAOYSA-N 1 3 327.675 2.619 10 0 EFAEHO [NH3+]CCCOCCNCc1cn(C2CCCC2)nc1-c1ccccn1 ZINC000629681995 480355958 /nfs/dbraw/zinc/35/59/58/480355958.db2.gz XFGQESFEQIEPMV-UHFFFAOYSA-N 1 3 343.475 2.515 10 0 EFAEHO Fc1ccc(CN2CCCC2)cc1-c1ccc(N2CC[NH2+]CC2)nc1 ZINC000629702105 480363047 /nfs/dbraw/zinc/36/30/47/480363047.db2.gz FXZNBRCWYAKTLA-UHFFFAOYSA-N 1 3 340.446 2.893 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)NC[C@H]1CCN1C1CCCC1)C(C)C ZINC000623731820 480426523 /nfs/dbraw/zinc/42/65/23/480426523.db2.gz XBBQBQAFNORIIK-GOSISDBHSA-N 1 3 338.540 2.811 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2CO[C@@H](C3CC3)C2)CC1 ZINC000623752422 480436851 /nfs/dbraw/zinc/43/68/51/480436851.db2.gz GDEUMVIXXQOUHD-TZIWHRDSSA-N 1 3 343.515 2.876 10 0 EFAEHO CN(c1ccccc1CN[C@@H]1CO[C@H](C2CC2)C1)C1CC[NH+](C)CC1 ZINC000623752786 480437026 /nfs/dbraw/zinc/43/70/26/480437026.db2.gz LDWDJTPJZZVMIL-RXVVDRJESA-N 1 3 343.515 2.874 10 0 EFAEHO CC[NH+]1CCC(CNCc2ccnn2CCc2ccccc2)CC1 ZINC000621333845 480455711 /nfs/dbraw/zinc/45/57/11/480455711.db2.gz SWJNXAHQRCIMDU-UHFFFAOYSA-N 1 3 326.488 2.947 10 0 EFAEHO CCN1CCN(Cc2ccccc2C[NH2+][C@H](C)[C@@H]2CCCCO2)CC1 ZINC000623865804 480493399 /nfs/dbraw/zinc/49/33/99/480493399.db2.gz BKFNLOPCPWNGQF-NQIIRXRSSA-N 1 3 345.531 2.871 10 0 EFAEHO C[NH+](C)C[C@H](O)CN[C@@H]1CCCC[C@@H]1Sc1ccc(F)cc1 ZINC000623889087 480506009 /nfs/dbraw/zinc/50/60/09/480506009.db2.gz CJYLAOYNAHMOPY-OIISXLGYSA-N 1 3 326.481 2.741 10 0 EFAEHO C[N@@H+]1CC[C@H](Nc2cccc(CN3CCC(O)CC3)c2)CC1(C)C ZINC000623938609 480530349 /nfs/dbraw/zinc/53/03/49/480530349.db2.gz WBBXNGMAHSXCHN-SFHVURJKSA-N 1 3 331.504 2.928 10 0 EFAEHO C[N@H+]1CC[C@H](Nc2cccc(CN3CCC(O)CC3)c2)CC1(C)C ZINC000623938609 480530355 /nfs/dbraw/zinc/53/03/55/480530355.db2.gz WBBXNGMAHSXCHN-SFHVURJKSA-N 1 3 331.504 2.928 10 0 EFAEHO c1cc(-c2cnc(N3CCNCC3)nc2)ccc1C[NH+]1CCCCC1 ZINC000630052354 480530468 /nfs/dbraw/zinc/53/04/68/480530468.db2.gz VOVVWMHWSXMZKC-UHFFFAOYSA-N 1 3 337.471 2.539 10 0 EFAEHO C[C@H]1CCC[N@@H+]1Cc1cccc(-c2cnc(N3CCNCC3)nc2)c1 ZINC000630051841 480530635 /nfs/dbraw/zinc/53/06/35/480530635.db2.gz RZWJXPMOKWLQBH-INIZCTEOSA-N 1 3 337.471 2.538 10 0 EFAEHO C[C@H]1CCC[N@H+]1Cc1cccc(-c2cnc(N3CCNCC3)nc2)c1 ZINC000630051841 480530639 /nfs/dbraw/zinc/53/06/39/480530639.db2.gz RZWJXPMOKWLQBH-INIZCTEOSA-N 1 3 337.471 2.538 10 0 EFAEHO Cc1ccc(Br)cc1[C@H](C)NCCOCC[NH+](C)C ZINC000623967645 480546695 /nfs/dbraw/zinc/54/66/95/480546695.db2.gz FHAJHCMTJJGPQH-ZDUSSCGKSA-N 1 3 329.282 2.986 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@H]1CC[C@H](C)[NH2+]C1)c1ccccc1 ZINC000626921466 480581497 /nfs/dbraw/zinc/58/14/97/480581497.db2.gz ATRRWJHIIUGYEV-RYQLBKOJSA-N 1 3 332.492 2.509 10 0 EFAEHO C[C@@H]1[NH2+]CC[C@H]1NC(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000626945289 480591649 /nfs/dbraw/zinc/59/16/49/480591649.db2.gz HXUMEHMFISUSIC-UHOSZYNNSA-N 1 3 344.503 2.509 10 0 EFAEHO CC[C@@H]1[NH2+]CC[C@H]1NC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000626956875 480597865 /nfs/dbraw/zinc/59/78/65/480597865.db2.gz IASJBYPPAJGXNN-OTWHNJEPSA-N 1 3 344.503 2.572 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@H]2CN(c3ccc(Cl)cc3)CCO2)CC[N@@H+]1C ZINC000624118859 480617133 /nfs/dbraw/zinc/61/71/33/480617133.db2.gz QNZCXGRFNNPDSK-HFTRVMKXSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@H]2CN(c3ccc(Cl)cc3)CCO2)CC[N@H+]1C ZINC000624118859 480617138 /nfs/dbraw/zinc/61/71/38/480617138.db2.gz QNZCXGRFNNPDSK-HFTRVMKXSA-N 1 3 337.895 2.618 10 0 EFAEHO CC[NH+]1CCC(NC[C@H]2CN(c3ccc(Cl)cc3)CCO2)CC1 ZINC000624118457 480617502 /nfs/dbraw/zinc/61/75/02/480617502.db2.gz IFDLWBLPLXBOCP-SFHVURJKSA-N 1 3 337.895 2.619 10 0 EFAEHO O=C(NCCCCC[NH+]1CCCC1)NC[C@@H]1CCN1C1CCCC1 ZINC000624125609 480621763 /nfs/dbraw/zinc/62/17/63/480621763.db2.gz IFDIOFBXOAWWAH-SFHVURJKSA-N 1 3 336.524 2.569 10 0 EFAEHO O=C(NC[C@@H]1CC[N@@H+]1C1CCCCC1)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000624316393 480706034 /nfs/dbraw/zinc/70/60/34/480706034.db2.gz PAAHNVGTSMSKJW-FHWLQOOXSA-N 1 3 348.535 2.710 10 0 EFAEHO O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000624316393 480706036 /nfs/dbraw/zinc/70/60/36/480706036.db2.gz PAAHNVGTSMSKJW-FHWLQOOXSA-N 1 3 348.535 2.710 10 0 EFAEHO CCN(C(=O)N[C@@H]1CC[NH2+][C@H]1C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000627240874 480708701 /nfs/dbraw/zinc/70/87/01/480708701.db2.gz BSASKYANNMKUMA-PBWTXFEYSA-N 1 3 344.503 2.604 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)NCC[C@@H]([NH3+])Cc2ccccc2)c1 ZINC000630580726 480791818 /nfs/dbraw/zinc/79/18/18/480791818.db2.gz FIOMBBFAKMQGMZ-GOSISDBHSA-N 1 3 340.471 2.830 10 0 EFAEHO CCCN(C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)[C@@H]1CC[N@H+](C)C1 ZINC000645395442 480824091 /nfs/dbraw/zinc/82/40/91/480824091.db2.gz STWGFQUYGDDVEM-QRVBRYPASA-N 1 3 344.503 2.558 10 0 EFAEHO CCCN(C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)[C@@H]1CC[N@@H+](C)C1 ZINC000645395442 480824098 /nfs/dbraw/zinc/82/40/98/480824098.db2.gz STWGFQUYGDDVEM-QRVBRYPASA-N 1 3 344.503 2.558 10 0 EFAEHO CCCN(C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)[C@H]1CC[N@H+](C)C1 ZINC000645395440 480824626 /nfs/dbraw/zinc/82/46/26/480824626.db2.gz STWGFQUYGDDVEM-OTWHNJEPSA-N 1 3 344.503 2.558 10 0 EFAEHO CCCN(C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)[C@H]1CC[N@@H+](C)C1 ZINC000645395440 480824631 /nfs/dbraw/zinc/82/46/31/480824631.db2.gz STWGFQUYGDDVEM-OTWHNJEPSA-N 1 3 344.503 2.558 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NCCN2[C@H](C)CCC[C@@H]2C)CC1 ZINC000632990251 480836441 /nfs/dbraw/zinc/83/64/41/480836441.db2.gz RTEACXJGEURINF-CALCHBBNSA-N 1 3 338.540 2.765 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NC[C@@H](C)N2CCC(C)CC2)CC1 ZINC000633085979 480877110 /nfs/dbraw/zinc/87/71/10/480877110.db2.gz INEUFIWQCFLOKW-QGZVFWFLSA-N 1 3 338.540 2.623 10 0 EFAEHO CCC1([NH+]2CCCC2)CCN(C(=O)NC[C@@H](C)N(C)C2CC2)CC1 ZINC000633090342 480878798 /nfs/dbraw/zinc/87/87/98/480878798.db2.gz CVGHGOQIDNVVRW-MRXNPFEDSA-N 1 3 336.524 2.519 10 0 EFAEHO O=C(CC1CC[NH2+]CC1)N[C@H]1CCCCCN(Cc2ccccc2)C1 ZINC000638850842 480895680 /nfs/dbraw/zinc/89/56/80/480895680.db2.gz HLKZFVKOOYCLHU-FQEVSTJZSA-N 1 3 343.515 2.937 10 0 EFAEHO O=C(CCC1C[NH2+]C1)N[C@H]1CCCCCN(Cc2ccccc2)C1 ZINC000638851456 480896040 /nfs/dbraw/zinc/89/60/40/480896040.db2.gz LQPGFIJSKXPQFJ-IBGZPJMESA-N 1 3 329.488 2.547 10 0 EFAEHO COc1cc(CN2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)cc2c1OCCO2 ZINC000647543239 480992918 /nfs/dbraw/zinc/99/29/18/480992918.db2.gz JWDIKOQWORYMKN-IRXDYDNUSA-N 1 3 346.471 2.678 10 0 EFAEHO NCC(=O)N1CCC[C@H](C[NH2+]C2(c3cccc(Cl)c3)CCC2)C1 ZINC000647553388 480999193 /nfs/dbraw/zinc/99/91/93/480999193.db2.gz YYSBGRKVVPZJSW-CQSZACIVSA-N 1 3 335.879 2.506 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1cncc(Br)c1 ZINC000664194475 481079090 /nfs/dbraw/zinc/07/90/90/481079090.db2.gz FBCHPGKDCCNRCD-LBPRGKRZSA-N 1 3 329.286 2.528 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1cncc(Br)c1 ZINC000664194475 481079096 /nfs/dbraw/zinc/07/90/96/481079096.db2.gz FBCHPGKDCCNRCD-LBPRGKRZSA-N 1 3 329.286 2.528 10 0 EFAEHO CCN(C(=O)NCCCCC[NH+]1CCCCC1)[C@@H]1CCN(CC)C1 ZINC000664186385 481075644 /nfs/dbraw/zinc/07/56/44/481075644.db2.gz PVTUPGJRVTUUFC-GOSISDBHSA-N 1 3 338.540 2.768 10 0 EFAEHO CCN(C(=O)NCCCCC[NH+]1CCCCC1)[C@H]1CCN(CC)C1 ZINC000664186386 481075943 /nfs/dbraw/zinc/07/59/43/481075943.db2.gz PVTUPGJRVTUUFC-SFHVURJKSA-N 1 3 338.540 2.768 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2CC[C@H](C3CC3)[NH2+]2)N2CCCC2)cc1 ZINC000653113908 481089173 /nfs/dbraw/zinc/08/91/73/481089173.db2.gz RKNIKKJOZJFGKO-AABGKKOBSA-N 1 3 341.499 2.779 10 0 EFAEHO Cc1ccc(C2(NCC(=O)NC3CC[NH+](C4CC4)CC3)CCC2)cc1 ZINC000646131296 481108789 /nfs/dbraw/zinc/10/87/89/481108789.db2.gz JJBQQJGXXIBBHY-UHFFFAOYSA-N 1 3 341.499 2.707 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N[C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC000664227713 481110949 /nfs/dbraw/zinc/11/09/49/481110949.db2.gz DMHVOBMGOSDIEY-XWTMOSNGSA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N[C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC000664227713 481110953 /nfs/dbraw/zinc/11/09/53/481110953.db2.gz DMHVOBMGOSDIEY-XWTMOSNGSA-N 1 3 338.540 2.526 10 0 EFAEHO c1ccc2c(c1)O[C@H](CCN[C@@H]1CCOC[C@@H]1[C@@H]1CCC[NH2+]1)CS2 ZINC000647800384 481114811 /nfs/dbraw/zinc/11/48/11/481114811.db2.gz AFBUPQOWYNVKRC-WCXIOVBPSA-N 1 3 348.512 2.677 10 0 EFAEHO CC1(C)CC(NC(=O)N2CCc3ccccc3[C@H]2CN)CC(C)(C)[NH2+]1 ZINC000646181459 481143798 /nfs/dbraw/zinc/14/37/98/481143798.db2.gz OMZSCECZANHTNC-QGZVFWFLSA-N 1 3 344.503 2.563 10 0 EFAEHO CCN(C(=O)NCC[C@@H](C)[N@H+](C)Cc1ccccc1)[C@H]1CCN(C)C1 ZINC000664292843 481156983 /nfs/dbraw/zinc/15/69/83/481156983.db2.gz SFWAUSGUYCFYLJ-MJGOQNOKSA-N 1 3 346.519 2.633 10 0 EFAEHO CCN(C(=O)NCC[C@@H](C)[N@@H+](C)Cc1ccccc1)[C@H]1CCN(C)C1 ZINC000664292843 481156989 /nfs/dbraw/zinc/15/69/89/481156989.db2.gz SFWAUSGUYCFYLJ-MJGOQNOKSA-N 1 3 346.519 2.633 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000650556502 481176306 /nfs/dbraw/zinc/17/63/06/481176306.db2.gz OAUAIVPMSHUHKW-GOSISDBHSA-N 1 3 334.508 2.566 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000650556502 481176313 /nfs/dbraw/zinc/17/63/13/481176313.db2.gz OAUAIVPMSHUHKW-GOSISDBHSA-N 1 3 334.508 2.566 10 0 EFAEHO C[NH+](C)CCCC(C)(C)NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659045016 481186203 /nfs/dbraw/zinc/18/62/03/481186203.db2.gz UEFLRHVINSHBRW-KRWDZBQOSA-N 1 3 348.491 2.589 10 0 EFAEHO CCCN(CCC[NH+](C)C)C(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659045826 481187288 /nfs/dbraw/zinc/18/72/88/481187288.db2.gz ZJSOPJOHQAVIGB-GOSISDBHSA-N 1 3 348.491 2.543 10 0 EFAEHO Clc1ccccc1Cn1cc(CN[C@@H]2CC23CC[NH2+]CC3)cn1 ZINC000666950692 481215254 /nfs/dbraw/zinc/21/52/54/481215254.db2.gz BIDUVLUQVNJIKT-QGZVFWFLSA-N 1 3 330.863 2.817 10 0 EFAEHO Fc1cc(CN[C@H]2CC23CC[NH2+]CC3)ccc1OCC(F)(F)F ZINC000666953511 481216445 /nfs/dbraw/zinc/21/64/45/481216445.db2.gz AFLAUXIIMIWFOA-AWEZNQCLSA-N 1 3 332.341 2.999 10 0 EFAEHO CCN(Cc1ccccc1)C(=O)CN1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647974874 481225774 /nfs/dbraw/zinc/22/57/74/481225774.db2.gz ABXGVNDOGJIPCF-VQTJNVASSA-N 1 3 343.515 2.747 10 0 EFAEHO COc1ccc(Cl)c(N2CCN(C[C@@H]3CC[NH2+][C@@H](C)C3)CC2)c1 ZINC000650704233 481271787 /nfs/dbraw/zinc/27/17/87/481271787.db2.gz OPTVDCHBSLLJJE-LSDHHAIUSA-N 1 3 337.895 2.859 10 0 EFAEHO COCCNC1CC[NH+](C[C@H](C)Cc2ccc(OC)c(F)c2)CC1 ZINC000650704775 481273040 /nfs/dbraw/zinc/27/30/40/481273040.db2.gz ZTLGTWQSDLMRAK-OAHLLOKOSA-N 1 3 338.467 2.713 10 0 EFAEHO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCN(Cc3cc(-c4ccccc4)n[nH]3)C2)C1 ZINC000650706635 481275408 /nfs/dbraw/zinc/27/54/08/481275408.db2.gz OVUGWSKSTWULED-HLIPFELVSA-N 1 3 340.471 2.795 10 0 EFAEHO COc1cc(Br)c(CNCCC2(C[NH3+])CC2)c(OC)c1 ZINC000650712448 481283308 /nfs/dbraw/zinc/28/33/08/481283308.db2.gz CWNUMEKFAUJXNG-UHFFFAOYSA-N 1 3 343.265 2.685 10 0 EFAEHO [NH3+]CC1(CCNCc2csc(-c3ccc4c(c3)OCO4)n2)CC1 ZINC000650713330 481283437 /nfs/dbraw/zinc/28/34/37/481283437.db2.gz OZUVMWCKPXPQNO-UHFFFAOYSA-N 1 3 331.441 2.757 10 0 EFAEHO C[NH2+]Cc1ccccc1CNCc1cc(OC)c(OC)c(OC)c1 ZINC000650718240 481287978 /nfs/dbraw/zinc/28/79/78/481287978.db2.gz DOFQMZBSPYOCQK-UHFFFAOYSA-N 1 3 330.428 2.722 10 0 EFAEHO COCCOc1cccc(CN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)c1 ZINC000650722300 481289157 /nfs/dbraw/zinc/28/91/57/481289157.db2.gz OYIJHFOICVYZKD-MISYRCLQSA-N 1 3 348.487 2.573 10 0 EFAEHO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCCN2Cc2cccc3c2OCCCO3)C1 ZINC000650722223 481289556 /nfs/dbraw/zinc/28/95/56/481289556.db2.gz NJUPAWIOCCBPME-AOIWGVFYSA-N 1 3 346.471 2.709 10 0 EFAEHO COCCOc1ccc(CN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)cc1 ZINC000650723926 481291519 /nfs/dbraw/zinc/29/15/19/481291519.db2.gz VXAPWQOEGOHWLG-SXLOBPIMSA-N 1 3 348.487 2.573 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@@H](C)c1ccc2c(c1)OCC(=O)N2 ZINC000650755235 481318422 /nfs/dbraw/zinc/31/84/22/481318422.db2.gz AHRPDVRPJPWDDY-ZDUSSCGKSA-N 1 3 325.412 2.588 10 0 EFAEHO CCN(C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)[C@H]1CC[N@H+](CC)C1 ZINC000664542169 481321652 /nfs/dbraw/zinc/32/16/52/481321652.db2.gz UDUKOLNGYKSBMR-FHWLQOOXSA-N 1 3 344.503 2.558 10 0 EFAEHO CCN(C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)[C@H]1CC[N@@H+](CC)C1 ZINC000664542169 481321658 /nfs/dbraw/zinc/32/16/58/481321658.db2.gz UDUKOLNGYKSBMR-FHWLQOOXSA-N 1 3 344.503 2.558 10 0 EFAEHO C[C@H](NCCC1CC[NH2+]CC1)c1ccc(-n2cncn2)cc1Cl ZINC000650764472 481327015 /nfs/dbraw/zinc/32/70/15/481327015.db2.gz ZQJQGAROGUHVJJ-ZDUSSCGKSA-N 1 3 333.867 2.961 10 0 EFAEHO C[N@H+](CCCNC(=O)C[C@H]1NCc2ccccc21)Cc1ccccc1 ZINC000659283894 481333289 /nfs/dbraw/zinc/33/32/89/481333289.db2.gz CXQYHFQYOUTVAR-HXUWFJFHSA-N 1 3 337.467 2.859 10 0 EFAEHO C[N@@H+](CCCNC(=O)C[C@H]1NCc2ccccc21)Cc1ccccc1 ZINC000659283894 481333302 /nfs/dbraw/zinc/33/33/02/481333302.db2.gz CXQYHFQYOUTVAR-HXUWFJFHSA-N 1 3 337.467 2.859 10 0 EFAEHO [NH3+][C@@H]1CCCCCC[C@H]1C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659368289 481388890 /nfs/dbraw/zinc/38/88/90/481388890.db2.gz OSGAPVKSBVTCQF-KURKYZTESA-N 1 3 331.460 2.584 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)NCC[C@@H]([NH3+])C(C)C)c1ccsc1 ZINC000659433372 481432321 /nfs/dbraw/zinc/43/23/21/481432321.db2.gz BWFCPYZAZKGDPN-HZPDHXFCSA-N 1 3 340.537 2.804 10 0 EFAEHO C[C@@H](CCNC(=O)NC[C@]1(C)CCCN1Cc1ccccc1)[NH+](C)C ZINC000664715547 481434358 /nfs/dbraw/zinc/43/43/58/481434358.db2.gz QAHLJTFYMAHQBM-PXNSSMCTSA-N 1 3 346.519 2.681 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)NCC[C@@H]([NH3+])C(C)C)N2CCCC2)cc1 ZINC000659444727 481439730 /nfs/dbraw/zinc/43/97/30/481439730.db2.gz IQACBYBYCSBIAO-MOPGFXCFSA-N 1 3 346.519 2.805 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N[C@H](CN1CCCCC1)c1ccccc1 ZINC000659457306 481447790 /nfs/dbraw/zinc/44/77/90/481447790.db2.gz YULAMBBXMOWRDF-RTBURBONSA-N 1 3 346.519 2.886 10 0 EFAEHO CC(=O)[C@](C)(O)C[NH+]1CCC2(CCN(Cc3ccccc3)CC2)CC1 ZINC000639725191 481461963 /nfs/dbraw/zinc/46/19/63/481461963.db2.gz ISASRJHWQAYJHF-HXUWFJFHSA-N 1 3 344.499 2.705 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000650995280 481490882 /nfs/dbraw/zinc/49/08/82/481490882.db2.gz CKYDHFUYPNYJMG-RBUKOAKNSA-N 1 3 346.519 2.709 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000650995280 481490890 /nfs/dbraw/zinc/49/08/90/481490890.db2.gz CKYDHFUYPNYJMG-RBUKOAKNSA-N 1 3 346.519 2.709 10 0 EFAEHO Cc1ccccc1CN1CCCN(C(=O)NCC[C@@H]([NH3+])C(C)C)CC1 ZINC000659624107 481520566 /nfs/dbraw/zinc/52/05/66/481520566.db2.gz KDZVBMZTRQDNMG-LJQANCHMSA-N 1 3 346.519 2.586 10 0 EFAEHO C[C@H](C(=O)N1CC[C@H](c2ccc(F)cc2)[C@@H]([NH3+])C1)N1CCCCCC1 ZINC000647093581 481633089 /nfs/dbraw/zinc/63/30/89/481633089.db2.gz OTDCZXUOLUTDMG-LZQZEXGQSA-N 1 3 347.478 2.733 10 0 EFAEHO CC[N@H+](CCCNC(=O)N1CC[C@H](N2CC=CC2)C1)C1CCCCC1 ZINC000651219975 481638068 /nfs/dbraw/zinc/63/80/68/481638068.db2.gz ODCBGGDISTUKEV-IBGZPJMESA-N 1 3 348.535 2.687 10 0 EFAEHO CC[N@@H+](CCCNC(=O)N1CC[C@H](N2CC=CC2)C1)C1CCCCC1 ZINC000651219975 481638074 /nfs/dbraw/zinc/63/80/74/481638074.db2.gz ODCBGGDISTUKEV-IBGZPJMESA-N 1 3 348.535 2.687 10 0 EFAEHO C[C@H]1CCC[N@H+](CCCCNCc2ccnn2-c2ccccn2)C1 ZINC000647171389 481682101 /nfs/dbraw/zinc/68/21/01/481682101.db2.gz IECNDXQMRKTHOS-KRWDZBQOSA-N 1 3 327.476 2.869 10 0 EFAEHO C[C@H]1CCC[N@@H+](CCCCNCc2ccnn2-c2ccccn2)C1 ZINC000647171389 481682116 /nfs/dbraw/zinc/68/21/16/481682116.db2.gz IECNDXQMRKTHOS-KRWDZBQOSA-N 1 3 327.476 2.869 10 0 EFAEHO c1ccc2c(c1)CCC1(CC[NH+](C[C@@H]3CCC4(CNC4)O3)CC1)C2 ZINC000662287429 481690471 /nfs/dbraw/zinc/69/04/71/481690471.db2.gz ZVMKIKYRZSDBGH-IBGZPJMESA-N 1 3 326.484 2.779 10 0 EFAEHO C[C@@H]1CCCC[C@@H]1N(C)C(=O)CN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662294033 481698104 /nfs/dbraw/zinc/69/81/04/481698104.db2.gz AFVWAIZYUVIIPB-QRQLOZEOSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H]1CCC[C@H](NC(=O)CN2CCC[C@@H](C3CC[NH2+]CC3)C2)[C@@H]1C ZINC000662294311 481699984 /nfs/dbraw/zinc/69/99/84/481699984.db2.gz LGRQGWIQGQTHQH-RWQQGDIJSA-N 1 3 335.536 2.639 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)[C@@H]3CCCC4(CC4)C3)CC2)CC1 ZINC000667642090 481705937 /nfs/dbraw/zinc/70/59/37/481705937.db2.gz OCAPAZNJDNRWJU-MRXNPFEDSA-N 1 3 333.520 2.632 10 0 EFAEHO COc1ccc([C@H](NC[C@H]2CCC3(C[NH2+]C3)O2)c2ccccc2)cc1 ZINC000662299628 481706205 /nfs/dbraw/zinc/70/62/05/481706205.db2.gz SPVBKNQCIHQQOP-WOJBJXKFSA-N 1 3 338.451 2.895 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CN(Cc3ccccc3)CC23CCOCC3)CO1 ZINC000647212926 481706530 /nfs/dbraw/zinc/70/65/30/481706530.db2.gz DMGOZANAQRHKNA-MISYRCLQSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)CO1 ZINC000647212926 481706539 /nfs/dbraw/zinc/70/65/39/481706539.db2.gz DMGOZANAQRHKNA-MISYRCLQSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@@H]2C[N@@H+](Cc3ccccc3)CC23CCOCC3)CO1 ZINC000647212926 481706548 /nfs/dbraw/zinc/70/65/48/481706548.db2.gz DMGOZANAQRHKNA-MISYRCLQSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]C[C@H]2CN(Cc3ccccc3)CC23CCOCC3)CO1 ZINC000647212928 481707204 /nfs/dbraw/zinc/70/72/04/481707204.db2.gz DMGOZANAQRHKNA-YZGWKJHDSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)CO1 ZINC000647212928 481707208 /nfs/dbraw/zinc/70/72/08/481707208.db2.gz DMGOZANAQRHKNA-YZGWKJHDSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@H]2C[N@@H+](Cc3ccccc3)CC23CCOCC3)CO1 ZINC000647212928 481707213 /nfs/dbraw/zinc/70/72/13/481707213.db2.gz DMGOZANAQRHKNA-YZGWKJHDSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1CCCN(CC(=O)Nc2cc(F)cc(F)c2)[C@@H]1CCC[NH3+] ZINC000662314906 481718945 /nfs/dbraw/zinc/71/89/45/481718945.db2.gz PTYYKIVDRSMVDF-MLGOLLRUSA-N 1 3 325.403 2.743 10 0 EFAEHO COc1ccc(C[NH2+]C[C@@H]2CN(C)C[C@H]2c2ccccc2)cc1O ZINC000647248659 481727387 /nfs/dbraw/zinc/72/73/87/481727387.db2.gz PRZBQPVJHFMUSF-MSOLQXFVSA-N 1 3 326.440 2.836 10 0 EFAEHO c1c(N2CCNCC2)n[nH]c1[C@@H]1CCC[N@@H+](CCC2CCCCC2)C1 ZINC000662337594 481735629 /nfs/dbraw/zinc/73/56/29/481735629.db2.gz LTACWCWYERXEND-GOSISDBHSA-N 1 3 345.535 2.969 10 0 EFAEHO c1c(N2CCNCC2)n[nH]c1[C@@H]1CCC[N@H+](CCC2CCCCC2)C1 ZINC000662337594 481735639 /nfs/dbraw/zinc/73/56/39/481735639.db2.gz LTACWCWYERXEND-GOSISDBHSA-N 1 3 345.535 2.969 10 0 EFAEHO c1c(N2CCNCC2)n[nH]c1[C@@H]1CCC[N@@H+](CCCC2CCCC2)C1 ZINC000662338493 481736575 /nfs/dbraw/zinc/73/65/75/481736575.db2.gz SFBVQOOYJVFMTC-GOSISDBHSA-N 1 3 345.535 2.969 10 0 EFAEHO c1c(N2CCNCC2)n[nH]c1[C@@H]1CCC[N@H+](CCCC2CCCC2)C1 ZINC000662338493 481736581 /nfs/dbraw/zinc/73/65/81/481736581.db2.gz SFBVQOOYJVFMTC-GOSISDBHSA-N 1 3 345.535 2.969 10 0 EFAEHO c1c([C@H]2CCC[N@@H+](CC3CCCCCC3)C2)[nH]nc1N1CCNCC1 ZINC000662338952 481737156 /nfs/dbraw/zinc/73/71/56/481737156.db2.gz XOUATZZKMWFTNS-SFHVURJKSA-N 1 3 345.535 2.969 10 0 EFAEHO c1c([C@H]2CCC[N@H+](CC3CCCCCC3)C2)[nH]nc1N1CCNCC1 ZINC000662338952 481737163 /nfs/dbraw/zinc/73/71/63/481737163.db2.gz XOUATZZKMWFTNS-SFHVURJKSA-N 1 3 345.535 2.969 10 0 EFAEHO C1CC2(C1)[C@H](N[C@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)C[C@H]2N1CCOCC1 ZINC000665274161 481762339 /nfs/dbraw/zinc/76/23/39/481762339.db2.gz LDGGGZKXZFWRAF-PXTPFGJHSA-N 1 3 347.547 2.530 10 0 EFAEHO C[C@@H]1CCC[C@H]([NH+]2CCC(NCC(C)(C)[C@]3(O)CCOC3)CC2)C1 ZINC000647341649 481768178 /nfs/dbraw/zinc/76/81/78/481768178.db2.gz ZKAXXJOJXDCLQQ-KPFFTGBYSA-N 1 3 338.536 2.797 10 0 EFAEHO C[C@@H]1CCC[C@H](N2CCC([NH2+]CC(C)(C)[C@]3(O)CCOC3)CC2)C1 ZINC000647341649 481768189 /nfs/dbraw/zinc/76/81/89/481768189.db2.gz ZKAXXJOJXDCLQQ-KPFFTGBYSA-N 1 3 338.536 2.797 10 0 EFAEHO C[C@H](CNC(=O)c1ccc2c(c1)[C@@H](C[NH3+])CCC2)N1CCC[C@@H](C)C1 ZINC000662389353 481780138 /nfs/dbraw/zinc/78/01/38/481780138.db2.gz WPTIJUBQQCFABD-GPMSIDNRSA-N 1 3 343.515 2.915 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)NC[C@H]1C[C@@H]([NH+](C)C)C1)c1ccccc1 ZINC000654351397 481812678 /nfs/dbraw/zinc/81/26/78/481812678.db2.gz FTAGDNSDULJRHV-UHOSZYNNSA-N 1 3 346.519 2.709 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000665363880 481821701 /nfs/dbraw/zinc/82/17/01/481821701.db2.gz DURFPNPDGMZLJQ-IRXDYDNUSA-N 1 3 336.524 2.519 10 0 EFAEHO C[NH+](C)CCOc1cccc(NC(=O)NC[C@H]2CCN2C(C)(C)C)c1 ZINC000665366690 481824460 /nfs/dbraw/zinc/82/44/60/481824460.db2.gz FVJZMAUPNVOVED-MRXNPFEDSA-N 1 3 348.491 2.621 10 0 EFAEHO CC(C)[N@H+](C)CC1CCN(C(=O)NC[C@H]2CCN2C(C)(C)C)CC1 ZINC000665366910 481824618 /nfs/dbraw/zinc/82/46/18/481824618.db2.gz LBVVYQOSAXQNIT-QGZVFWFLSA-N 1 3 338.540 2.621 10 0 EFAEHO CC(C)[N@@H+](C)CC1CCN(C(=O)NC[C@H]2CCN2C(C)(C)C)CC1 ZINC000665366910 481824623 /nfs/dbraw/zinc/82/46/23/481824623.db2.gz LBVVYQOSAXQNIT-QGZVFWFLSA-N 1 3 338.540 2.621 10 0 EFAEHO CCN(C(=O)C[C@H]1CC[NH2+]C1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000662501826 481844661 /nfs/dbraw/zinc/84/46/61/481844661.db2.gz DTCDMARUVMIEEC-LMMKCTJWSA-N 1 3 329.488 2.670 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccccc2C[NH+]2CCCCC2)C1 ZINC000654411961 481857288 /nfs/dbraw/zinc/85/72/88/481857288.db2.gz WPKDGOMLPDRWGI-QGZVFWFLSA-N 1 3 329.488 2.631 10 0 EFAEHO c1cc(OCC[NH+]2CCCC2)ccc1CN[C@@H]1CO[C@@H](C2CC2)C1 ZINC000667866445 481858795 /nfs/dbraw/zinc/85/87/95/481858795.db2.gz AXBDGKKYBPWGMT-AZUAARDMSA-N 1 3 330.472 2.818 10 0 EFAEHO C[N@@H+](CCNC(=O)N[C@@H]1CCCN2CCCC[C@@H]12)C1CCCCC1 ZINC000654414881 481860104 /nfs/dbraw/zinc/86/01/04/481860104.db2.gz ZFHQMWSUVIFLAJ-MSOLQXFVSA-N 1 3 336.524 2.567 10 0 EFAEHO C[N@H+](CCNC(=O)N[C@@H]1CCCN2CCCC[C@@H]12)C1CCCCC1 ZINC000654414881 481860097 /nfs/dbraw/zinc/86/00/97/481860097.db2.gz ZFHQMWSUVIFLAJ-MSOLQXFVSA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)N[C@H]1CCCN2CCCC[C@H]12 ZINC000654433732 481869386 /nfs/dbraw/zinc/86/93/86/481869386.db2.gz WGPJNKUBONKPIX-XWTMOSNGSA-N 1 3 336.524 2.565 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N[C@H]1CCCN2CCCC[C@H]12 ZINC000654433732 481869391 /nfs/dbraw/zinc/86/93/91/481869391.db2.gz WGPJNKUBONKPIX-XWTMOSNGSA-N 1 3 336.524 2.565 10 0 EFAEHO C[N@@H+]1CCCC[C@@H]1CCC(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000662684845 481933020 /nfs/dbraw/zinc/93/30/20/481933020.db2.gz JZRSWGNSSQVVTD-QZTJIDSGSA-N 1 3 331.460 2.551 10 0 EFAEHO C[N@H+]1CCCC[C@@H]1CCC(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000662684845 481933026 /nfs/dbraw/zinc/93/30/26/481933026.db2.gz JZRSWGNSSQVVTD-QZTJIDSGSA-N 1 3 331.460 2.551 10 0 EFAEHO C[N@@H+]1CCCC[C@@H]1CCC(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000662684844 481933523 /nfs/dbraw/zinc/93/35/23/481933523.db2.gz JZRSWGNSSQVVTD-MSOLQXFVSA-N 1 3 331.460 2.551 10 0 EFAEHO C[N@H+]1CCCC[C@@H]1CCC(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000662684844 481933530 /nfs/dbraw/zinc/93/35/30/481933530.db2.gz JZRSWGNSSQVVTD-MSOLQXFVSA-N 1 3 331.460 2.551 10 0 EFAEHO CC(C)(C)N1CC[C@@H](NC(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)C1 ZINC000665556566 481934935 /nfs/dbraw/zinc/93/49/35/481934935.db2.gz ZMHIIFOKFQVKLK-IAGOWNOFSA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)(C)N1CC[C@@H](NC(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)C1 ZINC000665556568 481935288 /nfs/dbraw/zinc/93/52/88/481935288.db2.gz ZMHIIFOKFQVKLK-SJORKVTESA-N 1 3 336.524 2.519 10 0 EFAEHO Cc1ccccc1[C@@H]([C@H](C)NC(=O)NC[C@H]1C[C@@H]([NH+](C)C)C1)N(C)C ZINC000654562096 481937357 /nfs/dbraw/zinc/93/73/57/481937357.db2.gz VVYZYXRSTKDQQA-IMBTUZDBSA-N 1 3 346.519 2.626 10 0 EFAEHO Cc1ccccc1[C@H]([C@H](C)NC(=O)NC[C@H]1C[C@@H]([NH+](C)C)C1)N(C)C ZINC000654562095 481937571 /nfs/dbraw/zinc/93/75/71/481937571.db2.gz VVYZYXRSTKDQQA-BMFAXAFESA-N 1 3 346.519 2.626 10 0 EFAEHO C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)C2([NH2+]C3CC3)CCC2)C1 ZINC000662696059 481938619 /nfs/dbraw/zinc/93/86/19/481938619.db2.gz HLBREOBYRCDHTC-YJBOKZPZSA-N 1 3 327.472 2.613 10 0 EFAEHO CC[C@H](C)[C@H](N)C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662710156 481944275 /nfs/dbraw/zinc/94/42/75/481944275.db2.gz DTZMFUHXANWWBN-UHOSZYNNSA-N 1 3 343.515 2.778 10 0 EFAEHO CC[C@H](C)[C@H](N)C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662710156 481944277 /nfs/dbraw/zinc/94/42/77/481944277.db2.gz DTZMFUHXANWWBN-UHOSZYNNSA-N 1 3 343.515 2.778 10 0 EFAEHO C[C@@H]([NH2+]C(C)(C)CNC(=O)C1(N)CC2(CCC2)C1)c1ccccc1 ZINC000662718574 481947037 /nfs/dbraw/zinc/94/70/37/481947037.db2.gz PQKLBLXKTZRNAP-OAHLLOKOSA-N 1 3 329.488 2.894 10 0 EFAEHO C[C@H]([NH2+]C(C)(C)CNC(=O)C1(NC2CC2)CCC1)c1ccccc1 ZINC000662718124 481947097 /nfs/dbraw/zinc/94/70/97/481947097.db2.gz LRZIGWQCMOBQBS-HNNXBMFYSA-N 1 3 329.488 2.907 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)C2(NC3CC3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000662717969 481947127 /nfs/dbraw/zinc/94/71/27/481947127.db2.gz FYPFFYIYWDWVPZ-LPHOPBHVSA-N 1 3 341.499 2.830 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)C2(NC3CC3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000662717969 481947128 /nfs/dbraw/zinc/94/71/28/481947128.db2.gz FYPFFYIYWDWVPZ-LPHOPBHVSA-N 1 3 341.499 2.830 10 0 EFAEHO CC(C)(N)C(=O)N1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000662760412 481961509 /nfs/dbraw/zinc/96/15/09/481961509.db2.gz WLUUUXCKNXPEKF-SFHVURJKSA-N 1 3 343.515 2.873 10 0 EFAEHO C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000660450655 481966646 /nfs/dbraw/zinc/96/66/46/481966646.db2.gz JGUWLSGDZFOUKT-CVEARBPZSA-N 1 3 338.540 2.669 10 0 EFAEHO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000660450655 481966651 /nfs/dbraw/zinc/96/66/51/481966651.db2.gz JGUWLSGDZFOUKT-CVEARBPZSA-N 1 3 338.540 2.669 10 0 EFAEHO C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000660450657 481967011 /nfs/dbraw/zinc/96/70/11/481967011.db2.gz JGUWLSGDZFOUKT-HZPDHXFCSA-N 1 3 338.540 2.669 10 0 EFAEHO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000660450657 481967016 /nfs/dbraw/zinc/96/70/16/481967016.db2.gz JGUWLSGDZFOUKT-HZPDHXFCSA-N 1 3 338.540 2.669 10 0 EFAEHO CCN(Cc1cccs1)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000665637401 481973210 /nfs/dbraw/zinc/97/32/10/481973210.db2.gz BYGWNHQEBWLZQQ-HNNXBMFYSA-N 1 3 340.537 2.552 10 0 EFAEHO CCN(Cc1cccs1)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000665637401 481973214 /nfs/dbraw/zinc/97/32/14/481973214.db2.gz BYGWNHQEBWLZQQ-HNNXBMFYSA-N 1 3 340.537 2.552 10 0 EFAEHO CC(C)(C)CC(C)(C)[NH+]1CCC(NCC[C@@]2(O)CCOC2)CC1 ZINC000651944754 482010624 /nfs/dbraw/zinc/01/06/24/482010624.db2.gz DISJCOQSOVHGTP-LJQANCHMSA-N 1 3 326.525 2.797 10 0 EFAEHO O=C(NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)[C@@H]1CCCCN1 ZINC000662919554 482012111 /nfs/dbraw/zinc/01/21/11/482012111.db2.gz NQWNCFCUEKVTOP-OALUTQOASA-N 1 3 341.499 2.547 10 0 EFAEHO O=C(NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)[C@@H]1CCCCN1 ZINC000662919554 482012114 /nfs/dbraw/zinc/01/21/14/482012114.db2.gz NQWNCFCUEKVTOP-OALUTQOASA-N 1 3 341.499 2.547 10 0 EFAEHO O=C(NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)[C@H]1CCCCN1 ZINC000662919555 482012991 /nfs/dbraw/zinc/01/29/91/482012991.db2.gz NQWNCFCUEKVTOP-RBUKOAKNSA-N 1 3 341.499 2.547 10 0 EFAEHO O=C(NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)[C@H]1CCCCN1 ZINC000662919555 482012995 /nfs/dbraw/zinc/01/29/95/482012995.db2.gz NQWNCFCUEKVTOP-RBUKOAKNSA-N 1 3 341.499 2.547 10 0 EFAEHO CO[C@H](CN1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1)[C@H]1CCOC1 ZINC000660542102 482014613 /nfs/dbraw/zinc/01/46/13/482014613.db2.gz ZYVKCRPLSRBFHY-PWRODBHTSA-N 1 3 344.499 2.636 10 0 EFAEHO CO[C@H](CN1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1)[C@H]1CCOC1 ZINC000660542102 482014617 /nfs/dbraw/zinc/01/46/17/482014617.db2.gz ZYVKCRPLSRBFHY-PWRODBHTSA-N 1 3 344.499 2.636 10 0 EFAEHO O=C(N[C@@H]1CCCN2CCCC[C@@H]12)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000654729644 482017900 /nfs/dbraw/zinc/01/79/00/482017900.db2.gz UQHZZPREFYXHRD-OTWHNJEPSA-N 1 3 348.535 2.663 10 0 EFAEHO CN(Cc1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]3CCCC[C@H]3[NH2+]2)C1 ZINC000649342807 482033781 /nfs/dbraw/zinc/03/37/81/482033781.db2.gz QBEFTSJZDANISB-WTGUMLROSA-N 1 3 341.499 2.640 10 0 EFAEHO CCC[C@H]1CCCCN1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000665761105 482038816 /nfs/dbraw/zinc/03/88/16/482038816.db2.gz XFFZXLSLDGAUGY-IRXDYDNUSA-N 1 3 326.529 2.623 10 0 EFAEHO CCC[C@H]1CCCCN1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000665761105 482038818 /nfs/dbraw/zinc/03/88/18/482038818.db2.gz XFFZXLSLDGAUGY-IRXDYDNUSA-N 1 3 326.529 2.623 10 0 EFAEHO C[C@H](NC(C)(C)CNC(=O)NCCC1(C[NH3+])CC1)c1ccccc1 ZINC000652151210 482099495 /nfs/dbraw/zinc/09/94/95/482099495.db2.gz MGIQJMHNVSMXBW-HNNXBMFYSA-N 1 3 332.492 2.544 10 0 EFAEHO CC(C)CN(C)CCC[NH2+][C@@H]1CCN(Cc2ccccn2)C[C@H]1C ZINC000652221913 482130592 /nfs/dbraw/zinc/13/05/92/482130592.db2.gz AEDXISVTZYFIBQ-UYAOXDASSA-N 1 3 332.536 2.860 10 0 EFAEHO CC(C)CN(C)CCC[NH2+][C@H]1CCN(Cc2ccccn2)C[C@@H]1C ZINC000652221911 482130701 /nfs/dbraw/zinc/13/07/01/482130701.db2.gz AEDXISVTZYFIBQ-ICSRJNTNSA-N 1 3 332.536 2.860 10 0 EFAEHO COc1cc2nccc(N3CCC[C@]4(CC[NH2+]C4)C3)c2cc1OC ZINC000663240149 482133437 /nfs/dbraw/zinc/13/34/37/482133437.db2.gz YKOJKWLDDSYPTB-LJQANCHMSA-N 1 3 327.428 2.832 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCN(C(=O)NCCC2(C[NH3+])CC2)CC1 ZINC000652232954 482137274 /nfs/dbraw/zinc/13/72/74/482137274.db2.gz IBFYEMVOAMQLQF-UHFFFAOYSA-N 1 3 338.540 2.657 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CNC[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663346215 482173980 /nfs/dbraw/zinc/17/39/80/482173980.db2.gz QUILBAYKBYMDKI-SFHVURJKSA-N 1 3 339.487 2.787 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CNC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663346215 482173986 /nfs/dbraw/zinc/17/39/86/482173986.db2.gz QUILBAYKBYMDKI-SFHVURJKSA-N 1 3 339.487 2.787 10 0 EFAEHO COc1ccc(CN(C)Cc2ccc3c(c2)C[NH2+]CC3)cc1OC ZINC000652336884 482178730 /nfs/dbraw/zinc/17/87/30/482178730.db2.gz KAVNDQSAWSQVAG-UHFFFAOYSA-N 1 3 326.440 2.982 10 0 EFAEHO CN(c1ccccc1C[N@@H+]1C[C@@H]2COC[C@]2(C)C1)C1CCN(C)CC1 ZINC000668596073 482182522 /nfs/dbraw/zinc/18/25/22/482182522.db2.gz CUNLHBCSRTVGOG-NQIIRXRSSA-N 1 3 343.515 2.685 10 0 EFAEHO CN(c1ccccc1C[N@H+]1C[C@@H]2COC[C@]2(C)C1)C1CCN(C)CC1 ZINC000668596073 482182525 /nfs/dbraw/zinc/18/25/25/482182525.db2.gz CUNLHBCSRTVGOG-NQIIRXRSSA-N 1 3 343.515 2.685 10 0 EFAEHO CC(C)OC[C@H](O)C[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000663368519 482186648 /nfs/dbraw/zinc/18/66/48/482186648.db2.gz HVGNVLLDJVQODQ-VQTJNVASSA-N 1 3 346.515 2.664 10 0 EFAEHO CC(C)OC[C@H](O)CNC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000663368519 482186651 /nfs/dbraw/zinc/18/66/51/482186651.db2.gz HVGNVLLDJVQODQ-VQTJNVASSA-N 1 3 346.515 2.664 10 0 EFAEHO CC(C)OC[C@H](O)CNC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000663368519 482186655 /nfs/dbraw/zinc/18/66/55/482186655.db2.gz HVGNVLLDJVQODQ-VQTJNVASSA-N 1 3 346.515 2.664 10 0 EFAEHO CCOc1ccccc1OCCN1CCCC[C@@H]1[C@@H]1C[C@H]([NH3+])CCO1 ZINC000652361422 482194048 /nfs/dbraw/zinc/19/40/48/482194048.db2.gz GVBHGCURPURCFL-HLIPFELVSA-N 1 3 348.487 2.825 10 0 EFAEHO C[C@H]1C[N@H+](C[C@H](O)[C@@H](N)Cc2ccccc2)CCc2ccc(F)cc21 ZINC000652364379 482195619 /nfs/dbraw/zinc/19/56/19/482195619.db2.gz LRMOQWZUCQINNH-JHVJFLLYSA-N 1 3 342.458 2.718 10 0 EFAEHO C[C@H]1C[N@@H+](C[C@H](O)[C@@H](N)Cc2ccccc2)CCc2ccc(F)cc21 ZINC000652364379 482195623 /nfs/dbraw/zinc/19/56/23/482195623.db2.gz LRMOQWZUCQINNH-JHVJFLLYSA-N 1 3 342.458 2.718 10 0 EFAEHO Cc1ccccc1[C@@H](C)NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000663396860 482207018 /nfs/dbraw/zinc/20/70/18/482207018.db2.gz SKQWBVBTMRWHGZ-DLBZAZTESA-N 1 3 334.508 2.627 10 0 EFAEHO Cc1ccccc1[C@@H](C)NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000663396860 482207026 /nfs/dbraw/zinc/20/70/26/482207026.db2.gz SKQWBVBTMRWHGZ-DLBZAZTESA-N 1 3 334.508 2.627 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N[C@@H]1CCCc2ccccc21 ZINC000663409571 482215565 /nfs/dbraw/zinc/21/55/65/482215565.db2.gz JZTOGWWUKPXWIY-QFBILLFUSA-N 1 3 346.519 2.635 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N[C@@H]1CCCc2ccccc21 ZINC000663409571 482215576 /nfs/dbraw/zinc/21/55/76/482215576.db2.gz JZTOGWWUKPXWIY-QFBILLFUSA-N 1 3 346.519 2.635 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@@H]3COC[C@H]3C2)CC1 ZINC000668704096 482220521 /nfs/dbraw/zinc/22/05/21/482220521.db2.gz BVWJRKPXBSGKPY-WOJBJXKFSA-N 1 3 343.515 2.687 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@@H]3COC[C@H]3C2)CC1 ZINC000668704096 482220527 /nfs/dbraw/zinc/22/05/27/482220527.db2.gz BVWJRKPXBSGKPY-WOJBJXKFSA-N 1 3 343.515 2.687 10 0 EFAEHO CC[NH+](CC)CCCN1CCO[C@H]2CCN(Cc3ccccc3)C[C@H]21 ZINC000649751334 482228075 /nfs/dbraw/zinc/22/80/75/482228075.db2.gz ITTOFRSHEGUVCU-RTWAWAEBSA-N 1 3 345.531 2.694 10 0 EFAEHO OC1(C[NH2+]C2CCN(c3ccncc3)CC2)CCC(F)(F)CC1 ZINC000668723014 482230846 /nfs/dbraw/zinc/23/08/46/482230846.db2.gz LWRFEFLNBLSLGU-UHFFFAOYSA-N 1 3 325.403 2.580 10 0 EFAEHO CN1CC[C@H](NC(=O)NC[C@@H]2CC[N@@H+]2C(C)(C)C)[C@@H]1c1ccccc1 ZINC000660960921 482245162 /nfs/dbraw/zinc/24/51/62/482245162.db2.gz WYYQHBNWEXHYLF-BZSNNMDCSA-N 1 3 344.503 2.604 10 0 EFAEHO CN1CC[C@H](NC(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)[C@@H]1c1ccccc1 ZINC000660960921 482245167 /nfs/dbraw/zinc/24/51/67/482245167.db2.gz WYYQHBNWEXHYLF-BZSNNMDCSA-N 1 3 344.503 2.604 10 0 EFAEHO [NH3+]C[C@H](NCc1nc2c(s1)CNCC2)c1ccc2ccccc2c1 ZINC000663499477 482265251 /nfs/dbraw/zinc/26/52/51/482265251.db2.gz WHWFHZZGJLHFQK-KRWDZBQOSA-N 1 3 338.480 2.732 10 0 EFAEHO CCN(C(=O)NCc1ccccc1C[NH+]1CCCC1)[C@H]1CCN(C)C1 ZINC000663518007 482276924 /nfs/dbraw/zinc/27/69/24/482276924.db2.gz OCBIIRRCYHKTIW-IBGZPJMESA-N 1 3 344.503 2.518 10 0 EFAEHO CCN(C(=O)NC[C@H](C1CCCCC1)[NH+](C)C)[C@@H]1CCN(CC)C1 ZINC000663629644 482325171 /nfs/dbraw/zinc/32/51/71/482325171.db2.gz PSNXKPLJNSFXTC-QZTJIDSGSA-N 1 3 338.540 2.623 10 0 EFAEHO Cc1ccc([C@H](C)NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000663745944 482372597 /nfs/dbraw/zinc/37/25/97/482372597.db2.gz GVDRVBQRYYODQP-IRXDYDNUSA-N 1 3 334.508 2.627 10 0 EFAEHO Cc1ccc([C@H](C)NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000663745944 482372600 /nfs/dbraw/zinc/37/26/00/482372600.db2.gz GVDRVBQRYYODQP-IRXDYDNUSA-N 1 3 334.508 2.627 10 0 EFAEHO CC(C)(C)N1CCC([NH2+]CCCN2c3ccccc3OCC2=O)CC1 ZINC000181152508 518708108 /nfs/dbraw/zinc/70/81/08/518708108.db2.gz GPSWWZPTOIVIPQ-UHFFFAOYSA-N 1 3 345.487 2.655 10 0 EFAEHO CC(C)(C)[NH+]1CCC(NCCCN2c3ccccc3OCC2=O)CC1 ZINC000181152508 518708111 /nfs/dbraw/zinc/70/81/11/518708111.db2.gz GPSWWZPTOIVIPQ-UHFFFAOYSA-N 1 3 345.487 2.655 10 0 EFAEHO CC(C)[NH+]1CCC(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CC1 ZINC000245699824 519671895 /nfs/dbraw/zinc/67/18/95/519671895.db2.gz ZCVJSSBBZUOLCS-OALUTQOASA-N 1 3 344.503 2.604 10 0 EFAEHO CC(C)[NH+]1CCC(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CC1 ZINC000245699819 519672196 /nfs/dbraw/zinc/67/21/96/519672196.db2.gz ZCVJSSBBZUOLCS-MOPGFXCFSA-N 1 3 344.503 2.604 10 0 EFAEHO CC(C)COC[C@H](O)CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245722878 519758683 /nfs/dbraw/zinc/75/86/83/519758683.db2.gz OYMZLAGZXWFHON-PLACYPQZSA-N 1 3 346.515 2.805 10 0 EFAEHO CC(C)COC[C@H](O)CN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245722878 519758686 /nfs/dbraw/zinc/75/86/86/519758686.db2.gz OYMZLAGZXWFHON-PLACYPQZSA-N 1 3 346.515 2.805 10 0 EFAEHO CC(C)C[C@@H](C[NH+](C)C)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000068224393 519775631 /nfs/dbraw/zinc/77/56/31/519775631.db2.gz SDKZEPOZENXRFZ-IBGZPJMESA-N 1 3 331.504 2.989 10 0 EFAEHO CCC(=O)N1CC[C@@H](N[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000245781350 521138953 /nfs/dbraw/zinc/13/89/53/521138953.db2.gz YWUIVIFAAYUIOL-YSTOQKLRSA-N 1 3 341.499 2.783 10 0 EFAEHO CCC(=O)N1CC[C@@H](N[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000245781350 521138956 /nfs/dbraw/zinc/13/89/56/521138956.db2.gz YWUIVIFAAYUIOL-YSTOQKLRSA-N 1 3 341.499 2.783 10 0 EFAEHO CC[N@H+](Cc1ccc(C(=O)N2CCN3CCC[C@H]3C2)cc1)C(C)C ZINC000245201047 521301556 /nfs/dbraw/zinc/30/15/56/521301556.db2.gz FAYVMEVRTNEUOT-IBGZPJMESA-N 1 3 329.488 2.837 10 0 EFAEHO CC[N@@H+](Cc1ccc(C(=O)N2CCN3CCC[C@H]3C2)cc1)C(C)C ZINC000245201047 521301563 /nfs/dbraw/zinc/30/15/63/521301563.db2.gz FAYVMEVRTNEUOT-IBGZPJMESA-N 1 3 329.488 2.837 10 0 EFAEHO CCN1CCC[C@@H]1CN(C)C(=O)NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000177399987 521629544 /nfs/dbraw/zinc/62/95/44/521629544.db2.gz ISHYMTAMOOMGNE-ZWKOTPCHSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN1CCC[C@@H]1CN(C)C(=O)NCCCC[N@H+]1CCCC[C@@H]1C ZINC000177399987 521629551 /nfs/dbraw/zinc/62/95/51/521629551.db2.gz ISHYMTAMOOMGNE-ZWKOTPCHSA-N 1 3 338.540 2.767 10 0 EFAEHO COc1cc(CN2CCC(C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)ccc1O ZINC000180071116 522369877 /nfs/dbraw/zinc/36/98/77/522369877.db2.gz IIBUJHCQPFBOHB-HZPDHXFCSA-N 1 3 348.487 2.722 10 0 EFAEHO CN1CCC[C@@H](CNC(=O)C2CC[NH+](C)CC2)[C@H]1c1cccs1 ZINC000073959222 523749861 /nfs/dbraw/zinc/74/98/61/523749861.db2.gz YSKAJASMALQHDQ-RDJZCZTQSA-N 1 3 335.517 2.589 10 0 EFAEHO Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)C[N@@H+]1C[C@H]2CN(C)C[C@H]2C1 ZINC000193636722 524200633 /nfs/dbraw/zinc/20/06/33/524200633.db2.gz WLTPLTGXGAVNAJ-SCTDSRPQSA-N 1 3 346.515 2.526 10 0 EFAEHO Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)C[N@H+]1C[C@H]2CN(C)C[C@H]2C1 ZINC000193636722 524200640 /nfs/dbraw/zinc/20/06/40/524200640.db2.gz WLTPLTGXGAVNAJ-SCTDSRPQSA-N 1 3 346.515 2.526 10 0 EFAEHO Cc1cc(C)cc(OC[C@@H](O)CN2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000193081108 524450566 /nfs/dbraw/zinc/45/05/66/524450566.db2.gz HSBXPXXLAVEFSZ-FQEVSTJZSA-N 1 3 346.515 2.851 10 0 EFAEHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1Nc1ccc(OC2CCN(C)CC2)nc1 ZINC000179744187 524913501 /nfs/dbraw/zinc/91/35/01/524913501.db2.gz VZQMNBGJBBBMLQ-RKVPGOIHSA-N 1 3 332.492 2.695 10 0 EFAEHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1Nc1ccc(OC2CCN(C)CC2)nc1 ZINC000179744187 524913506 /nfs/dbraw/zinc/91/35/06/524913506.db2.gz VZQMNBGJBBBMLQ-RKVPGOIHSA-N 1 3 332.492 2.695 10 0 EFAEHO C[C@H]([NH2+][C@H]1Cc2ccccc2[C@H]1O)c1cccc(OCCN(C)C)c1 ZINC000248005518 525639868 /nfs/dbraw/zinc/63/98/68/525639868.db2.gz KVBWEYIUTCUTDL-ONGXBYRLSA-N 1 3 340.467 2.936 10 0 EFAEHO CSC[C@H](CCO)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245704892 525699822 /nfs/dbraw/zinc/69/98/22/525699822.db2.gz MHHBTBXORAUYAA-CADBVGFASA-N 1 3 334.529 2.886 10 0 EFAEHO CSC[C@H](CCO)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245704892 525699836 /nfs/dbraw/zinc/69/98/36/525699836.db2.gz MHHBTBXORAUYAA-CADBVGFASA-N 1 3 334.529 2.886 10 0 EFAEHO CCCN1CCN(c2ccccc2CN(C)CC[NH+]2CCCC2)CC1 ZINC000349026553 534934564 /nfs/dbraw/zinc/93/45/64/534934564.db2.gz GXAKXGDTAFGJEX-UHFFFAOYSA-N 1 3 344.547 2.746 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H](OC)C(C)C)CC1 ZINC000344710092 534937826 /nfs/dbraw/zinc/93/78/26/534937826.db2.gz FNOFVTAWESOXDY-HXUWFJFHSA-N 1 3 333.520 2.979 10 0 EFAEHO CC(C)[NH+]1CCC(O)(CNCc2cnc(-c3ccccn3)s2)CC1 ZINC000344674084 535164568 /nfs/dbraw/zinc/16/45/68/535164568.db2.gz PAMOLUAVDFAIOB-UHFFFAOYSA-N 1 3 346.500 2.530 10 0 EFAEHO CCCN(C(=O)N[C@H](C)[C@H](C)[NH3+])[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000418711212 535225540 /nfs/dbraw/zinc/22/55/40/535225540.db2.gz WEJARSTZEFFNIA-YQVWRLOYSA-N 1 3 346.519 2.808 10 0 EFAEHO CCCN(C(=O)N[C@H](C)[C@H](C)[NH3+])[C@H]1CCCN(Cc2ccccc2)C1 ZINC000418711211 535225758 /nfs/dbraw/zinc/22/57/58/535225758.db2.gz WEJARSTZEFFNIA-SCTDSRPQSA-N 1 3 346.519 2.808 10 0 EFAEHO CC[NH+](CC)CC1CCN(Cc2cc(=O)n3cccc(C)c3n2)CC1 ZINC000343554141 535497130 /nfs/dbraw/zinc/49/71/30/535497130.db2.gz GCMMTOVNXFQEGM-UHFFFAOYSA-N 1 3 342.487 2.557 10 0 EFAEHO CC[NH+](CC)[C@@H](CNC(=O)N(C)[C@H]1CCN(C2CC2)C1)CC(C)C ZINC000349753349 535654943 /nfs/dbraw/zinc/65/49/43/535654943.db2.gz CKULADHYZFBUCK-ZWKOTPCHSA-N 1 3 338.540 2.621 10 0 EFAEHO CC[NH+](CC)[C@@H](CNC(=O)N(C)[C@@H]1CCN(C2CC2)C1)CC(C)C ZINC000349753347 535655661 /nfs/dbraw/zinc/65/56/61/535655661.db2.gz CKULADHYZFBUCK-QZTJIDSGSA-N 1 3 338.540 2.621 10 0 EFAEHO COC1(C[C@@H](C)[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCC1 ZINC000414303709 536693179 /nfs/dbraw/zinc/69/31/79/536693179.db2.gz LWNNYJDWLUCSNQ-GOSISDBHSA-N 1 3 346.515 2.951 10 0 EFAEHO Cn1cc(CCC[NH2+][C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cn1 ZINC000313990617 545809696 /nfs/dbraw/zinc/80/96/96/545809696.db2.gz NWLYDBULEMKORP-QHAWAJNXSA-N 1 3 338.499 2.853 10 0 EFAEHO CO[C@H]1CCC[C@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)C1 ZINC000397533438 546170587 /nfs/dbraw/zinc/17/05/87/546170587.db2.gz GDDHDASPFJZYIL-OALUTQOASA-N 1 3 332.488 2.561 10 0 EFAEHO C[C@]1(CNC(=O)N[C@@H]2CCC[C@H]([NH3+])C2)CCCN1Cc1ccccc1 ZINC000418046780 546212753 /nfs/dbraw/zinc/21/27/53/546212753.db2.gz RBWCFLIUZXSFGU-NLWGTHIKSA-N 1 3 344.503 2.610 10 0 EFAEHO C[C@@H]1CCC[N@@H+]1Cc1cccc(-c2cnc(N3CCNCC3)nc2)c1 ZINC000630051846 546416342 /nfs/dbraw/zinc/41/63/42/546416342.db2.gz RZWJXPMOKWLQBH-MRXNPFEDSA-N 1 3 337.471 2.538 10 0 EFAEHO C[C@@H]1CCC[N@H+]1Cc1cccc(-c2cnc(N3CCNCC3)nc2)c1 ZINC000630051846 546416346 /nfs/dbraw/zinc/41/63/46/546416346.db2.gz RZWJXPMOKWLQBH-MRXNPFEDSA-N 1 3 337.471 2.538 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](CNCc2c(Cl)cccc2N2CCOCC2)C1 ZINC000655827749 546602561 /nfs/dbraw/zinc/60/25/61/546602561.db2.gz ZGLWJYDFXDLKJI-GASCZTMLSA-N 1 3 337.895 2.606 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](CNC(=O)Nc2cc(CN)cc(C(F)(F)F)c2)C1 ZINC000655909316 546633823 /nfs/dbraw/zinc/63/38/23/546633823.db2.gz GOVHDHAKADHNLK-VDISTLRHSA-N 1 3 344.381 2.626 10 0 EFAEHO c1c(CC[NH+]2CCCCC2)nnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000656455645 546807118 /nfs/dbraw/zinc/80/71/18/546807118.db2.gz LIXBWKHEQGWVRG-FQEVSTJZSA-N 1 3 339.487 2.754 10 0 EFAEHO COc1ccc(CN2CCC[C@H](C3CC[NH2+]CC3)C2)c(OC)c1OC ZINC000656784397 546923513 /nfs/dbraw/zinc/92/35/13/546923513.db2.gz DATRZVALURVLOQ-INIZCTEOSA-N 1 3 348.487 2.924 10 0 EFAEHO COc1cc(OC)c(OC)cc1CN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656786221 546923965 /nfs/dbraw/zinc/92/39/65/546923965.db2.gz PYBFAHJCBMWWDJ-MRXNPFEDSA-N 1 3 348.487 2.924 10 0 EFAEHO COc1cc(CN2CCC([C@H]3CCC[NH2+]C3)CC2)cc2c1OCCO2 ZINC000656786965 546924284 /nfs/dbraw/zinc/92/42/84/546924284.db2.gz YIVNHDRMDFTAOL-KRWDZBQOSA-N 1 3 346.471 2.678 10 0 EFAEHO C[C@H]1CCC[C@@](C[NH2+]Cc2ccnn2-c2ccncc2)(N(C)C)C1 ZINC000657327805 547112735 /nfs/dbraw/zinc/11/27/35/547112735.db2.gz YNLJHPNSBHBRBM-QFBILLFUSA-N 1 3 327.476 2.867 10 0 EFAEHO c1cc(CNC[C@H]2CC[N@H+](Cc3ccccc3)C2)n(-c2ccncc2)n1 ZINC000657452805 547168867 /nfs/dbraw/zinc/16/88/67/547168867.db2.gz JXGPIYOIWVGGLN-LJQANCHMSA-N 1 3 347.466 2.879 10 0 EFAEHO c1cc(CNC[C@H]2CC[N@@H+](Cc3ccccc3)C2)n(-c2ccncc2)n1 ZINC000657452805 547168870 /nfs/dbraw/zinc/16/88/70/547168870.db2.gz JXGPIYOIWVGGLN-LJQANCHMSA-N 1 3 347.466 2.879 10 0 EFAEHO c1cc(C[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)n(-c2ccncc2)n1 ZINC000657452805 547168873 /nfs/dbraw/zinc/16/88/73/547168873.db2.gz JXGPIYOIWVGGLN-LJQANCHMSA-N 1 3 347.466 2.879 10 0 EFAEHO c1cc(CNC[C@@H]2CC[N@H+](Cc3ccccc3)C2)n(-c2ccncc2)n1 ZINC000657452803 547169391 /nfs/dbraw/zinc/16/93/91/547169391.db2.gz JXGPIYOIWVGGLN-IBGZPJMESA-N 1 3 347.466 2.879 10 0 EFAEHO c1cc(CNC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)n(-c2ccncc2)n1 ZINC000657452803 547169393 /nfs/dbraw/zinc/16/93/93/547169393.db2.gz JXGPIYOIWVGGLN-IBGZPJMESA-N 1 3 347.466 2.879 10 0 EFAEHO c1cc(C[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)n(-c2ccncc2)n1 ZINC000657452803 547169399 /nfs/dbraw/zinc/16/93/99/547169399.db2.gz JXGPIYOIWVGGLN-IBGZPJMESA-N 1 3 347.466 2.879 10 0 EFAEHO Cc1ccc2nc(CNCC3CC[NH+](C4CCOCC4)CC3)cn2c1 ZINC000657538315 547196312 /nfs/dbraw/zinc/19/63/12/547196312.db2.gz YWTHNPUPRHQJRW-UHFFFAOYSA-N 1 3 342.487 2.623 10 0 EFAEHO C(NCC1CC[NH+](C2CCOCC2)CC1)c1nc2c(s1)CCC2 ZINC000657535945 547196579 /nfs/dbraw/zinc/19/65/79/547196579.db2.gz UKUIYTUPCPEOCY-UHFFFAOYSA-N 1 3 335.517 2.612 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1ccccc1Br ZINC000657573314 547211792 /nfs/dbraw/zinc/21/17/92/547211792.db2.gz IYUGLDCGZCXKBB-AWEZNQCLSA-N 1 3 342.325 2.811 10 0 EFAEHO Cc1nn(-c2ccccc2)cc1CN[C@@H](C)CN(C)CCC[NH+](C)C ZINC000657573950 547212310 /nfs/dbraw/zinc/21/23/10/547212310.db2.gz QUHSTCVGYVWOSE-KRWDZBQOSA-N 1 3 343.519 2.542 10 0 EFAEHO CO[C@@H]1CCC[C@H]([C@@H](CO)[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000657576447 547214510 /nfs/dbraw/zinc/21/45/10/547214510.db2.gz KYSZOBNDAMVWJJ-PWIZWCRZSA-N 1 3 338.536 2.939 10 0 EFAEHO CO[C@@H]1CCC[C@H]([C@@H](CO)NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000657576447 547214515 /nfs/dbraw/zinc/21/45/15/547214515.db2.gz KYSZOBNDAMVWJJ-PWIZWCRZSA-N 1 3 338.536 2.939 10 0 EFAEHO CCC1(C[NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)CCOCC1 ZINC000657594448 547221700 /nfs/dbraw/zinc/22/17/00/547221700.db2.gz AJLISRFEIJHKPP-LJQANCHMSA-N 1 3 332.488 2.550 10 0 EFAEHO COc1cc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)ccc1C ZINC000657595177 547221763 /nfs/dbraw/zinc/22/17/63/547221763.db2.gz FTPMQGUESQYGDL-FQEVSTJZSA-N 1 3 340.467 2.860 10 0 EFAEHO COc1cc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)ccc1C ZINC000657595177 547221768 /nfs/dbraw/zinc/22/17/68/547221768.db2.gz FTPMQGUESQYGDL-FQEVSTJZSA-N 1 3 340.467 2.860 10 0 EFAEHO COCc1ccc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000657595904 547223086 /nfs/dbraw/zinc/22/30/86/547223086.db2.gz SLURNJKFOZOLEF-OAQYLSRUSA-N 1 3 340.467 2.689 10 0 EFAEHO COCc1ccc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000657595904 547223089 /nfs/dbraw/zinc/22/30/89/547223089.db2.gz SLURNJKFOZOLEF-OAQYLSRUSA-N 1 3 340.467 2.689 10 0 EFAEHO O[C@H]1C[C@@H](NCc2ccc(OCC[NH+]3CCCC3)cc2)C12CCC2 ZINC000657703303 547258620 /nfs/dbraw/zinc/25/86/20/547258620.db2.gz MZCXQONEUPCSMG-MOPGFXCFSA-N 1 3 330.472 2.554 10 0 EFAEHO CN(c1ccccc1CN[C@@H]1C[C@@H](O)C12CCC2)C1CC[NH+](C)CC1 ZINC000657704209 547258646 /nfs/dbraw/zinc/25/86/46/547258646.db2.gz DVOXSIJVPMLVGS-WOJBJXKFSA-N 1 3 343.515 2.610 10 0 EFAEHO C[C@@H]1CN(C)C[C@H]1[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000657773055 547281161 /nfs/dbraw/zinc/28/11/61/547281161.db2.gz PVUPLTKGZNNTPK-MISYRCLQSA-N 1 3 327.516 2.828 10 0 EFAEHO Cc1cc(C)n2c(CNCC3CC[NH+](CC4CC4)CC3)cnc2n1 ZINC000657813244 547292417 /nfs/dbraw/zinc/29/24/17/547292417.db2.gz LPPAWDUNUBGREN-UHFFFAOYSA-N 1 3 327.476 2.558 10 0 EFAEHO C[C@H](O)[C@@H](NCc1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000657820391 547294814 /nfs/dbraw/zinc/29/48/14/547294814.db2.gz VUOLBYBAGBJQCG-OXJNMPFZSA-N 1 3 328.456 2.839 10 0 EFAEHO C[C@H]([NH2+]CCCN1CCN(c2ccncc2)CC1)C(C)(C)C(F)F ZINC000657863579 547305104 /nfs/dbraw/zinc/30/51/04/547305104.db2.gz LASLOFRVWSHHDA-HNNXBMFYSA-N 1 3 340.462 2.863 10 0 EFAEHO COC[C@H](CC1CCOCC1)[NH2+]CC1CCN(c2ccncc2)CC1 ZINC000657908082 547315008 /nfs/dbraw/zinc/31/50/08/547315008.db2.gz FLFJNKGZNWKDPE-IBGZPJMESA-N 1 3 347.503 2.719 10 0 EFAEHO COC[C@@H](CC1CCOCC1)[NH2+]CC1CCN(c2ccncc2)CC1 ZINC000657908083 547315028 /nfs/dbraw/zinc/31/50/28/547315028.db2.gz FLFJNKGZNWKDPE-LJQANCHMSA-N 1 3 347.503 2.719 10 0 EFAEHO Cc1ncc([C@H](C)NCC2CC[NH+](C3CCOCC3)CC2)c(C)n1 ZINC000658067903 547346841 /nfs/dbraw/zinc/34/68/41/547346841.db2.gz RQBUXGBETGBFIM-AWEZNQCLSA-N 1 3 332.492 2.635 10 0 EFAEHO CC(=O)Nc1cccc([C@H](C)N[C@@H](C)CN(C)CCC[NH+](C)C)c1 ZINC000658106316 547357445 /nfs/dbraw/zinc/35/74/45/547357445.db2.gz BGHXHNQBUPSOOB-HOTGVXAUSA-N 1 3 334.508 2.568 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)N[C@@H]1CCc2c1c(F)ccc2F ZINC000658108290 547358307 /nfs/dbraw/zinc/35/83/07/547358307.db2.gz QMHQVXKZQRUORC-SUMWQHHRSA-N 1 3 325.447 2.814 10 0 EFAEHO COc1cc([C@@H](C)N[C@@H](C)CN(C)CCC[NH+](C)C)ccc1F ZINC000658109273 547359465 /nfs/dbraw/zinc/35/94/65/547359465.db2.gz UYQWPQCIZAICMX-LSDHHAIUSA-N 1 3 325.472 2.757 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)C12CCC2 ZINC000658135899 547366599 /nfs/dbraw/zinc/36/65/99/547366599.db2.gz FUABOJKXUPJLPD-SLFFLAALSA-N 1 3 344.499 2.691 10 0 EFAEHO CC1(C)C[C@@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)C(C)(C)O1 ZINC000658138709 547367349 /nfs/dbraw/zinc/36/73/49/547367349.db2.gz JYKBXZDQKBBJMI-ZWKOTPCHSA-N 1 3 332.488 2.689 10 0 EFAEHO CC[C@@H]([NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1)C1CCOCC1 ZINC000658137559 547367999 /nfs/dbraw/zinc/36/79/99/547367999.db2.gz HKTRYRWQBXQJCS-WOJBJXKFSA-N 1 3 332.488 2.548 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1)C1CCSCC1 ZINC000658142562 547370048 /nfs/dbraw/zinc/37/00/48/547370048.db2.gz YOPVAKCFTLEALS-BEFAXECRSA-N 1 3 334.529 2.875 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(N[C@@H]2C[C@H](O)C23CCC3)CC1 ZINC000658248947 547397070 /nfs/dbraw/zinc/39/70/70/547397070.db2.gz GXQYNEGUZNCOFZ-AHRSYUTCSA-N 1 3 328.500 2.975 10 0 EFAEHO Cc1cncc(CC[NH2+][C@H](C)c2ccc(OCCN(C)C)cc2)n1 ZINC000658263314 547400666 /nfs/dbraw/zinc/40/06/66/547400666.db2.gz ZZDJZJXVROMAMO-MRXNPFEDSA-N 1 3 328.460 2.619 10 0 EFAEHO CC[C@@H](CN1CCCC1)NC(=O)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000675197347 548228165 /nfs/dbraw/zinc/22/81/65/548228165.db2.gz MVDACVYRQLBVMO-ZWKOTPCHSA-N 1 3 336.524 2.521 10 0 EFAEHO CC[C@@H](CN1CCCC1)NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C(C)C ZINC000675199536 548229072 /nfs/dbraw/zinc/22/90/72/548229072.db2.gz KJWRQMWKSAGPGH-KSZLIROESA-N 1 3 336.524 2.518 10 0 EFAEHO CC[C@@H](CN1CCCC1)NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000675199536 548229078 /nfs/dbraw/zinc/22/90/78/548229078.db2.gz KJWRQMWKSAGPGH-KSZLIROESA-N 1 3 336.524 2.518 10 0 EFAEHO COC1CCN(CC[NH2+][C@@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1 ZINC000675929454 548377389 /nfs/dbraw/zinc/37/73/89/548377389.db2.gz FAONKHRMDJFZFI-WIYYLYMNSA-N 1 3 345.531 2.597 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)c1ccc(OCC[NH+]2CCCC2)cc1)N(C)C ZINC000676404599 548468603 /nfs/dbraw/zinc/46/86/03/548468603.db2.gz YREQPMAWQWFLDO-LJQANCHMSA-N 1 3 347.503 2.710 10 0 EFAEHO CC[C@H](C[NH+]1CCCC1)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000677577216 548728480 /nfs/dbraw/zinc/72/84/80/548728480.db2.gz LLZLLZJQQLVEPQ-CEXWTWQISA-N 1 3 344.503 2.605 10 0 EFAEHO CN(C)CCOc1ccc(C[N@@H+]2CCC[C@H]([C@H]3CCOC3)C2)cc1 ZINC000678339567 548903570 /nfs/dbraw/zinc/90/35/70/548903570.db2.gz PFACNSCLIYFNOM-OALUTQOASA-N 1 3 332.488 2.876 10 0 EFAEHO CN(C)CCOc1ccc(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)cc1 ZINC000678339567 548903572 /nfs/dbraw/zinc/90/35/72/548903572.db2.gz PFACNSCLIYFNOM-OALUTQOASA-N 1 3 332.488 2.876 10 0 EFAEHO O=C(CN[C@H](CC1CC1)c1ccccc1)NC1CC[NH+](C2CC2)CC1 ZINC000678776800 548985696 /nfs/dbraw/zinc/98/56/96/548985696.db2.gz JJMLFFZXHIGPPR-HXUWFJFHSA-N 1 3 341.499 2.860 10 0 EFAEHO C[C@@H]1CN(C)C[C@@H]1[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000679721422 549190604 /nfs/dbraw/zinc/19/06/04/549190604.db2.gz NUYWWMUINNIOHH-MLZLACJZSA-N 1 3 327.516 2.827 10 0 EFAEHO C[C@H]1CN(Cc2cccc3cnccc32)CC[C@@H]1[NH+]1CCN(C)CC1 ZINC000679990842 549234211 /nfs/dbraw/zinc/23/42/11/549234211.db2.gz RUTXQJKCKOXBCX-UWJYYQICSA-N 1 3 338.499 2.693 10 0 EFAEHO CN(C)CCOc1ccc(C[NH2+]CC2(CO)CC3(CCC3)C2)cc1 ZINC000683932700 549966047 /nfs/dbraw/zinc/96/60/47/549966047.db2.gz NKQDNWLHOCBINN-UHFFFAOYSA-N 1 3 332.488 2.659 10 0 EFAEHO CN(C)CCOc1ccc(CNC2CC([NH+]3CCCCC3)C2)cc1 ZINC000684425796 550038740 /nfs/dbraw/zinc/03/87/40/550038740.db2.gz RNWZVUOEPZNJRC-UHFFFAOYSA-N 1 3 331.504 2.734 10 0 EFAEHO C[C@H](CNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)[NH+]1CCCCC1 ZINC000758849501 575878717 /nfs/dbraw/zinc/87/87/17/575878717.db2.gz KKYMWAGYSGCWSE-BHIYHBOVSA-N 1 3 344.503 2.605 10 0 EFAEHO CC(C)Oc1cccc(C[NH2+]CCN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001691345845 1248678531 /nfs/dbraw/zinc/67/85/31/1248678531.db2.gz KPKKDEWAULWOFN-UHFFFAOYSA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1cc(CNCCN(C)C(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)cs1 ZINC001691359736 1248694172 /nfs/dbraw/zinc/69/41/72/1248694172.db2.gz CYXWUWPPAUZOCM-SJORKVTESA-N 1 3 335.517 2.621 10 0 EFAEHO Cc1cc(CNCCN(C)C(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)cs1 ZINC001691359736 1248694183 /nfs/dbraw/zinc/69/41/83/1248694183.db2.gz CYXWUWPPAUZOCM-SJORKVTESA-N 1 3 335.517 2.621 10 0 EFAEHO C[C@@H]1CCN(C(=O)Cc2c[nH]cn2)[C@H](C[NH2+]CCC2CCCC2)C1 ZINC001691372483 1248705209 /nfs/dbraw/zinc/70/52/09/1248705209.db2.gz GTKRIXMJFIPNKY-QAPCUYQASA-N 1 3 332.492 2.749 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN1CC[C@H](C)C1 ZINC001691370450 1248705800 /nfs/dbraw/zinc/70/58/00/1248705800.db2.gz QUCXJAWHEXJJQV-ITVKQWQRSA-N 1 3 335.536 2.901 10 0 EFAEHO CN(CC[NH2+]CCCC1CCC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001691476571 1249198231 /nfs/dbraw/zinc/19/82/31/1249198231.db2.gz MJKGLGVTTFTHOH-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]CCCc2cccc(C)c2)C1)N(C)C ZINC001266725832 1248240078 /nfs/dbraw/zinc/24/00/78/1248240078.db2.gz WASPIABSIOSKNK-OTWHNJEPSA-N 1 3 331.504 2.505 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001691159980 1248486867 /nfs/dbraw/zinc/48/68/67/1248486867.db2.gz PIYWPZKRINQQDQ-APWZRJJASA-N 1 3 341.515 2.827 10 0 EFAEHO CCCCC[N@H+]1CC[C@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001691159980 1248486875 /nfs/dbraw/zinc/48/68/75/1248486875.db2.gz PIYWPZKRINQQDQ-APWZRJJASA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1cc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cnc1Cl ZINC000850357652 1250447500 /nfs/dbraw/zinc/44/75/00/1250447500.db2.gz QOSXXMPTUHPRAF-SFHVURJKSA-N 1 3 345.874 2.900 10 0 EFAEHO Cc1cc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)cnc1Cl ZINC000850357652 1250447507 /nfs/dbraw/zinc/44/75/07/1250447507.db2.gz QOSXXMPTUHPRAF-SFHVURJKSA-N 1 3 345.874 2.900 10 0 EFAEHO COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC(=O)N2)cc1CN1CCCCC1 ZINC000850546973 1250530215 /nfs/dbraw/zinc/53/02/15/1250530215.db2.gz PSOCCUTVGLDDGW-QAPCUYQASA-N 1 3 345.487 2.610 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@@H]2C1 ZINC001691557808 1251768285 /nfs/dbraw/zinc/76/82/85/1251768285.db2.gz IHISIOSYCJLWLI-MSOLQXFVSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCCCC[N@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@@H]2C1 ZINC001691557808 1251768289 /nfs/dbraw/zinc/76/82/89/1251768289.db2.gz IHISIOSYCJLWLI-MSOLQXFVSA-N 1 3 335.536 2.831 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@H]2CCC[C@@H]([NH+](C)C)C2)cc1F ZINC001691556289 1251769894 /nfs/dbraw/zinc/76/98/94/1251769894.db2.gz STKLZGULLXEPKG-ZWKOTPCHSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001691556547 1251771348 /nfs/dbraw/zinc/77/13/48/1251771348.db2.gz UZWZEBHPEVQFBN-APWZRJJASA-N 1 3 349.494 2.803 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]Cc1ccc(C)c(C)c1 ZINC001691622965 1251840621 /nfs/dbraw/zinc/84/06/21/1251840621.db2.gz GLGXZYRKGSXSHR-IBGZPJMESA-N 1 3 331.504 2.726 10 0 EFAEHO CC(C)(C(=O)N1CCCCC[C@@H]([NH2+]CCCF)C1)N1CCCC1 ZINC001691625236 1251847109 /nfs/dbraw/zinc/84/71/09/1251847109.db2.gz DVYXMPMAUSHKJU-MRXNPFEDSA-N 1 3 327.488 2.581 10 0 EFAEHO CCCC[N@@H+]1CC[C@](C)(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001484059251 1252124312 /nfs/dbraw/zinc/12/43/12/1252124312.db2.gz XRBOQPBXEUGRFJ-ZWKOTPCHSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCC[N@H+]1CC[C@](C)(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001484059251 1252124321 /nfs/dbraw/zinc/12/43/21/1252124321.db2.gz XRBOQPBXEUGRFJ-ZWKOTPCHSA-N 1 3 327.488 2.580 10 0 EFAEHO CCc1ccccc1[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]CC(C)C ZINC001484322031 1252389589 /nfs/dbraw/zinc/38/95/89/1252389589.db2.gz AAJAURPYWZVYQJ-PXNSSMCTSA-N 1 3 345.531 2.994 10 0 EFAEHO C[C@@H]([NH2+]CCCC1CCC1)[C@H]1CCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001484338528 1252424067 /nfs/dbraw/zinc/42/40/67/1252424067.db2.gz LDYAUTQCWZCIIS-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001484357963 1252451426 /nfs/dbraw/zinc/45/14/26/1252451426.db2.gz KHGJILVUBOOGGU-AZUAARDMSA-N 1 3 345.531 2.704 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CC[C@H](C[NH2+]CCF)CC1)N1CCCCCC1 ZINC001484396596 1252519694 /nfs/dbraw/zinc/51/96/94/1252519694.db2.gz HYVGYJKPEOILCL-BZSNNMDCSA-N 1 3 341.515 2.733 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)c(C)s1 ZINC001484512938 1252738216 /nfs/dbraw/zinc/73/82/16/1252738216.db2.gz ZYYBRJXSLYOUEG-WMZOPIPTSA-N 1 3 349.544 2.787 10 0 EFAEHO Cc1ccc(CC[N@H+]2CCC[C@H](NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001484728369 1252819989 /nfs/dbraw/zinc/81/99/89/1252819989.db2.gz NGGOZHBAXGSCBA-FQEVSTJZSA-N 1 3 345.531 2.848 10 0 EFAEHO Cc1ccc(CC[N@@H+]2CCC[C@H](NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001484728369 1252819993 /nfs/dbraw/zinc/81/99/93/1252819993.db2.gz NGGOZHBAXGSCBA-FQEVSTJZSA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@H](F)CC[N@H+](C)CCCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001484758298 1252929861 /nfs/dbraw/zinc/92/98/61/1252929861.db2.gz BKTNKXCMZGFXNA-YJBOKZPZSA-N 1 3 347.494 2.727 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)CCCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001484758298 1252929882 /nfs/dbraw/zinc/92/98/82/1252929882.db2.gz BKTNKXCMZGFXNA-YJBOKZPZSA-N 1 3 347.494 2.727 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001273018515 1265825844 /nfs/dbraw/zinc/82/58/44/1265825844.db2.gz KXNQPUVHLACRKZ-YPMHNXCESA-N 1 3 331.913 2.726 10 0 EFAEHO C[C@H](CC[NH2+]CC1CCCC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001273018941 1265840069 /nfs/dbraw/zinc/84/00/69/1265840069.db2.gz QHLOFFRLRIMNRP-BEFAXECRSA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)[C@H](C[NH2+]CCCC(C)(C)C)C2CC2)C1 ZINC001485825216 1256382367 /nfs/dbraw/zinc/38/23/67/1256382367.db2.gz BKJGZAZQUMWJLX-FUHWJXTLSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H](C(=O)N(C)[C@@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001485825269 1256389225 /nfs/dbraw/zinc/38/92/25/1256389225.db2.gz CFZDYNMLHQVIDJ-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@@H](C[NH2+]CC2CC3(CCC3)C2)C2CC2)C1 ZINC001485827711 1257083009 /nfs/dbraw/zinc/08/30/09/1257083009.db2.gz QYQGBFHBHQUKQH-APWZRJJASA-N 1 3 347.547 2.735 10 0 EFAEHO c1ccc(CN2CCCC[C@H](C[NH2+][C@@H]3CCO[C@]34CCOC4)C2)cc1 ZINC000903173326 1259895978 /nfs/dbraw/zinc/89/59/78/1259895978.db2.gz YUUAAUBUFRCBSG-NJYVYQBISA-N 1 3 344.499 2.826 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001272830621 1261099328 /nfs/dbraw/zinc/09/93/28/1261099328.db2.gz QDNDJTDOCVKZLM-INIZCTEOSA-N 1 3 331.504 2.718 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@@H](C2CC2)N(C)C(=O)CN(C)C(C)C)c1 ZINC001485837507 1261372494 /nfs/dbraw/zinc/37/24/94/1261372494.db2.gz OSCNSKRLPZZHNW-FQEVSTJZSA-N 1 3 345.531 2.970 10 0 EFAEHO C[C@@H]([NH3+])[C@@H]1CCN(C[C@@H]2Cc3ccccc3O[C@H]2C(F)(F)F)C1 ZINC000923332457 1261483302 /nfs/dbraw/zinc/48/33/02/1261483302.db2.gz QFLDUTOEWDARSI-OEYIWLLWSA-N 1 3 328.378 2.838 10 0 EFAEHO CC[N@H+](C[C@H](CN)Cc1cnn(C)c1C)[C@H](C)Cc1ccsc1 ZINC000903916481 1261542727 /nfs/dbraw/zinc/54/27/27/1261542727.db2.gz SOZKGXVUHPNJKO-PBHICJAKSA-N 1 3 334.533 2.861 10 0 EFAEHO CC[N@@H+](C[C@H](CN)Cc1cnn(C)c1C)[C@H](C)Cc1ccsc1 ZINC000903916481 1261542734 /nfs/dbraw/zinc/54/27/34/1261542734.db2.gz SOZKGXVUHPNJKO-PBHICJAKSA-N 1 3 334.533 2.861 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)c(C)c1 ZINC000923365069 1261558361 /nfs/dbraw/zinc/55/83/61/1261558361.db2.gz RWEXPKOCJFVWIJ-GUDVDZBRSA-N 1 3 332.488 2.507 10 0 EFAEHO Cc1ccc(OC[C@@H](O)CN2CC[C@](C[NH3+])(C(C)(C)C)C2)c(C)c1 ZINC000923413205 1261627029 /nfs/dbraw/zinc/62/70/29/1261627029.db2.gz FAMPAIWEAIONDS-FXAWDEMLSA-N 1 3 334.504 2.740 10 0 EFAEHO Cc1cc(C)cc(OC[C@@H](O)CN2CC[C@@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000923414652 1261628326 /nfs/dbraw/zinc/62/83/26/1261628326.db2.gz MXHOLQWAGDSSSN-PXNSSMCTSA-N 1 3 334.504 2.740 10 0 EFAEHO [NH3+]C[C@H]1CC2(CO1)CCN(Cc1ccccc1Br)CC2 ZINC000923455865 1261679674 /nfs/dbraw/zinc/67/96/74/1261679674.db2.gz NFXKIGWTMOSJQN-CQSZACIVSA-N 1 3 339.277 2.779 10 0 EFAEHO CC[C@@H]1c2ccsc2CCN1C(=O)CN1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923498639 1261793645 /nfs/dbraw/zinc/79/36/45/1261793645.db2.gz IQPRZLHUJFYEHR-IIAWOOMASA-N 1 3 335.517 2.501 10 0 EFAEHO C[C@@H]1CN(CC(=O)N(Cc2cccc(F)c2)C(C)(C)C)CC[C@H]1C[NH3+] ZINC000923499199 1261795157 /nfs/dbraw/zinc/79/51/57/1261795157.db2.gz RDIVDNNUGNAOFW-WBVHZDCISA-N 1 3 349.494 2.870 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C[NH3+])[C@@H](C)C1)c1cccc2ccccc21 ZINC000923500069 1261796899 /nfs/dbraw/zinc/79/68/99/1261796899.db2.gz NVNDUEZHNBNOMJ-BQFCYCMXSA-N 1 3 339.483 2.934 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C[NH3+])[C@@H](C)C1)c1cccc2ccccc21 ZINC000923500075 1261797066 /nfs/dbraw/zinc/79/70/66/1261797066.db2.gz NVNDUEZHNBNOMJ-XYJFISCASA-N 1 3 339.483 2.934 10 0 EFAEHO CC(C)[C@H](NC(=O)CN1CC[C@H](C[NH3+])[C@H](C)C1)c1ccc(F)cc1 ZINC000923500512 1261797819 /nfs/dbraw/zinc/79/78/19/1261797819.db2.gz PICACFGMKSRSJH-OGWOLHLISA-N 1 3 335.467 2.556 10 0 EFAEHO Cn1c2cc(CN3CCC([C@@H]4CCC[NH2+]CC4)CC3)ccc2oc1=O ZINC000923507998 1261808429 /nfs/dbraw/zinc/80/84/29/1261808429.db2.gz SKRIAYKSJDFTSI-MRXNPFEDSA-N 1 3 343.471 2.733 10 0 EFAEHO CCCCCN1CC[C@H]1CN(C)C(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001691661517 1262209142 /nfs/dbraw/zinc/20/91/42/1262209142.db2.gz UWHDBOROBSCKNH-QFBILLFUSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCCCN1CC[C@H]1CN(C)C(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001691661517 1262209147 /nfs/dbraw/zinc/20/91/47/1262209147.db2.gz UWHDBOROBSCKNH-QFBILLFUSA-N 1 3 341.515 2.922 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@@H](C)CN(C)C(=O)C2(N(C)C)CCC2)cc1 ZINC001485881484 1262463419 /nfs/dbraw/zinc/46/34/19/1262463419.db2.gz GXTJOWIKRAQHFC-SFHVURJKSA-N 1 3 345.531 2.848 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)C[C@@H](C)NCc1ccc(C)cc1Cl ZINC001485941185 1262540768 /nfs/dbraw/zinc/54/07/68/1262540768.db2.gz MQUFYDSVIUIVDB-OAHLLOKOSA-N 1 3 339.911 2.927 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)C[C@@H](C)NCc1ccc(C)cc1Cl ZINC001485941185 1262540770 /nfs/dbraw/zinc/54/07/70/1262540770.db2.gz MQUFYDSVIUIVDB-OAHLLOKOSA-N 1 3 339.911 2.927 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+][C@@H]1CCc2c1cccc2F ZINC001485960993 1262560215 /nfs/dbraw/zinc/56/02/15/1262560215.db2.gz OTHKKOSRPYLROK-KBXCAEBGSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+][C@H]1CCc2c1cccc2F ZINC001485960994 1262560267 /nfs/dbraw/zinc/56/02/67/1262560267.db2.gz OTHKKOSRPYLROK-KDOFPFPSSA-N 1 3 335.467 2.590 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CCCc2cccc(F)c2)[C@H]1C ZINC001486090866 1262613074 /nfs/dbraw/zinc/61/30/74/1262613074.db2.gz DCFMZTMVBNQMFK-APWZRJJASA-N 1 3 349.494 2.679 10 0 EFAEHO CCCCC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]21 ZINC001486156528 1262713179 /nfs/dbraw/zinc/71/31/79/1262713179.db2.gz NPRBESYKUMDLKO-NZSAHSFTSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H](C[NH2+]C/C=C/Cl)C1)CC(C)(C)C ZINC001486211054 1262807006 /nfs/dbraw/zinc/80/70/06/1262807006.db2.gz AKUKDSQGPFQYLK-VZLFFANISA-N 1 3 329.916 2.591 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc(C)cc2)C(C)(C)C1 ZINC001486247167 1262849837 /nfs/dbraw/zinc/84/98/37/1262849837.db2.gz ZGVKIBQXIRFNMI-SFHVURJKSA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc(CF)cc2)C(C)(C)C1 ZINC001486249898 1262855539 /nfs/dbraw/zinc/85/55/39/1262855539.db2.gz LNXGRXMSZICKDB-GOSISDBHSA-N 1 3 349.494 2.823 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc(CF)cc2)C(C)(C)C1 ZINC001486249899 1262855650 /nfs/dbraw/zinc/85/56/50/1262855650.db2.gz LNXGRXMSZICKDB-SFHVURJKSA-N 1 3 349.494 2.823 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C[NH2+]CC=C(C)C)[C@H](C(F)(F)F)C1 ZINC001486253162 1262861131 /nfs/dbraw/zinc/86/11/31/1262861131.db2.gz KKFWYCVHUGXGFQ-HUUCEWRRSA-N 1 3 349.441 2.521 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)C1CC[NH+](CC2CC(C)C2)CC1 ZINC001486437847 1263122349 /nfs/dbraw/zinc/12/23/49/1263122349.db2.gz MDYKFEVCNOKZED-AQFXKWCLSA-N 1 3 335.536 2.734 10 0 EFAEHO CCC[NH+]1CCC([C@@H](C)NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001486440633 1263151219 /nfs/dbraw/zinc/15/12/19/1263151219.db2.gz WDTJNSGMFWJLRL-BEFAXECRSA-N 1 3 341.515 2.826 10 0 EFAEHO CC1CC(C[NH+]2CCC(C3(NC(=O)CN4CC[C@@H](C)C4)CC3)CC2)C1 ZINC001486490886 1263235417 /nfs/dbraw/zinc/23/54/17/1263235417.db2.gz JZIWFJNLGALRIJ-WWDZGPRUSA-N 1 3 347.547 2.735 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1=CCN(Cc2ccc(C)c(C)c2)CC1 ZINC001486518849 1263307804 /nfs/dbraw/zinc/30/78/04/1263307804.db2.gz KUIXGLPYRCWGMH-UHFFFAOYSA-N 1 3 343.515 2.894 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1=CCN(Cc2ccc(C)c(C)c2)CC1 ZINC001486518849 1263307817 /nfs/dbraw/zinc/30/78/17/1263307817.db2.gz KUIXGLPYRCWGMH-UHFFFAOYSA-N 1 3 343.515 2.894 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)C(C)C)[C@@H]2C1 ZINC001410143902 1264134470 /nfs/dbraw/zinc/13/44/70/1264134470.db2.gz CZUWOZLSQICEAF-AFYVEPGGSA-N 1 3 343.515 2.690 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)C(C)C)[C@@H]2C1 ZINC001410143902 1264134471 /nfs/dbraw/zinc/13/44/71/1264134471.db2.gz CZUWOZLSQICEAF-AFYVEPGGSA-N 1 3 343.515 2.690 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2cccc(C)c2)C1 ZINC001410232493 1264433822 /nfs/dbraw/zinc/43/38/22/1264433822.db2.gz ZORVPOUSSDLFOG-ZHALLVOQSA-N 1 3 331.504 2.882 10 0 EFAEHO C[C@@H]([NH2+]C[C@H]1C[C@H](NC(=O)CN(C)C2CCC2)C1)c1ccccc1F ZINC001410246461 1264487905 /nfs/dbraw/zinc/48/79/05/1264487905.db2.gz XTWNOKPRDQCZFD-BZUAXINKSA-N 1 3 347.478 2.855 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C[NH2+]Cc1cc(F)ccc1C)C1CC1)N(C)C ZINC001410315227 1264761635 /nfs/dbraw/zinc/76/16/35/1264761635.db2.gz PEYQFOPSOBWXTA-MOPGFXCFSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)[C@H]2CCC[N@@H+]2C(C)C)c1 ZINC001410378887 1264949351 /nfs/dbraw/zinc/94/93/51/1264949351.db2.gz GAPKTESUDYXKHO-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)[C@H]2CCC[N@H+]2C(C)C)c1 ZINC001410378887 1264949357 /nfs/dbraw/zinc/94/93/57/1264949357.db2.gz GAPKTESUDYXKHO-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(F)cc1F)N(C)C ZINC001273002320 1265070762 /nfs/dbraw/zinc/07/07/62/1265070762.db2.gz UKYVBWAVLCHRAF-SUMWQHHRSA-N 1 3 341.446 2.535 10 0 EFAEHO C[C@H](CN(C)C(=O)CN(C)CC(C)(C)C)[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001410439141 1265294272 /nfs/dbraw/zinc/29/42/72/1265294272.db2.gz QWODUAWHARXRRM-CABCVRRESA-N 1 3 347.494 2.836 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CC3CC3)[C@H]2C1)CC(C)(C)C ZINC001410909813 1270221538 /nfs/dbraw/zinc/22/15/38/1270221538.db2.gz DFMZPFIKVCHVMP-OKZBNKHCSA-N 1 3 335.536 2.591 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H]2CC[C@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001410945985 1270355403 /nfs/dbraw/zinc/35/54/03/1270355403.db2.gz ADTOZLKYEWPFEG-PMACEKPBSA-N 1 3 345.531 2.964 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@H]([NH2+]C/C=C/c2ccccc2)C(C)(C)C1)N(C)C ZINC001410980660 1270533067 /nfs/dbraw/zinc/53/30/67/1270533067.db2.gz JOOUSBGHFVUOHC-WXLQDFAISA-N 1 3 343.515 2.867 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCN(C(=O)[C@@H]2CCCN2C)C(C)C)cc1 ZINC001411183180 1271682128 /nfs/dbraw/zinc/68/21/28/1271682128.db2.gz HILQFQPBZAHSBW-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCN(C(=O)[C@@H]2CCCN2C)C(C)C)cc1 ZINC001411183180 1271682137 /nfs/dbraw/zinc/68/21/37/1271682137.db2.gz HILQFQPBZAHSBW-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccccc1)C(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001411184184 1271684796 /nfs/dbraw/zinc/68/47/96/1271684796.db2.gz BKGLHBGVOJUWKX-FQEVSTJZSA-N 1 3 343.515 2.697 10 0 EFAEHO CC[C@@H](C(=O)N(CC[N@H+](C)C[C@H]1CCC(F)(F)C1)C(C)C)N(C)C ZINC001411197221 1271885246 /nfs/dbraw/zinc/88/52/46/1271885246.db2.gz WYIJCSGUTBKTGH-HOTGVXAUSA-N 1 3 347.494 2.931 10 0 EFAEHO CC[C@@H](C(=O)N(CC[N@@H+](C)C[C@H]1CCC(F)(F)C1)C(C)C)N(C)C ZINC001411197221 1271885263 /nfs/dbraw/zinc/88/52/63/1271885263.db2.gz WYIJCSGUTBKTGH-HOTGVXAUSA-N 1 3 347.494 2.931 10 0 EFAEHO CCc1cccc(CN(C)CCN(C(=O)[C@H]2CC[N@H+](C)C2)C(C)C)c1 ZINC001411202202 1271907558 /nfs/dbraw/zinc/90/75/58/1271907558.db2.gz VEMQLQPBAQPUSL-FQEVSTJZSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1cccc(CN(C)CCN(C(=O)[C@H]2CC[N@@H+](C)C2)C(C)C)c1 ZINC001411202202 1271907577 /nfs/dbraw/zinc/90/75/77/1271907577.db2.gz VEMQLQPBAQPUSL-FQEVSTJZSA-N 1 3 345.531 2.870 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](NC(=O)CC[NH+](C)C)C(C)(C)C)c1 ZINC001411222791 1272055369 /nfs/dbraw/zinc/05/53/69/1272055369.db2.gz LEOBIVBWVJSYEI-KRWDZBQOSA-N 1 3 337.483 2.706 10 0 EFAEHO C[C@H](NC(=O)CN(C)CC(C)(C)C)C1CC[NH+](CCC2CC2)CC1 ZINC001411230985 1272085638 /nfs/dbraw/zinc/08/56/38/1272085638.db2.gz ATDNMFSMHZLPJD-INIZCTEOSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)C2CC(NCC=C(Cl)Cl)C2)CC[N@@H+]1C ZINC001411234831 1272093276 /nfs/dbraw/zinc/09/32/76/1272093276.db2.gz GCTSMNZGOBMSPO-CLRIEMFWSA-N 1 3 348.318 2.615 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)C2CC(NCC=C(Cl)Cl)C2)CC[N@H+]1C ZINC001411234831 1272093287 /nfs/dbraw/zinc/09/32/87/1272093287.db2.gz GCTSMNZGOBMSPO-CLRIEMFWSA-N 1 3 348.318 2.615 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C)C1)C1CC[NH+](CCC(C)(C)C)CC1 ZINC001411242466 1272113300 /nfs/dbraw/zinc/11/33/00/1272113300.db2.gz ZGTHMFATDMBVEN-SJORKVTESA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]Cc2ccc3cc[nH]c3c2)C1 ZINC001411252867 1272148396 /nfs/dbraw/zinc/14/83/96/1272148396.db2.gz LKBVUJUDQRWLQW-UHFFFAOYSA-N 1 3 342.487 2.587 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]Cc2ccc(Cl)cc2)C1 ZINC001411255648 1272153570 /nfs/dbraw/zinc/15/35/70/1272153570.db2.gz UQLHOWQCSYFTQN-UHFFFAOYSA-N 1 3 337.895 2.759 10 0 EFAEHO CC[C@H](C)C[NH2+]Cc1ccc(CNC(=O)Cc2nc[nH]c2C)c(F)c1 ZINC001411256543 1272160818 /nfs/dbraw/zinc/16/08/18/1272160818.db2.gz DVYUXGLQUIJNME-ZDUSSCGKSA-N 1 3 346.450 2.852 10 0 EFAEHO CC(C)[NH2+]Cc1ccc(CNC(=O)C(C)(C)N2CCCC2)c(F)c1 ZINC001411257253 1272162370 /nfs/dbraw/zinc/16/23/70/1272162370.db2.gz IPUMWSFTMJCQON-UHFFFAOYSA-N 1 3 335.467 2.814 10 0 EFAEHO CCO[C@@H]1C[C@H](NC[C@]2(C)CC[N@H+](Cc3ccccc3)C2)[C@H]1OC ZINC000379795539 1272987225 /nfs/dbraw/zinc/98/72/25/1272987225.db2.gz CIPLIZYGHMIFSG-NMLBUPMWSA-N 1 3 332.488 2.681 10 0 EFAEHO CCO[C@@H]1C[C@H](NC[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)[C@H]1OC ZINC000379795539 1272987228 /nfs/dbraw/zinc/98/72/28/1272987228.db2.gz CIPLIZYGHMIFSG-NMLBUPMWSA-N 1 3 332.488 2.681 10 0 EFAEHO Cc1cc([C@H](N)CC(=O)NC[C@H](CC(C)C)[NH+](C)C)cc(Cl)n1 ZINC000844168528 1278778191 /nfs/dbraw/zinc/77/81/91/1278778191.db2.gz FZGRAJUFVODLKZ-LSDHHAIUSA-N 1 3 340.899 2.526 10 0 EFAEHO CC[NH+](CC)CCCCNC(=O)C[C@H](N)c1cc(C)nc(Cl)c1 ZINC000844170900 1278778789 /nfs/dbraw/zinc/77/87/89/1278778789.db2.gz UCZYMTIMEAGJMD-HNNXBMFYSA-N 1 3 340.899 2.672 10 0 EFAEHO COC(=O)/C(C)=C/C[NH2+]C1[C@H](C)CN(Cc2ccccc2)C[C@@H]1C ZINC000787302470 1275750976 /nfs/dbraw/zinc/75/09/76/1275750976.db2.gz NROHMFIIVKQELT-OAEFZWHFSA-N 1 3 330.472 2.852 10 0 EFAEHO O[C@H](CN[C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(F)c1 ZINC000817888535 1276347873 /nfs/dbraw/zinc/34/78/73/1276347873.db2.gz HNLXQXDLDUKBQU-GGPKGHCWSA-N 1 3 342.414 2.705 10 0 EFAEHO CC(C)[N@H+](C)Cc1ccccc1CNC[C@H](O)c1ccc(F)cn1 ZINC000818960316 1276550216 /nfs/dbraw/zinc/55/02/16/1276550216.db2.gz AGHIRTBWTYCUTA-IBGZPJMESA-N 1 3 331.435 2.884 10 0 EFAEHO CC(C)[N@@H+](C)Cc1ccccc1CNC[C@H](O)c1ccc(F)cn1 ZINC000818960316 1276550219 /nfs/dbraw/zinc/55/02/19/1276550219.db2.gz AGHIRTBWTYCUTA-IBGZPJMESA-N 1 3 331.435 2.884 10 0 EFAEHO O[C@H](CNC[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(F)cn1 ZINC000818988463 1276564287 /nfs/dbraw/zinc/56/42/87/1276564287.db2.gz QJVLMHZECPFYQY-KBXCAEBGSA-N 1 3 349.475 2.817 10 0 EFAEHO O[C@H](CNC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(F)cn1 ZINC000818988463 1276564288 /nfs/dbraw/zinc/56/42/88/1276564288.db2.gz QJVLMHZECPFYQY-KBXCAEBGSA-N 1 3 349.475 2.817 10 0 EFAEHO C[N@@H+]1CCC[C@H](CNC[C@@H](O)c2ccc(F)cn2)[C@H]1c1cccs1 ZINC000819101446 1276607640 /nfs/dbraw/zinc/60/76/40/1276607640.db2.gz UODKAIOFHYFVOV-QBIMZIAESA-N 1 3 349.475 2.988 10 0 EFAEHO C[N@H+]1CCC[C@H](CNC[C@@H](O)c2ccc(F)cn2)[C@H]1c1cccs1 ZINC000819101446 1276607648 /nfs/dbraw/zinc/60/76/48/1276607648.db2.gz UODKAIOFHYFVOV-QBIMZIAESA-N 1 3 349.475 2.988 10 0 EFAEHO C[NH+](C)CCCC(C)(C)NC(=O)[C@H]1CCN(Cc2ccc(F)cc2)C1 ZINC000585090782 1277194690 /nfs/dbraw/zinc/19/46/90/1277194690.db2.gz IMTZKWNHQNTIAO-KRWDZBQOSA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1cc2c(ncnc2N2CCN(CCCCCC[NH3+])CC2)s1 ZINC000846220524 1280074837 /nfs/dbraw/zinc/07/48/37/1280074837.db2.gz JNXOPAOWYLVVPI-UHFFFAOYSA-N 1 3 333.505 2.641 10 0 EFAEHO CCN1C[C@H](CN2CCC(CCC[NH+](CC)CC)CC2)OC1=O ZINC000846849665 1280573441 /nfs/dbraw/zinc/57/34/41/1280573441.db2.gz HLVZLZUUZSMJLF-KRWDZBQOSA-N 1 3 325.497 2.661 10 0 EFAEHO Cc1ccc(NC(=O)NC(=O)[C@@H](C)N(C)CCCCCC[NH3+])c(C)c1 ZINC000872154872 1287449717 /nfs/dbraw/zinc/44/97/17/1287449717.db2.gz CVLQJYOUVBPFBW-MRXNPFEDSA-N 1 3 348.491 2.791 10 0 EFAEHO COC(=O)c1ccc(OC)c2c1CCN(CCCCCCC[NH3+])C2 ZINC000872154569 1287450164 /nfs/dbraw/zinc/45/01/64/1287450164.db2.gz TWRUOECJLPYGMA-UHFFFAOYSA-N 1 3 334.460 2.749 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2CNC[C@@H](O)CC(C)(C)O)C1 ZINC000872199754 1287471915 /nfs/dbraw/zinc/47/19/15/1287471915.db2.gz AZCJFLKSBCCCCI-QKLQHJQFSA-N 1 3 348.531 2.776 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC[C@@H](O)CC(C)(C)O)C1 ZINC000872199754 1287471919 /nfs/dbraw/zinc/47/19/19/1287471919.db2.gz AZCJFLKSBCCCCI-QKLQHJQFSA-N 1 3 348.531 2.776 10 0 EFAEHO CN(C)[C@H](CNC(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1)c1ccccc1 ZINC000809941520 1282635893 /nfs/dbraw/zinc/63/58/93/1282635893.db2.gz AVAUSPCGAYAUIR-VQIMIIECSA-N 1 3 335.467 2.618 10 0 EFAEHO CN(C)[C@H](CNC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1)c1ccccc1 ZINC000809941520 1282635906 /nfs/dbraw/zinc/63/59/06/1282635906.db2.gz AVAUSPCGAYAUIR-VQIMIIECSA-N 1 3 335.467 2.618 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](CCCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000810147781 1282972451 /nfs/dbraw/zinc/97/24/51/1282972451.db2.gz RYIUUBBVGHUXQI-FCEWJHQRSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000810147781 1282972462 /nfs/dbraw/zinc/97/24/62/1282972462.db2.gz RYIUUBBVGHUXQI-FCEWJHQRSA-N 1 3 341.515 2.683 10 0 EFAEHO Cc1cc(F)ccc1[C@@H](C)NC1CC[NH+](CCC(=O)N(C)C)CC1 ZINC000815578080 1287610561 /nfs/dbraw/zinc/61/05/61/1287610561.db2.gz HCJHMTGSYMHDRG-OAHLLOKOSA-N 1 3 335.467 2.727 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC[C@H]([NH+]3CCCC3)CC2)C1 ZINC000810425232 1283220521 /nfs/dbraw/zinc/22/05/21/1283220521.db2.gz HLRLLHXKPKFKLP-QFBILLFUSA-N 1 3 339.499 2.676 10 0 EFAEHO CC(C)CN1CCC([NH2+]C[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)CC1 ZINC000715117603 1284033720 /nfs/dbraw/zinc/03/37/20/1284033720.db2.gz OMUOZDYAFVZNHB-WOVMCDHWSA-N 1 3 339.524 3.000 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C[C@@H]1C ZINC000813462617 1285932663 /nfs/dbraw/zinc/93/26/63/1285932663.db2.gz ZHESMNFDMIGALS-MPGHIAIKSA-N 1 3 327.488 2.530 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C[C@@H]1C ZINC000813462617 1285932668 /nfs/dbraw/zinc/93/26/68/1285932668.db2.gz ZHESMNFDMIGALS-MPGHIAIKSA-N 1 3 327.488 2.530 10 0 EFAEHO OC1(C[NH+]2CCCCC2)CCN(CCOCc2ccccc2)CC1 ZINC001176880734 1288160363 /nfs/dbraw/zinc/16/03/63/1288160363.db2.gz ZBIRVHWBCVADDQ-UHFFFAOYSA-N 1 3 332.488 2.516 10 0 EFAEHO COc1cccc(CN(C[C@@H]2C[NH2+]C[C@H]2C)C2CCC(O)CC2)c1 ZINC000903434779 1312673314 /nfs/dbraw/zinc/67/33/14/1312673314.db2.gz JCOQXDXTPVQNDP-SVUBNXHSSA-N 1 3 332.488 2.656 10 0 EFAEHO C[C@@H]1C[NH2+]C[C@H]1CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 ZINC000903435160 1312674801 /nfs/dbraw/zinc/67/48/01/1312674801.db2.gz PUEZPPPSHHQBJL-KBMXLJTQSA-N 1 3 344.434 2.911 10 0 EFAEHO COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903439503 1312682774 /nfs/dbraw/zinc/68/27/74/1312682774.db2.gz IXRNVVBOOMVJKF-HLLBOEOZSA-N 1 3 331.460 2.534 10 0 EFAEHO CC(C)[C@@H](CNC(=O)OC(C)(C)C)C[NH+]1CCC(N(C)C)CC1 ZINC000823404335 1289293375 /nfs/dbraw/zinc/29/33/75/1289293375.db2.gz PIKDOEMHSSSVTI-HNNXBMFYSA-N 1 3 327.513 2.809 10 0 EFAEHO CN(CC(=O)N(C)[C@@H](C[NH2+]C/C=C\Cl)C1CC1)CC(C)(C)C ZINC001277692457 1312748135 /nfs/dbraw/zinc/74/81/35/1312748135.db2.gz CIEODZADJPCWLB-AJHXJQRKSA-N 1 3 329.916 2.543 10 0 EFAEHO COC(=O)[C@]12C[C@H]([NH3+])C[C@H]1CN([C@H](C)c1ccc(F)c(Cl)c1)C2 ZINC000903492335 1312765973 /nfs/dbraw/zinc/76/59/73/1312765973.db2.gz AXEKZBJZRSJJMR-DAWNXDAASA-N 1 3 340.826 2.752 10 0 EFAEHO Cc1cc([C@H](N)CC(=O)NCC[NH+](C(C)C)C(C)C)cc(Cl)n1 ZINC000825738308 1290263120 /nfs/dbraw/zinc/26/31/20/1290263120.db2.gz ZLECTONTNZJSBX-OAHLLOKOSA-N 1 3 340.899 2.668 10 0 EFAEHO C[C@@H](C(=O)Nc1ccccc1C(F)(F)F)N1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903496440 1312771424 /nfs/dbraw/zinc/77/14/24/1312771424.db2.gz NWFKABNRFXWVRC-FRRDWIJNSA-N 1 3 343.393 2.949 10 0 EFAEHO COc1ccc(-c2noc([C@@H](C)N3C[C@@H](C)[C@H](CC[NH3+])C3)n2)cc1 ZINC000903499775 1312777318 /nfs/dbraw/zinc/77/73/18/1312777318.db2.gz NKAHAJJVDBGSKR-UMVBOHGHSA-N 1 3 330.432 2.723 10 0 EFAEHO CCC[NH+]1CCC(N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C)CC1 ZINC000721920189 1312800723 /nfs/dbraw/zinc/80/07/23/1312800723.db2.gz NTVIYWINAKOHAR-HOCLYGCPSA-N 1 3 325.497 2.706 10 0 EFAEHO CN(C)C[C@H]1CC[N@H+](C[C@@H]2CCCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000876731452 1290994100 /nfs/dbraw/zinc/99/41/00/1290994100.db2.gz RCFBPXUYFKOQEN-DLBZAZTESA-N 1 3 339.524 2.907 10 0 EFAEHO CN(C)C[C@H]1CC[N@@H+](C[C@@H]2CCCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000876731452 1290994106 /nfs/dbraw/zinc/99/41/06/1290994106.db2.gz RCFBPXUYFKOQEN-DLBZAZTESA-N 1 3 339.524 2.907 10 0 EFAEHO C([C@@H]1CC2(CO1)CCOCC2)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000878286490 1291601614 /nfs/dbraw/zinc/60/16/14/1291601614.db2.gz PFFNQJLJMIBITD-NEWSRXKRSA-N 1 3 334.504 2.521 10 0 EFAEHO C([C@@H]1CC2(CO1)CCOCC2)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000878286490 1291601619 /nfs/dbraw/zinc/60/16/19/1291601619.db2.gz PFFNQJLJMIBITD-NEWSRXKRSA-N 1 3 334.504 2.521 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@@H]([C@H]2CCCN(CCF)C2)C1 ZINC001273598542 1292108397 /nfs/dbraw/zinc/10/83/97/1292108397.db2.gz DBNDUPUAHXHGTB-ZWKOTPCHSA-N 1 3 341.515 2.638 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@H]([C@H]2CCCN(CCF)C2)C1 ZINC001273598541 1292108412 /nfs/dbraw/zinc/10/84/12/1292108412.db2.gz DBNDUPUAHXHGTB-ROUUACIJSA-N 1 3 341.515 2.638 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C2CCC2)cc1)C(=O)CN1CCCC1 ZINC001273753609 1294742101 /nfs/dbraw/zinc/74/21/01/1294742101.db2.gz WZQBUHJQGIRKCE-UHFFFAOYSA-N 1 3 343.515 2.988 10 0 EFAEHO Brc1ccc(OCCCC[N@@H+]2CCCNCC2)cc1 ZINC000903713500 1313105032 /nfs/dbraw/zinc/10/50/32/1313105032.db2.gz TTWZSHVPUZYSIL-UHFFFAOYSA-N 1 3 327.266 2.903 10 0 EFAEHO Brc1ccc(OCCCC[N@H+]2CCCNCC2)cc1 ZINC000903713500 1313105036 /nfs/dbraw/zinc/10/50/36/1313105036.db2.gz TTWZSHVPUZYSIL-UHFFFAOYSA-N 1 3 327.266 2.903 10 0 EFAEHO C[C@H](CO[C@H]1CCOC1)[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000886539028 1295006088 /nfs/dbraw/zinc/00/60/88/1295006088.db2.gz RSWSGBFSVUNNQQ-GVVDHYSOSA-N 1 3 344.499 2.823 10 0 EFAEHO O[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C12CCC2 ZINC000886637903 1295078634 /nfs/dbraw/zinc/07/86/34/1295078634.db2.gz HPXIHGHMHNQSOJ-LJDSDSDDSA-N 1 3 326.484 2.933 10 0 EFAEHO COC(=O)C1=CC[C@H]([NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C1 ZINC000886641845 1295083321 /nfs/dbraw/zinc/08/33/21/1295083321.db2.gz UDEBOQKNLCPZTM-LEAZDLGRSA-N 1 3 340.467 2.891 10 0 EFAEHO COC(=O)C1=CC[C@H](N[C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1 ZINC000886641845 1295083331 /nfs/dbraw/zinc/08/33/31/1295083331.db2.gz UDEBOQKNLCPZTM-LEAZDLGRSA-N 1 3 340.467 2.891 10 0 EFAEHO COC(=O)C1=CC[C@H](N[C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1 ZINC000886641845 1295083337 /nfs/dbraw/zinc/08/33/37/1295083337.db2.gz UDEBOQKNLCPZTM-LEAZDLGRSA-N 1 3 340.467 2.891 10 0 EFAEHO COC(=O)[C@@H]1CC[C@H]([NH2+]C[C@@H]2CN(Cc3ccccc3)C[C@H]2C)C1 ZINC000886644311 1295086004 /nfs/dbraw/zinc/08/60/04/1295086004.db2.gz AADBCLWTFXJEDO-OWYHZJEWSA-N 1 3 330.472 2.686 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]C/C=C/CNC(=O)CN(C)C2CCC2)c1 ZINC001274089989 1295450141 /nfs/dbraw/zinc/45/01/41/1295450141.db2.gz TZNMVJGVTSIHSJ-BDUNBXCCSA-N 1 3 329.488 2.802 10 0 EFAEHO C[C@@H]([NH2+]C/C=C/CNC(=O)C1(N(C)C)CCC1)c1cccc(F)c1 ZINC001274089848 1295450211 /nfs/dbraw/zinc/45/02/11/1295450211.db2.gz SRISPKZAHQHNQR-MBVDDHJVSA-N 1 3 333.451 2.633 10 0 EFAEHO CC(C)CC[NH2+]CC(C)(C)CN(C)C(=O)[C@H]1CCCN1C(C)C ZINC001275668460 1296347272 /nfs/dbraw/zinc/34/72/72/1296347272.db2.gz NLYLQAIYECGOOD-QGZVFWFLSA-N 1 3 325.541 2.980 10 0 EFAEHO CN(C(=O)NC1CCC(C)([NH+]2CCCC2)CC1)[C@H]1CCN(C2CC2)C1 ZINC000925043393 1296792719 /nfs/dbraw/zinc/79/27/19/1296792719.db2.gz XRMNUFIASZGYAE-IPCDKGFNSA-N 1 3 348.535 2.662 10 0 EFAEHO C[C@@H]1CN(C(C)(C)C[NH2+][C@@H]2CCNC[C@H]2C2CCCC2)C[C@H](C)O1 ZINC000925516254 1296847175 /nfs/dbraw/zinc/84/71/75/1296847175.db2.gz RABHEBLPABABQW-OGWHTMIXSA-N 1 3 337.552 2.632 10 0 EFAEHO C[C@@H](NC[C@@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1ccc(Cl)s1 ZINC000925850967 1296880515 /nfs/dbraw/zinc/88/05/15/1296880515.db2.gz AUPNTROULMPIPW-MNOVXSKESA-N 1 3 328.865 2.737 10 0 EFAEHO C[C@@H](NCc1ccc(-c2nncnn2)cc1)c1cccc(C[NH+](C)C)c1 ZINC000926656002 1296944950 /nfs/dbraw/zinc/94/49/50/1296944950.db2.gz DXQVAONRGGTIBH-OAHLLOKOSA-N 1 3 348.454 2.846 10 0 EFAEHO C[C@@H]([NH2+]CC[S@](=O)CC(F)(F)F)c1cccc(CN(C)C)c1 ZINC000926684088 1296948678 /nfs/dbraw/zinc/94/86/78/1296948678.db2.gz RNPIASDASHRJJY-IPQOISQHSA-N 1 3 336.423 2.710 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@@]34C[C@@H]3CCCC4)CC2)CC1 ZINC000927431514 1297020162 /nfs/dbraw/zinc/02/01/62/1297020162.db2.gz AJLFLMZJCJALCL-GHTZIAJQSA-N 1 3 347.547 2.879 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@H]1C[NH2+]CCCCc1ccccc1 ZINC001277948465 1313334440 /nfs/dbraw/zinc/33/44/40/1313334440.db2.gz SXJAATLYAFJKPE-IBGZPJMESA-N 1 3 340.471 2.556 10 0 EFAEHO CN1CCC[C@H]1C(=O)NC/C=C\C[NH2+]CCCc1ccc(Cl)cc1 ZINC001273909507 1297113887 /nfs/dbraw/zinc/11/38/87/1297113887.db2.gz GVDNXSSOFFEVFW-KVLZDYKBSA-N 1 3 349.906 2.629 10 0 EFAEHO COCCN(C[C@@H](C[NH3+])Cc1cnn(C)c1C)[C@H](C)c1ccccc1 ZINC000903885553 1313348559 /nfs/dbraw/zinc/34/85/59/1313348559.db2.gz LMBHLSWCBCBPED-QZTJIDSGSA-N 1 3 344.503 2.556 10 0 EFAEHO CC(C)N1CCC([N@H+](C)C[C@@H](O)COc2ccc3cc[nH]c3c2)CC1 ZINC000929471927 1297183421 /nfs/dbraw/zinc/18/34/21/1297183421.db2.gz ZNVMWAOHFUNUOR-GOSISDBHSA-N 1 3 345.487 2.712 10 0 EFAEHO CC(C)N1CCC([N@@H+](C)C[C@@H](O)COc2ccc3cc[nH]c3c2)CC1 ZINC000929471927 1297183429 /nfs/dbraw/zinc/18/34/29/1297183429.db2.gz ZNVMWAOHFUNUOR-GOSISDBHSA-N 1 3 345.487 2.712 10 0 EFAEHO CC(C)CN(CCc1ccccc1)Cc1cnnn1[C@@H]1CCC[NH2+]C1 ZINC000903887109 1313353106 /nfs/dbraw/zinc/35/31/06/1313353106.db2.gz YWMBKQIMPXSNSJ-LJQANCHMSA-N 1 3 341.503 2.903 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN2CCSC3(CCCCC3)C2)cnn1C ZINC000903900064 1313378812 /nfs/dbraw/zinc/37/88/12/1313378812.db2.gz ZLFLPLLRFJWEHV-MRXNPFEDSA-N 1 3 336.549 2.598 10 0 EFAEHO CCN(C[C@@H](C[NH3+])Cc1cnn(C)c1C)[C@H](C)c1cccc(O)c1 ZINC000903904207 1313386032 /nfs/dbraw/zinc/38/60/32/1313386032.db2.gz RITPVCTUKISWLF-HZPDHXFCSA-N 1 3 330.476 2.635 10 0 EFAEHO CC(C)=CC[NH2+][C@H]1C[C@@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001488774155 1297739961 /nfs/dbraw/zinc/73/99/61/1297739961.db2.gz SHNZMRXNLBMIMK-JTDSTZFVSA-N 1 3 339.499 2.650 10 0 EFAEHO CC[C@H](C)C[NH2+][C@H]1C[C@@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001488774539 1297740706 /nfs/dbraw/zinc/74/07/06/1297740706.db2.gz VPSPFURCZJTJDR-GGXPGOJBSA-N 1 3 341.515 2.729 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN[C@@H]2CCSc3ccccc32)cnn1C ZINC000903927598 1313429967 /nfs/dbraw/zinc/42/99/67/1313429967.db2.gz ZWXGMDBKARVKCN-RHSMWYFYSA-N 1 3 330.501 2.673 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CNCc2ccccc2C(F)(F)F)cnn1C ZINC000903922647 1313423990 /nfs/dbraw/zinc/42/39/90/1313423990.db2.gz BFTKKBBTOYFFHY-ZDUSSCGKSA-N 1 3 340.393 2.655 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+](C)[C@@H](C)Cc2cccc(F)c2)cnn1C ZINC000903929979 1313434727 /nfs/dbraw/zinc/43/47/27/1313434727.db2.gz PAILZJQKPVBEOM-YOEHRIQHSA-N 1 3 332.467 2.548 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+](C)[C@@H](C)Cc2cccc(F)c2)cnn1C ZINC000903929979 1313434728 /nfs/dbraw/zinc/43/47/28/1313434728.db2.gz PAILZJQKPVBEOM-YOEHRIQHSA-N 1 3 332.467 2.548 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN(C)[C@@H](C)Cc2cccc(F)c2)cnn1C ZINC000903929979 1313434731 /nfs/dbraw/zinc/43/47/31/1313434731.db2.gz PAILZJQKPVBEOM-YOEHRIQHSA-N 1 3 332.467 2.548 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1C[C@H]([NH2+]CCC2=CCCCC2)C1 ZINC001488876528 1297852237 /nfs/dbraw/zinc/85/22/37/1297852237.db2.gz QCKARUVEXVJWCU-QAQDUYKDSA-N 1 3 330.476 2.636 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN[C@@H]2CCc3ccc(Cl)cc32)cnn1C ZINC000903933974 1313443278 /nfs/dbraw/zinc/44/32/78/1313443278.db2.gz CJQAWKIVDMKBIM-SCLBCKFNSA-N 1 3 332.879 2.776 10 0 EFAEHO CC[C@](C)(NC[C@H](C[NH3+])Cc1cnn(C)c1C)c1ccc(F)cc1 ZINC000903935676 1313445863 /nfs/dbraw/zinc/44/58/63/1313445863.db2.gz SFCSYGHVWVFUTC-KXBFYZLASA-N 1 3 332.467 2.900 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN(C)CC(C)(C)C ZINC001489048198 1297956772 /nfs/dbraw/zinc/95/67/72/1297956772.db2.gz HOCODFVZJKIDTQ-ZACQAIPSSA-N 1 3 343.531 2.929 10 0 EFAEHO CCC/C=C\CC[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)Cc1c[nH]cn1 ZINC001489049756 1297969305 /nfs/dbraw/zinc/96/93/05/1297969305.db2.gz ALVHWOAABAYQBL-ROEZOGTPSA-N 1 3 332.492 2.915 10 0 EFAEHO Cc1cccnc1C[NH2+][C@H]1CCCCCN(C(=O)CN(C)C(C)C)C1 ZINC001489242578 1298154173 /nfs/dbraw/zinc/15/41/73/1298154173.db2.gz IXSHPJFCIFDVFA-SFHVURJKSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCN(C/C=C/Cl)CC(C)(C)C1 ZINC001489349066 1298205431 /nfs/dbraw/zinc/20/54/31/1298205431.db2.gz CFKWAURQKRRQFJ-PPYMECGQSA-N 1 3 329.916 2.688 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCN(C/C=C/Cl)CC(C)(C)C1 ZINC001489349066 1298205435 /nfs/dbraw/zinc/20/54/35/1298205435.db2.gz CFKWAURQKRRQFJ-PPYMECGQSA-N 1 3 329.916 2.688 10 0 EFAEHO Cc1ccc(CCC[NH2+]C[C@H]2CCCN2C(=O)CN2CCCC2)cc1 ZINC001277997664 1313510197 /nfs/dbraw/zinc/51/01/97/1313510197.db2.gz PXPCWPTVPWYZMO-HXUWFJFHSA-N 1 3 343.515 2.604 10 0 EFAEHO C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)NC[C@@H]1C[NH2+]C[C@H]1C ZINC000903967715 1313510589 /nfs/dbraw/zinc/51/05/89/1313510589.db2.gz LSJBZUIVSKLFTE-YCPHGPKFSA-N 1 3 337.895 2.522 10 0 EFAEHO Cc1cncc(C[NH2+][C@H](C)[C@H]2CCCCN2C(=O)CN(C)C(C)C)c1 ZINC001490309659 1298753731 /nfs/dbraw/zinc/75/37/31/1298753731.db2.gz MHKHGLNLHXQUCG-IEBWSBKVSA-N 1 3 346.519 2.589 10 0 EFAEHO C[C@H](c1ccccc1F)[N@H+](CCCNC(=O)CN1CCCC1)C1CC1 ZINC001490393001 1298819934 /nfs/dbraw/zinc/81/99/34/1298819934.db2.gz CNEMXYDOMVHPGW-MRXNPFEDSA-N 1 3 347.478 2.953 10 0 EFAEHO C[C@H](c1ccccc1F)[N@@H+](CCCNC(=O)CN1CCCC1)C1CC1 ZINC001490393001 1298819943 /nfs/dbraw/zinc/81/99/43/1298819943.db2.gz CNEMXYDOMVHPGW-MRXNPFEDSA-N 1 3 347.478 2.953 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)C1CCN([C@@H]2CCc3c2cccc3F)CC1 ZINC001490416594 1298894596 /nfs/dbraw/zinc/89/45/96/1298894596.db2.gz OPXGUDRANUPQBL-LJQANCHMSA-N 1 3 347.478 2.688 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CC[NH+]([C@@H]2CCc3ccccc32)CC1 ZINC001490421222 1298897975 /nfs/dbraw/zinc/89/79/75/1298897975.db2.gz IEGDUZYNGDUXQQ-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1ccc(F)cc1)C1CC1 ZINC001490660279 1299101757 /nfs/dbraw/zinc/10/17/57/1299101757.db2.gz FXTWZGRTHPXJKO-MOPGFXCFSA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CC1CC(C)(C)C1)C1CC1 ZINC001490661404 1299103266 /nfs/dbraw/zinc/10/32/66/1299103266.db2.gz MRHQITAUJLGLNI-QZTJIDSGSA-N 1 3 335.536 2.780 10 0 EFAEHO CC(C)(C(=O)NC[C@H]([NH2+]Cc1ccc(F)cc1)C1CC1)N1CCCC1 ZINC001490695504 1299149749 /nfs/dbraw/zinc/14/97/49/1299149749.db2.gz XLLMGJSTQIHPCX-SFHVURJKSA-N 1 3 347.478 2.685 10 0 EFAEHO CN(C/C=C\Cl)C[C@H]1CCCN(C(=O)CCCC[NH+](C)C)C1 ZINC001490774427 1299232492 /nfs/dbraw/zinc/23/24/92/1299232492.db2.gz BTQGYKIHIQPXBI-BSDKJSHOSA-N 1 3 329.916 2.641 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000852909297 1299934747 /nfs/dbraw/zinc/93/47/47/1299934747.db2.gz QLTRKPMHFHIEGO-SFHVURJKSA-N 1 3 331.460 2.552 10 0 EFAEHO CN1CCCC(C)(C)[C@H]1CNC(=O)[C@H]1CC[N@H+](C)[C@H]1c1ccccc1 ZINC001412834430 1300301809 /nfs/dbraw/zinc/30/18/09/1300301809.db2.gz FISYOSCSNUHAQV-OTWHNJEPSA-N 1 3 343.515 2.916 10 0 EFAEHO CN1CCCC(C)(C)[C@H]1CNC(=O)[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1 ZINC001412834430 1300301816 /nfs/dbraw/zinc/30/18/16/1300301816.db2.gz FISYOSCSNUHAQV-OTWHNJEPSA-N 1 3 343.515 2.916 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N[C@@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC000855814799 1301129702 /nfs/dbraw/zinc/12/97/02/1301129702.db2.gz LBHCNWQOQVGSTD-DNVCBOLYSA-N 1 3 339.499 2.722 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC000855814799 1301129711 /nfs/dbraw/zinc/12/97/11/1301129711.db2.gz LBHCNWQOQVGSTD-DNVCBOLYSA-N 1 3 339.499 2.722 10 0 EFAEHO CN1CCCC[C@@H](C[NH2+]C[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)C1 ZINC000862483840 1302397334 /nfs/dbraw/zinc/39/73/34/1302397334.db2.gz ZHUPGYAVCSBSBJ-QFBILLFUSA-N 1 3 339.524 2.955 10 0 EFAEHO CCC[NH2+]C[C@@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CCCC1 ZINC001278276902 1313864992 /nfs/dbraw/zinc/86/49/92/1313864992.db2.gz ZCYPFQGHDVXVEN-VQIMIIECSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1ccc(CN2CCO[C@H](CN[C@H]3CC[N@@H+](C)C(C)(C)C3)C2)cc1 ZINC000865800564 1303406093 /nfs/dbraw/zinc/40/60/93/1303406093.db2.gz PCKWONYIKHVIIM-VQTJNVASSA-N 1 3 345.531 2.658 10 0 EFAEHO Cc1ccc(CN2CCO[C@H](CN[C@H]3CC[N@H+](C)C(C)(C)C3)C2)cc1 ZINC000865800564 1303406099 /nfs/dbraw/zinc/40/60/99/1303406099.db2.gz PCKWONYIKHVIIM-VQTJNVASSA-N 1 3 345.531 2.658 10 0 EFAEHO C[C@@H](CCc1cncc2ccccc21)NC[C@H](O)C[NH+]1CCCC1 ZINC000866242182 1303577447 /nfs/dbraw/zinc/57/74/47/1303577447.db2.gz AWKKOSMVNJRONR-LPHOPBHVSA-N 1 3 327.472 2.602 10 0 EFAEHO CN1CCC(O)(C[NH2+][C@H](CCc2ccccc2)c2ccccn2)CC1 ZINC000866270981 1303587752 /nfs/dbraw/zinc/58/77/52/1303587752.db2.gz ANCZSSHUYICEPT-HXUWFJFHSA-N 1 3 339.483 2.802 10 0 EFAEHO C[NH+]1CCC(O)(CN[C@H](CCc2ccccc2)c2ccccn2)CC1 ZINC000866270981 1303587759 /nfs/dbraw/zinc/58/77/59/1303587759.db2.gz ANCZSSHUYICEPT-HXUWFJFHSA-N 1 3 339.483 2.802 10 0 EFAEHO CCC[NH+]1CCC(NC[C@@H]2CN(Cc3ccccc3C)CCO2)CC1 ZINC000866509599 1303667454 /nfs/dbraw/zinc/66/74/54/1303667454.db2.gz ZCEOORQAVWVRNU-OAQYLSRUSA-N 1 3 345.531 2.660 10 0 EFAEHO CCCN1CCC([NH2+]C[C@@H]2CN(Cc3ccccc3C)CCO2)CC1 ZINC000866509599 1303667459 /nfs/dbraw/zinc/66/74/59/1303667459.db2.gz ZCEOORQAVWVRNU-OAQYLSRUSA-N 1 3 345.531 2.660 10 0 EFAEHO CC(C)(C)[C@]1(CN)CC[N@H+](CCC(=O)N2CCc3sccc3C2)C1 ZINC000866706134 1303760512 /nfs/dbraw/zinc/76/05/12/1303760512.db2.gz MRJFWFHUCCAZOF-IBGZPJMESA-N 1 3 349.544 2.720 10 0 EFAEHO CC(C)(C)[C@]1(CN)CC[N@@H+](CCC(=O)N2CCc3sccc3C2)C1 ZINC000866706134 1303760514 /nfs/dbraw/zinc/76/05/14/1303760514.db2.gz MRJFWFHUCCAZOF-IBGZPJMESA-N 1 3 349.544 2.720 10 0 EFAEHO CC1(C)[C@H](N)c2ccccc2N1C(=O)[C@H](C[NH3+])c1ccc(F)cc1 ZINC000867988602 1304062709 /nfs/dbraw/zinc/06/27/09/1304062709.db2.gz PPMRIYVNHHAZJY-NVXWUHKLSA-N 1 3 327.403 2.693 10 0 EFAEHO CN(CCNC(=O)Nc1ccc([C@@H]2C[C@H]2[NH3+])cc1)Cc1ccccc1 ZINC000868188057 1304178477 /nfs/dbraw/zinc/17/84/77/1304178477.db2.gz UBQDXUWIKYJYNS-RBUKOAKNSA-N 1 3 338.455 2.755 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)[C@H]2CCC[C@H]([NH+](C)C)C2)CCN1Cc1ccccc1 ZINC001413061618 1314067986 /nfs/dbraw/zinc/06/79/86/1314067986.db2.gz STUYDBJPERYFJS-BTHPGYMESA-N 1 3 343.515 2.886 10 0 EFAEHO O=C(CCC12CC(C1)C[NH2+]2)NC[C@H](c1cccs1)N1CCCC1 ZINC000870853857 1305629306 /nfs/dbraw/zinc/62/93/06/1305629306.db2.gz FODNHCJMPOLDAZ-SWKXRBFHSA-N 1 3 333.501 2.533 10 0 EFAEHO Cc1ccccc1CN1CCCN(C(=O)CCC23CC(C2)C[NH2+]3)CC1 ZINC000870865742 1305639129 /nfs/dbraw/zinc/63/91/29/1305639129.db2.gz HVAZUMHDAVQBMU-UHFFFAOYSA-N 1 3 341.499 2.562 10 0 EFAEHO CCN(C(=O)[C@]12C[C@H]1C[C@H]([NH3+])C2)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000870908260 1305673741 /nfs/dbraw/zinc/67/37/41/1305673741.db2.gz YLXABROSEDQFDY-HXIIOJACSA-N 1 3 341.499 2.798 10 0 EFAEHO Cc1cc(C)cc([C@@H](O)CN2CCC(O)(C[NH+]3CCCCC3)CC2)c1 ZINC001413080122 1307618081 /nfs/dbraw/zinc/61/80/81/1307618081.db2.gz RNCAHRCDOJVVDD-FQEVSTJZSA-N 1 3 346.515 2.650 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001413085936 1307640225 /nfs/dbraw/zinc/64/02/25/1307640225.db2.gz WVAJCHBFWXBBRQ-SJORKVTESA-N 1 3 337.533 2.759 10 0 EFAEHO C[C@H]1C[N@@H+](C2CC2)C[C@H]1NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC000901028437 1309230616 /nfs/dbraw/zinc/23/06/16/1309230616.db2.gz ZWVUYNQULLJUGM-SUMWQHHRSA-N 1 3 326.444 2.503 10 0 EFAEHO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC000901028437 1309230626 /nfs/dbraw/zinc/23/06/26/1309230626.db2.gz ZWVUYNQULLJUGM-SUMWQHHRSA-N 1 3 326.444 2.503 10 0 EFAEHO C[N@@H+]1CCC[C@H]2CN(C(=O)c3ccc(NC4=NCCC4)cc3)CC[C@H]21 ZINC000901104673 1309472419 /nfs/dbraw/zinc/47/24/19/1309472419.db2.gz PJFHUMZHUBHZSI-FUHWJXTLSA-N 1 3 340.471 2.847 10 0 EFAEHO C[N@H+]1CCC[C@H]2CN(C(=O)c3ccc(NC4=NCCC4)cc3)CC[C@H]21 ZINC000901104673 1309472425 /nfs/dbraw/zinc/47/24/25/1309472425.db2.gz PJFHUMZHUBHZSI-FUHWJXTLSA-N 1 3 340.471 2.847 10 0 EFAEHO C[N@@H+]1CCC[C@@H]2CN(C(=O)c3ccc(NC4=NCCC4)cc3)CC[C@@H]21 ZINC000901104672 1309473346 /nfs/dbraw/zinc/47/33/46/1309473346.db2.gz PJFHUMZHUBHZSI-AEFFLSMTSA-N 1 3 340.471 2.847 10 0 EFAEHO C[N@H+]1CCC[C@@H]2CN(C(=O)c3ccc(NC4=NCCC4)cc3)CC[C@@H]21 ZINC000901104672 1309473351 /nfs/dbraw/zinc/47/33/51/1309473351.db2.gz PJFHUMZHUBHZSI-AEFFLSMTSA-N 1 3 340.471 2.847 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001491487038 1311192624 /nfs/dbraw/zinc/19/26/24/1311192624.db2.gz TUVFDDJOHATLOU-DOTOQJQBSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001491487038 1311192627 /nfs/dbraw/zinc/19/26/27/1311192627.db2.gz TUVFDDJOHATLOU-DOTOQJQBSA-N 1 3 335.467 2.603 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]CCC2=CCCCC2)C1)N(C)C ZINC001277039842 1311517003 /nfs/dbraw/zinc/51/70/03/1311517003.db2.gz NIXGGKDUQFBFOH-GUDVDZBRSA-N 1 3 335.536 2.948 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@H]2C[C@H](C[NH2+]CCCCC(F)(F)F)C2)C1 ZINC001277046167 1311527678 /nfs/dbraw/zinc/52/76/78/1311527678.db2.gz IBJOPWQNUFJANV-RBSFLKMASA-N 1 3 349.441 2.545 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]CCC2=CCCCC2)C1)N(C)C ZINC001277074842 1311578877 /nfs/dbraw/zinc/57/88/77/1311578877.db2.gz NIXGGKDUQFBFOH-FHWLQOOXSA-N 1 3 335.536 2.948 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CCC[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001277210910 1311808634 /nfs/dbraw/zinc/80/86/34/1311808634.db2.gz RPTIVEKMRHRZOX-MRXNPFEDSA-N 1 3 349.494 2.993 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)CN1CC[C@H](C)C1 ZINC001277352089 1312042467 /nfs/dbraw/zinc/04/24/67/1312042467.db2.gz QSMKMGFOWVKITO-OTWHNJEPSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCCCC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)CN1CC[C@H](C)C1 ZINC001277352089 1312042469 /nfs/dbraw/zinc/04/24/69/1312042469.db2.gz QSMKMGFOWVKITO-OTWHNJEPSA-N 1 3 335.536 2.974 10 0 EFAEHO CN1CCC(O)(C[NH2+][C@H](CCc2ccccc2)c2cccnc2)CC1 ZINC000902815336 1312128670 /nfs/dbraw/zinc/12/86/70/1312128670.db2.gz UUMMPROBXTWUMQ-HXUWFJFHSA-N 1 3 339.483 2.802 10 0 EFAEHO CCC/C=C\CC[N@H+](C)C1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001277429071 1312155707 /nfs/dbraw/zinc/15/57/07/1312155707.db2.gz HQXGPDVOHZWRNU-HPFMTEOYSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@@H+](C)C1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001277429071 1312155709 /nfs/dbraw/zinc/15/57/09/1312155709.db2.gz HQXGPDVOHZWRNU-HPFMTEOYSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCCC[N@@H+]1CCC[C@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001277465520 1312331746 /nfs/dbraw/zinc/33/17/46/1312331746.db2.gz PIXQUZRAOSGARH-IBGZPJMESA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCC[N@H+]1CCC[C@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001277465520 1312331749 /nfs/dbraw/zinc/33/17/49/1312331749.db2.gz PIXQUZRAOSGARH-IBGZPJMESA-N 1 3 335.536 2.975 10 0 EFAEHO C(NC1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1)[C@@H]1CCC2(CCOCC2)CO1 ZINC000903216489 1312470315 /nfs/dbraw/zinc/47/03/15/1312470315.db2.gz BTIRXCNTKSRCMG-DQXYTYHJSA-N 1 3 334.504 2.710 10 0 EFAEHO C(NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)[C@@H]1CCC2(CCOCC2)CO1 ZINC000903216489 1312470318 /nfs/dbraw/zinc/47/03/18/1312470318.db2.gz BTIRXCNTKSRCMG-DQXYTYHJSA-N 1 3 334.504 2.710 10 0 EFAEHO CN(CC(=O)N1CC[C@@](C)(C[NH2+]CCc2ccccc2)C1)C1CCC1 ZINC001278504399 1314924431 /nfs/dbraw/zinc/92/44/31/1314924431.db2.gz LOXCALLCEQNHON-NRFANRHFSA-N 1 3 343.515 2.542 10 0 EFAEHO CN(CC(=O)N1CC[C@](C)(C[NH2+]CCc2ccccc2)C1)C1CCC1 ZINC001278504401 1314924555 /nfs/dbraw/zinc/92/45/55/1314924555.db2.gz LOXCALLCEQNHON-OAQYLSRUSA-N 1 3 343.515 2.542 10 0 EFAEHO CN(CC(=O)N1CC[C@](C)(C[NH2+]CCc2cccs2)C1)C1CCC1 ZINC001278505355 1314928558 /nfs/dbraw/zinc/92/85/58/1314928558.db2.gz QQCMNRRXUZUPEO-LJQANCHMSA-N 1 3 349.544 2.603 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001278571963 1315214002 /nfs/dbraw/zinc/21/40/02/1315214002.db2.gz KGYZGPDOAVJRIZ-HJYANYFWSA-N 1 3 343.515 2.868 10 0 EFAEHO C[NH+](C)CCCCC(=O)NCC1(C)CCN(Cc2ccccn2)CC1 ZINC001278632038 1315326457 /nfs/dbraw/zinc/32/64/57/1315326457.db2.gz CUEKQUULZHGQNU-UHFFFAOYSA-N 1 3 346.519 2.532 10 0 EFAEHO Cc1ccccc1CN1CC[C@H]1CN(C)C(=O)CCCC[NH+](C)C ZINC001263817069 1316565787 /nfs/dbraw/zinc/56/57/87/1316565787.db2.gz NXRFTOMTMGQLCK-IBGZPJMESA-N 1 3 331.504 2.760 10 0 EFAEHO CCCCC[NH2+][C@H]1C[C@@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001263843824 1316568524 /nfs/dbraw/zinc/56/85/24/1316568524.db2.gz LCIWMHOCCKOQEE-FCEWJHQRSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]1C[C@@H]([NH2+]CCCC2CCC2)C1 ZINC001264390973 1316611255 /nfs/dbraw/zinc/61/12/55/1316611255.db2.gz KGUKBYNUWFNXAA-CEXWTWQISA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@@H]1CC[NH2+]Cc1cccnc1 ZINC001264520506 1316627745 /nfs/dbraw/zinc/62/77/45/1316627745.db2.gz MBPUXWXCCBQPCY-MJGOQNOKSA-N 1 3 346.519 2.529 10 0 EFAEHO CCN1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)CCCC[NH+](C)C)C1 ZINC001264596473 1316640040 /nfs/dbraw/zinc/64/00/40/1316640040.db2.gz WQCWOKKYSABOCJ-RTBURBONSA-N 1 3 349.494 2.852 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2C[N@@H+](CC3=CCCCC3)CC[C@@H]2C1 ZINC001264655807 1316648373 /nfs/dbraw/zinc/64/83/73/1316648373.db2.gz OQYCFZMYVPGAKR-MOPGFXCFSA-N 1 3 333.520 2.609 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2C[N@H+](CC3=CCCCC3)CC[C@@H]2C1 ZINC001264655807 1316648376 /nfs/dbraw/zinc/64/83/76/1316648376.db2.gz OQYCFZMYVPGAKR-MOPGFXCFSA-N 1 3 333.520 2.609 10 0 EFAEHO COc1ccc(CN2CC[C@H](NC(=O)CCCC[NH+](C)C)[C@H]2C)cc1 ZINC001264728324 1316660948 /nfs/dbraw/zinc/66/09/48/1316660948.db2.gz HVNGCHOSGZTGSK-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@@H](c1ccccc1F)N(C)CCCNC(=O)C12CCC[NH+]1CCC2 ZINC001265007640 1316687513 /nfs/dbraw/zinc/68/75/13/1316687513.db2.gz ZKXBYPYOHPVSHO-INIZCTEOSA-N 1 3 347.478 2.953 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)[C@H]1CCCc2ccc(F)cc21)N(C)C ZINC001265060022 1316706196 /nfs/dbraw/zinc/70/61/96/1316706196.db2.gz TTXXIHVJAIBYMJ-OALUTQOASA-N 1 3 349.494 2.981 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)[C@H]1CCCc2ccc(F)cc21)N(C)C ZINC001265060022 1316706198 /nfs/dbraw/zinc/70/61/98/1316706198.db2.gz TTXXIHVJAIBYMJ-OALUTQOASA-N 1 3 349.494 2.981 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001265137296 1316733283 /nfs/dbraw/zinc/73/32/83/1316733283.db2.gz QXIADFGPAWYSHJ-VDRJNSHASA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001265137296 1316733285 /nfs/dbraw/zinc/73/32/85/1316733285.db2.gz QXIADFGPAWYSHJ-VDRJNSHASA-N 1 3 327.900 2.584 10 0 EFAEHO C[C@@H](c1ccccc1F)[N@H+](CCCNC(=O)[C@@H]1CCCN1C)C1CC1 ZINC001265155802 1316741840 /nfs/dbraw/zinc/74/18/40/1316741840.db2.gz DZJDHISIUIGSNP-KXBFYZLASA-N 1 3 347.478 2.952 10 0 EFAEHO C[C@@H](c1ccccc1F)[N@@H+](CCCNC(=O)[C@@H]1CCCN1C)C1CC1 ZINC001265155802 1316741842 /nfs/dbraw/zinc/74/18/42/1316741842.db2.gz DZJDHISIUIGSNP-KXBFYZLASA-N 1 3 347.478 2.952 10 0 EFAEHO Cc1ccc(C[N@@H+](CCCNC(=O)[C@H]2CCCN2C)C2CC2)cc1F ZINC001265156361 1316742249 /nfs/dbraw/zinc/74/22/49/1316742249.db2.gz WXYAXVNPODYSDN-LJQANCHMSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(C[N@H+](CCCNC(=O)[C@H]2CCCN2C)C2CC2)cc1F ZINC001265156361 1316742252 /nfs/dbraw/zinc/74/22/52/1316742252.db2.gz WXYAXVNPODYSDN-LJQANCHMSA-N 1 3 347.478 2.699 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)NCCCN(CCC(F)(F)F)C1CC1 ZINC001265183705 1316746284 /nfs/dbraw/zinc/74/62/84/1316746284.db2.gz CQDGXFOCKRWIFB-KBPBESRZSA-N 1 3 349.441 2.782 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CC1=CCCCC1)C1CC1 ZINC001265358554 1316789618 /nfs/dbraw/zinc/78/96/18/1316789618.db2.gz LORSFFGKKBZVIU-RBUKOAKNSA-N 1 3 333.520 2.846 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CC/C=C/c2ccccc2)C1 ZINC001265459709 1316808866 /nfs/dbraw/zinc/80/88/66/1316808866.db2.gz KGAALTMMLREAJZ-SSVWKNEZSA-N 1 3 329.488 2.621 10 0 EFAEHO OC1(C[NH2+]CCOC2CCCCC2)CCN(Cc2ccccc2)CC1 ZINC000701401322 1316835086 /nfs/dbraw/zinc/83/50/86/1316835086.db2.gz GJSSRPAMEYZKFZ-UHFFFAOYSA-N 1 3 346.515 2.952 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@H](C[NH2+]CCC(C)(C)C)C1)N(C)C ZINC001265613009 1316836772 /nfs/dbraw/zinc/83/67/72/1316836772.db2.gz GSNABMUYPXVBFC-SJORKVTESA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H](C[NH2+]CCCc2ccccc2)C1)N(C)C ZINC001265624508 1316837759 /nfs/dbraw/zinc/83/77/59/1316837759.db2.gz SUUQKARSGFTPSF-PMACEKPBSA-N 1 3 345.531 2.788 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001265862468 1316895848 /nfs/dbraw/zinc/89/58/48/1316895848.db2.gz BJXQNSOASWGWIJ-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1cccc(C)c1C[N@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001265862468 1316895849 /nfs/dbraw/zinc/89/58/49/1316895849.db2.gz BJXQNSOASWGWIJ-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@H+](C)C[C@@H]2CCCC(F)(F)C2)CCC1 ZINC001265863196 1316896626 /nfs/dbraw/zinc/89/66/26/1316896626.db2.gz WLRWABZRXJFTEJ-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@@H+](C)C[C@@H]2CCCC(F)(F)C2)CCC1 ZINC001265863196 1316896628 /nfs/dbraw/zinc/89/66/28/1316896628.db2.gz WLRWABZRXJFTEJ-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCCC[N@H+](C)CCc1ccccc1 ZINC001265933364 1316919147 /nfs/dbraw/zinc/91/91/47/1316919147.db2.gz KPOYBOWLLLRJEK-FQEVSTJZSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCCC[N@@H+](C)CCc1ccccc1 ZINC001265933364 1316919149 /nfs/dbraw/zinc/91/91/49/1316919149.db2.gz KPOYBOWLLLRJEK-FQEVSTJZSA-N 1 3 345.531 2.930 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001266049610 1316976455 /nfs/dbraw/zinc/97/64/55/1316976455.db2.gz YBZASIRMHZVCGS-SCBHQAGPSA-N 1 3 341.927 2.974 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001266049610 1316976457 /nfs/dbraw/zinc/97/64/57/1316976457.db2.gz YBZASIRMHZVCGS-SCBHQAGPSA-N 1 3 341.927 2.974 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NCCCN(Cc2ccsc2)C2CC2)C1 ZINC001266169091 1317119304 /nfs/dbraw/zinc/11/93/04/1317119304.db2.gz PVUJQLPGKPSQOG-OAHLLOKOSA-N 1 3 335.517 2.561 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NCCCN(Cc2ccsc2)C2CC2)C1 ZINC001266169091 1317119309 /nfs/dbraw/zinc/11/93/09/1317119309.db2.gz PVUJQLPGKPSQOG-OAHLLOKOSA-N 1 3 335.517 2.561 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CCCN(CC2=CCCCC2)C1 ZINC001266222147 1317162457 /nfs/dbraw/zinc/16/24/57/1317162457.db2.gz OMGSSJXKOYMPBK-RBUKOAKNSA-N 1 3 333.520 2.942 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CCCN(CC2=CCCCC2)C1 ZINC001266222147 1317162463 /nfs/dbraw/zinc/16/24/63/1317162463.db2.gz OMGSSJXKOYMPBK-RBUKOAKNSA-N 1 3 333.520 2.942 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CCCN(CC2=CCCCC2)C1 ZINC001266222148 1317163333 /nfs/dbraw/zinc/16/33/33/1317163333.db2.gz OMGSSJXKOYMPBK-RTBURBONSA-N 1 3 333.520 2.942 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CCCN(CC2=CCCCC2)C1 ZINC001266222148 1317163338 /nfs/dbraw/zinc/16/33/38/1317163338.db2.gz OMGSSJXKOYMPBK-RTBURBONSA-N 1 3 333.520 2.942 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)C2CCC2)C[C@@H]1C[NH2+]CCCC(C)(C)C ZINC001279115975 1317193801 /nfs/dbraw/zinc/19/38/01/1317193801.db2.gz XXXHNQDUBCKPAR-IRXDYDNUSA-N 1 3 337.552 2.981 10 0 EFAEHO CCc1ccc(CN2CC=C(CNC(=O)CC[N@@H+](C)CC)CC2)cc1 ZINC001279669147 1317352053 /nfs/dbraw/zinc/35/20/53/1317352053.db2.gz SJYJHYULSMCGLO-UHFFFAOYSA-N 1 3 343.515 2.839 10 0 EFAEHO CCc1ccc(CN2CC=C(CNC(=O)CC[N@H+](C)CC)CC2)cc1 ZINC001279669147 1317352055 /nfs/dbraw/zinc/35/20/55/1317352055.db2.gz SJYJHYULSMCGLO-UHFFFAOYSA-N 1 3 343.515 2.839 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC001279676294 1317357139 /nfs/dbraw/zinc/35/71/39/1317357139.db2.gz YXQKXILQHACTMH-MRXNPFEDSA-N 1 3 343.462 2.512 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC001279676294 1317357149 /nfs/dbraw/zinc/35/71/49/1317357149.db2.gz YXQKXILQHACTMH-MRXNPFEDSA-N 1 3 343.462 2.512 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)cc1C ZINC001279999380 1317433076 /nfs/dbraw/zinc/43/30/76/1317433076.db2.gz JSONPDDCGWOKLM-QUCCMNQESA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H]2CCN(C(=O)CN(C)C3CCC3)C2)cs1 ZINC001280073756 1317447942 /nfs/dbraw/zinc/44/79/42/1317447942.db2.gz QHAIMAXFRYZIOV-INIZCTEOSA-N 1 3 349.544 2.869 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CC[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001280297173 1317499516 /nfs/dbraw/zinc/49/95/16/1317499516.db2.gz RXDCOGUQBQPFAG-QGZVFWFLSA-N 1 3 347.478 2.558 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@H]1CC[C@H](NC(=O)Cc2nc[nH]c2C)CC1 ZINC001280379190 1317533644 /nfs/dbraw/zinc/53/36/44/1317533644.db2.gz XXWNIYYORHPAQT-FXVRUJLTSA-N 1 3 332.492 2.882 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]CCC(F)(F)F)CC1 ZINC001280381032 1317534534 /nfs/dbraw/zinc/53/45/34/1317534534.db2.gz FBXZJLBWHDQQEX-HDJSIYSDSA-N 1 3 337.430 2.544 10 0 EFAEHO CCC/C=C/CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001316606233 1317804192 /nfs/dbraw/zinc/80/41/92/1317804192.db2.gz NFSIJSDJZXPFRF-OZHPBFKBSA-N 1 3 335.536 2.996 10 0 EFAEHO CCC/C=C/CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001316606233 1317804203 /nfs/dbraw/zinc/80/42/03/1317804203.db2.gz NFSIJSDJZXPFRF-OZHPBFKBSA-N 1 3 335.536 2.996 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(CC[NH2+]CCCC2CCC2)CC1 ZINC001318875530 1328730549 /nfs/dbraw/zinc/73/05/49/1328730549.db2.gz VXLZZTKSYLYVKH-IBGZPJMESA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@H]1CC[N@@H+]1CCC1=CCCCC1)N(C)C ZINC001316607739 1317921384 /nfs/dbraw/zinc/92/13/84/1317921384.db2.gz UURZDWIRSFYALI-RTBURBONSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@H]1CC[N@H+]1CCC1=CCCCC1)N(C)C ZINC001316607739 1317921394 /nfs/dbraw/zinc/92/13/94/1317921394.db2.gz UURZDWIRSFYALI-RTBURBONSA-N 1 3 335.536 2.996 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(CC[NH2+]CC2CCC2)CC1 ZINC001318936672 1328744641 /nfs/dbraw/zinc/74/46/41/1328744641.db2.gz ABOPJSBVQPWJGP-IBGZPJMESA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C(C)C)c(C)s1 ZINC001403059968 1364264320 /nfs/dbraw/zinc/26/43/20/1364264320.db2.gz ZOVUTIAWEGNAGX-ZIAGYGMSSA-N 1 3 325.522 2.688 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[N@H+](CCCCCF)CC2(C)C)CCC1 ZINC001281557898 1318451886 /nfs/dbraw/zinc/45/18/86/1318451886.db2.gz QUWVWSYCQOQLFR-MRXNPFEDSA-N 1 3 341.515 2.827 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[N@@H+](CCCCCF)CC2(C)C)CCC1 ZINC001281557898 1318451894 /nfs/dbraw/zinc/45/18/94/1318451894.db2.gz QUWVWSYCQOQLFR-MRXNPFEDSA-N 1 3 341.515 2.827 10 0 EFAEHO CC/C=C/CC[N@H+](CC)CC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001281833233 1318598306 /nfs/dbraw/zinc/59/83/06/1318598306.db2.gz FNKNBHXTDCWNAM-OVKVCFKUSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](CC)CC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001281833233 1318598321 /nfs/dbraw/zinc/59/83/21/1318598321.db2.gz FNKNBHXTDCWNAM-OVKVCFKUSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@H]1C[NH2+]CCCc1ccccc1)N(C)C ZINC001281890631 1318616482 /nfs/dbraw/zinc/61/64/82/1318616482.db2.gz VZQGTSURCXMTCT-VQTJNVASSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1CC(C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001282014068 1318664708 /nfs/dbraw/zinc/66/47/08/1318664708.db2.gz QTPYTAIZOKXZIH-ZWCFYGAZSA-N 1 3 343.515 2.770 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@@H]1C[NH2+]CCCCCF ZINC001319132562 1328785640 /nfs/dbraw/zinc/78/56/40/1328785640.db2.gz PXKBLJJQKUQHGF-SJORKVTESA-N 1 3 327.488 2.581 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001319132565 1328785815 /nfs/dbraw/zinc/78/58/15/1328785815.db2.gz QBAWEACASNSAQM-HXUWFJFHSA-N 1 3 345.531 2.712 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001319132918 1328786721 /nfs/dbraw/zinc/78/67/21/1328786721.db2.gz VFUNPEGOPUTFCV-CQSZACIVSA-N 1 3 348.318 2.762 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@@H]2C(CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001282858202 1319165573 /nfs/dbraw/zinc/16/55/73/1319165573.db2.gz HXZDXPKEJCPYGF-BHNSQDDESA-N 1 3 347.547 2.901 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@@H]2C(CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001282858202 1319165576 /nfs/dbraw/zinc/16/55/76/1319165576.db2.gz HXZDXPKEJCPYGF-BHNSQDDESA-N 1 3 347.547 2.901 10 0 EFAEHO C[C@H](CCC[NH2+]Cc1ccc(F)cc1)NC(=O)C1(N(C)C)CCC1 ZINC001283185709 1319408802 /nfs/dbraw/zinc/40/88/02/1319408802.db2.gz LTPVDUQWLNWXIW-OAHLLOKOSA-N 1 3 335.467 2.685 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@H](C)C[NH2+]CC=C(Cl)Cl ZINC001319284160 1328832017 /nfs/dbraw/zinc/83/20/17/1328832017.db2.gz FKCHSDKXRWUGST-OLZOCXBDSA-N 1 3 336.307 2.522 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1C[C@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001284033090 1320158054 /nfs/dbraw/zinc/15/80/54/1320158054.db2.gz NPSDYIPPNYCTPS-ICSRJNTNSA-N 1 3 345.531 2.847 10 0 EFAEHO CCCC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN3CCC(C)CC3)C[C@@H]21 ZINC001284095290 1320190536 /nfs/dbraw/zinc/19/05/36/1320190536.db2.gz FSRYIDGJSDGGMD-GBESFXJTSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H](C[NH2+]CCc2ccccc2F)C1 ZINC001284242551 1320283094 /nfs/dbraw/zinc/28/30/94/1320283094.db2.gz FENQNYFEHVSSJZ-FUHWJXTLSA-N 1 3 349.494 2.583 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@@H]([NH2+]CCCc2ccccc2)C(C)(C)C1)N(C)C ZINC001284323606 1320319369 /nfs/dbraw/zinc/31/93/69/1320319369.db2.gz NQECUEPKKMPBGB-RBUKOAKNSA-N 1 3 345.531 2.786 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C2CC([NH2+]CCCC3CCCC3)C2)C1 ZINC001284790859 1320528662 /nfs/dbraw/zinc/52/86/62/1320528662.db2.gz XJRMESDVFYDWSV-IPJUCJBFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)=CCN1CC=C(CNC(=O)CCCC[NH+]2CCCC2)CC1 ZINC001284994574 1320639262 /nfs/dbraw/zinc/63/92/62/1320639262.db2.gz ILTOCNXVWOCFPD-UHFFFAOYSA-N 1 3 333.520 2.967 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H](C)C[NH2+]C/C=C/c1ccccc1)N(C)C ZINC001319563706 1328918478 /nfs/dbraw/zinc/91/84/78/1328918478.db2.gz WTJXDXVRTWGUEC-OWQTYREESA-N 1 3 331.504 2.723 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]CCc1cccs1 ZINC001319593627 1328923724 /nfs/dbraw/zinc/92/37/24/1328923724.db2.gz OWAACXJEMQCHFV-NVXWUHKLSA-N 1 3 337.533 2.602 10 0 EFAEHO CC(C)C[C@@H](CNCCF)NC(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001319609466 1328929259 /nfs/dbraw/zinc/92/92/59/1328929259.db2.gz MVQJSWAREJTNAH-IRXDYDNUSA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)C[C@@H](CNCCF)NC(=O)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001319609466 1328929262 /nfs/dbraw/zinc/92/92/62/1328929262.db2.gz MVQJSWAREJTNAH-IRXDYDNUSA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C[NH2+]C/C=C\Cl)C1CCCCC1)N(C)C ZINC001319658327 1328941270 /nfs/dbraw/zinc/94/12/70/1328941270.db2.gz YFHDVFRSCLDKHM-BTDPBSJTSA-N 1 3 343.943 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C[NH2+]C/C=C/Cl)C1CCCCC1)N(C)C ZINC001319659770 1328941324 /nfs/dbraw/zinc/94/13/24/1328941324.db2.gz NIRSLQFLSQVCOG-IRZHHCKBSA-N 1 3 329.916 2.734 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C[NH2+]C/C=C\Cl)C1CCCCC1)N(C)C ZINC001319659771 1328941350 /nfs/dbraw/zinc/94/13/50/1328941350.db2.gz NIRSLQFLSQVCOG-OXSAEWAQSA-N 1 3 329.916 2.734 10 0 EFAEHO CC(C)=CCN(C)C[C@H](C)NC(=O)c1ccccc1CC[NH+](C)C ZINC001322210916 1329438456 /nfs/dbraw/zinc/43/84/56/1329438456.db2.gz QJLVMZKYOGSFQY-KRWDZBQOSA-N 1 3 331.504 2.807 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@H]1CC[NH2+]Cc1ccsc1)N(C)C ZINC001319788754 1328989842 /nfs/dbraw/zinc/98/98/42/1328989842.db2.gz SFTKTHXWFCPJEY-DLBZAZTESA-N 1 3 337.533 2.949 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@H]1CC[NH2+]Cc1cnccc1C)N(C)C ZINC001319789009 1328990171 /nfs/dbraw/zinc/99/01/71/1328990171.db2.gz VYDHPTIGJUYCFG-RBUKOAKNSA-N 1 3 346.519 2.591 10 0 EFAEHO O=C(CN1CCCC1)N1CCCC[C@@H]1CC[NH2+]CC=C(Cl)Cl ZINC001319793351 1328993013 /nfs/dbraw/zinc/99/30/13/1328993013.db2.gz ULBVTLBPBRODOM-CQSZACIVSA-N 1 3 348.318 2.762 10 0 EFAEHO CCC/C=C/CC[NH2+]C[C@@H]1[C@@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001319860588 1329017018 /nfs/dbraw/zinc/01/70/18/1329017018.db2.gz GXZPRLBPHHSRII-OZZQIWQLSA-N 1 3 332.492 2.915 10 0 EFAEHO CCC/C=C\CC[NH2+]C[C@@H]1[C@@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001319860586 1329017376 /nfs/dbraw/zinc/01/73/76/1329017376.db2.gz GXZPRLBPHHSRII-BGYNLAARSA-N 1 3 332.492 2.915 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H](C)NCc1ccccc1F)[NH+]1CCCCC1 ZINC001491682336 1323787980 /nfs/dbraw/zinc/78/79/80/1323787980.db2.gz LDPIAOIERNUUIF-QFBILLFUSA-N 1 3 349.494 2.931 10 0 EFAEHO CN(CC(=O)N1CC[C@H]([NH2+]CCCc2ccccc2)C1)CC(C)(C)C ZINC001491752048 1323860581 /nfs/dbraw/zinc/86/05/81/1323860581.db2.gz DVRLSMBKOVAPBC-IBGZPJMESA-N 1 3 345.531 2.788 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H]([NH2+]CCCCc3ccccc3)C2)C1 ZINC001491752185 1323860668 /nfs/dbraw/zinc/86/06/68/1323860668.db2.gz SSRXVNPJIJHJKF-ICSRJNTNSA-N 1 3 343.515 2.542 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](C[NH2+]CCCc2ccccc2)C1)N(C)C ZINC001491833261 1323927242 /nfs/dbraw/zinc/92/72/42/1323927242.db2.gz MVHZFGODUQJRLF-WOJBJXKFSA-N 1 3 345.531 2.644 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[NH2+]CCCc2cccc(C)c2)C1)N(C)C ZINC001491847719 1323943051 /nfs/dbraw/zinc/94/30/51/1323943051.db2.gz KJXRZSKZFBQVBX-WOJBJXKFSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001491856958 1323952126 /nfs/dbraw/zinc/95/21/26/1323952126.db2.gz WFXHHLFNDWPCCV-SJLPKXTDSA-N 1 3 335.467 2.548 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2CCC[C@H]([NH2+]CCCF)C2)c1 ZINC001491897665 1324007462 /nfs/dbraw/zinc/00/74/62/1324007462.db2.gz ZEZQMOIFHCVLDR-ROUUACIJSA-N 1 3 335.467 2.738 10 0 EFAEHO C[C@H](F)CC[N@H+](C)[C@@H]1CCCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001491924390 1324039285 /nfs/dbraw/zinc/03/92/85/1324039285.db2.gz BXZMOCRZQOIAEV-DLBZAZTESA-N 1 3 341.515 2.922 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)[C@@H]1CCCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001491924390 1324039291 /nfs/dbraw/zinc/03/92/91/1324039291.db2.gz BXZMOCRZQOIAEV-DLBZAZTESA-N 1 3 341.515 2.922 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccc2cc[nH]c2c1)NC(=O)CN(C)C1CCC1 ZINC001320444553 1329132368 /nfs/dbraw/zinc/13/23/68/1329132368.db2.gz AGMKSDSKPGYCIQ-OAHLLOKOSA-N 1 3 342.487 2.637 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NCC[C@@H](C)NC/C(Cl)=C/Cl ZINC001492022648 1324135038 /nfs/dbraw/zinc/13/50/38/1324135038.db2.gz VKXCQDSHDQXMIJ-XWJOTYRJSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NCC[C@@H](C)NC/C(Cl)=C/Cl ZINC001492022648 1324135041 /nfs/dbraw/zinc/13/50/41/1324135041.db2.gz VKXCQDSHDQXMIJ-XWJOTYRJSA-N 1 3 336.307 2.663 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H](C)NC(=O)[C@H](C(C)C)N(C)C)cs1 ZINC001320453716 1329135387 /nfs/dbraw/zinc/13/53/87/1329135387.db2.gz JCGFTHYUSHHCJT-BBRMVZONSA-N 1 3 325.522 2.627 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc2ncccc2c1)N(C)C ZINC001320463739 1329137952 /nfs/dbraw/zinc/13/79/52/1329137952.db2.gz JBYWQKDEHSFBIF-HNAYVOBHSA-N 1 3 342.487 2.559 10 0 EFAEHO CN(CCNC(=O)CC[NH+](C)C)CCc1cc(Cl)ccc1Cl ZINC001492402152 1324485483 /nfs/dbraw/zinc/48/54/83/1324485483.db2.gz JSIYKMUZRZSFIG-UHFFFAOYSA-N 1 3 346.302 2.536 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001320548489 1329160341 /nfs/dbraw/zinc/16/03/41/1329160341.db2.gz LJUGMOHNJBYNHR-IAGOWNOFSA-N 1 3 331.504 2.575 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001316850292 1324693031 /nfs/dbraw/zinc/69/30/31/1324693031.db2.gz DMGPKHNJGUIZGQ-KRWDZBQOSA-N 1 3 331.504 2.583 10 0 EFAEHO Cc1ccc(C)c(C[N@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001316850292 1324693037 /nfs/dbraw/zinc/69/30/37/1324693037.db2.gz DMGPKHNJGUIZGQ-KRWDZBQOSA-N 1 3 331.504 2.583 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H](C)NC(=O)[C@@H](C(C)C)N(C)C)cc1F ZINC001320615734 1329178958 /nfs/dbraw/zinc/17/89/58/1329178958.db2.gz VODIJCVNUFPHPO-MAUKXSAKSA-N 1 3 337.483 2.705 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001316861754 1324903005 /nfs/dbraw/zinc/90/30/05/1324903005.db2.gz FTWNUINMUPOCNI-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO Cc1ccc(C)c(C[N@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001316861754 1324903009 /nfs/dbraw/zinc/90/30/09/1324903009.db2.gz FTWNUINMUPOCNI-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]CCCC(C)C)N(C)C ZINC001316701979 1325074932 /nfs/dbraw/zinc/07/49/32/1325074932.db2.gz LOZRFUOELLHYNE-FGTMMUONSA-N 1 3 325.541 2.980 10 0 EFAEHO CC/C=C/CC[N@H+](C)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001316850637 1325220161 /nfs/dbraw/zinc/22/01/61/1325220161.db2.gz GRQVOEJMTITIFM-UCFODXPJSA-N 1 3 341.515 2.993 10 0 EFAEHO CC/C=C/CC[N@@H+](C)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001316850637 1325220170 /nfs/dbraw/zinc/22/01/70/1325220170.db2.gz GRQVOEJMTITIFM-UCFODXPJSA-N 1 3 341.515 2.993 10 0 EFAEHO C[C@H](c1cccc(F)c1)[N@H+](C)CCCNC(=O)CN1CC[C@H](C)C1 ZINC001316851472 1325223132 /nfs/dbraw/zinc/22/31/32/1325223132.db2.gz XLINNXVDEKGIBI-JKSUJKDBSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@H](c1cccc(F)c1)[N@@H+](C)CCCNC(=O)CN1CC[C@H](C)C1 ZINC001316851472 1325223142 /nfs/dbraw/zinc/22/31/42/1325223142.db2.gz XLINNXVDEKGIBI-JKSUJKDBSA-N 1 3 335.467 2.667 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@H+](Cc2ccccc2)C2CC2)CCC1 ZINC001316920511 1325351573 /nfs/dbraw/zinc/35/15/73/1325351573.db2.gz UWRQJHWNCUWMRZ-UHFFFAOYSA-N 1 3 329.488 2.642 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@@H+](Cc2ccccc2)C2CC2)CCC1 ZINC001316920511 1325351583 /nfs/dbraw/zinc/35/15/83/1325351583.db2.gz UWRQJHWNCUWMRZ-UHFFFAOYSA-N 1 3 329.488 2.642 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001316987848 1325451678 /nfs/dbraw/zinc/45/16/78/1325451678.db2.gz OAGMMCKJZDWEMP-WENXUGBFSA-N 1 3 339.499 2.746 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001316987848 1325451689 /nfs/dbraw/zinc/45/16/89/1325451689.db2.gz OAGMMCKJZDWEMP-WENXUGBFSA-N 1 3 339.499 2.746 10 0 EFAEHO CCC/C=C/CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001317051291 1325523358 /nfs/dbraw/zinc/52/33/58/1325523358.db2.gz AVYZGOJRYAXIAX-DCWZWWHRSA-N 1 3 333.520 2.750 10 0 EFAEHO CCC/C=C/CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001317051291 1325523365 /nfs/dbraw/zinc/52/33/65/1325523365.db2.gz AVYZGOJRYAXIAX-DCWZWWHRSA-N 1 3 333.520 2.750 10 0 EFAEHO CCN(CC[NH2+]CC=C(C)C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001320840440 1329308714 /nfs/dbraw/zinc/30/87/14/1329308714.db2.gz IXMGVXSKCLBFSG-GOSISDBHSA-N 1 3 327.488 2.603 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001320891400 1329315564 /nfs/dbraw/zinc/31/55/64/1329315564.db2.gz HUVPGXVDITTWEI-PKOBYXMFSA-N 1 3 349.494 2.884 10 0 EFAEHO CCN(CC[NH2+]Cc1ccccc1C)C(=O)[C@@H]1CCCCN1CC ZINC001320928427 1329320671 /nfs/dbraw/zinc/32/06/71/1329320671.db2.gz KHVCHQUEBJBVQN-IBGZPJMESA-N 1 3 331.504 2.808 10 0 EFAEHO CCN(CC[NH2+]C[C@H]1CCc2ccccc2C1)C(=O)CN(C)C(C)C ZINC001320929561 1329321485 /nfs/dbraw/zinc/32/14/85/1329321485.db2.gz RWUGMXUFKNBHEU-SFHVURJKSA-N 1 3 345.531 2.570 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C/CNC(=O)[C@@H]1CCC[N@H+]1C(C)C ZINC001321056261 1329337318 /nfs/dbraw/zinc/33/73/18/1329337318.db2.gz CZFKMMQRWSWBNX-PXPVJAHISA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C/CNC(=O)[C@@H]1CCC[N@@H+]1C(C)C ZINC001321056261 1329337320 /nfs/dbraw/zinc/33/73/20/1329337320.db2.gz CZFKMMQRWSWBNX-PXPVJAHISA-N 1 3 347.478 2.769 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)NC/C=C\CNC/C=C/Cl ZINC001321126751 1329346681 /nfs/dbraw/zinc/34/66/81/1329346681.db2.gz PZRHWIGDIUHBOQ-BQGCWICQSA-N 1 3 327.900 2.654 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)NC/C=C\CNC/C=C/Cl ZINC001321126751 1329346684 /nfs/dbraw/zinc/34/66/84/1329346684.db2.gz PZRHWIGDIUHBOQ-BQGCWICQSA-N 1 3 327.900 2.654 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C/CNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001321187791 1329354492 /nfs/dbraw/zinc/35/44/92/1329354492.db2.gz WSSAJWXVWJJADS-SNAWJCMRSA-N 1 3 347.478 2.771 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C/CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001321208552 1329357021 /nfs/dbraw/zinc/35/70/21/1329357021.db2.gz AGWJIPHFKZIDDU-XLYSIVADSA-N 1 3 347.478 2.626 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C/CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001321208552 1329357023 /nfs/dbraw/zinc/35/70/23/1329357023.db2.gz AGWJIPHFKZIDDU-XLYSIVADSA-N 1 3 347.478 2.626 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C\C[NH2+][C@H](C)c1cc(C)ccc1C)N(C)C ZINC001321253597 1329363594 /nfs/dbraw/zinc/36/35/94/1329363594.db2.gz VXWDJRBKBKSGJU-TXKXQZRUSA-N 1 3 331.504 2.967 10 0 EFAEHO CC[C@H]([NH2+]C/C=C/CNC(=O)CN1CC[C@@H](C)C1)c1ccccc1 ZINC001321252662 1329363658 /nfs/dbraw/zinc/36/36/58/1329363658.db2.gz WLWYMUQWEAZNTN-KRZVHVFCSA-N 1 3 329.488 2.742 10 0 EFAEHO Cc1cc(C[NH2+]C/C=C\CNC(=O)CN2CCC(C)CC2)cs1 ZINC001321302533 1329370214 /nfs/dbraw/zinc/37/02/14/1329370214.db2.gz FKIQVVSZPSRULL-ARJAWSKDSA-N 1 3 335.517 2.550 10 0 EFAEHO CN(C)C1(C(=O)N2CCCC[C@H]2C[NH2+]CCCCCF)CCC1 ZINC001317189195 1327708417 /nfs/dbraw/zinc/70/84/17/1327708417.db2.gz HULBCZIRZURQQC-INIZCTEOSA-N 1 3 327.488 2.581 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H]2CCCCN2C(=O)CN(C)C(C)C)cc1 ZINC001317200155 1327727306 /nfs/dbraw/zinc/72/73/06/1327727306.db2.gz PDEPGCLGTOSMBV-FQEVSTJZSA-N 1 3 345.531 2.848 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](CC2=CCCCC2)C1 ZINC001317205528 1327739231 /nfs/dbraw/zinc/73/92/31/1327739231.db2.gz PRRGPACFARKGIO-MAUKXSAKSA-N 1 3 344.503 2.978 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](CC2=CCCCC2)C1 ZINC001317205528 1327739238 /nfs/dbraw/zinc/73/92/38/1327739238.db2.gz PRRGPACFARKGIO-MAUKXSAKSA-N 1 3 344.503 2.978 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H]1CCC[N@H+](CC2=CCCCC2)C1 ZINC001317205527 1327739469 /nfs/dbraw/zinc/73/94/69/1327739469.db2.gz PRRGPACFARKGIO-CRAIPNDOSA-N 1 3 344.503 2.978 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](CC2=CCCCC2)C1 ZINC001317205527 1327739473 /nfs/dbraw/zinc/73/94/73/1327739473.db2.gz PRRGPACFARKGIO-CRAIPNDOSA-N 1 3 344.503 2.978 10 0 EFAEHO CCC[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CCCC1 ZINC001495944119 1327810753 /nfs/dbraw/zinc/81/07/53/1327810753.db2.gz POYHWJVJJNZQNT-SFHVURJKSA-N 1 3 327.488 2.628 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@H]([N@H+](C)CCCCCF)C2)CCC1 ZINC001317374897 1327920187 /nfs/dbraw/zinc/92/01/87/1327920187.db2.gz HDEJESKRFZZBEM-INIZCTEOSA-N 1 3 327.488 2.533 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@H]([N@@H+](C)CCCCCF)C2)CCC1 ZINC001317374897 1327920190 /nfs/dbraw/zinc/92/01/90/1327920190.db2.gz HDEJESKRFZZBEM-INIZCTEOSA-N 1 3 327.488 2.533 10 0 EFAEHO CC(C)N(C)CC(=O)NC/C=C\C[NH2+][C@H]1CCCc2ccccc21 ZINC001321419371 1329384670 /nfs/dbraw/zinc/38/46/70/1329384670.db2.gz PHJUDIPUDICJPE-RURPWVQCSA-N 1 3 329.488 2.666 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[NH2+]Cc1ccc2ccccc2c1)N(C)C ZINC001317627395 1328209209 /nfs/dbraw/zinc/20/92/09/1328209209.db2.gz HAIPAWDFROCCEN-IBGZPJMESA-N 1 3 327.472 2.728 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]CC[C@H]1CCCC1(F)F ZINC001317662845 1328253096 /nfs/dbraw/zinc/25/30/96/1328253096.db2.gz ABNXPXVNWUNTGM-HZPDHXFCSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)=CCN[C@@H](CNC(=O)[C@@H]1C[NH+]2CCC1CC2)c1ccccc1 ZINC001317718346 1328327188 /nfs/dbraw/zinc/32/71/88/1328327188.db2.gz NDMOCGVFXAGSAA-UXHICEINSA-N 1 3 341.499 2.742 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@H]2CC[N@H+](CC3=CCCCC3)C2)CCC1 ZINC001317788992 1328378611 /nfs/dbraw/zinc/37/86/11/1328378611.db2.gz MPWQJECSBPYKDG-SFHVURJKSA-N 1 3 333.520 2.799 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@H]2CC[N@@H+](CC3=CCCCC3)C2)CCC1 ZINC001317788992 1328378618 /nfs/dbraw/zinc/37/86/18/1328378618.db2.gz MPWQJECSBPYKDG-SFHVURJKSA-N 1 3 333.520 2.799 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](C[N@H+](C)CCC2=CCCCC2)C1 ZINC001317830808 1328401764 /nfs/dbraw/zinc/40/17/64/1328401764.db2.gz KGJNWAARWLRUFT-RTBURBONSA-N 1 3 333.520 2.751 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](C[N@@H+](C)CCC2=CCCCC2)C1 ZINC001317830808 1328401769 /nfs/dbraw/zinc/40/17/69/1328401769.db2.gz KGJNWAARWLRUFT-RTBURBONSA-N 1 3 333.520 2.751 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@H](C[N@H+](C)CCCCCF)C1 ZINC001317861471 1328423064 /nfs/dbraw/zinc/42/30/64/1328423064.db2.gz ASNZBDRQQPMQLQ-QZTJIDSGSA-N 1 3 341.515 2.781 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@H](C[N@@H+](C)CCCCCF)C1 ZINC001317861471 1328423072 /nfs/dbraw/zinc/42/30/72/1328423072.db2.gz ASNZBDRQQPMQLQ-QZTJIDSGSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCc1ccc(C[NH2+]CCCN(C)C(=O)[C@@H]2CCCN2C)cc1 ZINC001322441338 1329458931 /nfs/dbraw/zinc/45/89/31/1329458931.db2.gz BAKJFQSVOZSUHX-IBGZPJMESA-N 1 3 331.504 2.671 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]CCCN(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001322694801 1329480619 /nfs/dbraw/zinc/48/06/19/1329480619.db2.gz VKYYUCIJGBAXIP-IAGOWNOFSA-N 1 3 347.503 2.536 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)CN1CCCC1)c1ccc(Cl)cc1 ZINC001322834760 1329492688 /nfs/dbraw/zinc/49/26/88/1329492688.db2.gz HMNQMJMXHSDLTP-OAHLLOKOSA-N 1 3 337.895 2.935 10 0 EFAEHO CN(CCC[NH2+][C@@H]1CCc2c1cccc2Cl)C(=O)CN1CCCC1 ZINC001322838000 1329493084 /nfs/dbraw/zinc/49/30/84/1329493084.db2.gz XCGPHHBCKBEADT-GOSISDBHSA-N 1 3 349.906 2.861 10 0 EFAEHO CC(C)CCCN1Cc2ccccc2C[C@@H]1CNC(=O)CC[NH+](C)C ZINC001381028774 1348030861 /nfs/dbraw/zinc/03/08/61/1348030861.db2.gz DUMJGJANWFNYIJ-HXUWFJFHSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCN1CCC1=CCCCC1)[NH+]1CCCC1 ZINC001323276741 1329530168 /nfs/dbraw/zinc/53/01/68/1329530168.db2.gz IDIIVDAIDULXFN-GOSISDBHSA-N 1 3 333.520 2.942 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C(C)C)N(C)C ZINC001323683857 1329561330 /nfs/dbraw/zinc/56/13/30/1329561330.db2.gz HOOWDHVCRQONGS-ZIGQXYKSSA-N 1 3 335.536 2.994 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C(C)C)N(C)C ZINC001323683857 1329561332 /nfs/dbraw/zinc/56/13/32/1329561332.db2.gz HOOWDHVCRQONGS-ZIGQXYKSSA-N 1 3 335.536 2.994 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001323874015 1329582320 /nfs/dbraw/zinc/58/23/20/1329582320.db2.gz QUPXOBOJWIVWAW-VUNJVDIESA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001323874015 1329582323 /nfs/dbraw/zinc/58/23/23/1329582323.db2.gz QUPXOBOJWIVWAW-VUNJVDIESA-N 1 3 335.536 2.997 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@H]2C[NH2+]CCCc2ccsc2)CCC1 ZINC001324173752 1329605320 /nfs/dbraw/zinc/60/53/20/1329605320.db2.gz BLGTXOOZKYUZNT-KRWDZBQOSA-N 1 3 349.544 2.746 10 0 EFAEHO CCCC[NH2+]C[C@]1(C)CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001324790807 1329658286 /nfs/dbraw/zinc/65/82/86/1329658286.db2.gz SRQMPWHSHPZDAA-OALUTQOASA-N 1 3 341.515 2.827 10 0 EFAEHO CCc1ccccc1[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NCC=C(C)C ZINC001325366329 1329683097 /nfs/dbraw/zinc/68/30/97/1329683097.db2.gz MPVBVRYMGMAQFG-QUCCMNQESA-N 1 3 343.515 2.914 10 0 EFAEHO CCc1ccccc1[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NCC=C(C)C ZINC001325366329 1329683098 /nfs/dbraw/zinc/68/30/98/1329683098.db2.gz MPVBVRYMGMAQFG-QUCCMNQESA-N 1 3 343.515 2.914 10 0 EFAEHO C[C@H]([NH2+]CCCc1ccccc1)[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001325465267 1329690197 /nfs/dbraw/zinc/69/01/97/1329690197.db2.gz FGZVOQYUIIFIHD-AZUAARDMSA-N 1 3 343.515 2.542 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001325665050 1329704994 /nfs/dbraw/zinc/70/49/94/1329704994.db2.gz HRHJZYRGXXCKAB-FHWLQOOXSA-N 1 3 337.552 2.887 10 0 EFAEHO CCC/C=C/CC[N@H+]1C[C@H]2CN(C(=O)[C@H](C(C)C)N(C)C)C[C@H]2C1 ZINC001325753981 1329710892 /nfs/dbraw/zinc/71/08/92/1329710892.db2.gz PARDWYKRQNKXKQ-FIPRUFKKSA-N 1 3 335.536 2.709 10 0 EFAEHO CCC/C=C/CC[N@@H+]1C[C@H]2CN(C(=O)[C@H](C(C)C)N(C)C)C[C@H]2C1 ZINC001325753981 1329710893 /nfs/dbraw/zinc/71/08/93/1329710893.db2.gz PARDWYKRQNKXKQ-FIPRUFKKSA-N 1 3 335.536 2.709 10 0 EFAEHO CCCCCC[N@H+]1C[C@H]2CN(C(=O)[C@H]3CCCCN3CC)C[C@H]2C1 ZINC001325778389 1329712650 /nfs/dbraw/zinc/71/26/50/1329712650.db2.gz GVMPJIWJRISLIH-CEXWTWQISA-N 1 3 335.536 2.831 10 0 EFAEHO CCCCCC[N@@H+]1C[C@H]2CN(C(=O)[C@H]3CCCCN3CC)C[C@H]2C1 ZINC001325778389 1329712651 /nfs/dbraw/zinc/71/26/51/1329712651.db2.gz GVMPJIWJRISLIH-CEXWTWQISA-N 1 3 335.536 2.831 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC[C@@H](C)N(C)Cc2ccccc2)C1 ZINC001381573121 1348369690 /nfs/dbraw/zinc/36/96/90/1348369690.db2.gz KKBYEWCBRASCLO-MJGOQNOKSA-N 1 3 331.504 2.745 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC[C@@H](C)N(C)Cc2ccccc2)C1 ZINC001381573121 1348369692 /nfs/dbraw/zinc/36/96/92/1348369692.db2.gz KKBYEWCBRASCLO-MJGOQNOKSA-N 1 3 331.504 2.745 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)c1 ZINC001326225823 1329740352 /nfs/dbraw/zinc/74/03/52/1329740352.db2.gz WXVVUGGDGYARLC-ICSRJNTNSA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@@H]1CCN(C(=O)[C@H]2CCCN2C)C1 ZINC001326332025 1329747955 /nfs/dbraw/zinc/74/79/55/1329747955.db2.gz KWKUZDWCMIZCQP-YLJYHZDGSA-N 1 3 343.515 2.671 10 0 EFAEHO C[C@H](F)CC[NH2+]CC[C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001326364628 1329750651 /nfs/dbraw/zinc/75/06/51/1329750651.db2.gz LCWQKAGQDJGXTP-HOTGVXAUSA-N 1 3 329.504 2.541 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](CC[NH2+]CC2CCCCCC2)C1 ZINC001326431696 1329756033 /nfs/dbraw/zinc/75/60/33/1329756033.db2.gz OEKSHAXHLJDBCY-IBGZPJMESA-N 1 3 335.536 2.881 10 0 EFAEHO CCc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)CN3CCCC3)C2)cc1 ZINC001326432159 1329756224 /nfs/dbraw/zinc/75/62/24/1329756224.db2.gz QYXLENHRIRDCKW-FQEVSTJZSA-N 1 3 343.515 2.673 10 0 EFAEHO CC[C@H](F)C[NH2+]CC[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001326436598 1329756584 /nfs/dbraw/zinc/75/65/84/1329756584.db2.gz FLMZVIAJJMDHOW-APWZRJJASA-N 1 3 349.494 2.938 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1)NC/C=C\Cl ZINC001382110162 1348729871 /nfs/dbraw/zinc/72/98/71/1348729871.db2.gz AOAVLQLMSUHUGW-AUJJKBCWSA-N 1 3 341.927 2.973 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@@H]1CCCC[N@H+]1C1CCCC1)NC/C=C\Cl ZINC001382110162 1348729874 /nfs/dbraw/zinc/72/98/74/1348729874.db2.gz AOAVLQLMSUHUGW-AUJJKBCWSA-N 1 3 341.927 2.973 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[C@H](C[NH2+]CC[C@H](C)F)CC1)N(C)C ZINC001326540746 1330314145 /nfs/dbraw/zinc/31/41/45/1330314145.db2.gz KKORIIARWMHPJS-LUKYLMHMSA-N 1 3 329.504 2.585 10 0 EFAEHO Cc1cncc(CN2CCC[C@@H](NC(=O)CCCC[NH+](C)C)CC2)c1 ZINC001327164895 1330434613 /nfs/dbraw/zinc/43/46/13/1330434613.db2.gz YKOUNJDTCNQZHD-LJQANCHMSA-N 1 3 346.519 2.593 10 0 EFAEHO CC/C=C/CCN1Cc2ccc(CNC(=O)[C@H]3CC[N@H+](C)C3)cc2C1 ZINC001327695089 1330509567 /nfs/dbraw/zinc/50/95/67/1330509567.db2.gz FCNQUQOSKGSCCF-PXPVJAHISA-N 1 3 341.499 2.926 10 0 EFAEHO CC/C=C/CCN1Cc2ccc(CNC(=O)[C@H]3CC[N@@H+](C)C3)cc2C1 ZINC001327695089 1330509571 /nfs/dbraw/zinc/50/95/71/1330509571.db2.gz FCNQUQOSKGSCCF-PXPVJAHISA-N 1 3 341.499 2.926 10 0 EFAEHO CC(C)CCC[NH2+]C1(C)CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001328018718 1330542315 /nfs/dbraw/zinc/54/23/15/1330542315.db2.gz YDJXTNVMNNAJCO-QGZVFWFLSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]CCCc1ccsc1 ZINC001329057422 1330661749 /nfs/dbraw/zinc/66/17/49/1330661749.db2.gz QXTPHIZGOYVSTJ-LSDHHAIUSA-N 1 3 337.533 2.648 10 0 EFAEHO C[C@@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]CCCc1cccc(F)c1 ZINC001331471014 1330841383 /nfs/dbraw/zinc/84/13/83/1330841383.db2.gz WDMZLNCJUBIHBO-INIZCTEOSA-N 1 3 349.494 2.679 10 0 EFAEHO CC(C)CCC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]21 ZINC001332157076 1330930295 /nfs/dbraw/zinc/93/02/95/1330930295.db2.gz INEXGZGUMXXKEB-CEXWTWQISA-N 1 3 337.552 2.980 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[C@H](C[NH2+]CC=C(Cl)Cl)C1)C1CCC1 ZINC001332271311 1330950571 /nfs/dbraw/zinc/95/05/71/1330950571.db2.gz IOMZOIOPVZMFTN-STQMWFEESA-N 1 3 348.318 2.664 10 0 EFAEHO CC(C)[C@@H](C(=O)N1C[C@H]([NH2+]CCCCCF)C(C)(C)C1)N(C)C ZINC001332386930 1330966283 /nfs/dbraw/zinc/96/62/83/1330966283.db2.gz HSWXSIHUCCJVDO-HOTGVXAUSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)N(CCN(C)CC1=CCCCC1)C(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001332708298 1331006361 /nfs/dbraw/zinc/00/63/61/1331006361.db2.gz XJKVABZXTKIBCY-HXUWFJFHSA-N 1 3 347.547 2.997 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]CCc1ccc(C)cc1)C(C)(C)C)N(C)C ZINC001332882085 1331034851 /nfs/dbraw/zinc/03/48/51/1331034851.db2.gz QNZYAXUFYQDYAR-RTBURBONSA-N 1 3 347.547 2.998 10 0 EFAEHO CN(C(=O)Cc1c[nH]cn1)C1CC([NH2+]CC/C=C\c2ccccc2)C1 ZINC001333120623 1331081176 /nfs/dbraw/zinc/08/11/76/1331081176.db2.gz OIMNOAMGRABDAJ-UITAMQMPSA-N 1 3 338.455 2.635 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+](Cc2ccc(C)cc2C)CC1)N(C)C ZINC001333364235 1331126356 /nfs/dbraw/zinc/12/63/56/1331126356.db2.gz GREAESDQADYBQZ-HXUWFJFHSA-N 1 3 343.515 2.892 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+](Cc2ccc(C)cc2C)CC1)N(C)C ZINC001333364235 1331126357 /nfs/dbraw/zinc/12/63/57/1331126357.db2.gz GREAESDQADYBQZ-HXUWFJFHSA-N 1 3 343.515 2.892 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC2=CC[N@H+](CC3CC(C)(C)C3)CC2)C1 ZINC001333405264 1331136233 /nfs/dbraw/zinc/13/62/33/1331136233.db2.gz GRCFZJWAOVHOOI-MRXNPFEDSA-N 1 3 333.520 2.513 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC2=CC[N@@H+](CC3CC(C)(C)C3)CC2)C1 ZINC001333405264 1331136235 /nfs/dbraw/zinc/13/62/35/1331136235.db2.gz GRCFZJWAOVHOOI-MRXNPFEDSA-N 1 3 333.520 2.513 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](NCCSc2ccncc2)[C@H](C)C1 ZINC001335813720 1331405764 /nfs/dbraw/zinc/40/57/64/1331405764.db2.gz KEOGIEMAPBWMHA-SJLPKXTDSA-N 1 3 337.533 2.900 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](NCCSc2ccncc2)[C@H](C)C1 ZINC001335813720 1331405765 /nfs/dbraw/zinc/40/57/65/1331405765.db2.gz KEOGIEMAPBWMHA-SJLPKXTDSA-N 1 3 337.533 2.900 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@H]1CCCCN1Cc1ccc(C2CC2)cc1 ZINC001480323685 1333624063 /nfs/dbraw/zinc/62/40/63/1333624063.db2.gz KUJGXFQJVIBUCU-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO c1[nH]nc2c1cccc2CN[C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC001352789578 1333730312 /nfs/dbraw/zinc/73/03/12/1333730312.db2.gz KPXPCMLDYDXYDK-XLIONFOSSA-N 1 3 334.423 2.908 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]CCCCC(F)(F)F ZINC001480459920 1334060124 /nfs/dbraw/zinc/06/01/24/1334060124.db2.gz PTCYPSSCRFQPHC-KGLIPLIRSA-N 1 3 337.430 2.686 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1C ZINC001480515421 1334102714 /nfs/dbraw/zinc/10/27/14/1334102714.db2.gz GBLSEXBNMLDLSE-KRWDZBQOSA-N 1 3 331.504 2.772 10 0 EFAEHO CCN1CCC[C@@H]1CNC(=[NH2+])NCCc1c(C)oc2ccccc21 ZINC000849087595 1335072858 /nfs/dbraw/zinc/07/28/58/1335072858.db2.gz DMVLOWLMXMHESY-OAHLLOKOSA-N 1 3 328.460 2.882 10 0 EFAEHO CC(C)[NH+]1CCC(NC(=O)CN2CCC[C@@H](C3CCC3)CC2)CC1 ZINC001414026469 1335524080 /nfs/dbraw/zinc/52/40/80/1335524080.db2.gz WZSJJPLZRJVXPO-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=S)Nc1ccccc1Cl ZINC000849275716 1335586066 /nfs/dbraw/zinc/58/60/66/1335586066.db2.gz VVQIREGKOPKVEN-ZDUSSCGKSA-N 1 3 342.940 2.898 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=S)Nc1ccccc1Cl ZINC000849275716 1335586068 /nfs/dbraw/zinc/58/60/68/1335586068.db2.gz VVQIREGKOPKVEN-ZDUSSCGKSA-N 1 3 342.940 2.898 10 0 EFAEHO CCc1ccccc1NC(=S)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000849275457 1335586173 /nfs/dbraw/zinc/58/61/73/1335586173.db2.gz QBQBGRYLTQELPP-HNNXBMFYSA-N 1 3 336.549 2.807 10 0 EFAEHO CCc1ccccc1NC(=S)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000849275457 1335586175 /nfs/dbraw/zinc/58/61/75/1335586175.db2.gz QBQBGRYLTQELPP-HNNXBMFYSA-N 1 3 336.549 2.807 10 0 EFAEHO C[C@@H]1C[C@H](CN2Cc3ccc(NC(=O)C(F)(F)F)cc3C2)CC[NH2+]1 ZINC000849349504 1335596892 /nfs/dbraw/zinc/59/68/92/1335596892.db2.gz BNMZMOMSWJXCQW-VXGBXAGGSA-N 1 3 341.377 2.891 10 0 EFAEHO O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001361728196 1336299136 /nfs/dbraw/zinc/29/91/36/1336299136.db2.gz QEKLRBDRKXCMCT-SLFFLAALSA-N 1 3 341.499 2.957 10 0 EFAEHO O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001361728196 1336299139 /nfs/dbraw/zinc/29/91/39/1336299139.db2.gz QEKLRBDRKXCMCT-SLFFLAALSA-N 1 3 341.499 2.957 10 0 EFAEHO C[NH+](C)C1(CNC(=O)c2ccc(NC3=NCCC3)cc2)CCCC1 ZINC001362100986 1336503788 /nfs/dbraw/zinc/50/37/88/1336503788.db2.gz UFVXWTDUHKUBIE-UHFFFAOYSA-N 1 3 328.460 2.895 10 0 EFAEHO C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)C2([NH+](C)C)CCCC2)C1 ZINC001362162595 1336532610 /nfs/dbraw/zinc/53/26/10/1336532610.db2.gz YWHVHXGSINEQFF-SJLPKXTDSA-N 1 3 329.488 2.813 10 0 EFAEHO COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](C)CC[NH+](C)C)cc1 ZINC001362248341 1336571754 /nfs/dbraw/zinc/57/17/54/1336571754.db2.gz DNGDYHSDBKFFMB-QFBILLFUSA-N 1 3 347.503 2.536 10 0 EFAEHO C[C@H](NC(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1)[C@H](c1ccccc1)N(C)C ZINC001362412830 1336599681 /nfs/dbraw/zinc/59/96/81/1336599681.db2.gz XHEZHXVEVXKNAK-JCHJZTRSSA-N 1 3 331.504 2.914 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)CC1 ZINC001362786320 1336742054 /nfs/dbraw/zinc/74/20/54/1336742054.db2.gz NQFYUEMGEQRVFR-IBGZPJMESA-N 1 3 349.494 2.913 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](CCN2CC3(CCCC3)OC[C@H]2CN(C)C)C1 ZINC001363810919 1337062334 /nfs/dbraw/zinc/06/23/34/1337062334.db2.gz UIEZOAKGRPCHCF-CEXWTWQISA-N 1 3 337.552 2.540 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](CCN2CC3(CCCC3)OC[C@H]2CN(C)C)C1 ZINC001363810919 1337062337 /nfs/dbraw/zinc/06/23/37/1337062337.db2.gz UIEZOAKGRPCHCF-CEXWTWQISA-N 1 3 337.552 2.540 10 0 EFAEHO CN1CCC[C@@H]1CC[NH2+][C@H]1CCN(C(=O)OC(C)(C)C)C12CCC2 ZINC001363812965 1337063746 /nfs/dbraw/zinc/06/37/46/1337063746.db2.gz XJCXJDZXAJEQAY-CVEARBPZSA-N 1 3 337.508 2.992 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CCC[NH+](C)C)CCN1Cc1cc(F)ccc1C ZINC001365864264 1337258426 /nfs/dbraw/zinc/25/84/26/1337258426.db2.gz BMGJCDCSHPUVAJ-RBUKOAKNSA-N 1 3 349.494 2.945 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@@H]1CCCN(CCc2ccccc2)C1 ZINC001365936428 1337268909 /nfs/dbraw/zinc/26/89/09/1337268909.db2.gz GKLJNSKLDPDUTD-UXHICEINSA-N 1 3 343.515 2.684 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@@H]1CCCN(CCc2ccccc2)C1 ZINC001365936428 1337268913 /nfs/dbraw/zinc/26/89/13/1337268913.db2.gz GKLJNSKLDPDUTD-UXHICEINSA-N 1 3 343.515 2.684 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](C[NH2+]CCC2CCCCC2)C1)N(C)C ZINC001480676715 1337277984 /nfs/dbraw/zinc/27/79/84/1337277984.db2.gz NXNIGMLVFLVCDH-RBUKOAKNSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccc(Cl)cc1)C1CC1)N(C)C ZINC001366057840 1337351895 /nfs/dbraw/zinc/35/18/95/1337351895.db2.gz GHRCWJDOULMNTM-IAGOWNOFSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[NH+]1CCCC1 ZINC001366131019 1337392724 /nfs/dbraw/zinc/39/27/24/1337392724.db2.gz KPVPTBDOSUEDBY-YDHLFZDLSA-N 1 3 348.318 2.663 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366073324 1337364983 /nfs/dbraw/zinc/36/49/83/1337364983.db2.gz JWNLKMRIPBOQIO-IEBWSBKVSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366073324 1337364987 /nfs/dbraw/zinc/36/49/87/1337364987.db2.gz JWNLKMRIPBOQIO-IEBWSBKVSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C(C)C)N(C)C ZINC001366077706 1337369279 /nfs/dbraw/zinc/36/92/79/1337369279.db2.gz GSNHZZHWBINZFI-YRXWBPOGSA-N 1 3 337.552 2.930 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C(C)C)N(C)C ZINC001366077706 1337369281 /nfs/dbraw/zinc/36/92/81/1337369281.db2.gz GSNHZZHWBINZFI-YRXWBPOGSA-N 1 3 337.552 2.930 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C(C)C)N(C)C ZINC001366077701 1337369542 /nfs/dbraw/zinc/36/95/42/1337369542.db2.gz GSNHZZHWBINZFI-OKYOBFRVSA-N 1 3 337.552 2.930 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C(C)C)N(C)C ZINC001366077701 1337369545 /nfs/dbraw/zinc/36/95/45/1337369545.db2.gz GSNHZZHWBINZFI-OKYOBFRVSA-N 1 3 337.552 2.930 10 0 EFAEHO C[C@H](F)CC[N@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366077932 1337369706 /nfs/dbraw/zinc/36/97/06/1337369706.db2.gz XRJFSCHAUZBLJN-ZWKOTPCHSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366077932 1337369707 /nfs/dbraw/zinc/36/97/07/1337369707.db2.gz XRJFSCHAUZBLJN-ZWKOTPCHSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCC[NH+]1CCCC1 ZINC001366080998 1337372167 /nfs/dbraw/zinc/37/21/67/1337372167.db2.gz BGNDFQHZIACQSD-KDURUIRLSA-N 1 3 335.536 2.974 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001366131264 1337392673 /nfs/dbraw/zinc/39/26/73/1337392673.db2.gz MAIFPXOPUJMVTH-VAMGGRTRSA-N 1 3 343.515 2.887 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+]CC3CCC(C)(C)CC3)C2)CCC1 ZINC001366146747 1337401898 /nfs/dbraw/zinc/40/18/98/1337401898.db2.gz BXEVRQAPHZOCSS-CALCHBBNSA-N 1 3 335.536 2.924 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+]C[C@@H]3CCCC(F)(F)C3)C2)CCC1 ZINC001366147536 1337402734 /nfs/dbraw/zinc/40/27/34/1337402734.db2.gz FFERPQVFMHXCNS-KFWWJZLASA-N 1 3 343.462 2.533 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001366161689 1337408755 /nfs/dbraw/zinc/40/87/55/1337408755.db2.gz LPLJGOHYWHJHNR-OTWHNJEPSA-N 1 3 331.504 2.626 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c(C)s1 ZINC001366163871 1337409222 /nfs/dbraw/zinc/40/92/22/1337409222.db2.gz UHUVCXCFYOIMDI-BBWFWOEESA-N 1 3 337.533 2.688 10 0 EFAEHO CN(CC(=O)NC[C@H]1CCC[N@H+](CC2CCCC2)C1)CC(C)(C)C ZINC001366176238 1337417079 /nfs/dbraw/zinc/41/70/79/1337417079.db2.gz CERIKOOQWNMBCU-GOSISDBHSA-N 1 3 337.552 2.983 10 0 EFAEHO CN(CC(=O)NC[C@H]1CCC[N@@H+](CC2CCCC2)C1)CC(C)(C)C ZINC001366176238 1337417081 /nfs/dbraw/zinc/41/70/81/1337417081.db2.gz CERIKOOQWNMBCU-GOSISDBHSA-N 1 3 337.552 2.983 10 0 EFAEHO CC1CC(C[N@@H+]2CCC[C@H](CNC(=O)C(C)(C)N3CCCC3)C2)C1 ZINC001366177245 1337418328 /nfs/dbraw/zinc/41/83/28/1337418328.db2.gz HQQHYUFRWLXLRM-LXPRWKDFSA-N 1 3 335.536 2.735 10 0 EFAEHO CC1CC(C[N@H+]2CCC[C@H](CNC(=O)C(C)(C)N3CCCC3)C2)C1 ZINC001366177245 1337418329 /nfs/dbraw/zinc/41/83/29/1337418329.db2.gz HQQHYUFRWLXLRM-LXPRWKDFSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+]1CCC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001366182316 1337423804 /nfs/dbraw/zinc/42/38/04/1337423804.db2.gz ATTSIJVGYUKMBM-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+]1CCC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001366182316 1337423807 /nfs/dbraw/zinc/42/38/07/1337423807.db2.gz ATTSIJVGYUKMBM-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@H+](C/C=C\c2ccccc2)C1 ZINC001366188191 1337427652 /nfs/dbraw/zinc/42/76/52/1337427652.db2.gz UUSNWYYLLGIFRE-RVPHRTOXSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@@H+](C/C=C\c2ccccc2)C1 ZINC001366188191 1337427654 /nfs/dbraw/zinc/42/76/54/1337427654.db2.gz UUSNWYYLLGIFRE-RVPHRTOXSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](Cc2csc(C)c2)C1)N(C)C ZINC001366191375 1337430549 /nfs/dbraw/zinc/43/05/49/1337430549.db2.gz ZBRJRXSNBZNTIZ-NVXWUHKLSA-N 1 3 337.533 2.725 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](Cc2csc(C)c2)C1)N(C)C ZINC001366191375 1337430554 /nfs/dbraw/zinc/43/05/54/1337430554.db2.gz ZBRJRXSNBZNTIZ-NVXWUHKLSA-N 1 3 337.533 2.725 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[NH2+][C@@H]2CCc3ccccc32)C1 ZINC001366199157 1337436884 /nfs/dbraw/zinc/43/68/84/1337436884.db2.gz AILQRKGGVJYNQI-YLJYHZDGSA-N 1 3 343.515 2.842 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[NH2+][C@H]2CCc3ccccc32)C1 ZINC001366208862 1337445317 /nfs/dbraw/zinc/44/53/17/1337445317.db2.gz RJURVXXPKCDGOV-PXNSSMCTSA-N 1 3 343.515 2.844 10 0 EFAEHO C[C@@H](NC[C@@H]1CCCCN1C(=O)CC[NH+](C)C)c1ccccc1F ZINC001366215092 1337450324 /nfs/dbraw/zinc/45/03/24/1337450324.db2.gz FVSRRDYTZVHSLP-CVEARBPZSA-N 1 3 335.467 2.809 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCCCN2C(=O)CN(C)C(C)C)c(C)n1 ZINC001366223291 1337456100 /nfs/dbraw/zinc/45/61/00/1337456100.db2.gz COZPMMIXYMEAEG-LJQANCHMSA-N 1 3 346.519 2.509 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001366230839 1337464298 /nfs/dbraw/zinc/46/42/98/1337464298.db2.gz MMUGQDPWHKCHMD-RHSMWYFYSA-N 1 3 346.519 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001366230839 1337464299 /nfs/dbraw/zinc/46/42/99/1337464299.db2.gz MMUGQDPWHKCHMD-RHSMWYFYSA-N 1 3 346.519 2.914 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001366233340 1337467047 /nfs/dbraw/zinc/46/70/47/1337467047.db2.gz WSBYYEXBODJWPU-LJQANCHMSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001366233339 1337467408 /nfs/dbraw/zinc/46/74/08/1337467408.db2.gz WSBYYEXBODJWPU-IBGZPJMESA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2C[N@H+](CC[C@@H]3CCC[C@@H](C)C3)C[C@H]21 ZINC001366237119 1337470314 /nfs/dbraw/zinc/47/03/14/1337470314.db2.gz RQHFSLWJFIQTMU-GJNTUIEKSA-N 1 3 335.536 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2C[N@@H+](CC[C@@H]3CCC[C@@H](C)C3)C[C@H]21 ZINC001366237119 1337470317 /nfs/dbraw/zinc/47/03/17/1337470317.db2.gz RQHFSLWJFIQTMU-GJNTUIEKSA-N 1 3 335.536 2.589 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]C/C=C/c1ccccc1 ZINC001366271048 1337484362 /nfs/dbraw/zinc/48/43/62/1337484362.db2.gz AJGDPYDPIUJNLG-FVDXIBTGSA-N 1 3 329.488 2.667 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc(F)cc1C ZINC001366286472 1337492034 /nfs/dbraw/zinc/49/20/34/1337492034.db2.gz OWFGWLWBDIFTLL-QAPCUYQASA-N 1 3 335.467 2.603 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001366311996 1337505882 /nfs/dbraw/zinc/50/58/82/1337505882.db2.gz QDOUAGYUKAPBRY-HUUCEWRRSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]C/C=C/c1ccc(Cl)cc1 ZINC001366362741 1337536724 /nfs/dbraw/zinc/53/67/24/1337536724.db2.gz CYKBRSBXMYJNQP-NFAHFFEMSA-N 1 3 337.895 2.788 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]Cc1ccc(C(F)F)cc1 ZINC001366366700 1337539975 /nfs/dbraw/zinc/53/99/75/1337539975.db2.gz MVQAHXFEBUAGMI-ZDUSSCGKSA-N 1 3 327.419 2.559 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2cccc3ccccc32)C1 ZINC001366387886 1337553299 /nfs/dbraw/zinc/55/32/99/1337553299.db2.gz HTDMTSFONVLURP-IBGZPJMESA-N 1 3 339.483 2.871 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[NH2+][C@@H](C)c2cccc(OC)c2)C1 ZINC001366411812 1337564624 /nfs/dbraw/zinc/56/46/24/1337564624.db2.gz NDDIHRNYOVPONR-DLBZAZTESA-N 1 3 347.503 2.536 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]([NH2+]Cc2ccccc2F)C1 ZINC001366421024 1337570917 /nfs/dbraw/zinc/57/09/17/1337570917.db2.gz BVXKCSULFZMCTM-SJORKVTESA-N 1 3 335.467 2.683 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+][C@H](C)CCNC(=O)CN(C)C(C)C ZINC001366508391 1337649011 /nfs/dbraw/zinc/64/90/11/1337649011.db2.gz DNPFHOVNPHZRFF-OAHLLOKOSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(Cl)c(F)c1)N(C)C ZINC001366510391 1337650633 /nfs/dbraw/zinc/65/06/33/1337650633.db2.gz OEMHJCUTZSYRET-MLGOLLRUSA-N 1 3 343.874 2.804 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@@H](C)CCNC(=O)CN(C)C(C)C)c(C)c1 ZINC001366513858 1337654099 /nfs/dbraw/zinc/65/40/99/1337654099.db2.gz SBKYHJAERYPFRN-SFHVURJKSA-N 1 3 333.520 2.936 10 0 EFAEHO C[N@H+](CCNC(=O)C(C)(C)N1CCCCC1)C[C@H]1CCC(F)(F)C1 ZINC001366526502 1337663385 /nfs/dbraw/zinc/66/33/85/1337663385.db2.gz AWBVJWXTPRVUPI-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO C[N@@H+](CCNC(=O)C(C)(C)N1CCCCC1)C[C@H]1CCC(F)(F)C1 ZINC001366526502 1337663394 /nfs/dbraw/zinc/66/33/94/1337663394.db2.gz AWBVJWXTPRVUPI-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NCCN(C)Cc2cc3ccccc3s2)CC[N@@H+]1C ZINC001366527687 1337664467 /nfs/dbraw/zinc/66/44/67/1337664467.db2.gz OQCBCJGYJVONCZ-RHSMWYFYSA-N 1 3 345.512 2.790 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NCCN(C)Cc2cc3ccccc3s2)CC[N@H+]1C ZINC001366527687 1337664469 /nfs/dbraw/zinc/66/44/69/1337664469.db2.gz OQCBCJGYJVONCZ-RHSMWYFYSA-N 1 3 345.512 2.790 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[N@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001366569830 1337705778 /nfs/dbraw/zinc/70/57/78/1337705778.db2.gz HLXOJZZOEVQJFE-CVEARBPZSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001366569830 1337705780 /nfs/dbraw/zinc/70/57/80/1337705780.db2.gz HLXOJZZOEVQJFE-CVEARBPZSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1cccc(CN(C)CCNC(=O)[C@@H]2CCC[C@H]([NH+](C)C)C2)c1 ZINC001366584968 1337722504 /nfs/dbraw/zinc/72/25/04/1337722504.db2.gz NYAUBZLYLLJZES-MOPGFXCFSA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C)[C@@H](C)c1ccc(Cl)cc1 ZINC001366596388 1337733938 /nfs/dbraw/zinc/73/39/38/1337733938.db2.gz NRAOUWSFLYFOKZ-AWEZNQCLSA-N 1 3 325.884 2.789 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C)[C@@H](C)c1ccc(Cl)cc1 ZINC001366596388 1337733942 /nfs/dbraw/zinc/73/39/42/1337733942.db2.gz NRAOUWSFLYFOKZ-AWEZNQCLSA-N 1 3 325.884 2.789 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCN(C)[C@H](C)c1ccccc1)[NH+]1CCCC1 ZINC001366597742 1337734603 /nfs/dbraw/zinc/73/46/03/1337734603.db2.gz UFCNOHUSVPADNH-MJGOQNOKSA-N 1 3 331.504 2.916 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@H+](Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001366703633 1337895969 /nfs/dbraw/zinc/89/59/69/1337895969.db2.gz GIVKRQGDAKHYOO-UYAOXDASSA-N 1 3 345.531 2.890 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@@H+](Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001366703633 1337895976 /nfs/dbraw/zinc/89/59/76/1337895976.db2.gz GIVKRQGDAKHYOO-UYAOXDASSA-N 1 3 345.531 2.890 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001366714119 1337908743 /nfs/dbraw/zinc/90/87/43/1337908743.db2.gz ZNTWUYFCPCVQEC-HOTGVXAUSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001366714119 1337908747 /nfs/dbraw/zinc/90/87/47/1337908747.db2.gz ZNTWUYFCPCVQEC-HOTGVXAUSA-N 1 3 349.906 2.620 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CCc2cccs2)C2CC2)CC[N@@H+]1C ZINC001366743132 1337954091 /nfs/dbraw/zinc/95/40/91/1337954091.db2.gz AAAVHOOJQGGUDV-ZWKOTPCHSA-N 1 3 349.544 2.602 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CCc2cccs2)C2CC2)CC[N@H+]1C ZINC001366743132 1337954096 /nfs/dbraw/zinc/95/40/96/1337954096.db2.gz AAAVHOOJQGGUDV-ZWKOTPCHSA-N 1 3 349.544 2.602 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@H+](C[C@@H]1CCCC(F)(F)C1)C1CC1)N(C)C ZINC001366751240 1337965450 /nfs/dbraw/zinc/96/54/50/1337965450.db2.gz KZZMUVTWUOXTPP-ZBFHGGJFSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@@H+](C[C@@H]1CCCC(F)(F)C1)C1CC1)N(C)C ZINC001366751240 1337965454 /nfs/dbraw/zinc/96/54/54/1337965454.db2.gz KZZMUVTWUOXTPP-ZBFHGGJFSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001366777106 1337995719 /nfs/dbraw/zinc/99/57/19/1337995719.db2.gz VRSPUURKDBEJPC-QGZVFWFLSA-N 1 3 337.895 2.716 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001366782545 1338001049 /nfs/dbraw/zinc/00/10/49/1338001049.db2.gz MAXHFHVLOPDNSW-IAGOWNOFSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@H+](C)CCc2cccs2)C1 ZINC001480742466 1338015506 /nfs/dbraw/zinc/01/55/06/1338015506.db2.gz LXVFVOMTMQJKLT-INIZCTEOSA-N 1 3 337.533 2.554 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@@H+](C)CCc2cccs2)C1 ZINC001480742466 1338015512 /nfs/dbraw/zinc/01/55/12/1338015512.db2.gz LXVFVOMTMQJKLT-INIZCTEOSA-N 1 3 337.533 2.554 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001366848382 1338114039 /nfs/dbraw/zinc/11/40/39/1338114039.db2.gz DIUVARLLAPVSPA-KRWDZBQOSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001366848382 1338114043 /nfs/dbraw/zinc/11/40/43/1338114043.db2.gz DIUVARLLAPVSPA-KRWDZBQOSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)cc1C ZINC001366849446 1338116173 /nfs/dbraw/zinc/11/61/73/1338116173.db2.gz GWRNYFSDSRTTHC-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)cc1C ZINC001366849446 1338116176 /nfs/dbraw/zinc/11/61/76/1338116176.db2.gz GWRNYFSDSRTTHC-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(C)c(C[N@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001366849343 1338116258 /nfs/dbraw/zinc/11/62/58/1338116258.db2.gz GJGFRLPZGJIYRB-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001366849343 1338116262 /nfs/dbraw/zinc/11/62/62/1338116262.db2.gz GJGFRLPZGJIYRB-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001366868389 1338138461 /nfs/dbraw/zinc/13/84/61/1338138461.db2.gz HTCJYLXWDOLFRO-FQEVSTJZSA-N 1 3 345.531 2.658 10 0 EFAEHO Cc1ccc(CC[N@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001366868389 1338138465 /nfs/dbraw/zinc/13/84/65/1338138465.db2.gz HTCJYLXWDOLFRO-FQEVSTJZSA-N 1 3 345.531 2.658 10 0 EFAEHO CCN1CCC[C@H](N(Cc2ccccc2)C(=O)C[C@H]2CC[N@H+](C)C2)C1 ZINC001366870688 1338142642 /nfs/dbraw/zinc/14/26/42/1338142642.db2.gz JSPGVTFAITWMTA-UXHICEINSA-N 1 3 343.515 2.841 10 0 EFAEHO CCN1CCC[C@H](N(Cc2ccccc2)C(=O)C[C@H]2CC[N@@H+](C)C2)C1 ZINC001366870688 1338142643 /nfs/dbraw/zinc/14/26/43/1338142643.db2.gz JSPGVTFAITWMTA-UXHICEINSA-N 1 3 343.515 2.841 10 0 EFAEHO CCN1CCC[C@@H](N(Cc2ccccc2)C(=O)C[C@@H]2CC[N@H+](C)C2)C1 ZINC001366870693 1338143057 /nfs/dbraw/zinc/14/30/57/1338143057.db2.gz JSPGVTFAITWMTA-VQTJNVASSA-N 1 3 343.515 2.841 10 0 EFAEHO CCN1CCC[C@@H](N(Cc2ccccc2)C(=O)C[C@@H]2CC[N@@H+](C)C2)C1 ZINC001366870693 1338143064 /nfs/dbraw/zinc/14/30/64/1338143064.db2.gz JSPGVTFAITWMTA-VQTJNVASSA-N 1 3 343.515 2.841 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[N@H+](C)C/C=C\c2ccccc2)C1)N(C)C ZINC001366872384 1338145350 /nfs/dbraw/zinc/14/53/50/1338145350.db2.gz PBOZMQRVEOFKNU-KLMKZAPQSA-N 1 3 343.515 2.820 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[N@@H+](C)C/C=C\c2ccccc2)C1)N(C)C ZINC001366872384 1338145353 /nfs/dbraw/zinc/14/53/53/1338145353.db2.gz PBOZMQRVEOFKNU-KLMKZAPQSA-N 1 3 343.515 2.820 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[N@H+](C)C/C=C/c2ccccc2)C1)N(C)C ZINC001366872387 1338145444 /nfs/dbraw/zinc/14/54/44/1338145444.db2.gz PBOZMQRVEOFKNU-WQEUXLNQSA-N 1 3 343.515 2.820 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[N@@H+](C)C/C=C/c2ccccc2)C1)N(C)C ZINC001366872387 1338145446 /nfs/dbraw/zinc/14/54/46/1338145446.db2.gz PBOZMQRVEOFKNU-WQEUXLNQSA-N 1 3 343.515 2.820 10 0 EFAEHO C[C@@H](c1ccc2c(c1)CCC2)N1CCC[C@H](NC(=O)CC[NH+](C)C)C1 ZINC001366900687 1338186168 /nfs/dbraw/zinc/18/61/68/1338186168.db2.gz IEZNJFUMJQXACS-JXFKEZNVSA-N 1 3 343.515 2.769 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@H+](CC2CC(C)(C)C2)C1)N1CCCC1 ZINC001367039670 1338300479 /nfs/dbraw/zinc/30/04/79/1338300479.db2.gz RVKZLUDPMLLAIG-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@@H+](CC2CC(C)(C)C2)C1)N1CCCC1 ZINC001367039670 1338300488 /nfs/dbraw/zinc/30/04/88/1338300488.db2.gz RVKZLUDPMLLAIG-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C1CCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001367105978 1338392947 /nfs/dbraw/zinc/39/29/47/1338392947.db2.gz YDVUHIQMINMMRM-VQIMIIECSA-N 1 3 329.488 2.643 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](CC)N(C)C)[NH2+]Cc1cccc(Cl)c1 ZINC001367130108 1338419446 /nfs/dbraw/zinc/41/94/46/1338419446.db2.gz FHUCNXWVLHJWIU-HZPDHXFCSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[C@H](C(=O)N[C@](C)(C[NH2+]Cc1ccc(F)cc1C)C1CC1)N(C)C ZINC001367173328 1338474171 /nfs/dbraw/zinc/47/41/71/1338474171.db2.gz XVXSFICRGVIWDK-UYAOXDASSA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@H](C(=O)N[C@@](C)(C[NH2+]Cc1ccc(F)cc1)C1CC1)N(C)C ZINC001367202439 1338509462 /nfs/dbraw/zinc/50/94/62/1338509462.db2.gz XNPZUHNKERIFOW-MJGOQNOKSA-N 1 3 335.467 2.540 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H]1CC[C@H](NC(=O)CN(C)C(C)C)CC1 ZINC001367203100 1338509967 /nfs/dbraw/zinc/50/99/67/1338509967.db2.gz ZMYZTVHNBODVPE-WGSAOQKQSA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@H]([NH2+]C[C@H]1CCCN1C(=O)CN1CCCC1)c1ccc(F)cc1 ZINC001367225940 1338533628 /nfs/dbraw/zinc/53/36/28/1338533628.db2.gz JQEBBAJQIWZFRN-MOPGFXCFSA-N 1 3 347.478 2.953 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@H](C)c1ccc(F)cc1 ZINC001367228599 1338536453 /nfs/dbraw/zinc/53/64/53/1338536453.db2.gz QKYYWEDDPKUTLL-CRAIPNDOSA-N 1 3 335.467 2.808 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+]C[C@@H](C)CNC(=O)CN(C)C(C)C ZINC001367290761 1338589991 /nfs/dbraw/zinc/58/99/91/1338589991.db2.gz TZYMDFMHTYJDJE-CQSZACIVSA-N 1 3 339.911 2.831 10 0 EFAEHO C[C@H](C[NH2+]C[C@H]1CCC(F)(F)C1)N(C)C(=O)CN(C)CC(C)(C)C ZINC001367387574 1338684143 /nfs/dbraw/zinc/68/41/43/1338684143.db2.gz VQRYHGKZHPSKAX-CABCVRRESA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(C(F)F)cc1)N(C)C ZINC001367395092 1338692656 /nfs/dbraw/zinc/69/26/56/1338692656.db2.gz HXPKDSYFDWVKNZ-CZUORRHYSA-N 1 3 341.446 2.901 10 0 EFAEHO C[C@@H](CNCc1cc2ccccc2o1)N(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001367400252 1338697853 /nfs/dbraw/zinc/69/78/53/1338697853.db2.gz UQSAABRGOKZXSM-HOTGVXAUSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@@H](CNCc1cc2ccccc2o1)N(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001367400252 1338697857 /nfs/dbraw/zinc/69/78/57/1338697857.db2.gz UQSAABRGOKZXSM-HOTGVXAUSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@@H](CNCc1cc2ccccc2o1)N(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001367400291 1338698230 /nfs/dbraw/zinc/69/82/30/1338698230.db2.gz UQSAABRGOKZXSM-JKSUJKDBSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@@H](CNCc1cc2ccccc2o1)N(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001367400291 1338698233 /nfs/dbraw/zinc/69/82/33/1338698233.db2.gz UQSAABRGOKZXSM-JKSUJKDBSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@H](C[NH2+][C@@H]1CCCc2ccc(F)cc21)N(C)C(=O)CN1CCCC1 ZINC001367404377 1338701594 /nfs/dbraw/zinc/70/15/94/1338701594.db2.gz LPDATBHRYBOTPZ-DNVCBOLYSA-N 1 3 347.478 2.735 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1cccc(F)c1 ZINC001367470503 1338769969 /nfs/dbraw/zinc/76/99/69/1338769969.db2.gz YVCNIVOALISCTF-RBUKOAKNSA-N 1 3 349.494 2.929 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1ccc(F)c(F)c1)C(C)C)N(C)C ZINC001367471493 1338771835 /nfs/dbraw/zinc/77/18/35/1338771835.db2.gz FMXOJLQAZUDVHC-DLBZAZTESA-N 1 3 341.446 2.535 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)c1 ZINC001367486420 1338786414 /nfs/dbraw/zinc/78/64/14/1338786414.db2.gz NIHLHJQWIOSHFK-FXAWDEMLSA-N 1 3 345.531 2.876 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)[NH2+]Cc1ccsc1 ZINC001367486952 1338787167 /nfs/dbraw/zinc/78/71/67/1338787167.db2.gz CNLREEQRSHUZTA-JKSUJKDBSA-N 1 3 325.522 2.565 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C(C)C ZINC001367487902 1338787550 /nfs/dbraw/zinc/78/75/50/1338787550.db2.gz BYUUHICEJLLTGS-IBGZPJMESA-N 1 3 333.520 2.874 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C(C)(C)[NH+]1CCCC1)NCc1ccccc1F ZINC001367491906 1338791541 /nfs/dbraw/zinc/79/15/41/1338791541.db2.gz WUZDGJOWDCSSIQ-GOSISDBHSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@@H](C(=O)N1CCCCC[C@H]([NH2+]CCC(F)(F)F)C1)N(C)C ZINC001388789163 1353017376 /nfs/dbraw/zinc/01/73/76/1353017376.db2.gz DEWLIWXNSKLCJP-KBPBESRZSA-N 1 3 337.430 2.640 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[N@H+](C)C[C@H]1CCc2ccccc2C1)N(C)C ZINC001367544346 1338850911 /nfs/dbraw/zinc/85/09/11/1338850911.db2.gz BJJGAFLYCFUWAZ-FXAWDEMLSA-N 1 3 345.531 2.522 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[N@@H+](C)C[C@H]1CCc2ccccc2C1)N(C)C ZINC001367544346 1338850913 /nfs/dbraw/zinc/85/09/13/1338850913.db2.gz BJJGAFLYCFUWAZ-FXAWDEMLSA-N 1 3 345.531 2.522 10 0 EFAEHO CC(C)c1ccc(CN(C)CCN(C)C(=O)[C@@H]2CC[N@H+](C)C2)cc1 ZINC001367549601 1338859702 /nfs/dbraw/zinc/85/97/02/1338859702.db2.gz DITPXUSUDRYUKY-LJQANCHMSA-N 1 3 331.504 2.652 10 0 EFAEHO CC(C)c1ccc(CN(C)CCN(C)C(=O)[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001367549601 1338859706 /nfs/dbraw/zinc/85/97/06/1338859706.db2.gz DITPXUSUDRYUKY-LJQANCHMSA-N 1 3 331.504 2.652 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C(C)C)CC[C@H]21 ZINC001367552712 1338863212 /nfs/dbraw/zinc/86/32/12/1338863212.db2.gz FOMJBRINTRZCKV-WOJBJXKFSA-N 1 3 343.515 2.758 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C(C)C)CC[C@H]21 ZINC001367552712 1338863216 /nfs/dbraw/zinc/86/32/16/1338863216.db2.gz FOMJBRINTRZCKV-WOJBJXKFSA-N 1 3 343.515 2.758 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCc2ccc(Cl)cc21)C(=O)[C@H]1CCCN1C ZINC001367647221 1338902665 /nfs/dbraw/zinc/90/26/65/1338902665.db2.gz XTRSPECIRYUGQN-ZWKOTPCHSA-N 1 3 349.906 2.860 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+][C@H](C)c1ccc2c(c1)CCC2)N(C)C ZINC001367742681 1338972193 /nfs/dbraw/zinc/97/21/93/1338972193.db2.gz ZGFLLYYWKFIARN-QMTMVMCOSA-N 1 3 331.504 2.671 10 0 EFAEHO C[C@H](C[N@H+](C)CC1CCC2(CC2)CC1)NC(=O)C1(N(C)C)CCC1 ZINC001367809592 1339028124 /nfs/dbraw/zinc/02/81/24/1339028124.db2.gz WUAFYXOMQVFWSE-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](C[N@@H+](C)CC1CCC2(CC2)CC1)NC(=O)C1(N(C)C)CCC1 ZINC001367809592 1339028126 /nfs/dbraw/zinc/02/81/26/1339028126.db2.gz WUAFYXOMQVFWSE-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)CC1CC(F)(F)C1 ZINC001367839701 1339056792 /nfs/dbraw/zinc/05/67/92/1339056792.db2.gz XFRNIZJYEIGZRJ-GDBMZVCRSA-N 1 3 345.478 2.731 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)CC1CC(F)(F)C1 ZINC001367839701 1339056795 /nfs/dbraw/zinc/05/67/95/1339056795.db2.gz XFRNIZJYEIGZRJ-GDBMZVCRSA-N 1 3 345.478 2.731 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(C(F)F)c1)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001367854564 1339070058 /nfs/dbraw/zinc/07/00/58/1339070058.db2.gz JIHGGTFUTSIFFF-CZUORRHYSA-N 1 3 339.430 2.512 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(C(F)F)c1)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001367854564 1339070060 /nfs/dbraw/zinc/07/00/60/1339070060.db2.gz JIHGGTFUTSIFFF-CZUORRHYSA-N 1 3 339.430 2.512 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)C[C@H](C)NC(=O)CN(C)C(C)C)c(C)c1 ZINC001367862340 1339075945 /nfs/dbraw/zinc/07/59/45/1339075945.db2.gz OBUNGGJFKNDKEB-SFHVURJKSA-N 1 3 333.520 2.889 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)C[C@H](C)NC(=O)CN(C)C(C)C)c(C)c1 ZINC001367862340 1339075946 /nfs/dbraw/zinc/07/59/46/1339075946.db2.gz OBUNGGJFKNDKEB-SFHVURJKSA-N 1 3 333.520 2.889 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+][C@H]1CCc2ccccc21)C1CC1)C1CCC1 ZINC001367909319 1339100504 /nfs/dbraw/zinc/10/05/04/1339100504.db2.gz ZBPWMLGAHFCSBH-VQTJNVASSA-N 1 3 341.499 2.643 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]CC1CCC(F)(F)CC1)C1CC1 ZINC001367919616 1339107860 /nfs/dbraw/zinc/10/78/60/1339107860.db2.gz LSQAACSTTVEROZ-INIZCTEOSA-N 1 3 345.478 2.637 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]Cc1ccccc1 ZINC001367924558 1339111140 /nfs/dbraw/zinc/11/11/40/1339111140.db2.gz ASRXTMUNFZCFBH-MOPGFXCFSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)N2CC[C@H]2CNC(=O)CCC[NH+](C)C)c1 ZINC001367959186 1339128148 /nfs/dbraw/zinc/12/81/48/1339128148.db2.gz JJQORIIBDXILON-MSOLQXFVSA-N 1 3 331.504 2.897 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)N2CC[C@@H]2CNC(=O)CCC[NH+](C)C)c1 ZINC001367959187 1339128682 /nfs/dbraw/zinc/12/86/82/1339128682.db2.gz JJQORIIBDXILON-QZTJIDSGSA-N 1 3 331.504 2.897 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC[C@H]2CCN2[C@@H]2CCc3ccccc32)CC1 ZINC001367960014 1339129396 /nfs/dbraw/zinc/12/93/96/1339129396.db2.gz HZXIARZXNPMLBV-UYAOXDASSA-N 1 3 341.499 2.596 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+]CC2CCC(C)CC2)CC1 ZINC001368039513 1339170629 /nfs/dbraw/zinc/17/06/29/1339170629.db2.gz KABBWCRNAKKODK-ABHNRTSZSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@H](F)C[N@@H+]1CC[C@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001368042149 1339171967 /nfs/dbraw/zinc/17/19/67/1339171967.db2.gz GVMFQQFNHHNMAE-ROUUACIJSA-N 1 3 341.515 2.635 10 0 EFAEHO CC[C@H](F)C[N@H+]1CC[C@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001368042149 1339171969 /nfs/dbraw/zinc/17/19/69/1339171969.db2.gz GVMFQQFNHHNMAE-ROUUACIJSA-N 1 3 341.515 2.635 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)N1C[C@H]2CCC[C@@H](C1)N2CCC1CC1 ZINC001368052037 1339178411 /nfs/dbraw/zinc/17/84/11/1339178411.db2.gz HDMYEKQKCSEORK-KDURUIRLSA-N 1 3 333.520 2.728 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCc2cccs2)C[C@H]1C ZINC001368109502 1339197628 /nfs/dbraw/zinc/19/76/28/1339197628.db2.gz SCMNYNCDWZCUEQ-HZPDHXFCSA-N 1 3 337.533 2.600 10 0 EFAEHO Cc1cc(F)ccc1C[NH+]1CCC(C)(NC(=O)CN(C)C(C)C)CC1 ZINC001368129401 1339207204 /nfs/dbraw/zinc/20/72/04/1339207204.db2.gz QFFBNAXQIXKYFM-UHFFFAOYSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@]1(C)CCC[N@H+](CC2CC(F)(F)C2)C1 ZINC001368227259 1339272980 /nfs/dbraw/zinc/27/29/80/1339272980.db2.gz YVFKOZUWOAVWPG-QGZVFWFLSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@]1(C)CCC[N@@H+](CC2CC(F)(F)C2)C1 ZINC001368227259 1339272982 /nfs/dbraw/zinc/27/29/82/1339272982.db2.gz YVFKOZUWOAVWPG-QGZVFWFLSA-N 1 3 345.478 2.590 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)[N@H+](CC2CC(C)(C)C2)C3)CCC1 ZINC001368328550 1339299971 /nfs/dbraw/zinc/29/99/71/1339299971.db2.gz VMKBSQBNIHMCME-SZMVWBNQSA-N 1 3 347.547 2.876 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)[N@@H+](CC2CC(C)(C)C2)C3)CCC1 ZINC001368328550 1339299973 /nfs/dbraw/zinc/29/99/73/1339299973.db2.gz VMKBSQBNIHMCME-SZMVWBNQSA-N 1 3 347.547 2.876 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccsc1)C2 ZINC001368328628 1339300138 /nfs/dbraw/zinc/30/01/38/1339300138.db2.gz VWFWEICTYFHRAX-BBWFWOEESA-N 1 3 335.517 2.559 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccsc1)C2 ZINC001368328628 1339300141 /nfs/dbraw/zinc/30/01/41/1339300141.db2.gz VWFWEICTYFHRAX-BBWFWOEESA-N 1 3 335.517 2.559 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CCCC1)N(C)C ZINC001368342734 1339307576 /nfs/dbraw/zinc/30/75/76/1339307576.db2.gz AVTCSXSGMVJBGB-RDGPPVDQSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCCC1)N(C)C ZINC001368342734 1339307578 /nfs/dbraw/zinc/30/75/78/1339307578.db2.gz AVTCSXSGMVJBGB-RDGPPVDQSA-N 1 3 335.536 2.876 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1CN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001368347941 1339310281 /nfs/dbraw/zinc/31/02/81/1339310281.db2.gz HMENIAWGKYYPJN-XLIONFOSSA-N 1 3 345.531 2.773 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2cc(C)ccc2C)C1 ZINC001368352473 1339312626 /nfs/dbraw/zinc/31/26/26/1339312626.db2.gz NXYBGARRWFYPDT-QUCCMNQESA-N 1 3 345.531 2.829 10 0 EFAEHO CN(C[C@@H]1CCN1CC1CCC1)C(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001368403142 1339341405 /nfs/dbraw/zinc/34/14/05/1339341405.db2.gz PTIYGRSIIBSXQW-LPHOPBHVSA-N 1 3 339.499 2.532 10 0 EFAEHO CN(C[C@@H]1CCN1CC1CCC1)C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001368403142 1339341414 /nfs/dbraw/zinc/34/14/14/1339341414.db2.gz PTIYGRSIIBSXQW-LPHOPBHVSA-N 1 3 339.499 2.532 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](CC[NH2+][C@@H]2CCc3ccccc32)C1 ZINC001368420221 1339354217 /nfs/dbraw/zinc/35/42/17/1339354217.db2.gz MXQPNXSJPNAATO-FXAWDEMLSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)CCC[NH+]1CCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)CC1 ZINC001368422136 1339355982 /nfs/dbraw/zinc/35/59/82/1339355982.db2.gz JFWQNAAVWWXCOJ-SFHVURJKSA-N 1 3 335.536 2.689 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)CCCN(C)C(=O)[C@H]2CCCN2C)c1 ZINC001368524244 1339460931 /nfs/dbraw/zinc/46/09/31/1339460931.db2.gz HJVZEFSBNISBPX-QFBILLFUSA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)CCCN(C)C(=O)[C@H]2CCCN2C)c1 ZINC001368524244 1339460933 /nfs/dbraw/zinc/46/09/33/1339460933.db2.gz HJVZEFSBNISBPX-QFBILLFUSA-N 1 3 347.503 2.631 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@H+](CCC(C)(C)C)CC1)N(C)C ZINC001368532914 1339471088 /nfs/dbraw/zinc/47/10/88/1339471088.db2.gz MEPYUYHMEPFZMC-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@@H+](CCC(C)(C)C)CC1)N(C)C ZINC001368532914 1339471089 /nfs/dbraw/zinc/47/10/89/1339471089.db2.gz MEPYUYHMEPFZMC-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2C[C@H]([NH2+][C@@H]3CCc4ccccc43)C2)C1 ZINC001368592006 1339538248 /nfs/dbraw/zinc/53/82/48/1339538248.db2.gz POVHQFOTEJZRNX-QQTQMKHKSA-N 1 3 341.499 2.500 10 0 EFAEHO CC[C@H](C)C[NH2+][C@H]1C[C@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001368594316 1339539895 /nfs/dbraw/zinc/53/98/95/1339539895.db2.gz VPSPFURCZJTJDR-FPXQBCRKSA-N 1 3 341.515 2.729 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CCC(C)(NC/C(Cl)=C\Cl)CC2)CC1 ZINC001368659610 1339572085 /nfs/dbraw/zinc/57/20/85/1339572085.db2.gz UZNOVDIVIAXFSZ-JLHYYAGUSA-N 1 3 348.318 2.618 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]Cc2ccc(C)cc2)CC1 ZINC001368665893 1339578478 /nfs/dbraw/zinc/57/84/78/1339578478.db2.gz WRMDCDNOJSIACK-UHFFFAOYSA-N 1 3 331.504 2.808 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)[C@@H](C)C1 ZINC001368693895 1339608689 /nfs/dbraw/zinc/60/86/89/1339608689.db2.gz DGXAVDMPAZALRK-FUHWJXTLSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)[C@@H](C)C1 ZINC001368693895 1339608692 /nfs/dbraw/zinc/60/86/92/1339608692.db2.gz DGXAVDMPAZALRK-FUHWJXTLSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@@H]([NH2+]CC1CC(NC(=O)CN(C)C2CCC2)C1)c1ccccc1 ZINC001368807298 1339743615 /nfs/dbraw/zinc/74/36/15/1339743615.db2.gz GKIMNKRIUPLYQY-KLHKWILBSA-N 1 3 329.488 2.716 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001368825171 1339764966 /nfs/dbraw/zinc/76/49/66/1339764966.db2.gz ZOMIUXZNVZKKNQ-CTWPCTMYSA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@H](F)C[N@@H+]1CC[C@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001368826917 1339767575 /nfs/dbraw/zinc/76/75/75/1339767575.db2.gz MYPZNAYHFAOTDS-HOTGVXAUSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@H](F)C[N@H+]1CC[C@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001368826917 1339767582 /nfs/dbraw/zinc/76/75/82/1339767582.db2.gz MYPZNAYHFAOTDS-HOTGVXAUSA-N 1 3 341.515 2.826 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@H+](Cc2cccnc2)CC(C)(C)C1 ZINC001368832378 1339772557 /nfs/dbraw/zinc/77/25/57/1339772557.db2.gz MMGDIHMFJUGWOM-GOSISDBHSA-N 1 3 346.519 2.530 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@@H+](Cc2cccnc2)CC(C)(C)C1 ZINC001368832378 1339772561 /nfs/dbraw/zinc/77/25/61/1339772561.db2.gz MMGDIHMFJUGWOM-GOSISDBHSA-N 1 3 346.519 2.530 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@H+](Cc2cccnc2)CC(C)(C)C1 ZINC001368832398 1339772998 /nfs/dbraw/zinc/77/29/98/1339772998.db2.gz MMGDIHMFJUGWOM-SFHVURJKSA-N 1 3 346.519 2.530 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@@H+](Cc2cccnc2)CC(C)(C)C1 ZINC001368832398 1339773003 /nfs/dbraw/zinc/77/30/03/1339773003.db2.gz MMGDIHMFJUGWOM-SFHVURJKSA-N 1 3 346.519 2.530 10 0 EFAEHO Cc1cccnc1CN[C@H](C)[C@@H](C)NC(=O)CCC[NH+]1CCCCC1 ZINC001368902446 1339843765 /nfs/dbraw/zinc/84/37/65/1339843765.db2.gz UQKPSNZAVKMKMB-QZTJIDSGSA-N 1 3 346.519 2.639 10 0 EFAEHO Cc1ccccc1C[N@H+]1C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001369112652 1339925044 /nfs/dbraw/zinc/92/50/44/1339925044.db2.gz GCWBCJIZZHKEOG-RBUKOAKNSA-N 1 3 345.531 2.908 10 0 EFAEHO Cc1ccccc1C[N@@H+]1C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001369112652 1339925047 /nfs/dbraw/zinc/92/50/47/1339925047.db2.gz GCWBCJIZZHKEOG-RBUKOAKNSA-N 1 3 345.531 2.908 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@H+](CC2CC3(CCC3)C2)CC1(C)C)N(C)C ZINC001369129263 1339933955 /nfs/dbraw/zinc/93/39/55/1339933955.db2.gz OQOZTPNNBASDGI-ROUUACIJSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@@H+](CC2CC3(CCC3)C2)CC1(C)C)N(C)C ZINC001369129263 1339933958 /nfs/dbraw/zinc/93/39/58/1339933958.db2.gz OQOZTPNNBASDGI-ROUUACIJSA-N 1 3 349.563 2.980 10 0 EFAEHO CN(C/C=C\Cl)C[C@@H]1CCCN(C(=O)CC[C@@H]2CCC[N@@H+]2C)C1 ZINC001370292338 1340013354 /nfs/dbraw/zinc/01/33/54/1340013354.db2.gz AZIJCWSUIRCLEP-LNUYWUECSA-N 1 3 341.927 2.784 10 0 EFAEHO CN(C/C=C\Cl)C[C@@H]1CCCN(C(=O)CC[C@@H]2CCC[N@H+]2C)C1 ZINC001370292338 1340013357 /nfs/dbraw/zinc/01/33/57/1340013357.db2.gz AZIJCWSUIRCLEP-LNUYWUECSA-N 1 3 341.927 2.784 10 0 EFAEHO CN(C/C=C/Cl)C[C@@H]1CCCN(C(=O)CC[C@@H]2CCC[N@@H+]2C)C1 ZINC001370292337 1340013749 /nfs/dbraw/zinc/01/37/49/1340013749.db2.gz AZIJCWSUIRCLEP-KRBAWLLUSA-N 1 3 341.927 2.784 10 0 EFAEHO CN(C/C=C/Cl)C[C@@H]1CCCN(C(=O)CC[C@@H]2CCC[N@H+]2C)C1 ZINC001370292337 1340013750 /nfs/dbraw/zinc/01/37/50/1340013750.db2.gz AZIJCWSUIRCLEP-KRBAWLLUSA-N 1 3 341.927 2.784 10 0 EFAEHO CCC[N@H+](C)C[C@H]1CCCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001370303305 1340022564 /nfs/dbraw/zinc/02/25/64/1340022564.db2.gz LAQOXJLZIKTJGS-APWZRJJASA-N 1 3 341.515 2.779 10 0 EFAEHO CCC[N@@H+](C)C[C@H]1CCCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001370303305 1340022567 /nfs/dbraw/zinc/02/25/67/1340022567.db2.gz LAQOXJLZIKTJGS-APWZRJJASA-N 1 3 341.515 2.779 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(C3CCC3)cc2)C1 ZINC001370402089 1340058024 /nfs/dbraw/zinc/05/80/24/1340058024.db2.gz BAHUNLSFUSQVAP-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+][C@H]2CCCc3ccc(F)cc32)C1 ZINC001370432615 1340075466 /nfs/dbraw/zinc/07/54/66/1340075466.db2.gz VBHMTYCBPCHSKP-HKUYNNGSSA-N 1 3 347.478 2.734 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CCc1cccs1)N(C)C ZINC001370589553 1340151131 /nfs/dbraw/zinc/15/11/31/1340151131.db2.gz YDRCNWZBKFHZCJ-YCXXCVGLSA-N 1 3 349.544 2.742 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCc1cccs1)N(C)C ZINC001370589553 1340151136 /nfs/dbraw/zinc/15/11/36/1340151136.db2.gz YDRCNWZBKFHZCJ-YCXXCVGLSA-N 1 3 349.544 2.742 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@H+](CCC(F)(F)F)CC[C@H]21 ZINC001370592905 1340153247 /nfs/dbraw/zinc/15/32/47/1340153247.db2.gz OOFYDLCFNKOXEU-HUUCEWRRSA-N 1 3 349.441 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@@H+](CCC(F)(F)F)CC[C@H]21 ZINC001370592905 1340153248 /nfs/dbraw/zinc/15/32/48/1340153248.db2.gz OOFYDLCFNKOXEU-HUUCEWRRSA-N 1 3 349.441 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@H+](CCC(F)(F)F)CC[C@H]21 ZINC001370592906 1340153489 /nfs/dbraw/zinc/15/34/89/1340153489.db2.gz OOFYDLCFNKOXEU-LSDHHAIUSA-N 1 3 349.441 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@@H+](CCC(F)(F)F)CC[C@H]21 ZINC001370592906 1340153492 /nfs/dbraw/zinc/15/34/92/1340153492.db2.gz OOFYDLCFNKOXEU-LSDHHAIUSA-N 1 3 349.441 2.592 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)C3CCC3)C2)cc1C ZINC001370636128 1340178800 /nfs/dbraw/zinc/17/88/00/1340178800.db2.gz KIRPWKOXIMGDPZ-HDICACEKSA-N 1 3 329.488 2.525 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001370646494 1340179526 /nfs/dbraw/zinc/17/95/26/1340179526.db2.gz CVTYUWODZBUOCJ-XJFOESAGSA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001370646494 1340179528 /nfs/dbraw/zinc/17/95/28/1340179528.db2.gz CVTYUWODZBUOCJ-XJFOESAGSA-N 1 3 346.302 2.559 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2F)C1)N(C)C ZINC001370652463 1340180248 /nfs/dbraw/zinc/18/02/48/1340180248.db2.gz WHIGWBCDSXVMBT-IJEWVQPXSA-N 1 3 341.858 2.556 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccccc32)C1)N(C)C ZINC001370671454 1340183094 /nfs/dbraw/zinc/18/30/94/1340183094.db2.gz LVHHUGSZHADAPW-PIKOESSRSA-N 1 3 343.515 2.887 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCCc3ccccc32)C1)N(C)C ZINC001370671448 1340183124 /nfs/dbraw/zinc/18/31/24/1340183124.db2.gz LVHHUGSZHADAPW-KVPLUYHFSA-N 1 3 343.515 2.887 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2F)C1 ZINC001370711101 1340187809 /nfs/dbraw/zinc/18/78/09/1340187809.db2.gz JIXPCYAQJRTEBK-GASCZTMLSA-N 1 3 341.858 2.558 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2Cl)C1 ZINC001370716512 1340189180 /nfs/dbraw/zinc/18/91/80/1340189180.db2.gz CBTGHGWMWXWVOH-GASCZTMLSA-N 1 3 341.858 2.556 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)c(F)c2)C1 ZINC001370720091 1340189828 /nfs/dbraw/zinc/18/98/28/1340189828.db2.gz NXIUEEWWKTXGLP-OKILXGFUSA-N 1 3 341.858 2.556 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001370757101 1340200151 /nfs/dbraw/zinc/20/01/51/1340200151.db2.gz YCSWPWOUGZWTNG-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001370757101 1340200153 /nfs/dbraw/zinc/20/01/53/1340200153.db2.gz YCSWPWOUGZWTNG-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)C1 ZINC001370776731 1340204777 /nfs/dbraw/zinc/20/47/77/1340204777.db2.gz BAJMLMDDHZYMMN-PXNSSMCTSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CCC[N@H+]([C@H]2CCc3ccccc32)C1 ZINC001370776731 1340204780 /nfs/dbraw/zinc/20/47/80/1340204780.db2.gz BAJMLMDDHZYMMN-PXNSSMCTSA-N 1 3 343.515 2.844 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)C1 ZINC001370787530 1340210549 /nfs/dbraw/zinc/21/05/49/1340210549.db2.gz ILGOLILODNXDBP-PXNSSMCTSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@H+]([C@H]2CCc3ccccc32)C1 ZINC001370787530 1340210553 /nfs/dbraw/zinc/21/05/53/1340210553.db2.gz ILGOLILODNXDBP-PXNSSMCTSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](Cc2ccc(F)cc2C)C1)N(C)C ZINC001370789349 1340211490 /nfs/dbraw/zinc/21/14/90/1340211490.db2.gz ZFCDJGAQQVNFBA-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2C)C1)N(C)C ZINC001370789349 1340211493 /nfs/dbraw/zinc/21/14/93/1340211493.db2.gz ZFCDJGAQQVNFBA-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)NC[C@@H]1CCCCN1CCCF ZINC001370852958 1340236429 /nfs/dbraw/zinc/23/64/29/1340236429.db2.gz KGTCKZIXJFRUIF-KRWDZBQOSA-N 1 3 341.515 2.970 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)NC[C@@H]1CCCCN1CCCF ZINC001370852958 1340236433 /nfs/dbraw/zinc/23/64/33/1340236433.db2.gz KGTCKZIXJFRUIF-KRWDZBQOSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[NH2+][C@H]1CCc2ccccc21 ZINC001370949091 1340301973 /nfs/dbraw/zinc/30/19/73/1340301973.db2.gz GWVKLCQEIKYXLW-ICSRJNTNSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H]1CCC[N@H+](Cc2ccc(F)cc2)C1 ZINC001370971084 1340314943 /nfs/dbraw/zinc/31/49/43/1340314943.db2.gz PFSIGDGGSUSLGC-AEFFLSMTSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H]1CCC[N@@H+](Cc2ccc(F)cc2)C1 ZINC001370971084 1340314946 /nfs/dbraw/zinc/31/49/46/1340314946.db2.gz PFSIGDGGSUSLGC-AEFFLSMTSA-N 1 3 349.494 2.883 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]CC=C(Cl)Cl)CC1)N(C)C ZINC001371071647 1340344280 /nfs/dbraw/zinc/34/42/80/1340344280.db2.gz MZMSFUOCSKDXPY-WXRRBKDZSA-N 1 3 336.307 2.663 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]CCc2ccc(C)cc2)CC1)N(C)C ZINC001371075451 1340347653 /nfs/dbraw/zinc/34/76/53/1340347653.db2.gz XULTWBDTZWQQGP-SOAGJPPSSA-N 1 3 345.531 2.895 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CNC(=O)C(C)(C)N2CCCCC2)c(C)n1 ZINC001371182307 1340398787 /nfs/dbraw/zinc/39/87/87/1340398787.db2.gz XUKNSEJNQXZOAV-INIZCTEOSA-N 1 3 346.519 2.557 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CNC(=O)C(C)(C)N2CCCCC2)c(C)n1 ZINC001371182320 1340399026 /nfs/dbraw/zinc/39/90/26/1340399026.db2.gz XUKNSEJNQXZOAV-MRXNPFEDSA-N 1 3 346.519 2.557 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H](C)[NH2+]Cc1ccc(C2CC2)cc1)N(C)C ZINC001371215060 1340422922 /nfs/dbraw/zinc/42/29/22/1340422922.db2.gz WPXQBRVPPKTESS-KXBFYZLASA-N 1 3 331.504 2.745 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001371305689 1340487020 /nfs/dbraw/zinc/48/70/20/1340487020.db2.gz IPYZKVNEWWRDIJ-KRWDZBQOSA-N 1 3 345.531 2.760 10 0 EFAEHO C[C@@H](CNC(=O)CC[N@H+](C)C1CCCCC1)NCc1ccsc1 ZINC001371319407 1340494663 /nfs/dbraw/zinc/49/46/63/1340494663.db2.gz WUYJAOPZYYPHJH-HNNXBMFYSA-N 1 3 337.533 2.997 10 0 EFAEHO C[C@@H](CNC(=O)CC[N@@H+](C)C1CCCCC1)NCc1ccsc1 ZINC001371319407 1340494665 /nfs/dbraw/zinc/49/46/65/1340494665.db2.gz WUYJAOPZYYPHJH-HNNXBMFYSA-N 1 3 337.533 2.997 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001371361792 1340529226 /nfs/dbraw/zinc/52/92/26/1340529226.db2.gz HJQHLAMDVYTRCL-OAHLLOKOSA-N 1 3 344.503 2.740 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001371361788 1340529317 /nfs/dbraw/zinc/52/93/17/1340529317.db2.gz HJQHLAMDVYTRCL-HNNXBMFYSA-N 1 3 344.503 2.740 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001371556102 1340643006 /nfs/dbraw/zinc/64/30/06/1340643006.db2.gz OLFKQTJOXHGENN-ROUUACIJSA-N 1 3 331.504 2.895 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NC1(C)CCC(C)(C)CC1 ZINC001371596172 1340665813 /nfs/dbraw/zinc/66/58/13/1340665813.db2.gz DBZXUYNKKIYLSW-INIZCTEOSA-N 1 3 340.556 2.917 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NC1(C)CCC(C)(C)CC1 ZINC001371596172 1340665817 /nfs/dbraw/zinc/66/58/17/1340665817.db2.gz DBZXUYNKKIYLSW-INIZCTEOSA-N 1 3 340.556 2.917 10 0 EFAEHO CC[C@](C)(NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccccc1 ZINC001371602243 1340669244 /nfs/dbraw/zinc/66/92/44/1340669244.db2.gz VNLYQUUJZQAKBI-PXNSSMCTSA-N 1 3 348.535 2.883 10 0 EFAEHO CC[C@](C)(NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccccc1 ZINC001371602243 1340669247 /nfs/dbraw/zinc/66/92/47/1340669247.db2.gz VNLYQUUJZQAKBI-PXNSSMCTSA-N 1 3 348.535 2.883 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001371612093 1340675032 /nfs/dbraw/zinc/67/50/32/1340675032.db2.gz FLWOBRMGRVZZGX-SFHVURJKSA-N 1 3 331.504 2.582 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2csc(C)c2)C1)N(C)C ZINC001373202232 1340945898 /nfs/dbraw/zinc/94/58/98/1340945898.db2.gz SWYDFOYTABEMDK-DOTOQJQBSA-N 1 3 337.533 2.725 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2csc(C)c2)C1)N(C)C ZINC001373202232 1340945900 /nfs/dbraw/zinc/94/59/00/1340945900.db2.gz SWYDFOYTABEMDK-DOTOQJQBSA-N 1 3 337.533 2.725 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@H+](CCc2ccccc2F)C1 ZINC001373243768 1340965293 /nfs/dbraw/zinc/96/52/93/1340965293.db2.gz GTAFVJXKXVXOBD-KRWDZBQOSA-N 1 3 349.494 2.537 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@@H+](CCc2ccccc2F)C1 ZINC001373243768 1340965294 /nfs/dbraw/zinc/96/52/94/1340965294.db2.gz GTAFVJXKXVXOBD-KRWDZBQOSA-N 1 3 349.494 2.537 10 0 EFAEHO Cc1ccc(CC[N@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)cc1 ZINC001373246589 1340966545 /nfs/dbraw/zinc/96/65/45/1340966545.db2.gz MATQREHFVVBXEA-HXUWFJFHSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CC[N@@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)cc1 ZINC001373246589 1340966547 /nfs/dbraw/zinc/96/65/47/1340966547.db2.gz MATQREHFVVBXEA-HXUWFJFHSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@H]1CCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001373309007 1340985275 /nfs/dbraw/zinc/98/52/75/1340985275.db2.gz DQGFODPARXPVIX-MSOLQXFVSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@H]1CCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001373309007 1340985276 /nfs/dbraw/zinc/98/52/76/1340985276.db2.gz DQGFODPARXPVIX-MSOLQXFVSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@H+](C)Cc2ccc(F)cc2)CC1 ZINC001373333157 1340994484 /nfs/dbraw/zinc/99/44/84/1340994484.db2.gz KBFFZSRSYZEJBZ-UHFFFAOYSA-N 1 3 349.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@@H+](C)Cc2ccc(F)cc2)CC1 ZINC001373333157 1340994485 /nfs/dbraw/zinc/99/44/85/1340994485.db2.gz KBFFZSRSYZEJBZ-UHFFFAOYSA-N 1 3 349.494 2.836 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC001373381054 1341005865 /nfs/dbraw/zinc/00/58/65/1341005865.db2.gz UWZCDMWJMXVHGY-MOPGFXCFSA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC001373381054 1341005866 /nfs/dbraw/zinc/00/58/66/1341005866.db2.gz UWZCDMWJMXVHGY-MOPGFXCFSA-N 1 3 329.488 2.642 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1C[C@@H]2C[C@H]1CN2[C@@H](C)c1cc(C)ccc1C ZINC001373579395 1341059476 /nfs/dbraw/zinc/05/94/76/1341059476.db2.gz VZQFBBJRZZUVBK-FHWLQOOXSA-N 1 3 343.515 2.991 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1C[C@@H]2C[C@H]1CN2[C@@H](C)c1cc(C)ccc1C ZINC001373579395 1341059478 /nfs/dbraw/zinc/05/94/78/1341059478.db2.gz VZQFBBJRZZUVBK-FHWLQOOXSA-N 1 3 343.515 2.991 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@H]1CCN([C@@H](C)c2cccc(OC)c2)C1 ZINC001373707565 1341113521 /nfs/dbraw/zinc/11/35/21/1341113521.db2.gz HXCNVJCNJYGNSD-WMZOPIPTSA-N 1 3 347.503 2.631 10 0 EFAEHO CCN(C(=O)C[C@@H]1CC[N@H+](C)C1)[C@H]1CCN(Cc2cccc(C)c2)C1 ZINC001373714561 1341117633 /nfs/dbraw/zinc/11/76/33/1341117633.db2.gz FOTOFRSLZFAOGP-PMACEKPBSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)C[C@@H]1CC[N@@H+](C)C1)[C@H]1CCN(Cc2cccc(C)c2)C1 ZINC001373714561 1341117634 /nfs/dbraw/zinc/11/76/34/1341117634.db2.gz FOTOFRSLZFAOGP-PMACEKPBSA-N 1 3 343.515 2.760 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCCC1)[NH2+]Cc1ccsc1 ZINC001373753200 1341134437 /nfs/dbraw/zinc/13/44/37/1341134437.db2.gz MAOKOWDRLDZLGY-MRXNPFEDSA-N 1 3 337.533 2.997 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](CC)[NH2+]Cc1ccc(C)cc1 ZINC001373764143 1341139007 /nfs/dbraw/zinc/13/90/07/1341139007.db2.gz YZZOCJWEHNZWDH-RBUKOAKNSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]CC1CCC(F)(F)CC1 ZINC001373800482 1341153085 /nfs/dbraw/zinc/15/30/85/1341153085.db2.gz YBERTTVOVCUNAA-HOCLYGCPSA-N 1 3 345.478 2.638 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@](C)(NC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001373895368 1341192964 /nfs/dbraw/zinc/19/29/64/1341192964.db2.gz CKCRTUMQSXTEMK-FQEVSTJZSA-N 1 3 331.504 2.710 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[C@H]([NH2+]Cc2ccc(C)nc2C)CC1)N(C)C ZINC001373922985 1341204992 /nfs/dbraw/zinc/20/49/92/1341204992.db2.gz CXMCSPZXNMLHLN-FHWLQOOXSA-N 1 3 346.519 2.556 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC001374112980 1341423329 /nfs/dbraw/zinc/42/33/29/1341423329.db2.gz VHHSLAOMOBVVSB-BEFAXECRSA-N 1 3 349.494 2.885 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+]C[C@H](F)CC)CCCC1 ZINC001374161619 1341482291 /nfs/dbraw/zinc/48/22/91/1341482291.db2.gz SJDDXCUGJDKRAX-HZPDHXFCSA-N 1 3 327.488 2.628 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(CNC(=O)C(C)(C)N2CCCC2)CCCC1 ZINC001374166792 1341494493 /nfs/dbraw/zinc/49/44/93/1341494493.db2.gz TWSMDAIRCFCYRV-OAHLLOKOSA-N 1 3 327.488 2.628 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)N(C)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001392063158 1355744639 /nfs/dbraw/zinc/74/46/39/1355744639.db2.gz LJMZYXUWYGYKPB-JHJVBQTASA-N 1 3 343.924 2.678 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)N(C)C(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001392063158 1355744641 /nfs/dbraw/zinc/74/46/41/1355744641.db2.gz LJMZYXUWYGYKPB-JHJVBQTASA-N 1 3 343.924 2.678 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCN(CC3CCCCCC3)CC2)CC[N@@H+]1C ZINC001374300088 1341683262 /nfs/dbraw/zinc/68/32/62/1341683262.db2.gz QXCQKHTZDVQQNR-RBUKOAKNSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCN(CC3CCCCCC3)CC2)CC[N@H+]1C ZINC001374300088 1341683264 /nfs/dbraw/zinc/68/32/64/1341683264.db2.gz QXCQKHTZDVQQNR-RBUKOAKNSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(Cl)cc1 ZINC001374327063 1341729144 /nfs/dbraw/zinc/72/91/44/1341729144.db2.gz IPLHDFJHFFYRJZ-AWEZNQCLSA-N 1 3 325.884 2.617 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccccc1)N(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001392103517 1355767702 /nfs/dbraw/zinc/76/77/02/1355767702.db2.gz VTSMJSKUZLVYFZ-OXJNMPFZSA-N 1 3 349.494 2.836 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cccc(C(F)F)c1)N(C)C(=O)CN1CCCC1 ZINC001374323110 1341723318 /nfs/dbraw/zinc/72/33/18/1341723318.db2.gz ANWUGKSULQTFTL-AWEZNQCLSA-N 1 3 339.430 2.657 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC001374325720 1341727558 /nfs/dbraw/zinc/72/75/58/1341727558.db2.gz DHBUEZUFGKBMAU-RDTXWAMCSA-N 1 3 335.467 2.590 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1csc(C)c1 ZINC001374327683 1341730827 /nfs/dbraw/zinc/73/08/27/1341730827.db2.gz JSANDMYOBKODOW-PBHICJAKSA-N 1 3 337.533 2.867 10 0 EFAEHO CC(C)C[C@H](C[NH2+]C(C)C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001374354153 1341783456 /nfs/dbraw/zinc/78/34/56/1341783456.db2.gz QHYAEYNVQOQDEW-QAPCUYQASA-N 1 3 329.504 2.728 10 0 EFAEHO C[C@H]([NH2+]C/C(Cl)=C\Cl)[C@@H]1CCCN(C(=O)CN2CCCC2)C1 ZINC001374386317 1341837324 /nfs/dbraw/zinc/83/73/24/1341837324.db2.gz CDPPBBUUUNHHIT-WIGWJDOSSA-N 1 3 348.318 2.618 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)CCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001392316635 1355976807 /nfs/dbraw/zinc/97/68/07/1355976807.db2.gz XETHUZVPIQACLA-QAPCUYQASA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)CCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001392316635 1355976808 /nfs/dbraw/zinc/97/68/08/1355976808.db2.gz XETHUZVPIQACLA-QAPCUYQASA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccsc1 ZINC001374419125 1341897415 /nfs/dbraw/zinc/89/74/15/1341897415.db2.gz KWZXASSBDMDFOP-SJORKVTESA-N 1 3 337.533 2.851 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)NCc1ccccc1F ZINC001374425783 1341907758 /nfs/dbraw/zinc/90/77/58/1341907758.db2.gz ZWFPOZYNDPLQTN-PKOBYXMFSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)NCc1ccccc1F ZINC001374425783 1341907760 /nfs/dbraw/zinc/90/77/60/1341907760.db2.gz ZWFPOZYNDPLQTN-PKOBYXMFSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)[C@H](CNC(=O)CC[NH+](C)C)NCc1ccc(Cl)cc1F ZINC001374430404 1341912312 /nfs/dbraw/zinc/91/23/12/1341912312.db2.gz CLSXHKVXKXQHJE-INIZCTEOSA-N 1 3 343.874 2.661 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]CC1CC2(CCC2)C1 ZINC001374434129 1341917732 /nfs/dbraw/zinc/91/77/32/1341917732.db2.gz PSGMZSJSDGHFKI-FUHWJXTLSA-N 1 3 335.536 2.639 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)c1 ZINC001374435119 1341918278 /nfs/dbraw/zinc/91/82/78/1341918278.db2.gz ZOJHRXKAXXHTPC-OXJNMPFZSA-N 1 3 345.531 2.876 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)c1 ZINC001374435121 1341918642 /nfs/dbraw/zinc/91/86/42/1341918642.db2.gz ZOJHRXKAXXHTPC-UZLBHIALSA-N 1 3 345.531 2.876 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NCc1sccc1Cl ZINC001374444544 1341929059 /nfs/dbraw/zinc/92/90/59/1341929059.db2.gz AFUNGMCPHACVLW-TZMCWYRMSA-N 1 3 343.924 2.584 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NCc1sccc1Cl ZINC001374444544 1341929064 /nfs/dbraw/zinc/92/90/64/1341929064.db2.gz AFUNGMCPHACVLW-TZMCWYRMSA-N 1 3 343.924 2.584 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H](C)c1ccc(F)cc1 ZINC001374448280 1341931009 /nfs/dbraw/zinc/93/10/09/1341931009.db2.gz BPKIXSYMIWAGDQ-MAUKXSAKSA-N 1 3 337.483 2.957 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001374455244 1341936444 /nfs/dbraw/zinc/93/64/44/1341936444.db2.gz SLYDXJUTNYBKMT-OALUTQOASA-N 1 3 349.494 2.884 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1)Cc1ccccc1 ZINC001374551811 1342060662 /nfs/dbraw/zinc/06/06/62/1342060662.db2.gz TYPSVLONLLASMD-RBUKOAKNSA-N 1 3 331.504 2.697 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)CC1CCC(F)(F)CC1 ZINC001392733705 1356293173 /nfs/dbraw/zinc/29/31/73/1356293173.db2.gz ZBNLZYXIWWVAMG-AWEZNQCLSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)CC1CCC(F)(F)CC1 ZINC001392733705 1356293175 /nfs/dbraw/zinc/29/31/75/1356293175.db2.gz ZBNLZYXIWWVAMG-AWEZNQCLSA-N 1 3 333.467 2.589 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@@H](C)NC(=O)[C@H]1CCCN1C(C)C ZINC001374755172 1342153638 /nfs/dbraw/zinc/15/36/38/1342153638.db2.gz MRSZTBNSAJWICZ-IEBWSBKVSA-N 1 3 331.504 2.771 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]Cc1cc2ccccc2s1)N(C)C ZINC001374775961 1342164766 /nfs/dbraw/zinc/16/47/66/1342164766.db2.gz JLPQEEUDCNANKN-CZUORRHYSA-N 1 3 333.501 2.836 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N[C@H](C)CNCc2cc(C)ccc2F)C1 ZINC001374800194 1342178047 /nfs/dbraw/zinc/17/80/47/1342178047.db2.gz AJMGZIWQABYBEK-IAGOWNOFSA-N 1 3 349.494 2.850 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N[C@H](C)CNCc2cc(C)ccc2F)C1 ZINC001374800194 1342178050 /nfs/dbraw/zinc/17/80/50/1342178050.db2.gz AJMGZIWQABYBEK-IAGOWNOFSA-N 1 3 349.494 2.850 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]CC1CCC2(CC2)CC1 ZINC001374847952 1342204950 /nfs/dbraw/zinc/20/49/50/1342204950.db2.gz BEQJAYJHZMVMTR-AEFFLSMTSA-N 1 3 335.536 2.926 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1C ZINC001375047293 1342347448 /nfs/dbraw/zinc/34/74/48/1342347448.db2.gz QZMNOIYDWMAVQQ-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1C ZINC001375047293 1342347455 /nfs/dbraw/zinc/34/74/55/1342347455.db2.gz QZMNOIYDWMAVQQ-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C[N@H+](C)CC1CCC2(CC2)CC1 ZINC001375140334 1342455416 /nfs/dbraw/zinc/45/54/16/1342455416.db2.gz BUNARRFTABOWIJ-CQSZACIVSA-N 1 3 332.492 2.668 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001375140334 1342455421 /nfs/dbraw/zinc/45/54/21/1342455421.db2.gz BUNARRFTABOWIJ-CQSZACIVSA-N 1 3 332.492 2.668 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccsc1 ZINC001393468090 1356868734 /nfs/dbraw/zinc/86/87/34/1356868734.db2.gz UJJGCIYZUKVSTG-DLBZAZTESA-N 1 3 335.517 2.655 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]Cc1cccc(F)c1 ZINC001375290340 1342597402 /nfs/dbraw/zinc/59/74/02/1342597402.db2.gz UGRFYQDBDXDLNS-HKUYNNGSSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+][C@H]2CCc3ccccc32)CC1 ZINC001375419940 1342724422 /nfs/dbraw/zinc/72/44/22/1342724422.db2.gz GFCNSMRSRIVFGI-OALUTQOASA-N 1 3 341.499 2.785 10 0 EFAEHO Cc1cc(C)c(CN2CC[C@H]2CN(C)C(=O)CCC[NH+](C)C)c(C)c1 ZINC001375458308 1342760908 /nfs/dbraw/zinc/76/09/08/1342760908.db2.gz NFCUEJGBOQAALC-IBGZPJMESA-N 1 3 345.531 2.986 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N(C)C[C@@H]1CCN1[C@H]1CCc2ccccc21 ZINC001375463163 1342769376 /nfs/dbraw/zinc/76/93/76/1342769376.db2.gz BFWDJHWDXQILRO-ICSRJNTNSA-N 1 3 343.515 2.939 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N(C)C[C@@H]1CCN1[C@H]1CCc2ccccc21 ZINC001375463163 1342769377 /nfs/dbraw/zinc/76/93/77/1342769377.db2.gz BFWDJHWDXQILRO-ICSRJNTNSA-N 1 3 343.515 2.939 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NCC2([NH2+]CC3CCCC3)CC2)C1 ZINC001375490856 1342797456 /nfs/dbraw/zinc/79/74/56/1342797456.db2.gz MVDBDEKDZAACKQ-IBGZPJMESA-N 1 3 339.499 2.628 10 0 EFAEHO C[C@H]([NH2+]C1(CNC(=O)CN2CC[C@H](C)C2)CC1)c1ccc(Cl)cc1 ZINC001375493543 1342800491 /nfs/dbraw/zinc/80/04/91/1342800491.db2.gz YXZHEAWYCYSNQY-GJZGRUSLSA-N 1 3 349.906 2.981 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+][C@H](C)c2cccc(OC)c2)C1)N(C)C ZINC001375553452 1342868338 /nfs/dbraw/zinc/86/83/38/1342868338.db2.gz HGEFAKZIWHCAPP-LFEHRJTNSA-N 1 3 347.503 2.581 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]([NH2+]Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001375559513 1342875631 /nfs/dbraw/zinc/87/56/31/1342875631.db2.gz WRFOSTPLGWSQAZ-QWFCFKBJSA-N 1 3 345.531 2.936 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccccc2F)C1)N(C)C ZINC001375571203 1342889552 /nfs/dbraw/zinc/88/95/52/1342889552.db2.gz DPNMCANPPLRNHK-KVSKMBFKSA-N 1 3 349.494 2.786 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C/Cl)C1 ZINC001375578519 1342898487 /nfs/dbraw/zinc/89/84/87/1342898487.db2.gz XLZMJJFSGNVVAG-UEYNBFAUSA-N 1 3 341.927 2.876 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]Cc1ccsc1 ZINC001375593384 1342912101 /nfs/dbraw/zinc/91/21/01/1342912101.db2.gz CQMXXDMPFXMCRI-WBVHZDCISA-N 1 3 337.533 2.807 10 0 EFAEHO CC[NH2+]C[C@H](NC(=O)[C@@H](CC)N(C)C)c1ccc2ccccc2c1 ZINC001375787348 1343013279 /nfs/dbraw/zinc/01/32/79/1343013279.db2.gz YYFCWAOJZXDHRR-RBUKOAKNSA-N 1 3 327.472 2.947 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C[NH2+]CC1CC1)C1CCCC1 ZINC001375795056 1343023643 /nfs/dbraw/zinc/02/36/43/1343023643.db2.gz VKGDXZDHEXGFJI-RBUKOAKNSA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1cc(CN2CC[C@](C)(NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)c(C)s1 ZINC001375851019 1343094988 /nfs/dbraw/zinc/09/49/88/1343094988.db2.gz RWSNGOODMJXWFK-APWZRJJASA-N 1 3 349.544 2.787 10 0 EFAEHO Cc1cc(CN2CC[C@](C)(NC(=O)C[C@H]3CC[N@H+](C)C3)C2)c(C)s1 ZINC001375851019 1343094995 /nfs/dbraw/zinc/09/49/95/1343094995.db2.gz RWSNGOODMJXWFK-APWZRJJASA-N 1 3 349.544 2.787 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@]2(C)CCN(C(=O)[C@H]3CCCN3C)C2)c1 ZINC001375865012 1343112435 /nfs/dbraw/zinc/11/24/35/1343112435.db2.gz AWHYSVJBDHWHSO-QUCCMNQESA-N 1 3 347.478 2.557 10 0 EFAEHO CC1([NH2+]C/C=C/c2ccccc2)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001393733530 1357111520 /nfs/dbraw/zinc/11/15/20/1357111520.db2.gz LWIZWCNIFQHJGA-VMPITWQZSA-N 1 3 338.455 2.636 10 0 EFAEHO CN(CC(=O)NC[C@@]1(C)CCC[N@H+](Cc2ccsc2)C1)C1CCC1 ZINC001375945937 1343197493 /nfs/dbraw/zinc/19/74/93/1343197493.db2.gz KZTWHLIUWHEONV-LJQANCHMSA-N 1 3 349.544 2.951 10 0 EFAEHO CN(CC(=O)NC[C@@]1(C)CCC[N@@H+](Cc2ccsc2)C1)C1CCC1 ZINC001375945937 1343197494 /nfs/dbraw/zinc/19/74/94/1343197494.db2.gz KZTWHLIUWHEONV-LJQANCHMSA-N 1 3 349.544 2.951 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@]1(C)CCC[N@H+](CC2CCCC2)C1)N(C)C ZINC001375954659 1343209720 /nfs/dbraw/zinc/20/97/20/1343209720.db2.gz DTPMAMZOBOWKIV-AZUAARDMSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CC2CCCC2)C1)N(C)C ZINC001375954659 1343209723 /nfs/dbraw/zinc/20/97/23/1343209723.db2.gz DTPMAMZOBOWKIV-AZUAARDMSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C)C[NH+]1CCC(N(C)C(=O)CN(C)CC(C)(C)C)CC1 ZINC001376011545 1343258106 /nfs/dbraw/zinc/25/81/06/1343258106.db2.gz DENIXMQCTTYXKW-INIZCTEOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001376146579 1343353573 /nfs/dbraw/zinc/35/35/73/1343353573.db2.gz UEYNJODLFHACOG-VQIMIIECSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001376146579 1343353574 /nfs/dbraw/zinc/35/35/74/1343353574.db2.gz UEYNJODLFHACOG-VQIMIIECSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1ccsc1)C1CC1 ZINC001376212028 1343401925 /nfs/dbraw/zinc/40/19/25/1343401925.db2.gz BUYHYQVEWHNVKO-IRXDYDNUSA-N 1 3 335.517 2.605 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]([NH2+][C@H]1CCc2ccccc21)C1CC1 ZINC001376252310 1343429601 /nfs/dbraw/zinc/42/96/01/1343429601.db2.gz CJDIAYBDSHQVAP-OALUTQOASA-N 1 3 329.488 2.500 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](C[N@H+](C)CCCC(C)C)C1)N(C)C ZINC001376298662 1343466450 /nfs/dbraw/zinc/46/64/50/1343466450.db2.gz YQFCSEXDBZJJSZ-QZTJIDSGSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](C[N@@H+](C)CCCC(C)C)C1)N(C)C ZINC001376298662 1343466453 /nfs/dbraw/zinc/46/64/53/1343466453.db2.gz YQFCSEXDBZJJSZ-QZTJIDSGSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](C[N@H+](C)CCCC(C)C)C1)N(C)C ZINC001376298666 1343466833 /nfs/dbraw/zinc/46/68/33/1343466833.db2.gz YQFCSEXDBZJJSZ-ZWKOTPCHSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](C[N@@H+](C)CCCC(C)C)C1)N(C)C ZINC001376298666 1343466836 /nfs/dbraw/zinc/46/68/36/1343466836.db2.gz YQFCSEXDBZJJSZ-ZWKOTPCHSA-N 1 3 325.541 2.933 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CC[C@H]([NH2+]Cc2cc(C)ccc2C)C1 ZINC001376322406 1343482274 /nfs/dbraw/zinc/48/22/74/1343482274.db2.gz LPLSWWLWNOXZDS-OALUTQOASA-N 1 3 349.494 2.674 10 0 EFAEHO CN(CC(=O)N1CC[C@H]([NH2+][C@@H]2CCc3ccccc32)C1)CC(C)(C)C ZINC001376333586 1343490016 /nfs/dbraw/zinc/49/00/16/1343490016.db2.gz SJHUTBSDMXLNIP-PKOBYXMFSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001376337222 1343493941 /nfs/dbraw/zinc/49/39/41/1343493941.db2.gz BESOKLVIRYFTOS-WBVHZDCISA-N 1 3 337.533 2.723 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001376364645 1343517759 /nfs/dbraw/zinc/51/77/59/1343517759.db2.gz QMMIVZHTABLPOO-FXAWDEMLSA-N 1 3 345.531 2.773 10 0 EFAEHO CC[C@@H](C(=O)N(Cc1ccccn1)C1CC[NH+](C(C)C)CC1)N(C)C ZINC001376380128 1343533583 /nfs/dbraw/zinc/53/35/83/1343533583.db2.gz RYEWHWIDSBNBPP-IBGZPJMESA-N 1 3 346.519 2.623 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H]([NH2+][C@@H](C)c2cc(C)ccc2C)C1)N(C)C ZINC001376396308 1343551030 /nfs/dbraw/zinc/55/10/30/1343551030.db2.gz JNCLSVRQOSNZMF-DWRORGKVSA-N 1 3 331.504 2.941 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@@H](C)c2ccc3c(c2)CCC3)C1 ZINC001376411064 1343565897 /nfs/dbraw/zinc/56/58/97/1343565897.db2.gz VXVBZQGBKQUBPO-YSSFQJQWSA-N 1 3 343.515 2.813 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@H](C)c2ccccc2Cl)C1 ZINC001376410541 1343566185 /nfs/dbraw/zinc/56/61/85/1343566185.db2.gz VOOREAUPQLENDR-RBSFLKMASA-N 1 3 337.895 2.978 10 0 EFAEHO CC[C@@H](c1ccccc1)[N@H+]1C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001376415645 1343569743 /nfs/dbraw/zinc/56/97/43/1343569743.db2.gz RQYBGHDJINBYIP-ZCNNSNEGSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@@H](c1ccccc1)[N@@H+]1C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001376415645 1343569745 /nfs/dbraw/zinc/56/97/45/1343569745.db2.gz RQYBGHDJINBYIP-ZCNNSNEGSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]C/C=C/c2ccc(Cl)cc2)C1)N(C)C ZINC001376470790 1343615332 /nfs/dbraw/zinc/61/53/32/1343615332.db2.gz VECXUUFQBJCEMO-FZYTWRFKSA-N 1 3 349.906 2.930 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C(C)C)cc2)C1)N(C)C ZINC001376487634 1343623140 /nfs/dbraw/zinc/62/31/40/1343623140.db2.gz IOJIJSJJGDUPII-OTWHNJEPSA-N 1 3 331.504 2.887 10 0 EFAEHO CC(C)[NH2+]CC1(c2ccccc2)CCN(C(=O)CN2CCCC2)CC1 ZINC001393768045 1357138741 /nfs/dbraw/zinc/13/87/41/1357138741.db2.gz XTVPUCWFTWAJHW-UHFFFAOYSA-N 1 3 343.515 2.641 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC[C@H]2CCCC2(F)F)C1)N(C)C ZINC001376491749 1343624254 /nfs/dbraw/zinc/62/42/54/1343624254.db2.gz RUPFRDZJFYOOHF-LVQVYYBASA-N 1 3 345.478 2.635 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(F)cc1 ZINC001376521396 1343646626 /nfs/dbraw/zinc/64/66/26/1343646626.db2.gz WRSKPELIWXUCMC-RTBURBONSA-N 1 3 347.478 2.733 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1CCC[C@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001376537305 1343663296 /nfs/dbraw/zinc/66/32/96/1343663296.db2.gz FVASSAFWSXKFLT-IAGOWNOFSA-N 1 3 325.541 2.839 10 0 EFAEHO CC[C@@H](C)C[N@H+]1CCC[C@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001376537305 1343663297 /nfs/dbraw/zinc/66/32/97/1343663297.db2.gz FVASSAFWSXKFLT-IAGOWNOFSA-N 1 3 325.541 2.839 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[NH2+]CC2CCC(C)CC2)C1 ZINC001376554790 1343672067 /nfs/dbraw/zinc/67/20/67/1343672067.db2.gz FPRUQGKGXYSJQW-ACBHZAAOSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+]C[C@@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001376618342 1343725944 /nfs/dbraw/zinc/72/59/44/1343725944.db2.gz RWHVITAPOZQXPU-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@H+](CCC(C)(C)C)C1 ZINC001376623629 1343730101 /nfs/dbraw/zinc/73/01/01/1343730101.db2.gz LJXLHCRJTVOXPP-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](CCC(C)(C)C)C1 ZINC001376623629 1343730104 /nfs/dbraw/zinc/73/01/04/1343730104.db2.gz LJXLHCRJTVOXPP-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001376627516 1343733705 /nfs/dbraw/zinc/73/37/05/1343733705.db2.gz QNYXKJCXZVXGEE-WMZOPIPTSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001376627516 1343733709 /nfs/dbraw/zinc/73/37/09/1343733709.db2.gz QNYXKJCXZVXGEE-WMZOPIPTSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](CCC(C)(C)C)C1 ZINC001376626130 1343733920 /nfs/dbraw/zinc/73/39/20/1343733920.db2.gz OVLMTRXOBZTHJF-GOEBONIOSA-N 1 3 334.508 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](CCC(C)(C)C)C1 ZINC001376626130 1343733923 /nfs/dbraw/zinc/73/39/23/1343733923.db2.gz OVLMTRXOBZTHJF-GOEBONIOSA-N 1 3 334.508 2.914 10 0 EFAEHO CCC(CC)C[N@@H+]1CCC[C@H]([C@@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001376629409 1343735923 /nfs/dbraw/zinc/73/59/23/1343735923.db2.gz SAMDNNWGYIRXRU-AEFFLSMTSA-N 1 3 325.541 2.980 10 0 EFAEHO CCC(CC)C[N@H+]1CCC[C@H]([C@@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001376629409 1343735926 /nfs/dbraw/zinc/73/59/26/1343735926.db2.gz SAMDNNWGYIRXRU-AEFFLSMTSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N[C@@H]1[C@H]2C[N@H+](CCCC(C)(C)C)C[C@H]21 ZINC001376659103 1343748443 /nfs/dbraw/zinc/74/84/43/1343748443.db2.gz ATSYNZHEGBZPOR-YTGMWSOZSA-N 1 3 335.536 2.732 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N[C@@H]1[C@H]2C[N@@H+](CCCC(C)(C)C)C[C@H]21 ZINC001376659103 1343748447 /nfs/dbraw/zinc/74/84/47/1343748447.db2.gz ATSYNZHEGBZPOR-YTGMWSOZSA-N 1 3 335.536 2.732 10 0 EFAEHO CC(C)[N@@H+]1CCc2c(CNC(=O)CN3[C@@H](C)CC[C@@H]3C)cccc2C1 ZINC001376673470 1343757024 /nfs/dbraw/zinc/75/70/24/1343757024.db2.gz NCWXXQGGWLGNPP-IRXDYDNUSA-N 1 3 343.515 2.942 10 0 EFAEHO CC(C)[N@H+]1CCc2c(CNC(=O)CN3[C@@H](C)CC[C@@H]3C)cccc2C1 ZINC001376673470 1343757025 /nfs/dbraw/zinc/75/70/25/1343757025.db2.gz NCWXXQGGWLGNPP-IRXDYDNUSA-N 1 3 343.515 2.942 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)NCc1cc(C)ccc1F ZINC001376731242 1343788561 /nfs/dbraw/zinc/78/85/61/1343788561.db2.gz NFQZLWODBDFICV-MAUKXSAKSA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)NCc1cc(C)ccc1F ZINC001376731242 1343788564 /nfs/dbraw/zinc/78/85/64/1343788564.db2.gz NFQZLWODBDFICV-MAUKXSAKSA-N 1 3 335.467 2.603 10 0 EFAEHO CC(C)(C(=O)NCC1(NCc2ccccc2F)CCC1)[NH+]1CCCC1 ZINC001376772244 1343823881 /nfs/dbraw/zinc/82/38/81/1343823881.db2.gz VOGQFZXIPPFRNG-UHFFFAOYSA-N 1 3 347.478 2.829 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)[NH+]1CCCC1)NCc1cc2ccccc2o1 ZINC001376784639 1343836547 /nfs/dbraw/zinc/83/65/47/1343836547.db2.gz OEXYJYVSVUFXJQ-HNNXBMFYSA-N 1 3 343.471 2.902 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]Cc2ccsc2)CCC1 ZINC001376814811 1343866451 /nfs/dbraw/zinc/86/64/51/1343866451.db2.gz BOGZLVADQZMMTN-HUUCEWRRSA-N 1 3 335.517 2.749 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)NCC1(NCc2ccsc2)CCC1 ZINC001376821544 1343872969 /nfs/dbraw/zinc/87/29/69/1343872969.db2.gz YJWWCKGZGDDABD-UHFFFAOYSA-N 1 3 335.517 2.753 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC[C@@H](NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001376909306 1343947752 /nfs/dbraw/zinc/94/77/52/1343947752.db2.gz GYENABWJYXFDTM-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CCC[N@H+]1CCC[C@@H](NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001376909306 1343947756 /nfs/dbraw/zinc/94/77/56/1343947756.db2.gz GYENABWJYXFDTM-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001376958346 1343988726 /nfs/dbraw/zinc/98/87/26/1343988726.db2.gz PXCMLEPVOCVFEY-ZWKOTPCHSA-N 1 3 331.504 2.834 10 0 EFAEHO CC(C)CCC[N@@H+](C)[C@@H]1CCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001376975357 1344005990 /nfs/dbraw/zinc/00/59/90/1344005990.db2.gz CGBNAXQTQQLCCM-MSOLQXFVSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)CCC[N@H+](C)[C@@H]1CCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001376975357 1344005989 /nfs/dbraw/zinc/00/59/89/1344005989.db2.gz CGBNAXQTQQLCCM-MSOLQXFVSA-N 1 3 325.541 2.932 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)[C@@H]1CCCC[N@@H+]1C(C)C ZINC001376990900 1344025871 /nfs/dbraw/zinc/02/58/71/1344025871.db2.gz HXWXMQCROSKYOL-SJORKVTESA-N 1 3 329.504 2.778 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)[C@@H]1CCCC[N@H+]1C(C)C ZINC001376990900 1344025875 /nfs/dbraw/zinc/02/58/75/1344025875.db2.gz HXWXMQCROSKYOL-SJORKVTESA-N 1 3 329.504 2.778 10 0 EFAEHO Cc1cccc([C@H](C)[N@H+](C)CCCN(C)C(=O)CN2CCCC2)c1 ZINC001377016553 1344063206 /nfs/dbraw/zinc/06/32/06/1344063206.db2.gz FHWSZEZUWRQRFE-SFHVURJKSA-N 1 3 331.504 2.932 10 0 EFAEHO Cc1cccc([C@H](C)[N@@H+](C)CCCN(C)C(=O)CN2CCCC2)c1 ZINC001377016553 1344063210 /nfs/dbraw/zinc/06/32/10/1344063210.db2.gz FHWSZEZUWRQRFE-SFHVURJKSA-N 1 3 331.504 2.932 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1sccc1Cl ZINC001377067524 1344112078 /nfs/dbraw/zinc/11/20/78/1344112078.db2.gz OLKWQOYMUMSKNX-OLZOCXBDSA-N 1 3 343.924 2.728 10 0 EFAEHO Cc1cccc(CN(CCNC(=O)C[NH+]2[C@@H](C)CC[C@@H]2C)C2CC2)c1 ZINC001377572869 1344182980 /nfs/dbraw/zinc/18/29/80/1344182980.db2.gz YUIVTWKGRPNXTB-ROUUACIJSA-N 1 3 343.515 2.948 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]CCN(C)C(=O)CN(C)C2CCC2)c1 ZINC001377572600 1344183572 /nfs/dbraw/zinc/18/35/72/1344183572.db2.gz HORDORGPGFYILY-QGZVFWFLSA-N 1 3 331.504 2.897 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]CCN(C)C(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001377589374 1344195818 /nfs/dbraw/zinc/19/58/18/1344195818.db2.gz KUWSYPOCJLXVRY-IEBWSBKVSA-N 1 3 333.520 2.999 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+][C@H](C)c1ccc(F)c(Cl)c1 ZINC001377605314 1344211653 /nfs/dbraw/zinc/21/16/53/1344211653.db2.gz VYCNEKQJLIBRSA-CYBMUJFWSA-N 1 3 343.874 2.928 10 0 EFAEHO CCC(CC)C[NH2+][C@H](C)C1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001377612032 1344220527 /nfs/dbraw/zinc/22/05/27/1344220527.db2.gz QRPPGLOZYBDZQK-MRXNPFEDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](F)C[NH2+][C@H](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001377619776 1344228612 /nfs/dbraw/zinc/22/86/12/1344228612.db2.gz XPPAVYUXLCIQBQ-WBVHZDCISA-N 1 3 343.531 2.929 10 0 EFAEHO CC(C)C[N@H+](C)C[C@@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001377664230 1344289758 /nfs/dbraw/zinc/28/97/58/1344289758.db2.gz RCERXZXPPWXSKL-LPHOPBHVSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)C[N@@H+](C)C[C@@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001377664230 1344289762 /nfs/dbraw/zinc/28/97/62/1344289762.db2.gz RCERXZXPPWXSKL-LPHOPBHVSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@H]([C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001377673911 1344302980 /nfs/dbraw/zinc/30/29/80/1344302980.db2.gz HQVXEKDQWBOGHI-ROUUACIJSA-N 1 3 346.519 2.949 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@H]([C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001377673911 1344302984 /nfs/dbraw/zinc/30/29/84/1344302984.db2.gz HQVXEKDQWBOGHI-ROUUACIJSA-N 1 3 346.519 2.949 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001377675717 1344305982 /nfs/dbraw/zinc/30/59/82/1344305982.db2.gz WTCFFQNNAYQRRF-AZUAARDMSA-N 1 3 343.515 2.939 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001377675717 1344305984 /nfs/dbraw/zinc/30/59/84/1344305984.db2.gz WTCFFQNNAYQRRF-AZUAARDMSA-N 1 3 343.515 2.939 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@H]1CC[N@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001377691082 1344328075 /nfs/dbraw/zinc/32/80/75/1344328075.db2.gz AAXQYINZUNSTMA-WMZOPIPTSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@H]1CC[N@@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001377691082 1344328079 /nfs/dbraw/zinc/32/80/79/1344328079.db2.gz AAXQYINZUNSTMA-WMZOPIPTSA-N 1 3 337.552 2.837 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2ccc(C)cc2C)C1)N(C)C ZINC001377701463 1344342765 /nfs/dbraw/zinc/34/27/65/1344342765.db2.gz QFQFQTAWCQIDIF-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2ccc(C)cc2C)C1)N(C)C ZINC001377701463 1344342769 /nfs/dbraw/zinc/34/27/69/1344342769.db2.gz QFQFQTAWCQIDIF-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@@H]1CC[N@H+](CCC(C)(C)C)C1)N(C)C ZINC001377705793 1344348928 /nfs/dbraw/zinc/34/89/28/1344348928.db2.gz HIVBJJVBSRGBGO-IAGOWNOFSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@@H]1CC[N@@H+](CCC(C)(C)C)C1)N(C)C ZINC001377705793 1344348935 /nfs/dbraw/zinc/34/89/35/1344348935.db2.gz HIVBJJVBSRGBGO-IAGOWNOFSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)c1cccc(C[NH2+]CC2CC(NC(=O)CN(C)C(C)C)C2)n1 ZINC001377733232 1344381365 /nfs/dbraw/zinc/38/13/65/1344381365.db2.gz JEUUQALOJLFTBZ-UHFFFAOYSA-N 1 3 346.519 2.530 10 0 EFAEHO Cc1cc(C[NH2+]CC2CC(NC(=O)[C@H](C(C)C)N(C)C)C2)cs1 ZINC001377736763 1344384975 /nfs/dbraw/zinc/38/49/75/1344384975.db2.gz RCDAVAGFEXGGQY-PREGVCBESA-N 1 3 337.533 2.627 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@H+](C)Cc2ccsc2)CC1 ZINC001377787450 1344439250 /nfs/dbraw/zinc/43/92/50/1344439250.db2.gz AWDAITZOXWVZCH-UHFFFAOYSA-N 1 3 337.533 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@@H+](C)Cc2ccsc2)CC1 ZINC001377787450 1344439258 /nfs/dbraw/zinc/43/92/58/1344439258.db2.gz AWDAITZOXWVZCH-UHFFFAOYSA-N 1 3 337.533 2.759 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccccc1)[C@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001377804365 1344455234 /nfs/dbraw/zinc/45/52/34/1344455234.db2.gz VHEQYYAGAKMJCM-SJORKVTESA-N 1 3 331.504 2.934 10 0 EFAEHO C[C@@H](NCc1ccccn1)[C@H](C)NC(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001377822223 1344476399 /nfs/dbraw/zinc/47/63/99/1344476399.db2.gz ZJQPKGCRCKHINX-CVEARBPZSA-N 1 3 346.519 2.717 10 0 EFAEHO C[C@@H](NCc1ccccn1)[C@H](C)NC(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001377822223 1344476402 /nfs/dbraw/zinc/47/64/02/1344476402.db2.gz ZJQPKGCRCKHINX-CVEARBPZSA-N 1 3 346.519 2.717 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H]1CCC[N@H+](CCC2CCCC2)C1 ZINC001377827818 1344485692 /nfs/dbraw/zinc/48/56/92/1344485692.db2.gz GZHLZOYVGXZTON-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H]1CCC[N@@H+](CCC2CCCC2)C1 ZINC001377827818 1344485695 /nfs/dbraw/zinc/48/56/95/1344485695.db2.gz GZHLZOYVGXZTON-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001377830663 1344487857 /nfs/dbraw/zinc/48/78/57/1344487857.db2.gz UCUGUYSIAQSSNB-GJZGRUSLSA-N 1 3 342.487 2.635 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)[C@@H](C)NC(=O)CCC[NH+](C)C ZINC001377836699 1344492709 /nfs/dbraw/zinc/49/27/09/1344492709.db2.gz FWJIUQOCBVVDTH-LSDHHAIUSA-N 1 3 339.911 2.973 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001377915716 1344579160 /nfs/dbraw/zinc/57/91/60/1344579160.db2.gz RPSZGEOURYQMSN-QWHCGFSZSA-N 1 3 343.874 2.802 10 0 EFAEHO CC[C@H](F)C[NH2+]CC(C)(C)CN(C)C(=O)[C@H]1CCCCN1CC ZINC001377980586 1344634387 /nfs/dbraw/zinc/63/43/87/1344634387.db2.gz WHNZSZUPSDEDOX-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1CN([C@@H](C)c2ccccc2)C1)[NH+]1CCCC1 ZINC001378020191 1344671290 /nfs/dbraw/zinc/67/12/90/1344671290.db2.gz JNNFQDZOLUCSTR-PXNSSMCTSA-N 1 3 343.515 2.916 10 0 EFAEHO Cc1cccc(CN(C)[C@H](C)CNC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001378066046 1344720164 /nfs/dbraw/zinc/72/01/64/1344720164.db2.gz DSZCMNRCUUKQKI-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1cccc(CN(C)[C@H](C)CNC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001378066046 1344720168 /nfs/dbraw/zinc/72/01/68/1344720168.db2.gz DSZCMNRCUUKQKI-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1cccc(CN(C)[C@H](C)CNC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001378066048 1344720295 /nfs/dbraw/zinc/72/02/95/1344720295.db2.gz DSZCMNRCUUKQKI-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1cccc(CN(C)[C@H](C)CNC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001378066048 1344720299 /nfs/dbraw/zinc/72/02/99/1344720299.db2.gz DSZCMNRCUUKQKI-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[N@H+](C)Cc1ccccc1C1CC1 ZINC001378150029 1344814005 /nfs/dbraw/zinc/81/40/05/1344814005.db2.gz WORXLARMXFTLFU-SJORKVTESA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[N@@H+](C)Cc1ccccc1C1CC1 ZINC001378150029 1344814008 /nfs/dbraw/zinc/81/40/08/1344814008.db2.gz WORXLARMXFTLFU-SJORKVTESA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC001378236432 1344919614 /nfs/dbraw/zinc/91/96/14/1344919614.db2.gz RGISKWKMAYTIRB-KDOFPFPSSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC001378236432 1344919618 /nfs/dbraw/zinc/91/96/18/1344919618.db2.gz RGISKWKMAYTIRB-KDOFPFPSSA-N 1 3 335.467 2.590 10 0 EFAEHO CC[C@H](C(=O)NC1(C[NH2+]Cc2cc(C)ccc2F)CCCC1)N(C)C ZINC001378352815 1345006843 /nfs/dbraw/zinc/00/68/43/1345006843.db2.gz MLJPLPXRFJHMCD-GOSISDBHSA-N 1 3 349.494 2.993 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C[NH2+]Cc2ccsc2)CCCCC1 ZINC001378414835 1345057422 /nfs/dbraw/zinc/05/74/22/1345057422.db2.gz GAUMMUVAJLYCRG-UHFFFAOYSA-N 1 3 337.533 2.997 10 0 EFAEHO C[C@@H](NC[C@@](C)(NC(=O)CC[NH+](C)C)C1CC1)c1ccccc1F ZINC001378416429 1345059214 /nfs/dbraw/zinc/05/92/14/1345059214.db2.gz TYHLQZNXCUNRMQ-AUUYWEPGSA-N 1 3 335.467 2.713 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H]1CC[C@H]([NH2+]C[C@@H](F)CC)CC1 ZINC001378435971 1345074178 /nfs/dbraw/zinc/07/41/78/1345074178.db2.gz BMHVQDUNYFJFLH-LUKYLMHMSA-N 1 3 327.488 2.626 10 0 EFAEHO C[C@@H]1CCCC[C@@]1(CNCc1ccccc1F)NC(=O)CC[NH+](C)C ZINC001378441410 1345079396 /nfs/dbraw/zinc/07/93/96/1345079396.db2.gz YSNMNVGJUZQXDS-UZLBHIALSA-N 1 3 349.494 2.932 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC2CC[NH+](CC3CC(C)(C)C3)CC2)C1 ZINC001378484391 1345116389 /nfs/dbraw/zinc/11/63/89/1345116389.db2.gz OPBSVXGDTNLVPO-QGZVFWFLSA-N 1 3 349.563 2.983 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]Cc1ccccc1C1CC1 ZINC001378525033 1345140413 /nfs/dbraw/zinc/14/04/13/1345140413.db2.gz WTUORYLQCOEAQH-LJQANCHMSA-N 1 3 343.515 2.985 10 0 EFAEHO Cc1cccc(CN2CC([C@@H](C)NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001378529355 1345143112 /nfs/dbraw/zinc/14/31/12/1345143112.db2.gz LJXTXPIPYKYPPS-XLIONFOSSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1cccc(CN2CC([C@@H](C)NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001378529355 1345143114 /nfs/dbraw/zinc/14/31/14/1345143114.db2.gz LJXTXPIPYKYPPS-XLIONFOSSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1cccc(CN2CC([C@H](C)NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001378529354 1345143306 /nfs/dbraw/zinc/14/33/06/1345143306.db2.gz LJXTXPIPYKYPPS-PXNSSMCTSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1cccc(CN2CC([C@H](C)NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001378529354 1345143310 /nfs/dbraw/zinc/14/33/10/1345143310.db2.gz LJXTXPIPYKYPPS-PXNSSMCTSA-N 1 3 343.515 2.806 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCCCC[N@@H+]1CCCF)N1CCCC1 ZINC001378529913 1345143732 /nfs/dbraw/zinc/14/37/32/1345143732.db2.gz QPGATSUSDNWDFD-INIZCTEOSA-N 1 3 327.488 2.581 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCCCC[N@H+]1CCCF)N1CCCC1 ZINC001378529913 1345143733 /nfs/dbraw/zinc/14/37/33/1345143733.db2.gz QPGATSUSDNWDFD-INIZCTEOSA-N 1 3 327.488 2.581 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+]Cc1c(F)cccc1Cl ZINC001378645043 1345220541 /nfs/dbraw/zinc/22/05/41/1345220541.db2.gz UWIFYYSDFAEXQB-CYBMUJFWSA-N 1 3 343.874 2.661 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+]CC[C@@H](C)F)CCCC1 ZINC001378735573 1345283455 /nfs/dbraw/zinc/28/34/55/1345283455.db2.gz LURBVCQWVFLVGM-CVEARBPZSA-N 1 3 327.488 2.628 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@H](C)c3cccc(C)c3)C[C@H]21 ZINC001378749262 1345291601 /nfs/dbraw/zinc/29/16/01/1345291601.db2.gz ITQKYSMLTRRAIT-AFYVEPGGSA-N 1 3 343.515 2.692 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@H](C)c3cccc(C)c3)C[C@H]21 ZINC001378749262 1345291604 /nfs/dbraw/zinc/29/16/04/1345291604.db2.gz ITQKYSMLTRRAIT-AFYVEPGGSA-N 1 3 343.515 2.692 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001378786726 1345316165 /nfs/dbraw/zinc/31/61/65/1345316165.db2.gz QGPNPVWJMFQWRG-OTWHNJEPSA-N 1 3 337.552 2.980 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001378786726 1345316172 /nfs/dbraw/zinc/31/61/72/1345316172.db2.gz QGPNPVWJMFQWRG-OTWHNJEPSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@@H](CNCc1sccc1Cl)N(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001378840002 1345353462 /nfs/dbraw/zinc/35/34/62/1345353462.db2.gz GSXBEFDJDSPYDC-STQMWFEESA-N 1 3 343.924 2.680 10 0 EFAEHO C[C@@H](CNCc1sccc1Cl)N(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001378840002 1345353469 /nfs/dbraw/zinc/35/34/69/1345353469.db2.gz GSXBEFDJDSPYDC-STQMWFEESA-N 1 3 343.924 2.680 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001378835865 1345350305 /nfs/dbraw/zinc/35/03/05/1345350305.db2.gz XVEMYDZDKRXRKY-HIRUMQFNSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001378835865 1345350308 /nfs/dbraw/zinc/35/03/08/1345350308.db2.gz XVEMYDZDKRXRKY-HIRUMQFNSA-N 1 3 348.318 2.664 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)cc1 ZINC001378842846 1345355795 /nfs/dbraw/zinc/35/57/95/1345355795.db2.gz HEBCLBBDGPHZPJ-FHWLQOOXSA-N 1 3 331.504 2.566 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001378847391 1345359833 /nfs/dbraw/zinc/35/98/33/1345359833.db2.gz VETQYMKXERWGOW-UKRRQHHQSA-N 1 3 333.467 2.589 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2ccccc2C)C1)N(C)C ZINC001378865600 1345375525 /nfs/dbraw/zinc/37/55/25/1345375525.db2.gz GTYAXWOGUOUBTJ-YWTNHNAXSA-N 1 3 331.504 2.881 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]Cc1ccsc1)NC(=O)C1(N(C)C)CCC1 ZINC001378872411 1345381704 /nfs/dbraw/zinc/38/17/04/1345381704.db2.gz GWCVKDFFPMKFJB-INIZCTEOSA-N 1 3 337.533 2.853 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)N[C@H]1C[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001378890269 1345400464 /nfs/dbraw/zinc/40/04/64/1345400464.db2.gz HMWIHHYJZHEFAU-DLNYNCLCSA-N 1 3 348.318 2.663 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001378899773 1345409142 /nfs/dbraw/zinc/40/91/42/1345409142.db2.gz PKDYQTMXTCFZET-YLJYHZDGSA-N 1 3 345.531 2.916 10 0 EFAEHO CCC(CC)C[NH2+]C[C@H]1[C@H](C)CCCN1C(=O)CN(C)C(C)C ZINC001378929601 1345435459 /nfs/dbraw/zinc/43/54/59/1345435459.db2.gz UUTAISFNFVWHHJ-AEFFLSMTSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C[NH2+]Cc1cc(C)ccc1C)C1CC1)N(C)C ZINC001379017788 1345499448 /nfs/dbraw/zinc/49/94/48/1345499448.db2.gz HIHNWYGIYAOCLV-UXHICEINSA-N 1 3 345.531 2.970 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)[C@H](C[NH2+]CC2CCCCC2)C2CC2)C1 ZINC001379032019 1345513756 /nfs/dbraw/zinc/51/37/56/1345513756.db2.gz OMYLFRCROMXSKA-QFBILLFUSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2C[NH+]3CCC2CC3)cc1C ZINC001379039773 1345523002 /nfs/dbraw/zinc/52/30/02/1345523002.db2.gz ISJFBTCOXMRXMP-FQEVSTJZSA-N 1 3 343.515 2.535 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H](C[NH2+]Cc1ccsc1)C1CC1)N(C)C ZINC001379064273 1345544671 /nfs/dbraw/zinc/54/46/71/1345544671.db2.gz XCLVQAQLJYGKGO-DLBZAZTESA-N 1 3 337.533 2.661 10 0 EFAEHO CN(CC[N@H+](C)CC[C@@H]1CCCC1(F)F)C(=O)CN(C)C1CCC1 ZINC001379067654 1345547805 /nfs/dbraw/zinc/54/78/05/1345547805.db2.gz TYORFCCALFDJNV-HNNXBMFYSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CC[N@@H+](C)CC[C@@H]1CCCC1(F)F)C(=O)CN(C)C1CCC1 ZINC001379067654 1345547807 /nfs/dbraw/zinc/54/78/07/1345547807.db2.gz TYORFCCALFDJNV-HNNXBMFYSA-N 1 3 345.478 2.686 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[N@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001393884115 1357250734 /nfs/dbraw/zinc/25/07/34/1357250734.db2.gz PWDNUTXIDWEBLY-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001393884115 1357250739 /nfs/dbraw/zinc/25/07/39/1357250739.db2.gz PWDNUTXIDWEBLY-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001379128066 1345606757 /nfs/dbraw/zinc/60/67/57/1345606757.db2.gz SSXCKMMYLVXQTM-HZPDHXFCSA-N 1 3 335.467 2.619 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001379128066 1345606762 /nfs/dbraw/zinc/60/67/62/1345606762.db2.gz SSXCKMMYLVXQTM-HZPDHXFCSA-N 1 3 335.467 2.619 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N(C)C[C@H](C)NCc2ccsc2)CC1 ZINC001379261647 1345685495 /nfs/dbraw/zinc/68/54/95/1345685495.db2.gz DSKHDQOCZKFEAE-HNNXBMFYSA-N 1 3 337.533 2.805 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@H](C)[NH2+]Cc1cc2ccccc2o1)N(C)C ZINC001379264916 1345687209 /nfs/dbraw/zinc/68/72/09/1345687209.db2.gz ZQCWDSYPSRBKQC-WMLDXEAASA-N 1 3 331.460 2.710 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]CCc1ccccc1 ZINC001379331318 1345733361 /nfs/dbraw/zinc/73/33/61/1345733361.db2.gz QBKHRDUFCVXVSC-PKOBYXMFSA-N 1 3 331.504 2.540 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]CCc1ccccc1 ZINC001379331317 1345733528 /nfs/dbraw/zinc/73/35/28/1345733528.db2.gz QBKHRDUFCVXVSC-MJGOQNOKSA-N 1 3 331.504 2.540 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CNCc2ccc(Cl)s2)CC[N@@H+]1C ZINC001379360807 1345747927 /nfs/dbraw/zinc/74/79/27/1345747927.db2.gz VILPQMYOOGUCBW-KWCYVHTRSA-N 1 3 343.924 2.726 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CNCc2ccc(Cl)s2)CC[N@H+]1C ZINC001379360807 1345747933 /nfs/dbraw/zinc/74/79/33/1345747933.db2.gz VILPQMYOOGUCBW-KWCYVHTRSA-N 1 3 343.924 2.726 10 0 EFAEHO C[C@H](CN[C@@H](C)c1ccccc1F)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001379413399 1345770659 /nfs/dbraw/zinc/77/06/59/1345770659.db2.gz REZLUKUTSDCWRJ-CABCVRRESA-N 1 3 335.467 2.855 10 0 EFAEHO C[C@H](CN[C@@H](C)c1cccc(Cl)c1F)NC(=O)CC[NH+](C)C ZINC001379419669 1345775740 /nfs/dbraw/zinc/77/57/40/1345775740.db2.gz PBYPXELCJDTDSN-NEPJUHHUSA-N 1 3 329.847 2.586 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)CN[C@H](C)c1cccc(Cl)c1F ZINC001379445541 1345787985 /nfs/dbraw/zinc/78/79/85/1345787985.db2.gz IAPFELWYGLFMAS-CHWSQXEVSA-N 1 3 343.874 2.976 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)CN[C@H](C)c1cccc(Cl)c1F ZINC001379445541 1345787990 /nfs/dbraw/zinc/78/79/90/1345787990.db2.gz IAPFELWYGLFMAS-CHWSQXEVSA-N 1 3 343.874 2.976 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C ZINC001379446507 1345788584 /nfs/dbraw/zinc/78/85/84/1345788584.db2.gz CMRWKGNYOWKHIC-BEFAXECRSA-N 1 3 331.504 2.745 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+][C@H]1CCc2c1cccc2Cl)N(C)C ZINC001379523901 1345827206 /nfs/dbraw/zinc/82/72/06/1345827206.db2.gz XOIFZYUVQXVKPJ-AFAVFJNCSA-N 1 3 337.895 2.762 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccccc1C1CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001379555129 1345856295 /nfs/dbraw/zinc/85/62/95/1345856295.db2.gz YISHIIPYANIXPE-HOTGVXAUSA-N 1 3 329.488 2.500 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2ccccc2C2CC2)C[C@H]1C ZINC001379584057 1345890082 /nfs/dbraw/zinc/89/00/82/1345890082.db2.gz IBCGWJZKOBSJCD-VQIMIIECSA-N 1 3 343.515 2.983 10 0 EFAEHO CCc1ccccc1C[NH2+]CC1CC(NC(=O)CN(C)C2CCC2)C1 ZINC001393899248 1357269161 /nfs/dbraw/zinc/26/91/61/1357269161.db2.gz NOOXTUWCOXHQQL-UHFFFAOYSA-N 1 3 343.515 2.718 10 0 EFAEHO Cc1cccc(C[NH2+]CC2CC(NC(=O)CN(C)CC(C)(C)C)C2)c1 ZINC001393901160 1357270623 /nfs/dbraw/zinc/27/06/23/1357270623.db2.gz KVGQYAASWLGDKF-UHFFFAOYSA-N 1 3 345.531 2.957 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]Cc2cc(C)ccc2C)C1)N(C)C ZINC001393906589 1357275021 /nfs/dbraw/zinc/27/50/21/1357275021.db2.gz IXXVHFBVZSXEKP-KVZIAJEVSA-N 1 3 331.504 2.628 10 0 EFAEHO C[C@@H](NCc1cc2ccccc2o1)[C@H](C)NC(=O)CCC[NH+](C)C ZINC001393960821 1357326833 /nfs/dbraw/zinc/32/68/33/1357326833.db2.gz GPUREFVIYZHPGY-CABCVRRESA-N 1 3 331.460 2.757 10 0 EFAEHO COc1cccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)c1 ZINC001393962330 1357328158 /nfs/dbraw/zinc/32/81/58/1357328158.db2.gz RXLVPUJPBFPJKO-HZPDHXFCSA-N 1 3 347.503 2.552 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H](C)[C@@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001393966953 1357332877 /nfs/dbraw/zinc/33/28/77/1357332877.db2.gz WSOBMNULCRQDHN-HZPDHXFCSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1cc(CN2CCC[C@H](NC(=O)CC[NH+](C)C)[C@H]2C)c(C)s1 ZINC001379670978 1347246650 /nfs/dbraw/zinc/24/66/50/1347246650.db2.gz VBHDQLQBOOUNIX-PBHICJAKSA-N 1 3 337.533 2.786 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)Cc1ccc(Cl)cc1C)N(C)C ZINC001379697377 1347266143 /nfs/dbraw/zinc/26/61/43/1347266143.db2.gz OAGVSZPSJAQTSF-WMLDXEAASA-N 1 3 339.911 2.925 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc(Cl)cc1C)N(C)C ZINC001379697377 1347266146 /nfs/dbraw/zinc/26/61/46/1347266146.db2.gz OAGVSZPSJAQTSF-WMLDXEAASA-N 1 3 339.911 2.925 10 0 EFAEHO CCc1cccc(C[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001379745324 1347301644 /nfs/dbraw/zinc/30/16/44/1347301644.db2.gz QIYXYRGQFYTDGY-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(C[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001379745324 1347301650 /nfs/dbraw/zinc/30/16/50/1347301650.db2.gz QIYXYRGQFYTDGY-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@H](CN(C)[C@@H](C)c1cccc(Cl)c1)NC(=O)CC[NH+](C)C ZINC001379744852 1347301969 /nfs/dbraw/zinc/30/19/69/1347301969.db2.gz SDOARJWMUUGRIO-KGLIPLIRSA-N 1 3 325.884 2.789 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)[C@H]1CCCc2ccccc21 ZINC001379792783 1347343197 /nfs/dbraw/zinc/34/31/97/1347343197.db2.gz BQRUKKZOHOZDFV-LPHOPBHVSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC001379792783 1347343201 /nfs/dbraw/zinc/34/32/01/1347343201.db2.gz BQRUKKZOHOZDFV-LPHOPBHVSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CN(C)Cc1cccc(F)c1)[NH+]1CCCC1 ZINC001379799491 1347347659 /nfs/dbraw/zinc/34/76/59/1347347659.db2.gz OYGSXZDUNHTPGU-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)[C@@H](C)NCc1cccc(Cl)c1F ZINC001393984902 1357352144 /nfs/dbraw/zinc/35/21/44/1357352144.db2.gz FMZHPNUXACNCDC-OLZOCXBDSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)[C@@H](C)NCc1cccc(Cl)c1F ZINC001393984902 1357352148 /nfs/dbraw/zinc/35/21/48/1357352148.db2.gz FMZHPNUXACNCDC-OLZOCXBDSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C[NH2+]CC1CCCC1)C(C)(C)C)N(C)C ZINC001380083496 1347507921 /nfs/dbraw/zinc/50/79/21/1347507921.db2.gz CBCZBWYGJBJFQJ-DLBZAZTESA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C1CC[NH+](Cc2ccccc2)CC1)N(C)C ZINC001380132084 1347525991 /nfs/dbraw/zinc/52/59/91/1347525991.db2.gz WKDJQSKGBVJVAH-YLJYHZDGSA-N 1 3 345.531 2.990 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1(NCc2ccc(Cl)c(Cl)c2)CC1 ZINC001380131849 1347526169 /nfs/dbraw/zinc/52/61/69/1347526169.db2.gz AUXUMXBJAFLSAP-UHFFFAOYSA-N 1 3 344.286 2.684 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C1CC[NH+](CCC(C)(C)C)CC1 ZINC001380131888 1347526184 /nfs/dbraw/zinc/52/61/84/1347526184.db2.gz VZEXZHPTJKZMAP-CQSZACIVSA-N 1 3 334.508 2.914 10 0 EFAEHO C[C@@H](NC1(CNC(=O)C23CC[NH+](CC2)C3)CC1)c1ccc(Cl)cc1 ZINC001380156546 1347539427 /nfs/dbraw/zinc/53/94/27/1347539427.db2.gz DIRJTIRTAFXFKP-CQSZACIVSA-N 1 3 347.890 2.735 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C2(CNC(=O)[C@@H](C(C)C)N(C)C)CC2)c1 ZINC001380159562 1347540180 /nfs/dbraw/zinc/54/01/80/1347540180.db2.gz KKMDSLAGKWPESY-MAUKXSAKSA-N 1 3 347.503 2.581 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+]C[C@@H]2CCCC(F)(F)C2)CC1)N(C)C ZINC001380160193 1347540893 /nfs/dbraw/zinc/54/08/93/1347540893.db2.gz RBWVCJONRADEME-HUUCEWRRSA-N 1 3 345.478 2.637 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CCF)C2CCCCCC2)CC[N@@H+]1C ZINC001380177352 1347551182 /nfs/dbraw/zinc/55/11/82/1347551182.db2.gz GPZUTBZFYZXAAY-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CCF)C2CCCCCC2)CC[N@H+]1C ZINC001380177352 1347551185 /nfs/dbraw/zinc/55/11/85/1347551185.db2.gz GPZUTBZFYZXAAY-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001380179865 1347552951 /nfs/dbraw/zinc/55/29/51/1347552951.db2.gz GKVMVHPOYHMOQD-SFHVURJKSA-N 1 3 346.519 2.949 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001380179865 1347552953 /nfs/dbraw/zinc/55/29/53/1347552953.db2.gz GKVMVHPOYHMOQD-SFHVURJKSA-N 1 3 346.519 2.949 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)[C@@H](C)C1 ZINC001380272193 1347563677 /nfs/dbraw/zinc/56/36/77/1347563677.db2.gz SUEWBUHDSKIDDU-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO COc1cccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)c1 ZINC001380272118 1347563844 /nfs/dbraw/zinc/56/38/44/1347563844.db2.gz SKHCHRXPGZPRPO-WMZOPIPTSA-N 1 3 347.503 2.505 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)cc1F ZINC001380275341 1347564780 /nfs/dbraw/zinc/56/47/80/1347564780.db2.gz XNYMEMMIEDTRAL-FUHWJXTLSA-N 1 3 349.494 2.943 10 0 EFAEHO C[C@@H](NC[C@@H]1CCCN1C(=O)CC[NH+](C)C)c1ccccc1Cl ZINC001380290108 1347571188 /nfs/dbraw/zinc/57/11/88/1347571188.db2.gz MOSSEUMVZHPANU-CABCVRRESA-N 1 3 337.895 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC001380293149 1347572453 /nfs/dbraw/zinc/57/24/53/1347572453.db2.gz WJZORXRMMUQOFI-IEBWSBKVSA-N 1 3 347.478 2.734 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C(C)C ZINC001393994721 1357365095 /nfs/dbraw/zinc/36/50/95/1357365095.db2.gz HENBCMMSBKIJMG-HZPDHXFCSA-N 1 3 348.535 2.836 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]CC3CC(C)(C)C3)C2)C1 ZINC001380427083 1347664597 /nfs/dbraw/zinc/66/45/97/1347664597.db2.gz XTOKOSGHEPFFBX-UZLBHIALSA-N 1 3 335.536 2.593 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]CC3CC(C)(C)C3)C2)C1 ZINC001380427079 1347664625 /nfs/dbraw/zinc/66/46/25/1347664625.db2.gz XTOKOSGHEPFFBX-JXFKEZNVSA-N 1 3 335.536 2.593 10 0 EFAEHO CCN1CCC(F)(F)[C@@H](CNC(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001380517413 1347736932 /nfs/dbraw/zinc/73/69/32/1347736932.db2.gz LLMDMXCRGVTISX-AWEZNQCLSA-N 1 3 345.478 2.733 10 0 EFAEHO CCN1CCC(F)(F)[C@@H](CNC(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001380517413 1347736935 /nfs/dbraw/zinc/73/69/35/1347736935.db2.gz LLMDMXCRGVTISX-AWEZNQCLSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCC1CCCC1)C2 ZINC001380660002 1347795964 /nfs/dbraw/zinc/79/59/64/1347795964.db2.gz PFOAFTSJJMOJJW-OTWHNJEPSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCC1CCCC1)C2 ZINC001380660002 1347795966 /nfs/dbraw/zinc/79/59/66/1347795966.db2.gz PFOAFTSJJMOJJW-OTWHNJEPSA-N 1 3 335.536 2.876 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CCCCC1)C2 ZINC001380663089 1347798229 /nfs/dbraw/zinc/79/82/29/1347798229.db2.gz ZPSBADMKBPANHO-FHWLQOOXSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CC1CCCCC1)C2 ZINC001380663089 1347798231 /nfs/dbraw/zinc/79/82/31/1347798231.db2.gz ZPSBADMKBPANHO-FHWLQOOXSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001380676372 1347805731 /nfs/dbraw/zinc/80/57/31/1347805731.db2.gz KVSDFBRNXOUOOR-AZUAARDMSA-N 1 3 345.531 2.970 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001380683763 1347811047 /nfs/dbraw/zinc/81/10/47/1347811047.db2.gz VHWCAHGPKRGOMV-HKUYNNGSSA-N 1 3 331.504 2.662 10 0 EFAEHO CC[C@H](C)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@H](C)C1)C2 ZINC001380686168 1347813628 /nfs/dbraw/zinc/81/36/28/1347813628.db2.gz YJPGGQDVIWWSEQ-FKSLSLAPSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](C)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@H](C)C1)C2 ZINC001380686168 1347813630 /nfs/dbraw/zinc/81/36/30/1347813630.db2.gz YJPGGQDVIWWSEQ-FKSLSLAPSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](C(=O)NCc1ccccc1C[N@H+](C)CC1CCC1)N(C)C ZINC001380782916 1347875080 /nfs/dbraw/zinc/87/50/80/1347875080.db2.gz YGSVBWKEFYJTNH-LJQANCHMSA-N 1 3 331.504 2.875 10 0 EFAEHO CC[C@H](C(=O)NCc1ccccc1C[N@@H+](C)CC1CCC1)N(C)C ZINC001380782916 1347875085 /nfs/dbraw/zinc/87/50/85/1347875085.db2.gz YGSVBWKEFYJTNH-LJQANCHMSA-N 1 3 331.504 2.875 10 0 EFAEHO CC[C@@H](F)CN[C@@H](C)c1ccc(CNC(=O)C23CC[NH+](CC2)C3)cc1 ZINC001380786113 1347877302 /nfs/dbraw/zinc/87/73/02/1347877302.db2.gz YJUGZEQCIIVLSS-MAUKXSAKSA-N 1 3 347.478 2.797 10 0 EFAEHO CC[C@H](F)CN[C@@H](C)c1ccc(CNC(=O)C23CC[NH+](CC2)C3)cc1 ZINC001380786117 1347877566 /nfs/dbraw/zinc/87/75/66/1347877566.db2.gz YJUGZEQCIIVLSS-YJBOKZPZSA-N 1 3 347.478 2.797 10 0 EFAEHO C[C@H](F)CC[NH2+]C1(CNC(=O)C(C)(C)N2CCCCC2)CCC1 ZINC001380856465 1347917453 /nfs/dbraw/zinc/91/74/53/1347917453.db2.gz JRINHFJINIRLEZ-HNNXBMFYSA-N 1 3 327.488 2.628 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CCC1 ZINC001380882394 1347934981 /nfs/dbraw/zinc/93/49/81/1347934981.db2.gz SDSXDUVDBKCNEZ-RDTXWAMCSA-N 1 3 345.478 2.576 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1CCC(N(C)C(=O)C2(N(C)C)CCC2)CC1 ZINC001394007910 1357380731 /nfs/dbraw/zinc/38/07/31/1357380731.db2.gz LASTUJIWQLDONN-QQFBHYJXSA-N 1 3 327.488 2.578 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](Cc2csc(C)c2)CC1)N(C)C ZINC001380928712 1347960799 /nfs/dbraw/zinc/96/07/99/1347960799.db2.gz GWVGHSCEIZOVGK-IAGOWNOFSA-N 1 3 337.533 2.867 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2csc(C)c2)CC1)N(C)C ZINC001380928712 1347960803 /nfs/dbraw/zinc/96/08/03/1347960803.db2.gz GWVGHSCEIZOVGK-IAGOWNOFSA-N 1 3 337.533 2.867 10 0 EFAEHO CC[C@H](C)C[N@@H+]1CCC[C@@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001380934335 1347966730 /nfs/dbraw/zinc/96/67/30/1347966730.db2.gz OXGBSBJIWRWPJS-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C)C[N@H+]1CCC[C@@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001380934335 1347966732 /nfs/dbraw/zinc/96/67/32/1347966732.db2.gz OXGBSBJIWRWPJS-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](Cc2ccc(F)cc2)CC1)N(C)C ZINC001380940996 1347972698 /nfs/dbraw/zinc/97/26/98/1347972698.db2.gz UJTSVYVSWAUGLZ-ZWKOTPCHSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](Cc2ccc(F)cc2)CC1)N(C)C ZINC001380940996 1347972701 /nfs/dbraw/zinc/97/27/01/1347972701.db2.gz UJTSVYVSWAUGLZ-ZWKOTPCHSA-N 1 3 335.467 2.637 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@H]1CCC[N@@H+]1C)CCC(F)(F)F ZINC001380959251 1347985559 /nfs/dbraw/zinc/98/55/59/1347985559.db2.gz VJRRTULXMJRTLV-CQSZACIVSA-N 1 3 337.430 2.594 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@H]1CCC[N@H+]1C)CCC(F)(F)F ZINC001380959251 1347985562 /nfs/dbraw/zinc/98/55/62/1347985562.db2.gz VJRRTULXMJRTLV-CQSZACIVSA-N 1 3 337.430 2.594 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)N2CCC(C)(NC/C(Cl)=C/Cl)CC2)C1 ZINC001381127862 1348095925 /nfs/dbraw/zinc/09/59/25/1348095925.db2.gz HLTWHNRQJXKKBM-ODUNQGDFSA-N 1 3 348.318 2.618 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)N2CCC(C)(NC/C(Cl)=C/Cl)CC2)C1 ZINC001381127862 1348095929 /nfs/dbraw/zinc/09/59/29/1348095929.db2.gz HLTWHNRQJXKKBM-ODUNQGDFSA-N 1 3 348.318 2.618 10 0 EFAEHO Cc1cc(CN2CC[C@H](NC(=O)CC[NH+](C)C)C(C)(C)C2)cs1 ZINC001381131225 1348098058 /nfs/dbraw/zinc/09/80/58/1348098058.db2.gz CVTIICOOXVHKBI-INIZCTEOSA-N 1 3 337.533 2.725 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](NC(=O)CCC[NH+](C)C)C[C@@H]2C)c(C)n1 ZINC001381169424 1348117767 /nfs/dbraw/zinc/11/77/67/1348117767.db2.gz HKARFNGSHCDBAZ-QFBILLFUSA-N 1 3 346.519 2.509 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]CCc1ccc(C)cc1 ZINC001381238042 1348159605 /nfs/dbraw/zinc/15/96/05/1348159605.db2.gz JCAHREUYFUOFBX-ICSRJNTNSA-N 1 3 345.531 2.896 10 0 EFAEHO CC[C@@H](C)C[N@H+](CC)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001381252866 1348165274 /nfs/dbraw/zinc/16/52/74/1348165274.db2.gz AEOUEIUPRPBADJ-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C)C[N@@H+](CC)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001381252866 1348165277 /nfs/dbraw/zinc/16/52/77/1348165277.db2.gz AEOUEIUPRPBADJ-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[N@H+](C)CCc1ccccc1F)N(C)C ZINC001381296433 1348195708 /nfs/dbraw/zinc/19/57/08/1348195708.db2.gz XUYBBKYPYIPUFD-IEBWSBKVSA-N 1 3 349.494 2.631 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[N@@H+](C)CCc1ccccc1F)N(C)C ZINC001381296433 1348195710 /nfs/dbraw/zinc/19/57/10/1348195710.db2.gz XUYBBKYPYIPUFD-IEBWSBKVSA-N 1 3 349.494 2.631 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC2CC(NC(=O)CN(C)C3CCC3)C2)c1 ZINC001381324502 1348211334 /nfs/dbraw/zinc/21/13/34/1348211334.db2.gz WJQPCUVXVBKKMS-UHFFFAOYSA-N 1 3 343.515 2.772 10 0 EFAEHO CCc1ccc(C[NH2+]CC2CC(NC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001381336755 1348214475 /nfs/dbraw/zinc/21/44/75/1348214475.db2.gz BWNYJFHTPKVUAT-CTWPCTMYSA-N 1 3 331.504 2.574 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]CC2CC(NC(=O)CN(C)C(C)C)C2)c1 ZINC001381343901 1348217366 /nfs/dbraw/zinc/21/73/66/1348217366.db2.gz VFLZSHSUMUMVSU-MUYFXNHWSA-N 1 3 331.504 2.881 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCCC1)[C@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001381369113 1348227892 /nfs/dbraw/zinc/22/78/92/1348227892.db2.gz FCMXNCAWTUMWGK-KBPBESRZSA-N 1 3 345.478 2.779 10 0 EFAEHO C[C@@H]([NH2+]CC1CCC(F)(F)CC1)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001381380845 1348233389 /nfs/dbraw/zinc/23/33/89/1348233389.db2.gz CCIKDPUCLLRIHU-KGLIPLIRSA-N 1 3 345.478 2.779 10 0 EFAEHO C[C@H](NCc1cc2ccccc2o1)[C@H](C)NC(=O)C1CC[NH+](C)CC1 ZINC001381427265 1348265645 /nfs/dbraw/zinc/26/56/45/1348265645.db2.gz ZKNDOPNVFHDNNM-GJZGRUSLSA-N 1 3 343.471 2.757 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]CCc1ccc(Cl)cc1 ZINC001381440928 1348276804 /nfs/dbraw/zinc/27/68/04/1348276804.db2.gz CIBVDRMVSIKDMZ-HUUCEWRRSA-N 1 3 339.911 2.706 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C(C)C ZINC001381459037 1348289674 /nfs/dbraw/zinc/28/96/74/1348289674.db2.gz WZEJSLOHDYBJPY-LSDHHAIUSA-N 1 3 339.911 2.971 10 0 EFAEHO CC[C@@H](C)C[NH2+]CC(C)(C)CN(C)C(=O)[C@@H]1CCCCN1CC ZINC001381484175 1348304203 /nfs/dbraw/zinc/30/42/03/1348304203.db2.gz HLUAFBBRGHNKEV-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC(C)(C)C[NH2+]CC1CC2(CCC2)C1 ZINC001381486912 1348305365 /nfs/dbraw/zinc/30/53/65/1348305365.db2.gz ZVNODCVTCMMOHM-UHFFFAOYSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H](C)[N@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001381529671 1348333141 /nfs/dbraw/zinc/33/31/41/1348333141.db2.gz IVSDEWADQYYDOS-AEFFLSMTSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H](C)[N@@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001381529671 1348333145 /nfs/dbraw/zinc/33/31/45/1348333145.db2.gz IVSDEWADQYYDOS-AEFFLSMTSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@H+](C)Cc1ccc2ncccc2c1)N(C)C ZINC001381530890 1348333987 /nfs/dbraw/zinc/33/39/87/1348333987.db2.gz IGKYAVCRBIFSME-HNAYVOBHSA-N 1 3 342.487 2.512 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@@H+](C)Cc1ccc2ncccc2c1)N(C)C ZINC001381530890 1348333991 /nfs/dbraw/zinc/33/39/91/1348333991.db2.gz IGKYAVCRBIFSME-HNAYVOBHSA-N 1 3 342.487 2.512 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[N@H+](C)Cc1ccc(C)cc1 ZINC001381535646 1348337536 /nfs/dbraw/zinc/33/75/36/1348337536.db2.gz SYYKJUZPKPXADG-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc(C)cc1 ZINC001381535646 1348337539 /nfs/dbraw/zinc/33/75/39/1348337539.db2.gz SYYKJUZPKPXADG-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001381562695 1348360259 /nfs/dbraw/zinc/36/02/59/1348360259.db2.gz XNPJMGVZKHABHE-QGZVFWFLSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001381562695 1348360261 /nfs/dbraw/zinc/36/02/61/1348360261.db2.gz XNPJMGVZKHABHE-QGZVFWFLSA-N 1 3 331.504 2.806 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC[C@H](C)N(C)Cc2ccc(F)cc2)C1 ZINC001381570696 1348366960 /nfs/dbraw/zinc/36/69/60/1348366960.db2.gz HKEXVCOGARXMOO-FUHWJXTLSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC[C@H](C)N(C)Cc2ccc(F)cc2)C1 ZINC001381570696 1348366964 /nfs/dbraw/zinc/36/69/64/1348366964.db2.gz HKEXVCOGARXMOO-FUHWJXTLSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC[C@@H](C)N(C)Cc2ccc(F)cc2)C1 ZINC001381570704 1348367221 /nfs/dbraw/zinc/36/72/21/1348367221.db2.gz HKEXVCOGARXMOO-SJLPKXTDSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC[C@@H](C)N(C)Cc2ccc(F)cc2)C1 ZINC001381570704 1348367225 /nfs/dbraw/zinc/36/72/25/1348367225.db2.gz HKEXVCOGARXMOO-SJLPKXTDSA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+](C)[C@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001381582743 1348377718 /nfs/dbraw/zinc/37/77/18/1348377718.db2.gz MLTYIUHHEAIZCL-MAUKXSAKSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cccc(C)c1C[N@H+](C)[C@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001381582743 1348377721 /nfs/dbraw/zinc/37/77/21/1348377721.db2.gz MLTYIUHHEAIZCL-MAUKXSAKSA-N 1 3 331.504 2.582 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)CCc1ccccc1Cl ZINC001381641415 1348425682 /nfs/dbraw/zinc/42/56/82/1348425682.db2.gz FNRAOGNTAKIURP-OAHLLOKOSA-N 1 3 339.911 2.659 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)CCc1ccccc1Cl ZINC001381641415 1348425684 /nfs/dbraw/zinc/42/56/84/1348425684.db2.gz FNRAOGNTAKIURP-OAHLLOKOSA-N 1 3 339.911 2.659 10 0 EFAEHO CCCC[C@H](C[NH2+]CC1CC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001381745899 1348495409 /nfs/dbraw/zinc/49/54/09/1348495409.db2.gz IZQKHXCDVKKBIK-VQIMIIECSA-N 1 3 341.515 2.874 10 0 EFAEHO CCCC[C@@H](C[NH2+]CC1CC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001381745895 1348495468 /nfs/dbraw/zinc/49/54/68/1348495468.db2.gz IZQKHXCDVKKBIK-QFBILLFUSA-N 1 3 341.515 2.874 10 0 EFAEHO C[NH+](C)CC1(C(=O)NC[C@@H]2CCCCCN2Cc2ccsc2)CC1 ZINC001381755085 1348503025 /nfs/dbraw/zinc/50/30/25/1348503025.db2.gz BXHAMVZDQGJDQS-KRWDZBQOSA-N 1 3 349.544 2.951 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)cc1F ZINC001381960116 1348626603 /nfs/dbraw/zinc/62/66/03/1348626603.db2.gz BMWGICDLVOVNQC-LNLFQRSKSA-N 1 3 349.494 2.705 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(F)cc2)C1)CC(C)(C)C ZINC001381969444 1348630566 /nfs/dbraw/zinc/63/05/66/1348630566.db2.gz VANXCZGOPDRGTR-SAABIXHNSA-N 1 3 349.494 2.788 10 0 EFAEHO CN(C/C=C/Cl)C1CCN(C(=O)C(C)(C)[NH+]2CCCC2)CC1 ZINC001381980611 1348636436 /nfs/dbraw/zinc/63/64/36/1348636436.db2.gz FBSQZDJYOUAJGG-RMKNXTFCSA-N 1 3 327.900 2.536 10 0 EFAEHO CN(C/C=C/Cl)C1CCN(C(=O)C23CCC[NH+](CCC2)C3)CC1 ZINC001381981403 1348637673 /nfs/dbraw/zinc/63/76/73/1348637673.db2.gz NSFQWLPQRMPAAP-RUDMXATFSA-N 1 3 339.911 2.538 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@@H]1CCCN1C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001382053284 1348686901 /nfs/dbraw/zinc/68/69/01/1348686901.db2.gz BZFVEUZQYOUVBD-LRDDRELGSA-N 1 3 341.858 2.510 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)NCc1ccc(Cl)s1 ZINC001382068015 1348696582 /nfs/dbraw/zinc/69/65/82/1348696582.db2.gz MINJSODBCYJVOB-YRGRVCCFSA-N 1 3 343.924 2.678 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)NCc1ccc(Cl)s1 ZINC001382068015 1348696584 /nfs/dbraw/zinc/69/65/84/1348696584.db2.gz MINJSODBCYJVOB-YRGRVCCFSA-N 1 3 343.924 2.678 10 0 EFAEHO C[C@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]CC[C@H]1CCCC1(F)F ZINC001382088332 1348709973 /nfs/dbraw/zinc/70/99/73/1348709973.db2.gz GOHQAZFXDPRTCP-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C[C@@H](C)NCc1ccccc1F ZINC001382089348 1348710981 /nfs/dbraw/zinc/71/09/81/1348710981.db2.gz YTIHTSQSWQSHKF-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N(C)C[C@@H](C)NCc1ccccc1F ZINC001382089348 1348710985 /nfs/dbraw/zinc/71/09/85/1348710985.db2.gz YTIHTSQSWQSHKF-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001382165838 1348787777 /nfs/dbraw/zinc/78/77/77/1348787777.db2.gz MUBYDTCAQBXDJM-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@H](NCc2cc(C)ccc2F)[C@H]1C ZINC001382300718 1348854354 /nfs/dbraw/zinc/85/43/54/1348854354.db2.gz DAWDUFNAQNYIFC-QAPCUYQASA-N 1 3 335.467 2.555 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@H](NCc2cc(C)ccc2F)[C@H]1C ZINC001382300718 1348854363 /nfs/dbraw/zinc/85/43/63/1348854363.db2.gz DAWDUFNAQNYIFC-QAPCUYQASA-N 1 3 335.467 2.555 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(Cl)cc2)[C@H]1C ZINC001382301166 1348855054 /nfs/dbraw/zinc/85/50/54/1348855054.db2.gz CXWLWWFYPIYSTF-RHSMWYFYSA-N 1 3 337.895 2.759 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)[C@@H](C)CNC(=O)[C@@H]1CCCN1C(C)C ZINC001394061194 1357430267 /nfs/dbraw/zinc/43/02/67/1357430267.db2.gz VRGXXPHSJXBUCP-HKUYNNGSSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccccc1C[N@H+](C)[C@@H](C)CNC(=O)[C@@H]1CCCN1C(C)C ZINC001394061194 1357430271 /nfs/dbraw/zinc/43/02/71/1357430271.db2.gz VRGXXPHSJXBUCP-HKUYNNGSSA-N 1 3 331.504 2.804 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+]Cc2ccsc2)C(C)(C)C)CCC1 ZINC001382516062 1348983383 /nfs/dbraw/zinc/98/33/83/1348983383.db2.gz GJUDDGBIKKXULY-OAHLLOKOSA-N 1 3 337.533 2.853 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@@H](CNCc1ccccn1)C(C)(C)C ZINC001382538960 1349005347 /nfs/dbraw/zinc/00/53/47/1349005347.db2.gz YEPQPDQZYKPJCX-MSOLQXFVSA-N 1 3 346.519 2.577 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@@H](CNCc1ccccn1)C(C)(C)C ZINC001382538960 1349005352 /nfs/dbraw/zinc/00/53/52/1349005352.db2.gz YEPQPDQZYKPJCX-MSOLQXFVSA-N 1 3 346.519 2.577 10 0 EFAEHO CC[C@H](F)CN1CCC([C@@H](C)NC(=O)CCC[NH+]2CCCC2)CC1 ZINC001382551507 1349012602 /nfs/dbraw/zinc/01/26/02/1349012602.db2.gz MISYNGUNBUJVCI-AEFFLSMTSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C1CCN(C/C=C\Cl)CC1)[NH+](C)C ZINC001382558619 1349018647 /nfs/dbraw/zinc/01/86/47/1349018647.db2.gz DXJKBDXQOBFABC-ZJIBPLLGSA-N 1 3 329.916 2.542 10 0 EFAEHO CC[C@@H](F)CN1CCC([C@@H](C)NC(=O)[C@@H](C(C)C)[NH+](C)C)CC1 ZINC001382557988 1349018799 /nfs/dbraw/zinc/01/87/99/1349018799.db2.gz GIUDRQFDPAPCAE-DJIMGWMZSA-N 1 3 329.504 2.537 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C)C1)C1CC[NH+](CC2CCCC2)CC1 ZINC001382561454 1349021420 /nfs/dbraw/zinc/02/14/20/1349021420.db2.gz RQXXULNDTBUTOX-SJORKVTESA-N 1 3 335.536 2.735 10 0 EFAEHO CCCN(C)CC(=O)NC1(C2CC[NH+](CCC(F)(F)F)CC2)CC1 ZINC001382590097 1349037714 /nfs/dbraw/zinc/03/77/14/1349037714.db2.gz PVQNRMHEWGBZHQ-UHFFFAOYSA-N 1 3 349.441 2.641 10 0 EFAEHO CC[NH2+][C@H](CCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001394188128 1357568477 /nfs/dbraw/zinc/56/84/77/1357568477.db2.gz MQARBBKKGZLVHM-CRAIPNDOSA-N 1 3 329.504 2.682 10 0 EFAEHO CC[NH2+][C@@H](CCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001394188149 1357568681 /nfs/dbraw/zinc/56/86/81/1357568681.db2.gz MQARBBKKGZLVHM-YJBOKZPZSA-N 1 3 329.504 2.682 10 0 EFAEHO CCCC[C@H](CNCc1ccccc1F)NC(=O)C12CC[NH+](CC1)C2 ZINC001394202044 1357585582 /nfs/dbraw/zinc/58/55/82/1357585582.db2.gz IBRUWYYWDGCJJY-QGZVFWFLSA-N 1 3 347.478 2.686 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](Cc2cc(C)ccc2C)C1)N(C)C ZINC001394226209 1357617294 /nfs/dbraw/zinc/61/72/94/1357617294.db2.gz KJGZHZCSDACTSE-QFBILLFUSA-N 1 3 331.504 2.580 10 0 EFAEHO C[C@H](NC(=O)CCC[NH+](C)C)C1CN(Cc2ccc(C3CC3)cc2)C1 ZINC001394247727 1357634790 /nfs/dbraw/zinc/63/47/90/1357634790.db2.gz IUHQFFMNKVDYBL-INIZCTEOSA-N 1 3 343.515 2.842 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001388704058 1352934301 /nfs/dbraw/zinc/93/43/01/1352934301.db2.gz QPCPYSYBDOFZIA-NUJGCVRESA-N 1 3 347.503 2.581 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H]1C[C@@H](CNC(=O)CN2[C@@H](C)CC[C@@H]2C)C1 ZINC001388704124 1352934350 /nfs/dbraw/zinc/93/43/50/1352934350.db2.gz RKJTVQGUZHCWRY-CGBFIWBNSA-N 1 3 343.515 2.852 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1C[C@H](NCc2ccccc2F)C1 ZINC001388722205 1352950897 /nfs/dbraw/zinc/95/08/97/1352950897.db2.gz TVZJENQJDDURCS-KBAYOESNSA-N 1 3 347.478 2.685 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1C[C@H](NCc2ccccc2F)C1 ZINC001388722205 1352950902 /nfs/dbraw/zinc/95/09/02/1352950902.db2.gz TVZJENQJDDURCS-KBAYOESNSA-N 1 3 347.478 2.685 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H]1C[N@@H+](C(C)C)C[C@H]1c1ccccc1 ZINC001388745271 1352971836 /nfs/dbraw/zinc/97/18/36/1352971836.db2.gz FLRCOMCHOHTHOP-IPMKNSEASA-N 1 3 349.494 2.659 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H]1C[N@H+](C(C)C)C[C@H]1c1ccccc1 ZINC001388745271 1352971837 /nfs/dbraw/zinc/97/18/37/1352971837.db2.gz FLRCOMCHOHTHOP-IPMKNSEASA-N 1 3 349.494 2.659 10 0 EFAEHO CC(C)c1cccc(C[NH2+][C@H]2C[C@H](CNC(=O)CN(C)C(C)C)C2)n1 ZINC001388750457 1352976918 /nfs/dbraw/zinc/97/69/18/1352976918.db2.gz ZQMKLOXNKKBHJB-SAABIXHNSA-N 1 3 346.519 2.530 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CCC[NH+](C)C)CCN1Cc1ccc2cc[nH]c2c1 ZINC001388784605 1353011637 /nfs/dbraw/zinc/01/16/37/1353011637.db2.gz LWJTVRPAYLTJQK-QAPCUYQASA-N 1 3 342.487 2.589 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@@H]2C1 ZINC001388790208 1353020067 /nfs/dbraw/zinc/02/00/67/1353020067.db2.gz QQPLHTARDCCXKH-MSOLQXFVSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@@H]2C1 ZINC001388790208 1353020071 /nfs/dbraw/zinc/02/00/71/1353020071.db2.gz QQPLHTARDCCXKH-MSOLQXFVSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)Cc1ccc(CN2CC[C@H](NC(=O)CC[NH+](C)C)[C@H]2C)cc1 ZINC001388819039 1353050898 /nfs/dbraw/zinc/05/08/98/1353050898.db2.gz XYKSJHTWMIZWSD-XLIONFOSSA-N 1 3 345.531 2.916 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@H+](Cc2cccnc2)CC(C)(C)C1)N(C)C ZINC001388834739 1353072691 /nfs/dbraw/zinc/07/26/91/1353072691.db2.gz GFJDHUZSROUXCF-MSOLQXFVSA-N 1 3 346.519 2.529 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@@H+](Cc2cccnc2)CC(C)(C)C1)N(C)C ZINC001388834739 1353072696 /nfs/dbraw/zinc/07/26/96/1353072696.db2.gz GFJDHUZSROUXCF-MSOLQXFVSA-N 1 3 346.519 2.529 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CN(Cc2ccc(C3CC3)cc2)CC1(C)C ZINC001394288828 1357674903 /nfs/dbraw/zinc/67/49/03/1357674903.db2.gz RKUMJQBDVPRIGZ-IBGZPJMESA-N 1 3 343.515 2.842 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1CN(Cc2ccc(CF)cc2)CC1(C)C ZINC001394292206 1357678091 /nfs/dbraw/zinc/67/80/91/1357678091.db2.gz WUMJTONHJDZGKS-SFHVURJKSA-N 1 3 349.494 2.825 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@H](C)[NH2+]Cc1ccsc1 ZINC001389326441 1353304931 /nfs/dbraw/zinc/30/49/31/1353304931.db2.gz SIWYJSBYDRRGBO-RDJZCZTQSA-N 1 3 337.533 2.948 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCCN(Cc2ccc(C3CCC3)cc2)C1 ZINC001389394600 1353362725 /nfs/dbraw/zinc/36/27/25/1353362725.db2.gz VAXLVEMIFOUZDJ-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO Cc1ccc(C[NH+]2CCC3(C[C@H]3NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001389525945 1353453468 /nfs/dbraw/zinc/45/34/68/1353453468.db2.gz IHLLZITXRYMZQE-LJQANCHMSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](CNC(=O)[C@H]1CCCN1C(C)C)C1CC1 ZINC001389612360 1353510372 /nfs/dbraw/zinc/51/03/72/1353510372.db2.gz PSRDUXCTTUKUJH-WOJBJXKFSA-N 1 3 343.515 2.852 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001389615459 1353512452 /nfs/dbraw/zinc/51/24/52/1353512452.db2.gz WUXHPGWXAKAGBB-MOPGFXCFSA-N 1 3 347.547 2.926 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](CNC(=O)C(C)(C)N1CCCC1)C1CC1 ZINC001389640184 1353526569 /nfs/dbraw/zinc/52/65/69/1353526569.db2.gz CGGFYALLUPIJDA-LJQANCHMSA-N 1 3 343.515 2.854 10 0 EFAEHO CCC(CC)C[N@H+](C)C[C@H]1CCCN(C(=O)[C@@H](CC)N(C)C)C1 ZINC001389767496 1353609946 /nfs/dbraw/zinc/60/99/46/1353609946.db2.gz WCNJJEPJNZPESC-QZTJIDSGSA-N 1 3 325.541 2.933 10 0 EFAEHO CCC(CC)C[N@@H+](C)C[C@H]1CCCN(C(=O)[C@@H](CC)N(C)C)C1 ZINC001389767496 1353609949 /nfs/dbraw/zinc/60/99/49/1353609949.db2.gz WCNJJEPJNZPESC-QZTJIDSGSA-N 1 3 325.541 2.933 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H]([NH2+]C/C=C/c2ccc(Cl)cc2)C1 ZINC001389780698 1353616904 /nfs/dbraw/zinc/61/69/04/1353616904.db2.gz NROMFTGSBHCOOA-BTBBHFPPSA-N 1 3 347.890 2.638 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(F)cc1)N(C)C ZINC001389942583 1353702033 /nfs/dbraw/zinc/70/20/33/1353702033.db2.gz SOKYPRAPGGFANC-IPQPSQTFSA-N 1 3 347.478 2.778 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(F)cc1)N(C)C ZINC001389942583 1353702036 /nfs/dbraw/zinc/70/20/36/1353702036.db2.gz SOKYPRAPGGFANC-IPQPSQTFSA-N 1 3 347.478 2.778 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@H+](CC3CCCC3)CC[C@@H]21 ZINC001389946971 1353704770 /nfs/dbraw/zinc/70/47/70/1353704770.db2.gz FXQODFXDYHTRPU-OALUTQOASA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@@H+](CC3CCCC3)CC[C@@H]21 ZINC001389946971 1353704773 /nfs/dbraw/zinc/70/47/73/1353704773.db2.gz FXQODFXDYHTRPU-OALUTQOASA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H](NCc2ccccc2F)C1)[NH+](CC)CC ZINC001389988222 1353727155 /nfs/dbraw/zinc/72/71/55/1353727155.db2.gz MCGFQHDUERICAS-JZXOWHBKSA-N 1 3 335.467 2.683 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](N[C@H](C)c2ccc(F)cc2F)C1 ZINC001390001838 1353734751 /nfs/dbraw/zinc/73/47/51/1353734751.db2.gz FJPOVLVSNSDUJR-YUELXQCFSA-N 1 3 339.430 2.604 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](N[C@H](C)c2ccc(F)cc2F)C1 ZINC001390001838 1353734754 /nfs/dbraw/zinc/73/47/54/1353734754.db2.gz FJPOVLVSNSDUJR-YUELXQCFSA-N 1 3 339.430 2.604 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H]1C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001390013333 1353743059 /nfs/dbraw/zinc/74/30/59/1353743059.db2.gz UGJMHWIAPVZIPS-SCTDSRPQSA-N 1 3 331.504 2.626 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CCC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001390055760 1353771441 /nfs/dbraw/zinc/77/14/41/1353771441.db2.gz GNXMELYSXACQPM-SFHVURJKSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccccc1C[N@H+]1CCC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001390055760 1353771443 /nfs/dbraw/zinc/77/14/43/1353771443.db2.gz GNXMELYSXACQPM-SFHVURJKSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@@](F)(C(=O)NC[C@H]2CCCCN2CCCF)C1 ZINC001390138315 1353849731 /nfs/dbraw/zinc/84/97/31/1353849731.db2.gz IEUOTQBJMBBFHK-QAPCUYQASA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)NC[C@H]2CCCCN2CCCF)C1 ZINC001390138315 1353849734 /nfs/dbraw/zinc/84/97/34/1353849734.db2.gz IEUOTQBJMBBFHK-QAPCUYQASA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001390154365 1353867773 /nfs/dbraw/zinc/86/77/73/1353867773.db2.gz IKBJCZFBRQGDNW-HOTGVXAUSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)cc1F ZINC001394727571 1358053044 /nfs/dbraw/zinc/05/30/44/1358053044.db2.gz VAQBBMRVNUKLSD-GOSISDBHSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)NCc1cc2ccccc2o1 ZINC001390406602 1354067719 /nfs/dbraw/zinc/06/77/19/1354067719.db2.gz USFSULUDISTMSB-DOTOQJQBSA-N 1 3 343.471 2.902 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)NCc1cc2ccccc2o1 ZINC001390406602 1354067723 /nfs/dbraw/zinc/06/77/23/1354067723.db2.gz USFSULUDISTMSB-DOTOQJQBSA-N 1 3 343.471 2.902 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)[N@H+](C)C1CCCC1)NCc1ccsc1 ZINC001390409795 1354070746 /nfs/dbraw/zinc/07/07/46/1354070746.db2.gz OOTASHWKJWKOKK-CQSZACIVSA-N 1 3 337.533 2.995 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)[N@@H+](C)C1CCCC1)NCc1ccsc1 ZINC001390409795 1354070749 /nfs/dbraw/zinc/07/07/49/1354070749.db2.gz OOTASHWKJWKOKK-CQSZACIVSA-N 1 3 337.533 2.995 10 0 EFAEHO Cc1ccc(CN[C@@H](C)CNC(=O)C23CCC[NH+]2CCC3)c(Cl)c1 ZINC001390438991 1354080855 /nfs/dbraw/zinc/08/08/55/1354080855.db2.gz NGAZIVUCOQGDMC-HNNXBMFYSA-N 1 3 349.906 2.871 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@H](C)CNC(=O)C(C)(C)N2CCCC2)c1 ZINC001390460095 1354095644 /nfs/dbraw/zinc/09/56/44/1354095644.db2.gz MUPZTOHBVLLPRZ-CVEARBPZSA-N 1 3 347.503 2.725 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@H](C)CNC(=O)C(C)(C)N2CCCC2)c1 ZINC001390460097 1354096176 /nfs/dbraw/zinc/09/61/76/1354096176.db2.gz MUPZTOHBVLLPRZ-HZPDHXFCSA-N 1 3 347.503 2.725 10 0 EFAEHO COc1cccc(C[NH2+][C@H]2CCC[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001390613733 1354208908 /nfs/dbraw/zinc/20/89/08/1354208908.db2.gz TVLYJRUBRLTACU-ROUUACIJSA-N 1 3 347.503 2.552 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCC[C@H]([N@H+](C)CCCF)C1 ZINC001390632226 1354230792 /nfs/dbraw/zinc/23/07/92/1354230792.db2.gz KAHGPCFNEJKXEI-DLBZAZTESA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCC[C@H]([N@@H+](C)CCCF)C1 ZINC001390632226 1354230797 /nfs/dbraw/zinc/23/07/97/1354230797.db2.gz KAHGPCFNEJKXEI-DLBZAZTESA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001390718753 1354311210 /nfs/dbraw/zinc/31/12/10/1354311210.db2.gz ZFJSVIIIWTZUQF-PKOBYXMFSA-N 1 3 333.520 2.936 10 0 EFAEHO C[C@H](c1ccc(Cl)cc1)N(C)CCNC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001390754052 1354342464 /nfs/dbraw/zinc/34/24/64/1354342464.db2.gz FPYYRJVEVMEFTO-KDOFPFPSSA-N 1 3 349.906 2.791 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@@H]2CCc3ccc(F)cc32)CC[N@@H+]1C ZINC001390765546 1354352848 /nfs/dbraw/zinc/35/28/48/1354352848.db2.gz LOEALSYVLAEVHX-QXAKKESOSA-N 1 3 347.478 2.591 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@@H]2CCc3ccc(F)cc32)CC[N@H+]1C ZINC001390765546 1354352852 /nfs/dbraw/zinc/35/28/52/1354352852.db2.gz LOEALSYVLAEVHX-QXAKKESOSA-N 1 3 347.478 2.591 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@@H+]1C)[C@@H]1CCc2c1cccc2F ZINC001390770690 1354358706 /nfs/dbraw/zinc/35/87/06/1354358706.db2.gz HPXORPKJJSJGAX-HNAYVOBHSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@H+]1C)[C@@H]1CCc2c1cccc2F ZINC001390770690 1354358712 /nfs/dbraw/zinc/35/87/12/1354358712.db2.gz HPXORPKJJSJGAX-HNAYVOBHSA-N 1 3 347.478 2.735 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)c1 ZINC001390777833 1354364515 /nfs/dbraw/zinc/36/45/15/1354364515.db2.gz GSSAFBWYBGFWNV-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)c1 ZINC001390777833 1354364521 /nfs/dbraw/zinc/36/45/21/1354364521.db2.gz GSSAFBWYBGFWNV-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)N(C)CCNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001390846605 1354430685 /nfs/dbraw/zinc/43/06/85/1354430685.db2.gz RLSVNYYHSCTDQC-GJZGRUSLSA-N 1 3 337.895 2.791 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)N(C)CCNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001390846605 1354430691 /nfs/dbraw/zinc/43/06/91/1354430691.db2.gz RLSVNYYHSCTDQC-GJZGRUSLSA-N 1 3 337.895 2.791 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001390859079 1354441741 /nfs/dbraw/zinc/44/17/41/1354441741.db2.gz AQOQYWGWZUKREE-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001390859079 1354441744 /nfs/dbraw/zinc/44/17/44/1354441744.db2.gz AQOQYWGWZUKREE-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001390859074 1354441978 /nfs/dbraw/zinc/44/19/78/1354441978.db2.gz AQOQYWGWZUKREE-CVEARBPZSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001390859074 1354441981 /nfs/dbraw/zinc/44/19/81/1354441981.db2.gz AQOQYWGWZUKREE-CVEARBPZSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[N@H+](CCNC(=O)C1(N(C)C)CCC1)[C@@H](C)c1cccc(OC)c1 ZINC001390906514 1354502370 /nfs/dbraw/zinc/50/23/70/1354502370.db2.gz ILJDVSMDCCIJBD-INIZCTEOSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[N@@H+](CCNC(=O)C1(N(C)C)CCC1)[C@@H](C)c1cccc(OC)c1 ZINC001390906514 1354502372 /nfs/dbraw/zinc/50/23/72/1354502372.db2.gz ILJDVSMDCCIJBD-INIZCTEOSA-N 1 3 347.503 2.679 10 0 EFAEHO CCN(CCNC(=O)CC[NH+](C)C)Cc1ccc(C(F)(F)F)cc1 ZINC001390963651 1354594579 /nfs/dbraw/zinc/59/45/79/1354594579.db2.gz QYNHBSXHUSABST-UHFFFAOYSA-N 1 3 345.409 2.595 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CCC[C@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001391053579 1354739937 /nfs/dbraw/zinc/73/99/37/1354739937.db2.gz GZPUAXQSJNMINU-IBGZPJMESA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccccc1C[N@H+]1CCC[C@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001391053579 1354739939 /nfs/dbraw/zinc/73/99/39/1354739939.db2.gz GZPUAXQSJNMINU-IBGZPJMESA-N 1 3 343.515 2.950 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@@H+]1CC1CCCC1)N1CCCC1 ZINC001391070266 1354761788 /nfs/dbraw/zinc/76/17/88/1354761788.db2.gz VGZOJEJAHGWJKE-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@H+]1CC1CCCC1)N1CCCC1 ZINC001391070266 1354761791 /nfs/dbraw/zinc/76/17/91/1354761791.db2.gz VGZOJEJAHGWJKE-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@@H+]1CC1CCCC1)N1CCCC1 ZINC001391070283 1354762398 /nfs/dbraw/zinc/76/23/98/1354762398.db2.gz VGZOJEJAHGWJKE-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@H+]1CC1CCCC1)N1CCCC1 ZINC001391070283 1354762399 /nfs/dbraw/zinc/76/23/99/1354762399.db2.gz VGZOJEJAHGWJKE-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCN(Cc2ccc(F)cc2)C1 ZINC001391108267 1354804554 /nfs/dbraw/zinc/80/45/54/1354804554.db2.gz WEIZXZWBCQNADO-HKUYNNGSSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCN(Cc2ccc(F)cc2)C1 ZINC001391108267 1354804557 /nfs/dbraw/zinc/80/45/57/1354804557.db2.gz WEIZXZWBCQNADO-HKUYNNGSSA-N 1 3 347.478 2.638 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@H+](CC[C@H](C)F)CC(C)(C)C1 ZINC001397819034 1360171186 /nfs/dbraw/zinc/17/11/86/1360171186.db2.gz URTOLWYUNUPSSD-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@@H+](CC[C@H](C)F)CC(C)(C)C1 ZINC001397819034 1360171187 /nfs/dbraw/zinc/17/11/87/1360171187.db2.gz URTOLWYUNUPSSD-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)c1ccc(CN(CCNC(=O)[C@@H]2CC[N@H+](C)C2)C2CC2)cc1 ZINC001391197978 1354925798 /nfs/dbraw/zinc/92/57/98/1354925798.db2.gz PJTNNOLSCAJRTN-LJQANCHMSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)c1ccc(CN(CCNC(=O)[C@@H]2CC[N@@H+](C)C2)C2CC2)cc1 ZINC001391197978 1354925803 /nfs/dbraw/zinc/92/58/03/1354925803.db2.gz PJTNNOLSCAJRTN-LJQANCHMSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)c1ccc(CN(CCNC(=O)[C@H]2CC[N@H+](C)C2)C2CC2)cc1 ZINC001391197977 1354926066 /nfs/dbraw/zinc/92/60/66/1354926066.db2.gz PJTNNOLSCAJRTN-IBGZPJMESA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)c1ccc(CN(CCNC(=O)[C@H]2CC[N@@H+](C)C2)C2CC2)cc1 ZINC001391197977 1354926072 /nfs/dbraw/zinc/92/60/72/1354926072.db2.gz PJTNNOLSCAJRTN-IBGZPJMESA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1cccc(C)c1CN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)C1CC1 ZINC001391203039 1354930752 /nfs/dbraw/zinc/93/07/52/1354930752.db2.gz VWRHNLPYJINXQE-GOSISDBHSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1cccc(C)c1CN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)C1CC1 ZINC001391203039 1354930755 /nfs/dbraw/zinc/93/07/55/1354930755.db2.gz VWRHNLPYJINXQE-GOSISDBHSA-N 1 3 343.515 2.726 10 0 EFAEHO C[C@H]([NH2+]CCc1cccs1)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001391230347 1354951811 /nfs/dbraw/zinc/95/18/11/1354951811.db2.gz DUHXPHIHBIBMKB-YJBOKZPZSA-N 1 3 349.544 2.602 10 0 EFAEHO CC(C)CC[NH2+][C@H](C)C1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001391235404 1354958110 /nfs/dbraw/zinc/95/81/10/1354958110.db2.gz DQNSOPOXKRXLMU-SJLPKXTDSA-N 1 3 325.541 2.835 10 0 EFAEHO C[C@H]([NH2+]CCC(C)(C)C)C1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001391235393 1354958124 /nfs/dbraw/zinc/95/81/24/1354958124.db2.gz DKJWOXUDBRWJGL-IRXDYDNUSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](C/C=C\c2ccccc2)C1)N(C)C ZINC001391297944 1355038196 /nfs/dbraw/zinc/03/81/96/1355038196.db2.gz KQTCJFVVOZMWMS-WLTZFMEZSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](C/C=C\c2ccccc2)C1)N(C)C ZINC001391297944 1355038200 /nfs/dbraw/zinc/03/82/00/1355038200.db2.gz KQTCJFVVOZMWMS-WLTZFMEZSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(F)c(C[N@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001391342076 1355097934 /nfs/dbraw/zinc/09/79/34/1355097934.db2.gz ZABSBWZVBMJNAB-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(F)c(C[N@@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001391342076 1355097940 /nfs/dbraw/zinc/09/79/40/1355097940.db2.gz ZABSBWZVBMJNAB-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCCN(Cc2ccccc2C2CC2)C1 ZINC001391401823 1355172892 /nfs/dbraw/zinc/17/28/92/1355172892.db2.gz RMKRKVRBMSTGFG-SFHVURJKSA-N 1 3 329.488 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[NH2+]Cc1ccc(F)cc1 ZINC001398762400 1360770455 /nfs/dbraw/zinc/77/04/55/1360770455.db2.gz CBYPWKDQQAEBQD-SFHVURJKSA-N 1 3 335.467 2.637 10 0 EFAEHO Cc1ccc(C)c(CN2CC(CNC(=O)C[NH+]3[C@@H](C)CC[C@@H]3C)C2)c1 ZINC001391523061 1355273633 /nfs/dbraw/zinc/27/36/33/1355273633.db2.gz IMNWIUBNAZONKU-ROUUACIJSA-N 1 3 343.515 2.724 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)NCC1CN(CCCc2ccsc2)C1 ZINC001391528455 1355278693 /nfs/dbraw/zinc/27/86/93/1355278693.db2.gz ZAHADCGPSVPTJZ-HOTGVXAUSA-N 1 3 349.544 2.602 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001391552836 1355300088 /nfs/dbraw/zinc/30/00/88/1355300088.db2.gz KAYNDQZIWGCCEW-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001391552836 1355300090 /nfs/dbraw/zinc/30/00/90/1355300090.db2.gz KAYNDQZIWGCCEW-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CCN(CCCc2ccsc2)C1 ZINC001391554389 1355301447 /nfs/dbraw/zinc/30/14/47/1355301447.db2.gz XMTUMPRTDYOROB-ZWKOTPCHSA-N 1 3 349.544 2.746 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CCN(CCCc2ccsc2)C1 ZINC001391554389 1355301453 /nfs/dbraw/zinc/30/14/53/1355301453.db2.gz XMTUMPRTDYOROB-ZWKOTPCHSA-N 1 3 349.544 2.746 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCC[N@@H+]1C(C)C)NCc1cc(C)ccc1F ZINC001391696565 1355442601 /nfs/dbraw/zinc/44/26/01/1355442601.db2.gz SXMVLULDWFEHNJ-PKOBYXMFSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCC[N@H+]1C(C)C)NCc1cc(C)ccc1F ZINC001391696565 1355442604 /nfs/dbraw/zinc/44/26/04/1355442604.db2.gz SXMVLULDWFEHNJ-PKOBYXMFSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1cccc(C)c1 ZINC001391696102 1355442677 /nfs/dbraw/zinc/44/26/77/1355442677.db2.gz SOOSZPAJCWJAOV-RTBURBONSA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(Cl)cc1 ZINC001391722272 1355465846 /nfs/dbraw/zinc/46/58/46/1355465846.db2.gz SBRDRDBECIGJBL-RHSMWYFYSA-N 1 3 337.895 2.666 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NC2(C[NH2+]CC3CC3)CCCC2)C1 ZINC001391767626 1355512121 /nfs/dbraw/zinc/51/21/21/1355512121.db2.gz CQJVMEDEUNZDRX-LJQANCHMSA-N 1 3 339.499 2.628 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@](C)(NC(=O)CN1CC[C@@H](C)C1)C1CC1 ZINC001391819368 1355562865 /nfs/dbraw/zinc/56/28/65/1355562865.db2.gz RXYUOLBGXGIWOL-IIBYNOLFSA-N 1 3 343.515 2.711 10 0 EFAEHO CC(C)CCC[NH+]1CCC(CCNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001391847005 1355590836 /nfs/dbraw/zinc/59/08/36/1355590836.db2.gz LXYJMUTZPSXMNM-SFHVURJKSA-N 1 3 337.552 2.983 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1[C@H](C)[NH2+]Cc1ccsc1 ZINC001436676440 1387279473 /nfs/dbraw/zinc/27/94/73/1387279473.db2.gz XKZBYSYKWKETRN-RDJZCZTQSA-N 1 3 337.533 2.949 10 0 EFAEHO C[C@H](CNC(=O)c1cccc(CN(C)C)c1)C[NH2+]Cc1ccsc1 ZINC001391958889 1355682148 /nfs/dbraw/zinc/68/21/48/1355682148.db2.gz FKGIUBJKNOAGNW-HNNXBMFYSA-N 1 3 345.512 2.965 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+]C[C@H](C)N(C)C(=O)[C@@H]1CCCN1C ZINC001392048379 1355735553 /nfs/dbraw/zinc/73/55/53/1355735553.db2.gz HHNVGNWBXQLAMM-KXBFYZLASA-N 1 3 346.519 2.544 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001392136316 1355794255 /nfs/dbraw/zinc/79/42/55/1355794255.db2.gz DGMPZLWFMCIUOZ-LSDHHAIUSA-N 1 3 333.467 2.589 10 0 EFAEHO C[C@H](C[NH2+][C@H](C)c1cccc(Cl)c1)N(C)C(=O)CN1CCCC1 ZINC001392136885 1355794688 /nfs/dbraw/zinc/79/46/88/1355794688.db2.gz WZDNFEQZWXUBAJ-HUUCEWRRSA-N 1 3 337.895 2.933 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](CC(C)C)NC(=O)[C@@H]2CC[N@H+](C)C2)c1 ZINC001392158168 1355812348 /nfs/dbraw/zinc/81/23/48/1355812348.db2.gz HXPQIECFOLBCQZ-SJLPKXTDSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](CC(C)C)NC(=O)[C@@H]2CC[N@@H+](C)C2)c1 ZINC001392158168 1355812350 /nfs/dbraw/zinc/81/23/50/1355812350.db2.gz HXPQIECFOLBCQZ-SJLPKXTDSA-N 1 3 349.494 2.706 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]Cc1ccc(F)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001392159143 1355813283 /nfs/dbraw/zinc/81/32/83/1355813283.db2.gz FKYBZHCNLWKUNF-APWZRJJASA-N 1 3 349.494 2.788 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1F ZINC001392176572 1355830995 /nfs/dbraw/zinc/83/09/95/1355830995.db2.gz FHHGAIKWDKRJKW-QFBILLFUSA-N 1 3 349.494 2.801 10 0 EFAEHO CC(C)[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc(F)cc1 ZINC001392230323 1355885459 /nfs/dbraw/zinc/88/54/59/1355885459.db2.gz WPTLHPVVESNIHT-SFHVURJKSA-N 1 3 349.494 2.931 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)c1 ZINC001392238471 1355895519 /nfs/dbraw/zinc/89/55/19/1355895519.db2.gz ZPLABTRXFXZSDY-PKOBYXMFSA-N 1 3 331.504 2.567 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)c1 ZINC001392238469 1355895962 /nfs/dbraw/zinc/89/59/62/1355895962.db2.gz ZPLABTRXFXZSDY-IEBWSBKVSA-N 1 3 331.504 2.567 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H]1CCc2ccccc21 ZINC001392248141 1355904813 /nfs/dbraw/zinc/90/48/13/1355904813.db2.gz GCOSECXEMGOJOS-OALUTQOASA-N 1 3 331.504 2.745 10 0 EFAEHO CN(CC(=O)N(C)CC[N@H+](C)CC1CC(C)(C)C1)CC(C)(C)C ZINC001392308838 1355966581 /nfs/dbraw/zinc/96/65/81/1355966581.db2.gz DIXMZQIFZRRSQR-UHFFFAOYSA-N 1 3 325.541 2.791 10 0 EFAEHO CN(CC(=O)N(C)CC[N@@H+](C)CC1CC(C)(C)C1)CC(C)(C)C ZINC001392308838 1355966583 /nfs/dbraw/zinc/96/65/83/1355966583.db2.gz DIXMZQIFZRRSQR-UHFFFAOYSA-N 1 3 325.541 2.791 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[C@@H]1C[NH2+]CC1CC2(CCC2)C1 ZINC001392353530 1356015311 /nfs/dbraw/zinc/01/53/11/1356015311.db2.gz NAOOUMKXYFMGRP-MSOLQXFVSA-N 1 3 335.536 2.783 10 0 EFAEHO CCN(CC[NH2+][C@@H](C)c1cc(C)ccc1C)C(=O)Cc1c[nH]cn1 ZINC001392458271 1356051048 /nfs/dbraw/zinc/05/10/48/1356051048.db2.gz XRVXRZLFVCLXLL-INIZCTEOSA-N 1 3 328.460 2.768 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCc2ccccc21)C(=O)[C@H]1CCCCN1CC ZINC001392461219 1356053124 /nfs/dbraw/zinc/05/31/24/1356053124.db2.gz TXQRFGPNCARQFJ-VQTJNVASSA-N 1 3 343.515 2.986 10 0 EFAEHO CCN(CC[NH2+][C@H](C)c1ccc(F)c(F)c1)C(=O)CN1CCCC1 ZINC001392463103 1356055257 /nfs/dbraw/zinc/05/52/57/1356055257.db2.gz YUOLWNBTCLHJLA-CQSZACIVSA-N 1 3 339.430 2.560 10 0 EFAEHO C[C@H](CN[C@@H](C)c1ccccc1F)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001392486806 1356069445 /nfs/dbraw/zinc/06/94/45/1356069445.db2.gz FUKNTFPXYLMVQE-CVEARBPZSA-N 1 3 347.478 2.857 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+]Cc1ccc(C(F)F)cc1 ZINC001392534027 1356105966 /nfs/dbraw/zinc/10/59/66/1356105966.db2.gz AFYKMQDEVGRXQK-CYBMUJFWSA-N 1 3 327.419 2.559 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1cc(C)cc(C)c1 ZINC001392535856 1356107786 /nfs/dbraw/zinc/10/77/86/1356107786.db2.gz DDXGKVPIZHZSBD-IEBWSBKVSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+]Cc1cc2ccccc2s1 ZINC001392536140 1356107893 /nfs/dbraw/zinc/10/78/93/1356107893.db2.gz KXPAMFYYVFQFIK-CQSZACIVSA-N 1 3 333.501 2.836 10 0 EFAEHO COc1cccc(C[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCCN2C(C)C)c1 ZINC001392594059 1356145590 /nfs/dbraw/zinc/14/55/90/1356145590.db2.gz GXBQOKLKDSIQJC-LPHOPBHVSA-N 1 3 347.503 2.552 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+][C@@H](C)c1ccc2c(c1)CCC2 ZINC001392616247 1356163377 /nfs/dbraw/zinc/16/33/77/1356163377.db2.gz GCQTYAHITNBLRV-HOTGVXAUSA-N 1 3 331.504 2.671 10 0 EFAEHO COc1ccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CCC[N@@H+]2C(C)C)cc1 ZINC001392652544 1356198702 /nfs/dbraw/zinc/19/87/02/1356198702.db2.gz FUPRPKNJQNRGLZ-APWZRJJASA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CCC[N@H+]2C(C)C)cc1 ZINC001392652544 1356198704 /nfs/dbraw/zinc/19/87/04/1356198704.db2.gz FUPRPKNJQNRGLZ-APWZRJJASA-N 1 3 347.503 2.505 10 0 EFAEHO C[C@H](CN(C)[C@@H](C)c1ccc(F)c(Cl)c1)NC(=O)CC[NH+](C)C ZINC001392685876 1356234667 /nfs/dbraw/zinc/23/46/67/1356234667.db2.gz KILQHRBARRXKKY-OLZOCXBDSA-N 1 3 343.874 2.928 10 0 EFAEHO C[C@@H](C[N@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001392691410 1356243387 /nfs/dbraw/zinc/24/33/87/1356243387.db2.gz ZQHMVKTYIGOERP-SJORKVTESA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](C[N@@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001392691410 1356243391 /nfs/dbraw/zinc/24/33/91/1356243391.db2.gz ZQHMVKTYIGOERP-SJORKVTESA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C[N@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001392715335 1356269121 /nfs/dbraw/zinc/26/91/21/1356269121.db2.gz DJTVTMZBXYFTLZ-BEFAXECRSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C[N@@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001392715335 1356269124 /nfs/dbraw/zinc/26/91/24/1356269124.db2.gz DJTVTMZBXYFTLZ-BEFAXECRSA-N 1 3 331.504 2.841 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)Cc1cccc(OC)c1 ZINC001392725104 1356283046 /nfs/dbraw/zinc/28/30/46/1356283046.db2.gz IEYCGJMSYJAJML-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)Cc1cccc(OC)c1 ZINC001392725104 1356283049 /nfs/dbraw/zinc/28/30/49/1356283049.db2.gz IEYCGJMSYJAJML-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCc2ccccc21)C(=O)CN(C)C1CCC1 ZINC001401610128 1362970822 /nfs/dbraw/zinc/97/08/22/1362970822.db2.gz QUIWFLYHJIEUKO-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN2CCC(C)CC2)CC[C@@H]1[NH2+]CCC(C)C ZINC001392805368 1356341877 /nfs/dbraw/zinc/34/18/77/1356341877.db2.gz FQZZMPKOFMCIBY-MOPGFXCFSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)C1(C[NH+](C)C)CC1 ZINC001401778410 1363115445 /nfs/dbraw/zinc/11/54/45/1363115445.db2.gz DRJOLLXZPLKNTK-MRXNPFEDSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NCC2(NCc3ccc(C4CC4)cc3)CC2)CC[N@@H+]1C ZINC001392909983 1356425003 /nfs/dbraw/zinc/42/50/03/1356425003.db2.gz ZHDHTTNDCMOEFN-DNVCBOLYSA-N 1 3 341.499 2.643 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NCC2(NCc3ccc(C4CC4)cc3)CC2)CC[N@H+]1C ZINC001392909983 1356425009 /nfs/dbraw/zinc/42/50/09/1356425009.db2.gz ZHDHTTNDCMOEFN-DNVCBOLYSA-N 1 3 341.499 2.643 10 0 EFAEHO C[C@H]([NH2+]C1(CNC(=O)CN(C)C2CCC2)CC1)c1cccc(F)c1 ZINC001392910979 1356425155 /nfs/dbraw/zinc/42/51/55/1356425155.db2.gz JCKFCJRGHJDGOL-AWEZNQCLSA-N 1 3 333.451 2.609 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@H+](C/C=C/Cl)C1 ZINC001392965080 1356471682 /nfs/dbraw/zinc/47/16/82/1356471682.db2.gz WXHZPBKFBHJKPY-QOCAVEGASA-N 1 3 341.927 2.784 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@@H+](C/C=C/Cl)C1 ZINC001392965080 1356471685 /nfs/dbraw/zinc/47/16/85/1356471685.db2.gz WXHZPBKFBHJKPY-QOCAVEGASA-N 1 3 341.927 2.784 10 0 EFAEHO CC(C)(C(=O)NCCN(CCF)C1CCCCCC1)[NH+]1CCCC1 ZINC001392967008 1356473093 /nfs/dbraw/zinc/47/30/93/1356473093.db2.gz AJWXNFILUDKZKZ-UHFFFAOYSA-N 1 3 341.515 2.971 10 0 EFAEHO CC[C@H](C(=O)NC1(C)CC[NH+]([C@@H]2CCc3ccccc32)CC1)N(C)C ZINC001393070453 1356558165 /nfs/dbraw/zinc/55/81/65/1356558165.db2.gz LGFCSRCPJXYXJD-RTBURBONSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@]2(CC[N@@H+](CC[C@@H](C)F)C2)C1 ZINC001393084836 1356577610 /nfs/dbraw/zinc/57/76/10/1356577610.db2.gz BGISXHLPRIBMPA-MJGOQNOKSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@]2(CC[N@H+](CC[C@@H](C)F)C2)C1 ZINC001393084836 1356577612 /nfs/dbraw/zinc/57/76/12/1356577612.db2.gz BGISXHLPRIBMPA-MJGOQNOKSA-N 1 3 341.515 2.779 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@H]3C[N@H+](CC4CCCC4)C[C@H]3C2)CCC1 ZINC001394351189 1357725362 /nfs/dbraw/zinc/72/53/62/1357725362.db2.gz MDAVPOZQZOSQHZ-IPMKNSEASA-N 1 3 347.547 2.878 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@H]3C[N@@H+](CC4CCCC4)C[C@H]3C2)CCC1 ZINC001394351189 1357725367 /nfs/dbraw/zinc/72/53/67/1357725367.db2.gz MDAVPOZQZOSQHZ-IPMKNSEASA-N 1 3 347.547 2.878 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2cc(C)ccc2F)C1)N(C)C ZINC001393161722 1356667251 /nfs/dbraw/zinc/66/72/51/1356667251.db2.gz MEEGVROFHDTUSL-ICSRJNTNSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2cc(C)ccc2F)C1)N(C)C ZINC001393161718 1356667286 /nfs/dbraw/zinc/66/72/86/1356667286.db2.gz MEEGVROFHDTUSL-AZUAARDMSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)[NH+]1CCC(C)(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001393180019 1356685881 /nfs/dbraw/zinc/68/58/81/1356685881.db2.gz MPXKJCSNTUTZTE-IBGZPJMESA-N 1 3 341.515 2.826 10 0 EFAEHO CCC(CC)C[N@@H+]1CCC[C@](C)(CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001402201450 1363511254 /nfs/dbraw/zinc/51/12/54/1363511254.db2.gz FLNOVZMAWWKYMC-IEBWSBKVSA-N 1 3 325.541 2.981 10 0 EFAEHO CCC(CC)C[N@H+]1CCC[C@](C)(CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001402201450 1363511258 /nfs/dbraw/zinc/51/12/58/1363511258.db2.gz FLNOVZMAWWKYMC-IEBWSBKVSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](F)CN1CCC([C@@H]2CCCN(C(=O)CC[NH+](C)C)C2)CC1 ZINC001393375631 1356797080 /nfs/dbraw/zinc/79/70/80/1356797080.db2.gz ZUYHSDCTVPCQQZ-MSOLQXFVSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]([NH2+]Cc2cccc(Cl)c2)C2CC2)C1 ZINC001402326947 1363607877 /nfs/dbraw/zinc/60/78/77/1363607877.db2.gz PLEADTBKBUUTDX-KDOFPFPSSA-N 1 3 349.906 2.666 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2cccc(C)c2)C1 ZINC001393397181 1356816454 /nfs/dbraw/zinc/81/64/54/1356816454.db2.gz LRYCNLUBZWUXHT-HKUYNNGSSA-N 1 3 331.504 2.521 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@H]2CN(C(=O)CN3[C@H](C)CC[C@@H]3C)C[C@H]2C1 ZINC001393419033 1356833441 /nfs/dbraw/zinc/83/34/41/1356833441.db2.gz RHTIMELYKZHUNL-QGFMHUBQSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@H]2CN(C(=O)CN3[C@H](C)CC[C@@H]3C)C[C@H]2C1 ZINC001393419033 1356833455 /nfs/dbraw/zinc/83/34/55/1356833455.db2.gz RHTIMELYKZHUNL-QGFMHUBQSA-N 1 3 335.536 2.686 10 0 EFAEHO CC[C@H](F)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCC[NH+]1CCCC1 ZINC001393466321 1356867684 /nfs/dbraw/zinc/86/76/84/1356867684.db2.gz QCMDCJICGZJXMT-OKZBNKHCSA-N 1 3 339.499 2.676 10 0 EFAEHO C[C@H](NC/C=C\Cl)c1ccc(CNC(=O)[C@@H]2CC[N@H+](C)C2)cc1 ZINC001393484499 1356886753 /nfs/dbraw/zinc/88/67/53/1356886753.db2.gz CRRHBDNGMAIGJY-WKRQOSGNSA-N 1 3 335.879 2.658 10 0 EFAEHO C[C@H](NC/C=C\Cl)c1ccc(CNC(=O)[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001393484499 1356886757 /nfs/dbraw/zinc/88/67/57/1356886757.db2.gz CRRHBDNGMAIGJY-WKRQOSGNSA-N 1 3 335.879 2.658 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1cccc2c1CC[N@H+](CC1CCC1)C2 ZINC001393526321 1356921053 /nfs/dbraw/zinc/92/10/53/1356921053.db2.gz VROPDZGLQRHJKX-UHFFFAOYSA-N 1 3 343.515 2.801 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1cccc2c1CC[N@@H+](CC1CCC1)C2 ZINC001393526321 1356921056 /nfs/dbraw/zinc/92/10/56/1356921056.db2.gz VROPDZGLQRHJKX-UHFFFAOYSA-N 1 3 343.515 2.801 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCCN(C/C=C\Cl)CC1)[NH+](CC)CC ZINC001393590865 1356971129 /nfs/dbraw/zinc/97/11/29/1356971129.db2.gz AHVKNFNVLGXULT-RBYQPQOCSA-N 1 3 329.916 2.830 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](Cc2cccc(OC)c2)CC1)N(C)C ZINC001393593301 1356973937 /nfs/dbraw/zinc/97/39/37/1356973937.db2.gz ABXFGZSGBWWSLE-PKOBYXMFSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](Cc2cccc(OC)c2)CC1)N(C)C ZINC001393593301 1356973940 /nfs/dbraw/zinc/97/39/40/1356973940.db2.gz ABXFGZSGBWWSLE-PKOBYXMFSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC001393632636 1357028209 /nfs/dbraw/zinc/02/82/09/1357028209.db2.gz LVCPNQLWQAIZLT-SJORKVTESA-N 1 3 329.504 2.779 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@H+](C)[C@@H]1CCc2ccccc21)N(C)C ZINC001393643833 1357045389 /nfs/dbraw/zinc/04/53/89/1357045389.db2.gz PNCGEGGLOAABTK-RBUKOAKNSA-N 1 3 331.504 2.794 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@@H+](C)[C@@H]1CCc2ccccc21)N(C)C ZINC001393643833 1357045391 /nfs/dbraw/zinc/04/53/91/1357045391.db2.gz PNCGEGGLOAABTK-RBUKOAKNSA-N 1 3 331.504 2.794 10 0 EFAEHO CCC1([NH2+]Cc2ccccc2F)CCN(C(=O)CN2CCCC2)CC1 ZINC001393679496 1357072600 /nfs/dbraw/zinc/07/26/00/1357072600.db2.gz KFAPHRCZXHXHHS-UHFFFAOYSA-N 1 3 347.478 2.782 10 0 EFAEHO CCC1([NH2+]C/C=C\Cl)CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001393681542 1357075770 /nfs/dbraw/zinc/07/57/70/1357075770.db2.gz YNKLSCIDKRRBHL-WTKPLQERSA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001394455392 1357837115 /nfs/dbraw/zinc/83/71/15/1357837115.db2.gz ZLUVDAHXFMECIN-OALUTQOASA-N 1 3 349.563 2.980 10 0 EFAEHO C[C@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]CC1CCC2(CC2)CC1 ZINC001394498313 1357880751 /nfs/dbraw/zinc/88/07/51/1357880751.db2.gz QJUZVUYUACNEMV-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCC1 ZINC001394529278 1357913592 /nfs/dbraw/zinc/91/35/92/1357913592.db2.gz OGNHPRKINBDKKK-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO Cc1ccc(CN[C@@H](C)CN(C)C(=O)C23CC[NH+](CC2)C3)c(Cl)c1 ZINC001394533814 1357919449 /nfs/dbraw/zinc/91/94/49/1357919449.db2.gz BLTBKJBAXCNQNV-HNNXBMFYSA-N 1 3 349.906 2.681 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]CCc1ccccc1Cl ZINC001394570480 1357962372 /nfs/dbraw/zinc/96/23/72/1357962372.db2.gz ZFQYNOVVILULAC-OAHLLOKOSA-N 1 3 339.911 2.659 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2CCN(C(=O)C3(C[NH+](C)C)CC3)[C@@H]2C)c1 ZINC001394666037 1357984978 /nfs/dbraw/zinc/98/49/78/1357984978.db2.gz FEOFPBJDRDDLIG-QAPCUYQASA-N 1 3 347.478 2.555 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(Cl)s2)[C@@H]1C ZINC001394670150 1357987386 /nfs/dbraw/zinc/98/73/86/1357987386.db2.gz BQHZLXZCVOQSLI-GXTWGEPZSA-N 1 3 343.924 2.821 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]CC2CCC3(CC3)CC2)C[C@H]1C ZINC001394690367 1358013248 /nfs/dbraw/zinc/01/32/48/1358013248.db2.gz ZOKSIUNLTSONIN-SJLPKXTDSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@H](c1cccc(F)c1)N1CC[C@]2(NC(=O)CC[NH+](C)C)CCC[C@@H]12 ZINC001394693721 1358017062 /nfs/dbraw/zinc/01/70/62/1358017062.db2.gz UIEFTMNUNFLYSL-XFQXTVEOSA-N 1 3 347.478 2.952 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001394814825 1358107437 /nfs/dbraw/zinc/10/74/37/1358107437.db2.gz KDAPGHAIZDACQF-IAGOWNOFSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C\Cl ZINC001440659384 1389805781 /nfs/dbraw/zinc/80/57/81/1389805781.db2.gz VKXCQDSHDQXMIJ-GANVNIMBSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C\Cl ZINC001440659384 1389805787 /nfs/dbraw/zinc/80/57/87/1389805787.db2.gz VKXCQDSHDQXMIJ-GANVNIMBSA-N 1 3 336.307 2.663 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1ccc(F)cc1)C(C)(C)C)N(C)C ZINC001394837776 1358139138 /nfs/dbraw/zinc/13/91/38/1358139138.db2.gz UTPDEMBKKNACEZ-SJORKVTESA-N 1 3 337.483 2.786 10 0 EFAEHO CC[C@H](F)CN1CCC([C@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)CC1 ZINC001394845487 1358149948 /nfs/dbraw/zinc/14/99/48/1358149948.db2.gz MZPQSWDUWRIGTP-RDJZCZTQSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@@H](C(=O)NC1(C2CC[NH+](Cc3ccccc3)CC2)CC1)N(C)C ZINC001394860128 1358167016 /nfs/dbraw/zinc/16/70/16/1358167016.db2.gz LYGWYNFWOPURTI-IBGZPJMESA-N 1 3 343.515 2.888 10 0 EFAEHO C[NH+](C)CCCC(=O)NC1(C2CCN(Cc3ccsc3)CC2)CC1 ZINC001394862198 1358169993 /nfs/dbraw/zinc/16/99/93/1358169993.db2.gz MZKZMOHWGKLZOM-UHFFFAOYSA-N 1 3 349.544 2.951 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC001436978848 1387350119 /nfs/dbraw/zinc/35/01/19/1387350119.db2.gz PWBCUBJUXURSSA-IYBDPMFKSA-N 1 3 339.430 2.701 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCC[N@@H+]1CC1CC1)N1CCCCC1 ZINC001437048038 1387387684 /nfs/dbraw/zinc/38/76/84/1387387684.db2.gz WOWGGNWLHOWRIY-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCC[N@H+]1CC1CC1)N1CCCCC1 ZINC001437048038 1387387688 /nfs/dbraw/zinc/38/76/88/1387387688.db2.gz WOWGGNWLHOWRIY-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](N[C@H]1C[C@@H](CNC(=O)C[C@H]2CC[N@H+](C)C2)C1)c1ccccc1F ZINC001397094532 1359672211 /nfs/dbraw/zinc/67/22/11/1359672211.db2.gz HPKLXCSHJPTPLT-VQHPVUNQSA-N 1 3 347.478 2.713 10 0 EFAEHO C[C@@H](N[C@H]1C[C@@H](CNC(=O)C[C@H]2CC[N@@H+](C)C2)C1)c1ccccc1F ZINC001397094532 1359672213 /nfs/dbraw/zinc/67/22/13/1359672213.db2.gz HPKLXCSHJPTPLT-VQHPVUNQSA-N 1 3 347.478 2.713 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CCC(C)(C)C)C1)N(C)C ZINC001397158367 1359713530 /nfs/dbraw/zinc/71/35/30/1359713530.db2.gz MKFDVBLTIQOYNZ-BBWFWOEESA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1C[C@@H]([NH2+]CC2CCC(C)CC2)C1)N(C)C ZINC001397128889 1359692040 /nfs/dbraw/zinc/69/20/40/1359692040.db2.gz BHJAUBKUDARTLZ-LKIAZTKLSA-N 1 3 337.552 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]Cc1cccc(F)c1 ZINC001397164968 1359717526 /nfs/dbraw/zinc/71/75/26/1359717526.db2.gz AUFSOVBAPYCYOE-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO C[C@H](F)CCN1CC[C@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)[C@H]1C ZINC001397240561 1359777808 /nfs/dbraw/zinc/77/78/08/1359777808.db2.gz IFLXDOUEJXKOBZ-UXLLHSPISA-N 1 3 341.515 2.967 10 0 EFAEHO C[C@H](F)CCN1CC[C@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)[C@H]1C ZINC001397240561 1359777810 /nfs/dbraw/zinc/77/78/10/1359777810.db2.gz IFLXDOUEJXKOBZ-UXLLHSPISA-N 1 3 341.515 2.967 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@H+](CC2CC(F)(F)C2)[C@@H]1C)N(CC)CC ZINC001397271653 1359805066 /nfs/dbraw/zinc/80/50/66/1359805066.db2.gz JMRXWEGJXPJQFP-KBMXLJTQSA-N 1 3 345.478 2.731 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@@H+](CC2CC(F)(F)C2)[C@@H]1C)N(CC)CC ZINC001397271653 1359805069 /nfs/dbraw/zinc/80/50/69/1359805069.db2.gz JMRXWEGJXPJQFP-KBMXLJTQSA-N 1 3 345.478 2.731 10 0 EFAEHO CN(C[C@H]1CC[N@@H+]1CC1CC(C)(C)C1)C(=O)C(C)(C)N1CCCC1 ZINC001397542987 1359946695 /nfs/dbraw/zinc/94/66/95/1359946695.db2.gz GYRQVENELAUQSY-QGZVFWFLSA-N 1 3 335.536 2.830 10 0 EFAEHO CN(C[C@H]1CC[N@H+]1CC1CC(C)(C)C1)C(=O)C(C)(C)N1CCCC1 ZINC001397542987 1359946699 /nfs/dbraw/zinc/94/66/99/1359946699.db2.gz GYRQVENELAUQSY-QGZVFWFLSA-N 1 3 335.536 2.830 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@@H+]2CC2CCC3(CC3)CC2)C1 ZINC001397579052 1359977008 /nfs/dbraw/zinc/97/70/08/1359977008.db2.gz OYYDOKLWTGWCOM-HKUYNNGSSA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@H+]2CC2CCC3(CC3)CC2)C1 ZINC001397579052 1359977011 /nfs/dbraw/zinc/97/70/11/1359977011.db2.gz OYYDOKLWTGWCOM-HKUYNNGSSA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@@H](N[C@H]1C[C@H](CNC(=O)CC[NH+](C)C)C1)c1ccccc1Cl ZINC001397669401 1360038002 /nfs/dbraw/zinc/03/80/02/1360038002.db2.gz DUWBRJSWEKVULD-RBSFLKMASA-N 1 3 337.895 2.837 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2cccc(C)c2)C1 ZINC001397720190 1360077693 /nfs/dbraw/zinc/07/76/93/1360077693.db2.gz AAPCQZJMTMBWBH-ZWKOTPCHSA-N 1 3 340.471 2.644 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C[C@H]1C)CC[NH+](CC[C@H](C)F)CC2 ZINC001397727541 1360083064 /nfs/dbraw/zinc/08/30/64/1360083064.db2.gz OIQLASGZEXAPKZ-DLBZAZTESA-N 1 3 341.515 2.778 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001397733515 1360088444 /nfs/dbraw/zinc/08/84/44/1360088444.db2.gz SDZZERYDTSRLIH-FXAWDEMLSA-N 1 3 345.531 2.964 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H]2CCCCCN(C(=O)CC[NH+](C)C)C2)c1 ZINC001397779211 1360128755 /nfs/dbraw/zinc/12/87/55/1360128755.db2.gz PFALNHQLOPINPL-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@H+](CCC(C)C)CC(C)(C)C1 ZINC001397811296 1360163459 /nfs/dbraw/zinc/16/34/59/1360163459.db2.gz NOQUBYCZJYJBQU-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@@H+](CCC(C)C)CC(C)(C)C1 ZINC001397811296 1360163464 /nfs/dbraw/zinc/16/34/64/1360163464.db2.gz NOQUBYCZJYJBQU-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@H+](C/C=C/Cl)CC(C)(C)C1)N(C)C ZINC001397804410 1360156316 /nfs/dbraw/zinc/15/63/16/1360156316.db2.gz FVVTZLNXXICENK-LADOHOGBSA-N 1 3 329.916 2.686 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@@H+](C/C=C/Cl)CC(C)(C)C1)N(C)C ZINC001397804410 1360156318 /nfs/dbraw/zinc/15/63/18/1360156318.db2.gz FVVTZLNXXICENK-LADOHOGBSA-N 1 3 329.916 2.686 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CC[N@H+](CCC2CCCCC2)C1 ZINC001398295858 1360448676 /nfs/dbraw/zinc/44/86/76/1360448676.db2.gz ZUUUFBIACMLTPW-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CC[N@@H+](CCC2CCCCC2)C1 ZINC001398295858 1360448677 /nfs/dbraw/zinc/44/86/77/1360448677.db2.gz ZUUUFBIACMLTPW-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC12CC[NH+](CCc1cccs1)CC2 ZINC001398361696 1360484113 /nfs/dbraw/zinc/48/41/13/1360484113.db2.gz KWZLXEGVNMIYBS-KRWDZBQOSA-N 1 3 349.544 2.602 10 0 EFAEHO CCCN(C(=O)CN1CC[C@@H](C)C1)C1CC[NH+](CC[C@@H](C)F)CC1 ZINC001398369409 1360490907 /nfs/dbraw/zinc/49/09/07/1360490907.db2.gz RQQSQVLMOPUEFT-IAGOWNOFSA-N 1 3 341.515 2.779 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@@H](NCc1ccccc1F)C1CC1 ZINC001398400731 1360517405 /nfs/dbraw/zinc/51/74/05/1360517405.db2.gz OWOKNVZLQYNUCG-PKOBYXMFSA-N 1 3 347.478 2.685 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@@H](NCc1ccccc1F)C1CC1 ZINC001398400731 1360517408 /nfs/dbraw/zinc/51/74/08/1360517408.db2.gz OWOKNVZLQYNUCG-PKOBYXMFSA-N 1 3 347.478 2.685 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]([NH2+]CC1CCCC1)C1CC1)N1CCCCCC1 ZINC001398438254 1360556535 /nfs/dbraw/zinc/55/65/35/1360556535.db2.gz GJQSPZMNNOILLS-LPHOPBHVSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](C[N@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001398460965 1360578823 /nfs/dbraw/zinc/57/88/23/1360578823.db2.gz GCHQAFGYOIICIP-IAGOWNOFSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](C[N@@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001398460965 1360578825 /nfs/dbraw/zinc/57/88/25/1360578825.db2.gz GCHQAFGYOIICIP-IAGOWNOFSA-N 1 3 325.541 2.933 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)C[NH+]2[C@H](C)CC[C@H]2C)c1 ZINC001492873682 1360636530 /nfs/dbraw/zinc/63/65/30/1360636530.db2.gz PMFKWBLBVKIFHG-IAGOWNOFSA-N 1 3 331.504 2.670 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CCC(F)(F)F)N(C)C ZINC001398571664 1360651356 /nfs/dbraw/zinc/65/13/56/1360651356.db2.gz FHQVTZSDCBWCRT-DKUMPPAJSA-N 1 3 349.441 2.637 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC(F)(F)F)N(C)C ZINC001398571664 1360651359 /nfs/dbraw/zinc/65/13/59/1360651359.db2.gz FHQVTZSDCBWCRT-DKUMPPAJSA-N 1 3 349.441 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@H](C)c2cc(F)ccc2F)C1 ZINC001398574706 1360652573 /nfs/dbraw/zinc/65/25/73/1360652573.db2.gz LNMDVMVBJMJWAS-BPLDGKMQSA-N 1 3 339.430 2.603 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]C[C@H]2CCC(F)(F)C2)C1)CC(C)(C)C ZINC001398628894 1360678863 /nfs/dbraw/zinc/67/88/63/1360678863.db2.gz SRMGDWLPQCUBTN-SOUVJXGZSA-N 1 3 345.478 2.637 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+][C@@H]3CCCc4ccccc43)C2)CCC1 ZINC001398631376 1360679427 /nfs/dbraw/zinc/67/94/27/1360679427.db2.gz XTWPCEWEIKUGLR-ZIFCJYIRSA-N 1 3 341.499 2.785 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@H](C(=O)N[C@H]2C[C@@H](NCC=C(Cl)Cl)C2)C1 ZINC001398659570 1360693367 /nfs/dbraw/zinc/69/33/67/1360693367.db2.gz HDJYFNNUTSMSEZ-FQUUOJAGSA-N 1 3 348.318 2.663 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)N[C@H]2C[C@@H](NCC=C(Cl)Cl)C2)C1 ZINC001398659592 1360693470 /nfs/dbraw/zinc/69/34/70/1360693470.db2.gz HDJYFNNUTSMSEZ-YIYPIFLZSA-N 1 3 348.318 2.663 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](CCCc2ccccc2)C1)N(C)C ZINC001398694566 1360723558 /nfs/dbraw/zinc/72/35/58/1360723558.db2.gz LBGFRYQRLCQPKB-VQTJNVASSA-N 1 3 345.531 2.788 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](CCCc2ccccc2)C1)N(C)C ZINC001398694566 1360723562 /nfs/dbraw/zinc/72/35/62/1360723562.db2.gz LBGFRYQRLCQPKB-VQTJNVASSA-N 1 3 345.531 2.788 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[NH2+][C@H](C)c2ccccc2)C1 ZINC001398734613 1360750979 /nfs/dbraw/zinc/75/09/79/1360750979.db2.gz PFNVQNYIKJOOBJ-MSOLQXFVSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H](C)[NH2+]CCc1ccccc1F ZINC001437212954 1387473495 /nfs/dbraw/zinc/47/34/95/1387473495.db2.gz HXHPKMRKZYRWFM-QFBILLFUSA-N 1 3 349.494 2.725 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1CCCC[N@@H+]1CCCF)N1CCCCCC1 ZINC001398770419 1360776433 /nfs/dbraw/zinc/77/64/33/1360776433.db2.gz ZAAWPNKJZRURLH-SJORKVTESA-N 1 3 327.488 2.581 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1CCCC[N@H+]1CCCF)N1CCCCCC1 ZINC001398770419 1360776437 /nfs/dbraw/zinc/77/64/37/1360776437.db2.gz ZAAWPNKJZRURLH-SJORKVTESA-N 1 3 327.488 2.581 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@H+](Cc2ccccc2F)C1 ZINC001398799246 1360801342 /nfs/dbraw/zinc/80/13/42/1360801342.db2.gz UMSOYZOPBCYVNN-IAGOWNOFSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1 ZINC001398799246 1360801345 /nfs/dbraw/zinc/80/13/45/1360801345.db2.gz UMSOYZOPBCYVNN-IAGOWNOFSA-N 1 3 349.494 2.883 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cc2ccccc2s1 ZINC001437214797 1387476117 /nfs/dbraw/zinc/47/61/17/1387476117.db2.gz XTUQVQZIYBYRGW-HUUCEWRRSA-N 1 3 345.512 2.837 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)NCc2cc3ccccc3o2)CC[N@@H+]1C ZINC001398914587 1360871555 /nfs/dbraw/zinc/87/15/55/1360871555.db2.gz GEGXOZFUYJZVIX-JCGIZDLHSA-N 1 3 343.471 2.757 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)NCc2cc3ccccc3o2)CC[N@H+]1C ZINC001398914587 1360871556 /nfs/dbraw/zinc/87/15/56/1360871556.db2.gz GEGXOZFUYJZVIX-JCGIZDLHSA-N 1 3 343.471 2.757 10 0 EFAEHO C[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]CCc1cccs1 ZINC001437217619 1387477753 /nfs/dbraw/zinc/47/77/53/1387477753.db2.gz VJMZXNKEKCFPIV-HZPDHXFCSA-N 1 3 337.533 2.649 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+][C@H](C)c1cccc(F)c1 ZINC001399047225 1360957121 /nfs/dbraw/zinc/95/71/21/1360957121.db2.gz ZIZHKFZXEVWIGW-HUUCEWRRSA-N 1 3 335.467 2.855 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CNC(=O)[C@@H](C)N2CCCCCC2)cc1 ZINC001399091741 1360986792 /nfs/dbraw/zinc/98/67/92/1360986792.db2.gz IWAAPFZSRNVWHT-QZTJIDSGSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@@H](C)c2cccc(OC)c2)CC[N@@H+]1C ZINC001399483014 1361265546 /nfs/dbraw/zinc/26/55/46/1361265546.db2.gz PHVHKYOSYYYSAW-ZYSHUDEJSA-N 1 3 347.503 2.535 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@@H](C)c2cccc(OC)c2)CC[N@H+]1C ZINC001399483014 1361265551 /nfs/dbraw/zinc/26/55/51/1361265551.db2.gz PHVHKYOSYYYSAW-ZYSHUDEJSA-N 1 3 347.503 2.535 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@@H+]1C)Cc1ccc2c(c1)CCC2 ZINC001399499841 1361281248 /nfs/dbraw/zinc/28/12/48/1361281248.db2.gz CEDAZCDBXIJQKW-FQEVSTJZSA-N 1 3 343.515 2.598 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@H+]1C)Cc1ccc2c(c1)CCC2 ZINC001399499841 1361281250 /nfs/dbraw/zinc/28/12/50/1361281250.db2.gz CEDAZCDBXIJQKW-FQEVSTJZSA-N 1 3 343.515 2.598 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(C)CCNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001399564032 1361334088 /nfs/dbraw/zinc/33/40/88/1361334088.db2.gz YMBONGWIQMZATM-HNNXBMFYSA-N 1 3 335.467 2.809 10 0 EFAEHO CN(CCNC(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1)CCc1ccccc1F ZINC001399637749 1361392442 /nfs/dbraw/zinc/39/24/42/1361392442.db2.gz GBECAJTWVRKEMM-ZWKOTPCHSA-N 1 3 349.494 2.537 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]CCc1ccc2ccccc2c1 ZINC001437261682 1387514330 /nfs/dbraw/zinc/51/43/30/1387514330.db2.gz LJLVOGZBAHKXTQ-KRWDZBQOSA-N 1 3 341.499 2.817 10 0 EFAEHO CCN(CCNC(=O)CC[C@H]1CCC[N@@H+]1C)Cc1ccc(F)cc1 ZINC001399725283 1361456832 /nfs/dbraw/zinc/45/68/32/1361456832.db2.gz RTLZWYWJCCTFGJ-GOSISDBHSA-N 1 3 335.467 2.638 10 0 EFAEHO CCN(CCNC(=O)CC[C@H]1CCC[N@H+]1C)Cc1ccc(F)cc1 ZINC001399725283 1361456833 /nfs/dbraw/zinc/45/68/33/1361456833.db2.gz RTLZWYWJCCTFGJ-GOSISDBHSA-N 1 3 335.467 2.638 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)[C@H](C)c1cccc(OC)c1 ZINC001399813260 1361513264 /nfs/dbraw/zinc/51/32/64/1361513264.db2.gz XXVZPZFGCAEJBS-SJORKVTESA-N 1 3 347.503 2.536 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)[C@H](C)c1cccc(OC)c1 ZINC001399813260 1361513268 /nfs/dbraw/zinc/51/32/68/1361513268.db2.gz XXVZPZFGCAEJBS-SJORKVTESA-N 1 3 347.503 2.536 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@H]2CCCN2Cc2ccc(CF)cc2)C1 ZINC001399859817 1361534033 /nfs/dbraw/zinc/53/40/33/1361534033.db2.gz CCIGQHRLLQSKIA-RTBURBONSA-N 1 3 347.478 2.579 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@H]2CCCN2Cc2ccc(CF)cc2)C1 ZINC001399859817 1361534037 /nfs/dbraw/zinc/53/40/37/1361534037.db2.gz CCIGQHRLLQSKIA-RTBURBONSA-N 1 3 347.478 2.579 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCN(Cc2ccc(F)cc2)C1)[NH+]1CCCC1 ZINC001399928775 1361584300 /nfs/dbraw/zinc/58/43/00/1361584300.db2.gz XERGWPGQHPHSJH-QGZVFWFLSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@H](C)C[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001400026588 1361677568 /nfs/dbraw/zinc/67/75/68/1361677568.db2.gz CWUQTZCJGHAYQE-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@H](C)C[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001400026588 1361677572 /nfs/dbraw/zinc/67/75/72/1361677572.db2.gz CWUQTZCJGHAYQE-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NCC[C@@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001400179907 1361818957 /nfs/dbraw/zinc/81/89/57/1361818957.db2.gz COZLFOSXQXLVFA-SJORKVTESA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NCC[C@@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001400179907 1361818959 /nfs/dbraw/zinc/81/89/59/1361818959.db2.gz COZLFOSXQXLVFA-SJORKVTESA-N 1 3 349.906 2.620 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@@H]2CC[N@H+](CCC3CCCC3)C2)C1 ZINC001400188577 1361829292 /nfs/dbraw/zinc/82/92/92/1361829292.db2.gz VVYJBMSJGAOJJR-PKOBYXMFSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@@H]2CC[N@@H+](CCC3CCCC3)C2)C1 ZINC001400188577 1361829296 /nfs/dbraw/zinc/82/92/96/1361829296.db2.gz VVYJBMSJGAOJJR-PKOBYXMFSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)C1)N(C)C ZINC001400279523 1361903987 /nfs/dbraw/zinc/90/39/87/1361903987.db2.gz SAQAKWLUHDEBDJ-HOJAQTOUSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@H+]([C@H]2CCc3ccccc32)C1)N(C)C ZINC001400279523 1361903991 /nfs/dbraw/zinc/90/39/91/1361903991.db2.gz SAQAKWLUHDEBDJ-HOJAQTOUSA-N 1 3 343.515 2.841 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC001400297817 1361916131 /nfs/dbraw/zinc/91/61/31/1361916131.db2.gz UWZCDMWJMXVHGY-RBUKOAKNSA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC001400297817 1361916133 /nfs/dbraw/zinc/91/61/33/1361916133.db2.gz UWZCDMWJMXVHGY-RBUKOAKNSA-N 1 3 329.488 2.642 10 0 EFAEHO CN(CC(=O)NCC1C[NH+]([C@@H]2CCc3ccccc32)C1)CC(C)(C)C ZINC001400527015 1362012985 /nfs/dbraw/zinc/01/29/85/1362012985.db2.gz HYRRAOBVZKXTCQ-LJQANCHMSA-N 1 3 343.515 2.700 10 0 EFAEHO CC(C)c1ccc([C@H](C)N2CC(CNC(=O)CC[NH+](C)C)C2)cc1 ZINC001400531367 1362014635 /nfs/dbraw/zinc/01/46/35/1362014635.db2.gz WSLJVIBBXSLBQD-INIZCTEOSA-N 1 3 331.504 2.871 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH+]2CC(CNC(=O)CN(C)C(C)C)C2)c1 ZINC001400572351 1362029985 /nfs/dbraw/zinc/02/99/85/1362029985.db2.gz LJAKDWKMTSYYAH-KRWDZBQOSA-N 1 3 331.504 2.753 10 0 EFAEHO CCN(C(=O)C[C@@H]1CC[N@H+](C)C1)[C@@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001400756473 1362144185 /nfs/dbraw/zinc/14/41/85/1362144185.db2.gz BKSFZJQYBWDVNL-VQTJNVASSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)C[C@@H]1CC[N@@H+](C)C1)[C@@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001400756473 1362144187 /nfs/dbraw/zinc/14/41/87/1362144187.db2.gz BKSFZJQYBWDVNL-VQTJNVASSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)C[C@@H]1CC[N@H+](C)C1)[C@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001400756437 1362144639 /nfs/dbraw/zinc/14/46/39/1362144639.db2.gz BKSFZJQYBWDVNL-PMACEKPBSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)C[C@@H]1CC[N@@H+](C)C1)[C@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001400756437 1362144641 /nfs/dbraw/zinc/14/46/41/1362144641.db2.gz BKSFZJQYBWDVNL-PMACEKPBSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@@H]1CCN(Cc2ccc3c(c2)CCC3)C1 ZINC001400766804 1362152481 /nfs/dbraw/zinc/15/24/81/1362152481.db2.gz MKAUZZRSADMFJD-HXUWFJFHSA-N 1 3 343.515 2.550 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1ccc(C)nc1C ZINC001400804043 1362173703 /nfs/dbraw/zinc/17/37/03/1362173703.db2.gz OQXDBZMCOWWJKD-RTBURBONSA-N 1 3 346.519 2.557 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC1(NC(=O)[C@H]2CCCN2C(C)C)CCCC1 ZINC001400909184 1362248105 /nfs/dbraw/zinc/24/81/05/1362248105.db2.gz PLIKORZHWSZBHO-HZPDHXFCSA-N 1 3 327.488 2.626 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC001400923029 1362264345 /nfs/dbraw/zinc/26/43/45/1362264345.db2.gz QJTGOHCVYAUVMH-HIFRSBDPSA-N 1 3 341.446 2.850 10 0 EFAEHO CC[C@H](C(=O)N[C@](C)(C[NH2+]Cc1ccccc1C)C1CC1)N(C)C ZINC001401030101 1362380151 /nfs/dbraw/zinc/38/01/51/1362380151.db2.gz CUUOKPSCAVYHAE-UYAOXDASSA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)(C(=O)NCCC1CCN(C/C=C\Cl)CC1)[NH+]1CCCC1 ZINC001401075731 1362417336 /nfs/dbraw/zinc/41/73/36/1362417336.db2.gz FXGYBJXYAZOSIK-UITAMQMPSA-N 1 3 341.927 2.832 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([N@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001437352575 1387573240 /nfs/dbraw/zinc/57/32/40/1387573240.db2.gz USMSBQZIDKNEIY-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([N@@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001437352575 1387573244 /nfs/dbraw/zinc/57/32/44/1387573244.db2.gz USMSBQZIDKNEIY-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)C[NH2+][C@@H]1CCc2ccccc21 ZINC001401113645 1362451835 /nfs/dbraw/zinc/45/18/35/1362451835.db2.gz JMCNCLRLZSXSIK-HNAYVOBHSA-N 1 3 329.488 2.500 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)C[NH2+]CC1CCC2(CC2)CC1 ZINC001401149729 1362485840 /nfs/dbraw/zinc/48/58/40/1362485840.db2.gz UHBMUGKDQPILPV-CQSZACIVSA-N 1 3 332.492 2.573 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cc2ccccc2s1)N(C)C(=O)[C@H]1CCCN1C ZINC001401247045 1362585944 /nfs/dbraw/zinc/58/59/44/1362585944.db2.gz YLNHOIWJRCKNEQ-WMLDXEAASA-N 1 3 345.512 2.932 10 0 EFAEHO C[C@@H](C[NH2+]CC1CCCC1)N(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001401247599 1362587214 /nfs/dbraw/zinc/58/72/14/1362587214.db2.gz QAAGJYCYIXOGJE-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C[C@@H](C)N(C)C(=O)CN(C)C(C)C)c1 ZINC001401266264 1362607374 /nfs/dbraw/zinc/60/73/74/1362607374.db2.gz LEBMIEZBRCFMEQ-CVEARBPZSA-N 1 3 335.492 2.533 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C)[C@H]1C[NH2+]Cc1ccsc1 ZINC001401306078 1362652626 /nfs/dbraw/zinc/65/26/26/1362652626.db2.gz MTDQDVNOGWUUFE-DOTOQJQBSA-N 1 3 337.533 2.805 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)CCC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001401307093 1362653799 /nfs/dbraw/zinc/65/37/99/1362653799.db2.gz VQMGJKJCJUZQTQ-QGZVFWFLSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)CCC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001401307093 1362653803 /nfs/dbraw/zinc/65/38/03/1362653803.db2.gz VQMGJKJCJUZQTQ-QGZVFWFLSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1cccc(Cl)c1 ZINC001401354418 1362703395 /nfs/dbraw/zinc/70/33/95/1362703395.db2.gz LVCJMPLTZJMIKZ-KRWDZBQOSA-N 1 3 339.911 2.911 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2ccc(Cl)cc21)C(=O)CC[NH+](C)C ZINC001401384405 1362737881 /nfs/dbraw/zinc/73/78/81/1362737881.db2.gz FUIBDYRZZPPSQZ-QGZVFWFLSA-N 1 3 337.895 2.669 10 0 EFAEHO CCc1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC001401385863 1362739516 /nfs/dbraw/zinc/73/95/16/1362739516.db2.gz DYNZDLWNXRYQDD-PXNSSMCTSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC001401385863 1362739520 /nfs/dbraw/zinc/73/95/20/1362739520.db2.gz DYNZDLWNXRYQDD-PXNSSMCTSA-N 1 3 345.531 2.870 10 0 EFAEHO CN(CCc1ccccc1)CCN(C)C(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001401433518 1362800035 /nfs/dbraw/zinc/80/00/35/1362800035.db2.gz CQUVZJRKJQBUQV-VQTJNVASSA-N 1 3 345.531 2.740 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccccc2Cl)C1 ZINC001401493360 1362885336 /nfs/dbraw/zinc/88/53/36/1362885336.db2.gz ODKGPXNTFHXARX-WMZOPIPTSA-N 1 3 349.906 2.715 10 0 EFAEHO CCN(CCN[C@@H](C)c1ccccc1F)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001401600224 1362962216 /nfs/dbraw/zinc/96/22/16/1362962216.db2.gz ZIONIPDSYNEKQY-JKSUJKDBSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCN[C@@H](C)c1ccccc1F)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001401600224 1362962219 /nfs/dbraw/zinc/96/22/19/1362962219.db2.gz ZIONIPDSYNEKQY-JKSUJKDBSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@H](CNCc1ccc(Cl)s1)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001401628814 1362983050 /nfs/dbraw/zinc/98/30/50/1362983050.db2.gz STUIPUDAILWPCG-CHWSQXEVSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@H](CNCc1ccc(Cl)s1)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001401628814 1362983057 /nfs/dbraw/zinc/98/30/57/1362983057.db2.gz STUIPUDAILWPCG-CHWSQXEVSA-N 1 3 343.924 2.870 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CCNC(=O)[C@H]2CCCN2C)c(Cl)c1 ZINC001437396162 1387603656 /nfs/dbraw/zinc/60/36/56/1387603656.db2.gz LRBBBVXSHPYULA-RHSMWYFYSA-N 1 3 337.895 2.727 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](C)NC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001401682156 1363023114 /nfs/dbraw/zinc/02/31/14/1363023114.db2.gz VLQFZYMYIHNQRO-YOEHRIQHSA-N 1 3 349.906 2.585 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)C[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001401769779 1363106675 /nfs/dbraw/zinc/10/66/75/1363106675.db2.gz NRUJFIOVAPDQTQ-HZPDHXFCSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)C[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001401769779 1363106676 /nfs/dbraw/zinc/10/66/76/1363106676.db2.gz NRUJFIOVAPDQTQ-HZPDHXFCSA-N 1 3 347.503 2.677 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C(C)(C)C)cc1)NC(=O)CC[NH+](C)C ZINC001401779407 1363119722 /nfs/dbraw/zinc/11/97/22/1363119722.db2.gz KNDNGAWWKPAEEL-INIZCTEOSA-N 1 3 333.520 2.872 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1C1CC1)NC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001401809007 1363159647 /nfs/dbraw/zinc/15/96/47/1363159647.db2.gz XCLXAEFVRLADEZ-IAGOWNOFSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1C1CC1)NC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001401809007 1363159649 /nfs/dbraw/zinc/15/96/49/1363159649.db2.gz XCLXAEFVRLADEZ-IAGOWNOFSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](F)CCN1CC[C@@H]1CNC(=O)CC[N@H+](C)C1CCCCC1 ZINC001401903105 1363228517 /nfs/dbraw/zinc/22/85/17/1363228517.db2.gz ZJJQQMDGDNJPKI-NVXWUHKLSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H](F)CCN1CC[C@@H]1CNC(=O)CC[N@@H+](C)C1CCCCC1 ZINC001401903105 1363228524 /nfs/dbraw/zinc/22/85/24/1363228524.db2.gz ZJJQQMDGDNJPKI-NVXWUHKLSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+][C@H](C)c2cccc(F)c2)CC1 ZINC001401945220 1363265701 /nfs/dbraw/zinc/26/57/01/1363265701.db2.gz SAUSKGVCQRIPCT-CRAIPNDOSA-N 1 3 347.478 2.998 10 0 EFAEHO CN(CC(=O)NCC1([NH2+]CC[C@@H]2CCCC2(F)F)CC1)C1CCC1 ZINC001401947228 1363267038 /nfs/dbraw/zinc/26/70/38/1363267038.db2.gz BOCOYQOZUPDSKC-AWEZNQCLSA-N 1 3 343.462 2.535 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001401965813 1363282822 /nfs/dbraw/zinc/28/28/22/1363282822.db2.gz BOWNWXNLFBNDGC-MSOLQXFVSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001401965813 1363282825 /nfs/dbraw/zinc/28/28/25/1363282825.db2.gz BOWNWXNLFBNDGC-MSOLQXFVSA-N 1 3 345.462 2.581 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C1(CNC(=O)CN2[C@H](C)CC[C@@H]2C)CC1 ZINC001401990080 1363307414 /nfs/dbraw/zinc/30/74/14/1363307414.db2.gz ZLNSGHMDZICAIA-HDICACEKSA-N 1 3 343.515 2.915 10 0 EFAEHO Cc1cc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)CC[NH+](C)C)cs1 ZINC001401991184 1363308455 /nfs/dbraw/zinc/30/84/55/1363308455.db2.gz GHLFVLFRIVTPQO-SJORKVTESA-N 1 3 335.517 2.574 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(C1)CC[NH+](CC1CC(C)C1)CC2 ZINC001402003024 1363320952 /nfs/dbraw/zinc/32/09/52/1363320952.db2.gz JCEQDSQHMCTNEN-UHFFFAOYSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CC=C(Cl)Cl)C[C@H]1C ZINC001402048283 1363357846 /nfs/dbraw/zinc/35/78/46/1363357846.db2.gz FVTYVORUPXKIOE-CHWSQXEVSA-N 1 3 336.307 2.615 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)cc1C ZINC001402070598 1363376223 /nfs/dbraw/zinc/37/62/23/1363376223.db2.gz FOLDFPLNMIABPM-LJQANCHMSA-N 1 3 331.504 2.724 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@@H]2CCCN([C@H]3CCc4ccccc43)C2)CC1 ZINC001402086265 1363390155 /nfs/dbraw/zinc/39/01/55/1363390155.db2.gz LETCRCCPEHPOFZ-MJGOQNOKSA-N 1 3 341.499 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@]2(CC[N@H+](CC3CCC3)C2)C1 ZINC001402118786 1363424720 /nfs/dbraw/zinc/42/47/20/1363424720.db2.gz WKMQBVXOJGGJSE-HXUWFJFHSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@]2(CC[N@@H+](CC3CCC3)C2)C1 ZINC001402118786 1363424725 /nfs/dbraw/zinc/42/47/25/1363424725.db2.gz WKMQBVXOJGGJSE-HXUWFJFHSA-N 1 3 335.536 2.831 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CC[C@H]2CC[C@@H](C1)N2C[C@@H](F)CC ZINC001402127441 1363433893 /nfs/dbraw/zinc/43/38/93/1363433893.db2.gz XICCSHQJCHIJQC-BBWFWOEESA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CC[C@H]2CC[C@@H](C1)N2C[C@@H](F)CC ZINC001402127441 1363433899 /nfs/dbraw/zinc/43/38/99/1363433899.db2.gz XICCSHQJCHIJQC-BBWFWOEESA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCN(CCc2cccs2)C1)[NH+](CC)CC ZINC001402188986 1363495467 /nfs/dbraw/zinc/49/54/67/1363495467.db2.gz VIXLQWNKVKGCAP-NVXWUHKLSA-N 1 3 337.533 2.602 10 0 EFAEHO CC[C@@H](F)C[NH+]1CCC(C)(CNC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001402197712 1363505577 /nfs/dbraw/zinc/50/55/77/1363505577.db2.gz BLRCWFQLPIZQFF-HZPDHXFCSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CCC2CCCC2)C1)N1CCCC1 ZINC001402225137 1363546172 /nfs/dbraw/zinc/54/61/72/1363546172.db2.gz FZQXWLVYNIBUKI-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CCC2CCCC2)C1)N1CCCC1 ZINC001402225137 1363546175 /nfs/dbraw/zinc/54/61/75/1363546175.db2.gz FZQXWLVYNIBUKI-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CC2CC(C)(C)C2)C1)N1CCCC1 ZINC001402235456 1363556479 /nfs/dbraw/zinc/55/64/79/1363556479.db2.gz RVKZLUDPMLLAIG-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CC2CC(C)(C)C2)C1)N1CCCC1 ZINC001402235456 1363556482 /nfs/dbraw/zinc/55/64/82/1363556482.db2.gz RVKZLUDPMLLAIG-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@@H](N[C@@H](CNC(=O)CC[NH+](C)C)C1CC1)c1ccccc1Cl ZINC001402331052 1363609181 /nfs/dbraw/zinc/60/91/81/1363609181.db2.gz BIKZTKFNFNQVME-DYVFJYSZSA-N 1 3 337.895 2.837 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)C1CC1 ZINC001402388182 1363646485 /nfs/dbraw/zinc/64/64/85/1363646485.db2.gz YUDRIZZKDDVTMT-MAUKXSAKSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)C1CC1 ZINC001402388182 1363646488 /nfs/dbraw/zinc/64/64/88/1363646488.db2.gz YUDRIZZKDDVTMT-MAUKXSAKSA-N 1 3 349.906 2.585 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([C@H](C)[NH2+]Cc2ccc(CF)cc2)C1 ZINC001402395067 1363653345 /nfs/dbraw/zinc/65/33/45/1363653345.db2.gz AIHYCSVOKOXXDC-QFBILLFUSA-N 1 3 349.494 2.823 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CC[C@H]3CCC[C@@H](C)C3)C[C@@H]2C1 ZINC001402428379 1363686919 /nfs/dbraw/zinc/68/69/19/1363686919.db2.gz DMADSHJZRXTPAK-WTGUMLROSA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CC[C@H]3CCC[C@@H](C)C3)C[C@@H]2C1 ZINC001402428379 1363686924 /nfs/dbraw/zinc/68/69/24/1363686924.db2.gz DMADSHJZRXTPAK-WTGUMLROSA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CC[C@H]3CCC[C@H](C)C3)C[C@@H]2C1 ZINC001402428380 1363687111 /nfs/dbraw/zinc/68/71/11/1363687111.db2.gz DMADSHJZRXTPAK-ZGXWSNOMSA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CC[C@H]3CCC[C@H](C)C3)C[C@@H]2C1 ZINC001402428380 1363687115 /nfs/dbraw/zinc/68/71/15/1363687115.db2.gz DMADSHJZRXTPAK-ZGXWSNOMSA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C2 ZINC001402434100 1363690311 /nfs/dbraw/zinc/69/03/11/1363690311.db2.gz FUESORKRKHZNMY-FCGDIQPGSA-N 1 3 337.552 2.978 10 0 EFAEHO CC(C)CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C2 ZINC001402434100 1363690313 /nfs/dbraw/zinc/69/03/13/1363690313.db2.gz FUESORKRKHZNMY-FCGDIQPGSA-N 1 3 337.552 2.978 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CC[C@H](NCc3ccsc3)C2)CCCCC1 ZINC001402446029 1363697930 /nfs/dbraw/zinc/69/79/30/1363697930.db2.gz QWIZNCCTCRVUEG-KRWDZBQOSA-N 1 3 349.544 2.951 10 0 EFAEHO CC[C@H](F)CN[C@H]1CCN(C(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001402449479 1363700507 /nfs/dbraw/zinc/70/05/07/1363700507.db2.gz XVEOSEJCDBKWMN-GJZGRUSLSA-N 1 3 327.488 2.578 10 0 EFAEHO CC[C@H](F)CN[C@H]1CCN(C(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001402449479 1363700511 /nfs/dbraw/zinc/70/05/11/1363700511.db2.gz XVEOSEJCDBKWMN-GJZGRUSLSA-N 1 3 327.488 2.578 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1csc(C)c1 ZINC001402484991 1363730589 /nfs/dbraw/zinc/73/05/89/1363730589.db2.gz ZGPGBORXRYEXKT-MSOLQXFVSA-N 1 3 349.544 2.964 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1csc(C)c1 ZINC001402484991 1363730593 /nfs/dbraw/zinc/73/05/93/1363730593.db2.gz ZGPGBORXRYEXKT-MSOLQXFVSA-N 1 3 349.544 2.964 10 0 EFAEHO CC[C@@H](F)CN1CCC2(CN(C(=O)CCC[NH+]3CCCC3)C2)CC1 ZINC001402495383 1363739155 /nfs/dbraw/zinc/73/91/55/1363739155.db2.gz MROWOTVOHFWPSP-QGZVFWFLSA-N 1 3 339.499 2.535 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCC[C@@H]1CNCc1ccccc1Cl ZINC001402527939 1363761964 /nfs/dbraw/zinc/76/19/64/1363761964.db2.gz FQBGPNATAGWFPW-MRXNPFEDSA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)c1cccc(CNC[C@H]2CCCCN2C(=O)CC[NH+](C)C)n1 ZINC001402529670 1363763380 /nfs/dbraw/zinc/76/33/80/1363763380.db2.gz UJCKFLSMNQQYDS-GOSISDBHSA-N 1 3 346.519 2.627 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)NCC2(NCc3ccsc3)CCC2)CC1 ZINC001402572314 1363799789 /nfs/dbraw/zinc/79/97/89/1363799789.db2.gz MEECCZFBLJADBH-UHFFFAOYSA-N 1 3 349.544 2.997 10 0 EFAEHO Cc1cc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCC2)c(C)s1 ZINC001402576251 1363803899 /nfs/dbraw/zinc/80/38/99/1363803899.db2.gz IZKLCCGDGQHNIK-UHFFFAOYSA-N 1 3 337.533 2.834 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+][C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)C1 ZINC001402606888 1363830314 /nfs/dbraw/zinc/83/03/14/1363830314.db2.gz YUHAOPQIDWXBFH-GASCZTMLSA-N 1 3 349.906 2.870 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[N@H+](CC2CC3(CCC3)C2)CC1 ZINC001402618604 1363842011 /nfs/dbraw/zinc/84/20/11/1363842011.db2.gz SNSIQRONFGSJBZ-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[N@@H+](CC2CC3(CCC3)C2)CC1 ZINC001402618604 1363842013 /nfs/dbraw/zinc/84/20/13/1363842013.db2.gz SNSIQRONFGSJBZ-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2cc(C)ccc2C)C1)N(C)C ZINC001402627621 1363854345 /nfs/dbraw/zinc/85/43/45/1363854345.db2.gz JNCLSVRQOSNZMF-VXNCWWDNSA-N 1 3 331.504 2.941 10 0 EFAEHO CN(CCCN(C)C(=O)C(C)(C)[NH+]1CCCC1)CCC(F)(F)F ZINC001402647798 1363882424 /nfs/dbraw/zinc/88/24/24/1363882424.db2.gz HSNMYUCUMYRHSD-UHFFFAOYSA-N 1 3 337.430 2.594 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@H+](C)CC1CCC(C)CC1)N(C)C ZINC001402652522 1363890772 /nfs/dbraw/zinc/89/07/72/1363890772.db2.gz GPGLTZYACPQHCC-ABHNRTSZSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@@H+](C)CC1CCC(C)CC1)N(C)C ZINC001402652522 1363890775 /nfs/dbraw/zinc/89/07/75/1363890775.db2.gz GPGLTZYACPQHCC-ABHNRTSZSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)C1CC[NH+](C(C)C)CC1 ZINC001402660441 1363902875 /nfs/dbraw/zinc/90/28/75/1363902875.db2.gz VFXXVICYMPTSOS-KRWDZBQOSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)N1Cc2ccc(CNC(=O)C(C)(C)[NH+]3CCCC3)cc2C1 ZINC001402750460 1363996796 /nfs/dbraw/zinc/99/67/96/1363996796.db2.gz SRKDOCWRVDVLQO-UHFFFAOYSA-N 1 3 329.488 2.901 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001402751114 1363998373 /nfs/dbraw/zinc/99/83/73/1363998373.db2.gz MLQUFODWGGVERI-LPHOPBHVSA-N 1 3 341.515 2.970 10 0 EFAEHO CCCC[N@H+]1CCCC[C@H]1CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001402751114 1363998376 /nfs/dbraw/zinc/99/83/76/1363998376.db2.gz MLQUFODWGGVERI-LPHOPBHVSA-N 1 3 341.515 2.970 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001402759608 1364007041 /nfs/dbraw/zinc/00/70/41/1364007041.db2.gz TWQIZRCDVFVHMO-CVEARBPZSA-N 1 3 345.478 2.734 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001402777619 1364025054 /nfs/dbraw/zinc/02/50/54/1364025054.db2.gz XHSXSZNFAFVWNA-QFBILLFUSA-N 1 3 331.504 2.526 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N(C)CCNC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001437454381 1387657476 /nfs/dbraw/zinc/65/74/76/1387657476.db2.gz AVVLUGLSDLQUKT-RBUKOAKNSA-N 1 3 347.478 2.667 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@@H](C)CCNC(=O)C2(N(C)C)CCC2)c1 ZINC001402821166 1364068641 /nfs/dbraw/zinc/06/86/41/1364068641.db2.gz ABKHYDKJEIEXIY-HOTGVXAUSA-N 1 3 347.503 2.725 10 0 EFAEHO Cc1cc(C[NH2+]C2CCC(NC(=O)CN(C)C(C)C)CC2)cs1 ZINC001402828947 1364075987 /nfs/dbraw/zinc/07/59/87/1364075987.db2.gz MNZMEWYCVUTNOS-UHFFFAOYSA-N 1 3 337.533 2.914 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC1CCC([NH2+]C/C=C\Cl)CC1 ZINC001402835798 1364081314 /nfs/dbraw/zinc/08/13/14/1364081314.db2.gz SQJSRVAMJOZEHV-OPLYECJVSA-N 1 3 327.900 2.629 10 0 EFAEHO CCc1cccc(C[NH2+]CC2CC(NC(=O)[C@H](CC)N(C)C)C2)c1 ZINC001402955002 1364160200 /nfs/dbraw/zinc/16/02/00/1364160200.db2.gz WZDSHPFJMWTKIP-ACBHZAAOSA-N 1 3 331.504 2.574 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@@H](C)c2cccc(F)c2)CC[N@@H+]1C ZINC001437462646 1387666786 /nfs/dbraw/zinc/66/67/86/1387666786.db2.gz ITUKSWKNXYWCQJ-JCGIZDLHSA-N 1 3 335.467 2.665 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@@H](C)c2cccc(F)c2)CC[N@H+]1C ZINC001437462646 1387666793 /nfs/dbraw/zinc/66/67/93/1387666793.db2.gz ITUKSWKNXYWCQJ-JCGIZDLHSA-N 1 3 335.467 2.665 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001402989933 1364186997 /nfs/dbraw/zinc/18/69/97/1364186997.db2.gz AWOPVUCPMLVPPT-HZPDHXFCSA-N 1 3 329.488 2.500 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H](C)[NH2+]CCc1ccc(Cl)cc1 ZINC001403003563 1364201705 /nfs/dbraw/zinc/20/17/05/1364201705.db2.gz IZPVGHLFOHSCRO-QWHCGFSZSA-N 1 3 348.878 2.640 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)CNC(=O)[C@H](C)N2CCCCCC2)cc1 ZINC001403040315 1364244163 /nfs/dbraw/zinc/24/41/63/1364244163.db2.gz BGYRHXBJQKUPAE-OALUTQOASA-N 1 3 345.531 2.896 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C(C)C)c(C)s1 ZINC001403059936 1364264340 /nfs/dbraw/zinc/26/43/40/1364264340.db2.gz ZOVUTIAWEGNAGX-KBPBESRZSA-N 1 3 325.522 2.688 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)[C@H](C)NC(=O)CC[NH+](C)C ZINC001403066358 1364270299 /nfs/dbraw/zinc/27/02/99/1364270299.db2.gz WEMLYBHQBURBIJ-KBPBESRZSA-N 1 3 325.884 2.583 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)[C@@H](C)NC(=O)CC[NH+](C)C ZINC001403066383 1364270487 /nfs/dbraw/zinc/27/04/87/1364270487.db2.gz WEMLYBHQBURBIJ-UONOGXRCSA-N 1 3 325.884 2.583 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)CNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001403083910 1364287677 /nfs/dbraw/zinc/28/76/77/1364287677.db2.gz NXBZPXAPMZVGTN-HUUCEWRRSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)CNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001403083910 1364287681 /nfs/dbraw/zinc/28/76/81/1364287681.db2.gz NXBZPXAPMZVGTN-HUUCEWRRSA-N 1 3 337.895 2.585 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[N@H+](C)CC1CCC2(CC2)CC1 ZINC001403138678 1364354661 /nfs/dbraw/zinc/35/46/61/1364354661.db2.gz PBGGUVPGGVYYHM-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001403138678 1364354664 /nfs/dbraw/zinc/35/46/64/1364354664.db2.gz PBGGUVPGGVYYHM-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO CCc1ccc(C[NH2+][C@H]2CCN(C(=O)[C@@H](F)CN(CC)CC)C2)cc1 ZINC001403167602 1364388074 /nfs/dbraw/zinc/38/80/74/1364388074.db2.gz LEAPGXXYHQDLHU-OALUTQOASA-N 1 3 349.494 2.619 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]([NH2+]CCc2ccccc2F)C1 ZINC001403265898 1364478804 /nfs/dbraw/zinc/47/88/04/1364478804.db2.gz BODJBWLFIKQEJL-MSOLQXFVSA-N 1 3 349.494 2.725 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]CC2CCC(F)(F)CC2)C1 ZINC001403271859 1364485411 /nfs/dbraw/zinc/48/54/11/1364485411.db2.gz WSIFSCPWYIPOSH-MRXNPFEDSA-N 1 3 345.478 2.590 10 0 EFAEHO CCc1cccc(CN2CC([C@@H](C)NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c1 ZINC001403321552 1364538908 /nfs/dbraw/zinc/53/89/08/1364538908.db2.gz GTECKDQXFOTWPT-APWZRJJASA-N 1 3 343.515 2.527 10 0 EFAEHO CCc1cccc(CN2CC([C@@H](C)NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c1 ZINC001403321552 1364538911 /nfs/dbraw/zinc/53/89/11/1364538911.db2.gz GTECKDQXFOTWPT-APWZRJJASA-N 1 3 343.515 2.527 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1C[N@H+](CCC(C)C)CC1(C)C)N(CC)CC ZINC001403381749 1364590554 /nfs/dbraw/zinc/59/05/54/1364590554.db2.gz KVHPEBSBSRSQEI-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1C[N@@H+](CCC(C)C)CC1(C)C)N(CC)CC ZINC001403381749 1364590556 /nfs/dbraw/zinc/59/05/56/1364590556.db2.gz KVHPEBSBSRSQEI-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001403432747 1364636658 /nfs/dbraw/zinc/63/66/58/1364636658.db2.gz ZXQRZBQDBSDFPT-MKXGPGLRSA-N 1 3 349.563 2.837 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001403432747 1364636662 /nfs/dbraw/zinc/63/66/62/1364636662.db2.gz ZXQRZBQDBSDFPT-MKXGPGLRSA-N 1 3 349.563 2.837 10 0 EFAEHO CC(C)[C@@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+]Cc1ccccc1 ZINC001403496240 1364704204 /nfs/dbraw/zinc/70/42/04/1364704204.db2.gz QLZVRHQBRKKNSH-GOSISDBHSA-N 1 3 331.504 2.791 10 0 EFAEHO CN(CC(=O)NCC[N@H+](C)CC[C@@H]1CCCC1(F)F)CC(C)(C)C ZINC001403683141 1364861397 /nfs/dbraw/zinc/86/13/97/1364861397.db2.gz GUBOJXMJFWGNLG-HNNXBMFYSA-N 1 3 347.494 2.838 10 0 EFAEHO CN(CC(=O)NCC[N@@H+](C)CC[C@@H]1CCCC1(F)F)CC(C)(C)C ZINC001403683141 1364861403 /nfs/dbraw/zinc/86/14/03/1364861403.db2.gz GUBOJXMJFWGNLG-HNNXBMFYSA-N 1 3 347.494 2.838 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]Cc2ccsc2)CN1C(=O)CN(C)CC(C)(C)C ZINC001403730991 1364889497 /nfs/dbraw/zinc/88/94/97/1364889497.db2.gz DAZVGACSVXQIRL-HOCLYGCPSA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CC2CCC3(CC3)CC2)[C@H]1C ZINC001403745268 1364897514 /nfs/dbraw/zinc/89/75/14/1364897514.db2.gz JDUAZUQJVHDBEY-AEFFLSMTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CC2CCC3(CC3)CC2)[C@@H]1C ZINC001403745271 1364898306 /nfs/dbraw/zinc/89/83/06/1364898306.db2.gz JDUAZUQJVHDBEY-FUHWJXTLSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@@H](NCc2cccc(C(C)C)n2)[C@@H]1C ZINC001403780501 1364931653 /nfs/dbraw/zinc/93/16/53/1364931653.db2.gz XOTDVPIJPPNVQM-QFBILLFUSA-N 1 3 346.519 2.626 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@@H](NCc2cccc(C(C)C)n2)[C@@H]1C ZINC001403780501 1364931656 /nfs/dbraw/zinc/93/16/56/1364931656.db2.gz XOTDVPIJPPNVQM-QFBILLFUSA-N 1 3 346.519 2.626 10 0 EFAEHO CCC(CC)C[NH2+][C@@H]1CN(C(=O)[C@H](C(C)C)N(C)C)CC1(C)C ZINC001403816146 1364972175 /nfs/dbraw/zinc/97/21/75/1364972175.db2.gz GWDLZTJKOLSTSO-SJORKVTESA-N 1 3 325.541 2.835 10 0 EFAEHO CCN(CCNC(=O)[C@H]1C[NH+]2CCC1CC2)Cc1ccc(Cl)cc1 ZINC001403848360 1364993943 /nfs/dbraw/zinc/99/39/43/1364993943.db2.gz HQINXCSFTZNMIJ-SFHVURJKSA-N 1 3 349.906 2.620 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1C[NH+]2CCC1CC2)Cc1ccc(Cl)cc1 ZINC001403848357 1364994606 /nfs/dbraw/zinc/99/46/06/1364994606.db2.gz HQINXCSFTZNMIJ-GOSISDBHSA-N 1 3 349.906 2.620 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)[C@@H](C)c1ccc(F)cc1 ZINC001403926237 1365050879 /nfs/dbraw/zinc/05/08/79/1365050879.db2.gz RIWKRFBFRUVXQX-HOTGVXAUSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)[C@@H](C)c1ccc(F)cc1 ZINC001403926237 1365050884 /nfs/dbraw/zinc/05/08/84/1365050884.db2.gz RIWKRFBFRUVXQX-HOTGVXAUSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)[C@@H](C)c1ccc(F)cc1 ZINC001403926243 1365051051 /nfs/dbraw/zinc/05/10/51/1365051051.db2.gz RIWKRFBFRUVXQX-JKSUJKDBSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)[C@@H](C)c1ccc(F)cc1 ZINC001403926243 1365051055 /nfs/dbraw/zinc/05/10/55/1365051055.db2.gz RIWKRFBFRUVXQX-JKSUJKDBSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC001403970241 1365117000 /nfs/dbraw/zinc/11/70/00/1365117000.db2.gz BOSWWJAHBZOJEG-QGZVFWFLSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](NC(=O)CC[NH+](C)C)C(C)(C)C)n1 ZINC001403976097 1365123461 /nfs/dbraw/zinc/12/34/61/1365123461.db2.gz AHNLTILETZDFEW-SFHVURJKSA-N 1 3 348.535 2.777 10 0 EFAEHO CC[C@@H](F)CN1CCC([C@H](C)NC(=O)[C@@H](C(C)C)[NH+](C)C)CC1 ZINC001403993550 1365144219 /nfs/dbraw/zinc/14/42/19/1365144219.db2.gz GIUDRQFDPAPCAE-USXIJHARSA-N 1 3 329.504 2.537 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C1CC[NH+](CCc2ccccc2)CC1)N(C)C ZINC001404002038 1365154630 /nfs/dbraw/zinc/15/46/30/1365154630.db2.gz FKYTXPDUEUTTQQ-PXNSSMCTSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]Cc2ccccc2C2CC2)C1 ZINC001404012283 1365165950 /nfs/dbraw/zinc/16/59/50/1365165950.db2.gz AJINKXXWBLCGCC-UHFFFAOYSA-N 1 3 343.515 2.983 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@H+](Cc2ccc(C3CC3)cc2)C1 ZINC001404065906 1365223827 /nfs/dbraw/zinc/22/38/27/1365223827.db2.gz BNLJATRCZZUFEH-SFHVURJKSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@@H+](Cc2ccc(C3CC3)cc2)C1 ZINC001404065906 1365223829 /nfs/dbraw/zinc/22/38/29/1365223829.db2.gz BNLJATRCZZUFEH-SFHVURJKSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC001404090250 1365250297 /nfs/dbraw/zinc/25/02/97/1365250297.db2.gz ULGJPWJGNCSPLB-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC001404090250 1365250303 /nfs/dbraw/zinc/25/03/03/1365250303.db2.gz ULGJPWJGNCSPLB-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2F)C1 ZINC001404106781 1365266666 /nfs/dbraw/zinc/26/66/66/1365266666.db2.gz RVASMVVNAWEKIQ-CVEARBPZSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+]([C@H](C)c2ccccc2F)C1 ZINC001404106781 1365266669 /nfs/dbraw/zinc/26/66/69/1365266669.db2.gz RVASMVVNAWEKIQ-CVEARBPZSA-N 1 3 335.467 2.665 10 0 EFAEHO Cc1ccccc1CN(CCNC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C)C1CC1 ZINC001404297012 1365436018 /nfs/dbraw/zinc/43/60/18/1365436018.db2.gz MDNFLUBYXLMPNY-HDICACEKSA-N 1 3 343.515 2.948 10 0 EFAEHO Cc1ccccc1CN(CCNC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C)C1CC1 ZINC001404297012 1365436022 /nfs/dbraw/zinc/43/60/22/1365436022.db2.gz MDNFLUBYXLMPNY-HDICACEKSA-N 1 3 343.515 2.948 10 0 EFAEHO CCCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@@H+](C(C)C)C1 ZINC001404435401 1365538946 /nfs/dbraw/zinc/53/89/46/1365538946.db2.gz YJELIWUXIMQNDA-VQIMIIECSA-N 1 3 341.515 2.920 10 0 EFAEHO CCCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@H+](C(C)C)C1 ZINC001404435401 1365538949 /nfs/dbraw/zinc/53/89/49/1365538949.db2.gz YJELIWUXIMQNDA-VQIMIIECSA-N 1 3 341.515 2.920 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001404673617 1365757589 /nfs/dbraw/zinc/75/75/89/1365757589.db2.gz UPSTXOGHUKZEHY-IAGOWNOFSA-N 1 3 341.515 2.683 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001404673617 1365757592 /nfs/dbraw/zinc/75/75/92/1365757592.db2.gz UPSTXOGHUKZEHY-IAGOWNOFSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[C@H](C(=O)NCC1CN([C@@H]2CCc3ccccc32)C1)[NH+](CC)CC ZINC001404907877 1365899226 /nfs/dbraw/zinc/89/92/26/1365899226.db2.gz OMSCEHMSLJLIQY-WOJBJXKFSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)(C)CCCN1C[C@@H]2C[C@H]1CN2C(=O)C12CCC[NH+](CCC1)C2 ZINC001404961515 1365938182 /nfs/dbraw/zinc/93/81/82/1365938182.db2.gz OKQZYQJATPDVAH-ROUUACIJSA-N 1 3 347.547 2.974 10 0 EFAEHO CCc1ccc(CN2CC[C@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)cc1 ZINC001405001669 1365962645 /nfs/dbraw/zinc/96/26/45/1365962645.db2.gz WMYLSDBHHZLYKK-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccc(CN2CC[C@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)cc1 ZINC001405001669 1365962648 /nfs/dbraw/zinc/96/26/48/1365962648.db2.gz WMYLSDBHHZLYKK-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc(C)cc1 ZINC001405281907 1366131707 /nfs/dbraw/zinc/13/17/07/1366131707.db2.gz WSGOCYGVVCBQLL-SFHVURJKSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@H](CNC(=O)C12CC[NH+](CC1)C2)NCc1c(C)cccc1Cl ZINC001405332183 1366149368 /nfs/dbraw/zinc/14/93/68/1366149368.db2.gz HKYCWEOJRKEGSG-OAHLLOKOSA-N 1 3 349.906 2.729 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)NCc1cccc(C(C)C)n1 ZINC001405333363 1366149448 /nfs/dbraw/zinc/14/94/48/1366149448.db2.gz IADJSUYBUNNWMJ-IRXDYDNUSA-N 1 3 346.519 2.531 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)NCc1cccc(C(C)C)n1 ZINC001405333363 1366149449 /nfs/dbraw/zinc/14/94/49/1366149449.db2.gz IADJSUYBUNNWMJ-IRXDYDNUSA-N 1 3 346.519 2.531 10 0 EFAEHO CC[C@H](C(=O)N[C@](C)(C[NH2+]Cc1ccc(C)c(F)c1)C1CC1)N(C)C ZINC001405451479 1366209017 /nfs/dbraw/zinc/20/90/17/1366209017.db2.gz YYZVTFHIZQARKJ-UYAOXDASSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@](C)(C[NH2+]Cc1cccc(F)c1)C1CC1 ZINC001405471078 1366222336 /nfs/dbraw/zinc/22/23/36/1366222336.db2.gz FWZYTJZIEBCXDP-LJQANCHMSA-N 1 3 335.467 2.540 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCc1ccc(C[NH2+]CC2CC2)cc1 ZINC001405538300 1366278425 /nfs/dbraw/zinc/27/84/25/1366278425.db2.gz FOZPQBBJSSQOKY-HOTGVXAUSA-N 1 3 329.488 2.675 10 0 EFAEHO C[C@@H](F)CC[NH+]1CCC(CCNC(=O)CN(C)CC(C)(C)C)CC1 ZINC001405558053 1366293242 /nfs/dbraw/zinc/29/32/42/1366293242.db2.gz QQIGXIVSGMZJGV-MRXNPFEDSA-N 1 3 343.531 2.931 10 0 EFAEHO CC[C@H](C(=O)NCCC1CC[NH+](Cc2ccsc2)CC1)N(C)C ZINC001405569456 1366302297 /nfs/dbraw/zinc/30/22/97/1366302297.db2.gz VBBBIZQXZXKMTJ-QGZVFWFLSA-N 1 3 337.533 2.807 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1([NH2+]CC2CC3(CCC3)C2)CCCC1 ZINC001405786426 1366414397 /nfs/dbraw/zinc/41/43/97/1366414397.db2.gz RDOVEHDJOLBXQA-UHFFFAOYSA-N 1 3 344.503 2.860 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CC2CC3(CCC3)C2)[C@@H](C)C1 ZINC001405967865 1367022474 /nfs/dbraw/zinc/02/24/74/1367022474.db2.gz KJKZPLBSVKGRIS-FUHWJXTLSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]C/C=C/Cl ZINC001406035007 1367122234 /nfs/dbraw/zinc/12/22/34/1367122234.db2.gz CSQUEXTVPNMZPK-LRPCFIKCSA-N 1 3 347.906 2.682 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]C/C=C\Cl ZINC001406034988 1367122712 /nfs/dbraw/zinc/12/27/12/1367122712.db2.gz CSQUEXTVPNMZPK-HFNVYPAOSA-N 1 3 347.906 2.682 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]Cc1ccccn1 ZINC001406054091 1367153608 /nfs/dbraw/zinc/15/36/08/1367153608.db2.gz YEUWTVUYBFSTTH-MOPGFXCFSA-N 1 3 346.519 2.575 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]([NH2+]CC1CC2(CCC2)C1)C(C)C ZINC001406075063 1367185568 /nfs/dbraw/zinc/18/55/68/1367185568.db2.gz YQWSUVPDSZVROD-QGZVFWFLSA-N 1 3 332.492 2.571 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[N@H+](C)[C@H]2CCc3ccccc32)CC1 ZINC001406148377 1367319710 /nfs/dbraw/zinc/31/97/10/1367319710.db2.gz PVFOOZOASJWXGJ-FQEVSTJZSA-N 1 3 343.515 2.796 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[N@@H+](C)[C@H]2CCc3ccccc32)CC1 ZINC001406148377 1367319715 /nfs/dbraw/zinc/31/97/15/1367319715.db2.gz PVFOOZOASJWXGJ-FQEVSTJZSA-N 1 3 343.515 2.796 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001406167825 1367356587 /nfs/dbraw/zinc/35/65/87/1367356587.db2.gz BRDCRYLFTGRCOA-HNNXBMFYSA-N 1 3 333.467 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001406167825 1367356594 /nfs/dbraw/zinc/35/65/94/1367356594.db2.gz BRDCRYLFTGRCOA-HNNXBMFYSA-N 1 3 333.467 2.542 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@H]3CN(C(=O)CN(C)C(C)C)CC[C@H]32)cs1 ZINC001406178196 1367374836 /nfs/dbraw/zinc/37/48/36/1367374836.db2.gz HFNSKXSKDLDTCB-ZWKOTPCHSA-N 1 3 349.544 2.820 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@H]3CN(C(=O)CN(C)C(C)C)CC[C@H]32)cs1 ZINC001406178196 1367374844 /nfs/dbraw/zinc/37/48/44/1367374844.db2.gz HFNSKXSKDLDTCB-ZWKOTPCHSA-N 1 3 349.544 2.820 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CCC[C@H]2NC(=O)CN(C)C(C)C)cc1F ZINC001406181125 1367378279 /nfs/dbraw/zinc/37/82/79/1367378279.db2.gz ATNWUUVDHOFBNJ-PKOBYXMFSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]Cc1ccc(CF)cc1 ZINC001406203539 1367399872 /nfs/dbraw/zinc/39/98/72/1367399872.db2.gz RMJCRDIWNARQAK-RBUKOAKNSA-N 1 3 349.494 2.871 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1ccccc1Cl ZINC001406360927 1367522937 /nfs/dbraw/zinc/52/29/37/1367522937.db2.gz FWSVKRBIMZLAQK-RHSMWYFYSA-N 1 3 337.895 2.809 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1ccccc1Cl ZINC001406360927 1367522941 /nfs/dbraw/zinc/52/29/41/1367522941.db2.gz FWSVKRBIMZLAQK-RHSMWYFYSA-N 1 3 337.895 2.809 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CNCc2sccc2Cl)CC[N@@H+]1C ZINC001406364159 1367525051 /nfs/dbraw/zinc/52/50/51/1367525051.db2.gz XNQCWAOQORVEMY-MBNYWOFBSA-N 1 3 343.924 2.726 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CNCc2sccc2Cl)CC[N@H+]1C ZINC001406364159 1367525058 /nfs/dbraw/zinc/52/50/58/1367525058.db2.gz XNQCWAOQORVEMY-MBNYWOFBSA-N 1 3 343.924 2.726 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1cc2ccccc2o1 ZINC001406463639 1367617185 /nfs/dbraw/zinc/61/71/85/1367617185.db2.gz BNALZIQUPGHRQV-YJBOKZPZSA-N 1 3 343.471 2.900 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1cc2ccccc2o1 ZINC001406463639 1367617190 /nfs/dbraw/zinc/61/71/90/1367617190.db2.gz BNALZIQUPGHRQV-YJBOKZPZSA-N 1 3 343.471 2.900 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001406496484 1367650096 /nfs/dbraw/zinc/65/00/96/1367650096.db2.gz OQDODJWOHQRKAS-GOEBONIOSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001406496484 1367650097 /nfs/dbraw/zinc/65/00/97/1367650097.db2.gz OQDODJWOHQRKAS-GOEBONIOSA-N 1 3 337.895 2.809 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)CC1CCC(C)(C)CC1)N(C)C ZINC001406633732 1367837780 /nfs/dbraw/zinc/83/77/80/1367837780.db2.gz XDDXTCXYEBKWEO-DOTOQJQBSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)CC1CCC(C)(C)CC1)N(C)C ZINC001406633732 1367837786 /nfs/dbraw/zinc/83/77/86/1367837786.db2.gz XDDXTCXYEBKWEO-DOTOQJQBSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H](C[N@H+](C)C[C@@H]1CCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001406667690 1367893175 /nfs/dbraw/zinc/89/31/75/1367893175.db2.gz LCRJYGFKOSTYLK-HUUCEWRRSA-N 1 3 347.494 2.836 10 0 EFAEHO C[C@H](C[N@@H+](C)C[C@@H]1CCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001406667690 1367893179 /nfs/dbraw/zinc/89/31/79/1367893179.db2.gz LCRJYGFKOSTYLK-HUUCEWRRSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN2CCCC2)CC[C@@H]1[NH2+]C/C(Cl)=C\Cl ZINC001406806494 1368078962 /nfs/dbraw/zinc/07/89/62/1368078962.db2.gz KMIOHNGNAPEFMZ-KAJHTXMWSA-N 1 3 348.318 2.618 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@H]1CC[N@@H+]1CC1CCCCCC1 ZINC001406836865 1368111379 /nfs/dbraw/zinc/11/13/79/1368111379.db2.gz 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CCc1cccc(CNC2(CNC(=O)[C@H]3CC[N@H+](C)[C@@H]3CC)CC2)c1 ZINC001406936760 1368228232 /nfs/dbraw/zinc/22/82/32/1368228232.db2.gz PRJXGDDUGRZIPQ-RBUKOAKNSA-N 1 3 343.515 2.718 10 0 EFAEHO CCc1cccc(CNC2(CNC(=O)[C@H]3CC[N@@H+](C)[C@@H]3CC)CC2)c1 ZINC001406936760 1368228237 /nfs/dbraw/zinc/22/82/37/1368228237.db2.gz PRJXGDDUGRZIPQ-RBUKOAKNSA-N 1 3 343.515 2.718 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C1(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001406941597 1368233125 /nfs/dbraw/zinc/23/31/25/1368233125.db2.gz IBMXHYAEBBOGRL-INIZCTEOSA-N 1 3 329.488 2.779 10 0 EFAEHO CCc1ccc(C[NH2+]C2(CNC(=O)C(C)(C)N3CCCC3)CC2)cc1 ZINC001406956391 1368244971 /nfs/dbraw/zinc/24/49/71/1368244971.db2.gz OVFXUAABSGDNEC-UHFFFAOYSA-N 1 3 343.515 2.862 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CC[N@H+](C/C=C\Cl)C2)CC1 ZINC001407001895 1368305989 /nfs/dbraw/zinc/30/59/89/1368305989.db2.gz MXVINSSTWHCYOK-LYLYKKCESA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CC[N@@H+](C/C=C\Cl)C2)CC1 ZINC001407001895 1368306002 /nfs/dbraw/zinc/30/60/02/1368306002.db2.gz MXVINSSTWHCYOK-LYLYKKCESA-N 1 3 341.927 2.640 10 0 EFAEHO Cc1cccc(C[NH2+]C2(CNC(=O)CN3[C@@H](C)CC[C@@H]3C)CC2)c1 ZINC001407010243 1368318521 /nfs/dbraw/zinc/31/85/21/1368318521.db2.gz RPYPHIHYRRUTFK-IRXDYDNUSA-N 1 3 329.488 2.606 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2ccc(C3CC3)cc2)CC1 ZINC001407013323 1368323682 /nfs/dbraw/zinc/32/36/82/1368323682.db2.gz YJKBOKJTMBZODB-UHFFFAOYSA-N 1 3 329.488 2.643 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@@]3(CCN(C(=O)CN(C)C(C)C)C3)C2)c1 ZINC001407035459 1368359674 /nfs/dbraw/zinc/35/96/74/1368359674.db2.gz HCZKBIUWQNCVGL-OAQYLSRUSA-N 1 3 343.515 2.760 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@@]3(CCN(C(=O)CN(C)C(C)C)C3)C2)c1 ZINC001407035459 1368359679 /nfs/dbraw/zinc/35/96/79/1368359679.db2.gz HCZKBIUWQNCVGL-OAQYLSRUSA-N 1 3 343.515 2.760 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]C/C=C\c2ccccc2)CCN1C(=O)CN1CCCC1 ZINC001407082281 1368405720 /nfs/dbraw/zinc/40/57/20/1368405720.db2.gz FXJSIUULVIUZPQ-JZYQWKAOSA-N 1 3 341.499 2.765 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10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)C1CCC1 ZINC001407485318 1368902130 /nfs/dbraw/zinc/90/21/30/1368902130.db2.gz ZXSBFEOFOGXTRC-BJLQDIEVSA-N 1 3 341.499 2.640 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC(C)C1)N(C)C ZINC001407528147 1368942479 /nfs/dbraw/zinc/94/24/79/1368942479.db2.gz HYWJUXMPNDOFTF-NIXGDYPTSA-N 1 3 335.536 2.732 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC(C)C1)N(C)C ZINC001407528147 1368942482 /nfs/dbraw/zinc/94/24/82/1368942482.db2.gz HYWJUXMPNDOFTF-NIXGDYPTSA-N 1 3 335.536 2.732 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2ccc(CF)cc2)C1 ZINC001407531026 1368944487 /nfs/dbraw/zinc/94/44/87/1368944487.db2.gz HISALESVEAOZPB-QFBILLFUSA-N 1 3 349.494 2.682 10 0 EFAEHO C[C@@H]([NH2+]CCC1CCCCC1)[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001407535428 1368953641 /nfs/dbraw/zinc/95/36/41/1368953641.db2.gz GLGJLVRGDJBGAM-IEBWSBKVSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@H]2CN(C(=O)CN3CCC(C)CC3)C[C@H]2C1 ZINC001407573592 1369003319 /nfs/dbraw/zinc/00/33/19/1369003319.db2.gz UIUSVERLDBJGDL-KDURUIRLSA-N 1 3 335.536 2.545 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@H]2CN(C(=O)CN3CCC(C)CC3)C[C@H]2C1 ZINC001407573592 1369003321 /nfs/dbraw/zinc/00/33/21/1369003321.db2.gz UIUSVERLDBJGDL-KDURUIRLSA-N 1 3 335.536 2.545 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC2(C1)CCN(Cc1cccc(Cl)c1)CC2 ZINC001407722965 1369162144 /nfs/dbraw/zinc/16/21/44/1369162144.db2.gz WNIANCCKGVQGPO-UHFFFAOYSA-N 1 3 349.906 2.716 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C1CCC1)C[C@@H]1CCCC(F)(F)C1 ZINC001492967166 1369176709 /nfs/dbraw/zinc/17/67/09/1369176709.db2.gz GUFIJEJGRYFGCB-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C1CCC1)C[C@@H]1CCCC(F)(F)C1 ZINC001492967166 1369176714 /nfs/dbraw/zinc/17/67/14/1369176714.db2.gz GUFIJEJGRYFGCB-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)CC[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CCC1 ZINC001407795058 1369242089 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CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)Cc1cccc(Cl)c1 ZINC001407957060 1369461749 /nfs/dbraw/zinc/46/17/49/1369461749.db2.gz RYNZZKBXKMKPRA-UHFFFAOYSA-N 1 3 339.911 2.961 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(CC)CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001407977959 1369486104 /nfs/dbraw/zinc/48/61/04/1369486104.db2.gz FEGLVNOZZWJGED-JKSUJKDBSA-N 1 3 329.504 2.682 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@@H]1Cc2ccccc2CN1CC[C@@H](C)F ZINC001408006488 1369520903 /nfs/dbraw/zinc/52/09/03/1369520903.db2.gz LHMCIXFLOFAAEU-APWZRJJASA-N 1 3 349.494 2.619 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@@H]1Cc2ccccc2CN1CC[C@@H](C)F ZINC001408006488 1369520909 /nfs/dbraw/zinc/52/09/09/1369520909.db2.gz LHMCIXFLOFAAEU-APWZRJJASA-N 1 3 349.494 2.619 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@@H]1Cc2ccccc2CN1CC[C@H](C)F ZINC001408006511 1369521397 /nfs/dbraw/zinc/52/13/97/1369521397.db2.gz LHMCIXFLOFAAEU-LPHOPBHVSA-N 1 3 349.494 2.619 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@@H]1Cc2ccccc2CN1CC[C@H](C)F ZINC001408006511 1369521400 /nfs/dbraw/zinc/52/14/00/1369521400.db2.gz LHMCIXFLOFAAEU-LPHOPBHVSA-N 1 3 349.494 2.619 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]CCC(F)(F)F ZINC001408228348 1369731792 /nfs/dbraw/zinc/73/17/92/1369731792.db2.gz HPKJNWRZXBAOIU-KBPBESRZSA-N 1 3 337.430 2.686 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@H]1C[N@H+](C)CCC1CC1 ZINC001408357889 1369870279 /nfs/dbraw/zinc/87/02/79/1369870279.db2.gz SJUJJRBGFXIDQG-OALUTQOASA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@H]1C[N@@H+](C)CCC1CC1 ZINC001408357889 1369870283 /nfs/dbraw/zinc/87/02/83/1369870283.db2.gz SJUJJRBGFXIDQG-OALUTQOASA-N 1 3 335.536 2.972 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1CC[C@H](C)C1)C[C@@H]1CCC(F)(F)C1 ZINC001437763048 1388034459 /nfs/dbraw/zinc/03/44/59/1388034459.db2.gz WQTUBHKPXMDHQR-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1CC[C@H](C)C1)C[C@@H]1CCC(F)(F)C1 ZINC001437763048 1388034467 /nfs/dbraw/zinc/03/44/67/1388034467.db2.gz WQTUBHKPXMDHQR-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1CC[C@@H](C)C1)C[C@@H]1CCC(F)(F)C1 ZINC001437763038 1388035828 /nfs/dbraw/zinc/03/58/28/1388035828.db2.gz WQTUBHKPXMDHQR-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1CC[C@@H](C)C1)C[C@@H]1CCC(F)(F)C1 ZINC001437763038 1388035837 /nfs/dbraw/zinc/03/58/37/1388035837.db2.gz WQTUBHKPXMDHQR-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(CCNC(=O)CC1CC[NH+](C)CC1)Cc1ccsc1 ZINC001437766740 1388039658 /nfs/dbraw/zinc/03/96/58/1388039658.db2.gz WLQAMVVYUOUIFL-UHFFFAOYSA-N 1 3 337.533 2.808 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+][C@@H](C)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001437850630 1388140701 /nfs/dbraw/zinc/14/07/01/1388140701.db2.gz DHEJATFXJWMDRS-MSOLQXFVSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)N3CCN(CC4CCCCC4)CC3)C[N@@H+]2C1 ZINC001417621428 1373100602 /nfs/dbraw/zinc/10/06/02/1373100602.db2.gz KLXBZHLINMXBMT-RLLQIKCJSA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)N3CCN(CC4CCCCC4)CC3)C[N@H+]2C1 ZINC001417621428 1373100606 /nfs/dbraw/zinc/10/06/06/1373100606.db2.gz KLXBZHLINMXBMT-RLLQIKCJSA-N 1 3 347.547 2.831 10 0 EFAEHO Cc1cccc(CN(CCN(C)C)C(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)c1 ZINC001417633016 1373109997 /nfs/dbraw/zinc/10/99/97/1373109997.db2.gz VOGLAROUIBWPST-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN(CCN(C)C)C(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)c1 ZINC001417633016 1373110002 /nfs/dbraw/zinc/11/00/02/1373110002.db2.gz VOGLAROUIBWPST-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001417646247 1373120122 /nfs/dbraw/zinc/12/01/22/1373120122.db2.gz AJWPAJHDRWTELQ-SLFFLAALSA-N 1 3 341.499 2.784 10 0 EFAEHO O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001417646247 1373120126 /nfs/dbraw/zinc/12/01/26/1373120126.db2.gz AJWPAJHDRWTELQ-SLFFLAALSA-N 1 3 341.499 2.784 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)CN1Cc1ccccc1 ZINC001417670675 1373141627 /nfs/dbraw/zinc/14/16/27/1373141627.db2.gz CAMFTHYUXISDJW-GSEOLPGOSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)CN1Cc1ccccc1 ZINC001417670675 1373141636 /nfs/dbraw/zinc/14/16/36/1373141636.db2.gz CAMFTHYUXISDJW-GSEOLPGOSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@@H]2CC[N@H+](CC3CC(C)(C)C3)C2)C1 ZINC001437935775 1388246831 /nfs/dbraw/zinc/24/68/31/1388246831.db2.gz CTYLBXOFLVODTC-DLBZAZTESA-N 1 3 335.536 2.593 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@@H]2CC[N@@H+](CC3CC(C)(C)C3)C2)C1 ZINC001437935775 1388246833 /nfs/dbraw/zinc/24/68/33/1388246833.db2.gz CTYLBXOFLVODTC-DLBZAZTESA-N 1 3 335.536 2.593 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CCc2cccs2)C1 ZINC001417777860 1373243560 /nfs/dbraw/zinc/24/35/60/1373243560.db2.gz MXNRRZSEUWNADB-VQHPVUNQSA-N 1 3 349.544 2.648 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)cc1C ZINC001417778850 1373245768 /nfs/dbraw/zinc/24/57/68/1373245768.db2.gz WIWFBYWDCNZCMA-KDURUIRLSA-N 1 3 331.504 2.628 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2C[C@H](CNC(=O)CN3[C@H](C)CC[C@@H]3C)C2)c1 ZINC001417797632 1373264228 /nfs/dbraw/zinc/26/42/28/1373264228.db2.gz FRKSDBPMNDUTQL-BMOGMMAESA-N 1 3 343.515 2.852 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+]CC[C@@H]2CCCC2(F)F)C1)N(C)C ZINC001417797774 1373265421 /nfs/dbraw/zinc/26/54/21/1373265421.db2.gz JCYJLBKRMIUYTG-VGWMRTNUSA-N 1 3 345.478 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CC1CCCC1 ZINC001417822949 1373297371 /nfs/dbraw/zinc/29/73/71/1373297371.db2.gz OKLHWNBYYCXFOC-NMLBUPMWSA-N 1 3 347.547 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CC1CCCC1 ZINC001417822949 1373297376 /nfs/dbraw/zinc/29/73/76/1373297376.db2.gz OKLHWNBYYCXFOC-NMLBUPMWSA-N 1 3 347.547 2.687 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@H]2CC[N@H+](CCCC(C)(C)C)C2)C1 ZINC001437942063 1388255704 /nfs/dbraw/zinc/25/57/04/1388255704.db2.gz QOWKIGWUVYOXBM-ROUUACIJSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@H]2CC[N@@H+](CCCC(C)(C)C)C2)C1 ZINC001437942063 1388255708 /nfs/dbraw/zinc/25/57/08/1388255708.db2.gz QOWKIGWUVYOXBM-ROUUACIJSA-N 1 3 337.552 2.983 10 0 EFAEHO CCc1cccc(CN2CC[C@H](NC(=O)CCC[NH+](C)C)[C@H]2C)c1 ZINC001417850501 1373334933 /nfs/dbraw/zinc/33/49/33/1373334933.db2.gz SUMAETJDPAMJGR-APWZRJJASA-N 1 3 331.504 2.670 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CCC2CC2)[C@@H]1C)N1CCCCC1 ZINC001417851508 1373337577 /nfs/dbraw/zinc/33/75/77/1373337577.db2.gz PJMACEBQUVOMQG-NZSAHSFTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CCC2CC2)[C@@H]1C)N1CCCCC1 ZINC001417851508 1373337581 /nfs/dbraw/zinc/33/75/81/1373337581.db2.gz PJMACEBQUVOMQG-NZSAHSFTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@@H](CCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001437944953 1388258463 /nfs/dbraw/zinc/25/84/63/1388258463.db2.gz WLGLOWOXQRAZKB-APWZRJJASA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)C[N@H+]1CC[C@@H](CCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001437944953 1388258471 /nfs/dbraw/zinc/25/84/71/1388258471.db2.gz WLGLOWOXQRAZKB-APWZRJJASA-N 1 3 341.515 2.683 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCC[C@@H](CN(C)C/C=C\Cl)C2)CC[N@@H+]1C ZINC001418021626 1373534530 /nfs/dbraw/zinc/53/45/30/1373534530.db2.gz QDRVZLZBWMCWBP-RUUKRCDUSA-N 1 3 341.927 2.640 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCC[C@@H](CN(C)C/C=C\Cl)C2)CC[N@H+]1C ZINC001418021626 1373534532 /nfs/dbraw/zinc/53/45/32/1373534532.db2.gz QDRVZLZBWMCWBP-RUUKRCDUSA-N 1 3 341.927 2.640 10 0 EFAEHO C[C@@H]1CCC[C@@H](CCN2C[C@H]3CC[C@@H](C2)N3C(=O)CC[NH+](C)C)C1 ZINC001418033587 1373548367 /nfs/dbraw/zinc/54/83/67/1373548367.db2.gz GMVTXWNIXGIIKN-HCXYKTFWSA-N 1 3 335.536 2.830 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H]([NH2+]C/C=C\c2ccc(Cl)cc2)C1 ZINC001418045205 1373557637 /nfs/dbraw/zinc/55/76/37/1373557637.db2.gz VFCBNRKJYKGTLF-JXCVUKRWSA-N 1 3 347.890 2.640 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@H]1C[C@@H](NCc2ccccc2Cl)C1 ZINC001418092635 1373597739 /nfs/dbraw/zinc/59/77/39/1373597739.db2.gz CPNWQFHKOJUOAX-BBWFWOEESA-N 1 3 349.906 2.951 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@H]1C[C@@H](NCc2ccccc2Cl)C1 ZINC001418092635 1373597745 /nfs/dbraw/zinc/59/77/45/1373597745.db2.gz CPNWQFHKOJUOAX-BBWFWOEESA-N 1 3 349.906 2.951 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc(C(F)F)c2)C1)N(C)C ZINC001418099740 1373603292 /nfs/dbraw/zinc/60/32/92/1373603292.db2.gz ZWVKJMVAMNIKBN-OWCLPIDISA-N 1 3 339.430 2.701 10 0 EFAEHO Cc1cccc(C[N@H+]2CCC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001418126075 1373644062 /nfs/dbraw/zinc/64/40/62/1373644062.db2.gz BSXZETGQAOERFN-AZUAARDMSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1cccc(C[N@@H+]2CCC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001418126075 1373644070 /nfs/dbraw/zinc/64/40/70/1373644070.db2.gz BSXZETGQAOERFN-AZUAARDMSA-N 1 3 343.515 2.665 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCCN(Cc2ccccn2)C1)[NH+](CC)CC ZINC001418128753 1373648048 /nfs/dbraw/zinc/64/80/48/1373648048.db2.gz MHRYSCALEHGCFK-PKOBYXMFSA-N 1 3 346.519 2.530 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CCC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001418131862 1373655707 /nfs/dbraw/zinc/65/57/07/1373655707.db2.gz BPPLWVCDEPGELT-KRWDZBQOSA-N 1 3 335.536 2.737 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CCC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001418131862 1373655713 /nfs/dbraw/zinc/65/57/13/1373655713.db2.gz BPPLWVCDEPGELT-KRWDZBQOSA-N 1 3 335.536 2.737 10 0 EFAEHO Cc1cc(CN2CCCC[C@H]2CNC(=O)CC[NH+](C)C)c(C)s1 ZINC001418157684 1373697854 /nfs/dbraw/zinc/69/78/54/1373697854.db2.gz ZKCKLACJYXWCOS-KRWDZBQOSA-N 1 3 337.533 2.787 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC1CCC([NH2+]C/C=C\Cl)CC1 ZINC001418188072 1373751744 /nfs/dbraw/zinc/75/17/44/1373751744.db2.gz UNWJZNMIVGEANK-CPIORXOHSA-N 1 3 327.900 2.630 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1cc(C)ccc1C ZINC001418227976 1373783987 /nfs/dbraw/zinc/78/39/87/1373783987.db2.gz DKLGXHVMWUPDQS-IEBWSBKVSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)c1cccc(CN[C@H](C)CNC(=O)C(C)(C)[NH+]2CCCC2)n1 ZINC001418262850 1373828539 /nfs/dbraw/zinc/82/85/39/1373828539.db2.gz QFVAKAQUDPFIED-MRXNPFEDSA-N 1 3 346.519 2.674 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC[C@H](C)NCc2cc(C)ccc2F)C1 ZINC001418275744 1373846744 /nfs/dbraw/zinc/84/67/44/1373846744.db2.gz YOUMJTSNMTYPKB-IRXDYDNUSA-N 1 3 349.494 2.850 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC[C@H](C)NCc2cc(C)ccc2F)C1 ZINC001418275744 1373846754 /nfs/dbraw/zinc/84/67/54/1373846754.db2.gz YOUMJTSNMTYPKB-IRXDYDNUSA-N 1 3 349.494 2.850 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H](C)[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001418301284 1373877958 /nfs/dbraw/zinc/87/79/58/1373877958.db2.gz WCVIKXSHFYPADD-DYVFJYSZSA-N 1 3 337.895 2.763 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001418314741 1373894065 /nfs/dbraw/zinc/89/40/65/1373894065.db2.gz BEQOKUCSMHAMLC-YJBOKZPZSA-N 1 3 343.471 2.902 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]Cc1cccc2ccccc21 ZINC001418315304 1373895437 /nfs/dbraw/zinc/89/54/37/1373895437.db2.gz WWHKPDMIAIJIFP-MRXNPFEDSA-N 1 3 327.472 2.774 10 0 EFAEHO CN(CC(=O)N[C@H]1CCC[C@@H]([NH2+]Cc2ccsc2)C1)C1CCC1 ZINC001418359410 1373932892 /nfs/dbraw/zinc/93/28/92/1373932892.db2.gz DFEMQCDGIZYZDS-CVEARBPZSA-N 1 3 335.517 2.749 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H]1CCC[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001418361973 1373934739 /nfs/dbraw/zinc/93/47/39/1373934739.db2.gz SRTUDAIXRPVMKK-MOPGFXCFSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@H](CCNC(=O)CN(C)C1CCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001418402876 1373983333 /nfs/dbraw/zinc/98/33/33/1373983333.db2.gz PCMGPWVDJJFNPG-DNVCBOLYSA-N 1 3 329.488 2.643 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@H+](C)CCNC(=O)CN(C)C2CCC2)c1 ZINC001418465895 1374056629 /nfs/dbraw/zinc/05/66/29/1374056629.db2.gz WBTHRQOBMSFCBB-KRWDZBQOSA-N 1 3 331.504 2.897 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@@H+](C)CCNC(=O)CN(C)C2CCC2)c1 ZINC001418465895 1374056632 /nfs/dbraw/zinc/05/66/32/1374056632.db2.gz WBTHRQOBMSFCBB-KRWDZBQOSA-N 1 3 331.504 2.897 10 0 EFAEHO CC(C)c1ccc(CN(C)CCNC(=O)[C@H](C(C)C)[NH+](C)C)cc1 ZINC001418470451 1374061393 /nfs/dbraw/zinc/06/13/93/1374061393.db2.gz OOCUNXTWQZLVPE-IBGZPJMESA-N 1 3 333.520 2.944 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)cc1 ZINC001418476615 1374069293 /nfs/dbraw/zinc/06/92/93/1374069293.db2.gz QCTWESNLDXXMFO-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)cc1 ZINC001418476615 1374069301 /nfs/dbraw/zinc/06/93/01/1374069301.db2.gz QCTWESNLDXXMFO-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001418482232 1374076723 /nfs/dbraw/zinc/07/67/23/1374076723.db2.gz JESMKQOGMNPFFX-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001418486512 1374081753 /nfs/dbraw/zinc/08/17/53/1374081753.db2.gz CWYQGFQPXNDAOC-ROUUACIJSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001418486512 1374081758 /nfs/dbraw/zinc/08/17/58/1374081758.db2.gz CWYQGFQPXNDAOC-ROUUACIJSA-N 1 3 331.504 2.582 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCCN(C)[C@H]1CCc2ccc(Cl)cc21 ZINC001418508808 1374109786 /nfs/dbraw/zinc/10/97/86/1374109786.db2.gz AFHCDEACVPKSSY-KRWDZBQOSA-N 1 3 337.895 2.717 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCCN(C)[C@H]1CCc2ccc(Cl)cc21 ZINC001418508808 1374109787 /nfs/dbraw/zinc/10/97/87/1374109787.db2.gz AFHCDEACVPKSSY-KRWDZBQOSA-N 1 3 337.895 2.717 10 0 EFAEHO CCN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1ccc(F)cc1C ZINC001418553503 1374171304 /nfs/dbraw/zinc/17/13/04/1374171304.db2.gz AGOXBRZJDOQLOD-UHFFFAOYSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001437991521 1388302449 /nfs/dbraw/zinc/30/24/49/1388302449.db2.gz POWJMDWWZIWILO-PKOBYXMFSA-N 1 3 349.494 2.890 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001437991521 1388302451 /nfs/dbraw/zinc/30/24/51/1388302451.db2.gz POWJMDWWZIWILO-PKOBYXMFSA-N 1 3 349.494 2.890 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@@H+]([C@@H]2CCc3ccccc32)C1)C1CCC1 ZINC001418656226 1374328799 /nfs/dbraw/zinc/32/87/99/1374328799.db2.gz GTJQFQZOWRHCID-OXQOHEQNSA-N 1 3 341.499 2.596 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@H+]([C@@H]2CCc3ccccc32)C1)C1CCC1 ZINC001418656226 1374328802 /nfs/dbraw/zinc/32/88/02/1374328802.db2.gz GTJQFQZOWRHCID-OXQOHEQNSA-N 1 3 341.499 2.596 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)cc1C ZINC001418669864 1374346477 /nfs/dbraw/zinc/34/64/77/1374346477.db2.gz GBMGLMHPEUUTGR-OXJNMPFZSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)cc1C ZINC001418669864 1374346484 /nfs/dbraw/zinc/34/64/84/1374346484.db2.gz GBMGLMHPEUUTGR-OXJNMPFZSA-N 1 3 343.515 2.583 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[N@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001438001193 1388315508 /nfs/dbraw/zinc/31/55/08/1388315508.db2.gz NUHNVUSFZDNAAI-CVEARBPZSA-N 1 3 345.478 2.544 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[N@@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001438001193 1388315514 /nfs/dbraw/zinc/31/55/14/1388315514.db2.gz NUHNVUSFZDNAAI-CVEARBPZSA-N 1 3 345.478 2.544 10 0 EFAEHO CCC[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CCC1CC1 ZINC001418726491 1374421997 /nfs/dbraw/zinc/42/19/97/1374421997.db2.gz DUNPCKGNISJTFD-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO CCC[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CCC1CC1 ZINC001418726491 1374422001 /nfs/dbraw/zinc/42/20/01/1374422001.db2.gz DUNPCKGNISJTFD-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]Cc3cccc(F)c3)C2)C1 ZINC001418730539 1374431331 /nfs/dbraw/zinc/43/13/31/1374431331.db2.gz ATAKFZCICVKMQH-HHXXYDBFSA-N 1 3 347.478 2.542 10 0 EFAEHO CN(CC(=O)N[C@@H]1[C@@H]2CCC[N@H+](CC3CC3)[C@@H]2C1(C)C)CC(C)(C)C ZINC001418740504 1374444027 /nfs/dbraw/zinc/44/40/27/1374444027.db2.gz BATLCTJXFXVBQQ-UHOSZYNNSA-N 1 3 349.563 2.980 10 0 EFAEHO CN(CC(=O)N[C@@H]1[C@@H]2CCC[N@@H+](CC3CC3)[C@@H]2C1(C)C)CC(C)(C)C ZINC001418740504 1374444031 /nfs/dbraw/zinc/44/40/31/1374444031.db2.gz BATLCTJXFXVBQQ-UHOSZYNNSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CCC(C)(C)C ZINC001418741186 1374444580 /nfs/dbraw/zinc/44/45/80/1374444580.db2.gz RQASINRJPAJPTE-OKYOBFRVSA-N 1 3 349.563 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CCC(C)(C)C ZINC001418741186 1374444583 /nfs/dbraw/zinc/44/45/83/1374444583.db2.gz RQASINRJPAJPTE-OKYOBFRVSA-N 1 3 349.563 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CCC(C)(C)C ZINC001418741190 1374444790 /nfs/dbraw/zinc/44/47/90/1374444790.db2.gz RQASINRJPAJPTE-RDGPPVDQSA-N 1 3 349.563 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CCC(C)(C)C ZINC001418741190 1374444791 /nfs/dbraw/zinc/44/47/91/1374444791.db2.gz RQASINRJPAJPTE-RDGPPVDQSA-N 1 3 349.563 2.932 10 0 EFAEHO CCC(CC)C[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN1CC[C@@H](C)C1 ZINC001418742190 1374446085 /nfs/dbraw/zinc/44/60/85/1374446085.db2.gz NTEIFUBTQMOFMH-LMMKCTJWSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)CCC[N@H+](C)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001438004659 1388318688 /nfs/dbraw/zinc/31/86/88/1388318688.db2.gz HWQBUELSYDJFIE-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)CCC[N@@H+](C)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001438004659 1388318691 /nfs/dbraw/zinc/31/86/91/1388318691.db2.gz HWQBUELSYDJFIE-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001418767017 1374476373 /nfs/dbraw/zinc/47/63/73/1374476373.db2.gz LBXHLTMQAVEHLT-VQTJNVASSA-N 1 3 341.499 2.784 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001418767017 1374476377 /nfs/dbraw/zinc/47/63/77/1374476377.db2.gz LBXHLTMQAVEHLT-VQTJNVASSA-N 1 3 341.499 2.784 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C1CC1)[C@@H]1CCCc2ccccc21 ZINC001418799535 1374518318 /nfs/dbraw/zinc/51/83/18/1374518318.db2.gz NBSNRXOXSUONCK-HXUWFJFHSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C1CC1)[C@@H]1CCCc2ccccc21 ZINC001418799535 1374518323 /nfs/dbraw/zinc/51/83/23/1374518323.db2.gz NBSNRXOXSUONCK-HXUWFJFHSA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@@H](F)CN1CC[C@H](NC(=O)CCC[NH+](C)C)CC(C)(C)C1 ZINC001418824451 1374545660 /nfs/dbraw/zinc/54/56/60/1374545660.db2.gz JXANYXKAJSRHMN-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)C[NH2+][C@H](CNC(=O)C(C)(C)N1CCCC1)c1ccccc1 ZINC001418859041 1374584579 /nfs/dbraw/zinc/58/45/79/1374584579.db2.gz XTIAMORYWUTITE-GOSISDBHSA-N 1 3 331.504 2.964 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001418946962 1374720203 /nfs/dbraw/zinc/72/02/03/1374720203.db2.gz BYZOFLWAGJDYTM-SFHVURJKSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001418946962 1374720208 /nfs/dbraw/zinc/72/02/08/1374720208.db2.gz BYZOFLWAGJDYTM-SFHVURJKSA-N 1 3 337.552 2.935 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCCN(Cc2ccc3ccccc3c2)C1 ZINC001418957942 1374732311 /nfs/dbraw/zinc/73/23/11/1374732311.db2.gz LBNVQJKEQHFNDY-FQEVSTJZSA-N 1 3 339.483 2.872 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@@H]2C[C@H]1CN2CC1CC(C)(C)C1)[NH+](CC)CC ZINC001419051409 1374792814 /nfs/dbraw/zinc/79/28/14/1374792814.db2.gz IONLLCWRVTXQBD-BZSNNMDCSA-N 1 3 335.536 2.828 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC[NH+](C[C@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001419079225 1374819342 /nfs/dbraw/zinc/81/93/42/1374819342.db2.gz YKLHQPDRPYMVPE-HOCLYGCPSA-N 1 3 345.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001419079743 1374820200 /nfs/dbraw/zinc/82/02/00/1374820200.db2.gz MRSMKKJGBDUWQB-GDBMZVCRSA-N 1 3 345.478 2.731 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H]1CC[N@H+](CCC2CC2)C1)N1CCCCC1 ZINC001419123355 1374868848 /nfs/dbraw/zinc/86/88/48/1374868848.db2.gz IFRJEAIHGUFOGF-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H]1CC[N@@H+](CCC2CC2)C1)N1CCCCC1 ZINC001419123355 1374868849 /nfs/dbraw/zinc/86/88/49/1374868849.db2.gz IFRJEAIHGUFOGF-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)[C@H]1CCN([C@@H](C)c2cccc(OC)c2)C1 ZINC001419138742 1374886766 /nfs/dbraw/zinc/88/67/66/1374886766.db2.gz KQCKISUNAGEQIA-WMZOPIPTSA-N 1 3 347.503 2.631 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)[C@H]1CCN([C@@H](C)c2cccc(OC)c2)C1 ZINC001419138742 1374886772 /nfs/dbraw/zinc/88/67/72/1374886772.db2.gz KQCKISUNAGEQIA-WMZOPIPTSA-N 1 3 347.503 2.631 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCN(CCc2ccc(C)cc2)C1)[NH+](CC)CC ZINC001419175888 1374924156 /nfs/dbraw/zinc/92/41/56/1374924156.db2.gz ZFBZISVOCSTZKE-VQTJNVASSA-N 1 3 345.531 2.848 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1csc(C)c1 ZINC001419181213 1374928864 /nfs/dbraw/zinc/92/88/64/1374928864.db2.gz CZWFUVJTVZSNTP-SJORKVTESA-N 1 3 337.533 2.914 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1csc(C)c1 ZINC001419181208 1374928901 /nfs/dbraw/zinc/92/89/01/1374928901.db2.gz CZWFUVJTVZSNTP-IRXDYDNUSA-N 1 3 337.533 2.914 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](CC)NCc1ccccc1F ZINC001419199123 1374945013 /nfs/dbraw/zinc/94/50/13/1374945013.db2.gz MVSYMKNQLOSFGB-AEFFLSMTSA-N 1 3 335.467 2.685 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](CC)NCc1ccccc1F ZINC001419199123 1374945018 /nfs/dbraw/zinc/94/50/18/1374945018.db2.gz MVSYMKNQLOSFGB-AEFFLSMTSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC)NCc1ccccc1F ZINC001419199215 1374945163 /nfs/dbraw/zinc/94/51/63/1374945163.db2.gz OBYLCKXAZPTVMS-SOLBZPMBSA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC)NCc1ccccc1F ZINC001419199215 1374945166 /nfs/dbraw/zinc/94/51/66/1374945166.db2.gz OBYLCKXAZPTVMS-SOLBZPMBSA-N 1 3 335.467 2.540 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](CC)NCc1ccccc1F ZINC001419199127 1374945329 /nfs/dbraw/zinc/94/53/29/1374945329.db2.gz MVSYMKNQLOSFGB-FUHWJXTLSA-N 1 3 335.467 2.685 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](CC)NCc1ccccc1F ZINC001419199127 1374945332 /nfs/dbraw/zinc/94/53/32/1374945332.db2.gz MVSYMKNQLOSFGB-FUHWJXTLSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cc(C)sc1C ZINC001419238360 1374983791 /nfs/dbraw/zinc/98/37/91/1374983791.db2.gz FDLVBPJBFSXQMX-CXAGYDPISA-N 1 3 337.533 2.691 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1ccccc1)C1CC1 ZINC001419260035 1375006926 /nfs/dbraw/zinc/00/69/26/1375006926.db2.gz JBDUIEGIOYAJBX-RTBURBONSA-N 1 3 329.488 2.545 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]CC1CCC(F)(F)CC1)C1CC1)N(C)C ZINC001419276077 1375023957 /nfs/dbraw/zinc/02/39/57/1375023957.db2.gz NGULHPCAIUTXEW-JKSUJKDBSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1ccccc1)C1CC1 ZINC001419302206 1375063749 /nfs/dbraw/zinc/06/37/49/1375063749.db2.gz YIAGWRVVUNLRJC-UXHICEINSA-N 1 3 343.515 2.934 10 0 EFAEHO CC[C@H](F)C[N@H+](C)C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001419329294 1375110662 /nfs/dbraw/zinc/11/06/62/1375110662.db2.gz BZCOCBCSFDZUGB-SJORKVTESA-N 1 3 343.531 2.883 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001419329294 1375110668 /nfs/dbraw/zinc/11/06/68/1375110668.db2.gz BZCOCBCSFDZUGB-SJORKVTESA-N 1 3 343.531 2.883 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@@H](CN(C)CCF)C1)[NH+]1CCCCC1 ZINC001419334691 1375119370 /nfs/dbraw/zinc/11/93/70/1375119370.db2.gz KEPVTWNYRXEKHI-ROUUACIJSA-N 1 3 341.515 2.637 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H]1CC[C@H]([NH2+]CC[C@H](C)F)CC1 ZINC001419377804 1375192502 /nfs/dbraw/zinc/19/25/02/1375192502.db2.gz NCGJNHNTZINAFS-QAETUUGQSA-N 1 3 327.488 2.626 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H]1CC[C@H]([NH2+]CC[C@H](C)F)CC1 ZINC001419377800 1375192827 /nfs/dbraw/zinc/19/28/27/1375192827.db2.gz NCGJNHNTZINAFS-LUKYLMHMSA-N 1 3 327.488 2.626 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+][C@H](C)c2cccc(Cl)c2)C1 ZINC001419386818 1375204125 /nfs/dbraw/zinc/20/41/25/1375204125.db2.gz UMXKNQFWSRSJIU-PBHICJAKSA-N 1 3 337.895 2.932 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001419405271 1375231295 /nfs/dbraw/zinc/23/12/95/1375231295.db2.gz HGNQYGDOPGELQK-FPCVCCKLSA-N 1 3 345.478 2.635 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]2C[N@H+](CCCF)CC[C@@H]21)CC(C)(C)C ZINC001419452114 1375292872 /nfs/dbraw/zinc/29/28/72/1375292872.db2.gz SYCGTEPGLUZHTB-SJORKVTESA-N 1 3 341.515 2.637 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]2C[N@@H+](CCCF)CC[C@@H]21)CC(C)(C)C ZINC001419452114 1375292884 /nfs/dbraw/zinc/29/28/84/1375292884.db2.gz SYCGTEPGLUZHTB-SJORKVTESA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@H+](Cc3ccsc3)CC[C@@H]21 ZINC001419453846 1375295323 /nfs/dbraw/zinc/29/53/23/1375295323.db2.gz XYUQARFCBSLNMZ-ROUUACIJSA-N 1 3 349.544 2.901 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@@H+](Cc3ccsc3)CC[C@@H]21 ZINC001419453846 1375295336 /nfs/dbraw/zinc/29/53/36/1375295336.db2.gz XYUQARFCBSLNMZ-ROUUACIJSA-N 1 3 349.544 2.901 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@H+](Cc3ccsc3)CC[C@H]21 ZINC001419453885 1375295489 /nfs/dbraw/zinc/29/54/89/1375295489.db2.gz YLWVLERRZHFYIK-QZTJIDSGSA-N 1 3 349.544 2.903 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@@H+](Cc3ccsc3)CC[C@H]21 ZINC001419453885 1375295505 /nfs/dbraw/zinc/29/55/05/1375295505.db2.gz YLWVLERRZHFYIK-QZTJIDSGSA-N 1 3 349.544 2.903 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@H]1C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001419499862 1375349817 /nfs/dbraw/zinc/34/98/17/1375349817.db2.gz KFUXIPSMIFYHMN-MJBXVCDLSA-N 1 3 348.318 2.805 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@H]1C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001419499862 1375349822 /nfs/dbraw/zinc/34/98/22/1375349822.db2.gz KFUXIPSMIFYHMN-MJBXVCDLSA-N 1 3 348.318 2.805 10 0 EFAEHO CCC(CC)C[NH2+]C[C@@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001419519763 1375378341 /nfs/dbraw/zinc/37/83/41/1375378341.db2.gz ZXCBYGLVRPYJMT-BEFAXECRSA-N 1 3 343.531 2.977 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)CC[NH+]3CCCCC3)C2)c1 ZINC001419521314 1375380388 /nfs/dbraw/zinc/38/03/88/1375380388.db2.gz UPCCWHYCTCUJAG-HDICACEKSA-N 1 3 347.478 2.747 10 0 EFAEHO Cc1ccc(C[N@H+]2CCC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)cc1 ZINC001419557015 1375445062 /nfs/dbraw/zinc/44/50/62/1375445062.db2.gz NDDJUOWCQURGIN-AZUAARDMSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccc(C[N@@H+]2CCC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)cc1 ZINC001419557015 1375445067 /nfs/dbraw/zinc/44/50/67/1375445067.db2.gz NDDJUOWCQURGIN-AZUAARDMSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccc(C[N@H+]2CCC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cc1 ZINC001419557025 1375445405 /nfs/dbraw/zinc/44/54/05/1375445405.db2.gz NDDJUOWCQURGIN-UYAOXDASSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccc(C[N@@H+]2CCC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cc1 ZINC001419557025 1375445412 /nfs/dbraw/zinc/44/54/12/1375445412.db2.gz NDDJUOWCQURGIN-UYAOXDASSA-N 1 3 343.515 2.665 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[NH2+]Cc2cc(C)ccc2F)C1 ZINC001419557638 1375448642 /nfs/dbraw/zinc/44/86/42/1375448642.db2.gz FFTZIPSLFWBWJQ-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001419562037 1375453163 /nfs/dbraw/zinc/45/31/63/1375453163.db2.gz DLPQVGXXQMSUMI-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001419674681 1375688205 /nfs/dbraw/zinc/68/82/05/1375688205.db2.gz RDLCKVLYTYCFAI-AEFFLSMTSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001419674681 1375688215 /nfs/dbraw/zinc/68/82/15/1375688215.db2.gz RDLCKVLYTYCFAI-AEFFLSMTSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](CN[C@@H](C)c1cccc(Cl)c1F)N(C)C(=O)CC[NH+](C)C ZINC001419717479 1375763909 /nfs/dbraw/zinc/76/39/09/1375763909.db2.gz VOVLFFMYCFOYAP-OLZOCXBDSA-N 1 3 343.874 2.928 10 0 EFAEHO CCCc1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001419719364 1375766533 /nfs/dbraw/zinc/76/65/33/1375766533.db2.gz KHSMLBHCPRTKEB-ZWKOTPCHSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001419719354 1375766594 /nfs/dbraw/zinc/76/65/94/1375766594.db2.gz KHSMLBHCPRTKEB-QZTJIDSGSA-N 1 3 345.531 2.917 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+]C[C@@H](C)N(C)C(=O)CN1CCCC1 ZINC001419742566 1375798481 /nfs/dbraw/zinc/79/84/81/1375798481.db2.gz HECNCKDMHDQWMV-OAHLLOKOSA-N 1 3 337.895 2.681 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]Cc1cccc(C(F)F)c1 ZINC001419756598 1375822559 /nfs/dbraw/zinc/82/25/59/1375822559.db2.gz CIIIPGFBIATSDX-AWEZNQCLSA-N 1 3 341.446 2.901 10 0 EFAEHO CC(C)(C(=O)N[C@@H](C[NH2+]CC1CC1)C1CCCCC1)N1CCCC1 ZINC001419809960 1375919735 /nfs/dbraw/zinc/91/97/35/1375919735.db2.gz ZLMUOTSWFXMBHO-SFHVURJKSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001419817602 1375930196 /nfs/dbraw/zinc/93/01/96/1375930196.db2.gz IFFRHFQVZOREKZ-UYAOXDASSA-N 1 3 345.531 2.704 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]C/C=C\c2ccccc2)[C@H](C)C1 ZINC001419820273 1375933458 /nfs/dbraw/zinc/93/34/58/1375933458.db2.gz KKESAFGRSWIUHT-NCJCTJFTSA-N 1 3 343.515 2.867 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)CNC(=O)C(C)(C)N2CCCC2)c(C)s1 ZINC001419837460 1375963285 /nfs/dbraw/zinc/96/32/85/1375963285.db2.gz YZHDHVPJOKOPAD-ZDUSSCGKSA-N 1 3 337.533 2.834 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](C)CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)c1 ZINC001419852805 1376003170 /nfs/dbraw/zinc/00/31/70/1376003170.db2.gz PQACHPAKBPZSJO-OXQOHEQNSA-N 1 3 349.494 2.802 10 0 EFAEHO COc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@@H]2CCCCN2C(C)C)cc1 ZINC001419862347 1376020913 /nfs/dbraw/zinc/02/09/13/1376020913.db2.gz FQBCSDQSRIDNEV-LPHOPBHVSA-N 1 3 347.503 2.552 10 0 EFAEHO COc1ccc(C[NH2+][C@H](C)CNC(=O)[C@@H]2CCCCN2C(C)C)cc1 ZINC001419862341 1376021430 /nfs/dbraw/zinc/02/14/30/1376021430.db2.gz FQBCSDQSRIDNEV-APWZRJJASA-N 1 3 347.503 2.552 10 0 EFAEHO COc1ccc(C[NH2+][C@H](C)CNC(=O)[C@H](C)N2CCCCCC2)cc1 ZINC001419876972 1376051230 /nfs/dbraw/zinc/05/12/30/1376051230.db2.gz YZUGGSUZMUATTG-SJORKVTESA-N 1 3 347.503 2.554 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](NCc2ccccc2F)C(C)C)CC[N@@H+]1C ZINC001419892751 1376083666 /nfs/dbraw/zinc/08/36/66/1376083666.db2.gz LOBPQYQIMZQFTK-QXAKKESOSA-N 1 3 349.494 2.786 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](NCc2ccccc2F)C(C)C)CC[N@H+]1C ZINC001419892751 1376083679 /nfs/dbraw/zinc/08/36/79/1376083679.db2.gz LOBPQYQIMZQFTK-QXAKKESOSA-N 1 3 349.494 2.786 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](CNC(=O)CN1CC[C@H](C)C1)C(C)C ZINC001419911976 1376115990 /nfs/dbraw/zinc/11/59/90/1376115990.db2.gz VDBWQMRAXFTTAP-FXAWDEMLSA-N 1 3 345.531 2.821 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+][C@H](C)c1ccc2c(c1)CCC2 ZINC001419930306 1376146152 /nfs/dbraw/zinc/14/61/52/1376146152.db2.gz CIKZKGDJIJHFMQ-HZPDHXFCSA-N 1 3 331.504 2.671 10 0 EFAEHO CCc1cccc(C[NH2+][C@H]2CCN(C(=O)[C@@H](F)CN(CC)CC)C2)c1 ZINC001419959066 1376189689 /nfs/dbraw/zinc/18/96/89/1376189689.db2.gz JMTUCSMFCAXFDO-OALUTQOASA-N 1 3 349.494 2.619 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]Cc2cccc(Cl)c2)C1 ZINC001420016419 1376287672 /nfs/dbraw/zinc/28/76/72/1376287672.db2.gz OLAUPAFYVYBAPQ-MRXNPFEDSA-N 1 3 337.895 2.618 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@@H]([NH2+]Cc3ccsc3)C2)CCC1 ZINC001420022613 1376303504 /nfs/dbraw/zinc/30/35/04/1376303504.db2.gz DZDCVXKHSIKSHN-HZPDHXFCSA-N 1 3 335.517 2.749 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@H+](C)C/C=C/c2ccccc2)C1 ZINC001420059271 1376400418 /nfs/dbraw/zinc/40/04/18/1376400418.db2.gz ZJHLJSLABOFDKR-MEJUDOHFSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@@H+](C)C/C=C/c2ccccc2)C1 ZINC001420059271 1376400419 /nfs/dbraw/zinc/40/04/19/1376400419.db2.gz ZJHLJSLABOFDKR-MEJUDOHFSA-N 1 3 343.515 2.963 10 0 EFAEHO C[C@H](CCNC(=O)CC[NH+](C)C)NCc1c(Cl)cccc1Cl ZINC001420126032 1376483074 /nfs/dbraw/zinc/48/30/74/1376483074.db2.gz TZCXHRTYGAVOSR-GFCCVEGCSA-N 1 3 346.302 2.930 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](C)CCNC(=O)CN1CC[C@H](C)C1 ZINC001420129698 1376487107 /nfs/dbraw/zinc/48/71/07/1376487107.db2.gz HIKYTVXHLJWDLO-DLBZAZTESA-N 1 3 331.504 2.575 10 0 EFAEHO COc1cccc([C@H](C)N(C)CCNC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001420279790 1376658093 /nfs/dbraw/zinc/65/80/93/1376658093.db2.gz AZMKBFWYMZWDES-INIZCTEOSA-N 1 3 347.503 2.679 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C ZINC001420348053 1376779515 /nfs/dbraw/zinc/77/95/15/1376779515.db2.gz CGSMKEJEDMBGIG-CALCHBBNSA-N 1 3 331.504 2.670 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001420348053 1376779525 /nfs/dbraw/zinc/77/95/25/1376779525.db2.gz CGSMKEJEDMBGIG-CALCHBBNSA-N 1 3 331.504 2.670 10 0 EFAEHO CCN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1ccc(OC)cc1 ZINC001420412022 1376910571 /nfs/dbraw/zinc/91/05/71/1376910571.db2.gz BXBSXGQRIFPZMF-UHFFFAOYSA-N 1 3 347.503 2.508 10 0 EFAEHO Cc1ccc(CN2CCC[C@H]2CNC(=O)CC[C@@H]2CCC[N@H+]2C)cc1 ZINC001420466636 1377027254 /nfs/dbraw/zinc/02/72/54/1377027254.db2.gz DUSAKSQKARIQMT-PMACEKPBSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(CN2CCC[C@H]2CNC(=O)CC[C@@H]2CCC[N@@H+]2C)cc1 ZINC001420466636 1377027260 /nfs/dbraw/zinc/02/72/60/1377027260.db2.gz DUSAKSQKARIQMT-PMACEKPBSA-N 1 3 343.515 2.950 10 0 EFAEHO CCCc1ccc(C[N@@H+]2CC[C@@H](CNC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001420561611 1377201458 /nfs/dbraw/zinc/20/14/58/1377201458.db2.gz NFWAULKOJLUYOW-VQTJNVASSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(C[N@H+]2CC[C@@H](CNC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001420561611 1377201461 /nfs/dbraw/zinc/20/14/61/1377201461.db2.gz NFWAULKOJLUYOW-VQTJNVASSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001420571567 1377223697 /nfs/dbraw/zinc/22/36/97/1377223697.db2.gz QTOKPMMGDUXJEK-CKEIUWERSA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001420571567 1377223704 /nfs/dbraw/zinc/22/37/04/1377223704.db2.gz QTOKPMMGDUXJEK-CKEIUWERSA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@H](CN(C)CCc1ccccc1F)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001420596364 1377281084 /nfs/dbraw/zinc/28/10/84/1377281084.db2.gz HUDGXPFIWABABL-SJLPKXTDSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@H](CN(C)CCc1ccccc1F)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001420596364 1377281086 /nfs/dbraw/zinc/28/10/86/1377281086.db2.gz HUDGXPFIWABABL-SJLPKXTDSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@H](C[N@H+](C)CC1CCC(F)(F)CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001420621553 1377346971 /nfs/dbraw/zinc/34/69/71/1377346971.db2.gz GPSFEQUOAMLLNP-LSDHHAIUSA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@H](C[N@@H+](C)CC1CCC(F)(F)CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001420621553 1377346978 /nfs/dbraw/zinc/34/69/78/1377346978.db2.gz GPSFEQUOAMLLNP-LSDHHAIUSA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@@H](C[N@H+](C)CC1CCC(F)(F)CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001420621544 1377347172 /nfs/dbraw/zinc/34/71/72/1377347172.db2.gz GPSFEQUOAMLLNP-CABCVRRESA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC1CCC(F)(F)CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001420621544 1377347177 /nfs/dbraw/zinc/34/71/77/1377347177.db2.gz GPSFEQUOAMLLNP-CABCVRRESA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[N@@H+]1CC[C@@H](C)C1 ZINC001420622876 1377350689 /nfs/dbraw/zinc/35/06/89/1377350689.db2.gz JZWUREXRJPOPGG-HZPDHXFCSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[N@H+]1CC[C@@H](C)C1 ZINC001420622876 1377350691 /nfs/dbraw/zinc/35/06/91/1377350691.db2.gz JZWUREXRJPOPGG-HZPDHXFCSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[N@@H+]1CC[C@H](C)C1 ZINC001420622867 1377352123 /nfs/dbraw/zinc/35/21/23/1377352123.db2.gz JZWUREXRJPOPGG-HOTGVXAUSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[N@H+]1CC[C@H](C)C1 ZINC001420622867 1377352126 /nfs/dbraw/zinc/35/21/26/1377352126.db2.gz JZWUREXRJPOPGG-HOTGVXAUSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001420656941 1377433383 /nfs/dbraw/zinc/43/33/83/1377433383.db2.gz CPRZMCKOKQZRKR-HOTGVXAUSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001420656941 1377433386 /nfs/dbraw/zinc/43/33/86/1377433386.db2.gz CPRZMCKOKQZRKR-HOTGVXAUSA-N 1 3 343.471 2.711 10 0 EFAEHO CC[C@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)NCC=C(Cl)Cl ZINC001438308871 1388498428 /nfs/dbraw/zinc/49/84/28/1388498428.db2.gz GBAMHUPIBJOTLK-OLZOCXBDSA-N 1 3 336.307 2.664 10 0 EFAEHO CC[C@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)NCC=C(Cl)Cl ZINC001438308871 1388498437 /nfs/dbraw/zinc/49/84/37/1388498437.db2.gz GBAMHUPIBJOTLK-OLZOCXBDSA-N 1 3 336.307 2.664 10 0 EFAEHO Cc1cc(CN(C)C[C@@H](C)NC(=O)C[C@@H]2CC[N@H+](C)C2)c(C)s1 ZINC001420667257 1377461065 /nfs/dbraw/zinc/46/10/65/1377461065.db2.gz PQTPDCWQBHKYCS-CJNGLKHVSA-N 1 3 337.533 2.643 10 0 EFAEHO Cc1cc(CN(C)C[C@@H](C)NC(=O)C[C@@H]2CC[N@@H+](C)C2)c(C)s1 ZINC001420667257 1377461066 /nfs/dbraw/zinc/46/10/66/1377461066.db2.gz PQTPDCWQBHKYCS-CJNGLKHVSA-N 1 3 337.533 2.643 10 0 EFAEHO CC[C@@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)NCC=C(Cl)Cl ZINC001438308873 1388498867 /nfs/dbraw/zinc/49/88/67/1388498867.db2.gz GBAMHUPIBJOTLK-QWHCGFSZSA-N 1 3 336.307 2.664 10 0 EFAEHO CC[C@@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)NCC=C(Cl)Cl ZINC001438308873 1388498868 /nfs/dbraw/zinc/49/88/68/1388498868.db2.gz GBAMHUPIBJOTLK-QWHCGFSZSA-N 1 3 336.307 2.664 10 0 EFAEHO CCCN(C)CC(=O)NCC[N@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC001420702986 1377533681 /nfs/dbraw/zinc/53/36/81/1377533681.db2.gz CNVDTMWDMWJHLO-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CCCN(C)CC(=O)NCC[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC001420702986 1377533682 /nfs/dbraw/zinc/53/36/82/1377533682.db2.gz CNVDTMWDMWJHLO-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H](C)[NH2+]Cc2cccc(F)c2)CC1 ZINC001420768041 1377628208 /nfs/dbraw/zinc/62/82/08/1377628208.db2.gz NFHIOGZXGAQELO-INIZCTEOSA-N 1 3 349.494 2.883 10 0 EFAEHO CC[NH2+][C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)c1ccccc1 ZINC001420776401 1377646800 /nfs/dbraw/zinc/64/68/00/1377646800.db2.gz NKJDVXHNEHHGDI-APWZRJJASA-N 1 3 335.467 2.666 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CC1CC1)c1ccccc1 ZINC001420779656 1377654688 /nfs/dbraw/zinc/65/46/88/1377654688.db2.gz WYHNJYSDANAXCK-RBUKOAKNSA-N 1 3 329.488 2.718 10 0 EFAEHO CCCN(C(=O)C[C@H]1CC[N@H+](C)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC001420831036 1377741972 /nfs/dbraw/zinc/74/19/72/1377741972.db2.gz XVOHSFKUCFNKQK-UXHICEINSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN(C(=O)C[C@H]1CC[N@@H+](C)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC001420831036 1377741974 /nfs/dbraw/zinc/74/19/74/1377741974.db2.gz XVOHSFKUCFNKQK-UXHICEINSA-N 1 3 343.515 2.841 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1CC[C@@H](CCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001420882364 1377828742 /nfs/dbraw/zinc/82/87/42/1377828742.db2.gz ZGFBIQFPJHGGJQ-HZPDHXFCSA-N 1 3 329.504 2.541 10 0 EFAEHO CC[C@@H](F)C[N@H+]1CC[C@@H](CCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001420882364 1377828745 /nfs/dbraw/zinc/82/87/45/1377828745.db2.gz ZGFBIQFPJHGGJQ-HZPDHXFCSA-N 1 3 329.504 2.541 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+]1CC[C@@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001420891480 1377847549 /nfs/dbraw/zinc/84/75/49/1377847549.db2.gz YMJICNYFFUPVTK-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+]1CC[C@@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001420891480 1377847551 /nfs/dbraw/zinc/84/75/51/1377847551.db2.gz YMJICNYFFUPVTK-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CC1)N1CCCCC1 ZINC001420941821 1377914793 /nfs/dbraw/zinc/91/47/93/1377914793.db2.gz HLZDKUMGBKXJPU-FGTMMUONSA-N 1 3 347.547 2.926 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]Cc1cnccc1C ZINC001438344128 1388522349 /nfs/dbraw/zinc/52/23/49/1388522349.db2.gz ORDYAAJKRXZPKR-RTBURBONSA-N 1 3 346.519 2.637 10 0 EFAEHO C[N@H+](CCCC1CCCC1)C[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001420960212 1377943260 /nfs/dbraw/zinc/94/32/60/1377943260.db2.gz YSCRNTRNZMRLBC-LJQANCHMSA-N 1 3 335.536 2.833 10 0 EFAEHO C[N@@H+](CCCC1CCCC1)C[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001420960212 1377943261 /nfs/dbraw/zinc/94/32/61/1377943261.db2.gz YSCRNTRNZMRLBC-LJQANCHMSA-N 1 3 335.536 2.833 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@H+](CC2CCC2)C1)N1CCCCC1 ZINC001420990390 1377985168 /nfs/dbraw/zinc/98/51/68/1377985168.db2.gz OQLJCELTKRERRR-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@@H+](CC2CCC2)C1)N1CCCCC1 ZINC001420990390 1377985169 /nfs/dbraw/zinc/98/51/69/1377985169.db2.gz OQLJCELTKRERRR-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C1(CNC(=O)CN2[C@@H](C)CC[C@@H]2C)CC1 ZINC001421007106 1378011533 /nfs/dbraw/zinc/01/15/33/1378011533.db2.gz SANDFNDFLAHLKH-HOTGVXAUSA-N 1 3 347.478 2.745 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C1(CNC(=O)CN2[C@H](C)CC[C@@H]2C)CC1 ZINC001421007117 1378011829 /nfs/dbraw/zinc/01/18/29/1378011829.db2.gz SANDFNDFLAHLKH-IYBDPMFKSA-N 1 3 347.478 2.745 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CC[N@H+](CC3CCC3)C2)CC1 ZINC001421007289 1378013262 /nfs/dbraw/zinc/01/32/62/1378013262.db2.gz MMYUAZIJDJFQMX-LJQANCHMSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CC[N@@H+](CC3CCC3)C2)CC1 ZINC001421007289 1378013266 /nfs/dbraw/zinc/01/32/66/1378013266.db2.gz MMYUAZIJDJFQMX-LJQANCHMSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@]2(CCN(C(=O)[C@H](C(C)C)N(C)C)C2)C1 ZINC001421040753 1378058160 /nfs/dbraw/zinc/05/81/60/1378058160.db2.gz SWBZGQUACFWJGG-ICSRJNTNSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@]2(CCN(C(=O)[C@H](C(C)C)N(C)C)C2)C1 ZINC001421040753 1378058162 /nfs/dbraw/zinc/05/81/62/1378058162.db2.gz SWBZGQUACFWJGG-ICSRJNTNSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CCc2ccccc2)C[C@@H]1C ZINC001421103743 1378131798 /nfs/dbraw/zinc/13/17/98/1378131798.db2.gz LGSSQMAIAUCRRU-HKUYNNGSSA-N 1 3 331.504 2.538 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@]1(C)CCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001421236916 1378326105 /nfs/dbraw/zinc/32/61/05/1378326105.db2.gz JELYFTJHBITTIZ-LPHOPBHVSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1(C)CC[NH+](CCC2CC2)CC1 ZINC001421282286 1378419110 /nfs/dbraw/zinc/41/91/10/1378419110.db2.gz MXXHFGXOXURJGU-CALCHBBNSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1(C)CC[NH+](CCC2CC2)CC1 ZINC001421282299 1378421766 /nfs/dbraw/zinc/42/17/66/1378421766.db2.gz MXXHFGXOXURJGU-IRXDYDNUSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)NC[C@@]1(C)CCC[N@H+](CCCC(C)C)C1)N(C)C ZINC001421285458 1378429950 /nfs/dbraw/zinc/42/99/50/1378429950.db2.gz BAAARWZKIJZLFH-IEBWSBKVSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CCCC(C)C)C1)N(C)C ZINC001421285458 1378429953 /nfs/dbraw/zinc/42/99/53/1378429953.db2.gz BAAARWZKIJZLFH-IEBWSBKVSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001421422661 1378600586 /nfs/dbraw/zinc/60/05/86/1378600586.db2.gz MDNRWJDFHYCOMG-KRWDZBQOSA-N 1 3 342.487 2.637 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1cccc(OC)c1 ZINC001421425222 1378601830 /nfs/dbraw/zinc/60/18/30/1378601830.db2.gz RMANJXUSUQUSRE-IEBWSBKVSA-N 1 3 347.503 2.552 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(C)cc1Cl ZINC001421501045 1378701702 /nfs/dbraw/zinc/70/17/02/1378701702.db2.gz QJJSALSJBSUEEQ-INIZCTEOSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(C)cc1Cl ZINC001421501051 1378702523 /nfs/dbraw/zinc/70/25/23/1378702523.db2.gz QJJSALSJBSUEEQ-MRXNPFEDSA-N 1 3 339.911 2.973 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC2(C[NH2+]Cc3ccsc3)CCCC2)C1 ZINC001421513238 1378722736 /nfs/dbraw/zinc/72/27/36/1378722736.db2.gz RLGIDEYLDLVMJQ-HNNXBMFYSA-N 1 3 335.517 2.609 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccc(F)cc1)C2 ZINC001421517920 1378732935 /nfs/dbraw/zinc/73/29/35/1378732935.db2.gz UFTLTSUEYBPIPD-WDSOQIARSA-N 1 3 347.478 2.637 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccc(F)cc1)C2 ZINC001421517920 1378732938 /nfs/dbraw/zinc/73/29/38/1378732938.db2.gz UFTLTSUEYBPIPD-WDSOQIARSA-N 1 3 347.478 2.637 10 0 EFAEHO C[C@@H]([NH2+]CC1CCCC1)[C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001421518721 1378734725 /nfs/dbraw/zinc/73/47/25/1378734725.db2.gz CMVBNADZIZSMRF-AEFFLSMTSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)N[C@](C)(C[NH2+]Cc1cccc(C)c1)C1CC1)N(C)C ZINC001421562424 1378815355 /nfs/dbraw/zinc/81/53/55/1378815355.db2.gz PBARSCDTWKZMHL-UYAOXDASSA-N 1 3 331.504 2.710 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001421563812 1378817714 /nfs/dbraw/zinc/81/77/14/1378817714.db2.gz UTGYIUPKCZDHKL-MJGOQNOKSA-N 1 3 331.504 2.519 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2C[N@@H+](CCC3CCCCC3)C[C@@H]2C1 ZINC001421574127 1378833844 /nfs/dbraw/zinc/83/38/44/1378833844.db2.gz HQKWSEUZXBHRBQ-KDURUIRLSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2C[N@H+](CCC3CCCCC3)C[C@@H]2C1 ZINC001421574127 1378833851 /nfs/dbraw/zinc/83/38/51/1378833851.db2.gz HQKWSEUZXBHRBQ-KDURUIRLSA-N 1 3 335.536 2.689 10 0 EFAEHO Cc1cc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)CC[NH+](C)C)cs1 ZINC001421633927 1378917489 /nfs/dbraw/zinc/91/74/89/1378917489.db2.gz KMPZINPSNDLDCE-IRXDYDNUSA-N 1 3 335.517 2.574 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)C[NH2+]Cc1ccc(C(C)C)cc1 ZINC001421765343 1379101408 /nfs/dbraw/zinc/10/14/08/1379101408.db2.gz FZDORCZKWDFVDD-HNNXBMFYSA-N 1 3 342.487 2.926 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NCC2([NH2+]CC3CCC3)CCC2)C1 ZINC001421768511 1379108435 /nfs/dbraw/zinc/10/84/35/1379108435.db2.gz WAAIKUBFLOXZKS-LJQANCHMSA-N 1 3 339.499 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@](C)(C[NH2+]Cc1ccccc1F)C1CC1 ZINC001438429752 1388590572 /nfs/dbraw/zinc/59/05/72/1388590572.db2.gz VKAIUCAEYIECLE-LJQANCHMSA-N 1 3 335.467 2.540 10 0 EFAEHO C[C@H](c1ccccc1F)N1CCC[C@H](NC(=O)CC[NH+](C)C)CC1 ZINC001421831523 1379197387 /nfs/dbraw/zinc/19/73/87/1379197387.db2.gz WPHJKYIMGIOXFL-CVEARBPZSA-N 1 3 335.467 2.809 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(CNC(=O)[C@@H]2CCCN2C(C)C)CCCC1 ZINC001421835354 1379203822 /nfs/dbraw/zinc/20/38/22/1379203822.db2.gz UJYCWBINQALDAS-CVEARBPZSA-N 1 3 327.488 2.626 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1CC[C@H]([NH2+]CC[C@H](C)F)CC1 ZINC001438437350 1388599391 /nfs/dbraw/zinc/59/93/91/1388599391.db2.gz ALNUBIAWOYTBGO-LUKYLMHMSA-N 1 3 327.488 2.624 10 0 EFAEHO CN(CCC[N@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)CN1CCCC1 ZINC001421899521 1379326686 /nfs/dbraw/zinc/32/66/86/1379326686.db2.gz CGKVRSBCAWVMEH-UHFFFAOYSA-N 1 3 342.487 2.544 10 0 EFAEHO CN(CCC[N@@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)CN1CCCC1 ZINC001421899521 1379326688 /nfs/dbraw/zinc/32/66/88/1379326688.db2.gz CGKVRSBCAWVMEH-UHFFFAOYSA-N 1 3 342.487 2.544 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001421904507 1379333082 /nfs/dbraw/zinc/33/30/82/1379333082.db2.gz ZJLJYFNNDLSGRN-OAHLLOKOSA-N 1 3 333.467 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001421904507 1379333089 /nfs/dbraw/zinc/33/30/89/1379333089.db2.gz ZJLJYFNNDLSGRN-OAHLLOKOSA-N 1 3 333.467 2.542 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](C)N(C)C(=O)CC[NH+](C)C ZINC001421924914 1379357474 /nfs/dbraw/zinc/35/74/74/1379357474.db2.gz DWLAQIQALNOSHA-AWEZNQCLSA-N 1 3 325.884 2.537 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001421935051 1379373849 /nfs/dbraw/zinc/37/38/49/1379373849.db2.gz BFPJOUURCMPMMN-SJORKVTESA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001421945930 1379390177 /nfs/dbraw/zinc/39/01/77/1379390177.db2.gz PXANHPBHNHEHOB-HNAYVOBHSA-N 1 3 345.531 2.890 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001421945936 1379391004 /nfs/dbraw/zinc/39/10/04/1379391004.db2.gz PXANHPBHNHEHOB-KXBFYZLASA-N 1 3 345.531 2.890 10 0 EFAEHO c1cc(N2CCCN(C[C@@H]3COC4(CCCCC4)O3)CC2)cc[nH+]1 ZINC001421958800 1379410644 /nfs/dbraw/zinc/41/06/44/1379410644.db2.gz ABLLELPCNLLCJP-GOSISDBHSA-N 1 3 331.460 2.670 10 0 EFAEHO CCCN(C)CC(=O)N(C)[C@H](C)C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001421995537 1379454330 /nfs/dbraw/zinc/45/43/30/1379454330.db2.gz RCGCIVYTJDHJCZ-HUUCEWRRSA-N 1 3 333.467 2.590 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@H]1[NH2+]CC1CC2(CCC2)C1 ZINC001422056558 1379551644 /nfs/dbraw/zinc/55/16/44/1379551644.db2.gz GQQDGXBIOCLYDD-FUHWJXTLSA-N 1 3 349.563 2.981 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@H]2CCC[C@H]([NH+](C)C)C2)CC1 ZINC001422059738 1379554688 /nfs/dbraw/zinc/55/46/88/1379554688.db2.gz DKGXZAXFISXBMY-ROUUACIJSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC(C)([NH2+]CCc3ccccc3)CC2)C1 ZINC001422058862 1379555464 /nfs/dbraw/zinc/55/54/64/1379555464.db2.gz UGNMYJANVSWVHF-SFHVURJKSA-N 1 3 343.515 2.542 10 0 EFAEHO CCC(CC)C[NH2+][C@H](C)[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001422069170 1379569150 /nfs/dbraw/zinc/56/91/50/1379569150.db2.gz YIFPWKLTYLXUGV-AEFFLSMTSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@H+](CCc2ccccc2)CC1(C)C)N(C)C ZINC001422077855 1379580570 /nfs/dbraw/zinc/58/05/70/1379580570.db2.gz BPNMBVSKIODUOH-RTBURBONSA-N 1 3 345.531 2.786 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@@H+](CCc2ccccc2)CC1(C)C)N(C)C ZINC001422077855 1379580574 /nfs/dbraw/zinc/58/05/74/1379580574.db2.gz BPNMBVSKIODUOH-RTBURBONSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@H](C)[NH+]1CCCCCC1)NCc1ccccn1 ZINC001422108306 1379621133 /nfs/dbraw/zinc/62/11/33/1379621133.db2.gz BPXGPCIPWHWSNY-IEBWSBKVSA-N 1 3 346.519 2.577 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CCc2ccccc2F)[C@@H](C)C1 ZINC001422137072 1379669935 /nfs/dbraw/zinc/66/99/35/1379669935.db2.gz VIHXBKJWFAGEIZ-WMZOPIPTSA-N 1 3 349.494 2.678 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CCc2ccccc2F)[C@@H](C)C1 ZINC001422137072 1379669940 /nfs/dbraw/zinc/66/99/40/1379669940.db2.gz VIHXBKJWFAGEIZ-WMZOPIPTSA-N 1 3 349.494 2.678 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H](C(C)C)N(C)C)[NH2+]CC1CC(C)(C)C1 ZINC001422139252 1379673343 /nfs/dbraw/zinc/67/33/43/1379673343.db2.gz YYKJGZILUHDVBH-IRXDYDNUSA-N 1 3 325.541 2.739 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)C(C)(C)[NH+]1CCCC1 ZINC001422180491 1379737177 /nfs/dbraw/zinc/73/71/77/1379737177.db2.gz CDWZWINZTVGYCO-UHFFFAOYSA-N 1 3 331.504 2.760 10 0 EFAEHO COc1cccc([C@@H](C)N(C)CCN(C)C(=O)[C@@H](C(C)C)[NH+](C)C)c1 ZINC001422230019 1379818870 /nfs/dbraw/zinc/81/88/70/1379818870.db2.gz QCFQBQURDYHWFR-VQIMIIECSA-N 1 3 349.519 2.733 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@H+](C)CC[C@@H]1CCCC1(F)F)N(C)C ZINC001422232428 1379822561 /nfs/dbraw/zinc/82/25/61/1379822561.db2.gz VNPABGULLFUASI-HOTGVXAUSA-N 1 3 347.494 2.788 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@@H+](C)CC[C@@H]1CCCC1(F)F)N(C)C ZINC001422232428 1379822564 /nfs/dbraw/zinc/82/25/64/1379822564.db2.gz VNPABGULLFUASI-HOTGVXAUSA-N 1 3 347.494 2.788 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H]2C[N@H+](C)CCc2cccs2)C1 ZINC001422241239 1379841854 /nfs/dbraw/zinc/84/18/54/1379841854.db2.gz DJEKQWWFCNEBPP-SJORKVTESA-N 1 3 349.544 2.555 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H]2C[N@@H+](C)CCc2cccs2)C1 ZINC001422241239 1379841855 /nfs/dbraw/zinc/84/18/55/1379841855.db2.gz DJEKQWWFCNEBPP-SJORKVTESA-N 1 3 349.544 2.555 10 0 EFAEHO Cc1cc(CN(C)C[C@@H]2CCCN2C(=O)CC[NH+](C)C)c(C)s1 ZINC001422252538 1379864213 /nfs/dbraw/zinc/86/42/13/1379864213.db2.gz UOZNAQPGMDMCOW-KRWDZBQOSA-N 1 3 337.533 2.739 10 0 EFAEHO Cc1cc(CN(C)C[C@H]2CCCN2C(=O)CC[NH+](C)C)c(C)s1 ZINC001422252539 1379864234 /nfs/dbraw/zinc/86/42/34/1379864234.db2.gz UOZNAQPGMDMCOW-QGZVFWFLSA-N 1 3 337.533 2.739 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@H]2C[NH2+]CC2CC3(CCC3)C2)CCC1 ZINC001422278556 1379893146 /nfs/dbraw/zinc/89/31/46/1379893146.db2.gz NYUQPVNYIFNZTJ-ZWKOTPCHSA-N 1 3 347.547 2.926 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001422325870 1379932663 /nfs/dbraw/zinc/93/26/63/1379932663.db2.gz NKFKRVPWQOZWHO-HZPDHXFCSA-N 1 3 331.504 2.716 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)CC(C)(C)C)cc1 ZINC001422372724 1379998731 /nfs/dbraw/zinc/99/87/31/1379998731.db2.gz DVUOWXFIXGMJFV-IAGOWNOFSA-N 1 3 333.520 2.956 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)CC(C)(C)C)cc1 ZINC001422372722 1379998818 /nfs/dbraw/zinc/99/88/18/1379998818.db2.gz DVUOWXFIXGMJFV-DLBZAZTESA-N 1 3 333.520 2.956 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)CC(C)(C)C)cc1 ZINC001422372729 1380000644 /nfs/dbraw/zinc/00/06/44/1380000644.db2.gz DVUOWXFIXGMJFV-SJORKVTESA-N 1 3 333.520 2.956 10 0 EFAEHO C[C@@H](NCc1ccccc1F)[C@H](C)NC(=O)CC1CC[NH+](C)CC1 ZINC001422381636 1380010732 /nfs/dbraw/zinc/01/07/32/1380010732.db2.gz SUTRMCUDIQWRDG-CABCVRRESA-N 1 3 335.467 2.540 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)[C@H](C)NCc1ccc(Cl)cc1F ZINC001422413425 1380056611 /nfs/dbraw/zinc/05/66/11/1380056611.db2.gz YLNOQOZCXRVGAX-QWHCGFSZSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)[C@H](C)NCc1ccc(Cl)cc1F ZINC001422413425 1380056619 /nfs/dbraw/zinc/05/66/19/1380056619.db2.gz YLNOQOZCXRVGAX-QWHCGFSZSA-N 1 3 343.874 2.804 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001422416204 1380060163 /nfs/dbraw/zinc/06/01/63/1380060163.db2.gz MJDGAXLYTKCDNK-UONOGXRCSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)Cc2ccc(F)cc2C)CC[N@@H+]1C ZINC001422510985 1380227848 /nfs/dbraw/zinc/22/78/48/1380227848.db2.gz YJSBABPRGNCJOO-AYOQOUSVSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)Cc2ccc(F)cc2C)CC[N@H+]1C ZINC001422510985 1380227851 /nfs/dbraw/zinc/22/78/51/1380227851.db2.gz YJSBABPRGNCJOO-AYOQOUSVSA-N 1 3 349.494 2.801 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1C ZINC001422520200 1380244528 /nfs/dbraw/zinc/24/45/28/1380244528.db2.gz PYRJMZJKSLAYDH-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1C ZINC001422520200 1380244529 /nfs/dbraw/zinc/24/45/29/1380244529.db2.gz PYRJMZJKSLAYDH-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1 ZINC001422527620 1380257714 /nfs/dbraw/zinc/25/77/14/1380257714.db2.gz ZWKPZRCVFKMHEL-MAUKXSAKSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1 ZINC001422527620 1380257715 /nfs/dbraw/zinc/25/77/15/1380257715.db2.gz ZWKPZRCVFKMHEL-MAUKXSAKSA-N 1 3 335.467 2.635 10 0 EFAEHO COc1ccc(CN(C)[C@H](C)CNC(=O)CC[C@@H]2CCC[N@@H+]2C)cc1 ZINC001422530955 1380266080 /nfs/dbraw/zinc/26/60/80/1380266080.db2.gz UTWQRTJEQXOATQ-AEFFLSMTSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1ccc(CN(C)[C@H](C)CNC(=O)CC[C@@H]2CCC[N@H+]2C)cc1 ZINC001422530955 1380266082 /nfs/dbraw/zinc/26/60/82/1380266082.db2.gz UTWQRTJEQXOATQ-AEFFLSMTSA-N 1 3 347.503 2.506 10 0 EFAEHO CCCc1ccc(C[N@H+](C)[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001422563213 1380330842 /nfs/dbraw/zinc/33/08/42/1380330842.db2.gz POYOLCBOFVMVTP-ROUUACIJSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(C[N@@H+](C)[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001422563213 1380330844 /nfs/dbraw/zinc/33/08/44/1380330844.db2.gz POYOLCBOFVMVTP-ROUUACIJSA-N 1 3 345.531 2.917 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(C)cc1C ZINC001422617376 1380442878 /nfs/dbraw/zinc/44/28/78/1380442878.db2.gz JJHVKWAFMKUUHK-MJGOQNOKSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](C)NC(=O)[C@H]2CCC[N@@H+]2C(C)C)n1 ZINC001422643377 1380475811 /nfs/dbraw/zinc/47/58/11/1380475811.db2.gz OJKBSZYRNVSCBQ-QFBILLFUSA-N 1 3 346.519 2.672 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](C)NC(=O)[C@H]2CCC[N@H+]2C(C)C)n1 ZINC001422643377 1380475813 /nfs/dbraw/zinc/47/58/13/1380475813.db2.gz OJKBSZYRNVSCBQ-QFBILLFUSA-N 1 3 346.519 2.672 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@H]1CCCCCN1Cc1ccsc1 ZINC001422722032 1380716484 /nfs/dbraw/zinc/71/64/84/1380716484.db2.gz UVUHNGODDOJCCP-QGZVFWFLSA-N 1 3 337.533 2.951 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@H]1CCCCCN1Cc1ccsc1 ZINC001422722032 1380716500 /nfs/dbraw/zinc/71/65/00/1380716500.db2.gz UVUHNGODDOJCCP-QGZVFWFLSA-N 1 3 337.533 2.951 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)C1C[NH+](CCC2CCCC2)C1 ZINC001422735663 1380734864 /nfs/dbraw/zinc/73/48/64/1380734864.db2.gz FWVPCQQXNMXTSF-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001422804774 1380832543 /nfs/dbraw/zinc/83/25/43/1380832543.db2.gz YZGTXIXTFUMTKG-IRXDYDNUSA-N 1 3 337.552 2.835 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001422804774 1380832550 /nfs/dbraw/zinc/83/25/50/1380832550.db2.gz YZGTXIXTFUMTKG-IRXDYDNUSA-N 1 3 337.552 2.835 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)C[C@@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001422835722 1380890126 /nfs/dbraw/zinc/89/01/26/1380890126.db2.gz PCMLPIRXNCLLGK-HZPDHXFCSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)C[C@@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001422835722 1380890137 /nfs/dbraw/zinc/89/01/37/1380890137.db2.gz PCMLPIRXNCLLGK-HZPDHXFCSA-N 1 3 347.503 2.677 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](CC3CC(C)(C)C3)C[C@@H]2C1 ZINC001422863049 1380961871 /nfs/dbraw/zinc/96/18/71/1380961871.db2.gz CAJDOFCOLNJIJE-CEXWTWQISA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](CC3CC(C)(C)C3)C[C@@H]2C1 ZINC001422863049 1380961878 /nfs/dbraw/zinc/96/18/78/1380961878.db2.gz CAJDOFCOLNJIJE-CEXWTWQISA-N 1 3 349.563 2.980 10 0 EFAEHO CCc1ccc(C[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001422880326 1380993756 /nfs/dbraw/zinc/99/37/56/1380993756.db2.gz SKWPCKLICSVTQC-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(C[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001422880326 1380993761 /nfs/dbraw/zinc/99/37/61/1380993761.db2.gz SKWPCKLICSVTQC-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCCC[C@H]1C[NH2+]CC1CC(F)(F)C1 ZINC001422929598 1381078394 /nfs/dbraw/zinc/07/83/94/1381078394.db2.gz DWHYMWBDFUFLDM-HOTGVXAUSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)[C@@H](CCNC(=O)[C@H]1CCCN1C)[NH2+]C/C(Cl)=C/Cl ZINC001422953178 1381113674 /nfs/dbraw/zinc/11/36/74/1381113674.db2.gz UWGOVTHQINLPPQ-ISESHHHUSA-N 1 3 336.307 2.520 10 0 EFAEHO COc1cccc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCCC2)c1 ZINC001438614622 1388699975 /nfs/dbraw/zinc/69/99/75/1388699975.db2.gz YJQNAWSXZUPYAI-UHFFFAOYSA-N 1 3 347.503 2.554 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001422994585 1381176444 /nfs/dbraw/zinc/17/64/44/1381176444.db2.gz NMKRDYLJQMVAEQ-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]Cc1csc(C)c1)C1CC1 ZINC001423004348 1381191563 /nfs/dbraw/zinc/19/15/63/1381191563.db2.gz PHBOMURFNVUWNJ-QZTJIDSGSA-N 1 3 349.544 2.915 10 0 EFAEHO CC(C)C[C@H](C)C[NH+]1CC2(C1)CCN(C(=O)CN(C)C(C)C)CC2 ZINC001438622619 1388705077 /nfs/dbraw/zinc/70/50/77/1388705077.db2.gz NYBMRISDHCIPRM-SFHVURJKSA-N 1 3 337.552 2.933 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H](NC(=O)C(C)(C)N2CCCC2)C2CC2)cs1 ZINC001423014510 1381210178 /nfs/dbraw/zinc/21/01/78/1381210178.db2.gz SXSNCTLMWYTUJE-KRWDZBQOSA-N 1 3 349.544 2.915 10 0 EFAEHO CCCc1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)[C@@H]2CCCN2C)cc1 ZINC001438636264 1388710212 /nfs/dbraw/zinc/71/02/12/1388710212.db2.gz MVJLVRYYKGSYIW-APWZRJJASA-N 1 3 331.504 2.670 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccsc2)[C@H](CC)C1 ZINC001423067791 1381297016 /nfs/dbraw/zinc/29/70/16/1381297016.db2.gz RGCQZAKSGVQUSV-IAGOWNOFSA-N 1 3 337.533 2.807 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccsc2)[C@@H](CC)C1 ZINC001423067793 1381297332 /nfs/dbraw/zinc/29/73/32/1381297332.db2.gz RGCQZAKSGVQUSV-IRXDYDNUSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@H](F)CN[C@@H](C)CN(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001423083384 1381319102 /nfs/dbraw/zinc/31/91/02/1381319102.db2.gz NCEJSLSNALGCCQ-GJZGRUSLSA-N 1 3 329.504 2.824 10 0 EFAEHO CC[C@H](F)CN[C@@H](C)CN(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001423083384 1381319109 /nfs/dbraw/zinc/31/91/09/1381319109.db2.gz NCEJSLSNALGCCQ-GJZGRUSLSA-N 1 3 329.504 2.824 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001423128682 1381400492 /nfs/dbraw/zinc/40/04/92/1381400492.db2.gz MERXQNYXPIQYEN-FUHWJXTLSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001423128686 1381400841 /nfs/dbraw/zinc/40/08/41/1381400841.db2.gz MERXQNYXPIQYEN-SJLPKXTDSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001423128688 1381401018 /nfs/dbraw/zinc/40/10/18/1381401018.db2.gz MERXQNYXPIQYEN-WMZOPIPTSA-N 1 3 331.504 2.582 10 0 EFAEHO CC(C)c1cccc(CN[C@H](C)CN(C)C(=O)[C@@H](C(C)C)[NH+](C)C)n1 ZINC001423157257 1381463389 /nfs/dbraw/zinc/46/33/89/1381463389.db2.gz KBQAXBBPCSKDCX-VQIMIIECSA-N 1 3 348.535 2.728 10 0 EFAEHO Cc1cc(C)c(CN2CC[C@@H]2CNC(=O)C[C@H]2CC[N@@H+](C)C2)c(C)c1 ZINC001423161786 1381476062 /nfs/dbraw/zinc/47/60/62/1381476062.db2.gz BAJUVQVOLNVRSU-RTBURBONSA-N 1 3 343.515 2.644 10 0 EFAEHO Cc1cc(C)c(CN2CC[C@@H]2CNC(=O)C[C@H]2CC[N@H+](C)C2)c(C)c1 ZINC001423161786 1381476066 /nfs/dbraw/zinc/47/60/66/1381476066.db2.gz BAJUVQVOLNVRSU-RTBURBONSA-N 1 3 343.515 2.644 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N(C)[C@@H](C)CNCc2ccccc2F)C1 ZINC001438680461 1388735973 /nfs/dbraw/zinc/73/59/73/1388735973.db2.gz JJKMEFYAUNEUQD-FUHWJXTLSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N(C)[C@@H](C)CNCc2ccccc2F)C1 ZINC001438680461 1388735978 /nfs/dbraw/zinc/73/59/78/1388735978.db2.gz JJKMEFYAUNEUQD-FUHWJXTLSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@@H](NC1(CNC(=O)CC[NH+](C)C)CC1)c1ccc(F)c(Cl)c1 ZINC001423275569 1381734180 /nfs/dbraw/zinc/73/41/80/1381734180.db2.gz PWKZJWSWQXXMOJ-GFCCVEGCSA-N 1 3 341.858 2.730 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+][C@@H]2CCCc3ccccc32)CC1)N(C)C ZINC001423277408 1381736961 /nfs/dbraw/zinc/73/69/61/1381736961.db2.gz ZMAZDTTVRYEZSR-RTBURBONSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+][C@H]2CCc3ccc(Cl)cc32)CC1 ZINC001423308657 1381765876 /nfs/dbraw/zinc/76/58/76/1381765876.db2.gz TTYRWJKMZVQTPL-KRWDZBQOSA-N 1 3 349.906 2.906 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C(=O)Cc1c[nH]cn1 ZINC001438691734 1388742435 /nfs/dbraw/zinc/74/24/35/1388742435.db2.gz JMUOCIOLSHRDHP-OAHLLOKOSA-N 1 3 340.471 2.856 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@@H]21 ZINC001423351654 1381828453 /nfs/dbraw/zinc/82/84/53/1381828453.db2.gz CLUNIFCAPHCEDK-FGTMMUONSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]Cc3ccccc3)[C@H]2C1 ZINC001423366407 1381855134 /nfs/dbraw/zinc/85/51/34/1381855134.db2.gz WWQPADYMGGCQHO-SLFFLAALSA-N 1 3 343.515 2.744 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@]12CCC[C@H]1N(CCC(F)(F)F)CC2 ZINC001423374412 1381871244 /nfs/dbraw/zinc/87/12/44/1381871244.db2.gz YBJQZRKNMABVNM-ZBFHGGJFSA-N 1 3 349.441 2.784 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@]12CCC[C@H]1N(CCC(F)(F)F)CC2 ZINC001423374412 1381871247 /nfs/dbraw/zinc/87/12/47/1381871247.db2.gz YBJQZRKNMABVNM-ZBFHGGJFSA-N 1 3 349.441 2.784 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)c1 ZINC001423401462 1381908782 /nfs/dbraw/zinc/90/87/82/1381908782.db2.gz JODAHZIDONPTPY-LJQANCHMSA-N 1 3 345.531 2.970 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(C)nc2C)C[C@@H]1C ZINC001423458526 1381960013 /nfs/dbraw/zinc/96/00/13/1381960013.db2.gz WLSVRSQHAIHCCK-QFBILLFUSA-N 1 3 346.519 2.509 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(C)nc2C)C[C@@H]1C ZINC001423458524 1381960776 /nfs/dbraw/zinc/96/07/76/1381960776.db2.gz WLSVRSQHAIHCCK-LPHOPBHVSA-N 1 3 346.519 2.509 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H]1CCCN1C(=O)CC[NH+](C)C ZINC001423476747 1381972754 /nfs/dbraw/zinc/97/27/54/1381972754.db2.gz IJJLQLNRCZNEGJ-OAHLLOKOSA-N 1 3 337.895 2.681 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N1CCC(C)(NC(=O)CC[NH+](C)C)CC1 ZINC001423512654 1382001131 /nfs/dbraw/zinc/00/11/31/1382001131.db2.gz TYXVQVBEKODNTJ-OAHLLOKOSA-N 1 3 335.467 2.809 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H](C)CNCc1cccnc1)[NH+]1CCCCC1 ZINC001438718490 1388760974 /nfs/dbraw/zinc/76/09/74/1388760974.db2.gz YCXLWEMCZFDWJP-MJGOQNOKSA-N 1 3 346.519 2.529 10 0 EFAEHO CCc1ccc(CN2CC[C@](C)(NC(=O)C[C@H]3CC[N@H+](C)C3)C2)cc1 ZINC001423583029 1382114013 /nfs/dbraw/zinc/11/40/13/1382114013.db2.gz JGRQFSRHOIHPRN-CTNGQTDRSA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1ccc(CN2CC[C@](C)(NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)cc1 ZINC001423583029 1382114018 /nfs/dbraw/zinc/11/40/18/1382114018.db2.gz JGRQFSRHOIHPRN-CTNGQTDRSA-N 1 3 343.515 2.671 10 0 EFAEHO CC(C)C[NH2+]C[C@@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)(C)C ZINC001423601099 1382146457 /nfs/dbraw/zinc/14/64/57/1382146457.db2.gz CPLCLZJJLGKHDD-DNVCBOLYSA-N 1 3 343.531 2.975 10 0 EFAEHO CC(C)(C)[C@H](C[NH2+]CC1CC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001423606691 1382155618 /nfs/dbraw/zinc/15/56/18/1382155618.db2.gz NNAPFVUMSHMIJO-HNAYVOBHSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)C[NH2+]C[C@H](NC(=O)[C@@H](C(C)C)N1CCCC1)C(C)(C)C ZINC001423623914 1382184297 /nfs/dbraw/zinc/18/42/97/1382184297.db2.gz XAQHKRMAMMNTTA-DLBZAZTESA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)C[NH2+]C[C@@H](NC(=O)[C@@H](C(C)C)N1CCCC1)C(C)(C)C ZINC001423623927 1382185179 /nfs/dbraw/zinc/18/51/79/1382185179.db2.gz XAQHKRMAMMNTTA-IAGOWNOFSA-N 1 3 325.541 2.883 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1(C)CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001423670583 1382259055 /nfs/dbraw/zinc/25/90/55/1382259055.db2.gz VORYMOAOMYWBPJ-UHFFFAOYSA-N 1 3 346.519 2.915 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H](CNCc1ccccc1F)C1CCCCC1 ZINC001438748714 1388784528 /nfs/dbraw/zinc/78/45/28/1388784528.db2.gz RJZHTEJMJYRWAY-IBGZPJMESA-N 1 3 349.494 2.932 10 0 EFAEHO CCc1ccccc1[C@H](CNC(=O)[C@H](C(C)C)N(C)C)[NH2+]C(C)C ZINC001423923758 1382505142 /nfs/dbraw/zinc/50/51/42/1382505142.db2.gz GSCKEPRRSCVQGI-OALUTQOASA-N 1 3 333.520 2.991 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCc1ccccc1)C2 ZINC001423932960 1382515709 /nfs/dbraw/zinc/51/57/09/1382515709.db2.gz RKXWVZMIBLWOGU-UFYCRDLUSA-N 1 3 343.515 2.538 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCc1ccccc1)C2 ZINC001423932960 1382515716 /nfs/dbraw/zinc/51/57/16/1382515716.db2.gz RKXWVZMIBLWOGU-UFYCRDLUSA-N 1 3 343.515 2.538 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H](C)[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001423951131 1382539275 /nfs/dbraw/zinc/53/92/75/1382539275.db2.gz KCNPWELLFZHCEC-DLBZAZTESA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1C ZINC001423952707 1382541556 /nfs/dbraw/zinc/54/15/56/1382541556.db2.gz XQBIHBBVHGAISP-AZUAARDMSA-N 1 3 345.531 2.828 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([C@@H](C)[NH2+]CCc2ccccc2F)C1 ZINC001423957149 1382545660 /nfs/dbraw/zinc/54/56/60/1382545660.db2.gz QAWOBZRVYNFPFG-AEFFLSMTSA-N 1 3 349.494 2.535 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001438765041 1388795255 /nfs/dbraw/zinc/79/52/55/1388795255.db2.gz FYUQSZSTMMBSBA-AZUAARDMSA-N 1 3 345.531 2.970 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]2[C@@H]1CC[N@@H+]2CCC1CC1)N(CC)CC ZINC001424043473 1382658188 /nfs/dbraw/zinc/65/81/88/1382658188.db2.gz JUBYHQQJYZVXJI-QRVBRYPASA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]2[C@@H]1CC[N@H+]2CCC1CC1)N(CC)CC ZINC001424043473 1382658190 /nfs/dbraw/zinc/65/81/90/1382658190.db2.gz JUBYHQQJYZVXJI-QRVBRYPASA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2[C@H]1CC[N@@H+]2CCC1CC1)N(CC)CC ZINC001424043456 1382658571 /nfs/dbraw/zinc/65/85/71/1382658571.db2.gz JUBYHQQJYZVXJI-CEXWTWQISA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2[C@H]1CC[N@H+]2CCC1CC1)N(CC)CC ZINC001424043456 1382658576 /nfs/dbraw/zinc/65/85/76/1382658576.db2.gz JUBYHQQJYZVXJI-CEXWTWQISA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C)[C@H]1C[NH2+]Cc1ccccc1 ZINC001438771844 1388800648 /nfs/dbraw/zinc/80/06/48/1388800648.db2.gz YGIYLHKNSYMADC-PKOBYXMFSA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CC[NH+](C[C@@H]1CC[C@@H]3C[C@@H]3C1)CC2 ZINC001424105460 1382762316 /nfs/dbraw/zinc/76/23/16/1382762316.db2.gz CRRYXXRPVUAQIO-QRVBRYPASA-N 1 3 347.547 2.687 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)C12CCC[NH+](CCC1)C2 ZINC001424166320 1382816391 /nfs/dbraw/zinc/81/63/91/1382816391.db2.gz WDUXMUREQRIEJD-UHFFFAOYSA-N 1 3 347.528 2.753 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(CNC(=O)[C@H](C)N2CCCCCC2)CCC1 ZINC001424194467 1382848580 /nfs/dbraw/zinc/84/85/80/1382848580.db2.gz AMUXREXWTSBEDK-JKSUJKDBSA-N 1 3 327.488 2.628 10 0 EFAEHO CN(CCC[N@H+](C)Cc1cccc(Cl)c1)C(=O)CN1CCCC1 ZINC001424331596 1382945783 /nfs/dbraw/zinc/94/57/83/1382945783.db2.gz MMQWQTYONXJLSB-UHFFFAOYSA-N 1 3 337.895 2.716 10 0 EFAEHO CN(CCC[N@@H+](C)Cc1cccc(Cl)c1)C(=O)CN1CCCC1 ZINC001424331596 1382945786 /nfs/dbraw/zinc/94/57/86/1382945786.db2.gz MMQWQTYONXJLSB-UHFFFAOYSA-N 1 3 337.895 2.716 10 0 EFAEHO CN(CCC[N@H+](C)[C@@H]1CCc2ccc(F)cc21)C(=O)CN1CCCC1 ZINC001424332848 1382947232 /nfs/dbraw/zinc/94/72/32/1382947232.db2.gz TZGNAPKATQNHKQ-LJQANCHMSA-N 1 3 347.478 2.689 10 0 EFAEHO CN(CCC[N@@H+](C)[C@@H]1CCc2ccc(F)cc21)C(=O)CN1CCCC1 ZINC001424332848 1382947234 /nfs/dbraw/zinc/94/72/34/1382947234.db2.gz TZGNAPKATQNHKQ-LJQANCHMSA-N 1 3 347.478 2.689 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](CNC(=O)CN(C)C2CCC2)C(C)C)c1 ZINC001438803710 1388826361 /nfs/dbraw/zinc/82/63/61/1388826361.db2.gz KSVMVDGXZMIUIX-LJQANCHMSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](CNC(=O)CN(C)C2CCC2)C(C)C)c1 ZINC001438803707 1388826511 /nfs/dbraw/zinc/82/65/11/1388826511.db2.gz KSVMVDGXZMIUIX-IBGZPJMESA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(CC1)CC[NH+](CCC1CC1)CC2 ZINC001424626911 1383216191 /nfs/dbraw/zinc/21/61/91/1383216191.db2.gz KMKHGZXVNVFOMD-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@H+](C)Cc1ccc(CF)cc1 ZINC001424697599 1383270090 /nfs/dbraw/zinc/27/00/90/1383270090.db2.gz KHGCRFROFHKBOI-IBGZPJMESA-N 1 3 349.494 2.919 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@@H+](C)Cc1ccc(CF)cc1 ZINC001424697599 1383270092 /nfs/dbraw/zinc/27/00/92/1383270092.db2.gz KHGCRFROFHKBOI-IBGZPJMESA-N 1 3 349.494 2.919 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@H+](C)C/C=C/c1ccccc1 ZINC001424697915 1383270223 /nfs/dbraw/zinc/27/02/23/1383270223.db2.gz KLGLQWUIWLAEGJ-MEJUDOHFSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@@H+](C)C/C=C/c1ccccc1 ZINC001424697915 1383270225 /nfs/dbraw/zinc/27/02/25/1383270225.db2.gz KLGLQWUIWLAEGJ-MEJUDOHFSA-N 1 3 343.515 2.963 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)C[C@@H]2CCCN2C(=O)CN2CCCC2)cc1 ZINC001424701944 1383273571 /nfs/dbraw/zinc/27/35/71/1383273571.db2.gz SKCUAIIODVRTNZ-FQEVSTJZSA-N 1 3 343.515 2.556 10 0 EFAEHO Cc1ccc(CC[N@H+](C)C[C@@H]2CCCN2C(=O)CN2CCCC2)cc1 ZINC001424701944 1383273581 /nfs/dbraw/zinc/27/35/81/1383273581.db2.gz SKCUAIIODVRTNZ-FQEVSTJZSA-N 1 3 343.515 2.556 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)c(C)c1 ZINC001424806515 1383367704 /nfs/dbraw/zinc/36/77/04/1383367704.db2.gz WUWZHENPDCYHNB-DLBZAZTESA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)cs1 ZINC001424820240 1383379595 /nfs/dbraw/zinc/37/95/95/1383379595.db2.gz NFMPVRUDPHIZOI-LSDHHAIUSA-N 1 3 337.533 2.914 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001424850802 1383415859 /nfs/dbraw/zinc/41/58/59/1383415859.db2.gz RKSWLMVPSISPJX-RYUDHWBXSA-N 1 3 331.913 2.726 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1c(C)cccc1Cl ZINC001424855394 1383423595 /nfs/dbraw/zinc/42/35/95/1383423595.db2.gz WYOZVEADYTYSFT-CABCVRRESA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)[N@H+](C)CC[C@@H]1CCCC1(F)F ZINC001425060010 1383511136 /nfs/dbraw/zinc/51/11/36/1383511136.db2.gz UKVJAVBVRBLZHL-OCCSQVGLSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC001425060010 1383511144 /nfs/dbraw/zinc/51/11/44/1383511144.db2.gz UKVJAVBVRBLZHL-OCCSQVGLSA-N 1 3 342.434 2.523 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1CCCCC[N@@H+]1CCCF)N1CCCCCC1 ZINC001425194619 1383540026 /nfs/dbraw/zinc/54/00/26/1383540026.db2.gz XTUICZPHCOBFAR-MSOLQXFVSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1CCCCC[N@H+]1CCCF)N1CCCCCC1 ZINC001425194619 1383540028 /nfs/dbraw/zinc/54/00/28/1383540028.db2.gz XTUICZPHCOBFAR-MSOLQXFVSA-N 1 3 341.515 2.971 10 0 EFAEHO CCCc1ccc(CN2CC([C@@H](C)NC(=O)CC[NH+](C)C)C2)cc1 ZINC001425265114 1383580454 /nfs/dbraw/zinc/58/04/54/1383580454.db2.gz ZCQXVPNQJBINRQ-MRXNPFEDSA-N 1 3 331.504 2.527 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C1C[NH+](CC2CCC(C)CC2)C1 ZINC001425266260 1383580873 /nfs/dbraw/zinc/58/08/73/1383580873.db2.gz JZJJVBTWXLNFBM-NPCAHTBFSA-N 1 3 332.492 2.523 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H]2C[N@H+](CC3CC3)C[C@@H]2C1)CC(C)(C)C ZINC001425378345 1383638430 /nfs/dbraw/zinc/63/84/30/1383638430.db2.gz FBZACDYSCWVFIN-OKZBNKHCSA-N 1 3 335.536 2.591 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CC3CC3)C[C@@H]2C1)CC(C)(C)C ZINC001425378345 1383638434 /nfs/dbraw/zinc/63/84/34/1383638434.db2.gz FBZACDYSCWVFIN-OKZBNKHCSA-N 1 3 335.536 2.591 10 0 EFAEHO C[C@@H](N[C@@H](C)CN(C)C(=O)CC[NH+](C)C)c1ccccc1Cl ZINC001425643733 1383732661 /nfs/dbraw/zinc/73/26/61/1383732661.db2.gz VSTXMUWPSVKZJD-UONOGXRCSA-N 1 3 325.884 2.789 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H]2C[C@H](C)N(C(=O)CCC[NH+](C)C)C2)c1 ZINC001425886963 1383828592 /nfs/dbraw/zinc/82/85/92/1383828592.db2.gz CRQRXXPIEPVFPV-DOTOQJQBSA-N 1 3 335.467 2.555 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)CCCN1CCCF ZINC001425919465 1383855550 /nfs/dbraw/zinc/85/55/50/1383855550.db2.gz AWKPIYCHIXKHKY-WBVHZDCISA-N 1 3 341.515 2.968 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)CCCN1CCCF ZINC001425919465 1383855554 /nfs/dbraw/zinc/85/55/54/1383855554.db2.gz AWKPIYCHIXKHKY-WBVHZDCISA-N 1 3 341.515 2.968 10 0 EFAEHO CC[C@@H](F)CN[C@@H]1CN(C(=O)CCC[NH+]2CCCCC2)CC1(C)C ZINC001425969385 1383908218 /nfs/dbraw/zinc/90/82/18/1383908218.db2.gz HBCDPGNKMHTEAQ-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]Cc2cccc(C)c2)C(C)(C)C1 ZINC001425969724 1383908261 /nfs/dbraw/zinc/90/82/61/1383908261.db2.gz ICCBNRZMHPLOKQ-SFHVURJKSA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)CCC[NH+]1CCC([C@H](C)NC(=O)CN2CC[C@H](C)C2)CC1 ZINC001426193707 1384061738 /nfs/dbraw/zinc/06/17/38/1384061738.db2.gz PKYRXYHHXULZLQ-ROUUACIJSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C(=O)C12CC[NH+](CC1)C2)C(C)C ZINC001426196631 1384063552 /nfs/dbraw/zinc/06/35/52/1384063552.db2.gz AZGKXSRECAULND-UHFFFAOYSA-N 1 3 343.515 2.760 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC([NH2+]Cc2cc(C)ccc2F)C1)N(C)C ZINC001426223334 1384082436 /nfs/dbraw/zinc/08/24/36/1384082436.db2.gz HWRMVEMPIYTHKL-HTWSVDAQSA-N 1 3 335.467 2.553 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N(C)CCN(C)C(=O)C12CC[NH+](CC1)C2 ZINC001438929761 1388931260 /nfs/dbraw/zinc/93/12/60/1388931260.db2.gz RPGKEFCRXCWEEE-OAHLLOKOSA-N 1 3 349.906 2.887 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2CC2CC3(CCC3)C2)C1 ZINC001438951773 1388948232 /nfs/dbraw/zinc/94/82/32/1388948232.db2.gz OQUGJBPLRFHVJQ-OALUTQOASA-N 1 3 347.547 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2CC2CC3(CCC3)C2)C1 ZINC001438951773 1388948236 /nfs/dbraw/zinc/94/82/36/1388948236.db2.gz OQUGJBPLRFHVJQ-OALUTQOASA-N 1 3 347.547 2.830 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1CCC[C@H]1NC(=O)CN(C)C(C)C ZINC001438961399 1388954588 /nfs/dbraw/zinc/95/45/88/1388954588.db2.gz LUOHXXIKXJNHES-WOJBJXKFSA-N 1 3 345.531 2.964 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CC[C@H](CC(C)(C)C)C1 ZINC001427990818 1385237528 /nfs/dbraw/zinc/23/75/28/1385237528.db2.gz JTTLUCPXXUEGCH-DLBZAZTESA-N 1 3 340.556 2.726 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CC[C@H](CC(C)(C)C)C1 ZINC001427990818 1385237530 /nfs/dbraw/zinc/23/75/30/1385237530.db2.gz JTTLUCPXXUEGCH-DLBZAZTESA-N 1 3 340.556 2.726 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCc2c1cccc2F)C(=O)CN(C)C(C)C ZINC001439087460 1388988368 /nfs/dbraw/zinc/98/83/68/1388988368.db2.gz ZGSGCIFGTNINQG-SFHVURJKSA-N 1 3 335.467 2.591 10 0 EFAEHO C[NH+](C)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC001433657580 1386943743 /nfs/dbraw/zinc/94/37/43/1386943743.db2.gz COVYZTYLPCUQJM-IAGOWNOFSA-N 1 3 328.460 2.893 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1cc(C)sc1C ZINC001439181936 1389036329 /nfs/dbraw/zinc/03/63/29/1389036329.db2.gz IXIAHMWWZIRAQR-CXAGYDPISA-N 1 3 337.533 2.834 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001439242739 1389069257 /nfs/dbraw/zinc/06/92/57/1389069257.db2.gz MVAADYKMPSIYMP-KKUMJFAQSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001439242739 1389069261 /nfs/dbraw/zinc/06/92/61/1389069261.db2.gz MVAADYKMPSIYMP-KKUMJFAQSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N(C)C[C@H](C)NC(=O)C12CC[NH+](CC1)C2 ZINC001439393986 1389231577 /nfs/dbraw/zinc/23/15/77/1389231577.db2.gz APOJVTOGMREJLP-LSDHHAIUSA-N 1 3 349.906 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)Cc1cccc(C(F)F)c1 ZINC001439400643 1389245505 /nfs/dbraw/zinc/24/55/05/1389245505.db2.gz ASTJTQSXAPTICT-CQSZACIVSA-N 1 3 341.446 2.901 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC001439400643 1389245510 /nfs/dbraw/zinc/24/55/10/1389245510.db2.gz ASTJTQSXAPTICT-CQSZACIVSA-N 1 3 341.446 2.901 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@H+](C)Cc1ccc(CF)cc1 ZINC001439400819 1389245716 /nfs/dbraw/zinc/24/57/16/1389245716.db2.gz BKRLHTWLXBFECX-LPHOPBHVSA-N 1 3 349.494 2.967 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc(CF)cc1 ZINC001439400819 1389245724 /nfs/dbraw/zinc/24/57/24/1389245724.db2.gz BKRLHTWLXBFECX-LPHOPBHVSA-N 1 3 349.494 2.967 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CC3CCC(C)CC3)C[C@@H]2C1 ZINC001440147536 1389410208 /nfs/dbraw/zinc/41/02/08/1389410208.db2.gz BFVGKIPOBBDBPZ-YHFFBGSDSA-N 1 3 335.536 2.543 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CC3CCC(C)CC3)C[C@@H]2C1 ZINC001440147536 1389410212 /nfs/dbraw/zinc/41/02/12/1389410212.db2.gz BFVGKIPOBBDBPZ-YHFFBGSDSA-N 1 3 335.536 2.543 10 0 EFAEHO C[C@@H]([NH2+]CC[C@@H]1CCN(C(=O)CN2CCCC2)C1)c1ccccc1F ZINC001440224174 1389454249 /nfs/dbraw/zinc/45/42/49/1389454249.db2.gz XKCFYWIPKFDMPV-IAGOWNOFSA-N 1 3 347.478 2.811 10 0 EFAEHO C[C@H]([NH2+]CC[C@H]1CCN(C(=O)CN2CCCC2)C1)c1ccccc1F ZINC001440224177 1389454262 /nfs/dbraw/zinc/45/42/62/1389454262.db2.gz XKCFYWIPKFDMPV-IRXDYDNUSA-N 1 3 347.478 2.811 10 0 EFAEHO CC(C)C[NH2+][C@H](C)c1ccc(CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001440225895 1389456488 /nfs/dbraw/zinc/45/64/88/1389456488.db2.gz SUXGSVLFBMZVLV-DLBZAZTESA-N 1 3 331.504 2.951 10 0 EFAEHO CN(C[C@@H]1CCN1CCC1CC1)C(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001440240027 1389467317 /nfs/dbraw/zinc/46/73/17/1389467317.db2.gz HSTPUGUGDNVCBW-LPHOPBHVSA-N 1 3 339.499 2.532 10 0 EFAEHO CN(C[C@@H]1CCN1CCC1CC1)C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001440240027 1389467319 /nfs/dbraw/zinc/46/73/19/1389467319.db2.gz HSTPUGUGDNVCBW-LPHOPBHVSA-N 1 3 339.499 2.532 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@@H]([NH2+]CC2CCCC2)C1)N1CCCCC1 ZINC001440278195 1389500211 /nfs/dbraw/zinc/50/02/11/1389500211.db2.gz PPTBFICFWLOTOA-HDICACEKSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(CC(=O)NC[C@H]1C[C@@H]([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)C1)CC(C)(C)C ZINC001440307364 1389518978 /nfs/dbraw/zinc/51/89/78/1389518978.db2.gz SBRHVDCTCNXCKW-FQBWVUSXSA-N 1 3 349.563 2.885 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN3[C@@H](C)CC[C@@H]3C)C2)c1 ZINC001440312390 1389524310 /nfs/dbraw/zinc/52/43/10/1389524310.db2.gz FRKSDBPMNDUTQL-QGZVKYPTSA-N 1 3 343.515 2.852 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(F)c2)C1 ZINC001440315901 1389528794 /nfs/dbraw/zinc/52/87/94/1389528794.db2.gz CXISNFKWOFNJAG-RLFYNMQTSA-N 1 3 335.467 2.711 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]Cc2cccc(F)c2)C1 ZINC001440362660 1389567564 /nfs/dbraw/zinc/56/75/64/1389567564.db2.gz MVTSXDUDQKBEFK-MRHSLFKSSA-N 1 3 347.478 2.683 10 0 EFAEHO C[C@H](N[C@H]1C[C@H](CNC(=O)C[C@@H]2CC[N@H+](C)C2)C1)c1ccccc1F ZINC001440363487 1389568191 /nfs/dbraw/zinc/56/81/91/1389568191.db2.gz HPKLXCSHJPTPLT-QAETUUGQSA-N 1 3 347.478 2.713 10 0 EFAEHO C[C@H](N[C@H]1C[C@H](CNC(=O)C[C@@H]2CC[N@@H+](C)C2)C1)c1ccccc1F ZINC001440363487 1389568195 /nfs/dbraw/zinc/56/81/95/1389568195.db2.gz HPKLXCSHJPTPLT-QAETUUGQSA-N 1 3 347.478 2.713 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CN(CC)C[C@H]1c1ccccc1)[NH+](CC)CC ZINC001440373611 1389574693 /nfs/dbraw/zinc/57/46/93/1389574693.db2.gz RBMIROMNGCQBGC-OTWHNJEPSA-N 1 3 331.504 2.711 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CCCN(CCC(F)(F)F)CC1 ZINC001440389846 1389586673 /nfs/dbraw/zinc/58/66/73/1389586673.db2.gz LZARWCGEDVLBLN-LSDHHAIUSA-N 1 3 349.441 2.784 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CCCN(CCC(F)(F)F)CC1 ZINC001440389846 1389586676 /nfs/dbraw/zinc/58/66/76/1389586676.db2.gz LZARWCGEDVLBLN-LSDHHAIUSA-N 1 3 349.441 2.784 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)CC1 ZINC001440402871 1389600619 /nfs/dbraw/zinc/60/06/19/1389600619.db2.gz LOKGJKITZRSEQC-UYAOXDASSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)CC1 ZINC001440402871 1389600623 /nfs/dbraw/zinc/60/06/23/1389600623.db2.gz LOKGJKITZRSEQC-UYAOXDASSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)CC1 ZINC001440402850 1389600983 /nfs/dbraw/zinc/60/09/83/1389600983.db2.gz LOKGJKITZRSEQC-QUCCMNQESA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@H+]([C@H]2CCc3ccccc32)CC1 ZINC001440402850 1389600984 /nfs/dbraw/zinc/60/09/84/1389600984.db2.gz LOKGJKITZRSEQC-QUCCMNQESA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N(C)C)CC[N@@H+]1CC1CC(F)(F)C1 ZINC001440445269 1389643105 /nfs/dbraw/zinc/64/31/05/1389643105.db2.gz DGQSVWHQOXVSOS-XHSDSOJGSA-N 1 3 345.478 2.587 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N(C)C)CC[N@H+]1CC1CC(F)(F)C1 ZINC001440445269 1389643109 /nfs/dbraw/zinc/64/31/09/1389643109.db2.gz DGQSVWHQOXVSOS-XHSDSOJGSA-N 1 3 345.478 2.587 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@H+](CC3CCC3)[C@H]2C1(C)C ZINC001440457214 1389657338 /nfs/dbraw/zinc/65/73/38/1389657338.db2.gz VFODROZCXBQCQD-QXAKKESOSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@@H+](CC3CCC3)[C@H]2C1(C)C ZINC001440457214 1389657341 /nfs/dbraw/zinc/65/73/41/1389657341.db2.gz VFODROZCXBQCQD-QXAKKESOSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001440463367 1389664929 /nfs/dbraw/zinc/66/49/29/1389664929.db2.gz FVKWBBJIEQMJOB-MAUKXSAKSA-N 1 3 347.494 2.727 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001440463367 1389664932 /nfs/dbraw/zinc/66/49/32/1389664932.db2.gz FVKWBBJIEQMJOB-MAUKXSAKSA-N 1 3 347.494 2.727 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[N@H+](CCC3CC3)CC(C)(C)C2)CCC1 ZINC001440527359 1389729806 /nfs/dbraw/zinc/72/98/06/1389729806.db2.gz BMUADGJIOLZWOX-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[N@@H+](CCC3CC3)CC(C)(C)C2)CCC1 ZINC001440527359 1389729808 /nfs/dbraw/zinc/72/98/08/1389729808.db2.gz BMUADGJIOLZWOX-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO CCC1([NH2+]Cc2ccc(F)cc2)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001440533400 1389736868 /nfs/dbraw/zinc/73/68/68/1389736868.db2.gz SQIUESBSLZHUPW-UHFFFAOYSA-N 1 3 344.434 2.652 10 0 EFAEHO CC(C)CN1Cc2ccccc2C[C@H]1CNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001440544877 1389746655 /nfs/dbraw/zinc/74/66/55/1389746655.db2.gz QSBATEDIQDJUNC-XLIONFOSSA-N 1 3 343.515 2.527 10 0 EFAEHO CC(C)CN1Cc2ccccc2C[C@H]1CNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001440544877 1389746656 /nfs/dbraw/zinc/74/66/56/1389746656.db2.gz QSBATEDIQDJUNC-XLIONFOSSA-N 1 3 343.515 2.527 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H]([NH2+]Cc2cccc(Cl)c2)C1 ZINC001440589517 1389762046 /nfs/dbraw/zinc/76/20/46/1389762046.db2.gz BWPXXXMMSNOULX-PBHICJAKSA-N 1 3 337.895 2.617 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]CC=C(Cl)Cl)CC1 ZINC001440604944 1389768811 /nfs/dbraw/zinc/76/88/11/1389768811.db2.gz LHJDXITYCSIAEX-UHFFFAOYSA-N 1 3 336.307 2.618 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@H]1[NH2+]Cc1ccsc1 ZINC001440609993 1389771900 /nfs/dbraw/zinc/77/19/00/1389771900.db2.gz PUKWLSOAEAEXJI-GOEBONIOSA-N 1 3 337.533 2.663 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1[NH2+]Cc1ccsc1 ZINC001440609995 1389771971 /nfs/dbraw/zinc/77/19/71/1389771971.db2.gz PUKWLSOAEAEXJI-ZBFHGGJFSA-N 1 3 337.533 2.663 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001440739228 1389860714 /nfs/dbraw/zinc/86/07/14/1389860714.db2.gz JLSGGKWSBWELLA-IBGZPJMESA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001440739228 1389860718 /nfs/dbraw/zinc/86/07/18/1389860718.db2.gz JLSGGKWSBWELLA-IBGZPJMESA-N 1 3 337.552 2.933 10 0 EFAEHO Cc1cc(C[NH2+]CC2CC(NC(=O)CN(C)C3CCC3)C2)cs1 ZINC001440757936 1389873059 /nfs/dbraw/zinc/87/30/59/1389873059.db2.gz LQXXAFZEUXYFJA-UHFFFAOYSA-N 1 3 335.517 2.525 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]Cc1ccc(CF)cc1 ZINC001440797810 1389904571 /nfs/dbraw/zinc/90/45/71/1389904571.db2.gz MYHQFNJFRGPKKU-LSDHHAIUSA-N 1 3 335.467 2.623 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001440805097 1389910240 /nfs/dbraw/zinc/91/02/40/1389910240.db2.gz YZCXKJIDTMNFQJ-HZPDHXFCSA-N 1 3 343.515 2.642 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001440805100 1389910773 /nfs/dbraw/zinc/91/07/73/1389910773.db2.gz YZCXKJIDTMNFQJ-JKSUJKDBSA-N 1 3 343.515 2.642 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H](C)[NH2+]CC1CCC(C)(C)CC1 ZINC001440831764 1389932496 /nfs/dbraw/zinc/93/24/96/1389932496.db2.gz ACMOMNIIMVSPPE-UONOGXRCSA-N 1 3 334.508 2.960 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001440853630 1389954678 /nfs/dbraw/zinc/95/46/78/1389954678.db2.gz XIBCKPIJGOQELL-NEPJUHHUSA-N 1 3 342.434 2.569 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[N@H+](C)CCc1cccs1 ZINC001440921954 1390009933 /nfs/dbraw/zinc/00/99/33/1390009933.db2.gz UFIJWBXEBXFCME-NVXWUHKLSA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[N@@H+](C)CCc1cccs1 ZINC001440921954 1390009938 /nfs/dbraw/zinc/00/99/38/1390009938.db2.gz UFIJWBXEBXFCME-NVXWUHKLSA-N 1 3 337.533 2.600 10 0 EFAEHO C[C@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)N(C)Cc1cccc(F)c1 ZINC001440934000 1390021359 /nfs/dbraw/zinc/02/13/59/1390021359.db2.gz IEXDWVAFUOZZOW-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)N(C)Cc1cccc(F)c1 ZINC001440934000 1390021364 /nfs/dbraw/zinc/02/13/64/1390021364.db2.gz IEXDWVAFUOZZOW-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H](C)[N@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001440934964 1390023192 /nfs/dbraw/zinc/02/31/92/1390023192.db2.gz KZUMACPNXDEKFI-BEFAXECRSA-N 1 3 344.503 2.691 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001440934964 1390023196 /nfs/dbraw/zinc/02/31/96/1390023196.db2.gz KZUMACPNXDEKFI-BEFAXECRSA-N 1 3 344.503 2.691 10 0 EFAEHO C[C@H](CCC[NH2+]CC=C(Cl)Cl)NC(=O)C1(N(C)C)CCC1 ZINC001506926046 1406452461 /nfs/dbraw/zinc/45/24/61/1406452461.db2.gz ZTSUVJMTLFYDCN-GFCCVEGCSA-N 1 3 336.307 2.664 10 0 EFAEHO C[C@H](CCC[NH2+]Cc1ccccc1F)NC(=O)CN1CC[C@@H](C)C1 ZINC001506937424 1406467440 /nfs/dbraw/zinc/46/74/40/1406467440.db2.gz APLQYXQLDHHIFP-HZPDHXFCSA-N 1 3 335.467 2.542 10 0 EFAEHO C[C@H](CCC[NH2+]C/C=C/Cl)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001506938396 1406468882 /nfs/dbraw/zinc/46/88/82/1406468882.db2.gz QNFOWAOOMSUVSC-IVXVGSNXSA-N 1 3 347.906 2.826 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)N(C)Cc1cccc(C(F)F)c1 ZINC001441009120 1391029842 /nfs/dbraw/zinc/02/98/42/1391029842.db2.gz IKFGVNSSUKDPSH-CJNGLKHVSA-N 1 3 339.430 2.512 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)N(C)Cc1cccc(C(F)F)c1 ZINC001441009120 1391029843 /nfs/dbraw/zinc/02/98/43/1391029843.db2.gz IKFGVNSSUKDPSH-CJNGLKHVSA-N 1 3 339.430 2.512 10 0 EFAEHO CCc1ccc(CN2CC[C@@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)cc1 ZINC001441099932 1391091828 /nfs/dbraw/zinc/09/18/28/1391091828.db2.gz WMYLSDBHHZLYKK-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccc(CN2CC[C@@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)cc1 ZINC001441099932 1391091830 /nfs/dbraw/zinc/09/18/30/1391091830.db2.gz WMYLSDBHHZLYKK-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCCCCN2CCC(F)(F)F)C1 ZINC001441143631 1391140472 /nfs/dbraw/zinc/14/04/72/1391140472.db2.gz ZLTSFYDICSEMGB-GJZGRUSLSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCCCCN2CCC(F)(F)F)C1 ZINC001441143631 1391140475 /nfs/dbraw/zinc/14/04/75/1391140475.db2.gz ZLTSFYDICSEMGB-GJZGRUSLSA-N 1 3 349.441 2.641 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+][C@H]1CCc2ccccc21 ZINC001506947440 1406483880 /nfs/dbraw/zinc/48/38/80/1406483880.db2.gz YPAABMTYNWPOMA-KSSFIOAISA-N 1 3 340.471 2.823 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C1CN(Cc2ccccc2)C1)[NH+]1CCCC1 ZINC001441215250 1391187040 /nfs/dbraw/zinc/18/70/40/1391187040.db2.gz UAOBCOZPBHFYSX-FXAWDEMLSA-N 1 3 343.515 2.744 10 0 EFAEHO C[C@H](F)CC[N@H+](C)C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001441303407 1391242752 /nfs/dbraw/zinc/24/27/52/1391242752.db2.gz RDVPYESUIWGCMO-IRXDYDNUSA-N 1 3 343.531 2.883 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001441303407 1391242755 /nfs/dbraw/zinc/24/27/55/1391242755.db2.gz RDVPYESUIWGCMO-IRXDYDNUSA-N 1 3 343.531 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](Cc3ccsc3)C[C@@H]2C1 ZINC001441341839 1391259569 /nfs/dbraw/zinc/25/95/69/1391259569.db2.gz QEZGWCVJPCWFCT-OKZBNKHCSA-N 1 3 349.544 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccsc3)C[C@@H]2C1 ZINC001441341839 1391259571 /nfs/dbraw/zinc/25/95/71/1391259571.db2.gz QEZGWCVJPCWFCT-OKZBNKHCSA-N 1 3 349.544 2.805 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)c(C)s1 ZINC001441366789 1391267979 /nfs/dbraw/zinc/26/79/79/1391267979.db2.gz SQFXYMYGJWXSQT-JCNLHEQBSA-N 1 3 337.533 2.690 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@@H]2CCc3ccc(F)cc32)C1 ZINC001441383421 1391274614 /nfs/dbraw/zinc/27/46/14/1391274614.db2.gz ZLQTZJBIBCQXEP-LSBZLQRGSA-N 1 3 347.478 2.639 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc(C(C)C)cc2)C1)N(C)C ZINC001441402635 1391285082 /nfs/dbraw/zinc/28/50/82/1391285082.db2.gz IOJIJSJJGDUPII-FHWLQOOXSA-N 1 3 331.504 2.887 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]([NH2+][C@H]2CCc3ccccc32)C1)CC(C)(C)C ZINC001441406088 1391287311 /nfs/dbraw/zinc/28/73/11/1391287311.db2.gz VORFAPLQIITBBA-LNLFQRSKSA-N 1 3 343.515 2.889 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)C3CCC3)C2)c(Cl)c1 ZINC001441491379 1391333337 /nfs/dbraw/zinc/33/33/37/1391333337.db2.gz UJCNZKDRBGVONZ-IYBDPMFKSA-N 1 3 349.906 2.870 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001441537456 1391354294 /nfs/dbraw/zinc/35/42/94/1391354294.db2.gz LXKBAGVFXDIKOH-SJLPKXTDSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001441537456 1391354299 /nfs/dbraw/zinc/35/42/99/1391354299.db2.gz LXKBAGVFXDIKOH-SJLPKXTDSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001441539621 1391355594 /nfs/dbraw/zinc/35/55/94/1391355594.db2.gz NTKXIAXTJUJRQZ-DGCLKSJQSA-N 1 3 331.913 2.678 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CCC([NH2+]CCc2cccs2)CC1 ZINC001441741694 1391412340 /nfs/dbraw/zinc/41/23/40/1391412340.db2.gz SBNBKSOMYGNFKN-UHFFFAOYSA-N 1 3 337.533 2.648 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C2CCC(NC(=O)CN(C)C(C)C)CC2)c1 ZINC001441740051 1391412357 /nfs/dbraw/zinc/41/23/57/1391412357.db2.gz JZBONJQAYPPDID-UHFFFAOYSA-N 1 3 349.494 2.991 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H]2C)c1 ZINC001441825999 1391420876 /nfs/dbraw/zinc/42/08/76/1391420876.db2.gz TVTQWYUNOQGUET-QFBILLFUSA-N 1 3 331.504 2.668 10 0 EFAEHO O=C(Nc1ccn(-c2cc[nH+]cc2)n1)c1ccc(CN2CCCC2)o1 ZINC001444219617 1391463434 /nfs/dbraw/zinc/46/34/34/1391463434.db2.gz FEQVOKLFHUISJP-UHFFFAOYSA-N 1 3 337.383 2.708 10 0 EFAEHO C[C@@H](C[NH2+]C[C@@H]1CCC(F)(F)C1)NC(=O)C(C)(C)N1CCCCC1 ZINC001445550208 1391533017 /nfs/dbraw/zinc/53/30/17/1391533017.db2.gz XLNBLYVADJYJRK-LSDHHAIUSA-N 1 3 345.478 2.781 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001446937697 1391640867 /nfs/dbraw/zinc/64/08/67/1391640867.db2.gz FHKMGGMKBUAXAA-PXNSSMCTSA-N 1 3 345.531 2.916 10 0 EFAEHO CC(C)C[NH2+]C[C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@@H]1C ZINC001446943234 1391642194 /nfs/dbraw/zinc/64/21/94/1391642194.db2.gz REINCSLNWYMTOK-QFBILLFUSA-N 1 3 331.504 2.702 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1C[NH2+]CC1CCCC1 ZINC001446973306 1391649366 /nfs/dbraw/zinc/64/93/66/1391649366.db2.gz PNGLJTRNETYJIY-AEFFLSMTSA-N 1 3 337.552 2.839 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccsc1 ZINC001447045242 1391672660 /nfs/dbraw/zinc/67/26/60/1391672660.db2.gz SKHPYCBXNDMGKR-DLBZAZTESA-N 1 3 335.517 2.655 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccsc1 ZINC001447045242 1391672662 /nfs/dbraw/zinc/67/26/62/1391672662.db2.gz SKHPYCBXNDMGKR-DLBZAZTESA-N 1 3 335.517 2.655 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CCc2ccccc2)CC1(C)C ZINC001447606821 1391718861 /nfs/dbraw/zinc/71/88/61/1391718861.db2.gz XLNCVTGOLNUEAX-LJQANCHMSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CCc2ccccc2)CC1(C)C ZINC001447606821 1391718866 /nfs/dbraw/zinc/71/88/66/1391718866.db2.gz XLNCVTGOLNUEAX-LJQANCHMSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H](C)[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001447668558 1391728515 /nfs/dbraw/zinc/72/85/15/1391728515.db2.gz KHTCXSVPCTVNBS-ARFHVFGLSA-N 1 3 347.494 2.883 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C1CCC([NH2+]C/C=C\Cl)CC1 ZINC001447943750 1391846394 /nfs/dbraw/zinc/84/63/94/1391846394.db2.gz CLOYHHSSYIPXJO-NWHLJZBTSA-N 1 3 341.927 2.973 10 0 EFAEHO Cc1ccc(CN(C)[C@@H](C)CNC(=O)[C@@H]2CCC[N@H+]2C(C)C)cc1F ZINC001448035519 1391906063 /nfs/dbraw/zinc/90/60/63/1391906063.db2.gz LSVUUGNYWPLMSW-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(CN(C)[C@@H](C)CNC(=O)[C@@H]2CCC[N@@H+]2C(C)C)cc1F ZINC001448035519 1391906065 /nfs/dbraw/zinc/90/60/65/1391906065.db2.gz LSVUUGNYWPLMSW-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@@H](C)CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001448042150 1391912801 /nfs/dbraw/zinc/91/28/01/1391912801.db2.gz OPHMTFSUJDTTHH-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@@H](C)CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001448042150 1391912804 /nfs/dbraw/zinc/91/28/04/1391912804.db2.gz OPHMTFSUJDTTHH-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[N@H+](C)CCCc1cccc(F)c1 ZINC001448100015 1391958472 /nfs/dbraw/zinc/95/84/72/1391958472.db2.gz SMOFVPIYJHMPHC-DLBZAZTESA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[N@@H+](C)CCCc1cccc(F)c1 ZINC001448100015 1391958479 /nfs/dbraw/zinc/95/84/79/1391958479.db2.gz SMOFVPIYJHMPHC-DLBZAZTESA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[N@H+](C)CC/C=C\c1ccccc1 ZINC001448103996 1391965620 /nfs/dbraw/zinc/96/56/20/1391965620.db2.gz ZEMCHQOTBOVVJE-OFIWPEFUSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[N@@H+](C)CC/C=C\c1ccccc1 ZINC001448103996 1391965626 /nfs/dbraw/zinc/96/56/26/1391965626.db2.gz ZEMCHQOTBOVVJE-OFIWPEFUSA-N 1 3 343.515 2.868 10 0 EFAEHO CCCN(C)CC(=O)NC1(C[NH2+]Cc2ccsc2)CCCCC1 ZINC001448225099 1392032701 /nfs/dbraw/zinc/03/27/01/1392032701.db2.gz DHTKHSMWZDDPND-UHFFFAOYSA-N 1 3 337.533 2.999 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001448551511 1392087409 /nfs/dbraw/zinc/08/74/09/1392087409.db2.gz KQIOYJSNACLVAQ-KURKYZTESA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001448551511 1392087416 /nfs/dbraw/zinc/08/74/16/1392087416.db2.gz KQIOYJSNACLVAQ-KURKYZTESA-N 1 3 335.536 2.686 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001449074500 1392251091 /nfs/dbraw/zinc/25/10/91/1392251091.db2.gz BYBCJJDDJZIJJU-HUUCEWRRSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)[C@@H](CCNC(=O)CN1CCCC1)[NH2+]C/C(Cl)=C\Cl ZINC001506992413 1406559819 /nfs/dbraw/zinc/55/98/19/1406559819.db2.gz GQRSKKZJNADNFI-KADHNRKRSA-N 1 3 336.307 2.522 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N(C)[C@@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001507012832 1406587768 /nfs/dbraw/zinc/58/77/68/1406587768.db2.gz MWZRCSHCOKAESE-MOPGFXCFSA-N 1 3 335.536 2.876 10 0 EFAEHO CN(C)C1(C(=O)N(C)[C@H](C[NH2+]CC2CC3(CCC3)C2)C2CC2)CCC1 ZINC001507013526 1406589456 /nfs/dbraw/zinc/58/94/56/1406589456.db2.gz YJYWXELUUCJREL-GOSISDBHSA-N 1 3 347.547 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001507037622 1406625503 /nfs/dbraw/zinc/62/55/03/1406625503.db2.gz WUEVXCMNGAUPBY-SFHVURJKSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@@H]1CCCN1C)[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001507064954 1406656889 /nfs/dbraw/zinc/65/68/89/1406656889.db2.gz YAAYPPPHSQZDJU-LRDDRELGSA-N 1 3 341.858 2.510 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)[C@H](C(C)C)[NH+](C)C)c1 ZINC001507086443 1406683158 /nfs/dbraw/zinc/68/31/58/1406683158.db2.gz SIPBFIQXTGZLIA-YJBOKZPZSA-N 1 3 337.483 2.657 10 0 EFAEHO C[C@H](CN(C)C(=O)C12CCC[NH+](CCC1)C2)NCc1ccsc1 ZINC001507089828 1406688374 /nfs/dbraw/zinc/68/83/74/1406688374.db2.gz QIIIUCPPPVQLBY-OAHLLOKOSA-N 1 3 335.517 2.561 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN(C)C1CCC1)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001507092152 1406690604 /nfs/dbraw/zinc/69/06/04/1406690604.db2.gz XNWGYTCMLUVUEG-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001507126893 1406738975 /nfs/dbraw/zinc/73/89/75/1406738975.db2.gz OPOBFVUMQFMXBB-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccccc1C1CC1 ZINC001507128954 1406743643 /nfs/dbraw/zinc/74/36/43/1406743643.db2.gz WGWGUKPPJPJGOY-IRXDYDNUSA-N 1 3 343.515 2.842 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1csc(C)c1 ZINC001507161007 1406789949 /nfs/dbraw/zinc/78/99/49/1406789949.db2.gz HIAXGXZRAITLKR-PBHICJAKSA-N 1 3 337.533 2.867 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@H](C)NCc1ccccc1F)[NH+]1CCCC1 ZINC001507161131 1406790361 /nfs/dbraw/zinc/79/03/61/1406790361.db2.gz ISOFPWROBMKXDE-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO CC[C@@H]1CC[C@H](C)[N@H+](CC(=O)NC[C@H](c2ccccc2)N(C)C)C1 ZINC001460094612 1396003961 /nfs/dbraw/zinc/00/39/61/1396003961.db2.gz BOKGJVKFLGYZPF-YQVWRLOYSA-N 1 3 331.504 2.916 10 0 EFAEHO CC[C@@H]1CC[C@H](C)[N@@H+](CC(=O)NC[C@H](c2ccccc2)N(C)C)C1 ZINC001460094612 1396003966 /nfs/dbraw/zinc/00/39/66/1396003966.db2.gz BOKGJVKFLGYZPF-YQVWRLOYSA-N 1 3 331.504 2.916 10 0 EFAEHO C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001464212368 1396556407 /nfs/dbraw/zinc/55/64/07/1396556407.db2.gz CPGYWMOYSHZXKN-IRXDYDNUSA-N 1 3 325.541 2.839 10 0 EFAEHO Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)[C@H](C)CC[NH+](C)C ZINC001468657123 1396977231 /nfs/dbraw/zinc/97/72/31/1396977231.db2.gz NOEDPOSBEFDPPA-SZVBFZGTSA-N 1 3 329.488 2.717 10 0 EFAEHO CC[NH+](CC)CCO[C@@H]1CCN(Cc2c[nH]c(=O)c3ccccc23)C1 ZINC001473212992 1397290084 /nfs/dbraw/zinc/29/00/84/1397290084.db2.gz FXAKFSHKKXOMAY-QGZVFWFLSA-N 1 3 343.471 2.873 10 0 EFAEHO C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C[N@@H+]1CCC[C@@H](N(C)C)CC1 ZINC001473380074 1397298380 /nfs/dbraw/zinc/29/83/80/1397298380.db2.gz ORGMTOUNWSSONJ-BRWVUGGUSA-N 1 3 339.524 2.906 10 0 EFAEHO C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C[N@H+]1CCC[C@@H](N(C)C)CC1 ZINC001473380074 1397298382 /nfs/dbraw/zinc/29/83/82/1397298382.db2.gz ORGMTOUNWSSONJ-BRWVUGGUSA-N 1 3 339.524 2.906 10 0 EFAEHO C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CN1CCC[C@@H]([NH+](C)C)CC1 ZINC001473380074 1397298383 /nfs/dbraw/zinc/29/83/83/1397298383.db2.gz ORGMTOUNWSSONJ-BRWVUGGUSA-N 1 3 339.524 2.906 10 0 EFAEHO CN(C)[C@@H](CNC(=O)C[N@@H+]1CCC[C@@H](C2CCC2)C1)c1ccccc1 ZINC001473656889 1397319515 /nfs/dbraw/zinc/31/95/15/1397319515.db2.gz ALQHTERCFGSDNB-UXHICEINSA-N 1 3 343.515 2.918 10 0 EFAEHO CN(C)[C@@H](CNC(=O)C[N@H+]1CCC[C@@H](C2CCC2)C1)c1ccccc1 ZINC001473656889 1397319519 /nfs/dbraw/zinc/31/95/19/1397319519.db2.gz ALQHTERCFGSDNB-UXHICEINSA-N 1 3 343.515 2.918 10 0 EFAEHO c1cc(C[NH2+]Cc2ccnc(OCC3CC3)c2)n(-c2ccncc2)n1 ZINC001473980073 1397360208 /nfs/dbraw/zinc/36/02/08/1397360208.db2.gz OMHPZEKUVVFWDE-UHFFFAOYSA-N 1 3 335.411 2.741 10 0 EFAEHO c1cc(CNCc2ccnc(OCC3CC3)c2)n(-c2cc[nH+]cc2)n1 ZINC001473980073 1397360215 /nfs/dbraw/zinc/36/02/15/1397360215.db2.gz OMHPZEKUVVFWDE-UHFFFAOYSA-N 1 3 335.411 2.741 10 0 EFAEHO CN(C[C@@H]1CCN1[C@H]1CCCc2ccccc21)C(=O)CC[NH+](C)C ZINC001479242861 1397636104 /nfs/dbraw/zinc/63/61/04/1397636104.db2.gz LJLIOVVDHKWTMU-HKUYNNGSSA-N 1 3 329.488 2.548 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+][C@H]1C[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001479348078 1397699817 /nfs/dbraw/zinc/69/98/17/1397699817.db2.gz NHDRZMQOJPKTBC-KURKYZTESA-N 1 3 331.504 2.881 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2C[C@H](CNC(=O)CN(C)C3CCC3)C2)c1 ZINC001479371286 1397706323 /nfs/dbraw/zinc/70/63/23/1397706323.db2.gz LPJZTQJHXZKVFX-JCNLHEQBSA-N 1 3 347.478 2.603 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]CC2CC(C)(C)C2)C1 ZINC001479416764 1397720692 /nfs/dbraw/zinc/72/06/92/1397720692.db2.gz MPELTXOXXJICMX-OVWQWFNUSA-N 1 3 335.536 2.780 10 0 EFAEHO CC[C@H](F)C[NH2+][C@@H]1CC[C@H](CNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001479453323 1397729068 /nfs/dbraw/zinc/72/90/68/1397729068.db2.gz WSTLFPJJLMEETH-YESZJQIVSA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@H]1CC[NH2+]Cc1ccsc1 ZINC001479522637 1397749540 /nfs/dbraw/zinc/74/95/40/1397749540.db2.gz LPKQHOJTGSFCHS-PBHICJAKSA-N 1 3 346.500 2.821 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[N@H+](C)Cc1ccccc1 ZINC001479738789 1397792205 /nfs/dbraw/zinc/79/22/05/1397792205.db2.gz KIDQFIXBVOGLDG-IBGZPJMESA-N 1 3 331.504 2.841 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[N@@H+](C)Cc1ccccc1 ZINC001479738789 1397792217 /nfs/dbraw/zinc/79/22/17/1397792217.db2.gz KIDQFIXBVOGLDG-IBGZPJMESA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001479796083 1397874934 /nfs/dbraw/zinc/87/49/34/1397874934.db2.gz BKAQTNKEJBIBDZ-QAPCUYQASA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001479796083 1397874939 /nfs/dbraw/zinc/87/49/39/1397874939.db2.gz BKAQTNKEJBIBDZ-QAPCUYQASA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](C)CC2CCC3(CC3)CC2)C1 ZINC001479796570 1397876656 /nfs/dbraw/zinc/87/66/56/1397876656.db2.gz JPPNKMOZGONUCE-KRWDZBQOSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](C)CC2CCC3(CC3)CC2)C1 ZINC001479796570 1397876663 /nfs/dbraw/zinc/87/66/63/1397876663.db2.gz JPPNKMOZGONUCE-KRWDZBQOSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](C)CC2CCC3(CC3)CC2)C1 ZINC001479796571 1397877500 /nfs/dbraw/zinc/87/75/00/1397877500.db2.gz JPPNKMOZGONUCE-QGZVFWFLSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](C)CC2CCC3(CC3)CC2)C1 ZINC001479796571 1397877505 /nfs/dbraw/zinc/87/75/05/1397877505.db2.gz JPPNKMOZGONUCE-QGZVFWFLSA-N 1 3 335.536 2.737 10 0 EFAEHO Cc1cccnc1CN(C)CCCNC(=O)[C@H](C)[NH+]1CCCCCC1 ZINC001479800739 1397886395 /nfs/dbraw/zinc/88/63/95/1397886395.db2.gz UCHCLTBNXOFFJS-SFHVURJKSA-N 1 3 346.519 2.593 10 0 EFAEHO O=C(NCCCN(Cc1ccsc1)C1CC1)[C@H]1C[NH+]2CCC1CC2 ZINC001479868539 1397976898 /nfs/dbraw/zinc/97/68/98/1397976898.db2.gz ICTCWXYFSJHPTG-SFHVURJKSA-N 1 3 347.528 2.561 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[N@H+](Cc1cccc(Cl)c1)C1CC1 ZINC001479873801 1397984219 /nfs/dbraw/zinc/98/42/19/1397984219.db2.gz GGPBWPXDZGSIDJ-GOSISDBHSA-N 1 3 349.906 2.905 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[N@@H+](Cc1cccc(Cl)c1)C1CC1 ZINC001479873801 1397984222 /nfs/dbraw/zinc/98/42/22/1397984222.db2.gz GGPBWPXDZGSIDJ-GOSISDBHSA-N 1 3 349.906 2.905 10 0 EFAEHO CCC[N@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001479876786 1397990451 /nfs/dbraw/zinc/99/04/51/1397990451.db2.gz VNSOOTPCIYWGPN-SFHVURJKSA-N 1 3 327.488 2.580 10 0 EFAEHO CCC[N@@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001479876786 1397990455 /nfs/dbraw/zinc/99/04/55/1397990455.db2.gz VNSOOTPCIYWGPN-SFHVURJKSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](F)CC[NH+]1CCC(N(C)C(=O)CN(C)CC(C)(C)C)CC1 ZINC001479893688 1398007311 /nfs/dbraw/zinc/00/73/11/1398007311.db2.gz WMPZFBKYYWKPHM-HNNXBMFYSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCN(CC2=CCCCC2)C1)[NH+]1CCCC1 ZINC001479973143 1398058765 /nfs/dbraw/zinc/05/87/65/1398058765.db2.gz XMPDVSBNYGZFOI-RTBURBONSA-N 1 3 333.520 2.798 10 0 EFAEHO C[C@H]([NH2+][C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)C1)c1ccccc1F ZINC001480208204 1398165171 /nfs/dbraw/zinc/16/51/71/1398165171.db2.gz QTRSKCGLQRRKSJ-SOUVJXGZSA-N 1 3 333.451 2.608 10 0 EFAEHO C[C@H](C(=O)NC[C@H](C)NCc1ccccc1F)[NH+]1CCCCCC1 ZINC001480548825 1398202510 /nfs/dbraw/zinc/20/25/10/1398202510.db2.gz OOLSRTNJLGUOAY-JKSUJKDBSA-N 1 3 335.467 2.685 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1CCN(C(=O)CN(C)C2CCC2)C1 ZINC001480615835 1398249880 /nfs/dbraw/zinc/24/98/80/1398249880.db2.gz FREJDSYQGNRSKU-IBGZPJMESA-N 1 3 343.515 2.602 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1C(=O)N1CC[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001480681325 1398279742 /nfs/dbraw/zinc/27/97/42/1398279742.db2.gz YPTRJYIWKDDYTO-TWBVXLPBSA-N 1 3 348.318 2.618 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1C(=O)N1CC[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001480681325 1398279746 /nfs/dbraw/zinc/27/97/46/1398279746.db2.gz YPTRJYIWKDDYTO-TWBVXLPBSA-N 1 3 348.318 2.618 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001480681849 1398280023 /nfs/dbraw/zinc/28/00/23/1398280023.db2.gz AIGVZSQQYYBPAT-GOSISDBHSA-N 1 3 331.504 2.582 10 0 EFAEHO CN(CC(=O)NCCC[C@@H]1CCC[N@@H+]1C/C=C/Cl)C1CCC1 ZINC001480826771 1398335648 /nfs/dbraw/zinc/33/56/48/1398335648.db2.gz SQEZXBKLEDVUDF-ZWIJEDICSA-N 1 3 327.900 2.584 10 0 EFAEHO CN(CC(=O)NCCC[C@@H]1CCC[N@H+]1C/C=C/Cl)C1CCC1 ZINC001480826771 1398335654 /nfs/dbraw/zinc/33/56/54/1398335654.db2.gz SQEZXBKLEDVUDF-ZWIJEDICSA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@@H]1CCC[N@@H+]1Cc1ccccc1C ZINC001493107684 1398446927 /nfs/dbraw/zinc/44/69/27/1398446927.db2.gz NFVDIPRHVGDSAQ-OALUTQOASA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@@H]1CCC[N@H+]1Cc1ccccc1C ZINC001493107684 1398446932 /nfs/dbraw/zinc/44/69/32/1398446932.db2.gz NFVDIPRHVGDSAQ-OALUTQOASA-N 1 3 349.494 2.756 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[N@H+](CCC2=CCCCC2)C1)N(C)C ZINC001493235204 1398552070 /nfs/dbraw/zinc/55/20/70/1398552070.db2.gz DXRAPMUFHZHFRK-RTBURBONSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[N@@H+](CCC2=CCCCC2)C1)N(C)C ZINC001493235204 1398552073 /nfs/dbraw/zinc/55/20/73/1398552073.db2.gz DXRAPMUFHZHFRK-RTBURBONSA-N 1 3 335.536 2.901 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1CC[C@H](C)C1)CC1CC2(CCC2)C1 ZINC001493317629 1398608862 /nfs/dbraw/zinc/60/88/62/1398608862.db2.gz CUUKYKKHYBODPK-KRWDZBQOSA-N 1 3 335.536 2.737 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1CC[C@H](C)C1)CC1CC2(CCC2)C1 ZINC001493317629 1398608868 /nfs/dbraw/zinc/60/88/68/1398608868.db2.gz CUUKYKKHYBODPK-KRWDZBQOSA-N 1 3 335.536 2.737 10 0 EFAEHO C[NH+](C)CCC(=O)NCCN(C1CC1)[C@@H]1CCc2c1cccc2Cl ZINC001493408030 1398682627 /nfs/dbraw/zinc/68/26/27/1398682627.db2.gz TZWWYUWZOHWIHM-GOSISDBHSA-N 1 3 349.906 2.860 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NCCN(Cc1ccccc1)C1CC1 ZINC001493450939 1398716996 /nfs/dbraw/zinc/71/69/96/1398716996.db2.gz WUYANJBXAKNDJH-IAGOWNOFSA-N 1 3 329.488 2.640 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCNCc1ccc(Cl)s1)[NH+](C)C ZINC001493586422 1398763854 /nfs/dbraw/zinc/76/38/54/1398763854.db2.gz RDWUHABRFKKZRG-AWEZNQCLSA-N 1 3 331.913 2.536 10 0 EFAEHO C[C@H](NCCN(C)C(=O)CC[NH+](C)C)c1ccc(F)c(Cl)c1 ZINC001493681974 1398804324 /nfs/dbraw/zinc/80/43/24/1398804324.db2.gz SDGVIWZRGSAXBY-LBPRGKRZSA-N 1 3 329.847 2.540 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC001493694440 1398813927 /nfs/dbraw/zinc/81/39/27/1398813927.db2.gz DXJBSNGYUCGASA-AWEZNQCLSA-N 1 3 339.430 2.514 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)CCNCc1ccc(Cl)c(Cl)c1 ZINC001493755272 1398865743 /nfs/dbraw/zinc/86/57/43/1398865743.db2.gz LVOWGIBLDXZVHV-UHFFFAOYSA-N 1 3 346.302 2.883 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)CCNCc1ccc(Cl)c(Cl)c1 ZINC001493755272 1398865747 /nfs/dbraw/zinc/86/57/47/1398865747.db2.gz LVOWGIBLDXZVHV-UHFFFAOYSA-N 1 3 346.302 2.883 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](CC1CC(F)(F)C1)C(C)C ZINC001493875945 1398943977 /nfs/dbraw/zinc/94/39/77/1398943977.db2.gz ZDYWRDDPQFNCSX-UHFFFAOYSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](CC1CC(F)(F)C1)C(C)C ZINC001493875945 1398943982 /nfs/dbraw/zinc/94/39/82/1398943982.db2.gz ZDYWRDDPQFNCSX-UHFFFAOYSA-N 1 3 342.434 2.523 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CCCF)c1ccccc1 ZINC001493889663 1398956846 /nfs/dbraw/zinc/95/68/46/1398956846.db2.gz UXVMBXSSVOYYQF-ZWKOTPCHSA-N 1 3 335.467 2.666 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1C[C@H]2CC[C@@H](C1)[N@H+]2CCCC(C)C ZINC001493915595 1398975011 /nfs/dbraw/zinc/97/50/11/1398975011.db2.gz MCXHEIUQHSVZNE-FGTMMUONSA-N 1 3 341.515 2.778 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCC(C)C ZINC001493915595 1398975017 /nfs/dbraw/zinc/97/50/17/1398975017.db2.gz MCXHEIUQHSVZNE-FGTMMUONSA-N 1 3 341.515 2.778 10 0 EFAEHO CCCN(C(=O)[C@H](C)[NH+]1CCCCCC1)[C@H]1CCN(CCCF)C1 ZINC001493968559 1399020017 /nfs/dbraw/zinc/02/00/17/1399020017.db2.gz IYJZOVFAVLHBGI-ROUUACIJSA-N 1 3 341.515 2.923 10 0 EFAEHO CCCN(C(=O)[C@H](C)N1CCCCCC1)[C@H]1CC[N@H+](CCCF)C1 ZINC001493968559 1399020019 /nfs/dbraw/zinc/02/00/19/1399020019.db2.gz IYJZOVFAVLHBGI-ROUUACIJSA-N 1 3 341.515 2.923 10 0 EFAEHO CCCN(C(=O)[C@H](C)N1CCCCCC1)[C@H]1CC[N@@H+](CCCF)C1 ZINC001493968559 1399020025 /nfs/dbraw/zinc/02/00/25/1399020025.db2.gz IYJZOVFAVLHBGI-ROUUACIJSA-N 1 3 341.515 2.923 10 0 EFAEHO C[NH+](C)CCC(=O)NCC[C@H]1CCN(Cc2sccc2Cl)C1 ZINC001494048569 1399089745 /nfs/dbraw/zinc/08/97/45/1399089745.db2.gz POXMQEUSRJGEPM-ZDUSSCGKSA-N 1 3 343.924 2.681 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2CC[N@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001494056346 1399096590 /nfs/dbraw/zinc/09/65/90/1399096590.db2.gz VPMZCPGWDOSOFA-QZTJIDSGSA-N 1 3 347.547 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2CC[N@@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001494056346 1399096593 /nfs/dbraw/zinc/09/65/93/1399096593.db2.gz VPMZCPGWDOSOFA-QZTJIDSGSA-N 1 3 347.547 2.737 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@H+](C)CC2CC(C)(C)C2)CC1 ZINC001494214775 1399218338 /nfs/dbraw/zinc/21/83/38/1399218338.db2.gz ONDZGRPBXOFEAL-UHFFFAOYSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@@H+](C)CC2CC(C)(C)C2)CC1 ZINC001494214775 1399218341 /nfs/dbraw/zinc/21/83/41/1399218341.db2.gz ONDZGRPBXOFEAL-UHFFFAOYSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@H]([NH2+]C/C=C/Cl)C1 ZINC001494241910 1399230511 /nfs/dbraw/zinc/23/05/11/1399230511.db2.gz KGCQRGULWYJEDW-MYNUTGAYSA-N 1 3 327.900 2.582 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)CCCC[NH+](C)C)C2)c(C)c1 ZINC001494623880 1399403646 /nfs/dbraw/zinc/40/36/46/1399403646.db2.gz BKGLSTUFTWKGRV-UHFFFAOYSA-N 1 3 331.504 2.583 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC2CC1CN2C(=O)c1ccc(N(C)C)nc1 ZINC001494660493 1399419659 /nfs/dbraw/zinc/41/96/59/1399419659.db2.gz MPJKJMCILDYLQU-VDZMMWBESA-N 1 3 342.487 2.793 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC2CC1CN2C(=O)c1ccc(N(C)C)nc1 ZINC001494660493 1399419662 /nfs/dbraw/zinc/41/96/62/1399419662.db2.gz MPJKJMCILDYLQU-VDZMMWBESA-N 1 3 342.487 2.793 10 0 EFAEHO CC(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CC[N@H+](C)C1CCCCC1 ZINC001494664493 1399421674 /nfs/dbraw/zinc/42/16/74/1399421674.db2.gz AIVOZIGMBGOGFD-OALUTQOASA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CC[N@@H+](C)C1CCCCC1 ZINC001494664493 1399421675 /nfs/dbraw/zinc/42/16/75/1399421675.db2.gz AIVOZIGMBGOGFD-OALUTQOASA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]Cc2cc(C)ccc2F)C1 ZINC001507418492 1407031988 /nfs/dbraw/zinc/03/19/88/1407031988.db2.gz GFYMXKHLQXSGSA-WMZOPIPTSA-N 1 3 349.494 2.850 10 0 EFAEHO C[C@@H](C(=O)N(C)[C@@H]1CC[N@H+](CCCCCF)C1)N1CCCCCC1 ZINC001494851070 1399505553 /nfs/dbraw/zinc/50/55/53/1399505553.db2.gz AYCNGMUGPWAMMV-ZWKOTPCHSA-N 1 3 341.515 2.923 10 0 EFAEHO C[C@@H](C(=O)N(C)[C@@H]1CC[N@@H+](CCCCCF)C1)N1CCCCCC1 ZINC001494851070 1399505559 /nfs/dbraw/zinc/50/55/59/1399505559.db2.gz AYCNGMUGPWAMMV-ZWKOTPCHSA-N 1 3 341.515 2.923 10 0 EFAEHO CN(C(=O)CCCC[NH+](C)C)[C@H]1CCN(Cc2ccc(CF)cc2)C1 ZINC001494862741 1399512751 /nfs/dbraw/zinc/51/27/51/1399512751.db2.gz JMFIHHJMVWTAKE-IBGZPJMESA-N 1 3 349.494 2.921 10 0 EFAEHO CC[C@H](CNC(=O)c1ccc(C[NH+](C)C)cc1)NCc1cncs1 ZINC001495079803 1399648762 /nfs/dbraw/zinc/64/87/62/1399648762.db2.gz ICLYCJYXYNDKMD-MRXNPFEDSA-N 1 3 346.500 2.503 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001495147302 1399699535 /nfs/dbraw/zinc/69/95/35/1399699535.db2.gz XNQOJHOHAZDKKZ-CQSZACIVSA-N 1 3 343.874 2.804 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC2(CNCC=C(Cl)Cl)CCCC2)CC[N@@H+]1C ZINC001495160612 1399706237 /nfs/dbraw/zinc/70/62/37/1399706237.db2.gz ICINRMNNEXIAKO-CHWSQXEVSA-N 1 3 348.318 2.664 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC2(CNCC=C(Cl)Cl)CCCC2)CC[N@H+]1C ZINC001495160612 1399706242 /nfs/dbraw/zinc/70/62/42/1399706242.db2.gz ICINRMNNEXIAKO-CHWSQXEVSA-N 1 3 348.318 2.664 10 0 EFAEHO C[N@H+](CCC(=O)NC1(CNCCF)CCCC1)C1CCCCC1 ZINC001495177459 1399716637 /nfs/dbraw/zinc/71/66/37/1399716637.db2.gz FEAMDJBPJNAWRN-UHFFFAOYSA-N 1 3 327.488 2.629 10 0 EFAEHO C[N@@H+](CCC(=O)NC1(CNCCF)CCCC1)C1CCCCC1 ZINC001495177459 1399716640 /nfs/dbraw/zinc/71/66/40/1399716640.db2.gz FEAMDJBPJNAWRN-UHFFFAOYSA-N 1 3 327.488 2.629 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@@](C)(C[NH2+]Cc2ccc(F)cc2)C2CC2)C1 ZINC001495275880 1399785449 /nfs/dbraw/zinc/78/54/49/1399785449.db2.gz DEKSPUBKZKMEMS-YWZLYKJASA-N 1 3 347.478 2.542 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@](C)(NC(=O)CN2CC[C@H](C)C2)C2CC2)c1 ZINC001495277853 1399787131 /nfs/dbraw/zinc/78/71/31/1399787131.db2.gz RIUFHDVHOOMBGF-UWJYYQICSA-N 1 3 343.515 2.711 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@](C)(NC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001495304014 1399814364 /nfs/dbraw/zinc/81/43/64/1399814364.db2.gz SSZOUJPUFGRNCU-HXUWFJFHSA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@H](C)C[NH2+]CC[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001495377158 1399923098 /nfs/dbraw/zinc/92/30/98/1399923098.db2.gz JUGKLXVCVGHQJM-PKOBYXMFSA-N 1 3 337.552 2.983 10 0 EFAEHO CCC(CC)C[NH2+]CC[C@@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001495389664 1399935359 /nfs/dbraw/zinc/93/53/59/1399935359.db2.gz YQXXRQPZRIKKCS-HKUYNNGSSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](CC[NH2+]Cc2ccccc2)C1 ZINC001495393519 1399938778 /nfs/dbraw/zinc/93/87/78/1399938778.db2.gz PLGARKZRJORMKZ-LJQANCHMSA-N 1 3 331.504 2.745 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(CC[NH2+]Cc2ccccc2F)CC1 ZINC001495434075 1399977076 /nfs/dbraw/zinc/97/70/76/1399977076.db2.gz BIDATVOUUMQRMN-UHFFFAOYSA-N 1 3 349.494 2.886 10 0 EFAEHO CC(C)C[NH2+]Cc1ccc(CNC(=O)CN2[C@H](C)CC[C@H]2C)cc1 ZINC001495508982 1400041198 /nfs/dbraw/zinc/04/11/98/1400041198.db2.gz LDWKENXIZNVDSD-IAGOWNOFSA-N 1 3 331.504 2.921 10 0 EFAEHO CC[C@H](F)C[NH+]1CCC(CCNC(=O)[C@H]2CCCCN2CC)CC1 ZINC001495539652 1400071061 /nfs/dbraw/zinc/07/10/61/1400071061.db2.gz GSQKHSMNUXNRPU-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)C[NH2+][C@@H]1CCc2ccccc21 ZINC001495743284 1400217395 /nfs/dbraw/zinc/21/73/95/1400217395.db2.gz OFXBRNBABMDWHO-VQIMIIECSA-N 1 3 345.531 2.994 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+]CC1CCC(C)(C)CC1 ZINC001495816272 1400291139 /nfs/dbraw/zinc/29/11/39/1400291139.db2.gz SXAHHWPPGRIZRA-INIZCTEOSA-N 1 3 325.541 2.885 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)[C@H]3CC[N@@H+](C)C3)CCCC2)c1 ZINC001495962192 1400384625 /nfs/dbraw/zinc/38/46/25/1400384625.db2.gz DFKURDYLXAVWTG-INIZCTEOSA-N 1 3 347.478 2.604 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)[C@H]3CC[N@H+](C)C3)CCCC2)c1 ZINC001495962192 1400384630 /nfs/dbraw/zinc/38/46/30/1400384630.db2.gz DFKURDYLXAVWTG-INIZCTEOSA-N 1 3 347.478 2.604 10 0 EFAEHO C[C@@H](CN[C@@H](C)c1ccccc1Cl)N(C)C(=O)C12CC[NH+](CC1)C2 ZINC001496207536 1400539357 /nfs/dbraw/zinc/53/93/57/1400539357.db2.gz QNFMTGRYSBRQJF-GJZGRUSLSA-N 1 3 349.906 2.933 10 0 EFAEHO C[C@H](CN[C@H](C)c1ccccc1Cl)N(C)C(=O)C12CC[NH+](CC1)C2 ZINC001496207538 1400539856 /nfs/dbraw/zinc/53/98/56/1400539856.db2.gz QNFMTGRYSBRQJF-HUUCEWRRSA-N 1 3 349.906 2.933 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](C)N(C)C(=O)[C@H]1CC[N@H+](C)C1 ZINC001496230377 1400557348 /nfs/dbraw/zinc/55/73/48/1400557348.db2.gz VKTXNWCJJBSXSG-GJZGRUSLSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](C)N(C)C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001496230377 1400557351 /nfs/dbraw/zinc/55/73/51/1400557351.db2.gz VKTXNWCJJBSXSG-GJZGRUSLSA-N 1 3 337.895 2.537 10 0 EFAEHO C[C@@H]([NH2+]C[C@H](C)N(C)C(=O)CN1CCCC1)c1ccc(F)c(F)c1 ZINC001496230164 1400557434 /nfs/dbraw/zinc/55/74/34/1400557434.db2.gz RIYJQJUOIXNVIT-UONOGXRCSA-N 1 3 339.430 2.558 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]CCCc1ccccc1 ZINC001496248112 1400570440 /nfs/dbraw/zinc/57/04/40/1400570440.db2.gz JQORQCTXHXILOJ-UYAOXDASSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+][C@@H]1CCc2c1cccc2F ZINC001496251154 1400572953 /nfs/dbraw/zinc/57/29/53/1400572953.db2.gz UBADHRFYRDNARP-RDTXWAMCSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)C[C@@H](CNCc1ccccc1F)NC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001496300778 1400616410 /nfs/dbraw/zinc/61/64/10/1400616410.db2.gz NWLLUHZCJNHGQU-AEFFLSMTSA-N 1 3 349.494 2.788 10 0 EFAEHO CC(C)C[C@@H](CNCc1ccccc1F)NC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001496300778 1400616420 /nfs/dbraw/zinc/61/64/20/1400616420.db2.gz NWLLUHZCJNHGQU-AEFFLSMTSA-N 1 3 349.494 2.788 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N[C@H](CNCCF)C2CCCCC2)CC1 ZINC001496325200 1400640882 /nfs/dbraw/zinc/64/08/82/1400640882.db2.gz RXXZOLQFAQETLE-GOSISDBHSA-N 1 3 341.515 2.731 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C[NH2+]CCC1CC1)C1CCCCC1 ZINC001496327491 1400643079 /nfs/dbraw/zinc/64/30/79/1400643079.db2.gz UKSQFFSGZHLJKD-SFHVURJKSA-N 1 3 332.492 2.715 10 0 EFAEHO C[C@H]1CN(C(=O)c2cccc(CN(C)C)c2)CC[C@@H]1[NH2+]CCCF ZINC001496368958 1400678157 /nfs/dbraw/zinc/67/81/57/1400678157.db2.gz JCXXQTRFZWBARA-YJBOKZPZSA-N 1 3 335.467 2.548 10 0 EFAEHO CC1CCN(CC(=O)N2CCCC[C@H]2CC[NH2+]C/C=C\Cl)CC1 ZINC001496412725 1400714670 /nfs/dbraw/zinc/71/46/70/1400714670.db2.gz CPDXIPLPYMWSOC-ASRSSLEJSA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H](C)[NH2+]Cc2cccc(F)c2)C1 ZINC001496466189 1400750476 /nfs/dbraw/zinc/75/04/76/1400750476.db2.gz ZRYBBFFZUULDLD-AEFFLSMTSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H](C)[NH2+]Cc2cccc(F)c2)C1 ZINC001496466190 1400750545 /nfs/dbraw/zinc/75/05/45/1400750545.db2.gz ZRYBBFFZUULDLD-FUHWJXTLSA-N 1 3 349.494 2.883 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C)[C@H]1C[NH2+]Cc1ccsc1 ZINC001496486207 1400763237 /nfs/dbraw/zinc/76/32/37/1400763237.db2.gz IHJNXJJFHUTPIM-NVXWUHKLSA-N 1 3 337.533 2.807 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1cccc(F)c1)C(C)C ZINC001496565132 1400832067 /nfs/dbraw/zinc/83/20/67/1400832067.db2.gz HSLPIKCPAVNULW-RBUKOAKNSA-N 1 3 349.494 2.931 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)cc1 ZINC001496603262 1400862839 /nfs/dbraw/zinc/86/28/39/1400862839.db2.gz QAJMQJNGMHKHPS-QUCCMNQESA-N 1 3 345.531 2.610 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)N(C)CCN(C)Cc1ccc(CF)cc1 ZINC001496841333 1401030155 /nfs/dbraw/zinc/03/01/55/1401030155.db2.gz FFUCAQRXQRFPRQ-IAGOWNOFSA-N 1 3 349.494 2.919 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC001496866312 1401062836 /nfs/dbraw/zinc/06/28/36/1401062836.db2.gz GSHAGZQYHTYKIC-PKOBYXMFSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2Cc2ccc(F)cc2)C1 ZINC001496866312 1401062842 /nfs/dbraw/zinc/06/28/42/1401062842.db2.gz GSHAGZQYHTYKIC-PKOBYXMFSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]1C[NH2+]Cc1ccccc1F ZINC001496924359 1401104631 /nfs/dbraw/zinc/10/46/31/1401104631.db2.gz QIKGPAFEZMAVBF-AEFFLSMTSA-N 1 3 335.467 2.540 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H](C)NC(=O)[C@@H](C(C)C)N(C)C)cs1 ZINC001497311541 1401291029 /nfs/dbraw/zinc/29/10/29/1401291029.db2.gz JCGFTHYUSHHCJT-XJKSGUPXSA-N 1 3 325.522 2.627 10 0 EFAEHO CCN(CCNCc1ncccc1C)C(=O)C(C)(C)[NH+]1CCCCC1 ZINC001497393471 1401345345 /nfs/dbraw/zinc/34/53/45/1401345345.db2.gz FQEMIHPENVDOIZ-UHFFFAOYSA-N 1 3 346.519 2.593 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(C)cc(C)c1)C(=O)CN1CC[C@@H](C)C1 ZINC001497454698 1401387604 /nfs/dbraw/zinc/38/76/04/1401387604.db2.gz LZDUQPFMLQKYDF-MRXNPFEDSA-N 1 3 331.504 2.583 10 0 EFAEHO CCN(CC[NH2+]CC1CCCCCC1)C(=O)[C@@H](C(C)C)N(C)C ZINC001497486263 1401411150 /nfs/dbraw/zinc/41/11/50/1401411150.db2.gz NECFJZUJQZLNCD-GOSISDBHSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/C[NH2+][C@@H]1CCCc2ccccc21)N(C)C ZINC001497603778 1401487047 /nfs/dbraw/zinc/48/70/47/1401487047.db2.gz ZLBBURJKAQNRIA-CLJKYYQGSA-N 1 3 343.515 2.912 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\C[NH2+][C@@H]1CCCc2ccccc21)N(C)C ZINC001497603783 1401487108 /nfs/dbraw/zinc/48/71/08/1401487108.db2.gz ZLBBURJKAQNRIA-KGMDJONISA-N 1 3 343.515 2.912 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/C[NH2+][C@H]1CCCc2ccccc21)N(C)C ZINC001497603785 1401487234 /nfs/dbraw/zinc/48/72/34/1401487234.db2.gz ZLBBURJKAQNRIA-RLFQVEEXSA-N 1 3 343.515 2.912 10 0 EFAEHO CC(C)(C(=O)NC/C=C/CNCc1cccc(Cl)c1)[NH+]1CCCC1 ZINC001497658854 1401527769 /nfs/dbraw/zinc/52/77/69/1401527769.db2.gz OKFLOAKXHMOZEA-ONEGZZNKSA-N 1 3 349.906 2.976 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/C[NH2+][C@@H]1CCc2ccccc21)N(C)C ZINC001497672772 1401538891 /nfs/dbraw/zinc/53/88/91/1401538891.db2.gz VFFVXHVCIZLHCY-JNVNVXKGSA-N 1 3 329.488 2.522 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]C/C=C\CNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001497725272 1401586558 /nfs/dbraw/zinc/58/65/58/1401586558.db2.gz KLSVBTFNPUZLHX-JKLVOYIESA-N 1 3 331.504 2.904 10 0 EFAEHO CCc1ccc(CC[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001497816100 1401672423 /nfs/dbraw/zinc/67/24/23/1401672423.db2.gz KOXLVHMIAJTEAW-YLJYHZDGSA-N 1 3 345.531 2.759 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CCCc1cccc(F)c1 ZINC001497816595 1401673004 /nfs/dbraw/zinc/67/30/04/1401673004.db2.gz VLNSFZZCUPIACG-VQIMIIECSA-N 1 3 349.494 2.725 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)C23CCC[NH+]2CCC3)c(Cl)c1 ZINC001497844476 1401690851 /nfs/dbraw/zinc/69/08/51/1401690851.db2.gz AMDTVDKYKKNKNI-OAHLLOKOSA-N 1 3 349.906 2.871 10 0 EFAEHO C[C@H](CNC1c2ccccc2-c2ccccc21)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001497983573 1401794196 /nfs/dbraw/zinc/79/41/96/1401794196.db2.gz HHIMFEVHRCAABV-HZPDHXFCSA-N 1 3 349.478 2.802 10 0 EFAEHO C[C@H](CNC1c2ccccc2-c2ccccc21)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001497983573 1401794204 /nfs/dbraw/zinc/79/42/04/1401794204.db2.gz HHIMFEVHRCAABV-HZPDHXFCSA-N 1 3 349.478 2.802 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCN2C(C)C)cc1C ZINC001498041507 1401825665 /nfs/dbraw/zinc/82/56/65/1401825665.db2.gz BZTYCSYQTPRHLS-HKUYNNGSSA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@@H](CN[C@@H](C)c1ccccc1F)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001498087456 1401850302 /nfs/dbraw/zinc/85/03/02/1401850302.db2.gz REZLUKUTSDCWRJ-GJZGRUSLSA-N 1 3 335.467 2.855 10 0 EFAEHO COc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@H]2CCCCN2C(C)C)cc1 ZINC001498133795 1401871835 /nfs/dbraw/zinc/87/18/35/1401871835.db2.gz ZJGTZMLVNLLKKE-QFBILLFUSA-N 1 3 347.503 2.552 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+]Cc1ccc(C(F)F)cc1 ZINC001498196883 1401903698 /nfs/dbraw/zinc/90/36/98/1401903698.db2.gz AFYKMQDEVGRXQK-ZDUSSCGKSA-N 1 3 327.419 2.559 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(CF)cc1 ZINC001498281691 1401972592 /nfs/dbraw/zinc/97/25/92/1401972592.db2.gz QYGYSCRQDODBAE-APWZRJJASA-N 1 3 349.494 2.965 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(CF)cc1 ZINC001498281691 1401972596 /nfs/dbraw/zinc/97/25/96/1401972596.db2.gz QYGYSCRQDODBAE-APWZRJJASA-N 1 3 349.494 2.965 10 0 EFAEHO Cc1cc(CN(C)C[C@@H](C)NC(=O)[C@H]2C[NH+]3CCC2CC3)c(C)s1 ZINC001498282147 1401972800 /nfs/dbraw/zinc/97/28/00/1401972800.db2.gz HGXQWKBSOKOZND-ACJLOTCBSA-N 1 3 349.544 2.643 10 0 EFAEHO Cc1cc(CN(C)C[C@H](C)NC(=O)[C@@H]2C[NH+]3CCC2CC3)c(C)s1 ZINC001498282149 1401973538 /nfs/dbraw/zinc/97/35/38/1401973538.db2.gz HGXQWKBSOKOZND-SCLBCKFNSA-N 1 3 349.544 2.643 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)CCc2ccccc2F)CC[N@@H+]1C ZINC001498289745 1401980504 /nfs/dbraw/zinc/98/05/04/1401980504.db2.gz VVBSVIWMQSEJDR-HHXXYDBFSA-N 1 3 349.494 2.535 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)CCc2ccccc2F)CC[N@H+]1C ZINC001498289745 1401980505 /nfs/dbraw/zinc/98/05/05/1401980505.db2.gz VVBSVIWMQSEJDR-HHXXYDBFSA-N 1 3 349.494 2.535 10 0 EFAEHO CC(C)CN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]CCCF)C(C)(C)C ZINC001507969084 1407226522 /nfs/dbraw/zinc/22/65/22/1407226522.db2.gz AUMDAILHPYHHKP-HZPDHXFCSA-N 1 3 329.504 2.587 10 0 EFAEHO CCCc1ccc(C[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001498381507 1402056286 /nfs/dbraw/zinc/05/62/86/1402056286.db2.gz PWMSSMXUGVMPRE-QZTJIDSGSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(C[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001498381507 1402056290 /nfs/dbraw/zinc/05/62/90/1402056290.db2.gz PWMSSMXUGVMPRE-QZTJIDSGSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+]CC1CCC(F)(F)CC1 ZINC001723204607 1424451574 /nfs/dbraw/zinc/45/15/74/1424451574.db2.gz STXPRHKWFMXXTP-UHFFFAOYSA-N 1 3 333.467 2.590 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+][C@@H](C)c1cccc(F)c1)N(C)C ZINC001498562403 1402176921 /nfs/dbraw/zinc/17/69/21/1402176921.db2.gz VPXKKLKKRKGCPI-YJBOKZPZSA-N 1 3 337.483 2.911 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]Cc1cc(Cl)ccc1F)N(C)C ZINC001498614506 1402202802 /nfs/dbraw/zinc/20/28/02/1402202802.db2.gz ZCLIUKWHEPXYMQ-INIZCTEOSA-N 1 3 343.874 2.757 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[NH2+]CC=C(Cl)Cl ZINC001498658909 1402232415 /nfs/dbraw/zinc/23/24/15/1402232415.db2.gz TYDKQKOJBQHRBI-CYBMUJFWSA-N 1 3 336.307 2.618 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)C ZINC001508025111 1407245411 /nfs/dbraw/zinc/24/54/11/1407245411.db2.gz SYTJQODKZZYQRX-LSDHHAIUSA-N 1 3 331.520 2.833 10 0 EFAEHO CC(C)(C(=O)N[C@H](CNCC=C(Cl)Cl)C1CC1)[NH+]1CCCC1 ZINC001498801489 1402299065 /nfs/dbraw/zinc/29/90/65/1402299065.db2.gz HNTNXKUXVDIUED-CYBMUJFWSA-N 1 3 348.318 2.664 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@H](NC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001498875024 1402350902 /nfs/dbraw/zinc/35/09/02/1402350902.db2.gz MLWMJQQNCFUYBR-IBGZPJMESA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)(C)[C@H](CNCc1ccccc1F)NC(=O)C12CC[NH+](CC1)C2 ZINC001508039317 1407257590 /nfs/dbraw/zinc/25/75/90/1407257590.db2.gz SDFYCVRVSRCYAS-KRWDZBQOSA-N 1 3 347.478 2.542 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+]CCCc2ccccc2)CC1 ZINC001499226229 1402528576 /nfs/dbraw/zinc/52/85/76/1402528576.db2.gz ONWSGMATWFFJRR-LJQANCHMSA-N 1 3 343.515 2.730 10 0 EFAEHO C[C@@H](NC1(CNC(=O)CC[C@H]2CCC[N@@H+]2C)CC1)c1cccc(F)c1 ZINC001499253686 1402539275 /nfs/dbraw/zinc/53/92/75/1402539275.db2.gz GQXBXJDNXSJHBW-CRAIPNDOSA-N 1 3 347.478 3.000 10 0 EFAEHO C[C@@H](NC1(CNC(=O)CC[C@H]2CCC[N@H+]2C)CC1)c1cccc(F)c1 ZINC001499253686 1402539280 /nfs/dbraw/zinc/53/92/80/1402539280.db2.gz GQXBXJDNXSJHBW-CRAIPNDOSA-N 1 3 347.478 3.000 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C1(CNC(=O)C(C)(C)N2CCCC2)CC1 ZINC001499311572 1402561002 /nfs/dbraw/zinc/56/10/02/1402561002.db2.gz HGBXYAARBNCDLZ-UHFFFAOYSA-N 1 3 347.478 2.747 10 0 EFAEHO C[C@@H](NC1(CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)CC1)c1cccc(F)c1 ZINC001499331308 1402569016 /nfs/dbraw/zinc/56/90/16/1402569016.db2.gz SWJMDANECAJYOW-UXLLHSPISA-N 1 3 347.478 2.855 10 0 EFAEHO C[C@@H](NC1(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)CC1)c1cccc(F)c1 ZINC001499331308 1402569018 /nfs/dbraw/zinc/56/90/18/1402569018.db2.gz SWJMDANECAJYOW-UXLLHSPISA-N 1 3 347.478 2.855 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)C1CC[NH+](CCC(F)(F)F)CC1 ZINC001508058315 1407270312 /nfs/dbraw/zinc/27/03/12/1407270312.db2.gz FDTHPRBYOPIVCM-CYBMUJFWSA-N 1 3 349.441 2.640 10 0 EFAEHO C[C@H](NC1(CNC(=O)[C@@H]2CC[N@H+](C)C2)CC1)c1ccc(Cl)cc1 ZINC001499448716 1402619066 /nfs/dbraw/zinc/61/90/66/1402619066.db2.gz PLAZUGYCMGEDOT-DZGCQCFKSA-N 1 3 335.879 2.591 10 0 EFAEHO C[C@H](NC1(CNC(=O)[C@@H]2CC[N@@H+](C)C2)CC1)c1ccc(Cl)cc1 ZINC001499448716 1402619070 /nfs/dbraw/zinc/61/90/70/1402619070.db2.gz PLAZUGYCMGEDOT-DZGCQCFKSA-N 1 3 335.879 2.591 10 0 EFAEHO CC(C)C[NH+]1CCC([C@@H](C)NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001508063792 1407274936 /nfs/dbraw/zinc/27/49/36/1407274936.db2.gz FRRARQYUOYLVTB-MRXNPFEDSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@H](C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CCC1)[NH+](CC)CC ZINC001499554719 1402680537 /nfs/dbraw/zinc/68/05/37/1402680537.db2.gz DXGHEHAGMDDJNR-CEXWTWQISA-N 1 3 335.536 2.972 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC[C@@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001499577363 1402695968 /nfs/dbraw/zinc/69/59/68/1402695968.db2.gz UGCUOZPCBPOFJX-PXDRNWIDSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC[C@@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001499577363 1402695969 /nfs/dbraw/zinc/69/59/69/1402695969.db2.gz UGCUOZPCBPOFJX-PXDRNWIDSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CCCc2ccccc2)CCN1C(=O)Cc1c[nH]cn1 ZINC001499849666 1402817239 /nfs/dbraw/zinc/81/72/39/1402817239.db2.gz VIMHZLJFHVJLRZ-FUHWJXTLSA-N 1 3 340.471 2.554 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)cc1 ZINC001499857234 1402823167 /nfs/dbraw/zinc/82/31/67/1402823167.db2.gz IQUXBIKAWCHJAN-ICSRJNTNSA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)cc1 ZINC001499857236 1402823873 /nfs/dbraw/zinc/82/38/73/1402823873.db2.gz IQUXBIKAWCHJAN-QUCCMNQESA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)cc1 ZINC001499857238 1402823902 /nfs/dbraw/zinc/82/39/02/1402823902.db2.gz IQUXBIKAWCHJAN-UYAOXDASSA-N 1 3 345.531 2.847 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC[C@H]2C[NH2+]CCC2CC2)c1 ZINC001499955880 1402869015 /nfs/dbraw/zinc/86/90/15/1402869015.db2.gz YWGNRBRPVOZMFT-IBGZPJMESA-N 1 3 329.488 2.743 10 0 EFAEHO C[NH+](C)CCC(=O)NC1(C)CCN(CCCCC(F)(F)F)CC1 ZINC001499997462 1402889269 /nfs/dbraw/zinc/88/92/69/1402889269.db2.gz GGEDUQUNOLDALJ-UHFFFAOYSA-N 1 3 337.430 2.641 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1(C)CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001500005661 1402896091 /nfs/dbraw/zinc/89/60/91/1402896091.db2.gz IHZXGIJZMGWODE-UHFFFAOYSA-N 1 3 332.492 2.668 10 0 EFAEHO CCC(CC)C[NH+]1CCC([C@H](C)NC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001508082591 1407287861 /nfs/dbraw/zinc/28/78/61/1407287861.db2.gz WLCAJEYECAKRDU-SJORKVTESA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001508089184 1407291901 /nfs/dbraw/zinc/29/19/01/1407291901.db2.gz IFYJCBFFBCSWPV-INIZCTEOSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C[NH2+]CCC1CC1)C1CCCC1 ZINC001500089086 1402933256 /nfs/dbraw/zinc/93/32/56/1402933256.db2.gz RXNKVFGIMKBMIZ-OALUTQOASA-N 1 3 335.536 2.924 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N[C@]2(C)CCN(C/C=C\c3ccccc3)C2)C1 ZINC001500281212 1403028244 /nfs/dbraw/zinc/02/82/44/1403028244.db2.gz SICNBDJBTKVCIU-HYHBTBHYSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N[C@]2(C)CCN(C/C=C\c3ccccc3)C2)C1 ZINC001500281212 1403028249 /nfs/dbraw/zinc/02/82/49/1403028249.db2.gz SICNBDJBTKVCIU-HYHBTBHYSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N[C@@]2(C)CCN(C/C=C/c3ccccc3)C2)C1 ZINC001500281214 1403028552 /nfs/dbraw/zinc/02/85/52/1403028552.db2.gz SICNBDJBTKVCIU-KJRVTTDBSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N[C@@]2(C)CCN(C/C=C/c3ccccc3)C2)C1 ZINC001500281214 1403028558 /nfs/dbraw/zinc/02/85/58/1403028558.db2.gz SICNBDJBTKVCIU-KJRVTTDBSA-N 1 3 341.499 2.622 10 0 EFAEHO C[C@@]1(C[NH2+]CCCC2CCCC2)CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001500380680 1403085989 /nfs/dbraw/zinc/08/59/89/1403085989.db2.gz XCFQFXCYUFJEGS-IBGZPJMESA-N 1 3 332.492 2.751 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C1CC([NH2+]CCCc2ccccc2)C1)N(C)C ZINC001508146009 1407314250 /nfs/dbraw/zinc/31/42/50/1407314250.db2.gz SAEXRZJFHBXAGG-SOAGJPPSSA-N 1 3 345.531 2.784 10 0 EFAEHO CCC(CC)C[N@@H+]1CCC[C@](C)(CNC(=O)CN(C)C(C)C)C1 ZINC001500552540 1403218112 /nfs/dbraw/zinc/21/81/12/1403218112.db2.gz GUMBFTMVBBSWRL-LJQANCHMSA-N 1 3 325.541 2.981 10 0 EFAEHO CCC(CC)C[N@H+]1CCC[C@](C)(CNC(=O)CN(C)C(C)C)C1 ZINC001500552540 1403218119 /nfs/dbraw/zinc/21/81/19/1403218119.db2.gz GUMBFTMVBBSWRL-LJQANCHMSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H]1CC[C@H](C[NH2+]CCF)CC1 ZINC001501188403 1403483313 /nfs/dbraw/zinc/48/33/13/1403483313.db2.gz IJWVJDUKTYHPKK-BZSNNMDCSA-N 1 3 341.515 2.731 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N(CCNC/C=C/Cl)Cc2ccccc2)CC[N@@H+]1C ZINC001501193618 1403485698 /nfs/dbraw/zinc/48/56/98/1403485698.db2.gz KNINXIGCCPLTIY-BJHRGBFUSA-N 1 3 349.906 2.698 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N(CCNC/C=C/Cl)Cc2ccccc2)CC[N@H+]1C ZINC001501193618 1403485701 /nfs/dbraw/zinc/48/57/01/1403485701.db2.gz KNINXIGCCPLTIY-BJHRGBFUSA-N 1 3 349.906 2.698 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H](CC[NH2+]CCc3ccccc3)C2)CCC1 ZINC001501574642 1403633952 /nfs/dbraw/zinc/63/39/52/1403633952.db2.gz QIWYDKMAIWRRKC-IBGZPJMESA-N 1 3 343.515 2.542 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]CCC2CCCCC2)C1 ZINC001501604472 1403643906 /nfs/dbraw/zinc/64/39/06/1403643906.db2.gz RPCCVBJDQFBRNW-RBUKOAKNSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(CF)cc2)C1)N(C)C ZINC001501618498 1403648492 /nfs/dbraw/zinc/64/84/92/1403648492.db2.gz LQNFECYXMVRAOC-MOPGFXCFSA-N 1 3 349.494 2.825 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCc1ccc([C@H](C)[NH2+]CCCF)cc1 ZINC001501681421 1403714238 /nfs/dbraw/zinc/71/42/38/1403714238.db2.gz INCLCSAZRJIZKL-ZDUSSCGKSA-N 1 3 332.423 2.587 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)N1CC2(C1)CCN(C/C=C\Cl)CC2 ZINC001501749517 1403763637 /nfs/dbraw/zinc/76/36/37/1403763637.db2.gz XHEAJGNRAFXRMA-YWEYNIOJSA-N 1 3 339.911 2.539 10 0 EFAEHO CC(C)C[N@@H+]1CCc2c(CNC(=O)CN(C)C3CCC3)cccc2C1 ZINC001501854502 1403829819 /nfs/dbraw/zinc/82/98/19/1403829819.db2.gz UXDFEPFVYLZKEZ-UHFFFAOYSA-N 1 3 343.515 2.801 10 0 EFAEHO CC(C)C[N@H+]1CCc2c(CNC(=O)CN(C)C3CCC3)cccc2C1 ZINC001501854502 1403829825 /nfs/dbraw/zinc/82/98/25/1403829825.db2.gz UXDFEPFVYLZKEZ-UHFFFAOYSA-N 1 3 343.515 2.801 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1C[NH2+]CCCc1ccccc1 ZINC001501898422 1403861642 /nfs/dbraw/zinc/86/16/42/1403861642.db2.gz FHHDHEGBLDZLKQ-HXUWFJFHSA-N 1 3 345.531 2.930 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]C[C@H]3CCC(F)(F)C3)CCC2)CCC1 ZINC001501961816 1403908982 /nfs/dbraw/zinc/90/89/82/1403908982.db2.gz LOVDFYZFILLMFU-AWEZNQCLSA-N 1 3 343.462 2.535 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C1(CNC(=O)CN(C)C(C)C)CCC1 ZINC001502029335 1403958724 /nfs/dbraw/zinc/95/87/24/1403958724.db2.gz UKLCLAVDWPMYNQ-UHFFFAOYSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C1(CNC(=O)CN(C)C(C)C)CCC1 ZINC001502029012 1403959268 /nfs/dbraw/zinc/95/92/68/1403959268.db2.gz IVQAURYQPXDZMS-UHFFFAOYSA-N 1 3 331.504 2.772 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)[C@H](C(C)C)[NH+]2CCCCC2)CCC1 ZINC001502028885 1403959378 /nfs/dbraw/zinc/95/93/78/1403959378.db2.gz DNRUIAAFEVSHLD-IRXDYDNUSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@H](F)CN1CCC[C@@H](NC(=O)CC[NH+]2CCCCC2)CC1 ZINC001502147453 1404047243 /nfs/dbraw/zinc/04/72/43/1404047243.db2.gz JOPVPCFMUHKEGF-DLBZAZTESA-N 1 3 327.488 2.581 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@]2(CCN(C[C@H](F)CC)C2)C1 ZINC001502547809 1404240122 /nfs/dbraw/zinc/24/01/22/1404240122.db2.gz FTYSUNPMHYYFFP-MJGOQNOKSA-N 1 3 341.515 2.781 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@]2(CCN(C[C@H](F)CC)C2)C1 ZINC001502547809 1404240123 /nfs/dbraw/zinc/24/01/23/1404240123.db2.gz FTYSUNPMHYYFFP-MJGOQNOKSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[C@@H](C)C[NH2+]C1(C)CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001502797711 1404348734 /nfs/dbraw/zinc/34/87/34/1404348734.db2.gz QRIRCPCVVVJTBD-MRXNPFEDSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@H+](CCCCCF)CC1(C)C)N(C)C ZINC001502835995 1404394019 /nfs/dbraw/zinc/39/40/19/1404394019.db2.gz GDBGHFMBBGUXCO-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@@H+](CCCCCF)CC1(C)C)N(C)C ZINC001502835995 1404394028 /nfs/dbraw/zinc/39/40/28/1404394028.db2.gz GDBGHFMBBGUXCO-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO CCCCCN1CCc2ccccc2[C@H]1CNC(=O)[C@H]1CC[N@H+](C)C1 ZINC001503690911 1404499017 /nfs/dbraw/zinc/49/90/17/1404499017.db2.gz JHIBPLBEYBXNTI-AZUAARDMSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCCCN1CCc2ccccc2[C@H]1CNC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001503690911 1404499019 /nfs/dbraw/zinc/49/90/19/1404499019.db2.gz JHIBPLBEYBXNTI-AZUAARDMSA-N 1 3 343.515 2.844 10 0 EFAEHO CN(Cc1cccc(Cl)c1)C[C@@H]1CCCN1C(=O)CC[NH+](C)C ZINC001505445239 1404636678 /nfs/dbraw/zinc/63/66/78/1404636678.db2.gz QUDOWRLRQHFXTK-KRWDZBQOSA-N 1 3 337.895 2.715 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001505624903 1404866781 /nfs/dbraw/zinc/86/67/81/1404866781.db2.gz CBRIGXVGHIIPQU-SJORKVTESA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001505624901 1404867485 /nfs/dbraw/zinc/86/74/85/1404867485.db2.gz CBRIGXVGHIIPQU-IAGOWNOFSA-N 1 3 331.504 2.771 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[N@H+](C)CCc1cccs1 ZINC001505931353 1405241322 /nfs/dbraw/zinc/24/13/22/1405241322.db2.gz YPVZRXQAFQHMTM-NVXWUHKLSA-N 1 3 337.533 2.602 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[N@@H+](C)CCc1cccs1 ZINC001505931353 1405241330 /nfs/dbraw/zinc/24/13/30/1405241330.db2.gz YPVZRXQAFQHMTM-NVXWUHKLSA-N 1 3 337.533 2.602 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[N@H+](C)CCc1cccs1 ZINC001505931354 1405241893 /nfs/dbraw/zinc/24/18/93/1405241893.db2.gz YPVZRXQAFQHMTM-RDJZCZTQSA-N 1 3 337.533 2.602 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[N@@H+](C)CCc1cccs1 ZINC001505931354 1405241897 /nfs/dbraw/zinc/24/18/97/1405241897.db2.gz YPVZRXQAFQHMTM-RDJZCZTQSA-N 1 3 337.533 2.602 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)[C@H]1CCc2c1cccc2F ZINC001506065585 1405425413 /nfs/dbraw/zinc/42/54/13/1405425413.db2.gz RNXIHFCLQOHLFK-KSSFIOAISA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)[C@H]1CCc2c1cccc2F ZINC001506065585 1405425415 /nfs/dbraw/zinc/42/54/15/1405425415.db2.gz RNXIHFCLQOHLFK-KSSFIOAISA-N 1 3 335.467 2.590 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C1C[NH+](CC2CCC3(CC3)CC2)C1 ZINC001506669584 1406126364 /nfs/dbraw/zinc/12/63/64/1406126364.db2.gz FKNCDMKKOLYDOX-AWEZNQCLSA-N 1 3 344.503 2.668 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@H]1CN(Cc2ccccc2)CC1(C)C ZINC001506742316 1406232650 /nfs/dbraw/zinc/23/26/50/1406232650.db2.gz QKYGJEGGQLSUKC-OALUTQOASA-N 1 3 343.515 2.888 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@H]1CN(Cc2ccccc2)CC1(C)C ZINC001506742316 1406232657 /nfs/dbraw/zinc/23/26/57/1406232657.db2.gz QKYGJEGGQLSUKC-OALUTQOASA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC001564720265 1415380874 /nfs/dbraw/zinc/38/08/74/1415380874.db2.gz XHRGQXBSZROZTI-IEBWSBKVSA-N 1 3 348.535 2.955 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC001564720265 1415380879 /nfs/dbraw/zinc/38/08/79/1415380879.db2.gz XHRGQXBSZROZTI-IEBWSBKVSA-N 1 3 348.535 2.955 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)[C@H](C(C)C)N(C)C)C[C@@H]2C1 ZINC001566052725 1415494234 /nfs/dbraw/zinc/49/42/34/1415494234.db2.gz KDLYLFPAMRFRHB-WYBNUAJGSA-N 1 3 335.536 2.709 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)[C@H](C(C)C)N(C)C)C[C@@H]2C1 ZINC001566052725 1415494232 /nfs/dbraw/zinc/49/42/32/1415494232.db2.gz KDLYLFPAMRFRHB-WYBNUAJGSA-N 1 3 335.536 2.709 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N1CCCCC[C@H]([NH2+]CCCF)C1 ZINC001566068950 1415501504 /nfs/dbraw/zinc/50/15/04/1415501504.db2.gz NVKXTBMNTZDGTD-DLBZAZTESA-N 1 3 327.488 2.580 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)[C@H]1C ZINC001566103191 1415515415 /nfs/dbraw/zinc/51/54/15/1415515415.db2.gz AKISBYSUXHGVKQ-GJYPPUQNSA-N 1 3 341.515 2.968 10 0 EFAEHO CCCCC[N@H+]1CC[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)[C@H]1C ZINC001566103191 1415515417 /nfs/dbraw/zinc/51/54/17/1415515417.db2.gz AKISBYSUXHGVKQ-GJYPPUQNSA-N 1 3 341.515 2.968 10 0 EFAEHO CC/C=C/CC[N@H+](C)C[C@@H]1CCCCN1C(=O)CN1CC[C@@H](C)C1 ZINC001566124498 1415522796 /nfs/dbraw/zinc/52/27/96/1415522796.db2.gz VQDZKIOEOMIUQR-YSKLNCTFSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](C)C[C@@H]1CCCCN1C(=O)CN1CC[C@@H](C)C1 ZINC001566124498 1415522803 /nfs/dbraw/zinc/52/28/03/1415522803.db2.gz VQDZKIOEOMIUQR-YSKLNCTFSA-N 1 3 335.536 2.997 10 0 EFAEHO CN(CC(=O)NCCC[N@H+](C)Cc1ccc2cc[nH]c2c1)C1CCC1 ZINC001566461845 1415561103 /nfs/dbraw/zinc/56/11/03/1415561103.db2.gz JPRPDDKWNKVJPQ-UHFFFAOYSA-N 1 3 342.487 2.590 10 0 EFAEHO CN(CC(=O)NCCC[N@@H+](C)Cc1ccc2cc[nH]c2c1)C1CCC1 ZINC001566461845 1415561109 /nfs/dbraw/zinc/56/11/09/1415561109.db2.gz JPRPDDKWNKVJPQ-UHFFFAOYSA-N 1 3 342.487 2.590 10 0 EFAEHO C[C@H](c1ccccc1F)N(C)CCCNC(=O)C1(C[NH+](C)C)CC1 ZINC001566486799 1415578762 /nfs/dbraw/zinc/57/87/62/1415578762.db2.gz KWAVKGQFIYRHFU-OAHLLOKOSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@@H]1CC[N@H+](CC(=O)NCCCN(C)Cc2ccc(Cl)s2)C1 ZINC001566490950 1415583556 /nfs/dbraw/zinc/58/35/56/1415583556.db2.gz IKQNCFGXXZIUIR-CYBMUJFWSA-N 1 3 343.924 2.681 10 0 EFAEHO C[C@@H]1CC[N@@H+](CC(=O)NCCCN(C)Cc2ccc(Cl)s2)C1 ZINC001566490950 1415583557 /nfs/dbraw/zinc/58/35/57/1415583557.db2.gz IKQNCFGXXZIUIR-CYBMUJFWSA-N 1 3 343.924 2.681 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001566678829 1415727565 /nfs/dbraw/zinc/72/75/65/1415727565.db2.gz GWMQSNKBUVPASH-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CC/C=C/CC[NH2+][C@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001566773859 1415770566 /nfs/dbraw/zinc/77/05/66/1415770566.db2.gz VVDGOEPVXKZHKM-WENXUGBFSA-N 1 3 339.499 2.746 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1C[C@H]([NH2+]CCCc2ccsc2)C1 ZINC001566813744 1415783259 /nfs/dbraw/zinc/78/32/59/1415783259.db2.gz MLHXRTTWUGKMJR-JOCBIADPSA-N 1 3 349.544 2.790 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1C[C@@H]([NH2+]CCCc2ccccc2)C1 ZINC001566862904 1415803814 /nfs/dbraw/zinc/80/38/14/1415803814.db2.gz OGRUZGODNHNCRR-LFGUQSLTSA-N 1 3 343.515 2.729 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H]1CCCCN1C(=O)C(C)(C)N1CCCCC1 ZINC001566938692 1415858198 /nfs/dbraw/zinc/85/81/98/1415858198.db2.gz XVLDGSFJPKUMKV-IAGOWNOFSA-N 1 3 341.515 2.970 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCCC[C@@H]1C[NH2+]CCCCCF ZINC001566954097 1415866713 /nfs/dbraw/zinc/86/67/13/1415866713.db2.gz RKCZSRKHZDNJDL-QZTJIDSGSA-N 1 3 341.515 2.971 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H](C)CNC(=O)C1(N(C)C)CCC1 ZINC001567023657 1415904870 /nfs/dbraw/zinc/90/48/70/1415904870.db2.gz XXLCFNNSDPCCII-KRWDZBQOSA-N 1 3 331.504 2.506 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001567041662 1415911142 /nfs/dbraw/zinc/91/11/42/1415911142.db2.gz BCPYAINMRSFSQX-SFHVURJKSA-N 1 3 345.531 2.896 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](C[NH2+]CCCCC(F)(F)F)C1)C1CCC1 ZINC001567128572 1415943841 /nfs/dbraw/zinc/94/38/41/1415943841.db2.gz POJARRDJYFKYQP-AWEZNQCLSA-N 1 3 349.441 2.641 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](C[NH2+]CCC3=CCCCC3)C2)C1 ZINC001567141039 1415949802 /nfs/dbraw/zinc/94/98/02/1415949802.db2.gz UFQOSZSTZPUBSO-HKUYNNGSSA-N 1 3 333.520 2.657 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001567155533 1415956021 /nfs/dbraw/zinc/95/60/21/1415956021.db2.gz REQFJFHWWUULTC-RDJZCZTQSA-N 1 3 335.467 2.548 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@H]1CCC[N@@H+]1Cc1ccccn1)N(C)C ZINC001567253540 1416023199 /nfs/dbraw/zinc/02/31/99/1416023199.db2.gz FSZKPAPZMBOITE-OALUTQOASA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@H]1CCC[N@H+]1Cc1ccccn1)N(C)C ZINC001567253540 1416023202 /nfs/dbraw/zinc/02/32/02/1416023202.db2.gz FSZKPAPZMBOITE-OALUTQOASA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)CCC[NH2+][C@@H](C)C1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001567630525 1416217085 /nfs/dbraw/zinc/21/70/85/1416217085.db2.gz SVJAQWYEPXZHFO-ROUUACIJSA-N 1 3 337.552 2.981 10 0 EFAEHO CC/C=C\CC[NH+]1CC(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001567841232 1416294911 /nfs/dbraw/zinc/29/49/11/1416294911.db2.gz UKWUZIAWPFFRCL-RURPWVQCSA-N 1 3 339.499 2.603 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@@H](CC[NH2+]CC2=CCCCC2)C1 ZINC001568068870 1416392601 /nfs/dbraw/zinc/39/26/01/1416392601.db2.gz HJEPHQZJHQCMJW-KRWDZBQOSA-N 1 3 330.476 2.671 10 0 EFAEHO O=C(CN1CCCC1)N1CCC(CC[NH2+]Cc2ccsc2)CC1 ZINC001568098487 1416409290 /nfs/dbraw/zinc/40/92/90/1416409290.db2.gz WCITZNSCZNJNPG-UHFFFAOYSA-N 1 3 335.517 2.562 10 0 EFAEHO CC(C)[C@@H](C(=O)NCc1ccc(CNC/C=C/Cl)cc1)[NH+](C)C ZINC001568121941 1416418221 /nfs/dbraw/zinc/41/82/21/1416418221.db2.gz TZBMDCYYSVBEJG-HQWZXOHUSA-N 1 3 337.895 2.731 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]C/C=C/c1ccccc1 ZINC001568176751 1416433722 /nfs/dbraw/zinc/43/37/22/1416433722.db2.gz XQIVEJLBXAAUDK-ZBZNSMLMSA-N 1 3 329.488 2.526 10 0 EFAEHO CCCCCC[NH+]1CC2(C1)CCN(C(=O)CN1CC[C@H](C)C1)CC2 ZINC001568252568 1416456188 /nfs/dbraw/zinc/45/61/88/1416456188.db2.gz LSNZVBPPXHYYPN-SFHVURJKSA-N 1 3 335.536 2.833 10 0 EFAEHO CCC/C=C\CC[NH+]1CC2(C1)CCN(C(=O)CN(C)CCC)CC2 ZINC001568253999 1416457080 /nfs/dbraw/zinc/45/70/80/1416457080.db2.gz WGMPWBYOQRIOLK-FPLPWBNLSA-N 1 3 335.536 2.999 10 0 EFAEHO C[C@H](C[NH2+]CCCCc1ccccc1)N(C)C(=O)[C@H]1CCCN1C ZINC001568262424 1416459594 /nfs/dbraw/zinc/45/95/94/1416459594.db2.gz JFXAEBYLCUOMRD-IEBWSBKVSA-N 1 3 331.504 2.540 10 0 EFAEHO C[C@H](C[NH2+]CC[C@@H]1CCCC1(F)F)N(C)C(=O)CN(C)C1CCC1 ZINC001568277776 1416463621 /nfs/dbraw/zinc/46/36/21/1416463621.db2.gz FUVYMBPWOVUFMM-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N[C@@H](CNCCF)C1CCCCC1 ZINC001568343998 1416484591 /nfs/dbraw/zinc/48/45/91/1416484591.db2.gz UVSPKOKOONWBAE-ROUUACIJSA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N[C@@H](CNCCF)C1CCCCC1 ZINC001568343998 1416484592 /nfs/dbraw/zinc/48/45/92/1416484592.db2.gz UVSPKOKOONWBAE-ROUUACIJSA-N 1 3 341.515 2.731 10 0 EFAEHO CCC/C=C\CC[NH2+][C@H](C)[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001568412058 1416521208 /nfs/dbraw/zinc/52/12/08/1416521208.db2.gz MZCUJBPYDBPOAA-MBZYTVFJSA-N 1 3 332.492 2.915 10 0 EFAEHO CCCN(C(=O)C[C@H]1CC[N@H+](C)C1)C1CCN(CC=C(C)C)CC1 ZINC001690138817 1417164036 /nfs/dbraw/zinc/16/40/36/1417164036.db2.gz QJTTYZPCPKMJFL-GOSISDBHSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCN(C(=O)C[C@H]1CC[N@@H+](C)C1)C1CCN(CC=C(C)C)CC1 ZINC001690138817 1417164040 /nfs/dbraw/zinc/16/40/40/1417164040.db2.gz QJTTYZPCPKMJFL-GOSISDBHSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]([NH2+]CCC2=CCCCC2)C2CC2)C1 ZINC001690169126 1417168838 /nfs/dbraw/zinc/16/88/38/1417168838.db2.gz UQVMHIXBLFQIJI-LPHOPBHVSA-N 1 3 333.520 2.703 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2C[C@@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001690369922 1417197522 /nfs/dbraw/zinc/19/75/22/1417197522.db2.gz DMFONBXCEUOYAU-KDURUIRLSA-N 1 3 331.504 2.505 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CCC[N@H+](CCC2=CCCCC2)C1 ZINC001690392504 1417208792 /nfs/dbraw/zinc/20/87/92/1417208792.db2.gz ZKDYAOLZWHDCCC-GOSISDBHSA-N 1 3 344.503 2.979 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CCC[N@@H+](CCC2=CCCCC2)C1 ZINC001690392504 1417208795 /nfs/dbraw/zinc/20/87/95/1417208795.db2.gz ZKDYAOLZWHDCCC-GOSISDBHSA-N 1 3 344.503 2.979 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@H](C[NH2+]CCCCCF)C1 ZINC001690437051 1417214887 /nfs/dbraw/zinc/21/48/87/1417214887.db2.gz VOLKRAZRMYCRPI-MSOLQXFVSA-N 1 3 341.515 2.829 10 0 EFAEHO CCCCC[NH2+]C[C@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001690739520 1417234207 /nfs/dbraw/zinc/23/42/07/1417234207.db2.gz SFUOIUWFPSAJBK-APWZRJJASA-N 1 3 341.515 2.827 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@H](C[NH2+]CCC2CCCC2)C1 ZINC001690757563 1417239201 /nfs/dbraw/zinc/23/92/01/1417239201.db2.gz LOXAGPCMPQHRSH-MOPGFXCFSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CCCC[NH+](C)C)CCN1Cc1cnccc1C ZINC001692217428 1417262537 /nfs/dbraw/zinc/26/25/37/1417262537.db2.gz GHWGNHJRXDNCTO-RBUKOAKNSA-N 1 3 346.519 2.591 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H](N(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001698568556 1417305210 /nfs/dbraw/zinc/30/52/10/1417305210.db2.gz DSXFUCRJMZJZCO-LPHOPBHVSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCCC[N@H+]1CC[C@H](N(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001698568556 1417305216 /nfs/dbraw/zinc/30/52/16/1417305216.db2.gz DSXFUCRJMZJZCO-LPHOPBHVSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H](N(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001698568557 1417305305 /nfs/dbraw/zinc/30/53/05/1417305305.db2.gz DSXFUCRJMZJZCO-QFBILLFUSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCCC[N@H+]1CC[C@H](N(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001698568557 1417305309 /nfs/dbraw/zinc/30/53/09/1417305309.db2.gz DSXFUCRJMZJZCO-QFBILLFUSA-N 1 3 341.515 2.922 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)[C@@H]1C[NH2+]C/C=C\Cl ZINC001698948340 1417353835 /nfs/dbraw/zinc/35/38/35/1417353835.db2.gz VNGYRDCGGZMXQP-LRDXNBAQSA-N 1 3 343.943 2.934 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1C ZINC001699107278 1417391508 /nfs/dbraw/zinc/39/15/08/1417391508.db2.gz SBGVPARWPXNQPY-QGZVFWFLSA-N 1 3 331.504 2.772 10 0 EFAEHO C[C@H](CC[NH2+]CC=C(Cl)Cl)NC(=O)CN(C)CC(C)(C)C ZINC001699134233 1417399364 /nfs/dbraw/zinc/39/93/64/1417399364.db2.gz VEOJZHVHDZMVGL-GFCCVEGCSA-N 1 3 338.323 2.768 10 0 EFAEHO CCN(CC[NH2+]C/C=C/c1ccc(Cl)cc1)C(=O)[C@@H]1CCCN1C ZINC001699172424 1417410019 /nfs/dbraw/zinc/41/00/19/1417410019.db2.gz DJEAJJIWJPTSQE-JXTAAOLFSA-N 1 3 349.906 2.886 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC/C=C\CNCc1cccc(Cl)c1 ZINC001699269650 1417415720 /nfs/dbraw/zinc/41/57/20/1417415720.db2.gz ABOXZYKFIFBYBZ-KVLZDYKBSA-N 1 3 349.906 2.976 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC/C=C\CNCc1cccc(Cl)c1 ZINC001699269650 1417415725 /nfs/dbraw/zinc/41/57/25/1417415725.db2.gz ABOXZYKFIFBYBZ-KVLZDYKBSA-N 1 3 349.906 2.976 10 0 EFAEHO CN(CCC[NH2+][C@@H]1CCCc2ccccc21)C(=O)[C@@H]1CCCN1C ZINC001699500338 1417426543 /nfs/dbraw/zinc/42/65/43/1417426543.db2.gz TWSZTAWUKCYJEA-MOPGFXCFSA-N 1 3 329.488 2.596 10 0 EFAEHO C[C@@H]([NH2+]CCC1=CCCCC1)[C@H]1CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001699953117 1417522637 /nfs/dbraw/zinc/52/26/37/1417522637.db2.gz ZSJYAMMWLFIDDQ-WBVHZDCISA-N 1 3 330.476 2.669 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001699969449 1417530527 /nfs/dbraw/zinc/53/05/27/1417530527.db2.gz LADGFWYONJNVRV-AZUAARDMSA-N 1 3 345.531 2.562 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+]Cc2ccc(C)c(C)c2)C1 ZINC001700088209 1417561277 /nfs/dbraw/zinc/56/12/77/1417561277.db2.gz RNWVWXZFUZOKJP-IBGZPJMESA-N 1 3 345.531 2.973 10 0 EFAEHO CC(C)(C(=O)N1C[C@H]([NH2+]CCCCCF)C(C)(C)C1)N1CCCC1 ZINC001700919900 1417689029 /nfs/dbraw/zinc/68/90/29/1417689029.db2.gz OFJBZJBXBSVDPT-INIZCTEOSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CC[NH2+]C1CCN(CC(C)C)CC1)C(=O)OC(C)(C)C ZINC000159448760 1418285114 /nfs/dbraw/zinc/28/51/14/1418285114.db2.gz UWJZDPJPWKYCHI-UHFFFAOYSA-N 1 3 327.513 2.953 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H](CC[NH2+]Cc3ccccc3)C2)C1 ZINC001714224984 1418589918 /nfs/dbraw/zinc/58/99/18/1418589918.db2.gz KAINBZNZENEVQX-AZUAARDMSA-N 1 3 343.515 2.747 10 0 EFAEHO CC(C)CCC[NH2+]CCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001714754358 1418626293 /nfs/dbraw/zinc/62/62/93/1418626293.db2.gz GEULPFJDDWHICF-GOSISDBHSA-N 1 3 329.504 2.683 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[NH2+]Cc2ccccc2C2CC2)CC1 ZINC001714773355 1418632351 /nfs/dbraw/zinc/63/23/51/1418632351.db2.gz SDPVSUQJNBQEOG-UHFFFAOYSA-N 1 3 343.515 2.844 10 0 EFAEHO Cc1ccccc1CCC[NH2+]CCN(C)C(=O)CN1CCC(C)CC1 ZINC001714774043 1418632497 /nfs/dbraw/zinc/63/24/97/1418632497.db2.gz UVPPTRSHLSQQDT-UHFFFAOYSA-N 1 3 345.531 2.708 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+]CCC2CC2)C2CCCCC2)CCC1 ZINC001714973965 1418644214 /nfs/dbraw/zinc/64/42/14/1418644214.db2.gz HGXGADYZUGWFRK-SFHVURJKSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@@H](C)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001715357639 1418666416 /nfs/dbraw/zinc/66/64/16/1418666416.db2.gz CTFZUXBEVGPFSW-IEBWSBKVSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@H](C)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001715357641 1418666620 /nfs/dbraw/zinc/66/66/20/1418666620.db2.gz CTFZUXBEVGPFSW-MJGOQNOKSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@H](C)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001715357637 1418666628 /nfs/dbraw/zinc/66/66/28/1418666628.db2.gz CTFZUXBEVGPFSW-HKUYNNGSSA-N 1 3 345.531 2.706 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)cc1)C(=O)CN(C)CC(C)(C)C ZINC001716239200 1418733634 /nfs/dbraw/zinc/73/36/34/1418733634.db2.gz FLWKGLYCBZNASM-UHFFFAOYSA-N 1 3 333.520 2.911 10 0 EFAEHO CN(CCC[NH2+]Cc1cccc(Cl)c1)C(=O)CN(C)C1CCC1 ZINC001716546537 1418910159 /nfs/dbraw/zinc/91/01/59/1418910159.db2.gz VZFMBHVXCUUUQR-UHFFFAOYSA-N 1 3 337.895 2.762 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[NH2+]CC[C@H]2CCCC2(F)F)CCC1 ZINC001716546488 1418910362 /nfs/dbraw/zinc/91/03/62/1418910362.db2.gz UQABDHPGMIMXQC-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001716547624 1418910444 /nfs/dbraw/zinc/91/04/44/1418910444.db2.gz VFLSBWKTPHDQOC-HOTGVXAUSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+]Cc1cccc(Cl)c1F ZINC001716586718 1418918636 /nfs/dbraw/zinc/91/86/36/1418918636.db2.gz DXDKRRXVZDOVAB-UHFFFAOYSA-N 1 3 343.874 2.757 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+]CCC2=CCCCC2)C2CC2)CCC1 ZINC001716613386 1418924989 /nfs/dbraw/zinc/92/49/89/1418924989.db2.gz YFFXVILERGPKCK-SFHVURJKSA-N 1 3 333.520 2.846 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC[C@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001716723449 1418974117 /nfs/dbraw/zinc/97/41/17/1418974117.db2.gz ILUHVAWTMFCSQT-RTLBZRNLSA-N 1 3 330.476 2.623 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC[C@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001716723449 1418974119 /nfs/dbraw/zinc/97/41/19/1418974119.db2.gz ILUHVAWTMFCSQT-RTLBZRNLSA-N 1 3 330.476 2.623 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@]1(C)CCN(Cc2ccc(CF)cc2)C1 ZINC001716851455 1419055616 /nfs/dbraw/zinc/05/56/16/1419055616.db2.gz YPKBVXJBSDPJHR-HXUWFJFHSA-N 1 3 349.494 2.969 10 0 EFAEHO CC(C)(C(=O)N1CC[C@](C)(C[NH2+]C/C=C\Cl)C1)N1CCCCC1 ZINC001716864032 1419062449 /nfs/dbraw/zinc/06/24/49/1419062449.db2.gz DFOYIYYIBJWOKC-YPLUBFQTSA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)(C(=O)N1CC[C@@](C)(C[NH2+]C/C=C/Cl)C1)N1CCCCC1 ZINC001716864030 1419062633 /nfs/dbraw/zinc/06/26/33/1419062633.db2.gz DFOYIYYIBJWOKC-KOEDOTQGSA-N 1 3 341.927 2.832 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@]1(C)CCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001716864396 1419063328 /nfs/dbraw/zinc/06/33/28/1419063328.db2.gz HZAPFMURBCFKRV-VQIMIIECSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)CC[NH2+]C[C@@H]1CN(C(=O)C(C)(C)N2CCCCC2)C[C@@H]1C ZINC001716982841 1419123193 /nfs/dbraw/zinc/12/31/93/1419123193.db2.gz HBWUECUAFKKOQP-ZWKOTPCHSA-N 1 3 337.552 2.981 10 0 EFAEHO CCC[NH2+]CCN(Cc1ccccc1)C(=O)CN1[C@H](C)CC[C@H]1C ZINC001717006573 1419143320 /nfs/dbraw/zinc/14/33/20/1419143320.db2.gz UDYROFBTVWOINE-QZTJIDSGSA-N 1 3 331.504 2.888 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(CC[NH2+]C/C=C\Cl)Cc2ccccc2)C1 ZINC001717007147 1419144027 /nfs/dbraw/zinc/14/40/27/1419144027.db2.gz QNBGMTGAEDUJBG-OOYWPUHTSA-N 1 3 349.906 2.699 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(CF)cc2)C1 ZINC001717077164 1419189836 /nfs/dbraw/zinc/18/98/36/1419189836.db2.gz XASFXGJDOGOISI-MOPGFXCFSA-N 1 3 347.478 2.579 10 0 EFAEHO CN(CC(=O)N1CC[C@H](CC[NH2+]CC2CC3(CCC3)C2)C1)C1CCC1 ZINC001717088410 1419198650 /nfs/dbraw/zinc/19/86/50/1419198650.db2.gz UUVVDRCQQRUIRD-KRWDZBQOSA-N 1 3 347.547 2.879 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H](CC[NH2+]CC=C(Cl)Cl)C2)CCC1 ZINC001717088467 1419198937 /nfs/dbraw/zinc/19/89/37/1419198937.db2.gz WMEFQJFEOLRMDX-ZDUSSCGKSA-N 1 3 348.318 2.618 10 0 EFAEHO CCCC[NH2+]CC[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001717110576 1419215505 /nfs/dbraw/zinc/21/55/05/1419215505.db2.gz GKSJRTDQDRATMV-KRWDZBQOSA-N 1 3 331.504 2.990 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1C ZINC001717111629 1419215903 /nfs/dbraw/zinc/21/59/03/1419215903.db2.gz WUIXOOULQOIKOE-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H]([NH2+]CCCc2ccccc2C)C1 ZINC001717290644 1419310481 /nfs/dbraw/zinc/31/04/81/1419310481.db2.gz PAWQWVJLKJZCAD-QUCCMNQESA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001717292879 1419311271 /nfs/dbraw/zinc/31/12/71/1419311271.db2.gz CDZJYAPUTPNCOF-QUCCMNQESA-N 1 3 345.531 2.704 10 0 EFAEHO CCCC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN(C)C1CCC1 ZINC001717360475 1419354150 /nfs/dbraw/zinc/35/41/50/1419354150.db2.gz DNKHLFNGEXYLGZ-UYAOXDASSA-N 1 3 329.488 2.643 10 0 EFAEHO CC/C=C/CC[N@H+](C)C[C@@H]1CCCN1C(=O)CN1CCC(C)CC1 ZINC001717372537 1419364580 /nfs/dbraw/zinc/36/45/80/1419364580.db2.gz GWYMONDTJRVUGL-UEKDZROGSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](C)C[C@@H]1CCCN1C(=O)CN1CCC(C)CC1 ZINC001717372537 1419364582 /nfs/dbraw/zinc/36/45/82/1419364582.db2.gz GWYMONDTJRVUGL-UEKDZROGSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+](C)C[C@H]1CCCN1C(=O)CN1CCC(C)CC1 ZINC001717372536 1419364777 /nfs/dbraw/zinc/36/47/77/1419364777.db2.gz GWYMONDTJRVUGL-SFFCAUCYSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](C)C[C@H]1CCCN1C(=O)CN1CCC(C)CC1 ZINC001717372536 1419364781 /nfs/dbraw/zinc/36/47/81/1419364781.db2.gz GWYMONDTJRVUGL-SFFCAUCYSA-N 1 3 335.536 2.997 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC(C)(C)C[NH2+]C/C=C\Cl ZINC001717460033 1419402797 /nfs/dbraw/zinc/40/27/97/1419402797.db2.gz WWIPKZNJQUOKFA-WWRUEGTHSA-N 1 3 329.916 2.688 10 0 EFAEHO C[C@@H](CNC(=O)CCCC[NH+](C)C)N(C)[C@H]1CCc2c1cccc2F ZINC001717494798 1419416569 /nfs/dbraw/zinc/41/65/69/1419416569.db2.gz MBGPGYWKWXHIGW-KXBFYZLASA-N 1 3 349.494 2.981 10 0 EFAEHO CC(C)=CCN1C[C@@H](NC(=O)[C@H](C(C)C)[NH+]2CCCC2)C(C)(C)C1 ZINC001717589904 1419460447 /nfs/dbraw/zinc/46/04/47/1419460447.db2.gz TTYJKSNLEVHFGH-MSOLQXFVSA-N 1 3 335.536 2.900 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001717627802 1419476397 /nfs/dbraw/zinc/47/63/97/1419476397.db2.gz ZWVMQQQHUOODBF-TYTUHHLSSA-N 1 3 335.536 2.900 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001717627802 1419476398 /nfs/dbraw/zinc/47/63/98/1419476398.db2.gz ZWVMQQQHUOODBF-TYTUHHLSSA-N 1 3 335.536 2.900 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001717627799 1419476486 /nfs/dbraw/zinc/47/64/86/1419476486.db2.gz ZWVMQQQHUOODBF-NEPBSLMDSA-N 1 3 335.536 2.900 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001717627799 1419476487 /nfs/dbraw/zinc/47/64/87/1419476487.db2.gz ZWVMQQQHUOODBF-NEPBSLMDSA-N 1 3 335.536 2.900 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H](C[NH2+]C/C=C/c2ccccc2)C1)C1CCC1 ZINC001717642272 1419484389 /nfs/dbraw/zinc/48/43/89/1419484389.db2.gz PDQKGDLDYKHYAM-ZKCQLFTGSA-N 1 3 341.499 2.669 10 0 EFAEHO C[C@@H](CCC[NH2+]Cc1cccc(F)c1)NC(=O)CN1CC[C@@H](C)C1 ZINC001717684421 1419504791 /nfs/dbraw/zinc/50/47/91/1419504791.db2.gz MHESQOAFTSXGCV-CVEARBPZSA-N 1 3 335.467 2.542 10 0 EFAEHO CC(C)CCC[NH2+][C@H]1C[C@@H](C)N(C(=O)CN(C)CC(C)(C)C)C1 ZINC001717821112 1419557412 /nfs/dbraw/zinc/55/74/12/1419557412.db2.gz AMNYQFFWWGCBOS-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)c1 ZINC001717831511 1419562451 /nfs/dbraw/zinc/56/24/51/1419562451.db2.gz YHJPSDZKFYZTGZ-QUCCMNQESA-N 1 3 345.531 2.847 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C[NH2+]CCc1cccs1)C(C)(C)C)N(C)C ZINC001717971889 1419635191 /nfs/dbraw/zinc/63/51/91/1419635191.db2.gz VELJKFKFQLTHEH-JKSUJKDBSA-N 1 3 339.549 2.751 10 0 EFAEHO CN(CCC[NH2+]Cc1ccccc1Cl)C(=O)[C@H]1CCCCN1C ZINC001723055708 1424413004 /nfs/dbraw/zinc/41/30/04/1424413004.db2.gz RJHPFPFDDYYFJX-QGZVFWFLSA-N 1 3 337.895 2.762 10 0 EFAEHO CN(CC(=O)N(C)CCC[NH2+]C[C@H]1CCC(F)(F)C1)CC(C)(C)C ZINC001723122668 1424428534 /nfs/dbraw/zinc/42/85/34/1424428534.db2.gz INCUYMHKTNPGSZ-HNNXBMFYSA-N 1 3 347.494 2.838 10 0 EFAEHO Cc1ccc(C[NH2+]CCCN(C)C(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001723124133 1424430353 /nfs/dbraw/zinc/43/03/53/1424430353.db2.gz USTDVEMDLKWYRK-KRWDZBQOSA-N 1 3 331.504 2.583 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001723175432 1424443075 /nfs/dbraw/zinc/44/30/75/1424443075.db2.gz FAWUFNGMJKWIIL-IBGZPJMESA-N 1 3 333.520 2.890 10 0 EFAEHO CCC/C=C/CC[NH2+][C@@H]1CCN(C(=O)Cc2c[nH]cn2)C[C@@H]1CC ZINC001723380413 1424481247 /nfs/dbraw/zinc/48/12/47/1424481247.db2.gz YOWAMRIVTVULAD-ZZGCUDHESA-N 1 3 332.492 2.915 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC[C@@H]2CCN2CCC2=CCCCC2)CC1 ZINC001723462916 1424504547 /nfs/dbraw/zinc/50/45/47/1424504547.db2.gz XIZRZCJIFNCLBG-IBGZPJMESA-N 1 3 333.520 2.799 10 0 EFAEHO CCCCC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CCC(C)CC3)C2)C1 ZINC001723721771 1424570367 /nfs/dbraw/zinc/57/03/67/1424570367.db2.gz PXUMADSLCWGJBQ-FQEVSTJZSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCC[N@H+]1CC[C@]2(CCN(C(=O)CN3CCC(C)CC3)C2)C1 ZINC001723721771 1424570373 /nfs/dbraw/zinc/57/03/73/1424570373.db2.gz PXUMADSLCWGJBQ-FQEVSTJZSA-N 1 3 335.536 2.833 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@H]2C[NH2+]C/C=C\c2ccccc2)CCC1 ZINC001723905195 1424608169 /nfs/dbraw/zinc/60/81/69/1424608169.db2.gz CVLAFQLRIRAEFI-LFIXQJEJSA-N 1 3 341.499 2.765 10 0 EFAEHO CCCC[NH2+]C[C@@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001723939968 1424611495 /nfs/dbraw/zinc/61/14/95/1424611495.db2.gz NEFHHMRXVSNGMD-YJBOKZPZSA-N 1 3 327.488 2.580 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H](CNCC=C(Cl)Cl)C1CCCC1 ZINC001724096000 1424655337 /nfs/dbraw/zinc/65/53/37/1424655337.db2.gz RIQKTUXURQMPTO-CYBMUJFWSA-N 1 3 336.307 2.522 10 0 EFAEHO CCc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001724753253 1424982470 /nfs/dbraw/zinc/98/24/70/1424982470.db2.gz ZNVQUCFQOYUNQS-HXUWFJFHSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1[NH2+]CCCCCF ZINC001724950582 1425158101 /nfs/dbraw/zinc/15/81/01/1425158101.db2.gz ZBLAFZHVKMGFFB-HOTGVXAUSA-N 1 3 329.504 2.541 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001725091063 1425294167 /nfs/dbraw/zinc/29/41/67/1425294167.db2.gz LUBDLGHKNJKTOS-QZTJIDSGSA-N 1 3 345.531 2.895 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H](C)[NH2+]CCCc1ccc(C)cc1 ZINC001725122388 1425315118 /nfs/dbraw/zinc/31/51/18/1425315118.db2.gz CWKALFJBIHTENW-HOTGVXAUSA-N 1 3 342.487 2.685 10 0 EFAEHO CC(C)=CCN(C)[C@@H](C)CNC(=O)c1ccc(CC[NH+](C)C)cc1 ZINC001725183994 1425363293 /nfs/dbraw/zinc/36/32/93/1425363293.db2.gz XLFKZMCZESWOSO-KRWDZBQOSA-N 1 3 331.504 2.807 10 0 EFAEHO CC(C)=CCN1CC([C@@H](C)NC(=O)C2(C[NH+](C)C)CCCCC2)C1 ZINC001725261681 1425423206 /nfs/dbraw/zinc/42/32/06/1425423206.db2.gz VWFDOTORYFXBOB-QGZVFWFLSA-N 1 3 335.536 2.901 10 0 EFAEHO Cc1ccc(C[NH2+]CCC[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1F ZINC001725412500 1425556240 /nfs/dbraw/zinc/55/62/40/1425556240.db2.gz DCSFLCOTIDHPDC-WBVHZDCISA-N 1 3 349.494 2.850 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H](C[NH2+]C/C=C/c2ccccc2)C1 ZINC001725653502 1425755816 /nfs/dbraw/zinc/75/58/16/1425755816.db2.gz JBYIHSKWDQLWTK-DSJULSIBSA-N 1 3 343.515 2.915 10 0 EFAEHO CC(C)CC[NH+]1CCC(NC[C@H](C)N2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000926660262 717946215 /nfs/dbraw/zinc/94/62/15/717946215.db2.gz IOCWMCIGNZVUEJ-OKZBNKHCSA-N 1 3 325.541 2.584 10 0 EFAEHO COc1ccc(Br)c(CN2C[C@@H](C)[C@H](CC[NH3+])C2)c1 ZINC000723901371 715005985 /nfs/dbraw/zinc/00/59/85/715005985.db2.gz GCOLZWWPXOBCNL-VXGBXAGGSA-N 1 3 327.266 2.874 10 0 EFAEHO FC(F)(F)c1ccn(CCN[C@H]2CC[NH2+]C[C@H]2C2CCCC2)n1 ZINC000925727940 715997854 /nfs/dbraw/zinc/99/78/54/715997854.db2.gz CCJWEHOELLVUER-KBPBESRZSA-N 1 3 330.398 2.660 10 0 EFAEHO FC(F)(F)c1ccn(CC[NH2+][C@H]2CCNC[C@H]2C2CCCC2)n1 ZINC000925727940 715997857 /nfs/dbraw/zinc/99/78/57/715997857.db2.gz CCJWEHOELLVUER-KBPBESRZSA-N 1 3 330.398 2.660 10 0 EFAEHO COCc1cc([C@H](C)[NH2+]C[C@H]2CNCCC2(F)F)ccc1OC ZINC000925779918 717694411 /nfs/dbraw/zinc/69/44/11/717694411.db2.gz QGXJDUJKUADISP-SWLSCSKDSA-N 1 3 328.403 2.737 10 0 EFAEHO N[C@@H]1C[C@@H]([NH2+]CC2(n3cc(Br)cn3)CC2)c2ccccc21 ZINC000925837026 719580366 /nfs/dbraw/zinc/58/03/66/719580366.db2.gz BNNVCYKGSFTRMX-HUUCEWRRSA-N 1 3 347.260 2.869 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2[NH2+]1 ZINC000261547901 719615803 /nfs/dbraw/zinc/61/58/03/719615803.db2.gz IXLXMLUPFZXXKH-LULLPPNCSA-N 1 3 329.488 2.544 10 0 EFAEHO CCN1CC[C@H](C[NH2+]C2CCN(c3ccc(N(C)C)cc3)CC2)C1 ZINC000163277026 724657401 /nfs/dbraw/zinc/65/74/01/724657401.db2.gz TURCRPRDVBAAKK-QGZVFWFLSA-N 1 3 330.520 2.653 10 0 EFAEHO CC1(C)C[C@H]([NH3+])C[C@@H](NCCOc2cccc(C(F)(F)F)n2)C1 ZINC000925628421 720627564 /nfs/dbraw/zinc/62/75/64/720627564.db2.gz FRQGESGYKLKMEL-VXGBXAGGSA-N 1 3 331.382 2.975 10 0 EFAEHO FC(F)C(F)(F)COCCN[C@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925652827 720753134 /nfs/dbraw/zinc/75/31/34/720753134.db2.gz UELHYCGIRDZODO-STQMWFEESA-N 1 3 326.378 2.661 10 0 EFAEHO CC[NH+](CC)Cc1ccc(CNC[C@H]2[C@@H](C(=O)OC)C2(F)F)cc1 ZINC000894152819 720944100 /nfs/dbraw/zinc/94/41/00/720944100.db2.gz DSVFTJWRERELOD-HOTGVXAUSA-N 1 3 340.414 2.672 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2cnc3onc(C)c3c2)[C@H](C)C1 ZINC000894257020 721764786 /nfs/dbraw/zinc/76/47/86/721764786.db2.gz XWQWEISTFGEARW-KDOFPFPSSA-N 1 3 346.475 2.758 10 0 EFAEHO CCN1CCN(C[C@H](C)C[NH2+][C@H]2CCc3c2nccc3Cl)CC1 ZINC000924953163 721862517 /nfs/dbraw/zinc/86/25/17/721862517.db2.gz PZWWHQKDMUYLFF-PBHICJAKSA-N 1 3 336.911 2.586 10 0 EFAEHO CCN1CCN(C[C@@H](C)C[NH2+][C@@H]2CCc3c2nccc3Cl)CC1 ZINC000924953165 721862789 /nfs/dbraw/zinc/86/27/89/721862789.db2.gz PZWWHQKDMUYLFF-WMLDXEAASA-N 1 3 336.911 2.586 10 0 EFAEHO Cc1noc2ncc(C[NH2+]CCCCN3C[C@H](C)O[C@@H](C)C3)cc12 ZINC000894299923 722005019 /nfs/dbraw/zinc/00/50/19/722005019.db2.gz RUMOHXKVEIBZII-KBPBESRZSA-N 1 3 332.448 2.510 10 0 EFAEHO CCN1CCN(CCC[NH2+]Cc2cc3c(cccc3O)s2)CC1 ZINC000894386163 722677868 /nfs/dbraw/zinc/67/78/68/722677868.db2.gz ZSNLBPAACBNJJU-UHFFFAOYSA-N 1 3 333.501 2.724 10 0 EFAEHO CC[NH+](CC)CCCC1CCN(C[C@@H]2[C@@H](C(=O)OC)C2(F)F)CC1 ZINC000894436134 722736736 /nfs/dbraw/zinc/73/67/36/722736736.db2.gz DIKKHWWNZXJION-CVEARBPZSA-N 1 3 346.462 2.875 10 0 EFAEHO CC[NH+](CC)CCCNC(=O)C1CCN(Cc2cc(C)co2)CC1 ZINC000894761910 722840972 /nfs/dbraw/zinc/84/09/72/722840972.db2.gz ANMJIEHAXBXQIP-UHFFFAOYSA-N 1 3 335.492 2.648 10 0 EFAEHO c1cc(C[NH2+]CCCCN2CCN(Cc3ccccc3)CC2)co1 ZINC000727466954 724055674 /nfs/dbraw/zinc/05/56/74/724055674.db2.gz JWSAIBQXEIPYTE-UHFFFAOYSA-N 1 3 327.472 2.967 10 0 EFAEHO COc1ccc(C2=NO[C@H](C[NH2+][C@@H]3CCN(C)C(C)(C)C3)C2)cc1C ZINC000895500545 724170810 /nfs/dbraw/zinc/17/08/10/724170810.db2.gz AOZMWPBIPODMHY-SJORKVTESA-N 1 3 345.487 2.959 10 0 EFAEHO CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(C[NH+]2CCC(C)(N3CCC3)CC2)C1 ZINC000895672315 724253393 /nfs/dbraw/zinc/25/33/93/724253393.db2.gz WMOBUGJPDPVQBX-JXFKEZNVSA-N 1 3 349.519 2.804 10 0 EFAEHO CN1C[C@H]2CC[C@@H](C1)C2[NH2+]CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000925379266 725687517 /nfs/dbraw/zinc/68/75/17/725687517.db2.gz CXFKQNOTPQZQOM-VMZNBEPHSA-N 1 3 346.862 2.862 10 0 EFAEHO C[C@H]1[C@H](NC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)CCN1C ZINC000913949141 725964384 /nfs/dbraw/zinc/96/43/84/725964384.db2.gz DFCRNKSHPSIOAU-QFBILLFUSA-N 1 3 344.503 2.564 10 0 EFAEHO C[C@H](NC(=O)c1ccc(NC2=NCCC2)cc1)C1=CC[N@H+](C)CC1 ZINC000907284540 726907660 /nfs/dbraw/zinc/90/76/60/726907660.db2.gz MQRZUNGVOIGJAM-AWEZNQCLSA-N 1 3 326.444 2.671 10 0 EFAEHO C[C@H](NC(=O)c1ccc(NC2=NCCC2)cc1)C1=CC[N@@H+](C)CC1 ZINC000907284540 726907665 /nfs/dbraw/zinc/90/76/65/726907665.db2.gz MQRZUNGVOIGJAM-AWEZNQCLSA-N 1 3 326.444 2.671 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC000909919682 727393597 /nfs/dbraw/zinc/39/35/97/727393597.db2.gz YYVJXAHRAZCEPS-SJORKVTESA-N 1 3 335.517 2.655 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC000909919682 727393598 /nfs/dbraw/zinc/39/35/98/727393598.db2.gz YYVJXAHRAZCEPS-SJORKVTESA-N 1 3 335.517 2.655 10 0 EFAEHO C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000913099547 727781885 /nfs/dbraw/zinc/78/18/85/727781885.db2.gz MZSVFQBJGHRXME-UMGGQSCQSA-N 1 3 343.515 2.744 10 0 EFAEHO C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000913099547 727781888 /nfs/dbraw/zinc/78/18/88/727781888.db2.gz MZSVFQBJGHRXME-UMGGQSCQSA-N 1 3 343.515 2.744 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1[C@H]1CC[N@H+](CC=C(C)C)C1 ZINC001569436589 1085212483 /nfs/dbraw/zinc/21/24/83/1085212483.db2.gz JLSSRFQVFJYMJK-OALUTQOASA-N 1 3 335.536 2.997 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1[C@H]1CC[N@@H+](CC=C(C)C)C1 ZINC001569436589 1085212495 /nfs/dbraw/zinc/21/24/95/1085212495.db2.gz JLSSRFQVFJYMJK-OALUTQOASA-N 1 3 335.536 2.997 10 0 EFAEHO CCCCC[NH+]1CCC2(CCN(C(=O)CN3CC[C@H](C)C3)C2)CC1 ZINC001569471073 1085268999 /nfs/dbraw/zinc/26/89/99/1085268999.db2.gz RGPSONZTHKMSCT-SFHVURJKSA-N 1 3 335.536 2.833 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC2(C1)CCN(C/C=C/Cl)CC2 ZINC001569471045 1085269599 /nfs/dbraw/zinc/26/95/99/1085269599.db2.gz QJXSKOIUTJTQRT-BJMVGYQFSA-N 1 3 341.927 2.785 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@](C)(C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001569683451 1085514826 /nfs/dbraw/zinc/51/48/26/1085514826.db2.gz KGYZGPDOAVJRIZ-CPCPBRJNSA-N 1 3 343.515 2.868 10 0 EFAEHO CCC[NH2+]CCN(Cc1ccccc1)C(=O)C(C)(C)N1CCCC1 ZINC001569870425 1085699683 /nfs/dbraw/zinc/69/96/83/1085699683.db2.gz WGNDSTCFXCMFRN-UHFFFAOYSA-N 1 3 331.504 2.889 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1c[nH]cn1 ZINC001569915864 1085761446 /nfs/dbraw/zinc/76/14/46/1085761446.db2.gz VJQWRIRPKAVLSO-HOTGVXAUSA-N 1 3 332.492 2.943 10 0 EFAEHO CCCCC[N@H+]1CC[C@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1c[nH]cn1 ZINC001569915864 1085761452 /nfs/dbraw/zinc/76/14/52/1085761452.db2.gz VJQWRIRPKAVLSO-HOTGVXAUSA-N 1 3 332.492 2.943 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1c[nH]cn1 ZINC001569915866 1085763315 /nfs/dbraw/zinc/76/33/15/1085763315.db2.gz VJQWRIRPKAVLSO-JKSUJKDBSA-N 1 3 332.492 2.943 10 0 EFAEHO CCCCC[N@H+]1CC[C@@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1c[nH]cn1 ZINC001569915866 1085763320 /nfs/dbraw/zinc/76/33/20/1085763320.db2.gz VJQWRIRPKAVLSO-JKSUJKDBSA-N 1 3 332.492 2.943 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@H](CC[NH2+]Cc2ccccc2)C1 ZINC001570021202 1085868676 /nfs/dbraw/zinc/86/86/76/1085868676.db2.gz CMTUUAFXLJDDER-PMACEKPBSA-N 1 3 343.515 2.889 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001570022140 1085870295 /nfs/dbraw/zinc/87/02/95/1085870295.db2.gz ONXQFYXAUZRLGT-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001570022556 1085870764 /nfs/dbraw/zinc/87/07/64/1085870764.db2.gz WMSVBLSMWPBIQC-GOSISDBHSA-N 1 3 345.531 2.917 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]CCCc3ccsc3)CCC2)CCC1 ZINC001570106611 1085954885 /nfs/dbraw/zinc/95/48/85/1085954885.db2.gz GFVLQDXQVRUNOK-UHFFFAOYSA-N 1 3 349.544 2.794 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@H+](CCCCCF)CC1)N(C)C ZINC001570177694 1086017333 /nfs/dbraw/zinc/01/73/33/1086017333.db2.gz QDAAEUXCSAOOOF-SJORKVTESA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@@H+](CCCCCF)CC1)N(C)C ZINC001570177694 1086017342 /nfs/dbraw/zinc/01/73/42/1086017342.db2.gz QDAAEUXCSAOOOF-SJORKVTESA-N 1 3 329.504 2.683 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC(C)([NH2+]CCC2=CCCCC2)CC1 ZINC001570378172 1086180361 /nfs/dbraw/zinc/18/03/61/1086180361.db2.gz LVLZSXIDIXHMIX-GOSISDBHSA-N 1 3 333.520 2.942 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CCCF ZINC001570519436 1086306341 /nfs/dbraw/zinc/30/63/41/1086306341.db2.gz NLQVLXLBHZEZAM-CEXWTWQISA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC(C)(C)C[NH2+]CCC(F)(F)F)N(C)C ZINC001570687642 1086460277 /nfs/dbraw/zinc/46/02/77/1086460277.db2.gz DNHNQSPZQJDVQD-CYBMUJFWSA-N 1 3 339.446 2.599 10 0 EFAEHO C[C@@H](CCC[NH2+]C[C@@H]1CCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001571271528 1086693328 /nfs/dbraw/zinc/69/33/28/1086693328.db2.gz WZSSIYJIGKDVNZ-LSDHHAIUSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)CCC[NH2+]Cc1cccnc1 ZINC001571315172 1086711944 /nfs/dbraw/zinc/71/19/44/1086711944.db2.gz SEWJSTJJXHIVDF-MJGOQNOKSA-N 1 3 346.519 2.719 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N(C)[C@H](C[NH2+]CCC(F)(F)F)C1CC1 ZINC001571360110 1086755036 /nfs/dbraw/zinc/75/50/36/1086755036.db2.gz LUPUIRCRXRMJTG-LSDHHAIUSA-N 1 3 349.441 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CCCc2ccccc2)[C@H]1C ZINC001571467693 1086842736 /nfs/dbraw/zinc/84/27/36/1086842736.db2.gz PFKUMHBMLQCMHN-MJGOQNOKSA-N 1 3 331.504 2.538 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccccc2C)C[C@@H]1C ZINC001571490290 1086878151 /nfs/dbraw/zinc/87/81/51/1086878151.db2.gz BTALBGOBEDQTHX-AZUAARDMSA-N 1 3 345.531 2.848 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCc2ccccc2C)C[C@H]1C ZINC001571490292 1086880992 /nfs/dbraw/zinc/88/09/92/1086880992.db2.gz BTALBGOBEDQTHX-QUCCMNQESA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)[C@H](C(=O)N1C[C@@H]([NH2+]CCCCCF)C(C)(C)C1)N(C)C ZINC001571567148 1086967147 /nfs/dbraw/zinc/96/71/47/1086967147.db2.gz HSWXSIHUCCJVDO-HZPDHXFCSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)(C)[C@@H](CNCCF)NC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001571630311 1087001371 /nfs/dbraw/zinc/00/13/71/1087001371.db2.gz FBULLQSFWCFOKB-DLBZAZTESA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)(C)[C@@H](CNCCF)NC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001571630311 1087001373 /nfs/dbraw/zinc/00/13/73/1087001373.db2.gz FBULLQSFWCFOKB-DLBZAZTESA-N 1 3 341.515 2.874 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCC1=CCN(Cc2ccccc2)CC1 ZINC001571688962 1087052893 /nfs/dbraw/zinc/05/28/93/1087052893.db2.gz GFDCZBQDDJBGKH-HXUWFJFHSA-N 1 3 341.499 2.809 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCC1=CCN(Cc2ccccc2)CC1 ZINC001571688962 1087052898 /nfs/dbraw/zinc/05/28/98/1087052898.db2.gz GFDCZBQDDJBGKH-HXUWFJFHSA-N 1 3 341.499 2.809 10 0 EFAEHO CCCCCC[N@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001480913476 1092390286 /nfs/dbraw/zinc/39/02/86/1092390286.db2.gz OPGPQWZMDTUZOB-SFHVURJKSA-N 1 3 329.504 2.827 10 0 EFAEHO CCCCCC[N@@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001480913476 1092390292 /nfs/dbraw/zinc/39/02/92/1092390292.db2.gz OPGPQWZMDTUZOB-SFHVURJKSA-N 1 3 329.504 2.827 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[NH2+]CC/C=C\c2ccccc2)C1)N(C)C ZINC001267067097 1092522703 /nfs/dbraw/zinc/52/27/03/1092522703.db2.gz NHCQFPPYFIEMRB-MYPZJPOHSA-N 1 3 343.515 2.868 10 0 EFAEHO C[NH+](C)[C@@H]1CCCC[C@H]1NC(=O)c1cccc(CN2CCCC2)c1 ZINC001649698498 1092595124 /nfs/dbraw/zinc/59/51/24/1092595124.db2.gz AOFHYVTVDMRZMX-RTBURBONSA-N 1 3 329.488 2.885 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCCC[C@H]1CCC[N@@H+]1CCCF ZINC001267178452 1093087276 /nfs/dbraw/zinc/08/72/76/1093087276.db2.gz XKMUVGLKKLCQPG-ROUUACIJSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCCC[C@H]1CCC[N@H+]1CCCF ZINC001267178452 1093087284 /nfs/dbraw/zinc/08/72/84/1093087284.db2.gz XKMUVGLKKLCQPG-ROUUACIJSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H]([NH2+]CCCCCF)C1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001267201669 1093180427 /nfs/dbraw/zinc/18/04/27/1093180427.db2.gz QWFDYOGLPKRJES-IRXDYDNUSA-N 1 3 341.515 2.685 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[NH2+]C/C=C\c1ccc(Cl)cc1)N(C)C ZINC001267456599 1094556999 /nfs/dbraw/zinc/55/69/99/1094556999.db2.gz CISMFNVFRPSURR-JTGQJZMRSA-N 1 3 337.895 2.741 10 0 EFAEHO Cc1cc(Cl)ccc1CN1CC[C@H](CNC(=O)CC[NH+](C)C)C1 ZINC001481108968 1094588542 /nfs/dbraw/zinc/58/85/42/1094588542.db2.gz IRTUEGMONZXXII-OAHLLOKOSA-N 1 3 337.895 2.538 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@H+](CC2=CCCCC2)C1)CC(C)(C)C ZINC001481112883 1094618655 /nfs/dbraw/zinc/61/86/55/1094618655.db2.gz UBUWKFHAADAJEK-GOSISDBHSA-N 1 3 335.536 2.903 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@@H+](CC2=CCCCC2)C1)CC(C)(C)C ZINC001481112883 1094618661 /nfs/dbraw/zinc/61/86/61/1094618661.db2.gz UBUWKFHAADAJEK-GOSISDBHSA-N 1 3 335.536 2.903 10 0 EFAEHO Cc1cc(C[NH2+]CCN(C)C(=O)c2cccc(CN(C)C)c2)cs1 ZINC001267472951 1094759393 /nfs/dbraw/zinc/75/93/93/1094759393.db2.gz CSLCHLBBNLHMRX-UHFFFAOYSA-N 1 3 345.512 2.980 10 0 EFAEHO CCCN(CCNC(=O)[C@@H]1C[NH+]2CCC1CC2)Cc1csc(C)c1 ZINC001481137023 1094936073 /nfs/dbraw/zinc/93/60/73/1094936073.db2.gz ZBIAEFORENAHCU-GOSISDBHSA-N 1 3 349.544 2.727 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@H+](CC2CCC(C)CC2)C1)N(C)C ZINC001481535389 1095173534 /nfs/dbraw/zinc/17/35/34/1095173534.db2.gz IDYHNCSSXCGGLE-BTRQGYIVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@@H+](CC2CCC(C)CC2)C1)N(C)C ZINC001481535389 1095173541 /nfs/dbraw/zinc/17/35/41/1095173541.db2.gz IDYHNCSSXCGGLE-BTRQGYIVSA-N 1 3 337.552 2.980 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NC[C@H](NCC2=CCCCC2)c2ccccc2)C1 ZINC001267526539 1095307477 /nfs/dbraw/zinc/30/74/77/1095307477.db2.gz VXFFDNVXYLQUER-UXHICEINSA-N 1 3 341.499 2.886 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NC[C@H](NCC2=CCCCC2)c2ccccc2)C1 ZINC001267526539 1095307494 /nfs/dbraw/zinc/30/74/94/1095307494.db2.gz VXFFDNVXYLQUER-UXHICEINSA-N 1 3 341.499 2.886 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NC[C@@H](NCC2=CCCCC2)c2ccccc2)C1 ZINC001267526541 1095308377 /nfs/dbraw/zinc/30/83/77/1095308377.db2.gz VXFFDNVXYLQUER-WOJBJXKFSA-N 1 3 341.499 2.886 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NC[C@@H](NCC2=CCCCC2)c2ccccc2)C1 ZINC001267526541 1095308387 /nfs/dbraw/zinc/30/83/87/1095308387.db2.gz VXFFDNVXYLQUER-WOJBJXKFSA-N 1 3 341.499 2.886 10 0 EFAEHO C[C@@H](C[NH2+]CCCC(C)(C)C)N(C)C(=O)CN1CCC(C)CC1 ZINC001268093943 1095310860 /nfs/dbraw/zinc/31/08/60/1095310860.db2.gz RBJOUUFNAMHNTH-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]CCc1ccccc1Cl ZINC001268098197 1095348635 /nfs/dbraw/zinc/34/86/35/1095348635.db2.gz DTHBQHMNPFRBGK-OAHLLOKOSA-N 1 3 339.911 2.659 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@@H](C[NH2+]C/C=C/Cl)C2CCCCC2)C1 ZINC001268118687 1095404168 /nfs/dbraw/zinc/40/41/68/1095404168.db2.gz CWYMRSLFBIXBJH-IZVQQQLMSA-N 1 3 341.927 2.735 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[C@H](C[NH2+]C/C=C\Cl)CC1)C1CCC1 ZINC001279261970 1095416392 /nfs/dbraw/zinc/41/63/92/1095416392.db2.gz KLJPFRCGLAGFIX-HHCPYQQPSA-N 1 3 341.927 2.735 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[N@H+](C)CCC2=CCCCC2)C1 ZINC001267702135 1095531530 /nfs/dbraw/zinc/53/15/30/1095531530.db2.gz CQLLLFBMBLECGS-IBGZPJMESA-N 1 3 335.536 2.999 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[N@@H+](C)CCC2=CCCCC2)C1 ZINC001267702135 1095531541 /nfs/dbraw/zinc/53/15/41/1095531541.db2.gz CQLLLFBMBLECGS-IBGZPJMESA-N 1 3 335.536 2.999 10 0 EFAEHO CC[C@H](F)C[NH2+]CC[C@H]1CCCCN1C(=O)CN(C)C1CCC1 ZINC001268152963 1095545257 /nfs/dbraw/zinc/54/52/57/1095545257.db2.gz BPTUKKHUVPQQRS-DOTOQJQBSA-N 1 3 327.488 2.580 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@H]1CC[NH2+]CCc1ccccc1 ZINC001268160334 1095593302 /nfs/dbraw/zinc/59/33/02/1095593302.db2.gz HRBKLXXIZOZFBL-IBGZPJMESA-N 1 3 340.471 2.556 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1C[C@@H]2C[C@H]1CN2CCC1CCCCC1 ZINC001267716078 1095621253 /nfs/dbraw/zinc/62/12/53/1095621253.db2.gz LKTSAFJKQILIAR-OALUTQOASA-N 1 3 335.536 2.974 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CC)Cc2cc(F)ccc2C)CC[N@@H+]1C ZINC001480976267 1095637976 /nfs/dbraw/zinc/63/79/76/1095637976.db2.gz ZWYMMXQXVWCVOB-RBUKOAKNSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CC)Cc2cc(F)ccc2C)CC[N@H+]1C ZINC001480976267 1095637983 /nfs/dbraw/zinc/63/79/83/1095637983.db2.gz ZWYMMXQXVWCVOB-RBUKOAKNSA-N 1 3 349.494 2.803 10 0 EFAEHO C[N@H+](CCCCC(F)(F)F)C[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001267596663 1096121145 /nfs/dbraw/zinc/12/11/45/1096121145.db2.gz OKZCJGOLSBWIKZ-HNNXBMFYSA-N 1 3 349.441 2.595 10 0 EFAEHO C[N@@H+](CCCCC(F)(F)F)C[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001267596663 1096121148 /nfs/dbraw/zinc/12/11/48/1096121148.db2.gz OKZCJGOLSBWIKZ-HNNXBMFYSA-N 1 3 349.441 2.595 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCN(C)CC1=CCCCC1)[NH+]1CCCC1 ZINC001268259790 1096196261 /nfs/dbraw/zinc/19/62/61/1096196261.db2.gz QSYOCZBHGKARLT-LJQANCHMSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)CC[C@H]21 ZINC001268263796 1096199580 /nfs/dbraw/zinc/19/95/80/1096199580.db2.gz BZYCDWKMNCQNMM-TZFVZSICSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)CC[C@H]21 ZINC001268263796 1096199589 /nfs/dbraw/zinc/19/95/89/1096199589.db2.gz BZYCDWKMNCQNMM-TZFVZSICSA-N 1 3 347.547 2.997 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]CCCC1CCC1 ZINC001268291742 1096272620 /nfs/dbraw/zinc/27/26/20/1096272620.db2.gz NLIZADYGLOVLSD-DLBZAZTESA-N 1 3 332.492 2.715 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CCC[C@@H]1C[NH2+]CCCC1CCC1 ZINC001268291747 1096272936 /nfs/dbraw/zinc/27/29/36/1096272936.db2.gz NLIZADYGLOVLSD-SJORKVTESA-N 1 3 332.492 2.715 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)[C@@H]1CC[N@H+](CCCCCF)C1 ZINC001481729088 1096431902 /nfs/dbraw/zinc/43/19/02/1096431902.db2.gz PLNYNLDOMBACTF-IAGOWNOFSA-N 1 3 327.488 2.533 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)[C@@H]1CC[N@@H+](CCCCCF)C1 ZINC001481729088 1096431909 /nfs/dbraw/zinc/43/19/09/1096431909.db2.gz PLNYNLDOMBACTF-IAGOWNOFSA-N 1 3 327.488 2.533 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)[C@H]1CC[N@H+](CCCCCF)C1 ZINC001481729091 1096431938 /nfs/dbraw/zinc/43/19/38/1096431938.db2.gz PLNYNLDOMBACTF-IRXDYDNUSA-N 1 3 327.488 2.533 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)[C@H]1CC[N@@H+](CCCCCF)C1 ZINC001481729091 1096431943 /nfs/dbraw/zinc/43/19/43/1096431943.db2.gz PLNYNLDOMBACTF-IRXDYDNUSA-N 1 3 327.488 2.533 10 0 EFAEHO C[C@@H](CC[NH2+]CC1CCC(F)(F)CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001268399982 1096493984 /nfs/dbraw/zinc/49/39/84/1096493984.db2.gz OVZUOGPXTMPPPH-CABCVRRESA-N 1 3 345.478 2.638 10 0 EFAEHO CN(C(=O)C[C@@H]1CC[N@H+](C)C1)[C@@H]1CCN(CCCCC(F)(F)F)C1 ZINC001481747176 1096509691 /nfs/dbraw/zinc/50/96/91/1096509691.db2.gz NHFXTTLYLSFVJG-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CN(C(=O)C[C@@H]1CC[N@@H+](C)C1)[C@@H]1CCN(CCCCC(F)(F)F)C1 ZINC001481747176 1096509695 /nfs/dbraw/zinc/50/96/95/1096509695.db2.gz NHFXTTLYLSFVJG-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cc(F)ccc1F)N(C)C ZINC001268413613 1096550899 /nfs/dbraw/zinc/55/08/99/1096550899.db2.gz LMKAULANJFKVBF-GUYCJALGSA-N 1 3 341.446 2.535 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001268414593 1096556925 /nfs/dbraw/zinc/55/69/25/1096556925.db2.gz LKFGTRKACJVKQU-IEBWSBKVSA-N 1 3 333.520 2.936 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCC[N@@H+]1C(C)C)NCC=C(Cl)Cl ZINC001481810363 1096723425 /nfs/dbraw/zinc/72/34/25/1096723425.db2.gz GACVEWMAFTWKHU-QWHCGFSZSA-N 1 3 336.307 2.663 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCC[N@H+]1C(C)C)NCC=C(Cl)Cl ZINC001481810363 1096723434 /nfs/dbraw/zinc/72/34/34/1096723434.db2.gz GACVEWMAFTWKHU-QWHCGFSZSA-N 1 3 336.307 2.663 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cc2ccccc2o1 ZINC001481849504 1096793355 /nfs/dbraw/zinc/79/33/55/1096793355.db2.gz DBYRTLOUPWKQAI-DOTOQJQBSA-N 1 3 343.471 2.759 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(C)c(C)c1 ZINC001481850279 1096794191 /nfs/dbraw/zinc/79/41/91/1096794191.db2.gz JTBHGDLZIWZTIH-DNVCBOLYSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(C)c(C)c1 ZINC001481850281 1096794751 /nfs/dbraw/zinc/79/47/51/1096794751.db2.gz JTBHGDLZIWZTIH-KXBFYZLASA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cc(C)ccc1C ZINC001481850674 1096795134 /nfs/dbraw/zinc/79/51/34/1096795134.db2.gz NTODSHSHNKIYRD-QFBILLFUSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1c(C)cc(C)cc1C ZINC001481881980 1096852414 /nfs/dbraw/zinc/85/24/14/1096852414.db2.gz NOHUUPTXOWYBCM-GOSISDBHSA-N 1 3 333.520 2.936 10 0 EFAEHO CCCCC[NH2+]CCN(CC)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001268479262 1096901616 /nfs/dbraw/zinc/90/16/16/1096901616.db2.gz HAWGUXPRTBKDJT-GOSISDBHSA-N 1 3 329.504 2.827 10 0 EFAEHO CCN(CC[NH2+]Cc1c(C)cccc1C)C(=O)[C@H](C(C)C)N(C)C ZINC001268493758 1096966186 /nfs/dbraw/zinc/96/61/86/1096966186.db2.gz SUVNMKZCADDEDB-IBGZPJMESA-N 1 3 333.520 2.828 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(CF)cc1)C(=O)[C@@H]1CCCCN1CC ZINC001268499668 1097006154 /nfs/dbraw/zinc/00/61/54/1097006154.db2.gz OMHXOOSXHPNNBJ-IBGZPJMESA-N 1 3 349.494 2.969 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(CF)cc1)C(=O)[C@H]1CCCCN1CC ZINC001268499669 1097006408 /nfs/dbraw/zinc/00/64/08/1097006408.db2.gz OMHXOOSXHPNNBJ-LJQANCHMSA-N 1 3 349.494 2.969 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H](CC[NH2+]Cc2ccsc2)C1)N(C)C ZINC001481983552 1097035208 /nfs/dbraw/zinc/03/52/08/1097035208.db2.gz JCAQTDAEDFGORC-RDJZCZTQSA-N 1 3 337.533 2.807 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@H](CC[NH2+]C/C=C\Cl)C2)CC1 ZINC001481989649 1097053696 /nfs/dbraw/zinc/05/36/96/1097053696.db2.gz QKLRUSTUUPUQKX-MGEKVANASA-N 1 3 341.927 2.689 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](CC[NH2+]CC2CC(C)(C)C2)C1 ZINC001481991595 1097057488 /nfs/dbraw/zinc/05/74/88/1097057488.db2.gz PMMYKNWPCRGNJW-KRWDZBQOSA-N 1 3 337.552 2.981 10 0 EFAEHO CN(CC(=O)N1CCC(CC[NH2+]C/C=C/Cl)CC1)CC(C)(C)C ZINC001482004920 1097067780 /nfs/dbraw/zinc/06/77/80/1097067780.db2.gz YDCXKARUALEPSA-WEVVVXLNSA-N 1 3 343.943 2.935 10 0 EFAEHO CC/C=C\CC[NH2+]CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001482003578 1097077194 /nfs/dbraw/zinc/07/71/94/1097077194.db2.gz GTQWGLPYNQTSSL-XDXAGZTOSA-N 1 3 335.536 2.903 10 0 EFAEHO CCC[NH2+]CCC1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001482004447 1097079104 /nfs/dbraw/zinc/07/91/04/1097079104.db2.gz RGBVFEYZNSSQPC-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](F)C[NH2+]CCC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001482006249 1097083864 /nfs/dbraw/zinc/08/38/64/1097083864.db2.gz QPLGTTQKRVZCIA-GOSISDBHSA-N 1 3 341.515 2.685 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NC/C=C/C[NH2+]CCCc1ccccc1Cl ZINC001268522103 1097123262 /nfs/dbraw/zinc/12/32/62/1097123262.db2.gz JQVDVAWNGBNFPO-SHCNBLLESA-N 1 3 349.906 2.629 10 0 EFAEHO C[C@H](NC/C=C/CNC(=O)C12CCC[NH+]1CCC2)c1ccc(F)cc1 ZINC001268562246 1097196639 /nfs/dbraw/zinc/19/66/39/1097196639.db2.gz FIILPKMISITWCC-KZSQQDEKSA-N 1 3 345.462 2.777 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[NH2+]C/C=C/c1ccccc1 ZINC001482065544 1097215337 /nfs/dbraw/zinc/21/53/37/1097215337.db2.gz JPWFKSBFOJGTSJ-BQHJZSHBSA-N 1 3 329.488 2.622 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[NH2+]C/C=C\c1ccccc1 ZINC001482065546 1097215582 /nfs/dbraw/zinc/21/55/82/1097215582.db2.gz JPWFKSBFOJGTSJ-KOTDBNOLSA-N 1 3 329.488 2.622 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H](C)CNC(=O)C(C)(C)N2CCCC2)c1 ZINC001482130806 1097299363 /nfs/dbraw/zinc/29/93/63/1097299363.db2.gz RCGSFNVOEVUBFP-MRXNPFEDSA-N 1 3 349.494 2.850 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C/C[NH2+]Cc2ccc(Cl)cc2)CC1 ZINC001268606389 1097452459 /nfs/dbraw/zinc/45/24/59/1097452459.db2.gz DLLYIPUDADHGKS-NSCUHMNNSA-N 1 3 349.906 2.834 10 0 EFAEHO C[NH+](C)Cc1cccc(C(=O)NC/C=C/CNCc2ccsc2)c1 ZINC001268628425 1097482019 /nfs/dbraw/zinc/48/20/19/1097482019.db2.gz NNIBNAQSZRRUKM-ONEGZZNKSA-N 1 3 343.496 2.886 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)c(C)s1 ZINC001268629330 1097483346 /nfs/dbraw/zinc/48/33/46/1097483346.db2.gz VMGYCDUSDHBCHL-YPDHSMTDSA-N 1 3 349.544 3.000 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)c(C)s1 ZINC001268629330 1097483350 /nfs/dbraw/zinc/48/33/50/1097483350.db2.gz VMGYCDUSDHBCHL-YPDHSMTDSA-N 1 3 349.544 3.000 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C\C[NH2+]CC1CCC(C)CC1 ZINC001268630865 1097485267 /nfs/dbraw/zinc/48/52/67/1097485267.db2.gz RGQWBCSXOZRMMJ-JVSUKQCGSA-N 1 3 335.536 2.949 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CCCc1ccccc1 ZINC001268674117 1097527879 /nfs/dbraw/zinc/52/78/79/1097527879.db2.gz PMWDKDDYUFYRQM-IEBWSBKVSA-N 1 3 331.504 2.588 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CCCc1cccc(F)c1 ZINC001268689312 1097542694 /nfs/dbraw/zinc/54/26/94/1097542694.db2.gz VLNSFZZCUPIACG-QFBILLFUSA-N 1 3 349.494 2.725 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+]CC[C@@H]1CCc2ccccc21 ZINC001268717290 1097566548 /nfs/dbraw/zinc/56/65/48/1097566548.db2.gz VMTRFJPGYDSVLH-WMZOPIPTSA-N 1 3 331.504 2.541 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCCCF)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001268747705 1097595550 /nfs/dbraw/zinc/59/55/50/1097595550.db2.gz TXNFDCNTKWZWJF-YJBOKZPZSA-N 1 3 347.494 2.775 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCCCF)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001268747705 1097595557 /nfs/dbraw/zinc/59/55/57/1097595557.db2.gz TXNFDCNTKWZWJF-YJBOKZPZSA-N 1 3 347.494 2.775 10 0 EFAEHO Cc1cc(C[NH2+]CCCN(C)C(=O)[C@@H](C(C)C)N(C)C)c(C)s1 ZINC001268838829 1097678789 /nfs/dbraw/zinc/67/87/89/1097678789.db2.gz CXQAUWGIZIEXFA-QGZVFWFLSA-N 1 3 339.549 2.889 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[NH2+]CC2CCC(C)(C)CC2)C1 ZINC001268847500 1097682797 /nfs/dbraw/zinc/68/27/97/1097682797.db2.gz KMBIZFSUZXKTFJ-KRWDZBQOSA-N 1 3 337.552 2.983 10 0 EFAEHO CCc1cccc(C[NH2+]CCCN(C)C(=O)CN2CCC(C)CC2)c1 ZINC001268894156 1097706391 /nfs/dbraw/zinc/70/63/91/1097706391.db2.gz ROKMWNRAGRWUHQ-UHFFFAOYSA-N 1 3 345.531 2.919 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+]Cc1cc2ccccc2o1 ZINC001268958209 1097745844 /nfs/dbraw/zinc/74/58/44/1097745844.db2.gz IQIIEYKXLMBNEY-UHFFFAOYSA-N 1 3 331.460 2.711 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[NH2+]Cc1ccc(OC)cc1 ZINC001268962971 1097754776 /nfs/dbraw/zinc/75/47/76/1097754776.db2.gz YJIPHFDKDXHCLW-LJQANCHMSA-N 1 3 347.503 2.508 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC=C(C)C ZINC001269471114 1098164350 /nfs/dbraw/zinc/16/43/50/1098164350.db2.gz FYFNSVATYIHVAS-MAUKXSAKSA-N 1 3 327.488 2.650 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]CCC(F)(F)F)CCCC1 ZINC001482238606 1098378836 /nfs/dbraw/zinc/37/88/36/1098378836.db2.gz USVNZYFCDBGTKL-ZIAGYGMSSA-N 1 3 349.441 2.830 10 0 EFAEHO CN(CC(=O)N1CCC(CC[NH2+]Cc2ccccc2)CC1)C1CCC1 ZINC001269870974 1098490988 /nfs/dbraw/zinc/49/09/88/1098490988.db2.gz IDFYSBAUGZXJHX-UHFFFAOYSA-N 1 3 343.515 2.889 10 0 EFAEHO CCCC[NH2+]CCC1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001269908668 1098515175 /nfs/dbraw/zinc/51/51/75/1098515175.db2.gz UCGJSUWUUGUFLZ-UHFFFAOYSA-N 1 3 325.541 2.983 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C ZINC001270022115 1098603862 /nfs/dbraw/zinc/60/38/62/1098603862.db2.gz KXEFNJIKVUIKOZ-PMACEKPBSA-N 1 3 343.515 2.602 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[NH2+]Cc2ccccc2)CC1)N(C)C ZINC001267918086 1098649928 /nfs/dbraw/zinc/64/99/28/1098649928.db2.gz ZXOKIYYMILJHEQ-LJQANCHMSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)=CC[NH2+]Cc1ccc(CNC(=O)C2(N(C)C)CCC2)cc1 ZINC001267937878 1098753762 /nfs/dbraw/zinc/75/37/62/1098753762.db2.gz AYOZTERZFUKFAJ-UHFFFAOYSA-N 1 3 329.488 2.843 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H]2CCCN2C(=O)[C@@H](C(C)C)N(C)C)cc1 ZINC001270173242 1098762535 /nfs/dbraw/zinc/76/25/35/1098762535.db2.gz AJYGAJYYAKKWGH-WOJBJXKFSA-N 1 3 345.531 2.704 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H]1C[NH2+]CCCc1ccccc1C)N(C)C ZINC001267963661 1098943166 /nfs/dbraw/zinc/94/31/66/1098943166.db2.gz UBSSPECWAKVNPY-UXHICEINSA-N 1 3 345.531 2.848 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001481290536 1099022381 /nfs/dbraw/zinc/02/23/81/1099022381.db2.gz LWZYRFZNNBMCER-MOPGFXCFSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001481290536 1099022393 /nfs/dbraw/zinc/02/23/93/1099022393.db2.gz LWZYRFZNNBMCER-MOPGFXCFSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)[C@@H]2CCC[N@H+]2C(C)C)c1 ZINC001482284452 1099030301 /nfs/dbraw/zinc/03/03/01/1099030301.db2.gz NUUYKCCIIRVIMD-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)[C@@H]2CCC[N@@H+]2C(C)C)c1 ZINC001482284452 1099030313 /nfs/dbraw/zinc/03/03/13/1099030313.db2.gz NUUYKCCIIRVIMD-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001482285188 1099039992 /nfs/dbraw/zinc/03/99/92/1099039992.db2.gz UQTHKOBTLBTASH-QAPCUYQASA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001482285188 1099040004 /nfs/dbraw/zinc/04/00/04/1099040004.db2.gz UQTHKOBTLBTASH-QAPCUYQASA-N 1 3 335.467 2.635 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)[C@H](C)CNCc1cc(C)ccc1F ZINC001482294242 1099171340 /nfs/dbraw/zinc/17/13/40/1099171340.db2.gz ZKSWNUXIVQLWFJ-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N(C)[C@H](C)CNCc1cc(C)ccc1F ZINC001482294242 1099171344 /nfs/dbraw/zinc/17/13/44/1099171344.db2.gz ZKSWNUXIVQLWFJ-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]CC1CCC2(CC2)CC1 ZINC001481319782 1099276793 /nfs/dbraw/zinc/27/67/93/1099276793.db2.gz NNPJTTFXGDYZDQ-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CN(CC(=O)N1CC[C@@](C)(C[NH2+]CC2=CCCCC2)C1)C1CCC1 ZINC001270736890 1099505766 /nfs/dbraw/zinc/50/57/66/1099505766.db2.gz DCLWCBPDTWATJY-FQEVSTJZSA-N 1 3 333.520 2.799 10 0 EFAEHO CC[C@H](C(=O)N1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC(C)C1)N(CC)CC ZINC001481385818 1099551154 /nfs/dbraw/zinc/55/11/54/1099551154.db2.gz YMUWWCWWUDMPRK-QCRHNUIXSA-N 1 3 335.536 2.828 10 0 EFAEHO CC[C@H](C(=O)N1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC(C)C1)N(CC)CC ZINC001481385818 1099551163 /nfs/dbraw/zinc/55/11/63/1099551163.db2.gz YMUWWCWWUDMPRK-QCRHNUIXSA-N 1 3 335.536 2.828 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC1(C[NH2+]C/C=C\Cl)CCCC1 ZINC001267846411 1099616356 /nfs/dbraw/zinc/61/63/56/1099616356.db2.gz FFPUXMSRIHCVKC-VXQJABLNSA-N 1 3 327.900 2.630 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@H](C)N(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001482330587 1099628776 /nfs/dbraw/zinc/62/87/76/1099628776.db2.gz KJNYQUBAFJSYCK-WRKUDEPPSA-N 1 3 341.515 2.992 10 0 EFAEHO CCCN(C(=O)[C@@H](C)N1CCCCCC1)[C@@H]1CC[N@H+](CC2CC2)C1 ZINC001481407120 1099653145 /nfs/dbraw/zinc/65/31/45/1099653145.db2.gz PGMVQJRCLWRKDR-IEBWSBKVSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN(C(=O)[C@@H](C)N1CCCCCC1)[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC001481407120 1099653153 /nfs/dbraw/zinc/65/31/53/1099653153.db2.gz PGMVQJRCLWRKDR-IEBWSBKVSA-N 1 3 335.536 2.974 10 0 EFAEHO CC[C@@H](C(=O)N(C)[C@@H](C)C[NH2+]CCc1ccc(Cl)cc1)N(C)C ZINC001482354810 1099784808 /nfs/dbraw/zinc/78/48/08/1099784808.db2.gz UHBQKOVDNIPMNR-YOEHRIQHSA-N 1 3 339.911 2.659 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](CC[NH2+]CC2CCC(C)CC2)C1 ZINC001280309154 1099890708 /nfs/dbraw/zinc/89/07/08/1099890708.db2.gz YUPFVNOCZDOQFO-CTWPCTMYSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)c1 ZINC001267892845 1099891464 /nfs/dbraw/zinc/89/14/64/1099891464.db2.gz ICOYPEFEKTXVJP-QGZVFWFLSA-N 1 3 340.471 2.679 10 0 EFAEHO CC(C)C[C@H](C[NH2+]C/C=C/Cl)NC(=O)[C@H]1CCCN1C(C)C ZINC001482384312 1099968825 /nfs/dbraw/zinc/96/88/25/1099968825.db2.gz NWXUAXSBSKRADF-CGMDNHBQSA-N 1 3 329.916 2.732 10 0 EFAEHO Cc1ccc(C[NH2+]CCC2CCN(C(=O)[C@H]3CCCN3C)CC2)cc1 ZINC001267907122 1100029673 /nfs/dbraw/zinc/02/96/73/1100029673.db2.gz QSMFRJVQZUVAJN-HXUWFJFHSA-N 1 3 343.515 2.808 10 0 EFAEHO CN(CC(=O)NCc1ccc(OCCC[NH+](C)C)cc1)CC(C)(C)C ZINC001628198384 1100073740 /nfs/dbraw/zinc/07/37/40/1100073740.db2.gz PWFWGYFFIHJHCD-UHFFFAOYSA-N 1 3 349.519 2.611 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCC(C)(C)C)[C@H](C)C1 ZINC001482431763 1100179242 /nfs/dbraw/zinc/17/92/42/1100179242.db2.gz CKPFCLCZNVAERS-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001482439858 1100233208 /nfs/dbraw/zinc/23/32/08/1100233208.db2.gz WKYSYVGNGRWYHA-PKOBYXMFSA-N 1 3 331.504 2.662 10 0 EFAEHO C[C@H](CNCC=C(Cl)Cl)N(C)C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001270994437 1100345768 /nfs/dbraw/zinc/34/57/68/1100345768.db2.gz FKJBZHPIYPISMW-CHWSQXEVSA-N 1 3 336.307 2.616 10 0 EFAEHO C[C@H](CNCC=C(Cl)Cl)N(C)C(=O)CC[C@H]1CCC[N@H+]1C ZINC001270994437 1100345779 /nfs/dbraw/zinc/34/57/79/1100345779.db2.gz FKJBZHPIYPISMW-CHWSQXEVSA-N 1 3 336.307 2.616 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001271094623 1100476958 /nfs/dbraw/zinc/47/69/58/1100476958.db2.gz YCRVBHLDIVPSDJ-LSDHHAIUSA-N 1 3 333.467 2.590 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001271094623 1100476959 /nfs/dbraw/zinc/47/69/59/1100476959.db2.gz YCRVBHLDIVPSDJ-LSDHHAIUSA-N 1 3 333.467 2.590 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001271099921 1100480562 /nfs/dbraw/zinc/48/05/62/1100480562.db2.gz HABQWQGHRJGUHN-JKSUJKDBSA-N 1 3 347.494 2.836 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001271099921 1100480571 /nfs/dbraw/zinc/48/05/71/1100480571.db2.gz HABQWQGHRJGUHN-JKSUJKDBSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)CC[NH2+][C@H](C)[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001482479008 1101183253 /nfs/dbraw/zinc/18/32/53/1101183253.db2.gz IWEVKHURPUTKHO-RTBURBONSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](C[NH2+]CC/C=C/c1ccccc1)N(C)C(=O)CN1CCCC1 ZINC001271207572 1101286732 /nfs/dbraw/zinc/28/67/32/1101286732.db2.gz NWGTXHZYPNOILH-VQANOXKBSA-N 1 3 329.488 2.622 10 0 EFAEHO CCC[NH2+]C[C@@H](CC(C)C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001271293803 1101345575 /nfs/dbraw/zinc/34/55/75/1101345575.db2.gz LTYOTWXWUPUOHE-QAPCUYQASA-N 1 3 329.504 2.729 10 0 EFAEHO CC[C@@H]1CN(C(=O)C2(N(C)C)CCC2)CC[C@@H]1[NH2+]CCCCCF ZINC001670580832 1101358858 /nfs/dbraw/zinc/35/88/58/1101358858.db2.gz BLSKTCRDZCEBHR-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H]([NH2+]CCCF)[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001482483757 1101491350 /nfs/dbraw/zinc/49/13/50/1101491350.db2.gz WNHYPZPPOBUBTP-HOTGVXAUSA-N 1 3 329.504 2.541 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)C2CCC2)CC[C@@H]1[NH2+]CCCC1CCC1 ZINC001271405110 1101508719 /nfs/dbraw/zinc/50/87/19/1101508719.db2.gz STWCYSVQNORSKK-APWZRJJASA-N 1 3 335.536 2.878 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CC[N@H+](CCC2=CCCCC2)C1 ZINC001266322367 1101547232 /nfs/dbraw/zinc/54/72/32/1101547232.db2.gz GFKGFWWVFNYMHL-ZWKOTPCHSA-N 1 3 339.499 2.747 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CC[N@@H+](CCC2=CCCCC2)C1 ZINC001266322367 1101547242 /nfs/dbraw/zinc/54/72/42/1101547242.db2.gz GFKGFWWVFNYMHL-ZWKOTPCHSA-N 1 3 339.499 2.747 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1C[C@H]([NH2+]CC/C=C\c2ccccc2)C1 ZINC001266635227 1101598747 /nfs/dbraw/zinc/59/87/47/1101598747.db2.gz XTPCPZUFFDFTTQ-XQZWBGLLSA-N 1 3 338.455 2.601 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)C(C)(C)[NH+]2CCCCC2)c1 ZINC001266702013 1101945964 /nfs/dbraw/zinc/94/59/64/1101945964.db2.gz MDMHWAYARFWCHA-UHFFFAOYSA-N 1 3 349.494 2.947 10 0 EFAEHO C[C@H]1CCCN(C(=O)c2ccc(C[NH+](C)C)cc2)[C@@H]1CNCCF ZINC001482491247 1101950822 /nfs/dbraw/zinc/95/08/22/1101950822.db2.gz ACIVQKCSRGGRGA-MAUKXSAKSA-N 1 3 335.467 2.548 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)cc1 ZINC001266725268 1102033519 /nfs/dbraw/zinc/03/35/19/1102033519.db2.gz ANOFWURTCXVORF-ZCNNSNEGSA-N 1 3 345.531 2.751 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)cc1F ZINC001266741172 1102074384 /nfs/dbraw/zinc/07/43/84/1102074384.db2.gz LYZRUOZVEHYGEI-MJGOQNOKSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)cc1F ZINC001266741172 1102074401 /nfs/dbraw/zinc/07/44/01/1102074401.db2.gz LYZRUOZVEHYGEI-MJGOQNOKSA-N 1 3 347.478 2.699 10 0 EFAEHO C[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)[C@H](C[NH2+]CCCF)C1 ZINC001656571373 1102124495 /nfs/dbraw/zinc/12/44/95/1102124495.db2.gz QBFMROWUNRPAEA-CVEARBPZSA-N 1 3 329.504 2.541 10 0 EFAEHO CCC/C=C/CC[N@H+](C)C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001266469071 1102197814 /nfs/dbraw/zinc/19/78/14/1102197814.db2.gz DOZLSLCNGZQJGA-RTRPANQVSA-N 1 3 332.492 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CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]CCC2=CCCCC2)C1 ZINC001271700371 1102265293 /nfs/dbraw/zinc/26/52/93/1102265293.db2.gz QPOMYGQGYBHWEM-MJGOQNOKSA-N 1 3 335.536 2.903 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C)[C@H]1C[NH2+]CC1CC(C)(C)C1 ZINC001482500477 1102419051 /nfs/dbraw/zinc/41/90/51/1102419051.db2.gz IMYZFAJDHYQQNQ-FUHWJXTLSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](F)C[N@H+](C)CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001482507585 1102444954 /nfs/dbraw/zinc/44/49/54/1102444954.db2.gz XTLGBEFVFCMFNO-AEFFLSMTSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001482507585 1102444957 /nfs/dbraw/zinc/44/49/57/1102444957.db2.gz XTLGBEFVFCMFNO-AEFFLSMTSA-N 1 3 341.515 2.637 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CCCC[C@H]2CNCC=C(Cl)Cl)CC1 ZINC001266878359 1102570366 /nfs/dbraw/zinc/57/03/66/1102570366.db2.gz YMABJYYJHSNQDU-ZDUSSCGKSA-N 1 3 348.318 2.618 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[NH2+]CCc1cccs1 ZINC001266881517 1102580946 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1102678121 /nfs/dbraw/zinc/67/81/21/1102678121.db2.gz MIEZCRAHJWXVJW-PXNSSMCTSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(C)CC(=O)NCCC[N@H+](C)[C@@H]1CCc2c1cccc2F ZINC001660372582 1102717572 /nfs/dbraw/zinc/71/75/72/1102717572.db2.gz QKLGNNSCSXWGQV-GOSISDBHSA-N 1 3 335.467 2.593 10 0 EFAEHO CCCN(C)CC(=O)NCCC[N@@H+](C)[C@@H]1CCc2c1cccc2F ZINC001660372582 1102717585 /nfs/dbraw/zinc/71/75/85/1102717585.db2.gz QKLGNNSCSXWGQV-GOSISDBHSA-N 1 3 335.467 2.593 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N1CC[C@H](NCc2ccsc2)C1 ZINC001266569603 1102795989 /nfs/dbraw/zinc/79/59/89/1102795989.db2.gz DIVANMXXPTVDLW-KRWDZBQOSA-N 1 3 335.517 2.705 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C[NH2+]CCC1=CCCCC1)C1CC1 ZINC001670543602 1102828441 /nfs/dbraw/zinc/82/84/41/1102828441.db2.gz CWSQYIIUQKNAEO-GOSISDBHSA-N 1 3 330.476 2.636 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1ccccc1)C(C)C ZINC001482533384 1102876902 /nfs/dbraw/zinc/87/69/02/1102876902.db2.gz PRUCDQXHPJWYDJ-RBUKOAKNSA-N 1 3 331.504 2.791 10 0 EFAEHO 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2.929 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(Cl)c1)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001483338884 1103424030 /nfs/dbraw/zinc/42/40/30/1103424030.db2.gz AIOJVTBTKRJSKH-CKEIUWERSA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(Cl)c1)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001483338884 1103424038 /nfs/dbraw/zinc/42/40/38/1103424038.db2.gz AIOJVTBTKRJSKH-CKEIUWERSA-N 1 3 337.895 2.617 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(OC)cc1 ZINC001483345434 1103428533 /nfs/dbraw/zinc/42/85/33/1103428533.db2.gz MFBOTGYUNNHWNG-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(OC)cc1 ZINC001483345434 1103428537 /nfs/dbraw/zinc/42/85/37/1103428537.db2.gz MFBOTGYUNNHWNG-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)Cc2cc(F)ccc2C)CC[N@@H+]1C ZINC001483339672 1103429493 /nfs/dbraw/zinc/42/94/93/1103429493.db2.gz JMKKAOYMPPDSOR-AYOQOUSVSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)Cc2cc(F)ccc2C)CC[N@H+]1C ZINC001483339672 1103429499 /nfs/dbraw/zinc/42/94/99/1103429499.db2.gz JMKKAOYMPPDSOR-AYOQOUSVSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@@H](C[N@H+](C)C[C@@H]1CCCC(F)(F)C1)NC(=O)CN(C)C1CCC1 ZINC001483347724 1103449496 /nfs/dbraw/zinc/44/94/96/1103449496.db2.gz NAWUBDBIYUIFTB-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)NC(=O)CN(C)C1CCC1 ZINC001483347724 1103449501 /nfs/dbraw/zinc/44/95/01/1103449501.db2.gz NAWUBDBIYUIFTB-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1cccc(CN(C)C[C@@H](C)NC(=O)C23CCC[NH+](CCC2)C3)c1 ZINC001483352905 1103463590 /nfs/dbraw/zinc/46/35/90/1103463590.db2.gz OYMBPFQQPFPSTR-GOSISDBHSA-N 1 3 343.515 2.808 10 0 EFAEHO CCCC[NH2+]C[C@H]1CCCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001661945725 1103514649 /nfs/dbraw/zinc/51/46/49/1103514649.db2.gz ATVAAKWYIKJSFK-APWZRJJASA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)CCc1ccccc1Cl ZINC001483420767 1103671168 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EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](C[NH2+]CCCCc2ccccc2)C1 ZINC001662607573 1103728177 /nfs/dbraw/zinc/72/81/77/1103728177.db2.gz GSTGUJHBGPYKJC-WOJBJXKFSA-N 1 3 343.515 2.542 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[NH2+]CCCc2cccc(F)c2)C1)N(C)C ZINC001662712614 1103767544 /nfs/dbraw/zinc/76/75/44/1103767544.db2.gz SFWKZUALRXXTQK-PKOBYXMFSA-N 1 3 349.494 2.537 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]CCCN(C)C(=O)CN(C)C2CCC2)c1 ZINC001483469944 1103769786 /nfs/dbraw/zinc/76/97/86/1103769786.db2.gz DWCGLSPKDLKPDK-KRWDZBQOSA-N 1 3 331.504 2.978 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(Cl)cc1)C(=O)CN(C)C1CCC1 ZINC001483469923 1103770974 /nfs/dbraw/zinc/77/09/74/1103770974.db2.gz DCNZEZRKLVMVSO-UHFFFAOYSA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+][C@H](C)c1ccccc1F)N(C)C ZINC001483471693 1103775292 /nfs/dbraw/zinc/77/52/92/1103775292.db2.gz SDPARHBPGGRJBI-QAPCUYQASA-N 1 3 337.483 2.911 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1Cc1cnccc1C)N(C)C ZINC001663072079 1103961479 /nfs/dbraw/zinc/96/14/79/1103961479.db2.gz MEFOSFTYYMFCJK-RTBURBONSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@@H]1CCC[N@H+]1Cc1cnccc1C)N(C)C ZINC001663072079 1103961486 /nfs/dbraw/zinc/96/14/86/1103961486.db2.gz MEFOSFTYYMFCJK-RTBURBONSA-N 1 3 346.519 2.591 10 0 EFAEHO CN(CC[NH2+]Cc1cc2ccccc2s1)C(=O)[C@H]1CCCN1C ZINC001663856393 1104227626 /nfs/dbraw/zinc/22/76/26/1104227626.db2.gz UPTZHQBYNHXJOM-MRXNPFEDSA-N 1 3 331.485 2.544 10 0 EFAEHO CN(CC[NH2+]Cc1cc(Cl)cc(Cl)c1)C(=O)[C@@H]1CCCN1C ZINC001663855842 1104227741 /nfs/dbraw/zinc/22/77/41/1104227741.db2.gz JJEGLNMLAZKQMB-HNNXBMFYSA-N 1 3 344.286 2.636 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[NH2+]Cc2cccc3ccccc32)C1 ZINC001664186176 1104309324 /nfs/dbraw/zinc/30/93/24/1104309324.db2.gz MCQKMILIZSUGBJ-QGZVFWFLSA-N 1 3 339.483 2.730 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]CCCc1cccc(F)c1 ZINC001664395065 1104376769 /nfs/dbraw/zinc/37/67/69/1104376769.db2.gz KLDSNPOSPRAOIU-LJQANCHMSA-N 1 3 349.494 2.681 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]C/C=C\c1ccccc1 ZINC001664395486 1104376956 /nfs/dbraw/zinc/37/69/56/1104376956.db2.gz RYVBBYJPXPVDPX-ADYPVZHUSA-N 1 3 329.488 2.622 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+]Cc1ccccc1C(F)(F)F ZINC001664396050 1104377712 /nfs/dbraw/zinc/37/77/12/1104377712.db2.gz ZWJYLBSCCGFQHI-UHFFFAOYSA-N 1 3 345.409 2.594 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)[C@@H](C)CNC(=O)C2(N(C)C)CCC2)c1 ZINC001409599894 1104453313 /nfs/dbraw/zinc/45/33/13/1104453313.db2.gz YZHMISPTOUZWBU-JKSUJKDBSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)[C@@H](C)CNC(=O)C2(N(C)C)CCC2)c1 ZINC001409599894 1104453317 /nfs/dbraw/zinc/45/33/17/1104453317.db2.gz YZHMISPTOUZWBU-JKSUJKDBSA-N 1 3 347.503 2.677 10 0 EFAEHO Cc1ccccc1CCC[N@@H+](C)[C@@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001409614552 1104511544 /nfs/dbraw/zinc/51/15/44/1104511544.db2.gz GREJAAKFARVLGC-HKUYNNGSSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccccc1CCC[N@H+](C)[C@@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001409614552 1104511553 /nfs/dbraw/zinc/51/15/53/1104511553.db2.gz GREJAAKFARVLGC-HKUYNNGSSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@H](CNC(=O)CC[NH+](C)C)N(C)C/C=C\c1ccc(Cl)cc1 ZINC001409618332 1104530482 /nfs/dbraw/zinc/53/04/82/1104530482.db2.gz CMDCYEWLAZWARF-IYKSTZQJSA-N 1 3 337.895 2.741 10 0 EFAEHO COc1cccc([C@@H](C)N(C)[C@H](C)CNC(=O)C2(C[NH+](C)C)CC2)c1 ZINC001409630682 1104543261 /nfs/dbraw/zinc/54/32/61/1104543261.db2.gz PYMDJQGJMPMANF-HZPDHXFCSA-N 1 3 347.503 2.535 10 0 EFAEHO Cc1cc(CN(C)[C@H](C)CNC(=O)C[C@H]2CC[N@H+](C)C2)c(C)s1 ZINC001409651424 1104601196 /nfs/dbraw/zinc/60/11/96/1104601196.db2.gz SJXBAQINCUOSFT-CZUORRHYSA-N 1 3 337.533 2.643 10 0 EFAEHO Cc1cc(CN(C)[C@H](C)CNC(=O)C[C@H]2CC[N@@H+](C)C2)c(C)s1 ZINC001409651424 1104601199 /nfs/dbraw/zinc/60/11/99/1104601199.db2.gz SJXBAQINCUOSFT-CZUORRHYSA-N 1 3 337.533 2.643 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC001482621884 1104671751 /nfs/dbraw/zinc/67/17/51/1104671751.db2.gz AAJJDTJLXNRRGK-HKUYNNGSSA-N 1 3 331.504 2.616 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC001482621884 1104671757 /nfs/dbraw/zinc/67/17/57/1104671757.db2.gz AAJJDTJLXNRRGK-HKUYNNGSSA-N 1 3 331.504 2.616 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001482652468 1104744187 /nfs/dbraw/zinc/74/41/87/1104744187.db2.gz XYELRLBBIATINB-WOJBJXKFSA-N 1 3 343.515 2.939 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001482652468 1104744194 /nfs/dbraw/zinc/74/41/94/1104744194.db2.gz XYELRLBBIATINB-WOJBJXKFSA-N 1 3 343.515 2.939 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](N(C)C(=O)CCCC[NH+](C)C)C2)cc1 ZINC001665682211 1104750733 /nfs/dbraw/zinc/75/07/33/1104750733.db2.gz WQQOQODFROJBIG-LJQANCHMSA-N 1 3 331.504 2.760 10 0 EFAEHO Cc1ccc(CN2CC[C@H](N(C)C(=O)CCCC[NH+](C)C)C2)cc1 ZINC001665682210 1104750905 /nfs/dbraw/zinc/75/09/05/1104750905.db2.gz WQQOQODFROJBIG-IBGZPJMESA-N 1 3 331.504 2.760 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2CC2CC3(CCC3)C2)C1 ZINC001482663747 1104765913 /nfs/dbraw/zinc/76/59/13/1104765913.db2.gz BVPQNILMTHQKKG-MOPGFXCFSA-N 1 3 347.547 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2CC2CC3(CCC3)C2)C1 ZINC001482663747 1104765918 /nfs/dbraw/zinc/76/59/18/1104765918.db2.gz BVPQNILMTHQKKG-MOPGFXCFSA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@H](C(=O)N[C@@](C)(C[NH2+]CCC1CC1)C1CC1)N1CCCCCC1 ZINC001666027160 1104833630 /nfs/dbraw/zinc/83/36/30/1104833630.db2.gz WOBXVJPVMHPMGS-UZLBHIALSA-N 1 3 335.536 2.926 10 0 EFAEHO CC1CC(C[NH2+]CC[C@@H]2CCCN(C(=O)CN3CCC(C)CC3)C2)C1 ZINC001666158027 1104887224 /nfs/dbraw/zinc/88/72/24/1104887224.db2.gz VLPCJHWHGBJZHN-GPJFCIFZSA-N 1 3 349.563 2.983 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](CC[NH2+]Cc2ccc(F)cc2)C1 ZINC001666168025 1104891052 /nfs/dbraw/zinc/89/10/52/1104891052.db2.gz RWHCEJOAKBXFLT-GOSISDBHSA-N 1 3 349.494 2.886 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(CC[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001666258704 1104913166 /nfs/dbraw/zinc/91/31/66/1104913166.db2.gz FFUQIRNKLPNCPD-AQNXPRMDSA-N 1 3 349.563 2.983 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H]1CCC[C@@H]1NC(=O)CN(C)C(C)C ZINC001482698411 1104954706 /nfs/dbraw/zinc/95/47/06/1104954706.db2.gz KWCULQCFJPTJKR-OALUTQOASA-N 1 3 331.504 2.710 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]CCc1ccccc1F ZINC001666600292 1104968167 /nfs/dbraw/zinc/96/81/67/1104968167.db2.gz RARMIQZJAJKKOS-MRXNPFEDSA-N 1 3 349.494 2.585 10 0 EFAEHO C[C@@H](CNCC=C(Cl)Cl)N(C)C(=O)C[N@H+](C)CC(C)(C)C ZINC001666992258 1105033562 /nfs/dbraw/zinc/03/35/62/1105033562.db2.gz MPWRUSKIEOXCNO-LBPRGKRZSA-N 1 3 338.323 2.720 10 0 EFAEHO C[C@@H](CNCC=C(Cl)Cl)N(C)C(=O)C[N@@H+](C)CC(C)(C)C ZINC001666992258 1105033567 /nfs/dbraw/zinc/03/35/67/1105033567.db2.gz MPWRUSKIEOXCNO-LBPRGKRZSA-N 1 3 338.323 2.720 10 0 EFAEHO C[NH+](C)Cc1ccc(C(=O)N[C@@H](CNCCF)C2CCCCC2)cc1 ZINC001667144117 1105061454 /nfs/dbraw/zinc/06/14/54/1105061454.db2.gz JMRGSPJDYGUYFN-IBGZPJMESA-N 1 3 349.494 2.986 10 0 EFAEHO C[NH+](C)Cc1ccc(C(=O)N[C@H](CNCCF)C2CCCCC2)cc1 ZINC001667144118 1105061616 /nfs/dbraw/zinc/06/16/16/1105061616.db2.gz JMRGSPJDYGUYFN-LJQANCHMSA-N 1 3 349.494 2.986 10 0 EFAEHO CCCCC[NH2+][C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1C ZINC001667196851 1105076254 /nfs/dbraw/zinc/07/62/54/1105076254.db2.gz DSLHLUKFYOJGSY-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001482839170 1105079242 /nfs/dbraw/zinc/07/92/42/1105079242.db2.gz IJCKCGAZVCLBTB-QGZVFWFLSA-N 1 3 331.504 2.772 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@H]([NH2+]CCCCCF)[C@@H](C)C2)CC1 ZINC001667204729 1105079634 /nfs/dbraw/zinc/07/96/34/1105079634.db2.gz SDLGQCWTUIPMBN-ZWKOTPCHSA-N 1 3 341.515 2.685 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@H]([NH2+]CCCCCF)[C@H](C)C2)CC1 ZINC001667204726 1105079890 /nfs/dbraw/zinc/07/98/90/1105079890.db2.gz SDLGQCWTUIPMBN-QZTJIDSGSA-N 1 3 341.515 2.685 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@H]1CC[NH2+]Cc1ccccc1F ZINC001667239170 1105092682 /nfs/dbraw/zinc/09/26/82/1105092682.db2.gz UEGZFSALSNDLQW-HKUYNNGSSA-N 1 3 347.478 2.781 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@@H]1CC[NH2+]Cc1cncc(C)c1)N(C)C ZINC001667284324 1105107250 /nfs/dbraw/zinc/10/72/50/1105107250.db2.gz JJRBOWJCGBBWIO-MOPGFXCFSA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@H](CCNCc1nccs1)NC(=O)c1ccc(C[NH+](C)C)cc1 ZINC001482880347 1105137674 /nfs/dbraw/zinc/13/76/74/1105137674.db2.gz NBMZBLPAFMCXEW-CQSZACIVSA-N 1 3 346.500 2.503 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C)[C@@H]1C[NH2+]CCC(C)(C)C ZINC001667400684 1105140581 /nfs/dbraw/zinc/14/05/81/1105140581.db2.gz MLGSXZIYVATACC-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001482891383 1105149805 /nfs/dbraw/zinc/14/98/05/1105149805.db2.gz NFDPBIPCFRPGFY-CJNGLKHVSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[C@@H](F)CNCCN(CC)C(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001482945587 1105231853 /nfs/dbraw/zinc/23/18/53/1105231853.db2.gz OWNYNURGYRPTNB-SJLPKXTDSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@@H](F)CNCCN(CC)C(=O)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001482945587 1105231859 /nfs/dbraw/zinc/23/18/59/1105231859.db2.gz OWNYNURGYRPTNB-SJLPKXTDSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@@H](F)CNCCN(CC)C(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001482945585 1105232311 /nfs/dbraw/zinc/23/23/11/1105232311.db2.gz OWNYNURGYRPTNB-AEFFLSMTSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@@H](F)CNCCN(CC)C(=O)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001482945585 1105232315 /nfs/dbraw/zinc/23/23/15/1105232315.db2.gz OWNYNURGYRPTNB-AEFFLSMTSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccc2cc[nH]c2c1)NC(=O)C1(N(C)C)CCC1 ZINC001668086436 1105233130 /nfs/dbraw/zinc/23/31/30/1105233130.db2.gz BHRLFIDCCARKFQ-OAHLLOKOSA-N 1 3 342.487 2.637 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001668087850 1105233843 /nfs/dbraw/zinc/23/38/43/1105233843.db2.gz SDKDWIQDKJWJKF-MRXNPFEDSA-N 1 3 331.504 2.718 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(CF)cc1)C(=O)CN1CCC(C)CC1 ZINC001482958258 1105242145 /nfs/dbraw/zinc/24/21/45/1105242145.db2.gz VCINQBURRPGUGO-UHFFFAOYSA-N 1 3 349.494 2.826 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(F)cc1)C(=O)CN(C)CC(C)(C)C ZINC001482950425 1105247019 /nfs/dbraw/zinc/24/70/19/1105247019.db2.gz QSXRQJMVMLHSMP-UHFFFAOYSA-N 1 3 337.483 2.742 10 0 EFAEHO CCc1ccc(C[NH2+]CC[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001668215155 1105258734 /nfs/dbraw/zinc/25/87/34/1105258734.db2.gz XFDUGVJEFWILPS-SJORKVTESA-N 1 3 331.504 2.575 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]Cc1ccccc1 ZINC001668234630 1105262882 /nfs/dbraw/zinc/26/28/82/1105262882.db2.gz NKAKXMAYADKNKQ-IEBWSBKVSA-N 1 3 331.504 2.934 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CC[NH2+]Cc1c(C)cccc1C ZINC001668289544 1105274999 /nfs/dbraw/zinc/27/49/99/1105274999.db2.gz VVSVXFKQNSTBLK-HNNXBMFYSA-N 1 3 328.460 2.562 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CC[NH2+]Cc1c(C)cccc1C ZINC001668289545 1105275714 /nfs/dbraw/zinc/27/57/14/1105275714.db2.gz VVSVXFKQNSTBLK-OAHLLOKOSA-N 1 3 328.460 2.562 10 0 EFAEHO CCc1ccccc1C[NH2+]CCN(CC)C(=O)C1(N(C)C)CCC1 ZINC001668453536 1105300471 /nfs/dbraw/zinc/30/04/71/1105300471.db2.gz USFOXOJCFDMIJG-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO CCN(CC[NH2+]CC[C@@H]1CCCC1(F)F)C(=O)CN1CC[C@@H](C)C1 ZINC001668555091 1105319686 /nfs/dbraw/zinc/31/96/86/1105319686.db2.gz IGJREYLBCHSGKW-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001668582040 1105325580 /nfs/dbraw/zinc/32/55/80/1105325580.db2.gz WFWBCNKVDNXXGE-DLBZAZTESA-N 1 3 335.517 2.703 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@H]1CCC[C@H]2CCC[N@H+]21 ZINC001668582040 1105325589 /nfs/dbraw/zinc/32/55/89/1105325589.db2.gz WFWBCNKVDNXXGE-DLBZAZTESA-N 1 3 335.517 2.703 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C/C=C\CNC(=O)[C@@H]2CCCN2C)cc1 ZINC001668745364 1105361101 /nfs/dbraw/zinc/36/11/01/1105361101.db2.gz FDYVFXPPPYMZFM-HMECNJMJSA-N 1 3 329.488 2.666 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C\CNCc2cc(C)sc2C)CC[N@@H+]1C ZINC001668832871 1105381064 /nfs/dbraw/zinc/38/10/64/1105381064.db2.gz CPIBJYULLGIPET-PLQXZHKYSA-N 1 3 349.544 2.857 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C\CNCc2cc(C)sc2C)CC[N@H+]1C ZINC001668832871 1105381071 /nfs/dbraw/zinc/38/10/71/1105381071.db2.gz CPIBJYULLGIPET-PLQXZHKYSA-N 1 3 349.544 2.857 10 0 EFAEHO CN(C)C1(C(=O)NC/C=C/C[NH2+][C@@H]2CCc3ccc(F)cc32)CCC1 ZINC001668864550 1105388162 /nfs/dbraw/zinc/38/81/62/1105388162.db2.gz HSMAAAZUFCHWHE-OAJJDEHYSA-N 1 3 345.462 2.559 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/CNCc1cc2ccccc2o1)[NH+](C)C ZINC001668873912 1105390499 /nfs/dbraw/zinc/39/04/99/1105390499.db2.gz XUDLNABBGROXDW-UCFODXPJSA-N 1 3 343.471 2.781 10 0 EFAEHO O=C(NC/C=C/CNCc1ccc(Cl)cc1)C12CCC[NH+]1CCC2 ZINC001668911522 1105397143 /nfs/dbraw/zinc/39/71/43/1105397143.db2.gz IGANTEMCFPDITB-OWOJBTEDSA-N 1 3 347.890 2.730 10 0 EFAEHO C[NH+](C)CCC(=O)NC/C=C/CN[C@H]1CCc2ccc(Cl)cc21 ZINC001669020805 1105418519 /nfs/dbraw/zinc/41/85/19/1105418519.db2.gz JVVWZBPDSAHABD-IDOMTICXSA-N 1 3 335.879 2.541 10 0 EFAEHO CC[C@H](C)C[NH2+]C/C=C/CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001669040541 1105422505 /nfs/dbraw/zinc/42/25/05/1105422505.db2.gz XLMNGOSXYZESPP-KJTGTQQJSA-N 1 3 327.488 2.507 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C/C=C\CNC(=O)CN1CC[C@@H](C)C1 ZINC001669040506 1105422650 /nfs/dbraw/zinc/42/26/50/1105422650.db2.gz XBAWHTIOODVNMB-ANBQXBGZSA-N 1 3 329.488 2.660 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C\C[NH2+]C/C=C\c2ccccc2)CC1 ZINC001669106807 1105435816 /nfs/dbraw/zinc/43/58/16/1105435816.db2.gz JCDHTTFNFHUBCM-ICZHLNMZSA-N 1 3 341.499 2.694 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NC/C=C/CNCc1cccc(Cl)c1 ZINC001669201193 1105455813 /nfs/dbraw/zinc/45/58/13/1105455813.db2.gz NNMFXCGAPMOSLT-OBMMGQTPSA-N 1 3 349.906 2.975 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001669289437 1105468618 /nfs/dbraw/zinc/46/86/18/1105468618.db2.gz XOKQQSCEZJWEGB-MJGOQNOKSA-N 1 3 331.504 2.505 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C[NH2+]CC[C@@H]1CCc2ccccc21)N(C)C ZINC001669320887 1105471535 /nfs/dbraw/zinc/47/15/35/1105471535.db2.gz TVLOCOQEMBJHLX-KPFFTGBYSA-N 1 3 345.531 2.787 10 0 EFAEHO C[C@H](C[NH2+]CC/C=C\c1ccccc1)NC(=O)CN1CC[C@H](C)C1 ZINC001669399744 1105480068 /nfs/dbraw/zinc/48/00/68/1105480068.db2.gz MBEJDRCWEOZPJB-MGEGMALFSA-N 1 3 329.488 2.526 10 0 EFAEHO C[C@@H](CNCC=C(Cl)Cl)NC(=O)C(C)(C)[NH+]1CCCCC1 ZINC001669559554 1105495734 /nfs/dbraw/zinc/49/57/34/1105495734.db2.gz UEOPGXJZYUQVJM-LBPRGKRZSA-N 1 3 336.307 2.664 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C[NH2+]CCc1ccc2ccccc2c1)N(C)C ZINC001669665711 1105507160 /nfs/dbraw/zinc/50/71/60/1105507160.db2.gz XNPUVZPMGOLTLQ-JXFKEZNVSA-N 1 3 341.499 2.817 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]C/C=C/c1ccccc1 ZINC001669750112 1105515253 /nfs/dbraw/zinc/51/52/53/1105515253.db2.gz DYIZRRYGBLYCFW-HRPDOCRFSA-N 1 3 329.488 2.669 10 0 EFAEHO CN(CC(=O)NC/C=C/C[NH2+][C@H]1CCCc2ccccc21)C1CCC1 ZINC001483018866 1105562164 /nfs/dbraw/zinc/56/21/64/1105562164.db2.gz SAKAMZIUORJUBS-SGSXCFNPSA-N 1 3 341.499 2.810 10 0 EFAEHO O=C(CN1CCCC1)N1CCC[C@@H]1C[NH2+]CC/C=C\c1ccccc1 ZINC001671384366 1105632267 /nfs/dbraw/zinc/63/22/67/1105632267.db2.gz MAJPBXWLMBSRKR-SMEINOAPSA-N 1 3 341.499 2.766 10 0 EFAEHO CCCCC[N@@H+]1CC[C@](C)(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001671675063 1105682311 /nfs/dbraw/zinc/68/23/11/1105682311.db2.gz SITCZSFLDDBRKL-OALUTQOASA-N 1 3 341.515 2.970 10 0 EFAEHO CCCCC[N@H+]1CC[C@](C)(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001671675063 1105682312 /nfs/dbraw/zinc/68/23/12/1105682312.db2.gz SITCZSFLDDBRKL-OALUTQOASA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@](C)(C[NH2+]CCCC3CCC3)C2)C1 ZINC001671785928 1105702519 /nfs/dbraw/zinc/70/25/19/1105702519.db2.gz ZYVYCNSNQILBLY-YLJYHZDGSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N(CC[NH2+]CC1CC1)Cc1ccccc1 ZINC001672400484 1105823282 /nfs/dbraw/zinc/82/32/82/1105823282.db2.gz FOMQHLQFFSRJQI-HDICACEKSA-N 1 3 343.515 2.888 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](CC[NH2+]CCCCC(F)(F)F)C1 ZINC001672762310 1105897634 /nfs/dbraw/zinc/89/76/34/1105897634.db2.gz VXEPYNHYVGHEGT-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](CC[NH2+]Cc2ccc(C)cc2)C1)N(C)C ZINC001672896346 1105931002 /nfs/dbraw/zinc/93/10/02/1105931002.db2.gz FSZFAGNYCAZXRV-RBUKOAKNSA-N 1 3 331.504 2.663 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+]Cc2cc(F)ccc2C)C1 ZINC001672901472 1105933119 /nfs/dbraw/zinc/93/31/19/1105933119.db2.gz IADOPXRRSFCIGM-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](CC[NH2+]Cc2ccc(CF)cc2)C1 ZINC001672909467 1105935415 /nfs/dbraw/zinc/93/54/15/1105935415.db2.gz GUFBVNCTRQFUMT-LJQANCHMSA-N 1 3 347.478 2.580 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1CC[C@H](C[NH2+]C/C=C/Cl)CC1 ZINC001672961098 1105949788 /nfs/dbraw/zinc/94/97/88/1105949788.db2.gz UPTCJVVCIDAGSP-CFPHFIGFSA-N 1 3 341.927 2.876 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1CC[C@H](C[NH2+]C/C=C/Cl)CC1 ZINC001672994953 1105956245 /nfs/dbraw/zinc/95/62/45/1105956245.db2.gz NWBJJVVMOAUAEH-LOKAJOTHSA-N 1 3 341.927 2.876 10 0 EFAEHO CC[C@H](F)CN1CC[C@@]2(C1)CCCN(C(=O)CCCC[NH+](C)C)C2 ZINC001673651760 1106068597 /nfs/dbraw/zinc/06/85/97/1106068597.db2.gz ZUTVJRTUOVHPMU-PKOBYXMFSA-N 1 3 341.515 2.781 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1CC1=CCCCC1 ZINC001674132631 1106142720 /nfs/dbraw/zinc/14/27/20/1106142720.db2.gz ANVPMZYQWXVGRQ-SJLPKXTDSA-N 1 3 333.520 2.940 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@H+]1CC1=CCCCC1 ZINC001674132631 1106142725 /nfs/dbraw/zinc/14/27/25/1106142725.db2.gz ANVPMZYQWXVGRQ-SJLPKXTDSA-N 1 3 333.520 2.940 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC1CC(C[NH2+]CCc2ccccc2)C1 ZINC001674612094 1106221912 /nfs/dbraw/zinc/22/19/12/1106221912.db2.gz OLXJQBFQXAOKSC-SOAGJPPSSA-N 1 3 343.515 2.588 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H](C)[NH2+]CCCc1cccc(F)c1 ZINC001674759614 1106252438 /nfs/dbraw/zinc/25/24/38/1106252438.db2.gz FPMVONSPOFCTNO-KGLIPLIRSA-N 1 3 346.450 2.515 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC(C)(C)C[NH2+]CCc2ccccc2)C1 ZINC001674856362 1106266365 /nfs/dbraw/zinc/26/63/65/1106266365.db2.gz CJZCKZDKGHYQAI-GOSISDBHSA-N 1 3 345.531 2.645 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CCCC2(CN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001675665620 1106407146 /nfs/dbraw/zinc/40/71/46/1106407146.db2.gz KPXHVZBJAMAWBW-GFOMBABLSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[N@H+]1CCCC2(CN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001675665620 1106407150 /nfs/dbraw/zinc/40/71/50/1106407150.db2.gz KPXHVZBJAMAWBW-GFOMBABLSA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1ccccc1C[NH2+]CCC[C@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001675973219 1106457852 /nfs/dbraw/zinc/45/78/52/1106457852.db2.gz HVTMHGYPSAFXEI-AEFFLSMTSA-N 1 3 331.504 2.711 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC/C=C\CNCc2csc(C)c2)C1 ZINC001483048960 1106479450 /nfs/dbraw/zinc/47/94/50/1106479450.db2.gz BFRSBMGUMTYHGW-XDXAGZTOSA-N 1 3 349.544 2.941 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC/C=C\CNCc2csc(C)c2)C1 ZINC001483048960 1106479453 /nfs/dbraw/zinc/47/94/53/1106479453.db2.gz BFRSBMGUMTYHGW-XDXAGZTOSA-N 1 3 349.544 2.941 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)[C@H](C[NH2+]CCC2CCCC2)C2CC2)C1 ZINC001676249295 1106505712 /nfs/dbraw/zinc/50/57/12/1106505712.db2.gz KFNZBIJAFNBCCC-QFBILLFUSA-N 1 3 335.536 2.735 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2ccsc2)[C@@H]1C ZINC001676686973 1106558907 /nfs/dbraw/zinc/55/89/07/1106558907.db2.gz VNJWRVHISZDQGA-DOTOQJQBSA-N 1 3 337.533 2.602 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CC[C@H](C[NH2+]CCC2CCCC2)C1 ZINC001676970231 1106639560 /nfs/dbraw/zinc/63/95/60/1106639560.db2.gz MYMRWGUWWZTPQM-DLBZAZTESA-N 1 3 332.492 2.715 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C1CC[NH+](CC2=CCCCC2)CC1 ZINC001677367648 1106706125 /nfs/dbraw/zinc/70/61/25/1106706125.db2.gz JMGXWOORZPZCFC-HNNXBMFYSA-N 1 3 344.503 2.978 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C1CC(N(C)C(=O)[C@@H]2CCCN2C)C1 ZINC001677385379 1106710801 /nfs/dbraw/zinc/71/08/01/1106710801.db2.gz AGQBVTVIFGKDRC-MHJFOBGBSA-N 1 3 343.515 2.601 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C1CC([NH2+]CCCCCF)C1 ZINC001677448789 1106719510 /nfs/dbraw/zinc/71/95/10/1106719510.db2.gz WWJKDUVSJMROIE-JCYILVPMSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@H+](Cc2cc(C)cc(C)c2)CC1)N(C)C ZINC001677603704 1106773247 /nfs/dbraw/zinc/77/32/47/1106773247.db2.gz ZQWXCKYFJPECAV-FQEVSTJZSA-N 1 3 343.515 2.892 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@@H+](Cc2cc(C)cc(C)c2)CC1)N(C)C ZINC001677603704 1106773260 /nfs/dbraw/zinc/77/32/60/1106773260.db2.gz ZQWXCKYFJPECAV-FQEVSTJZSA-N 1 3 343.515 2.892 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1=CCN(Cc2cc(C)sc2C)CC1 ZINC001677621803 1106786101 /nfs/dbraw/zinc/78/61/01/1106786101.db2.gz XNSNDGXFPXZHGE-UHFFFAOYSA-N 1 3 349.544 2.955 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1=CCN(Cc2cc(C)sc2C)CC1 ZINC001677621803 1106786115 /nfs/dbraw/zinc/78/61/15/1106786115.db2.gz XNSNDGXFPXZHGE-UHFFFAOYSA-N 1 3 349.544 2.955 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+](CCc2ccc(C)cc2)CC1)N(C)C ZINC001677624015 1106787891 /nfs/dbraw/zinc/78/78/91/1106787891.db2.gz KCNUEZDSZLDZSX-HXUWFJFHSA-N 1 3 343.515 2.626 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+](CCc2ccc(C)cc2)CC1)N(C)C ZINC001677624015 1106787904 /nfs/dbraw/zinc/78/79/04/1106787904.db2.gz KCNUEZDSZLDZSX-HXUWFJFHSA-N 1 3 343.515 2.626 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1=CC[N@H+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001677624803 1106788675 /nfs/dbraw/zinc/78/86/75/1106788675.db2.gz VEXBIHCTDZQVJQ-GOSISDBHSA-N 1 3 335.536 2.757 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1=CC[N@@H+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001677624803 1106788689 /nfs/dbraw/zinc/78/86/89/1106788689.db2.gz VEXBIHCTDZQVJQ-GOSISDBHSA-N 1 3 335.536 2.757 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\C[NH2+][C@H](C)c1ccc(F)cc1)N(C)C ZINC001483055699 1107692927 /nfs/dbraw/zinc/69/29/27/1107692927.db2.gz BJHBPADZPFLHDD-QNRLHKFMSA-N 1 3 335.467 2.735 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C/C=C/CNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001483055864 1107696358 /nfs/dbraw/zinc/69/63/58/1107696358.db2.gz COBYQQFMFJEEAL-IHHMQQGQSA-N 1 3 331.504 2.652 10 0 EFAEHO C[C@@H]([NH2+]C/C=C/CNC(=O)CN(C)CC(C)(C)C)c1ccccc1 ZINC001483060715 1107892628 /nfs/dbraw/zinc/89/26/28/1107892628.db2.gz OVKGANIULLZMIJ-OAGJVSPASA-N 1 3 331.504 2.988 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)c(C)c1 ZINC001409364361 1107908892 /nfs/dbraw/zinc/90/88/92/1107908892.db2.gz LCFSTGKYQRCEQS-DLBZAZTESA-N 1 3 331.504 2.771 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1c(C)cc(C)cc1C ZINC001409434025 1108352327 /nfs/dbraw/zinc/35/23/27/1108352327.db2.gz NVSPTMNVIJYGIB-MSOLQXFVSA-N 1 3 333.520 2.936 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H]2CCN(C(=O)C3(N(C)C)CCC3)C2)cs1 ZINC001272458462 1108389422 /nfs/dbraw/zinc/38/94/22/1108389422.db2.gz ZAQNGLYTBNVTAH-INIZCTEOSA-N 1 3 349.544 2.869 10 0 EFAEHO C[C@H]([NH2+]C/C=C\CNC(=O)CN1CCC(C)CC1)c1ccccc1 ZINC001483078558 1108419787 /nfs/dbraw/zinc/41/97/87/1108419787.db2.gz RBQNUKLIULWYDM-MJRGOJFPSA-N 1 3 329.488 2.742 10 0 EFAEHO O=C(CN1CCCC1)NC/C=C/C[NH2+]C/C=C/c1ccc(Cl)cc1 ZINC001483093501 1108575722 /nfs/dbraw/zinc/57/57/22/1108575722.db2.gz RJGQOHYAMFOUKF-DJKAJFNQSA-N 1 3 347.890 2.711 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](CC[NH2+]Cc2cccc(C)c2)C1)N(C)C ZINC001272566293 1108675505 /nfs/dbraw/zinc/67/55/05/1108675505.db2.gz UGCMPDWEYLWQTJ-HKUYNNGSSA-N 1 3 331.504 2.663 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CC1)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001483740656 1108717717 /nfs/dbraw/zinc/71/77/17/1108717717.db2.gz NMRWEANGLPGTGK-QGZVFWFLSA-N 1 3 347.528 2.894 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CC1)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001483740656 1108717730 /nfs/dbraw/zinc/71/77/30/1108717730.db2.gz NMRWEANGLPGTGK-QGZVFWFLSA-N 1 3 347.528 2.894 10 0 EFAEHO C[C@H](C[NH2+]CCC1CCCC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001483166208 1109911366 /nfs/dbraw/zinc/91/13/66/1109911366.db2.gz CJQUOKDWQZIYFO-DNVCBOLYSA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@H](C[NH2+]CC1=CCCCC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001483166127 1109920510 /nfs/dbraw/zinc/92/05/10/1109920510.db2.gz AESZNXHPMQJWNE-DNVCBOLYSA-N 1 3 339.499 2.794 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001483197467 1109997133 /nfs/dbraw/zinc/99/71/33/1109997133.db2.gz KMONKDVMHPYZQA-RDTXWAMCSA-N 1 3 335.467 2.638 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+][C@@H](C)c2cc(C)ccc2C)CC1)N(C)C ZINC001483748012 1111261266 /nfs/dbraw/zinc/26/12/66/1111261266.db2.gz YXHKLNYIFJJSRQ-FUHWJXTLSA-N 1 3 331.504 2.943 10 0 EFAEHO C[NH+](C)CC1(C(=O)NCC2(NCc3ccsc3)CC2)CCCCC1 ZINC001483755666 1111941652 /nfs/dbraw/zinc/94/16/52/1111941652.db2.gz YHCXDRCZLWDYHS-UHFFFAOYSA-N 1 3 349.544 2.999 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CC2)cc1 ZINC001483795366 1112455484 /nfs/dbraw/zinc/45/54/84/1112455484.db2.gz SEFMAHKSPXDMAO-UHFFFAOYSA-N 1 3 331.504 2.889 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@]2(C1)CCC[N@H+](Cc1ccsc1)C2 ZINC001483832916 1112493867 /nfs/dbraw/zinc/49/38/67/1112493867.db2.gz PYDYEYVNHSANKL-LJQANCHMSA-N 1 3 349.544 2.904 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@]2(C1)CCC[N@@H+](Cc1ccsc1)C2 ZINC001483832916 1112493868 /nfs/dbraw/zinc/49/38/68/1112493868.db2.gz PYDYEYVNHSANKL-LJQANCHMSA-N 1 3 349.544 2.904 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC2(C1)CCN(C[C@H](F)CC)CC2 ZINC001483836501 1112512781 /nfs/dbraw/zinc/51/27/81/1112512781.db2.gz BEPDPJMZSQWSPA-QGZVFWFLSA-N 1 3 341.515 2.781 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC2(C1)CCN(C[C@H](F)CC)CC2 ZINC001483836501 1112512783 /nfs/dbraw/zinc/51/27/83/1112512783.db2.gz BEPDPJMZSQWSPA-QGZVFWFLSA-N 1 3 341.515 2.781 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CCCc2ccsc2)CCN1C(=O)CN1CCCC1 ZINC001483912583 1112554638 /nfs/dbraw/zinc/55/46/38/1112554638.db2.gz AVHWZKVVQGSUQM-WMZOPIPTSA-N 1 3 349.544 2.746 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)cs1 ZINC001483913865 1112555312 /nfs/dbraw/zinc/55/53/12/1112555312.db2.gz KJUOICTXZIKSJN-RHSMWYFYSA-N 1 3 337.533 2.866 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@H]1C[NH2+]CCc1ccc(Cl)cc1 ZINC001483924504 1112563194 /nfs/dbraw/zinc/56/31/94/1112563194.db2.gz JBMPGZONGUPBKC-ZWKOTPCHSA-N 1 3 349.906 2.557 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+][C@@H]1CCc2ccccc21 ZINC001483959480 1112590500 /nfs/dbraw/zinc/59/05/00/1112590500.db2.gz VJDPBOQGAARESS-PKOBYXMFSA-N 1 3 329.488 2.595 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[NH2+]C/C=C\c1ccccc1 ZINC001483951708 1112594769 /nfs/dbraw/zinc/59/47/69/1112594769.db2.gz JPWFKSBFOJGTSJ-ABMFHFBKSA-N 1 3 329.488 2.622 10 0 EFAEHO CC[C@@H](C(=O)NC1(C)CC[NH+](C[C@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001483971278 1112602344 /nfs/dbraw/zinc/60/23/44/1112602344.db2.gz QTCAVBVMPAZBKW-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1(C)CC[NH+](CC[C@@H](C)F)CC1 ZINC001484136362 1112807375 /nfs/dbraw/zinc/80/73/75/1112807375.db2.gz DKPMATGSRAKOQF-IAGOWNOFSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)(C(=O)NC[C@]1(C)CCC[N@H+](CC2CCC2)C1)N1CCCC1 ZINC001484164783 1112869242 /nfs/dbraw/zinc/86/92/42/1112869242.db2.gz FRHJDQQYTVQYRB-FQEVSTJZSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)(C(=O)NC[C@]1(C)CCC[N@@H+](CC2CCC2)C1)N1CCCC1 ZINC001484164783 1112869244 /nfs/dbraw/zinc/86/92/44/1112869244.db2.gz FRHJDQQYTVQYRB-FQEVSTJZSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@H](C)C[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001484194628 1112906899 /nfs/dbraw/zinc/90/68/99/1112906899.db2.gz FUSKYSJDAWZZDT-GJZGRUSLSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C)C[N@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001484194628 1112906904 /nfs/dbraw/zinc/90/69/04/1112906904.db2.gz FUSKYSJDAWZZDT-GJZGRUSLSA-N 1 3 345.478 2.590 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001484195939 1112912636 /nfs/dbraw/zinc/91/26/36/1112912636.db2.gz OFBRKDVCIQFEKF-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001484195939 1112912641 /nfs/dbraw/zinc/91/26/41/1112912641.db2.gz OFBRKDVCIQFEKF-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](CC[NH2+]Cc2ccc(CF)cc2)C1 ZINC001484551131 1113003005 /nfs/dbraw/zinc/00/30/05/1113003005.db2.gz CFUNAZYCUKPKQW-IBGZPJMESA-N 1 3 349.494 2.825 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001484551253 1113003841 /nfs/dbraw/zinc/00/38/41/1113003841.db2.gz FJZBGBGFEHGXGA-IBGZPJMESA-N 1 3 331.504 2.663 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1[NH2+]CCCC1CCC1 ZINC001484900701 1117805010 /nfs/dbraw/zinc/80/50/10/1117805010.db2.gz UINDNRUXKNGZAK-AEFFLSMTSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1CN(C(=O)C(C)(C)[NH+]2CCCC2)C[C@@H]1NCC=C(Cl)Cl ZINC001484894845 1117809966 /nfs/dbraw/zinc/80/99/66/1117809966.db2.gz MJUOFGGBDAVCPQ-OLZOCXBDSA-N 1 3 348.318 2.616 10 0 EFAEHO C[C@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@@H]1[NH2+]CCCCCF ZINC001484907693 1117822219 /nfs/dbraw/zinc/82/22/19/1117822219.db2.gz VDYVPJCQFJNGDF-LPHOPBHVSA-N 1 3 349.494 2.938 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C)([NH2+]CCc2cccs2)CC1 ZINC001484928078 1117832661 /nfs/dbraw/zinc/83/26/61/1117832661.db2.gz FSSCUQQUSTXTFI-UHFFFAOYSA-N 1 3 337.533 2.602 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+]1CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]1C ZINC001484987892 1117914542 /nfs/dbraw/zinc/91/45/42/1117914542.db2.gz LGHGXSFOFFEGEO-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+]1CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]1C ZINC001484987892 1117914547 /nfs/dbraw/zinc/91/45/47/1117914547.db2.gz LGHGXSFOFFEGEO-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO CCCCC[NH2+][C@@H](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001484998880 1117924343 /nfs/dbraw/zinc/92/43/43/1117924343.db2.gz SPWKJYKRYZPUPO-YJBOKZPZSA-N 1 3 329.504 2.874 10 0 EFAEHO CC[N@H+](CC[C@@H](C)F)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001485033049 1117966505 /nfs/dbraw/zinc/96/65/05/1117966505.db2.gz UDKPXUDLPGYWJR-IAGOWNOFSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[N@@H+](CC[C@@H](C)F)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001485033049 1117966511 /nfs/dbraw/zinc/96/65/11/1117966511.db2.gz UDKPXUDLPGYWJR-IAGOWNOFSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCCC[C@H]2C[NH2+]CCCC2CCC2)C1 ZINC001485039725 1117972351 /nfs/dbraw/zinc/97/23/51/1117972351.db2.gz XIURFQGWECLAIX-HKUYNNGSSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001485230185 1118155713 /nfs/dbraw/zinc/15/57/13/1118155713.db2.gz QSDFLSLAYPJLTM-ZIAGYGMSSA-N 1 3 333.467 2.635 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)C1CCC(NC/C(Cl)=C\Cl)CC1 ZINC001485241235 1118172621 /nfs/dbraw/zinc/17/26/21/1118172621.db2.gz IFOHACSHSZOZCY-ZRDIBKRKSA-N 1 3 336.307 2.616 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1cccc(F)c1 ZINC001485311163 1118223745 /nfs/dbraw/zinc/22/37/45/1118223745.db2.gz YEWHGAVCLJSROY-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1cccc(F)c1 ZINC001485311163 1118223750 /nfs/dbraw/zinc/22/37/50/1118223750.db2.gz YEWHGAVCLJSROY-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)N(C)Cc1ccc(F)cc1 ZINC001485314352 1118227117 /nfs/dbraw/zinc/22/71/17/1118227117.db2.gz UEUKUZHBNKEKJY-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)N(C)Cc1ccc(F)cc1 ZINC001485314352 1118227121 /nfs/dbraw/zinc/22/71/21/1118227121.db2.gz UEUKUZHBNKEKJY-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO COc1cccc(CN(C)[C@H](C)CNC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001485335380 1118249377 /nfs/dbraw/zinc/24/93/77/1118249377.db2.gz BYUWSRBXNPFTKX-MRXNPFEDSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)[NH+]1CCCC1)N(C)Cc1ccc(F)cc1 ZINC001485334991 1118249952 /nfs/dbraw/zinc/24/99/52/1118249952.db2.gz AJFQTDUMQRKINN-HNNXBMFYSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[N@H+](C)CC1CC(C)(C)C1 ZINC001485350796 1118273877 /nfs/dbraw/zinc/27/38/77/1118273877.db2.gz PZVVOPBRJZQWFD-OAHLLOKOSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[N@@H+](C)CC1CC(C)(C)C1 ZINC001485350796 1118273878 /nfs/dbraw/zinc/27/38/78/1118273878.db2.gz PZVVOPBRJZQWFD-OAHLLOKOSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)C[C@H](C)C[NH+]1CC([C@H](C)NC(=O)C(C)(C)N2CCCC2)C1 ZINC001485519929 1118433191 /nfs/dbraw/zinc/43/31/91/1118433191.db2.gz LIDSIUDBZUKWFI-IRXDYDNUSA-N 1 3 337.552 2.980 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCCC2(CN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001485662494 1118511639 /nfs/dbraw/zinc/51/16/39/1118511639.db2.gz INAPLMKGEXUVOZ-AATRIKPKSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C/CC[N@H+]1CCCC2(CN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001485662494 1118511642 /nfs/dbraw/zinc/51/16/42/1118511642.db2.gz INAPLMKGEXUVOZ-AATRIKPKSA-N 1 3 333.520 2.751 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](CC3CC(C)(C)C3)C[C@H]2C1 ZINC001485657066 1118520173 /nfs/dbraw/zinc/52/01/73/1118520173.db2.gz HYSXYSIJZGWRRD-IPMKNSEASA-N 1 3 349.563 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CC3CC(C)(C)C3)C[C@H]2C1 ZINC001485657066 1118520174 /nfs/dbraw/zinc/52/01/74/1118520174.db2.gz HYSXYSIJZGWRRD-IPMKNSEASA-N 1 3 349.563 2.981 10 0 EFAEHO CN([C@@H](C[NH3+])c1ccc(Br)s1)[C@@H]1CCCN(C)C1 ZINC000053205425 214170320 /nfs/dbraw/zinc/17/03/20/214170320.db2.gz WKFXELBULWWZON-MNOVXSKESA-N 1 3 332.311 2.536 10 0 EFAEHO CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCc1cccc(CN(C)C)c1 ZINC000173946339 529405632 /nfs/dbraw/zinc/40/56/32/529405632.db2.gz SDOYLKUURXSRLK-RTBURBONSA-N 1 3 344.503 2.516 10 0 EFAEHO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1cccc(CN(C)C)c1 ZINC000173946339 529405635 /nfs/dbraw/zinc/40/56/35/529405635.db2.gz SDOYLKUURXSRLK-RTBURBONSA-N 1 3 344.503 2.516 10 0 EFAEHO CN(CC1CC[NH+](C)CC1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000103450789 219301416 /nfs/dbraw/zinc/30/14/16/219301416.db2.gz ZBVSTMYAGLDTLN-UHFFFAOYSA-N 1 3 329.488 2.696 10 0 EFAEHO CC[C@H]1CN(c2cc(Br)ccc2C[NH2+]C)CCN1C ZINC000104128518 219349899 /nfs/dbraw/zinc/34/98/99/219349899.db2.gz GKGRCMSUWHTUHT-AWEZNQCLSA-N 1 3 326.282 2.699 10 0 EFAEHO C[NH2+][C@H](CCN(C)CCN(C)C)c1ccc(Br)cc1 ZINC000104192370 219358009 /nfs/dbraw/zinc/35/80/09/219358009.db2.gz KISWXPCBHAXTDN-OAHLLOKOSA-N 1 3 328.298 2.593 10 0 EFAEHO c1ccc(CN2CC[C@H](Nc3cc([C@H]4CCC[NH2+]C4)ncn3)C2)cc1 ZINC000039420475 213236326 /nfs/dbraw/zinc/23/63/26/213236326.db2.gz CURDRLRSJUJNIG-ROUUACIJSA-N 1 3 337.471 2.630 10 0 EFAEHO C[C@H]1CCC[C@H](C)[NH+]1CCNC(=O)N1CCCC12CCN(C)CC2 ZINC000352499810 290501396 /nfs/dbraw/zinc/50/13/96/290501396.db2.gz LTFHIESMENVUIC-IRXDYDNUSA-N 1 3 336.524 2.519 10 0 EFAEHO CCCN(CCC[NH+](C)C)C(=O)NCCN1[C@H](C)CCC[C@H]1C ZINC000344403135 283219545 /nfs/dbraw/zinc/21/95/45/283219545.db2.gz WFXWNJLCLJJRRO-IAGOWNOFSA-N 1 3 326.529 2.623 10 0 EFAEHO C[NH+](C)C1CCN([C@H](CN)c2ccc(Br)s2)CC1 ZINC000036191606 213075901 /nfs/dbraw/zinc/07/59/01/213075901.db2.gz LTPMVOXYMNAUMO-LLVKDONJSA-N 1 3 332.311 2.536 10 0 EFAEHO CN1C(C)(C)CC([NH2+]CC(C)(C)CN2CCOCC2)CC1(C)C ZINC000032558349 212811021 /nfs/dbraw/zinc/81/10/21/212811021.db2.gz SITJTLATCRHMGA-UHFFFAOYSA-N 1 3 325.541 2.586 10 0 EFAEHO CCC[C@@](C)([NH3+])C(=O)N[C@H]1CC2(CCN(C)CC2)Oc2ccccc21 ZINC000262172537 283692345 /nfs/dbraw/zinc/69/23/45/283692345.db2.gz XQOFXHDJUMVGQB-QFBILLFUSA-N 1 3 345.487 2.608 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000245848163 243161407 /nfs/dbraw/zinc/16/14/07/243161407.db2.gz FVXQKDIWESXNLD-ZHALLVOQSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000245848163 243161412 /nfs/dbraw/zinc/16/14/12/243161412.db2.gz FVXQKDIWESXNLD-ZHALLVOQSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CC[C@@H]([NH3+])C2)CCN1Cc1ccccc1 ZINC000246714085 243300137 /nfs/dbraw/zinc/30/01/37/243300137.db2.gz XCWMYOAPWSCWKQ-NXWXRZEISA-N 1 3 329.488 2.625 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](NCc2ccc3cncn3c2)[C@@H](C)C1 ZINC000414188352 244038356 /nfs/dbraw/zinc/03/83/56/244038356.db2.gz QOYBPZKIOQJAQU-QFBILLFUSA-N 1 3 330.476 2.561 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](NCc2ccc3cncn3c2)[C@@H](C)C1 ZINC000414188352 244038362 /nfs/dbraw/zinc/03/83/62/244038362.db2.gz QOYBPZKIOQJAQU-QFBILLFUSA-N 1 3 330.476 2.561 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]Cc2ccc3cncn3c2)[C@@H](C)C1 ZINC000414188352 244038368 /nfs/dbraw/zinc/03/83/68/244038368.db2.gz QOYBPZKIOQJAQU-QFBILLFUSA-N 1 3 330.476 2.561 10 0 EFAEHO COCC[C@H]1CCC[C@@H]1[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000414296931 244077394 /nfs/dbraw/zinc/07/73/94/244077394.db2.gz FVCADAHYVVOJEC-UXHICEINSA-N 1 3 346.515 2.808 10 0 EFAEHO C[C@H](CC1CCOCC1)[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000414299007 244078675 /nfs/dbraw/zinc/07/86/75/244078675.db2.gz HSJHOGAXWXVTNU-GOSISDBHSA-N 1 3 346.515 2.808 10 0 EFAEHO C[C@H]1C[C@@H](CN(CCO)Cc2cc(Br)cs2)CC[NH2+]1 ZINC000414752786 244325999 /nfs/dbraw/zinc/32/59/99/244325999.db2.gz CRUFYQBBVVBSQR-RYUDHWBXSA-N 1 3 347.322 2.693 10 0 EFAEHO C[C@H](CC(=O)NCCc1ccccc1)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000414808561 244360513 /nfs/dbraw/zinc/36/05/13/244360513.db2.gz FGBVVYPKHVBIHB-SJORKVTESA-N 1 3 339.483 2.933 10 0 EFAEHO COC(=O)[C@@H](C)Oc1ccc(CNCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000414812468 244363336 /nfs/dbraw/zinc/36/33/36/244363336.db2.gz RIUSERRGSNABAK-HUUCEWRRSA-N 1 3 342.439 2.936 10 0 EFAEHO CCN(C(=O)NCCCC[NH3+])[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418517009 245180902 /nfs/dbraw/zinc/18/09/02/245180902.db2.gz YKZXVGSWLDNTQO-AEFFLSMTSA-N 1 3 332.492 2.592 10 0 EFAEHO CCN(C(=O)NCCCC[NH3+])[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418517010 245182089 /nfs/dbraw/zinc/18/20/89/245182089.db2.gz YKZXVGSWLDNTQO-FUHWJXTLSA-N 1 3 332.492 2.592 10 0 EFAEHO CCN(C(=O)N[C@H](C[NH3+])C1CC1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418457224 245164998 /nfs/dbraw/zinc/16/49/98/245164998.db2.gz IGZAZQCGLOLUGZ-ATZDWAIDSA-N 1 3 344.503 2.591 10 0 EFAEHO C[C@@H]1CN(Cc2cccc(C[NH+]3CCCCC3)c2)[C@@H](C)CN1CCO ZINC000419325411 245379437 /nfs/dbraw/zinc/37/94/37/245379437.db2.gz BEYIGNJJRTVAOQ-MOPGFXCFSA-N 1 3 345.531 2.559 10 0 EFAEHO COc1cc(Br)c(CNCCCC[NH+](C)C)cc1OC ZINC000045598419 213744715 /nfs/dbraw/zinc/74/47/15/213744715.db2.gz RBGPPEGVJMKCDS-UHFFFAOYSA-N 1 3 345.281 2.898 10 0 EFAEHO Cc1cccc2[nH]cc(CCN[C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)c21 ZINC000422716425 246426085 /nfs/dbraw/zinc/42/60/85/246426085.db2.gz NDVRTDVIFDWTSR-FGTMMUONSA-N 1 3 327.472 2.766 10 0 EFAEHO COc1cc(OC)cc(OCC[NH2+][C@@H](C)c2ccc(CN)nc2C)c1 ZINC000422935279 246517490 /nfs/dbraw/zinc/51/74/90/246517490.db2.gz HBXQTGJGJWPTDX-ZDUSSCGKSA-N 1 3 345.443 2.596 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@@H](CO)Cc1ccc(F)c(F)c1 ZINC000423069339 246560397 /nfs/dbraw/zinc/56/03/97/246560397.db2.gz DTILFEYUHJWRJF-DOMZBBRYSA-N 1 3 349.425 2.629 10 0 EFAEHO CCN1CCN(Cc2ccccc2C[NH2+][C@@H]2CC[C@@H]2SC)CC1 ZINC000425334368 247045251 /nfs/dbraw/zinc/04/52/51/247045251.db2.gz DPGOAJVOMODXJJ-MOPGFXCFSA-N 1 3 333.545 2.808 10 0 EFAEHO CCN1CCN(Cc2ccccc2C[NH2+][C@H]2CC[C@H]2SC)CC1 ZINC000425334371 247046441 /nfs/dbraw/zinc/04/64/41/247046441.db2.gz DPGOAJVOMODXJJ-RBUKOAKNSA-N 1 3 333.545 2.808 10 0 EFAEHO CCN1CCN(Cc2ccc(C[NH2+][C@@H]3CC[C@@H]3SC)cc2)CC1 ZINC000425358552 247058396 /nfs/dbraw/zinc/05/83/96/247058396.db2.gz OTPFRNOSGMIZJZ-MOPGFXCFSA-N 1 3 333.545 2.808 10 0 EFAEHO CC(C)(C)N1CC[C@@H](N2CCC(CCC[NH+]3CCCC3)CC2)C1=O ZINC000425427083 247081932 /nfs/dbraw/zinc/08/19/32/247081932.db2.gz XOCMWNHEYFHXJD-GOSISDBHSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@@H]1[C@@H](c2ccccc2)CCN1CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000434895917 248196517 /nfs/dbraw/zinc/19/65/17/248196517.db2.gz MLTLRLGHOPFUTN-UZLBHIALSA-N 1 3 341.499 2.607 10 0 EFAEHO COc1ccc(CN2CCCC2)cc1OC[C@@H](O)C[NH+]1CCCCC1 ZINC000012372834 211358949 /nfs/dbraw/zinc/35/89/49/211358949.db2.gz PUBYKQXLUYALAD-SFHVURJKSA-N 1 3 348.487 2.517 10 0 EFAEHO CN1CCN(CC[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)CC1(C)C ZINC000442878695 250134459 /nfs/dbraw/zinc/13/44/59/250134459.db2.gz ULOXWCLVBAXNBM-AZUAARDMSA-N 1 3 345.531 2.770 10 0 EFAEHO Cc1ccc(CN[C@@H](CC(C)C)C(=O)NCC[NH+](C)C)cc1Cl ZINC000443982791 250242958 /nfs/dbraw/zinc/24/29/58/250242958.db2.gz BMSUHCVLMFREPU-KRWDZBQOSA-N 1 3 339.911 2.831 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1C[NH2+]CCN1CCCC(C)(C)C1 ZINC000444007127 250249743 /nfs/dbraw/zinc/24/97/43/250249743.db2.gz AEEDJHQYYHKMHT-UHFFFAOYSA-N 1 3 327.476 2.787 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H](C)CCCO)CC1 ZINC000449407372 251016621 /nfs/dbraw/zinc/01/66/21/251016621.db2.gz HFRPJSAIMBAQGT-GOSISDBHSA-N 1 3 333.520 2.717 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@H](CO)[C@@H]2CC)CC1 ZINC000449431917 251023233 /nfs/dbraw/zinc/02/32/33/251023233.db2.gz ZPXXAHVGWZEUMD-UXHICEINSA-N 1 3 345.531 2.811 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@H](CO)[C@@H]2CC)CC1 ZINC000449431917 251023239 /nfs/dbraw/zinc/02/32/39/251023239.db2.gz ZPXXAHVGWZEUMD-UXHICEINSA-N 1 3 345.531 2.811 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@H](CCCO)C2)CC1 ZINC000449792166 251156043 /nfs/dbraw/zinc/15/60/43/251156043.db2.gz RYJHXSDOCMSDAL-IBGZPJMESA-N 1 3 345.531 2.813 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@H](CCCO)C2)CC1 ZINC000449792166 251156046 /nfs/dbraw/zinc/15/60/46/251156046.db2.gz RYJHXSDOCMSDAL-IBGZPJMESA-N 1 3 345.531 2.813 10 0 EFAEHO CC(C)Oc1ccc2[nH+]ccc(N3CCN(CCO)[C@H](C)C3)c2c1 ZINC000450448274 251390377 /nfs/dbraw/zinc/39/03/77/251390377.db2.gz AABNZISYPJPDEG-OAHLLOKOSA-N 1 3 329.444 2.525 10 0 EFAEHO O=C(NCC[C@H]1CCC[NH2+]C1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000416783951 295654925 /nfs/dbraw/zinc/65/49/25/295654925.db2.gz IMBKARHOOBOCLW-IEBWSBKVSA-N 1 3 344.503 2.512 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(C)C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000177481181 285271927 /nfs/dbraw/zinc/27/19/27/285271927.db2.gz LOIQMJKKQMICPQ-OALUTQOASA-N 1 3 346.519 2.723 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(C)C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000177481181 285271928 /nfs/dbraw/zinc/27/19/28/285271928.db2.gz LOIQMJKKQMICPQ-OALUTQOASA-N 1 3 346.519 2.723 10 0 EFAEHO CC[NH+](CC)CCOc1ccc(NC(=O)N2CC[C@@H](N(C)C)C2)cc1 ZINC000118546302 221155263 /nfs/dbraw/zinc/15/52/63/221155263.db2.gz GPWLQBGNIPBVJB-QGZVFWFLSA-N 1 3 348.491 2.575 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@@H](CNC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000119395751 221310303 /nfs/dbraw/zinc/31/03/03/221310303.db2.gz NCWGSRZINHYHCD-IBGZPJMESA-N 1 3 343.515 2.990 10 0 EFAEHO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000119395751 221310305 /nfs/dbraw/zinc/31/03/05/221310305.db2.gz NCWGSRZINHYHCD-IBGZPJMESA-N 1 3 343.515 2.990 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN2CC[C@H](C(C)(C)C)[C@@H](O)C2)cc1 ZINC000680476839 549331443 /nfs/dbraw/zinc/33/14/43/549331443.db2.gz URBKBWIIHVFXKA-OALUTQOASA-N 1 3 334.504 2.856 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@H]1CCOc2c(Br)cccc21 ZINC000423112362 285373977 /nfs/dbraw/zinc/37/39/77/285373977.db2.gz JWIKPRVKKMYVDD-FZMZJTMJSA-N 1 3 343.265 2.616 10 0 EFAEHO CN1CCC[C@H]1CC[NH+]1CCC(C(=O)N2CCc3ccccc32)CC1 ZINC000126300684 141366184 /nfs/dbraw/zinc/36/61/84/141366184.db2.gz QJVBBSMGBMKOTK-IBGZPJMESA-N 1 3 341.499 2.772 10 0 EFAEHO CC[NH+](CC)CCO[C@@H]1CCN(Cc2cc(-n3ccnc3)cs2)C1 ZINC000346232896 142172882 /nfs/dbraw/zinc/17/28/82/142172882.db2.gz YXTBCVVVNGOKQD-QGZVFWFLSA-N 1 3 348.516 2.867 10 0 EFAEHO COc1ccc(C2CCC([NH2+]CC3(O)CCN(C)CC3)CC2)cc1 ZINC000346451758 142206694 /nfs/dbraw/zinc/20/66/94/142206694.db2.gz QIZCCEFGRITEIN-UHFFFAOYSA-N 1 3 332.488 2.768 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000349904603 142376195 /nfs/dbraw/zinc/37/61/95/142376195.db2.gz CIPWAESMHIETOU-SCTDSRPQSA-N 1 3 346.519 2.536 10 0 EFAEHO CCN1CCCC[C@@H]1CNC(=O)N1CCC(C[NH+](CC)CC)CC1 ZINC000349964804 142384514 /nfs/dbraw/zinc/38/45/14/142384514.db2.gz QHPMYTXYVAJPRD-GOSISDBHSA-N 1 3 338.540 2.624 10 0 EFAEHO CCN1CCCC[C@H]1CNC(=O)N1CCC(C[NH+](CC)CC)CC1 ZINC000349964805 142384650 /nfs/dbraw/zinc/38/46/50/142384650.db2.gz QHPMYTXYVAJPRD-SFHVURJKSA-N 1 3 338.540 2.624 10 0 EFAEHO Cc1ccc(CN(CCN(C)C)C(=O)CC[C@H]2CCCC[N@@H+]2C)o1 ZINC000354802364 292098171 /nfs/dbraw/zinc/09/81/71/292098171.db2.gz TXYYYPZWUGHFSS-QGZVFWFLSA-N 1 3 335.492 2.743 10 0 EFAEHO Cc1ccc(CN(CCN(C)C)C(=O)CC[C@H]2CCCC[N@H+]2C)o1 ZINC000354802364 292098172 /nfs/dbraw/zinc/09/81/72/292098172.db2.gz TXYYYPZWUGHFSS-QGZVFWFLSA-N 1 3 335.492 2.743 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)NCC1([NH+](C)C)CCCCC1 ZINC000341236256 145018906 /nfs/dbraw/zinc/01/89/06/145018906.db2.gz NGBGJKGFIYZZQT-IRXDYDNUSA-N 1 3 338.540 2.813 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1CNC(=O)c1cccc(CN2CCCC2)c1 ZINC000343575696 145243064 /nfs/dbraw/zinc/24/30/64/145243064.db2.gz RFCGLXMLPHKQDG-IBGZPJMESA-N 1 3 329.488 2.887 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1CNC(=O)c1cccc(CN2CCCC2)c1 ZINC000343575696 145243065 /nfs/dbraw/zinc/24/30/65/145243065.db2.gz RFCGLXMLPHKQDG-IBGZPJMESA-N 1 3 329.488 2.887 10 0 EFAEHO C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000351890995 146227239 /nfs/dbraw/zinc/22/72/39/146227239.db2.gz WALKLTNEEOXPTR-IXDOHACOSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000356539929 147271297 /nfs/dbraw/zinc/27/12/97/147271297.db2.gz XZLRJHIKHGCUGV-IEBWSBKVSA-N 1 3 331.504 2.888 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)CC[C@H]1CCCC[N@H+]1C ZINC000356539929 147271300 /nfs/dbraw/zinc/27/13/00/147271300.db2.gz XZLRJHIKHGCUGV-IEBWSBKVSA-N 1 3 331.504 2.888 10 0 EFAEHO CC[C@@H]1C[C@@H](C[NH+]2CCC(N3CCN(C(C)C)CC3)CC2)CCO1 ZINC000356994385 147394370 /nfs/dbraw/zinc/39/43/70/147394370.db2.gz OJKLYROKWFETOG-AZUAARDMSA-N 1 3 337.552 2.682 10 0 EFAEHO COC(=O)C(C)(C)CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000364049958 149056562 /nfs/dbraw/zinc/05/65/62/149056562.db2.gz ZPNOJLFKGPYPML-AYHJJNSGSA-N 1 3 330.472 2.971 10 0 EFAEHO COC(=O)C(C)(C)CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000364049958 149056565 /nfs/dbraw/zinc/05/65/65/149056565.db2.gz ZPNOJLFKGPYPML-AYHJJNSGSA-N 1 3 330.472 2.971 10 0 EFAEHO C[C@@H]1C[C@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)CC[N@@H+]1C ZINC000368317204 150093119 /nfs/dbraw/zinc/09/31/19/150093119.db2.gz WHCBXQBZAUEOGS-NVXWUHKLSA-N 1 3 331.504 2.710 10 0 EFAEHO C[C@@H]1C[C@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)CC[N@H+]1C ZINC000368317204 150093122 /nfs/dbraw/zinc/09/31/22/150093122.db2.gz WHCBXQBZAUEOGS-NVXWUHKLSA-N 1 3 331.504 2.710 10 0 EFAEHO Cn1cc(C[NH2+]C2CC(N3CCCCC3)C2)c(-c2ccncc2)n1 ZINC000370125178 150526502 /nfs/dbraw/zinc/52/65/02/150526502.db2.gz YZBSTDKVHOUMFW-UHFFFAOYSA-N 1 3 325.460 2.589 10 0 EFAEHO C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]C1CC(N2CCCCC2)C1 ZINC000373522645 151183790 /nfs/dbraw/zinc/18/37/90/151183790.db2.gz NJWVRXZVMDQXHP-WYNBGMTASA-N 1 3 342.531 2.899 10 0 EFAEHO C[C@H]([NH2+][C@H]1CCN(C2CCN(C)CC2)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000374703728 151398197 /nfs/dbraw/zinc/39/81/97/151398197.db2.gz SJJTVJSUFXHOMM-GIUOSPMZSA-N 1 3 327.516 2.937 10 0 EFAEHO C[C@H]([NH2+][C@@H]1CCN(C2CCN(C)CC2)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000374703734 151398362 /nfs/dbraw/zinc/39/83/62/151398362.db2.gz SJJTVJSUFXHOMM-OFCAXSSNSA-N 1 3 327.516 2.937 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)CC[C@H]2CCCC[N@@H+]2C)N(C)C)cc1 ZINC000431773329 292251732 /nfs/dbraw/zinc/25/17/32/292251732.db2.gz OGOINEJKWVTQQO-MOPGFXCFSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)CC[C@H]2CCCC[N@H+]2C)N(C)C)cc1 ZINC000431773329 292251734 /nfs/dbraw/zinc/25/17/34/292251734.db2.gz OGOINEJKWVTQQO-MOPGFXCFSA-N 1 3 331.504 2.978 10 0 EFAEHO COc1ccc([C@H](NCCN2CCCCCC2)[C@@H]2CCC[NH2+]2)cc1 ZINC000422804947 286375530 /nfs/dbraw/zinc/37/55/30/286375530.db2.gz INBRLWFJOLUNCG-PMACEKPBSA-N 1 3 331.504 2.954 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc1 ZINC000423292101 286927488 /nfs/dbraw/zinc/92/74/88/286927488.db2.gz LJDDWPPZSIJRNY-KGLIPLIRSA-N 1 3 332.469 2.961 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@@H](CCO)C2)CC1 ZINC000093106436 544551075 /nfs/dbraw/zinc/55/10/75/544551075.db2.gz VFZZWICUZWGHEZ-IBGZPJMESA-N 1 3 345.531 2.813 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@@H](CCO)C2)CC1 ZINC000093106436 544551078 /nfs/dbraw/zinc/55/10/78/544551078.db2.gz VFZZWICUZWGHEZ-IBGZPJMESA-N 1 3 345.531 2.813 10 0 EFAEHO C[NH+]1CCC(CNc2ncnc3c2CCCC3)(N2CCCCC2)CC1 ZINC000153228687 544731592 /nfs/dbraw/zinc/73/15/92/544731592.db2.gz PEMBAQVKVWGJJV-UHFFFAOYSA-N 1 3 343.519 2.718 10 0 EFAEHO COc1cccc(N2CCC[C@H](N[C@@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)c1 ZINC000166634311 544852531 /nfs/dbraw/zinc/85/25/31/544852531.db2.gz ISVPZXXWJJFIJU-FGTMMUONSA-N 1 3 329.488 2.880 10 0 EFAEHO COc1cccc(N2CCC[C@H](N[C@@H]3CC[N@H+]4CCC[C@@H]4C3)C2)c1 ZINC000166634311 544852536 /nfs/dbraw/zinc/85/25/36/544852536.db2.gz ISVPZXXWJJFIJU-FGTMMUONSA-N 1 3 329.488 2.880 10 0 EFAEHO c1ccc(CN2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCN2CCSCC2)C3)cc1 ZINC000272444557 266266927 /nfs/dbraw/zinc/26/69/27/266266927.db2.gz UMGQBUSJUGZNLS-ACDBMABISA-N 1 3 345.556 2.820 10 0 EFAEHO c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](NCCN2CCSCC2)C3)cc1 ZINC000272444557 266266930 /nfs/dbraw/zinc/26/69/30/266266930.db2.gz UMGQBUSJUGZNLS-ACDBMABISA-N 1 3 345.556 2.820 10 0 EFAEHO c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](NCCN2CCSCC2)C3)cc1 ZINC000272444557 266266933 /nfs/dbraw/zinc/26/69/33/266266933.db2.gz UMGQBUSJUGZNLS-ACDBMABISA-N 1 3 345.556 2.820 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N[C@@H](CN2CCCC2)c2ccccc2)CC[N@@H+]1C ZINC000279295593 273199137 /nfs/dbraw/zinc/19/91/37/273199137.db2.gz YRELDRISYSYUPE-WDSOQIARSA-N 1 3 329.488 2.670 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N[C@@H](CN2CCCC2)c2ccccc2)CC[N@H+]1C ZINC000279295593 273199139 /nfs/dbraw/zinc/19/91/39/273199139.db2.gz YRELDRISYSYUPE-WDSOQIARSA-N 1 3 329.488 2.670 10 0 EFAEHO CC[NH+](CC)CC1CCN([C@H]2CCc3ccccc3NC2=O)CC1 ZINC000361698108 273635479 /nfs/dbraw/zinc/63/54/79/273635479.db2.gz BPFNUDLQIDTFPS-IBGZPJMESA-N 1 3 329.488 2.994 10 0 EFAEHO C[C@@H](NCC1CC[NH+](C[C@@H](O)c2ccccc2)CC1)c1nccn1C ZINC000182862533 274246421 /nfs/dbraw/zinc/24/64/21/274246421.db2.gz RQJAMZHNEIZODH-VQIMIIECSA-N 1 3 342.487 2.516 10 0 EFAEHO C[C@H](NCC1CC[NH+](C[C@H](O)c2ccccc2)CC1)c1cnccn1 ZINC000151916110 274511749 /nfs/dbraw/zinc/51/17/49/274511749.db2.gz FQOYYZHAJTYOFQ-JXFKEZNVSA-N 1 3 340.471 2.573 10 0 EFAEHO CCN(C(=O)C[NH2+]CC1CC1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000368454967 276061804 /nfs/dbraw/zinc/06/18/04/276061804.db2.gz WYCIZQIBQQBFBA-VQIMIIECSA-N 1 3 329.488 2.670 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCNC(=O)c2ccccc2Cl)[C@@H]2CCC[C@H]21 ZINC000367750646 277170993 /nfs/dbraw/zinc/17/09/93/277170993.db2.gz BARAAAPENIOXHK-BHYGNILZSA-N 1 3 335.879 2.532 10 0 EFAEHO C[N@H+]1CC[C@H](NCCNC(=O)c2ccccc2Cl)[C@@H]2CCC[C@H]21 ZINC000367750646 277170994 /nfs/dbraw/zinc/17/09/94/277170994.db2.gz BARAAAPENIOXHK-BHYGNILZSA-N 1 3 335.879 2.532 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)[C@H]2CCC[C@H]21 ZINC000353611508 277172392 /nfs/dbraw/zinc/17/23/92/277172392.db2.gz YSOUJNUZDTZODQ-OBKDMQGPSA-N 1 3 332.463 2.754 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)[C@H]2CCC[C@H]21 ZINC000353611508 277172394 /nfs/dbraw/zinc/17/23/94/277172394.db2.gz YSOUJNUZDTZODQ-OBKDMQGPSA-N 1 3 332.463 2.754 10 0 EFAEHO COc1ccccc1N1CC[C@H](N[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000422878118 278055894 /nfs/dbraw/zinc/05/58/94/278055894.db2.gz SKWDAINIFWMHII-XLAORIBOSA-N 1 3 329.488 2.784 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[NH3+])[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418434621 279001802 /nfs/dbraw/zinc/00/18/02/279001802.db2.gz VXLDCPMKJGMYKA-NVXWUHKLSA-N 1 3 332.492 2.591 10 0 EFAEHO CCN(C(=O)N[C@H](C)CC[NH3+])[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418546303 279003890 /nfs/dbraw/zinc/00/38/90/279003890.db2.gz JKEWLFYHUGYODW-RYRKJORJSA-N 1 3 332.492 2.591 10 0 EFAEHO CCN1CCCC[C@@H]1CNC(=O)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000111883738 279269795 /nfs/dbraw/zinc/26/97/95/279269795.db2.gz XZWJYZNGPLZOLF-MSOLQXFVSA-N 1 3 336.524 2.521 10 0 EFAEHO C[C@H](C(=O)N1CCC(C[NH+]2CCCC2)CC1)[C@H](N)c1ccccc1 ZINC000237554316 289261532 /nfs/dbraw/zinc/26/15/32/289261532.db2.gz IEFCODUVRIFGCB-LPHOPBHVSA-N 1 3 329.488 2.657 10 0 EFAEHO CN1CCC(C[NH2+][C@H]2CC(C)(C)OC2(C)C)(N2CCCCC2)CC1 ZINC000124759209 289879740 /nfs/dbraw/zinc/87/97/40/289879740.db2.gz YDRVXFRCCSIODU-KRWDZBQOSA-N 1 3 337.552 2.872 10 0 EFAEHO CN(C)[C@H](CNC(=O)NC1CCC(C[NH+](C)C)CC1)c1ccccc1 ZINC000125062288 293005487 /nfs/dbraw/zinc/00/54/87/293005487.db2.gz CPTRCQWGVDNSAW-NKELODKYSA-N 1 3 346.519 2.709 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)NCC(C)(C)N2CCCCC2)[C@H](C)C1 ZINC000127910879 293085104 /nfs/dbraw/zinc/08/51/04/293085104.db2.gz QRKXPCIGCGSRLY-IAGOWNOFSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)NCC(C)(C)N2CCCCC2)[C@H](C)C1 ZINC000127910879 293085106 /nfs/dbraw/zinc/08/51/06/293085106.db2.gz QRKXPCIGCGSRLY-IAGOWNOFSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H](CNC(=O)N[C@H](CN(C)C)c1ccccc1)[NH+]1CCC(C)CC1 ZINC000128974633 293120871 /nfs/dbraw/zinc/12/08/71/293120871.db2.gz XZRIESNESOSMGQ-PKOBYXMFSA-N 1 3 346.519 2.709 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H](O)[C@H](C)CC)CC1 ZINC000152118593 293318420 /nfs/dbraw/zinc/31/84/20/293318420.db2.gz OGZMOXFECABOSU-YLJYHZDGSA-N 1 3 333.520 2.715 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@@H](C)c2ccc(F)c(OC)c2)CC1 ZINC000152894480 293351700 /nfs/dbraw/zinc/35/17/00/293351700.db2.gz UGHDECKDARVKPW-INIZCTEOSA-N 1 3 337.483 2.903 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@]2(C)CCCO2)CC1 ZINC000152903329 293351710 /nfs/dbraw/zinc/35/17/10/293351710.db2.gz MNCFFBBQGKJOBZ-FQEVSTJZSA-N 1 3 331.504 2.877 10 0 EFAEHO CO[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340469977 294316805 /nfs/dbraw/zinc/31/68/05/294316805.db2.gz YBILXYXFDJJVEW-QWFCFKBJSA-N 1 3 346.515 2.928 10 0 EFAEHO COC(=O)C1(CN2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)CC1 ZINC000295337709 295302732 /nfs/dbraw/zinc/30/27/32/295302732.db2.gz PNLQRBWXRSZTRU-IBGZPJMESA-N 1 3 328.456 2.538 10 0 EFAEHO COC(=O)C1(CN2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)CC1 ZINC000295337709 295302734 /nfs/dbraw/zinc/30/27/34/295302734.db2.gz PNLQRBWXRSZTRU-IBGZPJMESA-N 1 3 328.456 2.538 10 0 EFAEHO CC[C@H](N[C@H](C)c1ccc(OCC[NH+](C)C)cc1)[C@@H](O)C(F)F ZINC000295865380 295388324 /nfs/dbraw/zinc/38/83/24/295388324.db2.gz BUAZPEZPSBRVOF-UHOFOFEASA-N 1 3 330.419 2.682 10 0 EFAEHO Cc1cc(CN2CCC(C(=O)NCCC[NH+]3CCCC3)CC2)cs1 ZINC000295975758 295405523 /nfs/dbraw/zinc/40/55/23/295405523.db2.gz IZUDYONCAIOCEA-UHFFFAOYSA-N 1 3 349.544 2.871 10 0 EFAEHO CC[C@H](N[C@@H](C)c1cccc(OCC[NH+](C)C)c1)[C@@H](O)C(F)F ZINC000296395607 310814431 /nfs/dbraw/zinc/81/44/31/310814431.db2.gz KGNUXWMNZJNURH-VBNZEHGJSA-N 1 3 330.419 2.682 10 0 EFAEHO C[C@@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)c1cccnc1 ZINC000397600658 311960643 /nfs/dbraw/zinc/96/06/43/311960643.db2.gz NPHYXLFNDJTCTH-QGZVFWFLSA-N 1 3 325.456 2.759 10 0 EFAEHO COc1cc(Br)c(CNCC[C@H]2CC[NH2+]C2)c(OC)c1 ZINC000414827175 312054804 /nfs/dbraw/zinc/05/48/04/312054804.db2.gz GUIKQYLSLBNKTP-LLVKDONJSA-N 1 3 343.265 2.556 10 0 EFAEHO C[C@H]1CC[NH2+]C[C@H]1NC1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000414922351 312063605 /nfs/dbraw/zinc/06/36/05/312063605.db2.gz FZBHDRIOOLISBF-SUMWQHHRSA-N 1 3 335.879 2.532 10 0 EFAEHO C[C@H]1CNCC[C@@H]1[NH2+]Cc1ccc(-n2ccc(C(F)(F)F)n2)cc1 ZINC000414938274 312066850 /nfs/dbraw/zinc/06/68/50/312066850.db2.gz IGHBSIABNIRBBO-WFASDCNBSA-N 1 3 338.377 2.979 10 0 EFAEHO C[C@H](CCc1ccc(OC(F)F)cc1)[NH2+]C[C@@H]1CNCCCO1 ZINC000415038441 312081394 /nfs/dbraw/zinc/08/13/94/312081394.db2.gz LZKPUGASULQKAI-CJNGLKHVSA-N 1 3 328.403 2.577 10 0 EFAEHO C[C@H](CCc1ccc(OC(F)F)cc1)NC[C@@H]1C[NH2+]CCCO1 ZINC000415038441 312081396 /nfs/dbraw/zinc/08/13/96/312081396.db2.gz LZKPUGASULQKAI-CJNGLKHVSA-N 1 3 328.403 2.577 10 0 EFAEHO C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+][C@@H]1CCCCNC1 ZINC000415070557 312087960 /nfs/dbraw/zinc/08/79/60/312087960.db2.gz QYGMGNWSIBCUTG-GOEBONIOSA-N 1 3 337.895 2.809 10 0 EFAEHO CC[NH2+]Cc1ccccc1NC(=O)N1CCN(C2CCCC2)CC1 ZINC000415944309 312182490 /nfs/dbraw/zinc/18/24/90/312182490.db2.gz OYFVMVVABJGOOW-UHFFFAOYSA-N 1 3 330.476 2.888 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)[C@H](C)C1 ZINC000415963884 312186317 /nfs/dbraw/zinc/18/63/17/312186317.db2.gz WKQVQIUGDIIXEJ-CXAGYDPISA-N 1 3 348.466 2.665 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)[C@H](C)C1 ZINC000415963884 312186319 /nfs/dbraw/zinc/18/63/19/312186319.db2.gz WKQVQIUGDIIXEJ-CXAGYDPISA-N 1 3 348.466 2.665 10 0 EFAEHO C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415976039 312188492 /nfs/dbraw/zinc/18/84/92/312188492.db2.gz QPTIIQRGMPBESI-ZDUSSCGKSA-N 1 3 348.466 2.665 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)NC[C@@H]([NH3+])c2ccccc2)N(C)C)cc1 ZINC000417313100 312207760 /nfs/dbraw/zinc/20/77/60/312207760.db2.gz OSAUSWHJSHYNEU-RTBURBONSA-N 1 3 340.471 2.597 10 0 EFAEHO C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)N2CCNC(C)(C)C2)CC1 ZINC000417677552 312255536 /nfs/dbraw/zinc/25/55/36/312255536.db2.gz FZQOSHGPPWDSJC-INIZCTEOSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@]1(CNC(=O)NC2CCC([NH3+])CC2)CCCN1Cc1ccccc1 ZINC000418039990 312314852 /nfs/dbraw/zinc/31/48/52/312314852.db2.gz IBDPUCVZKAJLID-AFMYVXGZSA-N 1 3 344.503 2.610 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)N1CCCC[C@@H]1[C@H](C)[NH3+])c1ccco1 ZINC000418163792 312337892 /nfs/dbraw/zinc/33/78/92/312337892.db2.gz HUDHMSWJAWMFEK-CAOSSQGBSA-N 1 3 336.480 2.620 10 0 EFAEHO C[C@@H](NC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H](c1ccccc1)N(C)C ZINC000418163461 312337957 /nfs/dbraw/zinc/33/79/57/312337957.db2.gz DKYJIANRNZXPBJ-NYJIRUKSSA-N 1 3 344.503 2.602 10 0 EFAEHO Cc1ccccc1[C@H]([C@@H](C)NC(=O)N(C1CC1)[C@H]1CC[NH2+]C1)N(C)C ZINC000418181175 312341351 /nfs/dbraw/zinc/34/13/51/312341351.db2.gz KWLFZSKVHBPVDZ-AYBZRNKSSA-N 1 3 344.503 2.522 10 0 EFAEHO CC(C)Cc1ccc([C@H](CNC(=O)N[C@H](C)[C@@H](C)[NH3+])N(C)C)cc1 ZINC000418198921 312345802 /nfs/dbraw/zinc/34/58/02/312345802.db2.gz WCBXLXCSHPMQEA-RKVPGOIHSA-N 1 3 334.508 2.523 10 0 EFAEHO CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N(C)C[C@@H]1CCCN1C ZINC000420773504 312387659 /nfs/dbraw/zinc/38/76/59/312387659.db2.gz AXQVUIUPMZZDHP-IBGZPJMESA-N 1 3 346.519 2.762 10 0 EFAEHO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)N(C)C[C@@H]1CCCN1C ZINC000420773504 312387661 /nfs/dbraw/zinc/38/76/61/312387661.db2.gz AXQVUIUPMZZDHP-IBGZPJMESA-N 1 3 346.519 2.762 10 0 EFAEHO CN1CC[C@@H](NC(=O)NC2CCC([NH+](C)C)CC2)[C@H]1c1ccccc1 ZINC000420823338 312397620 /nfs/dbraw/zinc/39/76/20/312397620.db2.gz VEYRUCNHOIEJEB-CSODTCANSA-N 1 3 344.503 2.604 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@H](c1cncc(Br)c1)C1CC1 ZINC000423109646 312412003 /nfs/dbraw/zinc/41/20/03/312412003.db2.gz STZRZALXSZZMMG-CABCVRRESA-N 1 3 342.281 2.639 10 0 EFAEHO COc1ccc([C@H](NCc2ccc3c(c2)CNC3)[C@@H]2CCC[NH2+]2)cc1 ZINC000423393126 312419263 /nfs/dbraw/zinc/41/92/63/312419263.db2.gz QLCQFDORVYNKFT-SFTDATJTSA-N 1 3 337.467 2.881 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2CC[C@@H](OC)C2)CC1 ZINC000471814655 313162522 /nfs/dbraw/zinc/16/25/22/313162522.db2.gz DWKPTYPVJUIXPA-RBUKOAKNSA-N 1 3 331.504 2.876 10 0 EFAEHO CCCC[N@H+](C)CCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475116281 313218448 /nfs/dbraw/zinc/21/84/48/313218448.db2.gz JJTWRLIPIBACBP-LJQANCHMSA-N 1 3 346.519 2.634 10 0 EFAEHO CCCC[N@@H+](C)CCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475116281 313218449 /nfs/dbraw/zinc/21/84/49/313218449.db2.gz JJTWRLIPIBACBP-LJQANCHMSA-N 1 3 346.519 2.634 10 0 EFAEHO CC(C)(C)N1CCC([NH2+]C[C@@H](CO)Cc2ccc(F)c(F)c2)CC1 ZINC000477915556 313246258 /nfs/dbraw/zinc/24/62/58/313246258.db2.gz KXDUKPGTQKGDJH-HNNXBMFYSA-N 1 3 340.458 2.968 10 0 EFAEHO CC(C)(C)[NH+]1CCC(NC[C@@H](CO)Cc2ccc(F)c(F)c2)CC1 ZINC000477915556 313246260 /nfs/dbraw/zinc/24/62/60/313246260.db2.gz KXDUKPGTQKGDJH-HNNXBMFYSA-N 1 3 340.458 2.968 10 0 EFAEHO CN(C)[C@H](CNC(=O)C1(C[NH+](C)C)CCCCC1)Cc1ccccc1 ZINC000492911131 314174299 /nfs/dbraw/zinc/17/42/99/314174299.db2.gz HSCIQWSOWFULPU-IBGZPJMESA-N 1 3 345.531 2.788 10 0 EFAEHO CCCN1CC[C@H](C[NH2+][C@H](C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1 ZINC000496297959 315017753 /nfs/dbraw/zinc/01/77/53/315017753.db2.gz YDBCTEVGSWYVRO-BRWVUGGUSA-N 1 3 339.524 2.953 10 0 EFAEHO FC(F)Oc1ccc(CN2CCC(CO[C@H]3CC[NH2+]C3)CC2)cc1 ZINC000530239924 317089113 /nfs/dbraw/zinc/08/91/13/317089113.db2.gz IVYPFGMXNCIXDD-KRWDZBQOSA-N 1 3 340.414 2.879 10 0 EFAEHO COc1ccccc1/C=C/CN1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530248864 317091412 /nfs/dbraw/zinc/09/14/12/317091412.db2.gz QYMCZAIFVSCRBA-OQBYNLHGSA-N 1 3 330.472 2.799 10 0 EFAEHO COc1ccccc1/C=C\CN1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530248865 317091473 /nfs/dbraw/zinc/09/14/73/317091473.db2.gz QYMCZAIFVSCRBA-UTSMFGRCSA-N 1 3 330.472 2.799 10 0 EFAEHO Cc1ccc(CN(C)C)cc1NC(=O)CCN(C)c1cc[nH+]cc1 ZINC000540926090 317758314 /nfs/dbraw/zinc/75/83/14/317758314.db2.gz MAFUYLWTHZEEPU-UHFFFAOYSA-N 1 3 326.444 2.917 10 0 EFAEHO C[C@H]([NH2+]CCCCN1CCN(C)CC1)c1cnn(C2CCCC2)c1 ZINC000548861100 318150924 /nfs/dbraw/zinc/15/09/24/318150924.db2.gz GQGWRDXFHYVVAU-KRWDZBQOSA-N 1 3 333.524 2.676 10 0 EFAEHO C[C@H]([NH2+]CCCCN1C[C@@H](C)O[C@@H](C)C1)c1cn2ccccc2n1 ZINC000551308598 318205496 /nfs/dbraw/zinc/20/54/96/318205496.db2.gz HWDGIVKHMYKPKK-BBWFWOEESA-N 1 3 330.476 2.874 10 0 EFAEHO C[C@@H]1[C@H](NCC(=O)NCC[NH+]2CCCCCC2)C[C@@H]1c1ccccc1 ZINC000552064781 318240832 /nfs/dbraw/zinc/24/08/32/318240832.db2.gz OGROKZIUBZCLNJ-YSIASYRMSA-N 1 3 343.515 2.760 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3[NH2+]2)N(C)C)cc1 ZINC000554302507 318306952 /nfs/dbraw/zinc/30/69/52/318306952.db2.gz NYPYJJZKOUFGNV-YRPNKDGESA-N 1 3 343.515 2.889 10 0 EFAEHO CCc1[nH+]c2ccccc2c(N2CCN([C@@H](CC)CO)CC2)c1C ZINC000554490885 318316462 /nfs/dbraw/zinc/31/64/62/318316462.db2.gz BTVVXMVHUYSLLE-INIZCTEOSA-N 1 3 327.472 2.999 10 0 EFAEHO [NH3+]CC1CCN(C(=O)NCc2ccccc2CN2CCCCC2)CC1 ZINC000563560576 318797088 /nfs/dbraw/zinc/79/70/88/318797088.db2.gz HQZDVJMYVWQHGG-UHFFFAOYSA-N 1 3 344.503 2.553 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)N1CCc2ccccc2[C@@H]1CN)C(C)C ZINC000566066987 319028463 /nfs/dbraw/zinc/02/84/63/319028463.db2.gz YFHIKJRJJUZVAD-IBGZPJMESA-N 1 3 346.519 2.763 10 0 EFAEHO Cc1ccc(C)c(OC[C@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1C ZINC000567104437 319138503 /nfs/dbraw/zinc/13/85/03/319138503.db2.gz NERMQXMPQIYTEU-RAFMOHDBSA-N 1 3 346.515 2.956 10 0 EFAEHO Cc1ccc(C)c(OC[C@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1C ZINC000567104437 319138505 /nfs/dbraw/zinc/13/85/05/319138505.db2.gz NERMQXMPQIYTEU-RAFMOHDBSA-N 1 3 346.515 2.956 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)N2CCC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC000567597192 319186954 /nfs/dbraw/zinc/18/69/54/319186954.db2.gz YDQLYOYEFHQSIC-QUCCMNQESA-N 1 3 344.503 2.595 10 0 EFAEHO [NH3+][C@@H]1CCC[C@H]1N[C@@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 ZINC000567639694 319191426 /nfs/dbraw/zinc/19/14/26/319191426.db2.gz LKRCUBGCNUXRQZ-DAXOMENPSA-N 1 3 332.398 2.613 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CN(C)C(=O)CN3CC[C@H](C)C3)C2)s1 ZINC000567750835 319207655 /nfs/dbraw/zinc/20/76/55/319207655.db2.gz JOYQAHYCOOCYJT-RDJZCZTQSA-N 1 3 349.544 2.679 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)C(=O)CN3CC[C@H](C)C3)C2)s1 ZINC000567750835 319207657 /nfs/dbraw/zinc/20/76/57/319207657.db2.gz JOYQAHYCOOCYJT-RDJZCZTQSA-N 1 3 349.544 2.679 10 0 EFAEHO O=C(NCCN[C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)c1ccccc1Cl ZINC000570320820 319464988 /nfs/dbraw/zinc/46/49/88/319464988.db2.gz ACMKCPMVKSDPFE-RYQLBKOJSA-N 1 3 349.906 2.970 10 0 EFAEHO CCCCCNC(=O)C1CCN(Cc2ccc3c(c2)C[NH2+]CC3)CC1 ZINC000574526146 319870613 /nfs/dbraw/zinc/87/06/13/319870613.db2.gz ZOWZJTBHQUKXEZ-UHFFFAOYSA-N 1 3 343.515 2.851 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3CC(C)=C[C@H](C)C3)CC2)CC1 ZINC000576477257 320019694 /nfs/dbraw/zinc/01/96/94/320019694.db2.gz CQNWVOMFNIFOKS-INIZCTEOSA-N 1 3 333.520 2.607 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2cccc3c2CCNC3)[C@H](C)C1 ZINC000578048759 320168256 /nfs/dbraw/zinc/16/82/56/320168256.db2.gz IJAOGXWASXTRJE-RDTXWAMCSA-N 1 3 330.476 2.526 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2cccc3c2CCNC3)[C@H](C)C1 ZINC000578048759 320168258 /nfs/dbraw/zinc/16/82/58/320168258.db2.gz IJAOGXWASXTRJE-RDTXWAMCSA-N 1 3 330.476 2.526 10 0 EFAEHO CCO[C@H]1C[C@@H]([NH2+]CC2(N3CCCCC3)CCN(C)CC2)C1(C)C ZINC000181827398 323252297 /nfs/dbraw/zinc/25/22/97/323252297.db2.gz QATJHBXVSUOPJX-MSOLQXFVSA-N 1 3 337.552 2.730 10 0 EFAEHO C[NH2+][C@H](C)C(=O)NCCCN(Cc1ccccc1)Cc1ccccc1 ZINC000390758869 323778742 /nfs/dbraw/zinc/77/87/42/323778742.db2.gz YGQCQEMSJQVWLP-GOSISDBHSA-N 1 3 339.483 2.803 10 0 EFAEHO COCC[C@@H](COC)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000579770528 324025786 /nfs/dbraw/zinc/02/57/86/324025786.db2.gz NDGLNMQASBLJKJ-LWYYNNOASA-N 1 3 332.488 2.823 10 0 EFAEHO COCC[C@@H](COC)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000579770528 324025789 /nfs/dbraw/zinc/02/57/89/324025789.db2.gz NDGLNMQASBLJKJ-LWYYNNOASA-N 1 3 332.488 2.823 10 0 EFAEHO COCC[C@@H](COC)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000579770526 324026233 /nfs/dbraw/zinc/02/62/33/324026233.db2.gz NDGLNMQASBLJKJ-HAGHYFMRSA-N 1 3 332.488 2.823 10 0 EFAEHO COCC[C@@H](COC)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000579770526 324026239 /nfs/dbraw/zinc/02/62/39/324026239.db2.gz NDGLNMQASBLJKJ-HAGHYFMRSA-N 1 3 332.488 2.823 10 0 EFAEHO CC(C)OCC[C@H](O)CNCc1ccccc1C[NH+]1CCCCC1 ZINC000580304813 324137717 /nfs/dbraw/zinc/13/77/17/324137717.db2.gz YUBLPAZFTYIRGC-FQEVSTJZSA-N 1 3 334.504 2.938 10 0 EFAEHO [NH3+][C@@H](CCC(=O)Nc1ccc2c(c1F)CCNC2)c1ccccc1 ZINC000581001665 324285270 /nfs/dbraw/zinc/28/52/70/324285270.db2.gz TZJXHXLAAGZJHP-INIZCTEOSA-N 1 3 327.403 2.890 10 0 EFAEHO C[C@H]([NH2+]C1CCN(c2ccncc2)CC1)c1ccc(-n2ccnn2)cc1 ZINC000581586397 324411576 /nfs/dbraw/zinc/41/15/76/324411576.db2.gz WUOJJZFTOSZIFV-INIZCTEOSA-N 1 3 348.454 2.982 10 0 EFAEHO N[C@@H](CNC(=O)c1ccccc1CC1CC[NH2+]CC1)c1ccccc1 ZINC000582290660 324562026 /nfs/dbraw/zinc/56/20/26/324562026.db2.gz QLBKBNIMVCSRAD-FQEVSTJZSA-N 1 3 337.467 2.659 10 0 EFAEHO NC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 ZINC000582481530 324603106 /nfs/dbraw/zinc/60/31/06/324603106.db2.gz QYMYAMKJMFSHDU-DXCKQFNASA-N 1 3 346.425 2.860 10 0 EFAEHO COc1ccc(C[NH+]2CCC(CNCc3cc(C)no3)CC2)cc1 ZINC000631056832 479864948 /nfs/dbraw/zinc/86/49/48/479864948.db2.gz UTAOIRQTCSFSSZ-UHFFFAOYSA-N 1 3 329.444 2.993 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+]Cc2ccnn2CC2CCC2)C[C@@H](C)O1 ZINC000631075702 479878795 /nfs/dbraw/zinc/87/87/95/479878795.db2.gz SQQDYRTXSHIQMT-IAGOWNOFSA-N 1 3 334.508 2.662 10 0 EFAEHO C[C@@H](Cc1ccc(O)cc1)[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000352634071 475477463 /nfs/dbraw/zinc/47/74/63/475477463.db2.gz VXAKCASMDVJKJW-SFHVURJKSA-N 1 3 345.531 2.863 10 0 EFAEHO C[C@@H]1C[C@@H](NCc2ccccc2N(C)C2CC[NH+](C)CC2)[C@@H](C)O1 ZINC000631223306 479968132 /nfs/dbraw/zinc/96/81/32/479968132.db2.gz SYGQYVXUXDKUBP-GPMSIDNRSA-N 1 3 331.504 2.873 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H]2CCC[C@@H](O)C2)CC1 ZINC000088728682 472382139 /nfs/dbraw/zinc/38/21/39/472382139.db2.gz HUMDZQQNMYORPW-UYAOXDASSA-N 1 3 345.531 2.859 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000069849236 472451557 /nfs/dbraw/zinc/45/15/57/472451557.db2.gz KYSPPHGRSIYFPH-HXUWFJFHSA-N 1 3 341.499 2.983 10 0 EFAEHO CN(Cc1csc(Br)c1)CC1CC[NH+](CCO)CC1 ZINC000069898302 472461683 /nfs/dbraw/zinc/46/16/83/472461683.db2.gz DUBKGTHPZKRWIY-UHFFFAOYSA-N 1 3 347.322 2.647 10 0 EFAEHO COc1ccccc1C[C@H]([NH2+]CCCN1CCCN(C)CC1)C(C)C ZINC000128637378 472478541 /nfs/dbraw/zinc/47/85/41/472478541.db2.gz NOVBMPNFAZRVQB-FQEVSTJZSA-N 1 3 347.547 2.880 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](NCCc2ncc(CC)s2)[C@@H](C)C1 ZINC000130254879 472593700 /nfs/dbraw/zinc/59/37/00/472593700.db2.gz OVPINKOOKLJXAT-DOTOQJQBSA-N 1 3 339.549 2.975 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](NCCc2ncc(CC)s2)[C@@H](C)C1 ZINC000130254879 472593703 /nfs/dbraw/zinc/59/37/03/472593703.db2.gz OVPINKOOKLJXAT-DOTOQJQBSA-N 1 3 339.549 2.975 10 0 EFAEHO Cc1ccccc1OC[C@H](O)CN1CCC(C[NH+]2CCCC2)CC1 ZINC000047972292 472790622 /nfs/dbraw/zinc/79/06/22/472790622.db2.gz GNYAZZXIRDZODC-LJQANCHMSA-N 1 3 332.488 2.543 10 0 EFAEHO CC[NH+](CC)CC1CCN(C[C@H](O)COc2ccc(C)cc2)CC1 ZINC000047978412 472791133 /nfs/dbraw/zinc/79/11/33/472791133.db2.gz CDTKILKURDCXOU-IBGZPJMESA-N 1 3 334.504 2.789 10 0 EFAEHO C[N@H+](C[C@@H]1CCCO1)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000105862869 472791705 /nfs/dbraw/zinc/79/17/05/472791705.db2.gz LCVJAKDIYMBPHR-VQTJNVASSA-N 1 3 332.488 2.543 10 0 EFAEHO C[N@@H+](C[C@@H]1CCCO1)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000105862869 472791712 /nfs/dbraw/zinc/79/17/12/472791712.db2.gz LCVJAKDIYMBPHR-VQTJNVASSA-N 1 3 332.488 2.543 10 0 EFAEHO CCN1CCC(N(C)C(=O)C2CCN(c3cc[nH+]cc3C)CC2)CC1 ZINC000073288785 472793567 /nfs/dbraw/zinc/79/35/67/472793567.db2.gz BZOYZBGYROXSJE-UHFFFAOYSA-N 1 3 344.503 2.549 10 0 EFAEHO C[C@H](O)C[NH+]1CCC(CN(C)Cc2cc(F)c(F)c(F)c2)CC1 ZINC000121122965 472801867 /nfs/dbraw/zinc/80/18/67/472801867.db2.gz GXEHZOCNRZOBQF-LBPRGKRZSA-N 1 3 330.394 2.629 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)C1CCN(Cc2ccccc2)CC1 ZINC000063737105 472809492 /nfs/dbraw/zinc/80/94/92/472809492.db2.gz UOUVBHLCQQUQOP-QGZVFWFLSA-N 1 3 331.504 2.745 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NC[C@@H](c2ccccc2)N(C)C)CC1 ZINC000157654542 472843234 /nfs/dbraw/zinc/84/32/34/472843234.db2.gz ONLUVJNYSAXELF-IBGZPJMESA-N 1 3 346.519 2.711 10 0 EFAEHO CCC[C@H](C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)N(C)C ZINC000134021364 472865122 /nfs/dbraw/zinc/86/51/22/472865122.db2.gz YQNZQZWEBUTDHH-NZSAHSFTSA-N 1 3 331.504 2.886 10 0 EFAEHO CCC[C@H](C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)N(C)C ZINC000134021364 472865127 /nfs/dbraw/zinc/86/51/27/472865127.db2.gz YQNZQZWEBUTDHH-NZSAHSFTSA-N 1 3 331.504 2.886 10 0 EFAEHO C[C@@H](CNC(=O)NC1CCC(C[NH+](C)C)CC1)N1CCC(C)CC1 ZINC000121928226 472946963 /nfs/dbraw/zinc/94/69/63/472946963.db2.gz BDCMUXWATNUPKV-AOCRQIFASA-N 1 3 338.540 2.526 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000620192732 480023016 /nfs/dbraw/zinc/02/30/16/480023016.db2.gz SIEVDJOQBNWVHS-IBGZPJMESA-N 1 3 343.515 2.747 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000620192732 480023022 /nfs/dbraw/zinc/02/30/22/480023022.db2.gz SIEVDJOQBNWVHS-IBGZPJMESA-N 1 3 343.515 2.747 10 0 EFAEHO CCC[NH+]1CCC(CN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)CC1 ZINC000122806095 473060675 /nfs/dbraw/zinc/06/06/75/473060675.db2.gz OWQHXQMOUDHAJC-HNNXBMFYSA-N 1 3 338.517 2.863 10 0 EFAEHO c1ccc(OCCOCCN2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000051907783 473071911 /nfs/dbraw/zinc/07/19/11/473071911.db2.gz MMVJDZHUTYJYSF-UHFFFAOYSA-N 1 3 332.488 2.890 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCc2ccccc2C[NH+](CC)CC)C1 ZINC000052519277 473116763 /nfs/dbraw/zinc/11/67/63/473116763.db2.gz LNUUUBIEGINZLD-LJQANCHMSA-N 1 3 346.519 2.812 10 0 EFAEHO CN(CCCCc1ccccc1)CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000053082941 473181474 /nfs/dbraw/zinc/18/14/74/473181474.db2.gz HVNBHPRVNSOBJL-UHFFFAOYSA-N 1 3 343.515 2.684 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)Nc1ccc(C)s1 ZINC000075413595 473185350 /nfs/dbraw/zinc/18/53/50/473185350.db2.gz JAEAHVWMJNWAND-HNNXBMFYSA-N 1 3 338.521 2.936 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)Nc1ccc(C)s1 ZINC000075413595 473185354 /nfs/dbraw/zinc/18/53/54/473185354.db2.gz JAEAHVWMJNWAND-HNNXBMFYSA-N 1 3 338.521 2.936 10 0 EFAEHO CC[C@@H]([NH2+]C[C@H]1CCN(CC)C1)c1ccccc1OCC(=O)N(C)C ZINC000163283368 473429869 /nfs/dbraw/zinc/42/98/69/473429869.db2.gz DBQKFHYTUPHCBM-SJLPKXTDSA-N 1 3 347.503 2.536 10 0 EFAEHO Cc1nccn1-c1ccc([C@H](C)[NH2+]C[C@@H](O)CN2CCCCC2)cc1 ZINC000151296816 473438940 /nfs/dbraw/zinc/43/89/40/473438940.db2.gz GJWALEDBRXHUBA-OXJNMPFZSA-N 1 3 342.487 2.678 10 0 EFAEHO CN(C)[C@H]1CCN(C(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000170827046 473622453 /nfs/dbraw/zinc/62/24/53/473622453.db2.gz OEBLXMTZGFBCKM-IBGZPJMESA-N 1 3 344.503 2.518 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@@H](CNC(=O)CCN2CCc3ccccc3C2)C1 ZINC000616999343 480052728 /nfs/dbraw/zinc/05/27/28/480052728.db2.gz FIQPDUJWXUWYOW-KRWDZBQOSA-N 1 3 343.515 2.671 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)CCN2CCc3ccccc3C2)C1 ZINC000616999343 480052733 /nfs/dbraw/zinc/05/27/33/480052733.db2.gz FIQPDUJWXUWYOW-KRWDZBQOSA-N 1 3 343.515 2.671 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000179269796 473666163 /nfs/dbraw/zinc/66/61/63/473666163.db2.gz AEMAXYULAUDHDM-GUDVDZBRSA-N 1 3 344.503 2.558 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000179269796 473666166 /nfs/dbraw/zinc/66/61/66/473666166.db2.gz AEMAXYULAUDHDM-GUDVDZBRSA-N 1 3 344.503 2.558 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NCc2cccc(CN(C)C)c2)CC1 ZINC000172825916 473689869 /nfs/dbraw/zinc/68/98/69/473689869.db2.gz XEFBJSFHKVCGFZ-UHFFFAOYSA-N 1 3 346.519 2.669 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2[NH2+]1)N(C)Cc1ccccc1 ZINC000262681491 473711800 /nfs/dbraw/zinc/71/18/00/473711800.db2.gz XOECPJOQVJPJOR-OWYHZJEWSA-N 1 3 329.488 2.544 10 0 EFAEHO COC(=O)c1ccccc1CCN1CCC(C[NH+]2CCCC2)CC1 ZINC000186673310 473721913 /nfs/dbraw/zinc/72/19/13/473721913.db2.gz UYMHTCGHRZIPKG-UHFFFAOYSA-N 1 3 330.472 2.824 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCC[N@H+](C)C2CCCC2)[C@H]1c1ccccc1 ZINC000245624280 473729035 /nfs/dbraw/zinc/72/90/35/473729035.db2.gz FZZQGZRNPVTVEP-RTBURBONSA-N 1 3 344.503 2.605 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCC[N@@H+](C)C2CCCC2)[C@H]1c1ccccc1 ZINC000245624280 473729042 /nfs/dbraw/zinc/72/90/42/473729042.db2.gz FZZQGZRNPVTVEP-RTBURBONSA-N 1 3 344.503 2.605 10 0 EFAEHO CC(C)C[C@H](C[NH+](C)C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000245704033 473738875 /nfs/dbraw/zinc/73/88/75/473738875.db2.gz ZYJCHSAYEGGPRL-QYZOEREBSA-N 1 3 346.519 2.707 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000617007553 480058813 /nfs/dbraw/zinc/05/88/13/480058813.db2.gz VPFYFZQWJDEWKE-RBUKOAKNSA-N 1 3 343.515 2.855 10 0 EFAEHO CCc1sc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1C ZINC000617504171 480247334 /nfs/dbraw/zinc/24/73/34/480247334.db2.gz IWKSVPJUPNGIRG-AWEZNQCLSA-N 1 3 325.522 2.621 10 0 EFAEHO CCc1sc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1C ZINC000617504171 480247341 /nfs/dbraw/zinc/24/73/41/480247341.db2.gz IWKSVPJUPNGIRG-AWEZNQCLSA-N 1 3 325.522 2.621 10 0 EFAEHO CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000246183312 473794143 /nfs/dbraw/zinc/79/41/43/473794143.db2.gz LXHRYEUWWMRSBE-QYZOEREBSA-N 1 3 344.503 2.558 10 0 EFAEHO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000246183312 473794152 /nfs/dbraw/zinc/79/41/52/473794152.db2.gz LXHRYEUWWMRSBE-QYZOEREBSA-N 1 3 344.503 2.558 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CC1 ZINC000180102082 473800502 /nfs/dbraw/zinc/80/05/02/473800502.db2.gz JNGWPKDJOWNPRR-RTBURBONSA-N 1 3 329.488 2.668 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000617014833 480066121 /nfs/dbraw/zinc/06/61/21/480066121.db2.gz QOOBNKLEUCDZEB-OALUTQOASA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000617014833 480066125 /nfs/dbraw/zinc/06/61/25/480066125.db2.gz QOOBNKLEUCDZEB-OALUTQOASA-N 1 3 343.515 2.888 10 0 EFAEHO CCC(=O)N1CC[C@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000180159280 473814096 /nfs/dbraw/zinc/81/40/96/473814096.db2.gz YWUIVIFAAYUIOL-UMQXSMKFSA-N 1 3 341.499 2.783 10 0 EFAEHO CCC(=O)N1CC[C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000180159280 473814102 /nfs/dbraw/zinc/81/41/02/473814102.db2.gz YWUIVIFAAYUIOL-UMQXSMKFSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H]([NH2+]C1CCN(C2CCN(C)CC2)CC1)C1CCSCC1 ZINC000187123329 473821516 /nfs/dbraw/zinc/82/15/16/473821516.db2.gz BHLRSNDGQPKCAC-OAHLLOKOSA-N 1 3 325.566 2.666 10 0 EFAEHO COc1cc2c(cc1F)CC[C@@H]2[NH2+]C1CCN([C@@H]2CCC[C@H]2O)CC1 ZINC000281734177 473822113 /nfs/dbraw/zinc/82/21/13/473822113.db2.gz VCUNHYNKYMXALR-IPMKNSEASA-N 1 3 348.462 2.789 10 0 EFAEHO C[C@H](CNC(=O)NC1CCC(C[NH+](C)C)CC1)N1CCC[C@H](C)C1 ZINC000246338079 473832557 /nfs/dbraw/zinc/83/25/57/473832557.db2.gz UHAHAGQZKZRYJN-KNXWPPODSA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000617014831 480066523 /nfs/dbraw/zinc/06/65/23/480066523.db2.gz QOOBNKLEUCDZEB-MOPGFXCFSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000617014831 480066530 /nfs/dbraw/zinc/06/65/30/480066530.db2.gz QOOBNKLEUCDZEB-MOPGFXCFSA-N 1 3 343.515 2.888 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)N(C)C)cc1 ZINC000246511489 473886185 /nfs/dbraw/zinc/88/61/85/473886185.db2.gz XARPJSCJBFDFGW-WDSOQIARSA-N 1 3 346.519 2.722 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)N(C)C)cc1 ZINC000246511489 473886194 /nfs/dbraw/zinc/88/61/94/473886194.db2.gz XARPJSCJBFDFGW-WDSOQIARSA-N 1 3 346.519 2.722 10 0 EFAEHO CN(C)C(=O)c1cccc(C[N@@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)c1 ZINC000246535278 473892387 /nfs/dbraw/zinc/89/23/87/473892387.db2.gz JOBFQUHMZNCGNL-ICSRJNTNSA-N 1 3 341.499 2.837 10 0 EFAEHO CN(C)C(=O)c1cccc(C[N@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)c1 ZINC000246535278 473892393 /nfs/dbraw/zinc/89/23/93/473892393.db2.gz JOBFQUHMZNCGNL-ICSRJNTNSA-N 1 3 341.499 2.837 10 0 EFAEHO COC[C@@H](C)C[NH2+]CCCCN1CCN(c2cccc(C)c2)CC1 ZINC000187645686 473899116 /nfs/dbraw/zinc/89/91/16/473899116.db2.gz PDSXJVXCDSQSLR-IBGZPJMESA-N 1 3 333.520 2.769 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)CC(C)C ZINC000173688472 473914183 /nfs/dbraw/zinc/91/41/83/473914183.db2.gz ZPULGLVZUMTQGN-SQNIBIBYSA-N 1 3 340.556 2.867 10 0 EFAEHO C[N@@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000246662642 473928490 /nfs/dbraw/zinc/92/84/90/473928490.db2.gz DNIFOMYMLOATLK-PMACEKPBSA-N 1 3 341.499 2.839 10 0 EFAEHO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000246662642 473928497 /nfs/dbraw/zinc/92/84/97/473928497.db2.gz DNIFOMYMLOATLK-PMACEKPBSA-N 1 3 341.499 2.839 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)NC[C@@H](C2CCCCC2)[NH+](C)C)CCN1C ZINC000173841053 473941591 /nfs/dbraw/zinc/94/15/91/473941591.db2.gz YIFOBPALXGTNSD-NXHRZFHOSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)NCCC[N@H+](C)C2CCCCC2)CCN1C ZINC000173850511 473943211 /nfs/dbraw/zinc/94/32/11/473943211.db2.gz JHXQKHUJULHUKD-AEFFLSMTSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)NCCC[N@@H+](C)C2CCCCC2)CCN1C ZINC000173850511 473943215 /nfs/dbraw/zinc/94/32/15/473943215.db2.gz JHXQKHUJULHUKD-AEFFLSMTSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)C1 ZINC000173893846 473952646 /nfs/dbraw/zinc/95/26/46/473952646.db2.gz RQVXZHXOGXHYLY-KZNAEPCWSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)C1 ZINC000173893846 473952649 /nfs/dbraw/zinc/95/26/49/473952649.db2.gz RQVXZHXOGXHYLY-KZNAEPCWSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C(C)C ZINC000173997603 473971812 /nfs/dbraw/zinc/97/18/12/473971812.db2.gz JEIDUHSCANDFEC-KURKYZTESA-N 1 3 338.540 2.619 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000173997603 473971818 /nfs/dbraw/zinc/97/18/18/473971818.db2.gz JEIDUHSCANDFEC-KURKYZTESA-N 1 3 338.540 2.619 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)NC[C@@H]1CCC[N@@H+]1C)c1ccsc1 ZINC000195127590 474010831 /nfs/dbraw/zinc/01/08/31/474010831.db2.gz YQODDXJUORWPHV-HOTGVXAUSA-N 1 3 338.521 2.524 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)NC[C@@H]1CCC[N@H+]1C)c1ccsc1 ZINC000195127590 474010838 /nfs/dbraw/zinc/01/08/38/474010838.db2.gz YQODDXJUORWPHV-HOTGVXAUSA-N 1 3 338.521 2.524 10 0 EFAEHO CC[N@@H+]1CC[C@H](CNC(=O)c2ccc(CN3CCCCC3)cc2)C1 ZINC000264529519 474025316 /nfs/dbraw/zinc/02/53/16/474025316.db2.gz KYAVFUZYZCNVGU-GOSISDBHSA-N 1 3 329.488 2.744 10 0 EFAEHO CC[N@H+]1CC[C@H](CNC(=O)c2ccc(CN3CCCCC3)cc2)C1 ZINC000264529519 474025323 /nfs/dbraw/zinc/02/53/23/474025323.db2.gz KYAVFUZYZCNVGU-GOSISDBHSA-N 1 3 329.488 2.744 10 0 EFAEHO CCN1CC[C@@H](C[NH2+][C@H](C)c2ccc(OCCOC)c(OC)c2)C1 ZINC000246989207 474026925 /nfs/dbraw/zinc/02/69/25/474026925.db2.gz KDBRPCMQMGYNPU-CVEARBPZSA-N 1 3 336.476 2.713 10 0 EFAEHO CN1CC[C@H](NC(=O)NCC2([NH+](C)C)CCCC2)[C@@H]1c1ccccc1 ZINC000270330506 474076172 /nfs/dbraw/zinc/07/61/72/474076172.db2.gz HVQRKVNWDUFMRZ-ROUUACIJSA-N 1 3 344.503 2.605 10 0 EFAEHO CCC[NH+](CCC)CCCNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000174680860 474078256 /nfs/dbraw/zinc/07/82/56/474078256.db2.gz LVUDSMKRDDTLPV-SJORKVTESA-N 1 3 326.529 2.623 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)C2C[C@H](c3ccccc3)OC2=O)CC1 ZINC000289074557 474140399 /nfs/dbraw/zinc/14/03/99/474140399.db2.gz AMIVKSKMFAYGMF-ZWKOTPCHSA-N 1 3 344.455 2.529 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2ccccc2CCN(C)C)[C@H](C)C1 ZINC000275611560 474252343 /nfs/dbraw/zinc/25/23/43/474252343.db2.gz IGUGDNOFSLNINJ-VQIMIIECSA-N 1 3 346.519 2.985 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccccc2CCN(C)C)[C@H](C)C1 ZINC000275611560 474252352 /nfs/dbraw/zinc/25/23/52/474252352.db2.gz IGUGDNOFSLNINJ-VQIMIIECSA-N 1 3 346.519 2.985 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000175635125 474270897 /nfs/dbraw/zinc/27/08/97/474270897.db2.gz VIOXROXWWDFNCL-KRWDZBQOSA-N 1 3 338.540 2.669 10 0 EFAEHO C[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000248165751 474274320 /nfs/dbraw/zinc/27/43/20/474274320.db2.gz ZSLSOKYNNYSTII-VQTJNVASSA-N 1 3 341.499 2.981 10 0 EFAEHO C[N@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000248165751 474274329 /nfs/dbraw/zinc/27/43/29/474274329.db2.gz ZSLSOKYNNYSTII-VQTJNVASSA-N 1 3 341.499 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000248186665 474279118 /nfs/dbraw/zinc/27/91/18/474279118.db2.gz XLMSFYPVYILFJH-VQTJNVASSA-N 1 3 343.515 2.840 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000248186665 474279123 /nfs/dbraw/zinc/27/91/23/474279123.db2.gz XLMSFYPVYILFJH-VQTJNVASSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)Nc2ccccc2CCN(C)C)CC[N@@H+]1C ZINC000275725327 474296211 /nfs/dbraw/zinc/29/62/11/474296211.db2.gz WOLLECYRIRBHFH-DOTOQJQBSA-N 1 3 332.492 2.737 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)Nc2ccccc2CCN(C)C)CC[N@H+]1C ZINC000275725327 474296219 /nfs/dbraw/zinc/29/62/19/474296219.db2.gz WOLLECYRIRBHFH-DOTOQJQBSA-N 1 3 332.492 2.737 10 0 EFAEHO CN(C)C(=O)CCC[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000248409017 474312677 /nfs/dbraw/zinc/31/26/77/474312677.db2.gz WDOVPBFOUPCHCR-XUVXKRRUSA-N 1 3 343.515 2.745 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3[NH2+]2)N(C)C)cc1 ZINC000237144328 474345389 /nfs/dbraw/zinc/34/53/89/474345389.db2.gz PYWCESXFKCNVOT-VJANTYMQSA-N 1 3 329.488 2.635 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)C2CCN(Cc3ccccc3)CC2)CC[N@@H+]1C ZINC000265915172 474383793 /nfs/dbraw/zinc/38/37/93/474383793.db2.gz AJQSERUCNZSYIB-FXAWDEMLSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)C2CCN(Cc3ccccc3)CC2)CC[N@H+]1C ZINC000265915172 474383798 /nfs/dbraw/zinc/38/37/98/474383798.db2.gz AJQSERUCNZSYIB-FXAWDEMLSA-N 1 3 343.515 2.840 10 0 EFAEHO CN(c1ccccc1C[N@H+](C)[C@H]1CC[C@H](O)CC1)C1CCN(C)CC1 ZINC000276111235 474420511 /nfs/dbraw/zinc/42/05/11/474420511.db2.gz XMHICXVBKAGTGW-KESTWPANSA-N 1 3 345.531 2.952 10 0 EFAEHO CN(c1ccccc1C[N@@H+](C)[C@H]1CC[C@H](O)CC1)C1CCN(C)CC1 ZINC000276111235 474420515 /nfs/dbraw/zinc/42/05/15/474420515.db2.gz XMHICXVBKAGTGW-KESTWPANSA-N 1 3 345.531 2.952 10 0 EFAEHO CN(CC1([NH+](C)C)CCC1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000189523309 474430663 /nfs/dbraw/zinc/43/06/63/474430663.db2.gz ULLZADIPQQBPLJ-UHFFFAOYSA-N 1 3 329.488 2.839 10 0 EFAEHO CN(CC[N@H+](C)C1CCN(C)CC1)Cc1cnc(-c2ccccc2)[nH]1 ZINC000289802301 474434135 /nfs/dbraw/zinc/43/41/35/474434135.db2.gz MVPTVVVJULMULO-UHFFFAOYSA-N 1 3 341.503 2.535 10 0 EFAEHO CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1cnc(-c2ccccc2)[nH]1 ZINC000289802301 474434140 /nfs/dbraw/zinc/43/41/40/474434140.db2.gz MVPTVVVJULMULO-UHFFFAOYSA-N 1 3 341.503 2.535 10 0 EFAEHO CN(CCN(C)C1CC[NH+](C)CC1)Cc1c[nH]c(-c2ccccc2)n1 ZINC000289802301 474434148 /nfs/dbraw/zinc/43/41/48/474434148.db2.gz MVPTVVVJULMULO-UHFFFAOYSA-N 1 3 341.503 2.535 10 0 EFAEHO Cc1nnc(CCN[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000289830057 474445501 /nfs/dbraw/zinc/44/55/01/474445501.db2.gz PJPLSGLYWOUIJJ-YOEHRIQHSA-N 1 3 330.501 2.889 10 0 EFAEHO Cc1nnc(CCN[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000289830057 474445509 /nfs/dbraw/zinc/44/55/09/474445509.db2.gz PJPLSGLYWOUIJJ-YOEHRIQHSA-N 1 3 330.501 2.889 10 0 EFAEHO CCN1CCC[C@H]1CN(C)C(=O)NCCC[NH+](C(C)C)C(C)C ZINC000176435167 474473767 /nfs/dbraw/zinc/47/37/67/474473767.db2.gz JPYKQSOKIKGOFM-KRWDZBQOSA-N 1 3 326.529 2.621 10 0 EFAEHO Cc1cncc([C@H](C)[NH2+]CC2(N3CCCCC3)CCN(C)CC2)c1 ZINC000184370012 474506655 /nfs/dbraw/zinc/50/66/55/474506655.db2.gz PDIVLWJMSDOQFS-SFHVURJKSA-N 1 3 330.520 2.991 10 0 EFAEHO COc1cccc(N2CCC[C@H](NC3C[C@H]4CC[C@@H](C3)[N@H+]4C)C2)c1 ZINC000249046297 474510224 /nfs/dbraw/zinc/51/02/24/474510224.db2.gz WGLUQIGSQONGBT-OOKSDGMUSA-N 1 3 329.488 2.879 10 0 EFAEHO COc1cccc(N2CCC[C@H](NC3C[C@H]4CC[C@@H](C3)[N@@H+]4C)C2)c1 ZINC000249046297 474510228 /nfs/dbraw/zinc/51/02/28/474510228.db2.gz WGLUQIGSQONGBT-OOKSDGMUSA-N 1 3 329.488 2.879 10 0 EFAEHO C[C@@H]1CC[C@H](C[N@H+](C)CC2CCN(C[C@@H](O)c3ccccc3)CC2)O1 ZINC000249102600 474526336 /nfs/dbraw/zinc/52/63/36/474526336.db2.gz PTZSFXYCCDTXQJ-DUXKGJEZSA-N 1 3 346.515 2.931 10 0 EFAEHO C[C@@H]1CC[C@H](C[N@@H+](C)CC2CCN(C[C@@H](O)c3ccccc3)CC2)O1 ZINC000249102600 474526340 /nfs/dbraw/zinc/52/63/40/474526340.db2.gz PTZSFXYCCDTXQJ-DUXKGJEZSA-N 1 3 346.515 2.931 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1N[C@H]1CC(=O)N(C(C)(C)C)C1 ZINC000271430585 474542589 /nfs/dbraw/zinc/54/25/89/474542589.db2.gz BVDBUTLPELHLMY-NEWSRXKRSA-N 1 3 343.515 2.886 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1N[C@H]1CC(=O)N(C(C)(C)C)C1 ZINC000271430585 474542595 /nfs/dbraw/zinc/54/25/95/474542595.db2.gz BVDBUTLPELHLMY-NEWSRXKRSA-N 1 3 343.515 2.886 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1[NH2+]CC(=O)NC(C)(C)C ZINC000184752499 474600976 /nfs/dbraw/zinc/60/09/76/474600976.db2.gz FDOCXLYTSBPJAW-HZPDHXFCSA-N 1 3 331.504 2.647 10 0 EFAEHO C[C@H](NC(=O)CC1CCN(C)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000291623199 474634234 /nfs/dbraw/zinc/63/42/34/474634234.db2.gz HBUSCFQYXBFKAD-FXAWDEMLSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@H](NC(=O)CC1CCN(C)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000291623199 474634238 /nfs/dbraw/zinc/63/42/38/474634238.db2.gz HBUSCFQYXBFKAD-FXAWDEMLSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@@H]1C[N@H+](C[C@H]2CCCO2)CC[C@@H]1NCc1cccc2c[nH]nc21 ZINC000252477923 474664664 /nfs/dbraw/zinc/66/46/64/474664664.db2.gz XUZTXJJJPVTKBR-OLMNPRSZSA-N 1 3 328.460 2.542 10 0 EFAEHO C[C@@H]1C[N@@H+](C[C@H]2CCCO2)CC[C@@H]1NCc1cccc2c[nH]nc21 ZINC000252477923 474664667 /nfs/dbraw/zinc/66/46/67/474664667.db2.gz XUZTXJJJPVTKBR-OLMNPRSZSA-N 1 3 328.460 2.542 10 0 EFAEHO CC[NH+](CC)[C@@H](CNC(=O)CC1CCN(C)CC1)Cc1ccccc1 ZINC000273204417 474775916 /nfs/dbraw/zinc/77/59/16/474775916.db2.gz KIQOVPUQHNYOEK-HXUWFJFHSA-N 1 3 345.531 2.788 10 0 EFAEHO COCCN1CC[C@@H](Nc2ccc(OCC[N@@H+]3CC[C@@H](C)C3)cc2)C1 ZINC000273248433 474801580 /nfs/dbraw/zinc/80/15/80/474801580.db2.gz ZZLUSUQZYDFDAA-IEBWSBKVSA-N 1 3 347.503 2.540 10 0 EFAEHO COCCN1CC[C@@H](Nc2ccc(OCC[N@H+]3CC[C@@H](C)C3)cc2)C1 ZINC000273248433 474801589 /nfs/dbraw/zinc/80/15/89/474801589.db2.gz ZZLUSUQZYDFDAA-IEBWSBKVSA-N 1 3 347.503 2.540 10 0 EFAEHO CC1CC[NH+](CCCCNCc2cnnn2Cc2ccccc2)CC1 ZINC000292021032 474805715 /nfs/dbraw/zinc/80/57/15/474805715.db2.gz XAHMZFGPQNRIKL-UHFFFAOYSA-N 1 3 341.503 2.928 10 0 EFAEHO CN(C(=O)C1CCC([NH3+])CC1)C1CCN(Cc2ccccc2)CC1 ZINC000310441083 474826018 /nfs/dbraw/zinc/82/60/18/474826018.db2.gz SKFIKXJYSZNQDT-UHFFFAOYSA-N 1 3 329.488 2.627 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+][C@@H]2CCN(C)C(C)(C)C2)[C@H](C)C1 ZINC000623420600 480276347 /nfs/dbraw/zinc/27/63/47/480276347.db2.gz IIYOWLCKNDWCSQ-KURKYZTESA-N 1 3 325.541 2.586 10 0 EFAEHO CC[NH+](CC)CCOc1ccc(C(=O)N2CCC[C@@H]2CN(C)C)cc1 ZINC000268236823 474878464 /nfs/dbraw/zinc/87/84/64/474878464.db2.gz YXZMBEUOYXFSDF-GOSISDBHSA-N 1 3 347.503 2.573 10 0 EFAEHO CN1CC[C@]2(CC[N@H+](CCOc3cccc(Br)c3)C2)C1 ZINC000292181719 474891076 /nfs/dbraw/zinc/89/10/76/474891076.db2.gz QQAJGEKEFJBSBR-INIZCTEOSA-N 1 3 339.277 2.856 10 0 EFAEHO CN1CC[C@]2(CC[N@@H+](CCOc3cccc(Br)c3)C2)C1 ZINC000292181719 474891081 /nfs/dbraw/zinc/89/10/81/474891081.db2.gz QQAJGEKEFJBSBR-INIZCTEOSA-N 1 3 339.277 2.856 10 0 EFAEHO CN1CC[C@]2(CC[N@H+](CCc3nc(-c4cccc(Cl)c4)no3)C2)C1 ZINC000292264734 474931878 /nfs/dbraw/zinc/93/18/78/474931878.db2.gz YXMYTDXUAKIYOH-SFHVURJKSA-N 1 3 346.862 2.960 10 0 EFAEHO CN1CC[C@]2(CC[N@@H+](CCc3nc(-c4cccc(Cl)c4)no3)C2)C1 ZINC000292264734 474931881 /nfs/dbraw/zinc/93/18/81/474931881.db2.gz YXMYTDXUAKIYOH-SFHVURJKSA-N 1 3 346.862 2.960 10 0 EFAEHO C[C@H](CN(C)CC(=O)NC1CC[NH+](C2CC2)CC1)C1CCCCC1 ZINC000625987695 480134934 /nfs/dbraw/zinc/13/49/34/480134934.db2.gz YRWDSTACLIRGHV-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H]1CCC[C@H](C)[NH+]1CCNC(=O)NCc1cccc(CN(C)C)c1 ZINC000341086999 474960562 /nfs/dbraw/zinc/96/05/62/474960562.db2.gz GAJVINWJKZOMEL-IRXDYDNUSA-N 1 3 346.519 2.810 10 0 EFAEHO CCN1CCN([C@H](C)C[NH2+][C@@H](C)c2cnn(C3CCCC3)c2)CC1 ZINC000337408661 474985592 /nfs/dbraw/zinc/98/55/92/474985592.db2.gz UQVCNSISRDTJGL-SJORKVTESA-N 1 3 333.524 2.675 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)N(C)CC[C@H]1CCCC[N@@H+]1C ZINC000341117015 474992542 /nfs/dbraw/zinc/99/25/42/474992542.db2.gz HBCLTICZSWHMDC-FGTMMUONSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000341117015 474992548 /nfs/dbraw/zinc/99/25/48/474992548.db2.gz HBCLTICZSWHMDC-FGTMMUONSA-N 1 3 338.540 2.765 10 0 EFAEHO CN(C)Cc1cccc(C(=O)Nc2ccc3c(c2F)CC[NH2+]C3)c1 ZINC000261722292 475038199 /nfs/dbraw/zinc/03/81/99/475038199.db2.gz LPNCBCZGTAPUHA-UHFFFAOYSA-N 1 3 327.403 2.785 10 0 EFAEHO C[C@@H](C(=O)Nc1ccc2c(c1F)CC[NH2+]C2)[C@@H](N)c1ccccc1 ZINC000261746547 475048291 /nfs/dbraw/zinc/04/82/91/475048291.db2.gz ORVPBWGMPLZIRH-KZULUSFZSA-N 1 3 327.403 2.746 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCCN(C)CC(F)(F)F ZINC000268961059 475097531 /nfs/dbraw/zinc/09/75/31/475097531.db2.gz XHANIUNYPTWFBM-WBVHZDCISA-N 1 3 343.437 2.981 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCCN(C)CC(F)(F)F ZINC000268961059 475097539 /nfs/dbraw/zinc/09/75/39/475097539.db2.gz XHANIUNYPTWFBM-WBVHZDCISA-N 1 3 343.437 2.981 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)N1CCC[C@H]1C[NH+]1CCCC1 ZINC000341564693 475147865 /nfs/dbraw/zinc/14/78/65/475147865.db2.gz YMZOSXBDDWQXJE-KSZLIROESA-N 1 3 336.524 2.519 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)CCc1ccc(C)cc1 ZINC000337579334 475149232 /nfs/dbraw/zinc/14/92/32/475149232.db2.gz MFMWPZLZQGARBY-FQEVSTJZSA-N 1 3 345.531 2.802 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)CCc1ccc(C)cc1 ZINC000337579334 475149237 /nfs/dbraw/zinc/14/92/37/475149237.db2.gz MFMWPZLZQGARBY-FQEVSTJZSA-N 1 3 345.531 2.802 10 0 EFAEHO c1ccc(OC2CCC2)c(CN[C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)c1 ZINC000262029052 475149919 /nfs/dbraw/zinc/14/99/19/475149919.db2.gz XHSRKNPZKRLXND-IPMKNSEASA-N 1 3 330.472 2.865 10 0 EFAEHO C[NH2+]CCC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000262315214 475218945 /nfs/dbraw/zinc/21/89/45/475218945.db2.gz DHQVJZZGBFJXLE-UHFFFAOYSA-N 1 3 339.483 2.757 10 0 EFAEHO C[C@@H]1CCC[C@@](CNC(=O)NCCN2CCCC[C@H]2C)([NH+](C)C)C1 ZINC000339449789 475223269 /nfs/dbraw/zinc/22/32/69/475223269.db2.gz UATOCKOTGIILGU-ZHALLVOQSA-N 1 3 338.540 2.671 10 0 EFAEHO COC[C@@H](C)[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000339490098 475252586 /nfs/dbraw/zinc/25/25/86/475252586.db2.gz WMPYVFQVSXZFDE-IEBWSBKVSA-N 1 3 332.488 2.540 10 0 EFAEHO COC[C@@H](C)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339490098 475252592 /nfs/dbraw/zinc/25/25/92/475252592.db2.gz WMPYVFQVSXZFDE-IEBWSBKVSA-N 1 3 332.488 2.540 10 0 EFAEHO COC[C@@H](C)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339490098 475252601 /nfs/dbraw/zinc/25/26/01/475252601.db2.gz WMPYVFQVSXZFDE-IEBWSBKVSA-N 1 3 332.488 2.540 10 0 EFAEHO C[C@@H]1OCC[C@@H]1[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000339491653 475252854 /nfs/dbraw/zinc/25/28/54/475252854.db2.gz BOWBFNGTIHOKOG-IHPCNDPISA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1OCC[C@@H]1NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339491653 475252858 /nfs/dbraw/zinc/25/28/58/475252858.db2.gz BOWBFNGTIHOKOG-IHPCNDPISA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1OCC[C@@H]1NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339491653 475252866 /nfs/dbraw/zinc/25/28/66/475252866.db2.gz BOWBFNGTIHOKOG-IHPCNDPISA-N 1 3 344.499 2.682 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@]2(O)CCC[C@@H]2C)CC1 ZINC000339554263 475303084 /nfs/dbraw/zinc/30/30/84/475303084.db2.gz BYZLKNLSEKRKKM-GHTZIAJQSA-N 1 3 345.531 2.859 10 0 EFAEHO CC[C@@H](NC1CC[NH+](CCC(=O)N(C)C)CC1)c1cccc(OC)c1 ZINC000361354908 475382639 /nfs/dbraw/zinc/38/26/39/475382639.db2.gz YPWQMLXRUBAEOW-LJQANCHMSA-N 1 3 347.503 2.679 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCCOC(F)F)CC1 ZINC000337871168 475395739 /nfs/dbraw/zinc/39/57/39/475395739.db2.gz RETWQNQCZCOWKE-UHFFFAOYSA-N 1 3 341.446 2.938 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCNC(=O)c1ccc(Nc2ccncc2)cc1 ZINC000345814457 475474743 /nfs/dbraw/zinc/47/47/43/475474743.db2.gz KKGFWVJZQKRSCE-MRXNPFEDSA-N 1 3 338.455 2.851 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc(Nc2ccncc2)cc1 ZINC000345814457 475474757 /nfs/dbraw/zinc/47/47/57/475474757.db2.gz KKGFWVJZQKRSCE-MRXNPFEDSA-N 1 3 338.455 2.851 10 0 EFAEHO CN(C)CCNC(=O)c1cccc(C[NH2+][C@H]2CC[C@H]2C2CCC2)c1 ZINC000337992929 475489206 /nfs/dbraw/zinc/48/92/06/475489206.db2.gz RJRGOIZHSXMVRE-OALUTQOASA-N 1 3 329.488 2.646 10 0 EFAEHO CC[NH+](CC)CC1CCN(Cc2ccc(N(C)CCOC)nc2)CC1 ZINC000361508893 475507318 /nfs/dbraw/zinc/50/73/18/475507318.db2.gz QVWRVBKQLYVNNF-UHFFFAOYSA-N 1 3 348.535 2.718 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)NCC(C)(C)C[NH+]1CCCC1 ZINC000358240088 475519230 /nfs/dbraw/zinc/51/92/30/475519230.db2.gz SUXZCQSAOZPWOP-CALCHBBNSA-N 1 3 338.540 2.671 10 0 EFAEHO CN(C(=O)CC[C@@H]1CCCC[N@@H+]1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000354930741 475531432 /nfs/dbraw/zinc/53/14/32/475531432.db2.gz NORAOGYURPCGKA-PMACEKPBSA-N 1 3 343.515 2.984 10 0 EFAEHO CN(C(=O)CC[C@@H]1CCCC[N@H+]1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000354930741 475531441 /nfs/dbraw/zinc/53/14/41/475531441.db2.gz NORAOGYURPCGKA-PMACEKPBSA-N 1 3 343.515 2.984 10 0 EFAEHO C[C@H]1C[C@@H](C[NH+]2CCN(CCN(C)Cc3ccccc3)CC2)CCO1 ZINC000352711333 475553071 /nfs/dbraw/zinc/55/30/71/475553071.db2.gz AWIPAGUEIPXEIM-FPOVZHCZSA-N 1 3 345.531 2.551 10 0 EFAEHO COc1cc([C@H](C)[NH2+]C2CCN([C@H]3CCC[C@H]3O)CC2)ccc1F ZINC000358301336 475573085 /nfs/dbraw/zinc/57/30/85/475573085.db2.gz PGQSLUMAQRDWEG-DOPJRALCSA-N 1 3 336.451 2.863 10 0 EFAEHO CC[NH+](CC)CCN(Cc1ccccc1)C(=O)NC[C@@H]1CCCN1C ZINC000339936641 475624410 /nfs/dbraw/zinc/62/44/10/475624410.db2.gz DYPBNLJUGDOKTJ-IBGZPJMESA-N 1 3 346.519 2.634 10 0 EFAEHO C[C@@H](CNC(=O)NCC[N@@H+]1CCCC[C@H]1C)N(C)Cc1ccccc1 ZINC000348377662 475628849 /nfs/dbraw/zinc/62/88/49/475628849.db2.gz FIIWCOIXTGQACK-MSOLQXFVSA-N 1 3 346.519 2.681 10 0 EFAEHO C[C@@H](CNC(=O)NCC[N@H+]1CCCC[C@H]1C)N(C)Cc1ccccc1 ZINC000348377662 475628858 /nfs/dbraw/zinc/62/88/58/475628858.db2.gz FIIWCOIXTGQACK-MSOLQXFVSA-N 1 3 346.519 2.681 10 0 EFAEHO C[C@H](CNC(=O)NCC[N@@H+]1CCCC[C@H]1C)N(C)Cc1ccccc1 ZINC000348377663 475630162 /nfs/dbraw/zinc/63/01/62/475630162.db2.gz FIIWCOIXTGQACK-QZTJIDSGSA-N 1 3 346.519 2.681 10 0 EFAEHO C[C@H](CNC(=O)NCC[N@H+]1CCCC[C@H]1C)N(C)Cc1ccccc1 ZINC000348377663 475630168 /nfs/dbraw/zinc/63/01/68/475630168.db2.gz FIIWCOIXTGQACK-QZTJIDSGSA-N 1 3 346.519 2.681 10 0 EFAEHO CN(C)CCNC(=O)c1ccc(C[NH2+][C@H]2CC[C@H]2C(C)(C)C)cc1 ZINC000348396026 475638547 /nfs/dbraw/zinc/63/85/47/475638547.db2.gz MGQFDEYOOKXVNG-MSOLQXFVSA-N 1 3 331.504 2.892 10 0 EFAEHO CC1=CCN(CCNC(=O)N[C@H](C)[C@@H](c2ccccc2)[NH+](C)C)CC1 ZINC000355079837 475650615 /nfs/dbraw/zinc/65/06/15/475650615.db2.gz QNQPUKHXJFOHCR-MJGOQNOKSA-N 1 3 344.503 2.629 10 0 EFAEHO COC[C@@H](CC(C)C)[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000361698687 475674924 /nfs/dbraw/zinc/67/49/24/475674924.db2.gz KCZNIVWPTNWGMO-GOSISDBHSA-N 1 3 325.541 2.587 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@@H]2C)C[C@H]1C ZINC000361775911 475742122 /nfs/dbraw/zinc/74/21/22/475742122.db2.gz YIMOWXHLLNCEPZ-XDNAFOTISA-N 1 3 338.540 2.764 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@@H]2C)C[C@H]1C ZINC000361775911 475742128 /nfs/dbraw/zinc/74/21/28/475742128.db2.gz YIMOWXHLLNCEPZ-XDNAFOTISA-N 1 3 338.540 2.764 10 0 EFAEHO CN1CC[C@@H](NC(=O)CC[C@H]2CCCC[N@@H+]2C)[C@@H]1c1ccccc1 ZINC000355243416 475772761 /nfs/dbraw/zinc/77/27/61/475772761.db2.gz STERXLQTEOAMBG-GGPKGHCWSA-N 1 3 329.488 2.813 10 0 EFAEHO CN1CC[C@@H](NC(=O)CC[C@H]2CCCC[N@H+]2C)[C@@H]1c1ccccc1 ZINC000355243416 475772769 /nfs/dbraw/zinc/77/27/69/475772769.db2.gz STERXLQTEOAMBG-GGPKGHCWSA-N 1 3 329.488 2.813 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H](C)Cn2cccn2)CC1 ZINC000358593398 475793968 /nfs/dbraw/zinc/79/39/68/475793968.db2.gz CJNBFMMEXNWXTA-GOSISDBHSA-N 1 3 341.503 2.593 10 0 EFAEHO COc1cccc(CC[NH2+][C@@H](C)c2ccc(OCCN(C)C)cc2)n1 ZINC000361922608 475869877 /nfs/dbraw/zinc/86/98/77/475869877.db2.gz ATHJZOBJONCPIF-INIZCTEOSA-N 1 3 343.471 2.924 10 0 EFAEHO O=C(CN[C@H](c1ccccc1)C1CCC1)NC1CC[NH+](C2CC2)CC1 ZINC000355395916 475900763 /nfs/dbraw/zinc/90/07/63/475900763.db2.gz WNUSNOLNKNNSPT-OAQYLSRUSA-N 1 3 341.499 2.860 10 0 EFAEHO CN1CC[C@H]([NH2+]CC2CCN(c3ccncc3)CC2)[C@@H]2CCC[C@H]21 ZINC000353397118 475934597 /nfs/dbraw/zinc/93/45/97/475934597.db2.gz WBKIGNGBOANFOO-SLFFLAALSA-N 1 3 328.504 2.760 10 0 EFAEHO CN1CCC(CC(=O)Nc2ccc3ccn(CC[NH+](C)C)c3c2)CC1 ZINC000346959070 475990713 /nfs/dbraw/zinc/99/07/13/475990713.db2.gz FLWUAFNRYYMMCU-UHFFFAOYSA-N 1 3 342.487 2.873 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000343546200 476084460 /nfs/dbraw/zinc/08/44/60/476084460.db2.gz PIPDKNBYGZRAGB-OALUTQOASA-N 1 3 335.536 2.975 10 0 EFAEHO CN1CC[C@H]([NH2+]CCOc2ccc(C(F)(F)F)cn2)[C@H]2CCC[C@H]21 ZINC000353647713 476155033 /nfs/dbraw/zinc/15/50/33/476155033.db2.gz SEMIXBAXCWZRQS-QLFBSQMISA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCOc2ccc(C(F)(F)F)cn2)[C@H]2CCC[C@H]21 ZINC000353647713 476155038 /nfs/dbraw/zinc/15/50/38/476155038.db2.gz SEMIXBAXCWZRQS-QLFBSQMISA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@H+]1CC[C@H](NCCOc2ccc(C(F)(F)F)cn2)[C@H]2CCC[C@H]21 ZINC000353647713 476155042 /nfs/dbraw/zinc/15/50/42/476155042.db2.gz SEMIXBAXCWZRQS-QLFBSQMISA-N 1 3 343.393 2.942 10 0 EFAEHO CC(C)C[C@H](N[C@H]1CCSc2ccccc21)C(=O)NCC[NH+](C)C ZINC000347230713 476187628 /nfs/dbraw/zinc/18/76/28/476187628.db2.gz OJMFPWHNTOWKGL-IRXDYDNUSA-N 1 3 349.544 2.906 10 0 EFAEHO CC1CCC(N2CCN(C(=O)CC[C@@H]3CCCC[N@@H+]3C)CC2)CC1 ZINC000353815313 476286287 /nfs/dbraw/zinc/28/62/87/476286287.db2.gz NDIQZSIPINXSBF-XBMUEBEBSA-N 1 3 335.536 2.974 10 0 EFAEHO CC1CCC(N2CCN(C(=O)CC[C@@H]3CCCC[N@H+]3C)CC2)CC1 ZINC000353815313 476286290 /nfs/dbraw/zinc/28/62/90/476286290.db2.gz NDIQZSIPINXSBF-XBMUEBEBSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000362532663 476299657 /nfs/dbraw/zinc/29/96/57/476299657.db2.gz YCKCYKPRSBNWNI-PMACEKPBSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000362532663 476299662 /nfs/dbraw/zinc/29/96/62/476299662.db2.gz YCKCYKPRSBNWNI-PMACEKPBSA-N 1 3 343.515 2.841 10 0 EFAEHO CC[NH+]1CCC(N(C)C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000357296193 476319643 /nfs/dbraw/zinc/31/96/43/476319643.db2.gz KULCASVAUSGBDT-UHFFFAOYSA-N 1 3 329.488 2.839 10 0 EFAEHO Cc1ccncc1CCC[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000377659565 476503751 /nfs/dbraw/zinc/50/37/51/476503751.db2.gz NWWPKAFWXGGJKS-UHFFFAOYSA-N 1 3 344.547 2.863 10 0 EFAEHO Cn1c2ccc(CN3CC[C@@H](C4CC[NH+](C)CC4)C3)cc2sc1=O ZINC000377883930 476628185 /nfs/dbraw/zinc/62/81/85/476628185.db2.gz LMDSGEWYJSLYRV-MRXNPFEDSA-N 1 3 345.512 2.764 10 0 EFAEHO CCCC[N@H+](C)C[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000357871108 476661621 /nfs/dbraw/zinc/66/16/21/476661621.db2.gz NELRGZWITHODIA-QXAKKESOSA-N 1 3 346.519 2.851 10 0 EFAEHO CCCC[N@@H+](C)C[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000357871108 476661627 /nfs/dbraw/zinc/66/16/27/476661627.db2.gz NELRGZWITHODIA-QXAKKESOSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@H](CCN1CCC[C@@]2(CCOC2)C1)[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000451904857 476713523 /nfs/dbraw/zinc/71/35/23/476713523.db2.gz RGJYXYLMMGLRFP-AQNXPRMDSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CCN1CCC[C@@]2(CCOC2)C1)[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000451904857 476713531 /nfs/dbraw/zinc/71/35/31/476713531.db2.gz RGJYXYLMMGLRFP-AQNXPRMDSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@@H+]1CCC[C@@]2(CCOC2)C1)N1CCC[C@]2(CCOC2)C1 ZINC000451904857 476713536 /nfs/dbraw/zinc/71/35/36/476713536.db2.gz RGJYXYLMMGLRFP-AQNXPRMDSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@H+]1CCC[C@@]2(CCOC2)C1)N1CCC[C@]2(CCOC2)C1 ZINC000451904857 476713544 /nfs/dbraw/zinc/71/35/44/476713544.db2.gz RGJYXYLMMGLRFP-AQNXPRMDSA-N 1 3 336.520 2.770 10 0 EFAEHO O=C(C[C@H]1CCC[NH2+]C1)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000379663852 476730411 /nfs/dbraw/zinc/73/04/11/476730411.db2.gz MTBPIQWWAQAKDK-RTBURBONSA-N 1 3 329.488 2.547 10 0 EFAEHO O=C(CC[C@@H]1CCC[NH2+]C1)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000379665542 476730993 /nfs/dbraw/zinc/73/09/93/476730993.db2.gz TUGVLKVULGKIGW-ICSRJNTNSA-N 1 3 343.515 2.937 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)C2CCC([NH3+])CC2)CCN1Cc1ccccc1 ZINC000379680712 476731723 /nfs/dbraw/zinc/73/17/23/476731723.db2.gz NSVJEKWFPYEJNL-HJZRJOMTSA-N 1 3 329.488 2.673 10 0 EFAEHO [NH3+]C[C@H]1CCCC[C@H]1NCc1cccc(COC2CCOCC2)c1 ZINC000422716564 476741015 /nfs/dbraw/zinc/74/10/15/476741015.db2.gz UJSROLHXZHMGIA-UYAOXDASSA-N 1 3 332.488 2.989 10 0 EFAEHO [NH3+]C[C@@H]1CCCC[C@@H]1NCc1cccc(COC2CCOCC2)c1 ZINC000422716560 476741730 /nfs/dbraw/zinc/74/17/30/476741730.db2.gz UJSROLHXZHMGIA-ICSRJNTNSA-N 1 3 332.488 2.989 10 0 EFAEHO NC[C@@H]1CCCC[C@@H]1[NH2+]CC1CCN(C(=O)c2ccccc2)CC1 ZINC000422770280 476769960 /nfs/dbraw/zinc/76/99/60/476769960.db2.gz UUDKWLOJPXWUDO-OALUTQOASA-N 1 3 329.488 2.646 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@@H](C)c1cnn(-c2ccc(F)cc2)c1C ZINC000422788552 476775748 /nfs/dbraw/zinc/77/57/48/476775748.db2.gz SJPRXMSKJHQVTO-XJKSGUPXSA-N 1 3 334.439 2.724 10 0 EFAEHO Cc1nc(CCN[C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cs1 ZINC000422816045 476790004 /nfs/dbraw/zinc/79/00/04/476790004.db2.gz DBGROWCFYPKCNY-WMZOPIPTSA-N 1 3 329.469 2.840 10 0 EFAEHO O=C(c1ccco1)N1CCC([NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCCN2)CC1 ZINC000422817069 476791589 /nfs/dbraw/zinc/79/15/89/476791589.db2.gz GOCGQEWRQANCJJ-KZNAEPCWSA-N 1 3 345.487 2.785 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CCc1ccc(-n2cccn2)cc1 ZINC000422822450 476795575 /nfs/dbraw/zinc/79/55/75/476795575.db2.gz KBAHELRNERFYNQ-HNNXBMFYSA-N 1 3 335.455 2.928 10 0 EFAEHO c1ccc(COCCCCN[C@@H]2CCOC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000422830808 476798689 /nfs/dbraw/zinc/79/86/89/476798689.db2.gz DBNXZLUUGFXTJI-VAMGGRTRSA-N 1 3 332.488 2.730 10 0 EFAEHO COc1ccc([C@H](N[C@@H]2C[C@@H](C)N(C3CC3)C2)[C@@H]2CCC[NH2+]2)cc1 ZINC000422861052 476815044 /nfs/dbraw/zinc/81/50/44/476815044.db2.gz IWBFPHMJLVWQBT-NLCWTHGUSA-N 1 3 329.488 2.703 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@@H](CN[C@H](C)[C@@H]3CCCC[NH2+]3)C2)c1 ZINC000422874622 476822010 /nfs/dbraw/zinc/82/20/10/476822010.db2.gz NXTUMWHODXEUMK-GUXCAODWSA-N 1 3 347.503 2.650 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCN(c2ncccc2Cl)C1 ZINC000422872037 476822470 /nfs/dbraw/zinc/82/24/70/476822470.db2.gz FJUXFBUGTWCAMA-ZFWWWQNUSA-N 1 3 345.878 2.827 10 0 EFAEHO C[C@@H]([NH2+]CC1=CCN(C)CC1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000392273232 476823633 /nfs/dbraw/zinc/82/36/33/476823633.db2.gz WPTFTUNOSCJFPS-NVXWUHKLSA-N 1 3 337.508 2.874 10 0 EFAEHO COc1ccc(CCN[C@@H]2CCOC[C@H]2[C@@H]2CCC[NH2+]2)c(Cl)c1 ZINC000422892425 476830375 /nfs/dbraw/zinc/83/03/75/476830375.db2.gz YNBDIFNRDRPYEG-RYQLBKOJSA-N 1 3 338.879 2.638 10 0 EFAEHO CCN1CCCC[C@@H]1CN[C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422903950 476840284 /nfs/dbraw/zinc/84/02/84/476840284.db2.gz GDAGLKMCFAOVOJ-IMFGXOCKSA-N 1 3 329.488 2.706 10 0 EFAEHO CC(C)(C[NH+]1CCCC1)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000457054847 476849102 /nfs/dbraw/zinc/84/91/02/476849102.db2.gz RAWGOUBIIBIUGW-UHFFFAOYSA-N 1 3 329.488 2.887 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)C[C@H](C)O1 ZINC000397558957 476857626 /nfs/dbraw/zinc/85/76/26/476857626.db2.gz PLUKYFLTHUGEID-IZZQQSIFSA-N 1 3 332.488 2.559 10 0 EFAEHO C[C@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)c1cccnc1 ZINC000397600656 476858023 /nfs/dbraw/zinc/85/80/23/476858023.db2.gz NPHYXLFNDJTCTH-KRWDZBQOSA-N 1 3 325.456 2.759 10 0 EFAEHO C[C@@H](NCC1(O)CC[NH+](Cc2ccccc2)CC1)c1cncc(F)c1 ZINC000397589394 476858529 /nfs/dbraw/zinc/85/85/29/476858529.db2.gz LJANPVWHXPYMOV-MRXNPFEDSA-N 1 3 343.446 2.898 10 0 EFAEHO CC[C@H](CN[C@@H](c1ccc(OC)cc1)[C@@H]1CCC[NH2+]1)N1CCCC1 ZINC000422963392 476869188 /nfs/dbraw/zinc/86/91/88/476869188.db2.gz IKDHANTXZBFXFB-HOJAQTOUSA-N 1 3 331.504 2.952 10 0 EFAEHO FC(F)(F)c1ccc(OCCN[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)nc1 ZINC000422987089 476879368 /nfs/dbraw/zinc/87/93/68/476879368.db2.gz FDAIOQPUCXNSOW-RRFJBIMHSA-N 1 3 343.393 2.990 10 0 EFAEHO FC(F)(F)c1ccc(OCCN[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)nc1 ZINC000422987088 476879525 /nfs/dbraw/zinc/87/95/25/476879525.db2.gz FDAIOQPUCXNSOW-RBSFLKMASA-N 1 3 343.393 2.990 10 0 EFAEHO NC[C@@H]1CCC[C@H]1[NH2+]C[C@@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422991714 476883577 /nfs/dbraw/zinc/88/35/77/476883577.db2.gz QAQFPVDPRVTLEL-OFQRWUPVSA-N 1 3 330.394 2.573 10 0 EFAEHO [NH3+]C[C@@H]1CCC[C@H]1NC[C@@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422991714 476883580 /nfs/dbraw/zinc/88/35/80/476883580.db2.gz QAQFPVDPRVTLEL-OFQRWUPVSA-N 1 3 330.394 2.573 10 0 EFAEHO NC[C@@H]1CCCC[C@H]1[NH2+]C[C@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422994932 476884351 /nfs/dbraw/zinc/88/43/51/476884351.db2.gz WOYHZKSKIPCSQK-HLLBOEOZSA-N 1 3 344.421 2.964 10 0 EFAEHO CC(C)N(C)CCC[NH2+][C@H](C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000400459084 476890022 /nfs/dbraw/zinc/89/00/22/476890022.db2.gz QVNYFWJKINHVOZ-CVEARBPZSA-N 1 3 327.513 2.952 10 0 EFAEHO CC(C)N1CC[C@H](C[NH2+][C@@H](C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1 ZINC000400581109 476892449 /nfs/dbraw/zinc/89/24/49/476892449.db2.gz QSKCVYNLCJFQMR-BBWFWOEESA-N 1 3 339.524 2.952 10 0 EFAEHO Cc1cc(N2CCC[C@H](N[C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)C2)n(C)n1 ZINC000423074615 476916468 /nfs/dbraw/zinc/91/64/68/476916468.db2.gz MIJWQRMMAIBYFA-CADBVGFASA-N 1 3 345.535 2.598 10 0 EFAEHO C[C@H]([NH3+])[C@@H](Cc1ccccc1)NC[C@H](CO)Cc1ccc(F)c(F)c1 ZINC000423079843 476920444 /nfs/dbraw/zinc/92/04/44/476920444.db2.gz RFVAXGXLECVZJQ-JNAXZKDPSA-N 1 3 348.437 2.664 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@H]1CSc2ccc(Br)cc21 ZINC000423088896 476924607 /nfs/dbraw/zinc/92/46/07/476924607.db2.gz RFADXNAOPUBSEW-AAEUAGOBSA-N 1 3 345.306 2.939 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@H](C)c1ccc(Br)cc1F ZINC000423116193 476934309 /nfs/dbraw/zinc/93/43/09/476934309.db2.gz ZVDSOVDKZSIYME-PWSUYJOCSA-N 1 3 333.245 2.993 10 0 EFAEHO Cc1nc(C[NH3+])ccc1[C@@H](C)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000423102216 476930207 /nfs/dbraw/zinc/93/02/07/476930207.db2.gz DQADNHMURGRZIE-KUHUBIRLSA-N 1 3 330.451 2.941 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)[C@@H]1CC[C@H](C2CC2)[NH2+]1)c1ccccc1 ZINC000407341342 476932583 /nfs/dbraw/zinc/93/25/83/476932583.db2.gz WDKCHPKDPCAFIH-CEXWTWQISA-N 1 3 329.488 2.716 10 0 EFAEHO c1ccc([C@H]2CC[C@H](CN[C@@H]3CCOC[C@H]3[C@@H]3CCC[NH2+]3)O2)cc1 ZINC000423127414 476937080 /nfs/dbraw/zinc/93/70/80/476937080.db2.gz SZERQGNEPROSLS-LCWAXJCOSA-N 1 3 330.472 2.653 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1cc(F)c(C(F)(F)F)cc1F ZINC000423136034 476940791 /nfs/dbraw/zinc/94/07/91/476940791.db2.gz YQYFTZLUIHQRLD-JTQLQIEISA-N 1 3 326.309 2.827 10 0 EFAEHO COc1ccc([C@H](NCCN2CCCC2(C)C)[C@H]2CCC[NH2+]2)cc1 ZINC000423160479 476948593 /nfs/dbraw/zinc/94/85/93/476948593.db2.gz HLHSTOKBKUAUAH-MOPGFXCFSA-N 1 3 331.504 2.952 10 0 EFAEHO COc1cc(OC)c(C[C@@H](C)NC2C[C@H]3CC[C@@H](C2)[NH2+]3)c(OC)c1 ZINC000423159133 476949124 /nfs/dbraw/zinc/94/91/24/476949124.db2.gz OVWYOCKKALAMRC-JKXDFHQYSA-N 1 3 334.460 2.516 10 0 EFAEHO CC(=O)Nc1ccc([C@@H](C)NCCC[NH2+]Cc2cccnc2)cc1 ZINC000423181050 476955980 /nfs/dbraw/zinc/95/59/80/476955980.db2.gz CBGQDIYPQGZNGC-OAHLLOKOSA-N 1 3 326.444 2.871 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2ccc3c(c2)CNCC3)[C@@H](C)C1 ZINC000415896729 476961665 /nfs/dbraw/zinc/96/16/65/476961665.db2.gz OVMJRWFFCJNJJK-KBXCAEBGSA-N 1 3 330.476 2.526 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc3c(c2)CNCC3)[C@@H](C)C1 ZINC000415896729 476961673 /nfs/dbraw/zinc/96/16/73/476961673.db2.gz OVMJRWFFCJNJJK-KBXCAEBGSA-N 1 3 330.476 2.526 10 0 EFAEHO COCCOc1cc(C)ccc1C[NH2+][C@@H]1CCN(C)[C@H]2CCC[C@H]21 ZINC000375783006 477002986 /nfs/dbraw/zinc/00/29/86/477002986.db2.gz BCECKIHFMNYQEO-OTWHNJEPSA-N 1 3 332.488 2.983 10 0 EFAEHO C[C@@H](NC[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc2c(s1)CCC2 ZINC000423381715 477012110 /nfs/dbraw/zinc/01/21/10/477012110.db2.gz IIBAVXGDDRVLLY-ABAIWWIYSA-N 1 3 347.450 2.724 10 0 EFAEHO COc1ccc([C@H](Cc2ccncc2)[NH2+][C@@H]2CCNC[C@H]2C)cc1 ZINC000423387129 477014533 /nfs/dbraw/zinc/01/45/33/477014533.db2.gz HOQHWXHDRYIIKD-YSGRDPCXSA-N 1 3 325.456 2.962 10 0 EFAEHO CO[C@]1(CN[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCOC1 ZINC000447598411 477020351 /nfs/dbraw/zinc/02/03/51/477020351.db2.gz HFAAABYKYMEDDE-HAGHYFMRSA-N 1 3 330.472 2.577 10 0 EFAEHO CO[C@]1(CN[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCOC1 ZINC000447598411 477020354 /nfs/dbraw/zinc/02/03/54/477020354.db2.gz HFAAABYKYMEDDE-HAGHYFMRSA-N 1 3 330.472 2.577 10 0 EFAEHO COCC1(CN[C@@H](C)c2ncc(-c3ccccc3)n2C)CC[NH2+]CC1 ZINC000423413197 477025811 /nfs/dbraw/zinc/02/58/11/477025811.db2.gz YMQHPUHHGXDJQN-INIZCTEOSA-N 1 3 342.487 2.754 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)C[C@H](c2ccccc2)N(C)C)CC1 ZINC000416142408 477037203 /nfs/dbraw/zinc/03/72/03/477037203.db2.gz CJULSHIPQBUGCH-LJQANCHMSA-N 1 3 331.504 2.918 10 0 EFAEHO C[C@@H]1CN(C2CC2)C[C@@H]1NC[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000423461385 477037770 /nfs/dbraw/zinc/03/77/70/477037770.db2.gz CHPAPIXRZFQQHK-NVRFMJDISA-N 1 3 331.479 2.591 10 0 EFAEHO CC(C)Oc1ccc([C@H](O)CN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)cc1 ZINC000375840487 477040091 /nfs/dbraw/zinc/04/00/91/477040091.db2.gz PNCPLPYCQHSSBK-YSTOQKLRSA-N 1 3 332.488 2.970 10 0 EFAEHO CC(C)Oc1ccc([C@H](O)CN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@@H]32)cc1 ZINC000375840487 477040095 /nfs/dbraw/zinc/04/00/95/477040095.db2.gz PNCPLPYCQHSSBK-YSTOQKLRSA-N 1 3 332.488 2.970 10 0 EFAEHO CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)CCN1CCc2ccccc2C1 ZINC000416157627 477046078 /nfs/dbraw/zinc/04/60/78/477046078.db2.gz RGDXSRPOOYQGQF-FQEVSTJZSA-N 1 3 343.515 2.768 10 0 EFAEHO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)CCN1CCc2ccccc2C1 ZINC000416157627 477046082 /nfs/dbraw/zinc/04/60/82/477046082.db2.gz RGDXSRPOOYQGQF-FQEVSTJZSA-N 1 3 343.515 2.768 10 0 EFAEHO FC1(F)CCNC[C@@H]1N[C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000423486961 477047095 /nfs/dbraw/zinc/04/70/95/477047095.db2.gz TXDMLZKLHQGGRU-MANSERQUSA-N 1 3 349.469 2.874 10 0 EFAEHO FC1(F)CCNC[C@@H]1N[C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000423486961 477047099 /nfs/dbraw/zinc/04/70/99/477047099.db2.gz TXDMLZKLHQGGRU-MANSERQUSA-N 1 3 349.469 2.874 10 0 EFAEHO COc1cc(OC)cc(OCC[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@H]32)c1 ZINC000375891933 477066327 /nfs/dbraw/zinc/06/63/27/477066327.db2.gz XKAIKBIBZRXQRP-OTWHNJEPSA-N 1 3 334.460 2.545 10 0 EFAEHO COc1cc(OC)cc(OCCN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)c1 ZINC000375891933 477066329 /nfs/dbraw/zinc/06/63/29/477066329.db2.gz XKAIKBIBZRXQRP-OTWHNJEPSA-N 1 3 334.460 2.545 10 0 EFAEHO COc1cc(OC)cc(OCCN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@H]32)c1 ZINC000375891933 477066331 /nfs/dbraw/zinc/06/63/31/477066331.db2.gz XKAIKBIBZRXQRP-OTWHNJEPSA-N 1 3 334.460 2.545 10 0 EFAEHO CC[C@H](CC(F)F)C(=O)N(CCN(C)C)C[C@@H]1CCC[N@@H+]1CC ZINC000457536324 477074736 /nfs/dbraw/zinc/07/47/36/477074736.db2.gz PCBJOVRDWUAXQS-CABCVRRESA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@H](CC(F)F)C(=O)N(CCN(C)C)C[C@@H]1CCC[N@H+]1CC ZINC000457536324 477074742 /nfs/dbraw/zinc/07/47/42/477074742.db2.gz PCBJOVRDWUAXQS-CABCVRRESA-N 1 3 333.467 2.542 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000431835174 477104205 /nfs/dbraw/zinc/10/42/05/477104205.db2.gz XGIBANVSUSOIEL-RLLQIKCJSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CC[C@H]1CCCC[N@H+]1C ZINC000431835174 477104214 /nfs/dbraw/zinc/10/42/14/477104214.db2.gz XGIBANVSUSOIEL-RLLQIKCJSA-N 1 3 343.515 2.888 10 0 EFAEHO O=C(C1CCN(C2CC2)CC1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000376080153 477164857 /nfs/dbraw/zinc/16/48/57/477164857.db2.gz JADHEDNOUVGGOY-GOSISDBHSA-N 1 3 347.547 2.975 10 0 EFAEHO CN1C[C@H](N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)CCC1=O ZINC000453105060 477169304 /nfs/dbraw/zinc/16/93/04/477169304.db2.gz BBHTYPFHYUZOPP-WTGUMLROSA-N 1 3 341.499 2.640 10 0 EFAEHO CN1C[C@H](N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)CCC1=O ZINC000453105060 477169311 /nfs/dbraw/zinc/16/93/11/477169311.db2.gz BBHTYPFHYUZOPP-WTGUMLROSA-N 1 3 341.499 2.640 10 0 EFAEHO Cc1cc([C@H](C)N[C@@H](CC(C)C)C(=O)NCC[NH+](C)C)cs1 ZINC000453187473 477188054 /nfs/dbraw/zinc/18/80/54/477188054.db2.gz VPXKKQLGPGLZBE-HOCLYGCPSA-N 1 3 325.522 2.800 10 0 EFAEHO OCC[C@H]1CSCCN1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000411319689 477193121 /nfs/dbraw/zinc/19/31/21/477193121.db2.gz RTEVWTSVFAYVOM-IBGZPJMESA-N 1 3 334.529 2.972 10 0 EFAEHO C[NH+]1CCC2(CCCN2C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000371360626 477265455 /nfs/dbraw/zinc/26/54/55/477265455.db2.gz IDHLXDSNMMGQMQ-UHFFFAOYSA-N 1 3 341.499 2.983 10 0 EFAEHO CCN1CCC(NC(=O)C[NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)CC1 ZINC000411561733 477276793 /nfs/dbraw/zinc/27/67/93/477276793.db2.gz RIAGOSMHVPSSJV-WOJBJXKFSA-N 1 3 343.515 2.903 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)NC[C@@H]1CCCCN1C1CC1 ZINC000433918021 477330266 /nfs/dbraw/zinc/33/02/66/477330266.db2.gz HQOBTPKHDXYDHF-JZXOWHBKSA-N 1 3 336.524 2.565 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NC[C@@H]1CCCCN1C1CC1 ZINC000433918021 477330273 /nfs/dbraw/zinc/33/02/73/477330273.db2.gz HQOBTPKHDXYDHF-JZXOWHBKSA-N 1 3 336.524 2.565 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@@H]([NH2+]Cc3ccc(OCCN(C)C)cc3)C[C@H]2C1 ZINC000424267533 477348577 /nfs/dbraw/zinc/34/85/77/477348577.db2.gz MNWJGILVTOTAFQ-LAGDQHSMSA-N 1 3 332.488 2.920 10 0 EFAEHO C[C@H]1CC2(CN1CC(=O)N[C@@H]1CCCc3ccccc31)CC[NH2+]CC2 ZINC000424289629 477357064 /nfs/dbraw/zinc/35/70/64/477357064.db2.gz MDVZHFNXUPOXFF-QFBILLFUSA-N 1 3 341.499 2.644 10 0 EFAEHO C[C@@H]1CC2(CN1CC(=O)N[C@@H]1CCCc3ccccc31)CC[NH2+]CC2 ZINC000424289632 477357622 /nfs/dbraw/zinc/35/76/22/477357622.db2.gz MDVZHFNXUPOXFF-VQIMIIECSA-N 1 3 341.499 2.644 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)NC(C)(C)CCC[NH+](C)C ZINC000458347640 477361519 /nfs/dbraw/zinc/36/15/19/477361519.db2.gz UGNIETMHIMJRCF-IYBDPMFKSA-N 1 3 326.529 2.669 10 0 EFAEHO CC[NH+](CC)[C@@H](CNC(=O)NC[C@@H](N)c1ccccc1)CC(C)C ZINC000416943094 477380514 /nfs/dbraw/zinc/38/05/14/477380514.db2.gz CBDJJWAOTBHHKI-QZTJIDSGSA-N 1 3 334.508 2.742 10 0 EFAEHO CCC(CC)[C@H](CNC(=O)NC[C@H](N)c1ccccc1)[NH+]1CCCC1 ZINC000416967548 477392792 /nfs/dbraw/zinc/39/27/92/477392792.db2.gz ZNFBBKYSNNHCOK-OALUTQOASA-N 1 3 346.519 2.886 10 0 EFAEHO C[C@@H](Cn1cccn1)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449078354 477425703 /nfs/dbraw/zinc/42/57/03/477425703.db2.gz ULTJIQXAYRKVIA-ROUUACIJSA-N 1 3 326.488 2.957 10 0 EFAEHO CC(C)(C)CC(C)(C)[NH+]1CCC(NC[C@@H]2CCS(=O)(=O)C2)CC1 ZINC000449076698 477426368 /nfs/dbraw/zinc/42/63/68/477426368.db2.gz XKJTVIPQAHVKPJ-HNNXBMFYSA-N 1 3 344.565 2.690 10 0 EFAEHO C[C@H](Cc1ccoc1)[NH2+]Cc1ccc(CN2CCN(C)CC2)cc1 ZINC000449081100 477427691 /nfs/dbraw/zinc/42/76/91/477427691.db2.gz BSVVXXVSGLKYFN-QGZVFWFLSA-N 1 3 327.472 2.748 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NCCc2cnn(C)c2)CC1 ZINC000449083567 477428788 /nfs/dbraw/zinc/42/87/88/477428788.db2.gz CIFRVSOXFZTFEF-KRWDZBQOSA-N 1 3 326.488 2.648 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@H](N)c1ccccc1 ZINC000417026476 477429439 /nfs/dbraw/zinc/42/94/39/477429439.db2.gz ANCWEKZTWPAGTI-AEFFLSMTSA-N 1 3 332.492 2.640 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@H](N)c1ccccc1 ZINC000417026476 477429442 /nfs/dbraw/zinc/42/94/42/477429442.db2.gz ANCWEKZTWPAGTI-AEFFLSMTSA-N 1 3 332.492 2.640 10 0 EFAEHO CC(C)COC[C@@H](O)CNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449095557 477436032 /nfs/dbraw/zinc/43/60/32/477436032.db2.gz ZJLOTEFBKOOXQG-RXVVDRJESA-N 1 3 348.531 2.705 10 0 EFAEHO CC(C)N1CC[C@H]([NH2+]C2CCN([C@@H](C)Cc3ccccc3)CC2)C1=O ZINC000449156428 477461949 /nfs/dbraw/zinc/46/19/49/477461949.db2.gz NYSAHROMZLXLDH-PXNSSMCTSA-N 1 3 343.515 2.681 10 0 EFAEHO COCCN1CC[C@H](NC2CC[NH+](C(C)(C)CC(C)(C)C)CC2)C1 ZINC000449157163 477462238 /nfs/dbraw/zinc/46/22/38/477462238.db2.gz UQDUOVUSHSBPFE-SFHVURJKSA-N 1 3 339.568 2.976 10 0 EFAEHO CSC[C@](C)(O)CNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449165094 477464664 /nfs/dbraw/zinc/46/46/64/477464664.db2.gz SXGQNRHFNKVHCZ-VQIMIIECSA-N 1 3 336.545 2.786 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NC[C@@]2(O)CCSC2)CC1 ZINC000449182304 477473984 /nfs/dbraw/zinc/47/39/84/477473984.db2.gz JMPKVZZJASPUBC-APWZRJJASA-N 1 3 334.529 2.540 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NC[C@]2(O)CCSC2)CC1 ZINC000449182306 477474244 /nfs/dbraw/zinc/47/42/44/477474244.db2.gz JMPKVZZJASPUBC-QFBILLFUSA-N 1 3 334.529 2.540 10 0 EFAEHO CC[NH2+][C@H](C)CNC(=O)N(CC)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418607385 477480153 /nfs/dbraw/zinc/48/01/53/477480153.db2.gz QWMTXWKJIOBSEU-ZHALLVOQSA-N 1 3 346.519 2.851 10 0 EFAEHO Cc1c(C[NH2+]C2CCN([C@H](C)Cc3ccccc3)CC2)cnn1C ZINC000449205309 477485230 /nfs/dbraw/zinc/48/52/30/477485230.db2.gz NYRVWMKKGMYNIE-MRXNPFEDSA-N 1 3 326.488 2.914 10 0 EFAEHO Cc1cc(CNCc2ccc(C(=O)NCC[NH+](C)C)cc2)cs1 ZINC000449226581 477496307 /nfs/dbraw/zinc/49/63/07/477496307.db2.gz RKMRBFRLNQOYMH-UHFFFAOYSA-N 1 3 331.485 2.638 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)CC1 ZINC000371819784 477511890 /nfs/dbraw/zinc/51/18/90/477511890.db2.gz ZCHXWHHGCJNWCQ-WMZOPIPTSA-N 1 3 344.503 2.548 10 0 EFAEHO CC(C)(C)CC(C)(C)[NH+]1CCC(NC[C@@H](CO)[C@@H]2CCOC2)CC1 ZINC000449301754 477533625 /nfs/dbraw/zinc/53/36/25/477533625.db2.gz SLEAULCBXSZIFH-SJORKVTESA-N 1 3 340.552 2.900 10 0 EFAEHO CC(C)(C)CC(C)(C)[NH+]1CCC(NC[C@H](CO)[C@@H]2CCOC2)CC1 ZINC000449301752 477534613 /nfs/dbraw/zinc/53/46/13/477534613.db2.gz SLEAULCBXSZIFH-IAGOWNOFSA-N 1 3 340.552 2.900 10 0 EFAEHO COCC[C@H](COC)NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449337021 477553357 /nfs/dbraw/zinc/55/33/57/477553357.db2.gz OYTPVFLRSWNNDR-YLJYHZDGSA-N 1 3 334.504 2.723 10 0 EFAEHO C[C@@H](Cc1ccccc1)N1CCC([NH2+][C@H]2CCc3nc[nH]c3C2)CC1 ZINC000449341141 477557068 /nfs/dbraw/zinc/55/70/68/477557068.db2.gz YAFMEPRNGIPVDM-LPHOPBHVSA-N 1 3 338.499 2.952 10 0 EFAEHO C[C@@H](Cc1ccccc1)N1CCC([NH2+][C@H]2CCc3[nH]cnc3C2)CC1 ZINC000449341141 477557073 /nfs/dbraw/zinc/55/70/73/477557073.db2.gz YAFMEPRNGIPVDM-LPHOPBHVSA-N 1 3 338.499 2.952 10 0 EFAEHO COc1cc(NCCN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)cc(OC)c1 ZINC000367614505 477601461 /nfs/dbraw/zinc/60/14/61/477601461.db2.gz HBGLVNCJMWBOMZ-QRVBRYPASA-N 1 3 333.476 2.578 10 0 EFAEHO COc1cc(NCCN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@@H]32)cc(OC)c1 ZINC000367614505 477601468 /nfs/dbraw/zinc/60/14/68/477601468.db2.gz HBGLVNCJMWBOMZ-QRVBRYPASA-N 1 3 333.476 2.578 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cccc(N3CCCC3=O)c2)[C@@H]2CCC[C@@H]21 ZINC000367612322 477601829 /nfs/dbraw/zinc/60/18/29/477601829.db2.gz ADTDTDKGDFSHHZ-FHWLQOOXSA-N 1 3 327.472 2.776 10 0 EFAEHO Cn1c2cccc(F)c2nc1CCN[C@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000367618989 477604779 /nfs/dbraw/zinc/60/47/79/477604779.db2.gz UXKBZWZKYNUNII-BPUTZDHNSA-N 1 3 330.451 2.717 10 0 EFAEHO Cn1c2cccc(F)c2nc1CCN[C@H]1CC[N@@H+](C)[C@H]2CCC[C@H]21 ZINC000367618989 477604786 /nfs/dbraw/zinc/60/47/86/477604786.db2.gz UXKBZWZKYNUNII-BPUTZDHNSA-N 1 3 330.451 2.717 10 0 EFAEHO COc1ccc([C@H](CN)C[NH2+][C@@]2(CO)C[C@H](C)CC(C)(C)C2)cc1 ZINC000420304824 477678505 /nfs/dbraw/zinc/67/85/05/477678505.db2.gz ORZIDQMOJQVQAX-MDYRTPRTSA-N 1 3 334.504 2.904 10 0 EFAEHO CCOc1ccccc1NC(=O)CCN1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000420390914 477741626 /nfs/dbraw/zinc/74/16/26/477741626.db2.gz HYXFLAXLDZNDNW-AEFFLSMTSA-N 1 3 345.487 2.878 10 0 EFAEHO CCc1cc(CCCN(C)C2C[C@H]3CC[C@@H](C2)[N@H+]3CCOC)on1 ZINC000451073634 477810389 /nfs/dbraw/zinc/81/03/89/477810389.db2.gz KYJZBAXDCCGYNS-JWTNVVGKSA-N 1 3 335.492 2.743 10 0 EFAEHO CCc1cc(CCCN(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3CCOC)on1 ZINC000451073634 477810394 /nfs/dbraw/zinc/81/03/94/477810394.db2.gz KYJZBAXDCCGYNS-JWTNVVGKSA-N 1 3 335.492 2.743 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN(CC[NH+](C)C)C1CCCC1 ZINC000428096013 477819080 /nfs/dbraw/zinc/81/90/80/477819080.db2.gz AXAGIIJYARRWGJ-UHFFFAOYSA-N 1 3 327.476 2.882 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@]1(C)CCC[N@@H+]1Cc1ccccc1)N(C)C ZINC000428325215 477869672 /nfs/dbraw/zinc/86/96/72/477869672.db2.gz KXHKUEYJJRRIRY-ICSRJNTNSA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@]1(C)CCC[N@H+]1Cc1ccccc1)N(C)C ZINC000428325215 477869681 /nfs/dbraw/zinc/86/96/81/477869681.db2.gz KXHKUEYJJRRIRY-ICSRJNTNSA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@]1(C)CCC[N@@H+]1Cc1ccccc1)N(C)C ZINC000428325218 477870113 /nfs/dbraw/zinc/87/01/13/477870113.db2.gz KXHKUEYJJRRIRY-UYAOXDASSA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@]1(C)CCC[N@H+]1Cc1ccccc1)N(C)C ZINC000428325218 477870119 /nfs/dbraw/zinc/87/01/19/477870119.db2.gz KXHKUEYJJRRIRY-UYAOXDASSA-N 1 3 331.504 2.744 10 0 EFAEHO C[NH+](C)CC1CCC(NC(=O)N2CCCN(C(C)(C)C)CC2)CC1 ZINC000532752568 477983415 /nfs/dbraw/zinc/98/34/15/477983415.db2.gz ACJQTDVRZPEVBH-UHFFFAOYSA-N 1 3 338.540 2.623 10 0 EFAEHO CCOc1ccc(C(=O)N2CCC([NH2+][C@H]3CCC[C@H](N)C3)CC2)cc1 ZINC000516785858 477988687 /nfs/dbraw/zinc/98/86/87/477988687.db2.gz YFUSWQFHAKSJDL-WMZOPIPTSA-N 1 3 345.487 2.549 10 0 EFAEHO CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCCN2[C@@H](C)CCC[C@@H]2C)C1 ZINC000465894320 477993045 /nfs/dbraw/zinc/99/30/45/477993045.db2.gz AESVLSKESRAEMH-BZSNNMDCSA-N 1 3 338.540 2.623 10 0 EFAEHO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NCCN2[C@@H](C)CCC[C@@H]2C)C1 ZINC000465894320 477993053 /nfs/dbraw/zinc/99/30/53/477993053.db2.gz AESVLSKESRAEMH-BZSNNMDCSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)(C)[C@H]1CCCC[C@H]1[NH2+]CC(=O)NC1CCN(C2CC2)CC1 ZINC000440058043 478067175 /nfs/dbraw/zinc/06/71/75/478067175.db2.gz BIWQYYUWRSEPTC-ZWKOTPCHSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)N(C)C ZINC000495019349 478106687 /nfs/dbraw/zinc/10/66/87/478106687.db2.gz PTWKWQXRPKWVDP-BHYGNILZSA-N 1 3 337.533 2.833 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)N(C)C ZINC000495019349 478106690 /nfs/dbraw/zinc/10/66/90/478106690.db2.gz PTWKWQXRPKWVDP-BHYGNILZSA-N 1 3 337.533 2.833 10 0 EFAEHO CN(CCC(=O)NCCN1CC=C(C(C)(C)C)CC1)c1cc[nH+]cc1 ZINC000560648661 478121362 /nfs/dbraw/zinc/12/13/62/478121362.db2.gz NZTJENNHUDXLTE-UHFFFAOYSA-N 1 3 344.503 2.702 10 0 EFAEHO CCc1ccccc1[C@@H](N)CNC(=O)C1C[C@H]2CCC[C@@H](C1)C2[NH3+] ZINC000561193529 478163925 /nfs/dbraw/zinc/16/39/25/478163925.db2.gz GHZWCVFZHHTAIB-DLLQETOTSA-N 1 3 329.488 2.519 10 0 EFAEHO CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)CN1CC[C@@H](C)C1 ZINC000561269962 478173740 /nfs/dbraw/zinc/17/37/40/478173740.db2.gz JGFVEBFFXSCFQD-QUCCMNQESA-N 1 3 343.515 2.699 10 0 EFAEHO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)CN1CC[C@@H](C)C1 ZINC000561269962 478173743 /nfs/dbraw/zinc/17/37/43/478173743.db2.gz JGFVEBFFXSCFQD-QUCCMNQESA-N 1 3 343.515 2.699 10 0 EFAEHO CC[NH+](CC)CC1CCN(Cc2ccc(-n3cncn3)c(F)c2)CC1 ZINC000535780958 478229909 /nfs/dbraw/zinc/22/99/09/478229909.db2.gz SHCHPSDKKCQCTE-UHFFFAOYSA-N 1 3 345.466 2.960 10 0 EFAEHO C[C@H]1CN(C(=O)NCC2([NH3+])CCCCCC2)CCN(C2CCC2)C1 ZINC000579572540 478329634 /nfs/dbraw/zinc/32/96/34/478329634.db2.gz XJAMXZHKFXUZBJ-MRXNPFEDSA-N 1 3 336.524 2.554 10 0 EFAEHO CCOC(=O)C1([C@@H](C)N[C@H](c2ccccn2)C2CCC2)CC[NH2+]CC1 ZINC000600708950 478479684 /nfs/dbraw/zinc/47/96/84/478479684.db2.gz MAZUEHYHLJXOFJ-QAPCUYQASA-N 1 3 345.487 2.834 10 0 EFAEHO CN(C)CCN(CC1CCCCC1)C(=O)CCN(C)c1cc[nH+]cc1 ZINC000540926423 478512261 /nfs/dbraw/zinc/51/22/61/478512261.db2.gz CUCHSFCCYVTLQW-UHFFFAOYSA-N 1 3 346.519 2.878 10 0 EFAEHO CN1CC[C@H](NC(=O)N[C@@H](C[NH3+])C2CCCCC2)[C@H]1c1ccccc1 ZINC000582171174 478530295 /nfs/dbraw/zinc/53/02/95/478530295.db2.gz RDWORXYJZZTLAA-GBESFXJTSA-N 1 3 344.503 2.639 10 0 EFAEHO CN(CCC(=O)NC[C@H](C1CCCCC1)[NH+](C)C)c1ccncc1 ZINC000541852551 478597432 /nfs/dbraw/zinc/59/74/32/478597432.db2.gz ZZGXBQFYGDEMDL-GOSISDBHSA-N 1 3 332.492 2.535 10 0 EFAEHO C[C@H](CSCCF)[NH2+]Cc1ccc(CN2CCN(C)CC2)cc1 ZINC000595011336 478628331 /nfs/dbraw/zinc/62/83/31/478628331.db2.gz CTRPEGKMSZCFFE-MRXNPFEDSA-N 1 3 339.524 2.615 10 0 EFAEHO C[N@@H+]1CCCC[C@H]1CN1CCN(C[C@@H]2CCc3ccccc3C2)CC1 ZINC000542916115 478708513 /nfs/dbraw/zinc/70/85/13/478708513.db2.gz WSFHYISJJNMQKK-KNQAVFIVSA-N 1 3 341.543 2.893 10 0 EFAEHO C[N@H+]1CCCC[C@H]1CN1CCN(C[C@@H]2CCc3ccccc3C2)CC1 ZINC000542916115 478708520 /nfs/dbraw/zinc/70/85/20/478708520.db2.gz WSFHYISJJNMQKK-KNQAVFIVSA-N 1 3 341.543 2.893 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000582973698 478734107 /nfs/dbraw/zinc/73/41/07/478734107.db2.gz HGJZFFRIKJWZKJ-WSTZPKSXSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000582973698 478734111 /nfs/dbraw/zinc/73/41/11/478734111.db2.gz HGJZFFRIKJWZKJ-WSTZPKSXSA-N 1 3 343.515 2.840 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)C[NH2+]C[C@@H](C)CN1CCCC1 ZINC000564650979 478777535 /nfs/dbraw/zinc/77/75/35/478777535.db2.gz FRSLMQMGGWYVQS-MSOLQXFVSA-N 1 3 334.504 2.871 10 0 EFAEHO CC(C)C[C@H](CNC(=O)C(N)C(F)(F)F)[NH2+][C@H](C)c1ccccc1 ZINC000564655202 478778991 /nfs/dbraw/zinc/77/89/91/478778991.db2.gz OAWCNQSJKINIQO-YUELXQCFSA-N 1 3 345.409 2.758 10 0 EFAEHO CCOC(=O)c1ncc(CN2CCC[C@@H](C)[C@H]2CCC[NH3+])s1 ZINC000601324866 478786738 /nfs/dbraw/zinc/78/67/38/478786738.db2.gz DQDQIJQYZXFMPV-TZMCWYRMSA-N 1 3 325.478 2.659 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1CNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000500526444 478793619 /nfs/dbraw/zinc/79/36/19/478793619.db2.gz PJBSEIABWYSTJV-IPMKNSEASA-N 1 3 344.503 2.605 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1CNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000500526444 478793627 /nfs/dbraw/zinc/79/36/27/478793627.db2.gz PJBSEIABWYSTJV-IPMKNSEASA-N 1 3 344.503 2.605 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1CNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000500526440 478793790 /nfs/dbraw/zinc/79/37/90/478793790.db2.gz PJBSEIABWYSTJV-FHWLQOOXSA-N 1 3 344.503 2.605 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1CNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000500526440 478793800 /nfs/dbraw/zinc/79/38/00/478793800.db2.gz PJBSEIABWYSTJV-FHWLQOOXSA-N 1 3 344.503 2.605 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@H](c2ccccn2)C2CCC2)CC1 ZINC000528659203 478873206 /nfs/dbraw/zinc/87/32/06/478873206.db2.gz OJWMCHUTXKVEEW-FQEVSTJZSA-N 1 3 330.520 2.929 10 0 EFAEHO C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccccc2CC[NH3+])C1 ZINC000565151329 478927126 /nfs/dbraw/zinc/92/71/26/478927126.db2.gz LIDHWOUREMZCTG-APWZRJJASA-N 1 3 337.467 2.753 10 0 EFAEHO O[C@H]1CCN(C2CC[NH+](CCCSCc3ccccc3)CC2)C1 ZINC000595864921 479040177 /nfs/dbraw/zinc/04/01/77/479040177.db2.gz XGJXGALPMPLRGE-IBGZPJMESA-N 1 3 334.529 2.841 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)C1 ZINC000565667789 479058497 /nfs/dbraw/zinc/05/84/97/479058497.db2.gz UNUGOYJVUBSZAP-AZUAARDMSA-N 1 3 343.515 2.747 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000565667789 479058504 /nfs/dbraw/zinc/05/85/04/479058504.db2.gz UNUGOYJVUBSZAP-AZUAARDMSA-N 1 3 343.515 2.747 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)C1 ZINC000565667797 479058789 /nfs/dbraw/zinc/05/87/89/479058789.db2.gz UNUGOYJVUBSZAP-UYAOXDASSA-N 1 3 343.515 2.747 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000565667797 479058798 /nfs/dbraw/zinc/05/87/98/479058798.db2.gz UNUGOYJVUBSZAP-UYAOXDASSA-N 1 3 343.515 2.747 10 0 EFAEHO CSC[C@@H](O)C[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000596064700 479116925 /nfs/dbraw/zinc/11/69/25/479116925.db2.gz HSMAMHCKMQYIPH-ROUUACIJSA-N 1 3 334.529 2.602 10 0 EFAEHO CSC[C@@H](O)CNC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000596064700 479116929 /nfs/dbraw/zinc/11/69/29/479116929.db2.gz HSMAMHCKMQYIPH-ROUUACIJSA-N 1 3 334.529 2.602 10 0 EFAEHO CSC[C@@H](O)CNC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000596064700 479116932 /nfs/dbraw/zinc/11/69/32/479116932.db2.gz HSMAMHCKMQYIPH-ROUUACIJSA-N 1 3 334.529 2.602 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000584418532 479128731 /nfs/dbraw/zinc/12/87/31/479128731.db2.gz DGSWHJZFYOFSBW-KRWDZBQOSA-N 1 3 329.488 2.631 10 0 EFAEHO CCC[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(=O)NCC1(N(C)C)CC1 ZINC000529496671 479179919 /nfs/dbraw/zinc/17/99/19/479179919.db2.gz MZRNFROSICLZJS-RTBURBONSA-N 1 3 343.515 2.745 10 0 EFAEHO CCC[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)NCC1(N(C)C)CC1 ZINC000529496671 479179925 /nfs/dbraw/zinc/17/99/25/479179925.db2.gz MZRNFROSICLZJS-RTBURBONSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(C(=O)NCCN(C)C)cc1)C1CC(F)(F)C1 ZINC000529538549 479198940 /nfs/dbraw/zinc/19/89/40/479198940.db2.gz DPIICQFOZCQBBC-CYBMUJFWSA-N 1 3 339.430 2.501 10 0 EFAEHO C[C@H]([NH2+]Cc1cccc(C(=O)NCCN(C)C)c1)C1CC(F)(F)C1 ZINC000529539750 479198949 /nfs/dbraw/zinc/19/89/49/479198949.db2.gz XCCZWVVLPQGBSX-ZDUSSCGKSA-N 1 3 339.430 2.501 10 0 EFAEHO [NH3+]C1(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCCC1 ZINC000557137547 479259157 /nfs/dbraw/zinc/25/91/57/479259157.db2.gz XOFHRTNAYOEJEU-SFHVURJKSA-N 1 3 344.503 2.612 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCCC1)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC000529722082 479270050 /nfs/dbraw/zinc/27/00/50/479270050.db2.gz GFZXZAWFJCKLBZ-RTBURBONSA-N 1 3 333.520 2.917 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCCC1)[C@H]1CCC[N@H+]1C1CCCC1 ZINC000529722082 479270054 /nfs/dbraw/zinc/27/00/54/479270054.db2.gz GFZXZAWFJCKLBZ-RTBURBONSA-N 1 3 333.520 2.917 10 0 EFAEHO CN1CCC[C@@H](NC(=O)N[C@H](C[NH+]2CCCCC2)c2ccccc2)C1 ZINC000604178852 479480151 /nfs/dbraw/zinc/48/01/51/479480151.db2.gz HQULMJPSRPAYBR-RTBURBONSA-N 1 3 344.503 2.607 10 0 EFAEHO CN1CCC[C@H](NC(=O)N[C@@H](C[NH+]2CCCCC2)c2ccccc2)C1 ZINC000604178850 479480788 /nfs/dbraw/zinc/48/07/88/479480788.db2.gz HQULMJPSRPAYBR-OALUTQOASA-N 1 3 344.503 2.607 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)N[C@@H]1CCC[N@H+](C)C1)c1ccsc1 ZINC000618555332 479490368 /nfs/dbraw/zinc/49/03/68/479490368.db2.gz UIYHUPKIISGLEU-CVEARBPZSA-N 1 3 338.521 2.524 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)N[C@@H]1CCC[N@@H+](C)C1)c1ccsc1 ZINC000618555332 479490377 /nfs/dbraw/zinc/49/03/77/479490377.db2.gz UIYHUPKIISGLEU-CVEARBPZSA-N 1 3 338.521 2.524 10 0 EFAEHO CCOC(=O)[C@@](C)(CN[C@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1 ZINC000600151828 479546753 /nfs/dbraw/zinc/54/67/53/479546753.db2.gz OUEXJCFTISHMGV-PXNSSMCTSA-N 1 3 332.488 2.970 10 0 EFAEHO CCOC(=O)[C@@](C)(CN[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1 ZINC000600151828 479546760 /nfs/dbraw/zinc/54/67/60/479546760.db2.gz OUEXJCFTISHMGV-PXNSSMCTSA-N 1 3 332.488 2.970 10 0 EFAEHO CC[C@](CN[C@H]1CC[N@H+](C)C(C)(C)C1)(C(=O)OC)c1ccccc1 ZINC000600165023 479555527 /nfs/dbraw/zinc/55/55/27/479555527.db2.gz OOUUPLKLHPQBHE-FXAWDEMLSA-N 1 3 332.488 2.970 10 0 EFAEHO CC[C@](CN[C@H]1CC[N@@H+](C)C(C)(C)C1)(C(=O)OC)c1ccccc1 ZINC000600165023 479555535 /nfs/dbraw/zinc/55/55/35/479555535.db2.gz OOUUPLKLHPQBHE-FXAWDEMLSA-N 1 3 332.488 2.970 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C1CCc2ccccc2CC1 ZINC000628051323 479747723 /nfs/dbraw/zinc/74/77/23/479747723.db2.gz BOYUDNVUSIPSQV-KRWDZBQOSA-N 1 3 345.531 2.570 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C1CCc2ccccc2CC1 ZINC000628051323 479747729 /nfs/dbraw/zinc/74/77/29/479747729.db2.gz BOYUDNVUSIPSQV-KRWDZBQOSA-N 1 3 345.531 2.570 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCN(Cc3ccccc3)C[C@@H](C)C2)CC[N@@H+]1C ZINC000633328089 479771335 /nfs/dbraw/zinc/77/13/35/479771335.db2.gz HHECIJKBAVVHJX-YZGWKJHDSA-N 1 3 343.515 2.697 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCN(Cc3ccccc3)C[C@@H](C)C2)CC[N@H+]1C ZINC000633328089 479771340 /nfs/dbraw/zinc/77/13/40/479771340.db2.gz HHECIJKBAVVHJX-YZGWKJHDSA-N 1 3 343.515 2.697 10 0 EFAEHO CN1CCC(C[NH2+]C[C@]2(C)CCCS2)(N2CCCCC2)CC1 ZINC000628220584 479818790 /nfs/dbraw/zinc/81/87/90/479818790.db2.gz BKGUEVGCYQWYRF-KRWDZBQOSA-N 1 3 325.566 2.812 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)CC[N@@H+]1C ZINC000631627988 480189995 /nfs/dbraw/zinc/18/99/95/480189995.db2.gz FDVMZBHEQVQWPE-FRYIKTPZSA-N 1 3 343.515 2.744 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)CC[N@H+]1C ZINC000631627988 480189999 /nfs/dbraw/zinc/18/99/99/480189999.db2.gz FDVMZBHEQVQWPE-FRYIKTPZSA-N 1 3 343.515 2.744 10 0 EFAEHO O[C@H](CC[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(F)F ZINC000631704829 480229518 /nfs/dbraw/zinc/22/95/18/480229518.db2.gz XVSWYLFDCOKMIR-XMTFNYHQSA-N 1 3 338.442 2.893 10 0 EFAEHO NC1(C[NH2+]Cc2ccc(OCc3ccccc3)cc2)CCOCC1 ZINC000629387220 480242720 /nfs/dbraw/zinc/24/27/20/480242720.db2.gz FULSGTXBGFXJRP-UHFFFAOYSA-N 1 3 326.440 2.863 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C[C@H]1CCc2ccccc2C1 ZINC000617505850 480246286 /nfs/dbraw/zinc/24/62/86/480246286.db2.gz SIJVEGRCHAINKB-ROUUACIJSA-N 1 3 345.531 2.570 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C[C@H]1CCc2ccccc2C1 ZINC000617505850 480246293 /nfs/dbraw/zinc/24/62/93/480246293.db2.gz SIJVEGRCHAINKB-ROUUACIJSA-N 1 3 345.531 2.570 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cc(Cl)ccc1Cl ZINC000617503589 480246380 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C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc2c(c1)CCCC2 ZINC000617503628 480247379 /nfs/dbraw/zinc/24/73/79/480247379.db2.gz REBKYDBZBTWAFM-INIZCTEOSA-N 1 3 331.504 2.567 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc2c(c1)CCCC2 ZINC000617503628 480247383 /nfs/dbraw/zinc/24/73/83/480247383.db2.gz REBKYDBZBTWAFM-INIZCTEOSA-N 1 3 331.504 2.567 10 0 EFAEHO C[C@@H](C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1cccc(Cl)c1 ZINC000617505592 480247563 /nfs/dbraw/zinc/24/75/63/480247563.db2.gz JDOLPWAYODBCHS-LSDHHAIUSA-N 1 3 339.911 2.832 10 0 EFAEHO C[C@@H](C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1cccc(Cl)c1 ZINC000617505592 480247568 /nfs/dbraw/zinc/24/75/68/480247568.db2.gz JDOLPWAYODBCHS-LSDHHAIUSA-N 1 3 339.911 2.832 10 0 EFAEHO Cc1ccc2[nH]c(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc2c1C ZINC000617505722 480247886 /nfs/dbraw/zinc/24/78/86/480247886.db2.gz NOFWXHQITKXPKT-HNNXBMFYSA-N 1 3 344.503 2.787 10 0 EFAEHO Cc1ccc2[nH]c(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc2c1C ZINC000617505722 480247889 /nfs/dbraw/zinc/24/78/89/480247889.db2.gz NOFWXHQITKXPKT-HNNXBMFYSA-N 1 3 344.503 2.787 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C[C@H](C)c1ccc(F)cc1 ZINC000617504812 480248080 /nfs/dbraw/zinc/24/80/80/480248080.db2.gz LGWCXBZJRRGHCQ-HOTGVXAUSA-N 1 3 337.483 2.708 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C[C@H](C)c1ccc(F)cc1 ZINC000617504812 480248088 /nfs/dbraw/zinc/24/80/88/480248088.db2.gz LGWCXBZJRRGHCQ-HOTGVXAUSA-N 1 3 337.483 2.708 10 0 EFAEHO CCn1cc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c2ccccc21 ZINC000617503953 480248427 /nfs/dbraw/zinc/24/84/27/480248427.db2.gz BTMVTWFVGVXLME-INIZCTEOSA-N 1 3 344.503 2.663 10 0 EFAEHO CCn1cc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c2ccccc21 ZINC000617503953 480248429 /nfs/dbraw/zinc/24/84/29/480248429.db2.gz BTMVTWFVGVXLME-INIZCTEOSA-N 1 3 344.503 2.663 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccccc1 ZINC000617505750 480248548 /nfs/dbraw/zinc/24/85/48/480248548.db2.gz OJSFOIGCTHVXHS-PKOBYXMFSA-N 1 3 333.520 2.814 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccccc1 ZINC000617505750 480248556 /nfs/dbraw/zinc/24/85/56/480248556.db2.gz OJSFOIGCTHVXHS-PKOBYXMFSA-N 1 3 333.520 2.814 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@H+](C)C(C)(C)C1)N1CCN(c2ccccc2)CC1 ZINC000623357588 480248896 /nfs/dbraw/zinc/24/88/96/480248896.db2.gz WWDZYFCGYKLGND-RTBURBONSA-N 1 3 344.547 2.660 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@@H+](C)C(C)(C)C1)N1CCN(c2ccccc2)CC1 ZINC000623357588 480248904 /nfs/dbraw/zinc/24/89/04/480248904.db2.gz WWDZYFCGYKLGND-RTBURBONSA-N 1 3 344.547 2.660 10 0 EFAEHO CN1CC[C@@H]([NH2+]Cc2ccc(OCC(F)(F)F)nc2)CC1(C)C ZINC000623356938 480248956 /nfs/dbraw/zinc/24/89/56/480248956.db2.gz PNNJAFFCNOHRJB-CYBMUJFWSA-N 1 3 331.382 2.985 10 0 EFAEHO Cc1cccc(CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1Cl ZINC000617507365 480249433 /nfs/dbraw/zinc/24/94/33/480249433.db2.gz UAHAXVIXCKFUOS-HNNXBMFYSA-N 1 3 339.911 2.579 10 0 EFAEHO Cc1cccc(CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1Cl ZINC000617507365 480249439 /nfs/dbraw/zinc/24/94/39/480249439.db2.gz UAHAXVIXCKFUOS-HNNXBMFYSA-N 1 3 339.911 2.579 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C[C@H]1CCCc2ccccc21 ZINC000617506031 480250486 /nfs/dbraw/zinc/25/04/86/480250486.db2.gz YMCZYUHSGOMPRJ-PKOBYXMFSA-N 1 3 345.531 2.885 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C[C@H]1CCCc2ccccc21 ZINC000617506031 480250490 /nfs/dbraw/zinc/25/04/90/480250490.db2.gz YMCZYUHSGOMPRJ-PKOBYXMFSA-N 1 3 345.531 2.885 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cccc(-c2ccoc2)c1 ZINC000617506770 480250651 /nfs/dbraw/zinc/25/06/51/480250651.db2.gz YUFDXYMZLOGHSV-INIZCTEOSA-N 1 3 343.471 2.948 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cccc(-c2ccoc2)c1 ZINC000617506770 480250656 /nfs/dbraw/zinc/25/06/56/480250656.db2.gz YUFDXYMZLOGHSV-INIZCTEOSA-N 1 3 343.471 2.948 10 0 EFAEHO Cc1c2cc(C)ccc2[nH]c1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617506244 480250878 /nfs/dbraw/zinc/25/08/78/480250878.db2.gz GWHKLMKLYOPFRB-HNNXBMFYSA-N 1 3 344.503 2.787 10 0 EFAEHO Cc1c2cc(C)ccc2[nH]c1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617506244 480250884 /nfs/dbraw/zinc/25/08/84/480250884.db2.gz GWHKLMKLYOPFRB-HNNXBMFYSA-N 1 3 344.503 2.787 10 0 EFAEHO CN1CC[C@@H]([NH2+]C[C@@H](c2cccc(F)c2)N2CCOCC2)CC1(C)C ZINC000623379296 480256927 /nfs/dbraw/zinc/25/69/27/480256927.db2.gz IIIIHVGVPLLMNR-MOPGFXCFSA-N 1 3 349.494 2.661 10 0 EFAEHO CC[C@@H]1CN(C(=O)c2ccc(OCC[NH+](CC)CC)cc2)C[C@H](C)N1 ZINC000620904571 480267187 /nfs/dbraw/zinc/26/71/87/480267187.db2.gz RFQGPTDARHAJFQ-FUHWJXTLSA-N 1 3 347.503 2.620 10 0 EFAEHO COC1CCN(C2(C[NH2+][C@H]3CCN(C)C(C)(C)C3)CCCC2)CC1 ZINC000623410371 480269707 /nfs/dbraw/zinc/26/97/07/480269707.db2.gz MFWNXMNMVGQSHZ-KRWDZBQOSA-N 1 3 337.552 2.872 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@H](N[C@@H]3CC[N@H+](C)C(C)(C)C3)C2)c1 ZINC000623439740 480285370 /nfs/dbraw/zinc/28/53/70/480285370.db2.gz WPLFCHOPPKVZSR-CVEARBPZSA-N 1 3 347.503 2.745 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@H](N[C@@H]3CC[N@@H+](C)C(C)(C)C3)C2)c1 ZINC000623439740 480285373 /nfs/dbraw/zinc/28/53/73/480285373.db2.gz WPLFCHOPPKVZSR-CVEARBPZSA-N 1 3 347.503 2.745 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@H]2CCN(C(=O)CCc3ccccc3)C2)CC1(C)C ZINC000623445597 480287814 /nfs/dbraw/zinc/28/78/14/480287814.db2.gz XWPUZYFTGRHOFG-OALUTQOASA-N 1 3 343.515 2.683 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@H]2CCN(C(=O)CCc3ccccc3)C2)CC1(C)C ZINC000623445597 480287819 /nfs/dbraw/zinc/28/78/19/480287819.db2.gz XWPUZYFTGRHOFG-OALUTQOASA-N 1 3 343.515 2.683 10 0 EFAEHO C[C@@H](Cc1ccc(F)cc1Br)NCC1([NH3+])CCOCC1 ZINC000629518664 480291465 /nfs/dbraw/zinc/29/14/65/480291465.db2.gz AOFYXXQLGJDIFK-NSHDSACASA-N 1 3 345.256 2.617 10 0 EFAEHO NC1(C[NH2+][C@@H]2CCc3cc(Br)ccc32)CCOCC1 ZINC000629521001 480293297 /nfs/dbraw/zinc/29/32/97/480293297.db2.gz KINXUNSEJQJPQH-CQSZACIVSA-N 1 3 325.250 2.534 10 0 EFAEHO [NH3+]C[C@@H]1CCCC[C@H]1NC[C@H]1CN(c2ccc(Cl)cc2)CCO1 ZINC000629523678 480294411 /nfs/dbraw/zinc/29/44/11/480294411.db2.gz NKLYUWCINYIVLV-JCGIZDLHSA-N 1 3 337.895 2.652 10 0 EFAEHO NC[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1CN(c2ccc(Cl)cc2)CCO1 ZINC000629523678 480294417 /nfs/dbraw/zinc/29/44/17/480294417.db2.gz NKLYUWCINYIVLV-JCGIZDLHSA-N 1 3 337.895 2.652 10 0 EFAEHO NC1(C[NH2+][C@@H]2CCCc3c(Br)cccc32)CCOCC1 ZINC000629525418 480294441 /nfs/dbraw/zinc/29/44/41/480294441.db2.gz UJNIYVKCZVRROS-OAHLLOKOSA-N 1 3 339.277 2.924 10 0 EFAEHO C[NH2+]CCOCCN[C@H](C)c1cnn(-c2cccc(Cl)c2)c1C ZINC000629529181 480297044 /nfs/dbraw/zinc/29/70/44/480297044.db2.gz UQDUZLFNCVTPRK-CYBMUJFWSA-N 1 3 336.867 2.721 10 0 EFAEHO [NH3+]CCCOCCN[C@@H]1CCc2c1cc(Br)cc2F ZINC000629542510 480297882 /nfs/dbraw/zinc/29/78/82/480297882.db2.gz ZOLFPDOAOVNQKI-CQSZACIVSA-N 1 3 331.229 2.531 10 0 EFAEHO C[C@H]1C[C@H](NCCOCCC[NH3+])c2cccc(Br)c21 ZINC000629538658 480297547 /nfs/dbraw/zinc/29/75/47/480297547.db2.gz MTMFJPFSEJRZBI-FZMZJTMJSA-N 1 3 327.266 2.952 10 0 EFAEHO C[C@@H]1C[C@@H](NCCOCCC[NH3+])c2cccc(Br)c21 ZINC000629538655 480297559 /nfs/dbraw/zinc/29/75/59/480297559.db2.gz MTMFJPFSEJRZBI-BXUZGUMPSA-N 1 3 327.266 2.952 10 0 EFAEHO [NH3+]CCCOCCN[C@@H]1CCCOc2c(Br)cccc21 ZINC000629538783 480297810 /nfs/dbraw/zinc/29/78/10/480297810.db2.gz NAQZEUYHEGNVOO-CQSZACIVSA-N 1 3 343.265 2.618 10 0 EFAEHO [NH3+]CCCOCCN[C@@H](c1ccc(Br)cc1F)C1CC1 ZINC000629535475 480297977 /nfs/dbraw/zinc/29/79/77/480297977.db2.gz CFXZHGJHKSVFMD-OAHLLOKOSA-N 1 3 345.256 2.994 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000629540533 480298120 /nfs/dbraw/zinc/29/81/20/480298120.db2.gz VGYMMOALIVETGO-BBRMVZONSA-N 1 3 348.318 2.940 10 0 EFAEHO CCOCCN(C[C@H]1CCC2(C[NH2+]C2)O1)[C@H]1CCc2ccccc21 ZINC000629573314 480314549 /nfs/dbraw/zinc/31/45/49/480314549.db2.gz FBQDSECLLVCPPK-MJGOQNOKSA-N 1 3 330.472 2.533 10 0 EFAEHO CCOCC[N@H+](C[C@H]1CCC2(CNC2)O1)[C@H]1CCc2ccccc21 ZINC000629573314 480314556 /nfs/dbraw/zinc/31/45/56/480314556.db2.gz FBQDSECLLVCPPK-MJGOQNOKSA-N 1 3 330.472 2.533 10 0 EFAEHO CCOCC[N@@H+](C[C@H]1CCC2(CNC2)O1)[C@H]1CCc2ccccc21 ZINC000629573314 480314561 /nfs/dbraw/zinc/31/45/61/480314561.db2.gz FBQDSECLLVCPPK-MJGOQNOKSA-N 1 3 330.472 2.533 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@H]2CCN(C(=O)Nc3ccccc3)C2)CC1(C)C ZINC000623515547 480322289 /nfs/dbraw/zinc/32/22/89/480322289.db2.gz FQXIVRFIBWQYAE-IRXDYDNUSA-N 1 3 330.476 2.755 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@H]2CCN(C(=O)Nc3ccccc3)C2)CC1(C)C ZINC000623515547 480322298 /nfs/dbraw/zinc/32/22/98/480322298.db2.gz FQXIVRFIBWQYAE-IRXDYDNUSA-N 1 3 330.476 2.755 10 0 EFAEHO C[N@@H+]1CC[C@@H](N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)CC1(C)C ZINC000623515830 480323161 /nfs/dbraw/zinc/32/31/61/480323161.db2.gz RUQSRXMJGLOGPI-MOPGFXCFSA-N 1 3 343.515 2.683 10 0 EFAEHO C[N@H+]1CC[C@@H](N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)CC1(C)C ZINC000623515830 480323167 /nfs/dbraw/zinc/32/31/67/480323167.db2.gz RUQSRXMJGLOGPI-MOPGFXCFSA-N 1 3 343.515 2.683 10 0 EFAEHO NCC(=O)N1CCC[C@H](C[NH2+][C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000629663745 480349464 /nfs/dbraw/zinc/34/94/64/480349464.db2.gz IWTFHMIEVCSKNK-DYVFJYSZSA-N 1 3 335.879 2.504 10 0 EFAEHO CC[C@H]1CCCC[N@@H+]1CCNC(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000623610550 480360907 /nfs/dbraw/zinc/36/09/07/480360907.db2.gz XQARPKNBTGZQQX-WMZOPIPTSA-N 1 3 336.524 2.567 10 0 EFAEHO CC[C@H]1CCCC[N@H+]1CCNC(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000623610550 480360913 /nfs/dbraw/zinc/36/09/13/480360913.db2.gz XQARPKNBTGZQQX-WMZOPIPTSA-N 1 3 336.524 2.567 10 0 EFAEHO CC1(C)OC[C@@H]2C[C@@]21NCc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000623622640 480366524 /nfs/dbraw/zinc/36/65/24/480366524.db2.gz XYKMPWYOFJRWBW-FXAWDEMLSA-N 1 3 330.472 2.818 10 0 EFAEHO C[C@@](O)(C[C@H](O)CNCc1ccc(C[NH+]2CCCCC2)cc1)C1CC1 ZINC000634639799 480389970 /nfs/dbraw/zinc/38/99/70/480389970.db2.gz PHOXMWIGOMOKHX-LEWJYISDSA-N 1 3 346.515 2.674 10 0 EFAEHO CC(C)OC[C@H](O)CNCc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000644522252 480412320 /nfs/dbraw/zinc/41/23/20/480412320.db2.gz GVFAQNPWMIAACZ-FXAWDEMLSA-N 1 3 334.504 2.937 10 0 EFAEHO CC(C)OC[C@H](O)CNCc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000644522252 480412325 /nfs/dbraw/zinc/41/23/25/480412325.db2.gz GVFAQNPWMIAACZ-FXAWDEMLSA-N 1 3 334.504 2.937 10 0 EFAEHO CC[NH+](CC)CCOc1ccccc1NC(=O)N[C@H]1CCCN(C)C1 ZINC000617921766 480419326 /nfs/dbraw/zinc/41/93/26/480419326.db2.gz JFTUTCUOMQLCRZ-INIZCTEOSA-N 1 3 348.491 2.623 10 0 EFAEHO CCN(C(=O)c1ccc(Nc2ccncc2)cc1)[C@H]1CC[N@H+](CC)C1 ZINC000617927834 480423428 /nfs/dbraw/zinc/42/34/28/480423428.db2.gz DGNFNOZXWZGJMK-IBGZPJMESA-N 1 3 338.455 2.803 10 0 EFAEHO CCN(C(=O)c1ccc(Nc2ccncc2)cc1)[C@H]1CC[N@@H+](CC)C1 ZINC000617927834 480423437 /nfs/dbraw/zinc/42/34/37/480423437.db2.gz DGNFNOZXWZGJMK-IBGZPJMESA-N 1 3 338.455 2.803 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2cncc(Cl)c2)[C@H](C)C1 ZINC000621280009 480428435 /nfs/dbraw/zinc/42/84/35/480428435.db2.gz JJWUFRDWHWAJMP-PBHICJAKSA-N 1 3 325.884 2.962 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CCN1CCN(CC2CCSCC2)CC1 ZINC000637984102 480439239 /nfs/dbraw/zinc/43/92/39/480439239.db2.gz BKYSWILMGBXMPA-CALCHBBNSA-N 1 3 325.566 2.620 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(CC2CCSCC2)CC1 ZINC000637984102 480439246 /nfs/dbraw/zinc/43/92/46/480439246.db2.gz BKYSWILMGBXMPA-CALCHBBNSA-N 1 3 325.566 2.620 10 0 EFAEHO CC(C)[NH+]1CCC(N2CCN(CC3CCSCC3)CC2)CC1 ZINC000638151306 480569760 /nfs/dbraw/zinc/56/97/60/480569760.db2.gz BZVHVAHVRSZOBO-UHFFFAOYSA-N 1 3 325.566 2.620 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@H]1CC[C@@H](C)[NH2+]C1)c1ccsc1 ZINC000626934388 480587864 /nfs/dbraw/zinc/58/78/64/480587864.db2.gz YEOUFWRWKUZLLM-VNQPRFMTSA-N 1 3 338.521 2.571 10 0 EFAEHO C[C@@H]1[NH2+]CC[C@H]1NC(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000626945288 480592469 /nfs/dbraw/zinc/59/24/69/480592469.db2.gz HXUMEHMFISUSIC-QXAKKESOSA-N 1 3 344.503 2.509 10 0 EFAEHO C[C@H](NC(C)(C)CNC(=O)N[C@@H]1CC[NH2+]C12CCC2)c1ccccc1 ZINC000626978943 480607406 /nfs/dbraw/zinc/60/74/06/480607406.db2.gz ZQSUHPATMQCFKS-DOTOQJQBSA-N 1 3 344.503 2.700 10 0 EFAEHO C[C@@H]1CC[C@H](NC(=O)N[C@H](CN2CCCCC2)c2ccccc2)C[NH2+]1 ZINC000626978676 480607719 /nfs/dbraw/zinc/60/77/19/480607719.db2.gz HYSJIDJBARCFFB-NZSAHSFTSA-N 1 3 344.503 2.653 10 0 EFAEHO c1cc(C[NH2+]CCCCN2CCN(c3ccccc3)CC2)sn1 ZINC000638385637 480699420 /nfs/dbraw/zinc/69/94/20/480699420.db2.gz GLZIUSKOBKCHHG-UHFFFAOYSA-N 1 3 330.501 2.835 10 0 EFAEHO C[C@H]([NH2+][C@H]1CCN(C2CCC2)C1=O)[C@H]1CCN(Cc2ccccc2)C1 ZINC000624343946 480718864 /nfs/dbraw/zinc/71/88/64/480718864.db2.gz DAWIWQQOVMMZAM-QRFRQXIXSA-N 1 3 341.499 2.640 10 0 EFAEHO C[NH+](C)[C@@H]1C[C@@H](NC(=O)C2CCN(Cc3ccccc3)CC2)C1(C)C ZINC000636088804 480789023 /nfs/dbraw/zinc/78/90/23/480789023.db2.gz IOCYBDMGCITVCD-RTBURBONSA-N 1 3 343.515 2.744 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](NC(=O)C2CCN(Cc3ccccc3)CC2)C1(C)C ZINC000636088801 480789406 /nfs/dbraw/zinc/78/94/06/480789406.db2.gz IOCYBDMGCITVCD-MOPGFXCFSA-N 1 3 343.515 2.744 10 0 EFAEHO CCC1([NH+]2CCCC2)CCN(C(=O)NC[C@H](C)N(C)C2CC2)CC1 ZINC000633090341 480878651 /nfs/dbraw/zinc/87/86/51/480878651.db2.gz CVGHGOQIDNVVRW-INIZCTEOSA-N 1 3 336.524 2.519 10 0 EFAEHO O=C(C[C@H]1CC[NH2+]C1)N[C@H]1CCCCCN(Cc2ccccc2)C1 ZINC000638850868 480895890 /nfs/dbraw/zinc/89/58/90/480895890.db2.gz HWQUMSRKFWVYDE-MOPGFXCFSA-N 1 3 329.488 2.547 10 0 EFAEHO [NH3+][C@@H]1CC[C@H](C(=O)N[C@H]2CCCCCN(Cc3ccccc3)C2)C1 ZINC000638850861 480896269 /nfs/dbraw/zinc/89/62/69/480896269.db2.gz HRAKUIVKJIAKFJ-OTWHNJEPSA-N 1 3 329.488 2.675 10 0 EFAEHO [NH3+][C@@H]1CC[C@H](C(=O)N[C@@H]2CCCCCN(Cc3ccccc3)C2)C1 ZINC000638850860 480896423 /nfs/dbraw/zinc/89/64/23/480896423.db2.gz HRAKUIVKJIAKFJ-IPMKNSEASA-N 1 3 329.488 2.675 10 0 EFAEHO C[N@H+](CCN1CCN(CCC[C@@H]2CCOC2)CC1)Cc1ccccc1 ZINC000645801368 480934239 /nfs/dbraw/zinc/93/42/39/480934239.db2.gz ZPROXJANASZVGU-OAQYLSRUSA-N 1 3 345.531 2.553 10 0 EFAEHO C[N@@H+](CCN1CCN(CCC[C@@H]2CCOC2)CC1)Cc1ccccc1 ZINC000645801368 480934241 /nfs/dbraw/zinc/93/42/41/480934241.db2.gz ZPROXJANASZVGU-OAQYLSRUSA-N 1 3 345.531 2.553 10 0 EFAEHO COc1cncc(/C=C/CCN2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)c1 ZINC000645837914 480941098 /nfs/dbraw/zinc/94/10/98/480941098.db2.gz PPQJRTSRCHWGBT-PERSGTCLSA-N 1 3 345.487 2.677 10 0 EFAEHO Cc1cnc(CC[NH+]2CCC(C)(CN3CCN(C)CC3)CC2)c(C)c1 ZINC000645857284 480945311 /nfs/dbraw/zinc/94/53/11/480945311.db2.gz VTJBGJXKOMYRFZ-UHFFFAOYSA-N 1 3 344.547 2.590 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2CC[C@H]([NH3+])[C@@H](CC)C2)CC1 ZINC000647497388 480968285 /nfs/dbraw/zinc/96/82/85/480968285.db2.gz FMRGAPFQAVDETH-ICSRJNTNSA-N 1 3 344.547 2.778 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000661404399 480993125 /nfs/dbraw/zinc/99/31/25/480993125.db2.gz YBJDMPOTQDCZJP-IRXDYDNUSA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000661404399 480993131 /nfs/dbraw/zinc/99/31/31/480993131.db2.gz YBJDMPOTQDCZJP-IRXDYDNUSA-N 1 3 338.540 2.526 10 0 EFAEHO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(CC)[C@@H]2CCN(C)C2)C1 ZINC000664073126 481004330 /nfs/dbraw/zinc/00/43/30/481004330.db2.gz NNBSJOJVMRNDBE-IAGOWNOFSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N(CC)[C@@H]2CCN(C)C2)C1 ZINC000664073126 481004332 /nfs/dbraw/zinc/00/43/32/481004332.db2.gz NNBSJOJVMRNDBE-IAGOWNOFSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(CC)[C@@H]2CCN(C)C2)C1 ZINC000664073125 481005286 /nfs/dbraw/zinc/00/52/86/481005286.db2.gz NNBSJOJVMRNDBE-DLBZAZTESA-N 1 3 338.540 2.623 10 0 EFAEHO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)N(CC)[C@@H]2CCN(C)C2)C1 ZINC000664073125 481005293 /nfs/dbraw/zinc/00/52/93/481005293.db2.gz NNBSJOJVMRNDBE-DLBZAZTESA-N 1 3 338.540 2.623 10 0 EFAEHO CCN(C(=O)N[C@H]1CC[N@@H+](C2CCCCC2)C1)[C@@H]1CCN(CC)C1 ZINC000666659772 481015452 /nfs/dbraw/zinc/01/54/52/481015452.db2.gz ZVNFYXSGYIYLIT-FUHWJXTLSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN(C(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1)[C@@H]1CCN(CC)C1 ZINC000666659772 481015460 /nfs/dbraw/zinc/01/54/60/481015460.db2.gz ZVNFYXSGYIYLIT-FUHWJXTLSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN(C(=O)N[C@@H]1CC[N@@H+](C2CCCCC2)C1)[C@@H]1CCN(CC)C1 ZINC000666659774 481015526 /nfs/dbraw/zinc/01/55/26/481015526.db2.gz ZVNFYXSGYIYLIT-SJLPKXTDSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN(C(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1)[C@@H]1CCN(CC)C1 ZINC000666659774 481015533 /nfs/dbraw/zinc/01/55/33/481015533.db2.gz ZVNFYXSGYIYLIT-SJLPKXTDSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)[C@H]1CC[C@@H](C2CC2)[NH2+]1)c1ccsc1 ZINC000653109981 481084937 /nfs/dbraw/zinc/08/49/37/481084937.db2.gz UCBDQIOBMWLUIU-GVDBMIGSSA-N 1 3 335.517 2.778 10 0 EFAEHO C[C@@H](CCN1CCOC2(CC[NH+](C)CC2)C1)OCc1ccccc1 ZINC000646105727 481090903 /nfs/dbraw/zinc/09/09/03/481090903.db2.gz FHAOFLPEUZFYLY-SFHVURJKSA-N 1 3 332.488 2.778 10 0 EFAEHO O[C@H]1CC[N@H+](Cc2ccc(CNc3ccnc4ccccc43)cc2)C1 ZINC000664238266 481121543 /nfs/dbraw/zinc/12/15/43/481121543.db2.gz FSPFUHLVQIUOGW-SFHVURJKSA-N 1 3 333.435 2.835 10 0 EFAEHO O[C@H]1CC[N@@H+](Cc2ccc(CNc3ccnc4ccccc43)cc2)C1 ZINC000664238266 481121547 /nfs/dbraw/zinc/12/15/47/481121547.db2.gz FSPFUHLVQIUOGW-SFHVURJKSA-N 1 3 333.435 2.835 10 0 EFAEHO COc1cc2ccnc(NCC[N@H+](C)CCCN(C)C)c2cc1OC ZINC000664244416 481128046 /nfs/dbraw/zinc/12/80/46/481128046.db2.gz HPADHGFQDMOAHI-UHFFFAOYSA-N 1 3 346.475 2.547 10 0 EFAEHO COc1cc2ccnc(NCC[N@@H+](C)CCCN(C)C)c2cc1OC ZINC000664244416 481128055 /nfs/dbraw/zinc/12/80/55/481128055.db2.gz HPADHGFQDMOAHI-UHFFFAOYSA-N 1 3 346.475 2.547 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1cccc2ccn(C)c21 ZINC000666857185 481150241 /nfs/dbraw/zinc/15/02/41/481150241.db2.gz OCBFNZYMNRONSL-HNNXBMFYSA-N 1 3 345.491 2.572 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1cccc2ccn(C)c21 ZINC000666857185 481150247 /nfs/dbraw/zinc/15/02/47/481150247.db2.gz OCBFNZYMNRONSL-HNNXBMFYSA-N 1 3 345.491 2.572 10 0 EFAEHO C[C@@H]1CC[NH2+]C[C@@H]1NC(=O)N[C@H](CN1CCCCC1)c1ccccc1 ZINC000669483617 481150830 /nfs/dbraw/zinc/15/08/30/481150830.db2.gz DPSKSWCJRXGCRT-NZSAHSFTSA-N 1 3 344.503 2.511 10 0 EFAEHO CSc1cc(NC(=O)N(CCN(C)C)CC[NH+](C)C)ccc1C ZINC000650536395 481164751 /nfs/dbraw/zinc/16/47/51/481164751.db2.gz PHCOOHXDIHWSKS-UHFFFAOYSA-N 1 3 338.521 2.674 10 0 EFAEHO C[NH+]1CCC2(CCN(C(=O)[C@H]3CCCN3Cc3ccccc3)C2)CC1 ZINC000646248929 481182176 /nfs/dbraw/zinc/18/21/76/481182176.db2.gz WOOXMWCOSPQFDA-LJQANCHMSA-N 1 3 341.499 2.595 10 0 EFAEHO CCC[N@H+](CC)C[C@@H](C)NC(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659047213 481188026 /nfs/dbraw/zinc/18/80/26/481188026.db2.gz QNOGEHRBBORFRN-CRAIPNDOSA-N 1 3 348.491 2.589 10 0 EFAEHO CCC[N@@H+](CC)C[C@@H](C)NC(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659047213 481188035 /nfs/dbraw/zinc/18/80/35/481188035.db2.gz QNOGEHRBBORFRN-CRAIPNDOSA-N 1 3 348.491 2.589 10 0 EFAEHO CN(C)CCOc1ccc(CN2CCCC[C@H]2[C@H]2CC[NH2+]C2)cc1 ZINC000666968823 481228449 /nfs/dbraw/zinc/22/84/49/481228449.db2.gz KRZMGZBXRNBIBJ-ICSRJNTNSA-N 1 3 331.504 2.591 10 0 EFAEHO NCC(=O)N1CCC[C@@H](C[NH2+]C2(c3ccccc3Cl)CCC2)C1 ZINC000650704092 481271632 /nfs/dbraw/zinc/27/16/32/481271632.db2.gz HCGGSLDPTLHWJL-AWEZNQCLSA-N 1 3 335.879 2.506 10 0 EFAEHO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCN(Cc3ccnn3-c3ccccc3)C2)C1 ZINC000650707724 481277508 /nfs/dbraw/zinc/27/75/08/481277508.db2.gz LVBMIQDRCWWKQY-SQGPQFPESA-N 1 3 340.471 2.591 10 0 EFAEHO COc1ccc(OCc2ccccn2)c(CNCCC2(C[NH3+])CC2)c1 ZINC000650713398 481282546 /nfs/dbraw/zinc/28/25/46/481282546.db2.gz RLIYQGPYPATCRS-UHFFFAOYSA-N 1 3 341.455 2.888 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@@H](C)CC(=O)NCCc1ccccc1 ZINC000650719427 481287010 /nfs/dbraw/zinc/28/70/10/481287010.db2.gz PVNQDWIMTALNKT-KRWDZBQOSA-N 1 3 339.483 2.633 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@@H](C)CC(=O)Nc1ccc(OC)cc1 ZINC000650719648 481288061 /nfs/dbraw/zinc/28/80/61/481288061.db2.gz XNTLBNZLQAZEAF-HNNXBMFYSA-N 1 3 341.455 2.922 10 0 EFAEHO [NH3+][C@@H]1CCO[C@H]([C@H]2CCCCN2Cc2cc(-c3ccccc3)n[nH]2)C1 ZINC000650723122 481291737 /nfs/dbraw/zinc/29/17/37/481291737.db2.gz HRJFLFXEHHBVGZ-AHRSYUTCSA-N 1 3 340.471 2.938 10 0 EFAEHO COCCOc1ccc(CN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)cc1 ZINC000650723925 481292474 /nfs/dbraw/zinc/29/24/74/481292474.db2.gz VXAPWQOEGOHWLG-RLLQIKCJSA-N 1 3 348.487 2.573 10 0 EFAEHO COCCOc1ccc(CN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)cc1 ZINC000650723924 481292577 /nfs/dbraw/zinc/29/25/77/481292577.db2.gz VXAPWQOEGOHWLG-MISYRCLQSA-N 1 3 348.487 2.573 10 0 EFAEHO COc1cc(C)c(CN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)cc1OC ZINC000650723886 481293141 /nfs/dbraw/zinc/29/31/41/481293141.db2.gz VJGNOBKSQVZOCB-KURKYZTESA-N 1 3 348.487 2.873 10 0 EFAEHO COc1cc(C)c(CN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)cc1OC ZINC000650723887 481293233 /nfs/dbraw/zinc/29/32/33/481293233.db2.gz VJGNOBKSQVZOCB-KZNAEPCWSA-N 1 3 348.487 2.873 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000664539155 481316981 /nfs/dbraw/zinc/31/69/81/481316981.db2.gz CXBHWWUYYUCQOU-MSOLQXFVSA-N 1 3 346.519 2.851 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000664539155 481316989 /nfs/dbraw/zinc/31/69/89/481316989.db2.gz CXBHWWUYYUCQOU-MSOLQXFVSA-N 1 3 346.519 2.851 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@@H](C)CC(=O)N(C)c1ccccc1 ZINC000650758726 481321774 /nfs/dbraw/zinc/32/17/74/481321774.db2.gz WOJUMIIOEXVMKZ-INIZCTEOSA-N 1 3 325.456 2.937 10 0 EFAEHO C[C@H]([NH3+])c1ccc(NC(=O)C(C[C@H]2COCCO2)C(F)(F)F)cc1 ZINC000659295290 481343337 /nfs/dbraw/zinc/34/33/37/481343337.db2.gz WGWCDRVGQOJQAK-BPNCWPANSA-N 1 3 346.349 2.629 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2)cc1 ZINC000659364162 481385022 /nfs/dbraw/zinc/38/50/22/481385022.db2.gz ISVVQFWGWQBJNT-ACJLOTCBSA-N 1 3 325.412 2.620 10 0 EFAEHO C[C@H]([NH3+])c1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)cc1 ZINC000659364164 481385083 /nfs/dbraw/zinc/38/50/83/481385083.db2.gz ISVVQFWGWQBJNT-SCLBCKFNSA-N 1 3 325.412 2.620 10 0 EFAEHO [NH3+][C@@H](CC1CCCCC1)C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659366442 481387310 /nfs/dbraw/zinc/38/73/10/481387310.db2.gz KBAYDRAAZXOBNB-ROUUACIJSA-N 1 3 331.460 2.584 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000659426751 481428383 /nfs/dbraw/zinc/42/83/83/481428383.db2.gz CGUOIHZROKOFBN-CABCVRRESA-N 1 3 338.521 2.558 10 0 EFAEHO [NH3+]C1(CNC(=O)NCc2ccccc2CN2CCCCC2)CCCC1 ZINC000659429628 481429066 /nfs/dbraw/zinc/42/90/66/481429066.db2.gz VGHGCKWVWCZYOK-UHFFFAOYSA-N 1 3 344.503 2.743 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)NCC[C@@H]([NH3+])C(C)C)c1ccccc1 ZINC000659427070 481430016 /nfs/dbraw/zinc/43/00/16/481430016.db2.gz KEJCEKYZKUYANK-MSOLQXFVSA-N 1 3 334.508 2.742 10 0 EFAEHO CN(CC(C)(C)[NH3+])C(=O)NCc1ccccc1CN1CCCCC1 ZINC000659429893 481431119 /nfs/dbraw/zinc/43/11/19/481431119.db2.gz YKPPDROFDMZIQQ-UHFFFAOYSA-N 1 3 332.492 2.551 10 0 EFAEHO CCN(C(=O)NCC[NH2+]C1CC1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000637297644 481438526 /nfs/dbraw/zinc/43/85/26/481438526.db2.gz PXMDJOZKHIZGDM-APWZRJJASA-N 1 3 344.503 2.605 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)NCC(C)(C)N[C@@H](C)c1ccccc1 ZINC000659453917 481445016 /nfs/dbraw/zinc/44/50/16/481445016.db2.gz AHWRACYICPZHNV-DOTOQJQBSA-N 1 3 334.508 2.788 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C ZINC000659466031 481453787 /nfs/dbraw/zinc/45/37/87/481453787.db2.gz OGSJQSVVISVSMB-UHOSZYNNSA-N 1 3 346.519 2.570 10 0 EFAEHO C[C@@H]([NH2+]CC(=O)NC[C@@H](c1ccccc1)N(C)C)C1CCC(F)CC1 ZINC000661999920 481475610 /nfs/dbraw/zinc/47/56/10/481475610.db2.gz DRQDABLTXWLSME-JVDULTGUSA-N 1 3 349.494 2.912 10 0 EFAEHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 ZINC000643479527 481486489 /nfs/dbraw/zinc/48/64/89/481486489.db2.gz NCVXVPUDFBGKOI-UAGQMJEPSA-N 1 3 343.450 2.506 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000659624481 481520299 /nfs/dbraw/zinc/52/02/99/481520299.db2.gz UXWRPNBPJZFRHC-PKOBYXMFSA-N 1 3 346.519 2.666 10 0 EFAEHO CCN(Cc1ccc(CN(C)C)cc1)C(=O)NCC[C@@H]([NH3+])C(C)C ZINC000659625114 481522303 /nfs/dbraw/zinc/52/23/03/481522303.db2.gz NBWFDLBHVYHPCR-GOSISDBHSA-N 1 3 334.508 2.653 10 0 EFAEHO C[C@H](CC[NH+]1CCC(N2CC[C@@H](O)C2)CC1)OCc1ccccc1 ZINC000662151793 481595673 /nfs/dbraw/zinc/59/56/73/481595673.db2.gz LIOLYGWYZVSJGC-YLJYHZDGSA-N 1 3 332.488 2.513 10 0 EFAEHO C[C@H]1[C@@H]([NH3+])CCN1C(=O)c1ccccc1OCCN1CCCC[C@H]1C ZINC000647044866 481615888 /nfs/dbraw/zinc/61/58/88/481615888.db2.gz QKCKDEZFGBNAJA-RYRKJORJSA-N 1 3 345.487 2.502 10 0 EFAEHO C[N@H+](CCCc1cc(-c2ccccc2)no1)C[C@@H]1CCC2(CNC2)O1 ZINC000662252907 481666245 /nfs/dbraw/zinc/66/62/45/481666245.db2.gz DAILNWBQJFGWCJ-SFHVURJKSA-N 1 3 341.455 2.727 10 0 EFAEHO C[N@@H+](CCCc1cc(-c2ccccc2)no1)C[C@@H]1CCC2(CNC2)O1 ZINC000662252907 481666252 /nfs/dbraw/zinc/66/62/52/481666252.db2.gz DAILNWBQJFGWCJ-SFHVURJKSA-N 1 3 341.455 2.727 10 0 EFAEHO CN(Cc1ccc(OC(F)(F)F)cc1)C[C@@H]1CCC2(C[NH2+]C2)O1 ZINC000662250468 481666979 /nfs/dbraw/zinc/66/69/79/481666979.db2.gz IVPJRNPYCRALRU-AWEZNQCLSA-N 1 3 330.350 2.538 10 0 EFAEHO O=C1CCCCN1CC1CCN(Cc2cccc3c2CC[NH2+]C3)CC1 ZINC000662254350 481671211 /nfs/dbraw/zinc/67/12/11/481671211.db2.gz HNTMHMKKXYYMBJ-UHFFFAOYSA-N 1 3 341.499 2.557 10 0 EFAEHO O=C1CCCCN1CC1CC[NH+](Cc2cccc3c2CCNC3)CC1 ZINC000662254350 481671215 /nfs/dbraw/zinc/67/12/15/481671215.db2.gz HNTMHMKKXYYMBJ-UHFFFAOYSA-N 1 3 341.499 2.557 10 0 EFAEHO CC[C@H](NCc1ccc(OCC[NH+]2CCCC2)cc1)[C@@H](O)C(F)F ZINC000648694038 481672244 /nfs/dbraw/zinc/67/22/44/481672244.db2.gz VGDWYAYZAWOPDA-DLBZAZTESA-N 1 3 342.430 2.655 10 0 EFAEHO c1ccc2c(c1)CCC[C@@]21CCC[N@@H+](C[C@@H]2CCC3(CNC3)O2)C1 ZINC000662259036 481673407 /nfs/dbraw/zinc/67/34/07/481673407.db2.gz OOXJPWSNINJLBO-ICSRJNTNSA-N 1 3 326.484 2.878 10 0 EFAEHO c1ccc2c(c1)CCC[C@@]21CCC[N@H+](C[C@@H]2CCC3(CNC3)O2)C1 ZINC000662259036 481673411 /nfs/dbraw/zinc/67/34/11/481673411.db2.gz OOXJPWSNINJLBO-ICSRJNTNSA-N 1 3 326.484 2.878 10 0 EFAEHO COC[C@@H](CN1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2)OC ZINC000659979663 481680330 /nfs/dbraw/zinc/68/03/30/481680330.db2.gz NLCGECRZGUMCKA-WOJBJXKFSA-N 1 3 332.488 2.636 10 0 EFAEHO COC[C@@H](CN1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2)OC ZINC000659979663 481680335 /nfs/dbraw/zinc/68/03/35/481680335.db2.gz NLCGECRZGUMCKA-WOJBJXKFSA-N 1 3 332.488 2.636 10 0 EFAEHO Fc1ccc([C@H](CC(F)(F)F)NC[C@@H]2CCC3(C[NH2+]C3)O2)cc1 ZINC000662281123 481689261 /nfs/dbraw/zinc/68/92/61/481689261.db2.gz IOTXSMNBFKYGMM-KBPBESRZSA-N 1 3 332.341 2.930 10 0 EFAEHO CCC[N@H+](C[C@@H]1CCC2(CNC2)O1)[C@H](C)CC(=O)Nc1ccccc1 ZINC000662283525 481690964 /nfs/dbraw/zinc/69/09/64/481690964.db2.gz UTVPEDBOHYEONU-AEFFLSMTSA-N 1 3 345.487 2.637 10 0 EFAEHO CCC[N@@H+](C[C@@H]1CCC2(CNC2)O1)[C@H](C)CC(=O)Nc1ccccc1 ZINC000662283525 481690970 /nfs/dbraw/zinc/69/09/70/481690970.db2.gz UTVPEDBOHYEONU-AEFFLSMTSA-N 1 3 345.487 2.637 10 0 EFAEHO CCO[C@@H](CC[NH+](C)C)CNCc1cnn(-c2ccccc2C)c1 ZINC000647190722 481695486 /nfs/dbraw/zinc/69/54/86/481695486.db2.gz MAQDUHCCQTWQLM-SFHVURJKSA-N 1 3 330.476 2.627 10 0 EFAEHO C[C@@H]1CCCC[C@H]1N(C)C(=O)CN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662294032 481698054 /nfs/dbraw/zinc/69/80/54/481698054.db2.gz AFVWAIZYUVIIPB-NZSAHSFTSA-N 1 3 335.536 2.735 10 0 EFAEHO COc1ccc([C@@H](NC[C@@H]2CCC3(C[NH2+]C3)O2)c2ccccc2)cc1 ZINC000662299625 481704934 /nfs/dbraw/zinc/70/49/34/481704934.db2.gz SPVBKNQCIHQQOP-PMACEKPBSA-N 1 3 338.451 2.895 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)[C@H]3CCCC4(CC4)C3)CC2)CC1 ZINC000667642089 481706271 /nfs/dbraw/zinc/70/62/71/481706271.db2.gz OCAPAZNJDNRWJU-INIZCTEOSA-N 1 3 333.520 2.632 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N[C@@H]1CCC[C@H](C2CC2)C1 ZINC000665188576 481709493 /nfs/dbraw/zinc/70/94/93/481709493.db2.gz NSRJNMNRQNDZHI-RYQLBKOJSA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N[C@@H]1CCC[C@H](C2CC2)C1 ZINC000665188576 481709501 /nfs/dbraw/zinc/70/95/01/481709501.db2.gz NSRJNMNRQNDZHI-RYQLBKOJSA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H]1CCCN(Cc2nnc(-c3ccccc3)n2C)[C@@H]1CCC[NH3+] ZINC000662316727 481720469 /nfs/dbraw/zinc/72/04/69/481720469.db2.gz MQDIHHWOFMNYAT-NVXWUHKLSA-N 1 3 327.476 2.822 10 0 EFAEHO C[N@@H+]1C[C@@H](CNCc2ccccc2-n2cncn2)[C@H](c2ccccc2)C1 ZINC000647249043 481728449 /nfs/dbraw/zinc/72/84/49/481728449.db2.gz ZNLDJNGHFSBZKQ-UXHICEINSA-N 1 3 347.466 2.702 10 0 EFAEHO C[N@H+]1C[C@@H](CNCc2ccccc2-n2cncn2)[C@H](c2ccccc2)C1 ZINC000647249043 481728456 /nfs/dbraw/zinc/72/84/56/481728456.db2.gz ZNLDJNGHFSBZKQ-UXHICEINSA-N 1 3 347.466 2.702 10 0 EFAEHO c1ccc2c(CCN[C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)ccnc2c1 ZINC000665239092 481737561 /nfs/dbraw/zinc/73/75/61/481737561.db2.gz LXJMEURHKMSGLY-MISYRCLQSA-N 1 3 325.456 2.524 10 0 EFAEHO CCOc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@H]2C[C@H](C)N(C3CC3)C2)cc1 ZINC000665254907 481748779 /nfs/dbraw/zinc/74/87/79/481748779.db2.gz CAGQZCTWUKZHNN-OQRYQMPQSA-N 1 3 343.515 2.746 10 0 EFAEHO COc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@H](C)[C@@H]2CCCOC2)cc1F ZINC000665259762 481755181 /nfs/dbraw/zinc/75/51/81/481755181.db2.gz PCVFSVQERSGXKU-KBEGMRNHSA-N 1 3 336.451 2.685 10 0 EFAEHO C[C@@H]1CCCC[C@H]1[NH+]1CCC(NCC(C)(C)[C@]2(O)CCOC2)CC1 ZINC000647340100 481768286 /nfs/dbraw/zinc/76/82/86/481768286.db2.gz DYNFNWKKWGUBNI-POAQFYNOSA-N 1 3 338.536 2.797 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(N[C@H](C)c2ccccc2Cl)CC1 ZINC000665285158 481770038 /nfs/dbraw/zinc/77/00/38/481770038.db2.gz FCIXJUPBMHNFLG-CQSZACIVSA-N 1 3 337.895 2.981 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](CCCNC(=O)C[C@@H]2NCc3ccccc32)C1 ZINC000662387842 481778063 /nfs/dbraw/zinc/77/80/63/481778063.db2.gz XFBIEUXYUSZIGM-FCEWJHQRSA-N 1 3 329.488 2.705 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)C[C@@H]2NCc3ccccc32)C1 ZINC000662387842 481778070 /nfs/dbraw/zinc/77/80/70/481778070.db2.gz XFBIEUXYUSZIGM-FCEWJHQRSA-N 1 3 329.488 2.705 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)C[C@H]2NCc3ccccc32)C1 ZINC000662387845 481778119 /nfs/dbraw/zinc/77/81/19/481778119.db2.gz XFBIEUXYUSZIGM-GPMSIDNRSA-N 1 3 329.488 2.705 10 0 EFAEHO CO[C@@H](CN(C)CC[N@H+](C)C1CCN(C)CC1)C1CCCCC1 ZINC000660139658 481783028 /nfs/dbraw/zinc/78/30/28/481783028.db2.gz YLZQXSULYWYQNY-IBGZPJMESA-N 1 3 325.541 2.540 10 0 EFAEHO CO[C@@H](CN(C)CC[N@@H+](C)C1CCN(C)CC1)C1CCCCC1 ZINC000660139658 481783040 /nfs/dbraw/zinc/78/30/40/481783040.db2.gz YLZQXSULYWYQNY-IBGZPJMESA-N 1 3 325.541 2.540 10 0 EFAEHO CC(C)(C)CCN1CCN(C(=O)C[C@H]2[NH2+]Cc3ccccc32)CC1 ZINC000662400385 481785878 /nfs/dbraw/zinc/78/58/78/481785878.db2.gz UYZGPHSDLZXHNG-GOSISDBHSA-N 1 3 329.488 2.801 10 0 EFAEHO C[NH+](C)CCOc1ccc(NC(=O)C[C@H]2NCc3ccccc32)cc1 ZINC000662399410 481786140 /nfs/dbraw/zinc/78/61/40/481786140.db2.gz STEQOXOOSQEDRJ-LJQANCHMSA-N 1 3 339.439 2.800 10 0 EFAEHO CCCCN1CCCC[C@@H]1CNC(=O)c1cc(C2CC[NH2+]CC2)no1 ZINC000662429181 481801082 /nfs/dbraw/zinc/80/10/82/481801082.db2.gz KIQROEJENUXEDN-MRXNPFEDSA-N 1 3 348.491 2.526 10 0 EFAEHO CCN(C(=O)C[C@H]1CC[NH2+]C1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000662501827 481845170 /nfs/dbraw/zinc/84/51/70/481845170.db2.gz DTCDMARUVMIEEC-SCTDSRPQSA-N 1 3 329.488 2.670 10 0 EFAEHO C[N@H+](CCCNC(=O)NC[C@H]1CCN1C(C)(C)C)C1CCCCC1 ZINC000660280270 481872330 /nfs/dbraw/zinc/87/23/30/481872330.db2.gz OIYLYCLTDLLPGY-QGZVFWFLSA-N 1 3 338.540 2.813 10 0 EFAEHO C[N@@H+](CCCNC(=O)NC[C@H]1CCN1C(C)(C)C)C1CCCCC1 ZINC000660280270 481872339 /nfs/dbraw/zinc/87/23/39/481872339.db2.gz OIYLYCLTDLLPGY-QGZVFWFLSA-N 1 3 338.540 2.813 10 0 EFAEHO C[N@H+](CCCNC(=O)NC[C@@H]1CCN1C(C)(C)C)C1CCCCC1 ZINC000660280269 481872832 /nfs/dbraw/zinc/87/28/32/481872832.db2.gz OIYLYCLTDLLPGY-KRWDZBQOSA-N 1 3 338.540 2.813 10 0 EFAEHO C[N@@H+](CCCNC(=O)NC[C@@H]1CCN1C(C)(C)C)C1CCCCC1 ZINC000660280269 481872834 /nfs/dbraw/zinc/87/28/34/481872834.db2.gz OIYLYCLTDLLPGY-KRWDZBQOSA-N 1 3 338.540 2.813 10 0 EFAEHO COC[C@H](CC(C)(C)C)[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000651723008 481920644 /nfs/dbraw/zinc/92/06/44/481920644.db2.gz ACBDMAOFHXFOHI-SFHVURJKSA-N 1 3 339.568 2.978 10 0 EFAEHO O=C(NCc1ccccc1C[NH+]1CCCC1)C1(NC2CC2)CCC1 ZINC000662668815 481924768 /nfs/dbraw/zinc/92/47/68/481924768.db2.gz JSBZMMCOUPQZJZ-UHFFFAOYSA-N 1 3 327.472 2.573 10 0 EFAEHO O=C(NC[C@H]1CCC[N@H+](Cc2ccccc2)C1)C1(NC2CC2)CCC1 ZINC000662694644 481936466 /nfs/dbraw/zinc/93/64/66/481936466.db2.gz ZHNGYDHDXAZIRM-GOSISDBHSA-N 1 3 341.499 2.690 10 0 EFAEHO O=C(NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)C1(NC2CC2)CCC1 ZINC000662694644 481936470 /nfs/dbraw/zinc/93/64/70/481936470.db2.gz ZHNGYDHDXAZIRM-GOSISDBHSA-N 1 3 341.499 2.690 10 0 EFAEHO C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)C2([NH2+]C3CC3)CCC2)C1 ZINC000662696056 481937974 /nfs/dbraw/zinc/93/79/74/481937974.db2.gz HLBREOBYRCDHTC-CRAIPNDOSA-N 1 3 327.472 2.613 10 0 EFAEHO CCC[C@@H](N)C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662710637 481943559 /nfs/dbraw/zinc/94/35/59/481943559.db2.gz IYGAGJWEVCLTIK-ZWKOTPCHSA-N 1 3 329.488 2.532 10 0 EFAEHO CCC[C@@H](N)C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662710637 481943563 /nfs/dbraw/zinc/94/35/63/481943563.db2.gz IYGAGJWEVCLTIK-ZWKOTPCHSA-N 1 3 329.488 2.532 10 0 EFAEHO CC(C)C[C@@H](N)C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662712967 481945706 /nfs/dbraw/zinc/94/57/06/481945706.db2.gz WIETWDFHXNJZLW-RTBURBONSA-N 1 3 343.515 2.778 10 0 EFAEHO CC(C)C[C@@H](N)C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662712967 481945710 /nfs/dbraw/zinc/94/57/10/481945710.db2.gz WIETWDFHXNJZLW-RTBURBONSA-N 1 3 343.515 2.778 10 0 EFAEHO C[C@@H]([NH2+]C(C)(C)CNC(=O)C1(NC2CC2)CCC1)c1ccccc1 ZINC000662718125 481947042 /nfs/dbraw/zinc/94/70/42/481947042.db2.gz LRZIGWQCMOBQBS-OAHLLOKOSA-N 1 3 329.488 2.907 10 0 EFAEHO C[C@@H]([NH3+])CC(=O)N1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000662754779 481959995 /nfs/dbraw/zinc/95/99/95/481959995.db2.gz AFNJPYHSLAWUOE-OXQOHEQNSA-N 1 3 343.515 2.873 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CCC[C@H]1c1ccccc1 ZINC000665637568 481973312 /nfs/dbraw/zinc/97/33/12/481973312.db2.gz HKQMQXPNJPSXBV-HKUYNNGSSA-N 1 3 346.519 2.805 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CCC[C@H]1c1ccccc1 ZINC000665637568 481973316 /nfs/dbraw/zinc/97/33/16/481973316.db2.gz HKQMQXPNJPSXBV-HKUYNNGSSA-N 1 3 346.519 2.805 10 0 EFAEHO CC(C)(C)N1CC[C@H](NC(=O)c2ccccc2CC2CC[NH2+]CC2)C1 ZINC000662853600 481995865 /nfs/dbraw/zinc/99/58/65/481995865.db2.gz QVNCPCUEPFOILP-SFHVURJKSA-N 1 3 343.515 2.831 10 0 EFAEHO CN(CCc1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2[NH2+]CCCC2(C)C)C1 ZINC000662873320 482000269 /nfs/dbraw/zinc/00/02/69/482000269.db2.gz WGBZXTRPUBUBJR-MOPGFXCFSA-N 1 3 343.515 2.540 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)Cc1c(C2CCC2)cnn1C ZINC000668159898 482006130 /nfs/dbraw/zinc/00/61/30/482006130.db2.gz KSVBRBGMQJEUFE-SFHVURJKSA-N 1 3 347.551 2.536 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)Cc1c(C2CCC2)cnn1C ZINC000668159898 482006131 /nfs/dbraw/zinc/00/61/31/482006131.db2.gz KSVBRBGMQJEUFE-SFHVURJKSA-N 1 3 347.551 2.536 10 0 EFAEHO C[N@H+](Cc1ccccc1NC(=O)COC1(C)CNC1)C1CCCCC1 ZINC000649276804 482008624 /nfs/dbraw/zinc/00/86/24/482008624.db2.gz IUIPMOBHHPRMOE-UHFFFAOYSA-N 1 3 345.487 2.768 10 0 EFAEHO C[N@@H+](Cc1ccccc1NC(=O)COC1(C)CNC1)C1CCCCC1 ZINC000649276804 482008629 /nfs/dbraw/zinc/00/86/29/482008629.db2.gz IUIPMOBHHPRMOE-UHFFFAOYSA-N 1 3 345.487 2.768 10 0 EFAEHO CCN(C(=O)[C@@H]1[NH2+]CC1(C)C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000649306015 482022415 /nfs/dbraw/zinc/02/24/15/482022415.db2.gz UBYRZFROXVSJLS-SZMVWBNQSA-N 1 3 329.488 2.668 10 0 EFAEHO CC[C@H]1CCCCCN1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000665759098 482038666 /nfs/dbraw/zinc/03/86/66/482038666.db2.gz ZQGQXJFOTLQZMF-IRXDYDNUSA-N 1 3 326.529 2.623 10 0 EFAEHO CC[C@H]1CCCCCN1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000665759098 482038672 /nfs/dbraw/zinc/03/86/72/482038672.db2.gz ZQGQXJFOTLQZMF-IRXDYDNUSA-N 1 3 326.529 2.623 10 0 EFAEHO CC(C)CN(C)CCC[NH2+][C@H]1CCN(Cc2ccccn2)C[C@H]1C ZINC000652221912 482130345 /nfs/dbraw/zinc/13/03/45/482130345.db2.gz AEDXISVTZYFIBQ-QUCCMNQESA-N 1 3 332.536 2.860 10 0 EFAEHO CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)CS1 ZINC000668488577 482142541 /nfs/dbraw/zinc/14/25/41/482142541.db2.gz BVXFKZNTUWWLLT-QYZOEREBSA-N 1 3 334.529 2.873 10 0 EFAEHO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCN(CCOc3ccccc3Cl)C2)C1 ZINC000652345621 482182459 /nfs/dbraw/zinc/18/24/59/482182459.db2.gz GUQBOQIVOLMMMV-HDMKZQKVSA-N 1 3 338.879 2.937 10 0 EFAEHO [NH3+][C@@H]1CCO[C@H]([C@H]2CCCN(CCOc3ccccc3Cl)C2)C1 ZINC000652345620 482182912 /nfs/dbraw/zinc/18/29/12/482182912.db2.gz GUQBOQIVOLMMMV-DAYGRLMNSA-N 1 3 338.879 2.937 10 0 EFAEHO CC(C)OC[C@@H](O)C[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000663368517 482185905 /nfs/dbraw/zinc/18/59/05/482185905.db2.gz HVGNVLLDJVQODQ-PMACEKPBSA-N 1 3 346.515 2.664 10 0 EFAEHO CC(C)OC[C@@H](O)CNC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000663368517 482185912 /nfs/dbraw/zinc/18/59/12/482185912.db2.gz HVGNVLLDJVQODQ-PMACEKPBSA-N 1 3 346.515 2.664 10 0 EFAEHO CC(C)OC[C@@H](O)CNC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000663368517 482185916 /nfs/dbraw/zinc/18/59/16/482185916.db2.gz HVGNVLLDJVQODQ-PMACEKPBSA-N 1 3 346.515 2.664 10 0 EFAEHO Cn1cc(C[C@@H]2CCC[C@@H]2[NH2+]C2CCN(c3ccncc3)CC2)cn1 ZINC000668609872 482187791 /nfs/dbraw/zinc/18/77/91/482187791.db2.gz IQXLNKOCIQDSBE-PXNSSMCTSA-N 1 3 339.487 2.785 10 0 EFAEHO CCO[C@@H]1CN(CCCc2ccc(C(F)(F)F)cc2)C[C@H]1C[NH3+] ZINC000652356974 482192145 /nfs/dbraw/zinc/19/21/45/482192145.db2.gz USUIOEZUZASMND-GDBMZVCRSA-N 1 3 330.394 2.934 10 0 EFAEHO CC(=O)c1ccccc1OCCN1CCCC[C@@H]1[C@@H]1C[C@H]([NH3+])CCO1 ZINC000652360369 482193527 /nfs/dbraw/zinc/19/35/27/482193527.db2.gz GEJHFIJKXKLRNZ-POAQFYNOSA-N 1 3 346.471 2.629 10 0 EFAEHO CCOc1ccc(OCCN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)cc1 ZINC000652360902 482193792 /nfs/dbraw/zinc/19/37/92/482193792.db2.gz TUIJGUVWIHAEMO-AHRSYUTCSA-N 1 3 348.487 2.825 10 0 EFAEHO C[C@@H]1C[N@H+](C[C@H](O)[C@@H](N)Cc2ccccc2)CCc2ccc(F)cc21 ZINC000652364380 482195544 /nfs/dbraw/zinc/19/55/44/482195544.db2.gz LRMOQWZUCQINNH-NQERJWCQSA-N 1 3 342.458 2.718 10 0 EFAEHO C[C@@H]1C[N@@H+](C[C@H](O)[C@@H](N)Cc2ccccc2)CCc2ccc(F)cc21 ZINC000652364380 482195548 /nfs/dbraw/zinc/19/55/48/482195548.db2.gz LRMOQWZUCQINNH-NQERJWCQSA-N 1 3 342.458 2.718 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@@H]3COC[C@@H]3C2)CC1 ZINC000668704093 482220795 /nfs/dbraw/zinc/22/07/95/482220795.db2.gz BVWJRKPXBSGKPY-UXHICEINSA-N 1 3 343.515 2.687 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@@H]3COC[C@@H]3C2)CC1 ZINC000668704093 482220799 /nfs/dbraw/zinc/22/07/99/482220799.db2.gz BVWJRKPXBSGKPY-UXHICEINSA-N 1 3 343.515 2.687 10 0 EFAEHO CN(c1ccccc1C[N@@H+]1CC[C@H]2COC[C@@H]2C1)C1CCN(C)CC1 ZINC000668706628 482222853 /nfs/dbraw/zinc/22/28/53/482222853.db2.gz UEBWBSXRQUPXGG-OALUTQOASA-N 1 3 343.515 2.685 10 0 EFAEHO CN(c1ccccc1C[N@H+]1CC[C@H]2COC[C@@H]2C1)C1CCN(C)CC1 ZINC000668706628 482222856 /nfs/dbraw/zinc/22/28/56/482222856.db2.gz UEBWBSXRQUPXGG-OALUTQOASA-N 1 3 343.515 2.685 10 0 EFAEHO CC[NH+](CC)CCCN1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21 ZINC000649751332 482228656 /nfs/dbraw/zinc/22/86/56/482228656.db2.gz ITTOFRSHEGUVCU-LEWJYISDSA-N 1 3 345.531 2.694 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC[C@@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000668748010 482244439 /nfs/dbraw/zinc/24/44/39/482244439.db2.gz PKKQJDKBZQOPCN-OAHLLOKOSA-N 1 3 340.533 2.904 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC[C@@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000668748010 482244445 /nfs/dbraw/zinc/24/44/45/482244445.db2.gz PKKQJDKBZQOPCN-OAHLLOKOSA-N 1 3 340.533 2.904 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000663452162 482244866 /nfs/dbraw/zinc/24/48/66/482244866.db2.gz JHQBNVWNRGRPKF-SFHVURJKSA-N 1 3 346.519 2.681 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000663452162 482244872 /nfs/dbraw/zinc/24/48/72/482244872.db2.gz JHQBNVWNRGRPKF-SFHVURJKSA-N 1 3 346.519 2.681 10 0 EFAEHO Clc1ccccc1[C@@H]1C[NH2+]CCN1Cc1nc2c(s1)CNCC2 ZINC000663492811 482264138 /nfs/dbraw/zinc/26/41/38/482264138.db2.gz BMNIXJRUCUEOMS-HNNXBMFYSA-N 1 3 348.903 2.589 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(NCc2cc(Cl)ccc2F)CC1 ZINC000663502780 482266283 /nfs/dbraw/zinc/26/62/83/482266283.db2.gz AZDSGJZTJXETPU-UHFFFAOYSA-N 1 3 341.858 2.559 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(NCc2c(F)cccc2Cl)CC1 ZINC000663502944 482268457 /nfs/dbraw/zinc/26/84/57/482268457.db2.gz JMFFMLLFNVQWBF-UHFFFAOYSA-N 1 3 341.858 2.559 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(NCc2ccc(Cl)cc2F)CC1 ZINC000663505506 482269408 /nfs/dbraw/zinc/26/94/08/482269408.db2.gz JLZSIXQCQWMVJE-UHFFFAOYSA-N 1 3 341.858 2.559 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C)C2(CO)CCC2)CC1 ZINC000668801875 482272288 /nfs/dbraw/zinc/27/22/88/482272288.db2.gz AXQDHFNWEQNBRZ-UHFFFAOYSA-N 1 3 331.504 2.565 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C)C2(CO)CCC2)CC1 ZINC000668801875 482272294 /nfs/dbraw/zinc/27/22/94/482272294.db2.gz AXQDHFNWEQNBRZ-UHFFFAOYSA-N 1 3 331.504 2.565 10 0 EFAEHO O=C(NCc1ccccc1CN1CCCCC1)N[C@@H]1CCC[NH2+]CC1 ZINC000668860300 482298765 /nfs/dbraw/zinc/29/87/65/482298765.db2.gz OJFIVVSRLJWVER-LJQANCHMSA-N 1 3 344.503 2.614 10 0 EFAEHO CCC(CC)[C@@H](CNC(=O)N(CC)[C@@H]1CCN(C)C1)[NH+]1CCCC1 ZINC000663560556 482300957 /nfs/dbraw/zinc/30/09/57/482300957.db2.gz WOYOFOAXLIOWNN-QZTJIDSGSA-N 1 3 338.540 2.623 10 0 EFAEHO CCN(C(=O)NC[C@@H](C1CCCCC1)[NH+](C)C)[C@H]1CCN(CC)C1 ZINC000663629645 482325332 /nfs/dbraw/zinc/32/53/32/482325332.db2.gz PSNXKPLJNSFXTC-ROUUACIJSA-N 1 3 338.540 2.623 10 0 EFAEHO CCN(C(=O)NCCCC[N@@H+]1CCCC[C@H]1C)[C@H]1CCN(CC)C1 ZINC000663653718 482331209 /nfs/dbraw/zinc/33/12/09/482331209.db2.gz CCSXOPIWNKNVMS-MSOLQXFVSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN(C(=O)NCCCC[N@H+]1CCCC[C@H]1C)[C@H]1CCN(CC)C1 ZINC000663653718 482331213 /nfs/dbraw/zinc/33/12/13/482331213.db2.gz CCSXOPIWNKNVMS-MSOLQXFVSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN(C(=O)NCCCC[N@@H+]1CCC[C@H](C)C1)[C@@H]1CCN(CC)C1 ZINC000663654121 482332601 /nfs/dbraw/zinc/33/26/01/482332601.db2.gz DKVVVTBFWBJLKF-ZWKOTPCHSA-N 1 3 338.540 2.624 10 0 EFAEHO CCN(C(=O)NCCCC[N@H+]1CCC[C@H](C)C1)[C@@H]1CCN(CC)C1 ZINC000663654121 482332607 /nfs/dbraw/zinc/33/26/07/482332607.db2.gz DKVVVTBFWBJLKF-ZWKOTPCHSA-N 1 3 338.540 2.624 10 0 EFAEHO C[C@@H](Cc1ccccc1)CN1CCN(C[C@H]2CCCC[N@@H+]2C)CC1 ZINC000132321529 534247837 /nfs/dbraw/zinc/24/78/37/534247837.db2.gz WDARIUOJXXDCFN-PZJWPPBQSA-N 1 3 329.532 2.967 10 0 EFAEHO C[C@@H](Cc1ccccc1)CN1CCN(C[C@H]2CCCC[N@H+]2C)CC1 ZINC000132321529 534247840 /nfs/dbraw/zinc/24/78/40/534247840.db2.gz WDARIUOJXXDCFN-PZJWPPBQSA-N 1 3 329.532 2.967 10 0 EFAEHO CC[N@H+](Cc1ccc(-c2nc([C@H]3CNCCN3C)no2)cc1)C(C)C ZINC000263218359 521296343 /nfs/dbraw/zinc/29/63/43/521296343.db2.gz LJVGAOKHZIXDFN-QGZVFWFLSA-N 1 3 343.475 2.543 10 0 EFAEHO CC[N@@H+](Cc1ccc(-c2nc([C@H]3CNCCN3C)no2)cc1)C(C)C ZINC000263218359 521296350 /nfs/dbraw/zinc/29/63/50/521296350.db2.gz LJVGAOKHZIXDFN-QGZVFWFLSA-N 1 3 343.475 2.543 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)N[C@@H](C)CN(C)Cc1ccccc1 ZINC000181280610 521628709 /nfs/dbraw/zinc/62/87/09/521628709.db2.gz RAEUGPNKOBRZJC-PKOBYXMFSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)N[C@@H](C)CN(C)Cc1ccccc1 ZINC000181280610 521628714 /nfs/dbraw/zinc/62/87/14/521628714.db2.gz RAEUGPNKOBRZJC-PKOBYXMFSA-N 1 3 346.519 2.633 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@H]2CCCOc3ccc(C)cc32)CC1 ZINC000154276416 521682299 /nfs/dbraw/zinc/68/22/99/521682299.db2.gz GSRREUJJMJZTPO-IBGZPJMESA-N 1 3 331.504 2.826 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCC[C@H]3C[N@H+](C)CC[C@H]32)c1 ZINC000245891538 521927484 /nfs/dbraw/zinc/92/74/84/521927484.db2.gz JSMKAHVCKKGNNN-FUHWJXTLSA-N 1 3 330.476 2.696 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)c1 ZINC000245891538 521927493 /nfs/dbraw/zinc/92/74/93/521927493.db2.gz JSMKAHVCKKGNNN-FUHWJXTLSA-N 1 3 330.476 2.696 10 0 EFAEHO CN1CC[C@H](NC(=O)N[C@H]2CCC[C@@H]([NH+](C)C)C2)[C@H]1c1ccccc1 ZINC000245612840 522046648 /nfs/dbraw/zinc/04/66/48/522046648.db2.gz CCCZYTLDYZVYFO-ZSYWTGECSA-N 1 3 344.503 2.604 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@H](C)c1ccc(OC)c(Br)c1 ZINC000234696635 522668324 /nfs/dbraw/zinc/66/83/24/522668324.db2.gz YDXNYUOEPCAKEQ-YPMHNXCESA-N 1 3 345.281 2.862 10 0 EFAEHO CN1CC[C@H](NC(=O)NCCCC[NH+]2CCCC2)[C@@H]1c1ccccc1 ZINC000179122516 523984510 /nfs/dbraw/zinc/98/45/10/523984510.db2.gz QJSYCCQUAOEDSM-OALUTQOASA-N 1 3 344.503 2.607 10 0 EFAEHO Cc1cc(C)cc(OC[C@H](O)CN2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000193081095 524453457 /nfs/dbraw/zinc/45/34/57/524453457.db2.gz HSBXPXXLAVEFSZ-HXUWFJFHSA-N 1 3 346.515 2.851 10 0 EFAEHO C[C@H](CO[C@H]1CCOC1)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245760838 524588063 /nfs/dbraw/zinc/58/80/63/524588063.db2.gz VOOBCLHCFGHEHL-JFHUYLGKSA-N 1 3 344.499 2.966 10 0 EFAEHO C[C@H](CO[C@H]1CCOC1)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245760838 524588069 /nfs/dbraw/zinc/58/80/69/524588069.db2.gz VOOBCLHCFGHEHL-JFHUYLGKSA-N 1 3 344.499 2.966 10 0 EFAEHO CS[C@H](CO)[C@@H](C)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245652521 525891788 /nfs/dbraw/zinc/89/17/88/525891788.db2.gz CVJRKOLTCYALQC-RXABAKJHSA-N 1 3 334.529 2.884 10 0 EFAEHO CS[C@H](CO)[C@@H](C)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245652521 525891794 /nfs/dbraw/zinc/89/17/94/525891794.db2.gz CVJRKOLTCYALQC-RXABAKJHSA-N 1 3 334.529 2.884 10 0 EFAEHO CS[C@H](CO)[C@H](C)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245652519 525897553 /nfs/dbraw/zinc/89/75/53/525897553.db2.gz CVJRKOLTCYALQC-GPFWEFOESA-N 1 3 334.529 2.884 10 0 EFAEHO CS[C@H](CO)[C@H](C)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245652519 525897559 /nfs/dbraw/zinc/89/75/59/525897559.db2.gz CVJRKOLTCYALQC-GPFWEFOESA-N 1 3 334.529 2.884 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)N(C)C)cc1 ZINC000119690788 525957303 /nfs/dbraw/zinc/95/73/03/525957303.db2.gz KKCBVBIHNAJJLU-UHOSZYNNSA-N 1 3 346.519 2.626 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@@H]2C)N(C)C)cc1 ZINC000119690788 525957310 /nfs/dbraw/zinc/95/73/10/525957310.db2.gz KKCBVBIHNAJJLU-UHOSZYNNSA-N 1 3 346.519 2.626 10 0 EFAEHO C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NC[C@@H]2CCCN2C)CC1 ZINC000116537810 526094230 /nfs/dbraw/zinc/09/42/30/526094230.db2.gz MISVDZGFWBPQPP-LPHOPBHVSA-N 1 3 344.503 2.605 10 0 EFAEHO COc1cccc(N2CCC[C@@H](NC3C[C@H]4CC[C@@H](C3)[N@H+]4C)C2)c1 ZINC000192877524 526144201 /nfs/dbraw/zinc/14/42/01/526144201.db2.gz WGLUQIGSQONGBT-CSNJMZFVSA-N 1 3 329.488 2.879 10 0 EFAEHO COc1cccc(N2CCC[C@@H](NC3C[C@H]4CC[C@@H](C3)[N@@H+]4C)C2)c1 ZINC000192877524 526144206 /nfs/dbraw/zinc/14/42/06/526144206.db2.gz WGLUQIGSQONGBT-CSNJMZFVSA-N 1 3 329.488 2.879 10 0 EFAEHO Cc1ccc2c(c1)[C@H]([NH2+]C1CCN(CCN(C)C)CC1)CCCO2 ZINC000150976595 526209231 /nfs/dbraw/zinc/20/92/31/526209231.db2.gz ZAZRJJUABVZWPD-LJQANCHMSA-N 1 3 331.504 2.824 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCC[C@H](O)CC)CC1 ZINC000344480416 534936727 /nfs/dbraw/zinc/93/67/27/534936727.db2.gz NCFLGQUHVOAZFI-LJQANCHMSA-N 1 3 333.520 2.859 10 0 EFAEHO CC(C)n1ccc(C[C@H](C)[NH2+]CCCCN2C[C@@H](C)O[C@@H](C)C2)n1 ZINC000341178174 535092274 /nfs/dbraw/zinc/09/22/74/535092274.db2.gz BRLVTKMKSFMXTJ-OKZBNKHCSA-N 1 3 336.524 2.874 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)C[C@@H](c2ccccc2)N(C)C)CC1 ZINC000416142403 535352129 /nfs/dbraw/zinc/35/21/29/535352129.db2.gz CJULSHIPQBUGCH-IBGZPJMESA-N 1 3 331.504 2.918 10 0 EFAEHO CC[C@@H]1C[C@H](CN2CCN(C3CC[NH+](C(C)C)CC3)CC2)CCO1 ZINC000356997558 535897034 /nfs/dbraw/zinc/89/70/34/535897034.db2.gz RWGMCIPJVNWXSZ-UYAOXDASSA-N 1 3 337.552 2.682 10 0 EFAEHO C[N@H+](Cc1ccccc1)CC(C)(C)CNC[C@H](CO)c1cccnc1 ZINC000342285611 536480149 /nfs/dbraw/zinc/48/01/49/536480149.db2.gz IWSSKXYWXGVKRM-HXUWFJFHSA-N 1 3 341.499 2.905 10 0 EFAEHO C[N@@H+](Cc1ccccc1)CC(C)(C)CNC[C@H](CO)c1cccnc1 ZINC000342285611 536480150 /nfs/dbraw/zinc/48/01/50/536480150.db2.gz IWSSKXYWXGVKRM-HXUWFJFHSA-N 1 3 341.499 2.905 10 0 EFAEHO COC1([C@@H](C)[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCCC1 ZINC000421858795 536707622 /nfs/dbraw/zinc/70/76/22/536707622.db2.gz RFIPIVVYARCKTH-GOSISDBHSA-N 1 3 346.515 2.951 10 0 EFAEHO [NH3+]C[C@H]1CCC[C@H]1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000261803754 545620932 /nfs/dbraw/zinc/62/09/32/545620932.db2.gz RFTNBGQLAPABKH-SJLPKXTDSA-N 1 3 347.528 2.591 10 0 EFAEHO COc1cccc(N2CC[C@H](CN[C@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)c1 ZINC000339069077 545922561 /nfs/dbraw/zinc/92/25/61/545922561.db2.gz QROORKGZJYOVNS-FGTMMUONSA-N 1 3 329.488 2.738 10 0 EFAEHO COc1cccc(N2CC[C@H](CN[C@H]3CC[N@H+]4CCC[C@@H]4C3)C2)c1 ZINC000339069077 545922564 /nfs/dbraw/zinc/92/25/64/545922564.db2.gz QROORKGZJYOVNS-FGTMMUONSA-N 1 3 329.488 2.738 10 0 EFAEHO COc1cccc(N2CC[C@H](C[NH2+][C@H]3CCN4CCC[C@@H]4C3)C2)c1 ZINC000339069077 545922566 /nfs/dbraw/zinc/92/25/66/545922566.db2.gz QROORKGZJYOVNS-FGTMMUONSA-N 1 3 329.488 2.738 10 0 EFAEHO COc1cccc(N2CCC[C@H](N[C@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)c1 ZINC000339067803 545922640 /nfs/dbraw/zinc/92/26/40/545922640.db2.gz ISVPZXXWJJFIJU-OKZBNKHCSA-N 1 3 329.488 2.880 10 0 EFAEHO COc1cccc(N2CCC[C@H](N[C@H]3CC[N@H+]4CCC[C@@H]4C3)C2)c1 ZINC000339067803 545922645 /nfs/dbraw/zinc/92/26/45/545922645.db2.gz ISVPZXXWJJFIJU-OKZBNKHCSA-N 1 3 329.488 2.880 10 0 EFAEHO O=C(c1ccccc1)N1CCC(CN[C@@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000339069256 545922679 /nfs/dbraw/zinc/92/26/79/545922679.db2.gz SIXTZXNCQDXYPX-UXHICEINSA-N 1 3 341.499 2.755 10 0 EFAEHO O=C(c1ccccc1)N1CCC(CN[C@@H]2CC[N@H+]3CCC[C@H]3C2)CC1 ZINC000339069256 545922684 /nfs/dbraw/zinc/92/26/84/545922684.db2.gz SIXTZXNCQDXYPX-UXHICEINSA-N 1 3 341.499 2.755 10 0 EFAEHO O=C(c1ccccc1)N1CCC(C[NH2+][C@@H]2CCN3CCC[C@H]3C2)CC1 ZINC000339069256 545922688 /nfs/dbraw/zinc/92/26/88/545922688.db2.gz SIXTZXNCQDXYPX-UXHICEINSA-N 1 3 341.499 2.755 10 0 EFAEHO CO[C@@H]1CCC[C@@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)C1 ZINC000397533441 546170804 /nfs/dbraw/zinc/17/08/04/546170804.db2.gz GDDHDASPFJZYIL-RTBURBONSA-N 1 3 332.488 2.561 10 0 EFAEHO C[C@]1(CNC(=O)N[C@H]2CCC[C@@H]([NH3+])C2)CCCN1Cc1ccccc1 ZINC000418046782 546212638 /nfs/dbraw/zinc/21/26/38/546212638.db2.gz RBWCFLIUZXSFGU-WSTZPKSXSA-N 1 3 344.503 2.610 10 0 EFAEHO Cc1c([C@@H](C)NC[C@H]2C[C@@H]([NH+](C)C)C2)nnn1-c1ccc(F)cc1 ZINC000655806179 546591599 /nfs/dbraw/zinc/59/15/99/546591599.db2.gz QPBQSBRDDBRFEC-MRRJBJDNSA-N 1 3 331.439 2.706 10 0 EFAEHO Cc1c([C@H](C)NC[C@H]2C[C@@H]([NH+](C)C)C2)nnn1-c1ccc(C)cc1 ZINC000655805099 546591831 /nfs/dbraw/zinc/59/18/31/546591831.db2.gz BSFRVXIGNANKDP-QILLFSRXSA-N 1 3 327.476 2.875 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C1CCN(C(=O)C(C)(C)C)CC1 ZINC000656200602 546719759 /nfs/dbraw/zinc/71/97/59/546719759.db2.gz APTQDEBUUOHXOS-ZDUSSCGKSA-N 1 3 332.492 2.536 10 0 EFAEHO COC[C@@H](CCC[NH3+])NC1(c2cccc(OC(F)(F)F)c2)CC1 ZINC000656200619 546719950 /nfs/dbraw/zinc/71/99/50/546719950.db2.gz BQFZAFOLKNASPJ-CYBMUJFWSA-N 1 3 332.366 2.918 10 0 EFAEHO COc1ccc(CN2CCC[C@@H](C3CC[NH2+]CC3)C2)c(OC)c1OC ZINC000656784400 546922813 /nfs/dbraw/zinc/92/28/13/546922813.db2.gz DATRZVALURVLOQ-MRXNPFEDSA-N 1 3 348.487 2.924 10 0 EFAEHO COc1cc(CN2CCC[C@@H](C3CC[NH2+]CC3)C2)cc(OC)c1O ZINC000656783062 546923537 /nfs/dbraw/zinc/92/35/37/546923537.db2.gz NMLWUEFCIICYDW-MRXNPFEDSA-N 1 3 334.460 2.621 10 0 EFAEHO COc1cc(OC)c(CN2CCC[C@H](C3CC[NH2+]CC3)C2)c(OC)c1 ZINC000656785992 546924697 /nfs/dbraw/zinc/92/46/97/546924697.db2.gz PDWREKDXEZJYDC-INIZCTEOSA-N 1 3 348.487 2.924 10 0 EFAEHO C[C@H]1CCC[N@@H+](C(C)(C)CNCc2ccnn2-c2ccncc2)C1 ZINC000657324612 547110490 /nfs/dbraw/zinc/11/04/90/547110490.db2.gz FIJUEGYWWYXWLI-INIZCTEOSA-N 1 3 327.476 2.867 10 0 EFAEHO C[C@H]1CCC[N@H+](C(C)(C)CNCc2ccnn2-c2ccncc2)C1 ZINC000657324612 547110493 /nfs/dbraw/zinc/11/04/93/547110493.db2.gz FIJUEGYWWYXWLI-INIZCTEOSA-N 1 3 327.476 2.867 10 0 EFAEHO C[C@H]1CCCN(C(C)(C)C[NH2+]Cc2ccnn2-c2ccncc2)C1 ZINC000657324612 547110500 /nfs/dbraw/zinc/11/05/00/547110500.db2.gz FIJUEGYWWYXWLI-INIZCTEOSA-N 1 3 327.476 2.867 10 0 EFAEHO Cc1ccc2cc(C[NH2+]C3CCN([C@H]4CCC[C@H]4O)CC3)[nH]c2c1 ZINC000657398840 547146138 /nfs/dbraw/zinc/14/61/38/547146138.db2.gz CVZTUNVYMJUNDJ-VQTJNVASSA-N 1 3 327.472 2.944 10 0 EFAEHO Cc1ccc2cc(C[NH2+]C3CCN([C@@H]4CCC[C@H]4O)CC3)[nH]c2c1 ZINC000657398841 547146425 /nfs/dbraw/zinc/14/64/25/547146425.db2.gz CVZTUNVYMJUNDJ-WOJBJXKFSA-N 1 3 327.472 2.944 10 0 EFAEHO c1cc(C[NH2+]CC2CCN(c3ccncc3)CC2)n(-c2ccncc2)n1 ZINC000657425355 547158500 /nfs/dbraw/zinc/15/85/00/547158500.db2.gz IQTHOTWDAPZIOQ-UHFFFAOYSA-N 1 3 348.454 2.669 10 0 EFAEHO CC[C@H]1CCC[C@@H]([NH2+]CC2(N3CCOCC3)CCN(C)CC2)CC1 ZINC000657490264 547182919 /nfs/dbraw/zinc/18/29/19/547182919.db2.gz HSGYAGBPHJTHNZ-RBUKOAKNSA-N 1 3 337.552 2.732 10 0 EFAEHO COc1ccc(F)cc1CNCC1CC[NH+](C2CCOCC2)CC1 ZINC000657537328 547196663 /nfs/dbraw/zinc/19/66/63/547196663.db2.gz HSZUCQDBTCWJLU-UHFFFAOYSA-N 1 3 336.451 2.815 10 0 EFAEHO COc1ccc(OC)c(CNCC2CC[NH+](C3CCOCC3)CC2)c1 ZINC000657536206 547197006 /nfs/dbraw/zinc/19/70/06/547197006.db2.gz HGBPWHMKPCXRAF-UHFFFAOYSA-N 1 3 348.487 2.684 10 0 EFAEHO Cc1ccccc1-n1nccc1CN[C@@H](C)CN(C)CCC[NH+](C)C ZINC000657573087 547212174 /nfs/dbraw/zinc/21/21/74/547212174.db2.gz JPABRFIXEOJUPR-SFHVURJKSA-N 1 3 343.519 2.542 10 0 EFAEHO COC1(C[NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)CCCCC1 ZINC000657595291 547222052 /nfs/dbraw/zinc/22/20/52/547222052.db2.gz GNLSNVHTYMYAMK-LJQANCHMSA-N 1 3 332.488 2.692 10 0 EFAEHO CCC1(C[NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)CCOCC1 ZINC000657594446 547222557 /nfs/dbraw/zinc/22/25/57/547222557.db2.gz AJLISRFEIJHKPP-IBGZPJMESA-N 1 3 332.488 2.550 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H](CO)CC2CC2)CC1 ZINC000657701435 547257250 /nfs/dbraw/zinc/25/72/50/547257250.db2.gz XYAWEWAQHWNEAF-LJQANCHMSA-N 1 3 345.531 2.717 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2C[C@@H](O)C23CCC3)CC1 ZINC000657707680 547259634 /nfs/dbraw/zinc/25/96/34/547259634.db2.gz VSKNXAXYHVMNMA-VQTJNVASSA-N 1 3 343.515 2.612 10 0 EFAEHO CN(C)CCOc1ccc(CC[NH2+]C2CC(CF)(CF)C2)cc1 ZINC000657873078 547307693 /nfs/dbraw/zinc/30/76/93/547307693.db2.gz RMDFVQGMBOUJKS-UHFFFAOYSA-N 1 3 326.431 2.847 10 0 EFAEHO COC1([C@H](C)[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCC1 ZINC000658034326 547339745 /nfs/dbraw/zinc/33/97/45/547339745.db2.gz HUEJNTGVYRCSTF-KRWDZBQOSA-N 1 3 332.488 2.561 10 0 EFAEHO C[C@H](NCC1CC[NH+](C2CCOCC2)CC1)c1cn2ccccc2n1 ZINC000658069864 547347624 /nfs/dbraw/zinc/34/76/24/547347624.db2.gz KCGNDQFOLMQRCX-INIZCTEOSA-N 1 3 342.487 2.876 10 0 EFAEHO CCO[C@@H]1C[C@@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)C12CCC2 ZINC000658135904 547366802 /nfs/dbraw/zinc/36/68/02/547366802.db2.gz FUABOJKXUPJLPD-XUVXKRRUSA-N 1 3 344.499 2.691 10 0 EFAEHO C[C@H](CCc1ccco1)[NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000658137805 547367913 /nfs/dbraw/zinc/36/79/13/547367913.db2.gz IKXPLEYVVVHCCN-VQIMIIECSA-N 1 3 328.456 2.957 10 0 EFAEHO CC[C@@H](NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccncc1 ZINC000658141998 547368982 /nfs/dbraw/zinc/36/89/82/547368982.db2.gz YAAXTTCQZBAYLY-WOJBJXKFSA-N 1 3 325.456 2.889 10 0 EFAEHO CC[C@@H](NCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1)c1ccncc1 ZINC000658141998 547368986 /nfs/dbraw/zinc/36/89/86/547368986.db2.gz YAAXTTCQZBAYLY-WOJBJXKFSA-N 1 3 325.456 2.889 10 0 EFAEHO CCC1(CC)[C@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)C[C@@H]1OC ZINC000658141895 547369016 /nfs/dbraw/zinc/36/90/16/547369016.db2.gz XOMWUQHBUATAKI-ZCNNSNEGSA-N 1 3 346.515 2.937 10 0 EFAEHO CCC1(CC)[C@H]([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)C[C@H]1OC ZINC000658141893 547369123 /nfs/dbraw/zinc/36/91/23/547369123.db2.gz XOMWUQHBUATAKI-VAMGGRTRSA-N 1 3 346.515 2.937 10 0 EFAEHO COC[C@@H](CC(C)(C)C)[NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000658139787 547369264 /nfs/dbraw/zinc/36/92/64/547369264.db2.gz SBTKHDCYYVMVGX-MOPGFXCFSA-N 1 3 334.504 2.794 10 0 EFAEHO CC1(C)[C@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)[C@H]2CCCO[C@H]21 ZINC000658139235 547369462 /nfs/dbraw/zinc/36/94/62/547369462.db2.gz PMRKKWZOJCPORW-MTQWCTHYSA-N 1 3 344.499 2.546 10 0 EFAEHO CC(C)O[C@@H]1C[C@H]([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)C1(C)C ZINC000658142550 547369863 /nfs/dbraw/zinc/36/98/63/547369863.db2.gz YOKHKPGBEOHIKF-HSALFYBXSA-N 1 3 346.515 2.935 10 0 EFAEHO C[C@@H](NCCO[C@H]1CC1(F)F)c1cccc(OCC[NH+](C)C)c1 ZINC000658168947 547378872 /nfs/dbraw/zinc/37/88/72/547378872.db2.gz JVTIQANBCXGYCI-CJNGLKHVSA-N 1 3 328.403 2.702 10 0 EFAEHO C[C@H](Cn1cncn1)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658317036 547418186 /nfs/dbraw/zinc/41/81/86/547418186.db2.gz IPXJOVZUYSRGKP-IEBWSBKVSA-N 1 3 339.487 2.559 10 0 EFAEHO C[C@H](Cn1cncn1)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000658317036 547418188 /nfs/dbraw/zinc/41/81/88/547418188.db2.gz IPXJOVZUYSRGKP-IEBWSBKVSA-N 1 3 339.487 2.559 10 0 EFAEHO CC[C@H](CN1CCCC1)NC(=O)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000675197344 548228145 /nfs/dbraw/zinc/22/81/45/548228145.db2.gz MVDACVYRQLBVMO-QZTJIDSGSA-N 1 3 336.524 2.521 10 0 EFAEHO CN(C)CCOc1ccc(C[NH2+]CCc2cnc(C3CC3)nc2)cc1 ZINC000677323327 548672997 /nfs/dbraw/zinc/67/29/97/548672997.db2.gz WBSWXGVFLAWRNA-UHFFFAOYSA-N 1 3 340.471 2.627 10 0 EFAEHO CN(CCCCOc1ccccc1)[C@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000678718749 548977546 /nfs/dbraw/zinc/97/75/46/548977546.db2.gz BOHKSUFQVUGDOZ-FQEVSTJZSA-N 1 3 345.531 2.946 10 0 EFAEHO CN(CCCCOc1ccccc1)[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000678718749 548977549 /nfs/dbraw/zinc/97/75/49/548977549.db2.gz BOHKSUFQVUGDOZ-FQEVSTJZSA-N 1 3 345.531 2.946 10 0 EFAEHO CN1CCC(N2CC[C@H]([N@H+](C)CCCCOc3ccccc3)C2)CC1 ZINC000678718749 548977553 /nfs/dbraw/zinc/97/75/53/548977553.db2.gz BOHKSUFQVUGDOZ-FQEVSTJZSA-N 1 3 345.531 2.946 10 0 EFAEHO CN1CCC(N2CC[C@H]([N@@H+](C)CCCCOc3ccccc3)C2)CC1 ZINC000678718749 548977556 /nfs/dbraw/zinc/97/75/56/548977556.db2.gz BOHKSUFQVUGDOZ-FQEVSTJZSA-N 1 3 345.531 2.946 10 0 EFAEHO Cc1nc2ccc(C[NH2+][C@@H]3CCN(C4CCN(C)CC4)C3)cc2s1 ZINC000683145596 549856034 /nfs/dbraw/zinc/85/60/34/549856034.db2.gz QUQSMNUXHCVXDF-MRXNPFEDSA-N 1 3 344.528 2.863 10 0 EFAEHO CCn1cnnc1CCN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000683692987 549931720 /nfs/dbraw/zinc/93/17/20/549931720.db2.gz ZACHWACUDDQEKX-REPLKXPHSA-N 1 3 339.487 2.626 10 0 EFAEHO CCn1cnnc1CCN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000683692987 549931723 /nfs/dbraw/zinc/93/17/23/549931723.db2.gz ZACHWACUDDQEKX-REPLKXPHSA-N 1 3 339.487 2.626 10 0 EFAEHO CCn1cnnc1CCN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000683692985 549931756 /nfs/dbraw/zinc/93/17/56/549931756.db2.gz ZACHWACUDDQEKX-LDLYASANSA-N 1 3 339.487 2.626 10 0 EFAEHO CCn1cnnc1CCN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000683692985 549931759 /nfs/dbraw/zinc/93/17/59/549931759.db2.gz ZACHWACUDDQEKX-LDLYASANSA-N 1 3 339.487 2.626 10 0 EFAEHO C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)[C@@H]1CCC[N@@H+]1C1CC1 ZINC000683855824 549955743 /nfs/dbraw/zinc/95/57/43/549955743.db2.gz ATEUQWPYBRTUFK-XLIONFOSSA-N 1 3 341.499 2.736 10 0 EFAEHO C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)[C@@H]1CCC[N@H+]1C1CC1 ZINC000683855824 549955744 /nfs/dbraw/zinc/95/57/44/549955744.db2.gz ATEUQWPYBRTUFK-XLIONFOSSA-N 1 3 341.499 2.736 10 0 EFAEHO CO[C@H]1CCC[C@@H]([NH2+]Cc2ccc(CN3CCC(O)CC3)cc2)C1 ZINC000684366958 550030782 /nfs/dbraw/zinc/03/07/82/550030782.db2.gz XOQGJEPNKXPPJZ-QUCCMNQESA-N 1 3 332.488 2.691 10 0 EFAEHO CCN1CCN(Cc2ccc(C[NH2+][C@@H]3CCC[C@H](OC)C3)cc2)CC1 ZINC000684370214 550031253 /nfs/dbraw/zinc/03/12/53/550031253.db2.gz PYLXBGPLXQWRAX-RTWAWAEBSA-N 1 3 345.531 2.871 10 0 EFAEHO CN1CC[C@H](NC(=O)CCCC[NH+]2CCCC2)[C@H]1c1ccccc1 ZINC000759953497 575961543 /nfs/dbraw/zinc/96/15/43/575961543.db2.gz IBLHMLJXUNRXGY-AZUAARDMSA-N 1 3 329.488 2.814 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NCCSC(F)(F)F)[C@H](C)C1 ZINC000765240910 577022084 /nfs/dbraw/zinc/02/20/84/577022084.db2.gz ZVPXQHYBDDAFRJ-OLZOCXBDSA-N 1 3 328.444 2.966 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NCCSC(F)(F)F)[C@H](C)C1 ZINC000765240910 577022086 /nfs/dbraw/zinc/02/20/86/577022086.db2.gz ZVPXQHYBDDAFRJ-OLZOCXBDSA-N 1 3 328.444 2.966 10 0 EFAEHO Cc1cccc(Cl)c1CNCCN(C)C(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001691321756 1248655413 /nfs/dbraw/zinc/65/54/13/1248655413.db2.gz JSKKFZKYBUSWJU-KRWDZBQOSA-N 1 3 349.906 2.538 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@H](C)C[C@H]2C[NH2+]CCC2CC2)CC1 ZINC001691376825 1248710031 /nfs/dbraw/zinc/71/00/31/1248710031.db2.gz GKMNEBZFLCUAAK-MJGOQNOKSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(CC[NH2+]C1C[C@H]2CC[C@@H](C1)N2C)C(=O)OC(C)(C)C ZINC000227655210 1248807077 /nfs/dbraw/zinc/80/70/77/1248807077.db2.gz AFOTZVXDNGGWSE-MQVJKMGUSA-N 1 3 325.497 2.847 10 0 EFAEHO CN(CC[NH2+]CCCC1CCC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001691476572 1249198885 /nfs/dbraw/zinc/19/88/85/1249198885.db2.gz MJKGLGVTTFTHOH-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2C[C@H]([NH2+]CCCC3CCCC3)C2)CCC1 ZINC001691789626 1249219996 /nfs/dbraw/zinc/21/99/96/1249219996.db2.gz ADZBGQNXNCGWFI-IYARVYRRSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1cc(CN2CCC[C@H]2CNC(=O)CCCC[NH+](C)C)cs1 ZINC001691106657 1248417182 /nfs/dbraw/zinc/41/71/82/1248417182.db2.gz YOFXXDFTIAWMDZ-KRWDZBQOSA-N 1 3 337.533 2.869 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]2C1 ZINC001691558233 1251770428 /nfs/dbraw/zinc/77/04/28/1251770428.db2.gz UDZZDJKOTFGGKO-ZLKFPQNLSA-N 1 3 333.520 2.607 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]2C1 ZINC001691558233 1251770438 /nfs/dbraw/zinc/77/04/38/1251770438.db2.gz UDZZDJKOTFGGKO-ZLKFPQNLSA-N 1 3 333.520 2.607 10 0 EFAEHO CC/C=C\CC[NH2+][C@H](C)[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001484353755 1252446259 /nfs/dbraw/zinc/44/62/59/1252446259.db2.gz HDWYJERXBOMQNJ-CQQBRXBZSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H]1CN(C(=O)C(C)(C)N2CCCCC2)C[C@H]1C ZINC001484367666 1252470120 /nfs/dbraw/zinc/47/01/20/1252470120.db2.gz HVXQGCCNIIRDHA-MSOLQXFVSA-N 1 3 335.536 2.901 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2ccsc2)CC1 ZINC001484460508 1252651742 /nfs/dbraw/zinc/65/17/42/1252651742.db2.gz BYZFHOYPERLIDA-DLBZAZTESA-N 1 3 347.528 2.655 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2C/C=C\c1ccccc1 ZINC001484461606 1252657700 /nfs/dbraw/zinc/65/77/00/1252657700.db2.gz JLVAZTYQZCOZHV-DGBZWLMUSA-N 1 3 341.499 2.717 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(F)c1 ZINC001484463897 1252664328 /nfs/dbraw/zinc/66/43/28/1252664328.db2.gz SIHYSKUQUVHCIF-OALUTQOASA-N 1 3 347.478 2.733 10 0 EFAEHO C[C@@H](c1ccccc1F)N1C[C@@H]2CCCN(C(=O)CC[NH+](C)C)[C@@H]2C1 ZINC001484473148 1252699265 /nfs/dbraw/zinc/69/92/65/1252699265.db2.gz NNUGMCFLNLHUSE-TXPKVOOTSA-N 1 3 347.478 2.761 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)c(C)c1 ZINC001484511515 1252734413 /nfs/dbraw/zinc/73/44/13/1252734413.db2.gz JDUSQGPHMJBOJK-ICSRJNTNSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@H]3CCCN3C)C2)c(C)s1 ZINC001484512937 1252738254 /nfs/dbraw/zinc/73/82/54/1252738254.db2.gz ZYYBRJXSLYOUEG-SJLPKXTDSA-N 1 3 349.544 2.787 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCCN(Cc2cccc(Cl)c2)CC1 ZINC001484724746 1252810031 /nfs/dbraw/zinc/81/00/31/1252810031.db2.gz XORNJNHHYNEFFW-KRWDZBQOSA-N 1 3 337.895 2.762 10 0 EFAEHO Cc1cccnc1CN(C)CCCN(C)C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001484745681 1252855496 /nfs/dbraw/zinc/85/54/96/1252855496.db2.gz OTSRKVNPBKQKLA-SFHVURJKSA-N 1 3 346.519 2.545 10 0 EFAEHO Cc1cccnc1CN(C)CCCN(C)C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001484745681 1252855509 /nfs/dbraw/zinc/85/55/09/1252855509.db2.gz OTSRKVNPBKQKLA-SFHVURJKSA-N 1 3 346.519 2.545 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(CC)CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001484810578 1253013510 /nfs/dbraw/zinc/01/35/10/1253013510.db2.gz CFVGXKAMSUTDQQ-HNNXBMFYSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(CC)CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001484810579 1253013887 /nfs/dbraw/zinc/01/38/87/1253013887.db2.gz CFVGXKAMSUTDQQ-OAHLLOKOSA-N 1 3 327.488 2.580 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C(C)C)cc1)C(=O)[C@@H]1CCCN1C ZINC001273298392 1265836929 /nfs/dbraw/zinc/83/69/29/1265836929.db2.gz NPIVHEXGGPDBPC-IBGZPJMESA-N 1 3 331.504 2.842 10 0 EFAEHO Cc1ccc(CCC[NH2+]C[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C)cc1 ZINC001671280413 1260068903 /nfs/dbraw/zinc/06/89/03/1260068903.db2.gz BYPGANMPHJLFQQ-PMACEKPBSA-N 1 3 343.515 2.602 10 0 EFAEHO CCCCC[NH+]1CCC2(CN(C(=O)CN3[C@H](C)CC[C@H]3C)C2)CC1 ZINC001272825912 1261059075 /nfs/dbraw/zinc/05/90/75/1261059075.db2.gz KZTWFYPQOOBOQO-QZTJIDSGSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCCC[NH+]1CCC2(CN(C(=O)CN3[C@H](C)CC[C@@H]3C)C2)CC1 ZINC001272825911 1261059221 /nfs/dbraw/zinc/05/92/21/1261059221.db2.gz KZTWFYPQOOBOQO-HDICACEKSA-N 1 3 335.536 2.974 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H](C)NC(=O)[C@H](C(C)C)N(C)C)c(C)c1 ZINC001272844067 1261152266 /nfs/dbraw/zinc/15/22/66/1261152266.db2.gz BHEKOAATLYURQG-MJGOQNOKSA-N 1 3 333.520 2.874 10 0 EFAEHO CN(CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@H]1CCN(c2ccccc2)C1=O ZINC000923310800 1261460263 /nfs/dbraw/zinc/46/02/63/1261460263.db2.gz AXKDRJGBUSDOFY-PHSGOXPASA-N 1 3 327.472 2.644 10 0 EFAEHO C[C@H]([NH3+])[C@@H]1CCN(C[C@@H]2Cc3ccccc3O[C@H]2C(F)(F)F)C1 ZINC000923332459 1261483366 /nfs/dbraw/zinc/48/33/66/1261483366.db2.gz QFLDUTOEWDARSI-ZGMNHVEMSA-N 1 3 328.378 2.838 10 0 EFAEHO CCN1CCN(c2ccc(F)cc2[C@@H](C)NCCC[NH2+]C2CC2)CC1 ZINC000923377936 1261577502 /nfs/dbraw/zinc/57/75/02/1261577502.db2.gz YAOFHNFIRBTNON-MRXNPFEDSA-N 1 3 348.510 2.760 10 0 EFAEHO COc1ccc([C@@H](NC[C@@H]2CC3(C[NH2+]C3)CO2)c2ccccc2)cc1 ZINC000923387658 1261596820 /nfs/dbraw/zinc/59/68/20/1261596820.db2.gz YLJBYIKBHKVRHG-PMACEKPBSA-N 1 3 338.451 2.753 10 0 EFAEHO COC(=O)c1cncc(CN2CCC[C@H](C[C@@H]([NH3+])C3CCCC3)C2)c1 ZINC000923422421 1261629700 /nfs/dbraw/zinc/62/97/00/1261629700.db2.gz RRJXJTRAENJONN-DNVCBOLYSA-N 1 3 345.487 2.988 10 0 EFAEHO [NH3+]C[C@H]1CC2(CO1)CCN(Cc1ccccc1OC(F)F)CC2 ZINC000923456285 1261680340 /nfs/dbraw/zinc/68/03/40/1261680340.db2.gz XEHAEBAXHKBTSA-CQSZACIVSA-N 1 3 326.387 2.618 10 0 EFAEHO [NH3+]C[C@H]1CC2(CO1)CCN(Cc1cccc(F)c1OC(F)F)CC2 ZINC000923449610 1261686571 /nfs/dbraw/zinc/68/65/71/1261686571.db2.gz ARSNYJVJSJNIIM-CYBMUJFWSA-N 1 3 344.377 2.757 10 0 EFAEHO C[C@H](C(=O)N1CCC[C@H]1c1cccs1)N1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923496334 1261764896 /nfs/dbraw/zinc/76/48/96/1261764896.db2.gz BEMWAICCAJMVQH-WCVJEAGWSA-N 1 3 335.517 2.717 10 0 EFAEHO C[C@H]1CN(CC(=O)NCC2(c3ccccc3)CCCC2)CC[C@@H]1C[NH3+] ZINC000923498238 1261790163 /nfs/dbraw/zinc/79/01/63/1261790163.db2.gz KDTQEKARLGMXTC-ZWKOTPCHSA-N 1 3 343.515 2.531 10 0 EFAEHO C[C@@H]1CN([C@H](C(=O)N2CCCCC2)c2ccccc2)CC[C@H]1C[NH3+] ZINC000923499638 1261796162 /nfs/dbraw/zinc/79/61/62/1261796162.db2.gz MJYXUHCAPSVRNT-NEWSRXKRSA-N 1 3 329.488 2.657 10 0 EFAEHO CCC[C@H](NC(=O)[C@H](C)N1CC[C@@H](C[NH3+])[C@H](C)C1)c1ccccc1 ZINC000923500194 1261796625 /nfs/dbraw/zinc/79/66/25/1261796625.db2.gz PCNKXIFMWUOPND-NEPXVJNWSA-N 1 3 331.504 2.949 10 0 EFAEHO CCC[C@H](NC(=O)[C@H](C)N1CC[C@H](C[NH3+])[C@@H](C)C1)c1ccccc1 ZINC000923500192 1261796694 /nfs/dbraw/zinc/79/66/94/1261796694.db2.gz PCNKXIFMWUOPND-DKKFBQAASA-N 1 3 331.504 2.949 10 0 EFAEHO c1cn(-c2ccc(CN3CCC([C@@H]4CCC[NH2+]CC4)CC3)cn2)cn1 ZINC000923505907 1261804175 /nfs/dbraw/zinc/80/41/75/1261804175.db2.gz DHTBAFJFKLBQBM-GOSISDBHSA-N 1 3 339.487 2.869 10 0 EFAEHO CCOC(=O)C1(C(F)(F)F)CCN(CC[C@@H]2CCC[NH2+]C2)CC1 ZINC000923525923 1261842460 /nfs/dbraw/zinc/84/24/60/1261842460.db2.gz VQMVZQNMAXZIJS-ZDUSSCGKSA-N 1 3 336.398 2.584 10 0 EFAEHO [NH3+]CCCCCCCN1C[C@@H](C[C@H]2COCCN2)c2ccccc21 ZINC000923540406 1261875131 /nfs/dbraw/zinc/87/51/31/1261875131.db2.gz JIHUAOYDXVLTEW-MSOLQXFVSA-N 1 3 331.504 2.878 10 0 EFAEHO CCCN(C)CC(=O)N(C)C[C@@H](C)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001485947127 1262514731 /nfs/dbraw/zinc/51/47/31/1262514731.db2.gz MXNMXHDQDBICAI-CABCVRRESA-N 1 3 333.467 2.590 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(C)cc1 ZINC001485962191 1262562442 /nfs/dbraw/zinc/56/24/42/1262562442.db2.gz WNAYYRVJAMBEGO-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2cc3ccccc3o2)[C@H]1C ZINC001486095887 1262618940 /nfs/dbraw/zinc/61/89/40/1262618940.db2.gz NTMXDPXNIUUASE-QAPCUYQASA-N 1 3 343.471 2.852 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CC2CC(C)(C)C2)CN1C(=O)CN(C)CC(C)(C)C ZINC001486124352 1262660664 /nfs/dbraw/zinc/66/06/64/1262660664.db2.gz OKYZVZIRQQMBJL-RDJZCZTQSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CC2CC(C)(C)C2)CN1C(=O)CN(C)CC(C)(C)C ZINC001486124350 1262660760 /nfs/dbraw/zinc/66/07/60/1262660760.db2.gz OKYZVZIRQQMBJL-DOTOQJQBSA-N 1 3 337.552 2.980 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCCC(F)(F)F)C[C@H]1C ZINC001486126698 1262704654 /nfs/dbraw/zinc/70/46/54/1262704654.db2.gz CSXWVWKGMSBKHS-ZIAGYGMSSA-N 1 3 337.430 2.640 10 0 EFAEHO CCCCC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@H]21 ZINC001486156527 1262713478 /nfs/dbraw/zinc/71/34/78/1262713478.db2.gz NPRBESYKUMDLKO-BHIYHBOVSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@]12CCC[C@H]1N(Cc1ccc(F)cc1)CC2 ZINC001486162060 1262722348 /nfs/dbraw/zinc/72/23/48/1262722348.db2.gz ZBXVNRNCWHSKLS-QUCCMNQESA-N 1 3 347.478 2.781 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@]12CCC[C@H]1N(Cc1ccc(F)cc1)CC2 ZINC001486162060 1262722349 /nfs/dbraw/zinc/72/23/49/1262722349.db2.gz ZBXVNRNCWHSKLS-QUCCMNQESA-N 1 3 347.478 2.781 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@H](C[NH2+]CCc3ccccc3)C2)CCC1 ZINC001486203394 1262788304 /nfs/dbraw/zinc/78/83/04/1262788304.db2.gz XEUAPDMRCXICSV-RBUKOAKNSA-N 1 3 343.515 2.588 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H](C[NH2+]CCc3ccccc3)C2)CCC1 ZINC001486203393 1262788690 /nfs/dbraw/zinc/78/86/90/1262788690.db2.gz XEUAPDMRCXICSV-OALUTQOASA-N 1 3 343.515 2.588 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@@H](C[NH2+]Cc2ccccc2F)C1 ZINC001486220999 1262824779 /nfs/dbraw/zinc/82/47/79/1262824779.db2.gz PUNTZFXEWJVWMH-WBVHZDCISA-N 1 3 335.467 2.540 10 0 EFAEHO C[C@@H](N[C@@H]1CN(C(=O)CC[NH+](C)C)CC1(C)C)c1ccccc1F ZINC001486240675 1262840882 /nfs/dbraw/zinc/84/08/82/1262840882.db2.gz OQSGKTIOKMBQBP-RHSMWYFYSA-N 1 3 335.467 2.665 10 0 EFAEHO CC1CC(C[NH2+][C@@H]2CN(C(=O)CN(C)CC(C)(C)C)CC2(C)C)C1 ZINC001486244845 1262848221 /nfs/dbraw/zinc/84/82/21/1262848221.db2.gz ZXRZISUTEQBHON-OFLPRAFFSA-N 1 3 337.552 2.837 10 0 EFAEHO CCCC[NH2+][C@H]1CN(C(=O)c2cccc(CN(C)C)c2)CC1(C)C ZINC001486249883 1262854584 /nfs/dbraw/zinc/85/45/84/1262854584.db2.gz LKHXTTFRRSLGBU-SFHVURJKSA-N 1 3 331.504 2.989 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@H](NC(=O)C(C)(C)N1CCCC1)C(C)(C)C ZINC001486407629 1263023580 /nfs/dbraw/zinc/02/35/80/1263023580.db2.gz SWILRUVTFNHZOM-HUUCEWRRSA-N 1 3 329.504 2.729 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C[NH2+]CC1CC(C)(C)C1)C(C)(C)C ZINC001486420776 1263068238 /nfs/dbraw/zinc/06/82/38/1263068238.db2.gz HEKAGCURPMXDPY-MRXNPFEDSA-N 1 3 334.508 2.817 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@H](C)C1)C1CC[NH+](CCC(C)(C)C)CC1 ZINC001486440738 1263151463 /nfs/dbraw/zinc/15/14/63/1263151463.db2.gz ZGTHMFATDMBVEN-DLBZAZTESA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC2=CC[N@H+](CC3CCC(C)CC3)CC2)C1 ZINC001486515617 1263301777 /nfs/dbraw/zinc/30/17/77/1263301777.db2.gz LNJLYEGNVAQKAW-FDYSRKEFSA-N 1 3 347.547 2.903 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC2=CC[N@@H+](CC3CCC(C)CC3)CC2)C1 ZINC001486515617 1263301785 /nfs/dbraw/zinc/30/17/85/1263301785.db2.gz LNJLYEGNVAQKAW-FDYSRKEFSA-N 1 3 347.547 2.903 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCCCCC3)C[C@H]21 ZINC001410125912 1263539696 /nfs/dbraw/zinc/53/96/96/1263539696.db2.gz SYTAACUPTRUREH-LDLYASANSA-N 1 3 335.536 2.593 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCCCCC3)C[C@H]21 ZINC001410125912 1263539706 /nfs/dbraw/zinc/53/97/06/1263539706.db2.gz SYTAACUPTRUREH-LDLYASANSA-N 1 3 335.536 2.593 10 0 EFAEHO CCCC[N@@H+]1C[C@@]2(C)CN(C(=O)CN(C)CC(C)(C)C)C[C@@]2(C)C1 ZINC001410173810 1264169956 /nfs/dbraw/zinc/16/99/56/1264169956.db2.gz CZJAYKQUNAWPOI-BGYRXZFFSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCC[N@H+]1C[C@@]2(C)CN(C(=O)CN(C)CC(C)(C)C)C[C@@]2(C)C1 ZINC001410173810 1264169958 /nfs/dbraw/zinc/16/99/58/1264169958.db2.gz CZJAYKQUNAWPOI-BGYRXZFFSA-N 1 3 337.552 2.935 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccccc2F)C1)CC(C)(C)C ZINC001410231666 1264430092 /nfs/dbraw/zinc/43/00/92/1264430092.db2.gz UTMXSVHQZKISSF-JCNLHEQBSA-N 1 3 349.494 2.788 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2cccc(C)c2)C1 ZINC001410232491 1264434354 /nfs/dbraw/zinc/43/43/54/1264434354.db2.gz ZORVPOUSSDLFOG-LNLFQRSKSA-N 1 3 331.504 2.882 10 0 EFAEHO C[C@H](F)CC[N@H+](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001410254616 1264551702 /nfs/dbraw/zinc/55/17/02/1264551702.db2.gz YHCHJKUYSFIEMM-HNNXBMFYSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001410254616 1264551710 /nfs/dbraw/zinc/55/17/10/1264551710.db2.gz YHCHJKUYSFIEMM-HNNXBMFYSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](C(=O)N(C)[C@@H](C[NH2+]Cc1cc(C)ccc1F)C1CC1)N(C)C ZINC001410307188 1264719663 /nfs/dbraw/zinc/71/96/63/1264719663.db2.gz HKSKRBNOBDWCJF-OALUTQOASA-N 1 3 349.494 2.801 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C[NH2+]CC1CCC(C)CC1)C1CC1 ZINC001410319224 1264775888 /nfs/dbraw/zinc/77/58/88/1264775888.db2.gz BANHPTVFCQPTLH-TVPLGVNVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N(C)C[C@H](C)NCc1ccccc1F ZINC001410385208 1264970345 /nfs/dbraw/zinc/97/03/45/1264970345.db2.gz MNSKKMHLPJSQDF-MAUKXSAKSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N(C)C[C@H](C)NCc1ccccc1F ZINC001410385208 1264970353 /nfs/dbraw/zinc/97/03/53/1264970353.db2.gz MNSKKMHLPJSQDF-MAUKXSAKSA-N 1 3 335.467 2.635 10 0 EFAEHO CCO[C@@H](C[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1)CN(C)C ZINC000922754667 1266739634 /nfs/dbraw/zinc/73/96/34/1266739634.db2.gz RGFLVDFFGBWMOD-PMACEKPBSA-N 1 3 345.531 2.740 10 0 EFAEHO CN(C/C=C\Cl)CC1CCN(C(=O)CCCC[NH+](C)C)CC1 ZINC001494211728 1268317786 /nfs/dbraw/zinc/31/77/86/1268317786.db2.gz XIWHFYXOKSKGFV-POHAHGRESA-N 1 3 329.916 2.641 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]C/C=C/c2ccccc2)C[C@@H]1C ZINC001410842906 1269768178 /nfs/dbraw/zinc/76/81/78/1269768178.db2.gz FZQXEBCYGZRCFR-ZNOOQZCJSA-N 1 3 329.488 2.619 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)[C@@H]1C ZINC001410874524 1269987848 /nfs/dbraw/zinc/98/78/48/1269987848.db2.gz YGFLYRLSQQIVEE-CRAIPNDOSA-N 1 3 335.467 2.553 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@@H](C[NH2+]Cc3ccsc3)C2)CCC1 ZINC001410948916 1270379846 /nfs/dbraw/zinc/37/98/46/1270379846.db2.gz HPNWLDYXXAXPJG-ZBFHGGJFSA-N 1 3 335.517 2.607 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2C[C@@H]([NH2+]C/C=C\Cl)C(C)(C)C2)c1 ZINC001411032350 1270732993 /nfs/dbraw/zinc/73/29/93/1270732993.db2.gz YYTASIZKVGJSHD-UXHZXRBQSA-N 1 3 349.906 2.941 10 0 EFAEHO C[C@@H]1CC[C@H](C)N(CCS(=O)(=O)CCN2C[C@@H](C)CC[C@@H]2C)C1 ZINC000744428792 1271041432 /nfs/dbraw/zinc/04/14/32/1271041432.db2.gz OFYWLKKVEIEMAP-MHORFTMASA-N 1 3 344.565 2.642 10 0 EFAEHO C[C@@H]1CC[C@H](C)N(CCS(=O)(=O)CC[N@@H+]2C[C@@H](C)CC[C@@H]2C)C1 ZINC000744428792 1271041440 /nfs/dbraw/zinc/04/14/40/1271041440.db2.gz OFYWLKKVEIEMAP-MHORFTMASA-N 1 3 344.565 2.642 10 0 EFAEHO C[C@@H]1CC[C@H](C)N(CCS(=O)(=O)CC[N@H+]2C[C@@H](C)CC[C@@H]2C)C1 ZINC000744428792 1271041447 /nfs/dbraw/zinc/04/14/47/1271041447.db2.gz OFYWLKKVEIEMAP-MHORFTMASA-N 1 3 344.565 2.642 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+](CCS(=O)(=O)CCN2C[C@@H](C)CC[C@@H]2C)C1 ZINC000744428792 1271041455 /nfs/dbraw/zinc/04/14/55/1271041455.db2.gz OFYWLKKVEIEMAP-MHORFTMASA-N 1 3 344.565 2.642 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+](CCS(=O)(=O)CCN2C[C@@H](C)CC[C@@H]2C)C1 ZINC000744428792 1271041458 /nfs/dbraw/zinc/04/14/58/1271041458.db2.gz OFYWLKKVEIEMAP-MHORFTMASA-N 1 3 344.565 2.642 10 0 EFAEHO C[C@@H]1CC[C@H](C)N(CCS(=O)(=O)CCN2C[C@@H](C)CC[C@H]2C)C1 ZINC000744428791 1271041590 /nfs/dbraw/zinc/04/15/90/1271041590.db2.gz OFYWLKKVEIEMAP-FZDBZEDMSA-N 1 3 344.565 2.642 10 0 EFAEHO C[C@@H]1CC[C@H](C)N(CCS(=O)(=O)CC[N@@H+]2C[C@@H](C)CC[C@H]2C)C1 ZINC000744428791 1271041595 /nfs/dbraw/zinc/04/15/95/1271041595.db2.gz OFYWLKKVEIEMAP-FZDBZEDMSA-N 1 3 344.565 2.642 10 0 EFAEHO C[C@@H]1CC[C@H](C)N(CCS(=O)(=O)CC[N@H+]2C[C@@H](C)CC[C@H]2C)C1 ZINC000744428791 1271041605 /nfs/dbraw/zinc/04/16/05/1271041605.db2.gz OFYWLKKVEIEMAP-FZDBZEDMSA-N 1 3 344.565 2.642 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+](CCS(=O)(=O)CCN2C[C@@H](C)CC[C@H]2C)C1 ZINC000744428791 1271041615 /nfs/dbraw/zinc/04/16/15/1271041615.db2.gz OFYWLKKVEIEMAP-FZDBZEDMSA-N 1 3 344.565 2.642 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+](CCS(=O)(=O)CCN2C[C@@H](C)CC[C@H]2C)C1 ZINC000744428791 1271041620 /nfs/dbraw/zinc/04/16/20/1271041620.db2.gz OFYWLKKVEIEMAP-FZDBZEDMSA-N 1 3 344.565 2.642 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccccc1)C(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001411184189 1271684990 /nfs/dbraw/zinc/68/49/90/1271684990.db2.gz BKGLHBGVOJUWKX-HXUWFJFHSA-N 1 3 343.515 2.697 10 0 EFAEHO CC[C@@H](C(=O)N(CC[N@H+](C)C[C@@H]1CCC(F)(F)C1)C(C)C)N(C)C ZINC001411197216 1271884805 /nfs/dbraw/zinc/88/48/05/1271884805.db2.gz WYIJCSGUTBKTGH-CVEARBPZSA-N 1 3 347.494 2.931 10 0 EFAEHO CC[C@@H](C(=O)N(CC[N@@H+](C)C[C@@H]1CCC(F)(F)C1)C(C)C)N(C)C ZINC001411197216 1271884820 /nfs/dbraw/zinc/88/48/20/1271884820.db2.gz WYIJCSGUTBKTGH-CVEARBPZSA-N 1 3 347.494 2.931 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCN(C(=O)CN2CCCC2)C(C)C)cc1 ZINC001411201470 1271904192 /nfs/dbraw/zinc/90/41/92/1271904192.db2.gz KZHVESIOSSWKEK-UHFFFAOYSA-N 1 3 331.504 2.760 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCN(C(=O)CN2CCCC2)C(C)C)cc1 ZINC001411201470 1271904199 /nfs/dbraw/zinc/90/41/99/1271904199.db2.gz KZHVESIOSSWKEK-UHFFFAOYSA-N 1 3 331.504 2.760 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H](CNCc1cc(F)ccc1F)C(C)(C)C ZINC001411225093 1272063988 /nfs/dbraw/zinc/06/39/88/1272063988.db2.gz QCISEDUILQETOA-MRXNPFEDSA-N 1 3 341.446 2.537 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C)C1)C1CC[NH+](CCC(C)(C)C)CC1 ZINC001411242461 1272113413 /nfs/dbraw/zinc/11/34/13/1272113413.db2.gz ZGTHMFATDMBVEN-IRXDYDNUSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccc(C[NH2+]C2CC(N(C)C(=O)CN(C)C(C)C)C2)cc1C ZINC001411256433 1272160680 /nfs/dbraw/zinc/16/06/80/1272160680.db2.gz XNEBHQNTSXJCMQ-UHFFFAOYSA-N 1 3 331.504 2.723 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1CC[NH+](CC2CC(F)(F)C2)CC1 ZINC001411257442 1272164290 /nfs/dbraw/zinc/16/42/90/1272164290.db2.gz GQUCJKJDGZJLHS-AWEZNQCLSA-N 1 3 345.478 2.589 10 0 EFAEHO CCC(CC)C[NH+]1CCC([C@H](C)NC(=O)[C@H](CC)N(C)C)CC1 ZINC001411264794 1272194311 /nfs/dbraw/zinc/19/43/11/1272194311.db2.gz QXGFHGOAGAEBRJ-YJBOKZPZSA-N 1 3 325.541 2.980 10 0 EFAEHO CCO[C@@H]1C[C@H](NC[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)[C@H]1OC ZINC000379795538 1272985959 /nfs/dbraw/zinc/98/59/59/1272985959.db2.gz CIPLIZYGHMIFSG-MTQWCTHYSA-N 1 3 332.488 2.681 10 0 EFAEHO CCO[C@@H]1C[C@H](NC[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)[C@H]1OC ZINC000379795538 1272985971 /nfs/dbraw/zinc/98/59/71/1272985971.db2.gz CIPLIZYGHMIFSG-MTQWCTHYSA-N 1 3 332.488 2.681 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CC[NH2+]CCc1ccc(Cl)cc1 ZINC001273139951 1273056937 /nfs/dbraw/zinc/05/69/37/1273056937.db2.gz IQDCYCMJKDXISL-CYBMUJFWSA-N 1 3 348.878 2.641 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001411282281 1274639213 /nfs/dbraw/zinc/63/92/13/1274639213.db2.gz PCBHFELCLMNSFB-KUHRKSKLSA-N 1 3 329.488 2.619 10 0 EFAEHO C[N@@H+]1CCCC[C@@H]1CCOC(=O)CCN1CCc2ccccc2C1 ZINC000786822285 1275553948 /nfs/dbraw/zinc/55/39/48/1275553948.db2.gz VSGDLIIEYZOCHZ-LJQANCHMSA-N 1 3 330.472 2.852 10 0 EFAEHO C[N@H+]1CCCC[C@@H]1CCOC(=O)CCN1CCc2ccccc2C1 ZINC000786822285 1275553956 /nfs/dbraw/zinc/55/39/56/1275553956.db2.gz VSGDLIIEYZOCHZ-LJQANCHMSA-N 1 3 330.472 2.852 10 0 EFAEHO CC[NH+](CC)CCO[C@H]1CCN(C[C@@H](O)c2ccc(F)cc2C)C1 ZINC000746674832 1275749630 /nfs/dbraw/zinc/74/96/30/1275749630.db2.gz KDCRSRBZPPGMKG-PKOBYXMFSA-N 1 3 338.467 2.600 10 0 EFAEHO COC(=O)/C(C)=C/C[NH2+]C1[C@H](C)CN(Cc2ccccc2)C[C@H]1C ZINC000787302471 1275750941 /nfs/dbraw/zinc/75/09/41/1275750941.db2.gz NROHMFIIVKQELT-QYHCQRMFSA-N 1 3 330.472 2.852 10 0 EFAEHO Cc1cc([C@@H](N)CC(=O)N[C@H](C)C(C)(C)C[NH+](C)C)cc(Cl)n1 ZINC000830413721 1276629824 /nfs/dbraw/zinc/62/98/24/1276629824.db2.gz CYHCQWUISVBTLF-OCCSQVGLSA-N 1 3 340.899 2.526 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N(C)C[C@@H](C)c1ccccc1 ZINC000820074083 1277034382 /nfs/dbraw/zinc/03/43/82/1277034382.db2.gz GGTHNXAPWHPCRK-MSOLQXFVSA-N 1 3 348.535 2.704 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N(C)C[C@@H](C)c1ccccc1 ZINC000820074083 1277034386 /nfs/dbraw/zinc/03/43/86/1277034386.db2.gz GGTHNXAPWHPCRK-MSOLQXFVSA-N 1 3 348.535 2.704 10 0 EFAEHO COC(=O)c1cc(CN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)ccc1C ZINC000872145687 1287443472 /nfs/dbraw/zinc/44/34/72/1287443472.db2.gz WLORUAMOURIGBS-QRQLOZEOSA-N 1 3 346.471 2.642 10 0 EFAEHO CN(CCCCCC[NH3+])CC(=O)N1CCC(Cc2ccccc2)CC1 ZINC000872154904 1287449096 /nfs/dbraw/zinc/44/90/96/1287449096.db2.gz DUCWARRBSSZSNV-UHFFFAOYSA-N 1 3 345.531 2.919 10 0 EFAEHO COc1ccccc1[C@@H]1CSCCCN1C[C@@H]1CCC2(C[NH2+]C2)O1 ZINC000872157053 1287451105 /nfs/dbraw/zinc/45/11/05/1287451105.db2.gz HKFDDWZRMDTZOH-RDJZCZTQSA-N 1 3 348.512 2.696 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2CNC[C@H](O)CC(C)(C)O)C1 ZINC000872199748 1287472165 /nfs/dbraw/zinc/47/21/65/1287472165.db2.gz AZCJFLKSBCCCCI-FUHIMQAGSA-N 1 3 348.531 2.776 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC[C@H](O)CC(C)(C)O)C1 ZINC000872199748 1287472171 /nfs/dbraw/zinc/47/21/71/1287472171.db2.gz AZCJFLKSBCCCCI-FUHIMQAGSA-N 1 3 348.531 2.776 10 0 EFAEHO CN(C)[C@@H](CNC(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1)c1ccccc1 ZINC000809941518 1282633954 /nfs/dbraw/zinc/63/39/54/1282633954.db2.gz AVAUSPCGAYAUIR-LPHOPBHVSA-N 1 3 335.467 2.618 10 0 EFAEHO CN(C)[C@@H](CNC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1)c1ccccc1 ZINC000809941518 1282633960 /nfs/dbraw/zinc/63/39/60/1282633960.db2.gz AVAUSPCGAYAUIR-LPHOPBHVSA-N 1 3 335.467 2.618 10 0 EFAEHO CN(C)[C@@H](CNC(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1)c1ccccc1 ZINC000809941519 1282636406 /nfs/dbraw/zinc/63/64/06/1282636406.db2.gz AVAUSPCGAYAUIR-QFBILLFUSA-N 1 3 335.467 2.618 10 0 EFAEHO CN(C)[C@@H](CNC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1)c1ccccc1 ZINC000809941519 1282636413 /nfs/dbraw/zinc/63/64/13/1282636413.db2.gz AVAUSPCGAYAUIR-QFBILLFUSA-N 1 3 335.467 2.618 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC[C@@H]2C[NH+]2CCCCC2)C1 ZINC000810334434 1283142779 /nfs/dbraw/zinc/14/27/79/1283142779.db2.gz FDHJTWKZCVFAJP-VQIMIIECSA-N 1 3 339.499 2.676 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCC[N@@H+](C3CCCC3)CC2)C1 ZINC000810426244 1283222657 /nfs/dbraw/zinc/22/26/57/1283222657.db2.gz PAEVLXQWNVHYQZ-IBGZPJMESA-N 1 3 339.499 2.676 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCC[N@H+](C3CCCC3)CC2)C1 ZINC000810426244 1283222663 /nfs/dbraw/zinc/22/26/63/1283222663.db2.gz PAEVLXQWNVHYQZ-IBGZPJMESA-N 1 3 339.499 2.676 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CC[C@H](C[NH+]3CCCCC3)C2)C1 ZINC000810443166 1283245546 /nfs/dbraw/zinc/24/55/46/1283245546.db2.gz LKNOLEUREHVOKX-APWZRJJASA-N 1 3 339.499 2.533 10 0 EFAEHO C[NH+](C)CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CCCC1 ZINC000810549218 1283374836 /nfs/dbraw/zinc/37/48/36/1283374836.db2.gz JGIBKTWFJXIPRZ-SFHVURJKSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C[C@H]1C ZINC000813462620 1285932440 /nfs/dbraw/zinc/93/24/40/1285932440.db2.gz ZHESMNFDMIGALS-VKJFTORMSA-N 1 3 327.488 2.530 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C[C@H]1C ZINC000813462620 1285932441 /nfs/dbraw/zinc/93/24/41/1285932441.db2.gz ZHESMNFDMIGALS-VKJFTORMSA-N 1 3 327.488 2.530 10 0 EFAEHO Cc1cc(C)cc(-n2ncc(CNC3CCC([NH+](C)C)CC3)n2)c1 ZINC000817416185 1288592699 /nfs/dbraw/zinc/59/26/99/1288592699.db2.gz OZEBMUHGMVWUQA-UHFFFAOYSA-N 1 3 327.476 2.847 10 0 EFAEHO COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903439504 1312682598 /nfs/dbraw/zinc/68/25/98/1312682598.db2.gz IXRNVVBOOMVJKF-VYDXJSESSA-N 1 3 331.460 2.534 10 0 EFAEHO CN(CC(=O)N(C)[C@@H](C[NH2+]C/C=C/Cl)C1CC1)CC(C)(C)C ZINC001277692458 1312748116 /nfs/dbraw/zinc/74/81/16/1312748116.db2.gz CIEODZADJPCWLB-PPYMECGQSA-N 1 3 329.916 2.543 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)[C@H](C)N1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903495290 1312768911 /nfs/dbraw/zinc/76/89/11/1312768911.db2.gz YXCSWKAFSQTOGN-FRRDWIJNSA-N 1 3 339.867 2.592 10 0 EFAEHO CC(C)[C@H](NC(=O)CN1C[C@@H](C)[C@H](CC[NH3+])C1)c1ccc(F)cc1 ZINC000903495851 1312769724 /nfs/dbraw/zinc/76/97/24/1312769724.db2.gz ACBBCGDZIGHTPC-OGWOLHLISA-N 1 3 335.467 2.556 10 0 EFAEHO CC(C)[C@@H](NC(=O)CN1C[C@@H](C)[C@H](CC[NH3+])C1)c1ccc(F)cc1 ZINC000903495850 1312769811 /nfs/dbraw/zinc/76/98/11/1312769811.db2.gz ACBBCGDZIGHTPC-IDHHARJASA-N 1 3 335.467 2.556 10 0 EFAEHO C[C@@H](NC(=O)[C@H](C)N1C[C@@H](C)[C@H](CC[NH3+])C1)c1cc2ccccc2o1 ZINC000903496332 1312770597 /nfs/dbraw/zinc/77/05/97/1312770597.db2.gz KNEMZQRWIKNIIL-PNBKFKSVSA-N 1 3 343.471 2.915 10 0 EFAEHO CCOc1ccc(-c2noc(CN3C[C@@H](C)[C@H](CC[NH3+])C3)n2)cc1 ZINC000903496790 1312772818 /nfs/dbraw/zinc/77/28/18/1312772818.db2.gz DWJNMLUWEWZUTH-UKRRQHHQSA-N 1 3 330.432 2.552 10 0 EFAEHO C[C@@H]1CN([C@@H]2CCCN(c3ccccc3Cl)C2=O)C[C@H]1CC[NH3+] ZINC000903497431 1312774654 /nfs/dbraw/zinc/77/46/54/1312774654.db2.gz WNVFVRJSYWGOBX-CKEIUWERSA-N 1 3 335.879 2.752 10 0 EFAEHO C([C@H]1CCC2(CCOCC2)O1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000878286926 1291602891 /nfs/dbraw/zinc/60/28/91/1291602891.db2.gz VJDFSZWSBDKZDW-QRQLOZEOSA-N 1 3 334.504 2.663 10 0 EFAEHO C([C@H]1CCC2(CCOCC2)O1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000878286926 1291602896 /nfs/dbraw/zinc/60/28/96/1291602896.db2.gz VJDFSZWSBDKZDW-QRQLOZEOSA-N 1 3 334.504 2.663 10 0 EFAEHO CCc1ccccc1C[NH2+]CCN(CC)C(=O)CN1CC[C@@H](C)C1 ZINC001273610838 1292379607 /nfs/dbraw/zinc/37/96/07/1292379607.db2.gz QTFRNZPEWWCPAX-QGZVFWFLSA-N 1 3 331.504 2.529 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001276339809 1292949293 /nfs/dbraw/zinc/94/92/93/1292949293.db2.gz KGJQILVBZJGULD-KRWDZBQOSA-N 1 3 339.911 2.864 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[NH2+]CCCCc1ccccc1 ZINC001277824364 1313033775 /nfs/dbraw/zinc/03/37/75/1313033775.db2.gz XFGGLMIIGJKTCJ-PMACEKPBSA-N 1 3 343.515 2.684 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]1C[NH2+]CCCCc1ccccc1 ZINC001277824365 1313033908 /nfs/dbraw/zinc/03/39/08/1313033908.db2.gz XFGGLMIIGJKTCJ-UXHICEINSA-N 1 3 343.515 2.684 10 0 EFAEHO O=C(CCN1CCc2ccccc2C1)OCCC[NH+]1CCCCC1 ZINC000800219925 1293962671 /nfs/dbraw/zinc/96/26/71/1293962671.db2.gz BMSCYWCVVDVBQO-UHFFFAOYSA-N 1 3 330.472 2.854 10 0 EFAEHO c1cc([C@H]2CCCN2C[C@H]2CC3(CO2)CC[NH2+]CC3)cc2c1OCO2 ZINC000903729690 1313130313 /nfs/dbraw/zinc/13/03/13/1313130313.db2.gz QNFCJLZXPDVBBE-IAGOWNOFSA-N 1 3 344.455 2.711 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]C/C=C\CNC(=O)CN(C)C2CCC2)c1 ZINC001274089992 1295450673 /nfs/dbraw/zinc/45/06/73/1295450673.db2.gz TZNMVJGVTSIHSJ-VGOKWCNXSA-N 1 3 329.488 2.802 10 0 EFAEHO CC[C@H](C(=O)NC/C=C/C[NH2+][C@H](C)c1cc(C)ccc1C)N(C)C ZINC001274125942 1295483769 /nfs/dbraw/zinc/48/37/69/1295483769.db2.gz VXWDJRBKBKSGJU-GXLYXMFMSA-N 1 3 331.504 2.967 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C/CNC(=O)[C@H](C(C)C)N(C)C)c(C)c1 ZINC001274517965 1296099931 /nfs/dbraw/zinc/09/99/31/1296099931.db2.gz AEZNPZKCZBBLHG-UCFODXPJSA-N 1 3 331.504 2.652 10 0 EFAEHO CCCCC[N@@H+]1CC[C@]2(C1)CCCN(C(=O)C1(N(C)C)CCC1)C2 ZINC001273841058 1296274691 /nfs/dbraw/zinc/27/46/91/1296274691.db2.gz QRVOQXCYBXOKJA-IBGZPJMESA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCC[N@H+]1CC[C@]2(C1)CCCN(C(=O)C1(N(C)C)CCC1)C2 ZINC001273841058 1296274697 /nfs/dbraw/zinc/27/46/97/1296274697.db2.gz QRVOQXCYBXOKJA-IBGZPJMESA-N 1 3 335.536 2.975 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1CCCN1C ZINC001275915145 1296450847 /nfs/dbraw/zinc/45/08/47/1296450847.db2.gz KDLNFZIQGDFVDG-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CSc1ccc([C@H](CNC(=O)[C@H](C)CC[NH+](C)C)N(C)C)cc1 ZINC001413002644 1296605545 /nfs/dbraw/zinc/60/55/45/1296605545.db2.gz LIASEXDKQSLHBY-PBHICJAKSA-N 1 3 337.533 2.715 10 0 EFAEHO Cc1cccc2nc(CC[NH2+][C@H]3CCNC[C@H]3C3CCCC3)cn21 ZINC000925713410 1296871259 /nfs/dbraw/zinc/87/12/59/1296871259.db2.gz RYXRVUSPEGLWCJ-OALUTQOASA-N 1 3 326.488 2.943 10 0 EFAEHO Cc1cccc2nc(CCN[C@H]3CC[NH2+]C[C@H]3C3CCCC3)cn21 ZINC000925713410 1296871277 /nfs/dbraw/zinc/87/12/77/1296871277.db2.gz RYXRVUSPEGLWCJ-OALUTQOASA-N 1 3 326.488 2.943 10 0 EFAEHO C[N@H+]1C[C@H]2CC[C@@H](C1)C2NC[C@H](O)c1ccc(C(F)(F)F)cc1 ZINC000926424787 1296928036 /nfs/dbraw/zinc/92/80/36/1296928036.db2.gz QFFKSUIWEJCTGS-CSOLROPVSA-N 1 3 328.378 2.669 10 0 EFAEHO C[N@@H+]1C[C@H]2CC[C@@H](C1)C2NC[C@H](O)c1ccc(C(F)(F)F)cc1 ZINC000926424787 1296928041 /nfs/dbraw/zinc/92/80/41/1296928041.db2.gz QFFKSUIWEJCTGS-CSOLROPVSA-N 1 3 328.378 2.669 10 0 EFAEHO CO[C@](C)(CO)CNC1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000926663494 1296946947 /nfs/dbraw/zinc/94/69/47/1296946947.db2.gz RKJBDZVTQYMQGI-NXEWRWPSSA-N 1 3 332.488 2.559 10 0 EFAEHO CO[C@](C)(CO)CNC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000926663494 1296946962 /nfs/dbraw/zinc/94/69/62/1296946962.db2.gz RKJBDZVTQYMQGI-NXEWRWPSSA-N 1 3 332.488 2.559 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+]2CCC[C@H]2Cc2ccccc2)cnn1C ZINC000903878942 1313336044 /nfs/dbraw/zinc/33/60/44/1313336044.db2.gz NUCFSKBLRLDIMI-ICSRJNTNSA-N 1 3 326.488 2.553 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+]2CCC[C@H]2Cc2ccccc2)cnn1C ZINC000903878942 1313336048 /nfs/dbraw/zinc/33/60/48/1313336048.db2.gz NUCFSKBLRLDIMI-ICSRJNTNSA-N 1 3 326.488 2.553 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CCC[C@@H]2Cc2ccccc2)cnn1C ZINC000903878944 1313336446 /nfs/dbraw/zinc/33/64/46/1313336446.db2.gz NUCFSKBLRLDIMI-UYAOXDASSA-N 1 3 326.488 2.553 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CCC[C@@H]2Cc2ccccc2)cnn1C ZINC000903878944 1313336450 /nfs/dbraw/zinc/33/64/50/1313336450.db2.gz NUCFSKBLRLDIMI-UYAOXDASSA-N 1 3 326.488 2.553 10 0 EFAEHO C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C[NH+]1CCC(N(C)C)CC1 ZINC000929263852 1297172522 /nfs/dbraw/zinc/17/25/22/1297172522.db2.gz OKGAYNBATZMTTC-HUUCEWRRSA-N 1 3 325.497 2.515 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+]2CCCC[C@H]2Cc2ccccc2)cnn1C ZINC000903890187 1313359384 /nfs/dbraw/zinc/35/93/84/1313359384.db2.gz ZCHPJLBVULUDHP-FPOVZHCZSA-N 1 3 340.515 2.943 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+]2CCCC[C@H]2Cc2ccccc2)cnn1C ZINC000903890187 1313359387 /nfs/dbraw/zinc/35/93/87/1313359387.db2.gz ZCHPJLBVULUDHP-FPOVZHCZSA-N 1 3 340.515 2.943 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+](CCc2cccc(F)c2)C2CC2)cnn1C ZINC000903893200 1313364527 /nfs/dbraw/zinc/36/45/27/1313364527.db2.gz SGLOWGYEVSCCRJ-QGZVFWFLSA-N 1 3 344.478 2.692 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+](CCc2cccc(F)c2)C2CC2)cnn1C ZINC000903893200 1313364530 /nfs/dbraw/zinc/36/45/30/1313364530.db2.gz SGLOWGYEVSCCRJ-QGZVFWFLSA-N 1 3 344.478 2.692 10 0 EFAEHO CC[C@H](Cc1ccccc1)N(C)Cc1cnnn1[C@H]1CCC[NH2+]C1 ZINC000903894859 1313367937 /nfs/dbraw/zinc/36/79/37/1313367937.db2.gz GLBXZICUFDGTOQ-MSOLQXFVSA-N 1 3 327.476 2.656 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CC[C@H](c3ccccc3)[C@H]2C)cnn1C ZINC000903897255 1313372616 /nfs/dbraw/zinc/37/26/16/1313372616.db2.gz GLNQCSDKGDGIQS-HLIPFELVSA-N 1 3 326.488 2.724 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CC[C@H](c3ccccc3)[C@H]2C)cnn1C ZINC000903897255 1313372620 /nfs/dbraw/zinc/37/26/20/1313372620.db2.gz GLNQCSDKGDGIQS-HLIPFELVSA-N 1 3 326.488 2.724 10 0 EFAEHO CC[C@@H](Cc1ccc(C)cc1)N(C)Cc1cnnn1[C@H]1CCC[NH2+]C1 ZINC000903898498 1313375611 /nfs/dbraw/zinc/37/56/11/1313375611.db2.gz NYZJPMRRSMBQRN-OALUTQOASA-N 1 3 341.503 2.964 10 0 EFAEHO CCN(C[C@H](C[NH3+])Cc1cnn(C)c1C)[C@@H](C)c1cccc(O)c1 ZINC000903904206 1313386056 /nfs/dbraw/zinc/38/60/56/1313386056.db2.gz RITPVCTUKISWLF-HOTGVXAUSA-N 1 3 330.476 2.635 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN2CCC(c3ccsc3)CC2)cnn1C ZINC000903910200 1313396364 /nfs/dbraw/zinc/39/63/64/1313396364.db2.gz KJTSKAZQYNRJJP-HNNXBMFYSA-N 1 3 332.517 2.787 10 0 EFAEHO CC[C@H]1Cc2ccccc2CN1C[C@H](C[NH3+])Cc1cnn(C)c1C ZINC000903910589 1313397889 /nfs/dbraw/zinc/39/78/89/1313397889.db2.gz OJNQGOOBPSIESS-JXFKEZNVSA-N 1 3 326.488 2.683 10 0 EFAEHO Cc1c(C[C@@H](CN)C[NH2+][C@@H](Cc2ccc(F)cc2)C(C)C)cnn1C ZINC000903926471 1313428018 /nfs/dbraw/zinc/42/80/18/1313428018.db2.gz SMHNXJAHYIGVCD-PXNSSMCTSA-N 1 3 346.494 2.842 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H]1C[C@H](CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001488844425 1297796071 /nfs/dbraw/zinc/79/60/71/1297796071.db2.gz QSMFVVGNUOADSN-UAPYVXQJSA-N 1 3 343.515 2.854 10 0 EFAEHO CSc1cc(C)ccc1CNC[C@@H](C[NH3+])Cc1cnn(C)c1C ZINC000903922645 1313424249 /nfs/dbraw/zinc/42/42/49/1313424249.db2.gz BFMLWPACCZASOI-OAHLLOKOSA-N 1 3 332.517 2.666 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+](C)[C@H](C)Cc2cccc(F)c2)cnn1C ZINC000903929977 1313434856 /nfs/dbraw/zinc/43/48/56/1313434856.db2.gz PAILZJQKPVBEOM-RHSMWYFYSA-N 1 3 332.467 2.548 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+](C)[C@H](C)Cc2cccc(F)c2)cnn1C ZINC000903929977 1313434859 /nfs/dbraw/zinc/43/48/59/1313434859.db2.gz PAILZJQKPVBEOM-RHSMWYFYSA-N 1 3 332.467 2.548 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN(C)[C@H](C)Cc2cccc(F)c2)cnn1C ZINC000903929977 1313434863 /nfs/dbraw/zinc/43/48/63/1313434863.db2.gz PAILZJQKPVBEOM-RHSMWYFYSA-N 1 3 332.467 2.548 10 0 EFAEHO C[NH+]1CCC(C(=O)NC[C@H]2CC[C@@H](NC/C(Cl)=C/Cl)C2)CC1 ZINC001488948834 1297894166 /nfs/dbraw/zinc/89/41/66/1297894166.db2.gz OZICRNKSBWCPOP-INTWUNTISA-N 1 3 348.318 2.522 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN[C@@H]2CCc3cc(Cl)ccc32)cnn1C ZINC000903934239 1313442714 /nfs/dbraw/zinc/44/27/14/1313442714.db2.gz FFMNTFVHONDEKN-SCLBCKFNSA-N 1 3 332.879 2.776 10 0 EFAEHO CC[C@@](C)(NC[C@@H](C[NH3+])Cc1cnn(C)c1C)c1ccc(F)cc1 ZINC000903935674 1313446076 /nfs/dbraw/zinc/44/60/76/1313446076.db2.gz SFCSYGHVWVFUTC-DNVCBOLYSA-N 1 3 332.467 2.900 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@H+](CC3CCC3)[C@@H]2C1(C)C ZINC001489088035 1298047411 /nfs/dbraw/zinc/04/74/11/1298047411.db2.gz UEYXDJFZYSMUAC-UHOSZYNNSA-N 1 3 335.536 2.732 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@@H+](CC3CCC3)[C@@H]2C1(C)C ZINC001489088035 1298047422 /nfs/dbraw/zinc/04/74/22/1298047422.db2.gz UEYXDJFZYSMUAC-UHOSZYNNSA-N 1 3 335.536 2.732 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2CCC[N@H+](CC3CCC3)[C@H]2C1(C)C ZINC001489088032 1298048635 /nfs/dbraw/zinc/04/86/35/1298048635.db2.gz UEYXDJFZYSMUAC-BHIYHBOVSA-N 1 3 335.536 2.732 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2CCC[N@@H+](CC3CCC3)[C@H]2C1(C)C ZINC001489088032 1298048641 /nfs/dbraw/zinc/04/86/41/1298048641.db2.gz UEYXDJFZYSMUAC-BHIYHBOVSA-N 1 3 335.536 2.732 10 0 EFAEHO CCCN(C)CC(=O)N1CCCCC[C@@H]([NH2+]Cc2cnccc2C)C1 ZINC001489241728 1298151629 /nfs/dbraw/zinc/15/16/29/1298151629.db2.gz VYIGRKGDOUYHDG-LJQANCHMSA-N 1 3 346.519 2.593 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)C2(C[NH+](C)C)CC2)CCN1CCCc1ccsc1 ZINC001489286367 1298156298 /nfs/dbraw/zinc/15/62/98/1298156298.db2.gz IRWUIRINRVMPSU-WBVHZDCISA-N 1 3 349.544 2.602 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccc(CF)cc2)[C@@H]1C ZINC001489301013 1298165846 /nfs/dbraw/zinc/16/58/46/1298165846.db2.gz NHMPFMWWQMIUTG-QAPCUYQASA-N 1 3 335.467 2.577 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccc(CF)cc2)[C@@H]1C ZINC001489301013 1298165852 /nfs/dbraw/zinc/16/58/52/1298165852.db2.gz NHMPFMWWQMIUTG-QAPCUYQASA-N 1 3 335.467 2.577 10 0 EFAEHO FC1(F)CCNC[C@H]1C[NH2+]Cc1ccc(Oc2cnccn2)cc1 ZINC000903955168 1313482000 /nfs/dbraw/zinc/48/20/00/1313482000.db2.gz LYFATVVOPRFYMC-AWEZNQCLSA-N 1 3 334.370 2.603 10 0 EFAEHO FC1(F)CCNC[C@@H]1C[NH2+]Cc1ccc(OC[C@H]2CCCO2)cc1 ZINC000903955311 1313482262 /nfs/dbraw/zinc/48/22/62/1313482262.db2.gz OWVOEFBMWUIKAW-NVXWUHKLSA-N 1 3 340.414 2.579 10 0 EFAEHO C[C@@H](CCc1n[nH]c2ccccc21)N[C@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903971716 1313518342 /nfs/dbraw/zinc/51/83/42/1313518342.db2.gz CFKUEGCFWSPAMH-JKSUJKDBSA-N 1 3 342.487 2.632 10 0 EFAEHO Fc1cc(CN2C[C@H]3CC[C@@H](C2)N3C2CC[NH2+]CC2)cc(F)c1F ZINC000903980117 1313529917 /nfs/dbraw/zinc/52/99/17/1313529917.db2.gz IDTRHQNRDOOEEU-GASCZTMLSA-N 1 3 339.405 2.505 10 0 EFAEHO Fc1cc(CN2C[C@H]3CC[C@@H](C2)[N@H+]3C2CCNCC2)cc(F)c1F ZINC000903980117 1313529921 /nfs/dbraw/zinc/52/99/21/1313529921.db2.gz IDTRHQNRDOOEEU-GASCZTMLSA-N 1 3 339.405 2.505 10 0 EFAEHO Fc1cc(CN2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CCNCC2)cc(F)c1F ZINC000903980117 1313529925 /nfs/dbraw/zinc/52/99/25/1313529925.db2.gz IDTRHQNRDOOEEU-GASCZTMLSA-N 1 3 339.405 2.505 10 0 EFAEHO Fc1ccc(/C=C\CN2C[C@H]3CC[C@@H](C2)[N@H+]3C2CCNCC2)c(F)c1 ZINC000903980607 1313531502 /nfs/dbraw/zinc/53/15/02/1313531502.db2.gz VRAGWTMKEVHHLU-XJSUHANISA-N 1 3 347.453 2.879 10 0 EFAEHO Fc1ccc(/C=C\CN2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CCNCC2)c(F)c1 ZINC000903980607 1313531506 /nfs/dbraw/zinc/53/15/06/1313531506.db2.gz VRAGWTMKEVHHLU-XJSUHANISA-N 1 3 347.453 2.879 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)CCCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001490250203 1298676510 /nfs/dbraw/zinc/67/65/10/1298676510.db2.gz GCXMSCUZYLFHJI-MRXNPFEDSA-N 1 3 331.504 2.583 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)CCCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001490250203 1298676520 /nfs/dbraw/zinc/67/65/20/1298676520.db2.gz GCXMSCUZYLFHJI-MRXNPFEDSA-N 1 3 331.504 2.583 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@H+](C)CCCNC(=O)CN1CC[C@H](C)C1 ZINC001490250613 1298678555 /nfs/dbraw/zinc/67/85/55/1298678555.db2.gz NAWJLGNCLAXBOV-FUHWJXTLSA-N 1 3 331.504 2.836 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@@H+](C)CCCNC(=O)CN1CC[C@H](C)C1 ZINC001490250613 1298678561 /nfs/dbraw/zinc/67/85/61/1298678561.db2.gz NAWJLGNCLAXBOV-FUHWJXTLSA-N 1 3 331.504 2.836 10 0 EFAEHO Cc1cncc(C[NH2+][C@H](C)[C@@H]2CCCCN2C(=O)CN(C)C(C)C)c1 ZINC001490309660 1298753873 /nfs/dbraw/zinc/75/38/73/1298753873.db2.gz MHKHGLNLHXQUCG-MJGOQNOKSA-N 1 3 346.519 2.589 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](NCc1ccccc1F)C1CC1 ZINC001490671405 1299070791 /nfs/dbraw/zinc/07/07/91/1299070791.db2.gz IUIDEOFHOFDTAA-RBUKOAKNSA-N 1 3 347.478 2.685 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](NCc1ccccc1F)C1CC1 ZINC001490671405 1299070796 /nfs/dbraw/zinc/07/07/96/1299070796.db2.gz IUIDEOFHOFDTAA-RBUKOAKNSA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CC1CC(C)(C)C1)C1CC1 ZINC001490661408 1299102888 /nfs/dbraw/zinc/10/28/88/1299102888.db2.gz MRHQITAUJLGLNI-ZWKOTPCHSA-N 1 3 335.536 2.780 10 0 EFAEHO Cc1ccc(CN[C@@H](CNC(=O)[C@@H]2CC[N@@H+](C)C2)C2CC2)c(Cl)c1 ZINC001490739727 1299176316 /nfs/dbraw/zinc/17/63/16/1299176316.db2.gz LAOVRKOTPOJFHX-AEFFLSMTSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1ccc(CN[C@@H](CNC(=O)[C@@H]2CC[N@H+](C)C2)C2CC2)c(Cl)c1 ZINC001490739727 1299176320 /nfs/dbraw/zinc/17/63/20/1299176320.db2.gz LAOVRKOTPOJFHX-AEFFLSMTSA-N 1 3 349.906 2.585 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCC[C@H](C[N@H+](C)CCCF)C1 ZINC001490776789 1299241278 /nfs/dbraw/zinc/24/12/78/1299241278.db2.gz RVARGUUPMPUTEN-QZTJIDSGSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCC[C@H](C[N@@H+](C)CCCF)C1 ZINC001490776789 1299241290 /nfs/dbraw/zinc/24/12/90/1299241290.db2.gz RVARGUUPMPUTEN-QZTJIDSGSA-N 1 3 341.515 2.779 10 0 EFAEHO O=C(CN1CCC[C@H](C2CC[NH2+]CC2)C1)NC1CCCCCCC1 ZINC000852753641 1299863629 /nfs/dbraw/zinc/86/36/29/1299863629.db2.gz FKTNQEMZJKHMSG-SFHVURJKSA-N 1 3 335.536 2.927 10 0 EFAEHO CC(C)C1CCC(N2CCN(C(=O)C=C3CC[NH2+]CC3)CC2)CC1 ZINC000852873181 1299922739 /nfs/dbraw/zinc/92/27/39/1299922739.db2.gz XCUQOUHJHSYMMP-UHFFFAOYSA-N 1 3 333.520 2.655 10 0 EFAEHO O[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)c1ccccn1 ZINC000853098259 1300006068 /nfs/dbraw/zinc/00/60/68/1300006068.db2.gz HWLZEBIIFFCSGI-SMLSOGCJSA-N 1 3 337.467 2.900 10 0 EFAEHO FC1(F)C[C@@H]1OCC[N@@H+]1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1 ZINC000689030475 1300081657 /nfs/dbraw/zinc/08/16/57/1300081657.db2.gz RHZSRNRDUHKOMF-KSZLIROESA-N 1 3 336.426 2.865 10 0 EFAEHO FC1(F)C[C@@H]1OCC[N@H+]1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1 ZINC000689030475 1300081670 /nfs/dbraw/zinc/08/16/70/1300081670.db2.gz RHZSRNRDUHKOMF-KSZLIROESA-N 1 3 336.426 2.865 10 0 EFAEHO CCN(C(=O)NCCCCCCC[NH+]1CCCC1)[C@@H]1CCN(C)C1 ZINC000853819925 1300294519 /nfs/dbraw/zinc/29/45/19/1300294519.db2.gz FMVOMAVDFMXDLA-GOSISDBHSA-N 1 3 338.540 2.768 10 0 EFAEHO CCN(C(=O)NC1CCC([NH+]2CCCCC2)CC1)[C@@H]1CCN(C)C1 ZINC000853832510 1300300889 /nfs/dbraw/zinc/30/08/89/1300300889.db2.gz AQCIGPUNOVBEEX-DAWZGUTISA-N 1 3 336.524 2.519 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)C[C@@H](N)c1cc(C)nc(Cl)c1 ZINC000854013656 1300389584 /nfs/dbraw/zinc/38/95/84/1300389584.db2.gz AUTJGXMKVXURNY-CQSZACIVSA-N 1 3 340.899 2.670 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)C[C@@H](N)c1cc(C)nc(Cl)c1 ZINC000854013656 1300389593 /nfs/dbraw/zinc/38/95/93/1300389593.db2.gz AUTJGXMKVXURNY-CQSZACIVSA-N 1 3 340.899 2.670 10 0 EFAEHO CN(Cc1ccc(C[NH+](C)C)cc1)C(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000854247499 1300486453 /nfs/dbraw/zinc/48/64/53/1300486453.db2.gz YSBVGUOPLMNJOK-SFHVURJKSA-N 1 3 346.519 2.762 10 0 EFAEHO C/C(=C/C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1cccc(F)c1 ZINC000855346381 1300924306 /nfs/dbraw/zinc/92/43/06/1300924306.db2.gz ZMKLQQXEHUAHBV-IRVMHKCDSA-N 1 3 335.467 2.617 10 0 EFAEHO C/C(=C/C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1cccc(F)c1 ZINC000855346381 1300924318 /nfs/dbraw/zinc/92/43/18/1300924318.db2.gz ZMKLQQXEHUAHBV-IRVMHKCDSA-N 1 3 335.467 2.617 10 0 EFAEHO COc1ccc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1C1CC1 ZINC000855347155 1300924928 /nfs/dbraw/zinc/92/49/28/1300924928.db2.gz VUOWRMWSJPHQCE-HNNXBMFYSA-N 1 3 347.503 2.574 10 0 EFAEHO COc1ccc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1C1CC1 ZINC000855347155 1300924935 /nfs/dbraw/zinc/92/49/35/1300924935.db2.gz VUOWRMWSJPHQCE-HNNXBMFYSA-N 1 3 347.503 2.574 10 0 EFAEHO Cc1cc2[nH]c(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc2c(C)c1 ZINC000855346263 1300925123 /nfs/dbraw/zinc/92/51/23/1300925123.db2.gz UVVWWNCRHXJSFL-INIZCTEOSA-N 1 3 344.503 2.787 10 0 EFAEHO Cc1cc2[nH]c(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc2c(C)c1 ZINC000855346263 1300925127 /nfs/dbraw/zinc/92/51/27/1300925127.db2.gz UVVWWNCRHXJSFL-INIZCTEOSA-N 1 3 344.503 2.787 10 0 EFAEHO CN(C)CCC[N@H+](C)C[C@@H]1CC(F)(F)CN1C(=O)OC(C)(C)C ZINC000862367035 1302350294 /nfs/dbraw/zinc/35/02/94/1302350294.db2.gz SOPUYQQMRFNZLH-ZDUSSCGKSA-N 1 3 335.439 2.515 10 0 EFAEHO CN(C)CCC[N@@H+](C)C[C@@H]1CC(F)(F)CN1C(=O)OC(C)(C)C ZINC000862367035 1302350316 /nfs/dbraw/zinc/35/03/16/1302350316.db2.gz SOPUYQQMRFNZLH-ZDUSSCGKSA-N 1 3 335.439 2.515 10 0 EFAEHO Cc1c(C[NH2+]CC2CCN(Cc3ccncc3)CC2)ccnc1F ZINC000862411829 1302372549 /nfs/dbraw/zinc/37/25/49/1302372549.db2.gz FNDQUGBHKHELHY-UHFFFAOYSA-N 1 3 328.435 2.926 10 0 EFAEHO C[C@@H]1CC[C@H](NCC2CCN(C(=O)OCc3ccccc3)CC2)C[NH2+]1 ZINC000863649262 1302669048 /nfs/dbraw/zinc/66/90/48/1302669048.db2.gz BFIVRNFFPRPWEO-APWZRJJASA-N 1 3 345.487 2.765 10 0 EFAEHO CC(C)(C)OC(=O)N1CCC[C@@H]1CNC1CC[NH+](CC2CC2)CC1 ZINC000865418935 1303246867 /nfs/dbraw/zinc/24/68/67/1303246867.db2.gz OAEOFKNKNNAOJF-QGZVFWFLSA-N 1 3 337.508 2.850 10 0 EFAEHO CCN1CCC[C@H](C[NH2+]CC23CC(C2)CN3C(=O)OC(C)(C)C)C1 ZINC000865437820 1303256714 /nfs/dbraw/zinc/25/67/14/1303256714.db2.gz SQGCVDRVYSYHBL-MDCZIUGASA-N 1 3 337.508 2.707 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+]Cc2cnc(Cl)c(F)c2)C[C@@H](C)O1 ZINC000865472314 1303272526 /nfs/dbraw/zinc/27/25/26/1303272526.db2.gz XZWCMJAOIWXEON-CHWSQXEVSA-N 1 3 329.847 2.853 10 0 EFAEHO C[NH+]1CCC(N2CC[C@H](Nc3nc(Cl)nc4ccccc43)C2)CC1 ZINC000865535458 1303299606 /nfs/dbraw/zinc/29/96/06/1303299606.db2.gz MBRVGSHOATWOCA-ZDUSSCGKSA-N 1 3 345.878 2.864 10 0 EFAEHO C[C@@H](CCc1cncc2ccccc21)NC[C@@H](O)C[NH+]1CCCC1 ZINC000866242184 1303577386 /nfs/dbraw/zinc/57/73/86/1303577386.db2.gz AWKKOSMVNJRONR-QFBILLFUSA-N 1 3 327.472 2.602 10 0 EFAEHO CCC[NH+]1CCC(NC[C@H]2CN(Cc3cccc(C)c3)CCO2)CC1 ZINC000866556112 1303682406 /nfs/dbraw/zinc/68/24/06/1303682406.db2.gz XZCOWMWZWUKUAD-NRFANRHFSA-N 1 3 345.531 2.660 10 0 EFAEHO CCCN1CCC([NH2+]C[C@H]2CN(Cc3cccc(C)c3)CCO2)CC1 ZINC000866556112 1303682411 /nfs/dbraw/zinc/68/24/11/1303682411.db2.gz XZCOWMWZWUKUAD-NRFANRHFSA-N 1 3 345.531 2.660 10 0 EFAEHO C([NH2+]C1CCN([C@@H]2CCOC2)CC1)[C@H]1CCN1C1CCCCCC1 ZINC000866562921 1303689289 /nfs/dbraw/zinc/68/92/89/1303689289.db2.gz WYSQPXXNDOCLGJ-WOJBJXKFSA-N 1 3 335.536 2.626 10 0 EFAEHO CN(CCNC(=O)NC1CCC(C)([NH+](C)C)CC1)Cc1ccccc1 ZINC000868130950 1304144513 /nfs/dbraw/zinc/14/45/13/1304144513.db2.gz WSMYVOVUHFJBJM-UHFFFAOYSA-N 1 3 346.519 2.681 10 0 EFAEHO CC(C)[NH+]1CCC(CCNC(=O)NC[C@@H]2CCN2C(C)(C)C)CC1 ZINC000868757842 1304458312 /nfs/dbraw/zinc/45/83/12/1304458312.db2.gz FQVCAXYHNPSAFW-KRWDZBQOSA-N 1 3 338.540 2.669 10 0 EFAEHO CC1CCN([C@H](CNC(=O)[C@]23C[C@H]2C[C@H]([NH3+])C3)c2cccs2)CC1 ZINC000870853791 1305629612 /nfs/dbraw/zinc/62/96/12/1305629612.db2.gz CWAPXAZVIKRARW-OLMMMNRUSA-N 1 3 347.528 2.765 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)[C@@H]2CCC[C@@H]([NH+](C)C)C2)CCN1Cc1ccccc1 ZINC001413061667 1314068957 /nfs/dbraw/zinc/06/89/57/1314068957.db2.gz STUYDBJPERYFJS-VBSBHUPXSA-N 1 3 343.515 2.886 10 0 EFAEHO CN(C)CCN(Cc1cccc(Cl)c1)C(=O)CCC12CC(C1)C[NH2+]2 ZINC000870908762 1305674295 /nfs/dbraw/zinc/67/42/95/1305674295.db2.gz XJOILPSXQFMDJE-UHFFFAOYSA-N 1 3 349.906 2.762 10 0 EFAEHO CC(C)(C)[C@]1(C[NH3+])CCN(C(=O)[C@H]2CCCN2Cc2ccccc2)C1 ZINC000870991644 1305733217 /nfs/dbraw/zinc/73/32/17/1305733217.db2.gz HHBUXEKSUJRACM-NQIIRXRSSA-N 1 3 343.515 2.875 10 0 EFAEHO CN1CCN(C(=O)c2ccc(C[NH+]3CCCC3)cc2)CCC1(C)C ZINC000871152342 1305840560 /nfs/dbraw/zinc/84/05/60/1305840560.db2.gz CEOHRFNGWJLUEV-UHFFFAOYSA-N 1 3 329.488 2.839 10 0 EFAEHO CC(C)CC[NH2+]C[C@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001276655343 1314196084 /nfs/dbraw/zinc/19/60/84/1314196084.db2.gz AKUPPYCMTKERHI-LPHOPBHVSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)CC[NH2+]C[C@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001276655344 1314196160 /nfs/dbraw/zinc/19/61/60/1314196160.db2.gz AKUPPYCMTKERHI-QFBILLFUSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)[NH+]1CCC(NC(=O)c2ccc(NC3=NCCC3)cc2)CC1 ZINC000900001958 1307587069 /nfs/dbraw/zinc/58/70/69/1307587069.db2.gz KEXKUWDIXKNTFM-UHFFFAOYSA-N 1 3 328.460 2.893 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+]CC1=CCCCC1)C1CC1)CC(C)(C)C ZINC001276656696 1314198232 /nfs/dbraw/zinc/19/82/32/1314198232.db2.gz RLAGATXLTJYSER-GOSISDBHSA-N 1 3 335.536 2.949 10 0 EFAEHO COCc1ccc(CN2CCC(O)(C[NH+]3CCCCC3)CC2)cc1 ZINC001413090779 1307732248 /nfs/dbraw/zinc/73/22/48/1307732248.db2.gz PVWOONAOZIFFBA-UHFFFAOYSA-N 1 3 332.488 2.646 10 0 EFAEHO O=C(N[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(NC2=NCCC2)cc1 ZINC000900239675 1307809126 /nfs/dbraw/zinc/80/91/26/1307809126.db2.gz DVMOINCTWHDXQE-DLBZAZTESA-N 1 3 326.444 2.647 10 0 EFAEHO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(NC2=NCCC2)cc1 ZINC000900239675 1307809129 /nfs/dbraw/zinc/80/91/29/1307809129.db2.gz DVMOINCTWHDXQE-DLBZAZTESA-N 1 3 326.444 2.647 10 0 EFAEHO CC[NH+](CC)[C@H]1CCN(C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900884344 1308821962 /nfs/dbraw/zinc/82/19/62/1308821962.db2.gz AGROAQUSUJTOGR-KRWDZBQOSA-N 1 3 328.460 2.847 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@@H](CNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000901022231 1309215479 /nfs/dbraw/zinc/21/54/79/1309215479.db2.gz GNJUPGRXDPSEDV-INIZCTEOSA-N 1 3 342.487 2.999 10 0 EFAEHO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000901022231 1309215488 /nfs/dbraw/zinc/21/54/88/1309215488.db2.gz GNJUPGRXDPSEDV-INIZCTEOSA-N 1 3 342.487 2.999 10 0 EFAEHO C[N@@H+]1CCC[C@H]2CN(C(=O)c3ccc(NC4=NCCC4)cc3)CC[C@@H]21 ZINC000901104675 1309472917 /nfs/dbraw/zinc/47/29/17/1309472917.db2.gz PJFHUMZHUBHZSI-WMZOPIPTSA-N 1 3 340.471 2.847 10 0 EFAEHO C[N@H+]1CCC[C@H]2CN(C(=O)c3ccc(NC4=NCCC4)cc3)CC[C@@H]21 ZINC000901104675 1309472920 /nfs/dbraw/zinc/47/29/20/1309472920.db2.gz PJFHUMZHUBHZSI-WMZOPIPTSA-N 1 3 340.471 2.847 10 0 EFAEHO CN(CC(=O)NC1CCC([NH2+]Cc2ccsc2)CC1)C1CCC1 ZINC001491352794 1311186805 /nfs/dbraw/zinc/18/68/05/1311186805.db2.gz ZBIPLSLJPFXBHI-UHFFFAOYSA-N 1 3 335.517 2.749 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC1CCC([NH2+]CCC(F)(F)F)CC1 ZINC001491353429 1311187179 /nfs/dbraw/zinc/18/71/79/1311187179.db2.gz ZHXAXILDSNDCQZ-YMAMQOFZSA-N 1 3 349.441 2.829 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@H]2C[C@H](C[NH2+]C/C=C\c3ccccc3)C2)C1 ZINC001277046223 1311527408 /nfs/dbraw/zinc/52/74/08/1311527408.db2.gz KHGJJZGRWHMRFT-WYODICHXSA-N 1 3 341.499 2.526 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@H]2C[C@H](C[NH2+]C/C=C\c3ccccc3)C2)C1 ZINC001277046221 1311527685 /nfs/dbraw/zinc/52/76/85/1311527685.db2.gz KHGJJZGRWHMRFT-RUWSKYLJSA-N 1 3 341.499 2.526 10 0 EFAEHO C[C@H](CCC[NH2+]C/C=C\Cl)NC(=O)C(C)(C)N1CCCCC1 ZINC001277186213 1311771333 /nfs/dbraw/zinc/77/13/33/1311771333.db2.gz DESNXQMUNPFQJB-WKTRQSJXSA-N 1 3 329.916 2.878 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC1([NH2+]CC2=CCCCC2)CC1 ZINC001277188864 1311776752 /nfs/dbraw/zinc/77/67/52/1311776752.db2.gz CWULJHOSVWAJRC-SFHVURJKSA-N 1 3 333.520 2.988 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CCCc2ccsc2)CC1 ZINC001277258815 1311884198 /nfs/dbraw/zinc/88/41/98/1311884198.db2.gz BNOAUSSOXFDJJW-HOTGVXAUSA-N 1 3 349.544 2.792 10 0 EFAEHO O[C@@H](C[NH2+][C@@H](CCc1ccccc1)c1cccnc1)CN1CCCC1 ZINC000902762231 1312085069 /nfs/dbraw/zinc/08/50/69/1312085069.db2.gz JCOXNPZQABIIFQ-SFTDATJTSA-N 1 3 339.483 2.802 10 0 EFAEHO CCCn1cc([C@H](C)NCC2CCN(c3cc[nH+]cc3)CC2)nn1 ZINC000902850054 1312154748 /nfs/dbraw/zinc/15/47/48/1312154748.db2.gz HPUGRASBBCARHQ-HNNXBMFYSA-N 1 3 328.464 2.650 10 0 EFAEHO c1cc(CN2CCC(C[NH2+][C@@H]3CC[C@@H]4[C@H]5OCC[C@H]5[C@@H]43)CC2)ccn1 ZINC000903050095 1312310412 /nfs/dbraw/zinc/31/04/12/1312310412.db2.gz PZCJWMOCSGHXRL-WRTQPQOASA-N 1 3 341.499 2.697 10 0 EFAEHO CN1CCC([NH2+][C@@H]2CN(Cc3ccccc3)C[C@H]2C(F)(F)F)CC1 ZINC000903269557 1312525654 /nfs/dbraw/zinc/52/56/54/1312525654.db2.gz AXECGUAYYXRINF-IAGOWNOFSA-N 1 3 341.421 2.733 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@@H]2C(CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001276699265 1314510534 /nfs/dbraw/zinc/51/05/34/1314510534.db2.gz CDBXZCPWLKLLJA-WAFMPYPUSA-N 1 3 333.520 2.511 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@@H]2C(CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001276699265 1314510539 /nfs/dbraw/zinc/51/05/39/1314510539.db2.gz CDBXZCPWLKLLJA-WAFMPYPUSA-N 1 3 333.520 2.511 10 0 EFAEHO CCCC[NH2+][C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C[C@H]1CC ZINC001276751316 1315033623 /nfs/dbraw/zinc/03/36/23/1315033623.db2.gz PBPBYAZFNSZBNL-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H](C[NH2+]CC=C(Cl)Cl)C2)CCC1 ZINC001278565941 1315206002 /nfs/dbraw/zinc/20/60/02/1315206002.db2.gz RRWPZYWEWTZEFV-STQMWFEESA-N 1 3 348.318 2.664 10 0 EFAEHO CC1(C)CN(C(=O)Cc2c[nH]cn2)C[C@H]1[NH2+]CCCCC(F)(F)F ZINC001278672163 1315468600 /nfs/dbraw/zinc/46/86/00/1315468600.db2.gz GFXWSWXRWLRSOP-CYBMUJFWSA-N 1 3 346.397 2.511 10 0 EFAEHO CC[N@H+](CCCNC(=O)N(C)[C@H]1CCCN(C)C1)C1CCCCC1 ZINC001252696613 1315488678 /nfs/dbraw/zinc/48/86/78/1315488678.db2.gz QCDCIWAAYBQHOP-SFHVURJKSA-N 1 3 338.540 2.767 10 0 EFAEHO CC[N@@H+](CCCNC(=O)N(C)[C@H]1CCCN(C)C1)C1CCCCC1 ZINC001252696613 1315488682 /nfs/dbraw/zinc/48/86/82/1315488682.db2.gz QCDCIWAAYBQHOP-SFHVURJKSA-N 1 3 338.540 2.767 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C[NH2+]CCCC1CCC1)C(C)(C)C ZINC001279027789 1316079179 /nfs/dbraw/zinc/07/91/79/1316079179.db2.gz HRTIFARJQAOWFD-KRWDZBQOSA-N 1 3 334.508 2.961 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([C@H](C)[NH2+]CCCc2ccccc2)C1 ZINC001279047605 1316094035 /nfs/dbraw/zinc/09/40/35/1316094035.db2.gz XHXLVAKDIXMHOL-ICSRJNTNSA-N 1 3 345.531 2.786 10 0 EFAEHO CCCCC[NH2+][C@H]1C[C@@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001263843825 1316568721 /nfs/dbraw/zinc/56/87/21/1316568721.db2.gz LCIWMHOCCKOQEE-JTDSTZFVSA-N 1 3 341.515 2.874 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2C[C@H]([NH2+]CCC3=CCCCC3)C2)CCC1 ZINC001263864556 1316570270 /nfs/dbraw/zinc/57/02/70/1316570270.db2.gz YHENGYCFEKIZOJ-IYARVYRRSA-N 1 3 333.520 2.846 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)[C@@H](C(C)C)N(C)C)C[C@@H]2C1 ZINC001264096353 1316588877 /nfs/dbraw/zinc/58/88/77/1316588877.db2.gz KDLYLFPAMRFRHB-HOHRJFBBSA-N 1 3 335.536 2.709 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)[C@@H](C(C)C)N(C)C)C[C@@H]2C1 ZINC001264096353 1316588879 /nfs/dbraw/zinc/58/88/79/1316588879.db2.gz KDLYLFPAMRFRHB-HOHRJFBBSA-N 1 3 335.536 2.709 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C[C@H]1C)CC[NH+](CC=C(C)C)CC2 ZINC001264496910 1316620876 /nfs/dbraw/zinc/62/08/76/1316620876.db2.gz FTPZPFOCCVBSMJ-GOSISDBHSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[NH2+]CC[C@@H]1[C@H](C)CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001264521305 1316628449 /nfs/dbraw/zinc/62/84/49/1316628449.db2.gz XVEZXNLTXDPBJK-VQIMIIECSA-N 1 3 331.504 2.989 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C)[C@H](C)c1ccc(F)c(F)c1)N(C)C ZINC001265000929 1316685373 /nfs/dbraw/zinc/68/53/73/1316685373.db2.gz IRIXNTZFAZDHEC-CXAGYDPISA-N 1 3 341.446 2.804 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C)[C@H](C)c1ccc(F)c(F)c1)N(C)C ZINC001265000929 1316685375 /nfs/dbraw/zinc/68/53/75/1316685375.db2.gz IRIXNTZFAZDHEC-CXAGYDPISA-N 1 3 341.446 2.804 10 0 EFAEHO Cc1cc(CN(C)CCCNC(=O)C23CCC[NH+](CCC2)C3)cs1 ZINC001265000993 1316685586 /nfs/dbraw/zinc/68/55/86/1316685586.db2.gz KNNVPDRNWOHJQA-UHFFFAOYSA-N 1 3 349.544 2.871 10 0 EFAEHO CCc1ccccc1C[N@H+](C)CCCNC(=O)CN1CC[C@@H](C)C1 ZINC001265036989 1316697193 /nfs/dbraw/zinc/69/71/93/1316697193.db2.gz OJPAPAMVWBILHL-QGZVFWFLSA-N 1 3 331.504 2.529 10 0 EFAEHO CCc1ccccc1C[N@@H+](C)CCCNC(=O)CN1CC[C@@H](C)C1 ZINC001265036989 1316697197 /nfs/dbraw/zinc/69/71/97/1316697197.db2.gz OJPAPAMVWBILHL-QGZVFWFLSA-N 1 3 331.504 2.529 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](CC)[C@@H]1CCc2ccc(F)cc21)N(C)C ZINC001265143087 1316736362 /nfs/dbraw/zinc/73/63/62/1316736362.db2.gz WUDSUNDWOYJWLQ-RTBURBONSA-N 1 3 349.494 2.981 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](CC)[C@@H]1CCc2ccc(F)cc21)N(C)C ZINC001265143087 1316736365 /nfs/dbraw/zinc/73/63/65/1316736365.db2.gz WUDSUNDWOYJWLQ-RTBURBONSA-N 1 3 349.494 2.981 10 0 EFAEHO O=C(N[C@H]1CCCN(CCCCCF)C1)C12CCC[NH+](CCC1)C2 ZINC001265215957 1316755304 /nfs/dbraw/zinc/75/53/04/1316755304.db2.gz FJZGFOLRKQUWIA-KRWDZBQOSA-N 1 3 339.499 2.583 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N[C@H]1CCCN(CCCCCF)C1 ZINC001265218992 1316756355 /nfs/dbraw/zinc/75/63/55/1316756355.db2.gz QGZOSXGMSYBHGQ-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N[C@H]1CCCN(CCCCCF)C1 ZINC001265218992 1316756357 /nfs/dbraw/zinc/75/63/57/1316756357.db2.gz QGZOSXGMSYBHGQ-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@@H]1CC12CCN(CCC(F)(F)F)CC2 ZINC001265334117 1316784836 /nfs/dbraw/zinc/78/48/36/1316784836.db2.gz KFJLMCOWCUHSDL-CQSZACIVSA-N 1 3 349.441 2.641 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2CCC[N@H+](CC3=CCCCC3)C2)CCC1 ZINC001265583863 1316828691 /nfs/dbraw/zinc/82/86/91/1316828691.db2.gz AISRQKOCKANNLB-SFHVURJKSA-N 1 3 333.520 2.799 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2CCC[N@@H+](CC3=CCCCC3)C2)CCC1 ZINC001265583863 1316828696 /nfs/dbraw/zinc/82/86/96/1316828696.db2.gz AISRQKOCKANNLB-SFHVURJKSA-N 1 3 333.520 2.799 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H](C[NH2+]CCCC(C)(C)C)C2)C1 ZINC001265623786 1316837316 /nfs/dbraw/zinc/83/73/16/1316837316.db2.gz DTUWOTAYRFNFPZ-ROUUACIJSA-N 1 3 337.552 2.983 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@@H]1C[NH2+]CCc1cccs1)N(C)C ZINC001265682621 1316853018 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CC[C@H](C(=O)NCCC[N@@H+](C)Cc1c(C)cc(C)cc1C)N(C)C ZINC001265954762 1316927471 /nfs/dbraw/zinc/92/74/71/1316927471.db2.gz VOOOROQLBIATFB-LJQANCHMSA-N 1 3 333.520 2.890 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](C)Cc1ccc(CF)cc1 ZINC001265978361 1316935640 /nfs/dbraw/zinc/93/56/40/1316935640.db2.gz KPOCXTJAXVBWMG-IBGZPJMESA-N 1 3 349.494 2.969 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](C)Cc1ccc(CF)cc1 ZINC001265978361 1316935642 /nfs/dbraw/zinc/93/56/42/1316935642.db2.gz KPOCXTJAXVBWMG-IBGZPJMESA-N 1 3 349.494 2.969 10 0 EFAEHO CN(CC(=O)N1CC[C@H](C[NH2+]CC2=CCCCC2)C1)CC(C)(C)C ZINC001266016146 1316954291 /nfs/dbraw/zinc/95/42/91/1316954291.db2.gz STDUASPOXYWACW-GOSISDBHSA-N 1 3 335.536 2.903 10 0 EFAEHO CC[N@H+](CCCNC(=O)C1(N(C)C)CCC1)Cc1csc(C)c1 ZINC001266049591 1316975665 /nfs/dbraw/zinc/97/56/65/1316975665.db2.gz XUMKFPVTDYGDRW-UHFFFAOYSA-N 1 3 337.533 2.869 10 0 EFAEHO CC[N@@H+](CCCNC(=O)C1(N(C)C)CCC1)Cc1csc(C)c1 ZINC001266049591 1316975671 /nfs/dbraw/zinc/97/56/71/1316975671.db2.gz XUMKFPVTDYGDRW-UHFFFAOYSA-N 1 3 337.533 2.869 10 0 EFAEHO CC[N@H+](CCCNC(=O)C1(N(C)C)CCC1)Cc1cc(F)ccc1C ZINC001266049179 1316976550 /nfs/dbraw/zinc/97/65/50/1316976550.db2.gz KSUBHVRZPKBLMC-UHFFFAOYSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[N@@H+](CCCNC(=O)C1(N(C)C)CCC1)Cc1cc(F)ccc1C ZINC001266049179 1316976558 /nfs/dbraw/zinc/97/65/58/1316976558.db2.gz KSUBHVRZPKBLMC-UHFFFAOYSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[N@H+](CCCNC(=O)Cc1nc[nH]c1C)Cc1ccc(C)cc1 ZINC001266105651 1317042604 /nfs/dbraw/zinc/04/26/04/1317042604.db2.gz BFLQRWDNWPQONJ-UHFFFAOYSA-N 1 3 328.460 2.597 10 0 EFAEHO CC[N@@H+](CCCNC(=O)Cc1nc[nH]c1C)Cc1ccc(C)cc1 ZINC001266105651 1317042609 /nfs/dbraw/zinc/04/26/09/1317042609.db2.gz BFLQRWDNWPQONJ-UHFFFAOYSA-N 1 3 328.460 2.597 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@](C)(CNCC=C(Cl)Cl)C2CC2)CC1 ZINC001318714120 1328676051 /nfs/dbraw/zinc/67/60/51/1328676051.db2.gz QALGNBWEEVZMKZ-OAHLLOKOSA-N 1 3 348.318 2.522 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCCN(CCC(F)(F)F)C2CC2)CC[N@@H+]1C ZINC001266153184 1317104445 /nfs/dbraw/zinc/10/44/45/1317104445.db2.gz ACBKRFUIZPIBGK-KBPBESRZSA-N 1 3 349.441 2.640 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCCN(CCC(F)(F)F)C2CC2)CC[N@H+]1C ZINC001266153184 1317104450 /nfs/dbraw/zinc/10/44/50/1317104450.db2.gz ACBKRFUIZPIBGK-KBPBESRZSA-N 1 3 349.441 2.640 10 0 EFAEHO CCC[NH2+]CCN(Cc1ccccc1)C(=O)[C@@H]1CCCCN1CC ZINC001279327606 1317236937 /nfs/dbraw/zinc/23/69/37/1317236937.db2.gz KOLNLKJTGLXAAS-IBGZPJMESA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@H+](CCC2=CCCCC2)CC1 ZINC001279696378 1317364863 /nfs/dbraw/zinc/36/48/63/1317364863.db2.gz XASMYDLQAZKHSR-UHFFFAOYSA-N 1 3 333.520 2.965 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@@H+](CCC2=CCCCC2)CC1 ZINC001279696378 1317364872 /nfs/dbraw/zinc/36/48/72/1317364872.db2.gz XASMYDLQAZKHSR-UHFFFAOYSA-N 1 3 333.520 2.965 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)[C@H]3CCCN3C)C2)cc1C ZINC001279999378 1317433418 /nfs/dbraw/zinc/43/34/18/1317433418.db2.gz JSONPDDCGWOKLM-AZUAARDMSA-N 1 3 343.515 2.726 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]C/C=C\c2ccccc2)C1 ZINC001280152123 1317465089 /nfs/dbraw/zinc/46/50/89/1317465089.db2.gz KMDFBKLFVSPJST-DIRAFQIWSA-N 1 3 341.499 2.622 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CC[C@H](CC[NH2+]Cc2cccc(Cl)c2)C1 ZINC001280207282 1317476623 /nfs/dbraw/zinc/47/66/23/1317476623.db2.gz IEHOPTGYTLTKNB-AWEZNQCLSA-N 1 3 346.862 2.634 10 0 EFAEHO CN(C[C@@H]1CCN1C[C@H]1CCC(F)(F)C1)C(=O)CCCC[NH+](C)C ZINC001316602569 1317498228 /nfs/dbraw/zinc/49/82/28/1317498228.db2.gz ANDTXBPMFPHZCA-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001280309253 1317504140 /nfs/dbraw/zinc/50/41/40/1317504140.db2.gz ZXYSSYYXRHUGOQ-LJQANCHMSA-N 1 3 345.531 2.917 10 0 EFAEHO CCC/C=C/CCN1CC[C@H]1CN(C)C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001316606226 1317803477 /nfs/dbraw/zinc/80/34/77/1317803477.db2.gz NFSIJSDJZXPFRF-AMIRNFFCSA-N 1 3 335.536 2.996 10 0 EFAEHO CCC/C=C/CCN1CC[C@H]1CN(C)C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001316606226 1317803488 /nfs/dbraw/zinc/80/34/88/1317803488.db2.gz NFSIJSDJZXPFRF-AMIRNFFCSA-N 1 3 335.536 2.996 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001281088440 1318010661 /nfs/dbraw/zinc/01/06/61/1318010661.db2.gz RTRJOQLQKLNWBV-RTLBZRNLSA-N 1 3 330.476 2.623 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001281088440 1318010666 /nfs/dbraw/zinc/01/06/66/1318010666.db2.gz RTRJOQLQKLNWBV-RTLBZRNLSA-N 1 3 330.476 2.623 10 0 EFAEHO O=C(CN1CCCC1)N1CCC(CC[NH2+]CCc2cccs2)CC1 ZINC001318931360 1328744523 /nfs/dbraw/zinc/74/45/23/1328744523.db2.gz OKDQEVGDNXHHOC-UHFFFAOYSA-N 1 3 349.544 2.605 10 0 EFAEHO C[C@@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@@H]1[NH2+]CCCCC(F)(F)F ZINC001281409023 1318274753 /nfs/dbraw/zinc/27/47/53/1318274753.db2.gz SAEPOEPHGGSKIW-KGLIPLIRSA-N 1 3 349.441 2.640 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1CCCCCF ZINC001281666370 1318532111 /nfs/dbraw/zinc/53/21/11/1318532111.db2.gz XKFKVRPBLIBKOE-JKSUJKDBSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@H+]1CCCCCF ZINC001281666370 1318532114 /nfs/dbraw/zinc/53/21/14/1318532114.db2.gz XKFKVRPBLIBKOE-JKSUJKDBSA-N 1 3 327.488 2.580 10 0 EFAEHO Cc1cccc(CCC[NH2+]C[C@H]2CCCN2C(=O)[C@H]2CCCN2C)c1 ZINC001319057886 1328771996 /nfs/dbraw/zinc/77/19/96/1328771996.db2.gz NVSQMJGZANYSJI-WOJBJXKFSA-N 1 3 343.515 2.602 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H](C)[NH2+]CCCc1cccc(F)c1 ZINC001282139277 1318746947 /nfs/dbraw/zinc/74/69/47/1318746947.db2.gz BCXPWEHDYHUYQJ-HZPDHXFCSA-N 1 3 349.494 2.725 10 0 EFAEHO CC(C)=CC[N@H+]1C[C@@H]2CC[C@@H](NC(=O)C3(N(C)C)CCC3)C[C@@H]2C1 ZINC001282947256 1319214163 /nfs/dbraw/zinc/21/41/63/1319214163.db2.gz JYVSQDBBYIYAAJ-RCCFBDPRSA-N 1 3 333.520 2.654 10 0 EFAEHO CC(C)=CC[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)C3(N(C)C)CCC3)C[C@@H]2C1 ZINC001282947256 1319214170 /nfs/dbraw/zinc/21/41/70/1319214170.db2.gz JYVSQDBBYIYAAJ-RCCFBDPRSA-N 1 3 333.520 2.654 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCCCCF ZINC001283681135 1319954064 /nfs/dbraw/zinc/95/40/64/1319954064.db2.gz WIOMNDPFOYZQRJ-MAUKXSAKSA-N 1 3 347.494 2.775 10 0 EFAEHO C[C@H]1[C@H](NCC=C(Cl)Cl)CCN1C(=O)CCCC[NH+](C)C ZINC001283925094 1320096257 /nfs/dbraw/zinc/09/62/57/1320096257.db2.gz BTINUYNGXHHDGF-QWHCGFSZSA-N 1 3 336.307 2.616 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[C@@H](C[NH2+]CC=C(Cl)Cl)C1 ZINC001284241940 1320282361 /nfs/dbraw/zinc/28/23/61/1320282361.db2.gz LULCATUVYSXUBL-OLZOCXBDSA-N 1 3 336.307 2.522 10 0 EFAEHO CC[C@@H](F)CN1CCC([C@H](C)NC(=O)[C@H](C(C)C)[NH+](C)C)CC1 ZINC001403982577 1365132039 /nfs/dbraw/zinc/13/20/39/1365132039.db2.gz GIUDRQFDPAPCAE-UAGQMJEPSA-N 1 3 329.504 2.537 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C[NH2+]CCc1ccccc1)C(C)(C)C)N(C)C ZINC001284642093 1320453947 /nfs/dbraw/zinc/45/39/47/1320453947.db2.gz CSFGSLJOOBHERK-MOPGFXCFSA-N 1 3 347.547 2.936 10 0 EFAEHO CC/C=C/CC[NH+]1CCC([C@@H](C)NC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001284699938 1320481529 /nfs/dbraw/zinc/48/15/29/1320481529.db2.gz LXVKRTLOVNEXEQ-PJHKVULZSA-N 1 3 335.536 2.901 10 0 EFAEHO Cc1cccc(CCC[NH2+]C[C@H](C)N(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001319473500 1328896632 /nfs/dbraw/zinc/89/66/32/1328896632.db2.gz UBFKNNAUWDCOTQ-SFHVURJKSA-N 1 3 345.531 2.848 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]CCc1cccs1 ZINC001319593626 1328923792 /nfs/dbraw/zinc/92/37/92/1328923792.db2.gz OWAACXJEMQCHFV-DOTOQJQBSA-N 1 3 337.533 2.602 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@@H]1CC[NH2+]Cc1cccnc1C)N(C)C ZINC001319766987 1328981692 /nfs/dbraw/zinc/98/16/92/1328981692.db2.gz OCZAMTPSLPJQFJ-RTBURBONSA-N 1 3 346.519 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC001404338642 1365460628 /nfs/dbraw/zinc/46/06/28/1365460628.db2.gz ZMDKUDFGVOMHLT-AWEZNQCLSA-N 1 3 325.884 2.789 10 0 EFAEHO O=C(Nc1cnn(-c2cc[nH+]cc2)c1)c1ccc(CN2CCCC2)o1 ZINC001292751184 1322114642 /nfs/dbraw/zinc/11/46/42/1322114642.db2.gz QKBMTOLKPOYVOJ-UHFFFAOYSA-N 1 3 337.383 2.708 10 0 EFAEHO CCCC[NH2+]C[C@@H]1[C@H](C)CCCN1C(=O)CN(C)CC(C)(C)C ZINC001319862287 1329019138 /nfs/dbraw/zinc/01/91/38/1329019138.db2.gz UYTQVSZGZCHSMC-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)[C@H]2CCCC[N@@H+]2C(C)C)c1 ZINC001491600741 1323739619 /nfs/dbraw/zinc/73/96/19/1323739619.db2.gz GZGSNWHHPNMJCF-QFBILLFUSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)[C@H]2CCCC[N@H+]2C(C)C)c1 ZINC001491600741 1323739627 /nfs/dbraw/zinc/73/96/27/1323739627.db2.gz GZGSNWHHPNMJCF-QFBILLFUSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@@H](CNC(=O)c1cccc(CN(C)C)c1)[NH2+]Cc1ccsc1 ZINC001491681026 1323785752 /nfs/dbraw/zinc/78/57/52/1323785752.db2.gz AZZFEHIOSBGJOY-AWEZNQCLSA-N 1 3 331.485 2.718 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]Cc2ccc(Cl)cc2)C1 ZINC001491859771 1323949067 /nfs/dbraw/zinc/94/90/67/1323949067.db2.gz YPQUAJQWBNRCPI-INIZCTEOSA-N 1 3 337.895 2.618 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2CCC[C@@H]([NH2+]CCCF)C2)c1 ZINC001491897663 1324007161 /nfs/dbraw/zinc/00/71/61/1324007161.db2.gz ZEZQMOIFHCVLDR-MSOLQXFVSA-N 1 3 335.467 2.738 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CCNC/C(Cl)=C\Cl ZINC001320416401 1329127145 /nfs/dbraw/zinc/12/71/45/1329127145.db2.gz TXVDQMGIKDQKOX-IPUYDCKKSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CCNC/C(Cl)=C\Cl ZINC001320416401 1329127148 /nfs/dbraw/zinc/12/71/48/1329127148.db2.gz TXVDQMGIKDQKOX-IPUYDCKKSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NCC[C@@H](C)NC/C(Cl)=C\Cl ZINC001492022646 1324133886 /nfs/dbraw/zinc/13/38/86/1324133886.db2.gz VKXCQDSHDQXMIJ-IPUYDCKKSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NCC[C@@H](C)NC/C(Cl)=C\Cl ZINC001492022646 1324133891 /nfs/dbraw/zinc/13/38/91/1324133891.db2.gz VKXCQDSHDQXMIJ-IPUYDCKKSA-N 1 3 336.307 2.663 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N(C)CCNC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001492257315 1324382481 /nfs/dbraw/zinc/38/24/81/1324382481.db2.gz NOYPIRWYBRCFKA-KDOFPFPSSA-N 1 3 349.906 2.791 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001320553600 1329161530 /nfs/dbraw/zinc/16/15/30/1329161530.db2.gz UZEGSGORQLEXST-PBHICJAKSA-N 1 3 339.911 2.973 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)CC[NH2+]CCC(F)(F)F ZINC001320564796 1329166206 /nfs/dbraw/zinc/16/62/06/1329166206.db2.gz UMNQKTWOVTVHCZ-KGLIPLIRSA-N 1 3 337.430 2.686 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C ZINC001316846523 1324685913 /nfs/dbraw/zinc/68/59/13/1324685913.db2.gz IZTDTGDWRCSFKB-GOSISDBHSA-N 1 3 337.483 2.658 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C ZINC001316846523 1324685919 /nfs/dbraw/zinc/68/59/19/1324685919.db2.gz IZTDTGDWRCSFKB-GOSISDBHSA-N 1 3 337.483 2.658 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc2c(c1)CCC2)N(C)C ZINC001320614601 1329178378 /nfs/dbraw/zinc/17/83/78/1329178378.db2.gz NCDKMYRGXNDDSC-OXQOHEQNSA-N 1 3 345.531 2.746 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cc(F)ccc1Cl)N(C)C ZINC001320607028 1329175920 /nfs/dbraw/zinc/17/59/20/1329175920.db2.gz IGLFOHAXPRXHDB-BLLLJJGKSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1cc(F)ccc1Cl)N(C)C ZINC001320607032 1329176044 /nfs/dbraw/zinc/17/60/44/1329176044.db2.gz IGLFOHAXPRXHDB-MLGOLLRUSA-N 1 3 343.874 2.804 10 0 EFAEHO CCC/C=C\CC[NH+]1CCC(N(C)C(=O)CN2CC[C@H](C)C2)CC1 ZINC001316933315 1325381930 /nfs/dbraw/zinc/38/19/30/1325381930.db2.gz IPUQZLFSWDUYQN-MJRGOJFPSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001316987847 1325450935 /nfs/dbraw/zinc/45/09/35/1325450935.db2.gz OAGMMCKJZDWEMP-NTWLCTACSA-N 1 3 339.499 2.746 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001316987847 1325450940 /nfs/dbraw/zinc/45/09/40/1325450940.db2.gz OAGMMCKJZDWEMP-NTWLCTACSA-N 1 3 339.499 2.746 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[N@H+](C)CC2=CCCCC2)C1 ZINC001317038156 1325505509 /nfs/dbraw/zinc/50/55/09/1325505509.db2.gz BAVQOOZCEOUBTR-LJQANCHMSA-N 1 3 335.536 2.999 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[N@@H+](C)CC2=CCCCC2)C1 ZINC001317038156 1325505515 /nfs/dbraw/zinc/50/55/15/1325505515.db2.gz BAVQOOZCEOUBTR-LJQANCHMSA-N 1 3 335.536 2.999 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H]([NH2+]CC/C=C\c3ccccc3)C2)C1 ZINC001317062649 1325534313 /nfs/dbraw/zinc/53/43/13/1325534313.db2.gz OECDQTVPGROBFJ-VRBJBPJOSA-N 1 3 341.499 2.622 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@@H]1CCC[N@@H+]1CC(C)C ZINC001320777268 1329300773 /nfs/dbraw/zinc/30/07/73/1329300773.db2.gz JNKUGUVGXTXFDC-KRWDZBQOSA-N 1 3 337.533 2.807 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@@H]1CCC[N@H+]1CC(C)C ZINC001320777268 1329300775 /nfs/dbraw/zinc/30/07/75/1329300775.db2.gz JNKUGUVGXTXFDC-KRWDZBQOSA-N 1 3 337.533 2.807 10 0 EFAEHO CCN(CC[NH2+]CC=C(C)C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001320840441 1329308634 /nfs/dbraw/zinc/30/86/34/1329308634.db2.gz IXMGVXSKCLBFSG-SFHVURJKSA-N 1 3 327.488 2.603 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)c(F)c1)C(=O)CN1CCC(C)CC1 ZINC001320876040 1329313161 /nfs/dbraw/zinc/31/31/61/1329313161.db2.gz KDKBCXXTJIURBD-UHFFFAOYSA-N 1 3 349.494 2.804 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C\CNC(=O)[C@H]1CCC[N@H+]1C(C)C ZINC001321056260 1329337389 /nfs/dbraw/zinc/33/73/89/1329337389.db2.gz CZFKMMQRWSWBNX-PHWHVTFISA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C\CNC(=O)[C@H]1CCC[N@@H+]1C(C)C ZINC001321056260 1329337391 /nfs/dbraw/zinc/33/73/91/1329337391.db2.gz CZFKMMQRWSWBNX-PHWHVTFISA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C\CNC(=O)[C@@H]1CCC[N@H+]1C(C)C ZINC001321056259 1329337647 /nfs/dbraw/zinc/33/76/47/1329337647.db2.gz CZFKMMQRWSWBNX-HMECNJMJSA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C\CNC(=O)[C@@H]1CCC[N@@H+]1C(C)C ZINC001321056259 1329337649 /nfs/dbraw/zinc/33/76/49/1329337649.db2.gz CZFKMMQRWSWBNX-HMECNJMJSA-N 1 3 347.478 2.769 10 0 EFAEHO CN(CC(=O)NC/C=C/C[NH2+]Cc1cccc(Cl)c1)C1CCC1 ZINC001321094880 1329342232 /nfs/dbraw/zinc/34/22/32/1329342232.db2.gz DALARYWPQLYHHI-NSCUHMNNSA-N 1 3 335.879 2.586 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C/C=C\CNC(=O)CN(C)C2CCC2)c1 ZINC001321096443 1329342843 /nfs/dbraw/zinc/34/28/43/1329342843.db2.gz PGBBLGZAVTVQIE-PLNGDYQASA-N 1 3 329.488 2.550 10 0 EFAEHO C[C@H](NC/C=C\CNC(=O)C12CCC[NH+]1CCC2)c1cccc(F)c1 ZINC001321142483 1329348566 /nfs/dbraw/zinc/34/85/66/1329348566.db2.gz SYCJOEPGJNPPKI-YPQKKHBXSA-N 1 3 345.462 2.777 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H](C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001317157361 1327652495 /nfs/dbraw/zinc/65/24/95/1327652495.db2.gz IICUETTWHQDUGO-NZONOLPTSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H](C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001317157359 1327653325 /nfs/dbraw/zinc/65/33/25/1327653325.db2.gz IICUETTWHQDUGO-IHEKOVBBSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@H]([NH2+]C/C=C/CNC(=O)CN1CCC(C)CC1)c1cccc(F)c1 ZINC001321301344 1329369963 /nfs/dbraw/zinc/36/99/63/1329369963.db2.gz AHMFQXNVDAGKPK-IDOMTICXSA-N 1 3 347.478 2.881 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C\CNC(=O)CN2CCC(C)CC2)cc1C ZINC001321301548 1329370146 /nfs/dbraw/zinc/37/01/46/1329370146.db2.gz BGAKLVNLCSVTKM-PLNGDYQASA-N 1 3 343.515 2.797 10 0 EFAEHO CCC/C=C\CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)CN(C)CC(C)(C)C ZINC001317214295 1327758448 /nfs/dbraw/zinc/75/84/48/1327758448.db2.gz DHTGZESVJGEGPU-UOUCVQCFSA-N 1 3 335.536 2.757 10 0 EFAEHO CCC/C=C\CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)CN(C)CC(C)(C)C ZINC001317214295 1327758456 /nfs/dbraw/zinc/75/84/56/1327758456.db2.gz DHTGZESVJGEGPU-UOUCVQCFSA-N 1 3 335.536 2.757 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CC[C@H](C[NH2+]CCC2CCCCCC2)C1 ZINC001317340434 1327870582 /nfs/dbraw/zinc/87/05/82/1327870582.db2.gz KYGYBBMNWRIUDE-QGZVFWFLSA-N 1 3 332.492 2.751 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CC[C@@H](C[NH2+]CCC2CCCCCC2)C1 ZINC001317340433 1327870850 /nfs/dbraw/zinc/87/08/50/1327870850.db2.gz KYGYBBMNWRIUDE-KRWDZBQOSA-N 1 3 332.492 2.751 10 0 EFAEHO CC(C)C[NH2+]CCc1ccc(CNC(=O)CN2[C@H](C)CC[C@H]2C)cc1 ZINC001317373440 1327918383 /nfs/dbraw/zinc/91/83/83/1327918383.db2.gz DAEGFWQRAGCKFT-QZTJIDSGSA-N 1 3 345.531 2.964 10 0 EFAEHO CC1CC(C[N@@H+]2CCC[C@H]2CCCNC(=O)C2(N(C)C)CCC2)C1 ZINC001317422218 1327982639 /nfs/dbraw/zinc/98/26/39/1327982639.db2.gz FWQICPXFDXUAPN-DAWZGUTISA-N 1 3 335.536 2.878 10 0 EFAEHO CC1CC(C[N@H+]2CCC[C@H]2CCCNC(=O)C2(N(C)C)CCC2)C1 ZINC001317422218 1327982648 /nfs/dbraw/zinc/98/26/48/1327982648.db2.gz FWQICPXFDXUAPN-DAWZGUTISA-N 1 3 335.536 2.878 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[C@@H]1CCC[N@@H+]1Cc1ccccc1F ZINC001317427158 1327998313 /nfs/dbraw/zinc/99/83/13/1327998313.db2.gz MMDRGOBGSSTJTQ-IEBWSBKVSA-N 1 3 347.478 2.781 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[C@@H]1CCC[N@H+]1Cc1ccccc1F ZINC001317427158 1327998323 /nfs/dbraw/zinc/99/83/23/1327998323.db2.gz MMDRGOBGSSTJTQ-IEBWSBKVSA-N 1 3 347.478 2.781 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NCCC[C@H]2CCC[N@@H+]2CCF)C1 ZINC001317434794 1328020639 /nfs/dbraw/zinc/02/06/39/1328020639.db2.gz LKYVQNXKISMTKZ-MAUKXSAKSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NCCC[C@H]2CCC[N@H+]2CCF)C1 ZINC001317434794 1328020648 /nfs/dbraw/zinc/02/06/48/1328020648.db2.gz LKYVQNXKISMTKZ-MAUKXSAKSA-N 1 3 345.478 2.529 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]CCN(C)C(=O)[C@H](C(C)C)N(C)C ZINC001317598834 1328179014 /nfs/dbraw/zinc/17/90/14/1328179014.db2.gz SAXKZUUUBDKPMH-KRWDZBQOSA-N 1 3 339.911 2.783 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)[C@@H]2CCC[N@H+]2CC(C)C)c1 ZINC001317603031 1328182429 /nfs/dbraw/zinc/18/24/29/1328182429.db2.gz JHWFIXKVBOZJJM-IBGZPJMESA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)[C@@H]2CCC[N@@H+]2CC(C)C)c1 ZINC001317603031 1328182436 /nfs/dbraw/zinc/18/24/36/1328182436.db2.gz JHWFIXKVBOZJJM-IBGZPJMESA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[NH2+]Cc2cccc(C(F)F)c2)C1 ZINC001317625735 1328206554 /nfs/dbraw/zinc/20/65/54/1328206554.db2.gz IISLSIGGAZXKAV-CQSZACIVSA-N 1 3 339.430 2.514 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCNCc1cc2ccccc2o1)[NH+](C)C ZINC001317654220 1328240197 /nfs/dbraw/zinc/24/01/97/1328240197.db2.gz ZAQUYIIODQIKOV-SFHVURJKSA-N 1 3 331.460 2.567 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)c1 ZINC001317669062 1328261790 /nfs/dbraw/zinc/26/17/90/1328261790.db2.gz GOBIWENZXIAHRH-IYBDPMFKSA-N 1 3 335.467 2.555 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)c1 ZINC001317669062 1328261800 /nfs/dbraw/zinc/26/18/00/1328261800.db2.gz GOBIWENZXIAHRH-IYBDPMFKSA-N 1 3 335.467 2.555 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)C[NH+]2[C@@H](C)CC[C@@H]2C)c1 ZINC001317669055 1328261873 /nfs/dbraw/zinc/26/18/73/1328261873.db2.gz GOBIWENZXIAHRH-HOTGVXAUSA-N 1 3 335.467 2.555 10 0 EFAEHO CC(C)=CCN[C@@H](CNC(=O)[C@@H](C(C)C)[NH+](C)C)c1ccccc1 ZINC001317724413 1328333879 /nfs/dbraw/zinc/33/38/79/1328333879.db2.gz LWPBPKRFWAMILM-RBUKOAKNSA-N 1 3 331.504 2.986 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](C[N@H+](C)CCC2=CCCCC2)C1)N(C)C ZINC001317857265 1328421522 /nfs/dbraw/zinc/42/15/22/1328421522.db2.gz PLTOAROUSXYEGB-OALUTQOASA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](C[N@@H+](C)CCC2=CCCCC2)C1)N(C)C ZINC001317857265 1328421527 /nfs/dbraw/zinc/42/15/27/1328421527.db2.gz PLTOAROUSXYEGB-OALUTQOASA-N 1 3 335.536 2.997 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@@H](C[N@H+](C)CCCCCF)C1 ZINC001317861476 1328422907 /nfs/dbraw/zinc/42/29/07/1328422907.db2.gz ASNZBDRQQPMQLQ-ZWKOTPCHSA-N 1 3 341.515 2.781 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@@H](C[N@@H+](C)CCCCCF)C1 ZINC001317861476 1328422915 /nfs/dbraw/zinc/42/29/15/1328422915.db2.gz ASNZBDRQQPMQLQ-ZWKOTPCHSA-N 1 3 341.515 2.781 10 0 EFAEHO CC/C=C\CC[N@H+](C)CC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001317869676 1328429415 /nfs/dbraw/zinc/42/94/15/1328429415.db2.gz GGFRXPMOCFLPKX-SREVYHEPSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](C)CC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001317869676 1328429421 /nfs/dbraw/zinc/42/94/21/1328429421.db2.gz GGFRXPMOCFLPKX-SREVYHEPSA-N 1 3 335.536 2.997 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]CCCN(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001322694802 1329480500 /nfs/dbraw/zinc/48/05/00/1329480500.db2.gz VKYYUCIJGBAXIP-IRXDYDNUSA-N 1 3 347.503 2.536 10 0 EFAEHO CN(CCC[NH2+][C@H]1CCc2c1cccc2Cl)C(=O)CN1CCCC1 ZINC001322838002 1329493039 /nfs/dbraw/zinc/49/30/39/1329493039.db2.gz XCGPHHBCKBEADT-SFHVURJKSA-N 1 3 349.906 2.861 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+]Cc1ccc(Cl)cc1F ZINC001322845907 1329493634 /nfs/dbraw/zinc/49/36/34/1329493634.db2.gz ZUBVDRJTDIXDNN-UHFFFAOYSA-N 1 3 343.874 2.757 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+]C/C=C/c2ccccc2)C2CC2)CCC1 ZINC001323013563 1329504847 /nfs/dbraw/zinc/50/48/47/1329504847.db2.gz CSFDLICBLBHKAN-ZAOIQFLMSA-N 1 3 341.499 2.669 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+]C/C=C\c2ccccc2)C2CC2)CCC1 ZINC001323013561 1329504903 /nfs/dbraw/zinc/50/49/03/1329504903.db2.gz CSFDLICBLBHKAN-SMTIMMHKSA-N 1 3 341.499 2.669 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H](C2CCN(C(=O)[C@H]3CCCN3C)CC2)C1 ZINC001323639437 1329557658 /nfs/dbraw/zinc/55/76/58/1329557658.db2.gz ZVBQFDCNCNKMDU-WEPWYQGCSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H](C2CCN(C(=O)[C@H]3CCCN3C)CC2)C1 ZINC001323639437 1329557661 /nfs/dbraw/zinc/55/76/61/1329557661.db2.gz ZVBQFDCNCNKMDU-WEPWYQGCSA-N 1 3 347.547 2.997 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001323874016 1329582119 /nfs/dbraw/zinc/58/21/19/1329582119.db2.gz QUPXOBOJWIVWAW-ZZHWGSSASA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001323874016 1329582121 /nfs/dbraw/zinc/58/21/21/1329582121.db2.gz QUPXOBOJWIVWAW-ZZHWGSSASA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CCCc2ccccc2)CCN1C(=O)CN1CCCC1 ZINC001324098526 1329600027 /nfs/dbraw/zinc/60/00/27/1329600027.db2.gz RPFPHMPGKKEQOE-UYAOXDASSA-N 1 3 343.515 2.684 10 0 EFAEHO CN(CC(=O)N1CCC[C@H]1C[NH2+]CCCCC(F)(F)F)C1CCC1 ZINC001324175184 1329605572 /nfs/dbraw/zinc/60/55/72/1329605572.db2.gz LPROBZQRANLUCZ-HNNXBMFYSA-N 1 3 349.441 2.784 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001324226766 1329609717 /nfs/dbraw/zinc/60/97/17/1329609717.db2.gz VHKBQDKAJQQCNP-APWZRJJASA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H](NCc1ccccn1)[C@@H](C)NC(=O)C1(C[NH+](C)C)CCCCC1 ZINC001381416517 1348257838 /nfs/dbraw/zinc/25/78/38/1348257838.db2.gz SLFHRDGLSHNACL-IAGOWNOFSA-N 1 3 346.519 2.577 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]C/C=C\c2ccccc2)C1 ZINC001325582817 1329698682 /nfs/dbraw/zinc/69/86/82/1329698682.db2.gz SDPNLAWHOUAEDM-HWJGFJICSA-N 1 3 343.515 2.726 10 0 EFAEHO CC(C)=CC[NH2+]CCN(Cc1ccccc1)C(=O)Cc1c[nH]cn1 ZINC001325702424 1329707485 /nfs/dbraw/zinc/70/74/85/1329707485.db2.gz RRZYZVVJZTVNGK-UHFFFAOYSA-N 1 3 326.444 2.537 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001326223516 1329740136 /nfs/dbraw/zinc/74/01/36/1329740136.db2.gz IGBFAXTVJNWBEI-RBUKOAKNSA-N 1 3 347.547 2.879 10 0 EFAEHO CCc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)[C@H]3CCCN3C)C2)cc1 ZINC001326334457 1329748274 /nfs/dbraw/zinc/74/82/74/1329748274.db2.gz RXVSVUAVEKMQAY-VQTJNVASSA-N 1 3 343.515 2.671 10 0 EFAEHO C[C@@H](F)CC[NH2+]CC[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001326364629 1329750455 /nfs/dbraw/zinc/75/04/55/1329750455.db2.gz LCWQKAGQDJGXTP-HZPDHXFCSA-N 1 3 329.504 2.541 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)CN3CC[C@H](C)C3)C2)cc1 ZINC001326366168 1329750490 /nfs/dbraw/zinc/75/04/90/1329750490.db2.gz ZGHIGUWUOPRPKN-ICSRJNTNSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)CN3CCCC3)C2)cc1C ZINC001326430712 1329756006 /nfs/dbraw/zinc/75/60/06/1329756006.db2.gz LBXWLKUEPGNIBS-IBGZPJMESA-N 1 3 343.515 2.727 10 0 EFAEHO CCc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN3CCCC3)C2)cc1 ZINC001326432160 1329756267 /nfs/dbraw/zinc/75/62/67/1329756267.db2.gz QYXLENHRIRDCKW-HXUWFJFHSA-N 1 3 343.515 2.673 10 0 EFAEHO C[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)[N@H+](C)CC1CC(F)(F)C1 ZINC001381585704 1348380970 /nfs/dbraw/zinc/38/09/70/1348380970.db2.gz FKXUXZNGMLCJGW-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)[N@@H+](C)CC1CC(F)(F)C1 ZINC001381585704 1348380973 /nfs/dbraw/zinc/38/09/73/1348380973.db2.gz FKXUXZNGMLCJGW-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@H](CC[NH2+]C/C=C\Cl)C2)c1 ZINC001326440029 1329756866 /nfs/dbraw/zinc/75/68/66/1329756866.db2.gz YWRDZUDBVGXSST-SGNXQUTQSA-N 1 3 349.906 2.943 10 0 EFAEHO C[C@H](C(=O)NC[C@H](C)[N@H+](C)CC1CC(F)(F)C1)N1CCCCCC1 ZINC001381585708 1348381188 /nfs/dbraw/zinc/38/11/88/1348381188.db2.gz FKXUXZNGMLCJGW-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C(=O)NC[C@H](C)[N@@H+](C)CC1CC(F)(F)C1)N1CCCCCC1 ZINC001381585708 1348381191 /nfs/dbraw/zinc/38/11/91/1348381191.db2.gz FKXUXZNGMLCJGW-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO CC/C=C\CCN1Cc2ccc(CNC(=O)[C@@H]3CC[N@H+](C)C3)cc2C1 ZINC001327694970 1330510015 /nfs/dbraw/zinc/51/00/15/1330510015.db2.gz FCNQUQOSKGSCCF-PHWHVTFISA-N 1 3 341.499 2.926 10 0 EFAEHO CC/C=C\CCN1Cc2ccc(CNC(=O)[C@@H]3CC[N@@H+](C)C3)cc2C1 ZINC001327694970 1330510017 /nfs/dbraw/zinc/51/00/17/1330510017.db2.gz FCNQUQOSKGSCCF-PHWHVTFISA-N 1 3 341.499 2.926 10 0 EFAEHO Cc1ccncc1CN1CC[C@@H](NC(=O)CCCC[NH+](C)C)C[C@@H]1C ZINC001328282271 1330580751 /nfs/dbraw/zinc/58/07/51/1330580751.db2.gz GJYDHYIBAMLIMN-PKOBYXMFSA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1ccncc1CN1CC[C@@H](NC(=O)CCCC[NH+](C)C)C[C@H]1C ZINC001328282269 1330580774 /nfs/dbraw/zinc/58/07/74/1330580774.db2.gz GJYDHYIBAMLIMN-IEBWSBKVSA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H](C)[NH2+]CCCCC(F)(F)F ZINC001329053118 1330661242 /nfs/dbraw/zinc/66/12/42/1330661242.db2.gz HGEXCONNOLNTKZ-CHWSQXEVSA-N 1 3 337.430 2.686 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H](C)[NH2+]CCCc1ccsc1 ZINC001329057421 1330661644 /nfs/dbraw/zinc/66/16/44/1330661644.db2.gz QXTPHIZGOYVSTJ-HUUCEWRRSA-N 1 3 337.533 2.648 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CCC[NH2+]Cc1cccnc1C ZINC001330986883 1330779210 /nfs/dbraw/zinc/77/92/10/1330779210.db2.gz HKXLZAIDHGNFFT-APWZRJJASA-N 1 3 346.519 2.639 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CCC[NH2+]Cc1cccnc1C ZINC001330986886 1330779593 /nfs/dbraw/zinc/77/95/93/1330779593.db2.gz HKXLZAIDHGNFFT-QFBILLFUSA-N 1 3 346.519 2.639 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H](C)CN(C)C(=O)CN1CC[C@@H](C)C1 ZINC001331559043 1330852347 /nfs/dbraw/zinc/85/23/47/1330852347.db2.gz CZRJIUNVNDKIKK-IEBWSBKVSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H](C)CN(C)C(=O)CN1CC[C@@H](C)C1 ZINC001331559044 1330852421 /nfs/dbraw/zinc/85/24/21/1330852421.db2.gz CZRJIUNVNDKIKK-MJGOQNOKSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C[NH2+]CCc1ccc(C)cc1)C(C)(C)C)N(C)C ZINC001332882084 1331034902 /nfs/dbraw/zinc/03/49/02/1331034902.db2.gz QNZYAXUFYQDYAR-RBUKOAKNSA-N 1 3 347.547 2.998 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C[NH2+]CCc1ccc(C)cc1)C(C)(C)C)N(C)C ZINC001332882083 1331035005 /nfs/dbraw/zinc/03/50/05/1331035005.db2.gz QNZYAXUFYQDYAR-OALUTQOASA-N 1 3 347.547 2.998 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N1CC=C(CNC(=O)CC[NH+](C)C)CC1 ZINC001333391092 1331131763 /nfs/dbraw/zinc/13/17/63/1331131763.db2.gz NMFWNJVDWKFZPR-LJQANCHMSA-N 1 3 347.478 2.977 10 0 EFAEHO O=C(OC[C@@H]1CC[N@@H+]1C1CCCCCC1)C1CCCN(C2CC2)C1=O ZINC001345531095 1332546520 /nfs/dbraw/zinc/54/65/20/1332546520.db2.gz NBBJGQFNWQTEGO-ZWKOTPCHSA-N 1 3 348.487 2.728 10 0 EFAEHO O=C(OC[C@@H]1CC[N@H+]1C1CCCCCC1)C1CCCN(C2CC2)C1=O ZINC001345531095 1332546523 /nfs/dbraw/zinc/54/65/23/1332546523.db2.gz NBBJGQFNWQTEGO-ZWKOTPCHSA-N 1 3 348.487 2.728 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCCC[N@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC001479866717 1332662186 /nfs/dbraw/zinc/66/21/86/1332662186.db2.gz RBMGUYSLBKHZBA-SFHVURJKSA-N 1 3 349.906 2.905 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCCC[N@@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC001479866717 1332662192 /nfs/dbraw/zinc/66/21/92/1332662192.db2.gz RBMGUYSLBKHZBA-SFHVURJKSA-N 1 3 349.906 2.905 10 0 EFAEHO C[C@@H](CSCCF)[NH2+]Cc1cccc(CN2CCN(C)CC2)c1 ZINC001346854376 1332697152 /nfs/dbraw/zinc/69/71/52/1332697152.db2.gz CQCHFCVKODXVMZ-INIZCTEOSA-N 1 3 339.524 2.615 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]CCCCC(F)(F)F ZINC001480459921 1334060700 /nfs/dbraw/zinc/06/07/00/1334060700.db2.gz PTCYPSSCRFQPHC-UONOGXRCSA-N 1 3 337.430 2.686 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](C)CNC(=O)[C@@H]1CCCN1C(C)C ZINC001480460948 1334066832 /nfs/dbraw/zinc/06/68/32/1334066832.db2.gz ZHDDERGAZYAOMA-APWZRJJASA-N 1 3 331.504 2.716 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N(C)CCCN(C)CCC(F)(F)F ZINC001407952991 1369454287 /nfs/dbraw/zinc/45/42/87/1369454287.db2.gz BOFOEVGERAQXEK-OKILXGFUSA-N 1 3 337.430 2.592 10 0 EFAEHO O=C(N1CCN(CC2CCCCCC2)CC1)C12CCC[NH+](CCC1)C2 ZINC001472968442 1334776829 /nfs/dbraw/zinc/77/68/29/1334776829.db2.gz PXLXYRYHJKVZBN-UHFFFAOYSA-N 1 3 347.547 2.977 10 0 EFAEHO CCN1CCC[C@H]1CNC(=[NH2+])NCCc1c(C)oc2ccccc21 ZINC000849087594 1335072850 /nfs/dbraw/zinc/07/28/50/1335072850.db2.gz DMVLOWLMXMHESY-HNNXBMFYSA-N 1 3 328.460 2.882 10 0 EFAEHO CC[N@@H+]1CC[C@@H]1CNC(=O)[C@H]1CCCCN1Cc1cccc(C)c1 ZINC001361493506 1336121989 /nfs/dbraw/zinc/12/19/89/1336121989.db2.gz FENMRWWVJFLWFF-RTBURBONSA-N 1 3 329.488 2.560 10 0 EFAEHO CC[N@H+]1CC[C@@H]1CNC(=O)[C@H]1CCCCN1Cc1cccc(C)c1 ZINC001361493506 1336121993 /nfs/dbraw/zinc/12/19/93/1336121993.db2.gz FENMRWWVJFLWFF-RTBURBONSA-N 1 3 329.488 2.560 10 0 EFAEHO CCN1CC[C@@H]1CNC(=O)[C@H]1CCCC[N@@H+]1Cc1cccc(C)c1 ZINC001361493506 1336121997 /nfs/dbraw/zinc/12/19/97/1336121997.db2.gz FENMRWWVJFLWFF-RTBURBONSA-N 1 3 329.488 2.560 10 0 EFAEHO CCN1CC[C@@H]1CNC(=O)[C@H]1CCCC[N@H+]1Cc1cccc(C)c1 ZINC001361493506 1336122000 /nfs/dbraw/zinc/12/20/00/1336122000.db2.gz FENMRWWVJFLWFF-RTBURBONSA-N 1 3 329.488 2.560 10 0 EFAEHO CC[N@@H+]1CC[C@H]1CNC(=O)[C@H]1CCCCN1Cc1cccc(C)c1 ZINC001361493502 1336122033 /nfs/dbraw/zinc/12/20/33/1336122033.db2.gz FENMRWWVJFLWFF-RBUKOAKNSA-N 1 3 329.488 2.560 10 0 EFAEHO CC[N@H+]1CC[C@H]1CNC(=O)[C@H]1CCCCN1Cc1cccc(C)c1 ZINC001361493502 1336122035 /nfs/dbraw/zinc/12/20/35/1336122035.db2.gz FENMRWWVJFLWFF-RBUKOAKNSA-N 1 3 329.488 2.560 10 0 EFAEHO CCN1CC[C@H]1CNC(=O)[C@H]1CCCC[N@@H+]1Cc1cccc(C)c1 ZINC001361493502 1336122036 /nfs/dbraw/zinc/12/20/36/1336122036.db2.gz FENMRWWVJFLWFF-RBUKOAKNSA-N 1 3 329.488 2.560 10 0 EFAEHO CCN1CC[C@H]1CNC(=O)[C@H]1CCCC[N@H+]1Cc1cccc(C)c1 ZINC001361493502 1336122038 /nfs/dbraw/zinc/12/20/38/1336122038.db2.gz FENMRWWVJFLWFF-RBUKOAKNSA-N 1 3 329.488 2.560 10 0 EFAEHO COc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001361610797 1336219537 /nfs/dbraw/zinc/21/95/37/1336219537.db2.gz LBPWAUJHFWXYHI-CVEARBPZSA-N 1 3 333.476 2.816 10 0 EFAEHO O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001361728200 1336299211 /nfs/dbraw/zinc/29/92/11/1336299211.db2.gz QEKLRBDRKXCMCT-VAMGGRTRSA-N 1 3 341.499 2.957 10 0 EFAEHO O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001361728200 1336299215 /nfs/dbraw/zinc/29/92/15/1336299215.db2.gz QEKLRBDRKXCMCT-VAMGGRTRSA-N 1 3 341.499 2.957 10 0 EFAEHO CN(C)CCN(CC1CCCCC1)C(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001361856078 1336377821 /nfs/dbraw/zinc/37/78/21/1336377821.db2.gz MSGSBUDLEKLLPH-RTBURBONSA-N 1 3 335.536 2.974 10 0 EFAEHO CN(C)CCN(CC1CCCCC1)C(=O)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001361856078 1336377824 /nfs/dbraw/zinc/37/78/24/1336377824.db2.gz MSGSBUDLEKLLPH-RTBURBONSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)N(CCN(C)C)c3ccccc3)C[N@@H+]2C1 ZINC001361951553 1336434520 /nfs/dbraw/zinc/43/45/20/1336434520.db2.gz HBSNMUGYHPPUIH-LMMKCTJWSA-N 1 3 329.488 2.702 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)N(CCN(C)C)c3ccccc3)C[N@H+]2C1 ZINC001361951553 1336434522 /nfs/dbraw/zinc/43/45/22/1336434522.db2.gz HBSNMUGYHPPUIH-LMMKCTJWSA-N 1 3 329.488 2.702 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)NC[C@H](C)N(C)Cc2ccccc2)CC1 ZINC001361966690 1336443387 /nfs/dbraw/zinc/44/33/87/1336443387.db2.gz IBZRQTYBOSLNGM-SFHVURJKSA-N 1 3 345.531 2.991 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)NCc2ccccc2CN(C)C)CC1 ZINC001362044574 1336478292 /nfs/dbraw/zinc/47/82/92/1336478292.db2.gz ZFZHPCZCGLIKCP-UHFFFAOYSA-N 1 3 331.504 2.732 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)[C@@H](C)CC[NH+](C)C)N2CCCC2)cc1 ZINC001362089827 1336498101 /nfs/dbraw/zinc/49/81/01/1336498101.db2.gz OXNAHOJGONNFQM-PKOBYXMFSA-N 1 3 331.504 2.836 10 0 EFAEHO CC1CCC(N2CCN(C(=O)C34CCC[NH+](CCC3)C4)CC2)CC1 ZINC001362157712 1336530278 /nfs/dbraw/zinc/53/02/78/1336530278.db2.gz WULYZOZAPPHMMS-UHFFFAOYSA-N 1 3 333.520 2.585 10 0 EFAEHO C[C@@H](C(=O)NC1CCN(C2CC[NH+](C)CC2)CC1)[C@@H](C)C(C)(C)C ZINC001362172607 1336537808 /nfs/dbraw/zinc/53/78/08/1336537808.db2.gz QLIJEELWBUMGHA-HZPDHXFCSA-N 1 3 337.552 2.980 10 0 EFAEHO C[NH+](C)CCc1cccc(C(=O)N2CCN(C3CCCCC3)CC2)c1 ZINC001362269760 1336581699 /nfs/dbraw/zinc/58/16/99/1336581699.db2.gz PBZXBNNSVMCERZ-UHFFFAOYSA-N 1 3 343.515 2.881 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H](C(=O)N(C)CCCN(C)Cc2ccco2)C1 ZINC001363178849 1336819301 /nfs/dbraw/zinc/81/93/01/1336819301.db2.gz JETUSGGGYXSHQU-KRWDZBQOSA-N 1 3 335.492 2.680 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H](C(=O)N(C)CCCN(C)Cc2ccco2)C1 ZINC001363178849 1336819303 /nfs/dbraw/zinc/81/93/03/1336819303.db2.gz JETUSGGGYXSHQU-KRWDZBQOSA-N 1 3 335.492 2.680 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H](C(=O)N(C)CCCN(C)Cc2ccco2)C1 ZINC001363178861 1336819415 /nfs/dbraw/zinc/81/94/15/1336819415.db2.gz JETUSGGGYXSHQU-QGZVFWFLSA-N 1 3 335.492 2.680 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H](C(=O)N(C)CCCN(C)Cc2ccco2)C1 ZINC001363178861 1336819419 /nfs/dbraw/zinc/81/94/19/1336819419.db2.gz JETUSGGGYXSHQU-QGZVFWFLSA-N 1 3 335.492 2.680 10 0 EFAEHO C[NH+]1CCC(NC(=O)CN[C@H](c2ccc(Cl)cc2)C2CC2)CC1 ZINC001363224109 1336842423 /nfs/dbraw/zinc/84/24/23/1336842423.db2.gz APIXKTZYRBRTMZ-SFHVURJKSA-N 1 3 335.879 2.591 10 0 EFAEHO CN1C[C@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C(C)(C)C1 ZINC001363625076 1336959704 /nfs/dbraw/zinc/95/97/04/1336959704.db2.gz ZFFUHXVDYRMISU-SFHVURJKSA-N 1 3 343.515 2.745 10 0 EFAEHO OC1(C[NH+]2CCCCC2)CCN(C[C@@H]2CCCC3(CCC3)O2)CC1 ZINC001363852509 1337082075 /nfs/dbraw/zinc/08/20/75/1337082075.db2.gz OWXNJBDVNGJBEW-SFHVURJKSA-N 1 3 336.520 2.791 10 0 EFAEHO COC(=O)Cc1ccccc1C[N@@H+]1C[C@@]23CN(C)C[C@]2(C1)CCCC3 ZINC001363854903 1337083579 /nfs/dbraw/zinc/08/35/79/1337083579.db2.gz NRKCNBSYVBUNPP-OYRHEFFESA-N 1 3 342.483 2.710 10 0 EFAEHO COC(=O)Cc1ccccc1C[N@H+]1C[C@@]23CN(C)C[C@]2(C1)CCCC3 ZINC001363854903 1337083581 /nfs/dbraw/zinc/08/35/81/1337083581.db2.gz NRKCNBSYVBUNPP-OYRHEFFESA-N 1 3 342.483 2.710 10 0 EFAEHO C[C@H]1CN(C(=O)C2(C[NH+](C)C)CCCCC2)CCN1C1CCCC1 ZINC001363996174 1337142433 /nfs/dbraw/zinc/14/24/33/1337142433.db2.gz HQCQXUSOSBLNFZ-KRWDZBQOSA-N 1 3 335.536 2.974 10 0 EFAEHO CC[N@H+](C)[C@H]1CCN(C(=O)[C@@H]2CCCCN2Cc2cccc(C)c2)C1 ZINC001364011081 1337149665 /nfs/dbraw/zinc/14/96/65/1337149665.db2.gz JXOMXHHOVMGIEP-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO CC[N@@H+](C)[C@H]1CCN(C(=O)[C@@H]2CCCCN2Cc2cccc(C)c2)C1 ZINC001364011081 1337149668 /nfs/dbraw/zinc/14/96/68/1337149668.db2.gz JXOMXHHOVMGIEP-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+]C/C=C\c2ccccc2)C1 ZINC001365849379 1337256125 /nfs/dbraw/zinc/25/61/25/1337256125.db2.gz MLKSKJZSTRPABH-QCPTXGODSA-N 1 3 329.488 2.524 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)C1CCN(Cc2cc3ccccc3o2)CC1 ZINC001365924206 1337261170 /nfs/dbraw/zinc/26/11/70/1337261170.db2.gz LRPMVFUIESNDMK-UHFFFAOYSA-N 1 3 343.471 2.807 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CCCN(CCc2ccccc2)C1 ZINC001365936432 1337269064 /nfs/dbraw/zinc/26/90/64/1337269064.db2.gz GKLJNSKLDPDUTD-VQTJNVASSA-N 1 3 343.515 2.684 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CCCN(CCc2ccccc2)C1 ZINC001365936432 1337269067 /nfs/dbraw/zinc/26/90/67/1337269067.db2.gz GKLJNSKLDPDUTD-VQTJNVASSA-N 1 3 343.515 2.684 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CC12CCN(Cc1cccc(Cl)c1)CC2 ZINC001366014012 1337323119 /nfs/dbraw/zinc/32/31/19/1337323119.db2.gz APEAIJGERJHYMA-KRWDZBQOSA-N 1 3 349.906 2.762 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@@H](NCC=C(Cl)Cl)C2CC2)CC[N@@H+]1C ZINC001366046179 1337344827 /nfs/dbraw/zinc/34/48/27/1337344827.db2.gz AVLHKTHINCGLFV-FPMFFAJLSA-N 1 3 348.318 2.520 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@@H](NCC=C(Cl)Cl)C2CC2)CC[N@H+]1C ZINC001366046179 1337344831 /nfs/dbraw/zinc/34/48/31/1337344831.db2.gz AVLHKTHINCGLFV-FPMFFAJLSA-N 1 3 348.318 2.520 10 0 EFAEHO CC1CCC(C[NH2+][C@H](CNC(=O)C2(N(C)C)CCC2)C2CC2)CC1 ZINC001366032858 1337336576 /nfs/dbraw/zinc/33/65/76/1337336576.db2.gz FDBQQNKVPRWIDQ-LEOMRAHMSA-N 1 3 335.536 2.781 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001366114619 1337384784 /nfs/dbraw/zinc/38/47/84/1337384784.db2.gz CVTYUWODZBUOCJ-XDQVBPFNSA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001366114619 1337384789 /nfs/dbraw/zinc/38/47/89/1337384789.db2.gz CVTYUWODZBUOCJ-XDQVBPFNSA-N 1 3 346.302 2.559 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@H]2CN(CCC(F)(F)F)CC[C@H]21 ZINC001366144187 1337400895 /nfs/dbraw/zinc/40/08/95/1337400895.db2.gz KYANZEBXFMUKGB-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@H]2CN(CCC(F)(F)F)CC[C@H]21 ZINC001366144187 1337400899 /nfs/dbraw/zinc/40/08/99/1337400899.db2.gz KYANZEBXFMUKGB-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1C[C@@H](NCc2ccc(F)cc2Cl)C1 ZINC001366154046 1337404700 /nfs/dbraw/zinc/40/47/00/1337404700.db2.gz HEHGQOVDJXOUDW-GASCZTMLSA-N 1 3 341.858 2.558 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(Cl)cc32)C1)N(C)C ZINC001366161606 1337408749 /nfs/dbraw/zinc/40/87/49/1337408749.db2.gz KIOIRHTXRCTYME-CYGHRXIMSA-N 1 3 349.906 2.904 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@H]1CNCc1ccccn1)[NH+](CC)CC ZINC001366221909 1337454654 /nfs/dbraw/zinc/45/46/54/1337454654.db2.gz ZZLMRYSSNFOTLG-RBUKOAKNSA-N 1 3 346.519 2.673 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]Cc2cc(F)ccc2C)CC1)N(C)C ZINC001366245430 1337474697 /nfs/dbraw/zinc/47/46/97/1337474697.db2.gz WWGWJJGYDBPNTE-CTWPCTMYSA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]C/C=C/c1ccccc1 ZINC001366271054 1337484519 /nfs/dbraw/zinc/48/45/19/1337484519.db2.gz AJGDPYDPIUJNLG-QWRNQZPISA-N 1 3 329.488 2.667 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H](C)CNC(=O)[C@@H]1CCCN1C(C)C ZINC001366277202 1337487423 /nfs/dbraw/zinc/48/74/23/1337487423.db2.gz MWBROZKZOYIXCI-YJBOKZPZSA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)C(C)(C)[NH+]2CCCCC2)c1 ZINC001366277985 1337487485 /nfs/dbraw/zinc/48/74/85/1337487485.db2.gz PWMZXCNUAANIPR-INIZCTEOSA-N 1 3 349.494 2.993 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](C)CNC(=O)[C@H]2CCCCN2C(C)C)c1 ZINC001366334259 1337519124 /nfs/dbraw/zinc/51/91/24/1337519124.db2.gz VCTVHEBFHPALJK-PKOBYXMFSA-N 1 3 331.504 2.852 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NCc1cc(Cl)cc(Cl)c1 ZINC001366358484 1337533796 /nfs/dbraw/zinc/53/37/96/1337533796.db2.gz OXLVMCGJMJSAHC-YPMHNXCESA-N 1 3 344.286 2.539 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NCc1cc(Cl)cc(Cl)c1 ZINC001366358484 1337533798 /nfs/dbraw/zinc/53/37/98/1337533798.db2.gz OXLVMCGJMJSAHC-YPMHNXCESA-N 1 3 344.286 2.539 10 0 EFAEHO CC(C)[NH2+]CCc1ccc(CNC(=O)CN2[C@@H](C)CC[C@@H]2C)cc1 ZINC001366423812 1337574020 /nfs/dbraw/zinc/57/40/20/1337574020.db2.gz WCLWBUVOTWOITE-IRXDYDNUSA-N 1 3 331.504 2.716 10 0 EFAEHO CC(C)[NH2+]CCc1ccc(CNC(=O)CN2[C@H](C)CC[C@@H]2C)cc1 ZINC001366423808 1337574204 /nfs/dbraw/zinc/57/42/04/1337574204.db2.gz WCLWBUVOTWOITE-CALCHBBNSA-N 1 3 331.504 2.716 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001366490653 1337631072 /nfs/dbraw/zinc/63/10/72/1337631072.db2.gz WJPUPRIDVGUKSF-KXBFYZLASA-N 1 3 345.531 2.938 10 0 EFAEHO Cc1cncc(C[NH2+][C@H](C)CCNC(=O)[C@@H]2CCCCN2C(C)C)c1 ZINC001366494234 1337635188 /nfs/dbraw/zinc/63/51/88/1337635188.db2.gz UMUYMQSPROGZDE-MJGOQNOKSA-N 1 3 346.519 2.637 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)cc1 ZINC001366525793 1337663756 /nfs/dbraw/zinc/66/37/56/1337663756.db2.gz ARBDUGPUUVESQP-RBUKOAKNSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)cc1 ZINC001366525793 1337663759 /nfs/dbraw/zinc/66/37/59/1337663759.db2.gz ARBDUGPUUVESQP-RBUKOAKNSA-N 1 3 331.504 2.527 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)CC[C@H]2CCC[N@@H+]2C)c(C)c1 ZINC001366541351 1337677756 /nfs/dbraw/zinc/67/77/56/1337677756.db2.gz PVKKQKRMYGHDSG-LJQANCHMSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)CC[C@H]2CCC[N@H+]2C)c(C)c1 ZINC001366541351 1337677758 /nfs/dbraw/zinc/67/77/58/1337677758.db2.gz PVKKQKRMYGHDSG-LJQANCHMSA-N 1 3 331.504 2.726 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@H+](C)[C@H]2CCc3ccc(Cl)cc32)C1 ZINC001366565662 1337701353 /nfs/dbraw/zinc/70/13/53/1337701353.db2.gz KPYDZBDOTGIZLJ-KSSFIOAISA-N 1 3 349.906 2.717 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@@H+](C)[C@H]2CCc3ccc(Cl)cc32)C1 ZINC001366565662 1337701354 /nfs/dbraw/zinc/70/13/54/1337701354.db2.gz KPYDZBDOTGIZLJ-KSSFIOAISA-N 1 3 349.906 2.717 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC[N@H+](C)CC1CCC(F)(F)CC1 ZINC001366592685 1337730108 /nfs/dbraw/zinc/73/01/08/1337730108.db2.gz NVWICLOWTOOIPN-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC[N@@H+](C)CC1CCC(F)(F)CC1 ZINC001366592685 1337730110 /nfs/dbraw/zinc/73/01/10/1337730110.db2.gz NVWICLOWTOOIPN-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CC)CCc2ccccc2F)CC[N@@H+]1C ZINC001366616241 1337755322 /nfs/dbraw/zinc/75/53/22/1337755322.db2.gz RXYBZWQXFNLUFD-PKOBYXMFSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CC)CCc2ccccc2F)CC[N@H+]1C ZINC001366616241 1337755330 /nfs/dbraw/zinc/75/53/30/1337755330.db2.gz RXYBZWQXFNLUFD-PKOBYXMFSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@H+](CC)C[C@H]1CCc2ccccc2C1)N(C)C ZINC001366626162 1337766642 /nfs/dbraw/zinc/76/66/42/1337766642.db2.gz AEKRPQJAWCRUCS-PXNSSMCTSA-N 1 3 345.531 2.570 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@@H+](CC)C[C@H]1CCc2ccccc2C1)N(C)C ZINC001366626162 1337766648 /nfs/dbraw/zinc/76/66/48/1337766648.db2.gz AEKRPQJAWCRUCS-PXNSSMCTSA-N 1 3 345.531 2.570 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)Cc1cccc(Cl)c1 ZINC001366639846 1337785833 /nfs/dbraw/zinc/78/58/33/1337785833.db2.gz UOGAMPSQONRDQJ-MRXNPFEDSA-N 1 3 337.895 2.620 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)Cc1cccc(Cl)c1 ZINC001366639846 1337785839 /nfs/dbraw/zinc/78/58/39/1337785839.db2.gz UOGAMPSQONRDQJ-MRXNPFEDSA-N 1 3 337.895 2.620 10 0 EFAEHO CC[N@H+](CCNC(=O)Cc1nc[nH]c1C)CC[C@@H]1CCCC1(F)F ZINC001366641660 1337788923 /nfs/dbraw/zinc/78/89/23/1337788923.db2.gz QRYUTOMJXJGAFX-AWEZNQCLSA-N 1 3 342.434 2.524 10 0 EFAEHO CC[N@@H+](CCNC(=O)Cc1nc[nH]c1C)CC[C@@H]1CCCC1(F)F ZINC001366641660 1337788930 /nfs/dbraw/zinc/78/89/30/1337788930.db2.gz QRYUTOMJXJGAFX-AWEZNQCLSA-N 1 3 342.434 2.524 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](CC)CC1CC2(CCC2)C1 ZINC001366642940 1337790631 /nfs/dbraw/zinc/79/06/31/1337790631.db2.gz DERFMHISUPJGOT-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](CC)CC1CC2(CCC2)C1 ZINC001366642940 1337790636 /nfs/dbraw/zinc/79/06/36/1337790636.db2.gz DERFMHISUPJGOT-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@H+](CCC2CCCC2)C1)N1CCCC1 ZINC001366703540 1337894924 /nfs/dbraw/zinc/89/49/24/1337894924.db2.gz YEKFGVIWYZUTIQ-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@@H+](CCC2CCCC2)C1)N1CCCC1 ZINC001366703540 1337894929 /nfs/dbraw/zinc/89/49/29/1337894929.db2.gz YEKFGVIWYZUTIQ-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H](C)[NH2+]CCC(C)(C)C)CC1 ZINC001366782677 1338000734 /nfs/dbraw/zinc/00/07/34/1338000734.db2.gz MVLCICIHBFEJDU-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@H]([NH2+]C/C(Cl)=C/Cl)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001366789728 1338007827 /nfs/dbraw/zinc/00/78/27/1338007827.db2.gz GZRQPGNIWOWCDN-BIGIQQRPSA-N 1 3 348.318 2.616 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@H]1CC[N@H+](CCC2CC2)C1 ZINC001366842055 1338103581 /nfs/dbraw/zinc/10/35/81/1338103581.db2.gz MSKABMSHJKZVIE-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@H]1CC[N@@H+](CCC2CC2)C1 ZINC001366842055 1338103585 /nfs/dbraw/zinc/10/35/85/1338103585.db2.gz MSKABMSHJKZVIE-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CCc1cccc(C[N@H+]2CC[C@@H](CCNC(=O)[C@@H](CC)N(C)C)C2)c1 ZINC001366847611 1338112539 /nfs/dbraw/zinc/11/25/39/1338112539.db2.gz ARTNNFWYJWKQTB-UYAOXDASSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1cccc(C[N@@H+]2CC[C@@H](CCNC(=O)[C@@H](CC)N(C)C)C2)c1 ZINC001366847611 1338112542 /nfs/dbraw/zinc/11/25/42/1338112542.db2.gz ARTNNFWYJWKQTB-UYAOXDASSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@@H]1CCN(C/C=C\Cl)C1)[NH+]1CCCC1 ZINC001366850997 1338117119 /nfs/dbraw/zinc/11/71/19/1338117119.db2.gz JIGUHWSUPHXEMW-LVXHKSIOSA-N 1 3 341.927 2.688 10 0 EFAEHO CC[C@H](F)C[N@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001366881540 1338159944 /nfs/dbraw/zinc/15/99/44/1338159944.db2.gz QUEFFZPFGZFNHE-SFHVURJKSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001366881540 1338159948 /nfs/dbraw/zinc/15/99/48/1338159948.db2.gz QUEFFZPFGZFNHE-SFHVURJKSA-N 1 3 341.515 2.637 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH+]2CC(CNC(=O)CN(C)C3CCC3)C2)c1 ZINC001366967803 1338229048 /nfs/dbraw/zinc/22/90/48/1338229048.db2.gz ALBSHQMWOVQCOO-KRWDZBQOSA-N 1 3 343.515 2.897 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1C[NH+]2CCC1CC2)NCc1ccccc1Cl ZINC001367089970 1338374678 /nfs/dbraw/zinc/37/46/78/1338374678.db2.gz ASFGQUVDQISMLN-DLBZAZTESA-N 1 3 349.906 2.666 10 0 EFAEHO CC(C)C[NH2+]CC1(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CCCC1 ZINC001367154571 1338451115 /nfs/dbraw/zinc/45/11/15/1338451115.db2.gz BVAOYGHGYGQDHP-IBGZPJMESA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC1CC[NH+](CC[C@@H](C)F)CC1)N(C)C ZINC001367213754 1338523419 /nfs/dbraw/zinc/52/34/19/1338523419.db2.gz VVRMGSJHUQSJIW-NVXWUHKLSA-N 1 3 329.504 2.539 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)C[NH2+]Cc1cccc(F)c1Cl)N(C)C ZINC001367295299 1338594799 /nfs/dbraw/zinc/59/47/99/1338594799.db2.gz VRMQPBVFHLIBCO-IUODEOHRSA-N 1 3 343.874 2.661 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+]Cc2ccc(C)nc2C)CCCC1 ZINC001367323181 1338620296 /nfs/dbraw/zinc/62/02/96/1338620296.db2.gz GABPFYRVUNHGRT-UHFFFAOYSA-N 1 3 346.519 2.559 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C(=O)CN(C)C1CCC1 ZINC001367356511 1338652098 /nfs/dbraw/zinc/65/20/98/1338652098.db2.gz IAVXENDLVJXJMF-INIZCTEOSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H](CNCc1ccccc1F)N(C)C(=O)C12CCC[NH+](CCC1)C2 ZINC001367369880 1338665506 /nfs/dbraw/zinc/66/55/06/1338665506.db2.gz XSRBZMZVGOEWOX-INIZCTEOSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@H](C[NH2+]CC1CCC(F)(F)CC1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001367383914 1338679731 /nfs/dbraw/zinc/67/97/31/1338679731.db2.gz QKUSARIAGRSCRY-HUUCEWRRSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]CC1CCC(F)(F)CC1 ZINC001367412760 1338710661 /nfs/dbraw/zinc/71/06/61/1338710661.db2.gz KRYLKYIIBFSTDF-AWEZNQCLSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H](C)[NH2+]Cc2ccccc2F)C1 ZINC001367450142 1338753106 /nfs/dbraw/zinc/75/31/06/1338753106.db2.gz NNLCMXPNNWHCTA-AEFFLSMTSA-N 1 3 349.494 2.883 10 0 EFAEHO CN(CC[N@H+](C)[C@H]1CCc2c1cccc2Cl)C(=O)CN1CCCC1 ZINC001367552699 1338863225 /nfs/dbraw/zinc/86/32/25/1338863225.db2.gz OVNOLBMKSDCAHC-SFHVURJKSA-N 1 3 349.906 2.813 10 0 EFAEHO CN(CC[N@@H+](C)[C@H]1CCc2c1cccc2Cl)C(=O)CN1CCCC1 ZINC001367552699 1338863229 /nfs/dbraw/zinc/86/32/29/1338863229.db2.gz OVNOLBMKSDCAHC-SFHVURJKSA-N 1 3 349.906 2.813 10 0 EFAEHO CCN(CC[NH2+][C@@H](C)c1cccc(OC)c1)C(=O)CN1CC[C@H](C)C1 ZINC001367646670 1338901676 /nfs/dbraw/zinc/90/16/76/1338901676.db2.gz IHMRXWPKIYCTDE-IRXDYDNUSA-N 1 3 347.503 2.536 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCc2ccc(Cl)cc21)C(=O)[C@@H]1CCCN1C ZINC001367647214 1338902833 /nfs/dbraw/zinc/90/28/33/1338902833.db2.gz XTRSPECIRYUGQN-ROUUACIJSA-N 1 3 349.906 2.860 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+][C@H](C)c1cccc(Cl)c1 ZINC001367776028 1339000487 /nfs/dbraw/zinc/00/04/87/1339000487.db2.gz WQVYBBHOSFYCQB-UONOGXRCSA-N 1 3 325.884 2.836 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@H+](C)Cc1ccccc1C1CC1)N(C)C ZINC001367817349 1339034725 /nfs/dbraw/zinc/03/47/25/1339034725.db2.gz ZTTGMKNFHIYKAY-DNVCBOLYSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@@H+](C)Cc1ccccc1C1CC1)N(C)C ZINC001367817349 1339034727 /nfs/dbraw/zinc/03/47/27/1339034727.db2.gz ZTTGMKNFHIYKAY-DNVCBOLYSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)Cc1ccc(C2CC2)cc1 ZINC001367860823 1339075749 /nfs/dbraw/zinc/07/57/49/1339075749.db2.gz KOOWOFHIASFZEB-MRXNPFEDSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)Cc1ccc(C2CC2)cc1 ZINC001367860823 1339075751 /nfs/dbraw/zinc/07/57/51/1339075751.db2.gz KOOWOFHIASFZEB-MRXNPFEDSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C[NH2+]CC1CCC2(CC2)CC1)C1CC1)N(C)C ZINC001367902824 1339096400 /nfs/dbraw/zinc/09/64/00/1339096400.db2.gz PWVUVJOCVBSTJT-ROUUACIJSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)(C(=O)N[C@@H](C[NH2+]Cc1ccsc1)C1CC1)N1CCCC1 ZINC001367903927 1339097493 /nfs/dbraw/zinc/09/74/93/1339097493.db2.gz RIPQUDFOWYRHMD-INIZCTEOSA-N 1 3 335.517 2.607 10 0 EFAEHO C[C@H](C(=O)N[C@@H](C[NH2+]Cc1ccccc1)C1CC1)N1CCCCCC1 ZINC001367910600 1339100965 /nfs/dbraw/zinc/10/09/65/1339100965.db2.gz IKVSTXMGDJRZNO-XLIONFOSSA-N 1 3 343.515 2.936 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]Cc1ccccc1 ZINC001367924561 1339111041 /nfs/dbraw/zinc/11/10/41/1339111041.db2.gz ASRXTMUNFZCFBH-RTBURBONSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)C(C)(C)N3CCCC3)CC2)cc1C ZINC001368012174 1339157211 /nfs/dbraw/zinc/15/72/11/1339157211.db2.gz KARJZZMBKHQHMN-UHFFFAOYSA-N 1 3 343.515 2.916 10 0 EFAEHO C[C@H](NC1(CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)CC1)c1ccc(F)cc1 ZINC001368015687 1339159093 /nfs/dbraw/zinc/15/90/93/1339159093.db2.gz NDPRCQDEVZRPPY-ZOBUZTSGSA-N 1 3 347.478 2.855 10 0 EFAEHO C[C@H](NC1(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)CC1)c1ccc(F)cc1 ZINC001368015687 1339159094 /nfs/dbraw/zinc/15/90/94/1339159094.db2.gz NDPRCQDEVZRPPY-ZOBUZTSGSA-N 1 3 347.478 2.855 10 0 EFAEHO CN(CC(=O)NCC1([NH2+][C@@H]2CCc3ccccc32)CC1)CC(C)(C)C ZINC001368019347 1339161057 /nfs/dbraw/zinc/16/10/57/1339161057.db2.gz MAXHDKVFXLRKCE-GOSISDBHSA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@H](NC1(CNC(=O)C23CC[NH+](CC2)C3)CC1)c1cccc(Cl)c1 ZINC001368030645 1339165583 /nfs/dbraw/zinc/16/55/83/1339165583.db2.gz ZWIJFFBELZCDFX-AWEZNQCLSA-N 1 3 347.890 2.735 10 0 EFAEHO C[C@@H](NC1(CNC(=O)C23CC[NH+](CC2)C3)CC1)c1cccc(Cl)c1 ZINC001368030648 1339165753 /nfs/dbraw/zinc/16/57/53/1339165753.db2.gz ZWIJFFBELZCDFX-CQSZACIVSA-N 1 3 347.890 2.735 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC2(C1)CCN(Cc1cccc(F)c1)CC2 ZINC001368055594 1339180594 /nfs/dbraw/zinc/18/05/94/1339180594.db2.gz HYTFDWFEQQXTIX-UHFFFAOYSA-N 1 3 347.478 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@H]1CCc2c1cccc2F ZINC001368124311 1339204301 /nfs/dbraw/zinc/20/43/01/1339204301.db2.gz VADBJVJGGWOXSO-BEFAXECRSA-N 1 3 347.478 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+]Cc1ccccc1Cl ZINC001368125941 1339205407 /nfs/dbraw/zinc/20/54/07/1339205407.db2.gz XCWRQGIHPSJMDJ-INIZCTEOSA-N 1 3 337.895 2.761 10 0 EFAEHO CCCN(C)CC(=O)NC1(C)CC[NH+]([C@H]2CCc3ccccc32)CC1 ZINC001368126856 1339205842 /nfs/dbraw/zinc/20/58/42/1339205842.db2.gz NIVNTQACBMLAKS-IBGZPJMESA-N 1 3 343.515 2.986 10 0 EFAEHO CC[C@@H](F)CN1CC[C@]2(C1)CCCCN(C(=O)CCC[NH+](C)C)C2 ZINC001368141482 1339215127 /nfs/dbraw/zinc/21/51/27/1339215127.db2.gz MZQFOBYMBNECKW-MJGOQNOKSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[C@H](C)C[NH+]1CCC(C)(CNC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001368209766 1339257407 /nfs/dbraw/zinc/25/74/07/1339257407.db2.gz XPRXXWSECFBJLF-IRXDYDNUSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@H](C(=O)NC[C@]1(C)CCC[N@H+](Cc2ccccc2)C1)N(C)C ZINC001368230582 1339275400 /nfs/dbraw/zinc/27/54/00/1339275400.db2.gz NDNQFBJPBHCKMP-QUCCMNQESA-N 1 3 331.504 2.745 10 0 EFAEHO CC[C@H](C(=O)NC[C@]1(C)CCC[N@@H+](Cc2ccccc2)C1)N(C)C ZINC001368230582 1339275402 /nfs/dbraw/zinc/27/54/02/1339275402.db2.gz NDNQFBJPBHCKMP-QUCCMNQESA-N 1 3 331.504 2.745 10 0 EFAEHO CCN1CCC(F)(F)[C@H](CNC(=O)[C@@H](C(C)C)[NH+]2CCCCC2)C1 ZINC001368252519 1339284228 /nfs/dbraw/zinc/28/42/28/1339284228.db2.gz SCSLFBGEMYGJLT-HZPDHXFCSA-N 1 3 345.478 2.590 10 0 EFAEHO CCc1ccccc1[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]C(C)C ZINC001368326287 1339298947 /nfs/dbraw/zinc/29/89/47/1339298947.db2.gz CYGNBAZMPLLCOW-SFHVURJKSA-N 1 3 331.504 2.889 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001368344941 1339308918 /nfs/dbraw/zinc/30/89/18/1339308918.db2.gz FSNNRTQPAXKZIF-RDGPPVDQSA-N 1 3 337.552 2.887 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)C[C@H]3CC[N@@H+](C)C3)CCC2)c1 ZINC001368491540 1339428340 /nfs/dbraw/zinc/42/83/40/1339428340.db2.gz ZDUOUPVAGBDISE-MRXNPFEDSA-N 1 3 347.478 2.604 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)C[C@H]3CC[N@H+](C)C3)CCC2)c1 ZINC001368491540 1339428344 /nfs/dbraw/zinc/42/83/44/1339428344.db2.gz ZDUOUPVAGBDISE-MRXNPFEDSA-N 1 3 347.478 2.604 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]Cc2ccc(F)cc2)CCC1 ZINC001368494294 1339432105 /nfs/dbraw/zinc/43/21/05/1339432105.db2.gz CZESVUDWDYBZSV-IYBDPMFKSA-N 1 3 347.478 2.827 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](Cc2cccc(C)c2)CC1)N(C)C ZINC001368509163 1339444544 /nfs/dbraw/zinc/44/45/44/1339444544.db2.gz CUUJBBOIIFWBLG-RTBURBONSA-N 1 3 331.504 2.806 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2cccc(C)c2)CC1)N(C)C ZINC001368509163 1339444546 /nfs/dbraw/zinc/44/45/46/1339444546.db2.gz CUUJBBOIIFWBLG-RTBURBONSA-N 1 3 331.504 2.806 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCCN(Cc2ccccn2)CC1)[NH+](CC)CC ZINC001368518601 1339454439 /nfs/dbraw/zinc/45/44/39/1339454439.db2.gz XEYOMXDFLWIEDW-PKOBYXMFSA-N 1 3 346.519 2.673 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@H+](CC2CC3(CCC3)C2)CC1 ZINC001368522530 1339458587 /nfs/dbraw/zinc/45/85/87/1339458587.db2.gz LNLYBZVTOWHULW-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@@H+](CC2CC3(CCC3)C2)CC1 ZINC001368522530 1339458588 /nfs/dbraw/zinc/45/85/88/1339458588.db2.gz LNLYBZVTOWHULW-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@H+](CC2CC3(CCC3)C2)CC1 ZINC001368522526 1339459024 /nfs/dbraw/zinc/45/90/24/1339459024.db2.gz LNLYBZVTOWHULW-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@@H+](CC2CC3(CCC3)C2)CC1 ZINC001368522526 1339459028 /nfs/dbraw/zinc/45/90/28/1339459028.db2.gz LNLYBZVTOWHULW-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)CC[NH2+][C@H]1C[C@@H](CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001368532777 1339471073 /nfs/dbraw/zinc/47/10/73/1339471073.db2.gz CNMVIVHFSNCOPU-IZAXUBKRSA-N 1 3 331.504 2.892 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](CCc2cccs2)CC1)N(C)C ZINC001368534206 1339473530 /nfs/dbraw/zinc/47/35/30/1339473530.db2.gz QNSYLEXAILWWEG-DOTOQJQBSA-N 1 3 337.533 2.602 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](CCc2cccs2)CC1)N(C)C ZINC001368534206 1339473534 /nfs/dbraw/zinc/47/35/34/1339473534.db2.gz QNSYLEXAILWWEG-DOTOQJQBSA-N 1 3 337.533 2.602 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@H+](C)C[C@@H]1CCC(F)(F)C1)N(C)C ZINC001368550675 1339488449 /nfs/dbraw/zinc/48/84/49/1339488449.db2.gz WWPPWZRBTXJLKV-HUUCEWRRSA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@@H+](C)C[C@@H]1CCC(F)(F)C1)N(C)C ZINC001368550675 1339488452 /nfs/dbraw/zinc/48/84/52/1339488452.db2.gz WWPPWZRBTXJLKV-HUUCEWRRSA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001368573150 1339521920 /nfs/dbraw/zinc/52/19/20/1339521920.db2.gz UBRNHXPKOOOQIW-KLHDSHLOSA-N 1 3 345.478 2.637 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2C[C@H]([NH2+][C@H]3CCc4ccccc43)C2)C1 ZINC001368591996 1339537737 /nfs/dbraw/zinc/53/77/37/1339537737.db2.gz POVHQFOTEJZRNX-CIWUYKSXSA-N 1 3 341.499 2.500 10 0 EFAEHO CC[C@H](C)C[NH2+][C@H]1C[C@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001368594321 1339540328 /nfs/dbraw/zinc/54/03/28/1339540328.db2.gz VPSPFURCZJTJDR-IUVQAAGXSA-N 1 3 341.515 2.729 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(C)CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001368650846 1339566394 /nfs/dbraw/zinc/56/63/94/1339566394.db2.gz CWHWSQIMQLWPPB-HNNXBMFYSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CC2CC3(CCC3)C2)[C@H](C)C1 ZINC001368693891 1339608634 /nfs/dbraw/zinc/60/86/34/1339608634.db2.gz DGXAVDMPAZALRK-AEFFLSMTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)[C@H](C)C1 ZINC001368693891 1339608640 /nfs/dbraw/zinc/60/86/40/1339608640.db2.gz DGXAVDMPAZALRK-AEFFLSMTSA-N 1 3 335.536 2.876 10 0 EFAEHO Cc1ccc(F)cc1CN1CC[C@@H](NC(=O)CC[NH+](C)C)C[C@H]1C ZINC001368698525 1339615029 /nfs/dbraw/zinc/61/50/29/1339615029.db2.gz UQNPKZWBNZCCTG-CRAIPNDOSA-N 1 3 335.467 2.555 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H](C(C)C)N2CCCC2)CC[N@@H+]1CCC1CC1 ZINC001368701139 1339618703 /nfs/dbraw/zinc/61/87/03/1339618703.db2.gz BSQKHKXHXURCOM-IPMKNSEASA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H](C(C)C)N2CCCC2)CC[N@H+]1CCC1CC1 ZINC001368701139 1339618704 /nfs/dbraw/zinc/61/87/04/1339618704.db2.gz BSQKHKXHXURCOM-IPMKNSEASA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+]([C@H](C)c3ccccc3)CC[C@@H]2C1 ZINC001368735457 1339656348 /nfs/dbraw/zinc/65/63/48/1339656348.db2.gz KLZASEVJFIFYTJ-RLLQIKCJSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+]([C@H](C)c3ccccc3)CC[C@@H]2C1 ZINC001368735457 1339656350 /nfs/dbraw/zinc/65/63/50/1339656350.db2.gz KLZASEVJFIFYTJ-RLLQIKCJSA-N 1 3 343.515 2.868 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCCCC[C@@H](NCc2ccccn2)C1 ZINC001368749087 1339672919 /nfs/dbraw/zinc/67/29/19/1339672919.db2.gz MLVATKXRQVXFNT-LJQANCHMSA-N 1 3 346.519 2.674 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCCCC[C@@H](NCc2ccccn2)C1 ZINC001368749087 1339672923 /nfs/dbraw/zinc/67/29/23/1339672923.db2.gz MLVATKXRQVXFNT-LJQANCHMSA-N 1 3 346.519 2.674 10 0 EFAEHO Cc1cccnc1CN[C@H]1CCCCCN(C(=O)CCC[NH+](C)C)C1 ZINC001368752507 1339677683 /nfs/dbraw/zinc/67/76/83/1339677683.db2.gz CTQJQEPEPIAIGP-SFHVURJKSA-N 1 3 346.519 2.593 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+][C@@H]1CCc2c1cccc2F ZINC001368757463 1339684262 /nfs/dbraw/zinc/68/42/62/1339684262.db2.gz ZQIOTHUAOQPOQK-KBXCAEBGSA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N1CCCCC[C@@H]([NH2+]C/C=C\Cl)C1 ZINC001368761767 1339687596 /nfs/dbraw/zinc/68/75/96/1339687596.db2.gz QTDSUZXFKQQVRA-GJWDQICYSA-N 1 3 341.927 2.973 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCCCC[C@H]([NH2+]CCC(F)(F)F)C2)C1 ZINC001368764121 1339690406 /nfs/dbraw/zinc/69/04/06/1339690406.db2.gz YKJGOVOJZSSUOK-GJZGRUSLSA-N 1 3 349.441 2.641 10 0 EFAEHO Cc1ccc(C)c(C[N@H+]2CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@H]2C)c1 ZINC001368783087 1339709927 /nfs/dbraw/zinc/70/99/27/1339709927.db2.gz CEOKSQXJJKEYNR-YZGWKJHDSA-N 1 3 345.531 2.969 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+]2CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@H]2C)c1 ZINC001368783087 1339709930 /nfs/dbraw/zinc/70/99/30/1339709930.db2.gz CEOKSQXJJKEYNR-YZGWKJHDSA-N 1 3 345.531 2.969 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CC[NH+](C)C)CCN1Cc1ccc(C(F)F)cc1 ZINC001368783539 1339710268 /nfs/dbraw/zinc/71/02/68/1339710268.db2.gz DCOKFFDQHZJIOY-CJNGLKHVSA-N 1 3 339.430 2.655 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CCC[NH+]2CCCC2)CCN1Cc1ccccc1 ZINC001368801239 1339735997 /nfs/dbraw/zinc/73/59/97/1339735997.db2.gz RDPCUQDHBVMRQD-MJGOQNOKSA-N 1 3 329.488 2.642 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@H+](Cc2ccccn2)CC(C)(C)C1)N(C)C ZINC001368823436 1339762849 /nfs/dbraw/zinc/76/28/49/1339762849.db2.gz CCCRKDVHUOVZGF-SJLPKXTDSA-N 1 3 346.519 2.529 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@@H+](Cc2ccccn2)CC(C)(C)C1)N(C)C ZINC001368823436 1339762851 /nfs/dbraw/zinc/76/28/51/1339762851.db2.gz CCCRKDVHUOVZGF-SJLPKXTDSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](Cc2cccnc2)CC(C)(C)C1 ZINC001368832782 1339774167 /nfs/dbraw/zinc/77/41/67/1339774167.db2.gz PAKFZIYWMZEBLF-GOSISDBHSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](Cc2cccnc2)CC(C)(C)C1 ZINC001368832782 1339774170 /nfs/dbraw/zinc/77/41/70/1339774170.db2.gz PAKFZIYWMZEBLF-GOSISDBHSA-N 1 3 346.519 2.529 10 0 EFAEHO Cc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)CC[NH+](C)C)c(Cl)c1 ZINC001368856969 1339793398 /nfs/dbraw/zinc/79/33/98/1339793398.db2.gz ANBBFAZEAKOVRP-UONOGXRCSA-N 1 3 325.884 2.583 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CCC([NH2+]CC2CC(F)(F)C2)CC1)N(C)C ZINC001368897065 1339836974 /nfs/dbraw/zinc/83/69/74/1339836974.db2.gz GYCMKKKFMYBGDP-UYSNPLJNSA-N 1 3 345.478 2.731 10 0 EFAEHO CN(C(=O)[C@@H]1CCCN1C)C1CCC([NH2+]CC=C(Cl)Cl)CC1 ZINC001368899972 1339840478 /nfs/dbraw/zinc/84/04/78/1339840478.db2.gz GJZVBJNLMHMICY-RUXDESIVSA-N 1 3 348.318 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001368902758 1339843909 /nfs/dbraw/zinc/84/39/09/1339843909.db2.gz VEJVBGXOMHHQFJ-VXGBXAGGSA-N 1 3 331.913 2.725 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC(C)(C)C[NH2+]CC1CC(C)(C)C1)N(C)C ZINC001368920202 1339865694 /nfs/dbraw/zinc/86/56/94/1339865694.db2.gz UFFGDSCRJRPGKU-INIZCTEOSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@@H](C)C1)C1C[NH+](CCCC2CCCC2)C1 ZINC001369094774 1339911816 /nfs/dbraw/zinc/91/18/16/1339911816.db2.gz PUKNSFBDVUATQN-IAGOWNOFSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@H](NC(=O)CN(C)CC(C)(C)C)C1C[NH+](CC2CC(C)(C)C2)C1 ZINC001369099251 1339915190 /nfs/dbraw/zinc/91/51/90/1339915190.db2.gz XOQMDARWCBQTCC-HNNXBMFYSA-N 1 3 337.552 2.837 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC2(C1)CCCN(Cc1ccsc1)C2 ZINC001369149821 1339944293 /nfs/dbraw/zinc/94/42/93/1339944293.db2.gz HSGQJDDIRXPILG-UHFFFAOYSA-N 1 3 335.517 2.514 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC2(C1)CCCN(Cc1ccsc1)C2 ZINC001369149821 1339944297 /nfs/dbraw/zinc/94/42/97/1339944297.db2.gz HSGQJDDIRXPILG-UHFFFAOYSA-N 1 3 335.517 2.514 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2ccc(F)cc2)C1)N(C)C ZINC001369173825 1339952487 /nfs/dbraw/zinc/95/24/87/1339952487.db2.gz MCPWHOZVZONJLB-DTDBQYNISA-N 1 3 335.467 2.711 10 0 EFAEHO CCCOc1cccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001370432730 1340075264 /nfs/dbraw/zinc/07/52/64/1340075264.db2.gz WQBVAUXDIKONAL-SFHVURJKSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H]([NH2+][C@H](C)c2cc(C)ccc2C)C1)N(C)C ZINC001370488410 1340099460 /nfs/dbraw/zinc/09/94/60/1340099460.db2.gz JNCLSVRQOSNZMF-YWTNHNAXSA-N 1 3 331.504 2.941 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H](NC(=O)CC[C@H]2CCC[N@@H+]2C)C1)c1ccccc1F ZINC001370640898 1340178998 /nfs/dbraw/zinc/17/89/98/1340178998.db2.gz UJFLXUBAIREJPD-MWDXBVQZSA-N 1 3 347.478 2.998 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H](NC(=O)CC[C@H]2CCC[N@H+]2C)C1)c1ccccc1F ZINC001370640898 1340179001 /nfs/dbraw/zinc/17/90/01/1340179001.db2.gz UJFLXUBAIREJPD-MWDXBVQZSA-N 1 3 347.478 2.998 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)C1 ZINC001370738621 1340194195 /nfs/dbraw/zinc/19/41/95/1340194195.db2.gz XWDOOCLATZBQPI-OPSDDYQFSA-N 1 3 341.499 2.809 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)NC[C@H]1CCCCN1CCCF ZINC001370852962 1340236240 /nfs/dbraw/zinc/23/62/40/1340236240.db2.gz KGTCKZIXJFRUIF-QGZVFWFLSA-N 1 3 341.515 2.970 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)NC[C@H]1CCCCN1CCCF ZINC001370852962 1340236242 /nfs/dbraw/zinc/23/62/42/1340236242.db2.gz KGTCKZIXJFRUIF-QGZVFWFLSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCCC1 ZINC001371362544 1340530006 /nfs/dbraw/zinc/53/00/06/1340530006.db2.gz JMJCKJRESHKPHO-BEFAXECRSA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC(C)(C)C ZINC001371364636 1340531180 /nfs/dbraw/zinc/53/11/80/1340531180.db2.gz OUNALXMAVKDNAT-RDTXWAMCSA-N 1 3 329.504 2.729 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001371620747 1340679639 /nfs/dbraw/zinc/67/96/39/1340679639.db2.gz SDWYKOKEHSLGKM-IRXDYDNUSA-N 1 3 347.503 2.535 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001371870415 1340732126 /nfs/dbraw/zinc/73/21/26/1340732126.db2.gz SEBSBDDOOJJARY-DGCLKSJQSA-N 1 3 331.913 2.726 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1ccccc1Cl)N(C)C ZINC001371870878 1340732550 /nfs/dbraw/zinc/73/25/50/1340732550.db2.gz YNRKPGKTPWEKOV-XJKSGUPXSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1cccc(Cl)c1F)N(C)C ZINC001371870756 1340732804 /nfs/dbraw/zinc/73/28/04/1340732804.db2.gz WFKINSDMBCGRDW-SWLSCSKDSA-N 1 3 343.874 2.804 10 0 EFAEHO CCCN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)Cc1ccc(C)c(F)c1 ZINC001372742011 1340785795 /nfs/dbraw/zinc/78/57/95/1340785795.db2.gz QAUVBQAPNCFTAQ-GOSISDBHSA-N 1 3 349.494 2.804 10 0 EFAEHO CCCN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)Cc1ccc(C)c(F)c1 ZINC001372742011 1340785797 /nfs/dbraw/zinc/78/57/97/1340785797.db2.gz QAUVBQAPNCFTAQ-GOSISDBHSA-N 1 3 349.494 2.804 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@H+](C2CC2)[C@H]2CCc3ccccc32)C1 ZINC001372862577 1340850861 /nfs/dbraw/zinc/85/08/61/1340850861.db2.gz ZCECIOKGJJYRGQ-UZLBHIALSA-N 1 3 341.499 2.596 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@@H+](C2CC2)[C@H]2CCc3ccccc32)C1 ZINC001372862577 1340850863 /nfs/dbraw/zinc/85/08/63/1340850863.db2.gz ZCECIOKGJJYRGQ-UZLBHIALSA-N 1 3 341.499 2.596 10 0 EFAEHO C[C@H](F)CC[NH2+][C@@H](CNC(=O)C1(N(C)C)CCC1)c1ccccc1 ZINC001373055630 1340887010 /nfs/dbraw/zinc/88/70/10/1340887010.db2.gz FCZSTFGIEWXKRK-RDJZCZTQSA-N 1 3 335.467 2.666 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2cc(F)ccc2C)C1)N(C)C ZINC001373199515 1340944536 /nfs/dbraw/zinc/94/45/36/1340944536.db2.gz QRRLCUZQEWDUHA-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2cc(F)ccc2C)C1)N(C)C ZINC001373199515 1340944537 /nfs/dbraw/zinc/94/45/37/1340944537.db2.gz QRRLCUZQEWDUHA-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2cc(F)ccc2C)C1)N(C)C ZINC001373199518 1340944570 /nfs/dbraw/zinc/94/45/70/1340944570.db2.gz QRRLCUZQEWDUHA-VQIMIIECSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2cc(F)ccc2C)C1)N(C)C ZINC001373199518 1340944571 /nfs/dbraw/zinc/94/45/71/1340944571.db2.gz QRRLCUZQEWDUHA-VQIMIIECSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2cc(C)ccc2F)C1)N(C)C ZINC001373220991 1340954267 /nfs/dbraw/zinc/95/42/67/1340954267.db2.gz CUPFRQLDKSMRSG-APWZRJJASA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2cc(C)ccc2F)C1)N(C)C ZINC001373220991 1340954268 /nfs/dbraw/zinc/95/42/68/1340954268.db2.gz CUPFRQLDKSMRSG-APWZRJJASA-N 1 3 349.494 2.803 10 0 EFAEHO CCCC[N@@H+]1CC[C@H](CCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001373226445 1340956820 /nfs/dbraw/zinc/95/68/20/1340956820.db2.gz MCWSGIOUIDXBRK-QFBILLFUSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCC[N@H+]1CC[C@H](CCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001373226445 1340956821 /nfs/dbraw/zinc/95/68/21/1340956821.db2.gz MCWSGIOUIDXBRK-QFBILLFUSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccc(CC[N@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)cc1 ZINC001373246588 1340966490 /nfs/dbraw/zinc/96/64/90/1340966490.db2.gz MATQREHFVVBXEA-FQEVSTJZSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CC[N@@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)cc1 ZINC001373246588 1340966492 /nfs/dbraw/zinc/96/64/92/1340966492.db2.gz MATQREHFVVBXEA-FQEVSTJZSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@H](F)CN(C)C[C@H]1CCN(C(=O)CCC[NH+]2CCCCC2)C1 ZINC001373308192 1340984886 /nfs/dbraw/zinc/98/48/86/1340984886.db2.gz AQVJLNICMFCLES-MSOLQXFVSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@H]1CCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001373309014 1340985104 /nfs/dbraw/zinc/98/51/04/1340985104.db2.gz DQGFODPARXPVIX-QZTJIDSGSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@H]1CCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001373309014 1340985106 /nfs/dbraw/zinc/98/51/06/1340985106.db2.gz DQGFODPARXPVIX-QZTJIDSGSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@@H]1CCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001373309018 1340985155 /nfs/dbraw/zinc/98/51/55/1340985155.db2.gz DQGFODPARXPVIX-ROUUACIJSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001373309018 1340985156 /nfs/dbraw/zinc/98/51/56/1340985156.db2.gz DQGFODPARXPVIX-ROUUACIJSA-N 1 3 325.541 2.789 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+](C)C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001373316301 1340988447 /nfs/dbraw/zinc/98/84/47/1340988447.db2.gz RFUIAGDGKNPFDG-QGZVFWFLSA-N 1 3 349.494 2.755 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+](C)C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001373316301 1340988449 /nfs/dbraw/zinc/98/84/49/1340988449.db2.gz RFUIAGDGKNPFDG-QGZVFWFLSA-N 1 3 349.494 2.755 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+](C)C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001373317815 1340989150 /nfs/dbraw/zinc/98/91/50/1340989150.db2.gz VIOFCDFSQXPFEW-IBGZPJMESA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1cccc(C)c1C[N@H+](C)C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001373317815 1340989151 /nfs/dbraw/zinc/98/91/51/1340989151.db2.gz VIOFCDFSQXPFEW-IBGZPJMESA-N 1 3 345.531 2.924 10 0 EFAEHO CCC(CC)C[N@H+](C)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001373333083 1340994435 /nfs/dbraw/zinc/99/44/35/1340994435.db2.gz HHBXWPCRWHTWRG-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CCC(CC)C[N@@H+](C)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001373333083 1340994436 /nfs/dbraw/zinc/99/44/36/1340994436.db2.gz HHBXWPCRWHTWRG-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)[C@H]1CCN(Cc2ccc(C3CCC3)cc2)C1 ZINC001373680427 1341097232 /nfs/dbraw/zinc/09/72/32/1341097232.db2.gz NKPGNPLIYZCNHW-FQEVSTJZSA-N 1 3 343.515 2.939 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]CCc1ccccc1 ZINC001373754008 1341134789 /nfs/dbraw/zinc/13/47/89/1341134789.db2.gz OAJOFDYMTDRFKE-RTBURBONSA-N 1 3 331.504 2.586 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1csc(C)c1 ZINC001373762998 1341138553 /nfs/dbraw/zinc/13/85/53/1341138553.db2.gz VJDIIMZGCBAKFH-SJORKVTESA-N 1 3 337.533 2.915 10 0 EFAEHO CC[C@H](CNC(=O)C12CCC[NH+](CCC1)C2)NCc1ccccc1F ZINC001373765792 1341139249 /nfs/dbraw/zinc/13/92/49/1341139249.db2.gz YOJQORUOFLTDOU-QGZVFWFLSA-N 1 3 347.478 2.686 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccccc1C ZINC001373779638 1341144360 /nfs/dbraw/zinc/14/43/60/1341144360.db2.gz CTVJDYGBURETBG-GOSISDBHSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccccc1C1CC1 ZINC001373797874 1341152073 /nfs/dbraw/zinc/15/20/73/1341152073.db2.gz NIIRJOMVAAQEPK-QFBILLFUSA-N 1 3 343.515 2.890 10 0 EFAEHO Cc1cc(C[NH2+]C[C@](C)(NC(=O)CN(C)C(C)C)C2CC2)cs1 ZINC001373903360 1341197160 /nfs/dbraw/zinc/19/71/60/1341197160.db2.gz WVDQFZKYURLWGG-SFHVURJKSA-N 1 3 337.533 2.771 10 0 EFAEHO CC[C@@H](C)C[NH2+]Cc1ccc(CNC(=O)C2(N(C)C)CCC2)cc1 ZINC001373931405 1341212079 /nfs/dbraw/zinc/21/20/79/1341212079.db2.gz NWEFLKSXTDJYQN-MRXNPFEDSA-N 1 3 331.504 2.923 10 0 EFAEHO CC[C@@H](C(=O)NCCC1CC[NH+](CCC(C)(C)C)CC1)N(C)C ZINC001373950357 1341241729 /nfs/dbraw/zinc/24/17/29/1341241729.db2.gz RYMOOHMBNCZXSF-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(CC[N@H+](Cc3ccsc3)C2)CC1 ZINC001373981149 1341274841 /nfs/dbraw/zinc/27/48/41/1341274841.db2.gz JYLQXAVJILMRRY-UHFFFAOYSA-N 1 3 349.544 2.903 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(CC[N@@H+](Cc3ccsc3)C2)CC1 ZINC001373981149 1341274843 /nfs/dbraw/zinc/27/48/43/1341274843.db2.gz JYLQXAVJILMRRY-UHFFFAOYSA-N 1 3 349.544 2.903 10 0 EFAEHO C[C@H](CNC/C(Cl)=C/Cl)CNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001374047016 1341334540 /nfs/dbraw/zinc/33/45/40/1341334540.db2.gz HDCQUIWVZXNKRP-YFBAIUBQSA-N 1 3 336.307 2.522 10 0 EFAEHO C[C@@H]([NH2+]C[C@@H](C)CNC(=O)C(C)(C)N1CCCC1)c1ccccc1 ZINC001374053029 1341340863 /nfs/dbraw/zinc/34/08/63/1341340863.db2.gz OMMZGGUXCTYLKE-IAGOWNOFSA-N 1 3 331.504 2.964 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccccc1)N(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001392103511 1355768268 /nfs/dbraw/zinc/76/82/68/1355768268.db2.gz VTSMJSKUZLVYFZ-JXFKEZNVSA-N 1 3 349.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H](C)[NH2+]CCC(C)(C)C)C1 ZINC001392188708 1355842953 /nfs/dbraw/zinc/84/29/53/1355842953.db2.gz KIPOMEHSJXTCJI-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]C[C@H]1CCc2ccccc2C1 ZINC001374327428 1341730551 /nfs/dbraw/zinc/73/05/51/1341730551.db2.gz JGZRNAOOYUWDKW-MSOLQXFVSA-N 1 3 345.531 2.568 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1csc(C)c1 ZINC001374327691 1341730765 /nfs/dbraw/zinc/73/07/65/1341730765.db2.gz JSANDMYOBKODOW-RHSMWYFYSA-N 1 3 337.533 2.867 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]C(C)C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001374354157 1341783287 /nfs/dbraw/zinc/78/32/87/1341783287.db2.gz QHYAEYNVQOQDEW-YJBOKZPZSA-N 1 3 329.504 2.728 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CC[NH+](C)C)NCc1ccc(Cl)cc1F ZINC001374430406 1341911958 /nfs/dbraw/zinc/91/19/58/1341911958.db2.gz CLSXHKVXKXQHJE-MRXNPFEDSA-N 1 3 343.874 2.661 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CC[NH+](C)C)NCc1cccc(F)c1Cl ZINC001374431913 1341914085 /nfs/dbraw/zinc/91/40/85/1341914085.db2.gz PLHRYYIJLDELCX-OAHLLOKOSA-N 1 3 343.874 2.661 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H](CNC(=O)CN1CC[C@@H](C)C1)C(C)C ZINC001374434002 1341916835 /nfs/dbraw/zinc/91/68/35/1341916835.db2.gz NQKPYSIEBWLJMP-BEFAXECRSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](CNC(=O)CN1CC[C@H](C)C1)C(C)C ZINC001374434634 1341917463 /nfs/dbraw/zinc/91/74/63/1341917463.db2.gz WGCCWLGRDZATQK-LPHOPBHVSA-N 1 3 331.504 2.567 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H](C)c1ccc(F)cc1 ZINC001374448282 1341930783 /nfs/dbraw/zinc/93/07/83/1341930783.db2.gz BPKIXSYMIWAGDQ-QAPCUYQASA-N 1 3 337.483 2.957 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C(C)C ZINC001374457909 1341938870 /nfs/dbraw/zinc/93/88/70/1341938870.db2.gz ZPTLPMAMYKDGAP-SFHVURJKSA-N 1 3 337.483 2.705 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2CCC[C@@H]3CCC[N@@H+]32)cc1 ZINC001374544424 1342049939 /nfs/dbraw/zinc/04/99/39/1342049939.db2.gz HGQPBSYRWSIICM-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2CCC[C@@H]3CCC[N@H+]32)cc1 ZINC001374544424 1342049943 /nfs/dbraw/zinc/04/99/43/1342049943.db2.gz HGQPBSYRWSIICM-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)[N@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001374555859 1342066282 /nfs/dbraw/zinc/06/62/82/1342066282.db2.gz FVEVCKDANRTOFE-SFHVURJKSA-N 1 3 335.467 2.763 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)[N@@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001374555859 1342066287 /nfs/dbraw/zinc/06/62/87/1342066287.db2.gz FVEVCKDANRTOFE-SFHVURJKSA-N 1 3 335.467 2.763 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]CC[C@H](C)NC(=O)Cc2nc[nH]c2C)c1 ZINC001374702952 1342121060 /nfs/dbraw/zinc/12/10/60/1342121060.db2.gz AWHQABUJKJKGHE-KBPBESRZSA-N 1 3 344.459 2.515 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC001374815153 1342186747 /nfs/dbraw/zinc/18/67/47/1342186747.db2.gz VYYINUXHFCLAKP-UZLBHIALSA-N 1 3 349.494 2.802 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001374847819 1342204027 /nfs/dbraw/zinc/20/40/27/1342204027.db2.gz AJGWPAVANZDIBT-DNVCBOLYSA-N 1 3 342.487 2.637 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C ZINC001374897289 1342229255 /nfs/dbraw/zinc/22/92/55/1342229255.db2.gz CMRWKGNYOWKHIC-KXBFYZLASA-N 1 3 331.504 2.745 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]Cc1cccc2ccccc21)N(C)C ZINC001374960513 1342270015 /nfs/dbraw/zinc/27/00/15/1342270015.db2.gz ANSTVGJEVMMVQV-HNAYVOBHSA-N 1 3 327.472 2.774 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)CCC[NH+]2CCCCC2)c1 ZINC001374978849 1342284291 /nfs/dbraw/zinc/28/42/91/1342284291.db2.gz MOPHTWHKQVBHKN-KRWDZBQOSA-N 1 3 349.494 2.995 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C(C)(C)C)cc1)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001375153106 1342468938 /nfs/dbraw/zinc/46/89/38/1342468938.db2.gz CFYRNLAQPNWUFQ-AEFFLSMTSA-N 1 3 345.531 2.872 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C(C)(C)C)cc1)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001375153106 1342468942 /nfs/dbraw/zinc/46/89/42/1342468942.db2.gz CFYRNLAQPNWUFQ-AEFFLSMTSA-N 1 3 345.531 2.872 10 0 EFAEHO Cc1ccc(CNC[C@@H](NC(=O)[C@@H]2CC[N@@H+](C)C2)C2CC2)c(Cl)c1 ZINC001375275301 1342582500 /nfs/dbraw/zinc/58/25/00/1342582500.db2.gz WMUOPIAGTPQOCX-SJLPKXTDSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1ccc(CNC[C@@H](NC(=O)[C@@H]2CC[N@H+](C)C2)C2CC2)c(Cl)c1 ZINC001375275301 1342582502 /nfs/dbraw/zinc/58/25/02/1342582502.db2.gz WMUOPIAGTPQOCX-SJLPKXTDSA-N 1 3 349.906 2.585 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]Cc1ccccc1F ZINC001375280990 1342588658 /nfs/dbraw/zinc/58/86/58/1342588658.db2.gz GAHXOGSRDNJNAU-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+]CC[C@@H]2CCCC2(F)F)CCC1)N(C)C ZINC001393554763 1356945338 /nfs/dbraw/zinc/94/53/38/1356945338.db2.gz HNIAUAFQFVUXCI-GJZGRUSLSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+][C@@H]2CCc3ccccc32)CC1 ZINC001375419943 1342724374 /nfs/dbraw/zinc/72/43/74/1342724374.db2.gz GFCNSMRSRIVFGI-RTBURBONSA-N 1 3 341.499 2.785 10 0 EFAEHO CN(CC(=O)N1CCC[C@]2(CC[N@H+](CCCF)C2)C1)CC(C)(C)C ZINC001393696694 1357087193 /nfs/dbraw/zinc/08/71/93/1357087193.db2.gz PPVZQXBAHMMXII-LJQANCHMSA-N 1 3 341.515 2.638 10 0 EFAEHO CN(CC(=O)N1CCC[C@]2(CC[N@@H+](CCCF)C2)C1)CC(C)(C)C ZINC001393696694 1357087198 /nfs/dbraw/zinc/08/71/98/1357087198.db2.gz PPVZQXBAHMMXII-LJQANCHMSA-N 1 3 341.515 2.638 10 0 EFAEHO CCCCN1CC[C@H]1CN(C)C(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001375461703 1342766542 /nfs/dbraw/zinc/76/65/42/1342766542.db2.gz BZQDLAXCNGDINB-YJBOKZPZSA-N 1 3 327.488 2.532 10 0 EFAEHO CCCCN1CC[C@H]1CN(C)C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001375461703 1342766545 /nfs/dbraw/zinc/76/65/45/1342766545.db2.gz BZQDLAXCNGDINB-YJBOKZPZSA-N 1 3 327.488 2.532 10 0 EFAEHO CCCCN1CC[C@@H]1CN(C)C(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001375461691 1342766801 /nfs/dbraw/zinc/76/68/01/1342766801.db2.gz BZQDLAXCNGDINB-QAPCUYQASA-N 1 3 327.488 2.532 10 0 EFAEHO CCCCN1CC[C@@H]1CN(C)C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001375461691 1342766803 /nfs/dbraw/zinc/76/68/03/1342766803.db2.gz BZQDLAXCNGDINB-QAPCUYQASA-N 1 3 327.488 2.532 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@@H+]2CCCC2CCCC2)C1 ZINC001375464107 1342770118 /nfs/dbraw/zinc/77/01/18/1342770118.db2.gz GMZJDMREXQDMEZ-PKOBYXMFSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@H+]2CCCC2CCCC2)C1 ZINC001375464107 1342770120 /nfs/dbraw/zinc/77/01/20/1342770120.db2.gz GMZJDMREXQDMEZ-PKOBYXMFSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H]([NH2+]C1(CNC(=O)CN2CC[C@H](C)C2)CC1)c1cccc(Cl)c1 ZINC001375490990 1342797462 /nfs/dbraw/zinc/79/74/62/1342797462.db2.gz NIBFAGRGBFRRFO-LSDHHAIUSA-N 1 3 349.906 2.981 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1(N[C@H](C)c2cccc(Cl)c2)CC1 ZINC001375519068 1342827741 /nfs/dbraw/zinc/82/77/41/1342827741.db2.gz VQGKCKVUQVEHTR-CQSZACIVSA-N 1 3 337.895 2.981 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1(N[C@H](C)c2cccc(Cl)c2)CC1 ZINC001375519068 1342827744 /nfs/dbraw/zinc/82/77/44/1342827744.db2.gz VQGKCKVUQVEHTR-CQSZACIVSA-N 1 3 337.895 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc32)C1)N(C)C ZINC001375520662 1342830193 /nfs/dbraw/zinc/83/01/93/1342830193.db2.gz ZQNXGRVYKOLTOS-VUBSUSDNSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]Cc2ccc(CF)cc2)CC1 ZINC001375552438 1342866904 /nfs/dbraw/zinc/86/69/04/1342866904.db2.gz JFRYCWCNMTUBNK-HZPDHXFCSA-N 1 3 347.478 2.767 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@H]1CC[N@H+](CC2CCC2)C1 ZINC001375568378 1342885458 /nfs/dbraw/zinc/88/54/58/1342885458.db2.gz DWLBFJMLQZYQIW-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@H]1CC[N@@H+](CC2CCC2)C1 ZINC001375568378 1342885464 /nfs/dbraw/zinc/88/54/64/1342885464.db2.gz DWLBFJMLQZYQIW-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)CN1CC[C@@H](C)C1 ZINC001375572501 1342890331 /nfs/dbraw/zinc/89/03/31/1342890331.db2.gz JRUDBAVBHQSNJT-MVCQKVDPSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]Cc3ccc(F)cc3)C2)C1 ZINC001375574955 1342892267 /nfs/dbraw/zinc/89/22/67/1342892267.db2.gz UCSOLOBMEZJPRR-VDZJLULYSA-N 1 3 347.478 2.542 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H]2CC[N@H+](CC[C@@H](C)F)C2)CC1 ZINC001375573864 1342892552 /nfs/dbraw/zinc/89/25/52/1342892552.db2.gz NVYASDOKFHKNPN-SJLPKXTDSA-N 1 3 341.515 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H]2CC[N@@H+](CC[C@@H](C)F)C2)CC1 ZINC001375573864 1342892562 /nfs/dbraw/zinc/89/25/62/1342892562.db2.gz NVYASDOKFHKNPN-SJLPKXTDSA-N 1 3 341.515 2.637 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+][C@H](C)c2ccccc2)C1 ZINC001375577539 1342895888 /nfs/dbraw/zinc/89/58/88/1342895888.db2.gz LEIBLMAURQTFEB-ZIFCJYIRSA-N 1 3 331.504 2.964 10 0 EFAEHO CC[C@H](F)CN1CC[C@H](NC(=O)C2(C[NH+](C)C)CC2)CC(C)(C)C1 ZINC001375691740 1342932814 /nfs/dbraw/zinc/93/28/14/1342932814.db2.gz YCDPBYYCRADSJP-HOTGVXAUSA-N 1 3 341.515 2.683 10 0 EFAEHO CN(CC(=O)N1CC[C@](C)(C[NH2+]CC2CC3(CCC3)C2)C1)C1CCC1 ZINC001375875673 1343121726 /nfs/dbraw/zinc/12/17/26/1343121726.db2.gz RSFHJTFYUCJDAV-HXUWFJFHSA-N 1 3 347.547 2.879 10 0 EFAEHO CN(CC(=O)N1CC[C@@](C)(C[NH2+]CC2CC3(CCC3)C2)C1)C1CCC1 ZINC001375875672 1343121790 /nfs/dbraw/zinc/12/17/90/1343121790.db2.gz RSFHJTFYUCJDAV-FQEVSTJZSA-N 1 3 347.547 2.879 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2ccccc2C)C1)N(C)C ZINC001375879447 1343125154 /nfs/dbraw/zinc/12/51/54/1343125154.db2.gz LRBUAUGISZLYEX-QUCCMNQESA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)NC[C@@]1(C)CCC[N@H+](Cc2ccsc2)C1)N(C)C ZINC001375949511 1343202064 /nfs/dbraw/zinc/20/20/64/1343202064.db2.gz XTHFQMSYKKROBL-SJLPKXTDSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@H](C(=O)NC[C@@]1(C)CCC[N@@H+](Cc2ccsc2)C1)N(C)C ZINC001375949511 1343202066 /nfs/dbraw/zinc/20/20/66/1343202066.db2.gz XTHFQMSYKKROBL-SJLPKXTDSA-N 1 3 337.533 2.807 10 0 EFAEHO Cc1ncccc1C[NH2+][C@H](C)[C@@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001376007542 1343255357 /nfs/dbraw/zinc/25/53/57/1343255357.db2.gz CDZIACIWKJAYNR-MJGOQNOKSA-N 1 3 346.519 2.589 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC12CC[NH+](Cc1ccsc1)CC2)C1CCC1 ZINC001376171672 1343372504 /nfs/dbraw/zinc/37/25/04/1343372504.db2.gz IMVGDEMAMFNQTQ-QGZVFWFLSA-N 1 3 347.528 2.703 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CCC1CCCC1)C1CC1 ZINC001376223408 1343409149 /nfs/dbraw/zinc/40/91/49/1343409149.db2.gz RVYBUTQZLYYHNY-MOPGFXCFSA-N 1 3 335.536 2.924 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]([NH2+][C@@H]1CCc2ccccc21)C1CC1 ZINC001376252312 1343429077 /nfs/dbraw/zinc/42/90/77/1343429077.db2.gz CJDIAYBDSHQVAP-RTBURBONSA-N 1 3 329.488 2.500 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+][C@@H](C)c2ccc(Cl)cc2)C1 ZINC001376353037 1343506701 /nfs/dbraw/zinc/50/67/01/1343506701.db2.gz NFQOJSRUGHIIOE-YOEHRIQHSA-N 1 3 337.895 2.932 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@H]1CN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001376361469 1343514368 /nfs/dbraw/zinc/51/43/68/1343514368.db2.gz LHKGNWIJUVWFNV-AEFFLSMTSA-N 1 3 349.494 2.658 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001376469084 1343614353 /nfs/dbraw/zinc/61/43/53/1343614353.db2.gz HGNQYGDOPGELQK-JONQDZQNSA-N 1 3 345.478 2.635 10 0 EFAEHO CCc1cccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001376479923 1343619257 /nfs/dbraw/zinc/61/92/57/1343619257.db2.gz YVSHXQDYCBDMNM-CEXWTWQISA-N 1 3 331.504 2.572 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N1C[C@@H]2CCCN(C(=O)CC[NH+](C)C)[C@@H]2C1 ZINC001376530010 1343654861 /nfs/dbraw/zinc/65/48/61/1343654861.db2.gz JSPBBGQSIUHYNA-VDZJLULYSA-N 1 3 347.478 2.761 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@H]1CCCCN1Cc1ccc2c(c1)CCC2 ZINC001376572788 1343690596 /nfs/dbraw/zinc/69/05/96/1343690596.db2.gz FCLAZCSSWVGIDX-HXUWFJFHSA-N 1 3 343.515 2.598 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@H]1CCCCN1Cc1ccc2cc[nH]c2c1 ZINC001376572910 1343690894 /nfs/dbraw/zinc/69/08/94/1343690894.db2.gz FERUBDNXHVEMMO-SFHVURJKSA-N 1 3 342.487 2.590 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCC[N@@H+]1CCC1CC1)N1CCCC1 ZINC001376589235 1343707195 /nfs/dbraw/zinc/70/71/95/1343707195.db2.gz FZKUXXADJWKHFT-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCC[N@H+]1CCC1CC1)N1CCCC1 ZINC001376589235 1343707199 /nfs/dbraw/zinc/70/71/99/1343707199.db2.gz FZKUXXADJWKHFT-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H]1CCC[N@H+](CC2CCCC2)C1 ZINC001376622599 1343729108 /nfs/dbraw/zinc/72/91/08/1343729108.db2.gz HTFMJFSRMIXRGC-SJLPKXTDSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H]1CCC[N@@H+](CC2CCCC2)C1 ZINC001376622599 1343729111 /nfs/dbraw/zinc/72/91/11/1343729111.db2.gz HTFMJFSRMIXRGC-SJLPKXTDSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001376627514 1343733634 /nfs/dbraw/zinc/73/36/34/1343733634.db2.gz QNYXKJCXZVXGEE-FUHWJXTLSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001376627514 1343733636 /nfs/dbraw/zinc/73/36/36/1343733636.db2.gz QNYXKJCXZVXGEE-FUHWJXTLSA-N 1 3 337.552 2.981 10 0 EFAEHO CCC(CC)C[N@@H+]1CCC[C@H]([C@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001376629419 1343735453 /nfs/dbraw/zinc/73/54/53/1343735453.db2.gz SAMDNNWGYIRXRU-WMZOPIPTSA-N 1 3 325.541 2.980 10 0 EFAEHO CCC(CC)C[N@H+]1CCC[C@H]([C@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001376629419 1343735457 /nfs/dbraw/zinc/73/54/57/1343735457.db2.gz SAMDNNWGYIRXRU-WMZOPIPTSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@@H]1[C@H]2C[N@H+](CCCC(C)(C)C)C[C@H]21 ZINC001376659074 1343748552 /nfs/dbraw/zinc/74/85/52/1343748552.db2.gz ATSYNZHEGBZPOR-BDJZZAGISA-N 1 3 335.536 2.732 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@@H]1[C@H]2C[N@@H+](CCCC(C)(C)C)C[C@H]21 ZINC001376659074 1343748554 /nfs/dbraw/zinc/74/85/54/1343748554.db2.gz ATSYNZHEGBZPOR-BDJZZAGISA-N 1 3 335.536 2.732 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]CCc1ccc(C)cc1 ZINC001376733312 1343790802 /nfs/dbraw/zinc/79/08/02/1343790802.db2.gz XGGBKQCLILAOPX-PKOBYXMFSA-N 1 3 331.504 2.506 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(CNC(=O)C(C)(C)N2CCCCC2)CCC1 ZINC001376734840 1343791056 /nfs/dbraw/zinc/79/10/56/1343791056.db2.gz HVAPLHOGKPKDQE-HNNXBMFYSA-N 1 3 327.488 2.628 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)C2CC[NH+](C(C)C)CC2)c1 ZINC001376833410 1343880830 /nfs/dbraw/zinc/88/08/30/1343880830.db2.gz XAMZWINPXLVAHQ-INIZCTEOSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]Cc1cccc(C(F)F)c1 ZINC001376882802 1343918623 /nfs/dbraw/zinc/91/86/23/1343918623.db2.gz QYPJJSVWPDXGSE-ZDUSSCGKSA-N 1 3 327.419 2.559 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001376943298 1343974509 /nfs/dbraw/zinc/97/45/09/1343974509.db2.gz RJBQSYWDNHSKAY-AEFFLSMTSA-N 1 3 341.515 2.922 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001376943298 1343974511 /nfs/dbraw/zinc/97/45/11/1343974511.db2.gz RJBQSYWDNHSKAY-AEFFLSMTSA-N 1 3 341.515 2.922 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CCC[C@H]([NH2+]CCC(F)(F)F)C1)N1CCCC1 ZINC001376977705 1344007866 /nfs/dbraw/zinc/00/78/66/1344007866.db2.gz SCSNIADCYCUBCM-KBPBESRZSA-N 1 3 349.441 2.830 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CCC[C@@H]([NH2+]CCC(F)(F)F)C1)N1CCCC1 ZINC001376977714 1344008098 /nfs/dbraw/zinc/00/80/98/1344008098.db2.gz SCSNIADCYCUBCM-ZIAGYGMSSA-N 1 3 349.441 2.830 10 0 EFAEHO CN(Cc1ccsc1)[C@@H]1CCCN(C(=O)C2(C[NH+](C)C)CC2)C1 ZINC001376982234 1344013680 /nfs/dbraw/zinc/01/36/80/1344013680.db2.gz SNDAWZTXTFHBKH-MRXNPFEDSA-N 1 3 335.517 2.513 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)CCCN(C)C(=O)CN(C)C(C)C)c1 ZINC001377022833 1344069971 /nfs/dbraw/zinc/06/99/71/1344069971.db2.gz ZTBZZCMBLWBFRV-UHFFFAOYSA-N 1 3 333.520 2.924 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)CCCN(C)C(=O)CN(C)C(C)C)c1 ZINC001377022833 1344069978 /nfs/dbraw/zinc/06/99/78/1344069978.db2.gz ZTBZZCMBLWBFRV-UHFFFAOYSA-N 1 3 333.520 2.924 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1sccc1Cl ZINC001377067523 1344112479 /nfs/dbraw/zinc/11/24/79/1344112479.db2.gz OLKWQOYMUMSKNX-CHWSQXEVSA-N 1 3 343.924 2.728 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@H](C)C2)c(C)s1 ZINC001377070829 1344115195 /nfs/dbraw/zinc/11/51/95/1344115195.db2.gz WLLMYLGHITVBEN-UONOGXRCSA-N 1 3 337.533 2.691 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001377094063 1344130545 /nfs/dbraw/zinc/13/05/45/1344130545.db2.gz OJEONLBMMLKJBJ-HNAYVOBHSA-N 1 3 344.503 2.739 10 0 EFAEHO CCN(CCNC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C)Cc1ccc(F)cc1C ZINC001377367076 1344153083 /nfs/dbraw/zinc/15/30/83/1344153083.db2.gz NGURNFLYEYYYQZ-CALCHBBNSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN(CCNC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C)Cc1ccc(F)cc1C ZINC001377367076 1344153086 /nfs/dbraw/zinc/15/30/86/1344153086.db2.gz NGURNFLYEYYYQZ-CALCHBBNSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]CCN(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001377590628 1344196463 /nfs/dbraw/zinc/19/64/63/1344196463.db2.gz JMZOYCANDYEWRU-SJLPKXTDSA-N 1 3 331.504 2.754 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[NH2+][C@H]2CCc3ccc(Cl)cc32)C1 ZINC001377590695 1344196698 /nfs/dbraw/zinc/19/66/98/1344196698.db2.gz JRELHDNNHSICKC-KSSFIOAISA-N 1 3 349.906 2.717 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+][C@H]1CCc2ccccc21 ZINC001377606593 1344212793 /nfs/dbraw/zinc/21/27/93/1344212793.db2.gz YEGNXDYQPHUEAK-OALUTQOASA-N 1 3 329.488 2.596 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]([NH2+]CC2CCC2)c2ccccc2)C1 ZINC001377609974 1344217614 /nfs/dbraw/zinc/21/76/14/1344217614.db2.gz GOXPKMOUPYYYRS-QFBILLFUSA-N 1 3 329.488 2.575 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[N@H+](C)C/C=C/c1ccccc1)N(C)C ZINC001377639518 1344249762 /nfs/dbraw/zinc/24/97/62/1344249762.db2.gz IJGFBKRKWGKYNP-LRHIHOEBSA-N 1 3 343.515 2.963 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[N@@H+](C)C/C=C/c1ccccc1)N(C)C ZINC001377639518 1344249765 /nfs/dbraw/zinc/24/97/65/1344249765.db2.gz IJGFBKRKWGKYNP-LRHIHOEBSA-N 1 3 343.515 2.963 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCC[N@H+](CCC)C1)[C@@H]1CCN(CCCF)C1 ZINC001377658631 1344278201 /nfs/dbraw/zinc/27/82/01/1344278201.db2.gz UHHJRLJCUJQCDM-QZTJIDSGSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCC[N@@H+](CCC)C1)[C@@H]1CCN(CCCF)C1 ZINC001377658631 1344278206 /nfs/dbraw/zinc/27/82/06/1344278206.db2.gz UHHJRLJCUJQCDM-QZTJIDSGSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@H+](C)[C@H]1CCc2ccccc21 ZINC001377681906 1344315764 /nfs/dbraw/zinc/31/57/64/1344315764.db2.gz XRNIKANUINKOLI-ICSRJNTNSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001377681906 1344315767 /nfs/dbraw/zinc/31/57/67/1344315767.db2.gz XRNIKANUINKOLI-ICSRJNTNSA-N 1 3 343.515 2.937 10 0 EFAEHO CN(CC(=O)NCC[C@H]1CC[N@H+](CC2CCCC2)C1)CC(C)(C)C ZINC001377712338 1344358553 /nfs/dbraw/zinc/35/85/53/1344358553.db2.gz WNRDIHDAHAXLDY-SFHVURJKSA-N 1 3 337.552 2.983 10 0 EFAEHO CN(CC(=O)NCC[C@H]1CC[N@@H+](CC2CCCC2)C1)CC(C)(C)C ZINC001377712338 1344358559 /nfs/dbraw/zinc/35/85/59/1344358559.db2.gz WNRDIHDAHAXLDY-SFHVURJKSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@@H]2CC[N@H+](CCCC3CCC3)C2)C1 ZINC001377713387 1344358782 /nfs/dbraw/zinc/35/87/82/1344358782.db2.gz XPLOSEHIVFZDBT-PKOBYXMFSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@@H]2CC[N@@H+](CCCC3CCC3)C2)C1 ZINC001377713387 1344358786 /nfs/dbraw/zinc/35/87/86/1344358786.db2.gz XPLOSEHIVFZDBT-PKOBYXMFSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2cccc(Cl)c2)C1)N(C)C ZINC001377716621 1344363252 /nfs/dbraw/zinc/36/32/52/1344363252.db2.gz PBSLJTCGMDVYAH-BDVYOWHSSA-N 1 3 337.895 2.665 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2cc3ccccc3o2)C1)N(C)C ZINC001377735929 1344384385 /nfs/dbraw/zinc/38/43/85/1344384385.db2.gz MXBYYDOFPSXRPD-JFUPDXTOSA-N 1 3 343.471 2.757 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001377805405 1344456481 /nfs/dbraw/zinc/45/64/81/1344456481.db2.gz ISFDXXCZNKWOAK-ZIAGYGMSSA-N 1 3 337.895 2.807 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)cc1 ZINC001377808955 1344460151 /nfs/dbraw/zinc/46/01/51/1344460151.db2.gz QCEYOPMNOJHHFW-HOTGVXAUSA-N 1 3 331.504 2.716 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001377824777 1344481474 /nfs/dbraw/zinc/48/14/74/1344481474.db2.gz MRRIOSCWISEQDK-JKSUJKDBSA-N 1 3 335.536 2.924 10 0 EFAEHO CCc1ccccc1CN1CC(CNC(=O)CC[C@@H]2CCC[N@@H+]2C)C1 ZINC001377973276 1344628078 /nfs/dbraw/zinc/62/80/78/1344628078.db2.gz CAGTXWBWJPLKIX-FQEVSTJZSA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1ccccc1CN1CC(CNC(=O)CC[C@@H]2CCC[N@H+]2C)C1 ZINC001377973276 1344628081 /nfs/dbraw/zinc/62/80/81/1344628081.db2.gz CAGTXWBWJPLKIX-FQEVSTJZSA-N 1 3 343.515 2.671 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)C[NH+]3[C@@H](C)CC[C@@H]3C)C2)cc1C ZINC001378019947 1344670415 /nfs/dbraw/zinc/67/04/15/1344670415.db2.gz HQTQFDMAORQSKO-ROUUACIJSA-N 1 3 343.515 2.724 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1cccc(F)c1 ZINC001378048258 1344699907 /nfs/dbraw/zinc/69/99/07/1344699907.db2.gz LWQMUWHNCPZYNG-QAPCUYQASA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1cccc(F)c1 ZINC001378048258 1344699911 /nfs/dbraw/zinc/69/99/11/1344699911.db2.gz LWQMUWHNCPZYNG-QAPCUYQASA-N 1 3 335.467 2.635 10 0 EFAEHO Cc1ccc(CCC[N@@H+](C)[C@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001378140315 1344804326 /nfs/dbraw/zinc/80/43/26/1344804326.db2.gz LNWCOXMQRDLEOO-RBUKOAKNSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CCC[N@H+](C)[C@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001378140315 1344804331 /nfs/dbraw/zinc/80/43/31/1344804331.db2.gz LNWCOXMQRDLEOO-RBUKOAKNSA-N 1 3 345.531 2.706 10 0 EFAEHO CCc1ccc(C[N@H+](C)[C@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001378148542 1344812998 /nfs/dbraw/zinc/81/29/98/1344812998.db2.gz VSHDGVLRSAXYRH-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(C[N@@H+](C)[C@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001378148542 1344813002 /nfs/dbraw/zinc/81/30/02/1344813002.db2.gz VSHDGVLRSAXYRH-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCCN1CC)[NH2+]Cc1cc(C)ccc1F ZINC001378341498 1344999209 /nfs/dbraw/zinc/99/92/09/1344999209.db2.gz PCYYZIMVYCUVFI-PKOBYXMFSA-N 1 3 349.494 2.993 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[NH2+][C@H]1CCc2ccccc21 ZINC001393861348 1357220255 /nfs/dbraw/zinc/22/02/55/1357220255.db2.gz QUGXLRAEZVZFJZ-ICSRJNTNSA-N 1 3 343.515 2.986 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N[C@H]2CC[C@H](NC/C(Cl)=C/Cl)CC2)C1 ZINC001378455847 1345091875 /nfs/dbraw/zinc/09/18/75/1345091875.db2.gz SWCOHEXDKWYWLK-QCKOUHBKSA-N 1 3 348.318 2.664 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N[C@H]2CC[C@H](NC/C(Cl)=C/Cl)CC2)C1 ZINC001378455847 1345091879 /nfs/dbraw/zinc/09/18/79/1345091879.db2.gz SWCOHEXDKWYWLK-QCKOUHBKSA-N 1 3 348.318 2.664 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC1CC[NH+](CC[C@@H](C)F)CC1)N(C)C ZINC001378475101 1345109781 /nfs/dbraw/zinc/10/97/81/1345109781.db2.gz VVRMGSJHUQSJIW-WBVHZDCISA-N 1 3 329.504 2.539 10 0 EFAEHO Cc1cccc(CN2CC([C@H](C)NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001378529353 1345143159 /nfs/dbraw/zinc/14/31/59/1345143159.db2.gz LJXTXPIPYKYPPS-FXAWDEMLSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1cccc(CN2CC([C@H](C)NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001378529353 1345143161 /nfs/dbraw/zinc/14/31/61/1345143161.db2.gz LJXTXPIPYKYPPS-FXAWDEMLSA-N 1 3 343.515 2.806 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCCCC[N@@H+]1CCCF)N1CCCC1 ZINC001378529914 1345143760 /nfs/dbraw/zinc/14/37/60/1345143760.db2.gz QPGATSUSDNWDFD-MRXNPFEDSA-N 1 3 327.488 2.581 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCCCC[N@H+]1CCCF)N1CCCC1 ZINC001378529914 1345143763 /nfs/dbraw/zinc/14/37/63/1345143763.db2.gz QPGATSUSDNWDFD-MRXNPFEDSA-N 1 3 327.488 2.581 10 0 EFAEHO CCc1ccccc1CC[NH+]1CC([C@H](C)NC(=O)[C@@H](CC)N(C)C)C1 ZINC001378539112 1345149810 /nfs/dbraw/zinc/14/98/10/1345149810.db2.gz ZISUDRYSGLKPTJ-OXJNMPFZSA-N 1 3 345.531 2.568 10 0 EFAEHO C[C@H](NC(=O)[C@H](C)N1CCCCCC1)C1C[NH+](CC2CCCC2)C1 ZINC001378555028 1345159612 /nfs/dbraw/zinc/15/96/12/1345159612.db2.gz IWPGKTUIDGYEIG-IRXDYDNUSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+][C@H]1CCc2ccccc21 ZINC001378562825 1345164410 /nfs/dbraw/zinc/16/44/10/1345164410.db2.gz FMIWNVIUCXBAMM-QAPCUYQASA-N 1 3 329.488 2.500 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@H+](CC2CC2)CC1(C)C)N1CCCCC1 ZINC001378678461 1345243798 /nfs/dbraw/zinc/24/37/98/1345243798.db2.gz LOMRRXUHZWOMLY-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@@H+](CC2CC2)CC1(C)C)N1CCCCC1 ZINC001378678461 1345243803 /nfs/dbraw/zinc/24/38/03/1345243803.db2.gz LOMRRXUHZWOMLY-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(CNC(=O)CN(C)CC(C)(C)C)CCCC1 ZINC001378710436 1345264826 /nfs/dbraw/zinc/26/48/26/1345264826.db2.gz OHTMYLBIGXKHSG-HNNXBMFYSA-N 1 3 329.504 2.731 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@]2(C)C[N@H+](CC3CCCC3)C[C@]2(C)C1 ZINC001378814411 1345335235 /nfs/dbraw/zinc/33/52/35/1345335235.db2.gz HKFKDXOPLVAIBY-BGYRXZFFSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@]2(C)C[N@@H+](CC3CCCC3)C[C@]2(C)C1 ZINC001378814411 1345335237 /nfs/dbraw/zinc/33/52/37/1345335237.db2.gz HKFKDXOPLVAIBY-BGYRXZFFSA-N 1 3 335.536 2.689 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(C)cc2C)C1)N(C)C ZINC001378842912 1345355551 /nfs/dbraw/zinc/35/55/51/1345355551.db2.gz HZFDTCFMXOUTRL-BHIYHBOVSA-N 1 3 331.504 2.628 10 0 EFAEHO C[C@@H](C[NH2+][C@H]1CCc2ccc(Cl)cc21)N(C)C(=O)CN1CCCC1 ZINC001378847976 1345360669 /nfs/dbraw/zinc/36/06/69/1345360669.db2.gz DNXPHGSXWRHCQS-KSSFIOAISA-N 1 3 349.906 2.860 10 0 EFAEHO C[C@H](C[NH2+][C@@H]1CCc2ccc(Cl)cc21)N(C)C(=O)CN1CCCC1 ZINC001378847979 1345361079 /nfs/dbraw/zinc/36/10/79/1345361079.db2.gz DNXPHGSXWRHCQS-RDTXWAMCSA-N 1 3 349.906 2.860 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@H](CC)N(C)C)C1 ZINC001378851614 1345363644 /nfs/dbraw/zinc/36/36/44/1345363644.db2.gz JDWCWNWSUROWMA-SNRMKQJTSA-N 1 3 331.504 2.574 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(C)c(C)c2)C1 ZINC001378867929 1345377051 /nfs/dbraw/zinc/37/70/51/1345377051.db2.gz QBGJBUMLYLIZCT-WGSAOQKQSA-N 1 3 331.504 2.630 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2cc3ccccc3o2)C1 ZINC001378871203 1345380803 /nfs/dbraw/zinc/38/08/03/1345380803.db2.gz XVLWSBNWBYILKJ-JCNLHEQBSA-N 1 3 343.471 2.759 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]CC1CC1)C1CCCCC1 ZINC001378884835 1345394655 /nfs/dbraw/zinc/39/46/55/1345394655.db2.gz LMPXCLGMCBSEMD-RBUKOAKNSA-N 1 3 335.536 2.924 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C[NH2+]CC1CC1)C1CCCCC1 ZINC001378888238 1345398576 /nfs/dbraw/zinc/39/85/76/1345398576.db2.gz UFWPCOZOWHFNKM-OALUTQOASA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)N[C@H]1C[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001378890279 1345400661 /nfs/dbraw/zinc/40/06/61/1345400661.db2.gz HMWIHHYJZHEFAU-QTAXVQTHSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2ccccc2F)C1 ZINC001378892427 1345402087 /nfs/dbraw/zinc/40/20/87/1345402087.db2.gz QRVFGBMDRJISBY-BZUAXINKSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C)Cc2ccc(CF)cc2)CC1 ZINC001378932290 1345438128 /nfs/dbraw/zinc/43/81/28/1345438128.db2.gz MQCIQBSWZQMAJQ-UHFFFAOYSA-N 1 3 349.494 2.919 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C)Cc2ccc(CF)cc2)CC1 ZINC001378932290 1345438131 /nfs/dbraw/zinc/43/81/31/1345438131.db2.gz MQCIQBSWZQMAJQ-UHFFFAOYSA-N 1 3 349.494 2.919 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C[NH2+]Cc1ccc(C)c(C)c1)C1CC1)N(C)C ZINC001379025766 1345507404 /nfs/dbraw/zinc/50/74/04/1345507404.db2.gz WEYHEJUWIOUPNX-UXHICEINSA-N 1 3 345.531 2.970 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@@H](C[NH2+]CC2CCCCC2)C2CC2)C1 ZINC001379032013 1345513459 /nfs/dbraw/zinc/51/34/59/1345513459.db2.gz OMYLFRCROMXSKA-APWZRJJASA-N 1 3 335.536 2.735 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@H]2C[NH2+]CC2CC(C)(C)C2)CCC1 ZINC001379156683 1345632183 /nfs/dbraw/zinc/63/21/83/1345632183.db2.gz QQTFQHRQMGQVGP-IRXDYDNUSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(C2CC2)cc1)N(C)C ZINC001379222622 1345667248 /nfs/dbraw/zinc/66/72/48/1345667248.db2.gz CANHJNHRZXDEKG-DNVCBOLYSA-N 1 3 331.504 2.841 10 0 EFAEHO C[C@H](C[NH2+]Cc1cc2ccccc2s1)NC(=O)CN1CC[C@@H](C)C1 ZINC001379416747 1345773130 /nfs/dbraw/zinc/77/31/30/1345773130.db2.gz MCFRWNJFFXBKBX-HUUCEWRRSA-N 1 3 345.512 2.837 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001379420653 1345775479 /nfs/dbraw/zinc/77/54/79/1345775479.db2.gz RUYBFYVVSVLJSX-DLBZAZTESA-N 1 3 331.504 2.746 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C ZINC001379446508 1345788554 /nfs/dbraw/zinc/78/85/54/1345788554.db2.gz CMRWKGNYOWKHIC-DNVCBOLYSA-N 1 3 331.504 2.745 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1sccc1Cl ZINC001379509872 1345818512 /nfs/dbraw/zinc/81/85/12/1345818512.db2.gz NMQBZTFHEKWPBD-GXTWGEPZSA-N 1 3 343.924 2.870 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1sccc1Cl ZINC001379509872 1345818515 /nfs/dbraw/zinc/81/85/15/1345818515.db2.gz NMQBZTFHEKWPBD-GXTWGEPZSA-N 1 3 343.924 2.870 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]Cc1ccccc1C(F)(F)F)N(C)C ZINC001379522523 1345826168 /nfs/dbraw/zinc/82/61/68/1345826168.db2.gz PVHRWFPUYANCNZ-SWLSCSKDSA-N 1 3 345.409 2.640 10 0 EFAEHO Cc1ccc(CN[C@H]2CCN(C(=O)CC[NH+](C)C)[C@@H]2C)c(Cl)c1 ZINC001379561479 1345864056 /nfs/dbraw/zinc/86/40/56/1345864056.db2.gz ZMMIQNIIDZDGDR-PBHICJAKSA-N 1 3 337.895 2.679 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]Cc2cc(C)cc(C)c2)C1 ZINC001393909994 1357278548 /nfs/dbraw/zinc/27/85/48/1357278548.db2.gz WOEBGXBYNQYDEW-UHFFFAOYSA-N 1 3 331.504 2.630 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]Cc2cccc(Cl)c2)C1 ZINC001393910358 1357278852 /nfs/dbraw/zinc/27/88/52/1357278852.db2.gz YHJNMXYYWNATCN-UHFFFAOYSA-N 1 3 337.895 2.666 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)[C@H](C)[NH2+]CCc1cccs1 ZINC001393954712 1357319287 /nfs/dbraw/zinc/31/92/87/1357319287.db2.gz GIJFSYYFEJMTDO-GJZGRUSLSA-N 1 3 337.533 2.648 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@@H](C)[NH2+]CCc1cccs1 ZINC001393954715 1357319511 /nfs/dbraw/zinc/31/95/11/1357319511.db2.gz GIJFSYYFEJMTDO-HUUCEWRRSA-N 1 3 337.533 2.648 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001393955619 1357320255 /nfs/dbraw/zinc/32/02/55/1357320255.db2.gz HHZORCBUOVCODZ-HUUCEWRRSA-N 1 3 335.467 2.683 10 0 EFAEHO COc1cccc([C@H](C)N(C)C[C@H](C)NC(=O)C2(C[NH+](C)C)CC2)c1 ZINC001379723971 1347286957 /nfs/dbraw/zinc/28/69/57/1347286957.db2.gz NVNGAJBHAQKHFC-HOTGVXAUSA-N 1 3 347.503 2.535 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+][C@@H]2CCc3ccccc32)C(C)(C)C1 ZINC001379730153 1347292326 /nfs/dbraw/zinc/29/23/26/1347292326.db2.gz MFIDTCYAIOWPOJ-RTBURBONSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]CC1CCC(F)(F)CC1)C1CC1)N(C)C ZINC001379877378 1347383063 /nfs/dbraw/zinc/38/30/63/1347383063.db2.gz XPRWNKNGANGXHW-JKSUJKDBSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001379911323 1347401649 /nfs/dbraw/zinc/40/16/49/1347401649.db2.gz YARPEOZQWKFNKV-UXHICEINSA-N 1 3 343.515 2.934 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]Cc1cccc(Cl)c1)C1CC1 ZINC001379922169 1347406013 /nfs/dbraw/zinc/40/60/13/1347406013.db2.gz QTQVPITYAKCWMH-KRWDZBQOSA-N 1 3 337.895 2.665 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)[C@H](C)NCc1cccc(Cl)c1F ZINC001393984913 1357352199 /nfs/dbraw/zinc/35/21/99/1357352199.db2.gz FMZHPNUXACNCDC-STQMWFEESA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)[C@H](C)NCc1cccc(Cl)c1F ZINC001393984913 1357352203 /nfs/dbraw/zinc/35/22/03/1357352203.db2.gz FMZHPNUXACNCDC-STQMWFEESA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccc2cc[nH]c2c1)C(=O)CC[NH+](C)C ZINC001380027599 1347469395 /nfs/dbraw/zinc/46/93/95/1347469395.db2.gz CJGDMNQACRNLFR-UHFFFAOYSA-N 1 3 344.503 2.788 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CC[C@@H](C)F)C(=O)CN1CCC(C)CC1 ZINC001380037048 1347476173 /nfs/dbraw/zinc/47/61/73/1347476173.db2.gz UPXFTGHSVFZJMA-QGZVFWFLSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)N(CC[N@H+](C)CC[C@@H](C)F)C(=O)CN1CCC(C)CC1 ZINC001380037048 1347476174 /nfs/dbraw/zinc/47/61/74/1347476174.db2.gz UPXFTGHSVFZJMA-QGZVFWFLSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)CCN(C(=O)CN1CCC(C)CC1)C(C)C ZINC001380038137 1347477400 /nfs/dbraw/zinc/47/74/00/1347477400.db2.gz YLXHGBSOOYTYTF-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)CCN(C(=O)CN1CCC(C)CC1)C(C)C ZINC001380038137 1347477403 /nfs/dbraw/zinc/47/74/03/1347477403.db2.gz YLXHGBSOOYTYTF-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC001380085245 1347509163 /nfs/dbraw/zinc/50/91/63/1347509163.db2.gz QCHQUEKRMYYZBC-GJZGRUSLSA-N 1 3 343.462 2.533 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C1CC[NH+](CC2CCCC2)CC1)N(C)C ZINC001380146644 1347533859 /nfs/dbraw/zinc/53/38/59/1347533859.db2.gz QWDOVVOAIKHQDT-QFBILLFUSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+][C@H](C)c2ccc(Cl)cc2)CC1)N(C)C ZINC001380159651 1347540466 /nfs/dbraw/zinc/54/04/66/1347540466.db2.gz GSFXDXVJTSZETM-CJNGLKHVSA-N 1 3 337.895 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2cc3ccccc3s2)CC1 ZINC001380172349 1347547454 /nfs/dbraw/zinc/54/74/54/1347547454.db2.gz SDATURDLNYXBNJ-UHFFFAOYSA-N 1 3 345.512 2.980 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2ccc(Cl)s2)C1)N(C)C ZINC001380175905 1347550184 /nfs/dbraw/zinc/55/01/84/1347550184.db2.gz HDJLPLVLIQRMDC-ORHYLEIMSA-N 1 3 343.924 2.821 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CC([NH2+]Cc2cc(C)ccc2F)C1 ZINC001380179156 1347552698 /nfs/dbraw/zinc/55/26/98/1347552698.db2.gz YRUDUPQVTMLNEC-UHFFFAOYSA-N 1 3 335.467 2.555 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C1CC([NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001380179693 1347553248 /nfs/dbraw/zinc/55/32/48/1347553248.db2.gz WNFYKWNNDSDBGK-ABHNRTSZSA-N 1 3 335.536 2.732 10 0 EFAEHO CN(CC(=O)N1CC[C@@](C)(C[NH2+]Cc2ccsc2)C1)C1CCC1 ZINC001380394720 1347644221 /nfs/dbraw/zinc/64/42/21/1347644221.db2.gz DUFKTNMGCRSTGV-SFHVURJKSA-N 1 3 335.517 2.561 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2csc(C)c2)C1)N(C)C ZINC001380411191 1347653859 /nfs/dbraw/zinc/65/38/59/1347653859.db2.gz WGXNEUOMQABWAC-AEFFLSMTSA-N 1 3 337.533 2.725 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@](C)(C[NH2+]C[C@H]2CCC(F)(F)C2)C1 ZINC001380422421 1347660596 /nfs/dbraw/zinc/66/05/96/1347660596.db2.gz KDOMZUGQQCBFCR-RDJZCZTQSA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1ccccc1C1CC1 ZINC001394001631 1357372820 /nfs/dbraw/zinc/37/28/20/1357372820.db2.gz MHFFIDZVTSSEDE-JKSUJKDBSA-N 1 3 331.504 2.887 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001380679420 1347808340 /nfs/dbraw/zinc/80/83/40/1347808340.db2.gz OXMGNRCYSUNFDU-UYAOXDASSA-N 1 3 345.531 2.970 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001380687453 1347814436 /nfs/dbraw/zinc/81/44/36/1347814436.db2.gz LRMAUCGCPPYRPB-XLIONFOSSA-N 1 3 345.531 2.773 10 0 EFAEHO CCC[NH+]1CCC(N(Cc2ccccn2)C(=O)[C@@H](CC)N(C)C)CC1 ZINC001380703914 1347823818 /nfs/dbraw/zinc/82/38/18/1347823818.db2.gz DRJVQSMSJLPLLP-LJQANCHMSA-N 1 3 346.519 2.625 10 0 EFAEHO Cc1ccc(C[N@@H+]2C[C@H]3CN(C(=O)CN(C)C(C)C)C[C@H]3C2)cc1C ZINC001380706330 1347825994 /nfs/dbraw/zinc/82/59/94/1347825994.db2.gz VVUNIINASDWESL-BGYRXZFFSA-N 1 3 343.515 2.534 10 0 EFAEHO Cc1ccc(C[N@H+]2C[C@H]3CN(C(=O)CN(C)C(C)C)C[C@H]3C2)cc1C ZINC001380706330 1347825998 /nfs/dbraw/zinc/82/59/98/1347825998.db2.gz VVUNIINASDWESL-BGYRXZFFSA-N 1 3 343.515 2.534 10 0 EFAEHO C[C@H](F)CC[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CCC1 ZINC001380882391 1347934555 /nfs/dbraw/zinc/93/45/55/1347934555.db2.gz SDSXDUVDBKCNEZ-KBXCAEBGSA-N 1 3 345.478 2.576 10 0 EFAEHO C[C@H](F)CC[NH2+]C1CCC(N(C)C(=O)C2(N(C)C)CCC2)CC1 ZINC001394007906 1357381093 /nfs/dbraw/zinc/38/10/93/1357381093.db2.gz LASTUJIWQLDONN-FHERZECASA-N 1 3 327.488 2.578 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[N@H+](CC3CC(C)(C)C3)CC2)CCC1 ZINC001380925918 1347958690 /nfs/dbraw/zinc/95/86/90/1347958690.db2.gz AOBBABAQWMKIBZ-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[N@@H+](CC3CC(C)(C)C3)CC2)CCC1 ZINC001380925918 1347958695 /nfs/dbraw/zinc/95/86/95/1347958695.db2.gz AOBBABAQWMKIBZ-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(CCC[N@H+](C)C[C@H]1CCCC(F)(F)C1)C(=O)[C@H]1CCCN1C ZINC001380948265 1347977465 /nfs/dbraw/zinc/97/74/65/1347977465.db2.gz KDKKLHNFZGZYRU-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1)C(=O)[C@H]1CCCN1C ZINC001380948265 1347977470 /nfs/dbraw/zinc/97/74/70/1347977470.db2.gz KDKKLHNFZGZYRU-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@@H]1CCC[N@@H+]1C)CCC(F)(F)F ZINC001380959235 1347986086 /nfs/dbraw/zinc/98/60/86/1347986086.db2.gz VJRRTULXMJRTLV-AWEZNQCLSA-N 1 3 337.430 2.594 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@@H]1CCC[N@H+]1C)CCC(F)(F)F ZINC001380959235 1347986089 /nfs/dbraw/zinc/98/60/89/1347986089.db2.gz VJRRTULXMJRTLV-AWEZNQCLSA-N 1 3 337.430 2.594 10 0 EFAEHO CCC1([NH2+]CC[C@H](C)F)CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001381020991 1348022956 /nfs/dbraw/zinc/02/29/56/1348022956.db2.gz UBLGXDSOUXSLMM-HNNXBMFYSA-N 1 3 327.488 2.580 10 0 EFAEHO CCC1([NH2+]CC2CC(C)C2)CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001381020895 1348023236 /nfs/dbraw/zinc/02/32/36/1348023236.db2.gz SFMUSVDTYGZYBH-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO CCC1([NH2+]CCC2CC2)CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001381025028 1348026552 /nfs/dbraw/zinc/02/65/52/1348026552.db2.gz INFYJKZXOKVNIP-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)CC[NH2+][C@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@H]1C ZINC001381126920 1348094431 /nfs/dbraw/zinc/09/44/31/1348094431.db2.gz ZKSWUOXGQQUFPO-APWZRJJASA-N 1 3 331.504 2.844 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381135339 1348101610 /nfs/dbraw/zinc/10/16/10/1348101610.db2.gz QGACPZSXQOMKES-SJORKVTESA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381135339 1348101612 /nfs/dbraw/zinc/10/16/12/1348101612.db2.gz QGACPZSXQOMKES-SJORKVTESA-N 1 3 325.541 2.835 10 0 EFAEHO Cc1ccncc1C[NH2+][C@@H](C)CCNC(=O)[C@@H]1CCCCN1C(C)C ZINC001381221022 1348148540 /nfs/dbraw/zinc/14/85/40/1348148540.db2.gz NQAUVLQUZCMHMU-HKUYNNGSSA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC001381233742 1348157783 /nfs/dbraw/zinc/15/77/83/1348157783.db2.gz LCSHOISINWLQSK-KBPBESRZSA-N 1 3 341.446 2.850 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]CC=C(Cl)Cl ZINC001381237587 1348159406 /nfs/dbraw/zinc/15/94/06/1348159406.db2.gz GROUQHJMIDCJAE-STQMWFEESA-N 1 3 336.307 2.664 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]CCc1ccc(C)cc1 ZINC001381238029 1348159667 /nfs/dbraw/zinc/15/96/67/1348159667.db2.gz JCAHREUYFUOFBX-AZUAARDMSA-N 1 3 345.531 2.896 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C[N@H+](CC)CC[C@H](C)F)CC1)N(C)C ZINC001381258903 1348168635 /nfs/dbraw/zinc/16/86/35/1348168635.db2.gz WCWIYYQYPPVKKD-RDJZCZTQSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C[N@@H+](CC)CC[C@H](C)F)CC1)N(C)C ZINC001381258903 1348168637 /nfs/dbraw/zinc/16/86/37/1348168637.db2.gz WCWIYYQYPPVKKD-RDJZCZTQSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](F)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1CCCC[N@@H+]1C ZINC001381277629 1348181580 /nfs/dbraw/zinc/18/15/80/1348181580.db2.gz URGZWRSNFWNQPV-OQIJWPOYSA-N 1 3 347.478 2.591 10 0 EFAEHO CC[C@@H](F)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1CCCC[N@H+]1C ZINC001381277629 1348181583 /nfs/dbraw/zinc/18/15/83/1348181583.db2.gz URGZWRSNFWNQPV-OQIJWPOYSA-N 1 3 347.478 2.591 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[N@H+](C)CCc1ccccc1F)N(C)C ZINC001381296435 1348195397 /nfs/dbraw/zinc/19/53/97/1348195397.db2.gz XUYBBKYPYIPUFD-PKOBYXMFSA-N 1 3 349.494 2.631 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[N@@H+](C)CCc1ccccc1F)N(C)C ZINC001381296435 1348195401 /nfs/dbraw/zinc/19/54/01/1348195401.db2.gz XUYBBKYPYIPUFD-PKOBYXMFSA-N 1 3 349.494 2.631 10 0 EFAEHO Cc1ccccc1C[NH2+]CC1CC(NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001381330611 1348212460 /nfs/dbraw/zinc/21/24/60/1348212460.db2.gz GRUKERRDTHGROD-KVZIAJEVSA-N 1 3 331.504 2.566 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)[C@@H](C(C)C)N(C)C)C2)c(C)c1 ZINC001381333823 1348213390 /nfs/dbraw/zinc/21/33/90/1348213390.db2.gz ZVEVNEOAYPMSOL-LYBXBRPPSA-N 1 3 345.531 2.874 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CC1CC(NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001381332819 1348213468 /nfs/dbraw/zinc/21/34/68/1348213468.db2.gz IHUKOHSTLQJXIF-XUJQIHCRSA-N 1 3 349.494 2.705 10 0 EFAEHO CCc1ccc(C[NH2+]CC2CC(NC(=O)[C@H](CC)N(C)C)C2)cc1 ZINC001381336752 1348214293 /nfs/dbraw/zinc/21/42/93/1348214293.db2.gz BWNYJFHTPKVUAT-ACBHZAAOSA-N 1 3 331.504 2.574 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)CN(C)C(C)C)C2)cc1C ZINC001381341603 1348216352 /nfs/dbraw/zinc/21/63/52/1348216352.db2.gz MITGNWXEKATLIS-UHFFFAOYSA-N 1 3 331.504 2.628 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCCC1)[C@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001381369121 1348227843 /nfs/dbraw/zinc/22/78/43/1348227843.db2.gz FCMXNCAWTUMWGK-UONOGXRCSA-N 1 3 345.478 2.779 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]C/C=C\c1ccccc1 ZINC001381394960 1348240031 /nfs/dbraw/zinc/24/00/31/1348240031.db2.gz RNFICWVVUCULAI-BEBBCNLGSA-N 1 3 329.488 2.667 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)cc1C ZINC001381397478 1348241931 /nfs/dbraw/zinc/24/19/31/1348241931.db2.gz UDWJLDBGKSRCBY-IRXDYDNUSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(CN[C@H](C)[C@@H](C)NC(=O)CCC[NH+](C)C)c(Cl)c1 ZINC001381413963 1348255919 /nfs/dbraw/zinc/25/59/19/1348255919.db2.gz IYWUQJCCVAOXER-HUUCEWRRSA-N 1 3 339.911 2.973 10 0 EFAEHO C[C@@H](NCc1cccnc1)[C@H](C)NC(=O)CC[N@H+](C)C1CCCCC1 ZINC001381420469 1348260743 /nfs/dbraw/zinc/26/07/43/1348260743.db2.gz YSSAMCPMTGXCHJ-SJORKVTESA-N 1 3 346.519 2.719 10 0 EFAEHO C[C@@H](NCc1cccnc1)[C@H](C)NC(=O)CC[N@@H+](C)C1CCCCC1 ZINC001381420469 1348260747 /nfs/dbraw/zinc/26/07/47/1348260747.db2.gz YSSAMCPMTGXCHJ-SJORKVTESA-N 1 3 346.519 2.719 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CCC([NH2+]Cc2ccsc2)CC1)N(C)C ZINC001381458356 1348288967 /nfs/dbraw/zinc/28/89/67/1348288967.db2.gz NYNQQMGMVWDMSR-OFLPRAFFSA-N 1 3 337.533 2.948 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@H](C)CNC(=O)[C@H]1CCC[N@H+]1C(C)C ZINC001381513738 1348323015 /nfs/dbraw/zinc/32/30/15/1348323015.db2.gz FDKBAFJQZXATFM-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@H](C)CNC(=O)[C@H]1CCC[N@@H+]1C(C)C ZINC001381513738 1348323017 /nfs/dbraw/zinc/32/30/17/1348323017.db2.gz FDKBAFJQZXATFM-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H](C)[N@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001381529673 1348332897 /nfs/dbraw/zinc/33/28/97/1348332897.db2.gz IVSDEWADQYYDOS-WMZOPIPTSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H](C)[N@@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001381529673 1348332901 /nfs/dbraw/zinc/33/29/01/1348332901.db2.gz IVSDEWADQYYDOS-WMZOPIPTSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@H](CNC(=O)C1(C[NH+](C)C)CC1)N(C)Cc1ccc(C2CC2)cc1 ZINC001381578285 1348374085 /nfs/dbraw/zinc/37/40/85/1348374085.db2.gz SGDICEODWWOCOR-MRXNPFEDSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@H+](C)CCc1ccc(Cl)cc1)N(C)C ZINC001381602190 1348394666 /nfs/dbraw/zinc/39/46/66/1348394666.db2.gz BYWCZOROBBPHLE-RHSMWYFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@@H+](C)CCc1ccc(Cl)cc1)N(C)C ZINC001381602190 1348394669 /nfs/dbraw/zinc/39/46/69/1348394669.db2.gz BYWCZOROBBPHLE-RHSMWYFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)[C@H]3CCCCN3C(C)C)[C@@H]2C1 ZINC001381904387 1348598357 /nfs/dbraw/zinc/59/83/57/1348598357.db2.gz IROJDAVCHARYDW-YSTOQKLRSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)[C@H]3CCCCN3C(C)C)[C@@H]2C1 ZINC001381904387 1348598360 /nfs/dbraw/zinc/59/83/60/1348598360.db2.gz IROJDAVCHARYDW-YSTOQKLRSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[C@@H](C[NH2+]CC2CCC(C)CC2)C1)N(C)C ZINC001381969249 1348630387 /nfs/dbraw/zinc/63/03/87/1348630387.db2.gz UQMNXEIBBLGHLI-CPLYBDICSA-N 1 3 337.552 2.883 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N(C)C[C@@H](C)NCc1ccccc1F ZINC001382089350 1348711049 /nfs/dbraw/zinc/71/10/49/1348711049.db2.gz YTIHTSQSWQSHKF-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N(C)C[C@@H](C)NCc1ccccc1F ZINC001382089350 1348711052 /nfs/dbraw/zinc/71/10/52/1348711052.db2.gz YTIHTSQSWQSHKF-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CCc1ccc(CC[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001382131434 1348752201 /nfs/dbraw/zinc/75/22/01/1348752201.db2.gz ZFPRCVNWACPODI-QZTJIDSGSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC001382170530 1348791383 /nfs/dbraw/zinc/79/13/83/1348791383.db2.gz XXWWPNZLROBDBZ-UONOGXRCSA-N 1 3 341.446 2.803 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)[C@@H]1C ZINC001382308323 1348858874 /nfs/dbraw/zinc/85/88/74/1348858874.db2.gz NVVIMEWDDGSQLE-CRAIPNDOSA-N 1 3 335.467 2.553 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CC3CCCC3)[C@H]2C1 ZINC001382324044 1348875066 /nfs/dbraw/zinc/87/50/66/1348875066.db2.gz BPLMAKDSUZDYQW-GBESFXJTSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1cccc(C[N@@H+](C)[C@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001394062227 1357431564 /nfs/dbraw/zinc/43/15/64/1357431564.db2.gz YXOFRVLYCNVZGN-MJGOQNOKSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1cccc(C[N@H+](C)[C@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001394062227 1357431568 /nfs/dbraw/zinc/43/15/68/1357431568.db2.gz YXOFRVLYCNVZGN-MJGOQNOKSA-N 1 3 331.504 2.804 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@H](NCc2sccc2Cl)C(C)(C)C1 ZINC001382369958 1348920384 /nfs/dbraw/zinc/92/03/84/1348920384.db2.gz PRPRBVXKLYRTCP-AWEZNQCLSA-N 1 3 343.924 2.680 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)c1 ZINC001382385088 1348926547 /nfs/dbraw/zinc/92/65/47/1348926547.db2.gz NWDSPFICBXJBKZ-LJQANCHMSA-N 1 3 345.531 2.916 10 0 EFAEHO Cc1cccc(CN(C)CCN(C(=O)C23CC[NH+](CC2)C3)C(C)C)c1 ZINC001382504470 1348971070 /nfs/dbraw/zinc/97/10/70/1348971070.db2.gz DVVKNXKTAOLLTC-UHFFFAOYSA-N 1 3 343.515 2.760 10 0 EFAEHO CC(C)N(CC[N@H+](C)CCc1ccccc1)C(=O)CN1CC[C@H](C)C1 ZINC001382505917 1348972787 /nfs/dbraw/zinc/97/27/87/1348972787.db2.gz KZFYOSCHGNIQGG-IBGZPJMESA-N 1 3 345.531 2.740 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CCc1ccccc1)C(=O)CN1CC[C@H](C)C1 ZINC001382505917 1348972791 /nfs/dbraw/zinc/97/27/91/1348972791.db2.gz KZFYOSCHGNIQGG-IBGZPJMESA-N 1 3 345.531 2.740 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@H](CNCc1ccccn1)C(C)(C)C ZINC001382538964 1349005213 /nfs/dbraw/zinc/00/52/13/1349005213.db2.gz YEPQPDQZYKPJCX-ZWKOTPCHSA-N 1 3 346.519 2.577 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@H](CNCc1ccccn1)C(C)(C)C ZINC001382538964 1349005217 /nfs/dbraw/zinc/00/52/17/1349005217.db2.gz YEPQPDQZYKPJCX-ZWKOTPCHSA-N 1 3 346.519 2.577 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)[NH+]1CCCC1)C1CCN(C/C=C\Cl)CC1 ZINC001382560001 1349020302 /nfs/dbraw/zinc/02/03/02/1349020302.db2.gz OFTIXRLCWLAOCQ-AJHXJQRKSA-N 1 3 341.927 2.830 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)CN1CCCC1)[NH2+]Cc1ccccc1 ZINC001394180205 1357556918 /nfs/dbraw/zinc/55/69/18/1357556918.db2.gz AMTKGEUMJXDHBY-IBGZPJMESA-N 1 3 331.504 2.745 10 0 EFAEHO CC[C@H](C(=O)NC1(C[NH2+]Cc2cnccc2C)CCCCC1)N(C)C ZINC001394190102 1357571496 /nfs/dbraw/zinc/57/14/96/1357571496.db2.gz UUSMATCTYICSRW-GOSISDBHSA-N 1 3 346.519 2.639 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](CCCc2ccccc2C)C1)N(C)C ZINC001394232007 1357621702 /nfs/dbraw/zinc/62/17/02/1357621702.db2.gz VOYFNTARTWQFLB-FXAWDEMLSA-N 1 3 345.531 2.704 10 0 EFAEHO CN(C[C@H]1CCN1CC/C=C\c1ccccc1)C(=O)[C@H]1CC[N@H+](C)C1 ZINC001388662631 1352903743 /nfs/dbraw/zinc/90/37/43/1352903743.db2.gz OXKGYTNGNMBWPY-ZHJYEMEWSA-N 1 3 341.499 2.574 10 0 EFAEHO CN(C[C@H]1CCN1CC/C=C\c1ccccc1)C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001388662631 1352903747 /nfs/dbraw/zinc/90/37/47/1352903747.db2.gz OXKGYTNGNMBWPY-ZHJYEMEWSA-N 1 3 341.499 2.574 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CCc2ccccc2F)C1)N(C)C ZINC001388756906 1352983040 /nfs/dbraw/zinc/98/30/40/1352983040.db2.gz LWVLRNYUFOCYNC-WDYCEAGBSA-N 1 3 349.494 2.583 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[C@@H]2CCC[N@@H+]2C)CCN1CCC(F)(F)F ZINC001388771182 1352997077 /nfs/dbraw/zinc/99/70/77/1352997077.db2.gz IEUSXPHUCNBOMW-SOUVJXGZSA-N 1 3 349.441 2.782 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[C@@H]2CCC[N@H+]2C)CCN1CCC(F)(F)F ZINC001388771182 1352997078 /nfs/dbraw/zinc/99/70/78/1352997078.db2.gz IEUSXPHUCNBOMW-SOUVJXGZSA-N 1 3 349.441 2.782 10 0 EFAEHO CCc1ccc(CN2CC[C@H](NC(=O)[C@@H](C(C)C)[NH+](C)C)[C@H]2C)cc1 ZINC001388783217 1353008796 /nfs/dbraw/zinc/00/87/96/1353008796.db2.gz HHJXNKGAEHCWOZ-LSTHTHJFSA-N 1 3 345.531 2.914 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2csc(C)c2)[C@@H]1C ZINC001388783077 1353009612 /nfs/dbraw/zinc/00/96/12/1353009612.db2.gz DMAVVKOLXNIOLE-WBVHZDCISA-N 1 3 337.533 2.867 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2csc(C)c2)[C@@H]1C ZINC001388783077 1353009620 /nfs/dbraw/zinc/00/96/20/1353009620.db2.gz DMAVVKOLXNIOLE-WBVHZDCISA-N 1 3 337.533 2.867 10 0 EFAEHO CCCN(C)CC(=O)N1CCCCC[C@H]([NH2+]CC2CC(F)(F)C2)C1 ZINC001388808651 1353040509 /nfs/dbraw/zinc/04/05/09/1353040509.db2.gz VDGUZCONMDYWPY-INIZCTEOSA-N 1 3 345.478 2.734 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CN(Cc2ccc(C3CC3)cc2)CC1(C)C ZINC001394288831 1357675719 /nfs/dbraw/zinc/67/57/19/1357675719.db2.gz RKUMJQBDVPRIGZ-LJQANCHMSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CN(Cc2ccccc2)CC1(C)C)[NH+](C)C ZINC001394298552 1357683849 /nfs/dbraw/zinc/68/38/49/1357683849.db2.gz DRWWZKGIDYUMBW-ROUUACIJSA-N 1 3 331.504 2.599 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CN(Cc2ccccc2)CC1(C)C)[NH+](C)C ZINC001394298526 1357684152 /nfs/dbraw/zinc/68/41/52/1357684152.db2.gz DRWWZKGIDYUMBW-MSOLQXFVSA-N 1 3 331.504 2.599 10 0 EFAEHO C[C@H](F)CCN1CCC[C@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001389375980 1353344810 /nfs/dbraw/zinc/34/48/10/1353344810.db2.gz OEDFEWNABLHLRD-HOTGVXAUSA-N 1 3 341.515 2.968 10 0 EFAEHO C[C@H](F)CCN1CCC[C@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001389375980 1353344818 /nfs/dbraw/zinc/34/48/18/1353344818.db2.gz OEDFEWNABLHLRD-HOTGVXAUSA-N 1 3 341.515 2.968 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCCN(Cc2ccc(C3CCC3)cc2)C1 ZINC001389394602 1353362446 /nfs/dbraw/zinc/36/24/46/1353362446.db2.gz VAXLVEMIFOUZDJ-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c(C)c1 ZINC001389462986 1353408351 /nfs/dbraw/zinc/40/83/51/1353408351.db2.gz QVMRNAOIFOYACW-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c(C)c1 ZINC001389462986 1353408353 /nfs/dbraw/zinc/40/83/53/1353408353.db2.gz QVMRNAOIFOYACW-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1CCN(Cc2cc3ccccc3s2)C1 ZINC001389481285 1353419993 /nfs/dbraw/zinc/41/99/93/1353419993.db2.gz MGGSVXOLESKPMR-INIZCTEOSA-N 1 3 345.512 2.934 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC12CC[NH+](Cc1ccc(C)cc1)CC2)N(C)C ZINC001389518523 1353447484 /nfs/dbraw/zinc/44/74/84/1353447484.db2.gz JATYZNXRBRPFML-RTBURBONSA-N 1 3 343.515 2.806 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1csc(C)c1)C1CC1 ZINC001389604606 1353504007 /nfs/dbraw/zinc/50/40/07/1353504007.db2.gz ISQRARCQJYAVSV-ZWKOTPCHSA-N 1 3 349.544 2.915 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](NCc1ccccc1F)C1CC1 ZINC001389604297 1353504126 /nfs/dbraw/zinc/50/41/26/1353504126.db2.gz FKEMUFIGEFVZQF-RBUKOAKNSA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NC[C@H](NCc1ccccc1F)C1CC1 ZINC001389604297 1353504130 /nfs/dbraw/zinc/50/41/30/1353504130.db2.gz FKEMUFIGEFVZQF-RBUKOAKNSA-N 1 3 347.478 2.683 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](CNC(=O)[C@H]1CCCN1C(C)C)C1CC1 ZINC001389612348 1353510335 /nfs/dbraw/zinc/51/03/35/1353510335.db2.gz PSRDUXCTTUKUJH-VQTJNVASSA-N 1 3 343.515 2.852 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](CNC(=O)C(C)(C)N1CCCC1)C1CC1 ZINC001389640181 1353526924 /nfs/dbraw/zinc/52/69/24/1353526924.db2.gz CGGFYALLUPIJDA-IBGZPJMESA-N 1 3 343.515 2.854 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]([NH2+]CCc1ccccc1)C1CC1)N1CCCC1 ZINC001389664036 1353538980 /nfs/dbraw/zinc/53/89/80/1353538980.db2.gz QBTCNWOJJMNYMJ-LJQANCHMSA-N 1 3 343.515 2.588 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3CCCC3)C[C@H]21)N1CCCC1 ZINC001394322013 1357700368 /nfs/dbraw/zinc/70/03/68/1357700368.db2.gz YNLXTAICSQVTMQ-LDLYASANSA-N 1 3 347.547 2.735 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3CCCC3)C[C@H]21)N1CCCC1 ZINC001394322013 1357700375 /nfs/dbraw/zinc/70/03/75/1357700375.db2.gz YNLXTAICSQVTMQ-LDLYASANSA-N 1 3 347.547 2.735 10 0 EFAEHO CC(C)(C(=O)NC[C@H](NCc1ccccc1F)C1CC1)[NH+]1CCCC1 ZINC001389673621 1353544684 /nfs/dbraw/zinc/54/46/84/1353544684.db2.gz XDQBGBQNLLBJNP-SFHVURJKSA-N 1 3 347.478 2.685 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1ccccc1F)C1CC1 ZINC001389689906 1353556973 /nfs/dbraw/zinc/55/69/73/1353556973.db2.gz NGINFPXWXYGQHG-RBUKOAKNSA-N 1 3 347.478 2.685 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC(C)(C)C)C[C@H]21)N1CCCCCC1 ZINC001394334032 1357709520 /nfs/dbraw/zinc/70/95/20/1357709520.db2.gz MUDNGRSDZQSECJ-MKXGPGLRSA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCC(C)(C)C)C[C@H]21)N1CCCCCC1 ZINC001394334032 1357709524 /nfs/dbraw/zinc/70/95/24/1357709524.db2.gz MUDNGRSDZQSECJ-MKXGPGLRSA-N 1 3 349.563 2.981 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001389901489 1353677012 /nfs/dbraw/zinc/67/70/12/1353677012.db2.gz RWHYYFKIYRTQFA-PCODUJHASA-N 1 3 347.503 2.579 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@H+](CC3CCCC3)CC[C@H]21 ZINC001389946976 1353704664 /nfs/dbraw/zinc/70/46/64/1353704664.db2.gz FXQODFXDYHTRPU-RTBURBONSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@@H+](CC3CCCC3)CC[C@H]21 ZINC001389946976 1353704667 /nfs/dbraw/zinc/70/46/67/1353704667.db2.gz FXQODFXDYHTRPU-RTBURBONSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(F)c2)C1)N(C)C ZINC001390012180 1353742510 /nfs/dbraw/zinc/74/25/10/1353742510.db2.gz QVIJNILZOYXSBS-RUGDWHBFSA-N 1 3 335.467 2.710 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CCC[N@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001390064932 1353778770 /nfs/dbraw/zinc/77/87/70/1353778770.db2.gz MDTCCDZMQNEENG-MSOLQXFVSA-N 1 3 347.547 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CCC[N@@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001390064932 1353778773 /nfs/dbraw/zinc/77/87/73/1353778773.db2.gz MDTCCDZMQNEENG-MSOLQXFVSA-N 1 3 347.547 2.737 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[NH2+]C[C@@H]2CCC(F)(F)C2)C1 ZINC001390099853 1353804351 /nfs/dbraw/zinc/80/43/51/1353804351.db2.gz BHTOKGWKGCUJIY-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[NH2+]C[C@H]2CCC(F)(F)C2)C1 ZINC001390099859 1353804373 /nfs/dbraw/zinc/80/43/73/1353804373.db2.gz BHTOKGWKGCUJIY-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCC[C@@H]1[C@@H]1CCCN1C/C=C/Cl ZINC001390179022 1353899102 /nfs/dbraw/zinc/89/91/02/1353899102.db2.gz ZHULNMACTNODNL-JHCSKLMMSA-N 1 3 327.900 2.536 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)cc1F ZINC001394727573 1358053100 /nfs/dbraw/zinc/05/31/00/1358053100.db2.gz VAQBBMRVNUKLSD-SFHVURJKSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1CCC(NC(=O)C(C)(C)N2CCCC2)CC1 ZINC001390280739 1353975310 /nfs/dbraw/zinc/97/53/10/1353975310.db2.gz WSXICQCFCDRVHA-QQFBHYJXSA-N 1 3 327.488 2.626 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CCC([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC001390283283 1353976487 /nfs/dbraw/zinc/97/64/87/1353976487.db2.gz RZPSMRMAQTVQFD-QQFBHYJXSA-N 1 3 345.478 2.779 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCCC1)[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001390371956 1354040513 /nfs/dbraw/zinc/04/05/13/1354040513.db2.gz GRGWQXNHGRAKJZ-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001390397560 1354062955 /nfs/dbraw/zinc/06/29/55/1354062955.db2.gz GLWROARVUAYWPW-GDBMZVCRSA-N 1 3 345.478 2.781 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1cccc(CC)c1 ZINC001390410293 1354070250 /nfs/dbraw/zinc/07/02/50/1354070250.db2.gz WJXXXHKMDGLICP-QFBILLFUSA-N 1 3 331.504 2.718 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001390530830 1354153032 /nfs/dbraw/zinc/15/30/32/1354153032.db2.gz DNZBFQLGJPESDJ-KBXCAEBGSA-N 1 3 335.467 2.638 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CC[C@H]([NH2+]C/C=C\c2ccccc2)C1 ZINC001390555580 1354169617 /nfs/dbraw/zinc/16/96/17/1354169617.db2.gz BYAGLXCCWLCWNZ-ULNHMINQSA-N 1 3 347.478 2.570 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+][C@H]2CCCc3ccccc32)C1 ZINC001390573880 1354181702 /nfs/dbraw/zinc/18/17/02/1354181702.db2.gz GBTSATDTUNPMKF-HKUYNNGSSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@@H](CCNC(=O)[C@@H]1CCCN1C)[NH2+]Cc1cc(Cl)ccc1F ZINC001390647608 1354245202 /nfs/dbraw/zinc/24/52/02/1354245202.db2.gz QIRVGRXSVFAFMW-LRDDRELGSA-N 1 3 341.858 2.558 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001390699621 1354291351 /nfs/dbraw/zinc/29/13/51/1354291351.db2.gz BGYLKSQDNLHQDQ-IRXDYDNUSA-N 1 3 343.515 2.502 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccccc1C1CC1 ZINC001390699306 1354291569 /nfs/dbraw/zinc/29/15/69/1354291569.db2.gz AJGWDVCKPIPZCD-IRXDYDNUSA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccccc1Cl ZINC001390699650 1354291585 /nfs/dbraw/zinc/29/15/85/1354291585.db2.gz BODHVSZYXRNLDO-HUUCEWRRSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001390718752 1354311436 /nfs/dbraw/zinc/31/14/36/1354311436.db2.gz ZFJSVIIIWTZUQF-IEBWSBKVSA-N 1 3 333.520 2.936 10 0 EFAEHO C[C@H](c1ccc(Cl)cc1)N(C)CCNC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001390754061 1354341834 /nfs/dbraw/zinc/34/18/34/1354341834.db2.gz FPYYRJVEVMEFTO-RDTXWAMCSA-N 1 3 349.906 2.791 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)c1 ZINC001390777832 1354364473 /nfs/dbraw/zinc/36/44/73/1354364473.db2.gz GSSAFBWYBGFWNV-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)c1 ZINC001390777832 1354364479 /nfs/dbraw/zinc/36/44/79/1354364479.db2.gz GSSAFBWYBGFWNV-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO CN(CC(=O)N1CCCCC[C@@H]([NH2+]C/C=C\Cl)C1)C1CCC1 ZINC001440465636 1389668357 /nfs/dbraw/zinc/66/83/57/1389668357.db2.gz UVVKGRJDNWNJKK-IZIDJEDMSA-N 1 3 327.900 2.584 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@H]2CCC[C@@H]3CCC[N@@H+]32)c1 ZINC001390826150 1354412089 /nfs/dbraw/zinc/41/20/89/1354412089.db2.gz MQQUWVSEVRBEKV-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@H]2CCC[C@@H]3CCC[N@H+]32)c1 ZINC001390826150 1354412092 /nfs/dbraw/zinc/41/20/92/1354412092.db2.gz MQQUWVSEVRBEKV-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C)[C@H]1CCc2ccc(Cl)cc21 ZINC001390865332 1354448183 /nfs/dbraw/zinc/44/81/83/1354448183.db2.gz QMEAUYVDVLRJJL-KRWDZBQOSA-N 1 3 337.895 2.716 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C)[C@H]1CCc2ccc(Cl)cc21 ZINC001390865332 1354448186 /nfs/dbraw/zinc/44/81/86/1354448186.db2.gz QMEAUYVDVLRJJL-KRWDZBQOSA-N 1 3 337.895 2.716 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C)[C@H]1CCc2c1cccc2Cl ZINC001390866888 1354449182 /nfs/dbraw/zinc/44/91/82/1354449182.db2.gz WDKACHFFUNRVTJ-KRWDZBQOSA-N 1 3 337.895 2.716 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C)[C@H]1CCc2c1cccc2Cl ZINC001390866888 1354449184 /nfs/dbraw/zinc/44/91/84/1354449184.db2.gz WDKACHFFUNRVTJ-KRWDZBQOSA-N 1 3 337.895 2.716 10 0 EFAEHO CC[C@H](F)CN1CC[C@H](CNC(=O)CC[N@H+](C)C2CCCCC2)C1 ZINC001391096233 1354789794 /nfs/dbraw/zinc/78/97/94/1354789794.db2.gz INTQRXOOALHFPX-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](F)CN1CC[C@H](CNC(=O)CC[N@@H+](C)C2CCCCC2)C1 ZINC001391096233 1354789796 /nfs/dbraw/zinc/78/97/96/1354789796.db2.gz INTQRXOOALHFPX-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@H+](CCCc2cccc(F)c2)C1)N(C)C ZINC001391105822 1354800509 /nfs/dbraw/zinc/80/05/09/1354800509.db2.gz MFRNCYPQUGTJLY-IEBWSBKVSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@@H+](CCCc2cccc(F)c2)C1)N(C)C ZINC001391105822 1354800516 /nfs/dbraw/zinc/80/05/16/1354800516.db2.gz MFRNCYPQUGTJLY-IEBWSBKVSA-N 1 3 349.494 2.537 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCN(Cc2ccc(F)cc2)C1 ZINC001391108271 1354804877 /nfs/dbraw/zinc/80/48/77/1354804877.db2.gz WEIZXZWBCQNADO-MJGOQNOKSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCN(Cc2ccc(F)cc2)C1 ZINC001391108271 1354804882 /nfs/dbraw/zinc/80/48/82/1354804882.db2.gz WEIZXZWBCQNADO-MJGOQNOKSA-N 1 3 347.478 2.638 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@H+](C2CC2)[C@H]2CCc3ccccc32)CCC1 ZINC001391169816 1354894616 /nfs/dbraw/zinc/89/46/16/1354894616.db2.gz SFTHGQKNMJLDJM-IBGZPJMESA-N 1 3 341.499 2.739 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@@H+](C2CC2)[C@H]2CCc3ccccc32)CCC1 ZINC001391169816 1354894621 /nfs/dbraw/zinc/89/46/21/1354894621.db2.gz SFTHGQKNMJLDJM-IBGZPJMESA-N 1 3 341.499 2.739 10 0 EFAEHO C[C@H](NCCN(C)C(=O)C12CC[NH+](CC1)C2)c1ccccc1Cl ZINC001391232638 1354954552 /nfs/dbraw/zinc/95/45/52/1354954552.db2.gz XDRDIPWHSHFZFV-AWEZNQCLSA-N 1 3 335.879 2.545 10 0 EFAEHO CCCN(C(=O)CC[NH+](C)C)[C@H]1CCN(Cc2ccc(CF)cc2)C1 ZINC001391273309 1355002903 /nfs/dbraw/zinc/00/29/03/1355002903.db2.gz KUDMVUVDTXKDRW-IBGZPJMESA-N 1 3 349.494 2.921 10 0 EFAEHO CN(CC(=O)NCC[C@@H]1CC[N@H+](Cc2ccsc2)C1)C1CCC1 ZINC001391307423 1355049646 /nfs/dbraw/zinc/04/96/46/1355049646.db2.gz FNGRKWBGHMIRPO-OAHLLOKOSA-N 1 3 335.517 2.561 10 0 EFAEHO CN(CC(=O)NCC[C@@H]1CC[N@@H+](Cc2ccsc2)C1)C1CCC1 ZINC001391307423 1355049650 /nfs/dbraw/zinc/04/96/50/1355049650.db2.gz FNGRKWBGHMIRPO-OAHLLOKOSA-N 1 3 335.517 2.561 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@H](C[N@H+](C)CCC(F)(F)F)C1 ZINC001391358319 1355121394 /nfs/dbraw/zinc/12/13/94/1355121394.db2.gz PJVVXWHMWCIEEV-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@H](C[N@@H+](C)CCC(F)(F)F)C1 ZINC001391358319 1355121396 /nfs/dbraw/zinc/12/13/96/1355121396.db2.gz PJVVXWHMWCIEEV-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@H+](CC2CCC2)C1)N1CCCCC1 ZINC001391404371 1355175125 /nfs/dbraw/zinc/17/51/25/1355175125.db2.gz OQLJCELTKRERRR-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@@H+](CC2CCC2)C1)N1CCCCC1 ZINC001391404371 1355175127 /nfs/dbraw/zinc/17/51/27/1355175127.db2.gz OQLJCELTKRERRR-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)(C(=O)NCC1C[NH+](CC2CC(C)(C)C2)C1)N1CCCCC1 ZINC001391481541 1355233795 /nfs/dbraw/zinc/23/37/95/1355233795.db2.gz NORJIZHNIRPGSZ-UHFFFAOYSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@H+](CCC2CCCC2)C1)N1CCCC1 ZINC001391593978 1355334417 /nfs/dbraw/zinc/33/44/17/1355334417.db2.gz FZQXWLVYNIBUKI-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@@H+](CCC2CCCC2)C1)N1CCCC1 ZINC001391593978 1355334422 /nfs/dbraw/zinc/33/44/22/1355334422.db2.gz FZQXWLVYNIBUKI-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](CC)[NH2+]Cc1ccc(F)c(Cl)c1)N(C)C ZINC001391693127 1355439692 /nfs/dbraw/zinc/43/96/92/1355439692.db2.gz BZSAUEZGXJTKQG-XJKSGUPXSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@H](CNC(=O)C12CCC[NH+]1CCC2)NCc1cc(C)ccc1F ZINC001391705087 1355450652 /nfs/dbraw/zinc/45/06/52/1355450652.db2.gz VBCKUZGTYVDNGA-QGZVFWFLSA-N 1 3 347.478 2.747 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001391721384 1355465232 /nfs/dbraw/zinc/46/52/32/1355465232.db2.gz VTBBVOXXCHJLJU-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(Cl)cc1 ZINC001391722271 1355465694 /nfs/dbraw/zinc/46/56/94/1355465694.db2.gz SBRDRDBECIGJBL-PBHICJAKSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)NCc1ccccc1F ZINC001391722584 1355465751 /nfs/dbraw/zinc/46/57/51/1355465751.db2.gz YJFBESBPRJSBGS-ZOBUZTSGSA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)NCc1ccccc1F ZINC001391722584 1355465754 /nfs/dbraw/zinc/46/57/54/1355465754.db2.gz YJFBESBPRJSBGS-ZOBUZTSGSA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)NCc1ccccc1Cl ZINC001391735349 1355479554 /nfs/dbraw/zinc/47/95/54/1355479554.db2.gz KBKLBHNGANELMU-ZBFHGGJFSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)NCc1ccccc1Cl ZINC001391735349 1355479555 /nfs/dbraw/zinc/47/95/55/1355479555.db2.gz KBKLBHNGANELMU-ZBFHGGJFSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@H]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001391827900 1355570863 /nfs/dbraw/zinc/57/08/63/1355570863.db2.gz WTGMMENAHAKJTJ-BZUAXINKSA-N 1 3 329.504 2.729 10 0 EFAEHO CC[C@@H]([NH2+]C[C@H]1CCCN1C(=O)CN1CCCC1)c1ccccc1 ZINC001391862115 1355601833 /nfs/dbraw/zinc/60/18/33/1355601833.db2.gz RLBGWWGGEFGTLZ-RTBURBONSA-N 1 3 329.488 2.814 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@H]1CNCc1cc(C)ccc1F ZINC001391869721 1355608438 /nfs/dbraw/zinc/60/84/38/1355608438.db2.gz GATPPGJUJRKASN-QGZVFWFLSA-N 1 3 335.467 2.557 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@H]1CNCc1cc(C)ccc1F ZINC001391869721 1355608441 /nfs/dbraw/zinc/60/84/41/1355608441.db2.gz GATPPGJUJRKASN-QGZVFWFLSA-N 1 3 335.467 2.557 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@H](C)[NH2+]Cc1ccsc1 ZINC001436676437 1387279430 /nfs/dbraw/zinc/27/94/30/1387279430.db2.gz XKZBYSYKWKETRN-DOTOQJQBSA-N 1 3 337.533 2.949 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001392136312 1355794195 /nfs/dbraw/zinc/79/41/95/1355794195.db2.gz DGMPZLWFMCIUOZ-HUUCEWRRSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)C[C@H](C[NH2+]Cc1ccsc1)NC(=O)CN1CC[C@H](C)C1 ZINC001392174037 1355827927 /nfs/dbraw/zinc/82/79/27/1355827927.db2.gz WYNWMILHZRIWGQ-DOTOQJQBSA-N 1 3 337.533 2.710 10 0 EFAEHO C[C@H](F)CC[N@H+](C)CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001392195247 1355851456 /nfs/dbraw/zinc/85/14/56/1355851456.db2.gz RMGRRVOKSRVEDI-IRXDYDNUSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001392195247 1355851459 /nfs/dbraw/zinc/85/14/59/1355851459.db2.gz RMGRRVOKSRVEDI-IRXDYDNUSA-N 1 3 341.515 2.637 10 0 EFAEHO C[N@H+](CCC1CCN(C(=O)CN2CCCC2)CC1)CC1CCCC1 ZINC001392201077 1355857810 /nfs/dbraw/zinc/85/78/10/1355857810.db2.gz MENCQFAJOCOTIJ-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO C[N@@H+](CCC1CCN(C(=O)CN2CCCC2)CC1)CC1CCCC1 ZINC001392201077 1355857812 /nfs/dbraw/zinc/85/78/12/1355857812.db2.gz MENCQFAJOCOTIJ-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)c1 ZINC001392238470 1355895563 /nfs/dbraw/zinc/89/55/63/1355895563.db2.gz ZPLABTRXFXZSDY-MJGOQNOKSA-N 1 3 331.504 2.567 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001392248167 1355905020 /nfs/dbraw/zinc/90/50/20/1355905020.db2.gz GSZKKSXITPCNIX-HXUWFJFHSA-N 1 3 345.531 2.746 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001392277365 1355932251 /nfs/dbraw/zinc/93/22/51/1355932251.db2.gz CKIZDQOBTOSEMT-BEFAXECRSA-N 1 3 347.478 2.619 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2cc(C)cc(C)c2)CC[N@@H+]1C ZINC001392280266 1355936326 /nfs/dbraw/zinc/93/63/26/1355936326.db2.gz ROIPDNBXJAQCDN-VQTJNVASSA-N 1 3 345.531 2.924 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2cc(C)cc(C)c2)CC[N@H+]1C ZINC001392280266 1355936328 /nfs/dbraw/zinc/93/63/28/1355936328.db2.gz ROIPDNBXJAQCDN-VQTJNVASSA-N 1 3 345.531 2.924 10 0 EFAEHO CN(CC[N@H+](C)CC1CCC2(CC2)CC1)C(=O)CN(C)C1CCC1 ZINC001392282285 1355937934 /nfs/dbraw/zinc/93/79/34/1355937934.db2.gz CYTXRQBJVCUPBL-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CN(CC[N@@H+](C)CC1CCC2(CC2)CC1)C(=O)CN(C)C1CCC1 ZINC001392282285 1355937937 /nfs/dbraw/zinc/93/79/37/1355937937.db2.gz CYTXRQBJVCUPBL-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@@H]21 ZINC001392344874 1356011017 /nfs/dbraw/zinc/01/10/17/1356011017.db2.gz WPYODRIHHILWNA-MSOLQXFVSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@@H]21 ZINC001392344874 1356011025 /nfs/dbraw/zinc/01/10/25/1356011025.db2.gz WPYODRIHHILWNA-MSOLQXFVSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2cc(C)ccc2C)C1)N(C)C ZINC001394375153 1357747035 /nfs/dbraw/zinc/74/70/35/1357747035.db2.gz IXXVHFBVZSXEKP-WDSOQIARSA-N 1 3 331.504 2.628 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]CC1CC2(CCC2)C1 ZINC001392353537 1356014637 /nfs/dbraw/zinc/01/46/37/1356014637.db2.gz NAOOUMKXYFMGRP-QZTJIDSGSA-N 1 3 335.536 2.783 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2Cc2ccsc2)C1 ZINC001392356543 1356016475 /nfs/dbraw/zinc/01/64/75/1356016475.db2.gz ZFKDKPDMKLEUCX-SJORKVTESA-N 1 3 335.517 2.513 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2Cc2ccsc2)C1 ZINC001392356543 1356016480 /nfs/dbraw/zinc/01/64/80/1356016480.db2.gz ZFKDKPDMKLEUCX-SJORKVTESA-N 1 3 335.517 2.513 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2cc(C)sc2C)C1)N(C)C ZINC001394376043 1357748131 /nfs/dbraw/zinc/74/81/31/1357748131.db2.gz NZPUHMSJCZITFV-XIRDDKMYSA-N 1 3 337.533 2.690 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCc2ccccc21)C(=O)[C@@H]1CCCCN1CC ZINC001392461217 1356053205 /nfs/dbraw/zinc/05/32/05/1356053205.db2.gz TXQRFGPNCARQFJ-UXHICEINSA-N 1 3 343.515 2.986 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C[C@@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001392510894 1356086360 /nfs/dbraw/zinc/08/63/60/1356086360.db2.gz IQTOEHGGYHROSY-UKRRQHHQSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@H]2CCCN2C(C)C)c(C)c1 ZINC001392564594 1356123519 /nfs/dbraw/zinc/12/35/19/1356123519.db2.gz HWARPFSQOSLZQC-PKOBYXMFSA-N 1 3 331.504 2.771 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC001392616075 1356163810 /nfs/dbraw/zinc/16/38/10/1356163810.db2.gz DYPVNMIICPSTQG-LBPRGKRZSA-N 1 3 346.302 2.928 10 0 EFAEHO COc1ccc(CN(C)C[C@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)cc1 ZINC001392663119 1356210082 /nfs/dbraw/zinc/21/00/82/1356210082.db2.gz NFRSDQHZQXLPRS-FUHWJXTLSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1ccc(CN(C)C[C@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)cc1 ZINC001392663119 1356210088 /nfs/dbraw/zinc/21/00/88/1356210088.db2.gz NFRSDQHZQXLPRS-FUHWJXTLSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)CCc1ccccc1 ZINC001392711373 1356264131 /nfs/dbraw/zinc/26/41/31/1356264131.db2.gz ZRASFMVQPAGBQW-AZUAARDMSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCc1ccccc1 ZINC001392711373 1356264134 /nfs/dbraw/zinc/26/41/34/1356264134.db2.gz ZRASFMVQPAGBQW-AZUAARDMSA-N 1 3 345.531 2.929 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@H]1CCN1CCc1ccc2ccccc2c1 ZINC001392853652 1356377707 /nfs/dbraw/zinc/37/77/07/1356377707.db2.gz LGEZWCNYNCDKMJ-HXUWFJFHSA-N 1 3 339.483 2.525 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001392942155 1356451895 /nfs/dbraw/zinc/45/18/95/1356451895.db2.gz ZUPJUTWJESSBMJ-ZWKOTPCHSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@H]1CCC[C@H]2CCC[N@H+]21 ZINC001392942155 1356451896 /nfs/dbraw/zinc/45/18/96/1356451896.db2.gz ZUPJUTWJESSBMJ-ZWKOTPCHSA-N 1 3 345.462 2.581 10 0 EFAEHO C[C@@H](C(=O)NCC1([NH2+]CC2CC(C)(C)C2)CC1)N1CCCCCC1 ZINC001392944270 1356454261 /nfs/dbraw/zinc/45/42/61/1356454261.db2.gz WHHKUTZVCGTMNN-INIZCTEOSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+]Cc2ccc(C3CC3)cc2)CC1)N(C)C ZINC001392948088 1356456766 /nfs/dbraw/zinc/45/67/66/1356456766.db2.gz FMKDXHGPKVGBPA-LJQANCHMSA-N 1 3 343.515 2.889 10 0 EFAEHO CN(CCNC(=O)CCCC[NH+](C)C)[C@H]1CCc2ccc(F)cc21 ZINC001492817051 1356492275 /nfs/dbraw/zinc/49/22/75/1356492275.db2.gz KBWQUZMQSSYPFL-SFHVURJKSA-N 1 3 335.467 2.593 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(CF)cc2)C[C@@H]1C ZINC001393035327 1356527222 /nfs/dbraw/zinc/52/72/22/1356527222.db2.gz YQVUSGUPSVWTAP-LPHOPBHVSA-N 1 3 349.494 2.965 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H]2CCCN2C(=O)CN(C)C(C)C)c(C)s1 ZINC001393053211 1356540804 /nfs/dbraw/zinc/54/08/04/1356540804.db2.gz LILIZXYMPFJMMA-KRWDZBQOSA-N 1 3 337.533 2.786 10 0 EFAEHO COc1cccc(C[NH+]2CCC(C)(NC(=O)CN(C)C(C)C)CC2)c1 ZINC001393082591 1356575104 /nfs/dbraw/zinc/57/51/04/1356575104.db2.gz SMAPNNAFUMJBAT-UHFFFAOYSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@]2(CC[N@@H+](CC[C@H](C)F)C2)C1 ZINC001393084842 1356577493 /nfs/dbraw/zinc/57/74/93/1356577493.db2.gz BGISXHLPRIBMPA-PKOBYXMFSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@]2(CC[N@H+](CC[C@H](C)F)C2)C1 ZINC001393084842 1356577498 /nfs/dbraw/zinc/57/74/98/1356577498.db2.gz BGISXHLPRIBMPA-PKOBYXMFSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCCC[C@]2(CCN(C/C=C\Cl)C2)C1 ZINC001393084687 1356577637 /nfs/dbraw/zinc/57/76/37/1356577637.db2.gz ACNPRZOBBXTWAL-OEPRFQHASA-N 1 3 341.927 2.785 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCCC[C@]2(CCN(C/C=C\Cl)C2)C1 ZINC001393084687 1356577639 /nfs/dbraw/zinc/57/76/39/1356577639.db2.gz ACNPRZOBBXTWAL-OEPRFQHASA-N 1 3 341.927 2.785 10 0 EFAEHO CCc1cccc(CN2CC[C@@](C)(NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c1 ZINC001393121036 1356623342 /nfs/dbraw/zinc/62/33/42/1356623342.db2.gz SZPFAIXFDNNERY-PZJWPPBQSA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1cccc(CN2CC[C@@](C)(NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c1 ZINC001393121036 1356623345 /nfs/dbraw/zinc/62/33/45/1356623345.db2.gz SZPFAIXFDNNERY-PZJWPPBQSA-N 1 3 343.515 2.671 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@H]3C[N@H+](CC4CCCC4)C[C@@H]3C2)CCC1 ZINC001394351184 1357725309 /nfs/dbraw/zinc/72/53/09/1357725309.db2.gz MDAVPOZQZOSQHZ-GBESFXJTSA-N 1 3 347.547 2.878 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@H]3C[N@@H+](CC4CCCC4)C[C@@H]3C2)CCC1 ZINC001394351184 1357725310 /nfs/dbraw/zinc/72/53/10/1357725310.db2.gz MDAVPOZQZOSQHZ-GBESFXJTSA-N 1 3 347.547 2.878 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@]1(C)CCC[N@H+](CC2CC2)C1 ZINC001393204748 1356716283 /nfs/dbraw/zinc/71/62/83/1356716283.db2.gz LSDDSOJPNUWSQD-UYAOXDASSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@]1(C)CCC[N@@H+](CC2CC2)C1 ZINC001393204748 1356716285 /nfs/dbraw/zinc/71/62/85/1356716285.db2.gz LSDDSOJPNUWSQD-UYAOXDASSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](F)CN1CCC[C@](C)(CNC(=O)C23CCC[NH+]2CCC3)C1 ZINC001393205905 1356718341 /nfs/dbraw/zinc/71/83/41/1356718341.db2.gz PVJAKARATPYLQD-FUHWJXTLSA-N 1 3 339.499 2.581 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCc1ccccc1)C2 ZINC001393365958 1356788922 /nfs/dbraw/zinc/78/89/22/1356788922.db2.gz GHKYWOGGJGGXMG-UFYCRDLUSA-N 1 3 343.515 2.540 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCc1ccccc1)C2 ZINC001393365958 1356788926 /nfs/dbraw/zinc/78/89/26/1356788926.db2.gz GHKYWOGGJGGXMG-UFYCRDLUSA-N 1 3 343.515 2.540 10 0 EFAEHO CCc1ccccc1[C@H](CNC(=O)CN(C)C1CCC1)[NH2+]C(C)C ZINC001393385530 1356805710 /nfs/dbraw/zinc/80/57/10/1356805710.db2.gz WBGDKSMBLVUICC-IBGZPJMESA-N 1 3 331.504 2.889 10 0 EFAEHO CC[C@H](F)CN1CC[C@@H]2[C@H]1CCCN2C(=O)CCC[NH+]1CCCC1 ZINC001393466322 1356867440 /nfs/dbraw/zinc/86/74/40/1356867440.db2.gz QCMDCJICGZJXMT-RCCFBDPRSA-N 1 3 339.499 2.676 10 0 EFAEHO C[C@H]([NH2+]CC[C@H]1CCN(C(=O)CN2CCCC2)C1)c1ccc(F)cc1 ZINC001393473345 1356874163 /nfs/dbraw/zinc/87/41/63/1356874163.db2.gz KZKOQEXYOVFYHH-IRXDYDNUSA-N 1 3 347.478 2.811 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]Cc2ccc(F)cc2)CC1 ZINC001393497245 1356898366 /nfs/dbraw/zinc/89/83/66/1356898366.db2.gz HRLBCOCCZSGODH-UAPYVXQJSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CC[NH+](Cc1cccc(F)c1)CC2 ZINC001393503031 1356903616 /nfs/dbraw/zinc/90/36/16/1356903616.db2.gz UBHFRYKIKCRDIJ-UHFFFAOYSA-N 1 3 347.478 2.590 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001393502064 1356903876 /nfs/dbraw/zinc/90/38/76/1356903876.db2.gz VCSSCKCYHJQVAE-QAETUUGQSA-N 1 3 329.504 2.585 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@H](C(=O)NCC2(NCc3ccsc3)CCC2)C1 ZINC001393566259 1356955206 /nfs/dbraw/zinc/95/52/06/1356955206.db2.gz MDRLJCBVBYUABI-IRXDYDNUSA-N 1 3 349.544 2.997 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@H+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001393595267 1356976471 /nfs/dbraw/zinc/97/64/71/1356976471.db2.gz MQSSGLKNTFSADP-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@@H+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001393595267 1356976475 /nfs/dbraw/zinc/97/64/75/1356976475.db2.gz MQSSGLKNTFSADP-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CCC1([NH2+]Cc2ccccn2)CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001393680214 1357073893 /nfs/dbraw/zinc/07/38/93/1357073893.db2.gz KGSXDVMTYIVFCN-GOSISDBHSA-N 1 3 346.519 2.529 10 0 EFAEHO CCC1([NH2+]Cc2cncc(C)c2)CCN(C(=O)CN(C)C(C)C)CC1 ZINC001393680760 1357074377 /nfs/dbraw/zinc/07/43/77/1357074377.db2.gz SRRPUQKVRNKAEP-UHFFFAOYSA-N 1 3 346.519 2.591 10 0 EFAEHO CC(C)[C@@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+]Cc1ccsc1 ZINC001394408451 1357785000 /nfs/dbraw/zinc/78/50/00/1357785000.db2.gz PMRPLYCBLIBESU-MRXNPFEDSA-N 1 3 337.533 2.853 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H](C[NH2+]CC1CC(C)(C)C1)C1CC1)N(C)C ZINC001394434161 1357813937 /nfs/dbraw/zinc/81/39/37/1357813937.db2.gz ZOAVGYXYPSJPTA-ROUUACIJSA-N 1 3 337.552 2.835 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H](C2CC2)N(C)C(=O)CN(C)C(C)C)cs1 ZINC001394436861 1357816480 /nfs/dbraw/zinc/81/64/80/1357816480.db2.gz BKQXUQUDRZNMQB-KRWDZBQOSA-N 1 3 337.533 2.723 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H](C2CC2)N(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001394445957 1357825998 /nfs/dbraw/zinc/82/59/98/1357825998.db2.gz UKCRMRGGJPNDLQ-FXAWDEMLSA-N 1 3 343.515 2.663 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C[NH2+]Cc1ccccc1C)C1CC1)N(C)C ZINC001394454263 1357836394 /nfs/dbraw/zinc/83/63/94/1357836394.db2.gz WTOLNRGHLLGIBE-RTBURBONSA-N 1 3 331.504 2.662 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC001394565573 1357958478 /nfs/dbraw/zinc/95/84/78/1357958478.db2.gz HBCGMNMAOBQKMR-INIZCTEOSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]CC[C@@H]1CCc2ccccc21 ZINC001394566320 1357960265 /nfs/dbraw/zinc/96/02/65/1357960265.db2.gz JXJOKLINWOYROF-HKUYNNGSSA-N 1 3 345.531 2.883 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@]12CCC[C@@H]1N(Cc1ccsc1)CC2 ZINC001394691841 1358014379 /nfs/dbraw/zinc/01/43/79/1358014379.db2.gz NYAVEIXAYWUZIB-WMZOPIPTSA-N 1 3 335.517 2.703 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]Cc3ccccc3)[C@H]2C1 ZINC001394697013 1358021324 /nfs/dbraw/zinc/02/13/24/1358021324.db2.gz ZAZNOGADQFWEDD-UFYCRDLUSA-N 1 3 343.515 2.745 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]Cc3ccccc3)[C@H]2C1 ZINC001394697012 1358021515 /nfs/dbraw/zinc/02/15/15/1358021515.db2.gz ZAZNOGADQFWEDD-SLFFLAALSA-N 1 3 343.515 2.745 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H](C[NH2+]Cc2ccc(CF)cc2)C1 ZINC001394705449 1358031790 /nfs/dbraw/zinc/03/17/90/1358031790.db2.gz ZHOHMTXJIZMXGX-RTBURBONSA-N 1 3 349.494 2.871 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@@H](C[NH2+]CC3CC(C)(C)C3)C2)CCC1 ZINC001394711315 1358038133 /nfs/dbraw/zinc/03/81/33/1358038133.db2.gz UPJHNNVDYKHUPK-NVXWUHKLSA-N 1 3 335.536 2.781 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)c(C)c1 ZINC001394726076 1358051841 /nfs/dbraw/zinc/05/18/41/1358051841.db2.gz OJGOFGJVBOKNLY-IBGZPJMESA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)N(CC[N@H+](C)CC1CC(C)(C)C1)C(=O)CN1CC[C@@H](C)C1 ZINC001394810350 1358101745 /nfs/dbraw/zinc/10/17/45/1358101745.db2.gz WUOBDUKMZXLPIZ-QGZVFWFLSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CC1CC(C)(C)C1)C(=O)CN1CC[C@@H](C)C1 ZINC001394810350 1358101749 /nfs/dbraw/zinc/10/17/49/1358101749.db2.gz WUOBDUKMZXLPIZ-QGZVFWFLSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)(C)[C@@H](CNC/C(Cl)=C\Cl)NC(=O)C[NH+]1CCCC1 ZINC001394831410 1358131091 /nfs/dbraw/zinc/13/10/91/1358131091.db2.gz XELPQHOXFDSAKQ-YQCJOKCJSA-N 1 3 336.307 2.522 10 0 EFAEHO CC(C)(C)[C@@H](C[NH2+]C/C(Cl)=C\Cl)NC(=O)CN1CCCC1 ZINC001394831410 1358131096 /nfs/dbraw/zinc/13/10/96/1358131096.db2.gz XELPQHOXFDSAKQ-YQCJOKCJSA-N 1 3 336.307 2.522 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C[NH2+]Cc1ccsc1)C(C)(C)C)N(C)C ZINC001394837647 1358139500 /nfs/dbraw/zinc/13/95/00/1358139500.db2.gz TVPYVKHGLUXHJS-JKSUJKDBSA-N 1 3 339.549 2.955 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCCC1)C1CC[NH+](CC2CC2)CC1 ZINC001394841250 1358143187 /nfs/dbraw/zinc/14/31/87/1358143187.db2.gz YXJICIBDTZQIIJ-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001394846372 1358151352 /nfs/dbraw/zinc/15/13/52/1358151352.db2.gz IFYJCBFFBCSWPV-MRXNPFEDSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)C1CCN(Cc2cccc(F)c2)CC1 ZINC001394848375 1358154565 /nfs/dbraw/zinc/15/45/65/1358154565.db2.gz OLPSYIGWPOMLCY-INIZCTEOSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)C1CCN(Cc2cccc(F)c2)CC1 ZINC001394848375 1358154568 /nfs/dbraw/zinc/15/45/68/1358154568.db2.gz OLPSYIGWPOMLCY-INIZCTEOSA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C2CC2)c(C)s1 ZINC001436835274 1387328539 /nfs/dbraw/zinc/32/85/39/1387328539.db2.gz VGZUTGNGBIDWLF-KRWDZBQOSA-N 1 3 337.533 2.690 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001437035183 1387375760 /nfs/dbraw/zinc/37/57/60/1387375760.db2.gz QBTLAQPJTSESCO-LJQANCHMSA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001437134364 1387409682 /nfs/dbraw/zinc/40/96/82/1387409682.db2.gz PTSXMZCTJHBSNP-GDBMZVCRSA-N 1 3 345.478 2.779 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001397157300 1359712598 /nfs/dbraw/zinc/71/25/98/1359712598.db2.gz IDYSBEXKGSUFLO-ZCNNSNEGSA-N 1 3 345.531 2.956 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@@H]([NH2+]C[C@H](C)CC(C)C)C1 ZINC001397164883 1359717575 /nfs/dbraw/zinc/71/75/75/1359717575.db2.gz AXADLESLUXJDDQ-HYVNUMGLSA-N 1 3 334.508 2.817 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@@H]([NH2+]CC2CC(C)(C)C2)C1 ZINC001397166188 1359719102 /nfs/dbraw/zinc/71/91/02/1359719102.db2.gz DDGJMGNKHIHTKR-GOEBONIOSA-N 1 3 332.492 2.571 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001397174002 1359724079 /nfs/dbraw/zinc/72/40/79/1359724079.db2.gz YUSBAXQRFQDWRV-RBUKOAKNSA-N 1 3 331.504 2.710 10 0 EFAEHO C[C@@H](F)CCN1CC[C@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)[C@H]1C ZINC001397240554 1359778329 /nfs/dbraw/zinc/77/83/29/1359778329.db2.gz IFLXDOUEJXKOBZ-INMHGKMJSA-N 1 3 341.515 2.967 10 0 EFAEHO C[C@@H](F)CCN1CC[C@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)[C@H]1C ZINC001397240554 1359778333 /nfs/dbraw/zinc/77/83/33/1359778333.db2.gz IFLXDOUEJXKOBZ-INMHGKMJSA-N 1 3 341.515 2.967 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[N@H+](C/C=C/Cl)CC(C)(C)C1)C1CCC1 ZINC001397265960 1359798487 /nfs/dbraw/zinc/79/84/87/1359798487.db2.gz AFEHSHXCDOZERB-BOSPYUDASA-N 1 3 341.927 2.830 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[N@@H+](C/C=C/Cl)CC(C)(C)C1)C1CCC1 ZINC001397265960 1359798492 /nfs/dbraw/zinc/79/84/92/1359798492.db2.gz AFEHSHXCDOZERB-BOSPYUDASA-N 1 3 341.927 2.830 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C)[NH+](CC)CC ZINC001397280078 1359812124 /nfs/dbraw/zinc/81/21/24/1359812124.db2.gz ZHKZGVRIKWWQTC-NEWSRXKRSA-N 1 3 331.504 2.886 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H]1CN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001397471829 1359909059 /nfs/dbraw/zinc/90/90/59/1359909059.db2.gz KBUUDRUGTQSGMV-VQIMIIECSA-N 1 3 331.504 2.526 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)C[C@H]1CCN1C[C@@H]1CCCC(F)(F)C1 ZINC001397556313 1359958468 /nfs/dbraw/zinc/95/84/68/1359958468.db2.gz PROYTHALIHRAHD-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)C[C@H]1CCN1C[C@@H]1CCCC(F)(F)C1 ZINC001397556313 1359958472 /nfs/dbraw/zinc/95/84/72/1359958472.db2.gz PROYTHALIHRAHD-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[C@@H]([NH2+]CCC(F)(F)F)C1)N1CCCC1 ZINC001397707199 1360065637 /nfs/dbraw/zinc/06/56/37/1360065637.db2.gz XLKDFTRAUZQQCW-UONOGXRCSA-N 1 3 349.441 2.688 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CC(CC)CC ZINC001397737656 1360092043 /nfs/dbraw/zinc/09/20/43/1360092043.db2.gz CBLJVRVVCZNYFO-YRPNKDGESA-N 1 3 349.563 2.933 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CC(CC)CC ZINC001397737656 1360092046 /nfs/dbraw/zinc/09/20/46/1360092046.db2.gz CBLJVRVVCZNYFO-YRPNKDGESA-N 1 3 349.563 2.933 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[N@H+](C)CC)CCN1Cc1csc(C)c1 ZINC001397753048 1360107976 /nfs/dbraw/zinc/10/79/76/1360107976.db2.gz HPKBZCBLNKPJLL-DLBZAZTESA-N 1 3 337.533 2.867 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[N@@H+](C)CC)CCN1Cc1csc(C)c1 ZINC001397753048 1360107979 /nfs/dbraw/zinc/10/79/79/1360107979.db2.gz HPKBZCBLNKPJLL-DLBZAZTESA-N 1 3 337.533 2.867 10 0 EFAEHO CCCN(C)CC(=O)N1CCCCC[C@@H]([NH2+]Cc2ncccc2C)C1 ZINC001397765951 1360117470 /nfs/dbraw/zinc/11/74/70/1360117470.db2.gz GIHQUWKEXNZHHY-GOSISDBHSA-N 1 3 346.519 2.593 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@@H+](C/C=C\Cl)CC(C)(C)C1)N(C)C ZINC001397804435 1360155445 /nfs/dbraw/zinc/15/54/45/1360155445.db2.gz FVVTZLNXXICENK-SKJVMOOOSA-N 1 3 329.916 2.686 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@H+](C/C=C\Cl)CC(C)(C)C1)N(C)C ZINC001397804435 1360155433 /nfs/dbraw/zinc/15/54/33/1360155433.db2.gz FVVTZLNXXICENK-SKJVMOOOSA-N 1 3 329.916 2.686 10 0 EFAEHO CN(CCc1ccccc1F)C[C@@H]1CCCCN1C(=O)CC[NH+](C)C ZINC001397808231 1360160626 /nfs/dbraw/zinc/16/06/26/1360160626.db2.gz BTKPYEUGOHEWIM-SFHVURJKSA-N 1 3 349.494 2.633 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC[NH+](CCc2ccccc2F)CC1 ZINC001398238701 1360407118 /nfs/dbraw/zinc/40/71/18/1360407118.db2.gz UWJKOJXNSWCWAM-UHFFFAOYSA-N 1 3 349.494 2.631 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H]1CC[N@H+](CCC2CCCCC2)C1 ZINC001398295856 1360448280 /nfs/dbraw/zinc/44/82/80/1360448280.db2.gz ZUUUFBIACMLTPW-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H]1CC[N@@H+](CCC2CCCCC2)C1 ZINC001398295856 1360448282 /nfs/dbraw/zinc/44/82/82/1360448282.db2.gz ZUUUFBIACMLTPW-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](C(=O)NC[C@H]([NH2+]CC1CCCC1)C1CC1)N1CCCCCC1 ZINC001398438251 1360556512 /nfs/dbraw/zinc/55/65/12/1360556512.db2.gz GJQSPZMNNOILLS-APWZRJJASA-N 1 3 335.536 2.926 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@@H](NCc2ccccc2Cl)C2CC2)C1 ZINC001398445583 1360562901 /nfs/dbraw/zinc/56/29/01/1360562901.db2.gz LYYZKGNJPCAUDQ-KBXCAEBGSA-N 1 3 349.906 2.666 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@@H](NCc2ccccc2Cl)C2CC2)C1 ZINC001398445583 1360562903 /nfs/dbraw/zinc/56/29/03/1360562903.db2.gz LYYZKGNJPCAUDQ-KBXCAEBGSA-N 1 3 349.906 2.666 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](CNC(=O)CN2CC[C@@H](C)C2)C2CC2)cc1 ZINC001398455336 1360572866 /nfs/dbraw/zinc/57/28/66/1360572866.db2.gz PPHOVJGQQLFVPL-UZLBHIALSA-N 1 3 343.515 2.575 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@H](NC2c3ccccc3-c3ccccc32)C1 ZINC001398524133 1360624381 /nfs/dbraw/zinc/62/43/81/1360624381.db2.gz UCQKTOCVELKCTQ-INIZCTEOSA-N 1 3 349.478 2.899 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)c1 ZINC001492873681 1360636348 /nfs/dbraw/zinc/63/63/48/1360636348.db2.gz PMFKWBLBVKIFHG-CALCHBBNSA-N 1 3 331.504 2.670 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)c1 ZINC001492873681 1360636353 /nfs/dbraw/zinc/63/63/53/1360636353.db2.gz PMFKWBLBVKIFHG-CALCHBBNSA-N 1 3 331.504 2.670 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1)CC(C)(C)C ZINC001398551035 1360639563 /nfs/dbraw/zinc/63/95/63/1360639563.db2.gz DIKSEQGRLXWHMD-UYTYNIKBSA-N 1 3 335.536 2.637 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1C[C@H](NCc2cccc(Cl)c2Cl)C1 ZINC001398553234 1360641676 /nfs/dbraw/zinc/64/16/76/1360641676.db2.gz JYCADLWDNWLFQG-JOCQHMNTSA-N 1 3 344.286 2.682 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]2CN(Cc3cccc(F)c3)CC[C@@H]21 ZINC001398596453 1360663576 /nfs/dbraw/zinc/66/35/76/1360663576.db2.gz SVMCQGGTOJFKDY-HKUYNNGSSA-N 1 3 347.478 2.590 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC[C@@H]2CCc3ccccc32)C1)N(C)C ZINC001398656753 1360691955 /nfs/dbraw/zinc/69/19/55/1360691955.db2.gz CRZJBBGCWSEZEW-PNYFIKQUSA-N 1 3 343.515 2.684 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(F)cc2F)C1 ZINC001398660260 1360694475 /nfs/dbraw/zinc/69/44/75/1360694475.db2.gz AVOPGOIFQWRVJE-AEGPPILISA-N 1 3 339.430 2.603 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cc3ccccc3o2)C1)N(C)C ZINC001398673164 1360703403 /nfs/dbraw/zinc/70/34/03/1360703403.db2.gz RYKUWQXPJZZJIX-JTDSTZFVSA-N 1 3 343.471 2.756 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](CCc2ccc(C)cc2)C1)N(C)C ZINC001398696285 1360725497 /nfs/dbraw/zinc/72/54/97/1360725497.db2.gz OTOWWLKEZFZVLZ-WOJBJXKFSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](CCc2ccc(C)cc2)C1)N(C)C ZINC001398696285 1360725500 /nfs/dbraw/zinc/72/55/00/1360725500.db2.gz OTOWWLKEZFZVLZ-WOJBJXKFSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[NH2+][C@@H](C)c2ccccc2)C1 ZINC001398734615 1360750850 /nfs/dbraw/zinc/75/08/50/1360750850.db2.gz PFNVQNYIKJOOBJ-ROUUACIJSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+]C[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001398738928 1360754609 /nfs/dbraw/zinc/75/46/09/1360754609.db2.gz RXUPHRQYESVAMQ-QZTJIDSGSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CCCC[N@@H+]1CCCF)N1CCCCCC1 ZINC001398770407 1360776359 /nfs/dbraw/zinc/77/63/59/1360776359.db2.gz ZAAWPNKJZRURLH-IAGOWNOFSA-N 1 3 327.488 2.581 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CCCC[N@H+]1CCCF)N1CCCCCC1 ZINC001398770407 1360776361 /nfs/dbraw/zinc/77/63/61/1360776361.db2.gz ZAAWPNKJZRURLH-IAGOWNOFSA-N 1 3 327.488 2.581 10 0 EFAEHO Cc1ccc(F)c(CN2CCC[C@@H]([C@@H](C)NC(=O)CC[NH+](C)C)C2)c1 ZINC001398785475 1360788536 /nfs/dbraw/zinc/78/85/36/1360788536.db2.gz IGXKFKBLIJYGIJ-IAGOWNOFSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H]1CCC[N@H+](Cc2ccsc2)C1 ZINC001398792118 1360795722 /nfs/dbraw/zinc/79/57/22/1360795722.db2.gz LVCRRKZSBAIAJY-WBVHZDCISA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H]1CCC[N@@H+](Cc2ccsc2)C1 ZINC001398792118 1360795723 /nfs/dbraw/zinc/79/57/23/1360795723.db2.gz LVCRRKZSBAIAJY-WBVHZDCISA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@H+](Cc2ccsc2)C1 ZINC001398792113 1360796184 /nfs/dbraw/zinc/79/61/84/1360796184.db2.gz LVCRRKZSBAIAJY-RDJZCZTQSA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](Cc2ccsc2)C1 ZINC001398792113 1360796186 /nfs/dbraw/zinc/79/61/86/1360796186.db2.gz LVCRRKZSBAIAJY-RDJZCZTQSA-N 1 3 337.533 2.805 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC2CCC(NC/C(Cl)=C\Cl)CC2)CC[N@@H+]1C ZINC001398831821 1360821014 /nfs/dbraw/zinc/82/10/14/1360821014.db2.gz AOIZUJKHCOVJOD-USMQAGGMSA-N 1 3 348.318 2.663 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC2CCC(NC/C(Cl)=C\Cl)CC2)CC[N@H+]1C ZINC001398831821 1360821016 /nfs/dbraw/zinc/82/10/16/1360821016.db2.gz AOIZUJKHCOVJOD-USMQAGGMSA-N 1 3 348.318 2.663 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@H]2CCCCN2C(C)C)c(C)n1 ZINC001437217251 1387476983 /nfs/dbraw/zinc/47/69/83/1387476983.db2.gz SWJKOZLJMDAPEF-QFBILLFUSA-N 1 3 346.519 2.556 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1cc(C)cc(C)c1 ZINC001398944326 1360886492 /nfs/dbraw/zinc/88/64/92/1360886492.db2.gz CLCDKVIMHPXCOI-MJGOQNOKSA-N 1 3 331.504 2.772 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)[C@H](C(C)C)[NH+]1CCCC1 ZINC001492878256 1360906071 /nfs/dbraw/zinc/90/60/71/1360906071.db2.gz HMHHDQRDKFSWBS-FQEVSTJZSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]CC1CC2(CCC2)C1 ZINC001399106161 1360997775 /nfs/dbraw/zinc/99/77/75/1360997775.db2.gz PVRKIPYRXHZBSP-SJORKVTESA-N 1 3 335.536 2.926 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@@H]([N@H+](C)Cc2ccccc2)C1 ZINC001399285560 1361126275 /nfs/dbraw/zinc/12/62/75/1361126275.db2.gz IFNIZKLQHICADQ-MOPGFXCFSA-N 1 3 349.494 2.789 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC001399285560 1361126278 /nfs/dbraw/zinc/12/62/78/1361126278.db2.gz IFNIZKLQHICADQ-MOPGFXCFSA-N 1 3 349.494 2.789 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1cccc2cccnc21)N(C)C ZINC001399412459 1361204479 /nfs/dbraw/zinc/20/44/79/1361204479.db2.gz HKMQBGBQHCGMSU-CRAIPNDOSA-N 1 3 342.487 2.559 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001399417558 1361208408 /nfs/dbraw/zinc/20/84/08/1361208408.db2.gz RAXLGONIVKRPMA-DZGCQCFKSA-N 1 3 333.467 2.637 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@H](C)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001399420192 1361210960 /nfs/dbraw/zinc/21/09/60/1361210960.db2.gz PXDUGDRTQAAOGD-GXTWGEPZSA-N 1 3 342.434 2.571 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]CCc1cccs1 ZINC001399429616 1361219459 /nfs/dbraw/zinc/21/94/59/1361219459.db2.gz JFTYQSXVXRUMFR-DOTOQJQBSA-N 1 3 337.533 2.649 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(C)CCNC(=O)C12CCC[NH+](CCC1)C2 ZINC001399498974 1361280915 /nfs/dbraw/zinc/28/09/15/1361280915.db2.gz HRDWHNGDZJIRNM-INIZCTEOSA-N 1 3 347.478 2.811 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@@H+]1C)[C@H]1CCc2ccc(F)cc21 ZINC001399499526 1361281390 /nfs/dbraw/zinc/28/13/90/1361281390.db2.gz BCYHMEAFROXBKI-HKUYNNGSSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@H+]1C)[C@H]1CCc2ccc(F)cc21 ZINC001399499526 1361281394 /nfs/dbraw/zinc/28/13/94/1361281394.db2.gz BCYHMEAFROXBKI-HKUYNNGSSA-N 1 3 347.478 2.735 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](C)[C@H]1CCc2ccccc21 ZINC001399655687 1361408396 /nfs/dbraw/zinc/40/83/96/1361408396.db2.gz MZWWQUZTVCJOFN-OALUTQOASA-N 1 3 329.488 2.596 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001399655687 1361408398 /nfs/dbraw/zinc/40/83/98/1361408398.db2.gz MZWWQUZTVCJOFN-OALUTQOASA-N 1 3 329.488 2.596 10 0 EFAEHO CCN(CCNC(=O)CC[C@@H]1CCC[N@@H+]1C)Cc1ccc(F)cc1 ZINC001399725284 1361456948 /nfs/dbraw/zinc/45/69/48/1361456948.db2.gz RTLZWYWJCCTFGJ-SFHVURJKSA-N 1 3 335.467 2.638 10 0 EFAEHO CCN(CCNC(=O)CC[C@@H]1CCC[N@H+]1C)Cc1ccc(F)cc1 ZINC001399725284 1361456951 /nfs/dbraw/zinc/45/69/51/1361456951.db2.gz RTLZWYWJCCTFGJ-SFHVURJKSA-N 1 3 335.467 2.638 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001437262034 1387515475 /nfs/dbraw/zinc/51/54/75/1387515475.db2.gz NWNOAKDYPIRLFX-TZMCWYRMSA-N 1 3 343.924 2.870 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CNC(=O)C(C)(C)N3CCCC3)C2)cc1 ZINC001399914408 1361571815 /nfs/dbraw/zinc/57/18/15/1361571815.db2.gz DIODYZOIJAPDPB-IBGZPJMESA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CNC(=O)C(C)(C)N3CCCC3)C2)cc1 ZINC001399914408 1361571817 /nfs/dbraw/zinc/57/18/17/1361571817.db2.gz DIODYZOIJAPDPB-IBGZPJMESA-N 1 3 343.515 2.808 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCN(Cc2ccc(F)cc2)C1)[NH+](CC)CC ZINC001399925864 1361581770 /nfs/dbraw/zinc/58/17/70/1361581770.db2.gz BWMLJUAFACPGQE-PKOBYXMFSA-N 1 3 349.494 2.884 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NC[C@@H]1CCN(Cc2ccsc2)C1 ZINC001399933641 1361590386 /nfs/dbraw/zinc/59/03/86/1361590386.db2.gz QXWYQNFTCDMIGJ-INIZCTEOSA-N 1 3 335.517 2.562 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(Cc2ccccc2C)C2CC2)CC[N@@H+]1C ZINC001400006647 1361659091 /nfs/dbraw/zinc/65/90/91/1361659091.db2.gz RUFFSSPDVWTCAQ-VQTJNVASSA-N 1 3 343.515 2.806 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(Cc2ccccc2C)C2CC2)CC[N@H+]1C ZINC001400006647 1361659095 /nfs/dbraw/zinc/65/90/95/1361659095.db2.gz RUFFSSPDVWTCAQ-VQTJNVASSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1cc(C)cc(CN(CCNC(=O)C[C@@H]2CC[N@@H+](C)C2)C2CC2)c1 ZINC001400033599 1361684212 /nfs/dbraw/zinc/68/42/12/1361684212.db2.gz PPUVFWHIMKGBDD-SFHVURJKSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1cc(C)cc(CN(CCNC(=O)C[C@@H]2CC[N@H+](C)C2)C2CC2)c1 ZINC001400033599 1361684216 /nfs/dbraw/zinc/68/42/16/1361684216.db2.gz PPUVFWHIMKGBDD-SFHVURJKSA-N 1 3 343.515 2.726 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[N@H+](CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001400044359 1361694822 /nfs/dbraw/zinc/69/48/22/1361694822.db2.gz VVYJTSDPHWOZRL-GOSISDBHSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[N@@H+](CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001400044359 1361694825 /nfs/dbraw/zinc/69/48/25/1361694825.db2.gz VVYJTSDPHWOZRL-GOSISDBHSA-N 1 3 335.536 2.734 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)cc1 ZINC001400205123 1361842703 /nfs/dbraw/zinc/84/27/03/1361842703.db2.gz VLLSQXDVJDBPEQ-IBGZPJMESA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)cc1 ZINC001400205123 1361842705 /nfs/dbraw/zinc/84/27/05/1361842705.db2.gz VLLSQXDVJDBPEQ-IBGZPJMESA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[N@H+](C)CCCc2ccccc2)C1)N(C)C ZINC001400227519 1361861829 /nfs/dbraw/zinc/86/18/29/1361861829.db2.gz RAIDPUCSZOYKMQ-WOJBJXKFSA-N 1 3 345.531 2.740 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[N@@H+](C)CCCc2ccccc2)C1)N(C)C ZINC001400227519 1361861831 /nfs/dbraw/zinc/86/18/31/1361861831.db2.gz RAIDPUCSZOYKMQ-WOJBJXKFSA-N 1 3 345.531 2.740 10 0 EFAEHO C[C@H](C(=O)N1CC[C@H](CN(C)C/C=C\Cl)C1)[NH+]1CCCCCC1 ZINC001400237251 1361872728 /nfs/dbraw/zinc/87/27/28/1361872728.db2.gz ZTZSOYYZOMIKDS-KIUVSXKZSA-N 1 3 341.927 2.784 10 0 EFAEHO Cc1ccc(C[N@@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1C ZINC001400239109 1361874628 /nfs/dbraw/zinc/87/46/28/1361874628.db2.gz ABRXUJIDWLBOAG-FQEVSTJZSA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1ccc(C[N@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1C ZINC001400239109 1361874632 /nfs/dbraw/zinc/87/46/32/1361874632.db2.gz ABRXUJIDWLBOAG-FQEVSTJZSA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1ccc(C[N@@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001400250918 1361887014 /nfs/dbraw/zinc/88/70/14/1361887014.db2.gz KIAFSLRAFFNHCS-LJQANCHMSA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1ccc(C[N@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001400250918 1361887018 /nfs/dbraw/zinc/88/70/18/1361887018.db2.gz KIAFSLRAFFNHCS-LJQANCHMSA-N 1 3 345.531 2.924 10 0 EFAEHO CN(CC(=O)NCC1C[NH+]([C@H]2CCc3ccccc32)C1)CC(C)(C)C ZINC001400527010 1362013071 /nfs/dbraw/zinc/01/30/71/1362013071.db2.gz HYRRAOBVZKXTCQ-IBGZPJMESA-N 1 3 343.515 2.700 10 0 EFAEHO Cc1cc(C)c(CN2CC(CNC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c(C)c1 ZINC001400545851 1362019804 /nfs/dbraw/zinc/01/98/04/1362019804.db2.gz HFEHBSBZCVRGIE-SFHVURJKSA-N 1 3 343.515 2.502 10 0 EFAEHO Cc1cc(C)c(CN2CC(CNC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c(C)c1 ZINC001400545851 1362019807 /nfs/dbraw/zinc/01/98/07/1362019807.db2.gz HFEHBSBZCVRGIE-SFHVURJKSA-N 1 3 343.515 2.502 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c(C)s1 ZINC001437329147 1387551054 /nfs/dbraw/zinc/55/10/54/1387551054.db2.gz OGLVFDDJZJKSEW-INIZCTEOSA-N 1 3 337.533 2.643 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[C@@H]([NH2+]CC2CC3(CCC3)C2)C1 ZINC001437327762 1387547790 /nfs/dbraw/zinc/54/77/90/1387547790.db2.gz KYFAPUKJAWQQBD-MSOLQXFVSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(C(=O)CCC[NH+](C)C)[C@@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001400703552 1362107821 /nfs/dbraw/zinc/10/78/21/1362107821.db2.gz FOLNXNXQHMJFJZ-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](CC)[NH2+]Cc1cc(C)sc1C)N(C)C ZINC001400835478 1362197898 /nfs/dbraw/zinc/19/78/98/1362197898.db2.gz VPSVQZJTOKVUJD-JKSUJKDBSA-N 1 3 325.522 2.690 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)[NH2+]Cc1ccc(F)c(F)c1 ZINC001400842930 1362204033 /nfs/dbraw/zinc/20/40/33/1362204033.db2.gz DQQKYWCZGMUQJP-RHSMWYFYSA-N 1 3 341.446 2.535 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC1(NC(=O)[C@@H]2CCCN2C(C)C)CCCC1 ZINC001400909176 1362248533 /nfs/dbraw/zinc/24/85/33/1362248533.db2.gz PLIKORZHWSZBHO-CVEARBPZSA-N 1 3 327.488 2.626 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC001400923023 1362263784 /nfs/dbraw/zinc/26/37/84/1362263784.db2.gz QJTGOHCVYAUVMH-DZGCQCFKSA-N 1 3 341.446 2.850 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CCCC1 ZINC001400969426 1362307899 /nfs/dbraw/zinc/30/78/99/1362307899.db2.gz JRQBNLTYTAQJRL-KURKYZTESA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@]1(C[NH2+]Cc2ccccn2)CCCC[C@@H]1C ZINC001401040449 1362389960 /nfs/dbraw/zinc/38/99/60/1362389960.db2.gz DFSHEMACIUALRX-FXAWDEMLSA-N 1 3 346.519 2.577 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H]1CC[C@H](NC(=O)CN(C)C(C)C)CC1 ZINC001401067757 1362408138 /nfs/dbraw/zinc/40/81/38/1362408138.db2.gz LOAXAGYRAGTJTM-WGSAOQKQSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H]1CC[C@H](NC(=O)CN(C)C(C)C)CC1 ZINC001401068218 1362408349 /nfs/dbraw/zinc/40/83/49/1362408349.db2.gz NWGJIMWUQAYPLE-WGSAOQKQSA-N 1 3 349.494 2.991 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@@H]1CCc2ccccc21 ZINC001401090487 1362433218 /nfs/dbraw/zinc/43/32/18/1362433218.db2.gz MIULVCHHNKOHGN-IEBWSBKVSA-N 1 3 329.488 2.596 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001401127246 1362464013 /nfs/dbraw/zinc/46/40/13/1362464013.db2.gz XDLCXCBMJOGUMG-GJZGRUSLSA-N 1 3 345.478 2.638 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)C[NH2+]CC1CCC2(CC2)CC1 ZINC001401149728 1362485954 /nfs/dbraw/zinc/48/59/54/1362485954.db2.gz UHBMUGKDQPILPV-AWEZNQCLSA-N 1 3 332.492 2.573 10 0 EFAEHO CN(CC(=O)NCC1([NH2+]Cc2ccsc2)CCCC1)C1CCC1 ZINC001401178148 1362511448 /nfs/dbraw/zinc/51/14/48/1362511448.db2.gz ABKPJCAZZSSBJP-UHFFFAOYSA-N 1 3 335.517 2.751 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001437357466 1387579182 /nfs/dbraw/zinc/57/91/82/1387579182.db2.gz MHXJYYZFOZZWOO-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001437357466 1387579184 /nfs/dbraw/zinc/57/91/84/1387579184.db2.gz MHXJYYZFOZZWOO-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CCCC1 ZINC001401189636 1362528991 /nfs/dbraw/zinc/52/89/91/1362528991.db2.gz ZJDMZIRSUOUBQD-IXDOHACOSA-N 1 3 344.503 2.715 10 0 EFAEHO Cc1ccc(CC[NH2+]C2(CNC(=O)CN(C)C(C)C)CCCC2)cc1 ZINC001401191276 1362530783 /nfs/dbraw/zinc/53/07/83/1362530783.db2.gz QNWXOOOYUDBDCW-UHFFFAOYSA-N 1 3 345.531 2.896 10 0 EFAEHO C[C@H](C[NH2+]CC1CCC2(CC2)CC1)N(C)C(=O)C1(N(C)C)CCC1 ZINC001401219836 1362558146 /nfs/dbraw/zinc/55/81/46/1362558146.db2.gz HNXICGBMOIROLY-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(CF)cc1 ZINC001401265612 1362606691 /nfs/dbraw/zinc/60/66/91/1362606691.db2.gz HRMRPBGBWKOXCU-VQIMIIECSA-N 1 3 349.494 2.967 10 0 EFAEHO CC(C)C[NH2+]C[C@H](CC(C)C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001401269309 1362611109 /nfs/dbraw/zinc/61/11/09/1362611109.db2.gz BQJOOAHONQCTAN-LPHOPBHVSA-N 1 3 343.531 2.975 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C[NH2+]CC1CC2(CCC2)C1)CC(C)C ZINC001401289085 1362635381 /nfs/dbraw/zinc/63/53/81/1362635381.db2.gz WGIPYEKPMGBNAT-KRWDZBQOSA-N 1 3 346.519 2.961 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C)[C@@H]1C[NH2+]Cc1ccsc1 ZINC001401306083 1362652537 /nfs/dbraw/zinc/65/25/37/1362652537.db2.gz MTDQDVNOGWUUFE-RDJZCZTQSA-N 1 3 337.533 2.805 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)CCC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001401310058 1362658249 /nfs/dbraw/zinc/65/82/49/1362658249.db2.gz OQBFMTCKQVALJZ-MSOLQXFVSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)CCC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001401310058 1362658255 /nfs/dbraw/zinc/65/82/55/1362658255.db2.gz OQBFMTCKQVALJZ-MSOLQXFVSA-N 1 3 343.531 2.881 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)cc1 ZINC001401344222 1362691396 /nfs/dbraw/zinc/69/13/96/1362691396.db2.gz OYHZRJWLUHOCAX-HKUYNNGSSA-N 1 3 331.504 2.567 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NCc1ccccc1Cl ZINC001401355788 1362705970 /nfs/dbraw/zinc/70/59/70/1362705970.db2.gz VPGXWUCENSXGDG-RDJZCZTQSA-N 1 3 337.895 2.522 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NCc1ccccc1Cl ZINC001401355788 1362705972 /nfs/dbraw/zinc/70/59/72/1362705972.db2.gz VPGXWUCENSXGDG-RDJZCZTQSA-N 1 3 337.895 2.522 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCN(C)C(=O)[C@@H]2C[NH+]3CCC2CC3)c1 ZINC001401366016 1362716923 /nfs/dbraw/zinc/71/69/23/1362716923.db2.gz JYNOKTMXRRFARJ-HXUWFJFHSA-N 1 3 343.515 2.535 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](CNC(=O)C[C@H]2CC[N@H+](C)C2)C(C)C)c1 ZINC001401380186 1362732608 /nfs/dbraw/zinc/73/26/08/1362732608.db2.gz LLXNNRFPUDVUHJ-VQIMIIECSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](CNC(=O)C[C@H]2CC[N@@H+](C)C2)C(C)C)c1 ZINC001401380186 1362732611 /nfs/dbraw/zinc/73/26/11/1362732611.db2.gz LLXNNRFPUDVUHJ-VQIMIIECSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)C(C)(C)[NH+]2CCCC2)cc1 ZINC001401385578 1362739443 /nfs/dbraw/zinc/73/94/43/1362739443.db2.gz NZTUNAWBNHMHLZ-UHFFFAOYSA-N 1 3 331.504 2.760 10 0 EFAEHO CC1CC(C[N@H+](C)CCN(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001401388079 1362742548 /nfs/dbraw/zinc/74/25/48/1362742548.db2.gz XTNZCHSXDRCMCW-RJYAGPCLSA-N 1 3 341.515 2.635 10 0 EFAEHO CC1CC(C[N@@H+](C)CCN(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001401388079 1362742551 /nfs/dbraw/zinc/74/25/51/1362742551.db2.gz XTNZCHSXDRCMCW-RJYAGPCLSA-N 1 3 341.515 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC001401433210 1362799252 /nfs/dbraw/zinc/79/92/52/1362799252.db2.gz CMJVHPTYULMGNN-LJQANCHMSA-N 1 3 349.494 2.934 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC001401433210 1362799255 /nfs/dbraw/zinc/79/92/55/1362799255.db2.gz CMJVHPTYULMGNN-LJQANCHMSA-N 1 3 349.494 2.934 10 0 EFAEHO CCN(CCN[C@H](C)c1ccccc1F)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001401600222 1362962257 /nfs/dbraw/zinc/96/22/57/1362962257.db2.gz ZIONIPDSYNEKQY-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCN[C@H](C)c1ccccc1F)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001401600222 1362962260 /nfs/dbraw/zinc/96/22/60/1362962260.db2.gz ZIONIPDSYNEKQY-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCN[C@H](C)c1ccccc1F)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001401600218 1362962391 /nfs/dbraw/zinc/96/23/91/1362962391.db2.gz ZIONIPDSYNEKQY-CVEARBPZSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCN[C@H](C)c1ccccc1F)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001401600218 1362962394 /nfs/dbraw/zinc/96/23/94/1362962394.db2.gz ZIONIPDSYNEKQY-CVEARBPZSA-N 1 3 335.467 2.667 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C)C[NH2+]CC1CCC2(CC2)CC1 ZINC001401617145 1362975122 /nfs/dbraw/zinc/97/51/22/1362975122.db2.gz HITKVVFZRCNXTC-AEFFLSMTSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001401626759 1362981098 /nfs/dbraw/zinc/98/10/98/1362981098.db2.gz HWIBTBCISAVLJX-OLZOCXBDSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001401626759 1362981103 /nfs/dbraw/zinc/98/11/03/1362981103.db2.gz HWIBTBCISAVLJX-OLZOCXBDSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001401626757 1362981301 /nfs/dbraw/zinc/98/13/01/1362981301.db2.gz HWIBTBCISAVLJX-CHWSQXEVSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001401626757 1362981307 /nfs/dbraw/zinc/98/13/07/1362981307.db2.gz HWIBTBCISAVLJX-CHWSQXEVSA-N 1 3 343.924 2.870 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CC1CC2(CCC2)C1 ZINC001401651506 1363000642 /nfs/dbraw/zinc/00/06/42/1363000642.db2.gz JWYBTMXKHSPRMB-SJLPKXTDSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+]Cc1ccccc1C(F)(F)F ZINC001401720106 1363051965 /nfs/dbraw/zinc/05/19/65/1363051965.db2.gz DFTWSBSOABVUGC-ZDUSSCGKSA-N 1 3 345.409 2.640 10 0 EFAEHO COc1cccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CCC[N@@H+]2C(C)C)c1 ZINC001401747933 1363081190 /nfs/dbraw/zinc/08/11/90/1363081190.db2.gz CZMLQHYBXITVLO-APWZRJJASA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CCC[N@H+]2C(C)C)c1 ZINC001401747933 1363081191 /nfs/dbraw/zinc/08/11/91/1363081191.db2.gz CZMLQHYBXITVLO-APWZRJJASA-N 1 3 347.503 2.505 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)cc1F ZINC001401774984 1363113297 /nfs/dbraw/zinc/11/32/97/1363113297.db2.gz HRQQTPVEQBDBDD-INIZCTEOSA-N 1 3 349.494 2.945 10 0 EFAEHO COc1cccc(CN(C)C[C@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001401780061 1363119487 /nfs/dbraw/zinc/11/94/87/1363119487.db2.gz KTHQYDGLOFQPMF-WMZOPIPTSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1cccc(CN(C)C[C@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001401780061 1363119491 /nfs/dbraw/zinc/11/94/91/1363119491.db2.gz KTHQYDGLOFQPMF-WMZOPIPTSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1cccc(CN(C)C[C@@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001401780053 1363120180 /nfs/dbraw/zinc/12/01/80/1363120180.db2.gz KTHQYDGLOFQPMF-AEFFLSMTSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1cccc(CN(C)C[C@@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001401780053 1363120183 /nfs/dbraw/zinc/12/01/83/1363120183.db2.gz KTHQYDGLOFQPMF-AEFFLSMTSA-N 1 3 347.503 2.506 10 0 EFAEHO CCc1ccc(CC[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001401782823 1363123793 /nfs/dbraw/zinc/12/37/93/1363123793.db2.gz SSDXNKFOXWFBOH-MSOLQXFVSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccc(CC[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001401782823 1363123797 /nfs/dbraw/zinc/12/37/97/1363123797.db2.gz SSDXNKFOXWFBOH-MSOLQXFVSA-N 1 3 345.531 2.570 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@H](C)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001401785118 1363126685 /nfs/dbraw/zinc/12/66/85/1363126685.db2.gz RJPXIBMNUJGAON-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@H](C)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001401785118 1363126691 /nfs/dbraw/zinc/12/66/91/1363126691.db2.gz RJPXIBMNUJGAON-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@H+](C)Cc1c(C)cc(C)cc1C)N(C)C ZINC001401810495 1363160222 /nfs/dbraw/zinc/16/02/22/1363160222.db2.gz ZFOXAINFDHNQPJ-IEBWSBKVSA-N 1 3 333.520 2.889 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@@H+](C)Cc1c(C)cc(C)cc1C)N(C)C ZINC001401810495 1363160223 /nfs/dbraw/zinc/16/02/23/1363160223.db2.gz ZFOXAINFDHNQPJ-IEBWSBKVSA-N 1 3 333.520 2.889 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]CC1CCCCC1)C1CC1 ZINC001401841524 1363180040 /nfs/dbraw/zinc/18/00/40/1363180040.db2.gz MDXKZWBMFDXSQY-RBUKOAKNSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H](NC(=O)[C@H]2CCCN2C(C)C)C2CC2)cs1 ZINC001401848941 1363185627 /nfs/dbraw/zinc/18/56/27/1363185627.db2.gz SEDRPHTXUINEGI-ZWKOTPCHSA-N 1 3 349.544 2.914 10 0 EFAEHO C[C@H](F)CCN1CC[C@@H]1CNC(=O)CC[N@H+](C)C1CCCCC1 ZINC001401903098 1363228739 /nfs/dbraw/zinc/22/87/39/1363228739.db2.gz ZJJQQMDGDNJPKI-DOTOQJQBSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](F)CCN1CC[C@@H]1CNC(=O)CC[N@@H+](C)C1CCCCC1 ZINC001401903098 1363228743 /nfs/dbraw/zinc/22/87/43/1363228743.db2.gz ZJJQQMDGDNJPKI-DOTOQJQBSA-N 1 3 327.488 2.580 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@H]2CCN2CCC2CCCCCC2)C1 ZINC001401933670 1363256346 /nfs/dbraw/zinc/25/63/46/1363256346.db2.gz XJFPSTIXEDMUPJ-RTBURBONSA-N 1 3 335.536 2.879 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@H]2CCN2CCC2CCCCCC2)C1 ZINC001401933670 1363256349 /nfs/dbraw/zinc/25/63/49/1363256349.db2.gz XJFPSTIXEDMUPJ-RTBURBONSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC2([NH2+]Cc3ccc(C4CC4)cc3)CC2)C1 ZINC001401958155 1363275893 /nfs/dbraw/zinc/27/58/93/1363275893.db2.gz BABZMJBKZRTKQP-INIZCTEOSA-N 1 3 341.499 2.644 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001401965821 1363282540 /nfs/dbraw/zinc/28/25/40/1363282540.db2.gz BOWNWXNLFBNDGC-QZTJIDSGSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001401965821 1363282542 /nfs/dbraw/zinc/28/25/42/1363282542.db2.gz BOWNWXNLFBNDGC-QZTJIDSGSA-N 1 3 345.462 2.581 10 0 EFAEHO C[C@@H]([NH2+]C1(CNC(=O)C(C)(C)N2CCCC2)CC1)c1ccccc1 ZINC001401969915 1363287044 /nfs/dbraw/zinc/28/70/44/1363287044.db2.gz UTGOOGLIZVTZLP-MRXNPFEDSA-N 1 3 329.488 2.860 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NCC2(NCc3ccc(C4CC4)cc3)CC2)C1 ZINC001401977951 1363294315 /nfs/dbraw/zinc/29/43/15/1363294315.db2.gz JJANQYYFKOGKJO-KRWDZBQOSA-N 1 3 341.499 2.644 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NCC2(NCc3ccc(C4CC4)cc3)CC2)C1 ZINC001401977951 1363294319 /nfs/dbraw/zinc/29/43/19/1363294319.db2.gz JJANQYYFKOGKJO-KRWDZBQOSA-N 1 3 341.499 2.644 10 0 EFAEHO C[C@H](NC[C@H]1CCCN1C(=O)CC[NH+](C)C)c1cc(F)ccc1F ZINC001402064392 1363371489 /nfs/dbraw/zinc/37/14/89/1363371489.db2.gz XTFHEXOIALFIAD-DZGCQCFKSA-N 1 3 339.430 2.558 10 0 EFAEHO Cc1ccc(CN2CCC[C@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)cc1 ZINC001402076002 1363380782 /nfs/dbraw/zinc/38/07/82/1363380782.db2.gz GLNLMMNXUQICNT-VQTJNVASSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(CN2CCC[C@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)cc1 ZINC001402076002 1363380783 /nfs/dbraw/zinc/38/07/83/1363380783.db2.gz GLNLMMNXUQICNT-VQTJNVASSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1cc(C[NH+]2CCC(C)(NC(=O)CN(C)C(C)C)CC2)cs1 ZINC001402086976 1363391519 /nfs/dbraw/zinc/39/15/19/1363391519.db2.gz JGTLZDHFLMOPQD-UHFFFAOYSA-N 1 3 337.533 2.867 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2cc(C)ccc2C)C1)N(C)C ZINC001402172975 1363479825 /nfs/dbraw/zinc/47/98/25/1363479825.db2.gz NMEIDKVPQGFIER-TZIWHRDSSA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)CC[N@@H+]1CCC[C@](C)(CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001402207056 1363520170 /nfs/dbraw/zinc/52/01/70/1363520170.db2.gz HEQBNQSAUQQVSW-IEBWSBKVSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)CC[N@H+]1CCC[C@](C)(CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001402207056 1363520173 /nfs/dbraw/zinc/52/01/73/1363520173.db2.gz HEQBNQSAUQQVSW-IEBWSBKVSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)CC[N@@H+]1CCC[C@@](C)(CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001402207059 1363520621 /nfs/dbraw/zinc/52/06/21/1363520621.db2.gz HEQBNQSAUQQVSW-MJGOQNOKSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)CC[N@H+]1CCC[C@@](C)(CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001402207059 1363520623 /nfs/dbraw/zinc/52/06/23/1363520623.db2.gz HEQBNQSAUQQVSW-MJGOQNOKSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([C@@H](C)[NH2+]Cc2ccc(CF)cc2)C1 ZINC001402395059 1363653490 /nfs/dbraw/zinc/65/34/90/1363653490.db2.gz AIHYCSVOKOXXDC-APWZRJJASA-N 1 3 349.494 2.823 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1CC[C@H](CNC(=O)Cc2nc[nH]c2C)CC1 ZINC001402405823 1363665178 /nfs/dbraw/zinc/66/51/78/1363665178.db2.gz DQUCTVCSYIUHMS-JYJNAYRXSA-N 1 3 338.471 2.521 10 0 EFAEHO CC(C)CC[NH2+][C@@H](C)[C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001402406782 1363666225 /nfs/dbraw/zinc/66/62/25/1363666225.db2.gz YXUDMKINXXLYEE-IRXDYDNUSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)(C)CC[NH2+][C@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001402450694 1363701537 /nfs/dbraw/zinc/70/15/37/1363701537.db2.gz GRELCBMTLIRQLR-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)C[C@H]21 ZINC001402473055 1363716710 /nfs/dbraw/zinc/71/67/10/1363716710.db2.gz NMDAALGKAGOMKS-DLBZAZTESA-N 1 3 335.517 2.513 10 0 EFAEHO CC(C)C[C@@H](C)C[NH+]1CCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)CC1 ZINC001402498649 1363741716 /nfs/dbraw/zinc/74/17/16/1363741716.db2.gz JHMDLFYQOFOLKJ-RTBURBONSA-N 1 3 349.563 2.935 10 0 EFAEHO CCC[N@@H+]1CCc2c(CNC(=O)CN3[C@@H](C)CC[C@@H]3C)cccc2C1 ZINC001402522257 1363758043 /nfs/dbraw/zinc/75/80/43/1363758043.db2.gz UQDVSMPDLIXVKY-IRXDYDNUSA-N 1 3 343.515 2.944 10 0 EFAEHO CCC[N@H+]1CCc2c(CNC(=O)CN3[C@@H](C)CC[C@@H]3C)cccc2C1 ZINC001402522257 1363758046 /nfs/dbraw/zinc/75/80/46/1363758046.db2.gz UQDVSMPDLIXVKY-IRXDYDNUSA-N 1 3 343.515 2.944 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(NCc3ccccc3F)CCC2)CC[N@@H+]1C ZINC001402577688 1363805889 /nfs/dbraw/zinc/80/58/89/1363805889.db2.gz PZTDKAOHRQZKSD-HOTGVXAUSA-N 1 3 347.478 2.685 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(NCc3ccccc3F)CCC2)CC[N@H+]1C ZINC001402577688 1363805893 /nfs/dbraw/zinc/80/58/93/1363805893.db2.gz PZTDKAOHRQZKSD-HOTGVXAUSA-N 1 3 347.478 2.685 10 0 EFAEHO Cc1ccccc1C[NH2+]C1(CNC(=O)CN2[C@H](C)CC[C@@H]2C)CCC1 ZINC001402578382 1363806976 /nfs/dbraw/zinc/80/69/76/1363806976.db2.gz NIDZZPQGIYMINP-HDICACEKSA-N 1 3 343.515 2.996 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+]CC[C@@H]3CCCC3(F)F)C2)CCC1 ZINC001402601475 1363825420 /nfs/dbraw/zinc/82/54/20/1363825420.db2.gz RILGXYUHTKSFEL-SOUVJXGZSA-N 1 3 343.462 2.533 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]C/C=C\c2ccc(Cl)cc2)C1 ZINC001402627568 1363854124 /nfs/dbraw/zinc/85/41/24/1363854124.db2.gz ISFGIAYEJCOVGA-JDVOYXAPSA-N 1 3 349.906 2.932 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)cc2)C1)N(C)C ZINC001402630081 1363857913 /nfs/dbraw/zinc/85/79/13/1363857913.db2.gz MBPLHTSNUAXHDB-NKGKWGDASA-N 1 3 335.467 2.710 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CCC[N@H+](CC2CCC(C)CC2)C1 ZINC001402687198 1363936629 /nfs/dbraw/zinc/93/66/29/1363936629.db2.gz KHRHPZMDQUNGQZ-ACBHZAAOSA-N 1 3 337.552 2.983 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CCC[N@@H+](CC2CCC(C)CC2)C1 ZINC001402687198 1363936634 /nfs/dbraw/zinc/93/66/34/1363936634.db2.gz KHRHPZMDQUNGQZ-ACBHZAAOSA-N 1 3 337.552 2.983 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001402712234 1363959630 /nfs/dbraw/zinc/95/96/30/1363959630.db2.gz FGDPHAKRPBKTGC-SFHVURJKSA-N 1 3 345.531 2.917 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001402713592 1363960664 /nfs/dbraw/zinc/96/06/64/1363960664.db2.gz GHQZNEFSYIOKHT-IBGZPJMESA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)C[NH2+]C[C@@H]1CCCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001402754569 1364001706 /nfs/dbraw/zinc/00/17/06/1364001706.db2.gz CFLJFEHQAQJJHR-QFBILLFUSA-N 1 3 341.515 2.826 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]Cc2cc(F)ccc2C)CC1 ZINC001402766110 1364015102 /nfs/dbraw/zinc/01/51/02/1364015102.db2.gz AMYBGALSZKPAOE-UHFFFAOYSA-N 1 3 349.494 2.947 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H]1CCC[N@@H+](CCCC(C)C)C1 ZINC001402772847 1364020549 /nfs/dbraw/zinc/02/05/49/1364020549.db2.gz FGFYCHZPYJPCPY-WBVHZDCISA-N 1 3 334.508 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H]1CCC[N@H+](CCCC(C)C)C1 ZINC001402772847 1364020553 /nfs/dbraw/zinc/02/05/53/1364020553.db2.gz FGFYCHZPYJPCPY-WBVHZDCISA-N 1 3 334.508 2.914 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@@H](C)[C@@H](NCc2cc(C)ccc2F)C1 ZINC001402786729 1364033803 /nfs/dbraw/zinc/03/38/03/1364033803.db2.gz NPPRYWNEOHTSST-APWZRJJASA-N 1 3 349.494 2.803 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@@H](C)[C@@H](NCc2cc(C)ccc2F)C1 ZINC001402786729 1364033807 /nfs/dbraw/zinc/03/38/07/1364033807.db2.gz NPPRYWNEOHTSST-APWZRJJASA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CCC([NH2+]CC2CC3(CCC3)C2)CC1 ZINC001402825803 1364072727 /nfs/dbraw/zinc/07/27/27/1364072727.db2.gz GEJLGHFRVNZWGH-UHFFFAOYSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]Cc2ccc(C)c(F)c2)CC1)N(C)C ZINC001402832892 1364078558 /nfs/dbraw/zinc/07/85/58/1364078558.db2.gz TWHHJXDPCQBGBL-FAFZWHIHSA-N 1 3 349.494 2.991 10 0 EFAEHO C[N@H+](CCNC(=O)C(C)(C)N1CCCCC1)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001437454894 1387660502 /nfs/dbraw/zinc/66/05/02/1387660502.db2.gz DHTPOZNNPIPELG-KURKYZTESA-N 1 3 335.536 2.735 10 0 EFAEHO C[N@@H+](CCNC(=O)C(C)(C)N1CCCCC1)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001437454894 1387660504 /nfs/dbraw/zinc/66/05/04/1387660504.db2.gz DHTPOZNNPIPELG-KURKYZTESA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCCC1)[NH2+]CC1CC2(CCC2)C1 ZINC001402893234 1364115065 /nfs/dbraw/zinc/11/50/65/1364115065.db2.gz YMQBKFOUDZPQCV-INIZCTEOSA-N 1 3 335.536 2.926 10 0 EFAEHO C[N@@H+]1CCCC[C@@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1NC/C=C\Cl ZINC001402897607 1364117403 /nfs/dbraw/zinc/11/74/03/1364117403.db2.gz KYYUQKPEANHRGW-SBBJTCDKSA-N 1 3 347.890 2.595 10 0 EFAEHO C[N@H+]1CCCC[C@@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1NC/C=C\Cl ZINC001402897607 1364117406 /nfs/dbraw/zinc/11/74/06/1364117406.db2.gz KYYUQKPEANHRGW-SBBJTCDKSA-N 1 3 347.890 2.595 10 0 EFAEHO C[N@@H+]1CCCC[C@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1NC/C=C/Cl ZINC001402897623 1364117925 /nfs/dbraw/zinc/11/79/25/1364117925.db2.gz KYYUQKPEANHRGW-XEGZUCJKSA-N 1 3 347.890 2.595 10 0 EFAEHO C[N@H+]1CCCC[C@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1NC/C=C/Cl ZINC001402897623 1364117926 /nfs/dbraw/zinc/11/79/26/1364117926.db2.gz KYYUQKPEANHRGW-XEGZUCJKSA-N 1 3 347.890 2.595 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]Cc2sccc2Cl)C1 ZINC001402942181 1364151424 /nfs/dbraw/zinc/15/14/24/1364151424.db2.gz DAAYLYSSEJWULJ-UHFFFAOYSA-N 1 3 343.924 2.728 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]Cc2ccc(Cl)cc2)C1)N(C)C ZINC001402951190 1364158096 /nfs/dbraw/zinc/15/80/96/1364158096.db2.gz QHPUKVQLZZDZPR-PREGVCBESA-N 1 3 337.895 2.665 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)CC(C)(C)C)c1 ZINC001403003601 1364201938 /nfs/dbraw/zinc/20/19/38/1364201938.db2.gz JVZUHPDPRDMKPR-DLBZAZTESA-N 1 3 333.520 2.956 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)CNC(=O)[C@H]2CCCCN2C(C)C)cc1 ZINC001403050089 1364254293 /nfs/dbraw/zinc/25/42/93/1364254293.db2.gz OUKWXTSVYYXOQM-AZUAARDMSA-N 1 3 345.531 2.895 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)CNC(=O)[C@@H]2CCCCN2C(C)C)cs1 ZINC001403051791 1364255692 /nfs/dbraw/zinc/25/56/92/1364255692.db2.gz PRBLDERVJVUPME-YOEHRIQHSA-N 1 3 337.533 2.914 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C(C)C)c(Cl)c1 ZINC001403056990 1364262216 /nfs/dbraw/zinc/26/22/16/1364262216.db2.gz XZRHPWAEXJETRE-GJZGRUSLSA-N 1 3 339.911 2.971 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)CCC[NH+]2CCCCC2)c1 ZINC001403137972 1364354605 /nfs/dbraw/zinc/35/46/05/1364354605.db2.gz LTVABADCUMBLRA-QGZVFWFLSA-N 1 3 349.494 2.995 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[N@H+](C)CCc1ccc(C)cc1 ZINC001403151111 1364369649 /nfs/dbraw/zinc/36/96/49/1364369649.db2.gz YSLZDKRYUXJRTR-AZUAARDMSA-N 1 3 345.531 2.848 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[N@@H+](C)CCc1ccc(C)cc1 ZINC001403151111 1364369654 /nfs/dbraw/zinc/36/96/54/1364369654.db2.gz YSLZDKRYUXJRTR-AZUAARDMSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H](C)[N@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001403166685 1364386595 /nfs/dbraw/zinc/38/65/95/1364386595.db2.gz KZUMACPNXDEKFI-HNAYVOBHSA-N 1 3 344.503 2.691 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H](C)[N@@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001403166685 1364386601 /nfs/dbraw/zinc/38/66/01/1364386601.db2.gz KZUMACPNXDEKFI-HNAYVOBHSA-N 1 3 344.503 2.691 10 0 EFAEHO C[C@@H](CNC(=O)CC[NH+](C)C)N(C)Cc1ccc(C(C)(C)C)cc1 ZINC001403169136 1364389499 /nfs/dbraw/zinc/38/94/99/1364389499.db2.gz NAHYFQXYOXMPIC-INIZCTEOSA-N 1 3 333.520 2.872 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@H+](C)[C@@H]2CCc3ccccc32)C1 ZINC001403316655 1364534539 /nfs/dbraw/zinc/53/45/39/1364534539.db2.gz CABGVQIERRSPGS-UYAOXDASSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@@H+](C)[C@@H]2CCc3ccccc32)C1 ZINC001403316655 1364534543 /nfs/dbraw/zinc/53/45/43/1364534543.db2.gz CABGVQIERRSPGS-UYAOXDASSA-N 1 3 343.515 2.937 10 0 EFAEHO Cc1cc(C)cc(C[NH+]2CC([C@@H](C)NC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001403332043 1364548836 /nfs/dbraw/zinc/54/88/36/1364548836.db2.gz RKRYROKFLRUYIC-MAUKXSAKSA-N 1 3 343.515 2.582 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C1C[NH+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001403335026 1364551154 /nfs/dbraw/zinc/55/11/54/1364551154.db2.gz UKXNJCKXKYXIFQ-YJBOKZPZSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](CC2CCC(F)(F)CC2)C1)N(C)C ZINC001403341294 1364556080 /nfs/dbraw/zinc/55/60/80/1364556080.db2.gz BFYFGUJHMSPDEP-CZUORRHYSA-N 1 3 345.478 2.589 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001437482104 1387683476 /nfs/dbraw/zinc/68/34/76/1387683476.db2.gz OHDAVOCEUZISQV-IBGZPJMESA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001437482104 1387683481 /nfs/dbraw/zinc/68/34/81/1387683481.db2.gz OHDAVOCEUZISQV-IBGZPJMESA-N 1 3 331.504 2.726 10 0 EFAEHO CCc1ccc(CC[NH+]2CC([C@H](C)NC(=O)CN(C)C(C)C)C2)cc1 ZINC001403359591 1364570038 /nfs/dbraw/zinc/57/00/38/1364570038.db2.gz XCXXECFECOWKMW-KRWDZBQOSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@H+](CCCF)CC1(C)C)N1CCCCC1 ZINC001403392993 1364598153 /nfs/dbraw/zinc/59/81/53/1364598153.db2.gz UNINODOJWCKIDD-IRXDYDNUSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@@H+](CCCF)CC1(C)C)N1CCCCC1 ZINC001403392993 1364598155 /nfs/dbraw/zinc/59/81/55/1364598155.db2.gz UNINODOJWCKIDD-IRXDYDNUSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@H+](CC1CC3(CCC3)C1)C2 ZINC001403395447 1364600333 /nfs/dbraw/zinc/60/03/33/1364600333.db2.gz DGABXBFWEKJYBQ-UHFFFAOYSA-N 1 3 347.547 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@@H+](CC1CC3(CCC3)C1)C2 ZINC001403395447 1364600335 /nfs/dbraw/zinc/60/03/35/1364600335.db2.gz DGABXBFWEKJYBQ-UHFFFAOYSA-N 1 3 347.547 2.831 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001403412823 1364617163 /nfs/dbraw/zinc/61/71/63/1364617163.db2.gz KATQQAWKVFKQOL-OTWHNJEPSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001403412823 1364617166 /nfs/dbraw/zinc/61/71/66/1364617166.db2.gz KATQQAWKVFKQOL-OTWHNJEPSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2)C1)N(C)C ZINC001403422572 1364627196 /nfs/dbraw/zinc/62/71/96/1364627196.db2.gz MCPWHOZVZONJLB-DFEHZGFQSA-N 1 3 335.467 2.711 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@H]2C[C@H](NC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001403426776 1364630126 /nfs/dbraw/zinc/63/01/26/1364630126.db2.gz ZZNCKGURSWLYCN-UAPYVXQJSA-N 1 3 343.515 2.772 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](CC3CCC3)C[C@H]2C1)CC(C)(C)C ZINC001403435537 1364638482 /nfs/dbraw/zinc/63/84/82/1364638482.db2.gz WYOCGZUDNCBAOS-GUDVDZBRSA-N 1 3 349.563 2.981 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](CC3CCC3)C[C@H]2C1)CC(C)(C)C ZINC001403435537 1364638485 /nfs/dbraw/zinc/63/84/85/1364638485.db2.gz WYOCGZUDNCBAOS-GUDVDZBRSA-N 1 3 349.563 2.981 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001403438718 1364641854 /nfs/dbraw/zinc/64/18/54/1364641854.db2.gz AAXPSNSRIXTQLY-FUHWJXTLSA-N 1 3 331.504 2.630 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1ccsc1 ZINC001403446241 1364648330 /nfs/dbraw/zinc/64/83/30/1364648330.db2.gz ODWMBHGNBYWHAK-WBVHZDCISA-N 1 3 337.533 2.995 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2cccc(Cl)c2)C1)N(C)C ZINC001403459937 1364661985 /nfs/dbraw/zinc/66/19/85/1364661985.db2.gz PBSLJTCGMDVYAH-DJIMGWMZSA-N 1 3 337.895 2.665 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C[NH2+]Cc1ccc(C)cc1)C1CC1)N(C)C ZINC001403511969 1364717353 /nfs/dbraw/zinc/71/73/53/1364717353.db2.gz SPVIUXUIBSBVJU-MOPGFXCFSA-N 1 3 331.504 2.662 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C[NH2+]Cc1cc(C)cc(C)c1)C1CC1)N(C)C ZINC001403528593 1364734113 /nfs/dbraw/zinc/73/41/13/1364734113.db2.gz OTKYDCPUJKSZMX-WOJBJXKFSA-N 1 3 345.531 2.970 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)Cc2cc(C)ccc2C)CC[N@@H+]1C ZINC001403558786 1364760753 /nfs/dbraw/zinc/76/07/53/1364760753.db2.gz AJOBCIPTBNANCR-RBUKOAKNSA-N 1 3 331.504 2.582 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)Cc2cc(C)ccc2C)CC[N@H+]1C ZINC001403558786 1364760759 /nfs/dbraw/zinc/76/07/59/1364760759.db2.gz AJOBCIPTBNANCR-RBUKOAKNSA-N 1 3 331.504 2.582 10 0 EFAEHO C[C@@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001403578279 1364779897 /nfs/dbraw/zinc/77/98/97/1364779897.db2.gz JEBPKSAGPYINGU-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(Cl)cc1 ZINC001403596242 1364799505 /nfs/dbraw/zinc/79/95/05/1364799505.db2.gz JSOIQTHQDPQQEI-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001403618987 1364821814 /nfs/dbraw/zinc/82/18/14/1364821814.db2.gz FDJPRKNXTVSNIM-HNNXBMFYSA-N 1 3 331.460 2.710 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C[C@H]1C ZINC001403739057 1364894171 /nfs/dbraw/zinc/89/41/71/1364894171.db2.gz CEPZKXPRSVLSDV-OXQOHEQNSA-N 1 3 343.515 2.985 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)cc1C ZINC001403742809 1364895998 /nfs/dbraw/zinc/89/59/98/1364895998.db2.gz HAKLBNQEUSGQRP-MJGOQNOKSA-N 1 3 331.504 2.723 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@@H+](C)CCNC(=O)[C@H](C(C)C)N(C)C)c1 ZINC001403752982 1364902859 /nfs/dbraw/zinc/90/28/59/1364902859.db2.gz SPHUECBNAZPKLC-HKUYNNGSSA-N 1 3 333.520 2.999 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@H+](C)CCNC(=O)[C@H](C(C)C)N(C)C)c1 ZINC001403752982 1364902860 /nfs/dbraw/zinc/90/28/60/1364902860.db2.gz SPHUECBNAZPKLC-HKUYNNGSSA-N 1 3 333.520 2.999 10 0 EFAEHO CCc1ccc(C[NH2+][C@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)cc1 ZINC001403772650 1364921047 /nfs/dbraw/zinc/92/10/47/1364921047.db2.gz LMUXOAKRMFNIQK-LPHOPBHVSA-N 1 3 331.504 2.668 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@@H](NCc2cccc(C(C)C)n2)[C@H]1C ZINC001403780512 1364931697 /nfs/dbraw/zinc/93/16/97/1364931697.db2.gz XOTDVPIJPPNVQM-VQIMIIECSA-N 1 3 346.519 2.626 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@@H](NCc2cccc(C(C)C)n2)[C@H]1C ZINC001403780512 1364931701 /nfs/dbraw/zinc/93/17/01/1364931701.db2.gz XOTDVPIJPPNVQM-VQIMIIECSA-N 1 3 346.519 2.626 10 0 EFAEHO CC[C@H](F)CN1CC[C@@]2(NC(=O)CCC[NH+]3CCCC3)CCC[C@H]12 ZINC001403788939 1364940751 /nfs/dbraw/zinc/94/07/51/1364940751.db2.gz ZOZXSZFHDVYGRW-LNLFQRSKSA-N 1 3 339.499 2.724 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC001403792282 1364944491 /nfs/dbraw/zinc/94/44/91/1364944491.db2.gz SBLXRSFUJPGYJT-SFHVURJKSA-N 1 3 335.467 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC001403792282 1364944495 /nfs/dbraw/zinc/94/44/95/1364944495.db2.gz SBLXRSFUJPGYJT-SFHVURJKSA-N 1 3 335.467 2.591 10 0 EFAEHO CCc1cccc(CN2CCC[C@H](NC(=O)CC[NH+](C)C)[C@@H]2C)c1 ZINC001403801339 1364955236 /nfs/dbraw/zinc/95/52/36/1364955236.db2.gz SBQNUBLUEFDDET-LPHOPBHVSA-N 1 3 331.504 2.670 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc(CF)cc1 ZINC001403807928 1364962133 /nfs/dbraw/zinc/96/21/33/1364962133.db2.gz VJWSAHLNFLADHJ-CRAIPNDOSA-N 1 3 335.467 2.577 10 0 EFAEHO CCC(CC)C[NH2+][C@H]1CN(C(=O)[C@H](C(C)C)N(C)C)CC1(C)C ZINC001403816130 1364972002 /nfs/dbraw/zinc/97/20/02/1364972002.db2.gz GWDLZTJKOLSTSO-IRXDYDNUSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+][C@H](C)c2ccccc2)C(C)(C)C1 ZINC001403834917 1364985256 /nfs/dbraw/zinc/98/52/56/1364985256.db2.gz NBPJAECPTBHCMZ-SJLPKXTDSA-N 1 3 331.504 2.914 10 0 EFAEHO CCc1cccc(CN(CC)CCNC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)c1 ZINC001403845990 1364993248 /nfs/dbraw/zinc/99/32/48/1364993248.db2.gz BMKJIPGRGYHHFP-VQTJNVASSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1cccc(CN(CC)CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)c1 ZINC001403845990 1364993250 /nfs/dbraw/zinc/99/32/50/1364993250.db2.gz BMKJIPGRGYHHFP-VQTJNVASSA-N 1 3 345.531 2.917 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@H+](C)Cc1ccc(C2CCC2)cc1)N(C)C ZINC001437515757 1387716774 /nfs/dbraw/zinc/71/67/74/1387716774.db2.gz DFGOCVSEIZJTAG-IBGZPJMESA-N 1 3 331.504 2.842 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@@H+](C)Cc1ccc(C2CCC2)cc1)N(C)C ZINC001437515757 1387716778 /nfs/dbraw/zinc/71/67/78/1387716778.db2.gz DFGOCVSEIZJTAG-IBGZPJMESA-N 1 3 331.504 2.842 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21)Cc1cccc(C)c1 ZINC001403934233 1365064410 /nfs/dbraw/zinc/06/44/10/1365064410.db2.gz YFMBLULCNJLVBM-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21)Cc1cccc(C)c1 ZINC001403934233 1365064414 /nfs/dbraw/zinc/06/44/14/1365064414.db2.gz YFMBLULCNJLVBM-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO CC(C)C[NH+]1CCC([C@H](C)NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001403993453 1365144330 /nfs/dbraw/zinc/14/43/30/1365144330.db2.gz FRRARQYUOYLVTB-INIZCTEOSA-N 1 3 325.541 2.837 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C1CC[NH+](Cc2ccsc2)CC1 ZINC001404010262 1365164227 /nfs/dbraw/zinc/16/42/27/1365164227.db2.gz QDFHRJCYYXVTKR-HNNXBMFYSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)CC[NH2+]C1CC(N(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001404031937 1365191377 /nfs/dbraw/zinc/19/13/77/1365191377.db2.gz XIIZNMSSJIWEDC-LADRWXRNSA-N 1 3 341.515 2.824 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC001404090259 1365250657 /nfs/dbraw/zinc/25/06/57/1365250657.db2.gz ULGJPWJGNCSPLB-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC001404090259 1365250665 /nfs/dbraw/zinc/25/06/65/1365250665.db2.gz ULGJPWJGNCSPLB-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO CN(CCNC(=O)[C@H]1CCC[C@H]2CCC[N@@H+]21)Cc1ccc(CF)cc1 ZINC001437528543 1387732760 /nfs/dbraw/zinc/73/27/60/1387732760.db2.gz BFMIWECZABLFJY-RBUKOAKNSA-N 1 3 347.478 2.721 10 0 EFAEHO CN(CCNC(=O)[C@H]1CCC[C@H]2CCC[N@H+]21)Cc1ccc(CF)cc1 ZINC001437528543 1387732764 /nfs/dbraw/zinc/73/27/64/1387732764.db2.gz BFMIWECZABLFJY-RBUKOAKNSA-N 1 3 347.478 2.721 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN[C@@H](C)c2ccccc2F)CC[N@@H+]1C ZINC001404330284 1365454685 /nfs/dbraw/zinc/45/46/85/1365454685.db2.gz SQFZPYXKPFYFRM-QILLFSRXSA-N 1 3 335.467 2.665 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN[C@@H](C)c2ccccc2F)CC[N@H+]1C ZINC001404330284 1365454688 /nfs/dbraw/zinc/45/46/88/1365454688.db2.gz SQFZPYXKPFYFRM-QILLFSRXSA-N 1 3 335.467 2.665 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](CCCC(C)(C)C)C1)N(C)C ZINC001404538425 1365637119 /nfs/dbraw/zinc/63/71/19/1365637119.db2.gz UILPGTCYAJOCGZ-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](CCCC(C)(C)C)C1)N(C)C ZINC001404538425 1365637122 /nfs/dbraw/zinc/63/71/22/1365637122.db2.gz UILPGTCYAJOCGZ-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)cc1F ZINC001404548590 1365641935 /nfs/dbraw/zinc/64/19/35/1365641935.db2.gz MWTUDYFJCTZTNO-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)cc1F ZINC001404548590 1365641940 /nfs/dbraw/zinc/64/19/40/1365641940.db2.gz MWTUDYFJCTZTNO-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001405000426 1365961681 /nfs/dbraw/zinc/96/16/81/1365961681.db2.gz YKWSZRQJZCGZPQ-PMPSAXMXSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001405000426 1365961685 /nfs/dbraw/zinc/96/16/85/1365961685.db2.gz YKWSZRQJZCGZPQ-PMPSAXMXSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@H+](C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001405060526 1365993517 /nfs/dbraw/zinc/99/35/17/1365993517.db2.gz YKWSZRQJZCGZPQ-OAGGEKHMSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001405060526 1365993519 /nfs/dbraw/zinc/99/35/19/1365993519.db2.gz YKWSZRQJZCGZPQ-OAGGEKHMSA-N 1 3 345.478 2.589 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)[C@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001405163501 1366071941 /nfs/dbraw/zinc/07/19/41/1366071941.db2.gz ZMFJSDJLOXYUER-FQEVSTJZSA-N 1 3 343.515 2.939 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)[C@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001405163501 1366071945 /nfs/dbraw/zinc/07/19/45/1366071945.db2.gz ZMFJSDJLOXYUER-FQEVSTJZSA-N 1 3 343.515 2.939 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)[NH2+]Cc1ccc(F)c(F)c1 ZINC001405246679 1366117034 /nfs/dbraw/zinc/11/70/34/1366117034.db2.gz DQQKYWCZGMUQJP-YOEHRIQHSA-N 1 3 341.446 2.535 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](CC)[NH2+]CC1CC2(CCC2)C1 ZINC001405260341 1366122459 /nfs/dbraw/zinc/12/24/59/1366122459.db2.gz TXEPIELCBBBQBH-MSOLQXFVSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001405304393 1366140850 /nfs/dbraw/zinc/14/08/50/1366140850.db2.gz MTVNGGZLXWKLOC-JXFKEZNVSA-N 1 3 343.515 2.502 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H](C(C)C)[NH+]1CCCCC1)NCc1ccccn1 ZINC001405367788 1366166561 /nfs/dbraw/zinc/16/65/61/1366166561.db2.gz KZXVELCWQXOLSU-PKOBYXMFSA-N 1 3 346.519 2.577 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CCCN2C(C)C)CC1 ZINC001405522644 1366265594 /nfs/dbraw/zinc/26/55/94/1366265594.db2.gz RGPYJYSBLDHTHF-VQHPVUNQSA-N 1 3 327.488 2.624 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[C@H]([NH2+]Cc2ccsc2)CC1)N(C)C ZINC001405528567 1366272204 /nfs/dbraw/zinc/27/22/04/1366272204.db2.gz YRUZYQIITZFFML-BRWVUGGUSA-N 1 3 337.533 2.851 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCCC1CCN(C/C=C/Cl)CC1 ZINC001405557421 1366293793 /nfs/dbraw/zinc/29/37/93/1366293793.db2.gz HXKIFOWQYXUTIY-DFIVBLOKSA-N 1 3 341.927 2.832 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCCC1CCN(C/C=C/Cl)CC1 ZINC001405557421 1366293799 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2.589 10 0 EFAEHO Cc1cccnc1CNC[C@@H](C)N(C)C(=O)[C@@H]1CCCC[N@@H+]1C(C)C ZINC001405868308 1366477332 /nfs/dbraw/zinc/47/73/32/1366477332.db2.gz UAEUSWZMNDDHMM-MJGOQNOKSA-N 1 3 346.519 2.589 10 0 EFAEHO Cc1cccnc1CNC[C@H](C)N(C)C(=O)[C@H]1CCCC[N@H+]1C(C)C ZINC001405868310 1366477586 /nfs/dbraw/zinc/47/75/86/1366477586.db2.gz UAEUSWZMNDDHMM-PKOBYXMFSA-N 1 3 346.519 2.589 10 0 EFAEHO Cc1cccnc1CNC[C@H](C)N(C)C(=O)[C@H]1CCCC[N@@H+]1C(C)C ZINC001405868310 1366477587 /nfs/dbraw/zinc/47/75/87/1366477587.db2.gz UAEUSWZMNDDHMM-PKOBYXMFSA-N 1 3 346.519 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CC2CC3(CCC3)C2)[C@H](C)C1 ZINC001405967859 1367022953 /nfs/dbraw/zinc/02/29/53/1367022953.db2.gz KJKZPLBSVKGRIS-AEFFLSMTSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)CCC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001405969754 1367024692 /nfs/dbraw/zinc/02/46/92/1367024692.db2.gz ITJWZTKSDPFCKE-MRXNPFEDSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)CCC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001405969754 1367024699 /nfs/dbraw/zinc/02/46/99/1367024699.db2.gz ITJWZTKSDPFCKE-MRXNPFEDSA-N 1 3 341.515 2.779 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)CCN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001406103124 1367230141 /nfs/dbraw/zinc/23/01/41/1367230141.db2.gz HNAGBGHUWQTJSA-INIZCTEOSA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)CCN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001406103124 1367230143 /nfs/dbraw/zinc/23/01/43/1367230143.db2.gz HNAGBGHUWQTJSA-INIZCTEOSA-N 1 3 347.503 2.631 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)Cc1ccc(C2CC2)cc1 ZINC001406178343 1367375998 /nfs/dbraw/zinc/37/59/98/1367375998.db2.gz RLPBQOWCZRGQDA-UHFFFAOYSA-N 1 3 331.504 2.794 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)Cc1ccc(C2CC2)cc1 ZINC001406178343 1367376006 /nfs/dbraw/zinc/37/60/06/1367376006.db2.gz RLPBQOWCZRGQDA-UHFFFAOYSA-N 1 3 331.504 2.794 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCC[C@@H]2NC(=O)CN(C)C(C)C)cc1F ZINC001406181121 1367378473 /nfs/dbraw/zinc/37/84/73/1367378473.db2.gz ATNWUUVDHOFBNJ-MJGOQNOKSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2CC2CC(C)(C)C2)C1 ZINC001406203109 1367400200 /nfs/dbraw/zinc/40/02/00/1367400200.db2.gz YZSPHEVGCSHKER-MSOLQXFVSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2CC2CC(C)(C)C2)C1 ZINC001406203109 1367400205 /nfs/dbraw/zinc/40/02/05/1367400205.db2.gz YZSPHEVGCSHKER-MSOLQXFVSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1ccccc1Cl ZINC001406349875 1367513233 /nfs/dbraw/zinc/51/32/33/1367513233.db2.gz DBZHEQWSMKKDCW-RHSMWYFYSA-N 1 3 337.895 2.807 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1ccccc1Cl ZINC001406349875 1367513236 /nfs/dbraw/zinc/51/32/36/1367513236.db2.gz DBZHEQWSMKKDCW-RHSMWYFYSA-N 1 3 337.895 2.807 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CC1CCC(F)(F)CC1 ZINC001406356728 1367518931 /nfs/dbraw/zinc/51/89/31/1367518931.db2.gz YGJLFRYDPMDJSH-GDBMZVCRSA-N 1 3 345.478 2.779 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]Cc1ccc2ccccc2c1)N(C)C ZINC001406378324 1367535416 /nfs/dbraw/zinc/53/54/16/1367535416.db2.gz IZCMLFWVGPUSGG-DNVCBOLYSA-N 1 3 327.472 2.774 10 0 EFAEHO C[C@H](C[NH2+]CC1CC(C)(C)C1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001406399186 1367547261 /nfs/dbraw/zinc/54/72/61/1367547261.db2.gz IMSDUJNFOREKEX-AUUYWEPGSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)NC(=O)CC[NH+]2CCCCC2)n1 ZINC001406428561 1367580279 /nfs/dbraw/zinc/58/02/79/1367580279.db2.gz GNSBPCQODKYIFF-QGZVFWFLSA-N 1 3 346.519 2.675 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)C23CCC[NH+](CCC2)C3)c1 ZINC001406503698 1367659488 /nfs/dbraw/zinc/65/94/88/1367659488.db2.gz SCUGTQQAAJHXAQ-INIZCTEOSA-N 1 3 347.478 2.604 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@H]2CCCC[N@@H+]2C(C)C)c1 ZINC001406533181 1367695631 /nfs/dbraw/zinc/69/56/31/1367695631.db2.gz NYPPZWLGDXTCAR-QFBILLFUSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@H]2CCCC[N@H+]2C(C)C)c1 ZINC001406533181 1367695637 /nfs/dbraw/zinc/69/56/37/1367695637.db2.gz NYPPZWLGDXTCAR-QFBILLFUSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001406699299 1367944283 /nfs/dbraw/zinc/94/42/83/1367944283.db2.gz RNRMROPNJMFYHC-JSGCOSHPSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001406699299 1367944286 /nfs/dbraw/zinc/94/42/86/1367944286.db2.gz RNRMROPNJMFYHC-JSGCOSHPSA-N 1 3 342.434 2.523 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC001406712898 1367964077 /nfs/dbraw/zinc/96/40/77/1367964077.db2.gz FHXSMBSSMJIHHU-HNAYVOBHSA-N 1 3 349.494 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC001406712898 1367964082 /nfs/dbraw/zinc/96/40/82/1367964082.db2.gz FHXSMBSSMJIHHU-HNAYVOBHSA-N 1 3 349.494 2.980 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCCC[C@@H]1CNC/C(Cl)=C/Cl ZINC001406719826 1367969129 /nfs/dbraw/zinc/96/91/29/1367969129.db2.gz NWEAHHRPDGHRQH-XWJOTYRJSA-N 1 3 336.307 2.522 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCCC[C@@H]1C[NH2+]Cc1ccsc1)C1CCC1 ZINC001406720799 1367970060 /nfs/dbraw/zinc/97/00/60/1367970060.db2.gz PCLQFXBJIREXMI-SJLPKXTDSA-N 1 3 349.544 2.997 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]Cc1ccc(F)cc1)C1CC1 ZINC001406760606 1368014127 /nfs/dbraw/zinc/01/41/27/1368014127.db2.gz LDCWSKPWHGKURY-RTBURBONSA-N 1 3 347.478 2.685 10 0 EFAEHO C[C@@H](C(=O)N[C@@H](C[NH2+]Cc1ccsc1)C1CC1)N1CCCCCC1 ZINC001406793704 1368060278 /nfs/dbraw/zinc/06/02/78/1368060278.db2.gz UGAMAKRTJJQNBP-YJBOKZPZSA-N 1 3 349.544 2.997 10 0 EFAEHO CCC(CC)C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)C[C@H]1CC ZINC001406803800 1368075430 /nfs/dbraw/zinc/07/54/30/1368075430.db2.gz HOAPYLRIGOZUNL-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]Cc1ccccc1Cl)C1CC1 ZINC001406830019 1368105019 /nfs/dbraw/zinc/10/50/19/1368105019.db2.gz RMTNENKGOLCAQI-QGZVFWFLSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+][C@@H](C)c1cccc(F)c1)C1CC1 ZINC001406841017 1368115116 /nfs/dbraw/zinc/11/51/16/1368115116.db2.gz ZVBLLECGTFFIMW-KBXCAEBGSA-N 1 3 335.467 2.711 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)[C@H]2CC[N@@H+](C3CCCCC3)C2)CC1 ZINC001406915513 1368205410 /nfs/dbraw/zinc/20/54/10/1368205410.db2.gz DQRSVUANUYOHST-HOTGVXAUSA-N 1 3 339.499 2.628 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)[C@H]2CC[N@H+](C3CCCCC3)C2)CC1 ZINC001406915513 1368205417 /nfs/dbraw/zinc/20/54/17/1368205417.db2.gz DQRSVUANUYOHST-HOTGVXAUSA-N 1 3 339.499 2.628 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)[C@@H]2CC[N@@H+](C3CCCCC3)C2)CC1 ZINC001406915502 1368206144 /nfs/dbraw/zinc/20/61/44/1368206144.db2.gz DQRSVUANUYOHST-CVEARBPZSA-N 1 3 339.499 2.628 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)[C@@H]2CC[N@H+](C3CCCCC3)C2)CC1 ZINC001406915502 1368206147 /nfs/dbraw/zinc/20/61/47/1368206147.db2.gz DQRSVUANUYOHST-CVEARBPZSA-N 1 3 339.499 2.628 10 0 EFAEHO C[C@@H](NC1(CNC(=O)C23CCC[NH+]2CCC3)CC1)c1cccc(F)c1 ZINC001406940319 1368231650 /nfs/dbraw/zinc/23/16/50/1368231650.db2.gz WLZCJVMLZKLTKO-OAHLLOKOSA-N 1 3 345.462 2.754 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]Cc3ccc(C4CC4)cc3)CC2)CCC1 ZINC001406947667 1368236413 /nfs/dbraw/zinc/23/64/13/1368236413.db2.gz RNDDEJROBZPNMF-UHFFFAOYSA-N 1 3 341.499 2.787 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)[C@@H]2CCCC[N@@H+]2C2CCCC2)CC1 ZINC001406958653 1368248702 /nfs/dbraw/zinc/24/87/02/1368248702.db2.gz QEVQRECETYMMLG-WBVHZDCISA-N 1 3 339.499 2.770 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)[C@@H]2CCCC[N@H+]2C2CCCC2)CC1 ZINC001406958653 1368248706 /nfs/dbraw/zinc/24/87/06/1368248706.db2.gz QEVQRECETYMMLG-WBVHZDCISA-N 1 3 339.499 2.770 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1(N[C@@H](C)c2ccc(F)c(F)c2)CC1 ZINC001406977382 1368270823 /nfs/dbraw/zinc/27/08/23/1368270823.db2.gz ASOPOUHTSQDJRC-ZDUSSCGKSA-N 1 3 339.430 2.606 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1(N[C@@H](C)c2ccc(F)c(F)c2)CC1 ZINC001406977382 1368270827 /nfs/dbraw/zinc/27/08/27/1368270827.db2.gz ASOPOUHTSQDJRC-ZDUSSCGKSA-N 1 3 339.430 2.606 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](CC[C@@H](C)F)CC2CC2)CC1 ZINC001407019189 1368332405 /nfs/dbraw/zinc/33/24/05/1368332405.db2.gz FNNIGNXUQFWJOG-MRXNPFEDSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](CC[C@@H](C)F)CC2CC2)CC1 ZINC001407019189 1368332407 /nfs/dbraw/zinc/33/24/07/1368332407.db2.gz FNNIGNXUQFWJOG-MRXNPFEDSA-N 1 3 341.515 2.778 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CC[C@]2(C1)CCCN(C[C@@H](F)CC)C2 ZINC001407026173 1368342618 /nfs/dbraw/zinc/34/26/18/1368342618.db2.gz UNZRKEATRXSZQY-PKOBYXMFSA-N 1 3 341.515 2.781 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CC[C@]2(C1)CCCN(C[C@@H](F)CC)C2 ZINC001407026173 1368342620 /nfs/dbraw/zinc/34/26/20/1368342620.db2.gz UNZRKEATRXSZQY-PKOBYXMFSA-N 1 3 341.515 2.781 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C[C@@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001407104338 1368429125 /nfs/dbraw/zinc/42/91/25/1368429125.db2.gz HEYNJJCZINCXQB-WMZOPIPTSA-N 1 3 347.503 2.677 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+][C@H](C)c1ccccc1F ZINC001407115101 1368442977 /nfs/dbraw/zinc/44/29/77/1368442977.db2.gz YXVVOWRKSURJNL-CVEARBPZSA-N 1 3 335.467 2.808 10 0 EFAEHO CC[C@H](C(=O)NCC1(C)CC[NH+](CCC(C)(C)C)CC1)N(C)C ZINC001407262029 1368669691 /nfs/dbraw/zinc/66/96/91/1368669691.db2.gz XZMIKJOMFXDQON-MRXNPFEDSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@@](C)(CNC(=O)CC2CC[NH+](C)CC2)C1 ZINC001407288360 1368711260 /nfs/dbraw/zinc/71/12/60/1368711260.db2.gz DJNCROPQDRNFQR-MJGOQNOKSA-N 1 3 341.515 2.685 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@@](C)(CNC(=O)C(C)(C)[NH+]2CCCC2)C1 ZINC001407289093 1368712425 /nfs/dbraw/zinc/71/24/25/1368712425.db2.gz CQVHDASUOCUMBD-APWZRJJASA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@](C)(CNC(=O)C(C)(C)[NH+]2CCCC2)C1 ZINC001407289110 1368712436 /nfs/dbraw/zinc/71/24/36/1368712436.db2.gz CQVHDASUOCUMBD-VQIMIIECSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@]1(C)CCC[N@H+](CCC(C)(C)C)C1)N(C)C ZINC001407290095 1368713489 /nfs/dbraw/zinc/71/34/89/1368713489.db2.gz CMFUPAJPZHEFNV-QFBILLFUSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CCC(C)(C)C)C1)N(C)C ZINC001407290095 1368713495 /nfs/dbraw/zinc/71/34/95/1368713495.db2.gz CMFUPAJPZHEFNV-QFBILLFUSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CC(C)(C)C1)C2 ZINC001407489721 1368905472 /nfs/dbraw/zinc/90/54/72/1368905472.db2.gz CYYHMEVAIBWEKE-SZMVWBNQSA-N 1 3 335.536 2.732 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CC1CC(C)(C)C1)C2 ZINC001407489721 1368905475 /nfs/dbraw/zinc/90/54/75/1368905475.db2.gz CYYHMEVAIBWEKE-SZMVWBNQSA-N 1 3 335.536 2.732 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCN(Cc2cccc(F)c2)C1 ZINC001437721537 1387969149 /nfs/dbraw/zinc/96/91/49/1387969149.db2.gz YTBHSKNGUJGRJV-MJGOQNOKSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCN(Cc2cccc(F)c2)C1 ZINC001437721537 1387969152 /nfs/dbraw/zinc/96/91/52/1387969152.db2.gz YTBHSKNGUJGRJV-MJGOQNOKSA-N 1 3 347.478 2.638 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2ccc(CF)cc2)C1 ZINC001407531012 1368945234 /nfs/dbraw/zinc/94/52/34/1368945234.db2.gz HISALESVEAOZPB-LPHOPBHVSA-N 1 3 349.494 2.682 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1C ZINC001407564501 1368993393 /nfs/dbraw/zinc/99/33/93/1368993393.db2.gz WDKCGIVTWRHWJI-QUCCMNQESA-N 1 3 345.531 2.970 10 0 EFAEHO CCc1cccc(C[N@@H+]2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001437728172 1387977923 /nfs/dbraw/zinc/97/79/23/1387977923.db2.gz OVSISGMQSZZRTF-FXAWDEMLSA-N 1 3 343.515 2.529 10 0 EFAEHO CCc1cccc(C[N@H+]2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001437728172 1387977929 /nfs/dbraw/zinc/97/79/29/1387977929.db2.gz OVSISGMQSZZRTF-FXAWDEMLSA-N 1 3 343.515 2.529 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC[C@@H]1CCN(Cc2cc(C)ccc2F)C1 ZINC001437732177 1387980469 /nfs/dbraw/zinc/98/04/69/1387980469.db2.gz CKPWJKLTBURWMY-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC[C@@H]1CCN(Cc2cc(C)ccc2F)C1 ZINC001437732177 1387980471 /nfs/dbraw/zinc/98/04/71/1387980471.db2.gz CKPWJKLTBURWMY-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[C@@H](F)CN1CCC2(CN(C(=O)[C@@H](CC)[NH+](CC)CC)C2)CC1 ZINC001407714769 1369152229 /nfs/dbraw/zinc/15/22/29/1369152229.db2.gz IZQJNIGGHBXJKT-IAGOWNOFSA-N 1 3 341.515 2.779 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001407789344 1369234447 /nfs/dbraw/zinc/23/44/47/1369234447.db2.gz ZUXUMMNLWARQTH-IRXDYDNUSA-N 1 3 347.528 2.894 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001407789344 1369234452 /nfs/dbraw/zinc/23/44/52/1369234452.db2.gz ZUXUMMNLWARQTH-IRXDYDNUSA-N 1 3 347.528 2.894 10 0 EFAEHO CC[C@H](F)CN1CCC[C@@H](NC(=O)CCC[NH+]2CCCC2)CC1 ZINC001407883265 1369346923 /nfs/dbraw/zinc/34/69/23/1369346923.db2.gz IDPDEKSFNFGHHR-DLBZAZTESA-N 1 3 327.488 2.581 10 0 EFAEHO Cc1ncccc1CN(C)CCCN(C)C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001407899559 1369366311 /nfs/dbraw/zinc/36/63/11/1369366311.db2.gz KUMCXHJIAVVJEH-LJQANCHMSA-N 1 3 346.519 2.545 10 0 EFAEHO Cc1ncccc1CN(C)CCCN(C)C(=O)CC[C@H]1CCC[N@H+]1C ZINC001407899559 1369366316 /nfs/dbraw/zinc/36/63/16/1369366316.db2.gz KUMCXHJIAVVJEH-LJQANCHMSA-N 1 3 346.519 2.545 10 0 EFAEHO CN(CCC[N@H+](C)C[C@H]1CCC(F)(F)C1)C(=O)CN(C)C1CCC1 ZINC001407926571 1369413311 /nfs/dbraw/zinc/41/33/11/1369413311.db2.gz YNOIJDJBJMBXIM-HNNXBMFYSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCC[N@@H+](C)C[C@H]1CCC(F)(F)C1)C(=O)CN(C)C1CCC1 ZINC001407926571 1369413313 /nfs/dbraw/zinc/41/33/13/1369413313.db2.gz YNOIJDJBJMBXIM-HNNXBMFYSA-N 1 3 345.478 2.686 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)CCCN(C)C(=O)CN2CCCC2)c(C)c1 ZINC001407945186 1369442292 /nfs/dbraw/zinc/44/22/92/1369442292.db2.gz ACGIUVDQNXGOLV-UHFFFAOYSA-N 1 3 345.531 2.988 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)CCCN(C)C(=O)CN2CCCC2)c(C)c1 ZINC001407945186 1369442296 /nfs/dbraw/zinc/44/22/96/1369442296.db2.gz ACGIUVDQNXGOLV-UHFFFAOYSA-N 1 3 345.531 2.988 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N(C)CCCN(C)CCC(F)(F)F ZINC001407952991 1369454284 /nfs/dbraw/zinc/45/42/84/1369454284.db2.gz BOFOEVGERAQXEK-OKILXGFUSA-N 1 3 337.430 2.592 10 0 EFAEHO CCC1([NH2+]Cc2cccc(C)c2)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001407963336 1369469169 /nfs/dbraw/zinc/46/91/69/1369469169.db2.gz JDCPWJPJLWYXMB-IBGZPJMESA-N 1 3 343.515 2.950 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001408004434 1369517754 /nfs/dbraw/zinc/51/77/54/1369517754.db2.gz DSRAVYIYLJHAKM-NRFANRHFSA-N 1 3 343.515 2.843 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001408004434 1369517758 /nfs/dbraw/zinc/51/77/58/1369517758.db2.gz DSRAVYIYLJHAKM-NRFANRHFSA-N 1 3 343.515 2.843 10 0 EFAEHO CN(C)C1(C(=O)N2CCC(C)([NH2+]CC=C(Cl)Cl)CC2)CCC1 ZINC001408108368 1369613999 /nfs/dbraw/zinc/61/39/99/1369613999.db2.gz IXCKLROXKDZAFG-UHFFFAOYSA-N 1 3 348.318 2.760 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)C2(C[NH+](C)C)CC2)CCN1Cc1ccsc1 ZINC001408179407 1369685568 /nfs/dbraw/zinc/68/55/68/1369685568.db2.gz JBBKZPUAWIHMLE-HOCLYGCPSA-N 1 3 335.517 2.559 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCC[C@H]1C[N@H+](C)CCC1CC1 ZINC001408357890 1369870409 /nfs/dbraw/zinc/87/04/09/1369870409.db2.gz SJUJJRBGFXIDQG-RBUKOAKNSA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCC[C@H]1C[N@@H+](C)CCC1CC1 ZINC001408357890 1369870417 /nfs/dbraw/zinc/87/04/17/1369870417.db2.gz SJUJJRBGFXIDQG-RBUKOAKNSA-N 1 3 335.536 2.972 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN(C)C(C)C)[C@@H]1CCc2ccccc21 ZINC001437766771 1388040862 /nfs/dbraw/zinc/04/08/62/1388040862.db2.gz ICJQJFWIIVHRJK-LJQANCHMSA-N 1 3 331.504 2.842 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN(C)C(C)C)[C@@H]1CCc2ccccc21 ZINC001437766771 1388040870 /nfs/dbraw/zinc/04/08/70/1388040870.db2.gz ICJQJFWIIVHRJK-LJQANCHMSA-N 1 3 331.504 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C[C@H]1CCCC(F)(F)C1)C1CC1 ZINC001437815351 1388111106 /nfs/dbraw/zinc/11/11/06/1388111106.db2.gz UNZKIPDWSCUYPU-HNNXBMFYSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C[C@H]1CCCC(F)(F)C1)C1CC1 ZINC001437815351 1388111109 /nfs/dbraw/zinc/11/11/09/1388111109.db2.gz UNZKIPDWSCUYPU-HNNXBMFYSA-N 1 3 345.478 2.733 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NCCN(Cc2ccc(CF)cc2)C2CC2)C1 ZINC001437819125 1388115427 /nfs/dbraw/zinc/11/54/27/1388115427.db2.gz XVZGFEFUHOFIAB-SFHVURJKSA-N 1 3 347.478 2.579 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NCCN(Cc2ccc(CF)cc2)C2CC2)C1 ZINC001437819125 1388115433 /nfs/dbraw/zinc/11/54/33/1388115433.db2.gz XVZGFEFUHOFIAB-SFHVURJKSA-N 1 3 347.478 2.579 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NCCN(Cc2ccc(CF)cc2)C2CC2)C1 ZINC001437819116 1388116210 /nfs/dbraw/zinc/11/62/10/1388116210.db2.gz XVZGFEFUHOFIAB-GOSISDBHSA-N 1 3 347.478 2.579 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NCCN(Cc2ccc(CF)cc2)C2CC2)C1 ZINC001437819116 1388116216 /nfs/dbraw/zinc/11/62/16/1388116216.db2.gz XVZGFEFUHOFIAB-GOSISDBHSA-N 1 3 347.478 2.579 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+]CC1CC(C)C1)c1ccccc1 ZINC001437867571 1388156178 /nfs/dbraw/zinc/15/61/78/1388156178.db2.gz DEZIMVPRKNGRFV-TVPLGVNVSA-N 1 3 331.504 2.820 10 0 EFAEHO CN(C)CCN(CCc1ccccc1)C(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001417613533 1373092851 /nfs/dbraw/zinc/09/28/51/1373092851.db2.gz FGICTZYRBNGELW-VQTJNVASSA-N 1 3 343.515 2.636 10 0 EFAEHO CN(C)CCN(CCc1ccccc1)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001417613533 1373092857 /nfs/dbraw/zinc/09/28/57/1373092857.db2.gz FGICTZYRBNGELW-VQTJNVASSA-N 1 3 343.515 2.636 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)CN1Cc1ccccc1 ZINC001417670674 1373141580 /nfs/dbraw/zinc/14/15/80/1373141580.db2.gz CAMFTHYUXISDJW-BTHPGYMESA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)CN1Cc1ccccc1 ZINC001417670674 1373141585 /nfs/dbraw/zinc/14/15/85/1373141585.db2.gz CAMFTHYUXISDJW-BTHPGYMESA-N 1 3 341.499 2.783 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]([NH2+]CCc2cccs2)C1)N1CCCC1 ZINC001417797344 1373263917 /nfs/dbraw/zinc/26/39/17/1373263917.db2.gz OBVBOVSNSSRMIF-WKILWMFISA-N 1 3 349.544 2.649 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+]Cc2cccc(Cl)c2)C1 ZINC001417801955 1373271179 /nfs/dbraw/zinc/27/11/79/1373271179.db2.gz JXMVIXDPTCJQKN-JCNLHEQBSA-N 1 3 337.895 2.665 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(C)cc2)C1)N(C)C ZINC001417815373 1373286715 /nfs/dbraw/zinc/28/67/15/1373286715.db2.gz STBVVCGJKXJOLD-OTWHNJEPSA-N 1 3 331.504 2.710 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(C)cc2)C1)N(C)C ZINC001417815366 1373287136 /nfs/dbraw/zinc/28/71/36/1373287136.db2.gz STBVVCGJKXJOLD-IPMKNSEASA-N 1 3 331.504 2.710 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@H](CCNC(=O)CN3CC[C@@H](C)C3)C2)cs1 ZINC001437941090 1388253333 /nfs/dbraw/zinc/25/33/33/1388253333.db2.gz OHFRCMBRKRAXRU-WBVHZDCISA-N 1 3 349.544 2.727 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@H](CCNC(=O)CN3CC[C@@H](C)C3)C2)cs1 ZINC001437941090 1388253334 /nfs/dbraw/zinc/25/33/34/1388253334.db2.gz OHFRCMBRKRAXRU-WBVHZDCISA-N 1 3 349.544 2.727 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2[N@@H+](CC2CCCC2)C1 ZINC001417823804 1373299508 /nfs/dbraw/zinc/29/95/08/1373299508.db2.gz STWCUYVYDPYUEC-MUGJNUQGSA-N 1 3 347.547 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2[N@H+](CC2CCCC2)C1 ZINC001417823804 1373299513 /nfs/dbraw/zinc/29/95/13/1373299513.db2.gz STWCUYVYDPYUEC-MUGJNUQGSA-N 1 3 347.547 2.686 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2C[C@@H]3C[N@@H+](CCCC(C)(C)C)CC[C@@H]3C2)C1 ZINC001417831937 1373310661 /nfs/dbraw/zinc/31/06/61/1373310661.db2.gz MEKPUPPHVLYPMV-QRVBRYPASA-N 1 3 349.563 2.935 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2C[C@@H]3C[N@H+](CCCC(C)(C)C)CC[C@@H]3C2)C1 ZINC001417831937 1373310666 /nfs/dbraw/zinc/31/06/66/1373310666.db2.gz MEKPUPPHVLYPMV-QRVBRYPASA-N 1 3 349.563 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCCC[C@@H]([NH2+]Cc2ccccc2)C1 ZINC001417838158 1373317511 /nfs/dbraw/zinc/31/75/11/1373317511.db2.gz OMENPOZZJNPBKQ-LJQANCHMSA-N 1 3 331.504 2.888 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2CC[N@H+](CCCC(C)(C)C)C2)C1 ZINC001437942060 1388255246 /nfs/dbraw/zinc/25/52/46/1388255246.db2.gz QOWKIGWUVYOXBM-QZTJIDSGSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2CC[N@@H+](CCCC(C)(C)C)C2)C1 ZINC001437942060 1388255249 /nfs/dbraw/zinc/25/52/49/1388255249.db2.gz QOWKIGWUVYOXBM-QZTJIDSGSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CCC[NH+](C)C)CCN1Cc1ccc(CF)cc1 ZINC001417848928 1373332755 /nfs/dbraw/zinc/33/27/55/1373332755.db2.gz JLVGMASYJHIFBR-QAPCUYQASA-N 1 3 335.467 2.577 10 0 EFAEHO CC(C)C[C@@H](C[NH+]1CCCC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001417884216 1373372190 /nfs/dbraw/zinc/37/21/90/1373372190.db2.gz SBCPNGCHFNXCAE-LPHOPBHVSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@@H](C)[NH2+]CCc1ccccc1 ZINC001417893354 1373381109 /nfs/dbraw/zinc/38/11/09/1373381109.db2.gz UJYKAFZSSURHOX-QUCCMNQESA-N 1 3 345.531 2.929 10 0 EFAEHO CC[C@H](C)C[NH+]1CCC2(C[C@H]2NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001417966654 1373466553 /nfs/dbraw/zinc/46/65/53/1373466553.db2.gz VNQBAWIIGDLRAC-DLBZAZTESA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1ccccc1)C1CC1 ZINC001417981582 1373482701 /nfs/dbraw/zinc/48/27/01/1373482701.db2.gz YOGKYWWDGZXAHX-OALUTQOASA-N 1 3 329.488 2.544 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H](C[N@H+](C)C/C=C\Cl)C1 ZINC001418023365 1373537393 /nfs/dbraw/zinc/53/73/93/1373537393.db2.gz VYRFDVWJRBADTG-VTBIRBAPSA-N 1 3 347.906 2.589 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H](C[N@@H+](C)C/C=C\Cl)C1 ZINC001418023365 1373537398 /nfs/dbraw/zinc/53/73/98/1373537398.db2.gz VYRFDVWJRBADTG-VTBIRBAPSA-N 1 3 347.906 2.589 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H]([NH2+][C@H]2CCc3ccc(Cl)cc32)C1)N(C)C ZINC001418063724 1373569055 /nfs/dbraw/zinc/56/90/55/1373569055.db2.gz KIOIRHTXRCTYME-UOVPBQLFSA-N 1 3 349.906 2.904 10 0 EFAEHO CN(CC(=O)N1CCC[C@H]2C[N@H+](CC3CC3)CC[C@H]21)CC(C)(C)C ZINC001418080528 1373585507 /nfs/dbraw/zinc/58/55/07/1373585507.db2.gz CPUFIIRPWMBUEF-ZWKOTPCHSA-N 1 3 335.536 2.687 10 0 EFAEHO CN(CC(=O)N1CCC[C@H]2C[N@@H+](CC3CC3)CC[C@H]21)CC(C)(C)C ZINC001418080528 1373585513 /nfs/dbraw/zinc/58/55/13/1373585513.db2.gz CPUFIIRPWMBUEF-ZWKOTPCHSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2F)C1)N(C)C ZINC001418095945 1373600061 /nfs/dbraw/zinc/60/00/61/1373600061.db2.gz WKUGKNNQGKTROC-AFIMGQEJSA-N 1 3 335.467 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2cc3ccccc3o2)C1 ZINC001418114971 1373619823 /nfs/dbraw/zinc/61/98/23/1373619823.db2.gz XCUAXIVZVVDPCY-IYBDPMFKSA-N 1 3 329.444 2.510 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@H+](CCCC(C)(C)C)C1 ZINC001437963083 1388277674 /nfs/dbraw/zinc/27/76/74/1388277674.db2.gz WSBOPWXGLXQEED-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@@H+](CCCC(C)(C)C)C1 ZINC001437963083 1388277678 /nfs/dbraw/zinc/27/76/78/1388277678.db2.gz WSBOPWXGLXQEED-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@H]1CCC[N@H+](CC2CCC2)C1 ZINC001418173458 1373727417 /nfs/dbraw/zinc/72/74/17/1373727417.db2.gz MGNYQDBZXZXRJA-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@H]1CCC[N@@H+](CC2CCC2)C1 ZINC001418173458 1373727420 /nfs/dbraw/zinc/72/74/20/1373727420.db2.gz MGNYQDBZXZXRJA-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1CCC(NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001418190704 1373755000 /nfs/dbraw/zinc/75/50/00/1373755000.db2.gz KIQSBLPEUBWQAL-QQFBHYJXSA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001418222406 1373777186 /nfs/dbraw/zinc/77/71/86/1373777186.db2.gz PRWMNGXKDWGXHC-HNAYVOBHSA-N 1 3 342.487 2.635 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)NCc1cccc(C(C)C)n1 ZINC001418228155 1373783898 /nfs/dbraw/zinc/78/38/98/1373783898.db2.gz FLYYZDUOIUDEJA-LPHOPBHVSA-N 1 3 346.519 2.674 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)NCc1cccc(C(C)C)n1 ZINC001418228155 1373783910 /nfs/dbraw/zinc/78/39/10/1373783910.db2.gz FLYYZDUOIUDEJA-LPHOPBHVSA-N 1 3 346.519 2.674 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)NCc1cc2ccccc2o1 ZINC001418229790 1373785094 /nfs/dbraw/zinc/78/50/94/1373785094.db2.gz MSEXVLFFJUKGCI-CRAIPNDOSA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)NCc1cc2ccccc2o1 ZINC001418229790 1373785096 /nfs/dbraw/zinc/78/50/96/1373785096.db2.gz MSEXVLFFJUKGCI-CRAIPNDOSA-N 1 3 343.471 2.902 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]Cc1cccc2ccccc21)N(C)C ZINC001418235114 1373790540 /nfs/dbraw/zinc/79/05/40/1373790540.db2.gz KOVKEYOQUQBPJP-HNAYVOBHSA-N 1 3 327.472 2.774 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1)NC/C=C/Cl ZINC001418262689 1373829151 /nfs/dbraw/zinc/82/91/51/1373829151.db2.gz BLBJOEIYVYWYAS-DGNXDGCUSA-N 1 3 327.900 2.630 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1)NC/C=C/Cl ZINC001418262689 1373829157 /nfs/dbraw/zinc/82/91/57/1373829157.db2.gz BLBJOEIYVYWYAS-DGNXDGCUSA-N 1 3 327.900 2.630 10 0 EFAEHO Cc1ccc(CN[C@@H](C)CNC(=O)CCC[NH+]2CCCCC2)c(C)n1 ZINC001418317169 1373896953 /nfs/dbraw/zinc/89/69/53/1373896953.db2.gz USCCKSMMCJOYPX-KRWDZBQOSA-N 1 3 346.519 2.559 10 0 EFAEHO C[C@]1(NC(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)CCN(Cc2ccccc2)C1 ZINC001418345596 1373921060 /nfs/dbraw/zinc/92/10/60/1373921060.db2.gz DLKCMTQLGHWVCQ-DYXWJJEUSA-N 1 3 341.499 2.784 10 0 EFAEHO C[C@]1(NC(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)CCN(Cc2ccccc2)C1 ZINC001418345596 1373921064 /nfs/dbraw/zinc/92/10/64/1373921064.db2.gz DLKCMTQLGHWVCQ-DYXWJJEUSA-N 1 3 341.499 2.784 10 0 EFAEHO CN(CC(=O)N[C@H]1CCC[C@H]([NH2+]Cc2ccsc2)C1)C1CCC1 ZINC001418359415 1373932532 /nfs/dbraw/zinc/93/25/32/1373932532.db2.gz DFEMQCDGIZYZDS-HOTGVXAUSA-N 1 3 335.517 2.749 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H]1CCC[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001418361976 1373934825 /nfs/dbraw/zinc/93/48/25/1373934825.db2.gz SRTUDAIXRPVMKK-OALUTQOASA-N 1 3 349.494 2.991 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1cccc(F)c1 ZINC001418440535 1374029885 /nfs/dbraw/zinc/02/98/85/1374029885.db2.gz HGAABOYBSCVAEG-CRAIPNDOSA-N 1 3 335.467 2.685 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C[C@@H]1CCN1CCC1CC1)[NH+]1CCCCC1 ZINC001418599746 1374249457 /nfs/dbraw/zinc/24/94/57/1374249457.db2.gz IZHLWDXXJBCVLJ-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)Oc1cccc(CN2CCC[C@@H]2CNC(=O)CC[NH+](C)C)c1 ZINC001418630964 1374293700 /nfs/dbraw/zinc/29/37/00/1374293700.db2.gz PNPXJJYZYSJVLS-GOSISDBHSA-N 1 3 347.503 2.506 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C[N@H+](C)CCC(C)(C)C)CC1 ZINC001437999667 1388313738 /nfs/dbraw/zinc/31/37/38/1388313738.db2.gz QVJQTJMHRDRIBW-UHFFFAOYSA-N 1 3 325.541 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C[N@@H+](C)CCC(C)(C)C)CC1 ZINC001437999667 1388313745 /nfs/dbraw/zinc/31/37/45/1388313745.db2.gz QVJQTJMHRDRIBW-UHFFFAOYSA-N 1 3 325.541 2.935 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@@H]([NH2+]Cc2cccc(F)c2)C1)N1CCCC1 ZINC001418643228 1374313256 /nfs/dbraw/zinc/31/32/56/1374313256.db2.gz BYXITZIKMCKXMO-MAEOIBBWSA-N 1 3 347.478 2.685 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1C[C@@H]([NH2+]CCC2CCCCC2)C1 ZINC001418651124 1374321976 /nfs/dbraw/zinc/32/19/76/1374321976.db2.gz XUZRMDMVKZTPIU-CALCHBBNSA-N 1 3 332.492 2.715 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@@H+]([C@@H]2CCc3ccccc32)C1)C1CCC1 ZINC001418656220 1374328282 /nfs/dbraw/zinc/32/82/82/1374328282.db2.gz GTJQFQZOWRHCID-OXJNMPFZSA-N 1 3 341.499 2.596 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@H+]([C@@H]2CCc3ccccc32)C1)C1CCC1 ZINC001418656220 1374328286 /nfs/dbraw/zinc/32/82/86/1374328286.db2.gz GTJQFQZOWRHCID-OXJNMPFZSA-N 1 3 341.499 2.596 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)cc1C ZINC001418669857 1374346965 /nfs/dbraw/zinc/34/69/65/1374346965.db2.gz GBMGLMHPEUUTGR-JXFKEZNVSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)cc1C ZINC001418669857 1374346967 /nfs/dbraw/zinc/34/69/67/1374346967.db2.gz GBMGLMHPEUUTGR-JXFKEZNVSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cc1C ZINC001418669872 1374347222 /nfs/dbraw/zinc/34/72/22/1374347222.db2.gz GBMGLMHPEUUTGR-OXQOHEQNSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cc1C ZINC001418669872 1374347225 /nfs/dbraw/zinc/34/72/25/1374347225.db2.gz GBMGLMHPEUUTGR-OXQOHEQNSA-N 1 3 343.515 2.583 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001418681289 1374363286 /nfs/dbraw/zinc/36/32/86/1374363286.db2.gz IPBUPDMRYGFJJD-SJORKVTESA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001418681289 1374363289 /nfs/dbraw/zinc/36/32/89/1374363289.db2.gz IPBUPDMRYGFJJD-SJORKVTESA-N 1 3 349.906 2.620 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@H+](CC2CCC(C)(C)CC2)C1)N(C)C ZINC001418689698 1374372574 /nfs/dbraw/zinc/37/25/74/1374372574.db2.gz YSTHOSSJQSNCIC-QZTJIDSGSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@@H+](CC2CCC(C)(C)CC2)C1)N(C)C ZINC001418689698 1374372578 /nfs/dbraw/zinc/37/25/78/1374372578.db2.gz YSTHOSSJQSNCIC-QZTJIDSGSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@@H+]([C@H](C)c2cccc(OC)c2)C1 ZINC001418692041 1374374742 /nfs/dbraw/zinc/37/47/42/1374374742.db2.gz QVIKTELWIRWNBP-SJORKVTESA-N 1 3 347.503 2.536 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@H+]([C@H](C)c2cccc(OC)c2)C1 ZINC001418692041 1374374747 /nfs/dbraw/zinc/37/47/47/1374374747.db2.gz QVIKTELWIRWNBP-SJORKVTESA-N 1 3 347.503 2.536 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC001418694463 1374377582 /nfs/dbraw/zinc/37/75/82/1374377582.db2.gz VXJSMLKOTNLPDJ-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC001418694463 1374377585 /nfs/dbraw/zinc/37/75/85/1374377585.db2.gz VXJSMLKOTNLPDJ-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC001418695391 1374378901 /nfs/dbraw/zinc/37/89/01/1374378901.db2.gz CQZFBSZIEXTURU-KXBFYZLASA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC001418695391 1374378906 /nfs/dbraw/zinc/37/89/06/1374378906.db2.gz CQZFBSZIEXTURU-KXBFYZLASA-N 1 3 347.478 2.591 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@@H+]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001418697219 1374382408 /nfs/dbraw/zinc/38/24/08/1374382408.db2.gz IIJMXXHSKAQVHP-QZTJIDSGSA-N 1 3 331.504 2.834 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@H+]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001418697219 1374382411 /nfs/dbraw/zinc/38/24/11/1374382411.db2.gz IIJMXXHSKAQVHP-QZTJIDSGSA-N 1 3 331.504 2.834 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001418701164 1374386451 /nfs/dbraw/zinc/38/64/51/1374386451.db2.gz VKEAUUNQPCFNQO-SFHVURJKSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001418701164 1374386455 /nfs/dbraw/zinc/38/64/55/1374386455.db2.gz VKEAUUNQPCFNQO-SFHVURJKSA-N 1 3 331.504 2.582 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]C[C@H]2CCC(F)(F)C2)C1 ZINC001418731870 1374434085 /nfs/dbraw/zinc/43/40/85/1374434085.db2.gz UISOCFYNIIRBLS-HRCADAONSA-N 1 3 345.478 2.637 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN(C)C(C)C)[C@H]1CCc2c1cccc2F ZINC001418738489 1374441163 /nfs/dbraw/zinc/44/11/63/1374441163.db2.gz BUSSYHREXFADHN-IBGZPJMESA-N 1 3 349.494 2.981 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN(C)C(C)C)[C@H]1CCc2c1cccc2F ZINC001418738489 1374441168 /nfs/dbraw/zinc/44/11/68/1374441168.db2.gz BUSSYHREXFADHN-IBGZPJMESA-N 1 3 349.494 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CCC(C)(C)C ZINC001418739071 1374442961 /nfs/dbraw/zinc/44/29/61/1374442961.db2.gz LKFZTZDBWXVYBC-RDGPPVDQSA-N 1 3 349.563 2.933 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CCC(C)(C)C ZINC001418739071 1374442962 /nfs/dbraw/zinc/44/29/62/1374442962.db2.gz LKFZTZDBWXVYBC-RDGPPVDQSA-N 1 3 349.563 2.933 10 0 EFAEHO CCC(CC)C[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN1CC[C@H](C)C1 ZINC001418742176 1374446162 /nfs/dbraw/zinc/44/61/62/1374446162.db2.gz NTEIFUBTQMOFMH-AOIWGVFYSA-N 1 3 337.552 2.981 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001418767013 1374476618 /nfs/dbraw/zinc/47/66/18/1374476618.db2.gz LBXHLTMQAVEHLT-UXHICEINSA-N 1 3 341.499 2.784 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001418767013 1374476620 /nfs/dbraw/zinc/47/66/20/1374476620.db2.gz LBXHLTMQAVEHLT-UXHICEINSA-N 1 3 341.499 2.784 10 0 EFAEHO C[NH+](C)CCC(=O)NCCN(C1CC1)[C@@H]1CCc2ccc(Cl)cc21 ZINC001418779302 1374490760 /nfs/dbraw/zinc/49/07/60/1374490760.db2.gz QHBFQPJJSBWGIW-GOSISDBHSA-N 1 3 349.906 2.860 10 0 EFAEHO CN(CC(=O)NCC[N@H+](C[C@@H]1CC[C@@H]2C[C@@H]2C1)C1CC1)CC(C)(C)C ZINC001418786260 1374499454 /nfs/dbraw/zinc/49/94/54/1374499454.db2.gz JNDQZKVEUVEPMX-KURKYZTESA-N 1 3 349.563 2.981 10 0 EFAEHO CN(CC(=O)NCC[N@@H+](C[C@@H]1CC[C@@H]2C[C@@H]2C1)C1CC1)CC(C)(C)C ZINC001418786260 1374499457 /nfs/dbraw/zinc/49/94/57/1374499457.db2.gz JNDQZKVEUVEPMX-KURKYZTESA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C1CC1)[C@H]1CCCc2ccccc21 ZINC001418799534 1374517889 /nfs/dbraw/zinc/51/78/89/1374517889.db2.gz NBSNRXOXSUONCK-FQEVSTJZSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C1CC1)[C@H]1CCCc2ccccc21 ZINC001418799534 1374517893 /nfs/dbraw/zinc/51/78/93/1374517893.db2.gz NBSNRXOXSUONCK-FQEVSTJZSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)[C@H]1C[NH+]2CCC1CC2)c1ccccc1Cl ZINC001418809169 1374529734 /nfs/dbraw/zinc/52/97/34/1374529734.db2.gz CYJRWZBYTPKPKE-PBHICJAKSA-N 1 3 349.906 2.791 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@H]1CCN(C/C=C\Cl)CC(C)(C)C1 ZINC001418823976 1374544599 /nfs/dbraw/zinc/54/45/99/1374544599.db2.gz HIHRBIIBMZTZST-WUKHSURWSA-N 1 3 329.916 2.688 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)C[C@H]1CC[N@H+](C)C1)c1ccccc1Cl ZINC001418825776 1374547367 /nfs/dbraw/zinc/54/73/67/1374547367.db2.gz HHYUCDMHXOABFM-HUUCEWRRSA-N 1 3 337.895 2.791 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)C[C@H]1CC[N@@H+](C)C1)c1ccccc1Cl ZINC001418825776 1374547371 /nfs/dbraw/zinc/54/73/71/1374547371.db2.gz HHYUCDMHXOABFM-HUUCEWRRSA-N 1 3 337.895 2.791 10 0 EFAEHO CCCC[N@@H+]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)CC(C)(C)C1 ZINC001418826968 1374548743 /nfs/dbraw/zinc/54/87/43/1374548743.db2.gz PLQSHXNLAYOLLT-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCC[N@H+]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)CC(C)(C)C1 ZINC001418826968 1374548748 /nfs/dbraw/zinc/54/87/48/1374548748.db2.gz PLQSHXNLAYOLLT-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO C[N@H+](CCC1CCCC1)C[C@@H]1CCCCN1C(=O)Cc1c[nH]cn1 ZINC001418827947 1374550750 /nfs/dbraw/zinc/55/07/50/1374550750.db2.gz SUAZXGHPILJGTI-SFHVURJKSA-N 1 3 332.492 2.845 10 0 EFAEHO C[N@@H+](CCC1CCCC1)C[C@@H]1CCCCN1C(=O)Cc1c[nH]cn1 ZINC001418827947 1374550755 /nfs/dbraw/zinc/55/07/55/1374550755.db2.gz SUAZXGHPILJGTI-SFHVURJKSA-N 1 3 332.492 2.845 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]([NH2+]CC1CCCC1)c1ccccc1)N(C)C ZINC001418850371 1374573345 /nfs/dbraw/zinc/57/33/45/1374573345.db2.gz ICCVBGVDBPIWJK-MOPGFXCFSA-N 1 3 331.504 2.964 10 0 EFAEHO Cc1cccc(C)c1C[N@H+]1CC[C@@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001418903581 1374661794 /nfs/dbraw/zinc/66/17/94/1374661794.db2.gz AECRXMVZHBEHDU-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+]1CC[C@@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001418903581 1374661798 /nfs/dbraw/zinc/66/17/98/1374661798.db2.gz AECRXMVZHBEHDU-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@@H]1CC[N@H+](Cc2cc(C)ccc2F)C1 ZINC001418913056 1374678620 /nfs/dbraw/zinc/67/86/20/1374678620.db2.gz KOZZYTXVINJMKQ-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@@H]1CC[N@@H+](Cc2cc(C)ccc2F)C1 ZINC001418913056 1374678625 /nfs/dbraw/zinc/67/86/25/1374678625.db2.gz KOZZYTXVINJMKQ-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2ccccc2C)C1)N(C)C ZINC001418917587 1374683478 /nfs/dbraw/zinc/68/34/78/1374683478.db2.gz ZYISXIKADZQVHR-PKOBYXMFSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2ccccc2C)C1)N(C)C ZINC001418917587 1374683480 /nfs/dbraw/zinc/68/34/80/1374683480.db2.gz ZYISXIKADZQVHR-PKOBYXMFSA-N 1 3 331.504 2.663 10 0 EFAEHO CN(Cc1ccc(Cl)s1)C[C@@H]1CCN(C(=O)CC[NH+](C)C)C1 ZINC001418940838 1374710764 /nfs/dbraw/zinc/71/07/64/1374710764.db2.gz POUUXRHTPZNQNV-ZDUSSCGKSA-N 1 3 343.924 2.634 10 0 EFAEHO Cc1cccc(CN2CCC[C@@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001418951827 1374726525 /nfs/dbraw/zinc/72/65/25/1374726525.db2.gz RQIRHOOAGVRICX-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1cccc(CN2CCC[C@@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001418951827 1374726526 /nfs/dbraw/zinc/72/65/26/1374726526.db2.gz RQIRHOOAGVRICX-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)C1)N(C)C ZINC001418952143 1374727062 /nfs/dbraw/zinc/72/70/62/1374727062.db2.gz SAQAKWLUHDEBDJ-MISYRCLQSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)C1)N(C)C ZINC001418952143 1374727063 /nfs/dbraw/zinc/72/70/63/1374727063.db2.gz SAQAKWLUHDEBDJ-MISYRCLQSA-N 1 3 343.515 2.841 10 0 EFAEHO Cc1ccc(C)c(CN2CC(CNC(=O)C(C)(C)[NH+]3CCCC3)C2)c1 ZINC001419025514 1374772744 /nfs/dbraw/zinc/77/27/44/1374772744.db2.gz UJEJQMKUHJKKIT-UHFFFAOYSA-N 1 3 343.515 2.726 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](CC)NCc1ccccc1F ZINC001419199131 1374945400 /nfs/dbraw/zinc/94/54/00/1374945400.db2.gz MVSYMKNQLOSFGB-WMZOPIPTSA-N 1 3 335.467 2.685 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](CC)NCc1ccccc1F ZINC001419199131 1374945404 /nfs/dbraw/zinc/94/54/04/1374945404.db2.gz MVSYMKNQLOSFGB-WMZOPIPTSA-N 1 3 335.467 2.685 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC12CC[NH+](CC1CC(C)(C)C1)CC2)N(C)C ZINC001419213094 1374959550 /nfs/dbraw/zinc/95/95/50/1374959550.db2.gz XWKDFLLYTDGATG-ROUUACIJSA-N 1 3 349.563 2.980 10 0 EFAEHO CC[C@H](CNC(=O)CC[NH+](C)C)N[C@@H](C)c1ccccc1Cl ZINC001419222165 1374968934 /nfs/dbraw/zinc/96/89/34/1374968934.db2.gz OEZQQKFSPBIQHJ-UONOGXRCSA-N 1 3 325.884 2.837 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]CCC(F)(F)F ZINC001419237561 1374984233 /nfs/dbraw/zinc/98/42/33/1374984233.db2.gz QXIKGQQMLADUGU-KGLIPLIRSA-N 1 3 337.430 2.688 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1cccc(F)c1)C1CC1 ZINC001419250440 1374997549 /nfs/dbraw/zinc/99/75/49/1374997549.db2.gz KZCCEJQEDSJFQP-OALUTQOASA-N 1 3 347.478 2.683 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001419256341 1375002433 /nfs/dbraw/zinc/00/24/33/1375002433.db2.gz YXTJTGRIWVUCNX-UZLBHIALSA-N 1 3 343.515 2.890 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@H](NCC=C(Cl)Cl)C1CC1 ZINC001419258839 1375004980 /nfs/dbraw/zinc/00/49/80/1375004980.db2.gz BCLGCPKDSNOYLH-KGLIPLIRSA-N 1 3 348.318 2.664 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@H](NCC=C(Cl)Cl)C1CC1 ZINC001419258839 1375004982 /nfs/dbraw/zinc/00/49/82/1375004982.db2.gz BCLGCPKDSNOYLH-KGLIPLIRSA-N 1 3 348.318 2.664 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2C[C@H](NC(=O)CN(C)CC(C)(C)C)C2)c1 ZINC001419411016 1375237258 /nfs/dbraw/zinc/23/72/58/1375237258.db2.gz HHUQESSBTWTHSC-QAQDUYKDSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@H](C)c2ccc(F)cc2F)C1 ZINC001419428074 1375259217 /nfs/dbraw/zinc/25/92/17/1375259217.db2.gz AVOPGOIFQWRVJE-BPLDGKMQSA-N 1 3 339.430 2.603 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2C/C=C\Cl ZINC001419447216 1375284806 /nfs/dbraw/zinc/28/48/06/1375284806.db2.gz KKKIQEXSXWLIQQ-UKVOOARPSA-N 1 3 345.890 2.530 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C/C=C\Cl ZINC001419447216 1375284812 /nfs/dbraw/zinc/28/48/12/1375284812.db2.gz KKKIQEXSXWLIQQ-UKVOOARPSA-N 1 3 345.890 2.530 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]2CN(Cc3ccc(F)cc3)CC[C@@H]21 ZINC001419450648 1375289838 /nfs/dbraw/zinc/28/98/38/1375289838.db2.gz QDHHHHOEIINYAK-HKUYNNGSSA-N 1 3 347.478 2.590 10 0 EFAEHO CN(CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccsc1)C1CCC1 ZINC001419450916 1375291605 /nfs/dbraw/zinc/29/16/05/1375291605.db2.gz TYPXEFBXHYDTAF-ZNXRZULTSA-N 1 3 347.528 2.844 10 0 EFAEHO CN(CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccsc1)C1CCC1 ZINC001419450916 1375291609 /nfs/dbraw/zinc/29/16/09/1375291609.db2.gz TYPXEFBXHYDTAF-ZNXRZULTSA-N 1 3 347.528 2.844 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@H+](Cc3ccsc3)CC[C@@H]21 ZINC001419453882 1375295652 /nfs/dbraw/zinc/29/56/52/1375295652.db2.gz YLWVLERRZHFYIK-MSOLQXFVSA-N 1 3 349.544 2.903 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@@H+](Cc3ccsc3)CC[C@@H]21 ZINC001419453882 1375295656 /nfs/dbraw/zinc/29/56/56/1375295656.db2.gz YLWVLERRZHFYIK-MSOLQXFVSA-N 1 3 349.544 2.903 10 0 EFAEHO CC[C@@H]([NH2+][C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)C1)c1ccccc1 ZINC001419470518 1375314340 /nfs/dbraw/zinc/31/43/40/1375314340.db2.gz NQPCURUWNODOBF-FGTMMUONSA-N 1 3 329.488 2.859 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)c(C)c1 ZINC001419474724 1375318431 /nfs/dbraw/zinc/31/84/31/1375318431.db2.gz KEKLLJYJJGRDOF-HDICACEKSA-N 1 3 329.488 2.525 10 0 EFAEHO C[C@@H]1CN(C(=O)C2C[NH+](C3CCCCC3)C2)CCN1C1CCCC1 ZINC001419490298 1375337312 /nfs/dbraw/zinc/33/73/12/1375337312.db2.gz SYVPRPLDHNWRAS-MRXNPFEDSA-N 1 3 333.520 2.726 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2)C1)N(C)C ZINC001419493799 1375343724 /nfs/dbraw/zinc/34/37/24/1375343724.db2.gz MJRONWQJJIOSND-HSALFYBXSA-N 1 3 339.483 2.917 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001419536321 1375408935 /nfs/dbraw/zinc/40/89/35/1375408935.db2.gz LIJDJJBWTUFNFS-ZDUSSCGKSA-N 1 3 343.874 2.661 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@@H]1CCCN(Cc2cc(C)ccc2F)C1 ZINC001419542257 1375421235 /nfs/dbraw/zinc/42/12/35/1375421235.db2.gz KOFNTILUWWCDBI-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@@H]1CCCN(Cc2cc(C)ccc2F)C1 ZINC001419542257 1375421240 /nfs/dbraw/zinc/42/12/40/1375421240.db2.gz KOFNTILUWWCDBI-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[NH2+]Cc2cc(C)ccc2F)C1 ZINC001419557635 1375448328 /nfs/dbraw/zinc/44/83/28/1375448328.db2.gz FFTZIPSLFWBWJQ-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1C ZINC001419571479 1375466986 /nfs/dbraw/zinc/46/69/86/1375466986.db2.gz VWIJWPMMLNPTHT-HXUWFJFHSA-N 1 3 345.531 2.972 10 0 EFAEHO C[C@H](F)CC[NH2+]C1(CNC(=O)CN(C)CC(C)(C)C)CCCC1 ZINC001419620381 1375556312 /nfs/dbraw/zinc/55/63/12/1375556312.db2.gz SMIFZZUSFZYVSX-HNNXBMFYSA-N 1 3 329.504 2.731 10 0 EFAEHO C[C@@H](C[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C(=O)C1(N(C)C)CCC1 ZINC001419668970 1375674500 /nfs/dbraw/zinc/67/45/00/1375674500.db2.gz YXYMRUKNUKYMAX-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc2ccccc2c1)N(C)C(=O)CN1CCCC1 ZINC001419743360 1375799525 /nfs/dbraw/zinc/79/95/25/1375799525.db2.gz IAZFJUDCSPSDSN-KRWDZBQOSA-N 1 3 339.483 2.872 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001419774806 1375855043 /nfs/dbraw/zinc/85/50/43/1375855043.db2.gz YYFZEJWQZOAQJR-DNVCBOLYSA-N 1 3 349.494 2.980 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+][C@H](C)CNC(=O)C2(N(C)C)CCC2)c1 ZINC001419776159 1375858016 /nfs/dbraw/zinc/85/80/16/1375858016.db2.gz NZDJIUKBEMOGBX-IAGOWNOFSA-N 1 3 331.504 2.943 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]CC1CC(C)(C)C1)NC(=O)CN1CC[C@@H](C)C1 ZINC001419793947 1375889896 /nfs/dbraw/zinc/88/98/96/1375889896.db2.gz PLEBSBPTELLKOA-AEFFLSMTSA-N 1 3 337.552 2.885 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](C)CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)c1 ZINC001419852807 1376003577 /nfs/dbraw/zinc/00/35/77/1376003577.db2.gz PQACHPAKBPZSJO-UZLBHIALSA-N 1 3 349.494 2.802 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](C)CNC(=O)[C@H](C)N1CCCCCC1 ZINC001419871917 1376038878 /nfs/dbraw/zinc/03/88/78/1376038878.db2.gz RPAKOUSKSZQCPG-MSOLQXFVSA-N 1 3 331.504 2.854 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]C/C=C/Cl ZINC001419906836 1376107802 /nfs/dbraw/zinc/10/78/02/1376107802.db2.gz MSPJJRBWJRSGDL-USQNJUIBSA-N 1 3 329.916 2.734 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](CNC(=O)CN1CC[C@H](C)C1)C(C)C ZINC001419910344 1376113029 /nfs/dbraw/zinc/11/30/29/1376113029.db2.gz SBNQLUHIPWRNMH-JXFKEZNVSA-N 1 3 345.531 2.876 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)CC[NH+]2CCCCC2)c1 ZINC001419933239 1376149791 /nfs/dbraw/zinc/14/97/91/1376149791.db2.gz UTNMTPJZHJBZQG-MRXNPFEDSA-N 1 3 335.467 2.604 10 0 EFAEHO CCc1cccc(C[NH2+][C@H]2CCN(C(=O)[C@H](F)CN(CC)CC)C2)c1 ZINC001419959068 1376189661 /nfs/dbraw/zinc/18/96/61/1376189661.db2.gz JMTUCSMFCAXFDO-RBUKOAKNSA-N 1 3 349.494 2.619 10 0 EFAEHO Cc1cccc(CN2CC[C@H](N(C)C(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001438234855 1388432056 /nfs/dbraw/zinc/43/20/56/1388432056.db2.gz OLFAJDZCJJOMCU-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN2CC[C@H](N(C)C(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001438234855 1388432063 /nfs/dbraw/zinc/43/20/63/1388432063.db2.gz OLFAJDZCJJOMCU-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCN(C)C(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001420019409 1376293356 /nfs/dbraw/zinc/29/33/56/1376293356.db2.gz YGURJNSXXQEGOQ-ICSRJNTNSA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCN(C)C(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001420019409 1376293364 /nfs/dbraw/zinc/29/33/64/1376293364.db2.gz YGURJNSXXQEGOQ-ICSRJNTNSA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCC[C@@H](NC(=O)CN(C)C(C)C)C2)cc1F ZINC001420020221 1376296397 /nfs/dbraw/zinc/29/63/97/1376296397.db2.gz LGLRBUAPTCMAAN-ZWKOTPCHSA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+][C@H](C)c2ccc(F)cc2)C1 ZINC001420022946 1376302133 /nfs/dbraw/zinc/30/21/33/1376302133.db2.gz YLKFYOZUSGDZGQ-CVEARBPZSA-N 1 3 335.467 2.665 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)C[NH+]2[C@H](C)CC[C@H]2C)c1 ZINC001420062800 1376405546 /nfs/dbraw/zinc/40/55/46/1376405546.db2.gz NUUABJRUZHKJDN-QZTJIDSGSA-N 1 3 331.504 2.758 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC001420168940 1376529059 /nfs/dbraw/zinc/52/90/59/1376529059.db2.gz VHHATFCKCVLQHW-MRXNPFEDSA-N 1 3 342.487 2.559 10 0 EFAEHO CN(CCNC(=O)CCC[NH+](C)C)[C@@H]1CCc2ccc(Cl)cc21 ZINC001420294558 1376680230 /nfs/dbraw/zinc/68/02/30/1376680230.db2.gz QUJVAATUSHLZJT-QGZVFWFLSA-N 1 3 337.895 2.717 10 0 EFAEHO CCC(CC)C[N@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001420296473 1376684595 /nfs/dbraw/zinc/68/45/95/1376684595.db2.gz PZFHJMAQGZDYOD-SFHVURJKSA-N 1 3 329.504 2.683 10 0 EFAEHO CCC(CC)C[N@@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001420296473 1376684601 /nfs/dbraw/zinc/68/46/01/1376684601.db2.gz PZFHJMAQGZDYOD-SFHVURJKSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C)Cc1ccc(C2CCC2)cc1 ZINC001420357641 1376796795 /nfs/dbraw/zinc/79/67/95/1376796795.db2.gz KJQDSLLJCJLDPE-UHFFFAOYSA-N 1 3 331.504 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C)Cc1ccc(C2CCC2)cc1 ZINC001420357641 1376796799 /nfs/dbraw/zinc/79/67/99/1376796799.db2.gz KJQDSLLJCJLDPE-UHFFFAOYSA-N 1 3 331.504 2.842 10 0 EFAEHO CCN(C(=O)[C@@H](C)[NH+]1CCCCCC1)[C@@H]1CCN(CCCF)C1 ZINC001438265044 1388463193 /nfs/dbraw/zinc/46/31/93/1388463193.db2.gz GIBXYSBDNQYBIL-IAGOWNOFSA-N 1 3 327.488 2.533 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@@H](C)NC(=O)[C@H](C(C)C)N(C)C)c(C)c1 ZINC001420365058 1376811146 /nfs/dbraw/zinc/81/11/46/1376811146.db2.gz JYYJNYFNCOFRAR-MJGOQNOKSA-N 1 3 333.520 2.792 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)CC1CC2(CCC2)C1 ZINC001420587482 1377261428 /nfs/dbraw/zinc/26/14/28/1377261428.db2.gz WYDTYBVVFVCFHT-SJLPKXTDSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001420587482 1377261431 /nfs/dbraw/zinc/26/14/31/1377261431.db2.gz WYDTYBVVFVCFHT-SJLPKXTDSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C[N@H+](C)CC[C@@H]1CCCC1(F)F ZINC001420661842 1377445552 /nfs/dbraw/zinc/44/55/52/1377445552.db2.gz KVAXVRMUQJRDSJ-JSGCOSHPSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC001420661842 1377445553 /nfs/dbraw/zinc/44/55/53/1377445553.db2.gz KVAXVRMUQJRDSJ-JSGCOSHPSA-N 1 3 342.434 2.523 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccc(F)cc1 ZINC001438307437 1388498098 /nfs/dbraw/zinc/49/80/98/1388498098.db2.gz UALYQOMRPQHGOZ-ROUUACIJSA-N 1 3 335.467 2.683 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NCCN(Cc2ccc(C3CC3)cc2)C2CC2)C1 ZINC001420705202 1377538755 /nfs/dbraw/zinc/53/87/55/1377538755.db2.gz KHWGUKJIYRTMJW-LJQANCHMSA-N 1 3 341.499 2.596 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NCCN(Cc2ccc(C3CC3)cc2)C2CC2)C1 ZINC001420705202 1377538758 /nfs/dbraw/zinc/53/87/58/1377538758.db2.gz KHWGUKJIYRTMJW-LJQANCHMSA-N 1 3 341.499 2.596 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+][C@H]2CCc3ccccc32)C2CC2)CCC1 ZINC001420733199 1377580428 /nfs/dbraw/zinc/58/04/28/1377580428.db2.gz CXSMRFJJXBIHJA-RBUKOAKNSA-N 1 3 341.499 2.643 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C[NH2+]Cc1ccsc1)C1CC1 ZINC001420740796 1377588259 /nfs/dbraw/zinc/58/82/59/1377588259.db2.gz OOMLXLLRZSDYHT-IAGOWNOFSA-N 1 3 335.517 2.605 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C[NH2+]Cc1ccsc1)C1CC1 ZINC001420740798 1377588463 /nfs/dbraw/zinc/58/84/63/1377588463.db2.gz OOMLXLLRZSDYHT-IRXDYDNUSA-N 1 3 335.517 2.605 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]Cc1cccc(C)c1)C1CC1 ZINC001420746316 1377593619 /nfs/dbraw/zinc/59/36/19/1377593619.db2.gz YCQMTMVKFARAHF-VQTJNVASSA-N 1 3 343.515 2.854 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCCN1C(C)C)[C@@H]1CC[N@H+](CC2CCC2)C1 ZINC001420808097 1377698167 /nfs/dbraw/zinc/69/81/67/1377698167.db2.gz VDVNNJHDBOVIOJ-MOPGFXCFSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCCN1C(C)C)[C@@H]1CC[N@@H+](CC2CCC2)C1 ZINC001420808097 1377698169 /nfs/dbraw/zinc/69/81/69/1377698169.db2.gz VDVNNJHDBOVIOJ-MOPGFXCFSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C(=O)[C@H]1CCCN1C(C)C)[C@@H]1CC[N@H+](CC2CCC2)C1 ZINC001420808112 1377698501 /nfs/dbraw/zinc/69/85/01/1377698501.db2.gz VDVNNJHDBOVIOJ-RTBURBONSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C(=O)[C@H]1CCCN1C(C)C)[C@@H]1CC[N@@H+](CC2CCC2)C1 ZINC001420808112 1377698504 /nfs/dbraw/zinc/69/85/04/1377698504.db2.gz VDVNNJHDBOVIOJ-RTBURBONSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@H]1CC[N@@H+]([C@H]2CCc3ccccc32)C1 ZINC001420885656 1377834990 /nfs/dbraw/zinc/83/49/90/1377834990.db2.gz FCTOITWTKCOBSX-PXNSSMCTSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@H]1CC[N@H+]([C@H]2CCc3ccccc32)C1 ZINC001420885656 1377834994 /nfs/dbraw/zinc/83/49/94/1377834994.db2.gz FCTOITWTKCOBSX-PXNSSMCTSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001420886215 1377836427 /nfs/dbraw/zinc/83/64/27/1377836427.db2.gz GXERGVGSEWSSJQ-QGZVFWFLSA-N 1 3 335.536 2.737 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001420886215 1377836431 /nfs/dbraw/zinc/83/64/31/1377836431.db2.gz GXERGVGSEWSSJQ-QGZVFWFLSA-N 1 3 335.536 2.737 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001420886212 1377836810 /nfs/dbraw/zinc/83/68/10/1377836810.db2.gz GXERGVGSEWSSJQ-KRWDZBQOSA-N 1 3 335.536 2.737 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001420886212 1377836813 /nfs/dbraw/zinc/83/68/13/1377836813.db2.gz GXERGVGSEWSSJQ-KRWDZBQOSA-N 1 3 335.536 2.737 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NCC1([NH2+][C@H]2CCc3ccccc32)CC1 ZINC001420955392 1377936090 /nfs/dbraw/zinc/93/60/90/1377936090.db2.gz SCXNRXSPELWATB-MSOLQXFVSA-N 1 3 347.478 2.592 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NCC1([NH2+][C@@H]2CCc3ccccc32)CC1 ZINC001420955403 1377936122 /nfs/dbraw/zinc/93/61/22/1377936122.db2.gz SCXNRXSPELWATB-QZTJIDSGSA-N 1 3 347.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+][C@H]2CCc3ccc(Cl)cc32)CC1 ZINC001420994120 1377992304 /nfs/dbraw/zinc/99/23/04/1377992304.db2.gz JAQJUXWIMJAYBS-KRWDZBQOSA-N 1 3 349.906 2.908 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1(NCc2ccsc2)CC1)[NH+]1CCCC1 ZINC001421003301 1378006557 /nfs/dbraw/zinc/00/65/57/1378006557.db2.gz CAPRLBVFJIVOPS-INIZCTEOSA-N 1 3 335.517 2.607 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN3[C@@H](C)CC[C@@H]3C)CC2)cc1C ZINC001421008548 1378014461 /nfs/dbraw/zinc/01/44/61/1378014461.db2.gz ZQTHKCIVJLBYGR-ROUUACIJSA-N 1 3 343.515 2.915 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@]2(CCN(Cc3ccsc3)C2)C1 ZINC001421042829 1378061472 /nfs/dbraw/zinc/06/14/72/1378061472.db2.gz ZBMYEVOHZPBTKC-SFHVURJKSA-N 1 3 335.517 2.514 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@]2(CCN(Cc3ccsc3)C2)C1 ZINC001421042829 1378061475 /nfs/dbraw/zinc/06/14/75/1378061475.db2.gz ZBMYEVOHZPBTKC-SFHVURJKSA-N 1 3 335.517 2.514 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H]2CCCN2C(=O)C2(C[NH+](C)C)CC2)c1 ZINC001421131160 1378162178 /nfs/dbraw/zinc/16/21/78/1378162178.db2.gz TXLHTZYZKCOSFU-QGZVFWFLSA-N 1 3 347.478 2.557 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H]2CCCN2C(=O)C2(C[NH+](C)C)CC2)c1 ZINC001421131154 1378162460 /nfs/dbraw/zinc/16/24/60/1378162460.db2.gz TXLHTZYZKCOSFU-KRWDZBQOSA-N 1 3 347.478 2.557 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@@H]1CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001421140931 1378175492 /nfs/dbraw/zinc/17/54/92/1378175492.db2.gz RIRUXSWNGVABIW-MSOLQXFVSA-N 1 3 335.467 2.691 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]CC3CCCCC3)C2)C1 ZINC001421254015 1378354400 /nfs/dbraw/zinc/35/44/00/1378354400.db2.gz KCLICCXUQNOQES-PXNSSMCTSA-N 1 3 335.536 2.737 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@]2(C)CCN(C(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001421257612 1378361310 /nfs/dbraw/zinc/36/13/10/1378361310.db2.gz PYUMXEDSPGJHAW-WIYYLYMNSA-N 1 3 343.515 2.665 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCN(CCc2ccccc2)C1)[NH+](CC)CC ZINC001421277102 1378402048 /nfs/dbraw/zinc/40/20/48/1378402048.db2.gz ZPPWKKWECROFKL-RTBURBONSA-N 1 3 331.504 2.540 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@]1(C)CCCN(C/C=C\c2ccccc2)C1 ZINC001421283472 1378424209 /nfs/dbraw/zinc/42/42/09/1378424209.db2.gz JHLOODRVZLEQPM-HWDCPHDLSA-N 1 3 343.515 2.870 10 0 EFAEHO CC[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]Cc1cc(C)ccc1F ZINC001421419000 1378596333 /nfs/dbraw/zinc/59/63/33/1378596333.db2.gz FKWZULGHYBOAOH-MRXNPFEDSA-N 1 3 335.467 2.603 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1cccc(OC)c1 ZINC001421444198 1378623293 /nfs/dbraw/zinc/62/32/93/1378623293.db2.gz XBSIDPWDRDEEJR-KRWDZBQOSA-N 1 3 347.503 2.554 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1cc(F)ccc1C ZINC001421443461 1378623414 /nfs/dbraw/zinc/62/34/14/1378623414.db2.gz VLSUXAYUFUNLTF-SFHVURJKSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cc(C)cc(C)c1 ZINC001421455113 1378639950 /nfs/dbraw/zinc/63/99/50/1378639950.db2.gz ZETFQHKQFREIKI-BEFAXECRSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]Cc1ccsc1 ZINC001421456145 1378641958 /nfs/dbraw/zinc/64/19/58/1378641958.db2.gz NTRRJMSTTBOEAS-IAGOWNOFSA-N 1 3 337.533 2.995 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]CCc1ccccc1 ZINC001421459041 1378646529 /nfs/dbraw/zinc/64/65/29/1378646529.db2.gz WOUCUANGICZNNU-UXHICEINSA-N 1 3 345.531 2.976 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](C(C)C)[NH+](C)C)NCc1cc(C)ccc1F ZINC001421470511 1378659781 /nfs/dbraw/zinc/65/97/81/1378659781.db2.gz KFSDNGYMFWAVJS-SJLPKXTDSA-N 1 3 337.483 2.705 10 0 EFAEHO CC[C@@H](CNC(=O)Cc1nc[nH]c1C)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001421471304 1378661602 /nfs/dbraw/zinc/66/16/02/1378661602.db2.gz ARWIRSWSDREJBF-KBPBESRZSA-N 1 3 342.434 2.571 10 0 EFAEHO COc1ccc(C[NH2+]CC2(NC(=O)CN(C)C(C)C)CCCC2)cc1 ZINC001421529593 1378759049 /nfs/dbraw/zinc/75/90/49/1378759049.db2.gz OQDPBFQYBCUDJL-UHFFFAOYSA-N 1 3 347.503 2.554 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](C)[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001421542384 1378783229 /nfs/dbraw/zinc/78/32/29/1378783229.db2.gz MILIBVYSBPPZPY-YLJYHZDGSA-N 1 3 345.531 2.916 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001421547371 1378790918 /nfs/dbraw/zinc/79/09/18/1378790918.db2.gz RXGGKQRASMCXIF-FUHWJXTLSA-N 1 3 349.494 2.801 10 0 EFAEHO CC(C)C[NH2+]Cc1ccc(CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001421604475 1378871852 /nfs/dbraw/zinc/87/18/52/1378871852.db2.gz AOKFAJFOVNIWII-UHFFFAOYSA-N 1 3 331.504 2.923 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H]([NH2+]CCc2ccccc2F)CC1 ZINC001421606077 1378873973 /nfs/dbraw/zinc/87/39/73/1378873973.db2.gz KJXXFYSBAOEIKX-IYARVYRRSA-N 1 3 349.494 2.725 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC2(C1)CCN(Cc1ccccc1Cl)CC2 ZINC001421670063 1378977475 /nfs/dbraw/zinc/97/74/75/1378977475.db2.gz RUKFSAWVIZHSKU-UHFFFAOYSA-N 1 3 349.906 2.716 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCC1(NCc2cccc(F)c2)CCC1 ZINC001421750195 1379076444 /nfs/dbraw/zinc/07/64/44/1379076444.db2.gz DPCUBWPHGJPRKU-GOSISDBHSA-N 1 3 347.478 2.829 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCC1(NCc2cccc(F)c2)CCC1 ZINC001421750195 1379076451 /nfs/dbraw/zinc/07/64/51/1379076451.db2.gz DPCUBWPHGJPRKU-GOSISDBHSA-N 1 3 347.478 2.829 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]1CNCc1cccc(Cl)c1F ZINC001421757884 1379087480 /nfs/dbraw/zinc/08/74/80/1379087480.db2.gz XOTKIRARGHJJNB-CQSZACIVSA-N 1 3 341.858 2.511 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+][C@H](C)c1ccc2c(c1)CCC2 ZINC001421767192 1379105578 /nfs/dbraw/zinc/10/55/78/1379105578.db2.gz IEUKXAONBJAONA-IAGOWNOFSA-N 1 3 345.531 2.918 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)C3(C[NH+](C)C)CC3)CCC2)c1 ZINC001421775341 1379120302 /nfs/dbraw/zinc/12/03/02/1379120302.db2.gz PEVXZKFVRRBIJN-UHFFFAOYSA-N 1 3 347.478 2.604 10 0 EFAEHO CCCN(C)CC(=O)N1CCC2(C[NH+](CC3CC(C)(C)C3)C2)CC1 ZINC001421850541 1379237881 /nfs/dbraw/zinc/23/78/81/1379237881.db2.gz JCFFRFDHRDXTAW-UHFFFAOYSA-N 1 3 335.536 2.689 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[N@H+](C)Cc1ccsc1 ZINC001421903129 1379331654 /nfs/dbraw/zinc/33/16/54/1379331654.db2.gz REDUIXSNEWLQAS-KRWDZBQOSA-N 1 3 337.533 2.903 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[N@@H+](C)Cc1ccsc1 ZINC001421903129 1379331657 /nfs/dbraw/zinc/33/16/57/1379331657.db2.gz REDUIXSNEWLQAS-KRWDZBQOSA-N 1 3 337.533 2.903 10 0 EFAEHO CCC1([NH2+]C/C=C\Cl)CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001421936548 1379376134 /nfs/dbraw/zinc/37/61/34/1379376134.db2.gz WOWVJAMNURXQPF-YHYXMXQVSA-N 1 3 327.900 2.584 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001421942894 1379385370 /nfs/dbraw/zinc/38/53/70/1379385370.db2.gz YMWGCLUPRIMODQ-INIZCTEOSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC1([NH2+]Cc2ccccc2)CCN(C(=O)CN2CCCC2)CC1 ZINC001421951350 1379398183 /nfs/dbraw/zinc/39/81/83/1379398183.db2.gz GWTMZWVCOZMGKO-UHFFFAOYSA-N 1 3 329.488 2.643 10 0 EFAEHO CC(C)N1Cc2ccccc2C[C@@H]1CNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001421952322 1379399320 /nfs/dbraw/zinc/39/93/20/1379399320.db2.gz JKLCIVPLXIKWJZ-VQTJNVASSA-N 1 3 343.515 2.812 10 0 EFAEHO CC(C)N1Cc2ccccc2C[C@@H]1CNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001421952322 1379399324 /nfs/dbraw/zinc/39/93/24/1379399324.db2.gz JKLCIVPLXIKWJZ-VQTJNVASSA-N 1 3 343.515 2.812 10 0 EFAEHO c1cc(N2CCCN(C[C@H]3COC4(CCCCC4)O3)CC2)cc[nH+]1 ZINC001421958815 1379410528 /nfs/dbraw/zinc/41/05/28/1379410528.db2.gz ABLLELPCNLLCJP-SFHVURJKSA-N 1 3 331.460 2.670 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC001421985340 1379440530 /nfs/dbraw/zinc/44/05/30/1379440530.db2.gz NULKOOGZOBOBDW-KBPBESRZSA-N 1 3 341.446 2.803 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC001421985355 1379440782 /nfs/dbraw/zinc/44/07/82/1379440782.db2.gz NULKOOGZOBOBDW-UONOGXRCSA-N 1 3 341.446 2.803 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1cccc(OC)c1 ZINC001421988477 1379444021 /nfs/dbraw/zinc/44/40/21/1379444021.db2.gz RMBJJGZTBFQUFP-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CCCN(C)CC(=O)N(C)[C@@H](C)C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001421995548 1379453788 /nfs/dbraw/zinc/45/37/88/1379453788.db2.gz RCGCIVYTJDHJCZ-LSDHHAIUSA-N 1 3 333.467 2.590 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NCCC1CCN(C/C=C\Cl)CC1 ZINC001438451840 1388615924 /nfs/dbraw/zinc/61/59/24/1388615924.db2.gz KQLDVQFLBRZGST-CMHMDVFHSA-N 1 3 341.927 2.830 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCCC1CCN(C/C=C\Cl)CC1 ZINC001438451840 1388615926 /nfs/dbraw/zinc/61/59/26/1388615926.db2.gz KQLDVQFLBRZGST-CMHMDVFHSA-N 1 3 341.927 2.830 10 0 EFAEHO CCC(CC)C[NH2+][C@H](C)[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001422069185 1379569808 /nfs/dbraw/zinc/56/98/08/1379569808.db2.gz YIFPWKLTYLXUGV-SJLPKXTDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@H+](CCCC(C)C)CC1(C)C)N(C)C ZINC001422083776 1379588795 /nfs/dbraw/zinc/58/87/95/1379588795.db2.gz CMOKDNJXDCEOCA-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@@H+](CCCC(C)C)CC1(C)C)N(C)C ZINC001422083776 1379588797 /nfs/dbraw/zinc/58/87/97/1379588797.db2.gz CMOKDNJXDCEOCA-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H](CNC(=O)CN1CC[C@H](C)C1)C(C)C ZINC001422105934 1379618267 /nfs/dbraw/zinc/61/82/67/1379618267.db2.gz CDYDAAAKQGAFHZ-KXBFYZLASA-N 1 3 349.494 2.706 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H](C)[NH+]1CCCCCC1)NCc1ccccn1 ZINC001422108301 1379620968 /nfs/dbraw/zinc/62/09/68/1379620968.db2.gz BPXGPCIPWHWSNY-HKUYNNGSSA-N 1 3 346.519 2.577 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](CNC(=O)C2(C[NH+](C)C)CC2)C(C)C)c1 ZINC001422116064 1379632962 /nfs/dbraw/zinc/63/29/62/1379632962.db2.gz GRNXDDKTQBSPIF-GOSISDBHSA-N 1 3 349.494 2.706 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(Cl)cc1 ZINC001422136898 1379669518 /nfs/dbraw/zinc/66/95/18/1379669518.db2.gz QKVDVXXMDPCEOK-KRWDZBQOSA-N 1 3 339.911 2.911 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(Cl)cc1 ZINC001422136901 1379669712 /nfs/dbraw/zinc/66/97/12/1379669712.db2.gz QKVDVXXMDPCEOK-QGZVFWFLSA-N 1 3 339.911 2.911 10 0 EFAEHO C[N@H+](C/C=C\c1ccccc1)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001422242292 1379842021 /nfs/dbraw/zinc/84/20/21/1379842021.db2.gz HQTNYURCIKOXGR-RVPHRTOXSA-N 1 3 341.499 2.718 10 0 EFAEHO C[N@@H+](C/C=C\c1ccccc1)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001422242292 1379842023 /nfs/dbraw/zinc/84/20/23/1379842023.db2.gz HQTNYURCIKOXGR-RVPHRTOXSA-N 1 3 341.499 2.718 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2CC2CC(C)(C)C2)C1 ZINC001422243264 1379846081 /nfs/dbraw/zinc/84/60/81/1379846081.db2.gz GEIKXTAUAXTNHG-ROUUACIJSA-N 1 3 335.536 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2CC2CC(C)(C)C2)C1 ZINC001422243264 1379846085 /nfs/dbraw/zinc/84/60/85/1379846085.db2.gz GEIKXTAUAXTNHG-ROUUACIJSA-N 1 3 335.536 2.687 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@@H]2C[NH2+]CC2CC3(CCC3)C2)CCC1 ZINC001422278549 1379893363 /nfs/dbraw/zinc/89/33/63/1379893363.db2.gz NYUQPVNYIFNZTJ-QZTJIDSGSA-N 1 3 347.547 2.926 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H](C)CNC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001438481745 1388635603 /nfs/dbraw/zinc/63/56/03/1388635603.db2.gz LBEOMFHWKQRLJW-QFBILLFUSA-N 1 3 349.494 2.849 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001422325859 1379933446 /nfs/dbraw/zinc/93/34/46/1379933446.db2.gz NKFKRVPWQOZWHO-HOTGVXAUSA-N 1 3 331.504 2.716 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc2c(c1)CCC2)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001422332063 1379939980 /nfs/dbraw/zinc/93/99/80/1379939980.db2.gz UHAOSNVESIQDSS-CVEARBPZSA-N 1 3 343.515 2.642 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CCC([NH2+]Cc2ccccc2)CC1)N(C)C ZINC001422411150 1380053803 /nfs/dbraw/zinc/05/38/03/1380053803.db2.gz ZFSLMIMMKDLJIN-CTWPCTMYSA-N 1 3 331.504 2.886 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)[C@@H](C)NCc1ccc(Cl)cc1F ZINC001422413423 1380056804 /nfs/dbraw/zinc/05/68/04/1380056804.db2.gz YLNOQOZCXRVGAX-OLZOCXBDSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)[C@@H](C)NCc1ccc(Cl)cc1F ZINC001422413423 1380056812 /nfs/dbraw/zinc/05/68/12/1380056812.db2.gz YLNOQOZCXRVGAX-OLZOCXBDSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)[NH+]1CCC(NC(=O)CN2CCC[C@@H](C3CCCC3)C2)CC1 ZINC001422445033 1380112218 /nfs/dbraw/zinc/11/22/18/1380112218.db2.gz KPSXEJCIKSGTRV-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(OC)cc1 ZINC001422518320 1380240333 /nfs/dbraw/zinc/24/03/33/1380240333.db2.gz MTDUHJMEDGCXEZ-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(OC)cc1 ZINC001422518320 1380240335 /nfs/dbraw/zinc/24/03/35/1380240335.db2.gz MTDUHJMEDGCXEZ-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(OC)cc1 ZINC001422518321 1380240517 /nfs/dbraw/zinc/24/05/17/1380240517.db2.gz MTDUHJMEDGCXEZ-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(OC)cc1 ZINC001422518321 1380240521 /nfs/dbraw/zinc/24/05/21/1380240521.db2.gz MTDUHJMEDGCXEZ-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[N@H+](C)CCc1ccccc1 ZINC001422518891 1380242405 /nfs/dbraw/zinc/24/24/05/1380242405.db2.gz NZDMCRCCIWPNHD-HKUYNNGSSA-N 1 3 331.504 2.540 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[N@@H+](C)CCc1ccccc1 ZINC001422518891 1380242409 /nfs/dbraw/zinc/24/24/09/1380242409.db2.gz NZDMCRCCIWPNHD-HKUYNNGSSA-N 1 3 331.504 2.540 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1C ZINC001422520212 1380244588 /nfs/dbraw/zinc/24/45/88/1380244588.db2.gz PYRJMZJKSLAYDH-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1C ZINC001422520212 1380244589 /nfs/dbraw/zinc/24/45/89/1380244589.db2.gz PYRJMZJKSLAYDH-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001422521189 1380246868 /nfs/dbraw/zinc/24/68/68/1380246868.db2.gz FJQHWFRFWMXIOD-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001422521189 1380246870 /nfs/dbraw/zinc/24/68/70/1380246870.db2.gz FJQHWFRFWMXIOD-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1 ZINC001422529250 1380261802 /nfs/dbraw/zinc/26/18/02/1380261802.db2.gz MBQGJCJJNUEHRF-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1 ZINC001422529250 1380261807 /nfs/dbraw/zinc/26/18/07/1380261807.db2.gz MBQGJCJJNUEHRF-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]CC1CC2(CCC2)C1 ZINC001438522681 1388654217 /nfs/dbraw/zinc/65/42/17/1388654217.db2.gz SLNVUWCFRPWIRZ-MRXNPFEDSA-N 1 3 335.536 2.783 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CCC2)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001422550610 1380302381 /nfs/dbraw/zinc/30/23/81/1380302381.db2.gz PPLBJUGBPXLRNJ-IAGOWNOFSA-N 1 3 343.515 2.890 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@@H](C)NC(=O)[C@@H]1CCCCN1C(C)C ZINC001422575949 1380352612 /nfs/dbraw/zinc/35/26/12/1380352612.db2.gz WFJPZQPOTKCIDF-APWZRJJASA-N 1 3 349.494 2.991 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(C)cc1C ZINC001422617375 1380442845 /nfs/dbraw/zinc/44/28/45/1380442845.db2.gz JJHVKWAFMKUUHK-IEBWSBKVSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](C)NC(=O)[C@@H]2CCC[N@@H+]2C(C)C)n1 ZINC001422643375 1380475548 /nfs/dbraw/zinc/47/55/48/1380475548.db2.gz OJKBSZYRNVSCBQ-LPHOPBHVSA-N 1 3 346.519 2.672 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](C)NC(=O)[C@@H]2CCC[N@H+]2C(C)C)n1 ZINC001422643375 1380475552 /nfs/dbraw/zinc/47/55/52/1380475552.db2.gz OJKBSZYRNVSCBQ-LPHOPBHVSA-N 1 3 346.519 2.672 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)[C@H]1CCCN1C)[NH2+]CC1CC(C)(C)C1 ZINC001422674962 1380560959 /nfs/dbraw/zinc/56/09/59/1380560959.db2.gz ZSDZGSBUZBXQKO-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC2(C[NH2+]Cc3ccsc3)CCCCC2)C1 ZINC001422686043 1380591877 /nfs/dbraw/zinc/59/18/77/1380591877.db2.gz XWHPSBLSQHNAIY-MRXNPFEDSA-N 1 3 349.544 2.999 10 0 EFAEHO Cc1cc(C)cc(CN2CC([C@H](C)NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c1 ZINC001422755501 1380764167 /nfs/dbraw/zinc/76/41/67/1380764167.db2.gz SCLSOCORUJZNMT-ROUUACIJSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1cc(C)cc(CN2CC([C@H](C)NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c1 ZINC001422755501 1380764172 /nfs/dbraw/zinc/76/41/72/1380764172.db2.gz SCLSOCORUJZNMT-ROUUACIJSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(CN2C[C@H](NC(=O)[C@H](C(C)C)[NH+](C)C)C(C)(C)C2)cc1 ZINC001422785358 1380803275 /nfs/dbraw/zinc/80/32/75/1380803275.db2.gz DTQAFHWYXVJJSZ-OALUTQOASA-N 1 3 345.531 2.908 10 0 EFAEHO C[C@H](C[N@H+](C)[C@H]1CCc2ccccc21)NC(=O)C1(N(C)C)CCC1 ZINC001422825100 1380864917 /nfs/dbraw/zinc/86/49/17/1380864917.db2.gz PUGUHRYGNNGUBH-QAPCUYQASA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@H](C[N@@H+](C)[C@H]1CCc2ccccc21)NC(=O)C1(N(C)C)CCC1 ZINC001422825100 1380864924 /nfs/dbraw/zinc/86/49/24/1380864924.db2.gz PUGUHRYGNNGUBH-QAPCUYQASA-N 1 3 329.488 2.595 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)C[C@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001422835719 1380888859 /nfs/dbraw/zinc/88/88/59/1380888859.db2.gz PCMLPIRXNCLLGK-HOTGVXAUSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)C[C@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001422835719 1380888870 /nfs/dbraw/zinc/88/88/70/1380888870.db2.gz PCMLPIRXNCLLGK-HOTGVXAUSA-N 1 3 347.503 2.677 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@H+](CCCC1CCC1)C2 ZINC001422874452 1380981146 /nfs/dbraw/zinc/98/11/46/1380981146.db2.gz MWCDKONHTUGGOE-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@@H+](CCCC1CCC1)C2 ZINC001422874452 1380981149 /nfs/dbraw/zinc/98/11/49/1380981149.db2.gz MWCDKONHTUGGOE-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CCCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001422878674 1380989880 /nfs/dbraw/zinc/98/98/80/1380989880.db2.gz XVFOKBQXJBUFNV-INIZCTEOSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@H](F)CC[N@H+]1CCCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001422878674 1380989886 /nfs/dbraw/zinc/98/98/86/1380989886.db2.gz XVFOKBQXJBUFNV-INIZCTEOSA-N 1 3 341.515 2.637 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@H+](C)CCc1ccc(C)cc1 ZINC001422917980 1381053207 /nfs/dbraw/zinc/05/32/07/1381053207.db2.gz NFLWYAJWHCUGLB-ICSRJNTNSA-N 1 3 345.531 2.848 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCc1ccc(C)cc1 ZINC001422917980 1381053210 /nfs/dbraw/zinc/05/32/10/1381053210.db2.gz NFLWYAJWHCUGLB-ICSRJNTNSA-N 1 3 345.531 2.848 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)CCc1ccc(C)cc1 ZINC001422917978 1381053881 /nfs/dbraw/zinc/05/38/81/1381053881.db2.gz NFLWYAJWHCUGLB-AZUAARDMSA-N 1 3 345.531 2.848 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCc1ccc(C)cc1 ZINC001422917978 1381053887 /nfs/dbraw/zinc/05/38/87/1381053887.db2.gz NFLWYAJWHCUGLB-AZUAARDMSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2ccc(F)cc2)C1)N(C)C ZINC001422920695 1381060028 /nfs/dbraw/zinc/06/00/28/1381060028.db2.gz YQSRHVNWIZKIAD-OHDICMOHSA-N 1 3 349.494 2.957 10 0 EFAEHO CN(C/C=C/Cl)C1CCN(C(=O)[C@@H]2CCC[C@@H]([NH+](C)C)C2)CC1 ZINC001422932799 1381084551 /nfs/dbraw/zinc/08/45/51/1381084551.db2.gz NBXQSNFWAWGVMH-OWTDREKGSA-N 1 3 341.927 2.782 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H](C1CC1)N(C)C(=O)CN(C)C(C)C ZINC001422999173 1381183900 /nfs/dbraw/zinc/18/39/00/1381183900.db2.gz VYWKAQGCKHURIN-IBGZPJMESA-N 1 3 331.504 2.662 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]Cc1ccc(C)cc1)C1CC1 ZINC001423004484 1381191657 /nfs/dbraw/zinc/19/16/57/1381191657.db2.gz PVKBVSOSGMBCPE-VQTJNVASSA-N 1 3 343.515 2.854 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N[C@H](CNCc2ccccc2Cl)C2CC2)CC[N@@H+]1C ZINC001423012019 1381205531 /nfs/dbraw/zinc/20/55/31/1381205531.db2.gz ZDTUQYCDYPZSAH-MZMPZRCHSA-N 1 3 349.906 2.665 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N[C@H](CNCc2ccccc2Cl)C2CC2)CC[N@H+]1C ZINC001423012019 1381205537 /nfs/dbraw/zinc/20/55/37/1381205537.db2.gz ZDTUQYCDYPZSAH-MZMPZRCHSA-N 1 3 349.906 2.665 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N[C@@H](CNCc2ccccc2Cl)C2CC2)CC[N@@H+]1C ZINC001423012024 1381205747 /nfs/dbraw/zinc/20/57/47/1381205747.db2.gz ZDTUQYCDYPZSAH-QBIMZIAESA-N 1 3 349.906 2.665 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N[C@@H](CNCc2ccccc2Cl)C2CC2)CC[N@H+]1C ZINC001423012024 1381205755 /nfs/dbraw/zinc/20/57/55/1381205755.db2.gz ZDTUQYCDYPZSAH-QBIMZIAESA-N 1 3 349.906 2.665 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](NC(=O)[C@H](C(C)C)[NH+](C)C)C2CC2)c1 ZINC001423014565 1381210156 /nfs/dbraw/zinc/21/01/56/1381210156.db2.gz SMUCRTDQLMPFMA-MOPGFXCFSA-N 1 3 349.494 2.705 10 0 EFAEHO C[C@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001423071288 1381300649 /nfs/dbraw/zinc/30/06/49/1381300649.db2.gz IWSMJBOJHJGGOR-OAHLLOKOSA-N 1 3 342.487 2.589 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C[C@H](C)N(C)C(=O)CN(C)C2CCC2)c1 ZINC001438646133 1388716164 /nfs/dbraw/zinc/71/61/64/1388716164.db2.gz BMLPEKIXFSPDDB-HOTGVXAUSA-N 1 3 347.503 2.677 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCN1CCCc1ccccc1 ZINC001423129801 1381403396 /nfs/dbraw/zinc/40/33/96/1381403396.db2.gz XIWQLQCSVOJMBH-VQTJNVASSA-N 1 3 343.515 2.684 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCN1CCCc1ccccc1 ZINC001423129801 1381403408 /nfs/dbraw/zinc/40/34/08/1381403408.db2.gz XIWQLQCSVOJMBH-VQTJNVASSA-N 1 3 343.515 2.684 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC[C@@H]1CCN1[C@H]1CCc2ccccc21 ZINC001423150518 1381447146 /nfs/dbraw/zinc/44/71/46/1381447146.db2.gz GWHKJKLESKLWBW-HKUYNNGSSA-N 1 3 329.488 2.596 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC[C@@H]1CCN1[C@H]1CCc2ccccc21 ZINC001423150518 1381447164 /nfs/dbraw/zinc/44/71/64/1381447164.db2.gz GWHKJKLESKLWBW-HKUYNNGSSA-N 1 3 329.488 2.596 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)NC[C@@H]1CCN1CC1CC2(CCC2)C1 ZINC001423151383 1381448307 /nfs/dbraw/zinc/44/83/07/1381448307.db2.gz GQBQYXUJHAEZDV-SFHVURJKSA-N 1 3 333.520 2.633 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)NC[C@H]1CCN1CC1CC2(CCC2)C1 ZINC001423151372 1381448417 /nfs/dbraw/zinc/44/84/17/1381448417.db2.gz GQBQYXUJHAEZDV-GOSISDBHSA-N 1 3 333.520 2.633 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001423173692 1381504577 /nfs/dbraw/zinc/50/45/77/1381504577.db2.gz QGQDWAOKWRYNLW-GJZGRUSLSA-N 1 3 333.467 2.589 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001438676412 1388732658 /nfs/dbraw/zinc/73/26/58/1388732658.db2.gz AQIYGCFQBTYNDX-ULQDDVLXSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001438676412 1388732661 /nfs/dbraw/zinc/73/26/61/1388732661.db2.gz AQIYGCFQBTYNDX-ULQDDVLXSA-N 1 3 349.494 2.801 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001423243699 1381668367 /nfs/dbraw/zinc/66/83/67/1381668367.db2.gz JJHMQFPZTFLSGN-QZTJIDSGSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001423243699 1381668396 /nfs/dbraw/zinc/66/83/96/1381668396.db2.gz JJHMQFPZTFLSGN-QZTJIDSGSA-N 1 3 345.462 2.581 10 0 EFAEHO CC(C)c1ccc(CNC2(CNC(=O)C3(C[NH+](C)C)CC3)CC2)cc1 ZINC001423257238 1381714203 /nfs/dbraw/zinc/71/42/03/1381714203.db2.gz CSVIQPPVSQNTLW-UHFFFAOYSA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@@H](NC1(CNC(=O)C2(C[NH+](C)C)CC2)CC1)c1cccc(Cl)c1 ZINC001423260156 1381722426 /nfs/dbraw/zinc/72/24/26/1381722426.db2.gz OUISOBHSCACBBL-CQSZACIVSA-N 1 3 349.906 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+][C@@H]2CCc3ccc(Cl)cc32)CC1 ZINC001423308660 1381765852 /nfs/dbraw/zinc/76/58/52/1381765852.db2.gz TTYRWJKMZVQTPL-QGZVFWFLSA-N 1 3 349.906 2.906 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)c(C)c1 ZINC001423319970 1381779695 /nfs/dbraw/zinc/77/96/95/1381779695.db2.gz BEMWCDKJZLOEOX-MJGOQNOKSA-N 1 3 331.504 2.723 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CC[C@@H](NCc2cc(C)ccc2F)[C@H]1C ZINC001423333368 1381797409 /nfs/dbraw/zinc/79/74/09/1381797409.db2.gz XGGPAPBNFOAZJM-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CC[C@@H](NCc2cc(C)ccc2F)[C@H]1C ZINC001423333368 1381797415 /nfs/dbraw/zinc/79/74/15/1381797415.db2.gz XGGPAPBNFOAZJM-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(CF)cc2)[C@H]1C ZINC001423333407 1381797609 /nfs/dbraw/zinc/79/76/09/1381797609.db2.gz XIPQROBFJSRADU-CRAIPNDOSA-N 1 3 335.467 2.575 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@]2(C1)CCCN(Cc1ccsc1)C2 ZINC001423347982 1381823673 /nfs/dbraw/zinc/82/36/73/1381823673.db2.gz DJWBJDHXCPVCRB-GOSISDBHSA-N 1 3 335.517 2.514 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@H]21 ZINC001423351665 1381828026 /nfs/dbraw/zinc/82/80/26/1381828026.db2.gz CLUNIFCAPHCEDK-RCCFBDPRSA-N 1 3 335.536 2.734 10 0 EFAEHO Cc1ccc(CN[C@@H]2C[C@H](C)N(C(=O)CC[NH+](C)C)C2)c(Cl)c1 ZINC001423357722 1381839518 /nfs/dbraw/zinc/83/95/18/1381839518.db2.gz QDQVWCBWBJWIJE-GOEBONIOSA-N 1 3 337.895 2.679 10 0 EFAEHO CC(C)CCC[NH+]1CCC2(CCN(C(=O)Cc3c[nH]cn3)C2)CC1 ZINC001423364872 1381852467 /nfs/dbraw/zinc/85/24/67/1381852467.db2.gz ZVTBTONXVUCIFC-UHFFFAOYSA-N 1 3 332.492 2.703 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N1C[C@H]([NH2+]CCC(F)(F)F)C(C)(C)C1 ZINC001423398576 1381904344 /nfs/dbraw/zinc/90/43/44/1381904344.db2.gz RWMZBJWHIWGMRP-KBPBESRZSA-N 1 3 349.441 2.638 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC2(C)CCN(Cc3ccsc3)CC2)C1 ZINC001423528519 1382020318 /nfs/dbraw/zinc/02/03/18/1382020318.db2.gz YKLUYMVRIIMNDZ-HNNXBMFYSA-N 1 3 335.517 2.561 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC2(C)CCN(Cc3ccsc3)CC2)C1 ZINC001423528519 1382020324 /nfs/dbraw/zinc/02/03/24/1382020324.db2.gz YKLUYMVRIIMNDZ-HNNXBMFYSA-N 1 3 335.517 2.561 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@]2(C)CCN(C(=O)CN3CC[C@H](C)C3)C2)cc1 ZINC001423626309 1382189541 /nfs/dbraw/zinc/18/95/41/1382189541.db2.gz HJTXKFZIWMZRKH-GHTZIAJQSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@]2(C)CCN(C(=O)CN3CC[C@@H](C)C3)C2)cc1 ZINC001423626310 1382190482 /nfs/dbraw/zinc/19/04/82/1382190482.db2.gz HJTXKFZIWMZRKH-NQIIRXRSSA-N 1 3 343.515 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@]1(C)CCC[N@H+](Cc2ccccc2)C1 ZINC001423701279 1382316958 /nfs/dbraw/zinc/31/69/58/1382316958.db2.gz FPRTUQDXLVUZOG-FQEVSTJZSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@]1(C)CCC[N@@H+](Cc2ccccc2)C1 ZINC001423701279 1382316965 /nfs/dbraw/zinc/31/69/65/1382316965.db2.gz FPRTUQDXLVUZOG-FQEVSTJZSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@]1(C)CCC[N@H+](Cc2ccccc2)C1 ZINC001423701282 1382317329 /nfs/dbraw/zinc/31/73/29/1382317329.db2.gz FPRTUQDXLVUZOG-HXUWFJFHSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@]1(C)CCC[N@@H+](Cc2ccccc2)C1 ZINC001423701282 1382317330 /nfs/dbraw/zinc/31/73/30/1382317330.db2.gz FPRTUQDXLVUZOG-HXUWFJFHSA-N 1 3 331.504 2.745 10 0 EFAEHO C[C@@H](C(=O)NC[C@@]1(C)CCC[N@H+](CCCF)C1)N1CCCCCC1 ZINC001423705836 1382324396 /nfs/dbraw/zinc/32/43/96/1382324396.db2.gz RECBZZLJMKGTFX-PKOBYXMFSA-N 1 3 341.515 2.829 10 0 EFAEHO C[C@@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CCCF)C1)N1CCCCCC1 ZINC001423705836 1382324403 /nfs/dbraw/zinc/32/44/03/1382324403.db2.gz RECBZZLJMKGTFX-PKOBYXMFSA-N 1 3 341.515 2.829 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CCC[C@@](C)(CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001423708413 1382332667 /nfs/dbraw/zinc/33/26/67/1382332667.db2.gz UVGVZVPHNRVQOM-LPHOPBHVSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](F)CC[N@H+]1CCC[C@@](C)(CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001423708413 1382332673 /nfs/dbraw/zinc/33/26/73/1382332673.db2.gz UVGVZVPHNRVQOM-LPHOPBHVSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccc(F)cc1)C2 ZINC001423934913 1382517847 /nfs/dbraw/zinc/51/78/47/1382517847.db2.gz WHTLYNWUJZKWJX-UHOSZYNNSA-N 1 3 347.478 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccc(F)cc1)C2 ZINC001423934913 1382517859 /nfs/dbraw/zinc/51/78/59/1382517859.db2.gz WHTLYNWUJZKWJX-UHOSZYNNSA-N 1 3 347.478 2.635 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H](C)[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001423951136 1382538792 /nfs/dbraw/zinc/53/87/92/1382538792.db2.gz KCNPWELLFZHCEC-IRXDYDNUSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](C)[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001423954600 1382543211 /nfs/dbraw/zinc/54/32/11/1382543211.db2.gz NETNTKJSIYWQQJ-OALUTQOASA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([C@@H](C)[NH2+]CCc2ccccc2F)C1 ZINC001423957157 1382545302 /nfs/dbraw/zinc/54/53/02/1382545302.db2.gz QAWOBZRVYNFPFG-SJLPKXTDSA-N 1 3 349.494 2.535 10 0 EFAEHO CC(C)CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1(N(C)C)CCC1)C2 ZINC001423963996 1382559439 /nfs/dbraw/zinc/55/94/39/1382559439.db2.gz PKITWIXYDLHSTI-BCDXTJNWSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1(N(C)C)CCC1)C2 ZINC001423963996 1382559450 /nfs/dbraw/zinc/55/94/50/1382559450.db2.gz PKITWIXYDLHSTI-BCDXTJNWSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(F)c1 ZINC001424036453 1382650792 /nfs/dbraw/zinc/65/07/92/1382650792.db2.gz AEUPFDJVVFOYHS-OALUTQOASA-N 1 3 347.478 2.733 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(F)c1 ZINC001424036453 1382650797 /nfs/dbraw/zinc/65/07/97/1382650797.db2.gz AEUPFDJVVFOYHS-OALUTQOASA-N 1 3 347.478 2.733 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([C@@H](C)[NH2+]CC2CC(C)(C)C2)C1 ZINC001438773473 1388802620 /nfs/dbraw/zinc/80/26/20/1388802620.db2.gz RRQFVWXLJQDZKI-AEFFLSMTSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+]CC2CC(C)(C)C2)CCC1 ZINC001424171544 1382822149 /nfs/dbraw/zinc/82/21/49/1382822149.db2.gz IDQQSOOWMZGMHI-QGZVFWFLSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(CCCN(C)C(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21)CCC(F)(F)F ZINC001424324766 1382936214 /nfs/dbraw/zinc/93/62/14/1382936214.db2.gz DNDVOAXTGSGUOU-CABCVRRESA-N 1 3 349.441 2.736 10 0 EFAEHO CN(CCCN(C)C(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21)CCC(F)(F)F ZINC001424324766 1382936218 /nfs/dbraw/zinc/93/62/18/1382936218.db2.gz DNDVOAXTGSGUOU-CABCVRRESA-N 1 3 349.441 2.736 10 0 EFAEHO C[C@@H](c1ccccc1F)N(C)CCCN(C)C(=O)C12CC[NH+](CC1)C2 ZINC001424326818 1382938638 /nfs/dbraw/zinc/93/86/38/1382938638.db2.gz PQMAHRGGKHASBF-INIZCTEOSA-N 1 3 347.478 2.763 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)[N@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001424333553 1382948049 /nfs/dbraw/zinc/94/80/49/1382948049.db2.gz XMGVUAPZYDXLMZ-INIZCTEOSA-N 1 3 335.467 2.763 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001424333553 1382948052 /nfs/dbraw/zinc/94/80/52/1382948052.db2.gz XMGVUAPZYDXLMZ-INIZCTEOSA-N 1 3 335.467 2.763 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001424383593 1382973826 /nfs/dbraw/zinc/97/38/26/1382973826.db2.gz JUZUCPXDWQDKNQ-IBGZPJMESA-N 1 3 332.492 2.703 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001424383593 1382973833 /nfs/dbraw/zinc/97/38/33/1382973833.db2.gz JUZUCPXDWQDKNQ-IBGZPJMESA-N 1 3 332.492 2.703 10 0 EFAEHO CCCN1Cc2ccccc2C[C@H]1CNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001424395256 1382983618 /nfs/dbraw/zinc/98/36/18/1382983618.db2.gz PALOCVFHXQUTKH-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO CCCN1Cc2ccccc2C[C@H]1CNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001424395256 1382983624 /nfs/dbraw/zinc/98/36/24/1382983624.db2.gz PALOCVFHXQUTKH-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NCc2ccc3c(c2)CN(CCC2CC2)C3)C1 ZINC001424439218 1383018651 /nfs/dbraw/zinc/01/86/51/1383018651.db2.gz BFIPZNHETOIKMJ-SFHVURJKSA-N 1 3 341.499 2.760 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NCc2ccc3c(c2)CN(CCC2CC2)C3)C1 ZINC001424439218 1383018656 /nfs/dbraw/zinc/01/86/56/1383018656.db2.gz BFIPZNHETOIKMJ-SFHVURJKSA-N 1 3 341.499 2.760 10 0 EFAEHO CC1CCN(CC(=O)N2CCC(C)([NH2+]CCC(F)(F)F)CC2)CC1 ZINC001424493199 1383047991 /nfs/dbraw/zinc/04/79/91/1383047991.db2.gz LUVBXSXFTKGWCZ-UHFFFAOYSA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)CC[NH2+][C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001438825765 1388842753 /nfs/dbraw/zinc/84/27/53/1388842753.db2.gz FYFWYQFTGLZMMQ-LPHOPBHVSA-N 1 3 343.531 2.975 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+][C@@H](C)c2ccc(F)cc2)C1 ZINC001424733304 1383305225 /nfs/dbraw/zinc/30/52/25/1383305225.db2.gz HCOBYHHGVNHKRI-SYJJWHGVSA-N 1 3 335.467 2.711 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001424796317 1383353783 /nfs/dbraw/zinc/35/37/83/1383353783.db2.gz LCYKSWDIZRMZDB-SJORKVTESA-N 1 3 331.504 2.505 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1C ZINC001424803445 1383362586 /nfs/dbraw/zinc/36/25/86/1383362586.db2.gz RPUGXPDXGHEOPY-IRXDYDNUSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)cs1 ZINC001424820233 1383379717 /nfs/dbraw/zinc/37/97/17/1383379717.db2.gz NFMPVRUDPHIZOI-HUUCEWRRSA-N 1 3 337.533 2.914 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)[C@@H](C)NC(=O)CCC[NH+]2CCCC2)c1 ZINC001424845047 1383408275 /nfs/dbraw/zinc/40/82/75/1383408275.db2.gz BMQLWMNEDDRSLL-IAGOWNOFSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CCC([NH2+]CCc2ccccc2)CC1)N(C)C ZINC001424860440 1383431720 /nfs/dbraw/zinc/43/17/20/1383431720.db2.gz UNFZUHLCLIIJIM-SOAGJPPSSA-N 1 3 345.531 2.929 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CCCCC[N@@H+]1CCCF)N1CCCCCC1 ZINC001425194630 1383539692 /nfs/dbraw/zinc/53/96/92/1383539692.db2.gz XTUICZPHCOBFAR-ZWKOTPCHSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CCCCC[N@H+]1CCCF)N1CCCCCC1 ZINC001425194630 1383539698 /nfs/dbraw/zinc/53/96/98/1383539698.db2.gz XTUICZPHCOBFAR-ZWKOTPCHSA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)C[N@@H+]1C[C@H](NC(=O)[C@@H](C(C)C)N2CCCCC2)C(C)(C)C1 ZINC001425307163 1383601770 /nfs/dbraw/zinc/60/17/70/1383601770.db2.gz XMVOSIOMLULOAB-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)C[N@H+]1C[C@H](NC(=O)[C@@H](C(C)C)N2CCCCC2)C(C)(C)C1 ZINC001425307163 1383601775 /nfs/dbraw/zinc/60/17/75/1383601775.db2.gz XMVOSIOMLULOAB-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001425309195 1383603256 /nfs/dbraw/zinc/60/32/56/1383603256.db2.gz RANXQKUIDBYJJR-IAGOWNOFSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001425309195 1383603259 /nfs/dbraw/zinc/60/32/59/1383603259.db2.gz RANXQKUIDBYJJR-IAGOWNOFSA-N 1 3 325.541 2.835 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@H](C)c3ccccc3F)C[C@H]21 ZINC001425373136 1383633075 /nfs/dbraw/zinc/63/30/75/1383633075.db2.gz HPEPEUOBMQLBDF-DDBAPUKQSA-N 1 3 347.478 2.523 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@H](C)c3ccccc3F)C[C@H]21 ZINC001425373136 1383633076 /nfs/dbraw/zinc/63/30/76/1383633076.db2.gz HPEPEUOBMQLBDF-DDBAPUKQSA-N 1 3 347.478 2.523 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001425414022 1383651769 /nfs/dbraw/zinc/65/17/69/1383651769.db2.gz MJXUWVXISXPCNW-WGSAOQKQSA-N 1 3 331.504 2.574 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@H+](C)CCN(C)C(=O)[C@@H]2CCCN2C)c1 ZINC001438862558 1388869775 /nfs/dbraw/zinc/86/97/75/1388869775.db2.gz GANBJICPABDQMO-HKUYNNGSSA-N 1 3 331.504 2.849 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@@H+](C)CCN(C)C(=O)[C@@H]2CCCN2C)c1 ZINC001438862558 1388869779 /nfs/dbraw/zinc/86/97/79/1388869779.db2.gz GANBJICPABDQMO-HKUYNNGSSA-N 1 3 331.504 2.849 10 0 EFAEHO Cc1cccnc1CN[C@@H](C)CN(C)C(=O)[C@H](C)[NH+]1CCCCCC1 ZINC001425642389 1383731532 /nfs/dbraw/zinc/73/15/32/1383731532.db2.gz PWRAYMSAKDEOCE-ROUUACIJSA-N 1 3 346.519 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc(Cl)cc2)C[C@H]1C ZINC001425887472 1383829635 /nfs/dbraw/zinc/82/96/35/1383829635.db2.gz JXTMLRMGZSAPLX-PBHICJAKSA-N 1 3 337.895 2.759 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CC3CC(C)(C)C3)[C@H]2C1 ZINC001425913872 1383850559 /nfs/dbraw/zinc/85/05/59/1383850559.db2.gz FDPDHRKCGMVWDW-GBESFXJTSA-N 1 3 349.563 2.981 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2ccc(CF)cc2)CC[N@@H+]1C ZINC001438874158 1388883416 /nfs/dbraw/zinc/88/34/16/1388883416.db2.gz OOCRRZUGQOLHQN-RBUKOAKNSA-N 1 3 349.494 2.777 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2ccc(CF)cc2)CC[N@H+]1C ZINC001438874158 1388883422 /nfs/dbraw/zinc/88/34/22/1388883422.db2.gz OOCRRZUGQOLHQN-RBUKOAKNSA-N 1 3 349.494 2.777 10 0 EFAEHO CN(CC[N@H+](C)[C@H]1CCc2ccccc21)C(=O)CN(C)C1CCC1 ZINC001438880780 1388887509 /nfs/dbraw/zinc/88/75/09/1388887509.db2.gz BFWHKQULINKSMO-IBGZPJMESA-N 1 3 329.488 2.548 10 0 EFAEHO CN(CC[N@@H+](C)[C@H]1CCc2ccccc21)C(=O)CN(C)C1CCC1 ZINC001438880780 1388887516 /nfs/dbraw/zinc/88/75/16/1388887516.db2.gz BFWHKQULINKSMO-IBGZPJMESA-N 1 3 329.488 2.548 10 0 EFAEHO CC(C)N(CC[N@H+](C)[C@H]1CCc2ccccc21)C(=O)[C@H]1CCCN1C ZINC001426110303 1383992598 /nfs/dbraw/zinc/99/25/98/1383992598.db2.gz DXWCIZDAIIMFDJ-VQTJNVASSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(CC[N@@H+](C)[C@H]1CCc2ccccc21)C(=O)[C@H]1CCCN1C ZINC001426110303 1383992600 /nfs/dbraw/zinc/99/26/00/1383992600.db2.gz DXWCIZDAIIMFDJ-VQTJNVASSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]CC1CC(C)(C)C1)C(C)(C)C ZINC001426169907 1384043340 /nfs/dbraw/zinc/04/33/40/1384043340.db2.gz VNSBTPLLHWWKEO-INIZCTEOSA-N 1 3 325.541 2.883 10 0 EFAEHO C[C@@H](NC(=O)[C@H](C)N1CCCCCC1)C1CC[NH+](CC2CC2)CC1 ZINC001426185999 1384052909 /nfs/dbraw/zinc/05/29/09/1384052909.db2.gz RHXBJZIRFSWNCR-SJORKVTESA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)N(C)CCN(C)C(=O)C12CC[NH+](CC1)C2 ZINC001438929752 1388930841 /nfs/dbraw/zinc/93/08/41/1388930841.db2.gz RPGKEFCRXCWEEE-HNNXBMFYSA-N 1 3 349.906 2.887 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)CCN(C)C(=O)CN2CCCC2)c(C)c1 ZINC001438936225 1388937075 /nfs/dbraw/zinc/93/70/75/1388937075.db2.gz FFUSAKQAZKACBQ-UHFFFAOYSA-N 1 3 331.504 2.598 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)CCN(C)C(=O)CN2CCCC2)c(C)c1 ZINC001438936225 1388937077 /nfs/dbraw/zinc/93/70/77/1388937077.db2.gz FFUSAKQAZKACBQ-UHFFFAOYSA-N 1 3 331.504 2.598 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)CC[C@H]1CCCC1(F)F ZINC001438937190 1388938440 /nfs/dbraw/zinc/93/84/40/1388938440.db2.gz KTADEWPOCDWWLR-OAHLLOKOSA-N 1 3 333.467 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC001438937190 1388938443 /nfs/dbraw/zinc/93/84/43/1388938443.db2.gz KTADEWPOCDWWLR-OAHLLOKOSA-N 1 3 333.467 2.542 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(Cl)cc2)C1 ZINC001438947215 1388945238 /nfs/dbraw/zinc/94/52/38/1388945238.db2.gz HHKZZFQXPHVQAK-WMZOPIPTSA-N 1 3 349.906 2.715 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@@H]1CCC[C@@H]1NC(=O)CN(C)C(C)C ZINC001438961376 1388954500 /nfs/dbraw/zinc/95/45/00/1388954500.db2.gz LUOHXXIKXJNHES-PMACEKPBSA-N 1 3 345.531 2.964 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+][C@@H]1CCCc2ccccc21 ZINC001439071805 1388978147 /nfs/dbraw/zinc/97/81/47/1388978147.db2.gz KXOSRDFFVOWCNQ-QFBILLFUSA-N 1 3 331.504 2.889 10 0 EFAEHO CCN(CCN[C@@H](C)c1ccc(F)c(Cl)c1)C(=O)CC[NH+](C)C ZINC001439080608 1388984144 /nfs/dbraw/zinc/98/41/44/1388984144.db2.gz PVWNVTJEHYPHBN-ZDUSSCGKSA-N 1 3 343.874 2.930 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@H+](CC2CCC2)CC1(C)C)N1CCCC1 ZINC001506752109 1406254617 /nfs/dbraw/zinc/25/46/17/1406254617.db2.gz GMSRTLRQWZSKBT-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@@H+](CC2CCC2)CC1(C)C)N1CCCC1 ZINC001506752109 1406254620 /nfs/dbraw/zinc/25/46/20/1406254620.db2.gz GMSRTLRQWZSKBT-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO C[NH+](C)[C@H]1CCCC[C@H]1NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC001433657588 1386944062 /nfs/dbraw/zinc/94/40/62/1386944062.db2.gz COVYZTYLPCUQJM-SJORKVTESA-N 1 3 328.460 2.893 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](CCC3CC3)C[C@@H]2C1)CC(C)(C)C ZINC001506851521 1406333927 /nfs/dbraw/zinc/33/39/27/1406333927.db2.gz DLZIFRNLGWYQSK-CEXWTWQISA-N 1 3 349.563 2.981 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](CCC3CC3)C[C@@H]2C1)CC(C)(C)C ZINC001506851521 1406333937 /nfs/dbraw/zinc/33/39/37/1406333937.db2.gz DLZIFRNLGWYQSK-CEXWTWQISA-N 1 3 349.563 2.981 10 0 EFAEHO CC[N@H+](C)[C@@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)C1 ZINC001434425133 1387145859 /nfs/dbraw/zinc/14/58/59/1387145859.db2.gz YUWJZHPKTRJNJC-PKOBYXMFSA-N 1 3 347.478 2.590 10 0 EFAEHO CC[N@@H+](C)[C@@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)C1 ZINC001434425133 1387145864 /nfs/dbraw/zinc/14/58/64/1387145864.db2.gz YUWJZHPKTRJNJC-PKOBYXMFSA-N 1 3 347.478 2.590 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]C[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001439121180 1389000483 /nfs/dbraw/zinc/00/04/83/1389000483.db2.gz VPUSJTYBESEOLQ-IAGOWNOFSA-N 1 3 331.504 2.943 10 0 EFAEHO C[C@H](C[NH2+][C@H]1CCc2ccc(Cl)cc21)NC(=O)C1(N(C)C)CCC1 ZINC001439120414 1389000889 /nfs/dbraw/zinc/00/08/89/1389000889.db2.gz PLLQMKLKYZHYLH-DYVFJYSZSA-N 1 3 349.906 2.906 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1c(C)cccc1C ZINC001439181585 1389035672 /nfs/dbraw/zinc/03/56/72/1389035672.db2.gz GCQAGHHSDQOAGQ-MJGOQNOKSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1sccc1Cl ZINC001439212873 1389051424 /nfs/dbraw/zinc/05/14/24/1389051424.db2.gz HOODQKXALFZLBY-JSGCOSHPSA-N 1 3 343.924 2.869 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1sccc1Cl ZINC001439212873 1389051428 /nfs/dbraw/zinc/05/14/28/1389051428.db2.gz HOODQKXALFZLBY-JSGCOSHPSA-N 1 3 343.924 2.869 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+][C@@H](C)c1ccc(F)c(Cl)c1)N(C)C ZINC001439225532 1389058116 /nfs/dbraw/zinc/05/81/16/1389058116.db2.gz ODQYDOPYGSUGCE-MQIPJXDCSA-N 1 3 343.874 2.975 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001439251429 1389074399 /nfs/dbraw/zinc/07/43/99/1389074399.db2.gz FPVNQWCFGSYOSN-OXJNMPFZSA-N 1 3 349.494 2.802 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc(Cl)cc1 ZINC001439284963 1389096337 /nfs/dbraw/zinc/09/63/37/1389096337.db2.gz NGOZDINSAXGJIE-WMLDXEAASA-N 1 3 337.895 2.809 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@H+](C)Cc1ccc(CF)cc1 ZINC001439400817 1389244991 /nfs/dbraw/zinc/24/49/91/1389244991.db2.gz BKRLHTWLXBFECX-APWZRJJASA-N 1 3 349.494 2.967 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@@H+](C)Cc1ccc(CF)cc1 ZINC001439400817 1389245000 /nfs/dbraw/zinc/24/50/00/1389245000.db2.gz BKRLHTWLXBFECX-APWZRJJASA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001439403111 1389248444 /nfs/dbraw/zinc/24/84/44/1389248444.db2.gz SCNFRGXPDZEQQX-AEFFLSMTSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001439403111 1389248450 /nfs/dbraw/zinc/24/84/50/1389248450.db2.gz SCNFRGXPDZEQQX-AEFFLSMTSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1cc(Cl)ccc1C[N@@H+](C)C[C@@H](C)NC(=O)CN(C)C(C)C ZINC001439406877 1389256854 /nfs/dbraw/zinc/25/68/54/1389256854.db2.gz MPKVUQAMBFWVLT-OAHLLOKOSA-N 1 3 339.911 2.925 10 0 EFAEHO Cc1cc(Cl)ccc1C[N@H+](C)C[C@@H](C)NC(=O)CN(C)C(C)C ZINC001439406877 1389256860 /nfs/dbraw/zinc/25/68/60/1389256860.db2.gz MPKVUQAMBFWVLT-OAHLLOKOSA-N 1 3 339.911 2.925 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NC2(C)CC[NH+](CCCF)CC2)C1 ZINC001439803856 1389333148 /nfs/dbraw/zinc/33/31/48/1389333148.db2.gz VRVOTQCCIWPOCL-GOSISDBHSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC2(C)CC[NH+](CCCF)CC2)C1 ZINC001439803857 1389333227 /nfs/dbraw/zinc/33/32/27/1389333227.db2.gz VRVOTQCCIWPOCL-SFHVURJKSA-N 1 3 345.478 2.529 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2ccccc2CC)C1 ZINC001440135707 1389406419 /nfs/dbraw/zinc/40/64/19/1389406419.db2.gz LMYUWIZHXUKNRP-FXAWDEMLSA-N 1 3 345.531 2.775 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2csc(C)c2)C1 ZINC001440137852 1389407164 /nfs/dbraw/zinc/40/71/64/1389407164.db2.gz RCNIZHFLARHMQP-YOEHRIQHSA-N 1 3 337.533 2.582 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[C@H](C[NH2+]Cc2ccsc2)CC1)C1CCC1 ZINC001440219282 1389448592 /nfs/dbraw/zinc/44/85/92/1389448592.db2.gz CTCLUJSQWFMWDI-JCNLHEQBSA-N 1 3 349.544 2.997 10 0 EFAEHO CN(C[C@@H]1CCN1CCCC1CCC1)C(=O)C(C)(C)[NH+]1CCCC1 ZINC001440227417 1389457263 /nfs/dbraw/zinc/45/72/63/1389457263.db2.gz HNZVOMHYBCYBJK-SFHVURJKSA-N 1 3 335.536 2.974 10 0 EFAEHO CN(C[C@@H]1CCN1CC1CCC1)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001440233952 1389462365 /nfs/dbraw/zinc/46/23/65/1389462365.db2.gz KKGQNYOSEFNYDR-SFHVURJKSA-N 1 3 335.536 2.972 10 0 EFAEHO CN(C[C@@H]1CCN1CC1CCC1)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001440233952 1389462368 /nfs/dbraw/zinc/46/23/68/1389462368.db2.gz KKGQNYOSEFNYDR-SFHVURJKSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](Cc1csc(C)c1)CC2 ZINC001440241700 1389468249 /nfs/dbraw/zinc/46/82/49/1389468249.db2.gz PVNXVAVHADNYKF-UHFFFAOYSA-N 1 3 349.544 2.823 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H](CNC(=O)CC[NH+](C)C)C1)c1ccccc1Cl ZINC001440301834 1389515666 /nfs/dbraw/zinc/51/56/66/1389515666.db2.gz DUWBRJSWEKVULD-SOUVJXGZSA-N 1 3 337.895 2.837 10 0 EFAEHO CN(CC(=O)NC[C@H]1C[C@@H]([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1)CC(C)(C)C ZINC001440307532 1389518985 /nfs/dbraw/zinc/51/89/85/1389518985.db2.gz SBRHVDCTCNXCKW-QQXKLLMISA-N 1 3 349.563 2.885 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN3[C@H](C)CC[C@H]3C)C2)c1 ZINC001440312389 1389524797 /nfs/dbraw/zinc/52/47/97/1389524797.db2.gz FRKSDBPMNDUTQL-LFGUQSLTSA-N 1 3 343.515 2.852 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CC3(CCC3)C2)C1 ZINC001440312308 1389524827 /nfs/dbraw/zinc/52/48/27/1389524827.db2.gz DIMKTLLFPZDHDN-LRNSACPNSA-N 1 3 347.547 2.924 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN3[C@H](C)CC[C@@H]3C)C2)c1 ZINC001440312391 1389524868 /nfs/dbraw/zinc/52/48/68/1389524868.db2.gz FRKSDBPMNDUTQL-TZRIAGMCSA-N 1 3 343.515 2.852 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]([NH2+]Cc2ccc(F)cc2)C1)N1CCCC1 ZINC001440348788 1389554063 /nfs/dbraw/zinc/55/40/63/1389554063.db2.gz DVTHEWXRAPUOHS-SAABIXHNSA-N 1 3 347.478 2.685 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C/Cl)C1)N1CCCCCC1 ZINC001440406455 1389605843 /nfs/dbraw/zinc/60/58/43/1389605843.db2.gz ONPTWTIRELWTED-QZLPVJBESA-N 1 3 341.927 2.878 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C\Cl)C1)N1CCCCCC1 ZINC001440406456 1389606481 /nfs/dbraw/zinc/60/64/81/1389606481.db2.gz ONPTWTIRELWTED-RUUKRCDUSA-N 1 3 341.927 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@H]2CCC[N@H+](CC3CCC3)[C@H]2C1(C)C ZINC001440457207 1389656712 /nfs/dbraw/zinc/65/67/12/1389656712.db2.gz VFODROZCXBQCQD-BHIYHBOVSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@H]2CCC[N@@H+](CC3CCC3)[C@H]2C1(C)C ZINC001440457207 1389656715 /nfs/dbraw/zinc/65/67/15/1389656715.db2.gz VFODROZCXBQCQD-BHIYHBOVSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@@H]1CCCCCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001440460681 1389660790 /nfs/dbraw/zinc/66/07/90/1389660790.db2.gz KJHRKSZPTLPALY-HZPDHXFCSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCN(C)CC(=O)N1CCCCC[C@H]([NH2+]Cc2cccnc2C)C1 ZINC001440464235 1389666013 /nfs/dbraw/zinc/66/60/13/1389666013.db2.gz IFOMQCZJBDFFQB-IBGZPJMESA-N 1 3 346.519 2.593 10 0 EFAEHO CN(CCC[N@H+](C)Cc1ccc(CF)cc1)C(=O)CN1CCCC1 ZINC001440482176 1389687499 /nfs/dbraw/zinc/68/74/99/1389687499.db2.gz NQBHBGVQMAVCMR-UHFFFAOYSA-N 1 3 335.467 2.532 10 0 EFAEHO CN(CCC[N@@H+](C)Cc1ccc(CF)cc1)C(=O)CN1CCCC1 ZINC001440482176 1389687503 /nfs/dbraw/zinc/68/75/03/1389687503.db2.gz NQBHBGVQMAVCMR-UHFFFAOYSA-N 1 3 335.467 2.532 10 0 EFAEHO CN(CCC[N@H+](C)Cc1ccccc1C1CC1)C(=O)CN1CCCC1 ZINC001440484806 1389689606 /nfs/dbraw/zinc/68/96/06/1389689606.db2.gz TZDKFBGVLCMNGV-UHFFFAOYSA-N 1 3 343.515 2.940 10 0 EFAEHO CN(CCC[N@@H+](C)Cc1ccccc1C1CC1)C(=O)CN1CCCC1 ZINC001440484806 1389689611 /nfs/dbraw/zinc/68/96/11/1389689611.db2.gz TZDKFBGVLCMNGV-UHFFFAOYSA-N 1 3 343.515 2.940 10 0 EFAEHO Cc1cc(C)cc(CN2CC[C@H](NC(=O)C3(C[NH+](C)C)CC3)[C@H]2C)c1 ZINC001440498328 1389701652 /nfs/dbraw/zinc/70/16/52/1389701652.db2.gz YDKNYMUMHSRAGJ-MJGOQNOKSA-N 1 3 343.515 2.724 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CCC[NH+](C)C)CCN1C/C=C\c1ccccc1 ZINC001440499182 1389701835 /nfs/dbraw/zinc/70/18/35/1389701835.db2.gz QHAUFYJGTLNKIJ-DKVQLLHESA-N 1 3 329.488 2.621 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[N@H+](C)CC1CC(F)(F)C1 ZINC001440518304 1389720217 /nfs/dbraw/zinc/72/02/17/1389720217.db2.gz MLMBXFTXSLJTIL-INIZCTEOSA-N 1 3 345.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[N@@H+](C)CC1CC(F)(F)C1 ZINC001440518304 1389720222 /nfs/dbraw/zinc/72/02/22/1389720222.db2.gz MLMBXFTXSLJTIL-INIZCTEOSA-N 1 3 345.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CC[C@@H](C)F)CC(C)(C)C1 ZINC001440526556 1389728449 /nfs/dbraw/zinc/72/84/49/1389728449.db2.gz FMLXYRCGTBTLFY-HZPDHXFCSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CC[C@@H](C)F)CC(C)(C)C1 ZINC001440526556 1389728451 /nfs/dbraw/zinc/72/84/51/1389728451.db2.gz FMLXYRCGTBTLFY-HZPDHXFCSA-N 1 3 329.504 2.682 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@]2(CC[N@H+](CC3CCCC3)C2)C1 ZINC001440533688 1389736964 /nfs/dbraw/zinc/73/69/64/1389736964.db2.gz BZTFZJBXRGPZPR-HXUWFJFHSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@]2(CC[N@@H+](CC3CCCC3)C2)C1 ZINC001440533688 1389736969 /nfs/dbraw/zinc/73/69/69/1389736969.db2.gz BZTFZJBXRGPZPR-HXUWFJFHSA-N 1 3 335.536 2.833 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2cccc(Cl)c2)[C@@H](C)C1 ZINC001440589520 1389761945 /nfs/dbraw/zinc/76/19/45/1389761945.db2.gz BWPXXXMMSNOULX-YOEHRIQHSA-N 1 3 337.895 2.617 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C/Cl ZINC001440659390 1389805858 /nfs/dbraw/zinc/80/58/58/1389805858.db2.gz VKXCQDSHDQXMIJ-LOKCTGBGSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C/Cl ZINC001440659390 1389805860 /nfs/dbraw/zinc/80/58/60/1389805860.db2.gz VKXCQDSHDQXMIJ-LOKCTGBGSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001506882931 1406401096 /nfs/dbraw/zinc/40/10/96/1406401096.db2.gz ASRHJRTZWVQLSF-XBESVWMLSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001506882931 1406401099 /nfs/dbraw/zinc/40/10/99/1406401099.db2.gz ASRHJRTZWVQLSF-XBESVWMLSA-N 1 3 348.318 2.663 10 0 EFAEHO CC[C@@H](F)C[N@H+](CC)CC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001440701595 1389826015 /nfs/dbraw/zinc/82/60/15/1389826015.db2.gz IVELCOTUWZSXBZ-QGZVFWFLSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](F)C[N@@H+](CC)CC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001440701595 1389826022 /nfs/dbraw/zinc/82/60/22/1389826022.db2.gz IVELCOTUWZSXBZ-QGZVFWFLSA-N 1 3 341.515 2.779 10 0 EFAEHO Cc1ccc(C[N@@H+](C)C[C@@H]2CCCN2C(=O)CN(C)C(C)C)cc1 ZINC001440752983 1389870818 /nfs/dbraw/zinc/87/08/18/1389870818.db2.gz YYKQFCMPUWFRNT-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1ccc(C[N@H+](C)C[C@@H]2CCCN2C(=O)CN(C)C(C)C)cc1 ZINC001440752983 1389870822 /nfs/dbraw/zinc/87/08/22/1389870822.db2.gz YYKQFCMPUWFRNT-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO CCc1ccc(C[NH2+]CC2CC(NC(=O)CN(C)C(C)C)C2)cc1 ZINC001440762962 1389876775 /nfs/dbraw/zinc/87/67/75/1389876775.db2.gz MJXUWVXISXPCNW-UHFFFAOYSA-N 1 3 331.504 2.574 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H](C[NH2+]Cc3ccc(CF)cc3)C2)CCC1 ZINC001506886840 1406405030 /nfs/dbraw/zinc/40/50/30/1406405030.db2.gz RXWBYWWMPBKPNR-IYARVYRRSA-N 1 3 347.478 2.625 10 0 EFAEHO Cc1cncc(C[NH2+][C@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCCC2)c1 ZINC001440787544 1389897340 /nfs/dbraw/zinc/89/73/40/1389897340.db2.gz MHSSARILTIKZOZ-SJORKVTESA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1cncc(C[NH2+][C@@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCCC2)c1 ZINC001440787539 1389897456 /nfs/dbraw/zinc/89/74/56/1389897456.db2.gz MHSSARILTIKZOZ-IRXDYDNUSA-N 1 3 346.519 2.637 10 0 EFAEHO C[C@@H]([NH2+]CCC(F)(F)F)[C@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001440794647 1389902846 /nfs/dbraw/zinc/90/28/46/1389902846.db2.gz UHZGGFNPEWVBRS-OLZOCXBDSA-N 1 3 337.430 2.686 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(CF)cc1)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001440797802 1389904819 /nfs/dbraw/zinc/90/48/19/1389904819.db2.gz MYHQFNJFRGPKKU-CABCVRRESA-N 1 3 335.467 2.623 10 0 EFAEHO C[C@@H]([NH2+]Cc1cc2ccccc2o1)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001440804456 1389910437 /nfs/dbraw/zinc/91/04/37/1389910437.db2.gz YNSQUOKQOBOVLI-CABCVRRESA-N 1 3 343.471 2.900 10 0 EFAEHO CC(C)c1cccc(CN[C@@H](C)[C@@H](C)NC(=O)C2(C[NH+](C)C)CC2)n1 ZINC001440826048 1389928922 /nfs/dbraw/zinc/92/89/22/1389928922.db2.gz ZFWKTBWRMWPGKS-JKSUJKDBSA-N 1 3 346.519 2.530 10 0 EFAEHO C[C@H](NC(=O)CN(C)CC(C)(C)C)[C@H](C)[NH2+]Cc1ccsc1 ZINC001440845267 1389944755 /nfs/dbraw/zinc/94/47/55/1389944755.db2.gz XLLBQNSULSMMMT-KBPBESRZSA-N 1 3 325.522 2.709 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[N@H+](C)CCc1cccs1 ZINC001440921953 1390009291 /nfs/dbraw/zinc/00/92/91/1390009291.db2.gz UFIJWBXEBXFCME-DOTOQJQBSA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[N@@H+](C)CCc1cccs1 ZINC001440921953 1390009300 /nfs/dbraw/zinc/00/93/00/1390009300.db2.gz UFIJWBXEBXFCME-DOTOQJQBSA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[N@H+](C)CCc1cccs1 ZINC001440921955 1390009810 /nfs/dbraw/zinc/00/98/10/1390009810.db2.gz UFIJWBXEBXFCME-RDJZCZTQSA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[N@@H+](C)CCc1cccs1 ZINC001440921955 1390009814 /nfs/dbraw/zinc/00/98/14/1390009814.db2.gz UFIJWBXEBXFCME-RDJZCZTQSA-N 1 3 337.533 2.600 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)N(C)Cc1cccc(F)c1 ZINC001440933998 1390021609 /nfs/dbraw/zinc/02/16/09/1390021609.db2.gz IEXDWVAFUOZZOW-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)N(C)Cc1cccc(F)c1 ZINC001440933998 1390021618 /nfs/dbraw/zinc/02/16/18/1390021618.db2.gz IEXDWVAFUOZZOW-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)N(C)Cc1cccc(F)c1 ZINC001440934003 1390021911 /nfs/dbraw/zinc/02/19/11/1390021911.db2.gz IEXDWVAFUOZZOW-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)N(C)Cc1cccc(F)c1 ZINC001440934003 1390021914 /nfs/dbraw/zinc/02/19/14/1390021914.db2.gz IEXDWVAFUOZZOW-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001506903884 1406422412 /nfs/dbraw/zinc/42/24/12/1406422412.db2.gz SGQCLNFCPUONDS-ULQDDVLXSA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C)CCC[NH2+]CC1CC(F)(F)C1 ZINC001506921146 1406444282 /nfs/dbraw/zinc/44/42/82/1406444282.db2.gz FBTVGCVMSWPHSQ-ZBFHGGJFSA-N 1 3 345.478 2.779 10 0 EFAEHO Cc1ccc(C[NH+]2CCC(N(C)C(=O)CN(C)C(C)C)CC2)cc1 ZINC001441008629 1391028918 /nfs/dbraw/zinc/02/89/18/1391028918.db2.gz GQTVFKRXVHKOLH-UHFFFAOYSA-N 1 3 331.504 2.758 10 0 EFAEHO CCc1ccc(CN2CC[C@@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)cc1 ZINC001441099931 1391091616 /nfs/dbraw/zinc/09/16/16/1391091616.db2.gz WMYLSDBHHZLYKK-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccc(CN2CC[C@@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)cc1 ZINC001441099931 1391091620 /nfs/dbraw/zinc/09/16/20/1391091620.db2.gz WMYLSDBHHZLYKK-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C1CN(Cc2ccccc2)C1)[NH+]1CCCC1 ZINC001441215277 1391187998 /nfs/dbraw/zinc/18/79/98/1391187998.db2.gz UAOBCOZPBHFYSX-XLIONFOSSA-N 1 3 343.515 2.744 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1CN(Cc2ccc(C)c(C)c2)CC1(C)C ZINC001441260185 1391215282 /nfs/dbraw/zinc/21/52/82/1391215282.db2.gz LBKRJVLRYSSWLZ-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1CN(Cc2ccc(C)c(C)c2)CC1(C)C ZINC001441260185 1391215286 /nfs/dbraw/zinc/21/52/86/1391215286.db2.gz LBKRJVLRYSSWLZ-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CN(CCF)C[C@@H]1CCCN(C(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001441296990 1391239986 /nfs/dbraw/zinc/23/99/86/1391239986.db2.gz VNYMIJULUXWIFE-INIZCTEOSA-N 1 3 341.515 2.779 10 0 EFAEHO CN(CCF)C[C@@H]1CCCN(C(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001441296990 1391239989 /nfs/dbraw/zinc/23/99/89/1391239989.db2.gz VNYMIJULUXWIFE-INIZCTEOSA-N 1 3 341.515 2.779 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2[C@H]3C[N@@H+](CCCC(C)(C)C)C[C@H]32)CCC1 ZINC001441305336 1391243940 /nfs/dbraw/zinc/24/39/40/1391243940.db2.gz LRLDYMMHICJSSU-OSYLJGHBSA-N 1 3 335.536 2.591 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2[C@H]3C[N@H+](CCCC(C)(C)C)C[C@H]32)CCC1 ZINC001441305336 1391243943 /nfs/dbraw/zinc/24/39/43/1391243943.db2.gz LRLDYMMHICJSSU-OSYLJGHBSA-N 1 3 335.536 2.591 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@@]2(C)CN(C(=O)CN(C)C(C)C)C[C@@]2(C)C1 ZINC001441332477 1391254617 /nfs/dbraw/zinc/25/46/17/1391254617.db2.gz AFYFDHKFDBRPOX-BGYRXZFFSA-N 1 3 337.552 2.933 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@@]2(C)CN(C(=O)CN(C)C(C)C)C[C@@]2(C)C1 ZINC001441332477 1391254622 /nfs/dbraw/zinc/25/46/22/1391254622.db2.gz AFYFDHKFDBRPOX-BGYRXZFFSA-N 1 3 337.552 2.933 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C1)C1CCC1 ZINC001441381205 1391274147 /nfs/dbraw/zinc/27/41/47/1391274147.db2.gz BFBOCSCJXHBQBM-WGSAOQKQSA-N 1 3 341.499 2.785 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C)CCc2cccs2)CC1 ZINC001441393072 1391279813 /nfs/dbraw/zinc/27/98/13/1391279813.db2.gz BKEOBCSXMVJJMW-UHFFFAOYSA-N 1 3 337.533 2.554 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C)CCc2cccs2)CC1 ZINC001441393072 1391279816 /nfs/dbraw/zinc/27/98/16/1391279816.db2.gz BKEOBCSXMVJJMW-UHFFFAOYSA-N 1 3 337.533 2.554 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C)CC2CC3(CCC3)C2)CC1 ZINC001441397565 1391282026 /nfs/dbraw/zinc/28/20/26/1391282026.db2.gz VYEBNGPKQNIYOV-UHFFFAOYSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C)CC2CC3(CCC3)C2)CC1 ZINC001441397565 1391282029 /nfs/dbraw/zinc/28/20/29/1391282029.db2.gz VYEBNGPKQNIYOV-UHFFFAOYSA-N 1 3 335.536 2.830 10 0 EFAEHO Cc1cc(C[N@@H+](C)C2CCN(C(=O)CN(C)C(C)C)CC2)cs1 ZINC001441398143 1391282938 /nfs/dbraw/zinc/28/29/38/1391282938.db2.gz ZDJVPUAWXWRYCN-UHFFFAOYSA-N 1 3 337.533 2.820 10 0 EFAEHO Cc1cc(C[N@H+](C)C2CCN(C(=O)CN(C)C(C)C)CC2)cs1 ZINC001441398143 1391282941 /nfs/dbraw/zinc/28/29/41/1391282941.db2.gz ZDJVPUAWXWRYCN-UHFFFAOYSA-N 1 3 337.533 2.820 10 0 EFAEHO CN(CC(=O)N(C)[C@@H](C[NH2+]CC1CC(C)(C)C1)C1CC1)C1CCC1 ZINC001441436000 1391304000 /nfs/dbraw/zinc/30/40/00/1391304000.db2.gz TWCLUTIBYGCVGT-SFHVURJKSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccsc1 ZINC001441444489 1391311201 /nfs/dbraw/zinc/31/12/01/1391311201.db2.gz HTRFDRYJURBNJJ-ALOPSCKCSA-N 1 3 335.517 2.702 10 0 EFAEHO CCCN(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccsc1 ZINC001441444489 1391311206 /nfs/dbraw/zinc/31/12/06/1391311206.db2.gz HTRFDRYJURBNJJ-ALOPSCKCSA-N 1 3 335.517 2.702 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C[NH2+]Cc1ccsc1)C1CC1 ZINC001441456744 1391321858 /nfs/dbraw/zinc/32/18/58/1391321858.db2.gz BATAJBVUUPMCNU-ROUUACIJSA-N 1 3 349.544 2.949 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](N[C@@H](C)c2cc(F)ccc2F)C1 ZINC001441529717 1391352174 /nfs/dbraw/zinc/35/21/74/1391352174.db2.gz QSMDNKSLQOFDCJ-AEGPPILISA-N 1 3 339.430 2.604 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](N[C@@H](C)c2cc(F)ccc2F)C1 ZINC001441529717 1391352182 /nfs/dbraw/zinc/35/21/82/1391352182.db2.gz QSMDNKSLQOFDCJ-AEGPPILISA-N 1 3 339.430 2.604 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@H+](Cc2ccc(CF)cc2)C1 ZINC001441577206 1391370418 /nfs/dbraw/zinc/37/04/18/1391370418.db2.gz VIRVMRGDCNDUGK-IBGZPJMESA-N 1 3 349.494 2.825 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC001441577206 1391370421 /nfs/dbraw/zinc/37/04/21/1391370421.db2.gz VIRVMRGDCNDUGK-IBGZPJMESA-N 1 3 349.494 2.825 10 0 EFAEHO Cc1cc(C[N@H+]2CCC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cs1 ZINC001441586314 1391376861 /nfs/dbraw/zinc/37/68/61/1391376861.db2.gz MKGAAHBPDXDMCY-WBVHZDCISA-N 1 3 349.544 2.727 10 0 EFAEHO Cc1cc(C[N@@H+]2CCC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cs1 ZINC001441586314 1391376865 /nfs/dbraw/zinc/37/68/65/1391376865.db2.gz MKGAAHBPDXDMCY-WBVHZDCISA-N 1 3 349.544 2.727 10 0 EFAEHO Cc1cncc(CN[C@@H](C)CN(C)C(=O)[C@@H](C)[NH+]2CCCCCC2)c1 ZINC001441587306 1391378983 /nfs/dbraw/zinc/37/89/83/1391378983.db2.gz NBNRNTLXJYDSQX-ZWKOTPCHSA-N 1 3 346.519 2.591 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H](C)c1cccc(F)c1 ZINC001444940280 1391516250 /nfs/dbraw/zinc/51/62/50/1391516250.db2.gz MKZUINRAGDDNBV-YJBOKZPZSA-N 1 3 337.483 2.957 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CC1CCC(F)(F)CC1 ZINC001445550376 1391532870 /nfs/dbraw/zinc/53/28/70/1391532870.db2.gz YGJLFRYDPMDJSH-GOEBONIOSA-N 1 3 345.478 2.779 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@]2(C)CCN(C(=O)CN3CC[C@H](C)C3)C2)cs1 ZINC001446620858 1391561996 /nfs/dbraw/zinc/56/19/96/1391561996.db2.gz XSDWPCKCFGWVNL-HNAYVOBHSA-N 1 3 349.544 2.727 10 0 EFAEHO Cc1cc(C[NH2+]C[C@]2(C)CCN(C(=O)CN3CC[C@@H](C)C3)C2)cs1 ZINC001446620804 1391562310 /nfs/dbraw/zinc/56/23/10/1391562310.db2.gz XSDWPCKCFGWVNL-BEFAXECRSA-N 1 3 349.544 2.727 10 0 EFAEHO CC(C)C[NH2+]C[C@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@H]1C ZINC001446943230 1391642374 /nfs/dbraw/zinc/64/23/74/1391642374.db2.gz REINCSLNWYMTOK-APWZRJJASA-N 1 3 331.504 2.702 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001446943599 1391643110 /nfs/dbraw/zinc/64/31/10/1391643110.db2.gz UAEHDHPXVWCAHE-QUCCMNQESA-N 1 3 345.531 2.828 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H]2C[N@H+](CC3CCC3)C[C@H]21)N(CC)CC ZINC001447040998 1391668688 /nfs/dbraw/zinc/66/86/88/1391668688.db2.gz DBDYABMDVAPAFP-GBESFXJTSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H]2C[N@@H+](CC3CCC3)C[C@H]21)N(CC)CC ZINC001447040998 1391668690 /nfs/dbraw/zinc/66/86/90/1391668690.db2.gz DBDYABMDVAPAFP-GBESFXJTSA-N 1 3 335.536 2.830 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](CCC1CCCC1)CC2 ZINC001447104011 1391695114 /nfs/dbraw/zinc/69/51/14/1391695114.db2.gz VXIIBVNAYWHZQE-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCCC1)[C@H](C)[NH2+]Cc1ccsc1 ZINC001447848076 1391780169 /nfs/dbraw/zinc/78/01/69/1391780169.db2.gz LQLBYYWEHKLIGE-GJZGRUSLSA-N 1 3 337.533 2.995 10 0 EFAEHO C[C@@H](NCc1cncs1)[C@@H](C)NC(=O)c1ccc(C[NH+](C)C)cc1 ZINC001447888817 1391791109 /nfs/dbraw/zinc/79/11/09/1391791109.db2.gz BXZRAZOXCCYNTO-ZIAGYGMSSA-N 1 3 346.500 2.501 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@@H](C)CNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001448042148 1391912680 /nfs/dbraw/zinc/91/26/80/1391912680.db2.gz OPHMTFSUJDTTHH-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@@H](C)CNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001448042148 1391912687 /nfs/dbraw/zinc/91/26/87/1391912687.db2.gz OPHMTFSUJDTTHH-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[N@H+](C)CC/C=C/c1ccccc1 ZINC001448103993 1391965082 /nfs/dbraw/zinc/96/50/82/1391965082.db2.gz ZEMCHQOTBOVVJE-BLRGSVSVSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[N@@H+](C)CC/C=C/c1ccccc1 ZINC001448103993 1391965085 /nfs/dbraw/zinc/96/50/85/1391965085.db2.gz ZEMCHQOTBOVVJE-BLRGSVSVSA-N 1 3 343.515 2.868 10 0 EFAEHO CCCN(C)CC(=O)NC1(C[NH2+]Cc2ccccc2)CCCCC1 ZINC001448227846 1392035258 /nfs/dbraw/zinc/03/52/58/1392035258.db2.gz KESUVPRUSDCIEQ-UHFFFAOYSA-N 1 3 331.504 2.937 10 0 EFAEHO CC(C)[C@@H](CCNC(=O)[C@@H]1CCCN1C)[NH2+]C/C(Cl)=C\Cl ZINC001506982438 1406545502 /nfs/dbraw/zinc/54/55/02/1406545502.db2.gz UWGOVTHQINLPPQ-NEKXEHSPSA-N 1 3 336.307 2.520 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H](C1CC1)N(C)C(=O)C(C)(C)N1CCCCC1 ZINC001448580647 1392092629 /nfs/dbraw/zinc/09/26/29/1392092629.db2.gz DGSHUIKMONCTCS-DLBZAZTESA-N 1 3 341.515 2.826 10 0 EFAEHO CCc1ccc(CN2CCC[C@H](NC(=O)CC[NH+](C)C)[C@H]2C)cc1 ZINC001449042491 1392229635 /nfs/dbraw/zinc/22/96/35/1392229635.db2.gz QIRYRXOLHQWNJT-APWZRJJASA-N 1 3 331.504 2.670 10 0 EFAEHO CC[C@H](F)C[NH2+][C@@H]1CN(C(=O)C(C)(C)N2CCCCC2)CC1(C)C ZINC001449065638 1392247733 /nfs/dbraw/zinc/24/77/33/1392247733.db2.gz XQVSIDPYBCLODZ-JKSUJKDBSA-N 1 3 341.515 2.826 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@H](NCc2ccc(Cl)s2)C(C)(C)C1 ZINC001449098956 1392253004 /nfs/dbraw/zinc/25/30/04/1392253004.db2.gz STLUYEAYIONHEE-ZDUSSCGKSA-N 1 3 343.924 2.680 10 0 EFAEHO CC(C)[C@@H](CCNC(=O)CN1CCCC1)[NH2+]C/C(Cl)=C/Cl ZINC001506992414 1406559384 /nfs/dbraw/zinc/55/93/84/1406559384.db2.gz GQRSKKZJNADNFI-RNQWEJQRSA-N 1 3 336.307 2.522 10 0 EFAEHO CC(C)=CC[NH2+]CC[C@@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001716174826 1418714274 /nfs/dbraw/zinc/71/42/74/1418714274.db2.gz ZRXKDWSOAYIOPM-CRAIPNDOSA-N 1 3 327.488 2.650 10 0 EFAEHO C[C@H](CN(C)C(=O)CN(C)C1CCC1)[NH2+]CC[C@H]1CCCC1(F)F ZINC001507092154 1406690508 /nfs/dbraw/zinc/69/05/08/1406690508.db2.gz XNWGYTCMLUVUEG-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+][C@H](C)CN(C)C(=O)Cc2c[nH]cn2)c1 ZINC001507129129 1406742896 /nfs/dbraw/zinc/74/28/96/1406742896.db2.gz NBUWOXJPUSIPFK-HZPDHXFCSA-N 1 3 328.460 2.767 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1csc(C)c1 ZINC001507161008 1406790488 /nfs/dbraw/zinc/79/04/88/1406790488.db2.gz HIAXGXZRAITLKR-RHSMWYFYSA-N 1 3 337.533 2.867 10 0 EFAEHO CN(Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1CCC[C@]2(CCOC2)O1 ZINC001459880645 1395988407 /nfs/dbraw/zinc/98/84/07/1395988407.db2.gz XQYIJDZAHRUDCC-VQTJNVASSA-N 1 3 332.488 2.908 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]CCc1ccc(C)cc1 ZINC001507163775 1406794222 /nfs/dbraw/zinc/79/42/22/1406794222.db2.gz VWPGZUIJHQOWIC-QUCCMNQESA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@H]1C[N@H+](C[Si](C)(C)c2ccccc2)CCN1c1ccncc1 ZINC001460709439 1396245423 /nfs/dbraw/zinc/24/54/23/1396245423.db2.gz NOHFAVJPRJJDNQ-KRWDZBQOSA-N 1 3 325.532 2.747 10 0 EFAEHO C[C@H]1C[N@@H+](C[Si](C)(C)c2ccccc2)CCN1c1ccncc1 ZINC001460709439 1396245429 /nfs/dbraw/zinc/24/54/29/1396245429.db2.gz NOHFAVJPRJJDNQ-KRWDZBQOSA-N 1 3 325.532 2.747 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001464212365 1396556087 /nfs/dbraw/zinc/55/60/87/1396556087.db2.gz CPGYWMOYSHZXKN-IAGOWNOFSA-N 1 3 325.541 2.839 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001464212354 1396556598 /nfs/dbraw/zinc/55/65/98/1396556598.db2.gz CPGYWMOYSHZXKN-CALCHBBNSA-N 1 3 325.541 2.839 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001464212354 1396556604 /nfs/dbraw/zinc/55/66/04/1396556604.db2.gz CPGYWMOYSHZXKN-CALCHBBNSA-N 1 3 325.541 2.839 10 0 EFAEHO CCN(C(=O)[C@@H](C)CC[NH+](C)C)[C@H]1CCN(Cc2ccccc2)C1 ZINC001466678056 1396771458 /nfs/dbraw/zinc/77/14/58/1396771458.db2.gz BVJWNHKYAOSQSU-HKUYNNGSSA-N 1 3 331.504 2.697 10 0 EFAEHO O=C(NC[C@H]1CC[N@@H+]1C1CCCCC1)N1CCN(C2CCCC2)CC1 ZINC001470824132 1397125517 /nfs/dbraw/zinc/12/55/17/1397125517.db2.gz PSXVYUBPQJZPAA-LJQANCHMSA-N 1 3 348.535 2.663 10 0 EFAEHO O=C(NC[C@H]1CC[N@H+]1C1CCCCC1)N1CCN(C2CCCC2)CC1 ZINC001470824132 1397125521 /nfs/dbraw/zinc/12/55/21/1397125521.db2.gz PSXVYUBPQJZPAA-LJQANCHMSA-N 1 3 348.535 2.663 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC001471227206 1397151923 /nfs/dbraw/zinc/15/19/23/1397151923.db2.gz NNAIMDUKNAJXFE-MJGOQNOKSA-N 1 3 331.504 2.745 10 0 EFAEHO CC[NH+](CC)CC[C@H](NC(=O)N[C@H]1CCN(C)[C@@H]1C)c1ccccc1 ZINC001471398014 1397168334 /nfs/dbraw/zinc/16/83/34/1397168334.db2.gz MXXQHJKIHIHYNW-NEWSRXKRSA-N 1 3 346.519 2.851 10 0 EFAEHO OC1(C[NH+]2CCCCC2)CCN(Cc2ccc3cc[nH]c3c2)CC1 ZINC001473875844 1397342918 /nfs/dbraw/zinc/34/29/18/1397342918.db2.gz AZDGLUFTVGESMX-UHFFFAOYSA-N 1 3 327.472 2.981 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@@H](C)N(C(=O)C3(C[NH+](C)C)CC3)C2)c1 ZINC001507321786 1406886336 /nfs/dbraw/zinc/88/63/36/1406886336.db2.gz QLLOVXSMFFHNTB-WBVHZDCISA-N 1 3 347.478 2.555 10 0 EFAEHO CN(C[C@@H]1CCN1[C@H]1CCc2ccccc21)C(=O)CCCC[NH+](C)C ZINC001479261612 1397651510 /nfs/dbraw/zinc/65/15/10/1397651510.db2.gz XTFASDBOLFMTGO-ICSRJNTNSA-N 1 3 343.515 2.939 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2C[C@H]([NH2+]CC3CCC(C)CC3)C2)C1 ZINC001479321233 1397683808 /nfs/dbraw/zinc/68/38/08/1397683808.db2.gz KZAQJWWVAJWHLZ-MYZTUTKLSA-N 1 3 335.536 2.639 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN3[C@@H](C)CC[C@@H]3C)C2)cc1 ZINC001479346311 1397697653 /nfs/dbraw/zinc/69/76/53/1397697653.db2.gz FGIBYUFNJHENBC-QGZVKYPTSA-N 1 3 343.515 2.852 10 0 EFAEHO CC[C@@H](F)CN1CCC2(C[C@H](C)N(C(=O)CC[N@H+](C)CC)C2)CC1 ZINC001479500409 1397738653 /nfs/dbraw/zinc/73/86/53/1397738653.db2.gz FDWVCQFFGSGEBK-DLBZAZTESA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](F)CN1CCC2(C[C@H](C)N(C(=O)CC[N@@H+](C)CC)C2)CC1 ZINC001479500409 1397738654 /nfs/dbraw/zinc/73/86/54/1397738654.db2.gz FDWVCQFFGSGEBK-DLBZAZTESA-N 1 3 341.515 2.779 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]2C)cc1C ZINC001479724015 1397781294 /nfs/dbraw/zinc/78/12/94/1397781294.db2.gz AXYKVGLSNDXFMS-HOJAQTOUSA-N 1 3 345.531 2.969 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]2C)cc1C ZINC001479724015 1397781297 /nfs/dbraw/zinc/78/12/97/1397781297.db2.gz AXYKVGLSNDXFMS-HOJAQTOUSA-N 1 3 345.531 2.969 10 0 EFAEHO Cc1cc(CN(C)CCCNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)cs1 ZINC001479792076 1397867734 /nfs/dbraw/zinc/86/77/34/1397867734.db2.gz NKPJSANBWVQSEJ-YOEHRIQHSA-N 1 3 337.533 2.725 10 0 EFAEHO Cc1cc(CN(C)CCCNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cs1 ZINC001479792076 1397867744 /nfs/dbraw/zinc/86/77/44/1397867744.db2.gz NKPJSANBWVQSEJ-YOEHRIQHSA-N 1 3 337.533 2.725 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1ccc(F)cc1C ZINC001479854843 1397956369 /nfs/dbraw/zinc/95/63/69/1397956369.db2.gz OPRLNBQPKJLZLP-MRXNPFEDSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1ccc(F)cc1C ZINC001479854843 1397956374 /nfs/dbraw/zinc/95/63/74/1397956374.db2.gz OPRLNBQPKJLZLP-MRXNPFEDSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[N@H+](CCCNC(=O)Cc1nc[nH]c1C)CC1CCC(C)CC1 ZINC001479859682 1397963921 /nfs/dbraw/zinc/96/39/21/1397963921.db2.gz RHOSPZHWVCYWIE-UHFFFAOYSA-N 1 3 334.508 2.915 10 0 EFAEHO CC[N@@H+](CCCNC(=O)Cc1nc[nH]c1C)CC1CCC(C)CC1 ZINC001479859682 1397963925 /nfs/dbraw/zinc/96/39/25/1397963925.db2.gz RHOSPZHWVCYWIE-UHFFFAOYSA-N 1 3 334.508 2.915 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@]12CCC[C@H]1N(Cc1cccc(F)c1)CC2 ZINC001507346932 1406924139 /nfs/dbraw/zinc/92/41/39/1406924139.db2.gz FVYBMFOQZLVIJB-QUCCMNQESA-N 1 3 347.478 2.781 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CCCCc2ccccc2)C1)N(C)C ZINC001479963002 1398047942 /nfs/dbraw/zinc/04/79/42/1398047942.db2.gz JGAMBYDHIAQIMT-VQTJNVASSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CCCCc2ccccc2)C1)N(C)C ZINC001479963002 1398047949 /nfs/dbraw/zinc/04/79/49/1398047949.db2.gz JGAMBYDHIAQIMT-VQTJNVASSA-N 1 3 345.531 2.786 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N[C@@H]1CCN(CC2=CCCCC2)C1 ZINC001479971616 1398057907 /nfs/dbraw/zinc/05/79/07/1398057907.db2.gz BCZDRFNEPHGMAS-LJQANCHMSA-N 1 3 333.520 2.943 10 0 EFAEHO CCCCCC[NH+]1CCC2(C[C@H]2NC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001479985126 1398070617 /nfs/dbraw/zinc/07/06/17/1398070617.db2.gz KYFQEKQCZLSUIR-QZTJIDSGSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]([NH2+]Cc1ccsc1)C1CC1)N1CCCCC1 ZINC001480022253 1398098303 /nfs/dbraw/zinc/09/83/03/1398098303.db2.gz WDVNSICTAMTUSW-QGZVFWFLSA-N 1 3 349.544 2.997 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]([NH2+][C@H]2CCc3ccccc32)C2CC2)CCC1 ZINC001480024332 1398099714 /nfs/dbraw/zinc/09/97/14/1398099714.db2.gz SSCPGOZZRLEBRF-OALUTQOASA-N 1 3 341.499 2.643 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1C[C@H]([NH2+]CCCCC(F)(F)F)C1 ZINC001480172249 1398142184 /nfs/dbraw/zinc/14/21/84/1398142184.db2.gz PERZBXHRYJCETK-KBUPBQIOSA-N 1 3 349.441 2.829 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H](C)CNC(=O)[C@@H]1CCCCN1C(C)C ZINC001480547713 1398201514 /nfs/dbraw/zinc/20/15/14/1398201514.db2.gz DIOXJAFMGPQLKJ-LPHOPBHVSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H](C)CNC(=O)[C@H]1CCCCN1C(C)C ZINC001480547714 1398201637 /nfs/dbraw/zinc/20/16/37/1398201637.db2.gz DIOXJAFMGPQLKJ-QFBILLFUSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@H]2CCCCN2C(C)C)cc1F ZINC001480548985 1398202098 /nfs/dbraw/zinc/20/20/98/1398202098.db2.gz OYHUMJDCDDBIAO-QFBILLFUSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@@H]2CCCCN2C(C)C)cc1F ZINC001480548984 1398202498 /nfs/dbraw/zinc/20/24/98/1398202498.db2.gz OYHUMJDCDDBIAO-LPHOPBHVSA-N 1 3 349.494 2.991 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H]([NH2+]CCCc2ccccc2Cl)C1 ZINC001480624455 1398253646 /nfs/dbraw/zinc/25/36/46/1398253646.db2.gz XMPBVVLISBJTJP-KRWDZBQOSA-N 1 3 349.906 2.559 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H](C[NH2+]CCCC(C)(C)C)C2)CC1 ZINC001480667583 1398272807 /nfs/dbraw/zinc/27/28/07/1398272807.db2.gz AJQVXBBKUSVRNM-GOSISDBHSA-N 1 3 337.552 2.983 10 0 EFAEHO CCN(CCNC(=O)C[NH+]1[C@@H](C)CC[C@@H]1C)Cc1ccc(C)c(F)c1 ZINC001493062644 1398407230 /nfs/dbraw/zinc/40/72/30/1398407230.db2.gz LHFCNVSRRJPDBB-IRXDYDNUSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CCC[N@@H+]1CC1CC(F)(F)C1)N(CC)CC ZINC001493136806 1398472931 /nfs/dbraw/zinc/47/29/31/1398472931.db2.gz UVNUVCBTHCRNDR-CVEARBPZSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CCC[N@H+]1CC1CC(F)(F)C1)N(CC)CC ZINC001493136806 1398472935 /nfs/dbraw/zinc/47/29/35/1398472935.db2.gz UVNUVCBTHCRNDR-CVEARBPZSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@@H+]1CC1CCC1)N1CCCCC1 ZINC001493160804 1398489599 /nfs/dbraw/zinc/48/95/99/1398489599.db2.gz JQZXJVATIIVLTQ-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@H+]1CC1CCC1)N1CCCCC1 ZINC001493160804 1398489605 /nfs/dbraw/zinc/48/96/05/1398489605.db2.gz JQZXJVATIIVLTQ-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@H]1CC[N@H+](CCCCCF)C1 ZINC001493242276 1398558578 /nfs/dbraw/zinc/55/85/78/1398558578.db2.gz ZKUODLBPKVRSMH-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@H]1CC[N@@H+](CCCCCF)C1 ZINC001493242276 1398558580 /nfs/dbraw/zinc/55/85/80/1398558580.db2.gz ZKUODLBPKVRSMH-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)C[C@@H]2CC[N@@H+](C)C2)C2CC2)c(C)c1 ZINC001493436332 1398707159 /nfs/dbraw/zinc/70/71/59/1398707159.db2.gz SOPWLFYTRIGZKO-SFHVURJKSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)C[C@@H]2CC[N@H+](C)C2)C2CC2)c(C)c1 ZINC001493436332 1398707163 /nfs/dbraw/zinc/70/71/63/1398707163.db2.gz SOPWLFYTRIGZKO-SFHVURJKSA-N 1 3 343.515 2.726 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+]([C@@H](C)c1ccc(F)cc1)C1CC1 ZINC001493450663 1398717342 /nfs/dbraw/zinc/71/73/42/1398717342.db2.gz VCVMUUNHFOSEMM-HNNXBMFYSA-N 1 3 335.467 2.808 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+]([C@@H](C)c1ccc(F)cc1)C1CC1 ZINC001493450663 1398717344 /nfs/dbraw/zinc/71/73/44/1398717344.db2.gz VCVMUUNHFOSEMM-HNNXBMFYSA-N 1 3 335.467 2.808 10 0 EFAEHO CN(CC(=O)N(C)CC[NH2+]CC[C@@H]1CCCC1(F)F)CC(C)(C)C ZINC001493695594 1398814414 /nfs/dbraw/zinc/81/44/14/1398814414.db2.gz JIISUWBCWJJKJX-HNNXBMFYSA-N 1 3 347.494 2.838 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)C[N@H+](C)CC(C)(C)C)c1 ZINC001493695757 1398814572 /nfs/dbraw/zinc/81/45/72/1398814572.db2.gz LQKQIPZVYCGRSZ-UHFFFAOYSA-N 1 3 337.483 2.660 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)C[N@@H+](C)CC(C)(C)C)c1 ZINC001493695757 1398814579 /nfs/dbraw/zinc/81/45/79/1398814579.db2.gz LQKQIPZVYCGRSZ-UHFFFAOYSA-N 1 3 337.483 2.660 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@H]1C(=O)N(C)CCNCc1ccccc1F ZINC001493721694 1398835560 /nfs/dbraw/zinc/83/55/60/1398835560.db2.gz YRSKOMPAOHFUKF-SFHVURJKSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@H]1C(=O)N(C)CCNCc1ccccc1F ZINC001493721694 1398835567 /nfs/dbraw/zinc/83/55/67/1398835567.db2.gz YRSKOMPAOHFUKF-SFHVURJKSA-N 1 3 335.467 2.637 10 0 EFAEHO CN(CCNCc1ccc(Cl)s1)C(=O)CCC[NH+]1CCCC1 ZINC001493803945 1398894733 /nfs/dbraw/zinc/89/47/33/1398894733.db2.gz VXSUXNVHCFCIDL-UHFFFAOYSA-N 1 3 343.924 2.826 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)N(C)CCNCc1cc2ccccc2o1 ZINC001493804008 1398895150 /nfs/dbraw/zinc/89/51/50/1398895150.db2.gz XRTXYUUNGRTASE-HOTGVXAUSA-N 1 3 343.471 2.854 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001493845414 1398918336 /nfs/dbraw/zinc/91/83/36/1398918336.db2.gz XOVXAZPNFYMVTM-SJLPKXTDSA-N 1 3 341.515 2.683 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@H](CCNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001494056826 1399096678 /nfs/dbraw/zinc/09/66/78/1399096678.db2.gz XZNZIWBUUDIBLY-MOPGFXCFSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@H](CCNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001494056826 1399096681 /nfs/dbraw/zinc/09/66/81/1399096681.db2.gz XZNZIWBUUDIBLY-MOPGFXCFSA-N 1 3 343.515 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@H+](C)[C@@H](C)c2ccccc2)C1 ZINC001494179582 1399191656 /nfs/dbraw/zinc/19/16/56/1399191656.db2.gz RWZVJKDJJMQQGN-ZWKOTPCHSA-N 1 3 331.504 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@@H+](C)[C@@H](C)c2ccccc2)C1 ZINC001494179582 1399191661 /nfs/dbraw/zinc/19/16/61/1399191661.db2.gz RWZVJKDJJMQQGN-ZWKOTPCHSA-N 1 3 331.504 2.868 10 0 EFAEHO CCc1ccccc1CN1CC(CNC(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC001494633642 1399408179 /nfs/dbraw/zinc/40/81/79/1399408179.db2.gz RTDCGVLXBSGINL-CALCHBBNSA-N 1 3 343.515 2.670 10 0 EFAEHO CCc1ccccc1CN1CC(CNC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC001494633642 1399408181 /nfs/dbraw/zinc/40/81/81/1399408181.db2.gz RTDCGVLXBSGINL-CALCHBBNSA-N 1 3 343.515 2.670 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)NCC1CN(CC2=CCCCC2)C1 ZINC001494636273 1399409266 /nfs/dbraw/zinc/40/92/66/1399409266.db2.gz ZNVIDGMJNBGXPD-UHFFFAOYSA-N 1 3 333.520 2.801 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H](C[NH2+]Cc2cc(C)ccc2F)C1 ZINC001507418491 1407032128 /nfs/dbraw/zinc/03/21/28/1407032128.db2.gz GFYMXKHLQXSGSA-SJLPKXTDSA-N 1 3 349.494 2.850 10 0 EFAEHO CN(C(=O)CCCC[NH+](C)C)[C@@H]1CCN(Cc2ccc(CF)cc2)C1 ZINC001494862743 1399512793 /nfs/dbraw/zinc/51/27/93/1399512793.db2.gz JMFIHHJMVWTAKE-LJQANCHMSA-N 1 3 349.494 2.921 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C1CCC1)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001495002297 1399597088 /nfs/dbraw/zinc/59/70/88/1399597088.db2.gz KJGXFRRJFLIQSK-QGZVFWFLSA-N 1 3 342.487 2.637 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]C/C=C\c1ccccc1 ZINC001495057105 1399632426 /nfs/dbraw/zinc/63/24/26/1399632426.db2.gz DGHZFBFFFLUYJK-PNDVUPANSA-N 1 3 329.488 2.526 10 0 EFAEHO CCCCC[NH2+][C@@H](CC)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001495057260 1399632764 /nfs/dbraw/zinc/63/27/64/1399632764.db2.gz FDOUFOGDZGJYMV-MAUKXSAKSA-N 1 3 329.504 2.874 10 0 EFAEHO CCCCC[NH2+][C@H](CC)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001495057261 1399633042 /nfs/dbraw/zinc/63/30/42/1399633042.db2.gz FDOUFOGDZGJYMV-QAPCUYQASA-N 1 3 329.504 2.874 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](CC)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001495058694 1399633732 /nfs/dbraw/zinc/63/37/32/1399633732.db2.gz QPKFQFKTOMIOLJ-VQIMIIECSA-N 1 3 331.504 2.575 10 0 EFAEHO CC[C@@H](CNC(=O)CC[NH+]1CCCCC1)NCc1cc(C)ccc1F ZINC001495137444 1399692813 /nfs/dbraw/zinc/69/28/13/1399692813.db2.gz KSHKTRJZPYHVPG-SFHVURJKSA-N 1 3 349.494 2.995 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@](C)(C[NH2+]Cc2ccc(F)cc2)C2CC2)C1 ZINC001495275877 1399785155 /nfs/dbraw/zinc/78/51/55/1399785155.db2.gz DEKSPUBKZKMEMS-FOIQADDNSA-N 1 3 347.478 2.542 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)N[C@](C)(CNCc2ccccc2F)C2CC2)C1 ZINC001495294874 1399800580 /nfs/dbraw/zinc/80/05/80/1399800580.db2.gz VWXLNCOREVQGTO-MGPUTAFESA-N 1 3 347.478 2.542 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)N[C@](C)(CNCc2ccccc2F)C2CC2)C1 ZINC001495294874 1399800594 /nfs/dbraw/zinc/80/05/94/1399800594.db2.gz VWXLNCOREVQGTO-MGPUTAFESA-N 1 3 347.478 2.542 10 0 EFAEHO CC[C@H](C(=O)N1C[C@H](NCc2ccccn2)C(C)(C)C1)[NH+](CC)CC ZINC001507446235 1407063062 /nfs/dbraw/zinc/06/30/62/1407063062.db2.gz QWLWKPWREPHKSD-MSOLQXFVSA-N 1 3 346.519 2.529 10 0 EFAEHO CC1(C)CN(C(=O)Cc2c[nH]cn2)C[C@@H]1[NH2+]CCCC1CCCC1 ZINC001507447021 1407063463 /nfs/dbraw/zinc/06/34/63/1407063463.db2.gz HLMQQLYYXMHWNV-KRWDZBQOSA-N 1 3 332.492 2.749 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H](CC[NH2+]CCC(C)(C)C)C1)N(C)C ZINC001495380498 1399926829 /nfs/dbraw/zinc/92/68/29/1399926829.db2.gz RBFGDHHBXBPOCP-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC1(C)CN(C(=O)CCC[NH+]2CCCCC2)C[C@@H]1NC/C=C/Cl ZINC001507452415 1407070665 /nfs/dbraw/zinc/07/06/65/1407070665.db2.gz MVJBLCMPHMAFQB-DYLHUKMJSA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(CC[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001495437995 1399979566 /nfs/dbraw/zinc/97/95/66/1399979566.db2.gz QUFDJEAWHZIUFV-HSALFYBXSA-N 1 3 349.563 2.981 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(CC[NH2+]CC[C@@H](C)F)CC1 ZINC001495438269 1399980366 /nfs/dbraw/zinc/98/03/66/1399980366.db2.gz TYKIATAPLPKLSR-SJLPKXTDSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H]1C[NH2+]C/C=C/c1ccccc1)N(C)C ZINC001495588319 1400100575 /nfs/dbraw/zinc/10/05/75/1400100575.db2.gz RIAZBNUUPWMNLS-MQESYYLESA-N 1 3 329.488 2.621 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCCC1)C[NH2+]CCC(F)(F)F ZINC001495666114 1400152153 /nfs/dbraw/zinc/15/21/53/1400152153.db2.gz MHARQBXWMFCNCR-CYBMUJFWSA-N 1 3 337.430 2.545 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C[C@@H](C)CNC(=O)C2(N(C)C)CCC2)c1 ZINC001495685861 1400166104 /nfs/dbraw/zinc/16/61/04/1400166104.db2.gz XISOSZAJSIBRTA-HZPDHXFCSA-N 1 3 347.503 2.582 10 0 EFAEHO C[C@@H](CNCc1c(Cl)cccc1Cl)CNC(=O)CC[NH+](C)C ZINC001495735334 1400209196 /nfs/dbraw/zinc/20/91/96/1400209196.db2.gz UXMICUTYRLDBIT-LBPRGKRZSA-N 1 3 346.302 2.787 10 0 EFAEHO C[C@H](CNCc1c(Cl)cccc1Cl)CNC(=O)CC[NH+](C)C ZINC001495735333 1400209629 /nfs/dbraw/zinc/20/96/29/1400209629.db2.gz UXMICUTYRLDBIT-GFCCVEGCSA-N 1 3 346.302 2.787 10 0 EFAEHO CCCN(C)CC(=O)N1CCC2(C[NH+](C[C@@H]3CC[C@H]4C[C@H]4C3)C2)CC1 ZINC001495986132 1400398832 /nfs/dbraw/zinc/39/88/32/1400398832.db2.gz IVRGQHQLTUMPEZ-CEXWTWQISA-N 1 3 347.547 2.689 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]CCc1ccccc1Cl)N(C)C ZINC001496096770 1400468522 /nfs/dbraw/zinc/46/85/22/1400468522.db2.gz NAVVZIGXAAHWLQ-WMLDXEAASA-N 1 3 339.911 2.659 10 0 EFAEHO CC(C)Oc1cccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CCCC2)c1 ZINC001496229501 1400556238 /nfs/dbraw/zinc/55/62/38/1400556238.db2.gz ISDSVBHZOGCDEU-QGZVFWFLSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@H](C[NH2+][C@H](C)c1ccc2c(c1)CCC2)N(C)C(=O)CN1CCCC1 ZINC001496230523 1400557245 /nfs/dbraw/zinc/55/72/45/1400557245.db2.gz XQTDJCZWHQRUJW-IAGOWNOFSA-N 1 3 343.515 2.769 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C[NH2+]CCC(C)C)C1CCCCC1 ZINC001496327518 1400643615 /nfs/dbraw/zinc/64/36/15/1400643615.db2.gz UPMKCGIHXUYYJH-SFHVURJKSA-N 1 3 334.508 2.961 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]CC1=CCCCC1 ZINC001496387010 1400693195 /nfs/dbraw/zinc/69/31/95/1400693195.db2.gz JNKKTTMHGPUXRY-MOPGFXCFSA-N 1 3 333.520 2.942 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001496562886 1400830357 /nfs/dbraw/zinc/83/03/57/1400830357.db2.gz VDDLJQHESCRIFN-RTBURBONSA-N 1 3 343.515 2.889 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1cccc(F)c1)C(C)C ZINC001496565129 1400832229 /nfs/dbraw/zinc/83/22/29/1400832229.db2.gz HSLPIKCPAVNULW-OALUTQOASA-N 1 3 349.494 2.931 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](CNC(=O)C2CC[NH+](C)CC2)C(C)C)c1 ZINC001496597975 1400858830 /nfs/dbraw/zinc/85/88/30/1400858830.db2.gz IPTRRWWGCPFZFI-LJQANCHMSA-N 1 3 349.494 2.706 10 0 EFAEHO CC(C)=CCN(C)CCN(C)C(=O)c1ccc(CC[NH+](C)C)cc1 ZINC001496780233 1400978749 /nfs/dbraw/zinc/97/87/49/1400978749.db2.gz FFGPNYZIUQEZRI-UHFFFAOYSA-N 1 3 331.504 2.761 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]CCc1cccs1 ZINC001496922758 1401103549 /nfs/dbraw/zinc/10/35/49/1401103549.db2.gz JYKVFNBXVVJACH-DOTOQJQBSA-N 1 3 337.533 2.505 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001507811038 1407166162 /nfs/dbraw/zinc/16/61/62/1407166162.db2.gz YQALNGDKQNHEBH-IAGOWNOFSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001507811038 1407166166 /nfs/dbraw/zinc/16/61/66/1407166166.db2.gz YQALNGDKQNHEBH-IAGOWNOFSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1cccc(Cl)c1F)N(C)C ZINC001497268072 1401259097 /nfs/dbraw/zinc/25/90/97/1401259097.db2.gz KPJZDKIVAQUCLG-DOMZBBRYSA-N 1 3 343.874 2.804 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cc1C ZINC001497271146 1401260550 /nfs/dbraw/zinc/26/05/50/1401260550.db2.gz JRVUUEIWUBIJOS-MAUKXSAKSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1nsc2ccccc12)N(C)C ZINC001497307266 1401287045 /nfs/dbraw/zinc/28/70/45/1401287045.db2.gz JVRMNZKDXWEGPX-BBRMVZONSA-N 1 3 348.516 2.621 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CC[NH2+]Cc1ccc(F)cc1 ZINC001497329825 1401307187 /nfs/dbraw/zinc/30/71/87/1401307187.db2.gz DUTNFQWGJSYTRE-QAPCUYQASA-N 1 3 335.467 2.685 10 0 EFAEHO CCCc1ccc(C[NH2+]CCN(CC)C(=O)[C@H]2CCCN2C)cc1 ZINC001497435036 1401372746 /nfs/dbraw/zinc/37/27/46/1401372746.db2.gz WVNLSYKDCJWJCG-LJQANCHMSA-N 1 3 331.504 2.671 10 0 EFAEHO CCN(CCNCc1ccc(Cl)s1)C(=O)[C@@H](C(C)C)[NH+](C)C ZINC001497447118 1401381201 /nfs/dbraw/zinc/38/12/01/1401381201.db2.gz IFUARHOKLRLVMX-OAHLLOKOSA-N 1 3 345.940 2.926 10 0 EFAEHO CCN(CCNCc1cccnc1C)C(=O)[C@H](C)[NH+]1CCCCCC1 ZINC001497464409 1401396352 /nfs/dbraw/zinc/39/63/52/1401396352.db2.gz MVRSFWSRNJOWBT-SFHVURJKSA-N 1 3 346.519 2.593 10 0 EFAEHO CCN(CC[NH2+][C@H](C)c1ccc(F)c(F)c1)C(=O)CN(C)C(C)C ZINC001497500114 1401422952 /nfs/dbraw/zinc/42/29/52/1401422952.db2.gz BDFKPCIDIJWROJ-CQSZACIVSA-N 1 3 341.446 2.804 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC/C=C\CNCc2ccc(Cl)cc2)CC[N@@H+]1C ZINC001497662123 1401531418 /nfs/dbraw/zinc/53/14/18/1401531418.db2.gz JGMKJXANBBWLKP-AAAUKVELSA-N 1 3 349.906 2.832 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC/C=C\CNCc2ccc(Cl)cc2)CC[N@H+]1C ZINC001497662123 1401531419 /nfs/dbraw/zinc/53/14/19/1401531419.db2.gz JGMKJXANBBWLKP-AAAUKVELSA-N 1 3 349.906 2.832 10 0 EFAEHO CC[C@H](F)CNC/C=C\CNC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001497663118 1401532246 /nfs/dbraw/zinc/53/22/46/1401532246.db2.gz PCIFTKLBQKJIJR-KINGKOSLSA-N 1 3 339.499 2.794 10 0 EFAEHO CC[C@H](F)CNC/C=C\CNC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001497663118 1401532248 /nfs/dbraw/zinc/53/22/48/1401532248.db2.gz PCIFTKLBQKJIJR-KINGKOSLSA-N 1 3 339.499 2.794 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\C[NH2+]Cc1ccc2c(c1)CCC2)N(C)C ZINC001497671331 1401538284 /nfs/dbraw/zinc/53/82/84/1401538284.db2.gz IKVSPWVMLOEOPL-KKHYBRAUSA-N 1 3 343.515 2.524 10 0 EFAEHO C[NH+](C)CCC(=O)NC/C=C/CNCc1ccc(Cl)c(Cl)c1 ZINC001497675596 1401542115 /nfs/dbraw/zinc/54/21/15/1401542115.db2.gz SHGOTXXKHBSNEU-ONEGZZNKSA-N 1 3 344.286 2.707 10 0 EFAEHO Cc1ccc(CC[NH2+]C/C=C\CNC(=O)CN2CCC(C)CC2)cc1 ZINC001497716012 1401577351 /nfs/dbraw/zinc/57/73/51/1401577351.db2.gz XTNLKFIKOCULJS-ARJAWSKDSA-N 1 3 343.515 2.531 10 0 EFAEHO C[C@H](C[NH2+]CC[C@H]1CCCC1(F)F)NC(=O)CN(C)CC(C)(C)C ZINC001497910779 1401734804 /nfs/dbraw/zinc/73/48/04/1401734804.db2.gz PPMNGHNSMFSFAU-HUUCEWRRSA-N 1 3 347.494 2.884 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001497910679 1401734962 /nfs/dbraw/zinc/73/49/62/1401734962.db2.gz MEDNGGMMJJTWAN-BJTXQSCBSA-N 1 3 327.488 2.650 10 0 EFAEHO CCC(CC)C[NH2+]C[C@@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001497910789 1401735217 /nfs/dbraw/zinc/73/52/17/1401735217.db2.gz QAUPIIPRWBIELA-RDTXWAMCSA-N 1 3 329.504 2.729 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(CF)cc1)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001498303847 1401992564 /nfs/dbraw/zinc/99/25/64/1401992564.db2.gz AFQJKFYGOJFTOX-QFBILLFUSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(CF)cc1)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001498303847 1401992566 /nfs/dbraw/zinc/99/25/66/1401992566.db2.gz AFQJKFYGOJFTOX-QFBILLFUSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@H](C[N@H+](C)CC1CCCC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001498380078 1402053777 /nfs/dbraw/zinc/05/37/77/1402053777.db2.gz FIWFERFXNMZVCF-DNVCBOLYSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H](C[N@@H+](C)CC1CCCC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001498380078 1402053782 /nfs/dbraw/zinc/05/37/82/1402053782.db2.gz FIWFERFXNMZVCF-DNVCBOLYSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CN1CCC[C@H]1C(=O)N[C@@H](C[NH2+]CCCF)C(C)(C)C ZINC001507969083 1407226461 /nfs/dbraw/zinc/22/64/61/1407226461.db2.gz AUMDAILHPYHHKP-HOTGVXAUSA-N 1 3 329.504 2.587 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@H+](C)Cc1ccc(F)cc1C ZINC001498455742 1402118045 /nfs/dbraw/zinc/11/80/45/1402118045.db2.gz JTWFCYRTHDKLOQ-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc(F)cc1C ZINC001498455742 1402118048 /nfs/dbraw/zinc/11/80/48/1402118048.db2.gz JTWFCYRTHDKLOQ-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(F)c(Cl)c1)C(=O)[C@@H]1CCCN1C ZINC001498525755 1402160553 /nfs/dbraw/zinc/16/05/53/1402160553.db2.gz FGJSGKSJYNKCKK-INIZCTEOSA-N 1 3 341.858 2.511 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CCCN(C)C(=O)[C@@H]2CCCCN2C)c1 ZINC001498567722 1402179338 /nfs/dbraw/zinc/17/93/38/1402179338.db2.gz KIUJRTJWJLVOJT-SFHVURJKSA-N 1 3 335.467 2.557 10 0 EFAEHO CN(CCC[NH2+]Cc1ccccc1Cl)C(=O)[C@@H]1CCCCN1C ZINC001498598037 1402193997 /nfs/dbraw/zinc/19/39/97/1402193997.db2.gz RJHPFPFDDYYFJX-KRWDZBQOSA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+][C@@H]1CCc2ccc(F)cc21)N(C)C ZINC001498643629 1402221002 /nfs/dbraw/zinc/22/10/02/1402221002.db2.gz DWSPYBCOCADLLO-RTBURBONSA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC001498656835 1402231793 /nfs/dbraw/zinc/23/17/93/1402231793.db2.gz AXIHQSWJRTXKLW-AWEZNQCLSA-N 1 3 341.446 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001498658765 1402232165 /nfs/dbraw/zinc/23/21/65/1402232165.db2.gz QYBGBJGCWIOOHQ-UHFFFAOYSA-N 1 3 343.874 2.757 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H](NC(=O)CN(C)C2CCC2)C2CC2)c1 ZINC001498770539 1402279139 /nfs/dbraw/zinc/27/91/39/1402279139.db2.gz NZIPUDMONIQKJT-IBGZPJMESA-N 1 3 347.478 2.603 10 0 EFAEHO CC(C)(C(=O)N[C@@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)N1CCCC1 ZINC001498802983 1402299813 /nfs/dbraw/zinc/29/98/13/1402299813.db2.gz OJAGXLATCNQLOC-SFHVURJKSA-N 1 3 347.547 2.926 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](NC(=O)CC[NH+](C)C)C1CC1 ZINC001498816684 1402310689 /nfs/dbraw/zinc/31/06/89/1402310689.db2.gz IPQDRXNOTFTGSY-KRWDZBQOSA-N 1 3 337.895 2.585 10 0 EFAEHO C[C@H](NC1(CNC(=O)CC[C@@H]2CCC[N@@H+]2C)CC1)c1cccc(F)c1 ZINC001499253693 1402539030 /nfs/dbraw/zinc/53/90/30/1402539030.db2.gz GQXBXJDNXSJHBW-YJBOKZPZSA-N 1 3 347.478 3.000 10 0 EFAEHO C[C@H](NC1(CNC(=O)CC[C@@H]2CCC[N@H+]2C)CC1)c1cccc(F)c1 ZINC001499253693 1402539033 /nfs/dbraw/zinc/53/90/33/1402539033.db2.gz GQXBXJDNXSJHBW-YJBOKZPZSA-N 1 3 347.478 3.000 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1(N[C@@H](C)c2cccc(F)c2)CC1)[NH+](C)C ZINC001499256461 1402540009 /nfs/dbraw/zinc/54/00/09/1402540009.db2.gz JCCPXNJCXRAOIG-YOEHRIQHSA-N 1 3 335.467 2.711 10 0 EFAEHO C[C@H](NC1(CNC(=O)[C@H]2CC[N@H+](C)C2)CC1)c1ccc(Cl)cc1 ZINC001499448719 1402619296 /nfs/dbraw/zinc/61/92/96/1402619296.db2.gz PLAZUGYCMGEDOT-ZFWWWQNUSA-N 1 3 335.879 2.591 10 0 EFAEHO C[C@H](NC1(CNC(=O)[C@H]2CC[N@@H+](C)C2)CC1)c1ccc(Cl)cc1 ZINC001499448719 1402619302 /nfs/dbraw/zinc/61/93/02/1402619302.db2.gz PLAZUGYCMGEDOT-ZFWWWQNUSA-N 1 3 335.879 2.591 10 0 EFAEHO CC/C=C\CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)[C@H]1CCCN1C ZINC001499492318 1402640624 /nfs/dbraw/zinc/64/06/24/1402640624.db2.gz XCWZSNUBAZTKTB-BTXZYYKMSA-N 1 3 333.520 2.939 10 0 EFAEHO CC[C@@H](C(=O)N1CCC([N@H+](CC=C(C)C)CC2CC2)CC1)N(C)C ZINC001499531524 1402666308 /nfs/dbraw/zinc/66/63/08/1402666308.db2.gz YDGJEUPATNDMBL-IBGZPJMESA-N 1 3 335.536 2.996 10 0 EFAEHO CC[C@@H](C(=O)N1CCC([N@@H+](CC=C(C)C)CC2CC2)CC1)N(C)C ZINC001499531524 1402666311 /nfs/dbraw/zinc/66/63/11/1402666311.db2.gz YDGJEUPATNDMBL-IBGZPJMESA-N 1 3 335.536 2.996 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC[C@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001499577361 1402696343 /nfs/dbraw/zinc/69/63/43/1402696343.db2.gz UGCUOZPCBPOFJX-HCZHMGAMSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC[C@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001499577361 1402696346 /nfs/dbraw/zinc/69/63/46/1402696346.db2.gz UGCUOZPCBPOFJX-HCZHMGAMSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@@H](F)CN1CC[C@]2(CCN(C(=O)CCC[NH+]3CCCC3)C2)C1 ZINC001499618626 1402723145 /nfs/dbraw/zinc/72/31/45/1402723145.db2.gz DZGJWPIMRWOQGU-MJGOQNOKSA-N 1 3 339.499 2.535 10 0 EFAEHO C[C@@H](F)CC[NH+]1CCC([C@H](C)NC(=O)CN(C)CC(C)(C)C)CC1 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Cc1cccc(C)c1C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001505625522 1404868165 /nfs/dbraw/zinc/86/81/65/1404868165.db2.gz KULCIDKWVLFWGD-IRXDYDNUSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C1CCC1 ZINC001505625520 1404868632 /nfs/dbraw/zinc/86/86/32/1404868632.db2.gz KULCIDKWVLFWGD-DLBZAZTESA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001505626093 1404868747 /nfs/dbraw/zinc/86/87/47/1404868747.db2.gz QVRVNZBMCLNAEB-GJZGRUSLSA-N 1 3 342.487 2.635 10 0 EFAEHO C[C@@H](NCc1ccc(Cl)cc1F)[C@H](C)NC(=O)CCC[NH+](C)C ZINC001505677080 1404926806 /nfs/dbraw/zinc/92/68/06/1404926806.db2.gz CWTLYDMWFRBOFZ-OLZOCXBDSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)[C@@H](C)NCc1ccc(C)cc1Cl ZINC001505723447 1404983708 /nfs/dbraw/zinc/98/37/08/1404983708.db2.gz AHJYUHUJSYRNAZ-CABCVRRESA-N 1 3 339.911 2.973 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)[C@@H](C)NCc1ccc(C)cc1Cl ZINC001505723447 1404983714 /nfs/dbraw/zinc/98/37/14/1404983714.db2.gz AHJYUHUJSYRNAZ-CABCVRRESA-N 1 3 339.911 2.973 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1cc(C)sc1C ZINC001505736557 1405004114 /nfs/dbraw/zinc/00/41/14/1405004114.db2.gz UVEIDTSLRGKCIW-KBPBESRZSA-N 1 3 325.522 2.690 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@@H](C)[C@H](C)NC(=O)Cc1nc[nH]c1C ZINC001505738512 1405006383 /nfs/dbraw/zinc/00/63/83/1405006383.db2.gz LIPDFHZYPRNYBT-GJZGRUSLSA-N 1 3 342.487 2.549 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC(C)(C)C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001505833510 1405122067 /nfs/dbraw/zinc/12/20/67/1405122067.db2.gz JUNIISDVPRAWDP-QGZVFWFLSA-N 1 3 349.563 2.983 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)[C@H](C)CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001505918531 1405221807 /nfs/dbraw/zinc/22/18/07/1405221807.db2.gz MVRUTODEMUFAMG-UYAOXDASSA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1ccc(CC[N@H+](C)[C@H](C)CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001505918531 1405221814 /nfs/dbraw/zinc/22/18/14/1405221814.db2.gz MVRUTODEMUFAMG-UYAOXDASSA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1cc(CN(C)[C@@H](C)CNC(=O)[C@@H]2C[NH+]3CCC2CC3)c(C)s1 ZINC001505920507 1405226251 /nfs/dbraw/zinc/22/62/51/1405226251.db2.gz NQULHYBXYIYVFB-SCLBCKFNSA-N 1 3 349.544 2.643 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1cccc(OC)c1 ZINC001505930517 1405242271 /nfs/dbraw/zinc/24/22/71/1405242271.db2.gz JTAINQNCVIFSHI-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1cccc(OC)c1 ZINC001505930517 1405242278 /nfs/dbraw/zinc/24/22/78/1405242278.db2.gz JTAINQNCVIFSHI-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)[C@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001505976618 1405295798 /nfs/dbraw/zinc/29/57/98/1405295798.db2.gz PNHIIPVKTDEYQM-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)[C@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001505976618 1405295804 /nfs/dbraw/zinc/29/58/04/1405295804.db2.gz PNHIIPVKTDEYQM-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[N@H+](C)CC1CCC2(CC2)CC1 ZINC001506002624 1405331293 /nfs/dbraw/zinc/33/12/93/1405331293.db2.gz ZWCNPEPQXVXKTP-IAGOWNOFSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001506002624 1405331301 /nfs/dbraw/zinc/33/13/01/1405331301.db2.gz ZWCNPEPQXVXKTP-IAGOWNOFSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H](CNC(=O)C12CC[NH+](CC1)C2)N(C)[C@@H](C)c1cccc(Cl)c1 ZINC001506037902 1405383535 /nfs/dbraw/zinc/38/35/35/1405383535.db2.gz CFIKERAEFJCJES-GJZGRUSLSA-N 1 3 349.906 2.933 10 0 EFAEHO CCc1cccc(CN(C)[C@@H](C)CNC(=O)C[C@H]2CC[N@H+](C)C2)c1 ZINC001506037933 1405384774 /nfs/dbraw/zinc/38/47/74/1405384774.db2.gz CWNAQXIKMRLDQV-QFBILLFUSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(CN(C)[C@@H](C)CNC(=O)C[C@H]2CC[N@@H+](C)C2)c1 ZINC001506037933 1405384783 /nfs/dbraw/zinc/38/47/83/1405384783.db2.gz CWNAQXIKMRLDQV-QFBILLFUSA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCF ZINC001506480636 1405825368 /nfs/dbraw/zinc/82/53/68/1405825368.db2.gz OXKLCXLRVCDXMG-QAPCUYQASA-N 1 3 347.494 2.631 10 0 EFAEHO CC[C@H](C(=O)NC1(C[NH2+]Cc2ccccc2)CCCCC1)N(C)C ZINC001506521261 1405901051 /nfs/dbraw/zinc/90/10/51/1405901051.db2.gz CZTVNLGNPTZLDP-GOSISDBHSA-N 1 3 331.504 2.936 10 0 EFAEHO CCCC[C@@H](CNCc1ccccn1)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001506544215 1405936124 /nfs/dbraw/zinc/93/61/24/1405936124.db2.gz IYAZRRJIHSDXRZ-LNLFQRSKSA-N 1 3 346.519 2.577 10 0 EFAEHO CCCC[C@@H](CNCc1ccccn1)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001506544215 1405936130 /nfs/dbraw/zinc/93/61/30/1405936130.db2.gz IYAZRRJIHSDXRZ-LNLFQRSKSA-N 1 3 346.519 2.577 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H](C)C1C[NH+](Cc2ccccc2C)C1 ZINC001506621630 1406054930 /nfs/dbraw/zinc/05/49/30/1406054930.db2.gz YJJMKVFMKMECHQ-LPHOPBHVSA-N 1 3 349.494 2.611 10 0 EFAEHO Cc1ccc(CN2CC([C@H](C)NC(=O)CCCC[NH+](C)C)C2)cc1 ZINC001506664282 1406120049 /nfs/dbraw/zinc/12/00/49/1406120049.db2.gz KOBALPAJAMTFNW-KRWDZBQOSA-N 1 3 331.504 2.663 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C1C[NH+](C[C@H]2CCCC(F)(F)C2)C1 ZINC001506671614 1406129594 /nfs/dbraw/zinc/12/95/94/1406129594.db2.gz PEYLVKPAEXHGEJ-GJZGRUSLSA-N 1 3 345.478 2.590 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C1C[NH+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC001506671618 1406129904 /nfs/dbraw/zinc/12/99/04/1406129904.db2.gz PEYLVKPAEXHGEJ-LSDHHAIUSA-N 1 3 345.478 2.590 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@@H]1CN(Cc2ccccc2)CC1(C)C ZINC001506742319 1406232878 /nfs/dbraw/zinc/23/28/78/1406232878.db2.gz QKYGJEGGQLSUKC-RBUKOAKNSA-N 1 3 343.515 2.888 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@@H]1CN(Cc2ccccc2)CC1(C)C ZINC001506742319 1406232882 /nfs/dbraw/zinc/23/28/82/1406232882.db2.gz QKYGJEGGQLSUKC-RBUKOAKNSA-N 1 3 343.515 2.888 10 0 EFAEHO CC/C=C\CC[NH2+]CC[C@@H]1[C@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001565939693 1415457909 /nfs/dbraw/zinc/45/79/09/1415457909.db2.gz SWNPDLNBJNPNRC-ZFTGLFDFSA-N 1 3 332.492 2.915 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)C2CC[NH+](C)CC2)CCN1CCCCC(F)(F)F ZINC001566102088 1415515466 /nfs/dbraw/zinc/51/54/66/1415515466.db2.gz JDDFVUBXQBGXIC-HIFRSBDPSA-N 1 3 349.441 2.640 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCNC(=O)CN(C)C2CCC2)c(C)c1 ZINC001566462276 1415561456 /nfs/dbraw/zinc/56/14/56/1415561456.db2.gz SBIRFLZTDBXITA-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCNC(=O)CN(C)C2CCC2)c(C)c1 ZINC001566462276 1415561463 /nfs/dbraw/zinc/56/14/63/1415561463.db2.gz SBIRFLZTDBXITA-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCNC(=O)C2(N(C)C)CCC2)c(C)c1 ZINC001566461389 1415561517 /nfs/dbraw/zinc/56/15/17/1415561517.db2.gz YFQPAKYISBEJPZ-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCNC(=O)C2(N(C)C)CCC2)c(C)c1 ZINC001566461389 1415561519 /nfs/dbraw/zinc/56/15/19/1415561519.db2.gz YFQPAKYISBEJPZ-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO C[C@@H](c1ccccc1F)N(C)CCCNC(=O)C1(C[NH+](C)C)CC1 ZINC001566486797 1415579121 /nfs/dbraw/zinc/57/91/21/1415579121.db2.gz KWAVKGQFIYRHFU-HNNXBMFYSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](C)C[C@@H]2CCCC(F)(F)C2)C1 ZINC001566490753 1415582631 /nfs/dbraw/zinc/58/26/31/1415582631.db2.gz BWCYASREOMAWKY-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](C)C[C@@H]2CCCC(F)(F)C2)C1 ZINC001566490753 1415582636 /nfs/dbraw/zinc/58/26/36/1415582636.db2.gz BWCYASREOMAWKY-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@H]1CCCCN1CCCCC(F)(F)F ZINC001566925468 1415850823 /nfs/dbraw/zinc/85/08/23/1415850823.db2.gz ITNLQRGTMUHJRD-AWEZNQCLSA-N 1 3 337.430 2.641 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[NH2+]CCc1ccccc1 ZINC001566951257 1415865372 /nfs/dbraw/zinc/86/53/72/1415865372.db2.gz FLKYFVQGXKOMNH-IBGZPJMESA-N 1 3 331.504 2.542 10 0 EFAEHO CN(CC(=O)N1CC[C@H](C[NH2+]C/C=C\c2ccccc2)C1)C1CCC1 ZINC001567128955 1415944243 /nfs/dbraw/zinc/94/42/43/1415944243.db2.gz YCKUISKPZWPMPJ-WMHRWZGDSA-N 1 3 341.499 2.622 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](C[NH2+]CCC3=CCCCC3)C2)C1 ZINC001567141042 1415949508 /nfs/dbraw/zinc/94/95/08/1415949508.db2.gz UFQOSZSTZPUBSO-PKOBYXMFSA-N 1 3 333.520 2.657 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[C@@H]1CCC[N@@H+]1C/C=C\Cl ZINC001567265659 1416043842 /nfs/dbraw/zinc/04/38/42/1416043842.db2.gz ALXVXNQVGGJTCP-RVHKNYROSA-N 1 3 341.927 2.974 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[C@@H]1CCC[N@H+]1C/C=C\Cl ZINC001567265659 1416043846 /nfs/dbraw/zinc/04/38/46/1416043846.db2.gz ALXVXNQVGGJTCP-RVHKNYROSA-N 1 3 341.927 2.974 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@H]2CCC[C@H]3CCC[N@@H+]32)cc1F ZINC001567573846 1416193586 /nfs/dbraw/zinc/19/35/86/1416193586.db2.gz NIBYDCNOOQEAFS-PKOBYXMFSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@H]2CCC[C@H]3CCC[N@H+]32)cc1F ZINC001567573846 1416193589 /nfs/dbraw/zinc/19/35/89/1416193589.db2.gz NIBYDCNOOQEAFS-PKOBYXMFSA-N 1 3 347.478 2.699 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C ZINC001567590539 1416200800 /nfs/dbraw/zinc/20/08/00/1416200800.db2.gz CDWWYNCMNDCUPN-IBGZPJMESA-N 1 3 331.504 2.842 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]CCCc1ccccc1C ZINC001567611455 1416209945 /nfs/dbraw/zinc/20/99/45/1416209945.db2.gz HMWRZVQMJKJBGL-FQEVSTJZSA-N 1 3 345.531 2.850 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]CCN(C)C(=O)CN(C)C(C)C ZINC001567611448 1416210242 /nfs/dbraw/zinc/21/02/42/1416210242.db2.gz HHLQIPQRFVNYKX-UHFFFAOYSA-N 1 3 325.884 2.537 10 0 EFAEHO C[NH+]1CCC(CC(=O)N2C[C@H]3CC[C@@H](C2)N3CCCCCF)CC1 ZINC001567674578 1416241395 /nfs/dbraw/zinc/24/13/95/1416241395.db2.gz KNECDNWAQXUAJU-HDICACEKSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CC(=O)NC1(C[NH2+]C/C=C/Cl)CCCC1)CC(C)(C)C ZINC001568005269 1416357462 /nfs/dbraw/zinc/35/74/62/1416357462.db2.gz CRGRNKNHYXGHRU-JXMROGBWSA-N 1 3 329.916 2.735 10 0 EFAEHO CC(C)=CC[NH2+]CC[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001568070685 1416393869 /nfs/dbraw/zinc/39/38/69/1416393869.db2.gz VNTVDKXWZYLXNZ-LJQANCHMSA-N 1 3 335.536 2.903 10 0 EFAEHO CC(C)CC[NH2+]CC[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001568070423 1416394111 /nfs/dbraw/zinc/39/41/11/1416394111.db2.gz RQSOUQNMRXBSRV-LJQANCHMSA-N 1 3 337.552 2.983 10 0 EFAEHO CC[C@H](C(=O)N1CCC2(CC[N@H+](CCCCCF)C2)CC1)N(C)C ZINC001568155514 1416427951 /nfs/dbraw/zinc/42/79/51/1416427951.db2.gz QMKLXXFLNGWFBI-QGZVFWFLSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[C@H](C(=O)N1CCC2(CC[N@@H+](CCCCCF)C2)CC1)N(C)C ZINC001568155514 1416427954 /nfs/dbraw/zinc/42/79/54/1416427954.db2.gz QMKLXXFLNGWFBI-QGZVFWFLSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H](C)C[NH2+]C/C=C\c1ccccc1)N(C)C ZINC001568280081 1416464122 /nfs/dbraw/zinc/46/41/22/1416464122.db2.gz WTJXDXVRTWGUEC-ZSKKXUIOSA-N 1 3 331.504 2.723 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCCC[C@@H]2CC[NH2+]CC2CCCC2)C1 ZINC001568393702 1416511105 /nfs/dbraw/zinc/51/11/05/1416511105.db2.gz QWHJQHAAZYPCHE-IEBWSBKVSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCCC[C@H]2CC[NH2+]CC2CCCC2)C1 ZINC001568393701 1416511181 /nfs/dbraw/zinc/51/11/81/1416511181.db2.gz QWHJQHAAZYPCHE-HKUYNNGSSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)CCC[NH2+]C[C@H]1[C@H](C)CCCN1C(=O)CN(C)C(C)C ZINC001568433445 1416533488 /nfs/dbraw/zinc/53/34/88/1416533488.db2.gz BPLCCINXTKWWQK-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]CCC1=CCCCC1 ZINC001568462379 1416539082 /nfs/dbraw/zinc/53/90/82/1416539082.db2.gz IYSUCJSWAHMPPD-HKUYNNGSSA-N 1 3 335.536 2.949 10 0 EFAEHO CCN(CC[NH2+]Cc1ccn(C(C)C)n1)C(=O)C1CCCC(F)C1 ZINC001568742232 1416545173 /nfs/dbraw/zinc/54/51/73/1416545173.db2.gz OCHJAQATFHCTTD-HOTGVXAUSA-N 1 3 338.471 2.930 10 0 EFAEHO CC(C)C[N@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001690005324 1417128849 /nfs/dbraw/zinc/12/88/49/1417128849.db2.gz AFCNPTAXGCGMCV-IBGZPJMESA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)C[N@@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001690005324 1417128853 /nfs/dbraw/zinc/12/88/53/1417128853.db2.gz AFCNPTAXGCGMCV-IBGZPJMESA-N 1 3 341.515 2.826 10 0 EFAEHO CN(C(=O)CN1CCCC1)C1CC[NH+](CCCCC(F)(F)F)CC1 ZINC001690030425 1417139136 /nfs/dbraw/zinc/13/91/36/1417139136.db2.gz YZYSCULELAJJJQ-UHFFFAOYSA-N 1 3 349.441 2.738 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CC[C@H]([NH2+]CCCCCF)C2)C1 ZINC001690246794 1417178171 /nfs/dbraw/zinc/17/81/71/1417178171.db2.gz WWEOCBDLGBJNRJ-YJBOKZPZSA-N 1 3 345.478 2.529 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@H]2C[C@@H]([NH2+]CC/C=C/c3ccccc3)C2)C1 ZINC001690356790 1417195225 /nfs/dbraw/zinc/19/52/25/1417195225.db2.gz VIXVIKWBCFLXHW-YZWUNXRZSA-N 1 3 341.499 2.669 10 0 EFAEHO C[C@H](NC(=O)CCCC[NH+](C)C)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC001690504711 1417219453 /nfs/dbraw/zinc/21/94/53/1417219453.db2.gz HOHBUHCKYYSUEU-PKOBYXMFSA-N 1 3 346.519 2.530 10 0 EFAEHO C[C@@H](C(=O)NCC1CN(CC2=CCCCC2)C1)[NH+]1CCCCCC1 ZINC001692337528 1417280133 /nfs/dbraw/zinc/28/01/33/1417280133.db2.gz BYWYDQCXWFLFME-KRWDZBQOSA-N 1 3 333.520 2.799 10 0 EFAEHO Cc1ccccc1C[NH2+]CCC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001698698757 1417311191 /nfs/dbraw/zinc/31/11/91/1417311191.db2.gz PYLANGDOIIFFOY-HXUWFJFHSA-N 1 3 343.515 2.808 10 0 EFAEHO CN(CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2CCCCCF)C1)C1CCC1 ZINC001699007879 1417366778 /nfs/dbraw/zinc/36/67/78/1417366778.db2.gz GPFSCDQBZCAKBP-AEFFLSMTSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2CCCCCF)C1)C1CCC1 ZINC001699007879 1417366782 /nfs/dbraw/zinc/36/67/82/1417366782.db2.gz GPFSCDQBZCAKBP-AEFFLSMTSA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccc(Cl)s1)NC(=O)C1(N(C)C)CCC1 ZINC001699107398 1417391221 /nfs/dbraw/zinc/39/12/21/1417391221.db2.gz SLQDVJINQHPWNN-LBPRGKRZSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@@H](CC[NH2+]C[C@H]1CCCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001699108028 1417392194 /nfs/dbraw/zinc/39/21/94/1417392194.db2.gz XQRBEQPIVBBFGV-GJZGRUSLSA-N 1 3 345.478 2.781 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CC[NH2+]Cc1csc(C)c1 ZINC001699158349 1417407936 /nfs/dbraw/zinc/40/79/36/1417407936.db2.gz DOISVRJHXOIMLU-PBHICJAKSA-N 1 3 337.533 2.915 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)c(C)c1)C(=O)CN(C)C1CCC1 ZINC001699186601 1417411468 /nfs/dbraw/zinc/41/14/68/1417411468.db2.gz ZEZLBNQEDGEYIF-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CCN(CC[NH2+]Cc1cc2ccccc2o1)C(=O)[C@@H]1CCCCN1C ZINC001699187281 1417412180 /nfs/dbraw/zinc/41/21/80/1417412180.db2.gz LWRNFWLUCISCJF-SFHVURJKSA-N 1 3 343.471 2.855 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(F)c(Cl)c1)C(=O)CN1CCCC1 ZINC001699216730 1417413795 /nfs/dbraw/zinc/41/37/95/1417413795.db2.gz BGQABUXSFGRBDL-UHFFFAOYSA-N 1 3 341.858 2.513 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C/C=C/CNC(=O)CN1CC[C@H](C)C1 ZINC001699308726 1417418485 /nfs/dbraw/zinc/41/84/85/1417418485.db2.gz OGLIVRRBWLRKJV-DKFQHHCZSA-N 1 3 343.515 2.914 10 0 EFAEHO C[NH+](C)CCCCC(=O)NCC1(C)CCN(C/C=C\Cl)CC1 ZINC001699866323 1417485165 /nfs/dbraw/zinc/48/51/65/1417485165.db2.gz WLSABTUYDRIXDC-POHAHGRESA-N 1 3 329.916 2.689 10 0 EFAEHO C[C@@H]([NH2+]CCCCC(F)(F)F)[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001699950603 1417520504 /nfs/dbraw/zinc/52/05/04/1417520504.db2.gz DYLYDGYDAQJCOK-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)C2CCC2)C[C@@H]1C[NH2+]CCC1CCCC1 ZINC001699961564 1417525889 /nfs/dbraw/zinc/52/58/89/1417525889.db2.gz XTVXAYLIGUTTAF-WMZOPIPTSA-N 1 3 335.536 2.735 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](CC[NH2+]CCC2=CCCCC2)C1 ZINC001700086719 1417559666 /nfs/dbraw/zinc/55/96/66/1417559666.db2.gz CKDUOWUWJXQXHM-IBGZPJMESA-N 1 3 333.520 2.801 10 0 EFAEHO CC(C)CN1CCC([NH2+]C[C@H]2CN(Cc3ccccc3)CCO2)CC1 ZINC000158670488 1418280791 /nfs/dbraw/zinc/28/07/91/1418280791.db2.gz IESLWXLKJHARRE-NRFANRHFSA-N 1 3 345.531 2.597 10 0 EFAEHO CC(C)CN1CCC([NH2+]C[C@@H]2CN(Cc3ccccc3)CCO2)CC1 ZINC000158670368 1418280810 /nfs/dbraw/zinc/28/08/10/1418280810.db2.gz IESLWXLKJHARRE-OAQYLSRUSA-N 1 3 345.531 2.597 10 0 EFAEHO CCC/C=C/CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)CN1[C@H](C)CC[C@H]1C ZINC001713283692 1418453271 /nfs/dbraw/zinc/45/32/71/1418453271.db2.gz LGJMCXKYTPRHTK-XYNYUMSJSA-N 1 3 333.520 2.652 10 0 EFAEHO CCC/C=C/CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)CN1[C@H](C)CC[C@H]1C ZINC001713283692 1418453274 /nfs/dbraw/zinc/45/32/74/1418453274.db2.gz LGJMCXKYTPRHTK-XYNYUMSJSA-N 1 3 333.520 2.652 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](C[NH2+]CC/C=C\c2ccccc2)C1)N(C)C ZINC001713354421 1418487763 /nfs/dbraw/zinc/48/77/63/1418487763.db2.gz NHCQFPPYFIEMRB-IDVICZFGSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CCC[C@H]([NH2+]CCCF)C1)N1CCCCC1 ZINC001713373444 1418498141 /nfs/dbraw/zinc/49/81/41/1418498141.db2.gz OSCHGNNUMHVHOH-HOTGVXAUSA-N 1 3 327.488 2.628 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CCC[C@H]([NH2+]CCCF)C1)N1CCCCC1 ZINC001713373446 1418498374 /nfs/dbraw/zinc/49/83/74/1418498374.db2.gz OSCHGNNUMHVHOH-JKSUJKDBSA-N 1 3 327.488 2.628 10 0 EFAEHO CC/C=C/CC[N@H+](C)C[C@@H]1CCN(C(=O)[C@H]2CCCCN2CC)C1 ZINC001714910486 1418642996 /nfs/dbraw/zinc/64/29/96/1418642996.db2.gz WZYUJBVQSUQPDE-HMTUNPETSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@H]2CCCCN2CC)C1 ZINC001714910486 1418642998 /nfs/dbraw/zinc/64/29/98/1418642998.db2.gz WZYUJBVQSUQPDE-HMTUNPETSA-N 1 3 335.536 2.997 10 0 EFAEHO O=C(NC1(CNCCF)CCCC1)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001715094774 1418650699 /nfs/dbraw/zinc/65/06/99/1418650699.db2.gz LCMZBENDBYLRPZ-MRXNPFEDSA-N 1 3 339.499 2.629 10 0 EFAEHO O=C(NC1(CNCCF)CCCC1)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001715094774 1418650700 /nfs/dbraw/zinc/65/07/00/1418650700.db2.gz LCMZBENDBYLRPZ-MRXNPFEDSA-N 1 3 339.499 2.629 10 0 EFAEHO CC1CC(C[NH2+]CCC2CCN(C(=O)CN3CC[C@H](C)C3)CC2)C1 ZINC001715176033 1418656015 /nfs/dbraw/zinc/65/60/15/1418656015.db2.gz QLIWAGDMBZQNKM-MUYFXNHWSA-N 1 3 335.536 2.593 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C\CNC(=O)CN2CCC(C)CC2)c(C)c1 ZINC001715883137 1418695015 /nfs/dbraw/zinc/69/50/15/1418695015.db2.gz AWMAHTMFGGFVQR-PLNGDYQASA-N 1 3 343.515 2.797 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@H]21 ZINC001716049109 1418704666 /nfs/dbraw/zinc/70/46/66/1418704666.db2.gz JQNJHIKTVBPPMI-QZTJIDSGSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCCCC[N@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@H]21 ZINC001716049109 1418704669 /nfs/dbraw/zinc/70/46/69/1418704669.db2.gz JQNJHIKTVBPPMI-QZTJIDSGSA-N 1 3 335.536 2.974 10 0 EFAEHO CC(C)c1cccc(C[NH2+]CC[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)n1 ZINC001716174589 1418713809 /nfs/dbraw/zinc/71/38/09/1418713809.db2.gz VCVYQSSEPMEQQD-IAGOWNOFSA-N 1 3 346.519 2.531 10 0 EFAEHO CCN(CC[NH2+]CC1CCC2(CC2)CC1)C(=O)CN1CC[C@@H](C)C1 ZINC001716240050 1418733456 /nfs/dbraw/zinc/73/34/56/1418733456.db2.gz WEARJFJCZVRQFI-QGZVFWFLSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C/CNCc2csc(C)c2)CC[N@@H+]1C ZINC001716297119 1418757507 /nfs/dbraw/zinc/75/75/07/1418757507.db2.gz WXPNKRZKFVSXTI-LZCSOBMZSA-N 1 3 335.517 2.549 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C/CNCc2csc(C)c2)CC[N@H+]1C ZINC001716297119 1418757512 /nfs/dbraw/zinc/75/75/12/1418757512.db2.gz WXPNKRZKFVSXTI-LZCSOBMZSA-N 1 3 335.517 2.549 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C\CNC(=O)C12CCC[NH+]1CCC2 ZINC001716313390 1418768570 /nfs/dbraw/zinc/76/85/70/1418768570.db2.gz AVPIEGYJPRDQJP-IHWYPQMZSA-N 1 3 345.462 2.525 10 0 EFAEHO CC[C@@H]([NH2+]C/C=C/CNC(=O)[C@H]1CCCN1C)c1ccc(F)cc1 ZINC001716330693 1418779217 /nfs/dbraw/zinc/77/92/17/1418779217.db2.gz YQUSFIUOQMUMLQ-UBZMYNMCSA-N 1 3 333.451 2.633 10 0 EFAEHO C[C@H](NC/C=C/CNC(=O)CC[NH+](C)C)c1ccc(F)c(Cl)c1 ZINC001716339871 1418784930 /nfs/dbraw/zinc/78/49/30/1418784930.db2.gz OKOVGMHQGOFGFC-IHVVCDCBSA-N 1 3 341.858 2.754 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C/C[NH2+][C@@H]1CCc2c1cccc2Cl)N(C)C ZINC001716344163 1418787773 /nfs/dbraw/zinc/78/77/73/1418787773.db2.gz RAENWQTXZNFZPG-VGRIIWOTSA-N 1 3 349.906 2.930 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC/C=C/C[NH2+]CCc1ccccc1F ZINC001716378058 1418860396 /nfs/dbraw/zinc/86/03/96/1418860396.db2.gz FZDZLEIEBQDJLD-GHOSXJJBSA-N 1 3 347.478 2.505 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C)C[NH2+]CCc1ccc(C)cc1 ZINC001716398064 1418872638 /nfs/dbraw/zinc/87/26/38/1418872638.db2.gz GHKOTZVUOQPNED-MJGOQNOKSA-N 1 3 331.504 2.506 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CCCN(C)C(=O)[C@@H]1CCCCN1C ZINC001716548733 1418911073 /nfs/dbraw/zinc/91/10/73/1418911073.db2.gz BMEDVUYRLLXLBC-SFHVURJKSA-N 1 3 335.467 2.557 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@@H](CNCCF)C2CCCC2)CCCCC1 ZINC001716819878 1419030659 /nfs/dbraw/zinc/03/06/59/1419030659.db2.gz IKNHHGUWBOLOHG-KRWDZBQOSA-N 1 3 341.515 2.733 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]1CC[C@H](C[NH2+]CCCF)CC1 ZINC001717001553 1419137234 /nfs/dbraw/zinc/13/72/34/1419137234.db2.gz FXQWCWCBVWANDS-BZSNNMDCSA-N 1 3 341.515 2.731 10 0 EFAEHO CCC/C=C\CC[N@H+]1C[C@H]2CN(C(=O)[C@@H]3CCCCN3CC)C[C@H]2C1 ZINC001717014908 1419150595 /nfs/dbraw/zinc/15/05/95/1419150595.db2.gz KCDYECBCFJOSQW-QOJNPXKOSA-N 1 3 347.547 2.997 10 0 EFAEHO CCC/C=C\CC[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3CCCCN3CC)C[C@H]2C1 ZINC001717014908 1419150596 /nfs/dbraw/zinc/15/05/96/1419150596.db2.gz KCDYECBCFJOSQW-QOJNPXKOSA-N 1 3 347.547 2.997 10 0 EFAEHO CCCCCC[N@H+]1C[C@H]2CN(C(=O)CN3[C@H](C)CC[C@H]3C)C[C@H]2C1 ZINC001717015249 1419150680 /nfs/dbraw/zinc/15/06/80/1419150680.db2.gz XFNHEOJOBMOXHP-MKXGPGLRSA-N 1 3 335.536 2.830 10 0 EFAEHO CCCCCC[N@@H+]1C[C@H]2CN(C(=O)CN3[C@H](C)CC[C@H]3C)C[C@H]2C1 ZINC001717015249 1419150682 /nfs/dbraw/zinc/15/06/82/1419150682.db2.gz XFNHEOJOBMOXHP-MKXGPGLRSA-N 1 3 335.536 2.830 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C(C)C)N(C)C ZINC001717035470 1419167654 /nfs/dbraw/zinc/16/76/54/1419167654.db2.gz KNKCLSMDXWVIRZ-WUYYXPQKSA-N 1 3 335.536 2.994 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C(C)C)N(C)C ZINC001717035470 1419167656 /nfs/dbraw/zinc/16/76/56/1419167656.db2.gz KNKCLSMDXWVIRZ-WUYYXPQKSA-N 1 3 335.536 2.994 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@H]2C[N@H+](CC=C(C)C)C[C@H]21 ZINC001717040649 1419174062 /nfs/dbraw/zinc/17/40/62/1419174062.db2.gz BHLSINGBVMVOKK-RCCFBDPRSA-N 1 3 339.499 2.555 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@H]2C[N@@H+](CC=C(C)C)C[C@H]21 ZINC001717040649 1419174067 /nfs/dbraw/zinc/17/40/67/1419174067.db2.gz BHLSINGBVMVOKK-RCCFBDPRSA-N 1 3 339.499 2.555 10 0 EFAEHO CN(CC(=O)N1CC[C@H](CC[NH2+]CC2CCCCC2)C1)C1CCC1 ZINC001717087701 1419198699 /nfs/dbraw/zinc/19/86/99/1419198699.db2.gz KYHRCWHGXGLDGA-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)CC[NH2+]CC[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001717099589 1419207693 /nfs/dbraw/zinc/20/76/93/1419207693.db2.gz ZDNGVWOPSQMGBO-QGZVFWFLSA-N 1 3 325.541 2.839 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+]Cc2cccc(C)c2)C1 ZINC001717107593 1419213149 /nfs/dbraw/zinc/21/31/49/1419213149.db2.gz NPNQMUIAMCUZQV-SFHVURJKSA-N 1 3 331.504 2.665 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N[C@@H]1CCCN(C/C=C\Cl)CC1 ZINC001717203588 1419264704 /nfs/dbraw/zinc/26/47/04/1419264704.db2.gz YDVSMWDOXQGCKN-XBMZPMPPSA-N 1 3 341.927 2.976 10 0 EFAEHO CC/C=C\CC[N@H+](CC)CC1CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001717356493 1419351780 /nfs/dbraw/zinc/35/17/80/1419351780.db2.gz AKNGYYJIBUIBKT-WAYWQWQTSA-N 1 3 332.492 2.869 10 0 EFAEHO CC/C=C\CC[N@@H+](CC)CC1CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001717356493 1419351783 /nfs/dbraw/zinc/35/17/83/1419351783.db2.gz AKNGYYJIBUIBKT-WAYWQWQTSA-N 1 3 332.492 2.869 10 0 EFAEHO CC/C=C\CC[N@H+](C)C[C@@H]1CCCN1C(=O)CN1CCC(C)CC1 ZINC001717372538 1419364590 /nfs/dbraw/zinc/36/45/90/1419364590.db2.gz GWYMONDTJRVUGL-VOFKWLDRSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](C)C[C@@H]1CCCN1C(=O)CN1CCC(C)CC1 ZINC001717372538 1419364593 /nfs/dbraw/zinc/36/45/93/1419364593.db2.gz GWYMONDTJRVUGL-VOFKWLDRSA-N 1 3 335.536 2.997 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC(C)(C)C[NH2+]C/C=C\Cl ZINC001717460032 1419402739 /nfs/dbraw/zinc/40/27/39/1419402739.db2.gz WWIPKZNJQUOKFA-WKTRQSJXSA-N 1 3 329.916 2.688 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001717627801 1419476669 /nfs/dbraw/zinc/47/66/69/1419476669.db2.gz ZWVMQQQHUOODBF-PMEOWRCESA-N 1 3 335.536 2.900 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001717627801 1419476671 /nfs/dbraw/zinc/47/66/71/1419476671.db2.gz ZWVMQQQHUOODBF-PMEOWRCESA-N 1 3 335.536 2.900 10 0 EFAEHO C[C@H](CCC[NH2+]Cc1cccc(F)c1)NC(=O)CN1CC[C@@H](C)C1 ZINC001717684423 1419504910 /nfs/dbraw/zinc/50/49/10/1419504910.db2.gz MHESQOAFTSXGCV-HZPDHXFCSA-N 1 3 335.467 2.542 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)c1 ZINC001717831509 1419562373 /nfs/dbraw/zinc/56/23/73/1419562373.db2.gz YHJPSDZKFYZTGZ-AZUAARDMSA-N 1 3 345.531 2.847 10 0 EFAEHO CC[C@H]([NH2+]CCCN(C)C(=O)Cc1c[nH]cn1)c1ccc(F)cc1 ZINC001723134030 1424432583 /nfs/dbraw/zinc/43/25/83/1424432583.db2.gz XLMAEKBFDCIOTN-KRWDZBQOSA-N 1 3 332.423 2.681 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CCCCC(F)(F)F)CCN1C(=O)Cc1c[nH]cn1 ZINC001723865003 1424598286 /nfs/dbraw/zinc/59/82/86/1424598286.db2.gz ZULSGSTZDABLRX-OLZOCXBDSA-N 1 3 346.397 2.654 10 0 EFAEHO CN(CC(=O)N1CC[C@@](C)(C[NH2+]CCCC2CCC2)C1)C1CCC1 ZINC001724223018 1424705387 /nfs/dbraw/zinc/70/53/87/1424705387.db2.gz NXIIMECNGGCCPT-FQEVSTJZSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCCC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@H](C)C1)C2 ZINC001724601621 1424818048 /nfs/dbraw/zinc/81/80/48/1424818048.db2.gz HKOILGULURTURD-OKYOBFRVSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCCC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@H](C)C1)C2 ZINC001724601621 1424818056 /nfs/dbraw/zinc/81/80/56/1424818056.db2.gz HKOILGULURTURD-OKYOBFRVSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1CC[C@H](C[NH2+]CCCF)CC1 ZINC001724613710 1424834125 /nfs/dbraw/zinc/83/41/25/1424834125.db2.gz IBFCNMIAPSMASI-VPLLLXJESA-N 1 3 341.515 2.731 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CC[C@H](CC[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001724729288 1424949642 /nfs/dbraw/zinc/94/96/42/1424949642.db2.gz UKKLNHBYHVAQSI-KRWDZBQOSA-N 1 3 344.503 2.751 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1([NH2+]CCC2=CCCCC2)CCC1 ZINC001724801821 1425021633 /nfs/dbraw/zinc/02/16/33/1425021633.db2.gz JMFDLVYGQLXMTK-UHFFFAOYSA-N 1 3 330.476 2.780 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H](C)[NH2+]CCCc1ccc(C)cc1 ZINC001725122381 1425314732 /nfs/dbraw/zinc/31/47/32/1425314732.db2.gz CWKALFJBIHTENW-CVEARBPZSA-N 1 3 342.487 2.685 10 0 EFAEHO CCCCC[N@H+](C)[C@@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001725181776 1425361516 /nfs/dbraw/zinc/36/15/16/1425361516.db2.gz PZUJNXYCMLYYSE-MAUKXSAKSA-N 1 3 329.504 2.826 10 0 EFAEHO CCCCC[N@@H+](C)[C@@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001725181776 1425361521 /nfs/dbraw/zinc/36/15/21/1425361521.db2.gz PZUJNXYCMLYYSE-MAUKXSAKSA-N 1 3 329.504 2.826 10 0 EFAEHO CN(C)C1(C(=O)N2CC3(C2)CCC[N@H+](CCCCCF)C3)CCC1 ZINC001725336495 1425480718 /nfs/dbraw/zinc/48/07/18/1425480718.db2.gz DCHWGNZWGAWSQB-UHFFFAOYSA-N 1 3 339.499 2.535 10 0 EFAEHO CN(C)C1(C(=O)N2CC3(C2)CCC[N@@H+](CCCCCF)C3)CCC1 ZINC001725336495 1425480722 /nfs/dbraw/zinc/48/07/22/1425480722.db2.gz DCHWGNZWGAWSQB-UHFFFAOYSA-N 1 3 339.499 2.535 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)CCC[NH2+]CCC(F)(F)F ZINC001725455763 1425593065 /nfs/dbraw/zinc/59/30/65/1425593065.db2.gz FEVDAUWJYSSPKZ-ZIAGYGMSSA-N 1 3 337.430 2.688 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@]12CCC[C@H]1[N@H+](CC=C(C)C)CC2 ZINC001725608690 1425698826 /nfs/dbraw/zinc/69/88/26/1425698826.db2.gz MMBNRBJYZDTDHK-SCTDSRPQSA-N 1 3 339.499 2.746 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@]12CCC[C@H]1[N@@H+](CC=C(C)C)CC2 ZINC001725608690 1425698832 /nfs/dbraw/zinc/69/88/32/1425698832.db2.gz MMBNRBJYZDTDHK-SCTDSRPQSA-N 1 3 339.499 2.746 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CCCCCF)[C@H]2C1 ZINC001725616830 1425710503 /nfs/dbraw/zinc/71/05/03/1425710503.db2.gz BXHMMDCBRPFXKM-OKZBNKHCSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CCCCCF)[C@H]2C1 ZINC001725616826 1425710569 /nfs/dbraw/zinc/71/05/69/1425710569.db2.gz BXHMMDCBRPFXKM-BZSNNMDCSA-N 1 3 341.515 2.683 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCC(C)(C)C)C(C)(C)C1 ZINC001725683238 1425779175 /nfs/dbraw/zinc/77/91/75/1425779175.db2.gz SPTYVWACGYVTLX-MRXNPFEDSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]CCCc2cccc(F)c2)C1 ZINC001725788835 1425853044 /nfs/dbraw/zinc/85/30/44/1425853044.db2.gz CBGTWHDDRALBSF-UHFFFAOYSA-N 1 3 349.494 2.678 10 0 EFAEHO CCc1ccc(CN2CC=C(CNC(=O)CCC[NH+](C)C)CC2)cc1 ZINC001725860175 1425924500 /nfs/dbraw/zinc/92/45/00/1425924500.db2.gz OCIQWSGMECCNDC-UHFFFAOYSA-N 1 3 343.515 2.839 10 0 EFAEHO FC(F)(F)c1ccn(CCN[C@@H]2CC[NH2+]C[C@H]2C2CCCC2)n1 ZINC000925727942 715979246 /nfs/dbraw/zinc/97/92/46/715979246.db2.gz CCJWEHOELLVUER-UONOGXRCSA-N 1 3 330.398 2.660 10 0 EFAEHO FC(F)(F)c1ccn(CC[NH2+][C@@H]2CCNC[C@H]2C2CCCC2)n1 ZINC000925727942 715979250 /nfs/dbraw/zinc/97/92/50/715979250.db2.gz CCJWEHOELLVUER-UONOGXRCSA-N 1 3 330.398 2.660 10 0 EFAEHO COc1ccc([C@@H](C)[NH2+]C[C@@H]2CNCCC2(F)F)c(C)c1OC ZINC000925777433 717622748 /nfs/dbraw/zinc/62/27/48/717622748.db2.gz OXXVOWHPDAKBJS-OLZOCXBDSA-N 1 3 328.403 2.908 10 0 EFAEHO CC[C@H]([NH2+]C[C@@H]1CNCCC1(F)F)c1ccc(C(=O)OC)cc1 ZINC000925779605 717678391 /nfs/dbraw/zinc/67/83/91/717678391.db2.gz YMMDJDYLHOWOSQ-GJZGRUSLSA-N 1 3 326.387 2.759 10 0 EFAEHO CCOC(=O)C1([C@@H](C)NCc2cscc2Cl)CC[NH2+]CC1 ZINC000925769861 717888441 /nfs/dbraw/zinc/88/84/41/717888441.db2.gz GJWQUXBWZUHVSH-LLVKDONJSA-N 1 3 330.881 2.813 10 0 EFAEHO c1ccc(CC[NH+]2CCC(NCCOc3cccnc3)CC2)cc1 ZINC000169019385 718828867 /nfs/dbraw/zinc/82/88/67/718828867.db2.gz AYOGEVIXEVJDLX-UHFFFAOYSA-N 1 3 325.456 2.757 10 0 EFAEHO CN1C[C@H]2CC[C@@H](C1)C2[NH2+]C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000924897738 721277022 /nfs/dbraw/zinc/27/70/22/721277022.db2.gz SGHSPFQVLWKWPF-PMRDEQMMSA-N 1 3 337.508 2.563 10 0 EFAEHO CC(C)N1CCC[C@@H](C[NH2+]CC2CN(C(=O)OC(C)(C)C)C2)C1 ZINC000894241475 721401997 /nfs/dbraw/zinc/40/19/97/721401997.db2.gz IUROYXPKTPHYLJ-HNNXBMFYSA-N 1 3 325.497 2.563 10 0 EFAEHO CCc1[nH]c(CNCc2cccc(C[NH+](C)C)c2)cc1C(=O)OC ZINC000894385928 722677180 /nfs/dbraw/zinc/67/71/80/722677180.db2.gz XNTGNJZVYKYXLU-UHFFFAOYSA-N 1 3 329.444 2.715 10 0 EFAEHO CC[C@@H](C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C(=O)OC ZINC000895138066 723431094 /nfs/dbraw/zinc/43/10/94/723431094.db2.gz BRGUNSXKLBQHPD-OKYOBFRVSA-N 1 3 330.472 2.828 10 0 EFAEHO CC[C@H](C[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C(=O)OC ZINC000895138067 723431203 /nfs/dbraw/zinc/43/12/03/723431203.db2.gz BRGUNSXKLBQHPD-RDGPPVDQSA-N 1 3 330.472 2.828 10 0 EFAEHO C[C@H](CN(C)C)[C@@H]1CCCC[N@@H+]1Cc1cccn(C(F)F)c1=O ZINC000895378551 724089006 /nfs/dbraw/zinc/08/90/06/724089006.db2.gz IPJDSOUGJNVNIC-HIFRSBDPSA-N 1 3 327.419 2.796 10 0 EFAEHO C[C@H](CN(C)C)[C@@H]1CCCC[N@H+]1Cc1cccn(C(F)F)c1=O ZINC000895378551 724089008 /nfs/dbraw/zinc/08/90/08/724089008.db2.gz IPJDSOUGJNVNIC-HIFRSBDPSA-N 1 3 327.419 2.796 10 0 EFAEHO COc1ccc(C2=NO[C@@H](C[NH2+][C@@H]3CCN(C)C(C)(C)C3)C2)cc1F ZINC000895505207 724164869 /nfs/dbraw/zinc/16/48/69/724164869.db2.gz PAUWFYZKIQRUBQ-HUUCEWRRSA-N 1 3 349.450 2.790 10 0 EFAEHO COc1ccc(C2=NO[C@H](C[NH2+][C@@H]3CCN(C)C(C)(C)C3)C2)cc1 ZINC000895497352 724168909 /nfs/dbraw/zinc/16/89/09/724168909.db2.gz HWAHTSFKWHRJJF-WBVHZDCISA-N 1 3 331.460 2.651 10 0 EFAEHO Cc1cc(CN2CCN(c3cc[nH+]cc3)[C@H](C)C2)ccc1-n1cncn1 ZINC000895555705 724193937 /nfs/dbraw/zinc/19/39/37/724193937.db2.gz AQSJBRKPKXDDGB-QGZVFWFLSA-N 1 3 348.454 2.681 10 0 EFAEHO CN1C[C@H]2CC[C@@H](C1)C2[NH2+]CCC1CCN(CC(F)(F)F)CC1 ZINC000925224332 724911164 /nfs/dbraw/zinc/91/11/64/724911164.db2.gz ZBJVKXOUEMIKHJ-XYPWUTKMSA-N 1 3 333.442 2.581 10 0 EFAEHO C[C@H]1[C@@H](NC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)CCN1C ZINC000913949140 725964405 /nfs/dbraw/zinc/96/44/05/725964405.db2.gz DFCRNKSHPSIOAU-LPHOPBHVSA-N 1 3 344.503 2.564 10 0 EFAEHO C[N@@H+]1CCC[C@@]2(CCN(C(=O)c3ccc(NC4=NCCC4)cc3)C2)C1 ZINC000908423830 727183337 /nfs/dbraw/zinc/18/33/37/727183337.db2.gz SWIXPLQTJKSCPT-HXUWFJFHSA-N 1 3 340.471 2.849 10 0 EFAEHO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3ccc(NC4=NCCC4)cc3)C2)C1 ZINC000908423830 727183339 /nfs/dbraw/zinc/18/33/39/727183339.db2.gz SWIXPLQTJKSCPT-HXUWFJFHSA-N 1 3 340.471 2.849 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC000909919679 727393604 /nfs/dbraw/zinc/39/36/04/727393604.db2.gz YYVJXAHRAZCEPS-DLBZAZTESA-N 1 3 335.517 2.655 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC000909919679 727393606 /nfs/dbraw/zinc/39/36/06/727393606.db2.gz YYVJXAHRAZCEPS-DLBZAZTESA-N 1 3 335.517 2.655 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC000909919680 727393623 /nfs/dbraw/zinc/39/36/23/727393623.db2.gz YYVJXAHRAZCEPS-IAGOWNOFSA-N 1 3 335.517 2.655 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC000909919680 727393624 /nfs/dbraw/zinc/39/36/24/727393624.db2.gz YYVJXAHRAZCEPS-IAGOWNOFSA-N 1 3 335.517 2.655 10 0 EFAEHO CC[N@@H+]1CCCN(C(=O)c2ccc(NC3=NCCC3)cc2)[C@H](C)C1 ZINC000910267562 727425319 /nfs/dbraw/zinc/42/53/19/727425319.db2.gz RWKRPSUTGAVXAI-OAHLLOKOSA-N 1 3 328.460 2.847 10 0 EFAEHO CC[N@H+]1CCCN(C(=O)c2ccc(NC3=NCCC3)cc2)[C@H](C)C1 ZINC000910267562 727425320 /nfs/dbraw/zinc/42/53/20/727425320.db2.gz RWKRPSUTGAVXAI-OAHLLOKOSA-N 1 3 328.460 2.847 10 0 EFAEHO C[NH+]1C[C@]2(C)CN(C(=O)c3cccc(CN4CCCC4)c3)C[C@@]2(C)C1 ZINC000913290091 727817254 /nfs/dbraw/zinc/81/72/54/727817254.db2.gz OGPJWQZOTRLVCF-NHCUHLMSSA-N 1 3 341.499 2.696 10 0 EFAEHO COC(=O)Cc1ccccc1CN1CCC(C[NH+]2CCCC2)CC1 ZINC000154989902 729034841 /nfs/dbraw/zinc/03/48/41/729034841.db2.gz QAFKRHXERMOHLV-UHFFFAOYSA-N 1 3 330.472 2.710 10 0 EFAEHO CC1(C)C[C@@H](NCc2cccc(CN3CCOCC3)c2)C[C@@H]([NH3+])C1 ZINC000925478106 729148586 /nfs/dbraw/zinc/14/85/86/729148586.db2.gz SVASNDOSNCLEIZ-MOPGFXCFSA-N 1 3 331.504 2.514 10 0 EFAEHO CN(C[C@@H]1CCCCN1Cc1ccccc1)C(=O)C12CC[NH+](CC1)C2 ZINC000920578196 729204191 /nfs/dbraw/zinc/20/41/91/729204191.db2.gz ROKZZMYUUTVCLX-IBGZPJMESA-N 1 3 341.499 2.595 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@@H]3C[C@@H]4CCCC[C@H]34)CC2)CC1 ZINC000921379907 729301566 /nfs/dbraw/zinc/30/15/66/729301566.db2.gz VOFGCGJHUPMKSO-YSIASYRMSA-N 1 3 347.547 2.878 10 0 EFAEHO C[NH+](C)CCCCC(=O)NCC1(N[C@H]2CCc3ccc(F)cc32)CC1 ZINC001569426411 1085197735 /nfs/dbraw/zinc/19/77/35/1085197735.db2.gz PWKZKTRIQLHEFP-SFHVURJKSA-N 1 3 347.478 2.783 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H]2C[NH2+]CCCc2ccccc2)C1 ZINC001569554910 1085370691 /nfs/dbraw/zinc/37/06/91/1085370691.db2.gz CVCGINIALNCXDX-UYAOXDASSA-N 1 3 343.515 2.542 10 0 EFAEHO CC(C)(C(=O)N[C@H](C[NH2+]C/C=C/Cl)C1CCCC1)N1CCCC1 ZINC001569607981 1085434831 /nfs/dbraw/zinc/43/48/31/1085434831.db2.gz YIWASCYTNDICQW-OJXHRBAXSA-N 1 3 341.927 2.878 10 0 EFAEHO C[C@@H]([NH2+]CCC1=CCCCC1)[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001569824085 1085643241 /nfs/dbraw/zinc/64/32/41/1085643241.db2.gz NBLLHJQQTPGAEN-IEBWSBKVSA-N 1 3 333.520 2.799 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]CCc2ccc(C)cc2)C1 ZINC001569853302 1085676670 /nfs/dbraw/zinc/67/66/70/1085676670.db2.gz PAMYWKWWHNMATB-AZUAARDMSA-N 1 3 345.531 2.563 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@H]2CN(C(=O)[C@@H]3CCCCN3CC)C[C@H]2C1 ZINC001569883780 1085716972 /nfs/dbraw/zinc/71/69/72/1085716972.db2.gz ILJDVRSZSVOKQK-GPXQEHKYSA-N 1 3 333.520 2.607 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3CCCCN3CC)C[C@H]2C1 ZINC001569883780 1085716976 /nfs/dbraw/zinc/71/69/76/1085716976.db2.gz ILJDVRSZSVOKQK-GPXQEHKYSA-N 1 3 333.520 2.607 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H]2[C@H]1CC[N@@H+]2CCCCCF)N(C)C ZINC001569912192 1085752678 /nfs/dbraw/zinc/75/26/78/1085752678.db2.gz GARLRKBJJBZBLT-RCCFBDPRSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H]2[C@H]1CC[N@H+]2CCCCCF)N(C)C ZINC001569912192 1085752694 /nfs/dbraw/zinc/75/26/94/1085752694.db2.gz GARLRKBJJBZBLT-RCCFBDPRSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](CC[NH2+]CC2CCCCC2)C1)N(C)C ZINC001570000335 1085841289 /nfs/dbraw/zinc/84/12/89/1085841289.db2.gz LBFNGLOKAYMAFL-RBUKOAKNSA-N 1 3 337.552 2.981 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CC[C@@H](CC[NH2+]CCC2CCCCC2)C1 ZINC001570006575 1085849827 /nfs/dbraw/zinc/84/98/27/1085849827.db2.gz ZRHPQTSNKPTXDF-QGZVFWFLSA-N 1 3 332.492 2.751 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CC[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001570018386 1085865959 /nfs/dbraw/zinc/86/59/59/1085865959.db2.gz DGKSXOVKKHPPLB-KRWDZBQOSA-N 1 3 347.478 2.558 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]CC2=CCCCC2)CCC1 ZINC001570127471 1085967416 /nfs/dbraw/zinc/96/74/16/1085967416.db2.gz HMIWTWUYIBPOPP-IAGOWNOFSA-N 1 3 333.520 2.988 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)CN(C)C1CCC1)C2 ZINC001570272952 1086111690 /nfs/dbraw/zinc/11/16/90/1086111690.db2.gz JOZBSFGDRMTTPS-HXUWFJFHSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCC[N@H+]1CC[C@@]2(C1)CCCN(C(=O)CN(C)C1CCC1)C2 ZINC001570272952 1086111693 /nfs/dbraw/zinc/11/16/93/1086111693.db2.gz JOZBSFGDRMTTPS-HXUWFJFHSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCC[N@@H+]1CCCC2(CN(C(=O)[C@H]3CCCCN3CC)C2)C1 ZINC001571049489 1086654637 /nfs/dbraw/zinc/65/46/37/1086654637.db2.gz UWJOXMXEAUQEEO-GOSISDBHSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCC[N@H+]1CCCC2(CN(C(=O)[C@H]3CCCCN3CC)C2)C1 ZINC001571049489 1086654642 /nfs/dbraw/zinc/65/46/42/1086654642.db2.gz UWJOXMXEAUQEEO-GOSISDBHSA-N 1 3 335.536 2.975 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CCCC2CCC2)C1 ZINC001571197635 1086675394 /nfs/dbraw/zinc/67/53/94/1086675394.db2.gz HCSWBRNBYWHJBF-FHWLQOOXSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H]2CC[C@H](C[NH2+]CCCF)C2)c1 ZINC001571550829 1086954337 /nfs/dbraw/zinc/95/43/37/1086954337.db2.gz VBQWZJJVJGVNRR-MAUKXSAKSA-N 1 3 335.467 2.596 10 0 EFAEHO CCCCCC[NH2+][C@H]1CN(C(=O)[C@@H](C(C)C)N(C)C)CC1(C)C ZINC001571563112 1086963810 /nfs/dbraw/zinc/96/38/10/1086963810.db2.gz CLIAJKPDDDZWEZ-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccc(CN2CC=C(CNC(=O)C[C@@H]3CC[N@@H+](C)C3)CC2)cc1 ZINC001571698962 1087069219 /nfs/dbraw/zinc/06/92/19/1087069219.db2.gz YRBXLMAEZGMXJY-FQEVSTJZSA-N 1 3 341.499 2.585 10 0 EFAEHO Cc1ccc(CN2CC=C(CNC(=O)C[C@@H]3CC[N@H+](C)C3)CC2)cc1 ZINC001571698962 1087069225 /nfs/dbraw/zinc/06/92/25/1087069225.db2.gz YRBXLMAEZGMXJY-FQEVSTJZSA-N 1 3 341.499 2.585 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@H](C(=O)N(CCN(C)C)Cc3ccsc3)C[N@@H+]2C1 ZINC001646974723 1088692830 /nfs/dbraw/zinc/69/28/30/1088692830.db2.gz PESFLDQRSREBQT-BPQIPLTHSA-N 1 3 349.544 2.759 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@H](C(=O)N(CCN(C)C)Cc3ccsc3)C[N@H+]2C1 ZINC001646974723 1088692835 /nfs/dbraw/zinc/69/28/35/1088692835.db2.gz PESFLDQRSREBQT-BPQIPLTHSA-N 1 3 349.544 2.759 10 0 EFAEHO CC(C)CCC[NH2+][C@@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001266970584 1092217651 /nfs/dbraw/zinc/21/76/51/1092217651.db2.gz FLAZODPQFCVQLT-YJBOKZPZSA-N 1 3 329.504 2.729 10 0 EFAEHO Cc1cc(CNCCN(C)C(=O)[C@@H]2CCC[C@H]([NH+](C)C)C2)cs1 ZINC001266979709 1092232703 /nfs/dbraw/zinc/23/27/03/1092232703.db2.gz IKVRAJRRRCIPPD-SJORKVTESA-N 1 3 337.533 2.725 10 0 EFAEHO CN(CCNC(=O)CCC[NH+](C)C)Cc1cc2ccccc2s1 ZINC001480908096 1092233575 /nfs/dbraw/zinc/23/35/75/1092233575.db2.gz QPGKIXKXIJBDQE-UHFFFAOYSA-N 1 3 333.501 2.791 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H]([NH2+]CCCc2ccccc2Cl)C1 ZINC001267006403 1092311798 /nfs/dbraw/zinc/31/17/98/1092311798.db2.gz JTAHNZXCCVXWNG-WMZOPIPTSA-N 1 3 349.906 2.557 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@H]([NH2+]CCCCC(F)(F)F)C1 ZINC001267026549 1092397672 /nfs/dbraw/zinc/39/76/72/1092397672.db2.gz PPALERBMIYRJML-GJZGRUSLSA-N 1 3 349.441 2.784 10 0 EFAEHO C[C@H](CCNC/C(Cl)=C\Cl)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001649450924 1092478197 /nfs/dbraw/zinc/47/81/97/1092478197.db2.gz PONALZOCRJNLLG-GMCKNXKJSA-N 1 3 336.307 2.664 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](C[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001267067276 1092525743 /nfs/dbraw/zinc/52/57/43/1092525743.db2.gz OUZQFGIMCOJOES-SJORKVTESA-N 1 3 325.541 2.837 10 0 EFAEHO CN(CC(=O)N1CCC(C(C)(C)C[NH+](C)C)CC1)CC(C)(C)C ZINC001650021346 1092884906 /nfs/dbraw/zinc/88/49/06/1092884906.db2.gz DTZVICTYSIMQOO-UHFFFAOYSA-N 1 3 325.541 2.791 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001267173594 1093063093 /nfs/dbraw/zinc/06/30/93/1093063093.db2.gz AWWVFZCMXWIKDB-MAUKXSAKSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001267173594 1093063104 /nfs/dbraw/zinc/06/31/04/1093063104.db2.gz AWWVFZCMXWIKDB-MAUKXSAKSA-N 1 3 327.488 2.580 10 0 EFAEHO CCC[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC[C@@H](C)F ZINC001493318265 1094449785 /nfs/dbraw/zinc/44/97/85/1094449785.db2.gz ORTHZNKWLLULPN-QAPCUYQASA-N 1 3 347.494 2.775 10 0 EFAEHO CCC[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC[C@@H](C)F ZINC001493318265 1094449791 /nfs/dbraw/zinc/44/97/91/1094449791.db2.gz ORTHZNKWLLULPN-QAPCUYQASA-N 1 3 347.494 2.775 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@H+](CCc2cccs2)C1)N1CCCC1 ZINC001481102988 1094519200 /nfs/dbraw/zinc/51/92/00/1094519200.db2.gz QJYUVQGADPROIK-MRXNPFEDSA-N 1 3 349.544 2.603 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@@H+](CCc2cccs2)C1)N1CCCC1 ZINC001481102988 1094519204 /nfs/dbraw/zinc/51/92/04/1094519204.db2.gz QJYUVQGADPROIK-MRXNPFEDSA-N 1 3 349.544 2.603 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@H+](CCc2cccs2)C1)N1CCCC1 ZINC001481102987 1094519905 /nfs/dbraw/zinc/51/99/05/1094519905.db2.gz QJYUVQGADPROIK-INIZCTEOSA-N 1 3 349.544 2.603 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@@H+](CCc2cccs2)C1)N1CCCC1 ZINC001481102987 1094519907 /nfs/dbraw/zinc/51/99/07/1094519907.db2.gz QJYUVQGADPROIK-INIZCTEOSA-N 1 3 349.544 2.603 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[NH2+]Cc1ccc(C(C)(C)C)cc1)N(C)C ZINC001267430355 1094521744 /nfs/dbraw/zinc/52/17/44/1094521744.db2.gz ONEGWLJYHMJIDY-SFHVURJKSA-N 1 3 333.520 2.872 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)N1C[C@H]2CC[C@@H](C1)N2CCCCCF ZINC001267437499 1094527663 /nfs/dbraw/zinc/52/76/63/1094527663.db2.gz ZESASZNCQFBWAA-HDICACEKSA-N 1 3 339.499 2.677 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CCN(C)C(=O)CN1CCC(C)CC1 ZINC001267444511 1094535069 /nfs/dbraw/zinc/53/50/69/1094535069.db2.gz HAXDPHUMZCYEID-UHFFFAOYSA-N 1 3 331.504 2.583 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@H+](Cc2ccccc2C2CC2)C1)N(C)C ZINC001481119098 1094735148 /nfs/dbraw/zinc/73/51/48/1094735148.db2.gz QYIGOSPDNBUAGZ-OXQOHEQNSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2C2CC2)C1)N(C)C ZINC001481119098 1094735160 /nfs/dbraw/zinc/73/51/60/1094735160.db2.gz QYIGOSPDNBUAGZ-OXQOHEQNSA-N 1 3 343.515 2.842 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]CCCCC(F)(F)F ZINC001267473071 1094761485 /nfs/dbraw/zinc/76/14/85/1094761485.db2.gz AHECYANBGMSRST-CQSZACIVSA-N 1 3 337.430 2.641 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+](CC/C=C\c2ccccc2)C1 ZINC001481125252 1094834163 /nfs/dbraw/zinc/83/41/63/1094834163.db2.gz BSNGRFFOXZSBKX-RVPHRTOXSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+](CC/C=C\c2ccccc2)C1 ZINC001481125252 1094834179 /nfs/dbraw/zinc/83/41/79/1094834179.db2.gz BSNGRFFOXZSBKX-RVPHRTOXSA-N 1 3 343.515 2.868 10 0 EFAEHO CCCN(CCNC(=O)[C@H]1C[NH+]2CCC1CC2)Cc1csc(C)c1 ZINC001481137024 1094935249 /nfs/dbraw/zinc/93/52/49/1094935249.db2.gz ZBIAEFORENAHCU-SFHVURJKSA-N 1 3 349.544 2.727 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1CC[C@H](C)C1)CC1CCC(C)CC1 ZINC001481147681 1094977825 /nfs/dbraw/zinc/97/78/25/1094977825.db2.gz JEWPTHRZERJSGU-XBMUEBEBSA-N 1 3 337.552 2.983 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1CC[C@H](C)C1)CC1CCC(C)CC1 ZINC001481147681 1094977831 /nfs/dbraw/zinc/97/78/31/1094977831.db2.gz JEWPTHRZERJSGU-XBMUEBEBSA-N 1 3 337.552 2.983 10 0 EFAEHO CN(CC(=O)N1CCC(C[N@H+](C)CCC2CC2)CC1)CC(C)(C)C ZINC001481518480 1095075155 /nfs/dbraw/zinc/07/51/55/1095075155.db2.gz VYDTZJMPMDXBHH-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO CN(CC(=O)N1CCC(C[N@@H+](C)CCC2CC2)CC1)CC(C)(C)C ZINC001481518480 1095075169 /nfs/dbraw/zinc/07/51/69/1095075169.db2.gz VYDTZJMPMDXBHH-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](Cc1ccc(C)cc1)C(C)C ZINC001267510735 1095134416 /nfs/dbraw/zinc/13/44/16/1095134416.db2.gz ADCUCXPEIZCVQB-UHFFFAOYSA-N 1 3 342.487 2.986 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](Cc1ccc(C)cc1)C(C)C ZINC001267510735 1095134422 /nfs/dbraw/zinc/13/44/22/1095134422.db2.gz ADCUCXPEIZCVQB-UHFFFAOYSA-N 1 3 342.487 2.986 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)N1C[C@H]2CC[C@@H](C1)N2CCCCCF ZINC001267537586 1095397868 /nfs/dbraw/zinc/39/78/68/1095397868.db2.gz JJRDTMCAIKURGR-HDICACEKSA-N 1 3 339.499 2.677 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[N@H+](C)CCC2=CCCCC2)C1 ZINC001267702136 1095531829 /nfs/dbraw/zinc/53/18/29/1095531829.db2.gz CQLLLFBMBLECGS-LJQANCHMSA-N 1 3 335.536 2.999 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[N@@H+](C)CCC2=CCCCC2)C1 ZINC001267702136 1095531834 /nfs/dbraw/zinc/53/18/34/1095531834.db2.gz CQLLLFBMBLECGS-LJQANCHMSA-N 1 3 335.536 2.999 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]CCc1cccs1 ZINC001268151459 1095537749 /nfs/dbraw/zinc/53/77/49/1095537749.db2.gz PTMUWIBGEJZRMZ-SJLPKXTDSA-N 1 3 349.544 2.746 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@H]1CC[NH2+]CCc1cccs1 ZINC001268151458 1095538761 /nfs/dbraw/zinc/53/87/61/1095538761.db2.gz PTMUWIBGEJZRMZ-FUHWJXTLSA-N 1 3 349.544 2.746 10 0 EFAEHO CCC/C=C\CCN1C[C@@H]2C[C@H]1CN2C(=O)CC1CC[NH+](C)CC1 ZINC001267712476 1095585652 /nfs/dbraw/zinc/58/56/52/1095585652.db2.gz ANBZANAOGRTKDO-DSQZMVHQSA-N 1 3 333.520 2.750 10 0 EFAEHO CCC/C=C/CCN1C[C@@H]2C[C@H]1CN2C(=O)CC1CC[NH+](C)CC1 ZINC001267712483 1095585846 /nfs/dbraw/zinc/58/58/46/1095585846.db2.gz ANBZANAOGRTKDO-WLMAVBAVSA-N 1 3 333.520 2.750 10 0 EFAEHO CN(CC[NH2+]Cc1ccc(C2CCC2)cc1)C(=O)[C@@H]1CCCN1C ZINC001481214793 1095674327 /nfs/dbraw/zinc/67/43/27/1095674327.db2.gz AOXCVIFIFDLEJD-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CCCCC[N@H+](CC)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001481000870 1095731931 /nfs/dbraw/zinc/73/19/31/1095731931.db2.gz JFOKXQYFGVVFKJ-GOSISDBHSA-N 1 3 329.504 2.827 10 0 EFAEHO CCCCC[N@@H+](CC)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001481000870 1095731945 /nfs/dbraw/zinc/73/19/45/1095731945.db2.gz JFOKXQYFGVVFKJ-GOSISDBHSA-N 1 3 329.504 2.827 10 0 EFAEHO O=C(CN1CCCC1)N1CCCC[C@H]1CC[NH2+]Cc1ccccc1F ZINC001268166950 1095778431 /nfs/dbraw/zinc/77/84/31/1095778431.db2.gz WEHJBSXLKMTSLP-SFHVURJKSA-N 1 3 347.478 2.782 10 0 EFAEHO Cc1cc(C)cc(CN2CC(CNC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001481630644 1096013408 /nfs/dbraw/zinc/01/34/08/1096013408.db2.gz MOYHITSUBMXYMC-FQEVSTJZSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1cc(C)cc(CN2CC(CNC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001481630644 1096013419 /nfs/dbraw/zinc/01/34/19/1096013419.db2.gz MOYHITSUBMXYMC-FQEVSTJZSA-N 1 3 343.515 2.726 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N(C)CCN(C)CC1=CCCCC1 ZINC001268242939 1096167438 /nfs/dbraw/zinc/16/74/38/1096167438.db2.gz RQXXJPQPARTHLD-LJQANCHMSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N(C)CCN(C)CC1=CCCCC1 ZINC001268242939 1096167444 /nfs/dbraw/zinc/16/74/44/1096167444.db2.gz RQXXJPQPARTHLD-LJQANCHMSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)=CCN(C)CCN(C)C(=O)c1ccccc1CC[NH+](C)C ZINC001268243364 1096168390 /nfs/dbraw/zinc/16/83/90/1096168390.db2.gz JTCBEXSHCKNNKE-UHFFFAOYSA-N 1 3 331.504 2.761 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H]3[C@H](CC[N@@H+]3CCCCCF)C2)CCC1 ZINC001268265949 1096213216 /nfs/dbraw/zinc/21/32/16/1096213216.db2.gz YFMXMAMYFQFRNS-SJORKVTESA-N 1 3 339.499 2.533 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3CCCCCF)C2)CCC1 ZINC001268265949 1096213220 /nfs/dbraw/zinc/21/32/20/1096213220.db2.gz YFMXMAMYFQFRNS-SJORKVTESA-N 1 3 339.499 2.533 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H]3[C@@H](CC[N@@H+]3CCCCCF)C2)CCC1 ZINC001268265939 1096213602 /nfs/dbraw/zinc/21/36/02/1096213602.db2.gz YFMXMAMYFQFRNS-DLBZAZTESA-N 1 3 339.499 2.533 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3CCCCCF)C2)CCC1 ZINC001268265939 1096213608 /nfs/dbraw/zinc/21/36/08/1096213608.db2.gz YFMXMAMYFQFRNS-DLBZAZTESA-N 1 3 339.499 2.533 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]CCCC1CCC1 ZINC001268291743 1096272481 /nfs/dbraw/zinc/27/24/81/1096272481.db2.gz NLIZADYGLOVLSD-IAGOWNOFSA-N 1 3 332.492 2.715 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@@H]2C[C@H]1CN2CC1CC2(CCC2)C1 ZINC001481681774 1096296715 /nfs/dbraw/zinc/29/67/15/1096296715.db2.gz PXAGKURCDGHVRW-ROUUACIJSA-N 1 3 333.520 2.584 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@@H]2C[C@H]1CN2CC1CC2(CCC2)C1 ZINC001481681774 1096296725 /nfs/dbraw/zinc/29/67/25/1096296725.db2.gz PXAGKURCDGHVRW-ROUUACIJSA-N 1 3 333.520 2.584 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccc2c(c1)CCC2)NC(=O)CN1CC[C@@H](C)C1 ZINC001268399875 1096493722 /nfs/dbraw/zinc/49/37/22/1096493722.db2.gz NDFRYHQCPIUYJO-SJORKVTESA-N 1 3 343.515 2.502 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccccc1C1CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001268400168 1096493962 /nfs/dbraw/zinc/49/39/62/1096493962.db2.gz SBTMEULIMWVKMH-IRXDYDNUSA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccc2c(c1)CCC2)NC(=O)CN1CC[C@H](C)C1 ZINC001268399874 1096494320 /nfs/dbraw/zinc/49/43/20/1096494320.db2.gz NDFRYHQCPIUYJO-IRXDYDNUSA-N 1 3 343.515 2.502 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)[NH+]1CCCC1 ZINC001481753575 1096534088 /nfs/dbraw/zinc/53/40/88/1096534088.db2.gz WMYRIKLBHGQQHF-UXHICEINSA-N 1 3 343.515 2.840 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)[NH+]1CCCC1 ZINC001481753576 1096534327 /nfs/dbraw/zinc/53/43/27/1096534327.db2.gz WMYRIKLBHGQQHF-VQTJNVASSA-N 1 3 343.515 2.840 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001268426083 1096579368 /nfs/dbraw/zinc/57/93/68/1096579368.db2.gz JSTLEZYLHZLDSA-ZDUSSCGKSA-N 1 3 343.874 2.804 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1cccc(C)c1 ZINC001268425144 1096583637 /nfs/dbraw/zinc/58/36/37/1096583637.db2.gz CNCRFQZUNPLUPE-PKOBYXMFSA-N 1 3 331.504 2.854 10 0 EFAEHO CCN(C(=O)[C@@H]1CCCN1C(C)C)[C@@H]1CC[N@H+](CCCCCF)C1 ZINC001481766584 1096642376 /nfs/dbraw/zinc/64/23/76/1096642376.db2.gz MIDQQQURTNSUDX-MSOLQXFVSA-N 1 3 341.515 2.922 10 0 EFAEHO CCN(C(=O)[C@@H]1CCCN1C(C)C)[C@@H]1CC[N@@H+](CCCCCF)C1 ZINC001481766584 1096642381 /nfs/dbraw/zinc/64/23/81/1096642381.db2.gz MIDQQQURTNSUDX-MSOLQXFVSA-N 1 3 341.515 2.922 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001481774499 1096673187 /nfs/dbraw/zinc/67/31/87/1096673187.db2.gz KZNCOZRGFNORCG-PKOBYXMFSA-N 1 3 347.547 2.831 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001481774499 1096673189 /nfs/dbraw/zinc/67/31/89/1096673189.db2.gz KZNCOZRGFNORCG-PKOBYXMFSA-N 1 3 347.547 2.831 10 0 EFAEHO CCN(CC[NH2+]CC[C@@H]1CCCC1(F)F)C(=O)C1(N(C)C)CCC1 ZINC001268454350 1096684642 /nfs/dbraw/zinc/68/46/42/1096684642.db2.gz RTEKZIITWILQST-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](CC)[NH2+]Cc1ccc(F)cc1C ZINC001481816757 1096732388 /nfs/dbraw/zinc/73/23/88/1096732388.db2.gz OWVNGIXXZWBECN-OALUTQOASA-N 1 3 349.494 2.993 10 0 EFAEHO CCN(CCNCc1ccc(C)c(F)c1)C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001268458705 1096736401 /nfs/dbraw/zinc/73/64/01/1096736401.db2.gz HZETYBXRCYBXFA-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO CCN(CCNCc1ccc(C)c(F)c1)C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001268458705 1096736408 /nfs/dbraw/zinc/73/64/08/1096736408.db2.gz HZETYBXRCYBXFA-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1c(C)cc(C)cc1C ZINC001481881987 1096851437 /nfs/dbraw/zinc/85/14/37/1096851437.db2.gz NOHUUPTXOWYBCM-SFHVURJKSA-N 1 3 333.520 2.936 10 0 EFAEHO CC[C@@H](C(=O)N(CC)CC[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001268476459 1096880981 /nfs/dbraw/zinc/88/09/81/1096880981.db2.gz DWMZSCDBSJRMDA-CABCVRRESA-N 1 3 333.467 2.590 10 0 EFAEHO CCN(CC[NH2+]CC1CCC(C)CC1)C(=O)[C@H](C(C)C)N(C)C ZINC001268492854 1096964159 /nfs/dbraw/zinc/96/41/59/1096964159.db2.gz BIRHHNGMDBCQCF-ABHNRTSZSA-N 1 3 325.541 2.837 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc(Cl)c1)C(=O)[C@@H](C(C)C)N(C)C ZINC001268493581 1096968816 /nfs/dbraw/zinc/96/88/16/1096968816.db2.gz QUFMYZMYUVSUBE-QGZVFWFLSA-N 1 3 339.911 2.864 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@](C)(CNCc1ccccc1Cl)C1CC1 ZINC001481939598 1096970151 /nfs/dbraw/zinc/97/01/51/1096970151.db2.gz ABQPYOTXLRSTTJ-GOSISDBHSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](CC[NH2+]Cc2ccc(F)cc2)C1)N(C)C ZINC001481981820 1097037057 /nfs/dbraw/zinc/03/70/57/1097037057.db2.gz ZJXZWCYCKJQZAR-IEBWSBKVSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](CC[NH2+]Cc2ccc(F)cc2)C1)N(C)C ZINC001481981821 1097037266 /nfs/dbraw/zinc/03/72/66/1097037266.db2.gz ZJXZWCYCKJQZAR-PKOBYXMFSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H](CC[NH2+]Cc2ccc(F)cc2)C1)N(C)C ZINC001481989415 1097054372 /nfs/dbraw/zinc/05/43/72/1097054372.db2.gz ZJXZWCYCKJQZAR-MJGOQNOKSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@H](F)C[NH2+]CC[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001481990542 1097055643 /nfs/dbraw/zinc/05/56/43/1097055643.db2.gz ZWWWZHMHMBYSBO-MSOLQXFVSA-N 1 3 341.515 2.685 10 0 EFAEHO CC[C@H](F)C[NH2+]CCC1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001482004166 1097078050 /nfs/dbraw/zinc/07/80/50/1097078050.db2.gz ONEPJKOXBCGGLS-KRWDZBQOSA-N 1 3 343.531 2.931 10 0 EFAEHO O=C(NC/C=C/CNC/C=C\Cl)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001268538875 1097145157 /nfs/dbraw/zinc/14/51/57/1097145157.db2.gz NVTVRBWDWQSTKE-UVWBIWNCSA-N 1 3 339.911 2.656 10 0 EFAEHO O=C(NC/C=C/CNC/C=C\Cl)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001268538875 1097145158 /nfs/dbraw/zinc/14/51/58/1097145158.db2.gz NVTVRBWDWQSTKE-UVWBIWNCSA-N 1 3 339.911 2.656 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H]1CCCN1C(=O)C(C)(C)N1CCCCC1 ZINC001482055836 1097193705 /nfs/dbraw/zinc/19/37/05/1097193705.db2.gz ISTIRBUFTCWJNX-HZPDHXFCSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@@H]1C[NH2+]CCCC(C)(C)C ZINC001279113197 1097209718 /nfs/dbraw/zinc/20/97/18/1097209718.db2.gz NBFRWOKXMSBXOH-SJORKVTESA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C/C[NH2+]Cc1ccc2ccccc2c1)N(C)C ZINC001268591891 1097314996 /nfs/dbraw/zinc/31/49/96/1097314996.db2.gz CVTMQRLXTKZGHO-DUIUGDAFSA-N 1 3 339.483 2.942 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C/CNC(=O)CC1CC[NH+](C)CC1 ZINC001268598957 1097442235 /nfs/dbraw/zinc/44/22/35/1097442235.db2.gz ZHQLHJNBWDOVLK-ONEGZZNKSA-N 1 3 347.478 2.628 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C\C[NH2+]Cc2ccc(Cl)cc2)CC1 ZINC001268606388 1097452385 /nfs/dbraw/zinc/45/23/85/1097452385.db2.gz DLLYIPUDADHGKS-IHWYPQMZSA-N 1 3 349.906 2.834 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)NC/C=C/CNCc2ccsc2)C1 ZINC001268612146 1097461351 /nfs/dbraw/zinc/46/13/51/1097461351.db2.gz DQXCWNRISZACHO-OAZXXZECSA-N 1 3 335.517 2.631 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NC/C=C\CNCc1ccc(Cl)cc1 ZINC001268628570 1097481873 /nfs/dbraw/zinc/48/18/73/1097481873.db2.gz OEGNZTXEBANAML-JGPFYOFESA-N 1 3 349.906 2.975 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@@H](C)NC(=O)[C@@H]1CCCCN1CC ZINC001268673601 1097528066 /nfs/dbraw/zinc/52/80/66/1097528066.db2.gz IKJMWDHSAMVQLY-XLIONFOSSA-N 1 3 345.531 2.760 10 0 EFAEHO C[C@H](C[N@H+](C)CCCCCF)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001268747699 1097594717 /nfs/dbraw/zinc/59/47/17/1097594717.db2.gz TXNFDCNTKWZWJF-CRAIPNDOSA-N 1 3 347.494 2.775 10 0 EFAEHO C[C@H](C[N@@H+](C)CCCCCF)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001268747699 1097594723 /nfs/dbraw/zinc/59/47/23/1097594723.db2.gz TXNFDCNTKWZWJF-CRAIPNDOSA-N 1 3 347.494 2.775 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]CCCN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001268797153 1097646418 /nfs/dbraw/zinc/64/64/18/1097646418.db2.gz GWEBEUAGVDAVHW-QGZVFWFLSA-N 1 3 331.504 2.978 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(F)cc1Cl)C(=O)[C@H]1CCCN1C ZINC001268811632 1097660219 /nfs/dbraw/zinc/66/02/19/1097660219.db2.gz OINRXQPBCKUGGZ-MRXNPFEDSA-N 1 3 341.858 2.511 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[NH2+]CC[C@H]2CCCC2(F)F)C1 ZINC001268847118 1097682594 /nfs/dbraw/zinc/68/25/94/1097682594.db2.gz CZBVKNQWAMPHBJ-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[NH2+]CC[C@@H]2CCCC2(F)F)C1 ZINC001268847116 1097682624 /nfs/dbraw/zinc/68/26/24/1097682624.db2.gz CZBVKNQWAMPHBJ-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[NH2+]CC[C@@H]2CCCC2(F)F)C1 ZINC001268847036 1097682695 /nfs/dbraw/zinc/68/26/95/1097682695.db2.gz CZBVKNQWAMPHBJ-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]Cc1ccc(Cl)cc1F)N(C)C ZINC001268852301 1097684619 /nfs/dbraw/zinc/68/46/19/1097684619.db2.gz JGVRTHONIMSZOW-INIZCTEOSA-N 1 3 343.874 2.757 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+][C@H]1CCc2ccc(F)cc21)N(C)C ZINC001268852252 1097684949 /nfs/dbraw/zinc/68/49/49/1097684949.db2.gz HHSABMBFVCBBOW-ROUUACIJSA-N 1 3 335.467 2.591 10 0 EFAEHO Cc1ccc(C[NH2+]CCCN(C)C(=O)CN2CCCC2)c(Cl)c1 ZINC001268950272 1097739664 /nfs/dbraw/zinc/73/96/64/1097739664.db2.gz QRIJWZOVJACRID-UHFFFAOYSA-N 1 3 337.895 2.682 10 0 EFAEHO CC[C@H]1CN(C(=O)CN2CCC(C)CC2)CC[C@@H]1[NH2+]CC=C(C)C ZINC001269183797 1097929035 /nfs/dbraw/zinc/92/90/35/1097929035.db2.gz VZGRSRTYLQFVDX-OALUTQOASA-N 1 3 335.536 2.901 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN2CCC(C)CC2)CC[C@H]1[NH2+]CC=C(C)C ZINC001269183799 1097929116 /nfs/dbraw/zinc/92/91/16/1097929116.db2.gz VZGRSRTYLQFVDX-RTBURBONSA-N 1 3 335.536 2.901 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC[C@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269693394 1098373494 /nfs/dbraw/zinc/37/34/94/1098373494.db2.gz UOZMATUORAYGHV-KDCRJJDASA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC[C@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269693394 1098373501 /nfs/dbraw/zinc/37/35/01/1098373501.db2.gz UOZMATUORAYGHV-KDCRJJDASA-N 1 3 335.536 2.997 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001269740368 1098413376 /nfs/dbraw/zinc/41/33/76/1098413376.db2.gz DYPBTZJQEFFRMI-QUCCMNQESA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCCC[N@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001269740368 1098413380 /nfs/dbraw/zinc/41/33/80/1098413380.db2.gz DYPBTZJQEFFRMI-QUCCMNQESA-N 1 3 335.536 2.833 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@@H](CC[NH2+]CCCC2CCC2)C1 ZINC001269771181 1098436914 /nfs/dbraw/zinc/43/69/14/1098436914.db2.gz YTRHKJIZWQTANU-KRWDZBQOSA-N 1 3 332.492 2.751 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C[NH2+]CCC(F)(F)F)C(C)(C)C)N(C)C ZINC001284643309 1098463591 /nfs/dbraw/zinc/46/35/91/1098463591.db2.gz LRKHUZAKHOAOOA-STQMWFEESA-N 1 3 339.446 2.646 10 0 EFAEHO CC[C@H](C(=O)NCc1ccc(C[NH2+]CCC(F)(F)F)cc1)N(C)C ZINC001270065797 1098655366 /nfs/dbraw/zinc/65/53/66/1098655366.db2.gz YBFDAVBKEPNHAP-OAHLLOKOSA-N 1 3 345.409 2.685 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[NH2+]CCCc1cccc(F)c1)N(C)C ZINC001270074769 1098664620 /nfs/dbraw/zinc/66/46/20/1098664620.db2.gz FORBJUXXJNBBJQ-RBUKOAKNSA-N 1 3 349.494 2.679 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H]1C[NH2+]CCCc1ccsc1)N(C)C ZINC001270293628 1098921028 /nfs/dbraw/zinc/92/10/28/1098921028.db2.gz YOLPPHQDEYBDOK-SJORKVTESA-N 1 3 337.533 2.602 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H]1C[NH2+]CCCc1cccc(F)c1)N(C)C ZINC001267969117 1098985202 /nfs/dbraw/zinc/98/52/02/1098985202.db2.gz FORBJUXXJNBBJQ-MOPGFXCFSA-N 1 3 349.494 2.679 10 0 EFAEHO CN1CCC[C@H]1CC[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 ZINC000709486988 1099005718 /nfs/dbraw/zinc/00/57/18/1099005718.db2.gz PEUIPQGZZFVRDT-QAETUUGQSA-N 1 3 337.508 2.848 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001481290538 1099021816 /nfs/dbraw/zinc/02/18/16/1099021816.db2.gz LWZYRFZNNBMCER-RBUKOAKNSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@H]1CCC[C@H]2CCC[N@H+]21 ZINC001481290538 1099021826 /nfs/dbraw/zinc/02/18/26/1099021826.db2.gz LWZYRFZNNBMCER-RBUKOAKNSA-N 1 3 347.478 2.699 10 0 EFAEHO CN(CCNCc1ccsc1)C(=O)c1ccc(C[NH+](C)C)cc1 ZINC001481292679 1099086145 /nfs/dbraw/zinc/08/61/45/1099086145.db2.gz SLOYXLLKCOSJHG-UHFFFAOYSA-N 1 3 331.485 2.672 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001268002745 1099140097 /nfs/dbraw/zinc/14/00/97/1099140097.db2.gz DNIZQUHFZPJCDM-MAUKXSAKSA-N 1 3 327.488 2.507 10 0 EFAEHO C[C@@H](CNC(=O)c1cccc(CN(C)C)c1)C[NH2+]CCC(F)(F)F ZINC001268015532 1099186473 /nfs/dbraw/zinc/18/64/73/1099186473.db2.gz OTGUPZRTNAOZPS-CYBMUJFWSA-N 1 3 345.409 2.656 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]Cc1cc(C)cc(C)c1 ZINC001481319847 1099277066 /nfs/dbraw/zinc/27/70/66/1099277066.db2.gz PPTSOLFEJICYEJ-LJQANCHMSA-N 1 3 331.504 2.726 10 0 EFAEHO CCCC[NH2+][C@H](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001481341376 1099377946 /nfs/dbraw/zinc/37/79/46/1099377946.db2.gz HAKLZOAMOXQGAC-MRXNPFEDSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccccc1F ZINC001481271457 1099415227 /nfs/dbraw/zinc/41/52/27/1099415227.db2.gz DDUIMLIKLBTRCB-XHSDSOJGSA-N 1 3 335.467 2.665 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccccc1F ZINC001481271457 1099415232 /nfs/dbraw/zinc/41/52/32/1099415232.db2.gz DDUIMLIKLBTRCB-XHSDSOJGSA-N 1 3 335.467 2.665 10 0 EFAEHO C[C@@H](C[NH2+]C/C=C\c1ccc(Cl)cc1)N(C)C(=O)[C@H]1CCCN1C ZINC001482318949 1099479314 /nfs/dbraw/zinc/47/93/14/1099479314.db2.gz HUBHSZYAYXYZIP-CTQQLDRNSA-N 1 3 349.906 2.884 10 0 EFAEHO CC(C)CCC[NH2+]C[C@@]1(C)CCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001270829273 1099677523 /nfs/dbraw/zinc/67/75/23/1099677523.db2.gz KYUOVSYBWBSCIM-PKOBYXMFSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)CCC[NH2+]C[C@]1(C)CCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001270829268 1099677613 /nfs/dbraw/zinc/67/76/13/1099677613.db2.gz KYUOVSYBWBSCIM-HKUYNNGSSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@]1(NC(=O)Cc2nc[nH]c2C)CCCC[C@@H]1C ZINC001267874571 1099794566 /nfs/dbraw/zinc/79/45/66/1099794566.db2.gz WNOUOQZHOXXFAC-KXBFYZLASA-N 1 3 332.492 2.882 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@@H](CC[NH2+]Cc2cccc(F)c2)C1 ZINC001267883064 1099833128 /nfs/dbraw/zinc/83/31/28/1099833128.db2.gz XGEYKYWFEGPEEX-QFBILLFUSA-N 1 3 347.478 2.638 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H](CC[NH2+]Cc2cccc(F)c2)C1 ZINC001267883062 1099833154 /nfs/dbraw/zinc/83/31/54/1099833154.db2.gz XGEYKYWFEGPEEX-APWZRJJASA-N 1 3 347.478 2.638 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@@H]2CCCCN2C(=O)[C@H]2CCCN2C)c1 ZINC001482443781 1100274060 /nfs/dbraw/zinc/27/40/60/1100274060.db2.gz FCALTBKULCRXOF-VQTJNVASSA-N 1 3 343.515 2.950 10 0 EFAEHO CC(C)CC[NH2+][C@@H](C)[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001482479003 1101183156 /nfs/dbraw/zinc/18/31/56/1101183156.db2.gz IWEVKHURPUTKHO-OALUTQOASA-N 1 3 337.552 2.981 10 0 EFAEHO CCCCCC[NH+]1CCC2(CN(C(=O)CN(C)C3CCC3)C2)CC1 ZINC001280387674 1101391182 /nfs/dbraw/zinc/39/11/82/1101391182.db2.gz FFKFSKOVVXHTMC-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@H]1CNC(=O)c1sccc1CN(C)C ZINC001670646117 1101431601 /nfs/dbraw/zinc/43/16/01/1101431601.db2.gz OGGGPISIDFLGDJ-JFDDCEBESA-N 1 3 335.517 2.970 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@H]1CNC(=O)c1sccc1CN(C)C ZINC001670646117 1101431605 /nfs/dbraw/zinc/43/16/05/1101431605.db2.gz OGGGPISIDFLGDJ-JFDDCEBESA-N 1 3 335.517 2.970 10 0 EFAEHO C[C@@H]([NH2+]CCCF)[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001482483760 1101491777 /nfs/dbraw/zinc/49/17/77/1101491777.db2.gz WNHYPZPPOBUBTP-HZPDHXFCSA-N 1 3 329.504 2.541 10 0 EFAEHO C=C/C=C/CCN1CCN(c2ccccc2OCC[NH+](C)C)CC1 ZINC001652804811 1101548293 /nfs/dbraw/zinc/54/82/93/1101548293.db2.gz IUOYZHHCOFGMNN-AATRIKPKSA-N 1 3 329.488 2.881 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@H]1CCN1[C@@H]1CCCc2ccccc21 ZINC001670713485 1101634929 /nfs/dbraw/zinc/63/49/29/1101634929.db2.gz JEBHYWWJCGSUHQ-UYAOXDASSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]CCCc2cccc(F)c2)C1)N(C)C ZINC001266693192 1101921065 /nfs/dbraw/zinc/92/10/65/1101921065.db2.gz RHWWRMPTWXDWSN-OTWHNJEPSA-N 1 3 349.494 2.581 10 0 EFAEHO C[C@H]1CCCN(C(=O)c2ccc(C[NH+](C)C)cc2)[C@H]1CNCCF ZINC001482491251 1101950254 /nfs/dbraw/zinc/95/02/54/1101950254.db2.gz ACIVQKCSRGGRGA-YJBOKZPZSA-N 1 3 335.467 2.548 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2C[C@@H]([NH2+]CCCC3CCCC3)C2)C1 ZINC001656160808 1101982335 /nfs/dbraw/zinc/98/23/35/1101982335.db2.gz TXTRCFFPDXPRFF-YTQUADARSA-N 1 3 335.536 2.783 10 0 EFAEHO CCC[N@@H+]1CC[C@H](CN[C@@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)C1 ZINC000693030711 1101987287 /nfs/dbraw/zinc/98/72/87/1101987287.db2.gz JHYNZISIDJVLDR-GVDBMIGSSA-N 1 3 339.524 2.953 10 0 EFAEHO CCC[N@H+]1CC[C@H](CN[C@@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)C1 ZINC000693030711 1101987292 /nfs/dbraw/zinc/98/72/92/1101987292.db2.gz JHYNZISIDJVLDR-GVDBMIGSSA-N 1 3 339.524 2.953 10 0 EFAEHO CCCN1CC[C@H](C[NH2+][C@@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)C1 ZINC000693030711 1101987295 /nfs/dbraw/zinc/98/72/95/1101987295.db2.gz JHYNZISIDJVLDR-GVDBMIGSSA-N 1 3 339.524 2.953 10 0 EFAEHO COc1ccc(C[NH+]2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)cc1N ZINC000705890972 1102029103 /nfs/dbraw/zinc/02/91/03/1102029103.db2.gz USMJXTLWONCPOT-OALUTQOASA-N 1 3 337.467 2.841 10 0 EFAEHO C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@H]1CC[NH2+]Cc1ccccc1 ZINC001656449173 1102092685 /nfs/dbraw/zinc/09/26/85/1102092685.db2.gz ZSUUKCPXWDQCDX-APWZRJJASA-N 1 3 340.471 2.759 10 0 EFAEHO C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@@H]1CC[NH2+]Cc1ccccc1 ZINC001656449176 1102092852 /nfs/dbraw/zinc/09/28/52/1102092852.db2.gz ZSUUKCPXWDQCDX-VQIMIIECSA-N 1 3 340.471 2.759 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCCC[C@H]2CC[NH2+]CCF)C1 ZINC001271575200 1102138947 /nfs/dbraw/zinc/13/89/47/1102138947.db2.gz BKTCHUITOBHGPI-YJBOKZPZSA-N 1 3 345.478 2.529 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@@H+]1C)Cc1ccccc1C1CC1 ZINC001480874886 1102139192 /nfs/dbraw/zinc/13/91/92/1102139192.db2.gz LWWJPUDWNWGUKM-LJQANCHMSA-N 1 3 343.515 2.986 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@H+]1C)Cc1ccccc1C1CC1 ZINC001480874886 1102139197 /nfs/dbraw/zinc/13/91/97/1102139197.db2.gz LWWJPUDWNWGUKM-LJQANCHMSA-N 1 3 343.515 2.986 10 0 EFAEHO C[C@H](F)CC[NH2+]CCC[C@@H]1[C@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001656628058 1102141303 /nfs/dbraw/zinc/14/13/03/1102141303.db2.gz RATWCQUBGHCMRF-HLLBOEOZSA-N 1 3 338.471 2.697 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1CC[NH2+]Cc1cccnc1C ZINC001271598802 1102152097 /nfs/dbraw/zinc/15/20/97/1102152097.db2.gz CYFLQCUBSOVLEU-IBGZPJMESA-N 1 3 346.519 2.593 10 0 EFAEHO Cc1ccncc1C[NH2+]CC[C@@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001271608016 1102172594 /nfs/dbraw/zinc/17/25/94/1102172594.db2.gz ICNWTICEFCWLEX-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO CCC/C=C/CC[N@H+](C)C[C@H]1CCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001266469068 1102198093 /nfs/dbraw/zinc/19/80/93/1102198093.db2.gz DOZLSLCNGZQJGA-FUTAKVPZSA-N 1 3 332.492 2.869 10 0 EFAEHO CCC/C=C/CC[N@@H+](C)C[C@H]1CCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001266469068 1102198099 /nfs/dbraw/zinc/19/80/99/1102198099.db2.gz DOZLSLCNGZQJGA-FUTAKVPZSA-N 1 3 332.492 2.869 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H]1CC[N@H+](CCCCCF)[C@@H]1C ZINC001656957473 1102270863 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329.488 2.667 10 0 EFAEHO CN(C)Cc1ccc(NC(=S)NCC[NH+](C)C)cc1C(F)(F)F ZINC000905594517 1103376439 /nfs/dbraw/zinc/37/64/39/1103376439.db2.gz ARXGNMGGMOZJMR-UHFFFAOYSA-N 1 3 348.438 2.615 10 0 EFAEHO CN(CC(=O)NC[C@H]1CCC[N@H+](CC2=CCCCC2)C1)C1CCC1 ZINC001661722996 1103383907 /nfs/dbraw/zinc/38/39/07/1103383907.db2.gz FYPOGFWOLUHBND-GOSISDBHSA-N 1 3 333.520 2.799 10 0 EFAEHO CN(CC(=O)NC[C@H]1CCC[N@@H+](CC2=CCCCC2)C1)C1CCC1 ZINC001661722996 1103383919 /nfs/dbraw/zinc/38/39/19/1103383919.db2.gz FYPOGFWOLUHBND-GOSISDBHSA-N 1 3 333.520 2.799 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C)C[N@H+](C)CCCc1ccccc1 ZINC001483338066 1103421727 /nfs/dbraw/zinc/42/17/27/1103421727.db2.gz ULJCYLYOXCRZIV-ICSRJNTNSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCCc1ccccc1 ZINC001483338066 1103421737 /nfs/dbraw/zinc/42/17/37/1103421737.db2.gz ULJCYLYOXCRZIV-ICSRJNTNSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)CCCc1ccccc1 ZINC001483338062 1103422269 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CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](CNCC=C(Cl)Cl)C1CC1 ZINC001483564090 1103957427 /nfs/dbraw/zinc/95/74/27/1103957427.db2.gz LVYOTVQCAOCQHZ-ZIAGYGMSSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](CNCC=C(Cl)Cl)C1CC1 ZINC001483564090 1103957433 /nfs/dbraw/zinc/95/74/33/1103957433.db2.gz LVYOTVQCAOCQHZ-ZIAGYGMSSA-N 1 3 348.318 2.664 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1cc(C)ccc1C)C1CC1)N(C)C ZINC001483600662 1104036271 /nfs/dbraw/zinc/03/62/71/1104036271.db2.gz JFTDLCMOUMKQJH-RBUKOAKNSA-N 1 3 331.504 2.628 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@H]2C[NH2+]CCc2cccs2)CCC1 ZINC001272269687 1104157409 /nfs/dbraw/zinc/15/74/09/1104157409.db2.gz FWTQRBTZFPTMHR-RDJZCZTQSA-N 1 3 349.544 2.649 10 0 EFAEHO CC(C)=CCN(CCNC(=O)C1CC[NH+](CC2CC2)CC1)C1CC1 ZINC001663769816 1104208874 /nfs/dbraw/zinc/20/88/74/1104208874.db2.gz XUZVZPIKYLCGFO-UHFFFAOYSA-N 1 3 333.520 2.655 10 0 EFAEHO CN(CC[NH2+]Cc1cc(Cl)cc(Cl)c1)C(=O)[C@H]1CCCN1C ZINC001663855843 1104226994 /nfs/dbraw/zinc/22/69/94/1104226994.db2.gz JJEGLNMLAZKQMB-OAHLLOKOSA-N 1 3 344.286 2.636 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[NH2+]CC1CCC(C)(C)CC1)N(C)C ZINC001663995319 1104258878 /nfs/dbraw/zinc/25/88/78/1104258878.db2.gz DWKHLAKENTZKRR-KRWDZBQOSA-N 1 3 325.541 2.837 10 0 EFAEHO Cc1ccncc1CNCCN(C)C(=O)CC[N@H+](C)C1CCCCC1 ZINC001664093354 1104283590 /nfs/dbraw/zinc/28/35/90/1104283590.db2.gz MQXRHJBLTOYKTH-UHFFFAOYSA-N 1 3 346.519 2.593 10 0 EFAEHO Cc1ccncc1CNCCN(C)C(=O)CC[N@@H+](C)C1CCCCC1 ZINC001664093354 1104283600 /nfs/dbraw/zinc/28/36/00/1104283600.db2.gz MQXRHJBLTOYKTH-UHFFFAOYSA-N 1 3 346.519 2.593 10 0 EFAEHO CC[C@@H](F)CNCCN(C)C(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001664138094 1104297584 /nfs/dbraw/zinc/29/75/84/1104297584.db2.gz HQDJSPDNSFAEHG-NVXWUHKLSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@@H](F)CNCCN(C)C(=O)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001664138094 1104297590 /nfs/dbraw/zinc/29/75/90/1104297590.db2.gz HQDJSPDNSFAEHG-NVXWUHKLSA-N 1 3 327.488 2.580 10 0 EFAEHO Cc1cccc(Cl)c1CNCCN(C)C(=O)C1CC[NH+](C)CC1 ZINC001664160396 1104303046 /nfs/dbraw/zinc/30/30/46/1104303046.db2.gz MDMHZFDIKTWUQY-UHFFFAOYSA-N 1 3 337.895 2.538 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001409584007 1104363218 /nfs/dbraw/zinc/36/32/18/1104363218.db2.gz WQIZVXKJTNKBDH-DNVCBOLYSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001409584007 1104363231 /nfs/dbraw/zinc/36/32/31/1104363231.db2.gz WQIZVXKJTNKBDH-DNVCBOLYSA-N 1 3 331.504 2.841 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(C)CCN(C)C(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001482599531 1104417357 /nfs/dbraw/zinc/41/73/57/1104417357.db2.gz WLLINQZPRZHYOU-KXBFYZLASA-N 1 3 347.478 2.619 10 0 EFAEHO CC(C)=CCN[C@@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)c1ccccc1 ZINC001664599418 1104467292 /nfs/dbraw/zinc/46/72/92/1104467292.db2.gz RFLNARIEIHIRPT-MJGOQNOKSA-N 1 3 329.488 2.742 10 0 EFAEHO CC(C)=CCN[C@@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)c1ccccc1 ZINC001664599418 1104467296 /nfs/dbraw/zinc/46/72/96/1104467296.db2.gz RFLNARIEIHIRPT-MJGOQNOKSA-N 1 3 329.488 2.742 10 0 EFAEHO Cc1ccc(CN(C)[C@@H](C)CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1F ZINC001409610009 1104480010 /nfs/dbraw/zinc/48/00/10/1104480010.db2.gz GPVWFDHQNRVPPW-BQFCYCMXSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(CN(C)[C@@H](C)CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1F ZINC001409610009 1104480012 /nfs/dbraw/zinc/48/00/12/1104480012.db2.gz GPVWFDHQNRVPPW-BQFCYCMXSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1cc(CN(C)[C@@H](C)CNC(=O)C[C@H]2CC[N@H+](C)C2)c(C)s1 ZINC001409651431 1104600917 /nfs/dbraw/zinc/60/09/17/1104600917.db2.gz SJXBAQINCUOSFT-XJKSGUPXSA-N 1 3 337.533 2.643 10 0 EFAEHO Cc1cc(CN(C)[C@@H](C)CNC(=O)C[C@H]2CC[N@@H+](C)C2)c(C)s1 ZINC001409651431 1104600922 /nfs/dbraw/zinc/60/09/22/1104600922.db2.gz SJXBAQINCUOSFT-XJKSGUPXSA-N 1 3 337.533 2.643 10 0 EFAEHO CN(CC[N@H+](C)[C@@H]1CCc2ccc(Cl)cc21)C(=O)[C@H]1CCCN1C ZINC001482618820 1104659977 /nfs/dbraw/zinc/65/99/77/1104659977.db2.gz JXLXJFMHNIIOLR-QZTJIDSGSA-N 1 3 349.906 2.812 10 0 EFAEHO CN(CC[N@@H+](C)[C@@H]1CCc2ccc(Cl)cc21)C(=O)[C@H]1CCCN1C ZINC001482618820 1104659985 /nfs/dbraw/zinc/65/99/85/1104659985.db2.gz JXLXJFMHNIIOLR-QZTJIDSGSA-N 1 3 349.906 2.812 10 0 EFAEHO O=C(NCC1CN(CCCCCF)C1)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001665292946 1104661433 /nfs/dbraw/zinc/66/14/33/1104661433.db2.gz FWHRXWFLJYNXNV-SFHVURJKSA-N 1 3 339.499 2.581 10 0 EFAEHO O=C(NCC1CN(CCCCCF)C1)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001665292946 1104661439 /nfs/dbraw/zinc/66/14/39/1104661439.db2.gz FWHRXWFLJYNXNV-SFHVURJKSA-N 1 3 339.499 2.581 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)[C@@H](C)c1ccc2c(c1)CCC2 ZINC001482651617 1104743491 /nfs/dbraw/zinc/74/34/91/1104743491.db2.gz GMMZJFHZFTWDBW-KRWDZBQOSA-N 1 3 345.531 2.967 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)[C@@H](C)c1ccc2c(c1)CCC2 ZINC001482651617 1104743493 /nfs/dbraw/zinc/74/34/93/1104743493.db2.gz GMMZJFHZFTWDBW-KRWDZBQOSA-N 1 3 345.531 2.967 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@H]21 ZINC001482660602 1104754079 /nfs/dbraw/zinc/75/40/79/1104754079.db2.gz ZKZBMORLZFZFLW-OSFIAYCASA-N 1 3 333.520 2.750 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@H]21 ZINC001482660602 1104754087 /nfs/dbraw/zinc/75/40/87/1104754087.db2.gz ZKZBMORLZFZFLW-OSFIAYCASA-N 1 3 333.520 2.750 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC1(C[NH2+]CCC(F)(F)F)CCCC1 ZINC001665968318 1104817809 /nfs/dbraw/zinc/81/78/09/1104817809.db2.gz FFGJUFWYFLDTQO-KBPBESRZSA-N 1 3 349.441 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@]1(C[NH2+]C/C=C/Cl)CCCC[C@@H]1C ZINC001666068764 1104848292 /nfs/dbraw/zinc/84/82/92/1104848292.db2.gz OCIGFELCZDDTGE-FIEKWJHISA-N 1 3 329.916 2.734 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N(C)CCN(C)CC2=CCCCC2)C1 ZINC001272093539 1104858886 /nfs/dbraw/zinc/85/88/86/1104858886.db2.gz SLKAMGCNLJJNBL-LJQANCHMSA-N 1 3 335.536 2.999 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N(C)CCN(C)CC2=CCCCC2)C1 ZINC001272093539 1104858895 /nfs/dbraw/zinc/85/88/95/1104858895.db2.gz SLKAMGCNLJJNBL-LJQANCHMSA-N 1 3 335.536 2.999 10 0 EFAEHO C[C@@H](F)CC[NH2+]CC[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001666157064 1104886452 /nfs/dbraw/zinc/88/64/52/1104886452.db2.gz JKZCAAIANYKMTK-MSOLQXFVSA-N 1 3 341.515 2.685 10 0 EFAEHO C[C@H](F)CC[NH2+]CCC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001666252833 1104912668 /nfs/dbraw/zinc/91/26/68/1104912668.db2.gz NBAWQBRBZDDDTP-KRWDZBQOSA-N 1 3 341.515 2.685 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(CC[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001666258705 1104914101 /nfs/dbraw/zinc/91/41/01/1104914101.db2.gz FFUQIRNKLPNCPD-HSALFYBXSA-N 1 3 349.563 2.983 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]1C[NH2+]CCC1=CCCCC1)C1CCC1 ZINC001666425365 1104942193 /nfs/dbraw/zinc/94/21/93/1104942193.db2.gz XUPMTYNGQGMXIQ-LJQANCHMSA-N 1 3 333.520 2.942 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H]2C[NH2+]CCCC2CCCC2)C1 ZINC001666458561 1104945670 /nfs/dbraw/zinc/94/56/70/1104945670.db2.gz GZXMOMHUBYGGCX-PKOBYXMFSA-N 1 3 335.536 2.879 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N1CCC2(CCN(CCF)C2)CC1 ZINC001666501118 1104952657 /nfs/dbraw/zinc/95/26/57/1104952657.db2.gz MOBFJPLDLUIDFB-UHFFFAOYSA-N 1 3 339.499 2.537 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC2(CN(Cc3ccccc3)C2)CC1 ZINC001666834886 1105005616 /nfs/dbraw/zinc/00/56/16/1105005616.db2.gz RWDYUTXYGVXDLB-UHFFFAOYSA-N 1 3 343.515 2.843 10 0 EFAEHO C[C@H](CNCC=C(Cl)Cl)N(C)C(=O)C[N@H+](C)CC(C)(C)C ZINC001666992257 1105033250 /nfs/dbraw/zinc/03/32/50/1105033250.db2.gz MPWRUSKIEOXCNO-GFCCVEGCSA-N 1 3 338.323 2.720 10 0 EFAEHO C[C@H](CNCC=C(Cl)Cl)N(C)C(=O)C[N@@H+](C)CC(C)(C)C ZINC001666992257 1105033252 /nfs/dbraw/zinc/03/32/52/1105033252.db2.gz MPWRUSKIEOXCNO-GFCCVEGCSA-N 1 3 338.323 2.720 10 0 EFAEHO C[C@H](CC[NH2+]CCC(F)(F)F)NC(=O)C(C)(C)N1CCCCC1 ZINC001482835068 1105071767 /nfs/dbraw/zinc/07/17/67/1105071767.db2.gz ZESAOIUXFYVPKM-CYBMUJFWSA-N 1 3 337.430 2.688 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccccc1Cl)N(C)C ZINC001482843866 1105084909 /nfs/dbraw/zinc/08/49/09/1105084909.db2.gz JNVLCFNBOJXGKX-PBHICJAKSA-N 1 3 339.911 2.911 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cccc(Cl)c1F)N(C)C ZINC001482846504 1105087773 /nfs/dbraw/zinc/08/77/73/1105087773.db2.gz KPJZDKIVAQUCLG-SWLSCSKDSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001482846548 1105088262 /nfs/dbraw/zinc/08/82/62/1105088262.db2.gz KXNQPUVHLACRKZ-WCQYABFASA-N 1 3 331.913 2.726 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1cccc(OC)c1 ZINC001482900769 1105145293 /nfs/dbraw/zinc/14/52/93/1105145293.db2.gz GNMFJIHTBCVASR-LPHOPBHVSA-N 1 3 347.503 2.554 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CC[NH2+]Cc1ccc(C2CC2)cc1 ZINC001482892197 1105150667 /nfs/dbraw/zinc/15/06/67/1105150667.db2.gz UPJBQNSMFWTWBZ-AWEZNQCLSA-N 1 3 340.471 2.823 10 0 EFAEHO Cc1ccc(CC[NH2+]CC[C@@H](C)NC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001668062085 1105228681 /nfs/dbraw/zinc/22/86/81/1105228681.db2.gz ZIVDUSQGFGNOPN-UYAOXDASSA-N 1 3 345.531 2.895 10 0 EFAEHO CC(C)CC[NH2+]CC[C@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001668215043 1105258682 /nfs/dbraw/zinc/25/86/82/1105258682.db2.gz VDAOARYMTJMDBR-MAUKXSAKSA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]CCc1ccccc1 ZINC001668234278 1105262909 /nfs/dbraw/zinc/26/29/09/1105262909.db2.gz HJPWYLFEJIURKE-ICSRJNTNSA-N 1 3 345.531 2.976 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1ccccc1 ZINC001668234629 1105263326 /nfs/dbraw/zinc/26/33/26/1105263326.db2.gz NKAKXMAYADKNKQ-HKUYNNGSSA-N 1 3 331.504 2.934 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cc2ccccc2o1)N(C)C ZINC001668279266 1105272420 /nfs/dbraw/zinc/27/24/20/1105272420.db2.gz QWVUUWCFBQFKOC-YOEHRIQHSA-N 1 3 331.460 2.757 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@@H](C)NC(=O)Cc2nc[nH]c2C)c1 ZINC001668287739 1105274238 /nfs/dbraw/zinc/27/42/38/1105274238.db2.gz BQSQNDGACYOJAX-CQSZACIVSA-N 1 3 328.460 2.508 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]Cc1ccccc1F ZINC001668319550 1105281208 /nfs/dbraw/zinc/28/12/08/1105281208.db2.gz IHYKAAHDXQCCGU-CRAIPNDOSA-N 1 3 335.467 2.685 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001668464045 1105301189 /nfs/dbraw/zinc/30/11/89/1105301189.db2.gz BWXTZRJVTPUOGL-MOPGFXCFSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001668464045 1105301194 /nfs/dbraw/zinc/30/11/94/1105301194.db2.gz BWXTZRJVTPUOGL-MOPGFXCFSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CC[NH2+]C/C=C/c1ccc(Cl)cc1)C(=O)[C@H]1CCCN1C ZINC001668521276 1105312300 /nfs/dbraw/zinc/31/23/00/1105312300.db2.gz DJEAJJIWJPTSQE-MJICGBHWSA-N 1 3 349.906 2.886 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001668582141 1105325499 /nfs/dbraw/zinc/32/54/99/1105325499.db2.gz WFWBCNKVDNXXGE-IAGOWNOFSA-N 1 3 335.517 2.703 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001668582141 1105325506 /nfs/dbraw/zinc/32/55/06/1105325506.db2.gz WFWBCNKVDNXXGE-IAGOWNOFSA-N 1 3 335.517 2.703 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\CNCc1cc2ccccc2o1)[NH+](C)C ZINC001668873911 1105390390 /nfs/dbraw/zinc/39/03/90/1105390390.db2.gz XUDLNABBGROXDW-FQQSSWHASA-N 1 3 343.471 2.781 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C\C[NH2+]C/C=C/c2ccccc2)CC1 ZINC001669106810 1105435397 /nfs/dbraw/zinc/43/53/97/1105435397.db2.gz JCDHTTFNFHUBCM-ZZWPSLBBSA-N 1 3 341.499 2.694 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C/C[NH2+]C/C=C/c2ccccc2)CC1 ZINC001669106809 1105435474 /nfs/dbraw/zinc/43/54/74/1105435474.db2.gz JCDHTTFNFHUBCM-WEYXYWBQSA-N 1 3 341.499 2.694 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)[C@@H]2CCC[C@H]([NH+](C)C)C2)cs1 ZINC001669138369 1105441260 /nfs/dbraw/zinc/44/12/60/1105441260.db2.gz HJVQPCJMXWVLID-KKSLTYSGSA-N 1 3 349.544 2.939 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\C[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001669151408 1105444678 /nfs/dbraw/zinc/44/46/78/1105444678.db2.gz SEKRULPKJGPQGG-KJPDOMRESA-N 1 3 345.478 2.660 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C\C[NH2+][C@H]1CCc2ccccc21 ZINC001669206384 1105456802 /nfs/dbraw/zinc/45/68/02/1105456802.db2.gz COWDDHOSWUIBOS-SLVIYJBESA-N 1 3 341.499 2.810 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+]C/C=C\c1ccc(Cl)cc1 ZINC001669750154 1105515155 /nfs/dbraw/zinc/51/51/55/1105515155.db2.gz GMDCXIWZTVBNJP-YVACAVLKSA-N 1 3 337.895 2.788 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC/C=C\CNCc1cccc(Cl)c1 ZINC001483016539 1105555344 /nfs/dbraw/zinc/55/53/44/1105555344.db2.gz RTTWOOQNQSFFNM-JXCVUKRWSA-N 1 3 349.906 2.976 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC/C=C\CNCc1cccc(Cl)c1 ZINC001483016539 1105555347 /nfs/dbraw/zinc/55/53/47/1105555347.db2.gz RTTWOOQNQSFFNM-JXCVUKRWSA-N 1 3 349.906 2.976 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@@H]1CCCC[C@H]1NC(=O)Cc1nc[nH]c1C ZINC001669979239 1105561625 /nfs/dbraw/zinc/56/16/25/1105561625.db2.gz ATFOMKIZZHVWKJ-PPPANMTLSA-N 1 3 332.492 2.882 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CCCN(C)C(=O)CN(C)C1CCC1 ZINC001670127902 1105584119 /nfs/dbraw/zinc/58/41/19/1105584119.db2.gz SOONGUBYWCXSOZ-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]C/C=C\Cl)C1CCCC1 ZINC001671530548 1105652286 /nfs/dbraw/zinc/65/22/86/1105652286.db2.gz OOWAPDGVTGQMQJ-IRMRGROASA-N 1 3 341.927 2.876 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@](C)(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001671675065 1105682027 /nfs/dbraw/zinc/68/20/27/1105682027.db2.gz SITCZSFLDDBRKL-RTBURBONSA-N 1 3 341.515 2.970 10 0 EFAEHO CCCCC[N@H+]1CC[C@@](C)(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001671675065 1105682032 /nfs/dbraw/zinc/68/20/32/1105682032.db2.gz SITCZSFLDDBRKL-RTBURBONSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@](C)(C[NH2+]CCCC3CCC3)C2)C1 ZINC001671785925 1105702189 /nfs/dbraw/zinc/70/21/89/1105702189.db2.gz ZYVYCNSNQILBLY-FXAWDEMLSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]CCCC3CCC3)C2)C1 ZINC001671785926 1105702433 /nfs/dbraw/zinc/70/24/33/1105702433.db2.gz ZYVYCNSNQILBLY-PXNSSMCTSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@](C)(C[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001671804356 1105706239 /nfs/dbraw/zinc/70/62/39/1105706239.db2.gz AJCHLQVAHREUKX-LPHOPBHVSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H]([NH2+]CCCc1ccsc1)[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001672247474 1105786086 /nfs/dbraw/zinc/78/60/86/1105786086.db2.gz WLNQXJXIHBOFMY-SJLPKXTDSA-N 1 3 349.544 2.603 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)C2CCC2)C[C@@H]1C[NH2+]CCCC1CCC1 ZINC001672286422 1105792851 /nfs/dbraw/zinc/79/28/51/1105792851.db2.gz HVXPIZZAIZEBCZ-WMZOPIPTSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)c1 ZINC001672761771 1105897663 /nfs/dbraw/zinc/89/76/63/1105897663.db2.gz PDTVUWUNPCUFGT-QUCCMNQESA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@@H]1CCN(C(=O)CN(C)C2CCC2)C1 ZINC001672805020 1105907696 /nfs/dbraw/zinc/90/76/96/1105907696.db2.gz IPEYKIVYSAOEJL-GOSISDBHSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@@H]1CCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001672805987 1105908285 /nfs/dbraw/zinc/90/82/85/1105908285.db2.gz RSIHBTVOBOSBOL-GOSISDBHSA-N 1 3 343.515 2.808 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H](CC[NH2+]Cc3ccsc3)C2)CCC1 ZINC001672806168 1105908379 /nfs/dbraw/zinc/90/83/79/1105908379.db2.gz TVHKQLVBQQBRGE-OAHLLOKOSA-N 1 3 335.517 2.561 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](CC[NH2+]Cc2ccc(F)cc2)C1)N(C)C ZINC001672859432 1105922857 /nfs/dbraw/zinc/92/28/57/1105922857.db2.gz UTSJKQVTXQQQKY-PKOBYXMFSA-N 1 3 349.494 2.740 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](CC[NH2+]Cc2ccc(C)cc2C)C1)N(C)C ZINC001672863304 1105923495 /nfs/dbraw/zinc/92/34/95/1105923495.db2.gz JBLRSQYMOJTQHT-ICSRJNTNSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H]2CCN(C(=O)CN3CCCC3)C2)c(C)s1 ZINC001672909966 1105935140 /nfs/dbraw/zinc/93/51/40/1105935140.db2.gz JQSFJWSDTQZOMC-KRWDZBQOSA-N 1 3 349.544 2.789 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](CC[NH2+]Cc2ccc(CF)cc2)C1 ZINC001672909466 1105935551 /nfs/dbraw/zinc/93/55/51/1105935551.db2.gz GUFBVNCTRQFUMT-IBGZPJMESA-N 1 3 347.478 2.580 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC(C)([NH2+]CCCC3CCC3)CC2)C1 ZINC001673982295 1106113838 /nfs/dbraw/zinc/11/38/38/1106113838.db2.gz SMNLKQHMUDUTBQ-KRWDZBQOSA-N 1 3 335.536 2.879 10 0 EFAEHO CC1CCN(CC(=O)N2CCC(C)([NH2+]CCCCCF)CC2)CC1 ZINC001673989614 1106114518 /nfs/dbraw/zinc/11/45/18/1106114518.db2.gz ZDQMDGQDEFJATJ-UHFFFAOYSA-N 1 3 341.515 2.829 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1CC1=CCCCC1 ZINC001674132632 1106143094 /nfs/dbraw/zinc/14/30/94/1106143094.db2.gz ANVPMZYQWXVGRQ-WMZOPIPTSA-N 1 3 333.520 2.940 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)CC[N@H+]1CC1=CCCCC1 ZINC001674132632 1106143095 /nfs/dbraw/zinc/14/30/95/1106143095.db2.gz ANVPMZYQWXVGRQ-WMZOPIPTSA-N 1 3 333.520 2.940 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@H+](C)CCC1=CCCCC1 ZINC001674440913 1106190929 /nfs/dbraw/zinc/19/09/29/1106190929.db2.gz OOWFPQQDMGTXCQ-OALUTQOASA-N 1 3 333.520 2.894 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@@H+](C)CCC1=CCCCC1 ZINC001674440913 1106190934 /nfs/dbraw/zinc/19/09/34/1106190934.db2.gz OOWFPQQDMGTXCQ-OALUTQOASA-N 1 3 333.520 2.894 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@H]([C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001674505226 1106208998 /nfs/dbraw/zinc/20/89/98/1106208998.db2.gz LUBMQMVGDNFMJQ-ZGQVYYGYSA-N 1 3 344.503 2.869 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@H]([C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001674505226 1106209003 /nfs/dbraw/zinc/20/90/03/1106209003.db2.gz LUBMQMVGDNFMJQ-ZGQVYYGYSA-N 1 3 344.503 2.869 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H](C)[NH2+]CCCc1cccc(F)c1 ZINC001674759616 1106252635 /nfs/dbraw/zinc/25/26/35/1106252635.db2.gz FPMVONSPOFCTNO-ZIAGYGMSSA-N 1 3 346.450 2.515 10 0 EFAEHO CCCC[C@@H](C[NH2+]CCC)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001675234363 1106320107 /nfs/dbraw/zinc/32/01/07/1106320107.db2.gz SOIGYRLPIZRPBF-MAUKXSAKSA-N 1 3 329.504 2.874 10 0 EFAEHO CC(C)(C(=O)N[C@H]1C[C@H](C[NH2+]CCC(F)(F)F)C1)N1CCCCC1 ZINC001675745548 1106418737 /nfs/dbraw/zinc/41/87/37/1106418737.db2.gz JIFVXCINCAEMDR-HDJSIYSDSA-N 1 3 349.441 2.688 10 0 EFAEHO CC[NH2+]CCCN(Cc1ccccc1)C(=O)CN1[C@@H](C)CC[C@@H]1C ZINC001676088642 1106483920 /nfs/dbraw/zinc/48/39/20/1106483920.db2.gz AORFTGBPXYSQHC-ROUUACIJSA-N 1 3 331.504 2.888 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C[NH2+]CCc1ccccc1)C(C)(C)C)N(C)C ZINC001677282727 1106691065 /nfs/dbraw/zinc/69/10/65/1106691065.db2.gz YTTIVCIFUPVJPN-ROUUACIJSA-N 1 3 333.520 2.690 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C1CC(N(C)C(=O)[C@H]2CCCN2C)C1 ZINC001677385381 1106711010 /nfs/dbraw/zinc/71/10/10/1106711010.db2.gz AGQBVTVIFGKDRC-SOAGJPPSSA-N 1 3 343.515 2.601 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](Cc2ccc(C)cc2)CC1 ZINC001677623739 1106790562 /nfs/dbraw/zinc/79/05/62/1106790562.db2.gz BQYBIZBHNXSKJS-UHFFFAOYSA-N 1 3 329.488 2.585 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](Cc2ccc(C)cc2)CC1 ZINC001677623739 1106790579 /nfs/dbraw/zinc/79/05/79/1106790579.db2.gz BQYBIZBHNXSKJS-UHFFFAOYSA-N 1 3 329.488 2.585 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)cc1F ZINC001409344066 1107561660 /nfs/dbraw/zinc/56/16/60/1107561660.db2.gz CJQHYRGTFVGILN-HUUCEWRRSA-N 1 3 335.467 2.601 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@H](C)[NH2+]CC1CC2(CCC2)C1 ZINC001409344411 1107589440 /nfs/dbraw/zinc/58/94/40/1107589440.db2.gz BFIKAUSSSHUDEO-JKSUJKDBSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@@H](NC(=O)CCC[NH+](C)C)[C@H](C)NCc1ccccc1Cl ZINC001409365909 1107921371 /nfs/dbraw/zinc/92/13/71/1107921371.db2.gz AELANTBZRLKUFZ-UONOGXRCSA-N 1 3 325.884 2.665 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC[C@@H]1CCN1C[C@H]1CCCC(F)(F)C1 ZINC001483693282 1107937140 /nfs/dbraw/zinc/93/71/40/1107937140.db2.gz LVSBLCMFHPEFLQ-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC[C@@H]1CCN1C[C@H]1CCCC(F)(F)C1 ZINC001483693282 1107937151 /nfs/dbraw/zinc/93/71/51/1107937151.db2.gz LVSBLCMFHPEFLQ-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]C/C=C\c1ccccc1 ZINC001272344067 1108012313 /nfs/dbraw/zinc/01/23/13/1108012313.db2.gz PVYXBNMPTNKMEZ-JFYHIKNKSA-N 1 3 343.515 2.915 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@H]3CCCN3C)C2)cc1F ZINC001272384866 1108140104 /nfs/dbraw/zinc/14/01/04/1108140104.db2.gz SPTRREIMEXCFLV-VQIMIIECSA-N 1 3 347.478 2.557 10 0 EFAEHO Cc1ccc(CN[C@H](C)[C@@H](C)NC(=O)C23CC[NH+](CC2)C3)c(Cl)c1 ZINC001409419985 1108254269 /nfs/dbraw/zinc/25/42/69/1108254269.db2.gz LFRJJTIENBKXMU-HUUCEWRRSA-N 1 3 349.906 2.727 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC/C=C/CNCc2ccc(Cl)cc2)CC1 ZINC001483070733 1108303056 /nfs/dbraw/zinc/30/30/56/1108303056.db2.gz RTGMFGLFDDFXAI-NSCUHMNNSA-N 1 3 349.906 2.834 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1c(C)cc(C)cc1C ZINC001409434028 1108351967 /nfs/dbraw/zinc/35/19/67/1108351967.db2.gz NVSPTMNVIJYGIB-QZTJIDSGSA-N 1 3 333.520 2.936 10 0 EFAEHO O=C(CN1CCCC1)NC/C=C/C[NH2+]Cc1cccc2ccccc21 ZINC001483093607 1108576435 /nfs/dbraw/zinc/57/64/35/1108576435.db2.gz RYXGLDQSLVTPFP-ONEGZZNKSA-N 1 3 337.467 2.698 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C\C[NH2+][C@H](C)c1ccccc1 ZINC001483098531 1108649060 /nfs/dbraw/zinc/64/90/60/1108649060.db2.gz RMQVAZACPNGSMY-MQCDJQTNSA-N 1 3 329.488 2.884 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001272554709 1108651143 /nfs/dbraw/zinc/65/11/43/1108651143.db2.gz GNRREEVDPUVFDE-UYAOXDASSA-N 1 3 345.531 2.909 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](CC[NH2+]Cc2cc(F)ccc2C)C1)N(C)C ZINC001272564554 1108671836 /nfs/dbraw/zinc/67/18/36/1108671836.db2.gz HOAWZMSRJORJOE-LPHOPBHVSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2cc(F)ccc2C)C1)N(C)C ZINC001272564553 1108672406 /nfs/dbraw/zinc/67/24/06/1108672406.db2.gz HOAWZMSRJORJOE-APWZRJJASA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](F)C[NH2+]CC1CC(NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001409290774 1109392368 /nfs/dbraw/zinc/39/23/68/1109392368.db2.gz OSKAIJNQZMMKBC-NXYGQSRBSA-N 1 3 335.467 2.594 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H](CC[NH2+]CC3CC(C)(C)C3)C2)CC1 ZINC001272598664 1111533156 /nfs/dbraw/zinc/53/31/56/1111533156.db2.gz IJVJZLCZGBHEIX-SFHVURJKSA-N 1 3 349.563 2.983 10 0 EFAEHO Cc1ccccc1CN1CC([C@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)C1 ZINC001409890375 1111733365 /nfs/dbraw/zinc/73/33/65/1111733365.db2.gz AWOQDVRJDCPMAA-FXAWDEMLSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1ccccc1CN1CC([C@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)C1 ZINC001409890375 1111733368 /nfs/dbraw/zinc/73/33/68/1111733368.db2.gz AWOQDVRJDCPMAA-FXAWDEMLSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1ccccc1CN1CC([C@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)C1 ZINC001409890416 1111733743 /nfs/dbraw/zinc/73/37/43/1111733743.db2.gz AWOQDVRJDCPMAA-PXNSSMCTSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1ccccc1CN1CC([C@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)C1 ZINC001409890416 1111733746 /nfs/dbraw/zinc/73/37/46/1111733746.db2.gz AWOQDVRJDCPMAA-PXNSSMCTSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1ccccc1CN1CC([C@@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)C1 ZINC001409890472 1111734298 /nfs/dbraw/zinc/73/42/98/1111734298.db2.gz AWOQDVRJDCPMAA-YLJYHZDGSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1ccccc1CN1CC([C@@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)C1 ZINC001409890472 1111734302 /nfs/dbraw/zinc/73/43/02/1111734302.db2.gz AWOQDVRJDCPMAA-YLJYHZDGSA-N 1 3 343.515 2.806 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](CC[NH2+]Cc2c(C)cccc2C)C1)N(C)C ZINC001272615666 1111746196 /nfs/dbraw/zinc/74/61/96/1111746196.db2.gz GCLMXKXOWBAFLJ-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@H]1CCN(C(=O)[C@@H](CC)N(C)C)C1 ZINC001272616746 1111749904 /nfs/dbraw/zinc/74/99/04/1111749904.db2.gz OXBGTXGUVPDGSV-FXAWDEMLSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001272641024 1111815089 /nfs/dbraw/zinc/81/50/89/1111815089.db2.gz AIXNPODZYCRGJB-GOSISDBHSA-N 1 3 343.515 2.673 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]CCC2=CCCCC2)CC1)N1CCCC1 ZINC001483756665 1111975788 /nfs/dbraw/zinc/97/57/88/1111975788.db2.gz GPZOJRIXIXEJMQ-UHFFFAOYSA-N 1 3 333.520 2.990 10 0 EFAEHO CC[C@@H]([NH2+]C1(CNC(=O)CN(C)C(C)C)CC1)c1ccc(F)cc1 ZINC001483794043 1112454903 /nfs/dbraw/zinc/45/49/03/1112454903.db2.gz CVYCKUUGUITGSS-QGZVFWFLSA-N 1 3 335.467 2.855 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@]2(C1)CCC[N@H+](Cc1ccsc1)C2 ZINC001483832915 1112493491 /nfs/dbraw/zinc/49/34/91/1112493491.db2.gz PYDYEYVNHSANKL-IBGZPJMESA-N 1 3 349.544 2.904 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@]2(C1)CCC[N@@H+](Cc1ccsc1)C2 ZINC001483832915 1112493499 /nfs/dbraw/zinc/49/34/99/1112493499.db2.gz PYDYEYVNHSANKL-IBGZPJMESA-N 1 3 349.544 2.904 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)cs1 ZINC001483913864 1112555620 /nfs/dbraw/zinc/55/56/20/1112555620.db2.gz KJUOICTXZIKSJN-PBHICJAKSA-N 1 3 337.533 2.866 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CCCCCF)CCN1C(=O)CN(C)C1CCC1 ZINC001483905493 1112565938 /nfs/dbraw/zinc/56/59/38/1112565938.db2.gz NRGMAIZEZKFRNO-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1(C)CC[NH+](CCCCCF)CC1 ZINC001484146008 1112823365 /nfs/dbraw/zinc/82/33/65/1112823365.db2.gz OZLDINQRDZTGIC-UHFFFAOYSA-N 1 3 338.471 2.619 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NCC1(C)CCN(C/C=C\Cl)CC1 ZINC001484147090 1112825480 /nfs/dbraw/zinc/82/54/80/1112825480.db2.gz MQPUGJRKOWPGND-KDLGDOBMSA-N 1 3 341.927 2.830 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCC1(C)CCN(C/C=C\Cl)CC1 ZINC001484147090 1112825485 /nfs/dbraw/zinc/82/54/85/1112825485.db2.gz MQPUGJRKOWPGND-KDLGDOBMSA-N 1 3 341.927 2.830 10 0 EFAEHO CC(C)CC[N@@H+]1CCC[C@@](C)(CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001484159975 1112855549 /nfs/dbraw/zinc/85/55/49/1112855549.db2.gz HEQBNQSAUQQVSW-HKUYNNGSSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)CC[N@H+]1CCC[C@@](C)(CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001484159975 1112855552 /nfs/dbraw/zinc/85/55/52/1112855552.db2.gz HEQBNQSAUQQVSW-HKUYNNGSSA-N 1 3 325.541 2.837 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001484195941 1112913260 /nfs/dbraw/zinc/91/32/60/1112913260.db2.gz OFBRKDVCIQFEKF-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001484195941 1112913266 /nfs/dbraw/zinc/91/32/66/1112913266.db2.gz OFBRKDVCIQFEKF-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CN(CC(=O)N1CC[C@H](CC[NH2+]CCc2cccs2)C1)C1CCC1 ZINC001484523495 1112979894 /nfs/dbraw/zinc/97/98/94/1112979894.db2.gz AJNXARBDQMSRKW-INIZCTEOSA-N 1 3 349.544 2.603 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H](CC[NH2+]CC3CC4(CCC4)C3)C2)CCC1 ZINC001484524462 1112980636 /nfs/dbraw/zinc/98/06/36/1112980636.db2.gz ZWRVZOYIENWFEO-QGZVFWFLSA-N 1 3 347.547 2.879 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](CC[NH2+]Cc2ccc(C)cc2)C1)N(C)C ZINC001484537286 1112992216 /nfs/dbraw/zinc/99/22/16/1112992216.db2.gz FSZFAGNYCAZXRV-OALUTQOASA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](CC[NH2+]Cc2cc(C)ccc2C)C1)N(C)C ZINC001484548135 1112996342 /nfs/dbraw/zinc/99/63/42/1112996342.db2.gz WBHHAAPBYOCBMW-ICSRJNTNSA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1cccc2c1CC[N@@H+](CC[C@H](C)F)C2 ZINC001484612138 1113054054 /nfs/dbraw/zinc/05/40/54/1113054054.db2.gz JQAMSNGSRRSSFW-INIZCTEOSA-N 1 3 349.494 2.749 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1cccc2c1CC[N@H+](CC[C@H](C)F)C2 ZINC001484612138 1113054058 /nfs/dbraw/zinc/05/40/58/1113054058.db2.gz JQAMSNGSRRSSFW-INIZCTEOSA-N 1 3 349.494 2.749 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(CNC(=O)[C@@H]2CCCCN2C(C)C)CCC1 ZINC001484655040 1113094536 /nfs/dbraw/zinc/09/45/36/1113094536.db2.gz JEAMGFNHXULEMH-CVEARBPZSA-N 1 3 327.488 2.626 10 0 EFAEHO CCc1ccccc1C[NH2+]C1(CNC(=O)CN(C)C(C)C)CCC1 ZINC001484663661 1113103447 /nfs/dbraw/zinc/10/34/47/1113103447.db2.gz YZFNYWZNJNIIKU-UHFFFAOYSA-N 1 3 331.504 2.718 10 0 EFAEHO CC1([NH2+]CCCc2ccccc2)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001484924646 1117828241 /nfs/dbraw/zinc/82/82/41/1117828241.db2.gz POHPPKUMHJSUDJ-UHFFFAOYSA-N 1 3 340.471 2.556 10 0 EFAEHO Cc1ccc(CN2CC[C@H](NC(=O)CC[NH+](C)C)C[C@H]2C)cc1F ZINC001484982562 1117906117 /nfs/dbraw/zinc/90/61/17/1117906117.db2.gz MUFDWGYKHRPPMZ-WBVHZDCISA-N 1 3 335.467 2.555 10 0 EFAEHO CCCCC[NH2+][C@@H](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001484998879 1117924048 /nfs/dbraw/zinc/92/40/48/1117924048.db2.gz SPWKJYKRYZPUPO-MAUKXSAKSA-N 1 3 329.504 2.874 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1Cc2ccccc2[C@H]1NCC1=CCCCC1 ZINC001485044595 1117963629 /nfs/dbraw/zinc/96/36/29/1117963629.db2.gz UHHNVYZODVUIKR-TZIWHRDSSA-N 1 3 341.499 2.810 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@@H]([C@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001485081515 1118031095 /nfs/dbraw/zinc/03/10/95/1118031095.db2.gz FBGFMNNFVRLAAU-RBUKOAKNSA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@@H]([C@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001485081515 1118031101 /nfs/dbraw/zinc/03/11/01/1118031101.db2.gz FBGFMNNFVRLAAU-RBUKOAKNSA-N 1 3 335.536 2.853 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC2CC(C[NH2+]CCCCC(F)(F)F)C2)C1 ZINC001485102515 1118039059 /nfs/dbraw/zinc/03/90/59/1118039059.db2.gz IBJOPWQNUFJANV-NFOMZHRRSA-N 1 3 349.441 2.545 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)C3(N(C)C)CCC3)C2)cc1C ZINC001485094947 1118042159 /nfs/dbraw/zinc/04/21/59/1118042159.db2.gz WEQWZTIKWQNUAL-UHFFFAOYSA-N 1 3 343.515 2.772 10 0 EFAEHO Cc1cc(C[NH2+]CC2CC(NC(=O)CN(C)C(C)C)C2)c(C)s1 ZINC001485110700 1118057299 /nfs/dbraw/zinc/05/72/99/1118057299.db2.gz SQFXYMYGJWXSQT-UHFFFAOYSA-N 1 3 337.533 2.690 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+][C@@H]2CCc3ccc(F)cc32)C1 ZINC001485110837 1118057528 /nfs/dbraw/zinc/05/75/28/1118057528.db2.gz YCABNJGJIOGABW-ITXXBFQVSA-N 1 3 347.478 2.638 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H](C)[NH2+]CCCc1cccc(C)c1 ZINC001485219532 1118139869 /nfs/dbraw/zinc/13/98/69/1118139869.db2.gz YDFLKKFPKZVEEY-CVEARBPZSA-N 1 3 342.487 2.685 10 0 EFAEHO C[C@@H](NCc1ccns1)[C@@H](C)NC(=O)c1cccc(C[NH+](C)C)c1 ZINC001485228177 1118154583 /nfs/dbraw/zinc/15/45/83/1118154583.db2.gz CIDNPDLLACUQMF-ZIAGYGMSSA-N 1 3 346.500 2.501 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001485230184 1118155825 /nfs/dbraw/zinc/15/58/25/1118155825.db2.gz QSDFLSLAYPJLTM-UONOGXRCSA-N 1 3 333.467 2.635 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N(C)CC(C)(C)C[NH2+]Cc1cccnc1 ZINC001485265522 1118184090 /nfs/dbraw/zinc/18/40/90/1118184090.db2.gz CXFFBLBQRGXLAD-IAGOWNOFSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)CC[NH2+]CC(C)(C)CN(C)C(=O)CN1[C@H](C)CC[C@@H]1C ZINC001485265466 1118184329 /nfs/dbraw/zinc/18/43/29/1118184329.db2.gz AXCLBGXYQLMNKE-CALCHBBNSA-N 1 3 325.541 2.980 10 0 EFAEHO CC/C=C/CC[N@H+](C)[C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001485349492 1118271633 /nfs/dbraw/zinc/27/16/33/1118271633.db2.gz GYAJPAOXHFFJEC-UHMOSQCASA-N 1 3 341.515 2.992 10 0 EFAEHO CC/C=C/CC[N@@H+](C)[C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001485349492 1118271634 /nfs/dbraw/zinc/27/16/34/1118271634.db2.gz GYAJPAOXHFFJEC-UHMOSQCASA-N 1 3 341.515 2.992 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC001485389779 1118331263 /nfs/dbraw/zinc/33/12/63/1118331263.db2.gz VMASMFCVWNRUOZ-QFBILLFUSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC001485389779 1118331267 /nfs/dbraw/zinc/33/12/67/1118331267.db2.gz VMASMFCVWNRUOZ-QFBILLFUSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](C(=O)NC1(C[NH2+]Cc2cccnc2C)CCCCC1)N(C)C ZINC001485449500 1118361704 /nfs/dbraw/zinc/36/17/04/1118361704.db2.gz NXKGIROTIQRFTB-GOSISDBHSA-N 1 3 346.519 2.639 10 0 EFAEHO CCCC[C@@H](CNCc1cccnc1)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001485467449 1118376791 /nfs/dbraw/zinc/37/67/91/1118376791.db2.gz CSNRFECMVGXQDX-WDSOQIARSA-N 1 3 346.519 2.577 10 0 EFAEHO CCCC[C@@H](CNCc1cccnc1)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001485467449 1118376796 /nfs/dbraw/zinc/37/67/96/1118376796.db2.gz CSNRFECMVGXQDX-WDSOQIARSA-N 1 3 346.519 2.577 10 0 EFAEHO C[C@@H](NC(=O)CC[NH+](C)C)C1CN(Cc2ccc(C(C)(C)C)cc2)C1 ZINC001485521632 1118434356 /nfs/dbraw/zinc/43/43/56/1118434356.db2.gz GJOQJXUDURYNGB-MRXNPFEDSA-N 1 3 345.531 2.872 10 0 EFAEHO C[C@H](NC(=O)CCCC[NH+]1CCCC1)C1CN(Cc2ccccc2)C1 ZINC001485538229 1118438862 /nfs/dbraw/zinc/43/88/62/1118438862.db2.gz DGMSESCCNWNDHX-SFHVURJKSA-N 1 3 343.515 2.889 10 0 EFAEHO Cc1ccc(C)c(CN2CC([C@H](C)NC(=O)CCCC[NH+](C)C)C2)c1 ZINC001485531927 1118443245 /nfs/dbraw/zinc/44/32/45/1118443245.db2.gz CNWLZHYTDJLKQU-SFHVURJKSA-N 1 3 345.531 2.972 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](CC3CC(C)(C)C3)C[C@H]2C1 ZINC001485657064 1118520471 /nfs/dbraw/zinc/52/04/71/1118520471.db2.gz HYSXYSIJZGWRRD-GUDVDZBRSA-N 1 3 349.563 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](CC3CC(C)(C)C3)C[C@H]2C1 ZINC001485657064 1118520473 /nfs/dbraw/zinc/52/04/73/1118520473.db2.gz HYSXYSIJZGWRRD-GUDVDZBRSA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@@H](CCC[NH2+]Cc1cccnc1)NC(=O)C(C)(C)N1CCCCC1 ZINC001485723186 1118543269 /nfs/dbraw/zinc/54/32/69/1118543269.db2.gz YQUIDKSONGXIJJ-KRWDZBQOSA-N 1 3 346.519 2.721 10 0 EFAEHO Cc1ccc(C[NH2+]CCC[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1F ZINC001485725281 1118544448 /nfs/dbraw/zinc/54/44/48/1118544448.db2.gz WVTDYQOFIZIYSF-MRXNPFEDSA-N 1 3 349.494 2.993 10 0 EFAEHO CN(C)C[C@@H](NC(=O)NCC1(C[NH+](C)C)CCCC1)c1ccccc1 ZINC000184911535 282116571 /nfs/dbraw/zinc/11/65/71/282116571.db2.gz VZCQIUWAKZWVNX-GOSISDBHSA-N 1 3 346.519 2.711 10 0 EFAEHO CC(C)N1CCN(CC[NH2+]Cc2cc(Br)cs2)CC1 ZINC000053382789 214180306 /nfs/dbraw/zinc/18/03/06/214180306.db2.gz UOZYFXFHTSHSIS-UHFFFAOYSA-N 1 3 346.338 2.626 10 0 EFAEHO COCC[N@H+](CC[C@@H](N)c1cccc(Br)c1)C1CC1 ZINC000053941193 214206507 /nfs/dbraw/zinc/20/65/07/214206507.db2.gz QFHPFZIGXOUKQD-OAHLLOKOSA-N 1 3 327.266 2.950 10 0 EFAEHO COCC[N@@H+](CC[C@@H](N)c1cccc(Br)c1)C1CC1 ZINC000053941193 214206510 /nfs/dbraw/zinc/20/65/10/214206510.db2.gz QFHPFZIGXOUKQD-OAHLLOKOSA-N 1 3 327.266 2.950 10 0 EFAEHO C[N@H+](CC[C@@H](N)c1ccccc1Br)C[C@@H]1CCCO1 ZINC000054020421 214210598 /nfs/dbraw/zinc/21/05/98/214210598.db2.gz ANORWTVISZMEJN-SWLSCSKDSA-N 1 3 327.266 2.950 10 0 EFAEHO C[N@@H+](CC[C@@H](N)c1ccccc1Br)C[C@@H]1CCCO1 ZINC000054020421 214210601 /nfs/dbraw/zinc/21/06/01/214210601.db2.gz ANORWTVISZMEJN-SWLSCSKDSA-N 1 3 327.266 2.950 10 0 EFAEHO C[N@H+](Cc1ccc(Br)cc1)[C@@H](CN)[C@@H]1CCCOC1 ZINC000104303788 219373162 /nfs/dbraw/zinc/37/31/62/219373162.db2.gz YBYTYJFPFDVODT-HIFRSBDPSA-N 1 3 327.266 2.635 10 0 EFAEHO C[N@@H+](Cc1ccc(Br)cc1)[C@@H](CN)[C@@H]1CCCOC1 ZINC000104303788 219373165 /nfs/dbraw/zinc/37/31/65/219373165.db2.gz YBYTYJFPFDVODT-HIFRSBDPSA-N 1 3 327.266 2.635 10 0 EFAEHO C[C@@H](O)C[NH+]1CCC(CNCc2ccccc2Br)CC1 ZINC000069349799 215383636 /nfs/dbraw/zinc/38/36/36/215383636.db2.gz SGHDBTWJWYGLGF-CYBMUJFWSA-N 1 3 341.293 2.632 10 0 EFAEHO CN(C)[C@H]1CCCN(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000105091412 219456074 /nfs/dbraw/zinc/45/60/74/219456074.db2.gz BXECUSVPWOWDPR-IBGZPJMESA-N 1 3 344.503 2.518 10 0 EFAEHO CCC[N@H+](CC)C[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000357874064 283183651 /nfs/dbraw/zinc/18/36/51/283183651.db2.gz SDDRJBYOPMVAQD-UHOSZYNNSA-N 1 3 346.519 2.851 10 0 EFAEHO CCC[N@@H+](CC)C[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000357874064 283183654 /nfs/dbraw/zinc/18/36/54/283183654.db2.gz SDDRJBYOPMVAQD-UHOSZYNNSA-N 1 3 346.519 2.851 10 0 EFAEHO CNC(=[NH2+])NC[C@@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000363432212 283273126 /nfs/dbraw/zinc/27/31/26/283273126.db2.gz GTHHNAYWSDQQLT-GXTWGEPZSA-N 1 3 328.382 2.832 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H](C)CC(C)(C)O)CC1 ZINC000449453006 283349919 /nfs/dbraw/zinc/34/99/19/283349919.db2.gz VUEMIBGHMNXEIS-KRWDZBQOSA-N 1 3 333.520 2.858 10 0 EFAEHO CCC[NH+]1CCN(c2ccccc2CN2CCOCC3(CC3)C2)CC1 ZINC000341568628 283349956 /nfs/dbraw/zinc/34/99/56/283349956.db2.gz UPIPFYSAQDQHII-UHFFFAOYSA-N 1 3 343.515 2.831 10 0 EFAEHO C[C@@H]([NH3+])Cc1cc(Br)ccc1OCCN1CCCC1 ZINC000037725259 213163184 /nfs/dbraw/zinc/16/31/84/213163184.db2.gz NNPPIADDYHAFEN-GFCCVEGCSA-N 1 3 327.266 2.813 10 0 EFAEHO OC[C@H](Cc1ccccc1)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000130266201 223138048 /nfs/dbraw/zinc/13/80/48/223138048.db2.gz GPKOFTRVMPETGS-QFIPXVFZSA-N 1 3 338.495 2.887 10 0 EFAEHO CCN1CCC[C@@H]1CNC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000073539409 216394598 /nfs/dbraw/zinc/39/45/98/216394598.db2.gz XZHNPTUUFXCZGO-LJQANCHMSA-N 1 3 344.503 2.566 10 0 EFAEHO Cc1ncsc1CN(C)C[C@H]1CC[N@H+](CCN2CCCCC2)C1 ZINC000195249528 240211315 /nfs/dbraw/zinc/21/13/15/240211315.db2.gz QVUHGHAEMRDIQB-QGZVFWFLSA-N 1 3 336.549 2.691 10 0 EFAEHO Cc1ncsc1CN(C)C[C@H]1CC[N@@H+](CCN2CCCCC2)C1 ZINC000195249528 240211322 /nfs/dbraw/zinc/21/13/22/240211322.db2.gz QVUHGHAEMRDIQB-QGZVFWFLSA-N 1 3 336.549 2.691 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000245848147 243161690 /nfs/dbraw/zinc/16/16/90/243161690.db2.gz FVXQKDIWESXNLD-AOIWGVFYSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000245848147 243161698 /nfs/dbraw/zinc/16/16/98/243161698.db2.gz FVXQKDIWESXNLD-AOIWGVFYSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)[C@H]2CC[C@H]([NH3+])C2)CCN1Cc1ccccc1 ZINC000246714102 243300163 /nfs/dbraw/zinc/30/01/63/243300163.db2.gz XCWMYOAPWSCWKQ-XGXHKWSGSA-N 1 3 329.488 2.625 10 0 EFAEHO CN1CCC(C[NH2+]CCCC2CCCCC2)(N2CCOCC2)CC1 ZINC000414486436 244190720 /nfs/dbraw/zinc/19/07/20/244190720.db2.gz QUNFZJUZTYSKGU-UHFFFAOYSA-N 1 3 337.552 2.733 10 0 EFAEHO CC[C@H]1C[C@H](C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCO1 ZINC000414528532 244214552 /nfs/dbraw/zinc/21/45/52/244214552.db2.gz UHRJIKNFSHYJBB-UXHICEINSA-N 1 3 346.515 2.808 10 0 EFAEHO CCC[C@H](C)C[NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1 ZINC000414556817 244233096 /nfs/dbraw/zinc/23/30/96/244233096.db2.gz OZGBSOXGCTVVII-INIZCTEOSA-N 1 3 331.504 2.910 10 0 EFAEHO CN(c1ccccc1C[NH2+][C@H]1CCC[C@H](CO)C1)C1CCN(C)CC1 ZINC000414573767 244238381 /nfs/dbraw/zinc/23/83/81/244238381.db2.gz MHGGUHGJRNEZEF-HKUYNNGSSA-N 1 3 345.531 2.858 10 0 EFAEHO C[C@H](c1cc2ccccc2o1)[N@H+](C)C[C@H]1CCCN(C(=O)CN)C1 ZINC000414675849 244287764 /nfs/dbraw/zinc/28/77/64/244287764.db2.gz GSLVLFGOSDXEAW-HUUCEWRRSA-N 1 3 329.444 2.623 10 0 EFAEHO C[C@H](c1cc2ccccc2o1)[N@@H+](C)C[C@H]1CCCN(C(=O)CN)C1 ZINC000414675849 244287773 /nfs/dbraw/zinc/28/77/73/244287773.db2.gz GSLVLFGOSDXEAW-HUUCEWRRSA-N 1 3 329.444 2.623 10 0 EFAEHO COC(=O)[C@H](C)Oc1ccc(CNCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000414812466 244363457 /nfs/dbraw/zinc/36/34/57/244363457.db2.gz RIUSERRGSNABAK-GJZGRUSLSA-N 1 3 342.439 2.936 10 0 EFAEHO COC(=O)[C@@H](C)Oc1ccc(CNCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000414812470 244364092 /nfs/dbraw/zinc/36/40/92/244364092.db2.gz RIUSERRGSNABAK-LSDHHAIUSA-N 1 3 342.439 2.936 10 0 EFAEHO c1cc(-c2n[nH]cc2CNCCC[NH2+]Cc2cccnc2)cs1 ZINC000414868333 244377095 /nfs/dbraw/zinc/37/70/95/244377095.db2.gz AFXDLZPJJGCONE-UHFFFAOYSA-N 1 3 327.457 2.803 10 0 EFAEHO Fc1ccc(-c2n[nH]cc2CNCCC[NH2+]Cc2cccnc2)cc1 ZINC000414878041 244383834 /nfs/dbraw/zinc/38/38/34/244383834.db2.gz MZNTZGISGAOCEC-UHFFFAOYSA-N 1 3 339.418 2.880 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@H](C)N[C@H]1CC[NH2+]C[C@@H]1C ZINC000414944912 244397138 /nfs/dbraw/zinc/39/71/38/244397138.db2.gz QRTYTCQCLAFTLK-OBJOEFQTSA-N 1 3 339.867 2.653 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+][C@H]1CCNC[C@@H]1C ZINC000414944912 244397146 /nfs/dbraw/zinc/39/71/46/244397146.db2.gz QRTYTCQCLAFTLK-OBJOEFQTSA-N 1 3 339.867 2.653 10 0 EFAEHO C[C@H]([NH3+])[C@H](C)NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000416831109 244863153 /nfs/dbraw/zinc/86/31/53/244863153.db2.gz HIFFMDHFZZVURK-SOUVJXGZSA-N 1 3 338.521 2.556 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)NCc2cccc(CN(C)C)c2)cc1 ZINC000417061625 245000791 /nfs/dbraw/zinc/00/07/91/245000791.db2.gz FXWPAKVHGQRWIA-OAHLLOKOSA-N 1 3 340.471 2.767 10 0 EFAEHO CCN(C(=O)N[C@@H]1CCC[NH2+]C1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418387559 245142223 /nfs/dbraw/zinc/14/22/23/245142223.db2.gz TXZRAELCTZQWIZ-QXAKKESOSA-N 1 3 344.503 2.605 10 0 EFAEHO CCN(C(=O)N[C@H](C[NH3+])C1CC1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418457226 245164314 /nfs/dbraw/zinc/16/43/14/245164314.db2.gz IGZAZQCGLOLUGZ-KFKAGJAMSA-N 1 3 344.503 2.591 10 0 EFAEHO CCN(CC[NH+]1CCCCCC1)C(=O)NC[C@H](N)c1ccccc1 ZINC000418453877 245164364 /nfs/dbraw/zinc/16/43/64/245164364.db2.gz PUEDSAHDXPFWDF-SFHVURJKSA-N 1 3 332.492 2.594 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)N[C@H](CCC[NH3+])c2ccccc2)CCN1C ZINC000418680712 245242716 /nfs/dbraw/zinc/24/27/16/245242716.db2.gz UUAQIFHUCGVMOX-BPQIPLTHSA-N 1 3 332.492 2.591 10 0 EFAEHO C[C@@H]1CN(CCO)[C@@H](C)CN1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000419325413 245376911 /nfs/dbraw/zinc/37/69/11/245376911.db2.gz BEYIGNJJRTVAOQ-RBUKOAKNSA-N 1 3 345.531 2.559 10 0 EFAEHO C[C@@H]1CN(Cc2ccc(C[NH+]3CCCCC3)cc2)[C@H](C)CN1CCO ZINC000419337827 245383908 /nfs/dbraw/zinc/38/39/08/245383908.db2.gz LGSOPPOCKHNNCG-RTBURBONSA-N 1 3 345.531 2.559 10 0 EFAEHO C[C@@H](C(=O)NCCCC[NH+](C)C)N1CCC(Cc2ccccc2)CC1 ZINC000264928646 247055499 /nfs/dbraw/zinc/05/54/99/247055499.db2.gz MXONGOBVXIEZGD-SFHVURJKSA-N 1 3 345.531 2.788 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CCC[C@@H]2CN2CCCCC2)CCCCC1 ZINC000426460163 247281023 /nfs/dbraw/zinc/28/10/23/247281023.db2.gz MGCYXNJACXTPMB-GOSISDBHSA-N 1 3 335.536 2.975 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)c2ccc(C[NH+]3CCCC3)cc2)CCN1C ZINC000265988239 248000329 /nfs/dbraw/zinc/00/03/29/248000329.db2.gz LIBPLTQVWUNUMK-LPHOPBHVSA-N 1 3 329.488 2.837 10 0 EFAEHO CN(C[C@@H](O)Cc1ccccc1C(F)(F)F)C[C@@H]1CCC[N@H+](C)C1 ZINC000443604808 250211468 /nfs/dbraw/zinc/21/14/68/250211468.db2.gz LYBOPKKGIWSSBM-ZBFHGGJFSA-N 1 3 344.421 2.882 10 0 EFAEHO CN(C[C@@H](O)Cc1ccccc1C(F)(F)F)C[C@@H]1CCC[N@@H+](C)C1 ZINC000443604808 250211471 /nfs/dbraw/zinc/21/14/71/250211471.db2.gz LYBOPKKGIWSSBM-ZBFHGGJFSA-N 1 3 344.421 2.882 10 0 EFAEHO C[C@H]([NH2+]C1(CN[C@@H]2CCN(C3CC3)C2)CCOCC1)c1ccccc1 ZINC000095422924 218364700 /nfs/dbraw/zinc/36/47/00/218364700.db2.gz FGJOCSMUWVIRBB-PKOBYXMFSA-N 1 3 343.515 2.713 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H](C)CCCO)CC1 ZINC000449407373 251016304 /nfs/dbraw/zinc/01/63/04/251016304.db2.gz HFRPJSAIMBAQGT-SFHVURJKSA-N 1 3 333.520 2.717 10 0 EFAEHO C[C@@H]1CN(CC(C)(C)C[N@H+](C)Cc2ccccc2)C[C@H](C)N1CCO ZINC000449530987 251055878 /nfs/dbraw/zinc/05/58/78/251055878.db2.gz FPCMYTVHKMYUQB-KDURUIRLSA-N 1 3 347.547 2.532 10 0 EFAEHO C[C@@H]1CN(CC(C)(C)C[N@@H+](C)Cc2ccccc2)C[C@H](C)N1CCO ZINC000449530987 251055881 /nfs/dbraw/zinc/05/58/81/251055881.db2.gz FPCMYTVHKMYUQB-KDURUIRLSA-N 1 3 347.547 2.532 10 0 EFAEHO CC[C@H](CO)[NH+]1CCN(c2ccnc3ccc(OC(C)C)cc32)CC1 ZINC000450364889 251362133 /nfs/dbraw/zinc/36/21/33/251362133.db2.gz ZIUOBMNSHDCIIA-MRXNPFEDSA-N 1 3 343.471 2.915 10 0 EFAEHO COC[C@@H](O)C[N@@H+]1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000453026485 252020882 /nfs/dbraw/zinc/02/08/82/252020882.db2.gz UTLZODZUBSXREQ-VQTJNVASSA-N 1 3 346.515 2.616 10 0 EFAEHO COC[C@@H](O)C[N@H+]1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000453026485 252020884 /nfs/dbraw/zinc/02/08/84/252020884.db2.gz UTLZODZUBSXREQ-VQTJNVASSA-N 1 3 346.515 2.616 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[N@@H+]1CC[C@@H]2[C@H](CCCN2C)C1 ZINC000268740232 252189502 /nfs/dbraw/zinc/18/95/02/252189502.db2.gz POPFZCJSDQESBT-QWFCFKBJSA-N 1 3 346.515 2.966 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H]2[C@H](CCCN2C)C1 ZINC000268740232 252189504 /nfs/dbraw/zinc/18/95/04/252189504.db2.gz POPFZCJSDQESBT-QWFCFKBJSA-N 1 3 346.515 2.966 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCCNC(=O)c1ccco1 ZINC000268765409 252214506 /nfs/dbraw/zinc/21/45/06/252214506.db2.gz PQXQYUBHSYTJSJ-AEFFLSMTSA-N 1 3 341.455 2.510 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCCNC(=O)c1ccco1 ZINC000268765409 252214509 /nfs/dbraw/zinc/21/45/09/252214509.db2.gz PQXQYUBHSYTJSJ-AEFFLSMTSA-N 1 3 341.455 2.510 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CCCCN2CCOCC2)CCN1Cc1ccccc1 ZINC000268782072 252232575 /nfs/dbraw/zinc/23/25/75/252232575.db2.gz QEBTXGLZXISHMY-PZJWPPBQSA-N 1 3 345.531 2.742 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCCN1CCSCC1 ZINC000268863706 252312448 /nfs/dbraw/zinc/31/24/48/252312448.db2.gz GUVMPENYKNLXJW-HKUYNNGSSA-N 1 3 333.545 2.535 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCCN1CCSCC1 ZINC000268863706 252312451 /nfs/dbraw/zinc/31/24/51/252312451.db2.gz GUVMPENYKNLXJW-HKUYNNGSSA-N 1 3 333.545 2.535 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NCC(C)(C)[NH+]1CCCCC1 ZINC000097394941 219021438 /nfs/dbraw/zinc/02/14/38/219021438.db2.gz WTTNCGNMMNHWHN-INIZCTEOSA-N 1 3 326.529 2.526 10 0 EFAEHO CC[NH+]1CCC(C(=O)N(C)CCN(C)C2CC2)(c2ccccc2)CC1 ZINC000408523132 285183822 /nfs/dbraw/zinc/18/38/22/285183822.db2.gz PDPQYYAKKXDPBW-UHFFFAOYSA-N 1 3 343.515 2.593 10 0 EFAEHO C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)C(=O)N1CCCC1 ZINC000343465989 142003875 /nfs/dbraw/zinc/00/38/75/142003875.db2.gz QGUAKZXZDWTNHF-OHSMVPPVSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@H]1CN(C(=O)C2(C[NH+](C)C)CCCCC2)CCN(C2CCC2)C1 ZINC000344766725 142074847 /nfs/dbraw/zinc/07/48/47/142074847.db2.gz FOUQHOAZUPWYQS-QGZVFWFLSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H](CCC(F)(F)F)[NH2+]Cc1ccc(C(=O)NCCN(C)C)cc1 ZINC000346321094 142189292 /nfs/dbraw/zinc/18/92/92/142189292.db2.gz LPDJZJHFFJVMRZ-CYBMUJFWSA-N 1 3 345.409 2.799 10 0 EFAEHO C[C@H](NC1CC[NH+](CCC(=O)N(C)C)CC1)c1ccc(Cl)cc1 ZINC000347998477 142306091 /nfs/dbraw/zinc/30/60/91/142306091.db2.gz ICFGBWSTDWGXOP-AWEZNQCLSA-N 1 3 337.895 2.933 10 0 EFAEHO CN(C(=O)NCCC[N@H+](C)C1CCCCC1)[C@H]1CCN(C2CC2)C1 ZINC000349612319 142340274 /nfs/dbraw/zinc/34/02/74/142340274.db2.gz ANQBXQBFLZWCDX-SFHVURJKSA-N 1 3 336.524 2.519 10 0 EFAEHO CN(C(=O)NCCC[N@@H+](C)C1CCCCC1)[C@H]1CCN(C2CC2)C1 ZINC000349612319 142340275 /nfs/dbraw/zinc/34/02/75/142340275.db2.gz ANQBXQBFLZWCDX-SFHVURJKSA-N 1 3 336.524 2.519 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000349904607 142376524 /nfs/dbraw/zinc/37/65/24/142376524.db2.gz CIPWAESMHIETOU-ZHALLVOQSA-N 1 3 346.519 2.536 10 0 EFAEHO O=C([C@@H]1CCCN1C1CCCC1)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000439845209 304331482 /nfs/dbraw/zinc/33/14/82/304331482.db2.gz YDABXQHJAXVOFD-OALUTQOASA-N 1 3 333.520 2.870 10 0 EFAEHO CCN1CC[C@@H](C[NH2+]Cc2ccc(OC)c3oc(C(=O)OC)cc32)C1 ZINC000343553817 145236597 /nfs/dbraw/zinc/23/65/97/145236597.db2.gz DJNJPOPLEHTYDV-ZDUSSCGKSA-N 1 3 346.427 2.659 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+]Cc2cc(-n3ccnc3)cs2)C[C@H](C)O1 ZINC000344112290 145370645 /nfs/dbraw/zinc/37/06/45/145370645.db2.gz LGTFFIMXYGQGGU-IYBDPMFKSA-N 1 3 348.516 2.913 10 0 EFAEHO Cc1cccc(O[C@@H]2CCCC[C@@H]2NC[C@@H](O)C[N@@H+](C)C2CC2)c1 ZINC000351601917 146156467 /nfs/dbraw/zinc/15/64/67/146156467.db2.gz GWQZGJDRVIPVTJ-YZGWKJHDSA-N 1 3 332.488 2.730 10 0 EFAEHO Cc1cccc(O[C@@H]2CCCC[C@@H]2NC[C@@H](O)C[N@H+](C)C2CC2)c1 ZINC000351601917 146156469 /nfs/dbraw/zinc/15/64/69/146156469.db2.gz GWQZGJDRVIPVTJ-YZGWKJHDSA-N 1 3 332.488 2.730 10 0 EFAEHO CN(C)C[C@H](Cc1ccccc1)NC(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000351917265 146234745 /nfs/dbraw/zinc/23/47/45/146234745.db2.gz OFGJCAACQOQFAP-OALUTQOASA-N 1 3 331.504 2.540 10 0 EFAEHO CN(C)C[C@H](Cc1ccccc1)NC(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000351917265 146234746 /nfs/dbraw/zinc/23/47/46/146234746.db2.gz OFGJCAACQOQFAP-OALUTQOASA-N 1 3 331.504 2.540 10 0 EFAEHO CC[C@H]1C[C@@H](CN2CCN(C3CC[NH+](C(C)C)CC3)CC2)CCO1 ZINC000356997555 147395731 /nfs/dbraw/zinc/39/57/31/147395731.db2.gz RWGMCIPJVNWXSZ-ICSRJNTNSA-N 1 3 337.552 2.682 10 0 EFAEHO CN(C)C(=O)CC[NH+]1CCC(N[C@@H](c2ccc(F)cc2)C2CC2)CC1 ZINC000359367548 148067547 /nfs/dbraw/zinc/06/75/47/148067547.db2.gz BOTKYPYJROLSKT-HXUWFJFHSA-N 1 3 347.478 2.809 10 0 EFAEHO CO[C@@]1(CNC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCOC1 ZINC000359391412 148073579 /nfs/dbraw/zinc/07/35/79/148073579.db2.gz HFAAABYKYMEDDE-RAFMOHDBSA-N 1 3 330.472 2.577 10 0 EFAEHO CO[C@@]1(CNC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCOC1 ZINC000359391412 148073582 /nfs/dbraw/zinc/07/35/82/148073582.db2.gz HFAAABYKYMEDDE-RAFMOHDBSA-N 1 3 330.472 2.577 10 0 EFAEHO CC(C)[N@@H+](C)C[C@H](C)NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000360123525 148277090 /nfs/dbraw/zinc/27/70/90/148277090.db2.gz HIOFXKQUNDLPJT-HKUYNNGSSA-N 1 3 346.519 2.631 10 0 EFAEHO CC(C)[N@H+](C)C[C@H](C)NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000360123525 148277091 /nfs/dbraw/zinc/27/70/91/148277091.db2.gz HIOFXKQUNDLPJT-HKUYNNGSSA-N 1 3 346.519 2.631 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]CCN2[C@H](C)CCC[C@@H]2C)[C@H](C)C1 ZINC000361218489 286062735 /nfs/dbraw/zinc/06/27/35/286062735.db2.gz YTHAFKGHJCVHLW-ZRNYENFQSA-N 1 3 339.568 2.976 10 0 EFAEHO Cc1cc(N2CCC[C@@H](NC3CC[NH+](C(C)(C)C)CC3)C2)n(C)n1 ZINC000368475718 150126489 /nfs/dbraw/zinc/12/64/89/150126489.db2.gz VTVGUGHHQIEGAW-QGZVFWFLSA-N 1 3 333.524 2.550 10 0 EFAEHO COCC[C@@H]1CCCC[N@H+](CCCN2CCN(C(C)C)CC2)C1 ZINC000374295559 151316867 /nfs/dbraw/zinc/31/68/67/151316867.db2.gz MMHUNMHOBLKGLZ-IBGZPJMESA-N 1 3 325.541 2.541 10 0 EFAEHO COCC[C@@H]1CCCC[N@@H+](CCCN2CCN(C(C)C)CC2)C1 ZINC000374295559 151316869 /nfs/dbraw/zinc/31/68/69/151316869.db2.gz MMHUNMHOBLKGLZ-IBGZPJMESA-N 1 3 325.541 2.541 10 0 EFAEHO COCC1CCC([NH2+]CC2(N3CCCCC3)CCN(C)CC2)CC1 ZINC000449166683 292263862 /nfs/dbraw/zinc/26/38/62/292263862.db2.gz FNOMIPSTZHHEFW-UHFFFAOYSA-N 1 3 337.552 2.732 10 0 EFAEHO CC[C@@H]1C[C@H](C[N@H+](CCN(C)C)C[C@H]2CCCN2CC)CCO1 ZINC000349039059 287302822 /nfs/dbraw/zinc/30/28/22/287302822.db2.gz WUHRPQJRYKDUOX-GUDVDZBRSA-N 1 3 325.541 2.540 10 0 EFAEHO CC[C@@H]1C[C@H](C[N@@H+](CCN(C)C)C[C@H]2CCCN2CC)CCO1 ZINC000349039059 287302824 /nfs/dbraw/zinc/30/28/24/287302824.db2.gz WUHRPQJRYKDUOX-GUDVDZBRSA-N 1 3 325.541 2.540 10 0 EFAEHO CC[C@@H]1[C@H](CO)CC[N@@H+]1Cc1ccccc1N(C)C1CCN(C)CC1 ZINC000449427075 287370597 /nfs/dbraw/zinc/37/05/97/287370597.db2.gz RUNZITDGWPXEAX-AZUAARDMSA-N 1 3 345.531 2.810 10 0 EFAEHO CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1ccccc1N(C)C1CCN(C)CC1 ZINC000449427075 287370601 /nfs/dbraw/zinc/37/06/01/287370601.db2.gz RUNZITDGWPXEAX-AZUAARDMSA-N 1 3 345.531 2.810 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CCCN2Cc2ccccc2)CC[N@@H+]1C ZINC000122720278 222144529 /nfs/dbraw/zinc/14/45/29/222144529.db2.gz AZNQTAUBCWVQBJ-QRQLOZEOSA-N 1 3 329.488 2.592 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CCCN2Cc2ccccc2)CC[N@H+]1C ZINC000122720278 222144531 /nfs/dbraw/zinc/14/45/31/222144531.db2.gz AZNQTAUBCWVQBJ-QRQLOZEOSA-N 1 3 329.488 2.592 10 0 EFAEHO CC[NH+](CC)CCOc1ccc(CN[C@H]2CCCOC2)cc1OC ZINC000164932421 544844604 /nfs/dbraw/zinc/84/46/04/544844604.db2.gz SRKNHILGFDIAGL-KRWDZBQOSA-N 1 3 336.476 2.684 10 0 EFAEHO CN1CCN(CCC(C)(C)[NH2+]Cc2cnc(-c3ccccc3)[nH]2)CC1 ZINC000185897333 265051704 /nfs/dbraw/zinc/05/17/04/265051704.db2.gz OCOGJWBCGPAJDG-UHFFFAOYSA-N 1 3 341.503 2.582 10 0 EFAEHO CCO[C@H]1C[C@H]([NH2+]C2CCN(C3CCCC3)CC2)C12CCOCC2 ZINC000186374503 265063315 /nfs/dbraw/zinc/06/33/15/265063315.db2.gz YQBMPMKRXZZIDT-OALUTQOASA-N 1 3 336.520 2.957 10 0 EFAEHO CCO[C@H]1C[C@H](NC2CC[NH+](C3CCCC3)CC2)C12CCOCC2 ZINC000186374503 265063318 /nfs/dbraw/zinc/06/33/18/265063318.db2.gz YQBMPMKRXZZIDT-OALUTQOASA-N 1 3 336.520 2.957 10 0 EFAEHO c1cc(OCCCN2CCC(C[NH+]3CCCC3)CC2)cc2c1OCO2 ZINC000194740702 265385571 /nfs/dbraw/zinc/38/55/71/265385571.db2.gz BIUGZODJZGBYGQ-UHFFFAOYSA-N 1 3 346.471 2.992 10 0 EFAEHO CC(C)N1C[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)CC1=O ZINC000272281473 266214144 /nfs/dbraw/zinc/21/41/44/266214144.db2.gz AHLFKUKAYALYPH-LWYYNNOASA-N 1 3 341.499 2.781 10 0 EFAEHO CC(C)N1C[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)CC1=O ZINC000272281465 266214573 /nfs/dbraw/zinc/21/45/73/266214573.db2.gz AHLFKUKAYALYPH-HAGHYFMRSA-N 1 3 341.499 2.781 10 0 EFAEHO Fc1ccc(OCCN2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000173961308 273026780 /nfs/dbraw/zinc/02/67/80/273026780.db2.gz BRVCNEAKOZPOJL-UHFFFAOYSA-N 1 3 336.451 2.781 10 0 EFAEHO C[C@H]1CN(CCCC[NH2+]Cc2ccnn2-c2ccccc2)C[C@H](C)O1 ZINC000279169772 273184283 /nfs/dbraw/zinc/18/42/83/273184283.db2.gz QPXLBSBGWFZIFD-ROUUACIJSA-N 1 3 342.487 2.851 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@@H](c2cccs2)N2CCCC2)CC[N@@H+]1C ZINC000279233940 273191348 /nfs/dbraw/zinc/19/13/48/273191348.db2.gz QQBDOJHJNDNVIU-JYJNAYRXSA-N 1 3 335.517 2.732 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@@H](c2cccs2)N2CCCC2)CC[N@H+]1C ZINC000279233940 273191349 /nfs/dbraw/zinc/19/13/49/273191349.db2.gz QQBDOJHJNDNVIU-JYJNAYRXSA-N 1 3 335.517 2.732 10 0 EFAEHO CN(C)CCNC(=O)c1ccc(C[NH2+][C@@H]2CCC[C@H]3C[C@]32C)cc1 ZINC000282185935 273526538 /nfs/dbraw/zinc/52/65/38/273526538.db2.gz NBXDTWCLPFQMIZ-NLWGTHIKSA-N 1 3 329.488 2.646 10 0 EFAEHO COCCCC[N@H+](C)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000117880205 274019060 /nfs/dbraw/zinc/01/90/60/274019060.db2.gz MOGORBVOHVKEFR-FQEVSTJZSA-N 1 3 334.504 2.790 10 0 EFAEHO COCCCC[N@@H+](C)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000117880205 274019062 /nfs/dbraw/zinc/01/90/62/274019062.db2.gz MOGORBVOHVKEFR-FQEVSTJZSA-N 1 3 334.504 2.790 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@@H]1CCOc2c(Br)cccc21 ZINC000423112664 274048507 /nfs/dbraw/zinc/04/85/07/274048507.db2.gz JWIKPRVKKMYVDD-SMDDNHRTSA-N 1 3 343.265 2.616 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccc(C[NH3+])cc1 ZINC000374461679 274355154 /nfs/dbraw/zinc/35/51/54/274355154.db2.gz YDFUTBOIGXXUCI-OXQOHEQNSA-N 1 3 337.467 2.786 10 0 EFAEHO CC1(C)COC[C@@H]1NCc1cccc(C[NH2+][C@H]2COCC2(C)C)c1 ZINC000451811228 276139448 /nfs/dbraw/zinc/13/94/48/276139448.db2.gz MWNDEMDWXVRZRW-ROUUACIJSA-N 1 3 332.488 2.716 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCC[C@@H](C)[N@H+](C)Cc2ccccc2)C1 ZINC000175361419 276166792 /nfs/dbraw/zinc/16/67/92/276166792.db2.gz WIRXHSXAQRDBPK-IEBWSBKVSA-N 1 3 346.519 2.681 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)C1 ZINC000175361419 276166796 /nfs/dbraw/zinc/16/67/96/276166796.db2.gz WIRXHSXAQRDBPK-IEBWSBKVSA-N 1 3 346.519 2.681 10 0 EFAEHO CC1=CCN(CCNC(=O)N[C@@H](C)[C@H](c2ccccc2)[NH+](C)C)CC1 ZINC000355079840 276182943 /nfs/dbraw/zinc/18/29/43/276182943.db2.gz QNQPUKHXJFOHCR-PKOBYXMFSA-N 1 3 344.503 2.629 10 0 EFAEHO CCN1CCC[C@H]1CNC(=[NH2+])NC[C@H]1CC[C@H](c2ccccc2)O1 ZINC000377438645 276184467 /nfs/dbraw/zinc/18/44/67/276184467.db2.gz SOAUZNDUKJMSRY-RCCFBDPRSA-N 1 3 330.476 2.505 10 0 EFAEHO CN1CCCN(C(=O)NCc2ccccc2C[NH+]2CCCCC2)CC1 ZINC000339586122 277048102 /nfs/dbraw/zinc/04/81/02/277048102.db2.gz DROWRIUWULGZFB-UHFFFAOYSA-N 1 3 344.503 2.520 10 0 EFAEHO COC[C@]1(CN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)OCCc2ccccc21 ZINC000353564785 277269581 /nfs/dbraw/zinc/26/95/81/277269581.db2.gz IQAVNTNDQKFWRP-WLRLJWMZSA-N 1 3 344.499 2.563 10 0 EFAEHO COC[C@]1(CN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@@H]32)OCCc2ccccc21 ZINC000353564785 277269583 /nfs/dbraw/zinc/26/95/83/277269583.db2.gz IQAVNTNDQKFWRP-WLRLJWMZSA-N 1 3 344.499 2.563 10 0 EFAEHO CC(C)c1ccc([C@@H](N)CNC(=O)[C@H](C[NH3+])c2ccc(F)cc2)cc1 ZINC000358742215 278045688 /nfs/dbraw/zinc/04/56/88/278045688.db2.gz IZGAQXCAODJDHI-MOPGFXCFSA-N 1 3 343.446 2.808 10 0 EFAEHO CC(CN1CC[C@@]2(C1)CCCOC2)C[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC000341993655 278156692 /nfs/dbraw/zinc/15/66/92/278156692.db2.gz PXOPWDCXGGSWAR-WOJBJXKFSA-N 1 3 336.520 2.628 10 0 EFAEHO CC(CN1CC[C@@]2(C1)CCCOC2)C[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000341993655 278156695 /nfs/dbraw/zinc/15/66/95/278156695.db2.gz PXOPWDCXGGSWAR-WOJBJXKFSA-N 1 3 336.520 2.628 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@H]1CC[N@H+](C)[C@H](C)C1)N(C)Cc1ccccc1 ZINC000246185280 278270652 /nfs/dbraw/zinc/27/06/52/278270652.db2.gz MBSGHWWLXDXEMT-AOIWGVFYSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1)N(C)Cc1ccccc1 ZINC000246185280 278270653 /nfs/dbraw/zinc/27/06/53/278270653.db2.gz MBSGHWWLXDXEMT-AOIWGVFYSA-N 1 3 346.519 2.631 10 0 EFAEHO CCN1CCN(Cc2ccccc2C[NH2+][C@@H]2CC[C@H]2SC)CC1 ZINC000425334373 279364210 /nfs/dbraw/zinc/36/42/10/279364210.db2.gz DPGOAJVOMODXJJ-RTBURBONSA-N 1 3 333.545 2.808 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)N(C)C ZINC000350060200 280172508 /nfs/dbraw/zinc/17/25/08/280172508.db2.gz PTWKWQXRPKWVDP-USXIJHARSA-N 1 3 337.533 2.833 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)N(C)C ZINC000350060200 280172510 /nfs/dbraw/zinc/17/25/10/280172510.db2.gz PTWKWQXRPKWVDP-USXIJHARSA-N 1 3 337.533 2.833 10 0 EFAEHO CC[C@@H]1CCCCN1CCNC(=O)N1CCC([NH+]2CCCC2)CC1 ZINC000077644850 280249576 /nfs/dbraw/zinc/24/95/76/280249576.db2.gz YMUOMDAGBGBFAN-QGZVFWFLSA-N 1 3 336.524 2.521 10 0 EFAEHO CN(C)[C@@H](CNC(=O)C[NH2+][C@@H]1CC2CCC1CC2)c1ccccc1 ZINC000433069525 289278026 /nfs/dbraw/zinc/27/80/26/289278026.db2.gz VMFOVYUNXBCOIY-HWMSQKFYSA-N 1 3 329.488 2.574 10 0 EFAEHO CN1CCC(C[NH2+][C@@H]2CCOC3(CCC3)C2)(N2CCCCC2)CC1 ZINC000449166738 289879758 /nfs/dbraw/zinc/87/97/58/289879758.db2.gz FXVXTGSWKPGSPO-GOSISDBHSA-N 1 3 335.536 2.628 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCCCC[NH+]2CCCC2)[C@H]1c1ccccc1 ZINC000245663959 290139586 /nfs/dbraw/zinc/13/95/86/290139586.db2.gz QJSYCCQUAOEDSM-RTBURBONSA-N 1 3 344.503 2.607 10 0 EFAEHO C[C@@H](C[NH2+]C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)CN1CCCC1 ZINC000130006677 293150706 /nfs/dbraw/zinc/15/07/06/293150706.db2.gz QFNQDSFYSXXDCT-IRXDYDNUSA-N 1 3 339.524 2.955 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)NCc1cccc(CN(C)C)c1 ZINC000151812650 293303508 /nfs/dbraw/zinc/30/35/08/293303508.db2.gz VHSKUNKSYOPJKM-LJQANCHMSA-N 1 3 346.519 2.668 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)NCc1cccc(CN(C)C)c1 ZINC000151812650 293303509 /nfs/dbraw/zinc/30/35/09/293303509.db2.gz VHSKUNKSYOPJKM-LJQANCHMSA-N 1 3 346.519 2.668 10 0 EFAEHO CC(=O)N[C@@H]1CCC[N@@H+](CC(C)(C)CN(C)Cc2ccccc2)C1 ZINC000153895301 293399832 /nfs/dbraw/zinc/39/98/32/293399832.db2.gz RFPXHFPVJYODFS-LJQANCHMSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(=O)N[C@@H]1CCC[N@H+](CC(C)(C)CN(C)Cc2ccccc2)C1 ZINC000153895301 293399833 /nfs/dbraw/zinc/39/98/33/293399833.db2.gz RFPXHFPVJYODFS-LJQANCHMSA-N 1 3 331.504 2.745 10 0 EFAEHO CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)CC1CCN(C)CC1 ZINC000291446130 294383345 /nfs/dbraw/zinc/38/33/45/294383345.db2.gz GQVXXLGIZCRXAU-UHFFFAOYSA-N 1 3 331.504 2.829 10 0 EFAEHO CN1CCC(N(Cc2ccccc2)C(=O)CC2CC[NH+](C)CC2)CC1 ZINC000291953715 294533010 /nfs/dbraw/zinc/53/30/10/294533010.db2.gz OJSWFABJHLMFME-UHFFFAOYSA-N 1 3 343.515 2.841 10 0 EFAEHO CC[C@H](N[C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H](O)C(F)F ZINC000294970447 295252575 /nfs/dbraw/zinc/25/25/75/295252575.db2.gz FRNBEQATJMDVFP-MXASKKJJSA-N 1 3 326.431 2.891 10 0 EFAEHO CC[C@H](N[C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H](O)C(F)F ZINC000294970447 295252576 /nfs/dbraw/zinc/25/25/76/295252576.db2.gz FRNBEQATJMDVFP-MXASKKJJSA-N 1 3 326.431 2.891 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)NC2CC[NH+](C3CCC3)CC2)c1 ZINC000296225852 295444294 /nfs/dbraw/zinc/44/42/94/295444294.db2.gz FZVCXBPXMBHEMD-UHFFFAOYSA-N 1 3 330.476 2.887 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)NCCN2CCCC[C@H]2C)C1 ZINC000337361959 297228005 /nfs/dbraw/zinc/22/80/05/297228005.db2.gz IQRDFZDHEBBGLZ-KZNAEPCWSA-N 1 3 338.540 2.528 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc1 ZINC000423292100 299004044 /nfs/dbraw/zinc/00/40/44/299004044.db2.gz LJDDWPPZSIJRNY-KBPBESRZSA-N 1 3 332.469 2.961 10 0 EFAEHO Cc1cc(N2CCC[C@H](N[C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)C2)n(C)n1 ZINC000423074616 301338133 /nfs/dbraw/zinc/33/81/33/301338133.db2.gz MIJWQRMMAIBYFA-INDMIFKZSA-N 1 3 345.535 2.598 10 0 EFAEHO Cc1ccccc1[C@H]([C@H](C)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)N(C)C ZINC000356254074 302207551 /nfs/dbraw/zinc/20/75/51/302207551.db2.gz BKWOAQAPPJENDC-DWRORGKVSA-N 1 3 331.504 2.833 10 0 EFAEHO Cc1ccccc1[C@H]([C@H](C)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)N(C)C ZINC000356254074 302207555 /nfs/dbraw/zinc/20/75/55/302207555.db2.gz BKWOAQAPPJENDC-DWRORGKVSA-N 1 3 331.504 2.833 10 0 EFAEHO CN(CC1CCCCC1)C(=O)CN1CCC(C[NH+]2CCCC2)CC1 ZINC000171386183 310747028 /nfs/dbraw/zinc/74/70/28/310747028.db2.gz AKAAQJUHDFTCKE-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO C[C@@H]1CCCC[C@@H]1N(C)C(=O)CN1CCC(C[NH+]2CCCC2)CC1 ZINC000171386107 310747190 /nfs/dbraw/zinc/74/71/90/310747190.db2.gz NYFSFEWTIIAVHI-MJGOQNOKSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000298769699 311021821 /nfs/dbraw/zinc/02/18/21/311021821.db2.gz SZTWHARBAXENFW-KRWDZBQOSA-N 1 3 329.488 2.887 10 0 EFAEHO CC(C)N1CC[C@@H](C[NH2+]C[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000304975749 311214441 /nfs/dbraw/zinc/21/44/41/311214441.db2.gz ZJWYLWMHIHMEJZ-SJORKVTESA-N 1 3 339.524 2.953 10 0 EFAEHO CCCN1CCN(c2ccccc2CNC[C@@]2(C)CCC[NH2+]C2)CC1 ZINC000414905642 312060829 /nfs/dbraw/zinc/06/08/29/312060829.db2.gz LQSLVDOKPGGPFN-NRFANRHFSA-N 1 3 344.547 2.698 10 0 EFAEHO CCCN1CCN(c2ccccc2CNC[C@]2(C)CCC[NH2+]C2)CC1 ZINC000414905645 312061031 /nfs/dbraw/zinc/06/10/31/312061031.db2.gz LQSLVDOKPGGPFN-OAQYLSRUSA-N 1 3 344.547 2.698 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000415057048 312084788 /nfs/dbraw/zinc/08/47/88/312084788.db2.gz SZFLWACSCASSLW-LPHOPBHVSA-N 1 3 325.460 2.540 10 0 EFAEHO C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+][C@@H]1CCCCNC1 ZINC000415064617 312086698 /nfs/dbraw/zinc/08/66/98/312086698.db2.gz DAROQHHNLFHCRE-WMLDXEAASA-N 1 3 337.895 2.809 10 0 EFAEHO CC(C)C[C@@H](N)C[NH2+]C1CCN(Cc2ccc(F)c(F)c2)CC1 ZINC000415112440 312096465 /nfs/dbraw/zinc/09/64/65/312096465.db2.gz RXVAMSOYHXGNKS-OAHLLOKOSA-N 1 3 325.447 2.892 10 0 EFAEHO CC(C)C[C@@H]([NH3+])CNC1CCN(Cc2ccc(F)c(F)c2)CC1 ZINC000415112440 312096468 /nfs/dbraw/zinc/09/64/68/312096468.db2.gz RXVAMSOYHXGNKS-OAHLLOKOSA-N 1 3 325.447 2.892 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2CC[C@H](C)[C@H](C[NH3+])C2)CC1 ZINC000415133245 312100380 /nfs/dbraw/zinc/10/03/80/312100380.db2.gz UZNHCCYDFGNXBW-AZUAARDMSA-N 1 3 344.547 2.635 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)[C@H](C)C1 ZINC000415963885 312186248 /nfs/dbraw/zinc/18/62/48/312186248.db2.gz WKQVQIUGDIIXEJ-DYVFJYSZSA-N 1 3 348.466 2.665 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)[C@H](C)C1 ZINC000415963885 312186249 /nfs/dbraw/zinc/18/62/49/312186249.db2.gz WKQVQIUGDIIXEJ-DYVFJYSZSA-N 1 3 348.466 2.665 10 0 EFAEHO CCCC[N@H+](C)C[C@@H](C)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415963412 312186503 /nfs/dbraw/zinc/18/65/03/312186503.db2.gz VLZSDRVKWQTOJM-CYBMUJFWSA-N 1 3 336.455 2.713 10 0 EFAEHO CCCC[N@@H+](C)C[C@@H](C)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415963412 312186505 /nfs/dbraw/zinc/18/65/05/312186505.db2.gz VLZSDRVKWQTOJM-CYBMUJFWSA-N 1 3 336.455 2.713 10 0 EFAEHO CCCN(CCC[NH+](C)C)C(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415973470 312188171 /nfs/dbraw/zinc/18/81/71/312188171.db2.gz NATARDODKXRRMS-UHFFFAOYSA-N 1 3 336.455 2.667 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)NCCN2[C@H](C)CCC[C@@H]2C)cc1 ZINC000417529362 312235215 /nfs/dbraw/zinc/23/52/15/312235215.db2.gz GIUXMLHNRNCIKY-OWCLPIDISA-N 1 3 332.492 2.768 10 0 EFAEHO C[C@@H](NC(C)(C)CNC(=O)N(C1CC1)[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000417710865 312259715 /nfs/dbraw/zinc/25/97/15/312259715.db2.gz VHFYKDVDYQKTLE-CRAIPNDOSA-N 1 3 344.503 2.652 10 0 EFAEHO CCCN(C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)C1CC[NH2+]CC1 ZINC000417935238 312298307 /nfs/dbraw/zinc/29/83/07/312298307.db2.gz GKJMQFHGPULSHG-RBUKOAKNSA-N 1 3 344.503 2.605 10 0 EFAEHO CN(CC(C)(C)C[NH3+])C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000418046848 312315908 /nfs/dbraw/zinc/31/59/08/312315908.db2.gz RJQJVKDVOYGUPO-HXUWFJFHSA-N 1 3 346.519 2.667 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)NC[C@@H]2N(C)CCCC2(C)C)cc1 ZINC000418096441 312324828 /nfs/dbraw/zinc/32/48/28/312324828.db2.gz IQOQJTARANFBBS-PBHICJAKSA-N 1 3 332.492 2.626 10 0 EFAEHO CC[C@@H](C)N[C@H](CNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccco1 ZINC000418171712 312339362 /nfs/dbraw/zinc/33/93/62/312339362.db2.gz VHJLAGCBUPYXKN-CTVHLWBWSA-N 1 3 348.491 2.633 10 0 EFAEHO Cc1ccccc1[C@H]([C@H](C)NC(=O)N(C1CC1)[C@H]1CC[NH2+]C1)N(C)C ZINC000418181176 312341301 /nfs/dbraw/zinc/34/13/01/312341301.db2.gz KWLFZSKVHBPVDZ-IEZWGBDMSA-N 1 3 344.503 2.522 10 0 EFAEHO CCc1ccc([C@@H](CNC(=O)N2CC[C@H]([NH3+])[C@@H]2C)N(CC)CC)cc1 ZINC000418213219 312348140 /nfs/dbraw/zinc/34/81/40/312348140.db2.gz KMXGTDGMPZFWMZ-ZYSHUDEJSA-N 1 3 346.519 2.763 10 0 EFAEHO CCc1cc(CCC[NH+]2CCC(C)(CN3CCN(C)CC3)CC2)on1 ZINC000450738975 312735700 /nfs/dbraw/zinc/73/57/00/312735700.db2.gz PPCBOEONYFJHGK-UHFFFAOYSA-N 1 3 348.535 2.519 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)NC34CCC(CC3)CC4)CC2)CC1 ZINC000458129819 313076151 /nfs/dbraw/zinc/07/61/51/313076151.db2.gz OOBLLVDEGDMSAX-UHFFFAOYSA-N 1 3 348.535 2.567 10 0 EFAEHO CC(C)c1noc(CCC[NH2+]C2CCN(c3ccncc3)CC2)n1 ZINC000459415014 313104125 /nfs/dbraw/zinc/10/41/25/313104125.db2.gz ZDBOJGALWRAMDL-UHFFFAOYSA-N 1 3 329.448 2.779 10 0 EFAEHO CCc1cccc(F)c1C[N@@H+]1CC[C@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000474263477 313206647 /nfs/dbraw/zinc/20/66/47/313206647.db2.gz CSGBYVTWBDYXJE-JXFKEZNVSA-N 1 3 333.495 2.846 10 0 EFAEHO CCc1cccc(F)c1C[N@H+]1CC[C@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000474263477 313206652 /nfs/dbraw/zinc/20/66/52/313206652.db2.gz CSGBYVTWBDYXJE-JXFKEZNVSA-N 1 3 333.495 2.846 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[N@H+](C)C1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000524300304 316153301 /nfs/dbraw/zinc/15/33/01/316153301.db2.gz JXKXIMQLOAMFOS-QXAKKESOSA-N 1 3 329.488 2.622 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[N@@H+](C)C1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000524300304 316153303 /nfs/dbraw/zinc/15/33/03/316153303.db2.gz JXKXIMQLOAMFOS-QXAKKESOSA-N 1 3 329.488 2.622 10 0 EFAEHO CCC[C@H](NC(=O)N(CCN(C)C)CC[NH+](C)C)C1CCCCC1 ZINC000524920527 316181271 /nfs/dbraw/zinc/18/12/71/316181271.db2.gz GATDPUVBABPOOQ-SFHVURJKSA-N 1 3 340.556 2.870 10 0 EFAEHO CC(C)(C)N1CCCN(C(=O)NC2CC([NH+]3CCCCC3)C2)CC1 ZINC000527241231 316354531 /nfs/dbraw/zinc/35/45/31/316354531.db2.gz ZVWZFEZDGCBXJW-UHFFFAOYSA-N 1 3 336.524 2.519 10 0 EFAEHO Cc1cc(CNCc2ccc(C[NH+]3CCC(O)CC3)cc2)ccn1 ZINC000527655396 316424150 /nfs/dbraw/zinc/42/41/50/316424150.db2.gz DLESONVTNDSYKJ-UHFFFAOYSA-N 1 3 325.456 2.637 10 0 EFAEHO Clc1cccc(OCCN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)c1 ZINC000530238275 317089254 /nfs/dbraw/zinc/08/92/54/317089254.db2.gz MDHNMVRCSWSOMK-GOSISDBHSA-N 1 3 338.879 2.809 10 0 EFAEHO CCOc1ccccc1OCCN1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530244195 317089572 /nfs/dbraw/zinc/08/95/72/317089572.db2.gz ZJFIMIRFJRQQQX-GOSISDBHSA-N 1 3 348.487 2.555 10 0 EFAEHO COc1ccccc1/C=C/CN1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530248862 317091028 /nfs/dbraw/zinc/09/10/28/317091028.db2.gz QYMCZAIFVSCRBA-FHHGHWCOSA-N 1 3 330.472 2.799 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)c1cc2sccc2s1 ZINC000530880993 317190650 /nfs/dbraw/zinc/19/06/50/317190650.db2.gz SZBSVSORHNPJSK-UHFFFAOYSA-N 1 3 325.503 2.528 10 0 EFAEHO CC(C)c1ccc(NC(=O)C[C@@H](C)[NH2+]CC2(O)CCN(C)CC2)cc1 ZINC000531978923 317338372 /nfs/dbraw/zinc/33/83/72/317338372.db2.gz HKBXJDIASAYONT-MRXNPFEDSA-N 1 3 347.503 2.573 10 0 EFAEHO CN(CCC[NH+](C)C)C(=O)NCc1ccccc1CN1CCCCC1 ZINC000542715197 317823066 /nfs/dbraw/zinc/82/30/66/317823066.db2.gz PWSFOYRONNRNQC-UHFFFAOYSA-N 1 3 346.519 2.766 10 0 EFAEHO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCCCN2CCN(C)CC2)cc1 ZINC000551536539 318209332 /nfs/dbraw/zinc/20/93/32/318209332.db2.gz GLCGQNAUBBPCKR-IOMROCGXSA-N 1 3 345.531 2.804 10 0 EFAEHO O=C(NCC1([NH+]2CCCCC2)CCCCC1)N1CCN2CCC1CC2 ZINC000554258953 318305140 /nfs/dbraw/zinc/30/51/40/318305140.db2.gz MFPSOPDOEFASEE-UHFFFAOYSA-N 1 3 348.535 2.665 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000554597694 318327629 /nfs/dbraw/zinc/32/76/29/318327629.db2.gz UGFMMSRNVZOKPO-ZWKOTPCHSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000554597694 318327631 /nfs/dbraw/zinc/32/76/31/318327631.db2.gz UGFMMSRNVZOKPO-ZWKOTPCHSA-N 1 3 343.515 2.877 10 0 EFAEHO FC(F)O[C@H]1CCN(CCCCC[N@@H+]2CC[C@H](OC(F)F)C2)C1 ZINC000555070894 318344774 /nfs/dbraw/zinc/34/47/74/318344774.db2.gz KNMVAQHTPNUMPP-STQMWFEESA-N 1 3 342.377 2.784 10 0 EFAEHO FC(F)O[C@H]1CCN(CCCCC[N@H+]2CC[C@H](OC(F)F)C2)C1 ZINC000555070894 318344776 /nfs/dbraw/zinc/34/47/76/318344776.db2.gz KNMVAQHTPNUMPP-STQMWFEESA-N 1 3 342.377 2.784 10 0 EFAEHO Clc1cccc(-n2cc(CNCC[C@@H]3CC[NH2+]C3)nn2)c1Cl ZINC000560944290 318580905 /nfs/dbraw/zinc/58/09/05/318580905.db2.gz HUNYIRHSCCSDHE-NSHDSACASA-N 1 3 340.258 2.663 10 0 EFAEHO CC[NH+](CC)CCn1ccc2cc(NC(=O)C3(N)CCC3)ccc21 ZINC000566170520 319043092 /nfs/dbraw/zinc/04/30/92/319043092.db2.gz HNXAGBNNYUEKHZ-UHFFFAOYSA-N 1 3 328.460 2.803 10 0 EFAEHO CC(C)(C)[NH+]1CCC(NC(=O)N2CCc3ccccc3[C@H]2CN)CC1 ZINC000566736753 319106175 /nfs/dbraw/zinc/10/61/75/319106175.db2.gz LVQPHPTWZIDVLK-GOSISDBHSA-N 1 3 344.503 2.517 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCC([NH2+][C@@H]2CCc3nnnn3CC2)CC1 ZINC000567604213 319187781 /nfs/dbraw/zinc/18/77/81/319187781.db2.gz YFBMQAVOWAEXBJ-OAHLLOKOSA-N 1 3 348.539 2.647 10 0 EFAEHO CC(C)(C)CC(C)(C)[NH+]1CCC(N[C@@H]2CCc3nnnn3CC2)CC1 ZINC000567604213 319187783 /nfs/dbraw/zinc/18/77/83/319187783.db2.gz YFBMQAVOWAEXBJ-OAHLLOKOSA-N 1 3 348.539 2.647 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)NCc2ccccc2CN2CCCCC2)CC[NH2+]1 ZINC000575898486 319964435 /nfs/dbraw/zinc/96/44/35/319964435.db2.gz BCAUVPULJWLKNW-LPHOPBHVSA-N 1 3 344.503 2.612 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3CC4(CCC4)C[C@H]3C)CC2)CC1 ZINC000576647999 320035824 /nfs/dbraw/zinc/03/58/24/320035824.db2.gz VSTQKDMRWUUTMT-QGZVFWFLSA-N 1 3 347.547 2.974 10 0 EFAEHO C[C@@H](O)[C@H](NC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1F ZINC000576759693 320046701 /nfs/dbraw/zinc/04/67/01/320046701.db2.gz BUMARBXRKOAKKC-KUHUBIRLSA-N 1 3 329.419 2.901 10 0 EFAEHO N[C@@H]1Cc2ccccc2N(C(=O)c2ccccc2CC2CC[NH2+]CC2)C1 ZINC000577399552 320107573 /nfs/dbraw/zinc/10/75/73/320107573.db2.gz LRARNJCNUFZVEG-LJQANCHMSA-N 1 3 349.478 2.759 10 0 EFAEHO N[C@H]1Cc2ccccc2N(C(=O)c2ccccc2CC2CC[NH2+]CC2)C1 ZINC000577399551 320107593 /nfs/dbraw/zinc/10/75/93/320107593.db2.gz LRARNJCNUFZVEG-IBGZPJMESA-N 1 3 349.478 2.759 10 0 EFAEHO CCO[C@H]1C[C@H]([NH2+]CC2(N3CCCCC3)CCN(C)CC2)C1(C)C ZINC000181827355 323252262 /nfs/dbraw/zinc/25/22/62/323252262.db2.gz QATJHBXVSUOPJX-ROUUACIJSA-N 1 3 337.552 2.730 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@@H](CNC(=O)Nc2ccc3c(c2F)CCNC3)C1 ZINC000580419007 324159068 /nfs/dbraw/zinc/15/90/68/324159068.db2.gz NMOFWSPYLFHFGU-AWEZNQCLSA-N 1 3 348.466 2.571 10 0 EFAEHO CC(C)C[N@H+]1CC[C@@H](CNC(=O)Nc2ccc3c(c2F)CCNC3)C1 ZINC000580419007 324159072 /nfs/dbraw/zinc/15/90/72/324159072.db2.gz NMOFWSPYLFHFGU-AWEZNQCLSA-N 1 3 348.466 2.571 10 0 EFAEHO C[C@@H]([NH3+])C[C@@H](C)NC(=O)NCc1ccccc1CN1CCCCC1 ZINC000580548818 324185735 /nfs/dbraw/zinc/18/57/35/324185735.db2.gz LCMAAKDDVWBRKQ-HZPDHXFCSA-N 1 3 332.492 2.598 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NCCc2cncn2C)CC1 ZINC000580934438 324269353 /nfs/dbraw/zinc/26/93/53/324269353.db2.gz QQAWYDUXXFPSLU-KRWDZBQOSA-N 1 3 326.488 2.648 10 0 EFAEHO CN(C)Cc1ccc(-c2noc(CSC3CC[NH2+]CC3)n2)cc1 ZINC000581297859 324345982 /nfs/dbraw/zinc/34/59/82/324345982.db2.gz LCAJCICJJNCCAD-UHFFFAOYSA-N 1 3 332.473 2.783 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](c2ccc(F)cc2)[C@@H]([NH3+])C1)N(CC)CC ZINC000583755802 324866247 /nfs/dbraw/zinc/86/62/47/324866247.db2.gz FIBKDTVVJNLKQS-FGTMMUONSA-N 1 3 335.467 2.589 10 0 EFAEHO CN(C)Cc1cccc(CNC(=O)NC2CCC(C[NH+](C)C)CC2)c1 ZINC000137722208 473211451 /nfs/dbraw/zinc/21/14/51/473211451.db2.gz VPAWMHSZIUUNPA-UHFFFAOYSA-N 1 3 346.519 2.668 10 0 EFAEHO CN(CCNC(=O)NC1CCC(C[NH+](C)C)CC1)Cc1ccccc1 ZINC000138253084 473217102 /nfs/dbraw/zinc/21/71/02/473217102.db2.gz SQPSHCQWMQFSFP-UHFFFAOYSA-N 1 3 346.519 2.538 10 0 EFAEHO CCC[C@@H](C(=O)NC[C@H](c1ccsc1)N(CC)CC)N(C)C ZINC000161565997 473244576 /nfs/dbraw/zinc/24/45/76/473244576.db2.gz ZIEXJMQOFUZFPW-JKSUJKDBSA-N 1 3 325.522 2.978 10 0 EFAEHO CCC[C@@H](C(=O)NC[C@H](c1ccsc1)N(CC)CC)[NH+](C)C ZINC000161565997 473244580 /nfs/dbraw/zinc/24/45/80/473244580.db2.gz ZIEXJMQOFUZFPW-JKSUJKDBSA-N 1 3 325.522 2.978 10 0 EFAEHO COC1(C[NH2+][C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)CCOCC1 ZINC000096003189 473252295 /nfs/dbraw/zinc/25/22/95/473252295.db2.gz GXXSENNDAGGEPV-HSALFYBXSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C[C@H](O)COCc2ccccc2Cl)CC[N@@H+]1C ZINC000177058739 473296946 /nfs/dbraw/zinc/29/69/46/473296946.db2.gz BBPRCBADUCMAKJ-PVAVHDDUSA-N 1 3 340.895 2.632 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C[C@H](O)COCc2ccccc2Cl)CC[N@H+]1C ZINC000177058739 473296956 /nfs/dbraw/zinc/29/69/56/473296956.db2.gz BBPRCBADUCMAKJ-PVAVHDDUSA-N 1 3 340.895 2.632 10 0 EFAEHO CN1CCC([NH+]2CCC(NCc3ccc(C(F)F)nc3)CC2)CC1 ZINC000631056579 479865329 /nfs/dbraw/zinc/86/53/29/479865329.db2.gz LVPQZRZBUUHMJN-UHFFFAOYSA-N 1 3 338.446 2.667 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)[C@H]3C[C@@H]3C3CCCCC3)CC2)CC1 ZINC000162474494 473344417 /nfs/dbraw/zinc/34/44/17/473344417.db2.gz LPGWJOJJFCIFTF-UXHICEINSA-N 1 3 347.547 2.878 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+]Cc2ccc(C(F)F)nc2)C[C@@H](C)O1 ZINC000631074972 479879019 /nfs/dbraw/zinc/87/90/19/479879019.db2.gz LOGOAATZOSFRFH-ZIAGYGMSSA-N 1 3 327.419 2.998 10 0 EFAEHO N[C@@H]1CCC[C@H]1[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccncc1 ZINC000422833913 476801541 /nfs/dbraw/zinc/80/15/41/476801541.db2.gz HDNADZDETUKFIA-RTBURBONSA-N 1 3 333.439 2.904 10 0 EFAEHO c1ccc(CN2CC[C@@]3(CC[N@@H+](CCOC4CCOCC4)C3)C2)cc1 ZINC000625422556 479915286 /nfs/dbraw/zinc/91/52/86/479915286.db2.gz GQOGCXKLEDHRGZ-OAQYLSRUSA-N 1 3 344.499 2.780 10 0 EFAEHO c1ccc(CN2CC[C@@]3(CC[N@H+](CCOC4CCOCC4)C3)C2)cc1 ZINC000625422556 479915293 /nfs/dbraw/zinc/91/52/93/479915293.db2.gz GQOGCXKLEDHRGZ-OAQYLSRUSA-N 1 3 344.499 2.780 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1c(F)ccc(F)c1Cl ZINC000622137718 479922471 /nfs/dbraw/zinc/92/24/71/479922471.db2.gz ULWTVCKBGQQBSH-NSHDSACASA-N 1 3 347.837 2.620 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1c(F)ccc(F)c1Cl ZINC000622137718 479922472 /nfs/dbraw/zinc/92/24/72/479922472.db2.gz ULWTVCKBGQQBSH-NSHDSACASA-N 1 3 347.837 2.620 10 0 EFAEHO COc1cncc(C[NH2+]C[C@@H]2CN(C)C[C@H]2c2ccccc2)c1C ZINC000631167118 479935582 /nfs/dbraw/zinc/93/55/82/479935582.db2.gz RBTCLUORONWVSI-MOPGFXCFSA-N 1 3 325.456 2.834 10 0 EFAEHO Cc1ccc(COc2ccc(C[NH2+]CCCNCCO)cc2)cc1 ZINC000013733206 471841252 /nfs/dbraw/zinc/84/12/52/471841252.db2.gz VWSAYUUCZUSHJN-UHFFFAOYSA-N 1 3 328.456 2.636 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@H](C(C)C)C3CC3)CC2)CC1 ZINC000620044728 479970140 /nfs/dbraw/zinc/97/01/40/479970140.db2.gz NAZSPRJYUBLGMX-LJQANCHMSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCCn2cccn2)CC1 ZINC000088677248 472380393 /nfs/dbraw/zinc/38/03/93/472380393.db2.gz WAYKQGMEMRNDHW-UHFFFAOYSA-N 1 3 341.503 2.595 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@](C)(O)C(C)C)CC1 ZINC000088720517 472381389 /nfs/dbraw/zinc/38/13/89/472381389.db2.gz ARAPIKXBKIUDPW-FQEVSTJZSA-N 1 3 333.520 2.715 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H](C)N(C)C2CC2)CC1 ZINC000088715045 472381544 /nfs/dbraw/zinc/38/15/44/472381544.db2.gz TWQQPMCWMTZESM-SFHVURJKSA-N 1 3 344.547 2.791 10 0 EFAEHO CN(C)C[C@@H](NC(=O)N[C@H](CC[NH+](C)C)C(C)(C)C)c1ccccc1 ZINC000116524664 472417423 /nfs/dbraw/zinc/41/74/23/472417423.db2.gz HJCXDGHAAIKQTI-QZTJIDSGSA-N 1 3 348.535 2.955 10 0 EFAEHO CN1CCC(Oc2ccc(N[C@H]3CC[N@@H+]4CCC[C@@H]4C3)cn2)CC1 ZINC000097038832 472420029 /nfs/dbraw/zinc/42/00/29/472420029.db2.gz YHKHCHOJABMSLR-DOTOQJQBSA-N 1 3 330.476 2.593 10 0 EFAEHO CN1CCC(Oc2ccc(N[C@H]3CC[N@H+]4CCC[C@@H]4C3)cn2)CC1 ZINC000097038832 472420037 /nfs/dbraw/zinc/42/00/37/472420037.db2.gz YHKHCHOJABMSLR-DOTOQJQBSA-N 1 3 330.476 2.593 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@H](CNC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000119395566 472552629 /nfs/dbraw/zinc/55/26/29/472552629.db2.gz NCWGSRZINHYHCD-LJQANCHMSA-N 1 3 343.515 2.990 10 0 EFAEHO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000119395566 472552634 /nfs/dbraw/zinc/55/26/34/472552634.db2.gz NCWGSRZINHYHCD-LJQANCHMSA-N 1 3 343.515 2.990 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000631269182 479996422 /nfs/dbraw/zinc/99/64/22/479996422.db2.gz IGVHDCXCVKEBLJ-GDBMZVCRSA-N 1 3 338.517 2.656 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000631269182 479996427 /nfs/dbraw/zinc/99/64/27/479996427.db2.gz IGVHDCXCVKEBLJ-GDBMZVCRSA-N 1 3 338.517 2.656 10 0 EFAEHO CN(CCC[NH+](C)C)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000119645364 472572178 /nfs/dbraw/zinc/57/21/78/472572178.db2.gz LOAKNHAIUUOCMM-FQEVSTJZSA-N 1 3 346.519 2.634 10 0 EFAEHO CC(C)OCC[N@H+](C)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000105862831 472792405 /nfs/dbraw/zinc/79/24/05/472792405.db2.gz JODBUFOWFZWAAV-FQEVSTJZSA-N 1 3 334.504 2.789 10 0 EFAEHO CC(C)OCC[N@@H+](C)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000105862831 472792411 /nfs/dbraw/zinc/79/24/11/472792411.db2.gz JODBUFOWFZWAAV-FQEVSTJZSA-N 1 3 334.504 2.789 10 0 EFAEHO C[NH+](C)CCOc1ccccc1C(=O)N1CCCN(C(C)(C)C)CC1 ZINC000063727879 472807968 /nfs/dbraw/zinc/80/79/68/472807968.db2.gz CPBJFPFOKJIROQ-UHFFFAOYSA-N 1 3 347.503 2.573 10 0 EFAEHO C[N@H+](CCCCCO)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000105915660 472808175 /nfs/dbraw/zinc/80/81/75/472808175.db2.gz VBDUITYXSLJRCT-HXUWFJFHSA-N 1 3 334.504 2.526 10 0 EFAEHO C[N@@H+](CCCCCO)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000105915660 472808178 /nfs/dbraw/zinc/80/81/78/472808178.db2.gz VBDUITYXSLJRCT-HXUWFJFHSA-N 1 3 334.504 2.526 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C)C[C@H]2CCC[C@@H]2O)CC1 ZINC000091899305 472823605 /nfs/dbraw/zinc/82/36/05/472823605.db2.gz LBMUHPHFZVWDLJ-CTNGQTDRSA-N 1 3 345.531 2.811 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C)C[C@H]2CCC[C@@H]2O)CC1 ZINC000091899305 472823610 /nfs/dbraw/zinc/82/36/10/472823610.db2.gz LBMUHPHFZVWDLJ-CTNGQTDRSA-N 1 3 345.531 2.811 10 0 EFAEHO CC(C)C[C@H](C[NH+](C)C)NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000079121254 472823686 /nfs/dbraw/zinc/82/36/86/472823686.db2.gz FDFBSWQPXJJMEP-MSOLQXFVSA-N 1 3 334.508 2.565 10 0 EFAEHO CC(C)C[C@H](C[NH+](C)C)NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000079121257 472824050 /nfs/dbraw/zinc/82/40/50/472824050.db2.gz FDFBSWQPXJJMEP-QZTJIDSGSA-N 1 3 334.508 2.565 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NC[C@@H](C)N2CCC[C@H](C)C2)CC1 ZINC000157745291 472853518 /nfs/dbraw/zinc/85/35/18/472853518.db2.gz ZHMFXHDUEBVWLG-DLBZAZTESA-N 1 3 338.540 2.528 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NC[C@H](C)N2CCC[C@H](C)C2)CC1 ZINC000157745436 472854547 /nfs/dbraw/zinc/85/45/47/472854547.db2.gz ZHMFXHDUEBVWLG-IRXDYDNUSA-N 1 3 338.540 2.528 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NCCCC[N@@H+]1CCC[C@H](C)C1 ZINC000079393844 472856496 /nfs/dbraw/zinc/85/64/96/472856496.db2.gz BKEGQWQDPVUUNW-ROUUACIJSA-N 1 3 340.556 2.774 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NCCCC[N@H+]1CCC[C@H](C)C1 ZINC000079393844 472856504 /nfs/dbraw/zinc/85/65/04/472856504.db2.gz BKEGQWQDPVUUNW-ROUUACIJSA-N 1 3 340.556 2.774 10 0 EFAEHO Cc1cc(CN2CCC(C[NH+]3CCCC3)CC2)ccc1-n1cncn1 ZINC000134187671 472883172 /nfs/dbraw/zinc/88/31/72/472883172.db2.gz IYLWISDCQBGAMP-UHFFFAOYSA-N 1 3 339.487 2.884 10 0 EFAEHO COC(=O)[C@H]1CCCN(Cc2ccc(OCC[NH+]3CCCC3)cc2)C1 ZINC000092643951 472949600 /nfs/dbraw/zinc/94/96/00/472949600.db2.gz LCURPTHOMYREFH-SFHVURJKSA-N 1 3 346.471 2.546 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN2CCC(CCC[NH+](C)C)CC2)cc1 ZINC000123540860 473155130 /nfs/dbraw/zinc/15/51/30/473155130.db2.gz PYCPGBNVCKJVSH-LJQANCHMSA-N 1 3 334.504 2.789 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC2(CCO)CCC2)CC1 ZINC000136526328 473162304 /nfs/dbraw/zinc/16/23/04/473162304.db2.gz JYWXNIRBBXZLJR-UHFFFAOYSA-N 1 3 345.531 2.861 10 0 EFAEHO Cc1sc2cc(C(=O)NCCN(C)C)[nH]c2c1C[NH+]1CCCCC1 ZINC000075487453 473191434 /nfs/dbraw/zinc/19/14/34/473191434.db2.gz XWYYPDYWIAGSPU-UHFFFAOYSA-N 1 3 348.516 2.815 10 0 EFAEHO CCC[C@H](C(=O)NC[C@@H](C1CC1)[N@H+](C)Cc1ccccc1)N(C)C ZINC000185332769 473395983 /nfs/dbraw/zinc/39/59/83/473395983.db2.gz ZGQMFGFLBFBOAS-MOPGFXCFSA-N 1 3 331.504 2.744 10 0 EFAEHO CCC[C@H](C(=O)NC[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1)N(C)C ZINC000185332769 473395984 /nfs/dbraw/zinc/39/59/84/473395984.db2.gz ZGQMFGFLBFBOAS-MOPGFXCFSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1nccn1-c1ccc([C@@H](C)[NH2+]C[C@@H](O)CN2CCCCC2)cc1 ZINC000151296755 473438769 /nfs/dbraw/zinc/43/87/69/473438769.db2.gz GJWALEDBRXHUBA-OXQOHEQNSA-N 1 3 342.487 2.678 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCCn2ccnc2)CC1 ZINC000151301369 473440640 /nfs/dbraw/zinc/44/06/40/473440640.db2.gz WLNFCZNNWOFCOL-UHFFFAOYSA-N 1 3 341.503 2.595 10 0 EFAEHO O=C(CN1CCC[C@@]2(CC=CCC2)C1)NC1CC[NH+](C2CC2)CC1 ZINC000114494223 473476670 /nfs/dbraw/zinc/47/66/70/473476670.db2.gz ZMDDMENAPTXPLG-FQEVSTJZSA-N 1 3 331.504 2.552 10 0 EFAEHO C[C@@H](NC[C@H](O)COCc1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185711325 473494168 /nfs/dbraw/zinc/49/41/68/473494168.db2.gz JQCCHJOHGSHFHG-QFUCXCTJSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@@H](NC[C@H](O)COCc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185711325 473494170 /nfs/dbraw/zinc/49/41/70/473494170.db2.gz JQCCHJOHGSHFHG-QFUCXCTJSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@@H]([NH2+]C[C@H](O)COCc1ccccc1)[C@@H]1CCCN(C2CCC2)C1 ZINC000185711325 473494177 /nfs/dbraw/zinc/49/41/77/473494177.db2.gz JQCCHJOHGSHFHG-QFUCXCTJSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1O)c1ccc(OCCN(C)C)cc1 ZINC000178352520 473497881 /nfs/dbraw/zinc/49/78/81/473497881.db2.gz ZSJHYYVLRBOTEN-RVHYNSKXSA-N 1 3 340.467 2.936 10 0 EFAEHO CN(C)CCN1CCC([NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000166117469 473522069 /nfs/dbraw/zinc/52/20/69/473522069.db2.gz FQYOCBHPNSKZTE-RXVVDRJESA-N 1 3 345.531 2.770 10 0 EFAEHO CN(C)CCN1CCC([NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000166117816 473522138 /nfs/dbraw/zinc/52/21/38/473522138.db2.gz FQYOCBHPNSKZTE-WIYYLYMNSA-N 1 3 345.531 2.770 10 0 EFAEHO COc1ccc([C@H](C)[NH2+]C[C@@H]2CCN(C3CC3)C2)cc1NC(C)=O ZINC000152454620 473565097 /nfs/dbraw/zinc/56/50/97/473565097.db2.gz SLUXFFVOGXOOEW-ZFWWWQNUSA-N 1 3 331.460 2.789 10 0 EFAEHO O=C(c1ccccc1)N1CCC([NH2+][C@@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000178954503 473599025 /nfs/dbraw/zinc/59/90/25/473599025.db2.gz CNXIEXNFYHWZON-RTBURBONSA-N 1 3 327.472 2.508 10 0 EFAEHO O=C(c1ccccc1)N1CCC(N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000178954503 473599028 /nfs/dbraw/zinc/59/90/28/473599028.db2.gz CNXIEXNFYHWZON-RTBURBONSA-N 1 3 327.472 2.508 10 0 EFAEHO O=C(c1ccccc1)N1CCC(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)CC1 ZINC000178954503 473599036 /nfs/dbraw/zinc/59/90/36/473599036.db2.gz CNXIEXNFYHWZON-RTBURBONSA-N 1 3 327.472 2.508 10 0 EFAEHO CN(C)[C@@H]1CCN(C(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000170827044 473622814 /nfs/dbraw/zinc/62/28/14/473622814.db2.gz OEBLXMTZGFBCKM-LJQANCHMSA-N 1 3 344.503 2.518 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(C(F)F)cc1 ZINC000617504751 480246885 /nfs/dbraw/zinc/24/68/85/480246885.db2.gz IWUJRGMSJBCJEU-ZDUSSCGKSA-N 1 3 327.419 2.626 10 0 EFAEHO CO[C@@H]1CCCN(Cc2ccccc2N(C)C2CC[NH+](C)CC2)C1 ZINC000245541207 473716637 /nfs/dbraw/zinc/71/66/37/473716637.db2.gz NSHKUEQHKLXBHJ-LJQANCHMSA-N 1 3 331.504 2.828 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000245606136 473724699 /nfs/dbraw/zinc/72/46/99/473724699.db2.gz AEMAXYULAUDHDM-QYZOEREBSA-N 1 3 344.503 2.558 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000245606136 473724706 /nfs/dbraw/zinc/72/47/06/473724706.db2.gz AEMAXYULAUDHDM-QYZOEREBSA-N 1 3 344.503 2.558 10 0 EFAEHO C[C@@H]([NH2+]CC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccnn1C ZINC000192838615 473735492 /nfs/dbraw/zinc/73/54/92/473735492.db2.gz PAUAVTSJWVQWEG-OXQOHEQNSA-N 1 3 342.487 2.516 10 0 EFAEHO CC(C)NC(=O)CCNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180109521 473802679 /nfs/dbraw/zinc/80/26/79/473802679.db2.gz BZKGSNSHUISEHW-YQQQUEKLSA-N 1 3 329.488 2.686 10 0 EFAEHO CC(C)NC(=O)CCNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180109521 473802681 /nfs/dbraw/zinc/80/26/81/473802681.db2.gz BZKGSNSHUISEHW-YQQQUEKLSA-N 1 3 329.488 2.686 10 0 EFAEHO CS[C@@H](CO)[C@@H](C)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180146131 473810835 /nfs/dbraw/zinc/81/08/35/473810835.db2.gz CVJRKOLTCYALQC-IPFAQRCESA-N 1 3 334.529 2.884 10 0 EFAEHO CS[C@@H](CO)[C@@H](C)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180146131 473810842 /nfs/dbraw/zinc/81/08/42/473810842.db2.gz CVJRKOLTCYALQC-IPFAQRCESA-N 1 3 334.529 2.884 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000617008995 480062194 /nfs/dbraw/zinc/06/21/94/480062194.db2.gz PUNSRHWNPOKYEF-GOSISDBHSA-N 1 3 329.488 2.885 10 0 EFAEHO COc1cc2c(cc1F)CC[C@@H]2[NH2+]C1CCN([C@H]2CCC[C@H]2O)CC1 ZINC000281734152 473822857 /nfs/dbraw/zinc/82/28/57/473822857.db2.gz VCUNHYNKYMXALR-GBESFXJTSA-N 1 3 348.462 2.789 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C[C@@H](O)COCc2ccccc2Cl)CC[N@@H+]1C ZINC000246328765 473829665 /nfs/dbraw/zinc/82/96/65/473829665.db2.gz BBPRCBADUCMAKJ-HYVNUMGLSA-N 1 3 340.895 2.632 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C[C@@H](O)COCc2ccccc2Cl)CC[N@H+]1C ZINC000246328765 473829666 /nfs/dbraw/zinc/82/96/66/473829666.db2.gz BBPRCBADUCMAKJ-HYVNUMGLSA-N 1 3 340.895 2.632 10 0 EFAEHO C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)C1 ZINC000246352402 473837765 /nfs/dbraw/zinc/83/77/65/473837765.db2.gz PIWMGGYYSPIMDS-ZACQAIPSSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)C1 ZINC000246352402 473837771 /nfs/dbraw/zinc/83/77/71/473837771.db2.gz PIWMGGYYSPIMDS-ZACQAIPSSA-N 1 3 338.540 2.621 10 0 EFAEHO CN1CCO[C@H]([C@@H](NCCCC[NH+](C)C)c2ccc(Cl)cc2)C1 ZINC000274553102 473873125 /nfs/dbraw/zinc/87/31/25/473873125.db2.gz DXDNEMQAKJEVOR-ROUUACIJSA-N 1 3 339.911 2.643 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)NC[C@H](C2CCCCC2)[NH+](C)C)CCN1C ZINC000246544103 473895601 /nfs/dbraw/zinc/89/56/01/473895601.db2.gz YIFOBPALXGTNSD-BPQIPLTHSA-N 1 3 338.540 2.621 10 0 EFAEHO CC(C)[N@@H+]1C[C@@H](C)[C@H](NC(=O)c2oc3ccccc3c2CN(C)C)C1 ZINC000246720801 473942442 /nfs/dbraw/zinc/94/24/42/473942442.db2.gz ACYHDDMRBSFLKL-RHSMWYFYSA-N 1 3 343.471 2.953 10 0 EFAEHO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2oc3ccccc3c2CN(C)C)C1 ZINC000246720801 473942448 /nfs/dbraw/zinc/94/24/48/473942448.db2.gz ACYHDDMRBSFLKL-RHSMWYFYSA-N 1 3 343.471 2.953 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)NCCC[N@H+](C)C2CCCCC2)CCN1C ZINC000173850480 473943068 /nfs/dbraw/zinc/94/30/68/473943068.db2.gz JHXQKHUJULHUKD-SJLPKXTDSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)NCCC[N@@H+](C)C2CCCCC2)CCN1C ZINC000173850480 473943075 /nfs/dbraw/zinc/94/30/75/473943075.db2.gz JHXQKHUJULHUKD-SJLPKXTDSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)NCCC[N@H+](C)C2CCCCC2)CCN1C ZINC000173850527 473943386 /nfs/dbraw/zinc/94/33/86/473943386.db2.gz JHXQKHUJULHUKD-WMZOPIPTSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)NCCC[N@@H+](C)C2CCCCC2)CCN1C ZINC000173850527 473943390 /nfs/dbraw/zinc/94/33/90/473943390.db2.gz JHXQKHUJULHUKD-WMZOPIPTSA-N 1 3 338.540 2.765 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C(C)C ZINC000173997584 473971655 /nfs/dbraw/zinc/97/16/55/473971655.db2.gz JEIDUHSCANDFEC-KSZLIROESA-N 1 3 338.540 2.619 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000173997584 473971661 /nfs/dbraw/zinc/97/16/61/473971661.db2.gz JEIDUHSCANDFEC-KSZLIROESA-N 1 3 338.540 2.619 10 0 EFAEHO C[NH+](C)[C@H](CC(=O)NC[C@@H]1CCN1C1CCCC1)c1ccccc1 ZINC000628964718 480075122 /nfs/dbraw/zinc/07/51/22/480075122.db2.gz FRSUZFVGQDEXQH-RBUKOAKNSA-N 1 3 329.488 2.813 10 0 EFAEHO C[NH+](C)[C@@H](CC(=O)NC[C@H]1CCN1C1CCCC1)c1ccccc1 ZINC000628964716 480076074 /nfs/dbraw/zinc/07/60/74/480076074.db2.gz FRSUZFVGQDEXQH-MOPGFXCFSA-N 1 3 329.488 2.813 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)N1CCc2ccccc21 ZINC000174317735 474020715 /nfs/dbraw/zinc/02/07/15/474020715.db2.gz SEXAIJPPXWRYGW-SFHVURJKSA-N 1 3 344.503 2.517 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)N1CCc2ccccc21 ZINC000174317735 474020720 /nfs/dbraw/zinc/02/07/20/474020720.db2.gz SEXAIJPPXWRYGW-SFHVURJKSA-N 1 3 344.503 2.517 10 0 EFAEHO CSc1cccc(F)c1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617507444 480250946 /nfs/dbraw/zinc/25/09/46/480250946.db2.gz XAZFDTMAKUCKMM-ZDUSSCGKSA-N 1 3 341.496 2.549 10 0 EFAEHO CSc1cccc(F)c1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617507444 480250951 /nfs/dbraw/zinc/25/09/51/480250951.db2.gz XAZFDTMAKUCKMM-ZDUSSCGKSA-N 1 3 341.496 2.549 10 0 EFAEHO C[C@@H]([NH2+]CCCCN1C[C@@H](C)O[C@@H](C)C1)c1ccc2c(c1)OCCO2 ZINC000247078869 474057526 /nfs/dbraw/zinc/05/75/26/474057526.db2.gz QSRZBBOHOQSPON-IXDOHACOSA-N 1 3 348.487 2.998 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)N[C@H](CC1CC1)c1ccccc1 ZINC000608717124 480078833 /nfs/dbraw/zinc/07/88/33/480078833.db2.gz UWBNQJHQQISOGZ-LJQANCHMSA-N 1 3 346.519 2.663 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCC2([NH+](C)C)CCCC2)[C@H]1c1ccccc1 ZINC000270330504 474075195 /nfs/dbraw/zinc/07/51/95/474075195.db2.gz HVQRKVNWDUFMRZ-QZTJIDSGSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H](CCNC(=O)c1ccccc1OCCN(C)C)[NH+]1CCCCC1 ZINC000182248310 474133093 /nfs/dbraw/zinc/13/30/93/474133093.db2.gz ARXLDHHYJBLMFB-KRWDZBQOSA-N 1 3 347.503 2.621 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)N1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000247483966 474159975 /nfs/dbraw/zinc/15/99/75/474159975.db2.gz KGXHFJBSFNWPFC-OALUTQOASA-N 1 3 344.503 2.559 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)N1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000247483966 474159981 /nfs/dbraw/zinc/15/99/81/474159981.db2.gz KGXHFJBSFNWPFC-OALUTQOASA-N 1 3 344.503 2.559 10 0 EFAEHO C[C@@H]([NH2+]C(C)(C)CNC(=O)N1CCN2CCC[C@H]2C1)c1ccccc1 ZINC000247497124 474165102 /nfs/dbraw/zinc/16/51/02/474165102.db2.gz USJOXVOTRSUITI-AEFFLSMTSA-N 1 3 344.503 2.605 10 0 EFAEHO CN(C)CCc1ccccc1NC(=O)N1CCC[C@H]1C[NH+]1CCCC1 ZINC000275562516 474237005 /nfs/dbraw/zinc/23/70/05/474237005.db2.gz BLIOHDZKSRSGBJ-SFHVURJKSA-N 1 3 344.503 2.883 10 0 EFAEHO C[C@@H](Cc1ccccc1)C[NH+]1CCC(CN2CCN(C)CC2)CC1 ZINC000289447072 474274816 /nfs/dbraw/zinc/27/48/16/474274816.db2.gz MRZCVUXWOCSOQR-IBGZPJMESA-N 1 3 329.532 2.825 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)Nc2ccccc2CCN(C)C)CC[N@@H+]1C ZINC000275725345 474296012 /nfs/dbraw/zinc/29/60/12/474296012.db2.gz WOLLECYRIRBHFH-WBVHZDCISA-N 1 3 332.492 2.737 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)Nc2ccccc2CCN(C)C)CC[N@H+]1C ZINC000275725345 474296018 /nfs/dbraw/zinc/29/60/18/474296018.db2.gz WOLLECYRIRBHFH-WBVHZDCISA-N 1 3 332.492 2.737 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)Nc1ccccc1CC[NH+](C)C ZINC000275725248 474296246 /nfs/dbraw/zinc/29/62/46/474296246.db2.gz WNAORDWEFYQHEF-MRXNPFEDSA-N 1 3 332.492 2.787 10 0 EFAEHO CN(C)C(=O)CCC[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000248409016 474313239 /nfs/dbraw/zinc/31/32/39/474313239.db2.gz WDOVPBFOUPCHCR-VAMGGRTRSA-N 1 3 343.515 2.745 10 0 EFAEHO CN(C)C[C@H](Cc1ccccc1)NC(=O)CC[C@H]([NH3+])c1ccccc1 ZINC000237026038 474323731 /nfs/dbraw/zinc/32/37/31/474323731.db2.gz LQKVSIFJFFKFRY-PMACEKPBSA-N 1 3 339.483 2.756 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000176256862 474423650 /nfs/dbraw/zinc/42/36/50/474423650.db2.gz DMHALTJBQJOULY-QGZVFWFLSA-N 1 3 336.524 2.567 10 0 EFAEHO COCCN1CC[C@H]([NH2+]C[C@@H]2CCCCN(Cc3ccccc3)C2)C1 ZINC000289784346 474426477 /nfs/dbraw/zinc/42/64/77/474426477.db2.gz KUIHOUOREBRPLX-SFTDATJTSA-N 1 3 345.531 2.599 10 0 EFAEHO COCCN1CC[C@H](NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)C1 ZINC000289784346 474426483 /nfs/dbraw/zinc/42/64/83/474426483.db2.gz KUIHOUOREBRPLX-SFTDATJTSA-N 1 3 345.531 2.599 10 0 EFAEHO COCCN1CC[C@H](NC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000289784346 474426490 /nfs/dbraw/zinc/42/64/90/474426490.db2.gz KUIHOUOREBRPLX-SFTDATJTSA-N 1 3 345.531 2.599 10 0 EFAEHO CN(CC1([NH+](C)C)CCC1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000248956961 474489946 /nfs/dbraw/zinc/48/99/46/474489946.db2.gz DFANNVUHOSHODZ-ZWKOTPCHSA-N 1 3 344.503 2.558 10 0 EFAEHO CC1(C[NH2+][C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]23)OCCCO1 ZINC000248984289 474497303 /nfs/dbraw/zinc/49/73/03/474497303.db2.gz GBQAEERZWLMFES-GUDVDZBRSA-N 1 3 330.472 2.640 10 0 EFAEHO CC1(C[NH2+][C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)OCCCO1 ZINC000248984291 474498209 /nfs/dbraw/zinc/49/82/09/474498209.db2.gz GBQAEERZWLMFES-IPMKNSEASA-N 1 3 330.472 2.640 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)CC[N@@H+]1C ZINC000631475649 480111117 /nfs/dbraw/zinc/11/11/17/480111117.db2.gz MPCQHKDRDSQMJY-HPFXQQBRSA-N 1 3 349.544 2.978 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)CC[N@H+]1C ZINC000631475649 480111122 /nfs/dbraw/zinc/11/11/22/480111122.db2.gz MPCQHKDRDSQMJY-HPFXQQBRSA-N 1 3 349.544 2.978 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)Nc1ccc2c(c1)OCCNC2)C(C)C ZINC000625942837 480115083 /nfs/dbraw/zinc/11/50/83/480115083.db2.gz HQUWYDHZXBNBQY-UHFFFAOYSA-N 1 3 348.491 2.799 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NC[C@H](C)N2CCC[C@@H](C)C2)CC1 ZINC000249730088 474607459 /nfs/dbraw/zinc/60/74/59/474607459.db2.gz ZHMFXHDUEBVWLG-SJORKVTESA-N 1 3 338.540 2.528 10 0 EFAEHO Cn1ccnc1CNCCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000267213029 474619657 /nfs/dbraw/zinc/61/96/57/474619657.db2.gz RCYWGHUBLCHVKI-UHFFFAOYSA-N 1 3 342.487 2.581 10 0 EFAEHO C[C@@H]1C[N@H+](C[C@H]2CCCO2)CC[C@H]1NCc1cccc2c[nH]nc21 ZINC000252477924 474664147 /nfs/dbraw/zinc/66/41/47/474664147.db2.gz XUZTXJJJPVTKBR-ZTFGCOKTSA-N 1 3 328.460 2.542 10 0 EFAEHO C[C@@H]1C[N@@H+](C[C@H]2CCCO2)CC[C@H]1NCc1cccc2c[nH]nc21 ZINC000252477924 474664157 /nfs/dbraw/zinc/66/41/57/474664157.db2.gz XUZTXJJJPVTKBR-ZTFGCOKTSA-N 1 3 328.460 2.542 10 0 EFAEHO CCC[NH+](CCC)CCCC(=O)Nc1cnn(C2CCN(C)CC2)c1 ZINC000634089372 480125377 /nfs/dbraw/zinc/12/53/77/480125377.db2.gz HOHDSXDPOVDUCW-UHFFFAOYSA-N 1 3 349.523 2.991 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)CC1CC[NH+](C)CC1)c1ccccc1 ZINC000273224543 474788167 /nfs/dbraw/zinc/78/81/67/474788167.db2.gz NOGCCTXAZOTGBJ-LJQANCHMSA-N 1 3 331.504 2.918 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@@H](c2cnn(C)c2)C(C)(C)C)CC1 ZINC000337324640 474898623 /nfs/dbraw/zinc/89/86/23/474898623.db2.gz UKXUIWNXIZYYBQ-SFHVURJKSA-N 1 3 335.540 2.513 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000337353088 474927813 /nfs/dbraw/zinc/92/78/13/474927813.db2.gz AMYUXLJLPOEGCV-ZWKOTPCHSA-N 1 3 338.540 2.815 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)NCCCC[N@H+]1CCCC[C@@H]1C ZINC000337353088 474927822 /nfs/dbraw/zinc/92/78/22/474927822.db2.gz AMYUXLJLPOEGCV-ZWKOTPCHSA-N 1 3 338.540 2.815 10 0 EFAEHO CN1CC[C@]2(CC[N@H+](C[C@@H](O)COc3ccc(C(C)(C)C)cc3)C2)C1 ZINC000292272657 474936133 /nfs/dbraw/zinc/93/61/33/474936133.db2.gz ZVLWPBVKJFYUCU-NQIIRXRSSA-N 1 3 346.515 2.751 10 0 EFAEHO CN1CC[C@]2(CC[N@@H+](C[C@@H](O)COc3ccc(C(C)(C)C)cc3)C2)C1 ZINC000292272657 474936141 /nfs/dbraw/zinc/93/61/41/474936141.db2.gz ZVLWPBVKJFYUCU-NQIIRXRSSA-N 1 3 346.515 2.751 10 0 EFAEHO CC[NH+](CC)[C@@H](CNC(=O)NCCN1CCCC[C@H]1C)CC(C)C ZINC000337391757 474971989 /nfs/dbraw/zinc/97/19/89/474971989.db2.gz ZWAMPJSLHFGFQS-QZTJIDSGSA-N 1 3 340.556 2.917 10 0 EFAEHO CCN1CCN([C@@H](C)C[NH2+][C@H](C)c2cnn(C3CCCC3)c2)CC1 ZINC000337408655 474986095 /nfs/dbraw/zinc/98/60/95/474986095.db2.gz UQVCNSISRDTJGL-DLBZAZTESA-N 1 3 333.524 2.675 10 0 EFAEHO [NH3+]C1C[C@H]2CCC[C@@H](C1)C2NC(=O)c1cccc(CN2CCCC2)c1 ZINC000261599793 474989287 /nfs/dbraw/zinc/98/92/87/474989287.db2.gz BAIXQSDLJITZGU-FWYSVENZSA-N 1 3 341.499 2.918 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N(C)CC[C@H]1CCCC[N@@H+]1C ZINC000341117018 474991924 /nfs/dbraw/zinc/99/19/24/474991924.db2.gz HBCLTICZSWHMDC-KZNAEPCWSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000341117018 474991929 /nfs/dbraw/zinc/99/19/29/474991929.db2.gz HBCLTICZSWHMDC-KZNAEPCWSA-N 1 3 338.540 2.765 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)c2ccccc2OCCN(C)C)CC1 ZINC000634120802 480139082 /nfs/dbraw/zinc/13/90/82/480139082.db2.gz MNEYLYYKINTSFP-UHFFFAOYSA-N 1 3 347.503 2.573 10 0 EFAEHO O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@@H]1C[C@H]2CCCC[C@@H]2[NH2+]1 ZINC000261709967 475035075 /nfs/dbraw/zinc/03/50/75/475035075.db2.gz PNNZJDUPZZDWEG-FUMNGEBKSA-N 1 3 341.499 2.860 10 0 EFAEHO C[C@@H](CNC(=O)NCC[N@H+]1[C@H](C)CCC[C@@H]1C)N1CCC(C)CC1 ZINC000341429655 475051438 /nfs/dbraw/zinc/05/14/38/475051438.db2.gz HYJXGICRYLOQNB-KSZLIROESA-N 1 3 338.540 2.669 10 0 EFAEHO C[C@@H](CNC(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C)N1CCC(C)CC1 ZINC000341429655 475051450 /nfs/dbraw/zinc/05/14/50/475051450.db2.gz HYJXGICRYLOQNB-KSZLIROESA-N 1 3 338.540 2.669 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)NCCC[N@@H+]1CCCC[C@H]1C ZINC000341450758 475054547 /nfs/dbraw/zinc/05/45/47/475054547.db2.gz JJRCTSMEWOMCTK-KURKYZTESA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)NCCC[N@H+]1CCCC[C@H]1C ZINC000341450758 475054555 /nfs/dbraw/zinc/05/45/55/475054555.db2.gz JJRCTSMEWOMCTK-KURKYZTESA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCCN1CCOC(C)(C)C1 ZINC000268917418 475070949 /nfs/dbraw/zinc/07/09/49/475070949.db2.gz VNOFDGBXWIACQS-ICSRJNTNSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCCN1CCOC(C)(C)C1 ZINC000268917418 475070960 /nfs/dbraw/zinc/07/09/60/475070960.db2.gz VNOFDGBXWIACQS-ICSRJNTNSA-N 1 3 345.531 2.597 10 0 EFAEHO CCN1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2cnn(C3CCCC3)c2)CC1 ZINC000337504693 475077038 /nfs/dbraw/zinc/07/70/38/475077038.db2.gz DPHXEODUJDYDCB-ROUUACIJSA-N 1 3 347.551 2.922 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)[C@H](N)C2CCOCC2)cc1 ZINC000261860655 475089646 /nfs/dbraw/zinc/08/96/46/475089646.db2.gz SEXAVGLMFQZZRX-DNVCBOLYSA-N 1 3 345.487 2.753 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)[C@H](N)C2CCOCC2)cc1 ZINC000261860655 475089655 /nfs/dbraw/zinc/08/96/55/475089655.db2.gz SEXAVGLMFQZZRX-DNVCBOLYSA-N 1 3 345.487 2.753 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)NCCC[NH2+]C1CCCCC1 ZINC000341551081 475136106 /nfs/dbraw/zinc/13/61/06/475136106.db2.gz BRQOMDJBURHBAE-CALCHBBNSA-N 1 3 338.540 2.861 10 0 EFAEHO C1C[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)[C@@H]([C@H]2COCCN2)C1 ZINC000262017449 475147291 /nfs/dbraw/zinc/14/72/91/475147291.db2.gz WDMHNCDAKFDXBY-XUVXKRRUSA-N 1 3 335.536 2.530 10 0 EFAEHO Cc1ccc(OC(F)F)c(CN[C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)c1 ZINC000262042383 475155214 /nfs/dbraw/zinc/15/52/14/475155214.db2.gz YSGSQPRKHCOZOQ-BZUAXINKSA-N 1 3 340.414 2.843 10 0 EFAEHO O[C@@H](CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)COCC1CC1 ZINC000347357025 475263374 /nfs/dbraw/zinc/26/33/74/475263374.db2.gz DWJRLELQCASLEY-VTHDOGFWSA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@@H](CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)COCC1CC1 ZINC000347357025 475263378 /nfs/dbraw/zinc/26/33/78/475263378.db2.gz DWJRLELQCASLEY-VTHDOGFWSA-N 1 3 344.499 2.559 10 0 EFAEHO Cc1cccc(C(C)(C)NCC(=O)NC2CC[NH+](C3CC3)CC2)c1 ZINC000341853799 475358492 /nfs/dbraw/zinc/35/84/92/475358492.db2.gz PBYVYSUEAXSDLK-UHFFFAOYSA-N 1 3 329.488 2.563 10 0 EFAEHO CN(C)CCNC(=O)c1cccc(C[NH2+][C@H]2CC[C@H]2C(C)(C)C)c1 ZINC000348112745 475400180 /nfs/dbraw/zinc/40/01/80/475400180.db2.gz RGRUDTBDNJKFMO-MSOLQXFVSA-N 1 3 331.504 2.892 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@H]1CCN(C2CC2)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000358105946 475403394 /nfs/dbraw/zinc/40/33/94/475403394.db2.gz WVHUJIVCXJUTBP-FCEWJHQRSA-N 1 3 348.535 2.518 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@H]1CCN(C2CC2)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000358105946 475403399 /nfs/dbraw/zinc/40/33/99/475403399.db2.gz WVHUJIVCXJUTBP-FCEWJHQRSA-N 1 3 348.535 2.518 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NCCc2cnc(C3CC3)nc2)[C@H](C)C1 ZINC000358221679 475502891 /nfs/dbraw/zinc/50/28/91/475502891.db2.gz HSDMHQQSVMAYEG-APWZRJJASA-N 1 3 346.519 2.623 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NCCc2cnc(C3CC3)nc2)[C@H](C)C1 ZINC000358221679 475502900 /nfs/dbraw/zinc/50/29/00/475502900.db2.gz HSDMHQQSVMAYEG-APWZRJJASA-N 1 3 346.519 2.623 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NCCc2cnc(C3CC3)nc2)[C@@H](C)C1 ZINC000358221682 475503231 /nfs/dbraw/zinc/50/32/31/475503231.db2.gz HSDMHQQSVMAYEG-LPHOPBHVSA-N 1 3 346.519 2.623 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NCCc2cnc(C3CC3)nc2)[C@@H](C)C1 ZINC000358221682 475503241 /nfs/dbraw/zinc/50/32/41/475503241.db2.gz HSDMHQQSVMAYEG-LPHOPBHVSA-N 1 3 346.519 2.623 10 0 EFAEHO CCO[C@H]1COCC[C@@H]1NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000354970934 475568044 /nfs/dbraw/zinc/56/80/44/475568044.db2.gz CKLBVDRYRZCQRP-OSYNSWQESA-N 1 3 344.499 2.966 10 0 EFAEHO CCO[C@H]1COCC[C@@H]1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000354970934 475568050 /nfs/dbraw/zinc/56/80/50/475568050.db2.gz CKLBVDRYRZCQRP-OSYNSWQESA-N 1 3 344.499 2.966 10 0 EFAEHO COc1cc([C@H](C)[NH2+]C2CCN([C@H]3CCC[C@@H]3O)CC2)ccc1F ZINC000358301342 475571652 /nfs/dbraw/zinc/57/16/52/475571652.db2.gz PGQSLUMAQRDWEG-KKXDTOCCSA-N 1 3 336.451 2.863 10 0 EFAEHO CN(C)CCN(Cc1ccc(F)cc1)C(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000355002210 475590384 /nfs/dbraw/zinc/59/03/84/475590384.db2.gz BAOXKTHQQRBWBP-IBGZPJMESA-N 1 3 349.494 2.980 10 0 EFAEHO CN(C)CCN(Cc1ccc(F)cc1)C(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000355002210 475590392 /nfs/dbraw/zinc/59/03/92/475590392.db2.gz BAOXKTHQQRBWBP-IBGZPJMESA-N 1 3 349.494 2.980 10 0 EFAEHO CN(C)CCN(Cc1ccccc1F)C(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000355018039 475600305 /nfs/dbraw/zinc/60/03/05/475600305.db2.gz OKNOPUNXFRPWPN-GOSISDBHSA-N 1 3 349.494 2.980 10 0 EFAEHO CN(C)CCN(Cc1ccccc1F)C(=O)CC[C@H]1CCCC[N@H+]1C ZINC000355018039 475600317 /nfs/dbraw/zinc/60/03/17/475600317.db2.gz OKNOPUNXFRPWPN-GOSISDBHSA-N 1 3 349.494 2.980 10 0 EFAEHO CN1CCC(C[NH2+]C2CC(OC(C)(C)C)C2)(N2CCCCC2)CC1 ZINC000352784127 475621089 /nfs/dbraw/zinc/62/10/89/475621089.db2.gz QAVZOEQXGYFAHS-UHFFFAOYSA-N 1 3 337.552 2.872 10 0 EFAEHO C[C@@H](CN(C)C)NC(=O)N1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000358488809 475717777 /nfs/dbraw/zinc/71/77/77/475717777.db2.gz AVMRXSJPIVKMTN-IRXDYDNUSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H](CN(C)C)NC(=O)N1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000358488809 475717783 /nfs/dbraw/zinc/71/77/83/475717783.db2.gz AVMRXSJPIVKMTN-IRXDYDNUSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@H]2C)C[C@@H]1C ZINC000361775908 475741559 /nfs/dbraw/zinc/74/15/59/475741559.db2.gz YIMOWXHLLNCEPZ-BDXSIMOUSA-N 1 3 338.540 2.764 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@H]2C)C[C@@H]1C ZINC000361775908 475741566 /nfs/dbraw/zinc/74/15/66/475741566.db2.gz YIMOWXHLLNCEPZ-BDXSIMOUSA-N 1 3 338.540 2.764 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000340102457 475760425 /nfs/dbraw/zinc/76/04/25/475760425.db2.gz LSAIFRUPVSLRRD-NEWSRXKRSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000340102457 475760440 /nfs/dbraw/zinc/76/04/40/475760440.db2.gz LSAIFRUPVSLRRD-NEWSRXKRSA-N 1 3 344.503 2.605 10 0 EFAEHO CN1CCC(N2CCC([NH2+][C@@H]3CCC[C@@H]([C@@H]4CCOC4)C3)CC2)CC1 ZINC000361895474 475849780 /nfs/dbraw/zinc/84/97/80/475849780.db2.gz XXRRJFHCDIYBDD-QWFCFKBJSA-N 1 3 349.563 2.730 10 0 EFAEHO CN1CC[C@H]([NH2+]CC2CCN(c3ccncc3)CC2)[C@@H]2CCC[C@@H]21 ZINC000353397119 475934749 /nfs/dbraw/zinc/93/47/49/475934749.db2.gz WBKIGNGBOANFOO-UFYCRDLUSA-N 1 3 328.504 2.760 10 0 EFAEHO CN(C)[C@H](CNC(=O)C1(C[NH+](C)C)CCCCC1)c1ccccc1 ZINC000358898373 476022219 /nfs/dbraw/zinc/02/22/19/476022219.db2.gz FINMVGXUPTYVBC-GOSISDBHSA-N 1 3 331.504 2.918 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000349992884 476027748 /nfs/dbraw/zinc/02/77/48/476027748.db2.gz KPTYVXBRSCLLTD-ZWKOTPCHSA-N 1 3 336.524 2.519 10 0 EFAEHO CCCC[N@H+]1CCCC[C@H]1CNC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000349992884 476027752 /nfs/dbraw/zinc/02/77/52/476027752.db2.gz KPTYVXBRSCLLTD-ZWKOTPCHSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@@H]1CCCC[N@@H+]1C)N(C)Cc1ccccc1 ZINC000353505855 476029306 /nfs/dbraw/zinc/02/93/06/476029306.db2.gz ZCYSHFUERJWCAS-HKUYNNGSSA-N 1 3 331.504 2.888 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@@H]1CCCC[N@H+]1C)N(C)Cc1ccccc1 ZINC000353505855 476029314 /nfs/dbraw/zinc/02/93/14/476029314.db2.gz ZCYSHFUERJWCAS-HKUYNNGSSA-N 1 3 331.504 2.888 10 0 EFAEHO C[N@@H+]1CC[C@H](NCc2ccc(-n3ccnc3)c(F)c2)[C@H]2CCC[C@H]21 ZINC000353521553 476044165 /nfs/dbraw/zinc/04/41/65/476044165.db2.gz QAVPLFVFAJPZNW-BPQIPLTHSA-N 1 3 328.435 2.974 10 0 EFAEHO C[N@H+]1CC[C@H](NCc2ccc(-n3ccnc3)c(F)c2)[C@H]2CCC[C@H]21 ZINC000353521553 476044170 /nfs/dbraw/zinc/04/41/70/476044170.db2.gz QAVPLFVFAJPZNW-BPQIPLTHSA-N 1 3 328.435 2.974 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccc(-n3ccnc3)c(F)c2)[C@H]2CCC[C@H]21 ZINC000353521553 476044176 /nfs/dbraw/zinc/04/41/76/476044176.db2.gz QAVPLFVFAJPZNW-BPQIPLTHSA-N 1 3 328.435 2.974 10 0 EFAEHO C[N@@H+]1CC[C@H](NCc2ccc(-n3ccnc3)c(F)c2)[C@@H]2CCC[C@@H]21 ZINC000353521556 476044390 /nfs/dbraw/zinc/04/43/90/476044390.db2.gz QAVPLFVFAJPZNW-SZMVWBNQSA-N 1 3 328.435 2.974 10 0 EFAEHO C[N@H+]1CC[C@H](NCc2ccc(-n3ccnc3)c(F)c2)[C@@H]2CCC[C@@H]21 ZINC000353521556 476044398 /nfs/dbraw/zinc/04/43/98/476044398.db2.gz QAVPLFVFAJPZNW-SZMVWBNQSA-N 1 3 328.435 2.974 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccc(-n3ccnc3)c(F)c2)[C@@H]2CCC[C@@H]21 ZINC000353521556 476044402 /nfs/dbraw/zinc/04/44/02/476044402.db2.gz QAVPLFVFAJPZNW-SZMVWBNQSA-N 1 3 328.435 2.974 10 0 EFAEHO COC1CCN(C2(C[NH2+][C@@H]3CCN(C)[C@@H]4CCC[C@@H]43)CCCC2)CC1 ZINC000353531837 476053937 /nfs/dbraw/zinc/05/39/37/476053937.db2.gz PMXFBNLGVSVINR-VAMGGRTRSA-N 1 3 349.563 2.872 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)[C@@H]2CCC[C@@H]21 ZINC000353604544 476118349 /nfs/dbraw/zinc/11/83/49/476118349.db2.gz JFUIWJPEQFJYHP-TUFLPTIASA-N 1 3 327.516 2.971 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]23)CCN1C ZINC000336693894 476125468 /nfs/dbraw/zinc/12/54/68/476125468.db2.gz IBXRTHRSZSJRAB-GHRYLNIYSA-N 1 3 327.516 2.969 10 0 EFAEHO CN1CC[C@H]([NH2+]CCOc2cccc(C(F)(F)F)n2)[C@@H]2CCC[C@H]21 ZINC000353615981 476126999 /nfs/dbraw/zinc/12/69/99/476126999.db2.gz XSVYQWNVUMHPBU-MELADBBJSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCOc2cccc(C(F)(F)F)n2)[C@@H]2CCC[C@H]21 ZINC000353615981 476127004 /nfs/dbraw/zinc/12/70/04/476127004.db2.gz XSVYQWNVUMHPBU-MELADBBJSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@H+]1CC[C@H](NCCOc2cccc(C(F)(F)F)n2)[C@@H]2CCC[C@H]21 ZINC000353615981 476127010 /nfs/dbraw/zinc/12/70/10/476127010.db2.gz XSVYQWNVUMHPBU-MELADBBJSA-N 1 3 343.393 2.942 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]C2CC(N3CCCCC3)C2)[C@@H](C)C1 ZINC000359038928 476135852 /nfs/dbraw/zinc/13/58/52/476135852.db2.gz VKRLKVPQGRROKZ-FVELJTHGSA-N 1 3 337.552 2.730 10 0 EFAEHO C[C@@H]1CCC[C@@H]([NH+]2CCC(N[C@@H]3CCC(=O)NC34CCC4)CC2)C1 ZINC000338774018 476175542 /nfs/dbraw/zinc/17/55/42/476175542.db2.gz CLXIBTSJVJOIIV-KBAYOESNSA-N 1 3 333.520 2.820 10 0 EFAEHO C[C@@H]1CCC[C@@H](N2CCC([NH2+][C@@H]3CCC(=O)NC34CCC4)CC2)C1 ZINC000338774018 476175549 /nfs/dbraw/zinc/17/55/49/476175549.db2.gz CLXIBTSJVJOIIV-KBAYOESNSA-N 1 3 333.520 2.820 10 0 EFAEHO c1cnc(N2CCC[C@H]([NH2+]C3CCN(C4CCCCC4)CC3)C2)nc1 ZINC000359101779 476189474 /nfs/dbraw/zinc/18/94/74/476189474.db2.gz DOYXPGGQOVDIHB-SFHVURJKSA-N 1 3 343.519 2.832 10 0 EFAEHO CC[C@H]1C[C@@H](C[NH+]2CCC(C)(CN3CCN(C)CC3)CC2)CCO1 ZINC000350551355 476239225 /nfs/dbraw/zinc/23/92/25/476239225.db2.gz FENROXLOKZQWJE-OALUTQOASA-N 1 3 337.552 2.541 10 0 EFAEHO C[NH+](C)[C@H](CNC(=O)CN1CCC(C)(C2CC2)CC1)c1ccccc1 ZINC000352189243 476535461 /nfs/dbraw/zinc/53/54/61/476535461.db2.gz LTRPLAWFGOHCDE-LJQANCHMSA-N 1 3 343.515 2.918 10 0 EFAEHO CN1CCC[C@H](CNC(=O)CC[NH3+])[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000364851258 476547625 /nfs/dbraw/zinc/54/76/25/476547625.db2.gz PIYXWVHHZUOQQK-CZUORRHYSA-N 1 3 343.393 2.553 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000377760039 476566750 /nfs/dbraw/zinc/56/67/50/476566750.db2.gz INCSSORSKDIWSU-VQIMIIECSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000377760039 476566757 /nfs/dbraw/zinc/56/67/57/476566757.db2.gz INCSSORSKDIWSU-VQIMIIECSA-N 1 3 341.515 2.827 10 0 EFAEHO C[NH+](C)C1CCN(C(=O)c2ccc(CN3CCCCC3)cc2)CC1 ZINC000357778796 476598032 /nfs/dbraw/zinc/59/80/32/476598032.db2.gz NOMYVTVFBBYKEP-UHFFFAOYSA-N 1 3 329.488 2.839 10 0 EFAEHO C[C@H]1CCOCCN1Cc1ccccc1C[N@@H+]1CCOCC[C@@H]1C ZINC000374986558 476622986 /nfs/dbraw/zinc/62/29/86/476622986.db2.gz JLALQLXYYILGCH-ROUUACIJSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@H]1CCOCCN1Cc1ccccc1C[N@H+]1CCOCC[C@@H]1C ZINC000374986558 476622991 /nfs/dbraw/zinc/62/29/91/476622991.db2.gz JLALQLXYYILGCH-ROUUACIJSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000377908074 476637781 /nfs/dbraw/zinc/63/77/81/476637781.db2.gz QYCDXWAPKIQBKY-QGZVKYPTSA-N 1 3 343.515 2.744 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000377908074 476637785 /nfs/dbraw/zinc/63/77/85/476637785.db2.gz QYCDXWAPKIQBKY-QGZVKYPTSA-N 1 3 343.515 2.744 10 0 EFAEHO CC(C)[NH+]1CCC(NC[C@H](CO)Cc2ccc(F)c(F)c2)CC1 ZINC000357849009 476647710 /nfs/dbraw/zinc/64/77/10/476647710.db2.gz KYXRYLKXGOVZBC-OAHLLOKOSA-N 1 3 326.431 2.578 10 0 EFAEHO CCCC[N@H+](C)C[C@H](C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000357871111 476662099 /nfs/dbraw/zinc/66/20/99/476662099.db2.gz NELRGZWITHODIA-YTQUADARSA-N 1 3 346.519 2.851 10 0 EFAEHO CCCC[N@@H+](C)C[C@H](C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000357871111 476662103 /nfs/dbraw/zinc/66/21/03/476662103.db2.gz NELRGZWITHODIA-YTQUADARSA-N 1 3 346.519 2.851 10 0 EFAEHO CN1CCC[C@@H](CNC(=O)NC(C)(C)CC[NH3+])[C@@H]1c1cccs1 ZINC000422605635 476716641 /nfs/dbraw/zinc/71/66/41/476716641.db2.gz QKNNIJYVCCAZLB-DZGCQCFKSA-N 1 3 338.521 2.558 10 0 EFAEHO C(=C/C[N@@H+]1CCC[C@@]2(CCOC2)C1)\CN1CCC[C@]2(CCOC2)C1 ZINC000451912948 476721721 /nfs/dbraw/zinc/72/17/21/476721721.db2.gz VLIBMYYGMMEZBC-FWDLARJDSA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C/C[N@H+]1CCC[C@@]2(CCOC2)C1)\CN1CCC[C@]2(CCOC2)C1 ZINC000451912948 476721727 /nfs/dbraw/zinc/72/17/27/476721727.db2.gz VLIBMYYGMMEZBC-FWDLARJDSA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C/C[N@@H+]1CCC[C@]2(CCOC2)C1)\CN1CCC[C@@]2(CCOC2)C1 ZINC000451912948 476721734 /nfs/dbraw/zinc/72/17/34/476721734.db2.gz VLIBMYYGMMEZBC-FWDLARJDSA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C/C[N@H+]1CCC[C@]2(CCOC2)C1)\CN1CCC[C@@]2(CCOC2)C1 ZINC000451912948 476721741 /nfs/dbraw/zinc/72/17/41/476721741.db2.gz VLIBMYYGMMEZBC-FWDLARJDSA-N 1 3 334.504 2.548 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@H]2CCC[C@H]2C[NH3+])CCN1Cc1ccccc1 ZINC000379675890 476731767 /nfs/dbraw/zinc/73/17/67/476731767.db2.gz YDIBHCGJARPJCG-LULLPPNCSA-N 1 3 329.488 2.531 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H](Cc1ccccc1)CN(C)C ZINC000422709143 476737415 /nfs/dbraw/zinc/73/74/15/476737415.db2.gz CWOTVVCRQFIEDH-QFBILLFUSA-N 1 3 326.488 2.672 10 0 EFAEHO C[C@@H]([NH2+]C1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C1CNC1 ZINC000422713181 476738627 /nfs/dbraw/zinc/73/86/27/476738627.db2.gz OYBGVYZVWNLHAJ-CYBMUJFWSA-N 1 3 341.421 2.867 10 0 EFAEHO Cc1cccc2[nH]cc(CCN[C@@H]3CCOC[C@H]3[C@@H]3CCC[NH2+]3)c21 ZINC000422716438 476740494 /nfs/dbraw/zinc/74/04/94/476740494.db2.gz NDVRTDVIFDWTSR-OKZBNKHCSA-N 1 3 327.472 2.766 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)C1CCC([NH3+])CC1 ZINC000382716722 476745254 /nfs/dbraw/zinc/74/52/54/476745254.db2.gz FVVJXPRHZBWWOT-IVMQYODDSA-N 1 3 329.488 2.627 10 0 EFAEHO C[C@H]1CCN(C(=O)C2CCC([NH3+])CC2)CCN1Cc1ccccc1 ZINC000382754564 476747204 /nfs/dbraw/zinc/74/72/04/476747204.db2.gz GGQPPJNOENOURQ-IVMQYODDSA-N 1 3 329.488 2.627 10 0 EFAEHO C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)CC1CC[NH+](C)CC1 ZINC000365887137 476751674 /nfs/dbraw/zinc/75/16/74/476751674.db2.gz JLMVJJPWVGCCJF-GOSISDBHSA-N 1 3 343.515 2.841 10 0 EFAEHO C(N[C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)C1(N2CCOCC2)CCCCC1 ZINC000422751103 476759689 /nfs/dbraw/zinc/75/96/89/476759689.db2.gz CEZZRAIMCXZQGF-HSALFYBXSA-N 1 3 349.563 2.922 10 0 EFAEHO C[C@@H]1CN(C(C)(C)CN[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)C[C@@H](C)O1 ZINC000422788439 476776730 /nfs/dbraw/zinc/77/67/30/476776730.db2.gz APQNGSMSLQFVPL-IEWDOMPSSA-N 1 3 337.552 2.775 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@H](C)c1cnn(-c2ccc(F)cc2)c1C ZINC000422788550 476776819 /nfs/dbraw/zinc/77/68/19/476776819.db2.gz SJPRXMSKJHQVTO-CZUORRHYSA-N 1 3 334.439 2.724 10 0 EFAEHO CCCCOCCOCCN[C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422802262 476783169 /nfs/dbraw/zinc/78/31/69/476783169.db2.gz DEXUMAPZAVGIIH-ICSRJNTNSA-N 1 3 348.487 2.665 10 0 EFAEHO O=C(c1ccco1)N1CCC([NH2+][C@@H]2CCC[C@H]2[C@H]2CCCCN2)CC1 ZINC000422817073 476792332 /nfs/dbraw/zinc/79/23/32/476792332.db2.gz GOCGQEWRQANCJJ-RCCFBDPRSA-N 1 3 345.487 2.785 10 0 EFAEHO c1ccc(COCCCCN[C@@H]2CCOC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000422830806 476798942 /nfs/dbraw/zinc/79/89/42/476798942.db2.gz DBNXZLUUGFXTJI-HSALFYBXSA-N 1 3 332.488 2.730 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@H]1CCN(c2ncccc2Cl)C1 ZINC000422872035 476821649 /nfs/dbraw/zinc/82/16/49/476821649.db2.gz FJUXFBUGTWCAMA-HIFRSBDPSA-N 1 3 345.878 2.827 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1cn(-c2ccccc2)nc1C(C)C ZINC000422872130 476822538 /nfs/dbraw/zinc/82/25/38/476822538.db2.gz FUQIADAMMGGCOY-QGZVFWFLSA-N 1 3 330.476 2.839 10 0 EFAEHO C[C@@H]([NH2+]CC1=CCN(C)CC1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000392273238 476823768 /nfs/dbraw/zinc/82/37/68/476823768.db2.gz WPTFTUNOSCJFPS-WBVHZDCISA-N 1 3 337.508 2.874 10 0 EFAEHO COc1cccc(OCCC[NH2+][C@@H](C)c2ccc(CN)nc2C)c1 ZINC000422916771 476844974 /nfs/dbraw/zinc/84/49/74/476844974.db2.gz FACFOUBHCRYAJW-AWEZNQCLSA-N 1 3 329.444 2.977 10 0 EFAEHO C(CN[C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)Cc1nnc2n1CCCCC2 ZINC000422915891 476845883 /nfs/dbraw/zinc/84/58/83/476845883.db2.gz BWRHLIMCFUEUSS-KZNAEPCWSA-N 1 3 345.535 2.838 10 0 EFAEHO C(C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCCN1)Cc1nnc2n1CCCCC2 ZINC000422915891 476845892 /nfs/dbraw/zinc/84/58/92/476845892.db2.gz BWRHLIMCFUEUSS-KZNAEPCWSA-N 1 3 345.535 2.838 10 0 EFAEHO CCOc1ccc([C@H](C)NC(=O)CCCN[C@H]2C[NH2+]CC[C@@H]2C)cc1 ZINC000422925667 476849304 /nfs/dbraw/zinc/84/93/04/476849304.db2.gz CAGUBGHYUPORSG-BXWFABGCSA-N 1 3 347.503 2.630 10 0 EFAEHO CCO[C@H]1C[C@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)C1(C)C ZINC000397600861 476858003 /nfs/dbraw/zinc/85/80/03/476858003.db2.gz UCEDPIAHYWWOEP-OALUTQOASA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@]1(C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCCS1 ZINC000397679248 476859804 /nfs/dbraw/zinc/85/98/04/476859804.db2.gz KXDDKTCUHKWFQF-GOSISDBHSA-N 1 3 334.529 2.889 10 0 EFAEHO CCOC(=O)C1([C@@H](C)N[C@@H]2COc3c2ccc(C)c3C)CC[NH2+]CC1 ZINC000422959802 476866382 /nfs/dbraw/zinc/86/63/82/476866382.db2.gz UOQIHXDJUANMAD-NVXWUHKLSA-N 1 3 346.471 2.648 10 0 EFAEHO C[C@H](Nc1ccc(N2CCC([NH+](C)C)CC2)cn1)c1cnccc1N ZINC000422957852 476867492 /nfs/dbraw/zinc/86/74/92/476867492.db2.gz VMODHOQWILFALB-AWEZNQCLSA-N 1 3 340.475 2.593 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)c2ccccc2CC[NH3+])CN1Cc1ccccc1 ZINC000398127738 476869349 /nfs/dbraw/zinc/86/93/49/476869349.db2.gz IODDJVPHKAUUKT-QFBILLFUSA-N 1 3 337.467 2.581 10 0 EFAEHO OC[C@@H](CNC1C[C@H]2CC[C@@H](C1)[NH2+]2)Cc1ccc(C(F)(F)F)cc1 ZINC000422993662 476882508 /nfs/dbraw/zinc/88/25/08/476882508.db2.gz TTYUVYRYKTYJMU-KTFSGNIMSA-N 1 3 342.405 2.729 10 0 EFAEHO NC[C@@H]1CCCC[C@@H]1[NH2+]C[C@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422994934 476884300 /nfs/dbraw/zinc/88/43/00/476884300.db2.gz WOYHZKSKIPCSQK-VYDXJSESSA-N 1 3 344.421 2.964 10 0 EFAEHO NC[C@@H]1CCCC[C@H]1[NH2+]C[C@@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422994935 476884532 /nfs/dbraw/zinc/88/45/32/476884532.db2.gz WOYHZKSKIPCSQK-YQQAZPJKSA-N 1 3 344.421 2.964 10 0 EFAEHO Clc1ccc(COCCN[C@@H]2CCOC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000423002106 476886811 /nfs/dbraw/zinc/88/68/11/476886811.db2.gz IVSAHLHJDWBWRV-KZNAEPCWSA-N 1 3 338.879 2.603 10 0 EFAEHO NCC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@H]2CCc2ccccc2)C1 ZINC000414694281 476888091 /nfs/dbraw/zinc/88/80/91/476888091.db2.gz NASHDASDWBXQHA-UXHICEINSA-N 1 3 343.515 2.671 10 0 EFAEHO NCC(=O)N1CCC[C@H](C[N@H+]2CCCC[C@H]2CCc2ccccc2)C1 ZINC000414694281 476888097 /nfs/dbraw/zinc/88/80/97/476888097.db2.gz NASHDASDWBXQHA-UXHICEINSA-N 1 3 343.515 2.671 10 0 EFAEHO [NH3+][C@@H]1CCC[C@@H]1NCCCOc1ncc(C(F)(F)F)cc1Cl ZINC000423008371 476889587 /nfs/dbraw/zinc/88/95/87/476889587.db2.gz AAQDKZWRAZMCCB-NEPJUHHUSA-N 1 3 337.773 2.992 10 0 EFAEHO CC(C)N(C)CCC[NH2+][C@@H](C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000400459087 476889784 /nfs/dbraw/zinc/88/97/84/476889784.db2.gz QVNYFWJKINHVOZ-HOTGVXAUSA-N 1 3 327.513 2.952 10 0 EFAEHO Cc1ccc2c(CCN[C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)cn(C)c2c1 ZINC000423057057 476908385 /nfs/dbraw/zinc/90/83/85/476908385.db2.gz GRTXOUWFDQCZHC-VAMGGRTRSA-N 1 3 341.499 2.776 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@H](CO)Cc1ccc(F)c(F)c1 ZINC000423069342 476915186 /nfs/dbraw/zinc/91/51/86/476915186.db2.gz DTILFEYUHJWRJF-WFASDCNBSA-N 1 3 349.425 2.629 10 0 EFAEHO Cc1cc(N2CCC[C@H](N[C@H](C)C[C@H]3CCCCC[NH2+]3)C2)n(C)n1 ZINC000423074380 476916529 /nfs/dbraw/zinc/91/65/29/476916529.db2.gz LLEBWNKQTYDJGI-NXHRZFHOSA-N 1 3 333.524 2.598 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@@H]1CSc2ccc(Br)cc21 ZINC000423088898 476924436 /nfs/dbraw/zinc/92/44/36/476924436.db2.gz RFADXNAOPUBSEW-WCQYABFASA-N 1 3 345.306 2.939 10 0 EFAEHO CCCN1CCC[C@H]1CN[C@H](c1ccc(OC)cc1)[C@@H]1CCC[NH2+]1 ZINC000423114464 476932272 /nfs/dbraw/zinc/93/22/72/476932272.db2.gz VUQPCQWBDKULFW-YSIASYRMSA-N 1 3 331.504 2.952 10 0 EFAEHO c1ccc([C@H]2CC[C@H](CN[C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)O2)cc1 ZINC000423127416 476937953 /nfs/dbraw/zinc/93/79/53/476937953.db2.gz SZERQGNEPROSLS-OUUBHVDSSA-N 1 3 330.472 2.653 10 0 EFAEHO c1ccc([C@@H]2CC[C@H](CN[C@@H]3CCOC[C@H]3[C@H]3CCC[NH2+]3)O2)cc1 ZINC000423127412 476938024 /nfs/dbraw/zinc/93/80/24/476938024.db2.gz SZERQGNEPROSLS-IVDHNXQLSA-N 1 3 330.472 2.653 10 0 EFAEHO COc1c(C)cc(C[N@@H+]2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1C ZINC000370705763 476944087 /nfs/dbraw/zinc/94/40/87/476944087.db2.gz IYDOAJIVKIVATN-ICSRJNTNSA-N 1 3 345.531 2.770 10 0 EFAEHO COc1c(C)cc(C[N@H+]2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1C ZINC000370705763 476944095 /nfs/dbraw/zinc/94/40/95/476944095.db2.gz IYDOAJIVKIVATN-ICSRJNTNSA-N 1 3 345.531 2.770 10 0 EFAEHO COc1c(C)cc(CN2CC[C@H]([NH+]3CCN(C)CC3)[C@@H](C)C2)cc1C ZINC000370705763 476944102 /nfs/dbraw/zinc/94/41/02/476944102.db2.gz IYDOAJIVKIVATN-ICSRJNTNSA-N 1 3 345.531 2.770 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000423173968 476953706 /nfs/dbraw/zinc/95/37/06/476953706.db2.gz ASCDDBQEUXMWQN-RHSMWYFYSA-N 1 3 328.435 2.917 10 0 EFAEHO CC(=O)Nc1ccc([C@H](C)NCCC[NH2+]Cc2cccnc2)cc1 ZINC000423181049 476955620 /nfs/dbraw/zinc/95/56/20/476955620.db2.gz CBGQDIYPQGZNGC-HNNXBMFYSA-N 1 3 326.444 2.871 10 0 EFAEHO C[C@H]([NH3+])[C@@H](Cc1ccccc1)N[C@H]1CCN(c2ccc(F)cc2)C1 ZINC000423187466 476957223 /nfs/dbraw/zinc/95/72/23/476957223.db2.gz POWQHAZTRPFDQE-ZAAXVRCTSA-N 1 3 327.447 2.953 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2ccc3c(c2)CNCC3)[C@H](C)C1 ZINC000415896732 476961095 /nfs/dbraw/zinc/96/10/95/476961095.db2.gz OVMJRWFFCJNJJK-KDOFPFPSSA-N 1 3 330.476 2.526 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc3c(c2)CNCC3)[C@H](C)C1 ZINC000415896732 476961102 /nfs/dbraw/zinc/96/11/02/476961102.db2.gz OVMJRWFFCJNJJK-KDOFPFPSSA-N 1 3 330.476 2.526 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+]2CCC[C@H](c3ccccn3)C2)CC1 ZINC000408518917 476961318 /nfs/dbraw/zinc/96/13/18/476961318.db2.gz KCERGKHGGDXWFI-IBGZPJMESA-N 1 3 330.520 2.677 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+]2CCC[C@H](c3ccccn3)C2)CC1 ZINC000408518917 476961325 /nfs/dbraw/zinc/96/13/25/476961325.db2.gz KCERGKHGGDXWFI-IBGZPJMESA-N 1 3 330.520 2.677 10 0 EFAEHO Cc1ccnc([C@H]2CC[N@@H+](CCCN3CCN(C(C)C)CC3)C2)c1 ZINC000408523837 476965143 /nfs/dbraw/zinc/96/51/43/476965143.db2.gz NXNXETVWQVAUNT-IBGZPJMESA-N 1 3 330.520 2.595 10 0 EFAEHO Cc1ccnc([C@H]2CC[N@H+](CCCN3CCN(C(C)C)CC3)C2)c1 ZINC000408523837 476965148 /nfs/dbraw/zinc/96/51/48/476965148.db2.gz NXNXETVWQVAUNT-IBGZPJMESA-N 1 3 330.520 2.595 10 0 EFAEHO CC[NH2+]Cc1ccccc1NC(=O)N1CC[C@@]2(C1)CCCN(C)C2 ZINC000415928623 476972877 /nfs/dbraw/zinc/97/28/77/476972877.db2.gz GDTGHJWQZFWFSY-IBGZPJMESA-N 1 3 330.476 2.746 10 0 EFAEHO CC1CC[NH+](CCCCNC(=O)Nc2ccc3c(c2)CNC3)CC1 ZINC000415996089 476982912 /nfs/dbraw/zinc/98/29/12/476982912.db2.gz MBYKHTRJCSMZPX-UHFFFAOYSA-N 1 3 330.476 2.923 10 0 EFAEHO O=C(Nc1ccc2c(c1)CNC2)N[C@H]1CC[N@H+](CC2CCCC2)C1 ZINC000415999921 476986025 /nfs/dbraw/zinc/98/60/25/476986025.db2.gz WHVNFHJGGGOYQH-SFHVURJKSA-N 1 3 328.460 2.676 10 0 EFAEHO O=C(Nc1ccc2c(c1)CNC2)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000415999921 476986030 /nfs/dbraw/zinc/98/60/30/476986030.db2.gz WHVNFHJGGGOYQH-SFHVURJKSA-N 1 3 328.460 2.676 10 0 EFAEHO O=C(Nc1ccc2c(c1)CNC2)N[C@@H]1CC[N@H+](CC2CCCC2)C1 ZINC000415999916 476986624 /nfs/dbraw/zinc/98/66/24/476986624.db2.gz WHVNFHJGGGOYQH-GOSISDBHSA-N 1 3 328.460 2.676 10 0 EFAEHO O=C(Nc1ccc2c(c1)CNC2)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000415999916 476986635 /nfs/dbraw/zinc/98/66/35/476986635.db2.gz WHVNFHJGGGOYQH-GOSISDBHSA-N 1 3 328.460 2.676 10 0 EFAEHO C[N@H+](CCCNC(=O)Nc1ccc2c(c1)CNC2)Cc1ccccc1 ZINC000416014383 476991216 /nfs/dbraw/zinc/99/12/16/476991216.db2.gz SNQSWNNRHLWJLY-UHFFFAOYSA-N 1 3 338.455 2.933 10 0 EFAEHO C[N@@H+](CCCNC(=O)Nc1ccc2c(c1)CNC2)Cc1ccccc1 ZINC000416014383 476991222 /nfs/dbraw/zinc/99/12/22/476991222.db2.gz SNQSWNNRHLWJLY-UHFFFAOYSA-N 1 3 338.455 2.933 10 0 EFAEHO Cc1cc(C)n(-c2ccc(C[NH2+][C@@H]3CCN(C)[C@@H]4CCC[C@@H]43)cn2)n1 ZINC000375791634 477008503 /nfs/dbraw/zinc/00/85/03/477008503.db2.gz OVFFCIQINIRWMI-GUDVDZBRSA-N 1 3 339.487 2.847 10 0 EFAEHO CC(C)C[NH+]1CCC(NC(=O)CCN2CCc3ccccc3C2)CC1 ZINC000416143007 477036532 /nfs/dbraw/zinc/03/65/32/477036532.db2.gz IQFXBJFNASOQDY-UHFFFAOYSA-N 1 3 343.515 2.671 10 0 EFAEHO FC1(F)CCNC[C@@H]1N[C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000423486966 477046163 /nfs/dbraw/zinc/04/61/63/477046163.db2.gz TXDMLZKLHQGGRU-OKYOBFRVSA-N 1 3 349.469 2.874 10 0 EFAEHO FC1(F)CCNC[C@@H]1N[C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000423486966 477046167 /nfs/dbraw/zinc/04/61/67/477046167.db2.gz TXDMLZKLHQGGRU-OKYOBFRVSA-N 1 3 349.469 2.874 10 0 EFAEHO CC[C@@H]([NH2+]CC1(N)C2CC3CC(C2)CC1C3)C1(C(=O)OC)CCC1 ZINC000423527481 477063879 /nfs/dbraw/zinc/06/38/79/477063879.db2.gz MPWPOAWRHCBZIW-XQYHGENGSA-N 1 3 334.504 2.852 10 0 EFAEHO CC[C@@H](NCC1([NH3+])C2CC3CC(C2)CC1C3)C1(C(=O)OC)CCC1 ZINC000423527481 477063887 /nfs/dbraw/zinc/06/38/87/477063887.db2.gz MPWPOAWRHCBZIW-XQYHGENGSA-N 1 3 334.504 2.852 10 0 EFAEHO COC(=O)C[C@@H]1CC[C@H]([NH2+]CC2(N)C3CC4CC(C3)CC2C4)[C@H]1C ZINC000423530302 477066026 /nfs/dbraw/zinc/06/60/26/477066026.db2.gz QZKMTEQAZODVMA-JZAWVGGASA-N 1 3 334.504 2.707 10 0 EFAEHO COc1cc(OC)cc(OCC[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@@H]32)c1 ZINC000375891927 477066401 /nfs/dbraw/zinc/06/64/01/477066401.db2.gz XKAIKBIBZRXQRP-GUDVDZBRSA-N 1 3 334.460 2.545 10 0 EFAEHO COc1cc(OC)cc(OCCN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)c1 ZINC000375891927 477066406 /nfs/dbraw/zinc/06/64/06/477066406.db2.gz XKAIKBIBZRXQRP-GUDVDZBRSA-N 1 3 334.460 2.545 10 0 EFAEHO COc1cc(OC)cc(OCCN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@@H]32)c1 ZINC000375891927 477066413 /nfs/dbraw/zinc/06/64/13/477066413.db2.gz XKAIKBIBZRXQRP-GUDVDZBRSA-N 1 3 334.460 2.545 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@H](O)c2ccc(Cl)c(F)c2)[C@H]2CCC[C@@H]21 ZINC000375896079 477068007 /nfs/dbraw/zinc/06/80/07/477068007.db2.gz SOLRZYXFQDOXNP-ZCPGHIKRSA-N 1 3 326.843 2.975 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)[C@H]2CCC[C@@H]21 ZINC000375896079 477068011 /nfs/dbraw/zinc/06/80/11/477068011.db2.gz SOLRZYXFQDOXNP-ZCPGHIKRSA-N 1 3 326.843 2.975 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)[C@H]2CCC[C@@H]21 ZINC000375896079 477068012 /nfs/dbraw/zinc/06/80/12/477068012.db2.gz SOLRZYXFQDOXNP-ZCPGHIKRSA-N 1 3 326.843 2.975 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCNC(=O)c2ccc(Cl)cc2)[C@H]2CCC[C@H]21 ZINC000375898498 477070044 /nfs/dbraw/zinc/07/00/44/477070044.db2.gz UBKAZVVQUKDPKM-IXDOHACOSA-N 1 3 335.879 2.532 10 0 EFAEHO C[N@H+]1CC[C@H](NCCNC(=O)c2ccc(Cl)cc2)[C@H]2CCC[C@H]21 ZINC000375898498 477070049 /nfs/dbraw/zinc/07/00/49/477070049.db2.gz UBKAZVVQUKDPKM-IXDOHACOSA-N 1 3 335.879 2.532 10 0 EFAEHO O=C(CC[N@@H+]1CCc2ccccc2C1)NC[C@H]1CCCCN1C1CC1 ZINC000416224516 477078168 /nfs/dbraw/zinc/07/81/68/477078168.db2.gz QTMVEXJSPATTAJ-HXUWFJFHSA-N 1 3 341.499 2.568 10 0 EFAEHO O=C(CC[N@H+]1CCc2ccccc2C1)NC[C@H]1CCCCN1C1CC1 ZINC000416224516 477078173 /nfs/dbraw/zinc/07/81/73/477078173.db2.gz QTMVEXJSPATTAJ-HXUWFJFHSA-N 1 3 341.499 2.568 10 0 EFAEHO O=C(CCN1CCc2ccccc2C1)NCCCCC[NH+]1CCCC1 ZINC000416246337 477091875 /nfs/dbraw/zinc/09/18/75/477091875.db2.gz ZTQWNMQMUGZQCZ-UHFFFAOYSA-N 1 3 343.515 2.817 10 0 EFAEHO C[NH+](C)CC1CCC(NC(=O)CCN2CCc3ccccc3C2)CC1 ZINC000431828863 477102490 /nfs/dbraw/zinc/10/24/90/477102490.db2.gz AXEXZZWWTCGGCW-UHFFFAOYSA-N 1 3 343.515 2.671 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N(CCN(C)C)Cc1ccsc1 ZINC000457718045 477159827 /nfs/dbraw/zinc/15/98/27/477159827.db2.gz WLCSXQWMPWRLCX-OAHLLOKOSA-N 1 3 340.537 2.552 10 0 EFAEHO CN1C[C@H](N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)CCC1=O ZINC000453105059 477169370 /nfs/dbraw/zinc/16/93/70/477169370.db2.gz BBHTYPFHYUZOPP-WCIQWLHISA-N 1 3 341.499 2.640 10 0 EFAEHO CN1C[C@H](N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)CCC1=O ZINC000453105059 477169375 /nfs/dbraw/zinc/16/93/75/477169375.db2.gz BBHTYPFHYUZOPP-WCIQWLHISA-N 1 3 341.499 2.640 10 0 EFAEHO COC1([C@H](C)[NH2+]C[C@H]2CCN(CCc3ccccc3)C2)CCOCC1 ZINC000453114508 477171308 /nfs/dbraw/zinc/17/13/08/477171308.db2.gz VTELHSKRKKVPSD-AZUAARDMSA-N 1 3 346.515 2.725 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)[C@H]2CCC[C@H]21 ZINC000453392311 477219452 /nfs/dbraw/zinc/21/94/52/477219452.db2.gz YUWSWXKODWOVGM-MJJLTSLDSA-N 1 3 346.519 2.843 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)[C@H]2CCC[C@H]21 ZINC000453392311 477219458 /nfs/dbraw/zinc/21/94/58/477219458.db2.gz YUWSWXKODWOVGM-MJJLTSLDSA-N 1 3 346.519 2.843 10 0 EFAEHO CCN1CCC(NC(=O)C[NH2+][C@@H]2CCCC[C@H]2c2ccccc2)CC1 ZINC000411561732 477276514 /nfs/dbraw/zinc/27/65/14/477276514.db2.gz RIAGOSMHVPSSJV-VQTJNVASSA-N 1 3 343.515 2.903 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1 ZINC000416808991 477317980 /nfs/dbraw/zinc/31/79/80/477317980.db2.gz PLVJKZZFPWQEIR-BEFAXECRSA-N 1 3 340.471 2.808 10 0 EFAEHO C[C@H]1OCC[C@H]1N(CCO)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000411669354 477318844 /nfs/dbraw/zinc/31/88/44/477318844.db2.gz ZIMFIYFCVICPKU-YLJYHZDGSA-N 1 3 332.488 2.644 10 0 EFAEHO O=C(NC[C@@H]1CCCCN1C1CC1)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000434348191 477334268 /nfs/dbraw/zinc/33/42/68/477334268.db2.gz DMSOSYJSQRDCPK-OALUTQOASA-N 1 3 348.535 2.663 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@@H]([NH2+]Cc3ccccc3CN3CC[C@@H](O)C3)C[C@H]2C1 ZINC000424281482 477355788 /nfs/dbraw/zinc/35/57/88/477355788.db2.gz NMVRNIKVQBQRQE-XNTOXWQXSA-N 1 3 344.499 2.546 10 0 EFAEHO O=C(NCCC[NH2+]C1CC1)NCc1ccccc1CN1CCCCC1 ZINC000416899635 477360351 /nfs/dbraw/zinc/36/03/51/477360351.db2.gz GHFNMLIBQHIYMZ-UHFFFAOYSA-N 1 3 344.503 2.614 10 0 EFAEHO O=C(NCC[C@H]1CCC[NH2+]1)NCc1ccccc1CN1CCCCC1 ZINC000416906927 477364515 /nfs/dbraw/zinc/36/45/15/477364515.db2.gz TZLIHPCNKVGBDQ-LJQANCHMSA-N 1 3 344.503 2.614 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@H](CN)c1ccc2ccccc2c1 ZINC000417011534 477421048 /nfs/dbraw/zinc/42/10/48/477421048.db2.gz SHLSFJQXSRFUBD-DNVCBOLYSA-N 1 3 342.487 2.869 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@@H](N)c1ccccc1 ZINC000417026480 477429418 /nfs/dbraw/zinc/42/94/18/477429418.db2.gz ANCWEKZTWPAGTI-SJLPKXTDSA-N 1 3 332.492 2.640 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@@H](N)c1ccccc1 ZINC000417026480 477429424 /nfs/dbraw/zinc/42/94/24/477429424.db2.gz ANCWEKZTWPAGTI-SJLPKXTDSA-N 1 3 332.492 2.640 10 0 EFAEHO C[C@@H](CN1CCCC1=O)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449089769 477432308 /nfs/dbraw/zinc/43/23/08/477432308.db2.gz LIFVJJCAKVBDSA-ROUUACIJSA-N 1 3 343.515 2.683 10 0 EFAEHO C[C@H](CN1CCCC1=O)NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449089768 477432908 /nfs/dbraw/zinc/43/29/08/477432908.db2.gz LIFVJJCAKVBDSA-QZTJIDSGSA-N 1 3 343.515 2.683 10 0 EFAEHO C[C@@H]([NH2+]C1CCN([C@@H](C)Cc2ccccc2)CC1)C(=O)NC(C)(C)C ZINC000449099416 477438290 /nfs/dbraw/zinc/43/82/90/477438290.db2.gz TUUMGHGVGGOIQL-DLBZAZTESA-N 1 3 345.531 2.975 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)NC[C@H](N)c2ccccc2)C1 ZINC000417216037 477447656 /nfs/dbraw/zinc/44/76/56/477447656.db2.gz AVGZPPVHIFUHST-JZXOWHBKSA-N 1 3 346.519 2.742 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)NC[C@H](N)c2ccccc2)C1 ZINC000417216037 477447664 /nfs/dbraw/zinc/44/76/64/477447664.db2.gz AVGZPPVHIFUHST-JZXOWHBKSA-N 1 3 346.519 2.742 10 0 EFAEHO C[C@H](Cc1ccccc1)N1CCC([NH2+][C@H]2CCN(C3CC3)C2)CC1 ZINC000449130729 477451867 /nfs/dbraw/zinc/45/18/67/477451867.db2.gz HOFIVPYGFCPZOJ-XLIONFOSSA-N 1 3 327.516 2.908 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(N[C@H]2CCN(C3CC3)C2)CC1 ZINC000449130729 477451872 /nfs/dbraw/zinc/45/18/72/477451872.db2.gz HOFIVPYGFCPZOJ-XLIONFOSSA-N 1 3 327.516 2.908 10 0 EFAEHO Cc1noc(CCCNC2CC[NH+]([C@H](C)Cc3ccccc3)CC2)n1 ZINC000449132832 477453065 /nfs/dbraw/zinc/45/30/65/477453065.db2.gz BSFLIGAZCAPRKU-MRXNPFEDSA-N 1 3 342.487 2.996 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NCCC(=O)NC(C)(C)C)CC1 ZINC000449145846 477458011 /nfs/dbraw/zinc/45/80/11/477458011.db2.gz MKLSKPRFAHTCAJ-KRWDZBQOSA-N 1 3 345.531 2.976 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NC[C@]2(O)CCSC2)CC1 ZINC000449182307 477473930 /nfs/dbraw/zinc/47/39/30/477473930.db2.gz JMPKVZZJASPUBC-VQIMIIECSA-N 1 3 334.529 2.540 10 0 EFAEHO CC(C)[N@@H+]1CC[C@H](N(C)C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)C1 ZINC000458581790 477493482 /nfs/dbraw/zinc/49/34/82/477493482.db2.gz MHYUSPPMIGCSSC-FHWLQOOXSA-N 1 3 344.503 2.556 10 0 EFAEHO CC(C)[N@H+]1CC[C@H](N(C)C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)C1 ZINC000458581790 477493486 /nfs/dbraw/zinc/49/34/86/477493486.db2.gz MHYUSPPMIGCSSC-FHWLQOOXSA-N 1 3 344.503 2.556 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NCCN2CCSCC2)CC1 ZINC000449221588 477494386 /nfs/dbraw/zinc/49/43/86/477494386.db2.gz GUCAMUYVWYDEMK-GOSISDBHSA-N 1 3 347.572 2.720 10 0 EFAEHO C[C@H]1C[C@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)C[N@@H+]1C1CC1 ZINC000371801597 477501340 /nfs/dbraw/zinc/50/13/40/477501340.db2.gz HJZRKWMIZAURCO-RDJZCZTQSA-N 1 3 343.515 2.853 10 0 EFAEHO C[C@H]1C[C@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)C[N@H+]1C1CC1 ZINC000371801597 477501350 /nfs/dbraw/zinc/50/13/50/477501350.db2.gz HJZRKWMIZAURCO-RDJZCZTQSA-N 1 3 343.515 2.853 10 0 EFAEHO CCO[C@@H]1COCC[C@H]1NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449238251 477501362 /nfs/dbraw/zinc/50/13/62/477501362.db2.gz QLSPDVJKIPCXEY-DUXKGJEZSA-N 1 3 346.515 2.866 10 0 EFAEHO C[C@@H]1OCC[C@@]1(O)CNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449291279 477529404 /nfs/dbraw/zinc/52/94/04/477529404.db2.gz KENHDKBOYRJMDM-HNAYVOBHSA-N 1 3 326.525 2.795 10 0 EFAEHO C[C@@H](Cc1ccccc1)N1CCC([NH2+]CCN2CC=CCC2)CC1 ZINC000449298707 477532475 /nfs/dbraw/zinc/53/24/75/477532475.db2.gz KPUMGDBNIPHJNJ-IBGZPJMESA-N 1 3 327.516 2.934 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NCCN2CC=CCC2)CC1 ZINC000449298707 477532480 /nfs/dbraw/zinc/53/24/80/477532480.db2.gz KPUMGDBNIPHJNJ-IBGZPJMESA-N 1 3 327.516 2.934 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC[C@@H](C)CCO)CC1 ZINC000449357625 477559530 /nfs/dbraw/zinc/55/95/30/477559530.db2.gz LIFPICFFSKWDML-GOSISDBHSA-N 1 3 333.520 2.717 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC[C@H](C)CCO)CC1 ZINC000449357626 477560798 /nfs/dbraw/zinc/56/07/98/477560798.db2.gz LIFPICFFSKWDML-SFHVURJKSA-N 1 3 333.520 2.717 10 0 EFAEHO COc1cc(C[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@@H]32)cc(OC)c1OC ZINC000367537948 477562968 /nfs/dbraw/zinc/56/29/68/477562968.db2.gz KKMRMHKRUMPSLX-OAGGEKHMSA-N 1 3 334.460 2.675 10 0 EFAEHO COc1cc(C[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@H]32)cc(OC)c1OC ZINC000367537946 477563128 /nfs/dbraw/zinc/56/31/28/477563128.db2.gz KKMRMHKRUMPSLX-ARFHVFGLSA-N 1 3 334.460 2.675 10 0 EFAEHO Cn1c2ccc(F)cc2nc1CCN[C@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000367627165 477608969 /nfs/dbraw/zinc/60/89/69/477608969.db2.gz RYBFILVWUAELMV-YQQAZPJKSA-N 1 3 330.451 2.717 10 0 EFAEHO Cn1c2ccc(F)cc2nc1CCN[C@H]1CC[N@@H+](C)[C@@H]2CCC[C@H]21 ZINC000367627165 477608974 /nfs/dbraw/zinc/60/89/74/477608974.db2.gz RYBFILVWUAELMV-YQQAZPJKSA-N 1 3 330.451 2.717 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccnc(OC3CCOCC3)c2)[C@@H]2CCC[C@H]21 ZINC000367625214 477609056 /nfs/dbraw/zinc/60/90/56/477609056.db2.gz XHZAZRNSUGOXMH-GBESFXJTSA-N 1 3 345.487 2.602 10 0 EFAEHO Cc1cc(C)n2c(CN3CC[C@H](C4CC[NH+](C)CC4)C3)cnc2n1 ZINC000367690656 477638270 /nfs/dbraw/zinc/63/82/70/477638270.db2.gz VCFYKAYKZQABQE-KRWDZBQOSA-N 1 3 327.476 2.510 10 0 EFAEHO COc1ccc([C@H](C[NH3+])CN[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000420395534 477746457 /nfs/dbraw/zinc/74/64/57/477746457.db2.gz DMJKGBOFRYORLM-NRSPTQNISA-N 1 3 339.483 2.773 10 0 EFAEHO COc1ccc([C@H](CN)C[NH2+][C@@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000420395534 477746463 /nfs/dbraw/zinc/74/64/63/477746463.db2.gz DMJKGBOFRYORLM-NRSPTQNISA-N 1 3 339.483 2.773 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)Nc2cccc(OCCN(C)C)c2)CC[N@@H+]1C ZINC000437782580 477752871 /nfs/dbraw/zinc/75/28/71/477752871.db2.gz WKJKSOMTOGETFM-WBVHZDCISA-N 1 3 348.491 2.573 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)Nc2cccc(OCCN(C)C)c2)CC[N@H+]1C ZINC000437782580 477752877 /nfs/dbraw/zinc/75/28/77/477752877.db2.gz WKJKSOMTOGETFM-WBVHZDCISA-N 1 3 348.491 2.573 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCN(Cc3ccccc3)C[C@H](C)C2)CC[N@@H+]1C ZINC000456326923 477861527 /nfs/dbraw/zinc/86/15/27/477861527.db2.gz HACYZGWVTJAMIV-BJLQDIEVSA-N 1 3 343.515 2.697 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCN(Cc3ccccc3)C[C@H](C)C2)CC[N@H+]1C ZINC000456326923 477861535 /nfs/dbraw/zinc/86/15/35/477861535.db2.gz HACYZGWVTJAMIV-BJLQDIEVSA-N 1 3 343.515 2.697 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@]1(C)CCC[N@@H+]1Cc1ccccc1)N(C)C ZINC000428325217 477870455 /nfs/dbraw/zinc/87/04/55/477870455.db2.gz KXHKUEYJJRRIRY-QUCCMNQESA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@]1(C)CCC[N@H+]1Cc1ccccc1)N(C)C ZINC000428325217 477870460 /nfs/dbraw/zinc/87/04/60/477870460.db2.gz KXHKUEYJJRRIRY-QUCCMNQESA-N 1 3 331.504 2.744 10 0 EFAEHO CCc1cc(CCCN2CCC[N@@H+](C3CCN(CC)CC3)CC2)on1 ZINC000420983992 477877761 /nfs/dbraw/zinc/87/77/61/477877761.db2.gz RSXDBPMRKWTVSA-UHFFFAOYSA-N 1 3 348.535 2.662 10 0 EFAEHO CCc1cc(CCCN2CCC[N@H+](C3CCN(CC)CC3)CC2)on1 ZINC000420983992 477877766 /nfs/dbraw/zinc/87/77/66/477877766.db2.gz RSXDBPMRKWTVSA-UHFFFAOYSA-N 1 3 348.535 2.662 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@](O)(CC)C2)CC1 ZINC000428433797 477896372 /nfs/dbraw/zinc/89/63/72/477896372.db2.gz UZTQTMIVRGTKQR-HXUWFJFHSA-N 1 3 331.504 2.565 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@](O)(CC)C2)CC1 ZINC000428433797 477896382 /nfs/dbraw/zinc/89/63/82/477896382.db2.gz UZTQTMIVRGTKQR-HXUWFJFHSA-N 1 3 331.504 2.565 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NCCc2cn(C)cn2)CC1 ZINC000459653184 478023828 /nfs/dbraw/zinc/02/38/28/478023828.db2.gz DAKIPOHOFVQIOY-QGZVFWFLSA-N 1 3 326.488 2.648 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2C[C@H](CO)C[C@H](C)C2)CC1 ZINC000421357895 478050600 /nfs/dbraw/zinc/05/06/00/478050600.db2.gz AGZVEYSRVHJVLI-RBUKOAKNSA-N 1 3 345.531 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2C[C@H](CO)C[C@H](C)C2)CC1 ZINC000421357895 478050610 /nfs/dbraw/zinc/05/06/10/478050610.db2.gz AGZVEYSRVHJVLI-RBUKOAKNSA-N 1 3 345.531 2.669 10 0 EFAEHO COC[C@@H](C)C[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000560598564 478116394 /nfs/dbraw/zinc/11/63/94/478116394.db2.gz VQDFVHSNAJXZLR-AZUAARDMSA-N 1 3 346.515 2.787 10 0 EFAEHO C[N@@H+]1CCCC[C@@H]1CN1CCN(CC2Cc3ccccc3C2)CC1 ZINC000562376178 478240153 /nfs/dbraw/zinc/24/01/53/478240153.db2.gz AWUDBOPFMXBJFV-OAQYLSRUSA-N 1 3 327.516 2.503 10 0 EFAEHO C[N@H+]1CCCC[C@@H]1CN1CCN(CC2Cc3ccccc3C2)CC1 ZINC000562376178 478240157 /nfs/dbraw/zinc/24/01/57/478240157.db2.gz AWUDBOPFMXBJFV-OAQYLSRUSA-N 1 3 327.516 2.503 10 0 EFAEHO O=C(NC[C@@H]1CCC[N@@H+]1CC1CCCCC1)N1CCN2CCC1CC2 ZINC000570230973 478314894 /nfs/dbraw/zinc/31/48/94/478314894.db2.gz HXDXMBFLNFTDMW-IBGZPJMESA-N 1 3 348.535 2.521 10 0 EFAEHO O=C(NC[C@@H]1CCC[N@H+]1CC1CCCCC1)N1CCN2CCC1CC2 ZINC000570230973 478314900 /nfs/dbraw/zinc/31/49/00/478314900.db2.gz HXDXMBFLNFTDMW-IBGZPJMESA-N 1 3 348.535 2.521 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N1CCC[N@@H+](C(C)(C)C)CC1 ZINC000594310442 478328212 /nfs/dbraw/zinc/32/82/12/478328212.db2.gz FKRGPGVMJPHRTK-IAGOWNOFSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N1CCC[N@H+](C(C)(C)C)CC1 ZINC000594310442 478328220 /nfs/dbraw/zinc/32/82/20/478328220.db2.gz FKRGPGVMJPHRTK-IAGOWNOFSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@H]1CN(Cc2ccnc3ccccc23)CC[C@@H]1[NH+]1CCN(C)CC1 ZINC000539823373 478443824 /nfs/dbraw/zinc/44/38/24/478443824.db2.gz FCFJLFDGGAJTNJ-UWJYYQICSA-N 1 3 338.499 2.693 10 0 EFAEHO C[C@@H]([NH2+]CCCN1CCN(c2ccncc2)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000527648947 478460856 /nfs/dbraw/zinc/46/08/56/478460856.db2.gz ABEHALVCBCMVBY-UXPWSPDFSA-N 1 3 328.504 2.618 10 0 EFAEHO CC[N@@H+]1CC[C@H](NC[C@@H]2CCN2Cc2ccc(OC)cc2)[C@@H](C)C1 ZINC000527963718 478590679 /nfs/dbraw/zinc/59/06/79/478590679.db2.gz BONWBGDFYJOOKM-QRFRQXIXSA-N 1 3 331.504 2.589 10 0 EFAEHO CC[N@H+]1CC[C@H](NC[C@@H]2CCN2Cc2ccc(OC)cc2)[C@@H](C)C1 ZINC000527963718 478590687 /nfs/dbraw/zinc/59/06/87/478590687.db2.gz BONWBGDFYJOOKM-QRFRQXIXSA-N 1 3 331.504 2.589 10 0 EFAEHO COc1ccc(CN2CC[C@H]2CNC2CC[NH+](C(C)C)CC2)cc1 ZINC000527965509 478592413 /nfs/dbraw/zinc/59/24/13/478592413.db2.gz DSYJTQCVNZWUBX-IBGZPJMESA-N 1 3 331.504 2.732 10 0 EFAEHO CCC[NH+]1CCC(NC[C@H]2CCN2Cc2ccc(OC)cc2)CC1 ZINC000527970350 478593773 /nfs/dbraw/zinc/59/37/73/478593773.db2.gz PNHWLFWJLKDKQI-LJQANCHMSA-N 1 3 331.504 2.734 10 0 EFAEHO CCC[NH+]1CCC(NC[C@@H]2CCN2Cc2ccc(OC)cc2)CC1 ZINC000527970347 478594480 /nfs/dbraw/zinc/59/44/80/478594480.db2.gz PNHWLFWJLKDKQI-IBGZPJMESA-N 1 3 331.504 2.734 10 0 EFAEHO CN(CCC(=O)NC1CC[NH+](C2CCCCC2)CC1)c1ccncc1 ZINC000541854475 478597870 /nfs/dbraw/zinc/59/78/70/478597870.db2.gz RDOJEZSWQQTPDC-UHFFFAOYSA-N 1 3 344.503 2.821 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1[C@H]1CCCN(C(=O)CCN(C)c2ccncc2)C1 ZINC000541857506 478598542 /nfs/dbraw/zinc/59/85/42/478598542.db2.gz KXYDUDMUUROVCL-SCTDSRPQSA-N 1 3 344.503 2.772 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)CCN(C)c2ccncc2)C1 ZINC000541857506 478598552 /nfs/dbraw/zinc/59/85/52/478598552.db2.gz KXYDUDMUUROVCL-SCTDSRPQSA-N 1 3 344.503 2.772 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1[C@@H]1CCCN(C(=O)CCN(C)c2ccncc2)C1 ZINC000541857508 478599780 /nfs/dbraw/zinc/59/97/80/478599780.db2.gz KXYDUDMUUROVCL-ZIFCJYIRSA-N 1 3 344.503 2.772 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)CCN(C)c2ccncc2)C1 ZINC000541857508 478599787 /nfs/dbraw/zinc/59/97/87/478599787.db2.gz KXYDUDMUUROVCL-ZIFCJYIRSA-N 1 3 344.503 2.772 10 0 EFAEHO COc1ccc(CC[NH2+][C@@H](C)c2ccc(OCCN(C)C)cc2)cn1 ZINC000527987959 478600939 /nfs/dbraw/zinc/60/09/39/478600939.db2.gz OUFHHYDAOVZCNH-INIZCTEOSA-N 1 3 343.471 2.924 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)N(C)CCC[NH+](C)C)c1ccccc1 ZINC000582514921 478616267 /nfs/dbraw/zinc/61/62/67/478616267.db2.gz UMHYVMXEAFZELK-SFHVURJKSA-N 1 3 334.508 2.663 10 0 EFAEHO Cc1ccc(OC[C@H](O)C[NH2+]C2CCN(C3CCCC3)CC2)cc1 ZINC000571790564 478679606 /nfs/dbraw/zinc/67/96/06/478679606.db2.gz VDKMHXLUJHDJLI-LJQANCHMSA-N 1 3 332.488 2.731 10 0 EFAEHO Cc1noc(CCN[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)n1 ZINC000583066303 478753368 /nfs/dbraw/zinc/75/33/68/478753368.db2.gz CVJVIRAZFSYLLS-IPMKNSEASA-N 1 3 340.471 2.953 10 0 EFAEHO Cc1noc(CCN[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)n1 ZINC000583066303 478753374 /nfs/dbraw/zinc/75/33/74/478753374.db2.gz CVJVIRAZFSYLLS-IPMKNSEASA-N 1 3 340.471 2.953 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCC1CCN(C[C@H](O)CC2(O)CCC2)CC1 ZINC000528404384 478757573 /nfs/dbraw/zinc/75/75/73/478757573.db2.gz NIINOEZMNIFXSS-IEBWSBKVSA-N 1 3 338.536 2.629 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCC1CCN(C[C@H](O)CC2(O)CCC2)CC1 ZINC000528404384 478757583 /nfs/dbraw/zinc/75/75/83/478757583.db2.gz NIINOEZMNIFXSS-IEBWSBKVSA-N 1 3 338.536 2.629 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)CCN(C)c2ccncc2)C1 ZINC000543715362 478771881 /nfs/dbraw/zinc/77/18/81/478771881.db2.gz CWJKSTGLZQFOIC-CALCHBBNSA-N 1 3 346.519 2.781 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)CCN(C)c2ccncc2)C1 ZINC000543715362 478771885 /nfs/dbraw/zinc/77/18/85/478771885.db2.gz CWJKSTGLZQFOIC-CALCHBBNSA-N 1 3 346.519 2.781 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[NH2+]C[C@H](C)CN1CCCC1 ZINC000564650999 478777509 /nfs/dbraw/zinc/77/75/09/478777509.db2.gz FRSLMQMGGWYVQS-ZWKOTPCHSA-N 1 3 334.504 2.871 10 0 EFAEHO CC(C)C[C@H](CNC(=O)C(N)C(F)(F)F)[NH2+][C@@H](C)c1ccccc1 ZINC000564655198 478778951 /nfs/dbraw/zinc/77/89/51/478778951.db2.gz OAWCNQSJKINIQO-CFVMTHIKSA-N 1 3 345.409 2.758 10 0 EFAEHO C[C@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@@H+]1CCC[C@H](C)C1 ZINC000572495812 478851065 /nfs/dbraw/zinc/85/10/65/478851065.db2.gz GCAMZRIEYKBWJO-UONOGXRCSA-N 1 3 348.466 2.713 10 0 EFAEHO C[C@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@H+]1CCC[C@H](C)C1 ZINC000572495812 478851078 /nfs/dbraw/zinc/85/10/78/478851078.db2.gz GCAMZRIEYKBWJO-UONOGXRCSA-N 1 3 348.466 2.713 10 0 EFAEHO CCO[C@@H]1C[C@H](NC[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)[C@H]1SC ZINC000592523953 478930943 /nfs/dbraw/zinc/93/09/43/478930943.db2.gz AWLUZHNXVWVSHL-ICBNADEASA-N 1 3 334.529 2.830 10 0 EFAEHO CCO[C@@H]1C[C@H](NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)[C@H]1SC ZINC000592523953 478930953 /nfs/dbraw/zinc/93/09/53/478930953.db2.gz AWLUZHNXVWVSHL-ICBNADEASA-N 1 3 334.529 2.830 10 0 EFAEHO N[C@@H]1CCCCC[C@H]1[NH2+]Cc1ccc(Cn2ccccc2=O)cc1 ZINC000583806466 478945322 /nfs/dbraw/zinc/94/53/22/478945322.db2.gz IZBUEPIXTHNBQD-RTBURBONSA-N 1 3 325.456 2.646 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCc2cnn(C(C)C)c2C1 ZINC000572951482 478957047 /nfs/dbraw/zinc/95/70/47/478957047.db2.gz ZOORGOVHWHMXQC-BBRMVZONSA-N 1 3 327.476 2.834 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@@H]([C@H](C)O)C2)CC1 ZINC000546655629 479049967 /nfs/dbraw/zinc/04/99/67/479049967.db2.gz AHWCJPASTAAWIQ-RBUKOAKNSA-N 1 3 345.531 2.811 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@@H]([C@H](C)O)C2)CC1 ZINC000546655629 479049975 /nfs/dbraw/zinc/04/99/75/479049975.db2.gz AHWCJPASTAAWIQ-RBUKOAKNSA-N 1 3 345.531 2.811 10 0 EFAEHO COC(=O)c1cc2c(o1)c(OC)ccc2CNCC[C@@H]([NH3+])C(C)C ZINC000596102383 479139676 /nfs/dbraw/zinc/13/96/76/479139676.db2.gz IBOWGIHEFCIJDG-CQSZACIVSA-N 1 3 334.416 2.691 10 0 EFAEHO c1ncn(-c2cccc(CN[C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)c2)n1 ZINC000569802131 479179620 /nfs/dbraw/zinc/17/96/20/479179620.db2.gz CHUSDMRJDJWFNC-GBESFXJTSA-N 1 3 325.460 2.668 10 0 EFAEHO c1ncn(-c2cccc(CN[C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)c2)n1 ZINC000569802133 479179833 /nfs/dbraw/zinc/17/98/33/479179833.db2.gz CHUSDMRJDJWFNC-GUDVDZBRSA-N 1 3 325.460 2.668 10 0 EFAEHO O[C@@H](C[NH2+]Cc1ccccc1CN1CCC(O)CC1)CC1CCCC1 ZINC000574393475 479278231 /nfs/dbraw/zinc/27/82/31/479278231.db2.gz XEZXMJMUQGIDLP-OAQYLSRUSA-N 1 3 346.515 2.674 10 0 EFAEHO C[C@H](NC(=O)c1cccc(CN2CCCC2)c1)C1CC[NH+](C)CC1 ZINC000603321793 479345680 /nfs/dbraw/zinc/34/56/80/479345680.db2.gz RIRSLZGUNBHARI-INIZCTEOSA-N 1 3 329.488 2.743 10 0 EFAEHO NC[C@H]1CCC[C@@H]1[NH2+]CCc1ccc(I)cc1 ZINC000596652798 479373279 /nfs/dbraw/zinc/37/32/79/479373279.db2.gz HZSKNVMQORQCEB-OCCSQVGLSA-N 1 3 344.240 2.551 10 0 EFAEHO C[C@@H]([NH3+])C[C@H](C)NCCc1ccc(I)cc1 ZINC000596653991 479373428 /nfs/dbraw/zinc/37/34/28/479373428.db2.gz MWWIIEGQCMDEKR-MNOVXSKESA-N 1 3 332.229 2.549 10 0 EFAEHO C[C@@H](N)C[C@H](C)[NH2+]CCc1ccc(I)cc1 ZINC000596653991 479373432 /nfs/dbraw/zinc/37/34/32/479373432.db2.gz MWWIIEGQCMDEKR-MNOVXSKESA-N 1 3 332.229 2.549 10 0 EFAEHO C[C@H]([NH2+]C(C)(C)CNC(=O)N[C@@H]1CCCN(C)C1)c1ccccc1 ZINC000603593562 479409992 /nfs/dbraw/zinc/40/99/92/479409992.db2.gz MLBUGBAQQULUOJ-DOTOQJQBSA-N 1 3 332.492 2.509 10 0 EFAEHO CSCC[C@@H](N)C(=O)N[C@H]1CCCCC[N@H+](Cc2ccccc2)C1 ZINC000602594653 479415198 /nfs/dbraw/zinc/41/51/98/479415198.db2.gz ZETXUODRJPSLLT-ZWKOTPCHSA-N 1 3 349.544 2.628 10 0 EFAEHO CSCC[C@@H](N)C(=O)N[C@H]1CCCCC[N@@H+](Cc2ccccc2)C1 ZINC000602594653 479415201 /nfs/dbraw/zinc/41/52/01/479415201.db2.gz ZETXUODRJPSLLT-ZWKOTPCHSA-N 1 3 349.544 2.628 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@@H]3CCC[C@@H]4C[C@@H]43)CC2)CC1 ZINC000618499695 479470957 /nfs/dbraw/zinc/47/09/57/479470957.db2.gz PXXGHEKTIXAPKY-HBFSDRIKSA-N 1 3 347.547 2.735 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)N[C@H]1CCC[N@H+](C)C1)c1ccsc1 ZINC000618555339 479490226 /nfs/dbraw/zinc/49/02/26/479490226.db2.gz UIYHUPKIISGLEU-HOTGVXAUSA-N 1 3 338.521 2.524 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)N[C@H]1CCC[N@@H+](C)C1)c1ccsc1 ZINC000618555339 479490232 /nfs/dbraw/zinc/49/02/32/479490232.db2.gz UIYHUPKIISGLEU-HOTGVXAUSA-N 1 3 338.521 2.524 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)NCc2ccccc2CN2CCCCC2)CC[NH2+]1 ZINC000575898488 479498568 /nfs/dbraw/zinc/49/85/68/479498568.db2.gz BCAUVPULJWLKNW-VQIMIIECSA-N 1 3 344.503 2.612 10 0 EFAEHO C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@@H]2CCCN(C)C2)CC1 ZINC000604814146 479576123 /nfs/dbraw/zinc/57/61/23/479576123.db2.gz DBLQUDMZAZFUSA-QFBILLFUSA-N 1 3 344.503 2.605 10 0 EFAEHO Cc1ccc2occ(CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c2c1 ZINC000628051764 479747801 /nfs/dbraw/zinc/74/78/01/479747801.db2.gz OMZLVOFHUXVWCS-INIZCTEOSA-N 1 3 345.487 2.672 10 0 EFAEHO Cc1ccc2occ(CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c2c1 ZINC000628051764 479747806 /nfs/dbraw/zinc/74/78/06/479747806.db2.gz OMZLVOFHUXVWCS-INIZCTEOSA-N 1 3 345.487 2.672 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@@H](C)[C@H](CO)C2)CC1 ZINC000621738056 479777074 /nfs/dbraw/zinc/77/70/74/479777074.db2.gz YGLMSYPJJGJWQD-QUCCMNQESA-N 1 3 345.531 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@@H](C)[C@H](CO)C2)CC1 ZINC000621738056 479777077 /nfs/dbraw/zinc/77/70/77/479777077.db2.gz YGLMSYPJJGJWQD-QUCCMNQESA-N 1 3 345.531 2.669 10 0 EFAEHO CN1CC[C@@H]([NH2+]C[C@@H](c2cccs2)N2CCOCC2)CC1(C)C ZINC000623337613 480238794 /nfs/dbraw/zinc/23/87/94/480238794.db2.gz QIVFJGINHGDKKY-CVEARBPZSA-N 1 3 337.533 2.584 10 0 EFAEHO CN1CC[C@@H]([NH2+]C[C@@H](c2ccccc2)N2CCOCC2)CC1(C)C ZINC000623346323 480243369 /nfs/dbraw/zinc/24/33/69/480243369.db2.gz MQRDBNPIOZKJNV-MOPGFXCFSA-N 1 3 331.504 2.522 10 0 EFAEHO C[C@@H](CCc1ccc(OC(F)F)cc1)NCC1([NH3+])CCOCC1 ZINC000629387575 480244348 /nfs/dbraw/zinc/24/43/48/480244348.db2.gz JESCIDXTWBFAKQ-ZDUSSCGKSA-N 1 3 328.403 2.707 10 0 EFAEHO Cc1ccc(C2CC2)c(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000617502230 480244942 /nfs/dbraw/zinc/24/49/42/480244942.db2.gz HXALAIYGNJVROJ-INIZCTEOSA-N 1 3 331.504 2.874 10 0 EFAEHO Cc1ccc(C2CC2)c(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000617502230 480244949 /nfs/dbraw/zinc/24/49/49/480244949.db2.gz HXALAIYGNJVROJ-INIZCTEOSA-N 1 3 331.504 2.874 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C[C@@]12CCCC[C@@H]1C2(F)F ZINC000617502420 480245500 /nfs/dbraw/zinc/24/55/00/480245500.db2.gz ONNXGNTXFKOKPW-ZOBUZTSGSA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C[C@@]12CCCC[C@@H]1C2(F)F ZINC000617502420 480245504 /nfs/dbraw/zinc/24/55/04/480245504.db2.gz ONNXGNTXFKOKPW-ZOBUZTSGSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)c1cccc(CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000617502156 480245849 /nfs/dbraw/zinc/24/58/49/480245849.db2.gz FIQWPLRFOIVISG-KRWDZBQOSA-N 1 3 333.520 2.741 10 0 EFAEHO CC(C)c1cccc(CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000617502156 480245858 /nfs/dbraw/zinc/24/58/58/480245858.db2.gz FIQWPLRFOIVISG-KRWDZBQOSA-N 1 3 333.520 2.741 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000617503961 480246764 /nfs/dbraw/zinc/24/67/64/480246764.db2.gz CFVYZGGKESOKDZ-CCLIWJKGSA-N 1 3 335.536 2.591 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000617503961 480246771 /nfs/dbraw/zinc/24/67/71/480246771.db2.gz CFVYZGGKESOKDZ-CCLIWJKGSA-N 1 3 335.536 2.591 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(C(F)F)cc1 ZINC000617504751 480246882 /nfs/dbraw/zinc/24/68/82/480246882.db2.gz IWUJRGMSJBCJEU-ZDUSSCGKSA-N 1 3 327.419 2.626 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1occc1-c1ccccc1 ZINC000617504537 480247461 /nfs/dbraw/zinc/24/74/61/480247461.db2.gz ZZXHCDYULWBMOZ-INIZCTEOSA-N 1 3 343.471 2.948 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1occc1-c1ccccc1 ZINC000617504537 480247469 /nfs/dbraw/zinc/24/74/69/480247469.db2.gz ZZXHCDYULWBMOZ-INIZCTEOSA-N 1 3 343.471 2.948 10 0 EFAEHO Cc1cccc([C@@H](C[NH2+][C@H]2CCN(C)C(C)(C)C2)N2CCOCC2)c1 ZINC000623356720 480248293 /nfs/dbraw/zinc/24/82/93/480248293.db2.gz BVGYQSPTLJKQJS-VQTJNVASSA-N 1 3 345.531 2.831 10 0 EFAEHO Cc1cccc([C@@H](C[NH2+][C@@H]2CCN(C)C(C)(C)C2)N2CCOCC2)c1 ZINC000623356721 480248307 /nfs/dbraw/zinc/24/83/07/480248307.db2.gz BVGYQSPTLJKQJS-WOJBJXKFSA-N 1 3 345.531 2.831 10 0 EFAEHO Cc1cccc([C@H](C[NH2+][C@@H]2CCN(C)C(C)(C)C2)N2CCOCC2)c1 ZINC000623356719 480248674 /nfs/dbraw/zinc/24/86/74/480248674.db2.gz BVGYQSPTLJKQJS-UXHICEINSA-N 1 3 345.531 2.831 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc2sccc2c1 ZINC000617506423 480249315 /nfs/dbraw/zinc/24/93/15/480249315.db2.gz MTBVQCMIFWQSCP-AWEZNQCLSA-N 1 3 333.501 2.903 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc2sccc2c1 ZINC000617506423 480249319 /nfs/dbraw/zinc/24/93/19/480249319.db2.gz MTBVQCMIFWQSCP-AWEZNQCLSA-N 1 3 333.501 2.903 10 0 EFAEHO Cc1ccc(C[C@H](C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000617506605 480249397 /nfs/dbraw/zinc/24/93/97/480249397.db2.gz SRDXTYMRHXMOOS-ROUUACIJSA-N 1 3 333.520 2.562 10 0 EFAEHO Cc1ccc(C[C@H](C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000617506605 480249403 /nfs/dbraw/zinc/24/94/03/480249403.db2.gz SRDXTYMRHXMOOS-ROUUACIJSA-N 1 3 333.520 2.562 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C/C=C\c1cccc(F)c1 ZINC000617505923 480251012 /nfs/dbraw/zinc/25/10/12/480251012.db2.gz VNRFMEWPDGLYQY-HWYHOQROSA-N 1 3 335.467 2.617 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C/C=C\c1cccc(F)c1 ZINC000617505923 480251018 /nfs/dbraw/zinc/25/10/18/480251018.db2.gz VNRFMEWPDGLYQY-HWYHOQROSA-N 1 3 335.467 2.617 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(F)c2ccccc12 ZINC000617507127 480251758 /nfs/dbraw/zinc/25/17/58/480251758.db2.gz JGXJQBATWIBVTC-HNNXBMFYSA-N 1 3 345.462 2.981 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(F)c2ccccc12 ZINC000617507127 480251763 /nfs/dbraw/zinc/25/17/63/480251763.db2.gz JGXJQBATWIBVTC-HNNXBMFYSA-N 1 3 345.462 2.981 10 0 EFAEHO C[C@@H]1CN(Cc2cccc(CN[C@H]3CC[N@H+](C)C(C)(C)C3)c2)CCO1 ZINC000623375963 480255077 /nfs/dbraw/zinc/25/50/77/480255077.db2.gz AOCJBOJSBZAMOE-XLIONFOSSA-N 1 3 345.531 2.870 10 0 EFAEHO C[C@@H]1CN(Cc2cccc(CN[C@H]3CC[N@@H+](C)C(C)(C)C3)c2)CCO1 ZINC000623375963 480255078 /nfs/dbraw/zinc/25/50/78/480255078.db2.gz AOCJBOJSBZAMOE-XLIONFOSSA-N 1 3 345.531 2.870 10 0 EFAEHO C[C@@H]1CN(Cc2cccc(C[NH2+][C@H]3CCN(C)C(C)(C)C3)c2)CCO1 ZINC000623375963 480255081 /nfs/dbraw/zinc/25/50/81/480255081.db2.gz AOCJBOJSBZAMOE-XLIONFOSSA-N 1 3 345.531 2.870 10 0 EFAEHO CC[C@@H]1CN(C(=O)c2ccc(C[NH+]3CCCCC3)cc2)C[C@H](C)N1 ZINC000620898136 480264010 /nfs/dbraw/zinc/26/40/10/480264010.db2.gz OUQLQFNSDUXFLU-QFBILLFUSA-N 1 3 329.488 2.885 10 0 EFAEHO CCN(C(=O)c1ccc(C[NH+]2CCCCC2)cc1)[C@@H]1CCN(C)C1 ZINC000617551674 480273487 /nfs/dbraw/zinc/27/34/87/480273487.db2.gz WWFLJLKFLUQJAL-LJQANCHMSA-N 1 3 329.488 2.839 10 0 EFAEHO C[C@@H](CN1CCN(c2ccccc2)CC1)N[C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623428837 480278596 /nfs/dbraw/zinc/27/85/96/480278596.db2.gz AKNKTMABUKUKBA-RBUKOAKNSA-N 1 3 344.547 2.660 10 0 EFAEHO C[C@@H](CN1CCN(c2ccccc2)CC1)N[C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623428837 480278603 /nfs/dbraw/zinc/27/86/03/480278603.db2.gz AKNKTMABUKUKBA-RBUKOAKNSA-N 1 3 344.547 2.660 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCC([C@H]2CCC[NH2+]C2)CC1)c1ccccc1 ZINC000631829459 480288836 /nfs/dbraw/zinc/28/88/36/480288836.db2.gz RBRRMPFFNCAIPO-HLIPFELVSA-N 1 3 343.515 2.964 10 0 EFAEHO Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]CC1(N)CCOCC1 ZINC000629522117 480293451 /nfs/dbraw/zinc/29/34/51/480293451.db2.gz VKOKJJJUDHWFCU-GFCCVEGCSA-N 1 3 332.473 2.672 10 0 EFAEHO CC[C@H]([NH2+]CC1(N)CCOCC1)c1ccc(Br)cc1 ZINC000629525335 480294207 /nfs/dbraw/zinc/29/42/07/480294207.db2.gz ZWYHOQSGVILLCM-AWEZNQCLSA-N 1 3 327.266 2.998 10 0 EFAEHO [NH3+]C[C@@H]1CCCC[C@@H]1NC[C@@H]1CN(c2ccc(Cl)cc2)CCO1 ZINC000629523679 480295364 /nfs/dbraw/zinc/29/53/64/480295364.db2.gz NKLYUWCINYIVLV-QGTPRVQTSA-N 1 3 337.895 2.652 10 0 EFAEHO NC[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1CN(c2ccc(Cl)cc2)CCO1 ZINC000629523679 480295368 /nfs/dbraw/zinc/29/53/68/480295368.db2.gz NKLYUWCINYIVLV-QGTPRVQTSA-N 1 3 337.895 2.652 10 0 EFAEHO CC[C@@H](NCCOCC[NH2+]C)c1cc(F)cc(Br)c1 ZINC000629530177 480296864 /nfs/dbraw/zinc/29/68/64/480296864.db2.gz XNMVMGVQUKNMAP-CQSZACIVSA-N 1 3 333.245 2.865 10 0 EFAEHO C[NH2+]CCOCCN[C@H]1C[C@@H](C)c2c1cccc2Br ZINC000629528732 480296978 /nfs/dbraw/zinc/29/69/78/480296978.db2.gz HWWBJQLBBNEDLU-RISCZKNCSA-N 1 3 327.266 2.823 10 0 EFAEHO [NH3+]CCCOCCN[C@@H]1CCc2c1ccc(F)c2Br ZINC000629538458 480298000 /nfs/dbraw/zinc/29/80/00/480298000.db2.gz NAJFVKWYMWHOIW-CYBMUJFWSA-N 1 3 331.229 2.531 10 0 EFAEHO [NH3+]CCCOCCN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000629537110 480298235 /nfs/dbraw/zinc/29/82/35/480298235.db2.gz ITPPYRBRWJUQBE-CQSZACIVSA-N 1 3 343.265 2.618 10 0 EFAEHO C[C@H](N)[C@H]1COCC[C@@H]1[NH2+]CCc1c[nH]c2cc(F)c(Cl)cc12 ZINC000629544854 480299356 /nfs/dbraw/zinc/29/93/56/480299356.db2.gz JUZOZNRZVRQOGP-WNMQOVRZSA-N 1 3 339.842 2.845 10 0 EFAEHO CN1CC[C@@H]([NH2+][C@H](CO)c2ccc(Br)cc2)CC1(C)C ZINC000623479231 480304009 /nfs/dbraw/zinc/30/40/09/480304009.db2.gz LFXLEWCUFZNRDJ-HUUCEWRRSA-N 1 3 341.293 2.945 10 0 EFAEHO CNC[C@](C)(O)C[N@@H+]1C[C@@H](c2ccc(Br)cc2)C[C@@H]1C ZINC000629581597 480315836 /nfs/dbraw/zinc/31/58/36/480315836.db2.gz DMKKHXATBOCEET-NOLJZWGESA-N 1 3 341.293 2.597 10 0 EFAEHO CNC[C@](C)(O)C[N@H+]1C[C@@H](c2ccc(Br)cc2)C[C@@H]1C ZINC000629581597 480315838 /nfs/dbraw/zinc/31/58/38/480315838.db2.gz DMKKHXATBOCEET-NOLJZWGESA-N 1 3 341.293 2.597 10 0 EFAEHO C[NH2+]C[C@](C)(O)CN1C[C@@H](c2ccc(Br)cc2)C[C@@H]1C ZINC000629581597 480315845 /nfs/dbraw/zinc/31/58/45/480315845.db2.gz DMKKHXATBOCEET-NOLJZWGESA-N 1 3 341.293 2.597 10 0 EFAEHO CNC[C@](C)(O)C[N@@H+]1C[C@@H](c2ccc(Br)cc2)C[C@H]1C ZINC000629581595 480316063 /nfs/dbraw/zinc/31/60/63/480316063.db2.gz DMKKHXATBOCEET-INWMFGNUSA-N 1 3 341.293 2.597 10 0 EFAEHO CNC[C@](C)(O)C[N@H+]1C[C@@H](c2ccc(Br)cc2)C[C@H]1C ZINC000629581595 480316068 /nfs/dbraw/zinc/31/60/68/480316068.db2.gz DMKKHXATBOCEET-INWMFGNUSA-N 1 3 341.293 2.597 10 0 EFAEHO C[NH2+]C[C@](C)(O)CN1C[C@@H](c2ccc(Br)cc2)C[C@H]1C ZINC000629581595 480316073 /nfs/dbraw/zinc/31/60/73/480316073.db2.gz DMKKHXATBOCEET-INWMFGNUSA-N 1 3 341.293 2.597 10 0 EFAEHO C[N@@H+]1CC[C@@H](NC[C@@H](CO)Cc2cc(F)c(F)c(F)c2)CC1(C)C ZINC000623508169 480319613 /nfs/dbraw/zinc/31/96/13/480319613.db2.gz LGUFFFFQQMNYJK-UONOGXRCSA-N 1 3 344.421 2.717 10 0 EFAEHO C[N@H+]1CC[C@@H](NC[C@@H](CO)Cc2cc(F)c(F)c(F)c2)CC1(C)C ZINC000623508169 480319614 /nfs/dbraw/zinc/31/96/14/480319614.db2.gz LGUFFFFQQMNYJK-UONOGXRCSA-N 1 3 344.421 2.717 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)CC1(C)C ZINC000623515545 480322615 /nfs/dbraw/zinc/32/26/15/480322615.db2.gz FQXIVRFIBWQYAE-DLBZAZTESA-N 1 3 330.476 2.755 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)CC1(C)C ZINC000623515545 480322621 /nfs/dbraw/zinc/32/26/21/480322621.db2.gz FQXIVRFIBWQYAE-DLBZAZTESA-N 1 3 330.476 2.755 10 0 EFAEHO C[N@H+](CCNC(=O)NC[C@@H]1CCN1C1CCCCC1)C1CCCC1 ZINC000623576720 480346925 /nfs/dbraw/zinc/34/69/25/480346925.db2.gz JLBKZLNBJBNCBD-SFHVURJKSA-N 1 3 336.524 2.567 10 0 EFAEHO C[N@@H+](CCNC(=O)NC[C@@H]1CCN1C1CCCCC1)C1CCCC1 ZINC000623576720 480346931 /nfs/dbraw/zinc/34/69/31/480346931.db2.gz JLBKZLNBJBNCBD-SFHVURJKSA-N 1 3 336.524 2.567 10 0 EFAEHO Cc1ccc(-n2cc(CNCCOCCC[NH3+])c(C(C)(C)C)n2)cc1 ZINC000629677149 480353267 /nfs/dbraw/zinc/35/32/67/480353267.db2.gz CSOBATBYHUGVRZ-UHFFFAOYSA-N 1 3 344.503 2.933 10 0 EFAEHO C[C@H](CN1CCCCC1)NC(=O)NC[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC000623707766 480411959 /nfs/dbraw/zinc/41/19/59/480411959.db2.gz JXLMZAQVQWCBGL-AEFFLSMTSA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@H](CN1CCCCC1)NC(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000623707766 480411963 /nfs/dbraw/zinc/41/19/63/480411963.db2.gz JXLMZAQVQWCBGL-AEFFLSMTSA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@@H](NC(=O)NC[C@H]1CCN1C1CCCCC1)C(C)(C)C[NH+](C)C ZINC000623736992 480428763 /nfs/dbraw/zinc/42/87/63/480428763.db2.gz NIJNQKMNOPFKHX-NVXWUHKLSA-N 1 3 338.540 2.669 10 0 EFAEHO CN1CCC[C@H](NC(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)C1 ZINC000617932355 480432232 /nfs/dbraw/zinc/43/22/32/480432232.db2.gz ZNYUCIPZBZKFGO-IBGZPJMESA-N 1 3 344.503 2.931 10 0 EFAEHO C[C@@](O)(C[C@@H](O)CNCc1ccccc1C[NH+]1CCCCC1)C1CC1 ZINC000634698803 480439434 /nfs/dbraw/zinc/43/94/34/480439434.db2.gz YORGRYPIOYEOCV-NHCUHLMSSA-N 1 3 346.515 2.674 10 0 EFAEHO C[C@H](c1ccccc1)[NH+]1CCC(NC[C@@H](O)C[C@@](C)(O)C2CC2)CC1 ZINC000634704506 480444197 /nfs/dbraw/zinc/44/41/97/480444197.db2.gz LPNHGIYPWCCVJE-TYCQWZJGSA-N 1 3 346.515 2.714 10 0 EFAEHO C[NH+]1CCC(CCNCc2ccnn2CCc2ccccc2)CC1 ZINC000621334495 480456427 /nfs/dbraw/zinc/45/64/27/480456427.db2.gz HMXMFJUIYFMFOK-UHFFFAOYSA-N 1 3 326.488 2.947 10 0 EFAEHO CO[C@H]1C[C@@H](C[NH2+]Cc2ccccc2N(C)C2CCN(C)CC2)C1 ZINC000623823274 480471638 /nfs/dbraw/zinc/47/16/38/480471638.db2.gz UPXLAMYRLYVDPT-UWUNEBHHSA-N 1 3 331.504 2.732 10 0 EFAEHO C[N@@H+]1CC[C@@H](Nc2cccc(CN3CCC(O)CC3)c2)CC1(C)C ZINC000623938608 480530504 /nfs/dbraw/zinc/53/05/04/480530504.db2.gz WBBXNGMAHSXCHN-GOSISDBHSA-N 1 3 331.504 2.928 10 0 EFAEHO C[N@H+]1CC[C@@H](Nc2cccc(CN3CCC(O)CC3)c2)CC1(C)C ZINC000623938608 480530508 /nfs/dbraw/zinc/53/05/08/480530508.db2.gz WBBXNGMAHSXCHN-GOSISDBHSA-N 1 3 331.504 2.928 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1Cc2ccccc2[C@@H]1C ZINC000621532139 480577562 /nfs/dbraw/zinc/57/75/62/480577562.db2.gz SKVBILHWZNBPLV-HOTGVXAUSA-N 1 3 332.492 2.545 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1Cc2ccccc2[C@@H]1C ZINC000621532139 480577570 /nfs/dbraw/zinc/57/75/70/480577570.db2.gz SKVBILHWZNBPLV-HOTGVXAUSA-N 1 3 332.492 2.545 10 0 EFAEHO C[C@@H]1CC[C@H](NC(=O)NCc2ccccc2CN2CCCCC2)C[NH2+]1 ZINC000626926785 480585267 /nfs/dbraw/zinc/58/52/67/480585267.db2.gz DRZDWYCNBGBTFM-APWZRJJASA-N 1 3 344.503 2.612 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@@H]1CC[C@@H](C)[NH2+]C1)c1ccsc1 ZINC000626934386 480586979 /nfs/dbraw/zinc/58/69/79/480586979.db2.gz YEOUFWRWKUZLLM-FVQBIDKESA-N 1 3 338.521 2.571 10 0 EFAEHO CC[C@@H]1[NH2+]CC[C@H]1NC(=O)NC[C@H](c1ccsc1)N(CC)CC ZINC000626933211 480587273 /nfs/dbraw/zinc/58/72/73/480587273.db2.gz HWLOEJLTUARNKY-ARFHVFGLSA-N 1 3 338.521 2.571 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N[C@@H]2CC[C@@H](C)[NH2+]C2)N2CCCC2)cc1 ZINC000626956550 480597881 /nfs/dbraw/zinc/59/78/81/480597881.db2.gz DUQSNUOWXABOHX-QRQLOZEOSA-N 1 3 344.503 2.572 10 0 EFAEHO C[C@@H]1CC[C@H](NC(=O)N[C@@H](CN2CCCCC2)c2ccccc2)C[NH2+]1 ZINC000626978675 480607676 /nfs/dbraw/zinc/60/76/76/480607676.db2.gz HYSJIDJBARCFFB-NEWSRXKRSA-N 1 3 344.503 2.653 10 0 EFAEHO C[C@@H](c1ccccc1)N1CCC(NC(=O)N[C@H]2CC[C@@H](C)[NH2+]C2)CC1 ZINC000626980653 480608302 /nfs/dbraw/zinc/60/83/02/480608302.db2.gz VDWYGNRUEQZEEJ-GJYPPUQNSA-N 1 3 344.503 2.652 10 0 EFAEHO COc1ncc(Br)cc1CN[C@H](C)C1CC[NH+](C)CC1 ZINC000624133591 480624703 /nfs/dbraw/zinc/62/47/03/480624703.db2.gz QZBSETDSGJMURW-LLVKDONJSA-N 1 3 342.281 2.673 10 0 EFAEHO OC1CCN(Cc2ccc(C[NH2+]CC3CCSCC3)cc2)CC1 ZINC000638273015 480636658 /nfs/dbraw/zinc/63/66/58/480636658.db2.gz CYDIIJNLZPWWRB-UHFFFAOYSA-N 1 3 334.529 2.876 10 0 EFAEHO O=C(NC[C@@H]1CC[N@@H+]1C1CCCCC1)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000624316395 480705702 /nfs/dbraw/zinc/70/57/02/480705702.db2.gz PAAHNVGTSMSKJW-IPMKNSEASA-N 1 3 348.535 2.710 10 0 EFAEHO O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000624316395 480705709 /nfs/dbraw/zinc/70/57/09/480705709.db2.gz PAAHNVGTSMSKJW-IPMKNSEASA-N 1 3 348.535 2.710 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@H](NC(=O)NC[C@H]2CCN2C2CCCCC2)C1 ZINC000624336284 480713417 /nfs/dbraw/zinc/71/34/17/480713417.db2.gz NERWTAMVEVCIND-DOTOQJQBSA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@H](NC(=O)NC[C@H]2CCN2C2CCCCC2)C1 ZINC000624336284 480713422 /nfs/dbraw/zinc/71/34/22/480713422.db2.gz NERWTAMVEVCIND-DOTOQJQBSA-N 1 3 336.524 2.565 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)CC[N@@H+]1C ZINC000632924493 480800351 /nfs/dbraw/zinc/80/03/51/480800351.db2.gz WYJHMUILFLJQSQ-GVDBMIGSSA-N 1 3 337.895 2.789 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)CC[N@H+]1C ZINC000632924493 480800356 /nfs/dbraw/zinc/80/03/56/480800356.db2.gz WYJHMUILFLJQSQ-GVDBMIGSSA-N 1 3 337.895 2.789 10 0 EFAEHO O=C(NC[C@H]1CC[N@@H+]1C1CCCCC1)NC[C@@H]1CCN1C1CCCC1 ZINC000624544560 480810379 /nfs/dbraw/zinc/81/03/79/480810379.db2.gz XCAMZOZRBBFVNX-MOPGFXCFSA-N 1 3 348.535 2.710 10 0 EFAEHO O=C(NC[C@H]1CC[N@H+]1C1CCCCC1)NC[C@@H]1CCN1C1CCCC1 ZINC000624544560 480810384 /nfs/dbraw/zinc/81/03/84/480810384.db2.gz XCAMZOZRBBFVNX-MOPGFXCFSA-N 1 3 348.535 2.710 10 0 EFAEHO CCC(C)(C)CCNC(=O)NC1CCN(C2CC[NH+](C)CC2)CC1 ZINC000632979295 480832073 /nfs/dbraw/zinc/83/20/73/480832073.db2.gz PHMKYUKFOQEHAZ-UHFFFAOYSA-N 1 3 338.540 2.671 10 0 EFAEHO O=C(C[C@H]1CC[NH2+]C1)N[C@@H]1CCCCCN(Cc2ccccc2)C1 ZINC000638850871 480896244 /nfs/dbraw/zinc/89/62/44/480896244.db2.gz HWQUMSRKFWVYDE-RTBURBONSA-N 1 3 329.488 2.547 10 0 EFAEHO N[C@@H](CC(F)F)C(=O)N[C@@H]1CCCCC[N@H+](Cc2ccccc2)C1 ZINC000638851690 480897301 /nfs/dbraw/zinc/89/73/01/480897301.db2.gz PMWXTFPBNCCXMG-CVEARBPZSA-N 1 3 339.430 2.530 10 0 EFAEHO N[C@@H](CC(F)F)C(=O)N[C@@H]1CCCCC[N@@H+](Cc2ccccc2)C1 ZINC000638851690 480897307 /nfs/dbraw/zinc/89/73/07/480897307.db2.gz PMWXTFPBNCCXMG-CVEARBPZSA-N 1 3 339.430 2.530 10 0 EFAEHO CCC(C)(C)N1CCN(C(=O)NC[C@H]2CC[N@@H+]2C2CCCC2)CC1 ZINC000624783879 480898643 /nfs/dbraw/zinc/89/86/43/480898643.db2.gz ARCLKVYZNMCLPL-QGZVFWFLSA-N 1 3 336.524 2.519 10 0 EFAEHO CCC(C)(C)N1CCN(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)CC1 ZINC000624783879 480898644 /nfs/dbraw/zinc/89/86/44/480898644.db2.gz ARCLKVYZNMCLPL-QGZVFWFLSA-N 1 3 336.524 2.519 10 0 EFAEHO COc1cncc(/C=C/CCN2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@@H]32)c1 ZINC000645837915 480941138 /nfs/dbraw/zinc/94/11/38/480941138.db2.gz PPQJRTSRCHWGBT-QBJFOYOQSA-N 1 3 345.487 2.677 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647542704 480990919 /nfs/dbraw/zinc/99/09/19/480990919.db2.gz ACWKTCJGSDHVGJ-ZWKOTPCHSA-N 1 3 339.487 2.787 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000661405003 480993241 /nfs/dbraw/zinc/99/32/41/480993241.db2.gz BOBVBLZZRKYRTE-DOTOQJQBSA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000661405003 480993248 /nfs/dbraw/zinc/99/32/48/480993248.db2.gz BOBVBLZZRKYRTE-DOTOQJQBSA-N 1 3 336.524 2.565 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1c(F)cccc1Cl ZINC000666637715 481000571 /nfs/dbraw/zinc/00/05/71/481000571.db2.gz VLDPIUROYFJQAP-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1c(F)cccc1Cl ZINC000666637715 481000574 /nfs/dbraw/zinc/00/05/74/481000574.db2.gz VLDPIUROYFJQAP-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2CC[N@@H+](C3CCCCC3)C2)CCN1C ZINC000666664355 481019145 /nfs/dbraw/zinc/01/91/45/481019145.db2.gz CEULYJHAVHPVGL-NUJGCVRESA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)CCN1C ZINC000666664355 481019155 /nfs/dbraw/zinc/01/91/55/481019155.db2.gz CEULYJHAVHPVGL-NUJGCVRESA-N 1 3 336.524 2.518 10 0 EFAEHO CC[NH+]1CCC(NC(=O)CN2CC[C@H]([C@H]3CCCC3(C)C)C2)CC1 ZINC000646049586 481040024 /nfs/dbraw/zinc/04/00/24/481040024.db2.gz OBQRAVQIWGXBQE-FUHWJXTLSA-N 1 3 335.536 2.735 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)[C@@H]1CC[C@@H](C2CC2)[NH2+]1)c1ccsc1 ZINC000653109983 481084737 /nfs/dbraw/zinc/08/47/37/481084737.db2.gz UCBDQIOBMWLUIU-YESZJQIVSA-N 1 3 335.517 2.778 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@H]2CC[C@H](C3CC3)[NH2+]2)N2CCCC2)cc1 ZINC000653113909 481088679 /nfs/dbraw/zinc/08/86/79/481088679.db2.gz RKNIKKJOZJFGKO-AQNXPRMDSA-N 1 3 341.499 2.779 10 0 EFAEHO CCN1CCN(c2ccccc2N[C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC000647789306 481106537 /nfs/dbraw/zinc/10/65/37/481106537.db2.gz ANUFZLUAIFFITF-FGTMMUONSA-N 1 3 328.504 2.629 10 0 EFAEHO c1ccc2c(c1)O[C@H](CCN[C@@H]1CCOC[C@@H]1[C@H]1CCC[NH2+]1)CS2 ZINC000647800383 481114915 /nfs/dbraw/zinc/11/49/15/481114915.db2.gz AFBUPQOWYNVKRC-QBPKDAKJSA-N 1 3 348.512 2.677 10 0 EFAEHO [NH3+]CC12CCC(CC1)CN2C(=O)c1cccc(CN2CCCC2)c1 ZINC000653169494 481123312 /nfs/dbraw/zinc/12/33/12/481123312.db2.gz LHNHAAJJHCJPLD-UHFFFAOYSA-N 1 3 327.472 2.626 10 0 EFAEHO CO[C@@]1(C[NH2+]C[C@@H]2CN(Cc3ccccc3)CC23CCC3)CCOC1 ZINC000639328302 481130787 /nfs/dbraw/zinc/13/07/87/481130787.db2.gz GPWMJYWNQDGRTN-TZIWHRDSSA-N 1 3 344.499 2.684 10 0 EFAEHO O=C(CCN1CCC[C@H]([C@@H]2CCC[NH2+]2)C1)NCc1ccccc1Cl ZINC000647901638 481169128 /nfs/dbraw/zinc/16/91/28/481169128.db2.gz SCERZAWDNNTQIE-WMZOPIPTSA-N 1 3 349.906 2.810 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@@H]1CCCC[N@@H+]1C)Cc1ccncc1 ZINC000646241270 481176245 /nfs/dbraw/zinc/17/62/45/481176245.db2.gz XETNBGVCXFOTAJ-IBGZPJMESA-N 1 3 346.519 2.626 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@@H]1CCCC[N@H+]1C)Cc1ccncc1 ZINC000646241270 481176251 /nfs/dbraw/zinc/17/62/51/481176251.db2.gz XETNBGVCXFOTAJ-IBGZPJMESA-N 1 3 346.519 2.626 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000650556503 481176590 /nfs/dbraw/zinc/17/65/90/481176590.db2.gz OAUAIVPMSHUHKW-SFHVURJKSA-N 1 3 334.508 2.566 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000650556503 481176596 /nfs/dbraw/zinc/17/65/96/481176596.db2.gz OAUAIVPMSHUHKW-SFHVURJKSA-N 1 3 334.508 2.566 10 0 EFAEHO C[NH+](C)CCCC(C)(C)NC(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659045017 481186393 /nfs/dbraw/zinc/18/63/93/481186393.db2.gz UEFLRHVINSHBRW-QGZVFWFLSA-N 1 3 348.491 2.589 10 0 EFAEHO CCC[N@H+](CC)C[C@H](C)NC(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659047214 481189006 /nfs/dbraw/zinc/18/90/06/481189006.db2.gz QNOGEHRBBORFRN-MAUKXSAKSA-N 1 3 348.491 2.589 10 0 EFAEHO CCC[N@@H+](CC)C[C@H](C)NC(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659047214 481189015 /nfs/dbraw/zinc/18/90/15/481189015.db2.gz QNOGEHRBBORFRN-MAUKXSAKSA-N 1 3 348.491 2.589 10 0 EFAEHO COc1ccc(OCc2nc(CNCCC3(C[NH3+])CC3)cs2)cc1 ZINC000650713401 481283158 /nfs/dbraw/zinc/28/31/58/481283158.db2.gz RQDKMKKGOSTDKM-UHFFFAOYSA-N 1 3 347.484 2.949 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@H](C)CC(=O)NCCc1ccccc1 ZINC000650719428 481287053 /nfs/dbraw/zinc/28/70/53/481287053.db2.gz PVNQDWIMTALNKT-QGZVFWFLSA-N 1 3 339.483 2.633 10 0 EFAEHO CCOc1ccc(CN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)cc1OC ZINC000650722043 481289015 /nfs/dbraw/zinc/28/90/15/481289015.db2.gz JILDBCPKVPKGPR-LMMKCTJWSA-N 1 3 348.487 2.955 10 0 EFAEHO COc1cc(CN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)cc(OC)c1 ZINC000650722632 481290252 /nfs/dbraw/zinc/29/02/52/481290252.db2.gz YFRLSIKBFYEUIZ-LZQZEXGQSA-N 1 3 334.460 2.565 10 0 EFAEHO COCCOc1cccc(CN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)c1 ZINC000650722302 481290316 /nfs/dbraw/zinc/29/03/16/481290316.db2.gz OYIJHFOICVYZKD-SXLOBPIMSA-N 1 3 348.487 2.573 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1cccc(F)c1Cl ZINC000667093566 481315626 /nfs/dbraw/zinc/31/56/26/481315626.db2.gz WVEOYFSCFURDAE-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1cccc(F)c1Cl ZINC000667093566 481315633 /nfs/dbraw/zinc/31/56/33/481315633.db2.gz WVEOYFSCFURDAE-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@@H]1CCN(C(C)=O)Cc2ccccc21 ZINC000650757310 481319704 /nfs/dbraw/zinc/31/97/04/481319704.db2.gz UJCRHNYRVBCNRG-OAQYLSRUSA-N 1 3 337.467 2.989 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@H](C)CC(=O)N(C)c1ccccc1 ZINC000650758727 481321421 /nfs/dbraw/zinc/32/14/21/481321421.db2.gz WOJUMIIOEXVMKZ-MRXNPFEDSA-N 1 3 325.456 2.937 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@@H](C)c1cccc(NS(C)(=O)=O)c1 ZINC000650758865 481322184 /nfs/dbraw/zinc/32/21/84/481322184.db2.gz ZVHMQVACNLWIIP-AWEZNQCLSA-N 1 3 347.484 2.628 10 0 EFAEHO C[C@@H](NCCC1CC[NH2+]CC1)c1ccc(-n2cncn2)cc1Cl ZINC000650764471 481326190 /nfs/dbraw/zinc/32/61/90/481326190.db2.gz ZQJQGAROGUHVJJ-CYBMUJFWSA-N 1 3 333.867 2.961 10 0 EFAEHO C[NH+](C)CCCOc1ccc(NC(=O)C2(N)CC3(CCC3)C2)cc1 ZINC000659284095 481335106 /nfs/dbraw/zinc/33/51/06/481335106.db2.gz FTLAWJFIWBCYMX-UHFFFAOYSA-N 1 3 331.460 2.617 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)cc1 ZINC000659364163 481384819 /nfs/dbraw/zinc/38/48/19/481384819.db2.gz ISVVQFWGWQBJNT-FZKQIMNGSA-N 1 3 325.412 2.620 10 0 EFAEHO [NH3+][C@H](CC1CCCCC1)C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659366440 481387532 /nfs/dbraw/zinc/38/75/32/481387532.db2.gz KBAYDRAAZXOBNB-MSOLQXFVSA-N 1 3 331.460 2.584 10 0 EFAEHO [NH3+][C@H](CCC(=O)Nc1ccc([C@@H]2CNCCO2)cc1)c1ccccc1 ZINC000659370818 481390544 /nfs/dbraw/zinc/39/05/44/481390544.db2.gz WWBZXUNQCVSTBC-MOPGFXCFSA-N 1 3 339.439 2.766 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1 ZINC000659445143 481440138 /nfs/dbraw/zinc/44/01/38/481440138.db2.gz DCPGZZZBCJKPJE-RTBURBONSA-N 1 3 346.519 2.571 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 ZINC000659456290 481447027 /nfs/dbraw/zinc/44/70/27/481447027.db2.gz KEXDOSDTTOLIAI-QFBILLFUSA-N 1 3 346.519 2.885 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000659483656 481464433 /nfs/dbraw/zinc/46/44/33/481464433.db2.gz DCBDEGBKMJZSJK-QUCCMNQESA-N 1 3 346.519 2.714 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CN[C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000643463868 481478940 /nfs/dbraw/zinc/47/89/40/481478940.db2.gz FAGBBSSOKNKNSU-YSTOQKLRSA-N 1 3 346.515 2.944 10 0 EFAEHO CCN(C(=O)NC[C@H]1CCC[N@@H+]1C1CCCCC1)[C@@H]1CCN(C)C1 ZINC000664813534 481494562 /nfs/dbraw/zinc/49/45/62/481494562.db2.gz XWGSRPIIFNJJIN-QZTJIDSGSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN(C(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1)[C@@H]1CCN(C)C1 ZINC000664813534 481494571 /nfs/dbraw/zinc/49/45/71/481494571.db2.gz XWGSRPIIFNJJIN-QZTJIDSGSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@@H]2CCCc3ccccc3C2)CC1 ZINC000648419137 481531844 /nfs/dbraw/zinc/53/18/44/481531844.db2.gz UXEVWIOUUGTDLM-OAQYLSRUSA-N 1 3 329.532 2.941 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000646901231 481541236 /nfs/dbraw/zinc/54/12/36/481541236.db2.gz YVJCDUGYYCVMMY-VQTJNVASSA-N 1 3 345.531 2.959 10 0 EFAEHO CN1CCC(N2CC[C@@H]([NH2+][C@@H]3CCCc4ccccc4C3)C2)CC1 ZINC000648450593 481554748 /nfs/dbraw/zinc/55/47/48/481554748.db2.gz VCENGKXKJCUQSX-WOJBJXKFSA-N 1 3 327.516 2.692 10 0 EFAEHO CN1CCC(N2CC[C@H]([NH2+][C@@H]3CCCc4ccccc4C3)C2)CC1 ZINC000648450591 481555634 /nfs/dbraw/zinc/55/56/34/481555634.db2.gz VCENGKXKJCUQSX-UXHICEINSA-N 1 3 327.516 2.692 10 0 EFAEHO C[C@H](CC[NH+]1CCC(N2CC[C@H](O)C2)CC1)OCc1ccccc1 ZINC000662151792 481596107 /nfs/dbraw/zinc/59/61/07/481596107.db2.gz LIOLYGWYZVSJGC-XLIONFOSSA-N 1 3 332.488 2.513 10 0 EFAEHO CC1CC[NH+](C[C@@H]2CCCN(CC3(O)CCSCC3)C2)CC1 ZINC000659862752 481606141 /nfs/dbraw/zinc/60/61/41/481606141.db2.gz DRAJLWMPWXGNBO-KRWDZBQOSA-N 1 3 326.550 2.688 10 0 EFAEHO CC1CCN(C[C@@H]2CCC[N@H+](CC3(O)CCSCC3)C2)CC1 ZINC000659862752 481606148 /nfs/dbraw/zinc/60/61/48/481606148.db2.gz DRAJLWMPWXGNBO-KRWDZBQOSA-N 1 3 326.550 2.688 10 0 EFAEHO CC1CCN(C[C@@H]2CCC[N@@H+](CC3(O)CCSCC3)C2)CC1 ZINC000659862752 481606152 /nfs/dbraw/zinc/60/61/52/481606152.db2.gz DRAJLWMPWXGNBO-KRWDZBQOSA-N 1 3 326.550 2.688 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](CNC(=O)c2ccc(CN3CCCCC3)cc2)C1 ZINC000654063990 481628092 /nfs/dbraw/zinc/62/80/92/481628092.db2.gz DXAZPGAOGZFJOP-IZAXUBKRSA-N 1 3 329.488 2.743 10 0 EFAEHO CCN(Cc1cccc(Br)c1)C[C@@H]1CCC2(C[NH2+]C2)O1 ZINC000662250704 481666023 /nfs/dbraw/zinc/66/60/23/481666023.db2.gz MHGRDPQHIJTBNR-HNNXBMFYSA-N 1 3 339.277 2.792 10 0 EFAEHO c1cc(C[N@@H+](C[C@H]2CCC3(CNC3)O2)C2CCCC2)cc2c1OCC2 ZINC000662257412 481669130 /nfs/dbraw/zinc/66/91/30/481669130.db2.gz OAGRWQNANOVLOJ-LJQANCHMSA-N 1 3 342.483 2.887 10 0 EFAEHO c1cc(C[N@H+](C[C@H]2CCC3(CNC3)O2)C2CCCC2)cc2c1OCC2 ZINC000662257412 481669137 /nfs/dbraw/zinc/66/91/37/481669137.db2.gz OAGRWQNANOVLOJ-LJQANCHMSA-N 1 3 342.483 2.887 10 0 EFAEHO CCCCCC(=O)NC1CCN(Cc2cccc3c2CC[NH2+]C3)CC1 ZINC000662255120 481670598 /nfs/dbraw/zinc/67/05/98/481670598.db2.gz ADEMPXXYUXJZOR-UHFFFAOYSA-N 1 3 343.515 2.993 10 0 EFAEHO c1ccc2c(c1)CCC[C@]21CCC[N@@H+](C[C@@H]2CCC3(CNC3)O2)C1 ZINC000662259035 481673033 /nfs/dbraw/zinc/67/30/33/481673033.db2.gz OOXJPWSNINJLBO-AZUAARDMSA-N 1 3 326.484 2.878 10 0 EFAEHO c1ccc2c(c1)CCC[C@]21CCC[N@H+](C[C@@H]2CCC3(CNC3)O2)C1 ZINC000662259035 481673035 /nfs/dbraw/zinc/67/30/35/481673035.db2.gz OOXJPWSNINJLBO-AZUAARDMSA-N 1 3 326.484 2.878 10 0 EFAEHO Cc1ccc(CCN(C[C@H]2CCC3(C[NH2+]C3)O2)C[C@@H]2CCCO2)cc1 ZINC000662258663 481673274 /nfs/dbraw/zinc/67/32/74/481673274.db2.gz YTMNMCMPTGDLMI-VQTJNVASSA-N 1 3 344.499 2.540 10 0 EFAEHO COc1ccc(-c2cc(CN3CC[C@H]4C[NH2+]C[C@H]4CC3)on2)cc1 ZINC000662273331 481684231 /nfs/dbraw/zinc/68/42/31/481684231.db2.gz LZYMGMOBOVNZHW-IYBDPMFKSA-N 1 3 327.428 2.782 10 0 EFAEHO C[C@@H]1CCCC[C@H]1N(C)C(=O)CN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662294030 481697079 /nfs/dbraw/zinc/69/70/79/481697079.db2.gz AFVWAIZYUVIIPB-BHIYHBOVSA-N 1 3 335.536 2.735 10 0 EFAEHO CCN(Cc1ccccc1)C(=O)CN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662294770 481699620 /nfs/dbraw/zinc/69/96/20/481699620.db2.gz NAFIBVAKRAIXJF-FQEVSTJZSA-N 1 3 343.515 2.747 10 0 EFAEHO C[C@H]1Cc2ccccc2N1C(=O)CN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662295405 481699645 /nfs/dbraw/zinc/69/96/45/481699645.db2.gz QZKGRMNYBRHVTL-QFBILLFUSA-N 1 3 341.499 2.676 10 0 EFAEHO O=C1[C@@H](N2CCC[C@H](C3CC[NH2+]CC3)C2)CCCN1c1ccccc1 ZINC000662294628 481701400 /nfs/dbraw/zinc/70/14/00/481701400.db2.gz CYGMGGCVVMCILE-ICSRJNTNSA-N 1 3 341.499 2.894 10 0 EFAEHO O=C(CN1CCC[C@@H](C2CC[NH2+]CC2)C1)NCCC1CCCCC1 ZINC000662295695 481701462 /nfs/dbraw/zinc/70/14/62/481701462.db2.gz HUVAEYFLWASIAP-LJQANCHMSA-N 1 3 335.536 2.785 10 0 EFAEHO C[C@H](C(=O)N[C@H]1CCCC[C@H]1C)N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662297186 481703479 /nfs/dbraw/zinc/70/34/79/481703479.db2.gz OGLHNVFPPBDEEW-RWQQGDIJSA-N 1 3 335.536 2.781 10 0 EFAEHO C[C@@H](C(=O)N[C@H]1CCCC[C@H]1C)N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662297183 481704081 /nfs/dbraw/zinc/70/40/81/481704081.db2.gz OGLHNVFPPBDEEW-JFRXWTBNSA-N 1 3 335.536 2.781 10 0 EFAEHO CN(CC1CCCCC1)C(=O)CN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662297519 481704841 /nfs/dbraw/zinc/70/48/41/481704841.db2.gz RAOHEBRMBXWOPQ-IBGZPJMESA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H](C(=O)NCC1CCCCC1)N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662297790 481704906 /nfs/dbraw/zinc/70/49/06/481704906.db2.gz RSHOMXRLCAFREG-VQIMIIECSA-N 1 3 335.536 2.783 10 0 EFAEHO Cn1cc(C[NH2+]C[C@@H]2CN(C)C[C@H]2c2ccccc2)c(C(F)F)n1 ZINC000647249419 481728696 /nfs/dbraw/zinc/72/86/96/481728696.db2.gz ZJBFOWFYQUHKLR-ZBFHGGJFSA-N 1 3 334.414 2.793 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1cccc(Cl)c1F ZINC000665223784 481730982 /nfs/dbraw/zinc/73/09/82/481730982.db2.gz WSDWOQGHKWVINX-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1cccc(Cl)c1F ZINC000665223784 481730991 /nfs/dbraw/zinc/73/09/91/481730991.db2.gz WSDWOQGHKWVINX-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO c1c(N2CCNCC2)n[nH]c1[C@H]1CCC[N@@H+](CCCC2CCC2)C1 ZINC000662335880 481734678 /nfs/dbraw/zinc/73/46/78/481734678.db2.gz ARUOHAZGKORSLJ-KRWDZBQOSA-N 1 3 331.508 2.579 10 0 EFAEHO c1c(N2CCNCC2)n[nH]c1[C@H]1CCC[N@H+](CCCC2CCC2)C1 ZINC000662335880 481734684 /nfs/dbraw/zinc/73/46/84/481734684.db2.gz ARUOHAZGKORSLJ-KRWDZBQOSA-N 1 3 331.508 2.579 10 0 EFAEHO CC(C)(CC[N@@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1)C1CC1 ZINC000662337023 481734700 /nfs/dbraw/zinc/73/47/00/481734700.db2.gz IGBWFEMHCGHHOZ-MRXNPFEDSA-N 1 3 345.535 2.825 10 0 EFAEHO CC(C)(CC[N@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1)C1CC1 ZINC000662337023 481734705 /nfs/dbraw/zinc/73/47/05/481734705.db2.gz IGBWFEMHCGHHOZ-MRXNPFEDSA-N 1 3 345.535 2.825 10 0 EFAEHO c1c(N2CCNCC2)n[nH]c1[C@@H]1CCC[N@@H+](CCCC2CCC2)C1 ZINC000662335881 481735308 /nfs/dbraw/zinc/73/53/08/481735308.db2.gz ARUOHAZGKORSLJ-QGZVFWFLSA-N 1 3 331.508 2.579 10 0 EFAEHO c1c(N2CCNCC2)n[nH]c1[C@@H]1CCC[N@H+](CCCC2CCC2)C1 ZINC000662335881 481735319 /nfs/dbraw/zinc/73/53/19/481735319.db2.gz ARUOHAZGKORSLJ-QGZVFWFLSA-N 1 3 331.508 2.579 10 0 EFAEHO CCOc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@H]2C[C@@H](C)N(C3CC3)C2)cc1 ZINC000665254905 481748398 /nfs/dbraw/zinc/74/83/98/481748398.db2.gz CAGQZCTWUKZHNN-GWKIZSTFSA-N 1 3 343.515 2.746 10 0 EFAEHO C1CC2(C1)[C@H](N[C@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)C[C@H]2N1CCOCC1 ZINC000665274160 481762507 /nfs/dbraw/zinc/76/25/07/481762507.db2.gz LDGGGZKXZFWRAF-OUUBHVDSSA-N 1 3 347.547 2.530 10 0 EFAEHO c1ccc2c(CCN[C@@H]3CCOC[C@H]3[C@H]3CCC[NH2+]3)nsc2c1 ZINC000665276669 481764176 /nfs/dbraw/zinc/76/41/76/481764176.db2.gz JZPSYDIQJGCVCA-ARFHVFGLSA-N 1 3 331.485 2.586 10 0 EFAEHO C[C@@H]1CCCC[C@H]1[NH+]1CCC(NCC(C)(C)[C@@]2(O)CCOC2)CC1 ZINC000647340101 481768055 /nfs/dbraw/zinc/76/80/55/481768055.db2.gz DYNFNWKKWGUBNI-YVWKXTFCSA-N 1 3 338.536 2.797 10 0 EFAEHO CCN(CC)C(=O)C[C@H](C)NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC000647343904 481770735 /nfs/dbraw/zinc/77/07/35/481770735.db2.gz FNNDHWSNAGSHAU-UHOSZYNNSA-N 1 3 331.504 2.568 10 0 EFAEHO CCN(CC)C(=O)C[C@H](C)NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000647343904 481770739 /nfs/dbraw/zinc/77/07/39/481770739.db2.gz FNNDHWSNAGSHAU-UHOSZYNNSA-N 1 3 331.504 2.568 10 0 EFAEHO CN1C[C@@H](C[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@@H]32)[C@H](c2ccccc2)C1 ZINC000647344250 481770793 /nfs/dbraw/zinc/77/07/93/481770793.db2.gz MPQZKBJCDYFTHP-ADAARDCZSA-N 1 3 327.516 2.794 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)C[C@H]1NCc2ccccc21 ZINC000662390204 481780496 /nfs/dbraw/zinc/78/04/96/481780496.db2.gz YGASMRMVTARHAH-VQIMIIECSA-N 1 3 329.488 2.992 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)C[C@H]1NCc2ccccc21 ZINC000662390204 481780507 /nfs/dbraw/zinc/78/05/07/481780507.db2.gz YGASMRMVTARHAH-VQIMIIECSA-N 1 3 329.488 2.992 10 0 EFAEHO CSc1cccc(C[N@@H+]2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)c1 ZINC000660156923 481791913 /nfs/dbraw/zinc/79/19/13/481791913.db2.gz SKIKHJUYYXGOPF-VQIMIIECSA-N 1 3 333.545 2.866 10 0 EFAEHO CSc1cccc(C[N@H+]2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)c1 ZINC000660156923 481791921 /nfs/dbraw/zinc/79/19/21/481791921.db2.gz SKIKHJUYYXGOPF-VQIMIIECSA-N 1 3 333.545 2.866 10 0 EFAEHO CO[C@H](C[N@H+](C)CCC1CCN(c2ccncc2)CC1)[C@@H]1CCOC1 ZINC000660165020 481796666 /nfs/dbraw/zinc/79/66/66/481796666.db2.gz BFNOKJYADFQKEG-UYAOXDASSA-N 1 3 347.503 2.671 10 0 EFAEHO CO[C@H](C[N@@H+](C)CCC1CCN(c2ccncc2)CC1)[C@@H]1CCOC1 ZINC000660165020 481796669 /nfs/dbraw/zinc/79/66/69/481796669.db2.gz BFNOKJYADFQKEG-UYAOXDASSA-N 1 3 347.503 2.671 10 0 EFAEHO O=C(NCC1([NH+]2CCCCC2)CCCCC1)C1(NC2CC2)CCC1 ZINC000662443398 481807448 /nfs/dbraw/zinc/80/74/48/481807448.db2.gz LKGUBGUZBXKUHZ-UHFFFAOYSA-N 1 3 333.520 2.966 10 0 EFAEHO CCN(CCC[NH+](CC)CC)C(=O)NC[C@H]1CCN1C(C)(C)C ZINC000665357112 481815807 /nfs/dbraw/zinc/81/58/07/481815807.db2.gz FDDBBTSXNBGSBI-MRXNPFEDSA-N 1 3 326.529 2.623 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000665363881 481821647 /nfs/dbraw/zinc/82/16/47/481821647.db2.gz DURFPNPDGMZLJQ-SJORKVTESA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000665363879 481821956 /nfs/dbraw/zinc/82/19/56/481821956.db2.gz DURFPNPDGMZLJQ-IAGOWNOFSA-N 1 3 336.524 2.519 10 0 EFAEHO C[N@@H+](CCNC(=O)N[C@H]1CCCN2CCCC[C@H]12)C1CCCCC1 ZINC000654414884 481860317 /nfs/dbraw/zinc/86/03/17/481860317.db2.gz ZFHQMWSUVIFLAJ-ZWKOTPCHSA-N 1 3 336.524 2.567 10 0 EFAEHO C[N@H+](CCNC(=O)N[C@H]1CCCN2CCCC[C@H]12)C1CCCCC1 ZINC000654414884 481860309 /nfs/dbraw/zinc/86/03/09/481860309.db2.gz ZFHQMWSUVIFLAJ-ZWKOTPCHSA-N 1 3 336.524 2.567 10 0 EFAEHO CCC(C)(C)N1CCN(C(=O)NC2CCC(C[NH+](C)C)CC2)CC1 ZINC000654502884 481904551 /nfs/dbraw/zinc/90/45/51/481904551.db2.gz UTEVAZIGVQVUNI-UHFFFAOYSA-N 1 3 338.540 2.623 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)C1([NH2+]C2CC2)CCC1)c1ccsc1 ZINC000662680649 481930531 /nfs/dbraw/zinc/93/05/31/481930531.db2.gz XQJSJIOOGUOKQA-MRXNPFEDSA-N 1 3 335.517 2.922 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)C2(NC3CC3)CCC2)C1 ZINC000662699005 481940241 /nfs/dbraw/zinc/94/02/41/481940241.db2.gz UZYOOJBRMGGYHD-SJORKVTESA-N 1 3 333.520 2.774 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)C2(NC3CC3)CCC2)C1 ZINC000662699005 481940246 /nfs/dbraw/zinc/94/02/46/481940246.db2.gz UZYOOJBRMGGYHD-SJORKVTESA-N 1 3 333.520 2.774 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)C2(NC3CC3)CCC2)C1 ZINC000662698996 481940399 /nfs/dbraw/zinc/94/03/99/481940399.db2.gz UZYOOJBRMGGYHD-DLBZAZTESA-N 1 3 333.520 2.774 10 0 EFAEHO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)C2(NC3CC3)CCC2)C1 ZINC000662698996 481940403 /nfs/dbraw/zinc/94/04/03/481940403.db2.gz UZYOOJBRMGGYHD-DLBZAZTESA-N 1 3 333.520 2.774 10 0 EFAEHO CCC[C@H](N)C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662710633 481943795 /nfs/dbraw/zinc/94/37/95/481943795.db2.gz IYGAGJWEVCLTIK-MSOLQXFVSA-N 1 3 329.488 2.532 10 0 EFAEHO CCC[C@H](N)C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662710633 481943798 /nfs/dbraw/zinc/94/37/98/481943798.db2.gz IYGAGJWEVCLTIK-MSOLQXFVSA-N 1 3 329.488 2.532 10 0 EFAEHO CC[C@H](C)[C@@H](N)C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662710155 481943894 /nfs/dbraw/zinc/94/38/94/481943894.db2.gz DTZMFUHXANWWBN-QXAKKESOSA-N 1 3 343.515 2.778 10 0 EFAEHO CC[C@H](C)[C@@H](N)C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662710155 481943900 /nfs/dbraw/zinc/94/39/00/481943900.db2.gz DTZMFUHXANWWBN-QXAKKESOSA-N 1 3 343.515 2.778 10 0 EFAEHO CCC[C@H](N)C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662710635 481943977 /nfs/dbraw/zinc/94/39/77/481943977.db2.gz IYGAGJWEVCLTIK-ROUUACIJSA-N 1 3 329.488 2.532 10 0 EFAEHO CCC[C@H](N)C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662710635 481943981 /nfs/dbraw/zinc/94/39/81/481943981.db2.gz IYGAGJWEVCLTIK-ROUUACIJSA-N 1 3 329.488 2.532 10 0 EFAEHO CCC[C@@](C)(N)C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662713295 481944874 /nfs/dbraw/zinc/94/48/74/481944874.db2.gz YRFDJNUYGIOWIB-UYAOXDASSA-N 1 3 343.515 2.922 10 0 EFAEHO CCC[C@@](C)(N)C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662713295 481944879 /nfs/dbraw/zinc/94/48/79/481944879.db2.gz YRFDJNUYGIOWIB-UYAOXDASSA-N 1 3 343.515 2.922 10 0 EFAEHO CC(C)C[C@H](N)C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662712957 481945186 /nfs/dbraw/zinc/94/51/86/481945186.db2.gz WIETWDFHXNJZLW-MOPGFXCFSA-N 1 3 343.515 2.778 10 0 EFAEHO CC(C)C[C@H](N)C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662712957 481945194 /nfs/dbraw/zinc/94/51/94/481945194.db2.gz WIETWDFHXNJZLW-MOPGFXCFSA-N 1 3 343.515 2.778 10 0 EFAEHO O=C(N1CCC[C@@H](C[NH+]2CCCCCC2)C1)C1(NC2CC2)CCC1 ZINC000662716473 481946174 /nfs/dbraw/zinc/94/61/74/481946174.db2.gz SYCLWZZMRUBWHS-KRWDZBQOSA-N 1 3 333.520 2.776 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000662731049 481952308 /nfs/dbraw/zinc/95/23/08/481952308.db2.gz WXZFDSHZLFIPEG-FUHWJXTLSA-N 1 3 335.467 2.527 10 0 EFAEHO CC1(C)CN(C(=O)CCC[NH3+])[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000662758474 481961523 /nfs/dbraw/zinc/96/15/23/481961523.db2.gz OSBDCLUKLIXWGX-HXUWFJFHSA-N 1 3 343.515 2.875 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N(Cc1ccccc1)C1CC1 ZINC000665637660 481973094 /nfs/dbraw/zinc/97/30/94/481973094.db2.gz KHXJOEMVILSTMO-KRWDZBQOSA-N 1 3 346.519 2.633 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N(Cc1ccccc1)C1CC1 ZINC000665637660 481973097 /nfs/dbraw/zinc/97/30/97/481973097.db2.gz KHXJOEMVILSTMO-KRWDZBQOSA-N 1 3 346.519 2.633 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CCC[C@@H]1C1CCCC1 ZINC000665639304 481973987 /nfs/dbraw/zinc/97/39/87/481973987.db2.gz UKXSLHBICZQHQP-FUHWJXTLSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CCC[C@@H]1C1CCCC1 ZINC000665639304 481973992 /nfs/dbraw/zinc/97/39/92/481973992.db2.gz UKXSLHBICZQHQP-FUHWJXTLSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CCc2ccccc2[C@@H]1C ZINC000665757592 482037486 /nfs/dbraw/zinc/03/74/86/482037486.db2.gz PGUBJBBVJHLHOK-IRXDYDNUSA-N 1 3 346.519 2.587 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CCc2ccccc2[C@@H]1C ZINC000665757592 482037491 /nfs/dbraw/zinc/03/74/91/482037491.db2.gz PGUBJBBVJHLHOK-IRXDYDNUSA-N 1 3 346.519 2.587 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[N@@H+]1CCC[C@]2(CCN(C)C2)C1 ZINC000660652938 482072003 /nfs/dbraw/zinc/07/20/03/482072003.db2.gz MUPDFWXJPZGMAS-WIYYLYMNSA-N 1 3 346.515 2.967 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@]2(CCN(C)C2)C1 ZINC000660652938 482072006 /nfs/dbraw/zinc/07/20/06/482072006.db2.gz MUPDFWXJPZGMAS-WIYYLYMNSA-N 1 3 346.515 2.967 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1cccc2c1ccn2C ZINC000665950735 482119233 /nfs/dbraw/zinc/11/92/33/482119233.db2.gz UHDZLXMUWUVIDD-HNNXBMFYSA-N 1 3 345.491 2.572 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1cccc2c1ccn2C ZINC000665950735 482119240 /nfs/dbraw/zinc/11/92/40/482119240.db2.gz UHDZLXMUWUVIDD-HNNXBMFYSA-N 1 3 345.491 2.572 10 0 EFAEHO CC[NH+]1CCC(NC(=O)CNC2(c3ccccc3C)CCC2)CC1 ZINC000649645659 482167504 /nfs/dbraw/zinc/16/75/04/482167504.db2.gz BNWYKKLTPRJARA-UHFFFAOYSA-N 1 3 329.488 2.564 10 0 EFAEHO Cc1cc(F)ccc1N1CCC[C@@H](N2C[C@@H]3CCC[C@]3(C[NH3+])C2)C1=O ZINC000652352122 482185621 /nfs/dbraw/zinc/18/56/21/482185621.db2.gz JGTXVTCNQYLBQO-CVAIRZPRSA-N 1 3 345.462 2.690 10 0 EFAEHO Cc1cc(F)ccc1N1CCC[C@@H]([N@@H+]2C[C@@H]3CCC[C@]3(CN)C2)C1=O ZINC000652352122 482185625 /nfs/dbraw/zinc/18/56/25/482185625.db2.gz JGTXVTCNQYLBQO-CVAIRZPRSA-N 1 3 345.462 2.690 10 0 EFAEHO Cc1cc(F)ccc1N1CCC[C@@H]([N@H+]2C[C@@H]3CCC[C@]3(CN)C2)C1=O ZINC000652352122 482185629 /nfs/dbraw/zinc/18/56/29/482185629.db2.gz JGTXVTCNQYLBQO-CVAIRZPRSA-N 1 3 345.462 2.690 10 0 EFAEHO CCOc1ccccc1OCCN1CCCC[C@@H]1[C@H]1C[C@@H]([NH3+])CCO1 ZINC000652361425 482193606 /nfs/dbraw/zinc/19/36/06/482193606.db2.gz GVBHGCURPURCFL-SQGPQFPESA-N 1 3 348.487 2.825 10 0 EFAEHO CCCCN(C[C@H](O)C[N@H+](C)C(C)C)[C@@H]1CCc2ncsc2C1 ZINC000660907959 482211870 /nfs/dbraw/zinc/21/18/70/482211870.db2.gz XAEFIDXTAGOKRX-HZPDHXFCSA-N 1 3 339.549 2.804 10 0 EFAEHO CCCCN(C[C@H](O)C[N@@H+](C)C(C)C)[C@@H]1CCc2ncsc2C1 ZINC000660907959 482211879 /nfs/dbraw/zinc/21/18/79/482211879.db2.gz XAEFIDXTAGOKRX-HZPDHXFCSA-N 1 3 339.549 2.804 10 0 EFAEHO CN(c1ccccc1C[N@@H+]1CC[C@@H]2COC[C@H]2C1)C1CCN(C)CC1 ZINC000668706630 482222035 /nfs/dbraw/zinc/22/20/35/482222035.db2.gz UEBWBSXRQUPXGG-RTBURBONSA-N 1 3 343.515 2.685 10 0 EFAEHO CN(c1ccccc1C[N@H+]1CC[C@@H]2COC[C@H]2C1)C1CCN(C)CC1 ZINC000668706630 482222041 /nfs/dbraw/zinc/22/20/41/482222041.db2.gz UEBWBSXRQUPXGG-RTBURBONSA-N 1 3 343.515 2.685 10 0 EFAEHO C[C@@H](CN1CCC(C)CC1)NC(=O)NC1CCC(C[NH+](C)C)CC1 ZINC000660939154 482230993 /nfs/dbraw/zinc/23/09/93/482230993.db2.gz IZNCPTAXDAKQGY-AOCRQIFASA-N 1 3 338.540 2.526 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2C[C@@H](C)[C@@](C)(CO)C2)CC1 ZINC000668739064 482242311 /nfs/dbraw/zinc/24/23/11/482242311.db2.gz LYSVGNWWNNXOGI-WIYYLYMNSA-N 1 3 345.531 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2C[C@@H](C)[C@@](C)(CO)C2)CC1 ZINC000668739064 482242320 /nfs/dbraw/zinc/24/23/20/482242320.db2.gz LYSVGNWWNNXOGI-WIYYLYMNSA-N 1 3 345.531 2.669 10 0 EFAEHO CC(C)c1ccc([C@@H]([NH3+])CNCc2nc3c(s2)CNCC3)cc1 ZINC000663492911 482264691 /nfs/dbraw/zinc/26/46/91/482264691.db2.gz DVNOMCLFPQMRSM-HNNXBMFYSA-N 1 3 330.501 2.702 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(NCc2ccccc2OC(C)C)CC1 ZINC000663504212 482267822 /nfs/dbraw/zinc/26/78/22/482267822.db2.gz WCIXYSRIVAPTJS-UHFFFAOYSA-N 1 3 347.503 2.554 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(NCc2cc3cc(F)ccc3o2)CC1 ZINC000663503717 482268199 /nfs/dbraw/zinc/26/81/99/482268199.db2.gz KTDIXRZFKGKZJF-UHFFFAOYSA-N 1 3 347.434 2.652 10 0 EFAEHO CCN(C(=O)NCCC[N@H+](C)Cc1ccccc1)[C@H]1CCN(CC)C1 ZINC000663506244 482269777 /nfs/dbraw/zinc/26/97/77/482269777.db2.gz KTQMNMHBLQKJHN-IBGZPJMESA-N 1 3 346.519 2.634 10 0 EFAEHO CCN(C(=O)NCCC[N@@H+](C)Cc1ccccc1)[C@H]1CCN(CC)C1 ZINC000663506244 482269780 /nfs/dbraw/zinc/26/97/80/482269780.db2.gz KTQMNMHBLQKJHN-IBGZPJMESA-N 1 3 346.519 2.634 10 0 EFAEHO CCN(C(=O)NCc1ccc(C[NH+]2CCCC2)cc1)[C@@H]1CCN(C)C1 ZINC000663508005 482271059 /nfs/dbraw/zinc/27/10/59/482271059.db2.gz GDJFKFCVNQOXND-LJQANCHMSA-N 1 3 344.503 2.518 10 0 EFAEHO C[C@@H](C[N@@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1)C(C)(C)C ZINC000663510222 482271939 /nfs/dbraw/zinc/27/19/39/482271939.db2.gz DUYWKXPMVXOSRG-JKSUJKDBSA-N 1 3 333.524 2.681 10 0 EFAEHO C[C@@H](C[N@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1)C(C)(C)C ZINC000663510222 482271947 /nfs/dbraw/zinc/27/19/47/482271947.db2.gz DUYWKXPMVXOSRG-JKSUJKDBSA-N 1 3 333.524 2.681 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)CCN1CCc2ccccc2C1 ZINC000652522997 482279247 /nfs/dbraw/zinc/27/92/47/482279247.db2.gz AZELUPGNUSTFKS-UHFFFAOYSA-N 1 3 331.504 2.529 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)CCN1CCc2ccccc2C1 ZINC000652522997 482279252 /nfs/dbraw/zinc/27/92/52/482279252.db2.gz AZELUPGNUSTFKS-UHFFFAOYSA-N 1 3 331.504 2.529 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NCC(C)(C)c1ccccc1 ZINC000663665713 482338014 /nfs/dbraw/zinc/33/80/14/482338014.db2.gz LARODNHPGAILSO-KRWDZBQOSA-N 1 3 348.535 2.535 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NCC(C)(C)c1ccccc1 ZINC000663665713 482338017 /nfs/dbraw/zinc/33/80/17/482338017.db2.gz LARODNHPGAILSO-KRWDZBQOSA-N 1 3 348.535 2.535 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[N@@H+]1CCC[C@H](C)C1)[C@@H]1CCN(CC)C1 ZINC000663787015 482389182 /nfs/dbraw/zinc/38/91/82/482389182.db2.gz FIYLRMWPEUBEKL-DLBZAZTESA-N 1 3 338.540 2.623 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[N@H+]1CCC[C@H](C)C1)[C@@H]1CCN(CC)C1 ZINC000663787015 482389186 /nfs/dbraw/zinc/38/91/86/482389186.db2.gz FIYLRMWPEUBEKL-DLBZAZTESA-N 1 3 338.540 2.623 10 0 EFAEHO CCN(C(=O)NCc1cccc(C[N@H+](C)CC)c1)[C@@H]1CCN(CC)C1 ZINC000663865406 482411961 /nfs/dbraw/zinc/41/19/61/482411961.db2.gz ARZFLFGOAXNAAM-LJQANCHMSA-N 1 3 346.519 2.764 10 0 EFAEHO CCN(C(=O)NCc1cccc(C[N@@H+](C)CC)c1)[C@@H]1CCN(CC)C1 ZINC000663865406 482411962 /nfs/dbraw/zinc/41/19/62/482411962.db2.gz ARZFLFGOAXNAAM-LJQANCHMSA-N 1 3 346.519 2.764 10 0 EFAEHO CCN(Cc1ccc(C[N@H+](CC)[C@H]2CCOC2)cc1)[C@H]1CCOC1 ZINC000361591520 500686612 /nfs/dbraw/zinc/68/66/12/500686612.db2.gz NVVDDTTZMAEPJE-PMACEKPBSA-N 1 3 332.488 2.908 10 0 EFAEHO CCN(Cc1ccc(C[N@@H+](CC)[C@H]2CCOC2)cc1)[C@H]1CCOC1 ZINC000361591520 500686613 /nfs/dbraw/zinc/68/66/13/500686613.db2.gz NVVDDTTZMAEPJE-PMACEKPBSA-N 1 3 332.488 2.908 10 0 EFAEHO CC(C)(C)[NH2+]CCNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000153886979 518757764 /nfs/dbraw/zinc/75/77/64/518757764.db2.gz HWDMLAHKZBSXOJ-INIZCTEOSA-N 1 3 335.467 2.542 10 0 EFAEHO CC(C)N1CC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)C1=O ZINC000245744418 519690605 /nfs/dbraw/zinc/69/06/05/519690605.db2.gz SGAXLRBLQGNQRG-HAGHYFMRSA-N 1 3 341.499 2.781 10 0 EFAEHO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)N[C@H](C)CN(C)Cc2ccccc2)C1 ZINC000245650398 519693563 /nfs/dbraw/zinc/69/35/63/519693563.db2.gz HEDODMVUCZFQPH-ZHALLVOQSA-N 1 3 346.519 2.535 10 0 EFAEHO CC(C)[N@@H+]1C[C@@H](C)[C@H](NC(=O)N[C@H](C)CN(C)Cc2ccccc2)C1 ZINC000245650398 519693565 /nfs/dbraw/zinc/69/35/65/519693565.db2.gz HEDODMVUCZFQPH-ZHALLVOQSA-N 1 3 346.519 2.535 10 0 EFAEHO CC(C)COC[C@@H](O)CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245722883 519757261 /nfs/dbraw/zinc/75/72/61/519757261.db2.gz OYMZLAGZXWFHON-WOZUAGRISA-N 1 3 346.515 2.805 10 0 EFAEHO CC(C)COC[C@@H](O)CN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245722883 519757263 /nfs/dbraw/zinc/75/72/63/519757263.db2.gz OYMZLAGZXWFHON-WOZUAGRISA-N 1 3 346.515 2.805 10 0 EFAEHO CC[NH+](CC)[C@@H](C)CNC(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000078545698 520825016 /nfs/dbraw/zinc/82/50/16/520825016.db2.gz DFDFLAGKFDLTLV-PKOBYXMFSA-N 1 3 346.519 2.853 10 0 EFAEHO CCN1CCC[C@H]1CN(C)C(=O)NCCCC[N@@H+]1CCC[C@H](C)C1 ZINC000177400327 521651361 /nfs/dbraw/zinc/65/13/61/521651361.db2.gz UNBLXUMLOWWCEW-ROUUACIJSA-N 1 3 338.540 2.624 10 0 EFAEHO CCN1CCC[C@H]1CN(C)C(=O)NCCCC[N@H+]1CCC[C@H](C)C1 ZINC000177400327 521651364 /nfs/dbraw/zinc/65/13/64/521651364.db2.gz UNBLXUMLOWWCEW-ROUUACIJSA-N 1 3 338.540 2.624 10 0 EFAEHO CCCN(CC[NH2+]C1C[C@H]2CC[C@@H](C1)N2C)C(=O)OC(C)(C)C ZINC000193049169 521661720 /nfs/dbraw/zinc/66/17/20/521661720.db2.gz VTMAUZPAULTMEJ-MQVJKMGUSA-N 1 3 325.497 2.848 10 0 EFAEHO CN(C)C[C@H](NC(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C)c1ccccc1 ZINC000116524661 521810854 /nfs/dbraw/zinc/81/08/54/521810854.db2.gz HJCXDGHAAIKQTI-ROUUACIJSA-N 1 3 348.535 2.955 10 0 EFAEHO CN(C)C[C@@H](NC(=O)c1ccc(C[NH+](C)C)cc1)c1ccccc1 ZINC000123459343 521899782 /nfs/dbraw/zinc/89/97/82/521899782.db2.gz BIAZNAAQBRQUFS-LJQANCHMSA-N 1 3 325.456 2.781 10 0 EFAEHO CN1CC[C@H](NC(=O)c2cccc(C[NH+](C)C)c2)[C@@H]1c1ccccc1 ZINC000180176182 521918591 /nfs/dbraw/zinc/91/85/91/521918591.db2.gz KMICVXMLJUOUTI-PMACEKPBSA-N 1 3 337.467 2.923 10 0 EFAEHO CN1CCC[C@@H](CNC(=O)C2CC[NH+](C)CC2)[C@@H]1c1cccs1 ZINC000245445273 523750668 /nfs/dbraw/zinc/75/06/68/523750668.db2.gz YSKAJASMALQHDQ-DOTOQJQBSA-N 1 3 335.517 2.589 10 0 EFAEHO COc1ccc(C[N@H+](C)C[C@@H]2CCN(C)C2)cc1Br ZINC000071190408 524003777 /nfs/dbraw/zinc/00/37/77/524003777.db2.gz HNVVXIZSLDCWAA-CYBMUJFWSA-N 1 3 327.266 2.841 10 0 EFAEHO COc1ccc(C[N@@H+](C)C[C@@H]2CCN(C)C2)cc1Br ZINC000071190408 524003781 /nfs/dbraw/zinc/00/37/81/524003781.db2.gz HNVVXIZSLDCWAA-CYBMUJFWSA-N 1 3 327.266 2.841 10 0 EFAEHO Cc1cc(C)n2c(C[NH2+]C[C@H]3CCN(Cc4ccccc4)C3)cnc2n1 ZINC000192918207 524561335 /nfs/dbraw/zinc/56/13/35/524561335.db2.gz ROELAQTWCWAJAC-LJQANCHMSA-N 1 3 349.482 2.958 10 0 EFAEHO Cc1cccc(NC(=O)[C@H]2CCC[N@H+](CCCN3CCCCC3)C2)n1 ZINC000193474169 524656730 /nfs/dbraw/zinc/65/67/30/524656730.db2.gz AAWBITROMWLQDF-SFHVURJKSA-N 1 3 344.503 2.917 10 0 EFAEHO Cc1cccc(NC(=O)[C@H]2CCC[N@@H+](CCCN3CCCCC3)C2)n1 ZINC000193474169 524656737 /nfs/dbraw/zinc/65/67/37/524656737.db2.gz AAWBITROMWLQDF-SFHVURJKSA-N 1 3 344.503 2.917 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@@H]2CCC[C@H]([NH3+])C2)CCN1Cc1ccccc1 ZINC000262267218 525431428 /nfs/dbraw/zinc/43/14/28/525431428.db2.gz HOQLTVMFRANLTJ-OQIJWPOYSA-N 1 3 329.488 2.673 10 0 EFAEHO O=C(C[N@@H+]1CCC[C@H]1C1CCCCC1)NC1CCN(C2CC2)CC1 ZINC000119707884 526758231 /nfs/dbraw/zinc/75/82/31/526758231.db2.gz FGLZBYMPHHZPLG-IBGZPJMESA-N 1 3 333.520 2.774 10 0 EFAEHO O=C(C[N@H+]1CCC[C@H]1C1CCCCC1)NC1CCN(C2CC2)CC1 ZINC000119707884 526758239 /nfs/dbraw/zinc/75/82/39/526758239.db2.gz FGLZBYMPHHZPLG-IBGZPJMESA-N 1 3 333.520 2.774 10 0 EFAEHO O=C1C[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)CN1C1CC1 ZINC000245742361 527021809 /nfs/dbraw/zinc/02/18/09/527021809.db2.gz RUYIXCKJMQWNOD-IZBJGVDFSA-N 1 3 339.483 2.535 10 0 EFAEHO CC[N@@H+]1CC[C@H](CNC(=O)c2oc3ccccc3c2CN(C)C)C1 ZINC000174181323 527814966 /nfs/dbraw/zinc/81/49/66/527814966.db2.gz MCGLPVPBQHGBDN-CQSZACIVSA-N 1 3 329.444 2.566 10 0 EFAEHO CC[N@H+]1CC[C@H](CNC(=O)c2oc3ccccc3c2CN(C)C)C1 ZINC000174181323 527814967 /nfs/dbraw/zinc/81/49/67/527814967.db2.gz MCGLPVPBQHGBDN-CQSZACIVSA-N 1 3 329.444 2.566 10 0 EFAEHO CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCN2CCC[C@@H]2C1 ZINC000171899253 528199000 /nfs/dbraw/zinc/19/90/00/528199000.db2.gz LYZOEYPDKHXCBU-LJQANCHMSA-N 1 3 344.503 2.518 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCC[C@@H](O)CC)CC1 ZINC000344480414 534936758 /nfs/dbraw/zinc/93/67/58/534936758.db2.gz NCFLGQUHVOAZFI-IBGZPJMESA-N 1 3 333.520 2.859 10 0 EFAEHO CC(C)[C@H](NCC(=O)NC1CC[NH+](C2CC2)CC1)c1ccc(F)cc1 ZINC000337443053 535122806 /nfs/dbraw/zinc/12/28/06/535122806.db2.gz ZCJNUVMMQAYCTC-FQEVSTJZSA-N 1 3 347.478 2.855 10 0 EFAEHO CCCC[N@@H+](Cc1ccccc1F)C[C@@H]1CCCN(C(=O)CN)C1 ZINC000414695614 535260729 /nfs/dbraw/zinc/26/07/29/535260729.db2.gz PGEOHLQKMIQREB-INIZCTEOSA-N 1 3 335.467 2.625 10 0 EFAEHO CCCC[N@H+](Cc1ccccc1F)C[C@@H]1CCCN(C(=O)CN)C1 ZINC000414695614 535260733 /nfs/dbraw/zinc/26/07/33/535260733.db2.gz PGEOHLQKMIQREB-INIZCTEOSA-N 1 3 335.467 2.625 10 0 EFAEHO C[NH+](C)C[C@H]1CCCN1C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000427726888 535957752 /nfs/dbraw/zinc/95/77/52/535957752.db2.gz OGNPBOGGMZPQTC-IEBWSBKVSA-N 1 3 347.478 2.590 10 0 EFAEHO COC1(CN2CCN(C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)CCCCC1 ZINC000349408294 536627466 /nfs/dbraw/zinc/62/74/66/536627466.db2.gz OXSQDFXRVYLKTP-DFNIBXOVSA-N 1 3 335.536 2.579 10 0 EFAEHO COC1(CN2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)CCCCC1 ZINC000349408294 536627469 /nfs/dbraw/zinc/62/74/69/536627469.db2.gz OXSQDFXRVYLKTP-DFNIBXOVSA-N 1 3 335.536 2.579 10 0 EFAEHO COC1(C[NH2+][C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]23)CCOCC1 ZINC000230212778 536684652 /nfs/dbraw/zinc/68/46/52/536684652.db2.gz GXXSENNDAGGEPV-VAMGGRTRSA-N 1 3 344.499 2.682 10 0 EFAEHO CN1CCC[C@H](CNC(=O)[C@@H]2CCC[C@@H]2C[NH3+])[C@@H]1c1cccs1 ZINC000261733074 545621027 /nfs/dbraw/zinc/62/10/27/545621027.db2.gz LAQWBJNASKFZSY-KCYZZUKISA-N 1 3 335.517 2.622 10 0 EFAEHO CC(C)C[C@H](C[NH3+])CC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000310547843 545808169 /nfs/dbraw/zinc/80/81/69/545808169.db2.gz VNCOHUJPWRQSLC-OALUTQOASA-N 1 3 331.504 2.730 10 0 EFAEHO C[C@H](CCN1CC[C@]2(C1)CCCOC2)[N@@H+]1CC[C@]2(C1)CCCOC2 ZINC000341992658 545943825 /nfs/dbraw/zinc/94/38/25/545943825.db2.gz NVYYKZHIEBIYNX-AABGKKOBSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CCN1CC[C@]2(C1)CCCOC2)[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000341992658 545943828 /nfs/dbraw/zinc/94/38/28/545943828.db2.gz NVYYKZHIEBIYNX-AABGKKOBSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@@H+]1CC[C@]2(C1)CCCOC2)N1CC[C@]2(C1)CCCOC2 ZINC000341992658 545943837 /nfs/dbraw/zinc/94/38/37/545943837.db2.gz NVYYKZHIEBIYNX-AABGKKOBSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@H+]1CC[C@]2(C1)CCCOC2)N1CC[C@]2(C1)CCCOC2 ZINC000341992658 545943843 /nfs/dbraw/zinc/94/38/43/545943843.db2.gz NVYYKZHIEBIYNX-AABGKKOBSA-N 1 3 336.520 2.770 10 0 EFAEHO CCCC[C@H](CC)CC[NH2+]CC1(N2CCOCC2)CCN(C)CC1 ZINC000414487823 546190909 /nfs/dbraw/zinc/19/09/09/546190909.db2.gz SQHLRTOYILNLSQ-IBGZPJMESA-N 1 3 339.568 2.979 10 0 EFAEHO CCCC[C@@H](CC)CC[NH2+]CC1(N2CCOCC2)CCN(C)CC1 ZINC000414487826 546191414 /nfs/dbraw/zinc/19/14/14/546191414.db2.gz SQHLRTOYILNLSQ-LJQANCHMSA-N 1 3 339.568 2.979 10 0 EFAEHO [NH3+][C@H]1CCC[C@@H](NC(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000416899055 546204323 /nfs/dbraw/zinc/20/43/23/546204323.db2.gz DRBZYMAZRMOJPA-RBUKOAKNSA-N 1 3 344.503 2.742 10 0 EFAEHO [NH3+][C@@H]1CCC[C@@H](NC(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000416899056 546204654 /nfs/dbraw/zinc/20/46/54/546204654.db2.gz DRBZYMAZRMOJPA-RTBURBONSA-N 1 3 344.503 2.742 10 0 EFAEHO O=C(NC[C@@H]1CCCCN1Cc1ccccc1)[C@@H]1C[C@]12CCC[NH2+]C2 ZINC000655445553 546450078 /nfs/dbraw/zinc/45/00/78/546450078.db2.gz BKTCDBTZSAVZSQ-ZJOUEHCJSA-N 1 3 341.499 2.547 10 0 EFAEHO C[C@H]1CC[C@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CS1 ZINC000655777785 546577115 /nfs/dbraw/zinc/57/71/15/546577115.db2.gz ZEGYRLPPECBECA-WMZOPIPTSA-N 1 3 334.529 2.887 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C[C@@H](C)O)C2CC2)CC1 ZINC000656277288 546762707 /nfs/dbraw/zinc/76/27/07/546762707.db2.gz BBYRJOKPXVEHLV-QGZVFWFLSA-N 1 3 331.504 2.564 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C[C@@H](C)O)C2CC2)CC1 ZINC000656277288 546762710 /nfs/dbraw/zinc/76/27/10/546762710.db2.gz BBYRJOKPXVEHLV-QGZVFWFLSA-N 1 3 331.504 2.564 10 0 EFAEHO c1c(CC[NH+]2CCCCC2)nnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000656455646 546807642 /nfs/dbraw/zinc/80/76/42/546807642.db2.gz LIXBWKHEQGWVRG-HXUWFJFHSA-N 1 3 339.487 2.754 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000656552543 546840131 /nfs/dbraw/zinc/84/01/31/546840131.db2.gz XHLVIFZLPZXDEV-IRXDYDNUSA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000656552543 546840134 /nfs/dbraw/zinc/84/01/34/546840134.db2.gz XHLVIFZLPZXDEV-IRXDYDNUSA-N 1 3 336.524 2.567 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000656786099 546924372 /nfs/dbraw/zinc/92/43/72/546924372.db2.gz KMLCQWFOGJFHFK-GOSISDBHSA-N 1 3 339.487 2.787 10 0 EFAEHO C[N@@H+]1C[C@@H](CNCc2ccnn2-c2ccncc2)[C@H](c2ccccc2)C1 ZINC000657499161 547185999 /nfs/dbraw/zinc/18/59/99/547185999.db2.gz AIPQWEABVSXVCK-NQIIRXRSSA-N 1 3 347.466 2.702 10 0 EFAEHO C[N@H+]1C[C@@H](CNCc2ccnn2-c2ccncc2)[C@H](c2ccccc2)C1 ZINC000657499161 547186002 /nfs/dbraw/zinc/18/60/02/547186002.db2.gz AIPQWEABVSXVCK-NQIIRXRSSA-N 1 3 347.466 2.702 10 0 EFAEHO CN1C[C@@H](C[NH2+]Cc2ccnn2-c2ccncc2)[C@H](c2ccccc2)C1 ZINC000657499161 547186006 /nfs/dbraw/zinc/18/60/06/547186006.db2.gz AIPQWEABVSXVCK-NQIIRXRSSA-N 1 3 347.466 2.702 10 0 EFAEHO CCCn1nc(C)c(CNCC2CC[NH+](C3CCOCC3)CC2)c1C ZINC000657535186 547195377 /nfs/dbraw/zinc/19/53/77/547195377.db2.gz IDJXUWBKQZOHER-UHFFFAOYSA-N 1 3 348.535 2.891 10 0 EFAEHO COc1ccc(CN[C@@H](C)CN(C)CCC[NH+](C)C)cc1Cl ZINC000657573986 547212087 /nfs/dbraw/zinc/21/20/87/547212087.db2.gz RYLZWLQBLBNICF-AWEZNQCLSA-N 1 3 327.900 2.710 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1cnc(-c2ccccn2)s1 ZINC000657574352 547212298 /nfs/dbraw/zinc/21/22/98/547212298.db2.gz WTHQCZQYKOJGAK-HNNXBMFYSA-N 1 3 347.532 2.567 10 0 EFAEHO Cc1ccccc1-n1cc(CN[C@@H](C)CN(C)CCC[NH+](C)C)cn1 ZINC000657573082 547212656 /nfs/dbraw/zinc/21/26/56/547212656.db2.gz JLUSORQGDCBFSX-SFHVURJKSA-N 1 3 343.519 2.542 10 0 EFAEHO CCOc1ccc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000657593564 547220293 /nfs/dbraw/zinc/22/02/93/547220293.db2.gz AMRMCZZROYOIPO-FQEVSTJZSA-N 1 3 340.467 2.942 10 0 EFAEHO CCOc1ccc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000657593564 547220299 /nfs/dbraw/zinc/22/02/99/547220299.db2.gz AMRMCZZROYOIPO-FQEVSTJZSA-N 1 3 340.467 2.942 10 0 EFAEHO COC1(C[NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)CCCCC1 ZINC000657595277 547221635 /nfs/dbraw/zinc/22/16/35/547221635.db2.gz GNLSNVHTYMYAMK-IBGZPJMESA-N 1 3 332.488 2.692 10 0 EFAEHO O[C@@H]1CC[N@H+](Cc2ccc(CNCc3ccc(F)c(F)c3)cc2)C1 ZINC000657595313 547222744 /nfs/dbraw/zinc/22/27/44/547222744.db2.gz ONSODUSXCNTPAP-QGZVFWFLSA-N 1 3 332.394 2.821 10 0 EFAEHO O[C@@H]1CC[N@@H+](Cc2ccc(CNCc3ccc(F)c(F)c3)cc2)C1 ZINC000657595313 547222751 /nfs/dbraw/zinc/22/27/51/547222751.db2.gz ONSODUSXCNTPAP-QGZVFWFLSA-N 1 3 332.394 2.821 10 0 EFAEHO c1nnn(Cc2ccccc2)c1CNCC1CC[NH+](CC2CC2)CC1 ZINC000657814614 547293643 /nfs/dbraw/zinc/29/36/43/547293643.db2.gz JSSHLEZYVPOEGD-UHFFFAOYSA-N 1 3 339.487 2.538 10 0 EFAEHO C[C@H](O)[C@H](NCc1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000657820007 547294389 /nfs/dbraw/zinc/29/43/89/547294389.db2.gz VUOLBYBAGBJQCG-JXFKEZNVSA-N 1 3 328.456 2.839 10 0 EFAEHO c1ccc(N2CCN(CCCC[NH2+][C@@H]3COC4(CCC4)C3)CC2)cc1 ZINC000657849286 547302378 /nfs/dbraw/zinc/30/23/78/547302378.db2.gz FYQUETZIFMDVPD-IBGZPJMESA-N 1 3 343.515 2.890 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]C[C@H]2CCN2C(C)(C)C)[C@H](C)C1 ZINC000658053461 547343429 /nfs/dbraw/zinc/34/34/29/547343429.db2.gz BEEITFWUKYRFHS-KURKYZTESA-N 1 3 325.541 2.586 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NC[C@H]2CCN2C(C)(C)C)[C@H](C)C1 ZINC000658053461 547343433 /nfs/dbraw/zinc/34/34/33/547343433.db2.gz BEEITFWUKYRFHS-KURKYZTESA-N 1 3 325.541 2.586 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NC[C@H]2CCN2C(C)(C)C)[C@H](C)C1 ZINC000658053461 547343436 /nfs/dbraw/zinc/34/34/36/547343436.db2.gz BEEITFWUKYRFHS-KURKYZTESA-N 1 3 325.541 2.586 10 0 EFAEHO COC[C@H](CC[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21)OC ZINC000658082242 547352362 /nfs/dbraw/zinc/35/23/62/547352362.db2.gz KNHWYTYOBFZPPC-XSDIEEQYSA-N 1 3 346.515 2.928 10 0 EFAEHO COc1ccc([C@@H](C)N[C@@H](C)CN(C)CCC[NH+](C)C)cc1F ZINC000658106830 547357508 /nfs/dbraw/zinc/35/75/08/547357508.db2.gz FDHZJAJHCCCBCI-LSDHHAIUSA-N 1 3 325.472 2.757 10 0 EFAEHO COc1ccc([C@H](C)N[C@@H](C)CN(C)CCC[NH+](C)C)cc1F ZINC000658106829 547357608 /nfs/dbraw/zinc/35/76/08/547357608.db2.gz FDHZJAJHCCCBCI-GJZGRUSLSA-N 1 3 325.472 2.757 10 0 EFAEHO C[C@@H](NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cccc(CO)c1 ZINC000658136389 547367892 /nfs/dbraw/zinc/36/78/92/547367892.db2.gz HAVNGOBURQDYMM-IERDGZPVSA-N 1 3 340.467 2.596 10 0 EFAEHO C[C@@H](NCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1)c1cccc(CO)c1 ZINC000658136389 547367894 /nfs/dbraw/zinc/36/78/94/547367894.db2.gz HAVNGOBURQDYMM-IERDGZPVSA-N 1 3 340.467 2.596 10 0 EFAEHO CC(C)(C)[NH+]1CCC(NCc2ccc(CN3CC[C@H](O)C3)cc2)CC1 ZINC000658138335 547367907 /nfs/dbraw/zinc/36/79/07/547367907.db2.gz JFKGYTHKFLKPPB-FQEVSTJZSA-N 1 3 345.531 2.606 10 0 EFAEHO COC1([C@H](C)[NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)CCCC1 ZINC000658140529 547368829 /nfs/dbraw/zinc/36/88/29/547368829.db2.gz VCDLHLIITWIWTJ-QFBILLFUSA-N 1 3 332.488 2.691 10 0 EFAEHO CC[C@H](NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccncc1 ZINC000658141992 547368865 /nfs/dbraw/zinc/36/88/65/547368865.db2.gz YAAXTTCQZBAYLY-PMACEKPBSA-N 1 3 325.456 2.889 10 0 EFAEHO CC[C@H](NCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1)c1ccncc1 ZINC000658141992 547368869 /nfs/dbraw/zinc/36/88/69/547368869.db2.gz YAAXTTCQZBAYLY-PMACEKPBSA-N 1 3 325.456 2.889 10 0 EFAEHO C[C@H](NCCO[C@@H]1CC1(F)F)c1cccc(OCC[NH+](C)C)c1 ZINC000658168949 547379878 /nfs/dbraw/zinc/37/98/78/547379878.db2.gz JVTIQANBCXGYCI-XJKSGUPXSA-N 1 3 328.403 2.702 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)C[NH2+][C@@H]1CCN(C)[C@@H]2CCC[C@@H]21 ZINC000671743136 547665250 /nfs/dbraw/zinc/66/52/50/547665250.db2.gz GDPCMXKCHLNGJI-NCXUSEDFSA-N 1 3 332.488 2.506 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CN[C@@H]1CC[N@@H+](C)[C@@H]2CCC[C@@H]21 ZINC000671743136 547665253 /nfs/dbraw/zinc/66/52/53/547665253.db2.gz GDPCMXKCHLNGJI-NCXUSEDFSA-N 1 3 332.488 2.506 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CN[C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000671743136 547665257 /nfs/dbraw/zinc/66/52/57/547665257.db2.gz GDPCMXKCHLNGJI-NCXUSEDFSA-N 1 3 332.488 2.506 10 0 EFAEHO COC1CCN(CC[NH2+][C@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1 ZINC000675929452 548377166 /nfs/dbraw/zinc/37/71/66/548377166.db2.gz FAONKHRMDJFZFI-NQIIRXRSSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@@H](N[C@H](CO)c1cccc(Br)c1)C1CC[NH+](C)CC1 ZINC000678598837 548959324 /nfs/dbraw/zinc/95/93/24/548959324.db2.gz NWSYCWGBLZBZOZ-MLGOLLRUSA-N 1 3 341.293 2.802 10 0 EFAEHO c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H](NCCOC[C@H]2CCCO2)C3)cc1 ZINC000679394213 549119413 /nfs/dbraw/zinc/11/94/13/549119413.db2.gz IJMDPZDOEMZLSW-MXEMCNAFSA-N 1 3 344.499 2.967 10 0 EFAEHO c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H](NCCOC[C@H]2CCCO2)C3)cc1 ZINC000679394213 549119419 /nfs/dbraw/zinc/11/94/19/549119419.db2.gz IJMDPZDOEMZLSW-MXEMCNAFSA-N 1 3 344.499 2.967 10 0 EFAEHO C[C@@H]1CN(C)C[C@@H]1[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000679721424 549190914 /nfs/dbraw/zinc/19/09/14/549190914.db2.gz NUYWWMUINNIOHH-RQSWOZRGSA-N 1 3 327.516 2.827 10 0 EFAEHO C[C@H]1CN(Cc2cccc3cnccc32)CC[C@H]1[NH+]1CCN(C)CC1 ZINC000679990840 549234443 /nfs/dbraw/zinc/23/44/43/549234443.db2.gz RUTXQJKCKOXBCX-LAUBAEHRSA-N 1 3 338.499 2.693 10 0 EFAEHO c1cc(OCC[NH+]2CCCC2)ccc1CN1CCOCC2(CC2)C1 ZINC000680001982 549236167 /nfs/dbraw/zinc/23/61/67/549236167.db2.gz VGZDCSRGQQLYQC-UHFFFAOYSA-N 1 3 330.472 2.774 10 0 EFAEHO C[C@H]1CCN(Cc2ccccc2)CCN1C(=O)[C@H]1CCC[N@@H+]1C1CC1 ZINC000683855819 549955868 /nfs/dbraw/zinc/95/58/68/549955868.db2.gz ATEUQWPYBRTUFK-FXAWDEMLSA-N 1 3 341.499 2.736 10 0 EFAEHO C[C@H]1CCN(Cc2ccccc2)CCN1C(=O)[C@H]1CCC[N@H+]1C1CC1 ZINC000683855819 549955870 /nfs/dbraw/zinc/95/58/70/549955870.db2.gz ATEUQWPYBRTUFK-FXAWDEMLSA-N 1 3 341.499 2.736 10 0 EFAEHO C[C@H]1CCN(Cc2ccccc2)CCN1C(=O)[C@@H]1CCC[N@@H+]1C1CC1 ZINC000683855821 549956008 /nfs/dbraw/zinc/95/60/08/549956008.db2.gz ATEUQWPYBRTUFK-PXNSSMCTSA-N 1 3 341.499 2.736 10 0 EFAEHO C[C@H]1CCN(Cc2ccccc2)CCN1C(=O)[C@@H]1CCC[N@H+]1C1CC1 ZINC000683855821 549956012 /nfs/dbraw/zinc/95/60/12/549956012.db2.gz ATEUQWPYBRTUFK-PXNSSMCTSA-N 1 3 341.499 2.736 10 0 EFAEHO CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(CN3CCC(O)CC3)cc2)C1 ZINC000684366960 550030621 /nfs/dbraw/zinc/03/06/21/550030621.db2.gz XOQGJEPNKXPPJZ-UYAOXDASSA-N 1 3 332.488 2.691 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH+]2CC([C@@H]3CCOC3)C2)CC1 ZINC000684415288 550036827 /nfs/dbraw/zinc/03/68/27/550036827.db2.gz ICQKZICLVHZSAH-LJQANCHMSA-N 1 3 343.515 2.687 10 0 EFAEHO COC(=O)/C(C)=C\C[N@H+](C)CCC1CCN(c2ccncc2)CC1 ZINC000771452882 581213370 /nfs/dbraw/zinc/21/33/70/581213370.db2.gz SELNDDGOTDCXPA-SOFYXZRVSA-N 1 3 331.460 2.739 10 0 EFAEHO COC(=O)/C(C)=C\C[N@@H+](C)CCC1CCN(c2ccncc2)CC1 ZINC000771452882 581213372 /nfs/dbraw/zinc/21/33/72/581213372.db2.gz SELNDDGOTDCXPA-SOFYXZRVSA-N 1 3 331.460 2.739 10 0 EFAEHO Cc1cccc(Cl)c1CNCCN(C)C(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001691321757 1248655374 /nfs/dbraw/zinc/65/53/74/1248655374.db2.gz JSKKFZKYBUSWJU-QGZVFWFLSA-N 1 3 349.906 2.538 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001691352334 1248685840 /nfs/dbraw/zinc/68/58/40/1248685840.db2.gz SLWWZFVATXHDGI-SFHVURJKSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001691352334 1248685854 /nfs/dbraw/zinc/68/58/54/1248685854.db2.gz SLWWZFVATXHDGI-SFHVURJKSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001691352333 1248687197 /nfs/dbraw/zinc/68/71/97/1248687197.db2.gz SLWWZFVATXHDGI-GOSISDBHSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)CC[C@H]1CCC[N@H+]1C ZINC001691352333 1248687208 /nfs/dbraw/zinc/68/72/08/1248687208.db2.gz SLWWZFVATXHDGI-GOSISDBHSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001691424094 1248762403 /nfs/dbraw/zinc/76/24/03/1248762403.db2.gz ZZKOWMYAIRHZIM-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1ccc(C[NH2+]CCN(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC001691476583 1249200935 /nfs/dbraw/zinc/20/09/35/1249200935.db2.gz MXABQPOQFHFDKM-FQEVSTJZSA-N 1 3 349.494 2.756 10 0 EFAEHO CCCCC[NH+]1CC2(C1)CCN(C(=O)[C@@H]1CCCCN1CC)CC2 ZINC001268049417 1249667357 /nfs/dbraw/zinc/66/73/57/1249667357.db2.gz ZGDZBFWTWPUQHE-SFHVURJKSA-N 1 3 335.536 2.975 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCC[N@@H+]1CCCCCF)N1CCCCC1 ZINC001691080385 1248372286 /nfs/dbraw/zinc/37/22/86/1248372286.db2.gz XAYGBJIBEASEKL-KRWDZBQOSA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCC[N@H+]1CCCCCF)N1CCCCC1 ZINC001691080385 1248372292 /nfs/dbraw/zinc/37/22/92/1248372292.db2.gz XAYGBJIBEASEKL-KRWDZBQOSA-N 1 3 341.515 2.971 10 0 EFAEHO CCCCC[NH2+][C@H]1C[C@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001691167091 1248498019 /nfs/dbraw/zinc/49/80/19/1248498019.db2.gz LCIWMHOCCKOQEE-BXWFABGCSA-N 1 3 341.515 2.874 10 0 EFAEHO C[NH+](C)CCOc1ccc(CNC[C@]23OCCC[C@H]2C3(F)F)cc1 ZINC000850378716 1250456264 /nfs/dbraw/zinc/45/62/64/1250456264.db2.gz PXJBVKCWOVCEII-SJORKVTESA-N 1 3 340.414 2.531 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@@H]2CCC[C@H]([NH+](C)C)C2)cc1F ZINC001691556286 1251770247 /nfs/dbraw/zinc/77/02/47/1251770247.db2.gz STKLZGULLXEPKG-MSOLQXFVSA-N 1 3 349.494 2.803 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)[C@@H](CC)N(C)C)C[C@@H]2C1 ZINC001691558037 1251770587 /nfs/dbraw/zinc/77/05/87/1251770587.db2.gz QLYLUOZBFZDYNG-VXARMHRZSA-N 1 3 335.536 2.853 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)[C@@H](CC)N(C)C)C[C@@H]2C1 ZINC001691558037 1251770594 /nfs/dbraw/zinc/77/05/94/1251770594.db2.gz QLYLUOZBFZDYNG-VXARMHRZSA-N 1 3 335.536 2.853 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@@H]2CCC[C@@H]([NH+](C)C)C2)cc1F ZINC001691556287 1251771398 /nfs/dbraw/zinc/77/13/98/1251771398.db2.gz STKLZGULLXEPKG-QZTJIDSGSA-N 1 3 349.494 2.803 10 0 EFAEHO CN(CC[NH2+]Cc1cc(Cl)cc(Cl)c1)C(=O)CN1CCCC1 ZINC001691603296 1251814604 /nfs/dbraw/zinc/81/46/04/1251814604.db2.gz YJMOKUPSSSWVDK-UHFFFAOYSA-N 1 3 344.286 2.637 10 0 EFAEHO CCCC[NH2+][C@@H]1CC[C@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001691626639 1251872269 /nfs/dbraw/zinc/87/22/69/1251872269.db2.gz MFAUJTRJPLFJSX-FCEWJHQRSA-N 1 3 341.515 2.874 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCCCC[C@H](NCc2ccccn2)C1 ZINC001691637136 1251975192 /nfs/dbraw/zinc/97/51/92/1251975192.db2.gz UBUAECXFSVBQJZ-IBGZPJMESA-N 1 3 346.519 2.674 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@]1(C)CC[N@H+](CC2=CCCCC2)C1 ZINC001484049186 1252116923 /nfs/dbraw/zinc/11/69/23/1252116923.db2.gz OIZFXPVPBJYQPG-PKOBYXMFSA-N 1 3 339.499 2.747 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@]1(C)CC[N@@H+](CC2=CCCCC2)C1 ZINC001484049186 1252116928 /nfs/dbraw/zinc/11/69/28/1252116928.db2.gz OIZFXPVPBJYQPG-PKOBYXMFSA-N 1 3 339.499 2.747 10 0 EFAEHO CCCC[N@@H+]1CC[C@@](C)(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001484059246 1252122890 /nfs/dbraw/zinc/12/28/90/1252122890.db2.gz XRBOQPBXEUGRFJ-QZTJIDSGSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCC[N@H+]1CC[C@@](C)(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001484059246 1252122895 /nfs/dbraw/zinc/12/28/95/1252122895.db2.gz XRBOQPBXEUGRFJ-QZTJIDSGSA-N 1 3 327.488 2.580 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@@]1(C)CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001484119029 1252290173 /nfs/dbraw/zinc/29/01/73/1252290173.db2.gz JVVVPNQPLFSCTE-KKHYBRAUSA-N 1 3 335.536 2.903 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@@]1(C)CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001484119031 1252290786 /nfs/dbraw/zinc/29/07/86/1252290786.db2.gz JVVVPNQPLFSCTE-RRFGBZISSA-N 1 3 335.536 2.903 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001484357964 1252451707 /nfs/dbraw/zinc/45/17/07/1252451707.db2.gz KHGJILVUBOOGGU-ICSRJNTNSA-N 1 3 345.531 2.704 10 0 EFAEHO C[C@H]1CN(C(=O)CN2CCC(C)CC2)C[C@H]1C[NH2+]CCCC1CCC1 ZINC001484381422 1252493612 /nfs/dbraw/zinc/49/36/12/1252493612.db2.gz WAGAJFMDLUBQIX-AZUAARDMSA-N 1 3 349.563 2.983 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](Cc3cccc(Cl)c3)C[C@@H]2C1 ZINC001484414984 1252562458 /nfs/dbraw/zinc/56/24/58/1252562458.db2.gz IZHPPVOZNUAPJV-CALCHBBNSA-N 1 3 349.906 2.570 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](Cc3cccc(Cl)c3)C[C@@H]2C1 ZINC001484414984 1252562463 /nfs/dbraw/zinc/56/24/63/1252562463.db2.gz IZHPPVOZNUAPJV-CALCHBBNSA-N 1 3 349.906 2.570 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+]2C[C@H]3CN(C(=O)CN(C)C(C)C)C[C@H]3C2)c1 ZINC001484414856 1252564991 /nfs/dbraw/zinc/56/49/91/1252564991.db2.gz DTLWCJOJNGBXCM-BGYRXZFFSA-N 1 3 343.515 2.534 10 0 EFAEHO Cc1cc(C)cc(C[N@H+]2C[C@H]3CN(C(=O)CN(C)C(C)C)C[C@H]3C2)c1 ZINC001484414856 1252565001 /nfs/dbraw/zinc/56/50/01/1252565001.db2.gz DTLWCJOJNGBXCM-BGYRXZFFSA-N 1 3 343.515 2.534 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@H+]1C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001484415352 1252571309 /nfs/dbraw/zinc/57/13/09/1252571309.db2.gz YWYNVXDPBSEQSU-GBESFXJTSA-N 1 3 343.515 2.786 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@@H+]1C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001484415352 1252571319 /nfs/dbraw/zinc/57/13/19/1252571319.db2.gz YWYNVXDPBSEQSU-GBESFXJTSA-N 1 3 343.515 2.786 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(F)c1 ZINC001484463898 1252663827 /nfs/dbraw/zinc/66/38/27/1252663827.db2.gz SIHYSKUQUVHCIF-RBUKOAKNSA-N 1 3 347.478 2.733 10 0 EFAEHO CN(CCC[N@H+](C)C[C@H]1CCCC(F)(F)C1)C(=O)CN1CCCC1 ZINC001484768380 1252969907 /nfs/dbraw/zinc/96/99/07/1252969907.db2.gz NBQMTINTCXMPAM-INIZCTEOSA-N 1 3 345.478 2.688 10 0 EFAEHO CN(CCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1)C(=O)CN1CCCC1 ZINC001484768380 1252969926 /nfs/dbraw/zinc/96/99/26/1252969926.db2.gz NBQMTINTCXMPAM-INIZCTEOSA-N 1 3 345.478 2.688 10 0 EFAEHO C[C@@H](CC[NH2+]CC1CCCC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001273018944 1265839501 /nfs/dbraw/zinc/83/95/01/1265839501.db2.gz QHLOFFRLRIMNRP-KXBFYZLASA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H]1CC[C@H](NC(=O)C(C)(C)N2CCCC2)CC1 ZINC001272748929 1256443805 /nfs/dbraw/zinc/44/38/05/1256443805.db2.gz VDJNXNZSODZNJR-ULQDDVLXSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C)CC[NH2+]CCc1cccs1 ZINC001272774443 1257883432 /nfs/dbraw/zinc/88/34/32/1257883432.db2.gz VKJVHOAPFURNDX-WBVHZDCISA-N 1 3 337.533 2.648 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccc(Cl)cc1)NC(=O)CN(C)C1CCC1 ZINC001272829553 1261094994 /nfs/dbraw/zinc/09/49/94/1261094994.db2.gz LFWADSXRLWEZJU-AWEZNQCLSA-N 1 3 337.895 2.809 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)cc1F)N(C)C ZINC001272866173 1261192661 /nfs/dbraw/zinc/19/26/61/1261192661.db2.gz SEKWOXUFLHMGSF-BLLLJJGKSA-N 1 3 343.874 2.804 10 0 EFAEHO CN(CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000923315264 1261449106 /nfs/dbraw/zinc/44/91/06/1261449106.db2.gz DVSBOZKZYYGFJY-IHBAFOEMSA-N 1 3 345.462 2.784 10 0 EFAEHO C[C@@H]([NH3+])[C@H]1CCN(C[C@@H]2Cc3ccccc3O[C@H]2C(F)(F)F)C1 ZINC000923332198 1261483207 /nfs/dbraw/zinc/48/32/07/1261483207.db2.gz QFLDUTOEWDARSI-AOLWHUPESA-N 1 3 328.378 2.838 10 0 EFAEHO Cc1ccc(C)c(OC[C@H](O)CN2CCCC[C@H]2[C@@H]2CC[NH2+]C2)c1 ZINC000923364505 1261558744 /nfs/dbraw/zinc/55/87/44/1261558744.db2.gz NGDHEGSYPBCERX-QRVBRYPASA-N 1 3 332.488 2.507 10 0 EFAEHO [NH3+][C@@H]1C[C@H](O)[C@@H](N2CCC(c3ccc(C(F)(F)F)cc3)CC2)C1 ZINC000923371176 1261565169 /nfs/dbraw/zinc/56/51/69/1261565169.db2.gz QHXNMPVDELOUER-JYJNAYRXSA-N 1 3 328.378 2.735 10 0 EFAEHO CN(CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)Cc1cn(C)nc1C(F)(F)F ZINC000923374346 1261574725 /nfs/dbraw/zinc/57/47/25/1261574725.db2.gz WIENTBDSQLMZJR-QXMXGUDHSA-N 1 3 330.398 2.791 10 0 EFAEHO CC[C@@H](C(=O)Nc1ccc(C)cc1)N1CCC2(CO[C@H](C[NH3+])C2)CC1 ZINC000923446309 1261665554 /nfs/dbraw/zinc/66/55/54/1261665554.db2.gz MTSSUYIQWKLDQL-ROUUACIJSA-N 1 3 345.487 2.542 10 0 EFAEHO Cc1ccc(-c2cc(CN3CCC4(CO[C@H](C[NH3+])C4)CC3)on2)cc1 ZINC000923448286 1261669004 /nfs/dbraw/zinc/66/90/04/1261669004.db2.gz BCHKHPSIAMXPQK-SFHVURJKSA-N 1 3 341.455 2.980 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H](C1CC1)N(C)C(=O)CN(C)C(C)C ZINC001485838628 1261731219 /nfs/dbraw/zinc/73/12/19/1261731219.db2.gz VOIAZVSPAQFKRB-HXUWFJFHSA-N 1 3 345.531 2.970 10 0 EFAEHO Cc1cc(F)ccc1N1CCC[C@H](N2CC[C@@H](C[NH3+])[C@H](C)C2)C1=O ZINC000923496398 1261765353 /nfs/dbraw/zinc/76/53/53/1261765353.db2.gz HRRCPVQWRCQKDZ-VKJFTORMSA-N 1 3 333.451 2.546 10 0 EFAEHO Cc1cc(C)c(N2CC[C@H](N3CC[C@@H](C[NH3+])[C@H](C)C3)C2=O)c(C)c1 ZINC000923494973 1261781486 /nfs/dbraw/zinc/78/14/86/1261781486.db2.gz RGKCXOJXIYUKML-SQNIBIBYSA-N 1 3 329.488 2.634 10 0 EFAEHO Cc1cc(C)c(N2CC[C@H](N3CC[C@H](C[NH3+])[C@@H](C)C3)C2=O)c(C)c1 ZINC000923494971 1261781859 /nfs/dbraw/zinc/78/18/59/1261781859.db2.gz RGKCXOJXIYUKML-KSZLIROESA-N 1 3 329.488 2.634 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C[NH3+])[C@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000923502428 1261782674 /nfs/dbraw/zinc/78/26/74/1261782674.db2.gz ZAHZMMRZVSCVKL-GQIGUUNPSA-N 1 3 343.515 2.659 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C[NH3+])[C@@H](C)C1)[C@H](C)c1ccc(F)cc1 ZINC000923496916 1261786514 /nfs/dbraw/zinc/78/65/14/1261786514.db2.gz KGEOAUZVGMTDTO-ZMSDIMECSA-N 1 3 335.467 2.652 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C[NH3+])[C@H](C)C1)c1ccc2ccccc2c1 ZINC000923504648 1261802333 /nfs/dbraw/zinc/80/23/33/1261802333.db2.gz SCLQRCMMLWUNDE-GUXCAODWSA-N 1 3 339.483 2.934 10 0 EFAEHO CCOC(=O)C1(C(F)(F)F)CCN(CCC2CC[NH2+]CC2)CC1 ZINC000923525762 1261841791 /nfs/dbraw/zinc/84/17/91/1261841791.db2.gz URITZNSGSZZVKO-UHFFFAOYSA-N 1 3 336.398 2.584 10 0 EFAEHO c1ccc2c(c1)[C@H](C[C@H]1COCCN1)CN2CCCC1CC[NH2+]CC1 ZINC000923538705 1261871342 /nfs/dbraw/zinc/87/13/42/1261871342.db2.gz APISHTIWKFHQGS-MOPGFXCFSA-N 1 3 343.515 2.749 10 0 EFAEHO [NH3+]CCCCCCCN1C[C@H](C[C@H]2COCCN2)c2ccccc21 ZINC000923540414 1261874736 /nfs/dbraw/zinc/87/47/36/1261874736.db2.gz JIHUAOYDXVLTEW-ROUUACIJSA-N 1 3 331.504 2.878 10 0 EFAEHO C[C@H](CN(C)C(=O)C1CC[NH+](CC2CC2)CC1)NCc1ccsc1 ZINC001485941520 1262540286 /nfs/dbraw/zinc/54/02/86/1262540286.db2.gz MZVXNCMKXFHVFV-OAHLLOKOSA-N 1 3 349.544 2.807 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)CN(C)C(=O)C12CC[NH+](CC1)C2 ZINC001485943825 1262542948 /nfs/dbraw/zinc/54/29/48/1262542948.db2.gz FKYIEEOQMZJPAR-HNNXBMFYSA-N 1 3 349.906 2.681 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(C)cc1 ZINC001485962192 1262561985 /nfs/dbraw/zinc/56/19/85/1262561985.db2.gz WNAYYRVJAMBEGO-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO C[C@H](c1ccccc1F)N1CC[C@@]2(NC(=O)CC[NH+](C)C)CCC[C@@H]12 ZINC001486148223 1262697972 /nfs/dbraw/zinc/69/79/72/1262697972.db2.gz LDODOVMYZBGEJH-ZTNFWEORSA-N 1 3 347.478 2.952 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN3CCC(C)CC3)C[C@H]21 ZINC001486168793 1262731040 /nfs/dbraw/zinc/73/10/40/1262731040.db2.gz ZLQTYPIDXQMSKH-XUVXKRRUSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CC[C@@H](C[NH2+]C/C=C\Cl)C1)N1CCCCC1 ZINC001486200930 1262785272 /nfs/dbraw/zinc/78/52/72/1262785272.db2.gz PEQKFYKJBCNOIE-PDTSHOSPSA-N 1 3 341.927 2.878 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H](C[NH2+]C/C=C\Cl)C1)CC(C)(C)C ZINC001486211053 1262807850 /nfs/dbraw/zinc/80/78/50/1262807850.db2.gz AKUKDSQGPFQYLK-OVUXIIJLSA-N 1 3 329.916 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H](C[NH2+]Cc2ccccc2F)C1 ZINC001486220996 1262825337 /nfs/dbraw/zinc/82/53/37/1262825337.db2.gz PUNTZFXEWJVWMH-DOTOQJQBSA-N 1 3 335.467 2.540 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N2C[C@H](NC/C=C/Cl)C(C)(C)C2)C1 ZINC001486241509 1262842969 /nfs/dbraw/zinc/84/29/69/1262842969.db2.gz VAHFTGLHRPKGJX-OHOWAWRESA-N 1 3 341.927 2.688 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N2C[C@H](NC/C=C/Cl)C(C)(C)C2)C1 ZINC001486241509 1262842974 /nfs/dbraw/zinc/84/29/74/1262842974.db2.gz VAHFTGLHRPKGJX-OHOWAWRESA-N 1 3 341.927 2.688 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N2C[C@@H](NC/C=C/Cl)C(C)(C)C2)C1 ZINC001486241506 1262843174 /nfs/dbraw/zinc/84/31/74/1262843174.db2.gz VAHFTGLHRPKGJX-BWVNKGDMSA-N 1 3 341.927 2.688 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N2C[C@@H](NC/C=C/Cl)C(C)(C)C2)C1 ZINC001486241506 1262843184 /nfs/dbraw/zinc/84/31/84/1262843184.db2.gz VAHFTGLHRPKGJX-BWVNKGDMSA-N 1 3 341.927 2.688 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C[NH2+]CC=C(C)C)[C@@H](C(F)(F)F)C1 ZINC001486253160 1262861065 /nfs/dbraw/zinc/86/10/65/1262861065.db2.gz KKFWYCVHUGXGFQ-CABCVRRESA-N 1 3 349.441 2.521 10 0 EFAEHO CC(C)N(CC[N@H+](C)Cc1ccccc1)C(=O)CN(C)C1CCC1 ZINC001486370448 1262967743 /nfs/dbraw/zinc/96/77/43/1262967743.db2.gz TYNGEORPYYSYAB-UHFFFAOYSA-N 1 3 331.504 2.840 10 0 EFAEHO CC(C)N(CC[N@@H+](C)Cc1ccccc1)C(=O)CN(C)C1CCC1 ZINC001486370448 1262967753 /nfs/dbraw/zinc/96/77/53/1262967753.db2.gz TYNGEORPYYSYAB-UHFFFAOYSA-N 1 3 331.504 2.840 10 0 EFAEHO CC(C)N(CC[N@H+](C)CC1CC(F)(F)C1)C(=O)CN1CC[C@H](C)C1 ZINC001486375670 1262977527 /nfs/dbraw/zinc/97/75/27/1262977527.db2.gz NGYFZBBEQXGFRB-HNNXBMFYSA-N 1 3 345.478 2.542 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CC1CC(F)(F)C1)C(=O)CN1CC[C@H](C)C1 ZINC001486375670 1262977533 /nfs/dbraw/zinc/97/75/33/1262977533.db2.gz NGYFZBBEQXGFRB-HNNXBMFYSA-N 1 3 345.478 2.542 10 0 EFAEHO CC(C)N(CC[N@H+](C)C[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)CN1CCCC1 ZINC001486379558 1262987383 /nfs/dbraw/zinc/98/73/83/1262987383.db2.gz LFXIIOKRVMDPFV-QRVBRYPASA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(CC[N@@H+](C)C[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)CN1CCCC1 ZINC001486379558 1262987388 /nfs/dbraw/zinc/98/73/88/1262987388.db2.gz LFXIIOKRVMDPFV-QRVBRYPASA-N 1 3 335.536 2.687 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C1CC[NH+](CCc2ccccc2)CC1)N(C)C ZINC001486440899 1263151531 /nfs/dbraw/zinc/15/15/31/1263151531.db2.gz FKYTXPDUEUTTQQ-XLIONFOSSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1C(F)(F)F ZINC001486452925 1263164485 /nfs/dbraw/zinc/16/44/85/1263164485.db2.gz RKHGZLFTTUGKCX-LSDHHAIUSA-N 1 3 349.441 2.662 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@H](NC(=O)C23CCCN2CCC3)C(C)(C)C1 ZINC001410061654 1263169787 /nfs/dbraw/zinc/16/97/87/1263169787.db2.gz ZTMXVXVAAYDFCC-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@H](NC(=O)C23CCCN2CCC3)C(C)(C)C1 ZINC001410061654 1263169792 /nfs/dbraw/zinc/16/97/92/1263169792.db2.gz ZTMXVXVAAYDFCC-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H](NC(=O)C23CCCN2CCC3)C(C)(C)C1 ZINC001410061666 1263169929 /nfs/dbraw/zinc/16/99/29/1263169929.db2.gz ZTMXVXVAAYDFCC-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H](NC(=O)C23CCCN2CCC3)C(C)(C)C1 ZINC001410061666 1263169934 /nfs/dbraw/zinc/16/99/34/1263169934.db2.gz ZTMXVXVAAYDFCC-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(C(=O)CN1CCCC1)C1CC([NH2+]CCCCc2ccccc2)C1 ZINC001486482543 1263221742 /nfs/dbraw/zinc/22/17/42/1263221742.db2.gz IGDRJTYPIWDKRA-UHFFFAOYSA-N 1 3 343.515 2.684 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]C1CC(N(C)C(=O)CN(C)C(C)C)C1 ZINC001486484219 1263224205 /nfs/dbraw/zinc/22/42/05/1263224205.db2.gz XGTHWOVUMWJIRS-WWDZGPRUSA-N 1 3 331.504 2.975 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@@H+]([C@H]2CCc3ccccc32)CC1)N(C)C ZINC001486515625 1263300998 /nfs/dbraw/zinc/30/09/98/1263300998.db2.gz LPGGHERYEBDDNG-PMACEKPBSA-N 1 3 341.499 2.762 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@H+]([C@H]2CCc3ccccc32)CC1)N(C)C ZINC001486515625 1263301009 /nfs/dbraw/zinc/30/10/09/1263301009.db2.gz LPGGHERYEBDDNG-PMACEKPBSA-N 1 3 341.499 2.762 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+]([C@H](C)c2ccccc2)CC1 ZINC001486519950 1263313737 /nfs/dbraw/zinc/31/37/37/1263313737.db2.gz XSSMIWHBVGLTDD-QGZVFWFLSA-N 1 3 329.488 2.838 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+]([C@H](C)c2ccccc2)CC1 ZINC001486519950 1263313750 /nfs/dbraw/zinc/31/37/50/1263313750.db2.gz XSSMIWHBVGLTDD-QGZVFWFLSA-N 1 3 329.488 2.838 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2cc(C)ccc2C)C1)N(C)C ZINC001410209666 1264336882 /nfs/dbraw/zinc/33/68/82/1264336882.db2.gz IXXVHFBVZSXEKP-BHIYHBOVSA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(CF)cc2)C1)N(C)C ZINC001410216181 1264342775 /nfs/dbraw/zinc/34/27/75/1264342775.db2.gz LNHBFOVZKDBJIN-GUDVDZBRSA-N 1 3 349.494 2.727 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001410235041 1264439795 /nfs/dbraw/zinc/43/97/95/1264439795.db2.gz XUADESSFGOPQKD-WGSAOQKQSA-N 1 3 331.504 2.628 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)[C@H]2CCC[N@@H+]2C(C)C)c1 ZINC001410378883 1264948834 /nfs/dbraw/zinc/94/88/34/1264948834.db2.gz GAPKTESUDYXKHO-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)[C@H]2CCC[N@H+]2C(C)C)c1 ZINC001410378883 1264948846 /nfs/dbraw/zinc/94/88/46/1264948846.db2.gz GAPKTESUDYXKHO-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@H](C)CN(C)C(=O)CN1CC[C@H](C)C1 ZINC001410427937 1265140453 /nfs/dbraw/zinc/14/04/53/1265140453.db2.gz BUFFCGOEUMTVDR-ZWKOTPCHSA-N 1 3 345.531 2.570 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001410428625 1265146498 /nfs/dbraw/zinc/14/64/98/1265146498.db2.gz CEZNZXUALVLJGN-YJBOKZPZSA-N 1 3 331.504 2.582 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N(C)C[C@@H](C)NCc2ccccc2F)C1 ZINC001410429716 1265157755 /nfs/dbraw/zinc/15/77/55/1265157755.db2.gz TXNWSQPFTLPVNR-AEFFLSMTSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N(C)C[C@@H](C)NCc2ccccc2F)C1 ZINC001410429716 1265157761 /nfs/dbraw/zinc/15/77/61/1265157761.db2.gz TXNWSQPFTLPVNR-AEFFLSMTSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N(C)C[C@H](C)NCc2ccccc2F)C1 ZINC001410429738 1265157877 /nfs/dbraw/zinc/15/78/77/1265157877.db2.gz TXNWSQPFTLPVNR-WMZOPIPTSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N(C)C[C@H](C)NCc2ccccc2F)C1 ZINC001410429738 1265157880 /nfs/dbraw/zinc/15/78/80/1265157880.db2.gz TXNWSQPFTLPVNR-WMZOPIPTSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001410434253 1265176573 /nfs/dbraw/zinc/17/65/73/1265176573.db2.gz LANHPTWADAJTEY-DNVCBOLYSA-N 1 3 344.503 2.691 10 0 EFAEHO O[C@H](C[C@H]1CCC[N@@H+]1Cc1ccnn1-c1ccncc1)c1ccco1 ZINC000824927624 1278357705 /nfs/dbraw/zinc/35/77/05/1278357705.db2.gz PPVPLSJEGLOYLA-SJLPKXTDSA-N 1 3 338.411 2.948 10 0 EFAEHO O[C@H](C[C@H]1CCC[N@H+]1Cc1ccnn1-c1ccncc1)c1ccco1 ZINC000824927624 1278357715 /nfs/dbraw/zinc/35/77/15/1278357715.db2.gz PPVPLSJEGLOYLA-SJLPKXTDSA-N 1 3 338.411 2.948 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001273121392 1268523465 /nfs/dbraw/zinc/52/34/65/1268523465.db2.gz BKUQETBDSGZADN-BBRMVZONSA-N 1 3 325.884 2.665 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(F)cc1F)N(C)C ZINC001273131566 1268783098 /nfs/dbraw/zinc/78/30/98/1268783098.db2.gz UKYVBWAVLCHRAF-GUYCJALGSA-N 1 3 341.446 2.535 10 0 EFAEHO CCN(CCNCc1cccnc1C)C(=O)C(C)(C)[NH+]1CCCCC1 ZINC001273373513 1269122067 /nfs/dbraw/zinc/12/20/67/1269122067.db2.gz BYKCFHCHJDLRFN-UHFFFAOYSA-N 1 3 346.519 2.593 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)[C@@H]1C ZINC001410874526 1269987987 /nfs/dbraw/zinc/98/79/87/1269987987.db2.gz YGFLYRLSQQIVEE-QAPCUYQASA-N 1 3 335.467 2.553 10 0 EFAEHO Cc1ccc(CN2CC[C@]3(NC(=O)CC[NH+](C)C)CCC[C@@H]23)cc1F ZINC001410883763 1270033811 /nfs/dbraw/zinc/03/38/11/1270033811.db2.gz AKHITBLSISWSMH-UYAOXDASSA-N 1 3 347.478 2.699 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@@H]([NH2+]C/C=C\c2ccccc2)C(C)(C)C1)N(C)C ZINC001410980643 1270533193 /nfs/dbraw/zinc/53/31/93/1270533193.db2.gz JOOUSBGHFVUOHC-FCVDOJIQSA-N 1 3 343.515 2.867 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2C[C@@H]([NH2+]C/C=C/Cl)C(C)(C)C2)c1 ZINC001411032334 1270732450 /nfs/dbraw/zinc/73/24/50/1270732450.db2.gz YYTASIZKVGJSHD-RCMYXZNBSA-N 1 3 349.906 2.941 10 0 EFAEHO CC[C@@H](F)C[NH+]1CCC([C@@H](C)NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001411234705 1272093956 /nfs/dbraw/zinc/09/39/56/1272093956.db2.gz LINITZAYWJRVDT-NVXWUHKLSA-N 1 3 343.531 2.929 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C2CC[NH+](Cc3ccsc3)CC2)CC1 ZINC001411254229 1272150605 /nfs/dbraw/zinc/15/06/05/1272150605.db2.gz HPXHVJDHQNKOJX-UHFFFAOYSA-N 1 3 349.544 2.949 10 0 EFAEHO Cc1cc([C@@H](N)CC(=O)NC[C@@H](CC(C)C)[NH+](C)C)cc(Cl)n1 ZINC000844168525 1278776605 /nfs/dbraw/zinc/77/66/05/1278776605.db2.gz FZGRAJUFVODLKZ-CABCVRRESA-N 1 3 340.899 2.526 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@]2(CC[N@H+](CCCCCF)C2)C1)N(C)C ZINC001671074735 1278845944 /nfs/dbraw/zinc/84/59/44/1278845944.db2.gz CSRCQDDEVQEGIJ-HKUYNNGSSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@]2(CC[N@@H+](CCCCCF)C2)C1)N(C)C ZINC001671074735 1278845951 /nfs/dbraw/zinc/84/59/51/1278845951.db2.gz CSRCQDDEVQEGIJ-HKUYNNGSSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[NH+](CC)CCO[C@@H]1CCN(C[C@H](O)c2ccc(F)cc2C)C1 ZINC000746674831 1275749782 /nfs/dbraw/zinc/74/97/82/1275749782.db2.gz KDCRSRBZPPGMKG-MJGOQNOKSA-N 1 3 338.467 2.600 10 0 EFAEHO C[C@H]([NH2+][C@H]1C[C@@H](N)c2ccccc21)[C@H](O)c1ccc2c(c1)OCO2 ZINC000817927137 1276360726 /nfs/dbraw/zinc/36/07/26/1276360726.db2.gz GWEVBFYISPJNAY-DPBKNMKXSA-N 1 3 326.396 2.572 10 0 EFAEHO CC[C@H](NCC[C@H]1CCC[NH2+]1)[C@H]1CCCN1C(=O)OC(C)(C)C ZINC000817967835 1276410867 /nfs/dbraw/zinc/41/08/67/1276410867.db2.gz CQPAFGCTQUIZMM-OWCLPIDISA-N 1 3 325.497 2.896 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@]1(O)CCCc2ccccc21 ZINC000817913140 1276374529 /nfs/dbraw/zinc/37/45/29/1276374529.db2.gz FOMUIJGZZZMUCU-XOBRGWDASA-N 1 3 325.456 2.723 10 0 EFAEHO O[C@H](CNCc1cccc(C[NH+]2CCCC2)c1)c1ccc(F)cn1 ZINC000818952969 1276557282 /nfs/dbraw/zinc/55/72/82/1276557282.db2.gz DVBDQMZARNNUDY-LJQANCHMSA-N 1 3 329.419 2.640 10 0 EFAEHO CC(C)[C@@](C)(C[NH3+])NC[C@H](O)COc1c(Cl)cccc1Cl ZINC000923296352 1277525091 /nfs/dbraw/zinc/52/50/91/1277525091.db2.gz QRZFGSBGWKFNGN-XHDPSFHLSA-N 1 3 335.275 2.696 10 0 EFAEHO [NH3+]CCCCCCN1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000846222204 1280075099 /nfs/dbraw/zinc/07/50/99/1280075099.db2.gz UEOYPVHZRQOJOC-UHFFFAOYSA-N 1 3 339.911 2.856 10 0 EFAEHO Cc1cc([C@H](N)CC(=O)NCCC[N@@H+](C)CC(C)C)cc(Cl)n1 ZINC000846685786 1280410576 /nfs/dbraw/zinc/41/05/76/1280410576.db2.gz GJVDLQXHGLRAJX-OAHLLOKOSA-N 1 3 340.899 2.527 10 0 EFAEHO Cc1cc([C@H](N)CC(=O)NCCC[N@H+](C)CC(C)C)cc(Cl)n1 ZINC000846685786 1280410581 /nfs/dbraw/zinc/41/05/81/1280410581.db2.gz GJVDLQXHGLRAJX-OAHLLOKOSA-N 1 3 340.899 2.527 10 0 EFAEHO C[N@H+](CCCOC(=O)C1CCN(C2CC2)CC1)Cc1ccccc1 ZINC000805895421 1280852773 /nfs/dbraw/zinc/85/27/73/1280852773.db2.gz QSEAWUXZCWSGNE-UHFFFAOYSA-N 1 3 330.472 2.926 10 0 EFAEHO C[N@@H+](CCCOC(=O)C1CCN(C2CC2)CC1)Cc1ccccc1 ZINC000805895421 1280852777 /nfs/dbraw/zinc/85/27/77/1280852777.db2.gz QSEAWUXZCWSGNE-UHFFFAOYSA-N 1 3 330.472 2.926 10 0 EFAEHO [NH3+][C@H](C[C@@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1 ZINC000872157611 1287453852 /nfs/dbraw/zinc/45/38/52/1287453852.db2.gz NUKUULWZVLUDCM-AZUAARDMSA-N 1 3 343.515 2.922 10 0 EFAEHO CC1CC[NH+](Cc2ccccc2CNC[C@H](O)CC(C)(C)O)CC1 ZINC000872200905 1287473416 /nfs/dbraw/zinc/47/34/16/1287473416.db2.gz MIBVEQUUVXCUDD-LJQANCHMSA-N 1 3 334.504 2.530 10 0 EFAEHO CC(C)OC[C@@H](O)C[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000872205741 1287475707 /nfs/dbraw/zinc/47/57/07/1287475707.db2.gz GVHAQAGZKPNTGJ-PLACYPQZSA-N 1 3 346.515 2.663 10 0 EFAEHO CC(C)OC[C@@H](O)C[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000872205743 1287476139 /nfs/dbraw/zinc/47/61/39/1287476139.db2.gz GVHAQAGZKPNTGJ-XSDIEEQYSA-N 1 3 346.515 2.663 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)[C@@]2(F)CC[N@@H+](C(C)(C)C)C2)N(C)C)cc1 ZINC000810243694 1283096477 /nfs/dbraw/zinc/09/64/77/1283096477.db2.gz JQIXIELNBOHPCN-YLJYHZDGSA-N 1 3 349.494 2.926 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)N(C)C)cc1 ZINC000810243694 1283096488 /nfs/dbraw/zinc/09/64/88/1283096488.db2.gz JQIXIELNBOHPCN-YLJYHZDGSA-N 1 3 349.494 2.926 10 0 EFAEHO CC[C@H]1CCCC[N@@H+]1CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810400536 1283190960 /nfs/dbraw/zinc/19/09/60/1283190960.db2.gz IEQDTYSZHZXAGZ-MAUKXSAKSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H]1CCCC[N@H+]1CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810400536 1283190963 /nfs/dbraw/zinc/19/09/63/1283190963.db2.gz IEQDTYSZHZXAGZ-MAUKXSAKSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC000810465053 1283238614 /nfs/dbraw/zinc/23/86/14/1283238614.db2.gz KJHBQNFUPHBCRY-GOSISDBHSA-N 1 3 329.504 2.824 10 0 EFAEHO CCN(CCC[NH+]1CCCC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000811398555 1284286687 /nfs/dbraw/zinc/28/66/87/1284286687.db2.gz HDBJPUJOHWHBFP-SFHVURJKSA-N 1 3 327.488 2.533 10 0 EFAEHO C[NH+](C)CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)c1ccccc1 ZINC000812949103 1285560596 /nfs/dbraw/zinc/56/05/96/1285560596.db2.gz NTLPOIOTHUXSJN-LJQANCHMSA-N 1 3 335.467 2.794 10 0 EFAEHO C[C@@H]1C[NH2+]C[C@H]1CN(C)CCCc1cc(-c2ccc(F)cc2)n(C)n1 ZINC000903432576 1312669979 /nfs/dbraw/zinc/66/99/79/1312669979.db2.gz FKQNEGOROBCYOX-WBVHZDCISA-N 1 3 344.478 2.946 10 0 EFAEHO C[C@@H]1C[NH2+]C[C@H]1CN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1 ZINC000903434848 1312673745 /nfs/dbraw/zinc/67/37/45/1312673745.db2.gz LTSXYCZASAGQAZ-BMFZPTHFSA-N 1 3 344.434 2.911 10 0 EFAEHO C[C@@H]1C[NH2+]C[C@H]1CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 ZINC000903435158 1312674739 /nfs/dbraw/zinc/67/47/39/1312674739.db2.gz PUEZPPPSHHQBJL-BMFZPTHFSA-N 1 3 344.434 2.911 10 0 EFAEHO CC[C@@H](C)[C@@H]1CN(Cc2ccc(C)nc2)CCN1C[C@@H]1C[NH2+]C[C@H]1C ZINC000903457555 1312711465 /nfs/dbraw/zinc/71/14/65/1312711465.db2.gz WXKLZZDIXCGQAA-JYWFKMLOSA-N 1 3 344.547 2.778 10 0 EFAEHO CN(CC(=O)N(C)[C@H](C[NH2+]C/C=C/Cl)C1CC1)CC(C)(C)C ZINC001277692460 1312747797 /nfs/dbraw/zinc/74/77/97/1312747797.db2.gz CIEODZADJPCWLB-RZIFZGNASA-N 1 3 329.916 2.543 10 0 EFAEHO C[C@@H]1CN(CC(=O)Nc2ccc(C(F)(F)F)cc2)C[C@H]1CC[NH3+] ZINC000903494686 1312768665 /nfs/dbraw/zinc/76/86/65/1312768665.db2.gz KREXAFPLCGCONR-VXGBXAGGSA-N 1 3 329.366 2.561 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)[C@@H](C)N1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903495291 1312769473 /nfs/dbraw/zinc/76/94/73/1312769473.db2.gz YXCSWKAFSQTOGN-JHJVBQTASA-N 1 3 339.867 2.592 10 0 EFAEHO C[C@H](C(=O)N[C@@H](C)c1cc2ccccc2o1)N1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903496330 1312770505 /nfs/dbraw/zinc/77/05/05/1312770505.db2.gz KNEMZQRWIKNIIL-JYYAWHABSA-N 1 3 343.471 2.915 10 0 EFAEHO C[C@@H](C(=O)Nc1ccccc1OC(F)F)N1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903496572 1312772099 /nfs/dbraw/zinc/77/20/99/1312772099.db2.gz SWOGUFGRCJGLOA-FRRDWIJNSA-N 1 3 341.402 2.532 10 0 EFAEHO C[C@@H]1CN(CCOc2ccccc2Br)C[C@H]1CC[NH3+] ZINC000903499110 1312776259 /nfs/dbraw/zinc/77/62/59/1312776259.db2.gz GGOMSPXPEYLONC-CHWSQXEVSA-N 1 3 327.266 2.745 10 0 EFAEHO C[C@H]1COCCN(CC(C[N@@H+]2CCOC[C@H](C)C2)C2CCCC2)C1 ZINC000878298032 1291610245 /nfs/dbraw/zinc/61/02/45/1291610245.db2.gz DYIXYGQOUKQZDQ-QZTJIDSGSA-N 1 3 338.536 2.729 10 0 EFAEHO C[C@H]1COCCN(CC(C[N@H+]2CCOC[C@H](C)C2)C2CCCC2)C1 ZINC000878298032 1291610255 /nfs/dbraw/zinc/61/02/55/1291610255.db2.gz DYIXYGQOUKQZDQ-QZTJIDSGSA-N 1 3 338.536 2.729 10 0 EFAEHO CCN(CC[NH2+]CC1CC(C)(C)C1)C(=O)CN(C)CC(C)(C)C ZINC001273610885 1292379726 /nfs/dbraw/zinc/37/97/26/1292379726.db2.gz RQVAROYITHJNPS-UHFFFAOYSA-N 1 3 325.541 2.839 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001276339811 1292948928 /nfs/dbraw/zinc/94/89/28/1292948928.db2.gz KGJQILVBZJGULD-QGZVFWFLSA-N 1 3 339.911 2.864 10 0 EFAEHO CCCCC[NH+]1CC([C@H](C)NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001276432502 1313058668 /nfs/dbraw/zinc/05/86/68/1313058668.db2.gz NLYWYJLCQBAKPS-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO CO[C@H](C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)[C@H]1CCOC1 ZINC000886634581 1295072930 /nfs/dbraw/zinc/07/29/30/1295072930.db2.gz HLOIMZHCOQQKBM-JRSUCEMESA-N 1 3 344.499 2.681 10 0 EFAEHO c1cc([C@@H]2CCCN2C[C@H]2CC3(CO2)CC[NH2+]CC3)cc2c1OCO2 ZINC000903729692 1313130220 /nfs/dbraw/zinc/13/02/20/1313130220.db2.gz QNFCJLZXPDVBBE-SJORKVTESA-N 1 3 344.455 2.711 10 0 EFAEHO C[C@H]([NH2+]C/C=C\CNC(=O)C1(N(C)C)CCC1)c1cccc(F)c1 ZINC001274089850 1295450860 /nfs/dbraw/zinc/45/08/60/1295450860.db2.gz SRISPKZAHQHNQR-XVWMLYKFSA-N 1 3 333.451 2.633 10 0 EFAEHO CC[C@H](C(=O)NC/C=C/C[NH2+][C@@H](C)c1cc(C)ccc1C)N(C)C ZINC001274125944 1295483249 /nfs/dbraw/zinc/48/32/49/1295483249.db2.gz VXWDJRBKBKSGJU-RNBODJDXSA-N 1 3 331.504 2.967 10 0 EFAEHO CC[C@H](C(=O)NC/C=C\C[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001274124713 1295485104 /nfs/dbraw/zinc/48/51/04/1295485104.db2.gz JIMREDKUUVOXES-JTGQJZMRSA-N 1 3 337.895 2.751 10 0 EFAEHO CSc1ccc([C@@H](CNC(=O)[C@@H](C)CC[NH+](C)C)N(C)C)cc1 ZINC001413002656 1296605413 /nfs/dbraw/zinc/60/54/13/1296605413.db2.gz LIASEXDKQSLHBY-WMLDXEAASA-N 1 3 337.533 2.715 10 0 EFAEHO CSc1ccc([C@@H](CNC(=O)[C@H](C)CC[NH+](C)C)N(C)C)cc1 ZINC001413002652 1296606169 /nfs/dbraw/zinc/60/61/69/1296606169.db2.gz LIASEXDKQSLHBY-RHSMWYFYSA-N 1 3 337.533 2.715 10 0 EFAEHO C[C@@H]1CN(C(C)(C)C[NH2+][C@@H]2CCNC[C@@H]2C2CCCC2)C[C@H](C)O1 ZINC000925516256 1296845165 /nfs/dbraw/zinc/84/51/65/1296845165.db2.gz RABHEBLPABABQW-UKBAYJJMSA-N 1 3 337.552 2.632 10 0 EFAEHO CC1(C)C[C@@H](N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H]([NH3+])C1 ZINC000925628438 1296864718 /nfs/dbraw/zinc/86/47/18/1296864718.db2.gz FXDAPXJHDQNEKI-FGTMMUONSA-N 1 3 329.488 2.673 10 0 EFAEHO CC1(C)C[C@H]([NH3+])C[C@@H](N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1 ZINC000925628440 1296865412 /nfs/dbraw/zinc/86/54/12/1296865412.db2.gz FXDAPXJHDQNEKI-KZNAEPCWSA-N 1 3 329.488 2.673 10 0 EFAEHO CO[C@@](C)(CO)CNC1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000926663495 1296947469 /nfs/dbraw/zinc/94/74/69/1296947469.db2.gz RKJBDZVTQYMQGI-RAFMOHDBSA-N 1 3 332.488 2.559 10 0 EFAEHO CO[C@@](C)(CO)CNC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000926663495 1296947482 /nfs/dbraw/zinc/94/74/82/1296947482.db2.gz RKJBDZVTQYMQGI-RAFMOHDBSA-N 1 3 332.488 2.559 10 0 EFAEHO Cc1noc([C@H]2OCC[C@H]2N[C@@H](C)c2cccc(C[NH+](C)C)c2)n1 ZINC000926776265 1296958217 /nfs/dbraw/zinc/95/82/17/1296958217.db2.gz JYONTVPKHQJTOZ-VUCTXSBTSA-N 1 3 330.432 2.620 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@@H]1C[NH2+][C@H]1CCOC12CCOCC2 ZINC000926776433 1296959769 /nfs/dbraw/zinc/95/97/69/1296959769.db2.gz AONYWCVWMMMGCV-HOJAQTOUSA-N 1 3 344.499 2.682 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN2CCCCC[C@@H]2c2ccncc2)cnn1C ZINC000903872862 1313325910 /nfs/dbraw/zinc/32/59/10/1313325910.db2.gz KIDBFKZCTVCLGS-YLJYHZDGSA-N 1 3 341.503 2.858 10 0 EFAEHO CN1CCC[C@H]1C(=O)NC/C=C/C[NH2+]Cc1cc2ccccc2s1 ZINC001273910997 1297120453 /nfs/dbraw/zinc/12/04/53/1297120453.db2.gz RLSXZNNCZHPBGL-BDUNBXCCSA-N 1 3 343.496 2.758 10 0 EFAEHO C[NH+]1CCC2(CCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)CC2)CC1 ZINC000931468594 1297340440 /nfs/dbraw/zinc/34/04/40/1297340440.db2.gz YRVYTYOWJDGZFQ-GFCCVEGCSA-N 1 3 344.368 2.743 10 0 EFAEHO C[NH+]1CCC2(CCN(C[C@](C)(O)C(F)(F)C(F)(F)F)CC2)CC1 ZINC000931468595 1297341090 /nfs/dbraw/zinc/34/10/90/1297341090.db2.gz YRVYTYOWJDGZFQ-LBPRGKRZSA-N 1 3 344.368 2.743 10 0 EFAEHO CC[C@@H]1Cc2ccccc2CN1C[C@@H](C[NH3+])Cc1cnn(C)c1C ZINC000903910591 1313397929 /nfs/dbraw/zinc/39/79/29/1313397929.db2.gz OJNQGOOBPSIESS-OXQOHEQNSA-N 1 3 326.488 2.683 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN[C@H]2CCc3c2cccc3Cl)cnn1C ZINC000903926480 1313428275 /nfs/dbraw/zinc/42/82/75/1313428275.db2.gz SQIOYQWQYULWRQ-UGSOOPFHSA-N 1 3 332.879 2.776 10 0 EFAEHO CCc1ccc(C(C)(C)C[NH2+]C[C@H](CN)Cc2cnn(C)c2C)cc1 ZINC000903927487 1313429988 /nfs/dbraw/zinc/42/99/88/1313429988.db2.gz YSPSBPNCGFLZPK-SFHVURJKSA-N 1 3 342.531 2.976 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN[C@H]2CCc3cc(Cl)ccc32)cnn1C ZINC000903934240 1313443313 /nfs/dbraw/zinc/44/33/13/1313443313.db2.gz FFMNTFVHONDEKN-UGSOOPFHSA-N 1 3 332.879 2.776 10 0 EFAEHO FC(F)(F)COc1ccc(C[NH2+]C[C@@H]2CNCCC2(F)F)cc1 ZINC000903955060 1313480802 /nfs/dbraw/zinc/48/08/02/1313480802.db2.gz JTUDJCYBYUQDCU-LBPRGKRZSA-N 1 3 338.320 2.962 10 0 EFAEHO COCC[C@H](Cc1cccc(F)c1)NC[C@@H]1C[NH2+]CCC1(F)F ZINC000903956147 1313485017 /nfs/dbraw/zinc/48/50/17/1313485017.db2.gz HZMKFUIODBLVSQ-GOEBONIOSA-N 1 3 330.394 2.608 10 0 EFAEHO C[C@@H](CC(=O)Nc1cccc(C(F)(F)F)c1)NC[C@@H]1C[NH2+]C[C@H]1C ZINC000903967751 1313510307 /nfs/dbraw/zinc/51/03/07/1313510307.db2.gz NICNDYBPYVWHMF-AGIUHOORSA-N 1 3 343.393 2.868 10 0 EFAEHO C[C@H](CCc1n[nH]c2ccccc21)N[C@@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903971713 1313518656 /nfs/dbraw/zinc/51/86/56/1313518656.db2.gz CFKUEGCFWSPAMH-CVEARBPZSA-N 1 3 342.487 2.632 10 0 EFAEHO C[C@@H](c1ccccc1F)N(C)CCCNC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001490196792 1298627372 /nfs/dbraw/zinc/62/73/72/1298627372.db2.gz RGMGHBCVXQPMEE-MAUKXSAKSA-N 1 3 347.478 2.667 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@H+](C)Cc1cc2ccccc2o1)N(C)C ZINC001490244776 1298671741 /nfs/dbraw/zinc/67/17/41/1298671741.db2.gz WHCYXTCUPISJHX-LJQANCHMSA-N 1 3 345.487 2.957 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@@H+](C)Cc1cc2ccccc2o1)N(C)C ZINC001490244776 1298671752 /nfs/dbraw/zinc/67/17/52/1298671752.db2.gz WHCYXTCUPISJHX-LJQANCHMSA-N 1 3 345.487 2.957 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@H+](C)CCCNC(=O)CN1CC[C@@H](C)C1 ZINC001490250612 1298677387 /nfs/dbraw/zinc/67/73/87/1298677387.db2.gz NAWJLGNCLAXBOV-AEFFLSMTSA-N 1 3 331.504 2.836 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@@H+](C)CCCNC(=O)CN1CC[C@@H](C)C1 ZINC001490250612 1298677396 /nfs/dbraw/zinc/67/73/96/1298677396.db2.gz NAWJLGNCLAXBOV-AEFFLSMTSA-N 1 3 331.504 2.836 10 0 EFAEHO Cc1ncccc1CN(C)CCCNC(=O)[C@H]1CCCC[N@H+]1C(C)C ZINC001490256694 1298687077 /nfs/dbraw/zinc/68/70/77/1298687077.db2.gz UFRZFZBTKFGBJA-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1ncccc1CN(C)CCCNC(=O)[C@H]1CCCC[N@@H+]1C(C)C ZINC001490256694 1298687087 /nfs/dbraw/zinc/68/70/87/1298687087.db2.gz UFRZFZBTKFGBJA-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[N@H+](CCCNC(=O)Cc1nc[nH]c1C)C[C@@H]1CCC(F)(F)C1 ZINC001490358357 1298840010 /nfs/dbraw/zinc/84/00/10/1298840010.db2.gz VYFMOBARTILJJE-CQSZACIVSA-N 1 3 342.434 2.524 10 0 EFAEHO CC[N@@H+](CCCNC(=O)Cc1nc[nH]c1C)C[C@@H]1CCC(F)(F)C1 ZINC001490358357 1298840026 /nfs/dbraw/zinc/84/00/26/1298840026.db2.gz VYFMOBARTILJJE-CQSZACIVSA-N 1 3 342.434 2.524 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C1CC[NH+](CCCCCF)CC1)N(C)C ZINC001490420707 1298899032 /nfs/dbraw/zinc/89/90/32/1298899032.db2.gz CSRHGFYATBSFMC-QGZVFWFLSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1ccc(F)cc1)C1CC1 ZINC001490660285 1299100906 /nfs/dbraw/zinc/10/09/06/1299100906.db2.gz FXTWZGRTHPXJKO-RBUKOAKNSA-N 1 3 347.478 2.683 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]([NH2+]CC2CCCCCC2)C2CC2)C1 ZINC001490710929 1299119806 /nfs/dbraw/zinc/11/98/06/1299119806.db2.gz VXINBSUCBGVFCF-QFBILLFUSA-N 1 3 335.536 2.783 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H]([NH2+]CCC(F)(F)F)C1CC1 ZINC001490718377 1299127630 /nfs/dbraw/zinc/12/76/30/1299127630.db2.gz SHXLHXWBRHFORN-LSDHHAIUSA-N 1 3 349.441 2.686 10 0 EFAEHO CC(C)(C(=O)NC[C@H]([NH2+]CC1=CCCCC1)C1CC1)N1CCCC1 ZINC001490695437 1299149645 /nfs/dbraw/zinc/14/96/45/1299149645.db2.gz WMGPOTYEISWWGQ-SFHVURJKSA-N 1 3 333.520 2.846 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N1CCC[C@H](CN(C)C/C=C\Cl)C1 ZINC001490758740 1299198109 /nfs/dbraw/zinc/19/81/09/1299198109.db2.gz MCOIORCJZPLOCT-REEAJDFCSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N1CCC[C@H](CN(C)C/C=C\Cl)C1 ZINC001490758740 1299198112 /nfs/dbraw/zinc/19/81/12/1299198112.db2.gz MCOIORCJZPLOCT-REEAJDFCSA-N 1 3 341.927 2.782 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001490773083 1299226505 /nfs/dbraw/zinc/22/65/05/1299226505.db2.gz BKANVMCHKBJIGQ-ZWKOTPCHSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001490773083 1299226513 /nfs/dbraw/zinc/22/65/13/1299226513.db2.gz BKANVMCHKBJIGQ-ZWKOTPCHSA-N 1 3 341.515 2.637 10 0 EFAEHO CCOP(=O)(OCC)[C@@H](O)CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000851777788 1299388243 /nfs/dbraw/zinc/38/82/43/1299388243.db2.gz BVWOQUZEOHOCRB-HZPDHXFCSA-N 1 3 348.424 2.521 10 0 EFAEHO COc1ccc([C@H](C)NCC[C@@H]([NH3+])C(C)C)cc1Cn1cccn1 ZINC000854230811 1300480177 /nfs/dbraw/zinc/48/01/77/1300480177.db2.gz ZFPCDAUEWOSSKD-MAUKXSAKSA-N 1 3 330.476 2.964 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)/C=C\c1ccc2[nH]ccc2c1 ZINC000855345831 1300923986 /nfs/dbraw/zinc/92/39/86/1300923986.db2.gz IAMWEROXDUOSBW-GQSKFBFOSA-N 1 3 342.487 2.569 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)/C=C\c1ccc2[nH]ccc2c1 ZINC000855345831 1300923997 /nfs/dbraw/zinc/92/39/97/1300923997.db2.gz IAMWEROXDUOSBW-GQSKFBFOSA-N 1 3 342.487 2.569 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)/C=C/c1ccc2[nH]ccc2c1 ZINC000855345766 1300924742 /nfs/dbraw/zinc/92/47/42/1300924742.db2.gz IAMWEROXDUOSBW-DYLHUKMJSA-N 1 3 342.487 2.569 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)/C=C/c1ccc2[nH]ccc2c1 ZINC000855345766 1300924745 /nfs/dbraw/zinc/92/47/45/1300924745.db2.gz IAMWEROXDUOSBW-DYLHUKMJSA-N 1 3 342.487 2.569 10 0 EFAEHO CN1CCCC[C@H](C[NH2+]C[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)C1 ZINC000862483842 1302396419 /nfs/dbraw/zinc/39/64/19/1302396419.db2.gz ZHUPGYAVCSBSBJ-VQIMIIECSA-N 1 3 339.524 2.955 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N1CCC(N2C(=O)O[C@H]3C[NH2+]C[C@H]32)CC1 ZINC000863549407 1302647519 /nfs/dbraw/zinc/64/75/19/1302647519.db2.gz IWRFXTAIKTVTDH-KURKYZTESA-N 1 3 347.434 2.534 10 0 EFAEHO C[C@H]1CN(CCCC[NH2+]Cc2cnc(Cl)c(F)c2)C[C@H](C)O1 ZINC000865472315 1303272603 /nfs/dbraw/zinc/27/26/03/1303272603.db2.gz XZWCMJAOIWXEON-STQMWFEESA-N 1 3 329.847 2.853 10 0 EFAEHO Cn1cc(CNCC2(c3ccccc3)CC[NH+](C)CC2)c(Cl)n1 ZINC000865775481 1303395501 /nfs/dbraw/zinc/39/55/01/1303395501.db2.gz WMELBIRCLZKVDQ-UHFFFAOYSA-N 1 3 332.879 2.827 10 0 EFAEHO O=c1[nH]c2c(cc1C[NH2+]Cc1ccnn1-c1ccncc1)CCCC2 ZINC000865878636 1303436559 /nfs/dbraw/zinc/43/65/59/1303436559.db2.gz UZFFAURDIDICJL-UHFFFAOYSA-N 1 3 335.411 2.537 10 0 EFAEHO CC(=O)NCC1CCC([NH2+][C@@H](C)[C@H]2CCCN(C3CCC3)C2)CC1 ZINC000866335554 1303606572 /nfs/dbraw/zinc/60/65/72/1303606572.db2.gz BKHNQKCWQHNORE-BARLLCKDSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[NH+]1CCC(N[C@@H]2COc3cccc(Br)c3C2)CC1 ZINC000866594152 1303702819 /nfs/dbraw/zinc/70/28/19/1303702819.db2.gz AVJGYTVEQGVAAE-ZDUSSCGKSA-N 1 3 339.277 2.827 10 0 EFAEHO CC(C)c1ccc([C@@H](C)N2CC[C@@H](N3C(=O)O[C@H]4C[NH2+]C[C@H]43)C2)cc1 ZINC000866712170 1303761812 /nfs/dbraw/zinc/76/18/12/1303761812.db2.gz RIHPXTLAHNESFX-AXUOBQJMSA-N 1 3 343.471 2.738 10 0 EFAEHO CC1(C)[C@@H](N)c2ccccc2N1C(=O)[C@@H](C[NH3+])c1ccc(F)cc1 ZINC000867988603 1304061906 /nfs/dbraw/zinc/06/19/06/1304061906.db2.gz PPMRIYVNHHAZJY-RDJZCZTQSA-N 1 3 327.403 2.693 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2c3ccc(C)cc3[C@H]3CN(C)CC[C@H]32)CC[N@@H+]1C ZINC000868435801 1304296203 /nfs/dbraw/zinc/29/62/03/1304296203.db2.gz VFJMTUASWSMFKG-ZCDKGFTFSA-N 1 3 341.499 2.860 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2c3ccc(C)cc3[C@H]3CN(C)CC[C@H]32)CC[N@H+]1C ZINC000868435801 1304296209 /nfs/dbraw/zinc/29/62/09/1304296209.db2.gz VFJMTUASWSMFKG-ZCDKGFTFSA-N 1 3 341.499 2.860 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CCCc2ccc(C)cc2)[C@H]1C ZINC001278317296 1314056382 /nfs/dbraw/zinc/05/63/82/1314056382.db2.gz YSXNQBSXHBNGJP-QUCCMNQESA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)CCC12CC(C1)C[NH2+]2 ZINC000870891628 1305661211 /nfs/dbraw/zinc/66/12/11/1305661211.db2.gz IFUJJOFKDAXZNC-OCDPCBSRSA-N 1 3 341.499 2.642 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001413085930 1307650377 /nfs/dbraw/zinc/65/03/77/1307650377.db2.gz WVAJCHBFWXBBRQ-IRXDYDNUSA-N 1 3 337.533 2.759 10 0 EFAEHO O=C(c1ccc(NC2=NCCC2)cc1)N1CC[C@H]([NH+]2CCCCC2)C1 ZINC000900624441 1308427152 /nfs/dbraw/zinc/42/71/52/1308427152.db2.gz KSEIMMHDCAJRJD-SFHVURJKSA-N 1 3 340.471 2.991 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900958933 1309040483 /nfs/dbraw/zinc/04/04/83/1309040483.db2.gz NBJPOVIWYMEGNY-IRXDYDNUSA-N 1 3 328.460 2.893 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)CC(C)(C)CC(F)(F)F ZINC001413267277 1309218905 /nfs/dbraw/zinc/21/89/05/1309218905.db2.gz LUWZWQUMZWNJLY-ZDUSSCGKSA-N 1 3 339.446 2.743 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)CC(C)(C)CC(F)(F)F ZINC001413267277 1309218913 /nfs/dbraw/zinc/21/89/13/1309218913.db2.gz LUWZWQUMZWNJLY-ZDUSSCGKSA-N 1 3 339.446 2.743 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@H](CNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000901022232 1309215966 /nfs/dbraw/zinc/21/59/66/1309215966.db2.gz GNJUPGRXDPSEDV-MRXNPFEDSA-N 1 3 342.487 2.999 10 0 EFAEHO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000901022232 1309215969 /nfs/dbraw/zinc/21/59/69/1309215969.db2.gz GNJUPGRXDPSEDV-MRXNPFEDSA-N 1 3 342.487 2.999 10 0 EFAEHO C[NH+]1CCC2(CCCN2C(=O)c2ccc(NC3=NCCC3)cc2)CC1 ZINC000901284325 1310048867 /nfs/dbraw/zinc/04/88/67/1310048867.db2.gz APEOKQYTTWEZBR-UHFFFAOYSA-N 1 3 340.471 2.991 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCCC[C@@H]1C[NH2+]CCC(F)(F)F ZINC001491270919 1311183345 /nfs/dbraw/zinc/18/33/45/1311183345.db2.gz KKXXIPWYLOOSRK-HUUCEWRRSA-N 1 3 349.441 2.784 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NC[C@H]1CCN1CCC1=CCCCC1 ZINC001276977610 1311403065 /nfs/dbraw/zinc/40/30/65/1311403065.db2.gz IXSOMTXASYFXCD-LJQANCHMSA-N 1 3 333.520 2.943 10 0 EFAEHO CN(C)C1(C(=O)N2C[C@H]([NH2+]CCCC3CCC3)C(C)(C)C2)CCC1 ZINC001284292187 1320306703 /nfs/dbraw/zinc/30/67/03/1320306703.db2.gz QADUIIIHYYFFOJ-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]CC/C=C/c3ccccc3)CC2)CCC1 ZINC001277080428 1311585470 /nfs/dbraw/zinc/58/54/70/1311585470.db2.gz SFTNZFQVGIIVMG-IZZDOVSWSA-N 1 3 341.499 2.813 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[N@H+](C)CCC2=CCCCC2)C1 ZINC001280857423 1311849130 /nfs/dbraw/zinc/84/91/30/1311849130.db2.gz RHKNPFIARYINQN-GOSISDBHSA-N 1 3 335.536 2.999 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[N@@H+](C)CCC2=CCCCC2)C1 ZINC001280857423 1311849134 /nfs/dbraw/zinc/84/91/34/1311849134.db2.gz RHKNPFIARYINQN-GOSISDBHSA-N 1 3 335.536 2.999 10 0 EFAEHO CC/C=C\CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)CN1CCCC1 ZINC001277324468 1311989733 /nfs/dbraw/zinc/98/97/33/1311989733.db2.gz OIZTZHHBNSCFQQ-PYZJBXCLSA-N 1 3 333.520 2.940 10 0 EFAEHO c1ccc(CCN2CC[C@H](C[NH2+][C@H]3CC[C@@H]4[C@H]5OCC[C@H]5[C@@H]43)C2)cc1 ZINC000902790397 1312109918 /nfs/dbraw/zinc/10/99/18/1312109918.db2.gz QGHTUULUTQHTPA-HZQJRTDASA-N 1 3 340.511 2.954 10 0 EFAEHO CCCn1cc([C@@H](C)NCC2CC[NH+](Cc3ccncc3)CC2)nn1 ZINC000903050064 1312310680 /nfs/dbraw/zinc/31/06/80/1312310680.db2.gz OXOWFQUJMFOUBA-MRXNPFEDSA-N 1 3 342.491 2.646 10 0 EFAEHO NC(=O)CC1CC([NH2+][C@@H]2CCC[C@H]3CN(Cc4ccccc4)C[C@@H]32)C1 ZINC000903258928 1312514244 /nfs/dbraw/zinc/51/42/44/1312514244.db2.gz DJFXFDOEQFYBAA-KPZODNFCSA-N 1 3 341.499 2.531 10 0 EFAEHO CCN(CC)Cc1cc([C@@H](C)[NH2+]C2CC(CC(N)=O)C2)ccc1OC ZINC000903258961 1312514278 /nfs/dbraw/zinc/51/42/78/1312514278.db2.gz FJVBZYDMUABNIR-KSTDHSDQSA-N 1 3 347.503 2.842 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)cc1 ZINC001278425056 1314563822 /nfs/dbraw/zinc/56/38/22/1314563822.db2.gz YWACRNDOMFZGAR-AZUAARDMSA-N 1 3 345.531 2.847 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@H](NC(=O)[C@@H](C(C)C)N1CCCCC1)C1CC1 ZINC001276711247 1314690636 /nfs/dbraw/zinc/69/06/36/1314690636.db2.gz GWOPLUWGLFDEFJ-RTBURBONSA-N 1 3 335.536 2.948 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN3CCC(C)CC3)C[C@@H]21 ZINC001278487258 1314790997 /nfs/dbraw/zinc/79/09/97/1314790997.db2.gz NBBNVYQHNIISPY-HSALFYBXSA-N 1 3 347.547 2.901 10 0 EFAEHO Cc1cc(C)cc(CN2CC[C@H](NC(=O)CCCC[NH+](C)C)C2)c1 ZINC001318299915 1328549581 /nfs/dbraw/zinc/54/95/81/1328549581.db2.gz NUIDJDFOJQHEOC-IBGZPJMESA-N 1 3 331.504 2.726 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001318301170 1328549858 /nfs/dbraw/zinc/54/98/58/1328549858.db2.gz OCNHKSROQVPIRN-UEKDZROGSA-N 1 3 329.488 2.909 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001318301170 1328549865 /nfs/dbraw/zinc/54/98/65/1328549865.db2.gz OCNHKSROQVPIRN-UEKDZROGSA-N 1 3 329.488 2.909 10 0 EFAEHO CCc1cccc(CN2CC[C@@H](NC(=O)CCCC[NH+](C)C)C2)c1 ZINC001318365873 1328564886 /nfs/dbraw/zinc/56/48/86/1328564886.db2.gz NRIQJUZBGSUIRW-LJQANCHMSA-N 1 3 331.504 2.671 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@@H](C[NH2+]CC=C(Cl)Cl)C2)CCC1 ZINC001278565938 1315206016 /nfs/dbraw/zinc/20/60/16/1315206016.db2.gz RRWPZYWEWTZEFV-OLZOCXBDSA-N 1 3 348.318 2.664 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@@H](C[NH2+]CC=C(Cl)Cl)C2)CCC1 ZINC001278565936 1315206235 /nfs/dbraw/zinc/20/62/35/1315206235.db2.gz RRWPZYWEWTZEFV-CHWSQXEVSA-N 1 3 348.318 2.664 10 0 EFAEHO CN(C(=O)C(C)(C)N1CCCC1)[C@@H]1CC[N@H+](CCCCCF)C1 ZINC001318423587 1328585250 /nfs/dbraw/zinc/58/52/50/1328585250.db2.gz MEUTYOQOSVXRDC-MRXNPFEDSA-N 1 3 327.488 2.533 10 0 EFAEHO CN(C(=O)C(C)(C)N1CCCC1)[C@@H]1CC[N@@H+](CCCCCF)C1 ZINC001318423587 1328585254 /nfs/dbraw/zinc/58/52/54/1328585254.db2.gz MEUTYOQOSVXRDC-MRXNPFEDSA-N 1 3 327.488 2.533 10 0 EFAEHO CC(C)CN1CCC([NH2+]C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1 ZINC000378882582 1316527394 /nfs/dbraw/zinc/52/73/94/1316527394.db2.gz ITLNXHOPUPXOPG-INIZCTEOSA-N 1 3 339.524 2.953 10 0 EFAEHO CC[NH2+]CC[C@H]1[C@H](C)CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001264521302 1316628441 /nfs/dbraw/zinc/62/84/41/1316628441.db2.gz XVEZXNLTXDPBJK-APWZRJJASA-N 1 3 331.504 2.989 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H](C)[C@H]2CCC[NH2+]CC2CC2)C1 ZINC001264575997 1316633673 /nfs/dbraw/zinc/63/36/73/1316633673.db2.gz CLOJPQXFVARDPY-ZHALLVOQSA-N 1 3 335.536 2.735 10 0 EFAEHO CC1CC(C[NH2+]CCC[C@@H]2[C@H](C)CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001264578342 1316633944 /nfs/dbraw/zinc/63/39/44/1316633944.db2.gz VZZGYJCKKZSFHS-MPLMCADHSA-N 1 3 346.519 2.995 10 0 EFAEHO C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@@H]1CCC[NH2+]C/C=C/Cl ZINC001264578108 1316633982 /nfs/dbraw/zinc/63/39/82/1316633982.db2.gz RKGDVVVUOMCDDS-JWLFTQPQSA-N 1 3 338.883 2.702 10 0 EFAEHO CC[C@@H](C(=O)N1CCCCC[C@@H]([NH2+]CCCCCF)C1)N(C)C ZINC001264683981 1316655728 /nfs/dbraw/zinc/65/57/28/1316655728.db2.gz PINJJFCTZVCKLJ-SJORKVTESA-N 1 3 329.504 2.827 10 0 EFAEHO Cc1cc(C[N@@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)c(C)s1 ZINC001265037279 1316697221 /nfs/dbraw/zinc/69/72/21/1316697221.db2.gz UASBXPLRVSVLTH-AWEZNQCLSA-N 1 3 337.533 2.645 10 0 EFAEHO Cc1cc(C[N@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)c(C)s1 ZINC001265037279 1316697223 /nfs/dbraw/zinc/69/72/23/1316697223.db2.gz UASBXPLRVSVLTH-AWEZNQCLSA-N 1 3 337.533 2.645 10 0 EFAEHO C[C@H]([NH2+]CCCC1CCC1)[C@H]1CCCCN1C(=O)Cc1c[nH]cn1 ZINC001265088209 1316717000 /nfs/dbraw/zinc/71/70/00/1316717000.db2.gz AUFHOSKDJCNJGQ-MAUKXSAKSA-N 1 3 332.492 2.892 10 0 EFAEHO C[C@@H](NCc1ccccn1)[C@@H]1CCCCN1C(=O)CCCC[NH+](C)C ZINC001265092922 1316719029 /nfs/dbraw/zinc/71/90/29/1316719029.db2.gz WPTJYXBRSIBREV-MJGOQNOKSA-N 1 3 346.519 2.673 10 0 EFAEHO C[C@H](NCc1ccccn1)[C@@H]1CCCCN1C(=O)CCCC[NH+](C)C ZINC001265092918 1316719098 /nfs/dbraw/zinc/71/90/98/1316719098.db2.gz WPTJYXBRSIBREV-HKUYNNGSSA-N 1 3 346.519 2.673 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001265137295 1316733635 /nfs/dbraw/zinc/73/36/35/1316733635.db2.gz QXIADFGPAWYSHJ-UXTFUVQESA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001265137295 1316733636 /nfs/dbraw/zinc/73/36/36/1316733636.db2.gz QXIADFGPAWYSHJ-UXTFUVQESA-N 1 3 327.900 2.584 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CC1=CCCCC1)C1CC1 ZINC001265358552 1316789477 /nfs/dbraw/zinc/78/94/77/1316789477.db2.gz LORSFFGKKBZVIU-MOPGFXCFSA-N 1 3 333.520 2.846 10 0 EFAEHO CCCCC[N@H+](C)C[C@H]1CCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001265390760 1316796002 /nfs/dbraw/zinc/79/60/02/1316796002.db2.gz MRZWCRJIOGAMLC-MSOLQXFVSA-N 1 3 325.541 2.933 10 0 EFAEHO CCCCC[N@@H+](C)C[C@H]1CCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001265390760 1316796004 /nfs/dbraw/zinc/79/60/04/1316796004.db2.gz MRZWCRJIOGAMLC-MSOLQXFVSA-N 1 3 325.541 2.933 10 0 EFAEHO CCC[NH2+]CC1(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CCCC1 ZINC001318655164 1328662241 /nfs/dbraw/zinc/66/22/41/1328662241.db2.gz WKNIOEBRVWSFOP-GOSISDBHSA-N 1 3 327.488 2.628 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1C[NH2+]CCc1ccccc1F ZINC001265689809 1316854970 /nfs/dbraw/zinc/85/49/70/1316854970.db2.gz LFLCXRXJIDWBQB-GOSISDBHSA-N 1 3 349.494 2.681 10 0 EFAEHO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)CCCNC(=O)[C@@H]1CCCN1C ZINC001265815226 1316882255 /nfs/dbraw/zinc/88/22/55/1316882255.db2.gz SLPSFBOLLGBOIB-DYVFJYSZSA-N 1 3 339.430 2.558 10 0 EFAEHO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)CCCNC(=O)[C@@H]1CCCN1C ZINC001265815226 1316882256 /nfs/dbraw/zinc/88/22/56/1316882256.db2.gz SLPSFBOLLGBOIB-DYVFJYSZSA-N 1 3 339.430 2.558 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N1CC[C@H](NCc2cccc(F)c2)C1 ZINC001265949661 1316925848 /nfs/dbraw/zinc/92/58/48/1316925848.db2.gz XVNPYYSPWNHGET-IBGZPJMESA-N 1 3 347.478 2.782 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001266015702 1316954485 /nfs/dbraw/zinc/95/44/85/1316954485.db2.gz JRXFVXDMEWOEEU-APWZRJJASA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001266029618 1316961350 /nfs/dbraw/zinc/96/13/50/1316961350.db2.gz UVYWRWQWXAQWJW-IEJDHCNXSA-N 1 3 343.515 2.724 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCc1ccc(CC[NH2+]CCF)cc1 ZINC001266086457 1317013820 /nfs/dbraw/zinc/01/38/20/1317013820.db2.gz ONRVYZOXNVRBPT-LJQANCHMSA-N 1 3 349.494 2.667 10 0 EFAEHO CC[C@H](C(=O)N[C@@](C)(C[NH2+]CC=C(Cl)Cl)C1CC1)N(C)C ZINC001318726750 1328677939 /nfs/dbraw/zinc/67/79/39/1328677939.db2.gz BJOCENODTPXIGY-DOMZBBRYSA-N 1 3 336.307 2.520 10 0 EFAEHO CC[C@H](C(=O)N[C@](C)(C[NH2+]CC=C(Cl)Cl)C1CC1)N(C)C ZINC001318726755 1328678488 /nfs/dbraw/zinc/67/84/88/1328678488.db2.gz BJOCENODTPXIGY-IUODEOHRSA-N 1 3 336.307 2.520 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@H]1CCC[N@@H+]1CC1CC(F)(F)C1)N(C)C ZINC001266242155 1317191662 /nfs/dbraw/zinc/19/16/62/1317191662.db2.gz ZVCDRIIIACAIRT-HOTGVXAUSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@H]1CCC[N@H+]1CC1CC(F)(F)C1)N(C)C ZINC001266242155 1317191663 /nfs/dbraw/zinc/19/16/63/1317191663.db2.gz ZVCDRIIIACAIRT-HOTGVXAUSA-N 1 3 345.478 2.733 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@H+](CC2CC3(CCC3)C2)CC1)C1CCC1 ZINC001279574937 1317306724 /nfs/dbraw/zinc/30/67/24/1317306724.db2.gz XARUAUKWJZHFBT-UHFFFAOYSA-N 1 3 345.531 2.799 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@@H+](CC2CC3(CCC3)C2)CC1)C1CCC1 ZINC001279574937 1317306732 /nfs/dbraw/zinc/30/67/32/1317306732.db2.gz XARUAUKWJZHFBT-UHFFFAOYSA-N 1 3 345.531 2.799 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1=CC[N@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001279676300 1317356334 /nfs/dbraw/zinc/35/63/34/1317356334.db2.gz ZCSNDPNJDWAMSB-IBGZPJMESA-N 1 3 347.547 2.901 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1=CC[N@@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001279676300 1317356344 /nfs/dbraw/zinc/35/63/44/1317356344.db2.gz ZCSNDPNJDWAMSB-IBGZPJMESA-N 1 3 347.547 2.901 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H](CC[NH2+]CC2CCCC2)C1)N(C)C ZINC001318848291 1328721132 /nfs/dbraw/zinc/72/11/32/1328721132.db2.gz DYZLDSZUOZNDNI-RBUKOAKNSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](F)CC[NH2+]Cc1ccc(CNC(=O)C2(N(C)C)CCC2)cc1 ZINC001318995867 1328759086 /nfs/dbraw/zinc/75/90/86/1328759086.db2.gz JLWUXILQYDRUJA-OAHLLOKOSA-N 1 3 335.467 2.625 10 0 EFAEHO Cc1ccc(CC[NH2+]CC2CC(NC(=O)C3(N(C)C)CCC3)C2)cc1 ZINC001282014930 1318664003 /nfs/dbraw/zinc/66/40/03/1318664003.db2.gz PQKMFRNWMYVIRD-UHFFFAOYSA-N 1 3 343.515 2.506 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001282013694 1318664269 /nfs/dbraw/zinc/66/42/69/1318664269.db2.gz IYTCZAVQTBJFGA-OFFRRBJUSA-N 1 3 329.488 2.524 10 0 EFAEHO CC(C)(C(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl)[NH+]1CCCC1 ZINC001319105049 1328780687 /nfs/dbraw/zinc/78/06/87/1328780687.db2.gz YLIFQKBTDLYVPL-CYBMUJFWSA-N 1 3 348.318 2.760 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@@H]2C[NH2+]CCc2cccs2)CC1 ZINC001319117891 1328783172 /nfs/dbraw/zinc/78/31/72/1328783172.db2.gz CHDCUKQMKXPBAD-QGZVFWFLSA-N 1 3 349.544 2.603 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@@H]2C(CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001282858204 1319165722 /nfs/dbraw/zinc/16/57/22/1319165722.db2.gz HXZDXPKEJCPYGF-QRCQGXBMSA-N 1 3 347.547 2.901 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@@H]2C(CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001282858204 1319165730 /nfs/dbraw/zinc/16/57/30/1319165730.db2.gz HXZDXPKEJCPYGF-QRCQGXBMSA-N 1 3 347.547 2.901 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3=CCCCC3)C[C@H]21)N(C)C ZINC001282871932 1319178135 /nfs/dbraw/zinc/17/81/35/1319178135.db2.gz NCGWFENAJKPGFY-AKHDSKFASA-N 1 3 333.520 2.511 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3=CCCCC3)C[C@H]21)N(C)C ZINC001282871932 1319178138 /nfs/dbraw/zinc/17/81/38/1319178138.db2.gz NCGWFENAJKPGFY-AKHDSKFASA-N 1 3 333.520 2.511 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CCCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001282973324 1319230830 /nfs/dbraw/zinc/23/08/30/1319230830.db2.gz SYACRKJKTHHRJF-VOFKWLDRSA-N 1 3 347.547 2.999 10 0 EFAEHO CCC/C=C\CC[N@H+]1CCCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001282973324 1319230837 /nfs/dbraw/zinc/23/08/37/1319230837.db2.gz SYACRKJKTHHRJF-VOFKWLDRSA-N 1 3 347.547 2.999 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CCCC2CCC2)C1 ZINC001283040780 1319280145 /nfs/dbraw/zinc/28/01/45/1319280145.db2.gz GFTNQRMUBUSKCH-FHWLQOOXSA-N 1 3 335.536 2.924 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@@]12CCC[C@H]1N(CCC(F)(F)F)CC2 ZINC001284068272 1320176686 /nfs/dbraw/zinc/17/66/86/1320176686.db2.gz DXQHEKPYBNURRD-GDBMZVCRSA-N 1 3 349.441 2.784 10 0 EFAEHO CCC/C=C\CC[NH+]1CC2(C1)CCN(C(=O)[C@H](CC)N(C)C)CC2 ZINC001319405769 1328875333 /nfs/dbraw/zinc/87/53/33/1328875333.db2.gz ZPRXHYOQPBQTJE-GIFJBRJJSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCCC[NH2+][C@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001284322811 1320319495 /nfs/dbraw/zinc/31/94/95/1320319495.db2.gz JLVONXUYPYFODB-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO CN(C(=O)CCCC[NH+](C)C)C1CC(NCc2ccccc2F)C1 ZINC001284816684 1320548349 /nfs/dbraw/zinc/54/83/49/1320548349.db2.gz XKJVQCDTCFNHGQ-UHFFFAOYSA-N 1 3 335.467 2.637 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NCC1=CC[N@H+](Cc2ccccc2)CC1 ZINC001284920160 1320596754 /nfs/dbraw/zinc/59/67/54/1320596754.db2.gz ALVBDKQAEUFTRV-IBGZPJMESA-N 1 3 347.478 2.615 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NCC1=CC[N@@H+](Cc2ccccc2)CC1 ZINC001284920160 1320596760 /nfs/dbraw/zinc/59/67/60/1320596760.db2.gz ALVBDKQAEUFTRV-IBGZPJMESA-N 1 3 347.478 2.615 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC=C(CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001284958448 1320617680 /nfs/dbraw/zinc/61/76/80/1320617680.db2.gz XAXVKRDNNQPSEC-QGZVFWFLSA-N 1 3 341.499 2.585 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC=C(CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001284958448 1320617686 /nfs/dbraw/zinc/61/76/86/1320617686.db2.gz XAXVKRDNNQPSEC-QGZVFWFLSA-N 1 3 341.499 2.585 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC=C(CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001284958439 1320618331 /nfs/dbraw/zinc/61/83/31/1320618331.db2.gz XAXVKRDNNQPSEC-KRWDZBQOSA-N 1 3 341.499 2.585 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC=C(CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001284958439 1320618337 /nfs/dbraw/zinc/61/83/37/1320618337.db2.gz XAXVKRDNNQPSEC-KRWDZBQOSA-N 1 3 341.499 2.585 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC=C(CNC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001284976689 1320626117 /nfs/dbraw/zinc/62/61/17/1320626117.db2.gz MNTFNPGPFHYYDT-HXUWFJFHSA-N 1 3 343.515 2.830 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC=C(CNC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001284976689 1320626121 /nfs/dbraw/zinc/62/61/21/1320626121.db2.gz MNTFNPGPFHYYDT-HXUWFJFHSA-N 1 3 343.515 2.830 10 0 EFAEHO CC(C)C[C@H](C[NH2+]CC1=CCCCC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001319635732 1328934952 /nfs/dbraw/zinc/93/49/52/1328934952.db2.gz YYWDPCJZLCXKIY-IEBWSBKVSA-N 1 3 335.536 2.949 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C[NH2+]C/C=C/Cl)C1CCCCC1)N(C)C ZINC001319659773 1328941150 /nfs/dbraw/zinc/94/11/50/1328941150.db2.gz NIRSLQFLSQVCOG-RYRVOACTSA-N 1 3 329.916 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C[NH2+]C/C=C/Cl)C1CCCCC1)N(C)C ZINC001319658331 1328941443 /nfs/dbraw/zinc/94/14/43/1328941443.db2.gz YFHDVFRSCLDKHM-MXDRFRHJSA-N 1 3 343.943 2.980 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1CC[NH2+]Cc1ccccc1 ZINC001319788422 1328989501 /nfs/dbraw/zinc/98/95/01/1328989501.db2.gz NNCFHSDIVFABKH-LJQANCHMSA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)=CCN(C)CCN(C)C(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001319999405 1329053741 /nfs/dbraw/zinc/05/37/41/1329053741.db2.gz FUZRPSHHDFLGJX-GOSISDBHSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)=CCN(C)CCN(C)C(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001319999405 1329053748 /nfs/dbraw/zinc/05/37/48/1329053748.db2.gz FUZRPSHHDFLGJX-GOSISDBHSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)=CCN(C)C[C@H](C)NC(=O)c1ccc(CC[NH+](C)C)cc1 ZINC001322243706 1329440756 /nfs/dbraw/zinc/44/07/56/1329440756.db2.gz IPSKEFIWMRQBMH-KRWDZBQOSA-N 1 3 331.504 2.807 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@@H]21 ZINC001320112576 1329084790 /nfs/dbraw/zinc/08/47/90/1329084790.db2.gz ULQJPEBMXMAVME-MSOLQXFVSA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@@H]21 ZINC001320112576 1329084794 /nfs/dbraw/zinc/08/47/94/1329084794.db2.gz ULQJPEBMXMAVME-MSOLQXFVSA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)NC[C@H](C)NCc1ccccc1F ZINC001491603470 1323781139 /nfs/dbraw/zinc/78/11/39/1323781139.db2.gz UEGOMQDXBABOOY-MAUKXSAKSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)NC[C@H](C)NCc1ccccc1F ZINC001491603470 1323781146 /nfs/dbraw/zinc/78/11/46/1323781146.db2.gz UEGOMQDXBABOOY-MAUKXSAKSA-N 1 3 335.467 2.683 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H]([NH2+]CCCCc3ccccc3)C2)C1 ZINC001491752186 1323860707 /nfs/dbraw/zinc/86/07/07/1323860707.db2.gz SSRXVNPJIJHJKF-QUCCMNQESA-N 1 3 343.515 2.542 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[NH2+]CCCc2cccc(C)c2)C1)N(C)C ZINC001491847718 1323943368 /nfs/dbraw/zinc/94/33/68/1323943368.db2.gz KJXRZSKZFBQVBX-VQTJNVASSA-N 1 3 345.531 2.706 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[NH2+]C[C@H]2CCCC(F)(F)C2)C1 ZINC001491849732 1323944579 /nfs/dbraw/zinc/94/45/79/1323944579.db2.gz LBPCAYARRWIGHA-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C)nc2C)C1 ZINC001491894755 1324004782 /nfs/dbraw/zinc/00/47/82/1324004782.db2.gz RITSQFSCPNUUED-RBUKOAKNSA-N 1 3 346.519 2.557 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[C@H]([NH2+]Cc2ccc(C)nc2C)C1 ZINC001491894754 1324004876 /nfs/dbraw/zinc/00/48/76/1324004876.db2.gz RITSQFSCPNUUED-OALUTQOASA-N 1 3 346.519 2.557 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H](C)NC(=O)[C@H](C(C)C)N(C)C)cs1 ZINC001320453720 1329135176 /nfs/dbraw/zinc/13/51/76/1329135176.db2.gz JCGFTHYUSHHCJT-CJNGLKHVSA-N 1 3 325.522 2.627 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)N(C)CCNC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001492257317 1324382246 /nfs/dbraw/zinc/38/22/46/1324382246.db2.gz NOYPIRWYBRCFKA-KSSFIOAISA-N 1 3 349.906 2.791 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(C)CCNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001492370148 1324459463 /nfs/dbraw/zinc/45/94/63/1324459463.db2.gz PCZWMLYUGVUTKL-HNNXBMFYSA-N 1 3 335.467 2.809 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001492386839 1324469242 /nfs/dbraw/zinc/46/92/42/1324469242.db2.gz QIVHAGCHILKRNJ-ROUUACIJSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001492386839 1324469245 /nfs/dbraw/zinc/46/92/45/1324469245.db2.gz QIVHAGCHILKRNJ-ROUUACIJSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c(C)c1 ZINC001492387117 1324469536 /nfs/dbraw/zinc/46/95/36/1324469536.db2.gz SRNXDJGKZOBHSV-ROUUACIJSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c(C)c1 ZINC001492387117 1324469542 /nfs/dbraw/zinc/46/95/42/1324469542.db2.gz SRNXDJGKZOBHSV-ROUUACIJSA-N 1 3 331.504 2.582 10 0 EFAEHO CCC/C=C\CC[N@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001492425182 1324503096 /nfs/dbraw/zinc/50/30/96/1324503096.db2.gz WSBWZVRJTXQOMG-QWUACUGRSA-N 1 3 341.515 2.993 10 0 EFAEHO CCC/C=C\CC[N@@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001492425182 1324503100 /nfs/dbraw/zinc/50/31/00/1324503100.db2.gz WSBWZVRJTXQOMG-QWUACUGRSA-N 1 3 341.515 2.993 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1cccc(Cl)c1)NC(=O)CN1CC[C@H](C)C1 ZINC001320551019 1329160315 /nfs/dbraw/zinc/16/03/15/1329160315.db2.gz ZFOZVZIKGZEDSD-GJZGRUSLSA-N 1 3 337.895 2.666 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccccc1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001320547252 1329159253 /nfs/dbraw/zinc/15/92/53/1329159253.db2.gz DEJLZJDAPZFFCI-OXJNMPFZSA-N 1 3 349.494 2.884 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001320548490 1329160251 /nfs/dbraw/zinc/16/02/51/1329160251.db2.gz LJUGMOHNJBYNHR-IRXDYDNUSA-N 1 3 331.504 2.575 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C)Cc1cc2ccccc2o1)N(C)C ZINC001316833562 1324619785 /nfs/dbraw/zinc/61/97/85/1324619785.db2.gz DTCQSSYRENZYLY-QGZVFWFLSA-N 1 3 331.460 2.711 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C)Cc1cc2ccccc2o1)N(C)C ZINC001316833562 1324619790 /nfs/dbraw/zinc/61/97/90/1324619790.db2.gz DTCQSSYRENZYLY-QGZVFWFLSA-N 1 3 331.460 2.711 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H](C)NC(=O)[C@@H](C(C)C)N(C)C)cc1F ZINC001320615733 1329179500 /nfs/dbraw/zinc/17/95/00/1329179500.db2.gz VODIJCVNUFPHPO-CRAIPNDOSA-N 1 3 337.483 2.705 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2C[N@@H+](CCC3=CCCCC3)CC[C@@H]2C1 ZINC001316758522 1325113900 /nfs/dbraw/zinc/11/39/00/1325113900.db2.gz FMJZWIPRIQBMAD-UXHICEINSA-N 1 3 347.547 2.999 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2C[N@H+](CCC3=CCCCC3)CC[C@@H]2C1 ZINC001316758522 1325113908 /nfs/dbraw/zinc/11/39/08/1325113908.db2.gz FMJZWIPRIQBMAD-UXHICEINSA-N 1 3 347.547 2.999 10 0 EFAEHO C[C@H](c1cccc(F)c1)[N@H+](C)CCCNC(=O)CN1CC[C@@H](C)C1 ZINC001316851471 1325222308 /nfs/dbraw/zinc/22/23/08/1325222308.db2.gz XLINNXVDEKGIBI-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@H](c1cccc(F)c1)[N@@H+](C)CCCNC(=O)CN1CC[C@@H](C)C1 ZINC001316851471 1325222317 /nfs/dbraw/zinc/22/23/17/1325222317.db2.gz XLINNXVDEKGIBI-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](C)[C@H]2CCc3ccc(F)cc32)C1 ZINC001316851157 1325223184 /nfs/dbraw/zinc/22/31/84/1325223184.db2.gz QITXDGXBHXAKIG-BEFAXECRSA-N 1 3 347.478 2.593 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](C)[C@H]2CCc3ccc(F)cc32)C1 ZINC001316851157 1325223191 /nfs/dbraw/zinc/22/31/91/1325223191.db2.gz QITXDGXBHXAKIG-BEFAXECRSA-N 1 3 347.478 2.593 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](C)CC[C@H]2CCCC2(F)F)C1 ZINC001316851373 1325223526 /nfs/dbraw/zinc/22/35/26/1325223526.db2.gz VWOLBXLPWRDWNZ-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](C)CC[C@H]2CCCC2(F)F)C1 ZINC001316851373 1325223536 /nfs/dbraw/zinc/22/35/36/1325223536.db2.gz VWOLBXLPWRDWNZ-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](C)[C@H]2CCc3ccc(F)cc32)C1 ZINC001316851160 1325223681 /nfs/dbraw/zinc/22/36/81/1325223681.db2.gz QITXDGXBHXAKIG-KXBFYZLASA-N 1 3 347.478 2.593 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](C)[C@H]2CCc3ccc(F)cc32)C1 ZINC001316851160 1325223688 /nfs/dbraw/zinc/22/36/88/1325223688.db2.gz QITXDGXBHXAKIG-KXBFYZLASA-N 1 3 347.478 2.593 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C)[C@@H]1CCc2c1cccc2F)N(C)C ZINC001316863209 1325231150 /nfs/dbraw/zinc/23/11/50/1325231150.db2.gz UANCKWYREQZVCW-QZTJIDSGSA-N 1 3 335.467 2.591 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C)[C@@H]1CCc2c1cccc2F)N(C)C ZINC001316863209 1325231158 /nfs/dbraw/zinc/23/11/58/1325231158.db2.gz UANCKWYREQZVCW-QZTJIDSGSA-N 1 3 335.467 2.591 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C)[C@H]1CCc2c1cccc2F)N(C)C ZINC001316863208 1325231722 /nfs/dbraw/zinc/23/17/22/1325231722.db2.gz UANCKWYREQZVCW-MSOLQXFVSA-N 1 3 335.467 2.591 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C)[C@H]1CCc2c1cccc2F)N(C)C ZINC001316863208 1325231730 /nfs/dbraw/zinc/23/17/30/1325231730.db2.gz UANCKWYREQZVCW-MSOLQXFVSA-N 1 3 335.467 2.591 10 0 EFAEHO CCC/C=C\CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001317051293 1325522897 /nfs/dbraw/zinc/52/28/97/1325522897.db2.gz AVYZGOJRYAXIAX-GJGSYKPXSA-N 1 3 333.520 2.750 10 0 EFAEHO CCC/C=C\CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001317051293 1325522907 /nfs/dbraw/zinc/52/29/07/1325522907.db2.gz AVYZGOJRYAXIAX-GJGSYKPXSA-N 1 3 333.520 2.750 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(C)ccc1C)C(=O)[C@@H](C(C)C)N(C)C ZINC001320843989 1329309440 /nfs/dbraw/zinc/30/94/40/1329309440.db2.gz MAAMRLBPXCKRBF-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)CC[NH+]1CCCCC1 ZINC001320928013 1329320363 /nfs/dbraw/zinc/32/03/63/1329320363.db2.gz DSRLVECCXRXZNI-UHFFFAOYSA-N 1 3 335.467 2.640 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001376294624 1343464044 /nfs/dbraw/zinc/46/40/44/1343464044.db2.gz YZJZSYKPMOTGOV-GOSISDBHSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001376294624 1343464047 /nfs/dbraw/zinc/46/40/47/1343464047.db2.gz YZJZSYKPMOTGOV-GOSISDBHSA-N 1 3 325.541 2.933 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C\CNC(=O)CN(C)C2CCC2)c(C)c1 ZINC001321094869 1329342031 /nfs/dbraw/zinc/34/20/31/1329342031.db2.gz CTVKVYVVUPIIGE-PLNGDYQASA-N 1 3 329.488 2.550 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C/C=C/CNC(=O)[C@H]2CCCN2C)cc1 ZINC001321187949 1329354130 /nfs/dbraw/zinc/35/41/30/1329354130.db2.gz FDYVFXPPPYMZFM-VZSQWMKGSA-N 1 3 329.488 2.666 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C/C=C\CNC(=O)[C@H]2CCCN2C)cc1 ZINC001321187948 1329354403 /nfs/dbraw/zinc/35/44/03/1329354403.db2.gz FDYVFXPPPYMZFM-PHWHVTFISA-N 1 3 329.488 2.666 10 0 EFAEHO C[NH+](C)CC1(C(=O)NC/C=C\CNCc2ccc(Cl)s2)CC1 ZINC001321210476 1329357305 /nfs/dbraw/zinc/35/73/05/1329357305.db2.gz IYCUFMPCXJSYDM-ARJAWSKDSA-N 1 3 341.908 2.505 10 0 EFAEHO CC[C@H]([NH2+]C/C=C/CNC(=O)CN1CC[C@H](C)C1)c1ccccc1 ZINC001321252664 1329363720 /nfs/dbraw/zinc/36/37/20/1329363720.db2.gz WLWYMUQWEAZNTN-TYLRKXQCSA-N 1 3 329.488 2.742 10 0 EFAEHO C[C@H](NC/C=C/CNC(=O)CC1CC[NH+](C)CC1)c1ccc(F)cc1 ZINC001321279317 1329366991 /nfs/dbraw/zinc/36/69/91/1329366991.db2.gz IRGWFIDNKNLNOO-CWDCEQMOSA-N 1 3 347.478 2.881 10 0 EFAEHO C[C@@H]([NH2+]C/C=C/CNC(=O)CN1CCC(C)CC1)c1cccc(F)c1 ZINC001321301349 1329369931 /nfs/dbraw/zinc/36/99/31/1329369931.db2.gz AHMFQXNVDAGKPK-REMYHPOOSA-N 1 3 347.478 2.881 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\CN[C@@H](C)c1cccc(F)c1)[NH+](C)C ZINC001321351609 1329376188 /nfs/dbraw/zinc/37/61/88/1329376188.db2.gz XIOOWNBFFHJFTR-UHCGQYCJSA-N 1 3 335.467 2.735 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1CCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001317308590 1327840384 /nfs/dbraw/zinc/84/03/84/1327840384.db2.gz LZYQXIBTDJPSCO-PMACEKPBSA-N 1 3 345.531 2.704 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)CC[NH+]2CCCCC2)cs1 ZINC001321415955 1329383817 /nfs/dbraw/zinc/38/38/17/1329383817.db2.gz GFOOFPSEPGHOMI-ONEGZZNKSA-N 1 3 335.517 2.695 10 0 EFAEHO CN(CC[NH2+]C/C=C/c1ccc(Cl)cc1)C(=O)CN(C)C1CCC1 ZINC001317595445 1328174709 /nfs/dbraw/zinc/17/47/09/1328174709.db2.gz CCAUZEWTFHYQHK-SNAWJCMRSA-N 1 3 349.906 2.886 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]CCN(C)C(=O)CN1CC[C@@H](C)C1 ZINC001317625048 1328207055 /nfs/dbraw/zinc/20/70/55/1328207055.db2.gz ARXKKWFNEVYXDO-CQSZACIVSA-N 1 3 337.895 2.538 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[NH2+]Cc2ccc(Cl)s2)CC1 ZINC001317644047 1328229063 /nfs/dbraw/zinc/22/90/63/1328229063.db2.gz MWXSKZDIDVTBIV-UHFFFAOYSA-N 1 3 343.924 2.681 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](C[N@H+](C)CCC2=CCCCC2)C1 ZINC001317830807 1328400563 /nfs/dbraw/zinc/40/05/63/1328400563.db2.gz KGJNWAARWLRUFT-RBUKOAKNSA-N 1 3 333.520 2.751 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](C[N@@H+](C)CCC2=CCCCC2)C1 ZINC001317830807 1328400568 /nfs/dbraw/zinc/40/05/68/1328400568.db2.gz KGJNWAARWLRUFT-RBUKOAKNSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C/CC[N@H+](C)CC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001317869678 1328428714 /nfs/dbraw/zinc/42/87/14/1328428714.db2.gz GGFRXPMOCFLPKX-VOTSOKGWSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](C)CC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001317869678 1328428719 /nfs/dbraw/zinc/42/87/19/1328428719.db2.gz GGFRXPMOCFLPKX-VOTSOKGWSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]CCCC(C)C ZINC001323166570 1329519191 /nfs/dbraw/zinc/51/91/91/1329519191.db2.gz DCQYPUYJYHUHAA-ZWKOTPCHSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+]Cc1ccc2c(c1)CCC2)N(C)C ZINC001322554660 1329467258 /nfs/dbraw/zinc/46/72/58/1329467258.db2.gz HUGHATGGCZHKJZ-FQEVSTJZSA-N 1 3 345.531 2.700 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+][C@H]1CCc2c1cccc2F)N(C)C ZINC001322565721 1329467998 /nfs/dbraw/zinc/46/79/98/1329467998.db2.gz HDCYHVZRBGCKLN-ZWKOTPCHSA-N 1 3 335.467 2.591 10 0 EFAEHO CN(CC(=O)N(C)CCC[NH2+]CC1CCCCC1)CC(C)(C)C ZINC001322695120 1329480572 /nfs/dbraw/zinc/48/05/72/1329480572.db2.gz WUBYDALOYCQLAU-UHFFFAOYSA-N 1 3 325.541 2.983 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CCCN(C)C(=O)[C@H](C(C)C)N(C)C ZINC001322797375 1329489418 /nfs/dbraw/zinc/48/94/18/1329489418.db2.gz VOVKFCVJAKWDDS-SFHVURJKSA-N 1 3 337.483 2.658 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[NH2+]Cc1ccc(F)cc1C ZINC001322851775 1329494549 /nfs/dbraw/zinc/49/45/49/1329494549.db2.gz CUULKTOODCHSQP-LJQANCHMSA-N 1 3 349.494 2.947 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@H](C2CCN(C(=O)CN3CCCC3)CC2)C1 ZINC001323637701 1329556980 /nfs/dbraw/zinc/55/69/80/1329556980.db2.gz MQBCISQMRWGXIE-YADGQWAMSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@H](C2CCN(C(=O)CN3CCCC3)CC2)C1 ZINC001323637701 1329556981 /nfs/dbraw/zinc/55/69/81/1329556981.db2.gz MQBCISQMRWGXIE-YADGQWAMSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@H](C2CCN(C(=O)CN3CCCC3)CC2)C1 ZINC001323637700 1329557411 /nfs/dbraw/zinc/55/74/11/1329557411.db2.gz MQBCISQMRWGXIE-XQQSMPNESA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@H](C2CCN(C(=O)CN3CCCC3)CC2)C1 ZINC001323637700 1329557414 /nfs/dbraw/zinc/55/74/14/1329557414.db2.gz MQBCISQMRWGXIE-XQQSMPNESA-N 1 3 347.547 2.999 10 0 EFAEHO CC(C)=CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)CN1CC[C@@H](C)C1 ZINC001323661640 1329559838 /nfs/dbraw/zinc/55/98/38/1329559838.db2.gz ZDCWICYAZLENLB-MVCQKVDPSA-N 1 3 333.520 2.796 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2ccccc2)C[C@@H]1C ZINC001324096593 1329599283 /nfs/dbraw/zinc/59/92/83/1329599283.db2.gz CWSHSPMYHIPZLI-AZUAARDMSA-N 1 3 345.531 2.929 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@@H]1C[NH2+]CCc1ccccc1Cl ZINC001324207049 1329608072 /nfs/dbraw/zinc/60/80/72/1329608072.db2.gz NDCPAWYZHARBEH-SJLPKXTDSA-N 1 3 349.906 2.557 10 0 EFAEHO CC(C)CC[NH2+]C[C@@H]1CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001324273724 1329613007 /nfs/dbraw/zinc/61/30/07/1329613007.db2.gz ONSQHILJBQLQSI-IBGZPJMESA-N 1 3 331.504 2.989 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@@]1(C)CCC[N@H+](CC=C(C)C)C1 ZINC001324937641 1329661283 /nfs/dbraw/zinc/66/12/83/1329661283.db2.gz YLKDILVHTWTPOZ-IEBWSBKVSA-N 1 3 341.515 2.851 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@@]1(C)CCC[N@@H+](CC=C(C)C)C1 ZINC001324937641 1329661285 /nfs/dbraw/zinc/66/12/85/1329661285.db2.gz YLKDILVHTWTPOZ-IEBWSBKVSA-N 1 3 341.515 2.851 10 0 EFAEHO CCc1ccccc1[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NCC=C(C)C ZINC001325366327 1329683174 /nfs/dbraw/zinc/68/31/74/1329683174.db2.gz MPVBVRYMGMAQFG-ICSRJNTNSA-N 1 3 343.515 2.914 10 0 EFAEHO CCc1ccccc1[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NCC=C(C)C ZINC001325366327 1329683176 /nfs/dbraw/zinc/68/31/76/1329683176.db2.gz MPVBVRYMGMAQFG-ICSRJNTNSA-N 1 3 343.515 2.914 10 0 EFAEHO C[C@@H]([NH2+]CCCc1ccccc1)[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001325465270 1329690322 /nfs/dbraw/zinc/69/03/22/1329690322.db2.gz FGZVOQYUIIFIHD-UYAOXDASSA-N 1 3 343.515 2.542 10 0 EFAEHO CC(C)CCC[NH2+]C[C@H]1CN(C(=O)CN2CCC(C)CC2)C[C@H]1C ZINC001325573251 1329697968 /nfs/dbraw/zinc/69/79/68/1329697968.db2.gz BBLIJYNFYLAZAV-MOPGFXCFSA-N 1 3 337.552 2.839 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]CCC2CCCCC2)C1 ZINC001325595399 1329699514 /nfs/dbraw/zinc/69/95/14/1329699514.db2.gz JFFPQTHQOMHXNU-HKUYNNGSSA-N 1 3 337.552 2.983 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001326223517 1329740179 /nfs/dbraw/zinc/74/01/79/1329740179.db2.gz IGBFAXTVJNWBEI-RTBURBONSA-N 1 3 347.547 2.879 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](CC[NH2+]CCC2=CCCCC2)C1 ZINC001326224918 1329740457 /nfs/dbraw/zinc/74/04/57/1329740457.db2.gz RBHZMJGIUFRMCP-MOPGFXCFSA-N 1 3 333.520 2.799 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](CC[NH2+]CCC2=CCCCC2)C1 ZINC001326224919 1329740488 /nfs/dbraw/zinc/74/04/88/1329740488.db2.gz RBHZMJGIUFRMCP-OALUTQOASA-N 1 3 333.520 2.799 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](CC[NH2+]CCc2ccccc2F)C1)N(C)C ZINC001326304820 1329745636 /nfs/dbraw/zinc/74/56/36/1329745636.db2.gz RCQGNFXJMYMZEW-VQIMIIECSA-N 1 3 349.494 2.537 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]CCCc2ccccc2)C1 ZINC001326329397 1329747631 /nfs/dbraw/zinc/74/76/31/1329747631.db2.gz ARYWINWMFQZVQW-VQTJNVASSA-N 1 3 343.515 2.542 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](CC[NH2+]CC2CC(C)(C)C2)C1)N(C)C ZINC001326417279 1329754594 /nfs/dbraw/zinc/75/45/94/1329754594.db2.gz BJTFONQJZQBBKN-AEFFLSMTSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1CC[C@H](C[NH2+]CC[C@H](C)F)CC1 ZINC001326512880 1330308570 /nfs/dbraw/zinc/30/85/70/1330308570.db2.gz OPDXFDUMHUWESE-XLAORIBOSA-N 1 3 341.515 2.872 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@H]1CC[C@H](NC(=O)CN2CC[C@H](C)C2)CC1 ZINC001326542772 1330314919 /nfs/dbraw/zinc/31/49/19/1330314919.db2.gz ZNVXSQNJFNQISJ-BCEYDMKGSA-N 1 3 335.536 2.949 10 0 EFAEHO CC[C@H](C(=O)NCc1cccc2c1CC[N@H+](CC=C(C)C)C2)N(C)C ZINC001326676847 1330345951 /nfs/dbraw/zinc/34/59/51/1330345951.db2.gz XIICIRLAJZSSRI-HXUWFJFHSA-N 1 3 343.515 2.967 10 0 EFAEHO CC[C@H](C(=O)NCc1cccc2c1CC[N@@H+](CC=C(C)C)C2)N(C)C ZINC001326676847 1330345957 /nfs/dbraw/zinc/34/59/57/1330345957.db2.gz XIICIRLAJZSSRI-HXUWFJFHSA-N 1 3 343.515 2.967 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]CCCc3ccccc3)CCC2)CCC1 ZINC001326834178 1330371401 /nfs/dbraw/zinc/37/14/01/1330371401.db2.gz GRVOIAIWDKJOHV-UHFFFAOYSA-N 1 3 343.515 2.732 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)CCC[NH2+]Cc1ccccn1 ZINC001330934676 1330772712 /nfs/dbraw/zinc/77/27/12/1330772712.db2.gz XTLDPRRQBHRPAA-PKOBYXMFSA-N 1 3 346.519 2.719 10 0 EFAEHO CC(C)[NH2+]CCC[C@H](NC(=O)CN1CC[C@H](C)C1)c1ccccc1 ZINC001331176038 1330801920 /nfs/dbraw/zinc/80/19/20/1330801920.db2.gz FYUHZWAMAUDSND-HKUYNNGSSA-N 1 3 331.504 2.964 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](CCC[NH2+]C(C)C)c1ccccc1 ZINC001331175927 1330802097 /nfs/dbraw/zinc/80/20/97/1330802097.db2.gz FPSUEPQQPVBERO-QGZVFWFLSA-N 1 3 328.460 2.896 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CCCCc2ccccc2)[C@H]1C ZINC001331944676 1330895461 /nfs/dbraw/zinc/89/54/61/1330895461.db2.gz SWEGOSRXKGJVSR-QUCCMNQESA-N 1 3 345.531 2.929 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@@H](C)N(C(=O)CCCC[NH+](C)C)C2)c1 ZINC001332050509 1330909636 /nfs/dbraw/zinc/90/96/36/1330909636.db2.gz PUQMKUMAPBSRDP-AEFFLSMTSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H]1[C@H](NC(=O)CCCC[NH+](C)C)CCCN1Cc1ccccc1 ZINC001332215834 1330942312 /nfs/dbraw/zinc/94/23/12/1330942312.db2.gz BIXOFKIDIYZLPV-PKOBYXMFSA-N 1 3 331.504 2.888 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H](C[NH2+]CC=C(Cl)Cl)C1)C1CCC1 ZINC001332271305 1330950878 /nfs/dbraw/zinc/95/08/78/1330950878.db2.gz IOMZOIOPVZMFTN-CHWSQXEVSA-N 1 3 348.318 2.664 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H](C[NH2+]CC=C(Cl)Cl)C1)C1CCC1 ZINC001332271309 1330950917 /nfs/dbraw/zinc/95/09/17/1330950917.db2.gz IOMZOIOPVZMFTN-QWHCGFSZSA-N 1 3 348.318 2.664 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2C[C@H]([NH2+]CCCC(C)(C)C)C(C)(C)C2)C1 ZINC001332422456 1330970084 /nfs/dbraw/zinc/97/00/84/1330970084.db2.gz ILOJCSCTVMNPQY-SJORKVTESA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2C[C@@H]([NH2+]CCCC(C)(C)C)C(C)(C)C2)C1 ZINC001332422452 1330970119 /nfs/dbraw/zinc/97/01/19/1330970119.db2.gz ILOJCSCTVMNPQY-IAGOWNOFSA-N 1 3 337.552 2.981 10 0 EFAEHO CCC/C=C\CC[NH2+][C@@H]1CN(C(=O)CN2CC[C@@H](C)C2)CC1(C)C ZINC001332422093 1330970282 /nfs/dbraw/zinc/97/02/82/1330970282.db2.gz GHLCLJWJEKPNQU-BTFXCVNISA-N 1 3 335.536 2.901 10 0 EFAEHO CCCCC[NH+]1CCC(C2(NC(=O)CN3CC[C@H](C)C3)CC2)CC1 ZINC001333180882 1331089619 /nfs/dbraw/zinc/08/96/19/1331089619.db2.gz UIBUTSAQFSWURP-KRWDZBQOSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC2=CC[N@H+](CC3=CCCCC3)CC2)C1 ZINC001333400019 1331135043 /nfs/dbraw/zinc/13/50/43/1331135043.db2.gz KOBPTTYPSBEUQE-KRWDZBQOSA-N 1 3 331.504 2.577 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC2=CC[N@@H+](CC3=CCCCC3)CC2)C1 ZINC001333400019 1331135045 /nfs/dbraw/zinc/13/50/45/1331135045.db2.gz KOBPTTYPSBEUQE-KRWDZBQOSA-N 1 3 331.504 2.577 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@@H+]([C@H]2CCc3ccccc32)CC1 ZINC001333456350 1331147483 /nfs/dbraw/zinc/14/74/83/1331147483.db2.gz BNSZXRCCINDUBV-FQEVSTJZSA-N 1 3 341.499 2.762 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@H+]([C@H]2CCc3ccccc32)CC1 ZINC001333456350 1331147490 /nfs/dbraw/zinc/14/74/90/1331147490.db2.gz BNSZXRCCINDUBV-FQEVSTJZSA-N 1 3 341.499 2.762 10 0 EFAEHO c1[nH]nc2c1cccc2CN[C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC001352789571 1333730383 /nfs/dbraw/zinc/73/03/83/1333730383.db2.gz KPXPCMLDYDXYDK-FXAWDEMLSA-N 1 3 334.423 2.908 10 0 EFAEHO CN1CCN(c2ccc(N[C@@H]3CCC[N@@H+]4CCCC[C@@H]34)cc2)CC1 ZINC001354235663 1334187682 /nfs/dbraw/zinc/18/76/82/1334187682.db2.gz LFGXAUPEBMRUAA-UXHICEINSA-N 1 3 328.504 2.867 10 0 EFAEHO CN1CCN(c2ccc(N[C@@H]3CCC[N@H+]4CCCC[C@@H]34)cc2)CC1 ZINC001354235663 1334187683 /nfs/dbraw/zinc/18/76/83/1334187683.db2.gz LFGXAUPEBMRUAA-UXHICEINSA-N 1 3 328.504 2.867 10 0 EFAEHO CN1CCN(c2ccc(N[C@@H]3CCC[N@@H+]4CCCC[C@H]34)cc2)CC1 ZINC001354235669 1334187888 /nfs/dbraw/zinc/18/78/88/1334187888.db2.gz LFGXAUPEBMRUAA-WOJBJXKFSA-N 1 3 328.504 2.867 10 0 EFAEHO CN1CCN(c2ccc(N[C@@H]3CCC[N@H+]4CCCC[C@H]34)cc2)CC1 ZINC001354235669 1334187890 /nfs/dbraw/zinc/18/78/90/1334187890.db2.gz LFGXAUPEBMRUAA-WOJBJXKFSA-N 1 3 328.504 2.867 10 0 EFAEHO CC(C)[NH+]1CCC(NC(=O)CN2CCC[C@H](C3CCC3)CC2)CC1 ZINC001414026470 1335524131 /nfs/dbraw/zinc/52/41/31/1335524131.db2.gz WZSJJPLZRJVXPO-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO [NH2+]=C(NC[C@@H]1C[C@H]1C1CC1)NC1CCN(Cc2ccccc2)CC1 ZINC000849116192 1335555182 /nfs/dbraw/zinc/55/51/82/1335555182.db2.gz HOCXIRNTOWEOSF-HKUYNNGSSA-N 1 3 326.488 2.811 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=S)Nc1ccc(F)cc1F ZINC000849275073 1335585561 /nfs/dbraw/zinc/58/55/61/1335585561.db2.gz GXZSKFBQQNIIGD-LBPRGKRZSA-N 1 3 344.475 2.523 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=S)Nc1ccc(F)cc1F ZINC000849275073 1335585562 /nfs/dbraw/zinc/58/55/62/1335585562.db2.gz GXZSKFBQQNIIGD-LBPRGKRZSA-N 1 3 344.475 2.523 10 0 EFAEHO C[C@H]1C[C@@H](CN2Cc3ccc(NC(=O)C(F)(F)F)cc3C2)CC[NH2+]1 ZINC000849349503 1335596796 /nfs/dbraw/zinc/59/67/96/1335596796.db2.gz BNMZMOMSWJXCQW-RYUDHWBXSA-N 1 3 341.377 2.891 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001361704766 1336284339 /nfs/dbraw/zinc/28/43/39/1336284339.db2.gz AMJAXTYJJDAFOP-OALUTQOASA-N 1 3 347.478 2.733 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001361704766 1336284345 /nfs/dbraw/zinc/28/43/45/1336284345.db2.gz AMJAXTYJJDAFOP-OALUTQOASA-N 1 3 347.478 2.733 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001361704767 1336284551 /nfs/dbraw/zinc/28/45/51/1336284551.db2.gz AMJAXTYJJDAFOP-RBUKOAKNSA-N 1 3 347.478 2.733 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001361704767 1336284554 /nfs/dbraw/zinc/28/45/54/1336284554.db2.gz AMJAXTYJJDAFOP-RBUKOAKNSA-N 1 3 347.478 2.733 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(CCN2CCCC2)c2ccccc2)CC[N@@H+]1C ZINC001361903280 1336408034 /nfs/dbraw/zinc/40/80/34/1336408034.db2.gz RWTKAMCEJKYSSK-RBUKOAKNSA-N 1 3 329.488 2.846 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(CCN2CCCC2)c2ccccc2)CC[N@H+]1C ZINC001361903280 1336408036 /nfs/dbraw/zinc/40/80/36/1336408036.db2.gz RWTKAMCEJKYSSK-RBUKOAKNSA-N 1 3 329.488 2.846 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)[C@@H](C)CC[NH+](C)C)c1ccsc1 ZINC001361917447 1336415870 /nfs/dbraw/zinc/41/58/70/1336415870.db2.gz HDCMEKROCYRCGZ-HOCLYGCPSA-N 1 3 325.522 2.835 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2CC[C@H]3C[C@@H](C)C[N@H+]3C2)N(C)C)cc1 ZINC001361975564 1336447466 /nfs/dbraw/zinc/44/74/66/1336447466.db2.gz BJEQJTSELBUTBR-LMCOJAPRSA-N 1 3 343.515 2.834 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2CC[C@H]3C[C@@H](C)C[N@@H+]3C2)N(C)C)cc1 ZINC001361975564 1336447467 /nfs/dbraw/zinc/44/74/67/1336447467.db2.gz BJEQJTSELBUTBR-LMCOJAPRSA-N 1 3 343.515 2.834 10 0 EFAEHO CN1CCC(N(Cc2ccco2)C(=O)[C@@H]2CCC[C@H]([NH+](C)C)C2)CC1 ZINC001362119740 1336511692 /nfs/dbraw/zinc/51/16/92/1336511692.db2.gz SKALGHIKGVWXDF-AEFFLSMTSA-N 1 3 347.503 2.823 10 0 EFAEHO C[C@@H](CC[NH+](C)C)C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC001362157904 1336530310 /nfs/dbraw/zinc/53/03/10/1336530310.db2.gz KKNFGZURINAULU-ROUUACIJSA-N 1 3 331.504 2.697 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC001362230893 1336564869 /nfs/dbraw/zinc/56/48/69/1336564869.db2.gz UDVZDOYKURHLME-QZTJIDSGSA-N 1 3 331.504 2.697 10 0 EFAEHO COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](C)CC[NH+](C)C)cc1 ZINC001362248338 1336571914 /nfs/dbraw/zinc/57/19/14/1336571914.db2.gz DNGDYHSDBKFFMB-APWZRJJASA-N 1 3 347.503 2.536 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)CC[N@@H+]1C ZINC001362420553 1336602849 /nfs/dbraw/zinc/60/28/49/1336602849.db2.gz QZFIGKOPMBZQFJ-SLFFLAALSA-N 1 3 343.515 2.840 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)CC[N@H+]1C ZINC001362420553 1336602851 /nfs/dbraw/zinc/60/28/51/1336602851.db2.gz QZFIGKOPMBZQFJ-SLFFLAALSA-N 1 3 343.515 2.840 10 0 EFAEHO CC(C)N1CCN(c2cccc(NC(=O)[C@H](C)CC[NH+](C)C)c2)CC1 ZINC001362613889 1336674267 /nfs/dbraw/zinc/67/42/67/1336674267.db2.gz QDAWMEFEUZLZTG-QGZVFWFLSA-N 1 3 346.519 2.743 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)NC[C@H]1CCCCN1Cc1ccccc1 ZINC001362802648 1336748679 /nfs/dbraw/zinc/74/86/79/1336748679.db2.gz NNAIMDUKNAJXFE-IEBWSBKVSA-N 1 3 331.504 2.745 10 0 EFAEHO CN1CCC[C@H]1CC[NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)C12CCC2 ZINC001363813001 1337064300 /nfs/dbraw/zinc/06/43/00/1337064300.db2.gz XJCXJDZXAJEQAY-JKSUJKDBSA-N 1 3 337.508 2.992 10 0 EFAEHO CO[C@H](CN1CCC(O)(C[NH+]2CCCCC2)CC1)c1ccccc1 ZINC001363855252 1337083948 /nfs/dbraw/zinc/08/39/48/1337083948.db2.gz YNYOATKFFILLNM-LJQANCHMSA-N 1 3 332.488 2.687 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2cc(F)ccc2C)C1)N(C)C ZINC001365853387 1337257770 /nfs/dbraw/zinc/25/77/70/1337257770.db2.gz WAIJFNQFHPCRNT-KFKAGJAMSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1cc(C)c(C[N@H+]2CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c(C)c1 ZINC001365985936 1337302591 /nfs/dbraw/zinc/30/25/91/1337302591.db2.gz QXJHIYHSFKHXAC-AZUAARDMSA-N 1 3 345.531 2.889 10 0 EFAEHO Cc1cc(C)c(C[N@@H+]2CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c(C)c1 ZINC001365985936 1337302594 /nfs/dbraw/zinc/30/25/94/1337302594.db2.gz QXJHIYHSFKHXAC-AZUAARDMSA-N 1 3 345.531 2.889 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCN(CCc2ccccc2)C1)[NH+]1CCCC1 ZINC001366006763 1337317450 /nfs/dbraw/zinc/31/74/50/1337317450.db2.gz WCNBFFLCHMHWLV-PMACEKPBSA-N 1 3 343.515 2.540 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC12CC[NH+](CC1CC3(CCC3)C1)CC2)N(C)C ZINC001366012726 1337322008 /nfs/dbraw/zinc/32/20/08/1337322008.db2.gz DLZUNLLPUDXLJA-ROUUACIJSA-N 1 3 347.547 2.878 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1c(C)cc(C)cc1C)C1CC1)N(C)C ZINC001366036752 1337338774 /nfs/dbraw/zinc/33/87/74/1337338774.db2.gz AACGCYGJUZBYJQ-WOJBJXKFSA-N 1 3 345.531 2.936 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1ccc(Cl)cc1)C1CC1)N(C)C ZINC001366057837 1337351939 /nfs/dbraw/zinc/35/19/39/1337351939.db2.gz GHRCWJDOULMNTM-DLBZAZTESA-N 1 3 337.895 2.665 10 0 EFAEHO CCC(CC)C[N@H+](C)C[C@H]1CCCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001366076606 1337368517 /nfs/dbraw/zinc/36/85/17/1337368517.db2.gz UJNKHEGXNNXQNB-IEBWSBKVSA-N 1 3 337.552 2.935 10 0 EFAEHO CCC(CC)C[N@@H+](C)C[C@H]1CCCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001366076606 1337368519 /nfs/dbraw/zinc/36/85/19/1337368519.db2.gz UJNKHEGXNNXQNB-IEBWSBKVSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366077922 1337369315 /nfs/dbraw/zinc/36/93/15/1337369315.db2.gz XRJFSCHAUZBLJN-MSOLQXFVSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366077922 1337369316 /nfs/dbraw/zinc/36/93/16/1337369316.db2.gz XRJFSCHAUZBLJN-MSOLQXFVSA-N 1 3 341.515 2.637 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001366114617 1337385029 /nfs/dbraw/zinc/38/50/29/1337385029.db2.gz CVTYUWODZBUOCJ-SYQHCUMBSA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001366114617 1337385032 /nfs/dbraw/zinc/38/50/32/1337385032.db2.gz CVTYUWODZBUOCJ-SYQHCUMBSA-N 1 3 346.302 2.559 10 0 EFAEHO CC[C@H]([NH2+][C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)C1)c1ccccc1 ZINC001366148631 1337402401 /nfs/dbraw/zinc/40/24/01/1337402401.db2.gz HSFHSZLJKOIAMQ-SCTDSRPQSA-N 1 3 329.488 2.859 10 0 EFAEHO C[C@H]([NH2+][C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)C1)c1cccc(F)c1 ZINC001366149558 1337403175 /nfs/dbraw/zinc/40/31/75/1337403175.db2.gz KEWCDKBBDZDZRO-RRQGHBQHSA-N 1 3 333.451 2.608 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001366164680 1337409824 /nfs/dbraw/zinc/40/98/24/1337409824.db2.gz YIWWZXSMEQELGZ-ZIFCJYIRSA-N 1 3 331.504 2.689 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1C ZINC001366170241 1337412883 /nfs/dbraw/zinc/41/28/83/1337412883.db2.gz NNTRGZSCUQEHLR-CEXWTWQISA-N 1 3 331.504 2.626 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(CC(C)C)cc2)C1)N(C)C ZINC001366170265 1337413044 /nfs/dbraw/zinc/41/30/44/1337413044.db2.gz NUHQYKLBYINUDM-ZCNNSNEGSA-N 1 3 345.531 2.962 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2cccc(Cl)c2F)C1 ZINC001366170381 1337413052 /nfs/dbraw/zinc/41/30/52/1337413052.db2.gz LUXJWQNOVAYZFX-OKILXGFUSA-N 1 3 341.858 2.558 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2cccc(Cl)c2F)C1 ZINC001366170381 1337413053 /nfs/dbraw/zinc/41/30/53/1337413053.db2.gz LUXJWQNOVAYZFX-OKILXGFUSA-N 1 3 341.858 2.558 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[NH2+][C@H]2CCc3ccccc32)C1 ZINC001366208866 1337445208 /nfs/dbraw/zinc/44/52/08/1337445208.db2.gz RJURVXXPKCDGOV-XLIONFOSSA-N 1 3 343.515 2.844 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@H]1CNCc1ccccn1)[NH+](CC)CC ZINC001366221908 1337454514 /nfs/dbraw/zinc/45/45/14/1337454514.db2.gz ZZLMRYSSNFOTLG-OALUTQOASA-N 1 3 346.519 2.673 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H](C)CNC(=O)[C@@H]1CCCN1C(C)C ZINC001366277200 1337487354 /nfs/dbraw/zinc/48/73/54/1337487354.db2.gz MWBROZKZOYIXCI-QAPCUYQASA-N 1 3 335.467 2.601 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc(F)cc1C ZINC001366286476 1337492080 /nfs/dbraw/zinc/49/20/80/1337492080.db2.gz OWFGWLWBDIFTLL-YJBOKZPZSA-N 1 3 335.467 2.603 10 0 EFAEHO C[C@@H](CNC(=O)CC[NH+](C)C)NCc1ccc(Cl)c(Cl)c1 ZINC001366318899 1337509292 /nfs/dbraw/zinc/50/92/92/1337509292.db2.gz BFQJFEJVSKTAQY-NSHDSACASA-N 1 3 332.275 2.539 10 0 EFAEHO Cc1ccncc1CN[C@H](C)CNC(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001366309138 1337504247 /nfs/dbraw/zinc/50/42/47/1337504247.db2.gz NSWZKAAKBHNVIH-MRXNPFEDSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1ccncc1CN[C@H](C)CNC(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001366309138 1337504249 /nfs/dbraw/zinc/50/42/49/1337504249.db2.gz NSWZKAAKBHNVIH-MRXNPFEDSA-N 1 3 346.519 2.637 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001366311990 1337505605 /nfs/dbraw/zinc/50/56/05/1337505605.db2.gz QDOUAGYUKAPBRY-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001366312023 1337505765 /nfs/dbraw/zinc/50/57/65/1337505765.db2.gz QFCILWWDFNWAAS-HNNXBMFYSA-N 1 3 335.467 2.603 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H](C)[NH2+]Cc1cc2ccccc2s1)N(C)C ZINC001366321853 1337510889 /nfs/dbraw/zinc/51/08/89/1337510889.db2.gz HACHUTPVFJDQCN-CJNGLKHVSA-N 1 3 333.501 2.836 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001366341165 1337522357 /nfs/dbraw/zinc/52/23/57/1337522357.db2.gz VNKPILYXZOVOQM-CABCVRRESA-N 1 3 347.494 2.884 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]Cc1ccc(C(F)F)cc1 ZINC001366366672 1337540113 /nfs/dbraw/zinc/54/01/13/1337540113.db2.gz MVQAHXFEBUAGMI-CYBMUJFWSA-N 1 3 327.419 2.559 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001366428439 1337578344 /nfs/dbraw/zinc/57/83/44/1337578344.db2.gz JGMUUHAPNZPBHT-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1ccccc1C[N@H+](C)[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001366428439 1337578346 /nfs/dbraw/zinc/57/83/46/1337578346.db2.gz JGMUUHAPNZPBHT-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@H](C)[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001366503440 1337645796 /nfs/dbraw/zinc/64/57/96/1337645796.db2.gz CVOUAMOGTANKBN-YOEHRIQHSA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)CC[C@@H]2CCC[N@@H+]2C)c(C)c1 ZINC001366541350 1337677566 /nfs/dbraw/zinc/67/75/66/1337677566.db2.gz PVKKQKRMYGHDSG-IBGZPJMESA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)CC[C@@H]2CCC[N@H+]2C)c(C)c1 ZINC001366541350 1337677571 /nfs/dbraw/zinc/67/75/71/1337677571.db2.gz PVKKQKRMYGHDSG-IBGZPJMESA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H]2CCC[C@H]([NH+](C)C)C2)cc1C ZINC001366585262 1337722786 /nfs/dbraw/zinc/72/27/86/1337722786.db2.gz OKSJYFIVNDKJCF-UXHICEINSA-N 1 3 345.531 2.972 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](C)CC[C@H]1CCCC1(F)F ZINC001366595420 1337733000 /nfs/dbraw/zinc/73/30/00/1337733000.db2.gz JPUDQHTUSLTAIX-CVEARBPZSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC001366595420 1337733002 /nfs/dbraw/zinc/73/30/02/1337733002.db2.gz JPUDQHTUSLTAIX-CVEARBPZSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[N@H+](CCNC(=O)[C@@H](C(C)C)N(C)C)[C@H]1CCc2ccccc21 ZINC001366640401 1337786825 /nfs/dbraw/zinc/78/68/25/1337786825.db2.gz LBTJZZLWLSHCQE-RBUKOAKNSA-N 1 3 331.504 2.698 10 0 EFAEHO CC[N@@H+](CCNC(=O)[C@@H](C(C)C)N(C)C)[C@H]1CCc2ccccc21 ZINC001366640401 1337786827 /nfs/dbraw/zinc/78/68/27/1337786827.db2.gz LBTJZZLWLSHCQE-RBUKOAKNSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCC[N@@H+]1CCc1ccccc1)N1CCCC1 ZINC001366656086 1337805083 /nfs/dbraw/zinc/80/50/83/1337805083.db2.gz FCHHOTBDEIJREO-IBGZPJMESA-N 1 3 343.515 2.684 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCC[N@H+]1CCc1ccccc1)N1CCCC1 ZINC001366656086 1337805088 /nfs/dbraw/zinc/80/50/88/1337805088.db2.gz FCHHOTBDEIJREO-IBGZPJMESA-N 1 3 343.515 2.684 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[N@H+](CCC2CCCCC2)C1)N(C)C ZINC001366690958 1337872329 /nfs/dbraw/zinc/87/23/29/1337872329.db2.gz SIGPAQRLGVIREY-RTBURBONSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[N@@H+](CCC2CCCCC2)C1)N(C)C ZINC001366690958 1337872336 /nfs/dbraw/zinc/87/23/36/1337872336.db2.gz SIGPAQRLGVIREY-RTBURBONSA-N 1 3 337.552 2.981 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCN(Cc2ccsc2)C1 ZINC001366701312 1337890275 /nfs/dbraw/zinc/89/02/75/1337890275.db2.gz KIKGZENOAJCYHI-WBVHZDCISA-N 1 3 335.517 2.561 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCN(Cc2ccsc2)C1 ZINC001366701312 1337890276 /nfs/dbraw/zinc/89/02/76/1337890276.db2.gz KIKGZENOAJCYHI-WBVHZDCISA-N 1 3 335.517 2.561 10 0 EFAEHO Cc1cccc(CN(CCNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)C2CC2)c1 ZINC001366753639 1337970503 /nfs/dbraw/zinc/97/05/03/1337970503.db2.gz PDEXLVQBCHVHTL-HKUYNNGSSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1cccc(CN(CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)C2CC2)c1 ZINC001366753639 1337970506 /nfs/dbraw/zinc/97/05/06/1337970506.db2.gz PDEXLVQBCHVHTL-HKUYNNGSSA-N 1 3 343.515 2.806 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+][C@@H]1CCc2c1cccc2Cl ZINC001366775199 1337993866 /nfs/dbraw/zinc/99/38/66/1337993866.db2.gz NRPITJRDKUGKCL-QGZVFWFLSA-N 1 3 337.895 2.716 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H](C)[NH2+]CCC(C)(C)C)CC1 ZINC001366782679 1338001000 /nfs/dbraw/zinc/00/10/00/1338001000.db2.gz MVLCICIHBFEJDU-MRXNPFEDSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@H]([NH2+]C/C(Cl)=C\Cl)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001366789731 1338007495 /nfs/dbraw/zinc/00/74/95/1338007495.db2.gz GZRQPGNIWOWCDN-MCGVVMAKSA-N 1 3 348.318 2.616 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001366848502 1338113607 /nfs/dbraw/zinc/11/36/07/1338113607.db2.gz BVTHGUYRVLHOGT-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001366848502 1338113610 /nfs/dbraw/zinc/11/36/10/1338113610.db2.gz BVTHGUYRVLHOGT-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CN(CCF)C[C@H]1CCN(C(=O)[C@@H]2CCCC[N@@H+]2C2CCCC2)C1 ZINC001366865381 1338135208 /nfs/dbraw/zinc/13/52/08/1338135208.db2.gz KKBIVJOWXLKSDY-AEFFLSMTSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)C[C@H]1CCN(C(=O)[C@@H]2CCCC[N@H+]2C2CCCC2)C1 ZINC001366865381 1338135210 /nfs/dbraw/zinc/13/52/10/1338135210.db2.gz KKBIVJOWXLKSDY-AEFFLSMTSA-N 1 3 339.499 2.533 10 0 EFAEHO CCN1CCC[C@@H](N(Cc2ccccc2)C(=O)C[C@H]2CC[N@H+](C)C2)C1 ZINC001366870695 1338142443 /nfs/dbraw/zinc/14/24/43/1338142443.db2.gz JSPGVTFAITWMTA-WOJBJXKFSA-N 1 3 343.515 2.841 10 0 EFAEHO CCN1CCC[C@@H](N(Cc2ccccc2)C(=O)C[C@H]2CC[N@@H+](C)C2)C1 ZINC001366870695 1338142446 /nfs/dbraw/zinc/14/24/46/1338142446.db2.gz JSPGVTFAITWMTA-WOJBJXKFSA-N 1 3 343.515 2.841 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[N@H+](C)C/C=C/c2ccccc2)C1)N(C)C ZINC001366872381 1338145336 /nfs/dbraw/zinc/14/53/36/1338145336.db2.gz PBOZMQRVEOFKNU-KBAGWLGSSA-N 1 3 343.515 2.820 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[N@@H+](C)C/C=C/c2ccccc2)C1)N(C)C ZINC001366872381 1338145338 /nfs/dbraw/zinc/14/53/38/1338145338.db2.gz PBOZMQRVEOFKNU-KBAGWLGSSA-N 1 3 343.515 2.820 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@H](CN(C)Cc2cc(C)ccc2F)C1 ZINC001366879923 1338156487 /nfs/dbraw/zinc/15/64/87/1338156487.db2.gz PBMCFHOUJVGAJW-QGZVFWFLSA-N 1 3 349.494 2.756 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@H](CN(C)Cc2cc(C)ccc2F)C1 ZINC001366879923 1338156489 /nfs/dbraw/zinc/15/64/89/1338156489.db2.gz PBMCFHOUJVGAJW-QGZVFWFLSA-N 1 3 349.494 2.756 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](C[N@H+](C)CCC2CCCCC2)C1 ZINC001366895812 1338179847 /nfs/dbraw/zinc/17/98/47/1338179847.db2.gz AGFMTXNNTOYYEH-MOPGFXCFSA-N 1 3 335.536 2.831 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](C[N@@H+](C)CCC2CCCCC2)C1 ZINC001366895812 1338179850 /nfs/dbraw/zinc/17/98/50/1338179850.db2.gz AGFMTXNNTOYYEH-MOPGFXCFSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CCN(CCc2cccs2)C1)[NH+](CC)CC ZINC001367017554 1338274760 /nfs/dbraw/zinc/27/47/60/1338274760.db2.gz VIXLQWNKVKGCAP-RDJZCZTQSA-N 1 3 337.533 2.602 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCN(CCc2cccs2)C1)[NH+](CC)CC ZINC001367017552 1338275440 /nfs/dbraw/zinc/27/54/40/1338275440.db2.gz VIXLQWNKVKGCAP-DOTOQJQBSA-N 1 3 337.533 2.602 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N1CCCC1 ZINC001367026960 1338284944 /nfs/dbraw/zinc/28/49/44/1338284944.db2.gz YCWVTGALXDJRDK-OALUTQOASA-N 1 3 347.547 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N1CCCC1 ZINC001367026960 1338284948 /nfs/dbraw/zinc/28/49/48/1338284948.db2.gz YCWVTGALXDJRDK-OALUTQOASA-N 1 3 347.547 2.878 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1C[NH+]2CCC1CC2)NCc1ccccc1Cl ZINC001367089971 1338374900 /nfs/dbraw/zinc/37/49/00/1338374900.db2.gz ASFGQUVDQISMLN-IAGOWNOFSA-N 1 3 349.906 2.666 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](CC)[NH2+]Cc1ccc(Cl)c(F)c1)N(C)C ZINC001367135369 1338426617 /nfs/dbraw/zinc/42/66/17/1338426617.db2.gz RXFWMMDZPQFHMC-XJKSGUPXSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001367147258 1338441969 /nfs/dbraw/zinc/44/19/69/1338441969.db2.gz DWLHNALFHGCNNN-LSDHHAIUSA-N 1 3 333.467 2.637 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1cccc(Cl)c1 ZINC001367150132 1338445902 /nfs/dbraw/zinc/44/59/02/1338445902.db2.gz OZQWXKQSDNSIMY-INIZCTEOSA-N 1 3 325.884 2.665 10 0 EFAEHO CC(C)C[NH2+]CC1(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CCCC1 ZINC001367154572 1338451705 /nfs/dbraw/zinc/45/17/05/1338451705.db2.gz BVAOYGHGYGQDHP-LJQANCHMSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@@H](C)C[NH+]1CCC(CCNC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001367213148 1338523617 /nfs/dbraw/zinc/52/36/17/1338523617.db2.gz UOTRDDVUVUJKAF-SJLPKXTDSA-N 1 3 325.541 2.837 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC1CC[NH+](CC[C@@H](C)F)CC1 ZINC001367214093 1338524065 /nfs/dbraw/zinc/52/40/65/1338524065.db2.gz OOHSIMCIZSNCSL-AEFFLSMTSA-N 1 3 341.515 2.827 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001367227189 1338535757 /nfs/dbraw/zinc/53/57/57/1338535757.db2.gz HEYNJJCZINCXQB-FUHWJXTLSA-N 1 3 347.503 2.677 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@@H](C)c1ccc(F)cc1 ZINC001367228600 1338536947 /nfs/dbraw/zinc/53/69/47/1338536947.db2.gz QKYYWEDDPKUTLL-MAUKXSAKSA-N 1 3 335.467 2.808 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H](C)C[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001367248587 1338549942 /nfs/dbraw/zinc/54/99/42/1338549942.db2.gz HREADYAEQOZVPE-WMZOPIPTSA-N 1 3 337.552 2.885 10 0 EFAEHO CC(C)CC[NH+]1CC2(C1)CCN(C(=O)CN(C)CC(C)(C)C)CC2 ZINC001367334997 1338633653 /nfs/dbraw/zinc/63/36/53/1338633653.db2.gz QEBWRYXYTVFCMT-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([C@@H](C)[NH2+]Cc2ccsc2)C1 ZINC001367434244 1338735534 /nfs/dbraw/zinc/73/55/34/1338735534.db2.gz AXLKYVRXHKUJOZ-WBVHZDCISA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccc(F)c(F)c1)C(C)C)N(C)C ZINC001367471499 1338772040 /nfs/dbraw/zinc/77/20/40/1338772040.db2.gz FMXOJLQAZUDVHC-IAGOWNOFSA-N 1 3 341.446 2.535 10 0 EFAEHO CC(C)[C@H](CNC(=O)C(C)(C)[NH+]1CCCC1)NCc1ccccc1F ZINC001367491921 1338791600 /nfs/dbraw/zinc/79/16/00/1338791600.db2.gz WUZDGJOWDCSSIQ-SFHVURJKSA-N 1 3 349.494 2.931 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C(C)C)cc1F ZINC001367492084 1338791622 /nfs/dbraw/zinc/79/16/22/1338791622.db2.gz KDPOPHVKAKRFCB-SFHVURJKSA-N 1 3 337.483 2.705 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2ccccc2C)CC[N@@H+]1C ZINC001367516681 1338816815 /nfs/dbraw/zinc/81/68/15/1338816815.db2.gz LBDZLBRDSPBKEL-RBUKOAKNSA-N 1 3 331.504 2.616 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2ccccc2C)CC[N@H+]1C ZINC001367516681 1338816817 /nfs/dbraw/zinc/81/68/17/1338816817.db2.gz LBDZLBRDSPBKEL-RBUKOAKNSA-N 1 3 331.504 2.616 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001367520744 1338820797 /nfs/dbraw/zinc/82/07/97/1338820797.db2.gz FENQDKQFAGDSFE-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001367520744 1338820801 /nfs/dbraw/zinc/82/08/01/1338820801.db2.gz FENQDKQFAGDSFE-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)CC[C@H]2CCC[N@@H+]2C)cc1 ZINC001367522622 1338822264 /nfs/dbraw/zinc/82/22/64/1338822264.db2.gz LZYPPVSNNHLKSH-LJQANCHMSA-N 1 3 331.504 2.760 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)CC[C@H]2CCC[N@H+]2C)cc1 ZINC001367522622 1338822268 /nfs/dbraw/zinc/82/22/68/1338822268.db2.gz LZYPPVSNNHLKSH-LJQANCHMSA-N 1 3 331.504 2.760 10 0 EFAEHO CN(CC[N@H+](C)CC[C@@H]1CCc2ccccc21)C(=O)CN1CCCC1 ZINC001367549094 1338858741 /nfs/dbraw/zinc/85/87/41/1338858741.db2.gz AKOKPFGKRDPEIN-IBGZPJMESA-N 1 3 343.515 2.593 10 0 EFAEHO CN(CC[N@@H+](C)CC[C@@H]1CCc2ccccc21)C(=O)CN1CCCC1 ZINC001367549094 1338858743 /nfs/dbraw/zinc/85/87/43/1338858743.db2.gz AKOKPFGKRDPEIN-IBGZPJMESA-N 1 3 343.515 2.593 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C(C)C)CC[C@@H]21 ZINC001367552705 1338862716 /nfs/dbraw/zinc/86/27/16/1338862716.db2.gz FOMJBRINTRZCKV-UXHICEINSA-N 1 3 343.515 2.758 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C(C)C)CC[C@@H]21 ZINC001367552705 1338862720 /nfs/dbraw/zinc/86/27/20/1338862720.db2.gz FOMJBRINTRZCKV-UXHICEINSA-N 1 3 343.515 2.758 10 0 EFAEHO CN(CC[N@H+](C)[C@@H]1CCc2c1cccc2Cl)C(=O)CN1CCCC1 ZINC001367552693 1338863022 /nfs/dbraw/zinc/86/30/22/1338863022.db2.gz OVNOLBMKSDCAHC-GOSISDBHSA-N 1 3 349.906 2.813 10 0 EFAEHO CN(CC[N@@H+](C)[C@@H]1CCc2c1cccc2Cl)C(=O)CN1CCCC1 ZINC001367552693 1338863028 /nfs/dbraw/zinc/86/30/28/1338863028.db2.gz OVNOLBMKSDCAHC-GOSISDBHSA-N 1 3 349.906 2.813 10 0 EFAEHO CCN(CC[NH2+][C@H](C)c1cc(C)ccc1C)C(=O)[C@H]1CCCN1C ZINC001367639488 1338894588 /nfs/dbraw/zinc/89/45/88/1338894588.db2.gz IPLRNGGCBKNRQV-IEBWSBKVSA-N 1 3 331.504 2.897 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCc2ccc(Cl)cc21)C(=O)[C@H]1CCCN1C ZINC001367647208 1338902567 /nfs/dbraw/zinc/90/25/67/1338902567.db2.gz XTRSPECIRYUGQN-QZTJIDSGSA-N 1 3 349.906 2.860 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1cc(C)ccc1C ZINC001367731805 1338964034 /nfs/dbraw/zinc/96/40/34/1338964034.db2.gz AJLALCCMZYQJER-IEBWSBKVSA-N 1 3 331.504 2.772 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001367731505 1338964227 /nfs/dbraw/zinc/96/42/27/1338964227.db2.gz KHVNMNDTNSNHKF-HKUYNNGSSA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@@H](NC[C@H](C)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccccc1F ZINC001367755536 1338983097 /nfs/dbraw/zinc/98/30/97/1338983097.db2.gz XFOUCLNBWHHYQT-JONQDZQNSA-N 1 3 335.467 2.711 10 0 EFAEHO C[C@@H](NC[C@H](C)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccccc1F ZINC001367755536 1338983100 /nfs/dbraw/zinc/98/31/00/1338983100.db2.gz XFOUCLNBWHHYQT-JONQDZQNSA-N 1 3 335.467 2.711 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C(F)F)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001367761856 1338988439 /nfs/dbraw/zinc/98/84/39/1338988439.db2.gz VOFMRBJNCPCDRG-KGLIPLIRSA-N 1 3 339.430 2.560 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+][C@H](C)c1ccc(Cl)cc1 ZINC001367774111 1338998645 /nfs/dbraw/zinc/99/86/45/1338998645.db2.gz HJXZCOGUVDYHCY-UONOGXRCSA-N 1 3 325.884 2.836 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCCN2CC)c1 ZINC001367776237 1339001007 /nfs/dbraw/zinc/00/10/07/1339001007.db2.gz YJYLIRXGZQXRDD-LPHOPBHVSA-N 1 3 331.504 2.718 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(C)c(F)c1 ZINC001367802223 1339022266 /nfs/dbraw/zinc/02/22/66/1339022266.db2.gz IYLYYFAQDCYUGL-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(C)c(F)c1 ZINC001367802223 1339022267 /nfs/dbraw/zinc/02/22/67/1339022267.db2.gz IYLYYFAQDCYUGL-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(Cl)c1)NC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001367802561 1339022685 /nfs/dbraw/zinc/02/26/85/1339022685.db2.gz FGJZOXKVTPWPIR-KBXCAEBGSA-N 1 3 349.906 2.618 10 0 EFAEHO Cc1ccccc1CCC[N@@H+](C)C[C@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001367834560 1339050684 /nfs/dbraw/zinc/05/06/84/1339050684.db2.gz NEFHDKOJFNIPGW-MJGOQNOKSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccccc1CCC[N@H+](C)C[C@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001367834560 1339050687 /nfs/dbraw/zinc/05/06/87/1339050687.db2.gz NEFHDKOJFNIPGW-MJGOQNOKSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@@H](CN(C)C/C=C\c1ccccc1)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001367839562 1339056517 /nfs/dbraw/zinc/05/65/17/1339056517.db2.gz YGYFYLAKJKUSIN-WSYIAORVSA-N 1 3 343.515 2.867 10 0 EFAEHO C[C@@H](CN(C)C/C=C\c1ccccc1)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001367839562 1339056519 /nfs/dbraw/zinc/05/65/19/1339056519.db2.gz YGYFYLAKJKUSIN-WSYIAORVSA-N 1 3 343.515 2.867 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)C[N@H+](C)CC1CC(F)(F)C1 ZINC001367840059 1339056915 /nfs/dbraw/zinc/05/69/15/1339056915.db2.gz XFRNIZJYEIGZRJ-ZBFHGGJFSA-N 1 3 345.478 2.731 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)C[N@@H+](C)CC1CC(F)(F)C1 ZINC001367840059 1339056918 /nfs/dbraw/zinc/05/69/18/1339056918.db2.gz XFRNIZJYEIGZRJ-ZBFHGGJFSA-N 1 3 345.478 2.731 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)Cc1ccc(C2CC2)cc1 ZINC001367860817 1339075628 /nfs/dbraw/zinc/07/56/28/1339075628.db2.gz KOOWOFHIASFZEB-INIZCTEOSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc(C2CC2)cc1 ZINC001367860817 1339075630 /nfs/dbraw/zinc/07/56/30/1339075630.db2.gz KOOWOFHIASFZEB-INIZCTEOSA-N 1 3 331.504 2.841 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H](NC(=O)[C@H]2CCCN2C(C)C)C2CC2)c1 ZINC001367908556 1339099367 /nfs/dbraw/zinc/09/93/67/1339099367.db2.gz XYCHDXRNEZPCTN-VQTJNVASSA-N 1 3 343.515 2.852 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@@H](CNCc1ccccc1F)C1CC1 ZINC001367909633 1339100642 /nfs/dbraw/zinc/10/06/42/1339100642.db2.gz RJPSJFHUJCIDLX-HKUYNNGSSA-N 1 3 347.478 2.685 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@@H](CNCc1ccccc1F)C1CC1 ZINC001367909633 1339100644 /nfs/dbraw/zinc/10/06/44/1339100644.db2.gz RJPSJFHUJCIDLX-HKUYNNGSSA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+][C@@H]1CCc2c1cccc2F)C1CC1 ZINC001367919606 1339107834 /nfs/dbraw/zinc/10/78/34/1339107834.db2.gz LMUSPVVHJJPSLN-MOPGFXCFSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]Cc1ccc(F)cc1 ZINC001367926387 1339112186 /nfs/dbraw/zinc/11/21/86/1339112186.db2.gz GMVPYACIJOAUPU-PKOBYXMFSA-N 1 3 349.494 2.883 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC[C@@H]2CCN2[C@H]2CCc3ccccc32)CC1 ZINC001367960009 1339129154 /nfs/dbraw/zinc/12/91/54/1339129154.db2.gz HZXIARZXNPMLBV-ICSRJNTNSA-N 1 3 341.499 2.596 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]C[C@H]2CCC(F)(F)C2)CC1)N1CCCC1 ZINC001368011180 1339156549 /nfs/dbraw/zinc/15/65/49/1339156549.db2.gz BZAYQJILCWHIBA-AWEZNQCLSA-N 1 3 343.462 2.535 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NCC2(N[C@@H]3CCc4ccc(Cl)cc43)CC2)C1 ZINC001368034667 1339167923 /nfs/dbraw/zinc/16/79/23/1339167923.db2.gz JMFUNPWLDJHTOM-WMLDXEAASA-N 1 3 347.890 2.517 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NCC2(N[C@@H]3CCc4ccc(Cl)cc43)CC2)C1 ZINC001368034667 1339167924 /nfs/dbraw/zinc/16/79/24/1339167924.db2.gz JMFUNPWLDJHTOM-WMLDXEAASA-N 1 3 347.890 2.517 10 0 EFAEHO Cc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)CC[NH+](C)C)cc1 ZINC001368043093 1339172509 /nfs/dbraw/zinc/17/25/09/1339172509.db2.gz KPTVQPNHKACUGC-MOPGFXCFSA-N 1 3 329.488 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+][C@@H]2CCc3c2cccc3Cl)CC1 ZINC001368043372 1339172781 /nfs/dbraw/zinc/17/27/81/1339172781.db2.gz ONMVUWNLHZLWJS-QGZVFWFLSA-N 1 3 349.906 2.906 10 0 EFAEHO CC[C@@H](C)C[N@H+](CC1CC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001368051923 1339177787 /nfs/dbraw/zinc/17/77/87/1339177787.db2.gz SFIPXMFANIKRSJ-QGZVFWFLSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@@H](C)C[N@@H+](CC1CC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001368051923 1339177788 /nfs/dbraw/zinc/17/77/88/1339177788.db2.gz SFIPXMFANIKRSJ-QGZVFWFLSA-N 1 3 335.536 2.831 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)cc1 ZINC001368109388 1339197817 /nfs/dbraw/zinc/19/78/17/1339197817.db2.gz RVDRQEWCQMQBDL-HKUYNNGSSA-N 1 3 331.504 2.804 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001368195232 1339248313 /nfs/dbraw/zinc/24/83/13/1339248313.db2.gz KDUNWAYRZQSGAE-CRAIPNDOSA-N 1 3 329.504 2.541 10 0 EFAEHO CCC(CC)C[NH+]1CCC(C)(CNC(=O)CN(C)C(C)C)CC1 ZINC001368212054 1339258625 /nfs/dbraw/zinc/25/86/25/1339258625.db2.gz UULRDXZQXPZWKF-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)NC[C@@]1(C)CCC[N@H+](Cc2ccccc2)C1)N(C)C ZINC001368230586 1339275332 /nfs/dbraw/zinc/27/53/32/1339275332.db2.gz NDNQFBJPBHCKMP-UYAOXDASSA-N 1 3 331.504 2.745 10 0 EFAEHO CC[C@H](C(=O)NC[C@@]1(C)CCC[N@@H+](Cc2ccccc2)C1)N(C)C ZINC001368230586 1339275334 /nfs/dbraw/zinc/27/53/34/1339275334.db2.gz NDNQFBJPBHCKMP-UYAOXDASSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@]1(C)CCC[N@H+](CCCF)C1 ZINC001368233230 1339277741 /nfs/dbraw/zinc/27/77/41/1339277741.db2.gz ZRMBKDZEIRZLPU-HKUYNNGSSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@]1(C)CCC[N@@H+](CCCF)C1 ZINC001368233230 1339277743 /nfs/dbraw/zinc/27/77/43/1339277743.db2.gz ZRMBKDZEIRZLPU-HKUYNNGSSA-N 1 3 341.515 2.827 10 0 EFAEHO CCc1ccccc1[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]C(C)C ZINC001368326280 1339298801 /nfs/dbraw/zinc/29/88/01/1339298801.db2.gz CYGNBAZMPLLCOW-GOSISDBHSA-N 1 3 331.504 2.889 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001368344934 1339309038 /nfs/dbraw/zinc/30/90/38/1339309038.db2.gz FSNNRTQPAXKZIF-NCXUSEDFSA-N 1 3 337.552 2.887 10 0 EFAEHO CN(C[C@@H]1CCN1CC[C@H]1CCCC1(F)F)C(=O)CCC[NH+](C)C ZINC001368399788 1339334883 /nfs/dbraw/zinc/33/48/83/1339334883.db2.gz KZFVJEVYENJRNM-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]CC[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001368418515 1339352081 /nfs/dbraw/zinc/35/20/81/1339352081.db2.gz LJAZRLOJIXYLFE-RTBURBONSA-N 1 3 343.515 2.980 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCc1ccccc1C[N@@H+](C)CC(C)C ZINC001368419666 1339353318 /nfs/dbraw/zinc/35/33/18/1339353318.db2.gz CXYXDDQFYHFZAB-UHFFFAOYSA-N 1 3 328.460 2.665 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCc1ccccc1C[N@H+](C)CC(C)C ZINC001368419666 1339353322 /nfs/dbraw/zinc/35/33/22/1339353322.db2.gz CXYXDDQFYHFZAB-UHFFFAOYSA-N 1 3 328.460 2.665 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](CC1CCCCC1)CC2 ZINC001368419679 1339353477 /nfs/dbraw/zinc/35/34/77/1339353477.db2.gz AQGFXQCQZQESEQ-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)C[C@@H]1CCN1CC[C@@H]1CCCC1(F)F ZINC001368419899 1339353764 /nfs/dbraw/zinc/35/37/64/1339353764.db2.gz KJRGPXXRFZEQFJ-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)C[C@@H]1CCN1CC[C@@H]1CCCC1(F)F ZINC001368419899 1339353767 /nfs/dbraw/zinc/35/37/67/1339353767.db2.gz KJRGPXXRFZEQFJ-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+][C@@H]2CCc3ccccc32)C1 ZINC001368425529 1339359080 /nfs/dbraw/zinc/35/90/80/1339359080.db2.gz TWWBINDQEIJLMO-YLJYHZDGSA-N 1 3 343.515 2.844 10 0 EFAEHO CC(C)C[C@H](C)C[NH+]1CCC2(CN(C(=O)Cc3c[nH]cn3)C2)CC1 ZINC001368424047 1339359329 /nfs/dbraw/zinc/35/93/29/1339359329.db2.gz PQPUBZXZIFNNPP-INIZCTEOSA-N 1 3 332.492 2.559 10 0 EFAEHO CC(C)C[N@@H+]1CCc2c(CNC(=O)[C@@H](C(C)C)N(C)C)cccc2C1 ZINC001368448065 1339384481 /nfs/dbraw/zinc/38/44/81/1339384481.db2.gz LZUZUGRLSZEBQG-HXUWFJFHSA-N 1 3 345.531 2.903 10 0 EFAEHO CC(C)C[N@H+]1CCc2c(CNC(=O)[C@@H](C(C)C)N(C)C)cccc2C1 ZINC001368448065 1339384486 /nfs/dbraw/zinc/38/44/86/1339384486.db2.gz LZUZUGRLSZEBQG-HXUWFJFHSA-N 1 3 345.531 2.903 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)C(C)(C)N3CCCC3)CCC2)cc1 ZINC001368482337 1339419139 /nfs/dbraw/zinc/41/91/39/1339419139.db2.gz CJHHGLMYMGFLTH-UHFFFAOYSA-N 1 3 343.515 2.998 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]Cc2ccsc2)CCC1)N1CCCC1 ZINC001368482425 1339419561 /nfs/dbraw/zinc/41/95/61/1339419561.db2.gz DFTJQTBVGIEKLJ-UHFFFAOYSA-N 1 3 335.517 2.751 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]Cc2ccc(F)cc2)CCC1 ZINC001368494286 1339431884 /nfs/dbraw/zinc/43/18/84/1339431884.db2.gz CZESVUDWDYBZSV-HOTGVXAUSA-N 1 3 347.478 2.827 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+](C)CCCN(C)C(=O)CN2CCCC2)c1 ZINC001368567823 1339516992 /nfs/dbraw/zinc/51/69/92/1339516992.db2.gz UTMTWVLAZREJMT-UHFFFAOYSA-N 1 3 331.504 2.680 10 0 EFAEHO Cc1ccc(C)c(C[N@H+](C)CCCN(C)C(=O)CN2CCCC2)c1 ZINC001368567823 1339516995 /nfs/dbraw/zinc/51/69/95/1339516995.db2.gz UTMTWVLAZREJMT-UHFFFAOYSA-N 1 3 331.504 2.680 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2C[C@H]([NH2+][C@H]3CCc4ccccc43)C2)C1 ZINC001368592000 1339538081 /nfs/dbraw/zinc/53/80/81/1339538081.db2.gz POVHQFOTEJZRNX-DUPRYPCISA-N 1 3 341.499 2.500 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccccc2F)C1)C1CCC1 ZINC001368641367 1339561716 /nfs/dbraw/zinc/56/17/16/1339561716.db2.gz PFVQZGKSHHUADV-DOTOQJQBSA-N 1 3 347.478 2.685 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C)([NH2+]CCc2ccc(C)cc2)CC1)N(C)C ZINC001368650814 1339566187 /nfs/dbraw/zinc/56/61/87/1339566187.db2.gz CLANTNPWNCCINS-IBGZPJMESA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+]C1(C)CCN(C(=O)CN(C)C(C)C)CC1 ZINC001368672743 1339586592 /nfs/dbraw/zinc/58/65/92/1339586592.db2.gz UTYAYASPHYNXPO-KRWDZBQOSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)CN(C)C2CCC2)CC[N@@H+]1Cc1ccsc1 ZINC001368693300 1339608516 /nfs/dbraw/zinc/60/85/16/1339608516.db2.gz LDQZXVPIZXVDDJ-ZBFHGGJFSA-N 1 3 335.517 2.702 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)CN(C)C2CCC2)CC[N@H+]1Cc1ccsc1 ZINC001368693300 1339608520 /nfs/dbraw/zinc/60/85/20/1339608520.db2.gz LDQZXVPIZXVDDJ-ZBFHGGJFSA-N 1 3 335.517 2.702 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+]1CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]1C ZINC001368695742 1339610247 /nfs/dbraw/zinc/61/02/47/1339610247.db2.gz KDALSRMNUBSUMS-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+]1CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]1C ZINC001368695742 1339610249 /nfs/dbraw/zinc/61/02/49/1339610249.db2.gz KDALSRMNUBSUMS-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCCCC[C@@H]([NH2+]C/C=C\Cl)C1)N(C)C ZINC001368753837 1339678520 /nfs/dbraw/zinc/67/85/20/1339678520.db2.gz BTBLDSOPHCDZDE-GPPWAPFKSA-N 1 3 329.916 2.686 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccc3c(c2)CCC3)[C@@H]1C ZINC001368796791 1339728234 /nfs/dbraw/zinc/72/82/34/1339728234.db2.gz UQJLKRBGLDKAML-UZLBHIALSA-N 1 3 343.515 2.596 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccc3c(c2)CCC3)[C@@H]1C ZINC001368796791 1339728237 /nfs/dbraw/zinc/72/82/37/1339728237.db2.gz UQJLKRBGLDKAML-UZLBHIALSA-N 1 3 343.515 2.596 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]C[C@@H]2CCCC(F)(F)C2)C1 ZINC001368823953 1339764014 /nfs/dbraw/zinc/76/40/14/1339764014.db2.gz ROOULDAMFWNELX-QQFBHYJXSA-N 1 3 345.478 2.638 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001368840828 1339780272 /nfs/dbraw/zinc/78/02/72/1339780272.db2.gz LUJHEWZFPQOZME-KBPBESRZSA-N 1 3 337.895 2.807 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)[C@@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001368879116 1339814459 /nfs/dbraw/zinc/81/44/59/1339814459.db2.gz UEZQAXARDXWTCQ-JKSUJKDBSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@H](NC(=O)CN(C)CC(C)(C)C)[C@H](C)[NH2+]CC1CC(C)(C)C1 ZINC001368882640 1339818096 /nfs/dbraw/zinc/81/80/96/1339818096.db2.gz ULRNWIULHKKCOT-GJZGRUSLSA-N 1 3 325.541 2.883 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NCC(C)(C)C1CCCC1 ZINC001368887943 1339824778 /nfs/dbraw/zinc/82/47/78/1339824778.db2.gz JCRMZCKIQDZEDA-INIZCTEOSA-N 1 3 340.556 2.774 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NCC(C)(C)C1CCCC1 ZINC001368887943 1339824782 /nfs/dbraw/zinc/82/47/82/1339824782.db2.gz JCRMZCKIQDZEDA-INIZCTEOSA-N 1 3 340.556 2.774 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@H+](CCc2ccccc2)CC1(C)C)N(C)C ZINC001369113316 1339924677 /nfs/dbraw/zinc/92/46/77/1339924677.db2.gz CXWWFIODCWOIHH-MOPGFXCFSA-N 1 3 345.531 2.642 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@@H+](CCc2ccccc2)CC1(C)C)N(C)C ZINC001369113316 1339924681 /nfs/dbraw/zinc/92/46/81/1339924681.db2.gz CXWWFIODCWOIHH-MOPGFXCFSA-N 1 3 345.531 2.642 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)[C@@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001369140857 1339938855 /nfs/dbraw/zinc/93/88/55/1339938855.db2.gz JIBSTQKSLMDBIG-WTGUMLROSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)[C@@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001369140857 1339938859 /nfs/dbraw/zinc/93/88/59/1339938859.db2.gz JIBSTQKSLMDBIG-WTGUMLROSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+][C@H](C)c1ccc(F)cc1)C1CC1 ZINC001370280148 1340006247 /nfs/dbraw/zinc/00/62/47/1340006247.db2.gz YMUDLBKTJWDJFT-KDOFPFPSSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H]([NH2+]CC[C@H]2CCCC2(F)F)C1)N(C)C ZINC001370521345 1340113555 /nfs/dbraw/zinc/11/35/55/1340113555.db2.gz RUPFRDZJFYOOHF-KLHDSHLOSA-N 1 3 345.478 2.635 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H]([NH2+]CC[C@@H]2CCCC2(F)F)C1)N(C)C ZINC001370521348 1340113633 /nfs/dbraw/zinc/11/36/33/1340113633.db2.gz RUPFRDZJFYOOHF-YHUYYLMFSA-N 1 3 345.478 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2F)C1 ZINC001370565860 1340136819 /nfs/dbraw/zinc/13/68/19/1340136819.db2.gz SOGBAKLKNWMGBB-SHTZXODSSA-N 1 3 341.858 2.556 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@H]2[C@@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001370591169 1340152287 /nfs/dbraw/zinc/15/22/87/1340152287.db2.gz LNEPSRMHPXIZBJ-WMZOPIPTSA-N 1 3 332.492 2.701 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001370591169 1340152288 /nfs/dbraw/zinc/15/22/88/1340152288.db2.gz LNEPSRMHPXIZBJ-WMZOPIPTSA-N 1 3 332.492 2.701 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2sccc2Cl)C1 ZINC001370711894 1340187887 /nfs/dbraw/zinc/18/78/87/1340187887.db2.gz MDZIEILEVRUWJI-BETUJISGSA-N 1 3 343.924 2.870 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2sccc2Cl)C1 ZINC001370711894 1340187889 /nfs/dbraw/zinc/18/78/89/1340187889.db2.gz MDZIEILEVRUWJI-BETUJISGSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1C[C@@H]([NH2+]C/C=C\c2ccccc2)C1 ZINC001370738626 1340193542 /nfs/dbraw/zinc/19/35/42/1340193542.db2.gz XWDOOCLATZBQPI-WQFIYFQTSA-N 1 3 341.499 2.809 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@H+](Cc2ccc(F)cc2)C1 ZINC001370971107 1340316212 /nfs/dbraw/zinc/31/62/12/1340316212.db2.gz PFSIGDGGSUSLGC-WMZOPIPTSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](Cc2ccc(F)cc2)C1 ZINC001370971107 1340316214 /nfs/dbraw/zinc/31/62/14/1340316214.db2.gz PFSIGDGGSUSLGC-WMZOPIPTSA-N 1 3 349.494 2.883 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001371828923 1340706821 /nfs/dbraw/zinc/70/68/21/1340706821.db2.gz FGMVLKUIRGMPHM-YJBOKZPZSA-N 1 3 331.504 2.630 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@@H](C)NCc1c(F)cccc1F)[NH+](C)C ZINC001371870806 1340732770 /nfs/dbraw/zinc/73/27/70/1340732770.db2.gz XANGWNZVJUUHCL-CXAGYDPISA-N 1 3 341.446 2.535 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1ccccc1Cl)N(C)C ZINC001371870876 1340732900 /nfs/dbraw/zinc/73/29/00/1340732900.db2.gz YNRKPGKTPWEKOV-CZUORRHYSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[C@H](C(=O)NCC[N@H+](C1CC1)[C@@H]1CCc2ccccc21)N(C)C ZINC001372829845 1340824644 /nfs/dbraw/zinc/82/46/44/1340824644.db2.gz CVCCZXFPBZDOGX-RTBURBONSA-N 1 3 329.488 2.595 10 0 EFAEHO CC[C@H](C(=O)NCC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21)N(C)C ZINC001372829845 1340824647 /nfs/dbraw/zinc/82/46/47/1340824647.db2.gz CVCCZXFPBZDOGX-RTBURBONSA-N 1 3 329.488 2.595 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)NCC[C@H]1CCN(C/C=C\Cl)C1 ZINC001373186638 1340938638 /nfs/dbraw/zinc/93/86/38/1340938638.db2.gz BMNWBVYOEUJUTQ-HBKWROQRSA-N 1 3 341.927 2.688 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NCC[C@H]1CCN(C/C=C\Cl)C1 ZINC001373186638 1340938639 /nfs/dbraw/zinc/93/86/39/1340938639.db2.gz BMNWBVYOEUJUTQ-HBKWROQRSA-N 1 3 341.927 2.688 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N2CC[C@H](CN(C)C/C=C/Cl)C2)C1 ZINC001373295716 1340980579 /nfs/dbraw/zinc/98/05/79/1340980579.db2.gz XKBYSOKHRYQHGG-VBXGELDYSA-N 1 3 341.927 2.641 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N2CC[C@H](CN(C)C/C=C/Cl)C2)C1 ZINC001373295716 1340980581 /nfs/dbraw/zinc/98/05/81/1340980581.db2.gz XKBYSOKHRYQHGG-VBXGELDYSA-N 1 3 341.927 2.641 10 0 EFAEHO CC[C@H](F)CN(C)C[C@@H]1CCN(C(=O)CCC[NH+]2CCCCC2)C1 ZINC001373308197 1340984771 /nfs/dbraw/zinc/98/47/71/1340984771.db2.gz AQVJLNICMFCLES-ROUUACIJSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCC[C@H]([NH2+]C/C=C/Cl)C2)C1 ZINC001373356848 1341000935 /nfs/dbraw/zinc/00/09/35/1341000935.db2.gz JARHTDMQXWPYHY-LTATYCHUSA-N 1 3 345.890 2.532 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCCN(Cc2ccccc2C2CC2)C1 ZINC001373383288 1341006891 /nfs/dbraw/zinc/00/68/91/1341006891.db2.gz RMKRKVRBMSTGFG-GOSISDBHSA-N 1 3 329.488 2.596 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@@H]2C[C@H]1CN2Cc1cccc2ccccc21 ZINC001373573693 1341057577 /nfs/dbraw/zinc/05/75/77/1341057577.db2.gz FFMQNSWFOPBUKO-OALUTQOASA-N 1 3 337.467 2.577 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N1CC[C@H](N(C)C(=O)CC[NH+](C)C)C1 ZINC001373678044 1341095766 /nfs/dbraw/zinc/09/57/66/1341095766.db2.gz ANRIKLIVOLUMFZ-ZWKOTPCHSA-N 1 3 335.467 2.761 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]CC1CC2(CCC2)C1 ZINC001373753291 1341134590 /nfs/dbraw/zinc/13/45/90/1341134590.db2.gz MFYWNMVYSISCTD-ROUUACIJSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1csc(C)c1 ZINC001373778761 1341143580 /nfs/dbraw/zinc/14/35/80/1341143580.db2.gz ATTZGHVGTZWABL-INIZCTEOSA-N 1 3 337.533 2.915 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccccc1C1CC1 ZINC001373797873 1341152143 /nfs/dbraw/zinc/15/21/43/1341152143.db2.gz NIIRJOMVAAQEPK-LPHOPBHVSA-N 1 3 343.515 2.890 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]CC1CCC(F)(F)CC1 ZINC001373800481 1341152817 /nfs/dbraw/zinc/15/28/17/1341152817.db2.gz YBERTTVOVCUNAA-GOEBONIOSA-N 1 3 345.478 2.638 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CCC(F)(F)CC1 ZINC001373800483 1341153141 /nfs/dbraw/zinc/15/31/41/1341153141.db2.gz YBERTTVOVCUNAA-ZBFHGGJFSA-N 1 3 345.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@]1(C[NH2+]Cc2cccnc2)CCCC[C@@H]1C ZINC001373902983 1341197039 /nfs/dbraw/zinc/19/70/39/1341197039.db2.gz MLPFUDCKJWNPCJ-FXAWDEMLSA-N 1 3 346.519 2.577 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1ccc(C[NH2+]Cc2ccccc2)cc1 ZINC001373931214 1341212053 /nfs/dbraw/zinc/21/20/53/1341212053.db2.gz CFSNRLRESIQIJT-UHFFFAOYSA-N 1 3 339.483 2.933 10 0 EFAEHO CC[C@H](F)CN1CCC(CCNC(=O)CC[NH+]2CCCCC2)CC1 ZINC001373951228 1341243026 /nfs/dbraw/zinc/24/30/26/1341243026.db2.gz GTADZPPIZQVSEU-SFHVURJKSA-N 1 3 341.515 2.829 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+][C@@H](C)c1ccccc1 ZINC001374053036 1341340825 /nfs/dbraw/zinc/34/08/25/1341340825.db2.gz OMMZGGUXCTYLKE-SJORKVTESA-N 1 3 331.504 2.964 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)C[NH2+]Cc1ccc(C2CC2)cc1 ZINC001374069695 1341360755 /nfs/dbraw/zinc/36/07/55/1341360755.db2.gz CFEDOKRVZRTICF-DLBZAZTESA-N 1 3 343.515 2.748 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001374276900 1341648101 /nfs/dbraw/zinc/64/81/01/1341648101.db2.gz BOGATCMQUTVRRP-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO CC[C@@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001374284343 1341657607 /nfs/dbraw/zinc/65/76/07/1341657607.db2.gz USUNYZDEZHCIRC-MJGOQNOKSA-N 1 3 333.520 2.889 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1c(C)cccc1Cl)N(C)C ZINC001374311558 1341699600 /nfs/dbraw/zinc/69/96/00/1341699600.db2.gz HMPASUDHEMHSLN-RHSMWYFYSA-N 1 3 339.911 2.925 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccccc1)N(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001392103531 1355767798 /nfs/dbraw/zinc/76/77/98/1355767798.db2.gz VTSMJSKUZLVYFZ-UZLBHIALSA-N 1 3 349.494 2.836 10 0 EFAEHO C[C@H](C[NH2+]Cc1cccc(C(F)F)c1)N(C)C(=O)CN1CCCC1 ZINC001374323130 1341723277 /nfs/dbraw/zinc/72/32/77/1341723277.db2.gz ANWUGKSULQTFTL-CQSZACIVSA-N 1 3 339.430 2.657 10 0 EFAEHO CC(C)C[C@H](C[NH2+]C(C)C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001374354147 1341783367 /nfs/dbraw/zinc/78/33/67/1341783367.db2.gz QHYAEYNVQOQDEW-CRAIPNDOSA-N 1 3 329.504 2.728 10 0 EFAEHO C[N@H+](CCC1CCN(C(=O)CN2CCCC2)CC1)Cc1ccccc1 ZINC001374406111 1341876302 /nfs/dbraw/zinc/87/63/02/1341876302.db2.gz PKCFARJTDCEOOE-UHFFFAOYSA-N 1 3 343.515 2.843 10 0 EFAEHO C[N@@H+](CCC1CCN(C(=O)CN2CCCC2)CC1)Cc1ccccc1 ZINC001374406111 1341876306 /nfs/dbraw/zinc/87/63/06/1341876306.db2.gz PKCFARJTDCEOOE-UHFFFAOYSA-N 1 3 343.515 2.843 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]C/C=C\Cl ZINC001374438637 1341921901 /nfs/dbraw/zinc/92/19/01/1341921901.db2.gz HRVFMSUMFANKAV-LTSYXSSYSA-N 1 3 329.916 2.732 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1ccccc1Cl)C(C)C)N(C)C ZINC001374443489 1341927386 /nfs/dbraw/zinc/92/73/86/1341927386.db2.gz KPGAFCPDDHPHJF-DLBZAZTESA-N 1 3 339.911 2.911 10 0 EFAEHO CN(CC(=O)N(C)CC[N@H+](C)C[C@H]1CCC(F)(F)C1)CC(C)(C)C ZINC001374536654 1342037773 /nfs/dbraw/zinc/03/77/73/1342037773.db2.gz MLHFQSGSJDTSII-HNNXBMFYSA-N 1 3 347.494 2.790 10 0 EFAEHO CN(CC(=O)N(C)CC[N@@H+](C)C[C@H]1CCC(F)(F)C1)CC(C)(C)C ZINC001374536654 1342037779 /nfs/dbraw/zinc/03/77/79/1342037779.db2.gz MLHFQSGSJDTSII-HNNXBMFYSA-N 1 3 347.494 2.790 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@@H]2CCC[C@H]3CCC[N@@H+]32)cc1 ZINC001374544418 1342048810 /nfs/dbraw/zinc/04/88/10/1342048810.db2.gz HGQPBSYRWSIICM-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@@H]2CCC[C@H]3CCC[N@H+]32)cc1 ZINC001374544418 1342048814 /nfs/dbraw/zinc/04/88/14/1342048814.db2.gz HGQPBSYRWSIICM-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO C[C@@H](c1ccc(Cl)cc1)[N@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001374555919 1342067676 /nfs/dbraw/zinc/06/76/76/1342067676.db2.gz GPQYNEWMDMSKEN-HNNXBMFYSA-N 1 3 337.895 2.887 10 0 EFAEHO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001374555919 1342067684 /nfs/dbraw/zinc/06/76/84/1342067684.db2.gz GPQYNEWMDMSKEN-HNNXBMFYSA-N 1 3 337.895 2.887 10 0 EFAEHO C[C@H](c1ccc(Cl)cc1)[N@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001374555921 1342067720 /nfs/dbraw/zinc/06/77/20/1342067720.db2.gz GPQYNEWMDMSKEN-OAHLLOKOSA-N 1 3 337.895 2.887 10 0 EFAEHO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001374555921 1342067724 /nfs/dbraw/zinc/06/77/24/1342067724.db2.gz GPQYNEWMDMSKEN-OAHLLOKOSA-N 1 3 337.895 2.887 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]1C[NH2+]Cc1cccc(F)c1 ZINC001374569551 1342082301 /nfs/dbraw/zinc/08/23/01/1342082301.db2.gz MTODIVIXSIQSOX-AEFFLSMTSA-N 1 3 335.467 2.540 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@H]2CCC[N@H+]2CC(C)C)c1 ZINC001374780132 1342166846 /nfs/dbraw/zinc/16/68/46/1342166846.db2.gz VOGHVIQHWDJAEF-VQIMIIECSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@H]2CCC[N@@H+]2CC(C)C)c1 ZINC001374780132 1342166850 /nfs/dbraw/zinc/16/68/50/1342166850.db2.gz VOGHVIQHWDJAEF-VQIMIIECSA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@H](C[NH2+]CC1CCC2(CC2)CC1)NC(=O)C(C)(C)N1CCCC1 ZINC001374799489 1342178170 /nfs/dbraw/zinc/17/81/70/1342178170.db2.gz SANQAUOOJJYAHG-MRXNPFEDSA-N 1 3 335.536 2.926 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N[C@@H](C)CNCc2ccccc2F)C1 ZINC001374927603 1342246017 /nfs/dbraw/zinc/24/60/17/1342246017.db2.gz JONKCAQAVFDPFV-DOTOQJQBSA-N 1 3 335.467 2.542 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N[C@@H](C)CNCc2ccccc2F)C1 ZINC001374927603 1342246021 /nfs/dbraw/zinc/24/60/21/1342246021.db2.gz JONKCAQAVFDPFV-DOTOQJQBSA-N 1 3 335.467 2.542 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@H](C)NC(=O)[C@H]1CCCCN1C(C)C ZINC001374938732 1342253981 /nfs/dbraw/zinc/25/39/81/1342253981.db2.gz ALTNPSHHWCYUPY-QFBILLFUSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@@H](C)[NH+]2CCCCCC2)c1 ZINC001374940407 1342255140 /nfs/dbraw/zinc/25/51/40/1342255140.db2.gz OXZLPKRFOSNVBP-DLBZAZTESA-N 1 3 349.494 2.993 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@H](C)[NH+]2CCCCCC2)c1 ZINC001374940410 1342255360 /nfs/dbraw/zinc/25/53/60/1342255360.db2.gz OXZLPKRFOSNVBP-IRXDYDNUSA-N 1 3 349.494 2.993 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001375101092 1342409763 /nfs/dbraw/zinc/40/97/63/1342409763.db2.gz HCKIKEJUQAOOEL-SJLPKXTDSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C)c(C[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001375101092 1342409765 /nfs/dbraw/zinc/40/97/65/1342409765.db2.gz HCKIKEJUQAOOEL-SJLPKXTDSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001375101091 1342410293 /nfs/dbraw/zinc/41/02/93/1342410293.db2.gz HCKIKEJUQAOOEL-FUHWJXTLSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C)c(C[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001375101091 1342410298 /nfs/dbraw/zinc/41/02/98/1342410298.db2.gz HCKIKEJUQAOOEL-FUHWJXTLSA-N 1 3 331.504 2.582 10 0 EFAEHO C[C@H](C[N@H+](C)CC/C=C\c1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001375105993 1342415808 /nfs/dbraw/zinc/41/58/08/1342415808.db2.gz VKWPVEUOBGHHQV-OFIWPEFUSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@H](C[N@@H+](C)CC/C=C\c1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001375105993 1342415813 /nfs/dbraw/zinc/41/58/13/1342415813.db2.gz VKWPVEUOBGHHQV-OFIWPEFUSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@H](C[N@H+](C)CCCc1cccc(F)c1)NC(=O)CN1CC[C@@H](C)C1 ZINC001375105947 1342415949 /nfs/dbraw/zinc/41/59/49/1342415949.db2.gz UYPVJIYKXUMXSU-IAGOWNOFSA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@H](C[N@@H+](C)CCCc1cccc(F)c1)NC(=O)CN1CC[C@@H](C)C1 ZINC001375105947 1342415951 /nfs/dbraw/zinc/41/59/51/1342415951.db2.gz UYPVJIYKXUMXSU-IAGOWNOFSA-N 1 3 349.494 2.537 10 0 EFAEHO CC(C)c1ccccc1CN(C)C[C@@H](C)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001375156400 1342472596 /nfs/dbraw/zinc/47/25/96/1342472596.db2.gz WWBZNDICEGYEKT-AEFFLSMTSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)c1ccccc1CN(C)C[C@@H](C)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001375156400 1342472598 /nfs/dbraw/zinc/47/25/98/1342472598.db2.gz WWBZNDICEGYEKT-AEFFLSMTSA-N 1 3 331.504 2.698 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](NC(=O)[C@H]2CCCN2C(C)C)C2CC2)cc1 ZINC001375221798 1342524072 /nfs/dbraw/zinc/52/40/72/1342524072.db2.gz DBNFMANSUYWHDS-VQTJNVASSA-N 1 3 343.515 2.852 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001375228783 1342532100 /nfs/dbraw/zinc/53/21/00/1342532100.db2.gz LEGQQRPIRAEBOT-RBUKOAKNSA-N 1 3 329.488 2.545 10 0 EFAEHO Cc1ccc(CNC[C@H](NC(=O)[C@@H]2CC[N@@H+](C)C2)C2CC2)c(Cl)c1 ZINC001375275279 1342581885 /nfs/dbraw/zinc/58/18/85/1342581885.db2.gz WMUOPIAGTPQOCX-AEFFLSMTSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1ccc(CNC[C@H](NC(=O)[C@@H]2CC[N@H+](C)C2)C2CC2)c(Cl)c1 ZINC001375275279 1342581890 /nfs/dbraw/zinc/58/18/90/1342581890.db2.gz WMUOPIAGTPQOCX-AEFFLSMTSA-N 1 3 349.906 2.585 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CC2CC(C)(C)C2)[C@H](CC)C1 ZINC001375285229 1342592607 /nfs/dbraw/zinc/59/26/07/1342592607.db2.gz KXJUSJUDWIECDR-QZTJIDSGSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3ccc(Cl)cc3)CC2)CC[N@@H+]1C ZINC001375419166 1342723525 /nfs/dbraw/zinc/72/35/25/1342723525.db2.gz DGBNLCPVWQURSZ-DLBZAZTESA-N 1 3 349.906 2.809 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3ccc(Cl)cc3)CC2)CC[N@H+]1C ZINC001375419166 1342723533 /nfs/dbraw/zinc/72/35/33/1342723533.db2.gz DGBNLCPVWQURSZ-DLBZAZTESA-N 1 3 349.906 2.809 10 0 EFAEHO Cc1cc(C)c(CN2CC[C@H]2CN(C)C(=O)CC[NH+](C)C)c(C)c1 ZINC001375475223 1342783046 /nfs/dbraw/zinc/78/30/46/1342783046.db2.gz PROBKBIKNXFEOE-SFHVURJKSA-N 1 3 331.504 2.596 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001375509264 1342816482 /nfs/dbraw/zinc/81/64/82/1342816482.db2.gz FEIXOTDSIJAJST-HHXXYDBFSA-N 1 3 349.494 2.705 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)C1)N1CCCC1 ZINC001375545106 1342857048 /nfs/dbraw/zinc/85/70/48/1342857048.db2.gz VBFLEKLBHZAZNW-UJWQCDCRSA-N 1 3 347.547 2.781 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H]1C[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001375557726 1342873398 /nfs/dbraw/zinc/87/33/98/1342873398.db2.gz BWWJPJKAQLSDFJ-IYARVYRRSA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@H+](CC2CCC2)C1 ZINC001375568390 1342884894 /nfs/dbraw/zinc/88/48/94/1342884894.db2.gz DWLBFJMLQZYQIW-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@@H+](CC2CCC2)C1 ZINC001375568390 1342884903 /nfs/dbraw/zinc/88/49/03/1342884903.db2.gz DWLBFJMLQZYQIW-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C\Cl)C1 ZINC001375578514 1342898051 /nfs/dbraw/zinc/89/80/51/1342898051.db2.gz XLZMJJFSGNVVAG-GTECMTFASA-N 1 3 341.927 2.876 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C\Cl)C1 ZINC001375578517 1342898321 /nfs/dbraw/zinc/89/83/21/1342898321.db2.gz XLZMJJFSGNVVAG-MGQWETQPSA-N 1 3 341.927 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]CC1CC(C)(C)C1 ZINC001375595597 1342913760 /nfs/dbraw/zinc/91/37/60/1342913760.db2.gz JNELUPNGWJDCTG-AEFFLSMTSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](C)C[N@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001375598625 1342916665 /nfs/dbraw/zinc/91/66/65/1342916665.db2.gz RLANMXFYNRREGA-QFBILLFUSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@H](C)C[N@@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001375598625 1342916669 /nfs/dbraw/zinc/91/66/69/1342916669.db2.gz RLANMXFYNRREGA-QFBILLFUSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+]Cc1ccc(C2CC2)cc1 ZINC001375770437 1342990809 /nfs/dbraw/zinc/99/08/09/1342990809.db2.gz VHPOOXPTNDZCMK-FQEVSTJZSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)Oc1cccc(CN2CC[C@@](C)(NC(=O)CC[NH+](C)C)C2)c1 ZINC001375841997 1343079968 /nfs/dbraw/zinc/07/99/68/1343079968.db2.gz IOBFKRJZZLUYRF-HXUWFJFHSA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@]2(C)CCN(C(=O)[C@H]3CCCN3C)C2)c1 ZINC001375865014 1343112525 /nfs/dbraw/zinc/11/25/25/1343112525.db2.gz AWHYSVJBDHWHSO-UYAOXDASSA-N 1 3 347.478 2.557 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1(C)CC[NH+](CC2CCCC2)CC1)N(C)C ZINC001375918644 1343166621 /nfs/dbraw/zinc/16/66/21/1343166621.db2.gz UTRODICHTNPHIX-SFHVURJKSA-N 1 3 337.552 2.981 10 0 EFAEHO CC1([NH2+]C/C=C\c2ccccc2)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001393733531 1357111251 /nfs/dbraw/zinc/11/12/51/1357111251.db2.gz LWIZWCNIFQHJGA-YVMONPNESA-N 1 3 338.455 2.636 10 0 EFAEHO C[C@@H](F)CC[NH+]1CCC(C)(CNC(=O)C(C)(C)N2CCCC2)CC1 ZINC001375921270 1343169429 /nfs/dbraw/zinc/16/94/29/1343169429.db2.gz FSWQEJVQQYYFPE-MRXNPFEDSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1(C)CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001375929401 1343177503 /nfs/dbraw/zinc/17/75/03/1343177503.db2.gz BFNYFOQESLHBPL-QRVBRYPASA-N 1 3 349.563 2.981 10 0 EFAEHO CN(C)C1(C(=O)NC[C@]2(C)CCC[N@H+](CC3CCCC3)C2)CCC1 ZINC001375950564 1343203650 /nfs/dbraw/zinc/20/36/50/1343203650.db2.gz WCGVFRFEHUBMBX-IBGZPJMESA-N 1 3 335.536 2.879 10 0 EFAEHO CN(C)C1(C(=O)NC[C@]2(C)CCC[N@@H+](CC3CCCC3)C2)CCC1 ZINC001375950564 1343203653 /nfs/dbraw/zinc/20/36/53/1343203653.db2.gz WCGVFRFEHUBMBX-IBGZPJMESA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@H](C(=O)NC[C@@]1(C)CCC[N@H+](CCc2ccccc2)C1)N(C)C ZINC001375962711 1343222335 /nfs/dbraw/zinc/22/23/35/1343222335.db2.gz ZXHBWFHZTXHYRL-TZIWHRDSSA-N 1 3 345.531 2.788 10 0 EFAEHO CC[C@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CCc2ccccc2)C1)N(C)C ZINC001375962711 1343222336 /nfs/dbraw/zinc/22/23/36/1343222336.db2.gz ZXHBWFHZTXHYRL-TZIWHRDSSA-N 1 3 345.531 2.788 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C1CCN(Cc2ccsc2)CC1)[NH+](C)C ZINC001376029165 1343271724 /nfs/dbraw/zinc/27/17/24/1343271724.db2.gz JPJKQLSENBTKTH-KRWDZBQOSA-N 1 3 337.533 2.757 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CCCN(CCc2ccccc2)C1)[NH+](CC)CC ZINC001376066482 1343300204 /nfs/dbraw/zinc/30/02/04/1343300204.db2.gz BXHGOBFSEYRDHD-UXHICEINSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)CCC[NH+]1CCC2(C[C@H]2NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001376174799 1343374637 /nfs/dbraw/zinc/37/46/37/1343374637.db2.gz BZYZGXGPXCVMLR-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC12CC[NH+](CCC1CCCC1)CC2)N(C)C ZINC001376175362 1343375833 /nfs/dbraw/zinc/37/58/33/1343375833.db2.gz UWJJTHJXLOWJJZ-MSOLQXFVSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC12CC[NH+](CCC1CCCC1)CC2 ZINC001376182200 1343383752 /nfs/dbraw/zinc/38/37/52/1343383752.db2.gz VUDGQPJBMGKRHT-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1ccsc1)C1CC1 ZINC001376212027 1343401894 /nfs/dbraw/zinc/40/18/94/1343401894.db2.gz BUYHYQVEWHNVKO-IAGOWNOFSA-N 1 3 335.517 2.605 10 0 EFAEHO CCC(CC)C[N@H+](C)C[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001376293962 1343463500 /nfs/dbraw/zinc/46/35/00/1343463500.db2.gz WWRQDJXXOFIMGS-SFHVURJKSA-N 1 3 325.541 2.933 10 0 EFAEHO CCC(CC)C[N@@H+](C)C[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001376293962 1343463503 /nfs/dbraw/zinc/46/35/03/1343463503.db2.gz WWRQDJXXOFIMGS-SFHVURJKSA-N 1 3 325.541 2.933 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001376337215 1343493823 /nfs/dbraw/zinc/49/38/23/1343493823.db2.gz BESOKLVIRYFTOS-NVXWUHKLSA-N 1 3 337.533 2.723 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([C@@H](C)[NH2+]CC2CC3(CCC3)C2)C1 ZINC001376350666 1343504792 /nfs/dbraw/zinc/50/47/92/1343504792.db2.gz UMCNUGYSGCZMNW-AEFFLSMTSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+]1C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001376408254 1343564243 /nfs/dbraw/zinc/56/42/43/1343564243.db2.gz CRMCVSQQWRJIIO-KDURUIRLSA-N 1 3 343.515 2.534 10 0 EFAEHO Cc1cccc(C)c1C[N@H+]1C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001376408254 1343564248 /nfs/dbraw/zinc/56/42/48/1343564248.db2.gz CRMCVSQQWRJIIO-KDURUIRLSA-N 1 3 343.515 2.534 10 0 EFAEHO CCCN(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC(C)(C)C1 ZINC001376425838 1343581078 /nfs/dbraw/zinc/58/10/78/1343581078.db2.gz DDJMZCZWYUPPTL-AYHJJNSGSA-N 1 3 335.536 2.876 10 0 EFAEHO CCCN(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC(C)(C)C1 ZINC001376425838 1343581079 /nfs/dbraw/zinc/58/10/79/1343581079.db2.gz DDJMZCZWYUPPTL-AYHJJNSGSA-N 1 3 335.536 2.876 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccccc2C2CC2)C1)C1CCC1 ZINC001376460189 1343608902 /nfs/dbraw/zinc/60/89/02/1343608902.db2.gz FMMXTNNVWZKFFT-HDICACEKSA-N 1 3 341.499 2.785 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCc3ccccc32)C1)CC(C)(C)C ZINC001376480734 1343619233 /nfs/dbraw/zinc/61/92/33/1343619233.db2.gz VORFAPLQIITBBA-SCTDSRPQSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@H](C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[NH+]1CCCCCC1 ZINC001376484028 1343621194 /nfs/dbraw/zinc/62/11/94/1343621194.db2.gz DDPXHCOYJQYEMH-MCIONIFRSA-N 1 3 348.318 2.807 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCCc3ccc(F)cc32)C1)N(C)C ZINC001376488210 1343623308 /nfs/dbraw/zinc/62/33/08/1343623308.db2.gz KDMVSBMZTZVVPE-OGWHTMIXSA-N 1 3 347.478 2.780 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCc3c2cccc3Cl)C1 ZINC001376511603 1343637869 /nfs/dbraw/zinc/63/78/69/1343637869.db2.gz JOZLGESOASOXMS-IYOUNJFTSA-N 1 3 349.906 2.904 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H](NCc2ccccc2F)C1)[NH+]1CCCC1 ZINC001376511758 1343639208 /nfs/dbraw/zinc/63/92/08/1343639208.db2.gz KPSSYBOEJQGGQS-ZIFCJYIRSA-N 1 3 347.478 2.683 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001376573949 1343691501 /nfs/dbraw/zinc/69/15/01/1343691501.db2.gz NVOKUKQFMDLROY-GOSISDBHSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001376573956 1343691685 /nfs/dbraw/zinc/69/16/85/1343691685.db2.gz NVOKUKQFMDLROY-SFHVURJKSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001376580566 1343697900 /nfs/dbraw/zinc/69/79/00/1343697900.db2.gz UJVOSLGOSWBYEA-MRXNPFEDSA-N 1 3 337.533 2.725 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001376598588 1343712840 /nfs/dbraw/zinc/71/28/40/1343712840.db2.gz GDGCQRFPUMWISZ-BRSBDYLESA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]Cc2ccccc2)CC1 ZINC001376610257 1343719441 /nfs/dbraw/zinc/71/94/41/1343719441.db2.gz MBWXYWITOOCRJY-WGSAOQKQSA-N 1 3 331.504 2.791 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001376615222 1343722698 /nfs/dbraw/zinc/72/26/98/1343722698.db2.gz WBJGZEBPRSYVMJ-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1C[NH2+]Cc1ccccc1F ZINC001376615706 1343722998 /nfs/dbraw/zinc/72/29/98/1343722998.db2.gz PLIUGJKCWPWIQA-QGZVFWFLSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@@H]1CCC[N@H+](CC2CCCC2)C1 ZINC001376622595 1343728930 /nfs/dbraw/zinc/72/89/30/1343728930.db2.gz HTFMJFSRMIXRGC-FUHWJXTLSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@@H]1CCC[N@@H+](CC2CCCC2)C1 ZINC001376622595 1343728934 /nfs/dbraw/zinc/72/89/34/1343728934.db2.gz HTFMJFSRMIXRGC-FUHWJXTLSA-N 1 3 335.536 2.878 10 0 EFAEHO CCC[N@@H+]1CCc2c(CNC(=O)[C@H](C(C)C)N(C)C)cccc2C1 ZINC001376671928 1343755253 /nfs/dbraw/zinc/75/52/53/1343755253.db2.gz IKXHGZTXDCBGEB-IBGZPJMESA-N 1 3 331.504 2.657 10 0 EFAEHO CCC[N@H+]1CCc2c(CNC(=O)[C@H](C(C)C)N(C)C)cccc2C1 ZINC001376671928 1343755255 /nfs/dbraw/zinc/75/52/55/1343755255.db2.gz IKXHGZTXDCBGEB-IBGZPJMESA-N 1 3 331.504 2.657 10 0 EFAEHO CCC[N@@H+]1CCc2c(CNC(=O)[C@@H](C(C)C)N(C)C)cccc2C1 ZINC001376671936 1343755411 /nfs/dbraw/zinc/75/54/11/1343755411.db2.gz IKXHGZTXDCBGEB-LJQANCHMSA-N 1 3 331.504 2.657 10 0 EFAEHO CCC[N@H+]1CCc2c(CNC(=O)[C@@H](C(C)C)N(C)C)cccc2C1 ZINC001376671936 1343755416 /nfs/dbraw/zinc/75/54/16/1343755416.db2.gz IKXHGZTXDCBGEB-LJQANCHMSA-N 1 3 331.504 2.657 10 0 EFAEHO CC(C)C[NH2+]C[C@H]1CCCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001376683577 1343762669 /nfs/dbraw/zinc/76/26/69/1343762669.db2.gz CFLJFEHQAQJJHR-APWZRJJASA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)[NH+]1CCCC1)NCc1cc2ccccc2o1 ZINC001376784645 1343836832 /nfs/dbraw/zinc/83/68/32/1343836832.db2.gz OEXYJYVSVUFXJQ-OAHLLOKOSA-N 1 3 343.471 2.902 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NCC1(NCc2ccccc2F)CCC1 ZINC001376820349 1343871680 /nfs/dbraw/zinc/87/16/80/1343871680.db2.gz SPOSECNQERKMEX-IYBDPMFKSA-N 1 3 347.478 2.827 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCC1(NCc2ccccc2F)CCC1 ZINC001376820349 1343871683 /nfs/dbraw/zinc/87/16/83/1343871683.db2.gz SPOSECNQERKMEX-IYBDPMFKSA-N 1 3 347.478 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1 ZINC001376883771 1343919311 /nfs/dbraw/zinc/91/93/11/1343919311.db2.gz SZDSBGSYIOZGQY-ZIAGYGMSSA-N 1 3 325.884 2.836 10 0 EFAEHO Cc1ccc(CN(C)CCCN(C)C(=O)[C@@H](C(C)C)[NH+](C)C)c(C)n1 ZINC001376970589 1343998683 /nfs/dbraw/zinc/99/86/83/1343998683.db2.gz IVYYNNNQGRMIEK-LJQANCHMSA-N 1 3 348.535 2.565 10 0 EFAEHO CCCC[N@H+](C)CCCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001376976504 1344006325 /nfs/dbraw/zinc/00/63/25/1344006325.db2.gz APPXWDSVZPXLKI-GOSISDBHSA-N 1 3 329.504 2.779 10 0 EFAEHO CCCC[N@@H+](C)CCCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001376976504 1344006332 /nfs/dbraw/zinc/00/63/32/1344006332.db2.gz APPXWDSVZPXLKI-GOSISDBHSA-N 1 3 329.504 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccccc2C2CC2)C1 ZINC001376976740 1344006963 /nfs/dbraw/zinc/00/69/63/1344006963.db2.gz VNRVXFLYDABWHS-SFHVURJKSA-N 1 3 329.488 2.595 10 0 EFAEHO COc1cccc(C[N@@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001393791610 1357161837 /nfs/dbraw/zinc/16/18/37/1357161837.db2.gz RILQJGIJWFLOGH-FUHWJXTLSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc(C[N@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001393791610 1357161839 /nfs/dbraw/zinc/16/18/39/1357161839.db2.gz RILQJGIJWFLOGH-FUHWJXTLSA-N 1 3 347.503 2.505 10 0 EFAEHO Cc1ncccc1CN(C)CCCN(C)C(=O)C[NH+]1[C@H](C)CC[C@H]1C ZINC001377017153 1344063308 /nfs/dbraw/zinc/06/33/08/1344063308.db2.gz JKWQLGIOOROXGQ-IAGOWNOFSA-N 1 3 346.519 2.543 10 0 EFAEHO CCN(CCNC(=O)C[NH+]1[C@H](C)CC[C@H]1C)Cc1ccc(F)cc1C ZINC001377367078 1344152627 /nfs/dbraw/zinc/15/26/27/1344152627.db2.gz NGURNFLYEYYYQZ-IAGOWNOFSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC[N@H+](CC1CC(C)(C)C1)C1CC1 ZINC001377566320 1344176110 /nfs/dbraw/zinc/17/61/10/1344176110.db2.gz GNNNVKPXYXEVFP-HOTGVXAUSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC[N@@H+](CC1CC(C)(C)C1)C1CC1 ZINC001377566320 1344176112 /nfs/dbraw/zinc/17/61/12/1344176112.db2.gz GNNNVKPXYXEVFP-HOTGVXAUSA-N 1 3 335.536 2.876 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](CC1CC(C)(C)C1)C1CC1 ZINC001377567542 1344177770 /nfs/dbraw/zinc/17/77/70/1344177770.db2.gz LEAURVISZQLJFD-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](CC1CC(C)(C)C1)C1CC1 ZINC001377567542 1344177774 /nfs/dbraw/zinc/17/77/74/1344177774.db2.gz LEAURVISZQLJFD-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+][C@@H](C)c1ccc2c(c1)CCC2 ZINC001377600555 1344206856 /nfs/dbraw/zinc/20/68/56/1344206856.db2.gz LDNBYZRHBPCIAT-INIZCTEOSA-N 1 3 331.504 2.625 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+][C@H](C)c1ccc2c(c1)CCC2 ZINC001377600560 1344207138 /nfs/dbraw/zinc/20/71/38/1344207138.db2.gz LDNBYZRHBPCIAT-MRXNPFEDSA-N 1 3 331.504 2.625 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]([NH2+]CC2CCC2)c2ccccc2)C1 ZINC001377609969 1344217285 /nfs/dbraw/zinc/21/72/85/1344217285.db2.gz GOXPKMOUPYYYRS-APWZRJJASA-N 1 3 329.488 2.575 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H]2C[N@H+](C)CCCC2CCC2)C1 ZINC001377659939 1344280894 /nfs/dbraw/zinc/28/08/94/1344280894.db2.gz HFWKSTONFXAXEJ-MJGOQNOKSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H]2C[N@@H+](C)CCCC2CCC2)C1 ZINC001377659939 1344280898 /nfs/dbraw/zinc/28/08/98/1344280898.db2.gz HFWKSTONFXAXEJ-MJGOQNOKSA-N 1 3 335.536 2.831 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001393813309 1357177654 /nfs/dbraw/zinc/17/76/54/1357177654.db2.gz AAXPSNSRIXTQLY-AEFFLSMTSA-N 1 3 331.504 2.630 10 0 EFAEHO CC(C)c1cccc(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@H](C)C2)n1 ZINC001393814334 1357178622 /nfs/dbraw/zinc/17/86/22/1357178622.db2.gz GFXBFRNPFGGVOX-IRXDYDNUSA-N 1 3 346.519 2.531 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2ccc(C)cc2C)C1)N(C)C ZINC001377701457 1344341860 /nfs/dbraw/zinc/34/18/60/1344341860.db2.gz QFQFQTAWCQIDIF-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2ccc(C)cc2C)C1)N(C)C ZINC001377701457 1344341863 /nfs/dbraw/zinc/34/18/63/1344341863.db2.gz QFQFQTAWCQIDIF-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001377709858 1344354478 /nfs/dbraw/zinc/35/44/78/1344354478.db2.gz AHXDVIUYLDQGPW-AEFFLSMTSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001377709858 1344354481 /nfs/dbraw/zinc/35/44/81/1344354481.db2.gz AHXDVIUYLDQGPW-AEFFLSMTSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001377721585 1344369684 /nfs/dbraw/zinc/36/96/84/1344369684.db2.gz LQPWYGVDCKLQAO-INIZCTEOSA-N 1 3 344.503 2.669 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001377721585 1344369688 /nfs/dbraw/zinc/36/96/88/1344369688.db2.gz LQPWYGVDCKLQAO-INIZCTEOSA-N 1 3 344.503 2.669 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001377810000 1344462260 /nfs/dbraw/zinc/46/22/60/1344462260.db2.gz RJSHYBNNSBDSOX-RYUDHWBXSA-N 1 3 343.924 2.869 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](C)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001377824646 1344481230 /nfs/dbraw/zinc/48/12/30/1344481230.db2.gz MPWNZDARTVCLLT-CVEARBPZSA-N 1 3 331.504 2.716 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001377824769 1344481517 /nfs/dbraw/zinc/48/15/17/1344481517.db2.gz MRRIOSCWISEQDK-HZPDHXFCSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001377830665 1344487679 /nfs/dbraw/zinc/48/76/79/1344487679.db2.gz UCUGUYSIAQSSNB-HUUCEWRRSA-N 1 3 342.487 2.635 10 0 EFAEHO C[C@@H](NC(=O)CCC[NH+](C)C)[C@H](C)NCc1sccc1Cl ZINC001377838397 1344493814 /nfs/dbraw/zinc/49/38/14/1344493814.db2.gz JQDSKCHTUCLRMK-NWDGAFQWSA-N 1 3 331.913 2.726 10 0 EFAEHO C[C@@H](NC(=O)CN(C)CC(C)(C)C)[C@H](C)[NH2+]CCc1ccccc1 ZINC001377849315 1344506842 /nfs/dbraw/zinc/50/68/42/1344506842.db2.gz HIKAKKDXUOASMT-DLBZAZTESA-N 1 3 333.520 2.690 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]Cc1cc(F)ccc1C ZINC001393830944 1357194825 /nfs/dbraw/zinc/19/48/25/1357194825.db2.gz QXVVVGYCGCCNQY-QFBILLFUSA-N 1 3 349.494 2.993 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001377885572 1344547578 /nfs/dbraw/zinc/54/75/78/1344547578.db2.gz SRLNGGIJWDJFHB-HUUCEWRRSA-N 1 3 331.460 2.757 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1CCC(N(C)C(=O)CN(C)C2CCC2)CC1 ZINC001377913660 1344576030 /nfs/dbraw/zinc/57/60/30/1344576030.db2.gz MJEARIGGEZWLNN-HPUBIQBYSA-N 1 3 327.488 2.578 10 0 EFAEHO CC(C)(C(=O)NCC1C[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)C1)N1CCCCC1 ZINC001377974459 1344628879 /nfs/dbraw/zinc/62/88/79/1344628879.db2.gz WZCUTQKHGBOQGD-NZSAHSFTSA-N 1 3 347.547 2.735 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1CN([C@@H](C)c2ccccc2)C1)[NH+]1CCCC1 ZINC001378020186 1344670988 /nfs/dbraw/zinc/67/09/88/1344670988.db2.gz JNNFQDZOLUCSTR-FXAWDEMLSA-N 1 3 343.515 2.916 10 0 EFAEHO CC(C)C[C@H](C)CN1C[C@@H]2C[C@H]1CN2C(=O)C12CCC[NH+](CCC1)C2 ZINC001378030517 1344680914 /nfs/dbraw/zinc/68/09/14/1344680914.db2.gz BMTJJLDQZNDNKA-FHWLQOOXSA-N 1 3 347.547 2.830 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1cccc(F)c1 ZINC001378048256 1344700425 /nfs/dbraw/zinc/70/04/25/1344700425.db2.gz LWQMUWHNCPZYNG-CRAIPNDOSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1cccc(F)c1 ZINC001378048256 1344700428 /nfs/dbraw/zinc/70/04/28/1344700428.db2.gz LWQMUWHNCPZYNG-CRAIPNDOSA-N 1 3 335.467 2.635 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccc(OC)cc1 ZINC001378251822 1344931724 /nfs/dbraw/zinc/93/17/24/1344931724.db2.gz UQMZXGZITWTLCW-MJGOQNOKSA-N 1 3 347.503 2.552 10 0 EFAEHO CC[C@H](CNC(=O)[C@H](C(C)C)N(C)C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001378254342 1344933685 /nfs/dbraw/zinc/93/36/85/1344933685.db2.gz FSQFYCDWMWHGNY-MJGOQNOKSA-N 1 3 344.503 2.739 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](CC)[NH2+]Cc1cc(F)ccc1C ZINC001378260647 1344939825 /nfs/dbraw/zinc/93/98/25/1344939825.db2.gz YMLKLKVVCJAOFR-RBUKOAKNSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]Cc1ccccc1 ZINC001378295292 1344963579 /nfs/dbraw/zinc/96/35/79/1344963579.db2.gz NFAIMCCCOJDBGE-MJGOQNOKSA-N 1 3 331.504 2.936 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc2ncccc2c1 ZINC001378332145 1344992862 /nfs/dbraw/zinc/99/28/62/1344992862.db2.gz BXLUNYQATVABBX-GOSISDBHSA-N 1 3 342.487 2.559 10 0 EFAEHO Cc1ccccc1C[NH2+]CC1(NC(=O)CN(C)C(C)C)CCCC1 ZINC001378370927 1345019880 /nfs/dbraw/zinc/01/98/80/1345019880.db2.gz JTBAZHZVRPZUKM-UHFFFAOYSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@H](C(=O)NCCC1CC[NH+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001378484402 1345116623 /nfs/dbraw/zinc/11/66/23/1345116623.db2.gz QCBIRUYRPZFSMR-GOSISDBHSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)C[NH2+][C@H]1CCCCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001417842397 1373324325 /nfs/dbraw/zinc/32/43/25/1373324325.db2.gz YBCLQRPTGIQLBK-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)C[NH2+]CC1CC2(CCC2)C1 ZINC001378556966 1345160928 /nfs/dbraw/zinc/16/09/28/1345160928.db2.gz FKRROHBBQMXYCK-FUHWJXTLSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1ccc(CN2C[C@@H](NC(=O)[C@@H](C(C)C)[NH+](C)C)C(C)(C)C2)cc1 ZINC001378648933 1345224357 /nfs/dbraw/zinc/22/43/57/1345224357.db2.gz DTQAFHWYXVJJSZ-RTBURBONSA-N 1 3 345.531 2.908 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@H+](CC2CC2)CC1(C)C)N1CCCCC1 ZINC001378678454 1345244450 /nfs/dbraw/zinc/24/44/50/1345244450.db2.gz LOMRRXUHZWOMLY-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@@H+](CC2CC2)CC1(C)C)N1CCCCC1 ZINC001378678454 1345244455 /nfs/dbraw/zinc/24/44/55/1345244455.db2.gz LOMRRXUHZWOMLY-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CN(CC(=O)NC[C@@H]1[C@H]2C[N@@H+](Cc3ccsc3)C[C@H]21)CC(C)(C)C ZINC001378717223 1345271404 /nfs/dbraw/zinc/27/14/04/1345271404.db2.gz DJRLDPFMZACPQR-OSYLJGHBSA-N 1 3 349.544 2.520 10 0 EFAEHO CN(CC(=O)NC[C@@H]1[C@H]2C[N@H+](Cc3ccsc3)C[C@H]21)CC(C)(C)C ZINC001378717223 1345271408 /nfs/dbraw/zinc/27/14/08/1345271408.db2.gz DJRLDPFMZACPQR-OSYLJGHBSA-N 1 3 349.544 2.520 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)[C@@H]2CCCN2C)cc1 ZINC001378750818 1345292236 /nfs/dbraw/zinc/29/22/36/1345292236.db2.gz HQYKNSHSZRAPGW-APWZRJJASA-N 1 3 331.504 2.841 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001378786722 1345315937 /nfs/dbraw/zinc/31/59/37/1345315937.db2.gz QGPNPVWJMFQWRG-GBESFXJTSA-N 1 3 337.552 2.980 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001378786722 1345315939 /nfs/dbraw/zinc/31/59/39/1345315939.db2.gz QGPNPVWJMFQWRG-GBESFXJTSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N1CCCC2(CN(C(=O)CC[NH+](C)C)C2)C1 ZINC001378798798 1345322262 /nfs/dbraw/zinc/32/22/62/1345322262.db2.gz OYSYVIBDGFDKRC-INIZCTEOSA-N 1 3 347.478 2.763 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1C[C@@]2(C)CN(Cc3ccsc3)C[C@@]2(C)C1 ZINC001378821670 1345340055 /nfs/dbraw/zinc/34/00/55/1345340055.db2.gz XDZAVFFEVBPWMH-KDURUIRLSA-N 1 3 349.544 2.760 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1C[C@@]2(C)CN(Cc3ccsc3)C[C@@]2(C)C1 ZINC001378821670 1345340058 /nfs/dbraw/zinc/34/00/58/1345340058.db2.gz XDZAVFFEVBPWMH-KDURUIRLSA-N 1 3 349.544 2.760 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)cc1C ZINC001378826908 1345344664 /nfs/dbraw/zinc/34/46/64/1345344664.db2.gz HBSSGWUSGVYFTH-CRAIPNDOSA-N 1 3 331.504 2.582 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001378835861 1345350369 /nfs/dbraw/zinc/35/03/69/1345350369.db2.gz XVEMYDZDKRXRKY-AUQWCNHSSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001378835861 1345350372 /nfs/dbraw/zinc/35/03/72/1345350372.db2.gz XVEMYDZDKRXRKY-AUQWCNHSSA-N 1 3 348.318 2.664 10 0 EFAEHO C[C@H](C[NH2+]Cc1cccc(Cl)c1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001378837734 1345350996 /nfs/dbraw/zinc/35/09/96/1345350996.db2.gz XJKDTHLTGHXICX-LSDHHAIUSA-N 1 3 337.895 2.618 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H]2CCCc3ccccc32)C1)N(C)C ZINC001378842717 1345355265 /nfs/dbraw/zinc/35/52/65/1345355265.db2.gz GONJZHBFQCZZIS-LWCVALJOSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2cccc(F)c2)C1)N(C)C ZINC001378846158 1345358252 /nfs/dbraw/zinc/35/82/52/1345358252.db2.gz QOPMZOYXHKFYDU-LNMJFAINSA-N 1 3 349.494 2.957 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccccc1C ZINC001378855912 1345367335 /nfs/dbraw/zinc/36/73/35/1345367335.db2.gz IHJLZZPTBCGBNU-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(OC)cc1 ZINC001378863577 1345373986 /nfs/dbraw/zinc/37/39/86/1345373986.db2.gz XSSKWGVKYLQGCM-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H](CC(C)C)NC(=O)CN1CC[C@H](C)C1 ZINC001378882223 1345391623 /nfs/dbraw/zinc/39/16/23/1345391623.db2.gz NNGGWQDPRVWCJU-FXAWDEMLSA-N 1 3 345.531 2.957 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H](CC(C)C)NC(=O)CN1CC[C@H](C)C1 ZINC001378882224 1345391640 /nfs/dbraw/zinc/39/16/40/1345391640.db2.gz NNGGWQDPRVWCJU-PXNSSMCTSA-N 1 3 345.531 2.957 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CCc2ccccc2F)[C@H](C)C1 ZINC001378894039 1345403878 /nfs/dbraw/zinc/40/38/78/1345403878.db2.gz FDENHBRUVFLWNT-APWZRJJASA-N 1 3 349.494 2.535 10 0 EFAEHO CCc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001378899765 1345408483 /nfs/dbraw/zinc/40/84/83/1345408483.db2.gz PKDYQTMXTCFZET-PXNSSMCTSA-N 1 3 345.531 2.916 10 0 EFAEHO CC(C)CC[N@@H+](C)C[C@@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001393880567 1357245144 /nfs/dbraw/zinc/24/51/44/1357245144.db2.gz GPMZDPYDNPOCSB-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)CC[N@H+](C)C[C@@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001393880567 1357245139 /nfs/dbraw/zinc/24/51/39/1357245139.db2.gz GPMZDPYDNPOCSB-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](NCc1ccccc1F)C(C)C ZINC001378962933 1345462045 /nfs/dbraw/zinc/46/20/45/1345462045.db2.gz OMMKIALZTMAQHA-OALUTQOASA-N 1 3 349.494 2.931 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](NCc1ccccc1F)C(C)C ZINC001378962933 1345462046 /nfs/dbraw/zinc/46/20/46/1345462046.db2.gz OMMKIALZTMAQHA-OALUTQOASA-N 1 3 349.494 2.931 10 0 EFAEHO CN(CC[N@H+](C)CC[C@H]1CCCC1(F)F)C(=O)CN(C)C1CCC1 ZINC001379067668 1345547438 /nfs/dbraw/zinc/54/74/38/1345547438.db2.gz TYORFCCALFDJNV-OAHLLOKOSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CC[N@@H+](C)CC[C@H]1CCCC1(F)F)C(=O)CN(C)C1CCC1 ZINC001379067668 1345547441 /nfs/dbraw/zinc/54/74/41/1345547441.db2.gz TYORFCCALFDJNV-OAHLLOKOSA-N 1 3 345.478 2.686 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001379110788 1345587407 /nfs/dbraw/zinc/58/74/07/1345587407.db2.gz LIZTZLGVZYOQPU-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001379110788 1345587410 /nfs/dbraw/zinc/58/74/10/1345587410.db2.gz LIZTZLGVZYOQPU-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO CN(CC[N@H+](C)Cc1cccc2ccccc21)C(=O)CN1CCCC1 ZINC001379132778 1345610802 /nfs/dbraw/zinc/61/08/02/1345610802.db2.gz QGRFHPGKLZRBEW-UHFFFAOYSA-N 1 3 339.483 2.826 10 0 EFAEHO CN(CC[N@@H+](C)Cc1cccc2ccccc21)C(=O)CN1CCCC1 ZINC001379132778 1345610807 /nfs/dbraw/zinc/61/08/07/1345610807.db2.gz QGRFHPGKLZRBEW-UHFFFAOYSA-N 1 3 339.483 2.826 10 0 EFAEHO CN(CC[N@H+](C)Cc1ccc(C2CC2)cc1)C(=O)CN1CCCC1 ZINC001379132797 1345611136 /nfs/dbraw/zinc/61/11/36/1345611136.db2.gz QMIXFSCHIKHCQD-UHFFFAOYSA-N 1 3 329.488 2.550 10 0 EFAEHO CN(CC[N@@H+](C)Cc1ccc(C2CC2)cc1)C(=O)CN1CCCC1 ZINC001379132797 1345611137 /nfs/dbraw/zinc/61/11/37/1345611137.db2.gz QMIXFSCHIKHCQD-UHFFFAOYSA-N 1 3 329.488 2.550 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(F)c(Cl)c1)N(C)C ZINC001379264869 1345686651 /nfs/dbraw/zinc/68/66/51/1345686651.db2.gz ZLXDMSSBVHWYGS-BLLLJJGKSA-N 1 3 343.874 2.756 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(C)nc1C ZINC001379330218 1345733401 /nfs/dbraw/zinc/73/34/01/1345733401.db2.gz OVCCBAGJYHLMIS-VQIMIIECSA-N 1 3 346.519 2.509 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)c(Cl)c1 ZINC001379356762 1345746208 /nfs/dbraw/zinc/74/62/08/1345746208.db2.gz HXHJOENHMJGFEF-IIAWOOMASA-N 1 3 337.895 2.583 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)c(Cl)c1 ZINC001379356762 1345746210 /nfs/dbraw/zinc/74/62/10/1345746210.db2.gz HXHJOENHMJGFEF-IIAWOOMASA-N 1 3 337.895 2.583 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]Cc1cccc(C(F)(F)F)c1)N(C)C ZINC001379380993 1345755774 /nfs/dbraw/zinc/75/57/74/1345755774.db2.gz BIUPFVUUPUCPDK-IUODEOHRSA-N 1 3 345.409 2.640 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C[C@@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001379415003 1345771236 /nfs/dbraw/zinc/77/12/36/1345771236.db2.gz HZWNABVRGAMQLN-DLBZAZTESA-N 1 3 331.504 2.746 10 0 EFAEHO C[C@H](C[NH2+]Cc1cc2ccccc2s1)NC(=O)CN1CC[C@H](C)C1 ZINC001379416753 1345772698 /nfs/dbraw/zinc/77/26/98/1345772698.db2.gz MCFRWNJFFXBKBX-LSDHHAIUSA-N 1 3 345.512 2.837 10 0 EFAEHO C[C@H](CN[C@H](C)c1cccc(Cl)c1F)NC(=O)CC[NH+](C)C ZINC001379419670 1345775369 /nfs/dbraw/zinc/77/53/69/1345775369.db2.gz PBYPXELCJDTDSN-VXGBXAGGSA-N 1 3 329.847 2.586 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+]Cc1cccc(C(F)F)c1 ZINC001379463654 1345799830 /nfs/dbraw/zinc/79/98/30/1345799830.db2.gz FQYOEUVNZKNDAT-CYBMUJFWSA-N 1 3 327.419 2.559 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC001379465674 1345801475 /nfs/dbraw/zinc/80/14/75/1345801475.db2.gz KZRYYRDPZJLKSM-CYBMUJFWSA-N 1 3 345.409 2.640 10 0 EFAEHO C[C@@H](C[NH2+]C[C@@H]1CCCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001379549764 1345848959 /nfs/dbraw/zinc/84/89/59/1345848959.db2.gz FFXCIHUNDCFMKO-LSDHHAIUSA-N 1 3 347.494 2.884 10 0 EFAEHO Cc1ccc(CN[C@@H]2CCN(C(=O)CC[NH+](C)C)[C@H]2C)c(Cl)c1 ZINC001379561491 1345865169 /nfs/dbraw/zinc/86/51/69/1345865169.db2.gz ZMMIQNIIDZDGDR-WMLDXEAASA-N 1 3 337.895 2.679 10 0 EFAEHO CCc1ccc(C[NH2+]CC2CC(NC(=O)CN(C)C3CCC3)C2)cc1 ZINC001393898775 1357268161 /nfs/dbraw/zinc/26/81/61/1357268161.db2.gz JFQGQMDXGFJCFS-UHFFFAOYSA-N 1 3 343.515 2.718 10 0 EFAEHO Cc1cc(C[NH2+]CC2CC(NC(=O)C3(N(C)C)CCC3)C2)c(C)s1 ZINC001393898405 1357268666 /nfs/dbraw/zinc/26/86/66/1357268666.db2.gz FPGFVMZURQABRV-UHFFFAOYSA-N 1 3 349.544 2.834 10 0 EFAEHO C[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CCC(C)(C)C ZINC001418493614 1374089068 /nfs/dbraw/zinc/08/90/68/1374089068.db2.gz HEEBSVBJHKNNLD-SFHVURJKSA-N 1 3 329.504 2.683 10 0 EFAEHO C[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CCC(C)(C)C ZINC001418493614 1374089072 /nfs/dbraw/zinc/08/90/72/1374089072.db2.gz HEEBSVBJHKNNLD-SFHVURJKSA-N 1 3 329.504 2.683 10 0 EFAEHO CN(CC(=O)N1C[C@H]([NH2+]C/C=C\Cl)C(C)(C)C1)CC(C)(C)C ZINC001379720747 1347284243 /nfs/dbraw/zinc/28/42/43/1347284243.db2.gz VXUFXQPNTUVVED-DANTVBBOSA-N 1 3 329.916 2.543 10 0 EFAEHO C[C@@H](C[N@H+](C)CC1CCC2(CC2)CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001379734261 1347293923 /nfs/dbraw/zinc/29/39/23/1347293923.db2.gz BFBUPIGLVPOVLR-SJORKVTESA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC1CCC2(CC2)CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001379734261 1347293926 /nfs/dbraw/zinc/29/39/26/1347293926.db2.gz BFBUPIGLVPOVLR-SJORKVTESA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H](C[N@H+](C)CC1CCC2(CC2)CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001379734250 1347294554 /nfs/dbraw/zinc/29/45/54/1347294554.db2.gz BFBUPIGLVPOVLR-IRXDYDNUSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC1CCC2(CC2)CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001379734250 1347294559 /nfs/dbraw/zinc/29/45/59/1347294559.db2.gz BFBUPIGLVPOVLR-IRXDYDNUSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C[N@H+](C)CCC1CCCCC1)N(C)C ZINC001379776326 1347326251 /nfs/dbraw/zinc/32/62/51/1347326251.db2.gz ZLCIFZMVSJWQSY-SJLPKXTDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C[N@@H+](C)CCC1CCCCC1)N(C)C ZINC001379776326 1347326256 /nfs/dbraw/zinc/32/62/56/1347326256.db2.gz ZLCIFZMVSJWQSY-SJLPKXTDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1)[NH+]1CCCC1 ZINC001379797716 1347346548 /nfs/dbraw/zinc/34/65/48/1347346548.db2.gz LTNVRLDVXYUQML-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001379857494 1347373669 /nfs/dbraw/zinc/37/36/69/1347373669.db2.gz LRPRQWXQAUGSNH-RTBURBONSA-N 1 3 347.547 2.924 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]Cc1ccsc1 ZINC001379934812 1347412862 /nfs/dbraw/zinc/41/28/62/1347412862.db2.gz HBQIVHLYARUXHB-SJORKVTESA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccc2c(c1)CCC2)C(=O)CC[NH+](C)C ZINC001380032624 1347472737 /nfs/dbraw/zinc/47/27/37/1347472737.db2.gz VSSJVNHQUVBKJK-UHFFFAOYSA-N 1 3 345.531 2.796 10 0 EFAEHO C[C@H](NC1(CNC(=O)CC[C@H]2CCC[N@@H+]2C)CC1)c1ccc(F)cc1 ZINC001380100132 1347514608 /nfs/dbraw/zinc/51/46/08/1347514608.db2.gz DYBCTDTXAUOSEW-MAUKXSAKSA-N 1 3 347.478 3.000 10 0 EFAEHO C[C@H](NC1(CNC(=O)CC[C@H]2CCC[N@H+]2C)CC1)c1ccc(F)cc1 ZINC001380100132 1347514610 /nfs/dbraw/zinc/51/46/10/1347514610.db2.gz DYBCTDTXAUOSEW-MAUKXSAKSA-N 1 3 347.478 3.000 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H](C)C1CCN(Cc2ccccn2)CC1 ZINC001380127273 1347523732 /nfs/dbraw/zinc/52/37/32/1347523732.db2.gz AYYDIFCLEHOOOS-QGZVFWFLSA-N 1 3 346.519 2.530 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H](C)C1CCN(Cc2ccccn2)CC1 ZINC001380127273 1347523734 /nfs/dbraw/zinc/52/37/34/1347523734.db2.gz AYYDIFCLEHOOOS-QGZVFWFLSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1CC[NH+](CC2CC(F)(F)C2)CC1 ZINC001380127864 1347524025 /nfs/dbraw/zinc/52/40/25/1347524025.db2.gz GQUCJKJDGZJLHS-CQSZACIVSA-N 1 3 345.478 2.589 10 0 EFAEHO CC[C@H](C)C[NH+]1CCC([C@@H](C)NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001380134558 1347527268 /nfs/dbraw/zinc/52/72/68/1347527268.db2.gz WIRPOPAHDAAKDP-LZLYRXPVSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C1CC[NH+](CC2CCCC2)CC1)N(C)C ZINC001380146639 1347533826 /nfs/dbraw/zinc/53/38/26/1347533826.db2.gz QWDOVVOAIKHQDT-LPHOPBHVSA-N 1 3 337.552 2.980 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C2(CNC(=O)[C@@H](C(C)C)N(C)C)CC2)c1 ZINC001380159560 1347540257 /nfs/dbraw/zinc/54/02/57/1347540257.db2.gz KKMDSLAGKWPESY-CRAIPNDOSA-N 1 3 347.503 2.581 10 0 EFAEHO Cc1cc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@H]3C)CC2)c(C)s1 ZINC001380169413 1347545905 /nfs/dbraw/zinc/54/59/05/1347545905.db2.gz DYDMYDODJPCLCL-ZIAGYGMSSA-N 1 3 349.544 2.976 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC([NH2+]Cc2ccc3cc[nH]c3c2)C1)N(C)C ZINC001380171013 1347546657 /nfs/dbraw/zinc/54/66/57/1347546657.db2.gz IFYWYYZAJOEPDT-TVPLGVNVSA-N 1 3 342.487 2.587 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)CC(C)(C)C)c(C)n1 ZINC001393992577 1357362135 /nfs/dbraw/zinc/36/21/35/1357362135.db2.gz XWBGFDOTQQMBJX-CVEARBPZSA-N 1 3 348.535 2.659 10 0 EFAEHO COc1cccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)c1 ZINC001380272112 1347563894 /nfs/dbraw/zinc/56/38/94/1347563894.db2.gz SKHCHRXPGZPRPO-FUHWJXTLSA-N 1 3 347.503 2.505 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]CC1CCC1)C1CCCC1 ZINC001380319965 1347591059 /nfs/dbraw/zinc/59/10/59/1347591059.db2.gz VHQCYQAYQHWKTB-RBUKOAKNSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C(C)C ZINC001393994734 1357364788 /nfs/dbraw/zinc/36/47/88/1357364788.db2.gz HENBCMMSBKIJMG-JKSUJKDBSA-N 1 3 348.535 2.836 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC2(C)CC[NH+](Cc3ccsc3)CC2)C1 ZINC001380447769 1347677684 /nfs/dbraw/zinc/67/76/84/1347677684.db2.gz ISHKNXCUCSCTCD-INIZCTEOSA-N 1 3 349.544 2.808 10 0 EFAEHO CCC(CC)C[N@@H+]1CCC(F)(F)[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001380521241 1347740117 /nfs/dbraw/zinc/74/01/17/1347740117.db2.gz OFEMMSUQGYOQNC-MRXNPFEDSA-N 1 3 347.494 2.836 10 0 EFAEHO CCC(CC)C[N@H+]1CCC(F)(F)[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001380521241 1347740118 /nfs/dbraw/zinc/74/01/18/1347740118.db2.gz OFEMMSUQGYOQNC-MRXNPFEDSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]CCc1ccccc1Cl ZINC001394001578 1357372154 /nfs/dbraw/zinc/37/21/54/1357372154.db2.gz MGXDKHJEOQWGRB-CABCVRRESA-N 1 3 339.911 2.706 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccsc2)C3)CCC1 ZINC001380661793 1347797528 /nfs/dbraw/zinc/79/75/28/1347797528.db2.gz QZCNAVHBRGOZIX-BBWFWOEESA-N 1 3 347.528 2.702 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccsc2)C3)CCC1 ZINC001380661793 1347797529 /nfs/dbraw/zinc/79/75/29/1347797529.db2.gz QZCNAVHBRGOZIX-BBWFWOEESA-N 1 3 347.528 2.702 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001380689721 1347815561 /nfs/dbraw/zinc/81/55/61/1347815561.db2.gz LUHFLHKFZAAUSE-FUHWJXTLSA-N 1 3 335.536 2.593 10 0 EFAEHO CC[N@H+](C)Cc1ccccc1CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001380776735 1347866319 /nfs/dbraw/zinc/86/63/19/1347866319.db2.gz CSFHJDHUSXTMRM-FQEVSTJZSA-N 1 3 349.494 2.967 10 0 EFAEHO CC[N@@H+](C)Cc1ccccc1CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001380776735 1347866320 /nfs/dbraw/zinc/86/63/20/1347866320.db2.gz CSFHJDHUSXTMRM-FQEVSTJZSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@@H]([NH2+]CCC(F)(F)F)[C@H](C)NC(=O)c1cccc(CN(C)C)c1 ZINC001394006519 1357379043 /nfs/dbraw/zinc/37/90/43/1357379043.db2.gz SIQXSUNAOPDEFQ-OLZOCXBDSA-N 1 3 345.409 2.797 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](CCc2ccccc2F)CC1)N(C)C ZINC001380940190 1347971848 /nfs/dbraw/zinc/97/18/48/1347971848.db2.gz RSUUHNRGUXGMNN-IEBWSBKVSA-N 1 3 349.494 2.679 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](CCc2ccccc2F)CC1)N(C)C ZINC001380940190 1347971853 /nfs/dbraw/zinc/97/18/53/1347971853.db2.gz RSUUHNRGUXGMNN-IEBWSBKVSA-N 1 3 349.494 2.679 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCC[C@@H]1[C@@H]1CCCN(C/C=C/Cl)C1 ZINC001380991120 1348009755 /nfs/dbraw/zinc/00/97/55/1348009755.db2.gz UQKBGQWIXFWPBI-DTIZEGCPSA-N 1 3 341.927 2.784 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@@H]1C ZINC001381126927 1348094475 /nfs/dbraw/zinc/09/44/75/1348094475.db2.gz ZKSWUOXGQQUFPO-QFBILLFUSA-N 1 3 331.504 2.844 10 0 EFAEHO Cc1ccccc1C[NH2+]C1(C)CCN(C(=O)CN(C)C(C)C)CC1 ZINC001381128354 1348095817 /nfs/dbraw/zinc/09/58/17/1348095817.db2.gz JUASIJWRAQRJQW-UHFFFAOYSA-N 1 3 331.504 2.806 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1(C)CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001381130549 1348097780 /nfs/dbraw/zinc/09/77/80/1348097780.db2.gz ZXLBXRLIMBBVSI-OAHLLOKOSA-N 1 3 329.504 2.683 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](NC(=O)CCC[NH+](C)C)C[C@H]2C)c(C)n1 ZINC001381169427 1348117872 /nfs/dbraw/zinc/11/78/72/1348117872.db2.gz HKARFNGSHCDBAZ-VQIMIIECSA-N 1 3 346.519 2.509 10 0 EFAEHO Cc1ccc(CN2CC[C@H](NC(=O)CCC[NH+](C)C)C[C@@H]2C)c(C)n1 ZINC001381169421 1348118005 /nfs/dbraw/zinc/11/80/05/1348118005.db2.gz HKARFNGSHCDBAZ-LPHOPBHVSA-N 1 3 346.519 2.509 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@H]1C[NH2+]C[C@@H](C)CC(C)C)N(C)C ZINC001381270484 1348175868 /nfs/dbraw/zinc/17/58/68/1348175868.db2.gz YUOJUGDZJWGNDD-OKZBNKHCSA-N 1 3 325.541 2.980 10 0 EFAEHO CN(Cc1ccc(CF)cc1)C[C@H]1CCCN1C(=O)CC[NH+](C)C ZINC001381298337 1348197701 /nfs/dbraw/zinc/19/77/01/1348197701.db2.gz KKDUGXAPVXQFTM-GOSISDBHSA-N 1 3 335.467 2.531 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]CC2CCC(F)(F)CC2)C1 ZINC001381338875 1348215026 /nfs/dbraw/zinc/21/50/26/1348215026.db2.gz MPPIRECBTUFIQT-UHFFFAOYSA-N 1 3 345.478 2.638 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@@H](C)c2ccccc2C)C1 ZINC001381343227 1348217505 /nfs/dbraw/zinc/21/75/05/1348217505.db2.gz XUNOFDBHTCFDQW-AOCRQIFASA-N 1 3 331.504 2.882 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]Cc1ccc(CF)cc1 ZINC001381389890 1348237476 /nfs/dbraw/zinc/23/74/76/1348237476.db2.gz MCAPSJAHIFSVCM-GJZGRUSLSA-N 1 3 335.467 2.623 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001381393718 1348239601 /nfs/dbraw/zinc/23/96/01/1348239601.db2.gz QFQIREWIZJXSGH-SJORKVTESA-N 1 3 331.504 2.771 10 0 EFAEHO CC[C@H](C)C[NH2+]CC(C)(C)CN(C)C(=O)[C@H]1CCCCN1CC ZINC001381484172 1348304271 /nfs/dbraw/zinc/30/42/71/1348304271.db2.gz HLUAFBBRGHNKEV-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[N@H+](C)CC[C@H]1CCCC1(F)F ZINC001381529241 1348332953 /nfs/dbraw/zinc/33/29/53/1348332953.db2.gz CFGDHLGLYNVHFY-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC001381529241 1348332956 /nfs/dbraw/zinc/33/29/56/1348332956.db2.gz CFGDHLGLYNVHFY-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC[C@H](C)N(C)Cc2ccc(F)cc2)C1 ZINC001381570708 1348367116 /nfs/dbraw/zinc/36/71/16/1348367116.db2.gz HKEXVCOGARXMOO-WMZOPIPTSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC[C@H](C)N(C)Cc2ccc(F)cc2)C1 ZINC001381570708 1348367119 /nfs/dbraw/zinc/36/71/19/1348367119.db2.gz HKEXVCOGARXMOO-WMZOPIPTSA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+](C)[C@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001381582742 1348377954 /nfs/dbraw/zinc/37/79/54/1348377954.db2.gz MLTYIUHHEAIZCL-CRAIPNDOSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cccc(C)c1C[N@H+](C)[C@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001381582742 1348377957 /nfs/dbraw/zinc/37/79/57/1348377957.db2.gz MLTYIUHHEAIZCL-CRAIPNDOSA-N 1 3 331.504 2.582 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@H+](C)C1)N(C)Cc1ccc(C(F)F)cc1 ZINC001381621174 1348410658 /nfs/dbraw/zinc/41/06/58/1348410658.db2.gz PXILNNHSTSNKIS-BBRMVZONSA-N 1 3 339.430 2.512 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(C(F)F)cc1 ZINC001381621174 1348410660 /nfs/dbraw/zinc/41/06/60/1348410660.db2.gz PXILNNHSTSNKIS-BBRMVZONSA-N 1 3 339.430 2.512 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)N(C)Cc1ccc(C(F)F)cc1 ZINC001381621176 1348410933 /nfs/dbraw/zinc/41/09/33/1348410933.db2.gz PXILNNHSTSNKIS-CJNGLKHVSA-N 1 3 339.430 2.512 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(C(F)F)cc1 ZINC001381621176 1348410935 /nfs/dbraw/zinc/41/09/35/1348410935.db2.gz PXILNNHSTSNKIS-CJNGLKHVSA-N 1 3 339.430 2.512 10 0 EFAEHO Cc1ccc(F)c(CN2CCCCC[C@@H]2CNC(=O)CC[NH+](C)C)c1 ZINC001381756208 1348504329 /nfs/dbraw/zinc/50/43/29/1348504329.db2.gz GPWYRTXTWFOZTE-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]CC2CCC(F)(F)CC2)C1)N(C)C ZINC001381965290 1348628617 /nfs/dbraw/zinc/62/86/17/1348628617.db2.gz CUZHOBBJBDRIAI-JYJNAYRXSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2)C1 ZINC001382006510 1348654677 /nfs/dbraw/zinc/65/46/77/1348654677.db2.gz HCOBYHHGVNHKRI-MPGHIAIKSA-N 1 3 335.467 2.711 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001382030320 1348673100 /nfs/dbraw/zinc/67/31/00/1348673100.db2.gz BKWCRUCANDHQSU-PMACEKPBSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@@H]1CCCN1C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001382053288 1348687172 /nfs/dbraw/zinc/68/71/72/1348687172.db2.gz BZFVEUZQYOUVBD-WBMJQRKESA-N 1 3 341.858 2.510 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@H](C)[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001382092719 1348713590 /nfs/dbraw/zinc/71/35/90/1348713590.db2.gz XKBDCUOVNOCIFA-PKOBYXMFSA-N 1 3 333.520 2.889 10 0 EFAEHO C[C@H](CN(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1)NCc1cccnc1 ZINC001382105258 1348724995 /nfs/dbraw/zinc/72/49/95/1348724995.db2.gz XELGIVMWZFVWBZ-MRXNPFEDSA-N 1 3 346.519 2.671 10 0 EFAEHO C[C@H](CN(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1)NCc1cccnc1 ZINC001382105258 1348725001 /nfs/dbraw/zinc/72/50/01/1348725001.db2.gz XELGIVMWZFVWBZ-MRXNPFEDSA-N 1 3 346.519 2.671 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@@H](C)[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001382121082 1348742065 /nfs/dbraw/zinc/74/20/65/1348742065.db2.gz HQMZFNBIOCLPJG-SJLPKXTDSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@H](CN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001382131499 1348751592 /nfs/dbraw/zinc/75/15/92/1348751592.db2.gz ZIPBRENCOXVCSF-DLBZAZTESA-N 1 3 343.515 2.842 10 0 EFAEHO CCc1ccc(CC[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001382131446 1348751629 /nfs/dbraw/zinc/75/16/29/1348751629.db2.gz ZFPRCVNWACPODI-ZWKOTPCHSA-N 1 3 345.531 2.570 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1cc(F)ccc1C ZINC001382166752 1348788500 /nfs/dbraw/zinc/78/85/00/1348788500.db2.gz OTBATKKXYYVQLT-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1cc(F)ccc1C ZINC001382166746 1348788838 /nfs/dbraw/zinc/78/88/38/1348788838.db2.gz OTBATKKXYYVQLT-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)[C@@H]1C ZINC001382299703 1348853270 /nfs/dbraw/zinc/85/32/70/1348853270.db2.gz AQLCYYAYEIKJKT-VQIMIIECSA-N 1 3 331.504 2.668 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)c1 ZINC001382310782 1348860300 /nfs/dbraw/zinc/86/03/00/1348860300.db2.gz JVKBGQWWNLSCAI-PKOBYXMFSA-N 1 3 331.504 2.723 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001382319293 1348866765 /nfs/dbraw/zinc/86/67/65/1348866765.db2.gz XGEAGPVSPWEJDB-IEBWSBKVSA-N 1 3 331.504 2.723 10 0 EFAEHO CC(C)C[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]21 ZINC001382336155 1348888452 /nfs/dbraw/zinc/88/84/52/1348888452.db2.gz PNFRBXPEQCSPGQ-OKZBNKHCSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)C[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)CC(C)(C)C)C[C@H]21 ZINC001382336151 1348888757 /nfs/dbraw/zinc/88/87/57/1348888757.db2.gz PNFRBXPEQCSPGQ-KZNAEPCWSA-N 1 3 337.552 2.837 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@@H]1CC[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001382351024 1348904144 /nfs/dbraw/zinc/90/41/44/1348904144.db2.gz QDBVRIFHJLSPRN-APWZRJJASA-N 1 3 349.494 2.849 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]C[C@@H](C)CC(C)C)C(C)(C)C1 ZINC001382382100 1348924387 /nfs/dbraw/zinc/92/43/87/1348924387.db2.gz XQMYBAUSYQTZLD-DLBZAZTESA-N 1 3 325.541 2.837 10 0 EFAEHO CCc1cccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)c1 ZINC001382385086 1348926482 /nfs/dbraw/zinc/92/64/82/1348926482.db2.gz NWDSPFICBXJBKZ-IBGZPJMESA-N 1 3 345.531 2.916 10 0 EFAEHO CC(C)N(CC[N@H+](C)C[C@@H]1CCC(F)(F)C1)C(=O)[C@H]1CCCN1C ZINC001382499756 1348965700 /nfs/dbraw/zinc/96/57/00/1348965700.db2.gz RJZKZXRAGUPYKQ-HZPDHXFCSA-N 1 3 345.478 2.685 10 0 EFAEHO CC(C)N(CC[N@@H+](C)C[C@@H]1CCC(F)(F)C1)C(=O)[C@H]1CCCN1C ZINC001382499756 1348965706 /nfs/dbraw/zinc/96/57/06/1348965706.db2.gz RJZKZXRAGUPYKQ-HZPDHXFCSA-N 1 3 345.478 2.685 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)C1CC[NH+](Cc2ccsc2)CC1 ZINC001382551112 1349012836 /nfs/dbraw/zinc/01/28/36/1349012836.db2.gz NGTVUMGZVMLQTK-OAHLLOKOSA-N 1 3 349.544 2.949 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@H+](C)Cc1ccccc1C1CC1)N(C)C ZINC001394123018 1357497275 /nfs/dbraw/zinc/49/72/75/1357497275.db2.gz GQRXRAPAHDHTDX-HNAYVOBHSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@@H+](C)Cc1ccccc1C1CC1)N(C)C ZINC001394123018 1357497278 /nfs/dbraw/zinc/49/72/78/1357497278.db2.gz GQRXRAPAHDHTDX-HNAYVOBHSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@H+](C)CCc1ccccc1Cl)N(C)C ZINC001394129676 1357507443 /nfs/dbraw/zinc/50/74/43/1357507443.db2.gz UOJBFGHAVGYPSY-WMLDXEAASA-N 1 3 339.911 2.659 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@@H+](C)CCc1ccccc1Cl)N(C)C ZINC001394129676 1357507447 /nfs/dbraw/zinc/50/74/47/1357507447.db2.gz UOJBFGHAVGYPSY-WMLDXEAASA-N 1 3 339.911 2.659 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]C/C=C/Cl ZINC001394194776 1357576785 /nfs/dbraw/zinc/57/67/85/1357576785.db2.gz XDYRCYTYNLSXKW-RTWZZBQXSA-N 1 3 329.916 2.543 10 0 EFAEHO CCCC[C@H](CNCc1cc(C)ccc1F)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001394205634 1357591977 /nfs/dbraw/zinc/59/19/77/1357591977.db2.gz RBEBTERROQRWBO-FUHWJXTLSA-N 1 3 349.494 2.850 10 0 EFAEHO CCCC[C@H](CNCc1cc(C)ccc1F)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001394205634 1357591980 /nfs/dbraw/zinc/59/19/80/1357591980.db2.gz RBEBTERROQRWBO-FUHWJXTLSA-N 1 3 349.494 2.850 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H](C)C1C[NH+](Cc2cccc(C)c2)C1 ZINC001394225184 1357616498 /nfs/dbraw/zinc/61/64/98/1357616498.db2.gz PJZCNYXSCQHHIH-APWZRJJASA-N 1 3 349.494 2.611 10 0 EFAEHO CN(C[C@H]1CCN1[C@H]1CCc2ccccc21)C(=O)CCC[NH+](C)C ZINC001388650191 1352889932 /nfs/dbraw/zinc/88/99/32/1352889932.db2.gz URKUZANSDRBSNJ-MJGOQNOKSA-N 1 3 329.488 2.548 10 0 EFAEHO CCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H](C(C)C)[NH+]2CCCC2)C1 ZINC001388746486 1352973248 /nfs/dbraw/zinc/97/32/48/1352973248.db2.gz JEHSYPVZTIPIQT-XUVXKRRUSA-N 1 3 343.515 2.711 10 0 EFAEHO Cc1cncc(C[NH2+][C@@H]2CCCCCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001388786414 1353014312 /nfs/dbraw/zinc/01/43/12/1353014312.db2.gz BLPNJDYUFOCHNX-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@H](C(=O)N1C[C@H]2CCN(C/C=C/Cl)C[C@H]2C1)[NH+](CC)CC ZINC001388792637 1353022616 /nfs/dbraw/zinc/02/26/16/1353022616.db2.gz IHZOOPGQHHVLFW-OCTWKEBNSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+][C@H]1CCCCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001388796852 1353027804 /nfs/dbraw/zinc/02/78/04/1353027804.db2.gz JBCMDHIBUJUHHJ-IRXDYDNUSA-N 1 3 334.508 2.995 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]1C ZINC001388803556 1353034893 /nfs/dbraw/zinc/03/48/93/1353034893.db2.gz SAKOSHNMMAAPMT-UXPWSPDFSA-N 1 3 345.531 2.914 10 0 EFAEHO CCc1ccccc1C[N@H+]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]1C ZINC001388803556 1353034900 /nfs/dbraw/zinc/03/49/00/1353034900.db2.gz SAKOSHNMMAAPMT-UXPWSPDFSA-N 1 3 345.531 2.914 10 0 EFAEHO Cc1ccccc1C[N@H+]1C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001394281259 1357664750 /nfs/dbraw/zinc/66/47/50/1357664750.db2.gz GCWBCJIZZHKEOG-OALUTQOASA-N 1 3 345.531 2.908 10 0 EFAEHO Cc1ccccc1C[N@@H+]1C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001394281259 1357664755 /nfs/dbraw/zinc/66/47/55/1357664755.db2.gz GCWBCJIZZHKEOG-OALUTQOASA-N 1 3 345.531 2.908 10 0 EFAEHO Cc1ccc(CN2C[C@@H](NC(=O)C3(C[NH+](C)C)CC3)C(C)(C)C2)cc1 ZINC001394290940 1357677137 /nfs/dbraw/zinc/67/71/37/1357677137.db2.gz VBIFDHQRYGFLGW-GOSISDBHSA-N 1 3 343.515 2.663 10 0 EFAEHO CCc1cccc(CN2CC[C@@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001389459956 1353406252 /nfs/dbraw/zinc/40/62/52/1353406252.db2.gz KMQAPAHKQZEDRK-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1cccc(CN2CC[C@@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001389459956 1353406256 /nfs/dbraw/zinc/40/62/56/1353406256.db2.gz KMQAPAHKQZEDRK-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO CC[C@H](F)CN1CCC2(C[C@@H]2NC(=O)CC[NH+]2CCCCC2)CC1 ZINC001389519440 1353448375 /nfs/dbraw/zinc/44/83/75/1353448375.db2.gz CCDGXFCALGYHQU-IRXDYDNUSA-N 1 3 339.499 2.581 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)[C@@H]2CCCN2C(C)C)C2CC2)cc1 ZINC001389611709 1353510304 /nfs/dbraw/zinc/51/03/04/1353510304.db2.gz OSUHGLCYTCOFKK-PMACEKPBSA-N 1 3 343.515 2.852 10 0 EFAEHO CN(CC(=O)NC[C@@H]([NH2+]CCC(C)(C)C)C1CC1)CC(C)(C)C ZINC001389669323 1353541768 /nfs/dbraw/zinc/54/17/68/1353541768.db2.gz PVADQBPZIJRLLY-MRXNPFEDSA-N 1 3 325.541 2.885 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C2CC2)c(C)c1 ZINC001389680897 1353550694 /nfs/dbraw/zinc/55/06/94/1353550694.db2.gz CRWCDKQXMDQSSP-HXUWFJFHSA-N 1 3 345.531 2.936 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@H+](C)CC2CC(C)(C)C2)C1 ZINC001389732658 1353588374 /nfs/dbraw/zinc/58/83/74/1353588374.db2.gz FCYVCKWKOHIJHY-QGZVFWFLSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@@H+](C)CC2CC(C)(C)C2)C1 ZINC001389732658 1353588377 /nfs/dbraw/zinc/58/83/77/1353588377.db2.gz FCYVCKWKOHIJHY-QGZVFWFLSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(F)cc1)N(C)C ZINC001389942585 1353701616 /nfs/dbraw/zinc/70/16/16/1353701616.db2.gz SOKYPRAPGGFANC-XVLXNVKGSA-N 1 3 347.478 2.778 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(F)cc1)N(C)C ZINC001389942585 1353701617 /nfs/dbraw/zinc/70/16/17/1353701617.db2.gz SOKYPRAPGGFANC-XVLXNVKGSA-N 1 3 347.478 2.778 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c(C)c1 ZINC001389959634 1353711000 /nfs/dbraw/zinc/71/10/00/1353711000.db2.gz OBJRRWQJNLOWKL-NSHGMRRFSA-N 1 3 345.531 2.935 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](N[C@@H](C)c2ccc(F)cc2F)C1 ZINC001390001835 1353734650 /nfs/dbraw/zinc/73/46/50/1353734650.db2.gz FJPOVLVSNSDUJR-AEGPPILISA-N 1 3 339.430 2.604 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](N[C@@H](C)c2ccc(F)cc2F)C1 ZINC001390001835 1353734653 /nfs/dbraw/zinc/73/46/53/1353734653.db2.gz FJPOVLVSNSDUJR-AEGPPILISA-N 1 3 339.430 2.604 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc(C(F)F)c2)C1 ZINC001390022915 1353747801 /nfs/dbraw/zinc/74/78/01/1353747801.db2.gz BCKRLFADMPMYFD-IYBDPMFKSA-N 1 3 339.430 2.701 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](Cc2cc(C)ccc2C)C1)N(C)C ZINC001390035285 1353755165 /nfs/dbraw/zinc/75/51/65/1353755165.db2.gz ITSGQNNNFASYQX-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](Cc2cc(C)ccc2C)C1)N(C)C ZINC001390035285 1353755171 /nfs/dbraw/zinc/75/51/71/1353755171.db2.gz ITSGQNNNFASYQX-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc(CF)cc1 ZINC001390359814 1354027449 /nfs/dbraw/zinc/02/74/49/1354027449.db2.gz JSFIVPSVZHTONR-QAPCUYQASA-N 1 3 335.467 2.623 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)c(C)s1 ZINC001390359757 1354028070 /nfs/dbraw/zinc/02/80/70/1354028070.db2.gz JNMBAIUNNOBECG-DYVFJYSZSA-N 1 3 337.533 2.832 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)[NH+]1CCCC1)N[C@H](C)c1ccccc1F ZINC001390454083 1354091249 /nfs/dbraw/zinc/09/12/49/1354091249.db2.gz BGCDTWVVJBQXRR-HUUCEWRRSA-N 1 3 335.467 2.855 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC[C@@H](C)NCc2cccc(F)c2)C1 ZINC001390455211 1354091672 /nfs/dbraw/zinc/09/16/72/1354091672.db2.gz GRSAUFGBTYVTSE-WBVHZDCISA-N 1 3 335.467 2.542 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC[C@@H](C)NCc2cccc(F)c2)C1 ZINC001390455211 1354091678 /nfs/dbraw/zinc/09/16/78/1354091678.db2.gz GRSAUFGBTYVTSE-WBVHZDCISA-N 1 3 335.467 2.542 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](C)CNC(=O)[C@H](C)N2CCCCCC2)c1 ZINC001390479017 1354112814 /nfs/dbraw/zinc/11/28/14/1354112814.db2.gz KWBITNINFBHYBE-MSOLQXFVSA-N 1 3 331.504 2.854 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](C)CNC(=O)[C@@H](C)N2CCCCCC2)c1 ZINC001390479019 1354112874 /nfs/dbraw/zinc/11/28/74/1354112874.db2.gz KWBITNINFBHYBE-QZTJIDSGSA-N 1 3 331.504 2.854 10 0 EFAEHO CC(C)c1ccc(C[NH2+][C@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001390479911 1354113661 /nfs/dbraw/zinc/11/36/61/1354113661.db2.gz KGGRELXCKHYIDS-DLBZAZTESA-N 1 3 331.504 2.746 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]Cc1ccc(C(F)F)cc1)N(C)C ZINC001390511211 1354137050 /nfs/dbraw/zinc/13/70/50/1354137050.db2.gz PCKXRYLIINNECV-SWLSCSKDSA-N 1 3 327.419 2.559 10 0 EFAEHO CC[C@@H]([NH2+]C[C@H]1CCN(C(=O)CN2CCCC2)C1)c1ccccc1 ZINC001390606900 1354202158 /nfs/dbraw/zinc/20/21/58/1354202158.db2.gz UCOIXLUVYHWQFT-IEBWSBKVSA-N 1 3 329.488 2.672 10 0 EFAEHO CC[C@@H]([NH2+]C[C@@H]1CCN(C(=O)CN2CCCC2)C1)c1ccccc1 ZINC001390607499 1354202225 /nfs/dbraw/zinc/20/22/25/1354202225.db2.gz UCOIXLUVYHWQFT-PKOBYXMFSA-N 1 3 329.488 2.672 10 0 EFAEHO COc1cccc(C[NH2+][C@@H]2CCC[C@@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001390613726 1354209090 /nfs/dbraw/zinc/20/90/90/1354209090.db2.gz TVLYJRUBRLTACU-QZTJIDSGSA-N 1 3 347.503 2.552 10 0 EFAEHO Cc1cccnc1C[NH2+][C@@H](C)CCNC(=O)[C@@H]1CCCCN1C(C)C ZINC001390708463 1354299630 /nfs/dbraw/zinc/29/96/30/1354299630.db2.gz ZPFODYXTBOBJHT-HKUYNNGSSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H](C)[NH2+]CC[C@H]1CCCC1(F)F ZINC001390719012 1354311452 /nfs/dbraw/zinc/31/14/52/1354311452.db2.gz LFPRFNPDXSXNQY-TZMCWYRMSA-N 1 3 342.434 2.571 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]Cc1cc(C)ccc1F ZINC001390733527 1354324716 /nfs/dbraw/zinc/32/47/16/1354324716.db2.gz QDNFXDCHHMQSET-LPHOPBHVSA-N 1 3 349.494 2.993 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@@H]2CCC[C@@H]3CCC[N@@H+]32)c1 ZINC001390826145 1354412303 /nfs/dbraw/zinc/41/23/03/1354412303.db2.gz MQQUWVSEVRBEKV-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@@H]2CCC[C@@H]3CCC[N@H+]32)c1 ZINC001390826145 1354412305 /nfs/dbraw/zinc/41/23/05/1354412305.db2.gz MQQUWVSEVRBEKV-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO CN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)[C@@H]1CCc2ccc(Cl)cc21 ZINC001390847887 1354431599 /nfs/dbraw/zinc/43/15/99/1354431599.db2.gz VJAXTYIKVQZUAD-KBXCAEBGSA-N 1 3 349.906 2.717 10 0 EFAEHO CN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)[C@@H]1CCc2ccc(Cl)cc21 ZINC001390847887 1354431608 /nfs/dbraw/zinc/43/16/08/1354431608.db2.gz VJAXTYIKVQZUAD-KBXCAEBGSA-N 1 3 349.906 2.717 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001390859086 1354442204 /nfs/dbraw/zinc/44/22/04/1354442204.db2.gz AQOQYWGWZUKREE-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001390859086 1354442208 /nfs/dbraw/zinc/44/22/08/1354442208.db2.gz AQOQYWGWZUKREE-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CC)C/C=C\c2ccccc2)CC[N@@H+]1C ZINC001390907445 1354504000 /nfs/dbraw/zinc/50/40/00/1354504000.db2.gz QLHKLBWHKVBBCV-KLMKZAPQSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CC)C/C=C\c2ccccc2)CC[N@H+]1C ZINC001390907445 1354504008 /nfs/dbraw/zinc/50/40/08/1354504008.db2.gz QLHKLBWHKVBBCV-KLMKZAPQSA-N 1 3 343.515 2.868 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)Cc1ccc(Cl)cc1 ZINC001390982894 1354633673 /nfs/dbraw/zinc/63/36/73/1354633673.db2.gz AUQMTKLXGKEZKX-MRXNPFEDSA-N 1 3 337.895 2.620 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)Cc1ccc(Cl)cc1 ZINC001390982894 1354633682 /nfs/dbraw/zinc/63/36/82/1354633682.db2.gz AUQMTKLXGKEZKX-MRXNPFEDSA-N 1 3 337.895 2.620 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CC[N@H+](CC2CCCC2)C1)N1CCCCCC1 ZINC001391096510 1354789153 /nfs/dbraw/zinc/78/91/53/1354789153.db2.gz MEMCDDSTXSSUJN-PKOBYXMFSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CC[N@@H+](CC2CCCC2)C1)N1CCCCCC1 ZINC001391096510 1354789158 /nfs/dbraw/zinc/78/91/58/1354789158.db2.gz MEMCDDSTXSSUJN-PKOBYXMFSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@H+](Cc2cc(C)sc2C)C1)N(C)C ZINC001391110341 1354809142 /nfs/dbraw/zinc/80/91/42/1354809142.db2.gz LKCLCRYTLVLEMA-NVXWUHKLSA-N 1 3 337.533 2.643 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@@H+](Cc2cc(C)sc2C)C1)N(C)C ZINC001391110341 1354809147 /nfs/dbraw/zinc/80/91/47/1354809147.db2.gz LKCLCRYTLVLEMA-NVXWUHKLSA-N 1 3 337.533 2.643 10 0 EFAEHO CC1CCC(C[N@H+](CCNC(=O)C2(N(C)C)CCC2)C2CC2)CC1 ZINC001391170866 1354895071 /nfs/dbraw/zinc/89/50/71/1354895071.db2.gz VQAJCNMSYKYMLP-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO CC1CCC(C[N@@H+](CCNC(=O)C2(N(C)C)CCC2)C2CC2)CC1 ZINC001391170866 1354895074 /nfs/dbraw/zinc/89/50/74/1354895074.db2.gz VQAJCNMSYKYMLP-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)N(CCNC(=O)CC[NH+](C)C)C1CC1 ZINC001391175780 1354901695 /nfs/dbraw/zinc/90/16/95/1354901695.db2.gz PHXKPNDENVIOTN-AWEZNQCLSA-N 1 3 337.895 2.933 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+][C@H](C)c1cccc(OC)c1 ZINC001391226264 1354948537 /nfs/dbraw/zinc/94/85/37/1354948537.db2.gz MTVUMQVUMLWWGY-VQIMIIECSA-N 1 3 347.503 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+]CC1CCCC1)c1ccccc1 ZINC001391243257 1354966430 /nfs/dbraw/zinc/96/64/30/1354966430.db2.gz KDIUTMUAWIUSSF-IBGZPJMESA-N 1 3 331.504 2.964 10 0 EFAEHO CCCN(C(=O)CC[NH+](C)C)[C@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001391274287 1355003422 /nfs/dbraw/zinc/00/34/22/1355003422.db2.gz MKRYORUEYVINDP-IBGZPJMESA-N 1 3 331.504 2.760 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCCN1C(C)C)[C@H]1CC[N@H+](CCC2CC2)C1 ZINC001391279649 1355011809 /nfs/dbraw/zinc/01/18/09/1355011809.db2.gz LXVAWRSJZDGHQT-OALUTQOASA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCCN1C(C)C)[C@H]1CC[N@@H+](CCC2CC2)C1 ZINC001391279649 1355011813 /nfs/dbraw/zinc/01/18/13/1355011813.db2.gz LXVAWRSJZDGHQT-OALUTQOASA-N 1 3 335.536 2.972 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CCNC(=O)CN3CC[C@@H](C)C3)C2)cc1 ZINC001391323882 1355076133 /nfs/dbraw/zinc/07/61/33/1355076133.db2.gz LLPIRASUGNLMCX-UYAOXDASSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CCNC(=O)CN3CC[C@@H](C)C3)C2)cc1 ZINC001391323882 1355076137 /nfs/dbraw/zinc/07/61/37/1355076137.db2.gz LLPIRASUGNLMCX-UYAOXDASSA-N 1 3 343.515 2.665 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CC[C@@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001391335626 1355090415 /nfs/dbraw/zinc/09/04/15/1355090415.db2.gz KPPJJUVNBFCJPS-DLBZAZTESA-N 1 3 349.494 2.938 10 0 EFAEHO C[C@H](F)CC[N@H+]1CC[C@@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001391335626 1355090421 /nfs/dbraw/zinc/09/04/21/1355090421.db2.gz KPPJJUVNBFCJPS-DLBZAZTESA-N 1 3 349.494 2.938 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)CC[C@@H]3CCC[N@H+]3C)C2)cc1C ZINC001391485835 1355237714 /nfs/dbraw/zinc/23/77/14/1355237714.db2.gz GTQVPLDZJLYQEG-FQEVSTJZSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)cc1C ZINC001391485835 1355237719 /nfs/dbraw/zinc/23/77/19/1355237719.db2.gz GTQVPLDZJLYQEG-FQEVSTJZSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001391552835 1355299926 /nfs/dbraw/zinc/29/99/26/1355299926.db2.gz KAYNDQZIWGCCEW-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001391552835 1355299932 /nfs/dbraw/zinc/29/99/32/1355299932.db2.gz KAYNDQZIWGCCEW-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccccc1CN1CC[C@H](NC(=O)CC[C@H]2CCC[N@H+]2C)C1 ZINC001391553436 1355300139 /nfs/dbraw/zinc/30/01/39/1355300139.db2.gz MUXHYRYOBOZXNU-RBUKOAKNSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccccc1CN1CC[C@H](NC(=O)CC[C@H]2CCC[N@@H+]2C)C1 ZINC001391553436 1355300142 /nfs/dbraw/zinc/30/01/42/1355300142.db2.gz MUXHYRYOBOZXNU-RBUKOAKNSA-N 1 3 329.488 2.560 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@H]1CCN(CCCc2ccsc2)C1 ZINC001391554386 1355301592 /nfs/dbraw/zinc/30/15/92/1355301592.db2.gz XMTUMPRTDYOROB-ROUUACIJSA-N 1 3 349.544 2.746 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@H]1CCN(CCCc2ccsc2)C1 ZINC001391554386 1355301596 /nfs/dbraw/zinc/30/15/96/1355301596.db2.gz XMTUMPRTDYOROB-ROUUACIJSA-N 1 3 349.544 2.746 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(CC)CC ZINC001391562123 1355306740 /nfs/dbraw/zinc/30/67/40/1355306740.db2.gz JOARHNRUHDWKPM-ZWKOTPCHSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(CC)CC ZINC001391562123 1355306742 /nfs/dbraw/zinc/30/67/42/1355306742.db2.gz JOARHNRUHDWKPM-ZWKOTPCHSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)[C@@H]1CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001391633521 1355380603 /nfs/dbraw/zinc/38/06/03/1355380603.db2.gz LNSJTMPUVDJURX-GOSISDBHSA-N 1 3 342.487 2.542 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)[C@@H]1CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001391633521 1355380605 /nfs/dbraw/zinc/38/06/05/1355380605.db2.gz LNSJTMPUVDJURX-GOSISDBHSA-N 1 3 342.487 2.542 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1cccc(C)c1 ZINC001391696077 1355442541 /nfs/dbraw/zinc/44/25/41/1355442541.db2.gz SOOSZPAJCWJAOV-MOPGFXCFSA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001391721393 1355465433 /nfs/dbraw/zinc/46/54/33/1355465433.db2.gz VTBBVOXXCHJLJU-HUUCEWRRSA-N 1 3 345.478 2.781 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCC[N@@H+]1C(C)C)NCc1ncccc1C ZINC001391728149 1355472129 /nfs/dbraw/zinc/47/21/29/1355472129.db2.gz MRHHFLMQHJHDIH-HKUYNNGSSA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCC[N@H+]1C(C)C)NCc1ncccc1C ZINC001391728149 1355472133 /nfs/dbraw/zinc/47/21/33/1355472133.db2.gz MRHHFLMQHJHDIH-HKUYNNGSSA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)NCc1ccccc1Cl ZINC001391735339 1355479619 /nfs/dbraw/zinc/47/96/19/1355479619.db2.gz KBKLBHNGANELMU-HOCLYGCPSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)NCc1ccccc1Cl ZINC001391735339 1355479620 /nfs/dbraw/zinc/47/96/20/1355479620.db2.gz KBKLBHNGANELMU-HOCLYGCPSA-N 1 3 337.895 2.666 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1(C[NH2+]CC2CC3(CCC3)C2)CCCC1 ZINC001391775231 1355519828 /nfs/dbraw/zinc/51/98/28/1355519828.db2.gz BNWFNJIUECKHPX-UHFFFAOYSA-N 1 3 344.503 2.860 10 0 EFAEHO Cc1ccc(F)c(CNCC2(NC(=O)[C@H]3CC[N@@H+](C)C3)CCCC2)c1 ZINC001391776223 1355520337 /nfs/dbraw/zinc/52/03/37/1355520337.db2.gz HDIWATNHLCQQHP-INIZCTEOSA-N 1 3 347.478 2.604 10 0 EFAEHO Cc1ccc(F)c(CNCC2(NC(=O)[C@H]3CC[N@H+](C)C3)CCCC2)c1 ZINC001391776223 1355520338 /nfs/dbraw/zinc/52/03/38/1355520338.db2.gz HDIWATNHLCQQHP-INIZCTEOSA-N 1 3 347.478 2.604 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@](C)(C[NH2+][C@@H](C)c1ccccc1)C1CC1 ZINC001391799295 1355541832 /nfs/dbraw/zinc/54/18/32/1355541832.db2.gz DAOKGTMGRHPCIV-OXJNMPFZSA-N 1 3 331.504 2.962 10 0 EFAEHO CC[C@H](F)C[NH2+][C@H]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001391827901 1355570846 /nfs/dbraw/zinc/57/08/46/1355570846.db2.gz WTGMMENAHAKJTJ-JYJNAYRXSA-N 1 3 329.504 2.729 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1CC[C@H]([NH2+]CCC(F)(F)F)CC1 ZINC001391829763 1355571863 /nfs/dbraw/zinc/57/18/63/1355571863.db2.gz BUTCSGKCOMBTGV-KBUPBQIOSA-N 1 3 349.441 2.829 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[C@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001391830367 1355572767 /nfs/dbraw/zinc/57/27/67/1355572767.db2.gz DGHAULBLIHSOLN-FPCVCCKLSA-N 1 3 345.478 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC001391833733 1355576897 /nfs/dbraw/zinc/57/68/97/1355576897.db2.gz RZPSMRMAQTVQFD-JYJNAYRXSA-N 1 3 345.478 2.779 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C[NH2+]CC1CC(C)(C)C1)CC(C)C ZINC001392171896 1355825832 /nfs/dbraw/zinc/82/58/32/1355825832.db2.gz VMHBBZVIXYLFHE-INIZCTEOSA-N 1 3 334.508 2.817 10 0 EFAEHO CC(C)C[C@H](C[NH2+]Cc1ccsc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001392174038 1355827529 /nfs/dbraw/zinc/82/75/29/1355827529.db2.gz WYNWMILHZRIWGQ-NVXWUHKLSA-N 1 3 337.533 2.710 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001392185628 1355839361 /nfs/dbraw/zinc/83/93/61/1355839361.db2.gz WGALXGRSUATQDT-UYAOXDASSA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H](C)[NH2+]CCC(C)(C)C)C1 ZINC001392188707 1355843268 /nfs/dbraw/zinc/84/32/68/1355843268.db2.gz KIPOMEHSJXTCJI-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001392286168 1355942066 /nfs/dbraw/zinc/94/20/66/1355942066.db2.gz UOYVIJKKTSGOBI-LJQANCHMSA-N 1 3 331.504 2.760 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)CC[C@H]1CCC[N@H+]1C ZINC001392286168 1355942069 /nfs/dbraw/zinc/94/20/69/1355942069.db2.gz UOYVIJKKTSGOBI-LJQANCHMSA-N 1 3 331.504 2.760 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001392297692 1355953404 /nfs/dbraw/zinc/95/34/04/1355953404.db2.gz KWZLMDWYRPYHMP-ROUUACIJSA-N 1 3 331.504 2.616 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001392297692 1355953407 /nfs/dbraw/zinc/95/34/07/1355953407.db2.gz KWZLMDWYRPYHMP-ROUUACIJSA-N 1 3 331.504 2.616 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2Cc2ccsc2)C1 ZINC001392356531 1356016623 /nfs/dbraw/zinc/01/66/23/1356016623.db2.gz ZFKDKPDMKLEUCX-DLBZAZTESA-N 1 3 335.517 2.513 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2Cc2ccsc2)C1 ZINC001392356531 1356016628 /nfs/dbraw/zinc/01/66/28/1356016628.db2.gz ZFKDKPDMKLEUCX-DLBZAZTESA-N 1 3 335.517 2.513 10 0 EFAEHO CCN(CC[NH2+][C@H](C)c1cccc(Cl)c1)C(=O)CN1CCCC1 ZINC001392453541 1356049093 /nfs/dbraw/zinc/04/90/93/1356049093.db2.gz ADIGWZBZWDHWOU-OAHLLOKOSA-N 1 3 337.895 2.935 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001392683052 1356232171 /nfs/dbraw/zinc/23/21/71/1356232171.db2.gz HMSQZPRIZORVRF-HNAYVOBHSA-N 1 3 345.531 2.890 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001392683052 1356232173 /nfs/dbraw/zinc/23/21/73/1356232173.db2.gz HMSQZPRIZORVRF-HNAYVOBHSA-N 1 3 345.531 2.890 10 0 EFAEHO CC(C)CC[N@H+](C)C[C@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001392688155 1356238159 /nfs/dbraw/zinc/23/81/59/1356238159.db2.gz RHBCHEVFHPNBTR-YJBOKZPZSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)CC[N@@H+](C)C[C@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001392688155 1356238163 /nfs/dbraw/zinc/23/81/63/1356238163.db2.gz RHBCHEVFHPNBTR-YJBOKZPZSA-N 1 3 329.504 2.682 10 0 EFAEHO CCc1ccccc1C[N@H+](C)C[C@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001392690145 1356240421 /nfs/dbraw/zinc/24/04/21/1356240421.db2.gz WUHWQFJLGKMZFH-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccccc1C[N@@H+](C)C[C@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001392690145 1356240423 /nfs/dbraw/zinc/24/04/23/1356240423.db2.gz WUHWQFJLGKMZFH-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+][C@@H](C)c1ccc(F)cc1)C1CC1 ZINC001392796460 1356334466 /nfs/dbraw/zinc/33/44/66/1356334466.db2.gz COAFQNDEDRJTHK-KSSFIOAISA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCN1CC1CC2(CCC2)C1)[NH+]1CCCC1 ZINC001392853426 1356378064 /nfs/dbraw/zinc/37/80/64/1356378064.db2.gz IGVNWGGDPUFPIU-QGZVFWFLSA-N 1 3 333.520 2.632 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3csc(C)c3)CC2)CC[N@@H+]1C ZINC001392906954 1356422669 /nfs/dbraw/zinc/42/26/69/1356422669.db2.gz FJBQEXBBBBOFGG-JKSUJKDBSA-N 1 3 335.517 2.525 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3csc(C)c3)CC2)CC[N@H+]1C ZINC001392906954 1356422674 /nfs/dbraw/zinc/42/26/74/1356422674.db2.gz FJBQEXBBBBOFGG-JKSUJKDBSA-N 1 3 335.517 2.525 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+][C@H]3CCc4c3cccc4F)CC2)CCC1 ZINC001392910391 1356424638 /nfs/dbraw/zinc/42/46/38/1356424638.db2.gz BNKHSTHNCSZSLM-KRWDZBQOSA-N 1 3 345.462 2.536 10 0 EFAEHO Cc1ccc(F)cc1CNC1(CNC(=O)C(C)(C)[NH+]2CCCC2)CC1 ZINC001392924811 1356436294 /nfs/dbraw/zinc/43/62/94/1356436294.db2.gz LVTQWECFNWPKPJ-UHFFFAOYSA-N 1 3 347.478 2.747 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]Cc2ccc(Cl)cc2)CC1)N1CCCC1 ZINC001392926383 1356437218 /nfs/dbraw/zinc/43/72/18/1356437218.db2.gz UNMXDRAWTHJFJW-UHFFFAOYSA-N 1 3 349.906 2.953 10 0 EFAEHO C[C@H](C(=O)NCC1([NH2+]CC2CC(C)(C)C2)CC1)N1CCCCCC1 ZINC001392944272 1356454233 /nfs/dbraw/zinc/45/42/33/1356454233.db2.gz WHHKUTZVCGTMNN-MRXNPFEDSA-N 1 3 335.536 2.926 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+][C@@H](C)c2ccc3c(c2)CCC3)CC1 ZINC001392948069 1356456985 /nfs/dbraw/zinc/45/69/85/1356456985.db2.gz FLQJTNHKKZGYOM-INIZCTEOSA-N 1 3 343.515 2.817 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+][C@H](C)c2ccc3c(c2)CCC3)CC1 ZINC001392948076 1356457223 /nfs/dbraw/zinc/45/72/23/1356457223.db2.gz FLQJTNHKKZGYOM-MRXNPFEDSA-N 1 3 343.515 2.817 10 0 EFAEHO C[NH+](C)Cc1cccc(C(=O)NCC2(NCc3ccsc3)CC2)c1 ZINC001392960353 1356467433 /nfs/dbraw/zinc/46/74/33/1356467433.db2.gz BNLPVIZDUNHHTL-UHFFFAOYSA-N 1 3 343.496 2.862 10 0 EFAEHO Cc1ccccc1C[NH2+]C1(CNC(=O)CN2[C@H](C)CC[C@@H]2C)CC1 ZINC001392960428 1356467877 /nfs/dbraw/zinc/46/78/77/1356467877.db2.gz KIWMPZBRIMYFFP-CALCHBBNSA-N 1 3 329.488 2.606 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]Cc2cccc(Cl)c2)CC1 ZINC001392964329 1356470898 /nfs/dbraw/zinc/47/08/98/1356470898.db2.gz UFNRMPGTYMDQMS-GJZGRUSLSA-N 1 3 349.906 2.951 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)NCCN(CCF)C1CCCCCC1 ZINC001392969156 1356475589 /nfs/dbraw/zinc/47/55/89/1356475589.db2.gz OOCWGFAKBSPPFY-IRXDYDNUSA-N 1 3 341.515 2.970 10 0 EFAEHO CN(CCNC(=O)CCCC[NH+](C)C)[C@@H]1CCc2ccc(F)cc21 ZINC001492817050 1356492207 /nfs/dbraw/zinc/49/22/07/1356492207.db2.gz KBWQUZMQSSYPFL-GOSISDBHSA-N 1 3 335.467 2.593 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(CF)cc2)C[C@@H]1C ZINC001393035329 1356527768 /nfs/dbraw/zinc/52/77/68/1356527768.db2.gz YQVUSGUPSVWTAP-QFBILLFUSA-N 1 3 349.494 2.965 10 0 EFAEHO CC[C@@H](F)CNC[C@H]1CCCN1C(=O)CC[N@H+](C)C1CCCCC1 ZINC001393053336 1356540785 /nfs/dbraw/zinc/54/07/85/1356540785.db2.gz VBUGNQQPYYVCMZ-SJLPKXTDSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@@H](F)CNC[C@H]1CCCN1C(=O)CC[N@@H+](C)C1CCCCC1 ZINC001393053336 1356540790 /nfs/dbraw/zinc/54/07/90/1356540790.db2.gz VBUGNQQPYYVCMZ-SJLPKXTDSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@@H](C(=O)NC1(C)CC[NH+]([C@@H]2CCc3ccccc32)CC1)N(C)C ZINC001393070448 1356558367 /nfs/dbraw/zinc/55/83/67/1356558367.db2.gz LGFCSRCPJXYXJD-RBUKOAKNSA-N 1 3 343.515 2.985 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+]CC2CCCC2)C2CCCC2)CCC1 ZINC001393073286 1356561444 /nfs/dbraw/zinc/56/14/44/1356561444.db2.gz QOUBGKAZZDBNLN-GOSISDBHSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@@H](F)CN1CCC(C)(CNC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)CC1 ZINC001393176749 1356682774 /nfs/dbraw/zinc/68/27/74/1356682774.db2.gz QXGNVRWECVENLN-IXDOHACOSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[C@@H](F)CN1CCC(C)(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)CC1 ZINC001393176749 1356682779 /nfs/dbraw/zinc/68/27/79/1356682779.db2.gz QXGNVRWECVENLN-IXDOHACOSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)(C(=O)NC[C@@]1(C)CCC[N@H+](CCC2CC2)C1)N1CCCC1 ZINC001393192444 1356702305 /nfs/dbraw/zinc/70/23/05/1356702305.db2.gz IHRGOPPMPXYVLG-HXUWFJFHSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)(C(=O)NC[C@@]1(C)CCC[N@@H+](CCC2CC2)C1)N1CCCC1 ZINC001393192444 1356702308 /nfs/dbraw/zinc/70/23/08/1356702308.db2.gz IHRGOPPMPXYVLG-HXUWFJFHSA-N 1 3 335.536 2.879 10 0 EFAEHO CCC(CC)C[N@@H+]1CCC(F)(F)[C@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001393240073 1356745580 /nfs/dbraw/zinc/74/55/80/1356745580.db2.gz IYNMUVDJMWDVPP-HZPDHXFCSA-N 1 3 347.494 2.836 10 0 EFAEHO CCC(CC)C[N@H+]1CCC(F)(F)[C@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001393240073 1356745583 /nfs/dbraw/zinc/74/55/83/1356745583.db2.gz IYNMUVDJMWDVPP-HZPDHXFCSA-N 1 3 347.494 2.836 10 0 EFAEHO CCC(CC)C[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@H](CC)N(C)C)C1 ZINC001393240066 1356745750 /nfs/dbraw/zinc/74/57/50/1356745750.db2.gz IYNMUVDJMWDVPP-HOTGVXAUSA-N 1 3 347.494 2.836 10 0 EFAEHO CCC(CC)C[N@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@H](CC)N(C)C)C1 ZINC001393240066 1356745755 /nfs/dbraw/zinc/74/57/55/1356745755.db2.gz IYNMUVDJMWDVPP-HOTGVXAUSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](F)CN1CC[C@H]2[C@@H]1CCCN2C(=O)CCC[NH+]1CCCC1 ZINC001393466319 1356866809 /nfs/dbraw/zinc/86/68/09/1356866809.db2.gz QCMDCJICGZJXMT-BZSNNMDCSA-N 1 3 339.499 2.676 10 0 EFAEHO CC[C@@H](F)CN1C[C@@H]2CCCN(C(=O)CCC[NH+]3CCCC3)[C@@H]2C1 ZINC001393469309 1356869765 /nfs/dbraw/zinc/86/97/65/1356869765.db2.gz ZAFQDQGWPBQVPD-RCCFBDPRSA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@H](NC/C=C/Cl)c1ccc(CNC(=O)[C@@H]2CC[N@H+](C)C2)cc1 ZINC001393484492 1356887133 /nfs/dbraw/zinc/88/71/33/1356887133.db2.gz CRRHBDNGMAIGJY-JMJUDDAMSA-N 1 3 335.879 2.658 10 0 EFAEHO C[C@H](NC/C=C/Cl)c1ccc(CNC(=O)[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001393484492 1356887140 /nfs/dbraw/zinc/88/71/40/1356887140.db2.gz CRRHBDNGMAIGJY-JMJUDDAMSA-N 1 3 335.879 2.658 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1C[NH2+][C@@H]1CCc2ccccc21 ZINC001393525594 1356919870 /nfs/dbraw/zinc/91/98/70/1356919870.db2.gz QUGXLRAEZVZFJZ-UYAOXDASSA-N 1 3 343.515 2.986 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@@H](C(=O)NCC2(NCc3ccsc3)CCC2)C1 ZINC001393566260 1356954962 /nfs/dbraw/zinc/95/49/62/1356954962.db2.gz MDRLJCBVBYUABI-SJORKVTESA-N 1 3 349.544 2.997 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCCN(C/C=C/Cl)CC1)[NH+](CC)CC ZINC001393590867 1356970788 /nfs/dbraw/zinc/97/07/88/1356970788.db2.gz AHVKNFNVLGXULT-UGTRGGQESA-N 1 3 329.916 2.830 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCCN(Cc2cccnc2)CC1)[NH+](CC)CC ZINC001393598726 1356983166 /nfs/dbraw/zinc/98/31/66/1356983166.db2.gz VOFVXBLUNJDHAL-RTBURBONSA-N 1 3 346.519 2.673 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCCN(Cc2ccc(C)nc2C)CC1 ZINC001393600987 1356987316 /nfs/dbraw/zinc/98/73/16/1356987316.db2.gz DOKKWXLSRFLDSZ-IBGZPJMESA-N 1 3 346.519 2.511 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCCN(Cc2ccc(C)nc2C)CC1 ZINC001393600987 1356987319 /nfs/dbraw/zinc/98/73/19/1356987319.db2.gz DOKKWXLSRFLDSZ-IBGZPJMESA-N 1 3 346.519 2.511 10 0 EFAEHO CN(CCCN(C)C(=O)CC1CC[NH+](C)CC1)Cc1ccsc1 ZINC001393630888 1357024246 /nfs/dbraw/zinc/02/42/46/1357024246.db2.gz DCLAXCPRXDMLAW-UHFFFAOYSA-N 1 3 337.533 2.760 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1C[C@@]2(C)CN(C(=O)Cc3c[nH]cn3)C[C@@]2(C)C1 ZINC001394355841 1357730851 /nfs/dbraw/zinc/73/08/51/1357730851.db2.gz ILIVRQNXQBGSHC-FFZOFVMBSA-N 1 3 346.519 2.805 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1C[C@@]2(C)CN(C(=O)Cc3c[nH]cn3)C[C@@]2(C)C1 ZINC001394355841 1357730855 /nfs/dbraw/zinc/73/08/55/1357730855.db2.gz ILIVRQNXQBGSHC-FFZOFVMBSA-N 1 3 346.519 2.805 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001394387411 1357759599 /nfs/dbraw/zinc/75/95/99/1357759599.db2.gz FHXGEVIUZZXZMP-BJLQDIEVSA-N 1 3 345.531 2.936 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2sccc2Cl)C1)N(C)C ZINC001394388740 1357761016 /nfs/dbraw/zinc/76/10/16/1357761016.db2.gz HGWHKADKASITCE-OBJOEFQTSA-N 1 3 343.924 2.726 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2cccc(OC)c2)C1)N(C)C ZINC001394397794 1357772492 /nfs/dbraw/zinc/77/24/92/1357772492.db2.gz ZANBJKLMLKJYOS-FXRXJOCMSA-N 1 3 347.503 2.581 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C[NH2+]Cc1ccccc1C)C1CC1)N(C)C ZINC001394454262 1357836208 /nfs/dbraw/zinc/83/62/08/1357836208.db2.gz WTOLNRGHLLGIBE-MOPGFXCFSA-N 1 3 331.504 2.662 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001394455387 1357837217 /nfs/dbraw/zinc/83/72/17/1357837217.db2.gz ZLUVDAHXFMECIN-MOPGFXCFSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001394455396 1357837299 /nfs/dbraw/zinc/83/72/99/1357837299.db2.gz ZLUVDAHXFMECIN-RBUKOAKNSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)CC[NH2+][C@H](C)CN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001394530527 1357915354 /nfs/dbraw/zinc/91/53/54/1357915354.db2.gz SECDXFOLJMLXGB-CRAIPNDOSA-N 1 3 329.504 2.682 10 0 EFAEHO CCCN(C)CC(=O)N(C)C[C@H](C)[NH2+]C[C@H]1CCc2ccccc2C1 ZINC001394538697 1357924837 /nfs/dbraw/zinc/92/48/37/1357924837.db2.gz IJMCYHMGXUBHOW-ROUUACIJSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001394568520 1357961209 /nfs/dbraw/zinc/96/12/09/1357961209.db2.gz SPMDHFKNJIRHHY-CYBMUJFWSA-N 1 3 343.874 2.756 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1cccc(F)c1)C1CC1 ZINC001436796069 1387302495 /nfs/dbraw/zinc/30/24/95/1387302495.db2.gz RNKTUYLOQIVHQO-MOPGFXCFSA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]CC2CCC3(CC3)CC2)C[C@H]1C ZINC001394690359 1358014030 /nfs/dbraw/zinc/01/40/30/1358014030.db2.gz ZOKSIUNLTSONIN-AEFFLSMTSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@H](c1cccc(F)c1)N1CC[C@]2(NC(=O)CC[NH+](C)C)CCC[C@H]12 ZINC001394693718 1358017370 /nfs/dbraw/zinc/01/73/70/1358017370.db2.gz UIEFTMNUNFLYSL-MOXGXCLJSA-N 1 3 347.478 2.952 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)c(C)c1 ZINC001394726082 1358051832 /nfs/dbraw/zinc/05/18/32/1358051832.db2.gz OJGOFGJVBOKNLY-LJQANCHMSA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccccc1)C(=O)C1CC[NH+](C)CC1 ZINC001394806551 1358094552 /nfs/dbraw/zinc/09/45/52/1358094552.db2.gz HTZQMODFPSXEFR-UHFFFAOYSA-N 1 3 331.504 2.697 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C[NH2+]CC1CC(C)(C)C1)C(C)(C)C ZINC001394829946 1358129300 /nfs/dbraw/zinc/12/93/00/1358129300.db2.gz BHMYHPURVQAJSB-MRXNPFEDSA-N 1 3 325.541 2.885 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C1CC[NH+](Cc2ccccc2)CC1)N(C)C ZINC001394848577 1358154738 /nfs/dbraw/zinc/15/47/38/1358154738.db2.gz VLCHFJHBXPTQQH-LPHOPBHVSA-N 1 3 331.504 2.744 10 0 EFAEHO CC[C@@H](C)C[NH+]1CCC(C2(NC(=O)Cc3nc[nH]c3C)CC2)CC1 ZINC001394860957 1358168137 /nfs/dbraw/zinc/16/81/37/1358168137.db2.gz POTIJLPLNGJMBF-CQSZACIVSA-N 1 3 332.492 2.668 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)s2)C1)N(C)C ZINC001436953683 1387343256 /nfs/dbraw/zinc/34/32/56/1387343256.db2.gz KVFHFLPRYCNQCD-ZOWXZIJZSA-N 1 3 343.924 2.725 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[NH2+]C[C@H]2CCC(F)(F)C2)C1 ZINC001437030656 1387367281 /nfs/dbraw/zinc/36/72/81/1387367281.db2.gz JCODKQHYNMHKHN-JKSUJKDBSA-N 1 3 345.478 2.590 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001437036800 1387380707 /nfs/dbraw/zinc/38/07/07/1387380707.db2.gz SHGPONKDRJYVQZ-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@H](F)CCN1CC[C@H]1CN(C)C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001397001285 1359605802 /nfs/dbraw/zinc/60/58/02/1359605802.db2.gz UYVPNOXYBLUNID-IRXDYDNUSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001397103911 1359679197 /nfs/dbraw/zinc/67/91/97/1359679197.db2.gz WFPZCQBDBDAYIR-DBVUQKKJSA-N 1 3 343.515 2.889 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H]1C[C@H](CNC(=O)CN2[C@H](C)CC[C@@H]2C)C1 ZINC001397140961 1359701740 /nfs/dbraw/zinc/70/17/40/1359701740.db2.gz RKJTVQGUZHCWRY-DSWCUTRASA-N 1 3 343.515 2.852 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(F)cc2)C1)N(C)C ZINC001397158759 1359713523 /nfs/dbraw/zinc/71/35/23/1359713523.db2.gz OHFBOTHRMPYYPC-UHOSZYNNSA-N 1 3 349.494 2.786 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCCCC[C@@H]([NH2+]C/C=C\Cl)C1 ZINC001397229342 1359768875 /nfs/dbraw/zinc/76/88/75/1359768875.db2.gz YCURPZYZMYGAHC-GPPWAPFKSA-N 1 3 347.906 2.780 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[N@H+](C/C=C\Cl)CC(C)(C)C1)C1CCC1 ZINC001397265969 1359798614 /nfs/dbraw/zinc/79/86/14/1359798614.db2.gz AFEHSHXCDOZERB-ZHMISCPASA-N 1 3 341.927 2.830 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[N@@H+](C/C=C\Cl)CC(C)(C)C1)C1CCC1 ZINC001397265969 1359798616 /nfs/dbraw/zinc/79/86/16/1359798616.db2.gz AFEHSHXCDOZERB-ZHMISCPASA-N 1 3 341.927 2.830 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@H]1C ZINC001397277265 1359810057 /nfs/dbraw/zinc/81/00/57/1359810057.db2.gz SAKOSHNMMAAPMT-LSTHTHJFSA-N 1 3 345.531 2.914 10 0 EFAEHO CCc1ccccc1C[N@H+]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@H]1C ZINC001397277265 1359810060 /nfs/dbraw/zinc/81/00/60/1359810060.db2.gz SAKOSHNMMAAPMT-LSTHTHJFSA-N 1 3 345.531 2.914 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@H+](CCc2ccccc2)[C@@H]1C)N(CC)CC ZINC001397277315 1359810219 /nfs/dbraw/zinc/81/02/19/1359810219.db2.gz ULQGQDUESQHTLJ-HOJAQTOUSA-N 1 3 345.531 2.929 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@@H+](CCc2ccccc2)[C@@H]1C)N(CC)CC ZINC001397277315 1359810222 /nfs/dbraw/zinc/81/02/22/1359810222.db2.gz ULQGQDUESQHTLJ-HOJAQTOUSA-N 1 3 345.531 2.929 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@@H+](CCC(C)C)CC(C)(C)C1 ZINC001397811305 1360163128 /nfs/dbraw/zinc/16/31/28/1360163128.db2.gz NOQUBYCZJYJBQU-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@H+](CCC(C)C)CC(C)(C)C1 ZINC001397811305 1360163127 /nfs/dbraw/zinc/16/31/27/1360163127.db2.gz NOQUBYCZJYJBQU-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](C/C=C/Cl)CC(C)(C)C1 ZINC001397817430 1360170031 /nfs/dbraw/zinc/17/00/31/1360170031.db2.gz VISHKJUTPRCYPQ-VFADXPBXSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](C/C=C/Cl)CC(C)(C)C1 ZINC001397817430 1360170033 /nfs/dbraw/zinc/17/00/33/1360170033.db2.gz VISHKJUTPRCYPQ-VFADXPBXSA-N 1 3 329.916 2.686 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001437183375 1387446693 /nfs/dbraw/zinc/44/66/93/1387446693.db2.gz DNCXOIBUVMMSBV-QGZVFWFLSA-N 1 3 331.504 2.506 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CC[N@H+](CCC2CCCCC2)C1 ZINC001398295860 1360448657 /nfs/dbraw/zinc/44/86/57/1360448657.db2.gz ZUUUFBIACMLTPW-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CC[N@@H+](CCC2CCCCC2)C1 ZINC001398295860 1360448659 /nfs/dbraw/zinc/44/86/59/1360448659.db2.gz ZUUUFBIACMLTPW-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1cc(C)cc(CN2CC[C@@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001398303013 1360452870 /nfs/dbraw/zinc/45/28/70/1360452870.db2.gz XCAAGMNUHIBIBJ-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(CN2CC[C@@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001398303013 1360452871 /nfs/dbraw/zinc/45/28/71/1360452871.db2.gz XCAAGMNUHIBIBJ-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]([NH2+]CC1CCCC1)C1CC1)N1CCCCCC1 ZINC001398438257 1360556525 /nfs/dbraw/zinc/55/65/25/1360556525.db2.gz GJQSPZMNNOILLS-QFBILLFUSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+]CC1CCC(F)(F)CC1)C1CC1 ZINC001398445035 1360563096 /nfs/dbraw/zinc/56/30/96/1360563096.db2.gz ARGSHUZDWPBJJH-INIZCTEOSA-N 1 3 345.478 2.637 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(C2CCC2)cc1 ZINC001437203699 1387464070 /nfs/dbraw/zinc/46/40/70/1387464070.db2.gz JXHBKXVOIONJRP-IAGOWNOFSA-N 1 3 343.515 2.890 10 0 EFAEHO CCCc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001398530080 1360627956 /nfs/dbraw/zinc/62/79/56/1360627956.db2.gz FUPQGESLIZMTCD-IBGZPJMESA-N 1 3 331.504 2.670 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@@H]2CN(CCC(F)(F)F)CC[C@@H]21 ZINC001398572951 1360651966 /nfs/dbraw/zinc/65/19/66/1360651966.db2.gz AWLFPVGZNPUTHW-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NCCN(C)Cc1ccc2c(c1)CCC2 ZINC001492873981 1360655234 /nfs/dbraw/zinc/65/52/34/1360655234.db2.gz YPVHAIOIMFEZTR-IAGOWNOFSA-N 1 3 343.515 2.596 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001398611516 1360669657 /nfs/dbraw/zinc/66/96/57/1360669657.db2.gz MAIFPXOPUJMVTH-ZCNNSNEGSA-N 1 3 343.515 2.887 10 0 EFAEHO Cc1ccc(CN[C@H]2C[C@@H](NC(=O)CCC[NH+](C)C)C2)c(Cl)c1 ZINC001398625659 1360677364 /nfs/dbraw/zinc/67/73/64/1360677364.db2.gz YMYJOOMVIMHXTA-IYBDPMFKSA-N 1 3 337.895 2.727 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N[C@H]2C[C@@H](NCC=C(Cl)Cl)C2)CC1 ZINC001398656131 1360691914 /nfs/dbraw/zinc/69/19/14/1360691914.db2.gz QVMHKAWYYKFLAE-OKILXGFUSA-N 1 3 348.318 2.663 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)C(C)C)C2)c(Cl)c1 ZINC001398660332 1360694060 /nfs/dbraw/zinc/69/40/60/1360694060.db2.gz BLXWXACYDIKGED-IYBDPMFKSA-N 1 3 337.895 2.725 10 0 EFAEHO C[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC1CCCC1 ZINC001437206753 1387469511 /nfs/dbraw/zinc/46/95/11/1387469511.db2.gz MJWVUYDMFJNGCV-BEFAXECRSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H](C)[NH2+]CCc1ccccc1F ZINC001437212952 1387473279 /nfs/dbraw/zinc/47/32/79/1387473279.db2.gz HXHPKMRKZYRWFM-LPHOPBHVSA-N 1 3 349.494 2.725 10 0 EFAEHO C[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]CCc1ccccc1 ZINC001437212943 1387473468 /nfs/dbraw/zinc/47/34/68/1387473468.db2.gz HTFBVKJVDCREPO-QZTJIDSGSA-N 1 3 331.504 2.588 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCC[N@@H+]1CC1CC(C)(C)C1)N(C)C ZINC001398761352 1360769600 /nfs/dbraw/zinc/76/96/00/1360769600.db2.gz SNOGTKXWQHBNEH-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCC[N@H+]1CC1CC(C)(C)C1)N(C)C ZINC001398761352 1360769602 /nfs/dbraw/zinc/76/96/02/1360769602.db2.gz SNOGTKXWQHBNEH-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCCC[C@@H]1CNCc1cc(C)ccc1F ZINC001398774079 1360779530 /nfs/dbraw/zinc/77/95/30/1360779530.db2.gz WWTNCIPOJSSBKU-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCCC[C@@H]1CNCc1cc(C)ccc1F ZINC001398774079 1360779534 /nfs/dbraw/zinc/77/95/34/1360779534.db2.gz WWTNCIPOJSSBKU-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]CCc1ccccc1 ZINC001437213086 1387474381 /nfs/dbraw/zinc/47/43/81/1387474381.db2.gz ITOFQJOZWMSRNQ-IEBWSBKVSA-N 1 3 331.504 2.586 10 0 EFAEHO Cc1ccc(F)c(CN2CCC[C@H]([C@@H](C)NC(=O)CC[NH+](C)C)C2)c1 ZINC001398785485 1360788432 /nfs/dbraw/zinc/78/84/32/1360788432.db2.gz IGXKFKBLIJYGIJ-SJORKVTESA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@H+](Cc2ccsc2)C1 ZINC001398792107 1360795731 /nfs/dbraw/zinc/79/57/31/1360795731.db2.gz LVCRRKZSBAIAJY-NVXWUHKLSA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](Cc2ccsc2)C1 ZINC001398792107 1360795732 /nfs/dbraw/zinc/79/57/32/1360795732.db2.gz LVCRRKZSBAIAJY-NVXWUHKLSA-N 1 3 337.533 2.805 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)[NH+]1CCCC1)[C@H]1CCCN(C/C=C/Cl)C1 ZINC001398800582 1360802107 /nfs/dbraw/zinc/80/21/07/1360802107.db2.gz XSFLWBSXVBPQNW-GFXFGIRVSA-N 1 3 341.927 2.830 10 0 EFAEHO Cc1cccnc1CN[C@H](C)CNC(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001398968377 1360901487 /nfs/dbraw/zinc/90/14/87/1360901487.db2.gz QXGHKHOIMDSYKQ-MRXNPFEDSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1cccnc1CN[C@H](C)CNC(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001398968377 1360901492 /nfs/dbraw/zinc/90/14/92/1360901492.db2.gz QXGHKHOIMDSYKQ-MRXNPFEDSA-N 1 3 346.519 2.637 10 0 EFAEHO C[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]CC1CC2(CCC2)C1 ZINC001399106141 1360998016 /nfs/dbraw/zinc/99/80/16/1360998016.db2.gz PVRKIPYRXHZBSP-IAGOWNOFSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001399274231 1361115518 /nfs/dbraw/zinc/11/55/18/1361115518.db2.gz FGZZSQJTMPHMEN-GOSISDBHSA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001399274231 1361115521 /nfs/dbraw/zinc/11/55/21/1361115521.db2.gz FGZZSQJTMPHMEN-GOSISDBHSA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2CCC[C@@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001399284822 1361126427 /nfs/dbraw/zinc/12/64/27/1361126427.db2.gz WHBFDILOTMDIQP-RBUKOAKNSA-N 1 3 331.504 2.852 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H]([N@H+](C)Cc2ccccc2)C1 ZINC001399285564 1361126705 /nfs/dbraw/zinc/12/67/05/1361126705.db2.gz IFNIZKLQHICADQ-OALUTQOASA-N 1 3 349.494 2.789 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC001399285564 1361126708 /nfs/dbraw/zinc/12/67/08/1361126708.db2.gz IFNIZKLQHICADQ-OALUTQOASA-N 1 3 349.494 2.789 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NCCN(C)Cc1ccc(C2CC2)cc1 ZINC001399483090 1361265770 /nfs/dbraw/zinc/26/57/70/1361265770.db2.gz MPAIPXLVLGUZQL-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NCCN(C)Cc1ccc(C2CC2)cc1 ZINC001399483090 1361265773 /nfs/dbraw/zinc/26/57/73/1361265773.db2.gz MPAIPXLVLGUZQL-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@@H+]1C)[C@H]1CCc2ccc(F)cc21 ZINC001399499548 1361281657 /nfs/dbraw/zinc/28/16/57/1361281657.db2.gz BCYHMEAFROXBKI-MJGOQNOKSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@H+]1C)[C@H]1CCc2ccc(F)cc21 ZINC001399499548 1361281660 /nfs/dbraw/zinc/28/16/60/1361281660.db2.gz BCYHMEAFROXBKI-MJGOQNOKSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CCNC(=O)C(C)(C)[NH+]1CCCC1)[C@H]1CCc2c1cccc2F ZINC001399562582 1361333860 /nfs/dbraw/zinc/33/38/60/1361333860.db2.gz VNFCQXCFQHQJJX-SFHVURJKSA-N 1 3 347.478 2.735 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(C)CCNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001399564036 1361334387 /nfs/dbraw/zinc/33/43/87/1361334387.db2.gz YMBONGWIQMZATM-OAHLLOKOSA-N 1 3 335.467 2.809 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H](C(C)C)[NH+]2CCCC2)c(C)c1 ZINC001399656047 1361408258 /nfs/dbraw/zinc/40/82/58/1361408258.db2.gz QMEOWDXSHSKBOQ-HXUWFJFHSA-N 1 3 345.531 2.972 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](C)[C@H]1CCc2ccccc21 ZINC001399655690 1361408633 /nfs/dbraw/zinc/40/86/33/1361408633.db2.gz MZWWQUZTVCJOFN-RBUKOAKNSA-N 1 3 329.488 2.596 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001399655690 1361408634 /nfs/dbraw/zinc/40/86/34/1361408634.db2.gz MZWWQUZTVCJOFN-RBUKOAKNSA-N 1 3 329.488 2.596 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C(C)C)Cc1ccc2ncccc2c1 ZINC001399824298 1361520161 /nfs/dbraw/zinc/52/01/61/1361520161.db2.gz PFZFQMXCGVOPSU-UHFFFAOYSA-N 1 3 342.487 2.513 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C(C)C)Cc1ccc2ncccc2c1 ZINC001399824298 1361520164 /nfs/dbraw/zinc/52/01/64/1361520164.db2.gz PFZFQMXCGVOPSU-UHFFFAOYSA-N 1 3 342.487 2.513 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CCN(Cc2ccc(F)cc2)C1)[NH+](CC)CC ZINC001399925853 1361581444 /nfs/dbraw/zinc/58/14/44/1361581444.db2.gz BWMLJUAFACPGQE-MJGOQNOKSA-N 1 3 349.494 2.884 10 0 EFAEHO CCCN(CCNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)Cc1cccc(F)c1 ZINC001399976896 1361629596 /nfs/dbraw/zinc/62/95/96/1361629596.db2.gz ZBDIDZOSHHMOTF-WMZOPIPTSA-N 1 3 349.494 2.884 10 0 EFAEHO CCCN(CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)Cc1cccc(F)c1 ZINC001399976896 1361629599 /nfs/dbraw/zinc/62/95/99/1361629599.db2.gz ZBDIDZOSHHMOTF-WMZOPIPTSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@H](C)C[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001400026700 1361677864 /nfs/dbraw/zinc/67/78/64/1361677864.db2.gz CWUQTZCJGHAYQE-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@H](C)C[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001400026700 1361677865 /nfs/dbraw/zinc/67/78/65/1361677865.db2.gz CWUQTZCJGHAYQE-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[N@H+](CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001400044363 1361694571 /nfs/dbraw/zinc/69/45/71/1361694571.db2.gz VVYJTSDPHWOZRL-SFHVURJKSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[N@@H+](CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001400044363 1361694574 /nfs/dbraw/zinc/69/45/74/1361694574.db2.gz VVYJTSDPHWOZRL-SFHVURJKSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@@H]([NH2+]CCN(C)C(=O)CN1CCCC1)c1ccc(F)c(Cl)c1 ZINC001400082241 1361719803 /nfs/dbraw/zinc/71/98/03/1361719803.db2.gz HLHSQWIPLZFXSH-CYBMUJFWSA-N 1 3 341.858 2.684 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@H](CCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001400184088 1361824807 /nfs/dbraw/zinc/82/48/07/1361824807.db2.gz MILLELYOMYCBLQ-KRWDZBQOSA-N 1 3 325.541 2.839 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@H](CCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001400184088 1361824809 /nfs/dbraw/zinc/82/48/09/1361824809.db2.gz MILLELYOMYCBLQ-KRWDZBQOSA-N 1 3 325.541 2.839 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@H+](Cc2ccc(CF)cc2)C1 ZINC001400189406 1361831457 /nfs/dbraw/zinc/83/14/57/1361831457.db2.gz AQHPSKOPDCCJPP-LJQANCHMSA-N 1 3 349.494 2.825 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC001400189406 1361831461 /nfs/dbraw/zinc/83/14/61/1361831461.db2.gz AQHPSKOPDCCJPP-LJQANCHMSA-N 1 3 349.494 2.825 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@H]1CCN(Cc2ccc3c(c2)CCC3)C1 ZINC001400766801 1362151984 /nfs/dbraw/zinc/15/19/84/1362151984.db2.gz MKAUZZRSADMFJD-FQEVSTJZSA-N 1 3 343.515 2.550 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]CCc1cccs1 ZINC001400800689 1362171975 /nfs/dbraw/zinc/17/19/75/1362171975.db2.gz IKFVIAITPZMOTM-NVXWUHKLSA-N 1 3 337.533 2.648 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](CC)[NH2+]Cc1ccc(C)nc1C ZINC001400804026 1362173834 /nfs/dbraw/zinc/17/38/34/1362173834.db2.gz OQXDBZMCOWWJKD-OALUTQOASA-N 1 3 346.519 2.557 10 0 EFAEHO CC[C@H](C(=O)N[C@@](C)(C[NH2+]Cc1ccccc1C)C1CC1)N(C)C ZINC001401030100 1362379690 /nfs/dbraw/zinc/37/96/90/1362379690.db2.gz CUUOKPSCAVYHAE-QUCCMNQESA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@]1(C[NH2+]Cc2ccccn2)CCCC[C@H]1C ZINC001401040469 1362389837 /nfs/dbraw/zinc/38/98/37/1362389837.db2.gz DFSHEMACIUALRX-YLJYHZDGSA-N 1 3 346.519 2.577 10 0 EFAEHO CC[NH2+]Cc1ccc(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC001401071626 1362412066 /nfs/dbraw/zinc/41/20/66/1362412066.db2.gz ZSJYOVCUSCENOP-IBGZPJMESA-N 1 3 335.467 2.625 10 0 EFAEHO CC(C)(C(=O)NCCC1CCN(C/C=C/Cl)CC1)[NH+]1CCCC1 ZINC001401075739 1362416975 /nfs/dbraw/zinc/41/69/75/1362416975.db2.gz FXGYBJXYAZOSIK-WEVVVXLNSA-N 1 3 341.927 2.832 10 0 EFAEHO CC[C@H](F)CN1CCC(CCNC(=O)CC[C@@H]2CCC[N@@H+]2C)CC1 ZINC001401075461 1362417652 /nfs/dbraw/zinc/41/76/52/1362417652.db2.gz OAPNAFJFCRHKLP-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](F)CN1CCC(CCNC(=O)CC[C@@H]2CCC[N@H+]2C)CC1 ZINC001401075461 1362417658 /nfs/dbraw/zinc/41/76/58/1362417658.db2.gz OAPNAFJFCRHKLP-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC001401152708 1362489553 /nfs/dbraw/zinc/48/95/53/1362489553.db2.gz JPRJMRIDWKWHIS-UONOGXRCSA-N 1 3 341.446 2.708 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+]Cc1ccc(Cl)s1 ZINC001401154280 1362490666 /nfs/dbraw/zinc/49/06/66/1362490666.db2.gz NBPBMHZDEZVFMU-LBPRGKRZSA-N 1 3 331.913 2.584 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1(NCc2cc(C)ccc2F)CCCC1 ZINC001401190551 1362529375 /nfs/dbraw/zinc/52/93/75/1362529375.db2.gz QPGXYEPPYOUBJY-UHFFFAOYSA-N 1 3 349.494 2.995 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1(NCc2cc(C)ccc2F)CCCC1 ZINC001401190551 1362529381 /nfs/dbraw/zinc/52/93/81/1362529381.db2.gz QPGXYEPPYOUBJY-UHFFFAOYSA-N 1 3 349.494 2.995 10 0 EFAEHO CC(C)CCC[NH+]1CC2(C1)CCN(C(=O)CN1CC[C@H](C)C1)CC2 ZINC001401192329 1362532430 /nfs/dbraw/zinc/53/24/30/1362532430.db2.gz DOLZUQOLUQQFOX-SFHVURJKSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@H](C[NH2+]CC1CCCC1)N(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001401247596 1362587173 /nfs/dbraw/zinc/58/71/73/1362587173.db2.gz QAAGJYCYIXOGJE-DNVCBOLYSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@@H]([NH2+]C[C@@H](C)N(C)C(=O)CN1CCCC1)c1ccc(F)cc1 ZINC001401257277 1362597005 /nfs/dbraw/zinc/59/70/05/1362597005.db2.gz KLUIEBJHEJYZCI-CRAIPNDOSA-N 1 3 335.467 2.809 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+]C[C@H](C)N(C)C(=O)CN1CCCC1 ZINC001401263442 1362604417 /nfs/dbraw/zinc/60/44/17/1362604417.db2.gz VIGYHZIFBFUPOB-INIZCTEOSA-N 1 3 346.519 2.546 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)[C@@H](C)CNCc1ccc(C)cc1Cl ZINC001401263637 1362605067 /nfs/dbraw/zinc/60/50/67/1362605067.db2.gz UYQCCLMQTXNFKZ-HNNXBMFYSA-N 1 3 339.911 2.927 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)[C@@H](C)CNCc1ccc(C)cc1Cl ZINC001401263637 1362605072 /nfs/dbraw/zinc/60/50/72/1362605072.db2.gz UYQCCLMQTXNFKZ-HNNXBMFYSA-N 1 3 339.911 2.927 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(CF)cc1 ZINC001401265611 1362606436 /nfs/dbraw/zinc/60/64/36/1362606436.db2.gz HRMRPBGBWKOXCU-QFBILLFUSA-N 1 3 349.494 2.967 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H](C)CNCc1ccccc1F)[NH+]1CCCC1 ZINC001401267317 1362608108 /nfs/dbraw/zinc/60/81/08/1362608108.db2.gz RXEJJZNBPSUKHT-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(C2CC2)cc1 ZINC001401268260 1362609762 /nfs/dbraw/zinc/60/97/62/1362609762.db2.gz XEGFIXHZNJSBEK-MRXNPFEDSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)C[C@H](C[NH2+]CC1CC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001401275368 1362619441 /nfs/dbraw/zinc/61/94/41/1362619441.db2.gz VZJLLIDRYFYBBX-APWZRJJASA-N 1 3 341.515 2.729 10 0 EFAEHO CC[C@H](F)CNC[C@H](CC(C)C)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001401283340 1362629585 /nfs/dbraw/zinc/62/95/85/1362629585.db2.gz LAZMJLHXMJUHES-IRXDYDNUSA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)C[C@@H](CNCc1ccccc1F)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001401283717 1362629632 /nfs/dbraw/zinc/62/96/32/1362629632.db2.gz QYRQDRIVLMDRPJ-BPQIPLTHSA-N 1 3 349.494 2.786 10 0 EFAEHO CC(C)C[C@@H](CNCc1ccccc1F)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001401283717 1362629636 /nfs/dbraw/zinc/62/96/36/1362629636.db2.gz QYRQDRIVLMDRPJ-BPQIPLTHSA-N 1 3 349.494 2.786 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1ccc(F)cc1)C(C)C ZINC001401335778 1362681660 /nfs/dbraw/zinc/68/16/60/1362681660.db2.gz QUSWOEOKIKYJHQ-OALUTQOASA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC1CC1 ZINC001401339634 1362685824 /nfs/dbraw/zinc/68/58/24/1362685824.db2.gz BYJWPNOWYZLRAW-LPHOPBHVSA-N 1 3 341.515 2.729 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)cc1 ZINC001401344223 1362691569 /nfs/dbraw/zinc/69/15/69/1362691569.db2.gz OYHZRJWLUHOCAX-IEBWSBKVSA-N 1 3 331.504 2.567 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](CNC(=O)C[C@@H]2CC[N@H+](C)C2)C(C)C)c1 ZINC001401380182 1362732747 /nfs/dbraw/zinc/73/27/47/1362732747.db2.gz LLXNNRFPUDVUHJ-LPHOPBHVSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](CNC(=O)C[C@@H]2CC[N@@H+](C)C2)C(C)C)c1 ZINC001401380182 1362732754 /nfs/dbraw/zinc/73/27/54/1362732754.db2.gz LLXNNRFPUDVUHJ-LPHOPBHVSA-N 1 3 349.494 2.706 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2ccc(F)cc21)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001401425924 1362788252 /nfs/dbraw/zinc/78/82/52/1362788252.db2.gz BUNPLNIAVOTAJQ-HNAYVOBHSA-N 1 3 347.478 2.545 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2ccc(F)cc21)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001401425924 1362788255 /nfs/dbraw/zinc/78/82/55/1362788255.db2.gz BUNPLNIAVOTAJQ-HNAYVOBHSA-N 1 3 347.478 2.545 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2ccc(F)cc21)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001401425927 1362788783 /nfs/dbraw/zinc/78/87/83/1362788783.db2.gz BUNPLNIAVOTAJQ-KXBFYZLASA-N 1 3 347.478 2.545 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2ccc(F)cc21)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001401425927 1362788788 /nfs/dbraw/zinc/78/87/88/1362788788.db2.gz BUNPLNIAVOTAJQ-KXBFYZLASA-N 1 3 347.478 2.545 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001401432066 1362797551 /nfs/dbraw/zinc/79/75/51/1362797551.db2.gz RCFHIPBBZJCOEJ-CABCVRRESA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001401432066 1362797554 /nfs/dbraw/zinc/79/75/54/1362797554.db2.gz RCFHIPBBZJCOEJ-CABCVRRESA-N 1 3 333.467 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC001401433205 1362799413 /nfs/dbraw/zinc/79/94/13/1362799413.db2.gz CMJVHPTYULMGNN-IBGZPJMESA-N 1 3 349.494 2.934 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC001401433205 1362799416 /nfs/dbraw/zinc/79/94/16/1362799416.db2.gz CMJVHPTYULMGNN-IBGZPJMESA-N 1 3 349.494 2.934 10 0 EFAEHO CCCc1ccc(CN(C)CCN(C)C(=O)C[C@H]2CC[N@H+](C)C2)cc1 ZINC001401436647 1362804500 /nfs/dbraw/zinc/80/45/00/1362804500.db2.gz WWVGWDKNOSYCLR-HXUWFJFHSA-N 1 3 345.531 2.871 10 0 EFAEHO CCCc1ccc(CN(C)CCN(C)C(=O)C[C@H]2CC[N@@H+](C)C2)cc1 ZINC001401436647 1362804503 /nfs/dbraw/zinc/80/45/03/1362804503.db2.gz WWVGWDKNOSYCLR-HXUWFJFHSA-N 1 3 345.531 2.871 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCCN2CC)c1 ZINC001401676876 1363020430 /nfs/dbraw/zinc/02/04/30/1363020430.db2.gz YJYLIRXGZQXRDD-VQIMIIECSA-N 1 3 331.504 2.718 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C[NH2+][C@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001401703014 1363037510 /nfs/dbraw/zinc/03/75/10/1363037510.db2.gz QPNNJRMGDSNQND-ZLIFDBKOSA-N 1 3 337.895 2.762 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1cc2ccccc2o1 ZINC001401722696 1363054717 /nfs/dbraw/zinc/05/47/17/1363054717.db2.gz IEULJHLSOXKCCL-MAUKXSAKSA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(F)c1 ZINC001401752734 1363086041 /nfs/dbraw/zinc/08/60/41/1363086041.db2.gz HZWDICWIUPJRQR-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(F)c1 ZINC001401752734 1363086043 /nfs/dbraw/zinc/08/60/43/1363086043.db2.gz HZWDICWIUPJRQR-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@H](C)NC(=O)[C@H]1CCC[N@@H+]1C(C)C ZINC001401754402 1363088085 /nfs/dbraw/zinc/08/80/85/1363088085.db2.gz JZCFKBRWUUWLKQ-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@H](C)NC(=O)[C@H]1CCC[N@H+]1C(C)C ZINC001401754402 1363088089 /nfs/dbraw/zinc/08/80/89/1363088089.db2.gz JZCFKBRWUUWLKQ-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NC[C@H]1CCN1[C@@H]1CCc2ccccc21 ZINC001401927286 1363250686 /nfs/dbraw/zinc/25/06/86/1363250686.db2.gz QOOKVCANKDDOAR-UYAOXDASSA-N 1 3 341.499 2.740 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@H]2CCN2CCC2CCCCCC2)C1 ZINC001401933669 1363256771 /nfs/dbraw/zinc/25/67/71/1363256771.db2.gz XJFPSTIXEDMUPJ-RBUKOAKNSA-N 1 3 335.536 2.879 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@H]2CCN2CCC2CCCCCC2)C1 ZINC001401933669 1363256775 /nfs/dbraw/zinc/25/67/75/1363256775.db2.gz XJFPSTIXEDMUPJ-RBUKOAKNSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+][C@H](C)c2cccc(F)c2)CC1 ZINC001401945225 1363265813 /nfs/dbraw/zinc/26/58/13/1363265813.db2.gz SAUSKGVCQRIPCT-QAPCUYQASA-N 1 3 347.478 2.998 10 0 EFAEHO CC[C@H](F)C[N@H+](CC1CC1)C1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001402004252 1363323400 /nfs/dbraw/zinc/32/34/00/1363323400.db2.gz MZVWRNMWCWPYIS-KRWDZBQOSA-N 1 3 341.515 2.778 10 0 EFAEHO CC[C@H](F)C[N@@H+](CC1CC1)C1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001402004252 1363323405 /nfs/dbraw/zinc/32/34/05/1363323405.db2.gz MZVWRNMWCWPYIS-KRWDZBQOSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(C1)CC[NH+](CCC(F)(F)F)CC2 ZINC001402010166 1363328681 /nfs/dbraw/zinc/32/86/81/1363328681.db2.gz XZWGCNWQUOLVSC-UHFFFAOYSA-N 1 3 349.441 2.594 10 0 EFAEHO C[NH+](C)CCCC(=O)NCC1(N[C@@H]2CCCc3ccc(F)cc32)CC1 ZINC001402045965 1363355973 /nfs/dbraw/zinc/35/59/73/1363355973.db2.gz XXFZAKCTDAFBQX-GOSISDBHSA-N 1 3 347.478 2.783 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2cccc(F)c2)C[C@@H]1C ZINC001402063391 1363370518 /nfs/dbraw/zinc/37/05/18/1363370518.db2.gz OZLGHIARVSYXTB-MAUKXSAKSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2cccc(F)c2)C[C@H]1C ZINC001402063398 1363370709 /nfs/dbraw/zinc/37/07/09/1363370709.db2.gz OZLGHIARVSYXTB-QAPCUYQASA-N 1 3 335.467 2.635 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@H]1CNCc1cccc(C(C)C)n1 ZINC001402070330 1363375509 /nfs/dbraw/zinc/37/55/09/1363375509.db2.gz HDPHHUWQNXGKCI-SFHVURJKSA-N 1 3 346.519 2.627 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@H]1CNCc1cccc(C(C)C)n1 ZINC001402070330 1363375512 /nfs/dbraw/zinc/37/55/12/1363375512.db2.gz HDPHHUWQNXGKCI-SFHVURJKSA-N 1 3 346.519 2.627 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@@H]2CCCN([C@@H]3CCc4ccccc43)C2)CC1 ZINC001402086262 1363390822 /nfs/dbraw/zinc/39/08/22/1363390822.db2.gz LETCRCCPEHPOFZ-IEBWSBKVSA-N 1 3 341.499 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C)CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001402089666 1363395034 /nfs/dbraw/zinc/39/50/34/1363395034.db2.gz ZEYOHFXPDCFSJV-KURKYZTESA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N[C@@]2(C)CC[N@H+](CCC3CC3)C2)C1 ZINC001402133887 1363440243 /nfs/dbraw/zinc/44/02/43/1363440243.db2.gz NHSCFKSTNFMAKQ-RBUKOAKNSA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N[C@@]2(C)CC[N@@H+](CCC3CC3)C2)C1 ZINC001402133887 1363440247 /nfs/dbraw/zinc/44/02/47/1363440247.db2.gz NHSCFKSTNFMAKQ-RBUKOAKNSA-N 1 3 339.499 2.580 10 0 EFAEHO C[NH+](C)CC1(C(=O)NC[C@]2(C)CCCN(Cc3ccsc3)C2)CC1 ZINC001402208283 1363521670 /nfs/dbraw/zinc/52/16/70/1363521670.db2.gz JAAIUWILWJPVRO-SFHVURJKSA-N 1 3 349.544 2.808 10 0 EFAEHO CCc1ccccc1[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)[NH2+]C(C)C ZINC001402387797 1363645984 /nfs/dbraw/zinc/64/59/84/1363645984.db2.gz GSCKEPRRSCVQGI-RTBURBONSA-N 1 3 333.520 2.991 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2ccc(CC)cc2)C1 ZINC001402411824 1363671360 /nfs/dbraw/zinc/67/13/60/1363671360.db2.gz OGOPIUUHUMJEOZ-PXNSSMCTSA-N 1 3 345.531 2.775 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CC[C@@H]3CCC[C@@H](C)C3)C[C@@H]2C1 ZINC001402428378 1363686887 /nfs/dbraw/zinc/68/68/87/1363686887.db2.gz DMADSHJZRXTPAK-WCIQWLHISA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CC[C@@H]3CCC[C@@H](C)C3)C[C@@H]2C1 ZINC001402428378 1363686889 /nfs/dbraw/zinc/68/68/89/1363686889.db2.gz DMADSHJZRXTPAK-WCIQWLHISA-N 1 3 349.563 2.933 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@H](NC(=O)CN(C)C3CCC3)C2)c(Cl)c1 ZINC001402496770 1363739546 /nfs/dbraw/zinc/73/95/46/1363739546.db2.gz UJCNZKDRBGVONZ-WKILWMFISA-N 1 3 349.906 2.870 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[C@H](C[NH2+]Cc2ccsc2)CC1)N(C)C ZINC001402502644 1363745151 /nfs/dbraw/zinc/74/51/51/1363745151.db2.gz DFTQTXDZZRIPKL-XIRDDKMYSA-N 1 3 337.533 2.853 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@H](C)c2ccc(Cl)cc2)C1 ZINC001402550220 1363780287 /nfs/dbraw/zinc/78/02/87/1363780287.db2.gz LSJHRBKJXOPLDK-KBRIMQKVSA-N 1 3 337.895 2.978 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001402591425 1363817877 /nfs/dbraw/zinc/81/78/77/1363817877.db2.gz FDJWOOGXEBNZEL-NXHRZFHOSA-N 1 3 329.488 2.777 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H](NC(=O)CCC[NH+](C)C)C1)c1ccccc1Cl ZINC001402601966 1363826571 /nfs/dbraw/zinc/82/65/71/1363826571.db2.gz BQLLVTUOTQKMAS-SOUVJXGZSA-N 1 3 337.895 2.980 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc(C(F)F)c2)C1 ZINC001402627571 1363854275 /nfs/dbraw/zinc/85/42/75/1363854275.db2.gz ISLNLKNOVCDUGC-IYBDPMFKSA-N 1 3 339.430 2.703 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c(C)c1 ZINC001402627436 1363854850 /nfs/dbraw/zinc/85/48/50/1363854850.db2.gz IAKPRAJCBCPAIG-OTWHNJEPSA-N 1 3 331.504 2.626 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001402669002 1363917526 /nfs/dbraw/zinc/91/75/26/1363917526.db2.gz UJQZIRROLQOKEC-SJLPKXTDSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001402669002 1363917529 /nfs/dbraw/zinc/91/75/29/1363917529.db2.gz UJQZIRROLQOKEC-SJLPKXTDSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](CCCC(C)C)C1 ZINC001402772838 1364020600 /nfs/dbraw/zinc/02/06/00/1364020600.db2.gz FGFYCHZPYJPCPY-NVXWUHKLSA-N 1 3 334.508 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H]1CCC[N@H+](CCCC(C)C)C1 ZINC001402772838 1364020605 /nfs/dbraw/zinc/02/06/05/1364020605.db2.gz FGFYCHZPYJPCPY-NVXWUHKLSA-N 1 3 334.508 2.914 10 0 EFAEHO CCC[N@H+](C)C[C@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001402911166 1364127351 /nfs/dbraw/zinc/12/73/51/1364127351.db2.gz ANQWDKVXTLINFE-CRAIPNDOSA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@@H+](C)C[C@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001402911166 1364127353 /nfs/dbraw/zinc/12/73/53/1364127353.db2.gz ANQWDKVXTLINFE-CRAIPNDOSA-N 1 3 327.488 2.532 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)CC[NH+](C)C)CCN1C/C=C\c1ccccc1 ZINC001402916722 1364132170 /nfs/dbraw/zinc/13/21/70/1364132170.db2.gz HTCQLOILWAPFIM-YXGRLTDGSA-N 1 3 329.488 2.621 10 0 EFAEHO Cc1ccncc1C[NH2+][C@H](C)[C@@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001402971064 1364170873 /nfs/dbraw/zinc/17/08/73/1364170873.db2.gz HDYLOUHBMWCXTI-IAGOWNOFSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H](C)[NH2+]CCc1ccc(Cl)cc1 ZINC001403003554 1364201662 /nfs/dbraw/zinc/20/16/62/1364201662.db2.gz IZPVGHLFOHSCRO-OLZOCXBDSA-N 1 3 348.878 2.640 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)CC(C)(C)C ZINC001403015055 1364215347 /nfs/dbraw/zinc/21/53/47/1364215347.db2.gz OOLLFOGFDBRQTD-DLBZAZTESA-N 1 3 333.520 2.956 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)CNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001403083924 1364288169 /nfs/dbraw/zinc/28/81/69/1364288169.db2.gz NXBZPXAPMZVGTN-LSDHHAIUSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)CNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001403083924 1364288172 /nfs/dbraw/zinc/28/81/72/1364288172.db2.gz NXBZPXAPMZVGTN-LSDHHAIUSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC(C)(C)C[NH2+]C[C@@H]1CCC(F)(F)C1)N(C)C ZINC001403086328 1364291822 /nfs/dbraw/zinc/29/18/22/1364291822.db2.gz ZSSPKMRBCGALHZ-CABCVRRESA-N 1 3 347.494 2.836 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)N(C)Cc1ccc(C2CC2)cc1 ZINC001403127282 1364340652 /nfs/dbraw/zinc/34/06/52/1364340652.db2.gz PPUYBWQUYAQWMW-JXXFODFXSA-N 1 3 343.515 2.841 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)N(C)Cc1ccc(C2CC2)cc1 ZINC001403127282 1364340659 /nfs/dbraw/zinc/34/06/59/1364340659.db2.gz PPUYBWQUYAQWMW-JXXFODFXSA-N 1 3 343.515 2.841 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)CCC[NH+]2CCCCC2)c1 ZINC001403137969 1364355026 /nfs/dbraw/zinc/35/50/26/1364355026.db2.gz LTVABADCUMBLRA-KRWDZBQOSA-N 1 3 349.494 2.995 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[N@H+](C)CCc1ccc(C)cc1 ZINC001403151135 1364370029 /nfs/dbraw/zinc/37/00/29/1364370029.db2.gz YSLZDKRYUXJRTR-UYAOXDASSA-N 1 3 345.531 2.848 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[N@@H+](C)CCc1ccc(C)cc1 ZINC001403151135 1364370032 /nfs/dbraw/zinc/37/00/32/1364370032.db2.gz YSLZDKRYUXJRTR-UYAOXDASSA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[N@H+](C)CC1CCCC1 ZINC001403164523 1364384579 /nfs/dbraw/zinc/38/45/79/1364384579.db2.gz BTHJYIVUOZMNQH-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[N@@H+](C)CC1CCCC1 ZINC001403164523 1364384586 /nfs/dbraw/zinc/38/45/86/1364384586.db2.gz BTHJYIVUOZMNQH-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H]1CCN(C(=O)[C@H](F)CN(CC)CC)C1 ZINC001403168649 1364388729 /nfs/dbraw/zinc/38/87/29/1364388729.db2.gz UZYZJDKCINYBAC-RBUKOAKNSA-N 1 3 349.494 2.619 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+][C@H](C)c2ccc3c(c2)CCC3)C1 ZINC001403215318 1364439859 /nfs/dbraw/zinc/43/98/59/1364439859.db2.gz KWRLQUJZVKMSQD-UZLBHIALSA-N 1 3 343.515 2.767 10 0 EFAEHO O=C(CCC[NH+]1CCCCC1)N1CC[C@H](NCc2ccsc2)C1 ZINC001403220425 1364443017 /nfs/dbraw/zinc/44/30/17/1364443017.db2.gz UTCXVMHAZLMYRC-KRWDZBQOSA-N 1 3 335.517 2.705 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CCCCC[C@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001403325106 1364543517 /nfs/dbraw/zinc/54/35/17/1364543517.db2.gz VVBMMFHLEBTSGR-IRXDYDNUSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H](F)CC[N@H+]1CCCCC[C@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001403325106 1364543520 /nfs/dbraw/zinc/54/35/20/1364543520.db2.gz VVBMMFHLEBTSGR-IRXDYDNUSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1C[NH+](CC2CCC(C)(C)CC2)C1 ZINC001403341686 1364556195 /nfs/dbraw/zinc/55/61/95/1364556195.db2.gz DEOOXEAKSCLATQ-MRXNPFEDSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1C[NH+](CC2CCC(F)(F)CC2)C1 ZINC001403355798 1364566597 /nfs/dbraw/zinc/56/65/97/1364566597.db2.gz SHHPVNBMZGWKKT-CQSZACIVSA-N 1 3 345.478 2.589 10 0 EFAEHO COc1cccc([C@@H](C)N2C[C@H](NC(=O)CC[NH+](C)C)C(C)(C)C2)c1 ZINC001403373926 1364584365 /nfs/dbraw/zinc/58/43/65/1364584365.db2.gz DFEQYYQSGHOKSQ-QAPCUYQASA-N 1 3 347.503 2.535 10 0 EFAEHO C[C@@H](CCNC(=O)C(C)(C)N1CCCCC1)[NH2+]Cc1ccsc1 ZINC001403377904 1364587331 /nfs/dbraw/zinc/58/73/31/1364587331.db2.gz SUUBNUDMYZEVDV-HNNXBMFYSA-N 1 3 337.533 2.997 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCCC(C)(C)C)C[C@H]21)N(C)C ZINC001403389651 1364596612 /nfs/dbraw/zinc/59/66/12/1364596612.db2.gz QNKGCUFLTUKPAI-FJIDUMEYSA-N 1 3 337.552 2.693 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCCC(C)(C)C)C[C@H]21)N(C)C ZINC001403389651 1364596618 /nfs/dbraw/zinc/59/66/18/1364596618.db2.gz QNKGCUFLTUKPAI-FJIDUMEYSA-N 1 3 337.552 2.693 10 0 EFAEHO C[C@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+]CC[C@H]1CCCC1(F)F ZINC001403404151 1364608235 /nfs/dbraw/zinc/60/82/35/1364608235.db2.gz MVEACKXASPLVKB-HUUCEWRRSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2cccc(F)c2)C1)N(C)C ZINC001403442092 1364644748 /nfs/dbraw/zinc/64/47/48/1364644748.db2.gz QOPMZOYXHKFYDU-STEAMIEHSA-N 1 3 349.494 2.957 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001403456835 1364658902 /nfs/dbraw/zinc/65/89/02/1364658902.db2.gz JMLBLMQCSOKXDC-ATZDWAIDSA-N 1 3 349.494 2.705 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@H]2CCc3c2cccc3F)C1 ZINC001403459377 1364660354 /nfs/dbraw/zinc/66/03/54/1364660354.db2.gz KZCNSEUNTSTAAG-DOXZYTNZSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(Cl)s2)C1)N(C)C ZINC001403462595 1364664985 /nfs/dbraw/zinc/66/49/85/1364664985.db2.gz UMDPVCPNKMVYNB-YRGRVCCFSA-N 1 3 343.924 2.726 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]Cc1ccc(C)nc1C ZINC001403487117 1364695029 /nfs/dbraw/zinc/69/50/29/1364695029.db2.gz MRXKZYXQVKQASN-HNAYVOBHSA-N 1 3 346.519 2.557 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)[C@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001403504122 1364710027 /nfs/dbraw/zinc/71/00/27/1364710027.db2.gz CPUIOIWNUBZLKE-VQTJNVASSA-N 1 3 343.515 2.888 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCC[N@H+](C)Cc1ccc(C2CCC2)cc1 ZINC001403510650 1364716211 /nfs/dbraw/zinc/71/62/11/1364716211.db2.gz YOEXOHJUYGPHRH-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCC[N@@H+](C)Cc1ccc(C2CCC2)cc1 ZINC001403510650 1364716214 /nfs/dbraw/zinc/71/62/14/1364716214.db2.gz YOEXOHJUYGPHRH-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO C[C@@H](CN(C)C(=O)C12CCC[NH+](CCC1)C2)NCc1ccccc1F ZINC001403559509 1364761159 /nfs/dbraw/zinc/76/11/59/1364761159.db2.gz BOSGMIQFLBVMLP-INIZCTEOSA-N 1 3 347.478 2.638 10 0 EFAEHO CN(CCNC(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12)Cc1ccc(CF)cc1 ZINC001403583830 1364785784 /nfs/dbraw/zinc/78/57/84/1364785784.db2.gz DNKOXNPUMJQJLS-RBUKOAKNSA-N 1 3 347.478 2.721 10 0 EFAEHO CN(CCNC(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12)Cc1ccc(CF)cc1 ZINC001403583830 1364785787 /nfs/dbraw/zinc/78/57/87/1364785787.db2.gz DNKOXNPUMJQJLS-RBUKOAKNSA-N 1 3 347.478 2.721 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)CN(C)C(=O)CN(C)C(C)C ZINC001403630349 1364833876 /nfs/dbraw/zinc/83/38/76/1364833876.db2.gz WRGFRLBYRKCSTF-INIZCTEOSA-N 1 3 348.535 2.790 10 0 EFAEHO CN(CCNC(=O)CC[NH+](C)C)CCc1cccc(Cl)c1Cl ZINC001403664549 1364855103 /nfs/dbraw/zinc/85/51/03/1364855103.db2.gz WTKOSPFJKNREMG-UHFFFAOYSA-N 1 3 346.302 2.536 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[N@H+](C)[C@H]1CCc2ccccc21 ZINC001403698022 1364871701 /nfs/dbraw/zinc/87/17/01/1364871701.db2.gz BKCGTSSVLSTYIK-VQTJNVASSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001403698022 1364871704 /nfs/dbraw/zinc/87/17/04/1364871704.db2.gz BKCGTSSVLSTYIK-VQTJNVASSA-N 1 3 343.515 2.985 10 0 EFAEHO CN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)[C@@H]1CCc2c1cccc2Cl ZINC001403728794 1364887851 /nfs/dbraw/zinc/88/78/51/1364887851.db2.gz DCJLEFBWPRYWRZ-RDTXWAMCSA-N 1 3 349.906 2.717 10 0 EFAEHO CN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)[C@@H]1CCc2c1cccc2Cl ZINC001403728794 1364887854 /nfs/dbraw/zinc/88/78/54/1364887854.db2.gz DCJLEFBWPRYWRZ-RDTXWAMCSA-N 1 3 349.906 2.717 10 0 EFAEHO CC(C)Oc1ccccc1CN[C@@H]1CCN(C(=O)CC[NH+](C)C)[C@H]1C ZINC001403741168 1364894876 /nfs/dbraw/zinc/89/48/76/1364894876.db2.gz HCJAFOCFFSDENL-FUHWJXTLSA-N 1 3 347.503 2.505 10 0 EFAEHO CCc1ccc(C[NH2+][C@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)cc1 ZINC001403772649 1364920452 /nfs/dbraw/zinc/92/04/52/1364920452.db2.gz LMUXOAKRMFNIQK-APWZRJJASA-N 1 3 331.504 2.668 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@]12CCC[C@@H]1N(Cc1cccc(F)c1)CC2 ZINC001403778132 1364928359 /nfs/dbraw/zinc/92/83/59/1364928359.db2.gz RBPHNJKRSQWFRB-ICSRJNTNSA-N 1 3 347.478 2.781 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@]12CCC[C@@H]1N(Cc1cccc(F)c1)CC2 ZINC001403778132 1364928363 /nfs/dbraw/zinc/92/83/63/1364928363.db2.gz RBPHNJKRSQWFRB-ICSRJNTNSA-N 1 3 347.478 2.781 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@]12CCC[C@H]1N(Cc1ccc(F)cc1)CC2 ZINC001403823212 1364977010 /nfs/dbraw/zinc/97/70/10/1364977010.db2.gz PPZPADRMTVERAD-QUCCMNQESA-N 1 3 347.478 2.781 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+][C@@H]1CN(C(=O)CN(C)C(C)C)CC1(C)C ZINC001403844837 1364992138 /nfs/dbraw/zinc/99/21/38/1364992138.db2.gz XSLAJTHLNFHJHM-DLBZAZTESA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+][C@@H]1CN(C(=O)CN(C)C(C)C)CC1(C)C ZINC001403844838 1364992396 /nfs/dbraw/zinc/99/23/96/1364992396.db2.gz XSLAJTHLNFHJHM-IAGOWNOFSA-N 1 3 325.541 2.835 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@@H]1CC[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001403830604 1364983331 /nfs/dbraw/zinc/98/33/31/1364983331.db2.gz ZXAGZTZKSVFNPL-YLJYHZDGSA-N 1 3 345.531 2.964 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1CC[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001403830601 1364983357 /nfs/dbraw/zinc/98/33/57/1364983357.db2.gz ZXAGZTZKSVFNPL-PXNSSMCTSA-N 1 3 345.531 2.964 10 0 EFAEHO CC[C@H](C)C[N@H+](CC)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001403910728 1365032952 /nfs/dbraw/zinc/03/29/52/1365032952.db2.gz GPVRNQJMKFIPGB-YJBOKZPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@H](C)C[N@@H+](CC)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001403910728 1365032955 /nfs/dbraw/zinc/03/29/55/1365032955.db2.gz GPVRNQJMKFIPGB-YJBOKZPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CCC[C@@H]2CCC[N@@H+]21)Cc1cccc(C)c1 ZINC001403934241 1365065343 /nfs/dbraw/zinc/06/53/43/1365065343.db2.gz YFMBLULCNJLVBM-WOJBJXKFSA-N 1 3 343.515 2.950 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CCC[C@@H]2CCC[N@H+]21)Cc1cccc(C)c1 ZINC001403934241 1365065347 /nfs/dbraw/zinc/06/53/47/1365065347.db2.gz YFMBLULCNJLVBM-WOJBJXKFSA-N 1 3 343.515 2.950 10 0 EFAEHO CC(C)N(CC[N@H+](C)C(C)C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001403934914 1365066053 /nfs/dbraw/zinc/06/60/53/1365066053.db2.gz QKBRBZAHYGGBCZ-GOSISDBHSA-N 1 3 329.504 2.776 10 0 EFAEHO CC(C)N(CC[N@@H+](C)C(C)C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001403934914 1365066058 /nfs/dbraw/zinc/06/60/58/1365066058.db2.gz QKBRBZAHYGGBCZ-GOSISDBHSA-N 1 3 329.504 2.776 10 0 EFAEHO CCN(CCNC(=O)[C@@H](C(C)C)[NH+]1CCCC1)Cc1ccccc1 ZINC001403953153 1365096913 /nfs/dbraw/zinc/09/69/13/1365096913.db2.gz SZMXWFDIANBSFD-LJQANCHMSA-N 1 3 331.504 2.745 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@@H](C)C1)C1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001403983321 1365132206 /nfs/dbraw/zinc/13/22/06/1365132206.db2.gz GSRPMZPNGYKKBX-IAGOWNOFSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C1CC[NH+](CC2CC(C)C2)CC1)N(C)C ZINC001403993259 1365143479 /nfs/dbraw/zinc/14/34/79/1365143479.db2.gz DHNYUJZEPBRVQD-FLAMNCDFSA-N 1 3 337.552 2.835 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2c(C)cccc2C)C1)N(C)C ZINC001404020139 1365174896 /nfs/dbraw/zinc/17/48/96/1365174896.db2.gz NJYFQHYJZXDYRC-FAFZWHIHSA-N 1 3 331.504 2.723 10 0 EFAEHO CC(C)CC[NH2+]C1CC(N(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001404031944 1365191561 /nfs/dbraw/zinc/19/15/61/1365191561.db2.gz XIIZNMSSJIWEDC-RJYAGPCLSA-N 1 3 341.515 2.824 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001404087794 1365247451 /nfs/dbraw/zinc/24/74/51/1365247451.db2.gz OSTDBBNGRSVYCI-OALUTQOASA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CC[N@@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001404087794 1365247453 /nfs/dbraw/zinc/24/74/53/1365247453.db2.gz OSTDBBNGRSVYCI-OALUTQOASA-N 1 3 349.563 2.981 10 0 EFAEHO CC[C@H](C(=O)NCC[N@H+](CC1CCC2(CC2)CC1)C1CC1)N(C)C ZINC001404236066 1365380287 /nfs/dbraw/zinc/38/02/87/1365380287.db2.gz QWGRTKWFBICBHA-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)NCC[N@@H+](CC1CCC2(CC2)CC1)C1CC1)N(C)C ZINC001404236066 1365380292 /nfs/dbraw/zinc/38/02/92/1365380292.db2.gz QWGRTKWFBICBHA-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)CC[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001404269393 1365416680 /nfs/dbraw/zinc/41/66/80/1365416680.db2.gz KKEZEJBZVDEJGV-IBGZPJMESA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CC[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001404269393 1365416684 /nfs/dbraw/zinc/41/66/84/1365416684.db2.gz KKEZEJBZVDEJGV-IBGZPJMESA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@H]1CC[N@H+](Cc2ccsc2)C1)N(C)C ZINC001404537057 1365635625 /nfs/dbraw/zinc/63/56/25/1365635625.db2.gz UCRDFFJJMCBVGZ-RDJZCZTQSA-N 1 3 337.533 2.663 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2ccsc2)C1)N(C)C ZINC001404537057 1365635628 /nfs/dbraw/zinc/63/56/28/1365635628.db2.gz UCRDFFJJMCBVGZ-RDJZCZTQSA-N 1 3 337.533 2.663 10 0 EFAEHO CC[C@H](C(=O)NCC1C[NH+]([C@H](C)c2cc(C)ccc2C)C1)N(C)C ZINC001404882214 1365876819 /nfs/dbraw/zinc/87/68/19/1365876819.db2.gz GWYLTDIBIJCUFN-VQIMIIECSA-N 1 3 331.504 2.753 10 0 EFAEHO Cc1cc(C)cc(CN2CC(CNC(=O)C[N@H+]3[C@H](C)CC[C@@H]3C)C2)c1 ZINC001404926638 1365913975 /nfs/dbraw/zinc/91/39/75/1365913975.db2.gz GDZAICNPMFILGG-HDICACEKSA-N 1 3 343.515 2.724 10 0 EFAEHO Cc1cc(C)cc(CN2CC(CNC(=O)C[N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1 ZINC001404926638 1365913977 /nfs/dbraw/zinc/91/39/77/1365913977.db2.gz GDZAICNPMFILGG-HDICACEKSA-N 1 3 343.515 2.724 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCN(Cc2ccc(C3CCCC3)cc2)C1 ZINC001405091633 1366014598 /nfs/dbraw/zinc/01/45/98/1366014598.db2.gz DQRCFGPYCZMPNO-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CC[C@H](C(=O)N[C@](C)(C[NH2+]Cc1csc(C)c1)C1CC1)N(C)C ZINC001405433969 1366198000 /nfs/dbraw/zinc/19/80/00/1366198000.db2.gz JDNOYZYTZZNRMD-SJLPKXTDSA-N 1 3 337.533 2.771 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[C@H]([NH2+]Cc2ccsc2)CC1)C1CCC1 ZINC001405525785 1366270501 /nfs/dbraw/zinc/27/05/01/1366270501.db2.gz ZBIPLSLJPFXBHI-WKILWMFISA-N 1 3 335.517 2.749 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001405607644 1366312289 /nfs/dbraw/zinc/31/22/89/1366312289.db2.gz QKXDJPUCWIGOQE-GOSISDBHSA-N 1 3 335.467 2.555 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)Cc1ccc(C2CC2)cc1 ZINC001437594141 1387803213 /nfs/dbraw/zinc/80/32/13/1387803213.db2.gz KWMOYXFHSBTZFQ-OXQOHEQNSA-N 1 3 343.515 2.842 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)Cc1ccc(C2CC2)cc1 ZINC001437594141 1387803221 /nfs/dbraw/zinc/80/32/21/1387803221.db2.gz KWMOYXFHSBTZFQ-OXQOHEQNSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1ccc(CN2CC3(C2)CCN(C(=O)CC[NH+](C)C)CC3)c(C)c1 ZINC001405788537 1366416353 /nfs/dbraw/zinc/41/63/53/1366416353.db2.gz HWSLKQQSDMQQCC-UHFFFAOYSA-N 1 3 343.515 2.680 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C[C@H](C)N(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001405833473 1366449067 /nfs/dbraw/zinc/44/90/67/1366449067.db2.gz QLDIBRRDQHNVPP-JKSUJKDBSA-N 1 3 347.503 2.677 10 0 EFAEHO C[C@@H](CNCc1ccc(Cl)cc1Cl)N(C)C(=O)CC[NH+](C)C ZINC001405858429 1366468671 /nfs/dbraw/zinc/46/86/71/1366468671.db2.gz XCBDUFJSIMVKCO-LBPRGKRZSA-N 1 3 346.302 2.882 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)N(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001405873601 1366481853 /nfs/dbraw/zinc/48/18/53/1366481853.db2.gz PAZUZSIJNMTVMM-LSDHHAIUSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)N(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001405873601 1366481855 /nfs/dbraw/zinc/48/18/55/1366481855.db2.gz PAZUZSIJNMTVMM-LSDHHAIUSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)N(C)C(=O)C[N@@H+]1CC[C@@H](C)C1 ZINC001405875718 1366483978 /nfs/dbraw/zinc/48/39/78/1366483978.db2.gz YHWUMNAUAFYTEA-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)N(C)C(=O)C[N@H+]1CC[C@@H](C)C1 ZINC001405875718 1366483981 /nfs/dbraw/zinc/48/39/81/1366483981.db2.gz YHWUMNAUAFYTEA-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC(CC[N@H+](C)CC[C@@H](C)F)CC1)N(C)C ZINC001405974244 1367033625 /nfs/dbraw/zinc/03/36/25/1367033625.db2.gz PYRZSUMWKSHHMX-AEFFLSMTSA-N 1 3 343.531 2.881 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC(CC[N@@H+](C)CC[C@@H](C)F)CC1)N(C)C ZINC001405974244 1367033634 /nfs/dbraw/zinc/03/36/34/1367033634.db2.gz PYRZSUMWKSHHMX-AEFFLSMTSA-N 1 3 343.531 2.881 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)CCc1ccc(Cl)cc1 ZINC001406169507 1367358731 /nfs/dbraw/zinc/35/87/31/1367358731.db2.gz DIKUGDJEIGIEHX-UHFFFAOYSA-N 1 3 339.911 2.613 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)CCc1ccc(Cl)cc1 ZINC001406169507 1367358739 /nfs/dbraw/zinc/35/87/39/1367358739.db2.gz DIKUGDJEIGIEHX-UHFFFAOYSA-N 1 3 339.911 2.613 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2ccc(Cl)cc21)C(=O)[C@H]1CC[N@H+](C)C1 ZINC001406172234 1367365084 /nfs/dbraw/zinc/36/50/84/1367365084.db2.gz XRRITQCGYJBLIK-MAUKXSAKSA-N 1 3 349.906 2.669 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2ccc(Cl)cc21)C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001406172234 1367365091 /nfs/dbraw/zinc/36/50/91/1367365091.db2.gz XRRITQCGYJBLIK-MAUKXSAKSA-N 1 3 349.906 2.669 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001406387857 1367539560 /nfs/dbraw/zinc/53/95/60/1367539560.db2.gz XFKWFBNAEJWZJZ-OAHLLOKOSA-N 1 3 335.467 2.603 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1cc2ccccc2o1 ZINC001406430169 1367583316 /nfs/dbraw/zinc/58/33/16/1367583316.db2.gz IEULJHLSOXKCCL-QAPCUYQASA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1cccc(C(C)C)n1 ZINC001406484502 1367637417 /nfs/dbraw/zinc/63/74/17/1367637417.db2.gz WQXDQEHFINYMGL-LPHOPBHVSA-N 1 3 346.519 2.674 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1cccc(C(C)C)n1 ZINC001406484502 1367637423 /nfs/dbraw/zinc/63/74/23/1367637423.db2.gz WQXDQEHFINYMGL-LPHOPBHVSA-N 1 3 346.519 2.674 10 0 EFAEHO C[C@@H](C[NH2+]CC1CC(C)(C)C1)NC(=O)c1cccc(CN(C)C)c1 ZINC001406561090 1367728309 /nfs/dbraw/zinc/72/83/09/1367728309.db2.gz MMAJBJSOLVFOEY-HNNXBMFYSA-N 1 3 331.504 2.892 10 0 EFAEHO CCc1cccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)c1 ZINC001406620434 1367816310 /nfs/dbraw/zinc/81/63/10/1367816310.db2.gz VWJWDYDSJOHZIS-FRQCXROJSA-N 1 3 331.504 2.526 10 0 EFAEHO CCc1cccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)c1 ZINC001406620434 1367816314 /nfs/dbraw/zinc/81/63/14/1367816314.db2.gz VWJWDYDSJOHZIS-FRQCXROJSA-N 1 3 331.504 2.526 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1C[NH+]2CCC1CC2)[C@@H](C)c1ccc(F)cc1 ZINC001492954030 1367863006 /nfs/dbraw/zinc/86/30/06/1367863006.db2.gz OSIXHUIBPWMLRO-HNAYVOBHSA-N 1 3 347.478 2.667 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C[NH2+]Cc1ccc(F)cc1)C1CC1 ZINC001406760604 1368014700 /nfs/dbraw/zinc/01/47/00/1368014700.db2.gz LDCWSKPWHGKURY-OALUTQOASA-N 1 3 347.478 2.685 10 0 EFAEHO Cc1ccc(CNC[C@@H](NC(=O)CC[NH+](C)C)C2CC2)c(Cl)c1 ZINC001406775473 1368033775 /nfs/dbraw/zinc/03/37/75/1368033775.db2.gz JSXRLMZMJKFOMV-QGZVFWFLSA-N 1 3 337.895 2.585 10 0 EFAEHO C[C@@H](C(=O)N[C@H](C[NH2+]Cc1ccsc1)C1CC1)N1CCCCCC1 ZINC001406793700 1368060809 /nfs/dbraw/zinc/06/08/09/1368060809.db2.gz UGAMAKRTJJQNBP-MAUKXSAKSA-N 1 3 349.544 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]Cc1ccccc1Cl)C1CC1 ZINC001406830010 1368104943 /nfs/dbraw/zinc/10/49/43/1368104943.db2.gz RMTNENKGOLCAQI-KRWDZBQOSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+][C@H](C)c1cccc(F)c1)C1CC1 ZINC001406841106 1368115239 /nfs/dbraw/zinc/11/52/39/1368115239.db2.gz ZVBLLECGTFFIMW-RDTXWAMCSA-N 1 3 335.467 2.711 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)NCC1(NC/C=C/Cl)CC1 ZINC001406940323 1368231377 /nfs/dbraw/zinc/23/13/77/1368231377.db2.gz MWEMMWQBDYDPBS-IZZDOVSWSA-N 1 3 327.900 2.630 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)NCC1(NC/C=C/Cl)CC1 ZINC001406940323 1368231380 /nfs/dbraw/zinc/23/13/80/1368231380.db2.gz MWEMMWQBDYDPBS-IZZDOVSWSA-N 1 3 327.900 2.630 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)[C@@H]2CCCC[N@@H+]2C2CCCC2)CC1 ZINC001406958643 1368248531 /nfs/dbraw/zinc/24/85/31/1368248531.db2.gz QEVQRECETYMMLG-RDJZCZTQSA-N 1 3 339.499 2.770 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)[C@@H]2CCCC[N@H+]2C2CCCC2)CC1 ZINC001406958643 1368248538 /nfs/dbraw/zinc/24/85/38/1368248538.db2.gz QEVQRECETYMMLG-RDJZCZTQSA-N 1 3 339.499 2.770 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1(N[C@H](C)c2ccc(F)c(F)c2)CC1 ZINC001406977373 1368270218 /nfs/dbraw/zinc/27/02/18/1368270218.db2.gz ASOPOUHTSQDJRC-CYBMUJFWSA-N 1 3 339.430 2.606 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1(N[C@H](C)c2ccc(F)c(F)c2)CC1 ZINC001406977373 1368270230 /nfs/dbraw/zinc/27/02/30/1368270230.db2.gz ASOPOUHTSQDJRC-CYBMUJFWSA-N 1 3 339.430 2.606 10 0 EFAEHO CCc1ccccc1C[NH2+]C1(CNC(=O)CN2[C@H](C)CC[C@@H]2C)CC1 ZINC001407013159 1368322908 /nfs/dbraw/zinc/32/29/08/1368322908.db2.gz WVEJWDNTRLNILA-CALCHBBNSA-N 1 3 343.515 2.860 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)c1 ZINC001407093468 1368418011 /nfs/dbraw/zinc/41/80/11/1368418011.db2.gz NGMXBEFDFVNNSG-SJLPKXTDSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+][C@H](C)c1ccc(F)cc1 ZINC001407110499 1368437197 /nfs/dbraw/zinc/43/71/97/1368437197.db2.gz QKYYWEDDPKUTLL-QAPCUYQASA-N 1 3 335.467 2.808 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C[NH2+]CC1CCC1)C1CCCC1 ZINC001407149576 1368498674 /nfs/dbraw/zinc/49/86/74/1368498674.db2.gz QXYOCZGYOKSAHL-OALUTQOASA-N 1 3 335.536 2.924 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@]1(C)CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001407174197 1368541839 /nfs/dbraw/zinc/54/18/39/1368541839.db2.gz HMGZQPPYKMDPPH-OAQYLSRUSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]CC1CC(F)(F)C1)C1CCCC1 ZINC001407180523 1368550491 /nfs/dbraw/zinc/55/04/91/1368550491.db2.gz ZXNNBVQGVNGQPF-INIZCTEOSA-N 1 3 345.478 2.637 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001407253250 1368656009 /nfs/dbraw/zinc/65/60/09/1368656009.db2.gz YFJNWACVOPPASR-TZIWHRDSSA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1(C)CC[NH+](CC[C@H](C)F)CC1)N(C)C ZINC001407273133 1368686218 /nfs/dbraw/zinc/68/62/18/1368686218.db2.gz IYWFMNLYNTXHJX-JKSUJKDBSA-N 1 3 329.504 2.539 10 0 EFAEHO CC[C@H](F)CN1CCC[C@](C)(CNC(=O)CC2CC[NH+](C)CC2)C1 ZINC001407288363 1368710693 /nfs/dbraw/zinc/71/06/93/1368710693.db2.gz DJNCROPQDRNFQR-PKOBYXMFSA-N 1 3 341.515 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CC(C)(C)C1)C2 ZINC001407489716 1368905513 /nfs/dbraw/zinc/90/55/13/1368905513.db2.gz CYYHMEVAIBWEKE-JQHSSLGASA-N 1 3 335.536 2.732 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CC1CC(C)(C)C1)C2 ZINC001407489716 1368905519 /nfs/dbraw/zinc/90/55/19/1368905519.db2.gz CYYHMEVAIBWEKE-JQHSSLGASA-N 1 3 335.536 2.732 10 0 EFAEHO CC[NH2+][C@@H](CNC(=O)CN(C)CC(C)(C)C)c1ccccc1CC ZINC001407511111 1368925372 /nfs/dbraw/zinc/92/53/72/1368925372.db2.gz MLNUILXRHBJBIU-SFHVURJKSA-N 1 3 333.520 2.994 10 0 EFAEHO CC[NH2+]C[C@H]1CC[C@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001407568600 1368998612 /nfs/dbraw/zinc/99/86/12/1368998612.db2.gz VNOMHTNFCNTTMW-BXWFABGCSA-N 1 3 341.515 2.731 10 0 EFAEHO C[C@H](c1ccccc1Cl)N1C[C@@H]2CN(C(=O)CC[NH+](C)C)C[C@@H]2C1 ZINC001407573553 1369003040 /nfs/dbraw/zinc/00/30/40/1369003040.db2.gz SRPJCUUISIABFD-OAGGEKHMSA-N 1 3 349.906 2.743 10 0 EFAEHO CCc1cccc(C[N@@H+]2CC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001437728233 1387977766 /nfs/dbraw/zinc/97/77/66/1387977766.db2.gz OVSISGMQSZZRTF-PXNSSMCTSA-N 1 3 343.515 2.529 10 0 EFAEHO CCc1cccc(C[N@H+]2CC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001437728233 1387977770 /nfs/dbraw/zinc/97/77/70/1387977770.db2.gz OVSISGMQSZZRTF-PXNSSMCTSA-N 1 3 343.515 2.529 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC2(C1)CCN(Cc1ccc(F)cc1)CC2 ZINC001407724723 1369163949 /nfs/dbraw/zinc/16/39/49/1369163949.db2.gz YIGBAPRJEYTCFD-UHFFFAOYSA-N 1 3 347.478 2.592 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC2(C1)CCN(Cc1ccc(F)cc1)CC2 ZINC001407724723 1369163956 /nfs/dbraw/zinc/16/39/56/1369163956.db2.gz YIGBAPRJEYTCFD-UHFFFAOYSA-N 1 3 347.478 2.592 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@H+](CCCc2cccc(C)c2)C1)N(C)C ZINC001437737790 1387987538 /nfs/dbraw/zinc/98/75/38/1387987538.db2.gz RLFQRAYMELTSOR-VQTJNVASSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@@H+](CCCc2cccc(C)c2)C1)N(C)C ZINC001437737790 1387987543 /nfs/dbraw/zinc/98/75/43/1387987543.db2.gz RLFQRAYMELTSOR-VQTJNVASSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC)([NH2+]Cc2cncc(C)c2)CC1)N(C)C ZINC001407988467 1369498855 /nfs/dbraw/zinc/49/88/55/1369498855.db2.gz YRVUNFIEZQAEKZ-SFHVURJKSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@H]1Cc2ccccc2CN1CC[C@@H](C)F ZINC001408006551 1369520386 /nfs/dbraw/zinc/52/03/86/1369520386.db2.gz LHMCIXFLOFAAEU-VQIMIIECSA-N 1 3 349.494 2.619 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@H]1Cc2ccccc2CN1CC[C@@H](C)F ZINC001408006551 1369520390 /nfs/dbraw/zinc/52/03/90/1369520390.db2.gz LHMCIXFLOFAAEU-VQIMIIECSA-N 1 3 349.494 2.619 10 0 EFAEHO Cc1cccc(C[NH2+]C2(C)CCN(C(=O)CN(C)C(C)C)CC2)c1 ZINC001408085135 1369590748 /nfs/dbraw/zinc/59/07/48/1369590748.db2.gz CYCSDQPLFDHAIE-UHFFFAOYSA-N 1 3 331.504 2.806 10 0 EFAEHO COc1cccc(C[NH2+]C2(C)CCN(C(=O)CN(C)C(C)C)CC2)c1 ZINC001408088261 1369594455 /nfs/dbraw/zinc/59/44/55/1369594455.db2.gz NVBQVASNOQAVFI-UHFFFAOYSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C)([NH2+]C[C@@H](C)CC(C)C)CC1)N(C)C ZINC001408091413 1369597698 /nfs/dbraw/zinc/59/76/98/1369597698.db2.gz FAUDRJHAKQXMTN-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C)([NH2+]CCc2cccs2)CC1)N(C)C ZINC001408095711 1369601690 /nfs/dbraw/zinc/60/16/90/1369601690.db2.gz LNDNYLKIAKRLNZ-INIZCTEOSA-N 1 3 337.533 2.602 10 0 EFAEHO Cc1ccc(F)cc1CN1CC[C@H](NC(=O)CC[NH+](C)C)C(C)(C)C1 ZINC001408109538 1369616028 /nfs/dbraw/zinc/61/60/28/1369616028.db2.gz BCBXRRNBDOLBHP-SFHVURJKSA-N 1 3 349.494 2.803 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001499902210 1402846584 /nfs/dbraw/zinc/84/65/84/1402846584.db2.gz VRXUTUMKPQCDAL-UONOGXRCSA-N 1 3 348.318 2.760 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@@H]1c2ccccc2CCN1CC[C@H](C)F ZINC001408269666 1369766577 /nfs/dbraw/zinc/76/65/77/1369766577.db2.gz XANSGKPZKLVOOF-QFBILLFUSA-N 1 3 349.494 2.792 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@@H]1c2ccccc2CCN1CC[C@H](C)F ZINC001408269666 1369766582 /nfs/dbraw/zinc/76/65/82/1369766582.db2.gz XANSGKPZKLVOOF-QFBILLFUSA-N 1 3 349.494 2.792 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN(C)C1CCC1 ZINC001408302945 1369797496 /nfs/dbraw/zinc/79/74/96/1369797496.db2.gz FLCMIJRJQRTTKV-QFIXIFRTSA-N 1 3 343.515 2.889 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001499902210 1402846581 /nfs/dbraw/zinc/84/65/81/1402846581.db2.gz VRXUTUMKPQCDAL-UONOGXRCSA-N 1 3 348.318 2.760 10 0 EFAEHO CCCN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)Cc1cc(F)ccc1C ZINC001437764153 1388036770 /nfs/dbraw/zinc/03/67/70/1388036770.db2.gz LDCWWWUGNQWDJX-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO CCCN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)Cc1cc(F)ccc1C ZINC001437764153 1388036777 /nfs/dbraw/zinc/03/67/77/1388036777.db2.gz LDCWWWUGNQWDJX-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO CCCN(CCNC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C)Cc1ccsc1 ZINC001437769803 1388046261 /nfs/dbraw/zinc/04/62/61/1388046261.db2.gz SXODJSYSESTBMW-IYBDPMFKSA-N 1 3 337.533 2.949 10 0 EFAEHO CCCN(CCNC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C)Cc1ccsc1 ZINC001437769803 1388046265 /nfs/dbraw/zinc/04/62/65/1388046265.db2.gz SXODJSYSESTBMW-IYBDPMFKSA-N 1 3 337.533 2.949 10 0 EFAEHO COC(=O)[C@@H]1CCCC[C@H]1CN1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC001414040951 1370034292 /nfs/dbraw/zinc/03/42/92/1370034292.db2.gz YDWOBIWQAFMKIC-SOLBZPMBSA-N 1 3 331.460 2.572 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)C[C@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001505447001 1404641814 /nfs/dbraw/zinc/64/18/14/1404641814.db2.gz XFPVKDJIDGPHOC-IAGOWNOFSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)C[C@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001505447001 1404641829 /nfs/dbraw/zinc/64/18/29/1404641829.db2.gz XFPVKDJIDGPHOC-IAGOWNOFSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)(C(=O)NCCN(Cc1ccccc1)C1CC1)[NH+]1CCCC1 ZINC001437800490 1388083068 /nfs/dbraw/zinc/08/30/68/1388083068.db2.gz XSQKRLOSEACQLH-UHFFFAOYSA-N 1 3 329.488 2.642 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NCC[N@H+](CCC2CC2)C2CC2)C1 ZINC001437808126 1388097058 /nfs/dbraw/zinc/09/70/58/1388097058.db2.gz OVONONKIOQABOS-IBGZPJMESA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NCC[N@@H+](CCC2CC2)C2CC2)C1 ZINC001437808126 1388097067 /nfs/dbraw/zinc/09/70/67/1388097067.db2.gz OVONONKIOQABOS-IBGZPJMESA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C[C@@H]1CCCC(F)(F)C1)C1CC1 ZINC001437815354 1388112044 /nfs/dbraw/zinc/11/20/44/1388112044.db2.gz UNZKIPDWSCUYPU-OAHLLOKOSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C[C@@H]1CCCC(F)(F)C1)C1CC1 ZINC001437815354 1388112060 /nfs/dbraw/zinc/11/20/60/1388112060.db2.gz UNZKIPDWSCUYPU-OAHLLOKOSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]([NH2+]CC1CCCC1)c1ccccc1 ZINC001437871722 1388158819 /nfs/dbraw/zinc/15/88/19/1388158819.db2.gz LRWAJGYJAADRCC-IBGZPJMESA-N 1 3 340.471 2.898 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001417625291 1373103559 /nfs/dbraw/zinc/10/35/59/1373103559.db2.gz MODNCYSLLXRZQX-MOPGFXCFSA-N 1 3 329.488 2.594 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001417625291 1373103562 /nfs/dbraw/zinc/10/35/62/1373103562.db2.gz MODNCYSLLXRZQX-MOPGFXCFSA-N 1 3 329.488 2.594 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12)N(C)Cc1ccccc1 ZINC001417643809 1373118249 /nfs/dbraw/zinc/11/82/49/1373118249.db2.gz IBQXMYLXORGXSX-NZSAHSFTSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12)N(C)Cc1ccccc1 ZINC001417643809 1373118254 /nfs/dbraw/zinc/11/82/54/1373118254.db2.gz IBQXMYLXORGXSX-NZSAHSFTSA-N 1 3 329.488 2.640 10 0 EFAEHO O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001417646245 1373120309 /nfs/dbraw/zinc/12/03/09/1373120309.db2.gz AJWPAJHDRWTELQ-AABGKKOBSA-N 1 3 341.499 2.784 10 0 EFAEHO O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001417646245 1373120313 /nfs/dbraw/zinc/12/03/13/1373120313.db2.gz AJWPAJHDRWTELQ-AABGKKOBSA-N 1 3 341.499 2.784 10 0 EFAEHO C[C@H](NC(=O)c1ccc(NC2=NCCC2)cc1)C(C)(C)C[NH+](C)C ZINC001417647689 1373121331 /nfs/dbraw/zinc/12/13/31/1373121331.db2.gz ULEROJWAJYEXAV-AWEZNQCLSA-N 1 3 330.476 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+]CC[C@@H]2CCCC2(F)F)C1 ZINC001417778268 1373244679 /nfs/dbraw/zinc/24/46/79/1373244679.db2.gz QPYOTXRFAOJECF-HRCADAONSA-N 1 3 345.478 2.637 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001417795118 1373262370 /nfs/dbraw/zinc/26/23/70/1373262370.db2.gz FEIXOTDSIJAJST-SZVBFZGTSA-N 1 3 349.494 2.705 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]CCc2ccccc2)C1 ZINC001417797268 1373264236 /nfs/dbraw/zinc/26/42/36/1373264236.db2.gz DFIFDYQNMUSIJH-ZULIPRJHSA-N 1 3 343.515 2.586 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CC1CCCC1 ZINC001417822954 1373297749 /nfs/dbraw/zinc/29/77/49/1373297749.db2.gz OKLHWNBYYCXFOC-YRPNKDGESA-N 1 3 347.547 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CC1CCCC1 ZINC001417822954 1373297753 /nfs/dbraw/zinc/29/77/53/1373297753.db2.gz OKLHWNBYYCXFOC-YRPNKDGESA-N 1 3 347.547 2.687 10 0 EFAEHO CC[C@H](F)C[N@@H+]1CC[C@H](NC(=O)CN(C)C(C)C)CC(C)(C)C1 ZINC001417862879 1373355338 /nfs/dbraw/zinc/35/53/38/1373355338.db2.gz LKCFXTNWBIIWNT-HOTGVXAUSA-N 1 3 329.504 2.682 10 0 EFAEHO CC[C@H](F)C[N@H+]1CC[C@H](NC(=O)CN(C)C(C)C)CC(C)(C)C1 ZINC001417862879 1373355343 /nfs/dbraw/zinc/35/53/43/1373355343.db2.gz LKCFXTNWBIIWNT-HOTGVXAUSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)C[C@@H](C[NH+]1CCCC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001417884217 1373372487 /nfs/dbraw/zinc/37/24/87/1373372487.db2.gz SBCPNGCHFNXCAE-QFBILLFUSA-N 1 3 341.515 2.826 10 0 EFAEHO CN(C)C1(C(=O)N(C)C2CC[NH+](CC3CC(C)(C)C3)CC2)CCC1 ZINC001417896949 1373385467 /nfs/dbraw/zinc/38/54/67/1373385467.db2.gz UWFVFUBZHZFCCC-UHFFFAOYSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C1CC[NH+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001417899565 1373390100 /nfs/dbraw/zinc/39/01/00/1373390100.db2.gz AESHXWKTBYAWIO-GOSISDBHSA-N 1 3 337.552 2.932 10 0 EFAEHO Cc1cccc(C[NH+]2CCC(N(C)C(=O)CN(C)C(C)C)CC2)c1 ZINC001417903162 1373394287 /nfs/dbraw/zinc/39/42/87/1373394287.db2.gz WZRWWTWHIRAWIY-UHFFFAOYSA-N 1 3 331.504 2.758 10 0 EFAEHO CC(C)CCC[NH+]1CCC2(C[C@H]2NC(=O)C2(N(C)C)CCC2)CC1 ZINC001417956931 1373450778 /nfs/dbraw/zinc/45/07/78/1373450778.db2.gz HWLFXXMMDPUKCR-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CC1CCCCC1)C1CC1 ZINC001417975146 1373476158 /nfs/dbraw/zinc/47/61/58/1373476158.db2.gz DPFGEHDBKGHGJZ-RTBURBONSA-N 1 3 335.536 2.924 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@@H](C[N@H+](C)C/C=C/Cl)C1 ZINC001418023359 1373537327 /nfs/dbraw/zinc/53/73/27/1373537327.db2.gz VYRFDVWJRBADTG-GFXFGIRVSA-N 1 3 347.906 2.589 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@@H](C[N@@H+](C)C/C=C/Cl)C1 ZINC001418023359 1373537330 /nfs/dbraw/zinc/53/73/30/1373537330.db2.gz VYRFDVWJRBADTG-GFXFGIRVSA-N 1 3 347.906 2.589 10 0 EFAEHO CCC(CC)C[NH2+][C@H]1C[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001418066534 1373571938 /nfs/dbraw/zinc/57/19/38/1373571938.db2.gz ZYAQJEYIGVYEQP-BXWFABGCSA-N 1 3 341.515 2.872 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@H+](Cc3ccccc3)CC[C@H]21 ZINC001418082806 1373590801 /nfs/dbraw/zinc/59/08/01/1373590801.db2.gz PNCJTXVHAVVXBQ-VQTJNVASSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]21 ZINC001418082806 1373590804 /nfs/dbraw/zinc/59/08/04/1373590804.db2.gz PNCJTXVHAVVXBQ-VQTJNVASSA-N 1 3 343.515 2.841 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H]1C[C@@H](NC(=O)CN(C)CC(C)(C)C)C1 ZINC001418105430 1373608752 /nfs/dbraw/zinc/60/87/52/1373608752.db2.gz YCCZZFJBZMXDTK-HDICACEKSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001418107279 1373610192 /nfs/dbraw/zinc/61/01/92/1373610192.db2.gz ABNBSTLJULNXTD-IBZXFUKWSA-N 1 3 329.488 2.523 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2)C1 ZINC001418109353 1373612681 /nfs/dbraw/zinc/61/26/81/1373612681.db2.gz RYROHVIVKQAESJ-BGYRXZFFSA-N 1 3 339.483 2.918 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001418111046 1373615127 /nfs/dbraw/zinc/61/51/27/1373615127.db2.gz SDONVDIWHIWHIM-CEXWTWQISA-N 1 3 329.488 2.641 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](Cc2c(C)cccc2C)C1)N(C)C ZINC001418128172 1373646986 /nfs/dbraw/zinc/64/69/86/1373646986.db2.gz SPLCGCUQBHNTSV-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](Cc2c(C)cccc2C)C1)N(C)C ZINC001418128172 1373646988 /nfs/dbraw/zinc/64/69/88/1373646988.db2.gz SPLCGCUQBHNTSV-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1CCCN(Cc2ccccn2)C1)[NH+](CC)CC ZINC001418128745 1373648940 /nfs/dbraw/zinc/64/89/40/1373648940.db2.gz MHRYSCALEHGCFK-HKUYNNGSSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@H+](CCCC(C)(C)C)C1 ZINC001418136180 1373660771 /nfs/dbraw/zinc/66/07/71/1373660771.db2.gz HYTVFWKTFCUZEX-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@@H+](CCCC(C)(C)C)C1 ZINC001418136180 1373660774 /nfs/dbraw/zinc/66/07/74/1373660774.db2.gz HYTVFWKTFCUZEX-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CC1CC(C[N@@H+]2CCCC[C@H]2CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001418154445 1373688318 /nfs/dbraw/zinc/68/83/18/1373688318.db2.gz DFMTXDXBZUMEEP-ABHNRTSZSA-N 1 3 335.536 2.878 10 0 EFAEHO CC1CC(C[N@H+]2CCCC[C@H]2CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001418154445 1373688320 /nfs/dbraw/zinc/68/83/20/1373688320.db2.gz DFMTXDXBZUMEEP-ABHNRTSZSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001437962324 1388277293 /nfs/dbraw/zinc/27/72/93/1388277293.db2.gz VLTXPHANUFKTOX-WOJBJXKFSA-N 1 3 343.515 2.889 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001437962324 1388277297 /nfs/dbraw/zinc/27/72/97/1388277297.db2.gz VLTXPHANUFKTOX-WOJBJXKFSA-N 1 3 343.515 2.889 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001437962320 1388277387 /nfs/dbraw/zinc/27/73/87/1388277387.db2.gz VLTXPHANUFKTOX-VQTJNVASSA-N 1 3 343.515 2.889 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001437962320 1388277391 /nfs/dbraw/zinc/27/73/91/1388277391.db2.gz VLTXPHANUFKTOX-VQTJNVASSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)[C@H]1CCC[N@H+](CC2CCC2)C1 ZINC001418173468 1373727467 /nfs/dbraw/zinc/72/74/67/1373727467.db2.gz MGNYQDBZXZXRJA-WMZOPIPTSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)[C@H]1CCC[N@@H+](CC2CCC2)C1 ZINC001418173468 1373727468 /nfs/dbraw/zinc/72/74/68/1373727468.db2.gz MGNYQDBZXZXRJA-WMZOPIPTSA-N 1 3 335.536 2.878 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)NCc1cc2ccccc2o1 ZINC001418229794 1373785155 /nfs/dbraw/zinc/78/51/55/1373785155.db2.gz MSEXVLFFJUKGCI-QAPCUYQASA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)NCc1cc2ccccc2o1 ZINC001418229794 1373785159 /nfs/dbraw/zinc/78/51/59/1373785159.db2.gz MSEXVLFFJUKGCI-QAPCUYQASA-N 1 3 343.471 2.902 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]CC[C@H]1CCCC1(F)F ZINC001418277629 1373850402 /nfs/dbraw/zinc/85/04/02/1373850402.db2.gz YAAHQLMZLVHDMB-LSDHHAIUSA-N 1 3 347.494 2.884 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001418314736 1373893993 /nfs/dbraw/zinc/89/39/93/1373893993.db2.gz BEQOKUCSMHAMLC-QAPCUYQASA-N 1 3 343.471 2.902 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]([NH2+]CC=C(Cl)Cl)C1 ZINC001418361904 1373935071 /nfs/dbraw/zinc/93/50/71/1373935071.db2.gz SHTGLTKLEDOMOV-OLZOCXBDSA-N 1 3 336.307 2.663 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@H]2CCc3c2cccc3F)CC[N@@H+]1C ZINC001418462941 1374052685 /nfs/dbraw/zinc/05/26/85/1374052685.db2.gz XYXHJYVXATXSKA-UHOSZYNNSA-N 1 3 347.478 2.591 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@H]2CCc3c2cccc3F)CC[N@H+]1C ZINC001418462941 1374052690 /nfs/dbraw/zinc/05/26/90/1374052690.db2.gz XYXHJYVXATXSKA-UHOSZYNNSA-N 1 3 347.478 2.591 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)c(C)c1 ZINC001418476987 1374070456 /nfs/dbraw/zinc/07/04/56/1374070456.db2.gz RQOCGDSGLIRUAB-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)c(C)c1 ZINC001418476987 1374070459 /nfs/dbraw/zinc/07/04/59/1374070459.db2.gz RQOCGDSGLIRUAB-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[N@H+](C)CC1CC2(CCC2)C1 ZINC001418504999 1374104932 /nfs/dbraw/zinc/10/49/32/1374104932.db2.gz URVXCWXIRCBSPQ-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[N@@H+](C)CC1CC2(CCC2)C1 ZINC001418504999 1374104936 /nfs/dbraw/zinc/10/49/36/1374104936.db2.gz URVXCWXIRCBSPQ-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO CCc1ccc(C[N@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001437991510 1388302725 /nfs/dbraw/zinc/30/27/25/1388302725.db2.gz PLUDXHVUJQRPGU-FQEVSTJZSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1ccc(C[N@@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001437991510 1388302729 /nfs/dbraw/zinc/30/27/29/1388302729.db2.gz PLUDXHVUJQRPGU-FQEVSTJZSA-N 1 3 345.531 2.870 10 0 EFAEHO CN(C[C@H]1CCN1[C@H]1CCc2ccccc21)C(=O)C1(C[NH+](C)C)CC1 ZINC001418586697 1374229036 /nfs/dbraw/zinc/22/90/36/1374229036.db2.gz FZPZPMBZWNNLDE-MJGOQNOKSA-N 1 3 341.499 2.548 10 0 EFAEHO CN(C[C@H]1CCN1Cc1ccccc1C1CC1)C(=O)CC[NH+](C)C ZINC001418591097 1374236992 /nfs/dbraw/zinc/23/69/92/1374236992.db2.gz BEDZNKVCZSNPNE-GOSISDBHSA-N 1 3 329.488 2.548 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@H]1CN(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001418598099 1374248131 /nfs/dbraw/zinc/24/81/31/1374248131.db2.gz VSGDGWAFQVOTHD-MOPGFXCFSA-N 1 3 343.515 2.678 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@H]1CN(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001418598099 1374248138 /nfs/dbraw/zinc/24/81/38/1374248138.db2.gz VSGDGWAFQVOTHD-MOPGFXCFSA-N 1 3 343.515 2.678 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@@H]1CN(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001418598119 1374249011 /nfs/dbraw/zinc/24/90/11/1374249011.db2.gz VSGDGWAFQVOTHD-RBUKOAKNSA-N 1 3 343.515 2.678 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@@H]1CN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001418598119 1374249015 /nfs/dbraw/zinc/24/90/15/1374249015.db2.gz VSGDGWAFQVOTHD-RBUKOAKNSA-N 1 3 343.515 2.678 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2F)C1 ZINC001418663339 1374340367 /nfs/dbraw/zinc/34/03/67/1374340367.db2.gz CKLOXJAOSXYYKE-OAGGEKHMSA-N 1 3 335.467 2.711 10 0 EFAEHO Cc1ccc(C)c(C[N@H+]2CC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001418674991 1374353835 /nfs/dbraw/zinc/35/38/35/1374353835.db2.gz RNNXSCYYJPNXHX-MJGOQNOKSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+]2CC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001418674991 1374353839 /nfs/dbraw/zinc/35/38/39/1374353839.db2.gz RNNXSCYYJPNXHX-MJGOQNOKSA-N 1 3 343.515 2.583 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC001418701037 1374386529 /nfs/dbraw/zinc/38/65/29/1374386529.db2.gz UKTCNSXABCXNMM-JKSUJKDBSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC001418701037 1374386534 /nfs/dbraw/zinc/38/65/34/1374386534.db2.gz UKTCNSXABCXNMM-JKSUJKDBSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC001418701028 1374386723 /nfs/dbraw/zinc/38/67/23/1374386723.db2.gz UKTCNSXABCXNMM-CVEARBPZSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC001418701028 1374386728 /nfs/dbraw/zinc/38/67/28/1374386728.db2.gz UKTCNSXABCXNMM-CVEARBPZSA-N 1 3 345.478 2.590 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[N@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001438001203 1388315067 /nfs/dbraw/zinc/31/50/67/1388315067.db2.gz NUHNVUSFZDNAAI-HZPDHXFCSA-N 1 3 345.478 2.544 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[N@@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001438001203 1388315074 /nfs/dbraw/zinc/31/50/74/1388315074.db2.gz NUHNVUSFZDNAAI-HZPDHXFCSA-N 1 3 345.478 2.544 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NC[C@H]2CC[C@@H]([NH2+]C/C=C\Cl)C2)c1 ZINC001418730900 1374431475 /nfs/dbraw/zinc/43/14/75/1374431475.db2.gz NYFNOAMECDNOFX-MOPUDMPASA-N 1 3 349.906 2.989 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]C[C@@H]2CCC(F)(F)C2)C1 ZINC001418731867 1374433674 /nfs/dbraw/zinc/43/36/74/1374433674.db2.gz UISOCFYNIIRBLS-ARFHVFGLSA-N 1 3 345.478 2.637 10 0 EFAEHO CN(CC(=O)N[C@@H]1[C@@H]2CCC[N@H+](CC3CC3)[C@H]2C1(C)C)CC(C)(C)C ZINC001418740496 1374443441 /nfs/dbraw/zinc/44/34/41/1374443441.db2.gz BATLCTJXFXVBQQ-QXAKKESOSA-N 1 3 349.563 2.980 10 0 EFAEHO CN(CC(=O)N[C@@H]1[C@@H]2CCC[N@@H+](CC3CC3)[C@H]2C1(C)C)CC(C)(C)C ZINC001418740496 1374443447 /nfs/dbraw/zinc/44/34/47/1374443447.db2.gz BATLCTJXFXVBQQ-QXAKKESOSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2[N@H+](CCC(C)(C)C)C1 ZINC001418741194 1374445278 /nfs/dbraw/zinc/44/52/78/1374445278.db2.gz RQASINRJPAJPTE-VJANTYMQSA-N 1 3 349.563 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2[N@@H+](CCC(C)(C)C)C1 ZINC001418741194 1374445275 /nfs/dbraw/zinc/44/52/75/1374445275.db2.gz RQASINRJPAJPTE-VJANTYMQSA-N 1 3 349.563 2.932 10 0 EFAEHO C[NH+](C)CCC(=O)NCCN(C1CC1)[C@H]1CCc2ccc(Cl)cc21 ZINC001418779319 1374490682 /nfs/dbraw/zinc/49/06/82/1374490682.db2.gz QHBFQPJJSBWGIW-SFHVURJKSA-N 1 3 349.906 2.860 10 0 EFAEHO Cc1ccc(C)c(CN(CCNC(=O)C[C@@H]2CC[N@@H+](C)C2)C2CC2)c1 ZINC001418800178 1374519100 /nfs/dbraw/zinc/51/91/00/1374519100.db2.gz ICXARTVPDCDYRC-SFHVURJKSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(C)c(CN(CCNC(=O)C[C@@H]2CC[N@H+](C)C2)C2CC2)c1 ZINC001418800178 1374519104 /nfs/dbraw/zinc/51/91/04/1374519104.db2.gz ICXARTVPDCDYRC-SFHVURJKSA-N 1 3 343.515 2.726 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1CCN(Cc2ccccn2)CC(C)(C)C1 ZINC001418838499 1374561348 /nfs/dbraw/zinc/56/13/48/1374561348.db2.gz UTXYIGBXAOVLNV-QGZVFWFLSA-N 1 3 346.519 2.530 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1CCN(Cc2ccccn2)CC(C)(C)C1 ZINC001418838499 1374561352 /nfs/dbraw/zinc/56/13/52/1374561352.db2.gz UTXYIGBXAOVLNV-QGZVFWFLSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H](C)[NH2+]Cc2ccc(F)cc2)CC1 ZINC001418841230 1374564147 /nfs/dbraw/zinc/56/41/47/1374564147.db2.gz DTTSTVGEVBNDHW-INIZCTEOSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)CC[NH2+][C@@H](C)C1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001418842264 1374564656 /nfs/dbraw/zinc/56/46/56/1374564656.db2.gz DQNSOPOXKRXLMU-WMZOPIPTSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)CC[NH2+][C@H](C)C1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001418842261 1374564714 /nfs/dbraw/zinc/56/47/14/1374564714.db2.gz DQNSOPOXKRXLMU-AEFFLSMTSA-N 1 3 325.541 2.835 10 0 EFAEHO C[C@H]([NH2+]C/C(Cl)=C\Cl)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001418843065 1374565450 /nfs/dbraw/zinc/56/54/50/1374565450.db2.gz LJLLVXMVLOTDLS-LERPTODRSA-N 1 3 348.318 2.618 10 0 EFAEHO CC[NH2+][C@@H](CNC(=O)CN1CC[C@@H](C)C1)c1ccc(C(C)C)cc1 ZINC001418844705 1374567509 /nfs/dbraw/zinc/56/75/09/1374567509.db2.gz QPHMWZVCLXHEIF-APWZRJJASA-N 1 3 331.504 2.919 10 0 EFAEHO CCCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@H+](CCC)C1 ZINC001418873156 1374606468 /nfs/dbraw/zinc/60/64/68/1374606468.db2.gz ILXPKYPMSGABDG-LPHOPBHVSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@@H+](CCC)C1 ZINC001418873156 1374606470 /nfs/dbraw/zinc/60/64/70/1374606470.db2.gz ILXPKYPMSGABDG-LPHOPBHVSA-N 1 3 341.515 2.922 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)C1)N(C)C ZINC001438029599 1388328065 /nfs/dbraw/zinc/32/80/65/1388328065.db2.gz POGMSLGLLNLKDK-HRCADAONSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@@H+](C[C@H]2CCC(F)(F)C2)C1)N(C)C ZINC001438029599 1388328071 /nfs/dbraw/zinc/32/80/71/1388328071.db2.gz POGMSLGLLNLKDK-HRCADAONSA-N 1 3 345.478 2.589 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CC[C@@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001418905327 1374665971 /nfs/dbraw/zinc/66/59/71/1374665971.db2.gz HPABNCZBGOGBPL-GOSISDBHSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccccc1C[N@H+]1CC[C@@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001418905327 1374665977 /nfs/dbraw/zinc/66/59/77/1374665977.db2.gz HPABNCZBGOGBPL-GOSISDBHSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@H]1CC[N@H+](Cc2cc(C)ccc2F)C1 ZINC001418913055 1374678549 /nfs/dbraw/zinc/67/85/49/1374678549.db2.gz KOZZYTXVINJMKQ-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@H]1CC[N@@H+](Cc2cc(C)ccc2F)C1 ZINC001418913055 1374678553 /nfs/dbraw/zinc/67/85/53/1374678553.db2.gz KOZZYTXVINJMKQ-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001418959382 1374734570 /nfs/dbraw/zinc/73/45/70/1374734570.db2.gz UPSTXOGHUKZEHY-DLBZAZTESA-N 1 3 341.515 2.683 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001418959382 1374734573 /nfs/dbraw/zinc/73/45/73/1374734573.db2.gz UPSTXOGHUKZEHY-DLBZAZTESA-N 1 3 341.515 2.683 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)N2C[C@@H]3C[C@H]2CN3C(=O)CCC[NH+](C)C)c1 ZINC001419056000 1374796696 /nfs/dbraw/zinc/79/66/96/1374796696.db2.gz YHRCZHBLPCLDFH-QYZOEREBSA-N 1 3 343.515 2.991 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@@H]1CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001419147793 1374896112 /nfs/dbraw/zinc/89/61/12/1374896112.db2.gz NEYCTDNQCXEMOU-GOSISDBHSA-N 1 3 342.487 2.542 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@H+](CCC2CCCC2)C1 ZINC001419165274 1374914169 /nfs/dbraw/zinc/91/41/69/1374914169.db2.gz YVXLKQOZCDQSPV-MJGOQNOKSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@@H+](CCC2CCCC2)C1 ZINC001419165274 1374914176 /nfs/dbraw/zinc/91/41/76/1374914176.db2.gz YVXLKQOZCDQSPV-MJGOQNOKSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC)NCc1ccccc1F ZINC001419199218 1374944721 /nfs/dbraw/zinc/94/47/21/1374944721.db2.gz OBYLCKXAZPTVMS-XYJFISCASA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC)NCc1ccccc1F ZINC001419199218 1374944725 /nfs/dbraw/zinc/94/47/25/1374944725.db2.gz OBYLCKXAZPTVMS-XYJFISCASA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1cccc(F)c1 ZINC001419220094 1374966505 /nfs/dbraw/zinc/96/65/05/1374966505.db2.gz HBPVJJIFOJYZIX-QGZVFWFLSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1cccc(F)c1 ZINC001419220088 1374966607 /nfs/dbraw/zinc/96/66/07/1374966607.db2.gz HBPVJJIFOJYZIX-KRWDZBQOSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]Cc1cccnc1C ZINC001419235089 1374982055 /nfs/dbraw/zinc/98/20/55/1374982055.db2.gz GDEQDOKAHDQTCK-RTBURBONSA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]Cc1cccnc1C ZINC001419235088 1374982263 /nfs/dbraw/zinc/98/22/63/1374982263.db2.gz GDEQDOKAHDQTCK-RBUKOAKNSA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]([NH2+]CC1CC(C)(C)C1)C1CC1)N1CCCC1 ZINC001419266795 1375014082 /nfs/dbraw/zinc/01/40/82/1375014082.db2.gz BCUWVCBAZJHNRS-QGZVFWFLSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1cccc(Cl)c1)C1CC1)N(C)C ZINC001419281515 1375029430 /nfs/dbraw/zinc/02/94/30/1375029430.db2.gz TUVWVPOUFOUBPS-IAGOWNOFSA-N 1 3 337.895 2.665 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)CN2CC[C@@H](C)C2)C2CC2)c(C)c1 ZINC001419302710 1375064549 /nfs/dbraw/zinc/06/45/49/1375064549.db2.gz ZNADKNCQXQIXJH-OXQOHEQNSA-N 1 3 343.515 2.630 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+][C@H](C)c1cccc(F)c1)C1CC1 ZINC001419328978 1375110684 /nfs/dbraw/zinc/11/06/84/1375110684.db2.gz UMYASDWGOMVTLZ-KDOFPFPSSA-N 1 3 335.467 2.711 10 0 EFAEHO CC[C@@H](F)CN[C@H]1CCN(C(=O)CC[N@H+](C)C2CCCCC2)C1 ZINC001419367134 1375175588 /nfs/dbraw/zinc/17/55/88/1375175588.db2.gz MXYJESVCIQQHQN-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@@H](F)CN[C@H]1CCN(C(=O)CC[N@@H+](C)C2CCCCC2)C1 ZINC001419367134 1375175590 /nfs/dbraw/zinc/17/55/90/1375175590.db2.gz MXYJESVCIQQHQN-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]2CN(Cc3ccc(F)cc3)CC[C@H]21 ZINC001419450679 1375291285 /nfs/dbraw/zinc/29/12/85/1375291285.db2.gz QDHHHHOEIINYAK-PKOBYXMFSA-N 1 3 347.478 2.590 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+][C@@H]3CCc4c3cccc4F)C2)CCC1 ZINC001419476685 1375319984 /nfs/dbraw/zinc/31/99/84/1375319984.db2.gz UOOPPBRWJLOUGF-QWQRMKEZSA-N 1 3 345.462 2.534 10 0 EFAEHO CC[C@H](N[C@H]1C[C@@H](NC(=O)CC[NH+](C)C)C1)c1ccc(F)cc1F ZINC001419488224 1375335936 /nfs/dbraw/zinc/33/59/36/1375335936.db2.gz FQLNMKTZXFMDMI-VBQJREDUSA-N 1 3 339.430 2.604 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H](NC(=O)CCC[NH+](C)C)C1)c1ccc(F)cc1F ZINC001419488291 1375336498 /nfs/dbraw/zinc/33/64/98/1375336498.db2.gz GAHYDGYDRPOXQA-AEGPPILISA-N 1 3 339.430 2.604 10 0 EFAEHO CCc1cccc(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)CC(C)(C)C)C2)c1 ZINC001419494499 1375343256 /nfs/dbraw/zinc/34/32/56/1375343256.db2.gz VZBPAEHWJJZJAD-KDURUIRLSA-N 1 3 345.531 2.964 10 0 EFAEHO C[C@H](C(=O)NCC1C[NH+](CC2CC(C)(C)C2)C1)N1CCCCCC1 ZINC001438139728 1388376827 /nfs/dbraw/zinc/37/68/27/1388376827.db2.gz BGCNARHCCUWNCJ-MRXNPFEDSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H](C)N(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001419667395 1375670673 /nfs/dbraw/zinc/67/06/73/1375670673.db2.gz OHGQDXVANJKSKI-HNNXBMFYSA-N 1 3 335.467 2.555 10 0 EFAEHO C[C@H](C[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C(=O)C1(N(C)C)CCC1 ZINC001419668972 1375674529 /nfs/dbraw/zinc/67/45/29/1375674529.db2.gz YXYMRUKNUKYMAX-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CCC([NH2+]Cc2ccccc2F)CC1 ZINC001419673749 1375685888 /nfs/dbraw/zinc/68/58/88/1375685888.db2.gz OELVJVHZROXQDX-UHFFFAOYSA-N 1 3 335.467 2.683 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]CCc2ccccc2F)CC1)N(C)C ZINC001419684127 1375708051 /nfs/dbraw/zinc/70/80/51/1375708051.db2.gz SMZMCEHKLNKYSB-FAFZWHIHSA-N 1 3 349.494 2.725 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001419831671 1375952021 /nfs/dbraw/zinc/95/20/21/1375952021.db2.gz VUCUJXFYFAVHAW-XLIONFOSSA-N 1 3 345.531 2.916 10 0 EFAEHO C[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCc1ccccc1 ZINC001419848840 1375994935 /nfs/dbraw/zinc/99/49/35/1375994935.db2.gz LDBVGQGKEGJTPT-UZLBHIALSA-N 1 3 349.494 2.536 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](C)CNC(=O)[C@@H]1CCCCN1C(C)C ZINC001419865614 1376028452 /nfs/dbraw/zinc/02/84/52/1376028452.db2.gz JLMLTPCFLCPVTO-MJGOQNOKSA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1cc(C[NH2+][C@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)cs1 ZINC001419908658 1376110343 /nfs/dbraw/zinc/11/03/43/1376110343.db2.gz PFSBOISXLBVBJP-RHSMWYFYSA-N 1 3 337.533 2.629 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)cs1 ZINC001419908666 1376110494 /nfs/dbraw/zinc/11/04/94/1376110494.db2.gz PFSBOISXLBVBJP-YOEHRIQHSA-N 1 3 337.533 2.629 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H](CNC(=O)CN1CC[C@@H](C)C1)C(C)C ZINC001419911985 1376115771 /nfs/dbraw/zinc/11/57/71/1376115771.db2.gz VDBWQMRAXFTTAP-XLIONFOSSA-N 1 3 345.531 2.821 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H](CNC(=O)CN1CC[C@H](C)C1)C(C)C ZINC001419911980 1376116175 /nfs/dbraw/zinc/11/61/75/1376116175.db2.gz VDBWQMRAXFTTAP-PXNSSMCTSA-N 1 3 345.531 2.821 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C(C)C)c(C)c1 ZINC001419937335 1376157066 /nfs/dbraw/zinc/15/70/66/1376157066.db2.gz TUDWXEMDUZGZKD-LJQANCHMSA-N 1 3 333.520 2.874 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C(C)C)c(C)c1 ZINC001419937333 1376157261 /nfs/dbraw/zinc/15/72/61/1376157261.db2.gz TUDWXEMDUZGZKD-IBGZPJMESA-N 1 3 333.520 2.874 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+][C@H]1CCc2c1cccc2Cl ZINC001419942515 1376166896 /nfs/dbraw/zinc/16/68/96/1376166896.db2.gz XLSMEBDOJBKLLO-DYVFJYSZSA-N 1 3 337.895 2.762 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21)Cc1ccccc1 ZINC001419989687 1376242957 /nfs/dbraw/zinc/24/29/57/1376242957.db2.gz KYRPVXXYXHXZBL-OALUTQOASA-N 1 3 329.488 2.594 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21)Cc1ccccc1 ZINC001419989687 1376242964 /nfs/dbraw/zinc/24/29/64/1376242964.db2.gz KYRPVXXYXHXZBL-OALUTQOASA-N 1 3 329.488 2.594 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@H+](C)CCC1CCCCC1)N(C)C ZINC001420034872 1376337054 /nfs/dbraw/zinc/33/70/54/1376337054.db2.gz DZLLFYYTCSJGSU-SFHVURJKSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@@H+](C)CCC1CCCCC1)N(C)C ZINC001420034872 1376337061 /nfs/dbraw/zinc/33/70/61/1376337061.db2.gz DZLLFYYTCSJGSU-SFHVURJKSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@H+](C)C/C=C/c2ccccc2)C1 ZINC001420059266 1376399849 /nfs/dbraw/zinc/39/98/49/1376399849.db2.gz ZJHLJSLABOFDKR-GPVYEGESSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@@H+](C)C/C=C/c2ccccc2)C1 ZINC001420059266 1376399857 /nfs/dbraw/zinc/39/98/57/1376399857.db2.gz ZJHLJSLABOFDKR-GPVYEGESSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@H+](C)C/C=C\c2ccccc2)C1 ZINC001420059276 1376399931 /nfs/dbraw/zinc/39/99/31/1376399931.db2.gz ZJHLJSLABOFDKR-VUBAQRPUSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@@H+](C)C/C=C\c2ccccc2)C1 ZINC001420059276 1376399942 /nfs/dbraw/zinc/39/99/42/1376399942.db2.gz ZJHLJSLABOFDKR-VUBAQRPUSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@H+](C)C/C=C\c2ccccc2)C1 ZINC001420059261 1376400527 /nfs/dbraw/zinc/40/05/27/1376400527.db2.gz ZJHLJSLABOFDKR-CRLZUZNUSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@@H+](C)C/C=C\c2ccccc2)C1 ZINC001420059261 1376400530 /nfs/dbraw/zinc/40/05/30/1376400530.db2.gz ZJHLJSLABOFDKR-CRLZUZNUSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@H]21 ZINC001420071992 1376418361 /nfs/dbraw/zinc/41/83/61/1376418361.db2.gz FTTABMJSLKRLIU-IEBWSBKVSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@H]21 ZINC001420071992 1376418364 /nfs/dbraw/zinc/41/83/64/1376418364.db2.gz FTTABMJSLKRLIU-IEBWSBKVSA-N 1 3 335.536 2.830 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1cc(F)ccc1C ZINC001420166642 1376527068 /nfs/dbraw/zinc/52/70/68/1376527068.db2.gz QXVVVGYCGCCNQY-APWZRJJASA-N 1 3 349.494 2.993 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC001420235704 1376593189 /nfs/dbraw/zinc/59/31/89/1376593189.db2.gz CLODSQIJEMIRCQ-UONOGXRCSA-N 1 3 341.446 2.850 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@H+](C)Cc2ccc(C3CCC3)cc2)CCC1 ZINC001420241850 1376603398 /nfs/dbraw/zinc/60/33/98/1376603398.db2.gz CRCHQWDEDKUTHK-UHFFFAOYSA-N 1 3 343.515 2.986 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@@H+](C)Cc2ccc(C3CCC3)cc2)CCC1 ZINC001420241850 1376603408 /nfs/dbraw/zinc/60/34/08/1376603408.db2.gz CRCHQWDEDKUTHK-UHFFFAOYSA-N 1 3 343.515 2.986 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)C(C)(C)[NH+]2CCCC2)cc1 ZINC001420285451 1376667413 /nfs/dbraw/zinc/66/74/13/1376667413.db2.gz PHNNVNQOTCMQPE-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001420308781 1376706629 /nfs/dbraw/zinc/70/66/29/1376706629.db2.gz DWZQGSRLYNRLSK-MOPGFXCFSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001420308781 1376706638 /nfs/dbraw/zinc/70/66/38/1376706638.db2.gz DWZQGSRLYNRLSK-MOPGFXCFSA-N 1 3 329.488 2.560 10 0 EFAEHO CC(C)c1ccc(CN(C)CCNC(=O)C[C@@H]2CC[N@H+](C)C2)cc1 ZINC001420332685 1376746588 /nfs/dbraw/zinc/74/65/88/1376746588.db2.gz FGYIYXFVTNLFSW-SFHVURJKSA-N 1 3 331.504 2.700 10 0 EFAEHO CC(C)c1ccc(CN(C)CCNC(=O)C[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001420332685 1376746591 /nfs/dbraw/zinc/74/65/91/1376746591.db2.gz FGYIYXFVTNLFSW-SFHVURJKSA-N 1 3 331.504 2.700 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001420335379 1376754846 /nfs/dbraw/zinc/75/48/46/1376754846.db2.gz UOINSLUEGKEOTE-MJGOQNOKSA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001420338011 1376759884 /nfs/dbraw/zinc/75/98/84/1376759884.db2.gz LHEAOPKLFAXQDV-ZWKOTPCHSA-N 1 3 345.531 2.821 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@H+](CCc2cccs2)C1 ZINC001438268881 1388467623 /nfs/dbraw/zinc/46/76/23/1388467623.db2.gz RXIPRWBOXFINLU-IAGOWNOFSA-N 1 3 349.544 2.555 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@@H+](CCc2cccs2)C1 ZINC001438268881 1388467625 /nfs/dbraw/zinc/46/76/25/1388467625.db2.gz RXIPRWBOXFINLU-IAGOWNOFSA-N 1 3 349.544 2.555 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@H]1CCC[N@@H+]1Cc1cccc(C)c1 ZINC001420479763 1377050857 /nfs/dbraw/zinc/05/08/57/1377050857.db2.gz DNXJJAPBPWNGTE-RTBURBONSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@H]1CCC[N@H+]1Cc1cccc(C)c1 ZINC001420479763 1377050861 /nfs/dbraw/zinc/05/08/61/1377050861.db2.gz DNXJJAPBPWNGTE-RTBURBONSA-N 1 3 349.494 2.756 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001420557755 1377192624 /nfs/dbraw/zinc/19/26/24/1377192624.db2.gz MVNLVUATDVDUQP-SJORKVTESA-N 1 3 347.503 2.535 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001420557755 1377192627 /nfs/dbraw/zinc/19/26/27/1377192627.db2.gz MVNLVUATDVDUQP-SJORKVTESA-N 1 3 347.503 2.535 10 0 EFAEHO CCc1ccc(CN(C)C[C@H](C)NC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)cc1 ZINC001420573663 1377228037 /nfs/dbraw/zinc/22/80/37/1377228037.db2.gz VXUJQMVOUTYBIO-FFZOFVMBSA-N 1 3 345.531 2.916 10 0 EFAEHO CCc1ccc(CN(C)C[C@H](C)NC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)cc1 ZINC001420573663 1377228044 /nfs/dbraw/zinc/22/80/44/1377228044.db2.gz VXUJQMVOUTYBIO-FFZOFVMBSA-N 1 3 345.531 2.916 10 0 EFAEHO CCc1ccc(CN(C)C[C@@H](C)NC(=O)[C@H]2C[NH+]3CCC2CC3)cc1 ZINC001420584520 1377252686 /nfs/dbraw/zinc/25/26/86/1377252686.db2.gz XLVKJZRCLNMIHZ-UZLBHIALSA-N 1 3 343.515 2.527 10 0 EFAEHO C[C@@H](C[N@H+](C)C[C@@H]1CCC(F)(F)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001420616152 1377331695 /nfs/dbraw/zinc/33/16/95/1377331695.db2.gz UUOJGDLPRXESLO-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[N@@H+](C)C[C@@H]1CCC(F)(F)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001420616152 1377331701 /nfs/dbraw/zinc/33/17/01/1377331701.db2.gz UUOJGDLPRXESLO-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN(C)C(C)C)[C@H]1CCc2ccc(F)cc21 ZINC001420627055 1377363400 /nfs/dbraw/zinc/36/34/00/1377363400.db2.gz SXQLIDVUCUHETK-IBGZPJMESA-N 1 3 349.494 2.981 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN(C)C(C)C)[C@H]1CCc2ccc(F)cc21 ZINC001420627055 1377363402 /nfs/dbraw/zinc/36/34/02/1377363402.db2.gz SXQLIDVUCUHETK-IBGZPJMESA-N 1 3 349.494 2.981 10 0 EFAEHO Cc1cc(CN(C)C[C@@H](C)NC(=O)C[C@H]2CC[N@H+](C)C2)c(C)s1 ZINC001420667259 1377461051 /nfs/dbraw/zinc/46/10/51/1377461051.db2.gz PQTPDCWQBHKYCS-CZUORRHYSA-N 1 3 337.533 2.643 10 0 EFAEHO Cc1cc(CN(C)C[C@@H](C)NC(=O)C[C@H]2CC[N@@H+](C)C2)c(C)s1 ZINC001420667259 1377461052 /nfs/dbraw/zinc/46/10/52/1377461052.db2.gz PQTPDCWQBHKYCS-CZUORRHYSA-N 1 3 337.533 2.643 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)CC1CCC(C)(C)CC1 ZINC001420688372 1377508433 /nfs/dbraw/zinc/50/84/33/1377508433.db2.gz ZMBBZUIOMONKFR-MRXNPFEDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)CC1CCC(C)(C)CC1 ZINC001420688372 1377508434 /nfs/dbraw/zinc/50/84/34/1377508434.db2.gz ZMBBZUIOMONKFR-MRXNPFEDSA-N 1 3 325.541 2.980 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NCCN(C/C=C\c2ccccc2)C2CC2)C1 ZINC001420702035 1377532529 /nfs/dbraw/zinc/53/25/29/1377532529.db2.gz WTIXOMNOTMETPV-ZXYDQQDNSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NCCN(C/C=C\c2ccccc2)C2CC2)C1 ZINC001420702035 1377532533 /nfs/dbraw/zinc/53/25/33/1377532533.db2.gz WTIXOMNOTMETPV-ZXYDQQDNSA-N 1 3 341.499 2.622 10 0 EFAEHO CCCN(C(=O)C[C@@H]1CC[N@H+](C)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC001420831033 1377741948 /nfs/dbraw/zinc/74/19/48/1377741948.db2.gz XVOHSFKUCFNKQK-PMACEKPBSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN(C(=O)C[C@@H]1CC[N@@H+](C)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC001420831033 1377741949 /nfs/dbraw/zinc/74/19/49/1377741949.db2.gz XVOHSFKUCFNKQK-PMACEKPBSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN(C(=O)[C@@H]1CC[N@H+](C)C1)[C@H]1CCN(Cc2cccc(C)c2)C1 ZINC001420830375 1377742623 /nfs/dbraw/zinc/74/26/23/1377742623.db2.gz VRCURNSLICTWBO-UXHICEINSA-N 1 3 343.515 2.760 10 0 EFAEHO CCCN(C(=O)[C@@H]1CC[N@@H+](C)C1)[C@H]1CCN(Cc2cccc(C)c2)C1 ZINC001420830375 1377742625 /nfs/dbraw/zinc/74/26/25/1377742625.db2.gz VRCURNSLICTWBO-UXHICEINSA-N 1 3 343.515 2.760 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@@H]2CCN2CC/C=C/c2ccccc2)C1 ZINC001420878933 1377823551 /nfs/dbraw/zinc/82/35/51/1377823551.db2.gz CIBAIIFOUDSJCD-OIJNNWEZSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@@H]2CCN2CC/C=C/c2ccccc2)C1 ZINC001420878933 1377823553 /nfs/dbraw/zinc/82/35/53/1377823553.db2.gz CIBAIIFOUDSJCD-OIJNNWEZSA-N 1 3 341.499 2.622 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]Cc1cnccc1C ZINC001438344109 1388522117 /nfs/dbraw/zinc/52/21/17/1388522117.db2.gz ORDYAAJKRXZPKR-MOPGFXCFSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@H]3C)CC2)cc1C ZINC001421008542 1378014609 /nfs/dbraw/zinc/01/46/09/1378014609.db2.gz ZQTHKCIVJLBYGR-QZTJIDSGSA-N 1 3 343.515 2.915 10 0 EFAEHO CC[C@@H](C(=O)NCC1C[NH+]([C@@H](C)c2cc(C)ccc2C)C1)N(C)C ZINC001421178947 1378236566 /nfs/dbraw/zinc/23/65/66/1378236566.db2.gz GWYLTDIBIJCUFN-LPHOPBHVSA-N 1 3 331.504 2.753 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1cc(C2CC2)nc(C2CC2)n1 ZINC001421191963 1378254604 /nfs/dbraw/zinc/25/46/04/1378254604.db2.gz PIQVSMLPQKNLCK-AWEZNQCLSA-N 1 3 331.508 2.915 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1cc(C2CC2)nc(C2CC2)n1 ZINC001421191963 1378254609 /nfs/dbraw/zinc/25/46/09/1378254609.db2.gz PIQVSMLPQKNLCK-AWEZNQCLSA-N 1 3 331.508 2.915 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)N[C@]2(C)CCN(Cc3ccc(CF)cc3)C2)C1 ZINC001421222720 1378304333 /nfs/dbraw/zinc/30/43/33/1378304333.db2.gz MZIBBKWJFHQIBW-AZUAARDMSA-N 1 3 347.478 2.579 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)N[C@]2(C)CCN(Cc3ccc(CF)cc3)C2)C1 ZINC001421222720 1378304339 /nfs/dbraw/zinc/30/43/39/1378304339.db2.gz MZIBBKWJFHQIBW-AZUAARDMSA-N 1 3 347.478 2.579 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(Cl)cc1 ZINC001438374360 1388544872 /nfs/dbraw/zinc/54/48/72/1388544872.db2.gz LJWVWDPKGJKLHV-INIZCTEOSA-N 1 3 325.884 2.665 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@](C)(C[NH2+]CC3CCCCC3)C2)C1 ZINC001421254014 1378354620 /nfs/dbraw/zinc/35/46/20/1378354620.db2.gz KCLICCXUQNOQES-FXAWDEMLSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H](F)CC[NH+]1CCC(C)(CNC(=O)CN(C)CC(C)(C)C)CC1 ZINC001421272018 1378388417 /nfs/dbraw/zinc/38/84/17/1378388417.db2.gz KCNTZORLVDVPSL-MRXNPFEDSA-N 1 3 343.531 2.931 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@]1(C)CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001421291516 1378443316 /nfs/dbraw/zinc/44/33/16/1378443316.db2.gz PLVPJRWUCUVMNH-HXUWFJFHSA-N 1 3 337.552 2.983 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@]1(C)CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001421291516 1378443318 /nfs/dbraw/zinc/44/33/18/1378443318.db2.gz PLVPJRWUCUVMNH-HXUWFJFHSA-N 1 3 337.552 2.983 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@H+](Cc2ccccc2C)C1 ZINC001421347148 1378523620 /nfs/dbraw/zinc/52/36/20/1378523620.db2.gz BIMAGIUAUMCSIB-XLIONFOSSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@@H+](Cc2ccccc2C)C1 ZINC001421347148 1378523624 /nfs/dbraw/zinc/52/36/24/1378523624.db2.gz BIMAGIUAUMCSIB-XLIONFOSSA-N 1 3 343.515 2.760 10 0 EFAEHO CC[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]Cc1cc(C)ccc1F ZINC001421418996 1378596338 /nfs/dbraw/zinc/59/63/38/1378596338.db2.gz FKWZULGHYBOAOH-INIZCTEOSA-N 1 3 335.467 2.603 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1cc(F)ccc1C ZINC001421423326 1378600589 /nfs/dbraw/zinc/60/05/89/1378600589.db2.gz PQNMWNYJUJHWET-RTBURBONSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1cccc(OC)c1 ZINC001421425236 1378601762 /nfs/dbraw/zinc/60/17/62/1378601762.db2.gz RMANJXUSUQUSRE-PKOBYXMFSA-N 1 3 347.503 2.552 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]Cc1ccsc1 ZINC001421456144 1378641529 /nfs/dbraw/zinc/64/15/29/1378641529.db2.gz NTRRJMSTTBOEAS-DLBZAZTESA-N 1 3 337.533 2.995 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C[NH2+]Cc2cccc(F)c2)CCCC1 ZINC001438400416 1388561881 /nfs/dbraw/zinc/56/18/81/1388561881.db2.gz YUYSBCVIXSFOPM-UHFFFAOYSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@H](CNC(=O)Cc1nc[nH]c1C)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001421471310 1378661581 /nfs/dbraw/zinc/66/15/81/1378661581.db2.gz ARWIRSWSDREJBF-UONOGXRCSA-N 1 3 342.434 2.571 10 0 EFAEHO CN(CC(=O)N[C@](C)(C[NH2+]Cc1ccsc1)C1CC1)C1CCC1 ZINC001421568156 1378823341 /nfs/dbraw/zinc/82/33/41/1378823341.db2.gz VVNPSYOJJUGIKT-GOSISDBHSA-N 1 3 335.517 2.607 10 0 EFAEHO CN(CC(=O)N[C@@](C)(C[NH2+]Cc1ccsc1)C1CC1)C1CCC1 ZINC001421568157 1378823402 /nfs/dbraw/zinc/82/34/02/1378823402.db2.gz VVNPSYOJJUGIKT-SFHVURJKSA-N 1 3 335.517 2.607 10 0 EFAEHO Cc1cc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)CC[NH+](C)C)cs1 ZINC001421633926 1378917164 /nfs/dbraw/zinc/91/71/64/1378917164.db2.gz KMPZINPSNDLDCE-IAGOWNOFSA-N 1 3 335.517 2.574 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2C[C@@H](F)CC ZINC001421632979 1378917188 /nfs/dbraw/zinc/91/71/88/1378917188.db2.gz JDEVYRXCRXIULT-BBWFWOEESA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2C[C@@H](F)CC ZINC001421632979 1378917194 /nfs/dbraw/zinc/91/71/94/1378917194.db2.gz JDEVYRXCRXIULT-BBWFWOEESA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@H](C)C[NH2+]Cc1ccsc1 ZINC001421741172 1379063595 /nfs/dbraw/zinc/06/35/95/1379063595.db2.gz UIIVINVDILSYAP-DOTOQJQBSA-N 1 3 337.533 2.853 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+][C@@H](C)c1ccc2c(c1)CCC2 ZINC001421767197 1379105512 /nfs/dbraw/zinc/10/55/12/1379105512.db2.gz IEUKXAONBJAONA-IRXDYDNUSA-N 1 3 345.531 2.918 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+][C@@H](C)c1c(F)cccc1F ZINC001421767942 1379107085 /nfs/dbraw/zinc/10/70/85/1379107085.db2.gz KFSPJYOFLQDQMA-KGLIPLIRSA-N 1 3 341.446 2.708 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+]C[C@H]2CCC(F)(F)C2)CCC1)N(C)C ZINC001421779914 1379128903 /nfs/dbraw/zinc/12/89/03/1379128903.db2.gz UOVWZYQVTNGBML-LSDHHAIUSA-N 1 3 345.478 2.637 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](Cc2ccc(OC)cc2)CC1)N(C)C ZINC001421815185 1379166226 /nfs/dbraw/zinc/16/62/26/1379166226.db2.gz AJTQYTNZCPXKPJ-PKOBYXMFSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](Cc2ccc(OC)cc2)CC1)N(C)C ZINC001421815185 1379166228 /nfs/dbraw/zinc/16/62/28/1379166228.db2.gz AJTQYTNZCPXKPJ-PKOBYXMFSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@@H](c1ccccc1F)N1CCC[C@H](NC(=O)CC[NH+](C)C)CC1 ZINC001421831526 1379197009 /nfs/dbraw/zinc/19/70/09/1379197009.db2.gz WPHJKYIMGIOXFL-HOTGVXAUSA-N 1 3 335.467 2.809 10 0 EFAEHO COc1ccc(C[N@@H+]2CCC[C@H](NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001421835464 1379206587 /nfs/dbraw/zinc/20/65/87/1379206587.db2.gz QXSHYHPKCXIDNK-SFHVURJKSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1ccc(C[N@H+]2CCC[C@H](NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001421835464 1379206588 /nfs/dbraw/zinc/20/65/88/1379206588.db2.gz QXSHYHPKCXIDNK-SFHVURJKSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2cccc(F)c2)CCCC1 ZINC001421847623 1379232428 /nfs/dbraw/zinc/23/24/28/1379232428.db2.gz GVDDVBFINBLMHM-UHFFFAOYSA-N 1 3 335.467 2.685 10 0 EFAEHO Cc1cc(CN(C)CCCN(C)C(=O)[C@H]2C[NH+]3CCC2CC3)cs1 ZINC001421864761 1379265251 /nfs/dbraw/zinc/26/52/51/1379265251.db2.gz LETHVGNVFWWCJJ-SFHVURJKSA-N 1 3 349.544 2.679 10 0 EFAEHO C[C@@H](C[NH2+][C@H]1CCc2ccccc21)N(C)C(=O)CN(C)C1CCC1 ZINC001421900917 1379328185 /nfs/dbraw/zinc/32/81/85/1379328185.db2.gz HSBPGMSRGHGEKJ-KXBFYZLASA-N 1 3 329.488 2.595 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@@H](C)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001421937868 1379378473 /nfs/dbraw/zinc/37/84/73/1379378473.db2.gz DTRNXLAQVNEKKV-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO CCC1([NH2+]C/C(Cl)=C\Cl)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001421941859 1379384551 /nfs/dbraw/zinc/38/45/51/1379384551.db2.gz RKEJLRFUCARHBF-CMPYXILNSA-N 1 3 348.318 2.760 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(CC)([NH2+]CC2CC(F)(F)C2)CC1 ZINC001421951618 1379398086 /nfs/dbraw/zinc/39/80/86/1379398086.db2.gz JOJQLTNIBJWKEW-UHFFFAOYSA-N 1 3 345.478 2.734 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@]2(CCN(Cc3cccc(F)c3)C2)C1 ZINC001421959508 1379411569 /nfs/dbraw/zinc/41/15/69/1379411569.db2.gz RWQVVTGZSXGATN-FQEVSTJZSA-N 1 3 347.478 2.592 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H](C)N(C)C(=O)CN(C)C(C)C)c(C)s1 ZINC001421976903 1379431108 /nfs/dbraw/zinc/43/11/08/1379431108.db2.gz BQSHQGUXWVOQHK-CYBMUJFWSA-N 1 3 325.522 2.642 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(F)cc1 ZINC001421985632 1379440881 /nfs/dbraw/zinc/44/08/81/1379440881.db2.gz OKOUQUMPBWYVCF-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1cc(F)ccc1C ZINC001421989813 1379446227 /nfs/dbraw/zinc/44/62/27/1379446227.db2.gz UNRHVNZCQPDMMP-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCCN(C)CC(=O)N(C)[C@@H](C)C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001421994814 1379453583 /nfs/dbraw/zinc/45/35/83/1379453583.db2.gz RCGCIVYTJDHJCZ-GJZGRUSLSA-N 1 3 333.467 2.590 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cc2ccccc2s1)N(C)C(=O)CN1CCCC1 ZINC001421994705 1379453741 /nfs/dbraw/zinc/45/37/41/1379453741.db2.gz PCFDWPSDPWFXEM-HNNXBMFYSA-N 1 3 345.512 2.934 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H]([NH2+]CCC(C)(C)C)[C@H](C)C2)CC1 ZINC001422037410 1379523587 /nfs/dbraw/zinc/52/35/87/1379523587.db2.gz ZWCWXZBAIFKSCX-MSOLQXFVSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NCCC1CCN(C/C=C\Cl)CC1 ZINC001438451842 1388615251 /nfs/dbraw/zinc/61/52/51/1388615251.db2.gz KQLDVQFLBRZGST-MMKBSGOPSA-N 1 3 341.927 2.830 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]Cc2ccc(F)cc2)CC1 ZINC001422068934 1379569218 /nfs/dbraw/zinc/56/92/18/1379569218.db2.gz RVQZPXXTOPYTEJ-UHFFFAOYSA-N 1 3 335.467 2.638 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@H+](CCCC(C)C)CC1(C)C)N(C)C ZINC001422083772 1379589008 /nfs/dbraw/zinc/58/90/08/1379589008.db2.gz CMOKDNJXDCEOCA-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@@H+](CCCC(C)C)CC1(C)C)N(C)C ZINC001422083772 1379589012 /nfs/dbraw/zinc/58/90/12/1379589012.db2.gz CMOKDNJXDCEOCA-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1cc(F)ccc1CN1CC[C@H](NC(=O)CC[NH+](C)C)C[C@H]1C ZINC001422117313 1379636039 /nfs/dbraw/zinc/63/60/39/1379636039.db2.gz BWJJFEBEAVLFOC-QAPCUYQASA-N 1 3 335.467 2.555 10 0 EFAEHO CCC[NH+]1CCC(CCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001438456403 1388621210 /nfs/dbraw/zinc/62/12/10/1388621210.db2.gz NTRBYDZAIZYRJH-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@H](C)[NH2+]CC1CCC(C)CC1)N(C)C ZINC001422147023 1379684926 /nfs/dbraw/zinc/68/49/26/1379684926.db2.gz UZJLBACUUPSPGN-IKJBURDNSA-N 1 3 325.541 2.883 10 0 EFAEHO C[C@@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001422152051 1379691960 /nfs/dbraw/zinc/69/19/60/1379691960.db2.gz QCYJRMHYBKLWGM-HNNXBMFYSA-N 1 3 342.487 2.637 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H](C)[NH2+][C@@H]1CCc2ccccc21)N(C)C ZINC001422157645 1379698759 /nfs/dbraw/zinc/69/87/59/1379698759.db2.gz GRPRIQZAQDFRCF-KFKAGJAMSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@H+](C)[C@@H]1CCc2ccccc21)N(C)C ZINC001422227325 1379811107 /nfs/dbraw/zinc/81/11/07/1379811107.db2.gz NFAZUWHMIGMXDK-MOPGFXCFSA-N 1 3 331.504 2.650 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@@H+](C)[C@@H]1CCc2ccccc21)N(C)C ZINC001422227325 1379811113 /nfs/dbraw/zinc/81/11/13/1379811113.db2.gz NFAZUWHMIGMXDK-MOPGFXCFSA-N 1 3 331.504 2.650 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@H+](C)CC[C@H]1CCCC1(F)F)N(C)C ZINC001422232419 1379821731 /nfs/dbraw/zinc/82/17/31/1379821731.db2.gz VNPABGULLFUASI-CVEARBPZSA-N 1 3 347.494 2.788 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@@H+](C)CC[C@H]1CCCC1(F)F)N(C)C ZINC001422232419 1379821736 /nfs/dbraw/zinc/82/17/36/1379821736.db2.gz VNPABGULLFUASI-CVEARBPZSA-N 1 3 347.494 2.788 10 0 EFAEHO C[N@H+](CCC1CCCCC1)C[C@H]1CCCN1C(=O)Cc1c[nH]cn1 ZINC001422238296 1379834707 /nfs/dbraw/zinc/83/47/07/1379834707.db2.gz SPFNQLLLVWXDGR-GOSISDBHSA-N 1 3 332.492 2.845 10 0 EFAEHO C[N@@H+](CCC1CCCCC1)C[C@H]1CCCN1C(=O)Cc1c[nH]cn1 ZINC001422238296 1379834712 /nfs/dbraw/zinc/83/47/12/1379834712.db2.gz SPFNQLLLVWXDGR-GOSISDBHSA-N 1 3 332.492 2.845 10 0 EFAEHO C[N@H+](CCC1CCCCC1)C[C@@H]1CCCN1C(=O)Cc1c[nH]cn1 ZINC001422238299 1379835467 /nfs/dbraw/zinc/83/54/67/1379835467.db2.gz SPFNQLLLVWXDGR-SFHVURJKSA-N 1 3 332.492 2.845 10 0 EFAEHO C[N@@H+](CCC1CCCCC1)C[C@@H]1CCCN1C(=O)Cc1c[nH]cn1 ZINC001422238299 1379835471 /nfs/dbraw/zinc/83/54/71/1379835471.db2.gz SPFNQLLLVWXDGR-SFHVURJKSA-N 1 3 332.492 2.845 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2Cc2cccc(F)c2)C1 ZINC001422248724 1379856897 /nfs/dbraw/zinc/85/68/97/1379856897.db2.gz PFKIPXFDOGHKCJ-HKUYNNGSSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001422248724 1379856903 /nfs/dbraw/zinc/85/69/03/1379856903.db2.gz PFKIPXFDOGHKCJ-HKUYNNGSSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2CCc2cccs2)C1 ZINC001422248551 1379856928 /nfs/dbraw/zinc/85/69/28/1379856928.db2.gz OUJNMFPRJKQPMB-FUHWJXTLSA-N 1 3 349.544 2.554 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2CCc2cccs2)C1 ZINC001422248551 1379856933 /nfs/dbraw/zinc/85/69/33/1379856933.db2.gz OUJNMFPRJKQPMB-FUHWJXTLSA-N 1 3 349.544 2.554 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC1CC(NC(=O)C2(N(C)C)CCC2)C1 ZINC001422270045 1379887348 /nfs/dbraw/zinc/88/73/48/1379887348.db2.gz YCYOSZWXRFOFON-UHFFFAOYSA-N 1 3 343.515 2.772 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@H]2C[NH2+]CC2CC3(CCC3)C2)CCC1 ZINC001422278553 1379893801 /nfs/dbraw/zinc/89/38/01/1379893801.db2.gz NYUQPVNYIFNZTJ-ROUUACIJSA-N 1 3 347.547 2.926 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001438481743 1388635387 /nfs/dbraw/zinc/63/53/87/1388635387.db2.gz LBEOMFHWKQRLJW-LPHOPBHVSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)c1cccc(CN[C@@H](C)[C@H](C)NC(=O)C2CC[NH+](C)CC2)n1 ZINC001422397882 1380036717 /nfs/dbraw/zinc/03/67/17/1380036717.db2.gz YPNGIVQETRBXNX-HOTGVXAUSA-N 1 3 346.519 2.530 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCN2C(C)C)cc1C ZINC001422491659 1380193078 /nfs/dbraw/zinc/19/30/78/1380193078.db2.gz BZTYCSYQTPRHLS-MJGOQNOKSA-N 1 3 331.504 2.771 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+][C@@H]1CCc2c1cccc2Cl)N(C)C ZINC001422509165 1380223545 /nfs/dbraw/zinc/22/35/45/1380223545.db2.gz XOIFZYUVQXVKPJ-CSMYWGQOSA-N 1 3 337.895 2.762 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001422521185 1380246950 /nfs/dbraw/zinc/24/69/50/1380246950.db2.gz FJQHWFRFWMXIOD-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001422521185 1380246952 /nfs/dbraw/zinc/24/69/52/1380246952.db2.gz FJQHWFRFWMXIOD-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1 ZINC001422529240 1380261394 /nfs/dbraw/zinc/26/13/94/1380261394.db2.gz MBQGJCJJNUEHRF-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1 ZINC001422529240 1380261397 /nfs/dbraw/zinc/26/13/97/1380261397.db2.gz MBQGJCJJNUEHRF-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]CC1CC2(CCC2)C1 ZINC001438522679 1388654710 /nfs/dbraw/zinc/65/47/10/1388654710.db2.gz SLNVUWCFRPWIRZ-INIZCTEOSA-N 1 3 335.536 2.783 10 0 EFAEHO C[C@@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)N(C)Cc1ccc(Cl)cc1 ZINC001422581308 1380361783 /nfs/dbraw/zinc/36/17/83/1380361783.db2.gz SWGNQALIOXXZLK-GOEBONIOSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(Cl)cc1 ZINC001422581308 1380361786 /nfs/dbraw/zinc/36/17/86/1380361786.db2.gz SWGNQALIOXXZLK-GOEBONIOSA-N 1 3 337.895 2.618 10 0 EFAEHO Cc1cc(Cl)ccc1C[N@@H+](C)[C@H](C)CNC(=O)CN(C)C(C)C ZINC001422597436 1380398045 /nfs/dbraw/zinc/39/80/45/1380398045.db2.gz FUPYZUGNEJPEOR-OAHLLOKOSA-N 1 3 339.911 2.925 10 0 EFAEHO Cc1cc(Cl)ccc1C[N@H+](C)[C@H](C)CNC(=O)CN(C)C(C)C ZINC001422597436 1380398046 /nfs/dbraw/zinc/39/80/46/1380398046.db2.gz FUPYZUGNEJPEOR-OAHLLOKOSA-N 1 3 339.911 2.925 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(Cl)s1 ZINC001422616498 1380440826 /nfs/dbraw/zinc/44/08/26/1380440826.db2.gz HMPXQZPGMUKRNY-TZMCWYRMSA-N 1 3 343.924 2.870 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)C[NH2+][C@H](C)c1cc(C)ccc1C ZINC001438538992 1388662986 /nfs/dbraw/zinc/66/29/86/1388662986.db2.gz AUFQRTILHUGQLY-GDBMZVCRSA-N 1 3 342.487 2.981 10 0 EFAEHO CCCC[C@@H](CNCc1ccccc1F)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001422690720 1380607140 /nfs/dbraw/zinc/60/71/40/1380607140.db2.gz PQRVZMRGWUDAKO-IRXDYDNUSA-N 1 3 335.467 2.542 10 0 EFAEHO CCCC[C@@H](CNCc1ccccc1F)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001422690720 1380607141 /nfs/dbraw/zinc/60/71/41/1380607141.db2.gz PQRVZMRGWUDAKO-IRXDYDNUSA-N 1 3 335.467 2.542 10 0 EFAEHO C[C@H](c1ccc2c(c1)CCC2)N1CC([C@H](C)NC(=O)CC[NH+](C)C)C1 ZINC001422736721 1380736107 /nfs/dbraw/zinc/73/61/07/1380736107.db2.gz WQOQETLKCLYEHH-JKSUJKDBSA-N 1 3 343.515 2.625 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@H](C)C1)C1C[NH+](CCC2CCCCC2)C1 ZINC001422755419 1380762448 /nfs/dbraw/zinc/76/24/48/1380762448.db2.gz UJTDSKJOAGNLRS-DLBZAZTESA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1cc(C)cc(CN2CC([C@@H](C)NC(=O)C[C@H]3CC[N@H+](C)C3)C2)c1 ZINC001422755498 1380763950 /nfs/dbraw/zinc/76/39/50/1380763950.db2.gz SCLSOCORUJZNMT-QZTJIDSGSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1cc(C)cc(CN2CC([C@@H](C)NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)c1 ZINC001422755498 1380763955 /nfs/dbraw/zinc/76/39/55/1380763955.db2.gz SCLSOCORUJZNMT-QZTJIDSGSA-N 1 3 343.515 2.582 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@@H]2[C@@H](CNC(=O)[C@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001422825694 1380865357 /nfs/dbraw/zinc/86/53/57/1380865357.db2.gz LZYKFOSJPNECOY-FRYIKTPZSA-N 1 3 349.563 2.981 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@@H]2[C@@H](CNC(=O)[C@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001422825694 1380865361 /nfs/dbraw/zinc/86/53/61/1380865361.db2.gz LZYKFOSJPNECOY-FRYIKTPZSA-N 1 3 349.563 2.981 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@@H]2[C@@H](CNC(=O)[C@@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001422825678 1380865567 /nfs/dbraw/zinc/86/55/67/1380865567.db2.gz LZYKFOSJPNECOY-AFYVEPGGSA-N 1 3 349.563 2.981 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@@H]2[C@@H](CNC(=O)[C@@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001422825678 1380865576 /nfs/dbraw/zinc/86/55/76/1380865576.db2.gz LZYKFOSJPNECOY-AFYVEPGGSA-N 1 3 349.563 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](CC(CC)CC)C[C@@H]2C1 ZINC001422881662 1380996425 /nfs/dbraw/zinc/99/64/25/1380996425.db2.gz SFKORMLYTGQPSN-GBESFXJTSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CC(CC)CC)C[C@@H]2C1 ZINC001422881662 1380996430 /nfs/dbraw/zinc/99/64/30/1380996430.db2.gz SFKORMLYTGQPSN-GBESFXJTSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001422992348 1381173550 /nfs/dbraw/zinc/17/35/50/1381173550.db2.gz CFZDYNMLHQVIDJ-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001422994594 1381176657 /nfs/dbraw/zinc/17/66/57/1381176657.db2.gz NMKRDYLJQMVAEQ-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001423000766 1381186158 /nfs/dbraw/zinc/18/61/58/1381186158.db2.gz LJYJSXDJGAHQPH-MOPGFXCFSA-N 1 3 347.547 2.926 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN(C)C1CCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001423073969 1381305064 /nfs/dbraw/zinc/30/50/64/1381305064.db2.gz CVAIPUYFLWMABB-KXBFYZLASA-N 1 3 329.488 2.595 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N(C)C[C@H](C)NCc2ccsc2)C1 ZINC001423128947 1381401842 /nfs/dbraw/zinc/40/18/42/1381401842.db2.gz VCRSCSLDVMNQMK-RDJZCZTQSA-N 1 3 337.533 2.807 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N(C)C[C@H](C)NCc2ccsc2)C1 ZINC001423128947 1381401847 /nfs/dbraw/zinc/40/18/47/1381401847.db2.gz VCRSCSLDVMNQMK-RDJZCZTQSA-N 1 3 337.533 2.807 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCN1CCCc1ccccc1 ZINC001423129811 1381403976 /nfs/dbraw/zinc/40/39/76/1381403976.db2.gz XIWQLQCSVOJMBH-WOJBJXKFSA-N 1 3 343.515 2.684 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCN1CCCc1ccccc1 ZINC001423129811 1381403982 /nfs/dbraw/zinc/40/39/82/1381403982.db2.gz XIWQLQCSVOJMBH-WOJBJXKFSA-N 1 3 343.515 2.684 10 0 EFAEHO Cc1cc(C)c(CN2CC[C@H]2CNC(=O)C[C@H]2CC[N@@H+](C)C2)c(C)c1 ZINC001423161777 1381475220 /nfs/dbraw/zinc/47/52/20/1381475220.db2.gz BAJUVQVOLNVRSU-MOPGFXCFSA-N 1 3 343.515 2.644 10 0 EFAEHO Cc1cc(C)c(CN2CC[C@H]2CNC(=O)C[C@H]2CC[N@H+](C)C2)c(C)c1 ZINC001423161777 1381475225 /nfs/dbraw/zinc/47/52/25/1381475225.db2.gz BAJUVQVOLNVRSU-MOPGFXCFSA-N 1 3 343.515 2.644 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001438670888 1388728588 /nfs/dbraw/zinc/72/85/88/1388728588.db2.gz TUEQRMACIVZZMX-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001438670888 1388728592 /nfs/dbraw/zinc/72/85/92/1388728592.db2.gz TUEQRMACIVZZMX-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N(C)[C@@H](C)CNCc2ccccc2F)C1 ZINC001438680463 1388735953 /nfs/dbraw/zinc/73/59/53/1388735953.db2.gz JJKMEFYAUNEUQD-WMZOPIPTSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N(C)[C@@H](C)CNCc2ccccc2F)C1 ZINC001438680463 1388735956 /nfs/dbraw/zinc/73/59/56/1388735956.db2.gz JJKMEFYAUNEUQD-WMZOPIPTSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N(C)[C@H](C)CNCc2ccccc2F)C1 ZINC001438680462 1388736294 /nfs/dbraw/zinc/73/62/94/1388736294.db2.gz JJKMEFYAUNEUQD-SJLPKXTDSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N(C)[C@H](C)CNCc2ccccc2F)C1 ZINC001438680462 1388736298 /nfs/dbraw/zinc/73/62/98/1388736298.db2.gz JJKMEFYAUNEUQD-SJLPKXTDSA-N 1 3 349.494 2.884 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001423243707 1381669193 /nfs/dbraw/zinc/66/91/93/1381669193.db2.gz JJHMQFPZTFLSGN-ZWKOTPCHSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001423243707 1381669219 /nfs/dbraw/zinc/66/92/19/1381669219.db2.gz JJHMQFPZTFLSGN-ZWKOTPCHSA-N 1 3 345.462 2.581 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CC[N@H+](CC3CC(C)C3)C2)CC1 ZINC001423318048 1381776670 /nfs/dbraw/zinc/77/66/70/1381776670.db2.gz DRELQYSBEKLNDL-AFMYVXGZSA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CC[N@@H+](CC3CC(C)C3)C2)CC1 ZINC001423318048 1381776676 /nfs/dbraw/zinc/77/66/76/1381776676.db2.gz DRELQYSBEKLNDL-AFMYVXGZSA-N 1 3 349.563 2.933 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H]2C)cc1 ZINC001423332054 1381796067 /nfs/dbraw/zinc/79/60/67/1381796067.db2.gz TWAJGVFOIJPMGL-QFBILLFUSA-N 1 3 331.504 2.668 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)cc1 ZINC001423332059 1381796518 /nfs/dbraw/zinc/79/65/18/1381796518.db2.gz TWAJGVFOIJPMGL-VQIMIIECSA-N 1 3 331.504 2.668 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C/C=C\Cl)CC2CC2)CC1 ZINC001423335537 1381802284 /nfs/dbraw/zinc/80/22/84/1381802284.db2.gz CCUKOYUKAYJKLR-WTKPLQERSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C/C=C\Cl)CC2CC2)CC1 ZINC001423335537 1381802292 /nfs/dbraw/zinc/80/22/92/1381802292.db2.gz CCUKOYUKAYJKLR-WTKPLQERSA-N 1 3 341.927 2.782 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCCC1CCC1 ZINC001423348438 1381823357 /nfs/dbraw/zinc/82/33/57/1381823357.db2.gz DUAIQYQZCFXXQU-KDURUIRLSA-N 1 3 335.536 2.974 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCCC1CCC1 ZINC001423348438 1381823363 /nfs/dbraw/zinc/82/33/63/1381823363.db2.gz DUAIQYQZCFXXQU-KDURUIRLSA-N 1 3 335.536 2.974 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001423362962 1381849382 /nfs/dbraw/zinc/84/93/82/1381849382.db2.gz JDYBHWIMAKSGFE-QUCCMNQESA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001423362962 1381849389 /nfs/dbraw/zinc/84/93/89/1381849389.db2.gz JDYBHWIMAKSGFE-QUCCMNQESA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001423362960 1381849623 /nfs/dbraw/zinc/84/96/23/1381849623.db2.gz JDYBHWIMAKSGFE-ICSRJNTNSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001423362960 1381849628 /nfs/dbraw/zinc/84/96/28/1381849628.db2.gz JDYBHWIMAKSGFE-ICSRJNTNSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]Cc3ccccc3)[C@@H]2C1 ZINC001423366417 1381855395 /nfs/dbraw/zinc/85/53/95/1381855395.db2.gz WWQPADYMGGCQHO-XUVXKRRUSA-N 1 3 343.515 2.744 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@]12CCC[C@@H]1N(Cc1ccsc1)CC2 ZINC001423372273 1381866556 /nfs/dbraw/zinc/86/65/56/1381866556.db2.gz RYKPRNWUSXHINC-FUHWJXTLSA-N 1 3 335.517 2.703 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@]12CCC[C@@H]1N(Cc1ccsc1)CC2 ZINC001423372273 1381866566 /nfs/dbraw/zinc/86/65/66/1381866566.db2.gz RYKPRNWUSXHINC-FUHWJXTLSA-N 1 3 335.517 2.703 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(CC[N@H+](CC3CCCCC3)C2)C1 ZINC001423382910 1381884440 /nfs/dbraw/zinc/88/44/40/1381884440.db2.gz VCAAUTZTDIBHIW-FQEVSTJZSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(CC[N@@H+](CC3CCCCC3)C2)C1 ZINC001423382910 1381884443 /nfs/dbraw/zinc/88/44/43/1381884443.db2.gz VCAAUTZTDIBHIW-FQEVSTJZSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N1C[C@@H]([NH2+]CCC(F)(F)F)C(C)(C)C1 ZINC001423398593 1381904968 /nfs/dbraw/zinc/90/49/68/1381904968.db2.gz RWMZBJWHIWGMRP-UONOGXRCSA-N 1 3 349.441 2.638 10 0 EFAEHO CN(CC(=O)N1C[C@H]([NH2+]Cc2ccccc2)C(C)(C)C1)CC(C)(C)C ZINC001423410290 1381919659 /nfs/dbraw/zinc/91/96/59/1381919659.db2.gz ZWMXZEYXCPQSIH-SFHVURJKSA-N 1 3 345.531 2.991 10 0 EFAEHO C[C@@H](NC[C@H]1CCCN1C(=O)CC[NH+](C)C)c1ccc(F)cc1F ZINC001423477080 1381972422 /nfs/dbraw/zinc/97/24/22/1381972422.db2.gz JYSJBCFAVAZEDJ-UKRRQHHQSA-N 1 3 339.430 2.558 10 0 EFAEHO CC[C@H]([NH2+]C[C@@H]1CCCN1C(=O)CN1CCCC1)c1ccccc1 ZINC001423491841 1381982378 /nfs/dbraw/zinc/98/23/78/1381982378.db2.gz RLBGWWGGEFGTLZ-OALUTQOASA-N 1 3 329.488 2.814 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NC2(C)CC[NH+](CC3CC3)CC2)C1 ZINC001423503939 1381993665 /nfs/dbraw/zinc/99/36/65/1381993665.db2.gz ASVHJMPSZGPDDB-LJQANCHMSA-N 1 3 339.499 2.580 10 0 EFAEHO CC[N@@H+]1CCCC[C@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001438715095 1388757986 /nfs/dbraw/zinc/75/79/86/1388757986.db2.gz OTEPENFUSHDBHK-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[N@H+]1CCCC[C@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001438715095 1388757990 /nfs/dbraw/zinc/75/79/90/1388757990.db2.gz OTEPENFUSHDBHK-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[N@@H+]1CCCC[C@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001438715094 1388758207 /nfs/dbraw/zinc/75/82/07/1388758207.db2.gz OTEPENFUSHDBHK-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CC[N@H+]1CCCC[C@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001438715094 1388758209 /nfs/dbraw/zinc/75/82/09/1388758209.db2.gz OTEPENFUSHDBHK-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]CC1CCC(C)(C)CC1 ZINC001438717974 1388760523 /nfs/dbraw/zinc/76/05/23/1388760523.db2.gz WVEBHNDQTYEBIK-INIZCTEOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(CCN(C)[C@@H](C)c1ccccc1)C(=O)[C@@H]1CC[N@H+](C)C1 ZINC001423584167 1382117176 /nfs/dbraw/zinc/11/71/76/1382117176.db2.gz XYOLYVFKEDXIFH-PKOBYXMFSA-N 1 3 331.504 2.868 10 0 EFAEHO CC(C)N(CCN(C)[C@@H](C)c1ccccc1)C(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001423584167 1382117181 /nfs/dbraw/zinc/11/71/81/1382117181.db2.gz XYOLYVFKEDXIFH-PKOBYXMFSA-N 1 3 331.504 2.868 10 0 EFAEHO CC(C)C[NH2+]C[C@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)(C)C ZINC001423601131 1382146190 /nfs/dbraw/zinc/14/61/90/1382146190.db2.gz CPLCLZJJLGKHDD-KXBFYZLASA-N 1 3 343.531 2.975 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C1CC[NH+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001423657077 1382235621 /nfs/dbraw/zinc/23/56/21/1382235621.db2.gz OTXAILGGUPEHLZ-YJBOKZPZSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](C(=O)NCC1(C)CC[NH+](CCCC(C)C)CC1)N(C)C ZINC001423669550 1382256400 /nfs/dbraw/zinc/25/64/00/1382256400.db2.gz WNQLIYPEWGHNGU-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[NH2+]C[C@@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CCCCC1 ZINC001438745227 1388782410 /nfs/dbraw/zinc/78/24/10/1388782410.db2.gz IQWQSTVEJVNVJY-VQIMIIECSA-N 1 3 341.515 2.874 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1F)C2 ZINC001423936144 1382519961 /nfs/dbraw/zinc/51/99/61/1382519961.db2.gz WORKKIOJPIYFGF-SZMVWBNQSA-N 1 3 347.478 2.637 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1F)C2 ZINC001423936144 1382519963 /nfs/dbraw/zinc/51/99/63/1382519963.db2.gz WORKKIOJPIYFGF-SZMVWBNQSA-N 1 3 347.478 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CCCCC1)C2 ZINC001423937786 1382522268 /nfs/dbraw/zinc/52/22/68/1382522268.db2.gz YSQFLSHOXUOMEE-FHWLQOOXSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CC1CCCCC1)C2 ZINC001423937786 1382522274 /nfs/dbraw/zinc/52/22/74/1382522274.db2.gz YSQFLSHOXUOMEE-FHWLQOOXSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H](C)[NH2+]Cc2ccccc2)C1 ZINC001438760683 1388791374 /nfs/dbraw/zinc/79/13/74/1388791374.db2.gz BFGTXSZBKYVPAJ-MJGOQNOKSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H](C)[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001423951133 1382538906 /nfs/dbraw/zinc/53/89/06/1382538906.db2.gz KCNPWELLFZHCEC-IAGOWNOFSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(F)c1 ZINC001424036455 1382650997 /nfs/dbraw/zinc/65/09/97/1382650997.db2.gz AEUPFDJVVFOYHS-RTBURBONSA-N 1 3 347.478 2.733 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(F)c1 ZINC001424036455 1382651002 /nfs/dbraw/zinc/65/10/02/1382651002.db2.gz AEUPFDJVVFOYHS-RTBURBONSA-N 1 3 347.478 2.733 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]2[C@H]1CC[N@@H+]2CCC1CC1)N(CC)CC ZINC001424043464 1382658160 /nfs/dbraw/zinc/65/81/60/1382658160.db2.gz JUBYHQQJYZVXJI-GUDVDZBRSA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]2[C@H]1CC[N@H+]2CCC1CC1)N(CC)CC ZINC001424043464 1382658164 /nfs/dbraw/zinc/65/81/64/1382658164.db2.gz JUBYHQQJYZVXJI-GUDVDZBRSA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)[C@H](C(=O)NCc1ccccc1C[N@H+](C)CC1CC1)N(C)C ZINC001424076568 1382735353 /nfs/dbraw/zinc/73/53/53/1382735353.db2.gz FGOTWXSCUWEJJR-LJQANCHMSA-N 1 3 331.504 2.731 10 0 EFAEHO CC(C)[C@H](C(=O)NCc1ccccc1C[N@@H+](C)CC1CC1)N(C)C ZINC001424076568 1382735354 /nfs/dbraw/zinc/73/53/54/1382735354.db2.gz FGOTWXSCUWEJJR-LJQANCHMSA-N 1 3 331.504 2.731 10 0 EFAEHO CC[C@@H](C(=O)NCc1cccc2c1CC[N@H+](CCC1CC1)C2)N(C)C ZINC001424146867 1382795206 /nfs/dbraw/zinc/79/52/06/1382795206.db2.gz VAMMJAGBKCVORY-FQEVSTJZSA-N 1 3 343.515 2.801 10 0 EFAEHO CC[C@@H](C(=O)NCc1cccc2c1CC[N@@H+](CCC1CC1)C2)N(C)C ZINC001424146867 1382795209 /nfs/dbraw/zinc/79/52/09/1382795209.db2.gz VAMMJAGBKCVORY-FQEVSTJZSA-N 1 3 343.515 2.801 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@H+](CC2CC(C)(C)C2)CC1(C)C ZINC001424510581 1383061855 /nfs/dbraw/zinc/06/18/55/1383061855.db2.gz GTHSIWXHOATHLC-KRWDZBQOSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@@H+](CC2CC(C)(C)C2)CC1(C)C ZINC001424510581 1383061859 /nfs/dbraw/zinc/06/18/59/1383061859.db2.gz GTHSIWXHOATHLC-KRWDZBQOSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccc(CC[N@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001424556407 1383104333 /nfs/dbraw/zinc/10/43/33/1383104333.db2.gz DZKOXMQAODYVBA-QUCCMNQESA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1ccc(CC[N@@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001424556407 1383104338 /nfs/dbraw/zinc/10/43/38/1383104338.db2.gz DZKOXMQAODYVBA-QUCCMNQESA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001424556954 1383105362 /nfs/dbraw/zinc/10/53/62/1383105362.db2.gz GEDLIOWVEQXNRT-HKUYNNGSSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001424556954 1383105364 /nfs/dbraw/zinc/10/53/64/1383105364.db2.gz GEDLIOWVEQXNRT-HKUYNNGSSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001424556955 1383105507 /nfs/dbraw/zinc/10/55/07/1383105507.db2.gz GEDLIOWVEQXNRT-IEBWSBKVSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001424556955 1383105508 /nfs/dbraw/zinc/10/55/08/1383105508.db2.gz GEDLIOWVEQXNRT-IEBWSBKVSA-N 1 3 331.504 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]Cc1cccc(F)c1Cl ZINC001424624600 1383214556 /nfs/dbraw/zinc/21/45/56/1383214556.db2.gz CFKNXKGFLLGRLG-ZDUSSCGKSA-N 1 3 343.874 2.804 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([C@@H]2CC[N@H+](CCC(C)C)C2)C1 ZINC001424696069 1383268737 /nfs/dbraw/zinc/26/87/37/1383268737.db2.gz IHGOGYUGUXUQJF-RBUKOAKNSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([C@@H]2CC[N@@H+](CCC(C)C)C2)C1 ZINC001424696069 1383268741 /nfs/dbraw/zinc/26/87/41/1383268741.db2.gz IHGOGYUGUXUQJF-RBUKOAKNSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCC1 ZINC001438825973 1388842929 /nfs/dbraw/zinc/84/29/29/1388842929.db2.gz GTCMGRMXHBIMCB-QFBILLFUSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCC1 ZINC001438825970 1388843163 /nfs/dbraw/zinc/84/31/63/1388843163.db2.gz GTCMGRMXHBIMCB-LPHOPBHVSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@@H]1CCCN1C(=O)[C@@H](C(C)C)N(C)C ZINC001424703451 1383276234 /nfs/dbraw/zinc/27/62/34/1383276234.db2.gz XGSVJPRCFSNHKS-ZWKOTPCHSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@@H]1CCCN1C(=O)[C@@H](C(C)C)N(C)C ZINC001424703451 1383276238 /nfs/dbraw/zinc/27/62/38/1383276238.db2.gz XGSVJPRCFSNHKS-ZWKOTPCHSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+][C@@H](C)c2cccc(F)c2)C1 ZINC001424735619 1383306677 /nfs/dbraw/zinc/30/66/77/1383306677.db2.gz QSXKMUUDXJCQHY-SYJJWHGVSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+][C@H](C)c2cccc(F)c2)C1 ZINC001424735617 1383306874 /nfs/dbraw/zinc/30/68/74/1383306874.db2.gz QSXKMUUDXJCQHY-KSTDHSDQSA-N 1 3 335.467 2.711 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)[C@@H](C)NC(=O)C23CCC[NH+]2CCC3)c1 ZINC001424786325 1383345639 /nfs/dbraw/zinc/34/56/39/1383345639.db2.gz KIZIXLPHAXLXRL-JKSUJKDBSA-N 1 3 347.478 2.745 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001424805553 1383365363 /nfs/dbraw/zinc/36/53/63/1383365363.db2.gz ULIKMHNDVZVWSN-GJZGRUSLSA-N 1 3 335.467 2.601 10 0 EFAEHO C[C@@H]([NH2+]Cc1cccc(F)c1)[C@H](C)NC(=O)CN(C)CC(C)(C)C ZINC001424807505 1383368465 /nfs/dbraw/zinc/36/84/65/1383368465.db2.gz PEPDJOSIXLICNP-CABCVRRESA-N 1 3 337.483 2.786 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C2CCC([NH2+]CCC(F)(F)F)CC2)C1 ZINC001424854839 1383423422 /nfs/dbraw/zinc/42/34/22/1383423422.db2.gz PYDLINQQMCIQHN-WLYUNCDWSA-N 1 3 349.441 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1C[NH+](Cc2ccccc2C2CC2)C1 ZINC001425259045 1383575768 /nfs/dbraw/zinc/57/57/68/1383575768.db2.gz BQVBOUMPRWYVCL-MRXNPFEDSA-N 1 3 343.515 2.841 10 0 EFAEHO Cc1ccc(C[NH+]2CC([C@H](C)NC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001425260943 1383577307 /nfs/dbraw/zinc/57/73/07/1383577307.db2.gz FMLOPHQURLDCIO-KRWDZBQOSA-N 1 3 331.504 2.580 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)CC(C)(C)C)[C@@H]2C1 ZINC001425361042 1383626089 /nfs/dbraw/zinc/62/60/89/1383626089.db2.gz PCNBXJZFBRNHLI-NNZMDNLPSA-N 1 3 337.552 2.695 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)CC(C)(C)C)[C@@H]2C1 ZINC001425361042 1383626094 /nfs/dbraw/zinc/62/60/94/1383626094.db2.gz PCNBXJZFBRNHLI-NNZMDNLPSA-N 1 3 337.552 2.695 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](CC3CC3)C[C@@H]2C1)CC(C)(C)C ZINC001425378335 1383638114 /nfs/dbraw/zinc/63/81/14/1383638114.db2.gz FBZACDYSCWVFIN-FGTMMUONSA-N 1 3 335.536 2.591 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](CC3CC3)C[C@@H]2C1)CC(C)(C)C ZINC001425378335 1383638120 /nfs/dbraw/zinc/63/81/20/1383638120.db2.gz FBZACDYSCWVFIN-FGTMMUONSA-N 1 3 335.536 2.591 10 0 EFAEHO CN(CC(=O)N1C[C@]2(C)C[N@H+](CC3CC3)C[C@]2(C)C1)CC(C)(C)C ZINC001425380163 1383640472 /nfs/dbraw/zinc/64/04/72/1383640472.db2.gz TVXLMEDWUZFOMF-BGYRXZFFSA-N 1 3 335.536 2.545 10 0 EFAEHO CN(CC(=O)N1C[C@]2(C)C[N@@H+](CC3CC3)C[C@]2(C)C1)CC(C)(C)C ZINC001425380163 1383640479 /nfs/dbraw/zinc/64/04/79/1383640479.db2.gz TVXLMEDWUZFOMF-BGYRXZFFSA-N 1 3 335.536 2.545 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)cs1 ZINC001425424695 1383655327 /nfs/dbraw/zinc/65/53/27/1383655327.db2.gz RCDAVAGFEXGGQY-XIRDDKMYSA-N 1 3 337.533 2.627 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2cc(C)cc(C)c2)C1 ZINC001425426935 1383656984 /nfs/dbraw/zinc/65/69/84/1383656984.db2.gz WOEBGXBYNQYDEW-WGSAOQKQSA-N 1 3 331.504 2.630 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H](C2CC2)N(C)C(=O)CN(C)C(C)C)c1 ZINC001425510454 1383675178 /nfs/dbraw/zinc/67/51/78/1383675178.db2.gz PMWKAWCWMAHZEH-IBGZPJMESA-N 1 3 331.504 2.662 10 0 EFAEHO Cc1cccnc1CN[C@@H](C)CN(C)C(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC001425642398 1383731753 /nfs/dbraw/zinc/73/17/53/1383731753.db2.gz PWRAYMSAKDEOCE-ZWKOTPCHSA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@H]1[C@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)CCCN1CCCF ZINC001425919452 1383855850 /nfs/dbraw/zinc/85/58/50/1383855850.db2.gz AWKPIYCHIXKHKY-DOTOQJQBSA-N 1 3 341.515 2.968 10 0 EFAEHO C[C@H]1[C@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)CCCN1CCCF ZINC001425919452 1383855852 /nfs/dbraw/zinc/85/58/52/1383855852.db2.gz AWKPIYCHIXKHKY-DOTOQJQBSA-N 1 3 341.515 2.968 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)CCN(C(=O)[C@H]2CCCN2C)C(C)C)cc1 ZINC001426112321 1383994811 /nfs/dbraw/zinc/99/48/11/1383994811.db2.gz QLZSJRAQZJBPSL-HXUWFJFHSA-N 1 3 345.531 2.801 10 0 EFAEHO Cc1ccc(CC[N@H+](C)CCN(C(=O)[C@H]2CCCN2C)C(C)C)cc1 ZINC001426112321 1383994815 /nfs/dbraw/zinc/99/48/15/1383994815.db2.gz QLZSJRAQZJBPSL-HXUWFJFHSA-N 1 3 345.531 2.801 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C1CC[NH+](Cc2ccccc2)CC1)N(C)C ZINC001426187950 1384054867 /nfs/dbraw/zinc/05/48/67/1384054867.db2.gz VLCHFJHBXPTQQH-APWZRJJASA-N 1 3 331.504 2.744 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCc1ccc(C[NH2+]CC2CC2)cc1F ZINC001426251233 1384094768 /nfs/dbraw/zinc/09/47/68/1384094768.db2.gz FIOIBJIVAFKVDH-HUUCEWRRSA-N 1 3 347.478 2.814 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCN(C)C(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001438900280 1388902652 /nfs/dbraw/zinc/90/26/52/1388902652.db2.gz ATDXOBRPNVPGBQ-OALUTQOASA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCN(C)C(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001438900280 1388902657 /nfs/dbraw/zinc/90/26/57/1388902657.db2.gz ATDXOBRPNVPGBQ-OALUTQOASA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCN(C)C(=O)C[C@H]2CC[N@H+](C)C2)c1 ZINC001438932584 1388934572 /nfs/dbraw/zinc/93/45/72/1388934572.db2.gz RNFIBLZKWSALDE-GOSISDBHSA-N 1 3 331.504 2.535 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCN(C)C(=O)C[C@H]2CC[N@@H+](C)C2)c1 ZINC001438932584 1388934576 /nfs/dbraw/zinc/93/45/76/1388934576.db2.gz RNFIBLZKWSALDE-GOSISDBHSA-N 1 3 331.504 2.535 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001438940367 1388940028 /nfs/dbraw/zinc/94/00/28/1388940028.db2.gz YDYNKZPNWKBEDY-SFHVURJKSA-N 1 3 345.531 2.522 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001438940367 1388940032 /nfs/dbraw/zinc/94/00/32/1388940032.db2.gz YDYNKZPNWKBEDY-SFHVURJKSA-N 1 3 345.531 2.522 10 0 EFAEHO CN(CC[N@H+](C)[C@H]1CCc2ccc(Cl)cc21)C(=O)CN1CCCC1 ZINC001438940388 1388940345 /nfs/dbraw/zinc/94/03/45/1388940345.db2.gz YCWQSYJOIIXMBN-SFHVURJKSA-N 1 3 349.906 2.813 10 0 EFAEHO CN(CC[N@@H+](C)[C@H]1CCc2ccc(Cl)cc21)C(=O)CN1CCCC1 ZINC001438940388 1388940349 /nfs/dbraw/zinc/94/03/49/1388940349.db2.gz YCWQSYJOIIXMBN-SFHVURJKSA-N 1 3 349.906 2.813 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H]2CCC[C@@H]2NC(=O)CN(C)C(C)C)c1 ZINC001438966165 1388955895 /nfs/dbraw/zinc/95/58/95/1388955895.db2.gz REQAAPPGECDLSM-APWZRJJASA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CC[C@@H](CC(C)(C)C)C1 ZINC001427990823 1385237871 /nfs/dbraw/zinc/23/78/71/1385237871.db2.gz JTTLUCPXXUEGCH-IRXDYDNUSA-N 1 3 340.556 2.726 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CC[C@@H](CC(C)(C)C)C1 ZINC001427990823 1385237879 /nfs/dbraw/zinc/23/78/79/1385237879.db2.gz JTTLUCPXXUEGCH-IRXDYDNUSA-N 1 3 340.556 2.726 10 0 EFAEHO CC1(C)CN(Cc2ccccc2)C[C@H]1NC(=O)CCC[NH+]1CCCC1 ZINC001506752519 1406255495 /nfs/dbraw/zinc/25/54/95/1406255495.db2.gz IYWNFRDRFJLQSW-LJQANCHMSA-N 1 3 343.515 2.889 10 0 EFAEHO CC[N@H+](C)[C@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)C1 ZINC001434425130 1387145619 /nfs/dbraw/zinc/14/56/19/1387145619.db2.gz YUWJZHPKTRJNJC-HKUYNNGSSA-N 1 3 347.478 2.590 10 0 EFAEHO CC[N@@H+](C)[C@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)C1 ZINC001434425130 1387145621 /nfs/dbraw/zinc/14/56/21/1387145621.db2.gz YUWJZHPKTRJNJC-HKUYNNGSSA-N 1 3 347.478 2.590 10 0 EFAEHO CC[N@H+](C)[C@@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)C1 ZINC001434425131 1387145933 /nfs/dbraw/zinc/14/59/33/1387145933.db2.gz YUWJZHPKTRJNJC-IEBWSBKVSA-N 1 3 347.478 2.590 10 0 EFAEHO CC[N@@H+](C)[C@@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)C1 ZINC001434425131 1387145938 /nfs/dbraw/zinc/14/59/38/1387145938.db2.gz YUWJZHPKTRJNJC-IEBWSBKVSA-N 1 3 347.478 2.590 10 0 EFAEHO C[C@H](CN1CCOCC1)CN1CC[C@@H](C)[N@H+](Cc2ccccc2)CC1 ZINC001434460031 1387162269 /nfs/dbraw/zinc/16/22/69/1387162269.db2.gz YMGOUSNAFMHFBF-VQTJNVASSA-N 1 3 345.531 2.551 10 0 EFAEHO C[C@H](CN1CCOCC1)CN1CC[C@@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC001434460031 1387162275 /nfs/dbraw/zinc/16/22/75/1387162275.db2.gz YMGOUSNAFMHFBF-VQTJNVASSA-N 1 3 345.531 2.551 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccsc1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001439251888 1389074545 /nfs/dbraw/zinc/07/45/45/1389074545.db2.gz HLHOCRXMPUJWQN-GUYCJALGSA-N 1 3 341.496 2.555 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCCN2C(C)C)cc1 ZINC001439257626 1389078065 /nfs/dbraw/zinc/07/80/65/1389078065.db2.gz MUCJTMNXWVARJK-HKUYNNGSSA-N 1 3 331.504 2.852 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@H]2CCCCN2CC)cc1 ZINC001439283645 1389095347 /nfs/dbraw/zinc/09/53/47/1389095347.db2.gz DYSLNIBWBOWUOB-QFBILLFUSA-N 1 3 331.504 2.718 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3nc[nH]c3C)C[C@@H]2C1 ZINC001506860188 1406356144 /nfs/dbraw/zinc/35/61/44/1406356144.db2.gz VVZMDSXKNINZHK-ROISDPOOSA-N 1 3 344.503 2.834 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3nc[nH]c3C)C[C@@H]2C1 ZINC001506860188 1406356154 /nfs/dbraw/zinc/35/61/54/1406356154.db2.gz VVZMDSXKNINZHK-ROISDPOOSA-N 1 3 344.503 2.834 10 0 EFAEHO C[C@H](C[N@H+](C)CC[C@H]1CCCC1(F)F)NC(=O)CN(C)C1CCC1 ZINC001439331347 1389148519 /nfs/dbraw/zinc/14/85/19/1389148519.db2.gz LOEZARFGJAYSSN-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C[N@@H+](C)CC[C@H]1CCCC1(F)F)NC(=O)CN(C)C1CCC1 ZINC001439331347 1389148524 /nfs/dbraw/zinc/14/85/24/1389148524.db2.gz LOEZARFGJAYSSN-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CN(C)[C@H](C)c1cccc(Cl)c1)NC(=O)C12CC[NH+](CC1)C2 ZINC001439393982 1389231875 /nfs/dbraw/zinc/23/18/75/1389231875.db2.gz APOJVTOGMREJLP-HUUCEWRRSA-N 1 3 349.906 2.933 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)Cc1ccc(CF)cc1 ZINC001439400823 1389245569 /nfs/dbraw/zinc/24/55/69/1389245569.db2.gz BKRLHTWLXBFECX-VQIMIIECSA-N 1 3 349.494 2.967 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)Cc1ccc(CF)cc1 ZINC001439400823 1389245575 /nfs/dbraw/zinc/24/55/75/1389245575.db2.gz BKRLHTWLXBFECX-VQIMIIECSA-N 1 3 349.494 2.967 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC001439403325 1389251315 /nfs/dbraw/zinc/25/13/15/1389251315.db2.gz GKWWNHOWSGALTJ-RDTXWAMCSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC001439403325 1389251325 /nfs/dbraw/zinc/25/13/25/1389251325.db2.gz GKWWNHOWSGALTJ-RDTXWAMCSA-N 1 3 335.467 2.590 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1csc(C)c1)C2 ZINC001440106673 1389389150 /nfs/dbraw/zinc/38/91/50/1389389150.db2.gz FKUVLZDOUAPGQZ-SZMVWBNQSA-N 1 3 349.544 2.867 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1csc(C)c1)C2 ZINC001440106673 1389389154 /nfs/dbraw/zinc/38/91/54/1389389154.db2.gz FKUVLZDOUAPGQZ-SZMVWBNQSA-N 1 3 349.544 2.867 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CC(C)(C)C1)C2 ZINC001440112900 1389391756 /nfs/dbraw/zinc/39/17/56/1389391756.db2.gz QXRDXYGKAOEPIU-JQHSSLGASA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CC1CC(C)(C)C1)C2 ZINC001440112900 1389391758 /nfs/dbraw/zinc/39/17/58/1389391758.db2.gz QXRDXYGKAOEPIU-JQHSSLGASA-N 1 3 335.536 2.734 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001506866215 1406374744 /nfs/dbraw/zinc/37/47/44/1406374744.db2.gz RUHHRWWETDVGBS-XDXAGZTOSA-N 1 3 333.520 2.609 10 0 EFAEHO CC/C=C\CC[N@H+]1CCCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001506866215 1406374750 /nfs/dbraw/zinc/37/47/50/1406374750.db2.gz RUHHRWWETDVGBS-XDXAGZTOSA-N 1 3 333.520 2.609 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001440136473 1389406215 /nfs/dbraw/zinc/40/62/15/1389406215.db2.gz NROKLZBBVPSRCN-MJGOQNOKSA-N 1 3 349.563 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2ccccc2CC)C1 ZINC001440135720 1389406228 /nfs/dbraw/zinc/40/62/28/1389406228.db2.gz LMYUWIZHXUKNRP-XLIONFOSSA-N 1 3 345.531 2.775 10 0 EFAEHO CCc1ccccc1CN1CC[C@@H]1CN(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001440265055 1389488167 /nfs/dbraw/zinc/48/81/67/1389488167.db2.gz OMUBLLPWFPEQSL-FXAWDEMLSA-N 1 3 343.515 2.624 10 0 EFAEHO CCc1ccccc1CN1CC[C@@H]1CN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001440265055 1389488170 /nfs/dbraw/zinc/48/81/70/1389488170.db2.gz OMUBLLPWFPEQSL-FXAWDEMLSA-N 1 3 343.515 2.624 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NC[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001440314213 1389526516 /nfs/dbraw/zinc/52/65/16/1389526516.db2.gz RRTZOOOTDMZNFD-SYQHCUMBSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+][C@H](C)c2cccc(F)c2)C1 ZINC001440315236 1389527121 /nfs/dbraw/zinc/52/71/21/1389527121.db2.gz CXISNFKWOFNJAG-RKVPGOIHSA-N 1 3 335.467 2.711 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1(NCc2cc3ccccc3o2)CCC1 ZINC001440330424 1389540035 /nfs/dbraw/zinc/54/00/35/1389540035.db2.gz CZJKZARQDIGXSE-UHFFFAOYSA-N 1 3 329.444 2.513 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1([NH2+]CC2CCC3(CC3)CC2)CCC1 ZINC001440353130 1389557734 /nfs/dbraw/zinc/55/77/34/1389557734.db2.gz BTJHASRSXZOBHE-UHFFFAOYSA-N 1 3 344.503 2.860 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)C1 ZINC001440361604 1389566543 /nfs/dbraw/zinc/56/65/43/1389566543.db2.gz IBJQWAVGZUHFDJ-BZUAXINKSA-N 1 3 345.478 2.637 10 0 EFAEHO C[C@@H](N[C@H]1C[C@H](CNC(=O)C[C@H]2CC[N@H+](C)C2)C1)c1ccccc1F ZINC001440363488 1389568899 /nfs/dbraw/zinc/56/88/99/1389568899.db2.gz HPKLXCSHJPTPLT-QBPKDAKJSA-N 1 3 347.478 2.713 10 0 EFAEHO C[C@@H](N[C@H]1C[C@H](CNC(=O)C[C@H]2CC[N@@H+](C)C2)C1)c1ccccc1F ZINC001440363488 1389568902 /nfs/dbraw/zinc/56/89/02/1389568902.db2.gz HPKLXCSHJPTPLT-QBPKDAKJSA-N 1 3 347.478 2.713 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)CC1 ZINC001440402806 1389601125 /nfs/dbraw/zinc/60/11/25/1389601125.db2.gz LOKGJKITZRSEQC-AZUAARDMSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)CC1 ZINC001440402806 1389601126 /nfs/dbraw/zinc/60/11/26/1389601126.db2.gz LOKGJKITZRSEQC-AZUAARDMSA-N 1 3 343.515 2.985 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001440407964 1389607720 /nfs/dbraw/zinc/60/77/20/1389607720.db2.gz RWDGBSLSTFVNNZ-PKOBYXMFSA-N 1 3 331.504 2.710 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)CCCN(C)C(=O)CN2CCCC2)c1 ZINC001440481786 1389687770 /nfs/dbraw/zinc/68/77/70/1389687770.db2.gz LWYNHPPMEPHEDH-KRWDZBQOSA-N 1 3 347.503 2.632 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)CCCN(C)C(=O)CN2CCCC2)c1 ZINC001440481786 1389687776 /nfs/dbraw/zinc/68/77/76/1389687776.db2.gz LWYNHPPMEPHEDH-KRWDZBQOSA-N 1 3 347.503 2.632 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCCC[C@H]1CN(C)Cc1ccc(F)cc1 ZINC001440522754 1389725915 /nfs/dbraw/zinc/72/59/15/1389725915.db2.gz ZTZJRSXXSGIAIW-IBGZPJMESA-N 1 3 349.494 2.980 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCCC[C@H]1CN(C)Cc1ccc(F)cc1 ZINC001440522754 1389725918 /nfs/dbraw/zinc/72/59/18/1389725918.db2.gz ZTZJRSXXSGIAIW-IBGZPJMESA-N 1 3 349.494 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CCCc2ccccc2)[C@@H](C)C1 ZINC001440654178 1389801906 /nfs/dbraw/zinc/80/19/06/1389801906.db2.gz UQLJNWGJNBDZSV-ICSRJNTNSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CCCc2ccccc2)[C@@H](C)C1 ZINC001440654178 1389801911 /nfs/dbraw/zinc/80/19/11/1389801911.db2.gz UQLJNWGJNBDZSV-ICSRJNTNSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NC1CC(CNC/C(Cl)=C/Cl)C1 ZINC001440751156 1389869696 /nfs/dbraw/zinc/86/96/96/1389869696.db2.gz ASRHJRTZWVQLSF-XDXKWZDDSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NC1CC(CNC/C(Cl)=C/Cl)C1 ZINC001440751156 1389869691 /nfs/dbraw/zinc/86/96/91/1389869691.db2.gz ASRHJRTZWVQLSF-XDXKWZDDSA-N 1 3 348.318 2.663 10 0 EFAEHO Cc1cncc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCCC2)c1 ZINC001440787528 1389896868 /nfs/dbraw/zinc/89/68/68/1389896868.db2.gz MHSSARILTIKZOZ-DLBZAZTESA-N 1 3 346.519 2.637 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]Cc1ccc(CF)cc1 ZINC001440797804 1389904448 /nfs/dbraw/zinc/90/44/48/1389904448.db2.gz MYHQFNJFRGPKKU-GJZGRUSLSA-N 1 3 335.467 2.623 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C1CCC1 ZINC001440802120 1389908192 /nfs/dbraw/zinc/90/81/92/1389908192.db2.gz VDSYPCSMIVIRMB-HUUCEWRRSA-N 1 3 335.467 2.601 10 0 EFAEHO C[C@@H](NCC=C(Cl)Cl)[C@H](C)NC(=O)CC[NH+]1CCCCC1 ZINC001440850486 1389951308 /nfs/dbraw/zinc/95/13/08/1389951308.db2.gz COCJMHLNIDLXQY-OLZOCXBDSA-N 1 3 336.307 2.664 10 0 EFAEHO C[C@@H](NCC=C(Cl)Cl)[C@@H](C)NC(=O)CC[NH+]1CCCCC1 ZINC001440850485 1389951616 /nfs/dbraw/zinc/95/16/16/1389951616.db2.gz COCJMHLNIDLXQY-CHWSQXEVSA-N 1 3 336.307 2.664 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001440853632 1389955140 /nfs/dbraw/zinc/95/51/40/1389955140.db2.gz XIBCKPIJGOQELL-RYUDHWBXSA-N 1 3 342.434 2.569 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[N@H+](C)CCc1cccs1 ZINC001440921956 1390009398 /nfs/dbraw/zinc/00/93/98/1390009398.db2.gz UFIJWBXEBXFCME-WBVHZDCISA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[N@@H+](C)CCc1cccs1 ZINC001440921956 1390009401 /nfs/dbraw/zinc/00/94/01/1390009401.db2.gz UFIJWBXEBXFCME-WBVHZDCISA-N 1 3 337.533 2.600 10 0 EFAEHO CCc1ccccc1CC[N@H+](C)[C@@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001440964810 1390056399 /nfs/dbraw/zinc/05/63/99/1390056399.db2.gz APHXRALRPDKWAQ-MSOLQXFVSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[N@@H+](C)[C@@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001440964810 1390056400 /nfs/dbraw/zinc/05/64/00/1390056400.db2.gz APHXRALRPDKWAQ-MSOLQXFVSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[N@H+](C)[C@@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001440964815 1390056492 /nfs/dbraw/zinc/05/64/92/1390056492.db2.gz APHXRALRPDKWAQ-ROUUACIJSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[N@@H+](C)[C@@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001440964815 1390056497 /nfs/dbraw/zinc/05/64/97/1390056497.db2.gz APHXRALRPDKWAQ-ROUUACIJSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C)CCC[NH2+]CC1CC(F)(F)C1 ZINC001506921141 1406444446 /nfs/dbraw/zinc/44/44/46/1406444446.db2.gz FBTVGCVMSWPHSQ-GOEBONIOSA-N 1 3 345.478 2.779 10 0 EFAEHO CCc1ccccc1C[NH+]1CC([C@@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001441201006 1391177476 /nfs/dbraw/zinc/17/74/76/1391177476.db2.gz FOOLMLZFSAYMPJ-MRXNPFEDSA-N 1 3 331.504 2.526 10 0 EFAEHO CCc1ccccc1C[NH+]1CC([C@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001441201003 1391177802 /nfs/dbraw/zinc/17/78/02/1391177802.db2.gz FOOLMLZFSAYMPJ-INIZCTEOSA-N 1 3 331.504 2.526 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C1CN(Cc2ccccc2)C1)[NH+]1CCCC1 ZINC001441215265 1391187286 /nfs/dbraw/zinc/18/72/86/1391187286.db2.gz UAOBCOZPBHFYSX-PXNSSMCTSA-N 1 3 343.515 2.744 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@H](C)c3cccc(F)c3)C[C@H]21 ZINC001441323934 1391251169 /nfs/dbraw/zinc/25/11/69/1391251169.db2.gz VUWQUNMHZWESBE-AXUOBQJMSA-N 1 3 347.478 2.523 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@H](C)c3cccc(F)c3)C[C@H]21 ZINC001441323934 1391251171 /nfs/dbraw/zinc/25/11/71/1391251171.db2.gz VUWQUNMHZWESBE-AXUOBQJMSA-N 1 3 347.478 2.523 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](CCC(C)(C)C)C[C@@H]2C1 ZINC001441343375 1391261803 /nfs/dbraw/zinc/26/18/03/1391261803.db2.gz UOGRGXZNBJIJMU-FGTMMUONSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](CCC(C)(C)C)C[C@@H]2C1 ZINC001441343375 1391261805 /nfs/dbraw/zinc/26/18/05/1391261805.db2.gz UOGRGXZNBJIJMU-FGTMMUONSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@H]1C[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001441366502 1391267841 /nfs/dbraw/zinc/26/78/41/1391267841.db2.gz RCPIMMBEAGBAAJ-YKTARERQSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccccc1 ZINC001441580407 1391373501 /nfs/dbraw/zinc/37/35/01/1391373501.db2.gz BYDBBRYKKXACJP-IEBWSBKVSA-N 1 3 331.504 2.886 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccccc1 ZINC001441580409 1391374027 /nfs/dbraw/zinc/37/40/27/1391374027.db2.gz BYDBBRYKKXACJP-MJGOQNOKSA-N 1 3 331.504 2.886 10 0 EFAEHO Cc1cc(C[N@H+]2CCC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cs1 ZINC001441584789 1391376308 /nfs/dbraw/zinc/37/63/08/1391376308.db2.gz MKGAAHBPDXDMCY-NVXWUHKLSA-N 1 3 349.544 2.727 10 0 EFAEHO Cc1cc(C[N@@H+]2CCC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cs1 ZINC001441584789 1391376312 /nfs/dbraw/zinc/37/63/12/1391376312.db2.gz MKGAAHBPDXDMCY-NVXWUHKLSA-N 1 3 349.544 2.727 10 0 EFAEHO Cc1cc(C[N@H+]2CCC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)cs1 ZINC001441586305 1391377142 /nfs/dbraw/zinc/37/71/42/1391377142.db2.gz MKGAAHBPDXDMCY-RDJZCZTQSA-N 1 3 349.544 2.727 10 0 EFAEHO Cc1cc(C[N@@H+]2CCC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)cs1 ZINC001441586305 1391377147 /nfs/dbraw/zinc/37/71/47/1391377147.db2.gz MKGAAHBPDXDMCY-RDJZCZTQSA-N 1 3 349.544 2.727 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCCN1CCCF)[NH+]1CCCCC1 ZINC001441633104 1391399139 /nfs/dbraw/zinc/39/91/39/1391399139.db2.gz CAGGVPITBHQJMM-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCC[N@@H+]1CCCF)N1CCCCC1 ZINC001441633104 1391399145 /nfs/dbraw/zinc/39/91/45/1391399145.db2.gz CAGGVPITBHQJMM-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCC[N@H+]1CCCF)N1CCCCC1 ZINC001441633104 1391399150 /nfs/dbraw/zinc/39/91/50/1391399150.db2.gz CAGGVPITBHQJMM-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)[C@@H]1C ZINC001441825381 1391420822 /nfs/dbraw/zinc/42/08/22/1391420822.db2.gz NZPBYFWVAPEYIG-OXJNMPFZSA-N 1 3 343.515 2.985 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc(C)c(C)c2)C(C)(C)C1 ZINC001441929452 1391440560 /nfs/dbraw/zinc/44/05/60/1391440560.db2.gz HDVMPJOBCKVXJT-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(Cl)s1 ZINC001443980868 1391455447 /nfs/dbraw/zinc/45/54/47/1391455447.db2.gz JPTKULKVOKPNCX-OLZOCXBDSA-N 1 3 343.924 2.728 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCC2CCN(C/C=C\Cl)CC2)CC[N@@H+]1C ZINC001444221050 1391463997 /nfs/dbraw/zinc/46/39/97/1391463997.db2.gz MIDFXAADRSUHSN-BIZJKMISSA-N 1 3 341.927 2.688 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCC2CCN(C/C=C\Cl)CC2)CC[N@H+]1C ZINC001444221050 1391464000 /nfs/dbraw/zinc/46/40/00/1391464000.db2.gz MIDFXAADRSUHSN-BIZJKMISSA-N 1 3 341.927 2.688 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC2(C1)CCN(C(=O)Cc1c[nH]cn1)CC2 ZINC001444258795 1391465952 /nfs/dbraw/zinc/46/59/52/1391465952.db2.gz IEOSHQHBUGCYGG-UHFFFAOYSA-N 1 3 332.492 2.703 10 0 EFAEHO CC(C)CCC[N@H+]1CCC2(C1)CCN(C(=O)Cc1c[nH]cn1)CC2 ZINC001444258795 1391465954 /nfs/dbraw/zinc/46/59/54/1391465954.db2.gz IEOSHQHBUGCYGG-UHFFFAOYSA-N 1 3 332.492 2.703 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H](C)C[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001444376170 1391476964 /nfs/dbraw/zinc/47/69/64/1391476964.db2.gz HREADYAEQOZVPE-SJLPKXTDSA-N 1 3 337.552 2.885 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+][C@@H](C)c1cc(F)ccc1F ZINC001444449559 1391492967 /nfs/dbraw/zinc/49/29/67/1391492967.db2.gz UNXJUZOCZXSGLF-KGLIPLIRSA-N 1 3 341.446 2.708 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](NC(=O)C(C)(C)N2CCCC2)C2CC2)cc1 ZINC001445963680 1391545335 /nfs/dbraw/zinc/54/53/35/1391545335.db2.gz VZHMGVPGRNWWSN-IBGZPJMESA-N 1 3 343.515 2.854 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@]1(C)CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001446677839 1391578415 /nfs/dbraw/zinc/57/84/15/1391578415.db2.gz AAWLBCSPTVGGPK-HXUWFJFHSA-N 1 3 346.519 2.915 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@]1(C)CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001446677839 1391578417 /nfs/dbraw/zinc/57/84/17/1391578417.db2.gz AAWLBCSPTVGGPK-HXUWFJFHSA-N 1 3 346.519 2.915 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001446937692 1391640575 /nfs/dbraw/zinc/64/05/75/1391640575.db2.gz FHKMGGMKBUAXAA-FXAWDEMLSA-N 1 3 345.531 2.916 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001446948741 1391644772 /nfs/dbraw/zinc/64/47/72/1391644772.db2.gz SHXJBMKDHCCGRD-IRXDYDNUSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@H]1C[NH2+]CC1CCCC1 ZINC001446973307 1391649464 /nfs/dbraw/zinc/64/94/64/1391649464.db2.gz PNGLJTRNETYJIY-FUHWJXTLSA-N 1 3 337.552 2.839 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)[C@@H](C)NCc1sccc1Cl ZINC001447911435 1391799508 /nfs/dbraw/zinc/79/95/08/1391799508.db2.gz QFRIIOZXGGAALK-VXGBXAGGSA-N 1 3 331.913 2.726 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)[C@@H](C)NCc1sccc1Cl ZINC001447911435 1391799511 /nfs/dbraw/zinc/79/95/11/1391799511.db2.gz QFRIIOZXGGAALK-VXGBXAGGSA-N 1 3 331.913 2.726 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001448036540 1391907339 /nfs/dbraw/zinc/90/73/39/1391907339.db2.gz FIYWPEOHRZHPMD-CRAIPNDOSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001448036540 1391907340 /nfs/dbraw/zinc/90/73/40/1391907340.db2.gz FIYWPEOHRZHPMD-CRAIPNDOSA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)[C@@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001448062104 1391926737 /nfs/dbraw/zinc/92/67/37/1391926737.db2.gz AIUOSHHTQFGHJX-SFHVURJKSA-N 1 3 345.531 2.848 10 0 EFAEHO Cc1ccc(CC[N@H+](C)[C@@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001448062104 1391926740 /nfs/dbraw/zinc/92/67/40/1391926740.db2.gz AIUOSHHTQFGHJX-SFHVURJKSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]CCc1ccccc1 ZINC001448210582 1392016956 /nfs/dbraw/zinc/01/69/56/1392016956.db2.gz JOXNLDGLHGSYRU-PMACEKPBSA-N 1 3 345.531 2.786 10 0 EFAEHO CC[NH2+]CC1(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CCCCC1 ZINC001448222086 1392029880 /nfs/dbraw/zinc/02/98/80/1392029880.db2.gz CMOAGVFDDCXDOG-SFHVURJKSA-N 1 3 327.488 2.628 10 0 EFAEHO CC(C)[C@@H](CCNC(=O)[C@@H]1CCCN1C)[NH2+]C/C(Cl)=C/Cl ZINC001506982437 1406545705 /nfs/dbraw/zinc/54/57/05/1406545705.db2.gz UWGOVTHQINLPPQ-CUSVYIHLSA-N 1 3 336.307 2.520 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H]1C[C@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001449019276 1392210528 /nfs/dbraw/zinc/21/05/28/1392210528.db2.gz PURBBXZWRGSMFE-LPHOPBHVSA-N 1 3 331.504 2.668 10 0 EFAEHO CCc1ccc(CN2CCC[C@@H](NC(=O)CC[NH+](C)C)[C@@H]2C)cc1 ZINC001449042500 1392229294 /nfs/dbraw/zinc/22/92/94/1392229294.db2.gz QIRYRXOLHQWNJT-QFBILLFUSA-N 1 3 331.504 2.670 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H](C[NH2+]Cc2ccc(F)cc2)C1 ZINC001449057859 1392241562 /nfs/dbraw/zinc/24/15/62/1392241562.db2.gz IKRCYAXANIKFSY-FUHWJXTLSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N(C)[C@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001507012839 1406588280 /nfs/dbraw/zinc/58/82/80/1406588280.db2.gz MWZRCSHCOKAESE-RBUKOAKNSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N(C)[C@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001507012842 1406588361 /nfs/dbraw/zinc/58/83/61/1406588361.db2.gz MWZRCSHCOKAESE-RTBURBONSA-N 1 3 335.536 2.876 10 0 EFAEHO CN(CC(=O)N(C)[C@@H](C[NH2+]CC=C(Cl)Cl)C1CC1)C1CCC1 ZINC001507013797 1406589447 /nfs/dbraw/zinc/58/94/47/1406589447.db2.gz ZJHQNQAGBIULRV-AWEZNQCLSA-N 1 3 348.318 2.616 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN(C)C1CCC1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001507088809 1406687098 /nfs/dbraw/zinc/68/70/98/1406687098.db2.gz KSAUTLCHUMVTJL-INIZCTEOSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H](CN(C)C(=O)C12CCC[NH+](CCC1)C2)NCc1ccsc1 ZINC001507089827 1406688382 /nfs/dbraw/zinc/68/83/82/1406688382.db2.gz QIIIUCPPPVQLBY-HNNXBMFYSA-N 1 3 335.517 2.561 10 0 EFAEHO C[C@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001507090972 1406690073 /nfs/dbraw/zinc/69/00/73/1406690073.db2.gz SODORRNHNJTFCX-MRXNPFEDSA-N 1 3 343.515 2.985 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001507126895 1406739302 /nfs/dbraw/zinc/73/93/02/1406739302.db2.gz OPOBFVUMQFMXBB-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)[C@@H](NC(C)C)c1ccc(OC)cc1 ZINC001457952520 1395390527 /nfs/dbraw/zinc/39/05/27/1395390527.db2.gz OPASHRVWFYYEBE-SFHVURJKSA-N 1 3 349.519 2.971 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)[C@@H](NC(C)C)c1ccc(OC)cc1 ZINC001457952520 1395390533 /nfs/dbraw/zinc/39/05/33/1395390533.db2.gz OPASHRVWFYYEBE-SFHVURJKSA-N 1 3 349.519 2.971 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]CCCc1ccccc1 ZINC001507161016 1406790760 /nfs/dbraw/zinc/79/07/60/1406790760.db2.gz HOWXXGAYJWZSGI-UYAOXDASSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C[C@H](C)NCc1ccccc1F)[NH+]1CCCC1 ZINC001507161128 1406790823 /nfs/dbraw/zinc/79/08/23/1406790823.db2.gz ISOFPWROBMKXDE-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO Cc1ccc(CN(CCN(C)C)C(=O)[C@@H]2CCC[C@H]([NH+](C)C)C2)o1 ZINC001464636607 1396592509 /nfs/dbraw/zinc/59/25/09/1396592509.db2.gz MOZWLRLYRQUQQK-SJORKVTESA-N 1 3 335.492 2.599 10 0 EFAEHO CC[C@H]1CCCC[C@H]1CNC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001470351174 1397087265 /nfs/dbraw/zinc/08/72/65/1397087265.db2.gz DUQKFWZFKWHTBN-BZSNNMDCSA-N 1 3 340.556 2.774 10 0 EFAEHO CC[C@H]1CCCC[C@H]1CNC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001470351174 1397087270 /nfs/dbraw/zinc/08/72/70/1397087270.db2.gz DUQKFWZFKWHTBN-BZSNNMDCSA-N 1 3 340.556 2.774 10 0 EFAEHO c1cc2cc(C[NH+]3CCC(N4CCCOCC4)CC3)ccc2cn1 ZINC001473689540 1397321864 /nfs/dbraw/zinc/32/18/64/1397321864.db2.gz IYQKAMNJNCGKRT-UHFFFAOYSA-N 1 3 325.456 2.922 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CC/C=C\c2ccccc2)CN1C(=O)Cc1c[nH]cn1 ZINC001507329272 1406893606 /nfs/dbraw/zinc/89/36/06/1406893606.db2.gz ZUWUWVNJFXILMV-YCIDRVBSSA-N 1 3 338.455 2.635 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1C[C@@H](NCc2ccccc2F)C1 ZINC001479301663 1397672620 /nfs/dbraw/zinc/67/26/20/1397672620.db2.gz TVZJENQJDDURCS-BPQIPLTHSA-N 1 3 347.478 2.685 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1C[C@@H](NCc2ccccc2F)C1 ZINC001479301663 1397672625 /nfs/dbraw/zinc/67/26/25/1397672625.db2.gz TVZJENQJDDURCS-BPQIPLTHSA-N 1 3 347.478 2.685 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@H]2C[C@@H](NCc3ccccc3Cl)C2)C1 ZINC001479336927 1397692195 /nfs/dbraw/zinc/69/21/95/1397692195.db2.gz CUZJZJYYGVDPPN-INMHGKMJSA-N 1 3 349.906 2.666 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@H]2C[C@@H](NCc3ccccc3Cl)C2)C1 ZINC001479336927 1397692200 /nfs/dbraw/zinc/69/22/00/1397692200.db2.gz CUZJZJYYGVDPPN-INMHGKMJSA-N 1 3 349.906 2.666 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC001479346205 1397698262 /nfs/dbraw/zinc/69/82/62/1397698262.db2.gz DKFPWBTWXVGOON-RIVXBTQJSA-N 1 3 347.478 2.683 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CCc2ccccc2)C1 ZINC001479346152 1397698285 /nfs/dbraw/zinc/69/82/85/1397698285.db2.gz DFIFDYQNMUSIJH-LFGUQSLTSA-N 1 3 343.515 2.586 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)C1 ZINC001479347960 1397699335 /nfs/dbraw/zinc/69/93/35/1397699335.db2.gz MLKSKJZSTRPABH-FKSNAJQLSA-N 1 3 329.488 2.524 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc32)C1 ZINC001479407418 1397716757 /nfs/dbraw/zinc/71/67/57/1397716757.db2.gz BZNMJLJIZWBUDA-SZVBFZGTSA-N 1 3 329.488 2.500 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]C[C@H]2CCC(F)(F)C2)C1 ZINC001479489811 1397736016 /nfs/dbraw/zinc/73/60/16/1397736016.db2.gz SZRXHMJIUZZULC-HRCADAONSA-N 1 3 345.478 2.638 10 0 EFAEHO C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)[C@H]1CC[NH2+]CCF ZINC001479520416 1397748127 /nfs/dbraw/zinc/74/81/27/1397748127.db2.gz CEDLLKRTDURFML-HOTGVXAUSA-N 1 3 329.504 2.541 10 0 EFAEHO C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)[C@@H]1CC[NH2+]CCF ZINC001479520418 1397748198 /nfs/dbraw/zinc/74/81/98/1397748198.db2.gz CEDLLKRTDURFML-JKSUJKDBSA-N 1 3 329.504 2.541 10 0 EFAEHO CC[C@H](C)C[N@H+](C)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001479796084 1397874698 /nfs/dbraw/zinc/87/46/98/1397874698.db2.gz BKAQTNKEJBIBDZ-YJBOKZPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001479796084 1397874702 /nfs/dbraw/zinc/87/47/02/1397874702.db2.gz BKAQTNKEJBIBDZ-YJBOKZPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001479846632 1397944300 /nfs/dbraw/zinc/94/43/00/1397944300.db2.gz NMNXWOMUDJMGPH-UXTFUVQESA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001479846632 1397944303 /nfs/dbraw/zinc/94/43/03/1397944303.db2.gz NMNXWOMUDJMGPH-UXTFUVQESA-N 1 3 327.900 2.584 10 0 EFAEHO CC[C@@H](F)CN(CCCNC(=O)C12CCC[NH+](CCC1)C2)C1CC1 ZINC001479871131 1397980682 /nfs/dbraw/zinc/98/06/82/1397980682.db2.gz XKEZHZYARADGJK-MRXNPFEDSA-N 1 3 339.499 2.581 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@H]1CCN(Cc2ccc(CF)cc2)C1 ZINC001479968581 1398055363 /nfs/dbraw/zinc/05/53/63/1398055363.db2.gz FIUDKDINILSAOF-SFHVURJKSA-N 1 3 335.467 2.579 10 0 EFAEHO CC(C)c1ccc(C[NH2+][C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001480173905 1398142982 /nfs/dbraw/zinc/14/29/82/1398142982.db2.gz PBODDHGCHACIDH-WGSAOQKQSA-N 1 3 331.504 2.887 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1C[C@H]([NH2+]C/C=C\c2ccccc2)C1 ZINC001480174676 1398144159 /nfs/dbraw/zinc/14/41/59/1398144159.db2.gz XWDOOCLATZBQPI-GDVWMFRKSA-N 1 3 341.499 2.809 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H]([NH2+]CC/C=C\c2ccccc2)C1)N(C)C ZINC001480623597 1398253768 /nfs/dbraw/zinc/25/37/68/1398253768.db2.gz AUBJLJUCNQIFPB-MYPZJPOHSA-N 1 3 343.515 2.867 10 0 EFAEHO CCCCC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@H]21 ZINC001507358035 1406947216 /nfs/dbraw/zinc/94/72/16/1406947216.db2.gz RKGMGYNEDFKRAL-KZNAEPCWSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[N@H+](C)C1)Cc1ccc(C2CCC2)cc1 ZINC001493058504 1398403558 /nfs/dbraw/zinc/40/35/58/1398403558.db2.gz MQVRNSVKWSSVSR-HXUWFJFHSA-N 1 3 343.515 2.844 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[N@@H+](C)C1)Cc1ccc(C2CCC2)cc1 ZINC001493058504 1398403560 /nfs/dbraw/zinc/40/35/60/1398403560.db2.gz MQVRNSVKWSSVSR-HXUWFJFHSA-N 1 3 343.515 2.844 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@@H+]1CC1CCC1)N1CCCCC1 ZINC001493160802 1398490122 /nfs/dbraw/zinc/49/01/22/1398490122.db2.gz JQZXJVATIIVLTQ-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@H+]1CC1CCC1)N1CCCCC1 ZINC001493160802 1398490126 /nfs/dbraw/zinc/49/01/26/1398490126.db2.gz JQZXJVATIIVLTQ-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](F)CN1CC[C@@H](CNC(=O)C2(C[NH+](C)C)CCCCC2)C1 ZINC001493223676 1398544208 /nfs/dbraw/zinc/54/42/08/1398544208.db2.gz OGQRVPCFFBKVFV-DLBZAZTESA-N 1 3 341.515 2.685 10 0 EFAEHO Cc1cc(C)cc(C[N@H+]2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001493238457 1398554571 /nfs/dbraw/zinc/55/45/71/1398554571.db2.gz WKOOJOPQQLDWBA-VQIMIIECSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+]2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001493238457 1398554574 /nfs/dbraw/zinc/55/45/74/1398554574.db2.gz WKOOJOPQQLDWBA-VQIMIIECSA-N 1 3 343.515 2.583 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CC[N@H+](CC3CCC(C)(C)CC3)C2)C1 ZINC001493240996 1398557662 /nfs/dbraw/zinc/55/76/62/1398557662.db2.gz YEWOLLLIQNKARR-HKUYNNGSSA-N 1 3 349.563 2.983 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CC[N@@H+](CC3CCC(C)(C)CC3)C2)C1 ZINC001493240996 1398557665 /nfs/dbraw/zinc/55/76/65/1398557665.db2.gz YEWOLLLIQNKARR-HKUYNNGSSA-N 1 3 349.563 2.983 10 0 EFAEHO CCC[N@H+](CCNC(=O)Cc1nc[nH]c1C)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001493331799 1398620465 /nfs/dbraw/zinc/62/04/65/1398620465.db2.gz WGRNQZDNJKFGPW-ZACQAIPSSA-N 1 3 332.492 2.525 10 0 EFAEHO CCC[N@@H+](CCNC(=O)Cc1nc[nH]c1C)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001493331799 1398620471 /nfs/dbraw/zinc/62/04/71/1398620471.db2.gz WGRNQZDNJKFGPW-ZACQAIPSSA-N 1 3 332.492 2.525 10 0 EFAEHO CN(CC[NH2+][C@@H]1CCc2ccc(Cl)cc21)C(=O)CN(C)C1CCC1 ZINC001493581751 1398761624 /nfs/dbraw/zinc/76/16/24/1398761624.db2.gz ZJGSLNXPNIOLPC-GOSISDBHSA-N 1 3 349.906 2.860 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[NH2+]Cc1cccc2ccccc21)N(C)C ZINC001493589698 1398764616 /nfs/dbraw/zinc/76/46/16/1398764616.db2.gz GXRJCAXXHFZKJT-LJQANCHMSA-N 1 3 327.472 2.728 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H](C)[NH2+]CCc2ccccc2)CC1 ZINC001493849780 1398921654 /nfs/dbraw/zinc/92/16/54/1398921654.db2.gz KFHOIKAYCMBDCU-GOSISDBHSA-N 1 3 345.531 2.786 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]([NH2+]CC2CCCC2)c2ccccc2)C1 ZINC001493900647 1398964988 /nfs/dbraw/zinc/96/49/88/1398964988.db2.gz ZALUTLFCFZLSLB-XLIONFOSSA-N 1 3 343.515 2.966 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]([NH2+]CC2CCCC2)c2ccccc2)C1 ZINC001493900645 1398965270 /nfs/dbraw/zinc/96/52/70/1398965270.db2.gz ZALUTLFCFZLSLB-PXNSSMCTSA-N 1 3 343.515 2.966 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@H]2CC[N@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001494056350 1399095841 /nfs/dbraw/zinc/09/58/41/1399095841.db2.gz VPMZCPGWDOSOFA-ROUUACIJSA-N 1 3 347.547 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@H]2CC[N@@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001494056350 1399095842 /nfs/dbraw/zinc/09/58/42/1399095842.db2.gz VPMZCPGWDOSOFA-ROUUACIJSA-N 1 3 347.547 2.737 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N1CC[C@H](CN(C)C/C=C\Cl)C1 ZINC001494141932 1399163313 /nfs/dbraw/zinc/16/33/13/1399163313.db2.gz PVAFSRWWRUZLMW-LVXHKSIOSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N1CC[C@H](CN(C)C/C=C\Cl)C1 ZINC001494141932 1399163318 /nfs/dbraw/zinc/16/33/18/1399163318.db2.gz PVAFSRWWRUZLMW-LVXHKSIOSA-N 1 3 341.927 2.640 10 0 EFAEHO Cc1ccc(F)c(CN(C)CC2CCN(C(=O)CC[NH+](C)C)CC2)c1 ZINC001494206087 1399212355 /nfs/dbraw/zinc/21/23/55/1399212355.db2.gz JNDZNKKXELRUBA-UHFFFAOYSA-N 1 3 349.494 2.756 10 0 EFAEHO Cc1cc(C)c(C[NH+]2CC(CNC(=O)C3(N(C)C)CCC3)C2)c(C)c1 ZINC001494558123 1399377877 /nfs/dbraw/zinc/37/78/77/1399377877.db2.gz AIBWYSIXPQRBLV-UHFFFAOYSA-N 1 3 343.515 2.644 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CC[C@H](C[NH2+]CCCC2CCC2)C1 ZINC001507418145 1407032770 /nfs/dbraw/zinc/03/27/70/1407032770.db2.gz BSYUPUMXVOZXIM-DLBZAZTESA-N 1 3 332.492 2.715 10 0 EFAEHO CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@H+](CC(C)C)C1 ZINC001494909990 1399549375 /nfs/dbraw/zinc/54/93/75/1399549375.db2.gz JWZODDLKQQBVFG-LPHOPBHVSA-N 1 3 341.515 2.778 10 0 EFAEHO CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@@H+](CC(C)C)C1 ZINC001494909990 1399549379 /nfs/dbraw/zinc/54/93/79/1399549379.db2.gz JWZODDLKQQBVFG-LPHOPBHVSA-N 1 3 341.515 2.778 10 0 EFAEHO CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@H+](CC2CC2)C1 ZINC001494911632 1399550408 /nfs/dbraw/zinc/55/04/08/1399550408.db2.gz WOWVRRCHMGILCG-QFBILLFUSA-N 1 3 339.499 2.532 10 0 EFAEHO CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@@H+](CC2CC2)C1 ZINC001494911632 1399550413 /nfs/dbraw/zinc/55/04/13/1399550413.db2.gz WOWVRRCHMGILCG-QFBILLFUSA-N 1 3 339.499 2.532 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001494911624 1399550742 /nfs/dbraw/zinc/55/07/42/1399550742.db2.gz WIFCHIIGFYIUOZ-FQEVSTJZSA-N 1 3 343.515 2.939 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)[NH+]1CCCC1)NCc1ccccc1F ZINC001495033180 1399614666 /nfs/dbraw/zinc/61/46/66/1399614666.db2.gz BAEUXGXGBNNFNI-INIZCTEOSA-N 1 3 335.467 2.685 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001507428327 1407042013 /nfs/dbraw/zinc/04/20/13/1407042013.db2.gz OSMNGBUSDDMBQQ-VQTJNVASSA-N 1 3 345.531 2.752 10 0 EFAEHO CCCCC[NH2+][C@@H](CC)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001495057262 1399632669 /nfs/dbraw/zinc/63/26/69/1399632669.db2.gz FDOUFOGDZGJYMV-YJBOKZPZSA-N 1 3 329.504 2.874 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C[NH2+]CC=C(Cl)Cl)CCCC1 ZINC001495212472 1399741068 /nfs/dbraw/zinc/74/10/68/1399741068.db2.gz USVWBARIMGQFKV-UHFFFAOYSA-N 1 3 336.307 2.664 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@](C)(C[NH2+]CC2=CCCCC2)C2CC2)C1 ZINC001495278538 1399787875 /nfs/dbraw/zinc/78/78/75/1399787875.db2.gz WHTIFCKWHXGDRU-OXJNMPFZSA-N 1 3 333.520 2.703 10 0 EFAEHO CCCN(C)CC(=O)N[C@@](C)(C[NH2+][C@@H]1CCc2ccccc21)C1CC1 ZINC001495298925 1399806962 /nfs/dbraw/zinc/80/69/62/1399806962.db2.gz QOMMNERRVRRIHW-CTNGQTDRSA-N 1 3 343.515 2.890 10 0 EFAEHO CC[C@H](C(=O)N1C[C@@H](NCc2ccccn2)C(C)(C)C1)[NH+](CC)CC ZINC001507446236 1407062555 /nfs/dbraw/zinc/06/25/55/1407062555.db2.gz QWLWKPWREPHKSD-QZTJIDSGSA-N 1 3 346.519 2.529 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](CC[NH2+]Cc2cccc(F)c2)C1)N(C)C ZINC001495359486 1399903853 /nfs/dbraw/zinc/90/38/53/1399903853.db2.gz KUBJMKXFRNRARN-QFBILLFUSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](CC[NH2+]CCC(C)(C)C)C1)N(C)C ZINC001495360134 1399904372 /nfs/dbraw/zinc/90/43/72/1399904372.db2.gz RBFGDHHBXBPOCP-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N2C[C@@H](NC/C=C\Cl)C(C)(C)C2)CC1 ZINC001507449904 1407066675 /nfs/dbraw/zinc/06/66/75/1407066675.db2.gz NFZUWRZCQMVBCS-KQQSKNTNSA-N 1 3 341.927 2.686 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1C[C@H](NCc2cc(C)ccc2F)C(C)(C)C1 ZINC001507449672 1407066979 /nfs/dbraw/zinc/06/69/79/1407066979.db2.gz JCGCGAMSFXTDAA-SFHVURJKSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1C[C@H](NCc2cc(C)ccc2F)C(C)(C)C1 ZINC001507449672 1407066983 /nfs/dbraw/zinc/06/69/83/1407066983.db2.gz JCGCGAMSFXTDAA-SFHVURJKSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](CC[NH2+]Cc2ccccc2)C1 ZINC001495393517 1399939141 /nfs/dbraw/zinc/93/91/41/1399939141.db2.gz PLGARKZRJORMKZ-IBGZPJMESA-N 1 3 331.504 2.745 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc(F)cc2C)C(C)(C)C1 ZINC001507451342 1407069170 /nfs/dbraw/zinc/06/91/70/1407069170.db2.gz PMSRSFNYWVXGNY-SFHVURJKSA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@H](CNC/C(Cl)=C/Cl)CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001495681054 1400161588 /nfs/dbraw/zinc/16/15/88/1400161588.db2.gz DWIHHJNXISHLDF-LRZCHELBSA-N 1 3 336.307 2.522 10 0 EFAEHO C[C@H](CNC/C(Cl)=C/Cl)CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001495681054 1400161592 /nfs/dbraw/zinc/16/15/92/1400161592.db2.gz DWIHHJNXISHLDF-LRZCHELBSA-N 1 3 336.307 2.522 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)C[NH2+]Cc1cc(C)ccc1F ZINC001495680799 1400161796 /nfs/dbraw/zinc/16/17/96/1400161796.db2.gz RLUTVPGHLKGFDT-APWZRJJASA-N 1 3 349.494 2.850 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C[C@H](C)CNC(=O)C2(N(C)C)CCC2)c1 ZINC001495685862 1400166710 /nfs/dbraw/zinc/16/67/10/1400166710.db2.gz XISOSZAJSIBRTA-JKSUJKDBSA-N 1 3 347.503 2.582 10 0 EFAEHO C[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C[NH2+]CC1CCCC1 ZINC001495744579 1400219797 /nfs/dbraw/zinc/21/97/97/1400219797.db2.gz XMYAEAJDZMYOIE-DNVCBOLYSA-N 1 3 341.515 2.731 10 0 EFAEHO C[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C[NH2+]CC1CCCC1 ZINC001495744588 1400220160 /nfs/dbraw/zinc/22/01/60/1400220160.db2.gz XMYAEAJDZMYOIE-KXBFYZLASA-N 1 3 341.515 2.731 10 0 EFAEHO CCC/C=C\CC[NH+]1CC2(C1)CCN(C(=O)[C@@H]1CCCN1C)CC2 ZINC001495968046 1400388851 /nfs/dbraw/zinc/38/88/51/1400388851.db2.gz APDXYUQNZACRHO-XFHJGTJQSA-N 1 3 333.520 2.751 10 0 EFAEHO C[C@H](C[NH2+]CC1CCC2(CC2)CC1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001496156470 1400507609 /nfs/dbraw/zinc/50/76/09/1400507609.db2.gz YZDRTYGGQIPIBD-IAGOWNOFSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](C)N(C)C(=O)[C@@H]1CC[N@H+](C)C1 ZINC001496230378 1400557273 /nfs/dbraw/zinc/55/72/73/1400557273.db2.gz VKTXNWCJJBSXSG-HUUCEWRRSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](C)N(C)C(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001496230378 1400557276 /nfs/dbraw/zinc/55/72/76/1400557276.db2.gz VKTXNWCJJBSXSG-HUUCEWRRSA-N 1 3 337.895 2.537 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]CCCc1ccccc1 ZINC001496248107 1400570336 /nfs/dbraw/zinc/57/03/36/1400570336.db2.gz JQORQCTXHXILOJ-ICSRJNTNSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)C[C@H](CNCc1ccccc1F)NC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001496300780 1400616637 /nfs/dbraw/zinc/61/66/37/1400616637.db2.gz NWLLUHZCJNHGQU-FUHWJXTLSA-N 1 3 349.494 2.788 10 0 EFAEHO CC(C)C[C@H](CNCc1ccccc1F)NC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001496300780 1400616646 /nfs/dbraw/zinc/61/66/46/1400616646.db2.gz NWLLUHZCJNHGQU-FUHWJXTLSA-N 1 3 349.494 2.788 10 0 EFAEHO CC(C)CC[NH2+][C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1C ZINC001496355685 1400666971 /nfs/dbraw/zinc/66/69/71/1400666971.db2.gz HPAVIPIUDWINAG-IRXDYDNUSA-N 1 3 325.541 2.837 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCCCN2C(=O)[C@@H]2CCCN2C)cc1 ZINC001496388508 1400696324 /nfs/dbraw/zinc/69/63/24/1400696324.db2.gz NRACEGLFTMWYDM-PMACEKPBSA-N 1 3 343.515 2.950 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H](C)[NH2+]CC2CC(F)(F)C2)C1 ZINC001496459012 1400744755 /nfs/dbraw/zinc/74/47/55/1400744755.db2.gz HBZKKFIHLRUONT-GOEBONIOSA-N 1 3 345.478 2.589 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@H]2CCC[C@@H]3CCC[N@@H+]32)CC1 ZINC001496510453 1400784972 /nfs/dbraw/zinc/78/49/72/1400784972.db2.gz HHNAWCKSTJKSMU-QZTJIDSGSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@H]2CCC[C@@H]3CCC[N@H+]32)CC1 ZINC001496510453 1400784977 /nfs/dbraw/zinc/78/49/77/1400784977.db2.gz HHNAWCKSTJKSMU-QZTJIDSGSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@@H]2CCC[C@H]3CCC[N@@H+]32)CC1 ZINC001496510454 1400785136 /nfs/dbraw/zinc/78/51/36/1400785136.db2.gz HHNAWCKSTJKSMU-ROUUACIJSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@@H]2CCC[C@H]3CCC[N@H+]32)CC1 ZINC001496510454 1400785138 /nfs/dbraw/zinc/78/51/38/1400785138.db2.gz HHNAWCKSTJKSMU-ROUUACIJSA-N 1 3 339.499 2.533 10 0 EFAEHO CC(C)[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001496562883 1400829556 /nfs/dbraw/zinc/82/95/56/1400829556.db2.gz VDDLJQHESCRIFN-MOPGFXCFSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)[C@H](CNC(=O)CC[NH+](C)C)N[C@@H](C)c1cc(F)ccc1F ZINC001496598996 1400859944 /nfs/dbraw/zinc/85/99/44/1400859944.db2.gz VMTVKCXXJHHCBV-GUYCJALGSA-N 1 3 341.446 2.708 10 0 EFAEHO CC(C)[C@H](CNC(=O)C12CC[NH+](CC1)C2)NCc1ccccc1Cl ZINC001496627273 1400880944 /nfs/dbraw/zinc/88/09/44/1400880944.db2.gz KGCFGLNHRATAGS-KRWDZBQOSA-N 1 3 349.906 2.666 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C12CC[NH+](CC1)C2)NCc1ccccc1Cl ZINC001496627274 1400881388 /nfs/dbraw/zinc/88/13/88/1400881388.db2.gz KGCFGLNHRATAGS-QGZVFWFLSA-N 1 3 349.906 2.666 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccccc1Cl ZINC001496638396 1400891131 /nfs/dbraw/zinc/89/11/31/1400891131.db2.gz DRCZKQYLVBMSPC-QGZVFWFLSA-N 1 3 339.911 2.911 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1ccccc1F)C(C)C ZINC001496640728 1400893223 /nfs/dbraw/zinc/89/32/23/1400893223.db2.gz CGMXFRZWNULWFN-RTBURBONSA-N 1 3 349.494 2.931 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[N@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001496809270 1400998873 /nfs/dbraw/zinc/99/88/73/1400998873.db2.gz VOQJVRHOXHZRIA-QRVBRYPASA-N 1 3 335.536 2.545 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[N@@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001496809270 1400998877 /nfs/dbraw/zinc/99/88/77/1400998877.db2.gz VOQJVRHOXHZRIA-QRVBRYPASA-N 1 3 335.536 2.545 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[N@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001496825086 1401011087 /nfs/dbraw/zinc/01/10/87/1401011087.db2.gz OIBPHBOKKWCRCN-SFHVURJKSA-N 1 3 345.531 2.524 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[N@@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001496825086 1401011095 /nfs/dbraw/zinc/01/10/95/1401011095.db2.gz OIBPHBOKKWCRCN-SFHVURJKSA-N 1 3 345.531 2.524 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]CCc1cccs1 ZINC001496922759 1401103504 /nfs/dbraw/zinc/10/35/04/1401103504.db2.gz JYKVFNBXVVJACH-NVXWUHKLSA-N 1 3 337.533 2.505 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001507811040 1407165419 /nfs/dbraw/zinc/16/54/19/1407165419.db2.gz YQALNGDKQNHEBH-IRXDYDNUSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001507811040 1407165423 /nfs/dbraw/zinc/16/54/23/1407165423.db2.gz YQALNGDKQNHEBH-IRXDYDNUSA-N 1 3 327.488 2.532 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC[C@@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001497271233 1401260577 /nfs/dbraw/zinc/26/05/77/1401260577.db2.gz LQITUKUFIZLTGZ-CRAIPNDOSA-N 1 3 331.504 2.630 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccccc1Cl)N(C)C ZINC001497311587 1401291219 /nfs/dbraw/zinc/29/12/19/1401291219.db2.gz JNVLCFNBOJXGKX-RHSMWYFYSA-N 1 3 339.911 2.911 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(F)ccc1C)C(=O)[C@H](C(C)C)N(C)C ZINC001497486107 1401410295 /nfs/dbraw/zinc/41/02/95/1401410295.db2.gz LHLNOQADNJAZCU-SFHVURJKSA-N 1 3 337.483 2.658 10 0 EFAEHO CCN(CCNCc1ccc(C)nc1C)C(=O)C[N@H+]1[C@H](C)CC[C@@H]1C ZINC001497500833 1401422526 /nfs/dbraw/zinc/42/25/26/1401422526.db2.gz LPNQZRCYROJKGK-CALCHBBNSA-N 1 3 346.519 2.509 10 0 EFAEHO CCN(CCNCc1ccc(C)nc1C)C(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001497500833 1401422527 /nfs/dbraw/zinc/42/25/27/1401422527.db2.gz LPNQZRCYROJKGK-CALCHBBNSA-N 1 3 346.519 2.509 10 0 EFAEHO CCN(CCNCc1ccc(C)nc1C)C(=O)C[NH+]1[C@@H](C)CC[C@@H]1C ZINC001497500835 1401423414 /nfs/dbraw/zinc/42/34/14/1401423414.db2.gz LPNQZRCYROJKGK-IRXDYDNUSA-N 1 3 346.519 2.509 10 0 EFAEHO CCN(CC[NH2+]C[C@H]1CCC(F)(F)C1)C(=O)[C@@H]1CCCCN1CC ZINC001497501265 1401423688 /nfs/dbraw/zinc/42/36/88/1401423688.db2.gz QKTPXYJKCOFUAH-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO CN(CC(=O)NC/C=C/C[NH2+]Cc1ccc(Cl)cc1)C1CCC1 ZINC001497596854 1401482744 /nfs/dbraw/zinc/48/27/44/1401482744.db2.gz LSESLLDTDOOFQM-NSCUHMNNSA-N 1 3 335.879 2.586 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\C[NH2+][C@H]1CCCc2ccccc21)N(C)C ZINC001497603780 1401487080 /nfs/dbraw/zinc/48/70/80/1401487080.db2.gz ZLBBURJKAQNRIA-COJDAZNPSA-N 1 3 343.515 2.912 10 0 EFAEHO O=C(NC/C=C/CNCc1ccsc1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001497612112 1401493191 /nfs/dbraw/zinc/49/31/91/1401493191.db2.gz NEZRTBOOBDIFRI-SRPIJEGYSA-N 1 3 333.501 2.527 10 0 EFAEHO O=C(NC/C=C/CNCc1ccsc1)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001497612112 1401493202 /nfs/dbraw/zinc/49/32/02/1401493202.db2.gz NEZRTBOOBDIFRI-SRPIJEGYSA-N 1 3 333.501 2.527 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C/C=C/CNC(=O)CN2CCC(C)CC2)c1 ZINC001497713300 1401575769 /nfs/dbraw/zinc/57/57/69/1401575769.db2.gz GFPSFNSNDVRSCY-SNAWJCMRSA-N 1 3 343.515 2.797 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC/C=C/C[NH2+]CC[C@@H]1CCC[C@@H](C)C1 ZINC001497734867 1401594389 /nfs/dbraw/zinc/59/43/89/1401594389.db2.gz SXPZFTHGUKERLV-JUPLKNRCSA-N 1 3 332.492 2.739 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001497826948 1401680103 /nfs/dbraw/zinc/68/01/03/1401680103.db2.gz BDYAWUKOXVMIPJ-MRXNPFEDSA-N 1 3 331.504 2.889 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+][C@@H](C)c1ccc2c(c1)CCC2)N(C)C ZINC001497836498 1401685707 /nfs/dbraw/zinc/68/57/07/1401685707.db2.gz ZGFLLYYWKFIARN-ZRGWGRIASA-N 1 3 331.504 2.671 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](C)NC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001497963469 1401777915 /nfs/dbraw/zinc/77/79/15/1401777915.db2.gz WDQCQLHEUSIOFK-HUUCEWRRSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](C)NC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001497963469 1401777923 /nfs/dbraw/zinc/77/79/23/1401777923.db2.gz WDQCQLHEUSIOFK-HUUCEWRRSA-N 1 3 337.895 2.585 10 0 EFAEHO C[C@H](CNC1c2ccccc2-c2ccccc21)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001497983572 1401793642 /nfs/dbraw/zinc/79/36/42/1401793642.db2.gz HHIMFEVHRCAABV-CVEARBPZSA-N 1 3 349.478 2.802 10 0 EFAEHO C[C@H](CNC1c2ccccc2-c2ccccc21)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001497983572 1401793646 /nfs/dbraw/zinc/79/36/46/1401793646.db2.gz HHIMFEVHRCAABV-CVEARBPZSA-N 1 3 349.478 2.802 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001498117943 1401864641 /nfs/dbraw/zinc/86/46/41/1401864641.db2.gz MEDNGGMMJJTWAN-BUSQMGNYSA-N 1 3 327.488 2.650 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc(CF)cc1 ZINC001498196881 1401903500 /nfs/dbraw/zinc/90/35/00/1401903500.db2.gz AFEZGIAYVFHKOI-MAUKXSAKSA-N 1 3 335.467 2.625 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CCCc1cccc(C)c1 ZINC001498197700 1401904776 /nfs/dbraw/zinc/90/47/76/1401904776.db2.gz UVMSFFARCUAGQD-ICSRJNTNSA-N 1 3 345.531 2.896 10 0 EFAEHO C[C@@H](C[N@H+](C)Cc1ccc(Cl)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001498381314 1402055296 /nfs/dbraw/zinc/05/52/96/1402055296.db2.gz OKHGRSCDEOLTOQ-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](C[N@@H+](C)Cc1ccc(Cl)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001498381314 1402055301 /nfs/dbraw/zinc/05/53/01/1402055301.db2.gz OKHGRSCDEOLTOQ-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCCC[C@@H]1C[NH2+]Cc1ccsc1 ZINC001498504679 1402150410 /nfs/dbraw/zinc/15/04/10/1402150410.db2.gz PDEHYAJJEJLGHF-SJORKVTESA-N 1 3 337.533 2.853 10 0 EFAEHO CN(CCC[NH2+][C@H]1CCc2c1cccc2Cl)C(=O)[C@H]1CCCN1C ZINC001498525734 1402160483 /nfs/dbraw/zinc/16/04/83/1402160483.db2.gz DSMTXACBZVISPN-ZWKOTPCHSA-N 1 3 349.906 2.860 10 0 EFAEHO CN(CCC[NH2+]CC[C@@H]1CCc2ccccc21)C(=O)Cc1c[nH]cn1 ZINC001498618350 1402204527 /nfs/dbraw/zinc/20/45/27/1402204527.db2.gz AHTIHZIOQGMQLG-KRWDZBQOSA-N 1 3 340.471 2.510 10 0 EFAEHO CN(CCC[NH2+][C@@H]1CCc2c1cccc2Cl)C(=O)Cc1c[nH]cn1 ZINC001498618962 1402205426 /nfs/dbraw/zinc/20/54/26/1402205426.db2.gz LCSIGFRSMAFHGE-QGZVFWFLSA-N 1 3 346.862 2.731 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C[NH2+][C@@H]1CCc2ccccc21)C1CC1 ZINC001498861717 1402341610 /nfs/dbraw/zinc/34/16/10/1402341610.db2.gz MUTJKGWHXYQAFJ-RTBURBONSA-N 1 3 329.488 2.500 10 0 EFAEHO Cc1ccc2ccccc2c1CN1CC[C@H]1CNC(=O)CC[NH+](C)C ZINC001499050425 1402445008 /nfs/dbraw/zinc/44/50/08/1402445008.db2.gz OFMXUTDAXYIYDR-SFHVURJKSA-N 1 3 339.483 2.790 10 0 EFAEHO CC(C)(C)[C@@H](CNCc1ccccc1F)NC(=O)C12CC[NH+](CC1)C2 ZINC001508039320 1407257657 /nfs/dbraw/zinc/25/76/57/1407257657.db2.gz SDFYCVRVSRCYAS-QGZVFWFLSA-N 1 3 347.478 2.542 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCC1(NC/C=C\c2ccccc2)CC1 ZINC001499253392 1402538990 /nfs/dbraw/zinc/53/89/90/1402538990.db2.gz BYKODIFKQHSCFN-STISFXCESA-N 1 3 341.499 2.813 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCC1(NC/C=C\c2ccccc2)CC1 ZINC001499253392 1402538995 /nfs/dbraw/zinc/53/89/95/1402538995.db2.gz BYKODIFKQHSCFN-STISFXCESA-N 1 3 341.499 2.813 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCC1(NC/C=C/c2ccccc2)CC1 ZINC001499253391 1402539104 /nfs/dbraw/zinc/53/91/04/1402539104.db2.gz BYKODIFKQHSCFN-SQUITACLSA-N 1 3 341.499 2.813 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCC1(NC/C=C/c2ccccc2)CC1 ZINC001499253391 1402539106 /nfs/dbraw/zinc/53/91/06/1402539106.db2.gz BYKODIFKQHSCFN-SQUITACLSA-N 1 3 341.499 2.813 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NCC2(NCc3ccc(C4CCC4)cc3)CC2)C1 ZINC001499448566 1402619323 /nfs/dbraw/zinc/61/93/23/1402619323.db2.gz MOAGSVCNEMOXIK-IBGZPJMESA-N 1 3 341.499 2.644 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NCC2(NCc3ccc(C4CCC4)cc3)CC2)C1 ZINC001499448566 1402619326 /nfs/dbraw/zinc/61/93/26/1402619326.db2.gz MOAGSVCNEMOXIK-IBGZPJMESA-N 1 3 341.499 2.644 10 0 EFAEHO C[C@@H](NC1(CNC(=O)[C@H]2CC[N@H+](C)C2)CC1)c1ccc(Cl)cc1 ZINC001499448717 1402619378 /nfs/dbraw/zinc/61/93/78/1402619378.db2.gz PLAZUGYCMGEDOT-HIFRSBDPSA-N 1 3 335.879 2.591 10 0 EFAEHO C[C@@H](NC1(CNC(=O)[C@H]2CC[N@@H+](C)C2)CC1)c1ccc(Cl)cc1 ZINC001499448717 1402619383 /nfs/dbraw/zinc/61/93/83/1402619383.db2.gz PLAZUGYCMGEDOT-HIFRSBDPSA-N 1 3 335.879 2.591 10 0 EFAEHO O=C(CN1CCCC1)N1CCC([N@H+](C/C=C\Cl)CC2CC2)CC1 ZINC001499530093 1402664720 /nfs/dbraw/zinc/66/47/20/1402664720.db2.gz LJYNHUPNYKDFBL-BAQGIRSFSA-N 1 3 339.911 2.538 10 0 EFAEHO O=C(CN1CCCC1)N1CCC([N@@H+](C/C=C\Cl)CC2CC2)CC1 ZINC001499530093 1402664725 /nfs/dbraw/zinc/66/47/25/1402664725.db2.gz LJYNHUPNYKDFBL-BAQGIRSFSA-N 1 3 339.911 2.538 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CCC1)[NH+](CC)CC ZINC001499554720 1402680433 /nfs/dbraw/zinc/68/04/33/1402680433.db2.gz DXGHEHAGMDDJNR-OTWHNJEPSA-N 1 3 335.536 2.972 10 0 EFAEHO Cc1ccc(F)c(CN2CCC([C@@H](C)NC(=O)CC[NH+](C)C)CC2)c1 ZINC001508064483 1407276054 /nfs/dbraw/zinc/27/60/54/1407276054.db2.gz HPIJZGMWHOCOHF-MRXNPFEDSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@@H](F)CN1CCC([C@H](C)NC(=O)CC2CC[NH+](C)CC2)CC1 ZINC001508080357 1407285928 /nfs/dbraw/zinc/28/59/28/1407285928.db2.gz CFRYMDRUJCEYLQ-MAUKXSAKSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@H](NC(=O)[C@H](C)N1CCCCCC1)C1CC[NH+](CCCF)CC1 ZINC001508080679 1407286253 /nfs/dbraw/zinc/28/62/53/1407286253.db2.gz GZFAPAHZBXGOIH-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001499902209 1402846596 /nfs/dbraw/zinc/84/65/96/1402846596.db2.gz VRXUTUMKPQCDAL-KGLIPLIRSA-N 1 3 348.318 2.760 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001499902209 1402846599 /nfs/dbraw/zinc/84/65/99/1402846599.db2.gz VRXUTUMKPQCDAL-KGLIPLIRSA-N 1 3 348.318 2.760 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@H]1C[NH2+]CC/C=C\c1ccccc1 ZINC001499915592 1402852358 /nfs/dbraw/zinc/85/23/58/1402852358.db2.gz FNJRZTTYLZBKDA-RQAKEFRFSA-N 1 3 341.499 2.765 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H]1C[NH2+]CCCc1ccc(C)cc1)N(C)C ZINC001499943533 1402864460 /nfs/dbraw/zinc/86/44/60/1402864460.db2.gz DXCHNQFOVCQCCT-PMACEKPBSA-N 1 3 345.531 2.848 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@](C)(C[NH2+]Cc3ccsc3)C2)CCC1 ZINC001500354131 1403070672 /nfs/dbraw/zinc/07/06/72/1403070672.db2.gz LIAZJSWOJZLWIX-KRWDZBQOSA-N 1 3 335.517 2.561 10 0 EFAEHO CN(CC(=O)N1CC[C@@](C)(C[NH2+]CC2CC(C)(C)C2)C1)C1CCC1 ZINC001500354721 1403071392 /nfs/dbraw/zinc/07/13/92/1403071392.db2.gz XZDUGENGHACFEN-FQEVSTJZSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CC[C@@](C)(C[NH2+]C/C=C/Cl)C1 ZINC001500382055 1403087513 /nfs/dbraw/zinc/08/75/13/1403087513.db2.gz JVGAKBRXQGHNGI-OTTBVJJXSA-N 1 3 341.927 2.830 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@](C)(C[NH2+]C/C=C\Cl)C2)c1 ZINC001500404495 1403100902 /nfs/dbraw/zinc/10/09/02/1403100902.db2.gz DXDJCJFWFDCEBA-FVXMCEBTSA-N 1 3 349.906 2.943 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@@](C)(C[NH2+]C/C=C/Cl)C2)c1 ZINC001500404497 1403101370 /nfs/dbraw/zinc/10/13/70/1403101370.db2.gz DXDJCJFWFDCEBA-SQUITACLSA-N 1 3 349.906 2.943 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@@](C)(C[NH2+]CCCF)C2)c1 ZINC001500405169 1403101645 /nfs/dbraw/zinc/10/16/45/1403101645.db2.gz RRUGNTHEWLGJBM-IBGZPJMESA-N 1 3 335.467 2.550 10 0 EFAEHO CCCN(C)CC(=O)NCC1(C)CC[NH+](CCC(C)(C)C)CC1 ZINC001500459411 1403136184 /nfs/dbraw/zinc/13/61/84/1403136184.db2.gz IMMLPDANNJNKOW-UHFFFAOYSA-N 1 3 325.541 2.983 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1(C)CC[NH+](CC2CCCC2)CC1 ZINC001500459972 1403136878 /nfs/dbraw/zinc/13/68/78/1403136878.db2.gz SMBRPEYDYCZRAV-UHFFFAOYSA-N 1 3 332.492 2.669 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@]1(C)CCC[N@H+](CC2CCC2)C1 ZINC001500497811 1403171519 /nfs/dbraw/zinc/17/15/19/1403171519.db2.gz ASGFSCYEZHYCNY-UYAOXDASSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@]1(C)CCC[N@@H+](CC2CCC2)C1 ZINC001500497811 1403171522 /nfs/dbraw/zinc/17/15/22/1403171522.db2.gz ASGFSCYEZHYCNY-UYAOXDASSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@]1(C)CCC[N@H+](CCc2ccccc2)C1 ZINC001500553356 1403219131 /nfs/dbraw/zinc/21/91/31/1403219131.db2.gz WPSNZIAMJJUUDM-OAQYLSRUSA-N 1 3 345.531 2.788 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@]1(C)CCC[N@@H+](CCc2ccccc2)C1 ZINC001500553356 1403219135 /nfs/dbraw/zinc/21/91/35/1403219135.db2.gz WPSNZIAMJJUUDM-OAQYLSRUSA-N 1 3 345.531 2.788 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001500620979 1403254983 /nfs/dbraw/zinc/25/49/83/1403254983.db2.gz QTJPGJONVKXZDU-MOEXGYKKSA-N 1 3 345.478 2.756 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001500620979 1403254986 /nfs/dbraw/zinc/25/49/86/1403254986.db2.gz QTJPGJONVKXZDU-MOEXGYKKSA-N 1 3 345.478 2.756 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001500620981 1403255023 /nfs/dbraw/zinc/25/50/23/1403255023.db2.gz QTJPGJONVKXZDU-WLMCBFPDSA-N 1 3 345.478 2.756 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001500620981 1403255025 /nfs/dbraw/zinc/25/50/25/1403255025.db2.gz QTJPGJONVKXZDU-WLMCBFPDSA-N 1 3 345.478 2.756 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC2(C3CC[NH+](CC4CCCC4)CC3)CC2)C1 ZINC001508166574 1407327820 /nfs/dbraw/zinc/32/78/20/1407327820.db2.gz UKPWRLNPVVTOGG-QGZVFWFLSA-N 1 3 347.547 2.879 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)N[C@H]1C[C@H]2C[C@@H](C1)N(C/C=C\Cl)C2 ZINC001501013262 1403404754 /nfs/dbraw/zinc/40/47/54/1403404754.db2.gz LJKJLJBYSVYRFG-ZVPCSVBDSA-N 1 3 339.911 2.584 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C2CC[NH+](CC3CC3)CC2)C1 ZINC001501015561 1403405068 /nfs/dbraw/zinc/40/50/68/1403405068.db2.gz IJQKZOACYXFJJU-LJQANCHMSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)C[NH+]1CCC([C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)CC1 ZINC001501016163 1403406392 /nfs/dbraw/zinc/40/63/92/1403406392.db2.gz ULDCSLKSPMXGOS-LJQANCHMSA-N 1 3 337.552 2.933 10 0 EFAEHO CCC[NH2+][C@H](CNC(=O)CN1CC[C@@H](C)C1)c1ccccc1CC ZINC001501021738 1403410129 /nfs/dbraw/zinc/41/01/29/1403410129.db2.gz JRLAZWGUGDZLEH-VQIMIIECSA-N 1 3 331.504 2.748 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2ccc(C)c(F)c2)C1 ZINC001501150559 1403460674 /nfs/dbraw/zinc/46/06/74/1403460674.db2.gz ULGZPBKPPCGONN-FUHWJXTLSA-N 1 3 349.494 2.660 10 0 EFAEHO CCCC[NH2+]C[C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@@H]1C ZINC001501153409 1403462232 /nfs/dbraw/zinc/46/22/32/1403462232.db2.gz OUHKVYOECNMQIZ-QFBILLFUSA-N 1 3 331.504 2.846 10 0 EFAEHO CC[C@H](F)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN(C)C1CCC1)C2 ZINC001501165977 1403469957 /nfs/dbraw/zinc/46/99/57/1403469957.db2.gz CEMBOXYNPFAPCE-ONIAQPFYSA-N 1 3 339.499 2.578 10 0 EFAEHO CC[C@H](F)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN(C)C1CCC1)C2 ZINC001501165977 1403469960 /nfs/dbraw/zinc/46/99/60/1403469960.db2.gz CEMBOXYNPFAPCE-ONIAQPFYSA-N 1 3 339.499 2.578 10 0 EFAEHO CC[C@@H](F)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN(C)C1CCC1)C2 ZINC001501165978 1403470015 /nfs/dbraw/zinc/47/00/15/1403470015.db2.gz CEMBOXYNPFAPCE-XYVMCAHJSA-N 1 3 339.499 2.578 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN(C)C1CCC1)C2 ZINC001501165978 1403470020 /nfs/dbraw/zinc/47/00/20/1403470020.db2.gz CEMBOXYNPFAPCE-XYVMCAHJSA-N 1 3 339.499 2.578 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@@H]1CCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001501577725 1403634081 /nfs/dbraw/zinc/63/40/81/1403634081.db2.gz CKMZLTDTEXLLRH-QUCCMNQESA-N 1 3 345.531 2.909 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]C[C@@H]3CCC(F)(F)C3)CCC2)CCC1 ZINC001501961817 1403908973 /nfs/dbraw/zinc/90/89/73/1403908973.db2.gz LOVDFYZFILLMFU-CQSZACIVSA-N 1 3 343.462 2.535 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1CCC[C@H](NC(=O)CN(C)C(C)C)CC1 ZINC001502147459 1404047610 /nfs/dbraw/zinc/04/76/10/1404047610.db2.gz JRDYFDWXIUCIMT-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1CCC[C@H](NC(=O)CN(C)C(C)C)CC1 ZINC001502147459 1404047612 /nfs/dbraw/zinc/04/76/12/1404047612.db2.gz JRDYFDWXIUCIMT-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[N@H+](C)Cc2ccsc2)CC1 ZINC001502385149 1404124854 /nfs/dbraw/zinc/12/48/54/1404124854.db2.gz KXNLSZCKXRMZGD-UHFFFAOYSA-N 1 3 337.533 2.760 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[N@@H+](C)Cc2ccsc2)CC1 ZINC001502385149 1404124860 /nfs/dbraw/zinc/12/48/60/1404124860.db2.gz KXNLSZCKXRMZGD-UHFFFAOYSA-N 1 3 337.533 2.760 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@]2(C1)CCCN(C(=O)[C@@H](CC)N(C)C)C2 ZINC001502543694 1404232032 /nfs/dbraw/zinc/23/20/32/1404232032.db2.gz LGHBMXFGBPRHML-TWPWWVQHSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@]2(C1)CCCN(C(=O)[C@@H](CC)N(C)C)C2 ZINC001502543694 1404232038 /nfs/dbraw/zinc/23/20/38/1404232038.db2.gz LGHBMXFGBPRHML-TWPWWVQHSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1ccc2c(c1)C[N@@H+](CCC1CC1)C2 ZINC001502653771 1404290960 /nfs/dbraw/zinc/29/09/60/1404290960.db2.gz YELPCPRKBRVQCT-UHFFFAOYSA-N 1 3 329.488 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1ccc2c(c1)C[N@H+](CCC1CC1)C2 ZINC001502653771 1404290963 /nfs/dbraw/zinc/29/09/63/1404290963.db2.gz YELPCPRKBRVQCT-UHFFFAOYSA-N 1 3 329.488 2.759 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1[NH2+]CCC(C)(C)C ZINC001502741737 1404320666 /nfs/dbraw/zinc/32/06/66/1404320666.db2.gz KMWUKERLVNUWQV-HOTGVXAUSA-N 1 3 325.541 2.837 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC(C)(NC/C(Cl)=C\Cl)CC1 ZINC001502795503 1404348154 /nfs/dbraw/zinc/34/81/54/1404348154.db2.gz NYDAYCDHCVOQOE-ACCUITESSA-N 1 3 336.307 2.618 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)C(C)(C)N2CCCC2)CC[N@@H+]1CCCCCF ZINC001502971492 1404447542 /nfs/dbraw/zinc/44/75/42/1404447542.db2.gz VMPSUEJWBNFCRP-IRXDYDNUSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)C(C)(C)N2CCCC2)CC[N@H+]1CCCCCF ZINC001502971492 1404447559 /nfs/dbraw/zinc/44/75/59/1404447559.db2.gz VMPSUEJWBNFCRP-IRXDYDNUSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)C(C)(C)N2CCCC2)CC[N@@H+]1CCCCCF ZINC001502971488 1404448323 /nfs/dbraw/zinc/44/83/23/1404448323.db2.gz VMPSUEJWBNFCRP-DLBZAZTESA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)C(C)(C)N2CCCC2)CC[N@H+]1CCCCCF ZINC001502971488 1404448326 /nfs/dbraw/zinc/44/83/26/1404448326.db2.gz VMPSUEJWBNFCRP-DLBZAZTESA-N 1 3 341.515 2.970 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)c(C)n1 ZINC001503022823 1404463697 /nfs/dbraw/zinc/46/36/97/1404463697.db2.gz GIXYCCVRRBWXRG-QFBILLFUSA-N 1 3 346.519 2.508 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)c(C)n1 ZINC001503022823 1404463701 /nfs/dbraw/zinc/46/37/01/1404463701.db2.gz GIXYCCVRRBWXRG-QFBILLFUSA-N 1 3 346.519 2.508 10 0 EFAEHO CN(Cc1cccc(Cl)c1)C[C@H]1CCCN1C(=O)CC[NH+](C)C ZINC001505445240 1404635301 /nfs/dbraw/zinc/63/53/01/1404635301.db2.gz QUDOWRLRQHFXTK-QGZVFWFLSA-N 1 3 337.895 2.715 10 0 EFAEHO CC(C)CCC[NH2+][C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)[C@H]1C ZINC001725561260 1425649874 /nfs/dbraw/zinc/64/98/74/1425649874.db2.gz ASQZBZWZLPJTGE-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CC1CC(NC(=O)C2(N(C)C)CCC2)C1 ZINC001505501889 1404729377 /nfs/dbraw/zinc/72/93/77/1404729377.db2.gz NXYBQLADSXFZNK-UHFFFAOYSA-N 1 3 347.478 2.603 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](CNCCF)C(C)(C)C)[NH+]1CCCCC1 ZINC001725755732 1425822132 /nfs/dbraw/zinc/82/21/32/1425822132.db2.gz GOJJEFSPQPGOPA-HOTGVXAUSA-N 1 3 329.504 2.587 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](C)[C@@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001505622769 1404865850 /nfs/dbraw/zinc/86/58/50/1404865850.db2.gz ZAJRRCQBPDRWDC-IAGOWNOFSA-N 1 3 331.504 2.771 10 0 EFAEHO COc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)CC(C)(C)C)cc1 ZINC001505694239 1404948647 /nfs/dbraw/zinc/94/86/47/1404948647.db2.gz LSNIHPDAZGFZIF-CVEARBPZSA-N 1 3 349.519 2.656 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)[C@H](C)NCc1ccc(C)cc1Cl ZINC001505723448 1404984222 /nfs/dbraw/zinc/98/42/22/1404984222.db2.gz AHJYUHUJSYRNAZ-GJZGRUSLSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)[C@H](C)NCc1ccc(C)cc1Cl ZINC001505723448 1404984231 /nfs/dbraw/zinc/98/42/31/1404984231.db2.gz AHJYUHUJSYRNAZ-GJZGRUSLSA-N 1 3 339.911 2.973 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1cc(C)sc1C ZINC001505736560 1405004182 /nfs/dbraw/zinc/00/41/82/1405004182.db2.gz UVEIDTSLRGKCIW-ZIAGYGMSSA-N 1 3 325.522 2.690 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)N(C)Cc1cc2ccccc2o1 ZINC001505922274 1405227153 /nfs/dbraw/zinc/22/71/53/1405227153.db2.gz KXTPETZJJJYZBV-IIDMSEBBSA-N 1 3 343.471 2.710 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)N(C)Cc1cc2ccccc2o1 ZINC001505922274 1405227159 /nfs/dbraw/zinc/22/71/59/1405227159.db2.gz KXTPETZJJJYZBV-IIDMSEBBSA-N 1 3 343.471 2.710 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[N@H+](C)CCc1cccs1 ZINC001505931355 1405242543 /nfs/dbraw/zinc/24/25/43/1405242543.db2.gz YPVZRXQAFQHMTM-WBVHZDCISA-N 1 3 337.533 2.602 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[N@@H+](C)CCc1cccs1 ZINC001505931355 1405242551 /nfs/dbraw/zinc/24/25/51/1405242551.db2.gz YPVZRXQAFQHMTM-WBVHZDCISA-N 1 3 337.533 2.602 10 0 EFAEHO Cc1ccc(CN(C)[C@@H](C)CNC(=O)CC[C@@H]2CCC[N@@H+]2C)cc1F ZINC001505937854 1405249226 /nfs/dbraw/zinc/24/92/26/1405249226.db2.gz NFUNIICORCHPMD-WMZOPIPTSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(CN(C)[C@@H](C)CNC(=O)CC[C@@H]2CCC[N@H+]2C)cc1F ZINC001505937854 1405249234 /nfs/dbraw/zinc/24/92/34/1405249234.db2.gz NFUNIICORCHPMD-WMZOPIPTSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[N@H+](C)CC1CCC2(CC2)CC1 ZINC001506002626 1405331217 /nfs/dbraw/zinc/33/12/17/1405331217.db2.gz ZWCNPEPQXVXKTP-SJORKVTESA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001506002626 1405331221 /nfs/dbraw/zinc/33/12/21/1405331221.db2.gz ZWCNPEPQXVXKTP-SJORKVTESA-N 1 3 335.536 2.735 10 0 EFAEHO CCc1cccc(CN(C)[C@@H](C)CNC(=O)C[C@@H]2CC[N@H+](C)C2)c1 ZINC001506037932 1405384617 /nfs/dbraw/zinc/38/46/17/1405384617.db2.gz CWNAQXIKMRLDQV-LPHOPBHVSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(CN(C)[C@@H](C)CNC(=O)C[C@@H]2CC[N@@H+](C)C2)c1 ZINC001506037932 1405384620 /nfs/dbraw/zinc/38/46/20/1405384620.db2.gz CWNAQXIKMRLDQV-LPHOPBHVSA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@H](CNC(=O)C12CC[NH+](CC1)C2)N(C)[C@@H](C)c1cccc(Cl)c1 ZINC001506037901 1405384696 /nfs/dbraw/zinc/38/46/96/1405384696.db2.gz CFIKERAEFJCJES-CABCVRRESA-N 1 3 349.906 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)CCc1ccc(Cl)cc1 ZINC001506064869 1405423808 /nfs/dbraw/zinc/42/38/08/1405423808.db2.gz FBGJDVPSEKZCPU-HNNXBMFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)CCc1ccc(Cl)cc1 ZINC001506064869 1405423817 /nfs/dbraw/zinc/42/38/17/1405423817.db2.gz FBGJDVPSEKZCPU-HNNXBMFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CC[C@@H](F)CN1CCCCC[C@H]1CNC(=O)CC1CC[NH+](C)CC1 ZINC001506576595 1405993058 /nfs/dbraw/zinc/99/30/58/1405993058.db2.gz UCLIRPRSFYOCMS-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)/C(F)=C/C1CCCCC1 ZINC001557450283 1415126491 /nfs/dbraw/zinc/12/64/91/1415126491.db2.gz KVMIOJJIVSAUCP-SUCHYCSPSA-N 1 3 327.488 2.808 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)/C(F)=C/C1CCCCC1 ZINC001557450283 1415126494 /nfs/dbraw/zinc/12/64/94/1415126494.db2.gz KVMIOJJIVSAUCP-SUCHYCSPSA-N 1 3 327.488 2.808 10 0 EFAEHO C[C@]1(CN2CCC(O)(C[NH+]3CCCCC3)CC2)CC1(Cl)Cl ZINC001560218257 1415268256 /nfs/dbraw/zinc/26/82/56/1415268256.db2.gz XLWKDXRCMYYOES-CQSZACIVSA-N 1 3 335.319 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@H]1CC[NH2+]C/C=C\Cl ZINC001565942913 1415460797 /nfs/dbraw/zinc/46/07/97/1415460797.db2.gz IGAZPJCRPCMGCW-PDTSHOSPSA-N 1 3 329.916 2.686 10 0 EFAEHO Cc1ccncc1CN(C)CCCNC(=O)C(C)(C)[NH+]1CCCCC1 ZINC001566453950 1415555764 /nfs/dbraw/zinc/55/57/64/1415555764.db2.gz LAFBILCFJKHTDU-UHFFFAOYSA-N 1 3 346.519 2.593 10 0 EFAEHO Cc1ccncc1CN(C)CCCNC(=O)[C@@H]1CCCC[N@H+]1C(C)C ZINC001566497660 1415588107 /nfs/dbraw/zinc/58/81/07/1415588107.db2.gz CJRMYQCPSNZCHP-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1ccncc1CN(C)CCCNC(=O)[C@@H]1CCCC[N@@H+]1C(C)C ZINC001566497660 1415588112 /nfs/dbraw/zinc/58/81/12/1415588112.db2.gz CJRMYQCPSNZCHP-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)C(C)(C)[NH+]1CCCCC1 ZINC001566550430 1415634237 /nfs/dbraw/zinc/63/42/37/1415634237.db2.gz HXOWRWJLMPLTSM-NTMALXAHSA-N 1 3 329.916 2.832 10 0 EFAEHO CCN(CCCNC(=O)C(C)(C)[NH+]1CCCC1)CCC(F)(F)F ZINC001566560848 1415642855 /nfs/dbraw/zinc/64/28/55/1415642855.db2.gz UZDYGXGVLILMOC-UHFFFAOYSA-N 1 3 337.430 2.641 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1C[C@H](NC(=O)CN2CC[C@H](C)C2)C1 ZINC001566803773 1415780576 /nfs/dbraw/zinc/78/05/76/1415780576.db2.gz MUHCAOOTQSWUFY-VDGAXYAQSA-N 1 3 343.515 2.506 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@H]2[C@@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001566828034 1415791380 /nfs/dbraw/zinc/79/13/80/1415791380.db2.gz XPZZSKMPRHMOIV-WMZOPIPTSA-N 1 3 332.492 2.845 10 0 EFAEHO CCCCCC[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001566828034 1415791384 /nfs/dbraw/zinc/79/13/84/1415791384.db2.gz XPZZSKMPRHMOIV-WMZOPIPTSA-N 1 3 332.492 2.845 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@H]1CCCN(Cc2ccsc2)C1 ZINC001566879657 1415820533 /nfs/dbraw/zinc/82/05/33/1415820533.db2.gz QXVTXJCVWGOHDX-MRXNPFEDSA-N 1 3 337.533 2.808 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1CCC[N@H+](CC2=CCCCC2)C1 ZINC001566881284 1415821776 /nfs/dbraw/zinc/82/17/76/1415821776.db2.gz PCCZNYAGLOHWNY-KRWDZBQOSA-N 1 3 330.476 2.589 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1CCC[N@@H+](CC2=CCCCC2)C1 ZINC001566881284 1415821779 /nfs/dbraw/zinc/82/17/79/1415821779.db2.gz PCCZNYAGLOHWNY-KRWDZBQOSA-N 1 3 330.476 2.589 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CCC[N@H+](CC2=CCCCC2)C1 ZINC001566881285 1415822390 /nfs/dbraw/zinc/82/23/90/1415822390.db2.gz PCCZNYAGLOHWNY-QGZVFWFLSA-N 1 3 330.476 2.589 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CCC[N@@H+](CC2=CCCCC2)C1 ZINC001566881285 1415822395 /nfs/dbraw/zinc/82/23/95/1415822395.db2.gz PCCZNYAGLOHWNY-QGZVFWFLSA-N 1 3 330.476 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H](C[NH2+]CCC2CCCC2)C1)N(C)C ZINC001566909991 1415838341 /nfs/dbraw/zinc/83/83/41/1415838341.db2.gz JPMOFOKYYSYTDI-RTBURBONSA-N 1 3 337.552 2.981 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H]([NH2+]CC/C=C\c3ccccc3)C2)CCC1 ZINC001567097192 1415932295 /nfs/dbraw/zinc/93/22/95/1415932295.db2.gz RQYXBYNDXMAMAC-LFIXQJEJSA-N 1 3 341.499 2.765 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H](C[NH2+]CCCCC(F)(F)F)C2)CCC1 ZINC001567127830 1415943660 /nfs/dbraw/zinc/94/36/60/1415943660.db2.gz KAQJQZYZTKHMRR-AWEZNQCLSA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]CC/C=C/c2ccccc2)C1 ZINC001567154170 1415955345 /nfs/dbraw/zinc/95/53/45/1415955345.db2.gz BRGZHTGZMKATJG-OEMHODTASA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@H]1CCC[N@@H+]1Cc1cncc(C)c1)N(C)C ZINC001567265310 1416042903 /nfs/dbraw/zinc/04/29/03/1416042903.db2.gz VCUSLZNLENGXDD-OALUTQOASA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@H]1CCC[N@H+]1Cc1cncc(C)c1)N(C)C ZINC001567265310 1416042911 /nfs/dbraw/zinc/04/29/11/1416042911.db2.gz VCUSLZNLENGXDD-OALUTQOASA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001567516167 1416169655 /nfs/dbraw/zinc/16/96/55/1416169655.db2.gz KLLZLIPHSKVJPQ-RBUKOAKNSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001567516167 1416169663 /nfs/dbraw/zinc/16/96/63/1416169663.db2.gz KLLZLIPHSKVJPQ-RBUKOAKNSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1cc(C[NH2+]CCN(C)C(=O)CN2CCC(C)CC2)c(C)s1 ZINC001567580359 1416195442 /nfs/dbraw/zinc/19/54/42/1416195442.db2.gz WPRWGVJCYPPIKL-UHFFFAOYSA-N 1 3 337.533 2.645 10 0 EFAEHO Cc1cccc(Cl)c1CNCCN(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001567591005 1416200358 /nfs/dbraw/zinc/20/03/58/1416200358.db2.gz SQYIMWKLVAONAF-OAHLLOKOSA-N 1 3 337.895 2.538 10 0 EFAEHO Cc1cccc(Cl)c1CNCCN(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001567591005 1416200361 /nfs/dbraw/zinc/20/03/61/1416200361.db2.gz SQYIMWKLVAONAF-OAHLLOKOSA-N 1 3 337.895 2.538 10 0 EFAEHO CC(C)CCC[NH2+][C@H](C)C1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001567630524 1416217187 /nfs/dbraw/zinc/21/71/87/1416217187.db2.gz SVJAQWYEPXZHFO-QZTJIDSGSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N(C)[C@@H]1CC[N@H+](CCCCCF)C1 ZINC001567921566 1416324248 /nfs/dbraw/zinc/32/42/48/1416324248.db2.gz AWVNOHIRLRMLLV-MSOLQXFVSA-N 1 3 341.515 2.922 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N(C)[C@@H]1CC[N@@H+](CCCCCF)C1 ZINC001567921566 1416324252 /nfs/dbraw/zinc/32/42/52/1416324252.db2.gz AWVNOHIRLRMLLV-MSOLQXFVSA-N 1 3 341.515 2.922 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NC2(C[NH2+]CCCF)CCCC2)C1 ZINC001568005218 1416356841 /nfs/dbraw/zinc/35/68/41/1416356841.db2.gz AVIMRFIWVAXTKU-GOSISDBHSA-N 1 3 345.478 2.577 10 0 EFAEHO C[C@H](C(=O)N[C@@](C)(C[NH2+]C/C=C\Cl)C1CC1)N1CCCCCC1 ZINC001568029505 1416366277 /nfs/dbraw/zinc/36/62/77/1416366277.db2.gz UIEAOZARTHITHT-BUYPAVLNSA-N 1 3 341.927 2.878 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(CC[NH2+]CC3CC(C)(C)C3)CC2)C1 ZINC001568094276 1416407311 /nfs/dbraw/zinc/40/73/11/1416407311.db2.gz XKFDVLDKFAQCJO-QGZVFWFLSA-N 1 3 349.563 2.983 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCc1ccc(C[NH2+]CCCF)cc1 ZINC001568121977 1416418570 /nfs/dbraw/zinc/41/85/70/1416418570.db2.gz UXZPELVBZASYIT-GOSISDBHSA-N 1 3 335.467 2.626 10 0 EFAEHO CC(C)CCC[NH2+]C[C@@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001568193619 1416437406 /nfs/dbraw/zinc/43/74/06/1416437406.db2.gz HJSBFLLCZBTPGI-VQIMIIECSA-N 1 3 343.531 2.977 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H](C)C[NH2+]CCc1ccccc1 ZINC001568197421 1416438941 /nfs/dbraw/zinc/43/89/41/1416438941.db2.gz UNIMUJGRANLOHW-UYAOXDASSA-N 1 3 345.531 2.834 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)CC[C@@H]1[NH2+]CCCCCF ZINC001568364784 1416493852 /nfs/dbraw/zinc/49/38/52/1416493852.db2.gz IGOOPRDFQUTNRM-IRXDYDNUSA-N 1 3 343.531 2.931 10 0 EFAEHO CC(C)N1CCN(c2cccc(NC(=O)[C@H]3CCCC[C@H]3[NH3+])c2)CC1 ZINC001645885223 1416579781 /nfs/dbraw/zinc/57/97/81/1416579781.db2.gz VSULZORXBSGWOG-RBUKOAKNSA-N 1 3 344.503 2.673 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1ccc(F)cc1 ZINC001691751115 1416664794 /nfs/dbraw/zinc/66/47/94/1416664794.db2.gz CEARTMJVZLFOQH-QGZVFWFLSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1ccc(F)cc1 ZINC001691751115 1416664797 /nfs/dbraw/zinc/66/47/97/1416664797.db2.gz CEARTMJVZLFOQH-QGZVFWFLSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)[C@@H]1CCCc2ccccc21)N(C)C ZINC001689841126 1417085173 /nfs/dbraw/zinc/08/51/73/1417085173.db2.gz YXRWXWXKZYAYJW-RBUKOAKNSA-N 1 3 331.504 2.842 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)[C@@H]1CCCc2ccccc21)N(C)C ZINC001689841126 1417085175 /nfs/dbraw/zinc/08/51/75/1417085175.db2.gz YXRWXWXKZYAYJW-RBUKOAKNSA-N 1 3 331.504 2.842 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1CCC[N@H+](CCCCCF)C1 ZINC001690037903 1417139893 /nfs/dbraw/zinc/13/98/93/1417139893.db2.gz UTIBOXMGIBIHSN-IRXDYDNUSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1CCC[N@@H+](CCCCCF)C1 ZINC001690037903 1417139898 /nfs/dbraw/zinc/13/98/98/1417139898.db2.gz UTIBOXMGIBIHSN-IRXDYDNUSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)CCC[NH2+][C@H]1C[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001690289650 1417184324 /nfs/dbraw/zinc/18/43/24/1417184324.db2.gz KNVZQKBWVUHFPC-BXWFABGCSA-N 1 3 341.515 2.872 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC1C[C@H]2CC[C@@H](C1)N2CCC(F)(F)F ZINC001690312284 1417188526 /nfs/dbraw/zinc/18/85/26/1417188526.db2.gz KMQOUBUFLYXQOA-GOOCMWNKSA-N 1 3 349.441 2.782 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001690757235 1417239235 /nfs/dbraw/zinc/23/92/35/1417239235.db2.gz DMODPXNSFSYFRC-GOSISDBHSA-N 1 3 345.531 2.570 10 0 EFAEHO CN(CC(=O)N1CCC(CC[NH2+]CC2CCCC2)CC1)C1CCC1 ZINC001698695954 1417309778 /nfs/dbraw/zinc/30/97/78/1417309778.db2.gz SENMWVVCIHAUDO-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccc(Cl)s1)NC(=O)C1(N(C)C)CCC1 ZINC001699107397 1417391363 /nfs/dbraw/zinc/39/13/63/1417391363.db2.gz SLQDVJINQHPWNN-GFCCVEGCSA-N 1 3 343.924 2.870 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1csc(C)c1 ZINC001699158352 1417407709 /nfs/dbraw/zinc/40/77/09/1417407709.db2.gz DOISVRJHXOIMLU-YOEHRIQHSA-N 1 3 337.533 2.915 10 0 EFAEHO CC/C=C/CCN1CC[C@H]1CNC(=O)c1ccc(C[NH+](C)C)cc1 ZINC001699632493 1417439300 /nfs/dbraw/zinc/43/93/00/1417439300.db2.gz LTSBZYBZVZQHHL-UEKDZROGSA-N 1 3 329.488 2.909 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001700094342 1417565428 /nfs/dbraw/zinc/56/54/28/1417565428.db2.gz SOWVMJYUXHGJPA-GOSISDBHSA-N 1 3 331.504 2.663 10 0 EFAEHO CN(C)C1(C(=O)N(C)[C@@H](C[NH2+]CCC2CCCC2)C2CC2)CCC1 ZINC001700723767 1417630170 /nfs/dbraw/zinc/63/01/70/1417630170.db2.gz ONQNVGOOEZXSEP-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](CNC(=O)OC(C)(C)C)NC1CC[NH+](CC(C)C)CC1 ZINC000234028361 1418279706 /nfs/dbraw/zinc/27/97/06/1418279706.db2.gz OUWRRQLABOIPLV-OAHLLOKOSA-N 1 3 327.513 3.000 10 0 EFAEHO C[C@H]([NH2+]CCCF)[C@@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001712998855 1418322403 /nfs/dbraw/zinc/32/24/03/1418322403.db2.gz HWYMPQDXVZVXEU-HOTGVXAUSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@@H]([NH2+]CCCF)[C@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001712998856 1418322431 /nfs/dbraw/zinc/32/24/31/1418322431.db2.gz HWYMPQDXVZVXEU-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO CCC/C=C/CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H]1CCCN1C(C)C ZINC001713281573 1418450906 /nfs/dbraw/zinc/45/09/06/1418450906.db2.gz PTVXGVSIPYWHGK-GIZGKNGMSA-N 1 3 333.520 2.652 10 0 EFAEHO CCC/C=C/CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H]1CCCN1C(C)C ZINC001713281573 1418450909 /nfs/dbraw/zinc/45/09/09/1418450909.db2.gz PTVXGVSIPYWHGK-GIZGKNGMSA-N 1 3 333.520 2.652 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](C[NH2+]CC/C=C/c2ccccc2)C1)N(C)C ZINC001713354424 1418487882 /nfs/dbraw/zinc/48/78/82/1418487882.db2.gz NHCQFPPYFIEMRB-RIZQAGQYSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001713364233 1418492522 /nfs/dbraw/zinc/49/25/22/1418492522.db2.gz KXMZZACYOYEDPB-GOSISDBHSA-N 1 3 331.504 2.846 10 0 EFAEHO CCC[NH2+]CCc1ccc(CNC(=O)[C@H]2CCCCN2CC)cc1 ZINC001713386898 1418501259 /nfs/dbraw/zinc/50/12/59/1418501259.db2.gz QUJGRUIASUMHJP-LJQANCHMSA-N 1 3 331.504 2.719 10 0 EFAEHO CCc1ccc(CC[NH2+]C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001714385905 1418602183 /nfs/dbraw/zinc/60/21/83/1418602183.db2.gz SEFJTKRIEKXBCI-HXUWFJFHSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@H](C)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001714749154 1418622639 /nfs/dbraw/zinc/62/26/39/1418622639.db2.gz IQRVUAYJPYMGIK-MSOLQXFVSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@H](C)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001714749156 1418623555 /nfs/dbraw/zinc/62/35/55/1418623555.db2.gz IQRVUAYJPYMGIK-ROUUACIJSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@@H](C)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001714749155 1418623814 /nfs/dbraw/zinc/62/38/14/1418623814.db2.gz IQRVUAYJPYMGIK-QZTJIDSGSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]CCc1ccccc1 ZINC001714774583 1418632361 /nfs/dbraw/zinc/63/23/61/1418632361.db2.gz WQPJQMLSVPDGCM-ICSRJNTNSA-N 1 3 345.531 2.929 10 0 EFAEHO CC[C@H](C(=O)NC/C=C\C[NH2+]Cc1ccc2ccccc2c1)N(C)C ZINC001715832198 1418685500 /nfs/dbraw/zinc/68/55/00/1418685500.db2.gz CVTMQRLXTKZGHO-WHXUGTBJSA-N 1 3 339.483 2.942 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)cs1 ZINC001715833111 1418686135 /nfs/dbraw/zinc/68/61/35/1418686135.db2.gz LEAWBRGNQZDRKB-ZFRRBFPSSA-N 1 3 347.528 2.835 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)cs1 ZINC001715833111 1418686138 /nfs/dbraw/zinc/68/61/38/1418686138.db2.gz LEAWBRGNQZDRKB-ZFRRBFPSSA-N 1 3 347.528 2.835 10 0 EFAEHO CC(C)=CC[NH2+]CC[C@@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001716174828 1418714630 /nfs/dbraw/zinc/71/46/30/1418714630.db2.gz ZRXKDWSOAYIOPM-QAPCUYQASA-N 1 3 327.488 2.650 10 0 EFAEHO CCN(CCNCc1cncc(C)c1)C(=O)[C@H]1CCCC[N@@H+]1C(C)C ZINC001716243750 1418735941 /nfs/dbraw/zinc/73/59/41/1418735941.db2.gz MHYFRIFKODRDOY-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO CCN(CCNCc1cncc(C)c1)C(=O)[C@H]1CCCC[N@H+]1C(C)C ZINC001716243750 1418735944 /nfs/dbraw/zinc/73/59/44/1418735944.db2.gz MHYFRIFKODRDOY-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@H]([NH2+]C/C=C\CNC(=O)CN1CC[C@@H](C)C1)c1ccc(F)cc1 ZINC001716344296 1418788093 /nfs/dbraw/zinc/78/80/93/1418788093.db2.gz SZIVMLLKWLHISQ-NJGOIUGXSA-N 1 3 347.478 2.881 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC/C=C/C[NH2+]Cc1cc(C)cc(C)c1 ZINC001716380271 1418862354 /nfs/dbraw/zinc/86/23/54/1418862354.db2.gz ZMNRLTVQADKLLQ-YJJPMGAVSA-N 1 3 343.515 2.940 10 0 EFAEHO C[C@H](C[NH2+]CC/C=C/c1ccccc1)NC(=O)C1(N(C)C)CCC1 ZINC001716399418 1418873576 /nfs/dbraw/zinc/87/35/76/1418873576.db2.gz JKMKJGVLWFTFAK-SNQZOLJRSA-N 1 3 329.488 2.669 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+][C@H]1CCc2c1cccc2F ZINC001716586687 1418918761 /nfs/dbraw/zinc/91/87/61/1418918761.db2.gz DATRKCLYUPXOHM-SFHVURJKSA-N 1 3 335.467 2.591 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[NH2+]Cc1ccc(F)cc1 ZINC001716586919 1418918774 /nfs/dbraw/zinc/91/87/74/1418918774.db2.gz KKGGOEPTZZFMPK-GOSISDBHSA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+]C[C@H]1CCc2ccccc2C1 ZINC001716586943 1418918907 /nfs/dbraw/zinc/91/89/07/1418918907.db2.gz LKZCILQDTPFJRN-SFHVURJKSA-N 1 3 345.531 2.570 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+]CCC2=CCCCC2)C2CC2)CCC1 ZINC001716613385 1418924854 /nfs/dbraw/zinc/92/48/54/1418924854.db2.gz YFFXVILERGPKCK-GOSISDBHSA-N 1 3 333.520 2.846 10 0 EFAEHO CC[C@H]1CN(C(=O)c2cccc(CN(C)C)c2)CC[C@H]1[NH2+]CCCF ZINC001716642032 1418936239 /nfs/dbraw/zinc/93/62/39/1418936239.db2.gz FVKRCYGNUWOIQW-PKOBYXMFSA-N 1 3 349.494 2.938 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001716703707 1418962676 /nfs/dbraw/zinc/96/26/76/1418962676.db2.gz FSJVXNVIPHOESI-QGZVFWFLSA-N 1 3 332.492 2.703 10 0 EFAEHO CCCCC[N@H+]1CC[C@@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001716703707 1418962678 /nfs/dbraw/zinc/96/26/78/1418962678.db2.gz FSJVXNVIPHOESI-QGZVFWFLSA-N 1 3 332.492 2.703 10 0 EFAEHO CC/C=C\CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)[C@@H]1CCCN1C ZINC001716705358 1418964191 /nfs/dbraw/zinc/96/41/91/1418964191.db2.gz XCWZSNUBAZTKTB-UMNVOXEQSA-N 1 3 333.520 2.939 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H]2C[NH2+]C/C=C/c2ccccc2)C1 ZINC001716784169 1419007025 /nfs/dbraw/zinc/00/70/25/1419007025.db2.gz MDMJXDHCGHCXHB-QKHICEAHSA-N 1 3 341.499 2.622 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@]1(C)CCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001716864393 1419063097 /nfs/dbraw/zinc/06/30/97/1419063097.db2.gz HZAPFMURBCFKRV-APWZRJJASA-N 1 3 341.515 2.827 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@@H]1CN(C(=O)CN2CCC(C)CC2)C[C@@H]1C ZINC001716992058 1419129279 /nfs/dbraw/zinc/12/92/79/1419129279.db2.gz LNTZMTBPUCJCBR-OBNUAKFSSA-N 1 3 335.536 2.759 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@@H](C(=O)N(CCNCCF)Cc2ccccc2)C1 ZINC001717006250 1419142450 /nfs/dbraw/zinc/14/24/50/1419142450.db2.gz HJEKDCPSFZEPHE-MOPGFXCFSA-N 1 3 349.494 2.695 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H](CC[NH2+]CC=C(Cl)Cl)C2)CCC1 ZINC001717088466 1419198973 /nfs/dbraw/zinc/19/89/73/1419198973.db2.gz WMEFQJFEOLRMDX-CYBMUJFWSA-N 1 3 348.318 2.618 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+]Cc2c(C)cccc2C)C1 ZINC001717107547 1419212555 /nfs/dbraw/zinc/21/25/55/1419212555.db2.gz MOWDWEMSMPJVGU-LJQANCHMSA-N 1 3 345.531 2.973 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+]Cc2c(C)cccc2C)C1 ZINC001717107546 1419212690 /nfs/dbraw/zinc/21/26/90/1419212690.db2.gz MOWDWEMSMPJVGU-IBGZPJMESA-N 1 3 345.531 2.973 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@H](CC[NH2+]CCC(F)(F)F)C1 ZINC001717110531 1419215207 /nfs/dbraw/zinc/21/52/07/1419215207.db2.gz FPRLWLBJYDMKBO-GJZGRUSLSA-N 1 3 349.441 2.641 10 0 EFAEHO CCCC[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CCC1 ZINC001717157817 1419241925 /nfs/dbraw/zinc/24/19/25/1419241925.db2.gz WVPVPOLTRNSKFO-GOSISDBHSA-N 1 3 327.488 2.628 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N[C@H]1CCCN(C/C=C\Cl)CC1 ZINC001717203587 1419264801 /nfs/dbraw/zinc/26/48/01/1419264801.db2.gz YDVSMWDOXQGCKN-IVEQORNPSA-N 1 3 341.927 2.976 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H]1C[N@H+](C)CC=C(C)C ZINC001717365450 1419358269 /nfs/dbraw/zinc/35/82/69/1419358269.db2.gz NDQGUVKZXUHVTQ-IRXDYDNUSA-N 1 3 327.488 2.555 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H]1C[N@@H+](C)CC=C(C)C ZINC001717365450 1419358274 /nfs/dbraw/zinc/35/82/74/1419358274.db2.gz NDQGUVKZXUHVTQ-IRXDYDNUSA-N 1 3 327.488 2.555 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@@H]2C[N@H+](C)CCCCCF)CC1 ZINC001717372314 1419365035 /nfs/dbraw/zinc/36/50/35/1419365035.db2.gz GLNDIPHICZXFJZ-GOSISDBHSA-N 1 3 341.515 2.781 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@@H]2C[N@@H+](C)CCCCCF)CC1 ZINC001717372314 1419365036 /nfs/dbraw/zinc/36/50/36/1419365036.db2.gz GLNDIPHICZXFJZ-GOSISDBHSA-N 1 3 341.515 2.781 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H](C)[C@@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001717412790 1419384115 /nfs/dbraw/zinc/38/41/15/1419384115.db2.gz KTCFSENTWMABJE-ZWKOTPCHSA-N 1 3 345.531 2.895 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H]1C[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001717647765 1419485936 /nfs/dbraw/zinc/48/59/36/1419485936.db2.gz GHBMOSSBPJYWKC-BXWFABGCSA-N 1 3 339.499 2.650 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)c1 ZINC001717831510 1419562016 /nfs/dbraw/zinc/56/20/16/1419562016.db2.gz YHJPSDZKFYZTGZ-ICSRJNTNSA-N 1 3 345.531 2.847 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@@H](C[NH2+]CCCC3CCC3)C2)CCC1 ZINC001717871816 1419595390 /nfs/dbraw/zinc/59/53/90/1419595390.db2.gz CZHVMSRPTIWJML-MSOLQXFVSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@H](C(=O)N[C@@H](C[NH2+]CCCF)C(C)(C)C)N1CCCCCC1 ZINC001717968782 1419633914 /nfs/dbraw/zinc/63/39/14/1419633914.db2.gz HYKJZSLJYWFTNY-CVEARBPZSA-N 1 3 329.504 2.731 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C[NH2+]CCc1cccs1)C(C)(C)C ZINC001717971454 1419635371 /nfs/dbraw/zinc/63/53/71/1419635371.db2.gz LGWVWELWVRTOHP-INIZCTEOSA-N 1 3 348.516 2.685 10 0 EFAEHO CC(C)=CC[NH2+]C1CC(N(C)C(=O)c2cccc(CN(C)C)c2)C1 ZINC001718000221 1419649777 /nfs/dbraw/zinc/64/97/77/1419649777.db2.gz CYIVYORVWUDEGF-UHFFFAOYSA-N 1 3 329.488 2.907 10 0 EFAEHO CN(C)C1(C(=O)NCC2=CC[N@H+](C[C@@H]3CC[C@H]4C[C@H]4C3)CC2)CCC1 ZINC001718022522 1419662016 /nfs/dbraw/zinc/66/20/16/1419662016.db2.gz YAOWNWYRRHMRHH-CEXWTWQISA-N 1 3 345.531 2.655 10 0 EFAEHO CN(C)C1(C(=O)NCC2=CC[N@@H+](C[C@@H]3CC[C@H]4C[C@H]4C3)CC2)CCC1 ZINC001718022522 1419662019 /nfs/dbraw/zinc/66/20/19/1419662019.db2.gz YAOWNWYRRHMRHH-CEXWTWQISA-N 1 3 345.531 2.655 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](CC2CC3(CCC3)C2)CC1 ZINC001718031931 1419670384 /nfs/dbraw/zinc/67/03/84/1419670384.db2.gz CARHNVSEDXCVND-UHFFFAOYSA-N 1 3 333.520 2.657 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](CC2CC3(CCC3)C2)CC1 ZINC001718031931 1419670386 /nfs/dbraw/zinc/67/03/86/1419670386.db2.gz CARHNVSEDXCVND-UHFFFAOYSA-N 1 3 333.520 2.657 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CCCC[C@H]1C[NH2+]CCC(C)(C)C ZINC001722953867 1424382249 /nfs/dbraw/zinc/38/22/49/1424382249.db2.gz LIWCIJCYISVWSW-HOTGVXAUSA-N 1 3 334.508 2.961 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CCCN(C)C(=O)CN(C)C2CCC2)c1 ZINC001723038281 1424407719 /nfs/dbraw/zinc/40/77/19/1424407719.db2.gz FALXPOUZUAKCSY-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)[C@H]1CCCN1C)c1ccc(Cl)cc1 ZINC001723093002 1424421412 /nfs/dbraw/zinc/42/14/12/1424421412.db2.gz RMNRROXZFZTBSQ-RHSMWYFYSA-N 1 3 337.895 2.933 10 0 EFAEHO CCc1cccc(C[NH2+]CCCN(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001723122704 1424428642 /nfs/dbraw/zinc/42/86/42/1424428642.db2.gz ITWSHJGONIUSOI-KRWDZBQOSA-N 1 3 331.504 2.529 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[NH2+][C@H]1CCc2ccccc21 ZINC001723203510 1424451433 /nfs/dbraw/zinc/45/14/33/1424451433.db2.gz KXFWZCUNLXMMKX-PMACEKPBSA-N 1 3 343.515 2.986 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[NH2+][C@@H]1CCc2ccccc21 ZINC001723203513 1424451794 /nfs/dbraw/zinc/45/17/94/1424451794.db2.gz KXFWZCUNLXMMKX-WOJBJXKFSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)(C(=O)N[C@H](C[NH2+]CCC(F)(F)F)C1CC1)N1CCCCC1 ZINC001723300748 1424461704 /nfs/dbraw/zinc/46/17/04/1424461704.db2.gz MHEGPEXTBLRHBT-CQSZACIVSA-N 1 3 349.441 2.688 10 0 EFAEHO CCC/C=C/CC[NH2+][C@@H]1CCN(C(=O)Cc2c[nH]cn2)C[C@H]1CC ZINC001723380412 1424481424 /nfs/dbraw/zinc/48/14/24/1424481424.db2.gz YOWAMRIVTVULAD-WXYTYNPNSA-N 1 3 332.492 2.915 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC[C@H]2CCN2CCC2=CCCCC2)CC1 ZINC001723462917 1424503977 /nfs/dbraw/zinc/50/39/77/1424503977.db2.gz XIZRZCJIFNCLBG-LJQANCHMSA-N 1 3 333.520 2.799 10 0 EFAEHO CCCCC[N@@H+]1CCC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001723678080 1424553305 /nfs/dbraw/zinc/55/33/05/1424553305.db2.gz BUPGBKCQFNPUGJ-QUCCMNQESA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCC[N@H+]1CCC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001723678080 1424553307 /nfs/dbraw/zinc/55/33/07/1424553307.db2.gz BUPGBKCQFNPUGJ-QUCCMNQESA-N 1 3 335.536 2.833 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001723718960 1424566445 /nfs/dbraw/zinc/56/64/45/1424566445.db2.gz NCCUGZLTCGTLPC-VOFKWLDRSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001723718960 1424566452 /nfs/dbraw/zinc/56/64/52/1424566452.db2.gz NCCUGZLTCGTLPC-VOFKWLDRSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001723718959 1424566758 /nfs/dbraw/zinc/56/67/58/1424566758.db2.gz NCCUGZLTCGTLPC-UEKDZROGSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001723718959 1424566760 /nfs/dbraw/zinc/56/67/60/1424566760.db2.gz NCCUGZLTCGTLPC-UEKDZROGSA-N 1 3 333.520 2.751 10 0 EFAEHO CN(C(=O)CCCC[NH+]1CCCC1)C1CN(CC2CCCCC2)C1 ZINC001723828196 1424586602 /nfs/dbraw/zinc/58/66/02/1424586602.db2.gz YPZOFPJFUQNOQM-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CCCCC(F)(F)F)CCN1C(=O)Cc1c[nH]cn1 ZINC001723865002 1424598542 /nfs/dbraw/zinc/59/85/42/1424598542.db2.gz ZULSGSTZDABLRX-CHWSQXEVSA-N 1 3 346.397 2.654 10 0 EFAEHO CN(CC(=O)N1CC[C@](C)(C[NH2+]CCCC2CCC2)C1)C1CCC1 ZINC001724223020 1424705303 /nfs/dbraw/zinc/70/53/03/1424705303.db2.gz NXIIMECNGGCCPT-HXUWFJFHSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)=CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1(N(C)C)CCC1)C2 ZINC001724612509 1424832982 /nfs/dbraw/zinc/83/29/82/1424832982.db2.gz GQKPGENJMUXRHN-BCDXTJNWSA-N 1 3 333.520 2.796 10 0 EFAEHO CC(C)=CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1(N(C)C)CCC1)C2 ZINC001724612509 1424832993 /nfs/dbraw/zinc/83/29/93/1424832993.db2.gz GQKPGENJMUXRHN-BCDXTJNWSA-N 1 3 333.520 2.796 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@H](C[NH2+]CC[C@@H](C)F)CC1 ZINC001724614664 1424835648 /nfs/dbraw/zinc/83/56/48/1424835648.db2.gz TXAXHKFETVQCOQ-FVQBIDKESA-N 1 3 338.471 2.521 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](CC[NH2+]Cc2ccccc2)C1)CC(C)(C)C ZINC001724717474 1424936105 /nfs/dbraw/zinc/93/61/05/1424936105.db2.gz CYWFKEZKEVUSSJ-LJQANCHMSA-N 1 3 345.531 2.993 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1CC(C[NH2+]CCC2=CCCCC2)C1 ZINC001725074066 1425283611 /nfs/dbraw/zinc/28/36/11/1425283611.db2.gz KKTIBMLUDZFMBU-UHFFFAOYSA-N 1 3 330.476 2.636 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H](C)[NH2+]CCCc1ccccc1C ZINC001725132097 1425322093 /nfs/dbraw/zinc/32/20/93/1425322093.db2.gz RZQBLJOHPXLESI-JKSUJKDBSA-N 1 3 342.487 2.685 10 0 EFAEHO Cc1ccc(C[NH2+]CCC[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cc1F ZINC001725412492 1425556452 /nfs/dbraw/zinc/55/64/52/1425556452.db2.gz DCSFLCOTIDHPDC-DOTOQJQBSA-N 1 3 349.494 2.850 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+]Cc1cccc(Cl)c1 ZINC001725414157 1425558668 /nfs/dbraw/zinc/55/86/68/1425558668.db2.gz PIBURAUSHIZHMC-CYBMUJFWSA-N 1 3 348.878 2.989 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CCC[NH2+]CCC(F)(F)F ZINC001725455761 1425593055 /nfs/dbraw/zinc/59/30/55/1425593055.db2.gz FEVDAUWJYSSPKZ-KGLIPLIRSA-N 1 3 337.430 2.688 10 0 EFAEHO C[C@@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]CCCCC(F)(F)F ZINC001725488247 1425615196 /nfs/dbraw/zinc/61/51/96/1425615196.db2.gz HFJDJRKYCOJBRB-ZDUSSCGKSA-N 1 3 337.430 2.640 10 0 EFAEHO C[C@@H]1[C@@H]([NH2+]CC/C=C/c2ccccc2)CCN1C(=O)Cc1c[nH]cn1 ZINC001725569382 1425655562 /nfs/dbraw/zinc/65/55/62/1425655562.db2.gz RJEDHTZGKYYNEJ-RCCFSGOVSA-N 1 3 338.455 2.635 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CCCc2ccccc2)CN1C(=O)CN(C)C1CCC1 ZINC001725606054 1425694451 /nfs/dbraw/zinc/69/44/51/1425694451.db2.gz YCYCQHSMEYODCG-MJGOQNOKSA-N 1 3 343.515 2.683 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)[C@@H]1C ZINC001725610751 1425701647 /nfs/dbraw/zinc/70/16/47/1425701647.db2.gz YBUIIDAULADABA-QUCCMNQESA-N 1 3 345.531 2.847 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]21 ZINC001725632356 1425731808 /nfs/dbraw/zinc/73/18/08/1425731808.db2.gz RKXBLHZIXGPSRE-NZSAHSFTSA-N 1 3 333.520 2.654 10 0 EFAEHO CN(C)C1(C(=O)N(C)C2CC([NH2+]CCCCC(F)(F)F)C2)CCC1 ZINC001725780713 1425845453 /nfs/dbraw/zinc/84/54/53/1425845453.db2.gz WEIBLBCNNSZFNR-UHFFFAOYSA-N 1 3 349.441 2.782 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001725822897 1425882372 /nfs/dbraw/zinc/88/23/72/1425882372.db2.gz AZOLPMNWXRLGMK-SFHVURJKSA-N 1 3 333.520 2.655 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001725822897 1425882385 /nfs/dbraw/zinc/88/23/85/1425882385.db2.gz AZOLPMNWXRLGMK-SFHVURJKSA-N 1 3 333.520 2.655 10 0 EFAEHO COCC[NH2+]Cc1ccc(CNC(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)c(F)c1 ZINC001725835935 1425903913 /nfs/dbraw/zinc/90/39/13/1425903913.db2.gz ABUFGVSMCNKFJM-UWWQBHOKSA-N 1 3 346.446 2.780 10 0 EFAEHO COCCOc1ccc([C@H](C)[NH2+]C[C@H]2CNCCC2(F)F)cc1 ZINC000925784436 717927942 /nfs/dbraw/zinc/92/79/42/717927942.db2.gz RIRHXILBOMJVEW-DZGCQCFKSA-N 1 3 328.403 2.607 10 0 EFAEHO COCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CNCCC2(F)F)cc1 ZINC000925784439 717928031 /nfs/dbraw/zinc/92/80/31/717928031.db2.gz RIRHXILBOMJVEW-ZFWWWQNUSA-N 1 3 328.403 2.607 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CCCC[C@H]2[NH2+]1 ZINC000261547902 714240057 /nfs/dbraw/zinc/24/00/57/714240057.db2.gz IXLXMLUPFZXXKH-OWYHZJEWSA-N 1 3 329.488 2.544 10 0 EFAEHO FC(F)(F)C(F)(F)OCCN[C@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925732182 716716429 /nfs/dbraw/zinc/71/64/29/716716429.db2.gz WQHWLOLMLLRDBK-NEPJUHHUSA-N 1 3 330.341 2.916 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@H]1CCC[C@@H](C(F)(F)F)O1 ZINC000925835246 719520807 /nfs/dbraw/zinc/52/08/07/719520807.db2.gz QYMUQCKULGMKOG-ZBINZKHDSA-N 1 3 331.382 2.999 10 0 EFAEHO N[C@H]1C[C@@H]([NH2+]CC2(n3cc(Br)cn3)CC2)c2ccccc21 ZINC000925837027 719580187 /nfs/dbraw/zinc/58/01/87/719580187.db2.gz BNNVCYKGSFTRMX-LSDHHAIUSA-N 1 3 347.260 2.869 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2[NH2+]1 ZINC000261547903 719615783 /nfs/dbraw/zinc/61/57/83/719615783.db2.gz IXLXMLUPFZXXKH-YSHGAJCASA-N 1 3 329.488 2.544 10 0 EFAEHO Cc1n[nH]c(CN(C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c1C ZINC000894075785 720269583 /nfs/dbraw/zinc/26/95/83/720269583.db2.gz KAEXNXQNVFZZIS-UHFFFAOYSA-N 1 3 347.551 2.655 10 0 EFAEHO COc1ccc(CCN[C@@H]2C[C@@H]([NH3+])C23CCC3)cc1OC(F)F ZINC000925557153 720390356 /nfs/dbraw/zinc/39/03/56/720390356.db2.gz KISYJCWWWPWOKZ-HUUCEWRRSA-N 1 3 326.387 2.699 10 0 EFAEHO CC1(C)C[C@@H](NCCOc2ccc(C(F)(F)F)cn2)C[C@@H]([NH3+])C1 ZINC000925619692 720598665 /nfs/dbraw/zinc/59/86/65/720598665.db2.gz QRAXTHCGIIWYFX-OLZOCXBDSA-N 1 3 331.382 2.975 10 0 EFAEHO CN1C[C@H]2CC[C@@H](C1)C2[NH2+]CC1CCN(C(=O)OC(C)(C)C)CC1 ZINC000924894744 721206785 /nfs/dbraw/zinc/20/67/85/721206785.db2.gz GBEKDHUOXDGXSA-SJPCQFCGSA-N 1 3 337.508 2.563 10 0 EFAEHO C[C@H](N[C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccnnc1 ZINC000924962845 721906680 /nfs/dbraw/zinc/90/66/80/721906680.db2.gz GVLSHJZZFQWOPW-GJZGRUSLSA-N 1 3 343.450 2.779 10 0 EFAEHO C[C@@H](N[C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccnnc1 ZINC000924962847 721906816 /nfs/dbraw/zinc/90/68/16/721906816.db2.gz GVLSHJZZFQWOPW-HUUCEWRRSA-N 1 3 343.450 2.779 10 0 EFAEHO COC(=O)[C@@H]1[C@H](C[NH2+]CC[C@@H](C)N(C)Cc2ccccc2)C1(F)F ZINC000894323932 722092430 /nfs/dbraw/zinc/09/24/30/722092430.db2.gz SJSKCTCBKHRTNI-KBMXLJTQSA-N 1 3 340.414 2.541 10 0 EFAEHO CCN(Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1[C@@H](C(=O)OC)C1(F)F ZINC000894764251 722841707 /nfs/dbraw/zinc/84/17/07/722841707.db2.gz GCTWBJPJYMDMIW-CVEARBPZSA-N 1 3 340.414 2.624 10 0 EFAEHO COC(=O)[C@H]1C[C@H]([NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C1 ZINC000895349792 724061028 /nfs/dbraw/zinc/06/10/28/724061028.db2.gz IURMAHIKLLSMLI-VMXHOPILSA-N 1 3 328.456 2.581 10 0 EFAEHO COC(=O)[C@H]1C[C@H](N[C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1 ZINC000895349792 724061030 /nfs/dbraw/zinc/06/10/30/724061030.db2.gz IURMAHIKLLSMLI-VMXHOPILSA-N 1 3 328.456 2.581 10 0 EFAEHO COC(=O)[C@H]1C[C@H](N[C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1 ZINC000895349792 724061034 /nfs/dbraw/zinc/06/10/34/724061034.db2.gz IURMAHIKLLSMLI-VMXHOPILSA-N 1 3 328.456 2.581 10 0 EFAEHO C[C@H](CN(C)C)[C@H]1CCCC[N@@H+]1Cc1cccn(C(F)F)c1=O ZINC000895378555 724088864 /nfs/dbraw/zinc/08/88/64/724088864.db2.gz IPJDSOUGJNVNIC-UKRRQHHQSA-N 1 3 327.419 2.796 10 0 EFAEHO C[C@H](CN(C)C)[C@H]1CCCC[N@H+]1Cc1cccn(C(F)F)c1=O ZINC000895378555 724088867 /nfs/dbraw/zinc/08/88/67/724088867.db2.gz IPJDSOUGJNVNIC-UKRRQHHQSA-N 1 3 327.419 2.796 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)CC1(C)C ZINC000895508516 724173827 /nfs/dbraw/zinc/17/38/27/724173827.db2.gz SORIJIDQMBIICS-DLBZAZTESA-N 1 3 343.471 2.577 10 0 EFAEHO C[C@@H]1CN(Cc2ccc(C[N@H+](C)Cc3cn[nH]c3)cc2)C[C@H](C)O1 ZINC000895740344 724289094 /nfs/dbraw/zinc/28/90/94/724289094.db2.gz ROJMTMZPWKKKEY-IYBDPMFKSA-N 1 3 328.460 2.651 10 0 EFAEHO C[C@@H]1CN(Cc2ccc(C[N@@H+](C)Cc3cn[nH]c3)cc2)C[C@H](C)O1 ZINC000895740344 724289097 /nfs/dbraw/zinc/28/90/97/724289097.db2.gz ROJMTMZPWKKKEY-IYBDPMFKSA-N 1 3 328.460 2.651 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccc(CN(C)Cc3cn[nH]c3)cc2)C[C@H](C)O1 ZINC000895740344 724289098 /nfs/dbraw/zinc/28/90/98/724289098.db2.gz ROJMTMZPWKKKEY-IYBDPMFKSA-N 1 3 328.460 2.651 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccc(CN(C)Cc3cn[nH]c3)cc2)C[C@H](C)O1 ZINC000895740344 724289102 /nfs/dbraw/zinc/28/91/02/724289102.db2.gz ROJMTMZPWKKKEY-IYBDPMFKSA-N 1 3 328.460 2.651 10 0 EFAEHO C[NH+]1CCC(C)(CNC(=O)c2ccc(NC3=NCCC3)cc2)CC1 ZINC000907260045 726903825 /nfs/dbraw/zinc/90/38/25/726903825.db2.gz GRIVDTDEGYXZKN-UHFFFAOYSA-N 1 3 328.460 2.753 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC000909919681 727393629 /nfs/dbraw/zinc/39/36/29/727393629.db2.gz YYVJXAHRAZCEPS-IRXDYDNUSA-N 1 3 335.517 2.655 10 0 EFAEHO CN(C)CCN(Cc1ccsc1)C(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC000909919681 727393630 /nfs/dbraw/zinc/39/36/30/727393630.db2.gz YYVJXAHRAZCEPS-IRXDYDNUSA-N 1 3 335.517 2.655 10 0 EFAEHO CC(C)N(C(=O)C12CC[NH+](CC1)C2)[C@H]1CCN(Cc2ccccc2)C1 ZINC000911542380 727560448 /nfs/dbraw/zinc/56/04/48/727560448.db2.gz TUTDTJQKYMLFLZ-IBGZPJMESA-N 1 3 341.499 2.594 10 0 EFAEHO CC(C)N(C(=O)C12CC[NH+](CC1)C2)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000911542382 727560463 /nfs/dbraw/zinc/56/04/63/727560463.db2.gz TUTDTJQKYMLFLZ-LJQANCHMSA-N 1 3 341.499 2.594 10 0 EFAEHO O=C(N[C@H]1C[C@@H]([NH+]2CCCC2)C1)c1ccc(NC2=NCCC2)cc1 ZINC000911582499 727565024 /nfs/dbraw/zinc/56/50/24/727565024.db2.gz SQQYTYFDONNDIB-CALCHBBNSA-N 1 3 326.444 2.647 10 0 EFAEHO COC[C@@H]1C[N@@H+](C2CCC2)CC12CCN(Cc1ccncc1)CC2 ZINC000169782611 728404703 /nfs/dbraw/zinc/40/47/03/728404703.db2.gz HDLGOAARSDQKLO-SFHVURJKSA-N 1 3 329.488 2.795 10 0 EFAEHO COC[C@@H]1C[N@H+](C2CCC2)CC12CCN(Cc1ccncc1)CC2 ZINC000169782611 728404706 /nfs/dbraw/zinc/40/47/06/728404706.db2.gz HDLGOAARSDQKLO-SFHVURJKSA-N 1 3 329.488 2.795 10 0 EFAEHO Cc1ncsc1CN1CCC2(C[N@@H+](C3CCC3)C[C@H]2CO)CC1 ZINC000169783594 728405337 /nfs/dbraw/zinc/40/53/37/728405337.db2.gz NYTBGBGMFAAZEF-HNNXBMFYSA-N 1 3 335.517 2.510 10 0 EFAEHO Cc1ncsc1CN1CCC2(C[N@H+](C3CCC3)C[C@H]2CO)CC1 ZINC000169783594 728405341 /nfs/dbraw/zinc/40/53/41/728405341.db2.gz NYTBGBGMFAAZEF-HNNXBMFYSA-N 1 3 335.517 2.510 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001569466853 1085259771 /nfs/dbraw/zinc/25/97/71/1085259771.db2.gz GRPLAATUNRNTPP-CFQKCQFKSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001569466853 1085259782 /nfs/dbraw/zinc/25/97/82/1085259782.db2.gz GRPLAATUNRNTPP-CFQKCQFKSA-N 1 3 347.547 2.999 10 0 EFAEHO CCc1ccc(CC[NH2+]C[C@@H]2CCCN2C(=O)[C@H](CC)N(C)C)cc1 ZINC001569556124 1085372650 /nfs/dbraw/zinc/37/26/50/1085372650.db2.gz WQMUJUNYOZTZMO-PMACEKPBSA-N 1 3 345.531 2.712 10 0 EFAEHO Cc1ncccc1CN1CCC(C)(NC(=O)CCCC[NH+](C)C)CC1 ZINC001569577260 1085396350 /nfs/dbraw/zinc/39/63/50/1085396350.db2.gz KOXNAJVQUKWWNV-UHFFFAOYSA-N 1 3 346.519 2.593 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@H](NC(=O)C(C)(C)N1CCCC1)C1CCCC1 ZINC001569606361 1085431700 /nfs/dbraw/zinc/43/17/00/1085431700.db2.gz FFOLVONHLLDBFD-NVXWUHKLSA-N 1 3 341.515 2.874 10 0 EFAEHO CN(CC(=O)N1CC[C@@](C)(C[NH2+]CCC2CCCC2)C1)C1CCC1 ZINC001569672664 1085504191 /nfs/dbraw/zinc/50/41/91/1085504191.db2.gz MQBIZDCYEBAZAU-FQEVSTJZSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[C@H](C[NH2+]C/C=C/Cl)CC1)N(C)C ZINC001569865966 1085692494 /nfs/dbraw/zinc/69/24/94/1085692494.db2.gz BTBCZMMJBMUWKZ-BNQIEWIESA-N 1 3 343.943 2.837 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H]2[C@H]1CCCN2C(=O)C(C)(C)c1c[nH]cn1 ZINC001569915863 1085762945 /nfs/dbraw/zinc/76/29/45/1085762945.db2.gz VJQWRIRPKAVLSO-CVEARBPZSA-N 1 3 332.492 2.943 10 0 EFAEHO CCCCC[N@H+]1CC[C@H]2[C@H]1CCCN2C(=O)C(C)(C)c1c[nH]cn1 ZINC001569915863 1085762954 /nfs/dbraw/zinc/76/29/54/1085762954.db2.gz VJQWRIRPKAVLSO-CVEARBPZSA-N 1 3 332.492 2.943 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](CC[NH2+]CC3CC4(CCC4)C3)C2)C1 ZINC001570004506 1085846027 /nfs/dbraw/zinc/84/60/27/1085846027.db2.gz KAXHKYFKDBJCHF-QZTJIDSGSA-N 1 3 347.547 2.737 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+]CC2CC3(CCC3)C2)C1 ZINC001570016193 1085864028 /nfs/dbraw/zinc/86/40/28/1085864028.db2.gz YUVLRLYJQRAEDM-QGZVFWFLSA-N 1 3 335.536 2.737 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](CC[NH2+]C/C=C\c2ccccc2)C1 ZINC001570018640 1085867871 /nfs/dbraw/zinc/86/78/71/1085867871.db2.gz HEMTXLJXQJDUAY-QKWWCAPFSA-N 1 3 341.499 2.624 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]Cc2ccccc2)C1 ZINC001570021206 1085869347 /nfs/dbraw/zinc/86/93/47/1085869347.db2.gz CMTUUAFXLJDDER-WOJBJXKFSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[C@H](C[NH2+]C/C=C/Cl)CC1)N1CCCC1 ZINC001570042973 1085896197 /nfs/dbraw/zinc/89/61/97/1085896197.db2.gz BEEBEHWQZJQWFX-VKULFDBSSA-N 1 3 341.927 2.878 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+]CC2=CCCCC2)CCC1 ZINC001570104031 1085950120 /nfs/dbraw/zinc/95/01/20/1085950120.db2.gz PZVKCEXOCQIWOE-GOSISDBHSA-N 1 3 333.520 2.988 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(C)([NH2+]CCCCCF)CC1 ZINC001570388057 1086188242 /nfs/dbraw/zinc/18/82/42/1086188242.db2.gz WAGUDKZSHHZRKY-KRWDZBQOSA-N 1 3 341.515 2.971 10 0 EFAEHO CCC[NH2+]CC1(c2ccccc2)CCN(C(=O)[C@@H](CC)N(C)C)CC1 ZINC001570405823 1086207968 /nfs/dbraw/zinc/20/79/68/1086207968.db2.gz JGCQVPKJOQLGTD-LJQANCHMSA-N 1 3 345.531 2.887 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1C[C@H](C[NH2+]CC[C@H]2CCC[C@@H](C)C2)C1 ZINC001571187316 1086675266 /nfs/dbraw/zinc/67/52/66/1086675266.db2.gz WJXQMJNNVRSDAX-VDHUWJSZSA-N 1 3 346.519 2.961 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1C[C@H](C[NH2+]CC[C@H]2CCC[C@H](C)C2)C1 ZINC001571187315 1086675568 /nfs/dbraw/zinc/67/55/68/1086675568.db2.gz WJXQMJNNVRSDAX-RANZSIQMSA-N 1 3 346.519 2.961 10 0 EFAEHO CC(C)(C)[C@H](CNCCF)NC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001571630314 1087001306 /nfs/dbraw/zinc/00/13/06/1087001306.db2.gz FBULLQSFWCFOKB-SJORKVTESA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)(C)[C@H](CNCCF)NC(=O)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001571630314 1087001315 /nfs/dbraw/zinc/00/13/15/1087001315.db2.gz FBULLQSFWCFOKB-SJORKVTESA-N 1 3 341.515 2.874 10 0 EFAEHO CN(C)C1(C(=O)NCC2=CC[N@H+](CC3=CCCCC3)CC2)CCC1 ZINC001571689453 1087053048 /nfs/dbraw/zinc/05/30/48/1087053048.db2.gz WZWNIHNLCAKOJB-UHFFFAOYSA-N 1 3 331.504 2.719 10 0 EFAEHO CN(C)C1(C(=O)NCC2=CC[N@@H+](CC3=CCCCC3)CC2)CCC1 ZINC001571689453 1087053055 /nfs/dbraw/zinc/05/30/55/1087053055.db2.gz WZWNIHNLCAKOJB-UHFFFAOYSA-N 1 3 331.504 2.719 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+](CC2CCC(C)CC2)CC1)N(C)C ZINC001571689766 1087054619 /nfs/dbraw/zinc/05/46/19/1087054619.db2.gz GHYHFHASGGFAMW-NKELODKYSA-N 1 3 335.536 2.901 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+](CC2CCC(C)CC2)CC1)N(C)C ZINC001571689766 1087054624 /nfs/dbraw/zinc/05/46/24/1087054624.db2.gz GHYHFHASGGFAMW-NKELODKYSA-N 1 3 335.536 2.901 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC2=CC[N@H+](CCC3=CCCCC3)CC2)C1 ZINC001571695038 1087062384 /nfs/dbraw/zinc/06/23/84/1087062384.db2.gz AQUXHWDTZOJBOL-GOSISDBHSA-N 1 3 345.531 2.967 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC2=CC[N@@H+](CCC3=CCCCC3)CC2)C1 ZINC001571695038 1087062391 /nfs/dbraw/zinc/06/23/91/1087062391.db2.gz AQUXHWDTZOJBOL-GOSISDBHSA-N 1 3 345.531 2.967 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001571699552 1087070685 /nfs/dbraw/zinc/07/06/85/1087070685.db2.gz UXEDYNHUBWMUDW-QRVBRYPASA-N 1 3 333.520 2.513 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001571699552 1087070689 /nfs/dbraw/zinc/07/06/89/1087070689.db2.gz UXEDYNHUBWMUDW-QRVBRYPASA-N 1 3 333.520 2.513 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001571700869 1087072206 /nfs/dbraw/zinc/07/22/06/1087072206.db2.gz QTWHEDIWXYZXMU-CEXWTWQISA-N 1 3 333.520 2.511 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001571700869 1087072214 /nfs/dbraw/zinc/07/22/14/1087072214.db2.gz QTWHEDIWXYZXMU-CEXWTWQISA-N 1 3 333.520 2.511 10 0 EFAEHO CC(C)CCC[NH2+][C@@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001266970582 1092217335 /nfs/dbraw/zinc/21/73/35/1092217335.db2.gz FLAZODPQFCVQLT-MAUKXSAKSA-N 1 3 329.504 2.729 10 0 EFAEHO Cc1cc(CNCCN(C)C(=O)[C@@H]2CCC[C@@H]([NH+](C)C)C2)cs1 ZINC001266979704 1092232623 /nfs/dbraw/zinc/23/26/23/1092232623.db2.gz IKVRAJRRRCIPPD-IAGOWNOFSA-N 1 3 337.533 2.725 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H]([NH2+]CCCc2ccccc2Cl)C1 ZINC001267006402 1092310646 /nfs/dbraw/zinc/31/06/46/1092310646.db2.gz JTAHNZXCCVXWNG-FUHWJXTLSA-N 1 3 349.906 2.557 10 0 EFAEHO CN(CC(=O)N1CC[C@H](C[NH2+]CCC2=CCCCC2)C1)C1CCC1 ZINC001267043801 1092443481 /nfs/dbraw/zinc/44/34/81/1092443481.db2.gz DUZNTWPNXQPNJB-GOSISDBHSA-N 1 3 333.520 2.799 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@@H]1CCN(C(=O)[C@@H](CC)N(C)C)C1 ZINC001267068011 1092526814 /nfs/dbraw/zinc/52/68/14/1092526814.db2.gz VTGFJPWKHAQJIP-FXAWDEMLSA-N 1 3 345.531 2.570 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]Cc1ccc(F)cc1C ZINC001267117172 1092800432 /nfs/dbraw/zinc/80/04/32/1092800432.db2.gz NXXMOKPPJMHXNR-SFHVURJKSA-N 1 3 335.467 2.557 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCC[N@H+](C)CC2=CCCCC2)c1 ZINC001267232579 1093301021 /nfs/dbraw/zinc/30/10/21/1093301021.db2.gz JHQWNWJIBGLOGH-UHFFFAOYSA-N 1 3 329.488 2.910 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCC[N@@H+](C)CC2=CCCCC2)c1 ZINC001267232579 1093301028 /nfs/dbraw/zinc/30/10/28/1093301028.db2.gz JHQWNWJIBGLOGH-UHFFFAOYSA-N 1 3 329.488 2.910 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H](C[NH2+]CCC(C)(C)C)C1CC1)N(C)C ZINC001283552672 1093627335 /nfs/dbraw/zinc/62/73/35/1093627335.db2.gz JJLASHZHADSZGA-SJORKVTESA-N 1 3 325.541 2.835 10 0 EFAEHO CN(CC[NH2+]CCc1ccc2ccccc2c1)C(=O)[C@H]1CCCN1C ZINC001267355116 1094293316 /nfs/dbraw/zinc/29/33/16/1094293316.db2.gz IWWIRPDNYNDPEN-HXUWFJFHSA-N 1 3 339.483 2.525 10 0 EFAEHO CN(CCNC(=O)CCCC[NH+](C)C)[C@@H]1CCc2c1cccc2F ZINC001480937874 1094404419 /nfs/dbraw/zinc/40/44/19/1094404419.db2.gz LTJZBJLHEVRSIQ-GOSISDBHSA-N 1 3 335.467 2.593 10 0 EFAEHO CN(CC(=O)N(C)CC[NH2+]C[C@@H]1CCCC(F)(F)C1)CC(C)(C)C ZINC001267429181 1094515654 /nfs/dbraw/zinc/51/56/54/1094515654.db2.gz RTQZWHFOSGVIKM-OAHLLOKOSA-N 1 3 347.494 2.838 10 0 EFAEHO CN(CC(=O)N(C)CC[NH2+]C[C@H]1CCCC(F)(F)C1)CC(C)(C)C ZINC001267429180 1094515971 /nfs/dbraw/zinc/51/59/71/1094515971.db2.gz RTQZWHFOSGVIKM-HNNXBMFYSA-N 1 3 347.494 2.838 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[NH2+]C/C=C/c1ccc(Cl)cc1)N(C)C ZINC001267456598 1094557639 /nfs/dbraw/zinc/55/76/39/1094557639.db2.gz CISMFNVFRPSURR-DKRLNXSXSA-N 1 3 337.895 2.741 10 0 EFAEHO O=C(CN1CCCC1)NCC[C@H]1CC[N@@H+](Cc2ccccc2Cl)C1 ZINC001481463451 1094719501 /nfs/dbraw/zinc/71/95/01/1094719501.db2.gz FOBHIOMBUKDBLC-INIZCTEOSA-N 1 3 349.906 2.764 10 0 EFAEHO O=C(CN1CCCC1)NCC[C@H]1CC[N@H+](Cc2ccccc2Cl)C1 ZINC001481463451 1094719512 /nfs/dbraw/zinc/71/95/12/1094719512.db2.gz FOBHIOMBUKDBLC-INIZCTEOSA-N 1 3 349.906 2.764 10 0 EFAEHO O=C(CN1CCCC1)NCC[C@@H]1CC[N@@H+](Cc2ccccc2Cl)C1 ZINC001481463460 1094721338 /nfs/dbraw/zinc/72/13/38/1094721338.db2.gz FOBHIOMBUKDBLC-MRXNPFEDSA-N 1 3 349.906 2.764 10 0 EFAEHO O=C(CN1CCCC1)NCC[C@@H]1CC[N@H+](Cc2ccccc2Cl)C1 ZINC001481463460 1094721349 /nfs/dbraw/zinc/72/13/49/1094721349.db2.gz FOBHIOMBUKDBLC-MRXNPFEDSA-N 1 3 349.906 2.764 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@H+](Cc2ccc(C)cc2C)C1)N(C)C ZINC001481119318 1094736396 /nfs/dbraw/zinc/73/63/96/1094736396.db2.gz SYJRRJPBOKDIEQ-PKOBYXMFSA-N 1 3 331.504 2.582 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@@H+](Cc2ccc(C)cc2C)C1)N(C)C ZINC001481119318 1094736407 /nfs/dbraw/zinc/73/64/07/1094736407.db2.gz SYJRRJPBOKDIEQ-PKOBYXMFSA-N 1 3 331.504 2.582 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]Cc1ccc(C)cc1C ZINC001267473064 1094762537 /nfs/dbraw/zinc/76/25/37/1094762537.db2.gz ADVNITNQQPWDHP-LJQANCHMSA-N 1 3 331.504 2.726 10 0 EFAEHO CCC[N@H+](CCNC(=O)C1(N(C)C)CCC1)C[C@H]1CCC(F)(F)C1 ZINC001481137891 1094925210 /nfs/dbraw/zinc/92/52/10/1094925210.db2.gz ZKYSLKBYOPYOEE-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CCC[N@@H+](CCNC(=O)C1(N(C)C)CCC1)C[C@H]1CCC(F)(F)C1 ZINC001481137891 1094925225 /nfs/dbraw/zinc/92/52/25/1094925225.db2.gz ZKYSLKBYOPYOEE-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@H+](C)CC2CCC(C)CC2)C1 ZINC001481507631 1094991501 /nfs/dbraw/zinc/99/15/01/1094991501.db2.gz CTUFVXHCONDATH-CTWPCTMYSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@@H+](C)CC2CCC(C)CC2)C1 ZINC001481507631 1094991508 /nfs/dbraw/zinc/99/15/08/1094991508.db2.gz CTUFVXHCONDATH-CTWPCTMYSA-N 1 3 337.552 2.933 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001481507801 1094997490 /nfs/dbraw/zinc/99/74/90/1094997490.db2.gz DXJJGLOMORGARY-IBGZPJMESA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001481507801 1094997503 /nfs/dbraw/zinc/99/75/03/1094997503.db2.gz DXJJGLOMORGARY-IBGZPJMESA-N 1 3 345.531 2.924 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)CC1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001481518129 1095071074 /nfs/dbraw/zinc/07/10/74/1095071074.db2.gz HZANVPQPYMNWTP-QGZVFWFLSA-N 1 3 343.531 2.883 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)CC1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001481518129 1095071088 /nfs/dbraw/zinc/07/10/88/1095071088.db2.gz HZANVPQPYMNWTP-QGZVFWFLSA-N 1 3 343.531 2.883 10 0 EFAEHO Cc1cccc(CN2CCC[C@@H](NC(=O)CCCC[NH+](C)C)C2)c1 ZINC001481529968 1095145058 /nfs/dbraw/zinc/14/50/58/1095145058.db2.gz XBCJXJKVAJYJEK-LJQANCHMSA-N 1 3 331.504 2.808 10 0 EFAEHO C[C@@H](C[NH2+]CCCc1ccccc1)N(C)C(=O)C1(N(C)C)CCC1 ZINC001268069484 1095160806 /nfs/dbraw/zinc/16/08/06/1095160806.db2.gz XJUAAEQCCAYLNL-KRWDZBQOSA-N 1 3 331.504 2.540 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]CCc1ccc(Cl)cc1)N(C)C ZINC001268072390 1095169764 /nfs/dbraw/zinc/16/97/64/1095169764.db2.gz UHBQKOVDNIPMNR-WMLDXEAASA-N 1 3 339.911 2.659 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(CCNC(=O)C[C@H]1CC[N@H+](C)C1)C1CC1 ZINC001481194223 1095239061 /nfs/dbraw/zinc/23/90/61/1095239061.db2.gz DGKAEKQGGRHOJH-HZPDHXFCSA-N 1 3 347.478 2.809 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)C1CC1 ZINC001481194223 1095239070 /nfs/dbraw/zinc/23/90/70/1095239070.db2.gz DGKAEKQGGRHOJH-HZPDHXFCSA-N 1 3 347.478 2.809 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[N@H+](CC1CCC2(CC2)CC1)C1CC1 ZINC001481196269 1095251882 /nfs/dbraw/zinc/25/18/82/1095251882.db2.gz YFWICMSLOUKXAF-UHFFFAOYSA-N 1 3 344.503 2.812 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[N@@H+](CC1CCC2(CC2)CC1)C1CC1 ZINC001481196269 1095251890 /nfs/dbraw/zinc/25/18/90/1095251890.db2.gz YFWICMSLOUKXAF-UHFFFAOYSA-N 1 3 344.503 2.812 10 0 EFAEHO CC(C)C[C@@H](CNCC=C(Cl)Cl)NC(=O)C12CC[NH+](CC1)C2 ZINC001268115183 1095393916 /nfs/dbraw/zinc/39/39/16/1095393916.db2.gz OPZSCOUVTYBQMD-ZDUSSCGKSA-N 1 3 348.318 2.522 10 0 EFAEHO CC/C=C/CC[NH2+][C@@H]1CCN(C(=O)CN2CCC(C)CC2)C[C@@H]1C ZINC001268137509 1095475167 /nfs/dbraw/zinc/47/51/67/1095475167.db2.gz HWUAYIATURFKQH-OBNUAKFSSA-N 1 3 335.536 2.901 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@H+](CC2CC3(CCC3)C2)C2CC2)CCC1 ZINC001493377119 1095577642 /nfs/dbraw/zinc/57/76/42/1095577642.db2.gz LQSIFIDCILDWSY-UHFFFAOYSA-N 1 3 333.520 2.632 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@@H+](CC2CC3(CCC3)C2)C2CC2)CCC1 ZINC001493377119 1095577654 /nfs/dbraw/zinc/57/76/54/1095577654.db2.gz LQSIFIDCILDWSY-UHFFFAOYSA-N 1 3 333.520 2.632 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+]CC[C@@H]1CCCCN1C(=O)Cc1c[nH]cn1 ZINC001268162062 1095596373 /nfs/dbraw/zinc/59/63/73/1095596373.db2.gz SUCHRWWCZCXRFH-WMZOPIPTSA-N 1 3 334.508 2.995 10 0 EFAEHO CCCCC[N@H+](CC)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001481000871 1095732249 /nfs/dbraw/zinc/73/22/49/1095732249.db2.gz JFOKXQYFGVVFKJ-SFHVURJKSA-N 1 3 329.504 2.827 10 0 EFAEHO CCCCC[N@@H+](CC)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001481000871 1095732264 /nfs/dbraw/zinc/73/22/64/1095732264.db2.gz JFOKXQYFGVVFKJ-SFHVURJKSA-N 1 3 329.504 2.827 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H]1CCC[N@H+](CCCCCF)C1 ZINC001268193527 1096064128 /nfs/dbraw/zinc/06/41/28/1096064128.db2.gz OAKFBFAGRPTOAU-DLBZAZTESA-N 1 3 327.488 2.581 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H]1CCC[N@@H+](CCCCCF)C1 ZINC001268193527 1096064139 /nfs/dbraw/zinc/06/41/39/1096064139.db2.gz OAKFBFAGRPTOAU-DLBZAZTESA-N 1 3 327.488 2.581 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H]1CCC[N@H+](CCCCCF)C1 ZINC001268193528 1096064404 /nfs/dbraw/zinc/06/44/04/1096064404.db2.gz OAKFBFAGRPTOAU-IRXDYDNUSA-N 1 3 327.488 2.581 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H]1CCC[N@@H+](CCCCCF)C1 ZINC001268193528 1096064414 /nfs/dbraw/zinc/06/44/14/1096064414.db2.gz OAKFBFAGRPTOAU-IRXDYDNUSA-N 1 3 327.488 2.581 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CCC[C@H]1CNC(=O)C(C)(C)N1CCCCC1 ZINC001481039588 1096106961 /nfs/dbraw/zinc/10/69/61/1096106961.db2.gz NMPUGZUWWRCXIZ-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](F)CC[N@H+]1CCC[C@H]1CNC(=O)C(C)(C)N1CCCCC1 ZINC001481039588 1096106964 /nfs/dbraw/zinc/10/69/64/1096106964.db2.gz NMPUGZUWWRCXIZ-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2C[C@@H]3C[C@H]2CN3CC2CCC3(CC3)CC2)CC1 ZINC001481677754 1096299726 /nfs/dbraw/zinc/29/97/26/1096299726.db2.gz LCGVYCQPJCTNFU-ROUUACIJSA-N 1 3 345.531 2.584 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]CC1CC2(CCC2)C1 ZINC001268364106 1096397733 /nfs/dbraw/zinc/39/77/33/1096397733.db2.gz AUXHBWXOTMOFAN-FUHWJXTLSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001268375146 1096424215 /nfs/dbraw/zinc/42/42/15/1096424215.db2.gz NFDPBIPCFRPGFY-CZUORRHYSA-N 1 3 325.884 2.665 10 0 EFAEHO CCCCC[NH2+]CC[C@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001268399773 1096492725 /nfs/dbraw/zinc/49/27/25/1096492725.db2.gz LKAWQFLSYOJFFZ-YJBOKZPZSA-N 1 3 329.504 2.874 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccccc1C1CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001268400166 1096493880 /nfs/dbraw/zinc/49/38/80/1096493880.db2.gz SBTMEULIMWVKMH-DLBZAZTESA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@H](CC[NH2+]CC1CCC(F)(F)CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001268399984 1096494256 /nfs/dbraw/zinc/49/42/56/1096494256.db2.gz OVZUOGPXTMPPPH-HUUCEWRRSA-N 1 3 345.478 2.638 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cccc(F)c1Cl)N(C)C ZINC001268412813 1096542300 /nfs/dbraw/zinc/54/23/00/1096542300.db2.gz AZKTXZMTTBCLSB-WFASDCNBSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CCNCc1c(F)cccc1F)[NH+](C)C ZINC001268412719 1096545811 /nfs/dbraw/zinc/54/58/11/1096545811.db2.gz BHGTUDZXHZMSJS-SUMWQHHRSA-N 1 3 341.446 2.535 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(CF)cc1)C(=O)C1(N(C)C)CCC1 ZINC001268453501 1096673044 /nfs/dbraw/zinc/67/30/44/1096673044.db2.gz LNKARJQTDXVTPE-UHFFFAOYSA-N 1 3 335.467 2.579 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@H]1CCN([C@H]2CCc3c2cccc3F)C1 ZINC001481774360 1096673364 /nfs/dbraw/zinc/67/33/64/1096673364.db2.gz JTUBOKVZHAFQMW-KXBFYZLASA-N 1 3 347.478 2.688 10 0 EFAEHO CC[C@H](CNC(=O)CC[NH+](C)C)N[C@@H](C)c1cccc(Cl)c1F ZINC001481848502 1096779328 /nfs/dbraw/zinc/77/93/28/1096779328.db2.gz ORTYSCORXCOVIN-QWHCGFSZSA-N 1 3 343.874 2.976 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cc2ccccc2o1 ZINC001481849505 1096793651 /nfs/dbraw/zinc/79/36/51/1096793651.db2.gz DBYRTLOUPWKQAI-NVXWUHKLSA-N 1 3 343.471 2.759 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NCc1ccc(C)cc1Cl ZINC001481876593 1096841001 /nfs/dbraw/zinc/84/10/01/1096841001.db2.gz WHAHVWNKXJMUGP-CVEARBPZSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NCc1ccc(C)cc1Cl ZINC001481876593 1096841010 /nfs/dbraw/zinc/84/10/10/1096841010.db2.gz WHAHVWNKXJMUGP-CVEARBPZSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NCc1ccc(C)cc1Cl ZINC001481876599 1096841466 /nfs/dbraw/zinc/84/14/66/1096841466.db2.gz WHAHVWNKXJMUGP-HOTGVXAUSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NCc1ccc(C)cc1Cl ZINC001481876599 1096841476 /nfs/dbraw/zinc/84/14/76/1096841476.db2.gz WHAHVWNKXJMUGP-HOTGVXAUSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@@H](CNC(=O)C12CC[NH+](CC1)C2)NCc1ccc(C)cc1Cl ZINC001481872535 1096846106 /nfs/dbraw/zinc/84/61/06/1096846106.db2.gz UIKKMRAAAURLCL-INIZCTEOSA-N 1 3 349.906 2.729 10 0 EFAEHO CC[C@@H](C(=O)N(CC)CC[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001268477446 1096877752 /nfs/dbraw/zinc/87/77/52/1096877752.db2.gz OULLVVZVCRSMEP-IBGZPJMESA-N 1 3 333.520 2.890 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc2cccnc21)C(=O)CN(C)C(C)C ZINC001268499208 1096996572 /nfs/dbraw/zinc/99/65/72/1096996572.db2.gz HNCNZVYZRDBYPJ-UHFFFAOYSA-N 1 3 342.487 2.513 10 0 EFAEHO O=C(CN1CCCC1)N1CCC[C@@H](CC[NH2+]CC=C(Cl)Cl)C1 ZINC001481990912 1097055794 /nfs/dbraw/zinc/05/57/94/1097055794.db2.gz FYRGDTVQQRAYNI-AWEZNQCLSA-N 1 3 348.318 2.620 10 0 EFAEHO CN1CCC[C@H]1C(=O)NC/C=C/C[NH2+]CCCc1ccccc1Cl ZINC001268522105 1097123064 /nfs/dbraw/zinc/12/30/64/1097123064.db2.gz JQVDVAWNGBNFPO-WRFKIARRSA-N 1 3 349.906 2.629 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC2CC[NH+](CCC(C)(C)C)CC2)C1 ZINC001482045356 1097161720 /nfs/dbraw/zinc/16/17/20/1097161720.db2.gz GBIXAOKEIYCTIC-QGZVFWFLSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC2CC[NH+](CCC(C)(C)C)CC2)C1 ZINC001482045355 1097161813 /nfs/dbraw/zinc/16/18/13/1097161813.db2.gz GBIXAOKEIYCTIC-KRWDZBQOSA-N 1 3 337.552 2.983 10 0 EFAEHO CCCCCC[N@@H+]1CCC2(C1)CCN(C(=O)Cc1c[nH]cn1)CC2 ZINC001482072046 1097226833 /nfs/dbraw/zinc/22/68/33/1097226833.db2.gz RSROAHJYXKHJMX-UHFFFAOYSA-N 1 3 332.492 2.847 10 0 EFAEHO CCCCCC[N@H+]1CCC2(C1)CCN(C(=O)Cc1c[nH]cn1)CC2 ZINC001482072046 1097226838 /nfs/dbraw/zinc/22/68/38/1097226838.db2.gz RSROAHJYXKHJMX-UHFFFAOYSA-N 1 3 332.492 2.847 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]CC[C@H]1CCCC1(F)F ZINC001482107162 1097268520 /nfs/dbraw/zinc/26/85/20/1097268520.db2.gz FYBZEZNZTFHSEE-HUUCEWRRSA-N 1 3 345.478 2.638 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H](C)CNC(=O)C(C)(C)N2CCCC2)c1 ZINC001482128509 1097298898 /nfs/dbraw/zinc/29/88/98/1097298898.db2.gz DQIZXOIHFCWBAQ-KRWDZBQOSA-N 1 3 331.504 2.711 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C/C=C\CNC(=O)CN(C)CC(C)(C)C ZINC001268592207 1097316660 /nfs/dbraw/zinc/31/66/60/1097316660.db2.gz XRWUIXBIRYXMLX-SREVYHEPSA-N 1 3 349.494 2.874 10 0 EFAEHO O=C(NC/C=C/CNCc1ccsc1)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001268602587 1097449853 /nfs/dbraw/zinc/44/98/53/1097449853.db2.gz MDRZNXODFZVRRY-KAWXUTATSA-N 1 3 333.501 2.527 10 0 EFAEHO O=C(NC/C=C/CNCc1ccsc1)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001268602587 1097449858 /nfs/dbraw/zinc/44/98/58/1097449858.db2.gz MDRZNXODFZVRRY-KAWXUTATSA-N 1 3 333.501 2.527 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)NC/C=C\CNCc2ccsc2)C1 ZINC001268612145 1097461267 /nfs/dbraw/zinc/46/12/67/1097461267.db2.gz DQXCWNRISZACHO-NMBNSIPYSA-N 1 3 335.517 2.631 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NC/C=C\CNCc1ccc(Cl)cc1 ZINC001268628572 1097482140 /nfs/dbraw/zinc/48/21/40/1097482140.db2.gz OEGNZTXEBANAML-SSGMOAHOSA-N 1 3 349.906 2.975 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NC/C=C\CNCc1ccc(Cl)cc1 ZINC001268628572 1097482141 /nfs/dbraw/zinc/48/21/41/1097482141.db2.gz OEGNZTXEBANAML-SSGMOAHOSA-N 1 3 349.906 2.975 10 0 EFAEHO C[NH+](C)Cc1cccc(C(=O)NC/C=C\CNCc2ccsc2)c1 ZINC001268628424 1097482273 /nfs/dbraw/zinc/48/22/73/1097482273.db2.gz NNIBNAQSZRRUKM-ARJAWSKDSA-N 1 3 343.496 2.886 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C[NH2+]C/C=C/c1ccc(Cl)cc1)N(C)C ZINC001268661727 1097515690 /nfs/dbraw/zinc/51/56/90/1097515690.db2.gz HGHXIVWBIQFKNV-PALPZSCYSA-N 1 3 337.895 2.788 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[NH2+]Cc2ccc(Cl)cc2)CCC1 ZINC001268797390 1097644394 /nfs/dbraw/zinc/64/43/94/1097644394.db2.gz LVTOXZZRNRAGGZ-UHFFFAOYSA-N 1 3 337.895 2.762 10 0 EFAEHO CCCc1ccc(C[NH2+]CCCN(C)C(=O)[C@H]2CCCN2C)cc1 ZINC001268810054 1097659439 /nfs/dbraw/zinc/65/94/39/1097659439.db2.gz BAKJFQSVOZSUHX-LJQANCHMSA-N 1 3 331.504 2.671 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CCCN(C)C(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001268839804 1097677809 /nfs/dbraw/zinc/67/78/09/1097677809.db2.gz NAZUQNIMDAOOCH-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+][C@@H]1CCc2ccc(F)cc21)N(C)C ZINC001268852251 1097684841 /nfs/dbraw/zinc/68/48/41/1097684841.db2.gz HHSABMBFVCBBOW-MSOLQXFVSA-N 1 3 335.467 2.591 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[NH2+][C@H]2CCc3ccccc32)CC1 ZINC001268893714 1097706580 /nfs/dbraw/zinc/70/65/80/1097706580.db2.gz FJRAEUBJLCJUCQ-FQEVSTJZSA-N 1 3 343.515 2.844 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N(C)CCC[NH2+]CCC(F)(F)F)c1 ZINC001268956916 1097745681 /nfs/dbraw/zinc/74/56/81/1097745681.db2.gz ACDAWBVMJUKONI-UHFFFAOYSA-N 1 3 345.409 2.752 10 0 EFAEHO CCC/C=C\CCN1C[C@@H]2C[C@H]1CN2C(=O)CCC[NH+]1CCCC1 ZINC001268987604 1097774529 /nfs/dbraw/zinc/77/45/29/1097774529.db2.gz ANCHLKOTFKNVPK-DHJFXDNESA-N 1 3 333.520 2.894 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CCCCc2ccccc2)C1)N(C)C ZINC001269033752 1097797465 /nfs/dbraw/zinc/79/74/65/1097797465.db2.gz JGAMBYDHIAQIMT-PMACEKPBSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CCCCc2ccccc2)C1)N(C)C ZINC001269033752 1097797469 /nfs/dbraw/zinc/79/74/69/1097797469.db2.gz JGAMBYDHIAQIMT-PMACEKPBSA-N 1 3 345.531 2.786 10 0 EFAEHO CN(CC(=O)NCC1([NH2+]CC2=CCCCC2)CCCC1)C1CCC1 ZINC001482222338 1098167703 /nfs/dbraw/zinc/16/77/03/1098167703.db2.gz YLBVSBXPELDBFQ-UHFFFAOYSA-N 1 3 333.520 2.990 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@H](CC[NH2+]Cc2ccsc2)C1 ZINC001269712025 1098388574 /nfs/dbraw/zinc/38/85/74/1098388574.db2.gz NHUNIWNAASJEIA-NVXWUHKLSA-N 1 3 335.517 2.561 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](CC[NH2+]CCC(C)(C)C)C1 ZINC001269790111 1098445822 /nfs/dbraw/zinc/44/58/22/1098445822.db2.gz DBDXAQHDWBAOBM-KRWDZBQOSA-N 1 3 325.541 2.983 10 0 EFAEHO C[C@@H]([NH2+]CC[C@H]1CCCCN1C)c1cccc(NS(C)(=O)=O)c1 ZINC000781915166 1098769280 /nfs/dbraw/zinc/76/92/80/1098769280.db2.gz XUQHJECNKRVWSK-RHSMWYFYSA-N 1 3 339.505 2.583 10 0 EFAEHO CN(CC[NH2+]Cc1ccc(C2CC2)cc1)C(=O)CN(C)C1CCC1 ZINC001481240667 1098775595 /nfs/dbraw/zinc/77/55/95/1098775595.db2.gz TUZLLWKHBJSMHM-UHFFFAOYSA-N 1 3 329.488 2.596 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C ZINC001481244998 1098883053 /nfs/dbraw/zinc/88/30/53/1098883053.db2.gz CDWWYNCMNDCUPN-LJQANCHMSA-N 1 3 331.504 2.842 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H]1C[NH2+]CC[C@H]1CCCC1(F)F)N(C)C ZINC001267963212 1098945317 /nfs/dbraw/zinc/94/53/17/1098945317.db2.gz JOUNQPKIEMDYDC-OAGGEKHMSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H]1CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001267969454 1098981628 /nfs/dbraw/zinc/98/16/28/1098981628.db2.gz JBQXTHOBSXEDPE-MAUKXSAKSA-N 1 3 335.467 2.691 10 0 EFAEHO O=C(N[C@@H](CNCCF)C1CCCC1)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001270404253 1099060164 /nfs/dbraw/zinc/06/01/64/1099060164.db2.gz VDLXSRLAYQPWLV-ROUUACIJSA-N 1 3 339.499 2.628 10 0 EFAEHO O=C(N[C@@H](CNCCF)C1CCCC1)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001270404253 1099060176 /nfs/dbraw/zinc/06/01/76/1099060176.db2.gz VDLXSRLAYQPWLV-ROUUACIJSA-N 1 3 339.499 2.628 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)[C@@H]1CCN(CCCCC(F)(F)F)C1 ZINC001267774870 1099110174 /nfs/dbraw/zinc/11/01/74/1099110174.db2.gz KYXNLKSAQHGAQN-CQSZACIVSA-N 1 3 337.430 2.594 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)[C@@H]1CCN(CCCCC(F)(F)F)C1 ZINC001267774870 1099110177 /nfs/dbraw/zinc/11/01/77/1099110177.db2.gz KYXNLKSAQHGAQN-CQSZACIVSA-N 1 3 337.430 2.594 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)CCNCc1c(C)cccc1Cl ZINC001481297013 1099114757 /nfs/dbraw/zinc/11/47/57/1099114757.db2.gz HQCDAUJWHWEZKP-UHFFFAOYSA-N 1 3 325.884 2.538 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)CCNCc1c(C)cccc1Cl ZINC001481297013 1099114761 /nfs/dbraw/zinc/11/47/61/1099114761.db2.gz HQCDAUJWHWEZKP-UHFFFAOYSA-N 1 3 325.884 2.538 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]CCCc1ccccc1 ZINC001481319739 1099277216 /nfs/dbraw/zinc/27/72/16/1099277216.db2.gz MAEPPQAGBMFWRF-IBGZPJMESA-N 1 3 331.504 2.542 10 0 EFAEHO CCCCC[NH2+][C@@H](C)C1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001481339806 1099370174 /nfs/dbraw/zinc/37/01/74/1099370174.db2.gz NHUGYXJDGGXMCZ-WMZOPIPTSA-N 1 3 325.541 2.980 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC([C@H](C)[NH2+]C/C=C/Cl)CC1 ZINC001481344188 1099391894 /nfs/dbraw/zinc/39/18/94/1099391894.db2.gz VROPBJHBUOKIOC-DUUASINPSA-N 1 3 341.927 2.830 10 0 EFAEHO C[C@H](C[NH2+]C/C=C/c1ccc(Cl)cc1)N(C)C(=O)[C@H]1CCCN1C ZINC001482318956 1099479156 /nfs/dbraw/zinc/47/91/56/1099479156.db2.gz HUBHSZYAYXYZIP-WFEZPHLISA-N 1 3 349.906 2.884 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@H](C)N(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001482330582 1099629125 /nfs/dbraw/zinc/62/91/25/1099629125.db2.gz KJNYQUBAFJSYCK-JCRZBSBLSA-N 1 3 341.515 2.992 10 0 EFAEHO COc1cccc(-c2n[nH]cc2C[NH2+]C[C@H]2CCN(C3CC3)C2)c1 ZINC000048711586 1100596643 /nfs/dbraw/zinc/59/66/43/1100596643.db2.gz GGLSPIPBNRGAJC-CQSZACIVSA-N 1 3 326.444 2.659 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1CC[NH2+]Cc1ncccc1C ZINC001482462804 1100629496 /nfs/dbraw/zinc/62/94/96/1100629496.db2.gz PNLYCUQXAZJRFI-SFHVURJKSA-N 1 3 346.519 2.593 10 0 EFAEHO CC(C)C[C@H](C[NH2+]CCCF)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001271295852 1101347870 /nfs/dbraw/zinc/34/78/70/1101347870.db2.gz YILZWSWAXSNQPE-QAPCUYQASA-N 1 3 347.494 2.679 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC[C@H]2C[NH2+]C/C=C\Cl)C1 ZINC001671346950 1101386323 /nfs/dbraw/zinc/38/63/23/1101386323.db2.gz MHJMTENOSJBCPZ-HLQNQHLTSA-N 1 3 345.890 2.532 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H]1CC[N@H+](CCC2=CCCCC2)C1 ZINC001266322364 1101547584 /nfs/dbraw/zinc/54/75/84/1101547584.db2.gz GFKGFWWVFNYMHL-MSOLQXFVSA-N 1 3 339.499 2.747 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H]1CC[N@@H+](CCC2=CCCCC2)C1 ZINC001266322364 1101547589 /nfs/dbraw/zinc/54/75/89/1101547589.db2.gz GFKGFWWVFNYMHL-MSOLQXFVSA-N 1 3 339.499 2.747 10 0 EFAEHO CCCCCN1CC[C@@H]1CN(C)C(=O)C1CC[NH+](CC2CC2)CC1 ZINC001656102613 1101952828 /nfs/dbraw/zinc/95/28/28/1101952828.db2.gz MXRYHMHBCIVDBA-LJQANCHMSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC/C=C/c2ccccc2)C1)N(C)C ZINC001266711243 1101980011 /nfs/dbraw/zinc/98/00/11/1101980011.db2.gz QBOHDSUPMNCUJE-NFLGUCHSSA-N 1 3 343.515 2.913 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2C[C@@H]([NH2+]CCCC3CCCC3)C2)C1 ZINC001656160807 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CCNPMDQOVTVBBR-YSIASYRMSA-N 1 3 343.515 2.506 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@@H]([NH2+]CC2=CCCCC2)C1 ZINC001656376023 1102045163 /nfs/dbraw/zinc/04/51/63/1102045163.db2.gz ZXXHWSVJXVRMPK-DLBZAZTESA-N 1 3 330.476 2.636 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@@H]([NH2+]CCCCC(F)(F)F)C1 ZINC001266733206 1102048932 /nfs/dbraw/zinc/04/89/32/1102048932.db2.gz PERZBXHRYJCETK-ZQDZILKHSA-N 1 3 349.441 2.829 10 0 EFAEHO CCCCC[NH+]1CCC2(C[C@H](C)N(C(=O)[C@H]3CCCN3C)C2)CC1 ZINC001656398469 1102051681 /nfs/dbraw/zinc/05/16/81/1102051681.db2.gz JPBCXSCBXNWBEJ-ZWKOTPCHSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@@H]1CC[NH2+]Cc1ccccc1 ZINC001656449175 1102092724 /nfs/dbraw/zinc/09/27/24/1102092724.db2.gz ZSUUKCPXWDQCDX-QFBILLFUSA-N 1 3 340.471 2.759 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@H]1CC[NH2+]Cc1ccc(F)cc1 ZINC001271584916 1102144944 /nfs/dbraw/zinc/14/49/44/1102144944.db2.gz CJRDHOINZYDCBV-SFHVURJKSA-N 1 3 344.434 2.652 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CCCC[NH+](C)C)CCN1Cc1cccnc1C ZINC001656752893 1102191346 /nfs/dbraw/zinc/19/13/46/1102191346.db2.gz WATXNYFAMJAXMP-RBUKOAKNSA-N 1 3 346.519 2.591 10 0 EFAEHO CCC/C=C\CC[N@H+](C)C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001266469070 1102198325 /nfs/dbraw/zinc/19/83/25/1102198325.db2.gz DOZLSLCNGZQJGA-OSJSJHBBSA-N 1 3 332.492 2.869 10 0 EFAEHO CCC/C=C\CC[N@@H+](C)C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001266469070 1102198329 /nfs/dbraw/zinc/19/83/29/1102198329.db2.gz DOZLSLCNGZQJGA-OSJSJHBBSA-N 1 3 332.492 2.869 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CCC[N@@H+]1CCCCCF)N1CCCCCC1 ZINC001266485450 1102241689 /nfs/dbraw/zinc/24/16/89/1102241689.db2.gz CCWINNIBDPSTKW-ZWKOTPCHSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CCC[N@H+]1CCCCCF)N1CCCCCC1 ZINC001266485450 1102241696 /nfs/dbraw/zinc/24/16/96/1102241696.db2.gz CCWINNIBDPSTKW-ZWKOTPCHSA-N 1 3 341.515 2.971 10 0 EFAEHO Cc1cccc([C@@H](C)N(C)CCNC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001480876259 1102251826 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Cc1cccc(CNCC2(O)CC[NH+](Cc3ccccc3)CC2)n1 ZINC000397524849 1102340494 /nfs/dbraw/zinc/34/04/94/1102340494.db2.gz WAJANTWZGHYLSK-UHFFFAOYSA-N 1 3 325.456 2.507 10 0 EFAEHO Cc1ccc2ccccc2c1C[NH2+]CCN(C)C(=O)Cc1c[nH]cn1 ZINC001266846862 1102422595 /nfs/dbraw/zinc/42/25/95/1102422595.db2.gz KEFAJIJQMXDGDE-UHFFFAOYSA-N 1 3 336.439 2.662 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@@H]1C[NH2+]C/C=C/c1ccccc1 ZINC001266865306 1102516922 /nfs/dbraw/zinc/51/69/22/1102516922.db2.gz SFQLTQUMLPRYQR-DGDLXGGDSA-N 1 3 341.499 2.765 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@H]1C[NH2+]C/C=C\c1ccccc1 ZINC001266865307 1102517178 /nfs/dbraw/zinc/51/71/78/1102517178.db2.gz SFQLTQUMLPRYQR-LFXJARLDSA-N 1 3 341.499 2.765 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCCC[C@@H]1C[NH2+]CCCF ZINC001266877744 1102569430 /nfs/dbraw/zinc/56/94/30/1102569430.db2.gz LTCDYPRZHOGDPK-IAGOWNOFSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)[C@H]1C[NH2+]CCCF ZINC001271741181 1102573763 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CN(C)C1(C(=O)NCCC[N@@H+](C)[C@H]2CCc3c2cccc3F)CCC1 ZINC001660170664 1102626648 /nfs/dbraw/zinc/62/66/48/1102626648.db2.gz QYKVWARWHFLMQF-SFHVURJKSA-N 1 3 347.478 2.735 10 0 EFAEHO Cc1cc(C[N@@H+](C)CCCNC(=O)CN(C)CC(C)(C)C)cs1 ZINC001660304339 1102679953 /nfs/dbraw/zinc/67/99/53/1102679953.db2.gz YCTJJOQMMQXBAL-UHFFFAOYSA-N 1 3 339.549 2.973 10 0 EFAEHO Cc1cc(C[N@H+](C)CCCNC(=O)CN(C)CC(C)(C)C)cs1 ZINC001660304339 1102679956 /nfs/dbraw/zinc/67/99/56/1102679956.db2.gz YCTJJOQMMQXBAL-UHFFFAOYSA-N 1 3 339.549 2.973 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001660372203 1102718855 /nfs/dbraw/zinc/71/88/55/1102718855.db2.gz NKXRFOJMFUFHKW-HZPDHXFCSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001660372203 1102718869 /nfs/dbraw/zinc/71/88/69/1102718869.db2.gz NKXRFOJMFUFHKW-HZPDHXFCSA-N 1 3 347.494 2.836 10 0 EFAEHO CC1CC(C[N@H+](C)CCCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001660409278 1102746362 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CCC/C=C/CC[N@H+]1C[C@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@H]2C1 ZINC001271861713 1102942836 /nfs/dbraw/zinc/94/28/36/1102942836.db2.gz ZDHGCJXTJIMQBL-QCUYKYDPSA-N 1 3 333.520 2.607 10 0 EFAEHO CCC/C=C/CC[N@@H+]1C[C@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@H]2C1 ZINC001271861713 1102942848 /nfs/dbraw/zinc/94/28/48/1102942848.db2.gz ZDHGCJXTJIMQBL-QCUYKYDPSA-N 1 3 333.520 2.607 10 0 EFAEHO CN(CC(=O)N(C)C1CC[NH+](CC2=CCCCC2)CC1)C1CCC1 ZINC001660776131 1102970935 /nfs/dbraw/zinc/97/09/35/1102970935.db2.gz PFQVMLBCKDXXKJ-UHFFFAOYSA-N 1 3 333.520 2.894 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)Cc1c[nH]cn1)[NH2+]Cc1ccsc1 ZINC001409765618 1103085825 /nfs/dbraw/zinc/08/58/25/1103085825.db2.gz KRAQVZHDFHETGS-MRXNPFEDSA-N 1 3 334.489 2.677 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1cccc(C(F)F)c1 ZINC001409456425 1103105590 /nfs/dbraw/zinc/10/55/90/1103105590.db2.gz GOVIBPIGSOCHBY-ZIAGYGMSSA-N 1 3 341.446 2.947 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(C[C@@H]2NC(=O)CN(C)C2CCC2)CC1 ZINC001661066960 1103107536 /nfs/dbraw/zinc/10/75/36/1103107536.db2.gz SEXAJBLHQQJTTA-XDXAGZTOSA-N 1 3 333.520 2.798 10 0 EFAEHO CC/C=C/CC[N@H+](C)C[C@H]1CCCN(C(=O)CN(C)C2CCC2)C1 ZINC001661213605 1103178521 /nfs/dbraw/zinc/17/85/21/1103178521.db2.gz VFMFUDCGJHMBHA-DUMMIQTOSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](C)C[C@H]1CCCN(C(=O)CN(C)C2CCC2)C1 ZINC001661213605 1103178537 /nfs/dbraw/zinc/17/85/37/1103178537.db2.gz VFMFUDCGJHMBHA-DUMMIQTOSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C[C@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001483266237 1103191377 /nfs/dbraw/zinc/19/13/77/1103191377.db2.gz HZWNABVRGAMQLN-SJORKVTESA-N 1 3 331.504 2.746 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1cc(C)cc(C)c1 ZINC001483296323 1103291193 /nfs/dbraw/zinc/29/11/93/1103291193.db2.gz DDXGKVPIZHZSBD-HKUYNNGSSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)CCCc1ccccc1 ZINC001483338071 1103421988 /nfs/dbraw/zinc/42/19/88/1103421988.db2.gz ULJCYLYOXCRZIV-UYAOXDASSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)CCCc1ccccc1 ZINC001483338071 1103421992 /nfs/dbraw/zinc/42/19/92/1103421992.db2.gz ULJCYLYOXCRZIV-UYAOXDASSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)(C(=O)N1CCC[C@H](C[NH2+]C/C=C/Cl)C1)N1CCCCC1 ZINC001661783147 1103422671 /nfs/dbraw/zinc/42/26/71/1103422671.db2.gz OMZGPCYYVYPYFE-MNDMWVCDSA-N 1 3 341.927 2.832 10 0 EFAEHO CN(CC(=O)N1CCC[C@H](C[NH2+]CCc2ccccc2)C1)C1CCC1 ZINC001661789039 1103426162 /nfs/dbraw/zinc/42/61/62/1103426162.db2.gz VSKJDXWBZLAHAX-LJQANCHMSA-N 1 3 343.515 2.542 10 0 EFAEHO CCc1cccc(CN(C)C[C@H](C)NC(=O)[C@H]2C[NH+]3CCC2CC3)c1 ZINC001483339723 1103428569 /nfs/dbraw/zinc/42/85/69/1103428569.db2.gz SGUVXTYTUQBCFB-JXFKEZNVSA-N 1 3 343.515 2.527 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(OC)cc1 ZINC001483345436 1103429907 /nfs/dbraw/zinc/42/99/07/1103429907.db2.gz MFBOTGYUNNHWNG-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(OC)cc1 ZINC001483345436 1103429910 /nfs/dbraw/zinc/42/99/10/1103429910.db2.gz MFBOTGYUNNHWNG-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO CCCC[NH2+]C[C@H]1CCCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001661945728 1103515159 /nfs/dbraw/zinc/51/51/59/1103515159.db2.gz ATVAAKWYIKJSFK-VQIMIIECSA-N 1 3 341.515 2.970 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@@H]1C[NH2+]CCC1CCCCC1 ZINC001661950379 1103519771 /nfs/dbraw/zinc/51/97/71/1103519771.db2.gz OEHDTPADPPFFEO-GOSISDBHSA-N 1 3 332.492 2.893 10 0 EFAEHO COc1cccc(CN(C)C[C@@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001483371413 1103521297 /nfs/dbraw/zinc/52/12/97/1103521297.db2.gz XAWZGPUDYJMJJS-MRXNPFEDSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1cc(C)ccc1C)C(C)C)N(C)C ZINC001482564698 1103537361 /nfs/dbraw/zinc/53/73/61/1103537361.db2.gz GFPVMXXAEADRSN-RTBURBONSA-N 1 3 333.520 2.874 10 0 EFAEHO C[C@H](CN(C)[C@@H]1CCc2c1cccc2F)NC(=O)CCCC[NH+](C)C ZINC001483407358 1103628515 /nfs/dbraw/zinc/62/85/15/1103628515.db2.gz BLTWFAWPKCZMAX-DNVCBOLYSA-N 1 3 349.494 2.981 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H](C)CNC(=O)[C@H]1CCCN1C(C)C ZINC001662220434 1103629198 /nfs/dbraw/zinc/62/91/98/1103629198.db2.gz XXTHBSFXBUJQHX-AZUAARDMSA-N 1 3 345.531 2.895 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](C[NH2+]CCCc2ccccc2)C1)C1CCC1 ZINC001662641586 1103739501 /nfs/dbraw/zinc/73/95/01/1103739501.db2.gz SLMUGUYZNCKHLP-IBGZPJMESA-N 1 3 343.515 2.542 10 0 EFAEHO CN(CCC[NH2+]Cc1cccc2ccccc21)C(=O)[C@@H]1CCCN1C ZINC001483456418 1103749760 /nfs/dbraw/zinc/74/97/60/1103749760.db2.gz VSZYABHBRHYPBG-FQEVSTJZSA-N 1 3 339.483 2.872 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](C[NH2+]CCCC2CCC2)C1)CC(C)(C)C ZINC001662685595 1103757124 /nfs/dbraw/zinc/75/71/24/1103757124.db2.gz MHXZJMVZNXYTQF-SFHVURJKSA-N 1 3 337.552 2.983 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]Cc1ccc(F)cc1Cl)N(C)C ZINC001483492224 1103822442 /nfs/dbraw/zinc/82/24/42/1103822442.db2.gz ABGKDBPRPLSFJI-INIZCTEOSA-N 1 3 343.874 2.757 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001483493077 1103827208 /nfs/dbraw/zinc/82/72/08/1103827208.db2.gz SAUVJZIAHPOLEP-KRWDZBQOSA-N 1 3 343.515 2.844 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[C@@H]1CCC[N@@H+]1CCC(F)(F)F ZINC001663124019 1103997680 /nfs/dbraw/zinc/99/76/80/1103997680.db2.gz OXBCFSZBBVSRGY-CQSZACIVSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[C@@H]1CCC[N@H+]1CCC(F)(F)F ZINC001663124019 1103997684 /nfs/dbraw/zinc/99/76/84/1103997684.db2.gz OXBCFSZBBVSRGY-CQSZACIVSA-N 1 3 337.430 2.640 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)[C@H](C)CNC(=O)CN(C)C2CCC2)c1 ZINC001409557876 1104224745 /nfs/dbraw/zinc/22/47/45/1104224745.db2.gz AZBYKNMCEZAIJH-HZPDHXFCSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)[C@H](C)CNC(=O)CN(C)C2CCC2)c1 ZINC001409557876 1104224750 /nfs/dbraw/zinc/22/47/50/1104224750.db2.gz AZBYKNMCEZAIJH-HZPDHXFCSA-N 1 3 347.503 2.677 10 0 EFAEHO CC[C@H](F)CNCCN(C)C(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001664138093 1104297614 /nfs/dbraw/zinc/29/76/14/1104297614.db2.gz HQDJSPDNSFAEHG-DOTOQJQBSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H](F)CNCCN(C)C(=O)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001664138093 1104297623 /nfs/dbraw/zinc/29/76/23/1104297623.db2.gz HQDJSPDNSFAEHG-DOTOQJQBSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[NH2+]C/C=C\c2ccc(Cl)cc2)C1 ZINC001664186732 1104312073 /nfs/dbraw/zinc/31/20/73/1104312073.db2.gz RWXPENMDYAVQIG-MJSXRHKHSA-N 1 3 349.906 2.743 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N(C)CC[NH2+]CC2=CCCCC2)c1 ZINC001664391395 1104375715 /nfs/dbraw/zinc/37/57/15/1104375715.db2.gz KVOUJZRPSMAXRF-UHFFFAOYSA-N 1 3 329.488 2.910 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(C)CCN(C)C(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001482599528 1104416909 /nfs/dbraw/zinc/41/69/09/1104416909.db2.gz WLLINQZPRZHYOU-DNVCBOLYSA-N 1 3 347.478 2.619 10 0 EFAEHO CC(C)N(C/C=C\Cl)CCCNC(=O)C12CCC[NH+](CCC1)C2 ZINC001664516416 1104423930 /nfs/dbraw/zinc/42/39/30/1104423930.db2.gz BOBVWURPPQZWQH-UITAMQMPSA-N 1 3 341.927 2.832 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@H+](C)[C@@H]1CC)[C@H]1CCN(CC=C(C)C)C1 ZINC001664667214 1104491283 /nfs/dbraw/zinc/49/12/83/1104491283.db2.gz FSDZFQUYYNWRMJ-GBESFXJTSA-N 1 3 335.536 2.996 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC)[C@H]1CCN(CC=C(C)C)C1 ZINC001664667214 1104491290 /nfs/dbraw/zinc/49/12/90/1104491290.db2.gz FSDZFQUYYNWRMJ-GBESFXJTSA-N 1 3 335.536 2.996 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H](C)[N@H+](C)Cc1c(C)cc(C)cc1C)N(C)C ZINC001409612094 1104503941 /nfs/dbraw/zinc/50/39/41/1104503941.db2.gz BTAUIZKYRAXHDQ-MJGOQNOKSA-N 1 3 333.520 2.889 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H](C)[N@@H+](C)Cc1c(C)cc(C)cc1C)N(C)C ZINC001409612094 1104503949 /nfs/dbraw/zinc/50/39/49/1104503949.db2.gz BTAUIZKYRAXHDQ-MJGOQNOKSA-N 1 3 333.520 2.889 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)n1 ZINC001483236738 1104526494 /nfs/dbraw/zinc/52/64/94/1104526494.db2.gz RMYYHBVHPSREOE-WMZOPIPTSA-N 1 3 346.519 2.674 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)n1 ZINC001483236738 1104526501 /nfs/dbraw/zinc/52/65/01/1104526501.db2.gz RMYYHBVHPSREOE-WMZOPIPTSA-N 1 3 346.519 2.674 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H](C)[N@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001409616869 1104527082 /nfs/dbraw/zinc/52/70/82/1104527082.db2.gz WQIZVXKJTNKBDH-BEFAXECRSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001409616869 1104527086 /nfs/dbraw/zinc/52/70/86/1104527086.db2.gz WQIZVXKJTNKBDH-BEFAXECRSA-N 1 3 331.504 2.841 10 0 EFAEHO C[C@H](CNC(=O)CC[NH+](C)C)N(C)Cc1cc2ccccc2s1 ZINC001409636022 1104565240 /nfs/dbraw/zinc/56/52/40/1104565240.db2.gz VULSPUMAJLYQGV-CQSZACIVSA-N 1 3 333.501 2.790 10 0 EFAEHO Cc1cc(CN(C)[C@H](C)CNC(=O)C[C@@H]2CC[N@H+](C)C2)c(C)s1 ZINC001409651418 1104600784 /nfs/dbraw/zinc/60/07/84/1104600784.db2.gz SJXBAQINCUOSFT-CJNGLKHVSA-N 1 3 337.533 2.643 10 0 EFAEHO Cc1cc(CN(C)[C@H](C)CNC(=O)C[C@@H]2CC[N@@H+](C)C2)c(C)s1 ZINC001409651418 1104600789 /nfs/dbraw/zinc/60/07/89/1104600789.db2.gz SJXBAQINCUOSFT-CJNGLKHVSA-N 1 3 337.533 2.643 10 0 EFAEHO C[C@H](C(=O)N[C@H]1CCC[N@H+](CCCCCF)C1)N1CCCCCC1 ZINC001665074881 1104625665 /nfs/dbraw/zinc/62/56/65/1104625665.db2.gz NGSFOVKCKFGZFK-MSOLQXFVSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@H](C(=O)N[C@H]1CCC[N@@H+](CCCCCF)C1)N1CCCCCC1 ZINC001665074881 1104625669 /nfs/dbraw/zinc/62/56/69/1104625669.db2.gz NGSFOVKCKFGZFK-MSOLQXFVSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@H](C(=O)N[C@H]1CCCN(CCCCCF)C1)[NH+]1CCCCCC1 ZINC001665074881 1104625675 /nfs/dbraw/zinc/62/56/75/1104625675.db2.gz NGSFOVKCKFGZFK-MSOLQXFVSA-N 1 3 341.515 2.971 10 0 EFAEHO CN(CC[N@H+](C)[C@H]1CCc2ccc(Cl)cc21)C(=O)[C@H]1CCCN1C ZINC001482618821 1104660177 /nfs/dbraw/zinc/66/01/77/1104660177.db2.gz JXLXJFMHNIIOLR-ZWKOTPCHSA-N 1 3 349.906 2.812 10 0 EFAEHO CN(CC[N@@H+](C)[C@H]1CCc2ccc(Cl)cc21)C(=O)[C@H]1CCCN1C ZINC001482618821 1104660187 /nfs/dbraw/zinc/66/01/87/1104660187.db2.gz JXLXJFMHNIIOLR-ZWKOTPCHSA-N 1 3 349.906 2.812 10 0 EFAEHO CN(CCN(C)C(=O)CC[NH+](C)C)Cc1ccc(C2CCC2)cc1 ZINC001482625260 1104683006 /nfs/dbraw/zinc/68/30/06/1104683006.db2.gz OZTCRQGRAZKKEI-UHFFFAOYSA-N 1 3 331.504 2.796 10 0 EFAEHO CN(CCN(C)C(=O)CC[NH+](C)C)Cc1ccc(C(C)(C)C)cc1 ZINC001482625157 1104683099 /nfs/dbraw/zinc/68/30/99/1104683099.db2.gz LFTZWDCUJCZDKL-UHFFFAOYSA-N 1 3 333.520 2.826 10 0 EFAEHO CN(CC[N@H+](C)CC1CCCC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001482628503 1104688500 /nfs/dbraw/zinc/68/85/00/1104688500.db2.gz UHODDDOREXRHGO-LJQANCHMSA-N 1 3 341.515 2.779 10 0 EFAEHO CN(CC[N@@H+](C)CC1CCCC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001482628503 1104688503 /nfs/dbraw/zinc/68/85/03/1104688503.db2.gz UHODDDOREXRHGO-LJQANCHMSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2Cc2ccsc2)C1 ZINC001482668391 1104812810 /nfs/dbraw/zinc/81/28/10/1104812810.db2.gz WCBATHQTMJMLLO-IRXDYDNUSA-N 1 3 335.517 2.511 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2Cc2ccsc2)C1 ZINC001482668391 1104812816 /nfs/dbraw/zinc/81/28/16/1104812816.db2.gz WCBATHQTMJMLLO-IRXDYDNUSA-N 1 3 335.517 2.511 10 0 EFAEHO CCCC[NH2+]C[C@](C)(NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001666021732 1104831731 /nfs/dbraw/zinc/83/17/31/1104831731.db2.gz KJHCKENUWAVKIB-OALUTQOASA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@@H](F)CC[NH2+]CCC1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001666245381 1104910966 /nfs/dbraw/zinc/91/09/66/1104910966.db2.gz XTFJDGHTLFHPSG-MRXNPFEDSA-N 1 3 343.531 2.931 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H]1CCC[C@H]1NC(=O)CN(C)C(C)C ZINC001482698761 1104955568 /nfs/dbraw/zinc/95/55/68/1104955568.db2.gz MYOANPSCXYBANB-IEBWSBKVSA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]CCc1ccccc1F ZINC001666600291 1104967860 /nfs/dbraw/zinc/96/78/60/1104967860.db2.gz RARMIQZJAJKKOS-INIZCTEOSA-N 1 3 349.494 2.585 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC2(C[NH+](CC=C(C)C)C2)CC1 ZINC001666825676 1105003555 /nfs/dbraw/zinc/00/35/55/1105003555.db2.gz OQFQCGHWTVSASA-QGZVFWFLSA-N 1 3 339.499 2.557 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H](C)NC(=O)C2(N(C)C)CCC2)c(C)s1 ZINC001482839401 1105079008 /nfs/dbraw/zinc/07/90/08/1105079008.db2.gz JMFKTXJPMFDDAF-CYBMUJFWSA-N 1 3 337.533 2.834 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccccc1Cl)N(C)C ZINC001482848300 1105091040 /nfs/dbraw/zinc/09/10/40/1105091040.db2.gz YKTDRZPEJGYHDL-XJKSGUPXSA-N 1 3 325.884 2.665 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001482887641 1105137860 /nfs/dbraw/zinc/13/78/60/1105137860.db2.gz BSYUFMKKNGCRGN-BEFAXECRSA-N 1 3 344.503 2.739 10 0 EFAEHO CC/C=C/CC[N@H+](C)CCC1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001667409925 1105142438 /nfs/dbraw/zinc/14/24/38/1105142438.db2.gz AWOVHBOIPTXFKD-UEKDZROGSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](C)CCC1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001667409925 1105142443 /nfs/dbraw/zinc/14/24/43/1105142443.db2.gz AWOVHBOIPTXFKD-UEKDZROGSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)cc1F ZINC001482900712 1105144848 /nfs/dbraw/zinc/14/48/48/1105144848.db2.gz FISPOMSORFPSRA-CYBMUJFWSA-N 1 3 343.874 2.804 10 0 EFAEHO Cc1cc(C)c(C[NH2+]CC[C@H](C)NC(=O)CN(C)C(C)C)c(C)c1 ZINC001482903045 1105160803 /nfs/dbraw/zinc/16/08/03/1105160803.db2.gz WIPGQCZUBSUFIP-SFHVURJKSA-N 1 3 333.520 2.936 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)CC[NH2+]Cc1ccsc1 ZINC001668234274 1105263152 /nfs/dbraw/zinc/26/31/52/1105263152.db2.gz HGBDFHUQNHAKKA-WBVHZDCISA-N 1 3 337.533 2.995 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCc2ccc(F)cc21)C(=O)CN(C)C(C)C ZINC001482969850 1105271429 /nfs/dbraw/zinc/27/14/29/1105271429.db2.gz LUEYHPWAFJCQCW-SFHVURJKSA-N 1 3 335.467 2.591 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CC[NH2+]CC1CCC2(CC2)CC1 ZINC001668288818 1105274831 /nfs/dbraw/zinc/27/48/31/1105274831.db2.gz OAVSDMIADQMPOF-AWEZNQCLSA-N 1 3 332.492 2.715 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+]Cc1sccc1Cl ZINC001668320692 1105281341 /nfs/dbraw/zinc/28/13/41/1105281341.db2.gz SKAUJOUGQHZFQI-GFCCVEGCSA-N 1 3 331.913 2.726 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC001668320353 1105281443 /nfs/dbraw/zinc/28/14/43/1105281443.db2.gz PUNZGEGYYQVSSS-ZWKOTPCHSA-N 1 3 345.531 2.616 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+]Cc1sccc1Cl ZINC001668320693 1105281476 /nfs/dbraw/zinc/28/14/76/1105281476.db2.gz SKAUJOUGQHZFQI-LBPRGKRZSA-N 1 3 331.913 2.726 10 0 EFAEHO CCN(CC[NH2+]C/C=C\c1ccc(Cl)cc1)C(=O)[C@H]1CCCN1C ZINC001668521277 1105312325 /nfs/dbraw/zinc/31/23/25/1105312325.db2.gz DJEAJJIWJPTSQE-WLPBJKJWSA-N 1 3 349.906 2.886 10 0 EFAEHO CCN(CC[NH2+]CC[C@H]1CCCC1(F)F)C(=O)CN1CC[C@H](C)C1 ZINC001668555094 1105319365 /nfs/dbraw/zinc/31/93/65/1105319365.db2.gz IGJREYLBCHSGKW-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001668582143 1105325195 /nfs/dbraw/zinc/32/51/95/1105325195.db2.gz WFWBCNKVDNXXGE-SJORKVTESA-N 1 3 335.517 2.703 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001668582143 1105325202 /nfs/dbraw/zinc/32/52/02/1105325202.db2.gz WFWBCNKVDNXXGE-SJORKVTESA-N 1 3 335.517 2.703 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc(C)c1)C(=O)[C@@H]1CCCCN1CC ZINC001668652726 1105341585 /nfs/dbraw/zinc/34/15/85/1105341585.db2.gz VJNLAZFYFASWHH-IBGZPJMESA-N 1 3 331.504 2.808 10 0 EFAEHO CN(C)C1(C(=O)NC/C=C/C[NH2+][C@H]2CCc3ccc(F)cc32)CCC1 ZINC001668864551 1105388609 /nfs/dbraw/zinc/38/86/09/1105388609.db2.gz HSMAAAZUFCHWHE-WHLIDYPQSA-N 1 3 345.462 2.559 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[N@H+](C)CCC2=CCCCC2)CC1 ZINC001272138625 1105391519 /nfs/dbraw/zinc/39/15/19/1105391519.db2.gz WGOGDFANBQYYLF-UHFFFAOYSA-N 1 3 335.536 2.999 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[N@@H+](C)CCC2=CCCCC2)CC1 ZINC001272138625 1105391524 /nfs/dbraw/zinc/39/15/24/1105391524.db2.gz WGOGDFANBQYYLF-UHFFFAOYSA-N 1 3 335.536 2.999 10 0 EFAEHO O=C(NC/C=C\CNCc1cccc(F)c1)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001668884277 1105393917 /nfs/dbraw/zinc/39/39/17/1105393917.db2.gz ZXRKJJQVAOAIRX-GDIRUBCPSA-N 1 3 345.462 2.605 10 0 EFAEHO O=C(NC/C=C\CNCc1cccc(F)c1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001668884277 1105393924 /nfs/dbraw/zinc/39/39/24/1105393924.db2.gz ZXRKJJQVAOAIRX-GDIRUBCPSA-N 1 3 345.462 2.605 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)NC/C=C/CNCc1ccc(F)cc1 ZINC001668906515 1105397645 /nfs/dbraw/zinc/39/76/45/1105397645.db2.gz ZFPJHASUJSFRNV-GNAXCBTBSA-N 1 3 347.478 2.708 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NC/C=C/CNCc1ccc(F)cc1 ZINC001668906515 1105397651 /nfs/dbraw/zinc/39/76/51/1105397651.db2.gz ZFPJHASUJSFRNV-GNAXCBTBSA-N 1 3 347.478 2.708 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C/C=C/CNC(=O)CN1CC[C@@H](C)C1 ZINC001669040508 1105423039 /nfs/dbraw/zinc/42/30/39/1105423039.db2.gz XBAWHTIOODVNMB-LLHDCHNASA-N 1 3 329.488 2.660 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C/CNC(=O)CN2CCC(C)CC2)cc1F ZINC001669107703 1105436432 /nfs/dbraw/zinc/43/64/32/1105436432.db2.gz NZFHWFFYFDIRDW-ONEGZZNKSA-N 1 3 347.478 2.628 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C\CNC(=O)CN2CCC(C)CC2)cc1F ZINC001669107700 1105436597 /nfs/dbraw/zinc/43/65/97/1105436597.db2.gz NZFHWFFYFDIRDW-ARJAWSKDSA-N 1 3 347.478 2.628 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC/C=C/CN[C@H]1CCc2ccc(Cl)cc21 ZINC001669126867 1105439885 /nfs/dbraw/zinc/43/98/85/1105439885.db2.gz QDHQSJXPWMDHLV-WRFKIARRSA-N 1 3 349.906 2.931 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC/C=C/CN[C@H]1CCc2ccc(Cl)cc21 ZINC001669126867 1105439888 /nfs/dbraw/zinc/43/98/88/1105439888.db2.gz QDHQSJXPWMDHLV-WRFKIARRSA-N 1 3 349.906 2.931 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)[C@@H]2CCC[C@@H]([NH+](C)C)C2)cs1 ZINC001669138362 1105441411 /nfs/dbraw/zinc/44/14/11/1105441411.db2.gz HJVQPCJMXWVLID-IFOCYFHOSA-N 1 3 349.544 2.939 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C/C[NH2+]Cc1c(C)cccc1C ZINC001669206719 1105456938 /nfs/dbraw/zinc/45/69/38/1105456938.db2.gz GPFKHOVRRHMYDH-ROUKRRSUSA-N 1 3 343.515 2.940 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001669289436 1105468772 /nfs/dbraw/zinc/46/87/72/1105468772.db2.gz XOKQQSCEZJWEGB-IEBWSBKVSA-N 1 3 331.504 2.505 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H](C)NC(=O)C(C)(C)N2CCCCC2)cc1 ZINC001669294162 1105469949 /nfs/dbraw/zinc/46/99/49/1105469949.db2.gz YZJBDZGLLNYOFS-GOSISDBHSA-N 1 3 345.531 2.896 10 0 EFAEHO C[C@H]([NH2+]C/C=C\CNC(=O)CN(C)C1CCC1)c1ccc(F)cc1 ZINC001483018794 1105561447 /nfs/dbraw/zinc/56/14/47/1105561447.db2.gz RLGNHIIJKURFMS-JZIMQPMSSA-N 1 3 333.451 2.633 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2CCCC[C@@H]2C[NH2+]CCCF)c1 ZINC001669985830 1105564748 /nfs/dbraw/zinc/56/47/48/1105564748.db2.gz NDMFXKGFQAJKOC-MOPGFXCFSA-N 1 3 349.494 2.986 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[NH2+]C[C@@H]2CCCC(F)(F)C2)CCC1 ZINC001670123688 1105583842 /nfs/dbraw/zinc/58/38/42/1105583842.db2.gz AZIJEZZFAJFBHQ-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)Cc1c[nH]cn1)c1ccc2c(c1)CCC2 ZINC001670261722 1105607185 /nfs/dbraw/zinc/60/71/85/1105607185.db2.gz UMOVBCIKXOZZNM-OAHLLOKOSA-N 1 3 340.471 2.640 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC[C@H]2C[NH2+]C/C=C/Cl)c1 ZINC001671385432 1105632544 /nfs/dbraw/zinc/63/25/44/1105632544.db2.gz WOHOQVKANLMCLB-MPNRVQBSSA-N 1 3 335.879 2.695 10 0 EFAEHO C[NH+](C)CC1(C(=O)NC/C=C/CNC/C=C\Cl)CCCCC1 ZINC001483037664 1105737736 /nfs/dbraw/zinc/73/77/36/1105737736.db2.gz PXSPKVTWTSOGDQ-VEQVDCDKSA-N 1 3 327.900 2.513 10 0 EFAEHO CN(C)C1(C(=O)N(CC[NH2+]C/C=C\Cl)Cc2ccccc2)CCC1 ZINC001672391951 1105821576 /nfs/dbraw/zinc/82/15/76/1105821576.db2.gz DPCHNTPBOXIJMX-GHXNOFRVSA-N 1 3 349.906 2.842 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@@H]2[C@H]1CCN2CCC(F)(F)F ZINC001672538452 1105864186 /nfs/dbraw/zinc/86/41/86/1105864186.db2.gz QYNRZTPKTXUERV-HUUCEWRRSA-N 1 3 349.441 2.736 10 0 EFAEHO CCCCC[N@@H+]1C[C@@H]2CCCN(C(=O)[C@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001672554618 1105870818 /nfs/dbraw/zinc/87/08/18/1105870818.db2.gz WRKWAJPCUVNIPY-IPMKNSEASA-N 1 3 335.536 2.972 10 0 EFAEHO CCCCC[N@H+]1C[C@@H]2CCCN(C(=O)[C@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001672554618 1105870821 /nfs/dbraw/zinc/87/08/21/1105870821.db2.gz WRKWAJPCUVNIPY-IPMKNSEASA-N 1 3 335.536 2.972 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(Cl)cc2)C1 ZINC001672761912 1105898015 /nfs/dbraw/zinc/89/80/15/1105898015.db2.gz RYRCOGWZPSEHPU-AEFFLSMTSA-N 1 3 349.906 2.762 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN(C)C3CCC3)C2)cc1 ZINC001672806214 1105908699 /nfs/dbraw/zinc/90/86/99/1105908699.db2.gz UYONELJACDCBKR-LJQANCHMSA-N 1 3 343.515 2.808 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](CC[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001672859343 1105922653 /nfs/dbraw/zinc/92/26/53/1105922653.db2.gz RPGGLIRPMJRVJW-IEBWSBKVSA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@@H]1[NH2+]CCCC1CCCC1 ZINC001673877001 1106095048 /nfs/dbraw/zinc/09/50/48/1106095048.db2.gz BJQZUJAYHKTFDY-WMZOPIPTSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC1CC(C[NH2+]CCC2CCCC2)C1 ZINC001674611435 1106221857 /nfs/dbraw/zinc/22/18/57/1106221857.db2.gz FIFQILQJZJNTEB-CTWPCTMYSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)CC[NH2+]CC1CC(NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001674611159 1106222174 /nfs/dbraw/zinc/22/21/74/1106222174.db2.gz BOKUYYIBBSWXOT-UHFFFAOYSA-N 1 3 331.504 2.892 10 0 EFAEHO CCCCC[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)C3(N(C)C)CCC3)C[C@@H]2C1 ZINC001675636426 1106400257 /nfs/dbraw/zinc/40/02/57/1106400257.db2.gz VLLUPDVQPHMJLM-RCCFBDPRSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCCC[N@H+]1C[C@@H]2CC[C@@H](NC(=O)C3(N(C)C)CCC3)C[C@@H]2C1 ZINC001675636426 1106400259 /nfs/dbraw/zinc/40/02/59/1106400259.db2.gz VLLUPDVQPHMJLM-RCCFBDPRSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+][C@@H](C)c1ccccc1 ZINC001676014125 1106469145 /nfs/dbraw/zinc/46/91/45/1106469145.db2.gz ZOZFGMBIJFRLCF-GJZGRUSLSA-N 1 3 328.460 2.896 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CCC[NH2+]Cc1ccccc1 ZINC001676024566 1106471533 /nfs/dbraw/zinc/47/15/33/1106471533.db2.gz WBDOSRLGCAUQHI-MJGOQNOKSA-N 1 3 331.504 2.936 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@H](C[NH2+]CCC2CCCC2)C2CC2)C1 ZINC001676249296 1106505536 /nfs/dbraw/zinc/50/55/36/1106505536.db2.gz KFNZBIJAFNBCCC-VQIMIIECSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@@H](C[NH2+]CCC2CCCC2)C2CC2)C1 ZINC001676249293 1106505630 /nfs/dbraw/zinc/50/56/30/1106505630.db2.gz KFNZBIJAFNBCCC-APWZRJJASA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H]1[C@@H]([NH2+]CCCCc2ccccc2)CCN1C(=O)CN1CCCC1 ZINC001676692418 1106559667 /nfs/dbraw/zinc/55/96/67/1106559667.db2.gz DUEIIIDRLZNVHX-QUCCMNQESA-N 1 3 343.515 2.684 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCc2cccc(F)c2)C[C@H]1C ZINC001676774145 1106577858 /nfs/dbraw/zinc/57/78/58/1106577858.db2.gz KGXWOXNDQXVIBP-APWZRJJASA-N 1 3 349.494 2.679 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC/C=C\CNCc2cccc(F)c2)C1 ZINC001483049646 1106602285 /nfs/dbraw/zinc/60/22/85/1106602285.db2.gz OSKPSMSNIFPSDU-JXCVUKRWSA-N 1 3 347.478 2.710 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC/C=C\CNCc2cccc(F)c2)C1 ZINC001483049646 1106602288 /nfs/dbraw/zinc/60/22/88/1106602288.db2.gz OSKPSMSNIFPSDU-JXCVUKRWSA-N 1 3 347.478 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H](C[NH2+]CC=C(Cl)Cl)C1 ZINC001676973811 1106640181 /nfs/dbraw/zinc/64/01/81/1106640181.db2.gz BGNMWIAAJJEQBP-QWHCGFSZSA-N 1 3 336.307 2.520 10 0 EFAEHO CCCC[NH2+][C@H]1CN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1(C)C ZINC001677023835 1106651453 /nfs/dbraw/zinc/65/14/53/1106651453.db2.gz PWJAZKPUAGJNSX-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO Cc1ccc(CCC[NH2+]C2CC(N(C)C(=O)[C@H]3CCCN3C)C2)cc1 ZINC001677419158 1106715547 /nfs/dbraw/zinc/71/55/47/1106715547.db2.gz GJWNJQAZEBDWQK-SOAGJPPSSA-N 1 3 343.515 2.601 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC([NH2+]CCCc2ccsc2)C1)N(C)C ZINC001677427191 1106716143 /nfs/dbraw/zinc/71/61/43/1106716143.db2.gz JPIKTVZSAOYPQT-JCYILVPMSA-N 1 3 337.533 2.600 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC([NH2+]CCCc2ccccc2C)C1)N(C)C ZINC001677427031 1106716335 /nfs/dbraw/zinc/71/63/35/1106716335.db2.gz GHGWNSJPYDGIDP-MHJFOBGBSA-N 1 3 345.531 2.847 10 0 EFAEHO [NH3+][C@H](CN[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12)CC(F)F ZINC000903936138 1107448209 /nfs/dbraw/zinc/44/82/09/1107448209.db2.gz YSIGPZIHUGXGQG-BNQQVVLKSA-N 1 3 331.204 2.659 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)[C@H](C)[NH2+]CC1CC2(CCC2)C1 ZINC001409344395 1107587086 /nfs/dbraw/zinc/58/70/86/1107587086.db2.gz BFIKAUSSSHUDEO-HOTGVXAUSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@@H](C)[NH2+]CC1CC2(CCC2)C1 ZINC001409344403 1107588045 /nfs/dbraw/zinc/58/80/45/1107588045.db2.gz BFIKAUSSSHUDEO-HZPDHXFCSA-N 1 3 335.536 2.924 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]C/C=C/Cl)CC(C)(C)C ZINC001272308543 1107727044 /nfs/dbraw/zinc/72/70/44/1107727044.db2.gz BSOWURXKDICKAJ-OVPGCVMQSA-N 1 3 329.916 2.591 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]C/C=C\Cl)CC(C)(C)C ZINC001272308536 1107727615 /nfs/dbraw/zinc/72/76/15/1107727615.db2.gz BSOWURXKDICKAJ-AJNJCKRNSA-N 1 3 329.916 2.591 10 0 EFAEHO CC(C)CCC[NH2+]C/C=C\CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001483060240 1107846890 /nfs/dbraw/zinc/84/68/90/1107846890.db2.gz GMAKLKUBHULSKU-LIXSYLKWSA-N 1 3 341.515 2.897 10 0 EFAEHO Cc1cc(C[NH2+]C/C=C\CNC(=O)CN(C)CC(C)(C)C)cs1 ZINC001483060247 1107857848 /nfs/dbraw/zinc/85/78/48/1107857848.db2.gz GQDSJRRVJJAHQC-SREVYHEPSA-N 1 3 337.533 2.796 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@H]21 ZINC001272216714 1107919516 /nfs/dbraw/zinc/91/95/16/1107919516.db2.gz WUJWBHKLYALZCG-PKVWGGKHSA-N 1 3 333.520 2.750 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@H]21 ZINC001272216714 1107919527 /nfs/dbraw/zinc/91/95/27/1107919527.db2.gz WUJWBHKLYALZCG-PKVWGGKHSA-N 1 3 333.520 2.750 10 0 EFAEHO C[C@@H](NCc1ccccc1Cl)[C@H](C)NC(=O)CCC[NH+](C)C ZINC001409365886 1107921463 /nfs/dbraw/zinc/92/14/63/1107921463.db2.gz AELANTBZRLKUFZ-KGLIPLIRSA-N 1 3 325.884 2.665 10 0 EFAEHO c1cc(CNC2(c3ccc4c(c3)OCCO4)CC2)c2c(c1)C[NH2+]CC2 ZINC000904469443 1107958776 /nfs/dbraw/zinc/95/87/76/1107958776.db2.gz MKDZZELMMSWNBW-UHFFFAOYSA-N 1 3 336.435 2.882 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NC[C@H]1CCN1CC1CC2(CCC2)C1 ZINC001483708091 1108076827 /nfs/dbraw/zinc/07/68/27/1108076827.db2.gz GSIBPYASQIHKIY-GOSISDBHSA-N 1 3 333.520 2.633 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C/CNC(=O)CC1CC[NH+](C)CC1 ZINC001483068531 1108268483 /nfs/dbraw/zinc/26/84/83/1108268483.db2.gz HSNXWZQESGWPER-ONEGZZNKSA-N 1 3 347.478 2.628 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C\CNC(=O)CC1CC[NH+](C)CC1 ZINC001483068529 1108268795 /nfs/dbraw/zinc/26/87/95/1108268795.db2.gz HSNXWZQESGWPER-ARJAWSKDSA-N 1 3 347.478 2.628 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)[C@H](C(C)C)N(C)C)C2)cc1 ZINC001409269832 1108359568 /nfs/dbraw/zinc/35/95/68/1108359568.db2.gz HEBCLBBDGPHZPJ-ACBHZAAOSA-N 1 3 331.504 2.566 10 0 EFAEHO CCc1cccc(C[NH2+]C/C=C/CNC(=O)CN2CCC(C)CC2)c1 ZINC001483076256 1108402292 /nfs/dbraw/zinc/40/22/92/1108402292.db2.gz DAOMAUHJIUTVGS-SNAWJCMRSA-N 1 3 343.515 2.743 10 0 EFAEHO CC1CC(C[NH2+]CC(C)(C)CN(C)C(=O)C(C)(C)N2CCCC2)C1 ZINC001409437506 1108405089 /nfs/dbraw/zinc/40/50/89/1108405089.db2.gz AAGDWPQZLQCGRE-UHFFFAOYSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC/C=C\CN[C@@H]1CCCc2ccc(F)cc21 ZINC001483078719 1108422053 /nfs/dbraw/zinc/42/20/53/1108422053.db2.gz FTEOWUSPMBATPX-PHWHVTFISA-N 1 3 347.478 2.807 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC/C=C\CN[C@@H]1CCCc2ccc(F)cc21 ZINC001483078719 1108422058 /nfs/dbraw/zinc/42/20/58/1108422058.db2.gz FTEOWUSPMBATPX-PHWHVTFISA-N 1 3 347.478 2.807 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](CC[NH2+]CCc2ccc(C)cc2)C1)N(C)C ZINC001272474899 1108433250 /nfs/dbraw/zinc/43/32/50/1108433250.db2.gz KKZWMGDAZZWVJR-VQTJNVASSA-N 1 3 345.531 2.706 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)NC/C=C/CNCc2ccc(F)cc2)C1 ZINC001483082656 1108454909 /nfs/dbraw/zinc/45/49/09/1108454909.db2.gz UBYAASCWAVPYOZ-JFZXIXNHSA-N 1 3 347.478 2.708 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@H]1CCCN(CCc2cccs2)C1 ZINC001266246433 1108671325 /nfs/dbraw/zinc/67/13/25/1108671325.db2.gz PMJKECXZHRBKOU-INIZCTEOSA-N 1 3 337.533 2.603 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+][C@@H]2CCc3ccccc32)CC1 ZINC001483738667 1108699554 /nfs/dbraw/zinc/69/95/54/1108699554.db2.gz SGXGHKSYVIWNEK-RTBURBONSA-N 1 3 341.499 2.787 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(Cl)cc1 ZINC001483197613 1109996641 /nfs/dbraw/zinc/99/66/41/1109996641.db2.gz NGOZDINSAXGJIE-RHSMWYFYSA-N 1 3 337.895 2.809 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+][C@H](C)c2cc(C)ccc2C)CC1)N(C)C ZINC001483748014 1111260945 /nfs/dbraw/zinc/26/09/45/1111260945.db2.gz YXHKLNYIFJJSRQ-SJLPKXTDSA-N 1 3 331.504 2.943 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+]Cc2csc(C)c2)C1 ZINC001272624847 1111764564 /nfs/dbraw/zinc/76/45/64/1111764564.db2.gz PRNSYXGDLNHMJF-MRXNPFEDSA-N 1 3 337.533 2.727 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001272641025 1111814758 /nfs/dbraw/zinc/81/47/58/1111814758.db2.gz AIXNPODZYCRGJB-SFHVURJKSA-N 1 3 343.515 2.673 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NCC2(NCc3ccsc3)CC2)C1 ZINC001483760863 1112045903 /nfs/dbraw/zinc/04/59/03/1112045903.db2.gz BCHWHEIUXJTCNF-INIZCTEOSA-N 1 3 335.517 2.609 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NCC2(NCc3ccsc3)CC2)C1 ZINC001483760863 1112045907 /nfs/dbraw/zinc/04/59/07/1112045907.db2.gz BCHWHEIUXJTCNF-INIZCTEOSA-N 1 3 335.517 2.609 10 0 EFAEHO Cc1ccc(CNC2(CNC(=O)[C@H]3CCC[C@H]([NH+](C)C)C3)CC2)cc1 ZINC001483783305 1112456971 /nfs/dbraw/zinc/45/69/71/1112456971.db2.gz LFOXCUQZBGQKIQ-OALUTQOASA-N 1 3 343.515 2.854 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001483848243 1112509626 /nfs/dbraw/zinc/50/96/26/1112509626.db2.gz RPADQHRGYVESHK-AQKVLALTSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001483848243 1112509627 /nfs/dbraw/zinc/50/96/27/1112509627.db2.gz RPADQHRGYVESHK-AQKVLALTSA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)cs1 ZINC001483913867 1112556326 /nfs/dbraw/zinc/55/63/26/1112556326.db2.gz KJUOICTXZIKSJN-YOEHRIQHSA-N 1 3 337.533 2.866 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CCCCCF)CCN1C(=O)CN(C)C1CCC1 ZINC001483905494 1112565611 /nfs/dbraw/zinc/56/56/11/1112565611.db2.gz NRGMAIZEZKFRNO-HZPDHXFCSA-N 1 3 327.488 2.580 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]1CNCc1cc(Cl)ccc1F ZINC001483942184 1112583465 /nfs/dbraw/zinc/58/34/65/1112583465.db2.gz GKWLVCLYRARMIS-HNNXBMFYSA-N 1 3 341.858 2.511 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@@H]1CCCN1C(=O)CN(C)C(C)C ZINC001483959315 1112589401 /nfs/dbraw/zinc/58/94/01/1112589401.db2.gz QKXDJPUCWIGOQE-SFHVURJKSA-N 1 3 335.467 2.555 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[NH2+]C/C=C/c1ccccc1 ZINC001483951709 1112594935 /nfs/dbraw/zinc/59/49/35/1112594935.db2.gz JPWFKSBFOJGTSJ-SSVWKNEZSA-N 1 3 329.488 2.622 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]C/C=C/Cl)C1CCCC1 ZINC001484001730 1112652580 /nfs/dbraw/zinc/65/25/80/1112652580.db2.gz RYEDZUNGVGUFHC-HYMNUWHNSA-N 1 3 341.927 2.878 10 0 EFAEHO CC(C)(C(=O)NC[C@@]1(C)CCC[N@H+](CC2CCC2)C1)N1CCCC1 ZINC001484164784 1112868944 /nfs/dbraw/zinc/86/89/44/1112868944.db2.gz FRHJDQQYTVQYRB-HXUWFJFHSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)(C(=O)NC[C@@]1(C)CCC[N@@H+](CC2CCC2)C1)N1CCCC1 ZINC001484164784 1112868949 /nfs/dbraw/zinc/86/89/49/1112868949.db2.gz FRHJDQQYTVQYRB-HXUWFJFHSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@]1(C)CCC[N@H+](CCC(C)(C)C)C1 ZINC001484174773 1112889947 /nfs/dbraw/zinc/88/99/47/1112889947.db2.gz MRNJGEYSFAXRCR-IBGZPJMESA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@]1(C)CCC[N@@H+](CCC(C)(C)C)C1 ZINC001484174773 1112889951 /nfs/dbraw/zinc/88/99/51/1112889951.db2.gz MRNJGEYSFAXRCR-IBGZPJMESA-N 1 3 325.541 2.981 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H](CC[NH2+]CC3CC4(CCC4)C3)C2)CCC1 ZINC001484524460 1112980390 /nfs/dbraw/zinc/98/03/90/1112980390.db2.gz ZWRVZOYIENWFEO-KRWDZBQOSA-N 1 3 347.547 2.879 10 0 EFAEHO CN(CC(=O)N1CC[C@H](CC[NH2+]CCc2ccccc2)C1)C1CCC1 ZINC001484525923 1112981875 /nfs/dbraw/zinc/98/18/75/1112981875.db2.gz UKZUKTBIZICOEZ-IBGZPJMESA-N 1 3 343.515 2.542 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2cc(C)ccc2C)C1)N(C)C ZINC001484548139 1112996418 /nfs/dbraw/zinc/99/64/18/1112996418.db2.gz WBHHAAPBYOCBMW-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO C[C@@H]([NH2+]CC[C@@H]1CCN(C(=O)CN2CCCC2)C1)c1cccc(F)c1 ZINC001484550042 1113002328 /nfs/dbraw/zinc/00/23/28/1113002328.db2.gz PWALAGAOWUEIOI-IAGOWNOFSA-N 1 3 347.478 2.811 10 0 EFAEHO C[C@H]([NH2+]CC[C@H]1CCN(C(=O)CN2CCCC2)C1)c1cccc(F)c1 ZINC001484550043 1113002683 /nfs/dbraw/zinc/00/26/83/1113002683.db2.gz PWALAGAOWUEIOI-IRXDYDNUSA-N 1 3 347.478 2.811 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001484551254 1113003693 /nfs/dbraw/zinc/00/36/93/1113003693.db2.gz FJZBGBGFEHGXGA-LJQANCHMSA-N 1 3 331.504 2.663 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NCc1ccc([C@@H](C)NCCF)cc1 ZINC001484558314 1113012141 /nfs/dbraw/zinc/01/21/41/1113012141.db2.gz DHXXYTYNKGPOHW-QAPCUYQASA-N 1 3 335.467 2.797 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NCc1ccc([C@@H](C)NCCF)cc1 ZINC001484558314 1113012145 /nfs/dbraw/zinc/01/21/45/1113012145.db2.gz DHXXYTYNKGPOHW-QAPCUYQASA-N 1 3 335.467 2.797 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NCC2([NH2+]CCC3CC3)CCC2)C1 ZINC001484652790 1113093820 /nfs/dbraw/zinc/09/38/20/1113093820.db2.gz HXKJCGHMGFWJJN-IBGZPJMESA-N 1 3 339.499 2.628 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@]2(CC[N@H+](CC3CC(C)C3)C2)C1 ZINC001484828071 1117746241 /nfs/dbraw/zinc/74/62/41/1117746241.db2.gz AHOSVDPOCUAOLI-QLOJAFMTSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@]2(CC[N@@H+](CC3CC(C)C3)C2)C1 ZINC001484828071 1117746245 /nfs/dbraw/zinc/74/62/45/1117746245.db2.gz AHOSVDPOCUAOLI-QLOJAFMTSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@H]1[NH2+]CCCC1CCC1 ZINC001484900702 1117805517 /nfs/dbraw/zinc/80/55/17/1117805517.db2.gz UINDNRUXKNGZAK-FUHWJXTLSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1C ZINC001484909446 1117822992 /nfs/dbraw/zinc/82/29/92/1117822992.db2.gz NHZJGXPMTJIWNV-MJGOQNOKSA-N 1 3 331.504 2.580 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001484910976 1117824565 /nfs/dbraw/zinc/82/45/65/1117824565.db2.gz ZAVFJPIAGZFGGF-ICSRJNTNSA-N 1 3 345.531 2.704 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+]1CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]1C ZINC001484987893 1117914877 /nfs/dbraw/zinc/91/48/77/1117914877.db2.gz LGHGXSFOFFEGEO-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+]1CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]1C ZINC001484987893 1117914878 /nfs/dbraw/zinc/91/48/78/1117914878.db2.gz LGHGXSFOFFEGEO-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@H](C)[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001484994337 1117929318 /nfs/dbraw/zinc/92/93/18/1117929318.db2.gz KHTCXSVPCTVNBS-JYJNAYRXSA-N 1 3 347.494 2.883 10 0 EFAEHO CC[N@H+](CC=C(C)C)CC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001485031290 1117956780 /nfs/dbraw/zinc/95/67/80/1117956780.db2.gz LHSCTGIAFDKGLG-UHFFFAOYSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[N@@H+](CC=C(C)C)CC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001485031290 1117956781 /nfs/dbraw/zinc/95/67/81/1117956781.db2.gz LHSCTGIAFDKGLG-UHFFFAOYSA-N 1 3 335.536 2.997 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCCC[C@H]2C[NH2+]CCCF)c1 ZINC001485041344 1117959611 /nfs/dbraw/zinc/95/96/11/1117959611.db2.gz CXFRRMHKNSJLIS-SFHVURJKSA-N 1 3 335.467 2.692 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)C1(N(C)C)CCC1 ZINC001485044282 1117963677 /nfs/dbraw/zinc/96/36/77/1117963677.db2.gz WNOJMMROSUANLU-ZTFGCOKTSA-N 1 3 347.478 2.591 10 0 EFAEHO CC[C@H](C)C[N@H+](CC)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001485033217 1117965884 /nfs/dbraw/zinc/96/58/84/1117965884.db2.gz ZOBKUICAPXQAGM-ROUUACIJSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C)C[N@@H+](CC)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001485033217 1117965888 /nfs/dbraw/zinc/96/58/88/1117965888.db2.gz ZOBKUICAPXQAGM-ROUUACIJSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C)C[N@H+](CC)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001485033215 1117966026 /nfs/dbraw/zinc/96/60/26/1117966026.db2.gz ZOBKUICAPXQAGM-MSOLQXFVSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C)C[N@@H+](CC)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001485033215 1117966029 /nfs/dbraw/zinc/96/60/29/1117966029.db2.gz ZOBKUICAPXQAGM-MSOLQXFVSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[N@H+](CC1CC(C)C1)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001485034070 1117967077 /nfs/dbraw/zinc/96/70/77/1117967077.db2.gz FTMIPJXEVSABJP-UHFFFAOYSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[N@@H+](CC1CC(C)C1)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001485034070 1117967080 /nfs/dbraw/zinc/96/70/80/1117967080.db2.gz FTMIPJXEVSABJP-UHFFFAOYSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]Cc2ccccc2Cl)C1)N(C)C ZINC001485103297 1118039722 /nfs/dbraw/zinc/03/97/22/1118039722.db2.gz NFQBBYZCRCCGMZ-PGEKIEPBSA-N 1 3 337.895 2.665 10 0 EFAEHO CCc1ccc(CC[NH2+][C@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001485158517 1118101446 /nfs/dbraw/zinc/10/14/46/1118101446.db2.gz ZGBIOEVPUGGHHU-SJORKVTESA-N 1 3 345.531 2.759 10 0 EFAEHO C[C@H](NCc1ccns1)[C@H](C)NC(=O)c1ccc(C[NH+](C)C)cc1 ZINC001485201254 1118125648 /nfs/dbraw/zinc/12/56/48/1118125648.db2.gz XCRSRGGFUNEKPQ-KBPBESRZSA-N 1 3 346.500 2.501 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H](C)[NH2+]CCCc1cccc(C)c1 ZINC001485219557 1118139775 /nfs/dbraw/zinc/13/97/75/1118139775.db2.gz YDFLKKFPKZVEEY-JKSUJKDBSA-N 1 3 342.487 2.685 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H](C)[NH2+]CCCc1cccc(C)c1 ZINC001485219556 1118139881 /nfs/dbraw/zinc/13/98/81/1118139881.db2.gz YDFLKKFPKZVEEY-HZPDHXFCSA-N 1 3 342.487 2.685 10 0 EFAEHO C[C@@H](NCc1ccns1)[C@H](C)NC(=O)c1cccc(C[NH+](C)C)c1 ZINC001485228172 1118154416 /nfs/dbraw/zinc/15/44/16/1118154416.db2.gz CIDNPDLLACUQMF-KGLIPLIRSA-N 1 3 346.500 2.501 10 0 EFAEHO CC(C)CC[NH2+]CC(C)(C)CN(C)C(=O)CN1[C@H](C)CC[C@H]1C ZINC001485265467 1118184129 /nfs/dbraw/zinc/18/41/29/1118184129.db2.gz AXCLBGXYQLMNKE-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@H](C)CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001485298638 1118216164 /nfs/dbraw/zinc/21/61/64/1118216164.db2.gz BINGVHGQWVPFKE-IEBWSBKVSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@H](C)CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001485298638 1118216169 /nfs/dbraw/zinc/21/61/69/1118216169.db2.gz BINGVHGQWVPFKE-IEBWSBKVSA-N 1 3 331.504 2.804 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1C[NH+]2CCC1CC2)N(C)Cc1ccc(Cl)cc1 ZINC001485300376 1118217822 /nfs/dbraw/zinc/21/78/22/1118217822.db2.gz DGPGYVYRHJIMTL-RDTXWAMCSA-N 1 3 349.906 2.618 10 0 EFAEHO Cc1cc(CN2CCCCC[C@H]2CNC(=O)CC[NH+](C)C)cs1 ZINC001485482913 1118388017 /nfs/dbraw/zinc/38/80/17/1118388017.db2.gz TUQORGKGAJKZDU-KRWDZBQOSA-N 1 3 337.533 2.869 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)C1C[NH+](CC2CCC(C)CC2)C1 ZINC001485508312 1118427146 /nfs/dbraw/zinc/42/71/46/1118427146.db2.gz BUKXXSGRQYDDLI-AQFXKWCLSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)C1C[NH+](CC2CCCCC2)C1 ZINC001485520684 1118433814 /nfs/dbraw/zinc/43/38/14/1118433814.db2.gz QKHNOXNOZKXHMN-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](NC(=O)CCCC[NH+]1CCCC1)C1CN(Cc2ccccc2)C1 ZINC001485538228 1118439041 /nfs/dbraw/zinc/43/90/41/1118439041.db2.gz DGMSESCCNWNDHX-GOSISDBHSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1C[NH+]([C@@H]2CCCc3ccccc32)C1 ZINC001485540713 1118440691 /nfs/dbraw/zinc/44/06/91/1118440691.db2.gz UETNCGAGVHZVPL-OXQOHEQNSA-N 1 3 343.515 2.841 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1CN(CCc2ccccc2F)CC1(C)C ZINC001485579297 1118465282 /nfs/dbraw/zinc/46/52/82/1118465282.db2.gz KICAPDFSUOTUJK-GOSISDBHSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1CN(CCc2ccccc2F)CC1(C)C ZINC001485579297 1118465285 /nfs/dbraw/zinc/46/52/85/1118465285.db2.gz KICAPDFSUOTUJK-GOSISDBHSA-N 1 3 349.494 2.537 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCCC2(CN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001485662495 1118511424 /nfs/dbraw/zinc/51/14/24/1118511424.db2.gz INAPLMKGEXUVOZ-WAYWQWQTSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C\CC[N@H+]1CCCC2(CN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001485662495 1118511425 /nfs/dbraw/zinc/51/14/25/1118511425.db2.gz INAPLMKGEXUVOZ-WAYWQWQTSA-N 1 3 333.520 2.751 10 0 EFAEHO CC(C)=CC[N@H+]1CCCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001485664000 1118513295 /nfs/dbraw/zinc/51/32/95/1118513295.db2.gz MDQUQGQHNSBPGX-UHFFFAOYSA-N 1 3 335.536 2.855 10 0 EFAEHO CC(C)=CC[N@@H+]1CCCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001485664000 1118513296 /nfs/dbraw/zinc/51/32/96/1118513296.db2.gz MDQUQGQHNSBPGX-UHFFFAOYSA-N 1 3 335.536 2.855 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]CC[C@@H]2CCCC2(F)F)C1)N(C)C ZINC001485688321 1118527987 /nfs/dbraw/zinc/52/79/87/1118527987.db2.gz FFAPLERTGIWSCA-YHUYYLMFSA-N 1 3 345.478 2.637 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+]CC1CCC(C)CC1 ZINC001485747457 1118567959 /nfs/dbraw/zinc/56/79/59/1118567959.db2.gz ZRKUMINCVNQLAU-ISXOHVOVSA-N 1 3 334.508 2.961 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+]CC1CCC(C)CC1 ZINC001485747456 1118568151 /nfs/dbraw/zinc/56/81/51/1118568151.db2.gz ZRKUMINCVNQLAU-CKDBGZEDSA-N 1 3 334.508 2.961 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@@H]1CC[N@H+](C)[C@H](C)C1)[C@@H](c1ccccc1)N(C)C ZINC000357278726 299074159 /nfs/dbraw/zinc/07/41/59/299074159.db2.gz WSYYNGGJSKSJSJ-JFRXWTBNSA-N 1 3 346.519 2.802 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1)[C@@H](c1ccccc1)N(C)C ZINC000357278726 299074160 /nfs/dbraw/zinc/07/41/60/299074160.db2.gz WSYYNGGJSKSJSJ-JFRXWTBNSA-N 1 3 346.519 2.802 10 0 EFAEHO CN(C)[C@H](CNC(=O)NC1CC([NH+]2CCCCC2)C1)c1ccccc1 ZINC000369722761 282241733 /nfs/dbraw/zinc/24/17/33/282241733.db2.gz NHWOWPDRGLRSGM-CTWPCTMYSA-N 1 3 344.503 2.605 10 0 EFAEHO C[N@H+](Cc1ccc(Br)cc1)[C@H](CN)[C@@H]1CCCOC1 ZINC000104303794 219372959 /nfs/dbraw/zinc/37/29/59/219372959.db2.gz YBYTYJFPFDVODT-UKRRQHHQSA-N 1 3 327.266 2.635 10 0 EFAEHO C[N@@H+](Cc1ccc(Br)cc1)[C@H](CN)[C@@H]1CCCOC1 ZINC000104303794 219372961 /nfs/dbraw/zinc/37/29/61/219372961.db2.gz YBYTYJFPFDVODT-UKRRQHHQSA-N 1 3 327.266 2.635 10 0 EFAEHO C[C@H](O)C[NH+]1CCC(CNCc2nc(-c3ccccc3)cs2)CC1 ZINC000069347385 215380861 /nfs/dbraw/zinc/38/08/61/215380861.db2.gz AUAKLTSRXAPIQS-HNNXBMFYSA-N 1 3 345.512 2.993 10 0 EFAEHO CN(CC1([NH+](C)C)CCC1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000186771315 236013358 /nfs/dbraw/zinc/01/33/58/236013358.db2.gz DFANNVUHOSHODZ-ROUUACIJSA-N 1 3 344.503 2.558 10 0 EFAEHO O[C@]1(C[NH2+]CC2CCC(c3nc4ccccc4[nH]3)CC2)CCCNC1 ZINC000072433038 216226572 /nfs/dbraw/zinc/22/65/72/216226572.db2.gz LMHQWAGGIYVXAY-ALLBUHFWSA-N 1 3 342.487 2.541 10 0 EFAEHO Cn1cnc(CCN[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)c1 ZINC000414121266 244013335 /nfs/dbraw/zinc/01/33/35/244013335.db2.gz GFEOPJDGEJVYMA-NJDAHSKKSA-N 1 3 338.499 2.995 10 0 EFAEHO Cn1cnc(CCN[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)c1 ZINC000414121266 244013343 /nfs/dbraw/zinc/01/33/43/244013343.db2.gz GFEOPJDGEJVYMA-NJDAHSKKSA-N 1 3 338.499 2.995 10 0 EFAEHO COCC[C@H]1CCC[C@H]1[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000414296935 244078326 /nfs/dbraw/zinc/07/83/26/244078326.db2.gz FVCADAHYVVOJEC-WOJBJXKFSA-N 1 3 346.515 2.808 10 0 EFAEHO COCC1CCC([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CC1 ZINC000414297794 244078789 /nfs/dbraw/zinc/07/87/89/244078789.db2.gz GQKMHTLARLLDQE-UHFFFAOYSA-N 1 3 346.515 2.808 10 0 EFAEHO COCC[C@@H]1CCC[C@H]1[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000414296933 244079355 /nfs/dbraw/zinc/07/93/55/244079355.db2.gz FVCADAHYVVOJEC-VQTJNVASSA-N 1 3 346.515 2.808 10 0 EFAEHO COCC[C@@H]1CCC[C@@H]1[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000414296929 244079371 /nfs/dbraw/zinc/07/93/71/244079371.db2.gz FVCADAHYVVOJEC-PMACEKPBSA-N 1 3 346.515 2.808 10 0 EFAEHO C[C@H](Cc1ccoc1)[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000414301573 244081932 /nfs/dbraw/zinc/08/19/32/244081932.db2.gz JVWCAJVBQLTXAM-QGZVFWFLSA-N 1 3 328.456 2.827 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1)[C@H]1C[C@H]1C ZINC000414336598 244093962 /nfs/dbraw/zinc/09/39/62/244093962.db2.gz IKQWLFAHMFSQJE-VCBZYWHSSA-N 1 3 329.488 2.518 10 0 EFAEHO CC(C)NC(=O)[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000414347930 244101763 /nfs/dbraw/zinc/10/17/63/244101763.db2.gz RLRYPNKSTYRDKM-OQIJWPOYSA-N 1 3 329.488 2.685 10 0 EFAEHO CCC1(C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCOCC1 ZINC000414523377 244211318 /nfs/dbraw/zinc/21/13/18/244211318.db2.gz HXIOFDKYJPSDPD-UHFFFAOYSA-N 1 3 346.515 2.810 10 0 EFAEHO CC[C@@H]1C[C@@H](C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCO1 ZINC000414528533 244213435 /nfs/dbraw/zinc/21/34/35/244213435.db2.gz UHRJIKNFSHYJBB-VQTJNVASSA-N 1 3 346.515 2.808 10 0 EFAEHO COc1cc(CNCc2ccc([C@H](C)[NH3+])cc2)cc2c1OCCO2 ZINC000414811636 244365421 /nfs/dbraw/zinc/36/54/21/244365421.db2.gz QAGOALXNUUJRAB-ZDUSSCGKSA-N 1 3 328.412 2.776 10 0 EFAEHO C[C@@H](CCN1C(=O)c2ccccc2C1=O)NCC1([NH3+])CCCCCC1 ZINC000414858784 244375955 /nfs/dbraw/zinc/37/59/55/244375955.db2.gz LJOMTKZTJKDWOP-HNNXBMFYSA-N 1 3 343.471 2.703 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@H](C)N[C@@H]1CC[NH2+]C[C@H]1C ZINC000414944910 244397597 /nfs/dbraw/zinc/39/75/97/244397597.db2.gz QRTYTCQCLAFTLK-MBNYWOFBSA-N 1 3 339.867 2.653 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+][C@@H]1CCNC[C@H]1C ZINC000414944910 244397602 /nfs/dbraw/zinc/39/76/02/244397602.db2.gz QRTYTCQCLAFTLK-MBNYWOFBSA-N 1 3 339.867 2.653 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)N[C@H]1CC[NH2+]C[C@H]1C ZINC000414945143 244399037 /nfs/dbraw/zinc/39/90/37/244399037.db2.gz RAMZMYFBTXXQRC-CPUCHLNUSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+][C@H]1CCNC[C@H]1C ZINC000414945143 244399044 /nfs/dbraw/zinc/39/90/44/244399044.db2.gz RAMZMYFBTXXQRC-CPUCHLNUSA-N 1 3 337.895 2.665 10 0 EFAEHO CCOc1cc(C[NH2+]C)cc(Br)c1OCCN(C)C ZINC000019777180 212065858 /nfs/dbraw/zinc/06/58/58/212065858.db2.gz QPRITKCKIMJBJK-UHFFFAOYSA-N 1 3 331.254 2.508 10 0 EFAEHO CCN(C(=O)NC[C@H](C)C[NH2+]C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418369015 284176704 /nfs/dbraw/zinc/17/67/04/284176704.db2.gz STNYVWAMNUEZOZ-ZHALLVOQSA-N 1 3 346.519 2.709 10 0 EFAEHO CC[NH+](CC)CCN(CC(C)C)C(=O)NC[C@@H](N)c1ccccc1 ZINC000418406072 245146414 /nfs/dbraw/zinc/14/64/14/245146414.db2.gz BQTFASJKUSSGMU-GOSISDBHSA-N 1 3 334.508 2.696 10 0 EFAEHO CCN(CC[NH+]1CCCCCC1)C(=O)NC[C@@H](N)c1ccccc1 ZINC000418453875 245163921 /nfs/dbraw/zinc/16/39/21/245163921.db2.gz PUEDSAHDXPFWDF-GOSISDBHSA-N 1 3 332.492 2.594 10 0 EFAEHO C[C@@H]1C[NH2+]CC[C@@H]1NC(=O)N1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000418602045 245209164 /nfs/dbraw/zinc/20/91/64/245209164.db2.gz UZZHVRHWIPNSRI-CVEARBPZSA-N 1 3 338.540 2.526 10 0 EFAEHO CC[NH2+][C@H](C)CNC(=O)N1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000418600307 245209530 /nfs/dbraw/zinc/20/95/30/245209530.db2.gz JFLJLALFJYNXFT-OAHLLOKOSA-N 1 3 326.529 2.526 10 0 EFAEHO CC[NH2+][C@H](C)CNC(=O)N(CC)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418607382 245211888 /nfs/dbraw/zinc/21/18/88/245211888.db2.gz QWMTXWKJIOBSEU-AOIWGVFYSA-N 1 3 346.519 2.851 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000418656866 245230055 /nfs/dbraw/zinc/23/00/55/245230055.db2.gz SYEHRQNUGHDMHC-IEBWSBKVSA-N 1 3 344.503 2.519 10 0 EFAEHO C[N@H+](CC(=O)NC1CCN(C2CC2)CC1)[C@@H]1CCC[C@H]1C(C)(C)C ZINC000419330877 245382654 /nfs/dbraw/zinc/38/26/54/245382654.db2.gz RADYFFBHNXKUNJ-QZTJIDSGSA-N 1 3 335.536 2.876 10 0 EFAEHO C[N@@H+](CC(=O)NC1CCN(C2CC2)CC1)[C@@H]1CCC[C@H]1C(C)(C)C ZINC000419330877 245382661 /nfs/dbraw/zinc/38/26/61/245382661.db2.gz RADYFFBHNXKUNJ-QZTJIDSGSA-N 1 3 335.536 2.876 10 0 EFAEHO C[N@H+](CC(=O)NC1CCN(C2CC2)CC1)[C@@H]1CCC[C@@H]1C(C)(C)C ZINC000419330879 245383008 /nfs/dbraw/zinc/38/30/08/245383008.db2.gz RADYFFBHNXKUNJ-ZWKOTPCHSA-N 1 3 335.536 2.876 10 0 EFAEHO C[N@@H+](CC(=O)NC1CCN(C2CC2)CC1)[C@@H]1CCC[C@@H]1C(C)(C)C ZINC000419330879 245383013 /nfs/dbraw/zinc/38/30/13/245383013.db2.gz RADYFFBHNXKUNJ-ZWKOTPCHSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@H]([NH2+]C[C@H]1CC[C@H](C(N)=O)CC1)c1cccc(OCCN(C)C)c1 ZINC000421850013 246137473 /nfs/dbraw/zinc/13/74/73/246137473.db2.gz CLBMIWLRJBMVRV-ULQDDVLXSA-N 1 3 347.503 2.569 10 0 EFAEHO COC1([C@H](C)[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCCC1 ZINC000421858796 246141346 /nfs/dbraw/zinc/14/13/46/246141346.db2.gz RFIPIVVYARCKTH-SFHVURJKSA-N 1 3 346.515 2.951 10 0 EFAEHO Fc1ccc2[nH]cc(CCN[C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)c2c1 ZINC000422761949 246449933 /nfs/dbraw/zinc/44/99/33/246449933.db2.gz NEKDBSQXGWPITL-ZHALLVOQSA-N 1 3 331.435 2.596 10 0 EFAEHO FC(F)C(F)(F)COCCN[C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000423072976 246563488 /nfs/dbraw/zinc/56/34/88/246563488.db2.gz HZWLMIPGKIZITR-FRRDWIJNSA-N 1 3 326.378 2.804 10 0 EFAEHO COc1cc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)N3C)cc2c1OCCO2 ZINC000266165182 248143629 /nfs/dbraw/zinc/14/36/29/248143629.db2.gz PCXCIJGORHDTSJ-MQVJKMGUSA-N 1 3 332.444 2.571 10 0 EFAEHO CC[NH+](CC)CCO[C@@H]1CCN(Cc2ccc(-c3cc[nH]n3)o2)C1 ZINC000435129264 248214119 /nfs/dbraw/zinc/21/41/19/248214119.db2.gz MIACDUKWCMAROF-OAHLLOKOSA-N 1 3 332.448 2.602 10 0 EFAEHO COCCOC[C@@H](C)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449175558 250941426 /nfs/dbraw/zinc/94/14/26/250941426.db2.gz OMXWOPAIHKNICU-MSOLQXFVSA-N 1 3 334.504 2.723 10 0 EFAEHO COC(=O)C1(CNC2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)CC1 ZINC000449258390 250971964 /nfs/dbraw/zinc/97/19/64/250971964.db2.gz PIIGULNQLUYQGW-INIZCTEOSA-N 1 3 330.472 2.625 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NCC(C)(C)[NH+]1CCCCC1 ZINC000097394943 219022057 /nfs/dbraw/zinc/02/20/57/219022057.db2.gz WTTNCGNMMNHWHN-MRXNPFEDSA-N 1 3 326.529 2.526 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)Cc1c(C)cc(OC)nc1C ZINC000349034005 285281690 /nfs/dbraw/zinc/28/16/90/285281690.db2.gz BRKDARRQJLLYNF-SFHVURJKSA-N 1 3 348.535 2.555 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)Cc1c(C)cc(OC)nc1C ZINC000349034005 285281691 /nfs/dbraw/zinc/28/16/91/285281691.db2.gz BRKDARRQJLLYNF-SFHVURJKSA-N 1 3 348.535 2.555 10 0 EFAEHO CC[NH+](CC)CCOc1ccc(NC(=O)N2CC[C@H](N(C)C)C2)cc1 ZINC000118546299 221155275 /nfs/dbraw/zinc/15/52/75/221155275.db2.gz GPWLQBGNIPBVJB-KRWDZBQOSA-N 1 3 348.491 2.575 10 0 EFAEHO C[C@@H](NCC1CC[NH+](C)CC1)c1ccc(-n2cncn2)cc1Cl ZINC000126311070 141366450 /nfs/dbraw/zinc/36/64/50/141366450.db2.gz VIRDCMILXYENIJ-CYBMUJFWSA-N 1 3 333.867 2.913 10 0 EFAEHO C[C@H](NCC1CC[NH+](C[C@@H](O)c2ccccc2)CC1)c1nccn1C ZINC000182862390 141377723 /nfs/dbraw/zinc/37/77/23/141377723.db2.gz RQJAMZHNEIZODH-QFBILLFUSA-N 1 3 342.487 2.516 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@]2(CO)C[C@H](C)CC(C)(C)C2)CC1 ZINC000337329249 141573437 /nfs/dbraw/zinc/57/34/37/141573437.db2.gz ZKYRPYUVKOKUFG-UYAOXDASSA-N 1 3 339.568 2.569 10 0 EFAEHO COCCN1CCC[C@@H]1C[NH2+][C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000348047516 142313647 /nfs/dbraw/zinc/31/36/47/142313647.db2.gz STISDUKCNDULBK-CEWLAPEOSA-N 1 3 345.531 2.597 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)N(C)[C@@H]2CCN(C3CC3)C2)c1 ZINC000349632891 142342192 /nfs/dbraw/zinc/34/21/92/142342192.db2.gz LLFWFSAEBQTAFB-LJQANCHMSA-N 1 3 344.503 2.516 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)N(C)[C@@H]2CCN(C3CC3)C2)c1 ZINC000349632891 142342193 /nfs/dbraw/zinc/34/21/93/142342193.db2.gz LLFWFSAEBQTAFB-LJQANCHMSA-N 1 3 344.503 2.516 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000349992882 142388342 /nfs/dbraw/zinc/38/83/42/142388342.db2.gz KPTYVXBRSCLLTD-ROUUACIJSA-N 1 3 336.524 2.519 10 0 EFAEHO CCCC[N@H+]1CCCC[C@H]1CNC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000349992882 142388343 /nfs/dbraw/zinc/38/83/43/142388343.db2.gz KPTYVXBRSCLLTD-ROUUACIJSA-N 1 3 336.524 2.519 10 0 EFAEHO CN(C(=O)NCCCCC[NH+]1CCCCC1)[C@@H]1CCN(C2CC2)C1 ZINC000350076869 142396937 /nfs/dbraw/zinc/39/69/37/142396937.db2.gz BBVBADKMZWPCJE-GOSISDBHSA-N 1 3 336.524 2.521 10 0 EFAEHO CCC[C@H](NCC(=O)NC1CC[NH+](C2CC2)CC1)c1ccccc1 ZINC000341037496 144977299 /nfs/dbraw/zinc/97/72/99/144977299.db2.gz MBDZKMYXPVCRGV-IBGZPJMESA-N 1 3 329.488 2.860 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000341308643 145030708 /nfs/dbraw/zinc/03/07/08/145030708.db2.gz AIEIWHLRPRCHFE-SCTDSRPQSA-N 1 3 346.519 2.679 10 0 EFAEHO CN(C)CCOc1cc(C[NH2+][C@@H]2CCC[C@@H]([C@H]3CCOC3)C2)ccn1 ZINC000341396231 145045301 /nfs/dbraw/zinc/04/53/01/145045301.db2.gz HBSFDONYYOQTAV-CEXWTWQISA-N 1 3 347.503 2.707 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H](CNC(=O)NCCN2[C@H](C)CCC[C@@H]2C)C1 ZINC000341433923 145051336 /nfs/dbraw/zinc/05/13/36/145051336.db2.gz QOCYQCZCGCEWSP-KSZLIROESA-N 1 3 338.540 2.669 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H](CNC(=O)NCCN2[C@H](C)CCC[C@@H]2C)C1 ZINC000341433923 145051338 /nfs/dbraw/zinc/05/13/38/145051338.db2.gz QOCYQCZCGCEWSP-KSZLIROESA-N 1 3 338.540 2.669 10 0 EFAEHO COc1cccc([C@H](C)N2CC[C@@H]([NH+]3CCN(C)CC3)[C@H](C)C2)c1 ZINC000343919582 145324777 /nfs/dbraw/zinc/32/47/77/145324777.db2.gz GJVBXZGKWOYLQI-FUHIMQAGSA-N 1 3 331.504 2.714 10 0 EFAEHO C[NH+](C)CC[C@H](NC(=O)CCN1CCc2ccccc2C1)C(C)(C)C ZINC000348908532 146022874 /nfs/dbraw/zinc/02/28/74/146022874.db2.gz GPIDXEXYOKDGBK-IBGZPJMESA-N 1 3 345.531 2.917 10 0 EFAEHO C[N@@H+]1CCCC[C@H]1CCC(=O)NCC1CCN(c2ccncc2)CC1 ZINC000355584782 147003993 /nfs/dbraw/zinc/00/39/93/147003993.db2.gz MXTGQYCXESETSP-SFHVURJKSA-N 1 3 344.503 2.679 10 0 EFAEHO C[N@H+]1CCCC[C@H]1CCC(=O)NCC1CCN(c2ccncc2)CC1 ZINC000355584782 147003996 /nfs/dbraw/zinc/00/39/96/147003996.db2.gz MXTGQYCXESETSP-SFHVURJKSA-N 1 3 344.503 2.679 10 0 EFAEHO CC[C@@H]1C[C@@H](CN2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)CCO1 ZINC000356998349 147395147 /nfs/dbraw/zinc/39/51/47/147395147.db2.gz UBWLVGBXAHKKFV-ZGXWSNOMSA-N 1 3 337.552 2.682 10 0 EFAEHO CC[C@@H]1C[C@@H](CN2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)CCO1 ZINC000356998349 147395149 /nfs/dbraw/zinc/39/51/49/147395149.db2.gz UBWLVGBXAHKKFV-ZGXWSNOMSA-N 1 3 337.552 2.682 10 0 EFAEHO CC[NH+](CC)CCO[C@@H]1CCN(Cc2c(C)cc(OC)nc2C)C1 ZINC000359222685 148027008 /nfs/dbraw/zinc/02/70/08/148027008.db2.gz IFBSRZJCKVHTJS-QGZVFWFLSA-N 1 3 335.492 2.640 10 0 EFAEHO CO[C@H]1CC[C@H]([NH2+]Cc2ccccc2N(C)C2CCN(C)CC2)C1 ZINC000190948116 286069303 /nfs/dbraw/zinc/06/93/03/286069303.db2.gz ICQBFJXUFIKNJP-HKUYNNGSSA-N 1 3 331.504 2.874 10 0 EFAEHO CN(C)CCOc1cc(C[NH2+][C@@H]2CCCC[C@H]2[C@H]2CCOC2)ccn1 ZINC000364390256 149140337 /nfs/dbraw/zinc/14/03/37/149140337.db2.gz WUUNSMLECMIAGK-GBESFXJTSA-N 1 3 347.503 2.707 10 0 EFAEHO O[C@H]1CCN(Cc2ccccc2C[NH2+]C2CC(c3ccccn3)C2)C1 ZINC000368031134 150014309 /nfs/dbraw/zinc/01/43/09/150014309.db2.gz RQMKLDGOHIPRSQ-MHJFOBGBSA-N 1 3 337.467 2.684 10 0 EFAEHO COc1cc(C)c(CN2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)c(C)n1 ZINC000261685537 286206243 /nfs/dbraw/zinc/20/62/43/286206243.db2.gz KJPFZDBTXASIBD-MJGOQNOKSA-N 1 3 325.456 2.881 10 0 EFAEHO COCC[C@H]1CCCC[N@H+](CCCN2CCN(C(C)C)CC2)C1 ZINC000374295560 151317001 /nfs/dbraw/zinc/31/70/01/151317001.db2.gz MMHUNMHOBLKGLZ-LJQANCHMSA-N 1 3 325.541 2.541 10 0 EFAEHO COCC[C@H]1CCCC[N@@H+](CCCN2CCN(C(C)C)CC2)C1 ZINC000374295560 151317003 /nfs/dbraw/zinc/31/70/03/151317003.db2.gz MMHUNMHOBLKGLZ-LJQANCHMSA-N 1 3 325.541 2.541 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C[C@H](O)COCc2ccc(Cl)cc2)CC[N@@H+]1C ZINC000123611722 222305991 /nfs/dbraw/zinc/30/59/91/222305991.db2.gz LVOVZJWJNHVRLS-JLSDUUJJSA-N 1 3 340.895 2.632 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C[C@H](O)COCc2ccc(Cl)cc2)CC[N@H+]1C ZINC000123611722 222305996 /nfs/dbraw/zinc/30/59/96/222305996.db2.gz LVOVZJWJNHVRLS-JLSDUUJJSA-N 1 3 340.895 2.632 10 0 EFAEHO CCCN(CCC[NH+](C)C)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000190061529 265208793 /nfs/dbraw/zinc/20/87/93/265208793.db2.gz NEHTZUZRRXIGOY-RBUKOAKNSA-N 1 3 346.519 2.805 10 0 EFAEHO COc1ccc([C@H](C)[NH2+]CCCN2CCN(C(C)C)CC2)cc1F ZINC000192785537 265308553 /nfs/dbraw/zinc/30/85/53/265308553.db2.gz NPPVZNRBNUOUNC-INIZCTEOSA-N 1 3 337.483 2.901 10 0 EFAEHO O[C@@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCOCC1 ZINC000272460955 266272951 /nfs/dbraw/zinc/27/29/51/266272951.db2.gz YKPQMNLBIGZGLR-WOZUAGRISA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCOCC1 ZINC000272460955 266272955 /nfs/dbraw/zinc/27/29/55/266272955.db2.gz YKPQMNLBIGZGLR-WOZUAGRISA-N 1 3 344.499 2.559 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC(C)(C)CN(C)Cc2ccccc2)CC[N@@H+]1C ZINC000279166768 273183962 /nfs/dbraw/zinc/18/39/62/273183962.db2.gz CISHYUUEWLKXDD-WMZOPIPTSA-N 1 3 331.504 2.744 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC(C)(C)CN(C)Cc2ccccc2)CC[N@H+]1C ZINC000279166768 273183964 /nfs/dbraw/zinc/18/39/64/273183964.db2.gz CISHYUUEWLKXDD-WMZOPIPTSA-N 1 3 331.504 2.744 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@@H](c2ccccc2)N2CCCC2)CC[N@@H+]1C ZINC000279256526 273193972 /nfs/dbraw/zinc/19/39/72/273193972.db2.gz UMIRASZHQMLQBU-WDSOQIARSA-N 1 3 329.488 2.670 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@@H](c2ccccc2)N2CCCC2)CC[N@H+]1C ZINC000279256526 273193973 /nfs/dbraw/zinc/19/39/73/273193973.db2.gz UMIRASZHQMLQBU-WDSOQIARSA-N 1 3 329.488 2.670 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2CCN(Cc3cccs3)CC2)CC[N@@H+]1C ZINC000279276580 273196737 /nfs/dbraw/zinc/19/67/37/273196737.db2.gz XATMERQWQQLGAS-RDJZCZTQSA-N 1 3 349.544 2.807 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2CCN(Cc3cccs3)CC2)CC[N@H+]1C ZINC000279276580 273196739 /nfs/dbraw/zinc/19/67/39/273196739.db2.gz XATMERQWQQLGAS-RDJZCZTQSA-N 1 3 349.544 2.807 10 0 EFAEHO CCN(C(=O)NC[C@@H]1CCC[NH2+]1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418379836 276062271 /nfs/dbraw/zinc/06/22/71/276062271.db2.gz WJNSROVSQNPBCZ-NZSAHSFTSA-N 1 3 344.503 2.605 10 0 EFAEHO CC(C)(C)OC(=O)N1CC[C@](C)(CN[C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000373850952 277193817 /nfs/dbraw/zinc/19/38/17/277193817.db2.gz OLTDJDQYPNAXTJ-FRQCXROJSA-N 1 3 337.508 2.850 10 0 EFAEHO CC(C)(C)OC(=O)N1CC[C@](C)(CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)C1 ZINC000373850952 277193819 /nfs/dbraw/zinc/19/38/19/277193819.db2.gz OLTDJDQYPNAXTJ-FRQCXROJSA-N 1 3 337.508 2.850 10 0 EFAEHO CC(C)(C)OC(=O)N1CC[C@](C)(C[NH2+][C@H]2CCN3CCC[C@@H]3C2)C1 ZINC000373850952 277193820 /nfs/dbraw/zinc/19/38/20/277193820.db2.gz OLTDJDQYPNAXTJ-FRQCXROJSA-N 1 3 337.508 2.850 10 0 EFAEHO COc1cccc([C@H](C)N2CC[C@@H]([NH+]3CCN(C)CC3)[C@@H](C)C2)c1 ZINC000343919581 278021188 /nfs/dbraw/zinc/02/11/88/278021188.db2.gz GJVBXZGKWOYLQI-ABSDTBQOSA-N 1 3 331.504 2.714 10 0 EFAEHO CCN(C(=O)NC1CC[NH2+]CC1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418313757 279001540 /nfs/dbraw/zinc/00/15/40/279001540.db2.gz WEYYNQBIYMZZCN-QFBILLFUSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1Nc1ccc(OC2CCN(C)CC2)nc1 ZINC000179744233 288102962 /nfs/dbraw/zinc/10/29/62/288102962.db2.gz VZQMNBGJBBBMLQ-RVKKMQEKSA-N 1 3 332.492 2.695 10 0 EFAEHO C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1Nc1ccc(OC2CCN(C)CC2)nc1 ZINC000179744233 288102966 /nfs/dbraw/zinc/10/29/66/288102966.db2.gz VZQMNBGJBBBMLQ-RVKKMQEKSA-N 1 3 332.492 2.695 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000156756127 279123682 /nfs/dbraw/zinc/12/36/82/279123682.db2.gz NWQJSVFVAOUOMQ-QZTJIDSGSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[NH+](CC)Cc1cccc(CNC(=O)N2CCN3CCC[C@H]3C2)c1 ZINC000171900515 279137777 /nfs/dbraw/zinc/13/77/77/279137777.db2.gz CDYLTXIHIRUVAA-IBGZPJMESA-N 1 3 344.503 2.518 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCCC12CC[NH+](C)CC2 ZINC000355038333 279185847 /nfs/dbraw/zinc/18/58/47/279185847.db2.gz LCVHKZZUMPDYMT-UHFFFAOYSA-N 1 3 325.460 2.636 10 0 EFAEHO CC[C@@H](NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1CCC[NH2+]1 ZINC000423080742 280183706 /nfs/dbraw/zinc/18/37/06/280183706.db2.gz AICDHNKCVWQBJJ-FJBKBRRZSA-N 1 3 333.442 2.912 10 0 EFAEHO CC1(C)CN(C(=O)NCc2ccccc2C[NH+]2CCCCC2)CCN1 ZINC000416900429 281175925 /nfs/dbraw/zinc/17/59/25/281175925.db2.gz IQWGRQYOHBDPCU-UHFFFAOYSA-N 1 3 344.503 2.566 10 0 EFAEHO CN(C)[C@@H](CC(=O)N1CCC[C@H]1C[NH+]1CCCC1)c1ccccc1 ZINC000416142072 289274583 /nfs/dbraw/zinc/27/45/83/289274583.db2.gz FNCZUFZMLFGMCY-OALUTQOASA-N 1 3 329.488 2.766 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1cccc(NC(=O)C2CCCC2)c1 ZINC000422718697 293096937 /nfs/dbraw/zinc/09/69/37/293096937.db2.gz XJIGIMWUZNKQRZ-SFHVURJKSA-N 1 3 333.476 2.659 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)NCCC1=CCCC1 ZINC000152255625 293325283 /nfs/dbraw/zinc/32/52/83/293325283.db2.gz CMGOBSKXYLMHSY-SFHVURJKSA-N 1 3 336.524 2.544 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)NCCC1=CCCC1 ZINC000152255625 293325286 /nfs/dbraw/zinc/32/52/86/293325286.db2.gz CMGOBSKXYLMHSY-SFHVURJKSA-N 1 3 336.524 2.544 10 0 EFAEHO Cc1ccc2c(c1)[C@H]([NH2+]CCCCN1CCN(C)CC1)CCCO2 ZINC000154389979 293423548 /nfs/dbraw/zinc/42/35/48/293423548.db2.gz WCTLNKOUTWFNQY-LJQANCHMSA-N 1 3 331.504 2.826 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)N[C@@H](CN(C)C)c2ccccc2)CC1 ZINC000157691266 293551680 /nfs/dbraw/zinc/55/16/80/293551680.db2.gz RVBADSWIIGPRQV-IBGZPJMESA-N 1 3 346.519 2.711 10 0 EFAEHO C[NH+](C)CCc1ccc(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC000290709805 294163707 /nfs/dbraw/zinc/16/37/07/294163707.db2.gz KEZSUIYDCZNQHJ-FQEVSTJZSA-N 1 3 349.494 2.619 10 0 EFAEHO Cc1cccc(CN(CCN(C)C)C(=O)CC2CC[NH+](C)CC2)c1 ZINC000291461206 294387868 /nfs/dbraw/zinc/38/78/68/294387868.db2.gz IDRVAEBNVZZUQX-UHFFFAOYSA-N 1 3 331.504 2.617 10 0 EFAEHO CN(C)C[C@H](NC(=O)CC1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000291618427 294431827 /nfs/dbraw/zinc/43/18/27/294431827.db2.gz KFRWWXLUOPXKOH-KRWDZBQOSA-N 1 3 337.895 2.791 10 0 EFAEHO C[N@@H+]1CCC[C@]2(CCN(C(=O)c3cccc(CN4CCCC4)c3)C2)C1 ZINC000294292375 295142217 /nfs/dbraw/zinc/14/22/17/295142217.db2.gz VKQDXVVECKFWBM-NRFANRHFSA-N 1 3 341.499 2.840 10 0 EFAEHO C[N@H+]1CCC[C@]2(CCN(C(=O)c3cccc(CN4CCCC4)c3)C2)C1 ZINC000294292375 295142219 /nfs/dbraw/zinc/14/22/19/295142219.db2.gz VKQDXVVECKFWBM-NRFANRHFSA-N 1 3 341.499 2.840 10 0 EFAEHO COc1ccc([C@H](NCCN2CCC[C@@H](C)C2)[C@@H]2CCC[NH2+]2)cc1 ZINC000422859704 295244812 /nfs/dbraw/zinc/24/48/12/295244812.db2.gz KTBCIKYJPHKSEA-UXPWSPDFSA-N 1 3 331.504 2.810 10 0 EFAEHO COc1ccc([C@H](NCCN2CCC(C)CC2)[C@@H]2CCC[NH2+]2)cc1 ZINC000422858437 295244899 /nfs/dbraw/zinc/24/48/99/295244899.db2.gz IQQBLGLPPNONRK-PMACEKPBSA-N 1 3 331.504 2.810 10 0 EFAEHO CC[C@H](N[C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@H](O)C(F)F ZINC000294970452 295252501 /nfs/dbraw/zinc/25/25/01/295252501.db2.gz FRNBEQATJMDVFP-SIXLDLHFSA-N 1 3 326.431 2.891 10 0 EFAEHO CC[C@H](N[C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H](O)C(F)F ZINC000294970452 295252502 /nfs/dbraw/zinc/25/25/02/295252502.db2.gz FRNBEQATJMDVFP-SIXLDLHFSA-N 1 3 326.431 2.891 10 0 EFAEHO COC(=O)c1cccc(OCCN2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000142822860 310673386 /nfs/dbraw/zinc/67/33/86/310673386.db2.gz XUESRQKEYOBFFU-UHFFFAOYSA-N 1 3 346.471 2.660 10 0 EFAEHO C[C@H](C[NH2+][C@H](C)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)CN(C)C ZINC000309699280 311228464 /nfs/dbraw/zinc/22/84/64/311228464.db2.gz FMYRVBDOMQSEHC-BZUAXINKSA-N 1 3 327.513 2.809 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)CC[N@@H+]1C ZINC000316874817 311235694 /nfs/dbraw/zinc/23/56/94/311235694.db2.gz WWGPNWALDHJHRI-FRRDWIJNSA-N 1 3 347.286 2.805 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)CC[N@H+]1C ZINC000316874817 311235696 /nfs/dbraw/zinc/23/56/96/311235696.db2.gz WWGPNWALDHJHRI-FRRDWIJNSA-N 1 3 347.286 2.805 10 0 EFAEHO CC(C)[C@@H]1C[C@@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCO1 ZINC000397576650 311960627 /nfs/dbraw/zinc/96/06/27/311960627.db2.gz CRJFHSDEXCNTSK-PMACEKPBSA-N 1 3 346.515 2.807 10 0 EFAEHO CCN(CC)CCC[NH2+][C@H](C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000400333351 311968682 /nfs/dbraw/zinc/96/86/82/311968682.db2.gz FJHFASRVOQUNJB-HZPDHXFCSA-N 1 3 327.513 2.953 10 0 EFAEHO C[C@@H]1CC[NH2+]C[C@H]1NC1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000414922344 312063452 /nfs/dbraw/zinc/06/34/52/312063452.db2.gz FZBHDRIOOLISBF-CXAGYDPISA-N 1 3 335.879 2.532 10 0 EFAEHO C[C@@H](N)[C@H](C)[NH2+]C1CCN(Cc2ccccc2Br)CC1 ZINC000415023327 312078909 /nfs/dbraw/zinc/07/89/09/312078909.db2.gz WTGYLMNPYGDSTM-OLZOCXBDSA-N 1 3 340.309 2.739 10 0 EFAEHO C[C@@H]([NH3+])[C@H](C)NC1CCN(Cc2ccccc2Br)CC1 ZINC000415023327 312078911 /nfs/dbraw/zinc/07/89/11/312078911.db2.gz WTGYLMNPYGDSTM-OLZOCXBDSA-N 1 3 340.309 2.739 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000415057047 312085124 /nfs/dbraw/zinc/08/51/24/312085124.db2.gz SZFLWACSCASSLW-APWZRJJASA-N 1 3 325.460 2.540 10 0 EFAEHO CC(C)C[C@H](N)C[NH2+]C1CCN(Cc2ccc(F)c(F)c2)CC1 ZINC000415112436 312096368 /nfs/dbraw/zinc/09/63/68/312096368.db2.gz RXVAMSOYHXGNKS-HNNXBMFYSA-N 1 3 325.447 2.892 10 0 EFAEHO CC(C)C[C@H]([NH3+])CNC1CCN(Cc2ccc(F)c(F)c2)CC1 ZINC000415112436 312096370 /nfs/dbraw/zinc/09/63/70/312096370.db2.gz RXVAMSOYHXGNKS-HNNXBMFYSA-N 1 3 325.447 2.892 10 0 EFAEHO CNCc1ccccc1NC(=O)N[C@@H]1CC[N@H+](CC2CCCC2)C1 ZINC000415909066 312180540 /nfs/dbraw/zinc/18/05/40/312180540.db2.gz FMDBMNNAMBQWKE-QGZVFWFLSA-N 1 3 330.476 2.792 10 0 EFAEHO CNCc1ccccc1NC(=O)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000415909066 312180541 /nfs/dbraw/zinc/18/05/41/312180541.db2.gz FMDBMNNAMBQWKE-QGZVFWFLSA-N 1 3 330.476 2.792 10 0 EFAEHO CN(C(=O)Nc1ccc2c(c1F)CCNC2)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000415964190 312186309 /nfs/dbraw/zinc/18/63/09/312186309.db2.gz XBRFEHAQADMRLV-YIONKMFJSA-N 1 3 346.450 2.560 10 0 EFAEHO CN(C(=O)Nc1ccc2c(c1F)CCNC2)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000415964190 312186310 /nfs/dbraw/zinc/18/63/10/312186310.db2.gz XBRFEHAQADMRLV-YIONKMFJSA-N 1 3 346.450 2.560 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)NC[C@H]([NH3+])c2ccccc2)N(C)C)cc1 ZINC000417313098 312207660 /nfs/dbraw/zinc/20/76/60/312207660.db2.gz OSAUSWHJSHYNEU-OALUTQOASA-N 1 3 340.471 2.597 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N(C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)N(C)C)cc1 ZINC000417318908 312208473 /nfs/dbraw/zinc/20/84/73/312208473.db2.gz ZSAMJTBJGZFCRB-SWDXFRIISA-N 1 3 344.503 2.522 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)NC[C@H](N)c1ccccc1 ZINC000417556758 312239556 /nfs/dbraw/zinc/23/95/56/312239556.db2.gz PXLSWLOIVSAUCL-ROUUACIJSA-N 1 3 332.492 2.640 10 0 EFAEHO CCCC[N@H+]1CCCC[C@H]1CNC(=O)NC[C@H](N)c1ccccc1 ZINC000417556758 312239558 /nfs/dbraw/zinc/23/95/58/312239558.db2.gz PXLSWLOIVSAUCL-ROUUACIJSA-N 1 3 332.492 2.640 10 0 EFAEHO CC1(C)CCC[NH2+][C@@H]1C(=O)N[C@H](CN)c1ccc2ccccc2c1 ZINC000417826929 312276850 /nfs/dbraw/zinc/27/68/50/312276850.db2.gz NIJGZNMVAVBLFV-QZTJIDSGSA-N 1 3 325.456 2.734 10 0 EFAEHO CC1(C)CCC[NH2+][C@@H]1C(=O)N[C@@H](CN)c1ccc2ccccc2c1 ZINC000417826931 312276913 /nfs/dbraw/zinc/27/69/13/312276913.db2.gz NIJGZNMVAVBLFV-ZWKOTPCHSA-N 1 3 325.456 2.734 10 0 EFAEHO C[C@@]1(CNC(=O)NC2CCC([NH3+])CC2)CCCN1Cc1ccccc1 ZINC000418039991 312314769 /nfs/dbraw/zinc/31/47/69/312314769.db2.gz IBDPUCVZKAJLID-QLOJAFMTSA-N 1 3 344.503 2.610 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)N1CCCC[C@H]1[C@H](C)[NH3+])c1ccco1 ZINC000418163796 312337718 /nfs/dbraw/zinc/33/77/18/312337718.db2.gz HUDHMSWJAWMFEK-JONQDZQNSA-N 1 3 336.480 2.620 10 0 EFAEHO CC(C)Cc1ccc([C@H](CNC(=O)N2CC[C@H]([NH3+])[C@@H]2C)N(C)C)cc1 ZINC000418191711 312344032 /nfs/dbraw/zinc/34/40/32/312344032.db2.gz LEPVYPZEQUHEPD-SNRMKQJTSA-N 1 3 346.519 2.619 10 0 EFAEHO CN1CC[C@H](NC(=O)NC2CCC([NH+](C)C)CC2)[C@@H]1c1ccccc1 ZINC000420823337 312397499 /nfs/dbraw/zinc/39/74/99/312397499.db2.gz VEYRUCNHOIEJEB-BTRQGYIVSA-N 1 3 344.503 2.604 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@@H](c1cncc(Br)c1)C1CC1 ZINC000423109650 312411895 /nfs/dbraw/zinc/41/18/95/312411895.db2.gz STZRZALXSZZMMG-HUUCEWRRSA-N 1 3 342.281 2.639 10 0 EFAEHO C[NH+](C)CCOCCN[C@@H]1CCc2c1ccc(F)c2Br ZINC000453214885 312880557 /nfs/dbraw/zinc/88/05/57/312880557.db2.gz IMTMRLNJMWDRLX-CQSZACIVSA-N 1 3 345.256 2.743 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)NC3(C4CCC4)CCC3)CC2)CC1 ZINC000458136851 313077342 /nfs/dbraw/zinc/07/73/42/313077342.db2.gz VGTZKSQYEYKNAI-UHFFFAOYSA-N 1 3 348.535 2.567 10 0 EFAEHO O=c1ccccn1Cc1ccc(CNC2CC[NH+](C3CC3)CC2)cc1 ZINC000459465105 313108250 /nfs/dbraw/zinc/10/82/50/313108250.db2.gz ITEDQRZXKZLLRC-UHFFFAOYSA-N 1 3 337.467 2.613 10 0 EFAEHO O[C@H](CN1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)C1CCCCC1 ZINC000471024651 313138801 /nfs/dbraw/zinc/13/88/01/313138801.db2.gz CBPNOUYNPUCJKU-QHAWAJNXSA-N 1 3 328.500 2.991 10 0 EFAEHO O[C@H](CN1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)C1CCCCC1 ZINC000471024651 313138802 /nfs/dbraw/zinc/13/88/02/313138802.db2.gz CBPNOUYNPUCJKU-QHAWAJNXSA-N 1 3 328.500 2.991 10 0 EFAEHO CCc1cccc(F)c1C[N@@H+]1CC[C@@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000474263488 313206741 /nfs/dbraw/zinc/20/67/41/313206741.db2.gz CSGBYVTWBDYXJE-OXJNMPFZSA-N 1 3 333.495 2.846 10 0 EFAEHO CCc1cccc(F)c1C[N@H+]1CC[C@@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000474263488 313206746 /nfs/dbraw/zinc/20/67/46/313206746.db2.gz CSGBYVTWBDYXJE-OXJNMPFZSA-N 1 3 333.495 2.846 10 0 EFAEHO C[C@@H]1C[C@H](C)[C@H](C)[N@H+](CC(=O)NC[C@@H](c2ccccc2)N(C)C)C1 ZINC000475740576 313226188 /nfs/dbraw/zinc/22/61/88/313226188.db2.gz CITAOJFKMZPEKV-DFEOGRTESA-N 1 3 331.504 2.772 10 0 EFAEHO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](CC(=O)NC[C@@H](c2ccccc2)N(C)C)C1 ZINC000475740576 313226191 /nfs/dbraw/zinc/22/61/91/313226191.db2.gz CITAOJFKMZPEKV-DFEOGRTESA-N 1 3 331.504 2.772 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2CCC[C@H]2CCO)CC1 ZINC000495168263 314676194 /nfs/dbraw/zinc/67/61/94/314676194.db2.gz ATXJDMMCRPJXNV-ICSRJNTNSA-N 1 3 345.531 2.859 10 0 EFAEHO CCCN1CC[C@H](C[NH2+][C@H](C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1 ZINC000496297961 315017606 /nfs/dbraw/zinc/01/76/06/315017606.db2.gz YDBCTEVGSWYVRO-ZACQAIPSSA-N 1 3 339.524 2.953 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)CNC1CC[NH+](C2CC2)CC1 ZINC000521426424 316022293 /nfs/dbraw/zinc/02/22/93/316022293.db2.gz ADYKBIMSZIMXFK-GOSISDBHSA-N 1 3 332.488 2.766 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)[NH+]1CCCC1 ZINC000524188936 316149509 /nfs/dbraw/zinc/14/95/09/316149509.db2.gz OERJUPQWNCHNSQ-SJLPKXTDSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(C(=O)NCCN(C)C)cc1)C1CC(F)(F)C1 ZINC000529538550 316910967 /nfs/dbraw/zinc/91/09/67/316910967.db2.gz DPIICQFOZCQBBC-ZDUSSCGKSA-N 1 3 339.430 2.501 10 0 EFAEHO Clc1ccc2c(c1)C[C@@H]1[C@H](N[C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)[C@H]21 ZINC000530208676 317080277 /nfs/dbraw/zinc/08/02/77/317080277.db2.gz GPQKBYCSUYKNCH-BVPSZOQCSA-N 1 3 332.875 2.725 10 0 EFAEHO Cc1cccc(C)c1OCCN1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530238675 317088804 /nfs/dbraw/zinc/08/88/04/317088804.db2.gz AKYODCRNUBKRHQ-LJQANCHMSA-N 1 3 332.488 2.773 10 0 EFAEHO Clc1cccc(OCCN2CCC(CO[C@H]3CC[NH2+]C3)CC2)c1 ZINC000530238276 317088813 /nfs/dbraw/zinc/08/88/13/317088813.db2.gz MDHNMVRCSWSOMK-SFHVURJKSA-N 1 3 338.879 2.809 10 0 EFAEHO CCCn1nc(C)c(CN2CCC(CO[C@H]3CC[NH2+]C3)CC2)c1C ZINC000530247882 317090673 /nfs/dbraw/zinc/09/06/73/317090673.db2.gz CIWRNVNSSPWECO-SFHVURJKSA-N 1 3 334.508 2.500 10 0 EFAEHO CCOc1ccc(CN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)cc1OC ZINC000530249098 317090974 /nfs/dbraw/zinc/09/09/74/317090974.db2.gz UFUGFRXRGSBVKU-GOSISDBHSA-N 1 3 348.487 2.684 10 0 EFAEHO C[C@@H]([NH2+]CCCCN1CCN(C)CC1)c1cnn(C2CCCC2)c1 ZINC000548861101 318151233 /nfs/dbraw/zinc/15/12/33/318151233.db2.gz GQGWRDXFHYVVAU-QGZVFWFLSA-N 1 3 333.524 2.676 10 0 EFAEHO C[C@H]1[C@H](c2ccccc2)C[C@@H]1NCC(=O)NCC[NH+]1CCCCCC1 ZINC000552064780 318240907 /nfs/dbraw/zinc/24/09/07/318240907.db2.gz OGROKZIUBZCLNJ-SXLOBPIMSA-N 1 3 343.515 2.760 10 0 EFAEHO C[C@@H]([NH2+]CC(=O)NC1CCN(C2CC2)CC1)C(C)(C)c1ccccc1 ZINC000553284922 318278109 /nfs/dbraw/zinc/27/81/09/318278109.db2.gz KHRKOZXCIKNDOW-MRXNPFEDSA-N 1 3 343.515 2.685 10 0 EFAEHO CN(C)[C@@H](CNC(=O)CC[C@H]1CCCC[N@@H+]1C)Cc1ccccc1 ZINC000554224643 318304298 /nfs/dbraw/zinc/30/42/98/318304298.db2.gz PYUUTCFSYFEOCH-RTBURBONSA-N 1 3 331.504 2.540 10 0 EFAEHO CN(C)[C@@H](CNC(=O)CC[C@H]1CCCC[N@H+]1C)Cc1ccccc1 ZINC000554224643 318304300 /nfs/dbraw/zinc/30/43/00/318304300.db2.gz PYUUTCFSYFEOCH-RTBURBONSA-N 1 3 331.504 2.540 10 0 EFAEHO CC(C)c1ccc([C@@H](N)CNC(=O)N2CC[C@]3(C2)CCC[NH2+]C3)cc1 ZINC000557219659 318432477 /nfs/dbraw/zinc/43/24/77/318432477.db2.gz VNGSXIAUTRMYGS-AZUAARDMSA-N 1 3 344.503 2.595 10 0 EFAEHO [NH3+]C[C@H]1c2ccccc2CCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000565718031 318996269 /nfs/dbraw/zinc/99/62/69/318996269.db2.gz DWWJVOIDHBMDJB-NRFANRHFSA-N 1 3 349.478 2.981 10 0 EFAEHO CC(C)(C)[NH+]1CCC(NC(=O)N2CCc3ccccc3[C@@H]2CN)CC1 ZINC000566736758 319106291 /nfs/dbraw/zinc/10/62/91/319106291.db2.gz LVQPHPTWZIDVLK-SFHVURJKSA-N 1 3 344.503 2.517 10 0 EFAEHO CNC(=O)[C@@H](N[C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000566795975 319111523 /nfs/dbraw/zinc/11/15/23/319111523.db2.gz CEFSUMACQWMCJK-ROUUACIJSA-N 1 3 329.488 2.544 10 0 EFAEHO CNC(=O)[C@@H](N[C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000566795975 319111525 /nfs/dbraw/zinc/11/15/25/319111525.db2.gz CEFSUMACQWMCJK-ROUUACIJSA-N 1 3 329.488 2.544 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](NCCc2ncc(C)cc2C)[C@@H](C)C1 ZINC000566971326 319127089 /nfs/dbraw/zinc/12/70/89/319127089.db2.gz JAKHQAUJNBFCCJ-AZUAARDMSA-N 1 3 333.520 2.968 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](NCCc2ncc(C)cc2C)[C@@H](C)C1 ZINC000566971326 319127092 /nfs/dbraw/zinc/12/70/92/319127092.db2.gz JAKHQAUJNBFCCJ-AZUAARDMSA-N 1 3 333.520 2.968 10 0 EFAEHO CCN(C(=O)[C@H](C)[NH2+]C1CC1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000567046572 319133603 /nfs/dbraw/zinc/13/36/03/319133603.db2.gz HXYTYXWURFWRCV-TXPKVOOTSA-N 1 3 329.488 2.811 10 0 EFAEHO C[C@H](N[C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cc[nH]c(=O)c1 ZINC000569229397 319360918 /nfs/dbraw/zinc/36/09/18/319360918.db2.gz BVQLFDBPGJNIRG-CRFBAAHOSA-N 1 3 325.412 2.694 10 0 EFAEHO O[C@@H](C[NH2+]Cc1ccc(CN2CCC(O)CC2)cc1)CC1CCCC1 ZINC000569352476 319372872 /nfs/dbraw/zinc/37/28/72/319372872.db2.gz PLRGTVYXWXSMPS-OAQYLSRUSA-N 1 3 346.515 2.674 10 0 EFAEHO [NH3+]C[C@H]1CCCN(C(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000576687230 320039155 /nfs/dbraw/zinc/03/91/55/320039155.db2.gz GAUFACYLOFTABH-QGZVFWFLSA-N 1 3 344.503 2.553 10 0 EFAEHO C[C@@H](O)[C@@H](NC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1F ZINC000576759691 320046377 /nfs/dbraw/zinc/04/63/77/320046377.db2.gz BUMARBXRKOAKKC-AUUYWEPGSA-N 1 3 329.419 2.901 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[NH2+]C[C@H]1CCN(C2CC2)C1 ZINC000577485336 320115478 /nfs/dbraw/zinc/11/54/78/320115478.db2.gz SCVLNRVHQINMIB-SJLPKXTDSA-N 1 3 332.488 2.624 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)CNC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000577485336 320115481 /nfs/dbraw/zinc/11/54/81/320115481.db2.gz SCVLNRVHQINMIB-SJLPKXTDSA-N 1 3 332.488 2.624 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)CNC[C@H]1CC[N@H+](C2CC2)C1 ZINC000577485336 320115484 /nfs/dbraw/zinc/11/54/84/320115484.db2.gz SCVLNRVHQINMIB-SJLPKXTDSA-N 1 3 332.488 2.624 10 0 EFAEHO [NH3+]C[C@H]1CC[C@@H](NC(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000577604631 320126598 /nfs/dbraw/zinc/12/65/98/320126598.db2.gz OYNGGHMNBGLKDV-QFBILLFUSA-N 1 3 344.503 2.599 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccnc(OCCN(C)C)c1)Cc1ccccc1 ZINC000182077150 323263756 /nfs/dbraw/zinc/26/37/56/323263756.db2.gz DYXFMXISQLOIRV-QGZVFWFLSA-N 1 3 327.472 2.990 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N(C)CCC[NH+](C)C)N2CCCC2)cc1 ZINC000185804379 323398539 /nfs/dbraw/zinc/39/85/39/323398539.db2.gz IAVJXKLBHYRXGC-IBGZPJMESA-N 1 3 346.519 2.725 10 0 EFAEHO COCCN(C)CCC[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000580714396 324219106 /nfs/dbraw/zinc/21/91/06/324219106.db2.gz ZQMPNHDGBPJYLY-HXUWFJFHSA-N 1 3 345.531 2.742 10 0 EFAEHO [NH3+][C@H](CCC(=O)Nc1ccc2c(c1F)CCNC2)c1ccccc1 ZINC000581001669 324285130 /nfs/dbraw/zinc/28/51/30/324285130.db2.gz TZJXHXLAAGZJHP-MRXNPFEDSA-N 1 3 327.403 2.890 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000581463375 324382127 /nfs/dbraw/zinc/38/21/27/324382127.db2.gz WWLAQWUWSCNXBM-UHFFFAOYSA-N 1 3 349.441 2.640 10 0 EFAEHO NC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 ZINC000582481531 324603158 /nfs/dbraw/zinc/60/31/58/324603158.db2.gz QYMYAMKJMFSHDU-JDFRZJQESA-N 1 3 346.425 2.860 10 0 EFAEHO CC[NH+](CC)[C@@H](C)CNC(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000111816737 473229053 /nfs/dbraw/zinc/22/90/53/473229053.db2.gz YEGULEHGXNRTRA-IRXDYDNUSA-N 1 3 334.508 2.536 10 0 EFAEHO C[C@H](Cc1ccccc1)C(=O)NC1CCN(C2CC[NH+](C)CC2)CC1 ZINC000112044940 473240380 /nfs/dbraw/zinc/24/03/80/473240380.db2.gz DQXSIICOGXDIBW-QGZVFWFLSA-N 1 3 343.515 2.540 10 0 EFAEHO CC(C)[C@](C)(O)C[N@H+](C)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000185002833 473298078 /nfs/dbraw/zinc/29/80/78/473298078.db2.gz NEOJQUXFCHLJPX-LEWJYISDSA-N 1 3 348.531 2.771 10 0 EFAEHO CC(C)[C@](C)(O)C[N@@H+](C)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000185002833 473298083 /nfs/dbraw/zinc/29/80/83/473298083.db2.gz NEOJQUXFCHLJPX-LEWJYISDSA-N 1 3 348.531 2.771 10 0 EFAEHO CN(CCN(C)C1CC1)C(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000185087926 473324864 /nfs/dbraw/zinc/32/48/64/473324864.db2.gz WSZHAAZKACLJPC-UHFFFAOYSA-N 1 3 344.503 2.518 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@@H](NC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000177468054 473383947 /nfs/dbraw/zinc/38/39/47/473383947.db2.gz BFNKGIGREKEIOY-MOPGFXCFSA-N 1 3 329.488 2.885 10 0 EFAEHO CN(c1ccccc1C[NH2+]C[C@@H]1CCCC[C@@H]1O)C1CCN(C)CC1 ZINC000150978945 473391209 /nfs/dbraw/zinc/39/12/09/473391209.db2.gz SRHOJJIENAJGQB-RXVVDRJESA-N 1 3 345.531 2.858 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2C[C@@H]3CCC[C@]3([NH3+])C2)CC1 ZINC000622004346 479879037 /nfs/dbraw/zinc/87/90/37/479879037.db2.gz NPVZIOFOLRBNGH-FPOVZHCZSA-N 1 3 342.531 2.532 10 0 EFAEHO N[C@@H]1CCC[C@@H]1[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccncc1 ZINC000422833889 476801167 /nfs/dbraw/zinc/80/11/67/476801167.db2.gz HDNADZDETUKFIA-MOPGFXCFSA-N 1 3 333.439 2.904 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)[C@H](C)[NH3+] ZINC000399354735 476881460 /nfs/dbraw/zinc/88/14/60/476881460.db2.gz FJQBDUAPJXWVHN-WDSOQIARSA-N 1 3 331.504 2.729 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cc(C(F)F)ccc1F ZINC000622137590 479922242 /nfs/dbraw/zinc/92/22/42/479922242.db2.gz JGGOERHLUKDXSE-LBPRGKRZSA-N 1 3 345.409 2.765 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cc(C(F)F)ccc1F ZINC000622137590 479922249 /nfs/dbraw/zinc/92/22/49/479922249.db2.gz JGGOERHLUKDXSE-LBPRGKRZSA-N 1 3 345.409 2.765 10 0 EFAEHO CCCC[NH+]1CCC(NC(=O)c2ccccc2OCCN(C)C)CC1 ZINC000068442414 472192767 /nfs/dbraw/zinc/19/27/67/472192767.db2.gz DHXCVRFYBBWSER-UHFFFAOYSA-N 1 3 347.503 2.621 10 0 EFAEHO CCN(Cc1ccccc1)C(=O)CN1CCC(CC[NH+](C)C)CC1 ZINC000056522655 472332550 /nfs/dbraw/zinc/33/25/50/472332550.db2.gz WOCSOPJHBNTWFO-UHFFFAOYSA-N 1 3 331.504 2.699 10 0 EFAEHO C[C@@H](CNC(=O)N[C@@H](CN(C)C)c1ccccc1)C[NH+]1CCCCC1 ZINC000057042577 472377545 /nfs/dbraw/zinc/37/75/45/472377545.db2.gz ZOXPOYDDZKBFPY-HKUYNNGSSA-N 1 3 346.519 2.711 10 0 EFAEHO CC(C)[NH+](CCNC(=O)N[C@@H](Cc1ccccc1)CN(C)C)C(C)C ZINC000057205576 472395230 /nfs/dbraw/zinc/39/52/30/472395230.db2.gz KLJKUJRAAQQQSN-IBGZPJMESA-N 1 3 348.535 2.577 10 0 EFAEHO Cc1cc(CN(C)CC2CC[NH+](C[C@H](O)c3ccccc3)CC2)on1 ZINC000069706244 472405102 /nfs/dbraw/zinc/40/51/02/472405102.db2.gz DOGOJNDMTOTPGE-FQEVSTJZSA-N 1 3 343.471 2.860 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@](C)(O)C2)CC1 ZINC000129484291 472546893 /nfs/dbraw/zinc/54/68/93/472546893.db2.gz YRXRMWKTFIGGDO-FQEVSTJZSA-N 1 3 331.504 2.565 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@](C)(O)C2)CC1 ZINC000129484291 472546898 /nfs/dbraw/zinc/54/68/98/472546898.db2.gz YRXRMWKTFIGGDO-FQEVSTJZSA-N 1 3 331.504 2.565 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NC[C@@H](C)N2CCC(C)CC2)CC1 ZINC000102005919 472561992 /nfs/dbraw/zinc/56/19/92/472561992.db2.gz BYSIOHOQLHNFOE-QGZVFWFLSA-N 1 3 338.540 2.528 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000061944819 472724868 /nfs/dbraw/zinc/72/48/68/472724868.db2.gz ABVJBQNAAJXKSG-IEBWSBKVSA-N 1 3 346.519 2.681 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000105148811 472728067 /nfs/dbraw/zinc/72/80/67/472728067.db2.gz KHMZDFLJMHJZLR-ZWKOTPCHSA-N 1 3 338.540 2.623 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)NCCN2CCCC[C@H]2C)CC1 ZINC000072956243 472746475 /nfs/dbraw/zinc/74/64/75/472746475.db2.gz GEFDPPQMZSBTKC-QGZVFWFLSA-N 1 3 344.503 2.597 10 0 EFAEHO Cc1ccccc1OC[C@@H](O)CN1CCC(C[NH+]2CCCC2)CC1 ZINC000047972295 472790175 /nfs/dbraw/zinc/79/01/75/472790175.db2.gz GNYAZZXIRDZODC-IBGZPJMESA-N 1 3 332.488 2.543 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N1CC[C@H](N(C)Cc2ccccc2)C1 ZINC000073654273 472847554 /nfs/dbraw/zinc/84/75/54/472847554.db2.gz FOKYVNAEOSLJAY-MJGOQNOKSA-N 1 3 346.519 2.633 10 0 EFAEHO O=C(CN(CC1CCCCC1)C1CC1)NC1CC[NH+](C2CC2)CC1 ZINC000064508797 472860335 /nfs/dbraw/zinc/86/03/35/472860335.db2.gz AQRNAAPHJYQGKE-UHFFFAOYSA-N 1 3 333.520 2.774 10 0 EFAEHO CN1CCC[C@H](CNC(=O)C2CC[NH+](C)CC2)[C@H]1c1cccs1 ZINC000073959224 472911000 /nfs/dbraw/zinc/91/10/00/472911000.db2.gz YSKAJASMALQHDQ-WBVHZDCISA-N 1 3 335.517 2.589 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)Nc1ccc(OCCC[NH+](C)C)cc1 ZINC000107280171 472939340 /nfs/dbraw/zinc/93/93/40/472939340.db2.gz FRXRXVKLAAJHQX-SFHVURJKSA-N 1 3 333.476 2.830 10 0 EFAEHO CCCC[NH+]1CCC(NC(=O)N[C@@H](CC(C)C)CN(C)C)CC1 ZINC000158680248 472958311 /nfs/dbraw/zinc/95/83/11/472958311.db2.gz IVAKVYSISDYTQU-KRWDZBQOSA-N 1 3 326.529 2.526 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCc2ccc(C[NH+](CC)CC)cc2)C1 ZINC000052519245 473117098 /nfs/dbraw/zinc/11/70/98/473117098.db2.gz UARMKUXFAXGMBJ-IBGZPJMESA-N 1 3 346.519 2.812 10 0 EFAEHO COCC[N@H+](C)CCCC1CC[NH+](Cc2nc(C)ccc2[O-])CC1 ZINC000093769401 473142072 /nfs/dbraw/zinc/14/20/72/473142072.db2.gz SAGCKIWVZOAQKM-UHFFFAOYSA-N 1 3 335.492 2.666 10 0 EFAEHO COCC[N@@H+](C)CCCC1CC[NH+](Cc2nc(C)ccc2[O-])CC1 ZINC000093769401 473142076 /nfs/dbraw/zinc/14/20/76/473142076.db2.gz SAGCKIWVZOAQKM-UHFFFAOYSA-N 1 3 335.492 2.666 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@]3(CCOC3)C2)CC1 ZINC000093820309 473150937 /nfs/dbraw/zinc/15/09/37/473150937.db2.gz QGZHSBXQTGPBQC-NRFANRHFSA-N 1 3 343.515 2.831 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@]3(CCOC3)C2)CC1 ZINC000093820309 473150943 /nfs/dbraw/zinc/15/09/43/473150943.db2.gz QGZHSBXQTGPBQC-NRFANRHFSA-N 1 3 343.515 2.831 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC(C)(C)N(C)C)CC1 ZINC000151311851 473441092 /nfs/dbraw/zinc/44/10/92/473441092.db2.gz IRWZFSUICKYERM-UHFFFAOYSA-N 1 3 332.536 2.648 10 0 EFAEHO Cn1cc(N2CCC[C@H](NC3CC[NH+](C4CCCCC4)CC3)C2)cn1 ZINC000166458196 473526634 /nfs/dbraw/zinc/52/66/34/473526634.db2.gz RPDDFFLUOFJVOP-SFHVURJKSA-N 1 3 345.535 2.776 10 0 EFAEHO Cn1cc(N2CCC[C@H]([NH2+]C3CCN(C4CCCCC4)CC3)C2)cn1 ZINC000166458196 473526641 /nfs/dbraw/zinc/52/66/41/473526641.db2.gz RPDDFFLUOFJVOP-SFHVURJKSA-N 1 3 345.535 2.776 10 0 EFAEHO C[C@H]1C[C@H](c2ccccc2)CN1CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000115553435 473580218 /nfs/dbraw/zinc/58/02/18/473580218.db2.gz JZBAPQGKYQZAMD-WMZOPIPTSA-N 1 3 341.499 2.607 10 0 EFAEHO C[C@@H]1CC[N@H+](CC(=O)NC2CCN(C3CC3)CC2)[C@@H]2CCCC[C@H]12 ZINC000620278089 480051840 /nfs/dbraw/zinc/05/18/40/480051840.db2.gz BEJXZWMXJPATNA-ATZDWAIDSA-N 1 3 333.520 2.630 10 0 EFAEHO C[C@@H]1CC[N@@H+](CC(=O)NC2CCN(C3CC3)CC2)[C@@H]2CCCC[C@H]12 ZINC000620278089 480051847 /nfs/dbraw/zinc/05/18/47/480051847.db2.gz BEJXZWMXJPATNA-ATZDWAIDSA-N 1 3 333.520 2.630 10 0 EFAEHO CC(C)C[C@H](C[NH+](C)C)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000179190186 473650098 /nfs/dbraw/zinc/65/00/98/473650098.db2.gz ZYJCHSAYEGGPRL-GUDVDZBRSA-N 1 3 346.519 2.707 10 0 EFAEHO CC(C)[NH+](CCNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)C(C)C ZINC000179270746 473667487 /nfs/dbraw/zinc/66/74/87/473667487.db2.gz BNIPALYSHWMSHB-RTBURBONSA-N 1 3 346.519 2.850 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2[NH2+]1)N(C)Cc1ccccc1 ZINC000262681493 473711069 /nfs/dbraw/zinc/71/10/69/473711069.db2.gz XOECPJOQVJPJOR-YSHGAJCASA-N 1 3 329.488 2.544 10 0 EFAEHO CN(C)CCOc1cccc(C[NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)c1 ZINC000245848597 473752894 /nfs/dbraw/zinc/75/28/94/473752894.db2.gz FZJHOBNOYAQQMY-GUDVDZBRSA-N 1 3 332.488 2.920 10 0 EFAEHO CS[C@H](CO)[C@H](C)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180146082 473810225 /nfs/dbraw/zinc/81/02/25/473810225.db2.gz CVJRKOLTCYALQC-BYUNMRKYSA-N 1 3 334.529 2.884 10 0 EFAEHO CS[C@H](CO)[C@H](C)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180146082 473810232 /nfs/dbraw/zinc/81/02/32/473810232.db2.gz CVJRKOLTCYALQC-BYUNMRKYSA-N 1 3 334.529 2.884 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NC1CC[NH+](C(C)(C)C)CC1 ZINC000193836279 473813968 /nfs/dbraw/zinc/81/39/68/473813968.db2.gz KWMLJTOSSGAXOU-MRXNPFEDSA-N 1 3 326.529 2.525 10 0 EFAEHO CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCC(C)(C)N1CCCCC1 ZINC000173395423 473824583 /nfs/dbraw/zinc/82/45/83/473824583.db2.gz MNHWWXRBWSYUQF-DLBZAZTESA-N 1 3 336.524 2.519 10 0 EFAEHO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCC(C)(C)N1CCCCC1 ZINC000173395423 473824589 /nfs/dbraw/zinc/82/45/89/473824589.db2.gz MNHWWXRBWSYUQF-DLBZAZTESA-N 1 3 336.524 2.519 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@H]1C[NH+]1CCCC1 ZINC000263774617 473843160 /nfs/dbraw/zinc/84/31/60/473843160.db2.gz FXGJPOUWRKGPLX-FQEVSTJZSA-N 1 3 341.499 2.983 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)C1 ZINC000246402704 473853046 /nfs/dbraw/zinc/85/30/46/473853046.db2.gz RQVXZHXOGXHYLY-FGTMMUONSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)C1 ZINC000246402704 473853056 /nfs/dbraw/zinc/85/30/56/473853056.db2.gz RQVXZHXOGXHYLY-FGTMMUONSA-N 1 3 338.540 2.623 10 0 EFAEHO CN1CCO[C@@H]([C@H](NCCCC[NH+](C)C)c2ccc(Cl)cc2)C1 ZINC000274553099 473873053 /nfs/dbraw/zinc/87/30/53/473873053.db2.gz DXDNEMQAKJEVOR-QZTJIDSGSA-N 1 3 339.911 2.643 10 0 EFAEHO CN1CCO[C@@H]([C@@H](NCCCC[NH+](C)C)c2ccc(Cl)cc2)C1 ZINC000274553095 473873822 /nfs/dbraw/zinc/87/38/22/473873822.db2.gz DXDNEMQAKJEVOR-MSOLQXFVSA-N 1 3 339.911 2.643 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@@H](O)COCc2ccc(Cl)cc2)CC[N@@H+]1C ZINC000246725441 473943107 /nfs/dbraw/zinc/94/31/07/473943107.db2.gz LVOVZJWJNHVRLS-ZTFGCOKTSA-N 1 3 340.895 2.632 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@@H](O)COCc2ccc(Cl)cc2)CC[N@H+]1C ZINC000246725441 473943111 /nfs/dbraw/zinc/94/31/11/473943111.db2.gz LVOVZJWJNHVRLS-ZTFGCOKTSA-N 1 3 340.895 2.632 10 0 EFAEHO CC1CC[NH+](CCCCNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)CC1 ZINC000173888042 473950830 /nfs/dbraw/zinc/95/08/30/473950830.db2.gz SYEDXLOKASXTQZ-MSOLQXFVSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@H](CNC(=O)N[C@H](CN(C)C)c2ccccc2)C1 ZINC000246793353 473964660 /nfs/dbraw/zinc/96/46/60/473964660.db2.gz CUFLXLGKSWFXFO-IEBWSBKVSA-N 1 3 346.519 2.566 10 0 EFAEHO CC(C)C[N@H+]1CC[C@H](CNC(=O)N[C@H](CN(C)C)c2ccccc2)C1 ZINC000246793353 473964664 /nfs/dbraw/zinc/96/46/64/473964664.db2.gz CUFLXLGKSWFXFO-IEBWSBKVSA-N 1 3 346.519 2.566 10 0 EFAEHO C[NH+](C)[C@@H](CC(=O)NC[C@@H]1CCN1C1CCCC1)c1ccccc1 ZINC000628964717 480075245 /nfs/dbraw/zinc/07/52/45/480075245.db2.gz FRSUZFVGQDEXQH-OALUTQOASA-N 1 3 329.488 2.813 10 0 EFAEHO CN(Cc1cccnc1)C[C@@H]1CC[N@H+](CCCN2CCCCC2)C1 ZINC000195278741 474046948 /nfs/dbraw/zinc/04/69/48/474046948.db2.gz PVAARYOUDRBDCF-FQEVSTJZSA-N 1 3 330.520 2.711 10 0 EFAEHO CN(Cc1cccnc1)C[C@@H]1CC[N@@H+](CCCN2CCCCC2)C1 ZINC000195278741 474046955 /nfs/dbraw/zinc/04/69/55/474046955.db2.gz PVAARYOUDRBDCF-FQEVSTJZSA-N 1 3 330.520 2.711 10 0 EFAEHO CCN1CC[C@H](C[NH2+][C@H](C)c2ccc(NC(=O)NC3CC3)cc2)C1 ZINC000247088273 474060324 /nfs/dbraw/zinc/06/03/24/474060324.db2.gz PGCKBMXEEPENHR-HUUCEWRRSA-N 1 3 330.476 2.963 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)Nc2ccc(C)cc2OCCN(C)C)CC[N@@H+]1C ZINC000631417609 480080514 /nfs/dbraw/zinc/08/05/14/480080514.db2.gz PKPWLFCFPSYUQC-DOTOQJQBSA-N 1 3 333.476 2.604 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)Nc2ccc(C)cc2OCCN(C)C)CC[N@H+]1C ZINC000631417609 480080522 /nfs/dbraw/zinc/08/05/22/480080522.db2.gz PKPWLFCFPSYUQC-DOTOQJQBSA-N 1 3 333.476 2.604 10 0 EFAEHO C[C@H](CNC(=O)N(C)[C@H]1CC[N@H+](C)[C@H](C)C1)N(C)Cc1ccccc1 ZINC000174833389 474104381 /nfs/dbraw/zinc/10/43/81/474104381.db2.gz MBSGHWWLXDXEMT-LMMKCTJWSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@H](CNC(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1)N(C)Cc1ccccc1 ZINC000174833389 474104385 /nfs/dbraw/zinc/10/43/85/474104385.db2.gz MBSGHWWLXDXEMT-LMMKCTJWSA-N 1 3 346.519 2.631 10 0 EFAEHO CN(CCC[NH+]1CCCC1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000282587415 474120810 /nfs/dbraw/zinc/12/08/10/474120810.db2.gz LNCXITSYUTYTIX-MOPGFXCFSA-N 1 3 344.503 2.559 10 0 EFAEHO CC[C@H]1CCCCN1CCNC(=O)NCCC1CC[NH+](CC)CC1 ZINC000175100116 474142858 /nfs/dbraw/zinc/14/28/58/474142858.db2.gz XKFNXJAXYZVGOH-SFHVURJKSA-N 1 3 338.540 2.672 10 0 EFAEHO CO[C@H]1C[C@@H](N(C)Cc2ccccc2N(C)C2CC[NH+](C)CC2)C1 ZINC000289359516 474237051 /nfs/dbraw/zinc/23/70/51/474237051.db2.gz KEOIKMYJHCZJTO-KDURUIRLSA-N 1 3 331.504 2.826 10 0 EFAEHO CN(C)CCc1ccccc1NC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000275589977 474245010 /nfs/dbraw/zinc/24/50/10/474245010.db2.gz FMQXIDFQVMDUNC-AYHJJNSGSA-N 1 3 344.503 2.928 10 0 EFAEHO CN(C)CCc1ccccc1NC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000275589977 474245016 /nfs/dbraw/zinc/24/50/16/474245016.db2.gz FMQXIDFQVMDUNC-AYHJJNSGSA-N 1 3 344.503 2.928 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2ccccc2CCN(C)C)[C@@H](C)C1 ZINC000275611554 474252916 /nfs/dbraw/zinc/25/29/16/474252916.db2.gz IGUGDNOFSLNINJ-LPHOPBHVSA-N 1 3 346.519 2.985 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccccc2CCN(C)C)[C@@H](C)C1 ZINC000275611554 474252921 /nfs/dbraw/zinc/25/29/21/474252921.db2.gz IGUGDNOFSLNINJ-LPHOPBHVSA-N 1 3 346.519 2.985 10 0 EFAEHO C[C@H](NC(=O)N1CCCN(C2CC2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182877848 474276514 /nfs/dbraw/zinc/27/65/14/474276514.db2.gz AWKBPBMKDNLKBN-DLBZAZTESA-N 1 3 348.535 2.519 10 0 EFAEHO C[C@H](NC(=O)N1CCCN(C2CC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182877848 474276521 /nfs/dbraw/zinc/27/65/21/474276521.db2.gz AWKBPBMKDNLKBN-DLBZAZTESA-N 1 3 348.535 2.519 10 0 EFAEHO CC(C)C[C@@H](N)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000236706903 474283350 /nfs/dbraw/zinc/28/33/50/474283350.db2.gz NQTYAAGMRBSXNA-XVLXNVKGSA-N 1 3 329.488 2.672 10 0 EFAEHO CC(C)C[C@@H](N)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000236706903 474283356 /nfs/dbraw/zinc/28/33/56/474283356.db2.gz NQTYAAGMRBSXNA-XVLXNVKGSA-N 1 3 329.488 2.672 10 0 EFAEHO OC[C@H]1C=C[C@@H](N[C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000248407172 474310946 /nfs/dbraw/zinc/31/09/46/474310946.db2.gz BNIYRLJICJHUPO-SRHPJPHMSA-N 1 3 326.484 2.814 10 0 EFAEHO OC[C@H]1C=C[C@@H](N[C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000248407172 474310951 /nfs/dbraw/zinc/31/09/51/474310951.db2.gz BNIYRLJICJHUPO-SRHPJPHMSA-N 1 3 326.484 2.814 10 0 EFAEHO OC[C@H]1C=C[C@@H]([NH2+][C@@H]2CCC[C@@H]3CN(Cc4ccccc4)C[C@H]32)C1 ZINC000248407172 474310960 /nfs/dbraw/zinc/31/09/60/474310960.db2.gz BNIYRLJICJHUPO-SRHPJPHMSA-N 1 3 326.484 2.814 10 0 EFAEHO CN1CCC[C@@H](CNC(=O)CC[NH3+])[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000237079929 474334350 /nfs/dbraw/zinc/33/43/50/474334350.db2.gz PIYXWVHHZUOQQK-BBRMVZONSA-N 1 3 343.393 2.553 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCN1C[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)[C@@H]2C1 ZINC000248558056 474357346 /nfs/dbraw/zinc/35/73/46/474357346.db2.gz BWXOTKKORZZSEF-HZMVEIRTSA-N 1 3 337.508 2.706 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCN1C[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)[C@@H]2C1 ZINC000248558056 474357352 /nfs/dbraw/zinc/35/73/52/474357352.db2.gz BWXOTKKORZZSEF-HZMVEIRTSA-N 1 3 337.508 2.706 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000248609035 474376890 /nfs/dbraw/zinc/37/68/90/474376890.db2.gz XEGWWVLMMLZQGB-WSTZPKSXSA-N 1 3 346.515 2.977 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000248609035 474376897 /nfs/dbraw/zinc/37/68/97/474376897.db2.gz XEGWWVLMMLZQGB-WSTZPKSXSA-N 1 3 346.515 2.977 10 0 EFAEHO Cc1ccc(OC[C@H](O)C[NH2+][C@H](C)[C@H]2CCCN(C3CCC3)C2)cc1 ZINC000248609035 474376903 /nfs/dbraw/zinc/37/69/03/474376903.db2.gz XEGWWVLMMLZQGB-WSTZPKSXSA-N 1 3 346.515 2.977 10 0 EFAEHO CCO[C@@H]1C[C@@](O)(CNC2CC[NH+](C3CCCCC3)CC2)C1(C)C ZINC000189432662 474395901 /nfs/dbraw/zinc/39/59/01/474395901.db2.gz AXQSFYRXQZZZKL-UYAOXDASSA-N 1 3 338.536 2.939 10 0 EFAEHO CCO[C@@H]1C[C@@](O)(C[NH2+]C2CCN(C3CCCCC3)CC2)C1(C)C ZINC000189432662 474395909 /nfs/dbraw/zinc/39/59/09/474395909.db2.gz AXQSFYRXQZZZKL-UYAOXDASSA-N 1 3 338.536 2.939 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(C[NH+]3CCCC3)cc2)CCN1C ZINC000265988237 474415024 /nfs/dbraw/zinc/41/50/24/474415024.db2.gz LIBPLTQVWUNUMK-APWZRJJASA-N 1 3 329.488 2.837 10 0 EFAEHO CCN(C)C(=O)[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000248747219 474424053 /nfs/dbraw/zinc/42/40/53/474424053.db2.gz BFJJARNFFBUCGE-OQIJWPOYSA-N 1 3 329.488 2.638 10 0 EFAEHO COCCN1CC[C@@H]([NH2+]C[C@H]2CCCCN(Cc3ccccc3)C2)C1 ZINC000289784340 474426190 /nfs/dbraw/zinc/42/61/90/474426190.db2.gz KUIHOUOREBRPLX-NHCUHLMSSA-N 1 3 345.531 2.599 10 0 EFAEHO COCCN1CC[C@@H](NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)C1 ZINC000289784340 474426194 /nfs/dbraw/zinc/42/61/94/474426194.db2.gz KUIHOUOREBRPLX-NHCUHLMSSA-N 1 3 345.531 2.599 10 0 EFAEHO COCCN1CC[C@@H](NC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000289784340 474426201 /nfs/dbraw/zinc/42/62/01/474426201.db2.gz KUIHOUOREBRPLX-NHCUHLMSSA-N 1 3 345.531 2.599 10 0 EFAEHO C[C@@H]1CN([C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)c2cccs2)CCO1 ZINC000248827428 474448092 /nfs/dbraw/zinc/44/80/92/474448092.db2.gz GPVVPLFGEROVTQ-QCLGFWRNSA-N 1 3 349.544 2.725 10 0 EFAEHO C[NH+](C)CCCCNCc1cn2ccc(Br)cc2n1 ZINC000290028300 474531998 /nfs/dbraw/zinc/53/19/98/474531998.db2.gz VONHQPJAMBCXPG-UHFFFAOYSA-N 1 3 325.254 2.528 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)CC[N@@H+]1C ZINC000631475871 480111080 /nfs/dbraw/zinc/11/10/80/480111080.db2.gz MPCQHKDRDSQMJY-LISAXSMJSA-N 1 3 349.544 2.978 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)CC[N@H+]1C ZINC000631475871 480111086 /nfs/dbraw/zinc/11/10/86/480111086.db2.gz MPCQHKDRDSQMJY-LISAXSMJSA-N 1 3 349.544 2.978 10 0 EFAEHO CN(C[C@@H](O)CC(F)(F)F)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000249290967 474553172 /nfs/dbraw/zinc/55/31/72/474553172.db2.gz MIFFMNHCTZFSPE-CVEARBPZSA-N 1 3 330.394 2.754 10 0 EFAEHO CN(C[C@@H](O)CC(F)(F)F)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000249290967 474553178 /nfs/dbraw/zinc/55/31/78/474553178.db2.gz MIFFMNHCTZFSPE-CVEARBPZSA-N 1 3 330.394 2.754 10 0 EFAEHO CN(C)[C@H](CNC(=O)C[NH+]1C[C@@H]2CCCC[C@H]2C1)c1ccccc1 ZINC000249367317 474560791 /nfs/dbraw/zinc/56/07/91/474560791.db2.gz VKDQBBUZKAULKH-GBESFXJTSA-N 1 3 329.488 2.528 10 0 EFAEHO C[N@H+](CC[C@H]1CCCO1)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000249502442 474581184 /nfs/dbraw/zinc/58/11/84/474581184.db2.gz XPPXYSVKBJGLKH-NHCUHLMSSA-N 1 3 346.515 2.933 10 0 EFAEHO C[N@@H+](CC[C@H]1CCCO1)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000249502442 474581187 /nfs/dbraw/zinc/58/11/87/474581187.db2.gz XPPXYSVKBJGLKH-NHCUHLMSSA-N 1 3 346.515 2.933 10 0 EFAEHO CCC[NH+](CCC)CCCNC(=O)Nc1ccc2c(c1)OCCNC2 ZINC000625943502 480114391 /nfs/dbraw/zinc/11/43/91/480114391.db2.gz IJOXPLLUIKTVSX-UHFFFAOYSA-N 1 3 348.491 2.802 10 0 EFAEHO O=C(NCCC[NH2+]C1CCCCC1)Nc1ccc2c(c1)OCCNC2 ZINC000625943548 480114500 /nfs/dbraw/zinc/11/45/00/480114500.db2.gz LDDSWGJVKUZOAW-UHFFFAOYSA-N 1 3 346.475 2.603 10 0 EFAEHO C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)N[C@H](CN(C)C)c1ccccc1 ZINC000249774129 474614424 /nfs/dbraw/zinc/61/44/24/474614424.db2.gz MHDGFIBWJVWQAT-ZIFCJYIRSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N[C@H](CN(C)C)c1ccccc1 ZINC000249774129 474614429 /nfs/dbraw/zinc/61/44/29/474614429.db2.gz MHDGFIBWJVWQAT-ZIFCJYIRSA-N 1 3 346.519 2.709 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CC1 ZINC000252801429 474714424 /nfs/dbraw/zinc/71/44/24/474714424.db2.gz JNGWPKDJOWNPRR-OALUTQOASA-N 1 3 329.488 2.668 10 0 EFAEHO CN1CCC(Oc2ccc(N[C@@H]3CC[N@@H+]4CCC[C@H]4C3)cn2)CC1 ZINC000253370930 474730201 /nfs/dbraw/zinc/73/02/01/474730201.db2.gz YHKHCHOJABMSLR-WBVHZDCISA-N 1 3 330.476 2.593 10 0 EFAEHO CN1CCC(Oc2ccc(N[C@@H]3CC[N@H+]4CCC[C@H]4C3)cn2)CC1 ZINC000253370930 474730205 /nfs/dbraw/zinc/73/02/05/474730205.db2.gz YHKHCHOJABMSLR-WBVHZDCISA-N 1 3 330.476 2.593 10 0 EFAEHO CN1CCC[C@H](CNC2=[NH+]CCN2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000253426476 474750708 /nfs/dbraw/zinc/75/07/08/474750708.db2.gz IYXPIOIHCCAWPR-HIFRSBDPSA-N 1 3 340.393 2.637 10 0 EFAEHO CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)CC1CCN(C)CC1 ZINC000273185398 474765641 /nfs/dbraw/zinc/76/56/41/474765641.db2.gz HFDBWBQSFIHBLS-FQEVSTJZSA-N 1 3 343.515 2.699 10 0 EFAEHO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)CC1CCN(C)CC1 ZINC000273185398 474765647 /nfs/dbraw/zinc/76/56/47/474765647.db2.gz HFDBWBQSFIHBLS-FQEVSTJZSA-N 1 3 343.515 2.699 10 0 EFAEHO CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)CC1CCN(C)CC1 ZINC000273185400 474766044 /nfs/dbraw/zinc/76/60/44/474766044.db2.gz HFDBWBQSFIHBLS-HXUWFJFHSA-N 1 3 343.515 2.699 10 0 EFAEHO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)CC1CCN(C)CC1 ZINC000273185400 474766051 /nfs/dbraw/zinc/76/60/51/474766051.db2.gz HFDBWBQSFIHBLS-HXUWFJFHSA-N 1 3 343.515 2.699 10 0 EFAEHO O[C@H](C[NH2+][C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21)CC(F)(F)F ZINC000307951744 474814780 /nfs/dbraw/zinc/81/47/80/474814780.db2.gz VBWXKHTYJAPLHD-LUKYLMHMSA-N 1 3 342.405 2.800 10 0 EFAEHO O[C@H](CN[C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)CC(F)(F)F ZINC000307951744 474814783 /nfs/dbraw/zinc/81/47/83/474814783.db2.gz VBWXKHTYJAPLHD-LUKYLMHMSA-N 1 3 342.405 2.800 10 0 EFAEHO O[C@H](CN[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)CC(F)(F)F ZINC000307951744 474814788 /nfs/dbraw/zinc/81/47/88/474814788.db2.gz VBWXKHTYJAPLHD-LUKYLMHMSA-N 1 3 342.405 2.800 10 0 EFAEHO CN1CCC(CC(=O)Nc2ccc(CC[NH+]3CCCC3)cc2)CC1 ZINC000273289115 474824697 /nfs/dbraw/zinc/82/46/97/474824697.db2.gz XRYRWEBAYMRHJZ-UHFFFAOYSA-N 1 3 329.488 2.995 10 0 EFAEHO CN1CC[C@@]2(CC[N@H+](CCOc3cccc(Br)c3)C2)C1 ZINC000292181723 474891393 /nfs/dbraw/zinc/89/13/93/474891393.db2.gz QQAJGEKEFJBSBR-MRXNPFEDSA-N 1 3 339.277 2.856 10 0 EFAEHO CN1CC[C@@]2(CC[N@@H+](CCOc3cccc(Br)c3)C2)C1 ZINC000292181723 474891395 /nfs/dbraw/zinc/89/13/95/474891395.db2.gz QQAJGEKEFJBSBR-MRXNPFEDSA-N 1 3 339.277 2.856 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@H](c2cnn(C)c2)C(C)(C)C)CC1 ZINC000337324638 474898121 /nfs/dbraw/zinc/89/81/21/474898121.db2.gz UKXUIWNXIZYYBQ-GOSISDBHSA-N 1 3 335.540 2.513 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)CC1 ZINC000337325366 474899064 /nfs/dbraw/zinc/89/90/64/474899064.db2.gz VDVKYPBWLSDXTM-BBTUJRGHSA-N 1 3 345.531 2.945 10 0 EFAEHO CC[C@H](NCC(=O)NC1CC[NH+](C2CC2)CC1)c1ccc(C)cc1 ZINC000341037278 474902787 /nfs/dbraw/zinc/90/27/87/474902787.db2.gz KJQVTMSOKZIVJW-IBGZPJMESA-N 1 3 329.488 2.779 10 0 EFAEHO CC[NH+](CC)CCN(Cc1ccccc1)C(=O)N[C@@H]1CCCN(C)C1 ZINC000620548342 480133061 /nfs/dbraw/zinc/13/30/61/480133061.db2.gz UBSWZKPRVWPQQI-LJQANCHMSA-N 1 3 346.519 2.634 10 0 EFAEHO CN1CC[C@@]2(CC[N@H+](C[C@H](O)COc3ccc(C(C)(C)C)cc3)C2)C1 ZINC000292272651 474935435 /nfs/dbraw/zinc/93/54/35/474935435.db2.gz ZVLWPBVKJFYUCU-GHTZIAJQSA-N 1 3 346.515 2.751 10 0 EFAEHO CN1CC[C@@]2(CC[N@@H+](C[C@H](O)COc3ccc(C(C)(C)C)cc3)C2)C1 ZINC000292272651 474935446 /nfs/dbraw/zinc/93/54/46/474935446.db2.gz ZVLWPBVKJFYUCU-GHTZIAJQSA-N 1 3 346.515 2.751 10 0 EFAEHO CN(C(=O)CC1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@H]1CCN(Cc2ccccc2)C1 ZINC000261553714 474982252 /nfs/dbraw/zinc/98/22/52/474982252.db2.gz AMSWXJJUKMZEIU-NXEWRWPSSA-N 1 3 341.499 2.640 10 0 EFAEHO Cc1ccc(OC[C@@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c(C)c1 ZINC000325149179 474984984 /nfs/dbraw/zinc/98/49/84/474984984.db2.gz MFIODZPCYGIPSO-IPQPSQTFSA-N 1 3 332.488 2.648 10 0 EFAEHO Cc1ccc(OC[C@@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c(C)c1 ZINC000325149179 474984994 /nfs/dbraw/zinc/98/49/94/474984994.db2.gz MFIODZPCYGIPSO-IPQPSQTFSA-N 1 3 332.488 2.648 10 0 EFAEHO Fc1ccc(N2CCN(Cc3cccc4c3CC[NH2+]C4)CC2)cc1 ZINC000325789137 474995466 /nfs/dbraw/zinc/99/54/66/474995466.db2.gz MLYOOSZOJRQSIZ-UHFFFAOYSA-N 1 3 325.431 2.794 10 0 EFAEHO Cc1occc1C(=O)NC1CC[NH+](CC[C@H]2CCCCN2C)CC1 ZINC000268522969 475029539 /nfs/dbraw/zinc/02/95/39/475029539.db2.gz GFOSUYNELFBXJI-QGZVFWFLSA-N 1 3 333.476 2.657 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCCN(C)CC(F)(F)F ZINC000268961057 475096625 /nfs/dbraw/zinc/09/66/25/475096625.db2.gz XHANIUNYPTWFBM-NVXWUHKLSA-N 1 3 343.437 2.981 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCCN(C)CC(F)(F)F ZINC000268961057 475096637 /nfs/dbraw/zinc/09/66/37/475096637.db2.gz XHANIUNYPTWFBM-NVXWUHKLSA-N 1 3 343.437 2.981 10 0 EFAEHO O=C(NCC[NH+]1CCC2(CCCCC2)CC1)N1CCN2CCC1CC2 ZINC000341531316 475118986 /nfs/dbraw/zinc/11/89/86/475118986.db2.gz OSWQIFKDKAZLHI-UHFFFAOYSA-N 1 3 348.535 2.522 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000341554306 475139489 /nfs/dbraw/zinc/13/94/89/475139489.db2.gz IRSDXRUCAPWQMY-KSZLIROESA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)N1CCC(CC[NH+](C)C)CC1 ZINC000341561494 475145543 /nfs/dbraw/zinc/14/55/43/475145543.db2.gz SXFVBRICFBUZAT-IRXDYDNUSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NCCC[N@@H+]1CCCC[C@H]1C ZINC000337577499 475147130 /nfs/dbraw/zinc/14/71/30/475147130.db2.gz XSRFFCCFLORQSR-SJORKVTESA-N 1 3 326.529 2.526 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NCCC[N@H+]1CCCC[C@H]1C ZINC000337577499 475147139 /nfs/dbraw/zinc/14/71/39/475147139.db2.gz XSRFFCCFLORQSR-SJORKVTESA-N 1 3 326.529 2.526 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N1CCC[C@H]1C[NH+]1CCCC1 ZINC000341564694 475148687 /nfs/dbraw/zinc/14/86/87/475148687.db2.gz YMZOSXBDDWQXJE-KURKYZTESA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H]1CCC[C@](CNC(=O)NCCN2CCCC[C@H]2C)([NH+](C)C)C1 ZINC000339449788 475223182 /nfs/dbraw/zinc/22/31/82/475223182.db2.gz UATOCKOTGIILGU-LMMKCTJWSA-N 1 3 338.540 2.671 10 0 EFAEHO CCN(Cc1ccccc1N(C)C1CC[NH+](C)CC1)[C@H]1CCOC1 ZINC000361236166 475293050 /nfs/dbraw/zinc/29/30/50/475293050.db2.gz HRTODHMMOLTGSK-IBGZPJMESA-N 1 3 331.504 2.828 10 0 EFAEHO CC[C@H](N[C@H](C)c1cccc(OCC[NH+](C)C)c1)[C@H](O)C(F)F ZINC000296395602 475296921 /nfs/dbraw/zinc/29/69/21/475296921.db2.gz KGNUXWMNZJNURH-KCXAZCMYSA-N 1 3 330.419 2.682 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2CCO[C@H](C)C2)CC1 ZINC000354686687 475338715 /nfs/dbraw/zinc/33/87/15/475338715.db2.gz DHFTZTZFGDDAKA-IEBWSBKVSA-N 1 3 331.504 2.876 10 0 EFAEHO CN(C)C(=O)CC[NH+]1CCC(N[C@@H]2CCCc3sccc32)CC1 ZINC000361340720 475368158 /nfs/dbraw/zinc/36/81/58/475368158.db2.gz HVOBGCORPPSDOQ-MRXNPFEDSA-N 1 3 335.517 2.658 10 0 EFAEHO Cc1cccc([C@H](C)NCC(=O)NC2CC[NH+](C3CC3)CC2)c1C ZINC000341867838 475368525 /nfs/dbraw/zinc/36/85/25/475368525.db2.gz FQPRHNXMCOXARY-INIZCTEOSA-N 1 3 329.488 2.697 10 0 EFAEHO Cc1cc([C@H](C)NC2CC[NH+](CCC(=O)N(C)C)CC2)c(C)s1 ZINC000361350018 475376721 /nfs/dbraw/zinc/37/67/21/475376721.db2.gz AZFMOERVWKCUCT-AWEZNQCLSA-N 1 3 337.533 2.958 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@@H]1CCN(C2CC2)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000358105948 475404115 /nfs/dbraw/zinc/40/41/15/475404115.db2.gz WVHUJIVCXJUTBP-TXPKVOOTSA-N 1 3 348.535 2.518 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@@H]1CCN(C2CC2)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000358105948 475404123 /nfs/dbraw/zinc/40/41/23/475404123.db2.gz WVHUJIVCXJUTBP-TXPKVOOTSA-N 1 3 348.535 2.518 10 0 EFAEHO Cc1ccc(CN(CCN(C)C)C(=O)CC[C@@H]2CCCC[N@@H+]2C)o1 ZINC000354802363 475421893 /nfs/dbraw/zinc/42/18/93/475421893.db2.gz TXYYYPZWUGHFSS-KRWDZBQOSA-N 1 3 335.492 2.743 10 0 EFAEHO Cc1ccc(CN(CCN(C)C)C(=O)CC[C@@H]2CCCC[N@H+]2C)o1 ZINC000354802363 475421903 /nfs/dbraw/zinc/42/19/03/475421903.db2.gz TXYYYPZWUGHFSS-KRWDZBQOSA-N 1 3 335.492 2.743 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000345809825 475470710 /nfs/dbraw/zinc/47/07/10/475470710.db2.gz KOZMYQPIWXPZNV-OTWHNJEPSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000345809824 475471209 /nfs/dbraw/zinc/47/12/09/475471209.db2.gz KOZMYQPIWXPZNV-GUDVDZBRSA-N 1 3 335.536 2.974 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)NCCN2CC=C(C)CC2)[NH+](C)C)cc1 ZINC000358193300 475478109 /nfs/dbraw/zinc/47/81/09/475478109.db2.gz QNESYFIJWALSKF-LJQANCHMSA-N 1 3 344.503 2.549 10 0 EFAEHO CC(CN1CC[C@]2(C1)CCCOC2)C[N@@H+]1CC[C@]2(C1)CCCOC2 ZINC000341993654 475487780 /nfs/dbraw/zinc/48/77/80/475487780.db2.gz PXOPWDCXGGSWAR-PMACEKPBSA-N 1 3 336.520 2.628 10 0 EFAEHO CC(CN1CC[C@]2(C1)CCCOC2)C[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000341993654 475487790 /nfs/dbraw/zinc/48/77/90/475487790.db2.gz PXOPWDCXGGSWAR-PMACEKPBSA-N 1 3 336.520 2.628 10 0 EFAEHO CCN(Cc1cccc(C[N@H+](CC)[C@H]2CCOC2)c1)[C@H]1CCOC1 ZINC000361584935 475570243 /nfs/dbraw/zinc/57/02/43/475570243.db2.gz ARZKTJTYEUSOMI-PMACEKPBSA-N 1 3 332.488 2.908 10 0 EFAEHO CCN(Cc1cccc(C[N@@H+](CC)[C@H]2CCOC2)c1)[C@H]1CCOC1 ZINC000361584935 475570249 /nfs/dbraw/zinc/57/02/49/475570249.db2.gz ARZKTJTYEUSOMI-PMACEKPBSA-N 1 3 332.488 2.908 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH+]2CCC(C)(CO)CC2)CC1 ZINC000358300767 475572977 /nfs/dbraw/zinc/57/29/77/475572977.db2.gz PJIPMCDKMGCVEM-UHFFFAOYSA-N 1 3 345.531 2.813 10 0 EFAEHO CCCN1CCC[C@H]1CNC(=O)N1CCC(C[NH+](CC)CC)CC1 ZINC000358304593 475573699 /nfs/dbraw/zinc/57/36/99/475573699.db2.gz CXGXDJRKYLHZIN-SFHVURJKSA-N 1 3 338.540 2.624 10 0 EFAEHO CCN(Cc1ccccc1C[N@H+](CC)[C@H]1CCOC1)[C@H]1CCOC1 ZINC000361587659 475573677 /nfs/dbraw/zinc/57/36/77/475573677.db2.gz KSHHKYUXAJWLSN-PMACEKPBSA-N 1 3 332.488 2.908 10 0 EFAEHO CCN(Cc1ccccc1C[N@@H+](CC)[C@H]1CCOC1)[C@H]1CCOC1 ZINC000361587659 475573686 /nfs/dbraw/zinc/57/36/86/475573686.db2.gz KSHHKYUXAJWLSN-PMACEKPBSA-N 1 3 332.488 2.908 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2ccc(CO)c(F)c2)[C@H](C)C1 ZINC000358367626 475622839 /nfs/dbraw/zinc/62/28/39/475622839.db2.gz NDVLMFJXLNNGOA-BEFAXECRSA-N 1 3 338.467 2.545 10 0 EFAEHO CCC[NH+]1CCC(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CC1 ZINC000340112605 475768560 /nfs/dbraw/zinc/76/85/60/475768560.db2.gz NJDVSILPEHTKNQ-RBUKOAKNSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@H]1C[N@H+](CCCNCc2ccccc2-c2ccnn2C)CCCO1 ZINC000353207393 475771403 /nfs/dbraw/zinc/77/14/03/475771403.db2.gz UQWXQINIKHHEFJ-KRWDZBQOSA-N 1 3 342.487 2.678 10 0 EFAEHO C[C@H]1C[N@@H+](CCCNCc2ccccc2-c2ccnn2C)CCCO1 ZINC000353207393 475771410 /nfs/dbraw/zinc/77/14/10/475771410.db2.gz UQWXQINIKHHEFJ-KRWDZBQOSA-N 1 3 342.487 2.678 10 0 EFAEHO CC(C)C[C@H]([NH2+][C@@H](C)C1CCC(F)(F)CC1)C(=O)NCCN(C)C ZINC000353246760 475800592 /nfs/dbraw/zinc/80/05/92/475800592.db2.gz XWHDLKPGKNUPDQ-HOCLYGCPSA-N 1 3 347.494 2.883 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(CC)Cc1ccc(C[NH+](C)C)cc1 ZINC000340176696 475825007 /nfs/dbraw/zinc/82/50/07/475825007.db2.gz BEXXLMCGSQHORR-IBGZPJMESA-N 1 3 331.504 2.971 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(CC)Cc1ccc(C[NH+](C)C)cc1 ZINC000340176697 475825993 /nfs/dbraw/zinc/82/59/93/475825993.db2.gz BEXXLMCGSQHORR-LJQANCHMSA-N 1 3 331.504 2.971 10 0 EFAEHO COc1cccc(CC[NH2+][C@H](C)c2ccc(OCCN(C)C)cc2)n1 ZINC000361922609 475870080 /nfs/dbraw/zinc/87/00/80/475870080.db2.gz ATHJZOBJONCPIF-MRXNPFEDSA-N 1 3 343.471 2.924 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cccc(C(=O)NC3CC3)c2)[C@H]2CCC[C@H]21 ZINC000353389760 475930254 /nfs/dbraw/zinc/93/02/54/475930254.db2.gz WOYLMZUPYYCWAM-CEXWTWQISA-N 1 3 327.472 2.541 10 0 EFAEHO COc1ccccc1N1CC[C@H](N[C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)C1 ZINC000353400604 475938153 /nfs/dbraw/zinc/93/81/53/475938153.db2.gz FZBIIIHBTOPNHM-MLHJIOFPSA-N 1 3 329.488 2.736 10 0 EFAEHO COc1ccccc1N1CC[C@H](N[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@@H]32)C1 ZINC000353400604 475938160 /nfs/dbraw/zinc/93/81/60/475938160.db2.gz FZBIIIHBTOPNHM-MLHJIOFPSA-N 1 3 329.488 2.736 10 0 EFAEHO COc1ccccc1N1CC[C@H](N[C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)C1 ZINC000353400603 475939062 /nfs/dbraw/zinc/93/90/62/475939062.db2.gz FZBIIIHBTOPNHM-FJIDUMEYSA-N 1 3 329.488 2.736 10 0 EFAEHO COc1ccccc1N1CC[C@H](N[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@H]32)C1 ZINC000353400603 475939070 /nfs/dbraw/zinc/93/90/70/475939070.db2.gz FZBIIIHBTOPNHM-FJIDUMEYSA-N 1 3 329.488 2.736 10 0 EFAEHO CN1CC[C@H]([NH2+][C@@H]2CC(=O)N(c3c(F)cccc3F)C2)[C@H]2CCC[C@@H]21 ZINC000353410340 475945008 /nfs/dbraw/zinc/94/50/08/475945008.db2.gz WQDIPLRCGMNFMZ-OMNBBPDLSA-N 1 3 349.425 2.533 10 0 EFAEHO CN(C)C1(C[NH2+][C@H]2CCN(C)[C@@H]3CCC[C@H]32)Cc2ccccc2C1 ZINC000353520656 476042506 /nfs/dbraw/zinc/04/25/06/476042506.db2.gz OJWAZFZXWOEXML-SLFFLAALSA-N 1 3 327.516 2.548 10 0 EFAEHO CN(C)CCOc1ccc(CC[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@H]32)cc1 ZINC000353521177 476042675 /nfs/dbraw/zinc/04/26/75/476042675.db2.gz PJZOTPRZCZYRPQ-PWRODBHTSA-N 1 3 345.531 2.632 10 0 EFAEHO CN(C)CCOc1ccc(CC[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@@H]32)cc1 ZINC000353521176 476042717 /nfs/dbraw/zinc/04/27/17/476042717.db2.gz PJZOTPRZCZYRPQ-NJYVYQBISA-N 1 3 345.531 2.632 10 0 EFAEHO C[N@@H+]1CC[C@H](NCc2ccc(-n3ccnc3)c(F)c2)[C@@H]2CCC[C@H]21 ZINC000353521555 476044811 /nfs/dbraw/zinc/04/48/11/476044811.db2.gz QAVPLFVFAJPZNW-RYQLBKOJSA-N 1 3 328.435 2.974 10 0 EFAEHO C[N@H+]1CC[C@H](NCc2ccc(-n3ccnc3)c(F)c2)[C@@H]2CCC[C@H]21 ZINC000353521555 476044814 /nfs/dbraw/zinc/04/48/14/476044814.db2.gz QAVPLFVFAJPZNW-RYQLBKOJSA-N 1 3 328.435 2.974 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccc(-n3ccnc3)c(F)c2)[C@@H]2CCC[C@H]21 ZINC000353521555 476044820 /nfs/dbraw/zinc/04/48/20/476044820.db2.gz QAVPLFVFAJPZNW-RYQLBKOJSA-N 1 3 328.435 2.974 10 0 EFAEHO CC[C@@H](Cn1cncn1)NCc1ccccc1C[NH+]1CCCCC1 ZINC000340475734 476059005 /nfs/dbraw/zinc/05/90/05/476059005.db2.gz XYOSQBYVNRBJEX-IBGZPJMESA-N 1 3 327.476 2.832 10 0 EFAEHO COC[C@]1(CN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)OCCc2ccccc21 ZINC000353564783 476082992 /nfs/dbraw/zinc/08/29/92/476082992.db2.gz IQAVNTNDQKFWRP-NRDMVMEKSA-N 1 3 344.499 2.563 10 0 EFAEHO COC[C@]1(CN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@H]32)OCCc2ccccc21 ZINC000353564783 476082997 /nfs/dbraw/zinc/08/29/97/476082997.db2.gz IQAVNTNDQKFWRP-NRDMVMEKSA-N 1 3 344.499 2.563 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)[C@H]2CCC[C@@H]21 ZINC000353598519 476112940 /nfs/dbraw/zinc/11/29/40/476112940.db2.gz VZNYOWXJOXWTTJ-YRXWBPOGSA-N 1 3 342.487 2.755 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)[C@H]2CCC[C@@H]21 ZINC000353598519 476112948 /nfs/dbraw/zinc/11/29/48/476112948.db2.gz VZNYOWXJOXWTTJ-YRXWBPOGSA-N 1 3 342.487 2.755 10 0 EFAEHO CN1CC[C@H]([NH2+]CCOc2cccc(C(F)(F)F)n2)[C@@H]2CCC[C@@H]21 ZINC000353615980 476126796 /nfs/dbraw/zinc/12/67/96/476126796.db2.gz XSVYQWNVUMHPBU-IHRRRGAJSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCOc2cccc(C(F)(F)F)n2)[C@@H]2CCC[C@@H]21 ZINC000353615980 476126803 /nfs/dbraw/zinc/12/68/03/476126803.db2.gz XSVYQWNVUMHPBU-IHRRRGAJSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@H+]1CC[C@H](NCCOc2cccc(C(F)(F)F)n2)[C@@H]2CCC[C@@H]21 ZINC000353615980 476126810 /nfs/dbraw/zinc/12/68/10/476126810.db2.gz XSVYQWNVUMHPBU-IHRRRGAJSA-N 1 3 343.393 2.942 10 0 EFAEHO CN1CCC[C@@H]1CC[NH+]1CCC2(C[C@@H]2C(=O)N2CCCCC2)CC1 ZINC000357082840 476217131 /nfs/dbraw/zinc/21/71/31/476217131.db2.gz JQTUXFVXYSJXCM-QZTJIDSGSA-N 1 3 333.520 2.585 10 0 EFAEHO CCN1CC[C@@H]([N@H+](C)Cc2cc(OC)c3c(c2)OCCO3)C[C@@H]1C ZINC000353754887 476250137 /nfs/dbraw/zinc/25/01/37/476250137.db2.gz RFTXNBBLULTMBI-GOEBONIOSA-N 1 3 334.460 2.771 10 0 EFAEHO CCN1CC[C@@H]([N@@H+](C)Cc2cc(OC)c3c(c2)OCCO3)C[C@@H]1C ZINC000353754887 476250140 /nfs/dbraw/zinc/25/01/40/476250140.db2.gz RFTXNBBLULTMBI-GOEBONIOSA-N 1 3 334.460 2.771 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]CCN2CCCC[C@H]2C)[C@H](C)C1 ZINC000359926295 476274076 /nfs/dbraw/zinc/27/40/76/476274076.db2.gz QBRFKXOMYYZEDR-QRVBRYPASA-N 1 3 325.541 2.587 10 0 EFAEHO CN1CCC(CNC(=[NH2+])Nc2ccccc2)(N2CCCCC2)CC1 ZINC000304342822 476280651 /nfs/dbraw/zinc/28/06/51/476280651.db2.gz UAKRQEMRQOTFOB-UHFFFAOYSA-N 1 3 329.492 2.573 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccc3ccccc3n2)CC[C@H]1N1CCN(C)CC1 ZINC000362704960 476358901 /nfs/dbraw/zinc/35/89/01/476358901.db2.gz WDOYILMGFMABJJ-LAUBAEHRSA-N 1 3 338.499 2.693 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccc3ccccc3n2)CC[C@H]1N1CCN(C)CC1 ZINC000362704960 476358905 /nfs/dbraw/zinc/35/89/05/476358905.db2.gz WDOYILMGFMABJJ-LAUBAEHRSA-N 1 3 338.499 2.693 10 0 EFAEHO Cc1ccc2c(c1)[C@@H]([NH2+]CCN1CCN(C)C(C)(C)C1)CCCO2 ZINC000374239966 476463016 /nfs/dbraw/zinc/46/30/16/476463016.db2.gz HFWJNRFSXCQYIB-SFHVURJKSA-N 1 3 331.504 2.824 10 0 EFAEHO C[C@H](Cc1ccccc1)C[N@H+](C)[C@@H]1CCN(C2CCN(C)CC2)C1 ZINC000377633065 476489670 /nfs/dbraw/zinc/48/96/70/476489670.db2.gz UOKLQMSVJMDGRM-WIYYLYMNSA-N 1 3 329.532 2.966 10 0 EFAEHO C[C@H](Cc1ccccc1)C[N@@H+](C)[C@@H]1CCN(C2CCN(C)CC2)C1 ZINC000377633065 476489677 /nfs/dbraw/zinc/48/96/77/476489677.db2.gz UOKLQMSVJMDGRM-WIYYLYMNSA-N 1 3 329.532 2.966 10 0 EFAEHO O[C@@H](CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCOCC1 ZINC000354193009 476491662 /nfs/dbraw/zinc/49/16/62/476491662.db2.gz YKPQMNLBIGZGLR-VTHDOGFWSA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@@H](CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCOCC1 ZINC000354193009 476491669 /nfs/dbraw/zinc/49/16/69/476491669.db2.gz YKPQMNLBIGZGLR-VTHDOGFWSA-N 1 3 344.499 2.559 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)C1 ZINC000377644468 476495726 /nfs/dbraw/zinc/49/57/26/476495726.db2.gz FIBSMHHFURULCU-GOSISDBHSA-N 1 3 327.488 2.624 10 0 EFAEHO COC1CC([NH2+]C[C@@H]2CN(Cc3ccccc3)CC23CCOCC3)C1 ZINC000354209229 476504796 /nfs/dbraw/zinc/50/47/96/476504796.db2.gz SLHQBCFCAHPIHW-XEVCZEQESA-N 1 3 344.499 2.682 10 0 EFAEHO CN(C)CCOc1cc(C[NH2+][C@@H]2CCCC[C@@H]2[C@H]2CCOC2)ccn1 ZINC000364390259 476526028 /nfs/dbraw/zinc/52/60/28/476526028.db2.gz WUUNSMLECMIAGK-IPMKNSEASA-N 1 3 347.503 2.707 10 0 EFAEHO CC[NH+](CC)CCC[C@@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000377747765 476558599 /nfs/dbraw/zinc/55/85/99/476558599.db2.gz HCWVMRKCWZOEAI-CRAIPNDOSA-N 1 3 329.504 2.826 10 0 EFAEHO C[C@H]1CCC[N@H+](CCCCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000377760038 476565705 /nfs/dbraw/zinc/56/57/05/476565705.db2.gz INCSSORSKDIWSU-QFBILLFUSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H]1CCC[N@@H+](CCCCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000377760038 476565710 /nfs/dbraw/zinc/56/57/10/476565710.db2.gz INCSSORSKDIWSU-QFBILLFUSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](Cc1ccccc1)N(C)CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000357748189 476575522 /nfs/dbraw/zinc/57/55/22/476575522.db2.gz NJQIMBFXWKLPQL-LJQANCHMSA-N 1 3 343.515 2.683 10 0 EFAEHO CCCC[N@H+](C)C[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000357871109 476662209 /nfs/dbraw/zinc/66/22/09/476662209.db2.gz NELRGZWITHODIA-UHOSZYNNSA-N 1 3 346.519 2.851 10 0 EFAEHO CCCC[N@@H+](C)C[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000357871109 476662213 /nfs/dbraw/zinc/66/22/13/476662213.db2.gz NELRGZWITHODIA-UHOSZYNNSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)C2CCC([NH3+])CC2)CCN1Cc1ccccc1 ZINC000379680715 476730178 /nfs/dbraw/zinc/73/01/78/476730178.db2.gz NSVJEKWFPYEJNL-RXQRSOPUSA-N 1 3 329.488 2.673 10 0 EFAEHO [NH3+]C1CCC(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)CC1 ZINC000379661243 476730619 /nfs/dbraw/zinc/73/06/19/476730619.db2.gz DVGFDALGLYDJMA-CTWPCTMYSA-N 1 3 329.488 2.675 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@@H](c1ccc(F)cc1)N(C)C ZINC000422705956 476737093 /nfs/dbraw/zinc/73/70/93/476737093.db2.gz DEXUYFNRCMCGPG-YJYMSZOUSA-N 1 3 330.451 2.941 10 0 EFAEHO C[C@H](NCc1ccc(OCCC[NH+](C)C)cc1)c1cnccc1N ZINC000422719398 476743114 /nfs/dbraw/zinc/74/31/14/476743114.db2.gz RBMFORSPTOAFJZ-HNNXBMFYSA-N 1 3 328.460 2.675 10 0 EFAEHO C(N[C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)C1(N2CCOCC2)CCCCC1 ZINC000422751106 476759404 /nfs/dbraw/zinc/75/94/04/476759404.db2.gz CEZZRAIMCXZQGF-VAMGGRTRSA-N 1 3 349.563 2.922 10 0 EFAEHO NC[C@H]1CCCC[C@@H]1[NH2+]CC1CCN(C(=O)c2ccccc2)CC1 ZINC000422770279 476769924 /nfs/dbraw/zinc/76/99/24/476769924.db2.gz UUDKWLOJPXWUDO-MOPGFXCFSA-N 1 3 329.488 2.646 10 0 EFAEHO COc1ccc(CC[NH2+][C@H](C)c2ccc(CN)nc2C)c(OC)c1 ZINC000422778258 476773281 /nfs/dbraw/zinc/77/32/81/476773281.db2.gz HBWJTHBWBLUTHJ-CYBMUJFWSA-N 1 3 329.444 2.759 10 0 EFAEHO O=C(c1ccco1)N1CCC([NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCCN2)CC1 ZINC000422817071 476791477 /nfs/dbraw/zinc/79/14/77/476791477.db2.gz GOCGQEWRQANCJJ-OKZBNKHCSA-N 1 3 345.487 2.785 10 0 EFAEHO COc1ccc([C@H](NCCN2CCCC[C@H]2C)[C@@H]2CCC[NH2+]2)cc1 ZINC000422858540 476813896 /nfs/dbraw/zinc/81/38/96/476813896.db2.gz IYUOAUGOCATNNE-UXPWSPDFSA-N 1 3 331.504 2.952 10 0 EFAEHO CC(C)(C[NH+]1CCCC1)NCCCN1CCN(c2ccccc2)CC1 ZINC000452091047 476816989 /nfs/dbraw/zinc/81/69/89/476816989.db2.gz APDPNWGZNQMADA-UHFFFAOYSA-N 1 3 344.547 2.663 10 0 EFAEHO COc1ccccc1N1CC[C@H](N[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)C1 ZINC000422878116 476823656 /nfs/dbraw/zinc/82/36/56/476823656.db2.gz SKWDAINIFWMHII-BSDSXHPESA-N 1 3 329.488 2.784 10 0 EFAEHO COc1ccc(C)cc1C1(CNC2C[C@H]3CC[C@@H](C2)[NH2+]3)CCOCC1 ZINC000422895939 476832286 /nfs/dbraw/zinc/83/22/86/476832286.db2.gz GVGKDSNFQCEXSP-JWTNVVGKSA-N 1 3 344.499 2.924 10 0 EFAEHO CCN1CCCC[C@@H]1CN[C@H](c1ccc(OC)cc1)[C@H]1CCC[NH2+]1 ZINC000422908466 476841326 /nfs/dbraw/zinc/84/13/26/476841326.db2.gz MQJHAGVVTLTTHR-MISYRCLQSA-N 1 3 331.504 2.952 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1ccc(Oc2cccnc2)c(F)c1 ZINC000422906614 476841411 /nfs/dbraw/zinc/84/14/11/476841411.db2.gz VNFRUNIYSUAUEN-OAHLLOKOSA-N 1 3 333.407 2.857 10 0 EFAEHO COc1cccc(OCCC[NH2+][C@H](C)c2ccc(CN)nc2C)c1 ZINC000422916772 476844490 /nfs/dbraw/zinc/84/44/90/476844490.db2.gz FACFOUBHCRYAJW-CQSZACIVSA-N 1 3 329.444 2.977 10 0 EFAEHO CC(=O)Nc1cccc(OCCN[C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000422937104 476854598 /nfs/dbraw/zinc/85/45/98/476854598.db2.gz CFTVSNBERNAYQL-SLFFLAALSA-N 1 3 345.487 2.924 10 0 EFAEHO CSC1(C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCC1 ZINC000397605786 476857489 /nfs/dbraw/zinc/85/74/89/476857489.db2.gz PRLQQIRCNZPJJW-UHFFFAOYSA-N 1 3 334.529 2.889 10 0 EFAEHO OC1(CNCc2ccccc2F)CC[NH+](Cc2ccccc2)CC1 ZINC000397589520 476858396 /nfs/dbraw/zinc/85/83/96/476858396.db2.gz JCHPXNVCDCCLSK-UHFFFAOYSA-N 1 3 328.431 2.942 10 0 EFAEHO CC1(C)C[C@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)C(C)(C)O1 ZINC000397602954 476858811 /nfs/dbraw/zinc/85/88/11/476858811.db2.gz VNXOLVNGONPFAC-SFHVURJKSA-N 1 3 346.515 2.949 10 0 EFAEHO CC[C@H](CN[C@@H](c1ccc(OC)cc1)[C@H]1CCC[NH2+]1)N1CCCC1 ZINC000422963394 476867979 /nfs/dbraw/zinc/86/79/79/476867979.db2.gz IKDHANTXZBFXFB-RLLQIKCJSA-N 1 3 331.504 2.952 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@H]1[NH2+]CCCC1(C)C ZINC000398148547 476868521 /nfs/dbraw/zinc/86/85/21/476868521.db2.gz ORDMRAPDUAXRGU-NZSAHSFTSA-N 1 3 343.515 2.791 10 0 EFAEHO NC[C@@H]1CCC[C@H]1[NH2+]C[C@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422991711 476882767 /nfs/dbraw/zinc/88/27/67/476882767.db2.gz QAQFPVDPRVTLEL-IJEWVQPXSA-N 1 3 330.394 2.573 10 0 EFAEHO [NH3+]C[C@@H]1CCC[C@H]1NC[C@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422991711 476882772 /nfs/dbraw/zinc/88/27/72/476882772.db2.gz QAQFPVDPRVTLEL-IJEWVQPXSA-N 1 3 330.394 2.573 10 0 EFAEHO NCC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@@H]2CCc2ccccc2)C1 ZINC000414694285 476886868 /nfs/dbraw/zinc/88/68/68/476886868.db2.gz NASHDASDWBXQHA-WOJBJXKFSA-N 1 3 343.515 2.671 10 0 EFAEHO NCC(=O)N1CCC[C@H](C[N@H+]2CCCC[C@@H]2CCc2ccccc2)C1 ZINC000414694285 476886874 /nfs/dbraw/zinc/88/68/74/476886874.db2.gz NASHDASDWBXQHA-WOJBJXKFSA-N 1 3 343.515 2.671 10 0 EFAEHO NCC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2)C1 ZINC000414741899 476890938 /nfs/dbraw/zinc/89/09/38/476890938.db2.gz LFIYZKWJAQXPFX-YJBOKZPZSA-N 1 3 333.451 2.550 10 0 EFAEHO NCC(=O)N1CCC[C@@H](C[N@H+]2CCCC[C@H]2c2ccc(F)cc2)C1 ZINC000414741899 476890946 /nfs/dbraw/zinc/89/09/46/476890946.db2.gz LFIYZKWJAQXPFX-YJBOKZPZSA-N 1 3 333.451 2.550 10 0 EFAEHO C[C@@H]([NH2+]CCCN1CCCC1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000400730564 476893549 /nfs/dbraw/zinc/89/35/49/476893549.db2.gz QJWMMZDDSHNBFQ-HZPDHXFCSA-N 1 3 325.497 2.707 10 0 EFAEHO C[C@@H]1CNCC[C@H]1[NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000414946660 476894895 /nfs/dbraw/zinc/89/48/95/476894895.db2.gz UQCDMSJTKPJZLD-CXAGYDPISA-N 1 3 335.879 2.532 10 0 EFAEHO COc1cc(Br)ccc1CCCN[C@H]1CCC[C@H]1[NH3+] ZINC000423028344 476896792 /nfs/dbraw/zinc/89/67/92/476896792.db2.gz GDGILZYSMGVVAI-KGLIPLIRSA-N 1 3 327.266 2.860 10 0 EFAEHO CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H]([NH2+]C[C@H]3CCCNC3)C[C@H]2C1 ZINC000401133783 476897938 /nfs/dbraw/zinc/89/79/38/476897938.db2.gz USCPQNNODUTRMM-QAETUUGQSA-N 1 3 337.508 2.611 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@H](C)c1ccc(Br)cc1OC ZINC000423074518 476917237 /nfs/dbraw/zinc/91/72/37/476917237.db2.gz UXQDQCBHVUNKFP-DGCLKSJQSA-N 1 3 345.281 2.862 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@@H](C)c1ccc(Br)cc1F ZINC000423116192 476934456 /nfs/dbraw/zinc/93/44/56/476934456.db2.gz ZVDSOVDKZSIYME-JQWIXIFHSA-N 1 3 333.245 2.993 10 0 EFAEHO C[C@H](NCc1ccc(OC2CC[NH+](C)CC2)cc1)c1cnccc1N ZINC000423109594 476931322 /nfs/dbraw/zinc/93/13/22/476931322.db2.gz SRJZCNGFIFYVTR-HNNXBMFYSA-N 1 3 340.471 2.818 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCN(c2ccccc2F)C1 ZINC000423123134 476936089 /nfs/dbraw/zinc/93/60/89/476936089.db2.gz DFYAPEHRVXZWGL-HOCLYGCPSA-N 1 3 328.435 2.917 10 0 EFAEHO COc1c(C)cc(C[N@@H+]2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1C ZINC000370705764 476943606 /nfs/dbraw/zinc/94/36/06/476943606.db2.gz IYDOAJIVKIVATN-QUCCMNQESA-N 1 3 345.531 2.770 10 0 EFAEHO COc1c(C)cc(C[N@H+]2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1C ZINC000370705764 476943614 /nfs/dbraw/zinc/94/36/14/476943614.db2.gz IYDOAJIVKIVATN-QUCCMNQESA-N 1 3 345.531 2.770 10 0 EFAEHO COc1c(C)cc(CN2CC[C@H]([NH+]3CCN(C)CC3)[C@H](C)C2)cc1C ZINC000370705764 476943616 /nfs/dbraw/zinc/94/36/16/476943616.db2.gz IYDOAJIVKIVATN-QUCCMNQESA-N 1 3 345.531 2.770 10 0 EFAEHO COc1ccc([C@H](CO)CN[C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000423168960 476951771 /nfs/dbraw/zinc/95/17/71/476951771.db2.gz IEUOLTYDRYOSRE-FRYIKTPZSA-N 1 3 332.488 2.672 10 0 EFAEHO Cc1ccnc([C@@H]2CC[N@@H+](CCCN3CCN(C(C)C)CC3)C2)c1 ZINC000408523838 476965120 /nfs/dbraw/zinc/96/51/20/476965120.db2.gz NXNXETVWQVAUNT-LJQANCHMSA-N 1 3 330.520 2.595 10 0 EFAEHO Cc1ccnc([C@@H]2CC[N@H+](CCCN3CCN(C(C)C)CC3)C2)c1 ZINC000408523838 476965125 /nfs/dbraw/zinc/96/51/25/476965125.db2.gz NXNXETVWQVAUNT-LJQANCHMSA-N 1 3 330.520 2.595 10 0 EFAEHO COc1ccc([C@H](NC[C@@H](N)c2ccccc2)[C@@H]2CCC[NH2+]2)cc1 ZINC000423249238 476975702 /nfs/dbraw/zinc/97/57/02/476975702.db2.gz OHLJVSOAATVTSC-AABGKKOBSA-N 1 3 325.456 2.778 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2ccc(NS(C)(=O)=O)cc2)cc1 ZINC000423292717 476984510 /nfs/dbraw/zinc/98/45/10/476984510.db2.gz ODIJSJPZMPGPOQ-ZIAGYGMSSA-N 1 3 347.484 2.929 10 0 EFAEHO C[C@H]1CCC[N@H+](CCCCNC(=O)Nc2ccc3c(c2)CNC3)C1 ZINC000415997328 476984483 /nfs/dbraw/zinc/98/44/83/476984483.db2.gz PAIJWEIPEPIYLD-HNNXBMFYSA-N 1 3 330.476 2.923 10 0 EFAEHO C[C@H]1CCC[N@@H+](CCCCNC(=O)Nc2ccc3c(c2)CNC3)C1 ZINC000415997328 476984490 /nfs/dbraw/zinc/98/44/90/476984490.db2.gz PAIJWEIPEPIYLD-HNNXBMFYSA-N 1 3 330.476 2.923 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)cc1 ZINC000423292714 476985017 /nfs/dbraw/zinc/98/50/17/476985017.db2.gz ODIJSJPZMPGPOQ-KBPBESRZSA-N 1 3 347.484 2.929 10 0 EFAEHO Cc1cc(C)n(-c2ccc(C[NH2+][C@@H]3CCN(C)[C@@H]4CCC[C@H]43)cn2)n1 ZINC000375791642 477007418 /nfs/dbraw/zinc/00/74/18/477007418.db2.gz OVFFCIQINIRWMI-IPMKNSEASA-N 1 3 339.487 2.847 10 0 EFAEHO COc1ccc([C@@H](NCc2ccc3c(c2)CNC3)[C@H]2CCC[NH2+]2)cc1 ZINC000423393124 477015095 /nfs/dbraw/zinc/01/50/95/477015095.db2.gz QLCQFDORVYNKFT-NHCUHLMSSA-N 1 3 337.467 2.881 10 0 EFAEHO CO[C@@]1(CN[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCOC1 ZINC000447598414 477019626 /nfs/dbraw/zinc/01/96/26/477019626.db2.gz HFAAABYKYMEDDE-YSTOQKLRSA-N 1 3 330.472 2.577 10 0 EFAEHO CO[C@@]1(CN[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCOC1 ZINC000447598414 477019634 /nfs/dbraw/zinc/01/96/34/477019634.db2.gz HFAAABYKYMEDDE-YSTOQKLRSA-N 1 3 330.472 2.577 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)CCN2CCc3ccccc3C2)C[C@H]1C ZINC000416153006 477042070 /nfs/dbraw/zinc/04/20/70/477042070.db2.gz ACGHABJZIDEVPF-YLJYHZDGSA-N 1 3 343.515 2.766 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)CCN2CCc3ccccc3C2)C[C@H]1C ZINC000416153006 477042074 /nfs/dbraw/zinc/04/20/74/477042074.db2.gz ACGHABJZIDEVPF-YLJYHZDGSA-N 1 3 343.515 2.766 10 0 EFAEHO FC1(F)CCNC[C@H]1N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000423488738 477046181 /nfs/dbraw/zinc/04/61/81/477046181.db2.gz VPOFURLXLYOJAS-XMTFNYHQSA-N 1 3 335.442 2.769 10 0 EFAEHO FC1(F)CCNC[C@H]1N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000423488738 477046182 /nfs/dbraw/zinc/04/61/82/477046182.db2.gz VPOFURLXLYOJAS-XMTFNYHQSA-N 1 3 335.442 2.769 10 0 EFAEHO C[N@@H+]1CCCC[C@H]1CCC(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000431625721 477064589 /nfs/dbraw/zinc/06/45/89/477064589.db2.gz PMKMULSPHHIFNG-FQEVSTJZSA-N 1 3 343.515 2.985 10 0 EFAEHO C[N@H+]1CCCC[C@H]1CCC(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000431625721 477064593 /nfs/dbraw/zinc/06/45/93/477064593.db2.gz PMKMULSPHHIFNG-FQEVSTJZSA-N 1 3 343.515 2.985 10 0 EFAEHO CN1CCN(c2ccc(N[C@@H]3CC[N@H+](C)[C@@H]4CCC[C@@H]43)cc2)CC1 ZINC000375898266 477069559 /nfs/dbraw/zinc/06/95/59/477069559.db2.gz QSBNEGBXQYBFJO-VAMGGRTRSA-N 1 3 328.504 2.723 10 0 EFAEHO CN1CCN(c2ccc(N[C@@H]3CC[N@@H+](C)[C@@H]4CCC[C@@H]43)cc2)CC1 ZINC000375898266 477069562 /nfs/dbraw/zinc/06/95/62/477069562.db2.gz QSBNEGBXQYBFJO-VAMGGRTRSA-N 1 3 328.504 2.723 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCNC(=O)c2ccc(Cl)cc2)[C@@H]2CCC[C@H]21 ZINC000375898500 477069712 /nfs/dbraw/zinc/06/97/12/477069712.db2.gz UBKAZVVQUKDPKM-YESZJQIVSA-N 1 3 335.879 2.532 10 0 EFAEHO C[N@H+]1CC[C@H](NCCNC(=O)c2ccc(Cl)cc2)[C@@H]2CCC[C@H]21 ZINC000375898500 477069718 /nfs/dbraw/zinc/06/97/18/477069718.db2.gz UBKAZVVQUKDPKM-YESZJQIVSA-N 1 3 335.879 2.532 10 0 EFAEHO CN1CCN(c2ccc(N[C@@H]3CC[N@H+](C)[C@H]4CCC[C@H]43)cc2)CC1 ZINC000375898268 477070003 /nfs/dbraw/zinc/07/00/03/477070003.db2.gz QSBNEGBXQYBFJO-ZCNNSNEGSA-N 1 3 328.504 2.723 10 0 EFAEHO CN1CCN(c2ccc(N[C@@H]3CC[N@@H+](C)[C@H]4CCC[C@H]43)cc2)CC1 ZINC000375898268 477070010 /nfs/dbraw/zinc/07/00/10/477070010.db2.gz QSBNEGBXQYBFJO-ZCNNSNEGSA-N 1 3 328.504 2.723 10 0 EFAEHO CN(C(=O)CCN1CCc2ccccc2C1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000416245872 477090534 /nfs/dbraw/zinc/09/05/34/477090534.db2.gz TXZARRDHICAHRP-YOFSQIOKSA-N 1 3 341.499 2.518 10 0 EFAEHO CN(C(=O)CCN1CCc2ccccc2C1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000416245872 477090537 /nfs/dbraw/zinc/09/05/37/477090537.db2.gz TXZARRDHICAHRP-YOFSQIOKSA-N 1 3 341.499 2.518 10 0 EFAEHO CCn1ccnc1[C@H](C)NCC1([NH+]2CCCCC2)CCN(C)CC1 ZINC000453123836 477173793 /nfs/dbraw/zinc/17/37/93/477173793.db2.gz SJZUZJZUPHEYQE-KRWDZBQOSA-N 1 3 333.524 2.504 10 0 EFAEHO CCn1ccnc1[C@H](C)NCC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000453123836 477173801 /nfs/dbraw/zinc/17/38/01/477173801.db2.gz SJZUZJZUPHEYQE-KRWDZBQOSA-N 1 3 333.524 2.504 10 0 EFAEHO O=C(NC[C@H]1CCCCN1C1CC1)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000434348190 477333980 /nfs/dbraw/zinc/33/39/80/477333980.db2.gz DMSOSYJSQRDCPK-MOPGFXCFSA-N 1 3 348.535 2.663 10 0 EFAEHO C[NH+](C)C1(CNC(=O)NC[C@H](N)c2ccccc2)CCCCCC1 ZINC000416853639 477338815 /nfs/dbraw/zinc/33/88/15/477338815.db2.gz VJHYBUFCENQONP-KRWDZBQOSA-N 1 3 332.492 2.640 10 0 EFAEHO CC1(C)CN(C(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)CCN1 ZINC000416887030 477354377 /nfs/dbraw/zinc/35/43/77/477354377.db2.gz HPNOIRCPJPGUIA-UHFFFAOYSA-N 1 3 344.503 2.566 10 0 EFAEHO C[C@H]1CN(C(=O)NCc2ccccc2C[NH+]2CCCCC2)[C@@H](C)CN1 ZINC000416901857 477361637 /nfs/dbraw/zinc/36/16/37/477361637.db2.gz KOINRFAJGDFUAJ-IRXDYDNUSA-N 1 3 344.503 2.564 10 0 EFAEHO CCCNC(=O)CCNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449084890 477431764 /nfs/dbraw/zinc/43/17/64/477431764.db2.gz JGIMUMPMWJBMEY-QGZVFWFLSA-N 1 3 331.504 2.588 10 0 EFAEHO C[C@H](CN1CCCC1=O)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449089767 477432568 /nfs/dbraw/zinc/43/25/68/477432568.db2.gz LIFVJJCAKVBDSA-MSOLQXFVSA-N 1 3 343.515 2.683 10 0 EFAEHO CC(C)N1CC[C@H]([NH2+]C2CCN([C@H](C)Cc3ccccc3)CC2)C1=O ZINC000449156429 477461549 /nfs/dbraw/zinc/46/15/49/477461549.db2.gz NYSAHROMZLXLDH-XLIONFOSSA-N 1 3 343.515 2.681 10 0 EFAEHO CSC[C@H](CCO)NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449159738 477463776 /nfs/dbraw/zinc/46/37/76/477463776.db2.gz ILRIZPSFTSAVFQ-APWZRJJASA-N 1 3 336.545 2.786 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000376734181 477480101 /nfs/dbraw/zinc/48/01/01/477480101.db2.gz NOXDYSYNOBWTJY-AYHJJNSGSA-N 1 3 336.524 2.519 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000376734181 477480108 /nfs/dbraw/zinc/48/01/08/477480108.db2.gz NOXDYSYNOBWTJY-AYHJJNSGSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@H]([NH2+]C(C)(C)CNC(=O)N1CCN2CCC1CC2)c1ccccc1 ZINC000376764342 477493757 /nfs/dbraw/zinc/49/37/57/477493757.db2.gz MTXHNECIDADPBK-INIZCTEOSA-N 1 3 344.503 2.605 10 0 EFAEHO COCC[C@@H](COC)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449337019 477552953 /nfs/dbraw/zinc/55/29/53/477552953.db2.gz OYTPVFLRSWNNDR-PXNSSMCTSA-N 1 3 334.504 2.723 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cccc(N3CCCC3=O)c2)[C@H]2CCC[C@H]21 ZINC000367612320 477601682 /nfs/dbraw/zinc/60/16/82/477601682.db2.gz ADTDTDKGDFSHHZ-CEXWTWQISA-N 1 3 327.472 2.776 10 0 EFAEHO Cn1c2ccc(F)cc2nc1CCN[C@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000367627166 477609463 /nfs/dbraw/zinc/60/94/63/477609463.db2.gz RYBFILVWUAELMV-ZOBUZTSGSA-N 1 3 330.451 2.717 10 0 EFAEHO Cn1c2ccc(F)cc2nc1CCN[C@H]1CC[N@@H+](C)[C@H]2CCC[C@H]21 ZINC000367627166 477609472 /nfs/dbraw/zinc/60/94/72/477609472.db2.gz RYBFILVWUAELMV-ZOBUZTSGSA-N 1 3 330.451 2.717 10 0 EFAEHO OC[C@H]1CCC[N@@H+]1Cc1ccccc1CN[C@H]1CCCc2n[nH]cc21 ZINC000367640286 477616050 /nfs/dbraw/zinc/61/60/50/477616050.db2.gz ZODVSZCGNDSLPW-MJGOQNOKSA-N 1 3 340.471 2.534 10 0 EFAEHO OC[C@H]1CCC[N@H+]1Cc1ccccc1CN[C@H]1CCCc2n[nH]cc21 ZINC000367640286 477616057 /nfs/dbraw/zinc/61/60/57/477616057.db2.gz ZODVSZCGNDSLPW-MJGOQNOKSA-N 1 3 340.471 2.534 10 0 EFAEHO CC(C)C[C@@H](C[NH+]1CCCC1)NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000458934356 477664641 /nfs/dbraw/zinc/66/46/41/477664641.db2.gz JZNVUVRJIIDCRD-SQNIBIBYSA-N 1 3 338.540 2.621 10 0 EFAEHO COc1ccc([C@H](CN)C[NH2+][C@@]2(CO)C[C@@H](C)CC(C)(C)C2)cc1 ZINC000420304826 477677775 /nfs/dbraw/zinc/67/77/75/477677775.db2.gz ORZIDQMOJQVQAX-VPWXQRGCSA-N 1 3 334.504 2.904 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)N(C)C ZINC000459034439 477709122 /nfs/dbraw/zinc/70/91/22/477709122.db2.gz DFGDVGSAZKOWFU-ZIFCJYIRSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)N(C)C ZINC000459034439 477709128 /nfs/dbraw/zinc/70/91/28/477709128.db2.gz DFGDVGSAZKOWFU-ZIFCJYIRSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1)[NH+](C)C ZINC000459034439 477709135 /nfs/dbraw/zinc/70/91/35/477709135.db2.gz DFGDVGSAZKOWFU-ZIFCJYIRSA-N 1 3 346.519 2.631 10 0 EFAEHO COc1ccc([C@H](C[NH3+])CN[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000420395532 477746432 /nfs/dbraw/zinc/74/64/32/477746432.db2.gz DMJKGBOFRYORLM-HMXCVIKNSA-N 1 3 339.483 2.773 10 0 EFAEHO COc1ccc([C@H](CN)C[NH2+][C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000420395532 477746433 /nfs/dbraw/zinc/74/64/33/477746433.db2.gz DMJKGBOFRYORLM-HMXCVIKNSA-N 1 3 339.483 2.773 10 0 EFAEHO CN1CCC(N2CCC([NH2+]CCCCOc3ccccc3)CC2)CC1 ZINC000438206652 477809597 /nfs/dbraw/zinc/80/95/97/477809597.db2.gz CSORNLGQGJTYNL-UHFFFAOYSA-N 1 3 345.531 2.994 10 0 EFAEHO c1ccc(COC2CC(NC3CC[NH+](C[C@H]4CCOC4)CC3)C2)cc1 ZINC000493900499 477873100 /nfs/dbraw/zinc/87/31/00/477873100.db2.gz MJMJYKPFRXKRGZ-KMFTYDHNSA-N 1 3 344.499 2.825 10 0 EFAEHO CC1CC[NH+](C2CCC(NCc3cn4cccnc4n3)CC2)CC1 ZINC000459444288 477907430 /nfs/dbraw/zinc/90/74/30/477907430.db2.gz FMGZWUWWLQKINH-UHFFFAOYSA-N 1 3 327.476 2.862 10 0 EFAEHO CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCC[NH+]1[C@@H](C)CCC[C@@H]1C ZINC000439310697 477962850 /nfs/dbraw/zinc/96/28/50/477962850.db2.gz VRABCZNQYXZPHQ-FJIDUMEYSA-N 1 3 336.524 2.518 10 0 EFAEHO O=C([C@H]1CCCN1C1CCCC1)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000439845211 478036487 /nfs/dbraw/zinc/03/64/87/478036487.db2.gz YDABXQHJAXVOFD-RTBURBONSA-N 1 3 333.520 2.870 10 0 EFAEHO CCC(C)(C)c1ccc(C(=O)N(CCN(C)C)CC[NH+](C)C)cc1 ZINC000533117893 478042190 /nfs/dbraw/zinc/04/21/90/478042190.db2.gz WXAFETFRCXOCPC-UHFFFAOYSA-N 1 3 333.520 2.940 10 0 EFAEHO CC(C)C[C@H](NCc1cc(Cl)cs1)C(=O)NCC[NH+](C)C ZINC000487560714 478049335 /nfs/dbraw/zinc/04/93/35/478049335.db2.gz QUSMIHSVJGZMHI-AWEZNQCLSA-N 1 3 331.913 2.584 10 0 EFAEHO CC1(C)NC(=O)CC[C@@H]1[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000495031038 478108207 /nfs/dbraw/zinc/10/82/07/478108207.db2.gz REIMIOGDJIBVNM-MOPGFXCFSA-N 1 3 343.515 2.936 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)C[C@H](C)O1 ZINC000560884525 478140187 /nfs/dbraw/zinc/14/01/87/478140187.db2.gz PLUKYFLTHUGEID-DZFIZOCASA-N 1 3 332.488 2.559 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)NC1CCC(C[NH+](C)C)CC1 ZINC000440789885 478160624 /nfs/dbraw/zinc/16/06/24/478160624.db2.gz DFHHUYLJKVIZKT-OQSMONGASA-N 1 3 338.540 2.669 10 0 EFAEHO CN1CCC(O)(C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCCC4)CC1 ZINC000489491824 478251475 /nfs/dbraw/zinc/25/14/75/478251475.db2.gz YORKRKPENQTGGF-LJQANCHMSA-N 1 3 344.499 2.825 10 0 EFAEHO O=C(C1CCN(Cc2ccccc2)CC1)N1CC[C@]2(C1)CCC[NH2+]C2 ZINC000519823908 478265155 /nfs/dbraw/zinc/26/51/55/478265155.db2.gz NZDCXAIPXSJGNL-OAQYLSRUSA-N 1 3 341.499 2.501 10 0 EFAEHO CC(C)(C)[N@@H+]1CCCN(C(=O)CCN2CCc3ccccc3C2)CC1 ZINC000570304693 478332056 /nfs/dbraw/zinc/33/20/56/478332056.db2.gz LNYIVJCMMDCISK-UHFFFAOYSA-N 1 3 343.515 2.768 10 0 EFAEHO CC(C)(C)[N@H+]1CCCN(C(=O)CCN2CCc3ccccc3C2)CC1 ZINC000570304693 478332064 /nfs/dbraw/zinc/33/20/64/478332064.db2.gz LNYIVJCMMDCISK-UHFFFAOYSA-N 1 3 343.515 2.768 10 0 EFAEHO C[C@H]1CN(C(=O)NC2CC([NH+]3CCCCC3)C2)CCN(C2CCC2)C1 ZINC000490349519 478333204 /nfs/dbraw/zinc/33/32/04/478333204.db2.gz ORCNIHBDRJYYHQ-LRYGQEGESA-N 1 3 348.535 2.519 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)Nc2ccc3c(c2)CNCC3)CC1 ZINC000570616445 478399944 /nfs/dbraw/zinc/39/99/44/478399944.db2.gz MRHDIDKLSCHISO-UHFFFAOYSA-N 1 3 330.476 2.576 10 0 EFAEHO CCN1CC[C@@H]([N@H+](C)Cc2ccc(-n3cncn3)c(F)c2)[C@H](C)C1 ZINC000539818236 478443674 /nfs/dbraw/zinc/44/36/74/478443674.db2.gz LLYVFRUEQMGIHG-RHSMWYFYSA-N 1 3 331.439 2.569 10 0 EFAEHO CCN1CC[C@@H]([N@@H+](C)Cc2ccc(-n3cncn3)c(F)c2)[C@H](C)C1 ZINC000539818236 478443679 /nfs/dbraw/zinc/44/36/79/478443679.db2.gz LLYVFRUEQMGIHG-RHSMWYFYSA-N 1 3 331.439 2.569 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CN(C)CCC(=O)NC(C)C)C2)s1 ZINC000563214482 478483137 /nfs/dbraw/zinc/48/31/37/478483137.db2.gz AESRNZMCMNOBSX-MRXNPFEDSA-N 1 3 337.533 2.725 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CN(C)CCC(=O)NC(C)C)C2)s1 ZINC000563214482 478483141 /nfs/dbraw/zinc/48/31/41/478483141.db2.gz AESRNZMCMNOBSX-MRXNPFEDSA-N 1 3 337.533 2.725 10 0 EFAEHO CN(CCC(=O)NCCC[N@H+](C)C1CCCCC1)c1ccncc1 ZINC000540923591 478510061 /nfs/dbraw/zinc/51/00/61/478510061.db2.gz UGWASYPKAGQVQR-UHFFFAOYSA-N 1 3 332.492 2.679 10 0 EFAEHO CN(CCC(=O)NCCC[N@@H+](C)C1CCCCC1)c1ccncc1 ZINC000540923591 478510065 /nfs/dbraw/zinc/51/00/65/478510065.db2.gz UGWASYPKAGQVQR-UHFFFAOYSA-N 1 3 332.492 2.679 10 0 EFAEHO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)CCN(C)c2ccncc2)C1 ZINC000540926945 478512987 /nfs/dbraw/zinc/51/29/87/478512987.db2.gz NTYVRSDIMZFWRA-QGZVFWFLSA-N 1 3 346.519 2.925 10 0 EFAEHO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)CCN(C)c2ccncc2)C1 ZINC000540926945 478512994 /nfs/dbraw/zinc/51/29/94/478512994.db2.gz NTYVRSDIMZFWRA-QGZVFWFLSA-N 1 3 346.519 2.925 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCCC1)NCC1CC[NH+](C2CC2)CC1 ZINC000527881995 478557739 /nfs/dbraw/zinc/55/77/39/478557739.db2.gz PQWYLDVXRWZHEI-LJQANCHMSA-N 1 3 348.535 2.567 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCCC1)NC1CC([NH+]2CCCCC2)C1 ZINC000527891955 478562416 /nfs/dbraw/zinc/56/24/16/478562416.db2.gz FTIMPSOZOKYDSP-AVAKVYKDSA-N 1 3 348.535 2.710 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)CCN(C)c1cc[nH+]cc1 ZINC000582318430 478568665 /nfs/dbraw/zinc/56/86/65/478568665.db2.gz SGNLCTNRXODXRC-UHFFFAOYSA-N 1 3 332.492 2.632 10 0 EFAEHO COC(=O)[C@@H]1C[C@H]1[C@@H](C)[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000594928417 478590990 /nfs/dbraw/zinc/59/09/90/478590990.db2.gz VUVWMWPZUJIUMA-XOKHGSTOSA-N 1 3 336.501 2.747 10 0 EFAEHO CC[N@@H+]1CC[C@H](NC[C@H]2CCN2Cc2ccc(OC)cc2)[C@@H](C)C1 ZINC000527963709 478591069 /nfs/dbraw/zinc/59/10/69/478591069.db2.gz BONWBGDFYJOOKM-HQRMLTQVSA-N 1 3 331.504 2.589 10 0 EFAEHO CC[N@H+]1CC[C@H](NC[C@H]2CCN2Cc2ccc(OC)cc2)[C@@H](C)C1 ZINC000527963709 478591078 /nfs/dbraw/zinc/59/10/78/478591078.db2.gz BONWBGDFYJOOKM-HQRMLTQVSA-N 1 3 331.504 2.589 10 0 EFAEHO COc1ccc(CC[NH2+][C@H](C)c2ccc(OCCN(C)C)cc2)cn1 ZINC000527987961 478601418 /nfs/dbraw/zinc/60/14/18/478601418.db2.gz OUFHHYDAOVZCNH-MRXNPFEDSA-N 1 3 343.471 2.924 10 0 EFAEHO C[C@H](NC(=O)CCN(C)c1ccncc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541893818 478608242 /nfs/dbraw/zinc/60/82/42/478608242.db2.gz KPRBQDBZYPLTKW-DLBZAZTESA-N 1 3 344.503 2.677 10 0 EFAEHO C[C@H](NC(=O)CCN(C)c1ccncc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000541893818 478608248 /nfs/dbraw/zinc/60/82/48/478608248.db2.gz KPRBQDBZYPLTKW-DLBZAZTESA-N 1 3 344.503 2.677 10 0 EFAEHO C[C@@H](CSCCF)[NH2+]CC1CCN(Cc2ccncc2)CC1 ZINC000595069941 478651233 /nfs/dbraw/zinc/65/12/33/478651233.db2.gz TZXNUHXSCRRDJP-HNNXBMFYSA-N 1 3 325.497 2.974 10 0 EFAEHO COC(=O)[C@@H]1C[C@@H]1[C@H](C)[NH2+]C[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000601137643 478681546 /nfs/dbraw/zinc/68/15/46/478681546.db2.gz FSCPQNIESKSGIK-BHEBFOIGSA-N 1 3 330.472 2.542 10 0 EFAEHO CCN(C(=O)N[C@H](C)C[C@H](C)[NH3+])[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000582903659 478715122 /nfs/dbraw/zinc/71/51/22/478715122.db2.gz LVCSOCFGDKDXRX-DODZYUBVSA-N 1 3 346.519 2.979 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C[C@H](O)CC2(O)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000528399744 478753200 /nfs/dbraw/zinc/75/32/00/478753200.db2.gz XJESIPCIYBMHNQ-YZGWKJHDSA-N 1 3 346.515 2.637 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C[C@H](O)CC2(O)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000528399744 478753211 /nfs/dbraw/zinc/75/32/11/478753211.db2.gz XJESIPCIYBMHNQ-YZGWKJHDSA-N 1 3 346.515 2.637 10 0 EFAEHO Cc1noc(CCN[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)n1 ZINC000583066302 478753514 /nfs/dbraw/zinc/75/35/14/478753514.db2.gz CVJVIRAZFSYLLS-GUDVDZBRSA-N 1 3 340.471 2.953 10 0 EFAEHO Cc1noc(CCN[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)n1 ZINC000583066302 478753518 /nfs/dbraw/zinc/75/35/18/478753518.db2.gz CVJVIRAZFSYLLS-GUDVDZBRSA-N 1 3 340.471 2.953 10 0 EFAEHO C[C@@H](CNC(=O)CCN(C)c1cc[nH+]cc1)N(C)Cc1ccccc1 ZINC000543713039 478770632 /nfs/dbraw/zinc/77/06/32/478770632.db2.gz ZXCVYZAIZWUSKC-KRWDZBQOSA-N 1 3 340.471 2.545 10 0 EFAEHO O[C@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)COCC1CC1 ZINC000499144829 478773902 /nfs/dbraw/zinc/77/39/02/478773902.db2.gz DWJRLELQCASLEY-PLACYPQZSA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)COCC1CC1 ZINC000499144829 478773909 /nfs/dbraw/zinc/77/39/09/478773909.db2.gz DWJRLELQCASLEY-PLACYPQZSA-N 1 3 344.499 2.559 10 0 EFAEHO COCCOC[C@H](C)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499255724 478775563 /nfs/dbraw/zinc/77/55/63/478775563.db2.gz ZCMPNZCQNJEBAR-FRYIKTPZSA-N 1 3 332.488 2.823 10 0 EFAEHO COCCOC[C@H](C)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499255724 478775566 /nfs/dbraw/zinc/77/55/66/478775566.db2.gz ZCMPNZCQNJEBAR-FRYIKTPZSA-N 1 3 332.488 2.823 10 0 EFAEHO CC[C@@H]1CCCC[N@@H+]1CCNC(=O)c1ccccc1OCCN(C)C ZINC000499691753 478779542 /nfs/dbraw/zinc/77/95/42/478779542.db2.gz FZLLKNHXBYGNBD-QGZVFWFLSA-N 1 3 347.503 2.621 10 0 EFAEHO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccccc1OCCN(C)C ZINC000499691753 478779546 /nfs/dbraw/zinc/77/95/46/478779546.db2.gz FZLLKNHXBYGNBD-QGZVFWFLSA-N 1 3 347.503 2.621 10 0 EFAEHO CCN1CCC([N@@H+]2CCCN(Cc3c(C)nsc3C)CC2)CC1 ZINC000572300743 478801386 /nfs/dbraw/zinc/80/13/86/478801386.db2.gz KQPXRARDTHNDQJ-UHFFFAOYSA-N 1 3 336.549 2.752 10 0 EFAEHO CCN1CCC([N@H+]2CCCN(Cc3c(C)nsc3C)CC2)CC1 ZINC000572300743 478801395 /nfs/dbraw/zinc/80/13/95/478801395.db2.gz KQPXRARDTHNDQJ-UHFFFAOYSA-N 1 3 336.549 2.752 10 0 EFAEHO CC[NH+]1CCC(N2CCCN(Cc3c(C)nsc3C)CC2)CC1 ZINC000572300743 478801400 /nfs/dbraw/zinc/80/14/00/478801400.db2.gz KQPXRARDTHNDQJ-UHFFFAOYSA-N 1 3 336.549 2.752 10 0 EFAEHO CC(C)OC[C@H](O)CNCc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000564849006 478830972 /nfs/dbraw/zinc/83/09/72/478830972.db2.gz PGEHILLLMQYBHH-HXUWFJFHSA-N 1 3 334.504 2.794 10 0 EFAEHO CCC[NH+]1CCC(NCC2(C(=O)OC(C)(C)C)CCOCC2)CC1 ZINC000592393117 478882241 /nfs/dbraw/zinc/88/22/41/478882241.db2.gz DVPBBFQZQRMMAL-UHFFFAOYSA-N 1 3 340.508 2.589 10 0 EFAEHO CC(C)[NH+]1CCC(NCC2(C(=O)OC(C)(C)C)CCOCC2)CC1 ZINC000592395259 478882287 /nfs/dbraw/zinc/88/22/87/478882287.db2.gz UZLHXIAVQIRWPP-UHFFFAOYSA-N 1 3 340.508 2.587 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)Nc1ccc2c(c1)OCCNC2 ZINC000528717629 478896295 /nfs/dbraw/zinc/89/62/95/478896295.db2.gz FFYGUTCNLOOBFK-GASCZTMLSA-N 1 3 346.475 2.553 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)Nc1ccc2c(c1)OCCNC2 ZINC000528717629 478896301 /nfs/dbraw/zinc/89/63/01/478896301.db2.gz FFYGUTCNLOOBFK-GASCZTMLSA-N 1 3 346.475 2.553 10 0 EFAEHO COC(=O)c1cc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)N3C)n2c1CCCC2 ZINC000598632758 478934499 /nfs/dbraw/zinc/93/44/99/478934499.db2.gz AGOSYLVEYZICOZ-MQVJKMGUSA-N 1 3 345.487 2.716 10 0 EFAEHO COC(=O)[C@@H](C)[C@@H](NCc1cccc2c1CC[NH2+]C2)c1ccccc1 ZINC000595889956 479054062 /nfs/dbraw/zinc/05/40/62/479054062.db2.gz ANANTRLTRSEITN-MGPUTAFESA-N 1 3 338.451 2.972 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)N(C)[C@H]2CCN(C(C)C)C2)CC1 ZINC000573540180 479087473 /nfs/dbraw/zinc/08/74/73/479087473.db2.gz ZIZFRPWXUDWBBG-SFHVURJKSA-N 1 3 344.503 2.548 10 0 EFAEHO c1ncn(-c2cccc(CN[C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)c2)n1 ZINC000569802135 479179912 /nfs/dbraw/zinc/17/99/12/479179912.db2.gz CHUSDMRJDJWFNC-IPMKNSEASA-N 1 3 325.460 2.668 10 0 EFAEHO CCC[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(=O)NC[C@H](C)N(C)C ZINC000529509145 479183357 /nfs/dbraw/zinc/18/33/57/479183357.db2.gz DECOBBPBMJIYCD-QXAKKESOSA-N 1 3 331.504 2.601 10 0 EFAEHO CCC[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)NC[C@H](C)N(C)C ZINC000529509145 479183362 /nfs/dbraw/zinc/18/33/62/479183362.db2.gz DECOBBPBMJIYCD-QXAKKESOSA-N 1 3 331.504 2.601 10 0 EFAEHO COc1cccc([C@@H]2[C@H](N[C@H]3CCC[C@H]([NH3+])C3)CCN2C2CC2)c1 ZINC000569867964 479197377 /nfs/dbraw/zinc/19/73/77/479197377.db2.gz QMLGKHAOBRBNDD-XAMWDVODSA-N 1 3 329.488 2.833 10 0 EFAEHO C[C@H]([NH2+]C(C)(C)CNC(=O)N[C@H]1CCCN(C)C1)c1ccccc1 ZINC000603593564 479410353 /nfs/dbraw/zinc/41/03/53/479410353.db2.gz MLBUGBAQQULUOJ-RDJZCZTQSA-N 1 3 332.492 2.509 10 0 EFAEHO CCC[N@H+](CC)C[C@@H](C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000575633546 479461198 /nfs/dbraw/zinc/46/11/98/479461198.db2.gz SDDRJBYOPMVAQD-NEWSRXKRSA-N 1 3 346.519 2.851 10 0 EFAEHO CCC[N@@H+](CC)C[C@@H](C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000575633546 479461203 /nfs/dbraw/zinc/46/12/03/479461203.db2.gz SDDRJBYOPMVAQD-NEWSRXKRSA-N 1 3 346.519 2.851 10 0 EFAEHO CCCC[NH+]1CCC(NC(=O)N2CCc3ccccc3[C@H]2CN)CC1 ZINC000575745731 479466080 /nfs/dbraw/zinc/46/60/80/479466080.db2.gz KMFCSHSPNYNUTM-LJQANCHMSA-N 1 3 344.503 2.519 10 0 EFAEHO CC[C@@](CN[C@H]1CC[N@H+](C)C(C)(C)C1)(C(=O)OC)c1ccccc1 ZINC000600165024 479555163 /nfs/dbraw/zinc/55/51/63/479555163.db2.gz OOUUPLKLHPQBHE-PXNSSMCTSA-N 1 3 332.488 2.970 10 0 EFAEHO CC[C@@](CN[C@H]1CC[N@@H+](C)C(C)(C)C1)(C(=O)OC)c1ccccc1 ZINC000600165024 479555169 /nfs/dbraw/zinc/55/51/69/479555169.db2.gz OOUUPLKLHPQBHE-PXNSSMCTSA-N 1 3 332.488 2.970 10 0 EFAEHO COC(=O)Cc1ccc(C[NH2+]C2CCN(c3ccncc3)CC2)cc1 ZINC000600185166 479570224 /nfs/dbraw/zinc/57/02/24/479570224.db2.gz NCGBCJSWBZWIFP-UHFFFAOYSA-N 1 3 339.439 2.556 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)Nc2ccccc2NC2CCN(C)CC2)CC[N@@H+]1C ZINC000630899914 479768328 /nfs/dbraw/zinc/76/83/28/479768328.db2.gz WUZUHKXPKXARPJ-QFBILLFUSA-N 1 3 344.503 2.862 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)Nc2ccccc2NC2CCN(C)CC2)CC[N@H+]1C ZINC000630899914 479768335 /nfs/dbraw/zinc/76/83/35/479768335.db2.gz WUZUHKXPKXARPJ-QFBILLFUSA-N 1 3 344.503 2.862 10 0 EFAEHO CCN1CCN(CCCC[NH2+]Cc2ccc(C(F)F)nc2)CC1 ZINC000631041377 479852404 /nfs/dbraw/zinc/85/24/04/479852404.db2.gz IMQFQUIRCOHQEY-UHFFFAOYSA-N 1 3 326.435 2.527 10 0 EFAEHO O[C@@H]1CC[N@H+](Cc2ccc(CN[C@H]3CCCc4ncccc43)cc2)C1 ZINC000631647173 480197931 /nfs/dbraw/zinc/19/79/31/480197931.db2.gz QBSCCHLVIOUBLX-NQIIRXRSSA-N 1 3 337.467 2.815 10 0 EFAEHO O[C@@H]1CC[N@@H+](Cc2ccc(CN[C@H]3CCCc4ncccc43)cc2)C1 ZINC000631647173 480197933 /nfs/dbraw/zinc/19/79/33/480197933.db2.gz QBSCCHLVIOUBLX-NQIIRXRSSA-N 1 3 337.467 2.815 10 0 EFAEHO C[C@@H](N[C@@H](C)c1ccc(OCC[NH+](C)C)cc1)[C@H](O)C(F)(F)F ZINC000631716744 480235508 /nfs/dbraw/zinc/23/55/08/480235508.db2.gz BXENEBYLTJLDPJ-ZOWXZIJZSA-N 1 3 334.382 2.589 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@@H](c2ccc(F)cc2)N2CCOCC2)CC1(C)C ZINC000623337957 480239504 /nfs/dbraw/zinc/23/95/04/480239504.db2.gz DGVRCFPGTKCNTP-OALUTQOASA-N 1 3 349.494 2.661 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000620817635 480244186 /nfs/dbraw/zinc/24/41/86/480244186.db2.gz JOXXQCGJGIXHTQ-QGZVFWFLSA-N 1 3 338.540 2.624 10 0 EFAEHO C[C@@H](Cc1ccc(Br)cc1F)NCC1([NH3+])CCOCC1 ZINC000629389503 480244985 /nfs/dbraw/zinc/24/49/85/480244985.db2.gz YXMPOZFDHDLKHS-NSHDSACASA-N 1 3 345.256 2.617 10 0 EFAEHO CCC(CC)[C@H](CN[C@H]1CC[N@H+](C)C(C)(C)C1)N1CCOCC1 ZINC000623353431 480245179 /nfs/dbraw/zinc/24/51/79/480245179.db2.gz LGSXYWUMSRPFBH-ROUUACIJSA-N 1 3 325.541 2.586 10 0 EFAEHO CCC(CC)[C@H](CN[C@H]1CC[N@@H+](C)C(C)(C)C1)N1CCOCC1 ZINC000623353431 480245184 /nfs/dbraw/zinc/24/51/84/480245184.db2.gz LGSXYWUMSRPFBH-ROUUACIJSA-N 1 3 325.541 2.586 10 0 EFAEHO C[C@H](CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1cccc(F)c1 ZINC000617505683 480246960 /nfs/dbraw/zinc/24/69/60/480246960.db2.gz MPNXTLBIBBRZHM-CVEARBPZSA-N 1 3 337.483 2.708 10 0 EFAEHO C[C@H](CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1cccc(F)c1 ZINC000617505683 480246963 /nfs/dbraw/zinc/24/69/63/480246963.db2.gz MPNXTLBIBBRZHM-CVEARBPZSA-N 1 3 337.483 2.708 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1c[nH]cc1-c1ccccc1 ZINC000617505281 480246991 /nfs/dbraw/zinc/24/69/91/480246991.db2.gz ZVAMKKQGEJKWIY-INIZCTEOSA-N 1 3 342.487 2.684 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1c[nH]cc1-c1ccccc1 ZINC000617505281 480246995 /nfs/dbraw/zinc/24/69/95/480246995.db2.gz ZVAMKKQGEJKWIY-INIZCTEOSA-N 1 3 342.487 2.684 10 0 EFAEHO C[C@H](CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccccc1F ZINC000617504769 480247493 /nfs/dbraw/zinc/24/74/93/480247493.db2.gz JUFVDAXVHREPMO-CVEARBPZSA-N 1 3 337.483 2.708 10 0 EFAEHO C[C@H](CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccccc1F ZINC000617504769 480247497 /nfs/dbraw/zinc/24/74/97/480247497.db2.gz JUFVDAXVHREPMO-CVEARBPZSA-N 1 3 337.483 2.708 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C1(c2cccc(F)c2)CCC1 ZINC000617504299 480247638 /nfs/dbraw/zinc/24/76/38/480247638.db2.gz OVIDMYGWAQMANY-INIZCTEOSA-N 1 3 349.494 2.636 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C1(c2cccc(F)c2)CCC1 ZINC000617504299 480247646 /nfs/dbraw/zinc/24/76/46/480247646.db2.gz OVIDMYGWAQMANY-INIZCTEOSA-N 1 3 349.494 2.636 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(-c2ccccc2)[nH]1 ZINC000617505478 480248482 /nfs/dbraw/zinc/24/84/82/480248482.db2.gz DQFOPOOEPBSMEH-INIZCTEOSA-N 1 3 342.487 2.684 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(-c2ccccc2)[nH]1 ZINC000617505478 480248490 /nfs/dbraw/zinc/24/84/90/480248490.db2.gz DQFOPOOEPBSMEH-INIZCTEOSA-N 1 3 342.487 2.684 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1coc2cc(F)ccc12 ZINC000617507244 480249953 /nfs/dbraw/zinc/24/99/53/480249953.db2.gz NWJCYCXQZFUDRZ-ZDUSSCGKSA-N 1 3 335.423 2.574 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1coc2cc(F)ccc12 ZINC000617507244 480249955 /nfs/dbraw/zinc/24/99/55/480249955.db2.gz NWJCYCXQZFUDRZ-ZDUSSCGKSA-N 1 3 335.423 2.574 10 0 EFAEHO CCc1ccc2occ(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c2c1 ZINC000617507591 480250419 /nfs/dbraw/zinc/25/04/19/480250419.db2.gz BKNOORXHENMMOE-HNNXBMFYSA-N 1 3 345.487 2.997 10 0 EFAEHO CCc1ccc2occ(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c2c1 ZINC000617507591 480250425 /nfs/dbraw/zinc/25/04/25/480250425.db2.gz BKNOORXHENMMOE-HNNXBMFYSA-N 1 3 345.487 2.997 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cc2cc(F)ccc2o1 ZINC000617505962 480251629 /nfs/dbraw/zinc/25/16/29/480251629.db2.gz WKOIHGIGIGNTSL-ZDUSSCGKSA-N 1 3 335.423 2.574 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cc2cc(F)ccc2o1 ZINC000617505962 480251633 /nfs/dbraw/zinc/25/16/33/480251633.db2.gz WKOIHGIGIGNTSL-ZDUSSCGKSA-N 1 3 335.423 2.574 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cccc2ccsc21 ZINC000617507253 480251814 /nfs/dbraw/zinc/25/18/14/480251814.db2.gz OFMXEABGCQDRCN-AWEZNQCLSA-N 1 3 333.501 2.903 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cccc2ccsc21 ZINC000617507253 480251819 /nfs/dbraw/zinc/25/18/19/480251819.db2.gz OFMXEABGCQDRCN-AWEZNQCLSA-N 1 3 333.501 2.903 10 0 EFAEHO CN1CC[C@@H]([NH2+]Cc2ccc(CN3CCCC3=O)cc2)CC1(C)C ZINC000623370366 480254444 /nfs/dbraw/zinc/25/44/44/480254444.db2.gz HTRRNHNZAWTNCY-GOSISDBHSA-N 1 3 329.488 2.771 10 0 EFAEHO COc1ccc(CCN[C@H]2CC[N@H+](C)C(C)(C)C2)c(OC)c1OC ZINC000623398593 480264143 /nfs/dbraw/zinc/26/41/43/480264143.db2.gz KFNYMMRRZQILBH-HNNXBMFYSA-N 1 3 336.476 2.717 10 0 EFAEHO COc1ccc(CCN[C@H]2CC[N@@H+](C)C(C)(C)C2)c(OC)c1OC ZINC000623398593 480264150 /nfs/dbraw/zinc/26/41/50/480264150.db2.gz KFNYMMRRZQILBH-HNNXBMFYSA-N 1 3 336.476 2.717 10 0 EFAEHO CC[C@@H]1CN(C)CCCN1C(=O)C1CCN(c2cc[nH+]cc2C)CC1 ZINC000614332655 480270828 /nfs/dbraw/zinc/27/08/28/480270828.db2.gz XERGLVVZTQEVLS-GOSISDBHSA-N 1 3 344.503 2.549 10 0 EFAEHO C[C@H](N[C@H]1CC[N@H+](C)C(C)(C)C1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000623429230 480280703 /nfs/dbraw/zinc/28/07/03/480280703.db2.gz UBQXPIWFIOQQRL-IHPCNDPISA-N 1 3 345.531 2.738 10 0 EFAEHO C[C@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000623429230 480280711 /nfs/dbraw/zinc/28/07/11/480280711.db2.gz UBQXPIWFIOQQRL-IHPCNDPISA-N 1 3 345.531 2.738 10 0 EFAEHO C[C@@H](NC(=O)[C@H](C)N1CCC([C@@H]2CC[NH2+]C2)CC1)c1ccccc1 ZINC000631826015 480286852 /nfs/dbraw/zinc/28/68/52/480286852.db2.gz BKRZYUYGIKZLKA-JTDSTZFVSA-N 1 3 329.488 2.574 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCC([C@@H]2CC[NH2+]C2)CC1)c1ccccc1 ZINC000631826014 480287321 /nfs/dbraw/zinc/28/73/21/480287321.db2.gz BKRZYUYGIKZLKA-GPMSIDNRSA-N 1 3 329.488 2.574 10 0 EFAEHO NC1(C[NH2+][C@H]2CCc3ccc(Br)cc32)CCOCC1 ZINC000629520990 480292534 /nfs/dbraw/zinc/29/25/34/480292534.db2.gz NQMSJCJKBUWYDG-AWEZNQCLSA-N 1 3 325.250 2.534 10 0 EFAEHO CC[C@H](NCCOCC[NH2+]C)c1cc(F)cc(Br)c1 ZINC000629530176 480296013 /nfs/dbraw/zinc/29/60/13/480296013.db2.gz XNMVMGVQUKNMAP-AWEZNQCLSA-N 1 3 333.245 2.865 10 0 EFAEHO C[NH2+]CCOCCN[C@@H]1CCCc2ccc(Br)cc21 ZINC000629529962 480296047 /nfs/dbraw/zinc/29/60/47/480296047.db2.gz RKNWGKYGXUCXEY-OAHLLOKOSA-N 1 3 327.266 2.652 10 0 EFAEHO C[NH2+]CCOCCN[C@@H]1CCc2cc(Br)cc(C)c21 ZINC000629530869 480296618 /nfs/dbraw/zinc/29/66/18/480296618.db2.gz TXEDVZMFCBNLOB-CQSZACIVSA-N 1 3 327.266 2.570 10 0 EFAEHO CCOCCN(C[C@@H]1CCC2(C[NH2+]C2)O1)[C@@H]1CCc2ccccc21 ZINC000629573315 480313142 /nfs/dbraw/zinc/31/31/42/480313142.db2.gz FBQDSECLLVCPPK-PKOBYXMFSA-N 1 3 330.472 2.533 10 0 EFAEHO CCOCC[N@H+](C[C@@H]1CCC2(CNC2)O1)[C@@H]1CCc2ccccc21 ZINC000629573315 480313148 /nfs/dbraw/zinc/31/31/48/480313148.db2.gz FBQDSECLLVCPPK-PKOBYXMFSA-N 1 3 330.472 2.533 10 0 EFAEHO CCOCC[N@@H+](C[C@@H]1CCC2(CNC2)O1)[C@@H]1CCc2ccccc21 ZINC000629573315 480313154 /nfs/dbraw/zinc/31/31/54/480313154.db2.gz FBQDSECLLVCPPK-PKOBYXMFSA-N 1 3 330.472 2.533 10 0 EFAEHO Cc1cc(C)cc(OCCN2CCC(CO[C@H]3CC[NH2+]C3)CC2)c1 ZINC000629590457 480320400 /nfs/dbraw/zinc/32/04/00/480320400.db2.gz CCAIOKZIQUBOPZ-IBGZPJMESA-N 1 3 332.488 2.773 10 0 EFAEHO O[C@@H](CNCCc1c[nH]c2cc(F)c(Cl)cc12)C[NH+]1CCCC1 ZINC000629613200 480333238 /nfs/dbraw/zinc/33/32/38/480333238.db2.gz KTTIIOHDVAPWIB-ZDUSSCGKSA-N 1 3 339.842 2.549 10 0 EFAEHO CNC(=O)[C@@H](CN[C@H]1CC[N@H+](C)C(C)(C)C1)Cc1ccc(F)cc1C ZINC000623556643 480339753 /nfs/dbraw/zinc/33/97/53/480339753.db2.gz QZCNMJJVZQUXLF-AEFFLSMTSA-N 1 3 349.494 2.501 10 0 EFAEHO CNC(=O)[C@@H](CN[C@H]1CC[N@@H+](C)C(C)(C)C1)Cc1ccc(F)cc1C ZINC000623556643 480339755 /nfs/dbraw/zinc/33/97/55/480339755.db2.gz QZCNMJJVZQUXLF-AEFFLSMTSA-N 1 3 349.494 2.501 10 0 EFAEHO COc1ccccc1-c1ccc(C[NH2+]CC2(N)CCOCC2)cc1 ZINC000629655266 480344854 /nfs/dbraw/zinc/34/48/54/480344854.db2.gz UWUPITCBASCEND-UHFFFAOYSA-N 1 3 326.440 2.960 10 0 EFAEHO C[C@](O)(C[C@@H](O)CNCc1ccc(C[NH+]2CCCCC2)cc1)C1CC1 ZINC000634639801 480389785 /nfs/dbraw/zinc/38/97/85/480389785.db2.gz PHOXMWIGOMOKHX-RTWAWAEBSA-N 1 3 346.515 2.674 10 0 EFAEHO CCN(C(=O)c1ccc(Nc2ccncc2)cc1)[C@@H]1CC[N@H+](CC)C1 ZINC000617927835 480423156 /nfs/dbraw/zinc/42/31/56/480423156.db2.gz DGNFNOZXWZGJMK-LJQANCHMSA-N 1 3 338.455 2.803 10 0 EFAEHO CCN(C(=O)c1ccc(Nc2ccncc2)cc1)[C@@H]1CC[N@@H+](CC)C1 ZINC000617927835 480423166 /nfs/dbraw/zinc/42/31/66/480423166.db2.gz DGNFNOZXWZGJMK-LJQANCHMSA-N 1 3 338.455 2.803 10 0 EFAEHO CN(c1ccccc1CN[C@@H]1CO[C@@H](C2CC2)C1)C1CC[NH+](C)CC1 ZINC000623752784 480438189 /nfs/dbraw/zinc/43/81/89/480438189.db2.gz LDWDJTPJZZVMIL-GHTZIAJQSA-N 1 3 343.515 2.874 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CCN1CCN(CC2CCSCC2)CC1 ZINC000637984103 480438537 /nfs/dbraw/zinc/43/85/37/480438537.db2.gz BKYSWILMGBXMPA-IAGOWNOFSA-N 1 3 325.566 2.620 10 0 EFAEHO C[C@@](O)(C[C@H](O)CNCc1ccccc1C[NH+]1CCCCC1)C1CC1 ZINC000634698802 480439178 /nfs/dbraw/zinc/43/91/78/480439178.db2.gz YORGRYPIOYEOCV-LEWJYISDSA-N 1 3 346.515 2.674 10 0 EFAEHO C[N@@H+]1CCC[C@H](CCNCc2ccnn2CCc2ccccc2)C1 ZINC000621362013 480473699 /nfs/dbraw/zinc/47/36/99/480473699.db2.gz NTJKRUSIQSAUMT-LJQANCHMSA-N 1 3 326.488 2.947 10 0 EFAEHO C[N@H+]1CCC[C@H](CCNCc2ccnn2CCc2ccccc2)C1 ZINC000621362013 480473707 /nfs/dbraw/zinc/47/37/07/480473707.db2.gz NTJKRUSIQSAUMT-LJQANCHMSA-N 1 3 326.488 2.947 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(CN2CCC(O)CC2)cc1)[C@@H]1CCCCO1 ZINC000623888366 480504166 /nfs/dbraw/zinc/50/41/66/480504166.db2.gz DHGOVYWZESYCDJ-JXFKEZNVSA-N 1 3 332.488 2.691 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](NC[C@@H]2Cc3ccccc3CO2)[C@H](C)C1 ZINC000624054665 480585528 /nfs/dbraw/zinc/58/55/28/480585528.db2.gz JYQHUAUVZZHMRW-JRGCBEDISA-N 1 3 346.515 2.855 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](NC[C@@H]2Cc3ccccc3CO2)[C@H](C)C1 ZINC000624054665 480585532 /nfs/dbraw/zinc/58/55/32/480585532.db2.gz JYQHUAUVZZHMRW-JRGCBEDISA-N 1 3 346.515 2.855 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)N[C@@H]2CC[C@@H](C)[NH2+]C2)CC1 ZINC000626980655 480608882 /nfs/dbraw/zinc/60/88/82/480608882.db2.gz VDWYGNRUEQZEEJ-GPMSIDNRSA-N 1 3 344.503 2.652 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCC1)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000624374753 480735432 /nfs/dbraw/zinc/73/54/32/480735432.db2.gz ZGTFTLUKMQZGDE-VQIMIIECSA-N 1 3 348.535 2.710 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCC1)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000624374753 480735438 /nfs/dbraw/zinc/73/54/38/480735438.db2.gz ZGTFTLUKMQZGDE-VQIMIIECSA-N 1 3 348.535 2.710 10 0 EFAEHO CCCN(C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)[C@@H]1CC[N@H+](C)C1 ZINC000645395436 480824708 /nfs/dbraw/zinc/82/47/08/480824708.db2.gz STWGFQUYGDDVEM-GUDVDZBRSA-N 1 3 344.503 2.558 10 0 EFAEHO CCCN(C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)[C@@H]1CC[N@@H+](C)C1 ZINC000645395436 480824713 /nfs/dbraw/zinc/82/47/13/480824713.db2.gz STWGFQUYGDDVEM-GUDVDZBRSA-N 1 3 344.503 2.558 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NC[C@H](C)N2CCC[C@@H](C)C2)CC1 ZINC000632995881 480840736 /nfs/dbraw/zinc/84/07/36/480840736.db2.gz HWSYFKWHBCSYMJ-SJORKVTESA-N 1 3 338.540 2.623 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)CC1 ZINC000632995879 480840765 /nfs/dbraw/zinc/84/07/65/480840765.db2.gz HWSYFKWHBCSYMJ-IAGOWNOFSA-N 1 3 338.540 2.623 10 0 EFAEHO [NH3+][C@@H]1CC[C@@H](C(=O)N[C@H]2CCCCCN(Cc3ccccc3)C2)C1 ZINC000638850862 480895622 /nfs/dbraw/zinc/89/56/22/480895622.db2.gz HRAKUIVKJIAKFJ-QRVBRYPASA-N 1 3 329.488 2.675 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2CC[C@H]([NH3+])[C@H](CC)C2)CC1 ZINC000647497389 480968478 /nfs/dbraw/zinc/96/84/78/480968478.db2.gz FMRGAPFQAVDETH-QUCCMNQESA-N 1 3 344.547 2.778 10 0 EFAEHO CCN1CCC([N@@H+]2CCCN(CCc3ncc(C)cc3C)CC2)CC1 ZINC000645929069 480971018 /nfs/dbraw/zinc/97/10/18/480971018.db2.gz KSJDHNHBOPOPHM-UHFFFAOYSA-N 1 3 344.547 2.733 10 0 EFAEHO CCN1CCC([N@H+]2CCCN(CCc3ncc(C)cc3C)CC2)CC1 ZINC000645929069 480971022 /nfs/dbraw/zinc/97/10/22/480971022.db2.gz KSJDHNHBOPOPHM-UHFFFAOYSA-N 1 3 344.547 2.733 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2CCC(C)([NH3+])CC2)CC1 ZINC000647530762 480983961 /nfs/dbraw/zinc/98/39/61/480983961.db2.gz DIPGAUHPCWCYKM-UHFFFAOYSA-N 1 3 330.520 2.532 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000661401142 480988554 /nfs/dbraw/zinc/98/85/54/480988554.db2.gz ABCYKCFLLKONTI-KBAYOESNSA-N 1 3 348.535 2.518 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000661401142 480988557 /nfs/dbraw/zinc/98/85/57/480988557.db2.gz ABCYKCFLLKONTI-KBAYOESNSA-N 1 3 348.535 2.518 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647542701 480989739 /nfs/dbraw/zinc/98/97/39/480989739.db2.gz ACWKTCJGSDHVGJ-MSOLQXFVSA-N 1 3 339.487 2.787 10 0 EFAEHO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(CC)[C@H]2CCN(C)C2)C1 ZINC000664073129 481004700 /nfs/dbraw/zinc/00/47/00/481004700.db2.gz NNBSJOJVMRNDBE-IRXDYDNUSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)N(CC)[C@H]2CCN(C)C2)C1 ZINC000664073129 481004707 /nfs/dbraw/zinc/00/47/07/481004707.db2.gz NNBSJOJVMRNDBE-IRXDYDNUSA-N 1 3 338.540 2.623 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)N(C)CCN2CCCCC2)CC1 ZINC000652990413 481014759 /nfs/dbraw/zinc/01/47/59/481014759.db2.gz SKLMKVXTVJEHKM-UHFFFAOYSA-N 1 3 344.503 2.551 10 0 EFAEHO Cc1cccc(C2(NCC(=O)NC3CC[NH+](C(C)C)CC3)CCC2)c1 ZINC000646021514 481026751 /nfs/dbraw/zinc/02/67/51/481026751.db2.gz HCBLNHZNLSWZIO-UHFFFAOYSA-N 1 3 343.515 2.953 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[NH2+][C@H](C)c1ccccc1)[C@H]1CCN(C)C1 ZINC000664109575 481027483 /nfs/dbraw/zinc/02/74/83/481027483.db2.gz QMWWBTCKFPRORC-AEFFLSMTSA-N 1 3 346.519 2.851 10 0 EFAEHO CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2ccccc2CC[NH3+])C1 ZINC000653122467 481093169 /nfs/dbraw/zinc/09/31/69/481093169.db2.gz XGDLSDQHEKLQIM-IBGZPJMESA-N 1 3 337.467 2.534 10 0 EFAEHO CC[NH+]1CCC(NC(=O)CNC2(c3ccc(C)cc3)CCC2)CC1 ZINC000646132085 481108873 /nfs/dbraw/zinc/10/88/73/481108873.db2.gz PYOGHVULYHGKPA-UHFFFAOYSA-N 1 3 329.488 2.564 10 0 EFAEHO C[NH+](C)CCc1ccccc1NC(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000666839716 481138921 /nfs/dbraw/zinc/13/89/21/481138921.db2.gz FODHFFSCRUDJPQ-INIZCTEOSA-N 1 3 332.492 2.785 10 0 EFAEHO O=C(CN1CC[C@H](C2CCCCC2)C1)NC1CC[NH+](C2CC2)CC1 ZINC000661587251 481149691 /nfs/dbraw/zinc/14/96/91/481149691.db2.gz YTKKBNWKLBYBBB-KRWDZBQOSA-N 1 3 333.520 2.632 10 0 EFAEHO C[C@@H]1C[NH2+]CC[C@@H]1NC(=O)N[C@@H](CN1CCCCC1)c1ccccc1 ZINC000669483901 481152384 /nfs/dbraw/zinc/15/23/84/481152384.db2.gz RWTISHJLVRDHAC-NEWSRXKRSA-N 1 3 344.503 2.511 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)N[C@@H]2C[NH2+]CC[C@H]2C)CC1 ZINC000669486868 481154362 /nfs/dbraw/zinc/15/43/62/481154362.db2.gz IBOZVSOFDCDFSE-GPMSIDNRSA-N 1 3 344.503 2.509 10 0 EFAEHO O=C(CCN1CCC[C@@H]([C@H]2CCC[NH2+]2)C1)NCc1ccccc1Cl ZINC000647901637 481168131 /nfs/dbraw/zinc/16/81/31/481168131.db2.gz SCERZAWDNNTQIE-SJLPKXTDSA-N 1 3 349.906 2.810 10 0 EFAEHO CC(C)c1csc(NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)n1 ZINC000664314950 481170752 /nfs/dbraw/zinc/17/07/52/481170752.db2.gz OYEQUNOEPNTFSF-ZDUSSCGKSA-N 1 3 341.525 2.660 10 0 EFAEHO CC(C)c1csc(NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)n1 ZINC000664314950 481170758 /nfs/dbraw/zinc/17/07/58/481170758.db2.gz OYEQUNOEPNTFSF-ZDUSSCGKSA-N 1 3 341.525 2.660 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccc(Cl)cc1 ZINC000664316058 481171998 /nfs/dbraw/zinc/17/19/98/481171998.db2.gz ZTMFRSWIPWVMDN-ZDUSSCGKSA-N 1 3 326.872 2.734 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccc(Cl)cc1 ZINC000664316058 481172007 /nfs/dbraw/zinc/17/20/07/481172007.db2.gz ZTMFRSWIPWVMDN-ZDUSSCGKSA-N 1 3 326.872 2.734 10 0 EFAEHO C[NH+]1CCC2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)CC1 ZINC000646248928 481182117 /nfs/dbraw/zinc/18/21/17/481182117.db2.gz WOOXMWCOSPQFDA-IBGZPJMESA-N 1 3 341.499 2.595 10 0 EFAEHO CC1(C)CC[N@H+](CC(=O)NC2CCN(C3CC3)CC2)CC(C)(C)C1 ZINC000661626463 481185185 /nfs/dbraw/zinc/18/51/85/481185185.db2.gz JSEJPAQBUBFDKB-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO CC1(C)CC[N@@H+](CC(=O)NC2CCN(C3CC3)CC2)CC(C)(C)C1 ZINC000661626463 481185194 /nfs/dbraw/zinc/18/51/94/481185194.db2.gz JSEJPAQBUBFDKB-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO COc1cc(Br)ccc1CN[C@@H]1CC12CC[NH2+]CC2 ZINC000666952346 481216524 /nfs/dbraw/zinc/21/65/24/481216524.db2.gz SDVUZBWOQZWRCY-CQSZACIVSA-N 1 3 325.250 2.689 10 0 EFAEHO COc1sc(CN[C@@H]2CC23CC[NH2+]CC3)cc1Br ZINC000666952026 481216740 /nfs/dbraw/zinc/21/67/40/481216740.db2.gz CDWZOSYZAFNPHW-LLVKDONJSA-N 1 3 331.279 2.751 10 0 EFAEHO Cc1cc(Br)cn2c(CN[C@@H]3CC34CC[NH2+]CC4)cnc12 ZINC000666953582 481217149 /nfs/dbraw/zinc/21/71/49/481217149.db2.gz BMGJBBHIRLGBLA-CQSZACIVSA-N 1 3 349.276 2.637 10 0 EFAEHO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCN(Cc3cc(-c4ccccc4)n[nH]3)C2)C1 ZINC000650706636 481276323 /nfs/dbraw/zinc/27/63/23/481276323.db2.gz OVUGWSKSTWULED-MBOZVWFJSA-N 1 3 340.471 2.795 10 0 EFAEHO [NH3+]CC1(CCNCc2cn(-c3cccc(Cl)c3Cl)nn2)CC1 ZINC000650713079 481282301 /nfs/dbraw/zinc/28/23/01/481282301.db2.gz DOVSLAZJARDWKM-UHFFFAOYSA-N 1 3 340.258 2.793 10 0 EFAEHO [NH3+]CC1(CCNCc2cn(-c3ccc(Cl)c(Cl)c3)nn2)CC1 ZINC000650714333 481283331 /nfs/dbraw/zinc/28/33/31/481283331.db2.gz ZCESVRNCZMFIDQ-UHFFFAOYSA-N 1 3 340.258 2.793 10 0 EFAEHO CCOc1ccc(CN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)cc1OC ZINC000650722046 481288733 /nfs/dbraw/zinc/28/87/33/481288733.db2.gz JILDBCPKVPKGPR-ZHALLVOQSA-N 1 3 348.487 2.955 10 0 EFAEHO COCCOc1cccc(CN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)c1 ZINC000650722301 481288772 /nfs/dbraw/zinc/28/87/72/481288772.db2.gz OYIJHFOICVYZKD-RLLQIKCJSA-N 1 3 348.487 2.573 10 0 EFAEHO COc1cccc(CN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)c1OC ZINC000650722550 481288833 /nfs/dbraw/zinc/28/88/33/481288833.db2.gz WIWMQBVCORZBFP-JFIYKMOQSA-N 1 3 334.460 2.565 10 0 EFAEHO CCOc1cc(CN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)ccc1OC ZINC000650722608 481289820 /nfs/dbraw/zinc/28/98/20/481289820.db2.gz XVHKYALLGJKUOH-LMMKCTJWSA-N 1 3 348.487 2.955 10 0 EFAEHO COc1cc(CN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)cc(OC)c1 ZINC000650722629 481289905 /nfs/dbraw/zinc/28/99/05/481289905.db2.gz YFRLSIKBFYEUIZ-ATZDWAIDSA-N 1 3 334.460 2.565 10 0 EFAEHO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCCN2Cc2cc(-c3ccccc3)n[nH]2)C1 ZINC000650723125 481292510 /nfs/dbraw/zinc/29/25/10/481292510.db2.gz HRJFLFXEHHBVGZ-UXPWSPDFSA-N 1 3 340.471 2.938 10 0 EFAEHO COc1cc(C)c(CN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)cc1OC ZINC000650723885 481292546 /nfs/dbraw/zinc/29/25/46/481292546.db2.gz VJGNOBKSQVZOCB-KSZLIROESA-N 1 3 348.487 2.873 10 0 EFAEHO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCCN2Cc2cc(-c3ccccc3)n[nH]2)C1 ZINC000650723123 481293099 /nfs/dbraw/zinc/29/30/99/481293099.db2.gz HRJFLFXEHHBVGZ-LSTHTHJFSA-N 1 3 340.471 2.938 10 0 EFAEHO CC[NH+](CC)[C@@H](CNC(=O)C1(N)CC2(CCC2)C1)c1ccccc1 ZINC000659249425 481306922 /nfs/dbraw/zinc/30/69/22/481306922.db2.gz RXYVEGQEGHHYHM-KRWDZBQOSA-N 1 3 329.488 2.847 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000664539158 481317018 /nfs/dbraw/zinc/31/70/18/481317018.db2.gz CXBHWWUYYUCQOU-ZWKOTPCHSA-N 1 3 346.519 2.851 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000664539158 481317022 /nfs/dbraw/zinc/31/70/22/481317022.db2.gz CXBHWWUYYUCQOU-ZWKOTPCHSA-N 1 3 346.519 2.851 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@H](C)c1cccc(NS(C)(=O)=O)c1 ZINC000650758866 481321379 /nfs/dbraw/zinc/32/13/79/481321379.db2.gz ZVHMQVACNLWIIP-CQSZACIVSA-N 1 3 347.484 2.628 10 0 EFAEHO c1ccc2c(c1)CC[C@H](CCN[C@@H]1CCOC[C@H]1[C@@H]1CCC[NH2+]1)N2 ZINC000650759023 481321571 /nfs/dbraw/zinc/32/15/71/481321571.db2.gz BJYKTRRLILWGTI-LCLWPZTBSA-N 1 3 329.488 2.550 10 0 EFAEHO C[NH+](C)CCCOc1cccc(NC(=O)C2(N)CC3(CCC3)C2)c1 ZINC000659284848 481334944 /nfs/dbraw/zinc/33/49/44/481334944.db2.gz OTWZJROTRYSFLB-UHFFFAOYSA-N 1 3 331.460 2.617 10 0 EFAEHO C[C@H]([NH3+])c1ccc(NC(=O)C(C[C@@H]2COCCO2)C(F)(F)F)cc1 ZINC000659295291 481344565 /nfs/dbraw/zinc/34/45/65/481344565.db2.gz WGWCDRVGQOJQAK-GDLCADMTSA-N 1 3 346.349 2.629 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000659465734 481451982 /nfs/dbraw/zinc/45/19/82/481451982.db2.gz RHBIFPYNAPELJY-QXAKKESOSA-N 1 3 346.519 2.712 10 0 EFAEHO C[C@@H]([NH2+]CC(=O)NC[C@H](c1ccccc1)N(C)C)C1CCC(F)CC1 ZINC000661999924 481475198 /nfs/dbraw/zinc/47/51/98/481475198.db2.gz DRQDABLTXWLSME-JVGQSUMCSA-N 1 3 349.494 2.912 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N[C@H](CN)c1ccc2ccccc2c1 ZINC000659527021 481482139 /nfs/dbraw/zinc/48/21/39/481482139.db2.gz HPERDQMRUMGGGL-QZTJIDSGSA-N 1 3 328.460 2.512 10 0 EFAEHO [NH3+]C[C@@H]1CCC[C@@H]1NCc1ccc(N2CCc3ccccc3C2)nc1 ZINC000643472042 481484524 /nfs/dbraw/zinc/48/45/24/481484524.db2.gz LDIAPYGPFLLAGL-ICSRJNTNSA-N 1 3 336.483 2.861 10 0 EFAEHO NC[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 ZINC000643479526 481486108 /nfs/dbraw/zinc/48/61/08/481486108.db2.gz NCVXVPUDFBGKOI-BHYGNILZSA-N 1 3 343.450 2.506 10 0 EFAEHO CC1(C)C[N@H+](CCOCCO)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000664835318 481506890 /nfs/dbraw/zinc/50/68/90/481506890.db2.gz CZYQHINKJJKGAI-HXUWFJFHSA-N 1 3 346.515 2.618 10 0 EFAEHO CC1(C)C[N@@H+](CCOCCO)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000664835318 481506894 /nfs/dbraw/zinc/50/68/94/481506894.db2.gz CZYQHINKJJKGAI-HXUWFJFHSA-N 1 3 346.515 2.618 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000659623123 481520357 /nfs/dbraw/zinc/52/03/57/481520357.db2.gz DIWVKMWXGDLOQY-IEBWSBKVSA-N 1 3 346.519 2.666 10 0 EFAEHO CCC[N@H+](CC)Cc1ccc(C(=O)N2CC[C@@H]3CN(C)C[C@@H]32)cc1 ZINC000646912183 481546918 /nfs/dbraw/zinc/54/69/18/481546918.db2.gz OVSPYWJPNKFDQS-MOPGFXCFSA-N 1 3 329.488 2.695 10 0 EFAEHO CCC[N@@H+](CC)Cc1ccc(C(=O)N2CC[C@@H]3CN(C)C[C@@H]32)cc1 ZINC000646912183 481546928 /nfs/dbraw/zinc/54/69/28/481546928.db2.gz OVSPYWJPNKFDQS-MOPGFXCFSA-N 1 3 329.488 2.695 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NCCOC[C@@H]2CCOC2)CC1 ZINC000648444775 481551794 /nfs/dbraw/zinc/55/17/94/481551794.db2.gz GVMFAAXSGVNZNS-AZUAARDMSA-N 1 3 346.515 2.725 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NCCOC[C@H]2CCOC2)CC1 ZINC000648444777 481552281 /nfs/dbraw/zinc/55/22/81/481552281.db2.gz GVMFAAXSGVNZNS-QUCCMNQESA-N 1 3 346.515 2.725 10 0 EFAEHO CC[N@H+](Cc1ccc(C(=O)N2CC[C@@H]3CN(C)C[C@H]32)cc1)C(C)C ZINC000646928290 481556512 /nfs/dbraw/zinc/55/65/12/481556512.db2.gz XFXWRKORYKHRNI-RTBURBONSA-N 1 3 329.488 2.693 10 0 EFAEHO CC[N@@H+](Cc1ccc(C(=O)N2CC[C@@H]3CN(C)C[C@H]32)cc1)C(C)C ZINC000646928290 481556516 /nfs/dbraw/zinc/55/65/16/481556516.db2.gz XFXWRKORYKHRNI-RTBURBONSA-N 1 3 329.488 2.693 10 0 EFAEHO COC[C@H](CN1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2)OC ZINC000659979662 481678872 /nfs/dbraw/zinc/67/88/72/481678872.db2.gz NLCGECRZGUMCKA-VQTJNVASSA-N 1 3 332.488 2.636 10 0 EFAEHO COC[C@H](CN1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2)OC ZINC000659979662 481678876 /nfs/dbraw/zinc/67/88/76/481678876.db2.gz NLCGECRZGUMCKA-VQTJNVASSA-N 1 3 332.488 2.636 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccc(F)cc1Cl ZINC000665153118 481688048 /nfs/dbraw/zinc/68/80/48/481688048.db2.gz TWCFXRKGNPIKMH-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccc(F)cc1Cl ZINC000665153118 481688056 /nfs/dbraw/zinc/68/80/56/481688056.db2.gz TWCFXRKGNPIKMH-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO CC[C@@H](NC[C@@H]1CCC2(C[NH2+]C2)O1)c1ccccc1OC(F)F ZINC000662280449 481689511 /nfs/dbraw/zinc/68/95/11/481689511.db2.gz DRSYUFIXYOGRCV-GXTWGEPZSA-N 1 3 326.387 2.850 10 0 EFAEHO Cc1ccccc1-n1cc(CNCC2(O)CC[NH+](C(C)C)CC2)cn1 ZINC000647192410 481695331 /nfs/dbraw/zinc/69/53/31/481695331.db2.gz DXKHOVSLIXKUSB-UHFFFAOYSA-N 1 3 342.487 2.506 10 0 EFAEHO C[C@H](C(=O)N(C)C1CCCCC1)N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662293444 481697184 /nfs/dbraw/zinc/69/71/84/481697184.db2.gz LDMQTSQPKZPIKQ-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO COC[C@H](C[N@@H+]1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1)OC ZINC000660010160 481699309 /nfs/dbraw/zinc/69/93/09/481699309.db2.gz GJJDVDNTLCMXCH-SLFFLAALSA-N 1 3 332.488 2.634 10 0 EFAEHO COC[C@H](C[N@H+]1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1)OC ZINC000660010160 481699313 /nfs/dbraw/zinc/69/93/13/481699313.db2.gz GJJDVDNTLCMXCH-SLFFLAALSA-N 1 3 332.488 2.634 10 0 EFAEHO COC[C@H](C[N@@H+]1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1)OC ZINC000660010161 481699656 /nfs/dbraw/zinc/69/96/56/481699656.db2.gz GJJDVDNTLCMXCH-UFYCRDLUSA-N 1 3 332.488 2.634 10 0 EFAEHO COC[C@H](C[N@H+]1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1)OC ZINC000660010161 481699660 /nfs/dbraw/zinc/69/96/60/481699660.db2.gz GJJDVDNTLCMXCH-UFYCRDLUSA-N 1 3 332.488 2.634 10 0 EFAEHO C[C@H](C(=O)NC1CCC(C)CC1)N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662298984 481706079 /nfs/dbraw/zinc/70/60/79/481706079.db2.gz YZJFQGCWDZIRRA-BDFRZKONSA-N 1 3 335.536 2.781 10 0 EFAEHO CC1=CC[C@](C)(C(=O)NC2CCN(C3CC[NH+](C)CC3)CC2)CC1 ZINC000667642188 481706228 /nfs/dbraw/zinc/70/62/28/481706228.db2.gz ROSRXFOMJALLDJ-FQEVSTJZSA-N 1 3 333.520 2.798 10 0 EFAEHO CC1=CC[C@@](C)(C(=O)NC2CCN(C3CC[NH+](C)CC3)CC2)CC1 ZINC000667642189 481706956 /nfs/dbraw/zinc/70/69/56/481706956.db2.gz ROSRXFOMJALLDJ-HXUWFJFHSA-N 1 3 333.520 2.798 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]C[C@@H]2CN(Cc3ccccc3)CC23CCOCC3)CO1 ZINC000647212927 481707937 /nfs/dbraw/zinc/70/79/37/481707937.db2.gz DMGOZANAQRHKNA-RLLQIKCJSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)CO1 ZINC000647212927 481707941 /nfs/dbraw/zinc/70/79/41/481707941.db2.gz DMGOZANAQRHKNA-RLLQIKCJSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@@H]2C[N@@H+](Cc3ccccc3)CC23CCOCC3)CO1 ZINC000647212927 481707946 /nfs/dbraw/zinc/70/79/46/481707946.db2.gz DMGOZANAQRHKNA-RLLQIKCJSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@H](NC(=O)CN1CCC[C@@H](C)[C@H]1CCC[NH3+])c1ccc(F)cc1 ZINC000662313203 481716911 /nfs/dbraw/zinc/71/69/11/481716911.db2.gz GHMHJESZWNQMDN-RVKKMQEKSA-N 1 3 335.467 2.842 10 0 EFAEHO C[NH+](C)CCCC1CCN(Cc2ccnn2-c2ccncc2)CC1 ZINC000667672178 481726592 /nfs/dbraw/zinc/72/65/92/481726592.db2.gz NDOUUYMNZOQATP-UHFFFAOYSA-N 1 3 327.476 2.821 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662337291 481734505 /nfs/dbraw/zinc/73/45/05/481734505.db2.gz KZPYRTVKWCZZIY-IRXDYDNUSA-N 1 3 333.524 2.681 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662337291 481734512 /nfs/dbraw/zinc/73/45/12/481734512.db2.gz KZPYRTVKWCZZIY-IRXDYDNUSA-N 1 3 333.524 2.681 10 0 EFAEHO COc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@@H](C)[C@H]2CCCOC2)cc1F ZINC000665259763 481754602 /nfs/dbraw/zinc/75/46/02/481754602.db2.gz PCVFSVQERSGXKU-MBGYTDRXSA-N 1 3 336.451 2.685 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](N[C@@H]2CCc3cc(N)ccc32)[C@@H](C)C1 ZINC000665269260 481758063 /nfs/dbraw/zinc/75/80/63/481758063.db2.gz CKOHZBXHNYXLTO-RYGJVYDSSA-N 1 3 331.504 2.983 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](N[C@@H]2CCc3cc(N)ccc32)[C@@H](C)C1 ZINC000665269260 481758070 /nfs/dbraw/zinc/75/80/70/481758070.db2.gz CKOHZBXHNYXLTO-RYGJVYDSSA-N 1 3 331.504 2.983 10 0 EFAEHO C[C@H](C[C@H]1CCCCC[NH2+]1)N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2 ZINC000665274817 481761922 /nfs/dbraw/zinc/76/19/22/481761922.db2.gz YWAPVUKIMAQWRE-NCXUSEDFSA-N 1 3 335.536 2.530 10 0 EFAEHO C[C@H](C[C@@H]1CCCCC[NH2+]1)N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2 ZINC000665274815 481762949 /nfs/dbraw/zinc/76/29/49/481762949.db2.gz YWAPVUKIMAQWRE-FCGDIQPGSA-N 1 3 335.536 2.530 10 0 EFAEHO C[C@@H]1CCC[C@H]([NH+]2CCC(NCC(C)(C)[C@@]3(O)CCOC3)CC2)C1 ZINC000647341648 481768209 /nfs/dbraw/zinc/76/82/09/481768209.db2.gz ZKAXXJOJXDCLQQ-IMFGXOCKSA-N 1 3 338.536 2.797 10 0 EFAEHO C[C@@H]1CCC[C@H](N2CCC([NH2+]CC(C)(C)[C@@]3(O)CCOC3)CC2)C1 ZINC000647341648 481768218 /nfs/dbraw/zinc/76/82/18/481768218.db2.gz ZKAXXJOJXDCLQQ-IMFGXOCKSA-N 1 3 338.536 2.797 10 0 EFAEHO CCC[C@H](NC1CCN(C(=O)CCC[NH2+]C)CC1)c1ccccn1 ZINC000665287434 481772288 /nfs/dbraw/zinc/77/22/88/481772288.db2.gz KWGBEXSLUUVKPD-SFHVURJKSA-N 1 3 332.492 2.503 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](CCCNC(=O)C[C@H]2NCc3ccccc32)C1 ZINC000662387847 481778849 /nfs/dbraw/zinc/77/88/49/481778849.db2.gz XFBIEUXYUSZIGM-JTDSTZFVSA-N 1 3 329.488 2.705 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)C[C@H]2NCc3ccccc32)C1 ZINC000662387847 481778855 /nfs/dbraw/zinc/77/88/55/481778855.db2.gz XFBIEUXYUSZIGM-JTDSTZFVSA-N 1 3 329.488 2.705 10 0 EFAEHO C[C@H]1CCC[N@H+](CCCCNC(=O)C[C@@H]2NCc3ccccc32)C1 ZINC000662389590 481780025 /nfs/dbraw/zinc/78/00/25/481780025.db2.gz SXSOVMQBOZIMAC-LPHOPBHVSA-N 1 3 329.488 2.849 10 0 EFAEHO C[C@H]1CCC[N@@H+](CCCCNC(=O)C[C@@H]2NCc3ccccc32)C1 ZINC000662389590 481780033 /nfs/dbraw/zinc/78/00/33/481780033.db2.gz SXSOVMQBOZIMAC-LPHOPBHVSA-N 1 3 329.488 2.849 10 0 EFAEHO C[C@H](CNC(=O)c1ccc2c(c1)[C@H](C[NH3+])CCC2)N1CCC[C@@H](C)C1 ZINC000662389364 481780987 /nfs/dbraw/zinc/78/09/87/481780987.db2.gz WPTIJUBQQCFABD-MDZRGWNJSA-N 1 3 343.515 2.915 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCCCNC(=O)C[C@@H]1NCc2ccccc21 ZINC000662390202 481781216 /nfs/dbraw/zinc/78/12/16/481781216.db2.gz YGASMRMVTARHAH-LPHOPBHVSA-N 1 3 329.488 2.992 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCCCNC(=O)C[C@@H]1NCc2ccccc21 ZINC000662390202 481781225 /nfs/dbraw/zinc/78/12/25/481781225.db2.gz YGASMRMVTARHAH-LPHOPBHVSA-N 1 3 329.488 2.992 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)C[C@@H]2NCc3ccccc32)c1 ZINC000662404038 481788118 /nfs/dbraw/zinc/78/81/18/481788118.db2.gz BDMULYXCPRAZFZ-FQEVSTJZSA-N 1 3 337.467 2.989 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)C[C@@H]2NCc3ccccc32)c1 ZINC000662404038 481788128 /nfs/dbraw/zinc/78/81/28/481788128.db2.gz BDMULYXCPRAZFZ-FQEVSTJZSA-N 1 3 337.467 2.989 10 0 EFAEHO CCCCN1CCCC[C@H]1CNC(=O)c1cc(C2CC[NH2+]CC2)no1 ZINC000662429179 481801010 /nfs/dbraw/zinc/80/10/10/481801010.db2.gz KIQROEJENUXEDN-INIZCTEOSA-N 1 3 348.491 2.526 10 0 EFAEHO C[NH+](C)CCCC1CCN(C(=O)NC[C@H]2CCN2C(C)(C)C)CC1 ZINC000665363219 481820813 /nfs/dbraw/zinc/82/08/13/481820813.db2.gz VFLRUGXTGHAJNN-QGZVFWFLSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000665366428 481824372 /nfs/dbraw/zinc/82/43/72/481824372.db2.gz YZEKGUCSZRTHCM-IRXDYDNUSA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)[N@H+](C)CC1CCN(C(=O)NC[C@@H]2CCN2C(C)(C)C)CC1 ZINC000665366909 481826102 /nfs/dbraw/zinc/82/61/02/481826102.db2.gz LBVVYQOSAXQNIT-KRWDZBQOSA-N 1 3 338.540 2.621 10 0 EFAEHO CC(C)[N@@H+](C)CC1CCN(C(=O)NC[C@@H]2CCN2C(C)(C)C)CC1 ZINC000665366909 481826107 /nfs/dbraw/zinc/82/61/07/481826107.db2.gz LBVVYQOSAXQNIT-KRWDZBQOSA-N 1 3 338.540 2.621 10 0 EFAEHO O=C(C[C@@H]1NCc2ccccc21)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000662505928 481848362 /nfs/dbraw/zinc/84/83/62/481848362.db2.gz VSQHDMSTBCXMKY-LSTHTHJFSA-N 1 3 339.483 2.696 10 0 EFAEHO O=C(C[C@@H]1NCc2ccccc21)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000662505928 481848367 /nfs/dbraw/zinc/84/83/67/481848367.db2.gz VSQHDMSTBCXMKY-LSTHTHJFSA-N 1 3 339.483 2.696 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000654433730 481869573 /nfs/dbraw/zinc/86/95/73/481869573.db2.gz WGPJNKUBONKPIX-XDNAFOTISA-N 1 3 336.524 2.565 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000654433730 481869579 /nfs/dbraw/zinc/86/95/79/481869579.db2.gz WGPJNKUBONKPIX-XDNAFOTISA-N 1 3 336.524 2.565 10 0 EFAEHO C[N@H+](CCCNC(=O)NC[C@H]1CCN1C(C)(C)C)Cc1ccccc1 ZINC000660275123 481870042 /nfs/dbraw/zinc/87/00/42/481870042.db2.gz XCUYMQUQJCZVJU-GOSISDBHSA-N 1 3 346.519 2.681 10 0 EFAEHO C[N@@H+](CCCNC(=O)NC[C@H]1CCN1C(C)(C)C)Cc1ccccc1 ZINC000660275123 481870046 /nfs/dbraw/zinc/87/00/46/481870046.db2.gz XCUYMQUQJCZVJU-GOSISDBHSA-N 1 3 346.519 2.681 10 0 EFAEHO CCCN(C(=O)C1CCN(c2cc[nH+]cc2C)CC1)[C@H]1CCN(C)C1 ZINC000648998916 481878061 /nfs/dbraw/zinc/87/80/61/481878061.db2.gz VEZVWQSNBXPMTI-SFHVURJKSA-N 1 3 344.503 2.549 10 0 EFAEHO CN(CCc1ccccc1)[C@@H]1CCN(C(=O)c2ccc(C[NH3+])cc2)C1 ZINC000662659040 481920572 /nfs/dbraw/zinc/92/05/72/481920572.db2.gz MVJCLFGEINZRGV-HXUWFJFHSA-N 1 3 337.467 2.534 10 0 EFAEHO C[C@H](C(=O)Nc1ccc([C@@H]2C[NH2+]CCO2)cc1)N1CCCCCC1 ZINC000662687185 481933758 /nfs/dbraw/zinc/93/37/58/481933758.db2.gz VLNCXGYYRGBSQI-QAPCUYQASA-N 1 3 331.460 2.551 10 0 EFAEHO CC(C)(C)N1CC[C@H](NC(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)C1 ZINC000665556565 481934254 /nfs/dbraw/zinc/93/42/54/481934254.db2.gz ZMHIIFOKFQVKLK-DLBZAZTESA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)C2([NH2+]C3CC3)CCC2)C1 ZINC000662696057 481938401 /nfs/dbraw/zinc/93/84/01/481938401.db2.gz HLBREOBYRCDHTC-MAUKXSAKSA-N 1 3 327.472 2.613 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000660405107 481940644 /nfs/dbraw/zinc/94/06/44/481940644.db2.gz WJADRZAXIABSTA-SJORKVTESA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000660405107 481940646 /nfs/dbraw/zinc/94/06/46/481940646.db2.gz WJADRZAXIABSTA-SJORKVTESA-N 1 3 338.540 2.671 10 0 EFAEHO NC1(C(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)CC2(CCC2)C1 ZINC000662715120 481944783 /nfs/dbraw/zinc/94/47/83/481944783.db2.gz FRBWJIAJOSXPKI-QGZVFWFLSA-N 1 3 333.520 2.763 10 0 EFAEHO CCN(C(=O)Nc1cccc(OCC[NH+](C)C)c1)[C@H]1CCN(CC)C1 ZINC000665601598 481956797 /nfs/dbraw/zinc/95/67/97/481956797.db2.gz BEQZCMNGRJWGAB-KRWDZBQOSA-N 1 3 348.491 2.575 10 0 EFAEHO CC1(C)CN(C(=O)CCC[NH3+])[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000662758473 481961911 /nfs/dbraw/zinc/96/19/11/481961911.db2.gz OSBDCLUKLIXWGX-FQEVSTJZSA-N 1 3 343.515 2.875 10 0 EFAEHO C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000660450658 481966849 /nfs/dbraw/zinc/96/68/49/481966849.db2.gz JGUWLSGDZFOUKT-JKSUJKDBSA-N 1 3 338.540 2.669 10 0 EFAEHO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000660450658 481966850 /nfs/dbraw/zinc/96/68/50/481966850.db2.gz JGUWLSGDZFOUKT-JKSUJKDBSA-N 1 3 338.540 2.669 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N(C)[C@@H](C)c1ccccc1 ZINC000665637142 481972845 /nfs/dbraw/zinc/97/28/45/481972845.db2.gz VNOXHPJAMAZJSV-IRXDYDNUSA-N 1 3 334.508 2.661 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N(C)[C@@H](C)c1ccccc1 ZINC000665637142 481972849 /nfs/dbraw/zinc/97/28/49/481972849.db2.gz VNOXHPJAMAZJSV-IRXDYDNUSA-N 1 3 334.508 2.661 10 0 EFAEHO CO[C@H](CN1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1)[C@@H]1CCOC1 ZINC000660542101 482015276 /nfs/dbraw/zinc/01/52/76/482015276.db2.gz ZYVKCRPLSRBFHY-NJYVYQBISA-N 1 3 344.499 2.636 10 0 EFAEHO CO[C@H](CN1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1)[C@@H]1CCOC1 ZINC000660542101 482015280 /nfs/dbraw/zinc/01/52/80/482015280.db2.gz ZYVKCRPLSRBFHY-NJYVYQBISA-N 1 3 344.499 2.636 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)C1(c2ccccc2)CC[NH2+]CC1 ZINC000649318710 482026629 /nfs/dbraw/zinc/02/66/29/482026629.db2.gz DZVISQFXDAZEBG-HDICACEKSA-N 1 3 343.515 2.687 10 0 EFAEHO Cc1cccc(C(C)(C)NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000665758622 482038192 /nfs/dbraw/zinc/03/81/92/482038192.db2.gz LBAXLRUHSMSOAU-KRWDZBQOSA-N 1 3 348.535 2.801 10 0 EFAEHO Cc1cccc(C(C)(C)NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000665758622 482038196 /nfs/dbraw/zinc/03/81/96/482038196.db2.gz LBAXLRUHSMSOAU-KRWDZBQOSA-N 1 3 348.535 2.801 10 0 EFAEHO Cc1cccc(CN(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1C ZINC000665762471 482040135 /nfs/dbraw/zinc/04/01/35/482040135.db2.gz FMJPPJTXRMUEEL-KRWDZBQOSA-N 1 3 348.535 2.717 10 0 EFAEHO Cc1cccc(CN(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1C ZINC000665762471 482040142 /nfs/dbraw/zinc/04/01/42/482040142.db2.gz FMJPPJTXRMUEEL-KRWDZBQOSA-N 1 3 348.535 2.717 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)NCCCCC[NH+]1CCCCC1 ZINC000660637071 482061711 /nfs/dbraw/zinc/06/17/11/482061711.db2.gz XVSOXVDCDSYIMV-QGZVFWFLSA-N 1 3 338.540 2.815 10 0 EFAEHO CCN(C[C@H]1CC[NH2+]C1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000649413655 482068551 /nfs/dbraw/zinc/06/85/51/482068551.db2.gz XBBIJCOUELEXCB-KRWDZBQOSA-N 1 3 345.535 2.809 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)C[N@@H+]1CCC[C@@]2(CCN(C)C2)C1 ZINC000660652837 482070837 /nfs/dbraw/zinc/07/08/37/482070837.db2.gz MUPDFWXJPZGMAS-RXVVDRJESA-N 1 3 346.515 2.967 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@]2(CCN(C)C2)C1 ZINC000660652837 482070840 /nfs/dbraw/zinc/07/08/40/482070840.db2.gz MUPDFWXJPZGMAS-RXVVDRJESA-N 1 3 346.515 2.967 10 0 EFAEHO c1cc(CNCC2CC[NH+](C3CCOCC3)CC2)nc2c1CCC2 ZINC000668440022 482124641 /nfs/dbraw/zinc/12/46/41/482124641.db2.gz HERHPDVPWWRRKW-UHFFFAOYSA-N 1 3 329.488 2.551 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1cc(F)ccc1Cl ZINC000665965503 482127923 /nfs/dbraw/zinc/12/79/23/482127923.db2.gz RJAJPQPBFVPLQO-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1cc(F)ccc1Cl ZINC000665965503 482127928 /nfs/dbraw/zinc/12/79/28/482127928.db2.gz RJAJPQPBFVPLQO-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)CS1 ZINC000668488574 482141505 /nfs/dbraw/zinc/14/15/05/482141505.db2.gz BVXFKZNTUWWLLT-FHWLQOOXSA-N 1 3 334.529 2.873 10 0 EFAEHO C[NH2+]Cc1ccccc1CNC(=O)N1CCN(CCC(C)(C)C)CC1 ZINC000652284519 482155972 /nfs/dbraw/zinc/15/59/72/482155972.db2.gz ZHUIOSFFUZWOCF-UHFFFAOYSA-N 1 3 346.519 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH+]2C[C@H](C)C(O)[C@@H](C)C2)CC1 ZINC000668554562 482166002 /nfs/dbraw/zinc/16/60/02/482166002.db2.gz NXHQDGHXOWNSDV-ROUUACIJSA-N 1 3 345.531 2.667 10 0 EFAEHO O=C(NC1CCN(Cc2ccc3c(c2)C[NH2+]CC3)CC1)c1ccccc1 ZINC000652336959 482178767 /nfs/dbraw/zinc/17/87/67/482178767.db2.gz VEPVGZHKUXOVPC-UHFFFAOYSA-N 1 3 349.478 2.727 10 0 EFAEHO CN(Cc1ccc(C(=O)NC2CC2)cc1)Cc1ccc2c(c1)C[NH2+]CC2 ZINC000652337160 482179154 /nfs/dbraw/zinc/17/91/54/482179154.db2.gz OICPICOLIQGAFQ-UHFFFAOYSA-N 1 3 349.478 2.857 10 0 EFAEHO Cc1cc(F)ccc1N1CCC[C@H](N2C[C@@H]3CCC[C@]3(C[NH3+])C2)C1=O ZINC000652352123 482185799 /nfs/dbraw/zinc/18/57/99/482185799.db2.gz JGTXVTCNQYLBQO-QSFXBCCZSA-N 1 3 345.462 2.690 10 0 EFAEHO Cc1cc(F)ccc1N1CCC[C@H]([N@@H+]2C[C@@H]3CCC[C@]3(CN)C2)C1=O ZINC000652352123 482185804 /nfs/dbraw/zinc/18/58/04/482185804.db2.gz JGTXVTCNQYLBQO-QSFXBCCZSA-N 1 3 345.462 2.690 10 0 EFAEHO Cc1cc(F)ccc1N1CCC[C@H]([N@H+]2C[C@@H]3CCC[C@]3(CN)C2)C1=O ZINC000652352123 482185807 /nfs/dbraw/zinc/18/58/07/482185807.db2.gz JGTXVTCNQYLBQO-QSFXBCCZSA-N 1 3 345.462 2.690 10 0 EFAEHO O[C@H](C[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCC2)C(F)(F)F ZINC000663369015 482185942 /nfs/dbraw/zinc/18/59/42/482185942.db2.gz UZRAMESJLOZIQX-HZPDHXFCSA-N 1 3 342.405 2.802 10 0 EFAEHO Cn1cc(C[C@@H]2CCC[C@H]2[NH2+]C2CCN(c3ccncc3)CC2)cn1 ZINC000668609871 482187412 /nfs/dbraw/zinc/18/74/12/482187412.db2.gz IQXLNKOCIQDSBE-FXAWDEMLSA-N 1 3 339.487 2.785 10 0 EFAEHO CCN(C(=O)NC[C@@H](c1ccccc1)[NH+](CC)CC)[C@H]1CCN(C)C1 ZINC000663450412 482243681 /nfs/dbraw/zinc/24/36/81/482243681.db2.gz IUHSDTSANZIADY-OALUTQOASA-N 1 3 346.519 2.805 10 0 EFAEHO Clc1ccccc1[C@H]1C[NH2+]CCN1Cc1nc2c(s1)CNCC2 ZINC000663492812 482263924 /nfs/dbraw/zinc/26/39/24/482263924.db2.gz BMNIXJRUCUEOMS-OAHLLOKOSA-N 1 3 348.903 2.589 10 0 EFAEHO C[C@@H]1CCC[C@H](C[N@@H+]2CCC[C@H](c3cc(N4CCNCC4)n[nH]3)C2)C1 ZINC000663513655 482273533 /nfs/dbraw/zinc/27/35/33/482273533.db2.gz TUXULSRFYZDDRR-SQNIBIBYSA-N 1 3 345.535 2.825 10 0 EFAEHO C[C@@H]1CCC[C@H](C[N@H+]2CCC[C@H](c3cc(N4CCNCC4)n[nH]3)C2)C1 ZINC000663513655 482273537 /nfs/dbraw/zinc/27/35/37/482273537.db2.gz TUXULSRFYZDDRR-SQNIBIBYSA-N 1 3 345.535 2.825 10 0 EFAEHO CCN(C(=O)NCc1ccccc1C[NH+](CC)CC)[C@@H]1CCN(C)C1 ZINC000663516497 482275146 /nfs/dbraw/zinc/27/51/46/482275146.db2.gz SSAKOXOLFJNJMZ-LJQANCHMSA-N 1 3 346.519 2.764 10 0 EFAEHO CCN(C(=O)NCc1ccccc1C[NH+](CC)CC)[C@H]1CCN(C)C1 ZINC000663516496 482275330 /nfs/dbraw/zinc/27/53/30/482275330.db2.gz SSAKOXOLFJNJMZ-IBGZPJMESA-N 1 3 346.519 2.764 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)c1cccc(CN2CCCC2)c1 ZINC000652522341 482277705 /nfs/dbraw/zinc/27/77/05/482277705.db2.gz DPIGQWKMZHCNJS-UHFFFAOYSA-N 1 3 331.504 2.990 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)c1cccc(CN2CCCC2)c1 ZINC000652522341 482277710 /nfs/dbraw/zinc/27/77/10/482277710.db2.gz DPIGQWKMZHCNJS-UHFFFAOYSA-N 1 3 331.504 2.990 10 0 EFAEHO CC[NH+]1CCC(NC(=O)CN[C@H](CC2CC2)c2ccccc2)CC1 ZINC000663597387 482315418 /nfs/dbraw/zinc/31/54/18/482315418.db2.gz QEKGFLXRGORNAF-LJQANCHMSA-N 1 3 329.488 2.718 10 0 EFAEHO C[C@]1(C2CC2)CN(CCCC[N@@H+]2CCO[C@@](C)(C3CC3)C2)CCO1 ZINC000661167221 482352058 /nfs/dbraw/zinc/35/20/58/482352058.db2.gz FURVJHVOQYQXNO-WOJBJXKFSA-N 1 3 336.520 2.768 10 0 EFAEHO C[C@]1(C2CC2)CN(CCCC[N@H+]2CCO[C@@](C)(C3CC3)C2)CCO1 ZINC000661167221 482352065 /nfs/dbraw/zinc/35/20/65/482352065.db2.gz FURVJHVOQYQXNO-WOJBJXKFSA-N 1 3 336.520 2.768 10 0 EFAEHO CCN(C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C)[C@@H]1CC[N@H+](CC)C1 ZINC000663844497 482404840 /nfs/dbraw/zinc/40/48/40/482404840.db2.gz WSUTWZHMDUOPSC-MOPGFXCFSA-N 1 3 346.519 2.723 10 0 EFAEHO CCN(C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C)[C@@H]1CC[N@@H+](CC)C1 ZINC000663844497 482404845 /nfs/dbraw/zinc/40/48/45/482404845.db2.gz WSUTWZHMDUOPSC-MOPGFXCFSA-N 1 3 346.519 2.723 10 0 EFAEHO CC(C)C[C@H](C[NH+](C)C)NC(=O)N[C@H](CN(C)C)c1ccccc1 ZINC000121442239 519337495 /nfs/dbraw/zinc/33/74/95/519337495.db2.gz GMUZJZBQVYZGKB-QZTJIDSGSA-N 1 3 334.508 2.565 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+]2CCC[C@@H](c3nccs3)C2)CC1 ZINC000192729083 519681230 /nfs/dbraw/zinc/68/12/30/519681230.db2.gz YWQTVVPJJWJCCK-QGZVFWFLSA-N 1 3 336.549 2.739 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+]2CCC[C@@H](c3nccs3)C2)CC1 ZINC000192729083 519681232 /nfs/dbraw/zinc/68/12/32/519681232.db2.gz YWQTVVPJJWJCCK-QGZVFWFLSA-N 1 3 336.549 2.739 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H]2CCCOC2)CC1 ZINC000236801834 519859882 /nfs/dbraw/zinc/85/98/82/519859882.db2.gz CXXVXOYLBVUFEZ-GOSISDBHSA-N 1 3 331.504 2.735 10 0 EFAEHO CC1CCC(=CC(=O)N2CCN(C3CC4CCC(C3)[NH+]4C)CC2)CC1 ZINC000154635845 520908701 /nfs/dbraw/zinc/90/87/01/520908701.db2.gz XNKZCTNOJPRSIL-JUNHRQJPSA-N 1 3 345.531 2.892 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000245868846 521629890 /nfs/dbraw/zinc/62/98/90/521629890.db2.gz RAEUGPNKOBRZJC-IEBWSBKVSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000245868846 521629898 /nfs/dbraw/zinc/62/98/98/521629898.db2.gz RAEUGPNKOBRZJC-IEBWSBKVSA-N 1 3 346.519 2.633 10 0 EFAEHO CCN1CCC[C@H]1CN(C)C(=O)NCCCC[NH+]1CCC(C)CC1 ZINC000177399216 521651510 /nfs/dbraw/zinc/65/15/10/521651510.db2.gz CRXRKIPGRTYFBH-SFHVURJKSA-N 1 3 338.540 2.624 10 0 EFAEHO C[NH2+]C1CCN(C(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)CC1 ZINC000179138757 521946899 /nfs/dbraw/zinc/94/68/99/521946899.db2.gz VJDPGRUIMCXWST-QGZVFWFLSA-N 1 3 343.515 2.540 10 0 EFAEHO COC(=O)c1ccccc1OCCN1CCC(C[NH+]2CCCC2)CC1 ZINC000182063060 522287629 /nfs/dbraw/zinc/28/76/29/522287629.db2.gz JQQWWKLVKOGMNP-UHFFFAOYSA-N 1 3 346.471 2.660 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@@H](C)c1ccc(OC)c(Br)c1 ZINC000234740972 522288434 /nfs/dbraw/zinc/28/84/34/522288434.db2.gz YDXNYUOEPCAKEQ-WCQYABFASA-N 1 3 345.281 2.862 10 0 EFAEHO CN1CC[C@H](C[N@H+](C)Cc2ccc(I)cc2)C1 ZINC000088185741 523261028 /nfs/dbraw/zinc/26/10/28/523261028.db2.gz HHWNMHNFOFWAPY-ZDUSSCGKSA-N 1 3 344.240 2.675 10 0 EFAEHO CN1CC[C@H](C[N@@H+](C)Cc2ccc(I)cc2)C1 ZINC000088185741 523261036 /nfs/dbraw/zinc/26/10/36/523261036.db2.gz HHWNMHNFOFWAPY-ZDUSSCGKSA-N 1 3 344.240 2.675 10 0 EFAEHO CN(Cc1cccc(C[N@H+](C)C[C@H]2CCCO2)c1)C[C@H]1CCCO1 ZINC000246156795 523299802 /nfs/dbraw/zinc/29/98/02/523299802.db2.gz QFHSAGVTHDBCIW-WOJBJXKFSA-N 1 3 332.488 2.908 10 0 EFAEHO CN(Cc1cccc(C[N@@H+](C)C[C@H]2CCCO2)c1)C[C@H]1CCCO1 ZINC000246156795 523299810 /nfs/dbraw/zinc/29/98/10/523299810.db2.gz QFHSAGVTHDBCIW-WOJBJXKFSA-N 1 3 332.488 2.908 10 0 EFAEHO COC(=O)[C@@H]1C[C@@H](c2ccccc2)C[N@H+](CCCN2CCCC2)C1 ZINC000120860355 523769620 /nfs/dbraw/zinc/76/96/20/523769620.db2.gz GRLQGARQGRXSMI-RTBURBONSA-N 1 3 330.472 2.751 10 0 EFAEHO COC(=O)[C@@H]1C[C@@H](c2ccccc2)C[N@@H+](CCCN2CCCC2)C1 ZINC000120860355 523769626 /nfs/dbraw/zinc/76/96/26/523769626.db2.gz GRLQGARQGRXSMI-RTBURBONSA-N 1 3 330.472 2.751 10 0 EFAEHO CS[C@H](CO)[C@@H](C)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245652520 525891934 /nfs/dbraw/zinc/89/19/34/525891934.db2.gz CVJRKOLTCYALQC-IQZDNPOKSA-N 1 3 334.529 2.884 10 0 EFAEHO CS[C@H](CO)[C@@H](C)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245652520 525891942 /nfs/dbraw/zinc/89/19/42/525891942.db2.gz CVJRKOLTCYALQC-IQZDNPOKSA-N 1 3 334.529 2.884 10 0 EFAEHO Cc1nn(C)c(C)c1CC[NH2+][C@@H](C)c1cccc(OCCN(C)C)c1 ZINC000177745166 527625849 /nfs/dbraw/zinc/62/58/49/527625849.db2.gz TWSUINPQPRGJRK-HNNXBMFYSA-N 1 3 344.503 2.871 10 0 EFAEHO CCC[C@@H](C(=O)NCC1CC[NH+](Cc2ccccc2)CC1)N(C)C ZINC000179621782 528842258 /nfs/dbraw/zinc/84/22/58/528842258.db2.gz RPJRGOWVOXTLBS-IBGZPJMESA-N 1 3 331.504 2.745 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH+]2CCC(OC)CC2)CC1 ZINC000349729619 534935872 /nfs/dbraw/zinc/93/58/72/534935872.db2.gz KODWXBWXXNKYPJ-UHFFFAOYSA-N 1 3 331.504 2.829 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H](OC)C(C)C)CC1 ZINC000344710090 534936575 /nfs/dbraw/zinc/93/65/75/534936575.db2.gz FNOFVTAWESOXDY-FQEVSTJZSA-N 1 3 333.520 2.979 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2CCC[C@@H](CO)C2)CC1 ZINC000414565027 534936645 /nfs/dbraw/zinc/93/66/45/534936645.db2.gz DQKXYSGKHVSJOX-UYAOXDASSA-N 1 3 345.531 2.859 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H](C)CCOC)CC1 ZINC000414479117 534936680 /nfs/dbraw/zinc/93/66/80/534936680.db2.gz HUWBTWDQHZGKLG-GOSISDBHSA-N 1 3 333.520 2.981 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2CCN(C3CC3)C2)CC1 ZINC000344222182 534937559 /nfs/dbraw/zinc/93/75/59/534937559.db2.gz PJTRPIWZJUPWQR-LJQANCHMSA-N 1 3 342.531 2.545 10 0 EFAEHO CCC[NH2+]CCNC(=O)N(CC)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418469747 535161706 /nfs/dbraw/zinc/16/17/06/535161706.db2.gz KPSYQBWEYIUQGV-HKUYNNGSSA-N 1 3 346.519 2.853 10 0 EFAEHO CC(C)[NH+]1CCC(O)(CNCc2cnc(-c3ccncc3)s2)CC1 ZINC000344627936 535165440 /nfs/dbraw/zinc/16/54/40/535165440.db2.gz HGLQCQKKZQJUTG-UHFFFAOYSA-N 1 3 346.500 2.530 10 0 EFAEHO CC(C)C[C@H](C)[NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1 ZINC000414325632 535299050 /nfs/dbraw/zinc/29/90/50/535299050.db2.gz MMXXPGMRVFVSPV-INIZCTEOSA-N 1 3 331.504 2.908 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)C[C@@H](c2ccccc2)N(C)C)CC1 ZINC000433382105 535446479 /nfs/dbraw/zinc/44/64/79/535446479.db2.gz MXKHHOXWGPPJRK-IBGZPJMESA-N 1 3 331.504 2.918 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)[C@@H](C)Cc1ccccc1 ZINC000352825137 535594555 /nfs/dbraw/zinc/59/45/55/535594555.db2.gz CBZDSTKTMBKLBL-ICSRJNTNSA-N 1 3 345.531 2.740 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)[C@@H](C)Cc1ccccc1 ZINC000352825137 535594561 /nfs/dbraw/zinc/59/45/61/535594561.db2.gz CBZDSTKTMBKLBL-ICSRJNTNSA-N 1 3 345.531 2.740 10 0 EFAEHO C[NH+](C)C[C@H]1CCCN1C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000427726890 535959833 /nfs/dbraw/zinc/95/98/33/535959833.db2.gz OGNPBOGGMZPQTC-PKOBYXMFSA-N 1 3 347.478 2.590 10 0 EFAEHO CN(C(=O)NC1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCN(C2CC2)C1 ZINC000356061325 536020403 /nfs/dbraw/zinc/02/04/03/536020403.db2.gz PHYZMQUBQKYHOP-LJQANCHMSA-N 1 3 348.535 2.662 10 0 EFAEHO COC1(C[C@H](C)[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCC1 ZINC000414303711 536693464 /nfs/dbraw/zinc/69/34/64/536693464.db2.gz LWNNYJDWLUCSNQ-SFHVURJKSA-N 1 3 346.515 2.951 10 0 EFAEHO CC1CCN([C@H](CNC(=O)[C@@H]2CCC[C@@H]2C[NH3+])c2ccccc2)CC1 ZINC000261858881 545621731 /nfs/dbraw/zinc/62/17/31/545621731.db2.gz WQMJERVVJWQEQW-VAMGGRTRSA-N 1 3 343.515 2.951 10 0 EFAEHO OCC[C@H]1CCCCCN1CCC[N@@H+]1CCCCC[C@H]1CCO ZINC000342039956 545945134 /nfs/dbraw/zinc/94/51/34/545945134.db2.gz AHEWWEHOOOXPLU-KDURUIRLSA-N 1 3 326.525 2.631 10 0 EFAEHO OCC[C@H]1CCCCCN1CCC[N@H+]1CCCCC[C@H]1CCO ZINC000342039956 545945135 /nfs/dbraw/zinc/94/51/35/545945135.db2.gz AHEWWEHOOOXPLU-KDURUIRLSA-N 1 3 326.525 2.631 10 0 EFAEHO OCC[C@H]1CCCCC[N@H+]1CCCN1CCCCC[C@H]1CCO ZINC000342039956 545945137 /nfs/dbraw/zinc/94/51/37/545945137.db2.gz AHEWWEHOOOXPLU-KDURUIRLSA-N 1 3 326.525 2.631 10 0 EFAEHO OCC[C@H]1CCCCC[N@@H+]1CCCN1CCCCC[C@H]1CCO ZINC000342039956 545945138 /nfs/dbraw/zinc/94/51/38/545945138.db2.gz AHEWWEHOOOXPLU-KDURUIRLSA-N 1 3 326.525 2.631 10 0 EFAEHO CC(C)[C@H]1CC[C@H]1[NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1 ZINC000414347420 546189147 /nfs/dbraw/zinc/18/91/47/546189147.db2.gz WGZZMZYOBHYWHP-WOJBJXKFSA-N 1 3 343.515 2.908 10 0 EFAEHO C[C@]1(CNC(=O)N[C@@H]2CCC[C@@H]([NH3+])C2)CCCN1Cc1ccccc1 ZINC000418046781 546212774 /nfs/dbraw/zinc/21/27/74/546212774.db2.gz RBWCFLIUZXSFGU-QWFCFKBJSA-N 1 3 344.503 2.610 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](CN[C@H](C(=O)N2CCCCC2)c2ccccc2)C1 ZINC000656126922 546690500 /nfs/dbraw/zinc/69/05/00/546690500.db2.gz AFLVTUXCGATGTI-UHOSZYNNSA-N 1 3 329.488 2.670 10 0 EFAEHO [NH3+]CCCN(c1ccccc1F)C1CCN(C[C@H]2CCCO2)CC1 ZINC000656254586 546748701 /nfs/dbraw/zinc/74/87/01/546748701.db2.gz CEQSRRRDJFGJBK-QGZVFWFLSA-N 1 3 335.467 2.624 10 0 EFAEHO COc1cc(Br)c(CNC[C@H]2C[C@@H]([NH+](C)C)C2)cc1O ZINC000656268965 546757735 /nfs/dbraw/zinc/75/77/35/546757735.db2.gz JNYZUUSRGDAQKP-KLPPZKSPSA-N 1 3 343.265 2.593 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C[C@H](C)O)C2CC2)CC1 ZINC000656277287 546762802 /nfs/dbraw/zinc/76/28/02/546762802.db2.gz BBYRJOKPXVEHLV-KRWDZBQOSA-N 1 3 331.504 2.564 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C[C@H](C)O)C2CC2)CC1 ZINC000656277287 546762805 /nfs/dbraw/zinc/76/28/05/546762805.db2.gz BBYRJOKPXVEHLV-KRWDZBQOSA-N 1 3 331.504 2.564 10 0 EFAEHO [NH3+]Cc1ccc(-c2cn([C@H]3CCN(Cc4ccccc4)C3)nn2)cc1 ZINC000656455975 546807503 /nfs/dbraw/zinc/80/75/03/546807503.db2.gz QVQCKMZYANXTIJ-IBGZPJMESA-N 1 3 333.439 2.851 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000656552540 546839630 /nfs/dbraw/zinc/83/96/30/546839630.db2.gz XHLVIFZLPZXDEV-DLBZAZTESA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000656552540 546839634 /nfs/dbraw/zinc/83/96/34/546839634.db2.gz XHLVIFZLPZXDEV-DLBZAZTESA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000656552542 546839721 /nfs/dbraw/zinc/83/97/21/546839721.db2.gz XHLVIFZLPZXDEV-IAGOWNOFSA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000656552542 546839726 /nfs/dbraw/zinc/83/97/26/546839726.db2.gz XHLVIFZLPZXDEV-IAGOWNOFSA-N 1 3 336.524 2.567 10 0 EFAEHO COc1cc(CN2CCC[C@H](C3CC[NH2+]CC3)C2)cc2c1OCO2 ZINC000656786203 546924361 /nfs/dbraw/zinc/92/43/61/546924361.db2.gz PQLTWBQVUHITLR-INIZCTEOSA-N 1 3 332.444 2.636 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN[C@H]2CCc3cc(N)ccc32)cc1 ZINC000656790593 546925285 /nfs/dbraw/zinc/92/52/85/546925285.db2.gz CJZMYZUZUXOJQU-FQEVSTJZSA-N 1 3 325.456 2.986 10 0 EFAEHO Cc1ncsc1-c1ccc(C[NH2+]CC2(O)CCN(C)CC2)cc1 ZINC000657371845 547134861 /nfs/dbraw/zinc/13/48/61/547134861.db2.gz OCCIRDNNRWZHNH-UHFFFAOYSA-N 1 3 331.485 2.665 10 0 EFAEHO Cc1ccc2cc(C[NH2+]C3CCN([C@@H]4CCC[C@@H]4O)CC3)[nH]c2c1 ZINC000657398839 547145608 /nfs/dbraw/zinc/14/56/08/547145608.db2.gz CVZTUNVYMJUNDJ-UXHICEINSA-N 1 3 327.472 2.944 10 0 EFAEHO CC[C@@H]1CCC[C@@H]([NH2+]CC2(N3CCOCC3)CCN(C)CC2)CC1 ZINC000657490266 547183009 /nfs/dbraw/zinc/18/30/09/547183009.db2.gz HSGYAGBPHJTHNZ-RTBURBONSA-N 1 3 337.552 2.732 10 0 EFAEHO COc1ccc(CN[C@@H](C)CN(C)CCC[NH+](C)C)c(Cl)c1 ZINC000657572672 547210858 /nfs/dbraw/zinc/21/08/58/547210858.db2.gz BFIBHZZZXIJDRS-AWEZNQCLSA-N 1 3 327.900 2.710 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1cnc(-c2ccco2)s1 ZINC000657573802 547212135 /nfs/dbraw/zinc/21/21/35/547212135.db2.gz UYFCHJCNBPUNFF-AWEZNQCLSA-N 1 3 336.505 2.765 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1ccc2c(c1)OCCCCO2 ZINC000657573520 547212443 /nfs/dbraw/zinc/21/24/43/547212443.db2.gz PBBXFYOHYQTYFN-KRWDZBQOSA-N 1 3 349.519 2.600 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1cnc(-c2ccccc2)nc1 ZINC000657572990 547212499 /nfs/dbraw/zinc/21/24/99/547212499.db2.gz HMVDYTKJTMTQSI-KRWDZBQOSA-N 1 3 341.503 2.505 10 0 EFAEHO Cc1ccc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1F ZINC000657594963 547221473 /nfs/dbraw/zinc/22/14/73/547221473.db2.gz LUHQOWFNBCNUJN-IBGZPJMESA-N 1 3 328.431 2.991 10 0 EFAEHO Cc1ccc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)cc1F ZINC000657594963 547221479 /nfs/dbraw/zinc/22/14/79/547221479.db2.gz LUHQOWFNBCNUJN-IBGZPJMESA-N 1 3 328.431 2.991 10 0 EFAEHO COCc1csc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1 ZINC000657594408 547221992 /nfs/dbraw/zinc/22/19/92/547221992.db2.gz AAPICLZDLAOBHZ-SFHVURJKSA-N 1 3 346.496 2.751 10 0 EFAEHO COCc1csc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1 ZINC000657594408 547221994 /nfs/dbraw/zinc/22/19/94/547221994.db2.gz AAPICLZDLAOBHZ-SFHVURJKSA-N 1 3 346.496 2.751 10 0 EFAEHO CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)CCO1 ZINC000657595652 547222873 /nfs/dbraw/zinc/22/28/73/547222873.db2.gz JEHATMUXUIMJNQ-AABGKKOBSA-N 1 3 332.488 2.546 10 0 EFAEHO c1cc(OCC[NH+]2CCCC2)ccc1CN[C@@H]1COC2(CCC2)C1 ZINC000657630365 547233965 /nfs/dbraw/zinc/23/39/65/547233965.db2.gz DFAXFEAYZOIEKM-SFHVURJKSA-N 1 3 330.472 2.962 10 0 EFAEHO O[C@@H]1C[C@H](NCc2ccc(OCC[NH+]3CCCC3)cc2)C12CCC2 ZINC000657703307 547258723 /nfs/dbraw/zinc/25/87/23/547258723.db2.gz MZCXQONEUPCSMG-RBUKOAKNSA-N 1 3 330.472 2.554 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2C[C@@H](O)C23CCC3)CC1 ZINC000657707681 547259804 /nfs/dbraw/zinc/25/98/04/547259804.db2.gz VSKNXAXYHVMNMA-WOJBJXKFSA-N 1 3 343.515 2.612 10 0 EFAEHO CN1CCN(Cc2ccc(C[NH2+]C3CC(CF)(CF)C3)cc2)CC1 ZINC000657841805 547300095 /nfs/dbraw/zinc/30/00/95/547300095.db2.gz GQQNFDPBFASUPZ-UHFFFAOYSA-N 1 3 337.458 2.611 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)N[C@@H](C)c1ccc(F)cc1N(C)C ZINC000658107592 547358575 /nfs/dbraw/zinc/35/85/75/547358575.db2.gz MCZRAHWVOJKQDP-HOTGVXAUSA-N 1 3 338.515 2.814 10 0 EFAEHO COc1cc([C@H](C)N[C@@H](C)CN(C)CCC[NH+](C)C)ccc1F ZINC000658109272 547359285 /nfs/dbraw/zinc/35/92/85/547359285.db2.gz UYQWPQCIZAICMX-GJZGRUSLSA-N 1 3 325.472 2.757 10 0 EFAEHO C[C@@H](N[C@@H](C)CN(C)CCC[NH+](C)C)c1ccc(C(F)F)nc1 ZINC000658109760 547359378 /nfs/dbraw/zinc/35/93/78/547359378.db2.gz WRQCQRHYCMBUEZ-UONOGXRCSA-N 1 3 328.451 2.942 10 0 EFAEHO O[C@@H]1CCN(Cc2ccc(C[NH2+][C@H]3CCCC34CCOCC4)cc2)C1 ZINC000658138037 547367790 /nfs/dbraw/zinc/36/77/90/547367790.db2.gz MCNGJXFZRUKBQG-UXHICEINSA-N 1 3 344.499 2.692 10 0 EFAEHO C[C@@H](CCc1ccco1)[NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000658137803 547367949 /nfs/dbraw/zinc/36/79/49/547367949.db2.gz IKXPLEYVVVHCCN-QFBILLFUSA-N 1 3 328.456 2.957 10 0 EFAEHO COC[C@H](CC(C)(C)C)[NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000658139789 547368937 /nfs/dbraw/zinc/36/89/37/547368937.db2.gz SBTKHDCYYVMVGX-RBUKOAKNSA-N 1 3 334.504 2.794 10 0 EFAEHO CCC1(CC)[C@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)C[C@H]1OC ZINC000658141894 547369322 /nfs/dbraw/zinc/36/93/22/547369322.db2.gz XOMWUQHBUATAKI-XUVXKRRUSA-N 1 3 346.515 2.937 10 0 EFAEHO COC1(C[C@@H](C)[NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)CCC1 ZINC000658142492 547369876 /nfs/dbraw/zinc/36/98/76/547369876.db2.gz YLDGJEWGPRJKOA-APWZRJJASA-N 1 3 332.488 2.691 10 0 EFAEHO Cc1ccncc1[C@@H](C)NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000658142845 547370209 /nfs/dbraw/zinc/37/02/09/547370209.db2.gz ZHNFCWLMUSXCDV-VQIMIIECSA-N 1 3 325.456 2.807 10 0 EFAEHO Cc1ccncc1[C@@H](C)NCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000658142845 547370212 /nfs/dbraw/zinc/37/02/12/547370212.db2.gz ZHNFCWLMUSXCDV-VQIMIIECSA-N 1 3 325.456 2.807 10 0 EFAEHO Cc1ccncc1[C@H](C)NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000658142841 547370311 /nfs/dbraw/zinc/37/03/11/547370311.db2.gz ZHNFCWLMUSXCDV-LPHOPBHVSA-N 1 3 325.456 2.807 10 0 EFAEHO Cc1ccncc1[C@H](C)NCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1 ZINC000658142841 547370313 /nfs/dbraw/zinc/37/03/13/547370313.db2.gz ZHNFCWLMUSXCDV-LPHOPBHVSA-N 1 3 325.456 2.807 10 0 EFAEHO Cc1cncc(CC[NH2+][C@@H](C)c2ccc(OCCN(C)C)cc2)n1 ZINC000658263311 547401190 /nfs/dbraw/zinc/40/11/90/547401190.db2.gz ZZDJZJXVROMAMO-INIZCTEOSA-N 1 3 328.460 2.619 10 0 EFAEHO C[C@H](Cn1cncn1)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658317039 547418673 /nfs/dbraw/zinc/41/86/73/547418673.db2.gz IPXJOVZUYSRGKP-MJGOQNOKSA-N 1 3 339.487 2.559 10 0 EFAEHO C[C@H](Cn1cncn1)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000658317039 547418676 /nfs/dbraw/zinc/41/86/76/547418676.db2.gz IPXJOVZUYSRGKP-MJGOQNOKSA-N 1 3 339.487 2.559 10 0 EFAEHO CN(Cc1ccccc1)[C@H]1CCN(C(=O)CC[C@@H]2CCCC[N@@H+]2C)C1 ZINC000672937574 547831888 /nfs/dbraw/zinc/83/18/88/547831888.db2.gz RCEVZSMSIVHABP-PMACEKPBSA-N 1 3 343.515 2.984 10 0 EFAEHO CN(Cc1ccccc1)[C@H]1CCN(C(=O)CC[C@@H]2CCCC[N@H+]2C)C1 ZINC000672937574 547831891 /nfs/dbraw/zinc/83/18/91/547831891.db2.gz RCEVZSMSIVHABP-PMACEKPBSA-N 1 3 343.515 2.984 10 0 EFAEHO CC[NH+](CC)CCNC(=O)N1CCN(Cc2ccccc2)CC[C@@H]1C ZINC000673767769 547954878 /nfs/dbraw/zinc/95/48/78/547954878.db2.gz PGZISJOAORPVFQ-SFHVURJKSA-N 1 3 346.519 2.634 10 0 EFAEHO CC[C@H](CN1CCCC1)NC(=O)N1CCC(C[NH+](CC)CC)CC1 ZINC000675196333 548227120 /nfs/dbraw/zinc/22/71/20/548227120.db2.gz DMXLFUBSMIMVPX-GOSISDBHSA-N 1 3 338.540 2.624 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCN(CC2CC2)C1 ZINC000675834773 548362722 /nfs/dbraw/zinc/36/27/22/548362722.db2.gz ZSBPRONMJLPTOL-UIFIKXQLSA-N 1 3 327.516 2.971 10 0 EFAEHO CC[C@H]([NH2+][C@H]1CCN(C2CCN(C)CC2)C1)c1cccc(OC)c1 ZINC000675875877 548366403 /nfs/dbraw/zinc/36/64/03/548366403.db2.gz UHQNCJZZQDUWAJ-PXNSSMCTSA-N 1 3 331.504 2.904 10 0 EFAEHO CC[C@@H]([NH2+][C@H]1CCN(C2CCN(C)CC2)C1)c1cccc(OC)c1 ZINC000675875876 548366775 /nfs/dbraw/zinc/36/67/75/548366775.db2.gz UHQNCJZZQDUWAJ-FXAWDEMLSA-N 1 3 331.504 2.904 10 0 EFAEHO CC[NH+](CC)CC1CCN(Cc2ccccc2-n2cncn2)CC1 ZINC000678139108 548851611 /nfs/dbraw/zinc/85/16/11/548851611.db2.gz JOSKUCBSCHGDQF-UHFFFAOYSA-N 1 3 327.476 2.821 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)CCN(C)c1ccncc1 ZINC000679407386 549123509 /nfs/dbraw/zinc/12/35/09/549123509.db2.gz LOIZFKKMAHTOAW-SFHVURJKSA-N 1 3 332.492 2.679 10 0 EFAEHO CCCC[N@H+]1CCCC[C@H]1CNC(=O)CCN(C)c1ccncc1 ZINC000679407386 549123512 /nfs/dbraw/zinc/12/35/12/549123512.db2.gz LOIZFKKMAHTOAW-SFHVURJKSA-N 1 3 332.492 2.679 10 0 EFAEHO C[C@@H]1CN(Cc2cccc3cnccc32)CC[C@@H]1[NH+]1CCN(C)CC1 ZINC000679990841 549233730 /nfs/dbraw/zinc/23/37/30/549233730.db2.gz RUTXQJKCKOXBCX-UTKZUKDTSA-N 1 3 338.499 2.693 10 0 EFAEHO CN1CCC(N2CC[C@H]([NH2+]CCCCOc3ccccc3)C2)CC1 ZINC000682158921 549706369 /nfs/dbraw/zinc/70/63/69/549706369.db2.gz UDTZQUNCGCSBLR-SFHVURJKSA-N 1 3 331.504 2.604 10 0 EFAEHO C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)[C@H]1CCC[N@@H+]1C1CC1 ZINC000683855827 549955803 /nfs/dbraw/zinc/95/58/03/549955803.db2.gz ATEUQWPYBRTUFK-YLJYHZDGSA-N 1 3 341.499 2.736 10 0 EFAEHO C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)[C@H]1CCC[N@H+]1C1CC1 ZINC000683855827 549955804 /nfs/dbraw/zinc/95/58/04/549955804.db2.gz ATEUQWPYBRTUFK-YLJYHZDGSA-N 1 3 341.499 2.736 10 0 EFAEHO CCN1CCN(Cc2ccc(C[NH2+][C@H]3CCC[C@H](OC)C3)cc2)CC1 ZINC000684370215 550031142 /nfs/dbraw/zinc/03/11/42/550031142.db2.gz PYLXBGPLXQWRAX-SFTDATJTSA-N 1 3 345.531 2.871 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCOC2CCC2)CC1 ZINC000756117007 575686918 /nfs/dbraw/zinc/68/69/18/575686918.db2.gz ANSLMXHNQBVAIY-UHFFFAOYSA-N 1 3 331.504 2.877 10 0 EFAEHO C[C@H](CNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)[NH+]1CCCCC1 ZINC000758849505 575878686 /nfs/dbraw/zinc/87/86/86/575878686.db2.gz KKYMWAGYSGCWSE-QRQLOZEOSA-N 1 3 344.503 2.605 10 0 EFAEHO Cc1ccccc1[C@@H](O)C[NH+]1CCC(N2CCN(C(C)C)CC2)CC1 ZINC000761120257 576116620 /nfs/dbraw/zinc/11/66/20/576116620.db2.gz BUJQRPZBLHRBRE-NRFANRHFSA-N 1 3 345.531 2.519 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CCC1 ZINC000763051195 576357392 /nfs/dbraw/zinc/35/73/92/576357392.db2.gz FPHCDWPYKORSQE-HOCLYGCPSA-N 1 3 335.517 2.732 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CCC1 ZINC000763051195 576357393 /nfs/dbraw/zinc/35/73/93/576357393.db2.gz FPHCDWPYKORSQE-HOCLYGCPSA-N 1 3 335.517 2.732 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCCOc1cccnc1 ZINC000765998167 577096998 /nfs/dbraw/zinc/09/69/98/577096998.db2.gz QWSIHJIBLKMOQM-FXAWDEMLSA-N 1 3 325.456 2.961 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCCOc1cccnc1 ZINC000765998167 577097000 /nfs/dbraw/zinc/09/70/00/577097000.db2.gz QWSIHJIBLKMOQM-FXAWDEMLSA-N 1 3 325.456 2.961 10 0 EFAEHO C[C@H]1CN(Cc2cncc3ccccc32)CC[C@@H]1[NH+]1CCN(C)CC1 ZINC000769524654 577370164 /nfs/dbraw/zinc/37/01/64/577370164.db2.gz GPCYSEDLRJBNLN-UWJYYQICSA-N 1 3 338.499 2.693 10 0 EFAEHO COC(=O)/C(C)=C/C[N@H+](C)CCC1CCN(c2ccncc2)CC1 ZINC000771452880 581213517 /nfs/dbraw/zinc/21/35/17/581213517.db2.gz SELNDDGOTDCXPA-OMCISZLKSA-N 1 3 331.460 2.739 10 0 EFAEHO COC(=O)/C(C)=C/C[N@@H+](C)CCC1CCN(c2ccncc2)CC1 ZINC000771452880 581213518 /nfs/dbraw/zinc/21/35/18/581213518.db2.gz SELNDDGOTDCXPA-OMCISZLKSA-N 1 3 331.460 2.739 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@H](O)c2cccnc2)CC[N@@H+]1Cc1ccccc1 ZINC000773081265 581394693 /nfs/dbraw/zinc/39/46/93/581394693.db2.gz LWCLGFKVDIZSJA-UXPWSPDFSA-N 1 3 325.456 2.758 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@H](O)c2cccnc2)CC[N@H+]1Cc1ccccc1 ZINC000773081265 581394696 /nfs/dbraw/zinc/39/46/96/581394696.db2.gz LWCLGFKVDIZSJA-UXPWSPDFSA-N 1 3 325.456 2.758 10 0 EFAEHO Cc1cc(CNCCN(C)C(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)cs1 ZINC001691359735 1248694281 /nfs/dbraw/zinc/69/42/81/1248694281.db2.gz CYXWUWPPAUZOCM-IRXDYDNUSA-N 1 3 335.517 2.621 10 0 EFAEHO Cc1cc(CNCCN(C)C(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)cs1 ZINC001691359735 1248694291 /nfs/dbraw/zinc/69/42/91/1248694291.db2.gz CYXWUWPPAUZOCM-IRXDYDNUSA-N 1 3 335.517 2.621 10 0 EFAEHO Cc1nc(C)c(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)s1 ZINC000850357606 1250447452 /nfs/dbraw/zinc/44/74/52/1250447452.db2.gz PHSXQYUNMKUKOH-QGZVFWFLSA-N 1 3 331.485 2.616 10 0 EFAEHO Cc1nc(C)c(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)s1 ZINC000850357606 1250447457 /nfs/dbraw/zinc/44/74/57/1250447457.db2.gz PHSXQYUNMKUKOH-QGZVFWFLSA-N 1 3 331.485 2.616 10 0 EFAEHO CN(C)CCC[NH2+][C@@H]1CCN(C(=O)C(F)(F)F)Cc2ccccc21 ZINC000850419913 1250477625 /nfs/dbraw/zinc/47/76/25/1250477625.db2.gz GEGUZBAWYHHASH-OAHLLOKOSA-N 1 3 343.393 2.564 10 0 EFAEHO CCCC[N@@H+]1CC[C@@](C)(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001484059244 1252123905 /nfs/dbraw/zinc/12/39/05/1252123905.db2.gz XRBOQPBXEUGRFJ-MSOLQXFVSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCC[N@H+]1CC[C@@](C)(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001484059244 1252123915 /nfs/dbraw/zinc/12/39/15/1252123915.db2.gz XRBOQPBXEUGRFJ-MSOLQXFVSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccsc1)C2 ZINC001484321878 1252389364 /nfs/dbraw/zinc/38/93/64/1252389364.db2.gz WOVTXNYWXSVNRS-BBWFWOEESA-N 1 3 335.517 2.557 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccsc1)C2 ZINC001484321878 1252389368 /nfs/dbraw/zinc/38/93/68/1252389368.db2.gz WOVTXNYWXSVNRS-BBWFWOEESA-N 1 3 335.517 2.557 10 0 EFAEHO CCc1ccccc1[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC(C)C ZINC001484322033 1252390893 /nfs/dbraw/zinc/39/08/93/1252390893.db2.gz AAJAURPYWZVYQJ-YLJYHZDGSA-N 1 3 345.531 2.994 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1F ZINC001484384436 1252489226 /nfs/dbraw/zinc/48/92/26/1252489226.db2.gz OGKREJYYCDWLFM-FUHWJXTLSA-N 1 3 349.494 2.658 10 0 EFAEHO C[C@H]1CN(C(=O)CN2CCC(C)CC2)C[C@@H]1C[NH2+]CCCC1CCC1 ZINC001484381424 1252493673 /nfs/dbraw/zinc/49/36/73/1252493673.db2.gz WAGAJFMDLUBQIX-ICSRJNTNSA-N 1 3 349.563 2.983 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N2CCCC[C@@H]2CNCC=C(Cl)Cl)CC[N@@H+]1C ZINC001484615968 1252766254 /nfs/dbraw/zinc/76/62/54/1252766254.db2.gz LNJXQKJMYORNAT-MGPQQGTHSA-N 1 3 348.318 2.616 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N2CCCC[C@@H]2CNCC=C(Cl)Cl)CC[N@H+]1C ZINC001484615968 1252766260 /nfs/dbraw/zinc/76/62/60/1252766260.db2.gz LNJXQKJMYORNAT-MGPQQGTHSA-N 1 3 348.318 2.616 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CCC[C@@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001484721095 1252836811 /nfs/dbraw/zinc/83/68/11/1252836811.db2.gz AJVVESJGNUQIPT-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@H](F)CC[N@H+]1CCC[C@@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001484721095 1252836816 /nfs/dbraw/zinc/83/68/16/1252836816.db2.gz AJVVESJGNUQIPT-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO CN(CCCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21)CCC(F)(F)F ZINC001484747233 1252903965 /nfs/dbraw/zinc/90/39/65/1252903965.db2.gz NOHTVYHUHOQLLX-GJZGRUSLSA-N 1 3 349.441 2.736 10 0 EFAEHO CN(CCCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21)CCC(F)(F)F ZINC001484747233 1252903969 /nfs/dbraw/zinc/90/39/69/1252903969.db2.gz NOHTVYHUHOQLLX-GJZGRUSLSA-N 1 3 349.441 2.736 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)[C@H](C[NH2+]CC2CC3(CCC3)C2)C2CC2)C1 ZINC001485827721 1257091177 /nfs/dbraw/zinc/09/11/77/1257091177.db2.gz QYQGBFHBHQUKQH-QFBILLFUSA-N 1 3 347.547 2.735 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)[C@@H](C[NH2+]CC2CC3(CCC3)C2)C2CC2)C1 ZINC001485827717 1257091500 /nfs/dbraw/zinc/09/15/00/1257091500.db2.gz QYQGBFHBHQUKQH-LPHOPBHVSA-N 1 3 347.547 2.735 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]CCc1cccs1 ZINC001272774441 1257882242 /nfs/dbraw/zinc/88/22/42/1257882242.db2.gz VKJVHOAPFURNDX-RDJZCZTQSA-N 1 3 337.533 2.648 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@H]([C@@H]2CCCCN2C(=O)CN(C)C(C)C)C1 ZINC001670924037 1258688792 /nfs/dbraw/zinc/68/87/92/1258688792.db2.gz RVTYNYHRMZYMKB-OALUTQOASA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@H]([C@@H]2CCCCN2C(=O)CN(C)C(C)C)C1 ZINC001670924037 1258688799 /nfs/dbraw/zinc/68/87/99/1258688799.db2.gz RVTYNYHRMZYMKB-OALUTQOASA-N 1 3 335.536 2.996 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001272830629 1261099397 /nfs/dbraw/zinc/09/93/97/1261099397.db2.gz QDNDJTDOCVKZLM-MRXNPFEDSA-N 1 3 331.504 2.718 10 0 EFAEHO Cn1nc(C(F)(F)F)c(CN2CC[C@H]3C[NH2+]C[C@H]3CC2)c1Cl ZINC000843128479 1261167236 /nfs/dbraw/zinc/16/72/36/1261167236.db2.gz XYTDWMWMKOMDQU-AOOOYVTPSA-N 1 3 336.789 2.524 10 0 EFAEHO Cc1ccc(C)c(OC[C@H](O)CN2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)c1 ZINC000923364389 1261557882 /nfs/dbraw/zinc/55/78/82/1261557882.db2.gz NGDHEGSYPBCERX-GUDVDZBRSA-N 1 3 332.488 2.507 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN2CCCC[C@@H]2[C@H]2CC[NH2+]C2)c(C)c1 ZINC000923365070 1261558475 /nfs/dbraw/zinc/55/84/75/1261558475.db2.gz RWEXPKOCJFVWIJ-IPMKNSEASA-N 1 3 332.488 2.507 10 0 EFAEHO Fc1ccc([C@@H](CC(F)(F)F)NC[C@@H]2CC3(C[NH2+]C3)CO2)cc1 ZINC000923377461 1261577807 /nfs/dbraw/zinc/57/78/07/1261577807.db2.gz UQSHIYIGQJVUBA-UONOGXRCSA-N 1 3 332.341 2.787 10 0 EFAEHO [NH3+]C[C@H]1CC2(CO1)CCN(Cc1cc(-c3ccc(F)cc3)no1)CC2 ZINC000923451197 1261688590 /nfs/dbraw/zinc/68/85/90/1261688590.db2.gz ZVXBKCNPRVWUDF-QGZVFWFLSA-N 1 3 345.418 2.811 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@@H](C1CC1)N(C)C(=O)CN(C)C(C)C ZINC001485838627 1261730986 /nfs/dbraw/zinc/73/09/86/1261730986.db2.gz VOIAZVSPAQFKRB-FQEVSTJZSA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)C[C@H](NC(=O)CN1CC[C@H](C[NH3+])[C@@H](C)C1)c1ccccc1 ZINC000923502100 1261781334 /nfs/dbraw/zinc/78/13/34/1261781334.db2.gz YABRXRWYBOHKGU-UHOSZYNNSA-N 1 3 331.504 2.807 10 0 EFAEHO CC(C)C[C@H](NC(=O)CN1CC[C@@H](C[NH3+])[C@H](C)C1)c1ccccc1 ZINC000923502098 1261781705 /nfs/dbraw/zinc/78/17/05/1261781705.db2.gz YABRXRWYBOHKGU-NEWSRXKRSA-N 1 3 331.504 2.807 10 0 EFAEHO Cc1cc(C)c(N2CC[C@H](N3CC[C@H](C[NH3+])[C@H](C)C3)C2=O)c(C)c1 ZINC000923494972 1261781935 /nfs/dbraw/zinc/78/19/35/1261781935.db2.gz RGKCXOJXIYUKML-KURKYZTESA-N 1 3 329.488 2.634 10 0 EFAEHO C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923502323 1261782716 /nfs/dbraw/zinc/78/27/16/1261782716.db2.gz YUWCDXWBFCEGQJ-YCPHGPKFSA-N 1 3 337.895 2.776 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C[NH3+])[C@H](C)C1)[C@H](C)c1ccc(F)cc1 ZINC000923496910 1261786882 /nfs/dbraw/zinc/78/68/82/1261786882.db2.gz KGEOAUZVGMTDTO-BFYDXBDKSA-N 1 3 335.467 2.652 10 0 EFAEHO CC[C@@H]1c2ccsc2CCN1C(=O)CN1CC[C@@H](C[NH3+])[C@@H](C)C1 ZINC000923498641 1261792970 /nfs/dbraw/zinc/79/29/70/1261792970.db2.gz IQPRZLHUJFYEHR-OFQRWUPVSA-N 1 3 335.517 2.501 10 0 EFAEHO C[C@H](NC(=O)[C@H](C)N1CC[C@@H](C[NH3+])[C@@H](C)C1)c1cc2ccccc2o1 ZINC000923499948 1261795881 /nfs/dbraw/zinc/79/58/81/1261795881.db2.gz OUSIKIWRBCTQCY-JKQORVJESA-N 1 3 343.471 2.915 10 0 EFAEHO C[C@H]1CN(CC(=O)N(Cc2ccccc2)C(C)(C)C)CC[C@H]1C[NH3+] ZINC000923504377 1261802302 /nfs/dbraw/zinc/80/23/02/1261802302.db2.gz RBVBNPQQPJZCDP-WMZOPIPTSA-N 1 3 331.504 2.730 10 0 EFAEHO C[C@@H]1CN(CC(=O)N(Cc2ccccc2)C(C)(C)C)CC[C@@H]1C[NH3+] ZINC000923504376 1261802546 /nfs/dbraw/zinc/80/25/46/1261802546.db2.gz RBVBNPQQPJZCDP-SJLPKXTDSA-N 1 3 331.504 2.730 10 0 EFAEHO c1ccc2c(c1)[C@@H](C[C@@H]1COCCN1)CN2CCC[NH+]1CCCCC1 ZINC000923541759 1261889965 /nfs/dbraw/zinc/88/99/65/1261889965.db2.gz VPHOLOUILKLWFW-RBUKOAKNSA-N 1 3 343.515 2.845 10 0 EFAEHO CN(CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)CC(=O)NCCC1=CCCCC1 ZINC000923552513 1261894143 /nfs/dbraw/zinc/89/41/43/1261894143.db2.gz CBUWKAQXESRAMF-YQQQUEKLSA-N 1 3 333.520 2.846 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cc2ccccc2o1 ZINC001485922665 1262503076 /nfs/dbraw/zinc/50/30/76/1262503076.db2.gz PGQUYWZPJAJQNE-CVEARBPZSA-N 1 3 343.471 2.711 10 0 EFAEHO CCCN(C)CC(=O)N(C)C[C@H](C)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001485947130 1262514586 /nfs/dbraw/zinc/51/45/86/1262514586.db2.gz MXNMXHDQDBICAI-LSDHHAIUSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)C[C@H](C)NCc1ccc(C)cc1Cl ZINC001485941184 1262540513 /nfs/dbraw/zinc/54/05/13/1262540513.db2.gz MQUFYDSVIUIVDB-HNNXBMFYSA-N 1 3 339.911 2.927 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)C[C@H](C)NCc1ccc(C)cc1Cl ZINC001485941184 1262540515 /nfs/dbraw/zinc/54/05/15/1262540515.db2.gz MQUFYDSVIUIVDB-HNNXBMFYSA-N 1 3 339.911 2.927 10 0 EFAEHO C[C@@H]1[C@H]([NH2+]CCCCCF)CCN1C(=O)CN(C)CC(C)(C)C ZINC001486089209 1262612066 /nfs/dbraw/zinc/61/20/66/1262612066.db2.gz OTFOWZWZQKYDGW-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2cccc(F)c2)[C@@H]1C ZINC001486090867 1262612959 /nfs/dbraw/zinc/61/29/59/1262612959.db2.gz DCFMZTMVBNQMFK-QFBILLFUSA-N 1 3 349.494 2.679 10 0 EFAEHO Cc1ccc(F)c(CN2CC[C@]3(NC(=O)CC[NH+](C)C)CCC[C@@H]23)c1 ZINC001486148846 1262699045 /nfs/dbraw/zinc/69/90/45/1262699045.db2.gz VCRCZSRXJSUREU-UYAOXDASSA-N 1 3 347.478 2.699 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN3CCC(C)CC3)C[C@@H]21 ZINC001486168790 1262731085 /nfs/dbraw/zinc/73/10/85/1262731085.db2.gz ZLQTYPIDXQMSKH-HSALFYBXSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[C@@H](C[NH2+]CCC2CC2)C1)N1CCCCC1 ZINC001486199640 1262783023 /nfs/dbraw/zinc/78/30/23/1262783023.db2.gz CJCITZPJTSDWCU-MSOLQXFVSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CC[C@H](C[NH2+]C/C=C/Cl)C1)N1CCCCC1 ZINC001486200931 1262785075 /nfs/dbraw/zinc/78/50/75/1262785075.db2.gz PEQKFYKJBCNOIE-VKFONMJVSA-N 1 3 341.927 2.878 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](CNCC=C(Cl)Cl)C(C)(C)C ZINC001486414909 1263092025 /nfs/dbraw/zinc/09/20/25/1263092025.db2.gz DMZCRIOVTDWNAO-GFCCVEGCSA-N 1 3 338.323 2.768 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](CNCC=C(Cl)Cl)C(C)(C)C ZINC001486414909 1263092034 /nfs/dbraw/zinc/09/20/34/1263092034.db2.gz DMZCRIOVTDWNAO-GFCCVEGCSA-N 1 3 338.323 2.768 10 0 EFAEHO C[C@H](NC(=O)[C@H](C)N1CCCCCC1)C1CC[NH+](CC2CC2)CC1 ZINC001486449220 1263139500 /nfs/dbraw/zinc/13/95/00/1263139500.db2.gz RHXBJZIRFSWNCR-IRXDYDNUSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@@H](C)C1)C1CC[NH+](CCC(C)(C)C)CC1 ZINC001486440739 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MUYXEODMEWJHPY-LJQANCHMSA-N 1 3 334.504 2.530 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC[C@H](O)CC(C)(C)O ZINC000872201239 1287473431 /nfs/dbraw/zinc/47/34/31/1287473431.db2.gz UDHYWYUBKUMHHA-VQIMIIECSA-N 1 3 334.504 2.673 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC[C@H](O)CC(C)(C)O ZINC000872201239 1287473437 /nfs/dbraw/zinc/47/34/37/1287473437.db2.gz UDHYWYUBKUMHHA-VQIMIIECSA-N 1 3 334.504 2.673 10 0 EFAEHO CC(C)(O)C[C@@H](O)CNCc1ccccc1C[NH+]1CCCCCC1 ZINC000872202063 1287474433 /nfs/dbraw/zinc/47/44/33/1287474433.db2.gz SHZIITRKPGONDR-LJQANCHMSA-N 1 3 334.504 2.674 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001671084515 1281347937 /nfs/dbraw/zinc/34/79/37/1281347937.db2.gz BYEQVCFREAKBBV-HRSGFYEVSA-N 1 3 347.547 2.999 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001671084515 1281347945 /nfs/dbraw/zinc/34/79/45/1281347945.db2.gz BYEQVCFREAKBBV-HRSGFYEVSA-N 1 3 347.547 2.999 10 0 EFAEHO C[NH+](C)CC1CCC(NC(=O)C2C[C@H](c3ccccc3)OC2=O)CC1 ZINC000809732919 1282411094 /nfs/dbraw/zinc/41/10/94/1282411094.db2.gz RNMKLWVYCJUBHQ-XAWIXRBMSA-N 1 3 344.455 2.527 10 0 EFAEHO C[NH+](C)CC1CCC(NC(=O)C2C[C@H](c3ccccc3)OC2=O)CC1 ZINC000809732916 1282411302 /nfs/dbraw/zinc/41/13/02/1282411302.db2.gz RNMKLWVYCJUBHQ-DQVOVIAYSA-N 1 3 344.455 2.527 10 0 EFAEHO C[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CCCCC1 ZINC000810146272 1282967115 /nfs/dbraw/zinc/96/71/15/1282967115.db2.gz OOVDOZGTZZOTGP-GOSISDBHSA-N 1 3 327.488 2.580 10 0 EFAEHO C[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CCCCC1 ZINC000810146272 1282967128 /nfs/dbraw/zinc/96/71/28/1282967128.db2.gz OOVDOZGTZZOTGP-GOSISDBHSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@@H]1CCCC[N@@H+]1CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810400535 1283190920 /nfs/dbraw/zinc/19/09/20/1283190920.db2.gz IEQDTYSZHZXAGZ-CRAIPNDOSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@@H]1CCCC[N@H+]1CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810400535 1283190927 /nfs/dbraw/zinc/19/09/27/1283190927.db2.gz IEQDTYSZHZXAGZ-CRAIPNDOSA-N 1 3 327.488 2.580 10 0 EFAEHO C[NH+](C)CC[C@@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)(C)C ZINC000810412758 1283214821 /nfs/dbraw/zinc/21/48/21/1283214821.db2.gz JSIZTMDLMMJGQX-KDOFPFPSSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCC(C[NH+]3CCCC3)CC2)C1 ZINC000810433951 1283228121 /nfs/dbraw/zinc/22/81/21/1283228121.db2.gz JNILFHGFJRCAIQ-IBGZPJMESA-N 1 3 339.499 2.533 10 0 EFAEHO Cc1cc(F)ccc1[C@H](C)N[C@@H](CC(C)C)C(=O)NCC[NH+](C)C ZINC000815608955 1287633115 /nfs/dbraw/zinc/63/31/15/1287633115.db2.gz RWMNJMIERUOUSS-YJBOKZPZSA-N 1 3 337.483 2.877 10 0 EFAEHO C[NH+](C)CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)c1ccccc1 ZINC000812949102 1285559740 /nfs/dbraw/zinc/55/97/40/1285559740.db2.gz NTLPOIOTHUXSJN-IBGZPJMESA-N 1 3 335.467 2.794 10 0 EFAEHO CC[NH+](CC)Cc1cc([C@H](C)NC2COCCOC2)ccc1OC ZINC000813879275 1286168152 /nfs/dbraw/zinc/16/81/52/1286168152.db2.gz KGAKZSMPSWXFBF-HNNXBMFYSA-N 1 3 336.476 2.603 10 0 EFAEHO CC[C@@H](C)[C@H]1CN(Cc2ccc(C)nc2)CCN1C[C@@H]1C[NH2+]C[C@H]1C ZINC000903457557 1312711563 /nfs/dbraw/zinc/71/15/63/1312711563.db2.gz WXKLZZDIXCGQAA-SGLNWRHMSA-N 1 3 344.547 2.778 10 0 EFAEHO CN(CC(=O)N(C)[C@H](C[NH2+]C/C=C\Cl)C1CC1)CC(C)(C)C ZINC001277692462 1312747775 /nfs/dbraw/zinc/74/77/75/1312747775.db2.gz CIEODZADJPCWLB-WUKHSURWSA-N 1 3 329.916 2.543 10 0 EFAEHO C[C@H](C(=O)Nc1cccc(C(F)(F)F)c1)N1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903494768 1312769431 /nfs/dbraw/zinc/76/94/31/1312769431.db2.gz NZRYFSZZNLBMIV-JHJVBQTASA-N 1 3 343.393 2.949 10 0 EFAEHO C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903496441 1312771384 /nfs/dbraw/zinc/77/13/84/1312771384.db2.gz NWFKABNRFXWVRC-JHJVBQTASA-N 1 3 343.393 2.949 10 0 EFAEHO C[C@@H]1CN(Cc2cc3c(cc2Br)OCO3)C[C@H]1CC[NH3+] ZINC000903496476 1312771829 /nfs/dbraw/zinc/77/18/29/1312771829.db2.gz PADCXCYBLVGZGH-GHMZBOCLSA-N 1 3 341.249 2.595 10 0 EFAEHO C[NH+]1CCC2(CCCN(Cc3ccnn3-c3ccncc3)C2)CC1 ZINC000825762125 1290446676 /nfs/dbraw/zinc/44/66/76/1290446676.db2.gz AJVDMKDIATXLEO-UHFFFAOYSA-N 1 3 325.460 2.575 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@H]([C@@H]2CCCN(CCF)C2)C1 ZINC001273598539 1292108028 /nfs/dbraw/zinc/10/80/28/1292108028.db2.gz DBNDUPUAHXHGTB-MSOLQXFVSA-N 1 3 341.515 2.638 10 0 EFAEHO CCN(CC[NH2+]CCc1ccccc1)C(=O)[C@H]1CCCCN1C(C)C ZINC001273646861 1293037788 /nfs/dbraw/zinc/03/77/88/1293037788.db2.gz ZHTBOBGBCYKIPW-HXUWFJFHSA-N 1 3 345.531 2.930 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)cc1C)C(=O)[C@@H](C(C)C)N(C)C ZINC001273715994 1294166129 /nfs/dbraw/zinc/16/61/29/1294166129.db2.gz BVKMZBSQFZWBLS-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO O[C@@H]1C[C@@H]([NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C12CCC2 ZINC000886637906 1295077250 /nfs/dbraw/zinc/07/72/50/1295077250.db2.gz HPXIHGHMHNQSOJ-WKWVNEEDSA-N 1 3 326.484 2.933 10 0 EFAEHO CCN(CC[NH2+]CC1CC2(CCC2)C1)C(=O)[C@H]1CCCCN1CC ZINC001273771934 1295243851 /nfs/dbraw/zinc/24/38/51/1295243851.db2.gz NUIDBQXKRZKVHX-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]1C[NH2+]CCCc1ccccc1)C1CCC1 ZINC001277866454 1313161764 /nfs/dbraw/zinc/16/17/64/1313161764.db2.gz UHWOFTHYXRVJOK-HXUWFJFHSA-N 1 3 343.515 2.684 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]CCCc1ccccc1 ZINC001275415313 1296276614 /nfs/dbraw/zinc/27/66/14/1296276614.db2.gz OOQSZTDSESMYQZ-DLBZAZTESA-N 1 3 331.504 2.586 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H]2C[NH2+]CCC2CCCCC2)C1 ZINC001277941528 1313307330 /nfs/dbraw/zinc/30/73/30/1313307330.db2.gz PITRQHOBEWHCBN-HKUYNNGSSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccc(C(=O)NCCN[C@@H]2CC[NH2+]C[C@H]2C2CCCC2)cc1F ZINC000925535366 1296850009 /nfs/dbraw/zinc/85/00/09/1296850009.db2.gz FLGZKYGJTXKNRR-PKOBYXMFSA-N 1 3 347.478 2.622 10 0 EFAEHO C(C[NH2+][C@H]1CCNC[C@H]1C1CCCC1)Cc1nnc2n1CCCCC2 ZINC000925574630 1296859388 /nfs/dbraw/zinc/85/93/88/1296859388.db2.gz WGYKUNZZWVNGMH-ROUUACIJSA-N 1 3 345.535 2.695 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN2CCCCC[C@H]2c2ccncc2)cnn1C ZINC000903872860 1313325994 /nfs/dbraw/zinc/32/59/94/1313325994.db2.gz KIDBFKZCTVCLGS-PXNSSMCTSA-N 1 3 341.503 2.858 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NC/C=C\C[NH2+]CCCc1ccc(Cl)cc1 ZINC001273909508 1297113980 /nfs/dbraw/zinc/11/39/80/1297113980.db2.gz GVDNXSSOFFEVFW-LHRDXKRPSA-N 1 3 349.906 2.629 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+](C)CCCCc2ccccc2)cnn1C ZINC000903885302 1313348007 /nfs/dbraw/zinc/34/80/07/1313348007.db2.gz KRAHCLHHTNNNQS-LJQANCHMSA-N 1 3 328.504 2.801 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+](C)CCCCc2ccccc2)cnn1C ZINC000903885302 1313348010 /nfs/dbraw/zinc/34/80/10/1313348010.db2.gz KRAHCLHHTNNNQS-LJQANCHMSA-N 1 3 328.504 2.801 10 0 EFAEHO COC[C@@H](C[NH+]1CCN(CCN(C)Cc2ccccc2)CC1)C(C)C ZINC000929607133 1297193529 /nfs/dbraw/zinc/19/35/29/1297193529.db2.gz UBCCWKPDQYLRMK-OAQYLSRUSA-N 1 3 347.547 2.655 10 0 EFAEHO COc1c(C)cc(CN(C)C[C@@H](C[NH3+])Cc2cnn(C)c2C)cc1C ZINC000903889647 1313358155 /nfs/dbraw/zinc/35/81/55/1313358155.db2.gz UVGJLXWQVWSOFD-GOSISDBHSA-N 1 3 344.503 2.603 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CC[C@H](c3ccccc3)[C@@H](C)C2)cnn1C ZINC000903896724 1313371869 /nfs/dbraw/zinc/37/18/69/1313371869.db2.gz DPUMKQNDYNEUTB-CDXJDZJCSA-N 1 3 340.515 2.972 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CC[C@H](c3ccccc3)[C@@H](C)C2)cnn1C ZINC000903896724 1313371873 /nfs/dbraw/zinc/37/18/73/1313371873.db2.gz DPUMKQNDYNEUTB-CDXJDZJCSA-N 1 3 340.515 2.972 10 0 EFAEHO Cc1c(C[C@H](CN)C[NH2+]C(C)(C)CCc2ccccc2)cnn1C ZINC000903897500 1313374221 /nfs/dbraw/zinc/37/42/21/1313374221.db2.gz FCNRIPKSDBKZLQ-GOSISDBHSA-N 1 3 328.504 2.847 10 0 EFAEHO CC[C@@H]1Cc2ccccc2CN1C[C@H](C[NH3+])Cc1cnn(C)c1C ZINC000903910590 1313397748 /nfs/dbraw/zinc/39/77/48/1313397748.db2.gz OJNQGOOBPSIESS-OXJNMPFZSA-N 1 3 326.488 2.683 10 0 EFAEHO CCCN(CCc1cccs1)Cc1cnnn1[C@H]1CCC[NH2+]C1 ZINC000903913120 1313403794 /nfs/dbraw/zinc/40/37/94/1313403794.db2.gz NBDVRXCFPQXDAD-HNNXBMFYSA-N 1 3 333.505 2.719 10 0 EFAEHO Cc1c(C[C@@H](CN)C[NH2+][C@H](Cc2ccc(F)cc2)C(C)C)cnn1C ZINC000903926470 1313428157 /nfs/dbraw/zinc/42/81/57/1313428157.db2.gz SMHNXJAHYIGVCD-FXAWDEMLSA-N 1 3 346.494 2.842 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN[C@@H]2CCc3c2cccc3Cl)cnn1C ZINC000903926478 1313428619 /nfs/dbraw/zinc/42/86/19/1313428619.db2.gz SQIOYQWQYULWRQ-FZKQIMNGSA-N 1 3 332.879 2.776 10 0 EFAEHO Cc1c(C[C@@H](CN)C[NH2+]CC(C)(C)c2ccccc2F)cnn1C ZINC000903922834 1313424371 /nfs/dbraw/zinc/42/43/71/1313424371.db2.gz GDIOJCHAGGRCQT-HNNXBMFYSA-N 1 3 332.467 2.552 10 0 EFAEHO Cc1c(C[C@@H](CN)C[NH2+][C@@H](C)C(C)(C)c2ccccc2)cnn1C ZINC000903922995 1313424833 /nfs/dbraw/zinc/42/48/33/1313424833.db2.gz JBLHQZJHMRXVRX-IRXDYDNUSA-N 1 3 328.504 2.802 10 0 EFAEHO Cc1c(C[C@H](CN)C[NH2+]CC(C)(C)c2ccccc2F)cnn1C ZINC000903922835 1313424931 /nfs/dbraw/zinc/42/49/31/1313424931.db2.gz GDIOJCHAGGRCQT-OAHLLOKOSA-N 1 3 332.467 2.552 10 0 EFAEHO Cc1c(C[C@H](CN)C[NH2+]CCc2csc3ccccc23)cnn1C ZINC000903924715 1313426137 /nfs/dbraw/zinc/42/61/37/1313426137.db2.gz HWMOWBGJXVEEJP-OAHLLOKOSA-N 1 3 342.512 2.893 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN[C@@]2(c3ccccc3)CC2(C)C)cnn1C ZINC000903933461 1313441385 /nfs/dbraw/zinc/44/13/85/1313441385.db2.gz RRMHQJHDPFADIU-OXQOHEQNSA-N 1 3 326.488 2.761 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@H+](CC3CCC3)[C@H]2C1(C)C ZINC001489088034 1298048706 /nfs/dbraw/zinc/04/87/06/1298048706.db2.gz UEYXDJFZYSMUAC-QXAKKESOSA-N 1 3 335.536 2.732 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@@H+](CC3CCC3)[C@H]2C1(C)C ZINC001489088034 1298048718 /nfs/dbraw/zinc/04/87/18/1298048718.db2.gz UEYXDJFZYSMUAC-QXAKKESOSA-N 1 3 335.536 2.732 10 0 EFAEHO CCCN(C)CC(=O)N1CCCCC[C@H]([NH2+]Cc2cnccc2C)C1 ZINC001489241726 1298151939 /nfs/dbraw/zinc/15/19/39/1298151939.db2.gz VYIGRKGDOUYHDG-IBGZPJMESA-N 1 3 346.519 2.593 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1CCN(C/C=C\Cl)CC(C)(C)C1 ZINC001489349071 1298206947 /nfs/dbraw/zinc/20/69/47/1298206947.db2.gz CFKWAURQKRRQFJ-WUKHSURWSA-N 1 3 329.916 2.688 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1CCN(C/C=C\Cl)CC(C)(C)C1 ZINC001489349071 1298206958 /nfs/dbraw/zinc/20/69/58/1298206958.db2.gz CFKWAURQKRRQFJ-WUKHSURWSA-N 1 3 329.916 2.688 10 0 EFAEHO Fc1cccc(F)c1-c1n[nH]cc1C[NH2+]C[C@H]1CNCCC1(F)F ZINC000903954823 1313480140 /nfs/dbraw/zinc/48/01/40/1313480140.db2.gz GVTNBBPHCRWDEZ-LLVKDONJSA-N 1 3 342.340 2.689 10 0 EFAEHO FC1(F)CCNC[C@H]1C[NH2+]Cc1ccc(OC[C@H]2CCCO2)cc1 ZINC000903955310 1313482118 /nfs/dbraw/zinc/48/21/18/1313482118.db2.gz OWVOEFBMWUIKAW-DOTOQJQBSA-N 1 3 340.414 2.579 10 0 EFAEHO c1ccc(OCCCCCN[C@@H]2C[NH2+]CC3(CCOCC3)C2)cc1 ZINC000903969213 1313513662 /nfs/dbraw/zinc/51/36/62/1313513662.db2.gz CSTRKOZBUQIVJI-SFHVURJKSA-N 1 3 332.488 2.984 10 0 EFAEHO C[C@@H](CCc1n[nH]c2ccccc21)N[C@@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903971714 1313518806 /nfs/dbraw/zinc/51/88/06/1313518806.db2.gz CFKUEGCFWSPAMH-HOTGVXAUSA-N 1 3 342.487 2.632 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C ZINC001490209241 1298602804 /nfs/dbraw/zinc/60/28/04/1298602804.db2.gz IZTDTGDWRCSFKB-SFHVURJKSA-N 1 3 337.483 2.658 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C ZINC001490209241 1298602809 /nfs/dbraw/zinc/60/28/09/1298602809.db2.gz IZTDTGDWRCSFKB-SFHVURJKSA-N 1 3 337.483 2.658 10 0 EFAEHO CN(CCCNC(=O)C1(C[NH+](C)C)CCCCC1)Cc1ccccn1 ZINC001490228306 1298637530 /nfs/dbraw/zinc/63/75/30/1298637530.db2.gz MDWTYXONXZAKCX-UHFFFAOYSA-N 1 3 346.519 2.532 10 0 EFAEHO C[C@@H](C(=O)NCCCN(C)Cc1ccsc1)[NH+]1CCCCCC1 ZINC001490255762 1298687313 /nfs/dbraw/zinc/68/73/13/1298687313.db2.gz HZUSDKBEBXXJDM-INIZCTEOSA-N 1 3 337.533 2.951 10 0 EFAEHO CC[N@H+](CCCNC(=O)Cc1nc[nH]c1C)C[C@H]1CCC(F)(F)C1 ZINC001490358355 1298840687 /nfs/dbraw/zinc/84/06/87/1298840687.db2.gz VYFMOBARTILJJE-AWEZNQCLSA-N 1 3 342.434 2.524 10 0 EFAEHO CC[N@@H+](CCCNC(=O)Cc1nc[nH]c1C)C[C@H]1CCC(F)(F)C1 ZINC001490358355 1298840694 /nfs/dbraw/zinc/84/06/94/1298840694.db2.gz VYFMOBARTILJJE-AWEZNQCLSA-N 1 3 342.434 2.524 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CCN(CCc2ccccc2)C1)[NH+](CC)CC ZINC001490560883 1298985609 /nfs/dbraw/zinc/98/56/09/1298985609.db2.gz ZPPWKKWECROFKL-OALUTQOASA-N 1 3 331.504 2.540 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1ccccc1C)C1CC1 ZINC001490670679 1299069602 /nfs/dbraw/zinc/06/96/02/1299069602.db2.gz FLDZGKQVMBNBHR-PMACEKPBSA-N 1 3 343.515 2.854 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CCc1cccs1)C1CC1 ZINC001490662046 1299105266 /nfs/dbraw/zinc/10/52/66/1299105266.db2.gz QHEZQIKCZVNLKG-QZTJIDSGSA-N 1 3 349.544 2.648 10 0 EFAEHO Cc1ccc(CN[C@H](CNC(=O)[C@@H]2CC[N@@H+](C)C2)C2CC2)c(Cl)c1 ZINC001490739729 1299176188 /nfs/dbraw/zinc/17/61/88/1299176188.db2.gz LAOVRKOTPOJFHX-SJLPKXTDSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1ccc(CN[C@H](CNC(=O)[C@@H]2CC[N@H+](C)C2)C2CC2)c(Cl)c1 ZINC001490739729 1299176191 /nfs/dbraw/zinc/17/61/91/1299176191.db2.gz LAOVRKOTPOJFHX-SJLPKXTDSA-N 1 3 349.906 2.585 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N1CCC[C@H](CN(C)C/C=C/Cl)C1 ZINC001490758738 1299198398 /nfs/dbraw/zinc/19/83/98/1299198398.db2.gz MCOIORCJZPLOCT-QOCAVEGASA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N1CCC[C@H](CN(C)C/C=C/Cl)C1 ZINC001490758738 1299198405 /nfs/dbraw/zinc/19/84/05/1299198405.db2.gz MCOIORCJZPLOCT-QOCAVEGASA-N 1 3 341.927 2.782 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC[C@H](CN(C)C/C=C\Cl)C2)CC[N@@H+]1C ZINC001490769022 1299219275 /nfs/dbraw/zinc/21/92/75/1299219275.db2.gz YTXZMJYPQMTEJI-WTCAJVMKSA-N 1 3 341.927 2.640 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC[C@H](CN(C)C/C=C\Cl)C2)CC[N@H+]1C ZINC001490769022 1299219278 /nfs/dbraw/zinc/21/92/78/1299219278.db2.gz YTXZMJYPQMTEJI-WTCAJVMKSA-N 1 3 341.927 2.640 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC[C@@H](CN(C)C/C=C/Cl)C2)CC[N@@H+]1C ZINC001490769021 1299219400 /nfs/dbraw/zinc/21/94/00/1299219400.db2.gz YTXZMJYPQMTEJI-HQBUCEQDSA-N 1 3 341.927 2.640 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC[C@@H](CN(C)C/C=C/Cl)C2)CC[N@H+]1C ZINC001490769021 1299219412 /nfs/dbraw/zinc/21/94/12/1299219412.db2.gz YTXZMJYPQMTEJI-HQBUCEQDSA-N 1 3 341.927 2.640 10 0 EFAEHO Cc1ccc(N2CC[C@H](N3CCC[C@@H](C4CC[NH2+]CC4)C3)C2=O)cc1 ZINC000852754240 1299864067 /nfs/dbraw/zinc/86/40/67/1299864067.db2.gz QQJFRMUTWDBIDX-QUCCMNQESA-N 1 3 341.499 2.812 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)C=C1CC[NH2+]CC1)c1cccc(OC)c1 ZINC000852856977 1299915394 /nfs/dbraw/zinc/91/53/94/1299915394.db2.gz HWMALFIKPQWJJC-LJQANCHMSA-N 1 3 345.487 2.504 10 0 EFAEHO Cc1ccc([C@H](C)NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)s1 ZINC000853473167 1300126366 /nfs/dbraw/zinc/12/63/66/1300126366.db2.gz MWELQIGPIPOYPD-ZFWWWQNUSA-N 1 3 340.537 2.689 10 0 EFAEHO Cc1ccc([C@H](C)NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)s1 ZINC000853473167 1300126371 /nfs/dbraw/zinc/12/63/71/1300126371.db2.gz MWELQIGPIPOYPD-ZFWWWQNUSA-N 1 3 340.537 2.689 10 0 EFAEHO Cc1ccc([C@@H](C)NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)s1 ZINC000853473166 1300126899 /nfs/dbraw/zinc/12/68/99/1300126899.db2.gz MWELQIGPIPOYPD-DZGCQCFKSA-N 1 3 340.537 2.689 10 0 EFAEHO Cc1ccc([C@@H](C)NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)s1 ZINC000853473166 1300126904 /nfs/dbraw/zinc/12/69/04/1300126904.db2.gz MWELQIGPIPOYPD-DZGCQCFKSA-N 1 3 340.537 2.689 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)C[C@H](N)c1cc(C)nc(Cl)c1 ZINC000854013655 1300389920 /nfs/dbraw/zinc/38/99/20/1300389920.db2.gz AUTJGXMKVXURNY-AWEZNQCLSA-N 1 3 340.899 2.670 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)C[C@H](N)c1cc(C)nc(Cl)c1 ZINC000854013655 1300389933 /nfs/dbraw/zinc/38/99/33/1300389933.db2.gz AUTJGXMKVXURNY-AWEZNQCLSA-N 1 3 340.899 2.670 10 0 EFAEHO CN(C)C1CC[NH+](C[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1 ZINC000113500077 1301036263 /nfs/dbraw/zinc/03/62/63/1301036263.db2.gz LECVBMXBCAHOJW-HNNXBMFYSA-N 1 3 325.497 2.660 10 0 EFAEHO CO[C@@H]1CN(C)[C@](C)(COC(=O)c2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000861350935 1302096255 /nfs/dbraw/zinc/09/62/55/1302096255.db2.gz GEIMFJIAIHCHSL-ICSRJNTNSA-N 1 3 346.471 2.548 10 0 EFAEHO CN1CCCC[C@H](C[NH2+]C[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)C1 ZINC000862483835 1302396383 /nfs/dbraw/zinc/39/63/83/1302396383.db2.gz ZHUPGYAVCSBSBJ-APWZRJJASA-N 1 3 339.524 2.955 10 0 EFAEHO C[C@@H]1CC[C@@H](N[C@@H]2CCCN(C(=O)Oc3ccccc3)CC2)C[NH2+]1 ZINC000863544888 1302644939 /nfs/dbraw/zinc/64/49/39/1302644939.db2.gz DPWLIEZBADROEJ-BRWVUGGUSA-N 1 3 331.460 2.770 10 0 EFAEHO C[C@@H](CCCCN1C(=O)c2ccccc2C1=O)N[C@@H]1CC[C@@H](C)[NH2+]C1 ZINC000863548287 1302645259 /nfs/dbraw/zinc/64/52/59/1302645259.db2.gz WSUMXUHXZFGWPY-OWCLPIDISA-N 1 3 343.471 2.572 10 0 EFAEHO CC(C)(C)OC(=O)NCc1cccc(CNCCC[NH+]2CCC2)c1 ZINC000865516017 1303292161 /nfs/dbraw/zinc/29/21/61/1303292161.db2.gz CYSIJQOGUBVTTB-UHFFFAOYSA-N 1 3 333.476 2.897 10 0 EFAEHO Cc1ccc(CN2CCO[C@H](CN[C@@H]3CC[N@@H+](C)C(C)(C)C3)C2)cc1 ZINC000865800566 1303406662 /nfs/dbraw/zinc/40/66/62/1303406662.db2.gz PCKWONYIKHVIIM-WOJBJXKFSA-N 1 3 345.531 2.658 10 0 EFAEHO Cc1ccc(CN2CCO[C@H](CN[C@@H]3CC[N@H+](C)C(C)(C)C3)C2)cc1 ZINC000865800566 1303406665 /nfs/dbraw/zinc/40/66/65/1303406665.db2.gz PCKWONYIKHVIIM-WOJBJXKFSA-N 1 3 345.531 2.658 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]C[C@@H]2c3ccccc3CN2C)[C@@H](C)C1 ZINC000866561830 1303687701 /nfs/dbraw/zinc/68/77/01/1303687701.db2.gz MIVJICVCJADRSI-DZFGPLHGSA-N 1 3 345.531 2.900 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]C[C@H]2c3ccccc3CN2C)[C@H](C)C1 ZINC000866561832 1303688132 /nfs/dbraw/zinc/68/81/32/1303688132.db2.gz MIVJICVCJADRSI-QMMLZNLJSA-N 1 3 345.531 2.900 10 0 EFAEHO CC[N@@H+]1CC[C@H](N[C@H]2C[C@H](C(=O)OCc3ccccc3)C2)[C@@H](C)C1 ZINC000866603668 1303707635 /nfs/dbraw/zinc/70/76/35/1303707635.db2.gz DJVVIAVNXLNVMI-WNHJNPCNSA-N 1 3 330.472 2.828 10 0 EFAEHO CC[N@H+]1CC[C@H](N[C@H]2C[C@H](C(=O)OCc3ccccc3)C2)[C@@H](C)C1 ZINC000866603668 1303707638 /nfs/dbraw/zinc/70/76/38/1303707638.db2.gz DJVVIAVNXLNVMI-WNHJNPCNSA-N 1 3 330.472 2.828 10 0 EFAEHO CC(=O)c1ccc(NC(=O)CCN2CC[C@](C[NH3+])(C(C)(C)C)C2)cc1 ZINC000866703817 1303757120 /nfs/dbraw/zinc/75/71/20/1303757120.db2.gz KSONYWQRXXZENV-HXUWFJFHSA-N 1 3 345.487 2.915 10 0 EFAEHO CC(C)c1ccc([C@H](C)N2CC[C@@H](N3C(=O)O[C@H]4C[NH2+]C[C@H]43)C2)cc1 ZINC000866712176 1303761756 /nfs/dbraw/zinc/76/17/56/1303761756.db2.gz RIHPXTLAHNESFX-PIKADFDJSA-N 1 3 343.471 2.738 10 0 EFAEHO O=C(NC[C@H]1CCCCN1Cc1ccccc1)[C@@H]1C[C@]12CCC[NH2+]C2 ZINC000867997112 1304067337 /nfs/dbraw/zinc/06/73/37/1304067337.db2.gz BKTCDBTZSAVZSQ-DYXWJJEUSA-N 1 3 341.499 2.547 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2ccc(C)cc2)[C@@H]1C ZINC001278317295 1314056407 /nfs/dbraw/zinc/05/64/07/1314056407.db2.gz YSXNQBSXHBNGJP-AZUAARDMSA-N 1 3 345.531 2.848 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2ccc(C)cc2)[C@H]1C ZINC001278317297 1314056623 /nfs/dbraw/zinc/05/66/23/1314056623.db2.gz YSXNQBSXHBNGJP-UYAOXDASSA-N 1 3 345.531 2.848 10 0 EFAEHO CCCCCC[N@@H+]1C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001276607555 1314068083 /nfs/dbraw/zinc/06/80/83/1314068083.db2.gz LPZZKDFYNNPNBS-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCCCC[N@H+]1C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001276607555 1314068086 /nfs/dbraw/zinc/06/80/86/1314068086.db2.gz LPZZKDFYNNPNBS-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)CCC12CC(C1)C[NH2+]2 ZINC000870891627 1305661433 /nfs/dbraw/zinc/66/14/33/1305661433.db2.gz IFUJJOFKDAXZNC-FQVISZRSSA-N 1 3 341.499 2.642 10 0 EFAEHO CC(=O)Nc1cccc(C[N@H+]2C[C@@]34CN(C)C[C@]3(C2)CCCC4)c1 ZINC001413090497 1307730467 /nfs/dbraw/zinc/73/04/67/1307730467.db2.gz FSLJFMCLEFASIY-BGYRXZFFSA-N 1 3 327.472 2.953 10 0 EFAEHO CC(=O)Nc1cccc(C[N@@H+]2C[C@@]34CN(C)C[C@]3(C2)CCCC4)c1 ZINC001413090497 1307730472 /nfs/dbraw/zinc/73/04/72/1307730472.db2.gz FSLJFMCLEFASIY-BGYRXZFFSA-N 1 3 327.472 2.953 10 0 EFAEHO CCCCC[NH2+]C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001265624187 1316837436 /nfs/dbraw/zinc/83/74/36/1316837436.db2.gz NFZBHIVHTKXEKF-QGZVFWFLSA-N 1 3 325.541 2.983 10 0 EFAEHO CC(C)N1CC[NH+](CCCN2CCc3cc(F)cc(F)c3C2)CC1 ZINC001413102095 1307891623 /nfs/dbraw/zinc/89/16/23/1307891623.db2.gz UOPQVGYWUCHIGI-UHFFFAOYSA-N 1 3 337.458 2.739 10 0 EFAEHO CC[NH+]1CCC(CNC(=O)c2ccc(NC3=NCCC3)cc2)CC1 ZINC000900354503 1308043788 /nfs/dbraw/zinc/04/37/88/1308043788.db2.gz DCCOXZZQTJCYOS-UHFFFAOYSA-N 1 3 328.460 2.753 10 0 EFAEHO O=C(c1ccc(NC2=NCCC2)cc1)N1CCC[C@H]1C[NH+]1CCCC1 ZINC000900443354 1308166702 /nfs/dbraw/zinc/16/67/02/1308166702.db2.gz VVLQSAHJDDNWJI-SFHVURJKSA-N 1 3 340.471 2.991 10 0 EFAEHO CCCCCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)[C@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001276669730 1314234218 /nfs/dbraw/zinc/23/42/18/1314234218.db2.gz JNKCGBAIJBWMDM-AKHDSKFASA-N 1 3 335.536 2.734 10 0 EFAEHO CCCCCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)[C@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001276669730 1314234221 /nfs/dbraw/zinc/23/42/21/1314234221.db2.gz JNKCGBAIJBWMDM-AKHDSKFASA-N 1 3 335.536 2.734 10 0 EFAEHO CN(CC1CC[NH+](C)CC1)C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000900573895 1308339517 /nfs/dbraw/zinc/33/95/17/1308339517.db2.gz FGNVCBSSSVHEHV-UHFFFAOYSA-N 1 3 328.460 2.705 10 0 EFAEHO O=C(N[C@@H]1CC[N@H+](CC2CC2)C1)c1ccc(NC2=NCCC2)cc1 ZINC000900628356 1308433406 /nfs/dbraw/zinc/43/34/06/1308433406.db2.gz XTOYLCRUYYXAHL-QGZVFWFLSA-N 1 3 326.444 2.505 10 0 EFAEHO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1ccc(NC2=NCCC2)cc1 ZINC000900628356 1308433409 /nfs/dbraw/zinc/43/34/09/1308433409.db2.gz XTOYLCRUYYXAHL-QGZVFWFLSA-N 1 3 326.444 2.505 10 0 EFAEHO CN(C(=O)c1ccc(NC2=NCCC2)cc1)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000900666782 1308496991 /nfs/dbraw/zinc/49/69/91/1308496991.db2.gz WEVYPLBQXBIOMX-KRWDZBQOSA-N 1 3 326.444 2.600 10 0 EFAEHO CN(C(=O)c1ccc(NC2=NCCC2)cc1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000900666782 1308496995 /nfs/dbraw/zinc/49/69/95/1308496995.db2.gz WEVYPLBQXBIOMX-KRWDZBQOSA-N 1 3 326.444 2.600 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CCCCCF)CC1(C)C ZINC001281566125 1318464159 /nfs/dbraw/zinc/46/41/59/1318464159.db2.gz DOXKTWYEAGWCKJ-MRXNPFEDSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CCCCCF)CC1(C)C ZINC001281566125 1318464163 /nfs/dbraw/zinc/46/41/63/1318464163.db2.gz DOXKTWYEAGWCKJ-MRXNPFEDSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C[N@@H+]1C1CC1 ZINC000900994087 1309132293 /nfs/dbraw/zinc/13/22/93/1309132293.db2.gz FVUGFXZJXFGZNT-CJNGLKHVSA-N 1 3 326.444 2.646 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C[N@H+]1C1CC1 ZINC000900994087 1309132297 /nfs/dbraw/zinc/13/22/97/1309132297.db2.gz FVUGFXZJXFGZNT-CJNGLKHVSA-N 1 3 326.444 2.646 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]CC/C=C/c2ccccc2)C1 ZINC001491079433 1311158551 /nfs/dbraw/zinc/15/85/51/1311158551.db2.gz BGEPTOUPKKZKJR-BZZHFGAJSA-N 1 3 329.488 2.667 10 0 EFAEHO CCc1ccc(CN2CCCC[C@H]2CNC(=O)CC[NH+](C)C)cc1 ZINC001491226231 1311177298 /nfs/dbraw/zinc/17/72/98/1311177298.db2.gz UERNCGUDWXJMBI-IBGZPJMESA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC1CCC([NH2+]CCC(F)(F)F)CC1 ZINC001491353428 1311187037 /nfs/dbraw/zinc/18/70/37/1311187037.db2.gz ZHXAXILDSNDCQZ-NRXISQOPSA-N 1 3 349.441 2.829 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001491487039 1311192432 /nfs/dbraw/zinc/19/24/32/1311192432.db2.gz TUVFDDJOHATLOU-NVXWUHKLSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001491487039 1311192436 /nfs/dbraw/zinc/19/24/36/1311192436.db2.gz TUVFDDJOHATLOU-NVXWUHKLSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CCC[C@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001277299514 1311947310 /nfs/dbraw/zinc/94/73/10/1311947310.db2.gz UYGKPQGWSLFOJC-IRXDYDNUSA-N 1 3 349.494 2.850 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CCC[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001277299515 1311947465 /nfs/dbraw/zinc/94/74/65/1311947465.db2.gz UYGKPQGWSLFOJC-SJORKVTESA-N 1 3 349.494 2.850 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@H](C)c2cccc(-n3ccnc3)c2)CC1 ZINC000902744671 1312071292 /nfs/dbraw/zinc/07/12/92/1312071292.db2.gz FCRKFQOLCTVYQM-GOSISDBHSA-N 1 3 341.503 2.551 10 0 EFAEHO CCN1CCN([C@H](C)C[NH2+][C@H](C)c2cccc(-n3ccnc3)c2)CC1 ZINC000902747430 1312073063 /nfs/dbraw/zinc/07/30/63/1312073063.db2.gz UKQOSBPGEIWMCC-QZTJIDSGSA-N 1 3 341.503 2.549 10 0 EFAEHO CC[C@H](F)CN1CC[C@H](CNC(=O)C2(C[NH+](C)C)CCCCC2)C1 ZINC001493223679 1312086371 /nfs/dbraw/zinc/08/63/71/1312086371.db2.gz OGQRVPCFFBKVFV-SJORKVTESA-N 1 3 341.515 2.685 10 0 EFAEHO c1ccc(CCN2CC[C@@H](C[NH2+][C@@H]3CC[C@@H]4[C@H]5OCC[C@H]5[C@@H]43)C2)cc1 ZINC000902790400 1312110295 /nfs/dbraw/zinc/11/02/95/1312110295.db2.gz QGHTUULUTQHTPA-YVZLVKDNSA-N 1 3 340.511 2.954 10 0 EFAEHO CCC/C=C\CC[N@H+](C)C1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001277429074 1312155166 /nfs/dbraw/zinc/15/51/66/1312155166.db2.gz HQXGPDVOHZWRNU-MJRGOJFPSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@@H+](C)C1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001277429074 1312155169 /nfs/dbraw/zinc/15/51/69/1312155169.db2.gz HQXGPDVOHZWRNU-MJRGOJFPSA-N 1 3 335.536 2.997 10 0 EFAEHO C1CCC([NH+]2CCC(N[C@@H]3CCCN4CCSC[C@@H]34)CC2)CC1 ZINC000903272573 1312527983 /nfs/dbraw/zinc/52/79/83/1312527983.db2.gz WMLNLEDOMITZQK-MOPGFXCFSA-N 1 3 337.577 2.953 10 0 EFAEHO C[C@@H]1C[NH2+]C[C@H]1CN(C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000903431150 1312667743 /nfs/dbraw/zinc/66/77/43/1312667743.db2.gz PFKIQYYJYCZEIC-ZBFHGGJFSA-N 1 3 330.451 2.936 10 0 EFAEHO Cc1ccc(CN[C@H]2C[C@@H](C)N(C(=O)CCCC[NH+](C)C)C2)c(C)n1 ZINC001278417705 1314537911 /nfs/dbraw/zinc/53/79/11/1314537911.db2.gz WJNOUCCYJYSNPY-APWZRJJASA-N 1 3 346.519 2.509 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1C[C@@H](C)N(C(=O)CN2CCCC2)C1 ZINC001278424390 1314562300 /nfs/dbraw/zinc/56/23/00/1314562300.db2.gz QNZWXINKBSXFBL-QUCCMNQESA-N 1 3 343.515 2.602 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H]1C[C@H](C)N(C(=O)CN2CCCC2)C1 ZINC001278424388 1314562725 /nfs/dbraw/zinc/56/27/25/1314562725.db2.gz QNZWXINKBSXFBL-AZUAARDMSA-N 1 3 343.515 2.602 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)cc1 ZINC001278425057 1314564112 /nfs/dbraw/zinc/56/41/12/1314564112.db2.gz YWACRNDOMFZGAR-ICSRJNTNSA-N 1 3 345.531 2.847 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@H](NC(=O)[C@H](C(C)C)N1CCCCC1)C1CC1 ZINC001276711244 1314689483 /nfs/dbraw/zinc/68/94/83/1314689483.db2.gz GWOPLUWGLFDEFJ-MOPGFXCFSA-N 1 3 335.536 2.948 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@](C)(C[NH2+]CCc3ccccc3)C2)CCC1 ZINC001278505992 1314934921 /nfs/dbraw/zinc/93/49/21/1314934921.db2.gz WHBSGSKASPEVCC-HXUWFJFHSA-N 1 3 343.515 2.542 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C[NH2+]CCCC1CCC1)C(C)(C)C ZINC001279027790 1316079340 /nfs/dbraw/zinc/07/93/40/1316079340.db2.gz HRTIFARJQAOWFD-QGZVFWFLSA-N 1 3 334.508 2.961 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C1C[NH+](CCC2=CCCCC2)C1)N(C)C ZINC001276388208 1316460830 /nfs/dbraw/zinc/46/08/30/1316460830.db2.gz DXRKIJNZYUTRPB-LPHOPBHVSA-N 1 3 335.536 2.900 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C1C[NH+](CCC2=CCCCC2)C1)N(C)C ZINC001276388207 1316460859 /nfs/dbraw/zinc/46/08/59/1316460859.db2.gz DXRKIJNZYUTRPB-APWZRJJASA-N 1 3 335.536 2.900 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C)[C@@H]1CC[NH2+]Cc1cccnc1 ZINC001264520504 1316627875 /nfs/dbraw/zinc/62/78/75/1316627875.db2.gz MBPUXWXCCBQPCY-HKUYNNGSSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)CC[NH2+]CC[C@H]1[C@@H](C)CCCN1C(=O)CN(C)C(C)C ZINC001264520858 1316628249 /nfs/dbraw/zinc/62/82/49/1316628249.db2.gz QPERRADJPICJCU-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[NH2+]CC[C@H]1[C@@H](C)CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001264521303 1316628561 /nfs/dbraw/zinc/62/85/61/1316628561.db2.gz XVEZXNLTXDPBJK-LPHOPBHVSA-N 1 3 331.504 2.989 10 0 EFAEHO C[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)[C@H](C[NH2+]CCC2CC2)C1 ZINC001264559470 1316631661 /nfs/dbraw/zinc/63/16/61/1316631661.db2.gz GDDSRPRKXGEAOR-AEFFLSMTSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)N1CCCCC[C@@H]([NH2+]CCCCCF)C1)N(C)C ZINC001264683979 1316655686 /nfs/dbraw/zinc/65/56/86/1316655686.db2.gz PINJJFCTZVCKLJ-IAGOWNOFSA-N 1 3 329.504 2.827 10 0 EFAEHO CC[C@@H](C(=O)N1CCCCC[C@H]([NH2+]CCCCCF)C1)N(C)C ZINC001264683980 1316655835 /nfs/dbraw/zinc/65/58/35/1316655835.db2.gz PINJJFCTZVCKLJ-IRXDYDNUSA-N 1 3 329.504 2.827 10 0 EFAEHO CC[C@]1(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CCC[NH2+]C1 ZINC000390767831 1316673813 /nfs/dbraw/zinc/67/38/13/1316673813.db2.gz GOEXHRMPKDJGID-ICSRJNTNSA-N 1 3 329.488 2.547 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)Cc1ccc(Cl)c(F)c1)N(C)C ZINC001265037331 1316697330 /nfs/dbraw/zinc/69/73/30/1316697330.db2.gz WGOXMLRGYLSJON-INIZCTEOSA-N 1 3 343.874 2.757 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)Cc1ccc(Cl)c(F)c1)N(C)C ZINC001265037331 1316697333 /nfs/dbraw/zinc/69/73/33/1316697333.db2.gz WGOXMLRGYLSJON-INIZCTEOSA-N 1 3 343.874 2.757 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](C)Cc1ccc(OC)cc1 ZINC001265072717 1316711194 /nfs/dbraw/zinc/71/11/94/1316711194.db2.gz CTLVDAWNOLJYRI-LJQANCHMSA-N 1 3 347.503 2.508 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](C)Cc1ccc(OC)cc1 ZINC001265072717 1316711196 /nfs/dbraw/zinc/71/11/96/1316711196.db2.gz CTLVDAWNOLJYRI-LJQANCHMSA-N 1 3 347.503 2.508 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](C)Cc1ccc(OC)cc1 ZINC001265072716 1316711342 /nfs/dbraw/zinc/71/13/42/1316711342.db2.gz CTLVDAWNOLJYRI-IBGZPJMESA-N 1 3 347.503 2.508 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](C)Cc1ccc(OC)cc1 ZINC001265072716 1316711344 /nfs/dbraw/zinc/71/13/44/1316711344.db2.gz CTLVDAWNOLJYRI-IBGZPJMESA-N 1 3 347.503 2.508 10 0 EFAEHO C[C@@H]([NH2+]CCCC1CCC1)[C@@H]1CCCCN1C(=O)Cc1c[nH]cn1 ZINC001265088210 1316716946 /nfs/dbraw/zinc/71/69/46/1316716946.db2.gz AUFHOSKDJCNJGQ-QAPCUYQASA-N 1 3 332.492 2.892 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC1(C[NH2+]C/C=C\Cl)CCCC1 ZINC001318632715 1328657418 /nfs/dbraw/zinc/65/74/18/1328657418.db2.gz MTLBJJYDKGSTBN-MLBQELRYSA-N 1 3 327.900 2.630 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](CC)[C@H]1CCc2ccccc21)N(C)C ZINC001265119371 1316726301 /nfs/dbraw/zinc/72/63/01/1316726301.db2.gz DTPVZVPAPKZUBY-MOPGFXCFSA-N 1 3 331.504 2.842 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](CC)[C@H]1CCc2ccccc21)N(C)C ZINC001265119371 1316726303 /nfs/dbraw/zinc/72/63/03/1316726303.db2.gz DTPVZVPAPKZUBY-MOPGFXCFSA-N 1 3 331.504 2.842 10 0 EFAEHO CCN(CCCNC(=O)C1CC[NH+](C)CC1)Cc1cc(C)ccc1F ZINC001265131396 1316730504 /nfs/dbraw/zinc/73/05/04/1316730504.db2.gz XJUNRFYNIMYGCE-UHFFFAOYSA-N 1 3 349.494 2.804 10 0 EFAEHO C[C@H](c1ccccc1F)[N@H+](CCCNC(=O)[C@@H]1CCCN1C)C1CC1 ZINC001265155799 1316742193 /nfs/dbraw/zinc/74/21/93/1316742193.db2.gz DZJDHISIUIGSNP-BEFAXECRSA-N 1 3 347.478 2.952 10 0 EFAEHO C[C@H](c1ccccc1F)[N@@H+](CCCNC(=O)[C@@H]1CCCN1C)C1CC1 ZINC001265155799 1316742194 /nfs/dbraw/zinc/74/21/94/1316742194.db2.gz DZJDHISIUIGSNP-BEFAXECRSA-N 1 3 347.478 2.952 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](C[C@@H]1CC[C@H]2C[C@H]2C1)C1CC1 ZINC001265182906 1316746564 /nfs/dbraw/zinc/74/65/64/1316746564.db2.gz VIFAIIATRLTCDG-IXDOHACOSA-N 1 3 344.503 2.668 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](C[C@@H]1CC[C@H]2C[C@H]2C1)C1CC1 ZINC001265182906 1316746566 /nfs/dbraw/zinc/74/65/66/1316746566.db2.gz VIFAIIATRLTCDG-IXDOHACOSA-N 1 3 344.503 2.668 10 0 EFAEHO CCC[NH2+]CC1(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CCCC1 ZINC001318655166 1328661985 /nfs/dbraw/zinc/66/19/85/1328661985.db2.gz WKNIOEBRVWSFOP-SFHVURJKSA-N 1 3 327.488 2.628 10 0 EFAEHO OC1(C[NH2+]CCOC2CCCC2)CCN(Cc2ccccc2)CC1 ZINC000701347399 1316831444 /nfs/dbraw/zinc/83/14/44/1316831444.db2.gz NJUACQXULKXCHL-UHFFFAOYSA-N 1 3 332.488 2.562 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H](C[NH2+]CCCC(C)(C)C)C2)C1 ZINC001265623787 1316837335 /nfs/dbraw/zinc/83/73/35/1316837335.db2.gz DTUWOTAYRFNFPZ-ZWKOTPCHSA-N 1 3 337.552 2.983 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H](C[NH2+]CCCc2ccccc2)C1)N(C)C ZINC001265624509 1316837641 /nfs/dbraw/zinc/83/76/41/1316837641.db2.gz SUUQKARSGFTPSF-UXHICEINSA-N 1 3 345.531 2.788 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NC[C@@H]2CCCCN2CCCCC(F)(F)F)C1 ZINC001265657448 1316845891 /nfs/dbraw/zinc/84/58/91/1316845891.db2.gz CYAOIFMNMRITIK-GJZGRUSLSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NC[C@@H]2CCCCN2CCCCC(F)(F)F)C1 ZINC001265657448 1316845894 /nfs/dbraw/zinc/84/58/94/1316845894.db2.gz CYAOIFMNMRITIK-GJZGRUSLSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NC[C@H]2CCCCN2CCCCC(F)(F)F)C1 ZINC001265657450 1316846075 /nfs/dbraw/zinc/84/60/75/1316846075.db2.gz CYAOIFMNMRITIK-LSDHHAIUSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NC[C@H]2CCCCN2CCCCC(F)(F)F)C1 ZINC001265657450 1316846077 /nfs/dbraw/zinc/84/60/77/1316846077.db2.gz CYAOIFMNMRITIK-LSDHHAIUSA-N 1 3 349.441 2.641 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NC2CCC([NH2+]CCCF)CC2)c1 ZINC001265744247 1316870636 /nfs/dbraw/zinc/87/06/36/1316870636.db2.gz AAKFSUVPQQCCAF-UHFFFAOYSA-N 1 3 335.467 2.738 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]CCCc1cccc(F)c1 ZINC001265774829 1316875805 /nfs/dbraw/zinc/87/58/05/1316875805.db2.gz JZIORPOMFOYHRQ-QFBILLFUSA-N 1 3 349.494 2.725 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@H+](C)[C@H]1CCc2c1cccc2F ZINC001265978241 1316935733 /nfs/dbraw/zinc/93/57/33/1316935733.db2.gz GERZFBIQTVTXBK-SFHVURJKSA-N 1 3 335.467 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@@H+](C)[C@H]1CCc2c1cccc2F ZINC001265978241 1316935734 /nfs/dbraw/zinc/93/57/34/1316935734.db2.gz GERZFBIQTVTXBK-SFHVURJKSA-N 1 3 335.467 2.591 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@H+](Cc2cccc(F)c2)C2CC2)CCC1 ZINC001266141414 1317089681 /nfs/dbraw/zinc/08/96/81/1317089681.db2.gz GJQKUFZVRZYCEC-UHFFFAOYSA-N 1 3 347.478 2.781 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@@H+](Cc2cccc(F)c2)C2CC2)CCC1 ZINC001266141414 1317089691 /nfs/dbraw/zinc/08/96/91/1317089691.db2.gz GJQKUFZVRZYCEC-UHFFFAOYSA-N 1 3 347.478 2.781 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(CC[NH2+]CC2CCC2)Cc2ccccc2)C1 ZINC001279318850 1317236399 /nfs/dbraw/zinc/23/63/99/1317236399.db2.gz RILTZVCJNYPLAC-GOSISDBHSA-N 1 3 343.515 2.747 10 0 EFAEHO C[C@H](c1ccccc1)[N@H+]1CC=C(CNC(=O)CN(C)C2CCC2)CC1 ZINC001279574995 1317306201 /nfs/dbraw/zinc/30/62/01/1317306201.db2.gz XRTSPMDKQBSXEP-QGZVFWFLSA-N 1 3 341.499 2.980 10 0 EFAEHO C[C@H](c1ccccc1)[N@@H+]1CC=C(CNC(=O)CN(C)C2CCC2)CC1 ZINC001279574995 1317306209 /nfs/dbraw/zinc/30/62/09/1317306209.db2.gz XRTSPMDKQBSXEP-QGZVFWFLSA-N 1 3 341.499 2.980 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1=CCN([C@H]2CCc3ccc(F)cc32)CC1 ZINC001279629219 1317338790 /nfs/dbraw/zinc/33/87/90/1317338790.db2.gz UMAATUWLYBMIBL-IBGZPJMESA-N 1 3 345.462 2.513 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1CC=C(CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001279637588 1317342049 /nfs/dbraw/zinc/34/20/49/1317342049.db2.gz ZCGVSOFYYGRQBG-ZWKOTPCHSA-N 1 3 335.536 2.759 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1CC=C(CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001279637588 1317342058 /nfs/dbraw/zinc/34/20/58/1317342058.db2.gz ZCGVSOFYYGRQBG-ZWKOTPCHSA-N 1 3 335.536 2.759 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1CC=C(CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001279637586 1317343489 /nfs/dbraw/zinc/34/34/89/1317343489.db2.gz ZCGVSOFYYGRQBG-QZTJIDSGSA-N 1 3 335.536 2.759 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1CC=C(CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001279637586 1317343498 /nfs/dbraw/zinc/34/34/98/1317343498.db2.gz ZCGVSOFYYGRQBG-QZTJIDSGSA-N 1 3 335.536 2.759 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1=CCN(Cc2ccc(C)cc2)CC1 ZINC001279668816 1317352942 /nfs/dbraw/zinc/35/29/42/1317352942.db2.gz IOQMAUJWIGYBSW-UHFFFAOYSA-N 1 3 329.488 2.585 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1=CCN(Cc2ccc(C)cc2)CC1 ZINC001279668816 1317352952 /nfs/dbraw/zinc/35/29/52/1317352952.db2.gz IOQMAUJWIGYBSW-UHFFFAOYSA-N 1 3 329.488 2.585 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](CC[NH2+]CCCc2ccsc2)C1 ZINC001280295251 1317499180 /nfs/dbraw/zinc/49/91/80/1317499180.db2.gz IZASRYSDUNPWMG-KRWDZBQOSA-N 1 3 349.544 2.605 10 0 EFAEHO C[C@@H](F)CC[NH2+]CC[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001280307567 1317502944 /nfs/dbraw/zinc/50/29/44/1317502944.db2.gz MUHSUESGSMMLAX-IAGOWNOFSA-N 1 3 349.494 2.938 10 0 EFAEHO CN(CC(=O)N1CCC[C@H](CC[NH2+]Cc2ccccc2)C1)C1CCC1 ZINC001318805288 1328706450 /nfs/dbraw/zinc/70/64/50/1328706450.db2.gz NWPWXZFXGRRYNE-LJQANCHMSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001403018546 1364219150 /nfs/dbraw/zinc/21/91/50/1364219150.db2.gz BZBKVMPNOGCDJJ-KGLIPLIRSA-N 1 3 325.884 2.663 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C)([NH2+]CCCc2ccccc2)CC1)N(C)C ZINC001281500426 1318370827 /nfs/dbraw/zinc/37/08/27/1318370827.db2.gz UYYILWMSAOHSFW-LJQANCHMSA-N 1 3 345.531 2.930 10 0 EFAEHO CCC[NH2+]CC1(c2ccccc2)CCN(C(=O)[C@H](CC)N(C)C)CC1 ZINC001281586155 1318491298 /nfs/dbraw/zinc/49/12/98/1318491298.db2.gz JGCQVPKJOQLGTD-IBGZPJMESA-N 1 3 345.531 2.887 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)CN(C)C2CCC2)CC[N@@H+]1CCCCCF ZINC001281664328 1318530082 /nfs/dbraw/zinc/53/00/82/1318530082.db2.gz KLFPEZQKOKDKGG-HZPDHXFCSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)CN(C)C2CCC2)CC[N@H+]1CCCCCF ZINC001281664328 1318530090 /nfs/dbraw/zinc/53/00/90/1318530090.db2.gz KLFPEZQKOKDKGG-HZPDHXFCSA-N 1 3 327.488 2.580 10 0 EFAEHO CN(C)C1(C(=O)NC2CC(C[NH2+]CCCc3ccsc3)C2)CCC1 ZINC001282014898 1318664531 /nfs/dbraw/zinc/66/45/31/1318664531.db2.gz OGJMAMCSEWOWSK-UHFFFAOYSA-N 1 3 349.544 2.649 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]CCCc1cccc(F)c1 ZINC001282139276 1318746624 /nfs/dbraw/zinc/74/66/24/1318746624.db2.gz BCXPWEHDYHUYQJ-HOTGVXAUSA-N 1 3 349.494 2.725 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H]1C[NH2+]CCCCCF ZINC001319132561 1328785593 /nfs/dbraw/zinc/78/55/93/1328785593.db2.gz PXKBLJJQKUQHGF-IAGOWNOFSA-N 1 3 327.488 2.581 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CCCN1C)CC2 ZINC001319140276 1328788035 /nfs/dbraw/zinc/78/80/35/1328788035.db2.gz UINIRDMQONFDTP-XDXAGZTOSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CCCN1C)CC2 ZINC001319140276 1328788037 /nfs/dbraw/zinc/78/80/37/1328788037.db2.gz UINIRDMQONFDTP-XDXAGZTOSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC2(C1)CCN(C(=O)CN1CC[C@@H](C)C1)CC2 ZINC001319145110 1328790711 /nfs/dbraw/zinc/79/07/11/1328790711.db2.gz OFZSOHWDZSZZFB-PHWHVTFISA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC2(C1)CCN(C(=O)CN1CC[C@@H](C)C1)CC2 ZINC001319145110 1328790719 /nfs/dbraw/zinc/79/07/19/1328790719.db2.gz OFZSOHWDZSZZFB-PHWHVTFISA-N 1 3 347.547 2.999 10 0 EFAEHO CCC/C=C/CC[N@H+]1C[C@@H]2C(CNC(=O)[C@@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001282858984 1319165620 /nfs/dbraw/zinc/16/56/20/1319165620.db2.gz ONJWONNJLOMMOZ-NYNFVCCZSA-N 1 3 347.547 2.900 10 0 EFAEHO CCC/C=C/CC[N@@H+]1C[C@@H]2C(CNC(=O)[C@@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001282858984 1319165623 /nfs/dbraw/zinc/16/56/23/1319165623.db2.gz ONJWONNJLOMMOZ-NYNFVCCZSA-N 1 3 347.547 2.900 10 0 EFAEHO CCCCC[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)Cc3nc[nH]c3C)C[C@@H]2C1 ZINC001282959563 1319219170 /nfs/dbraw/zinc/21/91/70/1319219170.db2.gz VFQPWNUGGPZAOP-GVDBMIGSSA-N 1 3 332.492 2.668 10 0 EFAEHO CCCCC[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Cc3nc[nH]c3C)C[C@@H]2C1 ZINC001282959563 1319219182 /nfs/dbraw/zinc/21/91/82/1319219182.db2.gz VFQPWNUGGPZAOP-GVDBMIGSSA-N 1 3 332.492 2.668 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CCCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001282973319 1319229451 /nfs/dbraw/zinc/22/94/51/1319229451.db2.gz SYACRKJKTHHRJF-SFFCAUCYSA-N 1 3 347.547 2.999 10 0 EFAEHO CCC/C=C\CC[N@H+]1CCCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001282973319 1319229457 /nfs/dbraw/zinc/22/94/57/1319229457.db2.gz SYACRKJKTHHRJF-SFFCAUCYSA-N 1 3 347.547 2.999 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CCCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001282973322 1319229657 /nfs/dbraw/zinc/22/96/57/1319229657.db2.gz SYACRKJKTHHRJF-UEKDZROGSA-N 1 3 347.547 2.999 10 0 EFAEHO CCC/C=C/CC[N@H+]1CCCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001282973322 1319229664 /nfs/dbraw/zinc/22/96/64/1319229664.db2.gz SYACRKJKTHHRJF-UEKDZROGSA-N 1 3 347.547 2.999 10 0 EFAEHO C[C@@H](CCC[NH2+]CC1CCC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001283239770 1319454732 /nfs/dbraw/zinc/45/47/32/1319454732.db2.gz OPHRRPNIDFMTDK-HNAYVOBHSA-N 1 3 341.515 2.874 10 0 EFAEHO CC/C=C/CC[NH+]1CC2(C1)CCN(C(=O)C1(N(C)C)CCC1)CC2 ZINC001319402376 1328872962 /nfs/dbraw/zinc/87/29/62/1328872962.db2.gz IIPIEDRSMWHIRD-AATRIKPKSA-N 1 3 333.520 2.751 10 0 EFAEHO CC(C)(C)[C@H](C[NH2+]C/C=C\Cl)NC(=O)C(C)(C)N1CCCC1 ZINC001284613257 1320440050 /nfs/dbraw/zinc/44/00/50/1320440050.db2.gz CSCAVSWKIBTQSD-CKXPSTMWSA-N 1 3 329.916 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C[NH2+]CCc1ccccc1)C(C)(C)C)N(C)C ZINC001284642099 1320453868 /nfs/dbraw/zinc/45/38/68/1320453868.db2.gz CSFGSLJOOBHERK-RTBURBONSA-N 1 3 347.547 2.936 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C[NH2+]CCc1ccccc1)C(C)(C)C)N(C)C ZINC001284642097 1320453913 /nfs/dbraw/zinc/45/39/13/1320453913.db2.gz CSFGSLJOOBHERK-RBUKOAKNSA-N 1 3 347.547 2.936 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C[NH2+]CCCF)C(C)(C)C)N1CCCCC1 ZINC001284652261 1320457787 /nfs/dbraw/zinc/45/77/87/1320457787.db2.gz HCFSMINMKUDZBP-DLBZAZTESA-N 1 3 343.531 2.977 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C1CC(N(C)C(=O)CN(C)C(C)C)C1 ZINC001284818476 1320548754 /nfs/dbraw/zinc/54/87/54/1320548754.db2.gz FEGPHXPMGFNQSX-UHFFFAOYSA-N 1 3 345.531 2.847 10 0 EFAEHO CC/C=C\CC[NH+]1CCC(C2(NC(=O)Cc3nc[nH]c3C)CC2)CC1 ZINC001284845842 1320560489 /nfs/dbraw/zinc/56/04/89/1320560489.db2.gz DFQLXKAIAUXSNU-PLNGDYQASA-N 1 3 344.503 2.978 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1CC=C(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001284920269 1320596785 /nfs/dbraw/zinc/59/67/85/1320596785.db2.gz DKXVOPJJZHHZMR-QGZVFWFLSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1CC=C(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001284920269 1320596792 /nfs/dbraw/zinc/59/67/92/1320596792.db2.gz DKXVOPJJZHHZMR-QGZVFWFLSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)C[C@@H](CNCCF)NC(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001319609467 1328929303 /nfs/dbraw/zinc/92/93/03/1328929303.db2.gz MVQJSWAREJTNAH-SJORKVTESA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)C[C@@H](CNCCF)NC(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001319609467 1328929306 /nfs/dbraw/zinc/92/93/06/1328929306.db2.gz MVQJSWAREJTNAH-SJORKVTESA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)C[C@H](C[NH2+]CC1=CCCCC1)NC(=O)CN1CC[C@H](C)C1 ZINC001319635735 1328935309 /nfs/dbraw/zinc/93/53/09/1328935309.db2.gz YYWDPCJZLCXKIY-PKOBYXMFSA-N 1 3 335.536 2.949 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@H](NC(=O)C1(N(C)C)CCC1)C1CCCCC1 ZINC001319658044 1328940599 /nfs/dbraw/zinc/94/05/99/1328940599.db2.gz UTMNPSKXHDHLCL-NVXWUHKLSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C[NH2+]CCF)C1CCCCC1 ZINC001319662268 1328943379 /nfs/dbraw/zinc/94/33/79/1328943379.db2.gz IGZGHKZHXLNEAN-ROUUACIJSA-N 1 3 341.515 2.874 10 0 EFAEHO CCC/C=C\CC[NH2+]C[C@@H]1[C@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001319860587 1329017601 /nfs/dbraw/zinc/01/76/01/1329017601.db2.gz GXZPRLBPHHSRII-GOVFWEMJSA-N 1 3 332.492 2.915 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CCC[C@H]2CCC[N@@H+]21)CC1=CCCCC1 ZINC001320058301 1329066692 /nfs/dbraw/zinc/06/66/92/1329066692.db2.gz LWLSPPPLFVWSLC-RBUKOAKNSA-N 1 3 333.520 2.894 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CCC[C@H]2CCC[N@H+]21)CC1=CCCCC1 ZINC001320058301 1329066696 /nfs/dbraw/zinc/06/66/96/1329066696.db2.gz LWLSPPPLFVWSLC-RBUKOAKNSA-N 1 3 333.520 2.894 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@@H]21 ZINC001320112580 1329085230 /nfs/dbraw/zinc/08/52/30/1329085230.db2.gz ULQJPEBMXMAVME-ROUUACIJSA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@@H]21 ZINC001320112580 1329085233 /nfs/dbraw/zinc/08/52/33/1329085233.db2.gz ULQJPEBMXMAVME-ROUUACIJSA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]Cc1ccc(C(C)(C)C)cc1 ZINC001491682691 1323787805 /nfs/dbraw/zinc/78/78/05/1323787805.db2.gz OFBLRCXERFXHBM-MRXNPFEDSA-N 1 3 333.520 2.919 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[NH2+]C[C@@H]2CCCC(F)(F)C2)C1 ZINC001491849729 1323944667 /nfs/dbraw/zinc/94/46/67/1323944667.db2.gz LBPCAYARRWIGHA-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001491856956 1323951539 /nfs/dbraw/zinc/95/15/39/1323951539.db2.gz WFXHHLFNDWPCCV-AEFFLSMTSA-N 1 3 335.467 2.548 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H]2CCC[C@@H]([NH2+]CCCF)C2)c1 ZINC001491897664 1324007099 /nfs/dbraw/zinc/00/70/99/1324007099.db2.gz ZEZQMOIFHCVLDR-QZTJIDSGSA-N 1 3 335.467 2.738 10 0 EFAEHO C[C@H](CC[NH2+]CC1CCC(F)(F)CC1)NC(=O)C1(N(C)C)CCC1 ZINC001320446063 1329133435 /nfs/dbraw/zinc/13/34/35/1329133435.db2.gz LHQAXNFFTUZEQH-CQSZACIVSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001492034742 1324194459 /nfs/dbraw/zinc/19/44/59/1324194459.db2.gz MUBJFBCNODDPTC-QAPCUYQASA-N 1 3 329.488 2.643 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]CCc1ccc(C)cc1 ZINC001492128938 1324235822 /nfs/dbraw/zinc/23/58/22/1324235822.db2.gz JCAHREUYFUOFBX-UYAOXDASSA-N 1 3 345.531 2.896 10 0 EFAEHO C[C@H](CCNC(=O)CN(C)CC(C)(C)C)[NH2+]Cc1ccsc1 ZINC001492085490 1324246302 /nfs/dbraw/zinc/24/63/02/1324246302.db2.gz WXGMUKRBFMMBBE-CQSZACIVSA-N 1 3 325.522 2.710 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@H+](C)Cc2ccc(C3CC3)cc2)CCC1 ZINC001492277772 1324396527 /nfs/dbraw/zinc/39/65/27/1324396527.db2.gz GELTYIBEIDZOGT-UHFFFAOYSA-N 1 3 329.488 2.596 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@@H+](C)Cc2ccc(C3CC3)cc2)CCC1 ZINC001492277772 1324396536 /nfs/dbraw/zinc/39/65/36/1324396536.db2.gz GELTYIBEIDZOGT-UHFFFAOYSA-N 1 3 329.488 2.596 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001492293907 1324436389 /nfs/dbraw/zinc/43/63/89/1324436389.db2.gz QGNQPBDGODQXPX-SFHVURJKSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001492293907 1324436393 /nfs/dbraw/zinc/43/63/93/1324436393.db2.gz QGNQPBDGODQXPX-SFHVURJKSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1cccc([C@H](C)N(C)CCNC(=O)C23CCC[NH+](CCC2)C3)c1 ZINC001492299398 1324440676 /nfs/dbraw/zinc/44/06/76/1324440676.db2.gz VQFOMSCFQFFSQD-SFHVURJKSA-N 1 3 343.515 2.980 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCN(C)[C@H]2CCc3c2cccc3F)CC[N@@H+]1C ZINC001492386845 1324468813 /nfs/dbraw/zinc/46/88/13/1324468813.db2.gz QOZJLAKTKICVJV-DOXZYTNZSA-N 1 3 347.478 2.591 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCN(C)[C@H]2CCc3c2cccc3F)CC[N@H+]1C ZINC001492386845 1324468817 /nfs/dbraw/zinc/46/88/17/1324468817.db2.gz QOZJLAKTKICVJV-DOXZYTNZSA-N 1 3 347.478 2.591 10 0 EFAEHO CC/C=C\CC[N@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001492423232 1324501085 /nfs/dbraw/zinc/50/10/85/1324501085.db2.gz NMAVLZSHFZWJQW-JTHGQSKGSA-N 1 3 327.488 2.603 10 0 EFAEHO CC/C=C\CC[N@@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001492423232 1324501094 /nfs/dbraw/zinc/50/10/94/1324501094.db2.gz NMAVLZSHFZWJQW-JTHGQSKGSA-N 1 3 327.488 2.603 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1sccc1Cl)N(C)C ZINC001320605719 1329175972 /nfs/dbraw/zinc/17/59/72/1329175972.db2.gz DLOXWSCDFAKIOF-WCQYABFASA-N 1 3 331.913 2.726 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C)c(C)c1 ZINC001316846919 1325213096 /nfs/dbraw/zinc/21/30/96/1325213096.db2.gz RHIOCKQGNZQINA-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C)c(C)c1 ZINC001316846919 1325213100 /nfs/dbraw/zinc/21/31/00/1325213100.db2.gz RHIOCKQGNZQINA-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO CC/C=C\CC[N@H+](C)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001316850633 1325218690 /nfs/dbraw/zinc/21/86/90/1325218690.db2.gz GRQVOEJMTITIFM-FQQSSWHASA-N 1 3 341.515 2.993 10 0 EFAEHO CC/C=C\CC[N@@H+](C)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001316850633 1325218700 /nfs/dbraw/zinc/21/87/00/1325218700.db2.gz GRQVOEJMTITIFM-FQQSSWHASA-N 1 3 341.515 2.993 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](C)[C@@H]2CCc3ccc(F)cc32)C1 ZINC001316851158 1325221989 /nfs/dbraw/zinc/22/19/89/1325221989.db2.gz QITXDGXBHXAKIG-DNVCBOLYSA-N 1 3 347.478 2.593 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](C)[C@@H]2CCc3ccc(F)cc32)C1 ZINC001316851158 1325221996 /nfs/dbraw/zinc/22/19/96/1325221996.db2.gz QITXDGXBHXAKIG-DNVCBOLYSA-N 1 3 347.478 2.593 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](C)Cc1ccc(C)c(F)c1 ZINC001316870764 1325239480 /nfs/dbraw/zinc/23/94/80/1325239480.db2.gz RQYAZKQRCJUWSA-LJQANCHMSA-N 1 3 349.494 2.947 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](C)Cc1ccc(C)c(F)c1 ZINC001316870764 1325239492 /nfs/dbraw/zinc/23/94/92/1325239492.db2.gz RQYAZKQRCJUWSA-LJQANCHMSA-N 1 3 349.494 2.947 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](C)Cc1ccc(C)c(F)c1 ZINC001316870761 1325239767 /nfs/dbraw/zinc/23/97/67/1325239767.db2.gz RQYAZKQRCJUWSA-IBGZPJMESA-N 1 3 349.494 2.947 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](C)Cc1ccc(C)c(F)c1 ZINC001316870761 1325239775 /nfs/dbraw/zinc/23/97/75/1325239775.db2.gz RQYAZKQRCJUWSA-IBGZPJMESA-N 1 3 349.494 2.947 10 0 EFAEHO CC[N@H+](CCCNC(=O)[C@@H]1CCCN1C)Cc1ccc(Cl)s1 ZINC001316886905 1325267486 /nfs/dbraw/zinc/26/74/86/1325267486.db2.gz LJKVENCULPCURG-AWEZNQCLSA-N 1 3 343.924 2.824 10 0 EFAEHO CC[N@@H+](CCCNC(=O)[C@@H]1CCCN1C)Cc1ccc(Cl)s1 ZINC001316886905 1325267496 /nfs/dbraw/zinc/26/74/96/1325267496.db2.gz LJKVENCULPCURG-AWEZNQCLSA-N 1 3 343.924 2.824 10 0 EFAEHO CC[N@H+](CCCNC(=O)Cc1nc[nH]c1C)[C@H]1CCc2ccccc21 ZINC001316906576 1325317268 /nfs/dbraw/zinc/31/72/68/1325317268.db2.gz ZWTMPNACFYQDHF-IBGZPJMESA-N 1 3 340.471 2.776 10 0 EFAEHO CC[N@@H+](CCCNC(=O)Cc1nc[nH]c1C)[C@H]1CCc2ccccc21 ZINC001316906576 1325317279 /nfs/dbraw/zinc/31/72/79/1325317279.db2.gz ZWTMPNACFYQDHF-IBGZPJMESA-N 1 3 340.471 2.776 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC23CC[NH+](CCCCCF)CC3)CCC1 ZINC001316998544 1325466668 /nfs/dbraw/zinc/46/66/68/1325466668.db2.gz OHZLEYHMVRORMT-INIZCTEOSA-N 1 3 339.499 2.581 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC23CC[NH+](CC2=CCCCC2)CC3)CCC1 ZINC001316999545 1325468364 /nfs/dbraw/zinc/46/83/64/1325468364.db2.gz XTIDMKNQRUXVNZ-SFHVURJKSA-N 1 3 345.531 2.942 10 0 EFAEHO CC/C=C\CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001317047207 1325517242 /nfs/dbraw/zinc/51/72/42/1325517242.db2.gz LFBWAAUICPJKKD-BYWFETGPSA-N 1 3 333.520 2.892 10 0 EFAEHO CC/C=C\CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001317047207 1325517250 /nfs/dbraw/zinc/51/72/50/1325517250.db2.gz LFBWAAUICPJKKD-BYWFETGPSA-N 1 3 333.520 2.892 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)cc1 ZINC001317078807 1325546066 /nfs/dbraw/zinc/54/60/66/1325546066.db2.gz ANOFWURTCXVORF-UFYCRDLUSA-N 1 3 345.531 2.751 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(C(F)F)cc1)C(=O)[C@H]1CCCN1C ZINC001322441458 1329458959 /nfs/dbraw/zinc/45/89/59/1329458959.db2.gz CACRMRRCNZJVPB-MRXNPFEDSA-N 1 3 339.430 2.657 10 0 EFAEHO CN(C)C1(C(=O)NC/C=C\C[NH2+]CC2CCC3(CC3)CC2)CCC1 ZINC001321092734 1329341802 /nfs/dbraw/zinc/34/18/02/1329341802.db2.gz RZAXJOISSMTIND-ARJAWSKDSA-N 1 3 333.520 2.703 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]C/C=C\CNC(=O)CN(C)C1CCC1 ZINC001321095462 1329342342 /nfs/dbraw/zinc/34/23/42/1329342342.db2.gz IUEZMWCOMUBCAO-JTGQJZMRSA-N 1 3 329.488 2.802 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)NC/C=C/CNC/C=C/Cl ZINC001321126752 1329346625 /nfs/dbraw/zinc/34/66/25/1329346625.db2.gz PZRHWIGDIUHBOQ-HRCSPUOPSA-N 1 3 327.900 2.654 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)NC/C=C/CNC/C=C/Cl ZINC001321126752 1329346628 /nfs/dbraw/zinc/34/66/28/1329346628.db2.gz PZRHWIGDIUHBOQ-HRCSPUOPSA-N 1 3 327.900 2.654 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)NC/C=C\CNC/C=C\Cl ZINC001321126753 1329346722 /nfs/dbraw/zinc/34/67/22/1329346722.db2.gz PZRHWIGDIUHBOQ-NJMVCRMVSA-N 1 3 327.900 2.654 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)NC/C=C\CNC/C=C\Cl ZINC001321126753 1329346724 /nfs/dbraw/zinc/34/67/24/1329346724.db2.gz PZRHWIGDIUHBOQ-NJMVCRMVSA-N 1 3 327.900 2.654 10 0 EFAEHO C[C@@H](NC/C=C/CNC(=O)C12CCC[NH+]1CCC2)c1cccc(F)c1 ZINC001321142479 1329348557 /nfs/dbraw/zinc/34/85/57/1329348557.db2.gz SYCJOEPGJNPPKI-WOMSROEHSA-N 1 3 345.462 2.777 10 0 EFAEHO C[C@@H]([NH2+]C/C=C\CNC(=O)CN1CCC(C)CC1)c1cccc(F)c1 ZINC001321301341 1329370025 /nfs/dbraw/zinc/37/00/25/1329370025.db2.gz AHMFQXNVDAGKPK-CWIOURORSA-N 1 3 347.478 2.881 10 0 EFAEHO C[C@H]([NH2+]C/C=C\CNC(=O)CN1CCC(C)CC1)c1cccc(F)c1 ZINC001321301346 1329370188 /nfs/dbraw/zinc/37/01/88/1329370188.db2.gz AHMFQXNVDAGKPK-LIMHQNJXSA-N 1 3 347.478 2.881 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H]1CCC[N@H+](CC2=CCCCC2)C1 ZINC001317205529 1327740632 /nfs/dbraw/zinc/74/06/32/1327740632.db2.gz PRRGPACFARKGIO-QAPCUYQASA-N 1 3 344.503 2.978 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H]1CCC[N@@H+](CC2=CCCCC2)C1 ZINC001317205529 1327740641 /nfs/dbraw/zinc/74/06/41/1327740641.db2.gz PRRGPACFARKGIO-QAPCUYQASA-N 1 3 344.503 2.978 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](C[NH2+]CCc2ccccc2)C1)CC(C)(C)C ZINC001317337943 1327867215 /nfs/dbraw/zinc/86/72/15/1327867215.db2.gz NUDSFSKGKNMUCQ-IBGZPJMESA-N 1 3 345.531 2.645 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]([NH2+]CCCc2ccccc2)C1 ZINC001317366275 1327906111 /nfs/dbraw/zinc/90/61/11/1327906111.db2.gz OZPJONGOMXNIOS-UXHICEINSA-N 1 3 345.531 2.976 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]([NH2+]CCCc2ccccc2)C1 ZINC001317366276 1327906534 /nfs/dbraw/zinc/90/65/34/1327906534.db2.gz OZPJONGOMXNIOS-VQTJNVASSA-N 1 3 345.531 2.976 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)CC[NH+]2CCCCC2)cs1 ZINC001321415954 1329384117 /nfs/dbraw/zinc/38/41/17/1329384117.db2.gz GFOOFPSEPGHOMI-ARJAWSKDSA-N 1 3 335.517 2.695 10 0 EFAEHO CC(C)N(C)CC(=O)NC/C=C\C[NH2+][C@@H]1CCCc2ccccc21 ZINC001321419369 1329385060 /nfs/dbraw/zinc/38/50/60/1329385060.db2.gz PHJUDIPUDICJPE-LIXSYLKWSA-N 1 3 329.488 2.666 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)[C@H]2CCC[N@H+]2CC(C)C)c1 ZINC001317603033 1328182495 /nfs/dbraw/zinc/18/24/95/1328182495.db2.gz JHWFIXKVBOZJJM-LJQANCHMSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)[C@H]2CCC[N@@H+]2CC(C)C)c1 ZINC001317603033 1328182502 /nfs/dbraw/zinc/18/25/02/1328182502.db2.gz JHWFIXKVBOZJJM-LJQANCHMSA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@H](C[NH2+]C/C=C\c1ccccc1)NC(=O)CN(C)CC(C)(C)C ZINC001321652291 1329401447 /nfs/dbraw/zinc/40/14/47/1329401447.db2.gz HBWPRTBNUIGHRF-QJWNTBNXSA-N 1 3 331.504 2.772 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC001317658613 1328247482 /nfs/dbraw/zinc/24/74/82/1328247482.db2.gz PTNOPJNLGLSDAO-UHFFFAOYSA-N 1 3 346.302 2.883 10 0 EFAEHO CC(C)N(CCF)CCCNC(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001317686007 1328289499 /nfs/dbraw/zinc/28/94/99/1328289499.db2.gz HKVZLGBBATWCHN-KRWDZBQOSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(CCF)CCCNC(=O)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001317686007 1328289508 /nfs/dbraw/zinc/28/95/08/1328289508.db2.gz HKVZLGBBATWCHN-KRWDZBQOSA-N 1 3 341.515 2.827 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(C(F)F)cc1)C(=O)[C@@H]1CCCN1C ZINC001322441457 1329459032 /nfs/dbraw/zinc/45/90/32/1329459032.db2.gz CACRMRRCNZJVPB-INIZCTEOSA-N 1 3 339.430 2.657 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)CN(C)C1CCC1)c1ccccc1F ZINC001322544620 1329466497 /nfs/dbraw/zinc/46/64/97/1329466497.db2.gz WXOGJMLOCVYCMG-OAHLLOKOSA-N 1 3 335.467 2.809 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]Cc1cc2ccccc2o1)N(C)C ZINC001322792948 1329488643 /nfs/dbraw/zinc/48/86/43/1329488643.db2.gz OAXSJTFHMMRQGQ-QGZVFWFLSA-N 1 3 331.460 2.711 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]([C@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001380991912 1348010465 /nfs/dbraw/zinc/01/04/65/1348010465.db2.gz ZBBHWLGRFAGCNJ-MOPGFXCFSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]([C@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001380991912 1348010470 /nfs/dbraw/zinc/01/04/70/1348010470.db2.gz ZBBHWLGRFAGCNJ-MOPGFXCFSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]([C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001380991915 1348010507 /nfs/dbraw/zinc/01/05/07/1348010507.db2.gz ZBBHWLGRFAGCNJ-RBUKOAKNSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]([C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001380991915 1348010509 /nfs/dbraw/zinc/01/05/09/1348010509.db2.gz ZBBHWLGRFAGCNJ-RBUKOAKNSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]CCCC(C)C ZINC001323166567 1329519119 /nfs/dbraw/zinc/51/91/19/1329519119.db2.gz DCQYPUYJYHUHAA-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H](C2CCN(C(=O)CN3CCCC3)CC2)C1 ZINC001323637699 1329557295 /nfs/dbraw/zinc/55/72/95/1329557295.db2.gz MQBCISQMRWGXIE-WUUFJKRQSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H](C2CCN(C(=O)CN3CCCC3)CC2)C1 ZINC001323637699 1329557296 /nfs/dbraw/zinc/55/72/96/1329557296.db2.gz MQBCISQMRWGXIE-WUUFJKRQSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H](C2CCN(C(=O)[C@H]3CCCN3C)CC2)C1 ZINC001323639436 1329557587 /nfs/dbraw/zinc/55/75/87/1329557587.db2.gz ZVBQFDCNCNKMDU-TZFVZSICSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H](C2CCN(C(=O)[C@H]3CCCN3C)CC2)C1 ZINC001323639436 1329557590 /nfs/dbraw/zinc/55/75/90/1329557590.db2.gz ZVBQFDCNCNKMDU-TZFVZSICSA-N 1 3 347.547 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CC2CC(F)(F)C2)CC1(C)C ZINC001381141872 1348105593 /nfs/dbraw/zinc/10/55/93/1348105593.db2.gz IPUFOLCKFUBDOQ-HNNXBMFYSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CC2CC(F)(F)C2)CC1(C)C ZINC001381141872 1348105594 /nfs/dbraw/zinc/10/55/94/1348105594.db2.gz IPUFOLCKFUBDOQ-HNNXBMFYSA-N 1 3 345.478 2.589 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)CC1 ZINC001323832778 1329576394 /nfs/dbraw/zinc/57/63/94/1329576394.db2.gz RJFLJNMAVUHHEP-VZSQWMKGSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)CC1 ZINC001323832772 1329576401 /nfs/dbraw/zinc/57/64/01/1329576401.db2.gz RJFLJNMAVUHHEP-PHWHVTFISA-N 1 3 347.547 2.999 10 0 EFAEHO CC(C)CC[NH2+]C[C@@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001324226767 1329609611 /nfs/dbraw/zinc/60/96/11/1329609611.db2.gz VHKBQDKAJQQCNP-LPHOPBHVSA-N 1 3 341.515 2.826 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001324263424 1329612157 /nfs/dbraw/zinc/61/21/57/1329612157.db2.gz LKSFMTGQVJZEFK-ZDUSSCGKSA-N 1 3 336.307 2.618 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001324263424 1329612160 /nfs/dbraw/zinc/61/21/60/1329612160.db2.gz LKSFMTGQVJZEFK-ZDUSSCGKSA-N 1 3 336.307 2.618 10 0 EFAEHO Cc1ccc(CCC[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)cc1 ZINC001324285393 1329613825 /nfs/dbraw/zinc/61/38/25/1329613825.db2.gz HHHJNLOXJAQTAL-HXUWFJFHSA-N 1 3 345.531 2.848 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H]1C[NH2+]CCc1ccccc1 ZINC001324286719 1329614028 /nfs/dbraw/zinc/61/40/28/1329614028.db2.gz STGSEMXXQJPOJH-VQTJNVASSA-N 1 3 343.515 2.684 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C[NH2+]C/C=C/Cl)C1CCCC1)N(C)C ZINC001324499219 1329633777 /nfs/dbraw/zinc/63/37/77/1329633777.db2.gz ZQIJGAVSYMXDEI-XKQHDHNFSA-N 1 3 329.916 2.590 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@]1(C)CCC[N@H+](CC=C(C)C)C1 ZINC001324937639 1329661022 /nfs/dbraw/zinc/66/10/22/1329661022.db2.gz YLKDILVHTWTPOZ-HKUYNNGSSA-N 1 3 341.515 2.851 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@]1(C)CCC[N@@H+](CC=C(C)C)C1 ZINC001324937639 1329661023 /nfs/dbraw/zinc/66/10/23/1329661023.db2.gz YLKDILVHTWTPOZ-HKUYNNGSSA-N 1 3 341.515 2.851 10 0 EFAEHO C[C@@H](NCC=C(Cl)Cl)[C@@H](C)NC(=O)CC1CC[NH+](C)CC1 ZINC001381446301 1348281006 /nfs/dbraw/zinc/28/10/06/1348281006.db2.gz WQTYBPXVJLIGEN-VXGBXAGGSA-N 1 3 336.307 2.520 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC(C)(C)C[NH2+]Cc1ccsc1)N(C)C ZINC001381468234 1348294941 /nfs/dbraw/zinc/29/49/41/1348294941.db2.gz IMYQREWCPCYRAS-INIZCTEOSA-N 1 3 339.549 2.909 10 0 EFAEHO C[C@@H]([NH2+]CCCc1ccccc1)[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001325465269 1329690301 /nfs/dbraw/zinc/69/03/01/1329690301.db2.gz FGZVOQYUIIFIHD-QUCCMNQESA-N 1 3 343.515 2.542 10 0 EFAEHO CC(C)C[NH2+]CCN(Cc1ccccc1)C(=O)C1(N(C)C)CCC1 ZINC001325694637 1329707103 /nfs/dbraw/zinc/70/71/03/1329707103.db2.gz ZPCCUKWNWLGGPX-UHFFFAOYSA-N 1 3 331.504 2.745 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC[C@H](C)N(C)Cc2ccccc2)C1 ZINC001381573232 1348369847 /nfs/dbraw/zinc/36/98/47/1348369847.db2.gz KKBYEWCBRASCLO-PKOBYXMFSA-N 1 3 331.504 2.745 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC[C@H](C)N(C)Cc2ccccc2)C1 ZINC001381573232 1348369851 /nfs/dbraw/zinc/36/98/51/1348369851.db2.gz KKBYEWCBRASCLO-PKOBYXMFSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)CC[N@H+](C)[C@@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001381582733 1348377999 /nfs/dbraw/zinc/37/79/99/1348377999.db2.gz MHHHWNUSVUWDID-YJBOKZPZSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)CC[N@@H+](C)[C@@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001381582733 1348378001 /nfs/dbraw/zinc/37/80/01/1348378001.db2.gz MHHHWNUSVUWDID-YJBOKZPZSA-N 1 3 329.504 2.682 10 0 EFAEHO C[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[N@H+](C)CC1CC(F)(F)C1 ZINC001381585702 1348380902 /nfs/dbraw/zinc/38/09/02/1348380902.db2.gz FKXUXZNGMLCJGW-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[N@@H+](C)CC1CC(F)(F)C1 ZINC001381585702 1348380906 /nfs/dbraw/zinc/38/09/06/1348380906.db2.gz FKXUXZNGMLCJGW-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1)NC/C=C/Cl ZINC001382110164 1348729613 /nfs/dbraw/zinc/72/96/13/1348729613.db2.gz AOAVLQLMSUHUGW-GVUMGAFJSA-N 1 3 341.927 2.973 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@@H]1CCCC[N@H+]1C1CCCC1)NC/C=C/Cl ZINC001382110164 1348729617 /nfs/dbraw/zinc/72/96/17/1348729617.db2.gz AOAVLQLMSUHUGW-GVUMGAFJSA-N 1 3 341.927 2.973 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1C[C@H]([NH2+]C/C=C\Cl)C(C)(C)C1 ZINC001382368679 1348919571 /nfs/dbraw/zinc/91/95/71/1348919571.db2.gz LOIORKWJVHJBAB-VTBIRBAPSA-N 1 3 341.927 2.828 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[C@H](C[NH2+]CC[C@@H](C)F)CC1)N(C)C ZINC001326540747 1330313660 /nfs/dbraw/zinc/31/36/60/1330313660.db2.gz KKORIIARWMHPJS-QBPKDAKJSA-N 1 3 329.504 2.585 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](CC1=CCCCC1)CC2 ZINC001326602207 1330325072 /nfs/dbraw/zinc/32/50/72/1330325072.db2.gz AVPZUAAKAUNTJL-UHFFFAOYSA-N 1 3 333.520 2.753 10 0 EFAEHO CCCCCN1Cc2ccc(CNC(=O)[C@@H]3CC[N@H+](C)C3)cc2C1 ZINC001327695323 1330509805 /nfs/dbraw/zinc/50/98/05/1330509805.db2.gz GIYKJITUPDYSSV-GOSISDBHSA-N 1 3 329.488 2.760 10 0 EFAEHO CCCCCN1Cc2ccc(CNC(=O)[C@@H]3CC[N@@H+](C)C3)cc2C1 ZINC001327695323 1330509809 /nfs/dbraw/zinc/50/98/09/1330509809.db2.gz GIYKJITUPDYSSV-GOSISDBHSA-N 1 3 329.488 2.760 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@H]1C[NH2+]CCc1ccccc1)N(C)C ZINC001328632600 1330610584 /nfs/dbraw/zinc/61/05/84/1330610584.db2.gz ZHIFSAMHQONDPN-RBUKOAKNSA-N 1 3 331.504 2.540 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCCC[C@H]2C[NH2+]CCc2cccs2)C1 ZINC001328643662 1330611471 /nfs/dbraw/zinc/61/14/71/1330611471.db2.gz FWGIEDPSHPHMRW-IRXDYDNUSA-N 1 3 349.544 2.603 10 0 EFAEHO C[C@@H]([NH2+]CCCCC(F)(F)F)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001329053119 1330661238 /nfs/dbraw/zinc/66/12/38/1330661238.db2.gz HGEXCONNOLNTKZ-OLZOCXBDSA-N 1 3 337.430 2.686 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001329051028 1330661320 /nfs/dbraw/zinc/66/13/20/1330661320.db2.gz AGFSVALCDAQRHQ-ZWKOTPCHSA-N 1 3 345.531 2.895 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H](C)[NH2+]CC/C=C/c1ccccc1 ZINC001329173113 1330676769 /nfs/dbraw/zinc/67/67/69/1330676769.db2.gz PJUQXFGISYKJIT-YWUZZIELSA-N 1 3 340.471 2.847 10 0 EFAEHO CC(C)C[NH2+]CCC[C@@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001330915931 1330769889 /nfs/dbraw/zinc/76/98/89/1330769889.db2.gz LCOFLDVTDHGBJL-CRAIPNDOSA-N 1 3 329.504 2.729 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+]Cc1ccc(F)cc1C ZINC001330968969 1330777180 /nfs/dbraw/zinc/77/71/80/1330777180.db2.gz CDOKUPJKZTXTAA-AWEZNQCLSA-N 1 3 346.450 2.783 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H](C[NH2+]CC1=CCCCC1)C1CC1)N(C)C ZINC001331327444 1330823091 /nfs/dbraw/zinc/82/30/91/1330823091.db2.gz ZWVIISLXJFPFOQ-RBUKOAKNSA-N 1 3 335.536 2.900 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H](C)CN(C)C(=O)CN1CC[C@H](C)C1 ZINC001331559042 1330852775 /nfs/dbraw/zinc/85/27/75/1330852775.db2.gz CZRJIUNVNDKIKK-HKUYNNGSSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@@H]1[C@@H]([NH2+]CCCc2ccsc2)CCN1C(=O)CN(C)C1CCC1 ZINC001331896064 1330886776 /nfs/dbraw/zinc/88/67/76/1330886776.db2.gz KFESCOCGEFUBBF-QAPCUYQASA-N 1 3 349.544 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCCCc2ccccc2)[C@@H]1C ZINC001331944675 1330895402 /nfs/dbraw/zinc/89/54/02/1330895402.db2.gz SWEGOSRXKGJVSR-AZUAARDMSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCCCC(F)(F)F)[C@H]1C ZINC001331945152 1330895542 /nfs/dbraw/zinc/89/55/42/1330895542.db2.gz YYIKWORYAZDRIW-ZIAGYGMSSA-N 1 3 337.430 2.638 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccsc2)C[C@H]1C ZINC001332048596 1330909487 /nfs/dbraw/zinc/90/94/87/1330909487.db2.gz LGXVBSXZKJXWQI-NVXWUHKLSA-N 1 3 337.533 2.602 10 0 EFAEHO CCC/C=C\CC[NH2+][C@@H]1CN(C(=O)CN2CC[C@H](C)C2)CC1(C)C ZINC001332422101 1330970239 /nfs/dbraw/zinc/97/02/39/1330970239.db2.gz GHLCLJWJEKPNQU-MZIIKBMYSA-N 1 3 335.536 2.901 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]CCCCC(F)(F)F)C1)N(C)C ZINC001333140349 1331083323 /nfs/dbraw/zinc/08/33/23/1331083323.db2.gz FXCXLKVSNBYLNF-JXQTWKCFSA-N 1 3 337.430 2.638 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1=CC[N@H+](CC2=CCCCC2)CC1)N(C)C ZINC001333354092 1331123764 /nfs/dbraw/zinc/12/37/64/1331123764.db2.gz CQSLRCGXPSVEMT-IBGZPJMESA-N 1 3 333.520 2.821 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1=CC[N@@H+](CC2=CCCCC2)CC1)N(C)C ZINC001333354092 1331123766 /nfs/dbraw/zinc/12/37/66/1331123766.db2.gz CQSLRCGXPSVEMT-IBGZPJMESA-N 1 3 333.520 2.821 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@H+](CC2=CCCCC2)CC1)C1CCC1 ZINC001333354100 1331123996 /nfs/dbraw/zinc/12/39/96/1331123996.db2.gz CXSQNBFPEHCUTC-UHFFFAOYSA-N 1 3 331.504 2.719 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@@H+](CC2=CCCCC2)CC1)C1CCC1 ZINC001333354100 1331124000 /nfs/dbraw/zinc/12/40/00/1331124000.db2.gz CXSQNBFPEHCUTC-UHFFFAOYSA-N 1 3 331.504 2.719 10 0 EFAEHO CCc1cccc(CN2CC=C(CNC(=O)CCC[NH+](C)C)CC2)c1 ZINC001333390097 1331130907 /nfs/dbraw/zinc/13/09/07/1331130907.db2.gz HVGDBQLYZZJLPA-UHFFFAOYSA-N 1 3 343.515 2.839 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@@H+]([C@@H]2CCc3ccccc32)CC1 ZINC001333456351 1331147656 /nfs/dbraw/zinc/14/76/56/1331147656.db2.gz BNSZXRCCINDUBV-HXUWFJFHSA-N 1 3 341.499 2.762 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@H+]([C@@H]2CCc3ccccc32)CC1 ZINC001333456351 1331147659 /nfs/dbraw/zinc/14/76/59/1331147659.db2.gz BNSZXRCCINDUBV-HXUWFJFHSA-N 1 3 341.499 2.762 10 0 EFAEHO CCN(CCCNC(=O)C12CCC[NH+](CCC1)C2)CCC(F)(F)F ZINC001479846252 1332546660 /nfs/dbraw/zinc/54/66/60/1332546660.db2.gz AVZMSTBAXUKCHO-UHFFFAOYSA-N 1 3 349.441 2.643 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC[C@@H](C[NH2+]CCC3CC3)C2)c1 ZINC001480305250 1333597941 /nfs/dbraw/zinc/59/79/41/1333597941.db2.gz QTRVPEAGFGVYME-IBGZPJMESA-N 1 3 343.515 2.990 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H](C)CNC(=O)[C@H]1CCCN1C(C)C ZINC001480460957 1334066153 /nfs/dbraw/zinc/06/61/53/1334066153.db2.gz ZHDDERGAZYAOMA-QFBILLFUSA-N 1 3 331.504 2.716 10 0 EFAEHO CCN1CCC[C@@H]1CNC(=[NH2+])NCc1ccc2[nH]c(C)c(C)c2c1 ZINC000849067242 1335067573 /nfs/dbraw/zinc/06/75/73/1335067573.db2.gz QDCPYEDMLYMTTJ-MRXNPFEDSA-N 1 3 327.476 2.883 10 0 EFAEHO C[C@H]([NH2+]C[C@@H]1CCC[C@]2(CCOC2)O1)[C@H]1CCCN(C2CCC2)C1 ZINC001413982908 1335384022 /nfs/dbraw/zinc/38/40/22/1335384022.db2.gz MZQDSSROAPWDJC-QGZVKYPTSA-N 1 3 336.520 2.957 10 0 EFAEHO C[C@H](NC[C@@H]1CCC[C@]2(CCOC2)O1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001413982908 1335384024 /nfs/dbraw/zinc/38/40/24/1335384024.db2.gz MZQDSSROAPWDJC-QGZVKYPTSA-N 1 3 336.520 2.957 10 0 EFAEHO C[C@H](NC[C@@H]1CCC[C@]2(CCOC2)O1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001413982908 1335384026 /nfs/dbraw/zinc/38/40/26/1335384026.db2.gz MZQDSSROAPWDJC-QGZVKYPTSA-N 1 3 336.520 2.957 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=S)N[C@@H](C)c1cccs1 ZINC000849275144 1335585662 /nfs/dbraw/zinc/58/56/62/1335585662.db2.gz IXZIBRQZMVEMHB-KBPBESRZSA-N 1 3 342.578 2.545 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=S)N[C@@H](C)c1cccs1 ZINC000849275144 1335585665 /nfs/dbraw/zinc/58/56/65/1335585665.db2.gz IXZIBRQZMVEMHB-KBPBESRZSA-N 1 3 342.578 2.545 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=S)Nc1ccc2c(c1)CCC2 ZINC000849277070 1335586116 /nfs/dbraw/zinc/58/61/16/1335586116.db2.gz SRDGFXWDSXQBOY-HNNXBMFYSA-N 1 3 348.560 2.734 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=S)Nc1ccc2c(c1)CCC2 ZINC000849277070 1335586118 /nfs/dbraw/zinc/58/61/18/1335586118.db2.gz SRDGFXWDSXQBOY-HNNXBMFYSA-N 1 3 348.560 2.734 10 0 EFAEHO CC[N@@H+]1CC[C@@H]1CNC(=O)[C@@H]1CCCCN1Cc1cccc(C)c1 ZINC001361493499 1336122071 /nfs/dbraw/zinc/12/20/71/1336122071.db2.gz FENMRWWVJFLWFF-MOPGFXCFSA-N 1 3 329.488 2.560 10 0 EFAEHO CC[N@H+]1CC[C@@H]1CNC(=O)[C@@H]1CCCCN1Cc1cccc(C)c1 ZINC001361493499 1336122072 /nfs/dbraw/zinc/12/20/72/1336122072.db2.gz FENMRWWVJFLWFF-MOPGFXCFSA-N 1 3 329.488 2.560 10 0 EFAEHO CCN1CC[C@@H]1CNC(=O)[C@@H]1CCCC[N@@H+]1Cc1cccc(C)c1 ZINC001361493499 1336122076 /nfs/dbraw/zinc/12/20/76/1336122076.db2.gz FENMRWWVJFLWFF-MOPGFXCFSA-N 1 3 329.488 2.560 10 0 EFAEHO CCN1CC[C@@H]1CNC(=O)[C@@H]1CCCC[N@H+]1Cc1cccc(C)c1 ZINC001361493499 1336122078 /nfs/dbraw/zinc/12/20/78/1336122078.db2.gz FENMRWWVJFLWFF-MOPGFXCFSA-N 1 3 329.488 2.560 10 0 EFAEHO COc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001361610799 1336219762 /nfs/dbraw/zinc/21/97/62/1336219762.db2.gz LBPWAUJHFWXYHI-HZPDHXFCSA-N 1 3 333.476 2.816 10 0 EFAEHO O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001361728191 1336299068 /nfs/dbraw/zinc/29/90/68/1336299068.db2.gz QEKLRBDRKXCMCT-HSALFYBXSA-N 1 3 341.499 2.957 10 0 EFAEHO O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001361728191 1336299071 /nfs/dbraw/zinc/29/90/71/1336299071.db2.gz QEKLRBDRKXCMCT-HSALFYBXSA-N 1 3 341.499 2.957 10 0 EFAEHO CN(C)[C@H](CNC(=O)c1cccc(CC[NH+](C)C)c1)c1ccccc1 ZINC001361749099 1336310603 /nfs/dbraw/zinc/31/06/03/1336310603.db2.gz VNENBMYFWYGDGK-HXUWFJFHSA-N 1 3 339.483 2.823 10 0 EFAEHO CN(C)[C@H](CNC(=O)c1ccc(C[NH+]2CCCC2)o1)c1ccsc1 ZINC001361779969 1336331292 /nfs/dbraw/zinc/33/12/92/1336331292.db2.gz FNSXOCLKOWAMFU-MRXNPFEDSA-N 1 3 347.484 2.970 10 0 EFAEHO O=C(c1ccc(C[NH+]2CCCC2)o1)N1CCN(C2CCCC2)CC1 ZINC001361908529 1336410593 /nfs/dbraw/zinc/41/05/93/1336410593.db2.gz YLHVXGJSDYWEHR-UHFFFAOYSA-N 1 3 331.460 2.576 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)CC1 ZINC001362030285 1336472503 /nfs/dbraw/zinc/47/25/03/1336472503.db2.gz QORVMXLMLXTENN-HXUWFJFHSA-N 1 3 345.531 2.644 10 0 EFAEHO CN(C)CCN(Cc1ccccc1F)C(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001362077894 1336493208 /nfs/dbraw/zinc/49/32/08/1336493208.db2.gz MBQSSAMZIVRMPR-FUHWJXTLSA-N 1 3 349.494 2.836 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)N(CCN(C)C)Cc2ccco2)CC1 ZINC001362084459 1336495751 /nfs/dbraw/zinc/49/57/51/1336495751.db2.gz SNWQBJMBQGKTPB-UHFFFAOYSA-N 1 3 335.492 2.538 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001362100898 1336503060 /nfs/dbraw/zinc/50/30/60/1336503060.db2.gz VETOLZKPHMKORQ-RTBURBONSA-N 1 3 331.504 2.697 10 0 EFAEHO C[C@@H](CC[NH+](C)C)C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC001362157918 1336530293 /nfs/dbraw/zinc/53/02/93/1336530293.db2.gz KKNFGZURINAULU-ZWKOTPCHSA-N 1 3 331.504 2.697 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1CNC(=O)c1ccc(NC2=NCCC2)cc1 ZINC001362276965 1336584332 /nfs/dbraw/zinc/58/43/32/1336584332.db2.gz MQMWOFBSSUHRSL-QGZVFWFLSA-N 1 3 328.460 2.895 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc(NC2=NCCC2)cc1 ZINC001362276965 1336584334 /nfs/dbraw/zinc/58/43/34/1336584334.db2.gz MQMWOFBSSUHRSL-QGZVFWFLSA-N 1 3 328.460 2.895 10 0 EFAEHO CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](C)CC[NH+](C)C ZINC001362541331 1336649882 /nfs/dbraw/zinc/64/98/82/1336649882.db2.gz LNDXZBQRAHZWSN-HKUYNNGSSA-N 1 3 333.520 2.847 10 0 EFAEHO CC(C)N1CCN(c2cccc(NC(=O)[C@@H](C)CC[NH+](C)C)c2)CC1 ZINC001362613882 1336674094 /nfs/dbraw/zinc/67/40/94/1336674094.db2.gz QDAWMEFEUZLZTG-KRWDZBQOSA-N 1 3 346.519 2.743 10 0 EFAEHO CN(CCCN(C)C(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1)Cc1ccco1 ZINC001362803468 1336748315 /nfs/dbraw/zinc/74/83/15/1336748315.db2.gz HOSDMWULWYMPGG-DLBZAZTESA-N 1 3 335.492 2.680 10 0 EFAEHO C[N@@H+]1C[C@@H](CNC(=O)C(C)(C)N2CCCCC2)[C@H](c2ccccc2)C1 ZINC001362827744 1336755511 /nfs/dbraw/zinc/75/55/11/1336755511.db2.gz NOYRKBPYXGQIIC-MOPGFXCFSA-N 1 3 343.515 2.713 10 0 EFAEHO C[N@H+]1C[C@@H](CNC(=O)C(C)(C)N2CCCCC2)[C@H](c2ccccc2)C1 ZINC001362827744 1336755518 /nfs/dbraw/zinc/75/55/18/1336755518.db2.gz NOYRKBPYXGQIIC-MOPGFXCFSA-N 1 3 343.515 2.713 10 0 EFAEHO Cc1cc(NC(=O)C2(N(C)C)CCCC2)ccc1OCC[NH+](C)C ZINC001362834057 1336756793 /nfs/dbraw/zinc/75/67/93/1336756793.db2.gz OEOJGXUUOLMIDL-UHFFFAOYSA-N 1 3 333.476 2.748 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(SC2CC2)cc1 ZINC001362959148 1336761256 /nfs/dbraw/zinc/76/12/56/1336761256.db2.gz UAGIVYPRYJLDEE-HNNXBMFYSA-N 1 3 349.544 2.943 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(SC2CC2)cc1 ZINC001362959148 1336761257 /nfs/dbraw/zinc/76/12/57/1336761257.db2.gz UAGIVYPRYJLDEE-HNNXBMFYSA-N 1 3 349.544 2.943 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)N[C@@]2(C)CCN(Cc3ccccc3)C2)C1 ZINC001363771077 1337034382 /nfs/dbraw/zinc/03/43/82/1337034382.db2.gz HSUZCEVAHNLILW-SBHAEUEKSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CCN1CCN(CC2(O)CCCCCC2)CC1 ZINC001363771743 1337035092 /nfs/dbraw/zinc/03/50/92/1337035092.db2.gz QIYIYRMCPFOIOJ-OALUTQOASA-N 1 3 337.552 2.562 10 0 EFAEHO CC[C@@H](C)N(CCc1ccccc1F)CC(=O)NC1CC[NH+](C)CC1 ZINC001363781763 1337042694 /nfs/dbraw/zinc/04/26/94/1337042694.db2.gz VBMRZMJTBLRGCJ-MRXNPFEDSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](CCN2CC3(CCCC3)OC[C@H]2CN(C)C)C1 ZINC001363810943 1337062661 /nfs/dbraw/zinc/06/26/61/1337062661.db2.gz UIEZOAKGRPCHCF-GUDVDZBRSA-N 1 3 337.552 2.540 10 0 EFAEHO C[C@@H]1CN(C(=O)C2(C[NH+](C)C)CCCCC2)CCN1C1CCCC1 ZINC001363996177 1337142847 /nfs/dbraw/zinc/14/28/47/1337142847.db2.gz HQCQXUSOSBLNFZ-QGZVFWFLSA-N 1 3 335.536 2.974 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CCCN(CC2CC(F)(F)C2)C1)[NH+](CC)CC ZINC001365942206 1337273830 /nfs/dbraw/zinc/27/38/30/1337273830.db2.gz KQPMQHDDYCPBNX-HOTGVXAUSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCCN(CC2CC(F)(F)C2)C1)[NH+](CC)CC ZINC001365942211 1337273842 /nfs/dbraw/zinc/27/38/42/1337273842.db2.gz KQPMQHDDYCPBNX-JKSUJKDBSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](CNC(=O)CN(C)C2CCC2)C2CC2)c1 ZINC001366037083 1337338468 /nfs/dbraw/zinc/33/84/68/1337338468.db2.gz PHXZULMFCRDCDK-LJQANCHMSA-N 1 3 347.478 2.603 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](CNC(=O)[C@@H]2CCCN2C(C)C)C2CC2)cs1 ZINC001366048150 1337346278 /nfs/dbraw/zinc/34/62/78/1337346278.db2.gz VVSKZWSUZORKKD-ROUUACIJSA-N 1 3 349.544 2.914 10 0 EFAEHO CN(CC(=O)NC[C@H]([NH2+]CC1CC(C)(C)C1)C1CC1)CC(C)(C)C ZINC001366053768 1337350363 /nfs/dbraw/zinc/35/03/63/1337350363.db2.gz JJVIKEWQGNERNZ-KRWDZBQOSA-N 1 3 337.552 2.885 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@H]1C[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001366131020 1337392881 /nfs/dbraw/zinc/39/28/81/1337392881.db2.gz KSJWEWGDQNSFNN-QAQDUYKDSA-N 1 3 337.895 2.725 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(Cl)cc32)C1)N(C)C ZINC001366161603 1337408688 /nfs/dbraw/zinc/40/86/88/1337408688.db2.gz KIOIRHTXRCTYME-CIRFHOKZSA-N 1 3 349.906 2.904 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2ccc(C)cc2Cl)C1 ZINC001366169203 1337412496 /nfs/dbraw/zinc/41/24/96/1337412496.db2.gz IBOZSOJKVAMRES-IYBDPMFKSA-N 1 3 337.895 2.727 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2ccc(C)cc2Cl)C1 ZINC001366169203 1337412498 /nfs/dbraw/zinc/41/24/98/1337412498.db2.gz IBOZSOJKVAMRES-IYBDPMFKSA-N 1 3 337.895 2.727 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)cc1C ZINC001366170244 1337413037 /nfs/dbraw/zinc/41/30/37/1337413037.db2.gz NNTRGZSCUQEHLR-OTWHNJEPSA-N 1 3 331.504 2.626 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC001366186907 1337426610 /nfs/dbraw/zinc/42/66/10/1337426610.db2.gz PHFADGCRGBLHJY-ROUUACIJSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC001366186907 1337426612 /nfs/dbraw/zinc/42/66/12/1337426612.db2.gz PHFADGCRGBLHJY-ROUUACIJSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC001366186903 1337426638 /nfs/dbraw/zinc/42/66/38/1337426638.db2.gz PHFADGCRGBLHJY-QZTJIDSGSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@H+]([C@H](C)c2ccccc2)C1 ZINC001366186903 1337426639 /nfs/dbraw/zinc/42/66/39/1337426639.db2.gz PHFADGCRGBLHJY-QZTJIDSGSA-N 1 3 331.504 2.916 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1CCC[N@@H+](CC2CCC(C)CC2)C1 ZINC001366187238 1337427686 /nfs/dbraw/zinc/42/76/86/1337427686.db2.gz LADRJPJXSKJNDC-VJFUWPCTSA-N 1 3 346.519 2.915 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1CCC[N@H+](CC2CCC(C)CC2)C1 ZINC001366187238 1337427687 /nfs/dbraw/zinc/42/76/87/1337427687.db2.gz LADRJPJXSKJNDC-VJFUWPCTSA-N 1 3 346.519 2.915 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[NH2+][C@@H]2CCc3ccccc32)C1 ZINC001366199114 1337436438 /nfs/dbraw/zinc/43/64/38/1337436438.db2.gz AILQRKGGVJYNQI-FXAWDEMLSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)CCC[N@@H+]1CCCC[C@@H]1CNC(=O)[C@H](C(C)C)N(C)C ZINC001366208548 1337444132 /nfs/dbraw/zinc/44/41/32/1337444132.db2.gz HANLLGBMFJKHQP-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CCC[N@H+]1CCCC[C@@H]1CNC(=O)[C@H](C(C)C)N(C)C ZINC001366208548 1337444135 /nfs/dbraw/zinc/44/41/35/1337444135.db2.gz HANLLGBMFJKHQP-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CCC[N@@H+]1CCCC[C@@H]1CNC(=O)[C@@H](C(C)C)N(C)C ZINC001366208572 1337444443 /nfs/dbraw/zinc/44/44/43/1337444443.db2.gz HANLLGBMFJKHQP-QZTJIDSGSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CCC[N@H+]1CCCC[C@@H]1CNC(=O)[C@@H](C(C)C)N(C)C ZINC001366208572 1337444445 /nfs/dbraw/zinc/44/44/45/1337444445.db2.gz HANLLGBMFJKHQP-QZTJIDSGSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001366209059 1337445360 /nfs/dbraw/zinc/44/53/60/1337445360.db2.gz VURWZVVYYGXKJB-HOTGVXAUSA-N 1 3 329.504 2.541 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2C[N@H+](CC[C@H]3CCC[C@H](C)C3)C[C@H]21 ZINC001366237122 1337470819 /nfs/dbraw/zinc/47/08/19/1337470819.db2.gz RQHFSLWJFIQTMU-NMDDUFOESA-N 1 3 335.536 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2C[N@@H+](CC[C@H]3CCC[C@H](C)C3)C[C@H]21 ZINC001366237122 1337470820 /nfs/dbraw/zinc/47/08/20/1337470820.db2.gz RQHFSLWJFIQTMU-NMDDUFOESA-N 1 3 335.536 2.589 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001366283577 1337490056 /nfs/dbraw/zinc/49/00/56/1337490056.db2.gz JBPQCQPKPHRCCQ-OXQOHEQNSA-N 1 3 343.515 2.644 10 0 EFAEHO C[C@@H](N[C@@H](C)CNC(=O)C12CC[NH+](CC1)C2)c1ccccc1Cl ZINC001366342985 1337523074 /nfs/dbraw/zinc/52/30/74/1337523074.db2.gz HSSJLKSVALDHJB-UONOGXRCSA-N 1 3 335.879 2.591 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]Cc1ccc(C(C)(C)C)cc1)N(C)C ZINC001366357222 1337532656 /nfs/dbraw/zinc/53/26/56/1337532656.db2.gz XAGXESLUHYFPOU-CRAIPNDOSA-N 1 3 333.520 2.919 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]Cc1cc2ccccc2s1 ZINC001366365892 1337538937 /nfs/dbraw/zinc/53/89/37/1337538937.db2.gz LDBGDTNFYMONIG-AWEZNQCLSA-N 1 3 333.501 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+][C@H]2CCc3ccc(F)cc32)C1 ZINC001366407636 1337562786 /nfs/dbraw/zinc/56/27/86/1337562786.db2.gz JDVNLZRYOOJVJO-BEFAXECRSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+][C@@H]2CCc3ccc(F)cc32)C1 ZINC001366407638 1337562925 /nfs/dbraw/zinc/56/29/25/1337562925.db2.gz JDVNLZRYOOJVJO-DNVCBOLYSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2F)C1 ZINC001366421015 1337570271 /nfs/dbraw/zinc/57/02/71/1337570271.db2.gz BVXKCSULFZMCTM-IAGOWNOFSA-N 1 3 335.467 2.683 10 0 EFAEHO Cc1cc(C[N@@H+](C)[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001366435878 1337585693 /nfs/dbraw/zinc/58/56/93/1337585693.db2.gz UVHHGZCXFIXCGH-KRWDZBQOSA-N 1 3 337.533 2.820 10 0 EFAEHO Cc1cc(C[N@H+](C)[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001366435878 1337585696 /nfs/dbraw/zinc/58/56/96/1337585696.db2.gz UVHHGZCXFIXCGH-KRWDZBQOSA-N 1 3 337.533 2.820 10 0 EFAEHO C[C@H](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCC1 ZINC001366485686 1337626263 /nfs/dbraw/zinc/62/62/63/1337626263.db2.gz MMNJDLPKZNERNW-DNVCBOLYSA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@@H](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCC1 ZINC001366485691 1337626592 /nfs/dbraw/zinc/62/65/92/1337626592.db2.gz MMNJDLPKZNERNW-HNAYVOBHSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CCNC(=O)CN(C)CC(C)(C)C)c(C)n1 ZINC001366487526 1337628722 /nfs/dbraw/zinc/62/87/22/1337628722.db2.gz PPVPODPBQBOGLG-OAHLLOKOSA-N 1 3 348.535 2.661 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+][C@H]1CCCc2ccccc21 ZINC001366512902 1337653377 /nfs/dbraw/zinc/65/33/77/1337653377.db2.gz PONOUZOFCQNOII-LPHOPBHVSA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+][C@@H]1CCCc2ccccc21 ZINC001366512914 1337653679 /nfs/dbraw/zinc/65/36/79/1337653679.db2.gz PONOUZOFCQNOII-VQIMIIECSA-N 1 3 331.504 2.889 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)CCNC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001366530401 1337667244 /nfs/dbraw/zinc/66/72/44/1337667244.db2.gz RJGKSNILLDXODG-GOSISDBHSA-N 1 3 349.906 2.538 10 0 EFAEHO CN(CCNC(=O)C(C)(C)[N@H+](C)C1CCCC1)Cc1ccccc1 ZINC001366551883 1337687023 /nfs/dbraw/zinc/68/70/23/1337687023.db2.gz PZROAPITOFVPKD-UHFFFAOYSA-N 1 3 331.504 2.888 10 0 EFAEHO CN(CCNC(=O)C(C)(C)[N@@H+](C)C1CCCC1)Cc1ccccc1 ZINC001366551883 1337687028 /nfs/dbraw/zinc/68/70/28/1337687028.db2.gz PZROAPITOFVPKD-UHFFFAOYSA-N 1 3 331.504 2.888 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@H+](C)CCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001366564681 1337698305 /nfs/dbraw/zinc/69/83/05/1337698305.db2.gz FILBPSBFWVOFAB-WMZOPIPTSA-N 1 3 331.504 2.754 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@@H+](C)CCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001366564681 1337698308 /nfs/dbraw/zinc/69/83/08/1337698308.db2.gz FILBPSBFWVOFAB-WMZOPIPTSA-N 1 3 331.504 2.754 10 0 EFAEHO CC[C@H](C(=O)NCC[N@H+](CC)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001366614901 1337754151 /nfs/dbraw/zinc/75/41/51/1337754151.db2.gz UFMDQJHKDSOLHE-HUUCEWRRSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@H](C(=O)NCC[N@@H+](CC)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001366614901 1337754155 /nfs/dbraw/zinc/75/41/55/1337754155.db2.gz UFMDQJHKDSOLHE-HUUCEWRRSA-N 1 3 333.467 2.590 10 0 EFAEHO CCc1cccc(CN(CC)CCNC(=O)C[C@@H]2CC[N@H+](C)C2)c1 ZINC001366636503 1337781649 /nfs/dbraw/zinc/78/16/49/1337781649.db2.gz BOEJMOBOEFGPQZ-IBGZPJMESA-N 1 3 331.504 2.529 10 0 EFAEHO CCc1cccc(CN(CC)CCNC(=O)C[C@@H]2CC[N@@H+](C)C2)c1 ZINC001366636503 1337781651 /nfs/dbraw/zinc/78/16/51/1337781651.db2.gz BOEJMOBOEFGPQZ-IBGZPJMESA-N 1 3 331.504 2.529 10 0 EFAEHO Cc1cccc(CN(CCNC(=O)CC[C@H]2CCC[N@H+]2C)C2CC2)c1 ZINC001366741080 1337949934 /nfs/dbraw/zinc/94/99/34/1337949934.db2.gz UKEGAMPSXZVVQY-LJQANCHMSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1cccc(CN(CCNC(=O)CC[C@H]2CCC[N@@H+]2C)C2CC2)c1 ZINC001366741080 1337949939 /nfs/dbraw/zinc/94/99/39/1337949939.db2.gz UKEGAMPSXZVVQY-LJQANCHMSA-N 1 3 343.515 2.950 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](CC1CCC(F)(F)CC1)C1CC1 ZINC001366762729 1337983325 /nfs/dbraw/zinc/98/33/25/1337983325.db2.gz USBDZCFXRZCAHP-UHFFFAOYSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](CC1CCC(F)(F)CC1)C1CC1 ZINC001366762729 1337983328 /nfs/dbraw/zinc/98/33/28/1337983328.db2.gz USBDZCFXRZCAHP-UHFFFAOYSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1ccc(C[N@@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001366868470 1338139015 /nfs/dbraw/zinc/13/90/15/1338139015.db2.gz IADUKZZNZSZJCH-SFHVURJKSA-N 1 3 349.494 2.755 10 0 EFAEHO Cc1ccc(C[N@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001366868470 1338139020 /nfs/dbraw/zinc/13/90/20/1338139020.db2.gz IADUKZZNZSZJCH-SFHVURJKSA-N 1 3 349.494 2.755 10 0 EFAEHO CCN1CCC[C@H](N(Cc2ccccc2)C(=O)C[C@@H]2CC[N@H+](C)C2)C1 ZINC001366870686 1338142520 /nfs/dbraw/zinc/14/25/20/1338142520.db2.gz JSPGVTFAITWMTA-PMACEKPBSA-N 1 3 343.515 2.841 10 0 EFAEHO CCN1CCC[C@H](N(Cc2ccccc2)C(=O)C[C@@H]2CC[N@@H+](C)C2)C1 ZINC001366870686 1338142525 /nfs/dbraw/zinc/14/25/25/1338142525.db2.gz JSPGVTFAITWMTA-PMACEKPBSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@H+](CC2CCCC2)C1)N1CCCC1 ZINC001366903576 1338188897 /nfs/dbraw/zinc/18/88/97/1338188897.db2.gz LAHNKZJMMJEHII-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@@H+](CC2CCCC2)C1)N1CCCC1 ZINC001366903576 1338188900 /nfs/dbraw/zinc/18/89/00/1338188900.db2.gz LAHNKZJMMJEHII-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@H+](CC2CCCC2)C1)N1CCCC1 ZINC001366911676 1338196540 /nfs/dbraw/zinc/19/65/40/1338196540.db2.gz LAHNKZJMMJEHII-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@@H+](CC2CCCC2)C1)N1CCCC1 ZINC001366911676 1338196543 /nfs/dbraw/zinc/19/65/43/1338196543.db2.gz LAHNKZJMMJEHII-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H]1CC[N@H+](CC2CCC2)C1)N1CCCCC1 ZINC001367060550 1338330307 /nfs/dbraw/zinc/33/03/07/1338330307.db2.gz RHSAGVAHVMVOLJ-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H]1CC[N@@H+](CC2CCC2)C1)N1CCCCC1 ZINC001367060550 1338330310 /nfs/dbraw/zinc/33/03/10/1338330310.db2.gz RHSAGVAHVMVOLJ-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1C[NH+]2CCC1CC2)NCc1ccccc1Cl ZINC001367089973 1338375228 /nfs/dbraw/zinc/37/52/28/1338375228.db2.gz ASFGQUVDQISMLN-SJORKVTESA-N 1 3 349.906 2.666 10 0 EFAEHO CC[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001367095804 1338381912 /nfs/dbraw/zinc/38/19/12/1338381912.db2.gz GHBKGYSQWLKQCP-FUHWJXTLSA-N 1 3 329.488 2.643 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C1CCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001367105973 1338392432 /nfs/dbraw/zinc/39/24/32/1338392432.db2.gz YDVUHIQMINMMRM-QFBILLFUSA-N 1 3 329.488 2.643 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](CC)CNC(=O)CN2CC[C@H](C)C2)c1 ZINC001367131134 1338421426 /nfs/dbraw/zinc/42/14/26/1338421426.db2.gz XTSOBTQYZPSAQY-QFBILLFUSA-N 1 3 331.504 2.575 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cccc(Cl)c1 ZINC001367131273 1338421461 /nfs/dbraw/zinc/42/14/61/1338421461.db2.gz ZCNVRBXHOXADMK-RHSMWYFYSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001367147252 1338441709 /nfs/dbraw/zinc/44/17/09/1338441709.db2.gz DWLHNALFHGCNNN-GJZGRUSLSA-N 1 3 333.467 2.637 10 0 EFAEHO CCCN(C)CC(=O)NC1(C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CCCC1 ZINC001367163559 1338463200 /nfs/dbraw/zinc/46/32/00/1338463200.db2.gz NNYKMKNMADTTNS-FGTMMUONSA-N 1 3 335.536 2.783 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC1CC[NH+](CC[C@H](C)F)CC1)N(C)C ZINC001367213743 1338523276 /nfs/dbraw/zinc/52/32/76/1338523276.db2.gz VVRMGSJHUQSJIW-DOTOQJQBSA-N 1 3 329.504 2.539 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC1CC[NH+](CC[C@H](C)F)CC1 ZINC001367214098 1338523904 /nfs/dbraw/zinc/52/39/04/1338523904.db2.gz OOHSIMCIZSNCSL-FUHWJXTLSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]Cc1ccc(Cl)cc1 ZINC001367226688 1338534870 /nfs/dbraw/zinc/53/48/70/1338534870.db2.gz ASZNXEWHAUYYHA-QGZVFWFLSA-N 1 3 337.895 2.761 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(C[NH+](CC3CCCCC3)C2)CC1 ZINC001367333808 1338634104 /nfs/dbraw/zinc/63/41/04/1338634104.db2.gz IPUUVXVEMGQVKF-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H](CNCc1cccnc1)N(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001367367816 1338663685 /nfs/dbraw/zinc/66/36/85/1338663685.db2.gz HFTLOSOWSPHQKV-INIZCTEOSA-N 1 3 346.519 2.671 10 0 EFAEHO C[C@@H](CNCc1cccnc1)N(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001367367816 1338663687 /nfs/dbraw/zinc/66/36/87/1338663687.db2.gz HFTLOSOWSPHQKV-INIZCTEOSA-N 1 3 346.519 2.671 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@H](C)N(C)C(=O)[C@H]2CCCN2C)cc1 ZINC001367373139 1338668242 /nfs/dbraw/zinc/66/82/42/1338668242.db2.gz HQYKNSHSZRAPGW-QFBILLFUSA-N 1 3 331.504 2.841 10 0 EFAEHO C[C@@H](C[NH2+]CC1CCC(F)(F)CC1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001367383911 1338679351 /nfs/dbraw/zinc/67/93/51/1338679351.db2.gz QKUSARIAGRSCRY-GJZGRUSLSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C ZINC001367397567 1338694869 /nfs/dbraw/zinc/69/48/69/1338694869.db2.gz NGKFBXIAUXTUNI-HNAYVOBHSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1cc(C)sc1C)N(C)C ZINC001367399723 1338697113 /nfs/dbraw/zinc/69/71/13/1338697113.db2.gz UAODGNHITFFUNX-BLLLJJGKSA-N 1 3 325.522 2.642 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CCCC2)cc1 ZINC001367407638 1338705136 /nfs/dbraw/zinc/70/51/36/1338705136.db2.gz RXEGNJOKPZYZEE-SFHVURJKSA-N 1 3 345.531 2.917 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]([NH2+]Cc1ccc2cc[nH]c2c1)C(C)C)N(C)C ZINC001367489796 1338789471 /nfs/dbraw/zinc/78/94/71/1338789471.db2.gz IOHYRJYZRMTIFA-MOPGFXCFSA-N 1 3 344.503 2.739 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@H+](C)Cc2ccc(C3CC3)cc2)CCC1 ZINC001367514137 1338813058 /nfs/dbraw/zinc/81/30/58/1338813058.db2.gz DDCKCJDDYVHNCO-UHFFFAOYSA-N 1 3 343.515 2.939 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@@H+](C)Cc2ccc(C3CC3)cc2)CCC1 ZINC001367514137 1338813061 /nfs/dbraw/zinc/81/30/61/1338813061.db2.gz DDCKCJDDYVHNCO-UHFFFAOYSA-N 1 3 343.515 2.939 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001367520746 1338820896 /nfs/dbraw/zinc/82/08/96/1338820896.db2.gz FENQDKQFAGDSFE-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001367520746 1338820897 /nfs/dbraw/zinc/82/08/97/1338820897.db2.gz FENQDKQFAGDSFE-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001367524645 1338825751 /nfs/dbraw/zinc/82/57/51/1338825751.db2.gz RCFHIPBBZJCOEJ-HUUCEWRRSA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001367524645 1338825754 /nfs/dbraw/zinc/82/57/54/1338825754.db2.gz RCFHIPBBZJCOEJ-HUUCEWRRSA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@H+](C/C=C/Cl)CC(C)(C)C1)N(C)C ZINC001388834696 1353071852 /nfs/dbraw/zinc/07/18/52/1353071852.db2.gz FVVTZLNXXICENK-VIGJRRFGSA-N 1 3 329.916 2.686 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@@H+](C/C=C/Cl)CC(C)(C)C1)N(C)C ZINC001388834696 1353071856 /nfs/dbraw/zinc/07/18/56/1353071856.db2.gz FVVTZLNXXICENK-VIGJRRFGSA-N 1 3 329.916 2.686 10 0 EFAEHO CCN(CC[NH2+][C@H](C)c1cc(C)ccc1C)C(=O)[C@@H]1CCCN1C ZINC001367639492 1338894862 /nfs/dbraw/zinc/89/48/62/1338894862.db2.gz IPLRNGGCBKNRQV-MJGOQNOKSA-N 1 3 331.504 2.897 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)NC(=O)[C@@H]2CCC[N@@H+]2C(C)C)n1 ZINC001367672186 1338918860 /nfs/dbraw/zinc/91/88/60/1338918860.db2.gz OJKBSZYRNVSCBQ-APWZRJJASA-N 1 3 346.519 2.672 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)NC(=O)[C@@H]2CCC[N@H+]2C(C)C)n1 ZINC001367672186 1338918862 /nfs/dbraw/zinc/91/88/62/1338918862.db2.gz OJKBSZYRNVSCBQ-APWZRJJASA-N 1 3 346.519 2.672 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C(C)(C)C)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001367694923 1338934271 /nfs/dbraw/zinc/93/42/71/1338934271.db2.gz KXIZZMZJYBZECT-IAGOWNOFSA-N 1 3 345.531 2.920 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]Cc1ccc(C(C)(C)C)cc1)N(C)C ZINC001367707442 1338945869 /nfs/dbraw/zinc/94/58/69/1338945869.db2.gz SDVWJBVASFJPOR-CRAIPNDOSA-N 1 3 333.520 2.919 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H](C)NC(=O)[C@@H]1CCCCN1C(C)C ZINC001367757673 1338984326 /nfs/dbraw/zinc/98/43/26/1338984326.db2.gz WFJPZQPOTKCIDF-LPHOPBHVSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CCC2)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001367760388 1338987614 /nfs/dbraw/zinc/98/76/14/1338987614.db2.gz PPLBJUGBPXLRNJ-IRXDYDNUSA-N 1 3 343.515 2.890 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001367840320 1339056987 /nfs/dbraw/zinc/05/69/87/1339056987.db2.gz XWCQKZKAGVATND-CRAIPNDOSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001367840320 1339056988 /nfs/dbraw/zinc/05/69/88/1339056988.db2.gz XWCQKZKAGVATND-CRAIPNDOSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001367840343 1339057601 /nfs/dbraw/zinc/05/76/01/1339057601.db2.gz XWCQKZKAGVATND-YJBOKZPZSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001367840343 1339057603 /nfs/dbraw/zinc/05/76/03/1339057603.db2.gz XWCQKZKAGVATND-YJBOKZPZSA-N 1 3 331.504 2.582 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C[N@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001367847633 1339064321 /nfs/dbraw/zinc/06/43/21/1339064321.db2.gz PGOLWALZKWKQCQ-FUHWJXTLSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C[N@@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001367847633 1339064326 /nfs/dbraw/zinc/06/43/26/1339064326.db2.gz PGOLWALZKWKQCQ-FUHWJXTLSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001367858920 1339073588 /nfs/dbraw/zinc/07/35/88/1339073588.db2.gz FXHMICIWCDMGEF-CABCVRRESA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001367858920 1339073586 /nfs/dbraw/zinc/07/35/86/1339073586.db2.gz FXHMICIWCDMGEF-CABCVRRESA-N 1 3 333.467 2.589 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H](NC(=O)[C@@H]2CCCN2C(C)C)C2CC2)c1 ZINC001367908552 1339099455 /nfs/dbraw/zinc/09/94/55/1339099455.db2.gz XYCHDXRNEZPCTN-PMACEKPBSA-N 1 3 343.515 2.852 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@H](CNCc1ccccc1F)C1CC1 ZINC001367909637 1339100629 /nfs/dbraw/zinc/10/06/29/1339100629.db2.gz RJPSJFHUJCIDLX-PKOBYXMFSA-N 1 3 347.478 2.685 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@H](CNCc1ccccc1F)C1CC1 ZINC001367909637 1339100634 /nfs/dbraw/zinc/10/06/34/1339100634.db2.gz RJPSJFHUJCIDLX-PKOBYXMFSA-N 1 3 347.478 2.685 10 0 EFAEHO C[C@@H](C(=O)N[C@@H](C[NH2+]Cc1ccccc1)C1CC1)N1CCCCCC1 ZINC001367910598 1339101157 /nfs/dbraw/zinc/10/11/57/1339101157.db2.gz IKVSTXMGDJRZNO-PXNSSMCTSA-N 1 3 343.515 2.936 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+][C@H]1CCc2c1cccc2F)C1CC1 ZINC001367919607 1339107723 /nfs/dbraw/zinc/10/77/23/1339107723.db2.gz LMUSPVVHJJPSLN-OALUTQOASA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001367920170 1339108368 /nfs/dbraw/zinc/10/83/68/1339108368.db2.gz LIUBGACVVOBDHW-ZWKOTPCHSA-N 1 3 335.536 2.637 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]C/C=C\c2ccccc2)CC1)N1CCCC1 ZINC001368014467 1339158640 /nfs/dbraw/zinc/15/86/40/1339158640.db2.gz VXDMHPQPWPRTTP-FLIBITNWSA-N 1 3 341.499 2.813 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NCC2(N[C@@H]3CCc4c3cccc4Cl)CC2)C1 ZINC001368035462 1339168402 /nfs/dbraw/zinc/16/84/02/1339168402.db2.gz MDDPIOHBBIDQKY-SUMWQHHRSA-N 1 3 347.890 2.517 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NCC2(N[C@@H]3CCc4c3cccc4Cl)CC2)C1 ZINC001368035462 1339168404 /nfs/dbraw/zinc/16/84/04/1339168404.db2.gz MDDPIOHBBIDQKY-SUMWQHHRSA-N 1 3 347.890 2.517 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NCC2(N[C@@H]3CCc4c3cccc4Cl)CC2)C1 ZINC001368035459 1339168543 /nfs/dbraw/zinc/16/85/43/1339168543.db2.gz MDDPIOHBBIDQKY-CXAGYDPISA-N 1 3 347.890 2.517 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NCC2(N[C@@H]3CCc4c3cccc4Cl)CC2)C1 ZINC001368035459 1339168546 /nfs/dbraw/zinc/16/85/46/1339168546.db2.gz MDDPIOHBBIDQKY-CXAGYDPISA-N 1 3 347.890 2.517 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1cccc(F)c1)C1CCCC1)N(C)C ZINC001368137043 1339212258 /nfs/dbraw/zinc/21/22/58/1339212258.db2.gz IDZKHYQUXNZQQU-RBUKOAKNSA-N 1 3 349.494 2.931 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1(C)CC[NH+](CCC(C)(C)C)CC1 ZINC001368209192 1339257335 /nfs/dbraw/zinc/25/73/35/1339257335.db2.gz WBMBXGXEKXUURJ-UHFFFAOYSA-N 1 3 334.508 2.915 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001368344951 1339309227 /nfs/dbraw/zinc/30/92/27/1339309227.db2.gz FSNNRTQPAXKZIF-VJANTYMQSA-N 1 3 337.552 2.887 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+]2C[C@H]3CN(C(=O)CN(C)C(C)C)C[C@H]3C2)c1 ZINC001368359111 1339315013 /nfs/dbraw/zinc/31/50/13/1339315013.db2.gz QGNKUBBMUPFLKU-BGYRXZFFSA-N 1 3 343.515 2.534 10 0 EFAEHO Cc1ccc(C)c(C[N@H+]2C[C@H]3CN(C(=O)CN(C)C(C)C)C[C@H]3C2)c1 ZINC001368359111 1339315015 /nfs/dbraw/zinc/31/50/15/1339315015.db2.gz QGNKUBBMUPFLKU-BGYRXZFFSA-N 1 3 343.515 2.534 10 0 EFAEHO C[C@H](NCCF)c1ccc(CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC001368412740 1339344130 /nfs/dbraw/zinc/34/41/30/1339344130.db2.gz LXYBPARXDQIBEB-MPGHIAIKSA-N 1 3 335.467 2.653 10 0 EFAEHO C[C@H](NCCF)c1ccc(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC001368412740 1339344136 /nfs/dbraw/zinc/34/41/36/1339344136.db2.gz LXYBPARXDQIBEB-MPGHIAIKSA-N 1 3 335.467 2.653 10 0 EFAEHO Cc1ccc(CN2CCC3(CN(C(=O)CC[NH+](C)C)C3)CC2)cc1F ZINC001368420307 1339353980 /nfs/dbraw/zinc/35/39/80/1339353980.db2.gz CFVHNYJMNHCXEA-UHFFFAOYSA-N 1 3 347.478 2.510 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+][C@H]2CCc3ccccc32)C1 ZINC001368425511 1339358992 /nfs/dbraw/zinc/35/89/92/1339358992.db2.gz TWWBINDQEIJLMO-PXNSSMCTSA-N 1 3 343.515 2.844 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC2(C1)CCN(Cc1cccc(F)c1)CC2 ZINC001368426160 1339361104 /nfs/dbraw/zinc/36/11/04/1339361104.db2.gz WMVAYKPDZDCHJO-UHFFFAOYSA-N 1 3 347.478 2.592 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC2(C1)CCN(Cc1cccc(F)c1)CC2 ZINC001368426160 1339361110 /nfs/dbraw/zinc/36/11/10/1339361110.db2.gz WMVAYKPDZDCHJO-UHFFFAOYSA-N 1 3 347.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](Cc1cccc(C)c1)CC2 ZINC001368426751 1339361422 /nfs/dbraw/zinc/36/14/22/1339361422.db2.gz XJOILMDYKMIMGU-UHFFFAOYSA-N 1 3 343.515 2.761 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]Cc2ccc(F)cc2)CCC1 ZINC001368494291 1339432206 /nfs/dbraw/zinc/43/22/06/1339432206.db2.gz CZESVUDWDYBZSV-HZPDHXFCSA-N 1 3 347.478 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+]CC[C@@H](C)F)CCC1)N1CCCCC1 ZINC001368499075 1339436940 /nfs/dbraw/zinc/43/69/40/1339436940.db2.gz YGJGZTYHIXFJGG-IAGOWNOFSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CCCN(Cc2ccccn2)CC1)[NH+](CC)CC ZINC001368518598 1339454400 /nfs/dbraw/zinc/45/44/00/1339454400.db2.gz XEYOMXDFLWIEDW-HKUYNNGSSA-N 1 3 346.519 2.673 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](CCc2cccs2)CC1)N(C)C ZINC001368534208 1339473017 /nfs/dbraw/zinc/47/30/17/1339473017.db2.gz QNSYLEXAILWWEG-NVXWUHKLSA-N 1 3 337.533 2.602 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](CCc2cccs2)CC1)N(C)C ZINC001368534208 1339473019 /nfs/dbraw/zinc/47/30/19/1339473019.db2.gz QNSYLEXAILWWEG-NVXWUHKLSA-N 1 3 337.533 2.602 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[N@H+](C)CC1CC2(CCC2)C1)N(C)C ZINC001368564639 1339511495 /nfs/dbraw/zinc/51/14/95/1339511495.db2.gz MDQMYGYNSOYPTP-GOSISDBHSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[N@@H+](C)CC1CC2(CCC2)C1)N(C)C ZINC001368564639 1339511499 /nfs/dbraw/zinc/51/14/99/1339511499.db2.gz MDQMYGYNSOYPTP-GOSISDBHSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]([NH2+]C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001368573157 1339522183 /nfs/dbraw/zinc/52/21/83/1339522183.db2.gz UBRNHXPKOOOQIW-YHUYYLMFSA-N 1 3 345.478 2.637 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2C[C@H]([NH2+]CC3CCC4(CC4)CC3)C2)C1 ZINC001368588224 1339535103 /nfs/dbraw/zinc/53/51/03/1339535103.db2.gz HLNXEQZABWPKHD-WDSOQIARSA-N 1 3 347.547 2.783 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2C[C@H]([NH2+][C@@H]3CCc4ccccc43)C2)C1 ZINC001368592009 1339538150 /nfs/dbraw/zinc/53/81/50/1339538150.db2.gz POVHQFOTEJZRNX-ZTTFOMCMSA-N 1 3 341.499 2.500 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]1CC[C@@H]([NH2+]CCC(F)(F)F)C1 ZINC001368639959 1339560495 /nfs/dbraw/zinc/56/04/95/1339560495.db2.gz FHZBQLDKHQZJLH-ZNMIVQPWSA-N 1 3 349.441 2.686 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H]([NH2+]CC2CCC3(CC3)CC2)C1 ZINC001368671658 1339585482 /nfs/dbraw/zinc/58/54/82/1339585482.db2.gz VHSAUJCXXKFWFX-AEFFLSMTSA-N 1 3 335.536 2.735 10 0 EFAEHO CCC[N@@H+]1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001368674484 1339589572 /nfs/dbraw/zinc/58/95/72/1339589572.db2.gz PGCHHZJYQCTBIM-VAMGGRTRSA-N 1 3 345.531 2.957 10 0 EFAEHO CCC[N@H+]1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001368674484 1339589576 /nfs/dbraw/zinc/58/95/76/1339589576.db2.gz PGCHHZJYQCTBIM-VAMGGRTRSA-N 1 3 345.531 2.957 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]2[C@@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)[C@H]21 ZINC001368692217 1339606589 /nfs/dbraw/zinc/60/65/89/1339606589.db2.gz FICKEUPJYZCUAI-NXHRZFHOSA-N 1 3 337.552 2.980 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]2[C@@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)[C@H]21 ZINC001368692217 1339606590 /nfs/dbraw/zinc/60/65/90/1339606590.db2.gz FICKEUPJYZCUAI-NXHRZFHOSA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1ccc(F)cc1CN1CC[C@@H](NC(=O)CC[NH+](C)C)C[C@@H]1C ZINC001368698527 1339615062 /nfs/dbraw/zinc/61/50/62/1339615062.db2.gz UQNPKZWBNZCCTG-MAUKXSAKSA-N 1 3 335.467 2.555 10 0 EFAEHO CC[C@H](F)C[N@H+](CC)CC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001368770800 1339695910 /nfs/dbraw/zinc/69/59/10/1339695910.db2.gz PAFLQRCTLZDGDP-ROUUACIJSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[C@H](F)C[N@@H+](CC)CC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001368770800 1339695918 /nfs/dbraw/zinc/69/59/18/1339695918.db2.gz PAFLQRCTLZDGDP-ROUUACIJSA-N 1 3 343.531 2.881 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H](C(C)C)N(C)C ZINC001368782324 1339709220 /nfs/dbraw/zinc/70/92/20/1339709220.db2.gz ZVLDJXQSDSBIPI-VAMGGRTRSA-N 1 3 345.531 2.991 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2ccccc2Cl)C1)N(C)C ZINC001368810299 1339747648 /nfs/dbraw/zinc/74/76/48/1339747648.db2.gz NFQBBYZCRCCGMZ-PUJMQQBBSA-N 1 3 337.895 2.665 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CC1CC(NC(=O)CN(C)C2CCC2)C1 ZINC001368811241 1339749647 /nfs/dbraw/zinc/74/96/47/1339749647.db2.gz VOOPHDXGNKTARJ-UHFFFAOYSA-N 1 3 347.478 2.603 10 0 EFAEHO Cc1ncccc1C[NH2+][C@@H](C)[C@@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001368845960 1339784655 /nfs/dbraw/zinc/78/46/55/1339784655.db2.gz BZXXDTCAUDFMQL-JKSUJKDBSA-N 1 3 346.519 2.637 10 0 EFAEHO C[C@@H]([NH2+]CC1CC(C)(C)C1)[C@H](C)NC(=O)CN(C)CC(C)(C)C ZINC001368882638 1339818034 /nfs/dbraw/zinc/81/80/34/1339818034.db2.gz ULRNWIULHKKCOT-CABCVRRESA-N 1 3 325.541 2.883 10 0 EFAEHO C[C@@H](NC(=O)CN(C)CC(C)(C)C)[C@@H](C)[NH2+]CC1CC(C)(C)C1 ZINC001368882642 1339818469 /nfs/dbraw/zinc/81/84/69/1339818469.db2.gz ULRNWIULHKKCOT-HUUCEWRRSA-N 1 3 325.541 2.883 10 0 EFAEHO COc1ccc(CN(C)[C@@H](C)CNC(=O)[C@@H]2CCC[N@@H+]2C(C)C)cc1 ZINC001368940470 1339886085 /nfs/dbraw/zinc/88/60/85/1339886085.db2.gz JFBFUBGGVHVKCK-LPHOPBHVSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(CN(C)[C@@H](C)CNC(=O)[C@@H]2CCC[N@H+]2C(C)C)cc1 ZINC001368940470 1339886090 /nfs/dbraw/zinc/88/60/90/1339886090.db2.gz JFBFUBGGVHVKCK-LPHOPBHVSA-N 1 3 347.503 2.505 10 0 EFAEHO CN(CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CCCC3CCCC3)C[C@H]21)C1CCC1 ZINC001369136700 1339937021 /nfs/dbraw/zinc/93/70/21/1339937021.db2.gz UTQHDJBBAOLAIA-OWZKRDHZSA-N 1 3 347.547 2.735 10 0 EFAEHO CN(CC(=O)NC[C@@H]1[C@H]2C[N@H+](CCCC3CCCC3)C[C@H]21)C1CCC1 ZINC001369136700 1339937025 /nfs/dbraw/zinc/93/70/25/1339937025.db2.gz UTQHDJBBAOLAIA-OWZKRDHZSA-N 1 3 347.547 2.735 10 0 EFAEHO CC(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C12CCC[NH+](CCC1)C2 ZINC001370331405 1340040046 /nfs/dbraw/zinc/04/00/46/1340040046.db2.gz NXICOQQYLPNYJB-KDURUIRLSA-N 1 3 347.547 2.974 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(F)c(Cl)c2)C1 ZINC001370429396 1340074025 /nfs/dbraw/zinc/07/40/25/1340074025.db2.gz NWJCZABTTRTNEJ-AWEZNQCLSA-N 1 3 341.858 2.510 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@H](C(=O)N[C@H]2C[C@H](NCC=C(Cl)Cl)C2)C1 ZINC001370531976 1340119623 /nfs/dbraw/zinc/11/96/23/1340119623.db2.gz HDJYFNNUTSMSEZ-XUXIUFHCSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H]([NH2+]CC2CCC3(CC3)CC2)C1)N(C)C ZINC001370547177 1340127719 /nfs/dbraw/zinc/12/77/19/1340127719.db2.gz LKFULJAEFXUWAM-BZSNNMDCSA-N 1 3 335.536 2.780 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@H+](CCC(F)(F)F)CC[C@@H]21 ZINC001370592904 1340153325 /nfs/dbraw/zinc/15/33/25/1340153325.db2.gz OOFYDLCFNKOXEU-GJZGRUSLSA-N 1 3 349.441 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@@H+](CCC(F)(F)F)CC[C@@H]21 ZINC001370592904 1340153327 /nfs/dbraw/zinc/15/33/27/1340153327.db2.gz OOFYDLCFNKOXEU-GJZGRUSLSA-N 1 3 349.441 2.592 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@H+](CCC(C)(C)C)C1)N(C)C ZINC001370747924 1340195625 /nfs/dbraw/zinc/19/56/25/1340195625.db2.gz CUWCZOPRHSUHHN-IRXDYDNUSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@@H+](CCC(C)(C)C)C1)N(C)C ZINC001370747924 1340195629 /nfs/dbraw/zinc/19/56/29/1340195629.db2.gz CUWCZOPRHSUHHN-IRXDYDNUSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)C1 ZINC001370787539 1340210387 /nfs/dbraw/zinc/21/03/87/1340210387.db2.gz ILGOLILODNXDBP-YLJYHZDGSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)C1 ZINC001370787539 1340210390 /nfs/dbraw/zinc/21/03/90/1340210390.db2.gz ILGOLILODNXDBP-YLJYHZDGSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)C1 ZINC001370787524 1340210929 /nfs/dbraw/zinc/21/09/29/1340210929.db2.gz ILGOLILODNXDBP-FXAWDEMLSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)C1 ZINC001370787524 1340210930 /nfs/dbraw/zinc/21/09/30/1340210930.db2.gz ILGOLILODNXDBP-FXAWDEMLSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1ccc(CC[NH2+]C2CCC(NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001371069527 1340342724 /nfs/dbraw/zinc/34/27/24/1340342724.db2.gz CTNDZLGJQQOJRL-UHFFFAOYSA-N 1 3 345.531 2.895 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001371179915 1340397443 /nfs/dbraw/zinc/39/74/43/1340397443.db2.gz SHQYFTXSSRKKBR-APWZRJJASA-N 1 3 331.504 2.716 10 0 EFAEHO CCc1ccc(CC[NH2+][C@@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001371179160 1340397781 /nfs/dbraw/zinc/39/77/81/1340397781.db2.gz QGUKTZUOHHGBDY-PXNSSMCTSA-N 1 3 345.531 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]C/C=C/c2ccc(Cl)cc2)C1 ZINC001371554317 1340641657 /nfs/dbraw/zinc/64/16/57/1340641657.db2.gz DQNKRSWRIDAVQP-WRFKIARRSA-N 1 3 349.906 2.884 10 0 EFAEHO CC(C)C1(C)CCN(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)CC1 ZINC001371594323 1340664919 /nfs/dbraw/zinc/66/49/19/1340664919.db2.gz ACKIAKNSMPBQJZ-KRWDZBQOSA-N 1 3 340.556 2.726 10 0 EFAEHO CC(C)C1(C)CCN(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)CC1 ZINC001371594323 1340664924 /nfs/dbraw/zinc/66/49/24/1340664924.db2.gz ACKIAKNSMPBQJZ-KRWDZBQOSA-N 1 3 340.556 2.726 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001371612091 1340675394 /nfs/dbraw/zinc/67/53/94/1340675394.db2.gz FLWOBRMGRVZZGX-GOSISDBHSA-N 1 3 331.504 2.582 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001371620737 1340679652 /nfs/dbraw/zinc/67/96/52/1340679652.db2.gz SDWYKOKEHSLGKM-IAGOWNOFSA-N 1 3 347.503 2.535 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001371620728 1340679960 /nfs/dbraw/zinc/67/99/60/1340679960.db2.gz SDWYKOKEHSLGKM-DLBZAZTESA-N 1 3 347.503 2.535 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+][C@H](C)c2cccc(F)c2)C1 ZINC001371622741 1340681159 /nfs/dbraw/zinc/68/11/59/1340681159.db2.gz VACIYPVLVLZGQS-CVEARBPZSA-N 1 3 335.467 2.665 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@@H]([NH2+]CC3CC(C)(C)C3)C2)CCC1 ZINC001371634105 1340685567 /nfs/dbraw/zinc/68/55/67/1340685567.db2.gz NOCPTRJHJLLWCA-IAGOWNOFSA-N 1 3 335.536 2.924 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@@H]([NH2+]CC3CC(C)(C)C3)C2)CCC1 ZINC001371634138 1340685572 /nfs/dbraw/zinc/68/55/72/1340685572.db2.gz NOCPTRJHJLLWCA-SJORKVTESA-N 1 3 335.536 2.924 10 0 EFAEHO CCCN(C(=O)[C@@H]1CC[N@H+](C)C1)[C@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001373127378 1340917444 /nfs/dbraw/zinc/91/74/44/1340917444.db2.gz JWNIFQQIRXIGEA-UXHICEINSA-N 1 3 343.515 2.760 10 0 EFAEHO CCCN(C(=O)[C@@H]1CC[N@@H+](C)C1)[C@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001373127378 1340917445 /nfs/dbraw/zinc/91/74/45/1340917445.db2.gz JWNIFQQIRXIGEA-UXHICEINSA-N 1 3 343.515 2.760 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@@H](CCNC(=O)CN2CC[C@H](C)C2)C1 ZINC001373220749 1340954242 /nfs/dbraw/zinc/95/42/42/1340954242.db2.gz CFRNRYSPRZMWRO-PKOBYXMFSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@@H](CCNC(=O)CN2CC[C@H](C)C2)C1 ZINC001373220749 1340954243 /nfs/dbraw/zinc/95/42/43/1340954243.db2.gz CFRNRYSPRZMWRO-PKOBYXMFSA-N 1 3 343.515 2.665 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[N@H+](C)CCc2ccc(C)cc2)C1)N(C)C ZINC001373306182 1340983956 /nfs/dbraw/zinc/98/39/56/1340983956.db2.gz XXCHDJPSMFPMOU-WOJBJXKFSA-N 1 3 345.531 2.658 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[N@@H+](C)CCc2ccc(C)cc2)C1)N(C)C ZINC001373306182 1340983957 /nfs/dbraw/zinc/98/39/57/1340983957.db2.gz XXCHDJPSMFPMOU-WOJBJXKFSA-N 1 3 345.531 2.658 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+](C)C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001373316285 1340988533 /nfs/dbraw/zinc/98/85/33/1340988533.db2.gz RFUIAGDGKNPFDG-KRWDZBQOSA-N 1 3 349.494 2.755 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+](C)C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001373316285 1340988534 /nfs/dbraw/zinc/98/85/34/1340988534.db2.gz RFUIAGDGKNPFDG-KRWDZBQOSA-N 1 3 349.494 2.755 10 0 EFAEHO Cc1cccc(C)c1CN1CC(CNC(=O)CC[C@H]2CCC[N@H+]2C)C1 ZINC001373512746 1341041426 /nfs/dbraw/zinc/04/14/26/1341041426.db2.gz DTAPCIGCAULNMV-LJQANCHMSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1cccc(C)c1CN1CC(CNC(=O)CC[C@H]2CCC[N@@H+]2C)C1 ZINC001373512746 1341041427 /nfs/dbraw/zinc/04/14/27/1341041427.db2.gz DTAPCIGCAULNMV-LJQANCHMSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)C(C)(C)[NH+]3CCCC3)C2)cc1C ZINC001373528239 1341045205 /nfs/dbraw/zinc/04/52/05/1341045205.db2.gz IYHQLUOEYHIMHK-UHFFFAOYSA-N 1 3 343.515 2.726 10 0 EFAEHO CC(C)CCCN1C[C@@H]2C[C@H]1CN2C(=O)C12CCC[NH+](CCC1)C2 ZINC001373569544 1341056377 /nfs/dbraw/zinc/05/63/77/1341056377.db2.gz WUJGCHBHRSSCDW-ROUUACIJSA-N 1 3 333.520 2.584 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccc(F)cc1C ZINC001373754955 1341135453 /nfs/dbraw/zinc/13/54/53/1341135453.db2.gz QRGFGOJHGFZBRL-RTBURBONSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC001373832342 1341166595 /nfs/dbraw/zinc/16/65/95/1341166595.db2.gz CNAQADUGXNZSSP-YLJYHZDGSA-N 1 3 345.531 2.616 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC001373832339 1341166819 /nfs/dbraw/zinc/16/68/19/1341166819.db2.gz CNAQADUGXNZSSP-XLIONFOSSA-N 1 3 345.531 2.616 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H]([NH2+]Cc2cccc(F)c2)CC1 ZINC001373923498 1341205256 /nfs/dbraw/zinc/20/52/56/1341205256.db2.gz PAFJPWQBDOPSQB-IYARVYRRSA-N 1 3 335.467 2.683 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+]C[C@H]2CCC(F)(F)C2)CCCC1)N(C)C ZINC001374164529 1341489614 /nfs/dbraw/zinc/48/96/14/1341489614.db2.gz ZONQOJKAVSWHGR-LSDHHAIUSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(F)c(Cl)c1)N(C)C(=O)[C@@H]1CCCN1C ZINC001374206283 1341553730 /nfs/dbraw/zinc/55/37/30/1341553730.db2.gz NJQSZMJPPNJPLP-WBMJQRKESA-N 1 3 341.858 2.510 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H](C)N(C)C(=O)[C@@H]2CCCCN2C)c1 ZINC001374248877 1341606336 /nfs/dbraw/zinc/60/63/36/1341606336.db2.gz XCCUKQJZCAOKBK-QAPCUYQASA-N 1 3 335.467 2.555 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(Cl)cc1 ZINC001374327066 1341729295 /nfs/dbraw/zinc/72/92/95/1341729295.db2.gz IPLHDFJHFFYRJZ-CQSZACIVSA-N 1 3 325.884 2.617 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1C ZINC001374383390 1341832971 /nfs/dbraw/zinc/83/29/71/1341832971.db2.gz JNTMJNQVJSKSDP-UYAOXDASSA-N 1 3 345.531 2.970 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1csc(C)c1)C(C)C)N(C)C ZINC001374442132 1341926143 /nfs/dbraw/zinc/92/61/43/1341926143.db2.gz ATQOCKOIKOTLMO-JKSUJKDBSA-N 1 3 325.522 2.627 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001374455493 1341936303 /nfs/dbraw/zinc/93/63/03/1341936303.db2.gz SLYDXJUTNYBKMT-RBUKOAKNSA-N 1 3 349.494 2.884 10 0 EFAEHO COc1ccc(CN(C)C[C@@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)cc1 ZINC001392663122 1356210583 /nfs/dbraw/zinc/21/05/83/1356210583.db2.gz NFRSDQHZQXLPRS-SJLPKXTDSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1ccc(CN(C)C[C@@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)cc1 ZINC001392663122 1356210587 /nfs/dbraw/zinc/21/05/87/1356210587.db2.gz NFRSDQHZQXLPRS-SJLPKXTDSA-N 1 3 347.503 2.506 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001374505704 1341994814 /nfs/dbraw/zinc/99/48/14/1341994814.db2.gz FETINHAZVDDYPQ-AEFFLSMTSA-N 1 3 349.544 2.698 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001374505704 1341994819 /nfs/dbraw/zinc/99/48/19/1341994819.db2.gz FETINHAZVDDYPQ-AEFFLSMTSA-N 1 3 349.544 2.698 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)[C@@H](C(C)C)[NH+](C)C)c(Cl)c1 ZINC001374930611 1342247411 /nfs/dbraw/zinc/24/74/11/1342247411.db2.gz BVPNONMKDRGNGZ-WMLDXEAASA-N 1 3 339.911 2.829 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001374962694 1342272561 /nfs/dbraw/zinc/27/25/61/1342272561.db2.gz IPSSSPBZILFWHK-SUMWQHHRSA-N 1 3 337.895 2.763 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CNCc1ccccc1F)[NH+]1CCCC1 ZINC001374981236 1342285585 /nfs/dbraw/zinc/28/55/85/1342285585.db2.gz JTIAYCBFLAJLGS-MAUKXSAKSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC001374981777 1342286317 /nfs/dbraw/zinc/28/63/17/1342286317.db2.gz KZRYYRDPZJLKSM-ZDUSSCGKSA-N 1 3 345.409 2.640 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1C ZINC001375047297 1342346239 /nfs/dbraw/zinc/34/62/39/1342346239.db2.gz QZMNOIYDWMAVQQ-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1C ZINC001375047297 1342346246 /nfs/dbraw/zinc/34/62/46/1342346246.db2.gz QZMNOIYDWMAVQQ-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](C[N@H+](C)CC/C=C/c1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001375105994 1342415083 /nfs/dbraw/zinc/41/50/83/1342415083.db2.gz VKWPVEUOBGHHQV-ZWQQMPCFSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC/C=C/c1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001375105994 1342415086 /nfs/dbraw/zinc/41/50/86/1342415086.db2.gz VKWPVEUOBGHHQV-ZWQQMPCFSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCc1cccc(F)c1)NC(=O)CN1CC[C@H](C)C1 ZINC001375105948 1342415547 /nfs/dbraw/zinc/41/55/47/1342415547.db2.gz UYPVJIYKXUMXSU-IRXDYDNUSA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCc1cccc(F)c1)NC(=O)CN1CC[C@H](C)C1 ZINC001375105948 1342415550 /nfs/dbraw/zinc/41/55/50/1342415550.db2.gz UYPVJIYKXUMXSU-IRXDYDNUSA-N 1 3 349.494 2.537 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCCC[C@H]2C[NH2+]Cc2ccsc2)CCC1 ZINC001375179123 1342494075 /nfs/dbraw/zinc/49/40/75/1342494075.db2.gz YMFXOLUMSMHIQE-IRXDYDNUSA-N 1 3 349.544 2.997 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](NC(=O)[C@@H]2CCCN2C(C)C)C2CC2)cc1 ZINC001375221796 1342524461 /nfs/dbraw/zinc/52/44/61/1342524461.db2.gz DBNFMANSUYWHDS-UXHICEINSA-N 1 3 343.515 2.852 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](NC(=O)[C@@H]2CCCN2C(C)C)C2CC2)cc1 ZINC001375221793 1342524607 /nfs/dbraw/zinc/52/46/07/1342524607.db2.gz DBNFMANSUYWHDS-PMACEKPBSA-N 1 3 343.515 2.852 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H](NC(=O)[C@@H]1CCCN1C(C)C)C1CC1 ZINC001375226482 1342529541 /nfs/dbraw/zinc/52/95/41/1342529541.db2.gz WVEUDBPLEKKRQH-UXHICEINSA-N 1 3 343.515 2.852 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CC2CC(C)(C)C2)[C@@H](CC)C1 ZINC001375285235 1342593004 /nfs/dbraw/zinc/59/30/04/1342593004.db2.gz KXJUSJUDWIECDR-ZWKOTPCHSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@H]2CCCN2C(C)C)CC1 ZINC001393493526 1356895151 /nfs/dbraw/zinc/89/51/51/1356895151.db2.gz KXTTZAUDBGKSIF-XSLAGTTESA-N 1 3 341.515 2.872 10 0 EFAEHO CC1CCC(C[N@@H+]2CC[C@@H]2CNC(=O)C(C)(C)N2CCCC2)CC1 ZINC001375338118 1342644454 /nfs/dbraw/zinc/64/44/54/1342644454.db2.gz WJJZYOFZDPGKKM-DAWZGUTISA-N 1 3 335.536 2.878 10 0 EFAEHO CC1CCC(C[N@H+]2CC[C@@H]2CNC(=O)C(C)(C)N2CCCC2)CC1 ZINC001375338118 1342644456 /nfs/dbraw/zinc/64/44/56/1342644456.db2.gz WJJZYOFZDPGKKM-DAWZGUTISA-N 1 3 335.536 2.878 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NCC1(N[C@H](C)c2cccc(F)c2)CC1 ZINC001375426229 1342729786 /nfs/dbraw/zinc/72/97/86/1342729786.db2.gz YWRVUZNLJHBFNB-QAPCUYQASA-N 1 3 347.478 3.000 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NCC1(N[C@H](C)c2cccc(F)c2)CC1 ZINC001375426229 1342729789 /nfs/dbraw/zinc/72/97/89/1342729789.db2.gz YWRVUZNLJHBFNB-QAPCUYQASA-N 1 3 347.478 3.000 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+][C@H](C)c2cccc(F)c2)CC1 ZINC001375426229 1342729790 /nfs/dbraw/zinc/72/97/90/1342729790.db2.gz YWRVUZNLJHBFNB-QAPCUYQASA-N 1 3 347.478 3.000 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NCC1(N[C@@H](C)c2cccc(F)c2)CC1 ZINC001375426231 1342729815 /nfs/dbraw/zinc/72/98/15/1342729815.db2.gz YWRVUZNLJHBFNB-YJBOKZPZSA-N 1 3 347.478 3.000 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NCC1(N[C@@H](C)c2cccc(F)c2)CC1 ZINC001375426231 1342729816 /nfs/dbraw/zinc/72/98/16/1342729816.db2.gz YWRVUZNLJHBFNB-YJBOKZPZSA-N 1 3 347.478 3.000 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+][C@@H](C)c2cccc(F)c2)CC1 ZINC001375426231 1342729817 /nfs/dbraw/zinc/72/98/17/1342729817.db2.gz YWRVUZNLJHBFNB-YJBOKZPZSA-N 1 3 347.478 3.000 10 0 EFAEHO CN(CC(=O)NCC1([NH2+][C@H]2CCCc3ccccc32)CC1)C1CCC1 ZINC001375428728 1342731905 /nfs/dbraw/zinc/73/19/05/1342731905.db2.gz FSEJIOXZFSMAIU-IBGZPJMESA-N 1 3 341.499 2.787 10 0 EFAEHO C[C@@H]([NH2+]C1(CNC(=O)CN2CC[C@@H](C)C2)CC1)c1ccc(Cl)cc1 ZINC001375493547 1342800692 /nfs/dbraw/zinc/80/06/92/1342800692.db2.gz YXZHEAWYCYSNQY-HUUCEWRRSA-N 1 3 349.906 2.981 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]([NH2+]CCC2CCCC2)C1)N1CCCC1 ZINC001375540335 1342852195 /nfs/dbraw/zinc/85/21/95/1342852195.db2.gz GDKZDICKQMHJDW-IYARVYRRSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@H]3C)CC2)cc1F ZINC001375554722 1342869132 /nfs/dbraw/zinc/86/91/32/1342869132.db2.gz QKTJSYYZYWALLK-HZPDHXFCSA-N 1 3 347.478 2.745 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CC=C(Cl)Cl)C1)N(C)C ZINC001375576114 1342895187 /nfs/dbraw/zinc/89/51/87/1342895187.db2.gz ZHESNUTZJDLYRN-XQQFMLRXSA-N 1 3 336.307 2.520 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+][C@@H](C)c2ccccc2)C1 ZINC001375577537 1342896262 /nfs/dbraw/zinc/89/62/62/1342896262.db2.gz LEIBLMAURQTFEB-JENIJYKNSA-N 1 3 331.504 2.964 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@@H]([NH2+]CCC2CCCC2)C1 ZINC001375581550 1342901006 /nfs/dbraw/zinc/90/10/06/1342901006.db2.gz XSVFPYNGSPZQRJ-DLBZAZTESA-N 1 3 332.492 2.715 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@]1(C)CC[N@H+](Cc2cccc(C)c2)C1 ZINC001375828520 1343062235 /nfs/dbraw/zinc/06/22/35/1343062235.db2.gz JGRDTNNIHSSJCX-AZUAARDMSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@]1(C)CC[N@@H+](Cc2cccc(C)c2)C1 ZINC001375828520 1343062241 /nfs/dbraw/zinc/06/22/41/1343062241.db2.gz JGRDTNNIHSSJCX-AZUAARDMSA-N 1 3 349.494 2.756 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001375883390 1343129530 /nfs/dbraw/zinc/12/95/30/1343129530.db2.gz VLQGKYQBIQGYAB-MJGOQNOKSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001375883388 1343129728 /nfs/dbraw/zinc/12/97/28/1343129728.db2.gz VLQGKYQBIQGYAB-IEBWSBKVSA-N 1 3 335.536 2.735 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@]2(C)CCC[N@H+](CC3CCCC3)C2)CCC1 ZINC001375950565 1343203292 /nfs/dbraw/zinc/20/32/92/1343203292.db2.gz WCGVFRFEHUBMBX-LJQANCHMSA-N 1 3 335.536 2.879 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@]2(C)CCC[N@@H+](CC3CCCC3)C2)CCC1 ZINC001375950565 1343203294 /nfs/dbraw/zinc/20/32/94/1343203294.db2.gz WCGVFRFEHUBMBX-LJQANCHMSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001376146570 1343353870 /nfs/dbraw/zinc/35/38/70/1343353870.db2.gz UEYNJODLFHACOG-APWZRJJASA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001376146570 1343353874 /nfs/dbraw/zinc/35/38/74/1343353874.db2.gz UEYNJODLFHACOG-APWZRJJASA-N 1 3 341.515 2.826 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC(C)(NC/C(Cl)=C\Cl)CC1 ZINC001393749035 1357123594 /nfs/dbraw/zinc/12/35/94/1357123594.db2.gz UWRBWVAIUFSTCZ-ACCUITESSA-N 1 3 336.307 2.618 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC(C)(NC/C(Cl)=C\Cl)CC1 ZINC001393749035 1357123595 /nfs/dbraw/zinc/12/35/95/1357123595.db2.gz UWRBWVAIUFSTCZ-ACCUITESSA-N 1 3 336.307 2.618 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1ccc(C)c(C)c1)C1CC1)N(C)C ZINC001376211582 1343402154 /nfs/dbraw/zinc/40/21/54/1343402154.db2.gz CPXVHWKCJFYMBX-RBUKOAKNSA-N 1 3 331.504 2.628 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]([NH2+]CCC2CCCCC2)C2CC2)CCC1 ZINC001376219178 1343406520 /nfs/dbraw/zinc/40/65/20/1343406520.db2.gz RUQRDHFZAZXKHP-GOSISDBHSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(CC(=O)N1CC[C@H]([NH2+][C@H]2CCc3ccccc32)C1)CC(C)(C)C ZINC001376333573 1343490220 /nfs/dbraw/zinc/49/02/20/1343490220.db2.gz SJHUTBSDMXLNIP-HKUYNNGSSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001376352451 1343506792 /nfs/dbraw/zinc/50/67/92/1343506792.db2.gz YCWWRSARAYCTII-RTBURBONSA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CC2CC(C)(C)C2)CC1(C)C ZINC001393761986 1357135655 /nfs/dbraw/zinc/13/56/55/1357135655.db2.gz VITDDDFVLOGSAP-QGZVFWFLSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CC2CC(C)(C)C2)CC1(C)C ZINC001393761986 1357135658 /nfs/dbraw/zinc/13/56/58/1357135658.db2.gz VITDDDFVLOGSAP-QGZVFWFLSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)c1ccccc1C[NH2+][C@H]1C[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001376411372 1343565827 /nfs/dbraw/zinc/56/58/27/1343565827.db2.gz WXTBGZACHHUSDM-IYARVYRRSA-N 1 3 331.504 2.887 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@H](C)c2ccc3c(c2)CCC3)C1 ZINC001376411059 1343566024 /nfs/dbraw/zinc/56/60/24/1343566024.db2.gz VXVBZQGBKQUBPO-CDHQVMDDSA-N 1 3 343.515 2.813 10 0 EFAEHO CC[C@H](c1ccccc1)[N@H+]1C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001376415643 1343569766 /nfs/dbraw/zinc/56/97/66/1343569766.db2.gz RQYBGHDJINBYIP-HSALFYBXSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](c1ccccc1)[N@@H+]1C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001376415643 1343569767 /nfs/dbraw/zinc/56/97/67/1343569767.db2.gz RQYBGHDJINBYIP-HSALFYBXSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H]2C[C@@H](NC(=O)CN(C)CC(C)(C)C)C2)cc1 ZINC001376476253 1343618031 /nfs/dbraw/zinc/61/80/31/1343618031.db2.gz IDZXEPYOSFKLMC-KDURUIRLSA-N 1 3 345.531 2.752 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc(F)c2)C1)CC(C)(C)C ZINC001376477403 1343618172 /nfs/dbraw/zinc/61/81/72/1343618172.db2.gz KPKMSXOJVJRIQX-CALCHBBNSA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]C/C=C\c2ccc(Cl)cc2)C1)N(C)C ZINC001376480690 1343619215 /nfs/dbraw/zinc/61/92/15/1343619215.db2.gz VECXUUFQBJCEMO-NQVSYGGRSA-N 1 3 349.906 2.930 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@H+](CCCc2ccccc2)C1 ZINC001376525110 1343650357 /nfs/dbraw/zinc/65/03/57/1343650357.db2.gz DNZFPMNNKIDBCC-FQEVSTJZSA-N 1 3 345.531 2.788 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@@H+](CCCc2ccccc2)C1 ZINC001376525110 1343650358 /nfs/dbraw/zinc/65/03/58/1343650358.db2.gz DNZFPMNNKIDBCC-FQEVSTJZSA-N 1 3 345.531 2.788 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]2CN(C/C=C/c3ccccc3)C[C@H]21 ZINC001376530034 1343654799 /nfs/dbraw/zinc/65/47/99/1343654799.db2.gz KCISGIDDWQMMGG-HZQWVYJSSA-N 1 3 341.499 2.574 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001376580561 1343697636 /nfs/dbraw/zinc/69/76/36/1343697636.db2.gz UJVOSLGOSWBYEA-INIZCTEOSA-N 1 3 337.533 2.725 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+]C[C@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001376618371 1343725981 /nfs/dbraw/zinc/72/59/81/1343725981.db2.gz RWHVITAPOZQXPU-ZWKOTPCHSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H]1CCC[N@H+](CCC(C)(C)C)C1 ZINC001376623647 1343729988 /nfs/dbraw/zinc/72/99/88/1343729988.db2.gz LJXLHCRJTVOXPP-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H]1CCC[N@@H+](CCC(C)(C)C)C1 ZINC001376623647 1343729992 /nfs/dbraw/zinc/72/99/92/1343729992.db2.gz LJXLHCRJTVOXPP-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H]1CCC[N@H+](CCC(C)(C)C)C1 ZINC001376626134 1343733864 /nfs/dbraw/zinc/73/38/64/1343733864.db2.gz OVLMTRXOBZTHJF-ZBFHGGJFSA-N 1 3 334.508 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H]1CCC[N@@H+](CCC(C)(C)C)C1 ZINC001376626134 1343733866 /nfs/dbraw/zinc/73/38/66/1343733866.db2.gz OVLMTRXOBZTHJF-ZBFHGGJFSA-N 1 3 334.508 2.914 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@@H]1[C@H]2C[N@H+](CCCC(C)(C)C)C[C@H]21 ZINC001376659090 1343748701 /nfs/dbraw/zinc/74/87/01/1343748701.db2.gz ATSYNZHEGBZPOR-RXYDEIHYSA-N 1 3 335.536 2.732 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@@H]1[C@H]2C[N@@H+](CCCC(C)(C)C)C[C@H]21 ZINC001376659090 1343748704 /nfs/dbraw/zinc/74/87/04/1343748704.db2.gz ATSYNZHEGBZPOR-RXYDEIHYSA-N 1 3 335.536 2.732 10 0 EFAEHO CC[C@H](C(=O)NCc1cccc2c1CC[N@H+](CCC1CC1)C2)N(C)C ZINC001376677179 1343760314 /nfs/dbraw/zinc/76/03/14/1343760314.db2.gz VAMMJAGBKCVORY-HXUWFJFHSA-N 1 3 343.515 2.801 10 0 EFAEHO CC[C@H](C(=O)NCc1cccc2c1CC[N@@H+](CCC1CC1)C2)N(C)C ZINC001376677179 1343760319 /nfs/dbraw/zinc/76/03/19/1343760319.db2.gz VAMMJAGBKCVORY-HXUWFJFHSA-N 1 3 343.515 2.801 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)NCc1cc2ccccc2o1 ZINC001376713693 1343778804 /nfs/dbraw/zinc/77/88/04/1343778804.db2.gz BUVSOMKUHPHYCS-CRAIPNDOSA-N 1 3 343.471 2.900 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)NCc1cc2ccccc2o1 ZINC001376713693 1343778806 /nfs/dbraw/zinc/77/88/06/1343778806.db2.gz BUVSOMKUHPHYCS-CRAIPNDOSA-N 1 3 343.471 2.900 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)NCc1cc(C)ccc1F ZINC001376731241 1343788755 /nfs/dbraw/zinc/78/87/55/1343788755.db2.gz NFQZLWODBDFICV-CRAIPNDOSA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)NCc1cc(C)ccc1F ZINC001376731241 1343788759 /nfs/dbraw/zinc/78/87/59/1343788759.db2.gz NFQZLWODBDFICV-CRAIPNDOSA-N 1 3 335.467 2.603 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1cc(C)sc1C ZINC001376731368 1343789064 /nfs/dbraw/zinc/78/90/64/1343789064.db2.gz NPQJDAFYTMJDNR-SUMWQHHRSA-N 1 3 337.533 2.834 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CCC1)N1CCCC1 ZINC001376770989 1343822979 /nfs/dbraw/zinc/82/29/79/1343822979.db2.gz QYGPNHCPFGAZCH-FGTMMUONSA-N 1 3 347.547 2.926 10 0 EFAEHO CC(C)c1ccccc1C[NH2+][C@@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001376800342 1343850070 /nfs/dbraw/zinc/85/00/70/1343850070.db2.gz LLEJOOWVFKAJPH-SJORKVTESA-N 1 3 331.504 2.746 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]C[C@@H]2CCCC(F)(F)C2)CCC1 ZINC001376815343 1343867099 /nfs/dbraw/zinc/86/70/99/1343867099.db2.gz BNDKBZBJXGUIMQ-OAHLLOKOSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]C[C@H]2CCCC(F)(F)C2)CCC1 ZINC001376815341 1343867661 /nfs/dbraw/zinc/86/76/61/1343867661.db2.gz BNDKBZBJXGUIMQ-HNNXBMFYSA-N 1 3 345.478 2.781 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](Cc2ccc(F)cc2C)CC1)N(C)C ZINC001376883143 1343918340 /nfs/dbraw/zinc/91/83/40/1343918340.db2.gz NSYDYJLUGNZKDJ-RTBURBONSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2C)CC1)N(C)C ZINC001376883143 1343918343 /nfs/dbraw/zinc/91/83/43/1343918343.db2.gz NSYDYJLUGNZKDJ-RTBURBONSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC[C@H](NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001376909309 1343947735 /nfs/dbraw/zinc/94/77/35/1343947735.db2.gz GYENABWJYXFDTM-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CCC[N@H+]1CCC[C@H](NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001376909309 1343947743 /nfs/dbraw/zinc/94/77/43/1343947743.db2.gz GYENABWJYXFDTM-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccc(F)c(C[N@H+]2CCC[C@@H](NC(=O)CN(C)C(C)C)CC2)c1 ZINC001376911587 1343949686 /nfs/dbraw/zinc/94/96/86/1343949686.db2.gz KMVOQPVPPWYHDU-GOSISDBHSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(C[N@@H+]2CCC[C@@H](NC(=O)CN(C)C(C)C)CC2)c1 ZINC001376911587 1343949688 /nfs/dbraw/zinc/94/96/88/1343949688.db2.gz KMVOQPVPPWYHDU-GOSISDBHSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001376952051 1343981312 /nfs/dbraw/zinc/98/13/12/1343981312.db2.gz DGDQNABEQCWOCV-GOSISDBHSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)C[N@H+](C)CCCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001376978828 1344009277 /nfs/dbraw/zinc/00/92/77/1344009277.db2.gz DTPZWYICGVPHNJ-SFHVURJKSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)C[N@@H+](C)CCCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001376978828 1344009281 /nfs/dbraw/zinc/00/92/81/1344009281.db2.gz DTPZWYICGVPHNJ-SFHVURJKSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)[C@@H]1CCCC[N@@H+]1C(C)C ZINC001376990898 1344026584 /nfs/dbraw/zinc/02/65/84/1344026584.db2.gz HXWXMQCROSKYOL-IRXDYDNUSA-N 1 3 329.504 2.778 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)[C@@H]1CCCC[N@H+]1C(C)C ZINC001376990898 1344026590 /nfs/dbraw/zinc/02/65/90/1344026590.db2.gz HXWXMQCROSKYOL-IRXDYDNUSA-N 1 3 329.504 2.778 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@@H](C)C2)c(C)s1 ZINC001377070830 1344115190 /nfs/dbraw/zinc/11/51/90/1344115190.db2.gz WLLMYLGHITVBEN-ZIAGYGMSSA-N 1 3 337.533 2.691 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@@H+]1CCC1CC1)N1CCCCC1 ZINC001377419554 1344161615 /nfs/dbraw/zinc/16/16/15/1344161615.db2.gz UEHBOOVXDQXVEV-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@H+]1CCC1CC1)N1CCCCC1 ZINC001377419554 1344161618 /nfs/dbraw/zinc/16/16/18/1344161618.db2.gz UEHBOOVXDQXVEV-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[N@H+](CCC(C)(C)C)CC1CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001377596165 1344203468 /nfs/dbraw/zinc/20/34/68/1344203468.db2.gz XJVODRXDQMBONB-UHFFFAOYSA-N 1 3 334.508 2.949 10 0 EFAEHO CC[N@@H+](CCC(C)(C)C)CC1CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001377596165 1344203475 /nfs/dbraw/zinc/20/34/75/1344203475.db2.gz XJVODRXDQMBONB-UHFFFAOYSA-N 1 3 334.508 2.949 10 0 EFAEHO CCC(CC)C[NH2+][C@@H](C)C1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001377612026 1344220237 /nfs/dbraw/zinc/22/02/37/1344220237.db2.gz QRPPGLOZYBDZQK-INIZCTEOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]C[C@@H]1CCc2ccccc2C1)N(C)C ZINC001393808240 1357173770 /nfs/dbraw/zinc/17/37/70/1357173770.db2.gz PTDXZOMOVIWETB-SQGPQFPESA-N 1 3 345.531 2.616 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]CC1CCCC1)c1ccccc1)N(C)C ZINC001377619496 1344227763 /nfs/dbraw/zinc/22/77/63/1344227763.db2.gz ICCVBGVDBPIWJK-RBUKOAKNSA-N 1 3 331.504 2.964 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCC[N@H+](CCC)C1)[C@H]1CCN(CCCF)C1 ZINC001377658630 1344278766 /nfs/dbraw/zinc/27/87/66/1344278766.db2.gz UHHJRLJCUJQCDM-MSOLQXFVSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCC[N@@H+](CCC)C1)[C@H]1CCN(CCCF)C1 ZINC001377658630 1344278771 /nfs/dbraw/zinc/27/87/71/1344278771.db2.gz UHHJRLJCUJQCDM-MSOLQXFVSA-N 1 3 341.515 2.781 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cc2ccccc2o1 ZINC001393814106 1357178781 /nfs/dbraw/zinc/17/87/81/1357178781.db2.gz CPXSUKJHVDTLRU-HOTGVXAUSA-N 1 3 343.471 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@H+](C)Cc1ccc(F)cc1 ZINC001377680245 1344312793 /nfs/dbraw/zinc/31/27/93/1344312793.db2.gz TVTKXJPGPPRTAL-GOSISDBHSA-N 1 3 335.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@@H+](C)Cc1ccc(F)cc1 ZINC001377680245 1344312796 /nfs/dbraw/zinc/31/27/96/1344312796.db2.gz TVTKXJPGPPRTAL-GOSISDBHSA-N 1 3 335.467 2.589 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cc2ccccc2o1 ZINC001393814099 1357178988 /nfs/dbraw/zinc/17/89/88/1357178988.db2.gz CPXSUKJHVDTLRU-CVEARBPZSA-N 1 3 343.471 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001377681904 1344315616 /nfs/dbraw/zinc/31/56/16/1344315616.db2.gz XRNIKANUINKOLI-AZUAARDMSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001377681904 1344315620 /nfs/dbraw/zinc/31/56/20/1344315620.db2.gz XRNIKANUINKOLI-AZUAARDMSA-N 1 3 343.515 2.937 10 0 EFAEHO CN(C)C1(C(=O)NC2CC(C[NH2+]CC3CCC4(CC4)CC3)C2)CCC1 ZINC001377717911 1344364326 /nfs/dbraw/zinc/36/43/26/1344364326.db2.gz UZXBZMSKUWXCKJ-UHFFFAOYSA-N 1 3 347.547 2.926 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1CC(C[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001377716907 1344364418 /nfs/dbraw/zinc/36/44/18/1344364418.db2.gz QYQWWOZRPCTALS-VJFUWPCTSA-N 1 3 335.536 2.637 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@@H]1CC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC001377726750 1344376721 /nfs/dbraw/zinc/37/67/21/1344376721.db2.gz XGVHHIDAGOFMQO-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@@H]1CC[N@@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC001377726750 1344376726 /nfs/dbraw/zinc/37/67/26/1344376726.db2.gz XGVHHIDAGOFMQO-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001377734985 1344383331 /nfs/dbraw/zinc/38/33/31/1344383331.db2.gz FHXGEVIUZZXZMP-QLOJAFMTSA-N 1 3 345.531 2.936 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](C[N@H+](C)C/C=C/c2ccccc2)C1 ZINC001377751289 1344398039 /nfs/dbraw/zinc/39/80/39/1344398039.db2.gz LXCNOXZBWPIQGC-UPBJVAEDSA-N 1 3 341.499 2.574 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](C[N@@H+](C)C/C=C/c2ccccc2)C1 ZINC001377751289 1344398043 /nfs/dbraw/zinc/39/80/43/1344398043.db2.gz LXCNOXZBWPIQGC-UPBJVAEDSA-N 1 3 341.499 2.574 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001377776728 1344425500 /nfs/dbraw/zinc/42/55/00/1344425500.db2.gz AYPYACNPCJHGCR-CVEARBPZSA-N 1 3 345.478 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001377776728 1344425506 /nfs/dbraw/zinc/42/55/06/1344425506.db2.gz AYPYACNPCJHGCR-CVEARBPZSA-N 1 3 345.478 2.542 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001377810003 1344462501 /nfs/dbraw/zinc/46/25/01/1344462501.db2.gz RJSHYBNNSBDSOX-VXGBXAGGSA-N 1 3 343.924 2.869 10 0 EFAEHO C[C@@H]([NH2+]CC1CCC2(CC2)CC1)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001377824751 1344481349 /nfs/dbraw/zinc/48/13/49/1344481349.db2.gz MRRIOSCWISEQDK-CVEARBPZSA-N 1 3 335.536 2.924 10 0 EFAEHO CCc1ccccc1CN1CC(CNC(=O)CC[C@H]2CCC[N@@H+]2C)C1 ZINC001377973282 1344627639 /nfs/dbraw/zinc/62/76/39/1344627639.db2.gz CAGTXWBWJPLKIX-HXUWFJFHSA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1ccccc1CN1CC(CNC(=O)CC[C@H]2CCC[N@H+]2C)C1 ZINC001377973282 1344627640 /nfs/dbraw/zinc/62/76/40/1344627640.db2.gz CAGTXWBWJPLKIX-HXUWFJFHSA-N 1 3 343.515 2.671 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@@H](C)CNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001378112846 1344775007 /nfs/dbraw/zinc/77/50/07/1344775007.db2.gz HWZIEGZTBHLICY-INIZCTEOSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@H+](C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001378117225 1344779455 /nfs/dbraw/zinc/77/94/55/1344779455.db2.gz YKWSZRQJZCGZPQ-BZUAXINKSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001378117225 1344779457 /nfs/dbraw/zinc/77/94/57/1344779457.db2.gz YKWSZRQJZCGZPQ-BZUAXINKSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N1CCCC1 ZINC001378138110 1344802080 /nfs/dbraw/zinc/80/20/80/1344802080.db2.gz YCWVTGALXDJRDK-MOPGFXCFSA-N 1 3 347.547 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N1CCCC1 ZINC001378138110 1344802085 /nfs/dbraw/zinc/80/20/85/1344802085.db2.gz YCWVTGALXDJRDK-MOPGFXCFSA-N 1 3 347.547 2.878 10 0 EFAEHO CCN(C(=O)[C@H](C)N1CCCCCC1)[C@H]1CC[N@H+](CCC2CC2)C1 ZINC001378205256 1344886862 /nfs/dbraw/zinc/88/68/62/1344886862.db2.gz YWWFFLMXSWMGJZ-HKUYNNGSSA-N 1 3 335.536 2.974 10 0 EFAEHO CCN(C(=O)[C@H](C)N1CCCCCC1)[C@H]1CC[N@@H+](CCC2CC2)C1 ZINC001378205256 1344886865 /nfs/dbraw/zinc/88/68/65/1344886865.db2.gz YWWFFLMXSWMGJZ-HKUYNNGSSA-N 1 3 335.536 2.974 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H](C)N(C)Cc1cccc(F)c1)[NH+]1CCCC1 ZINC001378227165 1344911324 /nfs/dbraw/zinc/91/13/24/1344911324.db2.gz FWRXWVYDZKMKMT-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H](C)N(C)Cc1cccc(F)c1)[NH+]1CCCC1 ZINC001378227172 1344911471 /nfs/dbraw/zinc/91/14/71/1344911471.db2.gz FWRXWVYDZKMKMT-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC001378236446 1344919480 /nfs/dbraw/zinc/91/94/80/1344919480.db2.gz RGISKWKMAYTIRB-RDTXWAMCSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC001378236446 1344919483 /nfs/dbraw/zinc/91/94/83/1344919483.db2.gz RGISKWKMAYTIRB-RDTXWAMCSA-N 1 3 335.467 2.590 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccc(OC)cc1 ZINC001378251831 1344931612 /nfs/dbraw/zinc/93/16/12/1344931612.db2.gz UQMZXGZITWTLCW-PKOBYXMFSA-N 1 3 347.503 2.552 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccc(OC)cc1 ZINC001378251811 1344931802 /nfs/dbraw/zinc/93/18/02/1344931802.db2.gz UQMZXGZITWTLCW-IEBWSBKVSA-N 1 3 347.503 2.552 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1cc(F)ccc1C ZINC001378260652 1344939817 /nfs/dbraw/zinc/93/98/17/1344939817.db2.gz YMLKLKVVCJAOFR-RTBURBONSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]CCc1ccccc1 ZINC001378301877 1344969098 /nfs/dbraw/zinc/96/90/98/1344969098.db2.gz XSGYXQZFKISNDA-UYAOXDASSA-N 1 3 345.531 2.978 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)NCc1sccc1Cl ZINC001378316703 1344980128 /nfs/dbraw/zinc/98/01/28/1344980128.db2.gz KVZPUNYAZTWQIO-OLZOCXBDSA-N 1 3 343.924 2.728 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)NCc1sccc1Cl ZINC001378316703 1344980133 /nfs/dbraw/zinc/98/01/33/1344980133.db2.gz KVZPUNYAZTWQIO-OLZOCXBDSA-N 1 3 343.924 2.728 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCC[C@H]1CNCc1ccccc1Cl ZINC001393859179 1357217773 /nfs/dbraw/zinc/21/77/73/1357217773.db2.gz FQBGPNATAGWFPW-INIZCTEOSA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)[C@H]1CCCN1C)[NH2+]Cc1ccsc1 ZINC001378380957 1345027067 /nfs/dbraw/zinc/02/70/67/1345027067.db2.gz MTPFCPZSFCADDR-DLBZAZTESA-N 1 3 337.533 2.805 10 0 EFAEHO C[C@H](NC[C@@](C)(NC(=O)CC[NH+](C)C)C1CC1)c1ccccc1F ZINC001378416431 1345058823 /nfs/dbraw/zinc/05/88/23/1345058823.db2.gz TYHLQZNXCUNRMQ-IFXJQAMLSA-N 1 3 335.467 2.713 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H]1CC[C@H]([NH2+]C[C@H](F)CC)CC1 ZINC001378435973 1345074157 /nfs/dbraw/zinc/07/41/57/1345074157.db2.gz BMHVQDUNYFJFLH-QBPKDAKJSA-N 1 3 327.488 2.626 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[C@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC001378457144 1345092755 /nfs/dbraw/zinc/09/27/55/1345092755.db2.gz VNXLJSPZPRNYJA-JYJNAYRXSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCCC[N@@H+]1CC1CC1)N1CCCC1 ZINC001378477259 1345110025 /nfs/dbraw/zinc/11/00/25/1345110025.db2.gz OKROHBUEPPZTKF-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCCC[N@H+]1CC1CC1)N1CCCC1 ZINC001378477259 1345110029 /nfs/dbraw/zinc/11/00/29/1345110029.db2.gz OKROHBUEPPZTKF-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCCC[N@@H+]1CC1CC1)N1CCCC1 ZINC001378477253 1345110469 /nfs/dbraw/zinc/11/04/69/1345110469.db2.gz OKROHBUEPPZTKF-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCCC[N@H+]1CC1CC1)N1CCCC1 ZINC001378477253 1345110473 /nfs/dbraw/zinc/11/04/73/1345110473.db2.gz OKROHBUEPPZTKF-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCCC[N@@H+]1CC1CC1)N1CCCC1 ZINC001378477272 1345110775 /nfs/dbraw/zinc/11/07/75/1345110775.db2.gz OKROHBUEPPZTKF-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCCC[N@H+]1CC1CC1)N1CCCC1 ZINC001378477272 1345110778 /nfs/dbraw/zinc/11/07/78/1345110778.db2.gz OKROHBUEPPZTKF-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC1CC[NH+](CCC(C)(C)C)CC1 ZINC001378480922 1345114262 /nfs/dbraw/zinc/11/42/62/1345114262.db2.gz AOIZFTKPSINGOQ-UHFFFAOYSA-N 1 3 334.508 2.915 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC1CC[NH+](Cc2ccccc2F)CC1 ZINC001378500269 1345125917 /nfs/dbraw/zinc/12/59/17/1345125917.db2.gz ZSACDRFRVUHDHI-UHFFFAOYSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](CCCc2cccc(F)c2)C1)N(C)C ZINC001378536742 1345147596 /nfs/dbraw/zinc/14/75/96/1345147596.db2.gz VKMXAZGTAUXBHM-DNVCBOLYSA-N 1 3 349.494 2.535 10 0 EFAEHO Cc1ccc(C[NH+]2CC([C@H](C)NC(=O)CN3CC[C@H](C)C3)C2)cc1C ZINC001378540452 1345150133 /nfs/dbraw/zinc/15/01/33/1345150133.db2.gz OQZYVLQLWVCUQH-YJBOKZPZSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(C[NH+]2CC([C@H](C)NC(=O)CN3CC[C@@H](C)C3)C2)cc1C ZINC001378540450 1345150427 /nfs/dbraw/zinc/15/04/27/1345150427.db2.gz OQZYVLQLWVCUQH-QAPCUYQASA-N 1 3 343.515 2.582 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C1C[NH+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001378549576 1345156261 /nfs/dbraw/zinc/15/62/61/1345156261.db2.gz DYPXWONHUMJLOZ-CRAIPNDOSA-N 1 3 335.536 2.589 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+][C@@H]1CCc2ccccc21 ZINC001378582906 1345178465 /nfs/dbraw/zinc/17/84/65/1345178465.db2.gz CCKUCEUKDRNNNW-VQIMIIECSA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+][C@H]1CCc2ccccc21 ZINC001378582884 1345178604 /nfs/dbraw/zinc/17/86/04/1345178604.db2.gz CCKUCEUKDRNNNW-APWZRJJASA-N 1 3 343.515 2.890 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1C[NH+](CC2CCC3(CC3)CC2)C1 ZINC001378587832 1345182999 /nfs/dbraw/zinc/18/29/99/1345182999.db2.gz PGRWFPVBPNVOMY-INIZCTEOSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)C[NH2+]CC1CCC2(CC2)CC1 ZINC001378601665 1345190940 /nfs/dbraw/zinc/19/09/40/1345190940.db2.gz BYEHZFGWETWHHU-IRXDYDNUSA-N 1 3 335.536 2.641 10 0 EFAEHO CCc1ccc(CN2C[C@H](NC(=O)CC[N@@H+](C)CC)C(C)(C)C2)cc1 ZINC001378663578 1345235060 /nfs/dbraw/zinc/23/50/60/1345235060.db2.gz MKNQLABHKUWMHS-IBGZPJMESA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccc(CN2C[C@H](NC(=O)CC[N@H+](C)CC)C(C)(C)C2)cc1 ZINC001378663578 1345235063 /nfs/dbraw/zinc/23/50/63/1345235063.db2.gz MKNQLABHKUWMHS-IBGZPJMESA-N 1 3 345.531 2.917 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1cccc(C(F)F)c1)N(C)C ZINC001378783540 1345313408 /nfs/dbraw/zinc/31/34/08/1345313408.db2.gz XOGXEJDHDIXAIL-XJKSGUPXSA-N 1 3 341.446 2.901 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](C)N(C)C(=O)[C@@H](C(C)C)[NH+](C)C)n1 ZINC001378807500 1345329665 /nfs/dbraw/zinc/32/96/65/1345329665.db2.gz DOHSFJNUUGRPPC-QFBILLFUSA-N 1 3 348.535 2.728 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@H](C)C2)cc1C ZINC001378826913 1345344319 /nfs/dbraw/zinc/34/43/19/1345344319.db2.gz HBSSGWUSGVYFTH-MAUKXSAKSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@@H](C)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001378828484 1345345416 /nfs/dbraw/zinc/34/54/16/1345345416.db2.gz KXAXIPXHSNDBHQ-MAUKXSAKSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@@H](C)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001378828480 1345345527 /nfs/dbraw/zinc/34/55/27/1345345527.db2.gz KXAXIPXHSNDBHQ-CRAIPNDOSA-N 1 3 331.504 2.582 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccccc1C ZINC001378855911 1345367488 /nfs/dbraw/zinc/36/74/88/1345367488.db2.gz IHJLZZPTBCGBNU-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]C[C@H](C)N(C)C(=O)CN2CCCC2)c1 ZINC001378856637 1345368408 /nfs/dbraw/zinc/36/84/08/1345368408.db2.gz WORMVDATQAGXGL-ZWKOTPCHSA-N 1 3 331.504 2.897 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccccc2C2CC2)C1)N(C)C ZINC001378875635 1345384239 /nfs/dbraw/zinc/38/42/39/1345384239.db2.gz XUXACLHQCSEUJT-QSFXBCCZSA-N 1 3 343.515 2.889 10 0 EFAEHO CN(CCC1CCN(C(=O)CC[NH+](C)C)CC1)Cc1ccccc1F ZINC001378911581 1345417203 /nfs/dbraw/zinc/41/72/03/1345417203.db2.gz DGEAZUQENPBABQ-UHFFFAOYSA-N 1 3 349.494 2.838 10 0 EFAEHO C[N@H+](C/C=C\c1ccccc1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001378933087 1345438666 /nfs/dbraw/zinc/43/86/66/1345438666.db2.gz UBOFQYKUCPDCMZ-YFHOEESVSA-N 1 3 341.499 2.718 10 0 EFAEHO C[N@@H+](C/C=C\c1ccccc1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001378933087 1345438667 /nfs/dbraw/zinc/43/86/67/1345438667.db2.gz UBOFQYKUCPDCMZ-YFHOEESVSA-N 1 3 341.499 2.718 10 0 EFAEHO Cc1cc(C[NH2+][C@H](CCNC(=O)Cc2nc[nH]c2C)C(C)C)cs1 ZINC001378983745 1345479223 /nfs/dbraw/zinc/47/92/23/1345479223.db2.gz ZRNOWDRUFIITQA-MRXNPFEDSA-N 1 3 348.516 2.951 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[N@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001393884117 1357250961 /nfs/dbraw/zinc/25/09/61/1357250961.db2.gz PWDNUTXIDWEBLY-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001393884117 1357250963 /nfs/dbraw/zinc/25/09/63/1357250963.db2.gz PWDNUTXIDWEBLY-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001379110845 1345588335 /nfs/dbraw/zinc/58/83/35/1345588335.db2.gz LIZTZLGVZYOQPU-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001379110845 1345588340 /nfs/dbraw/zinc/58/83/40/1345588340.db2.gz LIZTZLGVZYOQPU-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)c(C)s1 ZINC001379211366 1345661286 /nfs/dbraw/zinc/66/12/86/1345661286.db2.gz BXHBBOODPMWDEW-ZIAGYGMSSA-N 1 3 337.533 2.643 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]CC1CCC(C)(C)CC1 ZINC001379215926 1345663253 /nfs/dbraw/zinc/66/32/53/1345663253.db2.gz HUTFZXXYHBIOQX-IRXDYDNUSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@@H](C)[NH2+]CCc1ccc(Cl)cc1)N(C)C ZINC001379292301 1345704733 /nfs/dbraw/zinc/70/47/33/1345704733.db2.gz ZFYRZIKTOVQKPE-RHSMWYFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CC[C@H]([NH2+]CCN(CC)C(=O)CN1CCCC1)c1ccc(F)cc1 ZINC001379326817 1345730911 /nfs/dbraw/zinc/73/09/11/1345730911.db2.gz JGVQIVLJUPDJGB-SFHVURJKSA-N 1 3 335.467 2.811 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(C)nc1C ZINC001379330189 1345733540 /nfs/dbraw/zinc/73/35/40/1345733540.db2.gz OVCCBAGJYHLMIS-APWZRJJASA-N 1 3 346.519 2.509 10 0 EFAEHO C[C@H](CN[C@H](C)c1ccccc1F)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001379413887 1345770589 /nfs/dbraw/zinc/77/05/89/1345770589.db2.gz REZLUKUTSDCWRJ-HUUCEWRRSA-N 1 3 335.467 2.855 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)NC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)n1 ZINC001379414118 1345770728 /nfs/dbraw/zinc/77/07/28/1345770728.db2.gz JPYLILDHXDWMIO-IKGGRYGDSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)NC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)n1 ZINC001379414118 1345770732 /nfs/dbraw/zinc/77/07/32/1345770732.db2.gz JPYLILDHXDWMIO-IKGGRYGDSA-N 1 3 346.519 2.530 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CC1CCC(F)(F)CC1 ZINC001379466781 1345802354 /nfs/dbraw/zinc/80/23/54/1345802354.db2.gz MINRKCLDGDDINC-GDBMZVCRSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@@H](CNCc1cc2ccccc2o1)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001379534677 1345834385 /nfs/dbraw/zinc/83/43/85/1345834385.db2.gz GSWDNCPQXNRKNI-ZOBUZTSGSA-N 1 3 343.471 2.757 10 0 EFAEHO C[C@@H](CNCc1cc2ccccc2o1)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001379534677 1345834387 /nfs/dbraw/zinc/83/43/87/1345834387.db2.gz GSWDNCPQXNRKNI-ZOBUZTSGSA-N 1 3 343.471 2.757 10 0 EFAEHO C[C@@H](CNC1c2ccccc2-c2ccccc21)NC(=O)CC[NH+](C)C ZINC001379550495 1345849878 /nfs/dbraw/zinc/84/98/78/1345849878.db2.gz JTMLDYBWIBXYGM-HNNXBMFYSA-N 1 3 337.467 2.802 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001379579307 1345884289 /nfs/dbraw/zinc/88/42/89/1345884289.db2.gz AYHPFBQZURPZIL-XJKSGUPXSA-N 1 3 325.884 2.583 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)CN[C@@H](C)c1cccc(Cl)c1F ZINC001379579100 1345884511 /nfs/dbraw/zinc/88/45/11/1345884511.db2.gz IAPFELWYGLFMAS-STQMWFEESA-N 1 3 343.874 2.976 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)CN[C@@H](C)c1cccc(Cl)c1F ZINC001379579100 1345884512 /nfs/dbraw/zinc/88/45/12/1345884512.db2.gz IAPFELWYGLFMAS-STQMWFEESA-N 1 3 343.874 2.976 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CCC3CC3)[C@H]2C1)CC(C)(C)C ZINC001379634023 1345954861 /nfs/dbraw/zinc/95/48/61/1345954861.db2.gz YVZWHIUCEQPKKX-FHWLQOOXSA-N 1 3 349.563 2.981 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](CC)NCC=C(Cl)Cl ZINC001419201278 1374946640 /nfs/dbraw/zinc/94/66/40/1374946640.db2.gz QFCHOVNZQBUHNM-CHWSQXEVSA-N 1 3 336.307 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](CC)NCC=C(Cl)Cl ZINC001419201278 1374946644 /nfs/dbraw/zinc/94/66/44/1374946644.db2.gz QFCHOVNZQBUHNM-CHWSQXEVSA-N 1 3 336.307 2.664 10 0 EFAEHO CC[C@@H](CNC(=O)CC[NH+](C)C)N[C@@H](C)c1ccccc1Cl ZINC001419222156 1374968971 /nfs/dbraw/zinc/96/89/71/1374968971.db2.gz OEZQQKFSPBIQHJ-KBPBESRZSA-N 1 3 325.884 2.837 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@H](C)[NH2+]CCc1cccs1 ZINC001393954718 1357318912 /nfs/dbraw/zinc/31/89/12/1357318912.db2.gz GIJFSYYFEJMTDO-LSDHHAIUSA-N 1 3 337.533 2.648 10 0 EFAEHO C[C@@H](C[N@H+](C)C[C@H]1CCCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001379676270 1347250939 /nfs/dbraw/zinc/25/09/39/1347250939.db2.gz FIKZMZIJTIGTNZ-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[N@@H+](C)C[C@H]1CCCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001379676270 1347250943 /nfs/dbraw/zinc/25/09/43/1347250943.db2.gz FIKZMZIJTIGTNZ-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+][C@H]2CCc3ccccc32)C(C)(C)C1 ZINC001379730148 1347292165 /nfs/dbraw/zinc/29/21/65/1347292165.db2.gz MFIDTCYAIOWPOJ-RBUKOAKNSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CN(C)Cc1cccc(F)c1)[NH+]1CCCC1 ZINC001379799488 1347348113 /nfs/dbraw/zinc/34/81/13/1347348113.db2.gz OYGSXZDUNHTPGU-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001379911336 1347401611 /nfs/dbraw/zinc/40/16/11/1347401611.db2.gz YARPEOZQWKFNKV-WOJBJXKFSA-N 1 3 343.515 2.934 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]CCc1ccccc1 ZINC001379940814 1347414994 /nfs/dbraw/zinc/41/49/94/1347414994.db2.gz ORACUWFBPMFCOQ-PMACEKPBSA-N 1 3 345.531 2.786 10 0 EFAEHO Cc1cccc(C[N@@H+](C)CCN(C(=O)[C@@H]2CCCN2C)C(C)C)c1 ZINC001380003791 1347452007 /nfs/dbraw/zinc/45/20/07/1347452007.db2.gz ZGGHTGAYWYPTFK-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1cccc(C[N@H+](C)CCN(C(=O)[C@@H]2CCCN2C)C(C)C)c1 ZINC001380003791 1347452008 /nfs/dbraw/zinc/45/20/08/1347452008.db2.gz ZGGHTGAYWYPTFK-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C[NH2+]CC1CCCC1)C(C)(C)C)N(C)C ZINC001380083500 1347507825 /nfs/dbraw/zinc/50/78/25/1347507825.db2.gz CBCZBWYGJBJFQJ-IAGOWNOFSA-N 1 3 325.541 2.883 10 0 EFAEHO CN(CC(=O)NCC1([NH2+][C@H]2CCc3ccc(F)cc32)CC1)C1CCC1 ZINC001380107778 1347517773 /nfs/dbraw/zinc/51/77/73/1347517773.db2.gz YBVISKVWLGBFFS-SFHVURJKSA-N 1 3 345.462 2.536 10 0 EFAEHO CC1CCC(C[NH2+]C2(CNC(=O)C(C)(C)N3CCCC3)CC2)CC1 ZINC001380144407 1347533081 /nfs/dbraw/zinc/53/30/81/1347533081.db2.gz UJXZDFOZASQFDX-UHFFFAOYSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(C)C1(C(=O)N(C)C2CC([NH2+][C@@H]3CCc4ccccc43)C2)CCC1 ZINC001380158163 1347539649 /nfs/dbraw/zinc/53/96/49/1347539649.db2.gz YUHNTVFEXKFEDB-FAFZWHIHSA-N 1 3 341.499 2.737 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)CC(C)(C)C)c(C)n1 ZINC001393993136 1357362017 /nfs/dbraw/zinc/36/20/17/1357362017.db2.gz XWBGFDOTQQMBJX-HOTGVXAUSA-N 1 3 348.535 2.659 10 0 EFAEHO C[C@H](F)CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)CN(C)C1CCC1 ZINC001380179923 1347553321 /nfs/dbraw/zinc/55/33/21/1347553321.db2.gz JHYUFHIDNRTUIT-UNPWZGGWSA-N 1 3 339.499 2.721 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)[C@H](C)C1 ZINC001380272161 1347563879 /nfs/dbraw/zinc/56/38/79/1347563879.db2.gz SUEWBUHDSKIDDU-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO CC[C@@H](C(=O)N[C@]1(C)CC[N@H+](CCc2ccccc2)C1)N(CC)CC ZINC001380359795 1347617569 /nfs/dbraw/zinc/61/75/69/1347617569.db2.gz QBPVIYJLZXYTPA-PZJWPPBQSA-N 1 3 345.531 2.930 10 0 EFAEHO CC[C@@H](C(=O)N[C@]1(C)CC[N@@H+](CCc2ccccc2)C1)N(CC)CC ZINC001380359795 1347617570 /nfs/dbraw/zinc/61/75/70/1347617570.db2.gz QBPVIYJLZXYTPA-PZJWPPBQSA-N 1 3 345.531 2.930 10 0 EFAEHO CCC(CC)C[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001380521237 1347739457 /nfs/dbraw/zinc/73/94/57/1347739457.db2.gz OFEMMSUQGYOQNC-INIZCTEOSA-N 1 3 347.494 2.836 10 0 EFAEHO CCC(CC)C[N@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001380521237 1347739459 /nfs/dbraw/zinc/73/94/59/1347739459.db2.gz OFEMMSUQGYOQNC-INIZCTEOSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1ccccc1C1CC1 ZINC001394001612 1357372505 /nfs/dbraw/zinc/37/25/05/1357372505.db2.gz MHFFIDZVTSSEDE-HOTGVXAUSA-N 1 3 331.504 2.887 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CC)c1ccccc1CC ZINC001380658886 1347795132 /nfs/dbraw/zinc/79/51/32/1347795132.db2.gz ULTFLJGGVRMNBW-MOPGFXCFSA-N 1 3 331.504 2.890 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001380683767 1347811228 /nfs/dbraw/zinc/81/12/28/1347811228.db2.gz VHWCAHGPKRGOMV-MJGOQNOKSA-N 1 3 331.504 2.662 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001394002903 1357374326 /nfs/dbraw/zinc/37/43/26/1357374326.db2.gz RJNHOFAEWMBGDY-KGLIPLIRSA-N 1 3 325.884 2.665 10 0 EFAEHO CCC[NH+]1CCC(N(Cc2ccccn2)C(=O)[C@H](CC)N(C)C)CC1 ZINC001380703910 1347824302 /nfs/dbraw/zinc/82/43/02/1347824302.db2.gz DRJVQSMSJLPLLP-IBGZPJMESA-N 1 3 346.519 2.625 10 0 EFAEHO C[C@@H](NC(=O)c1cccc(CN(C)C)c1)[C@@H](C)[NH2+]CCC(F)(F)F ZINC001394006512 1357379246 /nfs/dbraw/zinc/37/92/46/1357379246.db2.gz SIQXSUNAOPDEFQ-CHWSQXEVSA-N 1 3 345.409 2.797 10 0 EFAEHO CN(C(=O)CN1CCCC1)C1CCC([NH2+]CC=C(Cl)Cl)CC1 ZINC001394006855 1357379318 /nfs/dbraw/zinc/37/93/18/1357379318.db2.gz NMTIXKKCNVRRFL-UHFFFAOYSA-N 1 3 348.318 2.760 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CCC1 ZINC001380882392 1347934444 /nfs/dbraw/zinc/93/44/44/1347934444.db2.gz SDSXDUVDBKCNEZ-KDOFPFPSSA-N 1 3 345.478 2.576 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[N@H+](CC3CC(C)(C)C3)CC2)CCC1 ZINC001380925920 1347959085 /nfs/dbraw/zinc/95/90/85/1347959085.db2.gz AOBBABAQWMKIBZ-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[N@@H+](CC3CC(C)(C)C3)CC2)CCC1 ZINC001380925920 1347959089 /nfs/dbraw/zinc/95/90/89/1347959089.db2.gz AOBBABAQWMKIBZ-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](Cc2ccc(C)cc2)CC1)N(C)C ZINC001380933206 1347966248 /nfs/dbraw/zinc/96/62/48/1347966248.db2.gz UYQHOQFDNQCYFO-RBUKOAKNSA-N 1 3 331.504 2.806 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](Cc2ccc(C)cc2)CC1)N(C)C ZINC001380933206 1347966252 /nfs/dbraw/zinc/96/62/52/1347966252.db2.gz UYQHOQFDNQCYFO-RBUKOAKNSA-N 1 3 331.504 2.806 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1CCC[C@@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001380934336 1347966583 /nfs/dbraw/zinc/96/65/83/1347966583.db2.gz OXGBSBJIWRWPJS-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C)C[N@H+]1CCC[C@@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001380934336 1347966584 /nfs/dbraw/zinc/96/65/84/1347966584.db2.gz OXGBSBJIWRWPJS-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](F)C[NH2+]C1CCC(N(C)C(=O)CN(C)C2CCC2)CC1 ZINC001394010000 1357382758 /nfs/dbraw/zinc/38/27/58/1357382758.db2.gz QDPPIEQAJQNQQD-UQPPLGOBSA-N 1 3 327.488 2.578 10 0 EFAEHO CN(CCC[N@@H+](C)CCC1CC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001380964589 1347989825 /nfs/dbraw/zinc/98/98/25/1347989825.db2.gz MNWNDEVISONQNS-IBGZPJMESA-N 1 3 341.515 2.779 10 0 EFAEHO CN(CCC[N@H+](C)CCC1CC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001380964589 1347989821 /nfs/dbraw/zinc/98/98/21/1347989821.db2.gz MNWNDEVISONQNS-IBGZPJMESA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCCN(C)Cc1ccsc1)[NH+](C)C ZINC001380984005 1348004684 /nfs/dbraw/zinc/00/46/84/1348004684.db2.gz ZLKLYPDETSBCCH-INIZCTEOSA-N 1 3 325.522 2.615 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@@H]1CCC[N@H+](CCCF)C1 ZINC001380987140 1348007308 /nfs/dbraw/zinc/00/73/08/1348007308.db2.gz BAQYKRHLQBLIOL-MSOLQXFVSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@@H]1CCC[N@@H+](CCCF)C1 ZINC001380987140 1348007311 /nfs/dbraw/zinc/00/73/11/1348007311.db2.gz BAQYKRHLQBLIOL-MSOLQXFVSA-N 1 3 341.515 2.779 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCN(C)C(=O)CN(C)C(C)C)cc1C ZINC001380990829 1348009008 /nfs/dbraw/zinc/00/90/08/1348009008.db2.gz URXOOTUVVPZEMS-UHFFFAOYSA-N 1 3 333.520 2.924 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCN(C)C(=O)CN(C)C(C)C)cc1C ZINC001380990829 1348009013 /nfs/dbraw/zinc/00/90/13/1348009013.db2.gz URXOOTUVVPZEMS-UHFFFAOYSA-N 1 3 333.520 2.924 10 0 EFAEHO CCC1([NH2+]CCc2cccs2)CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001381021405 1348023522 /nfs/dbraw/zinc/02/35/22/1348023522.db2.gz KAUJIVSSGURYCC-QGZVFWFLSA-N 1 3 349.544 2.746 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(CC)([NH2+]CC[C@@H](C)F)CC1 ZINC001381023536 1348025292 /nfs/dbraw/zinc/02/52/92/1348025292.db2.gz SSDRZZSNEABFHV-IAGOWNOFSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)C[NH2+]C1(C)CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001381128247 1348095909 /nfs/dbraw/zinc/09/59/09/1348095909.db2.gz PFTROKXXYPIXLS-IBGZPJMESA-N 1 3 341.515 2.826 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCN(CCc2ccccc2F)CC1(C)C ZINC001381137455 1348103216 /nfs/dbraw/zinc/10/32/16/1348103216.db2.gz XKRMVMSZOMZSBW-GOSISDBHSA-N 1 3 349.494 2.537 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cs1 ZINC001381162942 1348113389 /nfs/dbraw/zinc/11/33/89/1348113389.db2.gz GIVPPLPZGIFNBR-PBHICJAKSA-N 1 3 337.533 2.866 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cs1 ZINC001381162942 1348113392 /nfs/dbraw/zinc/11/33/92/1348113392.db2.gz GIVPPLPZGIFNBR-PBHICJAKSA-N 1 3 337.533 2.866 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cs1 ZINC001381162945 1348113625 /nfs/dbraw/zinc/11/36/25/1348113625.db2.gz GIVPPLPZGIFNBR-RHSMWYFYSA-N 1 3 337.533 2.866 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cs1 ZINC001381162945 1348113627 /nfs/dbraw/zinc/11/36/27/1348113627.db2.gz GIVPPLPZGIFNBR-RHSMWYFYSA-N 1 3 337.533 2.866 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cs1 ZINC001381162947 1348113687 /nfs/dbraw/zinc/11/36/87/1348113687.db2.gz GIVPPLPZGIFNBR-WMLDXEAASA-N 1 3 337.533 2.866 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cs1 ZINC001381162947 1348113689 /nfs/dbraw/zinc/11/36/89/1348113689.db2.gz GIVPPLPZGIFNBR-WMLDXEAASA-N 1 3 337.533 2.866 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccsc2)[C@H](C)C1 ZINC001381173947 1348121834 /nfs/dbraw/zinc/12/18/34/1348121834.db2.gz OVCMETGDJNAZDL-WBVHZDCISA-N 1 3 337.533 2.949 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccsc2)[C@H](C)C1 ZINC001381173947 1348121837 /nfs/dbraw/zinc/12/18/37/1348121837.db2.gz OVCMETGDJNAZDL-WBVHZDCISA-N 1 3 337.533 2.949 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC001381233743 1348157694 /nfs/dbraw/zinc/15/76/94/1348157694.db2.gz LCSHOISINWLQSK-UONOGXRCSA-N 1 3 341.446 2.850 10 0 EFAEHO CC[N@H+](CC[C@@H](C)F)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001381257026 1348167758 /nfs/dbraw/zinc/16/77/58/1348167758.db2.gz PUBSBAIRSNSRAK-MRXNPFEDSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[N@@H+](CC[C@@H](C)F)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001381257026 1348167760 /nfs/dbraw/zinc/16/77/60/1348167760.db2.gz PUBSBAIRSNSRAK-MRXNPFEDSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@@H]1C[N@H+](C)CCC(C)(C)C)N(C)C ZINC001381289067 1348189310 /nfs/dbraw/zinc/18/93/10/1348189310.db2.gz CKDMSINGYHYSFG-SJORKVTESA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@@H]1C[N@@H+](C)CCC(C)(C)C)N(C)C ZINC001381289067 1348189313 /nfs/dbraw/zinc/18/93/13/1348189313.db2.gz CKDMSINGYHYSFG-SJORKVTESA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@H]1C[N@H+](C)CCC(C)(C)C)N(C)C ZINC001381289064 1348189878 /nfs/dbraw/zinc/18/98/78/1348189878.db2.gz CKDMSINGYHYSFG-IRXDYDNUSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@H]1C[N@@H+](C)CCC(C)(C)C)N(C)C ZINC001381289064 1348189880 /nfs/dbraw/zinc/18/98/80/1348189880.db2.gz CKDMSINGYHYSFG-IRXDYDNUSA-N 1 3 325.541 2.932 10 0 EFAEHO CN(Cc1ccc(CF)cc1)C[C@@H]1CCCN1C(=O)CC[NH+](C)C ZINC001381298341 1348197776 /nfs/dbraw/zinc/19/77/76/1348197776.db2.gz KKDUGXAPVXQFTM-SFHVURJKSA-N 1 3 335.467 2.531 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC1CC(CNC/C(Cl)=C/Cl)C1 ZINC001381325939 1348211140 /nfs/dbraw/zinc/21/11/40/1348211140.db2.gz XVEMYDZDKRXRKY-VMAADMDHSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC1CC(CNC/C(Cl)=C/Cl)C1 ZINC001381325939 1348211145 /nfs/dbraw/zinc/21/11/45/1348211145.db2.gz XVEMYDZDKRXRKY-VMAADMDHSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC1CC(CNC/C(Cl)=C/Cl)C1 ZINC001381325938 1348211220 /nfs/dbraw/zinc/21/12/20/1348211220.db2.gz XVEMYDZDKRXRKY-PBKFIDCVSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC1CC(CNC/C(Cl)=C/Cl)C1 ZINC001381325938 1348211222 /nfs/dbraw/zinc/21/12/22/1348211222.db2.gz XVEMYDZDKRXRKY-PBKFIDCVSA-N 1 3 348.318 2.664 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC2CC(NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001381330025 1348212644 /nfs/dbraw/zinc/21/26/44/1348212644.db2.gz BCXSUUKRTNKYIY-MHJFOBGBSA-N 1 3 345.531 2.874 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2cccc(C(C)C)n2)C1)N(C)C ZINC001381332251 1348213062 /nfs/dbraw/zinc/21/30/62/1348213062.db2.gz UTIPGMHAAMXEPM-GXOAENINSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]Cc2cc3ccccc3o2)C1 ZINC001381342478 1348216821 /nfs/dbraw/zinc/21/68/21/1348216821.db2.gz PUAAQLBSYGGRKW-UHFFFAOYSA-N 1 3 343.471 2.757 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCCC1)[C@@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001381369125 1348227864 /nfs/dbraw/zinc/22/78/64/1348227864.db2.gz FCMXNCAWTUMWGK-ZIAGYGMSSA-N 1 3 345.478 2.779 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C1CCC1 ZINC001381390298 1348237485 /nfs/dbraw/zinc/23/74/85/1348237485.db2.gz MDCWQNREZQFZRX-HUUCEWRRSA-N 1 3 335.467 2.601 10 0 EFAEHO C[C@@H](NC(=O)C12CCC[NH+](CCC1)C2)[C@H](C)NCC=C(Cl)Cl ZINC001381410543 1348252436 /nfs/dbraw/zinc/25/24/36/1348252436.db2.gz ZPBMHVJYEOLCGY-QWHCGFSZSA-N 1 3 348.318 2.664 10 0 EFAEHO C[C@@H](NCC=C(Cl)Cl)[C@H](C)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001381410542 1348252450 /nfs/dbraw/zinc/25/24/50/1348252450.db2.gz ZPBMHVJYEOLCGY-OLZOCXBDSA-N 1 3 348.318 2.664 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@@H](C)CNC(=O)[C@@H]1CCC[N@H+]1C(C)C ZINC001381513007 1348322877 /nfs/dbraw/zinc/32/28/77/1348322877.db2.gz CVWSUNQPBZCYFQ-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@@H](C)CNC(=O)[C@@H]1CCC[N@@H+]1C(C)C ZINC001381513007 1348322880 /nfs/dbraw/zinc/32/28/80/1348322880.db2.gz CVWSUNQPBZCYFQ-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[N@H+](C)CC[C@@H]1CCCC1(F)F ZINC001381529233 1348332923 /nfs/dbraw/zinc/33/29/23/1348332923.db2.gz CFGDHLGLYNVHFY-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC001381529233 1348332927 /nfs/dbraw/zinc/33/29/27/1348332927.db2.gz CFGDHLGLYNVHFY-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC[C@@H](C)N(C)Cc2ccc(F)cc2)C1 ZINC001381570690 1348367195 /nfs/dbraw/zinc/36/71/95/1348367195.db2.gz HKEXVCOGARXMOO-AEFFLSMTSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC[C@@H](C)N(C)Cc2ccc(F)cc2)C1 ZINC001381570690 1348367197 /nfs/dbraw/zinc/36/71/97/1348367197.db2.gz HKEXVCOGARXMOO-AEFFLSMTSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)N(C)Cc1ccc(C(F)F)cc1 ZINC001381621349 1348410825 /nfs/dbraw/zinc/41/08/25/1348410825.db2.gz PXILNNHSTSNKIS-XJKSGUPXSA-N 1 3 339.430 2.512 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(C(F)F)cc1 ZINC001381621349 1348410828 /nfs/dbraw/zinc/41/08/28/1348410828.db2.gz PXILNNHSTSNKIS-XJKSGUPXSA-N 1 3 339.430 2.512 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)[C@@H]1CCCCN1C)[NH2+]Cc1ccccn1 ZINC001381717958 1348474603 /nfs/dbraw/zinc/47/46/03/1348474603.db2.gz ZSUMOMQMMBKCSS-MOPGFXCFSA-N 1 3 346.519 2.529 10 0 EFAEHO C[C@H](NC(=O)CN(C)CC(C)(C)C)C1C[NH+](CCC(C)(C)C)C1 ZINC001381816805 1348547527 /nfs/dbraw/zinc/54/75/27/1348547527.db2.gz CVBZGBVZFHXQQI-HNNXBMFYSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](CC/C=C\c2ccccc2)C1)N(C)C ZINC001381798387 1348533370 /nfs/dbraw/zinc/53/33/70/1348533370.db2.gz WKKCKYBZQSADQP-MQJXANNYSA-N 1 3 343.515 2.867 10 0 EFAEHO CC1(C)CN(Cc2ccccc2)C[C@@H]1NC(=O)CC[NH+]1CCCCC1 ZINC001381859985 1348572243 /nfs/dbraw/zinc/57/22/43/1348572243.db2.gz APOJOPCTBPJDDN-IBGZPJMESA-N 1 3 343.515 2.889 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381860130 1348572391 /nfs/dbraw/zinc/57/23/91/1348572391.db2.gz BRGYLZLPDDITBH-IAGOWNOFSA-N 1 3 325.541 2.835 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381860130 1348572392 /nfs/dbraw/zinc/57/23/92/1348572392.db2.gz BRGYLZLPDDITBH-IAGOWNOFSA-N 1 3 325.541 2.835 10 0 EFAEHO C[C@@H](c1ccccc1)[N@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)C3CCC3)[C@@H]2C1 ZINC001381891956 1348594409 /nfs/dbraw/zinc/59/44/09/1348594409.db2.gz KZDGWYVNVXZDSB-MVJPYGJCSA-N 1 3 341.499 2.526 10 0 EFAEHO C[C@@H](c1ccccc1)[N@@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)C3CCC3)[C@@H]2C1 ZINC001381891956 1348594411 /nfs/dbraw/zinc/59/44/11/1348594411.db2.gz KZDGWYVNVXZDSB-MVJPYGJCSA-N 1 3 341.499 2.526 10 0 EFAEHO CC1CCC(C[NH2+]C[C@H]2C[C@H](NC(=O)C3(N(C)C)CCC3)C2)CC1 ZINC001381962918 1348627400 /nfs/dbraw/zinc/62/74/00/1348627400.db2.gz OQICFWGQPXGIOJ-VNGAXPGBSA-N 1 3 335.536 2.781 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H]1C[C@H](NC(=O)CN(C)C2CCC2)C1 ZINC001381964020 1348627642 /nfs/dbraw/zinc/62/76/42/1348627642.db2.gz VOOPHDXGNKTARJ-RZDIXWSQSA-N 1 3 347.478 2.603 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001381968676 1348629970 /nfs/dbraw/zinc/62/99/70/1348629970.db2.gz FHXGEVIUZZXZMP-QWFCFKBJSA-N 1 3 345.531 2.936 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001382128215 1348749038 /nfs/dbraw/zinc/74/90/38/1348749038.db2.gz SUKVJGWSOUXUAV-BEFAXECRSA-N 1 3 345.531 2.890 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001382165848 1348787929 /nfs/dbraw/zinc/78/79/29/1348787929.db2.gz MUBYDTCAQBXDJM-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(Cl)cc2)[C@@H]1C ZINC001382301167 1348855683 /nfs/dbraw/zinc/85/56/83/1348855683.db2.gz CXWLWWFYPIYSTF-WMLDXEAASA-N 1 3 337.895 2.759 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)[C@@H]1C ZINC001382308335 1348858702 /nfs/dbraw/zinc/85/87/02/1348858702.db2.gz NVVIMEWDDGSQLE-QAPCUYQASA-N 1 3 335.467 2.553 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)[C@H](C)CNC(=O)[C@H]1CCCN1C(C)C ZINC001394061196 1357430574 /nfs/dbraw/zinc/43/05/74/1357430574.db2.gz VRGXXPHSJXBUCP-IEBWSBKVSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccccc1C[N@H+](C)[C@H](C)CNC(=O)[C@H]1CCCN1C(C)C ZINC001394061196 1357430576 /nfs/dbraw/zinc/43/05/76/1357430576.db2.gz VRGXXPHSJXBUCP-IEBWSBKVSA-N 1 3 331.504 2.804 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CC3CCCC3)[C@@H]2C1 ZINC001382324052 1348874017 /nfs/dbraw/zinc/87/40/17/1348874017.db2.gz BPLMAKDSUZDYQW-IPMKNSEASA-N 1 3 335.536 2.735 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CC3CCCC3)[C@H]2C1 ZINC001382324034 1348874290 /nfs/dbraw/zinc/87/42/90/1348874290.db2.gz BPLMAKDSUZDYQW-FHWLQOOXSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)Cc2cccc(C)c2)CC[N@@H+]1C ZINC001394063418 1357432416 /nfs/dbraw/zinc/43/24/16/1357432416.db2.gz VIZGWTQTGVDAFI-YTQUADARSA-N 1 3 331.504 2.662 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)Cc2cccc(C)c2)CC[N@H+]1C ZINC001394063418 1357432422 /nfs/dbraw/zinc/43/24/22/1357432422.db2.gz VIZGWTQTGVDAFI-YTQUADARSA-N 1 3 331.504 2.662 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@H]1CC[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001382351040 1348903759 /nfs/dbraw/zinc/90/37/59/1348903759.db2.gz QDBVRIFHJLSPRN-LPHOPBHVSA-N 1 3 349.494 2.849 10 0 EFAEHO CCC(CC)C[NH2+][C@@H]1CN(C(=O)[C@@H](C(C)C)N(C)C)CC1(C)C ZINC001382367008 1348918092 /nfs/dbraw/zinc/91/80/92/1348918092.db2.gz GWDLZTJKOLSTSO-IAGOWNOFSA-N 1 3 325.541 2.835 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]C[C@H](C)CC(C)C)C(C)(C)C1 ZINC001382382116 1348924528 /nfs/dbraw/zinc/92/45/28/1348924528.db2.gz XQMYBAUSYQTZLD-SJORKVTESA-N 1 3 325.541 2.837 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+]Cc2ccsc2)C(C)(C)C)CCC1 ZINC001382516061 1348983373 /nfs/dbraw/zinc/98/33/73/1348983373.db2.gz GJUDDGBIKKXULY-HNNXBMFYSA-N 1 3 337.533 2.853 10 0 EFAEHO CC(C)C[NH2+]C[C@@H](NC(=O)[C@H]1CCCN1CC(C)C)C(C)(C)C ZINC001382539206 1349005698 /nfs/dbraw/zinc/00/56/98/1349005698.db2.gz ZFGDJCCIXZIRFJ-IAGOWNOFSA-N 1 3 325.541 2.883 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1CC[NH+](Cc2ccsc2)CC1)N(C)C ZINC001382552456 1349014044 /nfs/dbraw/zinc/01/40/44/1349014044.db2.gz VOKIYKJJFGCQBC-RHSMWYFYSA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1CC[NH+](Cc2ccsc2)CC1 ZINC001382563412 1349023603 /nfs/dbraw/zinc/02/36/03/1349023603.db2.gz GZBQIRCQRKYXON-HNNXBMFYSA-N 1 3 337.533 2.805 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2ccc(F)cc2C)C1)N(C)C ZINC001382591770 1349038328 /nfs/dbraw/zinc/03/83/28/1349038328.db2.gz UTQPZZAUTSNWHS-DAWZGUTISA-N 1 3 335.467 2.553 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[N@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001394106175 1357476732 /nfs/dbraw/zinc/47/67/32/1357476732.db2.gz KGUXQCUZXZOAQX-LSDHHAIUSA-N 1 3 347.494 2.836 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001394106175 1357476734 /nfs/dbraw/zinc/47/67/34/1357476734.db2.gz KGUXQCUZXZOAQX-LSDHHAIUSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](CCCc2cccc(C)c2)C1)N(C)C ZINC001394224955 1357616298 /nfs/dbraw/zinc/61/62/98/1357616298.db2.gz IDCDTMNBUIIOGO-FXAWDEMLSA-N 1 3 345.531 2.704 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H](C)C1C[NH+](Cc2cccc(C)c2)C1 ZINC001394225195 1357616352 /nfs/dbraw/zinc/61/63/52/1357616352.db2.gz PJZCNYXSCQHHIH-VQIMIIECSA-N 1 3 349.494 2.611 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](CCCc2cccc(C)c2)C1)N(C)C ZINC001394224956 1357616468 /nfs/dbraw/zinc/61/64/68/1357616468.db2.gz IDCDTMNBUIIOGO-YLJYHZDGSA-N 1 3 345.531 2.704 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](Cc2cc(C)ccc2C)C1)N(C)C ZINC001394226213 1357617207 /nfs/dbraw/zinc/61/72/07/1357617207.db2.gz KJGZHZCSDACTSE-VQIMIIECSA-N 1 3 331.504 2.580 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](CCCc2ccc(C)cc2)C1)N(C)C ZINC001394268910 1357653346 /nfs/dbraw/zinc/65/33/46/1357653346.db2.gz URDNMLFBPLAWJO-FXAWDEMLSA-N 1 3 345.531 2.704 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@@H]([NH2+]CC[C@@H]2CCCC2(F)F)C1)N(C)C ZINC001388680719 1352915843 /nfs/dbraw/zinc/91/58/43/1352915843.db2.gz JCYJLBKRMIUYTG-CAOSSQGBSA-N 1 3 345.478 2.637 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@@H]([NH2+]Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001388683813 1352917978 /nfs/dbraw/zinc/91/79/78/1352917978.db2.gz WRFOSTPLGWSQAZ-WSTZPKSXSA-N 1 3 345.531 2.936 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H]1C[C@@H](CNC(=O)CN2[C@H](C)CC[C@@H]2C)C1 ZINC001388704127 1352934167 /nfs/dbraw/zinc/93/41/67/1352934167.db2.gz RKJTVQGUZHCWRY-LAGDQHSMSA-N 1 3 343.515 2.852 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@H]1C[C@H](NCc2ccccc2F)C1 ZINC001388722207 1352950608 /nfs/dbraw/zinc/95/06/08/1352950608.db2.gz TVZJENQJDDURCS-SZMVWBNQSA-N 1 3 347.478 2.685 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@H]1C[C@H](NCc2ccccc2F)C1 ZINC001388722207 1352950613 /nfs/dbraw/zinc/95/06/13/1352950613.db2.gz TVZJENQJDDURCS-SZMVWBNQSA-N 1 3 347.478 2.685 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CCc2ccc(C)cc2)C1)N(C)C ZINC001388762225 1352987197 /nfs/dbraw/zinc/98/71/97/1352987197.db2.gz ZBPBVKOGVFSGEU-XUVXKRRUSA-N 1 3 345.531 2.752 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C[C@H]1C)CC[NH+](C[C@@H](F)CC)CC2 ZINC001388764151 1352988864 /nfs/dbraw/zinc/98/88/64/1352988864.db2.gz USLSBFAQDMXUSO-SJORKVTESA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@@H+](C(C)C)CC[C@@H]1c1ccccc1)N(C)C ZINC001388766732 1352991452 /nfs/dbraw/zinc/99/14/52/1352991452.db2.gz DTBUPGNQKBEJMJ-AQNXPRMDSA-N 1 3 345.531 2.955 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@H+](C(C)C)CC[C@@H]1c1ccccc1)N(C)C ZINC001388766732 1352991456 /nfs/dbraw/zinc/99/14/56/1352991456.db2.gz DTBUPGNQKBEJMJ-AQNXPRMDSA-N 1 3 345.531 2.955 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+][C@H]1CCCCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001388796858 1353027537 /nfs/dbraw/zinc/02/75/37/1353027537.db2.gz JBCMDHIBUJUHHJ-SJORKVTESA-N 1 3 334.508 2.995 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@@H]1CCCCN1C(=O)CC[NH+](C)C ZINC001388832883 1353068218 /nfs/dbraw/zinc/06/82/18/1353068218.db2.gz CDWHGRGIQZDLRI-IBGZPJMESA-N 1 3 349.494 2.899 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@H+](C/C=C/Cl)CC(C)(C)C1 ZINC001388843786 1353083982 /nfs/dbraw/zinc/08/39/82/1353083982.db2.gz VZYDKWCJVPBZFN-PMGBHYCQSA-N 1 3 329.916 2.688 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@@H+](C/C=C/Cl)CC(C)(C)C1 ZINC001388843786 1353083985 /nfs/dbraw/zinc/08/39/85/1353083985.db2.gz VZYDKWCJVPBZFN-PMGBHYCQSA-N 1 3 329.916 2.688 10 0 EFAEHO C[C@H](F)CCN1CCC[C@@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001389375985 1353345431 /nfs/dbraw/zinc/34/54/31/1353345431.db2.gz OEDFEWNABLHLRD-JKSUJKDBSA-N 1 3 341.515 2.968 10 0 EFAEHO C[C@H](F)CCN1CCC[C@@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001389375985 1353345439 /nfs/dbraw/zinc/34/54/39/1353345439.db2.gz OEDFEWNABLHLRD-JKSUJKDBSA-N 1 3 341.515 2.968 10 0 EFAEHO CC[C@@H](C)C[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001394302664 1357687193 /nfs/dbraw/zinc/68/71/93/1357687193.db2.gz RKBOLXMCUJDFQQ-TVFCKZIOSA-N 1 3 335.536 2.591 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001394302664 1357687198 /nfs/dbraw/zinc/68/71/98/1357687198.db2.gz RKBOLXMCUJDFQQ-TVFCKZIOSA-N 1 3 335.536 2.591 10 0 EFAEHO CC[C@H](F)CN1CCC2(C[C@H]2NC(=O)CC[NH+]2CCCCC2)CC1 ZINC001389519374 1353447889 /nfs/dbraw/zinc/44/78/89/1353447889.db2.gz CCDGXFCALGYHQU-DLBZAZTESA-N 1 3 339.499 2.581 10 0 EFAEHO Cc1ccc(C[NH+]2CCC3(C[C@@H]3NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001389525940 1353453369 /nfs/dbraw/zinc/45/33/69/1353453369.db2.gz IHLLZITXRYMZQE-IBGZPJMESA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)[C@H]2CCCN2C(C)C)C2CC2)cc1 ZINC001389611732 1353510412 /nfs/dbraw/zinc/51/04/12/1353510412.db2.gz OSUHGLCYTCOFKK-VQTJNVASSA-N 1 3 343.515 2.852 10 0 EFAEHO C[C@@H](CN(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1)NC/C=C\Cl ZINC001394514815 1357897729 /nfs/dbraw/zinc/89/77/29/1357897729.db2.gz UINHEHQMPDAPGQ-MSKHEQNASA-N 1 3 329.916 2.828 10 0 EFAEHO C[C@@H](CN(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1)NC/C=C\Cl ZINC001394514815 1357897734 /nfs/dbraw/zinc/89/77/34/1357897734.db2.gz UINHEHQMPDAPGQ-MSKHEQNASA-N 1 3 329.916 2.828 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(F)cc2F)C1 ZINC001390001750 1353734789 /nfs/dbraw/zinc/73/47/89/1353734789.db2.gz BYCALNGSRUCPIZ-AEGPPILISA-N 1 3 339.430 2.604 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2Cl)C1 ZINC001390041261 1353760352 /nfs/dbraw/zinc/76/03/52/1353760352.db2.gz VOOREAUPQLENDR-SOUVJXGZSA-N 1 3 337.895 2.978 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](Cc3ccsc3)C[C@H]2C1 ZINC001394350713 1357724171 /nfs/dbraw/zinc/72/41/71/1357724171.db2.gz PEIAGOIDBLFAPI-RCCFBDPRSA-N 1 3 349.544 2.807 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccsc3)C[C@H]2C1 ZINC001394350713 1357724177 /nfs/dbraw/zinc/72/41/77/1357724177.db2.gz PEIAGOIDBLFAPI-RCCFBDPRSA-N 1 3 349.544 2.807 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCC[C@@H]1[C@H]1CCCN1C/C=C\Cl ZINC001390179042 1353899132 /nfs/dbraw/zinc/89/91/32/1353899132.db2.gz ZHULNMACTNODNL-KETLTQCKSA-N 1 3 327.900 2.536 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccccc2CC)C(C)(C)C1 ZINC001394712230 1358039175 /nfs/dbraw/zinc/03/91/75/1358039175.db2.gz HTAZTUSZEDDTMT-LJQANCHMSA-N 1 3 345.531 2.917 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]Cc2ccc(F)cc2C)CC1)N(C)C ZINC001390268564 1353966914 /nfs/dbraw/zinc/96/69/14/1353966914.db2.gz AANPSFDLNWIOFB-CTWPCTMYSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCCC1)[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001390371970 1354039867 /nfs/dbraw/zinc/03/98/67/1354039867.db2.gz GRGWQXNHGRAKJZ-LSDHHAIUSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)[N@H+](C)C1CCCC1)NCc1ccsc1 ZINC001390409792 1354070200 /nfs/dbraw/zinc/07/02/00/1354070200.db2.gz OOTASHWKJWKOKK-AWEZNQCLSA-N 1 3 337.533 2.995 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)[N@@H+](C)C1CCCC1)NCc1ccsc1 ZINC001390409792 1354070205 /nfs/dbraw/zinc/07/02/05/1354070205.db2.gz OOTASHWKJWKOKK-AWEZNQCLSA-N 1 3 337.533 2.995 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N(C)C1CC(NCC=C(Cl)Cl)C1 ZINC001394851321 1358157121 /nfs/dbraw/zinc/15/71/21/1358157121.db2.gz AQXSLEUNOIBWTL-RUXDESIVSA-N 1 3 348.318 2.757 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N(C)C1CC(NCC=C(Cl)Cl)C1 ZINC001394851321 1358157125 /nfs/dbraw/zinc/15/71/25/1358157125.db2.gz AQXSLEUNOIBWTL-RUXDESIVSA-N 1 3 348.318 2.757 10 0 EFAEHO C[C@@H](N[C@@H](C)CNC(=O)C(C)(C)[NH+]1CCCC1)c1ccccc1F ZINC001390454084 1354091833 /nfs/dbraw/zinc/09/18/33/1354091833.db2.gz BGCDTWVVJBQXRR-LSDHHAIUSA-N 1 3 335.467 2.855 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@@H](C)CNC(=O)C(C)(C)N2CCCC2)c1 ZINC001390460096 1354095909 /nfs/dbraw/zinc/09/59/09/1354095909.db2.gz MUPZTOHBVLLPRZ-HOTGVXAUSA-N 1 3 347.503 2.725 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC001390530837 1354153200 /nfs/dbraw/zinc/15/32/00/1354153200.db2.gz DNZBFQLGJPESDJ-KSSFIOAISA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N1CC[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001390584571 1354187907 /nfs/dbraw/zinc/18/79/07/1354187907.db2.gz RKMATGITEITSRG-VMBWUPECSA-N 1 3 348.318 2.616 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N1CC[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001390584571 1354187911 /nfs/dbraw/zinc/18/79/11/1354187911.db2.gz RKMATGITEITSRG-VMBWUPECSA-N 1 3 348.318 2.616 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+][C@@H]2CCCc3ccccc32)C1 ZINC001390596809 1354194254 /nfs/dbraw/zinc/19/42/54/1354194254.db2.gz NNHQYAIQPZBOIO-FXAWDEMLSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(F)c(Cl)c1)N(C)C ZINC001390670308 1354262920 /nfs/dbraw/zinc/26/29/20/1354262920.db2.gz HCGQIBUMNNLPOD-MLGOLLRUSA-N 1 3 343.874 2.804 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](C)CCNC(=O)[C@H](C(C)C)N(C)C)c1 ZINC001390676834 1354269620 /nfs/dbraw/zinc/26/96/20/1354269620.db2.gz MMDWEFSETIKRBH-YJBOKZPZSA-N 1 3 337.483 2.705 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccccc1Cl ZINC001390699651 1354291323 /nfs/dbraw/zinc/29/13/23/1354291323.db2.gz BODHVSZYXRNLDO-LSDHHAIUSA-N 1 3 337.895 2.666 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CCC(F)(F)CC1 ZINC001390711231 1354302305 /nfs/dbraw/zinc/30/23/05/1354302305.db2.gz ZHMASZRASVUBJP-CABCVRRESA-N 1 3 345.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+]Cc1cc(F)ccc1Cl ZINC001390725603 1354317348 /nfs/dbraw/zinc/31/73/48/1354317348.db2.gz DELFZVKDQVJEPR-CYBMUJFWSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+]Cc1sccc1Cl ZINC001390733457 1354324804 /nfs/dbraw/zinc/32/48/04/1354324804.db2.gz PVWVYZBGVYOJOT-GFCCVEGCSA-N 1 3 331.913 2.726 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1cc(C)ccc1F ZINC001390733537 1354325407 /nfs/dbraw/zinc/32/54/07/1354325407.db2.gz QDNFXDCHHMQSET-VQIMIIECSA-N 1 3 349.494 2.993 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1cccc(C)c1 ZINC001390739270 1354329353 /nfs/dbraw/zinc/32/93/53/1354329353.db2.gz ZYTHJEIPRBFRKD-IEBWSBKVSA-N 1 3 331.504 2.854 10 0 EFAEHO CN(CCNC(=O)C1CC[NH+](C)CC1)[C@@H]1CCc2ccc(Cl)cc21 ZINC001390808328 1354394805 /nfs/dbraw/zinc/39/48/05/1354394805.db2.gz FCSCAUSMXXSUPN-GOSISDBHSA-N 1 3 349.906 2.717 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)CC(C)(C)C)CC1CC(C)(C)C1 ZINC001390966878 1354600200 /nfs/dbraw/zinc/60/02/00/1354600200.db2.gz UIPVBIGOKVOWAO-UHFFFAOYSA-N 1 3 325.541 2.839 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)CC(C)(C)C)CC1CC(C)(C)C1 ZINC001390966878 1354600204 /nfs/dbraw/zinc/60/02/04/1354600204.db2.gz UIPVBIGOKVOWAO-UHFFFAOYSA-N 1 3 325.541 2.839 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C(C)C)C[C@H]1CCCC(F)(F)C1 ZINC001391019589 1354694644 /nfs/dbraw/zinc/69/46/44/1354694644.db2.gz IQCAYYVQAPAWOI-HNNXBMFYSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C(C)C)C[C@H]1CCCC(F)(F)C1 ZINC001391019589 1354694650 /nfs/dbraw/zinc/69/46/50/1354694650.db2.gz IQCAYYVQAPAWOI-HNNXBMFYSA-N 1 3 333.467 2.590 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@@H](CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001391096207 1354789989 /nfs/dbraw/zinc/78/99/89/1354789989.db2.gz KIVSQKQDMYOFCH-SFHVURJKSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@@H](CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001391096207 1354789993 /nfs/dbraw/zinc/78/99/93/1354789993.db2.gz KIVSQKQDMYOFCH-SFHVURJKSA-N 1 3 343.515 2.808 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@@H]2CCN(Cc3cccc(Cl)c3)C2)C1 ZINC001391117356 1354819257 /nfs/dbraw/zinc/81/92/57/1354819257.db2.gz YOZJKCNUZKUQRB-SJORKVTESA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@@H]2CCN(Cc3cccc(Cl)c3)C2)C1 ZINC001391117356 1354819262 /nfs/dbraw/zinc/81/92/62/1354819262.db2.gz YOZJKCNUZKUQRB-SJORKVTESA-N 1 3 349.906 2.620 10 0 EFAEHO CCc1cccc(C[N@@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001391120310 1354825061 /nfs/dbraw/zinc/82/50/61/1354825061.db2.gz UQGZXICEYRLKDU-IBGZPJMESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(C[N@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001391120310 1354825064 /nfs/dbraw/zinc/82/50/64/1354825064.db2.gz UQGZXICEYRLKDU-IBGZPJMESA-N 1 3 331.504 2.527 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@H+](Cc2ccccn2)CC(C)(C)C1 ZINC001397805294 1360157156 /nfs/dbraw/zinc/15/71/56/1360157156.db2.gz HBPBMJSZCHUJEL-KRWDZBQOSA-N 1 3 346.519 2.530 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@@H+](Cc2ccccn2)CC(C)(C)C1 ZINC001397805294 1360157160 /nfs/dbraw/zinc/15/71/60/1360157160.db2.gz HBPBMJSZCHUJEL-KRWDZBQOSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[N@H+](C[C@H]1CCC(F)(F)C1)C1CC1)N(C)C ZINC001391200881 1354928174 /nfs/dbraw/zinc/92/81/74/1354928174.db2.gz OSBBINUXUVCVRH-HOCLYGCPSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[N@@H+](C[C@H]1CCC(F)(F)C1)C1CC1)N(C)C ZINC001391200881 1354928176 /nfs/dbraw/zinc/92/81/76/1354928176.db2.gz OSBBINUXUVCVRH-HOCLYGCPSA-N 1 3 345.478 2.589 10 0 EFAEHO C[C@@H]([NH2+]CCC(C)(C)C)C1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001391235392 1354957921 /nfs/dbraw/zinc/95/79/21/1354957921.db2.gz DKJWOXUDBRWJGL-IAGOWNOFSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H](C)[NH2+]CC2CC(C)(C)C2)CC1 ZINC001391240932 1354964098 /nfs/dbraw/zinc/96/40/98/1354964098.db2.gz GZEKEHURHNBFMD-MRXNPFEDSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C(=O)[C@H]1CCCN1C(C)C)[C@@H]1CC[N@H+](CCC2CC2)C1 ZINC001391279653 1355012182 /nfs/dbraw/zinc/01/21/82/1355012182.db2.gz LXVAWRSJZDGHQT-RTBURBONSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C(=O)[C@H]1CCCN1C(C)C)[C@@H]1CC[N@@H+](CCC2CC2)C1 ZINC001391279653 1355012186 /nfs/dbraw/zinc/01/21/86/1355012186.db2.gz LXVAWRSJZDGHQT-RTBURBONSA-N 1 3 335.536 2.972 10 0 EFAEHO Cc1cc(C[N@@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001391364946 1355131819 /nfs/dbraw/zinc/13/18/19/1355131819.db2.gz ZQYLJUJCBKCSTC-INIZCTEOSA-N 1 3 337.533 2.677 10 0 EFAEHO Cc1cc(C[N@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001391364946 1355131823 /nfs/dbraw/zinc/13/18/23/1355131823.db2.gz ZQYLJUJCBKCSTC-INIZCTEOSA-N 1 3 337.533 2.677 10 0 EFAEHO C[C@H](F)CC[N@H+](C)CC1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001391367142 1355134367 /nfs/dbraw/zinc/13/43/67/1355134367.db2.gz MPZOVWDMSMLLSG-INIZCTEOSA-N 1 3 343.531 2.883 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)CC1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001391367142 1355134369 /nfs/dbraw/zinc/13/43/69/1355134369.db2.gz MPZOVWDMSMLLSG-INIZCTEOSA-N 1 3 343.531 2.883 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1CN(Cc2c(C)cc(C)cc2C)C1 ZINC001391509648 1355261327 /nfs/dbraw/zinc/26/13/27/1355261327.db2.gz IHLWGWANHPUONS-UHFFFAOYSA-N 1 3 331.504 2.502 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1CN(Cc2c(C)cc(C)cc2C)C1 ZINC001391509648 1355261329 /nfs/dbraw/zinc/26/13/29/1355261329.db2.gz IHLWGWANHPUONS-UHFFFAOYSA-N 1 3 331.504 2.502 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001391565696 1355310325 /nfs/dbraw/zinc/31/03/25/1355310325.db2.gz WEVGHVLBGWVMPF-SFHVURJKSA-N 1 3 342.487 2.590 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001391565696 1355310330 /nfs/dbraw/zinc/31/03/30/1355310330.db2.gz WEVGHVLBGWVMPF-SFHVURJKSA-N 1 3 342.487 2.590 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)[C@H]1CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001391633527 1355380204 /nfs/dbraw/zinc/38/02/04/1355380204.db2.gz LNSJTMPUVDJURX-SFHVURJKSA-N 1 3 342.487 2.542 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)[C@H]1CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001391633527 1355380209 /nfs/dbraw/zinc/38/02/09/1355380209.db2.gz LNSJTMPUVDJURX-SFHVURJKSA-N 1 3 342.487 2.542 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCC[N@@H+]1CC(C)C)NCc1ccccc1F ZINC001391694316 1355441082 /nfs/dbraw/zinc/44/10/82/1355441082.db2.gz BZKQRDZTLJKQBB-HKUYNNGSSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCC[N@H+]1CC(C)C)NCc1ccccc1F ZINC001391694316 1355441084 /nfs/dbraw/zinc/44/10/84/1355441084.db2.gz BZKQRDZTLJKQBB-HKUYNNGSSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001391721397 1355465453 /nfs/dbraw/zinc/46/54/53/1355465453.db2.gz VTBBVOXXCHJLJU-LSDHHAIUSA-N 1 3 345.478 2.781 10 0 EFAEHO CC[C@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)NCc1ccccc1Cl ZINC001391735329 1355479982 /nfs/dbraw/zinc/47/99/82/1355479982.db2.gz KBKLBHNGANELMU-GOEBONIOSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)NCc1ccccc1Cl ZINC001391735329 1355479985 /nfs/dbraw/zinc/47/99/85/1355479985.db2.gz KBKLBHNGANELMU-GOEBONIOSA-N 1 3 337.895 2.666 10 0 EFAEHO CC(C)[NH2+]CC1(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CCCC1 ZINC001391773913 1355517826 /nfs/dbraw/zinc/51/78/26/1355517826.db2.gz QIYTYVJJDRDNTF-SFHVURJKSA-N 1 3 327.488 2.626 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@](C)(C[NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001391797607 1355540456 /nfs/dbraw/zinc/54/04/56/1355540456.db2.gz AYQDAZQQBYCDAE-LJQANCHMSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@](C)(C[NH2+][C@@H](C)c1ccccc1)C1CC1 ZINC001391799294 1355541868 /nfs/dbraw/zinc/54/18/68/1355541868.db2.gz DAOKGTMGRHPCIV-JXFKEZNVSA-N 1 3 331.504 2.962 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@](C)(C[NH2+]Cc2ccccc2F)C2CC2)C1 ZINC001391821766 1355565293 /nfs/dbraw/zinc/56/52/93/1355565293.db2.gz WFBZLNJQKHRZKG-MGPUTAFESA-N 1 3 347.478 2.542 10 0 EFAEHO CC[C@H](C)C[NH2+]Cc1ccc(CNC(=O)Cc2nc[nH]c2C)cc1 ZINC001391839895 1355583555 /nfs/dbraw/zinc/58/35/55/1355583555.db2.gz PJZUFWXBSKBPMH-AWEZNQCLSA-N 1 3 328.460 2.713 10 0 EFAEHO C[NH+](C)CCC(=O)NCc1ccc(CNCc2ccc(F)cc2)cc1 ZINC001391840640 1355584223 /nfs/dbraw/zinc/58/42/23/1355584223.db2.gz SXCWJDKVHMSALU-UHFFFAOYSA-N 1 3 343.446 2.683 10 0 EFAEHO C[C@@H](CNC(=O)c1cccc(CN(C)C)c1)C[NH2+]Cc1ccsc1 ZINC001391958890 1355682250 /nfs/dbraw/zinc/68/22/50/1355682250.db2.gz FKGIUBJKNOAGNW-OAHLLOKOSA-N 1 3 345.512 2.965 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C[N@H+](C)CCCC(C)C)CC1)N(C)C ZINC001400245050 1361879694 /nfs/dbraw/zinc/87/96/94/1361879694.db2.gz FXUPHNNOFMUOOU-GOSISDBHSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C[N@@H+](C)CCCC(C)C)CC1)N(C)C ZINC001400245050 1361879697 /nfs/dbraw/zinc/87/96/97/1361879697.db2.gz FXUPHNNOFMUOOU-GOSISDBHSA-N 1 3 325.541 2.933 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+]C[C@@H](C)N(C)C(=O)[C@@H]1CCCN1C ZINC001392048370 1355735863 /nfs/dbraw/zinc/73/58/63/1355735863.db2.gz HHNVGNWBXQLAMM-BEFAXECRSA-N 1 3 346.519 2.544 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(Cl)c(F)c1)N(C)C ZINC001392081568 1355755493 /nfs/dbraw/zinc/75/54/93/1355755493.db2.gz XPEQKYBTCFQSBS-MLGOLLRUSA-N 1 3 343.874 2.756 10 0 EFAEHO CN(C/C=C/Cl)CCC1CCN(C(=O)C[C@@H]2CC[N@H+](C)C2)CC1 ZINC001392191904 1355846618 /nfs/dbraw/zinc/84/66/18/1355846618.db2.gz CPAIORZJJZIURQ-HJYWZVSTSA-N 1 3 341.927 2.641 10 0 EFAEHO CN(C/C=C/Cl)CCC1CCN(C(=O)C[C@@H]2CC[N@@H+](C)C2)CC1 ZINC001392191904 1355846621 /nfs/dbraw/zinc/84/66/21/1355846621.db2.gz CPAIORZJJZIURQ-HJYWZVSTSA-N 1 3 341.927 2.641 10 0 EFAEHO CC[C@H](F)C[N@H+](C)CCC1CCN(C(=O)[C@@H]2CCCCN2C)CC1 ZINC001392195426 1355851247 /nfs/dbraw/zinc/85/12/47/1355851247.db2.gz LTISOPDTJUZLCR-ROUUACIJSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)CCC1CCN(C(=O)[C@@H]2CCCCN2C)CC1 ZINC001392195426 1355851251 /nfs/dbraw/zinc/85/12/51/1355851251.db2.gz LTISOPDTJUZLCR-ROUUACIJSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC(CCN(C)CCF)CC1)[NH+]1CCCC1 ZINC001392202163 1355858765 /nfs/dbraw/zinc/85/87/65/1355858765.db2.gz OHSCXKTVBUZSHN-SFHVURJKSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]CCc1ccccc1 ZINC001392220014 1355875066 /nfs/dbraw/zinc/87/50/66/1355875066.db2.gz MENRIYJAVXCWFT-VQTJNVASSA-N 1 3 345.531 2.832 10 0 EFAEHO CC(C)[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccccc1 ZINC001392229964 1355885106 /nfs/dbraw/zinc/88/51/06/1355885106.db2.gz VHQDVJJMRWOMNJ-SFHVURJKSA-N 1 3 331.504 2.791 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H]1CCc2c1cccc2F ZINC001392256213 1355913451 /nfs/dbraw/zinc/91/34/51/1355913451.db2.gz QCHHWGINYXZAOC-OALUTQOASA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2C[NH+]3CCC2CC3)c(C)c1 ZINC001392278343 1355934107 /nfs/dbraw/zinc/93/41/07/1355934107.db2.gz HPEDTJKZWYDBJM-FQEVSTJZSA-N 1 3 343.515 2.535 10 0 EFAEHO CC1CCC(C[N@H+](C)CCN(C)C(=O)CN2CCC(C)CC2)CC1 ZINC001392315644 1355975621 /nfs/dbraw/zinc/97/56/21/1355975621.db2.gz WDXIEZNUXMQBOL-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO CC1CCC(C[N@@H+](C)CCN(C)C(=O)CN2CCC(C)CC2)CC1 ZINC001392315644 1355975626 /nfs/dbraw/zinc/97/56/26/1355975626.db2.gz WDXIEZNUXMQBOL-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2Cc2ccsc2)C1 ZINC001392356539 1356016965 /nfs/dbraw/zinc/01/69/65/1356016965.db2.gz ZFKDKPDMKLEUCX-IRXDYDNUSA-N 1 3 335.517 2.513 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2Cc2ccsc2)C1 ZINC001392356539 1356016970 /nfs/dbraw/zinc/01/69/70/1356016970.db2.gz ZFKDKPDMKLEUCX-IRXDYDNUSA-N 1 3 335.517 2.513 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1cc(C)cc(C)c1 ZINC001392535857 1356107872 /nfs/dbraw/zinc/10/78/72/1356107872.db2.gz DDXGKVPIZHZSBD-MJGOQNOKSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+][C@@H](C)c1ccc(F)c(Cl)c1 ZINC001392617375 1356164320 /nfs/dbraw/zinc/16/43/20/1356164320.db2.gz ISYSSFCYBDMABT-STQMWFEESA-N 1 3 343.874 2.975 10 0 EFAEHO C[C@@H](CN(C)[C@@H](C)c1ccc(F)c(Cl)c1)NC(=O)CC[NH+](C)C ZINC001392685883 1356235232 /nfs/dbraw/zinc/23/52/32/1356235232.db2.gz KILQHRBARRXKKY-STQMWFEESA-N 1 3 343.874 2.928 10 0 EFAEHO Cc1cccc(CCC[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001392691082 1356242932 /nfs/dbraw/zinc/24/29/32/1356242932.db2.gz XYFVQDFVUCCRKG-RBUKOAKNSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1cccc(CCC[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001392691082 1356242936 /nfs/dbraw/zinc/24/29/36/1356242936.db2.gz XYFVQDFVUCCRKG-RBUKOAKNSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)C[N@H+](C)CCc1ccccc1 ZINC001392711375 1356264688 /nfs/dbraw/zinc/26/46/88/1356264688.db2.gz ZRASFMVQPAGBQW-QUCCMNQESA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)C[N@@H+](C)CCc1ccccc1 ZINC001392711375 1356264689 /nfs/dbraw/zinc/26/46/89/1356264689.db2.gz ZRASFMVQPAGBQW-QUCCMNQESA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001392728583 1356287390 /nfs/dbraw/zinc/28/73/90/1356287390.db2.gz NRDBKIBLJMVGIQ-MSOLQXFVSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001392728583 1356287393 /nfs/dbraw/zinc/28/73/93/1356287393.db2.gz NRDBKIBLJMVGIQ-MSOLQXFVSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)(C(=O)N[C@@H](C[NH2+]CC1CCCCC1)C1CC1)N1CCCC1 ZINC001392782834 1356322904 /nfs/dbraw/zinc/32/29/04/1356322904.db2.gz HHRVHXKWEGWBNK-SFHVURJKSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)C/C=C\c2ccccc2)CC[N@@H+]1C ZINC001401745705 1363079176 /nfs/dbraw/zinc/07/91/76/1363079176.db2.gz CCKLFELOYBSPAQ-UDLVTDPCSA-N 1 3 343.515 2.867 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)C/C=C\c2ccccc2)CC[N@H+]1C ZINC001401745705 1363079182 /nfs/dbraw/zinc/07/91/82/1363079182.db2.gz CCKLFELOYBSPAQ-UDLVTDPCSA-N 1 3 343.515 2.867 10 0 EFAEHO CC(C)CCCN1CC[C@H]1CNC(=O)C1CC[NH+](CC2CC2)CC1 ZINC001392858986 1356382409 /nfs/dbraw/zinc/38/24/09/1356382409.db2.gz CHPRLGUTDMBHMS-IBGZPJMESA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NCCN(CCF)C1CCCCCC1 ZINC001392969153 1356475596 /nfs/dbraw/zinc/47/55/96/1356475596.db2.gz OOCWGFAKBSPPFY-IAGOWNOFSA-N 1 3 341.515 2.970 10 0 EFAEHO CCCN(C)CC(=O)N1CCC2(C1)CC[NH+](Cc1ccsc1)CC2 ZINC001392980204 1356487330 /nfs/dbraw/zinc/48/73/30/1356487330.db2.gz IIAOEEARYCBVOG-UHFFFAOYSA-N 1 3 349.544 2.904 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccsc1 ZINC001393089917 1356582918 /nfs/dbraw/zinc/58/29/18/1356582918.db2.gz ZSGZLGALAFFTSU-SJORKVTESA-N 1 3 335.517 2.655 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccsc1 ZINC001393089917 1356582920 /nfs/dbraw/zinc/58/29/20/1356582920.db2.gz ZSGZLGALAFFTSU-SJORKVTESA-N 1 3 335.517 2.655 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@]1(C)CCC[N@H+](CCC2CC2)C1 ZINC001393201846 1356712774 /nfs/dbraw/zinc/71/27/74/1356712774.db2.gz GHULVTLATNIRFI-QUCCMNQESA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@]1(C)CCC[N@@H+](CCC2CC2)C1 ZINC001393201846 1356712781 /nfs/dbraw/zinc/71/27/81/1356712781.db2.gz GHULVTLATNIRFI-QUCCMNQESA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@]1(C)CCC[N@H+](CC2CC2)C1 ZINC001393204739 1356716570 /nfs/dbraw/zinc/71/65/70/1356716570.db2.gz LSDDSOJPNUWSQD-QUCCMNQESA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@]1(C)CCC[N@@H+](CC2CC2)C1 ZINC001393204739 1356716572 /nfs/dbraw/zinc/71/65/72/1356716572.db2.gz LSDDSOJPNUWSQD-QUCCMNQESA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](F)CN1CCC[C@@](C)(CNC(=O)C23CCC[NH+]2CCC3)C1 ZINC001393205941 1356718326 /nfs/dbraw/zinc/71/83/26/1356718326.db2.gz PVJAKARATPYLQD-WMZOPIPTSA-N 1 3 339.499 2.581 10 0 EFAEHO CCC(CC)C[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001393240077 1356745854 /nfs/dbraw/zinc/74/58/54/1356745854.db2.gz IYNMUVDJMWDVPP-JKSUJKDBSA-N 1 3 347.494 2.836 10 0 EFAEHO CCC(CC)C[N@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001393240077 1356745858 /nfs/dbraw/zinc/74/58/58/1356745858.db2.gz IYNMUVDJMWDVPP-JKSUJKDBSA-N 1 3 347.494 2.836 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H](C)[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001393385316 1356805398 /nfs/dbraw/zinc/80/53/98/1356805398.db2.gz GKCYIUJFVVCDHY-AEFFLSMTSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H]1CN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001393394624 1356813957 /nfs/dbraw/zinc/81/39/57/1356813957.db2.gz JFNWPGFQMHRENT-AEFFLSMTSA-N 1 3 349.494 2.658 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001393403378 1356821856 /nfs/dbraw/zinc/82/18/56/1356821856.db2.gz ZBJOSPFNMVTRKF-FUHWJXTLSA-N 1 3 349.494 2.658 10 0 EFAEHO Cc1cccc([C@H](C)[N@H+]2C[C@H]3CN(C(=O)CN(C)C(C)C)C[C@H]3C2)c1 ZINC001393419010 1356833255 /nfs/dbraw/zinc/83/32/55/1356833255.db2.gz QZJOKOGZGUWXGU-YSIASYRMSA-N 1 3 343.515 2.786 10 0 EFAEHO Cc1cccc([C@H](C)[N@@H+]2C[C@H]3CN(C(=O)CN(C)C(C)C)C[C@H]3C2)c1 ZINC001393419010 1356833259 /nfs/dbraw/zinc/83/32/59/1356833259.db2.gz QZJOKOGZGUWXGU-YSIASYRMSA-N 1 3 343.515 2.786 10 0 EFAEHO CC[C@H](F)CN1C[C@@H]2CCCN(C(=O)CCC[NH+]3CCCC3)[C@@H]2C1 ZINC001393469307 1356869211 /nfs/dbraw/zinc/86/92/11/1356869211.db2.gz ZAFQDQGWPBQVPD-OKZBNKHCSA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@@H]([NH2+]CC[C@@H]1CCN(C(=O)CN2CCCC2)C1)c1ccc(F)cc1 ZINC001393473341 1356873707 /nfs/dbraw/zinc/87/37/07/1356873707.db2.gz KZKOQEXYOVFYHH-IAGOWNOFSA-N 1 3 347.478 2.811 10 0 EFAEHO C[C@@H]([NH2+]CC[C@H]1CCN(C(=O)CN2CCCC2)C1)c1ccc(F)cc1 ZINC001393473349 1356874043 /nfs/dbraw/zinc/87/40/43/1356874043.db2.gz KZKOQEXYOVFYHH-SJORKVTESA-N 1 3 347.478 2.811 10 0 EFAEHO CC(C)C[C@@H](C)C[NH+]1CCC2(CN(C(=O)CN(C)C(C)C)C2)CC1 ZINC001393503999 1356905277 /nfs/dbraw/zinc/90/52/77/1356905277.db2.gz XDNDALZFUQNCKZ-GOSISDBHSA-N 1 3 337.552 2.933 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1C[NH2+][C@H]1CCc2ccccc21 ZINC001393525581 1356920250 /nfs/dbraw/zinc/92/02/50/1356920250.db2.gz QUGXLRAEZVZFJZ-QUCCMNQESA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+]CC2CC(C)(C)C2)CCC1 ZINC001393540595 1356932329 /nfs/dbraw/zinc/93/23/29/1356932329.db2.gz IALUFACCXGXBCQ-KRWDZBQOSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]Cc2ccccc2)CCC1)N1CCCC1 ZINC001393552750 1356944213 /nfs/dbraw/zinc/94/42/13/1356944213.db2.gz WYAHHYNMSCMGKE-UHFFFAOYSA-N 1 3 329.488 2.690 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC1([NH2+]CC[C@H](C)F)CCC1 ZINC001393565138 1356954437 /nfs/dbraw/zinc/95/44/37/1356954437.db2.gz FSQCXCIMQYXWGQ-JKSUJKDBSA-N 1 3 327.488 2.626 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1(NCc2cc(C)ccc2F)CCC1 ZINC001393568610 1356957081 /nfs/dbraw/zinc/95/70/81/1356957081.db2.gz RUHMAOULOZFALA-UHFFFAOYSA-N 1 3 335.467 2.604 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1(NCc2cc(C)ccc2F)CCC1 ZINC001393568610 1356957083 /nfs/dbraw/zinc/95/70/83/1356957083.db2.gz RUHMAOULOZFALA-UHFFFAOYSA-N 1 3 335.467 2.604 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](Cc2cc(C)ccc2F)CC1)N(C)C ZINC001393600928 1356986351 /nfs/dbraw/zinc/98/63/51/1356986351.db2.gz KMPBUAVQFQURCU-IEBWSBKVSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(C)ccc2F)CC1)N(C)C ZINC001393600928 1356986355 /nfs/dbraw/zinc/98/63/55/1356986355.db2.gz KMPBUAVQFQURCU-IEBWSBKVSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1CCCN(Cc2ccc(C)nc2C)CC1 ZINC001393600988 1356986389 /nfs/dbraw/zinc/98/63/89/1356986389.db2.gz DOKKWXLSRFLDSZ-LJQANCHMSA-N 1 3 346.519 2.511 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1CCCN(Cc2ccc(C)nc2C)CC1 ZINC001393600988 1356986397 /nfs/dbraw/zinc/98/63/97/1356986397.db2.gz DOKKWXLSRFLDSZ-LJQANCHMSA-N 1 3 346.519 2.511 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC001393632634 1357028841 /nfs/dbraw/zinc/02/88/41/1357028841.db2.gz LVCPNQLWQAIZLT-IAGOWNOFSA-N 1 3 329.504 2.779 10 0 EFAEHO CN(CCC[N@H+](C)CC1CCC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001393634570 1357030771 /nfs/dbraw/zinc/03/07/71/1357030771.db2.gz MIYDJYPKSRDNPU-IBGZPJMESA-N 1 3 341.515 2.779 10 0 EFAEHO CN(CCC[N@@H+](C)CC1CCC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001393634570 1357030774 /nfs/dbraw/zinc/03/07/74/1357030774.db2.gz MIYDJYPKSRDNPU-IBGZPJMESA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H]2CCC[N@H+](CCCF)C2)C1 ZINC001393653211 1357052307 /nfs/dbraw/zinc/05/23/07/1357052307.db2.gz XAXBRBDTDUJVJW-QZTJIDSGSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H]2CCC[N@@H+](CCCF)C2)C1 ZINC001393653211 1357052308 /nfs/dbraw/zinc/05/23/08/1357052308.db2.gz XAXBRBDTDUJVJW-QZTJIDSGSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H]2CCC[N@H+](CCCF)C2)C1 ZINC001393653215 1357052905 /nfs/dbraw/zinc/05/29/05/1357052905.db2.gz XAXBRBDTDUJVJW-ROUUACIJSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H]2CCC[N@@H+](CCCF)C2)C1 ZINC001393653215 1357052906 /nfs/dbraw/zinc/05/29/06/1357052906.db2.gz XAXBRBDTDUJVJW-ROUUACIJSA-N 1 3 341.515 2.637 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c(C)c1 ZINC001394377988 1357749208 /nfs/dbraw/zinc/74/92/08/1357749208.db2.gz ZVEVNEOAYPMSOL-IHPCNDPISA-N 1 3 345.531 2.874 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001394455403 1357837311 /nfs/dbraw/zinc/83/73/11/1357837311.db2.gz ZLUVDAHXFMECIN-RTBURBONSA-N 1 3 349.563 2.980 10 0 EFAEHO C[C@H](CN(C)C(=O)CN(C)CC(C)(C)C)[NH2+]Cc1ccsc1 ZINC001394528479 1357912809 /nfs/dbraw/zinc/91/28/09/1357912809.db2.gz MGSWAGIOJYYZKK-CQSZACIVSA-N 1 3 325.522 2.663 10 0 EFAEHO CC[C@H](F)CN1CC[C@@]2(NC(=O)CC[NH+]3CCCCC3)CCC[C@@H]12 ZINC001394684897 1358003829 /nfs/dbraw/zinc/00/38/29/1358003829.db2.gz HOFKFPQDINBXNL-SCTDSRPQSA-N 1 3 339.499 2.724 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]CC2CCC3(CC3)CC2)C[C@@H]1C ZINC001394690364 1358013548 /nfs/dbraw/zinc/01/35/48/1358013548.db2.gz ZOKSIUNLTSONIN-FUHWJXTLSA-N 1 3 335.536 2.876 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H](Cc1ccccc1)[NH2+]C(C)C ZINC001394694197 1358017749 /nfs/dbraw/zinc/01/77/49/1358017749.db2.gz DRJVLSJMVLKHHC-PMACEKPBSA-N 1 3 345.531 2.976 10 0 EFAEHO C[C@H](F)CC[NH2+][C@@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001394706796 1358033045 /nfs/dbraw/zinc/03/30/45/1358033045.db2.gz CTEAIQVXFALLJY-LSDHHAIUSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]Cc1ccccc1F)C(C)(C)C ZINC001394825663 1358124184 /nfs/dbraw/zinc/12/41/84/1358124184.db2.gz IGGPLGKMMPEUBU-KRWDZBQOSA-N 1 3 337.483 2.786 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1(C2CC[NH+](CC3CC(C)C3)CC2)CC1 ZINC001394861693 1358168895 /nfs/dbraw/zinc/16/88/95/1358168895.db2.gz UCJJLVAWJGNKER-UHFFFAOYSA-N 1 3 344.503 2.668 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2CCN(C(=O)CCC[NH+]3CCCC3)C2)c1 ZINC001436883791 1387336350 /nfs/dbraw/zinc/33/63/50/1387336350.db2.gz YQLWETQDWVMYSZ-SFHVURJKSA-N 1 3 347.478 2.701 10 0 EFAEHO Cc1ccccc1C[N@H+]1CCC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001437009302 1387360063 /nfs/dbraw/zinc/36/00/63/1387360063.db2.gz WXPNAYITZUQFBH-SFHVURJKSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CCC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001437009302 1387360070 /nfs/dbraw/zinc/36/00/70/1387360070.db2.gz WXPNAYITZUQFBH-SFHVURJKSA-N 1 3 331.504 2.663 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CC[C@@H]([NH2+]CC=C(Cl)Cl)C2)CCC1 ZINC001397161645 1359714852 /nfs/dbraw/zinc/71/48/52/1359714852.db2.gz ZYCSVOLBWCUSBO-QWHCGFSZSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC(CC)C[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)[C@@H](CC)N(C)C ZINC001397176700 1359726724 /nfs/dbraw/zinc/72/67/24/1359726724.db2.gz VVJXARYDXQXLHC-BPQIPLTHSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H](F)CCN1CC[C@@H]1CN(C)C(=O)CCC[NH+]1CCCCC1 ZINC001397554190 1359955846 /nfs/dbraw/zinc/95/58/46/1359955846.db2.gz LMPUHEIFJBTEPF-DLBZAZTESA-N 1 3 327.488 2.533 10 0 EFAEHO CC[C@H](F)C[NH2+][C@H]1C[C@@H](CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001397619340 1360007719 /nfs/dbraw/zinc/00/77/19/1360007719.db2.gz WWKKQJMVQULIDK-RYQLBKOJSA-N 1 3 335.467 2.594 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N(C)C)CC[N@@H+]1CCCC(C)C ZINC001397738915 1360093241 /nfs/dbraw/zinc/09/32/41/1360093241.db2.gz GVHVTNDUKVCCPM-KSZLIROESA-N 1 3 325.541 2.978 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N(C)C)CC[N@H+]1CCCC(C)C ZINC001397738915 1360093244 /nfs/dbraw/zinc/09/32/44/1360093244.db2.gz GVHVTNDUKVCCPM-KSZLIROESA-N 1 3 325.541 2.978 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@H+](C/C=C/Cl)CC(C)(C)C1)N(C)C ZINC001397804429 1360156170 /nfs/dbraw/zinc/15/61/70/1360156170.db2.gz FVVTZLNXXICENK-MMCPSDEHSA-N 1 3 329.916 2.686 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@@H+](C/C=C/Cl)CC(C)(C)C1)N(C)C ZINC001397804429 1360156175 /nfs/dbraw/zinc/15/61/75/1360156175.db2.gz FVVTZLNXXICENK-MMCPSDEHSA-N 1 3 329.916 2.686 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@H+](C)CC1CCC(F)(F)CC1)N(C)C ZINC001448069613 1391930349 /nfs/dbraw/zinc/93/03/49/1391930349.db2.gz SIGSKTCTSOFEKW-DZGCQCFKSA-N 1 3 333.467 2.589 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@@H+](C)CC1CCC(F)(F)CC1)N(C)C ZINC001448069613 1391930354 /nfs/dbraw/zinc/93/03/54/1391930354.db2.gz SIGSKTCTSOFEKW-DZGCQCFKSA-N 1 3 333.467 2.589 10 0 EFAEHO CN(C(=O)C1(C[NH+](C)C)CC1)C1CCN(Cc2ccsc2)CC1 ZINC001398194624 1360370185 /nfs/dbraw/zinc/37/01/85/1360370185.db2.gz XOBWJOQQAYDZTJ-UHFFFAOYSA-N 1 3 335.517 2.513 10 0 EFAEHO C[C@H](F)CCN1CCC[C@H](NC(=O)C2(C[NH+](C)C)CCCCC2)C1 ZINC001398235168 1360403846 /nfs/dbraw/zinc/40/38/46/1360403846.db2.gz PXJQBSSFAUQGBZ-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccc(CC[NH+]2CCC(N(C)C(=O)CN(C)C(C)C)CC2)cc1 ZINC001398239927 1360407412 /nfs/dbraw/zinc/40/74/12/1360407412.db2.gz WVNXIHBUEPNVLA-UHFFFAOYSA-N 1 3 345.531 2.801 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H]1CC[N@H+](Cc2c(C)cccc2C)C1 ZINC001398287809 1360443265 /nfs/dbraw/zinc/44/32/65/1360443265.db2.gz JQSDBYRXSYSHKE-MJGOQNOKSA-N 1 3 349.494 2.674 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H]1CC[N@@H+](Cc2c(C)cccc2C)C1 ZINC001398287809 1360443266 /nfs/dbraw/zinc/44/32/66/1360443266.db2.gz JQSDBYRXSYSHKE-MJGOQNOKSA-N 1 3 349.494 2.674 10 0 EFAEHO Cc1cc(C)cc(CN2CC[C@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001398303010 1360452884 /nfs/dbraw/zinc/45/28/84/1360452884.db2.gz XCAAGMNUHIBIBJ-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(CN2CC[C@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001398303010 1360452888 /nfs/dbraw/zinc/45/28/88/1360452888.db2.gz XCAAGMNUHIBIBJ-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC12CC[NH+](CCCC1CCC1)CC2 ZINC001398356129 1360480447 /nfs/dbraw/zinc/48/04/47/1360480447.db2.gz FDUJVXRNOGBMEH-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@H](NCc1ccccc1F)C1CC1 ZINC001398400726 1360517284 /nfs/dbraw/zinc/51/72/84/1360517284.db2.gz OWOKNVZLQYNUCG-MJGOQNOKSA-N 1 3 347.478 2.685 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@H](NCc1ccccc1F)C1CC1 ZINC001398400726 1360517288 /nfs/dbraw/zinc/51/72/88/1360517288.db2.gz OWOKNVZLQYNUCG-MJGOQNOKSA-N 1 3 347.478 2.685 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](NCC=C(Cl)Cl)C1CC1 ZINC001398413905 1360532329 /nfs/dbraw/zinc/53/23/29/1360532329.db2.gz SWHOQRLGBMNGMH-KGLIPLIRSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](NCC=C(Cl)Cl)C1CC1 ZINC001398413905 1360532333 /nfs/dbraw/zinc/53/23/33/1360532333.db2.gz SWHOQRLGBMNGMH-KGLIPLIRSA-N 1 3 348.318 2.664 10 0 EFAEHO CC1CCC(CN2C[C@H]3CC[C@@H](C2)N3C(=O)C2(C[NH+](C)C)CC2)CC1 ZINC001398507112 1360611156 /nfs/dbraw/zinc/61/11/56/1360611156.db2.gz XRZDHFSGQZRTCA-YHFFBGSDSA-N 1 3 347.547 2.830 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)C[NH+]2[C@@H](C)CC[C@@H]2C)c1 ZINC001492873683 1360636587 /nfs/dbraw/zinc/63/65/87/1360636587.db2.gz PMFKWBLBVKIFHG-IRXDYDNUSA-N 1 3 331.504 2.670 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@@H](C)c2cc(F)ccc2F)C1 ZINC001398574711 1360652798 /nfs/dbraw/zinc/65/27/98/1360652798.db2.gz LNMDVMVBJMJWAS-QEJZJMRPSA-N 1 3 339.430 2.603 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@H+](CCC(F)(F)F)CC[C@@H]21 ZINC001398588364 1360659123 /nfs/dbraw/zinc/65/91/23/1360659123.db2.gz SKACHYWEEQUKNY-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@@H+](CCC(F)(F)F)CC[C@@H]21 ZINC001398588364 1360659127 /nfs/dbraw/zinc/65/91/27/1360659127.db2.gz SKACHYWEEQUKNY-CABCVRRESA-N 1 3 349.441 2.594 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@H+](CCC(F)(F)F)CC[C@H]21 ZINC001398588382 1360659401 /nfs/dbraw/zinc/65/94/01/1360659401.db2.gz SKACHYWEEQUKNY-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@@H+](CCC(F)(F)F)CC[C@H]21 ZINC001398588382 1360659411 /nfs/dbraw/zinc/65/94/11/1360659411.db2.gz SKACHYWEEQUKNY-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)CC[C@H]21 ZINC001398587444 1360659610 /nfs/dbraw/zinc/65/96/10/1360659610.db2.gz QVRZGKRWQREYNN-ZWKOTPCHSA-N 1 3 349.544 2.903 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)CC[C@H]21 ZINC001398587444 1360659614 /nfs/dbraw/zinc/65/96/14/1360659614.db2.gz QVRZGKRWQREYNN-ZWKOTPCHSA-N 1 3 349.544 2.903 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C/Cl ZINC001398589117 1360659930 /nfs/dbraw/zinc/65/99/30/1360659930.db2.gz ILIGACPAAOBHRB-SLUCWSNDSA-N 1 3 339.911 2.725 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C/Cl ZINC001398589117 1360659934 /nfs/dbraw/zinc/65/99/34/1360659934.db2.gz ILIGACPAAOBHRB-SLUCWSNDSA-N 1 3 339.911 2.725 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCCc3ccccc32)C1)N(C)C ZINC001398611488 1360669857 /nfs/dbraw/zinc/66/98/57/1360669857.db2.gz LVHHUGSZHADAPW-HNJRGHQBSA-N 1 3 343.515 2.887 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc3c(c2)CCC3)C1)N(C)C ZINC001398619133 1360673913 /nfs/dbraw/zinc/67/39/13/1360673913.db2.gz DGNLPOMQWQJRMK-GAZPGATBSA-N 1 3 343.515 2.813 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]C[C@@H]2CCC(F)(F)C2)C1)CC(C)(C)C ZINC001398628886 1360678888 /nfs/dbraw/zinc/67/88/88/1360678888.db2.gz SRMGDWLPQCUBTN-KFWWJZLASA-N 1 3 345.478 2.637 10 0 EFAEHO Cc1ccc(CN2CCCC[C@H]2CNC(=O)C[C@H]2CC[N@@H+](C)C2)cc1 ZINC001398751756 1360762526 /nfs/dbraw/zinc/76/25/26/1360762526.db2.gz BGWPBJFRBZVMME-UXHICEINSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1ccc(CN2CCCC[C@H]2CNC(=O)C[C@H]2CC[N@H+](C)C2)cc1 ZINC001398751756 1360762530 /nfs/dbraw/zinc/76/25/30/1360762530.db2.gz BGWPBJFRBZVMME-UXHICEINSA-N 1 3 343.515 2.808 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H](C)[NH2+]CCc1cccs1 ZINC001437212875 1387473202 /nfs/dbraw/zinc/47/32/02/1387473202.db2.gz HHBUPHIHBIESHW-DOTOQJQBSA-N 1 3 337.533 2.648 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@H+](CCc2ccccc2)C1 ZINC001398787120 1360790543 /nfs/dbraw/zinc/79/05/43/1360790543.db2.gz DGUPOQKPGVUJDW-UYAOXDASSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](CCc2ccccc2)C1 ZINC001398787120 1360790546 /nfs/dbraw/zinc/79/05/46/1360790546.db2.gz DGUPOQKPGVUJDW-UYAOXDASSA-N 1 3 345.531 2.786 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](CC2CCCC2)C1 ZINC001398792193 1360796056 /nfs/dbraw/zinc/79/60/56/1360796056.db2.gz LZFGFNNTBBJEQP-WMLDXEAASA-N 1 3 332.492 2.668 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](CC2CCCC2)C1 ZINC001398792193 1360796060 /nfs/dbraw/zinc/79/60/60/1360796060.db2.gz LZFGFNNTBBJEQP-WMLDXEAASA-N 1 3 332.492 2.668 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001398931609 1360879637 /nfs/dbraw/zinc/87/96/37/1360879637.db2.gz XZDNKIWXAYMBJF-IEBWSBKVSA-N 1 3 331.504 2.505 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc(C)cc1C ZINC001398955583 1360893743 /nfs/dbraw/zinc/89/37/43/1360893743.db2.gz MMTXQZKRRXJLLP-IEBWSBKVSA-N 1 3 331.504 2.772 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+][C@@H](C)c1cccc(F)c1 ZINC001399047211 1360957347 /nfs/dbraw/zinc/95/73/47/1360957347.db2.gz ZIZHKFZXEVWIGW-CABCVRRESA-N 1 3 335.467 2.855 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H](C)[NH2+]CC1CC2(CCC2)C1 ZINC001399081942 1360978354 /nfs/dbraw/zinc/97/83/54/1360978354.db2.gz AZSGDUYWSXCCEJ-FUHWJXTLSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@H](C)[NH2+]CC1CC2(CCC2)C1 ZINC001399081941 1360978702 /nfs/dbraw/zinc/97/87/02/1360978702.db2.gz AZSGDUYWSXCCEJ-AEFFLSMTSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+][C@H](C)c1ccc(F)c(Cl)c1 ZINC001399177208 1361049897 /nfs/dbraw/zinc/04/98/97/1361049897.db2.gz WCAFLOSFNKZYHL-CHWSQXEVSA-N 1 3 343.874 2.975 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)[C@@H](C(C)C)[NH+]1CCCC1 ZINC001492879760 1361081139 /nfs/dbraw/zinc/08/11/39/1361081139.db2.gz VWTGRNXATWNNDU-HXUWFJFHSA-N 1 3 345.531 2.972 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[NH2+]Cc2c(C)cc(C)cc2C)C1 ZINC001399252042 1361100000 /nfs/dbraw/zinc/10/00/00/1361100000.db2.gz RDAQZNAUMGBCON-LJQANCHMSA-N 1 3 345.531 2.892 10 0 EFAEHO CC[N@H+](C)[C@H](C(=O)N1CCC[C@H](N(C)CCF)C1)c1ccccc1 ZINC001399278466 1361120078 /nfs/dbraw/zinc/12/00/78/1361120078.db2.gz IAVQDLINKZEWJS-ROUUACIJSA-N 1 3 335.467 2.572 10 0 EFAEHO CC[N@@H+](C)[C@H](C(=O)N1CCC[C@H](N(C)CCF)C1)c1ccccc1 ZINC001399278466 1361120079 /nfs/dbraw/zinc/12/00/79/1361120079.db2.gz IAVQDLINKZEWJS-ROUUACIJSA-N 1 3 335.467 2.572 10 0 EFAEHO CCN(C)[C@H](C(=O)N1CCC[C@H]([N@H+](C)CCF)C1)c1ccccc1 ZINC001399278466 1361120081 /nfs/dbraw/zinc/12/00/81/1361120081.db2.gz IAVQDLINKZEWJS-ROUUACIJSA-N 1 3 335.467 2.572 10 0 EFAEHO CCN(C)[C@H](C(=O)N1CCC[C@H]([N@@H+](C)CCF)C1)c1ccccc1 ZINC001399278466 1361120083 /nfs/dbraw/zinc/12/00/83/1361120083.db2.gz IAVQDLINKZEWJS-ROUUACIJSA-N 1 3 335.467 2.572 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C\Cl ZINC001399346072 1361163687 /nfs/dbraw/zinc/16/36/87/1361163687.db2.gz OSRUXMPAURZZIW-BILBVFMZSA-N 1 3 336.307 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C\Cl ZINC001399346072 1361163691 /nfs/dbraw/zinc/16/36/91/1361163691.db2.gz OSRUXMPAURZZIW-BILBVFMZSA-N 1 3 336.307 2.664 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001399404397 1361199685 /nfs/dbraw/zinc/19/96/85/1361199685.db2.gz WXFCQUOSYBLDHN-FUHWJXTLSA-N 1 3 331.504 2.630 10 0 EFAEHO CN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1ccc(C2CC2)cc1 ZINC001399553886 1361327196 /nfs/dbraw/zinc/32/71/96/1361327196.db2.gz BETTVSOEMCWESV-UHFFFAOYSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C)[C@@H](C)c1ccc2c(c1)CCC2 ZINC001399653061 1361406079 /nfs/dbraw/zinc/40/60/79/1361406079.db2.gz GRYMHOHXHOJTLD-INIZCTEOSA-N 1 3 331.504 2.625 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C)[C@@H](C)c1ccc2c(c1)CCC2 ZINC001399653061 1361406083 /nfs/dbraw/zinc/40/60/83/1361406083.db2.gz GRYMHOHXHOJTLD-INIZCTEOSA-N 1 3 331.504 2.625 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C)[C@H](C)c1ccc2c(c1)CCC2 ZINC001399653062 1361406403 /nfs/dbraw/zinc/40/64/03/1361406403.db2.gz GRYMHOHXHOJTLD-MRXNPFEDSA-N 1 3 331.504 2.625 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C)[C@H](C)c1ccc2c(c1)CCC2 ZINC001399653062 1361406404 /nfs/dbraw/zinc/40/64/04/1361406404.db2.gz GRYMHOHXHOJTLD-MRXNPFEDSA-N 1 3 331.504 2.625 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@H]1CCCN1Cc1cc2ccccc2s1 ZINC001399850576 1361529442 /nfs/dbraw/zinc/52/94/42/1361529442.db2.gz GTEFDQZFCSZKFG-MRXNPFEDSA-N 1 3 345.512 2.934 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1CCN(CCC(F)(F)F)C1)[NH+]1CCCCCC1 ZINC001399920049 1361577046 /nfs/dbraw/zinc/57/70/46/1361577046.db2.gz BEONEJHHWKXLOL-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+]([C@H]2CCc3c2cccc3F)C1 ZINC001399930805 1361585719 /nfs/dbraw/zinc/58/57/19/1361585719.db2.gz ICPGIATYXILNLY-BEFAXECRSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+]([C@H]2CCc3c2cccc3F)C1 ZINC001399930805 1361585722 /nfs/dbraw/zinc/58/57/22/1361585722.db2.gz ICPGIATYXILNLY-BEFAXECRSA-N 1 3 347.478 2.591 10 0 EFAEHO Cc1cccc(C)c1C[N@H+]1CC[C@@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001399930421 1361585806 /nfs/dbraw/zinc/58/58/06/1361585806.db2.gz IXUHONNBCYBHFE-APWZRJJASA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+]1CC[C@@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001399930421 1361585809 /nfs/dbraw/zinc/58/58/09/1361585809.db2.gz IXUHONNBCYBHFE-APWZRJJASA-N 1 3 343.515 2.583 10 0 EFAEHO CCCN(CCNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC)Cc1ccsc1 ZINC001399949330 1361602969 /nfs/dbraw/zinc/60/29/69/1361602969.db2.gz FGTHGQVEMDYGJL-DLBZAZTESA-N 1 3 337.533 2.807 10 0 EFAEHO CCCN(CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC)Cc1ccsc1 ZINC001399949330 1361602971 /nfs/dbraw/zinc/60/29/71/1361602971.db2.gz FGTHGQVEMDYGJL-DLBZAZTESA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001400076785 1361716568 /nfs/dbraw/zinc/71/65/68/1361716568.db2.gz CWVMQYSMNWDVLW-AEFFLSMTSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H](C(=O)NCC[C@@H]1CCN(C/C=C/Cl)C1)[NH+]1CCCCCC1 ZINC001400182632 1361821316 /nfs/dbraw/zinc/82/13/16/1361821316.db2.gz LEHDNTUSJFDPSJ-QOCAVEGASA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001400184235 1361825444 /nfs/dbraw/zinc/82/54/44/1361825444.db2.gz MXHTUPVLKZYIMR-IEBWSBKVSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001400184235 1361825446 /nfs/dbraw/zinc/82/54/46/1361825446.db2.gz MXHTUPVLKZYIMR-IEBWSBKVSA-N 1 3 349.563 2.981 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H]1CC[N@H+](CCC(F)(F)F)C1 ZINC001400193208 1361834506 /nfs/dbraw/zinc/83/45/06/1361834506.db2.gz GAFAFQSZSWZQKX-LSDHHAIUSA-N 1 3 349.441 2.641 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H]1CC[N@@H+](CCC(F)(F)F)C1 ZINC001400193208 1361834509 /nfs/dbraw/zinc/83/45/09/1361834509.db2.gz GAFAFQSZSWZQKX-LSDHHAIUSA-N 1 3 349.441 2.641 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H]2CCC[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001437320094 1387539482 /nfs/dbraw/zinc/53/94/82/1387539482.db2.gz HUJMPLGADBKTJQ-MSOLQXFVSA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)(C(=O)NCC1C[NH+](CC2CCC3(CC3)CC2)C1)N1CCCC1 ZINC001400520957 1362010111 /nfs/dbraw/zinc/01/01/11/1362010111.db2.gz RHLADIYLWAPRFI-UHFFFAOYSA-N 1 3 347.547 2.879 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccc(C)cc1 ZINC001400799503 1362171302 /nfs/dbraw/zinc/17/13/02/1362171302.db2.gz HSELBXMHAXSQNU-MOPGFXCFSA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]CC1CCC2(CC2)CC1 ZINC001400807147 1362176182 /nfs/dbraw/zinc/17/61/82/1362176182.db2.gz BMNWOCJMLQCLKC-KRWDZBQOSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]Cc1ccsc1 ZINC001400852423 1362211376 /nfs/dbraw/zinc/21/13/76/1362211376.db2.gz KEDHPDROPZTDEK-OAHLLOKOSA-N 1 3 325.522 2.710 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(Cl)cc1C ZINC001400909199 1362247322 /nfs/dbraw/zinc/24/73/22/1362247322.db2.gz BTLXCWDSMIHPCH-QGZVFWFLSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@H](F)C[NH2+]CC1(NC(=O)[C@H]2CCCN2C(C)C)CCCC1 ZINC001400909189 1362248264 /nfs/dbraw/zinc/24/82/64/1362248264.db2.gz PLIKORZHWSZBHO-JKSUJKDBSA-N 1 3 327.488 2.626 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](CC)N(C)C)[NH2+]Cc1cccc2cccnc21 ZINC001400912040 1362250849 /nfs/dbraw/zinc/25/08/49/1362250849.db2.gz RJAFFBGDQFOIPA-QZTJIDSGSA-N 1 3 342.487 2.559 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H]([N@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001437342873 1387565195 /nfs/dbraw/zinc/56/51/95/1387565195.db2.gz AZHFXBOJMOMIGQ-DLBZAZTESA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H]([N@@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001437342873 1387565198 /nfs/dbraw/zinc/56/51/98/1387565198.db2.gz AZHFXBOJMOMIGQ-DLBZAZTESA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+]Cc1ccccc1Cl ZINC001401159440 1362494690 /nfs/dbraw/zinc/49/46/90/1362494690.db2.gz WKKIIHBSTBWCIT-AWEZNQCLSA-N 1 3 325.884 2.522 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]CC1CCC(C)(C)CC1)N(C)C ZINC001401229867 1362568498 /nfs/dbraw/zinc/56/84/98/1362568498.db2.gz LAEJYMRTCAZFOJ-DOTOQJQBSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](C[NH2+]CC1CCCC1)N(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001401247602 1362586913 /nfs/dbraw/zinc/58/69/13/1362586913.db2.gz QAAGJYCYIXOGJE-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)N(C)C(=O)C23CC[NH+](CC2)C3)c(Cl)c1 ZINC001401253861 1362592539 /nfs/dbraw/zinc/59/25/39/1362592539.db2.gz MHIOJODQHAULIL-OAHLLOKOSA-N 1 3 349.906 2.681 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+]C[C@@H](C)N(C)C(=O)CN1CCCC1 ZINC001401263443 1362603899 /nfs/dbraw/zinc/60/38/99/1362603899.db2.gz VIGYHZIFBFUPOB-MRXNPFEDSA-N 1 3 346.519 2.546 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H](C)CNCc1ccccc1F)[NH+]1CCCC1 ZINC001401267318 1362608262 /nfs/dbraw/zinc/60/82/62/1362608262.db2.gz RXEJJZNBPSUKHT-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO CC[C@@H](F)CNC[C@H](CC(C)C)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001401283350 1362629673 /nfs/dbraw/zinc/62/96/73/1362629673.db2.gz LAZMJLHXMJUHES-SJORKVTESA-N 1 3 341.515 2.731 10 0 EFAEHO CC[C@H](F)C[N@H+](C)CCC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001401305797 1362652014 /nfs/dbraw/zinc/65/20/14/1362652014.db2.gz MKFXFSZXINOPOH-KRWDZBQOSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)CCC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001401305797 1362652015 /nfs/dbraw/zinc/65/20/15/1362652015.db2.gz MKFXFSZXINOPOH-KRWDZBQOSA-N 1 3 341.515 2.779 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CCC(F)(F)F)C(C)C ZINC001401337396 1362683978 /nfs/dbraw/zinc/68/39/78/1362683978.db2.gz UYBIOCUZYVCLHD-UONOGXRCSA-N 1 3 337.430 2.544 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2ccc(F)cc21)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001401425921 1362788697 /nfs/dbraw/zinc/78/86/97/1362788697.db2.gz BUNPLNIAVOTAJQ-DNVCBOLYSA-N 1 3 347.478 2.545 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2ccc(F)cc21)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001401425921 1362788702 /nfs/dbraw/zinc/78/87/02/1362788702.db2.gz BUNPLNIAVOTAJQ-DNVCBOLYSA-N 1 3 347.478 2.545 10 0 EFAEHO CCCc1ccc(CN(C)CCN(C)C(=O)C[C@@H]2CC[N@H+](C)C2)cc1 ZINC001401436644 1362804381 /nfs/dbraw/zinc/80/43/81/1362804381.db2.gz WWVGWDKNOSYCLR-FQEVSTJZSA-N 1 3 345.531 2.871 10 0 EFAEHO CCCc1ccc(CN(C)CCN(C)C(=O)C[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001401436644 1362804386 /nfs/dbraw/zinc/80/43/86/1362804386.db2.gz WWVGWDKNOSYCLR-FQEVSTJZSA-N 1 3 345.531 2.871 10 0 EFAEHO C[C@H](CNCc1ccc(Cl)s1)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001401628817 1362983137 /nfs/dbraw/zinc/98/31/37/1362983137.db2.gz STUIPUDAILWPCG-OLZOCXBDSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@H](CNCc1ccc(Cl)s1)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001401628817 1362983144 /nfs/dbraw/zinc/98/31/44/1362983144.db2.gz STUIPUDAILWPCG-OLZOCXBDSA-N 1 3 343.924 2.870 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CNCc1ccccc1F)[NH+]1CCCC1 ZINC001401669189 1363015058 /nfs/dbraw/zinc/01/50/58/1363015058.db2.gz JTIAYCBFLAJLGS-QAPCUYQASA-N 1 3 335.467 2.540 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001401710421 1363044073 /nfs/dbraw/zinc/04/40/73/1363044073.db2.gz YHLIQFKYQYBSLO-KDOFPFPSSA-N 1 3 331.504 2.548 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(F)c1 ZINC001401752698 1363085334 /nfs/dbraw/zinc/08/53/34/1363085334.db2.gz HZWDICWIUPJRQR-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(F)c1 ZINC001401752698 1363085336 /nfs/dbraw/zinc/08/53/36/1363085336.db2.gz HZWDICWIUPJRQR-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@H](C)NC(=O)[C@@H]1CCC[N@@H+]1C(C)C ZINC001401754397 1363088355 /nfs/dbraw/zinc/08/83/55/1363088355.db2.gz JZCFKBRWUUWLKQ-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@H](C)NC(=O)[C@@H]1CCC[N@H+]1C(C)C ZINC001401754397 1363088358 /nfs/dbraw/zinc/08/83/58/1363088358.db2.gz JZCFKBRWUUWLKQ-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO CCc1ccc(CC[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001401782841 1363124242 /nfs/dbraw/zinc/12/42/42/1363124242.db2.gz SSDXNKFOXWFBOH-ROUUACIJSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccc(CC[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001401782841 1363124248 /nfs/dbraw/zinc/12/42/48/1363124248.db2.gz SSDXNKFOXWFBOH-ROUUACIJSA-N 1 3 345.531 2.570 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@H](C)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001401785120 1363126396 /nfs/dbraw/zinc/12/63/96/1363126396.db2.gz RJPXIBMNUJGAON-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@H](C)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001401785120 1363126401 /nfs/dbraw/zinc/12/64/01/1363126401.db2.gz RJPXIBMNUJGAON-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCc1ccc(CN(C)C[C@@H](C)NC(=O)C[C@@H]2CC[N@H+](C)C2)cc1 ZINC001401797043 1363142423 /nfs/dbraw/zinc/14/24/23/1363142423.db2.gz HTTJDXGLMYMTMK-APWZRJJASA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(CN(C)C[C@@H](C)NC(=O)C[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001401797043 1363142428 /nfs/dbraw/zinc/14/24/28/1363142428.db2.gz HTTJDXGLMYMTMK-APWZRJJASA-N 1 3 331.504 2.527 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)Cc1c(C)cc(C)cc1C)N(C)C ZINC001401810510 1363160740 /nfs/dbraw/zinc/16/07/40/1363160740.db2.gz ZFOXAINFDHNQPJ-PKOBYXMFSA-N 1 3 333.520 2.889 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)Cc1c(C)cc(C)cc1C)N(C)C ZINC001401810510 1363160743 /nfs/dbraw/zinc/16/07/43/1363160743.db2.gz ZFOXAINFDHNQPJ-PKOBYXMFSA-N 1 3 333.520 2.889 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCCC[C@@H]1C[NH2+]Cc1ccsc1 ZINC001401818368 1363166472 /nfs/dbraw/zinc/16/64/72/1363166472.db2.gz IMYPXDDYPQIALH-SJORKVTESA-N 1 3 337.533 2.855 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)Cc1cccc(C)c1 ZINC001401827387 1363171105 /nfs/dbraw/zinc/17/11/05/1363171105.db2.gz PLSNIGOAYZMECR-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)Cc1cccc(C)c1 ZINC001401827387 1363171109 /nfs/dbraw/zinc/17/11/09/1363171109.db2.gz PLSNIGOAYZMECR-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]CC1CCCCC1)C1CC1 ZINC001401841526 1363180047 /nfs/dbraw/zinc/18/00/47/1363180047.db2.gz MDXKZWBMFDXSQY-RTBURBONSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)(C(=O)N[C@@H](C[NH2+]CC1CCCC1)C1CC1)N1CCCCC1 ZINC001401850073 1363186477 /nfs/dbraw/zinc/18/64/77/1363186477.db2.gz VHIGVRUYTXCPNR-SFHVURJKSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H](NC(=O)CN(C)C(C)C)C1CC1 ZINC001401864763 1363198812 /nfs/dbraw/zinc/19/88/12/1363198812.db2.gz HQAPGCOSBXKCEE-IBGZPJMESA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+][C@H]1CCc2ccc(F)cc21)C1CC1 ZINC001401874706 1363206403 /nfs/dbraw/zinc/20/64/03/1363206403.db2.gz QPEAMKFLFWOATB-RBUKOAKNSA-N 1 3 347.478 2.638 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NC[C@@H]1CCN1[C@@H]1CCc2ccccc21 ZINC001401927272 1363250531 /nfs/dbraw/zinc/25/05/31/1363250531.db2.gz QOOKVCANKDDOAR-AZUAARDMSA-N 1 3 341.499 2.740 10 0 EFAEHO CC(C)(C)CC[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001401965530 1363282951 /nfs/dbraw/zinc/28/29/51/1363282951.db2.gz ODZLAABNICLKLN-LJQANCHMSA-N 1 3 341.515 2.874 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NCC1(N[C@@H]2CCc3c2cccc3F)CC1 ZINC001401976340 1363293003 /nfs/dbraw/zinc/29/30/03/1363293003.db2.gz ARVAJZYEXIDPGL-GOSISDBHSA-N 1 3 347.478 2.783 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NCC1(N[C@@H]2CCc3c2cccc3F)CC1 ZINC001401976340 1363293009 /nfs/dbraw/zinc/29/30/09/1363293009.db2.gz ARVAJZYEXIDPGL-GOSISDBHSA-N 1 3 347.478 2.783 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@@H](C(=O)NCC2(NCc3ccsc3)CC2)C1 ZINC001401979837 1363296749 /nfs/dbraw/zinc/29/67/49/1363296749.db2.gz RQJFVPGGCWPXPG-CVEARBPZSA-N 1 3 335.517 2.607 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H](C)[NH2+]Cc1ccccc1 ZINC001402035081 1363346248 /nfs/dbraw/zinc/34/62/48/1363346248.db2.gz GXVGOQKRBNRICS-PKOBYXMFSA-N 1 3 331.504 2.886 10 0 EFAEHO CC(C)c1ccccc1CN1CCC[C@H](NC(=O)CC[NH+](C)C)C1 ZINC001402091706 1363397661 /nfs/dbraw/zinc/39/76/61/1363397661.db2.gz JPEOCJBEOHREGW-SFHVURJKSA-N 1 3 331.504 2.842 10 0 EFAEHO CC(C)[NH2+]C[C@@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CCCC1 ZINC001402102858 1363410027 /nfs/dbraw/zinc/41/00/27/1363410027.db2.gz RZMXLWZHABYXSG-VQIMIIECSA-N 1 3 341.515 2.872 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2CCCF)N(CC)CC ZINC001402106342 1363413611 /nfs/dbraw/zinc/41/36/11/1363413611.db2.gz KRLPCYHVASARGQ-IKGGRYGDSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2CCCF)N(CC)CC ZINC001402106342 1363413614 /nfs/dbraw/zinc/41/36/14/1363413614.db2.gz KRLPCYHVASARGQ-IKGGRYGDSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2cc(C)ccc2C)C1)N(C)C ZINC001402172973 1363479474 /nfs/dbraw/zinc/47/94/74/1363479474.db2.gz NMEIDKVPQGFIER-CTNGQTDRSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccccc1CN1CC[C@@H](NC(=O)CC[C@H]2CCC[N@H+]2C)C1 ZINC001402177456 1363483667 /nfs/dbraw/zinc/48/36/67/1363483667.db2.gz MUXHYRYOBOZXNU-RTBURBONSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccccc1CN1CC[C@@H](NC(=O)CC[C@H]2CCC[N@@H+]2C)C1 ZINC001402177456 1363483672 /nfs/dbraw/zinc/48/36/72/1363483672.db2.gz MUXHYRYOBOZXNU-RTBURBONSA-N 1 3 329.488 2.560 10 0 EFAEHO CC[C@H](F)CN1CCC(C)(CNC(=O)CC[C@H]2CCC[N@@H+]2C)CC1 ZINC001402193278 1363500943 /nfs/dbraw/zinc/50/09/43/1363500943.db2.gz WVJAUAIUNPFOGW-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](F)CN1CCC(C)(CNC(=O)CC[C@H]2CCC[N@H+]2C)CC1 ZINC001402193278 1363500947 /nfs/dbraw/zinc/50/09/47/1363500947.db2.gz WVJAUAIUNPFOGW-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](F)C[NH+]1CCC2(C[C@H]2NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001402246885 1363567154 /nfs/dbraw/zinc/56/71/54/1363567154.db2.gz SAUPWOSJOWZTBS-JKSUJKDBSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)C1CC1 ZINC001402389102 1363647373 /nfs/dbraw/zinc/64/73/73/1363647373.db2.gz XOMFTUCUHRIJKK-OALUTQOASA-N 1 3 347.478 2.638 10 0 EFAEHO CN(CCF)C[C@H]1CCCN(C(=O)[C@H]2CCC[N@@H+]2C2CCCC2)C1 ZINC001402390903 1363649441 /nfs/dbraw/zinc/64/94/41/1363649441.db2.gz WAEWJIBSHFXUBH-SJLPKXTDSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)C[C@H]1CCCN(C(=O)[C@H]2CCC[N@H+]2C2CCCC2)C1 ZINC001402390903 1363649442 /nfs/dbraw/zinc/64/94/42/1363649442.db2.gz WAEWJIBSHFXUBH-SJLPKXTDSA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H](C[N@H+](C)CCC(C)(C)C)C2)C1 ZINC001402393490 1363652506 /nfs/dbraw/zinc/65/25/06/1363652506.db2.gz RGDZOVFGQSPPRP-ROUUACIJSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H](C[N@@H+](C)CCC(C)(C)C)C2)C1 ZINC001402393490 1363652512 /nfs/dbraw/zinc/65/25/12/1363652512.db2.gz RGDZOVFGQSPPRP-ROUUACIJSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H](C[N@H+](C)CCC(C)(C)C)C2)C1 ZINC001402393491 1363652624 /nfs/dbraw/zinc/65/26/24/1363652624.db2.gz RGDZOVFGQSPPRP-ZWKOTPCHSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H](C[N@@H+](C)CCC(C)(C)C)C2)C1 ZINC001402393491 1363652626 /nfs/dbraw/zinc/65/26/26/1363652626.db2.gz RGDZOVFGQSPPRP-ZWKOTPCHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([C@H](C)[NH2+]Cc2ccc(CF)cc2)C1 ZINC001402395063 1363653657 /nfs/dbraw/zinc/65/36/57/1363653657.db2.gz AIHYCSVOKOXXDC-LPHOPBHVSA-N 1 3 349.494 2.823 10 0 EFAEHO CCc1ccccc1[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]CC1CC1 ZINC001402401300 1363660518 /nfs/dbraw/zinc/66/05/18/1363660518.db2.gz VFWGEVDKEKAFSZ-JXFKEZNVSA-N 1 3 343.515 2.748 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C(C)C)N(C)C ZINC001402402434 1363662274 /nfs/dbraw/zinc/66/22/74/1363662274.db2.gz GSNHZZHWBINZFI-AKHDSKFASA-N 1 3 337.552 2.930 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C(C)C)N(C)C ZINC001402402434 1363662277 /nfs/dbraw/zinc/66/22/77/1363662277.db2.gz GSNHZZHWBINZFI-AKHDSKFASA-N 1 3 337.552 2.930 10 0 EFAEHO Cc1ccc(CCCN2C[C@H]3CC[C@@H](C2)N3C(=O)CC[NH+](C)C)cc1 ZINC001402404258 1363663836 /nfs/dbraw/zinc/66/38/36/1363663836.db2.gz WPMUMOFFFMNRFN-BGYRXZFFSA-N 1 3 343.515 2.555 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CCC[C@H]3CN(Cc4ccsc4)C[C@H]32)CC1 ZINC001402466579 1363712255 /nfs/dbraw/zinc/71/22/55/1363712255.db2.gz CALZDDOOGGJOOQ-DLBZAZTESA-N 1 3 347.528 2.513 10 0 EFAEHO CC(C)C[C@H](C)C[NH+]1CCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)CC1 ZINC001402498624 1363741642 /nfs/dbraw/zinc/74/16/42/1363741642.db2.gz JHMDLFYQOFOLKJ-MOPGFXCFSA-N 1 3 349.563 2.935 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C/Cl)[NH+](CC)CC ZINC001402547074 1363777208 /nfs/dbraw/zinc/77/72/08/1363777208.db2.gz IAWYMMAXHFSWOS-VBSBWPHSSA-N 1 3 341.927 2.971 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCC2)c1 ZINC001402579242 1363807867 /nfs/dbraw/zinc/80/78/67/1363807867.db2.gz OIENCJZDCQKPII-UHFFFAOYSA-N 1 3 331.504 2.772 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCc3c2cccc3F)C1)C1CCC1 ZINC001402588479 1363816228 /nfs/dbraw/zinc/81/62/28/1363816228.db2.gz BZESBHIXQXWPSZ-BIENJYKASA-N 1 3 345.462 2.534 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(F)cc32)C1)N(C)C ZINC001402601585 1363826024 /nfs/dbraw/zinc/82/60/24/1363826024.db2.gz SULNSTTZDHTCGW-JFRXWTBNSA-N 1 3 347.478 2.636 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H]1C[C@@H](NC(=O)CN(C)CC(C)(C)C)C1 ZINC001402602143 1363826291 /nfs/dbraw/zinc/82/62/91/1363826291.db2.gz CRZDPOGGHIXGSU-HDICACEKSA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(Cl)cc32)C1)N(C)C ZINC001402627892 1363855561 /nfs/dbraw/zinc/85/55/61/1363855561.db2.gz KIOIRHTXRCTYME-ATLSCFEFSA-N 1 3 349.906 2.904 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccccc2C2CC2)C1)N(C)C ZINC001402636909 1363866661 /nfs/dbraw/zinc/86/66/61/1363866661.db2.gz XDUFPPXKBGQUDJ-NSHGMRRFSA-N 1 3 343.515 2.887 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)C1CC[NH+](C(C)C)CC1 ZINC001402660450 1363902576 /nfs/dbraw/zinc/90/25/76/1363902576.db2.gz VFXXVICYMPTSOS-QGZVFWFLSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CCC[N@H+](CCCC3CCC3)C2)C1 ZINC001402663077 1363906736 /nfs/dbraw/zinc/90/67/36/1363906736.db2.gz JWNZSCLWACOKFD-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CCC[N@@H+](CCCC3CCC3)C2)C1 ZINC001402663077 1363906739 /nfs/dbraw/zinc/90/67/39/1363906739.db2.gz JWNZSCLWACOKFD-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCN(C)C(=O)CN(C)C(C)C)cc1F ZINC001402673179 1363923051 /nfs/dbraw/zinc/92/30/51/1363923051.db2.gz IECKUQXLBPDGSO-UHFFFAOYSA-N 1 3 337.483 2.755 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCN(C)C(=O)CN(C)C(C)C)cc1F ZINC001402673179 1363923053 /nfs/dbraw/zinc/92/30/53/1363923053.db2.gz IECKUQXLBPDGSO-UHFFFAOYSA-N 1 3 337.483 2.755 10 0 EFAEHO CC[C@H](C)[C@@H](C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CC)CC1 ZINC001402683604 1363933347 /nfs/dbraw/zinc/93/33/47/1363933347.db2.gz QPIHPILVUAOIDG-OGWHTMIXSA-N 1 3 335.536 2.828 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC)([NH2+]Cc2ccsc2)CC1)N(C)C ZINC001402696834 1363944606 /nfs/dbraw/zinc/94/46/06/1363944606.db2.gz CZONBJFPRYFLPB-INIZCTEOSA-N 1 3 337.533 2.949 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@]2(CCN(C/C=C/Cl)C2)C1 ZINC001402718738 1363965160 /nfs/dbraw/zinc/96/51/60/1363965160.db2.gz PFNRISKQXIVYJE-YXOJNZSOSA-N 1 3 341.927 2.785 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@]2(CCN(C/C=C/Cl)C2)C1 ZINC001402718738 1363965164 /nfs/dbraw/zinc/96/51/64/1363965164.db2.gz PFNRISKQXIVYJE-YXOJNZSOSA-N 1 3 341.927 2.785 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@]2(CCN(Cc3ccccc3F)C2)C1 ZINC001402728241 1363972083 /nfs/dbraw/zinc/97/20/83/1363972083.db2.gz ZTJRJXASJHEGRU-FQEVSTJZSA-N 1 3 347.478 2.592 10 0 EFAEHO CC(C)(C(=O)NCc1ccc2c(c1)CN(CC1CC1)C2)[NH+]1CCCC1 ZINC001402749601 1363996408 /nfs/dbraw/zinc/99/64/08/1363996408.db2.gz MODMBMSDWDIPDQ-UHFFFAOYSA-N 1 3 341.499 2.903 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001402777998 1364026804 /nfs/dbraw/zinc/02/68/04/1364026804.db2.gz ZMGCGBPEVQLLAM-HKUYNNGSSA-N 1 3 331.504 2.580 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N(C)CCNC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001437454377 1387656097 /nfs/dbraw/zinc/65/60/97/1387656097.db2.gz AVVLUGLSDLQUKT-OALUTQOASA-N 1 3 347.478 2.667 10 0 EFAEHO C[C@@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001402822703 1364070144 /nfs/dbraw/zinc/07/01/44/1364070144.db2.gz KZYJNXAFIHNMDA-LSDHHAIUSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)c1ccc(C[NH2+][C@H](C)CNC(=O)[C@H](C(C)C)N(C)C)cc1 ZINC001402905628 1364123282 /nfs/dbraw/zinc/12/32/82/1364123282.db2.gz DFOSPARWGRZCIJ-APWZRJJASA-N 1 3 333.520 2.991 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CCC[N@H+](CCCF)C2)CC1 ZINC001402915348 1364131215 /nfs/dbraw/zinc/13/12/15/1364131215.db2.gz OZUDNWCDWMETLH-GOSISDBHSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CCC[N@@H+](CCCF)C2)CC1 ZINC001402915348 1364131219 /nfs/dbraw/zinc/13/12/19/1364131219.db2.gz OZUDNWCDWMETLH-GOSISDBHSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1)N(C)C ZINC001402920296 1364136078 /nfs/dbraw/zinc/13/60/78/1364136078.db2.gz PEUXOSBKZLQQBL-XHDPSFHLSA-N 1 3 346.302 2.928 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@@H](C)c2cccc(C)c2)C1 ZINC001402955135 1364160288 /nfs/dbraw/zinc/16/02/88/1364160288.db2.gz ZORVPOUSSDLFOG-MUYFXNHWSA-N 1 3 331.504 2.882 10 0 EFAEHO C[C@@H](NCc1cccnc1)[C@@H](C)NC(=O)C1(C[NH+](C)C)CCCCC1 ZINC001402988365 1364186067 /nfs/dbraw/zinc/18/60/67/1364186067.db2.gz DKMYVWPSIMJJPC-IAGOWNOFSA-N 1 3 346.519 2.577 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001403018532 1364218516 /nfs/dbraw/zinc/21/85/16/1364218516.db2.gz BZBKVMPNOGCDJJ-KBPBESRZSA-N 1 3 325.884 2.663 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C1CCC1 ZINC001403035890 1364239750 /nfs/dbraw/zinc/23/97/50/1364239750.db2.gz WNVIDTSDNSYMSF-JKSUJKDBSA-N 1 3 331.504 2.716 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)CNC(=O)[C@H](C)N2CCCCCC2)cc1 ZINC001403040312 1364244091 /nfs/dbraw/zinc/24/40/91/1364244091.db2.gz BGYRHXBJQKUPAE-MOPGFXCFSA-N 1 3 345.531 2.896 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)CNC(=O)[C@H]2CCCCN2C(C)C)cs1 ZINC001403051786 1364255616 /nfs/dbraw/zinc/25/56/16/1364255616.db2.gz PRBLDERVJVUPME-WMLDXEAASA-N 1 3 337.533 2.914 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C(C)C)c(Cl)c1 ZINC001403057038 1364262274 /nfs/dbraw/zinc/26/22/74/1364262274.db2.gz XZRHPWAEXJETRE-LSDHHAIUSA-N 1 3 339.911 2.971 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)C/C=C/c2ccccc2)CC[N@@H+]1C ZINC001403118036 1364329850 /nfs/dbraw/zinc/32/98/50/1364329850.db2.gz DJBNGEXGFZMAOP-SWAXFOCASA-N 1 3 343.515 2.867 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)C/C=C/c2ccccc2)CC[N@H+]1C ZINC001403118036 1364329856 /nfs/dbraw/zinc/32/98/56/1364329856.db2.gz DJBNGEXGFZMAOP-SWAXFOCASA-N 1 3 343.515 2.867 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[N@H+](C)Cc1ccc(C2CC2)cc1 ZINC001403133730 1364349086 /nfs/dbraw/zinc/34/90/86/1364349086.db2.gz HGAONMAPOIGKPT-MRXNPFEDSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[N@@H+](C)Cc1ccc(C2CC2)cc1 ZINC001403133730 1364349092 /nfs/dbraw/zinc/34/90/92/1364349092.db2.gz HGAONMAPOIGKPT-MRXNPFEDSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC001403155453 1364374993 /nfs/dbraw/zinc/37/49/93/1364374993.db2.gz CSKZMCNBCHTGGY-ZDUSSCGKSA-N 1 3 345.409 2.640 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N(C)[C@@H](C)CNC(=O)CC[NH+](C)C ZINC001403168016 1364389172 /nfs/dbraw/zinc/38/91/72/1364389172.db2.gz LUKQZRYMERNKPP-UONOGXRCSA-N 1 3 325.884 2.789 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CCCC1 ZINC001403266850 1364479788 /nfs/dbraw/zinc/47/97/88/1364479788.db2.gz VOSREEVYZGBSBI-IEBWSBKVSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)C12CCC[NH+](CCC1)C2 ZINC001437485379 1387686627 /nfs/dbraw/zinc/68/66/27/1387686627.db2.gz MGULCSVKFOLSCE-UHFFFAOYSA-N 1 3 343.515 2.727 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C1C[NH+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001403335009 1364551479 /nfs/dbraw/zinc/55/14/79/1364551479.db2.gz UKXNJCKXKYXIFQ-QAPCUYQASA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001403350131 1364561422 /nfs/dbraw/zinc/56/14/22/1364561422.db2.gz KMUOUEANBQAMTN-FXAWDEMLSA-N 1 3 345.531 2.889 10 0 EFAEHO Cc1ccc(C[NH+]2CC([C@@H](C)NC(=O)CN(C)C(C)C)C2)cc1C ZINC001403355891 1364566454 /nfs/dbraw/zinc/56/64/54/1364566454.db2.gz SXVYQZMQDLYKMV-QGZVFWFLSA-N 1 3 331.504 2.580 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](Cc2ccccc2C2CC2)C1)N(C)C ZINC001403362329 1364574205 /nfs/dbraw/zinc/57/42/05/1364574205.db2.gz YZNXKVIWLDFRFO-MGPUTAFESA-N 1 3 343.515 2.841 10 0 EFAEHO Cc1cc(CN2C[C@]3(C)CN(C(=O)CC[NH+](C)C)C[C@]3(C)C2)cs1 ZINC001403403947 1364608361 /nfs/dbraw/zinc/60/83/61/1364608361.db2.gz OAUHRJFJVNSMFM-KDURUIRLSA-N 1 3 349.544 2.679 10 0 EFAEHO CC(C)CC[N@H+]1C[C@@H]2[C@@H](CNC(=O)[C@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001403409687 1364613999 /nfs/dbraw/zinc/61/39/99/1364613999.db2.gz JLVZJADGDPILNI-CADBVGFASA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)CC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)[C@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001403409687 1364614003 /nfs/dbraw/zinc/61/40/03/1364614003.db2.gz JLVZJADGDPILNI-CADBVGFASA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1ccccc1 ZINC001403440634 1364643263 /nfs/dbraw/zinc/64/32/63/1364643263.db2.gz FNAXZPZNKWZJTL-IEBWSBKVSA-N 1 3 331.504 2.934 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(Cl)s2)C1)N(C)C ZINC001403462576 1364664708 /nfs/dbraw/zinc/66/47/08/1364664708.db2.gz UMDPVCPNKMVYNB-OBJOEFQTSA-N 1 3 343.924 2.726 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+]Cc1cc(Cl)ccc1F ZINC001403497071 1364703550 /nfs/dbraw/zinc/70/35/50/1364703550.db2.gz XKDFSKGBKMNCTR-CYBMUJFWSA-N 1 3 343.874 2.804 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@H]1C[N@H+](C)C[C@@H]1c1ccccc1)NC/C=C\Cl ZINC001403594062 1364797771 /nfs/dbraw/zinc/79/77/71/1364797771.db2.gz OMTOGUOYNVKEHP-FKKKEJFISA-N 1 3 349.906 2.521 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1)NC/C=C\Cl ZINC001403594062 1364797775 /nfs/dbraw/zinc/79/77/75/1364797775.db2.gz OMTOGUOYNVKEHP-FKKKEJFISA-N 1 3 349.906 2.521 10 0 EFAEHO C[C@@H](CN(C)C(=O)C[C@@H]1CC[N@H+](C)C1)NCc1cc2ccccc2o1 ZINC001403605055 1364808996 /nfs/dbraw/zinc/80/89/96/1364808996.db2.gz CJDBBOKMELVHQY-HOTGVXAUSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@@H](CN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1)NCc1cc2ccccc2o1 ZINC001403605055 1364809000 /nfs/dbraw/zinc/80/90/00/1364809000.db2.gz CJDBBOKMELVHQY-HOTGVXAUSA-N 1 3 343.471 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001403618992 1364822077 /nfs/dbraw/zinc/82/20/77/1364822077.db2.gz FDJPRKNXTVSNIM-OAHLLOKOSA-N 1 3 331.460 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001403619040 1364822103 /nfs/dbraw/zinc/82/21/03/1364822103.db2.gz FINKBPUEPQQTPN-AWEZNQCLSA-N 1 3 333.467 2.589 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(F)cc1C ZINC001403620861 1364823455 /nfs/dbraw/zinc/82/34/55/1364823455.db2.gz IFPSHMMBBXOEKR-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+][C@H](C)CN(C)C(=O)CN(C)C(C)C ZINC001403630357 1364833921 /nfs/dbraw/zinc/83/39/21/1364833921.db2.gz WRGFRLBYRKCSTF-MRXNPFEDSA-N 1 3 348.535 2.790 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001403632878 1364836860 /nfs/dbraw/zinc/83/68/60/1364836860.db2.gz ZPNOLSGVMXUTAE-CQSZACIVSA-N 1 3 325.884 2.617 10 0 EFAEHO CC(C)Oc1ccccc1CN[C@@H]1CCN(C(=O)CC[NH+](C)C)[C@@H]1C ZINC001403741177 1364895158 /nfs/dbraw/zinc/89/51/58/1364895158.db2.gz HCJAFOCFFSDENL-SJLPKXTDSA-N 1 3 347.503 2.505 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)cc1C ZINC001403742805 1364895987 /nfs/dbraw/zinc/89/59/87/1364895987.db2.gz HAKLBNQEUSGQRP-IEBWSBKVSA-N 1 3 331.504 2.723 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)cc1 ZINC001403772652 1364920945 /nfs/dbraw/zinc/92/09/45/1364920945.db2.gz LMUXOAKRMFNIQK-VQIMIIECSA-N 1 3 331.504 2.668 10 0 EFAEHO CC[C@H](F)CN1CC[C@]2(NC(=O)CCC[NH+]3CCCC3)CCC[C@H]12 ZINC001403788938 1364940150 /nfs/dbraw/zinc/94/01/50/1364940150.db2.gz ZOZXSZFHDVYGRW-JENIJYKNSA-N 1 3 339.499 2.724 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CC(CC)CC)[C@@H]2C1 ZINC001403795012 1364946972 /nfs/dbraw/zinc/94/69/72/1364946972.db2.gz VPSDKGVCGIZFCL-OTWHNJEPSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001403796604 1364949471 /nfs/dbraw/zinc/94/94/71/1364949471.db2.gz BRBUUBSVKUMOSI-WMZOPIPTSA-N 1 3 335.536 2.783 10 0 EFAEHO C[C@H]1[C@@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc(CF)cc1 ZINC001403807943 1364962335 /nfs/dbraw/zinc/96/23/35/1364962335.db2.gz VJWSAHLNFLADHJ-YJBOKZPZSA-N 1 3 335.467 2.577 10 0 EFAEHO CCN(CCNC(=O)CC[NH+](C)C)Cc1cc2ccccc2s1 ZINC001403910545 1365032988 /nfs/dbraw/zinc/03/29/88/1365032988.db2.gz VMFQTYWUNYQXAX-UHFFFAOYSA-N 1 3 333.501 2.791 10 0 EFAEHO CC[C@H](C(=O)N(CC[N@H+](C)CC1CC(C)(C)C1)C(C)C)N(C)C ZINC001403933300 1365062888 /nfs/dbraw/zinc/06/28/88/1365062888.db2.gz FCZMDHYQQBSFMO-QGZVFWFLSA-N 1 3 325.541 2.932 10 0 EFAEHO CC[C@H](C(=O)N(CC[N@@H+](C)CC1CC(C)(C)C1)C(C)C)N(C)C ZINC001403933300 1365062890 /nfs/dbraw/zinc/06/28/90/1365062890.db2.gz FCZMDHYQQBSFMO-QGZVFWFLSA-N 1 3 325.541 2.932 10 0 EFAEHO CC[C@H](C(=O)N(CC[N@H+](C)CC1CC(F)(F)C1)C(C)C)N(C)C ZINC001403933974 1365063853 /nfs/dbraw/zinc/06/38/53/1365063853.db2.gz SBXUGTNOFOCYNY-OAHLLOKOSA-N 1 3 333.467 2.541 10 0 EFAEHO CC[C@H](C(=O)N(CC[N@@H+](C)CC1CC(F)(F)C1)C(C)C)N(C)C ZINC001403933974 1365063857 /nfs/dbraw/zinc/06/38/57/1365063857.db2.gz SBXUGTNOFOCYNY-OAHLLOKOSA-N 1 3 333.467 2.541 10 0 EFAEHO CC[C@@H](C(=O)N(CC[N@H+](C)CC1CC(F)(F)C1)C(C)C)N(C)C ZINC001403935677 1365067522 /nfs/dbraw/zinc/06/75/22/1365067522.db2.gz SBXUGTNOFOCYNY-HNNXBMFYSA-N 1 3 333.467 2.541 10 0 EFAEHO CC[C@@H](C(=O)N(CC[N@@H+](C)CC1CC(F)(F)C1)C(C)C)N(C)C ZINC001403935677 1365067525 /nfs/dbraw/zinc/06/75/25/1365067525.db2.gz SBXUGTNOFOCYNY-HNNXBMFYSA-N 1 3 333.467 2.541 10 0 EFAEHO Cc1cc(CN2CCC[C@@H]2CNC(=O)C[C@H]2CC[N@@H+](C)C2)c(C)s1 ZINC001404021176 1365177407 /nfs/dbraw/zinc/17/74/07/1365177407.db2.gz MTHDYLARBPCXHO-SJLPKXTDSA-N 1 3 349.544 2.787 10 0 EFAEHO Cc1cc(CN2CCC[C@@H]2CNC(=O)C[C@H]2CC[N@H+](C)C2)c(C)s1 ZINC001404021176 1365177412 /nfs/dbraw/zinc/17/74/12/1365177412.db2.gz MTHDYLARBPCXHO-SJLPKXTDSA-N 1 3 349.544 2.787 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C2CC(N(C)C(=O)CN(C)C(C)C)C2)c1 ZINC001404021698 1365178817 /nfs/dbraw/zinc/17/88/17/1365178817.db2.gz OJXRADZFDMTTTI-FAEJEUNOSA-N 1 3 347.503 2.675 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@H+](Cc2ccc(C3CC3)cc2)C1 ZINC001404065899 1365223506 /nfs/dbraw/zinc/22/35/06/1365223506.db2.gz BNLJATRCZZUFEH-GOSISDBHSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@@H+](Cc2ccc(C3CC3)cc2)C1 ZINC001404065899 1365223511 /nfs/dbraw/zinc/22/35/11/1365223511.db2.gz BNLJATRCZZUFEH-GOSISDBHSA-N 1 3 343.515 2.844 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(CCNC(=O)C12CC[NH+](CC1)C2)C1CC1 ZINC001404286467 1365429648 /nfs/dbraw/zinc/42/96/48/1365429648.db2.gz OVFNDIFGMDAYLE-HNNXBMFYSA-N 1 3 345.462 2.563 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@@H+](CCNC(=O)CN(C)C(C)C)C1CC1 ZINC001404292159 1365432987 /nfs/dbraw/zinc/43/29/87/1365432987.db2.gz KNGBWTQWKXPLCR-QGZVFWFLSA-N 1 3 331.504 2.977 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@H+](CCNC(=O)CN(C)C(C)C)C1CC1 ZINC001404292159 1365432991 /nfs/dbraw/zinc/43/29/91/1365432991.db2.gz KNGBWTQWKXPLCR-QGZVFWFLSA-N 1 3 331.504 2.977 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)C[NH+]2[C@H](C)CC[C@H]2C)C2CC2)cc1 ZINC001404297512 1365436172 /nfs/dbraw/zinc/43/61/72/1365436172.db2.gz NLCLQQWMTANWCX-QZTJIDSGSA-N 1 3 343.515 2.948 10 0 EFAEHO C[C@H]([NH2+]CC=C(Cl)Cl)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001404342277 1365462419 /nfs/dbraw/zinc/46/24/19/1365462419.db2.gz LHRVFMROBVCUCW-JSGCOSHPSA-N 1 3 348.318 2.616 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001437540737 1387744716 /nfs/dbraw/zinc/74/47/16/1387744716.db2.gz FZMNAQDMDFQSGE-OALUTQOASA-N 1 3 345.531 2.972 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CC(C)C)c1ccccc1 ZINC001404386241 1365490881 /nfs/dbraw/zinc/49/08/81/1365490881.db2.gz PJLBVHUVFIKJEV-RBUKOAKNSA-N 1 3 331.504 2.964 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001437540739 1387745432 /nfs/dbraw/zinc/74/54/32/1387745432.db2.gz FZMNAQDMDFQSGE-RBUKOAKNSA-N 1 3 345.531 2.972 10 0 EFAEHO CCCc1ccc(CN(C)CCNC(=O)C[C@H]2CC[N@H+](C)C2)cc1 ZINC001437542156 1387746515 /nfs/dbraw/zinc/74/65/15/1387746515.db2.gz RWSORVXOVAGNNE-LJQANCHMSA-N 1 3 331.504 2.529 10 0 EFAEHO CCCc1ccc(CN(C)CCNC(=O)C[C@H]2CC[N@@H+](C)C2)cc1 ZINC001437542156 1387746524 /nfs/dbraw/zinc/74/65/24/1387746524.db2.gz RWSORVXOVAGNNE-LJQANCHMSA-N 1 3 331.504 2.529 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2CC[N@H+](CC3CCCCC3)C2)C1 ZINC001404504590 1365607088 /nfs/dbraw/zinc/60/70/88/1365607088.db2.gz AKWPWPZFHPVJFY-MJGOQNOKSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2CC[N@@H+](CC3CCCCC3)C2)C1 ZINC001404504590 1365607089 /nfs/dbraw/zinc/60/70/89/1365607089.db2.gz AKWPWPZFHPVJFY-MJGOQNOKSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2ccsc2)C1)N(C)C ZINC001404523281 1365625279 /nfs/dbraw/zinc/62/52/79/1365625279.db2.gz UCRDFFJJMCBVGZ-NVXWUHKLSA-N 1 3 337.533 2.663 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2ccsc2)C1)N(C)C ZINC001404523281 1365625283 /nfs/dbraw/zinc/62/52/83/1365625283.db2.gz UCRDFFJJMCBVGZ-NVXWUHKLSA-N 1 3 337.533 2.663 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H]1CC[N@H+](Cc2ccsc2)C1 ZINC001404538763 1365637144 /nfs/dbraw/zinc/63/71/44/1365637144.db2.gz BUHLDZSKHHQJBJ-SJLPKXTDSA-N 1 3 349.544 2.951 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H]1CC[N@@H+](Cc2ccsc2)C1 ZINC001404538763 1365637146 /nfs/dbraw/zinc/63/71/46/1365637146.db2.gz BUHLDZSKHHQJBJ-SJLPKXTDSA-N 1 3 349.544 2.951 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CCC[N@H+](CCC2CCCC2)C1 ZINC001404753113 1365802369 /nfs/dbraw/zinc/80/23/69/1365802369.db2.gz GZHLZOYVGXZTON-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CCC[N@@H+](CCC2CCCC2)C1 ZINC001404753113 1365802372 /nfs/dbraw/zinc/80/23/72/1365802372.db2.gz GZHLZOYVGXZTON-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)CC[C@H]3CCC[N@H+]3C)C2)c(C)c1 ZINC001404886125 1365880737 /nfs/dbraw/zinc/88/07/37/1365880737.db2.gz CXKQRZOYDQVOTJ-HXUWFJFHSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c(C)c1 ZINC001404886125 1365880740 /nfs/dbraw/zinc/88/07/40/1365880740.db2.gz CXKQRZOYDQVOTJ-HXUWFJFHSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c(C)c1 ZINC001404886121 1365880759 /nfs/dbraw/zinc/88/07/59/1365880759.db2.gz CXKQRZOYDQVOTJ-FQEVSTJZSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c(C)c1 ZINC001404886121 1365880760 /nfs/dbraw/zinc/88/07/60/1365880760.db2.gz CXKQRZOYDQVOTJ-FQEVSTJZSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH+]2CC(CNC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001404909992 1365901387 /nfs/dbraw/zinc/90/13/87/1365901387.db2.gz UURNZNOPOZOTGZ-YLJYHZDGSA-N 1 3 345.531 2.999 10 0 EFAEHO Cc1cc(C)c(C[NH+]2CC(CNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001404944810 1365925413 /nfs/dbraw/zinc/92/54/13/1365925413.db2.gz HJWWSBZJTUXRTM-UHFFFAOYSA-N 1 3 331.504 2.500 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCN(C)Cc1ccc(CF)cc1)[NH+]1CCCC1 ZINC001437569818 1387780987 /nfs/dbraw/zinc/78/09/87/1387780987.db2.gz LEKZJTDXHMKAAN-IBGZPJMESA-N 1 3 349.494 2.825 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@H]1CCN(Cc2cc3ccccc3o2)C1 ZINC001405187165 1366097662 /nfs/dbraw/zinc/09/76/62/1366097662.db2.gz YRBZCQHWECHYRG-KRWDZBQOSA-N 1 3 343.471 2.807 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](CC)[NH2+]CC1CC2(CCC2)C1 ZINC001405260348 1366122182 /nfs/dbraw/zinc/12/21/82/1366122182.db2.gz TXEPIELCBBBQBH-ZWKOTPCHSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CC1CC2(CCC2)C1 ZINC001405274705 1366128684 /nfs/dbraw/zinc/12/86/84/1366128684.db2.gz OPGRDMZTRDIRLV-QGZVFWFLSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C1CCC1)[NH2+]Cc1cc(C)ccc1F ZINC001405358154 1366162209 /nfs/dbraw/zinc/16/22/09/1366162209.db2.gz FZDCKBYIBOSZBH-INIZCTEOSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CC1(NC(=O)CN(C)C(C)C)CCCC1 ZINC001405404763 1366178070 /nfs/dbraw/zinc/17/80/70/1366178070.db2.gz ILKJGVDFKHKIJI-UHFFFAOYSA-N 1 3 349.494 2.993 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N[C@@](C)(CNCc2ccccc2F)C2CC2)CC[N@@H+]1C ZINC001405438042 1366200419 /nfs/dbraw/zinc/20/04/19/1366200419.db2.gz QEXGJQIHPCPGJP-ZTQAJYAQSA-N 1 3 347.478 2.540 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N[C@@](C)(CNCc2ccccc2F)C2CC2)CC[N@H+]1C ZINC001405438042 1366200425 /nfs/dbraw/zinc/20/04/25/1366200425.db2.gz QEXGJQIHPCPGJP-ZTQAJYAQSA-N 1 3 347.478 2.540 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1CC[C@H]([NH2+]C/C=C/Cl)CC1 ZINC001405518158 1366262594 /nfs/dbraw/zinc/26/25/94/1366262594.db2.gz AEUNYEHIXSAYBD-JAUWVZEASA-N 1 3 327.900 2.629 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCc1ccc(C[NH2+]CC2CC2)cc1 ZINC001405538311 1366278639 /nfs/dbraw/zinc/27/86/39/1366278639.db2.gz FOZPQBBJSSQOKY-HZPDHXFCSA-N 1 3 329.488 2.675 10 0 EFAEHO C[C@H](F)CC[NH+]1CCC(CCNC(=O)CN(C)CC(C)(C)C)CC1 ZINC001405558046 1366293401 /nfs/dbraw/zinc/29/34/01/1366293401.db2.gz QQIGXIVSGMZJGV-INIZCTEOSA-N 1 3 343.531 2.931 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCCC1CCN(C/C=C\Cl)CC1 ZINC001405557442 1366293605 /nfs/dbraw/zinc/29/36/05/1366293605.db2.gz HXKIFOWQYXUTIY-ZZBREXMISA-N 1 3 341.927 2.832 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCCC1CCN(C/C=C\Cl)CC1 ZINC001405557442 1366293611 /nfs/dbraw/zinc/29/36/11/1366293611.db2.gz HXKIFOWQYXUTIY-ZZBREXMISA-N 1 3 341.927 2.832 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[NH2+]Cc1cc(C)ccc1F ZINC001405591841 1366309214 /nfs/dbraw/zinc/30/92/14/1366309214.db2.gz IRNAKPDNRVDQTP-QGZVFWFLSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H](C)CNC(=O)C(C)(C)N2CCCC2)cs1 ZINC001405696192 1366344815 /nfs/dbraw/zinc/34/48/15/1366344815.db2.gz XIJYABSKZKDELY-CQSZACIVSA-N 1 3 337.533 2.773 10 0 EFAEHO Cc1ccc(CN2CC3(C2)CCN(C(=O)CC[NH+](C)C)CC3)cc1C ZINC001405785743 1366414499 /nfs/dbraw/zinc/41/44/99/1366414499.db2.gz AJKBKGSVICYQPE-UHFFFAOYSA-N 1 3 343.515 2.680 10 0 EFAEHO CCCOc1cccc(C[NH2+]C[C@@H](C)N(C)C(=O)[C@@H]2CCCN2C)c1 ZINC001405788338 1366416275 /nfs/dbraw/zinc/41/62/75/1366416275.db2.gz BLXAVDQWQXRFSY-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)N(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001405873590 1366482027 /nfs/dbraw/zinc/48/20/27/1366482027.db2.gz PAZUZSIJNMTVMM-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)N(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001405873590 1366482031 /nfs/dbraw/zinc/48/20/31/1366482031.db2.gz PAZUZSIJNMTVMM-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)N(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001405873595 1366482084 /nfs/dbraw/zinc/48/20/84/1366482084.db2.gz PAZUZSIJNMTVMM-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)N(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001405873595 1366482089 /nfs/dbraw/zinc/48/20/89/1366482089.db2.gz PAZUZSIJNMTVMM-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H](CC(C)C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001405937419 1366540307 /nfs/dbraw/zinc/54/03/07/1366540307.db2.gz RQMMCPWUABRKNP-QUCCMNQESA-N 1 3 345.531 2.957 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)c(C)c1 ZINC001405990625 1367061463 /nfs/dbraw/zinc/06/14/63/1367061463.db2.gz ZWMUUDWEKNSGST-AZUAARDMSA-N 1 3 345.531 2.970 10 0 EFAEHO CC[N@H+](CCNC(=O)CN1CC[C@H](C)C1)Cc1ccc(C2CC2)cc1 ZINC001437625576 1387851285 /nfs/dbraw/zinc/85/12/85/1387851285.db2.gz JYJOPOFEGBVLOG-KRWDZBQOSA-N 1 3 343.515 2.844 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN1CC[C@H](C)C1)Cc1ccc(C2CC2)cc1 ZINC001437625576 1387851296 /nfs/dbraw/zinc/85/12/96/1387851296.db2.gz JYJOPOFEGBVLOG-KRWDZBQOSA-N 1 3 343.515 2.844 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1cc(C)ccc1F)C(C)C)N(C)C ZINC001406031762 1367118070 /nfs/dbraw/zinc/11/80/70/1367118070.db2.gz GUNWLTRSFPLDDB-QZTJIDSGSA-N 1 3 337.483 2.705 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CC[NH+](C)C)NCc1cc(F)ccc1Cl ZINC001406034862 1367122535 /nfs/dbraw/zinc/12/25/35/1367122535.db2.gz IPDBNVBHVUSMEM-MRXNPFEDSA-N 1 3 343.874 2.661 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](CNC(=O)C2(N(C)C)CCC2)C(C)C)c1 ZINC001406046182 1367140023 /nfs/dbraw/zinc/14/00/23/1367140023.db2.gz VQWPTWJWTOVFSL-GOSISDBHSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]Cc1ccccn1 ZINC001406054096 1367153157 /nfs/dbraw/zinc/15/31/57/1367153157.db2.gz YEUWTVUYBFSTTH-OALUTQOASA-N 1 3 346.519 2.575 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001406167832 1367357306 /nfs/dbraw/zinc/35/73/06/1367357306.db2.gz BRDCRYLFTGRCOA-OAHLLOKOSA-N 1 3 333.467 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001406167832 1367357312 /nfs/dbraw/zinc/35/73/12/1367357312.db2.gz BRDCRYLFTGRCOA-OAHLLOKOSA-N 1 3 333.467 2.542 10 0 EFAEHO CN(CC[N@H+](C)Cc1ccc2ccccc2c1)C(=O)CN1CCCC1 ZINC001406172898 1367365575 /nfs/dbraw/zinc/36/55/75/1367365575.db2.gz YGEITJHPNZDVDN-UHFFFAOYSA-N 1 3 339.483 2.826 10 0 EFAEHO CN(CC[N@@H+](C)Cc1ccc2ccccc2c1)C(=O)CN1CCCC1 ZINC001406172898 1367365582 /nfs/dbraw/zinc/36/55/82/1367365582.db2.gz YGEITJHPNZDVDN-UHFFFAOYSA-N 1 3 339.483 2.826 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)[C@H]2C[NH+]3CCC2CC3)c(Cl)c1 ZINC001406481107 1367633372 /nfs/dbraw/zinc/63/33/72/1367633372.db2.gz KVGMNTKUPDTECO-YOEHRIQHSA-N 1 3 349.906 2.585 10 0 EFAEHO C[C@H](C[N@H+](C)CC[C@H]1CCCC1(F)F)NC(=O)C1(N(C)C)CCC1 ZINC001406599600 1367780801 /nfs/dbraw/zinc/78/08/01/1367780801.db2.gz FXBITKRVIPVJGU-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C[N@@H+](C)CC[C@H]1CCCC1(F)F)NC(=O)C1(N(C)C)CCC1 ZINC001406599600 1367780804 /nfs/dbraw/zinc/78/08/04/1367780804.db2.gz FXBITKRVIPVJGU-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[N@H+](C)CC[C@H]1CCCC1(F)F)NC(=O)C1(N(C)C)CCC1 ZINC001406599615 1367780856 /nfs/dbraw/zinc/78/08/56/1367780856.db2.gz FXBITKRVIPVJGU-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC[C@H]1CCCC1(F)F)NC(=O)C1(N(C)C)CCC1 ZINC001406599615 1367780858 /nfs/dbraw/zinc/78/08/58/1367780858.db2.gz FXBITKRVIPVJGU-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)Cc1ccc(CN(C)C[C@H](C)NC(=O)[C@H]2CC[N@H+](C)C2)cc1 ZINC001406697287 1367939493 /nfs/dbraw/zinc/93/94/93/1367939493.db2.gz HINUPZZMVDMYOZ-PXNSSMCTSA-N 1 3 345.531 2.773 10 0 EFAEHO CC(C)Cc1ccc(CN(C)C[C@H](C)NC(=O)[C@H]2CC[N@@H+](C)C2)cc1 ZINC001406697287 1367939497 /nfs/dbraw/zinc/93/94/97/1367939497.db2.gz HINUPZZMVDMYOZ-PXNSSMCTSA-N 1 3 345.531 2.773 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001406699307 1367944550 /nfs/dbraw/zinc/94/45/50/1367944550.db2.gz RNRMROPNJMFYHC-OCCSQVGLSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001406699307 1367944554 /nfs/dbraw/zinc/94/45/54/1367944554.db2.gz RNRMROPNJMFYHC-OCCSQVGLSA-N 1 3 342.434 2.523 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@H+](C)CC1CC2(CCC2)C1 ZINC001406712770 1367963368 /nfs/dbraw/zinc/96/33/68/1367963368.db2.gz FAJMEMWUUGDMKD-WMZOPIPTSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001406712770 1367963372 /nfs/dbraw/zinc/96/33/72/1367963372.db2.gz FAJMEMWUUGDMKD-WMZOPIPTSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC001406712915 1367963480 /nfs/dbraw/zinc/96/34/80/1367963480.db2.gz FHXSMBSSMJIHHU-KXBFYZLASA-N 1 3 349.494 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC001406712915 1367963485 /nfs/dbraw/zinc/96/34/85/1367963485.db2.gz FHXSMBSSMJIHHU-KXBFYZLASA-N 1 3 349.494 2.980 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)CC1CC2(CCC2)C1 ZINC001406712759 1367963914 /nfs/dbraw/zinc/96/39/14/1367963914.db2.gz FAJMEMWUUGDMKD-FUHWJXTLSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001406712759 1367963921 /nfs/dbraw/zinc/96/39/21/1367963921.db2.gz FAJMEMWUUGDMKD-FUHWJXTLSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(CC(=O)N[C@H]1CCCC[C@H]1C[NH2+]Cc1ccsc1)C1CCC1 ZINC001406720806 1367969925 /nfs/dbraw/zinc/96/99/25/1367969925.db2.gz PCLQFXBJIREXMI-WMZOPIPTSA-N 1 3 349.544 2.997 10 0 EFAEHO CCC(CC)C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)C[C@H]1CC ZINC001406803802 1368075580 /nfs/dbraw/zinc/07/55/80/1368075580.db2.gz HOAPYLRIGOZUNL-QZTJIDSGSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN2CCCC2)CC[C@H]1[NH2+]C/C(Cl)=C/Cl ZINC001406806524 1368079048 /nfs/dbraw/zinc/07/90/48/1368079048.db2.gz KMIOHNGNAPEFMZ-TWBVXLPBSA-N 1 3 348.318 2.618 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@H]1CC[N@@H+]1CC1CCCCCC1 ZINC001406836855 1368111559 /nfs/dbraw/zinc/11/15/59/1368111559.db2.gz STEWUTOPEWWEHC-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@H]1CC[N@H+]1CC1CCCCCC1 ZINC001406836855 1368111564 /nfs/dbraw/zinc/11/15/64/1368111564.db2.gz STEWUTOPEWWEHC-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)NC[C@H]1CCCN1CCCF ZINC001437673912 1387923935 /nfs/dbraw/zinc/92/39/35/1387923935.db2.gz OOXCXPNKKUVOTH-MRXNPFEDSA-N 1 3 327.488 2.580 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)NC[C@H]1CCCN1CCCF ZINC001437673912 1387923941 /nfs/dbraw/zinc/92/39/41/1387923941.db2.gz OOXCXPNKKUVOTH-MRXNPFEDSA-N 1 3 327.488 2.580 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)[C@@H](C)c1cccc(OC)c1 ZINC001492956704 1368169951 /nfs/dbraw/zinc/16/99/51/1368169951.db2.gz MGCXSOZVLVZPDE-FRQCXROJSA-N 1 3 347.503 2.535 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)[C@@H](C)c1cccc(OC)c1 ZINC001492956704 1368169953 /nfs/dbraw/zinc/16/99/53/1368169953.db2.gz MGCXSOZVLVZPDE-FRQCXROJSA-N 1 3 347.503 2.535 10 0 EFAEHO CCC(CC)C[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001406961213 1368251905 /nfs/dbraw/zinc/25/19/05/1368251905.db2.gz RIOGZIHLLHIRIA-LJQANCHMSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@H](F)C[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)C1(N(C)C)CCC1 ZINC001407009807 1368318265 /nfs/dbraw/zinc/31/82/65/1368318265.db2.gz UHNZXZUPIHQKSZ-XYTVBORESA-N 1 3 339.499 2.721 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CC[C@@]2(C1)CCCN(C[C@H](F)CC)C2 ZINC001407026171 1368342501 /nfs/dbraw/zinc/34/25/01/1368342501.db2.gz UNZRKEATRXSZQY-MJGOQNOKSA-N 1 3 341.515 2.781 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CC[C@@]2(C1)CCCN(C[C@H](F)CC)C2 ZINC001407026171 1368342507 /nfs/dbraw/zinc/34/25/07/1368342507.db2.gz UNZRKEATRXSZQY-MJGOQNOKSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)CC[N@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001407025702 1368342544 /nfs/dbraw/zinc/34/25/44/1368342544.db2.gz WPBGGXQDNIZLRO-LJQANCHMSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)CC[N@@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001407025702 1368342549 /nfs/dbraw/zinc/34/25/49/1368342549.db2.gz WPBGGXQDNIZLRO-LJQANCHMSA-N 1 3 335.536 2.830 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001407104336 1368428796 /nfs/dbraw/zinc/42/87/96/1368428796.db2.gz HEYNJJCZINCXQB-AEFFLSMTSA-N 1 3 347.503 2.677 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[NH2+]CC1CCC2(CC2)CC1 ZINC001407105969 1368431916 /nfs/dbraw/zinc/43/19/16/1368431916.db2.gz MCRZZFNMCNENQF-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@]2(CC[N@H+](CCC3CC3)C2)C1 ZINC001407158705 1368514628 /nfs/dbraw/zinc/51/46/28/1368514628.db2.gz AGELHSANUIWYIG-HXUWFJFHSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@]2(CC[N@@H+](CCC3CC3)C2)C1 ZINC001407158705 1368514636 /nfs/dbraw/zinc/51/46/36/1368514636.db2.gz AGELHSANUIWYIG-HXUWFJFHSA-N 1 3 335.536 2.831 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@]1(C)CCN(Cc2ccccc2)C1 ZINC001407170153 1368531275 /nfs/dbraw/zinc/53/12/75/1368531275.db2.gz CBLURTJZSAYPKV-AZUAARDMSA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@]1(C)CCN(Cc2ccccc2)C1 ZINC001407170153 1368531282 /nfs/dbraw/zinc/53/12/82/1368531282.db2.gz CBLURTJZSAYPKV-AZUAARDMSA-N 1 3 329.488 2.642 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@]1(C)CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001407175665 1368544429 /nfs/dbraw/zinc/54/44/29/1368544429.db2.gz JLXKXJPTUOAJFL-HXUWFJFHSA-N 1 3 329.488 2.596 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2ccc(C)cc2)C1)N(C)C ZINC001407224368 1368609843 /nfs/dbraw/zinc/60/98/43/1368609843.db2.gz ACLJFNVLFBUUCI-QUCCMNQESA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2ccc(C)cc2)C1)N(C)C ZINC001407224374 1368610268 /nfs/dbraw/zinc/61/02/68/1368610268.db2.gz ACLJFNVLFBUUCI-UYAOXDASSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001407253236 1368656318 /nfs/dbraw/zinc/65/63/18/1368656318.db2.gz YFJNWACVOPPASR-CTNGQTDRSA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@](C)(C[NH2+]CC2CC(C)(C)C2)C1)N(C)C ZINC001407258083 1368662736 /nfs/dbraw/zinc/66/27/36/1368662736.db2.gz GXRVGHMESHVBTA-FXAWDEMLSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@](C)(C[NH2+]CC2CC(C)(C)C2)C1)N(C)C ZINC001407258089 1368662803 /nfs/dbraw/zinc/66/28/03/1368662803.db2.gz GXRVGHMESHVBTA-PXNSSMCTSA-N 1 3 337.552 2.837 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@]1(C)CCC[N@@H+](CCCC(C)C)C1 ZINC001407317266 1368762171 /nfs/dbraw/zinc/76/21/71/1368762171.db2.gz WYACJILUBJMRMG-LJQANCHMSA-N 1 3 334.508 2.915 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@]1(C)CCC[N@H+](CCCC(C)C)C1 ZINC001407317266 1368762173 /nfs/dbraw/zinc/76/21/73/1368762173.db2.gz WYACJILUBJMRMG-LJQANCHMSA-N 1 3 334.508 2.915 10 0 EFAEHO C[C@@H](NC1(CNC(=O)CC[NH+](C)C)CCCC1)c1ccccc1F ZINC001407471337 1368891641 /nfs/dbraw/zinc/89/16/41/1368891641.db2.gz KKEHFNHNTHQEPH-OAHLLOKOSA-N 1 3 335.467 2.857 10 0 EFAEHO CN(CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)C1CCC1 ZINC001407485320 1368902508 /nfs/dbraw/zinc/90/25/08/1368902508.db2.gz ZXSBFEOFOGXTRC-NSHGMRRFSA-N 1 3 341.499 2.640 10 0 EFAEHO CN(CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)C1CCC1 ZINC001407485320 1368902511 /nfs/dbraw/zinc/90/25/11/1368902511.db2.gz ZXSBFEOFOGXTRC-NSHGMRRFSA-N 1 3 341.499 2.640 10 0 EFAEHO CC[NH2+][C@H](CNC(=O)CN(C)CC(C)(C)C)c1ccccc1CC ZINC001407511110 1368924838 /nfs/dbraw/zinc/92/48/38/1368924838.db2.gz MLNUILXRHBJBIU-GOSISDBHSA-N 1 3 333.520 2.994 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cs1 ZINC001407529381 1368944792 /nfs/dbraw/zinc/94/47/92/1368944792.db2.gz FNFKUADZPKELGH-WMLDXEAASA-N 1 3 337.533 2.581 10 0 EFAEHO C[C@@H]([NH2+]CCC1CCCCC1)[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001407535432 1368953727 /nfs/dbraw/zinc/95/37/27/1368953727.db2.gz GLGJLVRGDJBGAM-MJGOQNOKSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)N(C)C ZINC001407539085 1368957710 /nfs/dbraw/zinc/95/77/10/1368957710.db2.gz YDBCYETXNOCPAV-IYWMVGAKSA-N 1 3 343.515 2.886 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)N(C)C ZINC001407539085 1368957714 /nfs/dbraw/zinc/95/77/14/1368957714.db2.gz YDBCYETXNOCPAV-IYWMVGAKSA-N 1 3 343.515 2.886 10 0 EFAEHO CC[N@H+](CCNC(=O)C1(N(C)C)CCC1)CC[C@H]1CCCC1(F)F ZINC001492964932 1368985636 /nfs/dbraw/zinc/98/56/36/1368985636.db2.gz GCUZEMGEUIMXFD-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[N@@H+](CCNC(=O)C1(N(C)C)CCC1)CC[C@H]1CCCC1(F)F ZINC001492964932 1368985638 /nfs/dbraw/zinc/98/56/38/1368985638.db2.gz GCUZEMGEUIMXFD-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@H]1CC[C@H](CNC(=O)Cc2nc[nH]c2C)CC1 ZINC001407562902 1368991358 /nfs/dbraw/zinc/99/13/58/1368991358.db2.gz OAYROYVNVSZJFE-DJIMGWMZSA-N 1 3 334.508 2.819 10 0 EFAEHO CC[C@@H](F)CN1CCC2(CN(C(=O)[C@H](CC)[NH+](CC)CC)C2)CC1 ZINC001407714779 1369152178 /nfs/dbraw/zinc/15/21/78/1369152178.db2.gz IZQJNIGGHBXJKT-SJORKVTESA-N 1 3 341.515 2.779 10 0 EFAEHO CCCC[N@@H+]1CCc2c(CNC(=O)CN(C)C3CCC3)cccc2C1 ZINC001407745564 1369185482 /nfs/dbraw/zinc/18/54/82/1369185482.db2.gz CGRGYWYJYJITPG-UHFFFAOYSA-N 1 3 343.515 2.945 10 0 EFAEHO CCCC[N@H+]1CCc2c(CNC(=O)CN(C)C3CCC3)cccc2C1 ZINC001407745564 1369185489 /nfs/dbraw/zinc/18/54/89/1369185489.db2.gz CGRGYWYJYJITPG-UHFFFAOYSA-N 1 3 343.515 2.945 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@@H](NC(=O)CCC[NH+]2CCCC2)CC1 ZINC001407883267 1369346115 /nfs/dbraw/zinc/34/61/15/1369346115.db2.gz IDPDEKSFNFGHHR-IAGOWNOFSA-N 1 3 327.488 2.581 10 0 EFAEHO CN(CCC[N@H+](C)C[C@@H]1CC[C@H]2C[C@H]2C1)C(=O)CN(C)C1CCC1 ZINC001407917602 1369396145 /nfs/dbraw/zinc/39/61/45/1369396145.db2.gz NIXMOZWGLOEWEM-FGTMMUONSA-N 1 3 335.536 2.687 10 0 EFAEHO CN(CCC[N@@H+](C)C[C@@H]1CC[C@H]2C[C@H]2C1)C(=O)CN(C)C1CCC1 ZINC001407917602 1369396151 /nfs/dbraw/zinc/39/61/51/1369396151.db2.gz NIXMOZWGLOEWEM-FGTMMUONSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@H+](C)CC1CCC(C)CC1 ZINC001407958300 1369462332 /nfs/dbraw/zinc/46/23/32/1369462332.db2.gz UQXGBZXURMJQOQ-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)CC1CCC(C)CC1 ZINC001407958300 1369462337 /nfs/dbraw/zinc/46/23/37/1369462337.db2.gz UQXGBZXURMJQOQ-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(CC)([NH2+]C/C=C/Cl)CC1 ZINC001408003497 1369516994 /nfs/dbraw/zinc/51/69/94/1369516994.db2.gz PSQBYPLLZWOQEB-AYAUWGRQSA-N 1 3 341.927 2.974 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@]2(CCN(CCC(F)(F)F)C2)C1 ZINC001408010139 1369524945 /nfs/dbraw/zinc/52/49/45/1369524945.db2.gz KNNLDRUSQACBCQ-MRXNPFEDSA-N 1 3 349.441 2.595 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CCC(C)(C)C)CC1(C)C ZINC001408146667 1369645348 /nfs/dbraw/zinc/64/53/48/1369645348.db2.gz QUWRDQXBPPUOIX-INIZCTEOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CCC(C)(C)C)CC1(C)C ZINC001408146667 1369645341 /nfs/dbraw/zinc/64/53/41/1369645341.db2.gz QUWRDQXBPPUOIX-INIZCTEOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)C[C@@H]1C ZINC001408188539 1369695359 /nfs/dbraw/zinc/69/53/59/1369695359.db2.gz QIFITRLCTSTSFV-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)C[C@@H]1C ZINC001408188539 1369695368 /nfs/dbraw/zinc/69/53/68/1369695368.db2.gz QIFITRLCTSTSFV-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cccc(Cl)c1 ZINC001408211097 1369717108 /nfs/dbraw/zinc/71/71/08/1369717108.db2.gz CNSVCONWYWQFRI-GJZGRUSLSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+][C@@H](C)c1ccc(F)c(F)c1)N(C)C ZINC001408214054 1369720074 /nfs/dbraw/zinc/72/00/74/1369720074.db2.gz YTJKFXZKCWABPY-GDZNZVCISA-N 1 3 341.446 2.850 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1CC[C@@H](C)C1)C[C@H]1CCC(F)(F)C1 ZINC001437763000 1388034333 /nfs/dbraw/zinc/03/43/33/1388034333.db2.gz WQTUBHKPXMDHQR-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1CC[C@@H](C)C1)C[C@H]1CCC(F)(F)C1 ZINC001437763000 1388034341 /nfs/dbraw/zinc/03/43/41/1388034341.db2.gz WQTUBHKPXMDHQR-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO COC(=O)[C@@H]1CCCC[C@@H]1CN1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC001414040947 1370034535 /nfs/dbraw/zinc/03/45/35/1370034535.db2.gz YDWOBIWQAFMKIC-JFIYKMOQSA-N 1 3 331.460 2.572 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)N(C)C)cc1 ZINC001417600542 1373081462 /nfs/dbraw/zinc/08/14/62/1373081462.db2.gz SWYOKTXRKXKDRS-OTWHNJEPSA-N 1 3 331.504 2.698 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)N(C)C)cc1 ZINC001417600542 1373081464 /nfs/dbraw/zinc/08/14/64/1373081464.db2.gz SWYOKTXRKXKDRS-OTWHNJEPSA-N 1 3 331.504 2.698 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@H](C(=O)N3CCN(CC4CCCCC4)CC3)C[N@@H+]2C1 ZINC001417621429 1373100822 /nfs/dbraw/zinc/10/08/22/1373100822.db2.gz KLXBZHLINMXBMT-YZGWKJHDSA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@H](C(=O)N3CCN(CC4CCCCC4)CC3)C[N@H+]2C1 ZINC001417621429 1373100825 /nfs/dbraw/zinc/10/08/25/1373100825.db2.gz KLXBZHLINMXBMT-YZGWKJHDSA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21)N(C)Cc1ccccc1 ZINC001417643810 1373118278 /nfs/dbraw/zinc/11/82/78/1373118278.db2.gz IBQXMYLXORGXSX-QRQLOZEOSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21)N(C)Cc1ccccc1 ZINC001417643810 1373118283 /nfs/dbraw/zinc/11/82/83/1373118283.db2.gz IBQXMYLXORGXSX-QRQLOZEOSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2cccc(F)c2)C1 ZINC001417777854 1373243593 /nfs/dbraw/zinc/24/35/93/1373243593.db2.gz MVTSXDUDQKBEFK-LFEHRJTNSA-N 1 3 347.478 2.683 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001417800488 1373269073 /nfs/dbraw/zinc/26/90/73/1373269073.db2.gz WFPZCQBDBDAYIR-VDGAXYAQSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[C@@H]([NH2+]CC2CCCC2)C1)N1CCCC1 ZINC001417806950 1373277299 /nfs/dbraw/zinc/27/72/99/1373277299.db2.gz CJBLAFOOTJBZAQ-ZWKOTPCHSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H]1CC[C@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001417816377 1373288142 /nfs/dbraw/zinc/28/81/42/1373288142.db2.gz QJVKJZYMRCJQBR-IMFGXOCKSA-N 1 3 343.515 2.711 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@H+](CCC(C)C)[C@H]2C1(C)C ZINC001417821060 1373293235 /nfs/dbraw/zinc/29/32/35/1373293235.db2.gz HFXPEYGMXJMOAN-QXAKKESOSA-N 1 3 337.552 2.980 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@@H+](CCC(C)C)[C@H]2C1(C)C ZINC001417821060 1373293238 /nfs/dbraw/zinc/29/32/38/1373293238.db2.gz HFXPEYGMXJMOAN-QXAKKESOSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CC1CCCC1 ZINC001417823801 1373298887 /nfs/dbraw/zinc/29/88/87/1373298887.db2.gz STWCUYVYDPYUEC-HAGHYFMRSA-N 1 3 347.547 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CC1CCCC1 ZINC001417823801 1373298890 /nfs/dbraw/zinc/29/88/90/1373298890.db2.gz STWCUYVYDPYUEC-HAGHYFMRSA-N 1 3 347.547 2.686 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2C[N@@H+](CC3CCC(C)CC3)CC[C@@H]2C1 ZINC001417841975 1373324291 /nfs/dbraw/zinc/32/42/91/1373324291.db2.gz OSKICOOBMYQHKY-TUNPWDSISA-N 1 3 349.563 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2C[N@H+](CC3CCC(C)CC3)CC[C@@H]2C1 ZINC001417841975 1373324295 /nfs/dbraw/zinc/32/42/95/1373324295.db2.gz OSKICOOBMYQHKY-TUNPWDSISA-N 1 3 349.563 2.935 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@@H]2CC[N@H+](CCCC(C)(C)C)C2)C1 ZINC001437942066 1388256185 /nfs/dbraw/zinc/25/61/85/1388256185.db2.gz QOWKIGWUVYOXBM-ZWKOTPCHSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@@H]2CC[N@@H+](CCCC(C)(C)C)C2)C1 ZINC001437942066 1388256189 /nfs/dbraw/zinc/25/61/89/1388256189.db2.gz QOWKIGWUVYOXBM-ZWKOTPCHSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CCC2CC2)[C@@H]1C)N1CCCCC1 ZINC001417851506 1373336674 /nfs/dbraw/zinc/33/66/74/1373336674.db2.gz PJMACEBQUVOMQG-NEWSRXKRSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CCC2CC2)[C@@H]1C)N1CCCCC1 ZINC001417851506 1373336679 /nfs/dbraw/zinc/33/66/79/1373336679.db2.gz PJMACEBQUVOMQG-NEWSRXKRSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@@H](F)C[N@H+]1CC[C@H](NC(=O)CN(C)C(C)C)CC(C)(C)C1 ZINC001417862878 1373355230 /nfs/dbraw/zinc/35/52/30/1373355230.db2.gz LKCFXTNWBIIWNT-CVEARBPZSA-N 1 3 329.504 2.682 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1CC[C@H](NC(=O)CN(C)C(C)C)CC(C)(C)C1 ZINC001417862878 1373355225 /nfs/dbraw/zinc/35/52/25/1373355225.db2.gz LKCFXTNWBIIWNT-CVEARBPZSA-N 1 3 329.504 2.682 10 0 EFAEHO CC[C@H](F)C[N@@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)CC(C)(C)C1 ZINC001417862881 1373355945 /nfs/dbraw/zinc/35/59/45/1373355945.db2.gz LKCFXTNWBIIWNT-JKSUJKDBSA-N 1 3 329.504 2.682 10 0 EFAEHO CC[C@H](F)C[N@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)CC(C)(C)C1 ZINC001417862881 1373355951 /nfs/dbraw/zinc/35/59/51/1373355951.db2.gz LKCFXTNWBIIWNT-JKSUJKDBSA-N 1 3 329.504 2.682 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1c(C)cccc1C)C1CC1)N(C)C ZINC001417982607 1373483673 /nfs/dbraw/zinc/48/36/73/1373483673.db2.gz JPFHVOIWRMLQNT-RBUKOAKNSA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1ccccc1)C1CC1 ZINC001417981587 1373483981 /nfs/dbraw/zinc/48/39/81/1373483981.db2.gz YOGKYWWDGZXAHX-RBUKOAKNSA-N 1 3 329.488 2.544 10 0 EFAEHO CN(CC(=O)NC[C@H]([NH2+]Cc1ccsc1)C1CC1)CC(C)(C)C ZINC001417994395 1373498817 /nfs/dbraw/zinc/49/88/17/1373498817.db2.gz DMVUNAXGECETGN-INIZCTEOSA-N 1 3 337.533 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@H+](C)CC2CC(F)(F)C2)C1 ZINC001418021331 1373532953 /nfs/dbraw/zinc/53/29/53/1373532953.db2.gz LEVRCNCFPQPDQL-HNNXBMFYSA-N 1 3 345.478 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@@H+](C)CC2CC(F)(F)C2)C1 ZINC001418021331 1373532959 /nfs/dbraw/zinc/53/29/59/1373532959.db2.gz LEVRCNCFPQPDQL-HNNXBMFYSA-N 1 3 345.478 2.542 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@H]1CCCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001418020971 1373533547 /nfs/dbraw/zinc/53/35/47/1373533547.db2.gz MFJNRYOSKDHURG-RTBURBONSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@H]1CCCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001418020971 1373533552 /nfs/dbraw/zinc/53/35/52/1373533552.db2.gz MFJNRYOSKDHURG-RTBURBONSA-N 1 3 337.552 2.935 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H](C[N@H+](C)C/C=C/Cl)C1 ZINC001418023321 1373537271 /nfs/dbraw/zinc/53/72/71/1373537271.db2.gz VYRFDVWJRBADTG-FEPMCFLQSA-N 1 3 347.906 2.589 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H](C[N@@H+](C)C/C=C/Cl)C1 ZINC001418023321 1373537272 /nfs/dbraw/zinc/53/72/72/1373537272.db2.gz VYRFDVWJRBADTG-FEPMCFLQSA-N 1 3 347.906 2.589 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@H](NCc2cc(Cl)cc(Cl)c2)C1 ZINC001418043511 1373556592 /nfs/dbraw/zinc/55/65/92/1373556592.db2.gz GTVWLHDQLQRCTC-HNNXBMFYSA-N 1 3 344.286 2.636 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H]([NH2+]C/C=C/c2ccc(Cl)cc2)C1 ZINC001418045217 1373557284 /nfs/dbraw/zinc/55/72/84/1373557284.db2.gz VFCBNRKJYKGTLF-WHLIDYPQSA-N 1 3 347.890 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@H](C)c2ccc(F)c(F)c2)C1 ZINC001418078164 1373582273 /nfs/dbraw/zinc/58/22/73/1373582273.db2.gz RVJCZNGVQZDZSW-BPLDGKMQSA-N 1 3 339.430 2.603 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@@H]2CCCc3ccccc32)C1 ZINC001418078092 1373582528 /nfs/dbraw/zinc/58/25/28/1373582528.db2.gz PGECYDYKPRFECM-ZHALLVOQSA-N 1 3 329.488 2.641 10 0 EFAEHO CC(C)Oc1ccccc1C[NH2+][C@H]1C[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001418078625 1373583579 /nfs/dbraw/zinc/58/35/79/1373583579.db2.gz WYJFDNHAVMQOMQ-IYARVYRRSA-N 1 3 347.503 2.551 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@H]2CN(C/C=C\Cl)CC[C@@H]21 ZINC001418082935 1373590534 /nfs/dbraw/zinc/59/05/34/1373590534.db2.gz PYWJAEOWTWMVOZ-BRLJPEOMSA-N 1 3 341.927 2.784 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@H]2CN(C/C=C\Cl)CC[C@@H]21 ZINC001418082935 1373590537 /nfs/dbraw/zinc/59/05/37/1373590537.db2.gz PYWJAEOWTWMVOZ-BRLJPEOMSA-N 1 3 341.927 2.784 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc3c(c2)CCC3)C1 ZINC001418110018 1373613541 /nfs/dbraw/zinc/61/35/41/1373613541.db2.gz XPVQWHAAUBHCSP-RYGJVYDSSA-N 1 3 343.515 2.815 10 0 EFAEHO CC[C@H](F)CN1CCC[C@H](CNC(=O)C(C)(C)[NH+]2CCCCC2)C1 ZINC001418117564 1373623676 /nfs/dbraw/zinc/62/36/76/1373623676.db2.gz BMNRDLJEUWBBJG-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CCC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001418131865 1373655644 /nfs/dbraw/zinc/65/56/44/1373655644.db2.gz BPPLWVCDEPGELT-QGZVFWFLSA-N 1 3 335.536 2.737 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CCC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001418131865 1373655649 /nfs/dbraw/zinc/65/56/49/1373655649.db2.gz BPPLWVCDEPGELT-QGZVFWFLSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001418169787 1373720783 /nfs/dbraw/zinc/72/07/83/1373720783.db2.gz UFFAIFIRIBYIPI-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1[C@H]2C[N@@H+]([C@H](C)c3cc(C)ccc3C)C[C@H]21)N(C)C ZINC001418179775 1373741368 /nfs/dbraw/zinc/74/13/68/1373741368.db2.gz CYAASWROINUSEO-PKOFMYQESA-N 1 3 343.515 2.751 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1[C@H]2C[N@H+]([C@H](C)c3cc(C)ccc3C)C[C@H]21)N(C)C ZINC001418179775 1373741373 /nfs/dbraw/zinc/74/13/73/1373741373.db2.gz CYAASWROINUSEO-PKOFMYQESA-N 1 3 343.515 2.751 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]Cc2ccc(C)cc2)CC1)N(C)C ZINC001418189165 1373753121 /nfs/dbraw/zinc/75/31/21/1373753121.db2.gz MDIIZXAMOREQBG-CTWPCTMYSA-N 1 3 331.504 2.852 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001418221903 1373777051 /nfs/dbraw/zinc/77/70/51/1373777051.db2.gz OLHXENCCGOQMMG-WMZOPIPTSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)c1cccc(CN[C@@H](C)CNC(=O)[C@H]2CCC[N@@H+]2C(C)C)n1 ZINC001418221676 1373777280 /nfs/dbraw/zinc/77/72/80/1373777280.db2.gz OBRWTIGJJKPWDT-QFBILLFUSA-N 1 3 346.519 2.672 10 0 EFAEHO CC(C)c1cccc(CN[C@@H](C)CNC(=O)[C@H]2CCC[N@H+]2C(C)C)n1 ZINC001418221676 1373777286 /nfs/dbraw/zinc/77/72/86/1373777286.db2.gz OBRWTIGJJKPWDT-QFBILLFUSA-N 1 3 346.519 2.672 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001418228945 1373785200 /nfs/dbraw/zinc/78/52/00/1373785200.db2.gz IPCVWJXDVAZZSD-WMZOPIPTSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+][C@@H](C)CNC(=O)CN(C)C2CCC2)c1 ZINC001418234940 1373789780 /nfs/dbraw/zinc/78/97/80/1373789780.db2.gz MFMBMMYHWKUTNE-IRXDYDNUSA-N 1 3 331.504 2.943 10 0 EFAEHO C[C@H](CNC(=O)CC[NH+](C)C)NC1c2ccccc2-c2ccccc21 ZINC001418269679 1373838723 /nfs/dbraw/zinc/83/87/23/1373838723.db2.gz RKGQRHIGEFCUSZ-OAHLLOKOSA-N 1 3 337.467 2.802 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+][C@H]1CCc2ccccc21 ZINC001418277580 1373850059 /nfs/dbraw/zinc/85/00/59/1373850059.db2.gz XMUMSZPIRKQKAF-QAPCUYQASA-N 1 3 331.504 2.746 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001418314730 1373894145 /nfs/dbraw/zinc/89/41/45/1373894145.db2.gz BEQOKUCSMHAMLC-CRAIPNDOSA-N 1 3 343.471 2.902 10 0 EFAEHO Cc1ccc(CN[C@H]2CCN(C(=O)C3(C[NH+](C)C)CC3)C2)c(Cl)c1 ZINC001418331300 1373912117 /nfs/dbraw/zinc/91/21/17/1373912117.db2.gz ODXPOBUJHCJTDX-INIZCTEOSA-N 1 3 349.906 2.681 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H]1CCC[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001418361980 1373934774 /nfs/dbraw/zinc/93/47/74/1373934774.db2.gz SRTUDAIXRPVMKK-RBUKOAKNSA-N 1 3 349.494 2.991 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1csc(C)c1 ZINC001418442155 1374032089 /nfs/dbraw/zinc/03/20/89/1374032089.db2.gz MJEKSIMRZGTJNL-RHSMWYFYSA-N 1 3 337.533 2.915 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H](C(C)C)[NH+]2CCCC2)cc1C ZINC001418525635 1374134884 /nfs/dbraw/zinc/13/48/84/1374134884.db2.gz ILVKUZIFUCIQJX-HXUWFJFHSA-N 1 3 345.531 2.972 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21)Cc1ccc(F)cc1 ZINC001418571338 1374202326 /nfs/dbraw/zinc/20/23/26/1374202326.db2.gz VOCOGRREHCTTCX-MOPGFXCFSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21)Cc1ccc(F)cc1 ZINC001418571338 1374202331 /nfs/dbraw/zinc/20/23/31/1374202331.db2.gz VOCOGRREHCTTCX-MOPGFXCFSA-N 1 3 347.478 2.781 10 0 EFAEHO CN(C[C@@H]1CCN1Cc1ccccc1C1CC1)C(=O)CC[NH+](C)C ZINC001418591100 1374236605 /nfs/dbraw/zinc/23/66/05/1374236605.db2.gz BEDZNKVCZSNPNE-SFHVURJKSA-N 1 3 329.488 2.548 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C[C@H]1CCN1CCC1CC1)[NH+]1CCCCC1 ZINC001418599745 1374250417 /nfs/dbraw/zinc/25/04/17/1374250417.db2.gz IZHLWDXXJBCVLJ-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO Cc1ccc(C)c(C[N@H+]2CC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001418674986 1374352755 /nfs/dbraw/zinc/35/27/55/1374352755.db2.gz RNNXSCYYJPNXHX-HKUYNNGSSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+]2CC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001418674986 1374352758 /nfs/dbraw/zinc/35/27/58/1374352758.db2.gz RNNXSCYYJPNXHX-HKUYNNGSSA-N 1 3 343.515 2.583 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1 ZINC001418701162 1374386575 /nfs/dbraw/zinc/38/65/75/1374386575.db2.gz VIXSJICXHPGFPO-SFHVURJKSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+](CC2CCC3(CC3)CC2)C1 ZINC001418701162 1374386579 /nfs/dbraw/zinc/38/65/79/1374386579.db2.gz VIXSJICXHPGFPO-SFHVURJKSA-N 1 3 335.536 2.735 10 0 EFAEHO CCCN(CCNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)Cc1ccsc1 ZINC001418723436 1374416039 /nfs/dbraw/zinc/41/60/39/1374416039.db2.gz DTIZIKDZWBUMBJ-RDJZCZTQSA-N 1 3 337.533 2.807 10 0 EFAEHO CCCN(CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)Cc1ccsc1 ZINC001418723436 1374416042 /nfs/dbraw/zinc/41/60/42/1374416042.db2.gz DTIZIKDZWBUMBJ-RDJZCZTQSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)C2(C[NH+](C)C)CC2)CCN1Cc1csc(C)c1 ZINC001418753267 1374460287 /nfs/dbraw/zinc/46/02/87/1374460287.db2.gz AYVDMBDQOAEYGG-DLBZAZTESA-N 1 3 349.544 2.867 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CCC[NH+]2CCCC2)CCN1CCC(F)(F)F ZINC001418762111 1374471597 /nfs/dbraw/zinc/47/15/97/1374471597.db2.gz ZOMURWPGMOJIBQ-LSDHHAIUSA-N 1 3 349.441 2.784 10 0 EFAEHO CCc1ccc(CN2CC[C@H](NC(=O)C3(C[NH+](C)C)CC3)[C@H]2C)cc1 ZINC001418803170 1374523215 /nfs/dbraw/zinc/52/32/15/1374523215.db2.gz QFJAKIRENQXAHK-APWZRJJASA-N 1 3 343.515 2.670 10 0 EFAEHO CC[C@@H](F)CN1CC[C@@H](NC(=O)CCC[NH+](C)C)CC(C)(C)C1 ZINC001418824459 1374546612 /nfs/dbraw/zinc/54/66/12/1374546612.db2.gz JXANYXKAJSRHMN-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@H](NCCN(C)C(=O)C[C@@H]1CC[N@H+](C)C1)c1ccccc1Cl ZINC001418825766 1374547465 /nfs/dbraw/zinc/54/74/65/1374547465.db2.gz HHYUCDMHXOABFM-GJZGRUSLSA-N 1 3 337.895 2.791 10 0 EFAEHO C[C@H](NCCN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1)c1ccccc1Cl ZINC001418825766 1374547467 /nfs/dbraw/zinc/54/74/67/1374547467.db2.gz HHYUCDMHXOABFM-GJZGRUSLSA-N 1 3 337.895 2.791 10 0 EFAEHO C[C@H](F)CC[N@H+](C)C[C@@H]1CCCCN1C(=O)CN1CCC(C)CC1 ZINC001418829351 1374551657 /nfs/dbraw/zinc/55/16/57/1374551657.db2.gz WLLOGOHUZPCNOE-ROUUACIJSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)C[C@@H]1CCCCN1C(=O)CN1CCC(C)CC1 ZINC001418829351 1374551659 /nfs/dbraw/zinc/55/16/59/1374551659.db2.gz WLLOGOHUZPCNOE-ROUUACIJSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@@H]([NH2+]C/C(Cl)=C/Cl)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001418843067 1374565198 /nfs/dbraw/zinc/56/51/98/1374565198.db2.gz LJLLVXMVLOTDLS-NWFCWYBLSA-N 1 3 348.318 2.618 10 0 EFAEHO C[C@H]([NH2+]C/C(Cl)=C/Cl)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001418843069 1374565297 /nfs/dbraw/zinc/56/52/97/1374565297.db2.gz LJLLVXMVLOTDLS-OJNRTJSBSA-N 1 3 348.318 2.618 10 0 EFAEHO C[C@H](F)CC[NH2+][C@@H](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001418844109 1374567058 /nfs/dbraw/zinc/56/70/58/1374567058.db2.gz JJDOLRUCIFLJDP-HOTGVXAUSA-N 1 3 343.531 2.929 10 0 EFAEHO CCCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@H+](CCC)C1 ZINC001418873154 1374606352 /nfs/dbraw/zinc/60/63/52/1374606352.db2.gz ILXPKYPMSGABDG-APWZRJJASA-N 1 3 341.515 2.922 10 0 EFAEHO CCCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@@H+](CCC)C1 ZINC001418873154 1374606356 /nfs/dbraw/zinc/60/63/56/1374606356.db2.gz ILXPKYPMSGABDG-APWZRJJASA-N 1 3 341.515 2.922 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@H+](C[C@@H]2CCC(F)(F)C2)C1)N(C)C ZINC001438029600 1388328641 /nfs/dbraw/zinc/32/86/41/1388328641.db2.gz POGMSLGLLNLKDK-OWCLPIDISA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@@H+](C[C@@H]2CCC(F)(F)C2)C1)N(C)C ZINC001438029600 1388328647 /nfs/dbraw/zinc/32/86/47/1388328647.db2.gz POGMSLGLLNLKDK-OWCLPIDISA-N 1 3 345.478 2.589 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001418909745 1374675487 /nfs/dbraw/zinc/67/54/87/1374675487.db2.gz AHXDVIUYLDQGPW-FUHWJXTLSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001418909745 1374675491 /nfs/dbraw/zinc/67/54/91/1374675491.db2.gz AHXDVIUYLDQGPW-FUHWJXTLSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2ccccc2C)C1)N(C)C ZINC001418917585 1374683544 /nfs/dbraw/zinc/68/35/44/1374683544.db2.gz ZYISXIKADZQVHR-IEBWSBKVSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2ccccc2C)C1)N(C)C ZINC001418917585 1374683550 /nfs/dbraw/zinc/68/35/50/1374683550.db2.gz ZYISXIKADZQVHR-IEBWSBKVSA-N 1 3 331.504 2.663 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCC1CN([C@@H]2CCc3ccccc32)C1 ZINC001419020651 1374768586 /nfs/dbraw/zinc/76/85/86/1374768586.db2.gz FKYMGTLBBHOLQS-AZUAARDMSA-N 1 3 341.499 2.596 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCC1CN([C@@H]2CCc3ccccc32)C1 ZINC001419020651 1374768591 /nfs/dbraw/zinc/76/85/91/1374768591.db2.gz FKYMGTLBBHOLQS-AZUAARDMSA-N 1 3 341.499 2.596 10 0 EFAEHO Cc1cccc([C@@H](C)N2CC(CNC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001419022546 1374770447 /nfs/dbraw/zinc/77/04/47/1374770447.db2.gz KQZUZCIKGRPKFD-YLJYHZDGSA-N 1 3 343.515 2.978 10 0 EFAEHO Cc1cccc([C@@H](C)N2CC(CNC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001419022546 1374770451 /nfs/dbraw/zinc/77/04/51/1374770451.db2.gz KQZUZCIKGRPKFD-YLJYHZDGSA-N 1 3 343.515 2.978 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)[C@@H]1CCN([C@@H](C)c2cccc(OC)c2)C1 ZINC001419138737 1374887049 /nfs/dbraw/zinc/88/70/49/1374887049.db2.gz KQCKISUNAGEQIA-FUHWJXTLSA-N 1 3 347.503 2.631 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)[C@@H]1CCN([C@@H](C)c2cccc(OC)c2)C1 ZINC001419138737 1374887054 /nfs/dbraw/zinc/88/70/54/1374887054.db2.gz KQCKISUNAGEQIA-FUHWJXTLSA-N 1 3 347.503 2.631 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1cccc(F)c1)C1CC1 ZINC001419250435 1374997561 /nfs/dbraw/zinc/99/75/61/1374997561.db2.gz KZCCEJQEDSJFQP-MOPGFXCFSA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H](CN(C)CCF)C1)[NH+]1CCCCC1 ZINC001419334680 1375119904 /nfs/dbraw/zinc/11/99/04/1375119904.db2.gz KEPVTWNYRXEKHI-QZTJIDSGSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)C[NH2+]C[C@@](C)(NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001419338808 1375127310 /nfs/dbraw/zinc/12/73/10/1375127310.db2.gz CFSIQOFTRSMWHM-RTBURBONSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)[NH2+]CC[C@@H]1CCCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001419374038 1375186118 /nfs/dbraw/zinc/18/61/18/1375186118.db2.gz MCLMISYLFPRVTA-LPHOPBHVSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC2CC[NH+](Cc3ccsc3)CC2)C1 ZINC001419398527 1375222093 /nfs/dbraw/zinc/22/20/93/1375222093.db2.gz JGUOACZNHLZQTB-MRXNPFEDSA-N 1 3 349.544 2.808 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc(C)cc2Cl)C1)N(C)C ZINC001419405061 1375229961 /nfs/dbraw/zinc/22/99/61/1375229961.db2.gz FGDHJVGKRBUZTO-BFYDXBDKSA-N 1 3 337.895 2.725 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@@H](C)c2ccc(F)cc2F)C1 ZINC001419428075 1375259668 /nfs/dbraw/zinc/25/96/68/1375259668.db2.gz AVOPGOIFQWRVJE-QEJZJMRPSA-N 1 3 339.430 2.603 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+][C@H]1C[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001419434648 1375268223 /nfs/dbraw/zinc/26/82/23/1375268223.db2.gz YEDNUYXJHWUDCP-SHTZXODSSA-N 1 3 337.895 2.725 10 0 EFAEHO CN(CC(=O)N1CCC[C@H]2C[N@H+](CCCF)CC[C@H]21)CC(C)(C)C ZINC001419452094 1375293459 /nfs/dbraw/zinc/29/34/59/1375293459.db2.gz SYCGTEPGLUZHTB-DLBZAZTESA-N 1 3 341.515 2.637 10 0 EFAEHO CN(CC(=O)N1CCC[C@H]2C[N@@H+](CCCF)CC[C@H]21)CC(C)(C)C ZINC001419452094 1375293470 /nfs/dbraw/zinc/29/34/70/1375293470.db2.gz SYCGTEPGLUZHTB-DLBZAZTESA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@H+](Cc3ccsc3)CC[C@H]21 ZINC001419453849 1375295045 /nfs/dbraw/zinc/29/50/45/1375295045.db2.gz XYUQARFCBSLNMZ-ZWKOTPCHSA-N 1 3 349.544 2.901 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@@H+](Cc3ccsc3)CC[C@H]21 ZINC001419453849 1375295056 /nfs/dbraw/zinc/29/50/56/1375295056.db2.gz XYUQARFCBSLNMZ-ZWKOTPCHSA-N 1 3 349.544 2.901 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@@H]2CN(Cc3ccsc3)CC[C@@H]21 ZINC001419453934 1375295827 /nfs/dbraw/zinc/29/58/27/1375295827.db2.gz YTIKGPQXGCIFOE-MSOLQXFVSA-N 1 3 349.544 2.903 10 0 EFAEHO CC(C)N(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(F)c1 ZINC001419460872 1375303257 /nfs/dbraw/zinc/30/32/57/1375303257.db2.gz LJICXHXCHRYZCX-YQQQUEKLSA-N 1 3 347.478 2.778 10 0 EFAEHO CC(C)N(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(F)c1 ZINC001419460872 1375303263 /nfs/dbraw/zinc/30/32/63/1375303263.db2.gz LJICXHXCHRYZCX-YQQQUEKLSA-N 1 3 347.478 2.778 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+][C@H]3CCc4c3cccc4F)C2)CCC1 ZINC001419476681 1375320364 /nfs/dbraw/zinc/32/03/64/1375320364.db2.gz UOOPPBRWJLOUGF-IYOUNJFTSA-N 1 3 345.462 2.534 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001419499857 1375349285 /nfs/dbraw/zinc/34/92/85/1375349285.db2.gz KFUXIPSMIFYHMN-HZSPNIEDSA-N 1 3 348.318 2.805 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001419499857 1375349296 /nfs/dbraw/zinc/34/92/96/1375349296.db2.gz KFUXIPSMIFYHMN-HZSPNIEDSA-N 1 3 348.318 2.805 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001419514580 1375368548 /nfs/dbraw/zinc/36/85/48/1375368548.db2.gz DAOSKIPWYWMJJP-BGYRXZFFSA-N 1 3 345.531 2.962 10 0 EFAEHO CCc1ccccc1C[N@H+]1CCC[C@@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001419539713 1375415950 /nfs/dbraw/zinc/41/59/50/1375415950.db2.gz BSPBCKQTFAJYIG-FXAWDEMLSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CCC[C@@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001419539713 1375415958 /nfs/dbraw/zinc/41/59/58/1375415958.db2.gz BSPBCKQTFAJYIG-FXAWDEMLSA-N 1 3 345.531 2.917 10 0 EFAEHO Cc1ccc(C[N@H+]2CCC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)cc1 ZINC001419557019 1375445438 /nfs/dbraw/zinc/44/54/38/1375445438.db2.gz NDDJUOWCQURGIN-ICSRJNTNSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccc(C[N@@H+]2CCC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)cc1 ZINC001419557019 1375445445 /nfs/dbraw/zinc/44/54/45/1375445445.db2.gz NDDJUOWCQURGIN-ICSRJNTNSA-N 1 3 343.515 2.665 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1(CNC(=O)CN(C)CC(C)(C)C)CCCC1 ZINC001419620385 1375557014 /nfs/dbraw/zinc/55/70/14/1375557014.db2.gz SMIFZZUSFZYVSX-OAHLLOKOSA-N 1 3 329.504 2.731 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1C[NH+](CCC2CCCCC2)C1 ZINC001438159548 1388388591 /nfs/dbraw/zinc/38/85/91/1388388591.db2.gz NOEMIGWLRVFDHV-CALCHBBNSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cc2ccccc2s1)N(C)C(=O)[C@@H]1CCCN1C ZINC001419659047 1375654223 /nfs/dbraw/zinc/65/42/23/1375654223.db2.gz YLNHOIWJRCKNEQ-YOEHRIQHSA-N 1 3 345.512 2.932 10 0 EFAEHO C[C@@H](C[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C(=O)C1(N(C)C)CCC1 ZINC001419668974 1375674873 /nfs/dbraw/zinc/67/48/73/1375674873.db2.gz YXYMRUKNUKYMAX-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+]C[C@H](C)N(C)C(=O)CN1CCCC1 ZINC001419742563 1375798500 /nfs/dbraw/zinc/79/85/00/1375798500.db2.gz HECNCKDMHDQWMV-HNNXBMFYSA-N 1 3 337.895 2.681 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]C/C=C/c1ccccc1 ZINC001419754680 1375818864 /nfs/dbraw/zinc/81/88/64/1375818864.db2.gz IJBOXWLWLVCQGN-GTZJFBCFSA-N 1 3 329.488 2.669 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001419768766 1375845070 /nfs/dbraw/zinc/84/50/70/1375845070.db2.gz MXXQNJDWEXJQRY-BEFAXECRSA-N 1 3 342.487 2.637 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[N@@H+](C)C[C@@H](F)CC)CC1)N(C)C ZINC001419844291 1375982193 /nfs/dbraw/zinc/98/21/93/1375982193.db2.gz CUEUZQNPPGGODV-DLBZAZTESA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[N@H+](C)C[C@@H](F)CC)CC1)N(C)C ZINC001419844291 1375982198 /nfs/dbraw/zinc/98/21/98/1375982198.db2.gz CUEUZQNPPGGODV-DLBZAZTESA-N 1 3 329.504 2.635 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C)[C@@H]1C[NH2+]CC1CC(C)(C)C1 ZINC001419849170 1375996125 /nfs/dbraw/zinc/99/61/25/1375996125.db2.gz SBXNTZRESKZRPN-AEFFLSMTSA-N 1 3 337.552 2.981 10 0 EFAEHO COc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@H]2CCCCN2C(C)C)cc1 ZINC001419862353 1376023932 /nfs/dbraw/zinc/02/39/32/1376023932.db2.gz FQBCSDQSRIDNEV-QFBILLFUSA-N 1 3 347.503 2.552 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](C)CNC(=O)[C@H]1CCCCN1C(C)C ZINC001419865619 1376028760 /nfs/dbraw/zinc/02/87/60/1376028760.db2.gz JLMLTPCFLCPVTO-PKOBYXMFSA-N 1 3 331.504 2.852 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NCc1ccc(Cl)c(Cl)c1 ZINC001419915567 1376121664 /nfs/dbraw/zinc/12/16/64/1376121664.db2.gz ALQMQPHQZDXZRE-WCQYABFASA-N 1 3 344.286 2.539 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NCc1ccc(Cl)c(Cl)c1 ZINC001419915567 1376121676 /nfs/dbraw/zinc/12/16/76/1376121676.db2.gz ALQMQPHQZDXZRE-WCQYABFASA-N 1 3 344.286 2.539 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001419931740 1376148686 /nfs/dbraw/zinc/14/86/86/1376148686.db2.gz GEKPJIQCLDWXRW-CXAGYDPISA-N 1 3 337.895 2.762 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]([NH2+][C@H]1CCc2ccccc21)C(C)C ZINC001419933030 1376150113 /nfs/dbraw/zinc/15/01/13/1376150113.db2.gz ZAUJZYINBIMNCS-HKUYNNGSSA-N 1 3 340.471 2.679 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]([NH2+][C@@H]1CCc2ccccc21)C(C)C ZINC001419933046 1376150359 /nfs/dbraw/zinc/15/03/59/1376150359.db2.gz ZAUJZYINBIMNCS-MJGOQNOKSA-N 1 3 340.471 2.679 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001419939471 1376160331 /nfs/dbraw/zinc/16/03/31/1376160331.db2.gz WLYHYVHHERMIJD-IBGZPJMESA-N 1 3 344.503 2.739 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21)Cc1ccccc1 ZINC001419989671 1376244053 /nfs/dbraw/zinc/24/40/53/1376244053.db2.gz KYRPVXXYXHXZBL-MOPGFXCFSA-N 1 3 329.488 2.594 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21)Cc1ccccc1 ZINC001419989671 1376244057 /nfs/dbraw/zinc/24/40/57/1376244057.db2.gz KYRPVXXYXHXZBL-MOPGFXCFSA-N 1 3 329.488 2.594 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCC[C@@H](NC(=O)CN(C)C(C)C)C2)cc1F ZINC001420020217 1376296461 /nfs/dbraw/zinc/29/64/61/1376296461.db2.gz LGLRBUAPTCMAAN-QZTJIDSGSA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@H]2CN(C(=O)CN(C)C3CCC3)CC[C@@H]21 ZINC001420071989 1376419096 /nfs/dbraw/zinc/41/90/96/1376419096.db2.gz FTTABMJSLKRLIU-HKUYNNGSSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@H]2CN(C(=O)CN(C)C3CCC3)CC[C@@H]21 ZINC001420071989 1376419101 /nfs/dbraw/zinc/41/91/01/1376419101.db2.gz FTTABMJSLKRLIU-HKUYNNGSSA-N 1 3 335.536 2.830 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]Cc1ccsc1)C1CCC1 ZINC001420108920 1376466861 /nfs/dbraw/zinc/46/68/61/1376466861.db2.gz YHWDMMFOSJLQSY-DOTOQJQBSA-N 1 3 335.517 2.607 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001420165873 1376525021 /nfs/dbraw/zinc/52/50/21/1376525021.db2.gz OUAFYZNAXLXBJF-AWEZNQCLSA-N 1 3 333.467 2.637 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1cccc(OC)c1 ZINC001420166763 1376526183 /nfs/dbraw/zinc/52/61/83/1376526183.db2.gz RDAJPEKCSITNHE-APWZRJJASA-N 1 3 347.503 2.554 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCc2ccccc21)C(=O)C1(N(C)C)CCC1 ZINC001420232294 1376588513 /nfs/dbraw/zinc/58/85/13/1376588513.db2.gz GXZYPCDYMYXCHX-GOSISDBHSA-N 1 3 329.488 2.596 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@@H+]1C)Cc1ccc2cc[nH]c2c1 ZINC001420250189 1376615583 /nfs/dbraw/zinc/61/55/83/1376615583.db2.gz MWJFEKFVJWBOJH-GOSISDBHSA-N 1 3 342.487 2.590 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@H+]1C)Cc1ccc2cc[nH]c2c1 ZINC001420250189 1376615586 /nfs/dbraw/zinc/61/55/86/1376615586.db2.gz MWJFEKFVJWBOJH-GOSISDBHSA-N 1 3 342.487 2.590 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001420286229 1376669047 /nfs/dbraw/zinc/66/90/47/1376669047.db2.gz VGYQKFUHJYVASQ-IEBWSBKVSA-N 1 3 331.504 2.771 10 0 EFAEHO CN(CCNC(=O)CC[NH+](C)C)Cc1ccc(C2CCCC2)cc1 ZINC001420289900 1376673463 /nfs/dbraw/zinc/67/34/63/1376673463.db2.gz MNDRHRWLUDHXSF-UHFFFAOYSA-N 1 3 331.504 2.844 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C1CCC1)[C@@H]1CCc2ccccc21 ZINC001420394471 1376872624 /nfs/dbraw/zinc/87/26/24/1376872624.db2.gz RKEHLPLPNXGDST-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C1CCC1)[C@@H]1CCc2ccccc21 ZINC001420394471 1376872629 /nfs/dbraw/zinc/87/26/29/1376872629.db2.gz RKEHLPLPNXGDST-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1cccc(Cl)c1 ZINC001420521334 1377125152 /nfs/dbraw/zinc/12/51/52/1377125152.db2.gz ZRRMGORDLHNKJS-YOEHRIQHSA-N 1 3 337.895 2.809 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1 ZINC001420582241 1377246834 /nfs/dbraw/zinc/24/68/34/1377246834.db2.gz MSIHWBQSOXDWAE-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1 ZINC001420582241 1377246839 /nfs/dbraw/zinc/24/68/39/1377246839.db2.gz MSIHWBQSOXDWAE-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C)C[N@H+](C)CC1CC2(CCC2)C1 ZINC001420587490 1377260788 /nfs/dbraw/zinc/26/07/88/1377260788.db2.gz WYDTYBVVFVCFHT-WMZOPIPTSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001420587490 1377260791 /nfs/dbraw/zinc/26/07/91/1377260791.db2.gz WYDTYBVVFVCFHT-WMZOPIPTSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](C[N@H+](C)CC1CCC(F)(F)CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001420621550 1377346601 /nfs/dbraw/zinc/34/66/01/1377346601.db2.gz GPSFEQUOAMLLNP-HUUCEWRRSA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@H](C[N@@H+](C)CC1CCC(F)(F)CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001420621550 1377346602 /nfs/dbraw/zinc/34/66/02/1377346602.db2.gz GPSFEQUOAMLLNP-HUUCEWRRSA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@@H](C[N@H+](C)CC1CCC(F)(F)CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001420621547 1377346890 /nfs/dbraw/zinc/34/68/90/1377346890.db2.gz GPSFEQUOAMLLNP-GJZGRUSLSA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC1CCC(F)(F)CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001420621547 1377346894 /nfs/dbraw/zinc/34/68/94/1377346894.db2.gz GPSFEQUOAMLLNP-GJZGRUSLSA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001420656945 1377432928 /nfs/dbraw/zinc/43/29/28/1377432928.db2.gz CPRZMCKOKQZRKR-HZPDHXFCSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001420656945 1377432933 /nfs/dbraw/zinc/43/29/33/1377432933.db2.gz CPRZMCKOKQZRKR-HZPDHXFCSA-N 1 3 343.471 2.711 10 0 EFAEHO Cc1cc(CN(C)C[C@H](C)NC(=O)C[C@@H]2CC[N@H+](C)C2)c(C)s1 ZINC001420666626 1377458918 /nfs/dbraw/zinc/45/89/18/1377458918.db2.gz PQTPDCWQBHKYCS-BBRMVZONSA-N 1 3 337.533 2.643 10 0 EFAEHO Cc1cc(CN(C)C[C@H](C)NC(=O)C[C@@H]2CC[N@@H+](C)C2)c(C)s1 ZINC001420666626 1377458931 /nfs/dbraw/zinc/45/89/31/1377458931.db2.gz PQTPDCWQBHKYCS-BBRMVZONSA-N 1 3 337.533 2.643 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NCCN(C/C=C\c2ccccc2)C2CC2)C1 ZINC001420702032 1377532654 /nfs/dbraw/zinc/53/26/54/1377532654.db2.gz WTIXOMNOTMETPV-NVAPOSRTSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NCCN(C/C=C\c2ccccc2)C2CC2)C1 ZINC001420702032 1377532657 /nfs/dbraw/zinc/53/26/57/1377532657.db2.gz WTIXOMNOTMETPV-NVAPOSRTSA-N 1 3 341.499 2.622 10 0 EFAEHO CCCN1CCCC[C@H]1C(=O)N1C[C@]23C[N@H+](C)C[C@@]2(C1)CCCC3 ZINC001420713086 1377552189 /nfs/dbraw/zinc/55/21/89/1377552189.db2.gz WPWAPETZGSBMAQ-YSIASYRMSA-N 1 3 333.520 2.585 10 0 EFAEHO CCCN1CCCC[C@H]1C(=O)N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001420713086 1377552192 /nfs/dbraw/zinc/55/21/92/1377552192.db2.gz WPWAPETZGSBMAQ-YSIASYRMSA-N 1 3 333.520 2.585 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C[NH2+]Cc1ccccc1C)C1CC1 ZINC001420736865 1377583723 /nfs/dbraw/zinc/58/37/23/1377583723.db2.gz KRCARHOYNJSNSQ-PMACEKPBSA-N 1 3 343.515 2.854 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](CNCc1ccccc1F)C1CC1 ZINC001420738188 1377586169 /nfs/dbraw/zinc/58/61/69/1377586169.db2.gz NFVHFKWMGFLYJN-RTBURBONSA-N 1 3 347.478 2.685 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](CNCc1ccccc1F)C1CC1 ZINC001420738188 1377586170 /nfs/dbraw/zinc/58/61/70/1377586170.db2.gz NFVHFKWMGFLYJN-RTBURBONSA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)CC[NH2+][C@@H](CNC(=O)C1(N(C)C)CCC1)c1ccccc1 ZINC001420776546 1377647573 /nfs/dbraw/zinc/64/75/73/1377647573.db2.gz PAHLOQGNPPTUFL-SFHVURJKSA-N 1 3 331.504 2.964 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]Cc1ccc(Cl)cc1)C1CC1 ZINC001420798883 1377686360 /nfs/dbraw/zinc/68/63/60/1377686360.db2.gz OSZUUNZXBGWBBJ-QGZVFWFLSA-N 1 3 337.895 2.665 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)[NH+]1CCCC1)NCc1cc(C)ccc1F ZINC001438330970 1388511868 /nfs/dbraw/zinc/51/18/68/1388511868.db2.gz UWXKAAITHRXJDQ-KRWDZBQOSA-N 1 3 349.494 2.993 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NCC[C@H]2CCN(C/C=C/Cl)C2)C1 ZINC001420890161 1377844042 /nfs/dbraw/zinc/84/40/42/1377844042.db2.gz YWGBAXHGISNGLC-ALOLOFKDSA-N 1 3 341.927 2.689 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NCC[C@H]2CCN(C/C=C/Cl)C2)C1 ZINC001420890161 1377844045 /nfs/dbraw/zinc/84/40/45/1377844045.db2.gz YWGBAXHGISNGLC-ALOLOFKDSA-N 1 3 341.927 2.689 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)cs1 ZINC001420890109 1377844724 /nfs/dbraw/zinc/84/47/24/1377844724.db2.gz SVKFPSBYDMJCHS-INIZCTEOSA-N 1 3 337.533 2.725 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)cs1 ZINC001420890109 1377844728 /nfs/dbraw/zinc/84/47/28/1377844728.db2.gz SVKFPSBYDMJCHS-INIZCTEOSA-N 1 3 337.533 2.725 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NCC[C@@H]2CCN(C/C=C\Cl)C2)C1 ZINC001420890171 1377844927 /nfs/dbraw/zinc/84/49/27/1377844927.db2.gz YWGBAXHGISNGLC-YFKBFVAJSA-N 1 3 341.927 2.689 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NCC[C@@H]2CCN(C/C=C\Cl)C2)C1 ZINC001420890171 1377844929 /nfs/dbraw/zinc/84/49/29/1377844929.db2.gz YWGBAXHGISNGLC-YFKBFVAJSA-N 1 3 341.927 2.689 10 0 EFAEHO Cc1cccc(C[N@@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001420950319 1377928461 /nfs/dbraw/zinc/92/84/61/1377928461.db2.gz NKWXKAIBDBJVBU-IBGZPJMESA-N 1 3 331.504 2.616 10 0 EFAEHO Cc1cccc(C[N@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001420950319 1377928465 /nfs/dbraw/zinc/92/84/65/1377928465.db2.gz NKWXKAIBDBJVBU-IBGZPJMESA-N 1 3 331.504 2.616 10 0 EFAEHO CC[C@H]([NH2+]C1(CNC(=O)C2(N(C)C)CCC2)CC1)c1ccccc1 ZINC001420959583 1377941827 /nfs/dbraw/zinc/94/18/27/1377941827.db2.gz NOWYDFNWXGDHJP-KRWDZBQOSA-N 1 3 329.488 2.860 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@H+](CC2CCC2)C1)N1CCCCC1 ZINC001420990392 1377985110 /nfs/dbraw/zinc/98/51/10/1377985110.db2.gz OQLJCELTKRERRR-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@@H+](CC2CCC2)C1)N1CCCCC1 ZINC001420990392 1377985112 /nfs/dbraw/zinc/98/51/12/1377985112.db2.gz OQLJCELTKRERRR-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@H]3C)CC2)c1 ZINC001421006983 1378011592 /nfs/dbraw/zinc/01/15/92/1378011592.db2.gz QWPIZWVYGSBQCC-QZTJIDSGSA-N 1 3 343.515 2.915 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+][C@H](C)c2ccc(Cl)cc2)CC1 ZINC001421007596 1378013183 /nfs/dbraw/zinc/01/31/83/1378013183.db2.gz XRBHNYBEENKPAO-CQSZACIVSA-N 1 3 337.895 2.980 10 0 EFAEHO CC[C@@H](CNC(=O)Cc1nc[nH]c1C)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001438359214 1388532609 /nfs/dbraw/zinc/53/26/09/1388532609.db2.gz PBLUHEOOUXKUNW-KBPBESRZSA-N 1 3 342.434 2.571 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@@H](C[NH2+]Cc2ccsc2)C2CCCC2)C1 ZINC001421166373 1378213092 /nfs/dbraw/zinc/21/30/92/1378213092.db2.gz FJSCNEKBHHGZSX-YJBOKZPZSA-N 1 3 349.544 2.855 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+]Cc2ccsc2)C2CCCC2)CCC1 ZINC001421177209 1378233308 /nfs/dbraw/zinc/23/33/08/1378233308.db2.gz VYTRCROKINWVAR-QGZVFWFLSA-N 1 3 349.544 2.997 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@](C)(C[NH2+]CC3CC(C)(C)C3)C2)CCC1 ZINC001421239295 1378329987 /nfs/dbraw/zinc/32/99/87/1378329987.db2.gz MTCOADQOAOOFSJ-IBGZPJMESA-N 1 3 335.536 2.735 10 0 EFAEHO CCN1CCC(F)(F)[C@@H](CNC(=O)CC[N@H+](C)C2CCCCC2)C1 ZINC001421328424 1378501728 /nfs/dbraw/zinc/50/17/28/1378501728.db2.gz CRNHDUVFLNANRF-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCC(F)(F)[C@@H](CNC(=O)CC[N@@H+](C)C2CCCCC2)C1 ZINC001421328424 1378501734 /nfs/dbraw/zinc/50/17/34/1378501734.db2.gz CRNHDUVFLNANRF-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1cccc(OC)c1 ZINC001421425229 1378601848 /nfs/dbraw/zinc/60/18/48/1378601848.db2.gz RMANJXUSUQUSRE-MJGOQNOKSA-N 1 3 347.503 2.552 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]Cc1ccccc1 ZINC001421451638 1378635266 /nfs/dbraw/zinc/63/52/66/1378635266.db2.gz AJXXQDCERTWIPL-MOPGFXCFSA-N 1 3 331.504 2.934 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]Cc1ccccc1 ZINC001421451651 1378635396 /nfs/dbraw/zinc/63/53/96/1378635396.db2.gz AJXXQDCERTWIPL-RTBURBONSA-N 1 3 331.504 2.934 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]CCc1ccccc1 ZINC001421459046 1378646644 /nfs/dbraw/zinc/64/66/44/1378646644.db2.gz WOUCUANGICZNNU-WOJBJXKFSA-N 1 3 345.531 2.976 10 0 EFAEHO CC[C@H](CNC(=O)C12CC[NH+](CC1)C2)NCc1cc2ccccc2o1 ZINC001421471524 1378661503 /nfs/dbraw/zinc/66/15/03/1378661503.db2.gz RDVCPFNVIGRVRU-MRXNPFEDSA-N 1 3 341.455 2.513 10 0 EFAEHO CCc1ccccc1[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]CC1CC1 ZINC001421530415 1378757524 /nfs/dbraw/zinc/75/75/24/1378757524.db2.gz OBRKSJKZPCMYIQ-LJQANCHMSA-N 1 3 343.515 2.890 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001421547377 1378791214 /nfs/dbraw/zinc/79/12/14/1378791214.db2.gz RXGGKQRASMCXIF-WMZOPIPTSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@](C)(C[NH2+]Cc2cccc(F)c2)C2CC2)C1 ZINC001421550621 1378795375 /nfs/dbraw/zinc/79/53/75/1378795375.db2.gz JCOLSFAWFXMKMA-FOIQADDNSA-N 1 3 347.478 2.542 10 0 EFAEHO CC(C)[NH2+]CCN(Cc1ccccc1)C(=O)CN1[C@H](C)CC[C@@H]1C ZINC001421567347 1378821620 /nfs/dbraw/zinc/82/16/20/1378821620.db2.gz WXVIFZVBPNLGQW-HDICACEKSA-N 1 3 331.504 2.886 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2C[N@@H+](CC3CCC4(CC4)CC3)C[C@@H]2C1 ZINC001421577363 1378836481 /nfs/dbraw/zinc/83/64/81/1378836481.db2.gz LUAZKTAQRJURAX-KDURUIRLSA-N 1 3 347.547 2.689 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2C[N@H+](CC3CCC4(CC4)CC3)C[C@@H]2C1 ZINC001421577363 1378836487 /nfs/dbraw/zinc/83/64/87/1378836487.db2.gz LUAZKTAQRJURAX-KDURUIRLSA-N 1 3 347.547 2.689 10 0 EFAEHO Cc1cc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)CCC[NH+](C)C)cs1 ZINC001421629033 1378907705 /nfs/dbraw/zinc/90/77/05/1378907705.db2.gz CQSIUUBMGJWNSE-ZWKOTPCHSA-N 1 3 349.544 2.964 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001421718251 1379032005 /nfs/dbraw/zinc/03/20/05/1379032005.db2.gz HDGDTPZTMMYKQJ-QGZVFWFLSA-N 1 3 345.531 2.965 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NCC2(NCc3ccsc3)CCC2)C1 ZINC001421767416 1379105832 /nfs/dbraw/zinc/10/58/32/1379105832.db2.gz SJYDRLSAJMKAEJ-KRWDZBQOSA-N 1 3 349.544 2.999 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NCC2(NCc3ccsc3)CCC2)C1 ZINC001421767416 1379105834 /nfs/dbraw/zinc/10/58/34/1379105834.db2.gz SJYDRLSAJMKAEJ-KRWDZBQOSA-N 1 3 349.544 2.999 10 0 EFAEHO CN(CCC[N@H+](C)[C@@H]1CCc2ccccc21)C(=O)CN(C)C1CCC1 ZINC001421867086 1379269135 /nfs/dbraw/zinc/26/91/35/1379269135.db2.gz NUBULMZFXTZFIO-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO CN(CCC[N@@H+](C)[C@@H]1CCc2ccccc21)C(=O)CN(C)C1CCC1 ZINC001421867086 1379269138 /nfs/dbraw/zinc/26/91/38/1379269138.db2.gz NUBULMZFXTZFIO-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccccc1C1CC1)N(C)C(=O)[C@@H]1CCCN1C ZINC001421875358 1379286352 /nfs/dbraw/zinc/28/63/52/1379286352.db2.gz SKRAGIXKBYDVHU-BEFAXECRSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccccc1C1CC1)N(C)C(=O)[C@@H]1CCCN1C ZINC001421875361 1379286679 /nfs/dbraw/zinc/28/66/79/1379286679.db2.gz SKRAGIXKBYDVHU-KXBFYZLASA-N 1 3 329.488 2.595 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001421889285 1379305836 /nfs/dbraw/zinc/30/58/36/1379305836.db2.gz MXKRANNZMVWDSG-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001421889285 1379305846 /nfs/dbraw/zinc/30/58/46/1379305846.db2.gz MXKRANNZMVWDSG-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@H+](C)CC1CCC(F)(F)CC1 ZINC001421902404 1379330382 /nfs/dbraw/zinc/33/03/82/1379330382.db2.gz QDXNTQVZLGHLNB-UHFFFAOYSA-N 1 3 347.494 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)CC1CCC(F)(F)CC1 ZINC001421902404 1379330388 /nfs/dbraw/zinc/33/03/88/1379330388.db2.gz QDXNTQVZLGHLNB-UHFFFAOYSA-N 1 3 347.494 2.932 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001421935025 1379373695 /nfs/dbraw/zinc/37/36/95/1379373695.db2.gz BFPJOUURCMPMMN-IAGOWNOFSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001421935036 1379373757 /nfs/dbraw/zinc/37/37/57/1379373757.db2.gz BFPJOUURCMPMMN-IRXDYDNUSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](F)CNCc1ccc(CNC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)cc1 ZINC001438447376 1388609599 /nfs/dbraw/zinc/60/95/99/1388609599.db2.gz MFDMUWATWQHXQY-GBESFXJTSA-N 1 3 349.494 2.871 10 0 EFAEHO CC[C@H](F)CNCc1ccc(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)cc1 ZINC001438447376 1388609603 /nfs/dbraw/zinc/60/96/03/1388609603.db2.gz MFDMUWATWQHXQY-GBESFXJTSA-N 1 3 349.494 2.871 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CCCC2)cc1 ZINC001421993838 1379452881 /nfs/dbraw/zinc/45/28/81/1379452881.db2.gz NYZNYKMIYWRATA-KRWDZBQOSA-N 1 3 331.504 2.842 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001422029502 1379513273 /nfs/dbraw/zinc/51/32/73/1379513273.db2.gz NGQCAXDDQDASOU-PKOBYXMFSA-N 1 3 331.504 2.662 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@H]([NH2+]Cc2cc3ccccc3o2)C1 ZINC001422063205 1379562563 /nfs/dbraw/zinc/56/25/63/1379562563.db2.gz NXJGICOBBIHNEJ-MAUKXSAKSA-N 1 3 343.471 2.710 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@H+](CCc2ccccc2)CC1(C)C)N(C)C ZINC001422077853 1379580491 /nfs/dbraw/zinc/58/04/91/1379580491.db2.gz BPNMBVSKIODUOH-MOPGFXCFSA-N 1 3 345.531 2.786 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@@H+](CCc2ccccc2)CC1(C)C)N(C)C ZINC001422077853 1379580493 /nfs/dbraw/zinc/58/04/93/1379580493.db2.gz BPNMBVSKIODUOH-MOPGFXCFSA-N 1 3 345.531 2.786 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001438453691 1388618105 /nfs/dbraw/zinc/61/81/05/1388618105.db2.gz RKRNBHBGLYKJRK-UHFFFAOYSA-N 1 3 346.519 2.915 10 0 EFAEHO CCC[NH+]1CCC(CCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001438456400 1388621312 /nfs/dbraw/zinc/62/13/12/1388621312.db2.gz NTRBYDZAIZYRJH-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO CCCc1ccc(CN(C)CCN(C)C(=O)C23CC[NH+](CC2)C3)cc1 ZINC001422227230 1379810384 /nfs/dbraw/zinc/81/03/84/1379810384.db2.gz MQPVYQHMMTZLBQ-UHFFFAOYSA-N 1 3 343.515 2.625 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H]2C[N@H+](C)CCc2cccs2)C1 ZINC001422241221 1379841950 /nfs/dbraw/zinc/84/19/50/1379841950.db2.gz DJEKQWWFCNEBPP-DLBZAZTESA-N 1 3 349.544 2.555 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H]2C[N@@H+](C)CCc2cccs2)C1 ZINC001422241221 1379841952 /nfs/dbraw/zinc/84/19/52/1379841952.db2.gz DJEKQWWFCNEBPP-DLBZAZTESA-N 1 3 349.544 2.555 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H]2C[N@H+](C)CCc2cccs2)C1 ZINC001422241228 1379842115 /nfs/dbraw/zinc/84/21/15/1379842115.db2.gz DJEKQWWFCNEBPP-IAGOWNOFSA-N 1 3 349.544 2.555 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H]2C[N@@H+](C)CCc2cccs2)C1 ZINC001422241228 1379842121 /nfs/dbraw/zinc/84/21/21/1379842121.db2.gz DJEKQWWFCNEBPP-IAGOWNOFSA-N 1 3 349.544 2.555 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H]1C[N@H+](C)CCC(C)(C)C)N(C)C ZINC001422248976 1379857041 /nfs/dbraw/zinc/85/70/41/1379857041.db2.gz CKDMSINGYHYSFG-DLBZAZTESA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H]1C[N@@H+](C)CCC(C)(C)C)N(C)C ZINC001422248976 1379857046 /nfs/dbraw/zinc/85/70/46/1379857046.db2.gz CKDMSINGYHYSFG-DLBZAZTESA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2Cc2cccc(F)c2)C1 ZINC001422248727 1379857360 /nfs/dbraw/zinc/85/73/60/1379857360.db2.gz PFKIPXFDOGHKCJ-IEBWSBKVSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001422248727 1379857363 /nfs/dbraw/zinc/85/73/63/1379857363.db2.gz PFKIPXFDOGHKCJ-IEBWSBKVSA-N 1 3 347.478 2.589 10 0 EFAEHO C[C@@H]([NH2+]CC1CC(NC(=O)C2(N(C)C)CCC2)C1)c1ccc(F)cc1 ZINC001422268540 1379885434 /nfs/dbraw/zinc/88/54/34/1379885434.db2.gz VNUAPDVSXZEDJF-KSTDHSDQSA-N 1 3 347.478 2.855 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001422291874 1379901876 /nfs/dbraw/zinc/90/18/76/1379901876.db2.gz HEBCLBBDGPHZPJ-CTWPCTMYSA-N 1 3 331.504 2.566 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001422428264 1380080747 /nfs/dbraw/zinc/08/07/47/1380080747.db2.gz UYBSVQOPMYDDHH-QWHCGFSZSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@H](C(=O)N(C)CC(C)(C)C[NH2+]Cc1ccc(C)nc1C)N(C)C ZINC001422446604 1380115385 /nfs/dbraw/zinc/11/53/85/1380115385.db2.gz VIOQLJHOROASJJ-GOSISDBHSA-N 1 3 348.535 2.613 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC(C)(C)C[NH2+]CC1CC2(CCC2)C1)N(C)C ZINC001422461262 1380142635 /nfs/dbraw/zinc/14/26/35/1380142635.db2.gz FVFALLQEQAYBBY-KRWDZBQOSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H](C)CNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001438517621 1388651417 /nfs/dbraw/zinc/65/14/17/1388651417.db2.gz HGUKPXJWEJXTMM-MAUKXSAKSA-N 1 3 337.483 2.562 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[N@H+](C)Cc1ccccc1C ZINC001422516684 1380238818 /nfs/dbraw/zinc/23/88/18/1380238818.db2.gz JYJKSVHXDCERRM-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[N@@H+](C)Cc1ccccc1C ZINC001422516684 1380238819 /nfs/dbraw/zinc/23/88/19/1380238819.db2.gz JYJKSVHXDCERRM-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1 ZINC001422527615 1380257825 /nfs/dbraw/zinc/25/78/25/1380257825.db2.gz ZWKPZRCVFKMHEL-CRAIPNDOSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1 ZINC001422527615 1380257828 /nfs/dbraw/zinc/25/78/28/1380257828.db2.gz ZWKPZRCVFKMHEL-CRAIPNDOSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1 ZINC001422527627 1380258308 /nfs/dbraw/zinc/25/83/08/1380258308.db2.gz ZWKPZRCVFKMHEL-YJBOKZPZSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1 ZINC001422527627 1380258311 /nfs/dbraw/zinc/25/83/11/1380258311.db2.gz ZWKPZRCVFKMHEL-YJBOKZPZSA-N 1 3 335.467 2.635 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]Cc1ccc(C(C)(C)C)cc1)N(C)C ZINC001422735525 1380734464 /nfs/dbraw/zinc/73/44/64/1380734464.db2.gz SDVWJBVASFJPOR-MAUKXSAKSA-N 1 3 333.520 2.919 10 0 EFAEHO C[C@@H](NC(=O)CC[NH+](C)C)C1CN([C@@H](C)c2ccc3c(c2)CCC3)C1 ZINC001422736708 1380735945 /nfs/dbraw/zinc/73/59/45/1380735945.db2.gz WQOQETLKCLYEHH-CVEARBPZSA-N 1 3 343.515 2.625 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001422743973 1380745229 /nfs/dbraw/zinc/74/52/29/1380745229.db2.gz UKXNJCKXKYXIFQ-MAUKXSAKSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C1C[NH+](CC2CCC3(CC3)CC2)C1 ZINC001422750921 1380754939 /nfs/dbraw/zinc/75/49/39/1380754939.db2.gz AEZURPOBVJLBOT-INIZCTEOSA-N 1 3 335.536 2.735 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C1C[NH+](CC2CCC3(CC3)CC2)C1 ZINC001422750925 1380755572 /nfs/dbraw/zinc/75/55/72/1380755572.db2.gz AEZURPOBVJLBOT-MRXNPFEDSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](Cc2ccc(C)cc2C)C1)N(C)C ZINC001422754911 1380762394 /nfs/dbraw/zinc/76/23/94/1380762394.db2.gz RQLFRZPDOZCYOP-QFBILLFUSA-N 1 3 331.504 2.580 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C)C1)C1C[NH+](CCC2CCCCC2)C1 ZINC001422755425 1380762527 /nfs/dbraw/zinc/76/25/27/1380762527.db2.gz UJTDSKJOAGNLRS-IRXDYDNUSA-N 1 3 335.536 2.735 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CC1CCC(F)(F)CC1 ZINC001422759861 1380767891 /nfs/dbraw/zinc/76/78/91/1380767891.db2.gz MINRKCLDGDDINC-HOCLYGCPSA-N 1 3 345.478 2.781 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3CCCCCC3)C[C@H]21 ZINC001422833123 1380882389 /nfs/dbraw/zinc/88/23/89/1380882389.db2.gz NFWQZUCYYKXMHV-OWZKRDHZSA-N 1 3 349.563 2.983 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3CCCCCC3)C[C@H]21 ZINC001422833123 1380882398 /nfs/dbraw/zinc/88/23/98/1380882398.db2.gz NFWQZUCYYKXMHV-OWZKRDHZSA-N 1 3 349.563 2.983 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCCCCC3)C[C@H]21 ZINC001422841128 1380907485 /nfs/dbraw/zinc/90/74/85/1380907485.db2.gz ZCPHGPVTTMBLEB-NNZMDNLPSA-N 1 3 344.503 2.525 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCCCCC3)C[C@H]21 ZINC001422841128 1380907502 /nfs/dbraw/zinc/90/75/02/1380907502.db2.gz ZCPHGPVTTMBLEB-NNZMDNLPSA-N 1 3 344.503 2.525 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CC2(C1)CCCN(Cc1ccsc1)C2 ZINC001422856375 1380952640 /nfs/dbraw/zinc/95/26/40/1380952640.db2.gz KOBYGOKKNNECFV-UHFFFAOYSA-N 1 3 335.517 2.514 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](CC(CC)CC)C[C@@H]2C1 ZINC001422881660 1380997053 /nfs/dbraw/zinc/99/70/53/1380997053.db2.gz SFKORMLYTGQPSN-CEXWTWQISA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](CC(CC)CC)C[C@@H]2C1 ZINC001422881660 1380997058 /nfs/dbraw/zinc/99/70/58/1380997058.db2.gz SFKORMLYTGQPSN-CEXWTWQISA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](CN(C)C/C=C/c1ccc(Cl)cc1)NC(=O)CC[NH+](C)C ZINC001422883783 1381000558 /nfs/dbraw/zinc/00/05/58/1381000558.db2.gz IHZRBKUFELWCON-NFAHFFEMSA-N 1 3 337.895 2.741 10 0 EFAEHO C[C@@H](CN(C)C/C=C\c1ccc(Cl)cc1)NC(=O)CC[NH+](C)C ZINC001422883785 1381000605 /nfs/dbraw/zinc/00/06/05/1381000605.db2.gz IHZRBKUFELWCON-YVACAVLKSA-N 1 3 337.895 2.741 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2ccccc2F)C1)N(C)C ZINC001422909849 1381037538 /nfs/dbraw/zinc/03/75/38/1381037538.db2.gz SFXQUAACYCJUEO-ADAWSYLGSA-N 1 3 335.467 2.711 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)CCCc1ccccc1 ZINC001422913749 1381045386 /nfs/dbraw/zinc/04/53/86/1381045386.db2.gz CFXWNZQHBCZPRL-UYAOXDASSA-N 1 3 345.531 2.930 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)CCCc1ccccc1 ZINC001422913749 1381045389 /nfs/dbraw/zinc/04/53/89/1381045389.db2.gz CFXWNZQHBCZPRL-UYAOXDASSA-N 1 3 345.531 2.930 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001422916456 1381049905 /nfs/dbraw/zinc/04/99/05/1381049905.db2.gz WJPIFJIAOSFLSK-NSISKUIASA-N 1 3 343.515 2.889 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)cc1C ZINC001422918452 1381055551 /nfs/dbraw/zinc/05/55/51/1381055551.db2.gz MITGNWXEKATLIS-WGSAOQKQSA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2cc3ccccc3o2)C1 ZINC001422919595 1381056203 /nfs/dbraw/zinc/05/62/03/1381056203.db2.gz PUAAQLBSYGGRKW-JCNLHEQBSA-N 1 3 343.471 2.757 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCCC[C@@H]1C[NH2+]CC1CC(F)(F)C1 ZINC001422929596 1381078203 /nfs/dbraw/zinc/07/82/03/1381078203.db2.gz DWHYMWBDFUFLDM-CVEARBPZSA-N 1 3 345.478 2.637 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C[NH2+]Cc1csc(C)c1)C1CC1 ZINC001423004356 1381192482 /nfs/dbraw/zinc/19/24/82/1381192482.db2.gz PHBOMURFNVUWNJ-ROUUACIJSA-N 1 3 349.544 2.915 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+][C@@H]1CCCc2ccccc21)C1CC1 ZINC001423059476 1381283862 /nfs/dbraw/zinc/28/38/62/1381283862.db2.gz MCEKJEJTEYBYBJ-WOJBJXKFSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001423084033 1381320396 /nfs/dbraw/zinc/32/03/96/1381320396.db2.gz VEOFTDYDPONEAS-CRAIPNDOSA-N 1 3 329.488 2.595 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCN1CCCc1ccccc1 ZINC001423129777 1381404120 /nfs/dbraw/zinc/40/41/20/1381404120.db2.gz XIWQLQCSVOJMBH-PMACEKPBSA-N 1 3 343.515 2.684 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCN1CCCc1ccccc1 ZINC001423129777 1381404127 /nfs/dbraw/zinc/40/41/27/1381404127.db2.gz XIWQLQCSVOJMBH-PMACEKPBSA-N 1 3 343.515 2.684 10 0 EFAEHO Cc1cc(C)c(CN2CC[C@H]2CNC(=O)C[C@@H]2CC[N@@H+](C)C2)c(C)c1 ZINC001423161780 1381475636 /nfs/dbraw/zinc/47/56/36/1381475636.db2.gz BAJUVQVOLNVRSU-OALUTQOASA-N 1 3 343.515 2.644 10 0 EFAEHO Cc1cc(C)c(CN2CC[C@H]2CNC(=O)C[C@@H]2CC[N@H+](C)C2)c(C)c1 ZINC001423161780 1381475646 /nfs/dbraw/zinc/47/56/46/1381475646.db2.gz BAJUVQVOLNVRSU-OALUTQOASA-N 1 3 343.515 2.644 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C[C@@H](C)NC/C=C\Cl)[NH+]1CCCCC1 ZINC001423171400 1381499073 /nfs/dbraw/zinc/49/90/73/1381499073.db2.gz MJSGXUBNXYKEST-AISUJJHZSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001438670891 1388729214 /nfs/dbraw/zinc/72/92/14/1388729214.db2.gz TUEQRMACIVZZMX-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001438670891 1388729217 /nfs/dbraw/zinc/72/92/17/1388729217.db2.gz TUEQRMACIVZZMX-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]CC[C@H]3CCCC3(F)F)CC2)CCC1 ZINC001423225328 1381617590 /nfs/dbraw/zinc/61/75/90/1381617590.db2.gz DOMCTRPVMABTNT-CQSZACIVSA-N 1 3 343.462 2.535 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+][C@H](C)c2ccc(F)cc2)CC1 ZINC001423232520 1381636671 /nfs/dbraw/zinc/63/66/71/1381636671.db2.gz TZIJVKNGRSNHGN-CRAIPNDOSA-N 1 3 347.478 3.000 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001423243704 1381669602 /nfs/dbraw/zinc/66/96/02/1381669602.db2.gz JJHMQFPZTFLSGN-ROUUACIJSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001423243704 1381669616 /nfs/dbraw/zinc/66/96/16/1381669616.db2.gz JJHMQFPZTFLSGN-ROUUACIJSA-N 1 3 345.462 2.581 10 0 EFAEHO C[C@@H](NC1(CNC(=O)CC2CC[NH+](C)CC2)CC1)c1ccc(F)cc1 ZINC001423289443 1381747785 /nfs/dbraw/zinc/74/77/85/1381747785.db2.gz RVPKTKUORZUEOE-OAHLLOKOSA-N 1 3 347.478 2.857 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]C/C=C\c2ccccc2)CC1 ZINC001423308255 1381763772 /nfs/dbraw/zinc/76/37/72/1381763772.db2.gz PNZRSSIUERXEJB-RPPGEJNMSA-N 1 3 341.499 2.811 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NCC2(NCc3ccccc3C3CC3)CC2)C1 ZINC001423308017 1381763879 /nfs/dbraw/zinc/76/38/79/1381763879.db2.gz WIWNKTWGTRDDAH-MRXNPFEDSA-N 1 3 341.499 2.644 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NCC2(NCc3ccccc3C3CC3)CC2)C1 ZINC001423308017 1381763885 /nfs/dbraw/zinc/76/38/85/1381763885.db2.gz WIWNKTWGTRDDAH-MRXNPFEDSA-N 1 3 341.499 2.644 10 0 EFAEHO CC[C@@H](C)C[N@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001423338702 1381806753 /nfs/dbraw/zinc/80/67/53/1381806753.db2.gz RLANMXFYNRREGA-APWZRJJASA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@@H](C)C[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001423338702 1381806758 /nfs/dbraw/zinc/80/67/58/1381806758.db2.gz RLANMXFYNRREGA-APWZRJJASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2cc3ccccc3o2)C[C@H]1C ZINC001423353084 1381831681 /nfs/dbraw/zinc/83/16/81/1381831681.db2.gz JYDKZVWGTFMUBH-NVXWUHKLSA-N 1 3 343.471 2.852 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@]12CCC[C@@H]1N(CCC(F)(F)F)CC2 ZINC001423374411 1381872282 /nfs/dbraw/zinc/87/22/82/1381872282.db2.gz YBJQZRKNMABVNM-HOCLYGCPSA-N 1 3 349.441 2.784 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@]12CCC[C@@H]1N(CCC(F)(F)F)CC2 ZINC001423374411 1381872292 /nfs/dbraw/zinc/87/22/92/1381872292.db2.gz YBJQZRKNMABVNM-HOCLYGCPSA-N 1 3 349.441 2.784 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001423421789 1381931576 /nfs/dbraw/zinc/93/15/76/1381931576.db2.gz QALFRFKASQHHLR-UXHICEINSA-N 1 3 345.531 2.964 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(C)nc2C)C[C@H]1C ZINC001423458522 1381960750 /nfs/dbraw/zinc/96/07/50/1381960750.db2.gz WLSVRSQHAIHCCK-APWZRJJASA-N 1 3 346.519 2.509 10 0 EFAEHO C[C@H](NC[C@H]1CCCN1C(=O)CC[NH+](C)C)c1ccc(F)cc1F ZINC001423477068 1381972814 /nfs/dbraw/zinc/97/28/14/1381972814.db2.gz JYSJBCFAVAZEDJ-DZGCQCFKSA-N 1 3 339.430 2.558 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC1(C)CCN(CCC(F)(F)F)CC1 ZINC001423502765 1381992556 /nfs/dbraw/zinc/99/25/56/1381992556.db2.gz FYCKNXKXFXDYKL-CQSZACIVSA-N 1 3 349.441 2.784 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC1(C)CCN(CCC(F)(F)F)CC1 ZINC001423502765 1381992561 /nfs/dbraw/zinc/99/25/61/1381992561.db2.gz FYCKNXKXFXDYKL-CQSZACIVSA-N 1 3 349.441 2.784 10 0 EFAEHO CCC[NH+]1CCC(C)(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001423503954 1381993892 /nfs/dbraw/zinc/99/38/92/1381993892.db2.gz AXAWTLBWGGNFFD-SFHVURJKSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1ccccc1F)C1CCCC1)N(C)C ZINC001423549422 1382050302 /nfs/dbraw/zinc/05/03/02/1382050302.db2.gz XPGOESRRGZTGMD-RTBURBONSA-N 1 3 349.494 2.931 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)CCN(C(=O)[C@H]1CCCN1C)C(C)C ZINC001423557922 1382063948 /nfs/dbraw/zinc/06/39/48/1382063948.db2.gz SFMZHDHDBMWACS-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1ccccc1C[N@H+](C)CCN(C(=O)[C@H]1CCCN1C)C(C)C ZINC001423557922 1382063954 /nfs/dbraw/zinc/06/39/54/1382063954.db2.gz SFMZHDHDBMWACS-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO CC(C)(C)[C@@H](C[NH2+]CC1CC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001423606687 1382155272 /nfs/dbraw/zinc/15/52/72/1382155272.db2.gz NNAPFVUMSHMIJO-DNVCBOLYSA-N 1 3 341.515 2.729 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@]2(C)CCN(C(=O)CN3CC[C@@H](C)C3)C2)cc1 ZINC001423626312 1382190497 /nfs/dbraw/zinc/19/04/97/1382190497.db2.gz HJTXKFZIWMZRKH-WIYYLYMNSA-N 1 3 343.515 2.665 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C1CC[NH+](CC2CCCC2)CC1)N(C)C ZINC001423646459 1382219025 /nfs/dbraw/zinc/21/90/25/1382219025.db2.gz QWDOVVOAIKHQDT-VQIMIIECSA-N 1 3 337.552 2.980 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C1CC(NCC=C(Cl)Cl)C1 ZINC001423688460 1382292449 /nfs/dbraw/zinc/29/24/49/1382292449.db2.gz PYSIZFVCLOEOGB-JXQTWKCFSA-N 1 3 348.318 2.759 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N(C)C1CC(NCC=C(Cl)Cl)C1 ZINC001423688460 1382292454 /nfs/dbraw/zinc/29/24/54/1382292454.db2.gz PYSIZFVCLOEOGB-JXQTWKCFSA-N 1 3 348.318 2.759 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CCC[C@](C)(CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001423708419 1382332707 /nfs/dbraw/zinc/33/27/07/1382332707.db2.gz UVGVZVPHNRVQOM-QFBILLFUSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](F)CC[N@H+]1CCC[C@](C)(CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001423708419 1382332713 /nfs/dbraw/zinc/33/27/13/1382332713.db2.gz UVGVZVPHNRVQOM-QFBILLFUSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(F)c1 ZINC001424036454 1382650712 /nfs/dbraw/zinc/65/07/12/1382650712.db2.gz AEUPFDJVVFOYHS-RBUKOAKNSA-N 1 3 347.478 2.733 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(F)c1 ZINC001424036454 1382650718 /nfs/dbraw/zinc/65/07/18/1382650718.db2.gz AEUPFDJVVFOYHS-RBUKOAKNSA-N 1 3 347.478 2.733 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001438776015 1388805920 /nfs/dbraw/zinc/80/59/20/1388805920.db2.gz XAXLCKLETBIQRY-VQIMIIECSA-N 1 3 349.494 2.801 10 0 EFAEHO CN(CCC[N@H+](C)[C@@H]1CCc2ccccc21)C(=O)[C@@H]1CCCN1C ZINC001424272569 1382915447 /nfs/dbraw/zinc/91/54/47/1382915447.db2.gz GVHHXHJPLMUQOI-MOPGFXCFSA-N 1 3 329.488 2.548 10 0 EFAEHO CN(CCC[N@@H+](C)[C@@H]1CCc2ccccc21)C(=O)[C@@H]1CCCN1C ZINC001424272569 1382915453 /nfs/dbraw/zinc/91/54/53/1382915453.db2.gz GVHHXHJPLMUQOI-MOPGFXCFSA-N 1 3 329.488 2.548 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+][C@H](C)c1cccc(Cl)c1 ZINC001439182940 1389036406 /nfs/dbraw/zinc/03/64/06/1389036406.db2.gz WQVYBBHOSFYCQB-ZIAGYGMSSA-N 1 3 325.884 2.836 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCN(C)C(=O)CN2CCCC2)cc1C ZINC001424329299 1382941945 /nfs/dbraw/zinc/94/19/45/1382941945.db2.gz BCBJHKJHQHRHHX-UHFFFAOYSA-N 1 3 331.504 2.680 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCN(C)C(=O)CN2CCCC2)cc1C ZINC001424329299 1382941949 /nfs/dbraw/zinc/94/19/49/1382941949.db2.gz BCBJHKJHQHRHHX-UHFFFAOYSA-N 1 3 331.504 2.680 10 0 EFAEHO CC(C)CCC(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CC2CC2)CC1 ZINC001424336922 1382952595 /nfs/dbraw/zinc/95/25/95/1382952595.db2.gz AZYFNYHTYPUVDK-BGYRXZFFSA-N 1 3 347.547 2.972 10 0 EFAEHO Cc1ccc(CC[NH2+]C2(C)CCN(C(=O)CN3CCCC3)CC2)cc1 ZINC001424499221 1383053044 /nfs/dbraw/zinc/05/30/44/1383053044.db2.gz OPJOOJNUONDCKV-UHFFFAOYSA-N 1 3 343.515 2.604 10 0 EFAEHO Cc1ccc(CC[N@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001424556402 1383104447 /nfs/dbraw/zinc/10/44/47/1383104447.db2.gz DZKOXMQAODYVBA-AZUAARDMSA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1ccc(CC[N@@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001424556402 1383104450 /nfs/dbraw/zinc/10/44/50/1383104450.db2.gz DZKOXMQAODYVBA-AZUAARDMSA-N 1 3 345.531 2.847 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+][C@@H]1CCCc2ccccc21)N(C)C ZINC001424583835 1383164931 /nfs/dbraw/zinc/16/49/31/1383164931.db2.gz ZUWQQSIHXCPACU-KFKAGJAMSA-N 1 3 331.504 2.889 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([C@H]2CC[N@H+](CCC(C)C)C2)C1 ZINC001424696064 1383269121 /nfs/dbraw/zinc/26/91/21/1383269121.db2.gz IHGOGYUGUXUQJF-MOPGFXCFSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([C@H]2CC[N@@H+](CCC(C)C)C2)C1 ZINC001424696064 1383269124 /nfs/dbraw/zinc/26/91/24/1383269124.db2.gz IHGOGYUGUXUQJF-MOPGFXCFSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@H]1CCCN1C(=O)[C@@H](C(C)C)N(C)C ZINC001424703443 1383276293 /nfs/dbraw/zinc/27/62/93/1383276293.db2.gz XGSVJPRCFSNHKS-QZTJIDSGSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@H]1CCCN1C(=O)[C@@H](C(C)C)N(C)C ZINC001424703443 1383276297 /nfs/dbraw/zinc/27/62/97/1383276297.db2.gz XGSVJPRCFSNHKS-QZTJIDSGSA-N 1 3 325.541 2.932 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1F ZINC001424738749 1383308011 /nfs/dbraw/zinc/30/80/11/1383308011.db2.gz BMWGICDLVOVNQC-FAFZWHIHSA-N 1 3 349.494 2.705 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2c(C)cccc2C)C1)N(C)C ZINC001424745791 1383314962 /nfs/dbraw/zinc/31/49/62/1383314962.db2.gz DQWZMOBQXBJDCF-FAFZWHIHSA-N 1 3 331.504 2.628 10 0 EFAEHO C[C@H](NCc1ccccc1F)[C@H](C)NC(=O)CC[NH+]1CCCCC1 ZINC001424852414 1383418947 /nfs/dbraw/zinc/41/89/47/1383418947.db2.gz JCHTWSRXSQMXJX-HOTGVXAUSA-N 1 3 335.467 2.685 10 0 EFAEHO Cc1cc(C[NH2+]CC(C)(C)CN(C)C(=O)CN(C)C(C)C)cs1 ZINC001424902060 1383477563 /nfs/dbraw/zinc/47/75/63/1383477563.db2.gz SRACEXPTVVFTHY-UHFFFAOYSA-N 1 3 339.549 2.971 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)[C@@H](C)CNC(=O)[C@H]1CC[N@H+](C)C1 ZINC001425070609 1383515763 /nfs/dbraw/zinc/51/57/63/1383515763.db2.gz LKTRYFKWGAZHFM-HOCLYGCPSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)[C@@H](C)CNC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001425070609 1383515765 /nfs/dbraw/zinc/51/57/65/1383515765.db2.gz LKTRYFKWGAZHFM-HOCLYGCPSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cccc(CCC[NH+]2CC([C@H](C)NC(=O)CN(C)C(C)C)C2)c1 ZINC001425265742 1383581415 /nfs/dbraw/zinc/58/14/15/1383581415.db2.gz PNYIHCPCEGGXEB-SFHVURJKSA-N 1 3 345.531 2.704 10 0 EFAEHO CC(C)C[N@@H+]1C[C@@H](NC(=O)[C@@H](C(C)C)N2CCCCC2)C(C)(C)C1 ZINC001425307159 1383601380 /nfs/dbraw/zinc/60/13/80/1383601380.db2.gz XMVOSIOMLULOAB-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)C[N@H+]1C[C@@H](NC(=O)[C@@H](C(C)C)N2CCCCC2)C(C)(C)C1 ZINC001425307159 1383601382 /nfs/dbraw/zinc/60/13/82/1383601382.db2.gz XMVOSIOMLULOAB-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C3CCC3)C2)c1 ZINC001425394792 1383646855 /nfs/dbraw/zinc/64/68/55/1383646855.db2.gz WJQPCUVXVBKKMS-UAPYVXQJSA-N 1 3 343.515 2.772 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@H]1C[C@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001425882590 1383824310 /nfs/dbraw/zinc/82/43/10/1383824310.db2.gz DWDOKEVHACTGFX-PXNSSMCTSA-N 1 3 345.531 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc(Cl)cc2)C[C@@H]1C ZINC001425887487 1383830575 /nfs/dbraw/zinc/83/05/75/1383830575.db2.gz JXTMLRMGZSAPLX-YOEHRIQHSA-N 1 3 337.895 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]C/C=C\c2ccccc2)C(C)(C)C1 ZINC001425979102 1383913955 /nfs/dbraw/zinc/91/39/55/1383913955.db2.gz UHWWUUNSWKRQJE-UZRURVBFSA-N 1 3 343.515 2.867 10 0 EFAEHO C[C@@H](c1ccc2c(c1)CCC2)[N@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001438940390 1388940497 /nfs/dbraw/zinc/94/04/97/1388940497.db2.gz YCYNJPPXWMHGAB-KRWDZBQOSA-N 1 3 343.515 2.722 10 0 EFAEHO C[C@@H](c1ccc2c(c1)CCC2)[N@@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001438940390 1388940502 /nfs/dbraw/zinc/94/05/02/1388940502.db2.gz YCYNJPPXWMHGAB-KRWDZBQOSA-N 1 3 343.515 2.722 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001438940364 1388940626 /nfs/dbraw/zinc/94/06/26/1388940626.db2.gz YDYNKZPNWKBEDY-GOSISDBHSA-N 1 3 345.531 2.522 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001438940364 1388940630 /nfs/dbraw/zinc/94/06/30/1388940630.db2.gz YDYNKZPNWKBEDY-GOSISDBHSA-N 1 3 345.531 2.522 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2CC2CC3(CCC3)C2)C1 ZINC001438951791 1388948805 /nfs/dbraw/zinc/94/88/05/1388948805.db2.gz OQUGJBPLRFHVJQ-RTBURBONSA-N 1 3 347.547 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2CC2CC3(CCC3)C2)C1 ZINC001438951791 1388948811 /nfs/dbraw/zinc/94/88/11/1388948811.db2.gz OQUGJBPLRFHVJQ-RTBURBONSA-N 1 3 347.547 2.830 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H]2CCC[C@H]2NC(=O)CN(C)C(C)C)c1 ZINC001438966172 1388956061 /nfs/dbraw/zinc/95/60/61/1388956061.db2.gz REQAAPPGECDLSM-QFBILLFUSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+][C@@H](C)c1cc(F)ccc1F ZINC001439079291 1388983221 /nfs/dbraw/zinc/98/32/21/1388983221.db2.gz WORDIXKGNSBKQW-KGLIPLIRSA-N 1 3 341.446 2.850 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@@H]2CCC[N@@H+]2C(C)C)c1 ZINC001439109755 1388996028 /nfs/dbraw/zinc/99/60/28/1388996028.db2.gz IORSMBCUCWLUNE-QAPCUYQASA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@@H]2CCC[N@H+]2C(C)C)c1 ZINC001439109755 1388996030 /nfs/dbraw/zinc/99/60/30/1388996030.db2.gz IORSMBCUCWLUNE-QAPCUYQASA-N 1 3 335.467 2.601 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@H+](CC2CCC2)CC1(C)C)N1CCCC1 ZINC001506752107 1406253995 /nfs/dbraw/zinc/25/39/95/1406253995.db2.gz GMSRTLRQWZSKBT-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@@H+](CC2CCC2)CC1(C)C)N1CCCC1 ZINC001506752107 1406254000 /nfs/dbraw/zinc/25/40/00/1406254000.db2.gz GMSRTLRQWZSKBT-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCCC(C)C)C[C@H]21 ZINC001506798454 1406286763 /nfs/dbraw/zinc/28/67/63/1406286763.db2.gz YQJYYDUVCYPPNW-OKYOBFRVSA-N 1 3 335.536 2.591 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]1[C@H]2C[N@H+](CCCC(C)C)C[C@H]21 ZINC001506798454 1406286767 /nfs/dbraw/zinc/28/67/67/1406286767.db2.gz YQJYYDUVCYPPNW-OKYOBFRVSA-N 1 3 335.536 2.591 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H]2C[N@H+](CCC3CC3)C[C@@H]2C1)CC(C)(C)C ZINC001506851523 1406334094 /nfs/dbraw/zinc/33/40/94/1406334094.db2.gz DLZIFRNLGWYQSK-GBESFXJTSA-N 1 3 349.563 2.981 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CCC3CC3)C[C@@H]2C1)CC(C)(C)C ZINC001506851523 1406334105 /nfs/dbraw/zinc/33/41/05/1406334105.db2.gz DLZIFRNLGWYQSK-GBESFXJTSA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@H](C(=O)N3CCN(C)C4(CCCCC4)C3)C[N@@H+]2C1 ZINC001434006507 1387053073 /nfs/dbraw/zinc/05/30/73/1387053073.db2.gz JLZNPMTYIPWUAZ-FGTMMUONSA-N 1 3 333.520 2.584 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@H](C(=O)N3CCN(C)C4(CCCCC4)C3)C[N@H+]2C1 ZINC001434006507 1387053085 /nfs/dbraw/zinc/05/30/85/1387053085.db2.gz JLZNPMTYIPWUAZ-FGTMMUONSA-N 1 3 333.520 2.584 10 0 EFAEHO C[NH+](C)[C@H]1C[C@H](NC(=O)c2cccc(CN3CCCC3)c2)C1(C)C ZINC001434121579 1387098355 /nfs/dbraw/zinc/09/83/55/1387098355.db2.gz WUGZMSAKWPLGSH-ROUUACIJSA-N 1 3 329.488 2.741 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001439138128 1389009323 /nfs/dbraw/zinc/00/93/23/1389009323.db2.gz GNVXYPYQCHWBCK-GFCCVEGCSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc2ccccc2c1)NC(=O)CN1CC[C@H](C)C1 ZINC001439253100 1389075475 /nfs/dbraw/zinc/07/54/75/1389075475.db2.gz LYDJJLDPRFKEAI-IRXDYDNUSA-N 1 3 339.483 2.776 10 0 EFAEHO C[C@@H](CNCc1ccccc1F)NC(=O)[C@H](C)[NH+]1CCCCCC1 ZINC001439256751 1389077669 /nfs/dbraw/zinc/07/76/69/1389077669.db2.gz ISMHFASGKWHYQK-HOTGVXAUSA-N 1 3 335.467 2.685 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc(Cl)cc1 ZINC001439284970 1389096088 /nfs/dbraw/zinc/09/60/88/1389096088.db2.gz NGOZDINSAXGJIE-YOEHRIQHSA-N 1 3 337.895 2.809 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3nc[nH]c3C)C[C@H]2C1 ZINC001506860184 1406358022 /nfs/dbraw/zinc/35/80/22/1406358022.db2.gz VVZMDSXKNINZHK-KJUCQMERSA-N 1 3 344.503 2.834 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3nc[nH]c3C)C[C@H]2C1 ZINC001506860184 1406358034 /nfs/dbraw/zinc/35/80/34/1406358034.db2.gz VVZMDSXKNINZHK-KJUCQMERSA-N 1 3 344.503 2.834 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1F ZINC001439361885 1389187588 /nfs/dbraw/zinc/18/75/88/1389187588.db2.gz ACMVCIAKKCXKHE-RYRKJORJSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1F ZINC001439361885 1389187593 /nfs/dbraw/zinc/18/75/93/1389187593.db2.gz ACMVCIAKKCXKHE-RYRKJORJSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001439403117 1389248789 /nfs/dbraw/zinc/24/87/89/1389248789.db2.gz SCNFRGXPDZEQQX-SJLPKXTDSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001439403117 1389248796 /nfs/dbraw/zinc/24/87/96/1389248796.db2.gz SCNFRGXPDZEQQX-SJLPKXTDSA-N 1 3 343.515 2.842 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@]1(C)CCCN(CCc2ccccc2F)C1 ZINC001439938117 1389357244 /nfs/dbraw/zinc/35/72/44/1389357244.db2.gz ILHTXMZSHUDDKU-FQEVSTJZSA-N 1 3 349.494 2.538 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCc1cccs1)C2 ZINC001440107579 1389389102 /nfs/dbraw/zinc/38/91/02/1389389102.db2.gz GMKFQMBHWWTBOC-BBWFWOEESA-N 1 3 349.544 2.602 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCc1cccs1)C2 ZINC001440107579 1389389108 /nfs/dbraw/zinc/38/91/08/1389389108.db2.gz GMKFQMBHWWTBOC-BBWFWOEESA-N 1 3 349.544 2.602 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NCc1ccc([C@@H](C)NCCF)cc1 ZINC001440226796 1389457067 /nfs/dbraw/zinc/45/70/67/1389457067.db2.gz VTQMACXCHGCIMT-QAPCUYQASA-N 1 3 335.467 2.796 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NCc1ccc([C@@H](C)NCCF)cc1 ZINC001440226796 1389457070 /nfs/dbraw/zinc/45/70/70/1389457070.db2.gz VTQMACXCHGCIMT-QAPCUYQASA-N 1 3 335.467 2.796 10 0 EFAEHO C[C@H](C(=O)N(C)C[C@@H]1CC[N@@H+]1CC1CCCC1)N1CCCCCC1 ZINC001440232484 1389461292 /nfs/dbraw/zinc/46/12/92/1389461292.db2.gz AYONQZDBVPMSOO-MJGOQNOKSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@H](C(=O)N(C)C[C@@H]1CC[N@H+]1CC1CCCC1)N1CCCCCC1 ZINC001440232484 1389461298 /nfs/dbraw/zinc/46/12/98/1389461298.db2.gz AYONQZDBVPMSOO-MJGOQNOKSA-N 1 3 335.536 2.974 10 0 EFAEHO CCc1ccccc1CN1CC[C@H]1CN(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001440265069 1389488350 /nfs/dbraw/zinc/48/83/50/1389488350.db2.gz OMUBLLPWFPEQSL-XLIONFOSSA-N 1 3 343.515 2.624 10 0 EFAEHO CCc1ccccc1CN1CC[C@H]1CN(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001440265069 1389488359 /nfs/dbraw/zinc/48/83/59/1389488359.db2.gz OMUBLLPWFPEQSL-XLIONFOSSA-N 1 3 343.515 2.624 10 0 EFAEHO CCc1ccccc1CN1CC[C@H]1CN(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001440265062 1389488563 /nfs/dbraw/zinc/48/85/63/1389488563.db2.gz OMUBLLPWFPEQSL-PXNSSMCTSA-N 1 3 343.515 2.624 10 0 EFAEHO CCc1ccccc1CN1CC[C@H]1CN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001440265062 1389488566 /nfs/dbraw/zinc/48/85/66/1389488566.db2.gz OMUBLLPWFPEQSL-PXNSSMCTSA-N 1 3 343.515 2.624 10 0 EFAEHO CN(CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccsc2)C1)CC(C)(C)C ZINC001440300468 1389514483 /nfs/dbraw/zinc/51/44/83/1389514483.db2.gz FHHYRMXQVCUBRH-IYBDPMFKSA-N 1 3 337.533 2.710 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CC3(CCC3)C2)C1 ZINC001440312312 1389524954 /nfs/dbraw/zinc/52/49/54/1389524954.db2.gz DIMKTLLFPZDHDN-MTNOOBJLSA-N 1 3 347.547 2.924 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1C[C@@H]([NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001440323225 1389534391 /nfs/dbraw/zinc/53/43/91/1389534391.db2.gz RABVHJKBRXYRHH-JQHSSLGASA-N 1 3 335.536 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+][C@H]2CCc3ccc(F)cc32)C1 ZINC001440362033 1389567838 /nfs/dbraw/zinc/56/78/38/1389567838.db2.gz KACINMBUBAPCHZ-FNHZYXHNSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+]Cc2cccc(C(C)C)n2)C1)N(C)C ZINC001440362625 1389567990 /nfs/dbraw/zinc/56/79/90/1389567990.db2.gz FXMJOJXJOWYGIV-IEZWGBDMSA-N 1 3 346.519 2.530 10 0 EFAEHO Cc1ccccc1C[N@H+]1CCC[C@@H](NC(=O)CN(C)C(C)C)CC1 ZINC001440394308 1389589365 /nfs/dbraw/zinc/58/93/65/1389589365.db2.gz FMMPLDOKQMFROF-LJQANCHMSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CCC[C@@H](NC(=O)CN(C)C(C)C)CC1 ZINC001440394308 1389589369 /nfs/dbraw/zinc/58/93/69/1389589369.db2.gz FMMPLDOKQMFROF-LJQANCHMSA-N 1 3 331.504 2.806 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2cccc(F)c2)C1)N(C)C ZINC001440397689 1389594745 /nfs/dbraw/zinc/59/47/45/1389594745.db2.gz AMZVMRSZFIHGIG-JQHSSLGASA-N 1 3 335.467 2.540 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]CCc3cccs3)C2)C1 ZINC001440402738 1389601339 /nfs/dbraw/zinc/60/13/39/1389601339.db2.gz RNIRJLLYIIKOBC-IXDOHACOSA-N 1 3 349.544 2.507 10 0 EFAEHO CC[C@H](F)CN1CCC[C@H](NC(=O)CCC[NH+]2CCCCC2)CC1 ZINC001440405092 1389604368 /nfs/dbraw/zinc/60/43/68/1389604368.db2.gz QBBDQTONQBEZJL-ROUUACIJSA-N 1 3 341.515 2.971 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@@H]([NH2+][C@H](C)c2ccccc2)C1 ZINC001440409422 1389609307 /nfs/dbraw/zinc/60/93/07/1389609307.db2.gz HLMQMZPDQJWEHH-UWWQBHOKSA-N 1 3 340.471 2.896 10 0 EFAEHO CN(CCCN(C)C(=O)C12CCC[NH+](CCC1)C2)CCC(F)(F)F ZINC001440426872 1389624612 /nfs/dbraw/zinc/62/46/12/1389624612.db2.gz ISSMWBZSNYJUAY-UHFFFAOYSA-N 1 3 349.441 2.595 10 0 EFAEHO CN(CCC[N@H+](C)CC1CC2(CCC2)C1)C(=O)CN(C)C1CCC1 ZINC001440429025 1389627668 /nfs/dbraw/zinc/62/76/68/1389627668.db2.gz DMUGYYRHQLYXES-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CN(CCC[N@@H+](C)CC1CC2(CCC2)C1)C(=O)CN(C)C1CCC1 ZINC001440429025 1389627679 /nfs/dbraw/zinc/62/76/79/1389627679.db2.gz DMUGYYRHQLYXES-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@H]2CCC[N@H+](CC3CCC3)[C@@H]2C1(C)C ZINC001440457211 1389656554 /nfs/dbraw/zinc/65/65/54/1389656554.db2.gz VFODROZCXBQCQD-QRQLOZEOSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@H]2CCC[N@@H+](CC3CCC3)[C@@H]2C1(C)C ZINC001440457211 1389656557 /nfs/dbraw/zinc/65/65/57/1389656557.db2.gz VFODROZCXBQCQD-QRQLOZEOSA-N 1 3 335.536 2.734 10 0 EFAEHO C[N@H+](CCC(=O)N1CCCCC[C@H](NCCF)C1)C1CCCCC1 ZINC001440472906 1389678352 /nfs/dbraw/zinc/67/83/52/1389678352.db2.gz LLNIZNJFHHONIE-KRWDZBQOSA-N 1 3 341.515 2.971 10 0 EFAEHO C[N@@H+](CCC(=O)N1CCCCC[C@H](NCCF)C1)C1CCCCC1 ZINC001440472906 1389678355 /nfs/dbraw/zinc/67/83/55/1389678355.db2.gz LLNIZNJFHHONIE-KRWDZBQOSA-N 1 3 341.515 2.971 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2C)[C@@H]1C ZINC001440492550 1389696699 /nfs/dbraw/zinc/69/66/99/1389696699.db2.gz XWVOUOGMLHTPBF-QRQLOZEOSA-N 1 3 349.494 2.754 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2C)[C@@H]1C ZINC001440492550 1389696701 /nfs/dbraw/zinc/69/67/01/1389696701.db2.gz XWVOUOGMLHTPBF-QRQLOZEOSA-N 1 3 349.494 2.754 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CC[C@@H](C)F)CC(C)(C)C1 ZINC001440526553 1389728769 /nfs/dbraw/zinc/72/87/69/1389728769.db2.gz FMLXYRCGTBTLFY-CVEARBPZSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CC[C@@H](C)F)CC(C)(C)C1 ZINC001440526553 1389728775 /nfs/dbraw/zinc/72/87/75/1389728775.db2.gz FMLXYRCGTBTLFY-CVEARBPZSA-N 1 3 329.504 2.682 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NCc1ccc2c(c1)CN(CC1CC1)C2 ZINC001440579412 1389759804 /nfs/dbraw/zinc/75/98/04/1389759804.db2.gz NQYYXHMSNXXPPF-HZPDHXFCSA-N 1 3 341.499 2.901 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@H](NC(=O)CN(C)C(C)C)C(C)(C)C1 ZINC001440616905 1389776655 /nfs/dbraw/zinc/77/66/55/1389776655.db2.gz CBJZOMRPFVNKIK-KRWDZBQOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@H](NC(=O)CN(C)C(C)C)C(C)(C)C1 ZINC001440616905 1389776658 /nfs/dbraw/zinc/77/66/58/1389776658.db2.gz CBJZOMRPFVNKIK-KRWDZBQOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CCCc2ccccc2)[C@H](C)C1 ZINC001440654180 1389801336 /nfs/dbraw/zinc/80/13/36/1389801336.db2.gz UQLJNWGJNBDZSV-UYAOXDASSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CCCc2ccccc2)[C@H](C)C1 ZINC001440654180 1389801345 /nfs/dbraw/zinc/80/13/45/1389801345.db2.gz UQLJNWGJNBDZSV-UYAOXDASSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CCCc2ccccc2)[C@H](C)C1 ZINC001440654179 1389801530 /nfs/dbraw/zinc/80/15/30/1389801530.db2.gz UQLJNWGJNBDZSV-QUCCMNQESA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CCCc2ccccc2)[C@H](C)C1 ZINC001440654179 1389801534 /nfs/dbraw/zinc/80/15/34/1389801534.db2.gz UQLJNWGJNBDZSV-QUCCMNQESA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N1CCc2ccccc2[C@H]1CNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001440688922 1389817973 /nfs/dbraw/zinc/81/79/73/1389817973.db2.gz LBUYRWWGOWPGHL-AZUAARDMSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N1CCc2ccccc2[C@H]1CNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001440688922 1389817978 /nfs/dbraw/zinc/81/79/78/1389817978.db2.gz LBUYRWWGOWPGHL-AZUAARDMSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001440692766 1389822266 /nfs/dbraw/zinc/82/22/66/1389822266.db2.gz RKGQIXPTYBCDMQ-HNNXBMFYSA-N 1 3 331.460 2.757 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H](C[NH2+]CC3CCCCCC3)C2)CCC1 ZINC001506886432 1406404398 /nfs/dbraw/zinc/40/43/98/1406404398.db2.gz KUMUONJWCHTVOZ-IYARVYRRSA-N 1 3 335.536 2.926 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@@H]2CCCc3ccccc32)C1 ZINC001440758952 1389873609 /nfs/dbraw/zinc/87/36/09/1389873609.db2.gz CSTUCKLGUUXXRF-OUNSHVDWSA-N 1 3 343.515 2.890 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@H](C)c2ccc(F)cc2)C1 ZINC001440758895 1389874100 /nfs/dbraw/zinc/87/41/00/1389874100.db2.gz BZVGQJFJGNPFOZ-KSTDHSDQSA-N 1 3 335.467 2.713 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC2CC(NC(=O)CN(C)C(C)C)C2)c1 ZINC001440764648 1389878171 /nfs/dbraw/zinc/87/81/71/1389878171.db2.gz XUADESSFGOPQKD-UHFFFAOYSA-N 1 3 331.504 2.628 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001440804459 1389910337 /nfs/dbraw/zinc/91/03/37/1389910337.db2.gz YNSQUOKQOBOVLI-GJZGRUSLSA-N 1 3 343.471 2.900 10 0 EFAEHO C[C@@H](NC(=O)C1(C[NH+](C)C)CC1)[C@H](C)NCc1cc2ccccc2o1 ZINC001440819666 1389923776 /nfs/dbraw/zinc/92/37/76/1389923776.db2.gz NFSLFGHDIKXHDF-LSDHHAIUSA-N 1 3 343.471 2.757 10 0 EFAEHO COc1cccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)CC(C)(C)C)c1 ZINC001440828898 1389930384 /nfs/dbraw/zinc/93/03/84/1389930384.db2.gz GIPYUSZDSXJJMI-HZPDHXFCSA-N 1 3 349.519 2.656 10 0 EFAEHO COc1cccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)CC(C)(C)C)c1 ZINC001440828896 1389930713 /nfs/dbraw/zinc/93/07/13/1389930713.db2.gz GIPYUSZDSXJJMI-HOTGVXAUSA-N 1 3 349.519 2.656 10 0 EFAEHO C[C@H](NCc1ccccc1Cl)[C@H](C)NC(=O)C1CC[NH+](C)CC1 ZINC001440834542 1389935255 /nfs/dbraw/zinc/93/52/55/1389935255.db2.gz LMOPLBKNSMMTRD-KBPBESRZSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC(C)(C)C[NH2+]CC2CC(C)(C)C2)C1 ZINC001440881949 1389975849 /nfs/dbraw/zinc/97/58/49/1389975849.db2.gz KWYRAFCBGSQMAM-MRXNPFEDSA-N 1 3 337.552 2.839 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)[C@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001440950526 1390039686 /nfs/dbraw/zinc/03/96/86/1390039686.db2.gz FLMBKNIZPXXYBQ-QGZVFWFLSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccccc1C[N@H+](C)[C@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001440950526 1390039690 /nfs/dbraw/zinc/03/96/90/1390039690.db2.gz FLMBKNIZPXXYBQ-QGZVFWFLSA-N 1 3 331.504 2.806 10 0 EFAEHO C[C@H](CCC[NH2+]C/C=C\Cl)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001506938395 1406468835 /nfs/dbraw/zinc/46/88/35/1406468835.db2.gz QNFOWAOOMSUVSC-INOXOVODSA-N 1 3 347.906 2.826 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N1CCC(N(C)C(=O)CC[NH+](C)C)CC1 ZINC001441011922 1391031967 /nfs/dbraw/zinc/03/19/67/1391031967.db2.gz DRZPNBKVFMUIAN-HNNXBMFYSA-N 1 3 335.467 2.761 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)Cc1ccc2ncccc2c1 ZINC001441031944 1391047318 /nfs/dbraw/zinc/04/73/18/1391047318.db2.gz IAAFFOGDJBGNLF-INIZCTEOSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)Cc1ccc2ncccc2c1 ZINC001441031944 1391047328 /nfs/dbraw/zinc/04/73/28/1391047328.db2.gz IAAFFOGDJBGNLF-INIZCTEOSA-N 1 3 342.487 2.512 10 0 EFAEHO CCc1ccccc1CN1CC[C@H](NC(=O)CC[C@@H]2CCC[N@@H+]2C)C1 ZINC001441100891 1391092475 /nfs/dbraw/zinc/09/24/75/1391092475.db2.gz ZVWFMYQGQWAEKV-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccccc1CN1CC[C@H](NC(=O)CC[C@@H]2CCC[N@H+]2C)C1 ZINC001441100891 1391092479 /nfs/dbraw/zinc/09/24/79/1391092479.db2.gz ZVWFMYQGQWAEKV-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO Cc1ncccc1C[NH2+]CC1(NC(=O)CN(C)C(C)C)CCCCC1 ZINC001441105912 1391098695 /nfs/dbraw/zinc/09/86/95/1391098695.db2.gz JVUYAEUCCKXTDV-UHFFFAOYSA-N 1 3 346.519 2.639 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)[NH+]1CCCCCC1)C1CN(Cc2ccccc2)C1 ZINC001441177971 1391162185 /nfs/dbraw/zinc/16/21/85/1391162185.db2.gz BJSALROTQUTHPV-QZTJIDSGSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]([NH2+]CCc1ccccc1)C1CC1 ZINC001441189054 1391168637 /nfs/dbraw/zinc/16/86/37/1391168637.db2.gz CGLWULBGUGFKDI-PMACEKPBSA-N 1 3 343.515 2.586 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001441196382 1391173696 /nfs/dbraw/zinc/17/36/96/1391173696.db2.gz CCYMPCGOTORJFL-QFBILLFUSA-N 1 3 331.504 2.580 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@@H](C)c3cccc(F)c3)C[C@H]21 ZINC001441323983 1391251281 /nfs/dbraw/zinc/25/12/81/1391251281.db2.gz VUWQUNMHZWESBE-UDTPNQRGSA-N 1 3 347.478 2.523 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@@H](C)c3cccc(F)c3)C[C@H]21 ZINC001441323983 1391251285 /nfs/dbraw/zinc/25/12/85/1391251285.db2.gz VUWQUNMHZWESBE-UDTPNQRGSA-N 1 3 347.478 2.523 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001441351601 1391265250 /nfs/dbraw/zinc/26/52/50/1391265250.db2.gz IHUKOHSTLQJXIF-SNRMKQJTSA-N 1 3 349.494 2.705 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)C3(N(C)C)CCC3)C2)cc1 ZINC001441356598 1391265725 /nfs/dbraw/zinc/26/57/25/1391265725.db2.gz YVWPRZVNDLLZCW-WGSAOQKQSA-N 1 3 343.515 2.718 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc(C)cc2Cl)C1)N(C)C ZINC001441401096 1391283877 /nfs/dbraw/zinc/28/38/77/1391283877.db2.gz FGDHJVGKRBUZTO-ZOBUZTSGSA-N 1 3 337.895 2.725 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1C[C@H](NCc2cccc(F)c2Cl)C1 ZINC001441417724 1391292546 /nfs/dbraw/zinc/29/25/46/1391292546.db2.gz OIRPMKFKAJATBA-HDJSIYSDSA-N 1 3 341.858 2.558 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@H](NCc2cccc(F)c2Cl)C1 ZINC001441417724 1391292549 /nfs/dbraw/zinc/29/25/49/1391292549.db2.gz OIRPMKFKAJATBA-HDJSIYSDSA-N 1 3 341.858 2.558 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C[NH2+]Cc1ccsc1)C1CC1 ZINC001441456739 1391321889 /nfs/dbraw/zinc/32/18/89/1391321889.db2.gz BATAJBVUUPMCNU-MSOLQXFVSA-N 1 3 349.544 2.949 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2cc(F)ccc2F)C1 ZINC001441522884 1391350604 /nfs/dbraw/zinc/35/06/04/1391350604.db2.gz SQDQVNYUESNHAW-AEGPPILISA-N 1 3 339.430 2.604 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](N[C@H](C)c2cc(F)ccc2F)C1 ZINC001441529722 1391352375 /nfs/dbraw/zinc/35/23/75/1391352375.db2.gz QSMDNKSLQOFDCJ-YUELXQCFSA-N 1 3 339.430 2.604 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](N[C@H](C)c2cc(F)ccc2F)C1 ZINC001441529722 1391352379 /nfs/dbraw/zinc/35/23/79/1391352379.db2.gz QSMDNKSLQOFDCJ-YUELXQCFSA-N 1 3 339.430 2.604 10 0 EFAEHO CCc1cccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)c1 ZINC001441825997 1391420924 /nfs/dbraw/zinc/42/09/24/1391420924.db2.gz TVTQWYUNOQGUET-APWZRJJASA-N 1 3 331.504 2.668 10 0 EFAEHO C[C@@H](C[NH2+]C[C@H]1CCC(F)(F)C1)NC(=O)C(C)(C)N1CCCCC1 ZINC001445550198 1391532880 /nfs/dbraw/zinc/53/28/80/1391532880.db2.gz XLNBLYVADJYJRK-GJZGRUSLSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2ccccc2C2CC2)CC1 ZINC001446291640 1391552480 /nfs/dbraw/zinc/55/24/80/1391552480.db2.gz CGRWEUPGCNOFJW-UHFFFAOYSA-N 1 3 329.488 2.643 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001446948736 1391644802 /nfs/dbraw/zinc/64/48/02/1391644802.db2.gz SHXJBMKDHCCGRD-DLBZAZTESA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[N@H+](C)[C@H]2CCc3ccccc32)C1 ZINC001447358277 1391710631 /nfs/dbraw/zinc/71/06/31/1391710631.db2.gz ZROFUJNYBDJKMY-XLIONFOSSA-N 1 3 343.515 2.796 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[N@@H+](C)[C@H]2CCc3ccccc32)C1 ZINC001447358277 1391710635 /nfs/dbraw/zinc/71/06/35/1391710635.db2.gz ZROFUJNYBDJKMY-XLIONFOSSA-N 1 3 343.515 2.796 10 0 EFAEHO CC(C)N1Cc2ccc(CNC(=O)CC[C@@H]3CCC[N@@H+]3C)cc2C1 ZINC001447497262 1391716277 /nfs/dbraw/zinc/71/62/77/1391716277.db2.gz QIMWLRMMBTXGLA-IBGZPJMESA-N 1 3 329.488 2.901 10 0 EFAEHO CC(C)N1Cc2ccc(CNC(=O)CC[C@@H]3CCC[N@H+]3C)cc2C1 ZINC001447497262 1391716285 /nfs/dbraw/zinc/71/62/85/1391716285.db2.gz QIMWLRMMBTXGLA-IBGZPJMESA-N 1 3 329.488 2.901 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@H+](C)CCCc1ccsc1 ZINC001447771694 1391758601 /nfs/dbraw/zinc/75/86/01/1391758601.db2.gz KTFXBUXNALEICS-ROUUACIJSA-N 1 3 349.544 2.698 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@@H+](C)CCCc1ccsc1 ZINC001447771694 1391758603 /nfs/dbraw/zinc/75/86/03/1391758603.db2.gz KTFXBUXNALEICS-ROUUACIJSA-N 1 3 349.544 2.698 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](C)[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001447884858 1391790934 /nfs/dbraw/zinc/79/09/34/1391790934.db2.gz MJUAKJDNRIDVED-SJORKVTESA-N 1 3 331.504 2.852 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C1CCC([NH2+]C/C=C/Cl)CC1 ZINC001447943743 1391845875 /nfs/dbraw/zinc/84/58/75/1391845875.db2.gz CLOYHHSSYIPXJO-JXVZXWCCSA-N 1 3 341.927 2.973 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[N@H+](C)CCc1cccs1 ZINC001448067636 1391929836 /nfs/dbraw/zinc/92/98/36/1391929836.db2.gz PEKJYLCJDALORT-OAHLLOKOSA-N 1 3 337.533 2.602 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[N@@H+](C)CCc1cccs1 ZINC001448067636 1391929838 /nfs/dbraw/zinc/92/98/38/1391929838.db2.gz PEKJYLCJDALORT-OAHLLOKOSA-N 1 3 337.533 2.602 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H](C[NH2+]Cc2ccc(F)cc2)C1 ZINC001449057863 1392241533 /nfs/dbraw/zinc/24/15/33/1392241533.db2.gz IKRCYAXANIKFSY-SJLPKXTDSA-N 1 3 335.467 2.540 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@H](C1CC1)N(C)C(=O)C(C)(C)N1CCCCC1 ZINC001507013435 1406589419 /nfs/dbraw/zinc/58/94/19/1406589419.db2.gz PFQPAOXJFQJDRO-RDJZCZTQSA-N 1 3 341.515 2.826 10 0 EFAEHO C[NH+](C)[C@H]1C[C@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C1(C)C ZINC001452129442 1392890231 /nfs/dbraw/zinc/89/02/31/1392890231.db2.gz HWJJPNACMVYULY-HOTGVXAUSA-N 1 3 328.460 2.749 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@@H](C1CC1)N(C)C(=O)CN(C)C(C)C ZINC001507035815 1406624061 /nfs/dbraw/zinc/62/40/61/1406624061.db2.gz LWMNVLWRKSPIRQ-IBGZPJMESA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN(C)C1CCC1)[NH2+]CC[C@H]1CCCC1(F)F ZINC001507092156 1406691729 /nfs/dbraw/zinc/69/17/29/1406691729.db2.gz XNWGYTCMLUVUEG-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001507127538 1406740844 /nfs/dbraw/zinc/74/08/44/1406740844.db2.gz QWWCUKPATQQHTQ-RTBURBONSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+][C@H](C)CN(C)C(=O)Cc2c[nH]cn2)c1 ZINC001507129124 1406743427 /nfs/dbraw/zinc/74/34/27/1406743427.db2.gz NBUWOXJPUSIPFK-CVEARBPZSA-N 1 3 328.460 2.767 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)[C@H]1CCC[C@H]([NH+](C)C)C1)c1ccco1 ZINC001457819140 1395345525 /nfs/dbraw/zinc/34/55/25/1395345525.db2.gz ZIDREDURCZMTRI-LUKYLMHMSA-N 1 3 335.492 2.945 10 0 EFAEHO CN(CC1CCCCC1)C(=O)CN1CCC2(CC1)CC[NH+](C)CC2 ZINC001460601632 1396237627 /nfs/dbraw/zinc/23/76/27/1396237627.db2.gz GSNNACUXCLUERR-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO C[C@@H](C[NH+]1CCCCC1)NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC001464074799 1396544890 /nfs/dbraw/zinc/54/48/90/1396544890.db2.gz XCXUZHOJXJEGRL-HNNXBMFYSA-N 1 3 328.460 2.895 10 0 EFAEHO C[C@H](CN1CCOCC1)CN1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001473148384 1397285955 /nfs/dbraw/zinc/28/59/55/1397285955.db2.gz XPLCWONJZKMFRL-UXHICEINSA-N 1 3 337.552 2.543 10 0 EFAEHO C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C[N@@H+]1CCC[C@H](N(C)C)CC1 ZINC001473380076 1397298572 /nfs/dbraw/zinc/29/85/72/1397298572.db2.gz ORGMTOUNWSSONJ-ZACQAIPSSA-N 1 3 339.524 2.906 10 0 EFAEHO C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C[N@H+]1CCC[C@H](N(C)C)CC1 ZINC001473380076 1397298581 /nfs/dbraw/zinc/29/85/81/1397298581.db2.gz ORGMTOUNWSSONJ-ZACQAIPSSA-N 1 3 339.524 2.906 10 0 EFAEHO C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CN1CCC[C@H]([NH+](C)C)CC1 ZINC001473380076 1397298583 /nfs/dbraw/zinc/29/85/83/1397298583.db2.gz ORGMTOUNWSSONJ-ZACQAIPSSA-N 1 3 339.524 2.906 10 0 EFAEHO C[C@H](CN1CCOCC1)C[N@@H+]1CCC[C@@H]1CCN1CCC(C)CC1 ZINC001473716716 1397324199 /nfs/dbraw/zinc/32/41/99/1397324199.db2.gz JSWUTNJOUDANPW-WOJBJXKFSA-N 1 3 337.552 2.541 10 0 EFAEHO C[C@H](CN1CCOCC1)C[N@H+]1CCC[C@@H]1CCN1CCC(C)CC1 ZINC001473716716 1397324205 /nfs/dbraw/zinc/32/42/05/1397324205.db2.gz JSWUTNJOUDANPW-WOJBJXKFSA-N 1 3 337.552 2.541 10 0 EFAEHO CC[C@@]1(C(=O)OC(C)(C)C)CCC[N@H+](C[C@H](O)CN(C)C(C)C)C1 ZINC001473847975 1397339709 /nfs/dbraw/zinc/33/97/09/1397339709.db2.gz NLEIZZZMESYRAL-VQIMIIECSA-N 1 3 342.524 2.521 10 0 EFAEHO CC[C@@]1(C(=O)OC(C)(C)C)CCC[N@@H+](C[C@H](O)CN(C)C(C)C)C1 ZINC001473847975 1397339711 /nfs/dbraw/zinc/33/97/11/1397339711.db2.gz NLEIZZZMESYRAL-VQIMIIECSA-N 1 3 342.524 2.521 10 0 EFAEHO COc1ccccc1OCC[N@@H+]1C[C@@]23CN(C)C[C@]2(C1)CCCC3 ZINC001473900588 1397348368 /nfs/dbraw/zinc/34/83/68/1397348368.db2.gz CQVLFCIJHCARON-BGYRXZFFSA-N 1 3 330.472 2.882 10 0 EFAEHO COc1ccccc1OCC[N@H+]1C[C@@]23CN(C)C[C@]2(C1)CCCC3 ZINC001473900588 1397348374 /nfs/dbraw/zinc/34/83/74/1397348374.db2.gz CQVLFCIJHCARON-BGYRXZFFSA-N 1 3 330.472 2.882 10 0 EFAEHO CN(C(=O)CCN1C[C@]23C[N@H+](C)C[C@@]2(C1)CCCC3)c1ccccc1 ZINC001473900412 1397348451 /nfs/dbraw/zinc/34/84/51/1397348451.db2.gz ASKTTYPJZVYQLP-OYRHEFFESA-N 1 3 341.499 2.847 10 0 EFAEHO CN(C(=O)CCN1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3)c1ccccc1 ZINC001473900412 1397348454 /nfs/dbraw/zinc/34/84/54/1397348454.db2.gz ASKTTYPJZVYQLP-OYRHEFFESA-N 1 3 341.499 2.847 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2C[C@@H](C)N(C(=O)CN3CCCC3)C2)c1 ZINC001507329921 1406894546 /nfs/dbraw/zinc/89/45/46/1406894546.db2.gz CZXGXJYDMPLCSW-QUCCMNQESA-N 1 3 343.515 2.602 10 0 EFAEHO CN(C[C@@H]1CC[N@@H+]1CCC1CCCC1)C(=O)C(C)(C)N1CCCC1 ZINC001479237060 1397631415 /nfs/dbraw/zinc/63/14/15/1397631415.db2.gz DGCMXMWDHNOLMW-SFHVURJKSA-N 1 3 335.536 2.974 10 0 EFAEHO CN(C[C@@H]1CC[N@H+]1CCC1CCCC1)C(=O)C(C)(C)N1CCCC1 ZINC001479237060 1397631418 /nfs/dbraw/zinc/63/14/18/1397631418.db2.gz DGCMXMWDHNOLMW-SFHVURJKSA-N 1 3 335.536 2.974 10 0 EFAEHO CN(C[C@@H]1CCN1[C@@H]1CCc2ccccc21)C(=O)CCCC[NH+](C)C ZINC001479261611 1397651829 /nfs/dbraw/zinc/65/18/29/1397651829.db2.gz XTFASDBOLFMTGO-AZUAARDMSA-N 1 3 343.515 2.939 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2C[C@H]([NH2+]CC3CCC(C)CC3)C2)C1 ZINC001479321234 1397683542 /nfs/dbraw/zinc/68/35/42/1397683542.db2.gz KZAQJWWVAJWHLZ-NXANPBQISA-N 1 3 335.536 2.639 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@H]1C[C@@H](CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001479346167 1397698060 /nfs/dbraw/zinc/69/80/60/1397698060.db2.gz DGYMHEHJPCXURX-SUMDDJOVSA-N 1 3 331.504 2.892 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CCc2ccccc2)C1 ZINC001479346156 1397698219 /nfs/dbraw/zinc/69/82/19/1397698219.db2.gz DFIFDYQNMUSIJH-QGZVKYPTSA-N 1 3 343.515 2.586 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+][C@H](C)c2cccc(F)c2)C1 ZINC001479415523 1397719897 /nfs/dbraw/zinc/71/98/97/1397719897.db2.gz CXISNFKWOFNJAG-IIDMSEBBSA-N 1 3 335.467 2.711 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@H]2C[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001479417082 1397720481 /nfs/dbraw/zinc/72/04/81/1397720481.db2.gz QPCPYSYBDOFZIA-BQFCYCMXSA-N 1 3 347.503 2.581 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]CC2CC(C)(C)C2)C1 ZINC001479416763 1397720581 /nfs/dbraw/zinc/72/05/81/1397720581.db2.gz MPELTXOXXJICMX-CMIRHGDUSA-N 1 3 335.536 2.780 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CC2CC(C)(C)C2)C1)N(C)C ZINC001479457894 1397729527 /nfs/dbraw/zinc/72/95/27/1397729527.db2.gz OZWKMNMBCPQMNH-JQHSSLGASA-N 1 3 337.552 2.883 10 0 EFAEHO CC(C)C[NH2+][C@@H]1CC[C@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001479475156 1397732965 /nfs/dbraw/zinc/73/29/65/1397732965.db2.gz GIPYIANPQBCXJD-FRQCXROJSA-N 1 3 341.515 2.729 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N2CCCCC2)CC[N@@H+]1CC1CC1 ZINC001479647225 1397760350 /nfs/dbraw/zinc/76/03/50/1397760350.db2.gz GBAWUFDHSKEGCG-OTWHNJEPSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N2CCCCC2)CC[N@H+]1CC1CC1 ZINC001479647225 1397760352 /nfs/dbraw/zinc/76/03/52/1397760352.db2.gz GBAWUFDHSKEGCG-OTWHNJEPSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CC2CCC2)[C@@H]1C)N1CCCCC1 ZINC001479729589 1397783848 /nfs/dbraw/zinc/78/38/48/1397783848.db2.gz BRZJREXXGWLBEZ-NEWSRXKRSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CC2CCC2)[C@@H]1C)N1CCCCC1 ZINC001479729589 1397783851 /nfs/dbraw/zinc/78/38/51/1397783851.db2.gz BRZJREXXGWLBEZ-NEWSRXKRSA-N 1 3 335.536 2.876 10 0 EFAEHO CN(Cc1ccccc1)C[C@@H]1CCCCN1C(=O)CCC[NH+](C)C ZINC001479738502 1397792108 /nfs/dbraw/zinc/79/21/08/1397792108.db2.gz IMXOHXAQWBFWMK-IBGZPJMESA-N 1 3 331.504 2.841 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001479796513 1397877672 /nfs/dbraw/zinc/87/76/72/1397877672.db2.gz IWJBZOVOLMDFCH-INIZCTEOSA-N 1 3 345.531 2.892 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001479796513 1397877680 /nfs/dbraw/zinc/87/76/80/1397877680.db2.gz IWJBZOVOLMDFCH-INIZCTEOSA-N 1 3 345.531 2.892 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](CC)[C@H]1CCc2ccccc21)N(C)C ZINC001479859378 1397962508 /nfs/dbraw/zinc/96/25/08/1397962508.db2.gz DTPVZVPAPKZUBY-OALUTQOASA-N 1 3 331.504 2.842 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](CC)[C@H]1CCc2ccccc21)N(C)C ZINC001479859378 1397962513 /nfs/dbraw/zinc/96/25/13/1397962513.db2.gz DTPVZVPAPKZUBY-OALUTQOASA-N 1 3 331.504 2.842 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@]12CCC[C@H]1N(Cc1cccc(F)c1)CC2 ZINC001507346933 1406924003 /nfs/dbraw/zinc/92/40/03/1406924003.db2.gz FVYBMFOQZLVIJB-UYAOXDASSA-N 1 3 347.478 2.781 10 0 EFAEHO C[C@H](C(=O)N[C@@H]1CC[N@H+](CCCCCF)C1)N1CCCCCC1 ZINC001479965367 1398051366 /nfs/dbraw/zinc/05/13/66/1398051366.db2.gz UKZIHDVHYBHJPK-IAGOWNOFSA-N 1 3 327.488 2.581 10 0 EFAEHO C[C@H](C(=O)N[C@@H]1CC[N@@H+](CCCCCF)C1)N1CCCCCC1 ZINC001479965367 1398051373 /nfs/dbraw/zinc/05/13/73/1398051373.db2.gz UKZIHDVHYBHJPK-IAGOWNOFSA-N 1 3 327.488 2.581 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCN(CC2=CCCCC2)C1)[NH+]1CCCC1 ZINC001479973140 1398059471 /nfs/dbraw/zinc/05/94/71/1398059471.db2.gz XMPDVSBNYGZFOI-MOPGFXCFSA-N 1 3 333.520 2.798 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]([NH2+][C@H]2CCc3ccccc32)C2CC2)CCC1 ZINC001480024334 1398099816 /nfs/dbraw/zinc/09/98/16/1398099816.db2.gz SSCPGOZZRLEBRF-RBUKOAKNSA-N 1 3 341.499 2.643 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001480160601 1398133480 /nfs/dbraw/zinc/13/34/80/1398133480.db2.gz DLZIFYMUVSBKRB-XDQVBPFNSA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@H]1CCC[C@H]2CCC[N@H+]21 ZINC001480160601 1398133486 /nfs/dbraw/zinc/13/34/86/1398133486.db2.gz DLZIFYMUVSBKRB-XDQVBPFNSA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001480160598 1398133575 /nfs/dbraw/zinc/13/35/75/1398133575.db2.gz DLZIFYMUVSBKRB-AAVRWANBSA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001480160598 1398133581 /nfs/dbraw/zinc/13/35/81/1398133581.db2.gz DLZIFYMUVSBKRB-AAVRWANBSA-N 1 3 346.302 2.559 10 0 EFAEHO C[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CC(C)(C)C1 ZINC001480536798 1398198971 /nfs/dbraw/zinc/19/89/71/1398198971.db2.gz KJKGKYGKPQWEIF-IFXJQAMLSA-N 1 3 341.515 2.729 10 0 EFAEHO C[C@H](CNC(=O)[C@H](C)[NH+]1CCCCCC1)NCc1ccccc1F ZINC001480548822 1398201961 /nfs/dbraw/zinc/20/19/61/1398201961.db2.gz OOLSRTNJLGUOAY-CVEARBPZSA-N 1 3 335.467 2.685 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCC[C@H](NC(=O)CN(C)C(C)C)C2)c(C)n1 ZINC001480710865 1398302955 /nfs/dbraw/zinc/30/29/55/1398302955.db2.gz UCVCGAMWWJMWHH-OALUTQOASA-N 1 3 346.519 2.556 10 0 EFAEHO CCCCC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@@H]21 ZINC001507358036 1406946890 /nfs/dbraw/zinc/94/68/90/1406946890.db2.gz RKGMGYNEDFKRAL-OKZBNKHCSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)[C@H]1CCc2c1cccc2F ZINC001493042336 1398386794 /nfs/dbraw/zinc/38/67/94/1398386794.db2.gz BTGSRTAYWDGHNL-BEFAXECRSA-N 1 3 347.478 2.593 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)[C@H]1CCc2c1cccc2F ZINC001493042336 1398386801 /nfs/dbraw/zinc/38/68/01/1398386801.db2.gz BTGSRTAYWDGHNL-BEFAXECRSA-N 1 3 347.478 2.593 10 0 EFAEHO CC/C=C/CC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)CCC)C[C@@H]21 ZINC001507361845 1406953213 /nfs/dbraw/zinc/95/32/13/1406953213.db2.gz DDJYSKAJBVPMFT-ZRAQOITDSA-N 1 3 335.536 2.901 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@H]1CCC[N@@H+]1Cc1ccccc1C ZINC001493107681 1398446193 /nfs/dbraw/zinc/44/61/93/1398446193.db2.gz NFVDIPRHVGDSAQ-MOPGFXCFSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@H]1CCC[N@H+]1Cc1ccccc1C ZINC001493107681 1398446196 /nfs/dbraw/zinc/44/61/96/1398446196.db2.gz NFVDIPRHVGDSAQ-MOPGFXCFSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@@H]1CCC[N@@H+]1Cc1ccccc1C ZINC001493107686 1398446235 /nfs/dbraw/zinc/44/62/35/1398446235.db2.gz NFVDIPRHVGDSAQ-RBUKOAKNSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@@H]1CCC[N@H+]1Cc1ccccc1C ZINC001493107686 1398446239 /nfs/dbraw/zinc/44/62/39/1398446239.db2.gz NFVDIPRHVGDSAQ-RBUKOAKNSA-N 1 3 349.494 2.756 10 0 EFAEHO CCCN(CCNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC)Cc1ccc(F)cc1 ZINC001493291280 1398590874 /nfs/dbraw/zinc/59/08/74/1398590874.db2.gz OREYFCHYHICGSU-RBUKOAKNSA-N 1 3 349.494 2.884 10 0 EFAEHO CCCN(CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC)Cc1ccc(F)cc1 ZINC001493291280 1398590881 /nfs/dbraw/zinc/59/08/81/1398590881.db2.gz OREYFCHYHICGSU-RBUKOAKNSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+](CCNC(=O)Cc1nc[nH]c1C)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001493331797 1398620748 /nfs/dbraw/zinc/62/07/48/1398620748.db2.gz WGRNQZDNJKFGPW-IXDOHACOSA-N 1 3 332.492 2.525 10 0 EFAEHO CCC[N@@H+](CCNC(=O)Cc1nc[nH]c1C)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001493331797 1398620751 /nfs/dbraw/zinc/62/07/51/1398620751.db2.gz WGRNQZDNJKFGPW-IXDOHACOSA-N 1 3 332.492 2.525 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@H+](CCC2=CCCCC2)C2CC2)C1 ZINC001493413740 1398688263 /nfs/dbraw/zinc/68/82/63/1398688263.db2.gz HYJIGIHVVLWJGM-QGZVFWFLSA-N 1 3 333.520 2.799 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@@H+](CCC2=CCCCC2)C2CC2)C1 ZINC001493413740 1398688269 /nfs/dbraw/zinc/68/82/69/1398688269.db2.gz HYJIGIHVVLWJGM-QGZVFWFLSA-N 1 3 333.520 2.799 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[N@@H+](CC[C@@H](C)F)C1CC1 ZINC001493424705 1398697160 /nfs/dbraw/zinc/69/71/60/1398697160.db2.gz VJWSRQHYUFDDRG-WBVHZDCISA-N 1 3 327.488 2.578 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[N@H+](CC[C@@H](C)F)C1CC1 ZINC001493424705 1398697165 /nfs/dbraw/zinc/69/71/65/1398697165.db2.gz VJWSRQHYUFDDRG-WBVHZDCISA-N 1 3 327.488 2.578 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)NCCN(Cc1ccccc1)C1CC1 ZINC001493450940 1398716682 /nfs/dbraw/zinc/71/66/82/1398716682.db2.gz WUYANJBXAKNDJH-IRXDYDNUSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)CC[C@@H]1CCC[N@@H+]1C)c1ccccc1F ZINC001493583238 1398762479 /nfs/dbraw/zinc/76/24/79/1398762479.db2.gz GMUZQIVCJOFVKX-CVEARBPZSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)CC[C@@H]1CCC[N@H+]1C)c1ccccc1F ZINC001493583238 1398762480 /nfs/dbraw/zinc/76/24/80/1398762480.db2.gz GMUZQIVCJOFVKX-CVEARBPZSA-N 1 3 335.467 2.809 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]CCN(C)C(=O)CN(C)CC(C)(C)C)c1 ZINC001493695190 1398814811 /nfs/dbraw/zinc/81/48/11/1398814811.db2.gz FKAFFPQPCVTNJB-INIZCTEOSA-N 1 3 349.519 2.782 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]CCN(C)C(=O)[C@@H](C(C)C)N(C)C ZINC001493769795 1398873509 /nfs/dbraw/zinc/87/35/09/1398873509.db2.gz SAXKZUUUBDKPMH-QGZVFWFLSA-N 1 3 339.911 2.783 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc2cc[nH]c2c1 ZINC001507382375 1406989570 /nfs/dbraw/zinc/98/95/70/1406989570.db2.gz KVCIMLFSCLFMEI-QAPCUYQASA-N 1 3 342.487 2.589 10 0 EFAEHO Cc1cccnc1C[N@@H+](CCCNC(=O)C1(N(C)C)CCC1)C(C)C ZINC001493860894 1398932251 /nfs/dbraw/zinc/93/22/51/1398932251.db2.gz WIALAMYLLYUULA-UHFFFAOYSA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1cccnc1C[N@H+](CCCNC(=O)C1(N(C)C)CCC1)C(C)C ZINC001493860894 1398932252 /nfs/dbraw/zinc/93/22/52/1398932252.db2.gz WIALAMYLLYUULA-UHFFFAOYSA-N 1 3 346.519 2.591 10 0 EFAEHO CCCN(C(=O)CC[NH+](C)C)[C@@H]1CCN(CCc2ccccc2F)C1 ZINC001493958966 1399009492 /nfs/dbraw/zinc/00/94/92/1399009492.db2.gz DAJUFVYOOAOWLG-GOSISDBHSA-N 1 3 349.494 2.633 10 0 EFAEHO O=C(NCC[C@@H]1CCN(CCF)C1)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001494044325 1399085975 /nfs/dbraw/zinc/08/59/75/1399085975.db2.gz XRPFFFNKYCQIBS-AEFFLSMTSA-N 1 3 339.499 2.581 10 0 EFAEHO O=C(NCC[C@@H]1CCN(CCF)C1)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001494044325 1399085981 /nfs/dbraw/zinc/08/59/81/1399085981.db2.gz XRPFFFNKYCQIBS-AEFFLSMTSA-N 1 3 339.499 2.581 10 0 EFAEHO C[N@H+](CCCc1ccsc1)C[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001494179485 1399191724 /nfs/dbraw/zinc/19/17/24/1399191724.db2.gz DUWIVXVHBGKACQ-GOSISDBHSA-N 1 3 349.544 2.557 10 0 EFAEHO C[N@@H+](CCCc1ccsc1)C[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001494179485 1399191731 /nfs/dbraw/zinc/19/17/31/1399191731.db2.gz DUWIVXVHBGKACQ-GOSISDBHSA-N 1 3 349.544 2.557 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[C@H](C[NH2+]Cc2ccsc2)C1)C1CCC1 ZINC001507402259 1407014538 /nfs/dbraw/zinc/01/45/38/1407014538.db2.gz XCLSRDRGOGAEQW-HOCLYGCPSA-N 1 3 335.517 2.607 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001494732683 1399447632 /nfs/dbraw/zinc/44/76/32/1399447632.db2.gz GWMQSNKBUVPASH-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CC[C@@H](C[NH2+]CCCC2CCC2)C1 ZINC001507418146 1407032658 /nfs/dbraw/zinc/03/26/58/1407032658.db2.gz BSYUPUMXVOZXIM-IAGOWNOFSA-N 1 3 332.492 2.715 10 0 EFAEHO C[C@H](C(=O)N(C)[C@@H]1CC[N@H+](CCCCCF)C1)N1CCCCCC1 ZINC001494851068 1399505263 /nfs/dbraw/zinc/50/52/63/1399505263.db2.gz AYCNGMUGPWAMMV-QZTJIDSGSA-N 1 3 341.515 2.923 10 0 EFAEHO C[C@H](C(=O)N(C)[C@@H]1CC[N@@H+](CCCCCF)C1)N1CCCCCC1 ZINC001494851068 1399505265 /nfs/dbraw/zinc/50/52/65/1399505265.db2.gz AYCNGMUGPWAMMV-QZTJIDSGSA-N 1 3 341.515 2.923 10 0 EFAEHO CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@H+](CC2CC2)C1 ZINC001494911630 1399551331 /nfs/dbraw/zinc/55/13/31/1399551331.db2.gz WOWVRRCHMGILCG-APWZRJJASA-N 1 3 339.499 2.532 10 0 EFAEHO CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC001494911630 1399551332 /nfs/dbraw/zinc/55/13/32/1399551332.db2.gz WOWVRRCHMGILCG-APWZRJJASA-N 1 3 339.499 2.532 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]C/C=C/c1ccccc1 ZINC001495057106 1399632518 /nfs/dbraw/zinc/63/25/18/1399632518.db2.gz DGHZFBFFFLUYJK-TZCMGQOBSA-N 1 3 329.488 2.526 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](CC)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001495058675 1399633422 /nfs/dbraw/zinc/63/34/22/1399633422.db2.gz QPKFQFKTOMIOLJ-LPHOPBHVSA-N 1 3 331.504 2.575 10 0 EFAEHO CC1(C)CN(C(=O)Cc2c[nH]cn2)C[C@H]1[NH2+]CCCC1CCCC1 ZINC001507447022 1407063589 /nfs/dbraw/zinc/06/35/89/1407063589.db2.gz HLMQQLYYXMHWNV-QGZVFWFLSA-N 1 3 332.492 2.749 10 0 EFAEHO CC[C@@H](C)C[NH2+]CCC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001495429077 1399972861 /nfs/dbraw/zinc/97/28/61/1399972861.db2.gz OOTPEDWHGXBTSQ-QGZVFWFLSA-N 1 3 337.552 2.983 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)cc1C ZINC001507454736 1407073084 /nfs/dbraw/zinc/07/30/84/1407073084.db2.gz ZMISNBJRMHCLCZ-LJQANCHMSA-N 1 3 345.531 2.970 10 0 EFAEHO CC[C@H](F)C[NH+]1CCC(CCNC(=O)[C@@H]2CCCCN2CC)CC1 ZINC001495539650 1400071191 /nfs/dbraw/zinc/07/11/91/1400071191.db2.gz GSQKHSMNUXNRPU-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H]1C[NH2+]CCCc1ccc(C)cc1)N(C)C ZINC001495577523 1400093573 /nfs/dbraw/zinc/09/35/73/1400093573.db2.gz DXCHNQFOVCQCCT-UXHICEINSA-N 1 3 345.531 2.848 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]C[C@@H]3CC[C@H]4C[C@H]4C3)CCCC2)CCC1 ZINC001495919906 1400355190 /nfs/dbraw/zinc/35/51/90/1400355190.db2.gz XUUQEHPUGTXJBG-FGTMMUONSA-N 1 3 347.547 2.926 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)[C@@H]3CC[N@@H+](C)C3)CCCC2)c1 ZINC001495962193 1400384500 /nfs/dbraw/zinc/38/45/00/1400384500.db2.gz DFKURDYLXAVWTG-MRXNPFEDSA-N 1 3 347.478 2.604 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)[C@@H]3CC[N@H+](C)C3)CCCC2)c1 ZINC001495962193 1400384504 /nfs/dbraw/zinc/38/45/04/1400384504.db2.gz DFKURDYLXAVWTG-MRXNPFEDSA-N 1 3 347.478 2.604 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C[C@H](C)N(C)C(=O)[C@@H]1CCCN1C ZINC001496027711 1400423769 /nfs/dbraw/zinc/42/37/69/1400423769.db2.gz JMVWWGPGJPHOGT-YOEHRIQHSA-N 1 3 337.895 2.679 10 0 EFAEHO C[C@H](C[NH2+][C@H](C)c1ccc(Cl)cc1)N(C)C(=O)CN1CCCC1 ZINC001496230126 1400556743 /nfs/dbraw/zinc/55/67/43/1400556743.db2.gz QTPSPKYLILSPFG-HUUCEWRRSA-N 1 3 337.895 2.933 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]CCCc1ccccc1 ZINC001496248105 1400570478 /nfs/dbraw/zinc/57/04/78/1400570478.db2.gz JQORQCTXHXILOJ-AZUAARDMSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]C/C=C/Cl)C1CCCCC1 ZINC001496328709 1400644262 /nfs/dbraw/zinc/64/42/62/1400644262.db2.gz ZTGWNJLFHWVYJC-JCVNQNCUSA-N 1 3 329.916 2.734 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CC2CC3(CCC3)C2)[C@@H](C)C1 ZINC001496366770 1400676357 /nfs/dbraw/zinc/67/63/57/1400676357.db2.gz FUQIYTFCCVYSAB-WMZOPIPTSA-N 1 3 335.536 2.735 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@H]1CC[NH2+]CC1=CCCCC1 ZINC001496387011 1400693774 /nfs/dbraw/zinc/69/37/74/1400693774.db2.gz JNKKTTMHGPUXRY-OALUTQOASA-N 1 3 333.520 2.942 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1CC[NH2+]Cc1cncc(C)c1 ZINC001496418956 1400721113 /nfs/dbraw/zinc/72/11/13/1400721113.db2.gz MEJHLDGFTGGZOJ-LJQANCHMSA-N 1 3 346.519 2.593 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H](C)[NH2+]Cc2cccc(F)c2)C1 ZINC001496466192 1400750416 /nfs/dbraw/zinc/75/04/16/1400750416.db2.gz ZRYBBFFZUULDLD-WMZOPIPTSA-N 1 3 349.494 2.883 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)cc1 ZINC001496730492 1400946414 /nfs/dbraw/zinc/94/64/14/1400946414.db2.gz HFPNZFMGUVRBCK-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)cc1 ZINC001496730492 1400946417 /nfs/dbraw/zinc/94/64/17/1400946417.db2.gz HFPNZFMGUVRBCK-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12)CC1=CCCCC1 ZINC001496731314 1400947042 /nfs/dbraw/zinc/94/70/42/1400947042.db2.gz OBHCXWGYKBLUML-RBUKOAKNSA-N 1 3 333.520 2.894 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12)CC1=CCCCC1 ZINC001496731314 1400947048 /nfs/dbraw/zinc/94/70/48/1400947048.db2.gz OBHCXWGYKBLUML-RBUKOAKNSA-N 1 3 333.520 2.894 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC001496866309 1401060691 /nfs/dbraw/zinc/06/06/91/1401060691.db2.gz GSHAGZQYHTYKIC-HKUYNNGSSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2Cc2ccc(F)cc2)C1 ZINC001496866309 1401060695 /nfs/dbraw/zinc/06/06/95/1401060695.db2.gz GSHAGZQYHTYKIC-HKUYNNGSSA-N 1 3 347.478 2.589 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2CCC[C@H]2NC(=O)CN(C)C(C)C)c1 ZINC001496925936 1401106095 /nfs/dbraw/zinc/10/60/95/1401106095.db2.gz XKBDCWUOXRRVGG-WOJBJXKFSA-N 1 3 345.531 2.964 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1sccc1Cl)N(C)C ZINC001497263881 1401255432 /nfs/dbraw/zinc/25/54/32/1401255432.db2.gz OGCICEBCRNTFFC-SWLSCSKDSA-N 1 3 345.940 2.972 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+][C@H](C)c1ccc(F)cc1F ZINC001497329732 1401306237 /nfs/dbraw/zinc/30/62/37/1401306237.db2.gz DECDSEUIIPIBNX-UONOGXRCSA-N 1 3 341.446 2.850 10 0 EFAEHO CC(C)N(CCN(C)[C@H]1CCc2c1cccc2F)C(=O)CC[NH+](C)C ZINC001507831355 1407175294 /nfs/dbraw/zinc/17/52/94/1407175294.db2.gz KNNHVKWPNGEFRC-IBGZPJMESA-N 1 3 349.494 2.934 10 0 EFAEHO CC[C@@H](F)CNCCN(CC)C(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001497394405 1401346275 /nfs/dbraw/zinc/34/62/75/1401346275.db2.gz OYYMQPIQHRRRLZ-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](F)CNCCN(CC)C(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001497394405 1401346280 /nfs/dbraw/zinc/34/62/80/1401346280.db2.gz OYYMQPIQHRRRLZ-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)c(C)c1)C(=O)C1(N(C)C)CCC1 ZINC001497400914 1401349361 /nfs/dbraw/zinc/34/93/61/1401349361.db2.gz MMDGHMWHEBESGU-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CC(C)N(CC[N@H+](C)C[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)Cc1c[nH]cn1 ZINC001507842137 1407180397 /nfs/dbraw/zinc/18/03/97/1407180397.db2.gz TZZFBFUAMKEZDD-ZACQAIPSSA-N 1 3 332.492 2.557 10 0 EFAEHO CC(C)N(CC[N@@H+](C)C[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)Cc1c[nH]cn1 ZINC001507842137 1407180401 /nfs/dbraw/zinc/18/04/01/1407180401.db2.gz TZZFBFUAMKEZDD-ZACQAIPSSA-N 1 3 332.492 2.557 10 0 EFAEHO CC[C@H](C(=O)N(CC)CC[NH2+]C[C@H]1CCc2ccccc2C1)N(C)C ZINC001497487268 1401412302 /nfs/dbraw/zinc/41/23/02/1401412302.db2.gz WQXLMPSWCPQDMQ-FXAWDEMLSA-N 1 3 345.531 2.570 10 0 EFAEHO CC[C@H]([NH2+]C/C=C\CNC(=O)[C@H]1CCCN1C)c1ccc(F)cc1 ZINC001497550302 1401450473 /nfs/dbraw/zinc/45/04/73/1401450473.db2.gz YQUSFIUOQMUMLQ-JTDRTSHGSA-N 1 3 333.451 2.633 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC/C=C/CNCc2ccc(Cl)cc2)CC[N@@H+]1C ZINC001497662124 1401531081 /nfs/dbraw/zinc/53/10/81/1401531081.db2.gz JGMKJXANBBWLKP-PKOQZONYSA-N 1 3 349.906 2.832 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC/C=C/CNCc2ccc(Cl)cc2)CC[N@H+]1C ZINC001497662124 1401531085 /nfs/dbraw/zinc/53/10/85/1401531085.db2.gz JGMKJXANBBWLKP-PKOQZONYSA-N 1 3 349.906 2.832 10 0 EFAEHO CC(C)N(CC[N@H+](C)[C@@H]1CCc2ccccc21)C(=O)CN1CCCC1 ZINC001507862245 1407187680 /nfs/dbraw/zinc/18/76/80/1407187680.db2.gz AHWOCJCFXKRDGT-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO CC(C)N(CC[N@@H+](C)[C@@H]1CCc2ccccc21)C(=O)CN1CCCC1 ZINC001507862245 1407187685 /nfs/dbraw/zinc/18/76/85/1407187685.db2.gz AHWOCJCFXKRDGT-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/C[NH2+][C@H]1CCc2ccccc21)N(C)C ZINC001497672774 1401539372 /nfs/dbraw/zinc/53/93/72/1401539372.db2.gz VFFVXHVCIZLHCY-YZPMEYCISA-N 1 3 329.488 2.522 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\C[NH2+][C@@H]1CCc2c1cccc2F)N(C)C ZINC001497673308 1401540208 /nfs/dbraw/zinc/54/02/08/1401540208.db2.gz XMTQDZRCPYRNEI-CQQBRXBZSA-N 1 3 347.478 2.661 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)CC2CC[NH+](C)CC2)c(C)s1 ZINC001497693678 1401557481 /nfs/dbraw/zinc/55/74/81/1401557481.db2.gz ZAJRNBXNXJUFSO-SNAWJCMRSA-N 1 3 349.544 2.859 10 0 EFAEHO CC(C)N(C)CC(=O)NC/C=C/C[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001497765668 1401636954 /nfs/dbraw/zinc/63/69/54/1401636954.db2.gz SXFODWAQGMSOIE-SHCNBLLESA-N 1 3 349.906 2.930 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@H]2CCCC[N@@H+]2C(C)C)c1 ZINC001497926931 1401746188 /nfs/dbraw/zinc/74/61/88/1401746188.db2.gz NYPPZWLGDXTCAR-VQIMIIECSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@H]2CCCC[N@H+]2C(C)C)c1 ZINC001497926931 1401746196 /nfs/dbraw/zinc/74/61/96/1401746196.db2.gz NYPPZWLGDXTCAR-VQIMIIECSA-N 1 3 349.494 2.991 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@@H](C)NC(=O)[C@@H]1CCCCN1CC ZINC001497994285 1401799945 /nfs/dbraw/zinc/79/99/45/1401799945.db2.gz ZSIVLNJWFNTKRZ-APWZRJJASA-N 1 3 331.504 2.718 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001498117946 1401864403 /nfs/dbraw/zinc/86/44/03/1401864403.db2.gz MEDNGGMMJJTWAN-YMQRJHMESA-N 1 3 327.488 2.650 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CC2)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001498118258 1401864849 /nfs/dbraw/zinc/86/48/49/1401864849.db2.gz QCUVYPSRLZDSDQ-CVEARBPZSA-N 1 3 329.488 2.500 10 0 EFAEHO Cc1cc(CN(C)C[C@@H](C)NC(=O)[C@@H]2C[NH+]3CCC2CC3)c(C)s1 ZINC001498282148 1401972747 /nfs/dbraw/zinc/97/27/47/1401972747.db2.gz HGXQWKBSOKOZND-FZKQIMNGSA-N 1 3 349.544 2.643 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001498286635 1401977201 /nfs/dbraw/zinc/97/72/01/1401977201.db2.gz BIVYSPYXWNOFEJ-RZQQEMMASA-N 1 3 343.515 2.841 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001498286635 1401977208 /nfs/dbraw/zinc/97/72/08/1401977208.db2.gz BIVYSPYXWNOFEJ-RZQQEMMASA-N 1 3 343.515 2.841 10 0 EFAEHO C[C@@H](CN(C)Cc1ccccc1C1CC1)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001498289455 1401979790 /nfs/dbraw/zinc/97/97/90/1401979790.db2.gz RZANSSZFNOPTKG-FRQCXROJSA-N 1 3 343.515 2.841 10 0 EFAEHO C[C@@H](CN(C)Cc1ccccc1C1CC1)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001498289455 1401979798 /nfs/dbraw/zinc/97/97/98/1401979798.db2.gz RZANSSZFNOPTKG-FRQCXROJSA-N 1 3 343.515 2.841 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(CF)cc1)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001498303848 1401992394 /nfs/dbraw/zinc/99/23/94/1401992394.db2.gz AFQJKFYGOJFTOX-VQIMIIECSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(CF)cc1)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001498303848 1401992398 /nfs/dbraw/zinc/99/23/98/1401992398.db2.gz AFQJKFYGOJFTOX-VQIMIIECSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)Cc1c[nH]cn1)c1ccc(Cl)cc1 ZINC001498618985 1402205390 /nfs/dbraw/zinc/20/53/90/1402205390.db2.gz MJNLWCHOCZLXTH-ZDUSSCGKSA-N 1 3 334.851 2.805 10 0 EFAEHO CN(CCC[NH2+]C/C=C/c1ccc(Cl)cc1)C(=O)CN1CCCC1 ZINC001498654850 1402229059 /nfs/dbraw/zinc/22/90/59/1402229059.db2.gz JPVDITRTYPLJPB-GQCTYLIASA-N 1 3 349.906 2.887 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C[NH2+]CC1=CCCCC1)C1CC1 ZINC001498770050 1402278511 /nfs/dbraw/zinc/27/85/11/1402278511.db2.gz OXMIZFNCFCZHRO-OALUTQOASA-N 1 3 333.520 2.846 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@@H](NC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001498872968 1402350361 /nfs/dbraw/zinc/35/03/61/1402350361.db2.gz HXFWWQRIMIIIJO-LJQANCHMSA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]CC1CC(F)(F)C1 ZINC001498906695 1402372708 /nfs/dbraw/zinc/37/27/08/1402372708.db2.gz JNJRLJFGGXONOQ-HOTGVXAUSA-N 1 3 345.478 2.589 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]CC1CC(C)(C)C1 ZINC001498906616 1402373157 /nfs/dbraw/zinc/37/31/57/1402373157.db2.gz HOFKOOJZDRQAED-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]CC[C@H]2CCc3ccccc32)CC1 ZINC001499459466 1402624136 /nfs/dbraw/zinc/62/41/36/1402624136.db2.gz XVKHTGZHQWDTDC-GOSISDBHSA-N 1 3 343.515 2.685 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001499616786 1402721214 /nfs/dbraw/zinc/72/12/14/1402721214.db2.gz UAGNFZSMAAMLHK-AQKVLALTSA-N 1 3 335.536 2.999 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001499616786 1402721216 /nfs/dbraw/zinc/72/12/16/1402721216.db2.gz UAGNFZSMAAMLHK-AQKVLALTSA-N 1 3 335.536 2.999 10 0 EFAEHO CC/C=C/CC[NH+]1CCC([C@H](C)NC(=O)CN2CC[C@H](C)C2)CC1 ZINC001508081140 1407286274 /nfs/dbraw/zinc/28/62/74/1407286274.db2.gz LXVKRTLOVNEXEQ-ZBKUBXTQSA-N 1 3 335.536 2.901 10 0 EFAEHO CC/C=C\CC[NH+]1CCC([C@H](C)NC(=O)CN2CC[C@H](C)C2)CC1 ZINC001508081134 1407286326 /nfs/dbraw/zinc/28/63/26/1407286326.db2.gz LXVKRTLOVNEXEQ-SLXDBMQSSA-N 1 3 335.536 2.901 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[NH2+]C/C=C\c1ccccc1)N(C)C ZINC001499904812 1402847121 /nfs/dbraw/zinc/84/71/21/1402847121.db2.gz RIAZBNUUPWMNLS-WETGWRSWSA-N 1 3 329.488 2.621 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H]2C[NH2+]CCCc2ccsc2)C1 ZINC001499927140 1402858198 /nfs/dbraw/zinc/85/81/98/1402858198.db2.gz YMIUSFZDOBWOPM-FUHWJXTLSA-N 1 3 349.544 2.603 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]CCC1CC1)C1CCCC1 ZINC001500089088 1402933204 /nfs/dbraw/zinc/93/32/04/1402933204.db2.gz RXNKVFGIMKBMIZ-RBUKOAKNSA-N 1 3 335.536 2.924 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@](C)(C[NH2+]Cc2cc(C)ccc2F)C1 ZINC001500396678 1403095495 /nfs/dbraw/zinc/09/54/95/1403095495.db2.gz GKPCKAGOVPPMAY-HXUWFJFHSA-N 1 3 349.494 2.804 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@](C)(C[NH2+]Cc2cc(C)ccc2F)C1 ZINC001500396676 1403095567 /nfs/dbraw/zinc/09/55/67/1403095567.db2.gz GKPCKAGOVPPMAY-FQEVSTJZSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[C@@H](F)CN1CCC(C)(CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)CC1 ZINC001500444302 1403127654 /nfs/dbraw/zinc/12/76/54/1403127654.db2.gz IUTDXUWKUSJCKJ-YESZJQIVSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[C@@H](F)CN1CCC(C)(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)CC1 ZINC001500444302 1403127657 /nfs/dbraw/zinc/12/76/57/1403127657.db2.gz IUTDXUWKUSJCKJ-YESZJQIVSA-N 1 3 341.515 2.683 10 0 EFAEHO CN(CC(=O)N(C)C1CC([NH2+]CC2CC(C)(C)C2)C1)CC(C)(C)C ZINC001508136762 1407309703 /nfs/dbraw/zinc/30/97/03/1407309703.db2.gz OXSDCBURHUVROM-UHFFFAOYSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CN(C(C)C)CCC1(F)F)[NH+](CC)CC ZINC001500617926 1403253545 /nfs/dbraw/zinc/25/35/45/1403253545.db2.gz YZAGCHJLICIXSE-GJZGRUSLSA-N 1 3 333.467 2.589 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)N[C@@H]1C[C@H]2C[C@@H](C1)N(C/C=C\Cl)C2 ZINC001501013261 1403404688 /nfs/dbraw/zinc/40/46/88/1403404688.db2.gz LJKJLJBYSVYRFG-XTGNXVLSSA-N 1 3 339.911 2.584 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@@H]1CCN(C(=O)[C@@H]2CCCN2C)C1 ZINC001501544428 1403621180 /nfs/dbraw/zinc/62/11/80/1403621180.db2.gz KWKUZDWCMIZCQP-XLIONFOSSA-N 1 3 343.515 2.671 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(F)cc2)C1)C1CCC1 ZINC001501577990 1403634714 /nfs/dbraw/zinc/63/47/14/1403634714.db2.gz GPDDCNFCIKVKEX-QGZVFWFLSA-N 1 3 347.478 2.638 10 0 EFAEHO CN(CC(=O)N1CC[C@H](CC[NH2+]CC2=CCCCC2)C1)C1CCC1 ZINC001501579027 1403634741 /nfs/dbraw/zinc/63/47/41/1403634741.db2.gz VVXIJIRDIRCFSB-SFHVURJKSA-N 1 3 333.520 2.799 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN(C)C3CCC3)C2)c1 ZINC001501578142 1403634886 /nfs/dbraw/zinc/63/48/86/1403634886.db2.gz HXDUMWKQEVKBLG-GOSISDBHSA-N 1 3 343.515 2.808 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@H](CC[NH2+]CCC3CC3)C2)c1 ZINC001501652299 1403668869 /nfs/dbraw/zinc/66/88/69/1403668869.db2.gz YWPFYBXCOGSHRR-SFHVURJKSA-N 1 3 343.515 2.990 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@@H]1C[NH2+]CCCc1ccccc1)N(C)C ZINC001501895080 1403859949 /nfs/dbraw/zinc/85/99/49/1403859949.db2.gz VZQGTSURCXMTCT-UXHICEINSA-N 1 3 345.531 2.930 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](CCc2ccc(C)cc2)CC1 ZINC001508230209 1407367669 /nfs/dbraw/zinc/36/76/69/1407367669.db2.gz RYSXFCIAMMWNKD-UHFFFAOYSA-N 1 3 343.515 2.628 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](CCc2ccc(C)cc2)CC1 ZINC001508230209 1407367675 /nfs/dbraw/zinc/36/76/75/1407367675.db2.gz RYSXFCIAMMWNKD-UHFFFAOYSA-N 1 3 343.515 2.628 10 0 EFAEHO CN(CC(=O)N1CCC[C@@]2(CC[N@H+](CC3CC3)C2)C1)CC(C)(C)C ZINC001502546891 1404237255 /nfs/dbraw/zinc/23/72/55/1404237255.db2.gz ZZGCJOYHTAOFHB-FQEVSTJZSA-N 1 3 335.536 2.689 10 0 EFAEHO CN(CC(=O)N1CCC[C@@]2(CC[N@@H+](CC3CC3)C2)C1)CC(C)(C)C ZINC001502546891 1404237259 /nfs/dbraw/zinc/23/72/59/1404237259.db2.gz ZZGCJOYHTAOFHB-FQEVSTJZSA-N 1 3 335.536 2.689 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(C)CCN(C(=O)[C@H]2CCCCN2CC)CC1 ZINC001502811206 1404357493 /nfs/dbraw/zinc/35/74/93/1404357493.db2.gz OYAUMQXHMVGMLV-JKSUJKDBSA-N 1 3 327.488 2.580 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)c(C)n1 ZINC001503022822 1404463356 /nfs/dbraw/zinc/46/33/56/1404463356.db2.gz GIXYCCVRRBWXRG-LPHOPBHVSA-N 1 3 346.519 2.508 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)c(C)n1 ZINC001503022822 1404463360 /nfs/dbraw/zinc/46/33/60/1404463360.db2.gz GIXYCCVRRBWXRG-LPHOPBHVSA-N 1 3 346.519 2.508 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)C1(N(C)C)CCC1 ZINC001505414589 1404572971 /nfs/dbraw/zinc/57/29/71/1404572971.db2.gz MDKWSLNABFMICC-ATZDWAIDSA-N 1 3 343.515 2.889 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)C[C@H]2CCCN2C(=O)[C@@H]2CCCN2C)cc1 ZINC001505424157 1404586217 /nfs/dbraw/zinc/58/62/17/1404586217.db2.gz JHWGHVTUEWBYMH-UXHICEINSA-N 1 3 343.515 2.555 10 0 EFAEHO Cc1ccc(CC[N@H+](C)C[C@H]2CCCN2C(=O)[C@@H]2CCCN2C)cc1 ZINC001505424157 1404586219 /nfs/dbraw/zinc/58/62/19/1404586219.db2.gz JHWGHVTUEWBYMH-UXHICEINSA-N 1 3 343.515 2.555 10 0 EFAEHO Cc1ccc(CN(C)C[C@H]2CCCN2C(=O)CC[NH+](C)C)cc1F ZINC001505445676 1404638432 /nfs/dbraw/zinc/63/84/32/1404638432.db2.gz ZMSSYCNQYZVCKV-QGZVFWFLSA-N 1 3 335.467 2.509 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001505530873 1404744809 /nfs/dbraw/zinc/74/48/09/1404744809.db2.gz GWSRRFAUAMPDJI-UHFFFAOYSA-N 1 3 335.536 2.783 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001505621815 1404863032 /nfs/dbraw/zinc/86/30/32/1404863032.db2.gz LXDSKCKIFFFSKR-ZIAGYGMSSA-N 1 3 337.895 2.807 10 0 EFAEHO C[C@@H]([NH2+]Cc1cccc(Cl)c1)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001505621813 1404863193 /nfs/dbraw/zinc/86/31/93/1404863193.db2.gz LXDSKCKIFFFSKR-KGLIPLIRSA-N 1 3 337.895 2.807 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@H](C)[C@@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001505621377 1404863405 /nfs/dbraw/zinc/86/34/05/1404863405.db2.gz GPRDGKQNHXZZSP-IAGOWNOFSA-N 1 3 345.531 2.759 10 0 EFAEHO C[C@@H](NCc1ccc(Cl)cc1Cl)[C@@H](C)NC(=O)CC[NH+](C)C ZINC001505686054 1404937047 /nfs/dbraw/zinc/93/70/47/1404937047.db2.gz LFYYVWCOTNLIGV-VXGBXAGGSA-N 1 3 346.302 2.928 10 0 EFAEHO COc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)CC(C)(C)C)cc1 ZINC001505694241 1404948701 /nfs/dbraw/zinc/94/87/01/1404948701.db2.gz LSNIHPDAZGFZIF-HZPDHXFCSA-N 1 3 349.519 2.656 10 0 EFAEHO CN(CCCNC(=O)C[C@H]1CC[N@H+](C)C1)Cc1ccc(Cl)s1 ZINC001731278291 1426366404 /nfs/dbraw/zinc/36/64/04/1426366404.db2.gz RJJCSWAJAGPUKI-CYBMUJFWSA-N 1 3 343.924 2.681 10 0 EFAEHO CN(CCCNC(=O)C[C@H]1CC[N@@H+](C)C1)Cc1ccc(Cl)s1 ZINC001731278291 1426366410 /nfs/dbraw/zinc/36/64/10/1426366410.db2.gz RJJCSWAJAGPUKI-CYBMUJFWSA-N 1 3 343.924 2.681 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC(C)(C)C[NH2+]CC1CC(C)(C)C1 ZINC001505850416 1405141364 /nfs/dbraw/zinc/14/13/64/1405141364.db2.gz VSOWQXWJYNJHTA-UHFFFAOYSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)[C@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001505976617 1405296440 /nfs/dbraw/zinc/29/64/40/1405296440.db2.gz PNHIIPVKTDEYQM-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)[C@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001505976617 1405296437 /nfs/dbraw/zinc/29/64/37/1405296437.db2.gz PNHIIPVKTDEYQM-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)[C@@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001505976620 1405297410 /nfs/dbraw/zinc/29/74/10/1405297410.db2.gz PNHIIPVKTDEYQM-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)[C@@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001505976620 1405297418 /nfs/dbraw/zinc/29/74/18/1405297418.db2.gz PNHIIPVKTDEYQM-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[N@H+](C)CC1CCC2(CC2)CC1 ZINC001506002625 1405331139 /nfs/dbraw/zinc/33/11/39/1405331139.db2.gz ZWCNPEPQXVXKTP-IRXDYDNUSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001506002625 1405331148 /nfs/dbraw/zinc/33/11/48/1405331148.db2.gz ZWCNPEPQXVXKTP-IRXDYDNUSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N(C)[C@@H](C)CNC(=O)C12CC[NH+](CC1)C2 ZINC001506037904 1405384535 /nfs/dbraw/zinc/38/45/35/1405384535.db2.gz CFIKERAEFJCJES-LSDHHAIUSA-N 1 3 349.906 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)CCc1ccc(Cl)cc1 ZINC001506064870 1405424257 /nfs/dbraw/zinc/42/42/57/1405424257.db2.gz FBGJDVPSEKZCPU-OAHLLOKOSA-N 1 3 339.911 2.659 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)CCc1ccc(Cl)cc1 ZINC001506064870 1405424260 /nfs/dbraw/zinc/42/42/60/1405424260.db2.gz FBGJDVPSEKZCPU-OAHLLOKOSA-N 1 3 339.911 2.659 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)[C@H](C)CNC(=O)CN(C)C(C)C)c(C)c1 ZINC001506065077 1405425765 /nfs/dbraw/zinc/42/57/65/1405425765.db2.gz IQPAKKULOOKGJS-GOSISDBHSA-N 1 3 333.520 2.889 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)[C@H](C)CNC(=O)CN(C)C(C)C)c(C)c1 ZINC001506065077 1405425766 /nfs/dbraw/zinc/42/57/66/1405425766.db2.gz IQPAKKULOOKGJS-GOSISDBHSA-N 1 3 333.520 2.889 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCF ZINC001506480632 1405824855 /nfs/dbraw/zinc/82/48/55/1405824855.db2.gz OXKLCXLRVCDXMG-MAUKXSAKSA-N 1 3 347.494 2.631 10 0 EFAEHO C[NH+](C)CCC(=O)NC1(CNCc2ccccc2F)CCCCC1 ZINC001506518670 1405896746 /nfs/dbraw/zinc/89/67/46/1405896746.db2.gz SGXZKYYBTCBISU-UHFFFAOYSA-N 1 3 335.467 2.686 10 0 EFAEHO CCC[N@@H+]1CCCCC[C@@H]1CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001506574169 1405988250 /nfs/dbraw/zinc/98/82/50/1405988250.db2.gz DQDDMIXCWKVYNW-VQIMIIECSA-N 1 3 341.515 2.970 10 0 EFAEHO CCC[N@H+]1CCCCC[C@@H]1CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001506574169 1405988256 /nfs/dbraw/zinc/98/82/56/1405988256.db2.gz DQDDMIXCWKVYNW-VQIMIIECSA-N 1 3 341.515 2.970 10 0 EFAEHO CCC[N@@H+]1CCCCC[C@H]1CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001506574164 1405988980 /nfs/dbraw/zinc/98/89/80/1405988980.db2.gz DQDDMIXCWKVYNW-QFBILLFUSA-N 1 3 341.515 2.970 10 0 EFAEHO CCC[N@H+]1CCCCC[C@H]1CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001506574164 1405988985 /nfs/dbraw/zinc/98/89/85/1405988985.db2.gz DQDDMIXCWKVYNW-QFBILLFUSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@H](F)CN1CCCCC[C@@H]1CNC(=O)CC1CC[NH+](C)CC1 ZINC001506576610 1405993473 /nfs/dbraw/zinc/99/34/73/1405993473.db2.gz UCLIRPRSFYOCMS-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)CC[NH+]1CC([C@H](C)NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001506657432 1406110421 /nfs/dbraw/zinc/11/04/21/1406110421.db2.gz XMMHYQBMCRFBBP-HNAYVOBHSA-N 1 3 341.515 2.682 10 0 EFAEHO Cc1ccc(CN2CC([C@@H](C)NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c(C)c1 ZINC001506660829 1406114554 /nfs/dbraw/zinc/11/45/54/1406114554.db2.gz AGGGIELCIYKLFM-MSOLQXFVSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(CN2CC([C@@H](C)NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c(C)c1 ZINC001506660829 1406114564 /nfs/dbraw/zinc/11/45/64/1406114564.db2.gz AGGGIELCIYKLFM-MSOLQXFVSA-N 1 3 343.515 2.582 10 0 EFAEHO CC[C@H](c1ccccc1)[NH+]1CC([C@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001506678511 1406139999 /nfs/dbraw/zinc/13/99/99/1406139999.db2.gz JEENCNXPSILVBO-QFBILLFUSA-N 1 3 331.504 2.914 10 0 EFAEHO C/C=C/C[C@H]1CCCN(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)C1 ZINC001565055609 1415388300 /nfs/dbraw/zinc/38/83/00/1415388300.db2.gz GXPGIGVBOSSGQD-VDZMMWBESA-N 1 3 338.540 2.646 10 0 EFAEHO C/C=C/C[C@H]1CCCN(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)C1 ZINC001565055609 1415388301 /nfs/dbraw/zinc/38/83/01/1415388301.db2.gz GXPGIGVBOSSGQD-VDZMMWBESA-N 1 3 338.540 2.646 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2C[C@@H]([NH2+]CCCCC(F)(F)F)C2)C1 ZINC001565851657 1415433277 /nfs/dbraw/zinc/43/32/77/1415433277.db2.gz KBUNUHXYWCJXJO-KFWWJZLASA-N 1 3 349.441 2.545 10 0 EFAEHO CC/C=C/CC[NH2+]CC[C@@H]1[C@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001565939690 1415457839 /nfs/dbraw/zinc/45/78/39/1415457839.db2.gz SWNPDLNBJNPNRC-FPZRGXOSSA-N 1 3 332.492 2.915 10 0 EFAEHO CC/C=C\CC[NH2+]CC[C@@H]1[C@@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001565939692 1415458078 /nfs/dbraw/zinc/45/80/78/1415458078.db2.gz SWNPDLNBJNPNRC-IMBPEULASA-N 1 3 332.492 2.915 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H]2CC[N@H+](C)C2)CCN1CCCCC(F)(F)F ZINC001566027692 1415485374 /nfs/dbraw/zinc/48/53/74/1415485374.db2.gz VCHNSVWNKNPVLL-QLFBSQMISA-N 1 3 349.441 2.640 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H]2CC[N@@H+](C)C2)CCN1CCCCC(F)(F)F ZINC001566027692 1415485375 /nfs/dbraw/zinc/48/53/75/1415485375.db2.gz VCHNSVWNKNPVLL-QLFBSQMISA-N 1 3 349.441 2.640 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H]2CC[N@H+](C)C2)CCN1CCCCC(F)(F)F ZINC001566027693 1415485903 /nfs/dbraw/zinc/48/59/03/1415485903.db2.gz VCHNSVWNKNPVLL-SOUVJXGZSA-N 1 3 349.441 2.640 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H]2CC[N@@H+](C)C2)CCN1CCCCC(F)(F)F ZINC001566027693 1415485907 /nfs/dbraw/zinc/48/59/07/1415485907.db2.gz VCHNSVWNKNPVLL-SOUVJXGZSA-N 1 3 349.441 2.640 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N[C@H]2CCN(CCCCC(F)(F)F)[C@@H]2C)CC[N@@H+]1C ZINC001566089830 1415511296 /nfs/dbraw/zinc/51/12/96/1415511296.db2.gz PYMWEVFXVSCSAF-TUVASFSCSA-N 1 3 349.441 2.638 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N[C@H]2CCN(CCCCC(F)(F)F)[C@@H]2C)CC[N@H+]1C ZINC001566089830 1415511299 /nfs/dbraw/zinc/51/12/99/1415511299.db2.gz PYMWEVFXVSCSAF-TUVASFSCSA-N 1 3 349.441 2.638 10 0 EFAEHO CN(CC(=O)NCCC[N@H+](C)[C@@H]1CCc2ccccc21)C1CCC1 ZINC001566462038 1415560872 /nfs/dbraw/zinc/56/08/72/1415560872.db2.gz NOXSCVYZBQZNSX-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO CN(CC(=O)NCCC[N@@H+](C)[C@@H]1CCc2ccccc21)C1CCC1 ZINC001566462038 1415560875 /nfs/dbraw/zinc/56/08/75/1415560875.db2.gz NOXSCVYZBQZNSX-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO CC[N@H+](CCCNC(=O)[C@H]1CCCN1C)[C@@H](C)c1ccccc1F ZINC001566560241 1415643880 /nfs/dbraw/zinc/64/38/80/1415643880.db2.gz IUYBBMLNHRWAOO-MAUKXSAKSA-N 1 3 335.467 2.809 10 0 EFAEHO CC[N@@H+](CCCNC(=O)[C@H]1CCCN1C)[C@@H](C)c1ccccc1F ZINC001566560241 1415643882 /nfs/dbraw/zinc/64/38/82/1415643882.db2.gz IUYBBMLNHRWAOO-MAUKXSAKSA-N 1 3 335.467 2.809 10 0 EFAEHO CN(CC(=O)N(C)C1CC[NH+](CCCCCF)CC1)C1CCC1 ZINC001566608762 1415692730 /nfs/dbraw/zinc/69/27/30/1415692730.db2.gz DBGAOLYLSWQMSZ-UHFFFAOYSA-N 1 3 327.488 2.533 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H]([NH2+]CC/C=C\c2ccccc2)C1)N(C)C ZINC001566766566 1415768523 /nfs/dbraw/zinc/76/85/23/1415768523.db2.gz AUBJLJUCNQIFPB-IDVICZFGSA-N 1 3 343.515 2.867 10 0 EFAEHO CC/C=C/CC[NH2+][C@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001566773856 1415770427 /nfs/dbraw/zinc/77/04/27/1415770427.db2.gz VVDGOEPVXKZHKM-CIHFUWIRSA-N 1 3 339.499 2.746 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H]([NH2+]CCCc2ccccc2C)C1)N(C)C ZINC001566811228 1415782882 /nfs/dbraw/zinc/78/28/82/1415782882.db2.gz PMNOCMRUQQGHAQ-GUDVDZBRSA-N 1 3 331.504 2.505 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@H]([NH2+]CCCc2ccsc2)C1 ZINC001566813745 1415783439 /nfs/dbraw/zinc/78/34/39/1415783439.db2.gz MLHXRTTWUGKMJR-KPOQHDDYSA-N 1 3 349.544 2.790 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@H]2[C@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001566828031 1415791158 /nfs/dbraw/zinc/79/11/58/1415791158.db2.gz XPZZSKMPRHMOIV-AEFFLSMTSA-N 1 3 332.492 2.845 10 0 EFAEHO CCCCCC[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001566828031 1415791163 /nfs/dbraw/zinc/79/11/63/1415791163.db2.gz XPZZSKMPRHMOIV-AEFFLSMTSA-N 1 3 332.492 2.845 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H]1C[C@@H]([NH2+]CCCc2ccsc2)C1 ZINC001566862506 1415803234 /nfs/dbraw/zinc/80/32/34/1415803234.db2.gz CTUKMSIHYWCNNF-KSZLIROESA-N 1 3 349.544 2.792 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H]1CCCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001566893917 1415828550 /nfs/dbraw/zinc/82/85/50/1415828550.db2.gz RGGQNNJSYMKDPF-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](C[NH2+]C/C=C/c2ccccc2)C1)C1CCC1 ZINC001567128952 1415944052 /nfs/dbraw/zinc/94/40/52/1415944052.db2.gz YCKUISKPZWPMPJ-AIADIJKESA-N 1 3 341.499 2.622 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](C[NH2+]CC/C=C/c2ccccc2)C1 ZINC001567153952 1415955505 /nfs/dbraw/zinc/95/55/05/1415955505.db2.gz YJAFQMSBZALPOG-ROTNKFJQSA-N 1 3 341.499 2.624 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](C[NH2+]CC/C=C/c2ccccc2)C1 ZINC001567153951 1415955594 /nfs/dbraw/zinc/95/55/94/1415955594.db2.gz YJAFQMSBZALPOG-KUIFVVTRSA-N 1 3 341.499 2.624 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@@H](C[NH2+]CCc2cccs2)C1 ZINC001567154535 1415956219 /nfs/dbraw/zinc/95/62/19/1415956219.db2.gz GHGYIGYTXSGZIX-FUHWJXTLSA-N 1 3 349.544 2.603 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@H](C[NH2+]CCc2cccs2)C1 ZINC001567154536 1415956359 /nfs/dbraw/zinc/95/63/59/1415956359.db2.gz GHGYIGYTXSGZIX-SJLPKXTDSA-N 1 3 349.544 2.603 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[NH2+]Cc1ccc(C(F)F)cc1)N(C)C ZINC001567593986 1416201855 /nfs/dbraw/zinc/20/18/55/1416201855.db2.gz VWVGYMHDRXVPCY-MRXNPFEDSA-N 1 3 341.446 2.758 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1C(=O)N(C)CCNCc1cc(C)ccc1F ZINC001567611377 1416209474 /nfs/dbraw/zinc/20/94/74/1416209474.db2.gz FACCGVVDWIRRPS-GOSISDBHSA-N 1 3 335.467 2.557 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1C(=O)N(C)CCNCc1cc(C)ccc1F ZINC001567611377 1416209479 /nfs/dbraw/zinc/20/94/79/1416209479.db2.gz FACCGVVDWIRRPS-GOSISDBHSA-N 1 3 335.467 2.557 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]Cc1ccc2c(c1)CCC2 ZINC001567611701 1416210167 /nfs/dbraw/zinc/21/01/67/1416210167.db2.gz RRCSKMSULGVNAR-HXUWFJFHSA-N 1 3 343.515 2.598 10 0 EFAEHO CC(C)CCC[NH2+][C@@H](C)C1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001567630523 1416216837 /nfs/dbraw/zinc/21/68/37/1416216837.db2.gz SVJAQWYEPXZHFO-MSOLQXFVSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@H+](C)CC2=CCCCC2)CC1 ZINC001567752786 1416273795 /nfs/dbraw/zinc/27/37/95/1416273795.db2.gz SMCIASCDXMUFAN-UHFFFAOYSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@@H+](C)CC2=CCCCC2)CC1 ZINC001567752786 1416273801 /nfs/dbraw/zinc/27/38/01/1416273801.db2.gz SMCIASCDXMUFAN-UHFFFAOYSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[NH+]1CC(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001567841230 1416295268 /nfs/dbraw/zinc/29/52/68/1416295268.db2.gz UKWUZIAWPFFRCL-LIXSYLKWSA-N 1 3 339.499 2.603 10 0 EFAEHO CN(CC(=O)N1CCC[C@H](CC[NH2+]Cc2ccsc2)C1)C1CCC1 ZINC001568059851 1416384741 /nfs/dbraw/zinc/38/47/41/1416384741.db2.gz BWZSPZMFTWEPHA-MRXNPFEDSA-N 1 3 349.544 2.951 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@@H](CC[NH2+]Cc2ccc(F)cc2)C1 ZINC001568064069 1416388548 /nfs/dbraw/zinc/38/85/48/1416388548.db2.gz FXPFOAVIVVSXDX-PKOBYXMFSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H](CC[NH2+]CCC(C)(C)C)C2)C1 ZINC001568068235 1416391837 /nfs/dbraw/zinc/39/18/37/1416391837.db2.gz SGETYMBBTFXIQW-QZTJIDSGSA-N 1 3 337.552 2.983 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@@H](CC[NH2+]CC2CCC2)C1 ZINC001568076307 1416398074 /nfs/dbraw/zinc/39/80/74/1416398074.db2.gz NFLRCOLWNHIPKZ-OALUTQOASA-N 1 3 335.536 2.879 10 0 EFAEHO O=C(CN1CCCC1)N1CCC(CC[NH2+]CCc2ccccc2)CC1 ZINC001568098011 1416409304 /nfs/dbraw/zinc/40/93/04/1416409304.db2.gz ONVQDURQSJAYTK-UHFFFAOYSA-N 1 3 343.515 2.543 10 0 EFAEHO CCC/C=C/CC[NH2+][C@H](C)[C@H]1CCCN(C(=O)Cc2c[nH]cn2)C1 ZINC001568412060 1416521092 /nfs/dbraw/zinc/52/10/92/1416521092.db2.gz MZCUJBPYDBPOAA-WBXGCANISA-N 1 3 332.492 2.915 10 0 EFAEHO CC(C)CCC[NH2+][C@@H](C)[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001568417266 1416524356 /nfs/dbraw/zinc/52/43/56/1416524356.db2.gz UUNVLYDXNVTROC-ZWKOTPCHSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N1CCN(c2cccc(NC(=O)[C@@H]3CCCC[C@H]3[NH3+])c2)CC1 ZINC001645885224 1416579626 /nfs/dbraw/zinc/57/96/26/1416579626.db2.gz VSULZORXBSGWOG-RTBURBONSA-N 1 3 344.503 2.673 10 0 EFAEHO CN1CCN(Cc2cccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)S4)c2)CC1 ZINC001646285282 1416643049 /nfs/dbraw/zinc/64/30/49/1416643049.db2.gz UOXVFVDJFNSMML-IHWFROFDSA-N 1 3 345.556 2.950 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]CCCC3CCC3)C2)C1 ZINC001689003110 1417011219 /nfs/dbraw/zinc/01/12/19/1417011219.db2.gz NVXADFYBDMXSLV-YTQUADARSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)CCCNC(=O)C2(N(C)C)CCC2)c1 ZINC001689806952 1417071920 /nfs/dbraw/zinc/07/19/20/1417071920.db2.gz BFZYONWJJPVYQS-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)CCCNC(=O)C2(N(C)C)CCC2)c1 ZINC001689806952 1417071926 /nfs/dbraw/zinc/07/19/26/1417071926.db2.gz BFZYONWJJPVYQS-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CN(CC(=O)NCCC[N@H+](C)CC1CC2(CCC2)C1)CC(C)(C)C ZINC001689841097 1417085298 /nfs/dbraw/zinc/08/52/98/1417085298.db2.gz YDKJJORFKSDLDA-UHFFFAOYSA-N 1 3 337.552 2.983 10 0 EFAEHO CN(CC(=O)NCCC[N@@H+](C)CC1CC2(CCC2)C1)CC(C)(C)C ZINC001689841097 1417085301 /nfs/dbraw/zinc/08/53/01/1417085301.db2.gz YDKJJORFKSDLDA-UHFFFAOYSA-N 1 3 337.552 2.983 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)Cc1ccc2ncccc2c1)N(C)C ZINC001689840796 1417085378 /nfs/dbraw/zinc/08/53/78/1417085378.db2.gz MIQQMWQTGZUQOG-IBGZPJMESA-N 1 3 342.487 2.513 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)Cc1ccc2ncccc2c1)N(C)C ZINC001689840796 1417085383 /nfs/dbraw/zinc/08/53/83/1417085383.db2.gz MIQQMWQTGZUQOG-IBGZPJMESA-N 1 3 342.487 2.513 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN(C)C1CCC1)[C@@H]1CCc2ccccc21 ZINC001689936277 1417100241 /nfs/dbraw/zinc/10/02/41/1417100241.db2.gz KLLUGYYEMLTGLZ-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN(C)C1CCC1)[C@@H]1CCc2ccccc21 ZINC001689936277 1417100244 /nfs/dbraw/zinc/10/02/44/1417100244.db2.gz KLLUGYYEMLTGLZ-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](CC)Cc1cncc(C)c1 ZINC001689970240 1417113633 /nfs/dbraw/zinc/11/36/33/1417113633.db2.gz IUBCXHZQFFUPON-IBGZPJMESA-N 1 3 346.519 2.593 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](CC)Cc1cncc(C)c1 ZINC001689970240 1417113634 /nfs/dbraw/zinc/11/36/34/1417113634.db2.gz IUBCXHZQFFUPON-IBGZPJMESA-N 1 3 346.519 2.593 10 0 EFAEHO Cc1cc(C[N@@H+](CCCNC(=O)[C@@H]2CCCN2C)C2CC2)c(C)s1 ZINC001689978917 1417117162 /nfs/dbraw/zinc/11/71/62/1417117162.db2.gz KYTUFIFZKVIZPF-SFHVURJKSA-N 1 3 349.544 2.930 10 0 EFAEHO Cc1cc(C[N@H+](CCCNC(=O)[C@@H]2CCCN2C)C2CC2)c(C)s1 ZINC001689978917 1417117165 /nfs/dbraw/zinc/11/71/65/1417117165.db2.gz KYTUFIFZKVIZPF-SFHVURJKSA-N 1 3 349.544 2.930 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@H]2C[C@@H]([NH2+]CC/C=C\c3ccccc3)C2)C1 ZINC001690356788 1417195412 /nfs/dbraw/zinc/19/54/12/1417195412.db2.gz VIXVIKWBCFLXHW-MRDHULANSA-N 1 3 341.499 2.669 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@@H]1CCC[N@H+](CCCCCF)C1 ZINC001690498359 1417218177 /nfs/dbraw/zinc/21/81/77/1417218177.db2.gz HDGYSHAFZUFEEJ-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@@H]1CCC[N@@H+](CCCCCF)C1 ZINC001690498359 1417218182 /nfs/dbraw/zinc/21/81/82/1417218182.db2.gz HDGYSHAFZUFEEJ-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@H](C[NH2+]CCCC2CCC2)C1 ZINC001690757328 1417239246 /nfs/dbraw/zinc/23/92/46/1417239246.db2.gz GOAYBMZCEORUTN-RTBURBONSA-N 1 3 335.536 2.879 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001690757236 1417239465 /nfs/dbraw/zinc/23/94/65/1417239465.db2.gz DMODPXNSFSYFRC-SFHVURJKSA-N 1 3 345.531 2.570 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@H](C[NH2+]CCCC2CCC2)C1 ZINC001690757325 1417239495 /nfs/dbraw/zinc/23/94/95/1417239495.db2.gz GOAYBMZCEORUTN-MOPGFXCFSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[N@H+]1CCCC[C@H]1C(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001698734276 1417323014 /nfs/dbraw/zinc/32/30/14/1417323014.db2.gz JRQMPDNWQMUZIR-KGLIPLIRSA-N 1 3 348.318 2.760 10 0 EFAEHO CC[N@@H+]1CCCC[C@H]1C(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001698734276 1417323009 /nfs/dbraw/zinc/32/30/09/1417323009.db2.gz JRQMPDNWQMUZIR-KGLIPLIRSA-N 1 3 348.318 2.760 10 0 EFAEHO C[C@@H](CC[NH2+]C[C@@H]1CCCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001699108030 1417391989 /nfs/dbraw/zinc/39/19/89/1417391989.db2.gz XQRBEQPIVBBFGV-LSDHHAIUSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@H](CC[NH2+]C[C@H]1CCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001699134490 1417399848 /nfs/dbraw/zinc/39/98/48/1417399848.db2.gz XATXPYUZTFLLRV-CABCVRRESA-N 1 3 347.494 2.884 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(C)ccc1C)C(=O)CN(C)C1CCC1 ZINC001699186473 1417411320 /nfs/dbraw/zinc/41/13/20/1417411320.db2.gz VTLIQYUAQRPDDA-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CN(CC(=O)NC/C=C\C[NH2+]CC1CC2(CCC2)C1)CC(C)(C)C ZINC001699308330 1417418617 /nfs/dbraw/zinc/41/86/17/1417418617.db2.gz MNGLFRUKPONAGJ-WAYWQWQTSA-N 1 3 335.536 2.807 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(C2CCC2)cc1)C(=O)[C@@H]1CCCN1C ZINC001699500232 1417426676 /nfs/dbraw/zinc/42/66/76/1417426676.db2.gz PYPPRFHIFYLLRO-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+]Cc1sccc1Cl)N(C)C ZINC001699529747 1417427745 /nfs/dbraw/zinc/42/77/45/1417427745.db2.gz IKCCLPRRQPKKBZ-OAHLLOKOSA-N 1 3 345.940 2.926 10 0 EFAEHO CC/C=C\CC[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001699662558 1417443693 /nfs/dbraw/zinc/44/36/93/1417443693.db2.gz WSLZVHCYVFDYJZ-RURPWVQCSA-N 1 3 339.499 2.794 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CCCF)CCN1C(=O)c1cccc(CN(C)C)c1 ZINC001699741544 1417464119 /nfs/dbraw/zinc/46/41/19/1417464119.db2.gz BULLGPNAGLNYEK-YJBOKZPZSA-N 1 3 335.467 2.691 10 0 EFAEHO C[NH+]1CCC(CC(=O)N2CCC[C@@H]2CNCC=C(Cl)Cl)CC1 ZINC001699759742 1417466153 /nfs/dbraw/zinc/46/61/53/1417466153.db2.gz CCUIRDITGVVSMQ-CQSZACIVSA-N 1 3 348.318 2.618 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C(C)C)N(C)C ZINC001700016621 1417540396 /nfs/dbraw/zinc/54/03/96/1417540396.db2.gz KNKCLSMDXWVIRZ-UUAOQSGWSA-N 1 3 335.536 2.994 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C(C)C)N(C)C ZINC001700016621 1417540399 /nfs/dbraw/zinc/54/03/99/1417540399.db2.gz KNKCLSMDXWVIRZ-UUAOQSGWSA-N 1 3 335.536 2.994 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](CC[NH2+]Cc2cc(C)ccc2F)C1)N(C)C ZINC001700087179 1417560695 /nfs/dbraw/zinc/56/06/95/1417560695.db2.gz NVYWSCXZJNZFED-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO CN(C)C1(C(=O)N(C)[C@H](C[NH2+]CCC2CCCC2)C2CC2)CCC1 ZINC001700723766 1417630471 /nfs/dbraw/zinc/63/04/71/1417630471.db2.gz ONQNVGOOEZXSEP-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO CCC/C=C\CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)CN1[C@H](C)CC[C@H]1C ZINC001713283691 1418453096 /nfs/dbraw/zinc/45/30/96/1418453096.db2.gz LGJMCXKYTPRHTK-SUHZXESGSA-N 1 3 333.520 2.652 10 0 EFAEHO CCC/C=C\CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)CN1[C@H](C)CC[C@H]1C ZINC001713283691 1418453101 /nfs/dbraw/zinc/45/31/01/1418453101.db2.gz LGJMCXKYTPRHTK-SUHZXESGSA-N 1 3 333.520 2.652 10 0 EFAEHO CN(C)C1(C(=O)NC2CCC([NH2+]CC3=CCCCC3)CC2)CCC1 ZINC001713287726 1418455520 /nfs/dbraw/zinc/45/55/20/1418455520.db2.gz PMCJPNXHRSUUHY-UHFFFAOYSA-N 1 3 333.520 2.988 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CCC[C@@H]([NH2+]CCCF)C1)N1CCCCC1 ZINC001713373445 1418498254 /nfs/dbraw/zinc/49/82/54/1418498254.db2.gz OSCHGNNUMHVHOH-HZPDHXFCSA-N 1 3 327.488 2.628 10 0 EFAEHO Cc1ncccc1C[N@H+]1CCC[C@H]1CCCNC(=O)CN(C)C(C)C ZINC001713441901 1418538483 /nfs/dbraw/zinc/53/84/83/1418538483.db2.gz CDDZWKGCIYLHBM-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1ncccc1C[N@@H+]1CCC[C@H]1CCCNC(=O)CN(C)C(C)C ZINC001713441901 1418538485 /nfs/dbraw/zinc/53/84/85/1418538485.db2.gz CDDZWKGCIYLHBM-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO CN(CC[NH2+]Cc1ccc(C2CCCC2)cc1)C(=O)[C@@H]1CCCN1C ZINC001713579033 1418559648 /nfs/dbraw/zinc/55/96/48/1418559648.db2.gz YYCGZRRMDQVRIR-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO O=C(CN1CCCC1)N1CCC(CC[NH2+]CC=C(Cl)Cl)CC1 ZINC001714290773 1418594542 /nfs/dbraw/zinc/59/45/42/1418594542.db2.gz DSSFOQLXWCOVEX-UHFFFAOYSA-N 1 3 348.318 2.620 10 0 EFAEHO Cc1ccccc1C[NH2+]CCC1CCN(C(=O)CN2CCCC2)CC1 ZINC001714291267 1418594876 /nfs/dbraw/zinc/59/48/76/1418594876.db2.gz PNGZGSQGZVZQJX-UHFFFAOYSA-N 1 3 343.515 2.809 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@H](C)N(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001714754040 1418625479 /nfs/dbraw/zinc/62/54/79/1418625479.db2.gz XIKAZIPLOQUNGO-CRAIPNDOSA-N 1 3 327.488 2.602 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@H](C)N(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001714754042 1418625747 /nfs/dbraw/zinc/62/57/47/1418625747.db2.gz XIKAZIPLOQUNGO-QAPCUYQASA-N 1 3 327.488 2.602 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H](C)N(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001714754043 1418625766 /nfs/dbraw/zinc/62/57/66/1418625766.db2.gz XIKAZIPLOQUNGO-YJBOKZPZSA-N 1 3 327.488 2.602 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC001714786218 1418638822 /nfs/dbraw/zinc/63/88/22/1418638822.db2.gz PVDVSQAGIFKFNL-UHFFFAOYSA-N 1 3 346.302 2.883 10 0 EFAEHO CC/C=C\CC[N@H+](C)C[C@@H]1CCN(C(=O)[C@@H]2CCCCN2CC)C1 ZINC001714910488 1418642816 /nfs/dbraw/zinc/64/28/16/1418642816.db2.gz WZYUJBVQSUQPDE-RJCMGOLDSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@@H]2CCCCN2CC)C1 ZINC001714910488 1418642817 /nfs/dbraw/zinc/64/28/17/1418642817.db2.gz WZYUJBVQSUQPDE-RJCMGOLDSA-N 1 3 335.536 2.997 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+]C/C=C/Cl)C1CCCCC1)C1CCC1 ZINC001714973906 1418643984 /nfs/dbraw/zinc/64/39/84/1418643984.db2.gz GTQSZUZMZRPYDI-CEUCYRDJSA-N 1 3 341.927 2.878 10 0 EFAEHO CC1CC(C[NH2+]CCC2CCN(C(=O)CN3CC[C@@H](C)C3)CC2)C1 ZINC001715176032 1418656053 /nfs/dbraw/zinc/65/60/53/1418656053.db2.gz QLIWAGDMBZQNKM-LRYGQEGESA-N 1 3 335.536 2.593 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@@H](C)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001715357642 1418666686 /nfs/dbraw/zinc/66/66/86/1418666686.db2.gz CTFZUXBEVGPFSW-PKOBYXMFSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)=CC[NH2+]CC[C@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001716174829 1418714350 /nfs/dbraw/zinc/71/43/50/1418714350.db2.gz ZRXKDWSOAYIOPM-YJBOKZPZSA-N 1 3 327.488 2.650 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C\C[NH2+][C@H]1CCc2c1cccc2Cl)N(C)C ZINC001716344162 1418787869 /nfs/dbraw/zinc/78/78/69/1418787869.db2.gz RAENWQTXZNFZPG-SLXDBMQSSA-N 1 3 349.906 2.930 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC/C=C/C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001716343616 1418788266 /nfs/dbraw/zinc/78/82/66/1418788266.db2.gz GTFLQYJMQLBEBJ-RCAFFNEUSA-N 1 3 333.520 2.561 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C/C=C/CNC(=O)CN1CCC(C)CC1 ZINC001716356887 1418796738 /nfs/dbraw/zinc/79/67/38/1418796738.db2.gz BSCQBHQGGSXHEL-ONEGZZNKSA-N 1 3 347.478 2.628 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C\C[NH2+]CCc1ccccc1F ZINC001716378059 1418860650 /nfs/dbraw/zinc/86/06/50/1418860650.db2.gz FZDZLEIEBQDJLD-LIXSYLKWSA-N 1 3 347.478 2.505 10 0 EFAEHO CCc1ccc(C[NH2+]C/C=C/CNC(=O)[C@@H]2CCCCN2CC)cc1 ZINC001716379395 1418861733 /nfs/dbraw/zinc/86/17/33/1418861733.db2.gz QEROWNSSSHFHJK-YJJPMGAVSA-N 1 3 343.515 2.885 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[NH2+]Cc1ccc(F)cc1 ZINC001716586920 1418919122 /nfs/dbraw/zinc/91/91/22/1418919122.db2.gz KKGGOEPTZZFMPK-SFHVURJKSA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)(C(=O)N[C@H](C[NH2+]CC1=CCCCC1)C1CC1)N1CCCC1 ZINC001716617129 1418926026 /nfs/dbraw/zinc/92/60/26/1418926026.db2.gz CRCMZRNMRYFVKS-GOSISDBHSA-N 1 3 333.520 2.846 10 0 EFAEHO CC[C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)CC[C@H]1[NH2+]CCCF ZINC001716642030 1418935969 /nfs/dbraw/zinc/93/59/69/1418935969.db2.gz FVKRCYGNUWOIQW-IEBWSBKVSA-N 1 3 349.494 2.938 10 0 EFAEHO CC[C@H]1CN(C(=O)c2cccc(CN(C)C)c2)CC[C@@H]1[NH2+]CCCF ZINC001716642029 1418936079 /nfs/dbraw/zinc/93/60/79/1418936079.db2.gz FVKRCYGNUWOIQW-HKUYNNGSSA-N 1 3 349.494 2.938 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC[C@@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001716724302 1418974778 /nfs/dbraw/zinc/97/47/78/1418974778.db2.gz ZFXUVWDXZNYTNA-PXDRNWIDSA-N 1 3 335.536 2.999 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC[C@@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001716724302 1418974780 /nfs/dbraw/zinc/97/47/80/1418974780.db2.gz ZFXUVWDXZNYTNA-PXDRNWIDSA-N 1 3 335.536 2.999 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC[C@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001716724301 1418975264 /nfs/dbraw/zinc/97/52/64/1418975264.db2.gz ZFXUVWDXZNYTNA-HCZHMGAMSA-N 1 3 335.536 2.999 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC[C@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001716724301 1418975268 /nfs/dbraw/zinc/97/52/68/1418975268.db2.gz ZFXUVWDXZNYTNA-HCZHMGAMSA-N 1 3 335.536 2.999 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@@]1(C)CCN(Cc2ccc(CF)cc2)C1 ZINC001716851454 1419055588 /nfs/dbraw/zinc/05/55/88/1419055588.db2.gz YPKBVXJBSDPJHR-FQEVSTJZSA-N 1 3 349.494 2.969 10 0 EFAEHO CC(C)(C(=O)N1CC[C@](C)(C[NH2+]C/C=C/Cl)C1)N1CCCCC1 ZINC001716864031 1419062646 /nfs/dbraw/zinc/06/26/46/1419062646.db2.gz DFOYIYYIBJWOKC-PDFOZTTASA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1CN(C(=O)C(C)(C)N2CCCCC2)C[C@H]1C ZINC001716982839 1419122975 /nfs/dbraw/zinc/12/29/75/1419122975.db2.gz HBWUECUAFKKOQP-MSOLQXFVSA-N 1 3 337.552 2.981 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@H](C(=O)N(CCNCCF)Cc2ccccc2)C1 ZINC001717006251 1419142585 /nfs/dbraw/zinc/14/25/85/1419142585.db2.gz HJEKDCPSFZEPHE-OALUTQOASA-N 1 3 349.494 2.695 10 0 EFAEHO CCC/C=C/CC[N@H+]1C[C@H]2CN(C(=O)[C@H]3CCCCN3CC)C[C@H]2C1 ZINC001717014910 1419150908 /nfs/dbraw/zinc/15/09/08/1419150908.db2.gz KCDYECBCFJOSQW-VMASUYHGSA-N 1 3 347.547 2.997 10 0 EFAEHO CCC/C=C/CC[N@@H+]1C[C@H]2CN(C(=O)[C@H]3CCCCN3CC)C[C@H]2C1 ZINC001717014910 1419150912 /nfs/dbraw/zinc/15/09/12/1419150912.db2.gz KCDYECBCFJOSQW-VMASUYHGSA-N 1 3 347.547 2.997 10 0 EFAEHO CCc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)Cc3c[nH]cn3)C2)cc1 ZINC001717100305 1419208135 /nfs/dbraw/zinc/20/81/35/1419208135.db2.gz PIEMJLZPWDPPKR-SFHVURJKSA-N 1 3 340.471 2.543 10 0 EFAEHO CC(C)CCC[NH2+]CC[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001717104816 1419211121 /nfs/dbraw/zinc/21/11/21/1419211121.db2.gz ZVGXPHFTPWOUSM-IBGZPJMESA-N 1 3 337.552 2.983 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CC[C@H]2CCN(C(=O)CN3CCCC3)C2)c1 ZINC001717110852 1419215481 /nfs/dbraw/zinc/21/54/81/1419215481.db2.gz YQMGFIKGKVIAHW-KRWDZBQOSA-N 1 3 347.478 2.558 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)CN3CCCC3)C2)c(C)c1 ZINC001717111004 1419216147 /nfs/dbraw/zinc/21/61/47/1419216147.db2.gz ZZYVAPJYHGOJRD-IBGZPJMESA-N 1 3 343.515 2.727 10 0 EFAEHO CC/C=C\CCN1Cc2ccccc2C[C@@H]1CNC(=O)CC[NH+](C)C ZINC001717243813 1419285748 /nfs/dbraw/zinc/28/57/48/1419285748.db2.gz LVEYBIWNUXZMFG-KKHYBRAUSA-N 1 3 343.515 2.838 10 0 EFAEHO C[C@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@@H]1[NH2+]CCCc1ccsc1 ZINC001717279676 1419304492 /nfs/dbraw/zinc/30/44/92/1419304492.db2.gz MTVGWAFTVMQEON-RDJZCZTQSA-N 1 3 349.544 2.602 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccccc2C)[C@@H](C)C1 ZINC001717290643 1419310501 /nfs/dbraw/zinc/31/05/01/1419310501.db2.gz PAWQWVJLKJZCAD-ICSRJNTNSA-N 1 3 345.531 2.706 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C1CCC([NH2+]CCCF)CC1 ZINC001717449884 1419399492 /nfs/dbraw/zinc/39/94/92/1419399492.db2.gz RLORIAJDUKGYGG-OFLPRAFFSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H](CNC(=O)CCCC[NH+](C)C)N(C)[C@@H]1CCc2c1cccc2F ZINC001717494797 1419416673 /nfs/dbraw/zinc/41/66/73/1419416673.db2.gz MBGPGYWKWXHIGW-HNAYVOBHSA-N 1 3 349.494 2.981 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CC2(C1)CCC[N@H+](CC=C(C)C)C2 ZINC001717628572 1419477152 /nfs/dbraw/zinc/47/71/52/1419477152.db2.gz AKMZKQSHKIMKLU-QGZVFWFLSA-N 1 3 339.499 2.557 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CC2(C1)CCC[N@@H+](CC=C(C)C)C2 ZINC001717628572 1419477155 /nfs/dbraw/zinc/47/71/55/1419477155.db2.gz AKMZKQSHKIMKLU-QGZVFWFLSA-N 1 3 339.499 2.557 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@@]2(C)CN(C(=O)C3(N(C)C)CCC3)C[C@@]2(C)C1 ZINC001717631387 1419479178 /nfs/dbraw/zinc/47/91/78/1419479178.db2.gz SSZAFVBBOQJJMH-JSXPQOMVSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@@]2(C)CN(C(=O)C3(N(C)C)CCC3)C[C@@]2(C)C1 ZINC001717631387 1419479181 /nfs/dbraw/zinc/47/91/81/1419479181.db2.gz SSZAFVBBOQJJMH-JSXPQOMVSA-N 1 3 347.547 2.997 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CCCc2cccc(C)c2)[C@H]1C ZINC001717803348 1419549130 /nfs/dbraw/zinc/54/91/30/1419549130.db2.gz WBILSUNQMLQNBQ-QUCCMNQESA-N 1 3 345.531 2.848 10 0 EFAEHO CCCc1ccc(CN2CC=C(CNC(=O)CC[NH+](C)C)CC2)cc1 ZINC001718027252 1419666762 /nfs/dbraw/zinc/66/67/62/1419666762.db2.gz FJFMYFMUYPYFAV-UHFFFAOYSA-N 1 3 343.515 2.839 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)[C@@H]1CCCN1C)c1cc(F)ccc1F ZINC001722993213 1424395804 /nfs/dbraw/zinc/39/58/04/1424395804.db2.gz UCEIRVCVHHAERD-GUYCJALGSA-N 1 3 339.430 2.558 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)[C@@H]1CCCN1C)c1cc(F)ccc1F ZINC001722993212 1424396268 /nfs/dbraw/zinc/39/62/68/1424396268.db2.gz UCEIRVCVHHAERD-DYVFJYSZSA-N 1 3 339.430 2.558 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[NH2+][C@@H]2CCc3c2cccc3F)CCC1 ZINC001723039992 1424409060 /nfs/dbraw/zinc/40/90/60/1424409060.db2.gz RADIVJYDFCGZAK-GOSISDBHSA-N 1 3 347.478 2.735 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CCCCC(F)(F)F)CC1 ZINC001723596392 1424527745 /nfs/dbraw/zinc/52/77/45/1424527745.db2.gz XDGXZQKUVRRTDC-OKILXGFUSA-N 1 3 349.441 2.830 10 0 EFAEHO CCCCC[N@@H+]1CCC[C@@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001723678081 1424553850 /nfs/dbraw/zinc/55/38/50/1424553850.db2.gz BUPGBKCQFNPUGJ-UYAOXDASSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCC[N@H+]1CCC[C@@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001723678081 1424553854 /nfs/dbraw/zinc/55/38/54/1424553854.db2.gz BUPGBKCQFNPUGJ-UYAOXDASSA-N 1 3 335.536 2.833 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001723722366 1424569097 /nfs/dbraw/zinc/56/90/97/1424569097.db2.gz VGZKSSOBUBRTLO-BJUCQYRTSA-N 1 3 333.520 2.609 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001723722366 1424569101 /nfs/dbraw/zinc/56/91/01/1424569101.db2.gz VGZKSSOBUBRTLO-BJUCQYRTSA-N 1 3 333.520 2.609 10 0 EFAEHO CN(CC(=O)NC1(C)CC[NH+](CCCCCF)CC1)C1CCC1 ZINC001724004062 1424621130 /nfs/dbraw/zinc/62/11/30/1424621130.db2.gz FZIJMIMTCPMZEE-UHFFFAOYSA-N 1 3 327.488 2.581 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H](CNCC=C(Cl)Cl)C1CCCC1 ZINC001724096001 1424654930 /nfs/dbraw/zinc/65/49/30/1424654930.db2.gz RIQKTUXURQMPTO-ZDUSSCGKSA-N 1 3 336.307 2.522 10 0 EFAEHO CC/C=C/CC[NH+]1CCC(C)(CNC(=O)Cc2nc[nH]c2C)CC1 ZINC001724301888 1424726069 /nfs/dbraw/zinc/72/60/69/1424726069.db2.gz IBYCNDOMDXWRJS-AATRIKPKSA-N 1 3 332.492 2.835 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@H](CC[NH2+]Cc3ccsc3)C2)CC1 ZINC001724731569 1424954573 /nfs/dbraw/zinc/95/45/73/1424954573.db2.gz XWEGDEOBVJOFPP-QGZVFWFLSA-N 1 3 349.544 2.808 10 0 EFAEHO CN(CC(=O)N1CCC(C)([NH2+]CCCCCF)CC1)C1CCC1 ZINC001724957537 1425165885 /nfs/dbraw/zinc/16/58/85/1425165885.db2.gz VVYWGVMEVGVQDX-UHFFFAOYSA-N 1 3 327.488 2.581 10 0 EFAEHO CC1([NH2+]CCCc2ccsc2)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001724961151 1425168747 /nfs/dbraw/zinc/16/87/47/1425168747.db2.gz VAAUCAYXZJRCLY-UHFFFAOYSA-N 1 3 346.500 2.617 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NC2CC(C[NH2+]C/C=C/Cl)C2)c1 ZINC001725076153 1425284602 /nfs/dbraw/zinc/28/46/02/1425284602.db2.gz NLGPZBPXQZRJQZ-QPJJXVBHSA-N 1 3 335.879 2.599 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@H]2C[C@H](C[NH2+]CCC3=CCCCC3)C2)C1 ZINC001725364008 1425509172 /nfs/dbraw/zinc/50/91/72/1425509172.db2.gz LUNPMZAAYZYDRA-BHIYHBOVSA-N 1 3 333.520 2.703 10 0 EFAEHO C[C@H](CCC[NH2+]Cc1ccccc1F)NC(=O)C1(N(C)C)CCC1 ZINC001725390010 1425531081 /nfs/dbraw/zinc/53/10/81/1425531081.db2.gz NJDILPBMLDLKAU-OAHLLOKOSA-N 1 3 335.467 2.685 10 0 EFAEHO C[C@@H]1[C@@H]([NH2+]CC/C=C\c2ccccc2)CCN1C(=O)Cc1c[nH]cn1 ZINC001725569383 1425655742 /nfs/dbraw/zinc/65/57/42/1425655742.db2.gz RJEDHTZGKYYNEJ-XCPAHUIFSA-N 1 3 338.455 2.635 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CCCCc2ccccc2)CN1C(=O)CN1CCCC1 ZINC001725598246 1425684376 /nfs/dbraw/zinc/68/43/76/1425684376.db2.gz UFWYDJGODSUSHN-QUCCMNQESA-N 1 3 343.515 2.684 10 0 EFAEHO Cc1cccc(C[N@H+]2CC=C(CNC(=O)CN(C)C3CCC3)CC2)c1 ZINC001725818211 1425878432 /nfs/dbraw/zinc/87/84/32/1425878432.db2.gz VNLFMEITEKMLRS-UHFFFAOYSA-N 1 3 341.499 2.728 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC=C(CNC(=O)CN(C)C3CCC3)CC2)c1 ZINC001725818211 1425878439 /nfs/dbraw/zinc/87/84/39/1425878439.db2.gz VNLFMEITEKMLRS-UHFFFAOYSA-N 1 3 341.499 2.728 10 0 EFAEHO CCC[NH2+]Cc1ccc(CNC(=O)CN2[C@H](C)CC[C@@H]2C)c(F)c1 ZINC001725833894 1425901137 /nfs/dbraw/zinc/90/11/37/1425901137.db2.gz OTQBXXVLZXMGHM-GASCZTMLSA-N 1 3 335.467 2.814 10 0 EFAEHO CCC[NH2+]Cc1ccc(CNC(=O)CN2[C@H](C)CC[C@H]2C)c(F)c1 ZINC001725833896 1425901324 /nfs/dbraw/zinc/90/13/24/1425901324.db2.gz OTQBXXVLZXMGHM-HUUCEWRRSA-N 1 3 335.467 2.814 10 0 EFAEHO CN1CC[C@]2(CC[N@H+](C[C@H](O)COc3cccc4ccccc43)C2)C1 ZINC000292179644 715813434 /nfs/dbraw/zinc/81/34/34/715813434.db2.gz QLGDQFCNDGSBIR-RXVVDRJESA-N 1 3 340.467 2.607 10 0 EFAEHO CN1CC[C@]2(CC[N@@H+](C[C@H](O)COc3cccc4ccccc43)C2)C1 ZINC000292179644 715813440 /nfs/dbraw/zinc/81/34/40/715813440.db2.gz QLGDQFCNDGSBIR-RXVVDRJESA-N 1 3 340.467 2.607 10 0 EFAEHO COCCOCCC[NH2+][C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12 ZINC000310162144 717775394 /nfs/dbraw/zinc/77/53/94/717775394.db2.gz RKDYQDCCKOJSGB-HSALFYBXSA-N 1 3 332.488 2.540 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC(C)(C)/C=C/Cl)CC2)CC1 ZINC000928927823 724518523 /nfs/dbraw/zinc/51/85/23/724518523.db2.gz KVZIXDJJKJSOQN-MDZDMXLPSA-N 1 3 341.927 2.830 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@H]1CC[C@@H](C(F)(F)F)O1 ZINC000925829007 719403686 /nfs/dbraw/zinc/40/36/86/719403686.db2.gz LPMFKMLAUOZSJH-ZBINZKHDSA-N 1 3 331.382 2.999 10 0 EFAEHO CCS(=O)(=O)c1ccccc1CC[NH2+][C@@H]1C[C@@H](N)CC(C)(C)C1 ZINC000925832072 719451628 /nfs/dbraw/zinc/45/16/28/719451628.db2.gz FOMZLTDOZBZCKQ-HZPDHXFCSA-N 1 3 338.517 2.518 10 0 EFAEHO CCS(=O)(=O)c1ccccc1CCN[C@@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925832072 719451634 /nfs/dbraw/zinc/45/16/34/719451634.db2.gz FOMZLTDOZBZCKQ-HZPDHXFCSA-N 1 3 338.517 2.518 10 0 EFAEHO CC1(C)[C@H]([NH2+]CCCN(C(=O)C2CCC2)C2CC2)[C@@H]2CCCN[C@@H]21 ZINC000925596083 720518400 /nfs/dbraw/zinc/51/84/00/720518400.db2.gz IPVIMRGMIOEVNI-FGTMMUONSA-N 1 3 333.520 2.534 10 0 EFAEHO CC1(C)[C@H]2NCCC[C@H]2[C@@H]1[NH2+]CCCC(=O)N1Cc2ccccc2C1 ZINC000925597791 720520371 /nfs/dbraw/zinc/52/03/71/720520371.db2.gz NRAANBIARKVFRT-HOJAQTOUSA-N 1 3 341.499 2.675 10 0 EFAEHO CC1(C)C[C@H]([NH3+])C[C@@H](NCCOc2ccc(C(F)(F)F)cn2)C1 ZINC000925619691 720598827 /nfs/dbraw/zinc/59/88/27/720598827.db2.gz QRAXTHCGIIWYFX-CHWSQXEVSA-N 1 3 331.382 2.975 10 0 EFAEHO CC1(C)C[C@@H](NCCOc2cccc(C(F)(F)F)n2)C[C@@H]([NH3+])C1 ZINC000925628418 720627558 /nfs/dbraw/zinc/62/75/58/720627558.db2.gz FRQGESGYKLKMEL-NEPJUHHUSA-N 1 3 331.382 2.975 10 0 EFAEHO CC[NH+](CC)Cc1ccc(CNC[C@H]2[C@H](C(=O)OC)C2(F)F)cc1 ZINC000894152823 720943940 /nfs/dbraw/zinc/94/39/40/720943940.db2.gz DSVFTJWRERELOD-JKSUJKDBSA-N 1 3 340.414 2.672 10 0 EFAEHO CC1(C)COC[C@H]1[NH2+]CCCCN1CCN(Cc2ccccc2)CC1 ZINC000894191244 721189826 /nfs/dbraw/zinc/18/98/26/721189826.db2.gz GNINDOXNFVLRPM-HXUWFJFHSA-N 1 3 345.531 2.599 10 0 EFAEHO Cn1c2ccc(CN3CCC([C@@H]4CCC[NH2+]4)CC3)cc2sc1=O ZINC000261794417 721322934 /nfs/dbraw/zinc/32/29/34/721322934.db2.gz GLANDEIZSKVUCH-HNNXBMFYSA-N 1 3 331.485 2.564 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]Cc2cnc3onc(C)c3c2)[C@H](C)C1 ZINC000894257024 721764896 /nfs/dbraw/zinc/76/48/96/721764896.db2.gz XWQWEISTFGEARW-RDTXWAMCSA-N 1 3 346.475 2.758 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2cnc3onc(C)c3c2)[C@@H](C)C1 ZINC000894257022 721764908 /nfs/dbraw/zinc/76/49/08/721764908.db2.gz XWQWEISTFGEARW-KSSFIOAISA-N 1 3 346.475 2.758 10 0 EFAEHO CCN1CCN(C[C@H](C)C[NH2+][C@@H]2CCc3c2nccc3Cl)CC1 ZINC000924953164 721862584 /nfs/dbraw/zinc/86/25/84/721862584.db2.gz PZWWHQKDMUYLFF-RHSMWYFYSA-N 1 3 336.911 2.586 10 0 EFAEHO CCN1CCN(C[C@@H](C)C[NH2+][C@H]2CCc3c2nccc3Cl)CC1 ZINC000924953166 721862594 /nfs/dbraw/zinc/86/25/94/721862594.db2.gz PZWWHQKDMUYLFF-YOEHRIQHSA-N 1 3 336.911 2.586 10 0 EFAEHO CN(C)Cc1ccc(C[NH2+]Cc2ccn(C)c2)c2c1OC(F)(F)O2 ZINC000894322884 722092023 /nfs/dbraw/zinc/09/20/23/722092023.db2.gz GKWVAXCTFZXRNA-UHFFFAOYSA-N 1 3 337.370 2.698 10 0 EFAEHO CCN(Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1[C@H](C(=O)OC)C1(F)F ZINC000894764253 722841529 /nfs/dbraw/zinc/84/15/29/722841529.db2.gz GCTWBJPJYMDMIW-HZPDHXFCSA-N 1 3 340.414 2.624 10 0 EFAEHO CCNC(=O)[C@@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C(C)C ZINC000894858105 722901286 /nfs/dbraw/zinc/90/12/86/722901286.db2.gz YMOOWRSLBYREDD-MUGJNUQGSA-N 1 3 343.515 2.790 10 0 EFAEHO COc1ccc([C@H](NC(C)C)C(=O)N(C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000896621876 723410599 /nfs/dbraw/zinc/41/05/99/723410599.db2.gz BVDXNZOURJKIET-WDYCEAGBSA-N 1 3 347.503 2.675 10 0 EFAEHO COc1ccc([C@H](NC(C)C)C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000896621876 723410601 /nfs/dbraw/zinc/41/06/01/723410601.db2.gz BVDXNZOURJKIET-WDYCEAGBSA-N 1 3 347.503 2.675 10 0 EFAEHO COC(=O)[C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C1 ZINC000895314065 724024500 /nfs/dbraw/zinc/02/45/00/724024500.db2.gz IURMAHIKLLSMLI-QTMHVTGLSA-N 1 3 328.456 2.581 10 0 EFAEHO COC(=O)[C@H]1C[C@@H](N[C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1 ZINC000895314065 724024504 /nfs/dbraw/zinc/02/45/04/724024504.db2.gz IURMAHIKLLSMLI-QTMHVTGLSA-N 1 3 328.456 2.581 10 0 EFAEHO COC(=O)[C@H]1C[C@@H](N[C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1 ZINC000895314065 724024506 /nfs/dbraw/zinc/02/45/06/724024506.db2.gz IURMAHIKLLSMLI-QTMHVTGLSA-N 1 3 328.456 2.581 10 0 EFAEHO CC(C)(C)OC(=O)N1CC(C[NH2+]C[C@H]2CCCN(CC3CC3)C2)C1 ZINC000895360072 724072612 /nfs/dbraw/zinc/07/26/12/724072612.db2.gz MENDXIVURRPACH-MRXNPFEDSA-N 1 3 337.508 2.565 10 0 EFAEHO COc1ccc(C2=NO[C@@H](C[NH2+][C@H]3CCN(C)C(C)(C)C3)C2)cc1C ZINC000895500542 724170805 /nfs/dbraw/zinc/17/08/05/724170805.db2.gz AOZMWPBIPODMHY-DLBZAZTESA-N 1 3 345.487 2.959 10 0 EFAEHO O=C(NCC1CC[NH+](C2CC2)CC1)c1ccc(NC2=NCCC2)cc1 ZINC000907783464 727016564 /nfs/dbraw/zinc/01/65/64/727016564.db2.gz TZXLQPJOCZQFLT-UHFFFAOYSA-N 1 3 340.471 2.895 10 0 EFAEHO CC[C@H]1C[N@H+](C)CCCN1C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000907931234 727048526 /nfs/dbraw/zinc/04/85/26/727048526.db2.gz SKXDQHLMHPDYRC-KRWDZBQOSA-N 1 3 328.460 2.847 10 0 EFAEHO CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000907931234 727048530 /nfs/dbraw/zinc/04/85/30/727048530.db2.gz SKXDQHLMHPDYRC-KRWDZBQOSA-N 1 3 328.460 2.847 10 0 EFAEHO CCCN(C(=O)c1ccc(NC2=NCCC2)cc1)[C@@H]1CC[N@H+](C)C1 ZINC000911511486 727553103 /nfs/dbraw/zinc/55/31/03/727553103.db2.gz HCXPDVFEFVDHTR-QGZVFWFLSA-N 1 3 328.460 2.847 10 0 EFAEHO CCCN(C(=O)c1ccc(NC2=NCCC2)cc1)[C@@H]1CC[N@@H+](C)C1 ZINC000911511486 727553105 /nfs/dbraw/zinc/55/31/05/727553105.db2.gz HCXPDVFEFVDHTR-QGZVFWFLSA-N 1 3 328.460 2.847 10 0 EFAEHO C[N@@H+]1C[C@@]2(C)CN(C(=O)c3cccc(CN4CCCC4)c3)C[C@@]2(C)C1 ZINC000913290092 727817237 /nfs/dbraw/zinc/81/72/37/727817237.db2.gz OGPJWQZOTRLVCF-OYRHEFFESA-N 1 3 341.499 2.696 10 0 EFAEHO C[N@H+]1C[C@@]2(C)CN(C(=O)c3cccc(CN4CCCC4)c3)C[C@@]2(C)C1 ZINC000913290092 727817239 /nfs/dbraw/zinc/81/72/39/727817239.db2.gz OGPJWQZOTRLVCF-OYRHEFFESA-N 1 3 341.499 2.696 10 0 EFAEHO CC1(C)C[C@H]([NH3+])C[C@@H](NCc2cccc(CN3CCOCC3)c2)C1 ZINC000925478116 729149961 /nfs/dbraw/zinc/14/99/61/729149961.db2.gz SVASNDOSNCLEIZ-RTBURBONSA-N 1 3 331.504 2.514 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@H+](CC=C(C)C)C1 ZINC001569436590 1085210780 /nfs/dbraw/zinc/21/07/80/1085210780.db2.gz JLSSRFQVFJYMJK-RBUKOAKNSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@@H+](CC=C(C)C)C1 ZINC001569436590 1085210791 /nfs/dbraw/zinc/21/07/91/1085210791.db2.gz JLSSRFQVFJYMJK-RBUKOAKNSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCCC[NH+]1CCC2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)CC1 ZINC001569471072 1085269848 /nfs/dbraw/zinc/26/98/48/1085269848.db2.gz RGPSONZTHKMSCT-GOSISDBHSA-N 1 3 335.536 2.833 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CCCC2CCCC2)CCN1C(=O)Cc1c[nH]cn1 ZINC001569524163 1085337674 /nfs/dbraw/zinc/33/76/74/1085337674.db2.gz YFCLIOZWQUGHMB-RDJZCZTQSA-N 1 3 332.492 2.892 10 0 EFAEHO CC(C)(C(=O)N1CC[C@](C)(C[NH2+]CCC2CC2)C1)N1CCCCC1 ZINC001569669733 1085501248 /nfs/dbraw/zinc/50/12/48/1085501248.db2.gz UQOAMNRJORKTTH-HXUWFJFHSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@](C)(C[NH2+]CCC2CCCC2)C1)N(C)C ZINC001569691284 1085521951 /nfs/dbraw/zinc/52/19/51/1085521951.db2.gz WJJKAMUXXMYBIS-UYAOXDASSA-N 1 3 337.552 2.981 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@H]2CN(C(=O)[C@@H]3CCCCN3CC)C[C@H]2C1 ZINC001569883775 1085717399 /nfs/dbraw/zinc/71/73/99/1085717399.db2.gz ILJDVRSZSVOKQK-CMZLPQLFSA-N 1 3 333.520 2.607 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3CCCCN3CC)C[C@H]2C1 ZINC001569883775 1085717404 /nfs/dbraw/zinc/71/74/04/1085717404.db2.gz ILJDVRSZSVOKQK-CMZLPQLFSA-N 1 3 333.520 2.607 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H]2[C@@H]1CC[N@@H+]2CCCCCF)N(C)C ZINC001569912189 1085752724 /nfs/dbraw/zinc/75/27/24/1085752724.db2.gz GARLRKBJJBZBLT-FGTMMUONSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H]2[C@@H]1CC[N@H+]2CCCCCF)N(C)C ZINC001569912189 1085752734 /nfs/dbraw/zinc/75/27/34/1085752734.db2.gz GARLRKBJJBZBLT-FGTMMUONSA-N 1 3 341.515 2.778 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CC[C@@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)c1 ZINC001569968485 1085796494 /nfs/dbraw/zinc/79/64/94/1085796494.db2.gz JNXITUODESNQDU-APWZRJJASA-N 1 3 347.478 2.557 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@@H]2CCN(C(=O)Cc3c[nH]cn3)C2)c1 ZINC001570005418 1085848399 /nfs/dbraw/zinc/84/83/99/1085848399.db2.gz NHBJPSIDUAVSLQ-QGZVFWFLSA-N 1 3 340.471 2.543 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@H]2CCN(C(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001570005822 1085848782 /nfs/dbraw/zinc/84/87/82/1085848782.db2.gz NZGGJEQTHGVRJD-OALUTQOASA-N 1 3 343.515 2.665 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CC[C@@H](CC[NH2+]Cc2ccc(Cl)cc2)C1 ZINC001570006205 1085850171 /nfs/dbraw/zinc/85/01/71/1085850171.db2.gz VOSPUGPDTDMVFS-OAHLLOKOSA-N 1 3 346.862 2.634 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]Cc2ccccc2)C1 ZINC001570021205 1085869256 /nfs/dbraw/zinc/86/92/56/1085869256.db2.gz CMTUUAFXLJDDER-VQTJNVASSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](CC[NH2+]C[C@@H]2CCC(F)(F)C2)C1 ZINC001570021613 1085869626 /nfs/dbraw/zinc/86/96/26/1085869626.db2.gz HWBZPGAUBPCDLX-JKSUJKDBSA-N 1 3 345.478 2.590 10 0 EFAEHO CC1CCN(CC(=O)N2CCCC[C@@H]2C[NH2+]CCC(F)(F)F)CC1 ZINC001570091810 1085942907 /nfs/dbraw/zinc/94/29/07/1085942907.db2.gz IPCAXUDGZJECPG-OAHLLOKOSA-N 1 3 349.441 2.641 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCC[N@H+](CCCCCF)CC1)C1CCC1 ZINC001570177950 1086017578 /nfs/dbraw/zinc/01/75/78/1086017578.db2.gz WASWTWHIGSABIZ-MRXNPFEDSA-N 1 3 327.488 2.581 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCC[N@@H+](CCCCCF)CC1)C1CCC1 ZINC001570177950 1086017586 /nfs/dbraw/zinc/01/75/86/1086017586.db2.gz WASWTWHIGSABIZ-MRXNPFEDSA-N 1 3 327.488 2.581 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H]([NH2+]CC/C=C/c2ccccc2)C1 ZINC001570362263 1086168262 /nfs/dbraw/zinc/16/82/62/1086168262.db2.gz RNCSOUGAHQCWOI-KOXHKMTQSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H]2CN(C(=O)CCCC[NH+](C)C)C[C@@H]2C)c1 ZINC001570362466 1086168592 /nfs/dbraw/zinc/16/85/92/1086168592.db2.gz VSKKKQFPOVWGDR-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CCCF ZINC001570519437 1086306017 /nfs/dbraw/zinc/30/60/17/1086306017.db2.gz NLQVLXLBHZEZAM-GUDVDZBRSA-N 1 3 347.478 2.591 10 0 EFAEHO CC[C@H](C(=O)N1C[C@]2(C)C[N@H+](CCCCCF)C[C@]2(C)C1)N(C)C ZINC001571064617 1086658860 /nfs/dbraw/zinc/65/88/60/1086658860.db2.gz SIPBHDJVCGUBRE-QRQLOZEOSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](C(=O)N1C[C@]2(C)C[N@@H+](CCCCCF)C[C@]2(C)C1)N(C)C ZINC001571064617 1086658866 /nfs/dbraw/zinc/65/88/66/1086658866.db2.gz SIPBHDJVCGUBRE-QRQLOZEOSA-N 1 3 341.515 2.637 10 0 EFAEHO Cc1ccc(C[NH2+]CCC[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001571269772 1086693376 /nfs/dbraw/zinc/69/33/76/1086693376.db2.gz DIDADPRBZJHKFP-KRWDZBQOSA-N 1 3 331.504 2.854 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CCC[C@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001571308219 1086707877 /nfs/dbraw/zinc/70/78/77/1086707877.db2.gz LNULWTXSGYXVHF-WBVHZDCISA-N 1 3 349.494 2.850 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CCC[C@@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001571308216 1086707947 /nfs/dbraw/zinc/70/79/47/1086707947.db2.gz LNULWTXSGYXVHF-DOTOQJQBSA-N 1 3 349.494 2.850 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N(C)[C@H](C[NH2+]CCC(F)(F)F)C1CC1 ZINC001571360109 1086754938 /nfs/dbraw/zinc/75/49/38/1086754938.db2.gz LUPUIRCRXRMJTG-HUUCEWRRSA-N 1 3 349.441 2.638 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CCCc2ccccc2)[C@H]1C ZINC001571465916 1086840213 /nfs/dbraw/zinc/84/02/13/1086840213.db2.gz MVVFTTPMXCERGV-MJGOQNOKSA-N 1 3 331.504 2.540 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2ccccc2)[C@H]1C ZINC001571467692 1086843789 /nfs/dbraw/zinc/84/37/89/1086843789.db2.gz PFKUMHBMLQCMHN-IEBWSBKVSA-N 1 3 331.504 2.538 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CCCCCF)CN1C(=O)CN(C)CC(C)(C)C ZINC001571487592 1086875888 /nfs/dbraw/zinc/87/58/88/1086875888.db2.gz UPXCXLQILFELGB-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H]2CC[C@@H](C[NH2+]CCCF)C2)c1 ZINC001571550828 1086954467 /nfs/dbraw/zinc/95/44/67/1086954467.db2.gz VBQWZJJVJGVNRR-CRAIPNDOSA-N 1 3 335.467 2.596 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1)C1CCC1 ZINC001571689042 1087052249 /nfs/dbraw/zinc/05/22/49/1087052249.db2.gz JBGAVTWVEFRDAA-CEXWTWQISA-N 1 3 345.531 2.655 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1)C1CCC1 ZINC001571689042 1087052256 /nfs/dbraw/zinc/05/22/56/1087052256.db2.gz JBGAVTWVEFRDAA-CEXWTWQISA-N 1 3 345.531 2.655 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)N(CCN(C)C)Cc3ccsc3)C[N@@H+]2C1 ZINC001646974731 1088692726 /nfs/dbraw/zinc/69/27/26/1088692726.db2.gz PESFLDQRSREBQT-NXHRZFHOSA-N 1 3 349.544 2.759 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)N(CCN(C)C)Cc3ccsc3)C[N@H+]2C1 ZINC001646974731 1088692732 /nfs/dbraw/zinc/69/27/32/1088692732.db2.gz PESFLDQRSREBQT-NXHRZFHOSA-N 1 3 349.544 2.759 10 0 EFAEHO Cc1cc(C)c(C[NH2+]CCN(C)C(=O)[C@@H](C(C)C)N(C)C)c(C)c1 ZINC001267004588 1092299599 /nfs/dbraw/zinc/29/95/99/1092299599.db2.gz FMPBGDQFRSBEIK-LJQANCHMSA-N 1 3 333.520 2.746 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H]([NH2+]CCCc3ccccc3)C2)CC1 ZINC001267021464 1092381334 /nfs/dbraw/zinc/38/13/34/1092381334.db2.gz HSVWSALYXDWTCR-FQEVSTJZSA-N 1 3 343.515 2.542 10 0 EFAEHO CCCCCC[N@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001480913475 1092391682 /nfs/dbraw/zinc/39/16/82/1092391682.db2.gz OPGPQWZMDTUZOB-GOSISDBHSA-N 1 3 329.504 2.827 10 0 EFAEHO CCCCCC[N@@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001480913475 1092391691 /nfs/dbraw/zinc/39/16/91/1092391691.db2.gz OPGPQWZMDTUZOB-GOSISDBHSA-N 1 3 329.504 2.827 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)CCC)C[C@@H]2C1 ZINC001649432825 1092449125 /nfs/dbraw/zinc/44/91/25/1092449125.db2.gz DVTDIKJITNNVNX-ZSQQTYLHSA-N 1 3 335.536 2.855 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)CCC)C[C@@H]2C1 ZINC001649432825 1092449131 /nfs/dbraw/zinc/44/91/31/1092449131.db2.gz DVTDIKJITNNVNX-ZSQQTYLHSA-N 1 3 335.536 2.855 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](C[NH2+]CCCc2cccc(F)c2)C1)N(C)C ZINC001267059084 1092498396 /nfs/dbraw/zinc/49/83/96/1092498396.db2.gz SFWKZUALRXXTQK-HKUYNNGSSA-N 1 3 349.494 2.537 10 0 EFAEHO CCC[NH2+]CCc1ccc(CNC(=O)CN2[C@@H](C)CC[C@@H]2C)cc1 ZINC001267098452 1092697443 /nfs/dbraw/zinc/69/74/43/1092697443.db2.gz QTYIAIXRRXURQU-IRXDYDNUSA-N 1 3 331.504 2.718 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H]([N@H+](C)CCCCCF)C1)N(C)C ZINC001267112333 1092779333 /nfs/dbraw/zinc/77/93/33/1092779333.db2.gz YDEJCISDXVOQBW-DLBZAZTESA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H]([N@@H+](C)CCCCCF)C1)N(C)C ZINC001267112333 1092779341 /nfs/dbraw/zinc/77/93/41/1092779341.db2.gz YDEJCISDXVOQBW-DLBZAZTESA-N 1 3 329.504 2.635 10 0 EFAEHO CN(CC(=O)NCCC[C@H]1CCC[N@@H+]1CCC(F)(F)F)C1CCC1 ZINC001267169862 1093043479 /nfs/dbraw/zinc/04/34/79/1093043479.db2.gz YRCWSRHMEDHKGV-HNNXBMFYSA-N 1 3 349.441 2.784 10 0 EFAEHO CN(CC(=O)NCCC[C@H]1CCC[N@H+]1CCC(F)(F)F)C1CCC1 ZINC001267169862 1093043484 /nfs/dbraw/zinc/04/34/84/1093043484.db2.gz YRCWSRHMEDHKGV-HNNXBMFYSA-N 1 3 349.441 2.784 10 0 EFAEHO Cc1ccc(F)c(CN2CC[C@H](CNC(=O)CCCC[NH+](C)C)C2)c1 ZINC001267307179 1093537387 /nfs/dbraw/zinc/53/73/87/1093537387.db2.gz NGEVUTMNSISDCY-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO CN(CCNCc1ccccc1F)C(=O)C(C)(C)[NH+]1CCCCC1 ZINC001267373230 1094351187 /nfs/dbraw/zinc/35/11/87/1094351187.db2.gz QYGIMCNDIYMDLZ-UHFFFAOYSA-N 1 3 335.467 2.638 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N(C)CCNCc1cc2ccccc2o1 ZINC001267380715 1094403500 /nfs/dbraw/zinc/40/35/00/1094403500.db2.gz NYZOGULYHXPBMC-SFHVURJKSA-N 1 3 343.471 2.855 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N(C)CCNCc1cc2ccccc2o1 ZINC001267380715 1094403501 /nfs/dbraw/zinc/40/35/01/1094403501.db2.gz NYZOGULYHXPBMC-SFHVURJKSA-N 1 3 343.471 2.855 10 0 EFAEHO CCC[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC[C@H](C)F ZINC001493318268 1094449363 /nfs/dbraw/zinc/44/93/63/1094449363.db2.gz ORTHZNKWLLULPN-YJBOKZPZSA-N 1 3 347.494 2.775 10 0 EFAEHO CCC[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC[C@H](C)F ZINC001493318268 1094449368 /nfs/dbraw/zinc/44/93/68/1094449368.db2.gz ORTHZNKWLLULPN-YJBOKZPZSA-N 1 3 347.494 2.775 10 0 EFAEHO Cc1cccc(CCC[N@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001481125325 1094835947 /nfs/dbraw/zinc/83/59/47/1094835947.db2.gz CEOZSWFIHKUTRE-HXUWFJFHSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1cccc(CCC[N@@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001481125325 1094835959 /nfs/dbraw/zinc/83/59/59/1094835959.db2.gz CEOZSWFIHKUTRE-HXUWFJFHSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@H+](C)Cc2ccc(CF)cc2)C1 ZINC001481507670 1094991146 /nfs/dbraw/zinc/99/11/46/1094991146.db2.gz DELCCBGGVZSGPX-IBGZPJMESA-N 1 3 349.494 2.777 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@@H+](C)Cc2ccc(CF)cc2)C1 ZINC001481507670 1094991150 /nfs/dbraw/zinc/99/11/50/1094991150.db2.gz DELCCBGGVZSGPX-IBGZPJMESA-N 1 3 349.494 2.777 10 0 EFAEHO CC[C@H](F)C[N@H+](C)CC1CCN(C(=O)[C@H]2CCCCN2CC)CC1 ZINC001481521680 1095092836 /nfs/dbraw/zinc/09/28/36/1095092836.db2.gz NFWQJEVRLNZNDW-ZWKOTPCHSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)CC1CCN(C(=O)[C@H]2CCCCN2CC)CC1 ZINC001481521680 1095092850 /nfs/dbraw/zinc/09/28/50/1095092850.db2.gz NFWQJEVRLNZNDW-ZWKOTPCHSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@H](C[NH2+]CCCC(C)(C)C)N(C)C(=O)CN1CCC(C)CC1 ZINC001268093944 1095310608 /nfs/dbraw/zinc/31/06/08/1095310608.db2.gz RBJOUUFNAMHNTH-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@H](C[NH2+]C/C=C/Cl)C2CCCCC2)C1 ZINC001268118688 1095404481 /nfs/dbraw/zinc/40/44/81/1095404481.db2.gz CWYMRSLFBIXBJH-ONLMNPRXSA-N 1 3 341.927 2.735 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC[C@H]1CCCCN1C(=O)CN(C)C1CCC1 ZINC001268152964 1095545998 /nfs/dbraw/zinc/54/59/98/1095545998.db2.gz BPTUKKHUVPQQRS-NVXWUHKLSA-N 1 3 327.488 2.580 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@H]1CC[NH2+]Cc1ccccc1F ZINC001268160510 1095589028 /nfs/dbraw/zinc/58/90/28/1095589028.db2.gz UEGZFSALSNDLQW-PKOBYXMFSA-N 1 3 347.478 2.781 10 0 EFAEHO CC[N@H+](CCNC(=O)C1(N(C)C)CCC1)Cc1ccc(C2CC2)cc1 ZINC001480978621 1095645980 /nfs/dbraw/zinc/64/59/80/1095645980.db2.gz GJOMXGCOLBDCAI-UHFFFAOYSA-N 1 3 343.515 2.986 10 0 EFAEHO CC[N@@H+](CCNC(=O)C1(N(C)C)CCC1)Cc1ccc(C2CC2)cc1 ZINC001480978621 1095645987 /nfs/dbraw/zinc/64/59/87/1095645987.db2.gz GJOMXGCOLBDCAI-UHFFFAOYSA-N 1 3 343.515 2.986 10 0 EFAEHO CCC(CC)C[NH+]1CC(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001481644248 1096133118 /nfs/dbraw/zinc/13/31/18/1096133118.db2.gz DBZFCZMRRNDUDL-LJQANCHMSA-N 1 3 341.515 2.683 10 0 EFAEHO Cc1ccc(CN2CCC[C@H]2CNC(=O)C(C)(C)[NH+]2CCCC2)cc1 ZINC001481051467 1096170797 /nfs/dbraw/zinc/17/07/97/1096170797.db2.gz FHVMIUSQZYSJRA-IBGZPJMESA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(CN2CCC[C@@H]2CNC(=O)C(C)(C)[NH+]2CCCC2)cc1 ZINC001481051468 1096170870 /nfs/dbraw/zinc/17/08/70/1096170870.db2.gz FHVMIUSQZYSJRA-LJQANCHMSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)C[NH+]3[C@@H](C)CC[C@@H]3C)C2)c(C)c1 ZINC001481660978 1096259050 /nfs/dbraw/zinc/25/90/50/1096259050.db2.gz QVWSBEKGBCRQPA-ROUUACIJSA-N 1 3 343.515 2.724 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccc(Cl)cc1)NC(=O)C1(N(C)C)CCC1 ZINC001268369136 1096405936 /nfs/dbraw/zinc/40/59/36/1096405936.db2.gz RINYTZGFHJQHOP-AWEZNQCLSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccc(Cl)cc1)NC(=O)C1(N(C)C)CCC1 ZINC001268369137 1096406058 /nfs/dbraw/zinc/40/60/58/1096406058.db2.gz RINYTZGFHJQHOP-CQSZACIVSA-N 1 3 337.895 2.809 10 0 EFAEHO CN(C(=O)CCC[NH+](C)C)[C@@H]1CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001481738983 1096475613 /nfs/dbraw/zinc/47/56/13/1096475613.db2.gz RMUHWECVEZWQLR-GOSISDBHSA-N 1 3 342.487 2.542 10 0 EFAEHO CN(C(=O)CCCC[NH+](C)C)[C@@H]1CCN(CCc2ccccc2F)C1 ZINC001481746142 1096501171 /nfs/dbraw/zinc/50/11/71/1096501171.db2.gz AFNOSYFAVWODIO-GOSISDBHSA-N 1 3 349.494 2.633 10 0 EFAEHO CN(C(=O)C[C@H]1CC[N@H+](C)C1)[C@@H]1CCN(CCCCC(F)(F)F)C1 ZINC001481747175 1096509212 /nfs/dbraw/zinc/50/92/12/1096509212.db2.gz NHFXTTLYLSFVJG-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO CN(C(=O)C[C@H]1CC[N@@H+](C)C1)[C@@H]1CCN(CCCCC(F)(F)F)C1 ZINC001481747175 1096509216 /nfs/dbraw/zinc/50/92/16/1096509216.db2.gz NHFXTTLYLSFVJG-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cccc(F)c1Cl)N(C)C ZINC001268412812 1096543427 /nfs/dbraw/zinc/54/34/27/1096543427.db2.gz AZKTXZMTTBCLSB-SWLSCSKDSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001268414594 1096557438 /nfs/dbraw/zinc/55/74/38/1096557438.db2.gz LKFGTRKACJVKQU-MJGOQNOKSA-N 1 3 333.520 2.936 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CC[C@H](C)NC(=O)[C@H](C(C)C)N(C)C ZINC001268418578 1096567837 /nfs/dbraw/zinc/56/78/37/1096567837.db2.gz YMZRMVTWCCFZQY-YJBOKZPZSA-N 1 3 337.483 2.705 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc2ccccc2c1)C(=O)[C@@H]1CCCN1C ZINC001268440136 1096598522 /nfs/dbraw/zinc/59/85/22/1096598522.db2.gz XDGUIGGFJPEQTL-FQEVSTJZSA-N 1 3 339.483 2.872 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001481774497 1096673257 /nfs/dbraw/zinc/67/32/57/1096673257.db2.gz KZNCOZRGFNORCG-IEBWSBKVSA-N 1 3 347.547 2.831 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001481774497 1096673260 /nfs/dbraw/zinc/67/32/60/1096673260.db2.gz KZNCOZRGFNORCG-IEBWSBKVSA-N 1 3 347.547 2.831 10 0 EFAEHO CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@@H+](C(C)C)C1 ZINC001481775102 1096674326 /nfs/dbraw/zinc/67/43/26/1096674326.db2.gz RJGKNDWQPXLKKT-CRAIPNDOSA-N 1 3 327.488 2.530 10 0 EFAEHO CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@H+](C(C)C)C1 ZINC001481775102 1096674330 /nfs/dbraw/zinc/67/43/30/1096674330.db2.gz RJGKNDWQPXLKKT-CRAIPNDOSA-N 1 3 327.488 2.530 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCC[N@@H+]1C(C)C)NCC=C(Cl)Cl ZINC001481810361 1096723025 /nfs/dbraw/zinc/72/30/25/1096723025.db2.gz GACVEWMAFTWKHU-OLZOCXBDSA-N 1 3 336.307 2.663 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCC[N@H+]1C(C)C)NCC=C(Cl)Cl ZINC001481810361 1096723029 /nfs/dbraw/zinc/72/30/29/1096723029.db2.gz GACVEWMAFTWKHU-OLZOCXBDSA-N 1 3 336.307 2.663 10 0 EFAEHO CCN(CCNCc1ccc(C)c(F)c1)C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001268458702 1096736486 /nfs/dbraw/zinc/73/64/86/1096736486.db2.gz HZETYBXRCYBXFA-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CCN(CCNCc1ccc(C)c(F)c1)C(=O)CC[C@H]1CCC[N@H+]1C ZINC001268458702 1096736494 /nfs/dbraw/zinc/73/64/94/1096736494.db2.gz HZETYBXRCYBXFA-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)NCC=C(Cl)Cl ZINC001481844048 1096780696 /nfs/dbraw/zinc/78/06/96/1096780696.db2.gz LSKXOUOWALQILQ-RWMBFGLXSA-N 1 3 336.307 2.520 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)NCC=C(Cl)Cl ZINC001481844048 1096780704 /nfs/dbraw/zinc/78/07/04/1096780704.db2.gz LSKXOUOWALQILQ-RWMBFGLXSA-N 1 3 336.307 2.520 10 0 EFAEHO CC[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]Cc1ccccc1 ZINC001481849266 1096791764 /nfs/dbraw/zinc/79/17/64/1096791764.db2.gz CBHVVPOEHGXFDI-YLJYHZDGSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@H](CNC(=O)[C@H](C(C)C)[NH+]1CCCC1)NCc1ccccc1F ZINC001481882207 1096853524 /nfs/dbraw/zinc/85/35/24/1096853524.db2.gz PQKCPQHGEODEQQ-MJGOQNOKSA-N 1 3 349.494 2.931 10 0 EFAEHO CCN(CCNCc1cnccc1C)C(=O)[C@@H]1CCCC[N@@H+]1C(C)C ZINC001268482020 1096918740 /nfs/dbraw/zinc/91/87/40/1096918740.db2.gz KRUSPBNRFDZCTI-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO CCN(CCNCc1cnccc1C)C(=O)[C@@H]1CCCC[N@H+]1C(C)C ZINC001268482020 1096918746 /nfs/dbraw/zinc/91/87/46/1096918746.db2.gz KRUSPBNRFDZCTI-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO CCN(CC[NH2+]Cc1c(C)cc(C)cc1C)C(=O)CN1CCCC1 ZINC001268498814 1096992756 /nfs/dbraw/zinc/99/27/56/1096992756.db2.gz WBNKXQAGKQHMQY-UHFFFAOYSA-N 1 3 331.504 2.646 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H](CC[NH2+]Cc2ccccc2)C1)N(C)C ZINC001481987784 1097043819 /nfs/dbraw/zinc/04/38/19/1097043819.db2.gz KZRGQFJKFNVDHH-MOPGFXCFSA-N 1 3 331.504 2.745 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@@H](CC[NH2+]C/C=C\Cl)C2)CC1 ZINC001481989650 1097054292 /nfs/dbraw/zinc/05/42/92/1097054292.db2.gz QKLRUSTUUPUQKX-VCKUIECUSA-N 1 3 341.927 2.689 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](CC[NH2+]C/C=C/Cl)C1 ZINC001481990432 1097055060 /nfs/dbraw/zinc/05/50/60/1097055060.db2.gz AAVYMKHWEROZHF-DTIZEGCPSA-N 1 3 341.927 2.832 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001481990549 1097055855 /nfs/dbraw/zinc/05/58/55/1097055855.db2.gz ZWWWZHMHMBYSBO-ZWKOTPCHSA-N 1 3 341.515 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](CC[NH2+]CC2CC(C)(C)C2)C1 ZINC001481991596 1097057782 /nfs/dbraw/zinc/05/77/82/1097057782.db2.gz PMMYKNWPCRGNJW-QGZVFWFLSA-N 1 3 337.552 2.981 10 0 EFAEHO CC/C=C/CC[NH2+]CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001482003575 1097077332 /nfs/dbraw/zinc/07/73/32/1097077332.db2.gz GTQWGLPYNQTSSL-WRFKIARRSA-N 1 3 335.536 2.903 10 0 EFAEHO CC(C)=CC[NH2+]Cc1ccc(CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001482034708 1097132354 /nfs/dbraw/zinc/13/23/54/1097132354.db2.gz YCVNKQQXSHUKOB-KRWDZBQOSA-N 1 3 329.488 2.700 10 0 EFAEHO O=C(NC/C=C\CNC/C=C\Cl)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001268538872 1097145165 /nfs/dbraw/zinc/14/51/65/1097145165.db2.gz NVTVRBWDWQSTKE-CAXMWIBCSA-N 1 3 339.911 2.656 10 0 EFAEHO O=C(NC/C=C\CNC/C=C\Cl)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001268538872 1097145166 /nfs/dbraw/zinc/14/51/66/1097145166.db2.gz NVTVRBWDWQSTKE-CAXMWIBCSA-N 1 3 339.911 2.656 10 0 EFAEHO CC(C)(C(=O)NC/C=C\CNCc1ccc(F)cc1)[NH+]1CCCCC1 ZINC001268537796 1097147303 /nfs/dbraw/zinc/14/73/03/1097147303.db2.gz DIECSVGLMRPAPH-PLNGDYQASA-N 1 3 347.478 2.852 10 0 EFAEHO Cc1ccc(F)c(CN2CCC(CCNC(=O)CC[NH+](C)C)CC2)c1 ZINC001482046833 1097166740 /nfs/dbraw/zinc/16/67/40/1097166740.db2.gz XSHHFESYOQJIRX-UHFFFAOYSA-N 1 3 349.494 2.804 10 0 EFAEHO C[C@@H](NC/C=C\CNC(=O)C12CCC[NH+]1CCC2)c1ccc(F)cc1 ZINC001268562247 1097196796 /nfs/dbraw/zinc/19/67/96/1097196796.db2.gz FIILPKMISITWCC-RXYHWBRQSA-N 1 3 345.462 2.777 10 0 EFAEHO C[C@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@@H]1C[NH2+]CCCC(C)(C)C ZINC001279113181 1097211922 /nfs/dbraw/zinc/21/19/22/1097211922.db2.gz NBFRWOKXMSBXOH-IRXDYDNUSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001482065699 1097215455 /nfs/dbraw/zinc/21/54/55/1097215455.db2.gz OCUOONBMUKPAJD-HZPDHXFCSA-N 1 3 345.478 2.734 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC[C@@H]2C[NH2+]C/C=C\Cl)c1 ZINC001482068687 1097227712 /nfs/dbraw/zinc/22/77/12/1097227712.db2.gz WOHOQVKANLMCLB-VWTAQGJOSA-N 1 3 335.879 2.695 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C/C=C\CNC(=O)[C@H]1CCCN1C ZINC001268574932 1097246308 /nfs/dbraw/zinc/24/63/08/1097246308.db2.gz NPLHFUINKDGSRC-CWIOURORSA-N 1 3 335.879 2.505 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C/CNC(=O)CN(C)CC(C)(C)C)cc1F ZINC001268591779 1097315014 /nfs/dbraw/zinc/31/50/14/1097315014.db2.gz UGNFYMLGDHTUHK-VOTSOKGWSA-N 1 3 349.494 2.874 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C/C[NH2+][C@@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001268593289 1097329487 /nfs/dbraw/zinc/32/94/87/1097329487.db2.gz UBTPSUDKXLDZTK-VGRIIWOTSA-N 1 3 349.906 2.930 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)C[NH2+]CCC1CCCCCC1 ZINC001482162750 1097418410 /nfs/dbraw/zinc/41/84/10/1097418410.db2.gz DJXFZPVBHAMBFB-OAHLLOKOSA-N 1 3 334.508 2.963 10 0 EFAEHO CC[C@H](C(=O)NC/C=C\C[NH2+][C@@H](C)c1ccc2c(c1)CCC2)N(C)C ZINC001268615996 1097466311 /nfs/dbraw/zinc/46/63/11/1097466311.db2.gz FKFBVJHAUYJIER-WBJHSIEHSA-N 1 3 343.515 2.839 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)C[NH+]2[C@H](C)CC[C@H]2C)c(C)s1 ZINC001268629322 1097483062 /nfs/dbraw/zinc/48/30/62/1097483062.db2.gz VMGYCDUSDHBCHL-JBZXTQMFSA-N 1 3 349.544 3.000 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]C/C=C/c1ccc(Cl)cc1)N(C)C ZINC001268651015 1097505868 /nfs/dbraw/zinc/50/58/68/1097505868.db2.gz HGHXIVWBIQFKNV-CMFPSAGXSA-N 1 3 337.895 2.788 10 0 EFAEHO CN(CCC[NH2+][C@H]1CCCc2ccc(F)cc21)C(=O)[C@@H]1CCCN1C ZINC001268784653 1097633205 /nfs/dbraw/zinc/63/32/05/1097633205.db2.gz ZVHFNQDZKLMUGQ-OALUTQOASA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(Cl)s1)C(=O)[C@H]1CCCCN1C ZINC001268802629 1097651542 /nfs/dbraw/zinc/65/15/42/1097651542.db2.gz SJOQQVKTMDHDDW-CQSZACIVSA-N 1 3 343.924 2.824 10 0 EFAEHO CN(CCC[NH2+][C@H]1CCCc2ccc(F)cc21)C(=O)Cc1c[nH]cn1 ZINC001268861621 1097690712 /nfs/dbraw/zinc/69/07/12/1097690712.db2.gz YYCGFHNFJXJMJC-SFHVURJKSA-N 1 3 344.434 2.607 10 0 EFAEHO Cc1ccc(C[NH2+]CCCN(C)C(=O)CN(C)C(C)C)c(Cl)c1 ZINC001268959325 1097748922 /nfs/dbraw/zinc/74/89/22/1097748922.db2.gz YIAVLXIXYLXPBY-UHFFFAOYSA-N 1 3 339.911 2.927 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[NH2+]CCc1cccs1 ZINC001268961768 1097753008 /nfs/dbraw/zinc/75/30/08/1097753008.db2.gz HCTVTCHVIMUNFQ-KRWDZBQOSA-N 1 3 337.533 2.603 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001269114290 1097866806 /nfs/dbraw/zinc/86/68/06/1097866806.db2.gz AVUYLEIVGRWRBU-VQIMIIECSA-N 1 3 339.499 2.650 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@@H]1CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001269192007 1097937556 /nfs/dbraw/zinc/93/75/56/1097937556.db2.gz IGEYMMYXBCYTCI-GOSISDBHSA-N 1 3 342.487 2.590 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N(C)[C@H]1CC[N@H+](CCCCCF)C1 ZINC001269240424 1097976610 /nfs/dbraw/zinc/97/66/10/1097976610.db2.gz LDEUUEDIPOFDGC-IRXDYDNUSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N(C)[C@H]1CC[N@@H+](CCCCCF)C1 ZINC001269240424 1097976616 /nfs/dbraw/zinc/97/66/16/1097976616.db2.gz LDEUUEDIPOFDGC-IRXDYDNUSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+]CCC2=CCCCC2)CC1 ZINC001269411469 1098118817 /nfs/dbraw/zinc/11/88/17/1098118817.db2.gz IMWRICVGKJBBCQ-SFHVURJKSA-N 1 3 333.520 2.988 10 0 EFAEHO CC[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC=C(C)C ZINC001269471108 1098164318 /nfs/dbraw/zinc/16/43/18/1098164318.db2.gz FYFNSVATYIHVAS-CRAIPNDOSA-N 1 3 327.488 2.650 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@](C)(C[NH2+]CC=C(Cl)Cl)C2CC2)C1 ZINC001269633795 1098311224 /nfs/dbraw/zinc/31/12/24/1098311224.db2.gz GAHSGKSEDHVWEJ-BLLLJJGKSA-N 1 3 348.318 2.522 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@@](C)(C[NH2+]CC=C(Cl)Cl)C2CC2)C1 ZINC001269633800 1098311718 /nfs/dbraw/zinc/31/17/18/1098311718.db2.gz GAHSGKSEDHVWEJ-WBMJQRKESA-N 1 3 348.318 2.522 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+]C[C@H]2CCC(F)(F)C2)CCCC1 ZINC001482236082 1098333842 /nfs/dbraw/zinc/33/38/42/1098333842.db2.gz CREOFTHAJIORDQ-HNNXBMFYSA-N 1 3 345.478 2.782 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269742168 1098417060 /nfs/dbraw/zinc/41/70/60/1098417060.db2.gz QUPXOBOJWIVWAW-VSQWLSRBSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269742168 1098417064 /nfs/dbraw/zinc/41/70/64/1098417064.db2.gz QUPXOBOJWIVWAW-VSQWLSRBSA-N 1 3 335.536 2.997 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(CC[NH2+]Cc2ccccc2F)CC1 ZINC001269838750 1098471624 /nfs/dbraw/zinc/47/16/24/1098471624.db2.gz PNLZEGPZDSVSLZ-IBGZPJMESA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC(CC[NH2+]CCC(C)(C)C)CC2)C1 ZINC001269907719 1098514244 /nfs/dbraw/zinc/51/42/44/1098514244.db2.gz IAFPZFHTCIECFZ-KRWDZBQOSA-N 1 3 337.552 2.983 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC[NH2+]CC2CC(F)(F)C2)CC1)N(C)C ZINC001269909045 1098515232 /nfs/dbraw/zinc/51/52/32/1098515232.db2.gz YNXDEXLOGKBKGZ-INIZCTEOSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[NH2+]Cc2cccc(F)c2)CC1)N(C)C ZINC001269935869 1098531942 /nfs/dbraw/zinc/53/19/42/1098531942.db2.gz ZJKOFECAHAQBKF-LJQANCHMSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(CC[NH2+]CC2CC(F)(F)C2)CC1 ZINC001269951352 1098542756 /nfs/dbraw/zinc/54/27/56/1098542756.db2.gz ILTVBJPADXURSX-UHFFFAOYSA-N 1 3 345.478 2.590 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@H]1CCCN1C(=O)[C@H]1CCCN1C ZINC001270022118 1098603343 /nfs/dbraw/zinc/60/33/43/1098603343.db2.gz KXEFNJIKVUIKOZ-WOJBJXKFSA-N 1 3 343.515 2.602 10 0 EFAEHO O=C(CN1CCCC1)N1CCC(CC[NH2+]Cc2cccc(F)c2)CC1 ZINC001267919406 1098653374 /nfs/dbraw/zinc/65/33/74/1098653374.db2.gz YAWNBIUXAFDHSY-UHFFFAOYSA-N 1 3 347.478 2.640 10 0 EFAEHO Cc1cc(C)c(C[NH2+]CCN(C)C(=O)CN(C)C2CCC2)c(C)c1 ZINC001481240457 1098773006 /nfs/dbraw/zinc/77/30/06/1098773006.db2.gz KIJVNCXQERUEMJ-UHFFFAOYSA-N 1 3 331.504 2.644 10 0 EFAEHO CN1CCC[C@@H]1CC[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 ZINC000709486985 1099005889 /nfs/dbraw/zinc/00/58/89/1099005889.db2.gz PEUIPQGZZFVRDT-NXOAAHMSSA-N 1 3 337.508 2.848 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC2(C1)CCN(C(=O)[C@H]1CCCN1C)CC2 ZINC001267974319 1099036033 /nfs/dbraw/zinc/03/60/33/1099036033.db2.gz UINIRDMQONFDTP-PYTPGESOSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC2(C1)CCN(C(=O)[C@H]1CCCN1C)CC2 ZINC001267974319 1099036046 /nfs/dbraw/zinc/03/60/46/1099036046.db2.gz UINIRDMQONFDTP-PYTPGESOSA-N 1 3 333.520 2.751 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C[NH2+]CCCF)C1CCCC1 ZINC001270442369 1099092202 /nfs/dbraw/zinc/09/22/02/1099092202.db2.gz LUFPLZVHNRAGBG-QZTJIDSGSA-N 1 3 341.515 2.874 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H](C[NH2+]CCF)C2CCCC2)c1 ZINC001270458512 1099112517 /nfs/dbraw/zinc/11/25/17/1099112517.db2.gz QFJOADXUFSEZLR-GOSISDBHSA-N 1 3 335.467 2.596 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[NH2+]Cc1ccc(C(C)(C)C)cc1 ZINC001481306421 1099196656 /nfs/dbraw/zinc/19/66/56/1099196656.db2.gz QNBLXNZHWHPTQP-UHFFFAOYSA-N 1 3 333.520 2.874 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@]1(C)CC[N@H+](CCCCCF)C1 ZINC001270582541 1099230198 /nfs/dbraw/zinc/23/01/98/1099230198.db2.gz IHMCVJSQNSQHFY-AEFFLSMTSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@]1(C)CC[N@@H+](CCCCCF)C1 ZINC001270582541 1099230200 /nfs/dbraw/zinc/23/02/00/1099230200.db2.gz IHMCVJSQNSQHFY-AEFFLSMTSA-N 1 3 327.488 2.580 10 0 EFAEHO CN(CC[NH2+]Cc1cc2ccccc2s1)C(=O)CN1CCCC1 ZINC001481315218 1099245852 /nfs/dbraw/zinc/24/58/52/1099245852.db2.gz STOUMLXOOXSOAO-UHFFFAOYSA-N 1 3 331.485 2.545 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)CCC[NH+]2CCCCC2)c(C)n1 ZINC001481317891 1099260561 /nfs/dbraw/zinc/26/05/61/1099260561.db2.gz UEGDJNLQMPZJAL-UHFFFAOYSA-N 1 3 346.519 2.513 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]Cc1ccc(Cl)cc1 ZINC001481320220 1099278774 /nfs/dbraw/zinc/27/87/74/1099278774.db2.gz WWKNJVBIJZALGE-QGZVFWFLSA-N 1 3 337.895 2.762 10 0 EFAEHO C[C@@H](C(=O)N[C@]1(C)CC[N@H+](CCCCCF)C1)N1CCCCCC1 ZINC001270633277 1099332064 /nfs/dbraw/zinc/33/20/64/1099332064.db2.gz RRYFPKLBVHDLPQ-PKOBYXMFSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@@H](C(=O)N[C@]1(C)CC[N@@H+](CCCCCF)C1)N1CCCCCC1 ZINC001270633277 1099332074 /nfs/dbraw/zinc/33/20/74/1099332074.db2.gz RRYFPKLBVHDLPQ-PKOBYXMFSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@H](C[NH2+]C/C=C\c1ccc(Cl)cc1)N(C)C(=O)[C@H]1CCCN1C ZINC001482318948 1099479293 /nfs/dbraw/zinc/47/92/93/1099479293.db2.gz HUBHSZYAYXYZIP-CLUARGJDSA-N 1 3 349.906 2.884 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]CC3=CCCCC3)CCCC2)CCC1 ZINC001270757522 1099534347 /nfs/dbraw/zinc/53/43/47/1099534347.db2.gz OSXDCPUYMPAAQJ-UHFFFAOYSA-N 1 3 333.520 2.990 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]CCC3CCCC3)C2)C1 ZINC001270795839 1099567286 /nfs/dbraw/zinc/56/72/86/1099567286.db2.gz BATNLYZZJVGDOY-PXNSSMCTSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H](C[NH2+]CCc1cccs1)N(C)C(=O)CN(C)CC(C)(C)C ZINC001482329856 1099618923 /nfs/dbraw/zinc/61/89/23/1099618923.db2.gz FKHNWWZZUHUEFV-HNNXBMFYSA-N 1 3 339.549 2.705 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+]CCCF)CCCC1)N1CCCCC1 ZINC001270826675 1099667308 /nfs/dbraw/zinc/66/73/08/1099667308.db2.gz SXNCWWSXYHTXSY-QGZVFWFLSA-N 1 3 341.515 2.875 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@]1(NC(=O)Cc2nc[nH]c2C)CCCC[C@H]1C ZINC001267874568 1099794258 /nfs/dbraw/zinc/79/42/58/1099794258.db2.gz WNOUOQZHOXXFAC-BEFAXECRSA-N 1 3 332.492 2.882 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@@H](C(=O)NCCCN2CCc3ccccc3C2)C1 ZINC001625490107 1099817664 /nfs/dbraw/zinc/81/76/64/1099817664.db2.gz YJSHWAJXKZMRGY-QUCCMNQESA-N 1 3 343.515 2.671 10 0 EFAEHO C[NH+](C)CCC(=O)NCC[C@H]1CCN(Cc2ccccc2Cl)C1 ZINC001481446173 1099867292 /nfs/dbraw/zinc/86/72/92/1099867292.db2.gz DISWOXKJEFQAGL-HNNXBMFYSA-N 1 3 337.895 2.620 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1cccc(C)c1 ZINC001482369852 1099872843 /nfs/dbraw/zinc/87/28/43/1099872843.db2.gz PTKYAAVCMZMTMB-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)C[C@H](C[NH2+]C/C=C/Cl)NC(=O)[C@@H]1CCCN1C(C)C ZINC001482384313 1099967788 /nfs/dbraw/zinc/96/77/88/1099967788.db2.gz NWXUAXSBSKRADF-DODUIYEKSA-N 1 3 329.916 2.732 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(CC[NH2+]Cc2ccc(F)cc2)CC1 ZINC001267906276 1100015114 /nfs/dbraw/zinc/01/51/14/1100015114.db2.gz BKZLTLMYVHIEHJ-IBGZPJMESA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](CNCCF)C1CCCCC1)[NH+]1CCCC1 ZINC001482413182 1100080752 /nfs/dbraw/zinc/08/07/52/1100080752.db2.gz MEJWVJJDAFRUOW-QZTJIDSGSA-N 1 3 341.515 2.731 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@H]1CN(CC2=CCCCC2)CCC1(F)F ZINC001271100894 1100481726 /nfs/dbraw/zinc/48/17/26/1100481726.db2.gz OGUQGXBIYPWCBA-INIZCTEOSA-N 1 3 343.462 2.512 10 0 EFAEHO C/C(=C\C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccccc1C ZINC001632635196 1100489891 /nfs/dbraw/zinc/48/98/91/1100489891.db2.gz JLIIIJYUDPHXAT-UMADGWCESA-N 1 3 331.504 2.787 10 0 EFAEHO C/C(=C\C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccccc1C ZINC001632635196 1100489895 /nfs/dbraw/zinc/48/98/95/1100489895.db2.gz JLIIIJYUDPHXAT-UMADGWCESA-N 1 3 331.504 2.787 10 0 EFAEHO C[C@@H](C[NH2+]CCCc1ccccc1Cl)N(C)C(=O)Cc1c[nH]cn1 ZINC001271121790 1100518970 /nfs/dbraw/zinc/51/89/70/1100518970.db2.gz SHYYRVLUHOWNFO-AWEZNQCLSA-N 1 3 348.878 2.675 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1CC[NH2+]Cc1ncccc1C ZINC001482462803 1100629329 /nfs/dbraw/zinc/62/93/29/1100629329.db2.gz PNLYCUQXAZJRFI-GOSISDBHSA-N 1 3 346.519 2.593 10 0 EFAEHO CC(C)CC[NH2+][C@@H](C)[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001482479006 1101183293 /nfs/dbraw/zinc/18/32/93/1101183293.db2.gz IWEVKHURPUTKHO-RBUKOAKNSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]CCC(C)(C)C)NC(=O)CN1CC[C@H](C)C1 ZINC001271292489 1101344588 /nfs/dbraw/zinc/34/45/88/1101344588.db2.gz BSVQKFSGKDDTQD-IRXDYDNUSA-N 1 3 325.541 2.885 10 0 EFAEHO CC[C@H]1CN(C(=O)C2(N(C)C)CCC2)CC[C@@H]1[NH2+]CCCCCF ZINC001670580830 1101357855 /nfs/dbraw/zinc/35/78/55/1101357855.db2.gz BLSKTCRDZCEBHR-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]1CNC(=O)c1sccc1CN(C)C ZINC001670646119 1101432732 /nfs/dbraw/zinc/43/27/32/1101432732.db2.gz OGGGPISIDFLGDJ-OGZRUICASA-N 1 3 335.517 2.970 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]1CNC(=O)c1sccc1CN(C)C ZINC001670646119 1101432736 /nfs/dbraw/zinc/43/27/36/1101432736.db2.gz OGGGPISIDFLGDJ-OGZRUICASA-N 1 3 335.517 2.970 10 0 EFAEHO C[C@@H]([NH2+]CCCF)[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001482483752 1101491009 /nfs/dbraw/zinc/49/10/09/1101491009.db2.gz WNHYPZPPOBUBTP-CVEARBPZSA-N 1 3 329.504 2.541 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2C[C@@H](NC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001266712753 1101988751 /nfs/dbraw/zinc/98/87/51/1101988751.db2.gz CCNPMDQOVTVBBR-RLLQIKCJSA-N 1 3 343.515 2.506 10 0 EFAEHO COc1ccc(C[NH+]2C[C@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1N ZINC000705890977 1102029429 /nfs/dbraw/zinc/02/94/29/1102029429.db2.gz USMJXTLWONCPOT-RTBURBONSA-N 1 3 337.467 2.841 10 0 EFAEHO CC/C=C/CC[NH2+][C@H]1C[C@@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001266733183 1102048273 /nfs/dbraw/zinc/04/82/73/1102048273.db2.gz OPVAXHGXXUUROL-QCUQMOABSA-N 1 3 329.488 2.955 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001480874623 1102106804 /nfs/dbraw/zinc/10/68/04/1102106804.db2.gz IQYLQTSAHDIWOX-LJQANCHMSA-N 1 3 331.504 2.671 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001480874623 1102106809 /nfs/dbraw/zinc/10/68/09/1102106809.db2.gz IQYLQTSAHDIWOX-LJQANCHMSA-N 1 3 331.504 2.671 10 0 EFAEHO CCCC[NH2+][C@H](C)[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001271562738 1102118921 /nfs/dbraw/zinc/11/89/21/1102118921.db2.gz UQOBLLDFMUELHY-VQIMIIECSA-N 1 3 331.504 2.989 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCCC[C@@H]2CC[NH2+]CCF)C1 ZINC001271575198 1102138638 /nfs/dbraw/zinc/13/86/38/1102138638.db2.gz BKTCHUITOBHGPI-QAPCUYQASA-N 1 3 345.478 2.529 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@@H]1CCCCN1C(=O)Cc1c[nH]cn1 ZINC001271585821 1102149211 /nfs/dbraw/zinc/14/92/11/1102149211.db2.gz WBSSRPZDCYWIHJ-IBGZPJMESA-N 1 3 340.471 2.822 10 0 EFAEHO C[C@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@H]1C[NH2+]CCCC1CCC1 ZINC001271628383 1102184620 /nfs/dbraw/zinc/18/46/20/1102184620.db2.gz GJUWKVIEKSZQSG-FUHWJXTLSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@@H]1C[NH2+]CCCC1CCC1 ZINC001271628384 1102185361 /nfs/dbraw/zinc/18/53/61/1102185361.db2.gz GJUWKVIEKSZQSG-WMZOPIPTSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CCC[N@@H+]1CCCCCF)N1CCCCCC1 ZINC001266485448 1102242939 /nfs/dbraw/zinc/24/29/39/1102242939.db2.gz CCWINNIBDPSTKW-QZTJIDSGSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CCC[N@H+]1CCCCCF)N1CCCCCC1 ZINC001266485448 1102242947 /nfs/dbraw/zinc/24/29/47/1102242947.db2.gz CCWINNIBDPSTKW-QZTJIDSGSA-N 1 3 341.515 2.971 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]CCCC(C)(C)C)C1 ZINC001271700872 1102259710 /nfs/dbraw/zinc/25/97/10/1102259710.db2.gz UPSHUYJXRTZRFO-SJORKVTESA-N 1 3 325.541 2.839 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]CCCc2ccccc2)C1 ZINC001271721174 1102310166 /nfs/dbraw/zinc/31/01/66/1102310166.db2.gz KNVHZKCSMDVFJR-QUCCMNQESA-N 1 3 345.531 2.644 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C)[C@@H]1C[NH2+]CCC(C)(C)C ZINC001482497574 1102361078 /nfs/dbraw/zinc/36/10/78/1102361078.db2.gz HLNPXKZYGRDXRW-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C)[C@H]1C[NH2+]CCC(C)(C)C ZINC001482497571 1102361454 /nfs/dbraw/zinc/36/14/54/1102361454.db2.gz HLNPXKZYGRDXRW-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)C23CCC[NH+](CCC2)C3)cc1 ZINC001480879805 1102373291 /nfs/dbraw/zinc/37/32/91/1102373291.db2.gz QQCAZTYZQPLRIQ-UHFFFAOYSA-N 1 3 343.515 2.673 10 0 EFAEHO CCOC(=O)/C=C\C[NH2+]C1[C@H](C)CN(Cc2ccccc2)C[C@@H]1C ZINC001658142148 1102438397 /nfs/dbraw/zinc/43/83/97/1102438397.db2.gz DYGOYFQQWFNVLF-GCGZCUHMSA-N 1 3 330.472 2.852 10 0 EFAEHO CC[C@H](F)C[N@H+](C)CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001482507592 1102445984 /nfs/dbraw/zinc/44/59/84/1102445984.db2.gz XTLGBEFVFCMFNO-WMZOPIPTSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001482507592 1102445992 /nfs/dbraw/zinc/44/59/92/1102445992.db2.gz XTLGBEFVFCMFNO-WMZOPIPTSA-N 1 3 341.515 2.637 10 0 EFAEHO C[NH+]1CCC(C(=O)N2CCCC[C@@H]2CNCC=C(Cl)Cl)CC1 ZINC001266876060 1102566082 /nfs/dbraw/zinc/56/60/82/1102566082.db2.gz FVXDANFBSDDZSK-CQSZACIVSA-N 1 3 348.318 2.618 10 0 EFAEHO CN(CCCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21)Cc1ccsc1 ZINC001660190146 1102630883 /nfs/dbraw/zinc/63/08/83/1102630883.db2.gz IXOKHQKSLWJGFS-IRXDYDNUSA-N 1 3 335.517 2.703 10 0 EFAEHO CN(CCCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21)Cc1ccsc1 ZINC001660190146 1102630885 /nfs/dbraw/zinc/63/08/85/1102630885.db2.gz IXOKHQKSLWJGFS-IRXDYDNUSA-N 1 3 335.517 2.703 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C)cc1C ZINC001660293347 1102675841 /nfs/dbraw/zinc/67/58/41/1102675841.db2.gz FRXOXEUTVSUNSS-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C)cc1C ZINC001660293347 1102675851 /nfs/dbraw/zinc/67/58/51/1102675851.db2.gz FRXOXEUTVSUNSS-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC2CCC([NH2+]CCCF)CC2)C1 ZINC001266913622 1102680005 /nfs/dbraw/zinc/68/00/05/1102680005.db2.gz MRJHHNDIIPYRCC-JMLCCBQJSA-N 1 3 345.478 2.576 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](CNCC=C(Cl)Cl)C2CC2)CC[N@@H+]1C ZINC001670475255 1102702273 /nfs/dbraw/zinc/70/22/73/1102702273.db2.gz NLFYUIQOSQYSET-MELADBBJSA-N 1 3 348.318 2.520 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](CNCC=C(Cl)Cl)C2CC2)CC[N@H+]1C ZINC001670475255 1102702285 /nfs/dbraw/zinc/70/22/85/1102702285.db2.gz NLFYUIQOSQYSET-MELADBBJSA-N 1 3 348.318 2.520 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](C)CC[C@@H]1CCC[C@@H](C)C1 ZINC001660379699 1102720998 /nfs/dbraw/zinc/72/09/98/1102720998.db2.gz JKYZQKVJGDJLEB-WBVHZDCISA-N 1 3 334.508 2.915 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](C)CC[C@@H]1CCC[C@@H](C)C1 ZINC001660379699 1102721003 /nfs/dbraw/zinc/72/10/03/1102721003.db2.gz JKYZQKVJGDJLEB-WBVHZDCISA-N 1 3 334.508 2.915 10 0 EFAEHO CC(C)=CC[NH2+]CCN(Cc1ccccc1)C(=O)CN1CC[C@H](C)C1 ZINC001271819794 1102797858 /nfs/dbraw/zinc/79/78/58/1102797858.db2.gz UREVWGMJMAKJAJ-IBGZPJMESA-N 1 3 343.515 2.913 10 0 EFAEHO CC[NH2+]CCN(Cc1ccccc1)C(=O)[C@H]1CCCCN1C(C)C ZINC001271819924 1102798729 /nfs/dbraw/zinc/79/87/29/1102798729.db2.gz WVWITXSSTIPUFO-LJQANCHMSA-N 1 3 331.504 2.888 10 0 EFAEHO CC(C)[C@H](CNC(=O)C(C)(C)N1CCCCC1)[NH2+]CC[C@@H](C)F ZINC001482530942 1102809668 /nfs/dbraw/zinc/80/96/68/1102809668.db2.gz IGUMRVNIRKPNSL-CVEARBPZSA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C(C)(C)N1CCCCC1)[NH2+]CC[C@@H](C)F ZINC001482530946 1102809812 /nfs/dbraw/zinc/80/98/12/1102809812.db2.gz IGUMRVNIRKPNSL-HZPDHXFCSA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001482531444 1102822920 /nfs/dbraw/zinc/82/29/20/1102822920.db2.gz ACYLOCGRAJHWKG-LSDHHAIUSA-N 1 3 345.478 2.637 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CC1CC(F)(F)C1)C(C)C ZINC001482532061 1102843978 /nfs/dbraw/zinc/84/39/78/1102843978.db2.gz IYXDYGGWPZXWLG-HZPDHXFCSA-N 1 3 345.478 2.637 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1ccc(C)cc1C ZINC001660589265 1102869476 /nfs/dbraw/zinc/86/94/76/1102869476.db2.gz NORRIVUGYQCQKZ-SFHVURJKSA-N 1 3 345.531 2.973 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1ccc(C)cc1C ZINC001660589265 1102869499 /nfs/dbraw/zinc/86/94/99/1102869499.db2.gz NORRIVUGYQCQKZ-SFHVURJKSA-N 1 3 345.531 2.973 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCCC[N@H+](C/C=C\c1ccccc1)C1CC1 ZINC001660659915 1102914810 /nfs/dbraw/zinc/91/48/10/1102914810.db2.gz GPSUSIYLYUMMST-KYRNDMNFSA-N 1 3 341.499 2.765 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCCC[N@@H+](C/C=C\c1ccccc1)C1CC1 ZINC001660659915 1102914821 /nfs/dbraw/zinc/91/48/21/1102914821.db2.gz GPSUSIYLYUMMST-KYRNDMNFSA-N 1 3 341.499 2.765 10 0 EFAEHO c1ncn(-c2ccccc2CNCCC[N@@H+]2CCc3ccccc3C2)n1 ZINC001660902499 1103020021 /nfs/dbraw/zinc/02/00/21/1103020021.db2.gz OEKFOIWKGOZNIF-UHFFFAOYSA-N 1 3 347.466 2.805 10 0 EFAEHO c1ncn(-c2ccccc2CNCCC[N@H+]2CCc3ccccc3C2)n1 ZINC001660902499 1103020039 /nfs/dbraw/zinc/02/00/39/1103020039.db2.gz OEKFOIWKGOZNIF-UHFFFAOYSA-N 1 3 347.466 2.805 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(C[C@@H]2NC(=O)CN2CC[C@H](C)C2)CC1 ZINC001661073142 1103114508 /nfs/dbraw/zinc/11/45/08/1103114508.db2.gz MAJNVMCSGDPCJF-JDTHPWDHSA-N 1 3 333.520 2.655 10 0 EFAEHO C[C@H](N[C@H]1C[C@H](NC(=O)CCCC[NH+](C)C)C1)c1ccccc1F ZINC001661499638 1103283402 /nfs/dbraw/zinc/28/34/02/1103283402.db2.gz YOMWYORVGQAUIC-JYJNAYRXSA-N 1 3 335.467 2.855 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc(C)cc1C ZINC001483296521 1103292414 /nfs/dbraw/zinc/29/24/14/1103292414.db2.gz JJHVKWAFMKUUHK-PKOBYXMFSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H]1C[C@@H]([NH2+]CCCCCF)C1 ZINC001661661287 1103351642 /nfs/dbraw/zinc/35/16/42/1103351642.db2.gz KPJGEIUZQMPWPH-IXDOHACOSA-N 1 3 327.488 2.626 10 0 EFAEHO CC(C)(C(=O)N1CCC[C@@H](C[NH2+]C/C=C\Cl)C1)N1CCCCC1 ZINC001661783146 1103423191 /nfs/dbraw/zinc/42/31/91/1103423191.db2.gz OMZGPCYYVYPYFE-GQSKFBFOSA-N 1 3 341.927 2.832 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(OC)cc1 ZINC001483345435 1103428600 /nfs/dbraw/zinc/42/86/00/1103428600.db2.gz MFBOTGYUNNHWNG-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(OC)cc1 ZINC001483345435 1103428607 /nfs/dbraw/zinc/42/86/07/1103428607.db2.gz MFBOTGYUNNHWNG-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CN(CC(=O)N1CCCC[C@@H]1C[NH2+]CCc1ccccc1)C1CCC1 ZINC001661925098 1103506881 /nfs/dbraw/zinc/50/68/81/1103506881.db2.gz BRMRHXKWHGPWTR-HXUWFJFHSA-N 1 3 343.515 2.684 10 0 EFAEHO CCCC[NH2+]C[C@@H]1CCCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001661945727 1103515623 /nfs/dbraw/zinc/51/56/23/1103515623.db2.gz ATVAAKWYIKJSFK-QFBILLFUSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@H]1C[NH2+]CCc1ccccc1F)N(C)C ZINC001661963217 1103522470 /nfs/dbraw/zinc/52/24/70/1103522470.db2.gz ADILGVXAVQXSOD-PKOBYXMFSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@@H](C[N@H+](C)CC1CCC(C)(C)CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001483383916 1103550078 /nfs/dbraw/zinc/55/00/78/1103550078.db2.gz LUXCIOARKWTXRR-IRXDYDNUSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC1CCC(C)(C)CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001483383916 1103550090 /nfs/dbraw/zinc/55/00/90/1103550090.db2.gz LUXCIOARKWTXRR-IRXDYDNUSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C2CCC2)cc1)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001483418320 1103664048 /nfs/dbraw/zinc/66/40/48/1103664048.db2.gz XARWHYNYHLIQNQ-JXFKEZNVSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C2CCC2)cc1)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001483418320 1103664056 /nfs/dbraw/zinc/66/40/56/1103664056.db2.gz XARWHYNYHLIQNQ-JXFKEZNVSA-N 1 3 343.515 2.842 10 0 EFAEHO CC/C=C\CC[NH2+][C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001662334042 1103666914 /nfs/dbraw/zinc/66/69/14/1103666914.db2.gz BQTZZMIMYNNCBZ-JKNDDFDJSA-N 1 3 327.488 2.650 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H](C[NH2+]C/C=C\c3ccccc3)C2)CCC1 ZINC001662639679 1103740519 /nfs/dbraw/zinc/74/05/19/1103740519.db2.gz CLVSHNVSVHFQRY-SMTIMMHKSA-N 1 3 341.499 2.622 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H]2CCN(C(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001662680765 1103755951 /nfs/dbraw/zinc/75/59/51/1103755951.db2.gz SVSZZSPRZCXZPJ-WOJBJXKFSA-N 1 3 345.531 2.562 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]CCCc2cccc(F)c2)C1 ZINC001662726761 1103772070 /nfs/dbraw/zinc/77/20/70/1103772070.db2.gz CEFIPNMXXNUTAS-GOSISDBHSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+][C@H](C)c1cc(F)ccc1F)N(C)C ZINC001483492428 1103823121 /nfs/dbraw/zinc/82/31/21/1103823121.db2.gz PRJHUGDBMDAUBQ-DYVFJYSZSA-N 1 3 341.446 2.804 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC001483492831 1103825543 /nfs/dbraw/zinc/82/55/43/1103825543.db2.gz KXFVFNURHUSJPT-HNAYVOBHSA-N 1 3 347.478 2.593 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]Cc1cccc2cccnc21)N(C)C ZINC001483493281 1103826936 /nfs/dbraw/zinc/82/69/36/1103826936.db2.gz WXYKXRLKJIZCCV-SFHVURJKSA-N 1 3 342.487 2.513 10 0 EFAEHO CCC[N@@H+](CC=C(C)C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001663684501 1104189852 /nfs/dbraw/zinc/18/98/52/1104189852.db2.gz YSORZWMVOOJZHS-IBGZPJMESA-N 1 3 341.515 2.993 10 0 EFAEHO CCC[N@H+](CC=C(C)C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001663684501 1104189857 /nfs/dbraw/zinc/18/98/57/1104189857.db2.gz YSORZWMVOOJZHS-IBGZPJMESA-N 1 3 341.515 2.993 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)[C@H]3CCC=CCCC3)CC2)CC1 ZINC000906467324 1104230498 /nfs/dbraw/zinc/23/04/98/1104230498.db2.gz YDZURTUZNSZNCO-KRWDZBQOSA-N 1 3 333.520 2.798 10 0 EFAEHO CCc1cccc(CN(C)[C@@H](C)CNC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)c1 ZINC001409573106 1104307338 /nfs/dbraw/zinc/30/73/38/1104307338.db2.gz LNULQKHXBIPXSY-FFZOFVMBSA-N 1 3 345.531 2.916 10 0 EFAEHO CCc1cccc(CN(C)[C@@H](C)CNC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)c1 ZINC001409573106 1104307347 /nfs/dbraw/zinc/30/73/47/1104307347.db2.gz LNULQKHXBIPXSY-FFZOFVMBSA-N 1 3 345.531 2.916 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](CC1CC(C)(C)C1)C(C)C ZINC001664552811 1104442006 /nfs/dbraw/zinc/44/20/06/1104442006.db2.gz FEGIQYCFJRMPSS-UHFFFAOYSA-N 1 3 334.508 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](CC1CC(C)(C)C1)C(C)C ZINC001664552811 1104442010 /nfs/dbraw/zinc/44/20/10/1104442010.db2.gz FEGIQYCFJRMPSS-UHFFFAOYSA-N 1 3 334.508 2.914 10 0 EFAEHO Cc1ccccc1CCC[N@@H+](C)[C@@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001409614616 1104511648 /nfs/dbraw/zinc/51/16/48/1104511648.db2.gz GREJAAKFARVLGC-MJGOQNOKSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccccc1CCC[N@H+](C)[C@@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001409614616 1104511656 /nfs/dbraw/zinc/51/16/56/1104511656.db2.gz GREJAAKFARVLGC-MJGOQNOKSA-N 1 3 345.531 2.706 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H](C)[N@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001409623530 1104533318 /nfs/dbraw/zinc/53/33/18/1104533318.db2.gz BDHINBDNAJMRFN-ROUUACIJSA-N 1 3 345.531 2.570 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H](C)[N@@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001409623530 1104533331 /nfs/dbraw/zinc/53/33/31/1104533331.db2.gz BDHINBDNAJMRFN-ROUUACIJSA-N 1 3 345.531 2.570 10 0 EFAEHO COc1cccc([C@@H](C)N(C)[C@@H](C)CNC(=O)C2(C[NH+](C)C)CC2)c1 ZINC001409630690 1104543628 /nfs/dbraw/zinc/54/36/28/1104543628.db2.gz PYMDJQGJMPMANF-JKSUJKDBSA-N 1 3 347.503 2.535 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001483237007 1104548613 /nfs/dbraw/zinc/54/86/13/1104548613.db2.gz XHBIXBCQDQIBGY-RDJZCZTQSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001483237007 1104548622 /nfs/dbraw/zinc/54/86/22/1104548622.db2.gz XHBIXBCQDQIBGY-RDJZCZTQSA-N 1 3 335.467 2.603 10 0 EFAEHO CC/C=C\CC[N@H+](C)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001664891045 1104594198 /nfs/dbraw/zinc/59/41/98/1104594198.db2.gz OQPITAJRKBWSAH-XFHJGTJQSA-N 1 3 335.536 2.855 10 0 EFAEHO CC/C=C\CC[N@@H+](C)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001664891045 1104594204 /nfs/dbraw/zinc/59/42/04/1104594204.db2.gz OQPITAJRKBWSAH-XFHJGTJQSA-N 1 3 335.536 2.855 10 0 EFAEHO CC(C)CC[N@H+](C)CCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001482628135 1104687966 /nfs/dbraw/zinc/68/79/66/1104687966.db2.gz FUTAZYDNEPQTKA-GOSISDBHSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)CC[N@@H+](C)CCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001482628135 1104687970 /nfs/dbraw/zinc/68/79/70/1104687970.db2.gz FUTAZYDNEPQTKA-GOSISDBHSA-N 1 3 329.504 2.635 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2ccc(F)cc21)C(=O)CCCC[NH+](C)C ZINC001482643023 1104723525 /nfs/dbraw/zinc/72/35/25/1104723525.db2.gz BMGJFKOXSCSTCF-LJQANCHMSA-N 1 3 349.494 2.935 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001482652466 1104744675 /nfs/dbraw/zinc/74/46/75/1104744675.db2.gz XYELRLBBIATINB-UXHICEINSA-N 1 3 343.515 2.939 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001482652466 1104744683 /nfs/dbraw/zinc/74/46/83/1104744683.db2.gz XYELRLBBIATINB-UXHICEINSA-N 1 3 343.515 2.939 10 0 EFAEHO C[C@@H](C(=O)N[C@@](C)(C[NH2+]CCC1CC1)C1CC1)N1CCCCCC1 ZINC001666027157 1104833394 /nfs/dbraw/zinc/83/33/94/1104833394.db2.gz WOBXVJPVMHPMGS-JXFKEZNVSA-N 1 3 335.536 2.926 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N(C)CCN(C)CC2=CCCCC2)C1 ZINC001272093537 1104858995 /nfs/dbraw/zinc/85/89/95/1104858995.db2.gz SLKAMGCNLJJNBL-IBGZPJMESA-N 1 3 335.536 2.999 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N(C)CCN(C)CC2=CCCCC2)C1 ZINC001272093537 1104859004 /nfs/dbraw/zinc/85/90/04/1104859004.db2.gz SLKAMGCNLJJNBL-IBGZPJMESA-N 1 3 335.536 2.999 10 0 EFAEHO C[C@H](F)CC[NH2+]CCC1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001666245380 1104910666 /nfs/dbraw/zinc/91/06/66/1104910666.db2.gz XTFJDGHTLFHPSG-INIZCTEOSA-N 1 3 343.531 2.931 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]1C[NH2+]Cc1ccc(F)cc1 ZINC001482696584 1104952885 /nfs/dbraw/zinc/95/28/85/1104952885.db2.gz CUUHFOIRMRFBCX-AEFFLSMTSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]1C[NH2+]CC1CC2(CCC2)C1 ZINC001482697708 1104954007 /nfs/dbraw/zinc/95/40/07/1104954007.db2.gz HEMYRYRDFFADEV-MSOLQXFVSA-N 1 3 335.536 2.781 10 0 EFAEHO C[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C[NH2+]CCC(C)(C)C ZINC001666619584 1104970651 /nfs/dbraw/zinc/97/06/51/1104970651.db2.gz GMZLWLLHCZRTID-KXBFYZLASA-N 1 3 343.531 2.977 10 0 EFAEHO C[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C[NH2+]CCC(C)(C)C ZINC001666619582 1104970835 /nfs/dbraw/zinc/97/08/35/1104970835.db2.gz GMZLWLLHCZRTID-DNVCBOLYSA-N 1 3 343.531 2.977 10 0 EFAEHO CC(C)=CCN1CC2(C1)CCN(C(=O)CCC[NH+]1CCCC1)CC2 ZINC001666838277 1105005796 /nfs/dbraw/zinc/00/57/96/1105005796.db2.gz QEVPIZKRBXTKMG-UHFFFAOYSA-N 1 3 333.520 2.753 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1cccc(Cl)c1F)N(C)C ZINC001482846502 1105088539 /nfs/dbraw/zinc/08/85/39/1105088539.db2.gz KPJZDKIVAQUCLG-IUODEOHRSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccccc1Cl)N(C)C ZINC001482848297 1105091159 /nfs/dbraw/zinc/09/11/59/1105091159.db2.gz YKTDRZPEJGYHDL-CZUORRHYSA-N 1 3 325.884 2.665 10 0 EFAEHO C[C@@H](CCNCc1c(Cl)cccc1Cl)NC(=O)CC[NH+](C)C ZINC001482868883 1105119663 /nfs/dbraw/zinc/11/96/63/1105119663.db2.gz YLENAUIPPXJOLC-LBPRGKRZSA-N 1 3 346.302 2.930 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CC[NH2+]Cc1ccc(C2CC2)cc1 ZINC001482892200 1105150571 /nfs/dbraw/zinc/15/05/71/1105150571.db2.gz UPJBQNSMFWTWBZ-CQSZACIVSA-N 1 3 340.471 2.823 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CC[NH2+]Cc1c(C)cc(C)cc1C ZINC001482892279 1105151425 /nfs/dbraw/zinc/15/14/25/1105151425.db2.gz UYURWLFMXVBVFP-MRXNPFEDSA-N 1 3 342.487 2.870 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1ccccc1 ZINC001668234632 1105264123 /nfs/dbraw/zinc/26/41/23/1105264123.db2.gz NKAKXMAYADKNKQ-PKOBYXMFSA-N 1 3 331.504 2.934 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C(F)F)cc1)C(=O)CN1CCCC1 ZINC001482967830 1105265867 /nfs/dbraw/zinc/26/58/67/1105265867.db2.gz ZWBOPNXYCLJKTK-UHFFFAOYSA-N 1 3 339.430 2.658 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)cc1 ZINC001668288023 1105273863 /nfs/dbraw/zinc/27/38/63/1105273863.db2.gz GXZKIWQLGJTPJT-LBPRGKRZSA-N 1 3 334.851 2.599 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+]C[C@H]1CCc2ccccc2C1 ZINC001668320350 1105281497 /nfs/dbraw/zinc/28/14/97/1105281497.db2.gz PUNZGEGYYQVSSS-MSOLQXFVSA-N 1 3 345.531 2.616 10 0 EFAEHO CCN(CCNCc1cncc(C)c1)C(=O)C(C)(C)[NH+]1CCCCC1 ZINC001668431175 1105297076 /nfs/dbraw/zinc/29/70/76/1105297076.db2.gz UIVGPACYZVAHEG-UHFFFAOYSA-N 1 3 346.519 2.593 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001668464048 1105301223 /nfs/dbraw/zinc/30/12/23/1105301223.db2.gz BWXTZRJVTPUOGL-RTBURBONSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001668464048 1105301231 /nfs/dbraw/zinc/30/12/31/1105301231.db2.gz BWXTZRJVTPUOGL-RTBURBONSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNC/C=C/Cl)C(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001668528454 1105314785 /nfs/dbraw/zinc/31/47/85/1105314785.db2.gz HNWUJPJRHZATKL-VDZSZVPASA-N 1 3 341.927 2.974 10 0 EFAEHO CCN(CCNC/C=C/Cl)C(=O)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001668528454 1105314791 /nfs/dbraw/zinc/31/47/91/1105314791.db2.gz HNWUJPJRHZATKL-VDZSZVPASA-N 1 3 341.927 2.974 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C2CC2)cc1)C(=O)CN1CC[C@@H](C)C1 ZINC001668554696 1105319553 /nfs/dbraw/zinc/31/95/53/1105319553.db2.gz BEIKAUSKHQVNRC-QGZVFWFLSA-N 1 3 343.515 2.844 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)NC/C=C\CNCc1ccc(F)cc1 ZINC001668906518 1105397523 /nfs/dbraw/zinc/39/75/23/1105397523.db2.gz ZFPJHASUJSFRNV-ZRHASKPBSA-N 1 3 347.478 2.708 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NC/C=C\CNCc1ccc(F)cc1 ZINC001668906518 1105397530 /nfs/dbraw/zinc/39/75/30/1105397530.db2.gz ZFPJHASUJSFRNV-ZRHASKPBSA-N 1 3 347.478 2.708 10 0 EFAEHO CC[C@H](C)C[NH2+]C/C=C\CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001669040543 1105422757 /nfs/dbraw/zinc/42/27/57/1105422757.db2.gz XLMNGOSXYZESPP-YMQRJHMESA-N 1 3 327.488 2.507 10 0 EFAEHO O=C(CN1CCCC1)NC/C=C\C[NH2+][C@@H]1CCc2c1cccc2Cl ZINC001669189451 1105453166 /nfs/dbraw/zinc/45/31/66/1105453166.db2.gz NKPOUBFDHKRCHG-QFRLHKFZSA-N 1 3 347.890 2.685 10 0 EFAEHO Cc1ccc(CNC/C=C\CNC(=O)C[NH+]2[C@H](C)CC[C@H]2C)cc1F ZINC001669201068 1105455830 /nfs/dbraw/zinc/45/58/30/1105455830.db2.gz LRWPKAUVDDDABO-OSNZYPHYSA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1ccc(CNC/C=C/CNC(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)cc1F ZINC001669201069 1105456263 /nfs/dbraw/zinc/45/62/63/1105456263.db2.gz LRWPKAUVDDDABO-PSUYNTKASA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1ccc(CNC/C=C/CNC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)cc1F ZINC001669201069 1105456267 /nfs/dbraw/zinc/45/62/67/1105456267.db2.gz LRWPKAUVDDDABO-PSUYNTKASA-N 1 3 347.478 2.769 10 0 EFAEHO C[C@H](C[NH2+]CCc1ccccc1F)NC(=O)C(C)(C)N1CCCCC1 ZINC001669293831 1105469706 /nfs/dbraw/zinc/46/97/06/1105469706.db2.gz RXPFOXLIRVNARV-MRXNPFEDSA-N 1 3 349.494 2.727 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C\CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001483019880 1105563336 /nfs/dbraw/zinc/56/33/36/1105563336.db2.gz QJRZAZMKLJVKGH-ZRHASKPBSA-N 1 3 347.478 2.771 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C\CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001483019880 1105563342 /nfs/dbraw/zinc/56/33/42/1105563342.db2.gz QJRZAZMKLJVKGH-ZRHASKPBSA-N 1 3 347.478 2.771 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H]2CCCC[C@H]2C[NH2+]CCCF)c1 ZINC001669985832 1105564804 /nfs/dbraw/zinc/56/48/04/1105564804.db2.gz NDMFXKGFQAJKOC-RBUKOAKNSA-N 1 3 349.494 2.986 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+]CCCN(C)C(=O)[C@@H]1CCCN1C ZINC001670041956 1105572133 /nfs/dbraw/zinc/57/21/33/1105572133.db2.gz NLVNORGEUCULAJ-KRWDZBQOSA-N 1 3 337.895 2.681 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+]CCCN(C)C(=O)CN1CCCC1 ZINC001670345757 1105622606 /nfs/dbraw/zinc/62/26/06/1105622606.db2.gz YLGSEIUTCSFLGW-UHFFFAOYSA-N 1 3 346.519 2.547 10 0 EFAEHO O=C(CN1CCCC1)N1CCC[C@@H]1C[NH2+]CC/C=C/c1ccccc1 ZINC001671384361 1105632255 /nfs/dbraw/zinc/63/22/55/1105632255.db2.gz MAJPBXWLMBSRKR-FTJUBABDSA-N 1 3 341.499 2.766 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[C@H](C[NH2+]C/C=C/Cl)CC2)C1 ZINC001672376791 1105817600 /nfs/dbraw/zinc/81/76/00/1105817600.db2.gz MHEUJDAFUWVADP-MDIRPLJZSA-N 1 3 341.927 2.593 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)CN(C)C3CCC3)C2)cc1 ZINC001672806213 1105908347 /nfs/dbraw/zinc/90/83/47/1105908347.db2.gz UYONELJACDCBKR-IBGZPJMESA-N 1 3 343.515 2.808 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+]CC2CCC(C)CC2)C1 ZINC001672902544 1105933808 /nfs/dbraw/zinc/93/38/08/1105933808.db2.gz RUKHGGOOPVMALL-CTWPCTMYSA-N 1 3 337.552 2.983 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CC[C@H](C[NH2+]CCCC(C)C)CC1 ZINC001672991319 1105955470 /nfs/dbraw/zinc/95/54/70/1105955470.db2.gz XDZFFXFLPXIILD-QAQDUYKDSA-N 1 3 334.508 2.961 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC1CC(C[NH2+]CCc2ccccc2)C1 ZINC001674612093 1106222135 /nfs/dbraw/zinc/22/21/35/1106222135.db2.gz OLXJQBFQXAOKSC-MHJFOBGBSA-N 1 3 343.515 2.588 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C[NH2+]CCc2ccccc2)CCCCC1 ZINC001675213551 1106316850 /nfs/dbraw/zinc/31/68/50/1106316850.db2.gz JOKDMGJFOXBWQP-UHFFFAOYSA-N 1 3 345.531 2.978 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@@H](C)C1)C1C[NH+](CCC2=CCCCC2)C1 ZINC001675343903 1106344930 /nfs/dbraw/zinc/34/49/30/1106344930.db2.gz XPWDMQZNPJCKPO-IAGOWNOFSA-N 1 3 333.520 2.655 10 0 EFAEHO CCCCC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)C3(N(C)C)CCC3)C[C@H]2C1 ZINC001675636423 1106400241 /nfs/dbraw/zinc/40/02/41/1106400241.db2.gz VLLUPDVQPHMJLM-BZSNNMDCSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCCC[N@H+]1C[C@@H]2CC[C@H](NC(=O)C3(N(C)C)CCC3)C[C@H]2C1 ZINC001675636423 1106400243 /nfs/dbraw/zinc/40/02/43/1106400243.db2.gz VLLUPDVQPHMJLM-BZSNNMDCSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CCC[N@H+](CC1=CCCCC1)C2 ZINC001675677055 1106409192 /nfs/dbraw/zinc/40/91/92/1106409192.db2.gz BHCNRZZQMYZUHR-UHFFFAOYSA-N 1 3 333.520 2.753 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CCC[N@@H+](CC1=CCCCC1)C2 ZINC001675677055 1106409195 /nfs/dbraw/zinc/40/91/95/1106409195.db2.gz BHCNRZZQMYZUHR-UHFFFAOYSA-N 1 3 333.520 2.753 10 0 EFAEHO CCCCC[N@@H+]1C[C@@]2(C)CN(C(=O)C3(N(C)C)CCC3)C[C@@]2(C)C1 ZINC001675688041 1106411563 /nfs/dbraw/zinc/41/15/63/1106411563.db2.gz IMBULELOINBPSU-KDURUIRLSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCCC[N@H+]1C[C@@]2(C)CN(C(=O)C3(N(C)C)CCC3)C[C@@]2(C)C1 ZINC001675688041 1106411566 /nfs/dbraw/zinc/41/15/66/1106411566.db2.gz IMBULELOINBPSU-KDURUIRLSA-N 1 3 335.536 2.831 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1C[C@H](C[NH2+]CCCC2CCCC2)C1 ZINC001675823603 1106425728 /nfs/dbraw/zinc/42/57/28/1106425728.db2.gz FWXURLCZQLBCAR-QAQDUYKDSA-N 1 3 332.492 2.715 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)CCC[NH2+]C/C=C/Cl ZINC001675985494 1106460522 /nfs/dbraw/zinc/46/05/22/1106460522.db2.gz CNRMWNBRSHRMOJ-XKQHDHNFSA-N 1 3 329.916 2.876 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+]CC1CC2(CCC2)C1 ZINC001676012288 1106468155 /nfs/dbraw/zinc/46/81/55/1106468155.db2.gz KUDCFRRDJTVZOL-CQSZACIVSA-N 1 3 332.492 2.715 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC/C=C/CNCc2csc(C)c2)C1 ZINC001483048959 1106479392 /nfs/dbraw/zinc/47/93/92/1106479392.db2.gz BFRSBMGUMTYHGW-WRFKIARRSA-N 1 3 349.544 2.941 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC/C=C/CNCc2csc(C)c2)C1 ZINC001483048959 1106479393 /nfs/dbraw/zinc/47/93/93/1106479393.db2.gz BFRSBMGUMTYHGW-WRFKIARRSA-N 1 3 349.544 2.941 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC/C=C/CNCc2csc(C)c2)C1 ZINC001483048958 1106479483 /nfs/dbraw/zinc/47/94/83/1106479483.db2.gz BFRSBMGUMTYHGW-SHCNBLLESA-N 1 3 349.544 2.941 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC/C=C/CNCc2csc(C)c2)C1 ZINC001483048958 1106479486 /nfs/dbraw/zinc/47/94/86/1106479486.db2.gz BFRSBMGUMTYHGW-SHCNBLLESA-N 1 3 349.544 2.941 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@@H](C[NH2+]CC2=CCCCC2)C2CC2)C1 ZINC001676249988 1106505511 /nfs/dbraw/zinc/50/55/11/1106505511.db2.gz RAFDZGQLYCBPIO-APWZRJJASA-N 1 3 333.520 2.655 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)[C@@H](C[NH2+]CC2=CCCCC2)C2CC2)C1 ZINC001676249990 1106505690 /nfs/dbraw/zinc/50/56/90/1106505690.db2.gz RAFDZGQLYCBPIO-LPHOPBHVSA-N 1 3 333.520 2.655 10 0 EFAEHO C[C@@H]1[C@H]([NH2+]CCCCc2ccccc2)CCN1C(=O)CN1CCCC1 ZINC001676692419 1106559701 /nfs/dbraw/zinc/55/97/01/1106559701.db2.gz DUEIIIDRLZNVHX-UYAOXDASSA-N 1 3 343.515 2.684 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@@H](C[NH2+]CCc3cccs3)C2)CCC1 ZINC001676933557 1106630265 /nfs/dbraw/zinc/63/02/65/1106630265.db2.gz YEOWTWLDSLJPAI-CVEARBPZSA-N 1 3 349.544 2.649 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+](Cc2cc(C)ccc2C)CC1)N(C)C ZINC001677575472 1106748597 /nfs/dbraw/zinc/74/85/97/1106748597.db2.gz VFZLAEGOEDXWJV-HXUWFJFHSA-N 1 3 343.515 2.892 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+](Cc2cc(C)ccc2C)CC1)N(C)C ZINC001677575472 1106748610 /nfs/dbraw/zinc/74/86/10/1106748610.db2.gz VFZLAEGOEDXWJV-HXUWFJFHSA-N 1 3 343.515 2.892 10 0 EFAEHO CC/C=C\CCN1CC[C@@H]1CNC(=O)C1CC[NH+](CC2CC2)CC1 ZINC001483691273 1107835938 /nfs/dbraw/zinc/83/59/38/1107835938.db2.gz DWYLZCSAZUHTPG-ZRHASKPBSA-N 1 3 333.520 2.655 10 0 EFAEHO Cc1cc(C[NH2+]C/C=C/CNC(=O)CN(C)CC(C)(C)C)cs1 ZINC001483060248 1107858671 /nfs/dbraw/zinc/85/86/71/1107858671.db2.gz GQDSJRRVJJAHQC-VOTSOKGWSA-N 1 3 337.533 2.796 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001409363615 1107915516 /nfs/dbraw/zinc/91/55/16/1107915516.db2.gz KKIZFIIBKCEZGJ-HZPDHXFCSA-N 1 3 331.504 2.716 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@@H]1CCN1C[C@@H]1CCCC(F)(F)C1 ZINC001483693096 1107926915 /nfs/dbraw/zinc/92/69/15/1107926915.db2.gz KMFANTLPCNVJHF-CVEARBPZSA-N 1 3 345.478 2.734 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)[C@H]3CCCN3C)C2)cc1F ZINC001272384865 1108140224 /nfs/dbraw/zinc/14/02/24/1108140224.db2.gz SPTRREIMEXCFLV-QFBILLFUSA-N 1 3 347.478 2.557 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N[C@H](C)[C@@H](C)NCc2ccccc2F)CC1 ZINC001409420814 1108263269 /nfs/dbraw/zinc/26/32/69/1108263269.db2.gz DZTKVIQXNOTWOF-HZPDHXFCSA-N 1 3 349.494 2.929 10 0 EFAEHO CCCN(C)CC(=O)NC/C=C/C[NH2+][C@H]1CCc2c1cccc2Cl ZINC001483087556 1108485920 /nfs/dbraw/zinc/48/59/20/1108485920.db2.gz QOLXTZCJMRATAH-WRFKIARRSA-N 1 3 349.906 2.931 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]CCCCC(F)(F)F)C1 ZINC001272524872 1108616255 /nfs/dbraw/zinc/61/62/55/1108616255.db2.gz VXEPYNHYVGHEGT-LSDHHAIUSA-N 1 3 349.441 2.641 10 0 EFAEHO C[C@H](CN[C@@H](C)c1ccccc1Cl)NC(=O)C12CC[NH+](CC1)C2 ZINC001483184984 1109967464 /nfs/dbraw/zinc/96/74/64/1109967464.db2.gz ZMFSHGLVDLTGNA-KGLIPLIRSA-N 1 3 335.879 2.591 10 0 EFAEHO CCc1ccc(CC[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCCN2CC)cc1 ZINC001483197461 1109997098 /nfs/dbraw/zinc/99/70/98/1109997098.db2.gz KHFUDIFIVQSHGM-XLIONFOSSA-N 1 3 345.531 2.760 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](CC[NH2+]Cc2csc(C)c2)C1)N(C)C ZINC001272617589 1111750966 /nfs/dbraw/zinc/75/09/66/1111750966.db2.gz XOEWNDWDXPHXIF-RDJZCZTQSA-N 1 3 337.533 2.725 10 0 EFAEHO C[C@H](NC1(CNC(=O)C2(C[NH+](C)C)CC2)CC1)c1ccc(Cl)cc1 ZINC001483763249 1112150468 /nfs/dbraw/zinc/15/04/68/1112150468.db2.gz YYUSFHHKNRRJMM-AWEZNQCLSA-N 1 3 349.906 2.981 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+][C@@H](C)c2cc(C)ccc2C)CC1)N(C)C ZINC001483784962 1112447315 /nfs/dbraw/zinc/44/73/15/1112447315.db2.gz YXHKLNYIFJJSRQ-WMZOPIPTSA-N 1 3 331.504 2.943 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2cccc(C(F)F)c2)CC1 ZINC001483795544 1112455508 /nfs/dbraw/zinc/45/55/08/1112455508.db2.gz WRSPYZXMBROXML-UHFFFAOYSA-N 1 3 339.430 2.703 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001483848245 1112509238 /nfs/dbraw/zinc/50/92/38/1112509238.db2.gz RPADQHRGYVESHK-DUIUGDAFSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001483848245 1112509240 /nfs/dbraw/zinc/50/92/40/1112509240.db2.gz RPADQHRGYVESHK-DUIUGDAFSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CCCc2ccsc2)CCN1C(=O)CN1CCCC1 ZINC001483912582 1112554772 /nfs/dbraw/zinc/55/47/72/1112554772.db2.gz AVHWZKVVQGSUQM-SJLPKXTDSA-N 1 3 349.544 2.746 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[NH2+]CCc1ccc(Cl)cc1 ZINC001483924503 1112563302 /nfs/dbraw/zinc/56/33/02/1112563302.db2.gz JBMPGZONGUPBKC-ROUUACIJSA-N 1 3 349.906 2.557 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@@H]1C[NH2+]CCCC(C)(C)C)N(C)C ZINC001483934435 1112576037 /nfs/dbraw/zinc/57/60/37/1112576037.db2.gz MIVXOJONACUPHO-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001483951978 1112594673 /nfs/dbraw/zinc/59/46/73/1112594673.db2.gz OCUOONBMUKPAJD-CVEARBPZSA-N 1 3 345.478 2.734 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NCC1(C)CCN(C/C=C\Cl)CC1 ZINC001484147088 1112825139 /nfs/dbraw/zinc/82/51/39/1112825139.db2.gz MQPUGJRKOWPGND-JKUHXPQUSA-N 1 3 341.927 2.830 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1CCC(F)(F)[C@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001484196744 1112915046 /nfs/dbraw/zinc/91/50/46/1112915046.db2.gz WCGHEMSSHKZVND-HUUCEWRRSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@@H](C)C[N@H+]1CCC(F)(F)[C@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001484196744 1112915050 /nfs/dbraw/zinc/91/50/50/1112915050.db2.gz WCGHEMSSHKZVND-HUUCEWRRSA-N 1 3 345.478 2.590 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](CC[NH2+]CCc2ccccc2)C1)C1CCC1 ZINC001484525926 1112981886 /nfs/dbraw/zinc/98/18/86/1112981886.db2.gz UKZUKTBIZICOEZ-LJQANCHMSA-N 1 3 343.515 2.542 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+]Cc2ccc(C)cc2)C1 ZINC001484548393 1113000658 /nfs/dbraw/zinc/00/06/58/1113000658.db2.gz DXQUWHGKMHLCOH-IBGZPJMESA-N 1 3 331.504 2.665 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001484551316 1113004191 /nfs/dbraw/zinc/00/41/91/1113004191.db2.gz GUZOZOJMZUKAFT-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CC[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001484552268 1113004911 /nfs/dbraw/zinc/00/49/11/1113004911.db2.gz YPHVJNHFOHAOSS-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]CCCCC(F)(F)F)CCC2)CCC1 ZINC001484637720 1113089728 /nfs/dbraw/zinc/08/97/28/1113089728.db2.gz OHZNEVDPDSNCEO-UHFFFAOYSA-N 1 3 349.441 2.832 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]CC[C@H]2CCCC2(F)F)CCC1 ZINC001484663087 1113103382 /nfs/dbraw/zinc/10/33/82/1113103382.db2.gz GWYZUXIDZFWVKW-OAHLLOKOSA-N 1 3 345.478 2.781 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)CN1CC[C@@H](C)C1)C2 ZINC001484828811 1117746618 /nfs/dbraw/zinc/74/66/18/1117746618.db2.gz DCKQWONQPJRGAG-UYAOXDASSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCC[N@H+]1CC[C@@]2(C1)CCCN(C(=O)CN1CC[C@@H](C)C1)C2 ZINC001484828811 1117746622 /nfs/dbraw/zinc/74/66/22/1117746622.db2.gz DCKQWONQPJRGAG-UYAOXDASSA-N 1 3 335.536 2.833 10 0 EFAEHO CCC1([NH2+]CC2=CCCCC2)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001484816559 1117749853 /nfs/dbraw/zinc/74/98/53/1117749853.db2.gz MNJGDSYQDINGIT-UHFFFAOYSA-N 1 3 330.476 2.813 10 0 EFAEHO C[C@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@H]1[NH2+]CCCCCF ZINC001484907695 1117821894 /nfs/dbraw/zinc/82/18/94/1117821894.db2.gz VDYVPJCQFJNGDF-QFBILLFUSA-N 1 3 349.494 2.938 10 0 EFAEHO C[C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@@H]1[NH2+]CCCCCF ZINC001484907692 1117821916 /nfs/dbraw/zinc/82/19/16/1117821916.db2.gz VDYVPJCQFJNGDF-APWZRJJASA-N 1 3 349.494 2.938 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCN(C/C=C\c2ccccc2)CC1(C)C ZINC001484937213 1117850324 /nfs/dbraw/zinc/85/03/24/1117850324.db2.gz LNYGRERIAFTGBP-SCEWNMGZSA-N 1 3 343.515 2.868 10 0 EFAEHO COc1ccc(C[N@@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001484987701 1117913824 /nfs/dbraw/zinc/91/38/24/1117913824.db2.gz GMILYNLVZLDTTR-FUHWJXTLSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(C[N@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001484987701 1117913826 /nfs/dbraw/zinc/91/38/26/1117913826.db2.gz GMILYNLVZLDTTR-FUHWJXTLSA-N 1 3 347.503 2.505 10 0 EFAEHO CC[N@H+](CC[C@@H](C)F)CC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001485030767 1117956055 /nfs/dbraw/zinc/95/60/55/1117956055.db2.gz CJXXSSQUKKRWAS-MRXNPFEDSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[N@@H+](CC[C@@H](C)F)CC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001485030767 1117956059 /nfs/dbraw/zinc/95/60/59/1117956059.db2.gz CJXXSSQUKKRWAS-MRXNPFEDSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@H](F)CC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)C1(N(C)C)CCC1 ZINC001485044279 1117963492 /nfs/dbraw/zinc/96/34/92/1117963492.db2.gz WNOJMMROSUANLU-BMGDILEWSA-N 1 3 347.478 2.591 10 0 EFAEHO CC[C@@H](C)C[N@H+](CC)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001485033216 1117966367 /nfs/dbraw/zinc/96/63/67/1117966367.db2.gz ZOBKUICAPXQAGM-QZTJIDSGSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C)C[N@@H+](CC)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001485033216 1117966368 /nfs/dbraw/zinc/96/63/68/1117966368.db2.gz ZOBKUICAPXQAGM-QZTJIDSGSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@H]([C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001485081513 1118031828 /nfs/dbraw/zinc/03/18/28/1118031828.db2.gz FBGFMNNFVRLAAU-MOPGFXCFSA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@H]([C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001485081513 1118031833 /nfs/dbraw/zinc/03/18/33/1118031833.db2.gz FBGFMNNFVRLAAU-MOPGFXCFSA-N 1 3 335.536 2.853 10 0 EFAEHO CN(C)C1(C(=O)NC2CC(C[NH2+]CCCCC(F)(F)F)C2)CCC1 ZINC001485094318 1118042360 /nfs/dbraw/zinc/04/23/60/1118042360.db2.gz QDWQRQOXRBOPGS-UHFFFAOYSA-N 1 3 349.441 2.688 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001485158924 1118101223 /nfs/dbraw/zinc/10/12/23/1118101223.db2.gz TUPSUGZLVRGXST-IRXDYDNUSA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@@H](NC(=O)C12CCC[NH+](CCC1)C2)[C@H](C)NCc1ccccc1F ZINC001485165077 1118107822 /nfs/dbraw/zinc/10/78/22/1118107822.db2.gz UMOFFKWRSPJKBL-JKSUJKDBSA-N 1 3 347.478 2.685 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)c(C)n1 ZINC001485180611 1118114884 /nfs/dbraw/zinc/11/48/84/1118114884.db2.gz NREVKTVLELSYEX-HOTGVXAUSA-N 1 3 346.519 2.556 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001485214215 1118150953 /nfs/dbraw/zinc/15/09/53/1118150953.db2.gz FKMSBWUTYXTPRE-OLZOCXBDSA-N 1 3 343.874 2.804 10 0 EFAEHO C[C@@H](NC(=O)c1cccc(C[NH+](C)C)c1)[C@H](C)NCc1ccns1 ZINC001485228175 1118154233 /nfs/dbraw/zinc/15/42/33/1118154233.db2.gz CIDNPDLLACUQMF-UONOGXRCSA-N 1 3 346.500 2.501 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)Cc2cc(F)ccc2C)CC[N@@H+]1C ZINC001485307824 1118220717 /nfs/dbraw/zinc/22/07/17/1118220717.db2.gz RLXSAPRBOMKJLX-AYOQOUSVSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)Cc2cc(F)ccc2C)CC[N@H+]1C ZINC001485307824 1118220720 /nfs/dbraw/zinc/22/07/20/1118220720.db2.gz RLXSAPRBOMKJLX-AYOQOUSVSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@H](CNC(=O)C12CCC[NH+](CCC1)C2)N(C)Cc1ccc(F)cc1 ZINC001485320737 1118232166 /nfs/dbraw/zinc/23/21/66/1118232166.db2.gz VKIADUGPLRATDV-MRXNPFEDSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@H](CNC(=O)C12CCC[NH+](CCC1)C2)N(C)Cc1cccc(F)c1 ZINC001485320106 1118232601 /nfs/dbraw/zinc/23/26/01/1118232601.db2.gz QLCHFHZSLACTSS-MRXNPFEDSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)CN1CCCC1)[NH2+]Cc1ccccc1F ZINC001485441561 1118354006 /nfs/dbraw/zinc/35/40/06/1118354006.db2.gz PKSSBRHIONWKEV-LJQANCHMSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]Cc1cccc(F)c1 ZINC001485429053 1118358492 /nfs/dbraw/zinc/35/84/92/1118358492.db2.gz OQDOUICOZOJOGC-MOPGFXCFSA-N 1 3 349.494 2.883 10 0 EFAEHO CCCC[C@H](C[NH2+]C(C)C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001485468571 1118378615 /nfs/dbraw/zinc/37/86/15/1118378615.db2.gz NUZNUBUFXVVWNA-QAPCUYQASA-N 1 3 329.504 2.872 10 0 EFAEHO CCCC[C@@H](C[NH2+]C(C)C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001485468570 1118378655 /nfs/dbraw/zinc/37/86/55/1118378655.db2.gz NUZNUBUFXVVWNA-MAUKXSAKSA-N 1 3 329.504 2.872 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@H]2CCCCCN2Cc2ccsc2)C1 ZINC001485484829 1118418195 /nfs/dbraw/zinc/41/81/95/1118418195.db2.gz LRONTDBCTBFLMO-SJLPKXTDSA-N 1 3 349.544 2.951 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@H]2CCCCCN2Cc2ccsc2)C1 ZINC001485484829 1118418197 /nfs/dbraw/zinc/41/81/97/1118418197.db2.gz LRONTDBCTBFLMO-SJLPKXTDSA-N 1 3 349.544 2.951 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)C1C[NH+](CC2CCCCC2)C1 ZINC001485520685 1118433655 /nfs/dbraw/zinc/43/36/55/1118433655.db2.gz QKHNOXNOZKXHMN-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1cc(C)cc(CN2C[C@H](NC(=O)CCC[NH+](C)C)C(C)(C)C2)c1 ZINC001485575985 1118473417 /nfs/dbraw/zinc/47/34/17/1118473417.db2.gz AFQZFGJUJBKHMT-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO C[C@H](CCC[NH2+]Cc1cccnc1)NC(=O)C(C)(C)N1CCCCC1 ZINC001485723187 1118543412 /nfs/dbraw/zinc/54/34/12/1118543412.db2.gz YQUIDKSONGXIJJ-QGZVFWFLSA-N 1 3 346.519 2.721 10 0 EFAEHO C[N@H+](CC[C@H](N)c1ccccc1Br)C[C@@H]1CCCO1 ZINC000054020418 214211062 /nfs/dbraw/zinc/21/10/62/214211062.db2.gz ANORWTVISZMEJN-WFASDCNBSA-N 1 3 327.266 2.950 10 0 EFAEHO C[N@@H+](CC[C@H](N)c1ccccc1Br)C[C@@H]1CCCO1 ZINC000054020418 214211066 /nfs/dbraw/zinc/21/10/66/214211066.db2.gz ANORWTVISZMEJN-WFASDCNBSA-N 1 3 327.266 2.950 10 0 EFAEHO CN(C)[C@H](CNC(=O)C[NH2+][C@H]1CC2CCC1CC2)c1ccccc1 ZINC000433069531 282238426 /nfs/dbraw/zinc/23/84/26/282238426.db2.gz VMFOVYUNXBCOIY-YVZJPGBNSA-N 1 3 329.488 2.574 10 0 EFAEHO CN1CC[C@@H](NC(=O)NC(C)(C)C[NH+]2CCCC2)[C@@H]1c1ccccc1 ZINC000458567567 283050399 /nfs/dbraw/zinc/05/03/99/283050399.db2.gz CWMFPBRVFNXLQG-MSOLQXFVSA-N 1 3 344.503 2.605 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)NCC[NH+]1[C@H](C)CCC[C@H]1C ZINC000352996390 283237558 /nfs/dbraw/zinc/23/75/58/283237558.db2.gz GOSAYGGQJUESLW-QZTJIDSGSA-N 1 3 338.540 2.767 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2CCC[C@@H]([NH+](C)C)C2)CC1 ZINC000092938516 283349892 /nfs/dbraw/zinc/34/98/92/283349892.db2.gz APVDDBSMIWSSJJ-HXUWFJFHSA-N 1 3 344.547 2.745 10 0 EFAEHO O=C([C@@H]1CCCN1C1CC1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000426484614 296016168 /nfs/dbraw/zinc/01/61/68/296016168.db2.gz GXHXREHDWDZLGW-HKUYNNGSSA-N 1 3 333.520 2.728 10 0 EFAEHO CCC[C@](C)([NH3+])C(=O)N[C@@H]1CC2(CCN(C)CC2)Oc2ccccc21 ZINC000262172535 284004968 /nfs/dbraw/zinc/00/49/68/284004968.db2.gz XQOFXHDJUMVGQB-APWZRJJASA-N 1 3 345.487 2.608 10 0 EFAEHO O=C(c1cccc(C[NH+]2CCCCC2)c1)N1CCN2CCC1CC2 ZINC000412277549 243241837 /nfs/dbraw/zinc/24/18/37/243241837.db2.gz HHMHGCFBPSINNK-UHFFFAOYSA-N 1 3 327.472 2.593 10 0 EFAEHO C[C@H](CCC1CCCC1)[NH2+]CC1(N2CCOCC2)CCN(C)CC1 ZINC000414185106 244037296 /nfs/dbraw/zinc/03/72/96/244037296.db2.gz GIZWTPUBTJIPLF-GOSISDBHSA-N 1 3 337.552 2.732 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](NCc2ccc3cncn3c2)[C@H](C)C1 ZINC000414188356 244038082 /nfs/dbraw/zinc/03/80/82/244038082.db2.gz QOYBPZKIOQJAQU-VQIMIIECSA-N 1 3 330.476 2.561 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](NCc2ccc3cncn3c2)[C@H](C)C1 ZINC000414188356 244038086 /nfs/dbraw/zinc/03/80/86/244038086.db2.gz QOYBPZKIOQJAQU-VQIMIIECSA-N 1 3 330.476 2.561 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]Cc2ccc3cncn3c2)[C@H](C)C1 ZINC000414188356 244038095 /nfs/dbraw/zinc/03/80/95/244038095.db2.gz QOYBPZKIOQJAQU-VQIMIIECSA-N 1 3 330.476 2.561 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NCc2ccc3cncn3c2)[C@H](C)C1 ZINC000414188326 244038730 /nfs/dbraw/zinc/03/87/30/244038730.db2.gz QOYBPZKIOQJAQU-APWZRJJASA-N 1 3 330.476 2.561 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NCc2ccc3cncn3c2)[C@H](C)C1 ZINC000414188326 244038735 /nfs/dbraw/zinc/03/87/35/244038735.db2.gz QOYBPZKIOQJAQU-APWZRJJASA-N 1 3 330.476 2.561 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2ccc3cncn3c2)[C@H](C)C1 ZINC000414188326 244038738 /nfs/dbraw/zinc/03/87/38/244038738.db2.gz QOYBPZKIOQJAQU-APWZRJJASA-N 1 3 330.476 2.561 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NCc2ccc3cncn3c2)[C@@H](C)C1 ZINC000414188348 244039623 /nfs/dbraw/zinc/03/96/23/244039623.db2.gz QOYBPZKIOQJAQU-LPHOPBHVSA-N 1 3 330.476 2.561 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NCc2ccc3cncn3c2)[C@@H](C)C1 ZINC000414188348 244039626 /nfs/dbraw/zinc/03/96/26/244039626.db2.gz QOYBPZKIOQJAQU-LPHOPBHVSA-N 1 3 330.476 2.561 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2ccc3cncn3c2)[C@@H](C)C1 ZINC000414188348 244039628 /nfs/dbraw/zinc/03/96/28/244039628.db2.gz QOYBPZKIOQJAQU-LPHOPBHVSA-N 1 3 330.476 2.561 10 0 EFAEHO CCCC[C@H](COC)[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000414294953 244079516 /nfs/dbraw/zinc/07/95/16/244079516.db2.gz CNWUZQKPOIJKIP-LJQANCHMSA-N 1 3 334.504 2.808 10 0 EFAEHO C[C@@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)[C@]1(C)CCCO1 ZINC000414308444 244080645 /nfs/dbraw/zinc/08/06/45/244080645.db2.gz QEUBSDZURXRXHE-MJGOQNOKSA-N 1 3 332.488 2.561 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1)[C@H]1C[C@H]1C ZINC000414336596 244093256 /nfs/dbraw/zinc/09/32/56/244093256.db2.gz IKQWLFAHMFSQJE-CLCXKQKWSA-N 1 3 329.488 2.518 10 0 EFAEHO CC(C)NC(=O)[C@@H](C)[NH2+]C1CCN([C@H](C)Cc2ccccc2)CC1 ZINC000414344870 244096639 /nfs/dbraw/zinc/09/66/39/244096639.db2.gz OJPPQUKILAVKTN-IAGOWNOFSA-N 1 3 331.504 2.585 10 0 EFAEHO CC(C)NC(=O)[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000414347926 244099576 /nfs/dbraw/zinc/09/95/76/244099576.db2.gz RLRYPNKSTYRDKM-DSLXNQLJSA-N 1 3 329.488 2.685 10 0 EFAEHO Cc1ccc([C@@H]2CCC[N@@H+]2C[C@@H]2CCCN(C(=O)CN)C2)cc1C ZINC000414698705 244296392 /nfs/dbraw/zinc/29/63/92/244296392.db2.gz XUAJQNAMXWWOIT-HKUYNNGSSA-N 1 3 329.488 2.638 10 0 EFAEHO Cc1ccc([C@@H]2CCC[N@H+]2C[C@@H]2CCCN(C(=O)CN)C2)cc1C ZINC000414698705 244296394 /nfs/dbraw/zinc/29/63/94/244296394.db2.gz XUAJQNAMXWWOIT-HKUYNNGSSA-N 1 3 329.488 2.638 10 0 EFAEHO C[C@@H](c1cc2ccccc2o1)[N@H+](C)C[C@H]1CCCN(C(=O)CN)C1 ZINC000414675851 244288012 /nfs/dbraw/zinc/28/80/12/244288012.db2.gz GSLVLFGOSDXEAW-LSDHHAIUSA-N 1 3 329.444 2.623 10 0 EFAEHO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)C[C@H]1CCCN(C(=O)CN)C1 ZINC000414675851 244288015 /nfs/dbraw/zinc/28/80/15/244288015.db2.gz GSLVLFGOSDXEAW-LSDHHAIUSA-N 1 3 329.444 2.623 10 0 EFAEHO C[C@H]1C[C@H](CN(CCO)Cc2cc(Br)cs2)CC[NH2+]1 ZINC000414752784 244327024 /nfs/dbraw/zinc/32/70/24/244327024.db2.gz CRUFYQBBVVBSQR-NWDGAFQWSA-N 1 3 347.322 2.693 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)N[C@@H]1CC[NH2+]C[C@H]1C ZINC000414945141 244397230 /nfs/dbraw/zinc/39/72/30/244397230.db2.gz RAMZMYFBTXXQRC-CKEIUWERSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+][C@@H]1CCNC[C@H]1C ZINC000414945141 244397239 /nfs/dbraw/zinc/39/72/39/244397239.db2.gz RAMZMYFBTXXQRC-CKEIUWERSA-N 1 3 337.895 2.665 10 0 EFAEHO CCn1nncc1CNCC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000417960342 245107399 /nfs/dbraw/zinc/10/73/99/245107399.db2.gz XHNKSLWNDKQGSU-WMZOPIPTSA-N 1 3 327.476 2.688 10 0 EFAEHO CCn1nncc1CNCC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000417960342 245107404 /nfs/dbraw/zinc/10/74/04/245107404.db2.gz XHNKSLWNDKQGSU-WMZOPIPTSA-N 1 3 327.476 2.688 10 0 EFAEHO CCn1nncc1CNCC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000417960341 245107586 /nfs/dbraw/zinc/10/75/86/245107586.db2.gz XHNKSLWNDKQGSU-SJLPKXTDSA-N 1 3 327.476 2.688 10 0 EFAEHO CCn1nncc1CNCC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000417960341 245107589 /nfs/dbraw/zinc/10/75/89/245107589.db2.gz XHNKSLWNDKQGSU-SJLPKXTDSA-N 1 3 327.476 2.688 10 0 EFAEHO CC(C)c1ccc([C@@H](N)CNC(=O)N(C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000418359777 245134987 /nfs/dbraw/zinc/13/49/87/245134987.db2.gz SMIFDDWFOWYHGL-SWDXFRIISA-N 1 3 344.503 2.734 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)N(C)[C@@H](C)C2CCN(C)CC2)cc1 ZINC000418490859 245173101 /nfs/dbraw/zinc/17/31/01/245173101.db2.gz NLJDBSMECGQSAW-CABCVRRESA-N 1 3 332.492 2.578 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)N(CCN(C)C)Cc2ccco2)cc1 ZINC000418498789 245175810 /nfs/dbraw/zinc/17/58/10/245175810.db2.gz XSIKPMLZASLKMG-HNNXBMFYSA-N 1 3 344.459 2.573 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[NH3+])[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418434622 245156541 /nfs/dbraw/zinc/15/65/41/245156541.db2.gz VXLDCPMKJGMYKA-RDJZCZTQSA-N 1 3 332.492 2.591 10 0 EFAEHO CCCC[N@H+](C)CC1CCN(C(=O)NC[C@H](N)c2ccccc2)CC1 ZINC000418449137 245162467 /nfs/dbraw/zinc/16/24/67/245162467.db2.gz JYPXDPWYLDHOPH-IBGZPJMESA-N 1 3 346.519 2.840 10 0 EFAEHO CCCC[N@@H+](C)CC1CCN(C(=O)NC[C@H](N)c2ccccc2)CC1 ZINC000418449137 245162472 /nfs/dbraw/zinc/16/24/72/245162472.db2.gz JYPXDPWYLDHOPH-IBGZPJMESA-N 1 3 346.519 2.840 10 0 EFAEHO CC1CCC(N2CCN(C(=O)NC[C@@H]([NH3+])c3ccccc3)CC2)CC1 ZINC000418456162 245165159 /nfs/dbraw/zinc/16/51/59/245165159.db2.gz SQMQDMKKPRLAKZ-NKELODKYSA-N 1 3 344.503 2.592 10 0 EFAEHO CC[NH+](CC)CC1CCN(C(=O)NCc2ccc3c(c2)CNC3)CC1 ZINC000418556778 245192920 /nfs/dbraw/zinc/19/29/20/245192920.db2.gz QKXVZTMBNBDDAQ-UHFFFAOYSA-N 1 3 344.503 2.553 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)N(C)[C@@H]1CC[N@@H+](CC)C[C@@H]1C ZINC000418644566 245223325 /nfs/dbraw/zinc/22/33/25/245223325.db2.gz CHUUIJVUBNLFRO-KFKAGJAMSA-N 1 3 346.519 2.621 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)N(C)[C@@H]1CC[N@H+](CC)C[C@@H]1C ZINC000418644566 245223330 /nfs/dbraw/zinc/22/33/30/245223330.db2.gz CHUUIJVUBNLFRO-KFKAGJAMSA-N 1 3 346.519 2.621 10 0 EFAEHO CC[C@H]([NH3+])CNC(=O)N(CC)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418711240 245256834 /nfs/dbraw/zinc/25/68/34/245256834.db2.gz WGKRVPAJVOJCLD-RYQLBKOJSA-N 1 3 332.492 2.591 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCN(C(=O)N[C@H]2CC[C@H](C[NH3+])C2)CC1 ZINC000418789984 245293188 /nfs/dbraw/zinc/29/31/88/245293188.db2.gz MKFDCRIEQGOUIK-HOTGVXAUSA-N 1 3 338.540 2.656 10 0 EFAEHO C[C@H]1CC[C@@H](C[NH3+])CN1CCOc1cccc(Br)c1 ZINC000042427536 204096806 /nfs/dbraw/zinc/09/68/06/204096806.db2.gz COYZVGUJSYIONJ-STQMWFEESA-N 1 3 327.266 2.887 10 0 EFAEHO C[C@H]([NH2+]C(C)(C)CNC(=O)NC[C@@H]1CCCN1C)c1ccccc1 ZINC000113604370 204452789 /nfs/dbraw/zinc/45/27/89/204452789.db2.gz WNOODSZTQIVTMT-RDJZCZTQSA-N 1 3 332.492 2.509 10 0 EFAEHO CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)[C@H]1CCC[C@H]([NH3+])C1 ZINC000246220850 205186184 /nfs/dbraw/zinc/18/61/84/205186184.db2.gz GTIMRCXPRBMCSE-AABGKKOBSA-N 1 3 343.515 2.875 10 0 EFAEHO CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)[C@H]1CCC[C@@H]([NH3+])C1 ZINC000246220859 205186382 /nfs/dbraw/zinc/18/63/82/205186382.db2.gz GTIMRCXPRBMCSE-HSALFYBXSA-N 1 3 343.515 2.875 10 0 EFAEHO COc1ccc2c(c1)OC[C@H]([NH2+][C@H](C)c1ccc(CN)nc1C)C2 ZINC000423022069 246545445 /nfs/dbraw/zinc/54/54/45/246545445.db2.gz HADBVGPSKSVEBT-CZUORRHYSA-N 1 3 327.428 2.512 10 0 EFAEHO C[C@H](C(=O)NCCCC[NH+](C)C)N1CCC(Cc2ccccc2)CC1 ZINC000264928645 247054917 /nfs/dbraw/zinc/05/49/17/247054917.db2.gz MXONGOBVXIEZGD-GOSISDBHSA-N 1 3 345.531 2.788 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CC[C@H]([NH+]2CCCC2)C1 ZINC000171439336 296249527 /nfs/dbraw/zinc/24/95/27/296249527.db2.gz IIOMNJGXIDCWAH-IBGZPJMESA-N 1 3 327.472 2.593 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C ZINC000116410492 296311718 /nfs/dbraw/zinc/31/17/18/296311718.db2.gz LMAWYKIUXNUKJH-CVEARBPZSA-N 1 3 326.529 2.526 10 0 EFAEHO COC[C@](C)(O)CC[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000449383723 251006180 /nfs/dbraw/zinc/00/61/80/251006180.db2.gz JNGDTPLMQSEXBT-XRXFAXGQSA-N 1 3 346.515 2.664 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@@H](CO)[C@H]2CC)CC1 ZINC000449431918 251024581 /nfs/dbraw/zinc/02/45/81/251024581.db2.gz ZPXXAHVGWZEUMD-VQTJNVASSA-N 1 3 345.531 2.811 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@@H](CO)[C@H]2CC)CC1 ZINC000449431918 251024583 /nfs/dbraw/zinc/02/45/83/251024583.db2.gz ZPXXAHVGWZEUMD-VQTJNVASSA-N 1 3 345.531 2.811 10 0 EFAEHO COC(=O)C1(CN2CC[C@]3(C2)CCC[N@H+](Cc2ccccc2)C3)CC1 ZINC000450453029 251392335 /nfs/dbraw/zinc/39/23/35/251392335.db2.gz LFCNJXYPXMGSLX-HXUWFJFHSA-N 1 3 342.483 2.928 10 0 EFAEHO COC(=O)C1(CN2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)CC1 ZINC000450453029 251392338 /nfs/dbraw/zinc/39/23/38/251392338.db2.gz LFCNJXYPXMGSLX-HXUWFJFHSA-N 1 3 342.483 2.928 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(C)C(=O)c1cccc(CN2CCCC2)c1 ZINC000176986397 207281031 /nfs/dbraw/zinc/28/10/31/207281031.db2.gz CHHFRNBVFVFLFN-IBGZPJMESA-N 1 3 329.488 2.839 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1cccc(CN2CCCC2)c1 ZINC000176986397 207281036 /nfs/dbraw/zinc/28/10/36/207281036.db2.gz CHHFRNBVFVFLFN-IBGZPJMESA-N 1 3 329.488 2.839 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[N@@H+]1CC[C@H]2[C@H](CCCN2C)C1 ZINC000268740228 252189912 /nfs/dbraw/zinc/18/99/12/252189912.db2.gz POPFZCJSDQESBT-GGPKGHCWSA-N 1 3 346.515 2.966 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H]2[C@H](CCCN2C)C1 ZINC000268740228 252189913 /nfs/dbraw/zinc/18/99/13/252189913.db2.gz POPFZCJSDQESBT-GGPKGHCWSA-N 1 3 346.515 2.966 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CCN(C2CC2)C1 ZINC000268798740 252250860 /nfs/dbraw/zinc/25/08/60/252250860.db2.gz GXNFOJNIIPBCQI-YFVAEKQCSA-N 1 3 327.516 2.971 10 0 EFAEHO CN1CCC[C@@H]1CC[NH+]1CCC(C(=O)N2CCc3ccccc32)CC1 ZINC000126300415 141366752 /nfs/dbraw/zinc/36/67/52/141366752.db2.gz QJVBBSMGBMKOTK-LJQANCHMSA-N 1 3 341.499 2.772 10 0 EFAEHO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)C(=O)N1CCCC1 ZINC000343466002 142003667 /nfs/dbraw/zinc/00/36/67/142003667.db2.gz QGUAKZXZDWTNHF-VOBGVNJCSA-N 1 3 341.499 2.783 10 0 EFAEHO CN1CCC(CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000347538901 142232552 /nfs/dbraw/zinc/23/25/52/142232552.db2.gz KOADNACHHCNUQM-UHFFFAOYSA-N 1 3 329.488 2.631 10 0 EFAEHO C[C@H](c1ccccc1)[C@H](C)[NH2+]CC(=O)NC1CCN(C2CC2)CC1 ZINC000347684729 142256421 /nfs/dbraw/zinc/25/64/21/142256421.db2.gz PJNBTXFHQBSYME-HOTGVXAUSA-N 1 3 329.488 2.511 10 0 EFAEHO COC(=O)c1cc(CNCc2ccc(C[NH+]3CCCC3)cc2)cn1C ZINC000347923661 142293796 /nfs/dbraw/zinc/29/37/96/142293796.db2.gz PNYMEYSLWIRDCL-UHFFFAOYSA-N 1 3 341.455 2.697 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)N(C)[C@H]2CCN(C3CC3)C2)c1 ZINC000349632890 142342052 /nfs/dbraw/zinc/34/20/52/142342052.db2.gz LLFWFSAEBQTAFB-IBGZPJMESA-N 1 3 344.503 2.516 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)N(C)[C@H]2CCN(C3CC3)C2)c1 ZINC000349632890 142342053 /nfs/dbraw/zinc/34/20/53/142342053.db2.gz LLFWFSAEBQTAFB-IBGZPJMESA-N 1 3 344.503 2.516 10 0 EFAEHO COC1(C[NH2+]CC2(N3CCCCC3)CCN(C)CC2)CCCCC1 ZINC000359728095 292121248 /nfs/dbraw/zinc/12/12/48/292121248.db2.gz HYKXPWWWMKTBKS-UHFFFAOYSA-N 1 3 337.552 2.876 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)NCC1([NH+](C)C)CCCCC1 ZINC000341236253 145018798 /nfs/dbraw/zinc/01/87/98/145018798.db2.gz NGBGJKGFIYZZQT-CALCHBBNSA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000341272531 145024180 /nfs/dbraw/zinc/02/41/80/145024180.db2.gz YUPOVGLJYNCNFH-GJZGRUSLSA-N 1 3 338.540 2.858 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000341308647 145030585 /nfs/dbraw/zinc/03/05/85/145030585.db2.gz AIEIWHLRPRCHFE-ZHALLVOQSA-N 1 3 346.519 2.679 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H](CNC(=O)NCCN2[C@@H](C)CCC[C@@H]2C)C1 ZINC000341433927 145051596 /nfs/dbraw/zinc/05/15/96/145051596.db2.gz QOCYQCZCGCEWSP-OKZBNKHCSA-N 1 3 338.540 2.669 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H](CNC(=O)NCCN2[C@@H](C)CCC[C@@H]2C)C1 ZINC000341433927 145051598 /nfs/dbraw/zinc/05/15/98/145051598.db2.gz QOCYQCZCGCEWSP-OKZBNKHCSA-N 1 3 338.540 2.669 10 0 EFAEHO Cc1ccccc1[C@@H](NCC(=O)NC1CC[NH+](C2CC2)CC1)C1CC1 ZINC000343616135 145253411 /nfs/dbraw/zinc/25/34/11/145253411.db2.gz UKVAMDVJGJCZPX-NRFANRHFSA-N 1 3 341.499 2.779 10 0 EFAEHO COc1cccc([C@H](C)N2CC[C@H]([NH+]3CCN(C)CC3)[C@H](C)C2)c1 ZINC000343919583 145324518 /nfs/dbraw/zinc/32/45/18/145324518.db2.gz GJVBXZGKWOYLQI-UWVAXJGDSA-N 1 3 331.504 2.714 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N1CCN(C2CCC(C)CC2)CC1 ZINC000350724781 146084160 /nfs/dbraw/zinc/08/41/60/146084160.db2.gz OKZRMRSXOJNEJT-LXPRWKDFSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@]1(NCC(=O)NC2CC[NH+](C3CC3)CC2)CCCc2ccccc21 ZINC000351724535 146188078 /nfs/dbraw/zinc/18/80/78/146188078.db2.gz YUDKBUFVABQWPK-NRFANRHFSA-N 1 3 341.499 2.571 10 0 EFAEHO CN(C)C[C@H](Cc1ccccc1)NC(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000351917266 146234488 /nfs/dbraw/zinc/23/44/88/146234488.db2.gz OFGJCAACQOQFAP-RBUKOAKNSA-N 1 3 331.504 2.540 10 0 EFAEHO CN(C)C[C@H](Cc1ccccc1)NC(=O)CC[C@H]1CCCC[N@H+]1C ZINC000351917266 146234489 /nfs/dbraw/zinc/23/44/89/146234489.db2.gz OFGJCAACQOQFAP-RBUKOAKNSA-N 1 3 331.504 2.540 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000355592962 147006815 /nfs/dbraw/zinc/00/68/15/147006815.db2.gz BQGCQZBWKLNXPW-ZIFCJYIRSA-N 1 3 346.519 2.679 10 0 EFAEHO CN(C)CCOc1cc(C[NH2+][C@@H]2CCCC[C@H]2[C@@H]2CCOC2)ccn1 ZINC000364390255 149140159 /nfs/dbraw/zinc/14/01/59/149140159.db2.gz WUUNSMLECMIAGK-CEXWTWQISA-N 1 3 347.503 2.707 10 0 EFAEHO C[C@@H]([NH2+][C@H]1CCN(C2CCN(C)CC2)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000374703730 151398381 /nfs/dbraw/zinc/39/83/81/151398381.db2.gz SJJTVJSUFXHOMM-LGYWMIHWSA-N 1 3 327.516 2.937 10 0 EFAEHO CCO[C@@H]1C[C@@H]([NH2+]CC2(N3CCCCC3)CCN(C)CC2)C12CCC2 ZINC000181827597 286279368 /nfs/dbraw/zinc/27/93/68/286279368.db2.gz SYHJNFHVDALQRD-RTBURBONSA-N 1 3 349.563 2.874 10 0 EFAEHO COc1ccc([C@H](N[C@@H]2C[C@@H](C)N(C3CC3)C2)[C@H]2CCC[NH2+]2)cc1 ZINC000422861050 286376245 /nfs/dbraw/zinc/37/62/45/286376245.db2.gz IWBFPHMJLVWQBT-FCNFAXOHSA-N 1 3 329.488 2.703 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCN(CC(C)C)C2)C12CCOCC2 ZINC000186425977 286388900 /nfs/dbraw/zinc/38/89/00/286388900.db2.gz LTEHKLOXUJKWBU-GBESFXJTSA-N 1 3 338.536 2.918 10 0 EFAEHO C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000338295888 287344148 /nfs/dbraw/zinc/34/41/48/287344148.db2.gz JJYHLYOHNQKCBJ-SJORKVTESA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000338295888 287344154 /nfs/dbraw/zinc/34/41/54/287344154.db2.gz JJYHLYOHNQKCBJ-SJORKVTESA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)N1CCCC12CCN(C)CC2 ZINC000352499809 287389653 /nfs/dbraw/zinc/38/96/53/287389653.db2.gz LTFHIESMENVUIC-IAGOWNOFSA-N 1 3 336.524 2.519 10 0 EFAEHO CCOC(=O)c1csc(CC[NH2+]C2CCN(C(C)(C)C)CC2)n1 ZINC000191559164 265267359 /nfs/dbraw/zinc/26/73/59/265267359.db2.gz CCFYFALZASBNGC-UHFFFAOYSA-N 1 3 339.505 2.715 10 0 EFAEHO CCC[N@H+](CCCN1CCN(C(C)C)CC1)C[C@@H]1CCCCO1 ZINC000192767268 265307368 /nfs/dbraw/zinc/30/73/68/265307368.db2.gz VIDHIJITAGBFMJ-IBGZPJMESA-N 1 3 325.541 2.684 10 0 EFAEHO CCC[N@@H+](CCCN1CCN(C(C)C)CC1)C[C@@H]1CCCCO1 ZINC000192767268 265307371 /nfs/dbraw/zinc/30/73/71/265307371.db2.gz VIDHIJITAGBFMJ-IBGZPJMESA-N 1 3 325.541 2.684 10 0 EFAEHO COC1(C[C@H](C)[NH2+]Cc2ccccc2CN2CC[C@H](O)C2)CCC1 ZINC000277240516 267136305 /nfs/dbraw/zinc/13/63/05/267136305.db2.gz ZSZISDSCSMJCBF-LPHOPBHVSA-N 1 3 332.488 2.691 10 0 EFAEHO C[C@]12C[C@H]1CCC[C@@H]2[NH2+]CCCN1CCN(c2ccncc2)CC1 ZINC000282376292 273553346 /nfs/dbraw/zinc/55/33/46/273553346.db2.gz WVZWXYCHEHQZKQ-HOJAQTOUSA-N 1 3 328.504 2.762 10 0 EFAEHO CCC[NH+]1CCN(c2ccccc2CN(C)CCn2cccn2)CC1 ZINC000125280615 276013143 /nfs/dbraw/zinc/01/31/43/276013143.db2.gz YTMAKSCPQALFNA-UHFFFAOYSA-N 1 3 341.503 2.547 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCC[C@@H](C)[N@H+](C)Cc2ccccc2)C1 ZINC000175361403 276177592 /nfs/dbraw/zinc/17/75/92/276177592.db2.gz WIRXHSXAQRDBPK-MJGOQNOKSA-N 1 3 346.519 2.681 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)C1 ZINC000175361403 276177593 /nfs/dbraw/zinc/17/75/93/276177593.db2.gz WIRXHSXAQRDBPK-MJGOQNOKSA-N 1 3 346.519 2.681 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H]2CCCCO2)CC1 ZINC000236801169 276263279 /nfs/dbraw/zinc/26/32/79/276263279.db2.gz SCRYCBKQKBUHMG-IBGZPJMESA-N 1 3 331.504 2.877 10 0 EFAEHO C[NH2+]Cc1ccccc1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000415919314 277287965 /nfs/dbraw/zinc/28/79/65/277287965.db2.gz HJIDVUVRFGHCJS-MOPGFXCFSA-N 1 3 338.455 2.973 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)N[C@H](CN(C)C)c1ccccc1 ZINC000120785477 277393522 /nfs/dbraw/zinc/39/35/22/277393522.db2.gz VKMTZRRSDFKIPF-RTBURBONSA-N 1 3 346.519 2.709 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)N[C@H](CN(C)C)c1ccccc1 ZINC000120785477 277393525 /nfs/dbraw/zinc/39/35/25/277393525.db2.gz VKMTZRRSDFKIPF-RTBURBONSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)NCCN1[C@H](C)CCC[C@H]1C ZINC000351890993 278161576 /nfs/dbraw/zinc/16/15/76/278161576.db2.gz WALKLTNEEOXPTR-BRWVUGGUSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@H](CNC(=O)CCN1CCc2ccccc2C1)[N@@H+]1CCCC[C@H]1C ZINC000416132307 278197868 /nfs/dbraw/zinc/19/78/68/278197868.db2.gz KSACXBREMKBVMG-QZTJIDSGSA-N 1 3 343.515 2.814 10 0 EFAEHO C[C@H](CNC(=O)CCN1CCc2ccccc2C1)[N@H+]1CCCC[C@H]1C ZINC000416132307 278197869 /nfs/dbraw/zinc/19/78/69/278197869.db2.gz KSACXBREMKBVMG-QZTJIDSGSA-N 1 3 343.515 2.814 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@@H]1CC[N@H+](C)[C@H](C)C1)N(C)Cc1ccccc1 ZINC000246185285 278270748 /nfs/dbraw/zinc/27/07/48/278270748.db2.gz MBSGHWWLXDXEMT-ZIFCJYIRSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1)N(C)Cc1ccccc1 ZINC000246185285 278270750 /nfs/dbraw/zinc/27/07/50/278270750.db2.gz MBSGHWWLXDXEMT-ZIFCJYIRSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@@H](NCC1CC[NH+](C[C@@H](O)c2ccccc2)CC1)c1cnccn1 ZINC000151916369 278341632 /nfs/dbraw/zinc/34/16/32/278341632.db2.gz FQOYYZHAJTYOFQ-OXQOHEQNSA-N 1 3 340.471 2.573 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)N(C)[C@@H]1CCN(C2CC2)C1)CC(C)C ZINC000349753346 279162155 /nfs/dbraw/zinc/16/21/55/279162155.db2.gz CKULADHYZFBUCK-MSOLQXFVSA-N 1 3 338.540 2.621 10 0 EFAEHO CN1CCC(C[NH2+][C@H]2CCCC23CCOCC3)(N2CCCCC2)CC1 ZINC000367078550 289880163 /nfs/dbraw/zinc/88/01/63/289880163.db2.gz QUVWWUDZXYATOD-IBGZPJMESA-N 1 3 349.563 2.876 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000129075607 293123090 /nfs/dbraw/zinc/12/30/90/293123090.db2.gz SGQBOWROLRUCOD-ROUUACIJSA-N 1 3 340.556 2.630 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NC[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000129075607 293123094 /nfs/dbraw/zinc/12/30/94/293123094.db2.gz SGQBOWROLRUCOD-ROUUACIJSA-N 1 3 340.556 2.630 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000129075816 293123464 /nfs/dbraw/zinc/12/34/64/293123464.db2.gz SGQBOWROLRUCOD-ZWKOTPCHSA-N 1 3 340.556 2.630 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NC[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000129075816 293123468 /nfs/dbraw/zinc/12/34/68/293123468.db2.gz SGQBOWROLRUCOD-ZWKOTPCHSA-N 1 3 340.556 2.630 10 0 EFAEHO CCCC[NH+]1CCC(NC(=O)N[C@H](CN(C)C)c2ccccc2)CC1 ZINC000158602472 293579186 /nfs/dbraw/zinc/57/91/86/293579186.db2.gz MDMLBWNDAGTLPS-LJQANCHMSA-N 1 3 346.519 2.853 10 0 EFAEHO C[NH+](C)CCc1ccc(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC000290709809 294163633 /nfs/dbraw/zinc/16/36/33/294163633.db2.gz KEZSUIYDCZNQHJ-HXUWFJFHSA-N 1 3 349.494 2.619 10 0 EFAEHO C[C@@H](Cc1ccc(O)cc1)NCc1ccncc1OCCC[NH+](C)C ZINC000293782944 295048998 /nfs/dbraw/zinc/04/89/98/295048998.db2.gz BXLNMDAKWZZVRD-INIZCTEOSA-N 1 3 343.471 2.839 10 0 EFAEHO COc1cc(OC)c(C[C@H](C)N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c(OC)c1 ZINC000295080285 295265532 /nfs/dbraw/zinc/26/55/32/295265532.db2.gz RYIDPVBSBTXTEU-ARFHVFGLSA-N 1 3 348.487 2.860 10 0 EFAEHO COc1cc(OC)c(C[C@H](C)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(OC)c1 ZINC000295080285 295265534 /nfs/dbraw/zinc/26/55/34/295265534.db2.gz RYIDPVBSBTXTEU-ARFHVFGLSA-N 1 3 348.487 2.860 10 0 EFAEHO NC[C@H]1CCCC[C@@H]1[NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000423085359 295267502 /nfs/dbraw/zinc/26/75/02/295267502.db2.gz KIUUIFWMOJKSRA-KKOFPSKJSA-N 1 3 333.442 2.899 10 0 EFAEHO COc1ccccc1N1CC[C@H]([NH2+][C@H](C)c2ccc(CN)nc2C)C1 ZINC000422870169 295372711 /nfs/dbraw/zinc/37/27/11/295372711.db2.gz BGMWIYBQZAYZEO-WBVHZDCISA-N 1 3 340.471 2.787 10 0 EFAEHO C[C@H](CN1CCCCC1)NC(=O)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000341454608 298562184 /nfs/dbraw/zinc/56/21/84/298562184.db2.gz CEEACSTUVVUEBT-MSOLQXFVSA-N 1 3 336.524 2.521 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)N(C)[C@@H](C)C2CCN(C)CC2)cc1 ZINC000418490860 299003756 /nfs/dbraw/zinc/00/37/56/299003756.db2.gz NLJDBSMECGQSAW-GJZGRUSLSA-N 1 3 332.492 2.578 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@H](C)N1CCc2ccccc2C1 ZINC000422710233 302588892 /nfs/dbraw/zinc/58/88/92/302588892.db2.gz FJTDLBPOOKPKAT-CVEARBPZSA-N 1 3 338.499 2.946 10 0 EFAEHO COc1c(Br)cccc1CNCC[C@@H]1CCC[NH2+]C1 ZINC000414841425 312056982 /nfs/dbraw/zinc/05/69/82/312056982.db2.gz ODABWMLJHVMHQP-LBPRGKRZSA-N 1 3 327.266 2.937 10 0 EFAEHO CC(C)N1CC[C@H](C[NH2+]C[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000304975743 311214323 /nfs/dbraw/zinc/21/43/23/311214323.db2.gz ZJWYLWMHIHMEJZ-DLBZAZTESA-N 1 3 339.524 2.953 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)C1(C)C ZINC000397600863 311960653 /nfs/dbraw/zinc/96/06/53/311960653.db2.gz UCEDPIAHYWWOEP-RBUKOAKNSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNCc2ccccc2N2CCOCC2)cc1 ZINC000414804949 312053483 /nfs/dbraw/zinc/05/34/83/312053483.db2.gz FQUCZNVCIYLJBQ-INIZCTEOSA-N 1 3 325.456 2.833 10 0 EFAEHO Clc1ccc(OC[C@@H]2CCCO2)c(CNCC[C@@H]2CC[NH2+]C2)c1 ZINC000414824526 312054609 /nfs/dbraw/zinc/05/46/09/312054609.db2.gz AUMPCARJUJLLIZ-YOEHRIQHSA-N 1 3 338.879 2.987 10 0 EFAEHO C[C@@H]1CNCC[C@@H]1[NH2+]Cc1ccc(-n2ccc(C(F)(F)F)n2)cc1 ZINC000414938271 312066769 /nfs/dbraw/zinc/06/67/69/312066769.db2.gz IGHBSIABNIRBBO-DOMZBBRYSA-N 1 3 338.377 2.979 10 0 EFAEHO C[C@@H](CCc1ccc(OC(F)F)cc1)[NH2+]C[C@H]1CNCCCO1 ZINC000415038443 312081588 /nfs/dbraw/zinc/08/15/88/312081588.db2.gz LZKPUGASULQKAI-XJKSGUPXSA-N 1 3 328.403 2.577 10 0 EFAEHO C[C@@H](CCc1ccc(OC(F)F)cc1)NC[C@H]1C[NH2+]CCCO1 ZINC000415038443 312081589 /nfs/dbraw/zinc/08/15/89/312081589.db2.gz LZKPUGASULQKAI-XJKSGUPXSA-N 1 3 328.403 2.577 10 0 EFAEHO C[NH2+]Cc1cccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c1 ZINC000415958098 312185433 /nfs/dbraw/zinc/18/54/33/312185433.db2.gz KTYWMOXSOLHCQU-RTBURBONSA-N 1 3 338.455 2.973 10 0 EFAEHO O=C(NCCC[NH2+]C1CCCCC1)Nc1ccc2c(c1F)CCNC2 ZINC000415965137 312186810 /nfs/dbraw/zinc/18/68/10/312186810.db2.gz ZBCGWLROTFFWKN-UHFFFAOYSA-N 1 3 348.466 2.905 10 0 EFAEHO O=C(NCCCCC[NH+]1CCCC1)Nc1ccc2c(c1F)CCNC2 ZINC000415971901 312187877 /nfs/dbraw/zinc/18/78/77/312187877.db2.gz KEVMIVLAFZUYAE-UHFFFAOYSA-N 1 3 348.466 2.859 10 0 EFAEHO CN(C(=O)Nc1ccc(C[NH3+])cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000415983376 312190328 /nfs/dbraw/zinc/19/03/28/312190328.db2.gz ZJOCJRAYRFKCPJ-LJQANCHMSA-N 1 3 338.455 2.884 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)NC[C@@H](N)c2ccccc2)c1 ZINC000417408914 312220698 /nfs/dbraw/zinc/22/06/98/312220698.db2.gz UYEJIMKJGDYZCY-LJQANCHMSA-N 1 3 340.471 2.638 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@@H](N)c2ccccc2)c1 ZINC000417408914 312220700 /nfs/dbraw/zinc/22/07/00/312220700.db2.gz UYEJIMKJGDYZCY-LJQANCHMSA-N 1 3 340.471 2.638 10 0 EFAEHO CC[C@@H](C)[N@H+](C)CCNC(=O)NC[C@H](N)c1ccc(C(C)C)cc1 ZINC000417441147 312224148 /nfs/dbraw/zinc/22/41/48/312224148.db2.gz AKBTZZOJSYCNHG-QAPCUYQASA-N 1 3 334.508 2.839 10 0 EFAEHO CC[C@@H](C)[N@@H+](C)CCNC(=O)NC[C@H](N)c1ccc(C(C)C)cc1 ZINC000417441147 312224151 /nfs/dbraw/zinc/22/41/51/312224151.db2.gz AKBTZZOJSYCNHG-QAPCUYQASA-N 1 3 334.508 2.839 10 0 EFAEHO C[C@H](CCC[NH3+])NC(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1 ZINC000417728048 312262388 /nfs/dbraw/zinc/26/23/88/312262388.db2.gz AHMDJWOEJVTQRF-IIAWOOMASA-N 1 3 338.521 2.558 10 0 EFAEHO CC1(C)CCC[NH2+][C@H]1C(=O)N[C@@H](CN)c1ccc2ccccc2c1 ZINC000417826930 312276832 /nfs/dbraw/zinc/27/68/32/312276832.db2.gz NIJGZNMVAVBLFV-ROUUACIJSA-N 1 3 325.456 2.734 10 0 EFAEHO C[C@@H](CCCC[NH3+])NC(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000418035667 312313759 /nfs/dbraw/zinc/31/37/59/312313759.db2.gz AVXPBOOMQZQRNY-PXNSSMCTSA-N 1 3 346.519 2.858 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@@H](c1cncc(Br)c1)C1CC1 ZINC000423109652 312411866 /nfs/dbraw/zinc/41/18/66/312411866.db2.gz STZRZALXSZZMMG-LSDHHAIUSA-N 1 3 342.281 2.639 10 0 EFAEHO COc1ccc([C@H](NCc2ccc3c(c2)CNC3)[C@H]2CCC[NH2+]2)cc1 ZINC000423393125 312419255 /nfs/dbraw/zinc/41/92/55/312419255.db2.gz QLCQFDORVYNKFT-RTWAWAEBSA-N 1 3 337.467 2.881 10 0 EFAEHO COc1ccc([C@@H](NCc2ccc3c(c2)CNC3)[C@@H]2CCC[NH2+]2)cc1 ZINC000423393123 312419267 /nfs/dbraw/zinc/41/92/67/312419267.db2.gz QLCQFDORVYNKFT-LEWJYISDSA-N 1 3 337.467 2.881 10 0 EFAEHO C[C@@H](c1ccncc1)N1CCC(NC(=O)[C@@H]2[NH2+]CCCC2(C)C)CC1 ZINC000423850269 312470944 /nfs/dbraw/zinc/47/09/44/312470944.db2.gz POAVHYRMWWWOLK-YJBOKZPZSA-N 1 3 344.503 2.501 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H]2CC[C@@H](C)O2)CC1 ZINC000453638102 312923207 /nfs/dbraw/zinc/92/32/07/312923207.db2.gz ZEGFQBIYGZNOOA-IEBWSBKVSA-N 1 3 331.504 2.876 10 0 EFAEHO CN(Cc1ccccc1)C1(CNC(=O)CC2CC[NH+](C)CC2)CCC1 ZINC000456125458 313032710 /nfs/dbraw/zinc/03/27/10/313032710.db2.gz VSKHMHLSICJUSU-UHFFFAOYSA-N 1 3 343.515 2.889 10 0 EFAEHO O[C@H](CC1CCCC1)CN1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000470993886 313138545 /nfs/dbraw/zinc/13/85/45/313138545.db2.gz DFJZCMIWWITLNS-QHAWAJNXSA-N 1 3 328.500 2.991 10 0 EFAEHO O[C@H](CC1CCCC1)CN1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000470993886 313138550 /nfs/dbraw/zinc/13/85/50/313138550.db2.gz DFJZCMIWWITLNS-QHAWAJNXSA-N 1 3 328.500 2.991 10 0 EFAEHO O[C@@H](CC1CCCC1)CN1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000470993885 313139177 /nfs/dbraw/zinc/13/91/77/313139177.db2.gz DFJZCMIWWITLNS-HBMCJLEFSA-N 1 3 328.500 2.991 10 0 EFAEHO O[C@@H](CC1CCCC1)CN1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000470993885 313139181 /nfs/dbraw/zinc/13/91/81/313139181.db2.gz DFJZCMIWWITLNS-HBMCJLEFSA-N 1 3 328.500 2.991 10 0 EFAEHO CC(C)C[C@H]([NH2+][C@H]1CS[C@H](C(C)(C)C)C1)C(=O)NCCN(C)C ZINC000488436752 313484369 /nfs/dbraw/zinc/48/43/69/313484369.db2.gz VGWXEHIXCNCTMA-PMPSAXMXSA-N 1 3 343.581 2.589 10 0 EFAEHO COc1ccccc1-c1ncc(CNCC2(C)CC[NH+](C)CC2)cn1 ZINC000491213777 313716953 /nfs/dbraw/zinc/71/69/53/313716953.db2.gz OVPNMIQXNCPWMT-UHFFFAOYSA-N 1 3 340.471 2.974 10 0 EFAEHO N[C@H](CC(=O)N1CC[C@H](c2ccc(F)cc2)[C@@H]([NH3+])C1)c1ccccc1 ZINC000519398287 315859865 /nfs/dbraw/zinc/85/98/65/315859865.db2.gz NJMZAOBGXRSYFD-QRVBRYPASA-N 1 3 341.430 2.559 10 0 EFAEHO O=C(C1CCN(Cc2ccccc2)CC1)N1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000519823863 315919606 /nfs/dbraw/zinc/91/96/06/315919606.db2.gz NZDCXAIPXSJGNL-NRFANRHFSA-N 1 3 341.499 2.501 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)CNC1CC[NH+](C2CC2)CC1 ZINC000521426425 316022412 /nfs/dbraw/zinc/02/24/12/316022412.db2.gz ADYKBIMSZIMXFK-SFHVURJKSA-N 1 3 332.488 2.766 10 0 EFAEHO CN(C)CCOc1ccccc1C(=O)NCC(C)(C)[NH+]1CCCCC1 ZINC000523302701 316115652 /nfs/dbraw/zinc/11/56/52/316115652.db2.gz WOFLSEVOUQRVOY-UHFFFAOYSA-N 1 3 347.503 2.621 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)[NH+]1CCCC1 ZINC000524188934 316149437 /nfs/dbraw/zinc/14/94/37/316149437.db2.gz OERJUPQWNCHNSQ-AEFFLSMTSA-N 1 3 347.478 2.638 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCC1)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC000530030197 317032455 /nfs/dbraw/zinc/03/24/55/317032455.db2.gz YLMSCUURIGGHQX-OALUTQOASA-N 1 3 333.520 2.917 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCC1)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC000530030197 317032459 /nfs/dbraw/zinc/03/24/59/317032459.db2.gz YLMSCUURIGGHQX-OALUTQOASA-N 1 3 333.520 2.917 10 0 EFAEHO COc1cc(C)c(CN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)cc1OC ZINC000530249057 317091157 /nfs/dbraw/zinc/09/11/57/317091157.db2.gz TVBRCWVRZOYJQE-GOSISDBHSA-N 1 3 348.487 2.603 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)CCN(C)c2cc[nH+]cc2)N(C)C)cc1 ZINC000540929002 317759014 /nfs/dbraw/zinc/75/90/14/317759014.db2.gz MSJSMJHLGUIFDN-LJQANCHMSA-N 1 3 340.471 2.635 10 0 EFAEHO CN(C)C[C@H](Cc1ccccc1)NC(=O)CC[N@H+](C)C1CCCCC1 ZINC000547733832 318035434 /nfs/dbraw/zinc/03/54/34/318035434.db2.gz ULRWLLADRVURBS-IBGZPJMESA-N 1 3 345.531 2.930 10 0 EFAEHO CN(C)C[C@H](Cc1ccccc1)NC(=O)CC[N@@H+](C)C1CCCCC1 ZINC000547733832 318035437 /nfs/dbraw/zinc/03/54/37/318035437.db2.gz ULRWLLADRVURBS-IBGZPJMESA-N 1 3 345.531 2.930 10 0 EFAEHO C[C@@H]([NH2+]CCCCN1C[C@@H](C)O[C@@H](C)C1)c1cn2ccccc2n1 ZINC000551308600 318205684 /nfs/dbraw/zinc/20/56/84/318205684.db2.gz HWDGIVKHMYKPKK-IXDOHACOSA-N 1 3 330.476 2.874 10 0 EFAEHO CCc1ccc([C@@H](CNC(=O)c2ccccc2CC[NH3+])N(C)C)cc1 ZINC000563336114 318769915 /nfs/dbraw/zinc/76/99/15/318769915.db2.gz DFIKICJXYCROJW-HXUWFJFHSA-N 1 3 339.483 2.783 10 0 EFAEHO CCC[NH+](CCC)CCCC(=O)N1CCc2ccccc2[C@@H]1CN ZINC000566295621 319059412 /nfs/dbraw/zinc/05/94/12/319059412.db2.gz BBGZKXYHAWLFGO-IBGZPJMESA-N 1 3 331.504 2.973 10 0 EFAEHO N[C@H]1CCC[C@@H]([NH2+]C2CCN(c3ccc(C(F)(F)F)cn3)CC2)C1 ZINC000566480813 319082418 /nfs/dbraw/zinc/08/24/18/319082418.db2.gz AWUMTZZYEHJIFY-DZGCQCFKSA-N 1 3 342.409 2.929 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN[C@H](C)C[NH+]1CCC(C)CC1 ZINC000569259515 319364429 /nfs/dbraw/zinc/36/44/29/319364429.db2.gz CHMDSIRLXVYAAB-MRXNPFEDSA-N 1 3 327.476 2.786 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1C[NH2+][C@H](C)CN1CCC(C)CC1 ZINC000569259515 319364431 /nfs/dbraw/zinc/36/44/31/319364431.db2.gz CHMDSIRLXVYAAB-MRXNPFEDSA-N 1 3 327.476 2.786 10 0 EFAEHO O=C(NCCN[C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)c1ccccc1Cl ZINC000570320818 319465072 /nfs/dbraw/zinc/46/50/72/319465072.db2.gz ACMKCPMVKSDPFE-CGTJXYLNSA-N 1 3 349.906 2.970 10 0 EFAEHO CC(C)(CNC(=O)Nc1ccc2c(c1F)CCNC2)[NH+]1CCCCC1 ZINC000574140164 319833304 /nfs/dbraw/zinc/83/33/04/319833304.db2.gz MFKQFLKFGXVUFL-UHFFFAOYSA-N 1 3 348.466 2.857 10 0 EFAEHO C[C@@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@@H+]1CCCC[C@H]1C ZINC000576610231 320032554 /nfs/dbraw/zinc/03/25/54/320032554.db2.gz MYOHRGWQKDCOEA-KGLIPLIRSA-N 1 3 348.466 2.856 10 0 EFAEHO C[C@@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@H+]1CCCC[C@H]1C ZINC000576610231 320032557 /nfs/dbraw/zinc/03/25/57/320032557.db2.gz MYOHRGWQKDCOEA-KGLIPLIRSA-N 1 3 348.466 2.856 10 0 EFAEHO CC(C)Oc1ccc([C@@H](CNC(=O)C[N@@H+]2CC[C@H](C)C2)N(C)C)cc1 ZINC000576956099 320064597 /nfs/dbraw/zinc/06/45/97/320064597.db2.gz XBYJAYZBIDXCGO-QFBILLFUSA-N 1 3 347.503 2.535 10 0 EFAEHO CC(C)Oc1ccc([C@@H](CNC(=O)C[N@H+]2CC[C@H](C)C2)N(C)C)cc1 ZINC000576956099 320064599 /nfs/dbraw/zinc/06/45/99/320064599.db2.gz XBYJAYZBIDXCGO-QFBILLFUSA-N 1 3 347.503 2.535 10 0 EFAEHO O=C(NCCN1CCCC1)c1ccc(C[NH2+][C@H]2CCCC23CC3)cc1 ZINC000577231946 320091732 /nfs/dbraw/zinc/09/17/32/320091732.db2.gz UICWRRPZMMHZGQ-IBGZPJMESA-N 1 3 341.499 2.935 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)C[NH2+]C[C@@H]1CCN(C2CC2)C1 ZINC000577485337 320115194 /nfs/dbraw/zinc/11/51/94/320115194.db2.gz SCVLNRVHQINMIB-WMZOPIPTSA-N 1 3 332.488 2.624 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)CNC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000577485337 320115196 /nfs/dbraw/zinc/11/51/96/320115196.db2.gz SCVLNRVHQINMIB-WMZOPIPTSA-N 1 3 332.488 2.624 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)CNC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000577485337 320115198 /nfs/dbraw/zinc/11/51/98/320115198.db2.gz SCVLNRVHQINMIB-WMZOPIPTSA-N 1 3 332.488 2.624 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[NH2+]C[C@@H]1CCN(C2CC2)C1 ZINC000577485335 320115371 /nfs/dbraw/zinc/11/53/71/320115371.db2.gz SCVLNRVHQINMIB-FUHWJXTLSA-N 1 3 332.488 2.624 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)CNC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000577485335 320115373 /nfs/dbraw/zinc/11/53/73/320115373.db2.gz SCVLNRVHQINMIB-FUHWJXTLSA-N 1 3 332.488 2.624 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)CNC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000577485335 320115376 /nfs/dbraw/zinc/11/53/76/320115376.db2.gz SCVLNRVHQINMIB-FUHWJXTLSA-N 1 3 332.488 2.624 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2cccc3c2CCNC3)[C@@H](C)C1 ZINC000578048758 320168541 /nfs/dbraw/zinc/16/85/41/320168541.db2.gz IJAOGXWASXTRJE-KSSFIOAISA-N 1 3 330.476 2.526 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2cccc3c2CCNC3)[C@@H](C)C1 ZINC000578048758 320168542 /nfs/dbraw/zinc/16/85/42/320168542.db2.gz IJAOGXWASXTRJE-KSSFIOAISA-N 1 3 330.476 2.526 10 0 EFAEHO CC[NH+](CC)CCOc1ccc(NC(=O)[C@@]2(C)CCCCN2)cc1 ZINC000180983252 323223847 /nfs/dbraw/zinc/22/38/47/323223847.db2.gz VLTXBWITMIDGRJ-LJQANCHMSA-N 1 3 333.476 2.878 10 0 EFAEHO N[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000579944641 324063242 /nfs/dbraw/zinc/06/32/42/324063242.db2.gz LMJZZAKBOMERCC-RTXFEEFZSA-N 1 3 348.800 2.802 10 0 EFAEHO N[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000579944642 324063326 /nfs/dbraw/zinc/06/33/26/324063326.db2.gz LMJZZAKBOMERCC-UHTWSYAYSA-N 1 3 348.800 2.802 10 0 EFAEHO O=C1CCCCN1CC1CCN(Cc2ccc3c(c2)C[NH2+]CC3)CC1 ZINC000580204682 324120609 /nfs/dbraw/zinc/12/06/09/324120609.db2.gz AAKDQJROWSUNAS-UHFFFAOYSA-N 1 3 341.499 2.557 10 0 EFAEHO Cc1c(OCCC[NH+]2CCCC2)cc(Cl)cc1N1CCNCC1 ZINC000148567604 473319505 /nfs/dbraw/zinc/31/95/05/473319505.db2.gz HMKHZGQQZUYGOX-UHFFFAOYSA-N 1 3 337.895 2.923 10 0 EFAEHO C[C@H]1CN(CCCC[NH2+]Cc2ccnn2CC2CCC2)C[C@H](C)O1 ZINC000631075704 479878987 /nfs/dbraw/zinc/87/89/87/479878987.db2.gz SQQDYRTXSHIQMT-IRXDYDNUSA-N 1 3 334.508 2.662 10 0 EFAEHO Cc1cc(Br)cc(C)c1CN[C@@H]1CCOC[C@@H]1[C@H](C)[NH3+] ZINC000422833143 476800826 /nfs/dbraw/zinc/80/08/26/476800826.db2.gz YPTQHQWCZIDDBO-APHBMKBZSA-N 1 3 341.293 2.908 10 0 EFAEHO c1ccc(CN2CC[C@]3(CC[N@@H+](CCOC4CCOCC4)C3)C2)cc1 ZINC000625422555 479914912 /nfs/dbraw/zinc/91/49/12/479914912.db2.gz GQOGCXKLEDHRGZ-NRFANRHFSA-N 1 3 344.499 2.780 10 0 EFAEHO c1ccc(CN2CC[C@]3(CC[N@H+](CCOC4CCOCC4)C3)C2)cc1 ZINC000625422555 479914918 /nfs/dbraw/zinc/91/49/18/479914918.db2.gz GQOGCXKLEDHRGZ-NRFANRHFSA-N 1 3 344.499 2.780 10 0 EFAEHO OCCNCCC[NH2+]Cc1cccc(OCc2ccc(Cl)cc2)c1 ZINC000013732881 471841672 /nfs/dbraw/zinc/84/16/72/471841672.db2.gz GNIIDUPRBKDUIW-UHFFFAOYSA-N 1 3 348.874 2.981 10 0 EFAEHO CC(C)[C@@H](NCC(=O)NC1CC[NH+](C2CC2)CC1)c1ccccc1 ZINC000042509838 472141499 /nfs/dbraw/zinc/14/14/99/472141499.db2.gz IQLHDMKNWSGQFJ-HXUWFJFHSA-N 1 3 329.488 2.716 10 0 EFAEHO C[C@H](CNC(=O)N[C@H](CN(C)C)c1ccccc1)C[NH+]1CCCCC1 ZINC000057042584 472377403 /nfs/dbraw/zinc/37/74/03/472377403.db2.gz ZOXPOYDDZKBFPY-IEBWSBKVSA-N 1 3 346.519 2.711 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCc2cccnc2)CC1 ZINC000088678795 472379780 /nfs/dbraw/zinc/37/97/80/472379780.db2.gz UQNGHDLUGZZMSY-UHFFFAOYSA-N 1 3 338.499 2.946 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@](C)(O)C(C)C)CC1 ZINC000088720519 472381428 /nfs/dbraw/zinc/38/14/28/472381428.db2.gz ARAPIKXBKIUDPW-HXUWFJFHSA-N 1 3 333.520 2.715 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H]2CCC[C@H](O)C2)CC1 ZINC000088728680 472382556 /nfs/dbraw/zinc/38/25/56/472382556.db2.gz HUMDZQQNMYORPW-QUCCMNQESA-N 1 3 345.531 2.859 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2cccc(CN(C)C)c2)[C@H](C)C1 ZINC000128405124 472446946 /nfs/dbraw/zinc/44/69/46/472446946.db2.gz UNIFPVYSYVCCAB-APWZRJJASA-N 1 3 346.519 2.620 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NCc2cccc(CN(C)C)c2)[C@H](C)C1 ZINC000128405124 472446949 /nfs/dbraw/zinc/44/69/49/472446949.db2.gz UNIFPVYSYVCCAB-APWZRJJASA-N 1 3 346.519 2.620 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N[C@@H]2CCCN(C)C2)[NH+]2CCCC2)cc1 ZINC000622452043 479990786 /nfs/dbraw/zinc/99/07/86/479990786.db2.gz AGNVOXMPRGCKST-MOPGFXCFSA-N 1 3 344.503 2.525 10 0 EFAEHO CC1(C)CCCN1CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000077383026 472516829 /nfs/dbraw/zinc/51/68/29/472516829.db2.gz WOGKPVLFQFGUBK-UHFFFAOYSA-N 1 3 329.488 2.773 10 0 EFAEHO CC[NH+](CC)[C@@H](C)CNC(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000077793524 472615380 /nfs/dbraw/zinc/61/53/80/472615380.db2.gz JXKLSFICCORXOB-HKUYNNGSSA-N 1 3 346.519 2.853 10 0 EFAEHO CC[NH+](CC)CC1CCN(C[C@@H](O)COc2ccc(C)cc2)CC1 ZINC000047978413 472791422 /nfs/dbraw/zinc/79/14/22/472791422.db2.gz CDTKILKURDCXOU-LJQANCHMSA-N 1 3 334.504 2.789 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)N2CCCN(C(C)C)CC2)CC1 ZINC000073334378 472798577 /nfs/dbraw/zinc/79/85/77/472798577.db2.gz SPUHTIVEQSCNSW-UHFFFAOYSA-N 1 3 344.503 2.549 10 0 EFAEHO CC(C)C[C@@H](C[NH+](C)C)NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000079121253 472823498 /nfs/dbraw/zinc/82/34/98/472823498.db2.gz FDFBSWQPXJJMEP-ROUUACIJSA-N 1 3 334.508 2.565 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NC[C@H](C)N2CCC[C@H](C)C2)CC1 ZINC000073658881 472848024 /nfs/dbraw/zinc/84/80/24/472848024.db2.gz NZAYZPMAIYJJAX-IRXDYDNUSA-N 1 3 338.540 2.528 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[NH+](C(C)(C)CC(C)(C)C)CC1)N(C)C ZINC000622662569 480013870 /nfs/dbraw/zinc/01/38/70/480013870.db2.gz MQUUGCYYWUVCGS-MRXNPFEDSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NCc1cccc(C[NH+](C)C)c1 ZINC000079451463 472867359 /nfs/dbraw/zinc/86/73/59/472867359.db2.gz LXVXUWSECQITDL-GOSISDBHSA-N 1 3 334.508 2.524 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NCCN(C)Cc2ccccc2)CC1 ZINC000073820843 472883948 /nfs/dbraw/zinc/88/39/48/472883948.db2.gz DUHCTJKIQUMYBR-UHFFFAOYSA-N 1 3 346.519 2.540 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@@]3(CCOC3)C2)CC1 ZINC000093820310 473151070 /nfs/dbraw/zinc/15/10/70/473151070.db2.gz QGZHSBXQTGPBQC-OAQYLSRUSA-N 1 3 343.515 2.831 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@@]3(CCOC3)C2)CC1 ZINC000093820310 473151075 /nfs/dbraw/zinc/15/10/75/473151075.db2.gz QGZHSBXQTGPBQC-OAQYLSRUSA-N 1 3 343.515 2.831 10 0 EFAEHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2ccc(OC)c(Cn3cccn3)c2)C1 ZINC000163290291 473431066 /nfs/dbraw/zinc/43/10/66/473431066.db2.gz OVEOFSNYGVWLMN-IRXDYDNUSA-N 1 3 342.487 2.932 10 0 EFAEHO CC(C)C[C@@H](CNC(=O)c1cccc(CN2CCCC2)c1)[NH+](C)C ZINC000114377764 473458095 /nfs/dbraw/zinc/45/80/95/473458095.db2.gz XHEVMJLGOWJGRT-IBGZPJMESA-N 1 3 331.504 2.989 10 0 EFAEHO CC[NH+](CC)Cc1ccc(CNC(=O)N2CCN3CCC[C@@H]3C2)cc1 ZINC000171899223 473477609 /nfs/dbraw/zinc/47/76/09/473477609.db2.gz STWVMNSPIOZRPV-LJQANCHMSA-N 1 3 344.503 2.518 10 0 EFAEHO CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCN2CCC[C@H]2C1 ZINC000171899254 473477689 /nfs/dbraw/zinc/47/76/89/473477689.db2.gz LYZOEYPDKHXCBU-IBGZPJMESA-N 1 3 344.503 2.518 10 0 EFAEHO Cn1cc(N2CCC[C@@H](NC3CC[NH+](C4CCCCC4)CC3)C2)cn1 ZINC000166458318 473527113 /nfs/dbraw/zinc/52/71/13/473527113.db2.gz RPDDFFLUOFJVOP-GOSISDBHSA-N 1 3 345.535 2.776 10 0 EFAEHO Cn1cc(N2CCC[C@@H]([NH2+]C3CCN(C4CCCCC4)CC3)C2)cn1 ZINC000166458318 473527120 /nfs/dbraw/zinc/52/71/20/473527120.db2.gz RPDDFFLUOFJVOP-GOSISDBHSA-N 1 3 345.535 2.776 10 0 EFAEHO C[C@@H]1C[C@@H](c2ccccc2)CN1CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000115553437 473580645 /nfs/dbraw/zinc/58/06/45/473580645.db2.gz JZBAPQGKYQZAMD-SJLPKXTDSA-N 1 3 341.499 2.607 10 0 EFAEHO CC[NH+](CC)[C@@H]1CCN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)C1 ZINC000179267441 473666243 /nfs/dbraw/zinc/66/62/43/473666243.db2.gz NOAGADXWKGCSQE-GUDVDZBRSA-N 1 3 344.503 2.558 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H](C)c1cccc(Cl)c1 ZINC000617505591 480246143 /nfs/dbraw/zinc/24/61/43/480246143.db2.gz JDOLPWAYODBCHS-GJZGRUSLSA-N 1 3 339.911 2.832 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H](C)c1cccc(Cl)c1 ZINC000617505591 480246147 /nfs/dbraw/zinc/24/61/47/480246147.db2.gz JDOLPWAYODBCHS-GJZGRUSLSA-N 1 3 339.911 2.832 10 0 EFAEHO CCCCN1CCC([NH2+]Cc2ccc3c(c2)sc(=O)n3C)CC1 ZINC000192506885 473687115 /nfs/dbraw/zinc/68/71/15/473687115.db2.gz XPTDWFNJUHUQAI-UHFFFAOYSA-N 1 3 333.501 2.954 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cccc(Cl)c1Cl ZINC000617503778 480246974 /nfs/dbraw/zinc/24/69/74/480246974.db2.gz YVVXUKBLIYCYHH-LBPRGKRZSA-N 1 3 346.302 2.995 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cccc(Cl)c1Cl ZINC000617503778 480246977 /nfs/dbraw/zinc/24/69/77/480246977.db2.gz YVVXUKBLIYCYHH-LBPRGKRZSA-N 1 3 346.302 2.995 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3[NH2+]2)N(C)C)cc1 ZINC000262667376 473708673 /nfs/dbraw/zinc/70/86/73/473708673.db2.gz PYWCESXFKCNVOT-RDGPPVDQSA-N 1 3 329.488 2.635 10 0 EFAEHO CN(C)CC1(C[NH2+]Cc2ccc3c(c2)sc(=O)n3C)CCCC1 ZINC000192727256 473714858 /nfs/dbraw/zinc/71/48/58/473714858.db2.gz NZLYZIFLWICCHF-UHFFFAOYSA-N 1 3 333.501 2.812 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@H](CNC(=O)CCN2CCc3ccccc3C2)C1 ZINC000616999344 480052267 /nfs/dbraw/zinc/05/22/67/480052267.db2.gz FIQPDUJWXUWYOW-QGZVFWFLSA-N 1 3 343.515 2.671 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)CCN2CCc3ccccc3C2)C1 ZINC000616999344 480052269 /nfs/dbraw/zinc/05/22/69/480052269.db2.gz FIQPDUJWXUWYOW-QGZVFWFLSA-N 1 3 343.515 2.671 10 0 EFAEHO CC(C)[NH+](CCNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)C(C)C ZINC000245610994 473727784 /nfs/dbraw/zinc/72/77/84/473727784.db2.gz BNIPALYSHWMSHB-MOPGFXCFSA-N 1 3 346.519 2.850 10 0 EFAEHO CCCNC(=O)CCN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245652501 473732496 /nfs/dbraw/zinc/73/24/96/473732496.db2.gz CUOLZGTYADEIKJ-REPLKXPHSA-N 1 3 329.488 2.688 10 0 EFAEHO CCCNC(=O)CCN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245652501 473732504 /nfs/dbraw/zinc/73/25/04/473732504.db2.gz CUOLZGTYADEIKJ-REPLKXPHSA-N 1 3 329.488 2.688 10 0 EFAEHO C[C@H]([NH2+]CC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccnn1C ZINC000192838563 473735821 /nfs/dbraw/zinc/73/58/21/473735821.db2.gz PAUAVTSJWVQWEG-JXFKEZNVSA-N 1 3 342.487 2.516 10 0 EFAEHO CCC[C@H](C(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)N(C)C ZINC000245918942 473762239 /nfs/dbraw/zinc/76/22/39/473762239.db2.gz WMYWWYPUYAPJIR-ZMSDIMECSA-N 1 3 337.533 2.978 10 0 EFAEHO CCC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)N(C)C ZINC000245918942 473762248 /nfs/dbraw/zinc/76/22/48/473762248.db2.gz WMYWWYPUYAPJIR-ZMSDIMECSA-N 1 3 337.533 2.978 10 0 EFAEHO CCC[C@H](C(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)N(C)C ZINC000245918934 473762650 /nfs/dbraw/zinc/76/26/50/473762650.db2.gz WMYWWYPUYAPJIR-BFYDXBDKSA-N 1 3 337.533 2.978 10 0 EFAEHO CCC[C@H](C(=O)NC[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1)N(C)C ZINC000245918934 473762658 /nfs/dbraw/zinc/76/26/58/473762658.db2.gz WMYWWYPUYAPJIR-BFYDXBDKSA-N 1 3 337.533 2.978 10 0 EFAEHO CN1CC[C@H]([NH2+]CC2(N3CCSCC3)CCCC2)CC1(C)C ZINC000623357044 480247802 /nfs/dbraw/zinc/24/78/02/480247802.db2.gz XBORSKPBNHSKJY-INIZCTEOSA-N 1 3 325.566 2.810 10 0 EFAEHO C[C@@H]1CN(CC2CC[NH+](C[C@@](C)(O)c3ccccc3)CC2)C[C@H](C)O1 ZINC000246199717 473796932 /nfs/dbraw/zinc/79/69/32/473796932.db2.gz LMVANNWIGARSIW-LVCYWYKZSA-N 1 3 346.515 2.715 10 0 EFAEHO COc1cccc(NC(=O)CCN2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000173307155 473800888 /nfs/dbraw/zinc/80/08/88/473800888.db2.gz DYHQJNZHXBZJSP-UHFFFAOYSA-N 1 3 345.487 2.832 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NC1CC[NH+](C(C)(C)C)CC1 ZINC000193836263 473813323 /nfs/dbraw/zinc/81/33/23/473813323.db2.gz KWMLJTOSSGAXOU-INIZCTEOSA-N 1 3 326.529 2.525 10 0 EFAEHO CC[C@@H]1CCCCN1CCNC(=O)N(C)[C@H]1CC[N@H+](CC)C[C@H]1C ZINC000246309876 473822781 /nfs/dbraw/zinc/82/27/81/473822781.db2.gz BDJUPJCUGKRVMP-KURKYZTESA-N 1 3 338.540 2.623 10 0 EFAEHO CC[C@@H]1CCCCN1CCNC(=O)N(C)[C@H]1CC[N@@H+](CC)C[C@H]1C ZINC000246309876 473822784 /nfs/dbraw/zinc/82/27/84/473822784.db2.gz BDJUPJCUGKRVMP-KURKYZTESA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(Cl)cc1Cl ZINC000617503498 480248666 /nfs/dbraw/zinc/24/86/66/480248666.db2.gz LQWNXOXQFWRNHA-LBPRGKRZSA-N 1 3 346.302 2.995 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(Cl)cc1Cl ZINC000617503498 480248672 /nfs/dbraw/zinc/24/86/72/480248672.db2.gz LQWNXOXQFWRNHA-LBPRGKRZSA-N 1 3 346.302 2.995 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)NC[C@@H]2CCN2C(C)(C)C)CC1 ZINC000617013509 480064669 /nfs/dbraw/zinc/06/46/69/480064669.db2.gz VRSBMZAQMSMXNP-KRWDZBQOSA-N 1 3 344.503 2.595 10 0 EFAEHO CCN1CC[C@H](C[NH2+]C[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000246937745 474010323 /nfs/dbraw/zinc/01/03/23/474010323.db2.gz PCEBWMWZKLHUOZ-HZPDHXFCSA-N 1 3 325.497 2.565 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N(C)[C@@H]2CC[N@H+](C)[C@H](C)C2)N(C)C)cc1 ZINC000174384462 474031816 /nfs/dbraw/zinc/03/18/16/474031816.db2.gz XARPJSCJBFDFGW-QRQLOZEOSA-N 1 3 346.519 2.722 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)N(C)C)cc1 ZINC000174384462 474031821 /nfs/dbraw/zinc/03/18/21/474031821.db2.gz XARPJSCJBFDFGW-QRQLOZEOSA-N 1 3 346.519 2.722 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N(C)[C@H]2CC[N@H+](C)[C@H](C)C2)N(C)C)cc1 ZINC000174384488 474032278 /nfs/dbraw/zinc/03/22/78/474032278.db2.gz XARPJSCJBFDFGW-NEWSRXKRSA-N 1 3 346.519 2.722 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)N(C)C)cc1 ZINC000174384488 474032286 /nfs/dbraw/zinc/03/22/86/474032286.db2.gz XARPJSCJBFDFGW-NEWSRXKRSA-N 1 3 346.519 2.722 10 0 EFAEHO C[C@]12C[C@H]1CCC[C@H]2[NH2+]CCCN1CCN(c2ccncc2)CC1 ZINC000282376301 474042450 /nfs/dbraw/zinc/04/24/50/474042450.db2.gz WVZWXYCHEHQZKQ-RLLQIKCJSA-N 1 3 328.504 2.762 10 0 EFAEHO C[C@@H]([NH2+]CCCCN1C[C@@H](C)O[C@H](C)C1)c1ccc2c(c1)OCCO2 ZINC000247078850 474057669 /nfs/dbraw/zinc/05/76/69/474057669.db2.gz QSRZBBOHOQSPON-BRWVUGGUSA-N 1 3 348.487 2.998 10 0 EFAEHO CC(C)N(C)CCC[NH2+]C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000227657858 474247086 /nfs/dbraw/zinc/24/70/86/474247086.db2.gz YHHKULBJWDEJJE-INIZCTEOSA-N 1 3 327.513 2.953 10 0 EFAEHO CC(C)N(C)CCC[NH2+]C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000227657862 474247212 /nfs/dbraw/zinc/24/72/12/474247212.db2.gz YHHKULBJWDEJJE-MRXNPFEDSA-N 1 3 327.513 2.953 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CC[N@@H+]1C ZINC000248129056 474263267 /nfs/dbraw/zinc/26/32/67/474263267.db2.gz WFDPFAULFVYECF-OQIJWPOYSA-N 1 3 344.503 2.556 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CC[N@H+]1C ZINC000248129056 474263274 /nfs/dbraw/zinc/26/32/74/474263274.db2.gz WFDPFAULFVYECF-OQIJWPOYSA-N 1 3 344.503 2.556 10 0 EFAEHO C[N@@H+]1CCC[C@H]2CN(CCCOc3ccc4c(c3)OCO4)CC[C@H]21 ZINC000248141085 474267800 /nfs/dbraw/zinc/26/78/00/474267800.db2.gz PQTUDGFBBISSDV-DOTOQJQBSA-N 1 3 332.444 2.600 10 0 EFAEHO C[N@H+]1CCC[C@H]2CN(CCCOc3ccc4c(c3)OCO4)CC[C@H]21 ZINC000248141085 474267805 /nfs/dbraw/zinc/26/78/05/474267805.db2.gz PQTUDGFBBISSDV-DOTOQJQBSA-N 1 3 332.444 2.600 10 0 EFAEHO CN1CCC[C@H]2C[N@H+](CCCOc3ccc4c(c3)OCO4)CC[C@H]21 ZINC000248141085 474267813 /nfs/dbraw/zinc/26/78/13/474267813.db2.gz PQTUDGFBBISSDV-DOTOQJQBSA-N 1 3 332.444 2.600 10 0 EFAEHO CN1CCC[C@H]2C[N@@H+](CCCOc3ccc4c(c3)OCO4)CC[C@H]21 ZINC000248141085 474267822 /nfs/dbraw/zinc/26/78/22/474267822.db2.gz PQTUDGFBBISSDV-DOTOQJQBSA-N 1 3 332.444 2.600 10 0 EFAEHO OC[C@H]1C=C[C@@H](N[C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000248407174 474310691 /nfs/dbraw/zinc/31/06/91/474310691.db2.gz BNIYRLJICJHUPO-XIYVOTBMSA-N 1 3 326.484 2.814 10 0 EFAEHO OC[C@H]1C=C[C@@H](N[C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000248407174 474310694 /nfs/dbraw/zinc/31/06/94/474310694.db2.gz BNIYRLJICJHUPO-XIYVOTBMSA-N 1 3 326.484 2.814 10 0 EFAEHO OC[C@H]1C=C[C@@H]([NH2+][C@@H]2CCC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1 ZINC000248407174 474310701 /nfs/dbraw/zinc/31/07/01/474310701.db2.gz BNIYRLJICJHUPO-XIYVOTBMSA-N 1 3 326.484 2.814 10 0 EFAEHO C[C@H](NC[C@@H](O)COCc1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248561842 474358558 /nfs/dbraw/zinc/35/85/58/474358558.db2.gz JQCCHJOHGSHFHG-HFSMHLIXSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@H](NC[C@@H](O)COCc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248561842 474358567 /nfs/dbraw/zinc/35/85/67/474358567.db2.gz JQCCHJOHGSHFHG-HFSMHLIXSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@H]([NH2+]C[C@@H](O)COCc1ccccc1)[C@H]1CCCN(C2CCC2)C1 ZINC000248561842 474358576 /nfs/dbraw/zinc/35/85/76/474358576.db2.gz JQCCHJOHGSHFHG-HFSMHLIXSA-N 1 3 346.515 2.807 10 0 EFAEHO CCC[C@H]1CN([C@@H]2CC[N@H+](Cc3ccccc3)C2)CCN1CCOC ZINC000271356153 474507016 /nfs/dbraw/zinc/50/70/16/474507016.db2.gz MHXFFHLDLKXLAV-LEWJYISDSA-N 1 3 345.531 2.694 10 0 EFAEHO CCC[C@H]1CN([C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCN1CCOC ZINC000271356153 474507021 /nfs/dbraw/zinc/50/70/21/474507021.db2.gz MHXFFHLDLKXLAV-LEWJYISDSA-N 1 3 345.531 2.694 10 0 EFAEHO O=C(NCc1ccccc1CN1CCCCC1)[C@@H]1CC12CC[NH2+]CC2 ZINC000238029558 474523229 /nfs/dbraw/zinc/52/32/29/474523229.db2.gz MNKCCZMEOKMDAI-IBGZPJMESA-N 1 3 341.499 2.678 10 0 EFAEHO C[NH+](C)CC[C@@H](NC(=O)Nc1ccc2c(c1)OCCNC2)C(C)(C)C ZINC000625943068 480115178 /nfs/dbraw/zinc/11/51/78/480115178.db2.gz DEZWXMIAVNPSMI-QGZVFWFLSA-N 1 3 348.491 2.657 10 0 EFAEHO CCN(CCC[NH+]1CCCC1)C(=O)Nc1ccc2c(c1)OCCNC2 ZINC000625941643 480113923 /nfs/dbraw/zinc/11/39/23/480113923.db2.gz PYERXJLLSIUVHH-UHFFFAOYSA-N 1 3 346.475 2.508 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1[NH2+]CC(=O)NC(C)(C)C ZINC000184752483 474600828 /nfs/dbraw/zinc/60/08/28/474600828.db2.gz FDOCXLYTSBPJAW-HOTGVXAUSA-N 1 3 331.504 2.647 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)NCCC1CCCC1 ZINC000340956119 474815329 /nfs/dbraw/zinc/81/53/29/474815329.db2.gz RAIUMSNDXKOTRH-SFHVURJKSA-N 1 3 338.540 2.624 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)NCCC1CCCC1 ZINC000340956119 474815334 /nfs/dbraw/zinc/81/53/34/474815334.db2.gz RAIUMSNDXKOTRH-SFHVURJKSA-N 1 3 338.540 2.624 10 0 EFAEHO C[C@@H]1CCN(C(=O)CC2CC[NH+](C)CC2)CCN1Cc1ccccc1 ZINC000273278669 474820442 /nfs/dbraw/zinc/82/04/42/474820442.db2.gz WFFNRUMBAYPVKZ-GOSISDBHSA-N 1 3 343.515 2.841 10 0 EFAEHO [NH3+]Cc1ccc(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000311201015 474837622 /nfs/dbraw/zinc/83/76/22/474837622.db2.gz KMRROVCWBPPVEV-IBGZPJMESA-N 1 3 337.467 2.787 10 0 EFAEHO C[C@H]([NH2+]C[C@@H]1CCc2nccn2C1)c1ccc(OCCN(C)C)cc1 ZINC000278874918 474886785 /nfs/dbraw/zinc/88/67/85/474886785.db2.gz CBTZGTXLNBINOW-IRXDYDNUSA-N 1 3 342.487 2.737 10 0 EFAEHO CCc1ccc([C@@H](CNC(=O)NC[C@@H](C)[NH+](CC)CC)N(C)C)cc1 ZINC000337326190 474899795 /nfs/dbraw/zinc/89/97/95/474899795.db2.gz ORNRTGGAHXUVDM-VQIMIIECSA-N 1 3 348.535 2.881 10 0 EFAEHO COC(=O)c1cc2cc(C[N@@H+]3CC[C@]4(CCN(C)C4)C3)ccc2o1 ZINC000292259027 474928239 /nfs/dbraw/zinc/92/82/39/474928239.db2.gz YKVGNQRIYMSMIU-IBGZPJMESA-N 1 3 328.412 2.747 10 0 EFAEHO COC(=O)c1cc2cc(C[N@H+]3CC[C@]4(CCN(C)C4)C3)ccc2o1 ZINC000292259027 474928245 /nfs/dbraw/zinc/92/82/45/474928245.db2.gz YKVGNQRIYMSMIU-IBGZPJMESA-N 1 3 328.412 2.747 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)NCc1cccc(CN(C)C)c1 ZINC000341086993 474958274 /nfs/dbraw/zinc/95/82/74/474958274.db2.gz GAJVINWJKZOMEL-CALCHBBNSA-N 1 3 346.519 2.810 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NCc1cccc(CN(C)C)c1 ZINC000341086993 474958282 /nfs/dbraw/zinc/95/82/82/474958282.db2.gz GAJVINWJKZOMEL-CALCHBBNSA-N 1 3 346.519 2.810 10 0 EFAEHO [NH3+]CCc1ccccc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000327245671 475017306 /nfs/dbraw/zinc/01/73/06/475017306.db2.gz NPLXMTMCNBJOJG-FQEVSTJZSA-N 1 3 337.467 2.755 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)NCC[N@@H+]1CCCC[C@@H]1C ZINC000341151250 475021202 /nfs/dbraw/zinc/02/12/02/475021202.db2.gz ICUGGUPGHVGGJU-MSOLQXFVSA-N 1 3 346.519 2.681 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)NCC[N@H+]1CCCC[C@@H]1C ZINC000341151250 475021208 /nfs/dbraw/zinc/02/12/08/475021208.db2.gz ICUGGUPGHVGGJU-MSOLQXFVSA-N 1 3 346.519 2.681 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)[C@@H]2CCCN2Cc2ccccc2)CC1 ZINC000634121461 480139117 /nfs/dbraw/zinc/13/91/17/480139117.db2.gz XEOHIMDOUKBJBB-IBGZPJMESA-N 1 3 343.515 2.984 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCNC(=O)NCCN1[C@@H](C)CCC[C@@H]1C ZINC000341450764 475054186 /nfs/dbraw/zinc/05/41/86/475054186.db2.gz JJRCTSMEWOMCTK-SQNIBIBYSA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCNC(=O)NCCN1[C@@H](C)CCC[C@@H]1C ZINC000341450764 475054193 /nfs/dbraw/zinc/05/41/93/475054193.db2.gz JJRCTSMEWOMCTK-SQNIBIBYSA-N 1 3 338.540 2.813 10 0 EFAEHO CC1(C)CCC[NH2+][C@H]1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000261786879 475062305 /nfs/dbraw/zinc/06/23/05/475062305.db2.gz YODZOOVDBOHIKB-MSOLQXFVSA-N 1 3 329.488 2.718 10 0 EFAEHO C[C@H](CNC(=O)NCCN1[C@@H](C)CCC[C@@H]1C)C[NH+]1CCCCC1 ZINC000341471311 475070796 /nfs/dbraw/zinc/07/07/96/475070796.db2.gz ZCNBPNQUGFBXPK-SQNIBIBYSA-N 1 3 338.540 2.671 10 0 EFAEHO NC1(C(=O)Nc2ccc(C[NH+]3CCCCCC3)cc2)CCOCC1 ZINC000261825514 475076227 /nfs/dbraw/zinc/07/62/27/475076227.db2.gz KOAOGRCGNUMRHX-UHFFFAOYSA-N 1 3 331.460 2.509 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)[C@H](N)C2CCOCC2)cc1 ZINC000261860658 475089292 /nfs/dbraw/zinc/08/92/92/475089292.db2.gz SEXAVGLMFQZZRX-HNAYVOBHSA-N 1 3 345.487 2.753 10 0 EFAEHO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)[C@H](N)C2CCOCC2)cc1 ZINC000261860658 475089299 /nfs/dbraw/zinc/08/92/99/475089299.db2.gz SEXAVGLMFQZZRX-HNAYVOBHSA-N 1 3 345.487 2.753 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)[C@@H](N)C2CCOCC2)cc1 ZINC000261860651 475089677 /nfs/dbraw/zinc/08/96/77/475089677.db2.gz SEXAVGLMFQZZRX-BEFAXECRSA-N 1 3 345.487 2.753 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)[C@@H](N)C2CCOCC2)cc1 ZINC000261860651 475089687 /nfs/dbraw/zinc/08/96/87/475089687.db2.gz SEXAVGLMFQZZRX-BEFAXECRSA-N 1 3 345.487 2.753 10 0 EFAEHO c1ccc(OCC2CC2)c(CN[C@@H]2CCC[C@H]2[C@H]2COCC[NH2+]2)c1 ZINC000261920892 475115419 /nfs/dbraw/zinc/11/54/19/475115419.db2.gz KJKNGEWTWHVMOB-GUDVDZBRSA-N 1 3 330.472 2.722 10 0 EFAEHO Cc1cc(CN(C)CCC2CCN(c3cc[nH+]cc3)CC2)ncn1 ZINC000292646735 475132861 /nfs/dbraw/zinc/13/28/61/475132861.db2.gz AECDGMWTIZVJPW-UHFFFAOYSA-N 1 3 325.460 2.919 10 0 EFAEHO C1C[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)[C@@H]([C@@H]2COCCN2)C1 ZINC000262017453 475146803 /nfs/dbraw/zinc/14/68/03/475146803.db2.gz WDMHNCDAKFDXBY-ZCNNSNEGSA-N 1 3 335.536 2.530 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)N[C@H](CC[NH+](C)C)C(C)(C)C ZINC000341605269 475179936 /nfs/dbraw/zinc/17/99/36/475179936.db2.gz LMAWYKIUXNUKJH-JKSUJKDBSA-N 1 3 326.529 2.526 10 0 EFAEHO C[C@@H]1OCC[C@H]1[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000339491649 475252414 /nfs/dbraw/zinc/25/24/14/475252414.db2.gz BOWBFNGTIHOKOG-DFQSSKMNSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1OCC[C@H]1NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339491649 475252418 /nfs/dbraw/zinc/25/24/18/475252418.db2.gz BOWBFNGTIHOKOG-DFQSSKMNSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1OCC[C@H]1NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339491649 475252425 /nfs/dbraw/zinc/25/24/25/475252425.db2.gz BOWBFNGTIHOKOG-DFQSSKMNSA-N 1 3 344.499 2.682 10 0 EFAEHO COC[C@H](C)[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000339490102 475253255 /nfs/dbraw/zinc/25/32/55/475253255.db2.gz WMPYVFQVSXZFDE-PKOBYXMFSA-N 1 3 332.488 2.540 10 0 EFAEHO COC[C@H](C)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339490102 475253264 /nfs/dbraw/zinc/25/32/64/475253264.db2.gz WMPYVFQVSXZFDE-PKOBYXMFSA-N 1 3 332.488 2.540 10 0 EFAEHO COC[C@H](C)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339490102 475253271 /nfs/dbraw/zinc/25/32/71/475253271.db2.gz WMPYVFQVSXZFDE-PKOBYXMFSA-N 1 3 332.488 2.540 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@]2(O)CCC[C@H]2C)CC1 ZINC000339554271 475302928 /nfs/dbraw/zinc/30/29/28/475302928.db2.gz BYZLKNLSEKRKKM-WIYYLYMNSA-N 1 3 345.531 2.859 10 0 EFAEHO CC[NH+](CC)CCCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000354788277 475411267 /nfs/dbraw/zinc/41/12/67/475411267.db2.gz QEAAMOJWFNNUDS-IBGZPJMESA-N 1 3 346.519 2.634 10 0 EFAEHO C[C@@H]1C[C@H](C[NH+]2CCN(CCN(C)Cc3ccccc3)CC2)CCO1 ZINC000352711335 475552699 /nfs/dbraw/zinc/55/26/99/475552699.db2.gz AWIPAGUEIPXEIM-TZIWHRDSSA-N 1 3 345.531 2.551 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NCCc2ncc(CC)s2)[C@H](C)C1 ZINC000361661983 475640658 /nfs/dbraw/zinc/64/06/58/475640658.db2.gz OVPINKOOKLJXAT-WBVHZDCISA-N 1 3 339.549 2.975 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NCCc2ncc(CC)s2)[C@H](C)C1 ZINC000361661983 475640662 /nfs/dbraw/zinc/64/06/62/475640662.db2.gz OVPINKOOKLJXAT-WBVHZDCISA-N 1 3 339.549 2.975 10 0 EFAEHO C/C(=C\c1ccc(Cl)cc1)C[NH2+]CCCN1CCC[C@@H](C(N)=O)C1 ZINC000338182752 475656481 /nfs/dbraw/zinc/65/64/81/475656481.db2.gz OLBHIWUFWLBFOH-OKACTXMXSA-N 1 3 349.906 2.920 10 0 EFAEHO CC[NH+](CC)Cc1ccc(C(=O)N(C)[C@H]2CN3CCC2CC3)cc1 ZINC000338191354 475662778 /nfs/dbraw/zinc/66/27/78/475662778.db2.gz QNUOYVDKDWNMMI-IBGZPJMESA-N 1 3 329.488 2.695 10 0 EFAEHO CC(C)C[C@H]([NH2+][C@H](C)C1CCC(F)(F)CC1)C(=O)NCCN(C)C ZINC000353246761 475800328 /nfs/dbraw/zinc/80/03/28/475800328.db2.gz XWHDLKPGKNUPDQ-ZBFHGGJFSA-N 1 3 347.494 2.883 10 0 EFAEHO CN1CC[C@H]([NH2+][C@@H]2CC(=O)N(c3c(F)cccc3F)C2)[C@@H]2CCC[C@@H]21 ZINC000353410342 475946374 /nfs/dbraw/zinc/94/63/74/475946374.db2.gz WQDIPLRCGMNFMZ-OQUILHJVSA-N 1 3 349.425 2.533 10 0 EFAEHO COc1cccc([C@H](CN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)N(C)C)c1 ZINC000353465951 475992619 /nfs/dbraw/zinc/99/26/19/475992619.db2.gz WISVWGGTCOFGMB-ZRNYENFQSA-N 1 3 331.504 2.760 10 0 EFAEHO COc1cccc([C@H](CN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@@H]32)N(C)C)c1 ZINC000353465951 475992622 /nfs/dbraw/zinc/99/26/22/475992622.db2.gz WISVWGGTCOFGMB-ZRNYENFQSA-N 1 3 331.504 2.760 10 0 EFAEHO COc1cccc([C@H](C[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@@H]32)N(C)C)c1 ZINC000353465951 475992627 /nfs/dbraw/zinc/99/26/27/475992627.db2.gz WISVWGGTCOFGMB-ZRNYENFQSA-N 1 3 331.504 2.760 10 0 EFAEHO CS[C@@H]1CN([C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1[NH+]1CCCC1 ZINC000298295605 476048344 /nfs/dbraw/zinc/04/83/44/476048344.db2.gz HJJQQMNUWJUAJZ-VAMGGRTRSA-N 1 3 345.556 2.773 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000350313404 476131476 /nfs/dbraw/zinc/13/14/76/476131476.db2.gz ZWOKLYUWKSLIDL-LJQANCHMSA-N 1 3 331.504 2.841 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)CC[C@H]1CCCC[N@H+]1C ZINC000350313404 476131482 /nfs/dbraw/zinc/13/14/82/476131482.db2.gz ZWOKLYUWKSLIDL-LJQANCHMSA-N 1 3 331.504 2.841 10 0 EFAEHO CN1CC[C@@]2(CC[N@H+](CCOc3ccc(Br)cc3)C2)C1 ZINC000336831196 476137621 /nfs/dbraw/zinc/13/76/21/476137621.db2.gz ISPVSDSIZDROKN-MRXNPFEDSA-N 1 3 339.277 2.856 10 0 EFAEHO CN1CC[C@@]2(CC[N@@H+](CCOc3ccc(Br)cc3)C2)C1 ZINC000336831196 476137625 /nfs/dbraw/zinc/13/76/25/476137625.db2.gz ISPVSDSIZDROKN-MRXNPFEDSA-N 1 3 339.277 2.856 10 0 EFAEHO CN1CC[C@H]([NH2+]CCOc2ncccc2C(F)(F)F)[C@@H]2CCC[C@H]21 ZINC000353635554 476141968 /nfs/dbraw/zinc/14/19/68/476141968.db2.gz ADVPRIKISDDCIO-AEGPPILISA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCOc2ncccc2C(F)(F)F)[C@@H]2CCC[C@H]21 ZINC000353635554 476141977 /nfs/dbraw/zinc/14/19/77/476141977.db2.gz ADVPRIKISDDCIO-AEGPPILISA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@H+]1CC[C@H](NCCOc2ncccc2C(F)(F)F)[C@@H]2CCC[C@H]21 ZINC000353635554 476141984 /nfs/dbraw/zinc/14/19/84/476141984.db2.gz ADVPRIKISDDCIO-AEGPPILISA-N 1 3 343.393 2.942 10 0 EFAEHO CN(c1ccccc1C[NH2+]CC[C@H]1CCOC1)C1CCN(C)CC1 ZINC000344258940 476193097 /nfs/dbraw/zinc/19/30/97/476193097.db2.gz CILPSSUDWMSFHN-KRWDZBQOSA-N 1 3 331.504 2.733 10 0 EFAEHO CC(C)C[C@H](N[C@@H]1CCCc2ccc(F)cc21)C(=O)NCC[NH+](C)C ZINC000347254927 476208830 /nfs/dbraw/zinc/20/88/30/476208830.db2.gz SWZPRARNWRUQFF-MOPGFXCFSA-N 1 3 349.494 2.885 10 0 EFAEHO O=C(N[C@H]1CCN(C2CC2)C1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000359245184 476215682 /nfs/dbraw/zinc/21/56/82/476215682.db2.gz ZDOUCFZSFAFYOG-MSOLQXFVSA-N 1 3 348.535 2.521 10 0 EFAEHO CN1CCC[C@H]1CC[NH+]1CCC2(C[C@H]2C(=O)N2CCCCC2)CC1 ZINC000357082841 476216956 /nfs/dbraw/zinc/21/69/56/476216956.db2.gz JQTUXFVXYSJXCM-ROUUACIJSA-N 1 3 333.520 2.585 10 0 EFAEHO CC[C@@H]1C[C@@H](C[NH+]2CCC(C)(CN3CCN(C)CC3)CC2)CCO1 ZINC000350551356 476238959 /nfs/dbraw/zinc/23/89/59/476238959.db2.gz FENROXLOKZQWJE-RBUKOAKNSA-N 1 3 337.552 2.541 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@@H]1CC[N@H+](C)[C@H](C)C1)[C@H](c1ccccc1)N(C)C ZINC000357278728 476313411 /nfs/dbraw/zinc/31/34/11/476313411.db2.gz WSYYNGGJSKSJSJ-UKBAYJJMSA-N 1 3 346.519 2.802 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1)[C@H](c1ccccc1)N(C)C ZINC000357278728 476313415 /nfs/dbraw/zinc/31/34/15/476313415.db2.gz WSYYNGGJSKSJSJ-UKBAYJJMSA-N 1 3 346.519 2.802 10 0 EFAEHO O=C(NC[C@H]1CCCCN1C1CC1)N1CCC(C[NH+]2CCCC2)CC1 ZINC000373121100 476378575 /nfs/dbraw/zinc/37/85/75/476378575.db2.gz KDEBAFAOWORKBI-LJQANCHMSA-N 1 3 348.535 2.521 10 0 EFAEHO CC(C)(C)OC(=O)N1CC[C@](C)(CN[C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000373850954 476435370 /nfs/dbraw/zinc/43/53/70/476435370.db2.gz OLTDJDQYPNAXTJ-JTDSTZFVSA-N 1 3 337.508 2.850 10 0 EFAEHO CC(C)(C)OC(=O)N1CC[C@](C)(CN[C@@H]2CC[N@H+]3CCC[C@H]3C2)C1 ZINC000373850954 476435378 /nfs/dbraw/zinc/43/53/78/476435378.db2.gz OLTDJDQYPNAXTJ-JTDSTZFVSA-N 1 3 337.508 2.850 10 0 EFAEHO CC(C)(C)OC(=O)N1CC[C@](C)(C[NH2+][C@@H]2CCN3CCC[C@H]3C2)C1 ZINC000373850954 476435387 /nfs/dbraw/zinc/43/53/87/476435387.db2.gz OLTDJDQYPNAXTJ-JTDSTZFVSA-N 1 3 337.508 2.850 10 0 EFAEHO C[C@H](CCNC(=O)CC1CCN(C)CC1)[N@H+](C)Cc1ccccc1 ZINC000362855566 476444088 /nfs/dbraw/zinc/44/40/88/476444088.db2.gz MXMJLMDYNQTWTC-QGZVFWFLSA-N 1 3 331.504 2.745 10 0 EFAEHO C[C@H](CCNC(=O)CC1CCN(C)CC1)[N@@H+](C)Cc1ccccc1 ZINC000362855566 476444093 /nfs/dbraw/zinc/44/40/93/476444093.db2.gz MXMJLMDYNQTWTC-QGZVFWFLSA-N 1 3 331.504 2.745 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)N(C)[C@@H]1CC[N@@H+](C2CC2)C1)c1ccco1 ZINC000357551196 476449646 /nfs/dbraw/zinc/44/96/46/476449646.db2.gz WVTYDLVLUDFTPC-USXIJHARSA-N 1 3 348.491 2.587 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1)c1ccco1 ZINC000357551196 476449653 /nfs/dbraw/zinc/44/96/53/476449653.db2.gz WVTYDLVLUDFTPC-USXIJHARSA-N 1 3 348.491 2.587 10 0 EFAEHO COC1CC([NH2+]C[C@H]2CN(Cc3ccccc3)CC23CCOCC3)C1 ZINC000354209225 476503931 /nfs/dbraw/zinc/50/39/31/476503931.db2.gz SLHQBCFCAHPIHW-HDYDNRTBSA-N 1 3 344.499 2.682 10 0 EFAEHO C[N@@H+]1CCCC12CCN(C(=O)c1cccc(CN3CCCC3)c1)CC2 ZINC000374881968 476572133 /nfs/dbraw/zinc/57/21/33/476572133.db2.gz OXHKIINUMOLFRY-UHFFFAOYSA-N 1 3 341.499 2.983 10 0 EFAEHO C[N@H+]1CCCC12CCN(C(=O)c1cccc(CN3CCCC3)c1)CC2 ZINC000374881968 476572137 /nfs/dbraw/zinc/57/21/37/476572137.db2.gz OXHKIINUMOLFRY-UHFFFAOYSA-N 1 3 341.499 2.983 10 0 EFAEHO C(=C/C[N@@H+]1CCC[C@]2(CCOC2)C1)\CN1CCC[C@]2(CCOC2)C1 ZINC000451912950 476721342 /nfs/dbraw/zinc/72/13/42/476721342.db2.gz VLIBMYYGMMEZBC-IGMPDDETSA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C/C[N@H+]1CCC[C@]2(CCOC2)C1)\CN1CCC[C@]2(CCOC2)C1 ZINC000451912950 476721346 /nfs/dbraw/zinc/72/13/46/476721346.db2.gz VLIBMYYGMMEZBC-IGMPDDETSA-N 1 3 334.504 2.548 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@H](c1ccc(F)cc1)N(C)C ZINC000422705954 476736780 /nfs/dbraw/zinc/73/67/80/476736780.db2.gz DEXUYFNRCMCGPG-DJJJIMSYSA-N 1 3 330.451 2.941 10 0 EFAEHO Cc1cccc2[nH]cc(CCN[C@@H]3CCOC[C@H]3[C@H]3CCC[NH2+]3)c21 ZINC000422716440 476740320 /nfs/dbraw/zinc/74/03/20/476740320.db2.gz NDVRTDVIFDWTSR-RCCFBDPRSA-N 1 3 327.472 2.766 10 0 EFAEHO C[C@@H]1CCN(C(=O)C2CCC([NH3+])CC2)CCN1Cc1ccccc1 ZINC000382754563 476746638 /nfs/dbraw/zinc/74/66/38/476746638.db2.gz GGQPPJNOENOURQ-IPJUCJBFSA-N 1 3 329.488 2.627 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@@H]1CCOc2ccc(Br)cc21 ZINC000422764766 476766996 /nfs/dbraw/zinc/76/69/96/476766996.db2.gz QHHSTGIFTVRTNM-GXTWGEPZSA-N 1 3 343.265 2.616 10 0 EFAEHO c1cc(CN2CCOCC2)ccc1CN[C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000422774274 476770760 /nfs/dbraw/zinc/77/07/60/476770760.db2.gz WKMWYPSPSBPNNY-NJDAHSKKSA-N 1 3 343.515 2.529 10 0 EFAEHO c1ccc2nc(CCN[C@@H]3CCOC[C@H]3[C@@H]3CCC[NH2+]3)ccc2c1 ZINC000422779011 476772857 /nfs/dbraw/zinc/77/28/57/476772857.db2.gz IBTZPXOHJPRHRM-YSIASYRMSA-N 1 3 325.456 2.524 10 0 EFAEHO COc1cccc(O[C@@H](C)C[NH2+][C@H](C)c2ccc(CN)nc2C)c1 ZINC000422779155 476773344 /nfs/dbraw/zinc/77/33/44/476773344.db2.gz BPYAIMJCMJQVEE-UONOGXRCSA-N 1 3 329.444 2.975 10 0 EFAEHO C[C@@H]1CN(C(C)(C)CN[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)C[C@@H](C)O1 ZINC000422788438 476776098 /nfs/dbraw/zinc/77/60/98/476776098.db2.gz APQNGSMSLQFVPL-FVVUREQNSA-N 1 3 337.552 2.775 10 0 EFAEHO Cc1nc(CCN[C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cs1 ZINC000422816043 476790863 /nfs/dbraw/zinc/79/08/63/476790863.db2.gz DBGROWCFYPKCNY-FUHWJXTLSA-N 1 3 329.469 2.840 10 0 EFAEHO C[C@@H](C[C@H]1COCCN1)[NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000390531451 476796072 /nfs/dbraw/zinc/79/60/72/476796072.db2.gz DUSDCHLTGCOLLD-RGSBRZDASA-N 1 3 343.515 2.539 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1ccc(Oc2cccc(F)c2)nc1 ZINC000422847546 476807579 /nfs/dbraw/zinc/80/75/79/476807579.db2.gz RRFMJTYNIXCJQZ-MRXNPFEDSA-N 1 3 333.407 2.857 10 0 EFAEHO CCCCOC[C@@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390847744 476807891 /nfs/dbraw/zinc/80/78/91/476807891.db2.gz GWYACMJJEOAJFR-VTHDOGFWSA-N 1 3 346.515 2.949 10 0 EFAEHO CCCCOC[C@@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000390847744 476807899 /nfs/dbraw/zinc/80/78/99/476807899.db2.gz GWYACMJJEOAJFR-VTHDOGFWSA-N 1 3 346.515 2.949 10 0 EFAEHO CC(C)NC(=O)[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000390895917 476808231 /nfs/dbraw/zinc/80/82/31/476808231.db2.gz RLRYPNKSTYRDKM-BPIHKTFHSA-N 1 3 329.488 2.685 10 0 EFAEHO COc1ccc([C@H](NCCN2CCC(C)CC2)[C@H]2CCC[NH2+]2)cc1 ZINC000422858438 476813466 /nfs/dbraw/zinc/81/34/66/476813466.db2.gz IQQBLGLPPNONRK-UXHICEINSA-N 1 3 331.504 2.810 10 0 EFAEHO COc1ccc([C@H](NCCN2CCCC[C@@H]2C)[C@@H]2CCC[NH2+]2)cc1 ZINC000422858542 476813968 /nfs/dbraw/zinc/81/39/68/476813968.db2.gz IYUOAUGOCATNNE-VDGAXYAQSA-N 1 3 331.504 2.952 10 0 EFAEHO Cc1cc(C)cc(OC[C@@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC000391725533 476816059 /nfs/dbraw/zinc/81/60/59/476816059.db2.gz RFKPAMFMUCLIBC-IPQPSQTFSA-N 1 3 332.488 2.648 10 0 EFAEHO Cc1cc(C)cc(OC[C@@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC000391725533 476816062 /nfs/dbraw/zinc/81/60/62/476816062.db2.gz RFKPAMFMUCLIBC-IPQPSQTFSA-N 1 3 332.488 2.648 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1cccnc1Oc1cccc(F)c1 ZINC000422862941 476816441 /nfs/dbraw/zinc/81/64/41/476816441.db2.gz OFZJHBWZRAELFW-INIZCTEOSA-N 1 3 333.407 2.857 10 0 EFAEHO COc1ccccc1N1CC[C@H]([NH2+][C@@H](C)c2ccc(CN)nc2C)C1 ZINC000422870168 476821018 /nfs/dbraw/zinc/82/10/18/476821018.db2.gz BGMWIYBQZAYZEO-RDJZCZTQSA-N 1 3 340.471 2.787 10 0 EFAEHO Cc1ccc(C)c(OC[C@@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC000392131901 476823097 /nfs/dbraw/zinc/82/30/97/476823097.db2.gz ANBTWBIKPXKKKV-IPQPSQTFSA-N 1 3 332.488 2.648 10 0 EFAEHO Cc1ccc(C)c(OC[C@@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC000392131901 476823106 /nfs/dbraw/zinc/82/31/06/476823106.db2.gz ANBTWBIKPXKKKV-IPQPSQTFSA-N 1 3 332.488 2.648 10 0 EFAEHO Clc1cccnc1N1CC[C@H](N[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000422877419 476824053 /nfs/dbraw/zinc/82/40/53/476824053.db2.gz RJFOHJMQDBTZLV-HDEZJCGLSA-N 1 3 334.895 2.824 10 0 EFAEHO COc1ccc(CCN[C@@H]2CCOC[C@@H]2[C@@H]2CCC[NH2+]2)c(Cl)c1 ZINC000422892422 476831069 /nfs/dbraw/zinc/83/10/69/476831069.db2.gz YNBDIFNRDRPYEG-BPQIPLTHSA-N 1 3 338.879 2.638 10 0 EFAEHO C[C@@H](NCc1ccc(OCC[NH+]2CCCC2)cc1)c1cnccc1N ZINC000422908378 476841347 /nfs/dbraw/zinc/84/13/47/476841347.db2.gz DHOQDANXSFKGHB-MRXNPFEDSA-N 1 3 340.471 2.820 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1ccc(Oc2cccnc2)c(F)c1 ZINC000422906613 476841833 /nfs/dbraw/zinc/84/18/33/476841833.db2.gz VNFRUNIYSUAUEN-HNNXBMFYSA-N 1 3 333.407 2.857 10 0 EFAEHO CC(=O)Nc1cccc(OCCN[C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000422937106 476854453 /nfs/dbraw/zinc/85/44/53/476854453.db2.gz CFTVSNBERNAYQL-XUVXKRRUSA-N 1 3 345.487 2.924 10 0 EFAEHO COc1ccc(C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)cc1 ZINC000397655679 476857337 /nfs/dbraw/zinc/85/73/37/476857337.db2.gz YHEXFBQVZXUEFT-UHFFFAOYSA-N 1 3 340.467 2.812 10 0 EFAEHO CC(C)[C@H]1C[C@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCO1 ZINC000397576657 476858895 /nfs/dbraw/zinc/85/88/95/476858895.db2.gz CRJFHSDEXCNTSK-WOJBJXKFSA-N 1 3 346.515 2.807 10 0 EFAEHO Cc1ccncc1C[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000397625376 476859051 /nfs/dbraw/zinc/85/90/51/476859051.db2.gz XVNVLVVVJWXRMQ-UHFFFAOYSA-N 1 3 325.456 2.507 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(C(=O)NCCN2CCCC2)cc1)[C@H]1C[C@H]1C ZINC000414069521 476862495 /nfs/dbraw/zinc/86/24/95/476862495.db2.gz BTRHPAWMKVHVCQ-MDZRGWNJSA-N 1 3 329.488 2.646 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C1CCC([NH3+])CC1 ZINC000398068251 476865840 /nfs/dbraw/zinc/86/58/40/476865840.db2.gz OJJNKIDYOZYPDM-JYPHPWERSA-N 1 3 329.488 2.531 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C1CCC([NH3+])CC1 ZINC000398068242 476866030 /nfs/dbraw/zinc/86/60/30/476866030.db2.gz OJJNKIDYOZYPDM-GWFLUQINSA-N 1 3 329.488 2.531 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1[NH2+]CCCC1(C)C ZINC000398148546 476869096 /nfs/dbraw/zinc/86/90/96/476869096.db2.gz ORDMRAPDUAXRGU-NEWSRXKRSA-N 1 3 343.515 2.791 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1[NH2+]CCCC1(C)C ZINC000398148548 476869107 /nfs/dbraw/zinc/86/91/07/476869107.db2.gz ORDMRAPDUAXRGU-QRQLOZEOSA-N 1 3 343.515 2.791 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CC2(N3CCOCC3)CCN(C)CC2)CC(C)(C)C1 ZINC000414197546 476875619 /nfs/dbraw/zinc/87/56/19/476875619.db2.gz PJVKSPYPOMLEFR-ROUUACIJSA-N 1 3 337.552 2.587 10 0 EFAEHO C[C@@H]1CC[NH2+]CC[C@@H]1NC[C@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422986647 476879689 /nfs/dbraw/zinc/87/96/89/476879689.db2.gz DAJNPXIVJYNHRE-UNEWFSDZSA-N 1 3 344.421 2.834 10 0 EFAEHO C[C@@H]1CCNCC[C@@H]1[NH2+]C[C@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422986647 476879695 /nfs/dbraw/zinc/87/96/95/476879695.db2.gz DAJNPXIVJYNHRE-UNEWFSDZSA-N 1 3 344.421 2.834 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C)[C@H](C)[NH3+] ZINC000399518711 476883735 /nfs/dbraw/zinc/88/37/35/476883735.db2.gz NWSPNICLUXNTAS-JFRXWTBNSA-N 1 3 331.504 2.633 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C)[C@H](C)[NH3+] ZINC000399518709 476883980 /nfs/dbraw/zinc/88/39/80/476883980.db2.gz NWSPNICLUXNTAS-DKKFBQAASA-N 1 3 331.504 2.633 10 0 EFAEHO COc1ccc2c(c1)OC[C@@H]([NH2+][C@H](C)c1ccc(CN)nc1C)C2 ZINC000423022068 476894714 /nfs/dbraw/zinc/89/47/14/476894714.db2.gz HADBVGPSKSVEBT-CJNGLKHVSA-N 1 3 327.428 2.512 10 0 EFAEHO COc1ccc2c(c1)OC[C@H](N[C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)C2 ZINC000423020838 476895235 /nfs/dbraw/zinc/89/52/35/476895235.db2.gz CWUNVYRUVPVYCO-OQIJWPOYSA-N 1 3 330.472 2.899 10 0 EFAEHO COc1cc(Br)ccc1CCCN[C@H]1CCC[C@@H]1[NH3+] ZINC000423028343 476897629 /nfs/dbraw/zinc/89/76/29/476897629.db2.gz GDGILZYSMGVVAI-KBPBESRZSA-N 1 3 327.266 2.860 10 0 EFAEHO COc1cccc([C@H]2[C@@H](NC3C[C@H]4CC[C@@H](C3)[NH2+]4)CCN2C2CC2)c1 ZINC000423043204 476901607 /nfs/dbraw/zinc/90/16/07/476901607.db2.gz NVYHFPSEZGHYRL-FMSCBOOZSA-N 1 3 341.499 2.846 10 0 EFAEHO CCOC(=O)c1csc(CC[NH2+][C@@H]2C[C@H](N)c3ccccc32)n1 ZINC000423065407 476910933 /nfs/dbraw/zinc/91/09/33/476910933.db2.gz BGLZNDRYPLMWGF-UONOGXRCSA-N 1 3 331.441 2.597 10 0 EFAEHO CCOC(=O)C1([C@@H](C)N[C@@H]2CCOc3c(C)cccc32)CC[NH2+]CC1 ZINC000423069015 476914815 /nfs/dbraw/zinc/91/48/15/476914815.db2.gz LFYRUMBXTLABHO-NVXWUHKLSA-N 1 3 346.471 2.730 10 0 EFAEHO C[C@H]([NH3+])[C@H](Cc1ccccc1)NC[C@H](CO)Cc1ccc(F)c(F)c1 ZINC000423079844 476919757 /nfs/dbraw/zinc/91/97/57/476919757.db2.gz RFVAXGXLECVZJQ-NQYLQCIDSA-N 1 3 348.437 2.664 10 0 EFAEHO NC[C@@H]1CCCC[C@@H]1[NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000423085360 476921967 /nfs/dbraw/zinc/92/19/67/476921967.db2.gz KIUUIFWMOJKSRA-MFNGEMCRSA-N 1 3 333.442 2.899 10 0 EFAEHO CCCN1CCC[C@H]1CN[C@H](c1ccc(OC)cc1)[C@H]1CCC[NH2+]1 ZINC000423114461 476932668 /nfs/dbraw/zinc/93/26/68/476932668.db2.gz VUQPCQWBDKULFW-DFQSSKMNSA-N 1 3 331.504 2.952 10 0 EFAEHO CC[C@@H](N[C@@H](CC(C)C)C(=O)NCC[NH+](C)C)c1cccc(F)c1 ZINC000446930316 476935853 /nfs/dbraw/zinc/93/58/53/476935853.db2.gz NMUXGRMWVABHDR-MSOLQXFVSA-N 1 3 337.483 2.959 10 0 EFAEHO CC1(C)[C@H](Oc2ccccc2)C[C@@H]1N[C@@H]1CCOC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000423125227 476936786 /nfs/dbraw/zinc/93/67/86/476936786.db2.gz NLRJROPFMNCDGC-UJMXGEILSA-N 1 3 344.499 2.979 10 0 EFAEHO CC1(C)[C@H](Oc2ccccc2)C[C@@H]1N[C@@H]1CCOC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000423125224 476937253 /nfs/dbraw/zinc/93/72/53/476937253.db2.gz NLRJROPFMNCDGC-LTFPLMDUSA-N 1 3 344.499 2.979 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2cccc(NS(C)(=O)=O)c2)cc1 ZINC000423295993 476985087 /nfs/dbraw/zinc/98/50/87/476985087.db2.gz YDIUIECBYXLJEO-KGLIPLIRSA-N 1 3 347.484 2.929 10 0 EFAEHO C[NH2+]Cc1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000416003585 476988082 /nfs/dbraw/zinc/98/80/82/476988082.db2.gz FMQTXYTWOFZZQU-RBUKOAKNSA-N 1 3 338.455 2.973 10 0 EFAEHO C[C@H]([NH2+][C@H]1CCNC[C@@H]1C)c1ccc(OCc2nccn2C)cc1 ZINC000423362565 477006536 /nfs/dbraw/zinc/00/65/36/477006536.db2.gz BGBPKQPUWFIPIS-MPGHIAIKSA-N 1 3 328.460 2.648 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccccc2CN2CCCC2=O)[C@@H]2CCC[C@@H]21 ZINC000375791169 477007717 /nfs/dbraw/zinc/00/77/17/477007717.db2.gz NZTVIKYTNWQJOF-UFYCRDLUSA-N 1 3 341.499 2.771 10 0 EFAEHO C[C@H](Cc1ccc(Br)cc1F)[NH2+]CCOCCN(C)C ZINC000447597770 477019508 /nfs/dbraw/zinc/01/95/08/477019508.db2.gz GTZCSILUDHDFBO-GFCCVEGCSA-N 1 3 347.272 2.687 10 0 EFAEHO C[C@H](CNC(=O)CCN1CCc2ccccc2C1)[N@@H+]1CCCC[C@@H]1C ZINC000416132309 477031144 /nfs/dbraw/zinc/03/11/44/477031144.db2.gz KSACXBREMKBVMG-ZWKOTPCHSA-N 1 3 343.515 2.814 10 0 EFAEHO C[C@H](CNC(=O)CCN1CCc2ccccc2C1)[N@H+]1CCCC[C@@H]1C ZINC000416132309 477031152 /nfs/dbraw/zinc/03/11/52/477031152.db2.gz KSACXBREMKBVMG-ZWKOTPCHSA-N 1 3 343.515 2.814 10 0 EFAEHO FC1(F)CCNC[C@@H]1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000423488735 477046105 /nfs/dbraw/zinc/04/61/05/477046105.db2.gz VPOFURLXLYOJAS-FJIDUMEYSA-N 1 3 335.442 2.769 10 0 EFAEHO FC1(F)CCNC[C@@H]1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000423488735 477046108 /nfs/dbraw/zinc/04/61/08/477046108.db2.gz VPOFURLXLYOJAS-FJIDUMEYSA-N 1 3 335.442 2.769 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)NCC1([NH3+])C2CC3CC(C2)CC1C3 ZINC000423522871 477060103 /nfs/dbraw/zinc/06/01/03/477060103.db2.gz HVKOSAGRVDRHPD-DAFVDEOWSA-N 1 3 328.504 2.653 10 0 EFAEHO CCC[N@H+](CC)C[C@H](C)NC(=O)CCN1CCc2ccccc2C1 ZINC000416231961 477082578 /nfs/dbraw/zinc/08/25/78/477082578.db2.gz DHINDQMMOCRNKQ-KRWDZBQOSA-N 1 3 331.504 2.671 10 0 EFAEHO CCC[N@@H+](CC)C[C@H](C)NC(=O)CCN1CCc2ccccc2C1 ZINC000416231961 477082582 /nfs/dbraw/zinc/08/25/82/477082582.db2.gz DHINDQMMOCRNKQ-KRWDZBQOSA-N 1 3 331.504 2.671 10 0 EFAEHO CCCC[N@H+](C)C[C@@H](C)NC(=O)CCN1CCc2ccccc2C1 ZINC000416233956 477082618 /nfs/dbraw/zinc/08/26/18/477082618.db2.gz LFACVUOHFDSKCW-QGZVFWFLSA-N 1 3 331.504 2.671 10 0 EFAEHO CCCC[N@@H+](C)C[C@@H](C)NC(=O)CCN1CCc2ccccc2C1 ZINC000416233956 477082625 /nfs/dbraw/zinc/08/26/25/477082625.db2.gz LFACVUOHFDSKCW-QGZVFWFLSA-N 1 3 331.504 2.671 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NC[C@@H]2N(C)CCCC2(C)C)CC1 ZINC000447951732 477101180 /nfs/dbraw/zinc/10/11/80/477101180.db2.gz NUELDOQTJOPXMG-KRWDZBQOSA-N 1 3 338.540 2.528 10 0 EFAEHO CN1CCCC(C)(C)[C@H]1CNC(=O)NC1CCC(C[NH+](C)C)CC1 ZINC000447959583 477102436 /nfs/dbraw/zinc/10/24/36/477102436.db2.gz QOXCEBPJPCGJNC-OFLPRAFFSA-N 1 3 338.540 2.526 10 0 EFAEHO CN(C)CCN(Cc1cccs1)C(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000431843722 477106461 /nfs/dbraw/zinc/10/64/61/477106461.db2.gz JRCNGZHHTIFQQZ-INIZCTEOSA-N 1 3 337.533 2.903 10 0 EFAEHO CN(C)CCN(Cc1cccs1)C(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000431843722 477106466 /nfs/dbraw/zinc/10/64/66/477106466.db2.gz JRCNGZHHTIFQQZ-INIZCTEOSA-N 1 3 337.533 2.903 10 0 EFAEHO CN(C)CCN(Cc1cccs1)C(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000431843724 477106969 /nfs/dbraw/zinc/10/69/69/477106969.db2.gz JRCNGZHHTIFQQZ-MRXNPFEDSA-N 1 3 337.533 2.903 10 0 EFAEHO CN(C)CCN(Cc1cccs1)C(=O)CC[C@H]1CCCC[N@H+]1C ZINC000431843724 477106977 /nfs/dbraw/zinc/10/69/77/477106977.db2.gz JRCNGZHHTIFQQZ-MRXNPFEDSA-N 1 3 337.533 2.903 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000371243452 477196189 /nfs/dbraw/zinc/19/61/89/477196189.db2.gz KGXKOHAJFMRPSH-VQTJNVASSA-N 1 3 341.499 2.887 10 0 EFAEHO CCO[C@@H]1COC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000453369261 477217006 /nfs/dbraw/zinc/21/70/06/477217006.db2.gz SXYUWSHXHXZBNT-OUUBHVDSSA-N 1 3 330.472 2.576 10 0 EFAEHO CCN1CCC(NC(=O)C[NH2+][C@H]2CCCC[C@@H]2c2ccccc2)CC1 ZINC000411561730 477276871 /nfs/dbraw/zinc/27/68/71/477276871.db2.gz RIAGOSMHVPSSJV-UXHICEINSA-N 1 3 343.515 2.903 10 0 EFAEHO O=C(NCC[C@H]1CCC[NH2+]C1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000416783952 477310029 /nfs/dbraw/zinc/31/00/29/477310029.db2.gz IMBKARHOOBOCLW-MJGOQNOKSA-N 1 3 344.503 2.512 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)NC[C@@H]1CCCCN1C1CC1 ZINC000433918023 477329109 /nfs/dbraw/zinc/32/91/09/477329109.db2.gz HQOBTPKHDXYDHF-NUJGCVRESA-N 1 3 336.524 2.565 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N(C1CC1)[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000416847928 477335192 /nfs/dbraw/zinc/33/51/92/477335192.db2.gz WCBQYEAVIRCQAO-RBUKOAKNSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H]1NCCN(C(=O)NCc2ccccc2C[NH+]2CCCCC2)[C@H]1C ZINC000416902667 477361583 /nfs/dbraw/zinc/36/15/83/477361583.db2.gz LUHZZAHKOGRXIR-IRXDYDNUSA-N 1 3 344.503 2.564 10 0 EFAEHO C[C@@H]1CN(C(=O)NCc2ccccc2C[NH+]2CCCCC2)[C@@H](C)CN1 ZINC000416901859 477361978 /nfs/dbraw/zinc/36/19/78/477361978.db2.gz KOINRFAJGDFUAJ-SJORKVTESA-N 1 3 344.503 2.564 10 0 EFAEHO C[C@H](CCC[NH3+])NC(=O)NCc1ccccc1CN1CCCCC1 ZINC000416908375 477364444 /nfs/dbraw/zinc/36/44/44/477364444.db2.gz WATLMVNAUGPQQC-MRXNPFEDSA-N 1 3 332.492 2.599 10 0 EFAEHO CCC([NH3+])(CC)CNC(=O)NCc1ccccc1CN1CCCCC1 ZINC000416907769 477364724 /nfs/dbraw/zinc/36/47/24/477364724.db2.gz VCOQLUFBNLQATL-UHFFFAOYSA-N 1 3 346.519 2.989 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@H]([NH2+]CC3(N4CCCCC4)CCN(C)CC3)C[C@H]2C1 ZINC000424308699 477366704 /nfs/dbraw/zinc/36/67/04/477366704.db2.gz HAVPLTKOYXILJY-AVCFWEGKSA-N 1 3 349.563 2.730 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@H]([NH2+]CCc3ccc(OCCN(C)C)cc3)C[C@H]2C1 ZINC000424322978 477372162 /nfs/dbraw/zinc/37/21/62/477372162.db2.gz VQXWDLGITAJXMX-KBCPTCDJSA-N 1 3 346.515 2.963 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCNC(=O)CCCc2ccccc2)[C@H]2CCC[C@H]21 ZINC000424334207 477373421 /nfs/dbraw/zinc/37/34/21/477373421.db2.gz WPQDACDBOWHNAL-HSALFYBXSA-N 1 3 343.515 2.588 10 0 EFAEHO C[N@H+]1CC[C@H](NCCNC(=O)CCCc2ccccc2)[C@H]2CCC[C@H]21 ZINC000424334207 477373426 /nfs/dbraw/zinc/37/34/26/477373426.db2.gz WPQDACDBOWHNAL-HSALFYBXSA-N 1 3 343.515 2.588 10 0 EFAEHO Cc1nccn1CC[NH2+]C1CCN([C@@H](C)Cc2ccccc2)CC1 ZINC000449108528 477442117 /nfs/dbraw/zinc/44/21/17/477442117.db2.gz RNVHDHYBFXFKOJ-KRWDZBQOSA-N 1 3 326.488 2.877 10 0 EFAEHO CN1CCN(C)[C@@H](CNC2CC[NH+](C(C)(C)CC(C)(C)C)CC2)C1 ZINC000449144172 477457950 /nfs/dbraw/zinc/45/79/50/477457950.db2.gz YWWDRNVOXPBJFA-SFHVURJKSA-N 1 3 338.584 2.501 10 0 EFAEHO CS[C@H](CO)[C@H](C)NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449158989 477463369 /nfs/dbraw/zinc/46/33/69/477463369.db2.gz WQPAEKKCBUMPIB-JTDSTZFVSA-N 1 3 336.545 2.784 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)N2CCC[C@H]2CN2CCCCC2)cc1 ZINC000418464764 477475695 /nfs/dbraw/zinc/47/56/95/477475695.db2.gz QANZVSIOFHUNCW-LPHOPBHVSA-N 1 3 344.503 2.866 10 0 EFAEHO Fc1ccc(OCC[NH2+]C2CCN(c3ccncc3)CC2)c(F)c1 ZINC000436469651 477485482 /nfs/dbraw/zinc/48/54/82/477485482.db2.gz DJZIVMBDTFHDEP-UHFFFAOYSA-N 1 3 333.382 2.997 10 0 EFAEHO CC(C)C[C@H](NCc1cccc2ccoc21)C(=O)NCC[NH+](C)C ZINC000449204629 477485589 /nfs/dbraw/zinc/48/55/89/477485589.db2.gz MRPJWOJIHBENKU-KRWDZBQOSA-N 1 3 331.460 2.615 10 0 EFAEHO C[C@@H](Cc1ccccc1)N1CCC([NH2+]C[C@@](C)(O)C(F)(F)F)CC1 ZINC000449217185 477491409 /nfs/dbraw/zinc/49/14/09/477491409.db2.gz XOXFPPVZEUWETP-WMLDXEAASA-N 1 3 344.421 2.985 10 0 EFAEHO C[C@@H]1C[C@@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)C[N@@H+]1C1CC1 ZINC000371801596 477501686 /nfs/dbraw/zinc/50/16/86/477501686.db2.gz HJZRKWMIZAURCO-NVXWUHKLSA-N 1 3 343.515 2.853 10 0 EFAEHO C[C@@H]1C[C@@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)C[N@H+]1C1CC1 ZINC000371801596 477501692 /nfs/dbraw/zinc/50/16/92/477501692.db2.gz HJZRKWMIZAURCO-NVXWUHKLSA-N 1 3 343.515 2.853 10 0 EFAEHO C[C@@H]1OCC[C@]1(O)CNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449291280 477529527 /nfs/dbraw/zinc/52/95/27/477529527.db2.gz KENHDKBOYRJMDM-KXBFYZLASA-N 1 3 326.525 2.795 10 0 EFAEHO Cc1cc2c(ncnc2N2CCN(CC[C@@H]3CCC[NH2+]C3)CC2)s1 ZINC000420376256 477732809 /nfs/dbraw/zinc/73/28/09/477732809.db2.gz QFIBKAAPUKGGDI-HNNXBMFYSA-N 1 3 345.516 2.511 10 0 EFAEHO c1cc(OCCCN2CCCC[C@H]2[C@H]2CC[NH2+]C2)cc2c1OCO2 ZINC000420376198 477732872 /nfs/dbraw/zinc/73/28/72/477732872.db2.gz AIDHDPLOKBZAKY-RDJZCZTQSA-N 1 3 332.444 2.648 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)Nc2cccc(OCCN(C)C)c2)CC[N@@H+]1C ZINC000437782577 477752751 /nfs/dbraw/zinc/75/27/51/477752751.db2.gz WKJKSOMTOGETFM-DOTOQJQBSA-N 1 3 348.491 2.573 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)Nc2cccc(OCCN(C)C)c2)CC[N@H+]1C ZINC000437782577 477752754 /nfs/dbraw/zinc/75/27/54/477752754.db2.gz WKJKSOMTOGETFM-DOTOQJQBSA-N 1 3 348.491 2.573 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CCCN(C3CCCC3)CC2)CCCCC1 ZINC000426889545 477757358 /nfs/dbraw/zinc/75/73/58/477757358.db2.gz GEPZHODLVQKVSH-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO COCC[N@H+](C)CCCC1CCN([C@H](C)c2cnc(C)cn2)CC1 ZINC000428290612 477861098 /nfs/dbraw/zinc/86/10/98/477861098.db2.gz YUVCLYCSKHQAHO-QGZVFWFLSA-N 1 3 334.508 2.916 10 0 EFAEHO COCC[N@@H+](C)CCCC1CCN([C@H](C)c2cnc(C)cn2)CC1 ZINC000428290612 477861106 /nfs/dbraw/zinc/86/11/06/477861106.db2.gz YUVCLYCSKHQAHO-QGZVFWFLSA-N 1 3 334.508 2.916 10 0 EFAEHO C[N@H+](CC1CC1)C[C@H]1CCN([C@@H]2CCN(Cc3ccccc3)C2)C1 ZINC000459358744 477863126 /nfs/dbraw/zinc/86/31/26/477863126.db2.gz NDKCWVMOTFFIGM-NHCUHLMSSA-N 1 3 327.516 2.925 10 0 EFAEHO C[N@@H+](CC1CC1)C[C@H]1CCN([C@@H]2CCN(Cc3ccccc3)C2)C1 ZINC000459358744 477863138 /nfs/dbraw/zinc/86/31/38/477863138.db2.gz NDKCWVMOTFFIGM-NHCUHLMSSA-N 1 3 327.516 2.925 10 0 EFAEHO C[N@H+](CC1CC1)C[C@H]1CCN([C@H]2CCN(Cc3ccccc3)C2)C1 ZINC000459358746 477863471 /nfs/dbraw/zinc/86/34/71/477863471.db2.gz NDKCWVMOTFFIGM-RTWAWAEBSA-N 1 3 327.516 2.925 10 0 EFAEHO C[N@@H+](CC1CC1)C[C@H]1CCN([C@H]2CCN(Cc3ccccc3)C2)C1 ZINC000459358746 477863477 /nfs/dbraw/zinc/86/34/77/477863477.db2.gz NDKCWVMOTFFIGM-RTWAWAEBSA-N 1 3 327.516 2.925 10 0 EFAEHO CCN1CCC([N@@H+]2CCCN(CCOc3ccc(F)cc3)CC2)CC1 ZINC000420983243 477876415 /nfs/dbraw/zinc/87/64/15/477876415.db2.gz QHYOKCYOILTUKZ-UHFFFAOYSA-N 1 3 349.494 2.697 10 0 EFAEHO CCN1CCC([N@H+]2CCCN(CCOc3ccc(F)cc3)CC2)CC1 ZINC000420983243 477876425 /nfs/dbraw/zinc/87/64/25/477876425.db2.gz QHYOKCYOILTUKZ-UHFFFAOYSA-N 1 3 349.494 2.697 10 0 EFAEHO CC[NH+]1CCC(N2CCCN(CCOc3ccc(F)cc3)CC2)CC1 ZINC000420983243 477876430 /nfs/dbraw/zinc/87/64/30/477876430.db2.gz QHYOKCYOILTUKZ-UHFFFAOYSA-N 1 3 349.494 2.697 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@@](O)(CC)C2)CC1 ZINC000428433796 477894560 /nfs/dbraw/zinc/89/45/60/477894560.db2.gz UZTQTMIVRGTKQR-FQEVSTJZSA-N 1 3 331.504 2.565 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@@](O)(CC)C2)CC1 ZINC000428433796 477894570 /nfs/dbraw/zinc/89/45/70/477894570.db2.gz UZTQTMIVRGTKQR-FQEVSTJZSA-N 1 3 331.504 2.565 10 0 EFAEHO Cc1nc2ccc(CNCCN3CCC([NH+](C)C)CC3)cc2s1 ZINC000494117368 477926866 /nfs/dbraw/zinc/92/68/66/477926866.db2.gz SRVUPXRWVNSSHD-UHFFFAOYSA-N 1 3 332.517 2.720 10 0 EFAEHO Cc1nc2ccc(CNCC3(O)CC[NH+](C(C)C)CC3)cc2s1 ZINC000494196590 477942760 /nfs/dbraw/zinc/94/27/60/477942760.db2.gz XWWASOMGKZJOAR-UHFFFAOYSA-N 1 3 333.501 2.930 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000516837229 477991044 /nfs/dbraw/zinc/99/10/44/477991044.db2.gz UWIZKKOMLZBDDE-HXUWFJFHSA-N 1 3 331.504 2.889 10 0 EFAEHO Cn1cnc(CC[NH2+][C@@H]2CCC[C@H]3CN(Cc4ccccc4)C[C@@H]32)c1 ZINC000459654408 478024218 /nfs/dbraw/zinc/02/42/18/478024218.db2.gz FMKJNSQZGDUAHR-SESVDKBCSA-N 1 3 338.499 2.853 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439747333 478024508 /nfs/dbraw/zinc/02/45/08/478024508.db2.gz RTJFUMZPONDCEM-APWZRJJASA-N 1 3 344.503 2.598 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439747333 478024514 /nfs/dbraw/zinc/02/45/14/478024514.db2.gz RTJFUMZPONDCEM-APWZRJJASA-N 1 3 344.503 2.598 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH+]2CCC(CCO)CC2)CC1 ZINC000560440483 478078773 /nfs/dbraw/zinc/07/87/73/478078773.db2.gz CFYLGCVWBFFHBP-UHFFFAOYSA-N 1 3 345.531 2.813 10 0 EFAEHO CCN(C(=O)CC[NH2+]C1CC1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000517755991 478122024 /nfs/dbraw/zinc/12/20/24/478122024.db2.gz CCFRDRHVEVLXFS-QFBILLFUSA-N 1 3 329.488 2.813 10 0 EFAEHO C(CCN1CCO[C@H](C2CCC2)C1)CN1CCO[C@H](C2CCC2)C1 ZINC000560725575 478126612 /nfs/dbraw/zinc/12/66/12/478126612.db2.gz PIISPXBEDGCTQL-PMACEKPBSA-N 1 3 336.520 2.768 10 0 EFAEHO CC(C)C[C@H]([NH2+][C@H]1CS[C@@H](C(C)(C)C)C1)C(=O)NCCN(C)C ZINC000488436751 478149743 /nfs/dbraw/zinc/14/97/43/478149743.db2.gz VGWXEHIXCNCTMA-OWCLPIDISA-N 1 3 343.581 2.589 10 0 EFAEHO CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)CN1CC[C@@H](C)C1 ZINC000561269963 478173685 /nfs/dbraw/zinc/17/36/85/478173685.db2.gz JGFVEBFFXSCFQD-UYAOXDASSA-N 1 3 343.515 2.699 10 0 EFAEHO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)CN1CC[C@@H](C)C1 ZINC000561269963 478173689 /nfs/dbraw/zinc/17/36/89/478173689.db2.gz JGFVEBFFXSCFQD-UYAOXDASSA-N 1 3 343.515 2.699 10 0 EFAEHO CC[NH+](CC)CCO[C@@H]1CCN(CCN2CCCc3ccccc32)C1 ZINC000536377435 478249591 /nfs/dbraw/zinc/24/95/91/478249591.db2.gz GJYJBJBXPDCJNI-HXUWFJFHSA-N 1 3 345.531 2.872 10 0 EFAEHO CC(C)[C@H](C)NC(=O)C1CCN(Cc2ccc3c(c2)C[NH2+]CC3)CC1 ZINC000579363955 478279921 /nfs/dbraw/zinc/27/99/21/478279921.db2.gz NHIWMWVPEQTEJC-INIZCTEOSA-N 1 3 343.515 2.705 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3C[C@@H](C)CC[C@@H]3C)CC2)CC1 ZINC000570104846 478284293 /nfs/dbraw/zinc/28/42/93/478284293.db2.gz QFTPFMPPCRLPJR-IRXDYDNUSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3C[C@@H](C)CC[C@H]3C)CC2)CC1 ZINC000570104844 478284331 /nfs/dbraw/zinc/28/43/31/478284331.db2.gz QFTPFMPPCRLPJR-DLBZAZTESA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)(NCC(=O)NC1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC000520241670 478287870 /nfs/dbraw/zinc/28/78/70/478287870.db2.gz GSWVDTWIUVCLRA-UHFFFAOYSA-N 1 3 349.906 2.908 10 0 EFAEHO CC[NH+](CC)CCSCC(=O)NC[C@@H]1CCN1C1CCCCC1 ZINC000600229426 478298126 /nfs/dbraw/zinc/29/81/26/478298126.db2.gz SGQQRPTUIGZIHN-KRWDZBQOSA-N 1 3 341.565 2.585 10 0 EFAEHO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000579569031 478327842 /nfs/dbraw/zinc/32/78/42/478327842.db2.gz CJGYDAVKBZNMDD-ZIAGYGMSSA-N 1 3 348.466 2.713 10 0 EFAEHO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000579569031 478327852 /nfs/dbraw/zinc/32/78/52/478327852.db2.gz CJGYDAVKBZNMDD-ZIAGYGMSSA-N 1 3 348.466 2.713 10 0 EFAEHO C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000579569029 478328374 /nfs/dbraw/zinc/32/83/74/478328374.db2.gz CJGYDAVKBZNMDD-KGLIPLIRSA-N 1 3 348.466 2.713 10 0 EFAEHO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000579569029 478328385 /nfs/dbraw/zinc/32/83/85/478328385.db2.gz CJGYDAVKBZNMDD-KGLIPLIRSA-N 1 3 348.466 2.713 10 0 EFAEHO CC[NH2+]CCCNC(=O)N(CC)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000562814268 478359164 /nfs/dbraw/zinc/35/91/64/478359164.db2.gz OLHMBBRTJGNJIN-IEBWSBKVSA-N 1 3 346.519 2.853 10 0 EFAEHO C[C@@H]([NH2+]C1CCN(c2ccncc2)CC1)c1ccc(-n2ccnn2)cc1 ZINC000581586398 478391754 /nfs/dbraw/zinc/39/17/54/478391754.db2.gz WUOJJZFTOSZIFV-MRXNPFEDSA-N 1 3 348.454 2.982 10 0 EFAEHO C[NH+](C)Cc1cccc(CNC(=O)NC[C@H]2CCN2C2CCCC2)c1 ZINC000527658139 478465534 /nfs/dbraw/zinc/46/55/34/478465534.db2.gz FHRMCOHTXFMVIV-LJQANCHMSA-N 1 3 344.503 2.564 10 0 EFAEHO C[NH+](C)Cc1cccc(CNC(=O)NC[C@@H]2CCN2C2CCCC2)c1 ZINC000527658138 478466309 /nfs/dbraw/zinc/46/63/09/478466309.db2.gz FHRMCOHTXFMVIV-IBGZPJMESA-N 1 3 344.503 2.564 10 0 EFAEHO CCOC(=O)C1([C@H](C)N[C@@H](c2ccccn2)C2CCC2)CC[NH2+]CC1 ZINC000600708949 478478323 /nfs/dbraw/zinc/47/83/23/478478323.db2.gz MAZUEHYHLJXOFJ-MAUKXSAKSA-N 1 3 345.487 2.834 10 0 EFAEHO Cc1cc(CNCc2ccccc2C[N@@H+]2CCC[C@@H]2CO)ccn1 ZINC000527693621 478480634 /nfs/dbraw/zinc/48/06/34/478480634.db2.gz XPJOQKUTZPBEEI-HXUWFJFHSA-N 1 3 325.456 2.637 10 0 EFAEHO Cc1cc(CNCc2ccccc2C[N@H+]2CCC[C@@H]2CO)ccn1 ZINC000527693621 478480644 /nfs/dbraw/zinc/48/06/44/478480644.db2.gz XPJOQKUTZPBEEI-HXUWFJFHSA-N 1 3 325.456 2.637 10 0 EFAEHO CC(C)[C@H](CNC(=O)CCN(C)c1ccncc1)[NH+]1CCC(C)CC1 ZINC000540929418 478512035 /nfs/dbraw/zinc/51/20/35/478512035.db2.gz VSTVMIIGNBQANR-IBGZPJMESA-N 1 3 346.519 2.781 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1C[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC000527806280 478530009 /nfs/dbraw/zinc/53/00/09/478530009.db2.gz DXVLYGBAXIHESY-IBGZPJMESA-N 1 3 325.460 2.682 10 0 EFAEHO O[C@H](CN[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21)[C@@H]1CCCO1 ZINC000527955187 478586636 /nfs/dbraw/zinc/58/66/36/478586636.db2.gz QHUBLNPYWWRWNL-ONUIULTDSA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@H](CN[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21)[C@@H]1CCCO1 ZINC000527955187 478586640 /nfs/dbraw/zinc/58/66/40/478586640.db2.gz QHUBLNPYWWRWNL-ONUIULTDSA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@H](CN[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21)[C@H]1CCCO1 ZINC000527955191 478587163 /nfs/dbraw/zinc/58/71/63/478587163.db2.gz QHUBLNPYWWRWNL-SRHPJPHMSA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@H](CN[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21)[C@H]1CCCO1 ZINC000527955191 478587175 /nfs/dbraw/zinc/58/71/75/478587175.db2.gz QHUBLNPYWWRWNL-SRHPJPHMSA-N 1 3 344.499 2.559 10 0 EFAEHO CSCc1ccc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000597942305 478589306 /nfs/dbraw/zinc/58/93/06/478589306.db2.gz LIGJLPMOHRFNMR-HNNXBMFYSA-N 1 3 337.533 2.551 10 0 EFAEHO CSCc1ccc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000597942305 478589313 /nfs/dbraw/zinc/58/93/13/478589313.db2.gz LIGJLPMOHRFNMR-HNNXBMFYSA-N 1 3 337.533 2.551 10 0 EFAEHO COC(=O)[C@@H]1C[C@@H]1[C@@H](C)[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000594928413 478590269 /nfs/dbraw/zinc/59/02/69/478590269.db2.gz VUVWMWPZUJIUMA-KBRIMQKVSA-N 1 3 336.501 2.747 10 0 EFAEHO CCCC[N@H+](C)CC1CCN(C(=O)CCN(C)c2ccncc2)CC1 ZINC000541857585 478599362 /nfs/dbraw/zinc/59/93/62/478599362.db2.gz RXJVVBVQTYWKPR-UHFFFAOYSA-N 1 3 346.519 2.878 10 0 EFAEHO CCCC[N@@H+](C)CC1CCN(C(=O)CCN(C)c2ccncc2)CC1 ZINC000541857585 478599370 /nfs/dbraw/zinc/59/93/70/478599370.db2.gz RXJVVBVQTYWKPR-UHFFFAOYSA-N 1 3 346.519 2.878 10 0 EFAEHO C[C@@H](NC(=O)CCN(C)c1ccncc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541893821 478608458 /nfs/dbraw/zinc/60/84/58/478608458.db2.gz KPRBQDBZYPLTKW-SJORKVTESA-N 1 3 344.503 2.677 10 0 EFAEHO C[C@@H](NC(=O)CCN(C)c1ccncc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000541893821 478608463 /nfs/dbraw/zinc/60/84/63/478608463.db2.gz KPRBQDBZYPLTKW-SJORKVTESA-N 1 3 344.503 2.677 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]C[C@H]2CCN2C2CCCC2)[C@H](C)C1 ZINC000528014945 478613980 /nfs/dbraw/zinc/61/39/80/478613980.db2.gz VZHODDUKUKMVAO-RLLQIKCJSA-N 1 3 337.552 2.730 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]C[C@@H]2CCN2C2CCCC2)[C@@H](C)C1 ZINC000528014943 478614443 /nfs/dbraw/zinc/61/44/43/478614443.db2.gz VZHODDUKUKMVAO-IHPCNDPISA-N 1 3 337.552 2.730 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC[C@@H](O)COc2ccc(C)cc2)c1 ZINC000571516906 478614754 /nfs/dbraw/zinc/61/47/54/478614754.db2.gz UNNPVFZBUNGHGX-HXUWFJFHSA-N 1 3 342.483 2.976 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC[C@@H](O)COc2ccc(C)cc2)c1 ZINC000571516906 478614761 /nfs/dbraw/zinc/61/47/61/478614761.db2.gz UNNPVFZBUNGHGX-HXUWFJFHSA-N 1 3 342.483 2.976 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC[C@H](O)COc2ccc(C)cc2)c1 ZINC000571516905 478615419 /nfs/dbraw/zinc/61/54/19/478615419.db2.gz UNNPVFZBUNGHGX-FQEVSTJZSA-N 1 3 342.483 2.976 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC[C@H](O)COc2ccc(C)cc2)c1 ZINC000571516905 478615428 /nfs/dbraw/zinc/61/54/28/478615428.db2.gz UNNPVFZBUNGHGX-FQEVSTJZSA-N 1 3 342.483 2.976 10 0 EFAEHO CCc1nncn1CCN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000563870094 478650760 /nfs/dbraw/zinc/65/07/60/478650760.db2.gz SEEHRDOQQGQAJT-LDLYASANSA-N 1 3 339.487 2.626 10 0 EFAEHO CCc1nncn1CCN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000563870094 478650765 /nfs/dbraw/zinc/65/07/65/478650765.db2.gz SEEHRDOQQGQAJT-LDLYASANSA-N 1 3 339.487 2.626 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)C1 ZINC000582974006 478733586 /nfs/dbraw/zinc/73/35/86/478733586.db2.gz PQOKVVGKMUYKLQ-VKJFTORMSA-N 1 3 335.517 2.589 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)C1 ZINC000582974006 478733599 /nfs/dbraw/zinc/73/35/99/478733599.db2.gz PQOKVVGKMUYKLQ-VKJFTORMSA-N 1 3 335.517 2.589 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000582973695 478734000 /nfs/dbraw/zinc/73/40/00/478734000.db2.gz HGJZFFRIKJWZKJ-GGPKGHCWSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000582973695 478734006 /nfs/dbraw/zinc/73/40/06/478734006.db2.gz HGJZFFRIKJWZKJ-GGPKGHCWSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000582973697 478734679 /nfs/dbraw/zinc/73/46/79/478734679.db2.gz HGJZFFRIKJWZKJ-QWFCFKBJSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000582973697 478734685 /nfs/dbraw/zinc/73/46/85/478734685.db2.gz HGJZFFRIKJWZKJ-QWFCFKBJSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C[C@@H](O)CC2(O)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000528399731 478752748 /nfs/dbraw/zinc/75/27/48/478752748.db2.gz XJESIPCIYBMHNQ-HOJAQTOUSA-N 1 3 346.515 2.637 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C[C@@H](O)CC2(O)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000528399731 478752756 /nfs/dbraw/zinc/75/27/56/478752756.db2.gz XJESIPCIYBMHNQ-HOJAQTOUSA-N 1 3 346.515 2.637 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCC1CCN(C[C@@H](O)CC2(O)CCC2)CC1 ZINC000528404389 478758839 /nfs/dbraw/zinc/75/88/39/478758839.db2.gz NIINOEZMNIFXSS-MJGOQNOKSA-N 1 3 338.536 2.629 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCC1CCN(C[C@@H](O)CC2(O)CCC2)CC1 ZINC000528404389 478758849 /nfs/dbraw/zinc/75/88/49/478758849.db2.gz NIINOEZMNIFXSS-MJGOQNOKSA-N 1 3 338.536 2.629 10 0 EFAEHO CN(CCC(=O)NC[C@H]1CCC[N@@H+]1C1CCCCC1)c1ccncc1 ZINC000564628526 478771676 /nfs/dbraw/zinc/77/16/76/478771676.db2.gz UZPIWPJNDIKGEH-LJQANCHMSA-N 1 3 344.503 2.821 10 0 EFAEHO CN(CCC(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1)c1ccncc1 ZINC000564628526 478771681 /nfs/dbraw/zinc/77/16/81/478771681.db2.gz UZPIWPJNDIKGEH-LJQANCHMSA-N 1 3 344.503 2.821 10 0 EFAEHO CC(C)C[C@H](CNC(=O)C(N)C(F)(F)F)[NH2+][C@H](C)c1ccccc1 ZINC000564655191 478778845 /nfs/dbraw/zinc/77/88/45/478778845.db2.gz OAWCNQSJKINIQO-BPLDGKMQSA-N 1 3 345.409 2.758 10 0 EFAEHO CC[C@@H]1CCCC[N@@H+]1CCNC(=O)N1CCc2ccccc2[C@@H]1CN ZINC000564937616 478865190 /nfs/dbraw/zinc/86/51/90/478865190.db2.gz LWWGIQHDXVJJMS-MJGOQNOKSA-N 1 3 344.503 2.519 10 0 EFAEHO CC[C@@H]1CCCC[N@H+]1CCNC(=O)N1CCc2ccccc2[C@@H]1CN ZINC000564937616 478865197 /nfs/dbraw/zinc/86/51/97/478865197.db2.gz LWWGIQHDXVJJMS-MJGOQNOKSA-N 1 3 344.503 2.519 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000583741411 478929811 /nfs/dbraw/zinc/92/98/11/478929811.db2.gz YNDLOPSOQZOEIB-OKILXGFUSA-N 1 3 348.466 2.856 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000583741411 478929815 /nfs/dbraw/zinc/92/98/15/478929815.db2.gz YNDLOPSOQZOEIB-OKILXGFUSA-N 1 3 348.466 2.856 10 0 EFAEHO CCN(C(=O)N[C@@H](C)C[NH+](C)C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000512427033 478997633 /nfs/dbraw/zinc/99/76/33/478997633.db2.gz PMIBJIXSMOGOAC-YQVWRLOYSA-N 1 3 346.519 2.804 10 0 EFAEHO C[NH+](C)CCc1ccccc1NC(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000529076954 479043200 /nfs/dbraw/zinc/04/32/00/479043200.db2.gz FNPBRTYONKGCRA-SFHVURJKSA-N 1 3 344.503 2.929 10 0 EFAEHO COc1cccc([C@@H]2[C@H](N[C@@H]3CCC[C@H]([NH3+])C3)CCN2C2CC2)c1 ZINC000569867895 479195765 /nfs/dbraw/zinc/19/57/65/479195765.db2.gz QMLGKHAOBRBNDD-LNKGRISISA-N 1 3 329.488 2.833 10 0 EFAEHO c1ncn2cc(CN[C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)ccc12 ZINC000584714362 479214270 /nfs/dbraw/zinc/21/42/70/479214270.db2.gz KQHDZOJJUFDJQH-UYAOXDASSA-N 1 3 334.423 2.680 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(CN3CCC(C(N)=O)CC3)cc2)[C@@H]1C ZINC000556881903 479232218 /nfs/dbraw/zinc/23/22/18/479232218.db2.gz QZGKMUBJKOLWHS-SPYBWZPUSA-N 1 3 329.488 2.518 10 0 EFAEHO C[NH+](C)CCc1ccc(C(=O)NC[C@H]2CCN2C2CCCCC2)cc1 ZINC000529716503 479263866 /nfs/dbraw/zinc/26/38/66/479263866.db2.gz MSNCOLIKXVRNIQ-HXUWFJFHSA-N 1 3 343.515 2.928 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)C1 ZINC000557647437 479297730 /nfs/dbraw/zinc/29/77/30/479297730.db2.gz ZKQWZUYAKVNGLI-ROUUACIJSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)C1 ZINC000557647437 479297737 /nfs/dbraw/zinc/29/77/37/479297737.db2.gz ZKQWZUYAKVNGLI-ROUUACIJSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H](C[C@H](C)[NH3+])NCCc1ccc(I)cc1 ZINC000596653994 479373240 /nfs/dbraw/zinc/37/32/40/479373240.db2.gz MWWIIEGQCMDEKR-WDEREUQCSA-N 1 3 332.229 2.549 10 0 EFAEHO C[C@H](C[C@H](C)N)[NH2+]CCc1ccc(I)cc1 ZINC000596653994 479373244 /nfs/dbraw/zinc/37/32/44/479373244.db2.gz MWWIIEGQCMDEKR-WDEREUQCSA-N 1 3 332.229 2.549 10 0 EFAEHO C[C@@H]([NH3+])C[C@@H](C)NCCc1ccc(I)cc1 ZINC000596653984 479373766 /nfs/dbraw/zinc/37/37/66/479373766.db2.gz MWWIIEGQCMDEKR-GHMZBOCLSA-N 1 3 332.229 2.549 10 0 EFAEHO C[C@@H](N)C[C@@H](C)[NH2+]CCc1ccc(I)cc1 ZINC000596653984 479373772 /nfs/dbraw/zinc/37/37/72/479373772.db2.gz MWWIIEGQCMDEKR-GHMZBOCLSA-N 1 3 332.229 2.549 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)NC[C@H]2CCCCN2C2CC2)cc1 ZINC000575853609 479487759 /nfs/dbraw/zinc/48/77/59/479487759.db2.gz FQKZIYFEPBAZHQ-RDTXWAMCSA-N 1 3 330.476 2.522 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@H]1CCC[N@H+](C)C1)c1ccsc1 ZINC000618555345 479489866 /nfs/dbraw/zinc/48/98/66/479489866.db2.gz UIYHUPKIISGLEU-JKSUJKDBSA-N 1 3 338.521 2.524 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@H]1CCC[N@@H+](C)C1)c1ccsc1 ZINC000618555345 479489873 /nfs/dbraw/zinc/48/98/73/479489873.db2.gz UIYHUPKIISGLEU-JKSUJKDBSA-N 1 3 338.521 2.524 10 0 EFAEHO COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000600157500 479550548 /nfs/dbraw/zinc/55/05/48/479550548.db2.gz XJCJERLCBWVDKH-KBAYOESNSA-N 1 3 332.488 2.869 10 0 EFAEHO COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000600157500 479550553 /nfs/dbraw/zinc/55/05/53/479550553.db2.gz XJCJERLCBWVDKH-KBAYOESNSA-N 1 3 332.488 2.869 10 0 EFAEHO CC[NH+](CC)CCOc1ccc(NC(=O)N[C@H]2CCCN(C)C2)cc1 ZINC000605339838 479634584 /nfs/dbraw/zinc/63/45/84/479634584.db2.gz RRFWLAAWBZUOGV-KRWDZBQOSA-N 1 3 348.491 2.623 10 0 EFAEHO CC[C@H](C[NH+]1CCCC1)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000605374368 479638641 /nfs/dbraw/zinc/63/86/41/479638641.db2.gz XXVVARMCXDMHBU-LJQANCHMSA-N 1 3 329.488 2.887 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)CC[N@@H+]1C ZINC000633218448 479723224 /nfs/dbraw/zinc/72/32/24/479723224.db2.gz PMSWQXSNWPEYSZ-KSZLIROESA-N 1 3 349.544 2.858 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)CC[N@H+]1C ZINC000633218448 479723230 /nfs/dbraw/zinc/72/32/30/479723230.db2.gz PMSWQXSNWPEYSZ-KSZLIROESA-N 1 3 349.544 2.858 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000628051938 479747455 /nfs/dbraw/zinc/74/74/55/479747455.db2.gz SNMHWUAIJNSOKK-DFQSSKMNSA-N 1 3 345.531 2.959 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000628051938 479747458 /nfs/dbraw/zinc/74/74/58/479747458.db2.gz SNMHWUAIJNSOKK-DFQSSKMNSA-N 1 3 345.531 2.959 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@@H](C)[C@@H](CO)C2)CC1 ZINC000621738057 479777324 /nfs/dbraw/zinc/77/73/24/479777324.db2.gz YGLMSYPJJGJWQD-UYAOXDASSA-N 1 3 345.531 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@@H](C)[C@@H](CO)C2)CC1 ZINC000621738057 479777328 /nfs/dbraw/zinc/77/73/28/479777328.db2.gz YGLMSYPJJGJWQD-UYAOXDASSA-N 1 3 345.531 2.669 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC(C)(C)N[C@H](C)c2ccccc2)CC[N@@H+]1C ZINC000630919465 479778901 /nfs/dbraw/zinc/77/89/01/479778901.db2.gz XURCAORPZRLRMJ-BPQIPLTHSA-N 1 3 331.504 2.962 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC(C)(C)N[C@H](C)c2ccccc2)CC[N@H+]1C ZINC000630919465 479778905 /nfs/dbraw/zinc/77/89/05/479778905.db2.gz XURCAORPZRLRMJ-BPQIPLTHSA-N 1 3 331.504 2.962 10 0 EFAEHO COC(=O)CC1([NH2+]Cc2ccc(OCCN(C)C)cc2)CCCC1 ZINC000619431707 479788108 /nfs/dbraw/zinc/78/81/08/479788108.db2.gz ZCNPYYQGXVYNCE-UHFFFAOYSA-N 1 3 334.460 2.593 10 0 EFAEHO CN1CCN(Cc2ccc(C[NH2+]C[C@@]3(C)CCCS3)cc2)CC1 ZINC000628202219 479810638 /nfs/dbraw/zinc/81/06/38/479810638.db2.gz LQMPRYZNGYNGIA-LJQANCHMSA-N 1 3 333.545 2.809 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000625285615 479849761 /nfs/dbraw/zinc/84/97/61/479849761.db2.gz DUPWTSMIBONHKX-RTBURBONSA-N 1 3 331.504 2.522 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(Cc2ccccc2)C2CCN(C)CC2)CC[N@@H+]1C ZINC000631632995 480192504 /nfs/dbraw/zinc/19/25/04/480192504.db2.gz TVCIWVJQSAXYTE-VQTJNVASSA-N 1 3 343.515 2.840 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(Cc2ccccc2)C2CCN(C)CC2)CC[N@H+]1C ZINC000631632995 480192511 /nfs/dbraw/zinc/19/25/11/480192511.db2.gz TVCIWVJQSAXYTE-VQTJNVASSA-N 1 3 343.515 2.840 10 0 EFAEHO CN1CC[C@@H]([NH2+]C[C@H](c2ccc(F)cc2)N2CCOCC2)CC1(C)C ZINC000623337959 480238327 /nfs/dbraw/zinc/23/83/27/480238327.db2.gz DGVRCFPGTKCNTP-RTBURBONSA-N 1 3 349.494 2.661 10 0 EFAEHO CCC(CC)[C@H](CN[C@@H]1CC[N@H+](C)C(C)(C)C1)N1CCOCC1 ZINC000623353429 480245601 /nfs/dbraw/zinc/24/56/01/480245601.db2.gz LGSXYWUMSRPFBH-MSOLQXFVSA-N 1 3 325.541 2.586 10 0 EFAEHO CCC(CC)[C@H](CN[C@@H]1CC[N@@H+](C)C(C)(C)C1)N1CCOCC1 ZINC000623353429 480245608 /nfs/dbraw/zinc/24/56/08/480245608.db2.gz LGSXYWUMSRPFBH-MSOLQXFVSA-N 1 3 325.541 2.586 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(Cl)c(Cl)c1 ZINC000617503739 480247426 /nfs/dbraw/zinc/24/74/26/480247426.db2.gz WYJAQZWXECPYNV-LBPRGKRZSA-N 1 3 346.302 2.995 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(Cl)c(Cl)c1 ZINC000617503739 480247431 /nfs/dbraw/zinc/24/74/31/480247431.db2.gz WYJAQZWXECPYNV-LBPRGKRZSA-N 1 3 346.302 2.995 10 0 EFAEHO C[C@H](CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccc(F)cc1 ZINC000617504811 480247602 /nfs/dbraw/zinc/24/76/02/480247602.db2.gz LGWCXBZJRRGHCQ-CVEARBPZSA-N 1 3 337.483 2.708 10 0 EFAEHO C[C@H](CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccc(F)cc1 ZINC000617504811 480247608 /nfs/dbraw/zinc/24/76/08/480247608.db2.gz LGWCXBZJRRGHCQ-CVEARBPZSA-N 1 3 337.483 2.708 10 0 EFAEHO Cc1cccc(C2(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)CCC2)c1 ZINC000617504241 480248377 /nfs/dbraw/zinc/24/83/77/480248377.db2.gz MBAIGNZKEJUELZ-SFHVURJKSA-N 1 3 345.531 2.805 10 0 EFAEHO Cc1cccc(C2(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)CCC2)c1 ZINC000617504241 480248381 /nfs/dbraw/zinc/24/83/81/480248381.db2.gz MBAIGNZKEJUELZ-SFHVURJKSA-N 1 3 345.531 2.805 10 0 EFAEHO C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CCN(C)C(C)(C)C3)cn2)C[C@@H](C)O1 ZINC000623358127 480248715 /nfs/dbraw/zinc/24/87/15/480248715.db2.gz PASWMDSQTOKUHM-JFIYKMOQSA-N 1 3 346.519 2.658 10 0 EFAEHO Cc1cc(Cl)cc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000617506300 480249357 /nfs/dbraw/zinc/24/93/57/480249357.db2.gz JMCKTVHDFFDXKV-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO Cc1cc(Cl)cc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000617506300 480249363 /nfs/dbraw/zinc/24/93/63/480249363.db2.gz JMCKTVHDFFDXKV-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C[C@@H]1CCCc2ccccc21 ZINC000617506030 480249924 /nfs/dbraw/zinc/24/99/24/480249924.db2.gz YMCZYUHSGOMPRJ-HKUYNNGSSA-N 1 3 345.531 2.885 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C[C@@H]1CCCc2ccccc21 ZINC000617506030 480249929 /nfs/dbraw/zinc/24/99/29/480249929.db2.gz YMCZYUHSGOMPRJ-HKUYNNGSSA-N 1 3 345.531 2.885 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccccc1OC1CCC1 ZINC000617505914 480250130 /nfs/dbraw/zinc/25/01/30/480250130.db2.gz VICSYSHJHIHASJ-INIZCTEOSA-N 1 3 347.503 2.620 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccccc1OC1CCC1 ZINC000617505914 480250136 /nfs/dbraw/zinc/25/01/36/480250136.db2.gz VICSYSHJHIHASJ-INIZCTEOSA-N 1 3 347.503 2.620 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCCc2sccc21 ZINC000617506707 480250255 /nfs/dbraw/zinc/25/02/55/480250255.db2.gz WRIWLNJRKIYHSH-GOEBONIOSA-N 1 3 337.533 2.556 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCCc2sccc21 ZINC000617506707 480250260 /nfs/dbraw/zinc/25/02/60/480250260.db2.gz WRIWLNJRKIYHSH-GOEBONIOSA-N 1 3 337.533 2.556 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cccc2c1CCCC2 ZINC000617508205 480250455 /nfs/dbraw/zinc/25/04/55/480250455.db2.gz XOTZGYZFAXNRNE-INIZCTEOSA-N 1 3 331.504 2.567 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cccc2c1CCCC2 ZINC000617508205 480250460 /nfs/dbraw/zinc/25/04/60/480250460.db2.gz XOTZGYZFAXNRNE-INIZCTEOSA-N 1 3 331.504 2.567 10 0 EFAEHO Cc1ccccc1[C@H](C)CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617505995 480250981 /nfs/dbraw/zinc/25/09/81/480250981.db2.gz XJUJFCQTHWPKEV-MSOLQXFVSA-N 1 3 333.520 2.877 10 0 EFAEHO Cc1ccccc1[C@H](C)CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617505995 480250988 /nfs/dbraw/zinc/25/09/88/480250988.db2.gz XJUJFCQTHWPKEV-MSOLQXFVSA-N 1 3 333.520 2.877 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(-c2ccccc2)o1 ZINC000617506555 480251918 /nfs/dbraw/zinc/25/19/18/480251918.db2.gz SASIOIBSNBXMIA-INIZCTEOSA-N 1 3 343.471 2.948 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(-c2ccccc2)o1 ZINC000617506555 480251921 /nfs/dbraw/zinc/25/19/21/480251921.db2.gz SASIOIBSNBXMIA-INIZCTEOSA-N 1 3 343.471 2.948 10 0 EFAEHO Cc1nc(CN2CCC(C[NH2+][C@H]3CCN(C)C(C)(C)C3)CC2)oc1C ZINC000623414618 480272395 /nfs/dbraw/zinc/27/23/95/480272395.db2.gz KCPGLWBEHNASNE-SFHVURJKSA-N 1 3 348.535 2.966 10 0 EFAEHO CN1CCC(C[NH2+]Cc2cccc3n[nH]cc32)(N2CCCCC2)CC1 ZINC000623432081 480281889 /nfs/dbraw/zinc/28/18/89/480281889.db2.gz CEOBXTUYDYXWHI-UHFFFAOYSA-N 1 3 341.503 2.603 10 0 EFAEHO C[C@@H](NC(=O)[C@H](C)N1CCC([C@H]2CC[NH2+]C2)CC1)c1ccccc1 ZINC000631826013 480287141 /nfs/dbraw/zinc/28/71/41/480287141.db2.gz BKRZYUYGIKZLKA-GJYPPUQNSA-N 1 3 329.488 2.574 10 0 EFAEHO C[N@@H+]1CC[C@@H](N[C@H]2CCN(C(=O)CCc3ccccc3)C2)CC1(C)C ZINC000623445596 480288361 /nfs/dbraw/zinc/28/83/61/480288361.db2.gz XWPUZYFTGRHOFG-MOPGFXCFSA-N 1 3 343.515 2.683 10 0 EFAEHO C[N@H+]1CC[C@@H](N[C@H]2CCN(C(=O)CCc3ccccc3)C2)CC1(C)C ZINC000623445596 480288368 /nfs/dbraw/zinc/28/83/68/480288368.db2.gz XWPUZYFTGRHOFG-MOPGFXCFSA-N 1 3 343.515 2.683 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCC[C@@H](C2CC[NH2+]CC2)C1)c1ccccc1 ZINC000631829605 480288921 /nfs/dbraw/zinc/28/89/21/480288921.db2.gz VUSWCIDTXRLSFZ-MBOZVWFJSA-N 1 3 343.515 2.964 10 0 EFAEHO NC1(C[NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)CCOCC1 ZINC000629521059 480292840 /nfs/dbraw/zinc/29/28/40/480292840.db2.gz KXMSCFZVPUPPDO-AWEZNQCLSA-N 1 3 330.350 2.670 10 0 EFAEHO NC1(C[NH2+][C@H]2CCCc3ccc(Br)cc32)CCOCC1 ZINC000629522766 480293859 /nfs/dbraw/zinc/29/38/59/480293859.db2.gz AQTSNWIHDWHOBB-HNNXBMFYSA-N 1 3 339.277 2.924 10 0 EFAEHO NC1(C[NH2+][C@H](c2ccc(Br)cc2)C2CC2)CCOCC1 ZINC000629524054 480294821 /nfs/dbraw/zinc/29/48/21/480294821.db2.gz KFWHVUWDUJJRIX-HNNXBMFYSA-N 1 3 339.277 2.998 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1cc(F)c(Br)cc1F ZINC000629531426 480295957 /nfs/dbraw/zinc/29/59/57/480295957.db2.gz KUGUKAROLMBKRQ-JTQLQIEISA-N 1 3 337.208 2.571 10 0 EFAEHO [NH3+]C[C@H](Cc1ccccc1)[C@@H]1CCCCN1CCOC1CCOCC1 ZINC000629527652 480296893 /nfs/dbraw/zinc/29/68/93/480296893.db2.gz BMCRQYHUPIDMBD-FPOVZHCZSA-N 1 3 346.515 2.854 10 0 EFAEHO NC[C@H](Cc1ccccc1)[C@@H]1CCCC[N@@H+]1CCOC1CCOCC1 ZINC000629527652 480296900 /nfs/dbraw/zinc/29/69/00/480296900.db2.gz BMCRQYHUPIDMBD-FPOVZHCZSA-N 1 3 346.515 2.854 10 0 EFAEHO NC[C@H](Cc1ccccc1)[C@@H]1CCCC[N@H+]1CCOC1CCOCC1 ZINC000629527652 480296907 /nfs/dbraw/zinc/29/69/07/480296907.db2.gz BMCRQYHUPIDMBD-FPOVZHCZSA-N 1 3 346.515 2.854 10 0 EFAEHO CC[C@H](NCCOCCC[NH3+])c1cc(F)cc(Br)c1 ZINC000629536021 480297624 /nfs/dbraw/zinc/29/76/24/480297624.db2.gz DZEMPNOQMSSOBI-AWEZNQCLSA-N 1 3 333.245 2.994 10 0 EFAEHO [NH3+]CCCOCCN[C@H]1CCCc2c(Br)cccc21 ZINC000629536057 480297709 /nfs/dbraw/zinc/29/77/09/480297709.db2.gz FBQPFIVHQMBFRZ-HNNXBMFYSA-N 1 3 327.266 2.782 10 0 EFAEHO [NH3+]CCCOCCN[C@@H]1CCSc2ccc(Br)cc21 ZINC000629534724 480297721 /nfs/dbraw/zinc/29/77/21/480297721.db2.gz BKHWSGWFJGVEPV-CYBMUJFWSA-N 1 3 345.306 2.941 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000629540537 480297960 /nfs/dbraw/zinc/29/79/60/480297960.db2.gz VGYMMOALIVETGO-CZUORRHYSA-N 1 3 348.318 2.940 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000629540539 480298585 /nfs/dbraw/zinc/29/85/85/480298585.db2.gz VGYMMOALIVETGO-XJKSGUPXSA-N 1 3 348.318 2.940 10 0 EFAEHO CN1CC[C@H]([NH2+][C@H](CO)c2ccc(Br)cc2)CC1(C)C ZINC000623479232 480303130 /nfs/dbraw/zinc/30/31/30/480303130.db2.gz LFXLEWCUFZNRDJ-LSDHHAIUSA-N 1 3 341.293 2.945 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)CC1(C)C ZINC000623508168 480318115 /nfs/dbraw/zinc/31/81/15/480318115.db2.gz LGUFFFFQQMNYJK-KGLIPLIRSA-N 1 3 344.421 2.717 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)CC1(C)C ZINC000623508168 480318123 /nfs/dbraw/zinc/31/81/23/480318123.db2.gz LGUFFFFQQMNYJK-KGLIPLIRSA-N 1 3 344.421 2.717 10 0 EFAEHO C[N@@H+]1CC[C@@H](N[C@H]2CCN(C(=O)Nc3ccccc3)C2)CC1(C)C ZINC000623515548 480323107 /nfs/dbraw/zinc/32/31/07/480323107.db2.gz FQXIVRFIBWQYAE-SJORKVTESA-N 1 3 330.476 2.755 10 0 EFAEHO C[N@H+]1CC[C@@H](N[C@H]2CCN(C(=O)Nc3ccccc3)C2)CC1(C)C ZINC000623515548 480323111 /nfs/dbraw/zinc/32/31/11/480323111.db2.gz FQXIVRFIBWQYAE-SJORKVTESA-N 1 3 330.476 2.755 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3CCCC4(CC4)CC3)CC2)CC1 ZINC000629646277 480342785 /nfs/dbraw/zinc/34/27/85/480342785.db2.gz KLRVABOPLMRCOV-UHFFFAOYSA-N 1 3 347.547 2.975 10 0 EFAEHO C[NH2+]CCOCCN(C)Cc1ccc(-n2cnc3ccccc32)cc1 ZINC000629652557 480344752 /nfs/dbraw/zinc/34/47/52/480344752.db2.gz HBNGFHIQTOBVQF-UHFFFAOYSA-N 1 3 338.455 2.693 10 0 EFAEHO CC[C@@H]1CCCC[N@@H+]1CCNC(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000623610547 480360801 /nfs/dbraw/zinc/36/08/01/480360801.db2.gz XQARPKNBTGZQQX-AEFFLSMTSA-N 1 3 336.524 2.567 10 0 EFAEHO CC[C@@H]1CCCC[N@H+]1CCNC(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000623610547 480360806 /nfs/dbraw/zinc/36/08/06/480360806.db2.gz XQARPKNBTGZQQX-AEFFLSMTSA-N 1 3 336.524 2.567 10 0 EFAEHO CNCC(=O)Nc1ccc(-c2cc(C[NH+]3CCCC3)ccc2F)cn1 ZINC000629702289 480362940 /nfs/dbraw/zinc/36/29/40/480362940.db2.gz JPDNIKBBGHDPLU-UHFFFAOYSA-N 1 3 342.418 2.641 10 0 EFAEHO c1cc(C[NH2+]C[C@H]2CCN2C2CCCCC2)n(-c2ccncc2)n1 ZINC000623614891 480363218 /nfs/dbraw/zinc/36/32/18/480363218.db2.gz FEMOWEGBCDOHIK-GOSISDBHSA-N 1 3 325.460 2.764 10 0 EFAEHO c1cc(CNC[C@H]2CC[N@@H+]2C2CCCCC2)n(-c2ccncc2)n1 ZINC000623614891 480363223 /nfs/dbraw/zinc/36/32/23/480363223.db2.gz FEMOWEGBCDOHIK-GOSISDBHSA-N 1 3 325.460 2.764 10 0 EFAEHO c1cc(CNC[C@H]2CC[N@H+]2C2CCCCC2)n(-c2ccncc2)n1 ZINC000623614891 480363225 /nfs/dbraw/zinc/36/32/25/480363225.db2.gz FEMOWEGBCDOHIK-GOSISDBHSA-N 1 3 325.460 2.764 10 0 EFAEHO C[C@@H](CN1CCCCC1)NC(=O)NC[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC000623707769 480412241 /nfs/dbraw/zinc/41/22/41/480412241.db2.gz JXLMZAQVQWCBGL-WMZOPIPTSA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@@H](CN1CCCCC1)NC(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000623707769 480412249 /nfs/dbraw/zinc/41/22/49/480412249.db2.gz JXLMZAQVQWCBGL-WMZOPIPTSA-N 1 3 336.524 2.567 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2cncc(Cl)c2)[C@@H](C)C1 ZINC000621280012 480428572 /nfs/dbraw/zinc/42/85/72/480428572.db2.gz JJWUFRDWHWAJMP-YOEHRIQHSA-N 1 3 325.884 2.962 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]Cc2cncc(Cl)c2)[C@@H](C)C1 ZINC000621280011 480428603 /nfs/dbraw/zinc/42/86/03/480428603.db2.gz JJWUFRDWHWAJMP-WMLDXEAASA-N 1 3 325.884 2.962 10 0 EFAEHO C[C@@H](NC(=O)NC[C@@H]1CCN1C1CCCCC1)C(C)(C)C[NH+](C)C ZINC000623736994 480429057 /nfs/dbraw/zinc/42/90/57/480429057.db2.gz NIJNQKMNOPFKHX-WBVHZDCISA-N 1 3 338.540 2.669 10 0 EFAEHO C[C@H](NC(=O)NC[C@@H]1CCN1C1CCCCC1)C(C)(C)C[NH+](C)C ZINC000623736993 480429385 /nfs/dbraw/zinc/42/93/85/480429385.db2.gz NIJNQKMNOPFKHX-RDJZCZTQSA-N 1 3 338.540 2.669 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@H](O)C[C@@](C)(O)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000634708805 480451101 /nfs/dbraw/zinc/45/11/01/480451101.db2.gz ZHZRMQGYZFAHNH-QYRPDUKASA-N 1 3 346.515 2.541 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@H](O)C[C@@](C)(O)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000634708805 480451106 /nfs/dbraw/zinc/45/11/06/480451106.db2.gz ZHZRMQGYZFAHNH-QYRPDUKASA-N 1 3 346.515 2.541 10 0 EFAEHO CN(CC(=O)NCc1ccccc1C[NH+]1CCCCC1)C1CCC1 ZINC000629943941 480462434 /nfs/dbraw/zinc/46/24/34/480462434.db2.gz DSTSPAAYKAWGOC-UHFFFAOYSA-N 1 3 329.488 2.773 10 0 EFAEHO CC(C)OC[C@H](O)C[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000644619407 480477304 /nfs/dbraw/zinc/47/73/04/480477304.db2.gz GVHAQAGZKPNTGJ-MXEMCNAFSA-N 1 3 346.515 2.663 10 0 EFAEHO CC(C)OC[C@H](O)CN[C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000644619407 480477309 /nfs/dbraw/zinc/47/73/09/480477309.db2.gz GVHAQAGZKPNTGJ-MXEMCNAFSA-N 1 3 346.515 2.663 10 0 EFAEHO CC(C)OC[C@H](O)CN[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000644619407 480477315 /nfs/dbraw/zinc/47/73/15/480477315.db2.gz GVHAQAGZKPNTGJ-MXEMCNAFSA-N 1 3 346.515 2.663 10 0 EFAEHO CC(C)OC[C@H](O)C[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000644619408 480477351 /nfs/dbraw/zinc/47/73/51/480477351.db2.gz GVHAQAGZKPNTGJ-XRXFAXGQSA-N 1 3 346.515 2.663 10 0 EFAEHO CC(C)OC[C@H](O)CN[C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000644619408 480477354 /nfs/dbraw/zinc/47/73/54/480477354.db2.gz GVHAQAGZKPNTGJ-XRXFAXGQSA-N 1 3 346.515 2.663 10 0 EFAEHO CC(C)OC[C@H](O)CN[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000644619408 480477359 /nfs/dbraw/zinc/47/73/59/480477359.db2.gz GVHAQAGZKPNTGJ-XRXFAXGQSA-N 1 3 346.515 2.663 10 0 EFAEHO CCOc1cncc(C[NH2+]C[C@@H]2CN(C)C[C@H]2c2ccccc2)c1 ZINC000621367657 480478437 /nfs/dbraw/zinc/47/84/37/480478437.db2.gz CCQFQJBAMVGPTN-QUCCMNQESA-N 1 3 325.456 2.915 10 0 EFAEHO CN1CCN(Cc2ccc(N[C@H]3CC[N@H+](C)C(C)(C)C3)cc2)CC1 ZINC000623931172 480527613 /nfs/dbraw/zinc/52/76/13/480527613.db2.gz MUFGMSJCDQUXCG-IBGZPJMESA-N 1 3 330.520 2.719 10 0 EFAEHO CN1CCN(Cc2ccc(N[C@H]3CC[N@@H+](C)C(C)(C)C3)cc2)CC1 ZINC000623931172 480527619 /nfs/dbraw/zinc/52/76/19/480527619.db2.gz MUFGMSJCDQUXCG-IBGZPJMESA-N 1 3 330.520 2.719 10 0 EFAEHO CC[C@@H]1[NH2+]CC[C@H]1NC(=O)NC[C@@H](c1ccccc1)N(CC)CC ZINC000626921422 480581268 /nfs/dbraw/zinc/58/12/68/480581268.db2.gz ADZVLQJCCCBZKZ-KSZLIROESA-N 1 3 332.492 2.509 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@@H]1CC[NH2+]C12CCC2)c1ccccc1 ZINC000626921840 480581362 /nfs/dbraw/zinc/58/13/62/480581362.db2.gz KHGQNZLNKYRIMJ-QZTJIDSGSA-N 1 3 344.503 2.653 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](NC[C@@H]2Cc3ccccc3CO2)[C@@H](C)C1 ZINC000624054664 480585986 /nfs/dbraw/zinc/58/59/86/480585986.db2.gz JYQHUAUVZZHMRW-DZFGPLHGSA-N 1 3 346.515 2.855 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](NC[C@@H]2Cc3ccccc3CO2)[C@@H](C)C1 ZINC000624054664 480585990 /nfs/dbraw/zinc/58/59/90/480585990.db2.gz JYQHUAUVZZHMRW-DZFGPLHGSA-N 1 3 346.515 2.855 10 0 EFAEHO CC[C@@H]1[NH2+]CC[C@H]1NC(=O)NC[C@@H](c1ccsc1)N(CC)CC ZINC000626933212 480587757 /nfs/dbraw/zinc/58/77/57/480587757.db2.gz HWLOEJLTUARNKY-XHSDSOJGSA-N 1 3 338.521 2.571 10 0 EFAEHO C[C@@H](NC(C)(C)CNC(=O)N[C@H]1CC[C@@H](C)[NH2+]C1)c1ccccc1 ZINC000626977861 480608033 /nfs/dbraw/zinc/60/80/33/480608033.db2.gz FIROCSXILTULGT-INMHGKMJSA-N 1 3 332.492 2.556 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@@H]2CN(c3ccc(Cl)cc3)CCO2)CC[N@@H+]1C ZINC000624118862 480617167 /nfs/dbraw/zinc/61/71/67/480617167.db2.gz QNZCXGRFNNPDSK-UWWQBHOKSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H]1C[C@@H](NC[C@@H]2CN(c3ccc(Cl)cc3)CCO2)CC[N@H+]1C ZINC000624118862 480617171 /nfs/dbraw/zinc/61/71/71/480617171.db2.gz QNZCXGRFNNPDSK-UWWQBHOKSA-N 1 3 337.895 2.618 10 0 EFAEHO Brc1cccc2c1C[C@@H]1[C@H](NC3C[C@H]4CC[C@@H](C3)[NH2+]4)[C@H]21 ZINC000635003209 480683685 /nfs/dbraw/zinc/68/36/85/480683685.db2.gz GZFCCOKKMVWZOS-BGECWEHFSA-N 1 3 333.273 2.960 10 0 EFAEHO CC(C)(C(=O)N1CCC[C@H]([C@H]2CCC[NH2+]2)C1)[C@H](N)c1ccccc1 ZINC000645108331 480696466 /nfs/dbraw/zinc/69/64/66/480696466.db2.gz WUSDBFJYNSXSAC-RCCFBDPRSA-N 1 3 329.488 2.703 10 0 EFAEHO CC(C)(C(=O)N1CCC[C@H]([C@@H]2CCC[NH2+]2)C1)[C@H](N)c1ccccc1 ZINC000645108328 480696926 /nfs/dbraw/zinc/69/69/26/480696926.db2.gz WUSDBFJYNSXSAC-OKZBNKHCSA-N 1 3 329.488 2.703 10 0 EFAEHO c1ccc(N2CCN(CCCC[NH2+]CCC[C@H]3CCO3)CC2)cc1 ZINC000638387150 480700193 /nfs/dbraw/zinc/70/01/93/480700193.db2.gz UBQPFXLPCGZYEA-FQEVSTJZSA-N 1 3 331.504 2.748 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](CN2CCCC2)c2ccccc2)CC[N@@H+]1C ZINC000630681675 480841534 /nfs/dbraw/zinc/84/15/34/480841534.db2.gz LEBSKIOLJNPEPQ-GBESFXJTSA-N 1 3 329.488 2.670 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](CN2CCCC2)c2ccccc2)CC[N@H+]1C ZINC000630681675 480841538 /nfs/dbraw/zinc/84/15/38/480841538.db2.gz LEBSKIOLJNPEPQ-GBESFXJTSA-N 1 3 329.488 2.670 10 0 EFAEHO O=C(C[C@@H]1CCC[NH2+]C1)N[C@H]1CCCCCN(Cc2ccccc2)C1 ZINC000638851548 480895740 /nfs/dbraw/zinc/89/57/40/480895740.db2.gz OHKUULJQPFLJEJ-PMACEKPBSA-N 1 3 343.515 2.937 10 0 EFAEHO O=C(C[C@@H]1CC[NH2+]C1)N[C@@H]1CCCCCN(Cc2ccccc2)C1 ZINC000638850870 480896232 /nfs/dbraw/zinc/89/62/32/480896232.db2.gz HWQUMSRKFWVYDE-RBUKOAKNSA-N 1 3 329.488 2.547 10 0 EFAEHO O=C(N[C@@H]1CCCCCN(Cc2ccccc2)C1)C1CC[NH2+]CC1 ZINC000638850744 480896565 /nfs/dbraw/zinc/89/65/65/480896565.db2.gz GUHTVIDFEQBPPD-LJQANCHMSA-N 1 3 329.488 2.547 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647542702 480990300 /nfs/dbraw/zinc/99/03/00/480990300.db2.gz ACWKTCJGSDHVGJ-QZTJIDSGSA-N 1 3 339.487 2.787 10 0 EFAEHO COc1cc(CN2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)cc2c1OCCO2 ZINC000647543237 480993941 /nfs/dbraw/zinc/99/39/41/480993941.db2.gz JWDIKOQWORYMKN-DLBZAZTESA-N 1 3 346.471 2.678 10 0 EFAEHO Cc1cccc(C2(NCC(=O)NC3CC[NH+](C4CC4)CC3)CCC2)c1 ZINC000646021737 481026017 /nfs/dbraw/zinc/02/60/17/481026017.db2.gz YIXYBHHQUCIVDM-UHFFFAOYSA-N 1 3 341.499 2.707 10 0 EFAEHO Cc1cccc([C@@H](C)NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1C ZINC000664144014 481049448 /nfs/dbraw/zinc/04/94/48/481049448.db2.gz FXPDDFKEFBCYRT-FUHWJXTLSA-N 1 3 348.535 2.936 10 0 EFAEHO Cc1cccc([C@@H](C)NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1C ZINC000664144014 481049453 /nfs/dbraw/zinc/04/94/53/481049453.db2.gz FXPDDFKEFBCYRT-FUHWJXTLSA-N 1 3 348.535 2.936 10 0 EFAEHO C[C@H](NC(C)(C)CNC(=O)[C@H]1CC[C@@H](C2CC2)[NH2+]1)c1ccccc1 ZINC000653117176 481090423 /nfs/dbraw/zinc/09/04/23/481090423.db2.gz CDUMKYKZBGUYQD-JCGIZDLHSA-N 1 3 329.488 2.763 10 0 EFAEHO CCN1CCN(c2ccccc2N[C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000647789307 481106297 /nfs/dbraw/zinc/10/62/97/481106297.db2.gz ANUFZLUAIFFITF-KZNAEPCWSA-N 1 3 328.504 2.629 10 0 EFAEHO CN(C)CCC[N@H+](C)CCNc1ncnc2[nH]c3cc(F)ccc3c21 ZINC000664246229 481128545 /nfs/dbraw/zinc/12/85/45/481128545.db2.gz VHEXXJMUHYWAJX-UHFFFAOYSA-N 1 3 344.438 2.546 10 0 EFAEHO CN(C)CCC[N@@H+](C)CCNc1ncnc2[nH]c3cc(F)ccc3c21 ZINC000664246229 481128549 /nfs/dbraw/zinc/12/85/49/481128549.db2.gz VHEXXJMUHYWAJX-UHFFFAOYSA-N 1 3 344.438 2.546 10 0 EFAEHO CCN(C(=O)Nc1ccccc1CC[NH+](C)C)[C@@H]1CCN(CC)C1 ZINC000666838667 481137011 /nfs/dbraw/zinc/13/70/11/481137011.db2.gz AESTUGAONNNSPV-QGZVFWFLSA-N 1 3 332.492 2.739 10 0 EFAEHO C[C@@H]1C[NH2+]CC[C@H]1NC(=O)N[C@@H](CN1CCCCC1)c1ccccc1 ZINC000669483903 481152251 /nfs/dbraw/zinc/15/22/51/481152251.db2.gz RWTISHJLVRDHAC-QRQLOZEOSA-N 1 3 344.503 2.511 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@@H](CNC(=O)Nc2ccc3c(c2F)CCNC3)C1 ZINC000659022042 481167784 /nfs/dbraw/zinc/16/77/84/481167784.db2.gz KZFJGLGWQKLWHK-ZDUSSCGKSA-N 1 3 348.466 2.713 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)Nc2ccc3c(c2F)CCNC3)C1 ZINC000659022042 481167791 /nfs/dbraw/zinc/16/77/91/481167791.db2.gz KZFJGLGWQKLWHK-ZDUSSCGKSA-N 1 3 348.466 2.713 10 0 EFAEHO c1ccc(C[N@H+]2C[C@@H](CNC3CSC3)C3(C2)CCOCC3)cc1 ZINC000646245137 481179099 /nfs/dbraw/zinc/17/90/99/481179099.db2.gz DONJJDDSNHDCEL-QGZVFWFLSA-N 1 3 332.513 2.620 10 0 EFAEHO c1ccc(C[N@@H+]2C[C@@H](CNC3CSC3)C3(C2)CCOCC3)cc1 ZINC000646245137 481179102 /nfs/dbraw/zinc/17/91/02/481179102.db2.gz DONJJDDSNHDCEL-QGZVFWFLSA-N 1 3 332.513 2.620 10 0 EFAEHO c1ccc(CN2C[C@@H](C[NH2+]C3CSC3)C3(C2)CCOCC3)cc1 ZINC000646245137 481179108 /nfs/dbraw/zinc/17/91/08/481179108.db2.gz DONJJDDSNHDCEL-QGZVFWFLSA-N 1 3 332.513 2.620 10 0 EFAEHO CCCC[N@H+](C)C[C@H](C)NC(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659040383 481182661 /nfs/dbraw/zinc/18/26/61/481182661.db2.gz DVMNAYBUXZLJJY-MAUKXSAKSA-N 1 3 348.491 2.589 10 0 EFAEHO CCCC[N@@H+](C)C[C@H](C)NC(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659040383 481182672 /nfs/dbraw/zinc/18/26/72/481182672.db2.gz DVMNAYBUXZLJJY-MAUKXSAKSA-N 1 3 348.491 2.589 10 0 EFAEHO CCCC[N@H+](C)C[C@@H](C)NC(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659040382 481182979 /nfs/dbraw/zinc/18/29/79/481182979.db2.gz DVMNAYBUXZLJJY-CRAIPNDOSA-N 1 3 348.491 2.589 10 0 EFAEHO CCCC[N@@H+](C)C[C@@H](C)NC(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659040382 481182986 /nfs/dbraw/zinc/18/29/86/481182986.db2.gz DVMNAYBUXZLJJY-CRAIPNDOSA-N 1 3 348.491 2.589 10 0 EFAEHO CCC[N@H+](CC)C[C@@H](C)NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659047215 481188129 /nfs/dbraw/zinc/18/81/29/481188129.db2.gz QNOGEHRBBORFRN-QAPCUYQASA-N 1 3 348.491 2.589 10 0 EFAEHO CCC[N@@H+](CC)C[C@@H](C)NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659047215 481188138 /nfs/dbraw/zinc/18/81/38/481188138.db2.gz QNOGEHRBBORFRN-QAPCUYQASA-N 1 3 348.491 2.589 10 0 EFAEHO Cc1nn(-c2ccc(F)cc2F)c(C)c1CN[C@H]1CC12CC[NH2+]CC2 ZINC000666953598 481217291 /nfs/dbraw/zinc/21/72/91/481217291.db2.gz BRUWEMADCKKMLF-SFHVURJKSA-N 1 3 346.425 2.999 10 0 EFAEHO CCN(Cc1ccccc1)C(=O)CN1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647974875 481226483 /nfs/dbraw/zinc/22/64/83/481226483.db2.gz ABXGVNDOGJIPCF-WOJBJXKFSA-N 1 3 343.515 2.747 10 0 EFAEHO Cn1c2ccccc2cc(CN2CCC(C[NH+]3CCCC3)CC2)c1=O ZINC000653496663 481283807 /nfs/dbraw/zinc/28/38/07/481283807.db2.gz BJGVJZSWFUBJCG-UHFFFAOYSA-N 1 3 339.483 2.846 10 0 EFAEHO Cc1c2cccc(C)c2oc1C[N@H+](C)C[C@H]1CCCN(C(=O)CN)C1 ZINC000650720388 481287460 /nfs/dbraw/zinc/28/74/60/481287460.db2.gz NHSFGFHKDOOQKT-MRXNPFEDSA-N 1 3 343.471 2.679 10 0 EFAEHO Cc1c2cccc(C)c2oc1C[N@@H+](C)C[C@H]1CCCN(C(=O)CN)C1 ZINC000650720388 481287466 /nfs/dbraw/zinc/28/74/66/481287466.db2.gz NHSFGFHKDOOQKT-MRXNPFEDSA-N 1 3 343.471 2.679 10 0 EFAEHO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCCN2Cc2cccc3c2OCCCO3)C1 ZINC000650722225 481289347 /nfs/dbraw/zinc/28/93/47/481289347.db2.gz NJUPAWIOCCBPME-ZHALLVOQSA-N 1 3 346.471 2.709 10 0 EFAEHO CCOc1cc(CN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)ccc1OC ZINC000650722609 481289528 /nfs/dbraw/zinc/28/95/28/481289528.db2.gz XVHKYALLGJKUOH-SCTDSRPQSA-N 1 3 348.487 2.955 10 0 EFAEHO COc1cc(CN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)cc(OC)c1 ZINC000650722631 481290074 /nfs/dbraw/zinc/29/00/74/481290074.db2.gz YFRLSIKBFYEUIZ-KFKAGJAMSA-N 1 3 334.460 2.565 10 0 EFAEHO CC[C@H](OCCN[C@@H]1CCOC[C@@H]1[C@H]1CCC[NH2+]1)c1ccccc1 ZINC000650742456 481308994 /nfs/dbraw/zinc/30/89/94/481308994.db2.gz YLDGIICPQDFWBT-WTGUMLROSA-N 1 3 332.488 2.901 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@@H]1CCO[C@H](c2ccncc2)C1 ZINC000650752319 481315253 /nfs/dbraw/zinc/31/52/53/481315253.db2.gz OPTBSETWKNRFMQ-NRXGSXMXSA-N 1 3 326.444 2.815 10 0 EFAEHO [NH3+][C@@H]1CCCCCC[C@@H]1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659368292 481389539 /nfs/dbraw/zinc/38/95/39/481389539.db2.gz OSGAPVKSBVTCQF-RCCFBDPRSA-N 1 3 331.460 2.584 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000659426752 481428190 /nfs/dbraw/zinc/42/81/90/481428190.db2.gz CGUOIHZROKOFBN-HUUCEWRRSA-N 1 3 338.521 2.558 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)NC1CCN([C@H](C)c2ccccc2)CC1 ZINC000659456291 481447376 /nfs/dbraw/zinc/44/73/76/481447376.db2.gz KEXDOSDTTOLIAI-VQIMIIECSA-N 1 3 346.519 2.885 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N[C@@H](CN1CCCCC1)c1ccccc1 ZINC000659457305 481447972 /nfs/dbraw/zinc/44/79/72/481447972.db2.gz YULAMBBXMOWRDF-MOPGFXCFSA-N 1 3 346.519 2.886 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000659465733 481452422 /nfs/dbraw/zinc/45/24/22/481452422.db2.gz RHBIFPYNAPELJY-NZSAHSFTSA-N 1 3 346.519 2.712 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C ZINC000659466029 481453989 /nfs/dbraw/zinc/45/39/89/481453989.db2.gz OGSJQSVVISVSMB-QRQLOZEOSA-N 1 3 346.519 2.570 10 0 EFAEHO CC(=O)[C@@](C)(O)C[NH+]1CCC2(CCN(Cc3ccccc3)CC2)CC1 ZINC000639725190 481460915 /nfs/dbraw/zinc/46/09/15/481460915.db2.gz ISASRJHWQAYJHF-FQEVSTJZSA-N 1 3 344.499 2.705 10 0 EFAEHO Cc1ccccc1[C@@H]([C@@H](C)NC(=O)NCC[C@@H]([NH3+])C(C)C)N(C)C ZINC000659491909 481468360 /nfs/dbraw/zinc/46/83/60/481468360.db2.gz FTAQCTAEATXIJM-KBAYOESNSA-N 1 3 334.508 2.659 10 0 EFAEHO CN(CC[NH+]1CCCCC1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000650996078 481490374 /nfs/dbraw/zinc/49/03/74/481490374.db2.gz WUAHWYYHABXEGX-RBUKOAKNSA-N 1 3 344.503 2.559 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000650995281 481490548 /nfs/dbraw/zinc/49/05/48/481490548.db2.gz CKYDHFUYPNYJMG-RTBURBONSA-N 1 3 346.519 2.709 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000650995281 481490551 /nfs/dbraw/zinc/49/05/51/481490551.db2.gz CKYDHFUYPNYJMG-RTBURBONSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@@H]([NH2+]CC(=O)NC1CCN(C2CC2)CC1)C1CCC(F)(F)CC1 ZINC000653868968 481504371 /nfs/dbraw/zinc/50/43/71/481504371.db2.gz NVODZZVSADTJQG-CYBMUJFWSA-N 1 3 343.462 2.533 10 0 EFAEHO CC1(C)C[N@H+](CCOCCO)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000664835317 481507049 /nfs/dbraw/zinc/50/70/49/481507049.db2.gz CZYQHINKJJKGAI-FQEVSTJZSA-N 1 3 346.515 2.618 10 0 EFAEHO CC1(C)C[N@@H+](CCOCCO)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000664835317 481507054 /nfs/dbraw/zinc/50/70/54/481507054.db2.gz CZYQHINKJJKGAI-FQEVSTJZSA-N 1 3 346.515 2.618 10 0 EFAEHO CC[C@H](C(N)=O)N1CC(C)(C)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664837722 481508081 /nfs/dbraw/zinc/50/80/81/481508081.db2.gz XLELTIPOAMINMZ-RTBURBONSA-N 1 3 343.515 2.873 10 0 EFAEHO CNC(=O)CC[N@@H+]1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000664839174 481509616 /nfs/dbraw/zinc/50/96/16/481509616.db2.gz ZYUYENQWEZPPFB-FQEVSTJZSA-N 1 3 343.515 2.745 10 0 EFAEHO CNC(=O)CC[N@H+]1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000664839174 481509624 /nfs/dbraw/zinc/50/96/24/481509624.db2.gz ZYUYENQWEZPPFB-FQEVSTJZSA-N 1 3 343.515 2.745 10 0 EFAEHO CCn1cnnc1CCNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000648400001 481518575 /nfs/dbraw/zinc/51/85/75/481518575.db2.gz UOJISGASMBIPBF-QGZVFWFLSA-N 1 3 341.503 2.526 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000659624479 481521215 /nfs/dbraw/zinc/52/12/15/481521215.db2.gz UXWRPNBPJZFRHC-IEBWSBKVSA-N 1 3 346.519 2.666 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NCCOC[C@H]2CCOC2)CC1 ZINC000648444776 481552236 /nfs/dbraw/zinc/55/22/36/481552236.db2.gz GVMFAAXSGVNZNS-ICSRJNTNSA-N 1 3 346.515 2.725 10 0 EFAEHO CC[N@H+](Cc1ccc(C(=O)N2CC[C@@H]3CN(C)C[C@@H]32)cc1)C(C)C ZINC000646928287 481556773 /nfs/dbraw/zinc/55/67/73/481556773.db2.gz XFXWRKORYKHRNI-MOPGFXCFSA-N 1 3 329.488 2.693 10 0 EFAEHO CC[N@@H+](Cc1ccc(C(=O)N2CC[C@@H]3CN(C)C[C@@H]32)cc1)C(C)C ZINC000646928287 481556782 /nfs/dbraw/zinc/55/67/82/481556782.db2.gz XFXWRKORYKHRNI-MOPGFXCFSA-N 1 3 329.488 2.693 10 0 EFAEHO OC1(CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)CCSCC1 ZINC000659876429 481615668 /nfs/dbraw/zinc/61/56/68/481615668.db2.gz BAKDVFAFFCGIBD-KRWDZBQOSA-N 1 3 326.550 2.833 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)N1CCC[C@H]1CN1CCCCC1 ZINC000651192167 481616174 /nfs/dbraw/zinc/61/61/74/481616174.db2.gz DBAOODBZHLRGGV-SFHVURJKSA-N 1 3 338.540 2.624 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)N1CCC[C@H]1CN1CCCCC1 ZINC000651192167 481616179 /nfs/dbraw/zinc/61/61/79/481616179.db2.gz DBAOODBZHLRGGV-SFHVURJKSA-N 1 3 338.540 2.624 10 0 EFAEHO CN(CCN1CC[NH+](C[C@@H]2C[C@H]3C[C@H]3C2)CC1)Cc1ccccc1 ZINC000659912201 481639442 /nfs/dbraw/zinc/63/94/42/481639442.db2.gz LSXBHOGYWKYDBK-WKCHPHFGSA-N 1 3 327.516 2.782 10 0 EFAEHO C[N@H+](CCCc1cc(-c2ccccc2)no1)C[C@H]1CCC2(CNC2)O1 ZINC000662252906 481667590 /nfs/dbraw/zinc/66/75/90/481667590.db2.gz DAILNWBQJFGWCJ-GOSISDBHSA-N 1 3 341.455 2.727 10 0 EFAEHO C[N@@H+](CCCc1cc(-c2ccccc2)no1)C[C@H]1CCC2(CNC2)O1 ZINC000662252906 481667601 /nfs/dbraw/zinc/66/76/01/481667601.db2.gz DAILNWBQJFGWCJ-GOSISDBHSA-N 1 3 341.455 2.727 10 0 EFAEHO c1csc(CCN2CCN(Cc3cccc4c3CC[NH2+]C4)CC2)c1 ZINC000662261558 481674302 /nfs/dbraw/zinc/67/43/02/481674302.db2.gz ZXBRMBIKZCBYHN-UHFFFAOYSA-N 1 3 341.524 2.754 10 0 EFAEHO COc1ncncc1CNCC1CC[NH+](Cc2cccs2)CC1 ZINC000647177150 481686514 /nfs/dbraw/zinc/68/65/14/481686514.db2.gz NGZRMZUKJWSKTC-UHFFFAOYSA-N 1 3 332.473 2.549 10 0 EFAEHO CCC[N@H+](C[C@H]1CCC2(CNC2)O1)[C@H](C)CC(=O)Nc1ccccc1 ZINC000662283527 481691338 /nfs/dbraw/zinc/69/13/38/481691338.db2.gz UTVPEDBOHYEONU-SJLPKXTDSA-N 1 3 345.487 2.637 10 0 EFAEHO CCC[N@@H+](C[C@H]1CCC2(CNC2)O1)[C@H](C)CC(=O)Nc1ccccc1 ZINC000662283527 481691345 /nfs/dbraw/zinc/69/13/45/481691345.db2.gz UTVPEDBOHYEONU-SJLPKXTDSA-N 1 3 345.487 2.637 10 0 EFAEHO O=C1[C@H](N2CCC[C@H](C3CC[NH2+]CC3)C2)CCCN1c1ccccc1 ZINC000662294626 481701600 /nfs/dbraw/zinc/70/16/00/481701600.db2.gz CYGMGGCVVMCILE-AZUAARDMSA-N 1 3 341.499 2.894 10 0 EFAEHO O=C(CN1CCC[C@H](C2CC[NH2+]CC2)C1)Nc1ccc2c(c1)CCC2 ZINC000662296222 481702766 /nfs/dbraw/zinc/70/27/66/481702766.db2.gz YJJZWJUSIBUKBS-IBGZPJMESA-N 1 3 341.499 2.825 10 0 EFAEHO CCc1ccc(NC(=O)CN2CCC[C@@H](C3CC[NH2+]CC3)C2)cc1 ZINC000662296090 481704151 /nfs/dbraw/zinc/70/41/51/481704151.db2.gz VXGSGFJQJZSNDZ-GOSISDBHSA-N 1 3 329.488 2.899 10 0 EFAEHO CCn1nc(C)c(C[NH2+]C[C@@H]2CN(C)C[C@H]2c2ccccc2)c1C ZINC000647249047 481728722 /nfs/dbraw/zinc/72/87/22/481728722.db2.gz ZYQYJTKKEWHRPF-QUCCMNQESA-N 1 3 326.488 2.955 10 0 EFAEHO CC(C)(CC[N@@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1)C1CC1 ZINC000662337022 481734943 /nfs/dbraw/zinc/73/49/43/481734943.db2.gz IGBWFEMHCGHHOZ-INIZCTEOSA-N 1 3 345.535 2.825 10 0 EFAEHO CC(C)(CC[N@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1)C1CC1 ZINC000662337022 481734953 /nfs/dbraw/zinc/73/49/53/481734953.db2.gz IGBWFEMHCGHHOZ-INIZCTEOSA-N 1 3 345.535 2.825 10 0 EFAEHO c1ccc2c(CCN[C@@H]3CCOC[C@H]3[C@H]3CCC[NH2+]3)ccnc2c1 ZINC000665239091 481737641 /nfs/dbraw/zinc/73/76/41/481737641.db2.gz LXJMEURHKMSGLY-DFQSSKMNSA-N 1 3 325.456 2.524 10 0 EFAEHO C[C@H](C[C@@H]1CCCCC[NH2+]1)NCc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000665240266 481739575 /nfs/dbraw/zinc/73/95/75/481739575.db2.gz GSEFWIQZEGYKGW-QMMLZNLJSA-N 1 3 345.531 2.654 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1cc(Cl)ccc1F ZINC000665251664 481746516 /nfs/dbraw/zinc/74/65/16/481746516.db2.gz WAJICYLKNBDORY-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1cc(Cl)ccc1F ZINC000665251664 481746519 /nfs/dbraw/zinc/74/65/19/481746519.db2.gz WAJICYLKNBDORY-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO CC(C)C[C@@H]([NH2+][C@H]1CCN(C2CCN(C)CC2)C1)c1ccncc1 ZINC000647288682 481746909 /nfs/dbraw/zinc/74/69/09/481746909.db2.gz KWRAZDWWYYSCNX-AZUAARDMSA-N 1 3 330.520 2.927 10 0 EFAEHO CC(C)C[C@@H](NC1CC[NH+](CCC(=O)N(C)C)CC1)c1ccncc1 ZINC000647288416 481747567 /nfs/dbraw/zinc/74/75/67/481747567.db2.gz CDMICRWTLFPFCV-LJQANCHMSA-N 1 3 346.519 2.701 10 0 EFAEHO CCOc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@@H]2CN(C3CC3)C[C@@H]2C)cc1 ZINC000665255195 481750456 /nfs/dbraw/zinc/75/04/56/481750456.db2.gz LHVBUGYUTKDJPQ-FCRQHZQGSA-N 1 3 343.515 2.603 10 0 EFAEHO C[C@@H](C[C@@H]1CCCCC[NH2+]1)N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2 ZINC000665274816 481761966 /nfs/dbraw/zinc/76/19/66/481761966.db2.gz YWAPVUKIMAQWRE-INDMIFKZSA-N 1 3 335.536 2.530 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)c1ccc2c(c1)[C@@H](C[NH3+])CCC2 ZINC000662387941 481777964 /nfs/dbraw/zinc/77/79/64/481777964.db2.gz NJBSESSTOXTAQX-MAUKXSAKSA-N 1 3 329.488 2.669 10 0 EFAEHO CC1CC[NH+](CCCCNC(=O)C[C@H]2NCc3ccccc32)CC1 ZINC000662388901 481778014 /nfs/dbraw/zinc/77/80/14/481778014.db2.gz PLZSSHIDBQAMJW-LJQANCHMSA-N 1 3 329.488 2.849 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)C[C@@H]2NCc3ccccc32)C1 ZINC000662387849 481779124 /nfs/dbraw/zinc/77/91/24/481779124.db2.gz XFBIEUXYUSZIGM-MDZRGWNJSA-N 1 3 329.488 2.705 10 0 EFAEHO C[C@@H](CNC(=O)c1ccc2c(c1)[C@H](C[NH3+])CCC2)N1CCC[C@@H](C)C1 ZINC000662389347 481781385 /nfs/dbraw/zinc/78/13/85/481781385.db2.gz WPTIJUBQQCFABD-GJYPPUQNSA-N 1 3 343.515 2.915 10 0 EFAEHO CSc1cccc(C[N@@H+]2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)c1 ZINC000660156910 481791754 /nfs/dbraw/zinc/79/17/54/481791754.db2.gz SKIKHJUYYXGOPF-APWZRJJASA-N 1 3 333.545 2.866 10 0 EFAEHO CSc1cccc(C[N@H+]2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)c1 ZINC000660156910 481791763 /nfs/dbraw/zinc/79/17/63/481791763.db2.gz SKIKHJUYYXGOPF-APWZRJJASA-N 1 3 333.545 2.866 10 0 EFAEHO c1ccc(N2CCN(CCCC[NH2+][C@H]3CO[C@@H](C4CC4)C3)CC2)cc1 ZINC000667793022 481807866 /nfs/dbraw/zinc/80/78/66/481807866.db2.gz PEEGBZXGLTUDTA-TZIWHRDSSA-N 1 3 343.515 2.746 10 0 EFAEHO CCN(CCC[NH+](CC)CC)C(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000665357111 481816357 /nfs/dbraw/zinc/81/63/57/481816357.db2.gz FDDBBTSXNBGSBI-INIZCTEOSA-N 1 3 326.529 2.623 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000665363878 481821318 /nfs/dbraw/zinc/82/13/18/481821318.db2.gz DURFPNPDGMZLJQ-DLBZAZTESA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000665363776 481822463 /nfs/dbraw/zinc/82/24/63/481822463.db2.gz BXJXWXDVHHDNBG-KRWDZBQOSA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)N1CCC[N@H+](C2CCCC2)CC1 ZINC000665363776 481822470 /nfs/dbraw/zinc/82/24/70/481822470.db2.gz BXJXWXDVHHDNBG-KRWDZBQOSA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000665365820 481822607 /nfs/dbraw/zinc/82/26/07/481822607.db2.gz LSEDPWGBKGKZHI-IRXDYDNUSA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000665366426 481824916 /nfs/dbraw/zinc/82/49/16/481824916.db2.gz YZEKGUCSZRTHCM-DLBZAZTESA-N 1 3 336.524 2.519 10 0 EFAEHO CSc1ccc(NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000665391480 481843620 /nfs/dbraw/zinc/84/36/20/481843620.db2.gz AHJBRULMLAYXGK-AWEZNQCLSA-N 1 3 338.521 2.802 10 0 EFAEHO CSc1ccc(NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000665391480 481843630 /nfs/dbraw/zinc/84/36/30/481843630.db2.gz AHJBRULMLAYXGK-AWEZNQCLSA-N 1 3 338.521 2.802 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)N[C@H]1CCCC12CCCCC2 ZINC000665454009 481878134 /nfs/dbraw/zinc/87/81/34/481878134.db2.gz ZOJWSWDOXGIHRY-KRWDZBQOSA-N 1 3 338.540 2.624 10 0 EFAEHO Cc1cccc(O[C@@H]2CCCC[C@@H]2[NH2+]C[C@H](O)CN(C)C(C)C)c1 ZINC000660321343 481895488 /nfs/dbraw/zinc/89/54/88/481895488.db2.gz OFDQDKMCCLMFAM-YSIASYRMSA-N 1 3 334.504 2.976 10 0 EFAEHO O=C(N1CCC[N@H+](CC2CCCCC2)CC1)C1(NC2CC2)CCC1 ZINC000662689829 481934676 /nfs/dbraw/zinc/93/46/76/481934676.db2.gz IZMJWGARNNKSIY-UHFFFAOYSA-N 1 3 333.520 2.776 10 0 EFAEHO O=C(N1CCC[N@@H+](CC2CCCCC2)CC1)C1(NC2CC2)CCC1 ZINC000662689829 481934680 /nfs/dbraw/zinc/93/46/80/481934680.db2.gz IZMJWGARNNKSIY-UHFFFAOYSA-N 1 3 333.520 2.776 10 0 EFAEHO CC[C@H](C)[C@H](N)C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662710157 481943815 /nfs/dbraw/zinc/94/38/15/481943815.db2.gz DTZMFUHXANWWBN-WDSOQIARSA-N 1 3 343.515 2.778 10 0 EFAEHO CC[C@H](C)[C@H](N)C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662710157 481943820 /nfs/dbraw/zinc/94/38/20/481943820.db2.gz DTZMFUHXANWWBN-WDSOQIARSA-N 1 3 343.515 2.778 10 0 EFAEHO CCC[C@@](C)(N)C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662713281 481945278 /nfs/dbraw/zinc/94/52/78/481945278.db2.gz YRFDJNUYGIOWIB-AZUAARDMSA-N 1 3 343.515 2.922 10 0 EFAEHO CCC[C@@](C)(N)C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662713281 481945285 /nfs/dbraw/zinc/94/52/85/481945285.db2.gz YRFDJNUYGIOWIB-AZUAARDMSA-N 1 3 343.515 2.922 10 0 EFAEHO N[C@H](C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)C1CCC1 ZINC000662716116 481947020 /nfs/dbraw/zinc/94/70/20/481947020.db2.gz QUTPQDCXYKAZEK-OALUTQOASA-N 1 3 341.499 2.532 10 0 EFAEHO N[C@H](C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)C1CCC1 ZINC000662716116 481947023 /nfs/dbraw/zinc/94/70/23/481947023.db2.gz QUTPQDCXYKAZEK-OALUTQOASA-N 1 3 341.499 2.532 10 0 EFAEHO CC[C@H](N)C(=O)N1CC(C)(C)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000662759556 481961450 /nfs/dbraw/zinc/96/14/50/481961450.db2.gz SZRYBQIOJSBOPC-RBUKOAKNSA-N 1 3 343.515 2.873 10 0 EFAEHO C[C@H](c1ccccc1)N(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000665637141 481972488 /nfs/dbraw/zinc/97/24/88/481972488.db2.gz VNOXHPJAMAZJSV-DLBZAZTESA-N 1 3 334.508 2.661 10 0 EFAEHO C[C@H](c1ccccc1)N(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000665637141 481972493 /nfs/dbraw/zinc/97/24/93/481972493.db2.gz VNOXHPJAMAZJSV-DLBZAZTESA-N 1 3 334.508 2.661 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CCC[C@H]1C1CCCC1 ZINC000665639305 481973883 /nfs/dbraw/zinc/97/38/83/481973883.db2.gz UKXSLHBICZQHQP-WMZOPIPTSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CCC[C@H]1C1CCCC1 ZINC000665639305 481973889 /nfs/dbraw/zinc/97/38/89/481973889.db2.gz UKXSLHBICZQHQP-WMZOPIPTSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1C[C@@H](C)c2ccccc21 ZINC000665638739 481974944 /nfs/dbraw/zinc/97/49/44/481974944.db2.gz AHYRDJBFXVPLEE-CVEARBPZSA-N 1 3 332.492 2.592 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1C[C@@H](C)c2ccccc21 ZINC000665638739 481974949 /nfs/dbraw/zinc/97/49/49/481974949.db2.gz AHYRDJBFXVPLEE-CVEARBPZSA-N 1 3 332.492 2.592 10 0 EFAEHO C[C@H](NC(=O)C1(NC2CC2)CCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000662805335 481978500 /nfs/dbraw/zinc/97/85/00/481978500.db2.gz WOPDBSQXEYKRQW-WMZOPIPTSA-N 1 3 341.499 2.688 10 0 EFAEHO C[C@H](NC(=O)C1(NC2CC2)CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000662805335 481978506 /nfs/dbraw/zinc/97/85/06/481978506.db2.gz WOPDBSQXEYKRQW-WMZOPIPTSA-N 1 3 341.499 2.688 10 0 EFAEHO CC(C)CN(C)CCC[NH2+]C1CCN(C(=O)CC(C)(C)C)CC1 ZINC000651865638 481980929 /nfs/dbraw/zinc/98/09/29/481980929.db2.gz BMKCLWJJBIAERM-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC1CCN(C(=O)CC(C)(C)C)CC1 ZINC000651865638 481980930 /nfs/dbraw/zinc/98/09/30/481980930.db2.gz BMKCLWJJBIAERM-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC1CCN(C(=O)CC(C)(C)C)CC1 ZINC000651865638 481980932 /nfs/dbraw/zinc/98/09/32/481980932.db2.gz BMKCLWJJBIAERM-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC[C@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000651865281 481981318 /nfs/dbraw/zinc/98/13/18/481981318.db2.gz SJRYSUWQCAEABL-INIZCTEOSA-N 1 3 340.533 2.761 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC[C@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000651865281 481981322 /nfs/dbraw/zinc/98/13/22/481981322.db2.gz SJRYSUWQCAEABL-INIZCTEOSA-N 1 3 340.533 2.761 10 0 EFAEHO O=C(NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)[C@H]1CCCCN1 ZINC000662919556 482012639 /nfs/dbraw/zinc/01/26/39/482012639.db2.gz NQWNCFCUEKVTOP-RTBURBONSA-N 1 3 341.499 2.547 10 0 EFAEHO O=C(NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)[C@H]1CCCCN1 ZINC000662919556 482012641 /nfs/dbraw/zinc/01/26/41/482012641.db2.gz NQWNCFCUEKVTOP-RTBURBONSA-N 1 3 341.499 2.547 10 0 EFAEHO O=C(N[C@@H]1CCCN2CCCC[C@H]12)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000654729643 482018603 /nfs/dbraw/zinc/01/86/03/482018603.db2.gz UQHZZPREFYXHRD-IPMKNSEASA-N 1 3 348.535 2.663 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1[C@H](C)C[C@@H]2CCCC[C@H]21 ZINC000665760016 482039070 /nfs/dbraw/zinc/03/90/70/482039070.db2.gz WMSUATLHEZUIHZ-XWTMOSNGSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1[C@H](C)C[C@@H]2CCCC[C@H]21 ZINC000665760016 482039077 /nfs/dbraw/zinc/03/90/77/482039077.db2.gz WMSUATLHEZUIHZ-XWTMOSNGSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1cccc2[nH]ccc21 ZINC000665927616 482112589 /nfs/dbraw/zinc/11/25/89/482112589.db2.gz MCRAOAADVKINHP-AWEZNQCLSA-N 1 3 331.464 2.561 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1cccc2[nH]ccc21 ZINC000665927616 482112593 /nfs/dbraw/zinc/11/25/93/482112593.db2.gz MCRAOAADVKINHP-AWEZNQCLSA-N 1 3 331.464 2.561 10 0 EFAEHO C[C@H](Cc1ccc(O)cc1)[NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000668488571 482141673 /nfs/dbraw/zinc/14/16/73/482141673.db2.gz BUWPGKURKPCMKE-IERDGZPVSA-N 1 3 340.467 2.680 10 0 EFAEHO CN(c1ccccc1C[N@@H+]1C[C@@H]2COC[C@@]2(C)C1)C1CCN(C)CC1 ZINC000668596075 482182685 /nfs/dbraw/zinc/18/26/85/482182685.db2.gz CUNLHBCSRTVGOG-WIYYLYMNSA-N 1 3 343.515 2.685 10 0 EFAEHO CN(c1ccccc1C[N@H+]1C[C@@H]2COC[C@@]2(C)C1)C1CCN(C)CC1 ZINC000668596075 482182690 /nfs/dbraw/zinc/18/26/90/482182690.db2.gz CUNLHBCSRTVGOG-WIYYLYMNSA-N 1 3 343.515 2.685 10 0 EFAEHO CCc1cccc(OCCN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)c1 ZINC000652360847 482192922 /nfs/dbraw/zinc/19/29/22/482192922.db2.gz RWLPXGCECAXJGL-SXLOBPIMSA-N 1 3 332.488 2.989 10 0 EFAEHO CCOc1ccc(OCCN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)cc1 ZINC000652360905 482194167 /nfs/dbraw/zinc/19/41/67/482194167.db2.gz TUIJGUVWIHAEMO-PWIZWCRZSA-N 1 3 348.487 2.825 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000663419995 482222494 /nfs/dbraw/zinc/22/24/94/482222494.db2.gz KKHJODFVILZRRX-KRWDZBQOSA-N 1 3 334.508 2.709 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000663419995 482222502 /nfs/dbraw/zinc/22/25/02/482222502.db2.gz KKHJODFVILZRRX-KRWDZBQOSA-N 1 3 334.508 2.709 10 0 EFAEHO O[C@@H]1CCN(C2CC[NH+](CCCCCOc3ccccc3)CC2)C1 ZINC000668740010 482240572 /nfs/dbraw/zinc/24/05/72/482240572.db2.gz QTXWIWFYFTXXOZ-LJQANCHMSA-N 1 3 332.488 2.767 10 0 EFAEHO CCC(CC)[C@@H](CNC(=O)N(CC)[C@H]1CCN(C)C1)[NH+]1CCCC1 ZINC000663560561 482300425 /nfs/dbraw/zinc/30/04/25/482300425.db2.gz WOYOFOAXLIOWNN-ZWKOTPCHSA-N 1 3 338.540 2.623 10 0 EFAEHO C/C(=C/c1ccc(Cl)cc1)C[NH2+]CCCN1CCC[C@@H](C(N)=O)C1 ZINC000119094264 518411640 /nfs/dbraw/zinc/41/16/40/518411640.db2.gz OLBHIWUFWLBFOH-MLRPBERTSA-N 1 3 349.906 2.920 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+]2CC3(CCCC3)OC(C)(C)C2)CC1 ZINC000192842393 519681658 /nfs/dbraw/zinc/68/16/58/519681658.db2.gz POUIVAZGTCFVEK-UHFFFAOYSA-N 1 3 337.552 2.826 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+]2CC3(CCCC3)OC(C)(C)C2)CC1 ZINC000192842393 519681660 /nfs/dbraw/zinc/68/16/60/519681660.db2.gz POUIVAZGTCFVEK-UHFFFAOYSA-N 1 3 337.552 2.826 10 0 EFAEHO CCC[C@H](C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)N(C)C ZINC000245931885 520985776 /nfs/dbraw/zinc/98/57/76/520985776.db2.gz YQNZQZWEBUTDHH-YTQUADARSA-N 1 3 331.504 2.886 10 0 EFAEHO CCC[C@H](C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)N(C)C ZINC000245931885 520985780 /nfs/dbraw/zinc/98/57/80/520985780.db2.gz YQNZQZWEBUTDHH-YTQUADARSA-N 1 3 331.504 2.886 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(C)C(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000245868853 521652355 /nfs/dbraw/zinc/65/23/55/521652355.db2.gz RAEUGPNKOBRZJC-MJGOQNOKSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(C)C(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000245868853 521652356 /nfs/dbraw/zinc/65/23/56/521652356.db2.gz RAEUGPNKOBRZJC-MJGOQNOKSA-N 1 3 346.519 2.633 10 0 EFAEHO CN(C)CCOc1ccccc1C(=O)NCCC[NH+]1CCCCCC1 ZINC000063654658 521802646 /nfs/dbraw/zinc/80/26/46/521802646.db2.gz KPYXGUCJAOJACF-UHFFFAOYSA-N 1 3 347.503 2.623 10 0 EFAEHO C[NH2+]C1CCN(C(=O)[C@H](C)N2CCC(Cc3ccccc3)CC2)CC1 ZINC000179138749 521950721 /nfs/dbraw/zinc/95/07/21/521950721.db2.gz VJDPGRUIMCXWST-KRWDZBQOSA-N 1 3 343.515 2.540 10 0 EFAEHO COC(=O)[C@@H]1C[C@@H](c2ccccc2)C[N@H+](CC[C@@H]2CCCN2C)C1 ZINC000245575191 523770247 /nfs/dbraw/zinc/77/02/47/523770247.db2.gz HOGFMKNYUDXDHH-QRVBRYPASA-N 1 3 330.472 2.749 10 0 EFAEHO COC(=O)[C@@H]1C[C@@H](c2ccccc2)C[N@@H+](CC[C@@H]2CCCN2C)C1 ZINC000245575191 523770251 /nfs/dbraw/zinc/77/02/51/523770251.db2.gz HOGFMKNYUDXDHH-QRVBRYPASA-N 1 3 330.472 2.749 10 0 EFAEHO COC(=O)[C@H]1C[C@H](c2ccccc2)C[N@H+](CCCN2CCCC2)C1 ZINC000120860220 523992498 /nfs/dbraw/zinc/99/24/98/523992498.db2.gz GRLQGARQGRXSMI-OALUTQOASA-N 1 3 330.472 2.751 10 0 EFAEHO COC(=O)[C@H]1C[C@H](c2ccccc2)C[N@@H+](CCCN2CCCC2)C1 ZINC000120860220 523992499 /nfs/dbraw/zinc/99/24/99/523992499.db2.gz GRLQGARQGRXSMI-OALUTQOASA-N 1 3 330.472 2.751 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)N2CC[C@@H]([NH+](C)C)C2)CC1 ZINC000116561430 526097278 /nfs/dbraw/zinc/09/72/78/526097278.db2.gz TWWUPBWKNASMOW-VQIMIIECSA-N 1 3 344.503 2.558 10 0 EFAEHO O=C(c1ccccc1)N1CCC([NH2+][C@@H]2CCN3CCC[C@H]3C2)CC1 ZINC000246093008 526791205 /nfs/dbraw/zinc/79/12/05/526791205.db2.gz CNXIEXNFYHWZON-MOPGFXCFSA-N 1 3 327.472 2.508 10 0 EFAEHO O=C(c1ccccc1)N1CCC(N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000246093008 526791211 /nfs/dbraw/zinc/79/12/11/526791211.db2.gz CNXIEXNFYHWZON-MOPGFXCFSA-N 1 3 327.472 2.508 10 0 EFAEHO O=C(c1ccccc1)N1CCC(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)CC1 ZINC000246093008 526791217 /nfs/dbraw/zinc/79/12/17/526791217.db2.gz CNXIEXNFYHWZON-MOPGFXCFSA-N 1 3 327.472 2.508 10 0 EFAEHO O=C1C[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)CN1C1CC1 ZINC000245742369 527030661 /nfs/dbraw/zinc/03/06/61/527030661.db2.gz RUYIXCKJMQWNOD-QGZVKYPTSA-N 1 3 339.483 2.535 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCC2(O)CCC2)CC1 ZINC000341334055 534937244 /nfs/dbraw/zinc/93/72/44/534937244.db2.gz HVJVDSUAJYOBEX-UHFFFAOYSA-N 1 3 331.504 2.613 10 0 EFAEHO CCC1(CNCc2ccncc2OCCC[NH+](C)C)CCOCC1 ZINC000342418125 535295136 /nfs/dbraw/zinc/29/51/36/535295136.db2.gz NZJHANJSSLNXAI-UHFFFAOYSA-N 1 3 335.492 2.709 10 0 EFAEHO CCCC[C@@H](COC)[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000414294952 535358879 /nfs/dbraw/zinc/35/88/79/535358879.db2.gz CNWUZQKPOIJKIP-IBGZPJMESA-N 1 3 334.504 2.808 10 0 EFAEHO CCN1CCCC[C@@H]1CNC(=O)C1CCN(c2cc[nH+]cc2C)CC1 ZINC000364388959 535480318 /nfs/dbraw/zinc/48/03/18/535480318.db2.gz SLQUIFNWGDIOSP-GOSISDBHSA-N 1 3 344.503 2.597 10 0 EFAEHO CCN1CCCC[C@H]1CNC(=O)C1CCN(c2cc[nH+]cc2C)CC1 ZINC000364388961 535504350 /nfs/dbraw/zinc/50/43/50/535504350.db2.gz SLQUIFNWGDIOSP-SFHVURJKSA-N 1 3 344.503 2.597 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@@H]2CCCC[C@H]2[C@H]2CCOC2)CC1 ZINC000365067046 535694782 /nfs/dbraw/zinc/69/47/82/535694782.db2.gz UQCPXVNTCBTFHZ-SLFFLAALSA-N 1 3 337.552 2.589 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@@H]2CCCC[C@H]2[C@@H]2CCOC2)CC1 ZINC000365067045 535694970 /nfs/dbraw/zinc/69/49/70/535694970.db2.gz UQCPXVNTCBTFHZ-HSALFYBXSA-N 1 3 337.552 2.589 10 0 EFAEHO CCN1CCN(C[C@H](C)C[NH2+][C@H](C)c2cnn(C3CCCC3)c2)CC1 ZINC000337504691 535718546 /nfs/dbraw/zinc/71/85/46/535718546.db2.gz DPHXEODUJDYDCB-QZTJIDSGSA-N 1 3 347.551 2.922 10 0 EFAEHO C[NH+](C)C[C@@H]1CCCN1C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000427726886 535942408 /nfs/dbraw/zinc/94/24/08/535942408.db2.gz OGNPBOGGMZPQTC-HKUYNNGSSA-N 1 3 347.478 2.590 10 0 EFAEHO COc1cccc(N2CC[C@H](CN[C@H]3CC[N@@H+]4CCC[C@H]4C3)C2)c1 ZINC000339069082 545921771 /nfs/dbraw/zinc/92/17/71/545921771.db2.gz QROORKGZJYOVNS-SQNIBIBYSA-N 1 3 329.488 2.738 10 0 EFAEHO COc1cccc(N2CC[C@H](CN[C@H]3CC[N@H+]4CCC[C@H]4C3)C2)c1 ZINC000339069082 545921774 /nfs/dbraw/zinc/92/17/74/545921774.db2.gz QROORKGZJYOVNS-SQNIBIBYSA-N 1 3 329.488 2.738 10 0 EFAEHO COc1cccc(N2CC[C@H](C[NH2+][C@H]3CCN4CCC[C@H]4C3)C2)c1 ZINC000339069082 545921778 /nfs/dbraw/zinc/92/17/78/545921778.db2.gz QROORKGZJYOVNS-SQNIBIBYSA-N 1 3 329.488 2.738 10 0 EFAEHO O=C(NCc1ccccc1CN1CCCCC1)[C@@H]1C[C@]12CCC[NH2+]C2 ZINC000655442916 546449666 /nfs/dbraw/zinc/44/96/66/546449666.db2.gz GMBPOWKOOAMRRY-FPOVZHCZSA-N 1 3 341.499 2.678 10 0 EFAEHO Cc1c([C@H](C)NC[C@H]2C[C@@H]([NH+](C)C)C2)nnn1-c1ccc(F)cc1 ZINC000655806180 546592318 /nfs/dbraw/zinc/59/23/18/546592318.db2.gz QPBQSBRDDBRFEC-RVSPLBMKSA-N 1 3 331.439 2.706 10 0 EFAEHO [NH3+]Cc1cccc(-c2cn([C@@H]3CCN(Cc4ccccc4)C3)nn2)c1 ZINC000656455498 546806205 /nfs/dbraw/zinc/80/62/05/546806205.db2.gz JMTXSTSAYOKCSP-LJQANCHMSA-N 1 3 333.439 2.851 10 0 EFAEHO C[C@@H]1CCC[C@@](C[NH2+]Cc2ccnn2-c2ccncc2)(N(C)C)C1 ZINC000657327806 547113746 /nfs/dbraw/zinc/11/37/46/547113746.db2.gz YNLJHPNSBHBRBM-VQIMIIECSA-N 1 3 327.476 2.867 10 0 EFAEHO CC(C)n1ccnc1CNCC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000657377541 547136158 /nfs/dbraw/zinc/13/61/58/547136158.db2.gz PONJKKJEOBVAMC-UHFFFAOYSA-N 1 3 333.524 2.504 10 0 EFAEHO Cc1cccc2[nH]c(CN[C@@H](CC(C)C)C(=O)NCC[NH+](C)C)cc21 ZINC000657420393 547155991 /nfs/dbraw/zinc/15/59/91/547155991.db2.gz WWHCQVIIZWIIHQ-IBGZPJMESA-N 1 3 344.503 2.658 10 0 EFAEHO COc1cccc(CNCC2CC[NH+](C3CCOCC3)CC2)c1OC ZINC000657536494 547196725 /nfs/dbraw/zinc/19/67/25/547196725.db2.gz KJKKVTGEJKJUIT-UHFFFAOYSA-N 1 3 348.487 2.684 10 0 EFAEHO COc1ccc(CNCC2CC[NH+](C3CCOCC3)CC2)c(OC)c1 ZINC000657536078 547197070 /nfs/dbraw/zinc/19/70/70/547197070.db2.gz FHPLDOVCXZWCEE-UHFFFAOYSA-N 1 3 348.487 2.684 10 0 EFAEHO c1c2cnccc2oc1CNCC1CC[NH+](C2CCOCC2)CC1 ZINC000657538137 547197157 /nfs/dbraw/zinc/19/71/57/547197157.db2.gz YQODBQWOEWDAMU-UHFFFAOYSA-N 1 3 329.444 2.808 10 0 EFAEHO Cc1ncc(CN[C@@H](C)CN(C)CCC[NH+](C)C)n1-c1ccccc1 ZINC000657574328 547212486 /nfs/dbraw/zinc/21/24/86/547212486.db2.gz WIJOPCIIGKWKTN-KRWDZBQOSA-N 1 3 343.519 2.542 10 0 EFAEHO CO[C@@H]1CCC[C@H]([C@H](CO)[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000657576445 547214748 /nfs/dbraw/zinc/21/47/48/547214748.db2.gz KYSZOBNDAMVWJJ-DBVUQKKJSA-N 1 3 338.536 2.939 10 0 EFAEHO CO[C@@H]1CCC[C@H]([C@H](CO)NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000657576445 547214753 /nfs/dbraw/zinc/21/47/53/547214753.db2.gz KYSZOBNDAMVWJJ-DBVUQKKJSA-N 1 3 338.536 2.939 10 0 EFAEHO O[C@H]1CCN(Cc2ccc(C[NH2+][C@H]3CCc4ccccc4C3)cc2)C1 ZINC000657593955 547220188 /nfs/dbraw/zinc/22/01/88/547220188.db2.gz DMHXBOFWVKDNIR-VXKWHMMOSA-N 1 3 336.479 2.900 10 0 EFAEHO COCC1CCC([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)CC1 ZINC000657594806 547222994 /nfs/dbraw/zinc/22/29/94/547222994.db2.gz CRYVPFDVCHVFEQ-MHJFOBGBSA-N 1 3 332.488 2.548 10 0 EFAEHO Cc1ccc(F)cc1CNCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000657597005 547224584 /nfs/dbraw/zinc/22/45/84/547224584.db2.gz QLFVAXRSIHEETE-HXUWFJFHSA-N 1 3 328.431 2.991 10 0 EFAEHO Cc1ccc(F)cc1CNCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000657597005 547224586 /nfs/dbraw/zinc/22/45/86/547224586.db2.gz QLFVAXRSIHEETE-HXUWFJFHSA-N 1 3 328.431 2.991 10 0 EFAEHO O[C@@H]1C[C@@H](NCc2ccc(OCC[NH+]3CCCC3)cc2)C12CCC2 ZINC000657703310 547258454 /nfs/dbraw/zinc/25/84/54/547258454.db2.gz MZCXQONEUPCSMG-RTBURBONSA-N 1 3 330.472 2.554 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2C[C@H](O)C23CCC3)CC1 ZINC000657707678 547259661 /nfs/dbraw/zinc/25/96/61/547259661.db2.gz VSKNXAXYHVMNMA-UXHICEINSA-N 1 3 343.515 2.612 10 0 EFAEHO CN1CCC([NH2+]C[C@@H]2CN(Cc3ccccc3)CC23CCC3)CC1 ZINC000657771090 547281294 /nfs/dbraw/zinc/28/12/94/547281294.db2.gz AYRFDMUTFXJQDC-LJQANCHMSA-N 1 3 327.516 2.973 10 0 EFAEHO CN1CCC([NH2+]C[C@H]2CN(Cc3ccccc3)CC23CCC3)CC1 ZINC000657771089 547281404 /nfs/dbraw/zinc/28/14/04/547281404.db2.gz AYRFDMUTFXJQDC-IBGZPJMESA-N 1 3 327.516 2.973 10 0 EFAEHO Cn1ncc(C(F)(F)F)c1CNCC1CC[NH+](CC2CC2)CC1 ZINC000657813869 547292465 /nfs/dbraw/zinc/29/24/65/547292465.db2.gz CJHSZUBMMYLLJM-UHFFFAOYSA-N 1 3 330.398 2.651 10 0 EFAEHO C[C@@H](O)[C@@H](NCc1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000657820393 547294205 /nfs/dbraw/zinc/29/42/05/547294205.db2.gz VUOLBYBAGBJQCG-OXQOHEQNSA-N 1 3 328.456 2.839 10 0 EFAEHO C[C@H](NCC1CC[NH+](C2CCOCC2)CC1)c1cc2n(n1)CCCC2 ZINC000658071230 547347474 /nfs/dbraw/zinc/34/74/74/547347474.db2.gz WBCIANAZRAYUAQ-INIZCTEOSA-N 1 3 346.519 2.761 10 0 EFAEHO CO[C@H](CNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1)[C@H]1CCOC1 ZINC000658070256 547347770 /nfs/dbraw/zinc/34/77/70/547347770.db2.gz AVJKVMNGHUREFO-SLYNCCJLSA-N 1 3 346.515 2.723 10 0 EFAEHO C[C@@H](NCC1CC[NH+](C2CCOCC2)CC1)c1cn2ccccc2n1 ZINC000658069865 547347924 /nfs/dbraw/zinc/34/79/24/547347924.db2.gz KCGNDQFOLMQRCX-MRXNPFEDSA-N 1 3 342.487 2.876 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)N[C@H]1CCc2cc(F)c(F)c(F)c21 ZINC000658105888 547357317 /nfs/dbraw/zinc/35/73/17/547357317.db2.gz FJJBHGAMVJVQIH-WFASDCNBSA-N 1 3 343.437 2.953 10 0 EFAEHO Cc1c([C@H](C)N[C@@H](C)CN(C)CCC[NH+](C)C)cnn1C(C)(C)C ZINC000658109826 547359243 /nfs/dbraw/zinc/35/92/43/547359243.db2.gz YVZZEUVRKPJVAQ-HOTGVXAUSA-N 1 3 337.556 2.869 10 0 EFAEHO CC(C)(C)OC1CC([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)C1 ZINC000658135379 547366669 /nfs/dbraw/zinc/36/66/69/547366669.db2.gz DITVFYOBKMQPPF-JLAWEPINSA-N 1 3 332.488 2.689 10 0 EFAEHO CCO[C@@H]1C[C@@H]([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)C12CCC2 ZINC000658135901 547367113 /nfs/dbraw/zinc/36/71/13/547367113.db2.gz FUABOJKXUPJLPD-VAMGGRTRSA-N 1 3 344.499 2.691 10 0 EFAEHO Cc1cncc([C@@H](C)NCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1 ZINC000658138799 547367536 /nfs/dbraw/zinc/36/75/36/547367536.db2.gz OFPTXTNOGWSNEQ-UZLBHIALSA-N 1 3 325.456 2.807 10 0 EFAEHO Cc1cncc([C@@H](C)NCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1 ZINC000658138799 547367541 /nfs/dbraw/zinc/36/75/41/547367541.db2.gz OFPTXTNOGWSNEQ-UZLBHIALSA-N 1 3 325.456 2.807 10 0 EFAEHO CC1(C)C[C@@H]([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)C(C)(C)O1 ZINC000658138706 547367600 /nfs/dbraw/zinc/36/76/00/547367600.db2.gz JYKBXZDQKBBJMI-QZTJIDSGSA-N 1 3 332.488 2.689 10 0 EFAEHO CC(C)(C)[NH+]1CCC(NCc2ccc(CN3CC[C@@H](O)C3)cc2)CC1 ZINC000658138336 547367863 /nfs/dbraw/zinc/36/78/63/547367863.db2.gz JFKGYTHKFLKPPB-HXUWFJFHSA-N 1 3 345.531 2.606 10 0 EFAEHO CC1(C)C[C@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)C(C)(C)O1 ZINC000658138708 547368058 /nfs/dbraw/zinc/36/80/58/547368058.db2.gz JYKBXZDQKBBJMI-ROUUACIJSA-N 1 3 332.488 2.689 10 0 EFAEHO O[C@H]1CCN(Cc2ccc(C[NH2+]C3CCC4(CCCO4)CC3)cc2)C1 ZINC000658137575 547368158 /nfs/dbraw/zinc/36/81/58/547368158.db2.gz KEMZBVVWTPAPJT-KBWCOIMZSA-N 1 3 344.499 2.835 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1)C1CCSCC1 ZINC000658142565 547369844 /nfs/dbraw/zinc/36/98/44/547369844.db2.gz YOPVAKCFTLEALS-HNAYVOBHSA-N 1 3 334.529 2.875 10 0 EFAEHO C[C@H](NCCO[C@H]1CC1(F)F)c1cccc(OCC[NH+](C)C)c1 ZINC000658168946 547378989 /nfs/dbraw/zinc/37/89/89/547378989.db2.gz JVTIQANBCXGYCI-BBRMVZONSA-N 1 3 328.403 2.702 10 0 EFAEHO CN(Cc1ccccc1)[C@H]1CCN(C(=O)CC[C@H]2CCCC[N@@H+]2C)C1 ZINC000672937575 547831579 /nfs/dbraw/zinc/83/15/79/547831579.db2.gz RCEVZSMSIVHABP-UXHICEINSA-N 1 3 343.515 2.984 10 0 EFAEHO CN(Cc1ccccc1)[C@H]1CCN(C(=O)CC[C@H]2CCCC[N@H+]2C)C1 ZINC000672937575 547831584 /nfs/dbraw/zinc/83/15/84/547831584.db2.gz RCEVZSMSIVHABP-UXHICEINSA-N 1 3 343.515 2.984 10 0 EFAEHO CC[C@H](CN1CCCC1)NC(=O)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000675197341 548227988 /nfs/dbraw/zinc/22/79/88/548227988.db2.gz MVDACVYRQLBVMO-MSOLQXFVSA-N 1 3 336.524 2.521 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCN(CC2CC2)C1 ZINC000675834771 548362619 /nfs/dbraw/zinc/36/26/19/548362619.db2.gz ZSBPRONMJLPTOL-QMMLZNLJSA-N 1 3 327.516 2.971 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN2CCC[C@H](n3ccnc3)C2)cc1 ZINC000678234279 548871285 /nfs/dbraw/zinc/87/12/85/548871285.db2.gz CQXNMLOZOUMSLN-SFHVURJKSA-N 1 3 328.460 2.661 10 0 EFAEHO CN(C)CCOc1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)cc1 ZINC000678339570 548902515 /nfs/dbraw/zinc/90/25/15/548902515.db2.gz PFACNSCLIYFNOM-RTBURBONSA-N 1 3 332.488 2.876 10 0 EFAEHO CN(C)CCOc1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)cc1 ZINC000678339570 548902521 /nfs/dbraw/zinc/90/25/21/548902521.db2.gz PFACNSCLIYFNOM-RTBURBONSA-N 1 3 332.488 2.876 10 0 EFAEHO C[C@@H]1CN(Cc2cccc3cnccc32)CC[C@H]1[NH+]1CCN(C)CC1 ZINC000679990838 549233980 /nfs/dbraw/zinc/23/39/80/549233980.db2.gz RUTXQJKCKOXBCX-DYESRHJHSA-N 1 3 338.499 2.693 10 0 EFAEHO CC(C)[C@@H](C[N@H+](C)Cc1ccccc1)NC(=O)N[C@@H]1CCCN(C)C1 ZINC000681095211 549461503 /nfs/dbraw/zinc/46/15/03/549461503.db2.gz NUIIQSHIWKMNPV-RTBURBONSA-N 1 3 346.519 2.536 10 0 EFAEHO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N[C@@H]1CCCN(C)C1 ZINC000681095211 549461507 /nfs/dbraw/zinc/46/15/07/549461507.db2.gz NUIIQSHIWKMNPV-RTBURBONSA-N 1 3 346.519 2.536 10 0 EFAEHO C[C@H]1CN(Cc2ccc3cnccc3c2)CC[C@H]1[NH+]1CCN(C)CC1 ZINC000683833113 549952935 /nfs/dbraw/zinc/95/29/35/549952935.db2.gz UBAQVLHBQAYGFQ-LAUBAEHRSA-N 1 3 338.499 2.693 10 0 EFAEHO CO[C@H]1CCC[C@@H]([NH2+]Cc2ccccc2CN2CCC(O)CC2)C1 ZINC000684383345 550033211 /nfs/dbraw/zinc/03/32/11/550033211.db2.gz MQPLSZFNPDUTLJ-QUCCMNQESA-N 1 3 332.488 2.691 10 0 EFAEHO C[C@@H]1CN(Cc2cncc3ccccc32)CC[C@@H]1[NH+]1CCN(C)CC1 ZINC000769524653 577370135 /nfs/dbraw/zinc/37/01/35/577370135.db2.gz GPCYSEDLRJBNLN-UTKZUKDTSA-N 1 3 338.499 2.693 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC[C@@H](O)c1cccnc1 ZINC000773083041 581394949 /nfs/dbraw/zinc/39/49/49/581394949.db2.gz RUSUVBJWNDXQMV-LSTHTHJFSA-N 1 3 325.456 2.615 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC[C@@H](O)c1cccnc1 ZINC000773083041 581394952 /nfs/dbraw/zinc/39/49/52/581394952.db2.gz RUSUVBJWNDXQMV-LSTHTHJFSA-N 1 3 325.456 2.615 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N(C)CCNCc1ccc(Cl)s1 ZINC001691317417 1248651003 /nfs/dbraw/zinc/65/10/03/1248651003.db2.gz VGDFERHYNMVCEZ-AWEZNQCLSA-N 1 3 343.924 2.822 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N(C)CCNCc1ccc(Cl)s1 ZINC001691317417 1248651016 /nfs/dbraw/zinc/65/10/16/1248651016.db2.gz VGDFERHYNMVCEZ-AWEZNQCLSA-N 1 3 343.924 2.822 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/C[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001268551684 1250102635 /nfs/dbraw/zinc/10/26/35/1250102635.db2.gz IKTDYBQRGOVREA-QDNWOOLPSA-N 1 3 345.478 2.660 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]CCCc2ccccc2C)C1)N(C)C ZINC001266725670 1248240135 /nfs/dbraw/zinc/24/01/35/1248240135.db2.gz PMNOCMRUQQGHAQ-CEXWTWQISA-N 1 3 331.504 2.505 10 0 EFAEHO Cc1cc(CN2CCC[C@@H]2CNC(=O)CCCC[NH+](C)C)cs1 ZINC001691106658 1248417620 /nfs/dbraw/zinc/41/76/20/1248417620.db2.gz YOFXXDFTIAWMDZ-QGZVFWFLSA-N 1 3 337.533 2.869 10 0 EFAEHO Cc1cc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cnc1Cl ZINC000850357651 1250448346 /nfs/dbraw/zinc/44/83/46/1250448346.db2.gz QOSXXMPTUHPRAF-GOSISDBHSA-N 1 3 345.874 2.900 10 0 EFAEHO Cc1cc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)cnc1Cl ZINC000850357651 1250448352 /nfs/dbraw/zinc/44/83/52/1250448352.db2.gz QOSXXMPTUHPRAF-GOSISDBHSA-N 1 3 345.874 2.900 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN[C@H]2C[C@H](O)c3ccccc32)cc1 ZINC000850372735 1250453220 /nfs/dbraw/zinc/45/32/20/1250453220.db2.gz YDJSZMVPHBJXPQ-PMACEKPBSA-N 1 3 326.440 2.895 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC001691567628 1251778091 /nfs/dbraw/zinc/77/80/91/1251778091.db2.gz ZNARKMVPJNGMLB-UHFFFAOYSA-N 1 3 345.409 2.595 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]CCCc1cccc(C)c1 ZINC001691622917 1251839632 /nfs/dbraw/zinc/83/96/32/1251839632.db2.gz DQESDMLDOROPJA-FQEVSTJZSA-N 1 3 345.531 2.850 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@]1(C)CC[N@H+](CC2=CCCCC2)C1 ZINC001484049185 1252117613 /nfs/dbraw/zinc/11/76/13/1252117613.db2.gz OIZFXPVPBJYQPG-MJGOQNOKSA-N 1 3 339.499 2.747 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@]1(C)CC[N@@H+](CC2=CCCCC2)C1 ZINC001484049185 1252117616 /nfs/dbraw/zinc/11/76/16/1252117616.db2.gz OIZFXPVPBJYQPG-MJGOQNOKSA-N 1 3 339.499 2.747 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@]1(C)CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001484119030 1252290831 /nfs/dbraw/zinc/29/08/31/1252290831.db2.gz JVVVPNQPLFSCTE-PRPIBZDOSA-N 1 3 335.536 2.903 10 0 EFAEHO C[C@H]([NH2+]CCCC1CCC1)[C@H]1CCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001484338531 1252424449 /nfs/dbraw/zinc/42/44/49/1252424449.db2.gz LDYAUTQCWZCIIS-WMZOPIPTSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](C)[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001484355977 1252449140 /nfs/dbraw/zinc/44/91/40/1252449140.db2.gz AICDVEYOPWHYIY-IEBWSBKVSA-N 1 3 331.504 2.662 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([C@@H](C)[NH2+]CCCC(C)(C)C)C1 ZINC001484356279 1252449442 /nfs/dbraw/zinc/44/94/42/1252449442.db2.gz BSIRASLSUGQORW-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H]1CN(C(=O)C(C)(C)N2CCCCC2)C[C@@H]1C ZINC001484367667 1252470483 /nfs/dbraw/zinc/47/04/83/1252470483.db2.gz HVXQGCCNIIRDHA-ROUUACIJSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@H]1CN(C(=O)C(C)(C)N2CCCCC2)C[C@@H]1C ZINC001484367668 1252471091 /nfs/dbraw/zinc/47/10/91/1252471091.db2.gz HVXQGCCNIIRDHA-ZWKOTPCHSA-N 1 3 335.536 2.901 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1F ZINC001484384437 1252489138 /nfs/dbraw/zinc/48/91/38/1252489138.db2.gz OGKREJYYCDWLFM-WMZOPIPTSA-N 1 3 349.494 2.658 10 0 EFAEHO O=C(Cc1c[nH]cn1)N(CC[NH2+]CC1CCCC1)Cc1ccccc1 ZINC001484399949 1252538983 /nfs/dbraw/zinc/53/89/83/1252538983.db2.gz FHLSRHUCDZGXBP-UHFFFAOYSA-N 1 3 340.471 2.761 10 0 EFAEHO CC(C)N(C)CC(=O)N(Cc1ccccn1)C1CC[NH+](C(C)C)CC1 ZINC001484400727 1252540116 /nfs/dbraw/zinc/54/01/16/1252540116.db2.gz BDRFKFHOGKZNPE-UHFFFAOYSA-N 1 3 346.519 2.623 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2C/C=C/c1ccccc1 ZINC001484461611 1252656419 /nfs/dbraw/zinc/65/64/19/1252656419.db2.gz JLVAZTYQZCOZHV-XGRQOQASSA-N 1 3 341.499 2.717 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2C/C=C/c1ccccc1 ZINC001484461603 1252656569 /nfs/dbraw/zinc/65/65/69/1252656569.db2.gz JLVAZTYQZCOZHV-AUVQFFENSA-N 1 3 341.499 2.717 10 0 EFAEHO CC[N@@H+]1C[C@@H](NC(=O)c2cccc(CN3CCCC3)c2)C(C)(C)C1 ZINC001434386673 1252657520 /nfs/dbraw/zinc/65/75/20/1252657520.db2.gz HCPVKIOEVVXRFR-GOSISDBHSA-N 1 3 329.488 2.743 10 0 EFAEHO CC[N@H+]1C[C@@H](NC(=O)c2cccc(CN3CCCC3)c2)C(C)(C)C1 ZINC001434386673 1252657527 /nfs/dbraw/zinc/65/75/27/1252657527.db2.gz HCPVKIOEVVXRFR-GOSISDBHSA-N 1 3 329.488 2.743 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)[C@H]3CCCN3C)C2)c(C)c1 ZINC001484511513 1252734725 /nfs/dbraw/zinc/73/47/25/1252734725.db2.gz JDUSQGPHMJBOJK-AZUAARDMSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H]2CCN(C(=O)[C@H]3CCCN3C)C2)c(C)s1 ZINC001484512936 1252737213 /nfs/dbraw/zinc/73/72/13/1252737213.db2.gz ZYYBRJXSLYOUEG-FUHWJXTLSA-N 1 3 349.544 2.787 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCCN(Cc2cc(C)ccc2F)CC1 ZINC001484724687 1252810498 /nfs/dbraw/zinc/81/04/98/1252810498.db2.gz TXNQIACDMQOMQH-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCCN(Cc2cc(C)ccc2F)CC1 ZINC001484724687 1252810514 /nfs/dbraw/zinc/81/05/14/1252810514.db2.gz TXNQIACDMQOMQH-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+]1CCC[C@@H](NC(=O)CN(C)C(C)C)CC1 ZINC001484728552 1252821091 /nfs/dbraw/zinc/82/10/91/1252821091.db2.gz RALXEXIDIMVEJR-LJQANCHMSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+]1CCC[C@@H](NC(=O)CN(C)C(C)C)CC1 ZINC001484728552 1252821098 /nfs/dbraw/zinc/82/10/98/1252821098.db2.gz RALXEXIDIMVEJR-LJQANCHMSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CCC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001484721093 1252835370 /nfs/dbraw/zinc/83/53/70/1252835370.db2.gz AJVVESJGNUQIPT-HOTGVXAUSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@H](F)CC[N@H+]1CCC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001484721093 1252835380 /nfs/dbraw/zinc/83/53/80/1252835380.db2.gz AJVVESJGNUQIPT-HOTGVXAUSA-N 1 3 329.504 2.683 10 0 EFAEHO CCN(CC[NH2+]Cc1c(C)cc(C)cc1C)C(=O)[C@@H]1CCCN1C ZINC001273298619 1265845446 /nfs/dbraw/zinc/84/54/46/1265845446.db2.gz STOTWBZYCIVXCX-IBGZPJMESA-N 1 3 331.504 2.644 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)[C@@H](C[NH2+]CCCC(C)(C)C)C2CC2)C1 ZINC001485825218 1256383044 /nfs/dbraw/zinc/38/30/44/1256383044.db2.gz BKJGZAZQUMWJLX-WMZOPIPTSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@H](C[NH2+]CC2CC3(CCC3)C2)C2CC2)C1 ZINC001485827724 1257094190 /nfs/dbraw/zinc/09/41/90/1257094190.db2.gz QYQGBFHBHQUKQH-VQIMIIECSA-N 1 3 347.547 2.735 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]CCc1cccs1 ZINC001272774440 1257882426 /nfs/dbraw/zinc/88/24/26/1257882426.db2.gz VKJVHOAPFURNDX-NVXWUHKLSA-N 1 3 337.533 2.648 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]CCc1cccs1 ZINC001272774439 1257882585 /nfs/dbraw/zinc/88/25/85/1257882585.db2.gz VKJVHOAPFURNDX-DOTOQJQBSA-N 1 3 337.533 2.648 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CCNC/C(Cl)=C/Cl ZINC001272824139 1260828955 /nfs/dbraw/zinc/82/89/55/1260828955.db2.gz VQXGTDRPKMODNP-NQAKMWCRSA-N 1 3 336.307 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CCNC/C(Cl)=C/Cl ZINC001272824139 1260828965 /nfs/dbraw/zinc/82/89/65/1260828965.db2.gz VQXGTDRPKMODNP-NQAKMWCRSA-N 1 3 336.307 2.664 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CCNC/C(Cl)=C/Cl ZINC001272824138 1260829735 /nfs/dbraw/zinc/82/97/35/1260829735.db2.gz VQXGTDRPKMODNP-NKMUALHBSA-N 1 3 336.307 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CCNC/C(Cl)=C/Cl ZINC001272824138 1260829740 /nfs/dbraw/zinc/82/97/40/1260829740.db2.gz VQXGTDRPKMODNP-NKMUALHBSA-N 1 3 336.307 2.664 10 0 EFAEHO CC(C)(C)[C@]1(C[NH3+])CCN(C[C@@H](O)COc2ccc(Cl)cc2)C1 ZINC000923413127 1261627408 /nfs/dbraw/zinc/62/74/08/1261627408.db2.gz DOFKNJMYBZCLJA-QAPCUYQASA-N 1 3 340.895 2.777 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN2CC[C@@](C[NH3+])(C(C)(C)C)C2)c(C)c1 ZINC000923413215 1261627538 /nfs/dbraw/zinc/62/75/38/1261627538.db2.gz FAMPAIWEAIONDS-XLIONFOSSA-N 1 3 334.504 2.740 10 0 EFAEHO Cc1cc(C)cc(OC[C@@H](O)CN2CC[C@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000923414649 1261628032 /nfs/dbraw/zinc/62/80/32/1261628032.db2.gz MXHOLQWAGDSSSN-FXAWDEMLSA-N 1 3 334.504 2.740 10 0 EFAEHO CC1(C)[C@H](NC[C@@H]2Cc3ccccc3O[C@H]2C(F)(F)F)C[C@@H]1[NH3+] ZINC000923423813 1261631839 /nfs/dbraw/zinc/63/18/39/1261631839.db2.gz ZORHPCUMFBYNIU-SPWCGHHHSA-N 1 3 328.378 2.884 10 0 EFAEHO [NH3+]C[C@H]1CC2(CO1)CCN(CCSc1ccc(F)cc1F)CC2 ZINC000923453253 1261693413 /nfs/dbraw/zinc/69/34/13/1261693413.db2.gz WOIWMZAIEDYTFY-CQSZACIVSA-N 1 3 342.455 2.887 10 0 EFAEHO C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923502312 1261782768 /nfs/dbraw/zinc/78/27/68/1261782768.db2.gz YUWCDXWBFCEGQJ-IIAWOOMASA-N 1 3 337.895 2.776 10 0 EFAEHO C[C@H](NC(=O)[C@H](C)N1CC[C@H](C[NH3+])[C@H](C)C1)c1ccc(Cl)cc1 ZINC000923497135 1261786838 /nfs/dbraw/zinc/78/68/38/1261786838.db2.gz FNJFEIVAWMHRIP-ORIJERBGSA-N 1 3 337.895 2.822 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C[NH3+])[C@@H](C)C1)[C@@H](C)c1ccc(F)cc1 ZINC000923496914 1261787095 /nfs/dbraw/zinc/78/70/95/1261787095.db2.gz KGEOAUZVGMTDTO-YQQAZPJKSA-N 1 3 335.467 2.652 10 0 EFAEHO C[C@@H]1CN(Cc2nn(-c3ccc(F)cc3)c3c2CCC3)CC[C@@H]1C[NH3+] ZINC000923497879 1261788524 /nfs/dbraw/zinc/78/85/24/1261788524.db2.gz NAZIYUOARJEDKE-HUUCEWRRSA-N 1 3 342.462 2.917 10 0 EFAEHO CC[C@@H]1c2ccsc2CCN1C(=O)CN1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923498640 1261793332 /nfs/dbraw/zinc/79/33/32/1261793332.db2.gz IQPRZLHUJFYEHR-IJEWVQPXSA-N 1 3 335.517 2.501 10 0 EFAEHO Brc1ccc(OC[C@@H]2CCCN2C[C@@H]2CC[NH2+]C2)cc1 ZINC000923525394 1261842341 /nfs/dbraw/zinc/84/23/41/1261842341.db2.gz HFUXTOIVFZOLBD-HIFRSBDPSA-N 1 3 339.277 2.902 10 0 EFAEHO c1ccc2c(c1)[C@H](C[C@H]1COCCN1)CN2CCC[NH+]1CCCCC1 ZINC000923541755 1261888468 /nfs/dbraw/zinc/88/84/68/1261888468.db2.gz VPHOLOUILKLWFW-MOPGFXCFSA-N 1 3 343.515 2.845 10 0 EFAEHO CCCN(C)CC(=O)N(C)C[C@H](C)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001485947128 1262515078 /nfs/dbraw/zinc/51/50/78/1262515078.db2.gz MXNMXHDQDBICAI-GJZGRUSLSA-N 1 3 333.467 2.590 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001485929926 1262528984 /nfs/dbraw/zinc/52/89/84/1262528984.db2.gz IDYMYDUVIDEGJD-ZBFHGGJFSA-N 1 3 345.478 2.731 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+][C@H]1CCc2c1cccc2F ZINC001485960995 1262560470 /nfs/dbraw/zinc/56/04/70/1262560470.db2.gz OTHKKOSRPYLROK-KSSFIOAISA-N 1 3 335.467 2.590 10 0 EFAEHO C[C@H]1[C@H]([NH2+]CCCCCF)CCN1C(=O)CN(C)CC(C)(C)C ZINC001486089210 1262612171 /nfs/dbraw/zinc/61/21/71/1262612171.db2.gz OTFOWZWZQKYDGW-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2cc3ccccc3o2)[C@@H]1C ZINC001486095885 1262618328 /nfs/dbraw/zinc/61/83/28/1262618328.db2.gz NTMXDPXNIUUASE-MAUKXSAKSA-N 1 3 343.471 2.852 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H]1C[C@@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001486134598 1262667904 /nfs/dbraw/zinc/66/79/04/1262667904.db2.gz LVMKGCYECYEPGV-CRAIPNDOSA-N 1 3 335.467 2.553 10 0 EFAEHO C[C@H](c1ccccc1F)N1CC[C@]2(NC(=O)CC[NH+](C)C)CCC[C@H]12 ZINC001486148215 1262698312 /nfs/dbraw/zinc/69/83/12/1262698312.db2.gz LDODOVMYZBGEJH-MOXGXCLJSA-N 1 3 347.478 2.952 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCCC(F)(F)F)C[C@@H]1C ZINC001486126692 1262704101 /nfs/dbraw/zinc/70/41/01/1262704101.db2.gz CSXWVWKGMSBKHS-KBPBESRZSA-N 1 3 337.430 2.640 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N1CC[C@]2(NC(=O)CC[NH+](C)C)CCC[C@@H]12 ZINC001486151948 1262707153 /nfs/dbraw/zinc/70/71/53/1262707153.db2.gz YWLCWYCFWCFYRB-XFQXTVEOSA-N 1 3 347.478 2.952 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN3CCC(C)CC3)C[C@@H]21 ZINC001486168791 1262730620 /nfs/dbraw/zinc/73/06/20/1262730620.db2.gz ZLQTYPIDXQMSKH-SLFFLAALSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H](C[NH2+]Cc2ccccc2F)C1 ZINC001486220997 1262825060 /nfs/dbraw/zinc/82/50/60/1262825060.db2.gz PUNTZFXEWJVWMH-NVXWUHKLSA-N 1 3 335.467 2.540 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCc2ccccc2F)C(C)(C)C1 ZINC001486246425 1262850457 /nfs/dbraw/zinc/85/04/57/1262850457.db2.gz KMURBDCRRGMTBO-SFHVURJKSA-N 1 3 349.494 2.537 10 0 EFAEHO CC(C)N(CC[N@H+](C)CCC(C)(C)C)C(=O)CN1CC[C@H](C)C1 ZINC001486376141 1262978839 /nfs/dbraw/zinc/97/88/39/1262978839.db2.gz XWEUVEVDAYGJAH-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CCC(C)(C)C)C(=O)CN1CC[C@H](C)C1 ZINC001486376141 1262978849 /nfs/dbraw/zinc/97/88/49/1262978849.db2.gz XWEUVEVDAYGJAH-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(CC[N@H+](C)CCC(C)(C)C)C(=O)CN1CC[C@@H](C)C1 ZINC001486376142 1262979168 /nfs/dbraw/zinc/97/91/68/1262979168.db2.gz XWEUVEVDAYGJAH-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CCC(C)(C)C)C(=O)CN1CC[C@@H](C)C1 ZINC001486376142 1262979170 /nfs/dbraw/zinc/97/91/70/1262979170.db2.gz XWEUVEVDAYGJAH-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](F)CN1CCC([C@H](C)NC(=O)CCC[NH+]2CCCC2)CC1 ZINC001486450584 1263144789 /nfs/dbraw/zinc/14/47/89/1263144789.db2.gz MISYNGUNBUJVCI-FUHWJXTLSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+](CCCc2ccsc2)CC1)N(C)C ZINC001486509208 1263282773 /nfs/dbraw/zinc/28/27/73/1263282773.db2.gz NSOAAOIPFRXCJQ-GOSISDBHSA-N 1 3 349.544 2.769 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+](CCCc2ccsc2)CC1)N(C)C ZINC001486509208 1263282781 /nfs/dbraw/zinc/28/27/81/1263282781.db2.gz NSOAAOIPFRXCJQ-GOSISDBHSA-N 1 3 349.544 2.769 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC2=CC[N@H+](CC3CCC(C)CC3)CC2)C1 ZINC001486515618 1263301060 /nfs/dbraw/zinc/30/10/60/1263301060.db2.gz LNJLYEGNVAQKAW-QPIRBTGLSA-N 1 3 347.547 2.903 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC2=CC[N@@H+](CC3CCC(C)CC3)CC2)C1 ZINC001486515618 1263301074 /nfs/dbraw/zinc/30/10/74/1263301074.db2.gz LNJLYEGNVAQKAW-QPIRBTGLSA-N 1 3 347.547 2.903 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](Cc2cc(C)ccc2C)CC1 ZINC001486518980 1263308662 /nfs/dbraw/zinc/30/86/62/1263308662.db2.gz CTELBKMAVIAZHZ-UHFFFAOYSA-N 1 3 343.515 2.894 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](Cc2cc(C)ccc2C)CC1 ZINC001486518980 1263308675 /nfs/dbraw/zinc/30/86/75/1263308675.db2.gz CTELBKMAVIAZHZ-UHFFFAOYSA-N 1 3 343.515 2.894 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1=CC[N@H+](CC2CC3(CCC3)C2)CC1 ZINC001486519527 1263309863 /nfs/dbraw/zinc/30/98/63/1263309863.db2.gz OVTIOXNXJDLXBP-UHFFFAOYSA-N 1 3 342.487 2.589 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1=CC[N@@H+](CC2CC3(CCC3)C2)CC1 ZINC001486519527 1263309871 /nfs/dbraw/zinc/30/98/71/1263309871.db2.gz OVTIOXNXJDLXBP-UHFFFAOYSA-N 1 3 342.487 2.589 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](Cc2ccccc2C)CC1 ZINC001486519517 1263310614 /nfs/dbraw/zinc/31/06/14/1263310614.db2.gz OQVNJXNLFJRGEW-UHFFFAOYSA-N 1 3 329.488 2.585 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](Cc2ccccc2C)CC1 ZINC001486519517 1263310624 /nfs/dbraw/zinc/31/06/24/1263310624.db2.gz OQVNJXNLFJRGEW-UHFFFAOYSA-N 1 3 329.488 2.585 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001410211877 1264324097 /nfs/dbraw/zinc/32/40/97/1264324097.db2.gz PYNYXYJDUKUSCM-UFYCRDLUSA-N 1 3 345.531 2.820 10 0 EFAEHO C[C@@]1(C[NH2+]Cc2cnn(CCF)c2)CCN(Cc2ccccc2)C1 ZINC000922093360 1264351938 /nfs/dbraw/zinc/35/19/38/1264351938.db2.gz CXKTVKLCWDEKHM-IBGZPJMESA-N 1 3 330.451 2.854 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2cccc(F)c2)C1)CC(C)(C)C ZINC001410227109 1264383420 /nfs/dbraw/zinc/38/34/20/1264383420.db2.gz OFRNPVPUKFVMCI-SAABIXHNSA-N 1 3 349.494 2.788 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccccc2C)C1 ZINC001410232073 1264432665 /nfs/dbraw/zinc/43/26/65/1264432665.db2.gz XUNOFDBHTCFDQW-BZSNNMDCSA-N 1 3 331.504 2.882 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@H]1C[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001410234767 1264439683 /nfs/dbraw/zinc/43/96/83/1264439683.db2.gz VFLSMAPUBQUAJO-SZVBFZGTSA-N 1 3 331.504 2.892 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C3CCC3)C2)cc1 ZINC001410234923 1264439924 /nfs/dbraw/zinc/43/99/24/1264439924.db2.gz JFQGQMDXGFJCFS-WGSAOQKQSA-N 1 3 343.515 2.718 10 0 EFAEHO CN(C/C=C/Cl)C1CCN(C(=O)[C@@H]2CCC[C@H]3CCC[N@@H+]32)CC1 ZINC001410251273 1264513138 /nfs/dbraw/zinc/51/31/38/1264513138.db2.gz KISMWVDUQTYMPV-JNARHASWSA-N 1 3 339.911 2.679 10 0 EFAEHO CN(C/C=C/Cl)C1CCN(C(=O)[C@@H]2CCC[C@H]3CCC[N@H+]32)CC1 ZINC001410251273 1264513142 /nfs/dbraw/zinc/51/31/42/1264513142.db2.gz KISMWVDUQTYMPV-JNARHASWSA-N 1 3 339.911 2.679 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC(N(C)C/C=C\Cl)CC1)[NH+]1CCCC1 ZINC001410254742 1264545451 /nfs/dbraw/zinc/54/54/51/1264545451.db2.gz CGAZCRDTEYRKDD-UXHZXRBQSA-N 1 3 341.927 2.782 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C[NH2+]Cc1ccc(C)cc1C)C1CC1)N(C)C ZINC001410312702 1264748192 /nfs/dbraw/zinc/74/81/92/1264748192.db2.gz LYEBLBVVEAMSMO-WOJBJXKFSA-N 1 3 345.531 2.970 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C[NH2+]Cc1ccc(C)cc1C)C1CC1)N(C)C ZINC001410312698 1264748996 /nfs/dbraw/zinc/74/89/96/1264748996.db2.gz LYEBLBVVEAMSMO-UXHICEINSA-N 1 3 345.531 2.970 10 0 EFAEHO CCCN(C)CC(=O)N(C)[C@H](C[NH2+][C@H]1CCc2ccccc21)C1CC1 ZINC001410326718 1264809473 /nfs/dbraw/zinc/80/94/73/1264809473.db2.gz MPEQEOWKOYGFLI-VQTJNVASSA-N 1 3 343.515 2.842 10 0 EFAEHO CCCN(C)CC(=O)N(C)[C@@H](C[NH2+][C@H]1CCc2ccccc21)C1CC1 ZINC001410326706 1264810719 /nfs/dbraw/zinc/81/07/19/1264810719.db2.gz MPEQEOWKOYGFLI-PMACEKPBSA-N 1 3 343.515 2.842 10 0 EFAEHO CC1([NH+]2CCC2)CCC(NC(=O)NC[C@@H]2CCCCN2C2CC2)CC1 ZINC000922208027 1264921183 /nfs/dbraw/zinc/92/11/83/1264921183.db2.gz XWPOTLHFUZHBIX-IPCDKGFNSA-N 1 3 348.535 2.710 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)[C@@H]2CCC[N@@H+]2C(C)C)c1 ZINC001410378873 1264949134 /nfs/dbraw/zinc/94/91/34/1264949134.db2.gz GAPKTESUDYXKHO-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)[C@@H]2CCC[N@H+]2C(C)C)c1 ZINC001410378873 1264949145 /nfs/dbraw/zinc/94/91/45/1264949145.db2.gz GAPKTESUDYXKHO-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO CC[NH+](CC)CCNC(=O)N1CCN(Cc2ccccc2)CC[C@H]1C ZINC000673767766 1267731670 /nfs/dbraw/zinc/73/16/70/1267731670.db2.gz PGZISJOAORPVFQ-GOSISDBHSA-N 1 3 346.519 2.634 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccccc2C2CC2)[C@@H]1C ZINC001410840212 1269721390 /nfs/dbraw/zinc/72/13/90/1269721390.db2.gz FXHFJIOUEBLKHA-OXJNMPFZSA-N 1 3 343.515 2.983 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)c1 ZINC001410876202 1270009808 /nfs/dbraw/zinc/00/98/08/1270009808.db2.gz YHPZABDLNQEIQU-MJGOQNOKSA-N 1 3 331.504 2.723 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CCC(C)(C)C)[C@H]2C1 ZINC001410912399 1270202125 /nfs/dbraw/zinc/20/21/25/1270202125.db2.gz FLLOYNJGQSHJRY-OKZBNKHCSA-N 1 3 337.552 2.981 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CC3CC3)[C@H]2C1)CC(C)(C)C ZINC001410909781 1270221658 /nfs/dbraw/zinc/22/16/58/1270221658.db2.gz DFMZPFIKVCHVMP-BZSNNMDCSA-N 1 3 335.536 2.591 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N(CCS(=O)(=O)CCN2C[C@H](C)CC[C@@H]2C)C1 ZINC000744428793 1271042107 /nfs/dbraw/zinc/04/21/07/1271042107.db2.gz OFYWLKKVEIEMAP-TVFCKZIOSA-N 1 3 344.565 2.642 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N(CCS(=O)(=O)CC[N@@H+]2C[C@H](C)CC[C@@H]2C)C1 ZINC000744428793 1271042110 /nfs/dbraw/zinc/04/21/10/1271042110.db2.gz OFYWLKKVEIEMAP-TVFCKZIOSA-N 1 3 344.565 2.642 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N(CCS(=O)(=O)CC[N@H+]2C[C@H](C)CC[C@@H]2C)C1 ZINC000744428793 1271042119 /nfs/dbraw/zinc/04/21/19/1271042119.db2.gz OFYWLKKVEIEMAP-TVFCKZIOSA-N 1 3 344.565 2.642 10 0 EFAEHO C[C@@H]1CC[C@H](C)N(CCS(=O)(=O)CC[N@@H+]2C[C@H](C)CC[C@H]2C)C1 ZINC000744428793 1271042129 /nfs/dbraw/zinc/04/21/29/1271042129.db2.gz OFYWLKKVEIEMAP-TVFCKZIOSA-N 1 3 344.565 2.642 10 0 EFAEHO C[C@@H]1CC[C@H](C)N(CCS(=O)(=O)CC[N@H+]2C[C@H](C)CC[C@H]2C)C1 ZINC000744428793 1271042133 /nfs/dbraw/zinc/04/21/33/1271042133.db2.gz OFYWLKKVEIEMAP-TVFCKZIOSA-N 1 3 344.565 2.642 10 0 EFAEHO CCC[N@H+](C)CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001411195175 1271857757 /nfs/dbraw/zinc/85/77/57/1271857757.db2.gz PSNRXHJXMFSXBV-GOSISDBHSA-N 1 3 329.504 2.778 10 0 EFAEHO CCC[N@@H+](C)CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001411195175 1271857768 /nfs/dbraw/zinc/85/77/68/1271857768.db2.gz PSNRXHJXMFSXBV-GOSISDBHSA-N 1 3 329.504 2.778 10 0 EFAEHO CCc1cccc(CN(C)CCN(C(=O)[C@@H]2CC[N@H+](C)C2)C(C)C)c1 ZINC001411202203 1271907385 /nfs/dbraw/zinc/90/73/85/1271907385.db2.gz VEMQLQPBAQPUSL-HXUWFJFHSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1cccc(CN(C)CCN(C(=O)[C@@H]2CC[N@@H+](C)C2)C(C)C)c1 ZINC001411202203 1271907395 /nfs/dbraw/zinc/90/73/95/1271907395.db2.gz VEMQLQPBAQPUSL-HXUWFJFHSA-N 1 3 345.531 2.870 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C1CC(N(C)C(=O)CN(C)C(C)C)C1 ZINC001411253375 1272147955 /nfs/dbraw/zinc/14/79/55/1272147955.db2.gz NGWRIWXOQTXNEH-UHFFFAOYSA-N 1 3 335.467 2.553 10 0 EFAEHO CC[NH+](CC)CCCC1CCN(C[C@H]2CN(C3CC3)C(=O)O2)CC1 ZINC000844313235 1278857378 /nfs/dbraw/zinc/85/73/78/1278857378.db2.gz BGQNDECGOZQNLF-SFHVURJKSA-N 1 3 337.508 2.804 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@]1(O)CCCc2ccccc21 ZINC000817913137 1276374535 /nfs/dbraw/zinc/37/45/35/1276374535.db2.gz FOMUIJGZZZMUCU-JLTOFOAXSA-N 1 3 325.456 2.723 10 0 EFAEHO N[C@@H]1CCC[C@@H]1[NH2+]C[C@H](C(=O)OCc1ccccc1)c1ccccc1 ZINC000817923026 1276378883 /nfs/dbraw/zinc/37/88/83/1276378883.db2.gz CLQYSMOUFVMMAJ-ZCNNSNEGSA-N 1 3 338.451 2.983 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CC[NH2+]CC[C@H]1CCCC1(F)F ZINC001273151198 1276458862 /nfs/dbraw/zinc/45/88/62/1276458862.db2.gz PPOIYYWAFPSALR-TZMCWYRMSA-N 1 3 342.434 2.571 10 0 EFAEHO C[N@@H+]1CCC[C@H](CNC[C@H](O)c2ccc(F)cn2)[C@H]1c1cccs1 ZINC000819101448 1276606808 /nfs/dbraw/zinc/60/68/08/1276606808.db2.gz UODKAIOFHYFVOV-SKDZVZGDSA-N 1 3 349.475 2.988 10 0 EFAEHO C[N@H+]1CCC[C@H](CNC[C@H](O)c2ccc(F)cn2)[C@H]1c1cccs1 ZINC000819101448 1276606822 /nfs/dbraw/zinc/60/68/22/1276606822.db2.gz UODKAIOFHYFVOV-SKDZVZGDSA-N 1 3 349.475 2.988 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1CN(Cc2ccccc2)CC1(C)C ZINC001410016669 1277330668 /nfs/dbraw/zinc/33/06/68/1277330668.db2.gz IREDXNZIEHRXFO-SFHVURJKSA-N 1 3 331.504 2.745 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1CN(Cc2ccccc2)CC1(C)C ZINC001410016669 1277330680 /nfs/dbraw/zinc/33/06/80/1277330680.db2.gz IREDXNZIEHRXFO-SFHVURJKSA-N 1 3 331.504 2.745 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@@H](C)c1ccc(N2CCNC2=O)cc1 ZINC000844925772 1279345156 /nfs/dbraw/zinc/34/51/56/1279345156.db2.gz URGPZKOIIRIHSV-HNNXBMFYSA-N 1 3 338.455 2.786 10 0 EFAEHO CCN1C[C@@H](CN2CCC(C[N@H+](C)Cc3ccccc3)CC2)OC1=O ZINC000846795492 1280502367 /nfs/dbraw/zinc/50/23/67/1280502367.db2.gz PYCQFSWQMJERPW-LJQANCHMSA-N 1 3 345.487 2.671 10 0 EFAEHO CCN1C[C@@H](CN2CCC(C[N@@H+](C)Cc3ccccc3)CC2)OC1=O ZINC000846795492 1280502368 /nfs/dbraw/zinc/50/23/68/1280502368.db2.gz PYCQFSWQMJERPW-LJQANCHMSA-N 1 3 345.487 2.671 10 0 EFAEHO CCN1C[C@@H](CN2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)OC1=O ZINC000846819346 1280551010 /nfs/dbraw/zinc/55/10/10/1280551010.db2.gz YVVOYWGGOYBCJS-SJLPKXTDSA-N 1 3 337.508 2.804 10 0 EFAEHO CCN1C[C@@H](CN2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)OC1=O ZINC000846819346 1280551015 /nfs/dbraw/zinc/55/10/15/1280551015.db2.gz YVVOYWGGOYBCJS-SJLPKXTDSA-N 1 3 337.508 2.804 10 0 EFAEHO CCN1C[C@@H](CN2CCC(CC[N@H+](CC)CC3CC3)CC2)OC1=O ZINC000846841319 1280567991 /nfs/dbraw/zinc/56/79/91/1280567991.db2.gz MGPORSTZDVTMHE-GOSISDBHSA-N 1 3 337.508 2.661 10 0 EFAEHO CCN1C[C@@H](CN2CCC(CC[N@@H+](CC)CC3CC3)CC2)OC1=O ZINC000846841319 1280568002 /nfs/dbraw/zinc/56/80/02/1280568002.db2.gz MGPORSTZDVTMHE-GOSISDBHSA-N 1 3 337.508 2.661 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2ccc3oc(=O)[nH]c3c2)[C@@H](C)C1 ZINC000872122262 1287435528 /nfs/dbraw/zinc/43/55/28/1287435528.db2.gz DGHYJWAWYXJBFO-HOCLYGCPSA-N 1 3 347.459 2.760 10 0 EFAEHO C[C@H](C(=O)NCc1ccc(Cl)cc1)N(C)CCCCCC[NH3+] ZINC000872155163 1287450146 /nfs/dbraw/zinc/45/01/46/1287450146.db2.gz NBDZIPJPURDFJI-CQSZACIVSA-N 1 3 325.884 2.796 10 0 EFAEHO [NH3+][C@H](C[C@H]1CCCN([C@H]2CCN(C3CCC3)C2=O)C1)C1CCCC1 ZINC000872158233 1287453467 /nfs/dbraw/zinc/45/34/67/1287453467.db2.gz UFCYAYGCXJKAPG-LZQZEXGQSA-N 1 3 333.520 2.759 10 0 EFAEHO [NH3+][C@H](C[C@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1 ZINC000872157614 1287453950 /nfs/dbraw/zinc/45/39/50/1287453950.db2.gz NUKUULWZVLUDCM-UYAOXDASSA-N 1 3 343.515 2.922 10 0 EFAEHO CN(C)[C@H](CNC(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1)c1ccccc1 ZINC000809941517 1282634267 /nfs/dbraw/zinc/63/42/67/1282634267.db2.gz AVAUSPCGAYAUIR-APWZRJJASA-N 1 3 335.467 2.618 10 0 EFAEHO CN(C)[C@H](CNC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1)c1ccccc1 ZINC000809941517 1282634279 /nfs/dbraw/zinc/63/42/79/1282634279.db2.gz AVAUSPCGAYAUIR-APWZRJJASA-N 1 3 335.467 2.618 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NCCC[NH+]2CCCCCC2)C1 ZINC000809947849 1282642620 /nfs/dbraw/zinc/64/26/20/1282642620.db2.gz NIUAXEOKVIUWGR-SFHVURJKSA-N 1 3 327.488 2.581 10 0 EFAEHO C[N@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CCCCC1 ZINC000810056260 1282788752 /nfs/dbraw/zinc/78/87/52/1282788752.db2.gz KEBWXDJUSBJSKU-LJQANCHMSA-N 1 3 341.515 2.970 10 0 EFAEHO C[N@@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CCCCC1 ZINC000810056260 1282788762 /nfs/dbraw/zinc/78/87/62/1282788762.db2.gz KEBWXDJUSBJSKU-LJQANCHMSA-N 1 3 341.515 2.970 10 0 EFAEHO C[NH+](C)CCN(Cc1ccccc1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810030171 1282789512 /nfs/dbraw/zinc/78/95/12/1282789512.db2.gz QZHBZBWJDTZNMW-FQEVSTJZSA-N 1 3 349.494 2.789 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC[C@H]2C[NH+]2CCCCC2)C1 ZINC000810334431 1283141459 /nfs/dbraw/zinc/14/14/59/1283141459.db2.gz FDHJTWKZCVFAJP-QFBILLFUSA-N 1 3 339.499 2.676 10 0 EFAEHO C[C@@H](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH+]1CCCCC1 ZINC000811031566 1283967133 /nfs/dbraw/zinc/96/71/33/1283967133.db2.gz SXVBGFUJGDXLER-MAUKXSAKSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH+]1CCCCC1 ZINC000811031567 1283967695 /nfs/dbraw/zinc/96/76/95/1283967695.db2.gz SXVBGFUJGDXLER-QAPCUYQASA-N 1 3 327.488 2.580 10 0 EFAEHO CCN(CCC[NH+]1CCCC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000811398544 1284286434 /nfs/dbraw/zinc/28/64/34/1284286434.db2.gz HDBJPUJOHWHBFP-GOSISDBHSA-N 1 3 327.488 2.533 10 0 EFAEHO COCCC[NH+]1CCC2(CC1)CN(Cc1ccccc1)C[C@@H](C)O2 ZINC000952995391 1285023522 /nfs/dbraw/zinc/02/35/22/1285023522.db2.gz KTAMMRSNUOXYNO-GOSISDBHSA-N 1 3 332.488 2.778 10 0 EFAEHO C[Si](C)(C[N@@H+]1CCCN(c2ccncc2)CC1)c1ccccc1 ZINC001171554837 1285645200 /nfs/dbraw/zinc/64/52/00/1285645200.db2.gz PEMSPNHBZGAAGS-UHFFFAOYSA-N 1 3 325.532 2.749 10 0 EFAEHO C[Si](C)(C[N@H+]1CCCN(c2ccncc2)CC1)c1ccccc1 ZINC001171554837 1285645207 /nfs/dbraw/zinc/64/52/07/1285645207.db2.gz PEMSPNHBZGAAGS-UHFFFAOYSA-N 1 3 325.532 2.749 10 0 EFAEHO C[NH+]1CCC2(CCCN(C(=O)[C@]3(F)CCN(C(C)(C)C)C3)C2)CC1 ZINC000813556315 1285974496 /nfs/dbraw/zinc/97/44/96/1285974496.db2.gz FPJZNDXCAMCECC-IBGZPJMESA-N 1 3 339.499 2.533 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CCC[C@H](NC(=O)Cc2nc[nH]c2C)CC1 ZINC001273465826 1289594357 /nfs/dbraw/zinc/59/43/57/1289594357.db2.gz MIYJFWMNFAIXRJ-OSJSJHBBSA-N 1 3 332.492 2.978 10 0 EFAEHO CCC/C=C\CC[N@H+]1CCC[C@H](NC(=O)Cc2nc[nH]c2C)CC1 ZINC001273465826 1289594366 /nfs/dbraw/zinc/59/43/66/1289594366.db2.gz MIYJFWMNFAIXRJ-OSJSJHBBSA-N 1 3 332.492 2.978 10 0 EFAEHO Brc1ccc2c(c1)[C@@H]1[C@H](C2)[C@@H]1NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873276814 1289697961 /nfs/dbraw/zinc/69/79/61/1289697961.db2.gz XIVWJBXUIQICLN-WNJYQQPYSA-N 1 3 333.273 2.960 10 0 EFAEHO C[C@@H]1CN(CC(=O)Nc2ccc(Cl)c(Cl)c2)C[C@H]1CC[NH3+] ZINC000903495168 1312769269 /nfs/dbraw/zinc/76/92/69/1312769269.db2.gz YCEDMEZLHZOHBY-GHMZBOCLSA-N 1 3 330.259 2.849 10 0 EFAEHO C[C@@H](C(=O)Nc1ccc(OC(F)F)cc1)N1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903495861 1312769858 /nfs/dbraw/zinc/76/98/58/1312769858.db2.gz AIZQZQJPSAFISM-FRRDWIJNSA-N 1 3 341.402 2.532 10 0 EFAEHO C[C@@H]1CN(CC(=O)N[C@H](c2ccccc2)C2CCCC2)C[C@H]1CC[NH3+] ZINC000903496885 1312772625 /nfs/dbraw/zinc/77/26/25/1312772625.db2.gz ITSJULGUXXYASU-OZOXKJRCSA-N 1 3 343.515 2.951 10 0 EFAEHO CCOc1ccccc1[C@@H](CC)NC(=O)CN1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903496969 1312773741 /nfs/dbraw/zinc/77/37/41/1312773741.db2.gz LMDAQAHLMPOPQS-JFIYKMOQSA-N 1 3 347.503 2.569 10 0 EFAEHO C[C@@H]1CN([C@H]2CCCN(c3ccccc3Cl)C2=O)C[C@H]1CC[NH3+] ZINC000903497432 1312774817 /nfs/dbraw/zinc/77/48/17/1312774817.db2.gz WNVFVRJSYWGOBX-CPUCHLNUSA-N 1 3 335.879 2.752 10 0 EFAEHO COc1ccc(-c2noc([C@H](C)N3C[C@@H](C)[C@H](CC[NH3+])C3)n2)cc1 ZINC000903499776 1312777207 /nfs/dbraw/zinc/77/72/07/1312777207.db2.gz NKAHAJJVDBGSKR-VNHYZAJKSA-N 1 3 330.432 2.723 10 0 EFAEHO CC(C)[NH+]1CCC(N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C)CC1 ZINC000721920350 1312800972 /nfs/dbraw/zinc/80/09/72/1312800972.db2.gz OVOURZDQVVAWNT-HOCLYGCPSA-N 1 3 325.497 2.704 10 0 EFAEHO CN(C)C[C@@H]1CC[N@H+](C[C@H]2CCCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000876731457 1290992890 /nfs/dbraw/zinc/99/28/90/1290992890.db2.gz RCFBPXUYFKOQEN-SJORKVTESA-N 1 3 339.524 2.907 10 0 EFAEHO CN(C)C[C@@H]1CC[N@@H+](C[C@H]2CCCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000876731457 1290992905 /nfs/dbraw/zinc/99/29/05/1290992905.db2.gz RCFBPXUYFKOQEN-SJORKVTESA-N 1 3 339.524 2.907 10 0 EFAEHO CC[C@@H](C(=O)N(CC)CC[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001273611250 1292393761 /nfs/dbraw/zinc/39/37/61/1292393761.db2.gz VMONUPAVHOEWEE-INIZCTEOSA-N 1 3 325.884 2.618 10 0 EFAEHO CCN(CCNCc1cc(C)ccc1F)C(=O)CC1CC[NH+](C)CC1 ZINC001273645643 1293010549 /nfs/dbraw/zinc/01/05/49/1293010549.db2.gz OGEUMWOARLELPR-UHFFFAOYSA-N 1 3 349.494 2.804 10 0 EFAEHO O[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C12CCC2 ZINC000886637905 1295078537 /nfs/dbraw/zinc/07/85/37/1295078537.db2.gz HPXIHGHMHNQSOJ-VYJAJWGXSA-N 1 3 326.484 2.933 10 0 EFAEHO COC(=O)C1=CC[C@@H]([NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C1 ZINC000886641847 1295083468 /nfs/dbraw/zinc/08/34/68/1295083468.db2.gz UDEBOQKNLCPZTM-RNQOJCNYSA-N 1 3 340.467 2.891 10 0 EFAEHO COC(=O)C1=CC[C@@H](N[C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1 ZINC000886641847 1295083481 /nfs/dbraw/zinc/08/34/81/1295083481.db2.gz UDEBOQKNLCPZTM-RNQOJCNYSA-N 1 3 340.467 2.891 10 0 EFAEHO COC(=O)C1=CC[C@@H](N[C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1 ZINC000886641847 1295083492 /nfs/dbraw/zinc/08/34/92/1295083492.db2.gz UDEBOQKNLCPZTM-RNQOJCNYSA-N 1 3 340.467 2.891 10 0 EFAEHO COC(=O)[C@@H]1CC[C@H]([NH2+]C[C@H]2CN(Cc3ccccc3)C[C@@H]2C)C1 ZINC000886644310 1295084917 /nfs/dbraw/zinc/08/49/17/1295084917.db2.gz AADBCLWTFXJEDO-NQYYFHDYSA-N 1 3 330.472 2.686 10 0 EFAEHO CCN(CC[NH2+]CC1CC2(CCC2)C1)C(=O)[C@@H]1CCCCN1CC ZINC001273771935 1295243791 /nfs/dbraw/zinc/24/37/91/1295243791.db2.gz NUIDBQXKRZKVHX-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H]([NH2+]C/C=C/CNC(=O)C1(N(C)C)CCC1)c1cccc(F)c1 ZINC001274089849 1295450520 /nfs/dbraw/zinc/45/05/20/1295450520.db2.gz SRISPKZAHQHNQR-RGDDUWESSA-N 1 3 333.451 2.633 10 0 EFAEHO Cc1ccc(CC[NH2+]CC2CC(NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001275284574 1296248932 /nfs/dbraw/zinc/24/89/32/1296248932.db2.gz MAXQIXMMRXITQW-SOAGJPPSSA-N 1 3 345.531 2.608 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CCCC[C@H]1C[NH2+]CCC1CC1)N1CCCC1 ZINC001275784737 1296406655 /nfs/dbraw/zinc/40/66/55/1296406655.db2.gz XNHLHYVUCISMQO-ROUUACIJSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CCCC[C@@H]1C[NH2+]CCC1CC1)N1CCCC1 ZINC001275784736 1296406852 /nfs/dbraw/zinc/40/68/52/1296406852.db2.gz XNHLHYVUCISMQO-QZTJIDSGSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(C(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC001412684162 1296645873 /nfs/dbraw/zinc/64/58/73/1296645873.db2.gz HLHKDPVHGOOCSR-AQNXPRMDSA-N 1 3 343.515 2.840 10 0 EFAEHO CC1(C)[C@H]2NCCC[C@H]2[C@@H]1[NH2+]CCCNC(=O)/C=C/c1ccccc1 ZINC000925664207 1296868356 /nfs/dbraw/zinc/86/83/56/1296868356.db2.gz CXJNJIPYVLRBPI-XWNOHFPPSA-N 1 3 341.499 2.572 10 0 EFAEHO Cc1ccc([C@@H](NC[C@H]2CC3(CC[NH2+]CC3)C(=O)O2)C2CCC2)o1 ZINC000925851249 1296880856 /nfs/dbraw/zinc/88/08/56/1296880856.db2.gz QWTWRJOJULQRQR-WBVHZDCISA-N 1 3 332.444 2.704 10 0 EFAEHO COc1ccc([C@H]2CCCN2C[C@@H](C[NH3+])Cc2cnn(C)c2C)cc1 ZINC000903873024 1313326450 /nfs/dbraw/zinc/32/64/50/1313326450.db2.gz DMGYRXSEMVDKHH-OXQOHEQNSA-N 1 3 342.487 2.692 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NC/C=C/C[NH2+]Cc1cc2ccccc2s1 ZINC001273911001 1297120468 /nfs/dbraw/zinc/12/04/68/1297120468.db2.gz RLSXZNNCZHPBGL-LAQIPUCWSA-N 1 3 343.496 2.758 10 0 EFAEHO CC(C)N1CCC([N@H+](C)C[C@H](O)COc2ccc3cc[nH]c3c2)CC1 ZINC000929471928 1297183777 /nfs/dbraw/zinc/18/37/77/1297183777.db2.gz ZNVMWAOHFUNUOR-SFHVURJKSA-N 1 3 345.487 2.712 10 0 EFAEHO CC(C)N1CCC([N@@H+](C)C[C@H](O)COc2ccc3cc[nH]c3c2)CC1 ZINC000929471928 1297183780 /nfs/dbraw/zinc/18/37/80/1297183780.db2.gz ZNVMWAOHFUNUOR-SFHVURJKSA-N 1 3 345.487 2.712 10 0 EFAEHO Cc1c(C[C@@H](CN)C[NH+]2CCC(C)(c3ccccc3)CC2)cnn1C ZINC000903891043 1313360404 /nfs/dbraw/zinc/36/04/04/1313360404.db2.gz IMLROJBBNKVAFA-SFHVURJKSA-N 1 3 340.515 2.900 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN2CCC(C)(c3ccccc3)CC2)cnn1C ZINC000903891043 1313360408 /nfs/dbraw/zinc/36/04/08/1313360408.db2.gz IMLROJBBNKVAFA-SFHVURJKSA-N 1 3 340.515 2.900 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CCC[C@H]2Cc2ccc(C)cc2)cnn1C ZINC000903891302 1313361441 /nfs/dbraw/zinc/36/14/41/1313361441.db2.gz LJMXJSMQGHCODN-CTNGQTDRSA-N 1 3 340.515 2.861 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CCC[C@H]2Cc2ccc(C)cc2)cnn1C ZINC000903891302 1313361445 /nfs/dbraw/zinc/36/14/45/1313361445.db2.gz LJMXJSMQGHCODN-CTNGQTDRSA-N 1 3 340.515 2.861 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+]2CCC[C@H]2Cc2ccc(C)cc2)cnn1C ZINC000903891303 1313361550 /nfs/dbraw/zinc/36/15/50/1313361550.db2.gz LJMXJSMQGHCODN-FPOVZHCZSA-N 1 3 340.515 2.861 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+]2CCC[C@H]2Cc2ccc(C)cc2)cnn1C ZINC000903891303 1313361554 /nfs/dbraw/zinc/36/15/54/1313361554.db2.gz LJMXJSMQGHCODN-FPOVZHCZSA-N 1 3 340.515 2.861 10 0 EFAEHO CCN(C[C@H](C[NH3+])Cc1cnn(C)c1C)[C@H](C)c1cccc(O)c1 ZINC000903904205 1313386127 /nfs/dbraw/zinc/38/61/27/1313386127.db2.gz RITPVCTUKISWLF-CVEARBPZSA-N 1 3 330.476 2.635 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccsc2)C1 ZINC001488805451 1297766458 /nfs/dbraw/zinc/76/64/58/1297766458.db2.gz SASKGOWMGCGGTH-NXNVCVFFSA-N 1 3 335.517 2.605 10 0 EFAEHO Cc1c(C[C@H](CN)C[NH2+][C@H](C)C(C)(C)c2ccccc2)cnn1C ZINC000903922994 1313424809 /nfs/dbraw/zinc/42/48/09/1313424809.db2.gz JBLHQZJHMRXVRX-IAGOWNOFSA-N 1 3 328.504 2.802 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN2CCc3ccc(F)cc3[C@H](C)C2)cnn1C ZINC000903931630 1313437661 /nfs/dbraw/zinc/43/76/61/1313437661.db2.gz GOIJUWQTPCYMIK-ZBFHGGJFSA-N 1 3 344.478 2.647 10 0 EFAEHO COc1cccc(C2(NC[C@H](C[NH3+])Cc3cnn(C)c3C)CCC2)c1 ZINC000903933333 1313441295 /nfs/dbraw/zinc/44/12/95/1313441295.db2.gz PAQQYPRVGUWTLV-INIZCTEOSA-N 1 3 342.487 2.524 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN[C@@]2(c3ccccc3)CC2(C)C)cnn1C ZINC000903933460 1313441305 /nfs/dbraw/zinc/44/13/05/1313441305.db2.gz RRMHQJHDPFADIU-OXJNMPFZSA-N 1 3 326.488 2.761 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]CCC(C)(C)C)N(C)C ZINC001489053660 1298024433 /nfs/dbraw/zinc/02/44/33/1298024433.db2.gz UPNSOYBNWVIOBC-IKGGRYGDSA-N 1 3 325.541 2.980 10 0 EFAEHO COc1cc(C[NH2+]C[C@H]2CNCCC2(F)F)ccc1OC(C)C ZINC000903954804 1313480304 /nfs/dbraw/zinc/48/03/04/1313480304.db2.gz WGUCIYJCYHNSSK-CQSZACIVSA-N 1 3 328.403 2.817 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@H+](C)CCCNC(=O)CN1CC[C@@H](C)C1 ZINC001490250614 1298678090 /nfs/dbraw/zinc/67/80/90/1298678090.db2.gz NAWJLGNCLAXBOV-SJLPKXTDSA-N 1 3 331.504 2.836 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@@H+](C)CCCNC(=O)CN1CC[C@@H](C)C1 ZINC001490250614 1298678097 /nfs/dbraw/zinc/67/80/97/1298678097.db2.gz NAWJLGNCLAXBOV-SJLPKXTDSA-N 1 3 331.504 2.836 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](C)[C@@H]2CCc3c2cccc3F)C1 ZINC001490250468 1298679369 /nfs/dbraw/zinc/67/93/69/1298679369.db2.gz LFKGRWPCLPSQFS-DNVCBOLYSA-N 1 3 347.478 2.593 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](C)[C@@H]2CCc3c2cccc3F)C1 ZINC001490250468 1298679380 /nfs/dbraw/zinc/67/93/80/1298679380.db2.gz LFKGRWPCLPSQFS-DNVCBOLYSA-N 1 3 347.478 2.593 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC001490348966 1298743907 /nfs/dbraw/zinc/74/39/07/1298743907.db2.gz LSCSCTFIJKUSEN-SIJIIQCFSA-N 1 3 329.916 2.832 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[N@H+](CCCCCF)C1)N1CCCCC1 ZINC001490540688 1298949270 /nfs/dbraw/zinc/94/92/70/1298949270.db2.gz PYYHOJLPSLNQAN-INIZCTEOSA-N 1 3 327.488 2.581 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[N@@H+](CCCCCF)C1)N1CCCCC1 ZINC001490540688 1298949280 /nfs/dbraw/zinc/94/92/80/1298949280.db2.gz PYYHOJLPSLNQAN-INIZCTEOSA-N 1 3 327.488 2.581 10 0 EFAEHO O=C(CCC[NH+]1CCCCC1)N[C@@H]1CCN(CC2=CCCCC2)C1 ZINC001490576493 1298996665 /nfs/dbraw/zinc/99/66/65/1298996665.db2.gz JPRLBCYCZKCYDM-LJQANCHMSA-N 1 3 333.520 2.943 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1ccccc1C)C1CC1 ZINC001490670681 1299069346 /nfs/dbraw/zinc/06/93/46/1299069346.db2.gz FLDZGKQVMBNBHR-UXHICEINSA-N 1 3 343.515 2.854 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](NCc1ccccc1F)C1CC1 ZINC001490671408 1299070439 /nfs/dbraw/zinc/07/04/39/1299070439.db2.gz IUIDEOFHOFDTAA-RTBURBONSA-N 1 3 347.478 2.685 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](NCc1ccccc1F)C1CC1 ZINC001490671408 1299070448 /nfs/dbraw/zinc/07/04/48/1299070448.db2.gz IUIDEOFHOFDTAA-RTBURBONSA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CCc1cccs1)C1CC1 ZINC001490662048 1299105441 /nfs/dbraw/zinc/10/54/41/1299105441.db2.gz QHEZQIKCZVNLKG-ZWKOTPCHSA-N 1 3 349.544 2.648 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]([NH2+]CC2CCC3(CC3)CC2)C2CC2)C1 ZINC001490711714 1299121146 /nfs/dbraw/zinc/12/11/46/1299121146.db2.gz ZWQSCOCIFKQJSE-VQIMIIECSA-N 1 3 347.547 2.783 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@H]([NH2+]CCC(F)(F)F)C1CC1 ZINC001490718374 1299127137 /nfs/dbraw/zinc/12/71/37/1299127137.db2.gz SHXLHXWBRHFORN-CABCVRRESA-N 1 3 349.441 2.686 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+][C@H](CNC(=O)CN(C)C(C)C)C1CC1 ZINC001490740531 1299177941 /nfs/dbraw/zinc/17/79/41/1299177941.db2.gz DDAAITXMJBSGHZ-QFBILLFUSA-N 1 3 331.504 2.881 10 0 EFAEHO CN(C/C=C/Cl)C[C@@H]1CCCN(C(=O)CCCC[NH+](C)C)C1 ZINC001490774428 1299231796 /nfs/dbraw/zinc/23/17/96/1299231796.db2.gz BTQGYKIHIQPXBI-JCVNQNCUSA-N 1 3 329.916 2.641 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@H+](C)Cc2ccccc2)C1 ZINC001490776346 1299238758 /nfs/dbraw/zinc/23/87/58/1299238758.db2.gz IVCRRCZRLCZIMB-IBGZPJMESA-N 1 3 331.504 2.697 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@@H+](C)Cc2ccccc2)C1 ZINC001490776346 1299238768 /nfs/dbraw/zinc/23/87/68/1299238768.db2.gz IVCRRCZRLCZIMB-IBGZPJMESA-N 1 3 331.504 2.697 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@@H](C[N@H+](C)CCCF)C1 ZINC001490776790 1299241137 /nfs/dbraw/zinc/24/11/37/1299241137.db2.gz RVARGUUPMPUTEN-ROUUACIJSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@@H](C[N@@H+](C)CCCF)C1 ZINC001490776790 1299241147 /nfs/dbraw/zinc/24/11/47/1299241147.db2.gz RVARGUUPMPUTEN-ROUUACIJSA-N 1 3 341.515 2.779 10 0 EFAEHO Cc1ccc(N2CC[C@@H](N3CCC[C@@H](C4CC[NH2+]CC4)C3)C2=O)cc1 ZINC000852754241 1299863419 /nfs/dbraw/zinc/86/34/19/1299863419.db2.gz QQJFRMUTWDBIDX-UYAOXDASSA-N 1 3 341.499 2.812 10 0 EFAEHO CC1CCN([C@H](CNC(=O)C=C2CC[NH2+]CC2)c2cccs2)CC1 ZINC000852855440 1299915540 /nfs/dbraw/zinc/91/55/40/1299915540.db2.gz ZCCCQWDYWBXSKJ-QGZVFWFLSA-N 1 3 347.528 2.947 10 0 EFAEHO CCN(C(=O)NCCCCCCC[NH+]1CCCC1)[C@H]1CCN(C)C1 ZINC000853820026 1300293855 /nfs/dbraw/zinc/29/38/55/1300293855.db2.gz FMVOMAVDFMXDLA-SFHVURJKSA-N 1 3 338.540 2.768 10 0 EFAEHO C/C(=C\C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccc(F)cc1 ZINC000855346078 1300924556 /nfs/dbraw/zinc/92/45/56/1300924556.db2.gz NKWQJKYENGTDTD-MDJJKAFGSA-N 1 3 335.467 2.617 10 0 EFAEHO C/C(=C\C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccc(F)cc1 ZINC000855346078 1300924563 /nfs/dbraw/zinc/92/45/63/1300924563.db2.gz NKWQJKYENGTDTD-MDJJKAFGSA-N 1 3 335.467 2.617 10 0 EFAEHO Cc1c(CN2CCC(N3CC[NH+](C(C)C)CC3)CC2)ccnc1F ZINC000862250810 1302323319 /nfs/dbraw/zinc/32/33/19/1302323319.db2.gz PUQXVVQZKLOUMC-UHFFFAOYSA-N 1 3 334.483 2.520 10 0 EFAEHO CN(C)CCC[N@H+](C)C[C@H]1CC(F)(F)CN1C(=O)OC(C)(C)C ZINC000862367034 1302349141 /nfs/dbraw/zinc/34/91/41/1302349141.db2.gz SOPUYQQMRFNZLH-CYBMUJFWSA-N 1 3 335.439 2.515 10 0 EFAEHO CN(C)CCC[N@@H+](C)C[C@H]1CC(F)(F)CN1C(=O)OC(C)(C)C ZINC000862367034 1302349154 /nfs/dbraw/zinc/34/91/54/1302349154.db2.gz SOPUYQQMRFNZLH-CYBMUJFWSA-N 1 3 335.439 2.515 10 0 EFAEHO C[C@@H]1CC[C@@H](N[C@H]2CCCN(C(=O)Oc3ccccc3)CC2)C[NH2+]1 ZINC000863544890 1302645369 /nfs/dbraw/zinc/64/53/69/1302645369.db2.gz DPWLIEZBADROEJ-IXDOHACOSA-N 1 3 331.460 2.770 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+]C/C=C/Cl)C1CCCC1)CC(C)(C)C ZINC001278275386 1313863536 /nfs/dbraw/zinc/86/35/36/1313863536.db2.gz PDZNMDALCPUBDD-JCVNQNCUSA-N 1 3 343.943 2.981 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+]C/C=C/Cl)C1CCCC1)CC(C)(C)C ZINC001278275387 1313863581 /nfs/dbraw/zinc/86/35/81/1313863581.db2.gz PDZNMDALCPUBDD-OJXHRBAXSA-N 1 3 343.943 2.981 10 0 EFAEHO C[NH+]1CCC(CNC(=O)[C@@H]2C[C@H]2C(C)(C)C)(N2CCCCC2)CC1 ZINC000866115122 1303530863 /nfs/dbraw/zinc/53/08/63/1303530863.db2.gz OWCWROILXHHPSX-IAGOWNOFSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1ccc(CN2CCO[C@@H](C[NH2+]C3CCN(C(C)C)CC3)C2)cc1 ZINC000866558597 1303686649 /nfs/dbraw/zinc/68/66/49/1303686649.db2.gz PQTISSHHVNDFAQ-NRFANRHFSA-N 1 3 345.531 2.658 10 0 EFAEHO C([NH2+]C1CCN([C@H]2CCOC2)CC1)[C@@H]1CCN1C1CCCCCC1 ZINC000866562918 1303689363 /nfs/dbraw/zinc/68/93/63/1303689363.db2.gz WYSQPXXNDOCLGJ-PMACEKPBSA-N 1 3 335.536 2.626 10 0 EFAEHO COC(=O)c1ccccc1OCCN1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866707081 1303760394 /nfs/dbraw/zinc/76/03/94/1303760394.db2.gz LRNLEJPGGPVIIE-LJQANCHMSA-N 1 3 334.460 2.549 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)[C@@H]2CCC[C@H]([NH+](C)C)C2)CCN1Cc1ccccc1 ZINC001413061657 1314068365 /nfs/dbraw/zinc/06/83/65/1314068365.db2.gz STUYDBJPERYFJS-RSPOEFSDSA-N 1 3 343.515 2.886 10 0 EFAEHO CC(C)(C)[C@@]1(C[NH3+])CCN(C(=O)[C@@H]2CCCN2Cc2ccccc2)C1 ZINC000870991642 1305733512 /nfs/dbraw/zinc/73/35/12/1305733512.db2.gz HHBUXEKSUJRACM-GHTZIAJQSA-N 1 3 343.515 2.875 10 0 EFAEHO C[NH+](C)C1(C)CCC(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC000871360347 1306020816 /nfs/dbraw/zinc/02/08/16/1306020816.db2.gz AZZBUQQSVSDCSE-IUPXNIOVSA-N 1 3 327.488 2.578 10 0 EFAEHO C[NH+](C)C1(C)CCC(NC(=O)C2C[C@@H](c3ccccc3)OC2=O)CC1 ZINC000871360563 1306021274 /nfs/dbraw/zinc/02/12/74/1306021274.db2.gz GPKWKEXLIFKQRH-ASPXRTSYSA-N 1 3 344.455 2.670 10 0 EFAEHO O=C(c1ccc(NC2=NCCC2)cc1)N1CCN(c2cc[nH+]cc2)CC1 ZINC000900007675 1307594775 /nfs/dbraw/zinc/59/47/75/1307594775.db2.gz QAFBHOIWPVYZNC-UHFFFAOYSA-N 1 3 349.438 2.648 10 0 EFAEHO c1nc2cc(C[NH2+]C3CCN(C[C@@H]4CCOC4)CC3)ccc2s1 ZINC001413129122 1308097842 /nfs/dbraw/zinc/09/78/42/1308097842.db2.gz SBVXRQLNBFYCII-HNNXBMFYSA-N 1 3 331.485 2.887 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900958934 1309040352 /nfs/dbraw/zinc/04/03/52/1309040352.db2.gz NBJPOVIWYMEGNY-SJORKVTESA-N 1 3 328.460 2.893 10 0 EFAEHO C[N@@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000901135343 1309575679 /nfs/dbraw/zinc/57/56/79/1309575679.db2.gz LTWZEUGAUBGYEI-WMZOPIPTSA-N 1 3 340.471 2.847 10 0 EFAEHO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000901135343 1309575683 /nfs/dbraw/zinc/57/56/83/1309575683.db2.gz LTWZEUGAUBGYEI-WMZOPIPTSA-N 1 3 340.471 2.847 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@H+](CC3CCCC3)CC[C@@H]21 ZINC001490984654 1311149513 /nfs/dbraw/zinc/14/95/13/1311149513.db2.gz UTLZWGUXNUKPOP-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@@H+](CC3CCCC3)CC[C@@H]21 ZINC001490984654 1311149514 /nfs/dbraw/zinc/14/95/14/1311149514.db2.gz UTLZWGUXNUKPOP-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CCCCC[N@@H+]1C[C@@]2(C)CN(C(=O)[C@@H](C(C)C)N(C)C)C[C@@]2(C)C1 ZINC001276906054 1311283627 /nfs/dbraw/zinc/28/36/27/1311283627.db2.gz JJAGDLLLIMXVBK-RLLQIKCJSA-N 1 3 337.552 2.933 10 0 EFAEHO CCCCC[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H](C(C)C)N(C)C)C[C@@]2(C)C1 ZINC001276906054 1311283628 /nfs/dbraw/zinc/28/36/28/1311283628.db2.gz JJAGDLLLIMXVBK-RLLQIKCJSA-N 1 3 337.552 2.933 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@H]2C[C@H](C[NH2+]C/C=C/c3ccccc3)C2)C1 ZINC001277046220 1311527637 /nfs/dbraw/zinc/52/76/37/1311527637.db2.gz KHGJJZGRWHMRFT-LBNSPJENSA-N 1 3 341.499 2.526 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]CCCc2ccsc2)CC1 ZINC001277258817 1311884253 /nfs/dbraw/zinc/88/42/53/1311884253.db2.gz BNOAUSSOXFDJJW-HZPDHXFCSA-N 1 3 349.544 2.792 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001277286063 1311931244 /nfs/dbraw/zinc/93/12/44/1311931244.db2.gz UMZFJWDZRAVKNR-IBGZPJMESA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001277286063 1311931246 /nfs/dbraw/zinc/93/12/46/1311931246.db2.gz UMZFJWDZRAVKNR-IBGZPJMESA-N 1 3 335.536 2.853 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CCC[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001277299513 1311947197 /nfs/dbraw/zinc/94/71/97/1311947197.db2.gz UYGKPQGWSLFOJC-IAGOWNOFSA-N 1 3 349.494 2.850 10 0 EFAEHO CC/C=C/CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)CN1CCCC1 ZINC001277324470 1311989627 /nfs/dbraw/zinc/98/96/27/1311989627.db2.gz OIZTZHHBNSCFQQ-RGNBEIPZSA-N 1 3 333.520 2.940 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@@H]2C[C@H](C)Cc3cc(OC)ccc32)CC1 ZINC000902745212 1312070996 /nfs/dbraw/zinc/07/09/96/1312070996.db2.gz LWLHOZJKEUPNSC-DYESRHJHSA-N 1 3 345.531 2.936 10 0 EFAEHO c1ccc(CCN2CC[C@@H](C[NH2+][C@H]3CC[C@@H]4[C@H]5OCC[C@H]5[C@@H]43)C2)cc1 ZINC000902790398 1312110120 /nfs/dbraw/zinc/11/01/20/1312110120.db2.gz QGHTUULUTQHTPA-PCPGVINSSA-N 1 3 340.511 2.954 10 0 EFAEHO COc1ccc2c(c1)C[C@H](C)C[C@@H]2[NH2+]CCN1CCN(C)C(C)(C)C1 ZINC000902982161 1312259516 /nfs/dbraw/zinc/25/95/16/1312259516.db2.gz WKXZASXBIGYLND-JXFKEZNVSA-N 1 3 345.531 2.934 10 0 EFAEHO c1cc(CCNC2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)c2c(c1)OCCO2 ZINC000903225623 1312479538 /nfs/dbraw/zinc/47/95/38/1312479538.db2.gz HRTLRWDJVISCMM-ZNXRZULTSA-N 1 3 328.456 2.748 10 0 EFAEHO c1cc(CCNC2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)c2c(c1)OCCO2 ZINC000903225623 1312479540 /nfs/dbraw/zinc/47/95/40/1312479540.db2.gz HRTLRWDJVISCMM-ZNXRZULTSA-N 1 3 328.456 2.748 10 0 EFAEHO CCOC(=O)C1CCC(N[C@@H](CC[NH+](C)C)c2cccnc2)CC1 ZINC000903380753 1312616748 /nfs/dbraw/zinc/61/67/48/1312616748.db2.gz OTWJMMWLFXYVBL-VJFUWPCTSA-N 1 3 333.476 2.786 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@@H]2C(CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001276699258 1314510746 /nfs/dbraw/zinc/51/07/46/1314510746.db2.gz CDBXZCPWLKLLJA-AJKFSTMBSA-N 1 3 333.520 2.511 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@@H]2C(CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001276699258 1314510752 /nfs/dbraw/zinc/51/07/52/1314510752.db2.gz CDBXZCPWLKLLJA-AJKFSTMBSA-N 1 3 333.520 2.511 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN3CCC(C)CC3)C[C@@H]21 ZINC001278487259 1314790739 /nfs/dbraw/zinc/79/07/39/1314790739.db2.gz NBBNVYQHNIISPY-SLFFLAALSA-N 1 3 347.547 2.901 10 0 EFAEHO CCCC[NH2+][C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1CC ZINC001276751315 1315033758 /nfs/dbraw/zinc/03/37/58/1315033758.db2.gz PBPBYAZFNSZBNL-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)CC[NH2+]C[C@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001278550358 1315170668 /nfs/dbraw/zinc/17/06/68/1315170668.db2.gz PXSRKSLTELKRHM-IBGZPJMESA-N 1 3 325.541 2.839 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@](C)(C[NH2+]CCc2ccccc2F)C1 ZINC001278571384 1315212609 /nfs/dbraw/zinc/21/26/09/1315212609.db2.gz FZRCYPVYSLQYCL-HXUWFJFHSA-N 1 3 349.494 2.538 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@](C)(C[NH2+]CCc2ccc(C)cc2)C1 ZINC001278571634 1315213455 /nfs/dbraw/zinc/21/34/55/1315213455.db2.gz HZEPZHTVUIPKAE-OAQYLSRUSA-N 1 3 345.531 2.708 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@](C)(C[NH2+]C/C=C/c2ccccc2)C1 ZINC001278573813 1315216869 /nfs/dbraw/zinc/21/68/69/1315216869.db2.gz YTOIQFYBBWPKDX-MAIVGLDJSA-N 1 3 343.515 2.870 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@](C)(C[NH2+]C/C=C\c2ccccc2)C1 ZINC001278573816 1315217398 /nfs/dbraw/zinc/21/73/98/1315217398.db2.gz YTOIQFYBBWPKDX-ZRKSWWEUSA-N 1 3 343.515 2.870 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C(F)(F)F ZINC001278703349 1315580884 /nfs/dbraw/zinc/58/08/84/1315580884.db2.gz GZAGDKGQRVHJRP-GJZGRUSLSA-N 1 3 349.441 2.519 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H](NC(=O)CN(C)C(C)C)C(C)(C)C)cc1 ZINC001279034881 1316086513 /nfs/dbraw/zinc/08/65/13/1316086513.db2.gz PKZCFRPDTCLLBK-LJQANCHMSA-N 1 3 347.547 2.998 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@@H](C)C1)C1CC[NH+](CCCCCF)CC1 ZINC001279096621 1316148990 /nfs/dbraw/zinc/14/89/90/1316148990.db2.gz CLTYMJYFWVCFHW-IAGOWNOFSA-N 1 3 341.515 2.685 10 0 EFAEHO CC(C)CCC[NH2+]CC[C@H]1[C@@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001263954745 1316574559 /nfs/dbraw/zinc/57/45/59/1316574559.db2.gz BORJIXVZWVVKRE-WMZOPIPTSA-N 1 3 334.508 2.995 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)C[C@@H]2C1 ZINC001264098606 1316589112 /nfs/dbraw/zinc/58/91/12/1316589112.db2.gz QUXIXGNGEOLPAX-MOPGFXCFSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCCC[N@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)C[C@@H]2C1 ZINC001264098606 1316589115 /nfs/dbraw/zinc/58/91/15/1316589115.db2.gz QUXIXGNGEOLPAX-MOPGFXCFSA-N 1 3 335.536 2.689 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001264100787 1316589317 /nfs/dbraw/zinc/58/93/17/1316589317.db2.gz HRKZGYBDPVAAKZ-YMHTTXFNSA-N 1 3 335.536 2.853 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001264100787 1316589319 /nfs/dbraw/zinc/58/93/19/1316589319.db2.gz HRKZGYBDPVAAKZ-YMHTTXFNSA-N 1 3 335.536 2.853 10 0 EFAEHO C[C@H](c1cccc(F)c1)[N@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001264994600 1316682944 /nfs/dbraw/zinc/68/29/44/1316682944.db2.gz CVTFVAQKQVCQLY-OAHLLOKOSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@H](c1cccc(F)c1)[N@@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001264994600 1316682947 /nfs/dbraw/zinc/68/29/47/1316682947.db2.gz CVTFVAQKQVCQLY-OAHLLOKOSA-N 1 3 335.467 2.809 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@H+](C)[C@H]1CCc2ccc(F)cc21)N(C)C ZINC001265032050 1316694897 /nfs/dbraw/zinc/69/48/97/1316694897.db2.gz HEWOQKWICPYVLW-RBUKOAKNSA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@@H+](C)[C@H]1CCc2ccc(F)cc21)N(C)C ZINC001265032050 1316694900 /nfs/dbraw/zinc/69/49/00/1316694900.db2.gz HEWOQKWICPYVLW-RBUKOAKNSA-N 1 3 349.494 2.837 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)[C@H]1CCc2c1cccc2F)N(C)C ZINC001265037277 1316696915 /nfs/dbraw/zinc/69/69/15/1316696915.db2.gz UANCKWYREQZVCW-ROUUACIJSA-N 1 3 335.467 2.591 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)[C@H]1CCc2c1cccc2F)N(C)C ZINC001265037277 1316696916 /nfs/dbraw/zinc/69/69/16/1316696916.db2.gz UANCKWYREQZVCW-ROUUACIJSA-N 1 3 335.467 2.591 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)Cc1ccc(Cl)cc1)N(C)C ZINC001265037334 1316697167 /nfs/dbraw/zinc/69/71/67/1316697167.db2.gz WLNOVXWNTOVDLU-INIZCTEOSA-N 1 3 325.884 2.618 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)Cc1ccc(Cl)cc1)N(C)C ZINC001265037334 1316697170 /nfs/dbraw/zinc/69/71/70/1316697170.db2.gz WLNOVXWNTOVDLU-INIZCTEOSA-N 1 3 325.884 2.618 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN(C)C(C)C)[C@@H]1CCc2c1cccc2F ZINC001265147969 1316739045 /nfs/dbraw/zinc/73/90/45/1316739045.db2.gz QJTRZHGEEBPHRV-LJQANCHMSA-N 1 3 349.494 2.981 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN(C)C(C)C)[C@@H]1CCc2c1cccc2F ZINC001265147969 1316739046 /nfs/dbraw/zinc/73/90/46/1316739046.db2.gz QJTRZHGEEBPHRV-LJQANCHMSA-N 1 3 349.494 2.981 10 0 EFAEHO Cc1ccc(C[N@@H+](CCCNC(=O)[C@@H]2CCCN2C)C2CC2)cc1F ZINC001265156360 1316741865 /nfs/dbraw/zinc/74/18/65/1316741865.db2.gz WXYAXVNPODYSDN-IBGZPJMESA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(C[N@H+](CCCNC(=O)[C@@H]2CCCN2C)C2CC2)cc1F ZINC001265156360 1316741867 /nfs/dbraw/zinc/74/18/67/1316741867.db2.gz WXYAXVNPODYSDN-IBGZPJMESA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](C[C@@H]1CC[C@@H]2C[C@@H]2C1)C1CC1 ZINC001265182907 1316746397 /nfs/dbraw/zinc/74/63/97/1316746397.db2.gz VIFAIIATRLTCDG-ZACQAIPSSA-N 1 3 344.503 2.668 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](C[C@@H]1CC[C@@H]2C[C@@H]2C1)C1CC1 ZINC001265182907 1316746399 /nfs/dbraw/zinc/74/63/99/1316746399.db2.gz VIFAIIATRLTCDG-ZACQAIPSSA-N 1 3 344.503 2.668 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCN(CCCCCF)C1)[NH+]1CCCCC1 ZINC001265320089 1316780674 /nfs/dbraw/zinc/78/06/74/1316780674.db2.gz XSGZVWOHXGYESI-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@H+](CCCCCF)C1)N1CCCCC1 ZINC001265320089 1316780676 /nfs/dbraw/zinc/78/06/76/1316780676.db2.gz XSGZVWOHXGYESI-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@@H+](CCCCCF)C1)N1CCCCC1 ZINC001265320089 1316780678 /nfs/dbraw/zinc/78/06/78/1316780678.db2.gz XSGZVWOHXGYESI-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCN(C(=O)CN1CC[C@@H](C)C1)C1CC[NH+](CC=C(C)C)CC1 ZINC001265341673 1316786538 /nfs/dbraw/zinc/78/65/38/1316786538.db2.gz WGRMUUFJIOHHNN-GOSISDBHSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H]([NH2+]CCCc2cccc(C)c2)C1)N(C)C ZINC001265503467 1316814640 /nfs/dbraw/zinc/81/46/40/1316814640.db2.gz WASPIABSIOSKNK-GUDVDZBRSA-N 1 3 331.504 2.505 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H](C[NH2+]CCC3CCCC3)C2)C1 ZINC001265623915 1316837223 /nfs/dbraw/zinc/83/72/23/1316837223.db2.gz GUATYUMHXDAGPM-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)CCC[NH2+]C[C@H]1CCCCN1C(=O)[C@H](C(C)C)N(C)C ZINC001265688038 1316854382 /nfs/dbraw/zinc/85/43/82/1316854382.db2.gz LGLZTPDQHOZRBK-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC2CCC([NH2+]CCCC3CCC3)CC2)C1 ZINC001265739638 1316869705 /nfs/dbraw/zinc/86/97/05/1316869705.db2.gz UIXHVDODGPSPSY-IPJUCJBFSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCCc1ccsc1 ZINC001265808943 1316880993 /nfs/dbraw/zinc/88/09/93/1316880993.db2.gz OHBGANHRANOGQR-HNNXBMFYSA-N 1 3 337.533 2.649 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C)cc1C ZINC001265866057 1316897164 /nfs/dbraw/zinc/89/71/64/1316897164.db2.gz FRXOXEUTVSUNSS-IBGZPJMESA-N 1 3 333.520 2.828 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C)cc1C ZINC001265866057 1316897166 /nfs/dbraw/zinc/89/71/66/1316897166.db2.gz FRXOXEUTVSUNSS-IBGZPJMESA-N 1 3 333.520 2.828 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CC[C@H](NCc2ccc(Cl)s2)C1 ZINC001265941522 1316922385 /nfs/dbraw/zinc/92/23/85/1316922385.db2.gz BMTABDVITITUGR-ZDUSSCGKSA-N 1 3 343.924 2.824 10 0 EFAEHO CN(CCCNC(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1)Cc1ccsc1 ZINC001265954795 1316927365 /nfs/dbraw/zinc/92/73/65/1316927365.db2.gz WLBIRHRTTBHXHZ-SJORKVTESA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001266029619 1316961539 /nfs/dbraw/zinc/96/15/39/1316961539.db2.gz UVYWRWQWXAQWJW-JFYHIKNKSA-N 1 3 343.515 2.724 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@H](C[NH2+]CCC3CC3)C2)c1 ZINC001266040216 1316968977 /nfs/dbraw/zinc/96/89/77/1316968977.db2.gz JFNOVQGPHNVVIJ-GOSISDBHSA-N 1 3 329.488 2.600 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@H]2CCC[C@H]3CCC[N@@H+]32)c1 ZINC001367540303 1338846237 /nfs/dbraw/zinc/84/62/37/1338846237.db2.gz GIMXFCWSTNRJDC-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@H]2CCC[C@H]3CCC[N@H+]32)c1 ZINC001367540303 1338846239 /nfs/dbraw/zinc/84/62/39/1338846239.db2.gz GIMXFCWSTNRJDC-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001266049609 1316975752 /nfs/dbraw/zinc/97/57/52/1316975752.db2.gz YBZASIRMHZVCGS-KOJMWDNASA-N 1 3 341.927 2.974 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001266049609 1316975756 /nfs/dbraw/zinc/97/57/56/1316975756.db2.gz YBZASIRMHZVCGS-KOJMWDNASA-N 1 3 341.927 2.974 10 0 EFAEHO CC[N@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CCC1CC1 ZINC001266082693 1317007776 /nfs/dbraw/zinc/00/77/76/1317007776.db2.gz MUVPHBCRJNDZOV-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[N@@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CCC1CC1 ZINC001266082693 1317007784 /nfs/dbraw/zinc/00/77/84/1317007784.db2.gz MUVPHBCRJNDZOV-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@@](C)(CNCC=C(Cl)Cl)C2CC2)CC1 ZINC001318714119 1328676068 /nfs/dbraw/zinc/67/60/68/1328676068.db2.gz QALGNBWEEVZMKZ-HNNXBMFYSA-N 1 3 348.318 2.522 10 0 EFAEHO OC1(CNCc2cncc(Cl)c2)CC[NH+](Cc2ccccc2)CC1 ZINC000702709631 1317053600 /nfs/dbraw/zinc/05/36/00/1317053600.db2.gz MQCDGXRLBODBQE-UHFFFAOYSA-N 1 3 345.874 2.852 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCCN(Cc2ccsc2)C2CC2)CC[N@@H+]1C ZINC001266153561 1317105130 /nfs/dbraw/zinc/10/51/30/1317105130.db2.gz MUIBYCKNWHMTEO-RDJZCZTQSA-N 1 3 349.544 2.949 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCCN(Cc2ccsc2)C2CC2)CC[N@H+]1C ZINC001266153561 1317105134 /nfs/dbraw/zinc/10/51/34/1317105134.db2.gz MUIBYCKNWHMTEO-RDJZCZTQSA-N 1 3 349.544 2.949 10 0 EFAEHO CC(C)(C(=O)N(CC[NH2+]CC1CC1)Cc1ccccc1)N1CCCC1 ZINC001279311863 1317233753 /nfs/dbraw/zinc/23/37/53/1317233753.db2.gz OSKQVDHPVOAWOQ-UHFFFAOYSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@H](c1ccccc1)[N@H+]1CC=C(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001279573807 1317305597 /nfs/dbraw/zinc/30/55/97/1317305597.db2.gz HTCFSQHSTFUGES-QGZVFWFLSA-N 1 3 341.499 2.980 10 0 EFAEHO C[C@H](c1ccccc1)[N@@H+]1CC=C(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001279573807 1317305605 /nfs/dbraw/zinc/30/56/05/1317305605.db2.gz HTCFSQHSTFUGES-QGZVFWFLSA-N 1 3 341.499 2.980 10 0 EFAEHO C[C@@H](c1ccccc1)[N@H+]1CC=C(CNC(=O)CN(C)C2CCC2)CC1 ZINC001279574992 1317306899 /nfs/dbraw/zinc/30/68/99/1317306899.db2.gz XRTSPMDKQBSXEP-KRWDZBQOSA-N 1 3 341.499 2.980 10 0 EFAEHO C[C@@H](c1ccccc1)[N@@H+]1CC=C(CNC(=O)CN(C)C2CCC2)CC1 ZINC001279574992 1317306908 /nfs/dbraw/zinc/30/69/08/1317306908.db2.gz XRTSPMDKQBSXEP-KRWDZBQOSA-N 1 3 341.499 2.980 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@H](CC[NH2+]CC=C(Cl)Cl)C1 ZINC001318777764 1328696489 /nfs/dbraw/zinc/69/64/89/1328696489.db2.gz CNWCRDYPUONKAT-ZIAGYGMSSA-N 1 3 348.318 2.618 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC[C@H]2CCN(C(=O)CN3CCCC3)C2)c1 ZINC001280297148 1317499696 /nfs/dbraw/zinc/49/96/96/1317499696.db2.gz RDSIZQWRUBAZKS-IBGZPJMESA-N 1 3 343.515 2.727 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001281088438 1318010993 /nfs/dbraw/zinc/01/09/93/1318010993.db2.gz RTRJOQLQKLNWBV-GNAXCBTBSA-N 1 3 330.476 2.623 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001281088438 1318011000 /nfs/dbraw/zinc/01/10/00/1318011000.db2.gz RTRJOQLQKLNWBV-GNAXCBTBSA-N 1 3 330.476 2.623 10 0 EFAEHO C[C@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@@H]1[NH2+]CCCCC(F)(F)F ZINC001281409022 1318274248 /nfs/dbraw/zinc/27/42/48/1318274248.db2.gz SAEPOEPHGGSKIW-KBPBESRZSA-N 1 3 349.441 2.640 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)CN(C)C2CCC2)CC[N@@H+]1CCCCCF ZINC001281664326 1318529573 /nfs/dbraw/zinc/52/95/73/1318529573.db2.gz KLFPEZQKOKDKGG-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)CN(C)C2CCC2)CC[N@H+]1CCCCCF ZINC001281664326 1318529579 /nfs/dbraw/zinc/52/95/79/1318529579.db2.gz KLFPEZQKOKDKGG-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1CC(C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001282014066 1318663921 /nfs/dbraw/zinc/66/39/21/1318663921.db2.gz QTPYTAIZOKXZIH-XJIUMZNISA-N 1 3 343.515 2.770 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[N@H+](CCC(C)C)CC1(C)C)N(CC)CC ZINC001403381758 1364589997 /nfs/dbraw/zinc/58/99/97/1364589997.db2.gz KVHPEBSBSRSQEI-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[N@@H+](CCC(C)C)CC1(C)C)N(CC)CC ZINC001403381758 1364590000 /nfs/dbraw/zinc/59/00/00/1364590000.db2.gz KVHPEBSBSRSQEI-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)=CC[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001282857650 1319164361 /nfs/dbraw/zinc/16/43/61/1319164361.db2.gz CHVLLJYBHFIJJK-NNZMDNLPSA-N 1 3 333.520 2.511 10 0 EFAEHO CC(C)=CC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001282857650 1319164369 /nfs/dbraw/zinc/16/43/69/1319164369.db2.gz CHVLLJYBHFIJJK-NNZMDNLPSA-N 1 3 333.520 2.511 10 0 EFAEHO C[C@@H](CCC[NH2+]CC1CC2(CCC2)C1)NC(=O)C1(N(C)C)CCC1 ZINC001283187352 1319411624 /nfs/dbraw/zinc/41/16/24/1319411624.db2.gz UQPXIPDOLMKXKZ-INIZCTEOSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@H](CCC[NH2+]CC1CC2(CCC2)C1)NC(=O)C1(N(C)C)CCC1 ZINC001283187353 1319412010 /nfs/dbraw/zinc/41/20/10/1319412010.db2.gz UQPXIPDOLMKXKZ-MRXNPFEDSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@@H](C(=O)N(CC[N@@H+](C)CC1CC(C)(C)C1)C(C)C)N(C)C ZINC001403933298 1365062478 /nfs/dbraw/zinc/06/24/78/1365062478.db2.gz FCZMDHYQQBSFMO-KRWDZBQOSA-N 1 3 325.541 2.932 10 0 EFAEHO CC/C=C\CC[NH+]1CC2(C1)CCN(C(=O)C1(N(C)C)CCC1)CC2 ZINC001319402377 1328872816 /nfs/dbraw/zinc/87/28/16/1328872816.db2.gz IIPIEDRSMWHIRD-WAYWQWQTSA-N 1 3 333.520 2.751 10 0 EFAEHO CC[C@H](C(=O)N1C[C@@H]([NH2+]CCCc2ccccc2)C(C)(C)C1)N(C)C ZINC001284293192 1320307086 /nfs/dbraw/zinc/30/70/86/1320307086.db2.gz NQECUEPKKMPBGB-RTBURBONSA-N 1 3 345.531 2.786 10 0 EFAEHO CC1(C)CN(C(=O)CCCC[NH+]2CCCC2)C[C@@H]1NC/C=C/Cl ZINC001284346840 1320328949 /nfs/dbraw/zinc/32/89/49/1320328949.db2.gz BXWXXJVAWPQPFQ-DYLHUKMJSA-N 1 3 341.927 2.832 10 0 EFAEHO CC1(C)CN(C(=O)CCCC[NH+]2CCCC2)C[C@H]1NC/C=C\Cl ZINC001284346842 1320329274 /nfs/dbraw/zinc/32/92/74/1320329274.db2.gz BXWXXJVAWPQPFQ-DZFYGRHCSA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)[C@@H](C(=O)N1C[C@H]([NH2+]CCCC2CCC2)C(C)(C)C1)N(C)C ZINC001284347376 1320329432 /nfs/dbraw/zinc/32/94/32/1320329432.db2.gz MUIIDBAWDGVHKF-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+]CCC(F)(F)F)C(C)(C)C)CCC1 ZINC001284597005 1320430608 /nfs/dbraw/zinc/43/06/08/1320430608.db2.gz DRDMNWKNICNBRK-LBPRGKRZSA-N 1 3 337.430 2.544 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C[NH2+]CCC(F)(F)F)C(C)(C)C)N(C)C ZINC001284643306 1320454752 /nfs/dbraw/zinc/45/47/52/1320454752.db2.gz LRKHUZAKHOAOOA-CHWSQXEVSA-N 1 3 339.446 2.646 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](Cc2cc(C)sc2C)CC1 ZINC001284977509 1320627097 /nfs/dbraw/zinc/62/70/97/1320627097.db2.gz XROVSKZDMUCNRN-UHFFFAOYSA-N 1 3 349.544 2.955 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](Cc2cc(C)sc2C)CC1 ZINC001284977509 1320627102 /nfs/dbraw/zinc/62/71/02/1320627102.db2.gz XROVSKZDMUCNRN-UHFFFAOYSA-N 1 3 349.544 2.955 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H](C)C[NH2+]C/C=C/c1ccccc1)N(C)C ZINC001319563705 1328918999 /nfs/dbraw/zinc/91/89/99/1328918999.db2.gz WTJXDXVRTWGUEC-GNCUJFGWSA-N 1 3 331.504 2.723 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CC[N@H+](C)C2CCCCC2)[C@@H]1CNCCF ZINC001319854198 1329015849 /nfs/dbraw/zinc/01/58/49/1329015849.db2.gz PVJVQYSMDZENOP-SJLPKXTDSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CC[N@@H+](C)C2CCCCC2)[C@@H]1CNCCF ZINC001319854198 1329015851 /nfs/dbraw/zinc/01/58/51/1329015851.db2.gz PVJVQYSMDZENOP-SJLPKXTDSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cccc(C(F)F)c1 ZINC001491579837 1323721257 /nfs/dbraw/zinc/72/12/57/1323721257.db2.gz PBBATWGCGFFSER-KBPBESRZSA-N 1 3 339.430 2.560 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)[C@@H](C)[NH+]2CCCCCC2)c1 ZINC001491599581 1323739600 /nfs/dbraw/zinc/73/96/00/1323739600.db2.gz ADPICZOGGFZSES-DLBZAZTESA-N 1 3 349.494 2.993 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)[C@@H]2CCCC[N@@H+]2C(C)C)c1 ZINC001491600734 1323739910 /nfs/dbraw/zinc/73/99/10/1323739910.db2.gz GZGSNWHHPNMJCF-APWZRJJASA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)[C@@H]2CCCC[N@H+]2C(C)C)c1 ZINC001491600734 1323739915 /nfs/dbraw/zinc/73/99/15/1323739915.db2.gz GZGSNWHHPNMJCF-APWZRJJASA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)NC[C@@H](C)NCc1ccccc1F ZINC001491603468 1323781750 /nfs/dbraw/zinc/78/17/50/1323781750.db2.gz UEGOMQDXBABOOY-CRAIPNDOSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)NC[C@@H](C)NCc1ccccc1F ZINC001491603468 1323781755 /nfs/dbraw/zinc/78/17/55/1323781755.db2.gz UEGOMQDXBABOOY-CRAIPNDOSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H](C)NCc1ccccc1F)[NH+]1CCCCC1 ZINC001491682335 1323787970 /nfs/dbraw/zinc/78/79/70/1323787970.db2.gz LDPIAOIERNUUIF-LPHOPBHVSA-N 1 3 349.494 2.931 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NC1c2ccccc2-c2ccccc21 ZINC001491674229 1323821955 /nfs/dbraw/zinc/82/19/55/1323821955.db2.gz SLHBTDJVLFSLNG-HZPDHXFCSA-N 1 3 349.478 2.802 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NC1c2ccccc2-c2ccccc21 ZINC001491674229 1323821961 /nfs/dbraw/zinc/82/19/61/1323821961.db2.gz SLHBTDJVLFSLNG-HZPDHXFCSA-N 1 3 349.478 2.802 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H]([NH2+]CCCc2cccc(F)c2)C1)N(C)C ZINC001491765410 1323873832 /nfs/dbraw/zinc/87/38/32/1323873832.db2.gz CIHVUOSFUGOEFR-RBUKOAKNSA-N 1 3 349.494 2.535 10 0 EFAEHO CC(C)CCC[NH2+][C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001491772382 1323880159 /nfs/dbraw/zinc/88/01/59/1323880159.db2.gz AZRPWCSEALXTEX-IBGZPJMESA-N 1 3 331.504 2.989 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[NH2+]C[C@@H]2CCCC(F)(F)C2)C1 ZINC001491849731 1323943989 /nfs/dbraw/zinc/94/39/89/1323943989.db2.gz LBPCAYARRWIGHA-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]Cc2ccc(Cl)cc2)C1 ZINC001491859772 1323949576 /nfs/dbraw/zinc/94/95/76/1323949576.db2.gz YPQUAJQWBNRCPI-MRXNPFEDSA-N 1 3 337.895 2.618 10 0 EFAEHO CC[C@@H]([NH2+]C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1)c1ccccc1 ZINC001491855991 1323950477 /nfs/dbraw/zinc/95/04/77/1323950477.db2.gz MYSJLJOXQLJKFG-PKOBYXMFSA-N 1 3 331.504 2.916 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C)nc2C)C1 ZINC001491894753 1324004240 /nfs/dbraw/zinc/00/42/40/1324004240.db2.gz RITSQFSCPNUUED-MOPGFXCFSA-N 1 3 346.519 2.557 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]([NH2+]Cc2cccc(F)c2)C1 ZINC001491895181 1324004799 /nfs/dbraw/zinc/00/47/99/1324004799.db2.gz FBRWMVQUUOTLMJ-ROUUACIJSA-N 1 3 335.467 2.683 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCc1ccc(CC[NH2+]CC2CC2)cc1 ZINC001491904004 1324016527 /nfs/dbraw/zinc/01/65/27/1324016527.db2.gz KNBMAILAGPSJEH-FQEVSTJZSA-N 1 3 343.515 2.719 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(C)CCNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001492286404 1324401341 /nfs/dbraw/zinc/40/13/41/1324401341.db2.gz MMBVVJXYQBVQOD-MAUKXSAKSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(C)CCNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001492286404 1324401346 /nfs/dbraw/zinc/40/13/46/1324401346.db2.gz MMBVVJXYQBVQOD-MAUKXSAKSA-N 1 3 335.467 2.809 10 0 EFAEHO CC/C=C/CC[N@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001492423233 1324500877 /nfs/dbraw/zinc/50/08/77/1324500877.db2.gz NMAVLZSHFZWJQW-LKGOPFMKSA-N 1 3 327.488 2.603 10 0 EFAEHO CC/C=C/CC[N@@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001492423233 1324500881 /nfs/dbraw/zinc/50/08/81/1324500881.db2.gz NMAVLZSHFZWJQW-LKGOPFMKSA-N 1 3 327.488 2.603 10 0 EFAEHO CN(CCNC(=O)c1ccc(CC[NH+](C)C)cc1)CC1=CCCCC1 ZINC001492424652 1324503044 /nfs/dbraw/zinc/50/30/44/1324503044.db2.gz RZJDQVMIAYWUML-UHFFFAOYSA-N 1 3 343.515 2.953 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]CCC(F)(F)F ZINC001320564798 1329166427 /nfs/dbraw/zinc/16/64/27/1329166427.db2.gz UMNQKTWOVTVHCZ-ZIAGYGMSSA-N 1 3 337.430 2.686 10 0 EFAEHO CC(C)[C@H](C(=O)NCCCN(C)Cc1ccc(Cl)s1)[NH+](C)C ZINC001316846511 1324686244 /nfs/dbraw/zinc/68/62/44/1324686244.db2.gz ISDHBZSWLZEXQM-OAHLLOKOSA-N 1 3 345.940 2.926 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc2c(c1)CCC2)N(C)C ZINC001320614602 1329178520 /nfs/dbraw/zinc/17/85/20/1329178520.db2.gz NCDKMYRGXNDDSC-UZLBHIALSA-N 1 3 345.531 2.746 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001316862331 1324911662 /nfs/dbraw/zinc/91/16/62/1324911662.db2.gz NBUIGJBLHOAUEE-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001316862331 1324911667 /nfs/dbraw/zinc/91/16/67/1324911667.db2.gz NBUIGJBLHOAUEE-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)[C@H](C[NH2+]CCF)C1 ZINC001316708394 1324976609 /nfs/dbraw/zinc/97/66/09/1324976609.db2.gz LSDCAPXWZWTWCF-QAPCUYQASA-N 1 3 335.467 2.548 10 0 EFAEHO CC[C@@H](C)C[NH2+]CCC[C@@H]1[C@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001316715978 1325034527 /nfs/dbraw/zinc/03/45/27/1325034527.db2.gz ZOSBJOQJPNRQFG-JFIYKMOQSA-N 1 3 334.508 2.995 10 0 EFAEHO CC[C@H](C(=O)N1CCCCC[C@H]([NH2+]CCCOC(C)C)C1)N(C)C ZINC001316774603 1325046656 /nfs/dbraw/zinc/04/66/56/1325046656.db2.gz VIONIMWIXSJXMO-ZWKOTPCHSA-N 1 3 341.540 2.503 10 0 EFAEHO CN(CCCNC(=O)C(C)(C)[N@H+](C)C1CCCC1)Cc1ccccn1 ZINC001316837324 1325198886 /nfs/dbraw/zinc/19/88/86/1325198886.db2.gz ZOBXYOQTTRAMJT-UHFFFAOYSA-N 1 3 346.519 2.673 10 0 EFAEHO CN(CCCNC(=O)C(C)(C)[N@@H+](C)C1CCCC1)Cc1ccccn1 ZINC001316837324 1325198891 /nfs/dbraw/zinc/19/88/91/1325198891.db2.gz ZOBXYOQTTRAMJT-UHFFFAOYSA-N 1 3 346.519 2.673 10 0 EFAEHO CC(C)(C(=O)NCCCN(CCC(F)(F)F)C1CC1)[NH+]1CCCC1 ZINC001316922900 1325357372 /nfs/dbraw/zinc/35/73/72/1325357372.db2.gz QHVBTJJOJNVLSS-UHFFFAOYSA-N 1 3 349.441 2.784 10 0 EFAEHO Cc1cc(C[N@@H+](CCCNC(=O)CN2CC[C@H](C)C2)C2CC2)cs1 ZINC001316924509 1325362781 /nfs/dbraw/zinc/36/27/81/1325362781.db2.gz UPIWJVGYJNWTTP-HNNXBMFYSA-N 1 3 349.544 2.869 10 0 EFAEHO Cc1cc(C[N@H+](CCCNC(=O)CN2CC[C@H](C)C2)C2CC2)cs1 ZINC001316924509 1325362789 /nfs/dbraw/zinc/36/27/89/1325362789.db2.gz UPIWJVGYJNWTTP-HNNXBMFYSA-N 1 3 349.544 2.869 10 0 EFAEHO CCC/C=C/CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001317051289 1325523119 /nfs/dbraw/zinc/52/31/19/1325523119.db2.gz AVYZGOJRYAXIAX-AXTJNSDUSA-N 1 3 333.520 2.750 10 0 EFAEHO CCC/C=C/CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001317051289 1325523127 /nfs/dbraw/zinc/52/31/27/1325523127.db2.gz AVYZGOJRYAXIAX-AXTJNSDUSA-N 1 3 333.520 2.750 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)CCCC[NH+](C)C)C2)c1 ZINC001317124290 1325591464 /nfs/dbraw/zinc/59/14/64/1325591464.db2.gz HGYAUSYZFICQFE-CALCHBBNSA-N 1 3 335.467 2.603 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001320891395 1329315850 /nfs/dbraw/zinc/31/58/50/1329315850.db2.gz HUVPGXVDITTWEI-HKUYNNGSSA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C/CNC(=O)[C@H]1CCC[N@H+]1C(C)C ZINC001321056262 1329337617 /nfs/dbraw/zinc/33/76/17/1329337617.db2.gz CZFKMMQRWSWBNX-VZSQWMKGSA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C/CNC(=O)[C@H]1CCC[N@@H+]1C(C)C ZINC001321056262 1329337620 /nfs/dbraw/zinc/33/76/20/1329337620.db2.gz CZFKMMQRWSWBNX-VZSQWMKGSA-N 1 3 347.478 2.769 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC/C=C\CNCc2ccc(Cl)s2)CC[N@@H+]1C ZINC001321064119 1329338526 /nfs/dbraw/zinc/33/85/26/1329338526.db2.gz KQPZOZBJIKKREI-VPOWOMEUSA-N 1 3 341.908 2.504 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC/C=C\CNCc2ccc(Cl)s2)CC[N@H+]1C ZINC001321064119 1329338529 /nfs/dbraw/zinc/33/85/29/1329338529.db2.gz KQPZOZBJIKKREI-VPOWOMEUSA-N 1 3 341.908 2.504 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]C/C=C/CNC(=O)C1(N(C)C)CCC1 ZINC001321092498 1329341688 /nfs/dbraw/zinc/34/16/88/1329341688.db2.gz ROULJJSKULOZDR-IWAYRVGRSA-N 1 3 329.488 2.802 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C/C=C\CNC(=O)C1(N(C)C)CCC1 ZINC001321092500 1329341895 /nfs/dbraw/zinc/34/18/95/1329341895.db2.gz ROULJJSKULOZDR-QWPQOLDESA-N 1 3 329.488 2.802 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C/C=C/CNC(=O)CN(C)C1CCC1 ZINC001321095464 1329342371 /nfs/dbraw/zinc/34/23/71/1329342371.db2.gz IUEZMWCOMUBCAO-LXXRFIIISA-N 1 3 329.488 2.802 10 0 EFAEHO O=C(NC/C=C\CNC/C=C/Cl)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001321208991 1329357181 /nfs/dbraw/zinc/35/71/81/1329357181.db2.gz MYYIAYGAXRFWQN-VCPMZGEJSA-N 1 3 339.911 2.798 10 0 EFAEHO O=C(NC/C=C\CNC/C=C/Cl)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001321208991 1329357185 /nfs/dbraw/zinc/35/71/85/1329357185.db2.gz MYYIAYGAXRFWQN-VCPMZGEJSA-N 1 3 339.911 2.798 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C/C=C\CNC(=O)CN2CCC(C)CC2)c1 ZINC001321304021 1329370399 /nfs/dbraw/zinc/37/03/99/1329370399.db2.gz LBFPOFWUYXBQEU-PLNGDYQASA-N 1 3 343.515 2.797 10 0 EFAEHO CC[C@H](C(=O)NC/C=C/C[NH2+]Cc1cccc2ccccc21)N(C)C ZINC001321339392 1329375038 /nfs/dbraw/zinc/37/50/38/1329375038.db2.gz UXVNCZONLTUIMP-AQKVLALTSA-N 1 3 339.483 2.942 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[C@H]1CCC[N@@H+]1Cc1ccccc1F ZINC001317427160 1327997467 /nfs/dbraw/zinc/99/74/67/1327997467.db2.gz MMDRGOBGSSTJTQ-PKOBYXMFSA-N 1 3 347.478 2.781 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[C@H]1CCC[N@H+]1Cc1ccccc1F ZINC001317427160 1327997481 /nfs/dbraw/zinc/99/74/81/1327997481.db2.gz MMDRGOBGSSTJTQ-PKOBYXMFSA-N 1 3 347.478 2.781 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N(C)CCNCc1ccc(Cl)s1 ZINC001317593247 1328171150 /nfs/dbraw/zinc/17/11/50/1328171150.db2.gz QQYZHOZZGYJVBT-AWEZNQCLSA-N 1 3 343.924 2.824 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N(C)CCNCc1ccc(Cl)s1 ZINC001317593247 1328171146 /nfs/dbraw/zinc/17/11/46/1328171146.db2.gz QQYZHOZZGYJVBT-AWEZNQCLSA-N 1 3 343.924 2.824 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)CCNCc1ccc(Cl)s1 ZINC001317593248 1328171910 /nfs/dbraw/zinc/17/19/10/1328171910.db2.gz QQYZHOZZGYJVBT-CQSZACIVSA-N 1 3 343.924 2.824 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N(C)CCNCc1ccc(Cl)s1 ZINC001317593248 1328171916 /nfs/dbraw/zinc/17/19/16/1328171916.db2.gz QQYZHOZZGYJVBT-CQSZACIVSA-N 1 3 343.924 2.824 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+]C/C=C\c2ccc(Cl)cc2)CCC1 ZINC001317596293 1328176134 /nfs/dbraw/zinc/17/61/34/1328176134.db2.gz QUXWVYRBWAPOQC-XQRVVYSFSA-N 1 3 349.906 2.886 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[NH2+]Cc1ccc(C(F)F)cc1)N(C)C ZINC001317655645 1328243280 /nfs/dbraw/zinc/24/32/80/1328243280.db2.gz UNCUWUFENYWILT-OAHLLOKOSA-N 1 3 327.419 2.512 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[NH2+]Cc1ccc(C(F)F)cc1)N(C)C ZINC001317655644 1328243963 /nfs/dbraw/zinc/24/39/63/1328243963.db2.gz UNCUWUFENYWILT-HNNXBMFYSA-N 1 3 327.419 2.512 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)C[NH+]2[C@H](C)CC[C@H]2C)c1 ZINC001317669059 1328261910 /nfs/dbraw/zinc/26/19/10/1328261910.db2.gz GOBIWENZXIAHRH-HZPDHXFCSA-N 1 3 335.467 2.555 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N(C)CC[NH2+]CCC2CCCC2)c1 ZINC001317669806 1328263944 /nfs/dbraw/zinc/26/39/44/1328263944.db2.gz LUURBIQDFMEDQP-UHFFFAOYSA-N 1 3 331.504 2.990 10 0 EFAEHO CC(C)N(CCF)CCCNC(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001317686008 1328289357 /nfs/dbraw/zinc/28/93/57/1328289357.db2.gz HKVZLGBBATWCHN-QGZVFWFLSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(CCF)CCCNC(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001317686008 1328289362 /nfs/dbraw/zinc/28/93/62/1328289362.db2.gz HKVZLGBBATWCHN-QGZVFWFLSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](Cc1ccccc1)C(C)C ZINC001317708995 1328317004 /nfs/dbraw/zinc/31/70/04/1328317004.db2.gz GLWRWRNBMHDYJW-UHFFFAOYSA-N 1 3 328.460 2.678 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](Cc1ccccc1)C(C)C ZINC001317708995 1328317010 /nfs/dbraw/zinc/31/70/10/1328317010.db2.gz GLWRWRNBMHDYJW-UHFFFAOYSA-N 1 3 328.460 2.678 10 0 EFAEHO CC(C)=CCN[C@@H](CNC(=O)C1CC[NH+](C)CC1)c1ccccc1 ZINC001317722245 1328332422 /nfs/dbraw/zinc/33/24/22/1328332422.db2.gz PCLFISWLDHDXME-IBGZPJMESA-N 1 3 329.488 2.742 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](C[N@H+](C)CCC2=CCCCC2)C1 ZINC001317830805 1328401842 /nfs/dbraw/zinc/40/18/42/1328401842.db2.gz KGJNWAARWLRUFT-MOPGFXCFSA-N 1 3 333.520 2.751 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](C[N@@H+](C)CCC2=CCCCC2)C1 ZINC001317830805 1328401846 /nfs/dbraw/zinc/40/18/46/1328401846.db2.gz KGJNWAARWLRUFT-MOPGFXCFSA-N 1 3 333.520 2.751 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](C[N@H+](C)CCC3=CCCCC3)C2)C1 ZINC001317852866 1328417436 /nfs/dbraw/zinc/41/74/36/1328417436.db2.gz IVULDWPMJZQDDJ-QUCCMNQESA-N 1 3 347.547 2.999 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](C[N@@H+](C)CCC3=CCCCC3)C2)C1 ZINC001317852866 1328417444 /nfs/dbraw/zinc/41/74/44/1328417444.db2.gz IVULDWPMJZQDDJ-QUCCMNQESA-N 1 3 347.547 2.999 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[N@H+](C)CCC2=CCCCC2)C1)N(C)C ZINC001317857267 1328421235 /nfs/dbraw/zinc/42/12/35/1328421235.db2.gz PLTOAROUSXYEGB-RTBURBONSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[N@@H+](C)CCC2=CCCCC2)C1)N(C)C ZINC001317857267 1328421240 /nfs/dbraw/zinc/42/12/40/1328421240.db2.gz PLTOAROUSXYEGB-RTBURBONSA-N 1 3 335.536 2.997 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(Cl)cc1)C(=O)[C@@H]1CCCCN1C ZINC001322652293 1329476160 /nfs/dbraw/zinc/47/61/60/1329476160.db2.gz VEROAGGUGCBIFH-KRWDZBQOSA-N 1 3 337.895 2.762 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]Cc1cc(C)sc1C)N(C)C ZINC001322793926 1329488669 /nfs/dbraw/zinc/48/86/69/1329488669.db2.gz YBAJTCGVABOZJC-MRXNPFEDSA-N 1 3 325.522 2.643 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)CN1CCCC1)c1ccc(F)c(F)c1 ZINC001322834927 1329492591 /nfs/dbraw/zinc/49/25/91/1329492591.db2.gz IMRKEKDDDNQOSM-CQSZACIVSA-N 1 3 339.430 2.560 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]([C@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001380991913 1348010370 /nfs/dbraw/zinc/01/03/70/1348010370.db2.gz ZBBHWLGRFAGCNJ-OALUTQOASA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]([C@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001380991913 1348010371 /nfs/dbraw/zinc/01/03/71/1348010371.db2.gz ZBBHWLGRFAGCNJ-OALUTQOASA-N 1 3 337.552 2.933 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C(C)C)N(C)C ZINC001323704660 1329563110 /nfs/dbraw/zinc/56/31/10/1329563110.db2.gz HOOWDHVCRQONGS-XCLUONLBSA-N 1 3 335.536 2.994 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C(C)C)N(C)C ZINC001323704660 1329563112 /nfs/dbraw/zinc/56/31/12/1329563112.db2.gz HOOWDHVCRQONGS-XCLUONLBSA-N 1 3 335.536 2.994 10 0 EFAEHO Cc1ccc(CCC[NH2+]C[C@@H]2CCCN2C(=O)CN(C)C(C)C)cc1 ZINC001324285392 1329613692 /nfs/dbraw/zinc/61/36/92/1329613692.db2.gz HHHJNLOXJAQTAL-FQEVSTJZSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C[NH2+]C/C=C\Cl)C1CCCC1)N(C)C ZINC001324499215 1329633573 /nfs/dbraw/zinc/63/35/73/1329633573.db2.gz ZQIJGAVSYMXDEI-QUAUAXPMSA-N 1 3 329.916 2.590 10 0 EFAEHO C[C@@H](NCc1ccccn1)[C@H](C)NC(=O)C1(C[NH+](C)C)CCCCC1 ZINC001381416524 1348258099 /nfs/dbraw/zinc/25/80/99/1348258099.db2.gz SLFHRDGLSHNACL-SJORKVTESA-N 1 3 346.519 2.577 10 0 EFAEHO C[C@H]([NH2+]CCCc1ccccc1)[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001325465268 1329690255 /nfs/dbraw/zinc/69/02/55/1329690255.db2.gz FGZVOQYUIIFIHD-ICSRJNTNSA-N 1 3 343.515 2.542 10 0 EFAEHO CC(C)CCC[NH2+]C[C@H]1CN(C(=O)CN2CCC(C)CC2)C[C@@H]1C ZINC001325573257 1329697976 /nfs/dbraw/zinc/69/79/76/1329697976.db2.gz BBLIJYNFYLAZAV-OALUTQOASA-N 1 3 337.552 2.839 10 0 EFAEHO CC(C)CCC[NH2+]C[C@@H]1CN(C(=O)CN2CCC(C)CC2)C[C@@H]1C ZINC001325573263 1329697996 /nfs/dbraw/zinc/69/79/96/1329697996.db2.gz BBLIJYNFYLAZAV-RBUKOAKNSA-N 1 3 337.552 2.839 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N(CCNCCF)Cc2ccccc2)CC1 ZINC001325707924 1329707976 /nfs/dbraw/zinc/70/79/76/1329707976.db2.gz HAITVOOBAWNFLT-UHFFFAOYSA-N 1 3 349.494 2.695 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@@H]2[C@@H]1CC[N@@H+]2CCCCCF)N(C)C ZINC001325897325 1329721043 /nfs/dbraw/zinc/72/10/43/1329721043.db2.gz GARLRKBJJBZBLT-SQNIBIBYSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@@H]2[C@@H]1CC[N@H+]2CCCCCF)N(C)C ZINC001325897325 1329721045 /nfs/dbraw/zinc/72/10/45/1329721045.db2.gz GARLRKBJJBZBLT-SQNIBIBYSA-N 1 3 341.515 2.778 10 0 EFAEHO CC[C@H](F)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCCC[NH+](C)C ZINC001325923165 1329725559 /nfs/dbraw/zinc/72/55/59/1329725559.db2.gz VKBJIUSUTCFGKZ-YESZJQIVSA-N 1 3 327.488 2.532 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)c1 ZINC001326225824 1329740273 /nfs/dbraw/zinc/74/02/73/1329740273.db2.gz WXVVUGGDGYARLC-QUCCMNQESA-N 1 3 343.515 2.671 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]CCC2=CCCCC2)C1 ZINC001326224920 1329740398 /nfs/dbraw/zinc/74/03/98/1329740398.db2.gz RBHZMJGIUFRMCP-RBUKOAKNSA-N 1 3 333.520 2.799 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](CC[NH2+]CC3=CCCCC3)C2)C1 ZINC001326365339 1329750502 /nfs/dbraw/zinc/75/05/02/1329750502.db2.gz OZGVXHZIHUCJEQ-IEBWSBKVSA-N 1 3 333.520 2.657 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](CC[NH2+]CC3=CCCCC3)C2)C1 ZINC001326365340 1329750545 /nfs/dbraw/zinc/75/05/45/1329750545.db2.gz OZGVXHZIHUCJEQ-MJGOQNOKSA-N 1 3 333.520 2.657 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN3CC[C@@H](C)C3)C2)cc1 ZINC001326366170 1329750585 /nfs/dbraw/zinc/75/05/85/1329750585.db2.gz ZGHIGUWUOPRPKN-UYAOXDASSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC[C@@H]1CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001326369785 1329750731 /nfs/dbraw/zinc/75/07/31/1329750731.db2.gz MSWISKPVQWJTMS-QGZVFWFLSA-N 1 3 340.471 2.597 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN3CCCC3)C2)cc1C ZINC001326430713 1329755959 /nfs/dbraw/zinc/75/59/59/1329755959.db2.gz LBXWLKUEPGNIBS-LJQANCHMSA-N 1 3 343.515 2.727 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)cc1C ZINC001381971424 1348631181 /nfs/dbraw/zinc/63/11/81/1348631181.db2.gz OENHQSXMXNSLQP-UFYCRDLUSA-N 1 3 345.531 2.874 10 0 EFAEHO CCCCCC[NH+]1CCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)CC1 ZINC001326599302 1330326018 /nfs/dbraw/zinc/32/60/18/1330326018.db2.gz RJFQZKOEYSCDOK-GOSISDBHSA-N 1 3 335.536 2.833 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCCC[C@@H]2C[NH2+]CCCC2CCC2)C1 ZINC001326736732 1330356761 /nfs/dbraw/zinc/35/67/61/1330356761.db2.gz XIURFQGWECLAIX-IEBWSBKVSA-N 1 3 335.536 2.879 10 0 EFAEHO CCC1([NH2+]CCCCCF)CCN(C(=O)CN2CCCC2)CC1 ZINC001327494113 1330488222 /nfs/dbraw/zinc/48/82/22/1330488222.db2.gz XAILRDSQTYLHLR-UHFFFAOYSA-N 1 3 327.488 2.583 10 0 EFAEHO CCCCC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN1CC[C@@H](C)C1 ZINC001328693335 1330616482 /nfs/dbraw/zinc/61/64/82/1330616482.db2.gz HLCMXCCVIWVQST-OZOXKJRCSA-N 1 3 343.515 2.890 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCCC2(CN(C(=O)[C@H](C(C)C)N(C)C)C2)C1 ZINC001330512227 1330763688 /nfs/dbraw/zinc/76/36/88/1330763688.db2.gz NWEPVWHNGZFEEV-DVBCCOPCSA-N 1 3 335.536 2.853 10 0 EFAEHO CC/C=C/CC[N@H+]1CCCC2(CN(C(=O)[C@H](C(C)C)N(C)C)C2)C1 ZINC001330512227 1330763692 /nfs/dbraw/zinc/76/36/92/1330763692.db2.gz NWEPVWHNGZFEEV-DVBCCOPCSA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)C[NH2+]CCC[C@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001330915938 1330770445 /nfs/dbraw/zinc/77/04/45/1330770445.db2.gz LCOFLDVTDHGBJL-YJBOKZPZSA-N 1 3 329.504 2.729 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)CCC[NH2+]Cc1cccnc1C ZINC001330986887 1330779475 /nfs/dbraw/zinc/77/94/75/1330779475.db2.gz HKXLZAIDHGNFFT-VQIMIIECSA-N 1 3 346.519 2.639 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H](C)CN(C)C(=O)CN1CC[C@H](C)C1 ZINC001331559045 1330852740 /nfs/dbraw/zinc/85/27/40/1330852740.db2.gz CZRJIUNVNDKIKK-PKOBYXMFSA-N 1 3 345.531 2.706 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCc2ccsc2)C[C@@H]1C ZINC001332048597 1330909271 /nfs/dbraw/zinc/90/92/71/1330909271.db2.gz LGXVBSXZKJXWQI-RDJZCZTQSA-N 1 3 337.533 2.602 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCc2ccccc2)C(C)(C)C1 ZINC001332437266 1330971760 /nfs/dbraw/zinc/97/17/60/1330971760.db2.gz LWVACZZZPUMWLP-LJQANCHMSA-N 1 3 345.531 2.788 10 0 EFAEHO CC[C@H](F)CN[C@@H]1CN(C(=O)CCCC[NH+]2CCCC2)CC1(C)C ZINC001332451714 1330973351 /nfs/dbraw/zinc/97/33/51/1330973351.db2.gz DZCDSAMPJDTRMZ-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO C[NH+](C)CCCCC(=O)NCC1=CCN(Cc2ccccc2)CC1 ZINC001333432506 1331141264 /nfs/dbraw/zinc/14/12/64/1331141264.db2.gz AMDXJNCAHPZVSX-UHFFFAOYSA-N 1 3 329.488 2.667 10 0 EFAEHO Cc1ccc(C[N@H+]2CC=C(CNC(=O)CN(C)C(C)C)CC2)c(C)c1 ZINC001333456929 1331147853 /nfs/dbraw/zinc/14/78/53/1331147853.db2.gz GJYJEYOKMOONQK-UHFFFAOYSA-N 1 3 343.515 2.892 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC=C(CNC(=O)CN(C)C(C)C)CC2)c(C)c1 ZINC001333456929 1331147857 /nfs/dbraw/zinc/14/78/57/1331147857.db2.gz GJYJEYOKMOONQK-UHFFFAOYSA-N 1 3 343.515 2.892 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1C ZINC001480515423 1334102648 /nfs/dbraw/zinc/10/26/48/1334102648.db2.gz GBLSEXBNMLDLSE-QGZVFWFLSA-N 1 3 331.504 2.772 10 0 EFAEHO C[C@H]1CC[N@H+](CC(=O)N2CCC(C)(NC/C(Cl)=C\Cl)CC2)C1 ZINC001408116331 1369621399 /nfs/dbraw/zinc/62/13/99/1369621399.db2.gz KZTPDTJJWJBFTJ-FYQHACEVSA-N 1 3 348.318 2.618 10 0 EFAEHO C[C@H]1CC[N@@H+](CC(=O)N2CCC(C)(NC/C(Cl)=C\Cl)CC2)C1 ZINC001408116331 1369621403 /nfs/dbraw/zinc/62/14/03/1369621403.db2.gz KZTPDTJJWJBFTJ-FYQHACEVSA-N 1 3 348.318 2.618 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H](C)[NH2+]CC1CCC(C)CC1)N(C)C ZINC001408235025 1369736898 /nfs/dbraw/zinc/73/68/98/1369736898.db2.gz UZJLBACUUPSPGN-JYSRZZCRSA-N 1 3 325.541 2.883 10 0 EFAEHO C[C@H](c1ccccc1)[C@H](O)CN1C[C@]23C[N@H+](C)C[C@@]2(C1)CCCC3 ZINC001414055680 1335549180 /nfs/dbraw/zinc/54/91/80/1335549180.db2.gz BPVKQZIEHXVELW-WLRLJWMZSA-N 1 3 328.500 2.959 10 0 EFAEHO C[C@H](c1ccccc1)[C@H](O)CN1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001414055680 1335549182 /nfs/dbraw/zinc/54/91/82/1335549182.db2.gz BPVKQZIEHXVELW-WLRLJWMZSA-N 1 3 328.500 2.959 10 0 EFAEHO CCCN(CC[NH+](CC)CC)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001361593969 1336208485 /nfs/dbraw/zinc/20/84/85/1336208485.db2.gz HZWQMMJBFSROSG-GOSISDBHSA-N 1 3 329.504 2.779 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N(CCN(C)C)Cc3ccccc3)C[N@@H+]2C1 ZINC001361879118 1336393324 /nfs/dbraw/zinc/39/33/24/1336393324.db2.gz DMGWPKKNCRFCKO-HOJAQTOUSA-N 1 3 343.515 2.697 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N(CCN(C)C)Cc3ccccc3)C[N@H+]2C1 ZINC001361879118 1336393326 /nfs/dbraw/zinc/39/33/26/1336393326.db2.gz DMGWPKKNCRFCKO-HOJAQTOUSA-N 1 3 343.515 2.697 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2CC[C@@H]3C[C@@H](C)C[N@H+]3C2)N(C)C)cc1 ZINC001361975550 1336447650 /nfs/dbraw/zinc/44/76/50/1336447650.db2.gz BJEQJTSELBUTBR-AFYVEPGGSA-N 1 3 343.515 2.834 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2CC[C@@H]3C[C@@H](C)C[N@@H+]3C2)N(C)C)cc1 ZINC001361975550 1336447652 /nfs/dbraw/zinc/44/76/52/1336447652.db2.gz BJEQJTSELBUTBR-AFYVEPGGSA-N 1 3 343.515 2.834 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@H]2CCC[C@@H]([NH+](C)C)C2)N(C)C)cc1 ZINC001361978110 1336448851 /nfs/dbraw/zinc/44/88/51/1336448851.db2.gz MSXGEQVJSCXNBB-OTWHNJEPSA-N 1 3 331.504 2.834 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@H]2CCC[C@H]([NH+](C)C)C2)N(C)C)cc1 ZINC001361978107 1336449063 /nfs/dbraw/zinc/44/90/63/1336449063.db2.gz MSXGEQVJSCXNBB-FHWLQOOXSA-N 1 3 331.504 2.834 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001361979874 1336449862 /nfs/dbraw/zinc/44/98/62/1336449862.db2.gz VWIQPZRLNNMPEC-HKUYNNGSSA-N 1 3 349.494 2.836 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)[C@H](C)CC[NH+](C)C)N2CCCC2)cc1 ZINC001362089816 1336498306 /nfs/dbraw/zinc/49/83/06/1336498306.db2.gz OXNAHOJGONNFQM-IEBWSBKVSA-N 1 3 331.504 2.836 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001362100893 1336502947 /nfs/dbraw/zinc/50/29/47/1336502947.db2.gz VETOLZKPHMKORQ-RBUKOAKNSA-N 1 3 331.504 2.697 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001362100368 1336503208 /nfs/dbraw/zinc/50/32/08/1336503208.db2.gz VETOLZKPHMKORQ-MOPGFXCFSA-N 1 3 331.504 2.697 10 0 EFAEHO C[C@H](NC(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1)[C@@H](c1ccccc1)N(C)C ZINC001362412829 1336599431 /nfs/dbraw/zinc/59/94/31/1336599431.db2.gz XHEZHXVEVXKNAK-AITUJVMLSA-N 1 3 331.504 2.914 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)N(C)CCCN(C)Cc2ccco2)CC1 ZINC001362431097 1336608152 /nfs/dbraw/zinc/60/81/52/1336608152.db2.gz WVVODGQRRQGFHJ-UHFFFAOYSA-N 1 3 349.519 2.928 10 0 EFAEHO CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H](C)CC[NH+](C)C ZINC001362541341 1336650029 /nfs/dbraw/zinc/65/00/29/1336650029.db2.gz LNDXZBQRAHZWSN-MJGOQNOKSA-N 1 3 333.520 2.847 10 0 EFAEHO C[C@@H](CC[NH+](C)C)C(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC001362739844 1336723038 /nfs/dbraw/zinc/72/30/38/1336723038.db2.gz KFARKXAJXIDCLE-XJKSGUPXSA-N 1 3 325.884 2.647 10 0 EFAEHO C[C@@H](CC[NH+](C)C)C(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC001362739393 1336723316 /nfs/dbraw/zinc/72/33/16/1336723316.db2.gz KFARKXAJXIDCLE-BBRMVZONSA-N 1 3 325.884 2.647 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001363189164 1336823440 /nfs/dbraw/zinc/82/34/40/1336823440.db2.gz BPIXHWLESUQLIU-IBGZPJMESA-N 1 3 341.515 2.923 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001363189164 1336823441 /nfs/dbraw/zinc/82/34/41/1336823441.db2.gz BPIXHWLESUQLIU-IBGZPJMESA-N 1 3 341.515 2.923 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@]1(C)CCN(Cc2ccccc2)C1 ZINC001364609727 1337195538 /nfs/dbraw/zinc/19/55/38/1337195538.db2.gz UJVZJZLDVXBSOS-YLJYHZDGSA-N 1 3 346.519 2.681 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](C[NH2+]CCC2CCCCC2)C1)N(C)C ZINC001480676716 1337278800 /nfs/dbraw/zinc/27/88/00/1337278800.db2.gz NXNIGMLVFLVCDH-RTBURBONSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC12CC[NH+](CC1CC(C)(C)C1)CC2)N(C)C ZINC001366013731 1337323253 /nfs/dbraw/zinc/32/32/53/1337323253.db2.gz GIOIYQZRUABQIK-IRXDYDNUSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1sccc1Cl)C1CC1)N(C)C ZINC001366066103 1337359476 /nfs/dbraw/zinc/35/94/76/1337359476.db2.gz QFLCBRPLEGSOAM-UONOGXRCSA-N 1 3 343.924 2.726 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccccc1)C1CC1)N1CCCCCC1 ZINC001366071265 1337363434 /nfs/dbraw/zinc/36/34/34/1337363434.db2.gz YPMFRBJGSVHVLX-YLJYHZDGSA-N 1 3 343.515 2.936 10 0 EFAEHO CCC(CC)C[N@@H+](C)C[C@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001366076613 1337368619 /nfs/dbraw/zinc/36/86/19/1337368619.db2.gz UJNKHEGXNNXQNB-PKOBYXMFSA-N 1 3 337.552 2.935 10 0 EFAEHO CCC(CC)C[N@H+](C)C[C@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001366076613 1337368613 /nfs/dbraw/zinc/36/86/13/1337368613.db2.gz UJNKHEGXNNXQNB-PKOBYXMFSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CC[N@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366078328 1337370427 /nfs/dbraw/zinc/37/04/27/1337370427.db2.gz ZVCUBRIQBPJDAM-IBGZPJMESA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CC[N@@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366078328 1337370431 /nfs/dbraw/zinc/37/04/31/1337370431.db2.gz ZVCUBRIQBPJDAM-IBGZPJMESA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccsc1)N(C)C ZINC001366134127 1337394773 /nfs/dbraw/zinc/39/47/73/1337394773.db2.gz LGXCZWPHJMUDTO-HQSKLWIPSA-N 1 3 349.544 2.946 10 0 EFAEHO CC(C)[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccsc1)N(C)C ZINC001366134127 1337394777 /nfs/dbraw/zinc/39/47/77/1337394777.db2.gz LGXCZWPHJMUDTO-HQSKLWIPSA-N 1 3 349.544 2.946 10 0 EFAEHO C[C@H]1CCC[C@@H](CC[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)C1 ZINC001366151723 1337404021 /nfs/dbraw/zinc/40/40/21/1337404021.db2.gz WFLJVZVELMUTHR-XLAORIBOSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCc3c2cccc3Cl)C1)N(C)C ZINC001366158155 1337406795 /nfs/dbraw/zinc/40/67/95/1337406795.db2.gz GFYGGQQZHBDUPU-GGNLRSJOSA-N 1 3 349.906 2.904 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2Cl)C1)N(C)C ZINC001366165150 1337409745 /nfs/dbraw/zinc/40/97/45/1337409745.db2.gz ZSDBQCTXWASISW-VWPFQQQWSA-N 1 3 337.895 2.978 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2Cl)C1)N(C)C ZINC001366165104 1337409813 /nfs/dbraw/zinc/40/98/13/1337409813.db2.gz ZSDBQCTXWASISW-SZOQZIPDSA-N 1 3 337.895 2.978 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(F)c(Cl)c2)C1 ZINC001366170477 1337412877 /nfs/dbraw/zinc/41/28/77/1337412877.db2.gz XTHZOYMLLQIDTL-OKILXGFUSA-N 1 3 341.858 2.558 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCCN(CCC(F)(F)F)C1 ZINC001366174023 1337415471 /nfs/dbraw/zinc/41/54/71/1337415471.db2.gz CEPBNESYVGEVKL-HUUCEWRRSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCCN(CCC(F)(F)F)C1 ZINC001366174023 1337415474 /nfs/dbraw/zinc/41/54/74/1337415474.db2.gz CEPBNESYVGEVKL-HUUCEWRRSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCCN(CCC(F)(F)F)C1 ZINC001366174025 1337415625 /nfs/dbraw/zinc/41/56/25/1337415625.db2.gz CEPBNESYVGEVKL-LSDHHAIUSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCCN(CCC(F)(F)F)C1 ZINC001366174025 1337415628 /nfs/dbraw/zinc/41/56/28/1337415628.db2.gz CEPBNESYVGEVKL-LSDHHAIUSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCCN(CCC(F)(F)F)C1 ZINC001366174021 1337415833 /nfs/dbraw/zinc/41/58/33/1337415833.db2.gz CEPBNESYVGEVKL-GJZGRUSLSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCCN(CCC(F)(F)F)C1 ZINC001366174021 1337415835 /nfs/dbraw/zinc/41/58/35/1337415835.db2.gz CEPBNESYVGEVKL-GJZGRUSLSA-N 1 3 349.441 2.641 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CCC[N@H+](Cc3ccsc3)C2)CCC1 ZINC001366183375 1337424391 /nfs/dbraw/zinc/42/43/91/1337424391.db2.gz YRTJTDFEORQVPD-OAHLLOKOSA-N 1 3 335.517 2.561 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CCC[N@@H+](Cc3ccsc3)C2)CCC1 ZINC001366183375 1337424396 /nfs/dbraw/zinc/42/43/96/1337424396.db2.gz YRTJTDFEORQVPD-OAHLLOKOSA-N 1 3 335.517 2.561 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001366203112 1337440011 /nfs/dbraw/zinc/44/00/11/1337440011.db2.gz IZSZYFMVKBVYLJ-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001366230841 1337464593 /nfs/dbraw/zinc/46/45/93/1337464593.db2.gz MMUGQDPWHKCHMD-YOEHRIQHSA-N 1 3 346.519 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001366230841 1337464594 /nfs/dbraw/zinc/46/45/94/1337464594.db2.gz MMUGQDPWHKCHMD-YOEHRIQHSA-N 1 3 346.519 2.914 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001366283572 1337489725 /nfs/dbraw/zinc/48/97/25/1337489725.db2.gz JBPQCQPKPHRCCQ-JXFKEZNVSA-N 1 3 343.515 2.644 10 0 EFAEHO C[C@H](CNC(=O)C12CC[NH+](CC1)C2)N[C@H](C)c1ccccc1Cl ZINC001366342989 1337523364 /nfs/dbraw/zinc/52/33/64/1337523364.db2.gz HSSJLKSVALDHJB-ZIAGYGMSSA-N 1 3 335.879 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC001366369822 1337542283 /nfs/dbraw/zinc/54/22/83/1337542283.db2.gz UVPHKKWAUIFKMD-LBPRGKRZSA-N 1 3 346.302 2.928 10 0 EFAEHO CC[C@H]([NH2+]C[C@@H]1CCN(C(=O)CN2CCCC2)C1)c1ccc(F)cc1 ZINC001366411479 1337564200 /nfs/dbraw/zinc/56/42/00/1337564200.db2.gz PMXWCYOXNRGLHQ-LPHOPBHVSA-N 1 3 347.478 2.811 10 0 EFAEHO CC[C@@H]([NH2+]C[C@@H]1CCN(C(=O)CN2CCCC2)C1)c1ccc(F)cc1 ZINC001366411482 1337564311 /nfs/dbraw/zinc/56/43/11/1337564311.db2.gz PMXWCYOXNRGLHQ-QFBILLFUSA-N 1 3 347.478 2.811 10 0 EFAEHO C[C@H](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCC1 ZINC001366485681 1337626369 /nfs/dbraw/zinc/62/63/69/1337626369.db2.gz MMNJDLPKZNERNW-BEFAXECRSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001366490650 1337631015 /nfs/dbraw/zinc/63/10/15/1337631015.db2.gz WJPUPRIDVGUKSF-HNAYVOBHSA-N 1 3 345.531 2.938 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+][C@@H]1CCCc2ccccc21 ZINC001366512908 1337653516 /nfs/dbraw/zinc/65/35/16/1337653516.db2.gz PONOUZOFCQNOII-QFBILLFUSA-N 1 3 331.504 2.889 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(C)CCNC(=O)C12CCC[NH+](CCC1)C2 ZINC001366540821 1337676294 /nfs/dbraw/zinc/67/62/94/1337676294.db2.gz MLNJWKUGWCNLMX-INIZCTEOSA-N 1 3 347.478 2.811 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@H+](C)CCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001366564679 1337698608 /nfs/dbraw/zinc/69/86/08/1337698608.db2.gz FILBPSBFWVOFAB-FUHWJXTLSA-N 1 3 331.504 2.754 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@@H+](C)CCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001366564679 1337698613 /nfs/dbraw/zinc/69/86/13/1337698613.db2.gz FILBPSBFWVOFAB-FUHWJXTLSA-N 1 3 331.504 2.754 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@@H+]1CC1CC2(CCC2)C1)N(C)C ZINC001366663464 1337819928 /nfs/dbraw/zinc/81/99/28/1337819928.db2.gz ALFWHHOGXYHDQC-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@H+]1CC1CC2(CCC2)C1)N(C)C ZINC001366663464 1337819937 /nfs/dbraw/zinc/81/99/37/1337819937.db2.gz ALFWHHOGXYHDQC-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CC[N@H+](CCC2CCCCC2)C1)N(C)C ZINC001366690955 1337872581 /nfs/dbraw/zinc/87/25/81/1337872581.db2.gz SIGPAQRLGVIREY-RBUKOAKNSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CC[N@@H+](CCC2CCCCC2)C1)N(C)C ZINC001366690955 1337872587 /nfs/dbraw/zinc/87/25/87/1337872587.db2.gz SIGPAQRLGVIREY-RBUKOAKNSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001366692984 1337874957 /nfs/dbraw/zinc/87/49/57/1337874957.db2.gz ARYBDVHRZQZPOX-SJLPKXTDSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001366692984 1337874966 /nfs/dbraw/zinc/87/49/66/1337874966.db2.gz ARYBDVHRZQZPOX-SJLPKXTDSA-N 1 3 335.536 2.591 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCN(Cc2ccsc2)C1 ZINC001366701302 1337889138 /nfs/dbraw/zinc/88/91/38/1337889138.db2.gz KIKGZENOAJCYHI-DOTOQJQBSA-N 1 3 335.517 2.561 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCN(Cc2ccsc2)C1 ZINC001366701302 1337889143 /nfs/dbraw/zinc/88/91/43/1337889143.db2.gz KIKGZENOAJCYHI-DOTOQJQBSA-N 1 3 335.517 2.561 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@H+](CCC2CCCC2)C1)N1CCCC1 ZINC001366703541 1337895121 /nfs/dbraw/zinc/89/51/21/1337895121.db2.gz YEKFGVIWYZUTIQ-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@@H+](CCC2CCCC2)C1)N1CCCC1 ZINC001366703541 1337895131 /nfs/dbraw/zinc/89/51/31/1337895131.db2.gz YEKFGVIWYZUTIQ-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c(C)s1 ZINC001366708473 1337901511 /nfs/dbraw/zinc/90/15/11/1337901511.db2.gz FHRVZCBLUQZSTA-INIZCTEOSA-N 1 3 337.533 2.643 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c(C)s1 ZINC001366708473 1337901513 /nfs/dbraw/zinc/90/15/13/1337901513.db2.gz FHRVZCBLUQZSTA-INIZCTEOSA-N 1 3 337.533 2.643 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@@H](C(=O)NCCN(Cc2ccccc2)C2CC2)C1 ZINC001366755357 1337972341 /nfs/dbraw/zinc/97/23/41/1337972341.db2.gz CZIOGSDQASHNRX-QUCCMNQESA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H]([NH2+]CC[C@H](C)F)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001366782541 1338000603 /nfs/dbraw/zinc/00/06/03/1338000603.db2.gz MAXHFHVLOPDNSW-DLBZAZTESA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)CC[NH2+][C@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001366785886 1338004787 /nfs/dbraw/zinc/00/47/87/1338004787.db2.gz VNGUZCNQXBGZPU-GOSISDBHSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@H+](C)CCc2cccs2)C1 ZINC001480742467 1338015241 /nfs/dbraw/zinc/01/52/41/1338015241.db2.gz LXVFVOMTMQJKLT-MRXNPFEDSA-N 1 3 337.533 2.554 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@@H+](C)CCc2cccs2)C1 ZINC001480742467 1338015244 /nfs/dbraw/zinc/01/52/44/1338015244.db2.gz LXVFVOMTMQJKLT-MRXNPFEDSA-N 1 3 337.533 2.554 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001366881538 1338159446 /nfs/dbraw/zinc/15/94/46/1338159446.db2.gz QUEFFZPFGZFNHE-GOSISDBHSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001366881538 1338159450 /nfs/dbraw/zinc/15/94/50/1338159450.db2.gz QUEFFZPFGZFNHE-GOSISDBHSA-N 1 3 341.515 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[N@H+](C)CC2CC3(CCC3)C2)C1 ZINC001366884886 1338164266 /nfs/dbraw/zinc/16/42/66/1338164266.db2.gz SLQGCDOLYWOTQX-QGZVFWFLSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[N@@H+](C)CC2CC3(CCC3)C2)C1 ZINC001366884886 1338164268 /nfs/dbraw/zinc/16/42/68/1338164268.db2.gz SLQGCDOLYWOTQX-QGZVFWFLSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001366901782 1338187384 /nfs/dbraw/zinc/18/73/84/1338187384.db2.gz NKIGTPPDBRHWRZ-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001366901782 1338187391 /nfs/dbraw/zinc/18/73/91/1338187391.db2.gz NKIGTPPDBRHWRZ-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCC1CN(CCCc2ccsc2)C1 ZINC001366970754 1338230467 /nfs/dbraw/zinc/23/04/67/1338230467.db2.gz MJBICJXTNJJDLR-GOSISDBHSA-N 1 3 349.544 2.603 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCC1CN(CCCc2ccsc2)C1 ZINC001366970754 1338230471 /nfs/dbraw/zinc/23/04/71/1338230471.db2.gz MJBICJXTNJJDLR-GOSISDBHSA-N 1 3 349.544 2.603 10 0 EFAEHO CCc1cccc(CN2CC[C@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001367008749 1338263851 /nfs/dbraw/zinc/26/38/51/1338263851.db2.gz KMQAPAHKQZEDRK-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1cccc(CN2CC[C@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001367008749 1338263853 /nfs/dbraw/zinc/26/38/53/1338263853.db2.gz KMQAPAHKQZEDRK-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO CCCc1ccc(CN2CC[C@@H](N(C)C(=O)CC[NH+](C)C)C2)cc1 ZINC001367061206 1338331684 /nfs/dbraw/zinc/33/16/84/1338331684.db2.gz QNVVPDJMXCAIBB-LJQANCHMSA-N 1 3 331.504 2.624 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](CC)N(C)C)[NH2+]Cc1ccc(C)cc1Cl ZINC001367097352 1338382981 /nfs/dbraw/zinc/38/29/81/1338382981.db2.gz CTPOAVVPPDQFLJ-NVXWUHKLSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]CC1CC(F)(F)C1 ZINC001367125408 1338413735 /nfs/dbraw/zinc/41/37/35/1338413735.db2.gz DVXJQDRGLGLJAE-GDBMZVCRSA-N 1 3 345.478 2.781 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](CC)N(C)C)[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001367135364 1338426076 /nfs/dbraw/zinc/42/60/76/1338426076.db2.gz RXFWMMDZPQFHMC-CZUORRHYSA-N 1 3 343.874 2.804 10 0 EFAEHO CCCN(C)CC(=O)NC1(C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CCCC1 ZINC001367163560 1338463039 /nfs/dbraw/zinc/46/30/39/1338463039.db2.gz NNYKMKNMADTTNS-KURKYZTESA-N 1 3 335.536 2.783 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC1CC[NH+](CCC(C)(C)C)CC1 ZINC001367213002 1338522753 /nfs/dbraw/zinc/52/27/53/1338522753.db2.gz LDMVYNYKOLURFI-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@@H](C)c1ccccc1F ZINC001367229585 1338536404 /nfs/dbraw/zinc/53/64/04/1338536404.db2.gz YXVVOWRKSURJNL-JKSUJKDBSA-N 1 3 335.467 2.808 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+]C[C@H](C)CNC(=O)CN(C)C(C)C ZINC001367290760 1338589613 /nfs/dbraw/zinc/58/96/13/1338589613.db2.gz TZYMDFMHTYJDJE-AWEZNQCLSA-N 1 3 339.911 2.831 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(Cl)cc1 ZINC001480791568 1338615540 /nfs/dbraw/zinc/61/55/40/1338615540.db2.gz YTHDRZDEUYLIAJ-LSDHHAIUSA-N 1 3 337.895 2.666 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]C/C=C/Cl)CCCC1)N1CCCC1 ZINC001367329955 1338629682 /nfs/dbraw/zinc/62/96/82/1338629682.db2.gz KNDVIRXAQGBDHA-JXMROGBWSA-N 1 3 327.900 2.632 10 0 EFAEHO C[C@H](C[NH2+]Cc1cccc(C(F)F)c1)N(C)C(=O)[C@@H]1CCCN1C ZINC001367365276 1338660838 /nfs/dbraw/zinc/66/08/38/1338660838.db2.gz YIZSGQAURYPGIT-CJNGLKHVSA-N 1 3 339.430 2.655 10 0 EFAEHO C[C@H](CNCc1ccccc1F)N(C)C(=O)C12CCC[NH+](CCC1)C2 ZINC001367369882 1338665666 /nfs/dbraw/zinc/66/56/66/1338665666.db2.gz XSRBZMZVGOEWOX-MRXNPFEDSA-N 1 3 347.478 2.638 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](C)N(C)C(=O)C12CC[NH+](CC1)C2 ZINC001367392190 1338688383 /nfs/dbraw/zinc/68/83/83/1338688383.db2.gz ACYGMPTZHJAGSL-HNNXBMFYSA-N 1 3 349.906 2.681 10 0 EFAEHO C[C@H](C[NH2+][C@H]1CCCc2ccc(F)cc21)N(C)C(=O)CN1CCCC1 ZINC001367404376 1338701840 /nfs/dbraw/zinc/70/18/40/1338701840.db2.gz LPDATBHRYBOTPZ-BEFAXECRSA-N 1 3 347.478 2.735 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CCCC2)cc1 ZINC001367407629 1338705430 /nfs/dbraw/zinc/70/54/30/1338705430.db2.gz RXEGNJOKPZYZEE-GOSISDBHSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]CC1CCC(F)(F)CC1 ZINC001367412761 1338711171 /nfs/dbraw/zinc/71/11/71/1338711171.db2.gz KRYLKYIIBFSTDF-CQSZACIVSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]Cc1cc2ccccc2o1 ZINC001367416131 1338714806 /nfs/dbraw/zinc/71/48/06/1338714806.db2.gz QUFBEZIUKAMXEE-HNNXBMFYSA-N 1 3 331.460 2.710 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1cc(C)sc1C)C(C)C)N(C)C ZINC001367495292 1338794375 /nfs/dbraw/zinc/79/43/75/1338794375.db2.gz SPOHZRRSMWNODG-DLBZAZTESA-N 1 3 339.549 2.936 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)cc1 ZINC001367494430 1338793935 /nfs/dbraw/zinc/79/39/35/1338793935.db2.gz YTILIOGPERJXKA-YLJYHZDGSA-N 1 3 345.531 2.821 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)CC[C@@H]2CCC[N@@H+]2C)cc1 ZINC001367522617 1338822509 /nfs/dbraw/zinc/82/25/09/1338822509.db2.gz LZYPPVSNNHLKSH-IBGZPJMESA-N 1 3 331.504 2.760 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)CC[C@@H]2CCC[N@H+]2C)cc1 ZINC001367522617 1338822513 /nfs/dbraw/zinc/82/25/13/1338822513.db2.gz LZYPPVSNNHLKSH-IBGZPJMESA-N 1 3 331.504 2.760 10 0 EFAEHO CN(CC[N@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@H]1CCCN1C ZINC001367526439 1338827654 /nfs/dbraw/zinc/82/76/54/1338827654.db2.gz JRASMWUKGWZGEW-LJQANCHMSA-N 1 3 329.488 2.548 10 0 EFAEHO CN(CC[N@@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@H]1CCCN1C ZINC001367526439 1338827660 /nfs/dbraw/zinc/82/76/60/1338827660.db2.gz JRASMWUKGWZGEW-LJQANCHMSA-N 1 3 329.488 2.548 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[N@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001367532554 1338835086 /nfs/dbraw/zinc/83/50/86/1338835086.db2.gz OOACZSCEGIQTOD-IBGZPJMESA-N 1 3 331.504 2.794 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[N@@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001367532554 1338835091 /nfs/dbraw/zinc/83/50/91/1338835091.db2.gz OOACZSCEGIQTOD-IBGZPJMESA-N 1 3 331.504 2.794 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@@H]2CCC[C@H]3CCC[N@@H+]32)c1 ZINC001367540298 1338844865 /nfs/dbraw/zinc/84/48/65/1338844865.db2.gz GIMXFCWSTNRJDC-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@@H]2CCC[C@H]3CCC[N@H+]32)c1 ZINC001367540298 1338844867 /nfs/dbraw/zinc/84/48/67/1338844867.db2.gz GIMXFCWSTNRJDC-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[N@H+](C)C[C@H]1CCc2ccccc2C1)N(C)C ZINC001367544356 1338850310 /nfs/dbraw/zinc/85/03/10/1338850310.db2.gz BJJGAFLYCFUWAZ-PXNSSMCTSA-N 1 3 345.531 2.522 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[N@@H+](C)C[C@H]1CCc2ccccc2C1)N(C)C ZINC001367544356 1338850320 /nfs/dbraw/zinc/85/03/20/1338850320.db2.gz BJJGAFLYCFUWAZ-PXNSSMCTSA-N 1 3 345.531 2.522 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)C12CC[NH+](CC1)C2 ZINC001367544839 1338851556 /nfs/dbraw/zinc/85/15/56/1338851556.db2.gz GKEQWQNRXYSINW-GOSISDBHSA-N 1 3 347.478 2.763 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)N(C)CCN(C)CCc1ccccc1F ZINC001367551597 1338861923 /nfs/dbraw/zinc/86/19/23/1338861923.db2.gz MNSJRVZNIXQFGG-IAGOWNOFSA-N 1 3 349.494 2.631 10 0 EFAEHO CCN(CC[NH2+][C@@H](C)c1cc(C)ccc1C)C(=O)[C@@H]1CCCN1C ZINC001367639484 1338895294 /nfs/dbraw/zinc/89/52/94/1338895294.db2.gz IPLRNGGCBKNRQV-HKUYNNGSSA-N 1 3 331.504 2.897 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)C(C)(C)[NH+]2CCCCC2)c1 ZINC001367678970 1338922911 /nfs/dbraw/zinc/92/29/11/1338922911.db2.gz ZOFXRYGBUXPJLJ-MRXNPFEDSA-N 1 3 349.494 2.993 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H](C)NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)c1 ZINC001367695281 1338935087 /nfs/dbraw/zinc/93/50/87/1338935087.db2.gz OYHOPHZDCHTINA-UZLBHIALSA-N 1 3 349.494 2.802 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)C[C@H]2CC[N@H+](C)C2)c(Cl)c1 ZINC001367706002 1338944221 /nfs/dbraw/zinc/94/42/21/1338944221.db2.gz LIJXWWNRSKLZOY-HUUCEWRRSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)C[C@H]2CC[N@@H+](C)C2)c(Cl)c1 ZINC001367706002 1338944222 /nfs/dbraw/zinc/94/42/22/1338944222.db2.gz LIJXWWNRSKLZOY-HUUCEWRRSA-N 1 3 337.895 2.585 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(CF)cc1 ZINC001367731779 1338964004 /nfs/dbraw/zinc/96/40/04/1338964004.db2.gz AFEZGIAYVFHKOI-CRAIPNDOSA-N 1 3 335.467 2.625 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(CF)cc1 ZINC001367731783 1338964298 /nfs/dbraw/zinc/96/42/98/1338964298.db2.gz AFEZGIAYVFHKOI-QAPCUYQASA-N 1 3 335.467 2.625 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CC1CCC(F)(F)CC1 ZINC001367736206 1338967103 /nfs/dbraw/zinc/96/71/03/1338967103.db2.gz DYLHYLNCYQMJHS-HOCLYGCPSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CCC2)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001367760390 1338987699 /nfs/dbraw/zinc/98/76/99/1338987699.db2.gz PPLBJUGBPXLRNJ-SJORKVTESA-N 1 3 343.515 2.890 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(F)c1 ZINC001367815748 1339033571 /nfs/dbraw/zinc/03/35/71/1339033571.db2.gz SUSXZBWKRBCYJW-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(F)c1 ZINC001367815748 1339033573 /nfs/dbraw/zinc/03/35/73/1339033573.db2.gz SUSXZBWKRBCYJW-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO C[C@@H](CN(C)C/C=C/c1ccccc1)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001367839548 1339056454 /nfs/dbraw/zinc/05/64/54/1339056454.db2.gz YGYFYLAKJKUSIN-GENHVGIHSA-N 1 3 343.515 2.867 10 0 EFAEHO C[C@@H](CN(C)C/C=C/c1ccccc1)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001367839548 1339056457 /nfs/dbraw/zinc/05/64/57/1339056457.db2.gz YGYFYLAKJKUSIN-GENHVGIHSA-N 1 3 343.515 2.867 10 0 EFAEHO CC(C)(C(=O)N[C@H](C[NH2+]Cc1ccsc1)C1CC1)N1CCCC1 ZINC001367903932 1339097156 /nfs/dbraw/zinc/09/71/56/1339097156.db2.gz RIPQUDFOWYRHMD-MRXNPFEDSA-N 1 3 335.517 2.607 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]CC1CCC(F)(F)CC1)C1CC1 ZINC001367919617 1339107982 /nfs/dbraw/zinc/10/79/82/1339107982.db2.gz LSQAACSTTVEROZ-MRXNPFEDSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001367920159 1339108338 /nfs/dbraw/zinc/10/83/38/1339108338.db2.gz LIUBGACVVOBDHW-MSOLQXFVSA-N 1 3 335.536 2.637 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001367920163 1339108413 /nfs/dbraw/zinc/10/84/13/1339108413.db2.gz LIUBGACVVOBDHW-QZTJIDSGSA-N 1 3 335.536 2.637 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]CCC(C)(C)C ZINC001367924487 1339111117 /nfs/dbraw/zinc/11/11/17/1339111117.db2.gz ABJVNGSQQOKAPV-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)CC[C@@H]3CCC[N@H+]3C)CC2)c(C)s1 ZINC001368006705 1339154459 /nfs/dbraw/zinc/15/44/59/1339154459.db2.gz IYKHVKDLQDUXBU-KRWDZBQOSA-N 1 3 349.544 2.978 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)CC[C@@H]3CCC[N@@H+]3C)CC2)c(C)s1 ZINC001368006705 1339154460 /nfs/dbraw/zinc/15/44/60/1339154460.db2.gz IYKHVKDLQDUXBU-KRWDZBQOSA-N 1 3 349.544 2.978 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+]CC2CCC3(CC3)CC2)CC1)N(C)C ZINC001368007646 1339154956 /nfs/dbraw/zinc/15/49/56/1339154956.db2.gz ORZHVQCTPCFFJC-KRWDZBQOSA-N 1 3 335.536 2.781 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+][C@@H]2CCCc3ccc(F)cc32)CC1 ZINC001368038638 1339169923 /nfs/dbraw/zinc/16/99/23/1339169923.db2.gz TUUKINNYWPPXKI-GOSISDBHSA-N 1 3 347.478 2.783 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1CC[C@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001368042154 1339171791 /nfs/dbraw/zinc/17/17/91/1339171791.db2.gz GVMFQQFNHHNMAE-ZWKOTPCHSA-N 1 3 341.515 2.635 10 0 EFAEHO CC[C@@H](F)C[N@H+]1CC[C@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001368042154 1339171792 /nfs/dbraw/zinc/17/17/92/1339171792.db2.gz GVMFQQFNHHNMAE-ZWKOTPCHSA-N 1 3 341.515 2.635 10 0 EFAEHO CC[C@H](C)C[N@H+](CC1CC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001368051921 1339177863 /nfs/dbraw/zinc/17/78/63/1339177863.db2.gz SFIPXMFANIKRSJ-KRWDZBQOSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@H](C)C[N@@H+](CC1CC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001368051921 1339177864 /nfs/dbraw/zinc/17/78/64/1339177864.db2.gz SFIPXMFANIKRSJ-KRWDZBQOSA-N 1 3 335.536 2.831 10 0 EFAEHO CN(C(=O)CCC[NH+]1CCCC1)C1CN(CC2CCCCCC2)C1 ZINC001368091051 1339192064 /nfs/dbraw/zinc/19/20/64/1339192064.db2.gz SZJKRFSUBVOTRF-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)[C@H](C)C1 ZINC001368102406 1339195487 /nfs/dbraw/zinc/19/54/87/1339195487.db2.gz GSARUXPKXDHNRT-MJGOQNOKSA-N 1 3 331.504 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+][C@@H]1CCc2c1cccc2F ZINC001368124315 1339204601 /nfs/dbraw/zinc/20/46/01/1339204601.db2.gz VADBJVJGGWOXSO-HNAYVOBHSA-N 1 3 347.478 2.734 10 0 EFAEHO Cc1ccc(F)cc1C[NH+]1CCC(C)(NC(=O)CN(C)C(C)C)CC1 ZINC001368127081 1339205819 /nfs/dbraw/zinc/20/58/19/1339205819.db2.gz FSRZEOCLLLMEFS-UHFFFAOYSA-N 1 3 349.494 2.945 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@]2(CC[N@H+](CC[C@@H](C)F)C2)C1 ZINC001368142891 1339215832 /nfs/dbraw/zinc/21/58/32/1339215832.db2.gz FQLUQCNMVWFLGT-IEBWSBKVSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@]2(CC[N@@H+](CC[C@@H](C)F)C2)C1 ZINC001368142891 1339215833 /nfs/dbraw/zinc/21/58/33/1339215833.db2.gz FQLUQCNMVWFLGT-IEBWSBKVSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@]1(C)CCN([C@@H](C)c2cccc(OC)c2)C1 ZINC001368184602 1339242291 /nfs/dbraw/zinc/24/22/91/1339242291.db2.gz YPBHJTKZGCIVOO-JXFKEZNVSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@]1(C)CCN([C@@H](C)c2cccc(OC)c2)C1 ZINC001368184602 1339242297 /nfs/dbraw/zinc/24/22/97/1339242297.db2.gz YPBHJTKZGCIVOO-JXFKEZNVSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001368195248 1339248206 /nfs/dbraw/zinc/24/82/06/1339248206.db2.gz KDUNWAYRZQSGAE-YJBOKZPZSA-N 1 3 329.504 2.541 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@]1(C)CCC[N@H+](CCCF)C1 ZINC001368233233 1339277149 /nfs/dbraw/zinc/27/71/49/1339277149.db2.gz ZRMBKDZEIRZLPU-PKOBYXMFSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@]1(C)CCC[N@@H+](CCCF)C1 ZINC001368233233 1339277151 /nfs/dbraw/zinc/27/71/51/1339277151.db2.gz ZRMBKDZEIRZLPU-PKOBYXMFSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN1CCC(F)(F)[C@@H](CNC(=O)[C@H](C(C)C)[NH+]2CCCCC2)C1 ZINC001368252515 1339284274 /nfs/dbraw/zinc/28/42/74/1339284274.db2.gz SCSLFBGEMYGJLT-HOTGVXAUSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC[C@H](C)F)N(C)C ZINC001368345557 1339309002 /nfs/dbraw/zinc/30/90/02/1339309002.db2.gz HWFRYNMEHBRFEZ-JCECYMMASA-N 1 3 341.515 2.680 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC[C@H](C)F)N(C)C ZINC001368345557 1339309004 /nfs/dbraw/zinc/30/90/04/1339309004.db2.gz HWFRYNMEHBRFEZ-JCECYMMASA-N 1 3 341.515 2.680 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001368347933 1339309918 /nfs/dbraw/zinc/30/99/18/1339309918.db2.gz HMENIAWGKYYPJN-FXAWDEMLSA-N 1 3 345.531 2.773 10 0 EFAEHO Cc1cc(F)ccc1CN1C[C@@H]2CCCN(C(=O)CC[NH+](C)C)[C@@H]2C1 ZINC001368382404 1339320311 /nfs/dbraw/zinc/32/03/11/1339320311.db2.gz WIAZAEZGYOOZMF-PKOBYXMFSA-N 1 3 347.478 2.509 10 0 EFAEHO CN(C[C@H]1CCN1CC[C@@H]1CCCC1(F)F)C(=O)CCC[NH+](C)C ZINC001368399805 1339334793 /nfs/dbraw/zinc/33/47/93/1339334793.db2.gz KZFVJEVYENJRNM-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)C[C@H]1CCN1CC[C@@H]1CCCC1(F)F ZINC001368419908 1339353964 /nfs/dbraw/zinc/35/39/64/1339353964.db2.gz KJRGPXXRFZEQFJ-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)C[C@H]1CCN1CC[C@@H]1CCCC1(F)F ZINC001368419908 1339353969 /nfs/dbraw/zinc/35/39/69/1339353969.db2.gz KJRGPXXRFZEQFJ-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](CC[NH2+][C@@H]2CCc3ccccc32)C1 ZINC001368420239 1339354257 /nfs/dbraw/zinc/35/42/57/1339354257.db2.gz MXQPNXSJPNAATO-YLJYHZDGSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)C[C@@H]1CCN1CC[C@H]1CCCC1(F)F ZINC001368419894 1339354496 /nfs/dbraw/zinc/35/44/96/1339354496.db2.gz KJRGPXXRFZEQFJ-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)C[C@@H]1CCN1CC[C@H]1CCCC1(F)F ZINC001368419894 1339354497 /nfs/dbraw/zinc/35/44/97/1339354497.db2.gz KJRGPXXRFZEQFJ-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+][C@@H]2CCc3ccccc32)C1 ZINC001368425504 1339358923 /nfs/dbraw/zinc/35/89/23/1339358923.db2.gz TWWBINDQEIJLMO-FXAWDEMLSA-N 1 3 343.515 2.844 10 0 EFAEHO CC(C)C[C@@H](C)C[NH+]1CCC2(CN(C(=O)Cc3c[nH]cn3)C2)CC1 ZINC001368424048 1339359060 /nfs/dbraw/zinc/35/90/60/1339359060.db2.gz PQPUBZXZIFNNPP-MRXNPFEDSA-N 1 3 332.492 2.559 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]CCc2ccccc2)CCC1 ZINC001368498155 1339436309 /nfs/dbraw/zinc/43/63/09/1339436309.db2.gz ZKTMWACJPWYNOS-QZTJIDSGSA-N 1 3 343.515 2.730 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+]CC[C@H](C)F)CCC1)N1CCCCC1 ZINC001368499074 1339437146 /nfs/dbraw/zinc/43/71/46/1339437146.db2.gz YGJGZTYHIXFJGG-DLBZAZTESA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](Cc2cccc(C)c2)CC1)N(C)C ZINC001368509161 1339444886 /nfs/dbraw/zinc/44/48/86/1339444886.db2.gz CUUJBBOIIFWBLG-RBUKOAKNSA-N 1 3 331.504 2.806 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](Cc2cccc(C)c2)CC1)N(C)C ZINC001368509161 1339444887 /nfs/dbraw/zinc/44/48/87/1339444887.db2.gz CUUJBBOIIFWBLG-RBUKOAKNSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC001368517044 1339452324 /nfs/dbraw/zinc/45/23/24/1339452324.db2.gz CSBFVLUEGFEKDB-GOSISDBHSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC001368517044 1339452326 /nfs/dbraw/zinc/45/23/26/1339452326.db2.gz CSBFVLUEGFEKDB-GOSISDBHSA-N 1 3 335.467 2.637 10 0 EFAEHO CN(CCC[N@H+](C)CC[C@H]1CCCC1(F)F)C(=O)[C@H]1CCCN1C ZINC001368531919 1339469851 /nfs/dbraw/zinc/46/98/51/1339469851.db2.gz XVUUBUBACMEJHS-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCC[N@@H+](C)CC[C@H]1CCCC1(F)F)C(=O)[C@H]1CCCN1C ZINC001368531919 1339469854 /nfs/dbraw/zinc/46/98/54/1339469854.db2.gz XVUUBUBACMEJHS-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@H+](CCC(C)(C)C)CC1)N(C)C ZINC001368532913 1339471098 /nfs/dbraw/zinc/47/10/98/1339471098.db2.gz MEPYUYHMEPFZMC-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@@H+](CCC(C)(C)C)CC1)N(C)C ZINC001368532913 1339471100 /nfs/dbraw/zinc/47/11/00/1339471100.db2.gz MEPYUYHMEPFZMC-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CCC1([NH2+]CCC(C)C)CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001368591190 1339537315 /nfs/dbraw/zinc/53/73/15/1339537315.db2.gz BWRJTVUWZBKCJC-QGZVFWFLSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+]CC2CCC3(CC3)CC2)C1)N(C)C ZINC001368608239 1339547647 /nfs/dbraw/zinc/54/76/47/1339547647.db2.gz ORJFRGOCLWVSRD-BZSNNMDCSA-N 1 3 335.536 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C[C@H]1C)CC[NH+](CC[C@@H](C)F)CC2 ZINC001368650372 1339566378 /nfs/dbraw/zinc/56/63/78/1339566378.db2.gz HBNKBRNVFSAUEA-IAGOWNOFSA-N 1 3 341.515 2.779 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001368663059 1339575600 /nfs/dbraw/zinc/57/56/00/1339575600.db2.gz ZBJRYEXBMCRHID-HKUYNNGSSA-N 1 3 331.504 2.580 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C)([NH2+]CCc2ccccc2F)CC1)N(C)C ZINC001368664538 1339576644 /nfs/dbraw/zinc/57/66/44/1339576644.db2.gz QHZRHQMKKIWQRL-GOSISDBHSA-N 1 3 349.494 2.679 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C)([NH2+]CC=C(Cl)Cl)CC1)N(C)C ZINC001368665872 1339578114 /nfs/dbraw/zinc/57/81/14/1339578114.db2.gz VZTYNMJGFYXJDB-LBPRGKRZSA-N 1 3 336.307 2.616 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)c(C)s1 ZINC001368670630 1339583528 /nfs/dbraw/zinc/58/35/28/1339583528.db2.gz TYHNQYTXJOZMHP-DYVFJYSZSA-N 1 3 337.533 2.642 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+]C1(C)CCN(C(=O)CN(C)C(C)C)CC1 ZINC001368672745 1339586733 /nfs/dbraw/zinc/58/67/33/1339586733.db2.gz UTYAYASPHYNXPO-QGZVFWFLSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)CN(C)C2CCC2)CC[N@@H+]1Cc1ccsc1 ZINC001368693296 1339608301 /nfs/dbraw/zinc/60/83/01/1339608301.db2.gz LDQZXVPIZXVDDJ-GOEBONIOSA-N 1 3 335.517 2.702 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)CN(C)C2CCC2)CC[N@H+]1Cc1ccsc1 ZINC001368693296 1339608307 /nfs/dbraw/zinc/60/83/07/1339608307.db2.gz LDQZXVPIZXVDDJ-GOEBONIOSA-N 1 3 335.517 2.702 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[N@H+](C)CC)CCN1Cc1ccc(F)cc1 ZINC001368702323 1339621206 /nfs/dbraw/zinc/62/12/06/1339621206.db2.gz RWGONLQDEXICSS-ZWKOTPCHSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[N@@H+](C)CC)CCN1Cc1ccc(F)cc1 ZINC001368702323 1339621212 /nfs/dbraw/zinc/62/12/12/1339621212.db2.gz RWGONLQDEXICSS-ZWKOTPCHSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1cccc2cccnc21)N(C)C ZINC001368722055 1339641178 /nfs/dbraw/zinc/64/11/78/1339641178.db2.gz HKMQBGBQHCGMSU-MAUKXSAKSA-N 1 3 342.487 2.559 10 0 EFAEHO Cc1cccnc1CN[C@@H]1CCCCCN(C(=O)CCC[NH+](C)C)C1 ZINC001368752505 1339677281 /nfs/dbraw/zinc/67/72/81/1339677281.db2.gz CTQJQEPEPIAIGP-GOSISDBHSA-N 1 3 346.519 2.593 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCCCC[C@@H]([NH2+]C/C=C/Cl)C1)N(C)C ZINC001368752256 1339677624 /nfs/dbraw/zinc/67/76/24/1339677624.db2.gz BTBLDSOPHCDZDE-ZGWZEZEDSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCCCC[C@H]([NH2+]C/C=C\Cl)C1)N(C)C ZINC001368753847 1339678661 /nfs/dbraw/zinc/67/86/61/1339678661.db2.gz BTBLDSOPHCDZDE-PCOVPTDHSA-N 1 3 329.916 2.686 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCCCC[C@@H]([NH2+]CCC(F)(F)F)C2)C1 ZINC001368764125 1339689747 /nfs/dbraw/zinc/68/97/47/1339689747.db2.gz YKJGOVOJZSSUOK-LSDHHAIUSA-N 1 3 349.441 2.641 10 0 EFAEHO CC[N@H+](CC[C@H](C)F)CC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001368771408 1339695748 /nfs/dbraw/zinc/69/57/48/1339695748.db2.gz WHXZXVQYHNSIQA-FUHWJXTLSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[N@@H+](CC[C@H](C)F)CC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001368771408 1339695750 /nfs/dbraw/zinc/69/57/50/1339695750.db2.gz WHXZXVQYHNSIQA-FUHWJXTLSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[N@H+](CC[C@@H](C)F)CC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001368771409 1339696095 /nfs/dbraw/zinc/69/60/95/1339696095.db2.gz WHXZXVQYHNSIQA-SJLPKXTDSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[N@@H+](CC[C@@H](C)F)CC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001368771409 1339696097 /nfs/dbraw/zinc/69/60/97/1339696097.db2.gz WHXZXVQYHNSIQA-SJLPKXTDSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[N@H+](CC[C@H](C)F)CC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001368780533 1339707176 /nfs/dbraw/zinc/70/71/76/1339707176.db2.gz WHXZXVQYHNSIQA-WMZOPIPTSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[N@@H+](CC[C@H](C)F)CC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001368780533 1339707180 /nfs/dbraw/zinc/70/71/80/1339707180.db2.gz WHXZXVQYHNSIQA-WMZOPIPTSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@H]1C[N@H+](C)CCc1ccccc1)N(C)C ZINC001368821450 1339761387 /nfs/dbraw/zinc/76/13/87/1339761387.db2.gz LYUWTLVMPFYTEN-VQTJNVASSA-N 1 3 345.531 2.882 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@H]1C[N@@H+](C)CCc1ccccc1)N(C)C ZINC001368821450 1339761388 /nfs/dbraw/zinc/76/13/88/1339761388.db2.gz LYUWTLVMPFYTEN-VQTJNVASSA-N 1 3 345.531 2.882 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]Cc2cc(C)sc2C)C1)N(C)C ZINC001368822741 1339761966 /nfs/dbraw/zinc/76/19/66/1339761966.db2.gz NZPUHMSJCZITFV-PREGVCBESA-N 1 3 337.533 2.690 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)[NH+]1CCCC1)[C@H](C)NCc1ccccc1F ZINC001368857200 1339793606 /nfs/dbraw/zinc/79/36/06/1339793606.db2.gz BVAFFYKCELHWOL-LSDHHAIUSA-N 1 3 335.467 2.683 10 0 EFAEHO CN(CC(C)(C)C[NH2+]CC1CC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001368918822 1339864092 /nfs/dbraw/zinc/86/40/92/1339864092.db2.gz KXJPDUIKLQYFRF-LJQANCHMSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)N(C)Cc1cccc(Cl)c1 ZINC001368942223 1339889846 /nfs/dbraw/zinc/88/98/46/1339889846.db2.gz SQENOBSRIDLECI-JJRVBVJISA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)N(C)Cc1cccc(Cl)c1 ZINC001368942223 1339889849 /nfs/dbraw/zinc/88/98/49/1339889849.db2.gz SQENOBSRIDLECI-JJRVBVJISA-N 1 3 337.895 2.617 10 0 EFAEHO Cc1ccccc1CCC[NH+]1CC([C@@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001369096999 1339912780 /nfs/dbraw/zinc/91/27/80/1339912780.db2.gz PBBOGWJCSLRJCL-GOSISDBHSA-N 1 3 345.531 2.704 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@H+](CC2CC3(CCC3)C2)CC1(C)C)N(C)C ZINC001369129260 1339934018 /nfs/dbraw/zinc/93/40/18/1339934018.db2.gz OQOZTPNNBASDGI-QZTJIDSGSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@@H+](CC2CC3(CCC3)C2)CC1(C)C)N(C)C ZINC001369129260 1339934023 /nfs/dbraw/zinc/93/40/23/1339934023.db2.gz OQOZTPNNBASDGI-QZTJIDSGSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccccc2)C1)N(C)C ZINC001369179351 1339956453 /nfs/dbraw/zinc/95/64/53/1339956453.db2.gz ZHGUCPUTHBEZDC-PBWTXFEYSA-N 1 3 331.504 2.818 10 0 EFAEHO C[C@@H](N[C@H]1C[C@H](NC(=O)CC[C@@H]2CCC[N@@H+]2C)C1)c1ccccc1F ZINC001370486269 1340098293 /nfs/dbraw/zinc/09/82/93/1340098293.db2.gz UJFLXUBAIREJPD-VQHPVUNQSA-N 1 3 347.478 2.998 10 0 EFAEHO C[C@@H](N[C@H]1C[C@H](NC(=O)CC[C@@H]2CCC[N@H+]2C)C1)c1ccccc1F ZINC001370486269 1340098297 /nfs/dbraw/zinc/09/82/97/1340098297.db2.gz UJFLXUBAIREJPD-VQHPVUNQSA-N 1 3 347.478 2.998 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2cccc(F)c2Cl)C1 ZINC001370703949 1340186420 /nfs/dbraw/zinc/18/64/20/1340186420.db2.gz OIRPMKFKAJATBA-OKILXGFUSA-N 1 3 341.858 2.558 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2cccc(F)c2Cl)C1 ZINC001370703949 1340186434 /nfs/dbraw/zinc/18/64/34/1340186434.db2.gz OIRPMKFKAJATBA-OKILXGFUSA-N 1 3 341.858 2.558 10 0 EFAEHO CCCc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@H](CC)N(C)C)C2)cc1 ZINC001370711796 1340188041 /nfs/dbraw/zinc/18/80/41/1340188041.db2.gz KSOLWVJWVIXYDN-OTWHNJEPSA-N 1 3 331.504 2.716 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCCc3ccccc32)C1 ZINC001370712892 1340188066 /nfs/dbraw/zinc/18/80/66/1340188066.db2.gz QOPSHNZIYXYETD-SCTDSRPQSA-N 1 3 329.488 2.643 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2Cl)C1)N(C)C ZINC001370717097 1340189361 /nfs/dbraw/zinc/18/93/61/1340189361.db2.gz ZSDBQCTXWASISW-ZJOBFFGXSA-N 1 3 337.895 2.978 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)C1 ZINC001370776743 1340204530 /nfs/dbraw/zinc/20/45/30/1340204530.db2.gz BAJMLMDDHZYMMN-YLJYHZDGSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)C1 ZINC001370776743 1340204534 /nfs/dbraw/zinc/20/45/34/1340204534.db2.gz BAJMLMDDHZYMMN-YLJYHZDGSA-N 1 3 343.515 2.844 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[NH2+]Cc2ccc(CF)cc2)C1 ZINC001370828785 1340222787 /nfs/dbraw/zinc/22/27/87/1340222787.db2.gz JMWPJMQZLRSBDY-IBGZPJMESA-N 1 3 349.494 2.825 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@H]1CCCCN1Cc1ccc(CF)cc1 ZINC001370891158 1340262778 /nfs/dbraw/zinc/26/27/78/1340262778.db2.gz YOOBERBMPNVRFM-SFHVURJKSA-N 1 3 335.467 2.579 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1C[NH2+][C@@H]1CCc2ccccc21 ZINC001370949113 1340301920 /nfs/dbraw/zinc/30/19/20/1340301920.db2.gz GWVKLCQEIKYXLW-UYAOXDASSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC2CCC([NH2+]CC=C(Cl)Cl)CC2)C1 ZINC001371079791 1340351720 /nfs/dbraw/zinc/35/17/20/1340351720.db2.gz SOFDODUJUPECGC-HSBZDZAISA-N 1 3 348.318 2.664 10 0 EFAEHO CCc1ccc(CC[NH2+][C@H](C)CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001371179164 1340397685 /nfs/dbraw/zinc/39/76/85/1340397685.db2.gz QGUKTZUOHHGBDY-YLJYHZDGSA-N 1 3 345.531 2.759 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001371179916 1340397866 /nfs/dbraw/zinc/39/78/66/1340397866.db2.gz SHQYFTXSSRKKBR-LPHOPBHVSA-N 1 3 331.504 2.716 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001371183269 1340399405 /nfs/dbraw/zinc/39/94/05/1340399405.db2.gz YHMMNZHYJLULPR-OXJNMPFZSA-N 1 3 343.515 2.642 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H](C)[NH2+]Cc1ccc(C2CC2)cc1)N(C)C ZINC001371215058 1340422816 /nfs/dbraw/zinc/42/28/16/1340422816.db2.gz WPXQBRVPPKTESS-BEFAXECRSA-N 1 3 331.504 2.745 10 0 EFAEHO C[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCCC1 ZINC001371362547 1340529685 /nfs/dbraw/zinc/52/96/85/1340529685.db2.gz JMJCKJRESHKPHO-HNAYVOBHSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H](C)CNC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001371366122 1340532480 /nfs/dbraw/zinc/53/24/80/1340532480.db2.gz UXDBBSRGZUNGSB-RDTXWAMCSA-N 1 3 331.504 2.548 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@H](C)[NH2+]Cc1cccc(F)c1Cl)N(C)C ZINC001371828430 1340706072 /nfs/dbraw/zinc/70/60/72/1340706072.db2.gz NVJKWOAQQDSVRH-WFASDCNBSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001371835165 1340712118 /nfs/dbraw/zinc/71/21/18/1340712118.db2.gz JGEYBTALJXADMU-HOCLYGCPSA-N 1 3 345.478 2.779 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001371835159 1340712164 /nfs/dbraw/zinc/71/21/64/1340712164.db2.gz JGEYBTALJXADMU-GOEBONIOSA-N 1 3 345.478 2.779 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1cccc(Cl)c1F)N(C)C ZINC001371870755 1340732914 /nfs/dbraw/zinc/73/29/14/1340732914.db2.gz WFKINSDMBCGRDW-IUODEOHRSA-N 1 3 343.874 2.804 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@H+](C2CC2)[C@@H]2CCc3ccccc32)C1 ZINC001372862572 1340850983 /nfs/dbraw/zinc/85/09/83/1340850983.db2.gz ZCECIOKGJJYRGQ-OXJNMPFZSA-N 1 3 341.499 2.596 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)C1 ZINC001372862572 1340850992 /nfs/dbraw/zinc/85/09/92/1340850992.db2.gz ZCECIOKGJJYRGQ-OXJNMPFZSA-N 1 3 341.499 2.596 10 0 EFAEHO CCCN(C(=O)[C@@H]1CC[N@H+](C)C1)[C@@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001373127388 1340917375 /nfs/dbraw/zinc/91/73/75/1340917375.db2.gz JWNIFQQIRXIGEA-WOJBJXKFSA-N 1 3 343.515 2.760 10 0 EFAEHO CCCN(C(=O)[C@@H]1CC[N@@H+](C)C1)[C@@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001373127388 1340917376 /nfs/dbraw/zinc/91/73/76/1340917376.db2.gz JWNIFQQIRXIGEA-WOJBJXKFSA-N 1 3 343.515 2.760 10 0 EFAEHO Cc1ccc(F)c(C[N@H+]2CC[C@@H](CCNC(=O)[C@H]3CCCN3C)C2)c1 ZINC001373162149 1340930796 /nfs/dbraw/zinc/93/07/96/1340930796.db2.gz UPGFWCPLZDULRU-VQIMIIECSA-N 1 3 347.478 2.557 10 0 EFAEHO Cc1ccc(F)c(C[N@@H+]2CC[C@@H](CCNC(=O)[C@H]3CCCN3C)C2)c1 ZINC001373162149 1340930798 /nfs/dbraw/zinc/93/07/98/1340930798.db2.gz UPGFWCPLZDULRU-VQIMIIECSA-N 1 3 347.478 2.557 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)NCC[C@@H]1CCN(C/C=C/Cl)C1 ZINC001373186639 1340938550 /nfs/dbraw/zinc/93/85/50/1340938550.db2.gz BMNWBVYOEUJUTQ-OCQNNJOQSA-N 1 3 341.927 2.688 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NCC[C@@H]1CCN(C/C=C/Cl)C1 ZINC001373186639 1340938551 /nfs/dbraw/zinc/93/85/51/1340938551.db2.gz BMNWBVYOEUJUTQ-OCQNNJOQSA-N 1 3 341.927 2.688 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CC[C@@H](CCNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001373190690 1340940712 /nfs/dbraw/zinc/94/07/12/1340940712.db2.gz LCAKATOIPNBMJV-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CC[C@@H](CCNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001373190690 1340940714 /nfs/dbraw/zinc/94/07/14/1340940714.db2.gz LCAKATOIPNBMJV-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N2CC[C@@H](CN(C)C/C=C\Cl)C2)C1 ZINC001373295717 1340980678 /nfs/dbraw/zinc/98/06/78/1340980678.db2.gz XKBYSOKHRYQHGG-YZNPXCOXSA-N 1 3 341.927 2.641 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N2CC[C@@H](CN(C)C/C=C\Cl)C2)C1 ZINC001373295717 1340980680 /nfs/dbraw/zinc/98/06/80/1340980680.db2.gz XKBYSOKHRYQHGG-YZNPXCOXSA-N 1 3 341.927 2.641 10 0 EFAEHO C[N@H+](C/C=C\c1ccccc1)C[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001373318345 1340989193 /nfs/dbraw/zinc/98/91/93/1340989193.db2.gz WBGIVEFQVXIABX-SONCPKABSA-N 1 3 341.499 2.576 10 0 EFAEHO C[N@@H+](C/C=C\c1ccccc1)C[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001373318345 1340989194 /nfs/dbraw/zinc/98/91/94/1340989194.db2.gz WBGIVEFQVXIABX-SONCPKABSA-N 1 3 341.499 2.576 10 0 EFAEHO CC(C)CC[N@@H+](C)CC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001373330974 1340993741 /nfs/dbraw/zinc/99/37/41/1340993741.db2.gz WMIHJNOCYOTUMU-SFHVURJKSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)CC[N@H+](C)CC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001373330974 1340993739 /nfs/dbraw/zinc/99/37/39/1340993739.db2.gz WMIHJNOCYOTUMU-SFHVURJKSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)C1)N(C)C ZINC001373379787 1341005398 /nfs/dbraw/zinc/00/53/98/1341005398.db2.gz POGMSLGLLNLKDK-XHSDSOJGSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@@H+](C[C@H]2CCC(F)(F)C2)C1)N(C)C ZINC001373379787 1341005399 /nfs/dbraw/zinc/00/53/99/1341005399.db2.gz POGMSLGLLNLKDK-XHSDSOJGSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)C1)N(C)C ZINC001373396381 1341011520 /nfs/dbraw/zinc/01/15/20/1341011520.db2.gz SAQAKWLUHDEBDJ-IHPCNDPISA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@H+]([C@H]2CCc3ccccc32)C1)N(C)C ZINC001373396381 1341011521 /nfs/dbraw/zinc/01/15/21/1341011521.db2.gz SAQAKWLUHDEBDJ-IHPCNDPISA-N 1 3 343.515 2.841 10 0 EFAEHO CCN(C(=O)C[C@H]1CC[N@H+](C)C1)[C@@H]1CCN(Cc2cccc(C)c2)C1 ZINC001373714564 1341117511 /nfs/dbraw/zinc/11/75/11/1341117511.db2.gz FOTOFRSLZFAOGP-WOJBJXKFSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)C[C@H]1CC[N@@H+](C)C1)[C@@H]1CCN(Cc2cccc(C)c2)C1 ZINC001373714564 1341117512 /nfs/dbraw/zinc/11/75/12/1341117512.db2.gz FOTOFRSLZFAOGP-WOJBJXKFSA-N 1 3 343.515 2.760 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC001373834401 1341167434 /nfs/dbraw/zinc/16/74/34/1341167434.db2.gz IQOGUEXVAATMRY-FUHWJXTLSA-N 1 3 335.467 2.638 10 0 EFAEHO CCCN(C)CC(=O)NC1(C[NH2+]C[C@H]2CCC(F)(F)C2)CCCC1 ZINC001373860277 1341178431 /nfs/dbraw/zinc/17/84/31/1341178431.db2.gz JYNCURNQGFMCOM-HNNXBMFYSA-N 1 3 345.478 2.782 10 0 EFAEHO CCCN(C)CC(=O)NC1(C[NH2+]C[C@@H]2CCC(F)(F)C2)CCCC1 ZINC001373860279 1341178447 /nfs/dbraw/zinc/17/84/47/1341178447.db2.gz JYNCURNQGFMCOM-OAHLLOKOSA-N 1 3 345.478 2.782 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[C@H]([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001373924814 1341205723 /nfs/dbraw/zinc/20/57/23/1341205723.db2.gz ZVNSAPBLRMJUKZ-RHQZKXFESA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC1CC[NH+](CC2CC(F)(F)C2)CC1 ZINC001373952258 1341244784 /nfs/dbraw/zinc/24/47/84/1341244784.db2.gz PNFCALJLEGHROD-UHFFFAOYSA-N 1 3 345.478 2.590 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001373969784 1341264328 /nfs/dbraw/zinc/26/43/28/1341264328.db2.gz BNDUFGVEXVSHBF-QGZVFWFLSA-N 1 3 335.467 2.555 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC2(CCN(Cc3ccccc3F)C2)CC1 ZINC001373981104 1341274910 /nfs/dbraw/zinc/27/49/10/1341274910.db2.gz IMMRCMFCCYZYNY-UHFFFAOYSA-N 1 3 347.478 2.592 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CCCC(C)(C)C ZINC001391530881 1355280243 /nfs/dbraw/zinc/28/02/43/1355280243.db2.gz FIYZQMMXKAMSDT-OKZBNKHCSA-N 1 3 335.536 2.972 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CCCC(C)(C)C ZINC001391530881 1355280247 /nfs/dbraw/zinc/28/02/47/1355280247.db2.gz FIYZQMMXKAMSDT-OKZBNKHCSA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001374112981 1341423212 /nfs/dbraw/zinc/42/32/12/1341423212.db2.gz VHHSLAOMOBVVSB-DNVCBOLYSA-N 1 3 349.494 2.885 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001374112982 1341423445 /nfs/dbraw/zinc/42/34/45/1341423445.db2.gz VHHSLAOMOBVVSB-HNAYVOBHSA-N 1 3 349.494 2.885 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+]C[C@@H](F)CC)CCCC1 ZINC001374161617 1341482367 /nfs/dbraw/zinc/48/23/67/1341482367.db2.gz SJDDXCUGJDKRAX-HOTGVXAUSA-N 1 3 327.488 2.628 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)[C@@H](C)CNCc2cc(C)ccc2F)CC[N@@H+]1C ZINC001374219983 1341570174 /nfs/dbraw/zinc/57/01/74/1341570174.db2.gz AKVZATYSZZDGJK-VDZJLULYSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)[C@@H](C)CNCc2cc(C)ccc2F)CC[N@H+]1C ZINC001374219983 1341570176 /nfs/dbraw/zinc/57/01/76/1341570176.db2.gz AKVZATYSZZDGJK-VDZJLULYSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C(=O)C1(N(C)C)CCC1 ZINC001374235059 1341588639 /nfs/dbraw/zinc/58/86/39/1341588639.db2.gz UMVJEVDJCUUKOR-INIZCTEOSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]C(C)C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001374354151 1341783345 /nfs/dbraw/zinc/78/33/45/1341783345.db2.gz QHYAEYNVQOQDEW-MAUKXSAKSA-N 1 3 329.504 2.728 10 0 EFAEHO C[C@H]([NH2+]C/C(Cl)=C/Cl)[C@H]1CCCN(C(=O)CN2CCCC2)C1 ZINC001374386313 1341837316 /nfs/dbraw/zinc/83/73/16/1341837316.db2.gz CDPPBBUUUNHHIT-DDBGXBMASA-N 1 3 348.318 2.618 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccsc1 ZINC001374419122 1341897533 /nfs/dbraw/zinc/89/75/33/1341897533.db2.gz KWZXASSBDMDFOP-IRXDYDNUSA-N 1 3 337.533 2.851 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H](CNC(=O)CN1CC[C@H](C)C1)C(C)C ZINC001374434005 1341917007 /nfs/dbraw/zinc/91/70/07/1341917007.db2.gz NQKPYSIEBWLJMP-KXBFYZLASA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](CNC(=O)CN1CC[C@@H](C)C1)C(C)C ZINC001374434637 1341917688 /nfs/dbraw/zinc/91/76/88/1341917688.db2.gz WGCCWLGRDZATQK-VQIMIIECSA-N 1 3 331.504 2.567 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)c1 ZINC001374435120 1341918795 /nfs/dbraw/zinc/91/87/95/1341918795.db2.gz ZOJHRXKAXXHTPC-OXQOHEQNSA-N 1 3 345.531 2.876 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C(C)C ZINC001374457908 1341938932 /nfs/dbraw/zinc/93/89/32/1341938932.db2.gz ZPTLPMAMYKDGAP-GOSISDBHSA-N 1 3 337.483 2.705 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)C[N@@H+]2CC[C@H](C)C2)c(Cl)c1 ZINC001392589854 1356141730 /nfs/dbraw/zinc/14/17/30/1356141730.db2.gz FICMRTPWGATEKB-GJZGRUSLSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)C[N@H+]2CC[C@H](C)C2)c(Cl)c1 ZINC001392589854 1356141732 /nfs/dbraw/zinc/14/17/32/1356141732.db2.gz FICMRTPWGATEKB-GJZGRUSLSA-N 1 3 337.895 2.585 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1)Cc1ccccc1 ZINC001374551809 1342060346 /nfs/dbraw/zinc/06/03/46/1342060346.db2.gz TYPSVLONLLASMD-MOPGFXCFSA-N 1 3 331.504 2.697 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]Cc1cccc(F)c1 ZINC001374569554 1342082061 /nfs/dbraw/zinc/08/20/61/1342082061.db2.gz MTODIVIXSIQSOX-FUHWJXTLSA-N 1 3 335.467 2.540 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C[C@@H](C)NC(=O)CN(C)CC(C)(C)C)c1 ZINC001374814423 1342186057 /nfs/dbraw/zinc/18/60/57/1342186057.db2.gz NAVCPLTUICUPNO-HZPDHXFCSA-N 1 3 349.519 2.828 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@H](C)NC(=O)[C@@H]1CCC[N@@H+]1C(C)C ZINC001375042044 1342340373 /nfs/dbraw/zinc/34/03/73/1342340373.db2.gz ZFFNFANYZBCXPW-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@H](C)NC(=O)[C@@H]1CCC[N@H+]1C(C)C ZINC001375042044 1342340380 /nfs/dbraw/zinc/34/03/80/1342340380.db2.gz ZFFNFANYZBCXPW-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C[N@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001375059306 1342362534 /nfs/dbraw/zinc/36/25/34/1342362534.db2.gz JYEDWCWHUSVXAF-KXBFYZLASA-N 1 3 344.503 2.691 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001375059306 1342362539 /nfs/dbraw/zinc/36/25/39/1342362539.db2.gz JYEDWCWHUSVXAF-KXBFYZLASA-N 1 3 344.503 2.691 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@H](C)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001375089626 1342398280 /nfs/dbraw/zinc/39/82/80/1342398280.db2.gz OWOZISKQLBMIFX-INIZCTEOSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](CNCc1ccccc1F)C1CC1 ZINC001375221773 1342524628 /nfs/dbraw/zinc/52/46/28/1342524628.db2.gz CUPFKYXDHHOHDN-RBUKOAKNSA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@@H](CNCc1ccccc1F)C1CC1 ZINC001375221773 1342524635 /nfs/dbraw/zinc/52/46/35/1342524635.db2.gz CUPFKYXDHHOHDN-RBUKOAKNSA-N 1 3 347.478 2.683 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]Cc1cccc(F)c1 ZINC001375290345 1342597597 /nfs/dbraw/zinc/59/75/97/1342597597.db2.gz UGRFYQDBDXDLNS-MJGOQNOKSA-N 1 3 349.494 2.883 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@H]2CCCN2C(C)C)CC1 ZINC001393493525 1356895509 /nfs/dbraw/zinc/89/55/09/1356895509.db2.gz KXTTZAUDBGKSIF-XLAORIBOSA-N 1 3 341.515 2.872 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NCC1(N[C@@H](C)c2cccc(F)c2)CC1 ZINC001375426227 1342729667 /nfs/dbraw/zinc/72/96/67/1342729667.db2.gz YWRVUZNLJHBFNB-MAUKXSAKSA-N 1 3 347.478 3.000 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NCC1(N[C@@H](C)c2cccc(F)c2)CC1 ZINC001375426227 1342729669 /nfs/dbraw/zinc/72/96/69/1342729669.db2.gz YWRVUZNLJHBFNB-MAUKXSAKSA-N 1 3 347.478 3.000 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+][C@@H](C)c2cccc(F)c2)CC1 ZINC001375426227 1342729671 /nfs/dbraw/zinc/72/96/71/1342729671.db2.gz YWRVUZNLJHBFNB-MAUKXSAKSA-N 1 3 347.478 3.000 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCC1(NCc2ccc(Cl)cc2)CC1 ZINC001375433666 1342738050 /nfs/dbraw/zinc/73/80/50/1342738050.db2.gz VOMLLXGHNVCZEZ-QGZVFWFLSA-N 1 3 349.906 2.953 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCC1(NCc2ccc(Cl)cc2)CC1 ZINC001375433666 1342738053 /nfs/dbraw/zinc/73/80/53/1342738053.db2.gz VOMLLXGHNVCZEZ-QGZVFWFLSA-N 1 3 349.906 2.953 10 0 EFAEHO Cc1cc(C)c(CN2CC[C@@H]2CN(C)C(=O)CCC[NH+](C)C)c(C)c1 ZINC001375458389 1342761239 /nfs/dbraw/zinc/76/12/39/1342761239.db2.gz NFCUEJGBOQAALC-LJQANCHMSA-N 1 3 345.531 2.986 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NCC2([NH2+]CC3CCCC3)CC2)C1 ZINC001375490857 1342797697 /nfs/dbraw/zinc/79/76/97/1342797697.db2.gz MVDBDEKDZAACKQ-LJQANCHMSA-N 1 3 339.499 2.628 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2C[C@@H]([NH2+]CCC3CCCCC3)C2)CCC1 ZINC001375498120 1342804297 /nfs/dbraw/zinc/80/42/97/1342804297.db2.gz ZJNOVZWMINWUMT-HDICACEKSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@@H]([NH2+][C@H]2CCc3ccccc32)C1)N(C)C ZINC001375520660 1342829886 /nfs/dbraw/zinc/82/98/86/1342829886.db2.gz ZQNXGRVYKOLTOS-MFHCWRBVSA-N 1 3 343.515 2.745 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+][C@H](C)c2ccc3c(c2)CCC3)CC1)N(C)C ZINC001375521093 1342830045 /nfs/dbraw/zinc/83/00/45/1342830045.db2.gz LANMAJKNQIGMHA-BEFAXECRSA-N 1 3 343.515 2.815 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]Cc2ccc(CF)cc2)CC1 ZINC001375552447 1342867193 /nfs/dbraw/zinc/86/71/93/1342867193.db2.gz JFRYCWCNMTUBNK-IYBDPMFKSA-N 1 3 347.478 2.767 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1CC[C@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001375571813 1342889084 /nfs/dbraw/zinc/88/90/84/1342889084.db2.gz IZAADKDQLGXBEG-MJGOQNOKSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@@H](C)C[N@H+]1CC[C@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001375571813 1342889088 /nfs/dbraw/zinc/88/90/88/1342889088.db2.gz IZAADKDQLGXBEG-MJGOQNOKSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001375574777 1342893212 /nfs/dbraw/zinc/89/32/12/1342893212.db2.gz DDWUCSQTZDJUQD-UBWPAXIJSA-N 1 3 343.515 2.915 10 0 EFAEHO C[C@@H](F)CC[N@H+](CC1CC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001375595900 1342914010 /nfs/dbraw/zinc/91/40/10/1342914010.db2.gz PWXREYVJUNWGAQ-MRXNPFEDSA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@@H](F)CC[N@@H+](CC1CC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001375595900 1342914012 /nfs/dbraw/zinc/91/40/12/1342914012.db2.gz PWXREYVJUNWGAQ-MRXNPFEDSA-N 1 3 339.499 2.533 10 0 EFAEHO Cc1cc(CN2CC[C@@](C)(NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)c(C)s1 ZINC001375851024 1343094358 /nfs/dbraw/zinc/09/43/58/1343094358.db2.gz RWSNGOODMJXWFK-VQIMIIECSA-N 1 3 349.544 2.787 10 0 EFAEHO Cc1cc(CN2CC[C@@](C)(NC(=O)C[C@H]3CC[N@H+](C)C3)C2)c(C)s1 ZINC001375851024 1343094368 /nfs/dbraw/zinc/09/43/68/1343094368.db2.gz RWSNGOODMJXWFK-VQIMIIECSA-N 1 3 349.544 2.787 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@](C)(C[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001375875468 1343121136 /nfs/dbraw/zinc/12/11/36/1343121136.db2.gz PYWCKERZACGPHO-ICSRJNTNSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CC[C@](C)(C[NH2+]CC2CCC2)C1 ZINC001375888432 1343134884 /nfs/dbraw/zinc/13/48/84/1343134884.db2.gz JTHHSFYXHGDDDM-UYAOXDASSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CC[C@@](C)(C[NH2+]CC2CCC2)C1 ZINC001375888429 1343134944 /nfs/dbraw/zinc/13/49/44/1343134944.db2.gz JTHHSFYXHGDDDM-QUCCMNQESA-N 1 3 335.536 2.878 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@](C)(C[NH2+]CC3CCCC3)C2)CC1 ZINC001375895004 1343141788 /nfs/dbraw/zinc/14/17/88/1343141788.db2.gz RUKPWHYDQWRJDF-HXUWFJFHSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC(C)([NH2+]CCC(C)(C)C)CC1)N(C)C ZINC001393735293 1357113039 /nfs/dbraw/zinc/11/30/39/1357113039.db2.gz MPUJXHONWCPUSZ-MRXNPFEDSA-N 1 3 325.541 2.980 10 0 EFAEHO CN(CC(=O)NC[C@]1(C)CCC[N@H+](Cc2ccsc2)C1)C1CCC1 ZINC001375945936 1343197642 /nfs/dbraw/zinc/19/76/42/1343197642.db2.gz KZTWHLIUWHEONV-IBGZPJMESA-N 1 3 349.544 2.951 10 0 EFAEHO CN(CC(=O)NC[C@]1(C)CCC[N@@H+](Cc2ccsc2)C1)C1CCC1 ZINC001375945936 1343197643 /nfs/dbraw/zinc/19/76/43/1343197643.db2.gz KZTWHLIUWHEONV-IBGZPJMESA-N 1 3 349.544 2.951 10 0 EFAEHO Cc1ncccc1C[NH2+][C@@H](C)[C@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001376007550 1343255408 /nfs/dbraw/zinc/25/54/08/1343255408.db2.gz CDZIACIWKJAYNR-PKOBYXMFSA-N 1 3 346.519 2.589 10 0 EFAEHO Cc1ccc(F)cc1CN1CCC(N(C)C(=O)CC[NH+](C)C)CC1 ZINC001376019780 1343264054 /nfs/dbraw/zinc/26/40/54/1343264054.db2.gz SPDHZDBQQONTNX-UHFFFAOYSA-N 1 3 335.467 2.509 10 0 EFAEHO CCc1ccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001393746299 1357120841 /nfs/dbraw/zinc/12/08/41/1357120841.db2.gz SWRJZNBCSPMRIG-APWZRJJASA-N 1 3 331.504 2.526 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC(C)(NC/C(Cl)=C/Cl)CC1 ZINC001393749411 1357123607 /nfs/dbraw/zinc/12/36/07/1357123607.db2.gz UWRBWVAIUFSTCZ-QBFSEMIESA-N 1 3 336.307 2.618 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC(C)(NC/C(Cl)=C/Cl)CC1 ZINC001393749411 1357123609 /nfs/dbraw/zinc/12/36/09/1357123609.db2.gz UWRBWVAIUFSTCZ-QBFSEMIESA-N 1 3 336.307 2.618 10 0 EFAEHO CC(C)CCC[NH+]1CCC2(C[C@H]2NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001376174801 1343374853 /nfs/dbraw/zinc/37/48/53/1343374853.db2.gz BZYZGXGPXCVMLR-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC12CC[NH+](CC1CC3(CCC3)C1)CC2 ZINC001376180757 1343382329 /nfs/dbraw/zinc/38/23/29/1343382329.db2.gz RICROEKWDVFTJV-SFHVURJKSA-N 1 3 347.547 2.879 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](NCC=C(Cl)Cl)C1CC1 ZINC001376210958 1343401564 /nfs/dbraw/zinc/40/15/64/1343401564.db2.gz BEUAXPLAIGTASX-UONOGXRCSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NC[C@H](NCC=C(Cl)Cl)C1CC1 ZINC001376210958 1343401566 /nfs/dbraw/zinc/40/15/66/1343401566.db2.gz BEUAXPLAIGTASX-UONOGXRCSA-N 1 3 348.318 2.663 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccc(Cl)s1)C1CC1)N(C)C ZINC001376265146 1343438164 /nfs/dbraw/zinc/43/81/64/1343438164.db2.gz VMMJRGITCNCUMP-ZIAGYGMSSA-N 1 3 343.924 2.726 10 0 EFAEHO C[N@H+](CCC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(CCF)C2)C1CCCCC1 ZINC001376304326 1343469870 /nfs/dbraw/zinc/46/98/70/1343469870.db2.gz MIDKDNBAHMPECU-JZXOWHBKSA-N 1 3 339.499 2.580 10 0 EFAEHO C[N@@H+](CCC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(CCF)C2)C1CCCCC1 ZINC001376304326 1343469872 /nfs/dbraw/zinc/46/98/72/1343469872.db2.gz MIDKDNBAHMPECU-JZXOWHBKSA-N 1 3 339.499 2.580 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCC1CCCC1)C2 ZINC001376312481 1343475406 /nfs/dbraw/zinc/47/54/06/1343475406.db2.gz JDSIOCAMPRGNFO-OTWHNJEPSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCC1CCCC1)C2 ZINC001376312481 1343475409 /nfs/dbraw/zinc/47/54/09/1343475409.db2.gz JDSIOCAMPRGNFO-OTWHNJEPSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001376337207 1343493924 /nfs/dbraw/zinc/49/39/24/1343493924.db2.gz BESOKLVIRYFTOS-DOTOQJQBSA-N 1 3 337.533 2.723 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([C@H](C)[NH2+]CC2CC3(CCC3)C2)C1 ZINC001376350671 1343504976 /nfs/dbraw/zinc/50/49/76/1343504976.db2.gz UMCNUGYSGCZMNW-FUHWJXTLSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001376361748 1343514399 /nfs/dbraw/zinc/51/43/99/1343514399.db2.gz LHKGNWIJUVWFNV-FUHWJXTLSA-N 1 3 349.494 2.658 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@@H]2CCc3c2cccc3Cl)C1 ZINC001376405652 1343560876 /nfs/dbraw/zinc/56/08/76/1343560876.db2.gz JOZLGESOASOXMS-HBUWYVDXSA-N 1 3 349.906 2.904 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]2CN(Cc3ccsc3)CC[C@H]21 ZINC001376451092 1343604221 /nfs/dbraw/zinc/60/42/21/1343604221.db2.gz KOXALVNJBIXSEI-IAGOWNOFSA-N 1 3 335.517 2.513 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@H]1C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001376468625 1343614133 /nfs/dbraw/zinc/61/41/33/1343614133.db2.gz DPHLAHRPASZMJE-ZCNNSNEGSA-N 1 3 345.531 2.615 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]C/C=C\c2ccc(Cl)cc2)C1)N(C)C ZINC001376470792 1343615124 /nfs/dbraw/zinc/61/51/24/1343615124.db2.gz VECXUUFQBJCEMO-WMRBKDBDSA-N 1 3 349.906 2.930 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2cccc(Cl)c2)C1 ZINC001376519593 1343645457 /nfs/dbraw/zinc/64/54/57/1343645457.db2.gz YYMUTOYLFZFPDA-XYPHTWIQSA-N 1 3 337.895 2.978 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2C[N@H+](CCC3CC3)C[C@H]21)N(CC)CC ZINC001376531172 1343656291 /nfs/dbraw/zinc/65/62/91/1343656291.db2.gz NTHWQPFOVHFZBN-IPMKNSEASA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2C[N@@H+](CCC3CC3)C[C@H]21)N(CC)CC ZINC001376531172 1343656292 /nfs/dbraw/zinc/65/62/92/1343656292.db2.gz NTHWQPFOVHFZBN-IPMKNSEASA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@H](C)C[N@@H+]1CCC[C@@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001376537315 1343663236 /nfs/dbraw/zinc/66/32/36/1343663236.db2.gz FVASSAFWSXKFLT-IRXDYDNUSA-N 1 3 325.541 2.839 10 0 EFAEHO CC[C@H](C)C[N@H+]1CCC[C@@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001376537315 1343663237 /nfs/dbraw/zinc/66/32/37/1343663237.db2.gz FVASSAFWSXKFLT-IRXDYDNUSA-N 1 3 325.541 2.839 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[NH2+]CC2CCC(C)CC2)C1 ZINC001376554800 1343672045 /nfs/dbraw/zinc/67/20/45/1343672045.db2.gz FPRUQGKGXYSJQW-CTWPCTMYSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)C[N@H+](C)Cc1ccccc1CNC(=O)C1(N(C)C)CCC1 ZINC001376561441 1343677270 /nfs/dbraw/zinc/67/72/70/1343677270.db2.gz LEUYFNBDCNARAC-UHFFFAOYSA-N 1 3 331.504 2.875 10 0 EFAEHO CC(C)C[N@@H+](C)Cc1ccccc1CNC(=O)C1(N(C)C)CCC1 ZINC001376561441 1343677271 /nfs/dbraw/zinc/67/72/71/1343677271.db2.gz LEUYFNBDCNARAC-UHFFFAOYSA-N 1 3 331.504 2.875 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[NH2+]Cc1ccccc1F ZINC001376615697 1343722707 /nfs/dbraw/zinc/72/27/07/1343722707.db2.gz PLIUGJKCWPWIQA-KRWDZBQOSA-N 1 3 335.467 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](Cc1ccc(C)cc1)CC2 ZINC001376628629 1343734727 /nfs/dbraw/zinc/73/47/27/1343734727.db2.gz WBWFUZQOTIDLCR-UHFFFAOYSA-N 1 3 343.515 2.761 10 0 EFAEHO CCC(CC)C[N@@H+]1CCC[C@@H]([C@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001376629413 1343735594 /nfs/dbraw/zinc/73/55/94/1343735594.db2.gz SAMDNNWGYIRXRU-FUHWJXTLSA-N 1 3 325.541 2.980 10 0 EFAEHO CCC(CC)C[N@H+]1CCC[C@@H]([C@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001376629413 1343735596 /nfs/dbraw/zinc/73/55/96/1343735596.db2.gz SAMDNNWGYIRXRU-FUHWJXTLSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]Cc2ccc(F)cc2)CC1)N(C)C ZINC001376661034 1343749174 /nfs/dbraw/zinc/74/91/74/1343749174.db2.gz FFZZCYSHDZKBEH-DAWZGUTISA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)CC[N@H+]1CCC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001376898099 1343936979 /nfs/dbraw/zinc/93/69/79/1343936979.db2.gz BCLMLUBVZBVKPN-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)CC[N@@H+]1CCC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001376898099 1343936976 /nfs/dbraw/zinc/93/69/76/1343936976.db2.gz BCLMLUBVZBVKPN-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001376909308 1343947981 /nfs/dbraw/zinc/94/79/81/1343947981.db2.gz GYENABWJYXFDTM-QZTJIDSGSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CCC[N@H+]1CCC[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001376909308 1343947982 /nfs/dbraw/zinc/94/79/82/1343947982.db2.gz GYENABWJYXFDTM-QZTJIDSGSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)(C(=O)N1CC[C@H](CNC/C(Cl)=C\Cl)C1)[NH+]1CCCC1 ZINC001376941698 1343972420 /nfs/dbraw/zinc/97/24/20/1343972420.db2.gz OHKOMGOZTAYFFF-OZYJXZHSSA-N 1 3 348.318 2.618 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CCC[C@@H]([NH2+]CCC(F)(F)F)C1)N1CCCC1 ZINC001376977708 1344008525 /nfs/dbraw/zinc/00/85/25/1344008525.db2.gz SCSNIADCYCUBCM-KGLIPLIRSA-N 1 3 349.441 2.830 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1cc2ccccc2o1)N(C)C ZINC001377051382 1344096502 /nfs/dbraw/zinc/09/65/02/1344096502.db2.gz PHJFGLFEIRIFFP-WMLDXEAASA-N 1 3 331.460 2.757 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001377067592 1344112056 /nfs/dbraw/zinc/11/20/56/1344112056.db2.gz ORLRTJAMUXEAGZ-DLBZAZTESA-N 1 3 343.515 2.890 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@@H](C)C2)c(C)s1 ZINC001377070827 1344114731 /nfs/dbraw/zinc/11/47/31/1344114731.db2.gz WLLMYLGHITVBEN-KGLIPLIRSA-N 1 3 337.533 2.691 10 0 EFAEHO CCC1([NH2+]C/C=C/Cl)CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001377112960 1344137416 /nfs/dbraw/zinc/13/74/16/1344137416.db2.gz CDWHTFKWKQTHFA-IZZDOVSWSA-N 1 3 327.900 2.584 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C ZINC001377273436 1344146139 /nfs/dbraw/zinc/14/61/39/1344146139.db2.gz MQDCBNSOFWAPHC-HDICACEKSA-N 1 3 331.504 2.724 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001377273436 1344146142 /nfs/dbraw/zinc/14/61/42/1344146142.db2.gz MQDCBNSOFWAPHC-HDICACEKSA-N 1 3 331.504 2.724 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@@H+]1CCC1CC1)N1CCCCC1 ZINC001377419553 1344161284 /nfs/dbraw/zinc/16/12/84/1344161284.db2.gz UEHBOOVXDQXVEV-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@H+]1CCC1CC1)N1CCCCC1 ZINC001377419553 1344161288 /nfs/dbraw/zinc/16/12/88/1344161288.db2.gz UEHBOOVXDQXVEV-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)C[N@H+](C)C[C@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001377664242 1344289023 /nfs/dbraw/zinc/28/90/23/1344289023.db2.gz RCERXZXPPWXSKL-VQIMIIECSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)C[N@@H+](C)C[C@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001377664242 1344289025 /nfs/dbraw/zinc/28/90/25/1344289025.db2.gz RCERXZXPPWXSKL-VQIMIIECSA-N 1 3 341.515 2.778 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@H]1CC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC001377726753 1344376165 /nfs/dbraw/zinc/37/61/65/1344376165.db2.gz XGVHHIDAGOFMQO-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@H]1CC[N@@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC001377726753 1344376170 /nfs/dbraw/zinc/37/61/70/1344376170.db2.gz XGVHHIDAGOFMQO-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[C@@H]([NH2+]CC1CC(NC(=O)Cc2nc[nH]c2C)C1)c1ccccc1 ZINC001377729479 1344379204 /nfs/dbraw/zinc/37/92/04/1344379204.db2.gz FNRDXAOKNOLNQY-VMWRSERWSA-N 1 3 340.471 2.896 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@@H](C)c2ccccc2F)C1 ZINC001377737783 1344386304 /nfs/dbraw/zinc/38/63/04/1344386304.db2.gz XLFFOOBWZZSGND-FHERZECASA-N 1 3 335.467 2.713 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001377804385 1344455211 /nfs/dbraw/zinc/45/52/11/1344455211.db2.gz HISXPXNPXCVYRJ-ZIAGYGMSSA-N 1 3 337.895 2.807 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(Cl)cc1)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001377804375 1344455377 /nfs/dbraw/zinc/45/53/77/1344455377.db2.gz HISXPXNPXCVYRJ-KGLIPLIRSA-N 1 3 337.895 2.807 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](C)[C@@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001377824668 1344481215 /nfs/dbraw/zinc/48/12/15/1344481215.db2.gz MPWNZDARTVCLLT-HZPDHXFCSA-N 1 3 331.504 2.716 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc2cc[nH]c2c1)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001377830659 1344487981 /nfs/dbraw/zinc/48/79/81/1344487981.db2.gz UCUGUYSIAQSSNB-CABCVRRESA-N 1 3 342.487 2.635 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)[C@H](C)NC(=O)CCC[NH+](C)C ZINC001377836697 1344492234 /nfs/dbraw/zinc/49/22/34/1344492234.db2.gz FWJIUQOCBVVDTH-GJZGRUSLSA-N 1 3 339.911 2.973 10 0 EFAEHO C[C@@H](NC(=O)CN(C)CC(C)(C)C)[C@@H](C)[NH2+]CCc1ccccc1 ZINC001377849316 1344506510 /nfs/dbraw/zinc/50/65/10/1344506510.db2.gz HIKAKKDXUOASMT-IAGOWNOFSA-N 1 3 333.520 2.690 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)[C@@H](C)NC(=O)C12CC[NH+](CC1)C2 ZINC001377888408 1344549309 /nfs/dbraw/zinc/54/93/09/1344549309.db2.gz YNLJSPSIFYYIJZ-HUUCEWRRSA-N 1 3 349.906 2.727 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]Cc1cccc(OC)c1 ZINC001393831008 1357194570 /nfs/dbraw/zinc/19/45/70/1357194570.db2.gz RDAJPEKCSITNHE-QFBILLFUSA-N 1 3 347.503 2.554 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)C[N@H+]3[C@H](C)CC[C@@H]3C)C2)cc1C ZINC001378019943 1344669959 /nfs/dbraw/zinc/66/99/59/1344669959.db2.gz HQTQFDMAORQSKO-HDICACEKSA-N 1 3 343.515 2.724 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)C[N@@H+]3[C@H](C)CC[C@@H]3C)C2)cc1C ZINC001378019943 1344669962 /nfs/dbraw/zinc/66/99/62/1344669962.db2.gz HQTQFDMAORQSKO-HDICACEKSA-N 1 3 343.515 2.724 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)C[NH+]3[C@H](C)CC[C@H]3C)C2)cc1C ZINC001378019945 1344670424 /nfs/dbraw/zinc/67/04/24/1344670424.db2.gz HQTQFDMAORQSKO-QZTJIDSGSA-N 1 3 343.515 2.724 10 0 EFAEHO CCc1ccc(C[N@H+](C)[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001378148562 1344813115 /nfs/dbraw/zinc/81/31/15/1344813115.db2.gz VSHDGVLRSAXYRH-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(C[N@@H+](C)[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001378148562 1344813119 /nfs/dbraw/zinc/81/31/19/1344813119.db2.gz VSHDGVLRSAXYRH-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)N(C)Cc1ccccc1C1CC1 ZINC001378181215 1344852787 /nfs/dbraw/zinc/85/27/87/1344852787.db2.gz GANIKYZDDRRPPN-IAGOWNOFSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)N(C)Cc1ccccc1C1CC1 ZINC001378181215 1344852791 /nfs/dbraw/zinc/85/27/91/1344852791.db2.gz GANIKYZDDRRPPN-IAGOWNOFSA-N 1 3 343.515 2.842 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@@H]1CC[N@H+](Cc2cccc(C)c2)C1 ZINC001378185338 1344859644 /nfs/dbraw/zinc/85/96/44/1344859644.db2.gz BFIQPXNRQWLAPY-AZUAARDMSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@@H]1CC[N@@H+](Cc2cccc(C)c2)C1 ZINC001378185338 1344859646 /nfs/dbraw/zinc/85/96/46/1344859646.db2.gz BFIQPXNRQWLAPY-AZUAARDMSA-N 1 3 343.515 2.760 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)Cc1cccc(C(F)F)c1 ZINC001378246427 1344927770 /nfs/dbraw/zinc/92/77/70/1344927770.db2.gz ZKTMPOPHWDJUHD-AWEZNQCLSA-N 1 3 341.446 2.901 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC001378246427 1344927773 /nfs/dbraw/zinc/92/77/73/1344927773.db2.gz ZKTMPOPHWDJUHD-AWEZNQCLSA-N 1 3 341.446 2.901 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)[C@H]1CCCN1C)[NH2+]Cc1ccsc1 ZINC001378380958 1345026914 /nfs/dbraw/zinc/02/69/14/1345026914.db2.gz MTPFCPZSFCADDR-IAGOWNOFSA-N 1 3 337.533 2.805 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H]2CCCCN2C(=O)CCC[NH+](C)C)c1 ZINC001393859969 1357219251 /nfs/dbraw/zinc/21/92/51/1357219251.db2.gz MNHBOKXMHAHINV-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H]2CCCCN2C(=O)CN(C)C(C)C)cs1 ZINC001393859555 1357219410 /nfs/dbraw/zinc/21/94/10/1357219410.db2.gz DIMWCGKGNBREHI-KRWDZBQOSA-N 1 3 337.533 2.867 10 0 EFAEHO C[C@@H](NC[C@](C)(NC(=O)CC[NH+](C)C)C1CC1)c1ccccc1F ZINC001378416434 1345058850 /nfs/dbraw/zinc/05/88/50/1345058850.db2.gz TYHLQZNXCUNRMQ-KUHUBIRLSA-N 1 3 335.467 2.713 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[C@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC001378457143 1345092561 /nfs/dbraw/zinc/09/25/61/1345092561.db2.gz VNXLJSPZPRNYJA-BZUAXINKSA-N 1 3 345.478 2.781 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001378518551 1345137236 /nfs/dbraw/zinc/13/72/36/1345137236.db2.gz OQBVVPLMZXXETF-LJQANCHMSA-N 1 3 331.504 2.670 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)c(C)c1 ZINC001378521008 1345138242 /nfs/dbraw/zinc/13/82/42/1345138242.db2.gz AAHGGMISVSLUJU-LJQANCHMSA-N 1 3 331.504 2.724 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)C1C[NH+]([C@@H]2CCc3ccccc32)C1 ZINC001378530537 1345143783 /nfs/dbraw/zinc/14/37/83/1345143783.db2.gz MDVZQDSFILZSOI-DNVCBOLYSA-N 1 3 341.499 2.595 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)C[NH2+]CC1CC2(CCC2)C1 ZINC001378556958 1345161237 /nfs/dbraw/zinc/16/12/37/1345161237.db2.gz FKRROHBBQMXYCK-AEFFLSMTSA-N 1 3 335.536 2.783 10 0 EFAEHO C[C@@H](NC(=O)CC[NH+](C)C)C1CN(Cc2cc3ccccc3s2)C1 ZINC001378561787 1345163730 /nfs/dbraw/zinc/16/37/30/1345163730.db2.gz RKKPCRSNRGRVAO-CQSZACIVSA-N 1 3 345.512 2.790 10 0 EFAEHO C[C@H](NC(=O)CC[NH+](C)C)C1CN(Cc2cc3ccccc3s2)C1 ZINC001378561778 1345163797 /nfs/dbraw/zinc/16/37/97/1345163797.db2.gz RKKPCRSNRGRVAO-AWEZNQCLSA-N 1 3 345.512 2.790 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C1C[NH+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001378579505 1345176058 /nfs/dbraw/zinc/17/60/58/1345176058.db2.gz DYPXWONHUMJLOZ-YJBOKZPZSA-N 1 3 335.536 2.589 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH+]1CC([C@@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001378582330 1345178001 /nfs/dbraw/zinc/17/80/01/1345178001.db2.gz DPPQQEUDCORTBJ-SJORKVTESA-N 1 3 331.504 2.833 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H](C)C[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001378797853 1345321342 /nfs/dbraw/zinc/32/13/42/1345321342.db2.gz YTMCEOCHDHHBON-WMZOPIPTSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C(=O)[C@H]1CCCN1C ZINC001378804111 1345326943 /nfs/dbraw/zinc/32/69/43/1345326943.db2.gz NVNSVYCLLHEXJH-DNVCBOLYSA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1ccc(CNC[C@H](C)N(C)C(=O)CC[NH+](C)C)c(Cl)c1 ZINC001378806655 1345329121 /nfs/dbraw/zinc/32/91/21/1345329121.db2.gz FURXEEBVBSJDSF-AWEZNQCLSA-N 1 3 325.884 2.537 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001378835873 1345350437 /nfs/dbraw/zinc/35/04/37/1345350437.db2.gz XVEMYDZDKRXRKY-QTTSWBFFSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001378835873 1345350441 /nfs/dbraw/zinc/35/04/41/1345350441.db2.gz XVEMYDZDKRXRKY-QTTSWBFFSA-N 1 3 348.318 2.664 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cccc(Cl)c1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001378837725 1345351169 /nfs/dbraw/zinc/35/11/69/1345351169.db2.gz XJKDTHLTGHXICX-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)N(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001378839999 1345352908 /nfs/dbraw/zinc/35/29/08/1345352908.db2.gz GSXBEFDJDSPYDC-CHWSQXEVSA-N 1 3 343.924 2.680 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)N(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001378839999 1345352913 /nfs/dbraw/zinc/35/29/13/1345352913.db2.gz GSXBEFDJDSPYDC-CHWSQXEVSA-N 1 3 343.924 2.680 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C[NH2+]CC1CC1)C1CCCCC1 ZINC001378884833 1345394482 /nfs/dbraw/zinc/39/44/82/1345394482.db2.gz LMPXCLGMCBSEMD-OALUTQOASA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N[C@H]1C[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001378890274 1345400788 /nfs/dbraw/zinc/40/07/88/1345400788.db2.gz HMWIHHYJZHEFAU-GFTMLOHNSA-N 1 3 348.318 2.663 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N[C@H]1C[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001378890274 1345400790 /nfs/dbraw/zinc/40/07/90/1345400790.db2.gz HMWIHHYJZHEFAU-GFTMLOHNSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccccc2F)C1 ZINC001378892428 1345402035 /nfs/dbraw/zinc/40/20/35/1345402035.db2.gz QRVFGBMDRJISBY-JYJNAYRXSA-N 1 3 335.467 2.711 10 0 EFAEHO CCC(CC)C[NH2+]C[C@H]1[C@@H](C)CCCN1C(=O)CN(C)C(C)C ZINC001378929607 1345435608 /nfs/dbraw/zinc/43/56/08/1345435608.db2.gz UUTAISFNFVWHHJ-WMZOPIPTSA-N 1 3 325.541 2.980 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](NCc1ccccc1F)C(C)C ZINC001378962941 1345462130 /nfs/dbraw/zinc/46/21/30/1345462130.db2.gz OMMKIALZTMAQHA-RBUKOAKNSA-N 1 3 349.494 2.931 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](NCc1ccccc1F)C(C)C ZINC001378962941 1345462132 /nfs/dbraw/zinc/46/21/32/1345462132.db2.gz OMMKIALZTMAQHA-RBUKOAKNSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C[NH2+]Cc1cc(C)ccc1C)C1CC1)N(C)C ZINC001379017794 1345499438 /nfs/dbraw/zinc/49/94/38/1345499438.db2.gz HIHNWYGIYAOCLV-WOJBJXKFSA-N 1 3 345.531 2.970 10 0 EFAEHO CN(CC(=O)N(C)[C@H](C[NH2+]CC1CCCC1)C1CC1)CC(C)(C)C ZINC001379039288 1345521231 /nfs/dbraw/zinc/52/12/31/1345521231.db2.gz XVMYEUJIYVLUQN-GOSISDBHSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@@H]2C[NH+]3CCC2CC3)cc1C ZINC001379039781 1345522577 /nfs/dbraw/zinc/52/25/77/1345522577.db2.gz ISJFBTCOXMRXMP-HXUWFJFHSA-N 1 3 343.515 2.535 10 0 EFAEHO CN(CC(=O)N(C)CC[N@H+](C)C[C@@H]1CC[C@H]2C[C@H]2C1)CC(C)(C)C ZINC001379100807 1345577685 /nfs/dbraw/zinc/57/76/85/1345577685.db2.gz TZVMVKZGONWNQI-FGTMMUONSA-N 1 3 337.552 2.791 10 0 EFAEHO CN(CC(=O)N(C)CC[N@@H+](C)C[C@@H]1CC[C@H]2C[C@H]2C1)CC(C)(C)C ZINC001379100807 1345577689 /nfs/dbraw/zinc/57/76/89/1345577689.db2.gz TZVMVKZGONWNQI-FGTMMUONSA-N 1 3 337.552 2.791 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001379128065 1345606428 /nfs/dbraw/zinc/60/64/28/1345606428.db2.gz SSXCKMMYLVXQTM-HOTGVXAUSA-N 1 3 335.467 2.619 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001379128065 1345606430 /nfs/dbraw/zinc/60/64/30/1345606430.db2.gz SSXCKMMYLVXQTM-HOTGVXAUSA-N 1 3 335.467 2.619 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@@H](C)CN(C)C(=O)CN(C)C(C)C)c1 ZINC001379323210 1345726126 /nfs/dbraw/zinc/72/61/26/1345726126.db2.gz CGPBBTNTCRKCPT-HOTGVXAUSA-N 1 3 335.492 2.533 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]CCc1cccs1 ZINC001379326375 1345729520 /nfs/dbraw/zinc/72/95/20/1345729520.db2.gz IJNHXMYQNFIERZ-NVXWUHKLSA-N 1 3 337.533 2.602 10 0 EFAEHO Cc1ccc(CN[C@@H]2CCN(C(=O)CC[NH+](C)C)[C@@H]2C)c(Cl)c1 ZINC001379561485 1345863915 /nfs/dbraw/zinc/86/39/15/1345863915.db2.gz ZMMIQNIIDZDGDR-RHSMWYFYSA-N 1 3 337.895 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc3c(c2)CCC3)C[C@@H]1C ZINC001379589738 1345898142 /nfs/dbraw/zinc/89/81/42/1345898142.db2.gz UACCQBJMPRPEQE-JXFKEZNVSA-N 1 3 343.515 2.595 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)C3(N(C)C)CCC3)C2)cc1F ZINC001393899350 1357269465 /nfs/dbraw/zinc/26/94/65/1357269465.db2.gz OZBYXDWPKGCRHS-UHFFFAOYSA-N 1 3 347.478 2.603 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CCC3CC3)[C@@H]2C1)CC(C)(C)C ZINC001379634029 1345954797 /nfs/dbraw/zinc/95/47/97/1345954797.db2.gz YVZWHIUCEQPKKX-OTWHNJEPSA-N 1 3 349.563 2.981 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CCC3CC3)[C@@H]2C1)CC(C)(C)C ZINC001379634027 1345954940 /nfs/dbraw/zinc/95/49/40/1345954940.db2.gz YVZWHIUCEQPKKX-IPMKNSEASA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)[C@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001393955608 1357320204 /nfs/dbraw/zinc/32/02/04/1357320204.db2.gz HHZORCBUOVCODZ-GJZGRUSLSA-N 1 3 335.467 2.683 10 0 EFAEHO C[C@H](NCc1cc2ccccc2o1)[C@H](C)NC(=O)CCC[NH+](C)C ZINC001393960824 1357326288 /nfs/dbraw/zinc/32/62/88/1357326288.db2.gz GPUREFVIYZHPGY-GJZGRUSLSA-N 1 3 331.460 2.757 10 0 EFAEHO COc1cccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)c1 ZINC001393962324 1357328431 /nfs/dbraw/zinc/32/84/31/1357328431.db2.gz RXLVPUJPBFPJKO-HOTGVXAUSA-N 1 3 347.503 2.552 10 0 EFAEHO Cc1cc(CN2CCC[C@@H](NC(=O)CC[NH+](C)C)[C@H]2C)c(C)s1 ZINC001379670990 1347246606 /nfs/dbraw/zinc/24/66/06/1347246606.db2.gz VBHDQLQBOOUNIX-RHSMWYFYSA-N 1 3 337.533 2.786 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(OC)c1 ZINC001379695400 1347265553 /nfs/dbraw/zinc/26/55/53/1347265553.db2.gz ZYNBBWYZWLXGGX-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(OC)c1 ZINC001379695400 1347265554 /nfs/dbraw/zinc/26/55/54/1347265554.db2.gz ZYNBBWYZWLXGGX-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(OC)c1 ZINC001379695398 1347265583 /nfs/dbraw/zinc/26/55/83/1347265583.db2.gz ZYNBBWYZWLXGGX-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(OC)c1 ZINC001379695398 1347265584 /nfs/dbraw/zinc/26/55/84/1347265584.db2.gz ZYNBBWYZWLXGGX-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO CN(CC(=O)N1C[C@@H]([NH2+]C/C=C\Cl)C(C)(C)C1)CC(C)(C)C ZINC001379720753 1347284795 /nfs/dbraw/zinc/28/47/95/1347284795.db2.gz VXUFXQPNTUVVED-WBTMPAOCSA-N 1 3 329.916 2.543 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)cc1 ZINC001379728919 1347291184 /nfs/dbraw/zinc/29/11/84/1347291184.db2.gz QUFHQAXFTLHFHD-IBGZPJMESA-N 1 3 345.531 2.704 10 0 EFAEHO CCc1cccc(CN(C)C[C@H](C)NC(=O)C[C@H]2CC[N@H+](C)C2)c1 ZINC001379765104 1347317904 /nfs/dbraw/zinc/31/79/04/1347317904.db2.gz MPOONZHLTIUCOZ-QFBILLFUSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(CN(C)C[C@H](C)NC(=O)C[C@H]2CC[N@@H+](C)C2)c1 ZINC001379765104 1347317910 /nfs/dbraw/zinc/31/79/10/1347317910.db2.gz MPOONZHLTIUCOZ-QFBILLFUSA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@@H+]1CC1CC(C)(C)C1)N1CCCCC1 ZINC001379976661 1347431455 /nfs/dbraw/zinc/43/14/55/1347431455.db2.gz WNNSATKHMDJNJP-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@H+]1CC1CC(C)(C)C1)N1CCCCC1 ZINC001379976661 1347431456 /nfs/dbraw/zinc/43/14/56/1347431456.db2.gz WNNSATKHMDJNJP-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1cccc(C[N@@H+](C)CCN(C(=O)CN2CCCC2)C(C)C)c1 ZINC001380043668 1347482250 /nfs/dbraw/zinc/48/22/50/1347482250.db2.gz XKFGWQBTTRYTPF-UHFFFAOYSA-N 1 3 331.504 2.760 10 0 EFAEHO Cc1cccc(C[N@H+](C)CCN(C(=O)CN2CCCC2)C(C)C)c1 ZINC001380043668 1347482252 /nfs/dbraw/zinc/48/22/52/1347482252.db2.gz XKFGWQBTTRYTPF-UHFFFAOYSA-N 1 3 331.504 2.760 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C[NH2+]C[C@@H]1CCC(F)(F)C1)C(C)(C)C ZINC001380092174 1347512029 /nfs/dbraw/zinc/51/20/29/1347512029.db2.gz YHYRWRIAALBATN-CABCVRRESA-N 1 3 347.494 2.884 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+][C@@H](C)c2ccc(Cl)cc2)CC1)N(C)C ZINC001380099667 1347514667 /nfs/dbraw/zinc/51/46/67/1347514667.db2.gz GSFXDXVJTSZETM-XJKSGUPXSA-N 1 3 337.895 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C1CC[NH+](CC2CC(C)C2)CC1)N(C)C ZINC001380121048 1347522228 /nfs/dbraw/zinc/52/22/28/1347522228.db2.gz DHNYUJZEPBRVQD-AFNJWWOFSA-N 1 3 337.552 2.835 10 0 EFAEHO CC[C@@H](F)CN1CCC([C@H](C)NC(=O)CC[NH+]2CCCCC2)CC1 ZINC001380145806 1347533677 /nfs/dbraw/zinc/53/36/77/1347533677.db2.gz JSMQPICWSACXMF-FUHWJXTLSA-N 1 3 341.515 2.827 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NCC1(N[C@@H]2CCc3ccc(F)cc32)CC1 ZINC001380158844 1347539889 /nfs/dbraw/zinc/53/98/89/1347539889.db2.gz DHQGXJRSFOTNQN-GOSISDBHSA-N 1 3 347.478 2.783 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NCC1(N[C@@H]2CCc3ccc(F)cc32)CC1 ZINC001380158844 1347539890 /nfs/dbraw/zinc/53/98/90/1347539890.db2.gz DHQGXJRSFOTNQN-GOSISDBHSA-N 1 3 347.478 2.783 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C1CC([NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001380179706 1347553068 /nfs/dbraw/zinc/55/30/68/1347553068.db2.gz WNFYKWNNDSDBGK-DAWZGUTISA-N 1 3 335.536 2.732 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)cc1F ZINC001380275345 1347564590 /nfs/dbraw/zinc/56/45/90/1347564590.db2.gz XNYMEMMIEDTRAL-SJLPKXTDSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001380293141 1347572489 /nfs/dbraw/zinc/57/24/89/1347572489.db2.gz WJZORXRMMUQOFI-HKUYNNGSSA-N 1 3 347.478 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]CC1CCC(F)(F)CC1 ZINC001380293367 1347572787 /nfs/dbraw/zinc/57/27/87/1347572787.db2.gz XRZMQZCUYFCUDP-MRXNPFEDSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](C(=O)NC1(C)CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001380294968 1347573535 /nfs/dbraw/zinc/57/35/35/1347573535.db2.gz QTCAVBVMPAZBKW-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1ccc(F)cc1CN1CCC(C)(NC(=O)CC[NH+](C)C)CC1 ZINC001380307504 1347581451 /nfs/dbraw/zinc/58/14/51/1347581451.db2.gz PKHBLUOQFPCWFY-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]Cc1cccc(Cl)c1 ZINC001419762208 1375832599 /nfs/dbraw/zinc/83/25/99/1375832599.db2.gz IWPBUBXBCLKNFT-CQSZACIVSA-N 1 3 325.884 2.617 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2ccsc2)C1)N(C)C ZINC001380407532 1347651608 /nfs/dbraw/zinc/65/16/08/1347651608.db2.gz NVZDGWJNMORFKS-WMZOPIPTSA-N 1 3 337.533 2.663 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@@]1(C)CCN(C(=O)[C@@H](CC)N(C)C)C1 ZINC001380410089 1347653286 /nfs/dbraw/zinc/65/32/86/1347653286.db2.gz UCDXYLIXMROCAB-TZIWHRDSSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1(C)CC[NH+](C[C@@H](F)CC)CC1 ZINC001380437674 1347671090 /nfs/dbraw/zinc/67/10/90/1347671090.db2.gz CWHSFKQSQOIUPE-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC2(C)CC[NH+](Cc3ccsc3)CC2)C1 ZINC001380447772 1347677708 /nfs/dbraw/zinc/67/77/08/1347677708.db2.gz ISHKNXCUCSCTCD-MRXNPFEDSA-N 1 3 349.544 2.808 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1C[N@H+](CC2CCCC2)CCC1(F)F)N(C)C ZINC001380515029 1347735404 /nfs/dbraw/zinc/73/54/04/1347735404.db2.gz DXSUKYMEWGDMPR-HZPDHXFCSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1C[N@@H+](CC2CCCC2)CCC1(F)F)N(C)C ZINC001380515029 1347735407 /nfs/dbraw/zinc/73/54/07/1347735407.db2.gz DXSUKYMEWGDMPR-HZPDHXFCSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)[C@@H](C)NCc1ccccc1Cl ZINC001393999955 1357370781 /nfs/dbraw/zinc/37/07/81/1357370781.db2.gz RWQXQSXABVEGOB-ZIAGYGMSSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)[C@@H](C)NCc1ccccc1Cl ZINC001393999955 1357370787 /nfs/dbraw/zinc/37/07/87/1357370787.db2.gz RWQXQSXABVEGOB-ZIAGYGMSSA-N 1 3 325.884 2.665 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CCCCC1)C2 ZINC001380663090 1347797741 /nfs/dbraw/zinc/79/77/41/1347797741.db2.gz ZPSBADMKBPANHO-OTWHNJEPSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CC1CCCCC1)C2 ZINC001380663090 1347797748 /nfs/dbraw/zinc/79/77/48/1347797748.db2.gz ZPSBADMKBPANHO-OTWHNJEPSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@H](C)C1)C2 ZINC001380678862 1347807611 /nfs/dbraw/zinc/80/76/11/1347807611.db2.gz HKJPKWUKEPKFBV-OKYOBFRVSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@H](C)C1)C2 ZINC001380678862 1347807617 /nfs/dbraw/zinc/80/76/17/1347807617.db2.gz HKJPKWUKEPKFBV-OKYOBFRVSA-N 1 3 335.536 2.734 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001380687451 1347814507 /nfs/dbraw/zinc/81/45/07/1347814507.db2.gz LRMAUCGCPPYRPB-PXNSSMCTSA-N 1 3 345.531 2.773 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CCCF)N1CCCC1 ZINC001380692826 1347817352 /nfs/dbraw/zinc/81/73/52/1347817352.db2.gz QJZDGGNKEYKZQO-BJWYYQGGSA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCF)N1CCCC1 ZINC001380692826 1347817355 /nfs/dbraw/zinc/81/73/55/1347817355.db2.gz QJZDGGNKEYKZQO-BJWYYQGGSA-N 1 3 339.499 2.580 10 0 EFAEHO CC[C@@H](C(=O)N1CC2(C1)CC[NH+](C[C@H](C)CC(C)C)CC2)N(C)C ZINC001380801757 1347887722 /nfs/dbraw/zinc/88/77/22/1347887722.db2.gz BSPODLNSYGKLMQ-MSOLQXFVSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@@H](C(=O)N1CC2(C1)CC[NH+](C[C@@H](C)CC(C)C)CC2)N(C)C ZINC001380801761 1347888216 /nfs/dbraw/zinc/88/82/16/1347888216.db2.gz BSPODLNSYGKLMQ-ROUUACIJSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@@H](C)C[N@H+]1CCC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001380934338 1347966953 /nfs/dbraw/zinc/96/69/53/1347966953.db2.gz OXGBSBJIWRWPJS-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1CCC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001380934338 1347966950 /nfs/dbraw/zinc/96/69/50/1347966950.db2.gz OXGBSBJIWRWPJS-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO CN(CCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)C(=O)[C@H]1CCCN1C ZINC001380948263 1347977652 /nfs/dbraw/zinc/97/76/52/1347977652.db2.gz KDKKLHNFZGZYRU-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)C(=O)[C@H]1CCCN1C ZINC001380948263 1347977655 /nfs/dbraw/zinc/97/76/55/1347977655.db2.gz KDKKLHNFZGZYRU-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)C(=O)[C@@H]1CCCN1C ZINC001380948259 1347977755 /nfs/dbraw/zinc/97/77/55/1347977755.db2.gz KDKKLHNFZGZYRU-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)C(=O)[C@@H]1CCCN1C ZINC001380948259 1347977758 /nfs/dbraw/zinc/97/77/58/1347977758.db2.gz KDKKLHNFZGZYRU-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCC[N@H+](C)[C@H]1CCc2c1cccc2F)C(=O)CN1CCCC1 ZINC001380978868 1348000097 /nfs/dbraw/zinc/00/00/97/1348000097.db2.gz GTQHVRYVMPLJMV-IBGZPJMESA-N 1 3 347.478 2.689 10 0 EFAEHO CN(CCC[N@@H+](C)[C@H]1CCc2c1cccc2F)C(=O)CN1CCCC1 ZINC001380978868 1348000099 /nfs/dbraw/zinc/00/00/99/1348000099.db2.gz GTQHVRYVMPLJMV-IBGZPJMESA-N 1 3 347.478 2.689 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@H+](C)Cc1ccc(F)c(F)c1 ZINC001380990273 1348009468 /nfs/dbraw/zinc/00/94/68/1348009468.db2.gz ROLXLAGQVHUWBL-UHFFFAOYSA-N 1 3 341.446 2.585 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)Cc1ccc(F)c(F)c1 ZINC001380990273 1348009469 /nfs/dbraw/zinc/00/94/69/1348009469.db2.gz ROLXLAGQVHUWBL-UHFFFAOYSA-N 1 3 341.446 2.585 10 0 EFAEHO CCC1([NH2+]CC=C(Cl)Cl)CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001381013615 1348018265 /nfs/dbraw/zinc/01/82/65/1348018265.db2.gz VPIGGGXULBWOQV-CYBMUJFWSA-N 1 3 348.318 2.760 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(CC)([NH2+]CC[C@@H](C)F)CC1 ZINC001381023545 1348025023 /nfs/dbraw/zinc/02/50/23/1348025023.db2.gz SSDRZZSNEABFHV-SJORKVTESA-N 1 3 341.515 2.970 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]C[C@@H](C)CC(C)C)CC1 ZINC001381129369 1348097185 /nfs/dbraw/zinc/09/71/85/1348097185.db2.gz LOENPPVAELXTBW-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+][C@@H]1CCc2ccc(F)cc21)N(C)C ZINC001381197435 1348134971 /nfs/dbraw/zinc/13/49/71/1348134971.db2.gz YAMDCNDVNMHCGY-MORSLUCNSA-N 1 3 335.467 2.638 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001381213397 1348144065 /nfs/dbraw/zinc/14/40/65/1348144065.db2.gz HCMNECIOJHFLJF-IRXDYDNUSA-N 1 3 331.504 2.575 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@H](C)[NH2+]C[C@@H]1CCc2ccccc2C1)N(C)C ZINC001381214485 1348144449 /nfs/dbraw/zinc/14/44/49/1348144449.db2.gz PTDXZOMOVIWETB-QKLQHJQFSA-N 1 3 345.531 2.616 10 0 EFAEHO CC[C@H](F)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1CCCC[N@@H+]1C ZINC001381277634 1348181543 /nfs/dbraw/zinc/18/15/43/1348181543.db2.gz URGZWRSNFWNQPV-WZGPROSRSA-N 1 3 347.478 2.591 10 0 EFAEHO CC[C@H](F)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1CCCC[N@H+]1C ZINC001381277634 1348181545 /nfs/dbraw/zinc/18/15/45/1348181545.db2.gz URGZWRSNFWNQPV-WZGPROSRSA-N 1 3 347.478 2.591 10 0 EFAEHO C[C@@H]([NH2+]CC1CC(NC(=O)CN(C)C2CCC2)C1)c1cccc(F)c1 ZINC001381332282 1348212897 /nfs/dbraw/zinc/21/28/97/1348212897.db2.gz VJUBMGROZFTZIG-KSTDHSDQSA-N 1 3 347.478 2.855 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001381386470 1348236044 /nfs/dbraw/zinc/23/60/44/1348236044.db2.gz IAOMYZUTTOIFRX-GJZGRUSLSA-N 1 3 335.467 2.601 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]C/C=C/c1ccccc1 ZINC001381394951 1348240365 /nfs/dbraw/zinc/24/03/65/1348240365.db2.gz RNFICWVVUCULAI-BAMWUGHESA-N 1 3 329.488 2.667 10 0 EFAEHO C[C@@H](NC(=O)CC[N@H+](C)C1CCCCC1)[C@H](C)NCc1cccnc1 ZINC001381420463 1348260881 /nfs/dbraw/zinc/26/08/81/1348260881.db2.gz YSSAMCPMTGXCHJ-DLBZAZTESA-N 1 3 346.519 2.719 10 0 EFAEHO C[C@@H](NC(=O)CC[N@@H+](C)C1CCCCC1)[C@H](C)NCc1cccnc1 ZINC001381420463 1348260883 /nfs/dbraw/zinc/26/08/83/1348260883.db2.gz YSSAMCPMTGXCHJ-DLBZAZTESA-N 1 3 346.519 2.719 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CCC([NH2+]Cc2ccsc2)CC1)N(C)C ZINC001381462990 1348292367 /nfs/dbraw/zinc/29/23/67/1348292367.db2.gz NYNQQMGMVWDMSR-JCYILVPMSA-N 1 3 337.533 2.948 10 0 EFAEHO CN(CC(C)(C)C[NH2+]CC1CC(C)(C)C1)C(=O)CN(C)C1CCC1 ZINC001381471180 1348296778 /nfs/dbraw/zinc/29/67/78/1348296778.db2.gz WOFJCTJYVZZNKD-UHFFFAOYSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[N@H+](C)Cc1ccc(C)cc1 ZINC001381535640 1348337407 /nfs/dbraw/zinc/33/74/07/1348337407.db2.gz SYYKJUZPKPXADG-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc(C)cc1 ZINC001381535640 1348337409 /nfs/dbraw/zinc/33/74/09/1348337409.db2.gz SYYKJUZPKPXADG-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001381562690 1348360039 /nfs/dbraw/zinc/36/00/39/1348360039.db2.gz XNPJMGVZKHABHE-KRWDZBQOSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001381562690 1348360040 /nfs/dbraw/zinc/36/00/40/1348360040.db2.gz XNPJMGVZKHABHE-KRWDZBQOSA-N 1 3 331.504 2.806 10 0 EFAEHO C[C@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)N(C)Cc1cccc(Cl)c1 ZINC001381613915 1348405000 /nfs/dbraw/zinc/40/50/00/1348405000.db2.gz ZQEGVYHPQCMFNB-GDBMZVCRSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)N(C)Cc1cccc(Cl)c1 ZINC001381613915 1348405003 /nfs/dbraw/zinc/40/50/03/1348405003.db2.gz ZQEGVYHPQCMFNB-GDBMZVCRSA-N 1 3 337.895 2.618 10 0 EFAEHO Cc1cc(F)ccc1CN1CCCCC[C@H]1CNC(=O)CC[NH+](C)C ZINC001381759778 1348507996 /nfs/dbraw/zinc/50/79/96/1348507996.db2.gz RIXTXABBWBVYKT-IBGZPJMESA-N 1 3 349.494 2.947 10 0 EFAEHO C[C@@H](NC(=O)CC[NH+](C)C)C1CN(Cc2ccc3ccccc3c2)C1 ZINC001381801196 1348534980 /nfs/dbraw/zinc/53/49/80/1348534980.db2.gz GYOQCRUEVCMEFJ-MRXNPFEDSA-N 1 3 339.483 2.728 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCCCC3)C[C@H]21)N1CCCC1 ZINC001381910766 1348601726 /nfs/dbraw/zinc/60/17/26/1348601726.db2.gz FRUITURNYYLXAF-LDLYASANSA-N 1 3 347.547 2.735 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCCCC3)C[C@H]21)N1CCCC1 ZINC001381910766 1348601728 /nfs/dbraw/zinc/60/17/28/1348601728.db2.gz FRUITURNYYLXAF-LDLYASANSA-N 1 3 347.547 2.735 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([N@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001381990740 1348646227 /nfs/dbraw/zinc/64/62/27/1348646227.db2.gz YDBOEHRNQBGMDE-FGTMMUONSA-N 1 3 335.536 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([N@@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001381990740 1348646230 /nfs/dbraw/zinc/64/62/30/1348646230.db2.gz YDBOEHRNQBGMDE-FGTMMUONSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2ccc(F)cc2)C1 ZINC001382004671 1348654304 /nfs/dbraw/zinc/65/43/04/1348654304.db2.gz HCOBYHHGVNHKRI-IIDMSEBBSA-N 1 3 335.467 2.711 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001382128226 1348748792 /nfs/dbraw/zinc/74/87/92/1348748792.db2.gz SUKVJGWSOUXUAV-DNVCBOLYSA-N 1 3 345.531 2.890 10 0 EFAEHO CCc1ccc(CC[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001382131440 1348752266 /nfs/dbraw/zinc/75/22/66/1348752266.db2.gz ZFPRCVNWACPODI-ROUUACIJSA-N 1 3 345.531 2.570 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)CCC[NH+]2CCCC2)c1 ZINC001382165466 1348787809 /nfs/dbraw/zinc/78/78/09/1348787809.db2.gz LVBFXQCEYQURSO-KRWDZBQOSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@@H](NCc2cc(C)ccc2F)[C@H]1C ZINC001382300716 1348854094 /nfs/dbraw/zinc/85/40/94/1348854094.db2.gz DAWDUFNAQNYIFC-CRAIPNDOSA-N 1 3 335.467 2.555 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@@H](NCc2cc(C)ccc2F)[C@H]1C ZINC001382300716 1348854103 /nfs/dbraw/zinc/85/41/03/1348854103.db2.gz DAWDUFNAQNYIFC-CRAIPNDOSA-N 1 3 335.467 2.555 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@H](NCc2ccc(C)nc2C)C[C@H]1C ZINC001382321664 1348869840 /nfs/dbraw/zinc/86/98/40/1348869840.db2.gz ZPMPBJQUERZRLG-VQIMIIECSA-N 1 3 346.519 2.509 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@H](NCc2ccc(C)nc2C)C[C@H]1C ZINC001382321664 1348869845 /nfs/dbraw/zinc/86/98/45/1348869845.db2.gz ZPMPBJQUERZRLG-VQIMIIECSA-N 1 3 346.519 2.509 10 0 EFAEHO CC(C)N(CC[N@H+](C)C[C@H]1CCC(F)(F)C1)C(=O)[C@H]1CCCN1C ZINC001382499759 1348965631 /nfs/dbraw/zinc/96/56/31/1348965631.db2.gz RJZKZXRAGUPYKQ-JKSUJKDBSA-N 1 3 345.478 2.685 10 0 EFAEHO CC(C)N(CC[N@@H+](C)C[C@H]1CCC(F)(F)C1)C(=O)[C@H]1CCCN1C ZINC001382499759 1348965636 /nfs/dbraw/zinc/96/56/36/1348965636.db2.gz RJZKZXRAGUPYKQ-JKSUJKDBSA-N 1 3 345.478 2.685 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C[NH2+]Cc1ccsc1)C(C)(C)C)N(C)C ZINC001382530158 1348996035 /nfs/dbraw/zinc/99/60/35/1348996035.db2.gz HGQIQJKLLGHLIR-GJZGRUSLSA-N 1 3 325.522 2.709 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]Cc1ccsc1)C(C)(C)C ZINC001382536713 1349003037 /nfs/dbraw/zinc/00/30/37/1349003037.db2.gz AEHYDQNGANRKDC-HNNXBMFYSA-N 1 3 325.522 2.709 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]CC1CC(C)(C)C1)C(C)(C)C)N(C)C ZINC001382542963 1349009139 /nfs/dbraw/zinc/00/91/39/1349009139.db2.gz VWLZIBTXDNNWTR-HZPDHXFCSA-N 1 3 325.541 2.883 10 0 EFAEHO C[NH+](C)CCC(=O)NCc1ccc(CNCc2ccccc2)cc1F ZINC001382600236 1349043932 /nfs/dbraw/zinc/04/39/32/1349043932.db2.gz SXQSCFHIKRCVHJ-UHFFFAOYSA-N 1 3 343.446 2.683 10 0 EFAEHO CC(C)CC[N@@H+]1CCCCC[C@H]1CNC(=O)[C@@H](C(C)C)N(C)C ZINC001394212807 1357602721 /nfs/dbraw/zinc/60/27/21/1357602721.db2.gz RUSRZQXLBOKCMR-ZWKOTPCHSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[N@H+]1CCCCC[C@H]1CNC(=O)[C@@H](C(C)C)N(C)C ZINC001394212807 1357602724 /nfs/dbraw/zinc/60/27/24/1357602724.db2.gz RUSRZQXLBOKCMR-ZWKOTPCHSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)N2CC[C@H]2CN(C)C(=O)CC[NH+](C)C)c1 ZINC001388651001 1352891073 /nfs/dbraw/zinc/89/10/73/1352891073.db2.gz WGNLLURQKKSRAX-MSOLQXFVSA-N 1 3 331.504 2.849 10 0 EFAEHO Cc1ccc(C)c([C@H](C)N2CC[C@@H]2CN(C)C(=O)CC[NH+](C)C)c1 ZINC001388651027 1352892064 /nfs/dbraw/zinc/89/20/64/1352892064.db2.gz WGNLLURQKKSRAX-ZWKOTPCHSA-N 1 3 331.504 2.849 10 0 EFAEHO CCc1ccccc1CN1CC([C@H](C)NC(=O)C[C@H]2CC[N@H+](C)C2)C1 ZINC001394268084 1357652826 /nfs/dbraw/zinc/65/28/26/1357652826.db2.gz SGGSVULDRUYCQG-DLBZAZTESA-N 1 3 343.515 2.527 10 0 EFAEHO CCc1ccccc1CN1CC([C@H](C)NC(=O)C[C@H]2CC[N@@H+](C)C2)C1 ZINC001394268084 1357652831 /nfs/dbraw/zinc/65/28/31/1357652831.db2.gz SGGSVULDRUYCQG-DLBZAZTESA-N 1 3 343.515 2.527 10 0 EFAEHO CN(C[C@@H]1CCN1CC/C=C/c1ccccc1)C(=O)[C@H]1CC[N@H+](C)C1 ZINC001388662629 1352903331 /nfs/dbraw/zinc/90/33/31/1352903331.db2.gz OXKGYTNGNMBWPY-UPBJVAEDSA-N 1 3 341.499 2.574 10 0 EFAEHO CN(C[C@@H]1CCN1CC/C=C/c1ccccc1)C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001388662629 1352903335 /nfs/dbraw/zinc/90/33/35/1352903335.db2.gz OXKGYTNGNMBWPY-UPBJVAEDSA-N 1 3 341.499 2.574 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H]1C[C@@H](CNC(=O)CN2[C@H](C)CC[C@H]2C)C1 ZINC001388704130 1352934126 /nfs/dbraw/zinc/93/41/26/1352934126.db2.gz RKJTVQGUZHCWRY-MLYOOKFZSA-N 1 3 343.515 2.852 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2C[C@@H]([NH2+]CC3CCC(C)CC3)C2)C1 ZINC001388725348 1352953037 /nfs/dbraw/zinc/95/30/37/1352953037.db2.gz KZAQJWWVAJWHLZ-QLBHFUSHSA-N 1 3 335.536 2.639 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2C[C@@H]([NH2+]CC3CCC(C)CC3)C2)C1 ZINC001388725353 1352953171 /nfs/dbraw/zinc/95/31/71/1352953171.db2.gz KZAQJWWVAJWHLZ-ZBABMDLNSA-N 1 3 335.536 2.639 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@@H]1CC[C@H](CNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001388744840 1352971903 /nfs/dbraw/zinc/97/19/03/1352971903.db2.gz FWPSZEKKENMEOU-IXDOHACOSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(F)cc2C)C1)N(C)C ZINC001388748964 1352975442 /nfs/dbraw/zinc/97/54/42/1352975442.db2.gz HUAYJHNFFURNJF-KFKAGJAMSA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2csc(C)c2)C1)N(C)C ZINC001388759209 1352985104 /nfs/dbraw/zinc/98/51/04/1352985104.db2.gz OPJSRFRYUVFLOH-UAGQMJEPSA-N 1 3 337.533 2.771 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CCC2CC2)C1)N1CCCCCC1 ZINC001388759411 1352985821 /nfs/dbraw/zinc/98/58/21/1352985821.db2.gz KRDDNTPLAMDLOO-NZSAHSFTSA-N 1 3 335.536 2.926 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C[C@@H]1C)CC[NH+](C[C@H](F)CC)CC2 ZINC001388764148 1352988328 /nfs/dbraw/zinc/98/83/28/1352988328.db2.gz USLSBFAQDMXUSO-DLBZAZTESA-N 1 3 341.515 2.779 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001388799488 1353030376 /nfs/dbraw/zinc/03/03/76/1353030376.db2.gz QQHWABRYJWDWPY-UXHICEINSA-N 1 3 343.515 2.616 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001388799488 1353030379 /nfs/dbraw/zinc/03/03/79/1353030379.db2.gz QQHWABRYJWDWPY-UXHICEINSA-N 1 3 343.515 2.616 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCCC[C@H](NCc2ccccc2F)C1 ZINC001388807378 1353037581 /nfs/dbraw/zinc/03/75/81/1353037581.db2.gz PAIOILTYTUPJBA-KRWDZBQOSA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC2(C[NH+](CCCCCF)C2)CC1)N(C)C ZINC001495987670 1353222526 /nfs/dbraw/zinc/22/25/26/1353222526.db2.gz UNYNRAWZXZVPCA-KRWDZBQOSA-N 1 3 341.515 2.637 10 0 EFAEHO Cc1cc(CN2CC[C@@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c(C)s1 ZINC001389458815 1353405911 /nfs/dbraw/zinc/40/59/11/1353405911.db2.gz JPTGXUMOZMAZSF-MSOLQXFVSA-N 1 3 349.544 2.930 10 0 EFAEHO Cc1cc(CN2CC[C@@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c(C)s1 ZINC001389458815 1353405917 /nfs/dbraw/zinc/40/59/17/1353405917.db2.gz JPTGXUMOZMAZSF-MSOLQXFVSA-N 1 3 349.544 2.930 10 0 EFAEHO CCc1cccc(CN2CC[C@@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001389459949 1353406293 /nfs/dbraw/zinc/40/62/93/1353406293.db2.gz KMQAPAHKQZEDRK-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1cccc(CN2CC[C@@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001389459949 1353406296 /nfs/dbraw/zinc/40/62/96/1353406296.db2.gz KMQAPAHKQZEDRK-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)[C@@H]2CCCN2C(C)C)C2CC2)cc1 ZINC001389611723 1353510129 /nfs/dbraw/zinc/51/01/29/1353510129.db2.gz OSUHGLCYTCOFKK-UXHICEINSA-N 1 3 343.515 2.852 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]([NH2+]Cc2ccccc2Cl)C2CC2)C1 ZINC001389673474 1353544818 /nfs/dbraw/zinc/54/48/18/1353544818.db2.gz WLWFTWZNWQMMJX-KSSFIOAISA-N 1 3 349.906 2.666 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]([NH2+]Cc2ccccc2Cl)C2CC2)C1 ZINC001389673481 1353544856 /nfs/dbraw/zinc/54/48/56/1353544856.db2.gz WLWFTWZNWQMMJX-RDTXWAMCSA-N 1 3 349.906 2.666 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]CC1CCC2(CC2)CC1)C1CC1)N(C)C ZINC001389686944 1353554703 /nfs/dbraw/zinc/55/47/03/1353554703.db2.gz GFMPMPUWIRAACP-QZTJIDSGSA-N 1 3 335.536 2.781 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1ccccc1F)C1CC1 ZINC001389689912 1353557021 /nfs/dbraw/zinc/55/70/21/1353557021.db2.gz NGINFPXWXYGQHG-RTBURBONSA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@H+](C)Cc2ccccc2F)C1 ZINC001389731058 1353586812 /nfs/dbraw/zinc/58/68/12/1353586812.db2.gz CJKNGBOXAGADAZ-QGZVFWFLSA-N 1 3 349.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@@H+](C)Cc2ccccc2F)C1 ZINC001389731058 1353586815 /nfs/dbraw/zinc/58/68/15/1353586815.db2.gz CJKNGBOXAGADAZ-QGZVFWFLSA-N 1 3 349.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@@H](C)c3ccccc3F)C[C@H]21 ZINC001394338805 1357711573 /nfs/dbraw/zinc/71/15/73/1357711573.db2.gz JMSWXXCHBSMHRA-LEUOFYLZSA-N 1 3 347.478 2.521 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@@H](C)c3ccccc3F)C[C@H]21 ZINC001394338805 1357711574 /nfs/dbraw/zinc/71/15/74/1357711574.db2.gz JMSWXXCHBSMHRA-LEUOFYLZSA-N 1 3 347.478 2.521 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2F)C1 ZINC001390012369 1353742419 /nfs/dbraw/zinc/74/24/19/1353742419.db2.gz RIRZUVKTSOYLES-GASCZTMLSA-N 1 3 341.858 2.558 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001390153738 1353867709 /nfs/dbraw/zinc/86/77/09/1353867709.db2.gz IKBJCZFBRQGDNW-CVEARBPZSA-N 1 3 345.478 2.733 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1C[NH2+]Cc1ccc(C)nc1C ZINC001390166716 1353883905 /nfs/dbraw/zinc/88/39/05/1353883905.db2.gz ZLNCMXYJSCWUKT-LJQANCHMSA-N 1 3 346.519 2.511 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCC[C@@H]1[C@@H]1CCCN1C/C=C\Cl ZINC001390179006 1353899331 /nfs/dbraw/zinc/89/93/31/1353899331.db2.gz ZHULNMACTNODNL-ASQNPNNHSA-N 1 3 327.900 2.536 10 0 EFAEHO CC[C@H](F)C[NH2+]C1CCC(NC(=O)C(C)(C)N2CCCC2)CC1 ZINC001390280733 1353975028 /nfs/dbraw/zinc/97/50/28/1353975028.db2.gz WSXICQCFCDRVHA-FHERZECASA-N 1 3 327.488 2.626 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H]1CN(C(=O)CN(C)C(C)C)CC1(C)C ZINC001394727504 1358052908 /nfs/dbraw/zinc/05/29/08/1358052908.db2.gz TZCBFLGHZNENGI-IBGZPJMESA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)N(CC[N@H+](C)CC1CC2(CCC2)C1)C(=O)[C@@H]1CCCN1C ZINC001394802489 1358087420 /nfs/dbraw/zinc/08/74/20/1358087420.db2.gz WDUKGFOMRGRLRV-SFHVURJKSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CC1CC2(CCC2)C1)C(=O)[C@@H]1CCCN1C ZINC001394802489 1358087422 /nfs/dbraw/zinc/08/74/22/1358087422.db2.gz WDUKGFOMRGRLRV-SFHVURJKSA-N 1 3 335.536 2.830 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCCC1)[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001390371966 1354039859 /nfs/dbraw/zinc/03/98/59/1354039859.db2.gz GRGWQXNHGRAKJZ-HUUCEWRRSA-N 1 3 345.478 2.781 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001390397561 1354062873 /nfs/dbraw/zinc/06/28/73/1354062873.db2.gz GLWROARVUAYWPW-GOEBONIOSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)[NH+]1CCCC1)N[C@@H](C)c1ccccc1F ZINC001390454082 1354091272 /nfs/dbraw/zinc/09/12/72/1354091272.db2.gz BGCDTWVVJBQXRR-GJZGRUSLSA-N 1 3 335.467 2.855 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H]1CCC[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001390605151 1354200252 /nfs/dbraw/zinc/20/02/52/1354200252.db2.gz CVDPNFGXBNNEIH-RBUKOAKNSA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]([NH2+]CC2CC3(CCC3)C2)C1 ZINC001390608508 1354203016 /nfs/dbraw/zinc/20/30/16/1354203016.db2.gz KOBPXFKMDKUFCK-MSOLQXFVSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@H](F)CC[N@H+](C)[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001390624058 1354221251 /nfs/dbraw/zinc/22/12/51/1354221251.db2.gz KXDIYPYSBCRIKN-JKSUJKDBSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001390624058 1354221253 /nfs/dbraw/zinc/22/12/53/1354221253.db2.gz KXDIYPYSBCRIKN-JKSUJKDBSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]([N@H+](C)C/C=C\c2ccccc2)C1)N(C)C ZINC001390641854 1354241531 /nfs/dbraw/zinc/24/15/31/1354241531.db2.gz ZHANTHOVIUAINO-WBDJMKMOSA-N 1 3 343.515 2.963 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]([N@@H+](C)C/C=C\c2ccccc2)C1)N(C)C ZINC001390641854 1354241533 /nfs/dbraw/zinc/24/15/33/1354241533.db2.gz ZHANTHOVIUAINO-WBDJMKMOSA-N 1 3 343.515 2.963 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001390699619 1354291162 /nfs/dbraw/zinc/29/11/62/1354291162.db2.gz BGYLKSQDNLHQDQ-IAGOWNOFSA-N 1 3 343.515 2.502 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]CC1CCC(F)(F)CC1 ZINC001390711237 1354302577 /nfs/dbraw/zinc/30/25/77/1354302577.db2.gz ZHMASZRASVUBJP-LSDHHAIUSA-N 1 3 345.478 2.638 10 0 EFAEHO CN(CCNC(=O)C12CCC[NH+]1CCC2)Cc1ccc(C2CC2)cc1 ZINC001390781929 1354369335 /nfs/dbraw/zinc/36/93/35/1354369335.db2.gz NRPYFAWWMMLGCP-UHFFFAOYSA-N 1 3 341.499 2.740 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N(C)CCNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001390846596 1354430915 /nfs/dbraw/zinc/43/09/15/1354430915.db2.gz RLSVNYYHSCTDQC-CABCVRRESA-N 1 3 337.895 2.791 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N(C)CCNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001390846596 1354430917 /nfs/dbraw/zinc/43/09/17/1354430917.db2.gz RLSVNYYHSCTDQC-CABCVRRESA-N 1 3 337.895 2.791 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@H]2CCC[C@H]([NH+](C)C)C2)c1 ZINC001390849125 1354432246 /nfs/dbraw/zinc/43/22/46/1354432246.db2.gz ZMHBJKGIIMRKAZ-PMACEKPBSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCN(C)Cc1ccc(C2CC2)cc1)[NH+](C)C ZINC001390850099 1354433024 /nfs/dbraw/zinc/43/30/24/1354433024.db2.gz KVCBQIVXNWHZJK-IBGZPJMESA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@@H+]1CC1CCCC1)N1CCCC1 ZINC001391070278 1354762423 /nfs/dbraw/zinc/76/24/23/1354762423.db2.gz VGZOJEJAHGWJKE-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@H+]1CC1CCCC1)N1CCCC1 ZINC001391070278 1354762426 /nfs/dbraw/zinc/76/24/26/1354762426.db2.gz VGZOJEJAHGWJKE-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](F)CN1CC[C@@H](CNC(=O)CC[N@H+](C)C2CCCCC2)C1 ZINC001391096227 1354789699 /nfs/dbraw/zinc/78/96/99/1354789699.db2.gz INTQRXOOALHFPX-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](F)CN1CC[C@@H](CNC(=O)CC[N@@H+](C)C2CCCCC2)C1 ZINC001391096227 1354789702 /nfs/dbraw/zinc/78/97/02/1354789702.db2.gz INTQRXOOALHFPX-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CCc1ccc(C[N@H+]2CC[C@@H](CNC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001391108251 1354804269 /nfs/dbraw/zinc/80/42/69/1354804269.db2.gz VUXALHBJQGAJTO-RBUKOAKNSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(C[N@@H+]2CC[C@@H](CNC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001391108251 1354804273 /nfs/dbraw/zinc/80/42/73/1354804273.db2.gz VUXALHBJQGAJTO-RBUKOAKNSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(C[N@H+]2CC[C@H](CNC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001391108253 1354805402 /nfs/dbraw/zinc/80/54/02/1354805402.db2.gz VUXALHBJQGAJTO-RTBURBONSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(C[N@@H+]2CC[C@H](CNC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001391108253 1354805407 /nfs/dbraw/zinc/80/54/07/1354805407.db2.gz VUXALHBJQGAJTO-RTBURBONSA-N 1 3 331.504 2.527 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@H+](Cc2cc(C)sc2C)C1)N(C)C ZINC001391110244 1354809227 /nfs/dbraw/zinc/80/92/27/1354809227.db2.gz LKCLCRYTLVLEMA-DOTOQJQBSA-N 1 3 337.533 2.643 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@@H+](Cc2cc(C)sc2C)C1)N(C)C ZINC001391110244 1354809232 /nfs/dbraw/zinc/80/92/32/1354809232.db2.gz LKCLCRYTLVLEMA-DOTOQJQBSA-N 1 3 337.533 2.643 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](C/C=C/Cl)CC(C)(C)C1 ZINC001397817423 1360169595 /nfs/dbraw/zinc/16/95/95/1360169595.db2.gz VISHKJUTPRCYPQ-PMGBHYCQSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](C/C=C/Cl)CC(C)(C)C1 ZINC001397817423 1360169598 /nfs/dbraw/zinc/16/95/98/1360169598.db2.gz VISHKJUTPRCYPQ-PMGBHYCQSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](Cc2ccccn2)CC(C)(C)C1 ZINC001397811789 1360164228 /nfs/dbraw/zinc/16/42/28/1360164228.db2.gz KRZBRMSQLCYVCI-QGZVFWFLSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](Cc2ccccn2)CC(C)(C)C1 ZINC001397811789 1360164231 /nfs/dbraw/zinc/16/42/31/1360164231.db2.gz KRZBRMSQLCYVCI-QGZVFWFLSA-N 1 3 346.519 2.529 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H](C(C)C)N2CCCC2)CC[N@@H+]1CC1CCC1 ZINC001397747751 1360102032 /nfs/dbraw/zinc/10/20/32/1360102032.db2.gz JCBHBKVILYLXAS-IPMKNSEASA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H](C(C)C)N2CCCC2)CC[N@H+]1CC1CCC1 ZINC001397747751 1360102034 /nfs/dbraw/zinc/10/20/34/1360102034.db2.gz JCBHBKVILYLXAS-IPMKNSEASA-N 1 3 335.536 2.876 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@H+](Cc2ccccn2)CC(C)(C)C1 ZINC001397805295 1360157125 /nfs/dbraw/zinc/15/71/25/1360157125.db2.gz HBPBMJSZCHUJEL-QGZVFWFLSA-N 1 3 346.519 2.530 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@@H+](Cc2ccccn2)CC(C)(C)C1 ZINC001397805295 1360157128 /nfs/dbraw/zinc/15/71/28/1360157128.db2.gz HBPBMJSZCHUJEL-QGZVFWFLSA-N 1 3 346.519 2.530 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)C12CC[NH+](CC1)C2)c1ccccc1Cl ZINC001391232650 1354954255 /nfs/dbraw/zinc/95/42/55/1354954255.db2.gz XDRDIPWHSHFZFV-CQSZACIVSA-N 1 3 335.879 2.545 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001391299109 1355039677 /nfs/dbraw/zinc/03/96/77/1355039677.db2.gz NJADGMXPJZCXFQ-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001391299109 1355039680 /nfs/dbraw/zinc/03/96/80/1355039680.db2.gz NJADGMXPJZCXFQ-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CCNC(=O)CN3CC[C@@H](C)C3)C2)cc1 ZINC001391323881 1355075340 /nfs/dbraw/zinc/07/53/40/1355075340.db2.gz LLPIRASUGNLMCX-QUCCMNQESA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CCNC(=O)CN3CC[C@@H](C)C3)C2)cc1 ZINC001391323881 1355075345 /nfs/dbraw/zinc/07/53/45/1355075345.db2.gz LLPIRASUGNLMCX-QUCCMNQESA-N 1 3 343.515 2.665 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H]1CC[N@H+](CC2CCCC2)C1 ZINC001391335520 1355089635 /nfs/dbraw/zinc/08/96/35/1355089635.db2.gz KFYYIZDPQCNARO-MOPGFXCFSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC001391335520 1355089639 /nfs/dbraw/zinc/08/96/39/1355089639.db2.gz KFYYIZDPQCNARO-MOPGFXCFSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H]1CC[N@H+](CC2CC(C)(C)C2)C1 ZINC001391338966 1355095357 /nfs/dbraw/zinc/09/53/57/1355095357.db2.gz NCLOXIOXOMTDCN-OAHLLOKOSA-N 1 3 332.492 2.525 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H]1CC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001391338966 1355095360 /nfs/dbraw/zinc/09/53/60/1355095360.db2.gz NCLOXIOXOMTDCN-OAHLLOKOSA-N 1 3 332.492 2.525 10 0 EFAEHO Cc1ccc(F)c(C[N@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001391342078 1355097768 /nfs/dbraw/zinc/09/77/68/1355097768.db2.gz ZABSBWZVBMJNAB-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(F)c(C[N@@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001391342078 1355097773 /nfs/dbraw/zinc/09/77/73/1355097773.db2.gz ZABSBWZVBMJNAB-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@H+](C)Cc2ccccc2F)CC1 ZINC001391366566 1355134929 /nfs/dbraw/zinc/13/49/29/1355134929.db2.gz WCNBOYWYYCFCNA-UHFFFAOYSA-N 1 3 349.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@@H+](C)Cc2ccccc2F)CC1 ZINC001391366566 1355134934 /nfs/dbraw/zinc/13/49/34/1355134934.db2.gz WCNBOYWYYCFCNA-UHFFFAOYSA-N 1 3 349.494 2.836 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1C)N(C)C ZINC001398585019 1360657483 /nfs/dbraw/zinc/65/74/83/1360657483.db2.gz XGZGWAUBVONEEG-NXEWRWPSSA-N 1 3 343.515 2.947 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1C)N(C)C ZINC001398585019 1360657486 /nfs/dbraw/zinc/65/74/86/1360657486.db2.gz XGZGWAUBVONEEG-NXEWRWPSSA-N 1 3 343.515 2.947 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CNC(=O)C(C)(C)N2CCCC2)c(C)c1 ZINC001399036533 1360949865 /nfs/dbraw/zinc/94/98/65/1360949865.db2.gz TXXSKSOWFFBKMX-KRWDZBQOSA-N 1 3 331.504 2.772 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NCC1CN(CCCc2ccsc2)C1 ZINC001391528459 1355278254 /nfs/dbraw/zinc/27/82/54/1355278254.db2.gz ZAHADCGPSVPTJZ-IYBDPMFKSA-N 1 3 349.544 2.602 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCC1CN(CCCc2ccsc2)C1 ZINC001391528459 1355278259 /nfs/dbraw/zinc/27/82/59/1355278259.db2.gz ZAHADCGPSVPTJZ-IYBDPMFKSA-N 1 3 349.544 2.602 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NCC1CN(CCCc2ccsc2)C1 ZINC001391528458 1355278819 /nfs/dbraw/zinc/27/88/19/1355278819.db2.gz ZAHADCGPSVPTJZ-HZPDHXFCSA-N 1 3 349.544 2.602 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@H+](CCC2CCCC2)C1)N1CCCC1 ZINC001391593977 1355334724 /nfs/dbraw/zinc/33/47/24/1355334724.db2.gz FZQXWLVYNIBUKI-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@@H+](CCC2CCCC2)C1)N1CCCC1 ZINC001391593977 1355334732 /nfs/dbraw/zinc/33/47/32/1355334732.db2.gz FZQXWLVYNIBUKI-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1cccc(C)c1 ZINC001391696085 1355442481 /nfs/dbraw/zinc/44/24/81/1355442481.db2.gz SOOSZPAJCWJAOV-OALUTQOASA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCC1 ZINC001391721689 1355465110 /nfs/dbraw/zinc/46/51/10/1355465110.db2.gz QQQFRZOJIJZKRP-LPHOPBHVSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCC1 ZINC001391721681 1355465141 /nfs/dbraw/zinc/46/51/41/1355465141.db2.gz QQQFRZOJIJZKRP-APWZRJJASA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1ccc(F)c(CNCC2(NC(=O)[C@@H]3CC[N@@H+](C)C3)CCCC2)c1 ZINC001391776231 1355520428 /nfs/dbraw/zinc/52/04/28/1355520428.db2.gz HDIWATNHLCQQHP-MRXNPFEDSA-N 1 3 347.478 2.604 10 0 EFAEHO Cc1ccc(F)c(CNCC2(NC(=O)[C@@H]3CC[N@H+](C)C3)CCCC2)c1 ZINC001391776231 1355520431 /nfs/dbraw/zinc/52/04/31/1355520431.db2.gz HDIWATNHLCQQHP-MRXNPFEDSA-N 1 3 347.478 2.604 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H](C)C[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001391951838 1355675070 /nfs/dbraw/zinc/67/50/70/1355675070.db2.gz QZWZUTIWWLMMDL-HNAYVOBHSA-N 1 3 344.503 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+]Cc1cc(F)ccc1Cl ZINC001391965260 1355687427 /nfs/dbraw/zinc/68/74/27/1355687427.db2.gz PYIVQTLJHWKUMM-ZDUSSCGKSA-N 1 3 343.874 2.661 10 0 EFAEHO CC(C)CC[N@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001400238190 1361873943 /nfs/dbraw/zinc/87/39/43/1361873943.db2.gz FUXVNRXKOWJSEW-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CC[N@@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001400238190 1361873946 /nfs/dbraw/zinc/87/39/46/1361873946.db2.gz FUXVNRXKOWJSEW-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C[N@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001400253123 1361888395 /nfs/dbraw/zinc/88/83/95/1361888395.db2.gz YOLLUJWBBWRDEE-AQNXPRMDSA-N 1 3 349.563 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C[N@@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001400253123 1361888397 /nfs/dbraw/zinc/88/83/97/1361888397.db2.gz YOLLUJWBBWRDEE-AQNXPRMDSA-N 1 3 349.563 2.935 10 0 EFAEHO CC[C@@H](NC[C@@H](C)N(C)C(=O)CC[NH+](C)C)c1ccc(F)cc1F ZINC001392129254 1355789619 /nfs/dbraw/zinc/78/96/19/1355789619.db2.gz XZOTZISFJAGVSS-CXAGYDPISA-N 1 3 341.446 2.804 10 0 EFAEHO CN(C/C=C/Cl)CCC1CCN(C(=O)C[C@H]2CC[N@H+](C)C2)CC1 ZINC001392191900 1355846479 /nfs/dbraw/zinc/84/64/79/1355846479.db2.gz CPAIORZJJZIURQ-DLGAGEGBSA-N 1 3 341.927 2.641 10 0 EFAEHO CN(C/C=C/Cl)CCC1CCN(C(=O)C[C@H]2CC[N@@H+](C)C2)CC1 ZINC001392191900 1355846485 /nfs/dbraw/zinc/84/64/85/1355846485.db2.gz CPAIORZJJZIURQ-DLGAGEGBSA-N 1 3 341.927 2.641 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]CCc1ccccc1 ZINC001392220007 1355875242 /nfs/dbraw/zinc/87/52/42/1355875242.db2.gz MENRIYJAVXCWFT-PMACEKPBSA-N 1 3 345.531 2.832 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccc(F)cc1 ZINC001392225686 1355879615 /nfs/dbraw/zinc/87/96/15/1355879615.db2.gz XZCHAFQDTHKAGE-RTBURBONSA-N 1 3 349.494 2.929 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001392248166 1355905236 /nfs/dbraw/zinc/90/52/36/1355905236.db2.gz GSZKKSXITPCNIX-FQEVSTJZSA-N 1 3 345.531 2.746 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H]1CCc2c1cccc2F ZINC001392256218 1355913179 /nfs/dbraw/zinc/91/31/79/1355913179.db2.gz QCHHWGINYXZAOC-RTBURBONSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001392277372 1355932331 /nfs/dbraw/zinc/93/23/31/1355932331.db2.gz CKIZDQOBTOSEMT-HNAYVOBHSA-N 1 3 347.478 2.619 10 0 EFAEHO CCc1ccccc1CN(C)CCN(C)C(=O)[C@H]1CC[N@H+](C)[C@@H]1CC ZINC001392280216 1355936196 /nfs/dbraw/zinc/93/61/96/1355936196.db2.gz PSTYZAIHEIBLQD-VQTJNVASSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1ccccc1CN(C)CCN(C)C(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC ZINC001392280216 1355936197 /nfs/dbraw/zinc/93/61/97/1355936197.db2.gz PSTYZAIHEIBLQD-VQTJNVASSA-N 1 3 345.531 2.870 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCc2ccccc21)C(=O)[C@@H](C(C)C)N(C)C ZINC001392452438 1356047850 /nfs/dbraw/zinc/04/78/50/1356047850.db2.gz HOIRGIYNYXPJGM-RBUKOAKNSA-N 1 3 331.504 2.698 10 0 EFAEHO COc1cccc(C[NH2+][C@H]2CC[C@H](NC(=O)CN(C)C(C)C)CC2)c1 ZINC001401069672 1362409927 /nfs/dbraw/zinc/40/99/27/1362409927.db2.gz ZQSCCORRMOPGEE-IYARVYRRSA-N 1 3 347.503 2.552 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+][C@@H](C)c1ccc2c(c1)CCC2 ZINC001392534941 1356106836 /nfs/dbraw/zinc/10/68/36/1356106836.db2.gz GCQTYAHITNBLRV-CVEARBPZSA-N 1 3 331.504 2.671 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(F)cc1C ZINC001392539008 1356110098 /nfs/dbraw/zinc/11/00/98/1356110098.db2.gz ZXALLIHTCWVHSO-QAPCUYQASA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H](C)NC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001392564960 1356123670 /nfs/dbraw/zinc/12/36/70/1356123670.db2.gz VGYQKFUHJYVASQ-PKOBYXMFSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCN2C(C)C)c(C)c1 ZINC001392564592 1356123734 /nfs/dbraw/zinc/12/37/34/1356123734.db2.gz HWARPFSQOSLZQC-HKUYNNGSSA-N 1 3 331.504 2.771 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1ccccc1Cl ZINC001392565435 1356124306 /nfs/dbraw/zinc/12/43/06/1356124306.db2.gz FWSVKRBIMZLAQK-WMLDXEAASA-N 1 3 337.895 2.809 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1ccccc1Cl ZINC001392565435 1356124310 /nfs/dbraw/zinc/12/43/10/1356124310.db2.gz FWSVKRBIMZLAQK-WMLDXEAASA-N 1 3 337.895 2.809 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001392591708 1356143372 /nfs/dbraw/zinc/14/33/72/1356143372.db2.gz LHEAOPKLFAXQDV-MSOLQXFVSA-N 1 3 345.531 2.821 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)CC[NH+]2CCCCC2)c1 ZINC001392616360 1356163384 /nfs/dbraw/zinc/16/33/84/1356163384.db2.gz BPZJIGMAWIJEMZ-INIZCTEOSA-N 1 3 335.467 2.604 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001392683041 1356231710 /nfs/dbraw/zinc/23/17/10/1356231710.db2.gz HMSQZPRIZORVRF-BEFAXECRSA-N 1 3 345.531 2.890 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001392683041 1356231714 /nfs/dbraw/zinc/23/17/14/1356231714.db2.gz HMSQZPRIZORVRF-BEFAXECRSA-N 1 3 345.531 2.890 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)CCc1ccccc1 ZINC001392711376 1356264764 /nfs/dbraw/zinc/26/47/64/1356264764.db2.gz ZRASFMVQPAGBQW-UYAOXDASSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)CCc1ccccc1 ZINC001392711376 1356264770 /nfs/dbraw/zinc/26/47/70/1356264770.db2.gz ZRASFMVQPAGBQW-UYAOXDASSA-N 1 3 345.531 2.929 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001392715340 1356269357 /nfs/dbraw/zinc/26/93/57/1356269357.db2.gz DJTVTMZBXYFTLZ-DNVCBOLYSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001392715340 1356269360 /nfs/dbraw/zinc/26/93/60/1356269360.db2.gz DJTVTMZBXYFTLZ-DNVCBOLYSA-N 1 3 331.504 2.841 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)C[C@@H](C)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001392731611 1356289987 /nfs/dbraw/zinc/28/99/87/1356289987.db2.gz WUTPJBKSLLAUFR-ZBFHGGJFSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)C[C@@H](C)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001392731611 1356289991 /nfs/dbraw/zinc/28/99/91/1356289991.db2.gz WUTPJBKSLLAUFR-ZBFHGGJFSA-N 1 3 337.895 2.537 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+][C@H](C)c1ccc(F)cc1)C1CC1 ZINC001392796465 1356333977 /nfs/dbraw/zinc/33/39/77/1356333977.db2.gz COAFQNDEDRJTHK-RDTXWAMCSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+]CC2CCC(C)CC2)CC1 ZINC001392897418 1356415457 /nfs/dbraw/zinc/41/54/57/1356415457.db2.gz MOYHWYKNGONXRZ-DAWZGUTISA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C2(CNC(=O)C(C)(C)N3CCCC3)CC2)c1 ZINC001392922243 1356434369 /nfs/dbraw/zinc/43/43/69/1356434369.db2.gz BVZRIROLPSNAOJ-UHFFFAOYSA-N 1 3 343.515 2.916 10 0 EFAEHO C[C@H](NC1(CNC(=O)CC2CC[NH+](C)CC2)CC1)c1cccc(F)c1 ZINC001392942329 1356451690 /nfs/dbraw/zinc/45/16/90/1356451690.db2.gz PMBUUAXDWLILCZ-HNNXBMFYSA-N 1 3 347.478 2.857 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001392942142 1356451901 /nfs/dbraw/zinc/45/19/01/1356451901.db2.gz ZUPJUTWJESSBMJ-MSOLQXFVSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001392942142 1356451903 /nfs/dbraw/zinc/45/19/03/1356451903.db2.gz ZUPJUTWJESSBMJ-MSOLQXFVSA-N 1 3 345.462 2.581 10 0 EFAEHO CC[C@@H](F)C[N@H+](CC1CC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001392976890 1356483717 /nfs/dbraw/zinc/48/37/17/1356483717.db2.gz ZTXHJCRUYHBDCY-QGZVFWFLSA-N 1 3 339.499 2.533 10 0 EFAEHO CC[C@@H](F)C[N@@H+](CC1CC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001392976890 1356483720 /nfs/dbraw/zinc/48/37/20/1356483720.db2.gz ZTXHJCRUYHBDCY-QGZVFWFLSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(C(=O)CC[C@@H]1CCC[N@@H+]1C)C1CN(CC2CCCCCC2)C1 ZINC001392999974 1356502626 /nfs/dbraw/zinc/50/26/26/1356502626.db2.gz AKMIIGONWSYZJV-SFHVURJKSA-N 1 3 335.536 2.974 10 0 EFAEHO CN(C(=O)CC[C@@H]1CCC[N@H+]1C)C1CN(CC2CCCCCC2)C1 ZINC001392999974 1356502631 /nfs/dbraw/zinc/50/26/31/1356502631.db2.gz AKMIIGONWSYZJV-SFHVURJKSA-N 1 3 335.536 2.974 10 0 EFAEHO C[NH+](C)CCCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CC2(CCC2)C1 ZINC001401997718 1363315896 /nfs/dbraw/zinc/31/58/96/1363315896.db2.gz KTGKDHGZEBCAOI-KDURUIRLSA-N 1 3 347.547 2.974 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@@H]1CCCN1C(=O)CN(C)C(C)C ZINC001393048958 1356537482 /nfs/dbraw/zinc/53/74/82/1356537482.db2.gz CWIKVVVBLJIOSX-SFHVURJKSA-N 1 3 331.504 2.724 10 0 EFAEHO CC[C@H](F)CNC[C@H]1CCCN1C(=O)CC[N@H+](C)C1CCCCC1 ZINC001393053333 1356540823 /nfs/dbraw/zinc/54/08/23/1356540823.db2.gz VBUGNQQPYYVCMZ-FUHWJXTLSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@H](F)CNC[C@H]1CCCN1C(=O)CC[N@@H+](C)C1CCCCC1 ZINC001393053333 1356540827 /nfs/dbraw/zinc/54/08/27/1356540827.db2.gz VBUGNQQPYYVCMZ-FUHWJXTLSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@H](C(=O)NC1(C)CC[NH+]([C@H]2CCc3ccccc32)CC1)N(C)C ZINC001393070441 1356558035 /nfs/dbraw/zinc/55/80/35/1356558035.db2.gz LGFCSRCPJXYXJD-MOPGFXCFSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@]2(CC[N@@H+](CC[C@@H](C)F)C2)C1 ZINC001393084834 1356577807 /nfs/dbraw/zinc/57/78/07/1356577807.db2.gz BGISXHLPRIBMPA-IEBWSBKVSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@]2(CC[N@H+](CC[C@@H](C)F)C2)C1 ZINC001393084834 1356577812 /nfs/dbraw/zinc/57/78/12/1356577812.db2.gz BGISXHLPRIBMPA-IEBWSBKVSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)CC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001393246704 1356748569 /nfs/dbraw/zinc/74/85/69/1356748569.db2.gz ZWAYUESJJPDBRZ-HZPDHXFCSA-N 1 3 347.494 2.692 10 0 EFAEHO CC(C)CC[N@H+]1CCC(F)(F)[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001393246704 1356748571 /nfs/dbraw/zinc/74/85/71/1356748571.db2.gz ZWAYUESJJPDBRZ-HZPDHXFCSA-N 1 3 347.494 2.692 10 0 EFAEHO CC[C@@H](F)CN1CCC([C@H]2CCCN(C(=O)CC[NH+](C)C)C2)CC1 ZINC001393375635 1356797302 /nfs/dbraw/zinc/79/73/02/1356797302.db2.gz ZUYHSDCTVPCQQZ-ZWKOTPCHSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](F)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C2 ZINC001393383476 1356803578 /nfs/dbraw/zinc/80/35/78/1356803578.db2.gz IOVPDTWASYUSTK-SFFUCWETSA-N 1 3 341.515 2.680 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C2 ZINC001393383476 1356803582 /nfs/dbraw/zinc/80/35/82/1356803582.db2.gz IOVPDTWASYUSTK-SFFUCWETSA-N 1 3 341.515 2.680 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@H]1C[NH2+]Cc1ccccc1 ZINC001393392741 1356812623 /nfs/dbraw/zinc/81/26/23/1356812623.db2.gz FKRHFCQLGVIZPG-PKOBYXMFSA-N 1 3 345.531 2.849 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CCCC1 ZINC001393399537 1356818084 /nfs/dbraw/zinc/81/80/84/1356818084.db2.gz ZLGZPMPAKIXLMS-BCDXTJNWSA-N 1 3 344.503 2.810 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCCC1 ZINC001393399537 1356818086 /nfs/dbraw/zinc/81/80/86/1356818086.db2.gz ZLGZPMPAKIXLMS-BCDXTJNWSA-N 1 3 344.503 2.810 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[C@H](C[NH2+]Cc2ccsc2)CC1)N(C)C ZINC001393485236 1356887516 /nfs/dbraw/zinc/88/75/16/1356887516.db2.gz DFTQTXDZZRIPKL-DJIMGWMZSA-N 1 3 337.533 2.853 10 0 EFAEHO CC(C)[N@@H+]1CCc2c(CNC(=O)C3(N(C)C)CCC3)cccc2C1 ZINC001393522190 1356917556 /nfs/dbraw/zinc/91/75/56/1356917556.db2.gz JKUQUETVZLDXBT-UHFFFAOYSA-N 1 3 329.488 2.554 10 0 EFAEHO CC(C)[N@H+]1CCc2c(CNC(=O)C3(N(C)C)CCC3)cccc2C1 ZINC001393522190 1356917559 /nfs/dbraw/zinc/91/75/59/1356917559.db2.gz JKUQUETVZLDXBT-UHFFFAOYSA-N 1 3 329.488 2.554 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](CCc2ccccc2)CC1)N(C)C ZINC001393601373 1356986992 /nfs/dbraw/zinc/98/69/92/1356986992.db2.gz LSCLRPBSFMRZLD-RTBURBONSA-N 1 3 331.504 2.540 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](CCc2ccccc2)CC1)N(C)C ZINC001393601373 1356986997 /nfs/dbraw/zinc/98/69/97/1356986997.db2.gz LSCLRPBSFMRZLD-RTBURBONSA-N 1 3 331.504 2.540 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@H+](CCC(C)(C)C)C1)N(C)C ZINC001402656248 1363896387 /nfs/dbraw/zinc/89/63/87/1363896387.db2.gz CUWCZOPRHSUHHN-DLBZAZTESA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@@H+](CCC(C)(C)C)C1)N(C)C ZINC001402656248 1363896391 /nfs/dbraw/zinc/89/63/91/1363896391.db2.gz CUWCZOPRHSUHHN-DLBZAZTESA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[N@H+](C)CC2CCC(C)CC2)C1 ZINC001393636400 1357033112 /nfs/dbraw/zinc/03/31/12/1357033112.db2.gz QPPOJAWBHQPQJE-XBMUEBEBSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[N@@H+](C)CC2CCC(C)CC2)C1 ZINC001393636400 1357033115 /nfs/dbraw/zinc/03/31/15/1357033115.db2.gz QPPOJAWBHQPQJE-XBMUEBEBSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC)([NH2+]CC2CC(F)(F)C2)CC1)N(C)C ZINC001393679873 1357073765 /nfs/dbraw/zinc/07/37/65/1357073765.db2.gz NHKUYNVOUPAUSF-HNNXBMFYSA-N 1 3 345.478 2.733 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@H]2CCCc3ccccc32)C1 ZINC001394386715 1357758572 /nfs/dbraw/zinc/75/85/72/1357758572.db2.gz CSTUCKLGUUXXRF-QRFRQXIXSA-N 1 3 343.515 2.890 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C[NH2+][C@H](C)c1ccccc1)C1CC1 ZINC001394437933 1357817873 /nfs/dbraw/zinc/81/78/73/1357817873.db2.gz CNLRZDFEWYWCOG-APWZRJJASA-N 1 3 331.504 2.914 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@@H](C)[NH2+]CC1CCC(C)(C)CC1)N(C)C ZINC001394494636 1357876651 /nfs/dbraw/zinc/87/66/51/1357876651.db2.gz IJDOPDPFQQDRRK-NVXWUHKLSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC001394565576 1357958492 /nfs/dbraw/zinc/95/84/92/1357958492.db2.gz HBCGMNMAOBQKMR-MRXNPFEDSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(Cl)s2)[C@H]1C ZINC001394670158 1357987445 /nfs/dbraw/zinc/98/74/45/1357987445.db2.gz BQHZLXZCVOQSLI-OCCSQVGLSA-N 1 3 343.924 2.821 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc(CF)cc2)C[C@@H]1C ZINC001394677805 1357995888 /nfs/dbraw/zinc/99/58/88/1357995888.db2.gz HRZCCKIYUNGJJB-MAUKXSAKSA-N 1 3 335.467 2.575 10 0 EFAEHO CC[C@@H](F)CN[C@@H]1CN(C(=O)C2CC[NH+](C(C)C)CC2)CC1(C)C ZINC001394716695 1358043754 /nfs/dbraw/zinc/04/37/54/1358043754.db2.gz XTCZGNGXJDSQOB-IAGOWNOFSA-N 1 3 341.515 2.682 10 0 EFAEHO Cc1cc(C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C2CC2)c(C)s1 ZINC001436835281 1387328296 /nfs/dbraw/zinc/32/82/96/1387328296.db2.gz VGZUTGNGBIDWLF-QGZVFWFLSA-N 1 3 337.533 2.690 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]2CN(Cc3ccccc3F)CC[C@@H]21 ZINC001436943359 1387341899 /nfs/dbraw/zinc/34/18/99/1387341899.db2.gz JIEGQIFQDZZQSF-MJGOQNOKSA-N 1 3 347.478 2.590 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]2CN(Cc3ccccc3F)CC[C@H]21 ZINC001436943358 1387342147 /nfs/dbraw/zinc/34/21/47/1387342147.db2.gz JIEGQIFQDZZQSF-IEBWSBKVSA-N 1 3 347.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@H+](CC2CCC(C)CC2)C1 ZINC001437002870 1387356516 /nfs/dbraw/zinc/35/65/16/1387356516.db2.gz LYJZITRMOMHQHB-CTWPCTMYSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@@H+](CC2CCC(C)CC2)C1 ZINC001437002870 1387356523 /nfs/dbraw/zinc/35/65/23/1387356523.db2.gz LYJZITRMOMHQHB-CTWPCTMYSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCC[N@@H+]1CC1CC1)N1CCCCC1 ZINC001437048022 1387387603 /nfs/dbraw/zinc/38/76/03/1387387603.db2.gz WOWGGNWLHOWRIY-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCC[N@H+]1CC1CC1)N1CCCCC1 ZINC001437048022 1387387605 /nfs/dbraw/zinc/38/76/05/1387387605.db2.gz WOWGGNWLHOWRIY-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccccc2)C1 ZINC001397094175 1359671424 /nfs/dbraw/zinc/67/14/24/1359671424.db2.gz RNROASSMYDBSJL-AMBYYYRHSA-N 1 3 329.488 2.544 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccccc2)C1 ZINC001397094181 1359671832 /nfs/dbraw/zinc/67/18/32/1359671832.db2.gz RNROASSMYDBSJL-RWQQGDIJSA-N 1 3 329.488 2.544 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H](CNC(=O)C[C@H]2CC[N@H+](C)C2)C1)c1ccccc1F ZINC001397094533 1359671952 /nfs/dbraw/zinc/67/19/52/1359671952.db2.gz HPKLXCSHJPTPLT-VVLHAWIVSA-N 1 3 347.478 2.713 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H](CNC(=O)C[C@H]2CC[N@@H+](C)C2)C1)c1ccccc1F ZINC001397094533 1359671956 /nfs/dbraw/zinc/67/19/56/1359671956.db2.gz HPKLXCSHJPTPLT-VVLHAWIVSA-N 1 3 347.478 2.713 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+][C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001397094256 1359672129 /nfs/dbraw/zinc/67/21/29/1359672129.db2.gz SGBNTOOYLUXRRX-JENIJYKNSA-N 1 3 331.504 2.881 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@@H]([NH2+]CC2CCC3(CC3)CC2)C1)N(C)C ZINC001397099028 1359676044 /nfs/dbraw/zinc/67/60/44/1359676044.db2.gz ORJFRGOCLWVSRD-FGTMMUONSA-N 1 3 335.536 2.781 10 0 EFAEHO CN(CC(=O)NC[C@H]1C[C@H]([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1)CC(C)(C)C ZINC001397130938 1359693718 /nfs/dbraw/zinc/69/37/18/1359693718.db2.gz SBRHVDCTCNXCKW-IEWDOMPSSA-N 1 3 349.563 2.885 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccccc2)C1)C1CCC1 ZINC001397158774 1359713309 /nfs/dbraw/zinc/71/33/09/1359713309.db2.gz OPGLOTXJMUNJBJ-ZWKOTPCHSA-N 1 3 329.488 2.545 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H]1CC[C@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001397161503 1359715147 /nfs/dbraw/zinc/71/51/47/1359715147.db2.gz XWOCBUVUDCPXOX-PKOBYXMFSA-N 1 3 343.515 2.854 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@@H]([NH2+]CC2CCCCC2)C1 ZINC001397174908 1359724697 /nfs/dbraw/zinc/72/46/97/1359724697.db2.gz RBLOQUPTLSAWMB-DLBZAZTESA-N 1 3 332.492 2.715 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)C[C@@H]2C1 ZINC001397219101 1359759283 /nfs/dbraw/zinc/75/92/83/1359759283.db2.gz PWGQAHNXXAQJJQ-UXHICEINSA-N 1 3 349.563 2.935 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)C[C@@H]2C1 ZINC001397219101 1359759288 /nfs/dbraw/zinc/75/92/88/1359759288.db2.gz PWGQAHNXXAQJJQ-UXHICEINSA-N 1 3 349.563 2.935 10 0 EFAEHO Cc1ncccc1C[NH2+][C@@H]1CCCCCN(C(=O)CN(C)C(C)C)C1 ZINC001397232394 1359771563 /nfs/dbraw/zinc/77/15/63/1359771563.db2.gz NEYHYIQQEQHTKN-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@H+](CCC(C)C)CC(C)(C)C1)N(C)C ZINC001397269507 1359803668 /nfs/dbraw/zinc/80/36/68/1359803668.db2.gz JJIPZVMBUIDISU-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@@H+](CCC(C)C)CC(C)(C)C1)N(C)C ZINC001397269507 1359803671 /nfs/dbraw/zinc/80/36/71/1359803671.db2.gz JJIPZVMBUIDISU-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](F)CCN1CC[C@@H]1CN(C)C(=O)CCC[NH+]1CCCCC1 ZINC001397554193 1359955951 /nfs/dbraw/zinc/95/59/51/1359955951.db2.gz LMPUHEIFJBTEPF-IAGOWNOFSA-N 1 3 327.488 2.533 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H]2C[C@H](CNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001397666829 1360035768 /nfs/dbraw/zinc/03/57/68/1360035768.db2.gz AHGYWPTWFPWDHO-WGSAOQKQSA-N 1 3 345.531 2.936 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]([NH2+]CC2CC3(CCC3)C2)C1)N1CCCC1 ZINC001397668048 1360037224 /nfs/dbraw/zinc/03/72/24/1360037224.db2.gz RMYUGHZORAUFBY-SAABIXHNSA-N 1 3 347.547 2.926 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]C/C=C\c1ccc(Cl)cc1)N(C)C ZINC001437164607 1387433589 /nfs/dbraw/zinc/43/35/89/1387433589.db2.gz GKTOLUITWSUYNG-GRQQHNRBSA-N 1 3 337.895 2.788 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(F)cc2C)C1)N(C)C ZINC001397731102 1360085437 /nfs/dbraw/zinc/08/54/37/1360085437.db2.gz HUAYJHNFFURNJF-IPELMVKDSA-N 1 3 349.494 2.849 10 0 EFAEHO CCC[N@@H+]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)CC(C)(C)C1 ZINC001397810100 1360162393 /nfs/dbraw/zinc/16/23/93/1360162393.db2.gz MHBDZYLPZHQOEP-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO CCC[N@H+]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)CC(C)(C)C1 ZINC001397810100 1360162396 /nfs/dbraw/zinc/16/23/96/1360162396.db2.gz MHBDZYLPZHQOEP-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+][C@@H]1CCc2c1cccc2F ZINC001437187918 1387449579 /nfs/dbraw/zinc/44/95/79/1387449579.db2.gz NPSSUHFUOQGQSW-RDTXWAMCSA-N 1 3 347.478 2.782 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCCN([C@@H]2CCCc3ccc(F)cc32)C1 ZINC001398225928 1360396119 /nfs/dbraw/zinc/39/61/19/1360396119.db2.gz FFRKFVQIDGELNJ-IEBWSBKVSA-N 1 3 347.478 2.735 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H]1CC[N@H+](Cc2c(C)cccc2C)C1 ZINC001398287802 1360443256 /nfs/dbraw/zinc/44/32/56/1360443256.db2.gz JQSDBYRXSYSHKE-IEBWSBKVSA-N 1 3 349.494 2.674 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H]1CC[N@@H+](Cc2c(C)cccc2C)C1 ZINC001398287802 1360443258 /nfs/dbraw/zinc/44/32/58/1360443258.db2.gz JQSDBYRXSYSHKE-IEBWSBKVSA-N 1 3 349.494 2.674 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001398331771 1360468536 /nfs/dbraw/zinc/46/85/36/1360468536.db2.gz GJUJPTQSROYXLQ-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001398331771 1360468539 /nfs/dbraw/zinc/46/85/39/1360468539.db2.gz GJUJPTQSROYXLQ-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC001437197537 1387457123 /nfs/dbraw/zinc/45/71/23/1387457123.db2.gz AATFMFVTCZSSKZ-OXJNMPFZSA-N 1 3 349.494 2.802 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@@H](NCc2ccccc2Cl)C2CC2)C1 ZINC001398445590 1360563870 /nfs/dbraw/zinc/56/38/70/1360563870.db2.gz LYYZKGNJPCAUDQ-RDTXWAMCSA-N 1 3 349.906 2.666 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@@H](NCc2ccccc2Cl)C2CC2)C1 ZINC001398445590 1360563873 /nfs/dbraw/zinc/56/38/73/1360563873.db2.gz LYYZKGNJPCAUDQ-RDTXWAMCSA-N 1 3 349.906 2.666 10 0 EFAEHO O=C([C@@H]1CCCC[N@@H+]1C1CCCC1)N1CC[C@H](NC/C=C/Cl)C1 ZINC001398523544 1360623716 /nfs/dbraw/zinc/62/37/16/1360623716.db2.gz CNWICCRMMFKUGV-NJNDOFCISA-N 1 3 339.911 2.727 10 0 EFAEHO O=C([C@@H]1CCCC[N@H+]1C1CCCC1)N1CC[C@H](NC/C=C/Cl)C1 ZINC001398523544 1360623717 /nfs/dbraw/zinc/62/37/17/1360623717.db2.gz CNWICCRMMFKUGV-NJNDOFCISA-N 1 3 339.911 2.727 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001437204935 1387465440 /nfs/dbraw/zinc/46/54/40/1387465440.db2.gz KOVGTPBBBOTTMK-UKRRQHHQSA-N 1 3 337.895 2.585 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NCCN(C)Cc1ccc2c(c1)CCC2 ZINC001492873976 1360654475 /nfs/dbraw/zinc/65/44/75/1360654475.db2.gz YPVHAIOIMFEZTR-CALCHBBNSA-N 1 3 343.515 2.596 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCCN(C)Cc1ccc2c(c1)CCC2 ZINC001492873976 1360654476 /nfs/dbraw/zinc/65/44/76/1360654476.db2.gz YPVHAIOIMFEZTR-CALCHBBNSA-N 1 3 343.515 2.596 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)NCCN(C)Cc1ccc2c(c1)CCC2 ZINC001492873982 1360655508 /nfs/dbraw/zinc/65/55/08/1360655508.db2.gz YPVHAIOIMFEZTR-IRXDYDNUSA-N 1 3 343.515 2.596 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@H]2CN(Cc3ccsc3)CC[C@H]21 ZINC001398587421 1360659565 /nfs/dbraw/zinc/65/95/65/1360659565.db2.gz QVRZGKRWQREYNN-QZTJIDSGSA-N 1 3 349.544 2.903 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@H]2CN(Cc3ccsc3)CC[C@H]21 ZINC001398587421 1360659567 /nfs/dbraw/zinc/65/95/67/1360659567.db2.gz QVRZGKRWQREYNN-QZTJIDSGSA-N 1 3 349.544 2.903 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccccc32)C1)N(C)C ZINC001398609049 1360668484 /nfs/dbraw/zinc/66/84/84/1360668484.db2.gz HEVYBNYYRKPHFV-UKBAYJJMSA-N 1 3 329.488 2.641 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(F)cc32)C1)N(C)C ZINC001398630049 1360679632 /nfs/dbraw/zinc/67/96/32/1360679632.db2.gz SULNSTTZDHTCGW-UKBAYJJMSA-N 1 3 347.478 2.636 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C(F)F)cc2)C1)N(C)C ZINC001398631815 1360680083 /nfs/dbraw/zinc/68/00/83/1360680083.db2.gz XNTAFGJPFPFSJO-XHSDSOJGSA-N 1 3 339.430 2.701 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)C1 ZINC001398664190 1360696726 /nfs/dbraw/zinc/69/67/26/1360696726.db2.gz IGOPDNCDKXAKAS-LZUBRRHXSA-N 1 3 341.499 2.811 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1CCC[N@H+](CC2CCC2)C1)N1CCCCCC1 ZINC001398667983 1360699587 /nfs/dbraw/zinc/69/95/87/1360699587.db2.gz GRADDUSPNZCEMZ-HKUYNNGSSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1CCC[N@@H+](CC2CCC2)C1)N1CCCCCC1 ZINC001398667983 1360699590 /nfs/dbraw/zinc/69/95/90/1360699590.db2.gz GRADDUSPNZCEMZ-HKUYNNGSSA-N 1 3 335.536 2.879 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCCN(Cc2ccsc2)C1 ZINC001398685702 1360715850 /nfs/dbraw/zinc/71/58/50/1360715850.db2.gz FTHWCDSDFPBIDN-AEFFLSMTSA-N 1 3 349.544 2.951 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCCN(Cc2ccsc2)C1 ZINC001398685702 1360715853 /nfs/dbraw/zinc/71/58/53/1360715853.db2.gz FTHWCDSDFPBIDN-AEFFLSMTSA-N 1 3 349.544 2.951 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001398706347 1360732453 /nfs/dbraw/zinc/73/24/53/1360732453.db2.gz SPNACYKLRBVEJC-HKUYNNGSSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001398706347 1360732458 /nfs/dbraw/zinc/73/24/58/1360732458.db2.gz SPNACYKLRBVEJC-HKUYNNGSSA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@H](C(=O)NC[C@H](C)[NH2+]CCc1ccccc1)N1CCCCCC1 ZINC001437212947 1387473295 /nfs/dbraw/zinc/47/32/95/1387473295.db2.gz HTFBVKJVDCREPO-ZWKOTPCHSA-N 1 3 331.504 2.588 10 0 EFAEHO COc1cccc(C[NH2+]C[C@@H]2CCCCN2C(=O)CN(C)C(C)C)c1 ZINC001398770693 1360777382 /nfs/dbraw/zinc/77/73/82/1360777382.db2.gz LZDRCLGEWJECDM-SFHVURJKSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@H](C)[NH2+]CCc1ccccc1F ZINC001437212949 1387474013 /nfs/dbraw/zinc/47/40/13/1387474013.db2.gz HXHPKMRKZYRWFM-APWZRJJASA-N 1 3 349.494 2.725 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](CCc2ccccc2)C1 ZINC001398787112 1360790455 /nfs/dbraw/zinc/79/04/55/1360790455.db2.gz DGUPOQKPGVUJDW-AZUAARDMSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](CCc2ccccc2)C1 ZINC001398787112 1360790458 /nfs/dbraw/zinc/79/04/58/1360790458.db2.gz DGUPOQKPGVUJDW-AZUAARDMSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](Cc2ccsc2)C1 ZINC001398792101 1360796093 /nfs/dbraw/zinc/79/60/93/1360796093.db2.gz LVCRRKZSBAIAJY-DOTOQJQBSA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](Cc2ccsc2)C1 ZINC001398792101 1360796097 /nfs/dbraw/zinc/79/60/97/1360796097.db2.gz LVCRRKZSBAIAJY-DOTOQJQBSA-N 1 3 337.533 2.805 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)[NH+]1CCCC1)[C@@H]1CCCN(C/C=C/Cl)C1 ZINC001398800585 1360801779 /nfs/dbraw/zinc/80/17/79/1360801779.db2.gz XSFLWBSXVBPQNW-KBUFDJFCSA-N 1 3 341.927 2.830 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@@H](C)CNC(=O)[C@@H]1CCCN1C(C)C ZINC001398929668 1360878035 /nfs/dbraw/zinc/87/80/35/1360878035.db2.gz UFHHULVWGIQOGD-PXNSSMCTSA-N 1 3 345.531 2.759 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CNC(=O)[C@H]2CCCCN2C(C)C)c(C)n1 ZINC001437217253 1387477106 /nfs/dbraw/zinc/47/71/06/1387477106.db2.gz SWJKOZLJMDAPEF-VQIMIIECSA-N 1 3 346.519 2.556 10 0 EFAEHO C[C@@H](CNC(=O)c1ccc(CC[NH+](C)C)cc1)NCc1ccsc1 ZINC001399038891 1360951459 /nfs/dbraw/zinc/95/14/59/1360951459.db2.gz TYZDYLXJUQTIKG-HNNXBMFYSA-N 1 3 345.512 2.760 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+][C@@H](C)c1cccc(F)c1 ZINC001399047217 1360956950 /nfs/dbraw/zinc/95/69/50/1360956950.db2.gz ZIZHKFZXEVWIGW-GJZGRUSLSA-N 1 3 335.467 2.855 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H](C)[NH2+]Cc1ccc(C2CC2)cc1)N(C)C ZINC001399055812 1360962328 /nfs/dbraw/zinc/96/23/28/1360962328.db2.gz WPXQBRVPPKTESS-DNVCBOLYSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2cccc(C(F)F)c2)C1 ZINC001399222079 1361081429 /nfs/dbraw/zinc/08/14/29/1361081429.db2.gz DOMCPVBOBLPPQB-INIZCTEOSA-N 1 3 339.430 2.655 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[C@H]([NH2+]Cc2cc(C)ccc2F)C1 ZINC001399270865 1361112614 /nfs/dbraw/zinc/11/26/14/1361112614.db2.gz PXACIZBXSGAAHG-ROUUACIJSA-N 1 3 349.494 2.993 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@@H]([N@H+](C)Cc2ccccc2)C1 ZINC001399285569 1361126984 /nfs/dbraw/zinc/12/69/84/1361126984.db2.gz IFNIZKLQHICADQ-RTBURBONSA-N 1 3 349.494 2.789 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC001399285569 1361126987 /nfs/dbraw/zinc/12/69/87/1361126987.db2.gz IFNIZKLQHICADQ-RTBURBONSA-N 1 3 349.494 2.789 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NCC[C@@H](C)NC/C(Cl)=C/Cl ZINC001399346093 1361163659 /nfs/dbraw/zinc/16/36/59/1361163659.db2.gz OSRUXMPAURZZIW-NKMUALHBSA-N 1 3 336.307 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NCC[C@@H](C)NC/C(Cl)=C/Cl ZINC001399346093 1361163661 /nfs/dbraw/zinc/16/36/61/1361163661.db2.gz OSRUXMPAURZZIW-NKMUALHBSA-N 1 3 336.307 2.664 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1cc(C)sc1C)N(C)C ZINC001399410931 1361203551 /nfs/dbraw/zinc/20/35/51/1361203551.db2.gz BZMWKYBXFOFDTA-MLGOLLRUSA-N 1 3 325.522 2.690 10 0 EFAEHO CC(C)c1ccccc1CN(C)CCNC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001399486061 1361268845 /nfs/dbraw/zinc/26/88/45/1361268845.db2.gz OKJSFFIOOOOFSB-FQEVSTJZSA-N 1 3 343.515 2.700 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001399564199 1361334437 /nfs/dbraw/zinc/33/44/37/1361334437.db2.gz ZYPTYUYCFMPZAL-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO COc1cccc([C@@H](C)N(C)CCNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001399565739 1361336417 /nfs/dbraw/zinc/33/64/17/1361336417.db2.gz FMKKHFPYVHMHIO-JZXOWHBKSA-N 1 3 347.503 2.535 10 0 EFAEHO COc1cccc([C@@H](C)N(C)CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001399565739 1361336421 /nfs/dbraw/zinc/33/64/21/1361336421.db2.gz FMKKHFPYVHMHIO-JZXOWHBKSA-N 1 3 347.503 2.535 10 0 EFAEHO C[C@H](c1ccc(Cl)cc1)N(C)CCNC(=O)C12CC[NH+](CC1)C2 ZINC001399644494 1361399279 /nfs/dbraw/zinc/39/92/79/1361399279.db2.gz STUJAWOYSVZSOZ-CQSZACIVSA-N 1 3 335.879 2.545 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21)Cc1ccccc1 ZINC001399722725 1361455277 /nfs/dbraw/zinc/45/52/77/1361455277.db2.gz PXGRTLGSMPTIGR-RTBURBONSA-N 1 3 329.488 2.642 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[C@H]2CCCC[N@H+]21)Cc1ccccc1 ZINC001399722725 1361455280 /nfs/dbraw/zinc/45/52/80/1361455280.db2.gz PXGRTLGSMPTIGR-RTBURBONSA-N 1 3 329.488 2.642 10 0 EFAEHO CCN(C/C=C/c1ccccc1)CCNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001399756104 1361481025 /nfs/dbraw/zinc/48/10/25/1361481025.db2.gz RGVHISAUSHGIJP-QYLKWSRPSA-N 1 3 343.515 2.868 10 0 EFAEHO CCN(C/C=C/c1ccccc1)CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001399756104 1361481028 /nfs/dbraw/zinc/48/10/28/1361481028.db2.gz RGVHISAUSHGIJP-QYLKWSRPSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCC[N@@H+]1CC1CC(C)(C)C1)N1CCCC1 ZINC001399863474 1361536370 /nfs/dbraw/zinc/53/63/70/1361536370.db2.gz DCJDDHBUBROZIN-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCC[N@H+]1CC1CC(C)(C)C1)N1CCCC1 ZINC001399863474 1361536375 /nfs/dbraw/zinc/53/63/75/1361536375.db2.gz DCJDDHBUBROZIN-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1cccc(Cl)c1CN1CC[C@@H](CNC(=O)CC[NH+](C)C)C1 ZINC001399927630 1361582414 /nfs/dbraw/zinc/58/24/14/1361582414.db2.gz JCCREFMGYHSLQM-HNNXBMFYSA-N 1 3 337.895 2.538 10 0 EFAEHO Cc1cccc(Cl)c1CN1CC[C@H](CNC(=O)CC[NH+](C)C)C1 ZINC001399927643 1361582789 /nfs/dbraw/zinc/58/27/89/1361582789.db2.gz JCCREFMGYHSLQM-OAHLLOKOSA-N 1 3 337.895 2.538 10 0 EFAEHO Cc1cccc(C)c1C[N@H+]1CC[C@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001399930424 1361585877 /nfs/dbraw/zinc/58/58/77/1361585877.db2.gz IXUHONNBCYBHFE-VQIMIIECSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+]1CC[C@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001399930424 1361585879 /nfs/dbraw/zinc/58/58/79/1361585879.db2.gz IXUHONNBCYBHFE-VQIMIIECSA-N 1 3 343.515 2.583 10 0 EFAEHO CCCN(CCNC(=O)C12CCC[NH+]1CCC2)Cc1ccsc1 ZINC001399963396 1361617083 /nfs/dbraw/zinc/61/70/83/1361617083.db2.gz WIBQCOWUULGMRD-UHFFFAOYSA-N 1 3 335.517 2.705 10 0 EFAEHO CC[C@@H](C)C[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001400026584 1361677595 /nfs/dbraw/zinc/67/75/95/1361677595.db2.gz CWUQTZCJGHAYQE-DNVCBOLYSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@@H](C)C[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001400026584 1361677597 /nfs/dbraw/zinc/67/75/97/1361677597.db2.gz CWUQTZCJGHAYQE-DNVCBOLYSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[N@H+](C1CC1)[C@H]1CCc2ccccc21)N(C)C ZINC001400038550 1361689032 /nfs/dbraw/zinc/68/90/32/1361689032.db2.gz JNHFLNMRCFLXRR-PMACEKPBSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[N@@H+](C1CC1)[C@H]1CCc2ccccc21)N(C)C ZINC001400038550 1361689037 /nfs/dbraw/zinc/68/90/37/1361689037.db2.gz JNHFLNMRCFLXRR-PMACEKPBSA-N 1 3 343.515 2.841 10 0 EFAEHO C[C@H](C(=O)N1CC[C@H](CN(C)C/C=C/Cl)C1)[NH+]1CCCCCC1 ZINC001400237241 1361873289 /nfs/dbraw/zinc/87/32/89/1361873289.db2.gz ZTZSOYYZOMIKDS-ISIQUDIPSA-N 1 3 341.927 2.784 10 0 EFAEHO Cc1ccc(C[N@@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001400250915 1361886472 /nfs/dbraw/zinc/88/64/72/1361886472.db2.gz KIAFSLRAFFNHCS-IBGZPJMESA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1ccc(C[N@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001400250915 1361886475 /nfs/dbraw/zinc/88/64/75/1361886475.db2.gz KIAFSLRAFFNHCS-IBGZPJMESA-N 1 3 345.531 2.924 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001400251934 1361887589 /nfs/dbraw/zinc/88/75/89/1361887589.db2.gz TVEPESATWKLXSD-HSALFYBXSA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001400251934 1361887593 /nfs/dbraw/zinc/88/75/93/1361887593.db2.gz TVEPESATWKLXSD-HSALFYBXSA-N 1 3 349.563 2.933 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC001400297803 1361916573 /nfs/dbraw/zinc/91/65/73/1361916573.db2.gz UWZCDMWJMXVHGY-OALUTQOASA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC001400297803 1361916580 /nfs/dbraw/zinc/91/65/80/1361916580.db2.gz UWZCDMWJMXVHGY-OALUTQOASA-N 1 3 329.488 2.642 10 0 EFAEHO CC(C)c1ccc([C@@H](C)N2CC(CNC(=O)CC[NH+](C)C)C2)cc1 ZINC001400531369 1362014617 /nfs/dbraw/zinc/01/46/17/1362014617.db2.gz WSLJVIBBXSLBQD-MRXNPFEDSA-N 1 3 331.504 2.871 10 0 EFAEHO Cc1ccccc1CN1CC(CNC(=O)[C@@H](C(C)C)[NH+]2CCCC2)C1 ZINC001400566800 1362027804 /nfs/dbraw/zinc/02/78/04/1362027804.db2.gz BYBQETOSLCCNSV-HXUWFJFHSA-N 1 3 343.515 2.663 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH+]2CC(CNC(=O)CN(C)C(C)C)C2)c1 ZINC001400573197 1362030174 /nfs/dbraw/zinc/03/01/74/1362030174.db2.gz LJAKDWKMTSYYAH-QGZVFWFLSA-N 1 3 331.504 2.753 10 0 EFAEHO CC(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001400578308 1362033297 /nfs/dbraw/zinc/03/32/97/1362033297.db2.gz OSMRLHYAQJZHNN-ROUUACIJSA-N 1 3 335.536 2.830 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](CC)[NH2+]Cc1cccc(F)c1 ZINC001400797283 1362169312 /nfs/dbraw/zinc/16/93/12/1362169312.db2.gz HVIDYFCMZSBINN-ROUUACIJSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@H](F)C[NH2+]CC1(NC(=O)[C@@H]2CCCN2C(C)C)CCCC1 ZINC001400909180 1362248449 /nfs/dbraw/zinc/24/84/49/1362248449.db2.gz PLIKORZHWSZBHO-HOTGVXAUSA-N 1 3 327.488 2.626 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC001400923036 1362263963 /nfs/dbraw/zinc/26/39/63/1362263963.db2.gz QJTGOHCVYAUVMH-ZFWWWQNUSA-N 1 3 341.446 2.850 10 0 EFAEHO CC[NH2+]Cc1ccc(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC001401071628 1362411764 /nfs/dbraw/zinc/41/17/64/1362411764.db2.gz ZSJYOVCUSCENOP-LJQANCHMSA-N 1 3 335.467 2.625 10 0 EFAEHO CC[C@@H](F)C[NH+]1CCC(CCNC(=O)CN(C)CC(C)(C)C)CC1 ZINC001401073637 1362414794 /nfs/dbraw/zinc/41/47/94/1362414794.db2.gz GFNCYOGODLVBRO-QGZVFWFLSA-N 1 3 343.531 2.931 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@H]1CNCc1cc(C)ccc1F ZINC001401090409 1362433335 /nfs/dbraw/zinc/43/33/35/1362433335.db2.gz LNEDPQUEMGKPCY-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@H]1CNCc1cc(C)ccc1F ZINC001401090409 1362433338 /nfs/dbraw/zinc/43/33/38/1362433338.db2.gz LNEDPQUEMGKPCY-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([N@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001437352586 1387573803 /nfs/dbraw/zinc/57/38/03/1387573803.db2.gz USMSBQZIDKNEIY-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([N@@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001437352586 1387573810 /nfs/dbraw/zinc/57/38/10/1387573810.db2.gz USMSBQZIDKNEIY-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@@H](C)N(C)C(=O)[C@@H]2CCCN2C)c(C)c1 ZINC001401200598 1362540399 /nfs/dbraw/zinc/54/03/99/1362540399.db2.gz JFEVAEOKDJRFCL-MJGOQNOKSA-N 1 3 331.504 2.643 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)[C@H](C)CNCc1ccc(C)cc1Cl ZINC001401263641 1362605175 /nfs/dbraw/zinc/60/51/75/1362605175.db2.gz UYQCCLMQTXNFKZ-OAHLLOKOSA-N 1 3 339.911 2.927 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)[C@H](C)CNCc1ccc(C)cc1Cl ZINC001401263641 1362605178 /nfs/dbraw/zinc/60/51/78/1362605178.db2.gz UYQCCLMQTXNFKZ-OAHLLOKOSA-N 1 3 339.911 2.927 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C[C@H](C)N(C)C(=O)CN(C)C(C)C)c1 ZINC001401266266 1362607541 /nfs/dbraw/zinc/60/75/41/1362607541.db2.gz LEBMIEZBRCFMEQ-HOTGVXAUSA-N 1 3 335.492 2.533 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]Cc1cccc(F)c1)NC(=O)CN1CC[C@@H](C)C1 ZINC001401269757 1362611945 /nfs/dbraw/zinc/61/19/45/1362611945.db2.gz CBEBIMXBAJOZDY-APWZRJJASA-N 1 3 349.494 2.788 10 0 EFAEHO CC(C)[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]CC1CC2(CCC2)C1 ZINC001401336636 1362682470 /nfs/dbraw/zinc/68/24/70/1362682470.db2.gz SYGZOQAFHDZVEL-KRWDZBQOSA-N 1 3 335.536 2.781 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)CCN(C)C(=O)CN(C)C2CCC2)c1 ZINC001401370176 1362720757 /nfs/dbraw/zinc/72/07/57/1362720757.db2.gz RLEONNRYNXLTSM-INIZCTEOSA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)CCN(C)C(=O)CN(C)C2CCC2)c1 ZINC001401370176 1362720760 /nfs/dbraw/zinc/72/07/60/1362720760.db2.gz RLEONNRYNXLTSM-INIZCTEOSA-N 1 3 347.503 2.631 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2ccc(Cl)cc21)C(=O)CC[NH+](C)C ZINC001401384401 1362737618 /nfs/dbraw/zinc/73/76/18/1362737618.db2.gz FUIBDYRZZPPSQZ-KRWDZBQOSA-N 1 3 337.895 2.669 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@H+](C)CCN(C)C(=O)CN2CCCC2)c1 ZINC001401439672 1362809552 /nfs/dbraw/zinc/80/95/52/1362809552.db2.gz PTROTGGDWLINEU-SFHVURJKSA-N 1 3 331.504 2.850 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@@H+](C)CCN(C)C(=O)CN2CCCC2)c1 ZINC001401439672 1362809555 /nfs/dbraw/zinc/80/95/55/1362809555.db2.gz PTROTGGDWLINEU-SFHVURJKSA-N 1 3 331.504 2.850 10 0 EFAEHO C[C@@H](CNCc1ccccc1F)NC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001401684830 1363024240 /nfs/dbraw/zinc/02/42/40/1363024240.db2.gz HMXYMROHYDPDNQ-KXBFYZLASA-N 1 3 347.478 2.827 10 0 EFAEHO C[C@@H](CNCc1ccccc1F)NC(=O)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001401684830 1363024243 /nfs/dbraw/zinc/02/42/43/1363024243.db2.gz HMXYMROHYDPDNQ-KXBFYZLASA-N 1 3 347.478 2.827 10 0 EFAEHO CCc1ccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)cc1 ZINC001401754099 1363088428 /nfs/dbraw/zinc/08/84/28/1363088428.db2.gz OYEXEORKEIPJPA-FRQCXROJSA-N 1 3 331.504 2.526 10 0 EFAEHO CCc1ccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1 ZINC001401754099 1363088429 /nfs/dbraw/zinc/08/84/29/1363088429.db2.gz OYEXEORKEIPJPA-FRQCXROJSA-N 1 3 331.504 2.526 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@@H](C)C2)cc1C ZINC001437401691 1387610050 /nfs/dbraw/zinc/61/00/50/1387610050.db2.gz JBTQOHPFCTYOIK-CRAIPNDOSA-N 1 3 331.504 2.630 10 0 EFAEHO COc1cccc(CN(C)C[C@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001401780056 1363119775 /nfs/dbraw/zinc/11/97/75/1363119775.db2.gz KTHQYDGLOFQPMF-FUHWJXTLSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1cccc(CN(C)C[C@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001401780056 1363119779 /nfs/dbraw/zinc/11/97/79/1363119779.db2.gz KTHQYDGLOFQPMF-FUHWJXTLSA-N 1 3 347.503 2.506 10 0 EFAEHO CCc1ccc(CN(C)C[C@H](C)NC(=O)C[C@@H]2CC[N@H+](C)C2)cc1 ZINC001401797047 1363142394 /nfs/dbraw/zinc/14/23/94/1363142394.db2.gz HTTJDXGLMYMTMK-LPHOPBHVSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(CN(C)C[C@H](C)NC(=O)C[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001401797047 1363142399 /nfs/dbraw/zinc/14/23/99/1363142399.db2.gz HTTJDXGLMYMTMK-LPHOPBHVSA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CN(C)Cc1ccccc1)[NH+]1CCCC1 ZINC001401830469 1363172580 /nfs/dbraw/zinc/17/25/80/1363172580.db2.gz SHWVQLWTLAGFCV-PKOBYXMFSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H](NC(=O)[C@H]2CCCN2C(C)C)C2CC2)cs1 ZINC001401848930 1363185783 /nfs/dbraw/zinc/18/57/83/1363185783.db2.gz SEDRPHTXUINEGI-QZTJIDSGSA-N 1 3 349.544 2.914 10 0 EFAEHO CC(C)(C(=O)N[C@H](C[NH2+]Cc1ccccc1)C1CC1)N1CCCC1 ZINC001401853924 1363189958 /nfs/dbraw/zinc/18/99/58/1363189958.db2.gz YTQCRNWVJZIQGK-GOSISDBHSA-N 1 3 329.488 2.545 10 0 EFAEHO C[C@H](C(=O)N[C@H](C[NH2+]CC1CCCC1)C1CC1)N1CCCCCC1 ZINC001401859746 1363194817 /nfs/dbraw/zinc/19/48/17/1363194817.db2.gz QAVZXZQOCHAGFB-VQIMIIECSA-N 1 3 335.536 2.926 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCN2CCC2CCCCCC2)C1 ZINC001401933668 1363256695 /nfs/dbraw/zinc/25/66/95/1363256695.db2.gz XJFPSTIXEDMUPJ-OALUTQOASA-N 1 3 335.536 2.879 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCN2CCC2CCCCCC2)C1 ZINC001401933668 1363256699 /nfs/dbraw/zinc/25/66/99/1363256699.db2.gz XJFPSTIXEDMUPJ-OALUTQOASA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H]([NH2+]C1(CNC(=O)CN(C)C2CCC2)CC1)c1ccc(F)cc1 ZINC001401950045 1363269683 /nfs/dbraw/zinc/26/96/83/1363269683.db2.gz RDPVSPKVKDYWMO-GOSISDBHSA-N 1 3 347.478 3.000 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@H+](CC2CCC2)C1 ZINC001401990543 1363307981 /nfs/dbraw/zinc/30/79/81/1363307981.db2.gz UCCANJUPPXWSLV-RTBURBONSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@@H+](CC2CCC2)C1 ZINC001401990543 1363307988 /nfs/dbraw/zinc/30/79/88/1363307988.db2.gz UCCANJUPPXWSLV-RTBURBONSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@]2(CC[N@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001402014243 1363330804 /nfs/dbraw/zinc/33/08/04/1363330804.db2.gz NNWQAZQPCBKBKH-OAQYLSRUSA-N 1 3 347.547 2.833 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@]2(CC[N@@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001402014243 1363330808 /nfs/dbraw/zinc/33/08/08/1363330808.db2.gz NNWQAZQPCBKBKH-OAQYLSRUSA-N 1 3 347.547 2.833 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)[C@@H](C)C1 ZINC001402069600 1363375483 /nfs/dbraw/zinc/37/54/83/1363375483.db2.gz UKGPFGAMZDTKMV-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H]1CC[N@H+](Cc2cc(C)ccc2C)C1 ZINC001402162705 1363470384 /nfs/dbraw/zinc/47/03/84/1363470384.db2.gz HQDIMZSIBBOAAQ-RTBURBONSA-N 1 3 349.494 2.674 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H]1CC[N@@H+](Cc2cc(C)ccc2C)C1 ZINC001402162705 1363470387 /nfs/dbraw/zinc/47/03/87/1363470387.db2.gz HQDIMZSIBBOAAQ-RTBURBONSA-N 1 3 349.494 2.674 10 0 EFAEHO CC[C@@H](F)CN1CCC(C)(CNC(=O)CC[C@@H]2CCC[N@@H+]2C)CC1 ZINC001402193284 1363500875 /nfs/dbraw/zinc/50/08/75/1363500875.db2.gz WVJAUAIUNPFOGW-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](F)CN1CCC(C)(CNC(=O)CC[C@@H]2CCC[N@H+]2C)CC1 ZINC001402193284 1363500878 /nfs/dbraw/zinc/50/08/78/1363500878.db2.gz WVJAUAIUNPFOGW-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CCC2CCCC2)C1)N1CCCC1 ZINC001402225136 1363545982 /nfs/dbraw/zinc/54/59/82/1363545982.db2.gz FZQXWLVYNIBUKI-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CCC2CCCC2)C1)N1CCCC1 ZINC001402225136 1363545986 /nfs/dbraw/zinc/54/59/86/1363545986.db2.gz FZQXWLVYNIBUKI-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](c1ccccc1F)N1CCC2(C[C@@H]2NC(=O)CC[NH+](C)C)CC1 ZINC001402245709 1363566322 /nfs/dbraw/zinc/56/63/22/1363566322.db2.gz QSIDYALZSXWOPM-QAPCUYQASA-N 1 3 347.478 2.809 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1cccc(C)c1)C1CC1 ZINC001402288767 1363588186 /nfs/dbraw/zinc/58/81/86/1363588186.db2.gz GQXYHLZLYHLPEX-UXHICEINSA-N 1 3 343.515 2.854 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](CNC(=O)CN1CC[C@@H](C)C1)C1CC1 ZINC001402319192 1363603037 /nfs/dbraw/zinc/60/30/37/1363603037.db2.gz AVXJCCIXFVVISG-OXQOHEQNSA-N 1 3 343.515 2.575 10 0 EFAEHO CC(C)(C(=O)NC[C@H]([NH2+]CC1CCCCC1)C1CC1)N1CCCC1 ZINC001402328841 1363608125 /nfs/dbraw/zinc/60/81/25/1363608125.db2.gz LITXBNNBIUNSQB-SFHVURJKSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1cccc(F)c1)C2 ZINC001402406963 1363666502 /nfs/dbraw/zinc/66/65/02/1363666502.db2.gz HOJFJVFTAAQRLL-WDSOQIARSA-N 1 3 347.478 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1cccc(F)c1)C2 ZINC001402406963 1363666505 /nfs/dbraw/zinc/66/65/05/1363666505.db2.gz HOJFJVFTAAQRLL-WDSOQIARSA-N 1 3 347.478 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([C@H](C)[NH2+]C/C=C/c2ccccc2)C1 ZINC001402407651 1363667128 /nfs/dbraw/zinc/66/71/28/1363667128.db2.gz KZWQNWBSTPJSKB-QYLKWSRPSA-N 1 3 343.515 2.867 10 0 EFAEHO CC[C@@H](F)CN(C)C[C@H]1CCCN(C(=O)CC[NH+]2CCCCC2)C1 ZINC001402409064 1363668941 /nfs/dbraw/zinc/66/89/41/1363668941.db2.gz QNJLHQNVLJDXJI-QZTJIDSGSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2ccc(CC)cc2)C1 ZINC001402411836 1363671581 /nfs/dbraw/zinc/67/15/81/1363671581.db2.gz OGOPIUUHUMJEOZ-XLIONFOSSA-N 1 3 345.531 2.775 10 0 EFAEHO CC[C@H](C)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)Cc1nc[nH]c1C)C2 ZINC001402444247 1363696720 /nfs/dbraw/zinc/69/67/20/1363696720.db2.gz YLKHXHIRQSAANN-LLLHUVSDSA-N 1 3 332.492 2.666 10 0 EFAEHO CC[C@H](C)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)Cc1nc[nH]c1C)C2 ZINC001402444247 1363696722 /nfs/dbraw/zinc/69/67/22/1363696722.db2.gz YLKHXHIRQSAANN-LLLHUVSDSA-N 1 3 332.492 2.666 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](NCc2cc(C)ccc2F)C1)[NH+](CC)CC ZINC001402453401 1363703313 /nfs/dbraw/zinc/70/33/13/1363703313.db2.gz UJWLTUGFFLWUJQ-HKUYNNGSSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cccc(C[NH+]2CCC3(CN(C(=O)CN(C)C(C)C)C3)CC2)c1 ZINC001402499586 1363742239 /nfs/dbraw/zinc/74/22/39/1363742239.db2.gz UXZAFAHUZGVOSL-UHFFFAOYSA-N 1 3 343.515 2.760 10 0 EFAEHO CCC[N@@H+]1CCc2c(CNC(=O)CN3[C@H](C)CC[C@H]3C)cccc2C1 ZINC001402522252 1363758250 /nfs/dbraw/zinc/75/82/50/1363758250.db2.gz UQDVSMPDLIXVKY-IAGOWNOFSA-N 1 3 343.515 2.944 10 0 EFAEHO CCC[N@H+]1CCc2c(CNC(=O)CN3[C@H](C)CC[C@H]3C)cccc2C1 ZINC001402522252 1363758254 /nfs/dbraw/zinc/75/82/54/1363758254.db2.gz UQDVSMPDLIXVKY-IAGOWNOFSA-N 1 3 343.515 2.944 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C\Cl)[NH+](CC)CC ZINC001402547070 1363776876 /nfs/dbraw/zinc/77/68/76/1363776876.db2.gz IAWYMMAXHFSWOS-QLXVOUISSA-N 1 3 341.927 2.971 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2ccc3cc[nH]c3c2)CCC1 ZINC001402572643 1363801081 /nfs/dbraw/zinc/80/10/81/1363801081.db2.gz AMTQIICQMUUCCQ-UHFFFAOYSA-N 1 3 342.487 2.637 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001402593009 1363819255 /nfs/dbraw/zinc/81/92/55/1363819255.db2.gz MWWSKAPKQCOERS-HZSPNIEDSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]21 ZINC001402583095 1363811624 /nfs/dbraw/zinc/81/16/24/1363811624.db2.gz QRRBWURDTXEFLQ-WOJBJXKFSA-N 1 3 343.515 2.840 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]21 ZINC001402583095 1363811628 /nfs/dbraw/zinc/81/16/28/1363811628.db2.gz QRRBWURDTXEFLQ-WOJBJXKFSA-N 1 3 343.515 2.840 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(Cl)c2)C1)N(C)C ZINC001402591853 1363818033 /nfs/dbraw/zinc/81/80/33/1363818033.db2.gz MYOGZPDARMELAO-KKBVYLPWSA-N 1 3 337.895 2.978 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001402593016 1363818763 /nfs/dbraw/zinc/81/87/63/1363818763.db2.gz MWWSKAPKQCOERS-MJBXVCDLSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001402593016 1363818765 /nfs/dbraw/zinc/81/87/65/1363818765.db2.gz MWWSKAPKQCOERS-MJBXVCDLSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001402593009 1363819254 /nfs/dbraw/zinc/81/92/54/1363819254.db2.gz MWWSKAPKQCOERS-HZSPNIEDSA-N 1 3 348.318 2.663 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+]CCc3ccccc3Cl)C2)CCC1 ZINC001402606383 1363829011 /nfs/dbraw/zinc/82/90/11/1363829011.db2.gz XPBRCDHXDFQDGC-IYBDPMFKSA-N 1 3 349.906 2.604 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@H+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001402612022 1363835073 /nfs/dbraw/zinc/83/50/73/1363835073.db2.gz MQSSGLKNTFSADP-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@@H+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001402612022 1363835078 /nfs/dbraw/zinc/83/50/78/1363835078.db2.gz MQSSGLKNTFSADP-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc(Cl)c2F)C1)N(C)C ZINC001402632688 1363861023 /nfs/dbraw/zinc/86/10/23/1363861023.db2.gz PSIJRSDHVLLXQG-VNHYZAJKSA-N 1 3 341.858 2.556 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2F)C1 ZINC001402645255 1363877793 /nfs/dbraw/zinc/87/77/93/1363877793.db2.gz SOGBAKLKNWMGBB-GASCZTMLSA-N 1 3 341.858 2.556 10 0 EFAEHO CN(CCC[N@H+](C)CC1CCC2(CC2)CC1)C(=O)Cc1c[nH]cn1 ZINC001402659570 1363901528 /nfs/dbraw/zinc/90/15/28/1363901528.db2.gz RDDSDHFOZSKGRQ-UHFFFAOYSA-N 1 3 332.492 2.703 10 0 EFAEHO CN(CCC[N@@H+](C)CC1CCC2(CC2)CC1)C(=O)Cc1c[nH]cn1 ZINC001402659570 1363901532 /nfs/dbraw/zinc/90/15/32/1363901532.db2.gz RDDSDHFOZSKGRQ-UHFFFAOYSA-N 1 3 332.492 2.703 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CCC[N@H+](CC2CCC(C)CC2)C1 ZINC001402687219 1363936495 /nfs/dbraw/zinc/93/64/95/1363936495.db2.gz KHRHPZMDQUNGQZ-CTWPCTMYSA-N 1 3 337.552 2.983 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CCC[N@@H+](CC2CCC(C)CC2)C1 ZINC001402687219 1363936497 /nfs/dbraw/zinc/93/64/97/1363936497.db2.gz KHRHPZMDQUNGQZ-CTWPCTMYSA-N 1 3 337.552 2.983 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@]2(CCN(Cc3ccccc3F)C2)C1 ZINC001402728246 1363971839 /nfs/dbraw/zinc/97/18/39/1363971839.db2.gz ZTJRJXASJHEGRU-HXUWFJFHSA-N 1 3 347.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1C[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001402759616 1364007184 /nfs/dbraw/zinc/00/71/84/1364007184.db2.gz TWQIZRCDVFVHMO-HZPDHXFCSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC(C)([NH2+]CCC(C)(C)C)CC1)N(C)C ZINC001402770871 1364019005 /nfs/dbraw/zinc/01/90/05/1364019005.db2.gz MPUJXHONWCPUSZ-INIZCTEOSA-N 1 3 325.541 2.980 10 0 EFAEHO CCc1cccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001402777611 1364025265 /nfs/dbraw/zinc/02/52/65/1364025265.db2.gz XHSXSZNFAFVWNA-LPHOPBHVSA-N 1 3 331.504 2.526 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001402778001 1364026637 /nfs/dbraw/zinc/02/66/37/1364026637.db2.gz ZMGCGBPEVQLLAM-MJGOQNOKSA-N 1 3 331.504 2.580 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1[C@H]2C[N@@H+]([C@@H](CC)c3ccc(F)cc3)C[C@H]21)N(C)C ZINC001402801856 1364050451 /nfs/dbraw/zinc/05/04/51/1364050451.db2.gz YEAGCMZDRKPLGX-ZWJWXYIHSA-N 1 3 347.478 2.663 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1[C@H]2C[N@H+]([C@@H](CC)c3ccc(F)cc3)C[C@H]21)N(C)C ZINC001402801856 1364050454 /nfs/dbraw/zinc/05/04/54/1364050454.db2.gz YEAGCMZDRKPLGX-ZWJWXYIHSA-N 1 3 347.478 2.663 10 0 EFAEHO C[C@@H](CCNC(=O)[C@@H]1CCCN1C)[NH2+]Cc1ccc(F)cc1Cl ZINC001402819575 1364066953 /nfs/dbraw/zinc/06/69/53/1364066953.db2.gz OXJUOSOVJGLBSQ-LRDDRELGSA-N 1 3 341.858 2.558 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC1CCC([NH2+]C/C=C/Cl)CC1 ZINC001402835814 1364081036 /nfs/dbraw/zinc/08/10/36/1364081036.db2.gz SQJSRVAMJOZEHV-VUQPMBRBSA-N 1 3 327.900 2.629 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](C)CCNC(=O)CN1CC[C@@H](C)C1 ZINC001402841673 1364084602 /nfs/dbraw/zinc/08/46/02/1364084602.db2.gz RHRDGUSQYIGSSP-QAPCUYQASA-N 1 3 331.504 2.630 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]CCc1ccccc1 ZINC001402844326 1364086395 /nfs/dbraw/zinc/08/63/95/1364086395.db2.gz SXCLNMCHRBOEOY-ICSRJNTNSA-N 1 3 345.531 2.976 10 0 EFAEHO CCC[N@H+](C)C[C@@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001402911254 1364127528 /nfs/dbraw/zinc/12/75/28/1364127528.db2.gz ANQWDKVXTLINFE-YJBOKZPZSA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@@H+](C)C[C@@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001402911254 1364127529 /nfs/dbraw/zinc/12/75/29/1364127529.db2.gz ANQWDKVXTLINFE-YJBOKZPZSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H]2CC[N@H+](CC3CCC3)C2)C1 ZINC001402919562 1364134178 /nfs/dbraw/zinc/13/41/78/1364134178.db2.gz AKPVRGPMSSZUAM-OALUTQOASA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H]2CC[N@@H+](CC3CCC3)C2)C1 ZINC001402919562 1364134180 /nfs/dbraw/zinc/13/41/80/1364134180.db2.gz AKPVRGPMSSZUAM-OALUTQOASA-N 1 3 335.536 2.687 10 0 EFAEHO CCc1cccc(C[NH2+]CC2CC(NC(=O)CN(C)C3CCC3)C2)c1 ZINC001402924677 1364139685 /nfs/dbraw/zinc/13/96/85/1364139685.db2.gz NLIGNXIDYLQSLS-UHFFFAOYSA-N 1 3 343.515 2.718 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H](C)[C@@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001402985991 1364182959 /nfs/dbraw/zinc/18/29/59/1364182959.db2.gz CLKCMDGMWSSTLK-LSDHHAIUSA-N 1 3 335.467 2.601 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCCC1)[C@H](C)[NH2+]CCc1ccccc1 ZINC001402989251 1364186335 /nfs/dbraw/zinc/18/63/35/1364186335.db2.gz YZYFFZKCYCZCLU-ROUUACIJSA-N 1 3 345.531 2.976 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cccc2ccccc21 ZINC001402997102 1364194589 /nfs/dbraw/zinc/19/45/89/1364194589.db2.gz HXPCEMSYXVGDMQ-IAGOWNOFSA-N 1 3 339.483 2.776 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)CC(C)(C)C)c1 ZINC001403003617 1364201744 /nfs/dbraw/zinc/20/17/44/1364201744.db2.gz JVZUHPDPRDMKPR-IRXDYDNUSA-N 1 3 333.520 2.956 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)CNC(=O)[C@H]2CCCCN2C(C)C)cs1 ZINC001403051781 1364255945 /nfs/dbraw/zinc/25/59/45/1364255945.db2.gz PRBLDERVJVUPME-RHSMWYFYSA-N 1 3 337.533 2.914 10 0 EFAEHO COc1cccc(CN(C)[C@H](C)CNC(=O)[C@@H]2CCC[N@@H+]2C(C)C)c1 ZINC001403111200 1364322290 /nfs/dbraw/zinc/32/22/90/1364322290.db2.gz DQCRBPRLAQCKRI-APWZRJJASA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc(CN(C)[C@H](C)CNC(=O)[C@@H]2CCC[N@H+]2C(C)C)c1 ZINC001403111200 1364322295 /nfs/dbraw/zinc/32/22/95/1364322295.db2.gz DQCRBPRLAQCKRI-APWZRJJASA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)[C@@H](C)CNC(=O)CN(C)C(C)C)c1 ZINC001403230411 1364447172 /nfs/dbraw/zinc/44/71/72/1364447172.db2.gz PQPSZCIZQVIFTC-JKSUJKDBSA-N 1 3 335.492 2.533 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)[C@@H](C)CNC(=O)CN(C)C(C)C)c1 ZINC001403230411 1364447178 /nfs/dbraw/zinc/44/71/78/1364447178.db2.gz PQPSZCIZQVIFTC-JKSUJKDBSA-N 1 3 335.492 2.533 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]CC1CCCC1 ZINC001403266842 1364478977 /nfs/dbraw/zinc/47/89/77/1364478977.db2.gz VOSREEVYZGBSBI-HKUYNNGSSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)[C@H]1CCCCN1C)[NH2+]Cc1ccccn1 ZINC001403272985 1364486073 /nfs/dbraw/zinc/48/60/73/1364486073.db2.gz ZSUMOMQMMBKCSS-RTBURBONSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C1C[NH+](CCC2CCCCC2)C1)N(C)C ZINC001403314570 1364531249 /nfs/dbraw/zinc/53/12/49/1364531249.db2.gz AYMANTBYWXQMLL-VQIMIIECSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CCCCC[C@@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001403325103 1364542220 /nfs/dbraw/zinc/54/22/20/1364542220.db2.gz VVBMMFHLEBTSGR-IAGOWNOFSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CCCCC[C@@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001403325103 1364542226 /nfs/dbraw/zinc/54/22/26/1364542226.db2.gz VVBMMFHLEBTSGR-IAGOWNOFSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1C[NH+](CC2CCC(C)(C)CC2)C1 ZINC001403341683 1364555984 /nfs/dbraw/zinc/55/59/84/1364555984.db2.gz DEOOXEAKSCLATQ-INIZCTEOSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001403350138 1364561020 /nfs/dbraw/zinc/56/10/20/1364561020.db2.gz KMUOUEANBQAMTN-YLJYHZDGSA-N 1 3 345.531 2.889 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@H+](CCCF)CC1(C)C)N1CCCCC1 ZINC001403392989 1364598082 /nfs/dbraw/zinc/59/80/82/1364598082.db2.gz UNINODOJWCKIDD-DLBZAZTESA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@@H+](CCCF)CC1(C)C)N1CCCCC1 ZINC001403392989 1364598084 /nfs/dbraw/zinc/59/80/84/1364598084.db2.gz UNINODOJWCKIDD-DLBZAZTESA-N 1 3 341.515 2.683 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC2(C1)CCCN(C/C=C/c1ccccc1)C2 ZINC001403410645 1364613068 /nfs/dbraw/zinc/61/30/68/1364613068.db2.gz NNHSIYDEJWVSTR-UXBLZVDNSA-N 1 3 341.499 2.576 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)C1 ZINC001403418099 1364622493 /nfs/dbraw/zinc/62/24/93/1364622493.db2.gz PNKDHWVVYBHTFY-RZDIXWSQSA-N 1 3 347.478 2.603 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]CCc1ccccc1 ZINC001403448080 1364650617 /nfs/dbraw/zinc/65/06/17/1364650617.db2.gz SXCLNMCHRBOEOY-QUCCMNQESA-N 1 3 345.531 2.976 10 0 EFAEHO C[NH+]1CCC(CC(=O)N[C@H]2C[C@H](CNC/C(Cl)=C/Cl)C2)CC1 ZINC001403452334 1364653957 /nfs/dbraw/zinc/65/39/57/1364653957.db2.gz SVXIMUCVLSQYAA-WQIUSWLNSA-N 1 3 348.318 2.522 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@@H](CC)N(C)C)C1 ZINC001403456580 1364658881 /nfs/dbraw/zinc/65/88/81/1364658881.db2.gz JDWCWNWSUROWMA-ATZDWAIDSA-N 1 3 331.504 2.574 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC001403459386 1364660397 /nfs/dbraw/zinc/66/03/97/1364660397.db2.gz KZCNSEUNTSTAAG-SPYBWZPUSA-N 1 3 347.478 2.638 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C2CC2)N(C)C(=O)CN(C)C(C)C)c(C)c1 ZINC001403520399 1364724438 /nfs/dbraw/zinc/72/44/38/1364724438.db2.gz XEQPUCZBALTEEH-FQEVSTJZSA-N 1 3 345.531 2.970 10 0 EFAEHO CCCc1ccc(CN(C)CCNC(=O)[C@@H]2C[NH+]3CCC2CC3)cc1 ZINC001403564137 1364765902 /nfs/dbraw/zinc/76/59/02/1364765902.db2.gz KWUMTSPEKWVLIX-HXUWFJFHSA-N 1 3 343.515 2.529 10 0 EFAEHO C[C@H](CN(C)C(=O)C[C@H]1CC[N@H+](C)C1)NCc1cc2ccccc2o1 ZINC001403605058 1364809322 /nfs/dbraw/zinc/80/93/22/1364809322.db2.gz CJDBBOKMELVHQY-HZPDHXFCSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@H](CN(C)C(=O)C[C@H]1CC[N@@H+](C)C1)NCc1cc2ccccc2o1 ZINC001403605058 1364809324 /nfs/dbraw/zinc/80/93/24/1364809324.db2.gz CJDBBOKMELVHQY-HZPDHXFCSA-N 1 3 343.471 2.711 10 0 EFAEHO CC[C@H](N[C@H](C)CN(C)C(=O)CC[NH+](C)C)c1ccc(F)cc1F ZINC001403607911 1364812377 /nfs/dbraw/zinc/81/23/77/1364812377.db2.gz XLMAIVLBIVUPKD-DYVFJYSZSA-N 1 3 341.446 2.804 10 0 EFAEHO C[C@H](CN(C)C(=O)C[C@H]1CC[N@H+](C)C1)NCc1ccccc1Cl ZINC001403615922 1364819635 /nfs/dbraw/zinc/81/96/35/1364819635.db2.gz QIQJNBUDVNPMNU-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CN(C)C(=O)C[C@H]1CC[N@@H+](C)C1)NCc1ccccc1Cl ZINC001403615922 1364819640 /nfs/dbraw/zinc/81/96/40/1364819640.db2.gz QIQJNBUDVNPMNU-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(F)cc1C ZINC001403620897 1364823642 /nfs/dbraw/zinc/82/36/42/1364823642.db2.gz IFPSHMMBBXOEKR-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(C)CCNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001403658514 1364852676 /nfs/dbraw/zinc/85/26/76/1364852676.db2.gz BMUAGPPWIFVDIM-ZOBUZTSGSA-N 1 3 335.467 2.665 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(C)CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001403658514 1364852681 /nfs/dbraw/zinc/85/26/81/1364852681.db2.gz BMUAGPPWIFVDIM-ZOBUZTSGSA-N 1 3 335.467 2.665 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@@H]2CCC[C@H]3CCC[N@@H+]32)c1 ZINC001403701356 1364874208 /nfs/dbraw/zinc/87/42/08/1364874208.db2.gz RURUGYYMZKMJCH-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@@H]2CCC[C@H]3CCC[N@H+]32)c1 ZINC001403701356 1364874214 /nfs/dbraw/zinc/87/42/14/1364874214.db2.gz RURUGYYMZKMJCH-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@H]2CCC[C@@H]3CCC[N@@H+]32)c1 ZINC001403701442 1364874964 /nfs/dbraw/zinc/87/49/64/1364874964.db2.gz RURUGYYMZKMJCH-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@H]2CCC[C@@H]3CCC[N@H+]32)c1 ZINC001403701442 1364874970 /nfs/dbraw/zinc/87/49/70/1364874970.db2.gz RURUGYYMZKMJCH-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@@H]2CCC[C@@H]3CCC[N@@H+]32)c1 ZINC001403701368 1364875195 /nfs/dbraw/zinc/87/51/95/1364875195.db2.gz RURUGYYMZKMJCH-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@@H]2CCC[C@@H]3CCC[N@H+]32)c1 ZINC001403701368 1364875198 /nfs/dbraw/zinc/87/51/98/1364875198.db2.gz RURUGYYMZKMJCH-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]Cc2ccsc2)CN1C(=O)CN(C)CC(C)(C)C ZINC001403730979 1364889758 /nfs/dbraw/zinc/88/97/58/1364889758.db2.gz DAZVGACSVXQIRL-GDBMZVCRSA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CC2CCC(F)(F)CC2)[C@H]1C ZINC001403740928 1364894798 /nfs/dbraw/zinc/89/47/98/1364894798.db2.gz GJNIRZYGCUFUQR-GDBMZVCRSA-N 1 3 345.478 2.731 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H](C[NH2+]CC3CC4(CCC4)C3)C2)CCC1 ZINC001403811969 1364967702 /nfs/dbraw/zinc/96/77/02/1364967702.db2.gz XWWNWTPWALNKEC-WMZOPIPTSA-N 1 3 347.547 2.926 10 0 EFAEHO CC[C@@H](C(=O)N(CC[N@H+](C)CC1CC(C)(C)C1)C(C)C)N(C)C ZINC001403933298 1365062476 /nfs/dbraw/zinc/06/24/76/1365062476.db2.gz FCZMDHYQQBSFMO-KRWDZBQOSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C1CC[NH+](CC2CC(C)C2)CC1)N(C)C ZINC001403970668 1365117584 /nfs/dbraw/zinc/11/75/84/1365117584.db2.gz DHNYUJZEPBRVQD-MPLMCADHSA-N 1 3 337.552 2.835 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C1CC[NH+](CC2CCCC2)CC1)N(C)C ZINC001403976373 1365123087 /nfs/dbraw/zinc/12/30/87/1365123087.db2.gz QWDOVVOAIKHQDT-APWZRJJASA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)CCC[N@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001437517505 1387720696 /nfs/dbraw/zinc/72/06/96/1387720696.db2.gz PBYMUOGWQZPUOX-SFHVURJKSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)CCC[N@@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001437517505 1387720701 /nfs/dbraw/zinc/72/07/01/1387720701.db2.gz PBYMUOGWQZPUOX-SFHVURJKSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C1CCN(C/C=C/Cl)CC1)[NH+](C)C ZINC001403981459 1365129490 /nfs/dbraw/zinc/12/94/90/1365129490.db2.gz DXJKBDXQOBFABC-IVRLUWICSA-N 1 3 329.916 2.542 10 0 EFAEHO CCCC[NH+]1CCC([C@H](C)NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001403994806 1365146143 /nfs/dbraw/zinc/14/61/43/1365146143.db2.gz MGOKECGTNYKOIU-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2ccc(CF)cc2)C1)N(C)C ZINC001404016228 1365170640 /nfs/dbraw/zinc/17/06/40/1365170640.db2.gz KCXNAWPYIISFAR-DAWZGUTISA-N 1 3 335.467 2.575 10 0 EFAEHO CC(C)[NH2+]Cc1ccc(CNC(=O)CN2[C@H](C)CC[C@@H]2C)c(F)c1 ZINC001404026523 1365184471 /nfs/dbraw/zinc/18/44/71/1365184471.db2.gz CCYKOXMZPVDKFU-GASCZTMLSA-N 1 3 335.467 2.813 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CC[C@@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001404069891 1365228491 /nfs/dbraw/zinc/22/84/91/1365228491.db2.gz BTQXROWCBOFOOC-MSOLQXFVSA-N 1 3 343.515 2.529 10 0 EFAEHO CCc1ccccc1C[N@H+]1CC[C@@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001404069891 1365228497 /nfs/dbraw/zinc/22/84/97/1365228497.db2.gz BTQXROWCBOFOOC-MSOLQXFVSA-N 1 3 343.515 2.529 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@H+](CC2CC(C)(C)C2)C1)CC(C)(C)C ZINC001404069528 1365228938 /nfs/dbraw/zinc/22/89/38/1365228938.db2.gz AVHDKIFKIMWXFI-INIZCTEOSA-N 1 3 337.552 2.839 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@@H+](CC2CC(C)(C)C2)C1)CC(C)(C)C ZINC001404069528 1365228944 /nfs/dbraw/zinc/22/89/44/1365228944.db2.gz AVHDKIFKIMWXFI-INIZCTEOSA-N 1 3 337.552 2.839 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN[C@H](C)c2ccccc2F)CC[N@@H+]1C ZINC001404330287 1365454832 /nfs/dbraw/zinc/45/48/32/1365454832.db2.gz SQFZPYXKPFYFRM-UWWQBHOKSA-N 1 3 335.467 2.665 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN[C@H](C)c2ccccc2F)CC[N@H+]1C ZINC001404330287 1365454836 /nfs/dbraw/zinc/45/48/36/1365454836.db2.gz SQFZPYXKPFYFRM-UWWQBHOKSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)(C(=O)NC[C@H]([NH2+]CC1CC1)c1ccccc1)N1CCCC1 ZINC001404395429 1365499212 /nfs/dbraw/zinc/49/92/12/1365499212.db2.gz YKQZZXSMUXYNJW-SFHVURJKSA-N 1 3 329.488 2.718 10 0 EFAEHO CC[C@@H](C(=O)NCC1CN([C@H]2CCc3ccccc32)C1)[NH+](CC)CC ZINC001404907870 1365899591 /nfs/dbraw/zinc/89/95/91/1365899591.db2.gz OMSCEHMSLJLIQY-PMACEKPBSA-N 1 3 343.515 2.842 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](C)Cc1ccc(C2CC2)cc1 ZINC001437571317 1387784519 /nfs/dbraw/zinc/78/45/19/1387784519.db2.gz VMMMPVUZQGYDKT-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](C)Cc1ccc(C2CC2)cc1 ZINC001437571317 1387784522 /nfs/dbraw/zinc/78/45/22/1387784522.db2.gz VMMMPVUZQGYDKT-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@@H]1CCN(Cc2cc3ccccc3o2)C1 ZINC001405187167 1366097600 /nfs/dbraw/zinc/09/76/00/1366097600.db2.gz YRBZCQHWECHYRG-QGZVFWFLSA-N 1 3 343.471 2.807 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1ccc(F)cc1 ZINC001405251666 1366118705 /nfs/dbraw/zinc/11/87/05/1366118705.db2.gz JUXYBEALOXDVPC-QZTJIDSGSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccc(C)nc1C ZINC001405262222 1366123397 /nfs/dbraw/zinc/12/33/97/1366123397.db2.gz UIGCJGIPBQQODV-RBUKOAKNSA-N 1 3 346.519 2.556 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(C)cc1C ZINC001405301198 1366139589 /nfs/dbraw/zinc/13/95/89/1366139589.db2.gz JLZVQDCIHHSSSQ-APWZRJJASA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001405304424 1366140889 /nfs/dbraw/zinc/14/08/89/1366140889.db2.gz MTVNGGZLXWKLOC-UZLBHIALSA-N 1 3 343.515 2.502 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)NCc1cccc(C(C)C)n1 ZINC001405333366 1366150251 /nfs/dbraw/zinc/15/02/51/1366150251.db2.gz IADJSUYBUNNWMJ-SJORKVTESA-N 1 3 346.519 2.531 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)NCc1cccc(C(C)C)n1 ZINC001405333366 1366150255 /nfs/dbraw/zinc/15/02/55/1366150255.db2.gz IADJSUYBUNNWMJ-SJORKVTESA-N 1 3 346.519 2.531 10 0 EFAEHO CC[C@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)NCc1cc2ccccc2o1 ZINC001405348034 1366156037 /nfs/dbraw/zinc/15/60/37/1366156037.db2.gz WKGXKGPGIRNWDH-DOTOQJQBSA-N 1 3 343.471 2.759 10 0 EFAEHO CC[C@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)NCc1cc2ccccc2o1 ZINC001405348034 1366156038 /nfs/dbraw/zinc/15/60/38/1366156038.db2.gz WKGXKGPGIRNWDH-DOTOQJQBSA-N 1 3 343.471 2.759 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H](C(C)C)[NH+]1CCCCC1)NCc1ccccn1 ZINC001405367762 1366166336 /nfs/dbraw/zinc/16/63/36/1366166336.db2.gz KZXVELCWQXOLSU-HKUYNNGSSA-N 1 3 346.519 2.577 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@@H]1CCc2ccccc21 ZINC001405608870 1366312607 /nfs/dbraw/zinc/31/26/07/1366312607.db2.gz VJDPBOQGAARESS-IEBWSBKVSA-N 1 3 329.488 2.595 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+]Cc1cc(Cl)ccc1F ZINC001405726036 1366366924 /nfs/dbraw/zinc/36/69/24/1366366924.db2.gz YWKNAVHWQQEXHS-CYBMUJFWSA-N 1 3 343.874 2.661 10 0 EFAEHO CC(C)Oc1ccccc1C[NH2+]C[C@@H](C)N(C)C(=O)[C@@H]1CCCN1C ZINC001405787992 1366415717 /nfs/dbraw/zinc/41/57/17/1366415717.db2.gz AATARCBZGBRPBL-AEFFLSMTSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C[C@@H](C)N(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001405833470 1366448780 /nfs/dbraw/zinc/44/87/80/1366448780.db2.gz QLDIBRRDQHNVPP-HZPDHXFCSA-N 1 3 347.503 2.677 10 0 EFAEHO Cc1cccnc1CNC[C@@H](C)N(C)C(=O)[C@H]1CCCC[N@H+]1C(C)C ZINC001405868306 1366477538 /nfs/dbraw/zinc/47/75/38/1366477538.db2.gz UAEUSWZMNDDHMM-IEBWSBKVSA-N 1 3 346.519 2.589 10 0 EFAEHO Cc1cccnc1CNC[C@@H](C)N(C)C(=O)[C@H]1CCCC[N@@H+]1C(C)C ZINC001405868306 1366477542 /nfs/dbraw/zinc/47/75/42/1366477542.db2.gz UAEUSWZMNDDHMM-IEBWSBKVSA-N 1 3 346.519 2.589 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@H](C)C2)c(C)s1 ZINC001405871492 1366479931 /nfs/dbraw/zinc/47/99/31/1366479931.db2.gz QSPUBAFZYCORDN-UONOGXRCSA-N 1 3 337.533 2.643 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H](CC(C)C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001405937386 1366539962 /nfs/dbraw/zinc/53/99/62/1366539962.db2.gz RQMMCPWUABRKNP-ICSRJNTNSA-N 1 3 345.531 2.957 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[N@H+](C)[C@@H]2CCc3ccccc32)CC1 ZINC001406148379 1367319226 /nfs/dbraw/zinc/31/92/26/1367319226.db2.gz PVFOOZOASJWXGJ-HXUWFJFHSA-N 1 3 343.515 2.796 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[N@@H+](C)[C@@H]2CCc3ccccc32)CC1 ZINC001406148379 1367319235 /nfs/dbraw/zinc/31/92/35/1367319235.db2.gz PVFOOZOASJWXGJ-HXUWFJFHSA-N 1 3 343.515 2.796 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)CC[C@@H]32)cs1 ZINC001406178174 1367374634 /nfs/dbraw/zinc/37/46/34/1367374634.db2.gz HFNSKXSKDLDTCB-MSOLQXFVSA-N 1 3 349.544 2.820 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)CC[C@@H]32)cs1 ZINC001406178174 1367374640 /nfs/dbraw/zinc/37/46/40/1367374640.db2.gz HFNSKXSKDLDTCB-MSOLQXFVSA-N 1 3 349.544 2.820 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2CC2CC(C)(C)C2)C1 ZINC001406203133 1367400079 /nfs/dbraw/zinc/40/00/79/1367400079.db2.gz YZSPHEVGCSHKER-QZTJIDSGSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2CC2CC(C)(C)C2)C1 ZINC001406203133 1367400085 /nfs/dbraw/zinc/40/00/85/1367400085.db2.gz YZSPHEVGCSHKER-QZTJIDSGSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]1C[NH2+]Cc1ccc(CF)cc1 ZINC001406203519 1367400138 /nfs/dbraw/zinc/40/01/38/1367400138.db2.gz RMJCRDIWNARQAK-OALUTQOASA-N 1 3 349.494 2.871 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]Cc1cccc2ccccc21)N(C)C ZINC001406360156 1367521341 /nfs/dbraw/zinc/52/13/41/1367521341.db2.gz ANSTVGJEVMMVQV-DNVCBOLYSA-N 1 3 327.472 2.774 10 0 EFAEHO CCN(CCNC(=O)[C@H]1C[NH+]2CCC1CC2)Cc1cc(C)sc1C ZINC001492951035 1367545286 /nfs/dbraw/zinc/54/52/86/1367545286.db2.gz BVKXIMYYJWBSAT-SFHVURJKSA-N 1 3 349.544 2.645 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CC2)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001406401105 1367548547 /nfs/dbraw/zinc/54/85/47/1367548547.db2.gz QCUVYPSRLZDSDQ-HZPDHXFCSA-N 1 3 329.488 2.500 10 0 EFAEHO CCN(CCNC(=O)[C@H]1C[NH+]2CCC1CC2)Cc1cccc(Cl)c1 ZINC001492951760 1367570035 /nfs/dbraw/zinc/57/00/35/1367570035.db2.gz FTZVJYOGRAFNOJ-SFHVURJKSA-N 1 3 349.906 2.620 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1cc2ccccc2o1 ZINC001406430161 1367583158 /nfs/dbraw/zinc/58/31/58/1367583158.db2.gz IEULJHLSOXKCCL-CRAIPNDOSA-N 1 3 343.471 2.902 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+][C@@H]1CCc2c1cccc2Cl ZINC001406432221 1367586302 /nfs/dbraw/zinc/58/63/02/1367586302.db2.gz PHTMRKOISIVBOY-CXAGYDPISA-N 1 3 337.895 2.762 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](CC)C[C@@H]1CCC(F)(F)C1 ZINC001437647432 1387886610 /nfs/dbraw/zinc/88/66/10/1387886610.db2.gz CSWYFTNLQISCOX-HZPDHXFCSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](CC)C[C@@H]1CCC(F)(F)C1 ZINC001437647432 1387886616 /nfs/dbraw/zinc/88/66/16/1387886616.db2.gz CSWYFTNLQISCOX-HZPDHXFCSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](CC)C[C@H]1CCC(F)(F)C1 ZINC001437647429 1387887836 /nfs/dbraw/zinc/88/78/36/1387887836.db2.gz CSWYFTNLQISCOX-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](CC)C[C@H]1CCC(F)(F)C1 ZINC001437647429 1387887843 /nfs/dbraw/zinc/88/78/43/1387887843.db2.gz CSWYFTNLQISCOX-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1cc(C)ccc1F ZINC001406482707 1367635732 /nfs/dbraw/zinc/63/57/32/1367635732.db2.gz RKSDKEYYWAUFGZ-YJBOKZPZSA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1cc(C)ccc1F ZINC001406482707 1367635737 /nfs/dbraw/zinc/63/57/37/1367635737.db2.gz RKSDKEYYWAUFGZ-YJBOKZPZSA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1cc2ccccc2o1 ZINC001406482895 1367636029 /nfs/dbraw/zinc/63/60/29/1367636029.db2.gz RWQLDPBGLMWRGH-YJBOKZPZSA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1cc2ccccc2o1 ZINC001406482895 1367636036 /nfs/dbraw/zinc/63/60/36/1367636036.db2.gz RWQLDPBGLMWRGH-YJBOKZPZSA-N 1 3 343.471 2.902 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)C[C@H]2CC[N@H+](C)C2)c(Cl)c1 ZINC001406543880 1367707326 /nfs/dbraw/zinc/70/73/26/1367707326.db2.gz LIJXWWNRSKLZOY-LSDHHAIUSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)C[C@H]2CC[N@@H+](C)C2)c(Cl)c1 ZINC001406543880 1367707328 /nfs/dbraw/zinc/70/73/28/1367707328.db2.gz LIJXWWNRSKLZOY-LSDHHAIUSA-N 1 3 337.895 2.585 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(F)cc1)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001406612069 1367804851 /nfs/dbraw/zinc/80/48/51/1367804851.db2.gz FQGNVWITWUOWOM-INIZCTEOSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@H+](C)CC1CCC(C)(C)CC1)N(C)C ZINC001406633738 1367836762 /nfs/dbraw/zinc/83/67/62/1367836762.db2.gz XDDXTCXYEBKWEO-NVXWUHKLSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@@H+](C)CC1CCC(C)(C)CC1)N(C)C ZINC001406633738 1367836764 /nfs/dbraw/zinc/83/67/64/1367836764.db2.gz XDDXTCXYEBKWEO-NVXWUHKLSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)c1ccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CC[N@H+](C)C2)cc1 ZINC001406690680 1367929638 /nfs/dbraw/zinc/92/96/38/1367929638.db2.gz AATKPQQMMPDEJV-VQIMIIECSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)c1ccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001406690680 1367929643 /nfs/dbraw/zinc/92/96/43/1367929643.db2.gz AATKPQQMMPDEJV-VQIMIIECSA-N 1 3 331.504 2.698 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)CC1CC2(CCC2)C1 ZINC001406712766 1367963457 /nfs/dbraw/zinc/96/34/57/1367963457.db2.gz FAJMEMWUUGDMKD-SJLPKXTDSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001406712766 1367963461 /nfs/dbraw/zinc/96/34/61/1367963461.db2.gz FAJMEMWUUGDMKD-SJLPKXTDSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)CCc1ccc(Cl)cc1 ZINC001406722948 1367971493 /nfs/dbraw/zinc/97/14/93/1367971493.db2.gz OLUZYENJSJIMOW-HNNXBMFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)CCc1ccc(Cl)cc1 ZINC001406722948 1367971497 /nfs/dbraw/zinc/97/14/97/1367971497.db2.gz OLUZYENJSJIMOW-HNNXBMFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CCC(CC)C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)C[C@@H]1CC ZINC001406803805 1368076076 /nfs/dbraw/zinc/07/60/76/1368076076.db2.gz HOAPYLRIGOZUNL-ZWKOTPCHSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+][C@@H](C)c2ccccc2)CC1 ZINC001406923384 1368217930 /nfs/dbraw/zinc/21/79/30/1368217930.db2.gz XJKVOBTXAYPFLC-WMZOPIPTSA-N 1 3 329.488 2.859 10 0 EFAEHO C[C@H](NC1(CNC(=O)C23CCC[NH+]2CCC3)CC1)c1cccc(F)c1 ZINC001406940315 1368232126 /nfs/dbraw/zinc/23/21/26/1368232126.db2.gz WLZCJVMLZKLTKO-HNNXBMFYSA-N 1 3 345.462 2.754 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C2(CNC(=O)C(C)(C)N3CCCC3)CC2)c1 ZINC001406951583 1368242017 /nfs/dbraw/zinc/24/20/17/1368242017.db2.gz LAZPCBTXLZKPNJ-UHFFFAOYSA-N 1 3 343.515 2.916 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]Cc2ccc(Cl)cc2)CC1 ZINC001406999857 1368301813 /nfs/dbraw/zinc/30/18/13/1368301813.db2.gz BNTLVNUHKGLOGF-GASCZTMLSA-N 1 3 349.906 2.951 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CC[N@H+](C/C=C\Cl)C2)CC1 ZINC001407001899 1368306201 /nfs/dbraw/zinc/30/62/01/1368306201.db2.gz MXVINSSTWHCYOK-RLXIPRIJSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CC[N@@H+](C/C=C\Cl)C2)CC1 ZINC001407001899 1368306208 /nfs/dbraw/zinc/30/62/08/1368306208.db2.gz MXVINSSTWHCYOK-RLXIPRIJSA-N 1 3 341.927 2.640 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CC[C@]2(C1)CCCN(C[C@H](F)CC)C2 ZINC001407026168 1368342647 /nfs/dbraw/zinc/34/26/47/1368342647.db2.gz UNZRKEATRXSZQY-IEBWSBKVSA-N 1 3 341.515 2.781 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CC[C@]2(C1)CCCN(C[C@H](F)CC)C2 ZINC001407026168 1368342652 /nfs/dbraw/zinc/34/26/52/1368342652.db2.gz UNZRKEATRXSZQY-IEBWSBKVSA-N 1 3 341.515 2.781 10 0 EFAEHO CN(C(=O)CCC[NH+]1CCCCC1)C1CN(C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC001407078136 1368401023 /nfs/dbraw/zinc/40/10/23/1368401023.db2.gz KYLIXDPKTOVONN-QRVBRYPASA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]C/C=C/c2ccccc2)CCN1C(=O)CN1CCCC1 ZINC001407082292 1368405113 /nfs/dbraw/zinc/40/51/13/1368405113.db2.gz FXJSIUULVIUZPQ-MRRRUUNJSA-N 1 3 341.499 2.765 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)c1 ZINC001407093472 1368417574 /nfs/dbraw/zinc/41/75/74/1368417574.db2.gz NGMXBEFDFVNNSG-WMZOPIPTSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1(C)CC[NH+](Cc2cccc(F)c2)CC1 ZINC001407268326 1368677983 /nfs/dbraw/zinc/67/79/83/1368677983.db2.gz DZJXWMFTCFHNQJ-UHFFFAOYSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[N@H+](CC2CCCC2)CCC1(F)F)N(C)C ZINC001407312412 1368754459 /nfs/dbraw/zinc/75/44/59/1368754459.db2.gz DXSUKYMEWGDMPR-HOTGVXAUSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[N@@H+](CC2CCCC2)CCC1(F)F)N(C)C ZINC001407312412 1368754463 /nfs/dbraw/zinc/75/44/63/1368754463.db2.gz DXSUKYMEWGDMPR-HOTGVXAUSA-N 1 3 345.478 2.590 10 0 EFAEHO CCC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001407335833 1368788236 /nfs/dbraw/zinc/78/82/36/1368788236.db2.gz RQWOTOGTFBJLRX-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CCC[N@H+]1CCC(F)(F)[C@H](CNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001407335833 1368788241 /nfs/dbraw/zinc/78/82/41/1368788241.db2.gz RQWOTOGTFBJLRX-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1cccc(C)c1)C2 ZINC001407494794 1368909542 /nfs/dbraw/zinc/90/95/42/1368909542.db2.gz NNXZPIJWBPXQJC-ZCNNSNEGSA-N 1 3 343.515 2.806 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1cccc(C)c1)C2 ZINC001407494794 1368909547 /nfs/dbraw/zinc/90/95/47/1368909547.db2.gz NNXZPIJWBPXQJC-ZCNNSNEGSA-N 1 3 343.515 2.806 10 0 EFAEHO C[C@H]([NH2+]CCC1CCCCC1)[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001407535425 1368954028 /nfs/dbraw/zinc/95/40/28/1368954028.db2.gz GLGJLVRGDJBGAM-HKUYNNGSSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H](c1ccccc1Cl)N1CC[C@@H](CNC(=O)CC[NH+](C)C)C1 ZINC001437722917 1387971112 /nfs/dbraw/zinc/97/11/12/1387971112.db2.gz NSWFITVZHMVGOQ-GJZGRUSLSA-N 1 3 337.895 2.791 10 0 EFAEHO CC[NH2+]C[C@H]1CC[C@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001407568601 1368998387 /nfs/dbraw/zinc/99/83/87/1368998387.db2.gz VNOMHTNFCNTTMW-GPMSIDNRSA-N 1 3 341.515 2.731 10 0 EFAEHO CC[C@H](C(=O)N1CC2(C1)CCN(C[C@@H](F)CC)CC2)[NH+](CC)CC ZINC001407714764 1369152207 /nfs/dbraw/zinc/15/22/07/1369152207.db2.gz IZQJNIGGHBXJKT-DLBZAZTESA-N 1 3 341.515 2.779 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001407812870 1369262548 /nfs/dbraw/zinc/26/25/48/1369262548.db2.gz VCSZLMQJWNCDMW-DLBZAZTESA-N 1 3 347.528 2.894 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@H]1CCC[C@H]2CCC[N@H+]21 ZINC001407812870 1369262551 /nfs/dbraw/zinc/26/25/51/1369262551.db2.gz VCSZLMQJWNCDMW-DLBZAZTESA-N 1 3 347.528 2.894 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1(CNC(=O)c2cccc(CN(C)C)c2)CCC1 ZINC001407829734 1369283661 /nfs/dbraw/zinc/28/36/61/1369283661.db2.gz YFWFJALKISQRLS-OAHLLOKOSA-N 1 3 335.467 2.738 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001437742202 1387993219 /nfs/dbraw/zinc/99/32/19/1387993219.db2.gz RUIVCZKYJNXIIT-KRWDZBQOSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccccc1C[N@H+]1CC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001437742202 1387993222 /nfs/dbraw/zinc/99/32/22/1387993222.db2.gz RUIVCZKYJNXIIT-KRWDZBQOSA-N 1 3 331.504 2.527 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](Cc2ccc(CF)cc2)CC1)N(C)C ZINC001407888059 1369353154 /nfs/dbraw/zinc/35/31/54/1369353154.db2.gz JBUXCHXAVPCPJN-RTBURBONSA-N 1 3 349.494 2.967 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2ccc(CF)cc2)CC1)N(C)C ZINC001407888059 1369353159 /nfs/dbraw/zinc/35/31/59/1369353159.db2.gz JBUXCHXAVPCPJN-RTBURBONSA-N 1 3 349.494 2.967 10 0 EFAEHO CN(CCC[N@H+](C)C[C@@H]1CCC(F)(F)C1)C(=O)CN(C)C1CCC1 ZINC001407926576 1369413606 /nfs/dbraw/zinc/41/36/06/1369413606.db2.gz YNOIJDJBJMBXIM-OAHLLOKOSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCC[N@@H+](C)C[C@@H]1CCC(F)(F)C1)C(=O)CN(C)C1CCC1 ZINC001407926576 1369413611 /nfs/dbraw/zinc/41/36/11/1369413611.db2.gz YNOIJDJBJMBXIM-OAHLLOKOSA-N 1 3 345.478 2.686 10 0 EFAEHO C[C@H](F)CCN1Cc2ccccc2C[C@@H]1CNC(=O)CCC[NH+](C)C ZINC001407996082 1369508951 /nfs/dbraw/zinc/50/89/51/1369508951.db2.gz CQKRAQWWHKTLLU-QFBILLFUSA-N 1 3 349.494 2.619 10 0 EFAEHO CCC1([NH2+]Cc2cccnc2C)CCN(C(=O)CN(C)C(C)C)CC1 ZINC001408000042 1369511564 /nfs/dbraw/zinc/51/15/64/1369511564.db2.gz MIOPNISMTAXIGM-UHFFFAOYSA-N 1 3 346.519 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001408017781 1369531383 /nfs/dbraw/zinc/53/13/83/1369531383.db2.gz VGIYXNKGSRPBAN-OAQYLSRUSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001408017781 1369531394 /nfs/dbraw/zinc/53/13/94/1369531394.db2.gz VGIYXNKGSRPBAN-OAQYLSRUSA-N 1 3 343.515 2.841 10 0 EFAEHO CC[C@H](C)C[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN(C)C1CCC1 ZINC001408302941 1369797360 /nfs/dbraw/zinc/79/73/60/1369797360.db2.gz FLCMIJRJQRTTKV-NYSBEXSLSA-N 1 3 343.515 2.889 10 0 EFAEHO COC(=O)[C@@H]1CCCC[C@H]1CN1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC001414040953 1370034763 /nfs/dbraw/zinc/03/47/63/1370034763.db2.gz YDWOBIWQAFMKIC-XYJFISCASA-N 1 3 331.460 2.572 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+][C@H](C)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001437850653 1388140770 /nfs/dbraw/zinc/14/07/70/1388140770.db2.gz DHEJATFXJWMDRS-ZWKOTPCHSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H]([NH2+]CCc1cccs1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001437851037 1388140925 /nfs/dbraw/zinc/14/09/25/1388140925.db2.gz FADBSMDUSDCMCR-INIZCTEOSA-N 1 3 349.544 2.603 10 0 EFAEHO CCC(CC)C[NH2+][C@H](C)C1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001437852597 1388142070 /nfs/dbraw/zinc/14/20/70/1388142070.db2.gz NZBRKKBHQKXAID-IAGOWNOFSA-N 1 3 337.552 2.981 10 0 EFAEHO CCC[NH2+][C@H](C)C1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001437856863 1388145121 /nfs/dbraw/zinc/14/51/21/1388145121.db2.gz WYTRJWMJGJFGPV-BEFAXECRSA-N 1 3 341.515 2.826 10 0 EFAEHO CCc1ccc([C@@H](CNC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)N(C)C)cc1 ZINC001417600541 1373081294 /nfs/dbraw/zinc/08/12/94/1373081294.db2.gz SWYOKTXRKXKDRS-IPMKNSEASA-N 1 3 331.504 2.698 10 0 EFAEHO CCc1ccc([C@@H](CNC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)N(C)C)cc1 ZINC001417600541 1373081298 /nfs/dbraw/zinc/08/12/98/1373081298.db2.gz SWYOKTXRKXKDRS-IPMKNSEASA-N 1 3 331.504 2.698 10 0 EFAEHO Cc1cccc(CN(CCN(C)C)C(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)c1 ZINC001417633017 1373109683 /nfs/dbraw/zinc/10/96/83/1373109683.db2.gz VOGLAROUIBWPST-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN(CCN(C)C)C(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)c1 ZINC001417633017 1373109689 /nfs/dbraw/zinc/10/96/89/1373109689.db2.gz VOGLAROUIBWPST-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2C[C@H]([NH2+]CC3CCC4(CC4)CC3)C2)CCC1 ZINC001417785847 1373251772 /nfs/dbraw/zinc/25/17/72/1373251772.db2.gz BEULGQFRIVDRSI-IYARVYRRSA-N 1 3 347.547 2.926 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1CNC(=O)c1ccc(NC2=NCCC2)cc1 ZINC001417796703 1373263408 /nfs/dbraw/zinc/26/34/08/1373263408.db2.gz ZWWAIBSYKRHCQZ-KRWDZBQOSA-N 1 3 328.460 2.895 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1CNC(=O)c1ccc(NC2=NCCC2)cc1 ZINC001417796703 1373263412 /nfs/dbraw/zinc/26/34/12/1373263412.db2.gz ZWWAIBSYKRHCQZ-KRWDZBQOSA-N 1 3 328.460 2.895 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C[C@H]1C)CC[NH+](CC1CCC1)CC2 ZINC001417811810 1373282414 /nfs/dbraw/zinc/28/24/14/1373282414.db2.gz IGLJSFBYPBMOIR-QGZVFWFLSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]Cc1ccsc1 ZINC001417819573 1373291756 /nfs/dbraw/zinc/29/17/56/1373291756.db2.gz OSLLDXIPWVKFSZ-WBVHZDCISA-N 1 3 337.533 2.805 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@H+](CCC(C)C)[C@@H]2C1(C)C ZINC001417821062 1373292480 /nfs/dbraw/zinc/29/24/80/1373292480.db2.gz HFXPEYGMXJMOAN-UHOSZYNNSA-N 1 3 337.552 2.980 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@@H+](CCC(C)C)[C@@H]2C1(C)C ZINC001417821062 1373292483 /nfs/dbraw/zinc/29/24/83/1373292483.db2.gz HFXPEYGMXJMOAN-UHOSZYNNSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@H+](CCC(C)C)CC(C)(C)C1)N(C)C ZINC001417862619 1373354347 /nfs/dbraw/zinc/35/43/47/1373354347.db2.gz JJIPZVMBUIDISU-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@@H+](CCC(C)C)CC(C)(C)C1)N(C)C ZINC001417862619 1373354354 /nfs/dbraw/zinc/35/43/54/1373354354.db2.gz JJIPZVMBUIDISU-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[N@H+](C/C=C/Cl)CC(C)(C)C2)CCC1 ZINC001417864437 1373359290 /nfs/dbraw/zinc/35/92/90/1373359290.db2.gz UYBOYFWUAJTSNL-WCLQSUPFSA-N 1 3 341.927 2.830 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[N@@H+](C/C=C/Cl)CC(C)(C)C2)CCC1 ZINC001417864437 1373359297 /nfs/dbraw/zinc/35/92/97/1373359297.db2.gz UYBOYFWUAJTSNL-WCLQSUPFSA-N 1 3 341.927 2.830 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[N@H+](C/C=C/Cl)CC(C)(C)C2)CCC1 ZINC001417864438 1373359706 /nfs/dbraw/zinc/35/97/06/1373359706.db2.gz UYBOYFWUAJTSNL-WGPYJDKQSA-N 1 3 341.927 2.830 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[N@@H+](C/C=C/Cl)CC(C)(C)C2)CCC1 ZINC001417864438 1373359712 /nfs/dbraw/zinc/35/97/12/1373359712.db2.gz UYBOYFWUAJTSNL-WGPYJDKQSA-N 1 3 341.927 2.830 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@H](CCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001437944962 1388259485 /nfs/dbraw/zinc/25/94/85/1388259485.db2.gz WLGLOWOXQRAZKB-QFBILLFUSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)C[N@H+]1CC[C@H](CCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001437944962 1388259490 /nfs/dbraw/zinc/25/94/90/1388259490.db2.gz WLGLOWOXQRAZKB-QFBILLFUSA-N 1 3 341.515 2.683 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC12CC[NH+](Cc1ccsc1)CC2 ZINC001417954685 1373447665 /nfs/dbraw/zinc/44/76/65/1373447665.db2.gz LZLKEGLYBQSOCT-MRXNPFEDSA-N 1 3 335.517 2.561 10 0 EFAEHO Cc1ccccc1C[NH+]1CCC2(C[C@@H]2NC(=O)CN(C)C(C)C)CC1 ZINC001417957046 1373450894 /nfs/dbraw/zinc/45/08/94/1373450894.db2.gz NNVLTIBRUJLDFH-IBGZPJMESA-N 1 3 343.515 2.806 10 0 EFAEHO CC[C@H](C)C[NH+]1CCC2(C[C@@H]2NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001417966659 1373466532 /nfs/dbraw/zinc/46/65/32/1373466532.db2.gz VNQBAWIIGDLRAC-IRXDYDNUSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CC1CCCCC1)C1CC1 ZINC001417975144 1373476254 /nfs/dbraw/zinc/47/62/54/1373476254.db2.gz DPFGEHDBKGHGJZ-RBUKOAKNSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CC1CCCCC1)C1CC1 ZINC001417975141 1373476333 /nfs/dbraw/zinc/47/63/33/1373476333.db2.gz DPFGEHDBKGHGJZ-MOPGFXCFSA-N 1 3 335.536 2.924 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1ccc(C)cc1)C1CC1 ZINC001417991303 1373495167 /nfs/dbraw/zinc/49/51/67/1373495167.db2.gz OANFUVYDOHSLMH-WOJBJXKFSA-N 1 3 343.515 2.854 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]([NH2+]C/C=C/c2ccccc2)C2CC2)C1 ZINC001417997731 1373503455 /nfs/dbraw/zinc/50/34/55/1373503455.db2.gz SQNCGOXUHYSCPU-IFKDRHBRSA-N 1 3 341.499 2.526 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+]Cc1cccc(Cl)c1)C1CC1 ZINC001418008850 1373516856 /nfs/dbraw/zinc/51/68/56/1373516856.db2.gz CAEAXPICRWWOSD-KRWDZBQOSA-N 1 3 337.895 2.665 10 0 EFAEHO CN(C/C=C\Cl)C[C@@H]1CCCN(C(=O)C(C)(C)[NH+]2CCCC2)C1 ZINC001418035652 1373550676 /nfs/dbraw/zinc/55/06/76/1373550676.db2.gz WYCUVINACDRZFD-GQSKFBFOSA-N 1 3 341.927 2.784 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccsc1)N(C)C ZINC001418079707 1373584256 /nfs/dbraw/zinc/58/42/56/1373584256.db2.gz ABHCYZFMVYGJST-HMQMGEFJSA-N 1 3 335.517 2.700 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccsc1)N(C)C ZINC001418079707 1373584261 /nfs/dbraw/zinc/58/42/61/1373584261.db2.gz ABHCYZFMVYGJST-HMQMGEFJSA-N 1 3 335.517 2.700 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]2C[N@H+](CC3CC3)CC[C@@H]21)CC(C)(C)C ZINC001418080518 1373585852 /nfs/dbraw/zinc/58/58/52/1373585852.db2.gz CPUFIIRPWMBUEF-MSOLQXFVSA-N 1 3 335.536 2.687 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]2C[N@@H+](CC3CC3)CC[C@@H]21)CC(C)(C)C ZINC001418080518 1373585855 /nfs/dbraw/zinc/58/58/55/1373585855.db2.gz CPUFIIRPWMBUEF-MSOLQXFVSA-N 1 3 335.536 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]21 ZINC001418082812 1373590893 /nfs/dbraw/zinc/59/08/93/1373590893.db2.gz PNCJTXVHAVVXBQ-WOJBJXKFSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]21 ZINC001418082812 1373590895 /nfs/dbraw/zinc/59/08/95/1373590895.db2.gz PNCJTXVHAVVXBQ-WOJBJXKFSA-N 1 3 343.515 2.841 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@H]1C[C@@H](NCc2ccccc2Cl)C1 ZINC001418092637 1373597473 /nfs/dbraw/zinc/59/74/73/1373597473.db2.gz CPNWQFHKOJUOAX-IXDOHACOSA-N 1 3 349.906 2.951 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@H]1C[C@@H](NCc2ccccc2Cl)C1 ZINC001418092637 1373597478 /nfs/dbraw/zinc/59/74/78/1373597478.db2.gz CPNWQFHKOJUOAX-IXDOHACOSA-N 1 3 349.906 2.951 10 0 EFAEHO Cc1cccc(C[N@H+]2CCC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001418126079 1373642667 /nfs/dbraw/zinc/64/26/67/1373642667.db2.gz BSXZETGQAOERFN-ICSRJNTNSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1cccc(C[N@@H+]2CCC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001418126079 1373642672 /nfs/dbraw/zinc/64/26/72/1373642672.db2.gz BSXZETGQAOERFN-ICSRJNTNSA-N 1 3 343.515 2.665 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CCC[N@H+](CCCC(C)(C)C)C2)C1 ZINC001418128322 1373648193 /nfs/dbraw/zinc/64/81/93/1373648193.db2.gz KCCSNLNWMNFKJX-MSOLQXFVSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CCC[N@@H+](CCCC(C)(C)C)C2)C1 ZINC001418128322 1373648199 /nfs/dbraw/zinc/64/81/99/1373648199.db2.gz KCCSNLNWMNFKJX-MSOLQXFVSA-N 1 3 337.552 2.983 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CCCN(Cc2ccccn2)C1)[NH+](CC)CC ZINC001418128751 1373648577 /nfs/dbraw/zinc/64/85/77/1373648577.db2.gz MHRYSCALEHGCFK-MJGOQNOKSA-N 1 3 346.519 2.530 10 0 EFAEHO C[C@H]([NH2+][C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)C1)c1ccc(F)cc1 ZINC001418136020 1373660634 /nfs/dbraw/zinc/66/06/34/1373660634.db2.gz YDIWGIYTGRKHFY-RRQGHBQHSA-N 1 3 333.451 2.608 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001418147396 1373674776 /nfs/dbraw/zinc/67/47/76/1373674776.db2.gz QYVUTXRQDYWKBN-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO CC1CC(C[N@@H+]2CCCC[C@@H]2CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001418154447 1373687668 /nfs/dbraw/zinc/68/76/68/1373687668.db2.gz DFMTXDXBZUMEEP-DAWZGUTISA-N 1 3 335.536 2.878 10 0 EFAEHO CC1CC(C[N@H+]2CCCC[C@@H]2CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001418154447 1373687673 /nfs/dbraw/zinc/68/76/73/1373687673.db2.gz DFMTXDXBZUMEEP-DAWZGUTISA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(CN2CCCC[C@@H]2CNC(=O)CC[NH+](C)C)cc1C ZINC001418157526 1373698919 /nfs/dbraw/zinc/69/89/19/1373698919.db2.gz YLWUDXKNPRNZHD-LJQANCHMSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H]2CCCCN2C(=O)CC[NH+](C)C)c1 ZINC001418164459 1373713206 /nfs/dbraw/zinc/71/32/06/1373713206.db2.gz TWOKPOMUMGCIEV-QGZVFWFLSA-N 1 3 335.467 2.557 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001418169784 1373720710 /nfs/dbraw/zinc/72/07/10/1373720710.db2.gz UFFAIFIRIBYIPI-HOTGVXAUSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)c1cccc(CN[C@@H](C)CNC(=O)[C@@H]2CCC[N@@H+]2C(C)C)n1 ZINC001418221673 1373777074 /nfs/dbraw/zinc/77/70/74/1373777074.db2.gz OBRWTIGJJKPWDT-LPHOPBHVSA-N 1 3 346.519 2.672 10 0 EFAEHO CC(C)c1cccc(CN[C@@H](C)CNC(=O)[C@@H]2CCC[N@H+]2C(C)C)n1 ZINC001418221673 1373777079 /nfs/dbraw/zinc/77/70/79/1373777079.db2.gz OBRWTIGJJKPWDT-LPHOPBHVSA-N 1 3 346.519 2.672 10 0 EFAEHO C[C@H](CNC(=O)C12CCC[NH+](CCC1)C2)N[C@@H](C)c1ccccc1F ZINC001418235810 1373791081 /nfs/dbraw/zinc/79/10/81/1373791081.db2.gz LYQKQOQTFVVXMH-CVEARBPZSA-N 1 3 347.478 2.857 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1)NC/C=C/Cl ZINC001418262695 1373829367 /nfs/dbraw/zinc/82/93/67/1373829367.db2.gz BLBJOEIYVYWYAS-YHOLHYGNSA-N 1 3 327.900 2.630 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CCCC[N@H+]1C1CCCC1)NC/C=C/Cl ZINC001418262695 1373829376 /nfs/dbraw/zinc/82/93/76/1373829376.db2.gz BLBJOEIYVYWYAS-YHOLHYGNSA-N 1 3 327.900 2.630 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+][C@@H]1CCc2ccccc21 ZINC001418277578 1373849825 /nfs/dbraw/zinc/84/98/25/1373849825.db2.gz XMUMSZPIRKQKAF-MAUKXSAKSA-N 1 3 331.504 2.746 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]([NH2+]CC=C(Cl)Cl)C1 ZINC001418361911 1373934979 /nfs/dbraw/zinc/93/49/79/1373934979.db2.gz SHTGLTKLEDOMOV-STQMWFEESA-N 1 3 336.307 2.663 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]C/C=C\c1ccccc1 ZINC001418415972 1373998000 /nfs/dbraw/zinc/99/80/00/1373998000.db2.gz PIRKJBAFZQJGRS-RPPGEJNMSA-N 1 3 329.488 2.526 10 0 EFAEHO Cc1ncccc1C[NH2+][C@H](C)CCNC(=O)[C@@H]1CCCCN1C(C)C ZINC001418415938 1373999109 /nfs/dbraw/zinc/99/91/09/1373999109.db2.gz ANQJYTIQQKIPDO-APWZRJJASA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@@H](C(C)C)[NH+]2CCCC2)c1 ZINC001418525215 1374133665 /nfs/dbraw/zinc/13/36/65/1374133665.db2.gz FNMMFLWTZWUKJP-HXUWFJFHSA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001418673719 1374350316 /nfs/dbraw/zinc/35/03/16/1374350316.db2.gz OSTDBBNGRSVYCI-RTBURBONSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[N@@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001418673719 1374350321 /nfs/dbraw/zinc/35/03/21/1374350321.db2.gz OSTDBBNGRSVYCI-RTBURBONSA-N 1 3 349.563 2.981 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@@H+]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001418697406 1374382745 /nfs/dbraw/zinc/38/27/45/1374382745.db2.gz IIJMXXHSKAQVHP-ZWKOTPCHSA-N 1 3 331.504 2.834 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@H+]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001418697406 1374382747 /nfs/dbraw/zinc/38/27/47/1374382747.db2.gz IIJMXXHSKAQVHP-ZWKOTPCHSA-N 1 3 331.504 2.834 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC(CN(C)C/C=C/Cl)CC2)CC[N@@H+]1C ZINC001438001945 1388314601 /nfs/dbraw/zinc/31/46/01/1388314601.db2.gz UCLOKABGCGFAGM-LTBXPFIXSA-N 1 3 341.927 2.640 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC(CN(C)C/C=C/Cl)CC2)CC[N@H+]1C ZINC001438001945 1388314607 /nfs/dbraw/zinc/31/46/07/1388314607.db2.gz UCLOKABGCGFAGM-LTBXPFIXSA-N 1 3 341.927 2.640 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[N@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001438001197 1388315984 /nfs/dbraw/zinc/31/59/84/1388315984.db2.gz NUHNVUSFZDNAAI-HOTGVXAUSA-N 1 3 345.478 2.544 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[N@@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001438001197 1388315990 /nfs/dbraw/zinc/31/59/90/1388315990.db2.gz NUHNVUSFZDNAAI-HOTGVXAUSA-N 1 3 345.478 2.544 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]CCc2cccs2)C1 ZINC001418731116 1374431614 /nfs/dbraw/zinc/43/16/14/1374431614.db2.gz PJBMARIMKJSPQI-JKSUJKDBSA-N 1 3 337.533 2.505 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CCC(C)(C)C ZINC001418739059 1374443010 /nfs/dbraw/zinc/44/30/10/1374443010.db2.gz LKFZTZDBWXVYBC-MANSERQUSA-N 1 3 349.563 2.933 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CCC(C)(C)C ZINC001418739059 1374443013 /nfs/dbraw/zinc/44/30/13/1374443013.db2.gz LKFZTZDBWXVYBC-MANSERQUSA-N 1 3 349.563 2.933 10 0 EFAEHO CN(CC(=O)N[C@@H]1[C@H]2CCC[N@H+](CC3CC3)[C@@H]2C1(C)C)CC(C)(C)C ZINC001418740489 1374443861 /nfs/dbraw/zinc/44/38/61/1374443861.db2.gz BATLCTJXFXVBQQ-QRQLOZEOSA-N 1 3 349.563 2.980 10 0 EFAEHO CN(CC(=O)N[C@@H]1[C@H]2CCC[N@@H+](CC3CC3)[C@@H]2C1(C)C)CC(C)(C)C ZINC001418740489 1374443865 /nfs/dbraw/zinc/44/38/65/1374443865.db2.gz BATLCTJXFXVBQQ-QRQLOZEOSA-N 1 3 349.563 2.980 10 0 EFAEHO Cc1ccc(C)c(CN(CCNC(=O)C[C@H]2CC[N@@H+](C)C2)C2CC2)c1 ZINC001418800176 1374519014 /nfs/dbraw/zinc/51/90/14/1374519014.db2.gz ICXARTVPDCDYRC-GOSISDBHSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(C)c(CN(CCNC(=O)C[C@H]2CC[N@H+](C)C2)C2CC2)c1 ZINC001418800176 1374519018 /nfs/dbraw/zinc/51/90/18/1374519018.db2.gz ICXARTVPDCDYRC-GOSISDBHSA-N 1 3 343.515 2.726 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1CC[C@H](NC(=O)C23CCCN2CCC3)[C@H]1C ZINC001418800192 1374519326 /nfs/dbraw/zinc/51/93/26/1374519326.db2.gz MKUXSGSIMHTUAO-KURKYZTESA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1CC[C@H](NC(=O)C23CCCN2CCC3)[C@H]1C ZINC001418800192 1374519329 /nfs/dbraw/zinc/51/93/29/1374519329.db2.gz MKUXSGSIMHTUAO-KURKYZTESA-N 1 3 335.536 2.876 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2cc3ccccc3o2)[C@@H]1C ZINC001418807284 1374528595 /nfs/dbraw/zinc/52/85/95/1374528595.db2.gz QTRKLFKXYMHNDD-QAPCUYQASA-N 1 3 343.471 2.854 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2cc3ccccc3o2)[C@@H]1C ZINC001418807284 1374528598 /nfs/dbraw/zinc/52/85/98/1374528598.db2.gz QTRKLFKXYMHNDD-QAPCUYQASA-N 1 3 343.471 2.854 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)[C@@H]1C[NH+]2CCC1CC2)c1ccccc1Cl ZINC001418809184 1374528956 /nfs/dbraw/zinc/52/89/56/1374528956.db2.gz CYJRWZBYTPKPKE-RHSMWYFYSA-N 1 3 349.906 2.791 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@H+](C[C@@H]2CCC(F)(F)C2)C1)N(C)C ZINC001438020822 1388323509 /nfs/dbraw/zinc/32/35/09/1388323509.db2.gz POGMSLGLLNLKDK-BZUAXINKSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@@H+](C[C@@H]2CCC(F)(F)C2)C1)N(C)C ZINC001438020822 1388323515 /nfs/dbraw/zinc/32/35/15/1388323515.db2.gz POGMSLGLLNLKDK-BZUAXINKSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CC2CCC2)CC(C)(C)C1)N(C)C ZINC001418821315 1374542302 /nfs/dbraw/zinc/54/23/02/1374542302.db2.gz ACHRSMAPWAOBLJ-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CC2CCC2)CC(C)(C)C1)N(C)C ZINC001418821315 1374542304 /nfs/dbraw/zinc/54/23/04/1374542304.db2.gz ACHRSMAPWAOBLJ-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)CC(C)(C)C1 ZINC001418836284 1374559043 /nfs/dbraw/zinc/55/90/43/1374559043.db2.gz LUHMXWCPJMGNNY-QGZVFWFLSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)CC(C)(C)C1 ZINC001418836284 1374559047 /nfs/dbraw/zinc/55/90/47/1374559047.db2.gz LUHMXWCPJMGNNY-QGZVFWFLSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccccn2)CC(C)(C)C1 ZINC001418838496 1374561043 /nfs/dbraw/zinc/56/10/43/1374561043.db2.gz UTXYIGBXAOVLNV-KRWDZBQOSA-N 1 3 346.519 2.530 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccccn2)CC(C)(C)C1 ZINC001418838496 1374561046 /nfs/dbraw/zinc/56/10/46/1374561046.db2.gz UTXYIGBXAOVLNV-KRWDZBQOSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)C[NH2+][C@@H](CNC(=O)C(C)(C)N1CCCC1)c1ccccc1 ZINC001418859042 1374584710 /nfs/dbraw/zinc/58/47/10/1374584710.db2.gz XTIAMORYWUTITE-SFHVURJKSA-N 1 3 331.504 2.964 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@@H+]([C@H]2CCc3ccccc32)C1 ZINC001418909401 1374673829 /nfs/dbraw/zinc/67/38/29/1374673829.db2.gz XOXPLKOFBQKIGG-XLIONFOSSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@H+]([C@H]2CCc3ccccc32)C1 ZINC001418909401 1374673835 /nfs/dbraw/zinc/67/38/35/1374673835.db2.gz XOXPLKOFBQKIGG-XLIONFOSSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)C1)N(C)C ZINC001418952145 1374726425 /nfs/dbraw/zinc/72/64/25/1374726425.db2.gz SAQAKWLUHDEBDJ-YZGWKJHDSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@H+]([C@H]2CCc3ccccc32)C1)N(C)C ZINC001418952145 1374726429 /nfs/dbraw/zinc/72/64/29/1374726429.db2.gz SAQAKWLUHDEBDJ-YZGWKJHDSA-N 1 3 343.515 2.841 10 0 EFAEHO Cc1cccc([C@H](C)N2CC(CNC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001419022536 1374770873 /nfs/dbraw/zinc/77/08/73/1374770873.db2.gz KQZUZCIKGRPKFD-PXNSSMCTSA-N 1 3 343.515 2.978 10 0 EFAEHO Cc1cccc([C@H](C)N2CC(CNC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001419022536 1374770875 /nfs/dbraw/zinc/77/08/75/1374770875.db2.gz KQZUZCIKGRPKFD-PXNSSMCTSA-N 1 3 343.515 2.978 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCN(Cc2cc3ccccc3s2)C1 ZINC001419063151 1374803111 /nfs/dbraw/zinc/80/31/11/1374803111.db2.gz UZTZLLCUHIMCSR-HNNXBMFYSA-N 1 3 331.485 2.544 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001419079218 1374818966 /nfs/dbraw/zinc/81/89/66/1374818966.db2.gz YKLHQPDRPYMVPE-GDBMZVCRSA-N 1 3 345.478 2.685 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1cccc(F)c1)C1CC1 ZINC001419250449 1374997402 /nfs/dbraw/zinc/99/74/02/1374997402.db2.gz KZCCEJQEDSJFQP-RTBURBONSA-N 1 3 347.478 2.683 10 0 EFAEHO C[C@H](NCC1(NC(=O)CC[NH+](C)C)CCCC1)c1ccccc1F ZINC001419312084 1375082636 /nfs/dbraw/zinc/08/26/36/1375082636.db2.gz FNBHXODKBSQFBG-HNNXBMFYSA-N 1 3 335.467 2.857 10 0 EFAEHO Cc1ccc(C[NH2+]CC2(NC(=O)CN(C)C(C)C)CCCC2)cc1 ZINC001419322877 1375100402 /nfs/dbraw/zinc/10/04/02/1375100402.db2.gz UPUKHSRNEVARRX-UHFFFAOYSA-N 1 3 331.504 2.854 10 0 EFAEHO Cc1cc(C[NH2+]CC2(NC(=O)CN(C)C(C)C)CCCC2)cs1 ZINC001419323987 1375101874 /nfs/dbraw/zinc/10/18/74/1375101874.db2.gz WEYHLWFAVVXQMI-UHFFFAOYSA-N 1 3 337.533 2.915 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001419328775 1375110240 /nfs/dbraw/zinc/11/02/40/1375110240.db2.gz BZCOCBCSFDZUGB-IAGOWNOFSA-N 1 3 343.531 2.883 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001419328775 1375110244 /nfs/dbraw/zinc/11/02/44/1375110244.db2.gz BZCOCBCSFDZUGB-IAGOWNOFSA-N 1 3 343.531 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+]Cc1ccccc1Cl)C1CC1 ZINC001419331674 1375115396 /nfs/dbraw/zinc/11/53/96/1375115396.db2.gz XXYFYHQXZYQVBP-KRWDZBQOSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)C[NH2+]C[C@](C)(NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001419338794 1375127052 /nfs/dbraw/zinc/12/70/52/1375127052.db2.gz CFSIQOFTRSMWHM-OALUTQOASA-N 1 3 341.515 2.729 10 0 EFAEHO CC[C@@H](c1ccccc1)N1C[C@H]2CC[C@@H](C1)N2C(=O)CC[NH+](C)C ZINC001419340472 1375129323 /nfs/dbraw/zinc/12/93/23/1375129323.db2.gz SVAUWQOPLTZGOQ-OTWHNJEPSA-N 1 3 329.488 2.765 10 0 EFAEHO Cc1ccc(C)c([C@H](C)N2C[C@H]3CC[C@@H](C2)N3C(=O)CC[NH+](C)C)c1 ZINC001419340375 1375129878 /nfs/dbraw/zinc/12/98/78/1375129878.db2.gz SOCLIXYZFZLCOJ-GBESFXJTSA-N 1 3 343.515 2.991 10 0 EFAEHO C[C@H](C(=O)N[C@](C)(C[NH2+]CC1CCC1)C1CC1)N1CCCCCC1 ZINC001419347566 1375141879 /nfs/dbraw/zinc/14/18/79/1375141879.db2.gz UGBZHTQNLXWFDG-OXQOHEQNSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@](C)(NC(=O)CN(C)C(C)C)C2CC2)cc1F ZINC001419359401 1375162068 /nfs/dbraw/zinc/16/20/68/1375162068.db2.gz OCGOTHHISFFJQV-HXUWFJFHSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)(C)CC[NH2+][C@H]1C[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001419413008 1375240864 /nfs/dbraw/zinc/24/08/64/1375240864.db2.gz MMBSYPCVCHKKAK-DOXZYTNZSA-N 1 3 341.515 2.872 10 0 EFAEHO CC[C@H]([NH2+][C@H]1C[C@H](NC(=O)CN(C)C(C)C)C1)c1ccc(F)cc1 ZINC001419435454 1375268576 /nfs/dbraw/zinc/26/85/76/1375268576.db2.gz ZWSAEOCAVGCBML-BZSNNMDCSA-N 1 3 335.467 2.854 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc(C)cc2Cl)C1 ZINC001419440515 1375275909 /nfs/dbraw/zinc/27/59/09/1375275909.db2.gz UCEZICWUFLFBBW-WKILWMFISA-N 1 3 337.895 2.727 10 0 EFAEHO Cc1ccccc1[C@@H](C)N1CC(CNC(=O)CC[C@@H]2CCC[N@@H+]2C)C1 ZINC001438128436 1388368039 /nfs/dbraw/zinc/36/80/39/1388368039.db2.gz LWYFSDYUZXHYTG-MJGOQNOKSA-N 1 3 343.515 2.978 10 0 EFAEHO Cc1ccccc1[C@@H](C)N1CC(CNC(=O)CC[C@@H]2CCC[N@H+]2C)C1 ZINC001438128436 1388368042 /nfs/dbraw/zinc/36/80/42/1388368042.db2.gz LWYFSDYUZXHYTG-MJGOQNOKSA-N 1 3 343.515 2.978 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2C/C=C\Cl ZINC001419447211 1375285836 /nfs/dbraw/zinc/28/58/36/1375285836.db2.gz KKKIQEXSXWLIQQ-RDKQIMRRSA-N 1 3 345.890 2.530 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C/C=C\Cl ZINC001419447211 1375285843 /nfs/dbraw/zinc/28/58/43/1375285843.db2.gz KKKIQEXSXWLIQQ-RDKQIMRRSA-N 1 3 345.890 2.530 10 0 EFAEHO Cc1ccccc1[C@@H](C)N1CC(CNC(=O)CC[C@H]2CCC[N@@H+]2C)C1 ZINC001438128423 1388368439 /nfs/dbraw/zinc/36/84/39/1388368439.db2.gz LWYFSDYUZXHYTG-IEBWSBKVSA-N 1 3 343.515 2.978 10 0 EFAEHO Cc1ccccc1[C@@H](C)N1CC(CNC(=O)CC[C@H]2CCC[N@H+]2C)C1 ZINC001438128423 1388368446 /nfs/dbraw/zinc/36/84/46/1388368446.db2.gz LWYFSDYUZXHYTG-IEBWSBKVSA-N 1 3 343.515 2.978 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)C3CCC3)C2)c(C)s1 ZINC001419476616 1375320412 /nfs/dbraw/zinc/32/04/12/1375320412.db2.gz TYYURXYRDHTRFR-IYBDPMFKSA-N 1 3 335.517 2.586 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]Cc1ccc(F)cc1 ZINC001419504392 1375354282 /nfs/dbraw/zinc/35/42/82/1375354282.db2.gz NQEAPGWUOZBMPY-OAHLLOKOSA-N 1 3 335.467 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCCc3ccccc32)C1 ZINC001419519804 1375378855 /nfs/dbraw/zinc/37/88/55/1375378855.db2.gz PGECYDYKPRFECM-SCTDSRPQSA-N 1 3 329.488 2.641 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cc2ccccc2o1)N(C)C(=O)[C@@H]1CCCCN1C ZINC001419681789 1375704228 /nfs/dbraw/zinc/70/42/28/1375704228.db2.gz IFBNBQAVKRPJAI-YJBOKZPZSA-N 1 3 343.471 2.854 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N1C[C@@H]2C[C@H]1CN2CCCC(C)(C)C ZINC001438168663 1388397436 /nfs/dbraw/zinc/39/74/36/1388397436.db2.gz IBRSOTPYSXRAHS-SQNIBIBYSA-N 1 3 335.536 2.972 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N1C[C@@H]2C[C@H]1CN2CCCC(C)(C)C ZINC001438168663 1388397444 /nfs/dbraw/zinc/39/74/44/1388397444.db2.gz IBRSOTPYSXRAHS-SQNIBIBYSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]C/C=C/c1ccccc1 ZINC001419754675 1375818317 /nfs/dbraw/zinc/81/83/17/1375818317.db2.gz IJBOXWLWLVCQGN-FVDXIBTGSA-N 1 3 329.488 2.669 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1cccc(F)c1 ZINC001419762020 1375829660 /nfs/dbraw/zinc/82/96/60/1375829660.db2.gz IJNZCJXYHAGZSE-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]Cc1cccc(C(F)(F)F)c1)N(C)C ZINC001419775223 1375856337 /nfs/dbraw/zinc/85/63/37/1375856337.db2.gz OWCWFDZZKGZPHW-SWLSCSKDSA-N 1 3 345.409 2.640 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]Cc1ccc2ccccc2c1)N(C)C ZINC001419777540 1375859267 /nfs/dbraw/zinc/85/92/67/1375859267.db2.gz SVDZHZYTTSOGML-HNAYVOBHSA-N 1 3 327.472 2.774 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)[C@@H]2CCC[N@H+]2CC(C)C)c1 ZINC001419793370 1375887549 /nfs/dbraw/zinc/88/75/49/1375887549.db2.gz UZVYSYDYTHEHAE-APWZRJJASA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)[C@@H]2CCC[N@@H+]2CC(C)C)c1 ZINC001419793370 1375887554 /nfs/dbraw/zinc/88/75/54/1375887554.db2.gz UZVYSYDYTHEHAE-APWZRJJASA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)C[C@H](C[NH2+]CC1CC(C)(C)C1)NC(=O)CN1CC[C@H](C)C1 ZINC001419793968 1375890102 /nfs/dbraw/zinc/89/01/02/1375890102.db2.gz PLEBSBPTELLKOA-FUHWJXTLSA-N 1 3 337.552 2.885 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]C/C=C/c2ccccc2)[C@H](C)C1 ZINC001419820269 1375933204 /nfs/dbraw/zinc/93/32/04/1375933204.db2.gz KKESAFGRSWIUHT-FFQNAWCLSA-N 1 3 343.515 2.867 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]C/C=C\c2ccccc2)[C@H](C)C1 ZINC001419820277 1375933639 /nfs/dbraw/zinc/93/36/39/1375933639.db2.gz KKESAFGRSWIUHT-POQYLXETSA-N 1 3 343.515 2.867 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)CC1 ZINC001419844197 1375982294 /nfs/dbraw/zinc/98/22/94/1375982294.db2.gz CMLIFUITPIOLOZ-ROUUACIJSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)CC1 ZINC001419844197 1375982298 /nfs/dbraw/zinc/98/22/98/1375982298.db2.gz CMLIFUITPIOLOZ-ROUUACIJSA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCc1ccccc1 ZINC001419848825 1375996365 /nfs/dbraw/zinc/99/63/65/1375996365.db2.gz LDBVGQGKEGJTPT-JXFKEZNVSA-N 1 3 349.494 2.536 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](C)CNC(=O)[C@H]1CCCCN1C(C)C ZINC001419865611 1376028917 /nfs/dbraw/zinc/02/89/17/1376028917.db2.gz JLMLTPCFLCPVTO-IEBWSBKVSA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](CNC(=O)CN1CC[C@H](C)C1)C(C)C ZINC001419910347 1376113098 /nfs/dbraw/zinc/11/30/98/1376113098.db2.gz SBNQLUHIPWRNMH-OXJNMPFZSA-N 1 3 345.531 2.876 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](CNC(=O)CN1CC[C@@H](C)C1)C(C)C ZINC001419911992 1376115738 /nfs/dbraw/zinc/11/57/38/1376115738.db2.gz VDBWQMRAXFTTAP-YLJYHZDGSA-N 1 3 345.531 2.821 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NCc1ccc(Cl)c(Cl)c1 ZINC001419915570 1376121206 /nfs/dbraw/zinc/12/12/06/1376121206.db2.gz ALQMQPHQZDXZRE-YPMHNXCESA-N 1 3 344.286 2.539 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NCc1ccc(Cl)c(Cl)c1 ZINC001419915570 1376121210 /nfs/dbraw/zinc/12/12/10/1376121210.db2.gz ALQMQPHQZDXZRE-YPMHNXCESA-N 1 3 344.286 2.539 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+][C@@H](C)c1ccc2c(c1)CCC2 ZINC001419930290 1376146052 /nfs/dbraw/zinc/14/60/52/1376146052.db2.gz CIKZKGDJIJHFMQ-CVEARBPZSA-N 1 3 331.504 2.671 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)CC[NH+]2CCCCC2)c1 ZINC001419933234 1376150276 /nfs/dbraw/zinc/15/02/76/1376150276.db2.gz UTNMTPJZHJBZQG-INIZCTEOSA-N 1 3 335.467 2.604 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+][C@H]2CCc3ccc(Cl)cc32)C1 ZINC001419976007 1376219238 /nfs/dbraw/zinc/21/92/38/1376219238.db2.gz QLQBEYLQWKLIOZ-WMZOPIPTSA-N 1 3 349.906 2.858 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@H]([NH2+]Cc3ccsc3)C2)CCC1 ZINC001420022605 1376303068 /nfs/dbraw/zinc/30/30/68/1376303068.db2.gz DZDCVXKHSIKSHN-HOTGVXAUSA-N 1 3 335.517 2.749 10 0 EFAEHO CN(Cc1ccc(Cl)cc1)[C@H]1CCCN(C(=O)CC[NH+](C)C)C1 ZINC001420060611 1376402227 /nfs/dbraw/zinc/40/22/27/1376402227.db2.gz YNUQHAJEELGYTR-KRWDZBQOSA-N 1 3 337.895 2.715 10 0 EFAEHO CN(CC(=O)N[C@H]1CCC[C@H]1C[NH2+]Cc1ccsc1)C1CCC1 ZINC001420108926 1376466131 /nfs/dbraw/zinc/46/61/31/1376466131.db2.gz YHWDMMFOSJLQSY-RDJZCZTQSA-N 1 3 335.517 2.607 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](C)CCNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001420125015 1376481214 /nfs/dbraw/zinc/48/12/14/1376481214.db2.gz MMDWEFSETIKRBH-MAUKXSAKSA-N 1 3 337.483 2.705 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1cc(F)ccc1C ZINC001420166645 1376526222 /nfs/dbraw/zinc/52/62/22/1376526222.db2.gz QXVVVGYCGCCNQY-VQIMIIECSA-N 1 3 349.494 2.993 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@@H+]1C)Cc1ccc2cc[nH]c2c1 ZINC001420250190 1376615449 /nfs/dbraw/zinc/61/54/49/1376615449.db2.gz MWJFEKFVJWBOJH-SFHVURJKSA-N 1 3 342.487 2.590 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@H+]1C)Cc1ccc2cc[nH]c2c1 ZINC001420250190 1376615458 /nfs/dbraw/zinc/61/54/58/1376615458.db2.gz MWJFEKFVJWBOJH-SFHVURJKSA-N 1 3 342.487 2.590 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@@H]2CCC[C@H]3CCC[N@@H+]32)cc1 ZINC001420306856 1376703941 /nfs/dbraw/zinc/70/39/41/1376703941.db2.gz BPFHJWCKGAMWRQ-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@@H]2CCC[C@H]3CCC[N@H+]32)cc1 ZINC001420306856 1376703949 /nfs/dbraw/zinc/70/39/49/1376703949.db2.gz BPFHJWCKGAMWRQ-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001420308814 1376707596 /nfs/dbraw/zinc/70/75/96/1376707596.db2.gz DWZQGSRLYNRLSK-RTBURBONSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001420308814 1376707599 /nfs/dbraw/zinc/70/75/99/1376707599.db2.gz DWZQGSRLYNRLSK-RTBURBONSA-N 1 3 329.488 2.560 10 0 EFAEHO CN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)Cc1ccc(C(F)F)cc1 ZINC001420336010 1376754932 /nfs/dbraw/zinc/75/49/32/1376754932.db2.gz YKLFSYBDNRUPQI-OAHLLOKOSA-N 1 3 339.430 2.514 10 0 EFAEHO CN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)Cc1ccc(C(F)F)cc1 ZINC001420336010 1376754943 /nfs/dbraw/zinc/75/49/43/1376754943.db2.gz YKLFSYBDNRUPQI-OAHLLOKOSA-N 1 3 339.430 2.514 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@@H](C)NC(=O)[C@H]1CCCCN1C(C)C ZINC001420350956 1376784728 /nfs/dbraw/zinc/78/47/28/1376784728.db2.gz ALTNPSHHWCYUPY-VQIMIIECSA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)[C@H](C(=O)NCCN(C)CCc1ccccc1F)[NH+]1CCCC1 ZINC001420358218 1376798871 /nfs/dbraw/zinc/79/88/71/1376798871.db2.gz MMDNKBQPBCFCFJ-LJQANCHMSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+][C@@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001420434135 1376963995 /nfs/dbraw/zinc/96/39/95/1376963995.db2.gz QPNNJRMGDSNQND-JCURWCKSSA-N 1 3 337.895 2.762 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@H]1CCCN1Cc1ccc(C(F)F)cc1 ZINC001420491021 1377070015 /nfs/dbraw/zinc/07/00/15/1377070015.db2.gz COKRYEVWCWNSKW-MRXNPFEDSA-N 1 3 339.430 2.657 10 0 EFAEHO Cc1ccc(F)c(CN2CC[C@H](CNC(=O)[C@H](C(C)C)[NH+](C)C)C2)c1 ZINC001420560384 1377199845 /nfs/dbraw/zinc/19/98/45/1377199845.db2.gz MKKCJCNBMSNTOW-APWZRJJASA-N 1 3 349.494 2.658 10 0 EFAEHO CCCc1ccc(C[N@@H+]2CC[C@H](CNC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001420561612 1377201468 /nfs/dbraw/zinc/20/14/68/1377201468.db2.gz NFWAULKOJLUYOW-WOJBJXKFSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(C[N@H+]2CC[C@H](CNC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001420561612 1377201470 /nfs/dbraw/zinc/20/14/70/1377201470.db2.gz NFWAULKOJLUYOW-WOJBJXKFSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001420571580 1377223732 /nfs/dbraw/zinc/22/37/32/1377223732.db2.gz QTOKPMMGDUXJEK-JJRVBVJISA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001420571580 1377223735 /nfs/dbraw/zinc/22/37/35/1377223735.db2.gz QTOKPMMGDUXJEK-JJRVBVJISA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@@H](C[N@H+](C)C[C@H]1CCC(F)(F)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001420616145 1377330792 /nfs/dbraw/zinc/33/07/92/1377330792.db2.gz UUOJGDLPRXESLO-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[N@@H+](C)C[C@H]1CCC(F)(F)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001420616145 1377330800 /nfs/dbraw/zinc/33/08/00/1377330800.db2.gz UUOJGDLPRXESLO-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1[C@@H](C)CC[C@@H]1C)CC1CC(F)(F)C1 ZINC001420622149 1377349178 /nfs/dbraw/zinc/34/91/78/1377349178.db2.gz GNSNABPATIZAIC-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1[C@@H](C)CC[C@@H]1C)CC1CC(F)(F)C1 ZINC001420622149 1377349184 /nfs/dbraw/zinc/34/91/84/1377349184.db2.gz GNSNABPATIZAIC-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1[C@H](C)CC[C@@H]1C)CC1CC(F)(F)C1 ZINC001420622146 1377349807 /nfs/dbraw/zinc/34/98/07/1377349807.db2.gz GNSNABPATIZAIC-GASCZTMLSA-N 1 3 345.478 2.733 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1[C@H](C)CC[C@@H]1C)CC1CC(F)(F)C1 ZINC001420622146 1377349812 /nfs/dbraw/zinc/34/98/12/1377349812.db2.gz GNSNABPATIZAIC-GASCZTMLSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccc(F)cc1 ZINC001438307433 1388497964 /nfs/dbraw/zinc/49/79/64/1388497964.db2.gz UALYQOMRPQHGOZ-MSOLQXFVSA-N 1 3 335.467 2.683 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@H+](C)CCc1ccccc1Cl)N(C)C ZINC001420665337 1377457104 /nfs/dbraw/zinc/45/71/04/1377457104.db2.gz VEGCKHQIYNBXHX-RHSMWYFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@@H+](C)CCc1ccccc1Cl)N(C)C ZINC001420665337 1377457107 /nfs/dbraw/zinc/45/71/07/1377457107.db2.gz VEGCKHQIYNBXHX-RHSMWYFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CC[C@@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)NCC=C(Cl)Cl ZINC001438308875 1388498883 /nfs/dbraw/zinc/49/88/83/1388498883.db2.gz GBAMHUPIBJOTLK-STQMWFEESA-N 1 3 336.307 2.664 10 0 EFAEHO CC[C@@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)NCC=C(Cl)Cl ZINC001438308875 1388498886 /nfs/dbraw/zinc/49/88/86/1388498886.db2.gz GBAMHUPIBJOTLK-STQMWFEESA-N 1 3 336.307 2.664 10 0 EFAEHO CCCN(C)CC(=O)NCC[N@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC001420702988 1377533912 /nfs/dbraw/zinc/53/39/12/1377533912.db2.gz CNVDTMWDMWJHLO-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO CCCN(C)CC(=O)NCC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC001420702988 1377533914 /nfs/dbraw/zinc/53/39/14/1377533914.db2.gz CNVDTMWDMWJHLO-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@H](CNCc1ccccc1F)C1CC1 ZINC001420738168 1377586267 /nfs/dbraw/zinc/58/62/67/1377586267.db2.gz NFVHFKWMGFLYJN-MOPGFXCFSA-N 1 3 347.478 2.685 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@H](CNCc1ccccc1F)C1CC1 ZINC001420738168 1377586269 /nfs/dbraw/zinc/58/62/69/1377586269.db2.gz NFVHFKWMGFLYJN-MOPGFXCFSA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001420766550 1377624348 /nfs/dbraw/zinc/62/43/48/1377624348.db2.gz ARJPOJQVHZTJHN-RTBURBONSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@@H]([NH2+]CCc1ccccc1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001420771731 1377635675 /nfs/dbraw/zinc/63/56/75/1377635675.db2.gz UVWIRZCXAFSKQA-GOSISDBHSA-N 1 3 343.515 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H](C)[NH2+]Cc2ccccc2F)CC1 ZINC001420773304 1377639930 /nfs/dbraw/zinc/63/99/30/1377639930.db2.gz VYZAODQDYKWWDJ-MRXNPFEDSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]Cc1sccc1Cl)C1CC1 ZINC001420794429 1377678941 /nfs/dbraw/zinc/67/89/41/1377678941.db2.gz FHIJFJXLTSYCGD-AWEZNQCLSA-N 1 3 343.924 2.726 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)[NH+]1CCCC1)NCc1cc(C)ccc1F ZINC001438330990 1388512522 /nfs/dbraw/zinc/51/25/22/1388512522.db2.gz UWXKAAITHRXJDQ-QGZVFWFLSA-N 1 3 349.494 2.993 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@@H]1CC[N@@H+]([C@@H]2CCc3ccccc32)C1 ZINC001420885669 1377834879 /nfs/dbraw/zinc/83/48/79/1377834879.db2.gz FCTOITWTKCOBSX-YLJYHZDGSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@@H]1CC[N@H+]([C@@H]2CCc3ccccc32)C1 ZINC001420885669 1377834882 /nfs/dbraw/zinc/83/48/82/1377834882.db2.gz FCTOITWTKCOBSX-YLJYHZDGSA-N 1 3 343.515 2.844 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](CN(C)C/C=C/Cl)C1)[NH+](CC)CC ZINC001420939611 1377913595 /nfs/dbraw/zinc/91/35/95/1377913595.db2.gz HPHUKIIGXDOGDD-ZGWZEZEDSA-N 1 3 329.916 2.640 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@H+](CC2CCC(C)CC2)C1)N(C)C ZINC001420982899 1377976135 /nfs/dbraw/zinc/97/61/35/1377976135.db2.gz IDYHNCSSXCGGLE-GMNCBBECSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@@H+](CC2CCC(C)CC2)C1)N(C)C ZINC001420982899 1377976138 /nfs/dbraw/zinc/97/61/38/1377976138.db2.gz IDYHNCSSXCGGLE-GMNCBBECSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@@H](CNC(=O)Cc1nc[nH]c1C)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001438359223 1388532111 /nfs/dbraw/zinc/53/21/11/1388532111.db2.gz PBLUHEOOUXKUNW-KGLIPLIRSA-N 1 3 342.434 2.571 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H]2CCCN2C(=O)CCC[NH+](C)C)c1 ZINC001421130349 1378160620 /nfs/dbraw/zinc/16/06/20/1378160620.db2.gz PXPXMFCQKKMVHQ-KRWDZBQOSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H]2CCCN2C(=O)CCC[NH+](C)C)c1 ZINC001421130352 1378160652 /nfs/dbraw/zinc/16/06/52/1378160652.db2.gz PXPXMFCQKKMVHQ-QGZVFWFLSA-N 1 3 335.467 2.557 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@H](C[NH2+]Cc2ccsc2)C2CCCC2)C1 ZINC001421165817 1378213179 /nfs/dbraw/zinc/21/31/79/1378213179.db2.gz FJSCNEKBHHGZSX-CRAIPNDOSA-N 1 3 349.544 2.855 10 0 EFAEHO CC[C@H](C(=O)N1C[C@@H]2C[C@H]1CN2CC1CCCCC1)[NH+](CC)CC ZINC001421215971 1378293718 /nfs/dbraw/zinc/29/37/18/1378293718.db2.gz IDWFHDNEWQYKQP-GBESFXJTSA-N 1 3 335.536 2.972 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@](C)(C[NH2+]CC3CC(C)(C)C3)C2)CCC1 ZINC001421239349 1378329550 /nfs/dbraw/zinc/32/95/50/1378329550.db2.gz MTCOADQOAOOFSJ-LJQANCHMSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H](C(=O)NC[C@@]1(C)CCC[N@H+](CC2CC2)C1)N1CCCCCC1 ZINC001421294874 1378449179 /nfs/dbraw/zinc/44/91/79/1378449179.db2.gz KATFFFJDZSGCHW-FXAWDEMLSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CC2CC2)C1)N1CCCCCC1 ZINC001421294874 1378449182 /nfs/dbraw/zinc/44/91/82/1378449182.db2.gz KATFFFJDZSGCHW-FXAWDEMLSA-N 1 3 335.536 2.879 10 0 EFAEHO CN(C(=O)CC[C@@H]1CCC[N@@H+]1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC001421302677 1378465222 /nfs/dbraw/zinc/46/52/22/1378465222.db2.gz OFAMSTGPYFIENJ-OALUTQOASA-N 1 3 329.488 2.594 10 0 EFAEHO CN(C(=O)CC[C@@H]1CCC[N@H+]1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC001421302677 1378465227 /nfs/dbraw/zinc/46/52/27/1378465227.db2.gz OFAMSTGPYFIENJ-OALUTQOASA-N 1 3 329.488 2.594 10 0 EFAEHO CCN1CCC(F)(F)[C@H](CNC(=O)CC[N@H+](C)C2CCCCC2)C1 ZINC001421328427 1378501324 /nfs/dbraw/zinc/50/13/24/1378501324.db2.gz CRNHDUVFLNANRF-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCC(F)(F)[C@H](CNC(=O)CC[N@@H+](C)C2CCCCC2)C1 ZINC001421328427 1378501329 /nfs/dbraw/zinc/50/13/29/1378501329.db2.gz CRNHDUVFLNANRF-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001421422664 1378600534 /nfs/dbraw/zinc/60/05/34/1378600534.db2.gz MDNRWJDFHYCOMG-QGZVFWFLSA-N 1 3 342.487 2.637 10 0 EFAEHO CC[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@@H](C)c1cccc(OC)c1 ZINC001421425835 1378601796 /nfs/dbraw/zinc/60/17/96/1378601796.db2.gz QHZLTSYVQSZXTF-RDJZCZTQSA-N 1 3 347.503 2.725 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]Cc1ccccc1 ZINC001421451646 1378635210 /nfs/dbraw/zinc/63/52/10/1378635210.db2.gz AJXXQDCERTWIPL-RBUKOAKNSA-N 1 3 331.504 2.934 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cc(C)cc(C)c1 ZINC001421455116 1378640157 /nfs/dbraw/zinc/64/01/57/1378640157.db2.gz ZETFQHKQFREIKI-DNVCBOLYSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]CCc1ccccc1 ZINC001421459043 1378646665 /nfs/dbraw/zinc/64/66/65/1378646665.db2.gz WOUCUANGICZNNU-VQTJNVASSA-N 1 3 345.531 2.976 10 0 EFAEHO C[C@@H](c1ccc(Cl)cc1)N1C[C@@H]2CN(C(=O)CC[NH+](C)C)C[C@@H]2C1 ZINC001421569169 1378826309 /nfs/dbraw/zinc/82/63/09/1378826309.db2.gz AJVJORWIEFKAOZ-BHYGNILZSA-N 1 3 349.906 2.743 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2C[C@H](F)CC ZINC001421632981 1378917737 /nfs/dbraw/zinc/91/77/37/1378917737.db2.gz JDEVYRXCRXIULT-BRWVUGGUSA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2C[C@H](F)CC ZINC001421632981 1378917738 /nfs/dbraw/zinc/91/77/38/1378917738.db2.gz JDEVYRXCRXIULT-BRWVUGGUSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H](C)C[NH2+]Cc1ccsc1 ZINC001421741174 1379063875 /nfs/dbraw/zinc/06/38/75/1379063875.db2.gz UIIVINVDILSYAP-NVXWUHKLSA-N 1 3 337.533 2.853 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)C[NH2+]Cc1ccc(C(C)C)cc1 ZINC001421765383 1379101414 /nfs/dbraw/zinc/10/14/14/1379101414.db2.gz FZDORCZKWDFVDD-OAHLLOKOSA-N 1 3 342.487 2.926 10 0 EFAEHO CC(C)C[NH2+]C1(CO)CCN(C[C@H]2CCCC23CCOCC3)CC1 ZINC001421806147 1379157603 /nfs/dbraw/zinc/15/76/03/1379157603.db2.gz DPYMANLZXSQGDI-GOSISDBHSA-N 1 3 338.536 2.656 10 0 EFAEHO CN(CCC[N@H+](C)[C@H]1CCc2ccccc21)C(=O)CN(C)C1CCC1 ZINC001421867085 1379268918 /nfs/dbraw/zinc/26/89/18/1379268918.db2.gz NUBULMZFXTZFIO-FQEVSTJZSA-N 1 3 343.515 2.939 10 0 EFAEHO CN(CCC[N@@H+](C)[C@H]1CCc2ccccc21)C(=O)CN(C)C1CCC1 ZINC001421867085 1379268924 /nfs/dbraw/zinc/26/89/24/1379268924.db2.gz NUBULMZFXTZFIO-FQEVSTJZSA-N 1 3 343.515 2.939 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001421911494 1379341001 /nfs/dbraw/zinc/34/10/01/1379341001.db2.gz MMZKCCMKKDZNEN-CZUORRHYSA-N 1 3 325.884 2.617 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H](C)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001421937882 1379378737 /nfs/dbraw/zinc/37/87/37/1379378737.db2.gz DTRNXLAQVNEKKV-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCC1([NH2+]Cc2ccsc2)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001421946013 1379390556 /nfs/dbraw/zinc/39/05/56/1379390556.db2.gz ZDUSLOVYPDPLKX-INIZCTEOSA-N 1 3 335.517 2.703 10 0 EFAEHO CCC1([NH2+]Cc2ccccc2)CCN(C(=O)CN(C)C(C)C)CC1 ZINC001421951078 1379398428 /nfs/dbraw/zinc/39/84/28/1379398428.db2.gz DYIZONRAIUVRTK-UHFFFAOYSA-N 1 3 331.504 2.888 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(C)c(F)c1 ZINC001421978957 1379432782 /nfs/dbraw/zinc/43/27/82/1379432782.db2.gz GDRBIYGPHLAWJF-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1ccccc1C1CC1)N(C)C ZINC001421980439 1379434082 /nfs/dbraw/zinc/43/40/82/1379434082.db2.gz BGLNAQBOKKPSTK-DNVCBOLYSA-N 1 3 331.504 2.841 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001422029496 1379513326 /nfs/dbraw/zinc/51/33/26/1379513326.db2.gz NGQCAXDDQDASOU-MJGOQNOKSA-N 1 3 331.504 2.662 10 0 EFAEHO CC(C)[NH2+]CC[C@@H]1CCCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001422034468 1379519971 /nfs/dbraw/zinc/51/99/71/1379519971.db2.gz UGPNGGHZBGIQMG-QFBILLFUSA-N 1 3 341.515 2.968 10 0 EFAEHO CC(C)[NH2+]CC[C@H]1CCCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001422034469 1379520203 /nfs/dbraw/zinc/52/02/03/1379520203.db2.gz UGPNGGHZBGIQMG-VQIMIIECSA-N 1 3 341.515 2.968 10 0 EFAEHO CCc1ccc(CC[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001422071070 1379571403 /nfs/dbraw/zinc/57/14/03/1379571403.db2.gz YWTKQCLKGSBHKY-XLIONFOSSA-N 1 3 345.531 2.568 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)CC[NH+](C)C)CCN1Cc1cc2ccccc2o1 ZINC001422126079 1379651881 /nfs/dbraw/zinc/65/18/81/1379651881.db2.gz LYXZCEKOHVMTNK-RDJZCZTQSA-N 1 3 343.471 2.854 10 0 EFAEHO C[C@@H](c1ccc(Cl)cc1)N(C)CCN(C)C(=O)CC[NH+](C)C ZINC001422198454 1379759458 /nfs/dbraw/zinc/75/94/58/1379759458.db2.gz MKYMCACSWIXGML-AWEZNQCLSA-N 1 3 325.884 2.743 10 0 EFAEHO C[C@@H]1CC[N@H+](CC(=O)N(C)CCN(C)Cc2ccc(C3CC3)cc2)C1 ZINC001422199933 1379760081 /nfs/dbraw/zinc/76/00/81/1379760081.db2.gz LOCWQYUENHFEPS-QGZVFWFLSA-N 1 3 343.515 2.796 10 0 EFAEHO C[C@@H]1CC[N@@H+](CC(=O)N(C)CCN(C)Cc2ccc(C3CC3)cc2)C1 ZINC001422199933 1379760087 /nfs/dbraw/zinc/76/00/87/1379760087.db2.gz LOCWQYUENHFEPS-QGZVFWFLSA-N 1 3 343.515 2.796 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@H+](C)[C@H]1CCc2ccccc21)N(C)C ZINC001422227329 1379810492 /nfs/dbraw/zinc/81/04/92/1379810492.db2.gz NFAZUWHMIGMXDK-OALUTQOASA-N 1 3 331.504 2.650 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@@H+](C)[C@H]1CCc2ccccc21)N(C)C ZINC001422227329 1379810494 /nfs/dbraw/zinc/81/04/94/1379810494.db2.gz NFAZUWHMIGMXDK-OALUTQOASA-N 1 3 331.504 2.650 10 0 EFAEHO CN(CC[N@H+](C)Cc1ccccc1C1CC1)C(=O)CN1CCCC1 ZINC001422239521 1379838366 /nfs/dbraw/zinc/83/83/66/1379838366.db2.gz SPFIICKZNIJDIP-UHFFFAOYSA-N 1 3 329.488 2.550 10 0 EFAEHO CN(CC[N@@H+](C)Cc1ccccc1C1CC1)C(=O)CN1CCCC1 ZINC001422239521 1379838368 /nfs/dbraw/zinc/83/83/68/1379838368.db2.gz SPFIICKZNIJDIP-UHFFFAOYSA-N 1 3 329.488 2.550 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2CC2CC(C)(C)C2)C1 ZINC001422243270 1379846259 /nfs/dbraw/zinc/84/62/59/1379846259.db2.gz GEIKXTAUAXTNHG-ZWKOTPCHSA-N 1 3 335.536 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2CC2CC(C)(C)C2)C1 ZINC001422243270 1379846264 /nfs/dbraw/zinc/84/62/64/1379846264.db2.gz GEIKXTAUAXTNHG-ZWKOTPCHSA-N 1 3 335.536 2.687 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[N@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001422247533 1379854702 /nfs/dbraw/zinc/85/47/02/1379854702.db2.gz OQPSTXSPMLPVEZ-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001422247533 1379854709 /nfs/dbraw/zinc/85/47/09/1379854709.db2.gz OQPSTXSPMLPVEZ-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2CCc2cccs2)C1 ZINC001422248545 1379857068 /nfs/dbraw/zinc/85/70/68/1379857068.db2.gz OUJNMFPRJKQPMB-AEFFLSMTSA-N 1 3 349.544 2.554 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2CCc2cccs2)C1 ZINC001422248545 1379857075 /nfs/dbraw/zinc/85/70/75/1379857075.db2.gz OUJNMFPRJKQPMB-AEFFLSMTSA-N 1 3 349.544 2.554 10 0 EFAEHO C[C@H]([NH2+]CC1CC(NC(=O)C2(N(C)C)CCC2)C1)c1ccccc1F ZINC001422268043 1379883994 /nfs/dbraw/zinc/88/39/94/1379883994.db2.gz SOHAUFRKRIZOFG-FHERZECASA-N 1 3 347.478 2.855 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2ccccc2C2CC2)C1)N(C)C ZINC001422298650 1379907467 /nfs/dbraw/zinc/90/74/67/1379907467.db2.gz XUXACLHQCSEUJT-PKUWUEBNSA-N 1 3 343.515 2.889 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001438481740 1388635528 /nfs/dbraw/zinc/63/55/28/1388635528.db2.gz LBEOMFHWKQRLJW-APWZRJJASA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001422332069 1379940115 /nfs/dbraw/zinc/94/01/15/1379940115.db2.gz UHAOSNVESIQDSS-JKSUJKDBSA-N 1 3 343.515 2.642 10 0 EFAEHO C[C@@H](NCc1ccccc1F)[C@@H](C)NC(=O)CC1CC[NH+](C)CC1 ZINC001422381645 1380011001 /nfs/dbraw/zinc/01/10/01/1380011001.db2.gz SUTRMCUDIQWRDG-HUUCEWRRSA-N 1 3 335.467 2.540 10 0 EFAEHO C[C@H](NCc1ccccc1F)[C@H](C)NC(=O)CC1CC[NH+](C)CC1 ZINC001422381641 1380011068 /nfs/dbraw/zinc/01/10/68/1380011068.db2.gz SUTRMCUDIQWRDG-GJZGRUSLSA-N 1 3 335.467 2.540 10 0 EFAEHO CCN(CC[NH2+][C@@H](C)c1ccc2c(c1)CCC2)C(=O)CN1CCCC1 ZINC001422455951 1380131821 /nfs/dbraw/zinc/13/18/21/1380131821.db2.gz FHQQQEZMFIHTGH-KRWDZBQOSA-N 1 3 343.515 2.770 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](C)NC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001422493632 1380196751 /nfs/dbraw/zinc/19/67/51/1380196751.db2.gz VLQFZYMYIHNQRO-PBHICJAKSA-N 1 3 349.906 2.585 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+]2CCO[C@H](C(C)(C)C)CC2)CC1 ZINC001422507161 1380218334 /nfs/dbraw/zinc/21/83/34/1380218334.db2.gz WCXXVWFTNHFZPG-SFHVURJKSA-N 1 3 325.541 2.540 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+]2CCO[C@H](C(C)(C)C)CC2)CC1 ZINC001422507161 1380218335 /nfs/dbraw/zinc/21/83/35/1380218335.db2.gz WCXXVWFTNHFZPG-SFHVURJKSA-N 1 3 325.541 2.540 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H](C)[N@H+](C)CCC1CCCCC1)N(C)C ZINC001422512592 1380229462 /nfs/dbraw/zinc/22/94/62/1380229462.db2.gz BCCDVSRBTVNAJJ-WMZOPIPTSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H](C)[N@@H+](C)CCC1CCCCC1)N(C)C ZINC001422512592 1380229467 /nfs/dbraw/zinc/22/94/67/1380229467.db2.gz BCCDVSRBTVNAJJ-WMZOPIPTSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1 ZINC001422529254 1380262215 /nfs/dbraw/zinc/26/22/15/1380262215.db2.gz MBQGJCJJNUEHRF-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1 ZINC001422529254 1380262219 /nfs/dbraw/zinc/26/22/19/1380262219.db2.gz MBQGJCJJNUEHRF-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CCCc1ccc(C[N@H+](C)[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001422563205 1380331206 /nfs/dbraw/zinc/33/12/06/1380331206.db2.gz POYOLCBOFVMVTP-MSOLQXFVSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(C[N@@H+](C)[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001422563205 1380331209 /nfs/dbraw/zinc/33/12/09/1380331209.db2.gz POYOLCBOFVMVTP-MSOLQXFVSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)[N@H+](C)CCc1ccccc1 ZINC001422572061 1380345949 /nfs/dbraw/zinc/34/59/49/1380345949.db2.gz GRXSRNQDNHKBNN-OALUTQOASA-N 1 3 345.531 2.930 10 0 EFAEHO C[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)[N@@H+](C)CCc1ccccc1 ZINC001422572061 1380345951 /nfs/dbraw/zinc/34/59/51/1380345951.db2.gz GRXSRNQDNHKBNN-OALUTQOASA-N 1 3 345.531 2.930 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@@H](C)NC(=O)[C@H]1CCCCN1C(C)C ZINC001422575955 1380352469 /nfs/dbraw/zinc/35/24/69/1380352469.db2.gz WFJPZQPOTKCIDF-VQIMIIECSA-N 1 3 349.494 2.991 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CC1CCC2(CC2)CC1 ZINC001422651509 1380490470 /nfs/dbraw/zinc/49/04/70/1380490470.db2.gz SBXFVSIIZCAZSS-WMZOPIPTSA-N 1 3 335.536 2.926 10 0 EFAEHO CCCN(C)CC(=O)NC1(C[NH2+]Cc2cncc(C)c2)CCCCC1 ZINC001422682807 1380578835 /nfs/dbraw/zinc/57/88/35/1380578835.db2.gz VCIIIFYKSVKUNI-UHFFFAOYSA-N 1 3 346.519 2.641 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C)C1)C1C[NH+](CCC2CCCCC2)C1 ZINC001422755428 1380763076 /nfs/dbraw/zinc/76/30/76/1380763076.db2.gz UJTDSKJOAGNLRS-SJORKVTESA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1C[NH+](CC[C@@H]2CCCC2(F)F)C1 ZINC001422760833 1380768723 /nfs/dbraw/zinc/76/87/23/1380768723.db2.gz JVLXNIGTOLSJPP-HOCLYGCPSA-N 1 3 345.478 2.589 10 0 EFAEHO Cc1ccc(CN2C[C@@H](NC(=O)[C@H](C(C)C)[NH+](C)C)C(C)(C)C2)cc1 ZINC001422785353 1380802872 /nfs/dbraw/zinc/80/28/72/1380802872.db2.gz DTQAFHWYXVJJSZ-MOPGFXCFSA-N 1 3 345.531 2.908 10 0 EFAEHO C[C@H](c1ccccc1)N1C[C@H](NC(=O)C2(C[NH+](C)C)CC2)C(C)(C)C1 ZINC001422789689 1380809612 /nfs/dbraw/zinc/80/96/12/1380809612.db2.gz QDKRBCFDQMQNFM-AEFFLSMTSA-N 1 3 343.515 2.916 10 0 EFAEHO C[C@@H](c1ccccc1)N1C[C@H](NC(=O)C2(C[NH+](C)C)CC2)C(C)(C)C1 ZINC001422789702 1380810451 /nfs/dbraw/zinc/81/04/51/1380810451.db2.gz QDKRBCFDQMQNFM-WMZOPIPTSA-N 1 3 343.515 2.916 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@H+](CCC2CCCC2)CC1(C)C)N(C)C ZINC001422795633 1380819648 /nfs/dbraw/zinc/81/96/48/1380819648.db2.gz YDWDLKYDUXHZFT-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@@H+](CCC2CCCC2)CC1(C)C)N(C)C ZINC001422795633 1380819654 /nfs/dbraw/zinc/81/96/54/1380819654.db2.gz YDWDLKYDUXHZFT-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@H+](CCC2CCCC2)CC1(C)C)N(C)C ZINC001422795630 1380819883 /nfs/dbraw/zinc/81/98/83/1380819883.db2.gz YDWDLKYDUXHZFT-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@@H+](CCC2CCCC2)CC1(C)C)N(C)C ZINC001422795630 1380819889 /nfs/dbraw/zinc/81/98/89/1380819889.db2.gz YDWDLKYDUXHZFT-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2o1)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001422813686 1380844949 /nfs/dbraw/zinc/84/49/49/1380844949.db2.gz VDPFIGSQOOHWQD-IIDMSEBBSA-N 1 3 343.471 2.710 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2o1)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001422813686 1380844952 /nfs/dbraw/zinc/84/49/52/1380844952.db2.gz VDPFIGSQOOHWQD-IIDMSEBBSA-N 1 3 343.471 2.710 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2o1)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001422813682 1380845056 /nfs/dbraw/zinc/84/50/56/1380845056.db2.gz VDPFIGSQOOHWQD-HDMKZQKVSA-N 1 3 343.471 2.710 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2o1)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001422813682 1380845065 /nfs/dbraw/zinc/84/50/65/1380845065.db2.gz VDPFIGSQOOHWQD-HDMKZQKVSA-N 1 3 343.471 2.710 10 0 EFAEHO C[C@@H](C[N@H+](C)Cc1ccc2cc[nH]c2c1)NC(=O)C1(N(C)C)CCC1 ZINC001422817671 1380852509 /nfs/dbraw/zinc/85/25/09/1380852509.db2.gz DGGZHTJDRDUXMQ-HNNXBMFYSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@@H](C[N@@H+](C)Cc1ccc2cc[nH]c2c1)NC(=O)C1(N(C)C)CCC1 ZINC001422817671 1380852513 /nfs/dbraw/zinc/85/25/13/1380852513.db2.gz DGGZHTJDRDUXMQ-HNNXBMFYSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2[C@H]3C[N@@H+](CC4CCCCCC4)C[C@H]32)C1 ZINC001422836363 1380893764 /nfs/dbraw/zinc/89/37/64/1380893764.db2.gz YUUGYAROJLZLHQ-AFYVEPGGSA-N 1 3 347.547 2.593 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2[C@H]3C[N@H+](CC4CCCCCC4)C[C@H]32)C1 ZINC001422836363 1380893774 /nfs/dbraw/zinc/89/37/74/1380893774.db2.gz YUUGYAROJLZLHQ-AFYVEPGGSA-N 1 3 347.547 2.593 10 0 EFAEHO CCc1ccc(C[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001422880299 1380993458 /nfs/dbraw/zinc/99/34/58/1380993458.db2.gz SKWPCKLICSVTQC-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(C[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001422880299 1380993461 /nfs/dbraw/zinc/99/34/61/1380993461.db2.gz SKWPCKLICSVTQC-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)c1cccc(CNC2(CNC(=O)CC[NH+](C)C)CCCC2)n1 ZINC001438607337 1388693958 /nfs/dbraw/zinc/69/39/58/1388693958.db2.gz RUERPOTUNNJTAJ-UHFFFAOYSA-N 1 3 346.519 2.675 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2c(C)cccc2C)C1)N(C)C ZINC001422908738 1381036969 /nfs/dbraw/zinc/03/69/69/1381036969.db2.gz DQWZMOBQXBJDCF-ZHALLVOQSA-N 1 3 331.504 2.628 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H](NC(=O)C(C)(C)N2CCCC2)C2CC2)cs1 ZINC001423014519 1381209340 /nfs/dbraw/zinc/20/93/40/1381209340.db2.gz SXSNCTLMWYTUJE-QGZVFWFLSA-N 1 3 349.544 2.915 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@H](C)[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001423070458 1381300089 /nfs/dbraw/zinc/30/00/89/1381300089.db2.gz FQDFUEOBILSTJC-DZGCQCFKSA-N 1 3 333.467 2.589 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(C(F)F)cc1)N(C)C ZINC001423080301 1381314312 /nfs/dbraw/zinc/31/43/12/1381314312.db2.gz SKVRSWJDNBHIPH-XJKSGUPXSA-N 1 3 341.446 2.901 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C[C@H](C)N(C)C(=O)CN(C)C2CCC2)c1 ZINC001438646137 1388716263 /nfs/dbraw/zinc/71/62/63/1388716263.db2.gz BMLPEKIXFSPDDB-JKSUJKDBSA-N 1 3 347.503 2.677 10 0 EFAEHO C[C@H](NC1(CNC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)CC1)c1cccc(Cl)c1 ZINC001423221955 1381612880 /nfs/dbraw/zinc/61/28/80/1381612880.db2.gz MBIFPRVJQHHWHF-JJRVBVJISA-N 1 3 349.906 2.980 10 0 EFAEHO C[C@H](NC1(CNC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)CC1)c1cccc(Cl)c1 ZINC001423221955 1381612897 /nfs/dbraw/zinc/61/28/97/1381612897.db2.gz MBIFPRVJQHHWHF-JJRVBVJISA-N 1 3 349.906 2.980 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001438676408 1388732677 /nfs/dbraw/zinc/73/26/77/1388732677.db2.gz AQIYGCFQBTYNDX-BBWFWOEESA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001438676408 1388732681 /nfs/dbraw/zinc/73/26/81/1388732681.db2.gz AQIYGCFQBTYNDX-BBWFWOEESA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@H](NC1(CNC(=O)C2(C[NH+](C)C)CC2)CC1)c1cccc(Cl)c1 ZINC001423260152 1381722390 /nfs/dbraw/zinc/72/23/90/1381722390.db2.gz OUISOBHSCACBBL-AWEZNQCLSA-N 1 3 349.906 2.981 10 0 EFAEHO C[C@@H](NC1(CNC(=O)C2CC[NH+](C)CC2)CC1)c1cccc(Cl)c1 ZINC001423274591 1381734546 /nfs/dbraw/zinc/73/45/46/1381734546.db2.gz NQPWLTJRTXWCEH-CQSZACIVSA-N 1 3 349.906 2.981 10 0 EFAEHO C[C@@H]1[C@@H]([NH2+]CC2CC(C)(C)C2)CCN1C(=O)CN(C)CC(C)(C)C ZINC001423317455 1381776190 /nfs/dbraw/zinc/77/61/90/1381776190.db2.gz FLMKUPJSPBTSAM-WBVHZDCISA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@@H]1CC[N@H+](CCC2CC2)C1 ZINC001423320024 1381779048 /nfs/dbraw/zinc/77/90/48/1381779048.db2.gz IRMBNCXBMZNHKK-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@@H]1CC[N@@H+](CCC2CC2)C1 ZINC001423320024 1381779053 /nfs/dbraw/zinc/77/90/53/1381779053.db2.gz IRMBNCXBMZNHKK-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CCc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)cc1 ZINC001423332048 1381796164 /nfs/dbraw/zinc/79/61/64/1381796164.db2.gz TWAJGVFOIJPMGL-APWZRJJASA-N 1 3 331.504 2.668 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)c1 ZINC001423333168 1381797291 /nfs/dbraw/zinc/79/72/91/1381797291.db2.gz WQRCSHXOCIXTJN-CRAIPNDOSA-N 1 3 335.467 2.553 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]Cc3ccccc3)[C@@H]2C1 ZINC001423366421 1381854910 /nfs/dbraw/zinc/85/49/10/1381854910.db2.gz WWQPADYMGGCQHO-ZCNNSNEGSA-N 1 3 343.515 2.744 10 0 EFAEHO C[C@H]1[C@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc2c(c1)CCC2 ZINC001423368911 1381860131 /nfs/dbraw/zinc/86/01/31/1381860131.db2.gz GXZWLKYZVXHQAG-OXJNMPFZSA-N 1 3 343.515 2.596 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@]12CCC[C@@H]1N(Cc1ccsc1)CC2 ZINC001423372279 1381865578 /nfs/dbraw/zinc/86/55/78/1381865578.db2.gz RYKPRNWUSXHINC-WMZOPIPTSA-N 1 3 335.517 2.703 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@]12CCC[C@@H]1N(Cc1ccsc1)CC2 ZINC001423372279 1381865583 /nfs/dbraw/zinc/86/55/83/1381865583.db2.gz RYKPRNWUSXHINC-WMZOPIPTSA-N 1 3 335.517 2.703 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1C[C@@H]([NH2+]Cc2ccccc2)C(C)(C)C1 ZINC001423393780 1381899422 /nfs/dbraw/zinc/89/94/22/1381899422.db2.gz MDLDWIHQGSVIKF-QZTJIDSGSA-N 1 3 349.494 2.693 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@@H](NCc2ccccc2F)C(C)(C)C1 ZINC001423402189 1381910161 /nfs/dbraw/zinc/91/01/61/1381910161.db2.gz KKVBLKVBQKCVFK-GOSISDBHSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@@H](NCc2ccccc2F)C(C)(C)C1 ZINC001423402189 1381910167 /nfs/dbraw/zinc/91/01/67/1381910167.db2.gz KKVBLKVBQKCVFK-GOSISDBHSA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001423408487 1381916858 /nfs/dbraw/zinc/91/68/58/1381916858.db2.gz CLXKAIMXMNVWBP-RTBURBONSA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001423424376 1381934379 /nfs/dbraw/zinc/93/43/79/1381934379.db2.gz VPLCPVKZDSXEGH-WMZOPIPTSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]Cc1ccc2ncccc2c1 ZINC001438710978 1388755285 /nfs/dbraw/zinc/75/52/85/1388755285.db2.gz GGAKKLLZOQKWLP-MRXNPFEDSA-N 1 3 342.487 2.512 10 0 EFAEHO Cc1cccc(C[NH+]2CCC(C)(NC(=O)CN(C)C(C)C)CC2)c1 ZINC001423520098 1382008792 /nfs/dbraw/zinc/00/87/92/1382008792.db2.gz WRJRVSORKCQWSK-UHFFFAOYSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)N(CC[N@H+](C)CC1CC(F)(F)C1)C(=O)CN(C)C1CCC1 ZINC001423556460 1382061984 /nfs/dbraw/zinc/06/19/84/1382061984.db2.gz HUXRPIHWOHKYBD-UHFFFAOYSA-N 1 3 345.478 2.685 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CC1CC(F)(F)C1)C(=O)CN(C)C1CCC1 ZINC001423556460 1382061989 /nfs/dbraw/zinc/06/19/89/1382061989.db2.gz HUXRPIHWOHKYBD-UHFFFAOYSA-N 1 3 345.478 2.685 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H](C)CNCc1cccnc1)[NH+]1CCCCC1 ZINC001438718484 1388761368 /nfs/dbraw/zinc/76/13/68/1388761368.db2.gz YCXLWEMCZFDWJP-IEBWSBKVSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)C[NH2+]C[C@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)(C)C ZINC001423601113 1382146849 /nfs/dbraw/zinc/14/68/49/1382146849.db2.gz CPLCLZJJLGKHDD-HNAYVOBHSA-N 1 3 343.531 2.975 10 0 EFAEHO CC(C)(C)[C@@H](C[NH2+]CC1CC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001423606683 1382155315 /nfs/dbraw/zinc/15/53/15/1382155315.db2.gz NNAPFVUMSHMIJO-BEFAXECRSA-N 1 3 341.515 2.729 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H](CNCc1ccc(F)cc1F)C(C)(C)C ZINC001423618934 1382176839 /nfs/dbraw/zinc/17/68/39/1382176839.db2.gz IZTBAJIAGZEIHE-INIZCTEOSA-N 1 3 341.446 2.537 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@](C)(C[NH2+]CC3CC4(CCC4)C3)C2)C1 ZINC001423624660 1382186331 /nfs/dbraw/zinc/18/63/31/1382186331.db2.gz CNFZDDRZVIOZBQ-YLJYHZDGSA-N 1 3 347.547 2.737 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C1CC[NH+](CC[C@H](C)F)CC1)N(C)C ZINC001423652961 1382229247 /nfs/dbraw/zinc/22/92/47/1382229247.db2.gz SHSRJCYPHMHGPW-ZMSDIMECSA-N 1 3 329.504 2.537 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1F)C2 ZINC001423936138 1382520213 /nfs/dbraw/zinc/52/02/13/1382520213.db2.gz WORKKIOJPIYFGF-JQHSSLGASA-N 1 3 347.478 2.637 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1F)C2 ZINC001423936138 1382520220 /nfs/dbraw/zinc/52/02/20/1382520220.db2.gz WORKKIOJPIYFGF-JQHSSLGASA-N 1 3 347.478 2.637 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](C)[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001423954605 1382543268 /nfs/dbraw/zinc/54/32/68/1382543268.db2.gz NETNTKJSIYWQQJ-RBUKOAKNSA-N 1 3 345.531 2.970 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001438765051 1388795548 /nfs/dbraw/zinc/79/55/48/1388795548.db2.gz FYUQSZSTMMBSBA-UYAOXDASSA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C)[C@@H]1C[NH2+]Cc1ccccc1 ZINC001438771834 1388801012 /nfs/dbraw/zinc/80/10/12/1388801012.db2.gz YGIYLHKNSYMADC-HKUYNNGSSA-N 1 3 331.504 2.744 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([C@@H](C)[NH2+]CC2CC(C)(C)C2)C1 ZINC001438773483 1388803122 /nfs/dbraw/zinc/80/31/22/1388803122.db2.gz RRQFVWXLJQDZKI-SJLPKXTDSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CC[NH+](C[C@@H]1CC[C@H]3C[C@H]3C1)CC2 ZINC001424105456 1382762373 /nfs/dbraw/zinc/76/23/73/1382762373.db2.gz CRRYXXRPVUAQIO-CEXWTWQISA-N 1 3 347.547 2.687 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(CNC(=O)[C@H](C)N2CCCCCC2)CCC1 ZINC001424194464 1382849119 /nfs/dbraw/zinc/84/91/19/1382849119.db2.gz AMUXREXWTSBEDK-HOTGVXAUSA-N 1 3 327.488 2.628 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)[C@H](C(C)C)[NH+](C)C)CCC2)c1 ZINC001424223527 1382882052 /nfs/dbraw/zinc/88/20/52/1382882052.db2.gz NKWJGWMLESKRLQ-SFHVURJKSA-N 1 3 349.494 2.849 10 0 EFAEHO CCC1([NH2+]Cc2cccnc2)CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001424363547 1382967695 /nfs/dbraw/zinc/96/76/95/1382967695.db2.gz ABGXRXDOWKPSKD-SFHVURJKSA-N 1 3 346.519 2.529 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NCc2ccc3c(c2)CN(CCC2CC2)C3)C1 ZINC001424439216 1383018406 /nfs/dbraw/zinc/01/84/06/1383018406.db2.gz BFIPZNHETOIKMJ-GOSISDBHSA-N 1 3 341.499 2.760 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NCc2ccc3c(c2)CN(CCC2CC2)C3)C1 ZINC001424439216 1383018412 /nfs/dbraw/zinc/01/84/12/1383018412.db2.gz BFIPZNHETOIKMJ-GOSISDBHSA-N 1 3 341.499 2.760 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)NCc1ccccc1F ZINC001438811399 1388834576 /nfs/dbraw/zinc/83/45/76/1388834576.db2.gz ORLZJMHDSONHFX-BXWFABGCSA-N 1 3 349.494 2.786 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)NCc1ccccc1F ZINC001438811399 1388834582 /nfs/dbraw/zinc/83/45/82/1388834582.db2.gz ORLZJMHDSONHFX-BXWFABGCSA-N 1 3 349.494 2.786 10 0 EFAEHO CC[C@H](F)C[NH2+][C@@H](CNC(=O)C(C)(C)N1CCCCC1)C(C)C ZINC001438812641 1388836303 /nfs/dbraw/zinc/83/63/03/1388836303.db2.gz OCEVIXIRYUOILM-HOTGVXAUSA-N 1 3 329.504 2.729 10 0 EFAEHO CC[C@@H](F)C[N@H+](CC)CC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001424662883 1383237180 /nfs/dbraw/zinc/23/71/80/1383237180.db2.gz JVZWOBVZMTUMSX-QGZVFWFLSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](F)C[N@@H+](CC)CC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001424662883 1383237185 /nfs/dbraw/zinc/23/71/85/1383237185.db2.gz JVZWOBVZMTUMSX-QGZVFWFLSA-N 1 3 341.515 2.779 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@H+](C)C/C=C/c1ccccc1 ZINC001424688284 1383259134 /nfs/dbraw/zinc/25/91/34/1383259134.db2.gz RPKOBLAIUUDBER-MELMLQDISA-N 1 3 341.499 2.717 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@@H+](C)C/C=C/c1ccccc1 ZINC001424688284 1383259140 /nfs/dbraw/zinc/25/91/40/1383259140.db2.gz RPKOBLAIUUDBER-MELMLQDISA-N 1 3 341.499 2.717 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@H+](C)C/C=C\c1ccccc1 ZINC001424697901 1383270049 /nfs/dbraw/zinc/27/00/49/1383270049.db2.gz KLGLQWUIWLAEGJ-CRLZUZNUSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@@H+](C)C/C=C\c1ccccc1 ZINC001424697901 1383270053 /nfs/dbraw/zinc/27/00/53/1383270053.db2.gz KLGLQWUIWLAEGJ-CRLZUZNUSA-N 1 3 343.515 2.963 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1C ZINC001424803442 1383362971 /nfs/dbraw/zinc/36/29/71/1383362971.db2.gz RPUGXPDXGHEOPY-IAGOWNOFSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001424805559 1383365699 /nfs/dbraw/zinc/36/56/99/1383365699.db2.gz ULIKMHNDVZVWSN-LSDHHAIUSA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)c(C)c1 ZINC001424806529 1383367456 /nfs/dbraw/zinc/36/74/56/1383367456.db2.gz WUWZHENPDCYHNB-SJORKVTESA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)cc1 ZINC001424817469 1383376722 /nfs/dbraw/zinc/37/67/22/1383376722.db2.gz OWMRPSWVKFDPIV-ROUUACIJSA-N 1 3 345.531 2.895 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)cc1 ZINC001424817470 1383376778 /nfs/dbraw/zinc/37/67/78/1383376778.db2.gz OWMRPSWVKFDPIV-ZWKOTPCHSA-N 1 3 345.531 2.895 10 0 EFAEHO Cc1cc(CN(C)[C@H](C)CNC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)c(C)s1 ZINC001424940143 1383494260 /nfs/dbraw/zinc/49/42/60/1383494260.db2.gz PHVDGJSCOWKVJG-SUYBPPKGSA-N 1 3 337.533 2.642 10 0 EFAEHO Cc1cc(CN(C)[C@H](C)CNC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)c(C)s1 ZINC001424940143 1383494264 /nfs/dbraw/zinc/49/42/64/1383494264.db2.gz PHVDGJSCOWKVJG-SUYBPPKGSA-N 1 3 337.533 2.642 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)[N@H+](C)CC[C@@H]1CCCC1(F)F ZINC001425060007 1383510890 /nfs/dbraw/zinc/51/08/90/1383510890.db2.gz UKVJAVBVRBLZHL-JSGCOSHPSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC001425060007 1383510898 /nfs/dbraw/zinc/51/08/98/1383510898.db2.gz UKVJAVBVRBLZHL-JSGCOSHPSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)[C@H](C)CNC(=O)[C@H]1CC[N@H+](C)C1 ZINC001425070623 1383515922 /nfs/dbraw/zinc/51/59/22/1383515922.db2.gz LKTRYFKWGAZHFM-ZBFHGGJFSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)[C@H](C)CNC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001425070623 1383515926 /nfs/dbraw/zinc/51/59/26/1383515926.db2.gz LKTRYFKWGAZHFM-ZBFHGGJFSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C1C[NH+](CC2CCC(C)CC2)C1 ZINC001425266257 1383580939 /nfs/dbraw/zinc/58/09/39/1383580939.db2.gz JZJJVBTWXLNFBM-BBBYJDLNSA-N 1 3 332.492 2.523 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001425309187 1383603215 /nfs/dbraw/zinc/60/32/15/1383603215.db2.gz RANXQKUIDBYJJR-DLBZAZTESA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001425309187 1383603212 /nfs/dbraw/zinc/60/32/12/1383603212.db2.gz RANXQKUIDBYJJR-DLBZAZTESA-N 1 3 325.541 2.835 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCCCCC3)C[C@H]21)N(C)C ZINC001425386028 1383645012 /nfs/dbraw/zinc/64/50/12/1383645012.db2.gz XWNNFBPXLYBTOW-OKYOBFRVSA-N 1 3 335.536 2.591 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCCCCC3)C[C@H]21)N(C)C ZINC001425386028 1383645016 /nfs/dbraw/zinc/64/50/16/1383645016.db2.gz XWNNFBPXLYBTOW-OKYOBFRVSA-N 1 3 335.536 2.591 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@H](C[NH2+]CC2CC(C)(C)C2)C2CC2)C1 ZINC001425501153 1383672904 /nfs/dbraw/zinc/67/29/04/1383672904.db2.gz WAHQIGMPZROTAN-CRAIPNDOSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]CC1CCC(C)(C)CC1 ZINC001425690604 1383768156 /nfs/dbraw/zinc/76/81/56/1383768156.db2.gz DKEUKMMXSMYPQX-INIZCTEOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc(Cl)cc2)C[C@H]1C ZINC001425887477 1383830561 /nfs/dbraw/zinc/83/05/61/1383830561.db2.gz JXTMLRMGZSAPLX-RHSMWYFYSA-N 1 3 337.895 2.759 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CC3CC(C)(C)C3)[C@H]2C1 ZINC001425913863 1383850189 /nfs/dbraw/zinc/85/01/89/1383850189.db2.gz FDPDHRKCGMVWDW-FHWLQOOXSA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@H]1[C@@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc(C2CC2)cc1 ZINC001425921779 1383857654 /nfs/dbraw/zinc/85/76/54/1383857654.db2.gz DZDFAWDAPIDOFT-JXFKEZNVSA-N 1 3 343.515 2.985 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]Cc2cccc(C)c2)C(C)(C)C1 ZINC001425969722 1383908272 /nfs/dbraw/zinc/90/82/72/1383908272.db2.gz ICCBNRZMHPLOKQ-GOSISDBHSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCN(C(=O)[C@H]2CC[N@H+](C)C2)C(C)C)c1 ZINC001426131122 1384012999 /nfs/dbraw/zinc/01/29/99/1384012999.db2.gz YCQKRYCTAQMKEA-IBGZPJMESA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCN(C(=O)[C@H]2CC[N@@H+](C)C2)C(C)C)c1 ZINC001426131122 1384013002 /nfs/dbraw/zinc/01/30/02/1384013002.db2.gz YCQKRYCTAQMKEA-IBGZPJMESA-N 1 3 345.531 2.924 10 0 EFAEHO C[C@@H](NC[C@H](NC(=O)CC[NH+](C)C)C(C)(C)C)c1ccccc1F ZINC001426134476 1384016697 /nfs/dbraw/zinc/01/66/97/1384016697.db2.gz GEPFXJJVAZGCHW-PBHICJAKSA-N 1 3 337.483 2.959 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C2CC(N(C)C(=O)CN(C)C(C)C)C2)c1 ZINC001426246546 1384092862 /nfs/dbraw/zinc/09/28/62/1384092862.db2.gz OTVPVACNCUKFTH-UHFFFAOYSA-N 1 3 335.467 2.553 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1(C2CC[NH+](CCC(C)C)CC2)CC1 ZINC001426260517 1384108983 /nfs/dbraw/zinc/10/89/83/1384108983.db2.gz HWWAYLWWIGQSJE-UHFFFAOYSA-N 1 3 332.492 2.668 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCN(C)C(=O)C[C@@H]2CC[N@H+](C)C2)c1 ZINC001438932585 1388934620 /nfs/dbraw/zinc/93/46/20/1388934620.db2.gz RNFIBLZKWSALDE-SFHVURJKSA-N 1 3 331.504 2.535 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCN(C)C(=O)C[C@@H]2CC[N@@H+](C)C2)c1 ZINC001438932585 1388934624 /nfs/dbraw/zinc/93/46/24/1388934624.db2.gz RNFIBLZKWSALDE-SFHVURJKSA-N 1 3 331.504 2.535 10 0 EFAEHO CN(CC[N@H+](C)[C@@H]1CCc2ccc(Cl)cc21)C(=O)CN1CCCC1 ZINC001438940385 1388940686 /nfs/dbraw/zinc/94/06/86/1388940686.db2.gz YCWQSYJOIIXMBN-GOSISDBHSA-N 1 3 349.906 2.813 10 0 EFAEHO CN(CC[N@@H+](C)[C@@H]1CCc2ccc(Cl)cc21)C(=O)CN1CCCC1 ZINC001438940385 1388940688 /nfs/dbraw/zinc/94/06/88/1388940688.db2.gz YCWQSYJOIIXMBN-GOSISDBHSA-N 1 3 349.906 2.813 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+][C@@H](C)c1cc(F)ccc1F ZINC001439079288 1388983304 /nfs/dbraw/zinc/98/33/04/1388983304.db2.gz WORDIXKGNSBKQW-KBPBESRZSA-N 1 3 341.446 2.850 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCc2c1cccc2F)C(=O)CN(C)C(C)C ZINC001439087458 1388988113 /nfs/dbraw/zinc/98/81/13/1388988113.db2.gz ZGSGCIFGTNINQG-GOSISDBHSA-N 1 3 335.467 2.591 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCN2C(C)C)c(C)c1 ZINC001439109303 1388995906 /nfs/dbraw/zinc/99/59/06/1388995906.db2.gz HWARPFSQOSLZQC-MJGOQNOKSA-N 1 3 331.504 2.771 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@H+](CC2CCC2)CC1(C)C)N1CCCC1 ZINC001506752106 1406253855 /nfs/dbraw/zinc/25/38/55/1406253855.db2.gz GMSRTLRQWZSKBT-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@@H+](CC2CCC2)CC1(C)C)N1CCCC1 ZINC001506752106 1406253860 /nfs/dbraw/zinc/25/38/60/1406253860.db2.gz GMSRTLRQWZSKBT-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO Cc1cccnc1CNC[C@@H](C)NC(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001439133156 1389007332 /nfs/dbraw/zinc/00/73/32/1389007332.db2.gz YOAZSFFZIQGRQA-MRXNPFEDSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1cccnc1CNC[C@@H](C)NC(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001439133156 1389007335 /nfs/dbraw/zinc/00/73/35/1389007335.db2.gz YOAZSFFZIQGRQA-MRXNPFEDSA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+][C@H](C)c1ccc(F)c(Cl)c1)N(C)C ZINC001439225531 1389058356 /nfs/dbraw/zinc/05/83/56/1389058356.db2.gz ODQYDOPYGSUGCE-HWWQOWPSSA-N 1 3 343.874 2.975 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc2ccccc2c1)NC(=O)CN1CC[C@@H](C)C1 ZINC001439253103 1389074964 /nfs/dbraw/zinc/07/49/64/1389074964.db2.gz LYDJJLDPRFKEAI-SJORKVTESA-N 1 3 339.483 2.776 10 0 EFAEHO C[C@H](CN(C)[C@@H](C)c1cccc(Cl)c1)NC(=O)C12CC[NH+](CC1)C2 ZINC001439393973 1389232398 /nfs/dbraw/zinc/23/23/98/1389232398.db2.gz APOJVTOGMREJLP-CABCVRRESA-N 1 3 349.906 2.933 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001439403114 1389249512 /nfs/dbraw/zinc/24/95/12/1389249512.db2.gz SCNFRGXPDZEQQX-FUHWJXTLSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001439403114 1389249517 /nfs/dbraw/zinc/24/95/17/1389249517.db2.gz SCNFRGXPDZEQQX-FUHWJXTLSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1cc(Cl)ccc1C[N@@H+](C)C[C@H](C)NC(=O)CN(C)C(C)C ZINC001439406870 1389257002 /nfs/dbraw/zinc/25/70/02/1389257002.db2.gz MPKVUQAMBFWVLT-HNNXBMFYSA-N 1 3 339.911 2.925 10 0 EFAEHO Cc1cc(Cl)ccc1C[N@H+](C)C[C@H](C)NC(=O)CN(C)C(C)C ZINC001439406870 1389257010 /nfs/dbraw/zinc/25/70/10/1389257010.db2.gz MPKVUQAMBFWVLT-HNNXBMFYSA-N 1 3 339.911 2.925 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CCCC2(CN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001506864911 1406372742 /nfs/dbraw/zinc/37/27/42/1406372742.db2.gz KPXHVZBJAMAWBW-GIFJBRJJSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@H+]1CCCC2(CN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001506864911 1406372749 /nfs/dbraw/zinc/37/27/49/1406372749.db2.gz KPXHVZBJAMAWBW-GIFJBRJJSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CCC(F)(F)F)N(C)C ZINC001440124760 1389398493 /nfs/dbraw/zinc/39/84/93/1389398493.db2.gz ZYUKDFCGHPMWGV-LXTVHRRPSA-N 1 3 349.441 2.638 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC(F)(F)F)N(C)C ZINC001440124760 1389398497 /nfs/dbraw/zinc/39/84/97/1389398497.db2.gz ZYUKDFCGHPMWGV-LXTVHRRPSA-N 1 3 349.441 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]CC2CCCCCC2)C1 ZINC001440136445 1389406459 /nfs/dbraw/zinc/40/64/59/1389406459.db2.gz NJYSVJFXWSCZEP-HKUYNNGSSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccccc2C[N@H+](C)CCC2CC2)C1 ZINC001440215067 1389443531 /nfs/dbraw/zinc/44/35/31/1389443531.db2.gz BRCHVKFUNPDGDE-QGZVFWFLSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccccc2C[N@@H+](C)CCC2CC2)C1 ZINC001440215067 1389443534 /nfs/dbraw/zinc/44/35/34/1389443534.db2.gz BRCHVKFUNPDGDE-QGZVFWFLSA-N 1 3 343.515 2.877 10 0 EFAEHO CC(C)C[NH2+][C@@H](C)c1ccc(CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001440225901 1389456508 /nfs/dbraw/zinc/45/65/08/1389456508.db2.gz SUXGSVLFBMZVLV-SJORKVTESA-N 1 3 331.504 2.951 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NCc1ccc([C@H](C)NCCF)cc1 ZINC001440226797 1389457663 /nfs/dbraw/zinc/45/76/63/1389457663.db2.gz VTQMACXCHGCIMT-YJBOKZPZSA-N 1 3 335.467 2.796 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NCc1ccc([C@H](C)NCCF)cc1 ZINC001440226797 1389457667 /nfs/dbraw/zinc/45/76/67/1389457667.db2.gz VTQMACXCHGCIMT-YJBOKZPZSA-N 1 3 335.467 2.796 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@@H+]2CCC2CCCCC2)C1 ZINC001440240329 1389466871 /nfs/dbraw/zinc/46/68/71/1389466871.db2.gz ILTSELKEIIEFSQ-IEBWSBKVSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@H+]2CCC2CCCCC2)C1 ZINC001440240329 1389466874 /nfs/dbraw/zinc/46/68/74/1389466874.db2.gz ILTSELKEIIEFSQ-IEBWSBKVSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CC3(CCC3)C2)C1 ZINC001440312310 1389524912 /nfs/dbraw/zinc/52/49/12/1389524912.db2.gz DIMKTLLFPZDHDN-LSTDLKDCSA-N 1 3 347.547 2.924 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NC[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001440314210 1389526337 /nfs/dbraw/zinc/52/63/37/1389526337.db2.gz RRTZOOOTDMZNFD-KPWCQOOUSA-N 1 3 348.318 2.663 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NC[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001440314210 1389526339 /nfs/dbraw/zinc/52/63/39/1389526339.db2.gz RRTZOOOTDMZNFD-KPWCQOOUSA-N 1 3 348.318 2.663 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+]C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001440372110 1389573115 /nfs/dbraw/zinc/57/31/15/1389573115.db2.gz UBRNHXPKOOOQIW-VGWMRTNUSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)CC1 ZINC001440395480 1389590779 /nfs/dbraw/zinc/59/07/79/1389590779.db2.gz IKDDGRVVGGMYBA-JKSUJKDBSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@@H+](C[C@H]2CCC(F)(F)C2)CC1 ZINC001440395480 1389590782 /nfs/dbraw/zinc/59/07/82/1389590782.db2.gz IKDDGRVVGGMYBA-JKSUJKDBSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)CC1 ZINC001440395472 1389590927 /nfs/dbraw/zinc/59/09/27/1389590927.db2.gz IKDDGRVVGGMYBA-HOTGVXAUSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@@H+](C[C@H]2CCC(F)(F)C2)CC1 ZINC001440395472 1389590929 /nfs/dbraw/zinc/59/09/29/1389590929.db2.gz IKDDGRVVGGMYBA-HOTGVXAUSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@H](NC(=O)CCC[NH+]2CCCCC2)CC1 ZINC001440405089 1389604304 /nfs/dbraw/zinc/60/43/04/1389604304.db2.gz QBBDQTONQBEZJL-MSOLQXFVSA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccsc2)C1)N(C)C ZINC001440407085 1389606315 /nfs/dbraw/zinc/60/63/15/1389606315.db2.gz XLXXPEWHOKDOFI-UAGQMJEPSA-N 1 3 337.533 2.709 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC001440486704 1389691263 /nfs/dbraw/zinc/69/12/63/1389691263.db2.gz YRNUAOIPNIQSSE-IBGZPJMESA-N 1 3 349.494 2.934 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC001440486704 1389691267 /nfs/dbraw/zinc/69/12/67/1389691267.db2.gz YRNUAOIPNIQSSE-IBGZPJMESA-N 1 3 349.494 2.934 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@H]1CCN(Cc2ccccn2)CC(C)(C)C1 ZINC001440539404 1389742515 /nfs/dbraw/zinc/74/25/15/1389742515.db2.gz VTYAJEBGLCIFJT-QGZVFWFLSA-N 1 3 346.519 2.530 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C3CCC3)C2)c1 ZINC001506886485 1406404596 /nfs/dbraw/zinc/40/45/96/1406404596.db2.gz LZRCHIUCFCDJTJ-WGSAOQKQSA-N 1 3 343.515 2.772 10 0 EFAEHO CCc1cccc(C[NH2+]CC2CC(NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001440761415 1389875827 /nfs/dbraw/zinc/87/58/27/1389875827.db2.gz PYNYXYJDUKUSCM-MHJFOBGBSA-N 1 3 345.531 2.820 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H](C)[NH2+]CC1CCC(C)(C)CC1 ZINC001440831775 1389932339 /nfs/dbraw/zinc/93/23/39/1389932339.db2.gz ACMOMNIIMVSPPE-ZIAGYGMSSA-N 1 3 334.508 2.960 10 0 EFAEHO C[C@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)N(C)Cc1cccc(F)c1 ZINC001440933995 1390021431 /nfs/dbraw/zinc/02/14/31/1390021431.db2.gz IEXDWVAFUOZZOW-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)N(C)Cc1cccc(F)c1 ZINC001440933995 1390021436 /nfs/dbraw/zinc/02/14/36/1390021436.db2.gz IEXDWVAFUOZZOW-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CCCCC[NH2+]C[C@H]1C[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001506897563 1406414994 /nfs/dbraw/zinc/41/49/94/1406414994.db2.gz QEKDYKQVVPNWNA-GPMSIDNRSA-N 1 3 341.515 2.874 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CC=C(Cl)Cl)C1 ZINC001506906620 1406424504 /nfs/dbraw/zinc/42/45/04/1406424504.db2.gz MBEJDIPNBDVAND-IHRRRGAJSA-N 1 3 348.318 2.664 10 0 EFAEHO C[C@@H](CCC[NH2+]Cc1ccccc1F)NC(=O)CN1CC[C@H](C)C1 ZINC001506937423 1406467730 /nfs/dbraw/zinc/46/77/30/1406467730.db2.gz APLQYXQLDHHIFP-HOTGVXAUSA-N 1 3 335.467 2.542 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC001441008205 1391028493 /nfs/dbraw/zinc/02/84/93/1391028493.db2.gz PAMUBBWFJMWWBW-OAHLLOKOSA-N 1 3 345.478 2.686 10 0 EFAEHO C[C@H](NC(=O)CC[NH+](C)C)C1CN([C@@H]2CCCc3ccc(F)cc32)C1 ZINC001441184515 1391166353 /nfs/dbraw/zinc/16/63/53/1391166353.db2.gz VUNJAFBXEXUACJ-IFXJQAMLSA-N 1 3 347.478 2.591 10 0 EFAEHO Cc1ccc(C[NH+]2CC([C@H](C)NC(=O)CN3CC[C@H](C)C3)C2)c(C)c1 ZINC001441189390 1391169657 /nfs/dbraw/zinc/16/96/57/1391169657.db2.gz ZVRWXRHXDCLERM-WMZOPIPTSA-N 1 3 343.515 2.582 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001441196402 1391173811 /nfs/dbraw/zinc/17/38/11/1391173811.db2.gz CCYMPCGOTORJFL-VQIMIIECSA-N 1 3 331.504 2.580 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H]([NH2+]CC1CCCC1)C1CC1 ZINC001441231376 1391199585 /nfs/dbraw/zinc/19/95/85/1391199585.db2.gz GFEPQQUZCJPMKO-OALUTQOASA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)[C@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001441271255 1391223121 /nfs/dbraw/zinc/22/31/21/1391223121.db2.gz WCKNSZFZVVTADP-AKHDSKFASA-N 1 3 335.536 2.589 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)[C@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001441271255 1391223125 /nfs/dbraw/zinc/22/31/25/1391223125.db2.gz WCKNSZFZVVTADP-AKHDSKFASA-N 1 3 335.536 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+][C@@H]1CCCc2ccccc21)C1CC1 ZINC001441291913 1391236848 /nfs/dbraw/zinc/23/68/48/1391236848.db2.gz FLTOICINNIFYPS-WOJBJXKFSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@H](F)CC[N@H+](C)C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001441303393 1391242568 /nfs/dbraw/zinc/24/25/68/1391242568.db2.gz RDVPYESUIWGCMO-DLBZAZTESA-N 1 3 343.531 2.883 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001441303393 1391242572 /nfs/dbraw/zinc/24/25/72/1391242572.db2.gz RDVPYESUIWGCMO-DLBZAZTESA-N 1 3 343.531 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@H+](CCc1cccs1)C2 ZINC001441335825 1391256967 /nfs/dbraw/zinc/25/69/67/1391256967.db2.gz HLLUZVJJXFHPST-UHFFFAOYSA-N 1 3 349.544 2.555 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@@H+](CCc1cccs1)C2 ZINC001441335825 1391256971 /nfs/dbraw/zinc/25/69/71/1391256971.db2.gz HLLUZVJJXFHPST-UHFFFAOYSA-N 1 3 349.544 2.555 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CCC[N@H+](CC1CC3(CCC3)C1)C2 ZINC001441339351 1391258590 /nfs/dbraw/zinc/25/85/90/1391258590.db2.gz OLDDEGRXMQDYEC-UHFFFAOYSA-N 1 3 347.547 2.833 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CCC[N@@H+](CC1CC3(CCC3)C1)C2 ZINC001441339351 1391258594 /nfs/dbraw/zinc/25/85/94/1391258594.db2.gz OLDDEGRXMQDYEC-UHFFFAOYSA-N 1 3 347.547 2.833 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccccc2Cl)C1 ZINC001441365104 1391267654 /nfs/dbraw/zinc/26/76/54/1391267654.db2.gz LYJFVXNNHKJPFX-KOMQPUFPSA-N 1 3 337.895 2.665 10 0 EFAEHO CN(CC(=O)N(C)[C@H](C[NH2+]CC1CC(C)(C)C1)C1CC1)C1CCC1 ZINC001441435999 1391303851 /nfs/dbraw/zinc/30/38/51/1391303851.db2.gz TWCLUTIBYGCVGT-GOSISDBHSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc3ccccc32)C1 ZINC001441518850 1391346198 /nfs/dbraw/zinc/34/61/98/1391346198.db2.gz JTYGPUIQXPKOBN-KDURUIRLSA-N 1 3 339.483 2.918 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C)cc2Cl)C1)N(C)C ZINC001441519922 1391348397 /nfs/dbraw/zinc/34/83/97/1391348397.db2.gz FGDHJVGKRBUZTO-HLLBOEOZSA-N 1 3 337.895 2.725 10 0 EFAEHO CC[C@H](F)CN1CCC[C@H](CNC(=O)CCC[NH+]2CCCCC2)C1 ZINC001441577236 1391370985 /nfs/dbraw/zinc/37/09/85/1391370985.db2.gz VRBRDNOZCCQDJB-MSOLQXFVSA-N 1 3 341.515 2.829 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCCN1CCCF)[NH+]1CCCCC1 ZINC001441633107 1391399287 /nfs/dbraw/zinc/39/92/87/1391399287.db2.gz CAGGVPITBHQJMM-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCC[N@@H+]1CCCF)N1CCCCC1 ZINC001441633107 1391399292 /nfs/dbraw/zinc/39/92/92/1391399292.db2.gz CAGGVPITBHQJMM-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCC[N@H+]1CCCF)N1CCCCC1 ZINC001441633107 1391399301 /nfs/dbraw/zinc/39/93/01/1391399301.db2.gz CAGGVPITBHQJMM-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCCN1CCCF)[NH+]1CCCCC1 ZINC001441633111 1391399399 /nfs/dbraw/zinc/39/93/99/1391399399.db2.gz CAGGVPITBHQJMM-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCC[N@@H+]1CCCF)N1CCCCC1 ZINC001441633111 1391399406 /nfs/dbraw/zinc/39/94/06/1391399406.db2.gz CAGGVPITBHQJMM-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCC[N@H+]1CCCF)N1CCCCC1 ZINC001441633111 1391399412 /nfs/dbraw/zinc/39/94/12/1391399412.db2.gz CAGGVPITBHQJMM-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H]1[C@@H](NCc2cccc(Cl)c2F)CCN1C(=O)CC[NH+](C)C ZINC001441823530 1391420521 /nfs/dbraw/zinc/42/05/21/1391420521.db2.gz NFSSFPLSVVBWTA-DOMZBBRYSA-N 1 3 341.858 2.510 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)c1 ZINC001441826001 1391420852 /nfs/dbraw/zinc/42/08/52/1391420852.db2.gz TVTQWYUNOQGUET-VQIMIIECSA-N 1 3 331.504 2.668 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001441841599 1391422119 /nfs/dbraw/zinc/42/21/19/1391422119.db2.gz LXQXFDCARSQYEF-OAHLLOKOSA-N 1 3 329.488 2.643 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(Cl)s1 ZINC001443980911 1391455340 /nfs/dbraw/zinc/45/53/40/1391455340.db2.gz JPTKULKVOKPNCX-STQMWFEESA-N 1 3 343.924 2.728 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H](C)c1cccc(F)c1 ZINC001444940279 1391516135 /nfs/dbraw/zinc/51/61/35/1391516135.db2.gz MKZUINRAGDDNBV-QAPCUYQASA-N 1 3 337.483 2.957 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CC1CCC(F)(F)CC1 ZINC001445550384 1391532812 /nfs/dbraw/zinc/53/28/12/1391532812.db2.gz YGJLFRYDPMDJSH-HOCLYGCPSA-N 1 3 345.478 2.779 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001446948738 1391644806 /nfs/dbraw/zinc/64/48/06/1391644806.db2.gz SHXJBMKDHCCGRD-IAGOWNOFSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccsc1 ZINC001447045266 1391672093 /nfs/dbraw/zinc/67/20/93/1391672093.db2.gz SKHPYCBXNDMGKR-SJORKVTESA-N 1 3 335.517 2.655 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccsc1 ZINC001447045266 1391672095 /nfs/dbraw/zinc/67/20/95/1391672095.db2.gz SKHPYCBXNDMGKR-SJORKVTESA-N 1 3 335.517 2.655 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccsc1 ZINC001447045258 1391672126 /nfs/dbraw/zinc/67/21/26/1391672126.db2.gz SKHPYCBXNDMGKR-IRXDYDNUSA-N 1 3 335.517 2.655 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccsc1 ZINC001447045258 1391672128 /nfs/dbraw/zinc/67/21/28/1391672128.db2.gz SKHPYCBXNDMGKR-IRXDYDNUSA-N 1 3 335.517 2.655 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H](C)[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001447668560 1391729078 /nfs/dbraw/zinc/72/90/78/1391729078.db2.gz KHTCXSVPCTVNBS-HRCADAONSA-N 1 3 347.494 2.883 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]1C[N@H+](C)CCCc1ccsc1 ZINC001447771682 1391757940 /nfs/dbraw/zinc/75/79/40/1391757940.db2.gz KTFXBUXNALEICS-MSOLQXFVSA-N 1 3 349.544 2.698 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]1C[N@@H+](C)CCCc1ccsc1 ZINC001447771682 1391757943 /nfs/dbraw/zinc/75/79/43/1391757943.db2.gz KTFXBUXNALEICS-MSOLQXFVSA-N 1 3 349.544 2.698 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[N@H+](C)CCCc1ccccc1)N(C)C ZINC001447780204 1391766079 /nfs/dbraw/zinc/76/60/79/1391766079.db2.gz KDJVSUGFRAAEAU-VQTJNVASSA-N 1 3 345.531 2.882 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[N@@H+](C)CCCc1ccccc1)N(C)C ZINC001447780204 1391766083 /nfs/dbraw/zinc/76/60/83/1391766083.db2.gz KDJVSUGFRAAEAU-VQTJNVASSA-N 1 3 345.531 2.882 10 0 EFAEHO CCc1cccc(C[NH2+]CC2CC(NC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001447798774 1391770808 /nfs/dbraw/zinc/77/08/08/1391770808.db2.gz SOBYXVUIPJSCIM-UHFFFAOYSA-N 1 3 343.515 2.718 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](C)[C@@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001447884853 1391790586 /nfs/dbraw/zinc/79/05/86/1391790586.db2.gz MJUAKJDNRIDVED-DLBZAZTESA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C(C)C)c(C)c1 ZINC001447926100 1391817685 /nfs/dbraw/zinc/81/76/85/1391817685.db2.gz AWRZHGPHKYWFOV-ROUUACIJSA-N 1 3 333.520 2.935 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CCC([NH2+]Cc2ccsc2)CC1 ZINC001447943825 1391844857 /nfs/dbraw/zinc/84/48/57/1391844857.db2.gz CXCOFBPYIPDLPD-UHFFFAOYSA-N 1 3 337.533 2.949 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@H](C)CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001448042153 1391912551 /nfs/dbraw/zinc/91/25/51/1391912551.db2.gz OPHMTFSUJDTTHH-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@H](C)CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001448042153 1391912555 /nfs/dbraw/zinc/91/25/55/1391912555.db2.gz OPHMTFSUJDTTHH-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[N@H+](C)[C@H]1CCc2ccccc21 ZINC001448068997 1391929672 /nfs/dbraw/zinc/92/96/72/1391929672.db2.gz JBLBZDHQLXWFDJ-APWZRJJASA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001448068997 1391929677 /nfs/dbraw/zinc/92/96/77/1391929677.db2.gz JBLBZDHQLXWFDJ-APWZRJJASA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@@H](C(=O)NC1(C[NH2+]Cc2cccnc2C)CCCCC1)N(C)C ZINC001448225711 1392033904 /nfs/dbraw/zinc/03/39/04/1392033904.db2.gz NXKGIROTIQRFTB-SFHVURJKSA-N 1 3 346.519 2.639 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2[C@H]3C[N@@H+](CCC4CCCCC4)C[C@H]32)C1 ZINC001448436473 1392084176 /nfs/dbraw/zinc/08/41/76/1392084176.db2.gz FNKCHUFIDMEVKM-FRYIKTPZSA-N 1 3 347.547 2.593 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2[C@H]3C[N@H+](CCC4CCCCC4)C[C@H]32)C1 ZINC001448436473 1392084178 /nfs/dbraw/zinc/08/41/78/1392084178.db2.gz FNKCHUFIDMEVKM-FRYIKTPZSA-N 1 3 347.547 2.593 10 0 EFAEHO C[C@@H]1C[C@H](NCc2ccsc2)CN1C(=O)CCC[NH+]1CCCC1 ZINC001449016927 1392208277 /nfs/dbraw/zinc/20/82/77/1392208277.db2.gz NLBVDIOKJIJOGC-WBVHZDCISA-N 1 3 335.517 2.703 10 0 EFAEHO C[C@H]1C[C@@H](NCc2ccsc2)CN1C(=O)CCC[NH+]1CCCC1 ZINC001449016924 1392209045 /nfs/dbraw/zinc/20/90/45/1392209045.db2.gz NLBVDIOKJIJOGC-DOTOQJQBSA-N 1 3 335.517 2.703 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@@H](C[NH2+]Cc2ccc(F)cc2)C1 ZINC001449057852 1392241795 /nfs/dbraw/zinc/24/17/95/1392241795.db2.gz IKRCYAXANIKFSY-AEFFLSMTSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)(C(=O)NCc1ccc(C[NH2+]CC2CC2)cc1F)N1CCCC1 ZINC001449419698 1392263419 /nfs/dbraw/zinc/26/34/19/1392263419.db2.gz WWGQZXVMRZNZIN-UHFFFAOYSA-N 1 3 347.478 2.816 10 0 EFAEHO CN(C)C[C@H](NC(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(F)cc1 ZINC001450711699 1392710314 /nfs/dbraw/zinc/71/03/14/1392710314.db2.gz WOFVRIKOANEYNL-JQHSSLGASA-N 1 3 335.467 2.665 10 0 EFAEHO CN(C)C[C@H](NC(=O)[C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(F)cc1 ZINC001450711731 1392710664 /nfs/dbraw/zinc/71/06/64/1392710664.db2.gz WOFVRIKOANEYNL-SZMVWBNQSA-N 1 3 335.467 2.665 10 0 EFAEHO CN(CC(=O)N(C)[C@@H](C[NH2+]CC1=CCCCC1)C1CC1)C1CCC1 ZINC001507013781 1406588953 /nfs/dbraw/zinc/58/89/53/1406588953.db2.gz ZHIDONWIBTZGOC-IBGZPJMESA-N 1 3 333.520 2.798 10 0 EFAEHO CN(C(=O)C(C)(C)N1CCCCC1)[C@@H](C[NH2+]C/C=C/Cl)C1CC1 ZINC001507014184 1406590484 /nfs/dbraw/zinc/59/04/84/1406590484.db2.gz WRACJVVQLMQJNX-JCVNQNCUSA-N 1 3 341.927 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001507037621 1406625040 /nfs/dbraw/zinc/62/50/40/1406625040.db2.gz WUEVXCMNGAUPBY-GOSISDBHSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@@H]1C[NH+]2CCC1CC2)NCc1ccccc1Cl ZINC001507072452 1406665568 /nfs/dbraw/zinc/66/55/68/1406665568.db2.gz HBJUSHFRMCDCGN-RHSMWYFYSA-N 1 3 349.906 2.618 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001507126890 1406739106 /nfs/dbraw/zinc/73/91/06/1406739106.db2.gz OPOBFVUMQFMXBB-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccccc1C1CC1 ZINC001507128959 1406743466 /nfs/dbraw/zinc/74/34/66/1406743466.db2.gz WGWGUKPPJPJGOY-SJORKVTESA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C[C@@H](C)NCc1ccccc1F)[NH+]1CCCC1 ZINC001507161126 1406790385 /nfs/dbraw/zinc/79/03/85/1406790385.db2.gz ISOFPWROBMKXDE-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001507163291 1406794308 /nfs/dbraw/zinc/79/43/08/1406794308.db2.gz UGWWJEFTEOPLJR-GJZGRUSLSA-N 1 3 333.467 2.589 10 0 EFAEHO CN(Cc1ccc(C[NH+](C)C)cc1)C[C@H]1CCC[C@@]2(CCOC2)O1 ZINC001459880626 1395988828 /nfs/dbraw/zinc/98/88/28/1395988828.db2.gz XQYIJDZAHRUDCC-UXHICEINSA-N 1 3 332.488 2.908 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)[C@H]1C ZINC001507296235 1406861458 /nfs/dbraw/zinc/86/14/58/1406861458.db2.gz HLZGKHNQFKLOJJ-OXQOHEQNSA-N 1 3 343.515 2.983 10 0 EFAEHO CCc1ccc([C@@H](C)NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC001469669589 1397047892 /nfs/dbraw/zinc/04/78/92/1397047892.db2.gz VCXGLJNVDQWHRX-DLBZAZTESA-N 1 3 348.535 2.881 10 0 EFAEHO CCc1ccc([C@@H](C)NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC001469669589 1397047896 /nfs/dbraw/zinc/04/78/96/1397047896.db2.gz VCXGLJNVDQWHRX-DLBZAZTESA-N 1 3 348.535 2.881 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cccc(OC(C)(C)C)c1 ZINC001470026938 1397067098 /nfs/dbraw/zinc/06/70/98/1397067098.db2.gz VJNFPGPMYGLDMG-INIZCTEOSA-N 1 3 349.519 2.866 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cccc(OC(C)(C)C)c1 ZINC001470026938 1397067107 /nfs/dbraw/zinc/06/71/07/1397067107.db2.gz VJNFPGPMYGLDMG-INIZCTEOSA-N 1 3 349.519 2.866 10 0 EFAEHO C[C@@H](CN1CCOCC1)C[N@@H+]1CCC[C@@H]1CCN1CCC(C)CC1 ZINC001473716715 1397323956 /nfs/dbraw/zinc/32/39/56/1397323956.db2.gz JSWUTNJOUDANPW-VQTJNVASSA-N 1 3 337.552 2.541 10 0 EFAEHO C[C@@H](CN1CCOCC1)C[N@H+]1CCC[C@@H]1CCN1CCC(C)CC1 ZINC001473716715 1397323960 /nfs/dbraw/zinc/32/39/60/1397323960.db2.gz JSWUTNJOUDANPW-VQTJNVASSA-N 1 3 337.552 2.541 10 0 EFAEHO C[C@H](CN1CCOCC1)C[N@@H+]1CCC[C@H]1CCN1CCC(C)CC1 ZINC001473716714 1397324152 /nfs/dbraw/zinc/32/41/52/1397324152.db2.gz JSWUTNJOUDANPW-UXHICEINSA-N 1 3 337.552 2.541 10 0 EFAEHO C[C@H](CN1CCOCC1)C[N@H+]1CCC[C@H]1CCN1CCC(C)CC1 ZINC001473716714 1397324161 /nfs/dbraw/zinc/32/41/61/1397324161.db2.gz JSWUTNJOUDANPW-UXHICEINSA-N 1 3 337.552 2.541 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H]2C[C@H](C)N(C(=O)C3(C[NH+](C)C)CC3)C2)c1 ZINC001507321781 1406886782 /nfs/dbraw/zinc/88/67/82/1406886782.db2.gz QLLOVXSMFFHNTB-DOTOQJQBSA-N 1 3 347.478 2.555 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@@H]2CN(C)C(=O)C[C@H]2CC[N@H+](C)C2)c1 ZINC001479260179 1397650051 /nfs/dbraw/zinc/65/00/51/1397650051.db2.gz HMYOJCVYKSZMGI-UYAOXDASSA-N 1 3 343.515 2.678 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@@H]2CN(C)C(=O)C[C@H]2CC[N@@H+](C)C2)c1 ZINC001479260179 1397650056 /nfs/dbraw/zinc/65/00/56/1397650056.db2.gz HMYOJCVYKSZMGI-UYAOXDASSA-N 1 3 343.515 2.678 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+]C/C=C\c2ccccc2)C1 ZINC001479347962 1397699155 /nfs/dbraw/zinc/69/91/55/1397699155.db2.gz MLKSKJZSTRPABH-ZLOHZDAMSA-N 1 3 329.488 2.524 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2C[C@H]([NH2+]CCC3CCCCC3)C2)C1 ZINC001479398916 1397714819 /nfs/dbraw/zinc/71/48/19/1397714819.db2.gz JZNQVBLYUGEMBE-WDSOQIARSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1C[C@H]([NH2+]CCCC2CCCC2)C1 ZINC001479411109 1397718919 /nfs/dbraw/zinc/71/89/19/1397718919.db2.gz XKJDMKZUAWXOGN-QAQDUYKDSA-N 1 3 332.492 2.715 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+][C@H]1C[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001479416889 1397720671 /nfs/dbraw/zinc/72/06/71/1397720671.db2.gz NHDRZMQOJPKTBC-BZSNNMDCSA-N 1 3 331.504 2.881 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]CC3CCCCC3)C2)C1 ZINC001479475777 1397733018 /nfs/dbraw/zinc/73/30/18/1397733018.db2.gz NAYPCCYUBWBHNP-YTQUADARSA-N 1 3 335.536 2.783 10 0 EFAEHO C[C@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@@H]1CC[NH2+]Cc1ccsc1 ZINC001479522644 1397749533 /nfs/dbraw/zinc/74/95/33/1397749533.db2.gz LPKQHOJTGSFCHS-WMLDXEAASA-N 1 3 346.500 2.821 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[N@H+](C)Cc1ccc(F)cc1 ZINC001479738918 1397792847 /nfs/dbraw/zinc/79/28/47/1397792847.db2.gz MTUQNYDXGYUPBX-IBGZPJMESA-N 1 3 349.494 2.980 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[N@@H+](C)Cc1ccc(F)cc1 ZINC001479738918 1397792849 /nfs/dbraw/zinc/79/28/49/1397792849.db2.gz MTUQNYDXGYUPBX-IBGZPJMESA-N 1 3 349.494 2.980 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@H+](C)Cc2ccccc2C2CC2)CCC1 ZINC001479775416 1397842965 /nfs/dbraw/zinc/84/29/65/1397842965.db2.gz VOVWLONUROWCRC-UHFFFAOYSA-N 1 3 343.515 2.986 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@@H+](C)Cc2ccccc2C2CC2)CCC1 ZINC001479775416 1397842975 /nfs/dbraw/zinc/84/29/75/1397842975.db2.gz VOVWLONUROWCRC-UHFFFAOYSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001479777341 1397845757 /nfs/dbraw/zinc/84/57/57/1397845757.db2.gz LOUZGBISCUYWFL-SFHVURJKSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001479777341 1397845758 /nfs/dbraw/zinc/84/57/58/1397845758.db2.gz LOUZGBISCUYWFL-SFHVURJKSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001479777373 1397845974 /nfs/dbraw/zinc/84/59/74/1397845974.db2.gz NKXRFOJMFUFHKW-HOTGVXAUSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001479777373 1397845978 /nfs/dbraw/zinc/84/59/78/1397845978.db2.gz NKXRFOJMFUFHKW-HOTGVXAUSA-N 1 3 347.494 2.836 10 0 EFAEHO Cc1cccnc1C[NH2+][C@@H](C)[C@@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001479835859 1397931420 /nfs/dbraw/zinc/93/14/20/1397931420.db2.gz YFQNQRZHDHKWAZ-HKUYNNGSSA-N 1 3 346.519 2.589 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C1CC1)[C@@H]1CCc2ccccc21)N(C)C ZINC001479879819 1397994496 /nfs/dbraw/zinc/99/44/96/1397994496.db2.gz MSJFONBCXALSPE-WOJBJXKFSA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21)N(C)C ZINC001479879819 1397994502 /nfs/dbraw/zinc/99/45/02/1397994502.db2.gz MSJFONBCXALSPE-WOJBJXKFSA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CCN(Cc2ccccc2C)C1)[NH+](CC)CC ZINC001479963664 1398049428 /nfs/dbraw/zinc/04/94/28/1398049428.db2.gz PYHQZLDOFOIZTB-OALUTQOASA-N 1 3 331.504 2.806 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(C[C@@H]2NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001479984717 1398069521 /nfs/dbraw/zinc/06/95/21/1398069521.db2.gz HJVRXCMYRXORTH-KBSZCIAZSA-N 1 3 335.536 2.900 10 0 EFAEHO CCCCCC[NH+]1CCC2(C[C@@H]2NC(=O)CN2CC[C@H](C)C2)CC1 ZINC001479985127 1398070625 /nfs/dbraw/zinc/07/06/25/1398070625.db2.gz KYFQEKQCZLSUIR-ROUUACIJSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CC(C)(C)C1 ZINC001480536871 1398198506 /nfs/dbraw/zinc/19/85/06/1398198506.db2.gz KJKGKYGKPQWEIF-LIRRHRJNSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001480548314 1398202544 /nfs/dbraw/zinc/20/25/44/1398202544.db2.gz JRXGPHTZZFWQSP-CRAIPNDOSA-N 1 3 335.467 2.683 10 0 EFAEHO CCC/C=C\CC[NH2+]C[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001480669424 1398273348 /nfs/dbraw/zinc/27/33/48/1398273348.db2.gz TZZWAEBJHYWSQL-VOFKWLDRSA-N 1 3 335.536 2.903 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](C[NH2+]CCCCc2ccccc2)C1 ZINC001480679243 1398279240 /nfs/dbraw/zinc/27/92/40/1398279240.db2.gz IUPQYMKRWLXNMH-FQEVSTJZSA-N 1 3 343.515 2.543 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001480682121 1398279702 /nfs/dbraw/zinc/27/97/02/1398279702.db2.gz CFXOKVKPKUCINO-KRWDZBQOSA-N 1 3 331.504 2.527 10 0 EFAEHO CN(CC(=O)NCCC[C@H]1CCC[N@H+]1C/C=C\Cl)C1CCC1 ZINC001480826768 1398335249 /nfs/dbraw/zinc/33/52/49/1398335249.db2.gz SQEZXBKLEDVUDF-AVFOEOQDSA-N 1 3 327.900 2.584 10 0 EFAEHO CN(CC(=O)NCCC[C@H]1CCC[N@@H+]1C/C=C\Cl)C1CCC1 ZINC001480826768 1398335244 /nfs/dbraw/zinc/33/52/44/1398335244.db2.gz SQEZXBKLEDVUDF-AVFOEOQDSA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1ccc(F)cc1 ZINC001493002635 1398354108 /nfs/dbraw/zinc/35/41/08/1398354108.db2.gz WXGYQBORHYNIRB-UHFFFAOYSA-N 1 3 335.467 2.638 10 0 EFAEHO CCN(CCNC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C)Cc1ccc(C)c(F)c1 ZINC001493062638 1398407133 /nfs/dbraw/zinc/40/71/33/1398407133.db2.gz LHFCNVSRRJPDBB-CALCHBBNSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN(CCNC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C)Cc1ccc(C)c(F)c1 ZINC001493062638 1398407135 /nfs/dbraw/zinc/40/71/35/1398407135.db2.gz LHFCNVSRRJPDBB-CALCHBBNSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N1CCC[C@@H]1CNC(=O)CC[NH+](C)C ZINC001493134446 1398469415 /nfs/dbraw/zinc/46/94/15/1398469415.db2.gz WKZJNLJVXYYLJE-QZTJIDSGSA-N 1 3 335.467 2.809 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@@H]2CCCN2C/C=C\c2ccccc2)C1 ZINC001493153280 1398484704 /nfs/dbraw/zinc/48/47/04/1398484704.db2.gz ZQGDBSDDRYKPDY-NIKFVJRQSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@@H]2CCCN2C/C=C\c2ccccc2)C1 ZINC001493153280 1398484706 /nfs/dbraw/zinc/48/47/06/1398484706.db2.gz ZQGDBSDDRYKPDY-NIKFVJRQSA-N 1 3 341.499 2.622 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCN(Cc2cccc(F)c2)C1)[NH+]1CCCC1 ZINC001493224416 1398544789 /nfs/dbraw/zinc/54/47/89/1398544789.db2.gz XPRMFPAOSYGNJH-KRWDZBQOSA-N 1 3 347.478 2.638 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1CC[C@@H](C)C1)[C@H]1CCc2ccccc21 ZINC001493317819 1398609570 /nfs/dbraw/zinc/60/95/70/1398609570.db2.gz GZAWIRQURYAPIL-XLIONFOSSA-N 1 3 343.515 2.844 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1CC[C@@H](C)C1)[C@H]1CCc2ccccc21 ZINC001493317819 1398609573 /nfs/dbraw/zinc/60/95/73/1398609573.db2.gz GZAWIRQURYAPIL-XLIONFOSSA-N 1 3 343.515 2.844 10 0 EFAEHO CCC[N@H+](CCNC(=O)Cc1nc[nH]c1C)C[C@H]1CCC(F)(F)C1 ZINC001493330954 1398618908 /nfs/dbraw/zinc/61/89/08/1398618908.db2.gz ODHXCOKCAVVXRO-AWEZNQCLSA-N 1 3 342.434 2.524 10 0 EFAEHO CCC[N@@H+](CCNC(=O)Cc1nc[nH]c1C)C[C@H]1CCC(F)(F)C1 ZINC001493330954 1398618912 /nfs/dbraw/zinc/61/89/12/1398618912.db2.gz ODHXCOKCAVVXRO-AWEZNQCLSA-N 1 3 342.434 2.524 10 0 EFAEHO C[NH+](C)CCC(=O)NCCN(Cc1ccc2ccccc2c1)C1CC1 ZINC001493413639 1398686739 /nfs/dbraw/zinc/68/67/39/1398686739.db2.gz XTGIQBMAPHGAOA-UHFFFAOYSA-N 1 3 339.483 2.872 10 0 EFAEHO Cc1cccc([C@H](C)[N@@H+](CCNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001493451311 1398718153 /nfs/dbraw/zinc/71/81/53/1398718153.db2.gz YWIFGVXFPMOZDM-KRWDZBQOSA-N 1 3 331.504 2.977 10 0 EFAEHO Cc1cccc([C@H](C)[N@H+](CCNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001493451311 1398718156 /nfs/dbraw/zinc/71/81/56/1398718156.db2.gz YWIFGVXFPMOZDM-KRWDZBQOSA-N 1 3 331.504 2.977 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+]CC[C@H]2CCc3ccccc32)CCC1 ZINC001493575006 1398758723 /nfs/dbraw/zinc/75/87/23/1398758723.db2.gz QFYHPJMZYWIRHZ-GOSISDBHSA-N 1 3 343.515 2.639 10 0 EFAEHO CN(CCNCc1cc2ccccc2o1)C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001493584098 1398762141 /nfs/dbraw/zinc/76/21/41/1398762141.db2.gz KJCBORNCYDYJHS-KRWDZBQOSA-N 1 3 343.471 2.855 10 0 EFAEHO CN(CCNCc1cc2ccccc2o1)C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001493584098 1398762149 /nfs/dbraw/zinc/76/21/49/1398762149.db2.gz KJCBORNCYDYJHS-KRWDZBQOSA-N 1 3 343.471 2.855 10 0 EFAEHO CN(CCNCc1cc2ccccc2o1)C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001493584101 1398762412 /nfs/dbraw/zinc/76/24/12/1398762412.db2.gz KJCBORNCYDYJHS-QGZVFWFLSA-N 1 3 343.471 2.855 10 0 EFAEHO CN(CCNCc1cc2ccccc2o1)C(=O)CC[C@H]1CCC[N@H+]1C ZINC001493584101 1398762414 /nfs/dbraw/zinc/76/24/14/1398762414.db2.gz KJCBORNCYDYJHS-QGZVFWFLSA-N 1 3 343.471 2.855 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)N(C)CCNCc1cc2ccccc2o1 ZINC001493804010 1398894593 /nfs/dbraw/zinc/89/45/93/1398894593.db2.gz XRTXYUUNGRTASE-HZPDHXFCSA-N 1 3 343.471 2.854 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]CC1CCC(F)(F)CC1 ZINC001493806075 1398895527 /nfs/dbraw/zinc/89/55/27/1398895527.db2.gz FJFZCHSICPLQMW-INIZCTEOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCNCc1ccsc1)[NH+]1CCCCC1 ZINC001493807198 1398896471 /nfs/dbraw/zinc/89/64/71/1398896471.db2.gz XIYGRFCPEMRAJP-QGZVFWFLSA-N 1 3 337.533 2.807 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)N1C[C@H]2CC[C@@H](C1)N2CCCCCF ZINC001493931029 1398982845 /nfs/dbraw/zinc/98/28/45/1398982845.db2.gz ZIENISZSDOPDHJ-TVFCKZIOSA-N 1 3 339.499 2.674 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@H+](C)[C@@H](C)c2ccccc2)C1 ZINC001494179580 1399192083 /nfs/dbraw/zinc/19/20/83/1399192083.db2.gz RWZVJKDJJMQQGN-ROUUACIJSA-N 1 3 331.504 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@@H+](C)[C@@H](C)c2ccccc2)C1 ZINC001494179580 1399192090 /nfs/dbraw/zinc/19/20/90/1399192090.db2.gz RWZVJKDJJMQQGN-ROUUACIJSA-N 1 3 331.504 2.868 10 0 EFAEHO C[N@H+](CCC1CCCCC1)C[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001494182301 1399195136 /nfs/dbraw/zinc/19/51/36/1399195136.db2.gz XWPIOQSHOQGNKI-IBGZPJMESA-N 1 3 335.536 2.833 10 0 EFAEHO C[N@@H+](CCC1CCCCC1)C[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001494182301 1399195138 /nfs/dbraw/zinc/19/51/38/1399195138.db2.gz XWPIOQSHOQGNKI-IBGZPJMESA-N 1 3 335.536 2.833 10 0 EFAEHO Cc1cccc(C)c1CN1CC(CNC(=O)CCCC[NH+](C)C)C1 ZINC001494623955 1399403651 /nfs/dbraw/zinc/40/36/51/1399403651.db2.gz CUSGDURJXHJTME-UHFFFAOYSA-N 1 3 331.504 2.583 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N2C[C@@H]3C[C@H]2CN3CCCC(C)C)C1 ZINC001494666376 1399422126 /nfs/dbraw/zinc/42/21/26/1399422126.db2.gz GVIUFVAFGKFGJA-QYZOEREBSA-N 1 3 335.536 2.830 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N2C[C@@H]3C[C@H]2CN3CCCC(C)C)C1 ZINC001494666376 1399422127 /nfs/dbraw/zinc/42/21/27/1399422127.db2.gz GVIUFVAFGKFGJA-QYZOEREBSA-N 1 3 335.536 2.830 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)N1C[C@@H]2C[C@H]1CN2CC1CC2(CCC2)C1 ZINC001494684966 1399431829 /nfs/dbraw/zinc/43/18/29/1399431829.db2.gz DGPIWKCFZONOJL-OALUTQOASA-N 1 3 345.531 2.728 10 0 EFAEHO CC(C)=CCN1CC[C@@H](N(C)C(=O)[C@@H](C(C)C)[NH+]2CCCCC2)C1 ZINC001494873448 1399519734 /nfs/dbraw/zinc/51/97/34/1399519734.db2.gz BQTHXYDJBLOPPK-RTBURBONSA-N 1 3 335.536 2.996 10 0 EFAEHO CCN(C(=O)CC[C@@H]1CCC[N@@H+]1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001494907186 1399546505 /nfs/dbraw/zinc/54/65/05/1399546505.db2.gz XKBPUBYLRWNKTL-VQTJNVASSA-N 1 3 343.515 2.984 10 0 EFAEHO CCN(C(=O)CC[C@@H]1CCC[N@H+]1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001494907186 1399546507 /nfs/dbraw/zinc/54/65/07/1399546507.db2.gz XKBPUBYLRWNKTL-VQTJNVASSA-N 1 3 343.515 2.984 10 0 EFAEHO CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@H+](CC(C)C)C1 ZINC001494909992 1399549342 /nfs/dbraw/zinc/54/93/42/1399549342.db2.gz JWZODDLKQQBVFG-VQIMIIECSA-N 1 3 341.515 2.778 10 0 EFAEHO CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@@H+](CC(C)C)C1 ZINC001494909992 1399549343 /nfs/dbraw/zinc/54/93/43/1399549343.db2.gz JWZODDLKQQBVFG-VQIMIIECSA-N 1 3 341.515 2.778 10 0 EFAEHO CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@H+](CC2CC2)C1 ZINC001494911633 1399550644 /nfs/dbraw/zinc/55/06/44/1399550644.db2.gz WOWVRRCHMGILCG-VQIMIIECSA-N 1 3 339.499 2.532 10 0 EFAEHO CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC001494911633 1399550648 /nfs/dbraw/zinc/55/06/48/1399550648.db2.gz WOWVRRCHMGILCG-VQIMIIECSA-N 1 3 339.499 2.532 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]CCc1ccc(C)cc1 ZINC001494985620 1399590276 /nfs/dbraw/zinc/59/02/76/1399590276.db2.gz QKNBPSITGKVXFI-WOJBJXKFSA-N 1 3 345.531 2.895 10 0 EFAEHO CC[C@@H](CNC(=O)c1ccc(C[NH+](C)C)cc1)NCc1cncs1 ZINC001495079801 1399648734 /nfs/dbraw/zinc/64/87/34/1399648734.db2.gz ICLYCJYXYNDKMD-INIZCTEOSA-N 1 3 346.500 2.503 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@@H]1CN(C(=O)C(C)(C)N2CCCCC2)CC1(C)C ZINC001507431001 1407045284 /nfs/dbraw/zinc/04/52/84/1407045284.db2.gz IOQPRUKOOSWSEY-HZPDHXFCSA-N 1 3 341.515 2.826 10 0 EFAEHO CN(CC(=O)NC1(C[NH2+]CC=C(Cl)Cl)CCCC1)C1CCC1 ZINC001495181549 1399718923 /nfs/dbraw/zinc/71/89/23/1399718923.db2.gz RNQWAWXDWQOOBF-UHFFFAOYSA-N 1 3 348.318 2.808 10 0 EFAEHO CCCN(C)CC(=O)N[C@@](C)(C[NH2+][C@H]1CCc2ccccc21)C1CC1 ZINC001495298927 1399806700 /nfs/dbraw/zinc/80/67/00/1399806700.db2.gz QOMMNERRVRRIHW-FPOVZHCZSA-N 1 3 343.515 2.890 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@](C)(C[NH2+]C/C=C\Cl)C2CC2)c1 ZINC001495304856 1399817142 /nfs/dbraw/zinc/81/71/42/1399817142.db2.gz YHBPKGSHVHIBJX-AJWDXOCTSA-N 1 3 349.906 2.989 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H]2CCCN(C(=O)[C@@H]3CCCN3C)C2)cs1 ZINC001495348075 1399885297 /nfs/dbraw/zinc/88/52/97/1399885297.db2.gz VMJDJNXEQCNZKI-AEFFLSMTSA-N 1 3 349.544 2.869 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@@H](CC[NH2+]CC3CCC3)C2)CC1 ZINC001495376157 1399922438 /nfs/dbraw/zinc/92/24/38/1399922438.db2.gz AGHISOVUMZGPNS-IBGZPJMESA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H](CC[NH2+]C/C=C/Cl)C1)N(C)C ZINC001495381053 1399926760 /nfs/dbraw/zinc/92/67/60/1399926760.db2.gz RLPHDDGEGIARQK-HKFHSAMXSA-N 1 3 329.916 2.543 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](CC[NH2+]CC2CC(C)(C)C2)C1 ZINC001495380907 1399927021 /nfs/dbraw/zinc/92/70/21/1399927021.db2.gz UCGORAOBRSBLSO-KRWDZBQOSA-N 1 3 337.552 2.983 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(CC[NH2+]CC[C@H](C)F)CC1 ZINC001495438268 1399980812 /nfs/dbraw/zinc/98/08/12/1399980812.db2.gz TYKIATAPLPKLSR-FUHWJXTLSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+]CCC1CCN(C(=O)CN2CCCC2)CC1 ZINC001495446275 1399985560 /nfs/dbraw/zinc/98/55/60/1399985560.db2.gz UFJUWJBSMWRYLG-SFHVURJKSA-N 1 3 337.552 2.983 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC(CC[NH2+]CCF)CC2)c1 ZINC001495446288 1399986075 /nfs/dbraw/zinc/98/60/75/1399986075.db2.gz URQRRSFFOBAAGX-UHFFFAOYSA-N 1 3 335.467 2.550 10 0 EFAEHO CCCN(C)CC(=O)NCCC1CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001495535352 1400065821 /nfs/dbraw/zinc/06/58/21/1400065821.db2.gz LJGBFCQJRFJGIC-HSALFYBXSA-N 1 3 349.563 2.983 10 0 EFAEHO CCCN(C)CC(=O)NCCC1CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001495535346 1400066495 /nfs/dbraw/zinc/06/64/95/1400066495.db2.gz LJGBFCQJRFJGIC-AQNXPRMDSA-N 1 3 349.563 2.983 10 0 EFAEHO CC[C@@H](F)C[NH+]1CCC(CCNC(=O)[C@H]2CCCCN2CC)CC1 ZINC001495539647 1400070956 /nfs/dbraw/zinc/07/09/56/1400070956.db2.gz GSQKHSMNUXNRPU-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](F)C[NH+]1CCC(CCNC(=O)[C@@H]2CCCCN2CC)CC1 ZINC001495539646 1400071458 /nfs/dbraw/zinc/07/14/58/1400071458.db2.gz GSQKHSMNUXNRPU-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001495685494 1400165218 /nfs/dbraw/zinc/16/52/18/1400165218.db2.gz RRGKAPIJJLLDOQ-GJZGRUSLSA-N 1 3 345.478 2.638 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)C[NH2+][C@H]1CCc2ccccc21 ZINC001495743278 1400217283 /nfs/dbraw/zinc/21/72/83/1400217283.db2.gz OFXBRNBABMDWHO-APWZRJJASA-N 1 3 345.531 2.994 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]C[C@H]2CCC(F)(F)C2)CCCC1 ZINC001495963609 1400386277 /nfs/dbraw/zinc/38/62/77/1400386277.db2.gz LSBWKANKUOSYGS-HNNXBMFYSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@H](C[NH2+][C@@H](C)c1ccc2c(c1)CCC2)N(C)C(=O)CN1CCCC1 ZINC001496230525 1400557398 /nfs/dbraw/zinc/55/73/98/1400557398.db2.gz XQTDJCZWHQRUJW-SJORKVTESA-N 1 3 343.515 2.769 10 0 EFAEHO C[C@@H](C[NH2+]CCC(F)(F)F)N(C)C(=O)c1cccc(CN(C)C)c1 ZINC001496239078 1400564624 /nfs/dbraw/zinc/56/46/24/1400564624.db2.gz PHXQBNSAXCZYEU-ZDUSSCGKSA-N 1 3 345.409 2.751 10 0 EFAEHO CC(C)C[C@H](CNCCF)NC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001496284325 1400599055 /nfs/dbraw/zinc/59/90/55/1400599055.db2.gz HAVODCMQUFGZFO-AEFFLSMTSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)C[C@H](CNCCF)NC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001496284325 1400599056 /nfs/dbraw/zinc/59/90/56/1400599056.db2.gz HAVODCMQUFGZFO-AEFFLSMTSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)C[C@H](CNCc1ccccn1)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001496287098 1400602124 /nfs/dbraw/zinc/60/21/24/1400602124.db2.gz ZQKWWZIQDSSCON-GOSISDBHSA-N 1 3 346.519 2.577 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]C/C=C/Cl)C1CCCCC1 ZINC001496328711 1400644067 /nfs/dbraw/zinc/64/40/67/1400644067.db2.gz ZTGWNJLFHWVYJC-OJXHRBAXSA-N 1 3 329.916 2.734 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@@H]1CC[NH2+]CC1=CCCCC1 ZINC001496410043 1400711945 /nfs/dbraw/zinc/71/19/45/1400711945.db2.gz AHLGRVSECONAMS-GOSISDBHSA-N 1 3 330.476 2.813 10 0 EFAEHO CC[C@H](C)C[N@H+](C)CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001496507762 1400783204 /nfs/dbraw/zinc/78/32/04/1400783204.db2.gz CGPCXAOBMVRYPW-ZWKOTPCHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001496507762 1400783206 /nfs/dbraw/zinc/78/32/06/1400783206.db2.gz CGPCXAOBMVRYPW-ZWKOTPCHSA-N 1 3 337.552 2.935 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)cc1 ZINC001496603261 1400862826 /nfs/dbraw/zinc/86/28/26/1400862826.db2.gz QAJMQJNGMHKHPS-ICSRJNTNSA-N 1 3 345.531 2.610 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]([NH2+]CC1CCC2(CC2)CC1)C(C)C ZINC001496626004 1400879953 /nfs/dbraw/zinc/87/99/53/1400879953.db2.gz ADKNLNXATLKTEU-GOSISDBHSA-N 1 3 346.519 2.961 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1ccccc1F)C(C)C ZINC001496640727 1400892371 /nfs/dbraw/zinc/89/23/71/1400892371.db2.gz CGMXFRZWNULWFN-RBUKOAKNSA-N 1 3 349.494 2.931 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[N@H+](C)C[C@H]2CCCC(F)(F)C2)C1 ZINC001496780887 1400978868 /nfs/dbraw/zinc/97/88/68/1400978868.db2.gz IYALEHLTTMFLCG-HOTGVXAUSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[N@@H+](C)C[C@H]2CCCC(F)(F)C2)C1 ZINC001496780887 1400978872 /nfs/dbraw/zinc/97/88/72/1400978872.db2.gz IYALEHLTTMFLCG-HOTGVXAUSA-N 1 3 345.478 2.544 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H]3CN(C(=O)CN(C)C(C)C)CC[C@@H]32)cc1 ZINC001496866767 1401062882 /nfs/dbraw/zinc/06/28/82/1401062882.db2.gz IRDGPOQLDIORLG-PMACEKPBSA-N 1 3 343.515 2.758 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H]3CN(C(=O)CN(C)C(C)C)CC[C@@H]32)cc1 ZINC001496866767 1401062889 /nfs/dbraw/zinc/06/28/89/1401062889.db2.gz IRDGPOQLDIORLG-PMACEKPBSA-N 1 3 343.515 2.758 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@@H]2C[NH2+]CCC2CCCC2)CCC1 ZINC001496889440 1401079122 /nfs/dbraw/zinc/07/91/22/1401079122.db2.gz SGSMKJUGJDIUOI-MSOLQXFVSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]Cc1ccccc1F ZINC001496924362 1401104603 /nfs/dbraw/zinc/10/46/03/1401104603.db2.gz QIKGPAFEZMAVBF-SJLPKXTDSA-N 1 3 335.467 2.540 10 0 EFAEHO C[C@@H](CC[NH2+]C/C=C\c1ccccc1)NC(=O)C1(N(C)C)CCC1 ZINC001497205227 1401218597 /nfs/dbraw/zinc/21/85/97/1401218597.db2.gz INBDBVCERDMFDH-GJBHZFNWSA-N 1 3 329.488 2.669 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC[C@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001497271235 1401260902 /nfs/dbraw/zinc/26/09/02/1401260902.db2.gz LQITUKUFIZLTGZ-QAPCUYQASA-N 1 3 331.504 2.630 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H](C)NC(=O)[C@@H](C(C)C)N(C)C)cs1 ZINC001497311539 1401291277 /nfs/dbraw/zinc/29/12/77/1401291277.db2.gz JCGFTHYUSHHCJT-CZUORRHYSA-N 1 3 325.522 2.627 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(Cl)cc1C)C(=O)[C@@H]1CCCN1C ZINC001497361750 1401327051 /nfs/dbraw/zinc/32/70/51/1401327051.db2.gz IYNZTBQLPIILOT-KRWDZBQOSA-N 1 3 337.895 2.681 10 0 EFAEHO CCN(CCN[C@H](C)c1ccccc1F)C(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001497384407 1401340596 /nfs/dbraw/zinc/34/05/96/1401340596.db2.gz XDPHBGUNOULZHC-QAPCUYQASA-N 1 3 347.478 2.667 10 0 EFAEHO CCN(CCN[C@H](C)c1ccccc1F)C(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001497384405 1401340716 /nfs/dbraw/zinc/34/07/16/1401340716.db2.gz XDPHBGUNOULZHC-CRAIPNDOSA-N 1 3 347.478 2.667 10 0 EFAEHO CCN(CCNCc1csc(C)c1)C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001497403313 1401350114 /nfs/dbraw/zinc/35/01/14/1401350114.db2.gz ITXUNVWNEZDKJL-QGZVFWFLSA-N 1 3 337.533 2.869 10 0 EFAEHO CCN(CCNCc1csc(C)c1)C(=O)CC[C@H]1CCC[N@H+]1C ZINC001497403313 1401350118 /nfs/dbraw/zinc/35/01/18/1401350118.db2.gz ITXUNVWNEZDKJL-QGZVFWFLSA-N 1 3 337.533 2.869 10 0 EFAEHO CC[C@H](C(=O)N(CC)CC[NH2+]C[C@@H]1CCc2ccccc2C1)N(C)C ZINC001497487271 1401412253 /nfs/dbraw/zinc/41/22/53/1401412253.db2.gz WQXLMPSWCPQDMQ-YLJYHZDGSA-N 1 3 345.531 2.570 10 0 EFAEHO CC[C@@H](C(=O)N(CC)CC[NH2+]C[C@@H]1CCc2ccccc2C1)N(C)C ZINC001497487270 1401412322 /nfs/dbraw/zinc/41/23/22/1401412322.db2.gz WQXLMPSWCPQDMQ-XLIONFOSSA-N 1 3 345.531 2.570 10 0 EFAEHO CCN(CCNCc1cccnc1)C(=O)[C@H](C(C)C)[NH+]1CCCCC1 ZINC001497501282 1401424077 /nfs/dbraw/zinc/42/40/77/1401424077.db2.gz QUPIEOVLYUHSJY-IBGZPJMESA-N 1 3 346.519 2.530 10 0 EFAEHO O=C(NC/C=C\CNCc1ccsc1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001497612106 1401493221 /nfs/dbraw/zinc/49/32/21/1401493221.db2.gz NEZRTBOOBDIFRI-MQTUYHIVSA-N 1 3 333.501 2.527 10 0 EFAEHO O=C(NC/C=C\CNCc1ccsc1)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001497612106 1401493226 /nfs/dbraw/zinc/49/32/26/1401493226.db2.gz NEZRTBOOBDIFRI-MQTUYHIVSA-N 1 3 333.501 2.527 10 0 EFAEHO CC[C@H](F)CNC/C=C/CNC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001497663121 1401531858 /nfs/dbraw/zinc/53/18/58/1401531858.db2.gz PCIFTKLBQKJIJR-ZZGCUDHESA-N 1 3 339.499 2.794 10 0 EFAEHO CC[C@H](F)CNC/C=C/CNC(=O)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001497663121 1401531863 /nfs/dbraw/zinc/53/18/63/1401531863.db2.gz PCIFTKLBQKJIJR-ZZGCUDHESA-N 1 3 339.499 2.794 10 0 EFAEHO CCCN(C)CC(=O)NC/C=C/C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001497726691 1401587512 /nfs/dbraw/zinc/58/75/12/1401587512.db2.gz SZHQYXYODXDZBX-VZSQWMKGSA-N 1 3 347.478 2.807 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001497831528 1401682843 /nfs/dbraw/zinc/68/28/43/1401682843.db2.gz OQDODJWOHQRKAS-ZBFHGGJFSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001497831528 1401682848 /nfs/dbraw/zinc/68/28/48/1401682848.db2.gz OQDODJWOHQRKAS-ZBFHGGJFSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@H](C[NH2+]CC[C@@H]1CCCC1(F)F)NC(=O)CN(C)CC(C)(C)C ZINC001497910778 1401735104 /nfs/dbraw/zinc/73/51/04/1401735104.db2.gz PPMNGHNSMFSFAU-CABCVRRESA-N 1 3 347.494 2.884 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001498061334 1401836958 /nfs/dbraw/zinc/83/69/58/1401836958.db2.gz XCZPMIGPTZXBAO-HNNXBMFYSA-N 1 3 349.906 2.810 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc(CF)cc1 ZINC001498196882 1401903922 /nfs/dbraw/zinc/90/39/22/1401903922.db2.gz AFEZGIAYVFHKOI-YJBOKZPZSA-N 1 3 335.467 2.625 10 0 EFAEHO Cc1cc(CN(C)C[C@H](C)NC(=O)[C@H]2C[NH+]3CCC2CC3)c(C)s1 ZINC001498282150 1401973522 /nfs/dbraw/zinc/97/35/22/1401973522.db2.gz HGXQWKBSOKOZND-UGSOOPFHSA-N 1 3 349.544 2.643 10 0 EFAEHO Cc1cc(CN(C)C[C@H](C)NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)c(C)s1 ZINC001498287248 1401978075 /nfs/dbraw/zinc/97/80/75/1401978075.db2.gz FIKGPIZNWODATG-DXCKQFNASA-N 1 3 337.533 2.642 10 0 EFAEHO Cc1cc(CN(C)C[C@H](C)NC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)c(C)s1 ZINC001498287248 1401978081 /nfs/dbraw/zinc/97/80/81/1401978081.db2.gz FIKGPIZNWODATG-DXCKQFNASA-N 1 3 337.533 2.642 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(CF)cc1)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001498303845 1401992316 /nfs/dbraw/zinc/99/23/16/1401992316.db2.gz AFQJKFYGOJFTOX-APWZRJJASA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(CF)cc1)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001498303845 1401992324 /nfs/dbraw/zinc/99/23/24/1401992324.db2.gz AFQJKFYGOJFTOX-APWZRJJASA-N 1 3 349.494 2.967 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)cc1 ZINC001498305698 1401994163 /nfs/dbraw/zinc/99/41/63/1401994163.db2.gz MIYBZGUAVBAWIF-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)cc1 ZINC001498305698 1401994170 /nfs/dbraw/zinc/99/41/70/1401994170.db2.gz MIYBZGUAVBAWIF-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1cccc(CN(C)C[C@H](C)NC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001498365157 1402040992 /nfs/dbraw/zinc/04/09/92/1402040992.db2.gz BAUKILXFRPPCMH-LNLFQRSKSA-N 1 3 331.504 2.662 10 0 EFAEHO Cc1cccc(CN(C)C[C@H](C)NC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001498365157 1402040999 /nfs/dbraw/zinc/04/09/99/1402040999.db2.gz BAUKILXFRPPCMH-LNLFQRSKSA-N 1 3 331.504 2.662 10 0 EFAEHO C[C@H](C[N@H+](C)CC1CCCC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001498380076 1402053600 /nfs/dbraw/zinc/05/36/00/1402053600.db2.gz FIWFERFXNMZVCF-BEFAXECRSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H](C[N@@H+](C)CC1CCCC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001498380076 1402053604 /nfs/dbraw/zinc/05/36/04/1402053604.db2.gz FIWFERFXNMZVCF-BEFAXECRSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001498424459 1402088448 /nfs/dbraw/zinc/08/84/48/1402088448.db2.gz FUABUOIXPHKWAT-HOCLYGCPSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001498424459 1402088453 /nfs/dbraw/zinc/08/84/53/1402088453.db2.gz FUABUOIXPHKWAT-HOCLYGCPSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001498424460 1402090005 /nfs/dbraw/zinc/09/00/05/1402090005.db2.gz FUABUOIXPHKWAT-ZBFHGGJFSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001498424460 1402090011 /nfs/dbraw/zinc/09/00/11/1402090011.db2.gz FUABUOIXPHKWAT-ZBFHGGJFSA-N 1 3 337.895 2.618 10 0 EFAEHO C[N@H+](CCC(=O)N[C@H](CNCCF)C(C)(C)C)C1CCCCC1 ZINC001507985057 1407232920 /nfs/dbraw/zinc/23/29/20/1407232920.db2.gz UHNKRQXBLDDLEU-MRXNPFEDSA-N 1 3 329.504 2.731 10 0 EFAEHO C[N@@H+](CCC(=O)N[C@H](CNCCF)C(C)(C)C)C1CCCCC1 ZINC001507985057 1407232928 /nfs/dbraw/zinc/23/29/28/1407232928.db2.gz UHNKRQXBLDDLEU-MRXNPFEDSA-N 1 3 329.504 2.731 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)Cc1ccc(F)cc1C ZINC001498455744 1402118418 /nfs/dbraw/zinc/11/84/18/1402118418.db2.gz JTWFCYRTHDKLOQ-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)Cc1ccc(F)cc1C ZINC001498455744 1402118421 /nfs/dbraw/zinc/11/84/21/1402118421.db2.gz JTWFCYRTHDKLOQ-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CN(CCC[NH2+]C/C=C\c1ccc(Cl)cc1)C(=O)CN1CCCC1 ZINC001498654851 1402229024 /nfs/dbraw/zinc/22/90/24/1402229024.db2.gz JPVDITRTYPLJPB-XQRVVYSFSA-N 1 3 349.906 2.887 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]CCCN(C)C(=O)CN(C)C(C)C ZINC001498658903 1402232274 /nfs/dbraw/zinc/23/22/74/1402232274.db2.gz SZKBMKLWTAZAEJ-UHFFFAOYSA-N 1 3 339.911 2.927 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+]CC1CC(C)(C)C1)C1CC1)CC(C)(C)C ZINC001498822007 1402314249 /nfs/dbraw/zinc/31/42/49/1402314249.db2.gz JSTUYWYWWQQOOB-QGZVFWFLSA-N 1 3 337.552 2.885 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C[NH2+][C@H]1CCc2ccccc21)C1CC1 ZINC001498861713 1402341517 /nfs/dbraw/zinc/34/15/17/1402341517.db2.gz MUTJKGWHXYQAFJ-OALUTQOASA-N 1 3 329.488 2.500 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]CC1CC(F)(F)C1 ZINC001498906697 1402372939 /nfs/dbraw/zinc/37/29/39/1402372939.db2.gz JNJRLJFGGXONOQ-JKSUJKDBSA-N 1 3 345.478 2.589 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCC1(NCc2cccc(Cl)c2)CC1 ZINC001499254283 1402539440 /nfs/dbraw/zinc/53/94/40/1402539440.db2.gz MCZLFRMYMLBJAR-KRWDZBQOSA-N 1 3 349.906 2.953 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCC1(NCc2cccc(Cl)c2)CC1 ZINC001499254283 1402539443 /nfs/dbraw/zinc/53/94/43/1402539443.db2.gz MCZLFRMYMLBJAR-KRWDZBQOSA-N 1 3 349.906 2.953 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]CC[C@@H]2CCc3ccccc32)CC1 ZINC001499459468 1402624242 /nfs/dbraw/zinc/62/42/42/1402624242.db2.gz XVKHTGZHQWDTDC-SFHVURJKSA-N 1 3 343.515 2.685 10 0 EFAEHO Cc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)CC[NH+](C)C)cc1C ZINC001499511063 1402649850 /nfs/dbraw/zinc/64/98/50/1402649850.db2.gz KVZJAVYZOQLAOV-UXHICEINSA-N 1 3 343.515 2.820 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)C1CC[NH+](CC2CCC2)CC1 ZINC001508063218 1407273461 /nfs/dbraw/zinc/27/34/61/1407273461.db2.gz CCKCDWBLPIYPJN-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC1=CCCCC1 ZINC001499554907 1402680414 /nfs/dbraw/zinc/68/04/14/1402680414.db2.gz KNSLVZCMZUACTQ-KDURUIRLSA-N 1 3 333.520 2.894 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC[C@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001499573379 1402692664 /nfs/dbraw/zinc/69/26/64/1402692664.db2.gz CRNWGWULNRPOCW-IBGZPJMESA-N 1 3 332.492 2.703 10 0 EFAEHO CC(C)CCC[N@H+]1CCC[C@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001499573379 1402692670 /nfs/dbraw/zinc/69/26/70/1402692670.db2.gz CRNWGWULNRPOCW-IBGZPJMESA-N 1 3 332.492 2.703 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC[C@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001499577366 1402696176 /nfs/dbraw/zinc/69/61/76/1402696176.db2.gz UGCUOZPCBPOFJX-YJJPMGAVSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC[C@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001499577366 1402696179 /nfs/dbraw/zinc/69/61/79/1402696179.db2.gz UGCUOZPCBPOFJX-YJJPMGAVSA-N 1 3 335.536 2.997 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@@H]1C[NH2+]CC/C=C\c1ccccc1 ZINC001499915591 1402851923 /nfs/dbraw/zinc/85/19/23/1402851923.db2.gz FNJRZTTYLZBKDA-OWFXXDGYSA-N 1 3 341.499 2.765 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@@H]1C[NH2+]CC/C=C/c1ccccc1 ZINC001499915593 1402852028 /nfs/dbraw/zinc/85/20/28/1402852028.db2.gz FNJRZTTYLZBKDA-RWQKXMEQSA-N 1 3 341.499 2.765 10 0 EFAEHO Cc1cccc(CCC[NH2+]C[C@@H]2CCCN2C(=O)CN2CCCC2)c1 ZINC001499950445 1402866562 /nfs/dbraw/zinc/86/65/62/1402866562.db2.gz HACVPQVAICSFSS-FQEVSTJZSA-N 1 3 343.515 2.604 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C1CC[NH+](CC2CCCC2)CC1 ZINC001508082883 1407288005 /nfs/dbraw/zinc/28/80/05/1407288005.db2.gz MJTQWNOUDFOFTO-AWEZNQCLSA-N 1 3 332.492 2.668 10 0 EFAEHO Cc1ccc(CC[NH+]2CCC(C)(NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001500012214 1402899963 /nfs/dbraw/zinc/89/99/63/1402899963.db2.gz AJLSOMSXHWNIJT-UHFFFAOYSA-N 1 3 345.531 2.848 10 0 EFAEHO CN(C)C1(C(=O)N(C)C2CC([NH2+]CC3CC4(CCC4)C3)C2)CCC1 ZINC001508115191 1407303003 /nfs/dbraw/zinc/30/30/03/1407303003.db2.gz QNBWGHXBSFMOJN-UHFFFAOYSA-N 1 3 333.520 2.630 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@](C)(C[NH2+]Cc3ccsc3)C2)CCC1 ZINC001500354132 1403070939 /nfs/dbraw/zinc/07/09/39/1403070939.db2.gz LIAZJSWOJZLWIX-QGZVFWFLSA-N 1 3 335.517 2.561 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001500378951 1403085562 /nfs/dbraw/zinc/08/55/62/1403085562.db2.gz ZTTAAIISYOXKGI-VQIMIIECSA-N 1 3 325.541 2.839 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@](C)(C[NH2+]CCc2ccccc2)C1)N(C)C ZINC001500397238 1403095386 /nfs/dbraw/zinc/09/53/86/1403095386.db2.gz ROFKXGIYJFZWLM-TZIWHRDSSA-N 1 3 345.531 2.644 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@@](C)(C[NH2+]C/C=C\Cl)C2)c1 ZINC001500404498 1403101167 /nfs/dbraw/zinc/10/11/67/1403101167.db2.gz DXDJCJFWFDCEBA-STISFXCESA-N 1 3 349.906 2.943 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2ccc(C)c(F)c2)C1 ZINC001501150558 1403460390 /nfs/dbraw/zinc/46/03/90/1403460390.db2.gz ULGZPBKPPCGONN-AEFFLSMTSA-N 1 3 349.494 2.660 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2ccc(C)c(C)c2)C1 ZINC001501150419 1403460448 /nfs/dbraw/zinc/46/04/48/1403460448.db2.gz RBLBRBVBUNBNFA-QUCCMNQESA-N 1 3 345.531 2.829 10 0 EFAEHO C[C@@H](F)CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1(N(C)C)CCC1)C2 ZINC001501165954 1403469754 /nfs/dbraw/zinc/46/97/54/1403469754.db2.gz BHVOUMKNRIERLX-WCXIOVBPSA-N 1 3 339.499 2.578 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1(N(C)C)CCC1)C2 ZINC001501165954 1403469756 /nfs/dbraw/zinc/46/97/56/1403469756.db2.gz BHVOUMKNRIERLX-WCXIOVBPSA-N 1 3 339.499 2.578 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H](CC[NH2+]Cc3ccccc3F)C2)CCC1 ZINC001501574478 1403632849 /nfs/dbraw/zinc/63/28/49/1403632849.db2.gz NMTBSIUDTYHUPU-INIZCTEOSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2ccccc2C)C1)N(C)C ZINC001501637368 1403659557 /nfs/dbraw/zinc/65/95/57/1403659557.db2.gz HPTNIVKWYPAKDK-MJGOQNOKSA-N 1 3 331.504 2.663 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)CC1 ZINC001501745427 1403761440 /nfs/dbraw/zinc/76/14/40/1403761440.db2.gz YFAPNSPPHPPZPZ-SHCNBLLESA-N 1 3 333.520 2.609 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)CC1 ZINC001501745429 1403761644 /nfs/dbraw/zinc/76/16/44/1403761644.db2.gz YFAPNSPPHPPZPZ-XDXAGZTOSA-N 1 3 333.520 2.609 10 0 EFAEHO CC[C@H](F)C[NH+]1CCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)CC1 ZINC001501745443 1403761702 /nfs/dbraw/zinc/76/17/02/1403761702.db2.gz YYPBYGJZUZMNLB-INIZCTEOSA-N 1 3 341.515 2.637 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)CC1 ZINC001501745428 1403762079 /nfs/dbraw/zinc/76/20/79/1403762079.db2.gz YFAPNSPPHPPZPZ-WRFKIARRSA-N 1 3 333.520 2.609 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CC[NH+](CCc1cccs1)CC2 ZINC001501749056 1403763935 /nfs/dbraw/zinc/76/39/35/1403763935.db2.gz LUJMTUAZLKVIEE-UHFFFAOYSA-N 1 3 349.544 2.555 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@H+](CC2CCCC2)CC1)CC(C)(C)C ZINC001508220051 1407356996 /nfs/dbraw/zinc/35/69/96/1407356996.db2.gz QPHPGAPVWFUXEJ-UHFFFAOYSA-N 1 3 335.536 2.903 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@@H+](CC2CCCC2)CC1)CC(C)(C)C ZINC001508220051 1407356998 /nfs/dbraw/zinc/35/69/98/1407356998.db2.gz QPHPGAPVWFUXEJ-UHFFFAOYSA-N 1 3 335.536 2.903 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC1=CC[N@H+](CCCCCF)CC1 ZINC001508228020 1407364903 /nfs/dbraw/zinc/36/49/03/1407364903.db2.gz CEHIVSJSCHERPE-GOSISDBHSA-N 1 3 339.499 2.749 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC1=CC[N@@H+](CCCCCF)CC1 ZINC001508228020 1407364910 /nfs/dbraw/zinc/36/49/10/1407364910.db2.gz CEHIVSJSCHERPE-GOSISDBHSA-N 1 3 339.499 2.749 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@H+](CC2CC3(CCC3)C2)CC1 ZINC001508228994 1407365645 /nfs/dbraw/zinc/36/56/45/1407365645.db2.gz KKTPGRSWWYHKRK-UHFFFAOYSA-N 1 3 333.520 2.655 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@@H+](CC2CC3(CCC3)C2)CC1 ZINC001508228994 1407365651 /nfs/dbraw/zinc/36/56/51/1407365651.db2.gz KKTPGRSWWYHKRK-UHFFFAOYSA-N 1 3 333.520 2.655 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]CC2CC(F)(F)C2)CCC1)N1CCCC1 ZINC001501988950 1403929727 /nfs/dbraw/zinc/92/97/27/1403929727.db2.gz RTPWJOJOLGDBIH-UHFFFAOYSA-N 1 3 343.462 2.535 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)CC1 ZINC001502145548 1404045518 /nfs/dbraw/zinc/04/55/18/1404045518.db2.gz TZABRJMNIFITGY-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[N@@H+](C[C@H]2CCC(F)(F)C2)CC1 ZINC001502145548 1404045521 /nfs/dbraw/zinc/04/55/21/1404045521.db2.gz TZABRJMNIFITGY-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO CCC1([NH2+]CC2CCCC2)CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001502505847 1404205197 /nfs/dbraw/zinc/20/51/97/1404205197.db2.gz ATJOVRXWZZEPRZ-QGZVFWFLSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]Cc2ccc(CF)cc2)CC1 ZINC001502805340 1404354831 /nfs/dbraw/zinc/35/48/31/1404354831.db2.gz DJDKMPAPAQTOOF-UHFFFAOYSA-N 1 3 349.494 2.969 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(C)CCN(C(=O)[C@@H]2CCCCN2CC)CC1 ZINC001502811203 1404357043 /nfs/dbraw/zinc/35/70/43/1404357043.db2.gz OYAUMQXHMVGMLV-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@H+](CC2CC3(CCC3)C2)[C@H](C)C1 ZINC001503013258 1404459340 /nfs/dbraw/zinc/45/93/40/1404459340.db2.gz DFKPMKSGYKKPFU-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)[C@H](C)C1 ZINC001503013258 1404459344 /nfs/dbraw/zinc/45/93/44/1404459344.db2.gz DFKPMKSGYKKPFU-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@H]1C[NH2+]C/C=C\c1ccccc1 ZINC001505403571 1404560549 /nfs/dbraw/zinc/56/05/49/1404560549.db2.gz SFQLTQUMLPRYQR-VIFSCDBUSA-N 1 3 341.499 2.765 10 0 EFAEHO CC[C@H](C)C[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H](C(C)C)N(C)C ZINC001505415702 1404575709 /nfs/dbraw/zinc/57/57/09/1404575709.db2.gz RJBCLQJYVSDZTH-YGWPLHOASA-N 1 3 345.531 2.991 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N2CCC[C@H]2CN(C)CC=C(C)C)C1 ZINC001505443359 1404629881 /nfs/dbraw/zinc/62/98/81/1404629881.db2.gz IWXZQJYOPNJYPJ-MOPGFXCFSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N2CCC[C@H]2CN(C)CC=C(C)C)C1 ZINC001505443359 1404629897 /nfs/dbraw/zinc/62/98/97/1404629897.db2.gz IWXZQJYOPNJYPJ-MOPGFXCFSA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H]2CCCN2C(=O)CC[NH+](C)C)cc1F ZINC001505445675 1404637864 /nfs/dbraw/zinc/63/78/64/1404637864.db2.gz ZMSSYCNQYZVCKV-KRWDZBQOSA-N 1 3 335.467 2.509 10 0 EFAEHO CC[C@H](C)C[N@H+](C)C[C@@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001505447002 1404640618 /nfs/dbraw/zinc/64/06/18/1404640618.db2.gz XFPVKDJIDGPHOC-IRXDYDNUSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)C[C@@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001505447002 1404640631 /nfs/dbraw/zinc/64/06/31/1404640631.db2.gz XFPVKDJIDGPHOC-IRXDYDNUSA-N 1 3 325.541 2.933 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](C)[C@@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001505622768 1404865932 /nfs/dbraw/zinc/86/59/32/1404865932.db2.gz ZAJRRCQBPDRWDC-DLBZAZTESA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)c(C)s1 ZINC001505624822 1404866972 /nfs/dbraw/zinc/86/69/72/1404866972.db2.gz BHGHBIHEWMTYNT-UONOGXRCSA-N 1 3 337.533 2.832 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001505625523 1404868250 /nfs/dbraw/zinc/86/82/50/1404868250.db2.gz KULCIDKWVLFWGD-SJORKVTESA-N 1 3 331.504 2.771 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC001505736045 1405002316 /nfs/dbraw/zinc/00/23/16/1405002316.db2.gz QDODXWNMXTWVKZ-HOTGVXAUSA-N 1 3 342.487 2.559 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001505735861 1405002335 /nfs/dbraw/zinc/00/23/35/1405002335.db2.gz PFWVWTHTDMUWKF-KBPBESRZSA-N 1 3 333.467 2.637 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC001505736047 1405002615 /nfs/dbraw/zinc/00/26/15/1405002615.db2.gz QDODXWNMXTWVKZ-HZPDHXFCSA-N 1 3 342.487 2.559 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@@H](C)[C@@H](C)NC(=O)Cc1nc[nH]c1C ZINC001505738516 1405006923 /nfs/dbraw/zinc/00/69/23/1405006923.db2.gz LIPDFHZYPRNYBT-LSDHHAIUSA-N 1 3 342.487 2.549 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N(C)CC(C)(C)C[NH2+]Cc1ccccn1 ZINC001505850535 1405141267 /nfs/dbraw/zinc/14/12/67/1405141267.db2.gz ZPRDXJHHDGCGIO-CALCHBBNSA-N 1 3 346.519 2.529 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)[C@@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001505918529 1405222043 /nfs/dbraw/zinc/22/20/43/1405222043.db2.gz MVRUTODEMUFAMG-ICSRJNTNSA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1ccc(CC[N@H+](C)[C@@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001505918529 1405222049 /nfs/dbraw/zinc/22/20/49/1405222049.db2.gz MVRUTODEMUFAMG-ICSRJNTNSA-N 1 3 345.531 2.847 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)CN1CCCC1)[NH2+]CCC(C)(C)C ZINC001506492169 1405845811 /nfs/dbraw/zinc/84/58/11/1405845811.db2.gz ZTSTYFGHRMIUAP-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]CC2=CCCCC2)C1 ZINC001565877989 1415131266 /nfs/dbraw/zinc/13/12/66/1415131266.db2.gz JCUQDJUDTGUKKF-CAMMJAKZSA-N 1 3 333.520 2.844 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N(C)C[C@@H]2CCN2CCCCCF)CC1 ZINC001565829254 1415423835 /nfs/dbraw/zinc/42/38/35/1415423835.db2.gz BGIHJZNTHJCHJG-SFHVURJKSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@@H]([NH2+]CCCC2CCC2)C1)N1CCCC1 ZINC001565848385 1415432453 /nfs/dbraw/zinc/43/24/53/1415432453.db2.gz PJKHURSYCSJVKV-HDICACEKSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@@H]([NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001565850576 1415433003 /nfs/dbraw/zinc/43/30/03/1415433003.db2.gz PHMMQWNJZSKAOF-IXDOHACOSA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@@H]1CC[NH2+]C/C=C\Cl ZINC001565942911 1415461032 /nfs/dbraw/zinc/46/10/32/1415461032.db2.gz IGAZPJCRPCMGCW-GSNCDVCBSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N1CCCCC[C@H]([NH2+]CCCF)C1 ZINC001566068952 1415501775 /nfs/dbraw/zinc/50/17/75/1415501775.db2.gz NVKXTBMNTZDGTD-IRXDYDNUSA-N 1 3 327.488 2.580 10 0 EFAEHO CN(CC(=O)NCCC[N@H+](C)[C@@H]1CCc2ccc(F)cc21)C1CCC1 ZINC001566462591 1415561589 /nfs/dbraw/zinc/56/15/89/1415561589.db2.gz ZEQMLYDUDLRQBK-LJQANCHMSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CC(=O)NCCC[N@@H+](C)[C@@H]1CCc2ccc(F)cc21)C1CCC1 ZINC001566462591 1415561592 /nfs/dbraw/zinc/56/15/92/1415561592.db2.gz ZEQMLYDUDLRQBK-LJQANCHMSA-N 1 3 347.478 2.735 10 0 EFAEHO CC[N@H+](CCCNC(=O)C1(N(C)C)CCC1)C[C@@H]1CCC(F)(F)C1 ZINC001566552610 1415636355 /nfs/dbraw/zinc/63/63/55/1415636355.db2.gz BOMQMDRFPNBUIF-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[N@@H+](CCCNC(=O)C1(N(C)C)CCC1)C[C@@H]1CCC(F)(F)C1 ZINC001566552610 1415636358 /nfs/dbraw/zinc/63/63/58/1415636358.db2.gz BOMQMDRFPNBUIF-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC/C=C\CC[NH2+][C@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001566773857 1415770441 /nfs/dbraw/zinc/77/04/41/1415770441.db2.gz VVDGOEPVXKZHKM-FQEKARNZSA-N 1 3 339.499 2.746 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001566811162 1415782673 /nfs/dbraw/zinc/78/26/73/1415782673.db2.gz OMASIOWXEIGYPR-UFYCRDLUSA-N 1 3 345.531 2.751 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N[C@H]1C[C@@H](NCc2ccccc2F)C1 ZINC001566863753 1415804280 /nfs/dbraw/zinc/80/42/80/1415804280.db2.gz OBEPXUAACDZDNN-HDICACEKSA-N 1 3 347.478 2.829 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H](C[NH2+]CCC2CCCC2)C1)N(C)C ZINC001566909990 1415838472 /nfs/dbraw/zinc/83/84/72/1415838472.db2.gz JPMOFOKYYSYTDI-RBUKOAKNSA-N 1 3 337.552 2.981 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@H]1CCCCN1CCCCC(F)(F)F ZINC001566925469 1415851015 /nfs/dbraw/zinc/85/10/15/1415851015.db2.gz ITNLQRGTMUHJRD-CQSZACIVSA-N 1 3 337.430 2.641 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](C[NH2+]CCCc2ccccc2C)C1)N(C)C ZINC001567139810 1415949099 /nfs/dbraw/zinc/94/90/99/1415949099.db2.gz FCNDWTOBFFPFMA-QUCCMNQESA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]CC/C=C/c2ccccc2)C1 ZINC001567154176 1415955482 /nfs/dbraw/zinc/95/54/82/1415955482.db2.gz BRGZHTGZMKATJG-WUTDNEBXSA-N 1 3 343.515 2.868 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@@H](C[NH2+]CCc2cccs2)C1 ZINC001567154537 1415956194 /nfs/dbraw/zinc/95/61/94/1415956194.db2.gz GHGYIGYTXSGZIX-WMZOPIPTSA-N 1 3 349.544 2.603 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]CCN(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001567561119 1416188230 /nfs/dbraw/zinc/18/82/30/1416188230.db2.gz AFEOUFYWBWRIEY-GOSISDBHSA-N 1 3 345.531 2.775 10 0 EFAEHO CCc1ccc(CC[NH2+]CCN(C)C(=O)[C@H]2CCCCN2CC)cc1 ZINC001567611818 1416210045 /nfs/dbraw/zinc/21/00/45/1416210045.db2.gz WEBZWGZADIINON-HXUWFJFHSA-N 1 3 345.531 2.714 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N(C)CC[NH2+]CC2CC3(CCC3)C2)c1 ZINC001567611505 1416210220 /nfs/dbraw/zinc/21/02/20/1416210220.db2.gz JQRSABPNWFEQNG-UHFFFAOYSA-N 1 3 343.515 2.990 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC1CC1 ZINC001567648889 1416228056 /nfs/dbraw/zinc/22/80/56/1416228056.db2.gz LBVPRRAQZLQGAH-LJQANCHMSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC1CC1 ZINC001567648889 1416228059 /nfs/dbraw/zinc/22/80/59/1416228059.db2.gz LBVPRRAQZLQGAH-LJQANCHMSA-N 1 3 341.515 2.826 10 0 EFAEHO CCC/C=C/CC[N@H+](C)CC1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001567744519 1416268841 /nfs/dbraw/zinc/26/88/41/1416268841.db2.gz LPZPLOOFLKLGGE-GHOSXJJBSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[N@@H+](C)CC1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001567744519 1416268842 /nfs/dbraw/zinc/26/88/42/1416268842.db2.gz LPZPLOOFLKLGGE-GHOSXJJBSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@](F)(C(=O)N[C@H]2CCN(CCCCCF)C2)C1 ZINC001567880180 1416308261 /nfs/dbraw/zinc/30/82/61/1416308261.db2.gz WNSHFBVXXSMRMD-MAUKXSAKSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)N[C@H]2CCN(CCCCCF)C2)C1 ZINC001567880180 1416308264 /nfs/dbraw/zinc/30/82/64/1416308264.db2.gz WNSHFBVXXSMRMD-MAUKXSAKSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N[C@H]2CC[N@H+](CCCCCF)C2)C1 ZINC001567880180 1416308267 /nfs/dbraw/zinc/30/82/67/1416308267.db2.gz WNSHFBVXXSMRMD-MAUKXSAKSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N[C@H]2CC[N@@H+](CCCCCF)C2)C1 ZINC001567880180 1416308269 /nfs/dbraw/zinc/30/82/69/1416308269.db2.gz WNSHFBVXXSMRMD-MAUKXSAKSA-N 1 3 345.478 2.529 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H](CC[NH2+]Cc2ccsc2)C1)C1CCC1 ZINC001568059850 1416384484 /nfs/dbraw/zinc/38/44/84/1416384484.db2.gz BWZSPZMFTWEPHA-INIZCTEOSA-N 1 3 349.544 2.951 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H](CC[NH2+]CCC(C)(C)C)C2)C1 ZINC001568068236 1416391916 /nfs/dbraw/zinc/39/19/16/1416391916.db2.gz SGETYMBBTFXIQW-ROUUACIJSA-N 1 3 337.552 2.983 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H](CC[NH2+]CC2CCC2)C1 ZINC001568076309 1416398469 /nfs/dbraw/zinc/39/84/69/1416398469.db2.gz NFLRCOLWNHIPKZ-RBUKOAKNSA-N 1 3 335.536 2.879 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@@H]1CNCc1ccccc1F ZINC001568150437 1416426175 /nfs/dbraw/zinc/42/61/75/1416426175.db2.gz NIXDIEJXVKBXFN-QGZVFWFLSA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H]1CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001568152988 1416426389 /nfs/dbraw/zinc/42/63/89/1416426389.db2.gz CJBURFOLNDZNOW-LJQANCHMSA-N 1 3 329.488 2.909 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]C/C=C/c1ccccc1 ZINC001568176749 1416433770 /nfs/dbraw/zinc/43/37/70/1416433770.db2.gz XQIVEJLBXAAUDK-VDZSZVPASA-N 1 3 329.488 2.526 10 0 EFAEHO CC(C)CCC[NH2+]C[C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001568193617 1416437486 /nfs/dbraw/zinc/43/74/86/1416437486.db2.gz HJSBFLLCZBTPGI-LPHOPBHVSA-N 1 3 343.531 2.977 10 0 EFAEHO CN(CC(=O)N1CCC2(C[NH+](CCCCCF)C2)CC1)C1CCC1 ZINC001568250677 1416455239 /nfs/dbraw/zinc/45/52/39/1416455239.db2.gz PJHRBOGJLXJDBM-UHFFFAOYSA-N 1 3 339.499 2.535 10 0 EFAEHO C[C@H](C[NH2+]CCCCc1ccccc1)N(C)C(=O)[C@@H]1CCCN1C ZINC001568262425 1416459649 /nfs/dbraw/zinc/45/96/49/1416459649.db2.gz JFXAEBYLCUOMRD-MJGOQNOKSA-N 1 3 331.504 2.540 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H](C)C[NH2+]C/C=C/c1ccccc1)N(C)C ZINC001568280080 1416464205 /nfs/dbraw/zinc/46/42/05/1416464205.db2.gz WTJXDXVRTWGUEC-VHCSCNJLSA-N 1 3 331.504 2.723 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@@H]1CCCCN1C(=O)[C@@H]1CCCN1C ZINC001568379783 1416502085 /nfs/dbraw/zinc/50/20/85/1416502085.db2.gz WXVMBODAIQZSGE-PMACEKPBSA-N 1 3 343.515 2.950 10 0 EFAEHO C[C@@H]([NH2+]CCCF)[C@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001568416975 1416523787 /nfs/dbraw/zinc/52/37/87/1416523787.db2.gz QPAZWOHKFWPFDS-APWZRJJASA-N 1 3 349.494 2.938 10 0 EFAEHO C[C@H]([NH2+]CCCF)[C@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001568416976 1416523962 /nfs/dbraw/zinc/52/39/62/1416523962.db2.gz QPAZWOHKFWPFDS-LPHOPBHVSA-N 1 3 349.494 2.938 10 0 EFAEHO CC(C)CCC[NH2+][C@H](C)[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001568417263 1416524343 /nfs/dbraw/zinc/52/43/43/1416524343.db2.gz UUNVLYDXNVTROC-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN(C)C1CCC1)[C@H]1CCc2ccccc21 ZINC001689936276 1417100290 /nfs/dbraw/zinc/10/02/90/1417100290.db2.gz KLLUGYYEMLTGLZ-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN(C)C1CCC1)[C@H]1CCc2ccccc21 ZINC001689936276 1417100292 /nfs/dbraw/zinc/10/02/92/1417100292.db2.gz KLLUGYYEMLTGLZ-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@H]2C[C@@H]([NH2+]CC/C=C\c3ccccc3)C2)C1 ZINC001690356789 1417195259 /nfs/dbraw/zinc/19/52/59/1417195259.db2.gz VIXVIKWBCFLXHW-OWDDEDPBSA-N 1 3 341.499 2.669 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CCC[C@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001690388209 1417205996 /nfs/dbraw/zinc/20/59/96/1417205996.db2.gz FEGRXPQQIHKRFT-CQQBRXBZSA-N 1 3 335.536 2.903 10 0 EFAEHO CCC/C=C\CC[N@H+]1CCC[C@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001690388209 1417205998 /nfs/dbraw/zinc/20/59/98/1417205998.db2.gz FEGRXPQQIHKRFT-CQQBRXBZSA-N 1 3 335.536 2.903 10 0 EFAEHO O=C([C@@H]1CCCC[N@@H+]1C1CCCC1)N1CCCC[C@@H]1CNCCF ZINC001690477703 1417216201 /nfs/dbraw/zinc/21/62/01/1417216201.db2.gz SALJEVXGKUFWPT-MSOLQXFVSA-N 1 3 339.499 2.724 10 0 EFAEHO O=C([C@@H]1CCCC[N@H+]1C1CCCC1)N1CCCC[C@@H]1CNCCF ZINC001690477703 1417216204 /nfs/dbraw/zinc/21/62/04/1417216204.db2.gz SALJEVXGKUFWPT-MSOLQXFVSA-N 1 3 339.499 2.724 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H]1CCC[N@H+](CCCCCF)C1 ZINC001690498361 1417218868 /nfs/dbraw/zinc/21/88/68/1417218868.db2.gz HDGYSHAFZUFEEJ-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H]1CCC[N@@H+](CCCCCF)C1 ZINC001690498361 1417218873 /nfs/dbraw/zinc/21/88/73/1417218873.db2.gz HDGYSHAFZUFEEJ-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCCC[NH2+]C[C@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001690739523 1417234310 /nfs/dbraw/zinc/23/43/10/1417234310.db2.gz SFUOIUWFPSAJBK-VQIMIIECSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@@H](C[NH2+]CCCC2CCC2)C1 ZINC001690757327 1417239264 /nfs/dbraw/zinc/23/92/64/1417239264.db2.gz GOAYBMZCEORUTN-RBUKOAKNSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@H](C[NH2+]CCC2CCCC2)C1 ZINC001690757566 1417239550 /nfs/dbraw/zinc/23/95/50/1417239550.db2.gz LOXAGPCMPQHRSH-RTBURBONSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H](C(=O)NCC1CN(CC2=CCCCC2)C1)[NH+]1CCCCCC1 ZINC001692337529 1417280026 /nfs/dbraw/zinc/28/00/26/1417280026.db2.gz BYWYDQCXWFLFME-QGZVFWFLSA-N 1 3 333.520 2.799 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@@H]1CCN(Cc2ccc3c(c2)CCC3)C1 ZINC001698553673 1417303057 /nfs/dbraw/zinc/30/30/57/1417303057.db2.gz SSNDATWJSNZHNM-HXUWFJFHSA-N 1 3 343.515 2.598 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@H](N(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001698568549 1417305961 /nfs/dbraw/zinc/30/59/61/1417305961.db2.gz DSXFUCRJMZJZCO-APWZRJJASA-N 1 3 341.515 2.922 10 0 EFAEHO CCCCC[N@H+]1CC[C@@H](N(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001698568549 1417305965 /nfs/dbraw/zinc/30/59/65/1417305965.db2.gz DSXFUCRJMZJZCO-APWZRJJASA-N 1 3 341.515 2.922 10 0 EFAEHO C[C@@H](C[NH2+]CCCc1cccc(F)c1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001698846231 1417339930 /nfs/dbraw/zinc/33/99/30/1417339930.db2.gz YMWHVCWBJQRAHT-IRXDYDNUSA-N 1 3 349.494 2.537 10 0 EFAEHO CN(CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2CCCCCF)C1)C1CCC1 ZINC001699007882 1417366509 /nfs/dbraw/zinc/36/65/09/1417366509.db2.gz GPFSCDQBZCAKBP-WMZOPIPTSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2CCCCCF)C1)C1CCC1 ZINC001699007882 1417366510 /nfs/dbraw/zinc/36/65/10/1417366510.db2.gz GPFSCDQBZCAKBP-WMZOPIPTSA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@H](CC[NH2+]C/C=C/c1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001699133616 1417399075 /nfs/dbraw/zinc/39/90/75/1417399075.db2.gz FKZKJPXITKCBRR-OKMWKSJFSA-N 1 3 329.488 2.526 10 0 EFAEHO CCN(CC[NH2+]C/C=C\c1ccc(Cl)cc1)C(=O)[C@@H]1CCCN1C ZINC001699172425 1417409920 /nfs/dbraw/zinc/40/99/20/1417409920.db2.gz DJEAJJIWJPTSQE-SUZKBHRPSA-N 1 3 349.906 2.886 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(Cl)c(F)c1)C(=O)[C@@H]1CCCN1C ZINC001699172534 1417409932 /nfs/dbraw/zinc/40/99/32/1417409932.db2.gz HNBUBTXNSFQGNU-INIZCTEOSA-N 1 3 341.858 2.511 10 0 EFAEHO CCN(CCNCc1c(C)cccc1Cl)C(=O)[C@H]1CC[N@H+](C)C1 ZINC001699216660 1417413914 /nfs/dbraw/zinc/41/39/14/1417413914.db2.gz MHQDZAXGXDKVAT-HNNXBMFYSA-N 1 3 337.895 2.538 10 0 EFAEHO CCN(CCNCc1c(C)cccc1Cl)C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001699216660 1417413918 /nfs/dbraw/zinc/41/39/18/1417413918.db2.gz MHQDZAXGXDKVAT-HNNXBMFYSA-N 1 3 337.895 2.538 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]CCCN(C)C(=O)[C@@H]1CCCN1C ZINC001699500623 1417426694 /nfs/dbraw/zinc/42/66/94/1417426694.db2.gz ZDZNBOXQOQYHIF-KRWDZBQOSA-N 1 3 337.895 2.681 10 0 EFAEHO CN(CCC[NH2+][C@H]1CCCc2ccccc21)C(=O)[C@@H]1CCCN1C ZINC001699500339 1417426709 /nfs/dbraw/zinc/42/67/09/1417426709.db2.gz TWSZTAWUKCYJEA-OALUTQOASA-N 1 3 329.488 2.596 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)CN1CC[C@H](C)C1)c1cccc(F)c1 ZINC001699533063 1417428432 /nfs/dbraw/zinc/42/84/32/1417428432.db2.gz ARUOBCMVTXWGIT-HOTGVXAUSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CCCF)CCN1C(=O)c1cccc(CN(C)C)c1 ZINC001699741539 1417464245 /nfs/dbraw/zinc/46/42/45/1417464245.db2.gz BULLGPNAGLNYEK-MAUKXSAKSA-N 1 3 335.467 2.691 10 0 EFAEHO CN(CC(=O)NC1(C)CC[NH+](CC2=CCCCC2)CC1)C1CCC1 ZINC001699770271 1417466735 /nfs/dbraw/zinc/46/67/35/1417466735.db2.gz GXYUECDSPAYPIK-UHFFFAOYSA-N 1 3 333.520 2.942 10 0 EFAEHO C[C@H]([NH2+]CCCCC(F)(F)F)[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001699950606 1417520266 /nfs/dbraw/zinc/52/02/66/1417520266.db2.gz DYLYDGYDAQJCOK-LSDHHAIUSA-N 1 3 349.441 2.641 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001699969450 1417530942 /nfs/dbraw/zinc/53/09/42/1417530942.db2.gz LADGFWYONJNVRV-ICSRJNTNSA-N 1 3 345.531 2.562 10 0 EFAEHO Cc1ccc(CC[NH2+]CC[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001700094956 1417566149 /nfs/dbraw/zinc/56/61/49/1417566149.db2.gz YXXASQSLIFTVII-HXUWFJFHSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccccc2)C[C@H]1C ZINC001700853990 1417665854 /nfs/dbraw/zinc/66/58/54/1417665854.db2.gz OZYQBGPANJGEMX-IEBWSBKVSA-N 1 3 331.504 2.538 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001712986056 1418315538 /nfs/dbraw/zinc/31/55/38/1418315538.db2.gz QSTYOXGCJPHPDI-UHFFFAOYSA-N 1 3 332.492 2.669 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](C)CC1CCC2(CC2)CC1 ZINC001712986056 1418315542 /nfs/dbraw/zinc/31/55/42/1418315542.db2.gz QSTYOXGCJPHPDI-UHFFFAOYSA-N 1 3 332.492 2.669 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1C[C@@H]([NH2+]CCCCC(F)(F)F)C1 ZINC001713192284 1418369250 /nfs/dbraw/zinc/36/92/50/1418369250.db2.gz KQGYCQQETZBUPT-QLFBSQMISA-N 1 3 349.441 2.829 10 0 EFAEHO CC(C)CCC[NH2+]C[C@@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001713239634 1418409115 /nfs/dbraw/zinc/40/91/15/1418409115.db2.gz WWDDFGALQXQYFI-ZWKOTPCHSA-N 1 3 325.541 2.837 10 0 EFAEHO CCC/C=C\CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)CN1[C@H](C)CC[C@@H]1C ZINC001713283690 1418453614 /nfs/dbraw/zinc/45/36/14/1418453614.db2.gz LGJMCXKYTPRHTK-NDOSOLMMSA-N 1 3 333.520 2.652 10 0 EFAEHO CCC/C=C\CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)CN1[C@H](C)CC[C@@H]1C ZINC001713283690 1418453617 /nfs/dbraw/zinc/45/36/17/1418453617.db2.gz LGJMCXKYTPRHTK-NDOSOLMMSA-N 1 3 333.520 2.652 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]CC[C@H]2CCCC2(F)F)C1 ZINC001713366246 1418493969 /nfs/dbraw/zinc/49/39/69/1418493969.db2.gz ZJXHHUMWTMGPPM-JKSUJKDBSA-N 1 3 345.478 2.590 10 0 EFAEHO Cc1ccc2ccccc2c1C[NH2+]CCN(C)C(=O)[C@H]1CCCN1C ZINC001713577557 1418559748 /nfs/dbraw/zinc/55/97/48/1418559748.db2.gz AIHPEJVJXUNEBN-HXUWFJFHSA-N 1 3 339.483 2.790 10 0 EFAEHO CN(CC[NH2+]Cc1ccc(C2CCCC2)cc1)C(=O)[C@H]1CCCN1C ZINC001713579034 1418559882 /nfs/dbraw/zinc/55/98/82/1418559882.db2.gz YYCGZRRMDQVRIR-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CCc1ccc(CC[NH2+]C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001714385903 1418602398 /nfs/dbraw/zinc/60/23/98/1418602398.db2.gz SEFJTKRIEKXBCI-FQEVSTJZSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]CCN(C)C(=O)CN1CC[C@H](C)C1 ZINC001714753563 1418625512 /nfs/dbraw/zinc/62/55/12/1418625512.db2.gz DDBSQQULPGIDOJ-KRWDZBQOSA-N 1 3 331.504 2.700 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@H]21 ZINC001716049111 1418704526 /nfs/dbraw/zinc/70/45/26/1418704526.db2.gz JQNJHIKTVBPPMI-ZWKOTPCHSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCCCC[N@H+]1CC[C@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@H]21 ZINC001716049111 1418704533 /nfs/dbraw/zinc/70/45/33/1418704533.db2.gz JQNJHIKTVBPPMI-ZWKOTPCHSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1cc2ccccc2o1)NC(=O)CN1CC[C@H](C)C1 ZINC001716174513 1418713756 /nfs/dbraw/zinc/71/37/56/1418713756.db2.gz TYSQRWSSVJRVPP-HOTGVXAUSA-N 1 3 343.471 2.759 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc(Cl)c1)C(=O)CN1CC[C@H](C)C1 ZINC001716239283 1418733715 /nfs/dbraw/zinc/73/37/15/1418733715.db2.gz ICICNJSMIWWAOS-HNNXBMFYSA-N 1 3 337.895 2.620 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C/CNCc2cc(F)ccc2C)CC[N@@H+]1C ZINC001716294838 1418755832 /nfs/dbraw/zinc/75/58/32/1418755832.db2.gz CTMAXKJZRMNVJH-OBNUAKFSSA-N 1 3 347.478 2.626 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C/CNCc2cc(F)ccc2C)CC[N@H+]1C ZINC001716294838 1418755835 /nfs/dbraw/zinc/75/58/35/1418755835.db2.gz CTMAXKJZRMNVJH-OBNUAKFSSA-N 1 3 347.478 2.626 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C/CNC(=O)C12CCC[NH+]1CCC2 ZINC001716313391 1418768563 /nfs/dbraw/zinc/76/85/63/1418768563.db2.gz AVPIEGYJPRDQJP-NSCUHMNNSA-N 1 3 345.462 2.525 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC/C=C\C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001716343614 1418788143 /nfs/dbraw/zinc/78/81/43/1418788143.db2.gz GTFLQYJMQLBEBJ-BAHPRDJBSA-N 1 3 333.520 2.561 10 0 EFAEHO CC(C)(C)CC[NH2+]C/C=C\CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001716343552 1418788226 /nfs/dbraw/zinc/78/82/26/1418788226.db2.gz FONGKPQDHSSVCD-QULHZPMSSA-N 1 3 341.515 2.897 10 0 EFAEHO CCc1ccc(C[NH2+]C/C=C\CNC(=O)[C@H]2CCCCN2CC)cc1 ZINC001716379393 1418861410 /nfs/dbraw/zinc/86/14/10/1418861410.db2.gz QEROWNSSSHFHJK-PXDRNWIDSA-N 1 3 343.515 2.885 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C/C[NH2+]Cc1cc(C)cc(C)c1 ZINC001716380270 1418862471 /nfs/dbraw/zinc/86/24/71/1418862471.db2.gz ZMNRLTVQADKLLQ-ROUKRRSUSA-N 1 3 343.515 2.940 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CCc1ccc(C)cc1 ZINC001716398063 1418872532 /nfs/dbraw/zinc/87/25/32/1418872532.db2.gz GHKOTZVUOQPNED-IEBWSBKVSA-N 1 3 331.504 2.506 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C[NH2+]CC[C@@H]1CCc2ccccc21)N(C)C ZINC001716441427 1418883764 /nfs/dbraw/zinc/88/37/64/1418883764.db2.gz TVLOCOQEMBJHLX-QRFRQXIXSA-N 1 3 345.531 2.787 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C[NH2+]CC[C@H]1CCc2ccccc21)N(C)C ZINC001716441426 1418883786 /nfs/dbraw/zinc/88/37/86/1418883786.db2.gz TVLOCOQEMBJHLX-HQRMLTQVSA-N 1 3 345.531 2.787 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+][C@H](C)c1ccc(F)cc1F ZINC001716586843 1418919165 /nfs/dbraw/zinc/91/91/65/1418919165.db2.gz IHWMRWMZXGWJQN-CQSZACIVSA-N 1 3 341.446 2.804 10 0 EFAEHO CC(C)(C(=O)N[C@@H](C[NH2+]CC1=CCCCC1)C1CC1)N1CCCC1 ZINC001716617130 1418926165 /nfs/dbraw/zinc/92/61/65/1418926165.db2.gz CRCMZRNMRYFVKS-SFHVURJKSA-N 1 3 333.520 2.846 10 0 EFAEHO CCCCC[NH2+]C[C@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001716620991 1418927627 /nfs/dbraw/zinc/92/76/27/1418927627.db2.gz CKFYLWWAWZDXRI-QFBILLFUSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C[NH2+]CCC(F)(F)F)C1CC1 ZINC001716624008 1418928161 /nfs/dbraw/zinc/92/81/61/1418928161.db2.gz NBPOBIYYOIQMLR-GJZGRUSLSA-N 1 3 349.441 2.686 10 0 EFAEHO CC[C@@H]1CN(C(=O)C(C)(C)N2CCCCC2)CC[C@@H]1[NH2+]CCCF ZINC001716635674 1418932252 /nfs/dbraw/zinc/93/22/52/1418932252.db2.gz MRLLRWZYPSSVKN-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@@]2(CCN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001716732426 1418982196 /nfs/dbraw/zinc/98/21/96/1418982196.db2.gz WMULBTPEKGJRBV-HXUWFJFHSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCCC[N@H+]1CC[C@@]2(CCN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001716732426 1418982198 /nfs/dbraw/zinc/98/21/98/1418982198.db2.gz WMULBTPEKGJRBV-HXUWFJFHSA-N 1 3 335.536 2.975 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@H]1CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001716790640 1419009970 /nfs/dbraw/zinc/00/99/70/1419009970.db2.gz JBQXTHOBSXEDPE-QAPCUYQASA-N 1 3 335.467 2.691 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@H](CNCCF)C2CCCC2)CCCCC1 ZINC001716819879 1419030545 /nfs/dbraw/zinc/03/05/45/1419030545.db2.gz IKNHHGUWBOLOHG-QGZVFWFLSA-N 1 3 341.515 2.733 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC[C@@](C)(CNC(=O)Cc2nc[nH]c2C)C1 ZINC001716901281 1419087068 /nfs/dbraw/zinc/08/70/68/1419087068.db2.gz FHRDBSDYPLROKZ-VOFKWLDRSA-N 1 3 332.492 2.835 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC[C@@](C)(CNC(=O)Cc2nc[nH]c2C)C1 ZINC001716901281 1419087071 /nfs/dbraw/zinc/08/70/71/1419087071.db2.gz FHRDBSDYPLROKZ-VOFKWLDRSA-N 1 3 332.492 2.835 10 0 EFAEHO CCC/C=C\CC[N@H+]1C[C@H]2CN(C(=O)[C@H]3CCCCN3CC)C[C@H]2C1 ZINC001717014907 1419150571 /nfs/dbraw/zinc/15/05/71/1419150571.db2.gz KCDYECBCFJOSQW-IVCWSTDESA-N 1 3 347.547 2.997 10 0 EFAEHO CCC/C=C\CC[N@@H+]1C[C@H]2CN(C(=O)[C@H]3CCCCN3CC)C[C@H]2C1 ZINC001717014907 1419150574 /nfs/dbraw/zinc/15/05/74/1419150574.db2.gz KCDYECBCFJOSQW-IVCWSTDESA-N 1 3 347.547 2.997 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](CC[NH2+]CC=C(Cl)Cl)C1)C1CCC1 ZINC001717088628 1419199418 /nfs/dbraw/zinc/19/94/18/1419199418.db2.gz ZEFGAYSPZMHACB-CYBMUJFWSA-N 1 3 348.318 2.618 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N[C@H]1CCCN(C/C=C/Cl)CC1 ZINC001717203585 1419264847 /nfs/dbraw/zinc/26/48/47/1419264847.db2.gz YDVSMWDOXQGCKN-BHMZLHOFSA-N 1 3 341.927 2.976 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001717247821 1419291370 /nfs/dbraw/zinc/29/13/70/1419291370.db2.gz PQVCNKKFPZJYCV-IBGZPJMESA-N 1 3 332.492 2.847 10 0 EFAEHO CCCCCC[N@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001717247821 1419291373 /nfs/dbraw/zinc/29/13/73/1419291373.db2.gz PQVCNKKFPZJYCV-IBGZPJMESA-N 1 3 332.492 2.847 10 0 EFAEHO CCC[NH2+]CC1(c2ccccc2)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001717315157 1419325891 /nfs/dbraw/zinc/32/58/91/1419325891.db2.gz BNSPNAUOMJSCQC-IBGZPJMESA-N 1 3 343.515 2.641 10 0 EFAEHO CC/C=C/CC[N@H+](CC)CC1CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001717356492 1419351551 /nfs/dbraw/zinc/35/15/51/1419351551.db2.gz AKNGYYJIBUIBKT-AATRIKPKSA-N 1 3 332.492 2.869 10 0 EFAEHO CC/C=C/CC[N@@H+](CC)CC1CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001717356492 1419351556 /nfs/dbraw/zinc/35/15/56/1419351556.db2.gz AKNGYYJIBUIBKT-AATRIKPKSA-N 1 3 332.492 2.869 10 0 EFAEHO CC/C=C\CC[N@H+](CC)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001717357569 1419352035 /nfs/dbraw/zinc/35/20/35/1419352035.db2.gz UVXLDPKDICBPDW-WAYWQWQTSA-N 1 3 335.536 2.999 10 0 EFAEHO CC/C=C\CC[N@@H+](CC)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001717357569 1419352037 /nfs/dbraw/zinc/35/20/37/1419352037.db2.gz UVXLDPKDICBPDW-WAYWQWQTSA-N 1 3 335.536 2.999 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@@H]1C[N@H+](C)CCCCC(F)(F)F ZINC001717369244 1419361728 /nfs/dbraw/zinc/36/17/28/1419361728.db2.gz KESZVGOMKHVIJC-HUUCEWRRSA-N 1 3 349.441 2.736 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@@H]1C[N@@H+](C)CCCCC(F)(F)F ZINC001717369244 1419361732 /nfs/dbraw/zinc/36/17/32/1419361732.db2.gz KESZVGOMKHVIJC-HUUCEWRRSA-N 1 3 349.441 2.736 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC2CC(C[NH2+]CCC3=CCCCC3)C2)C1 ZINC001717390083 1419375770 /nfs/dbraw/zinc/37/57/70/1419375770.db2.gz LUNPMZAAYZYDRA-IVMQYODDSA-N 1 3 333.520 2.703 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[N@H+](C)CCCCC(F)(F)F ZINC001717475800 1419410577 /nfs/dbraw/zinc/41/05/77/1419410577.db2.gz FICVXVUTTYZJNQ-CYBMUJFWSA-N 1 3 337.430 2.640 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[N@@H+](C)CCCCC(F)(F)F ZINC001717475800 1419410578 /nfs/dbraw/zinc/41/05/78/1419410578.db2.gz FICVXVUTTYZJNQ-CYBMUJFWSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H]1C[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001717647767 1419485991 /nfs/dbraw/zinc/48/59/91/1419485991.db2.gz GHBMOSSBPJYWKC-GPMSIDNRSA-N 1 3 339.499 2.650 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CCC[NH2+]Cc1ncccc1C ZINC001717695141 1419510767 /nfs/dbraw/zinc/51/07/67/1419510767.db2.gz ATNOIHAGFWZWDD-HKUYNNGSSA-N 1 3 346.519 2.639 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2cccc(C)c2)[C@@H]1C ZINC001717803347 1419549122 /nfs/dbraw/zinc/54/91/22/1419549122.db2.gz WBILSUNQMLQNBQ-AZUAARDMSA-N 1 3 345.531 2.848 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]CCc1cccs1)C(C)(C)C)N(C)C ZINC001717971888 1419635482 /nfs/dbraw/zinc/63/54/82/1419635482.db2.gz VELJKFKFQLTHEH-HZPDHXFCSA-N 1 3 339.549 2.751 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C2CC([NH2+]CCCCC(F)(F)F)C2)C1 ZINC001717996705 1419648111 /nfs/dbraw/zinc/64/81/11/1419648111.db2.gz PEPSVDNPRRADBL-NFOMZHRRSA-N 1 3 349.441 2.640 10 0 EFAEHO CN(C(=O)Cc1c[nH]cn1)C1CC([NH2+]CCCCc2ccccc2)C1 ZINC001717997612 1419648978 /nfs/dbraw/zinc/64/89/78/1419648978.db2.gz ZMJAQDDUSDNXME-UHFFFAOYSA-N 1 3 340.471 2.554 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@@H+]([C@@H](C)c2ccccc2)CC1 ZINC001718033327 1419671537 /nfs/dbraw/zinc/67/15/37/1419671537.db2.gz GKKQAQPZWNVASE-KRWDZBQOSA-N 1 3 329.488 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@H+]([C@@H](C)c2ccccc2)CC1 ZINC001718033327 1419671538 /nfs/dbraw/zinc/67/15/38/1419671538.db2.gz GKKQAQPZWNVASE-KRWDZBQOSA-N 1 3 329.488 2.836 10 0 EFAEHO CN(CCC[NH2+][C@H]1CCCc2ccccc21)C(=O)CN1CCCC1 ZINC001723195323 1424448921 /nfs/dbraw/zinc/44/89/21/1424448921.db2.gz ZEWUGPIZHYMLRC-IBGZPJMESA-N 1 3 329.488 2.598 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]CCCCC(F)(F)F)CC1 ZINC001723596393 1424528669 /nfs/dbraw/zinc/52/86/69/1424528669.db2.gz XDGXZQKUVRRTDC-ZIAGYGMSSA-N 1 3 349.441 2.830 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CCCCC(F)(F)F)CCN1C(=O)Cc1c[nH]cn1 ZINC001723865007 1424598507 /nfs/dbraw/zinc/59/85/07/1424598507.db2.gz ZULSGSTZDABLRX-STQMWFEESA-N 1 3 346.397 2.654 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001723940038 1424611661 /nfs/dbraw/zinc/61/16/61/1424611661.db2.gz OEDPUHNTGUOQMI-QFBILLFUSA-N 1 3 339.499 2.746 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001723940037 1424611816 /nfs/dbraw/zinc/61/18/16/1424611816.db2.gz OEDPUHNTGUOQMI-LPHOPBHVSA-N 1 3 339.499 2.746 10 0 EFAEHO C[C@H]1CN(C(=O)CN2CCC(C)CC2)C[C@@H]1C[NH2+]CCCCCF ZINC001724602553 1424818269 /nfs/dbraw/zinc/81/82/69/1424818269.db2.gz JPZIIKLTNVDILL-ROUUACIJSA-N 1 3 341.515 2.542 10 0 EFAEHO C[C@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@@H]1C[NH2+]CCC1CC1 ZINC001724609767 1424829019 /nfs/dbraw/zinc/82/90/19/1424829019.db2.gz RXLGVZJRLAHDMP-JXFKEZNVSA-N 1 3 343.515 2.846 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1CC[C@H](C[NH2+]CCCF)CC1 ZINC001724613711 1424834096 /nfs/dbraw/zinc/83/40/96/1424834096.db2.gz IBFCNMIAPSMASI-XSLAGTTESA-N 1 3 341.515 2.731 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)c1 ZINC001724695818 1424915535 /nfs/dbraw/zinc/91/55/35/1424915535.db2.gz DZIMTPIROCKXJK-QUCCMNQESA-N 1 3 343.515 2.726 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](CC[NH2+]CC2CC(C)(C)C2)C1)C1CCC1 ZINC001724711196 1424930001 /nfs/dbraw/zinc/93/00/01/1424930001.db2.gz FFCMGOIJSMMWGV-MRXNPFEDSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)=CC[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CCC1 ZINC001724793602 1425017317 /nfs/dbraw/zinc/01/73/17/1425017317.db2.gz MDKPPAMWNBKQPS-LJQANCHMSA-N 1 3 339.499 2.794 10 0 EFAEHO CC(C)=CC[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CCC1 ZINC001724793601 1425017776 /nfs/dbraw/zinc/01/77/76/1425017776.db2.gz MDKPPAMWNBKQPS-IBGZPJMESA-N 1 3 339.499 2.794 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1[NH2+]CCCCCF ZINC001724950580 1425158396 /nfs/dbraw/zinc/15/83/96/1425158396.db2.gz ZBLAFZHVKMGFFB-CVEARBPZSA-N 1 3 329.504 2.541 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@H]1[NH2+]CCCCCF ZINC001724950584 1425158609 /nfs/dbraw/zinc/15/86/09/1425158609.db2.gz ZBLAFZHVKMGFFB-JKSUJKDBSA-N 1 3 329.504 2.541 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001724972850 1425183933 /nfs/dbraw/zinc/18/39/33/1425183933.db2.gz VCKVWWUKPROJRC-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CCCCC[N@H+]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001724972850 1425183939 /nfs/dbraw/zinc/18/39/39/1425183939.db2.gz VCKVWWUKPROJRC-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@H+](C)CCCCC(F)(F)F ZINC001725099122 1425299563 /nfs/dbraw/zinc/29/95/63/1425299563.db2.gz KESZVGOMKHVIJC-GJZGRUSLSA-N 1 3 349.441 2.736 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@@H+](C)CCCCC(F)(F)F ZINC001725099122 1425299568 /nfs/dbraw/zinc/29/95/68/1425299568.db2.gz KESZVGOMKHVIJC-GJZGRUSLSA-N 1 3 349.441 2.736 10 0 EFAEHO CC(C)CC[NH2+]CC(C)(C)CN(C)C(=O)C(C)(C)N1CCCC1 ZINC001725149067 1425334781 /nfs/dbraw/zinc/33/47/81/1425334781.db2.gz QOHVYNJVVKOYIJ-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1ccc(C[NH2+]CCC[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1F ZINC001725412497 1425556259 /nfs/dbraw/zinc/55/62/59/1425556259.db2.gz DCSFLCOTIDHPDC-RDJZCZTQSA-N 1 3 349.494 2.850 10 0 EFAEHO Cc1cc(C[NH2+]CCC[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cs1 ZINC001725416406 1425560937 /nfs/dbraw/zinc/56/09/37/1425560937.db2.gz LAOBYFLQVQEUGO-LSDHHAIUSA-N 1 3 337.533 2.773 10 0 EFAEHO Cc1cccc(C[NH2+]CCC[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001725421271 1425565385 /nfs/dbraw/zinc/56/53/85/1425565385.db2.gz YFLJFBGTUMTMOU-QZTJIDSGSA-N 1 3 331.504 2.711 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CCCc2ccccc2)CN1C(=O)CN(C)C1CCC1 ZINC001725606056 1425694691 /nfs/dbraw/zinc/69/46/91/1425694691.db2.gz YCYCQHSMEYODCG-PKOBYXMFSA-N 1 3 343.515 2.683 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)[C@H]1C ZINC001725610750 1425701133 /nfs/dbraw/zinc/70/11/33/1425701133.db2.gz YBUIIDAULADABA-AZUAARDMSA-N 1 3 345.531 2.847 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CCCCCF)[C@@H]2C1 ZINC001725616832 1425710526 /nfs/dbraw/zinc/71/05/26/1425710526.db2.gz BXHMMDCBRPFXKM-RCCFBDPRSA-N 1 3 341.515 2.683 10 0 EFAEHO Cc1cccc(C[N@H+]2CC=C(CNC(=O)CN3CC[C@@H](C)C3)CC2)c1 ZINC001725823805 1425883210 /nfs/dbraw/zinc/88/32/10/1425883210.db2.gz NHCSOSKAIRPUPN-GOSISDBHSA-N 1 3 341.499 2.585 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC=C(CNC(=O)CN3CC[C@@H](C)C3)CC2)c1 ZINC001725823805 1425883216 /nfs/dbraw/zinc/88/32/16/1425883216.db2.gz NHCSOSKAIRPUPN-GOSISDBHSA-N 1 3 341.499 2.585 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC=C(CNC(=O)CN(C)C(C)C)CC1 ZINC001725829760 1425896295 /nfs/dbraw/zinc/89/62/95/1425896295.db2.gz MVMDQSFOWFBSNZ-UHFFFAOYSA-N 1 3 329.488 2.584 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC=C(CNC(=O)CN(C)C(C)C)CC1 ZINC001725829760 1425896299 /nfs/dbraw/zinc/89/62/99/1425896299.db2.gz MVMDQSFOWFBSNZ-UHFFFAOYSA-N 1 3 329.488 2.584 10 0 EFAEHO COc1ccc([C@H](C)[NH2+]C[C@H]2CNCCC2(F)F)c(C)c1OC ZINC000925777435 717623067 /nfs/dbraw/zinc/62/30/67/717623067.db2.gz OXXVOWHPDAKBJS-QWHCGFSZSA-N 1 3 328.403 2.908 10 0 EFAEHO CCN1CC[C@@H](C[NH2+]C2CCN(c3ccc(N(C)C)cc3)CC2)C1 ZINC000163277173 718375846 /nfs/dbraw/zinc/37/58/46/718375846.db2.gz TURCRPRDVBAAKK-KRWDZBQOSA-N 1 3 330.520 2.653 10 0 EFAEHO CC[NH+](CC)Cc1ccc(C(=O)N[C@@]2(C)CN3CCC2CC3)cc1 ZINC000892789983 719186003 /nfs/dbraw/zinc/18/60/03/719186003.db2.gz VZXBSYLGPGVUIE-FQEVSTJZSA-N 1 3 329.488 2.743 10 0 EFAEHO C[C@H](NC[C@@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1ccc(Cl)s1 ZINC000925850968 719818774 /nfs/dbraw/zinc/81/87/74/719818774.db2.gz AUPNTROULMPIPW-QWRGUYRKSA-N 1 3 328.865 2.737 10 0 EFAEHO CCc1cc(N2CCC[C@H](N[C@@H]3C[C@H]([NH3+])CC(C)(C)C3)C2)ncn1 ZINC000925620552 720601615 /nfs/dbraw/zinc/60/16/15/720601615.db2.gz HQTVCZVYAVGGFC-BHYGNILZSA-N 1 3 331.508 2.503 10 0 EFAEHO CC1(C)[C@H]([NH2+]CCCNC(=O)/C=C\c2ccccc2)[C@@H]2CCCN[C@@H]21 ZINC000925664206 720832067 /nfs/dbraw/zinc/83/20/67/720832067.db2.gz CXJNJIPYVLRBPI-SZOISFNESA-N 1 3 341.499 2.572 10 0 EFAEHO CC1(C)C[C@@H]([NH3+])C[C@H](NC[C@@H](O)c2cccc(Br)c2)C1 ZINC000925667816 720846403 /nfs/dbraw/zinc/84/64/03/720846403.db2.gz SJLFJOVHQARHQV-SOUVJXGZSA-N 1 3 341.293 2.978 10 0 EFAEHO CC[NH+](CC)Cc1ccc(CNC[C@@H]2[C@H](C(=O)OC)C2(F)F)cc1 ZINC000894152821 720944046 /nfs/dbraw/zinc/94/40/46/720944046.db2.gz DSVFTJWRERELOD-HZPDHXFCSA-N 1 3 340.414 2.672 10 0 EFAEHO COC(=O)[C@H]1[C@H](CNCc2cccc(C[N@H+](C)C(C)C)c2)C1(F)F ZINC000894206619 721207448 /nfs/dbraw/zinc/20/74/48/721207448.db2.gz HHGBIPMIKIVNTN-JKSUJKDBSA-N 1 3 340.414 2.671 10 0 EFAEHO COC(=O)[C@H]1[C@H](CNCc2cccc(C[N@@H+](C)C(C)C)c2)C1(F)F ZINC000894206619 721207452 /nfs/dbraw/zinc/20/74/52/721207452.db2.gz HHGBIPMIKIVNTN-JKSUJKDBSA-N 1 3 340.414 2.671 10 0 EFAEHO COC(=O)[C@H]1[C@@H](CNCc2ccccc2C[N@H+](C)C(C)C)C1(F)F ZINC000894385085 722676659 /nfs/dbraw/zinc/67/66/59/722676659.db2.gz PTOFYSLVDRBJGK-HZPDHXFCSA-N 1 3 340.414 2.671 10 0 EFAEHO COC(=O)[C@H]1[C@@H](CNCc2ccccc2C[N@@H+](C)C(C)C)C1(F)F ZINC000894385085 722676660 /nfs/dbraw/zinc/67/66/60/722676660.db2.gz PTOFYSLVDRBJGK-HZPDHXFCSA-N 1 3 340.414 2.671 10 0 EFAEHO COC(=O)[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000895352028 724063159 /nfs/dbraw/zinc/06/31/59/724063159.db2.gz MRXPLJVZFSFAQQ-YHDCXSKOSA-N 1 3 342.483 2.971 10 0 EFAEHO C[C@H](CN(C)C)[C@H]1CCCC[N@@H+]1CC1CN(C(=O)OC(C)(C)C)C1 ZINC000895377577 724087987 /nfs/dbraw/zinc/08/79/87/724087987.db2.gz MMWZBYFAHUTASX-NVXWUHKLSA-N 1 3 339.524 2.906 10 0 EFAEHO C[C@H](CN(C)C)[C@H]1CCCC[N@H+]1CC1CN(C(=O)OC(C)(C)C)C1 ZINC000895377577 724087990 /nfs/dbraw/zinc/08/79/90/724087990.db2.gz MMWZBYFAHUTASX-NVXWUHKLSA-N 1 3 339.524 2.906 10 0 EFAEHO CC[NH+]1CCN(c2ccc(NCc3c(C)ccnc3N)cc2F)CC1 ZINC000895467938 724149010 /nfs/dbraw/zinc/14/90/10/724149010.db2.gz QRZCYWZWMPLSGK-UHFFFAOYSA-N 1 3 343.450 2.865 10 0 EFAEHO CN1CC[C@@H]([NH2+]C[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)CC1(C)C ZINC000895508521 724173889 /nfs/dbraw/zinc/17/38/89/724173889.db2.gz SORIJIDQMBIICS-SJORKVTESA-N 1 3 343.471 2.577 10 0 EFAEHO COc1ccc(C2CC2)cc1C[NH2+]C1CCN(CC(C)(C)O)CC1 ZINC000895538112 724187292 /nfs/dbraw/zinc/18/72/92/724187292.db2.gz XFYZVAWIMUIXLX-UHFFFAOYSA-N 1 3 332.488 2.898 10 0 EFAEHO Cc1cc(CN2CCN(c3cc[nH+]cc3)[C@@H](C)C2)ccc1-n1cncn1 ZINC000895555704 724193832 /nfs/dbraw/zinc/19/38/32/724193832.db2.gz AQSJBRKPKXDDGB-KRWDZBQOSA-N 1 3 348.454 2.681 10 0 EFAEHO CCC[NH+]1CCN(c2ccccc2CNC[C@@H](O)c2ccco2)CC1 ZINC000088676871 725627874 /nfs/dbraw/zinc/62/78/74/725627874.db2.gz QXIJJAKWFXQQKR-LJQANCHMSA-N 1 3 343.471 2.635 10 0 EFAEHO CN(C)C[C@H]1CC[N@H+](CCCN(C(=O)OC(C)(C)C)C2CC2)C1 ZINC000929637449 725644198 /nfs/dbraw/zinc/64/41/98/725644198.db2.gz IKQAGGDCRGFTIX-OAHLLOKOSA-N 1 3 325.497 2.660 10 0 EFAEHO CN(C)C[C@H]1CC[N@@H+](CCCN(C(=O)OC(C)(C)C)C2CC2)C1 ZINC000929637449 725644200 /nfs/dbraw/zinc/64/42/00/725644200.db2.gz IKQAGGDCRGFTIX-OAHLLOKOSA-N 1 3 325.497 2.660 10 0 EFAEHO C[N@@H+]1CCN(C(=O)c2ccc(NC3=NCCC3)cc2)CCC1(C)C ZINC000913722904 725833089 /nfs/dbraw/zinc/83/30/89/725833089.db2.gz VYAUXQUVSLRIBF-UHFFFAOYSA-N 1 3 328.460 2.847 10 0 EFAEHO C[N@H+]1CCN(C(=O)c2ccc(NC3=NCCC3)cc2)CCC1(C)C ZINC000913722904 725833092 /nfs/dbraw/zinc/83/30/92/725833092.db2.gz VYAUXQUVSLRIBF-UHFFFAOYSA-N 1 3 328.460 2.847 10 0 EFAEHO CCN(C(=O)c1ccc(NC2=NCCC2)cc1)C1CC[NH+](C)CC1 ZINC000908912625 727287341 /nfs/dbraw/zinc/28/73/41/727287341.db2.gz AGAJTWZMYNSMJP-UHFFFAOYSA-N 1 3 328.460 2.847 10 0 EFAEHO C[N@@H+]1CCC[C@@H](CCNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000909915023 727393075 /nfs/dbraw/zinc/39/30/75/727393075.db2.gz RSLJQAXDTYVQOZ-HNNXBMFYSA-N 1 3 328.460 2.753 10 0 EFAEHO C[N@H+]1CCC[C@@H](CCNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000909915023 727393077 /nfs/dbraw/zinc/39/30/77/727393077.db2.gz RSLJQAXDTYVQOZ-HNNXBMFYSA-N 1 3 328.460 2.753 10 0 EFAEHO C[N@@H+]1CCC[C@H](CCNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000909915024 727393108 /nfs/dbraw/zinc/39/31/08/727393108.db2.gz RSLJQAXDTYVQOZ-OAHLLOKOSA-N 1 3 328.460 2.753 10 0 EFAEHO C[N@H+]1CCC[C@H](CCNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000909915024 727393110 /nfs/dbraw/zinc/39/31/10/727393110.db2.gz RSLJQAXDTYVQOZ-OAHLLOKOSA-N 1 3 328.460 2.753 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000912298300 727690254 /nfs/dbraw/zinc/69/02/54/727690254.db2.gz UQYVPNGRCAYSEW-INIZCTEOSA-N 1 3 328.460 2.893 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000912298300 727690255 /nfs/dbraw/zinc/69/02/55/727690255.db2.gz UQYVPNGRCAYSEW-INIZCTEOSA-N 1 3 328.460 2.893 10 0 EFAEHO C[C@@]1(NC(=O)c2ccc(NC3=NCCC3)cc2)C[NH+]2CCC1CC2 ZINC000912374159 727703128 /nfs/dbraw/zinc/70/31/28/727703128.db2.gz KZVFCLSZZQJEJY-LJQANCHMSA-N 1 3 326.444 2.505 10 0 EFAEHO C[N@@H+]1C[C@@]2(C)CN(C(=O)c3ccc(NC4=NCCC4)cc3)C[C@@]2(C)C1 ZINC000913273676 727811745 /nfs/dbraw/zinc/81/17/45/727811745.db2.gz GNCNPARAFDASGM-BGYRXZFFSA-N 1 3 340.471 2.705 10 0 EFAEHO C[N@H+]1C[C@@]2(C)CN(C(=O)c3ccc(NC4=NCCC4)cc3)C[C@@]2(C)C1 ZINC000913273676 727811747 /nfs/dbraw/zinc/81/17/47/727811747.db2.gz GNCNPARAFDASGM-BGYRXZFFSA-N 1 3 340.471 2.705 10 0 EFAEHO CCOc1cccc(CN2CCC3(C[N@H+](C)C[C@H]3COC)CC2)c1 ZINC000169789857 728404224 /nfs/dbraw/zinc/40/42/24/728404224.db2.gz UTMFZLSDXKCGKD-SFHVURJKSA-N 1 3 332.488 2.876 10 0 EFAEHO CCOc1cccc(CN2CCC3(C[N@@H+](C)C[C@H]3COC)CC2)c1 ZINC000169789857 728404228 /nfs/dbraw/zinc/40/42/28/728404228.db2.gz UTMFZLSDXKCGKD-SFHVURJKSA-N 1 3 332.488 2.876 10 0 EFAEHO CC1(C)C[C@@H]([NH3+])C[C@H](NCc2cccc(CN3CCOCC3)c2)C1 ZINC000925478107 729148464 /nfs/dbraw/zinc/14/84/64/729148464.db2.gz SVASNDOSNCLEIZ-OALUTQOASA-N 1 3 331.504 2.514 10 0 EFAEHO C[NH+]1CCC(C(=O)NC[C@@H]2CCN2CCCCc2ccccc2)CC1 ZINC001569371829 1085152193 /nfs/dbraw/zinc/15/21/93/1085152193.db2.gz VPUCZZDTQBXVKD-FQEVSTJZSA-N 1 3 343.515 2.542 10 0 EFAEHO C[NH+](C)CCCCC(=O)NCC1(N[C@@H]2CCc3ccc(F)cc32)CC1 ZINC001569426410 1085197522 /nfs/dbraw/zinc/19/75/22/1085197522.db2.gz PWKZKTRIQLHEFP-GOSISDBHSA-N 1 3 347.478 2.783 10 0 EFAEHO CC[C@H](C(=O)N1CCC([N@H+](CC=C(C)C)CC2CC2)CC1)N(C)C ZINC001569452508 1085239728 /nfs/dbraw/zinc/23/97/28/1085239728.db2.gz YDGJEUPATNDMBL-LJQANCHMSA-N 1 3 335.536 2.996 10 0 EFAEHO CC[C@H](C(=O)N1CCC([N@@H+](CC=C(C)C)CC2CC2)CC1)N(C)C ZINC001569452508 1085239734 /nfs/dbraw/zinc/23/97/34/1085239734.db2.gz YDGJEUPATNDMBL-LJQANCHMSA-N 1 3 335.536 2.996 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CCC(C)CC3)C2)C1 ZINC001569479443 1085287092 /nfs/dbraw/zinc/28/70/92/1085287092.db2.gz WNHUGNHOEPNOFO-NYPGBQQYSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@]2(CCN(C(=O)CN3CCC(C)CC3)C2)C1 ZINC001569479443 1085287099 /nfs/dbraw/zinc/28/70/99/1085287099.db2.gz WNHUGNHOEPNOFO-NYPGBQQYSA-N 1 3 347.547 2.999 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@H]2C[NH2+]CCCc2ccccc2)CCC1 ZINC001569543405 1085358640 /nfs/dbraw/zinc/35/86/40/1085358640.db2.gz CVWGOEVLIUWIJF-IBGZPJMESA-N 1 3 343.515 2.684 10 0 EFAEHO CN(CC(=O)N1CC[C@@](C)(C[NH2+]C/C=C\Cl)C1)CC(C)(C)C ZINC001569683934 1085514428 /nfs/dbraw/zinc/51/44/28/1085514428.db2.gz UCUGLYIJXCRKNX-QLBOMPFWSA-N 1 3 329.916 2.545 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@](C)(C[NH2+]CC2=CCCCC2)C1)N(C)C ZINC001569683776 1085514460 /nfs/dbraw/zinc/51/44/60/1085514460.db2.gz QVSPFVFFZJDJHU-UYAOXDASSA-N 1 3 335.536 2.901 10 0 EFAEHO CN(CC(=O)N1CC[C@](C)(C[NH2+]C/C=C\Cl)C1)CC(C)(C)C ZINC001569683931 1085514677 /nfs/dbraw/zinc/51/46/77/1085514677.db2.gz UCUGLYIJXCRKNX-BQLWYNFJSA-N 1 3 329.916 2.545 10 0 EFAEHO C[C@@H]([NH2+]CCC1=CCCCC1)[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001569824086 1085643612 /nfs/dbraw/zinc/64/36/12/1085643612.db2.gz NBLLHJQQTPGAEN-MJGOQNOKSA-N 1 3 333.520 2.799 10 0 EFAEHO CCCC[NH2+]CC[C@@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001570001986 1085842587 /nfs/dbraw/zinc/84/25/87/1085842587.db2.gz JMCDCWYIFFRUQG-VQIMIIECSA-N 1 3 341.515 2.827 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001570022557 1085870490 /nfs/dbraw/zinc/87/04/90/1085870490.db2.gz WMSVBLSMWPBIQC-SFHVURJKSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+]CC2=CCCCC2)CCC1 ZINC001570104032 1085950953 /nfs/dbraw/zinc/95/09/53/1085950953.db2.gz PZVKCEXOCQIWOE-SFHVURJKSA-N 1 3 333.520 2.988 10 0 EFAEHO CC/C(C)=C\C(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CC2CC2)CC1 ZINC001570220982 1086062227 /nfs/dbraw/zinc/06/22/27/1086062227.db2.gz YUFVUXGHJIDVSF-NNAJYLQYSA-N 1 3 345.531 2.892 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)CN(C)C(C)C)C2 ZINC001570274595 1086117137 /nfs/dbraw/zinc/11/71/37/1086117137.db2.gz HBYDHVLAVZUKRX-ROUKRRSUSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@]2(C1)CCCN(C(=O)CN(C)C(C)C)C2 ZINC001570274595 1086117144 /nfs/dbraw/zinc/11/71/44/1086117144.db2.gz HBYDHVLAVZUKRX-ROUKRRSUSA-N 1 3 335.536 2.997 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@@H]1CCCCC[N@@H+]1CC=C(C)C ZINC001570822866 1086543111 /nfs/dbraw/zinc/54/31/11/1086543111.db2.gz MVVLWCLVSYGJSL-ROUUACIJSA-N 1 3 341.515 2.993 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@@H]1CCCCC[N@H+]1CC=C(C)C ZINC001570822866 1086543119 /nfs/dbraw/zinc/54/31/19/1086543119.db2.gz MVVLWCLVSYGJSL-ROUUACIJSA-N 1 3 341.515 2.993 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@H+](CC1=CCCCC1)C2 ZINC001571049394 1086654471 /nfs/dbraw/zinc/65/44/71/1086654471.db2.gz TXTZUEQDIJMXLY-UHFFFAOYSA-N 1 3 333.520 2.751 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@@H+](CC1=CCCCC1)C2 ZINC001571049394 1086654472 /nfs/dbraw/zinc/65/44/72/1086654472.db2.gz TXTZUEQDIJMXLY-UHFFFAOYSA-N 1 3 333.520 2.751 10 0 EFAEHO CCCCC[N@@H+]1CCCC2(CN(C(=O)[C@@H]3CCCCN3CC)C2)C1 ZINC001571049491 1086654863 /nfs/dbraw/zinc/65/48/63/1086654863.db2.gz UWJOXMXEAUQEEO-SFHVURJKSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCC[N@H+]1CCCC2(CN(C(=O)[C@@H]3CCCCN3CC)C2)C1 ZINC001571049491 1086654874 /nfs/dbraw/zinc/65/48/74/1086654874.db2.gz UWJOXMXEAUQEEO-SFHVURJKSA-N 1 3 335.536 2.975 10 0 EFAEHO C[C@H](CCC[NH2+]C[C@@H]1CCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001571271527 1086692979 /nfs/dbraw/zinc/69/29/79/1086692979.db2.gz WZSSIYJIGKDVNZ-HUUCEWRRSA-N 1 3 345.478 2.781 10 0 EFAEHO CN(C)C1(C(=O)N(C)[C@H](C[NH2+]CCc2cccs2)C2CC2)CCC1 ZINC001571361148 1086756439 /nfs/dbraw/zinc/75/64/39/1086756439.db2.gz HUUQUSHHWLDAMM-QGZVFWFLSA-N 1 3 349.544 2.602 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CC[C@H](C[NH2+]CCCC(C)(C)C)C1 ZINC001571548419 1086953140 /nfs/dbraw/zinc/95/31/40/1086953140.db2.gz ODQMITGPUHPHRB-JKSUJKDBSA-N 1 3 334.508 2.961 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2CC[C@@H](C[NH2+]CCCF)C2)c1 ZINC001571550830 1086954480 /nfs/dbraw/zinc/95/44/80/1086954480.db2.gz VBQWZJJVJGVNRR-QAPCUYQASA-N 1 3 335.467 2.596 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C[NH2+]CCCF)C(C)(C)C)N1CCCC1 ZINC001571639307 1087011116 /nfs/dbraw/zinc/01/11/16/1087011116.db2.gz LKOQZESPHZXFPK-HZPDHXFCSA-N 1 3 329.504 2.587 10 0 EFAEHO CCCN1CCCC[C@H]1C(=O)N1CC[C@H](c2ccc(F)cc2)[C@@H]([NH3+])C1 ZINC001647248013 1089161659 /nfs/dbraw/zinc/16/16/59/1089161659.db2.gz LYWOWJPZBKXFGZ-QYZOEREBSA-N 1 3 347.478 2.733 10 0 EFAEHO O=C(NCC12CCC[NH+](CCC1)C2)c1ccc(NC2=NCCC2)cc1 ZINC001649328549 1092393710 /nfs/dbraw/zinc/39/37/10/1092393710.db2.gz DACFLGBQJPJRFT-UHFFFAOYSA-N 1 3 340.471 2.897 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12 ZINC001649357454 1092428679 /nfs/dbraw/zinc/42/86/79/1092428679.db2.gz QGHQWUGXGRCEJF-FRFSOERESA-N 1 3 341.455 2.564 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@@H]12 ZINC001649357454 1092428687 /nfs/dbraw/zinc/42/86/87/1092428687.db2.gz QGHQWUGXGRCEJF-FRFSOERESA-N 1 3 341.455 2.564 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](C[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001267067272 1092524468 /nfs/dbraw/zinc/52/44/68/1092524468.db2.gz OUZQFGIMCOJOES-IAGOWNOFSA-N 1 3 325.541 2.837 10 0 EFAEHO CN(CC[NH2+]Cc1ccc(C2CCCC2)cc1)C(=O)CN1CCCC1 ZINC001267081776 1092605295 /nfs/dbraw/zinc/60/52/95/1092605295.db2.gz SGEYNBIVKRPXID-UHFFFAOYSA-N 1 3 343.515 2.988 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@H]1CCC[N@@H+]1CCC(F)(F)F)N(C)C ZINC001267175304 1093070593 /nfs/dbraw/zinc/07/05/93/1093070593.db2.gz RTGBRDRELAZAAZ-KBPBESRZSA-N 1 3 337.430 2.640 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@H]1CCC[N@H+]1CCC(F)(F)F)N(C)C ZINC001267175304 1093070598 /nfs/dbraw/zinc/07/05/98/1093070598.db2.gz RTGBRDRELAZAAZ-KBPBESRZSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCCC[C@@H]1CCC[N@@H+]1CCCF ZINC001267178450 1093087676 /nfs/dbraw/zinc/08/76/76/1093087676.db2.gz XKMUVGLKKLCQPG-MSOLQXFVSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCCC[C@@H]1CCC[N@H+]1CCCF ZINC001267178450 1093087689 /nfs/dbraw/zinc/08/76/89/1093087689.db2.gz XKMUVGLKKLCQPG-MSOLQXFVSA-N 1 3 341.515 2.970 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CCC[C@@H]3CCC[N@@H+]32)c(C)c1 ZINC001480923284 1093141221 /nfs/dbraw/zinc/14/12/21/1093141221.db2.gz RJGKQGAFMPQPGU-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CCC[C@@H]3CCC[N@H+]32)c(C)c1 ZINC001480923284 1093141229 /nfs/dbraw/zinc/14/12/29/1093141229.db2.gz RJGKQGAFMPQPGU-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO c1csc(CNCCc2ccc(OCC[NH+]3CCCC3)cc2)n1 ZINC001650863692 1093502003 /nfs/dbraw/zinc/50/20/03/1093502003.db2.gz JJEVHWYYSDMLEN-UHFFFAOYSA-N 1 3 331.485 2.950 10 0 EFAEHO CN(CC[NH2+]CCc1ccc2ccccc2c1)C(=O)[C@@H]1CCCN1C ZINC001267355115 1094292322 /nfs/dbraw/zinc/29/23/22/1094292322.db2.gz IWWIRPDNYNDPEN-FQEVSTJZSA-N 1 3 339.483 2.525 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[NH2+]Cc2ccc(C(C)(C)C)cc2)C1 ZINC001267429361 1094515388 /nfs/dbraw/zinc/51/53/88/1094515388.db2.gz YYDGNYLRGJNFQR-KRWDZBQOSA-N 1 3 345.531 2.874 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@H+](Cc2ccsc2)C1)CC(C)(C)C ZINC001481112999 1094619258 /nfs/dbraw/zinc/61/92/58/1094619258.db2.gz VEIPJEXCSWHAOF-HNNXBMFYSA-N 1 3 337.533 2.664 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@@H+](Cc2ccsc2)C1)CC(C)(C)C ZINC001481112999 1094619268 /nfs/dbraw/zinc/61/92/68/1094619268.db2.gz VEIPJEXCSWHAOF-HNNXBMFYSA-N 1 3 337.533 2.664 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CC[N@H+](CCC3CCCCC3)C2)C1 ZINC001481112935 1094619522 /nfs/dbraw/zinc/61/95/22/1094619522.db2.gz UQJIWMCYUKVJCL-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CC[N@@H+](CCC3CCCCC3)C2)C1 ZINC001481112935 1094619526 /nfs/dbraw/zinc/61/95/26/1094619526.db2.gz UQJIWMCYUKVJCL-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@H](F)C[N@@H+]1CC[C@@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001481462990 1094715672 /nfs/dbraw/zinc/71/56/72/1094715672.db2.gz WTYKMFVGIOFVAP-APWZRJJASA-N 1 3 349.494 2.938 10 0 EFAEHO CC[C@H](F)C[N@H+]1CC[C@@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001481462990 1094715682 /nfs/dbraw/zinc/71/56/82/1094715682.db2.gz WTYKMFVGIOFVAP-APWZRJJASA-N 1 3 349.494 2.938 10 0 EFAEHO C[C@H](F)CC[N@H+](C)C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001481510096 1095008463 /nfs/dbraw/zinc/00/84/63/1095008463.db2.gz TXYMCUBIQILTSW-FUHWJXTLSA-N 1 3 349.494 2.890 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001481510096 1095008475 /nfs/dbraw/zinc/00/84/75/1095008475.db2.gz TXYMCUBIQILTSW-FUHWJXTLSA-N 1 3 349.494 2.890 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)CC1CCN(C(=O)[C@@H]2CCCCN2CC)CC1 ZINC001481521677 1095090048 /nfs/dbraw/zinc/09/00/48/1095090048.db2.gz NFWQJEVRLNZNDW-MSOLQXFVSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)CC1CCN(C(=O)[C@@H]2CCCCN2CC)CC1 ZINC001481521677 1095090062 /nfs/dbraw/zinc/09/00/62/1095090062.db2.gz NFWQJEVRLNZNDW-MSOLQXFVSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@H](C[NH2+]CCCc1ccccc1)N(C)C(=O)C1(N(C)C)CCC1 ZINC001268069485 1095161304 /nfs/dbraw/zinc/16/13/04/1095161304.db2.gz XJUAAEQCCAYLNL-QGZVFWFLSA-N 1 3 331.504 2.540 10 0 EFAEHO C[C@@H](CNCC=C(Cl)Cl)N(C)C(=O)CCC[NH+]1CCCC1 ZINC001268099909 1095351809 /nfs/dbraw/zinc/35/18/09/1095351809.db2.gz RFSLUSGUNFQFCE-ZDUSSCGKSA-N 1 3 336.307 2.618 10 0 EFAEHO CC/C=C\CC[NH2+][C@@H]1CCN(C(=O)CN2CCC(C)CC2)C[C@@H]1C ZINC001268137510 1095474888 /nfs/dbraw/zinc/47/48/88/1095474888.db2.gz HWUAYIATURFKQH-ZYHOBAKYSA-N 1 3 335.536 2.901 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@H]1CC[NH2+]CCc1cccs1 ZINC001268151460 1095538577 /nfs/dbraw/zinc/53/85/77/1095538577.db2.gz PTMUWIBGEJZRMZ-WMZOPIPTSA-N 1 3 349.544 2.746 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H]1CC[N@H+](CC2=CCCCC2)C1 ZINC001267566256 1095583226 /nfs/dbraw/zinc/58/32/26/1095583226.db2.gz BRNRUMWFGSTGMP-QGZVFWFLSA-N 1 3 330.476 2.589 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H]1CC[N@@H+](CC2=CCCCC2)C1 ZINC001267566256 1095583237 /nfs/dbraw/zinc/58/32/37/1095583237.db2.gz BRNRUMWFGSTGMP-QGZVFWFLSA-N 1 3 330.476 2.589 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@@H]1CC[NH2+]CCc1ccccc1 ZINC001268160335 1095592876 /nfs/dbraw/zinc/59/28/76/1095592876.db2.gz HRBKLXXIZOZFBL-LJQANCHMSA-N 1 3 340.471 2.556 10 0 EFAEHO CCN(CCNC(=O)CC[C@@H]1CCC[N@@H+]1C)Cc1cccc(C)c1 ZINC001480980334 1095651271 /nfs/dbraw/zinc/65/12/71/1095651271.db2.gz MLRGOIZMQPXGQV-IBGZPJMESA-N 1 3 331.504 2.808 10 0 EFAEHO CCN(CCNC(=O)CC[C@@H]1CCC[N@H+]1C)Cc1cccc(C)c1 ZINC001480980334 1095651276 /nfs/dbraw/zinc/65/12/76/1095651276.db2.gz MLRGOIZMQPXGQV-IBGZPJMESA-N 1 3 331.504 2.808 10 0 EFAEHO CCN(CCNC(=O)[C@@H](C(C)C)[NH+]1CCCC1)Cc1ccc(F)cc1 ZINC001481019615 1095884458 /nfs/dbraw/zinc/88/44/58/1095884458.db2.gz YZPAHIAYBSRZIV-LJQANCHMSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]1CCC[N@@H+]1CCCCCF ZINC001481041170 1096124293 /nfs/dbraw/zinc/12/42/93/1096124293.db2.gz ZPBPEAIXVKSPQN-IAGOWNOFSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]1CCC[N@H+]1CCCCCF ZINC001481041170 1096124299 /nfs/dbraw/zinc/12/42/99/1096124299.db2.gz ZPBPEAIXVKSPQN-IAGOWNOFSA-N 1 3 327.488 2.580 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H]3[C@H](CC[N@@H+]3CCCCCF)C2)CCC1 ZINC001268265942 1096212455 /nfs/dbraw/zinc/21/24/55/1096212455.db2.gz YFMXMAMYFQFRNS-IAGOWNOFSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3CCCCCF)C2)CCC1 ZINC001268265942 1096212462 /nfs/dbraw/zinc/21/24/62/1096212462.db2.gz YFMXMAMYFQFRNS-IAGOWNOFSA-N 1 3 339.499 2.533 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NCC1CN([C@@H]2CCc3ccccc32)C1 ZINC001481669016 1096273626 /nfs/dbraw/zinc/27/36/26/1096273626.db2.gz CASNLJLVKWZTQN-HXUWFJFHSA-N 1 3 341.499 2.598 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccccc1Cl)NC(=O)CN1CC[C@@H](C)C1 ZINC001268399708 1096492640 /nfs/dbraw/zinc/49/26/40/1096492640.db2.gz KBHIIHFRRQFKSS-CABCVRRESA-N 1 3 337.895 2.666 10 0 EFAEHO C[C@@H](CC[NH2+]CC1CCC(F)(F)CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001268399983 1096494187 /nfs/dbraw/zinc/49/41/87/1096494187.db2.gz OVZUOGPXTMPPPH-GJZGRUSLSA-N 1 3 345.478 2.638 10 0 EFAEHO C[C@H](CC[NH2+]CC1CCC(F)(F)CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001268399985 1096494268 /nfs/dbraw/zinc/49/42/68/1096494268.db2.gz OVZUOGPXTMPPPH-LSDHHAIUSA-N 1 3 345.478 2.638 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@@H](C)NC(=O)CN(C)CC(C)(C)C)c1 ZINC001268401264 1096495945 /nfs/dbraw/zinc/49/59/45/1096495945.db2.gz AJFZDAADVKSUQR-QGZVFWFLSA-N 1 3 333.520 2.957 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1CC[C@H](N(C)C(=O)C(C)(C)c2c[nH]cn2)C1 ZINC001481746207 1096503335 /nfs/dbraw/zinc/50/33/35/1096503335.db2.gz BPYDOIPXZHFJLI-HOTGVXAUSA-N 1 3 334.508 2.902 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1CC[C@H](N(C)C(=O)C(C)(C)c2c[nH]cn2)C1 ZINC001481746207 1096503341 /nfs/dbraw/zinc/50/33/41/1096503341.db2.gz BPYDOIPXZHFJLI-HOTGVXAUSA-N 1 3 334.508 2.902 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1cccc(F)c1)NC(=O)CN(C)CC(C)(C)C ZINC001268403632 1096504100 /nfs/dbraw/zinc/50/41/00/1096504100.db2.gz JWSYKQITKXFACY-HNNXBMFYSA-N 1 3 337.483 2.788 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc2ncccc2c1)N(C)C ZINC001268403187 1096505887 /nfs/dbraw/zinc/50/58/87/1096505887.db2.gz JBYWQKDEHSFBIF-BEFAXECRSA-N 1 3 342.487 2.559 10 0 EFAEHO CN(C(=O)C[C@@H]1CC[N@H+](C)C1)[C@H]1CCN(CCCCC(F)(F)F)C1 ZINC001481747173 1096508912 /nfs/dbraw/zinc/50/89/12/1096508912.db2.gz NHFXTTLYLSFVJG-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO CN(C(=O)C[C@@H]1CC[N@@H+](C)C1)[C@H]1CCN(CCCCC(F)(F)F)C1 ZINC001481747173 1096508917 /nfs/dbraw/zinc/50/89/17/1096508917.db2.gz NHFXTTLYLSFVJG-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@@H+](C(C)C)C1 ZINC001481775105 1096674055 /nfs/dbraw/zinc/67/40/55/1096674055.db2.gz RJGKNDWQPXLKKT-YJBOKZPZSA-N 1 3 327.488 2.530 10 0 EFAEHO CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@H+](C(C)C)C1 ZINC001481775105 1096674057 /nfs/dbraw/zinc/67/40/57/1096674057.db2.gz RJGKNDWQPXLKKT-YJBOKZPZSA-N 1 3 327.488 2.530 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)NCC=C(Cl)Cl ZINC001481844047 1096781180 /nfs/dbraw/zinc/78/11/80/1096781180.db2.gz LSKXOUOWALQILQ-AVGNSLFASA-N 1 3 336.307 2.520 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)NCC=C(Cl)Cl ZINC001481844047 1096781189 /nfs/dbraw/zinc/78/11/89/1096781189.db2.gz LSKXOUOWALQILQ-AVGNSLFASA-N 1 3 336.307 2.520 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cc2ccccc2o1 ZINC001481849507 1096792987 /nfs/dbraw/zinc/79/29/87/1096792987.db2.gz DBYRTLOUPWKQAI-WBVHZDCISA-N 1 3 343.471 2.759 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(C)c(C)c1 ZINC001481850278 1096795060 /nfs/dbraw/zinc/79/50/60/1096795060.db2.gz JTBHGDLZIWZTIH-BEFAXECRSA-N 1 3 331.504 2.630 10 0 EFAEHO C[NH+](C)CCCC(=O)NC1(CNCC=C(Cl)Cl)CCCC1 ZINC001481904639 1096898283 /nfs/dbraw/zinc/89/82/83/1096898283.db2.gz MZIOHLKHXKHRJS-UHFFFAOYSA-N 1 3 336.307 2.666 10 0 EFAEHO CCN(CC[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1)C(=O)CN1CCC(C)CC1 ZINC001268486824 1096938949 /nfs/dbraw/zinc/93/89/49/1096938949.db2.gz MZURWEVMKWAMMX-CEXWTWQISA-N 1 3 335.536 2.593 10 0 EFAEHO CCN(CC[NH2+]CC1CCC(C)CC1)C(=O)[C@@H](C(C)C)N(C)C ZINC001268492855 1096964613 /nfs/dbraw/zinc/96/46/13/1096964613.db2.gz BIRHHNGMDBCQCF-DAWZGUTISA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)(C(=O)N1CCC[C@@H](CC[NH2+]CCCF)C1)N1CCCCC1 ZINC001481975336 1097032139 /nfs/dbraw/zinc/03/21/39/1097032139.db2.gz SGEJPYBXHLPRQB-KRWDZBQOSA-N 1 3 341.515 2.829 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC(CC[NH2+]CC2CCCC2)CC1)N(C)C ZINC001482004009 1097078258 /nfs/dbraw/zinc/07/82/58/1097078258.db2.gz NCJPSIZGOLMXDW-LJQANCHMSA-N 1 3 337.552 2.981 10 0 EFAEHO CN1CCC[C@H]1C(=O)NC/C=C\C[NH2+]CCCc1ccccc1Cl ZINC001268522106 1097123343 /nfs/dbraw/zinc/12/33/43/1097123343.db2.gz JQVDVAWNGBNFPO-XDXAGZTOSA-N 1 3 349.906 2.629 10 0 EFAEHO CC(C)=CC[NH2+]Cc1ccc(CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001482034709 1097131867 /nfs/dbraw/zinc/13/18/67/1097131867.db2.gz YCVNKQQXSHUKOB-QGZVFWFLSA-N 1 3 329.488 2.700 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\C[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001268551789 1097176948 /nfs/dbraw/zinc/17/69/48/1097176948.db2.gz KDLQYEZCGXLCPE-XFHJGTJQSA-N 1 3 335.536 2.805 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]C/C=C/CNC(=O)[C@H](C(C)C)N(C)C ZINC001268552649 1097177780 /nfs/dbraw/zinc/17/77/80/1097177780.db2.gz RRDONWOQSCMKQQ-OYEZICKXSA-N 1 3 331.504 2.904 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC1CC[NH+](Cc2ccsc2)CC1 ZINC001482051809 1097185520 /nfs/dbraw/zinc/18/55/20/1097185520.db2.gz PERDUOWJULFTNY-UHFFFAOYSA-N 1 3 337.533 2.807 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]1C[NH2+]CCc1ccccc1Cl ZINC001482054372 1097188981 /nfs/dbraw/zinc/18/89/81/1097188981.db2.gz NDCPAWYZHARBEH-AEFFLSMTSA-N 1 3 349.906 2.557 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)C[NH2+]C/C=C\c1ccccc1 ZINC001482101050 1097258436 /nfs/dbraw/zinc/25/84/36/1097258436.db2.gz KMPDMOPUINKVRO-PJKWBFRZSA-N 1 3 343.515 2.915 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)C[NH2+]C/C=C/c1ccccc1 ZINC001482101052 1097258467 /nfs/dbraw/zinc/25/84/67/1097258467.db2.gz KMPDMOPUINKVRO-ZPPSIVDRSA-N 1 3 343.515 2.915 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC/C=C/CNCc2ccc(CF)cc2)CC[N@@H+]1C ZINC001268582254 1097283721 /nfs/dbraw/zinc/28/37/21/1097283721.db2.gz NLOVEDRHUFUHTB-YKTDSXCKSA-N 1 3 347.478 2.648 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC/C=C/CNCc2ccc(CF)cc2)CC[N@H+]1C ZINC001268582254 1097283722 /nfs/dbraw/zinc/28/37/22/1097283722.db2.gz NLOVEDRHUFUHTB-YKTDSXCKSA-N 1 3 347.478 2.648 10 0 EFAEHO C[C@@H](NC/C=C/CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(F)c1 ZINC001268584365 1097291258 /nfs/dbraw/zinc/29/12/58/1097291258.db2.gz YTVFZASCFNKGNK-KJOHKCLLSA-N 1 3 347.478 2.879 10 0 EFAEHO C[C@@H](NC/C=C/CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(F)c1 ZINC001268584365 1097291263 /nfs/dbraw/zinc/29/12/63/1097291263.db2.gz YTVFZASCFNKGNK-KJOHKCLLSA-N 1 3 347.478 2.879 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC/C=C\C[NH2+]CCC2CCCCCC2)C1 ZINC001268591785 1097315107 /nfs/dbraw/zinc/31/51/07/1097315107.db2.gz UHQSMOFOXAYOOU-HPFMTEOYSA-N 1 3 335.536 2.951 10 0 EFAEHO Cc1cc(Cl)ccc1CNC/C=C\CNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001268612619 1097461208 /nfs/dbraw/zinc/46/12/08/1097461208.db2.gz GXCXXANCAJGHMU-MJSXRHKHSA-N 1 3 349.906 2.752 10 0 EFAEHO Cc1cc(Cl)ccc1CNC/C=C\CNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001268612619 1097461213 /nfs/dbraw/zinc/46/12/13/1097461213.db2.gz GXCXXANCAJGHMU-MJSXRHKHSA-N 1 3 349.906 2.752 10 0 EFAEHO CC[C@H](C(=O)NC/C=C/C[NH2+][C@@H](C)c1ccc2c(c1)CCC2)N(C)C ZINC001268615994 1097465301 /nfs/dbraw/zinc/46/53/01/1097465301.db2.gz FKFBVJHAUYJIER-AIRUHKMPSA-N 1 3 343.515 2.839 10 0 EFAEHO CC(C)(C)c1ccc(C[NH2+]C/C=C\CNC(=O)CN2CCCC2)cc1 ZINC001268625284 1097478856 /nfs/dbraw/zinc/47/88/56/1097478856.db2.gz MLOXJWFLANWMKQ-PLNGDYQASA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)C[NH+]2[C@H](C)CC[C@H]2C)c(C)s1 ZINC001268629326 1097483319 /nfs/dbraw/zinc/48/33/19/1097483319.db2.gz VMGYCDUSDHBCHL-XEVLESSRSA-N 1 3 349.544 3.000 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/CNCc1cccc(F)c1)[NH+]1CCCC1 ZINC001268630150 1097484011 /nfs/dbraw/zinc/48/40/11/1097484011.db2.gz GFPHLJFFQDMGEB-RTLBZRNLSA-N 1 3 347.478 2.708 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C[NH2+]C/C=C\c1ccc(Cl)cc1)N(C)C ZINC001268661726 1097515776 /nfs/dbraw/zinc/51/57/76/1097515776.db2.gz HGHXIVWBIQFKNV-FRAJWHGFSA-N 1 3 337.895 2.788 10 0 EFAEHO CCc1cccc(C[NH2+]CCCN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001268797547 1097644266 /nfs/dbraw/zinc/64/42/66/1097644266.db2.gz RLCWJMUVWOJQDW-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)[C@H]1CCCN1C)c1cc(F)ccc1F ZINC001268812266 1097660502 /nfs/dbraw/zinc/66/05/02/1097660502.db2.gz UCEIRVCVHHAERD-CXAGYDPISA-N 1 3 339.430 2.558 10 0 EFAEHO CN(CCC[NH2+]Cc1cc2ccccc2s1)C(=O)Cc1c[nH]cn1 ZINC001268860976 1097690571 /nfs/dbraw/zinc/69/05/71/1097690571.db2.gz MTDCRKLSPDBJLD-UHFFFAOYSA-N 1 3 342.468 2.805 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001269114287 1097866295 /nfs/dbraw/zinc/86/62/95/1097866295.db2.gz AVUYLEIVGRWRBU-QFBILLFUSA-N 1 3 339.499 2.650 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN2CCC(C)CC2)CC[C@@H]1[NH2+]CC=C(C)C ZINC001269183796 1097929377 /nfs/dbraw/zinc/92/93/77/1097929377.db2.gz VZGRSRTYLQFVDX-MOPGFXCFSA-N 1 3 335.536 2.901 10 0 EFAEHO CC[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC=C(C)C ZINC001269471116 1098164220 /nfs/dbraw/zinc/16/42/20/1098164220.db2.gz FYFNSVATYIHVAS-QAPCUYQASA-N 1 3 327.488 2.650 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H](CC[NH2+]Cc2ccsc2)C1 ZINC001269712026 1098388460 /nfs/dbraw/zinc/38/84/60/1098388460.db2.gz NHUNIWNAASJEIA-RDJZCZTQSA-N 1 3 335.517 2.561 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](CC[NH2+]Cc2ccsc2)C1 ZINC001269792271 1098447731 /nfs/dbraw/zinc/44/77/31/1098447731.db2.gz SBZABZXUBMHGLO-INIZCTEOSA-N 1 3 337.533 2.808 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C[NH2+]CCC(F)(F)F)C(C)(C)C)N(C)C ZINC001284643308 1098462611 /nfs/dbraw/zinc/46/26/11/1098462611.db2.gz LRKHUZAKHOAOOA-QWHCGFSZSA-N 1 3 339.446 2.646 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C[NH2+]CCC(F)(F)F)C(C)(C)C)N(C)C ZINC001284643307 1098462677 /nfs/dbraw/zinc/46/26/77/1098462677.db2.gz LRKHUZAKHOAOOA-OLZOCXBDSA-N 1 3 339.446 2.646 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[NH2+]CCc2ccccc2)CC1)N(C)C ZINC001269935175 1098531475 /nfs/dbraw/zinc/53/14/75/1098531475.db2.gz LLARDWAPYFQNOA-HXUWFJFHSA-N 1 3 345.531 2.788 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC(CC[NH2+]Cc3ccsc3)CC2)C1 ZINC001267914296 1098614487 /nfs/dbraw/zinc/61/44/87/1098614487.db2.gz FCHDFGJDHXXACL-INIZCTEOSA-N 1 3 349.544 2.808 10 0 EFAEHO CC1CCN(CC(=O)N2CCC(CC[NH2+]CC3CCC3)CC2)CC1 ZINC001267916618 1098626036 /nfs/dbraw/zinc/62/60/36/1098626036.db2.gz FIECLZVXZGFEHP-UHFFFAOYSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[NH2+]Cc2ccc(F)cc2)CC1)N(C)C ZINC001267917620 1098638865 /nfs/dbraw/zinc/63/88/65/1098638865.db2.gz NMAVTXNENJLOOA-LJQANCHMSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@@H](C(=O)NCc1ccc(C[NH2+]CCC(F)(F)F)cc1)N(C)C ZINC001270082461 1098672828 /nfs/dbraw/zinc/67/28/28/1098672828.db2.gz YBFDAVBKEPNHAP-HNNXBMFYSA-N 1 3 345.409 2.685 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H]2C[NH2+]CCC2=CCCCC2)C1 ZINC001270263881 1098879763 /nfs/dbraw/zinc/87/97/63/1098879763.db2.gz ZVZHWFFELXCMII-IEBWSBKVSA-N 1 3 333.520 2.799 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC2(C1)CCN(C(=O)[C@H]1CCCN1C)CC2 ZINC001267974320 1099036136 /nfs/dbraw/zinc/03/61/36/1099036136.db2.gz UINIRDMQONFDTP-SHCNBLLESA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC2(C1)CCN(C(=O)[C@H]1CCCN1C)CC2 ZINC001267974320 1099036147 /nfs/dbraw/zinc/03/61/47/1099036147.db2.gz UINIRDMQONFDTP-SHCNBLLESA-N 1 3 333.520 2.751 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001482285187 1099039759 /nfs/dbraw/zinc/03/97/59/1099039759.db2.gz UQTHKOBTLBTASH-MAUKXSAKSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001482285187 1099039774 /nfs/dbraw/zinc/03/97/74/1099039774.db2.gz UQTHKOBTLBTASH-MAUKXSAKSA-N 1 3 335.467 2.635 10 0 EFAEHO CCc1cccc(C[NH2+]CCN(C)C(=O)CN2CCC(C)CC2)c1 ZINC001481294965 1099101600 /nfs/dbraw/zinc/10/16/00/1099101600.db2.gz KOPKNLXNAUYUGR-UHFFFAOYSA-N 1 3 331.504 2.529 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001268002747 1099140259 /nfs/dbraw/zinc/14/02/59/1099140259.db2.gz DNIZQUHFZPJCDM-YJBOKZPZSA-N 1 3 327.488 2.507 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC([C@H](C)[NH2+]CCC2CC2)CC1 ZINC001481341906 1099376569 /nfs/dbraw/zinc/37/65/69/1099376569.db2.gz BHITYWDOJCXLKW-QFBILLFUSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](CC[NH2+]CCC2CCCC2)C1)N(C)C ZINC001280264578 1099381415 /nfs/dbraw/zinc/38/14/15/1099381415.db2.gz YOZFGAWNLZPXJO-OALUTQOASA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1ccccc1F ZINC001481355128 1099439920 /nfs/dbraw/zinc/43/99/20/1099439920.db2.gz WKXZGYXWLCXDBJ-KRWDZBQOSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1ccccc1F ZINC001481355128 1099439928 /nfs/dbraw/zinc/43/99/28/1099439928.db2.gz WKXZGYXWLCXDBJ-KRWDZBQOSA-N 1 3 349.494 2.884 10 0 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1102445628 /nfs/dbraw/zinc/44/56/28/1102445628.db2.gz XTLGBEFVFCMFNO-FUHWJXTLSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@H+](CCCCCF)C1)N1CCCCC1 ZINC001266514694 1102461392 /nfs/dbraw/zinc/46/13/92/1102461392.db2.gz UNMJWEFTLSNFJD-QGZVFWFLSA-N 1 3 341.515 2.829 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@@H+](CCCCCF)C1)N1CCCCC1 ZINC001266514694 1102461400 /nfs/dbraw/zinc/46/14/00/1102461400.db2.gz UNMJWEFTLSNFJD-QGZVFWFLSA-N 1 3 341.515 2.829 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@@H]1C[NH2+]C/C=C\c1ccccc1 ZINC001266865308 1102516706 /nfs/dbraw/zinc/51/67/06/1102516706.db2.gz SFQLTQUMLPRYQR-RHHFQONYSA-N 1 3 341.499 2.765 10 0 EFAEHO OC1(C[NH2+]CCOc2ccccc2)CCN(Cc2ccccc2)CC1 ZINC000397607017 1102533926 /nfs/dbraw/zinc/53/39/26/1102533926.db2.gz QBMADQONKZPFAU-UHFFFAOYSA-N 1 3 340.467 2.682 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCCC[C@@H]1C[NH2+]CCCF ZINC001266877748 1102569080 /nfs/dbraw/zinc/56/90/80/1102569080.db2.gz LTCDYPRZHOGDPK-SJORKVTESA-N 1 3 327.488 2.580 10 0 EFAEHO 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1103545366 /nfs/dbraw/zinc/54/53/66/1103545366.db2.gz VMDFQJKXUYUPCZ-UWVAXJGDSA-N 1 3 345.531 2.916 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(C(F)F)c1)NC(=O)CC[NH+](C)C ZINC001483380310 1103547094 /nfs/dbraw/zinc/54/70/94/1103547094.db2.gz BCBGBJMBMSVPLK-CYBMUJFWSA-N 1 3 327.419 2.512 10 0 EFAEHO C[C@H](CN(C)[C@H]1CCc2c1cccc2F)NC(=O)CCCC[NH+](C)C ZINC001483407353 1103628339 /nfs/dbraw/zinc/62/83/39/1103628339.db2.gz BLTWFAWPKCZMAX-BEFAXECRSA-N 1 3 349.494 2.981 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@H+](C)CCc1ccccc1F ZINC001483421041 1103672323 /nfs/dbraw/zinc/67/23/23/1103672323.db2.gz NTRZWQRCTSUOCN-LPHOPBHVSA-N 1 3 349.494 2.679 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCc1ccccc1F ZINC001483421041 1103672327 /nfs/dbraw/zinc/67/23/27/1103672327.db2.gz NTRZWQRCTSUOCN-LPHOPBHVSA-N 1 3 349.494 2.679 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](C[NH2+]CCCCc2ccccc2)C1 ZINC001662607572 1103728450 /nfs/dbraw/zinc/72/84/50/1103728450.db2.gz GSTGUJHBGPYKJC-VQTJNVASSA-N 1 3 343.515 2.542 10 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1104008260 /nfs/dbraw/zinc/00/82/60/1104008260.db2.gz LQVSEKFVERKOAR-GUYCJALGSA-N 1 3 337.895 2.837 10 0 EFAEHO C[C@H](NC[C@@H](NC(=O)CC[NH+](C)C)C1CC1)c1ccccc1Cl ZINC001483585948 1104008327 /nfs/dbraw/zinc/00/83/27/1104008327.db2.gz LQVSEKFVERKOAR-SUMWQHHRSA-N 1 3 337.895 2.837 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H]1C[NH2+]CCc1cccs1 ZINC001671389140 1104208162 /nfs/dbraw/zinc/20/81/62/1104208162.db2.gz IJLVQGBWZSMAAG-FUHWJXTLSA-N 1 3 349.544 2.746 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)[C@@H]3CCC=CCCC3)CC2)CC1 ZINC000906467325 1104230879 /nfs/dbraw/zinc/23/08/79/1104230879.db2.gz YDZURTUZNSZNCO-QGZVFWFLSA-N 1 3 333.520 2.798 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N(C)CCNCc1cc(C)ccc1F ZINC001663967910 1104251675 /nfs/dbraw/zinc/25/16/75/1104251675.db2.gz KRGPWOJTZKTWAD-SFHVURJKSA-N 1 3 335.467 2.557 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N(C)CCNCc1cc(C)ccc1F ZINC001663967910 1104251681 /nfs/dbraw/zinc/25/16/81/1104251681.db2.gz KRGPWOJTZKTWAD-SFHVURJKSA-N 1 3 335.467 2.557 10 0 EFAEHO 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3 337.552 2.981 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[N@@H+](C)CC1CCC(C)(C)CC1 ZINC001409612554 1104506928 /nfs/dbraw/zinc/50/69/28/1104506928.db2.gz CKFKLJRGNLNBGZ-IAGOWNOFSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccccc1CCC[N@@H+](C)[C@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001409614608 1104512237 /nfs/dbraw/zinc/51/22/37/1104512237.db2.gz GREJAAKFARVLGC-IEBWSBKVSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccccc1CCC[N@H+](C)[C@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001409614608 1104512246 /nfs/dbraw/zinc/51/22/46/1104512246.db2.gz GREJAAKFARVLGC-IEBWSBKVSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@@H](CNC(=O)CC[NH+](C)C)N(C)C/C=C/c1ccc(Cl)cc1 ZINC001409618335 1104531233 /nfs/dbraw/zinc/53/12/33/1104531233.db2.gz CMDCYEWLAZWARF-NFAHFFEMSA-N 1 3 337.895 2.741 10 0 EFAEHO CCCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(C[NH+](C)C)cc1 ZINC001665416874 1104688954 /nfs/dbraw/zinc/68/89/54/1104688954.db2.gz OYBFYPZQVJNGDS-OALUTQOASA-N 1 3 329.488 2.837 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@@H]21 ZINC001482660604 1104754217 /nfs/dbraw/zinc/75/42/17/1104754217.db2.gz ZKZBMORLZFZFLW-VGRIIWOTSA-N 1 3 333.520 2.750 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@@H]21 ZINC001482660604 1104754222 /nfs/dbraw/zinc/75/42/22/1104754222.db2.gz ZKZBMORLZFZFLW-VGRIIWOTSA-N 1 3 333.520 2.750 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)CC[C@H]32)c1 ZINC001482667261 1104805531 /nfs/dbraw/zinc/80/55/31/1104805531.db2.gz SBFHEGNXCWFVNZ-WOJBJXKFSA-N 1 3 343.515 2.758 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)CC[C@H]32)c1 ZINC001482667261 1104805541 /nfs/dbraw/zinc/80/55/41/1104805541.db2.gz SBFHEGNXCWFVNZ-WOJBJXKFSA-N 1 3 343.515 2.758 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1(C[NH2+]CCCC2CCC2)CCCC1 ZINC001665959643 1104815799 /nfs/dbraw/zinc/81/57/99/1104815799.db2.gz RCWVDWLJAOJLGP-UHFFFAOYSA-N 1 3 332.492 2.860 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@]1(C[NH2+]C/C=C/Cl)CCCC[C@H]1C ZINC001666068767 1104848449 /nfs/dbraw/zinc/84/84/49/1104848449.db2.gz OCIGFELCZDDTGE-WNEOQSQQSA-N 1 3 329.916 2.734 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](CC[NH2+]Cc2ccc(F)cc2)C1 ZINC001666168026 1104891525 /nfs/dbraw/zinc/89/15/25/1104891525.db2.gz RWHCEJOAKBXFLT-SFHVURJKSA-N 1 3 349.494 2.886 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@H]2CC[C@H]([NH2+]CCCC3CCC3)CC2)C1 ZINC001666306694 1104922809 /nfs/dbraw/zinc/92/28/09/1104922809.db2.gz UIXHVDODGPSPSY-WDSOQIARSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H]1CCC[C@H]1NC(=O)CN(C)C(C)C ZINC001482698412 1104954832 /nfs/dbraw/zinc/95/48/32/1104954832.db2.gz KWCULQCFJPTJKR-RBUKOAKNSA-N 1 3 331.504 2.710 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]C/C=C/c1ccccc1 ZINC001666599379 1104967935 /nfs/dbraw/zinc/96/79/35/1104967935.db2.gz FKZPUIRXCVHBNX-ZPHJMFTNSA-N 1 3 343.515 2.916 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]C/C=C\c1ccccc1 ZINC001666599380 1104968036 /nfs/dbraw/zinc/96/80/36/1104968036.db2.gz FKZPUIRXCVHBNX-ZVBPTUHVSA-N 1 3 343.515 2.916 10 0 EFAEHO CCCCC[NH2+][C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1C ZINC001667196849 1105075998 /nfs/dbraw/zinc/07/59/98/1105075998.db2.gz DSLHLUKFYOJGSY-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccccc1Cl)N(C)C ZINC001482843867 1105084705 /nfs/dbraw/zinc/08/47/05/1105084705.db2.gz JNVLCFNBOJXGKX-YOEHRIQHSA-N 1 3 339.911 2.911 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CC[NH2+]Cc1cccc(OC)c1 ZINC001482900768 1105144945 /nfs/dbraw/zinc/14/49/45/1105144945.db2.gz GNMFJIHTBCVASR-APWZRJJASA-N 1 3 347.503 2.554 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001482888916 1105147516 /nfs/dbraw/zinc/14/75/16/1105147516.db2.gz NJNPALDOACURGE-YOEHRIQHSA-N 1 3 339.911 2.911 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(Cl)s1)C(=O)[C@@H]1CCCCN1C ZINC001482944457 1105225997 /nfs/dbraw/zinc/22/59/97/1105225997.db2.gz FVYLMQHFHZXSIM-AWEZNQCLSA-N 1 3 343.924 2.824 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)cc1C)C(=O)CN1CC[C@@H](C)C1 ZINC001482950069 1105246474 /nfs/dbraw/zinc/24/64/74/1105246474.db2.gz DQTDNBNOOACTTB-QGZVFWFLSA-N 1 3 331.504 2.583 10 0 EFAEHO CCN(CC[NH2+]Cc1c(C)cc(C)cc1C)C(=O)CN1CC[C@H](C)C1 ZINC001482950070 1105246719 /nfs/dbraw/zinc/24/67/19/1105246719.db2.gz DSRSWVBXIUMMNQ-INIZCTEOSA-N 1 3 345.531 2.892 10 0 EFAEHO CCN(CC[NH2+]Cc1ccccc1C)C(=O)CN(C)CC(C)(C)C ZINC001482950092 1105246992 /nfs/dbraw/zinc/24/69/92/1105246992.db2.gz FKYPVQJKKNBVBD-UHFFFAOYSA-N 1 3 333.520 2.911 10 0 EFAEHO CCc1ccc(C[NH2+]CC[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001668215153 1105259026 /nfs/dbraw/zinc/25/90/26/1105259026.db2.gz XFDUGVJEFWILPS-IAGOWNOFSA-N 1 3 331.504 2.575 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1ccsc1 ZINC001668234271 1105263015 /nfs/dbraw/zinc/26/30/15/1105263015.db2.gz HGBDFHUQNHAKKA-DOTOQJQBSA-N 1 3 337.533 2.995 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCc2ccc(F)cc21)C(=O)CN(C)C(C)C ZINC001482969848 1105271345 /nfs/dbraw/zinc/27/13/45/1105271345.db2.gz LUEYHPWAFJCQCW-GOSISDBHSA-N 1 3 335.467 2.591 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cc2ccccc2o1)N(C)C ZINC001668279265 1105272062 /nfs/dbraw/zinc/27/20/62/1105272062.db2.gz QWVUUWCFBQFKOC-WMLDXEAASA-N 1 3 331.460 2.757 10 0 EFAEHO CCN(CC[NH2+]CC1CC(C)C1)C(=O)c1cccc(CN(C)C)c1 ZINC001482970271 1105272449 /nfs/dbraw/zinc/27/24/49/1105272449.db2.gz RALLFVZVSCIQJC-UHFFFAOYSA-N 1 3 331.504 2.846 10 0 EFAEHO CCc1ccc(C[NH2+]CC[C@@H](C)NC(=O)Cc2nc[nH]c2C)cc1 ZINC001668287723 1105273916 /nfs/dbraw/zinc/27/39/16/1105273916.db2.gz BIJNLPUOGZBXTG-CQSZACIVSA-N 1 3 328.460 2.508 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H](C)NC(=O)CN(C)C(C)C)c(C)s1 ZINC001668319324 1105280141 /nfs/dbraw/zinc/28/01/41/1105280141.db2.gz FZFLPWQXNWEHPZ-CYBMUJFWSA-N 1 3 325.522 2.690 10 0 EFAEHO CCN(CCNCc1ccc(Cl)s1)C(=O)C1(C[NH+](C)C)CC1 ZINC001668533767 1105315437 /nfs/dbraw/zinc/31/54/37/1105315437.db2.gz QFXWRVRUVSWRAU-UHFFFAOYSA-N 1 3 343.924 2.681 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C/C=C\CNC(=O)[C@@H]2CCCN2C)c1 ZINC001668746444 1105361219 /nfs/dbraw/zinc/36/12/19/1105361219.db2.gz YIACXAUWQQMJQE-HGFKVBKKSA-N 1 3 329.488 2.721 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/C[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001669027012 1105420302 /nfs/dbraw/zinc/42/03/02/1105420302.db2.gz KDLQYEZCGXLCPE-DUMMIQTOSA-N 1 3 335.536 2.805 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C/C=C\CNC(=O)CN1CC[C@H](C)C1 ZINC001669040507 1105422726 /nfs/dbraw/zinc/42/27/26/1105422726.db2.gz XBAWHTIOODVNMB-KINGKOSLSA-N 1 3 329.488 2.660 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)NC/C=C/CNCc1ccsc1 ZINC001669074807 1105429970 /nfs/dbraw/zinc/42/99/70/1105429970.db2.gz DZNFDSGCGLTMEV-LAQIPUCWSA-N 1 3 335.517 2.773 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)NC/C=C/CNCc1ccsc1 ZINC001669074807 1105429972 /nfs/dbraw/zinc/42/99/72/1105429972.db2.gz DZNFDSGCGLTMEV-LAQIPUCWSA-N 1 3 335.517 2.773 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC/C=C\C[NH2+]Cc1c(C)cccc1C ZINC001669206717 1105457275 /nfs/dbraw/zinc/45/72/75/1105457275.db2.gz GPFKHOVRRHMYDH-HCZHMGAMSA-N 1 3 343.515 2.940 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H](C)NC(=O)C(C)(C)N2CCCCC2)cc1 ZINC001669559691 1105496439 /nfs/dbraw/zinc/49/64/39/1105496439.db2.gz YZJBDZGLLNYOFS-SFHVURJKSA-N 1 3 345.531 2.896 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]C/C=C/c1ccccc1 ZINC001669750115 1105514511 /nfs/dbraw/zinc/51/45/11/1105514511.db2.gz DYIZRRYGBLYCFW-SCLHNIASSA-N 1 3 329.488 2.669 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC/C=C\CNCc1cccc(Cl)c1 ZINC001483016538 1105555273 /nfs/dbraw/zinc/55/52/73/1105555273.db2.gz RTTWOOQNQSFFNM-DDKKJVIOSA-N 1 3 349.906 2.976 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC/C=C\CNCc1cccc(Cl)c1 ZINC001483016538 1105555279 /nfs/dbraw/zinc/55/52/79/1105555279.db2.gz RTTWOOQNQSFFNM-DDKKJVIOSA-N 1 3 349.906 2.976 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N(C)CCC[NH2+]CC2CCCC2)c1 ZINC001670357961 1105624228 /nfs/dbraw/zinc/62/42/28/1105624228.db2.gz XNPSAQPAFNIWBC-UHFFFAOYSA-N 1 3 331.504 2.990 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+]Cc1ccc2ncccc2c1 ZINC001670357717 1105624299 /nfs/dbraw/zinc/62/42/99/1105624299.db2.gz PAYPPVLSZUNDQV-UHFFFAOYSA-N 1 3 342.487 2.513 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@@H]2C[NH2+]CCCC2CCC2)CC1 ZINC001671359616 1105629649 /nfs/dbraw/zinc/62/96/49/1105629649.db2.gz LIMAPLSAPSNFOL-LJQANCHMSA-N 1 3 335.536 2.879 10 0 EFAEHO CCC/C=C\CC[NH+]1CCC(C)(NC(=O)Cc2nc[nH]c2C)CC1 ZINC001671437331 1105637003 /nfs/dbraw/zinc/63/70/03/1105637003.db2.gz RSPLBXRIYBDLBS-SREVYHEPSA-N 1 3 332.492 2.978 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@]1(C)CCC[N@H+](CCCCCF)C1 ZINC001671917118 1105731783 /nfs/dbraw/zinc/73/17/83/1105731783.db2.gz VRXDAAZOAGRXGV-SFHVURJKSA-N 1 3 338.471 2.619 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@]1(C)CCC[N@@H+](CCCCCF)C1 ZINC001671917118 1105731787 /nfs/dbraw/zinc/73/17/87/1105731787.db2.gz VRXDAAZOAGRXGV-SFHVURJKSA-N 1 3 338.471 2.619 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001672377334 1105817240 /nfs/dbraw/zinc/81/72/40/1105817240.db2.gz USSQZBZGWGIEAZ-XSLAGTTESA-N 1 3 341.515 2.589 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@H]2CN(CCC(F)(F)F)C[C@H]21 ZINC001672567919 1105874058 /nfs/dbraw/zinc/87/40/58/1105874058.db2.gz QIMBILGVNSTSMN-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](CC[NH2+]Cc2ccc(Cl)cc2)C1 ZINC001672761913 1105897418 /nfs/dbraw/zinc/89/74/18/1105897418.db2.gz RYRCOGWZPSEHPU-WMZOPIPTSA-N 1 3 349.906 2.762 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@H]1CCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001672805988 1105908166 /nfs/dbraw/zinc/90/81/66/1105908166.db2.gz RSIHBTVOBOSBOL-SFHVURJKSA-N 1 3 343.515 2.808 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H](CC[NH2+]Cc3ccsc3)C2)CCC1 ZINC001672806167 1105908566 /nfs/dbraw/zinc/90/85/66/1105908566.db2.gz TVHKQLVBQQBRGE-HNNXBMFYSA-N 1 3 335.517 2.561 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2ccccc2)C1)N(C)C ZINC001672857946 1105921702 /nfs/dbraw/zinc/92/17/02/1105921702.db2.gz GXPSOBPEYGFOTL-RTBURBONSA-N 1 3 331.504 2.601 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](CC[NH2+]Cc2ccccc2)C1)N(C)C ZINC001672857945 1105921950 /nfs/dbraw/zinc/92/19/50/1105921950.db2.gz GXPSOBPEYGFOTL-RBUKOAKNSA-N 1 3 331.504 2.601 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC[C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001672863571 1105923313 /nfs/dbraw/zinc/92/33/13/1105923313.db2.gz OMIDNTXPOJSNMR-JKSUJKDBSA-N 1 3 329.504 2.541 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC[C@@H]2CCN(C(=O)Cc3c[nH]cn3)C2)c1 ZINC001672867689 1105924651 /nfs/dbraw/zinc/92/46/51/1105924651.db2.gz DKUXAUPMYBDENI-QGZVFWFLSA-N 1 3 340.471 2.597 10 0 EFAEHO CC/C=C\CC[NH2+]CC[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001672884778 1105927870 /nfs/dbraw/zinc/92/78/70/1105927870.db2.gz DJKMYNAHHAVGPD-PHWHVTFISA-N 1 3 335.536 2.903 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+]CC2CCC(C)CC2)C1 ZINC001672902543 1105933462 /nfs/dbraw/zinc/93/34/62/1105933462.db2.gz RUKHGGOOPVMALL-ACBHZAAOSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1CC[C@H](C[NH2+]C/C=C\Cl)CC1 ZINC001672961100 1105949740 /nfs/dbraw/zinc/94/97/40/1105949740.db2.gz UPTCJVVCIDAGSP-JWMSWGABSA-N 1 3 341.927 2.876 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1CC[C@H](C[NH2+]C/C=C/Cl)CC1 ZINC001672961099 1105949871 /nfs/dbraw/zinc/94/98/71/1105949871.db2.gz UPTCJVVCIDAGSP-DRBHCFIDSA-N 1 3 341.927 2.876 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1CC[C@H](C[NH2+]CCC2CC2)CC1 ZINC001672995056 1105956185 /nfs/dbraw/zinc/95/61/85/1105956185.db2.gz RSJMRRJDNKGTCB-YOQCTACHSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1CC[C@H](C[NH2+]CCC2CC2)CC1 ZINC001672995055 1105956312 /nfs/dbraw/zinc/95/63/12/1105956312.db2.gz RSJMRRJDNKGTCB-PSBWJHGTSA-N 1 3 335.536 2.924 10 0 EFAEHO CCCCC[NH+]1CCC2(CN(C(=O)[C@@H]3CCCCN3CC)C2)CC1 ZINC001673021023 1105960515 /nfs/dbraw/zinc/96/05/15/1105960515.db2.gz HXXADUOEZKOFKY-SFHVURJKSA-N 1 3 335.536 2.975 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@@H]1Cc2ccccc2CN1CC1CC1 ZINC001673633820 1106060112 /nfs/dbraw/zinc/06/01/12/1106060112.db2.gz LDOHGMGLEAKDQU-FQEVSTJZSA-N 1 3 343.515 2.671 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)Cc1c[nH]cn1)[NH2+]CC1=CCCCC1 ZINC001675136428 1106306682 /nfs/dbraw/zinc/30/66/82/1106306682.db2.gz VLAIPHQJJNWNDC-GOSISDBHSA-N 1 3 332.492 2.915 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C)C1)C1C[NH+](CCC2=CCCCC2)C1 ZINC001675343905 1106344886 /nfs/dbraw/zinc/34/48/86/1106344886.db2.gz XPWDMQZNPJCKPO-SJORKVTESA-N 1 3 333.520 2.655 10 0 EFAEHO C[C@@H](CCC[NH2+]CCC1CC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001675973349 1106458169 /nfs/dbraw/zinc/45/81/69/1106458169.db2.gz JDCAERVGLDAUHV-KXBFYZLASA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+][C@H](C)c1ccccc1 ZINC001676014126 1106469239 /nfs/dbraw/zinc/46/92/39/1106469239.db2.gz ZOZFGMBIJFRLCF-HUUCEWRRSA-N 1 3 328.460 2.896 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CCC[NH2+]CC1CC(F)(F)C1 ZINC001676024768 1106471321 /nfs/dbraw/zinc/47/13/21/1106471321.db2.gz XYCMHKBGCURFPN-HOCLYGCPSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@H]1[C@H](NCc2ccccc2F)CCN1C(=O)CCCC[NH+](C)C ZINC001676680297 1106557635 /nfs/dbraw/zinc/55/76/35/1106557635.db2.gz KIGZAOVUVSDVLC-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@@H](C[NH2+]CCc3cccs3)C2)CCC1 ZINC001676933559 1106630476 /nfs/dbraw/zinc/63/04/76/1106630476.db2.gz YEOWTWLDSLJPAI-HZPDHXFCSA-N 1 3 349.544 2.649 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CC[C@@H](C[NH2+]CCC(F)(F)F)C1)N1CCCC1 ZINC001676946161 1106634037 /nfs/dbraw/zinc/63/40/37/1106634037.db2.gz USUOCBQZBFJNQW-ZIAGYGMSSA-N 1 3 349.441 2.688 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)cs1 ZINC001483049707 1106645775 /nfs/dbraw/zinc/64/57/75/1106645775.db2.gz ADKDQDHILIIQKZ-YXVLKGNQSA-N 1 3 335.517 2.549 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cs1 ZINC001483049707 1106645780 /nfs/dbraw/zinc/64/57/80/1106645780.db2.gz ADKDQDHILIIQKZ-YXVLKGNQSA-N 1 3 335.517 2.549 10 0 EFAEHO CCCCCC[NH2+][C@@H]1CN(C(=O)[C@H](C(C)C)N(C)C)CC1(C)C ZINC001677032376 1106652930 /nfs/dbraw/zinc/65/29/30/1106652930.db2.gz CLIAJKPDDDZWEZ-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@H](CNCC=C(Cl)Cl)C(C)(C)C ZINC001677276712 1106689733 /nfs/dbraw/zinc/68/97/33/1106689733.db2.gz GKPNXZRUIRZABH-LBPRGKRZSA-N 1 3 338.323 2.768 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C[NH2+]CCc1ccccc1)C(C)(C)C)N(C)C ZINC001677282728 1106691020 /nfs/dbraw/zinc/69/10/20/1106691020.db2.gz YTTIVCIFUPVJPN-ZWKOTPCHSA-N 1 3 333.520 2.690 10 0 EFAEHO CC1CC(C[N@H+]2CC=C(CNC(=O)CN(C)CC(C)(C)C)CC2)C1 ZINC001677603445 1106773699 /nfs/dbraw/zinc/77/36/99/1106773699.db2.gz RVZOTJPTSHLELJ-UHFFFAOYSA-N 1 3 335.536 2.759 10 0 EFAEHO CC1CC(C[N@@H+]2CC=C(CNC(=O)CN(C)CC(C)(C)C)CC2)C1 ZINC001677603445 1106773712 /nfs/dbraw/zinc/77/37/12/1106773712.db2.gz RVZOTJPTSHLELJ-UHFFFAOYSA-N 1 3 335.536 2.759 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+](C[C@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001677623725 1106790244 /nfs/dbraw/zinc/79/02/44/1106790244.db2.gz AXPDFKICCIGXEH-JKSUJKDBSA-N 1 3 343.462 2.510 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+](C[C@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001677623725 1106790259 /nfs/dbraw/zinc/79/02/59/1106790259.db2.gz AXPDFKICCIGXEH-JKSUJKDBSA-N 1 3 343.462 2.510 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)C(C)(C)[NH+]2CCCCC2)c1 ZINC001483227940 1107457178 /nfs/dbraw/zinc/45/71/78/1107457178.db2.gz ZOFXRYGBUXPJLJ-INIZCTEOSA-N 1 3 349.494 2.993 10 0 EFAEHO C[C@@H]([NH2+]CC1CC(NC(=O)C2(N(C)C)CCC2)C1)c1ccccc1 ZINC001409266562 1107690370 /nfs/dbraw/zinc/69/03/70/1107690370.db2.gz UBSBXEZSWKUIQC-KLHKWILBSA-N 1 3 329.488 2.716 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@H]21 ZINC001272216712 1107919821 /nfs/dbraw/zinc/91/98/21/1107919821.db2.gz WUJWBHKLYALZCG-MSIWKICXSA-N 1 3 333.520 2.750 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@H]21 ZINC001272216712 1107919826 /nfs/dbraw/zinc/91/98/26/1107919826.db2.gz WUJWBHKLYALZCG-MSIWKICXSA-N 1 3 333.520 2.750 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@H]1CCN1C[C@H]1CCCC(F)(F)C1 ZINC001483693103 1107927206 /nfs/dbraw/zinc/92/72/06/1107927206.db2.gz KMFANTLPCNVJHF-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC/C=C\C[NH2+]CC2CCCC2)C1 ZINC001483061973 1107951056 /nfs/dbraw/zinc/95/10/56/1107951056.db2.gz YCDJFGQCYNCYMG-RURPWVQCSA-N 1 3 339.499 2.651 10 0 EFAEHO C[C@@H](NC(=O)CN(C)CC(C)(C)C)[C@@H](C)[NH2+]CCc1cccs1 ZINC001409406974 1108200570 /nfs/dbraw/zinc/20/05/70/1108200570.db2.gz XOGVQRHXODTLSE-HUUCEWRRSA-N 1 3 339.549 2.751 10 0 EFAEHO Cc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)C23CC[NH+](CC2)C3)c(Cl)c1 ZINC001409419986 1108253526 /nfs/dbraw/zinc/25/35/26/1108253526.db2.gz LFRJJTIENBKXMU-LSDHHAIUSA-N 1 3 349.906 2.727 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2CC2CC2)C1 ZINC001272226173 1108297893 /nfs/dbraw/zinc/29/78/93/1108297893.db2.gz RCPZEMXFVCUYLV-RTBURBONSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2CC2CC2)C1 ZINC001272226173 1108297903 /nfs/dbraw/zinc/29/79/03/1108297903.db2.gz RCPZEMXFVCUYLV-RTBURBONSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2ccsc2)C1)N(C)C ZINC001272465358 1108413704 /nfs/dbraw/zinc/41/37/04/1108413704.db2.gz DYDLUWGPTGDODU-WBVHZDCISA-N 1 3 337.533 2.663 10 0 EFAEHO O=C(CN1CCCC1)NC/C=C/C[NH2+]C/C=C\c1ccc(Cl)cc1 ZINC001483093502 1108574669 /nfs/dbraw/zinc/57/46/69/1108574669.db2.gz RJGQOHYAMFOUKF-NRUGGMJCSA-N 1 3 347.890 2.711 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NC/C=C/C[NH2+]CCC(F)(F)F)c1 ZINC001483097137 1108621888 /nfs/dbraw/zinc/62/18/88/1108621888.db2.gz IGELVXNJDFRUBM-ONEGZZNKSA-N 1 3 343.393 2.576 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C\C[NH2+]Cc1ccc(CF)cc1 ZINC001483097165 1108624468 /nfs/dbraw/zinc/62/44/68/1108624468.db2.gz ISQQYUUWSUKKHH-PHWHVTFISA-N 1 3 347.478 2.793 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cscc1C(F)F ZINC000898584295 1109022972 /nfs/dbraw/zinc/02/29/72/1109022972.db2.gz BNOZHJTZDDONGI-NSHDSACASA-N 1 3 333.448 2.688 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cscc1C(F)F ZINC000898584295 1109022973 /nfs/dbraw/zinc/02/29/73/1109022973.db2.gz BNOZHJTZDDONGI-NSHDSACASA-N 1 3 333.448 2.688 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@@H]3C[C@@H]3[C@@H]3C[C@@H]3C)CC2)CC1 ZINC000899398792 1109311275 /nfs/dbraw/zinc/31/12/75/1109311275.db2.gz BUJLZGPGQTYVSZ-UUXHPUJUSA-N 1 3 347.547 2.591 10 0 EFAEHO CN(C)Cc1ccc(NC(=O)[C@@H]2CC[N@H+](C)C2)cc1C(F)(F)F ZINC000899671735 1109437313 /nfs/dbraw/zinc/43/73/13/1109437313.db2.gz ARZKPHPSFSANRZ-GFCCVEGCSA-N 1 3 329.366 2.657 10 0 EFAEHO CN(C)Cc1ccc(NC(=O)[C@@H]2CC[N@@H+](C)C2)cc1C(F)(F)F ZINC000899671735 1109437316 /nfs/dbraw/zinc/43/73/16/1109437316.db2.gz ARZKPHPSFSANRZ-GFCCVEGCSA-N 1 3 329.366 2.657 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1cccc(C(C)C)n1 ZINC001483133341 1109557593 /nfs/dbraw/zinc/55/75/93/1109557593.db2.gz WQXDQEHFINYMGL-APWZRJJASA-N 1 3 346.519 2.674 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1cccc(C(C)C)n1 ZINC001483133341 1109557597 /nfs/dbraw/zinc/55/75/97/1109557597.db2.gz WQXDQEHFINYMGL-APWZRJJASA-N 1 3 346.519 2.674 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)NCC1(NCc2ccsc2)CC1 ZINC001483745977 1111152894 /nfs/dbraw/zinc/15/28/94/1111152894.db2.gz KZVODQKPSGETRF-INIZCTEOSA-N 1 3 335.517 2.607 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)NCC1(NCc2ccsc2)CC1 ZINC001483745977 1111152898 /nfs/dbraw/zinc/15/28/98/1111152898.db2.gz KZVODQKPSGETRF-INIZCTEOSA-N 1 3 335.517 2.607 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](CC[NH2+]Cc2csc(C)c2)C1)N(C)C ZINC001272617587 1111751032 /nfs/dbraw/zinc/75/10/32/1111751032.db2.gz XOEWNDWDXPHXIF-DOTOQJQBSA-N 1 3 337.533 2.725 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+][C@H](C)c2cc(C)ccc2C)CC1 ZINC001483786871 1112449102 /nfs/dbraw/zinc/44/91/02/1112449102.db2.gz HUFCYBGTQFCFBC-QGZVFWFLSA-N 1 3 331.504 2.945 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@]2(CCN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001483842160 1112500399 /nfs/dbraw/zinc/50/03/99/1112500399.db2.gz MTYSAZRDLGAWGH-HXUWFJFHSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@]2(CCN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001483842160 1112500401 /nfs/dbraw/zinc/50/04/01/1112500401.db2.gz MTYSAZRDLGAWGH-HXUWFJFHSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCC2(C1)CC[NH+](CC1CCCC1)CC2 ZINC001483837011 1112513736 /nfs/dbraw/zinc/51/37/36/1112513736.db2.gz UGLWOZFEUHVWMX-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@H]1C[NH2+]CCCC(C)(C)C)N(C)C ZINC001483934434 1112576365 /nfs/dbraw/zinc/57/63/65/1112576365.db2.gz MIVXOJONACUPHO-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H](C(=O)NC1(C)CC[NH+](CC[C@H](C)F)CC1)N1CCCCCC1 ZINC001483973034 1112614817 /nfs/dbraw/zinc/61/48/17/1112614817.db2.gz QEJIUESUCRISBM-DLBZAZTESA-N 1 3 341.515 2.970 10 0 EFAEHO COc1ccc(C[NH+]2CCC(C)(NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001483976377 1112618377 /nfs/dbraw/zinc/61/83/77/1112618377.db2.gz JPGAMDQUQALSJR-UHFFFAOYSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1(C)CC[NH+](CC[C@H](C)F)CC1 ZINC001484136363 1112807983 /nfs/dbraw/zinc/80/79/83/1112807983.db2.gz DKPMATGSRAKOQF-IRXDYDNUSA-N 1 3 341.515 2.826 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](CC[NH2+]Cc2ccsc2)C1)C1CCC1 ZINC001484523585 1112979909 /nfs/dbraw/zinc/97/99/09/1112979909.db2.gz BJUDOPBHXJDKLC-OAHLLOKOSA-N 1 3 335.517 2.561 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+]C[C@@H]2CCC(F)(F)C2)C1 ZINC001484550129 1113002765 /nfs/dbraw/zinc/00/27/65/1113002765.db2.gz QCMVWCWUZNAOTI-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)=CCN(C)Cc1ccccc1CNC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001484557656 1113010800 /nfs/dbraw/zinc/01/08/00/1113010800.db2.gz VVSXFNWMOOCQQF-LJQANCHMSA-N 1 3 329.488 2.653 10 0 EFAEHO CC(C)=CCN(C)Cc1ccccc1CNC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001484557656 1113010805 /nfs/dbraw/zinc/01/08/05/1113010805.db2.gz VVSXFNWMOOCQQF-LJQANCHMSA-N 1 3 329.488 2.653 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCc1ccc([C@H](C)[NH2+]CC[C@H](C)F)cc1 ZINC001484563259 1113018741 /nfs/dbraw/zinc/01/87/41/1113018741.db2.gz LYULLVWUESIEMT-KBPBESRZSA-N 1 3 346.450 2.976 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001484571404 1113030672 /nfs/dbraw/zinc/03/06/72/1113030672.db2.gz ANPTVEBBFSYIPU-KZNAEPCWSA-N 1 3 325.541 2.883 10 0 EFAEHO Cc1cc(C[NH+]2CCC3(CN(C(=O)CN(C)C(C)C)C3)CC2)cs1 ZINC001484581574 1113034245 /nfs/dbraw/zinc/03/42/45/1113034245.db2.gz IECORMDMLKJRDP-UHFFFAOYSA-N 1 3 349.544 2.821 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CC[C@H](C[NH2+]CCC(C)(C)C)CC1 ZINC001484575420 1113040113 /nfs/dbraw/zinc/04/01/13/1113040113.db2.gz SMLWQEAYMRARTO-WKILWMFISA-N 1 3 334.508 2.961 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NCC2([NH2+]CCC3CC3)CCC2)C1 ZINC001484652791 1113094121 /nfs/dbraw/zinc/09/41/21/1113094121.db2.gz HXKJCGHMGFWJJN-LJQANCHMSA-N 1 3 339.499 2.628 10 0 EFAEHO CCC1([NH2+]Cc2ccsc2)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001484816806 1117750373 /nfs/dbraw/zinc/75/03/73/1117750373.db2.gz ROOMUZVDBBWRQS-UHFFFAOYSA-N 1 3 332.473 2.575 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@]2(CC[N@H+](CCC(F)(F)F)C2)C1 ZINC001484831554 1117766166 /nfs/dbraw/zinc/76/61/66/1117766166.db2.gz SKQHLLZGXWAXSW-MRXNPFEDSA-N 1 3 349.441 2.594 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@]2(CC[N@@H+](CCC(F)(F)F)C2)C1 ZINC001484831554 1117766168 /nfs/dbraw/zinc/76/61/68/1117766168.db2.gz SKQHLLZGXWAXSW-MRXNPFEDSA-N 1 3 349.441 2.594 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@@H]([NH2+]C/C=C\Cl)C1 ZINC001484876729 1117792923 /nfs/dbraw/zinc/79/29/23/1117792923.db2.gz KGCQRGULWYJEDW-GSNCDVCBSA-N 1 3 327.900 2.582 10 0 EFAEHO C[C@H]1CN(C(=O)C(C)(C)[NH+]2CCCC2)C[C@H]1NCC=C(Cl)Cl ZINC001484894847 1117810227 /nfs/dbraw/zinc/81/02/27/1117810227.db2.gz MJUOFGGBDAVCPQ-QWHCGFSZSA-N 1 3 348.318 2.616 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C2(C)CCN(C(=O)CN(C)C(C)C)CC2)c1 ZINC001484928346 1117832395 /nfs/dbraw/zinc/83/23/95/1117832395.db2.gz PDINAESNYKEIHH-UHFFFAOYSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001484994659 1117929846 /nfs/dbraw/zinc/92/98/46/1117929846.db2.gz NJQMZQOHSPZOTF-RRFJBIMHSA-N 1 3 333.467 2.637 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@@H]1C[N@H+](C)Cc1ccccc1 ZINC001485057552 1117995295 /nfs/dbraw/zinc/99/52/95/1117995295.db2.gz FZIPCGVJJHRELZ-MOPGFXCFSA-N 1 3 349.494 2.789 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@@H]1C[N@@H+](C)Cc1ccccc1 ZINC001485057552 1117995298 /nfs/dbraw/zinc/99/52/98/1117995298.db2.gz FZIPCGVJJHRELZ-MOPGFXCFSA-N 1 3 349.494 2.789 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001485157840 1118100609 /nfs/dbraw/zinc/10/06/09/1118100609.db2.gz VMWPBMFSDQBCNA-NWDGAFQWSA-N 1 3 343.924 2.869 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001485157842 1118100640 /nfs/dbraw/zinc/10/06/40/1118100640.db2.gz VMWPBMFSDQBCNA-RYUDHWBXSA-N 1 3 343.924 2.869 10 0 EFAEHO C[C@H](NCc1ccccc1F)[C@H](C)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001485165072 1118108042 /nfs/dbraw/zinc/10/80/42/1118108042.db2.gz UMOFFKWRSPJKBL-HOTGVXAUSA-N 1 3 347.478 2.685 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@H](C)[NH2+]CCc1ccccc1F ZINC001485181229 1118115644 /nfs/dbraw/zinc/11/56/44/1118115644.db2.gz RAKCPCLRYNGSMX-JKSUJKDBSA-N 1 3 349.494 2.725 10 0 EFAEHO C[C@@H]([NH2+]CCc1ccccc1)[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001485183116 1118117171 /nfs/dbraw/zinc/11/71/71/1118117171.db2.gz ZKYWHCCEIOYAJH-SJORKVTESA-N 1 3 331.504 2.586 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H](C)[NH2+]CCCc1cccc(C)c1 ZINC001485219555 1118139466 /nfs/dbraw/zinc/13/94/66/1118139466.db2.gz YDFLKKFPKZVEEY-HOTGVXAUSA-N 1 3 342.487 2.685 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001485214212 1118150987 /nfs/dbraw/zinc/15/09/87/1118150987.db2.gz FKMSBWUTYXTPRE-CHWSQXEVSA-N 1 3 343.874 2.804 10 0 EFAEHO C[C@H](NCc1ccns1)[C@H](C)NC(=O)c1cccc(C[NH+](C)C)c1 ZINC001485228170 1118154560 /nfs/dbraw/zinc/15/45/60/1118154560.db2.gz CIDNPDLLACUQMF-KBPBESRZSA-N 1 3 346.500 2.501 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)CC(C)(C)C[NH2+]C/C=C\Cl ZINC001485253027 1118169126 /nfs/dbraw/zinc/16/91/26/1118169126.db2.gz XITNBEHRJGWSDK-VIHMKRCTSA-N 1 3 329.916 2.688 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1 ZINC001485308236 1118221053 /nfs/dbraw/zinc/22/10/53/1118221053.db2.gz DQUWNHNWIPYECL-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1 ZINC001485308236 1118221057 /nfs/dbraw/zinc/22/10/57/1118221057.db2.gz DQUWNHNWIPYECL-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1cccc(F)c1 ZINC001485311164 1118223874 /nfs/dbraw/zinc/22/38/74/1118223874.db2.gz YEWHGAVCLJSROY-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1cccc(F)c1 ZINC001485311164 1118223878 /nfs/dbraw/zinc/22/38/78/1118223878.db2.gz YEWHGAVCLJSROY-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CC/C=C\CC[N@H+](C)[C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001485349491 1118271562 /nfs/dbraw/zinc/27/15/62/1118271562.db2.gz GYAJPAOXHFFJEC-RQUZMNLWSA-N 1 3 341.515 2.992 10 0 EFAEHO CC/C=C\CC[N@@H+](C)[C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001485349491 1118271565 /nfs/dbraw/zinc/27/15/65/1118271565.db2.gz GYAJPAOXHFFJEC-RQUZMNLWSA-N 1 3 341.515 2.992 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+]CC/C=C/c2ccccc2)CCC1 ZINC001493574984 1118386910 /nfs/dbraw/zinc/38/69/10/1118386910.db2.gz PKNCRYJPLWADMV-KPKJPENVSA-N 1 3 329.488 2.622 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCCCCN2Cc2ccsc2)C1 ZINC001485484830 1118418139 /nfs/dbraw/zinc/41/81/39/1118418139.db2.gz LRONTDBCTBFLMO-WMZOPIPTSA-N 1 3 349.544 2.951 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@@H]2CCCCCN2Cc2ccsc2)C1 ZINC001485484830 1118418140 /nfs/dbraw/zinc/41/81/40/1118418140.db2.gz LRONTDBCTBFLMO-WMZOPIPTSA-N 1 3 349.544 2.951 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1C[NH+](CCCc2cccc(F)c2)C1 ZINC001485538184 1118439225 /nfs/dbraw/zinc/43/92/25/1118439225.db2.gz BDCJWYCITINYSK-INIZCTEOSA-N 1 3 349.494 2.535 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1C[NH+]([C@H]2CCCc3ccccc32)C1 ZINC001485540710 1118440522 /nfs/dbraw/zinc/44/05/22/1118440522.db2.gz UETNCGAGVHZVPL-JXFKEZNVSA-N 1 3 343.515 2.841 10 0 EFAEHO Cc1ccc(C)c(CN2CC([C@@H](C)NC(=O)CCCC[NH+](C)C)C2)c1 ZINC001485531925 1118443173 /nfs/dbraw/zinc/44/31/73/1118443173.db2.gz CNWLZHYTDJLKQU-GOSISDBHSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CN(CCc2ccccc2F)CC1(C)C ZINC001485579298 1118465685 /nfs/dbraw/zinc/46/56/85/1118465685.db2.gz KICAPDFSUOTUJK-SFHVURJKSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CN(CCc2ccccc2F)CC1(C)C ZINC001485579298 1118465690 /nfs/dbraw/zinc/46/56/90/1118465690.db2.gz KICAPDFSUOTUJK-SFHVURJKSA-N 1 3 349.494 2.537 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+](Cc3cc(C)sc3C)C[C@H]21 ZINC001485623652 1118492928 /nfs/dbraw/zinc/49/29/28/1118492928.db2.gz MNOQBNUHQAAQAW-NNZMDNLPSA-N 1 3 349.544 2.501 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+](Cc3cc(C)sc3C)C[C@H]21 ZINC001485623652 1118492929 /nfs/dbraw/zinc/49/29/29/1118492929.db2.gz MNOQBNUHQAAQAW-NNZMDNLPSA-N 1 3 349.544 2.501 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@H](C)C3)C[C@@]2(C)C1 ZINC001485668749 1118517172 /nfs/dbraw/zinc/51/71/72/1118517172.db2.gz DXRPOROWZGESIQ-FASOMAFZSA-N 1 3 347.547 2.855 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@H](C)C3)C[C@@]2(C)C1 ZINC001485668749 1118517173 /nfs/dbraw/zinc/51/71/73/1118517173.db2.gz DXRPOROWZGESIQ-FASOMAFZSA-N 1 3 347.547 2.855 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@]2(C)C[N@H+](CC3=CCCCC3)C[C@]2(C)C1 ZINC001485669602 1118517935 /nfs/dbraw/zinc/51/79/35/1118517935.db2.gz GXSIIHFTOQXKFM-OYRHEFFESA-N 1 3 347.547 2.999 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@]2(C)C[N@@H+](CC3=CCCCC3)C[C@]2(C)C1 ZINC001485669602 1118517938 /nfs/dbraw/zinc/51/79/38/1118517938.db2.gz GXSIIHFTOQXKFM-OYRHEFFESA-N 1 3 347.547 2.999 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](CC3CC(C)(C)C3)C[C@@H]2C1 ZINC001485657061 1118520319 /nfs/dbraw/zinc/52/03/19/1118520319.db2.gz HYSXYSIJZGWRRD-GBESFXJTSA-N 1 3 349.563 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CC3CC(C)(C)C3)C[C@@H]2C1 ZINC001485657061 1118520321 /nfs/dbraw/zinc/52/03/21/1118520321.db2.gz HYSXYSIJZGWRRD-GBESFXJTSA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@H]2C[C@H](C[NH2+]CCCc3ccsc3)C2)C1 ZINC001485696558 1118534711 /nfs/dbraw/zinc/53/47/11/1118534711.db2.gz UWKWEMNDIYSLMV-SZMVWBNQSA-N 1 3 349.544 2.507 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC([N@H+](C)CCC(C)(C)C)CC1)N(C)C ZINC001485759504 1118564727 /nfs/dbraw/zinc/56/47/27/1118564727.db2.gz XKZDRCQCWGBNHH-KRWDZBQOSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC([N@@H+](C)CCC(C)(C)C)CC1)N(C)C ZINC001485759504 1118564729 /nfs/dbraw/zinc/56/47/29/1118564729.db2.gz XKZDRCQCWGBNHH-KRWDZBQOSA-N 1 3 325.541 2.932 10 0 EFAEHO CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000174979252 529406615 /nfs/dbraw/zinc/40/66/15/529406615.db2.gz HTBVNPZPUIPZAN-WOJBJXKFSA-N 1 3 341.499 2.981 10 0 EFAEHO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000174979252 529406619 /nfs/dbraw/zinc/40/66/19/529406619.db2.gz HTBVNPZPUIPZAN-WOJBJXKFSA-N 1 3 341.499 2.981 10 0 EFAEHO CN1CCC(C[NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)(N2CCCCC2)CC1 ZINC000245848382 282695807 /nfs/dbraw/zinc/69/58/07/282695807.db2.gz FXIYPHQLOSHPEJ-GUDVDZBRSA-N 1 3 349.563 2.730 10 0 EFAEHO CN1CC[C@H]([NH2+]CC2(N3CCSCC3)CCCC2)[C@H]2CCC[C@@H]21 ZINC000353443978 283133825 /nfs/dbraw/zinc/13/38/25/283133825.db2.gz FDIURMRLODZKEV-SQNIBIBYSA-N 1 3 337.577 2.810 10 0 EFAEHO C[NH+](C)C1CCN([C@@H](CN)c2ccc(Br)s2)CC1 ZINC000036191604 213075769 /nfs/dbraw/zinc/07/57/69/213075769.db2.gz LTPMVOXYMNAUMO-NSHDSACASA-N 1 3 332.311 2.536 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2ccc(S(C)(=O)=O)cc2)cc1 ZINC000423292103 296030514 /nfs/dbraw/zinc/03/05/14/296030514.db2.gz LJDDWPPZSIJRNY-ZIAGYGMSSA-N 1 3 332.469 2.961 10 0 EFAEHO C[C@@H]([NH2+]CC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccnn1C ZINC000192838581 239907956 /nfs/dbraw/zinc/90/79/56/239907956.db2.gz PAUAVTSJWVQWEG-UZLBHIALSA-N 1 3 342.487 2.516 10 0 EFAEHO O=C([C@H]1CCCN1C1CC1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000426484615 296108042 /nfs/dbraw/zinc/10/80/42/296108042.db2.gz GXHXREHDWDZLGW-IEBWSBKVSA-N 1 3 333.520 2.728 10 0 EFAEHO C[C@@H]([NH2+]C1(CN[C@@H]2CCN(C3CC3)C2)CCOCC1)c1ccccc1 ZINC000095422925 296112718 /nfs/dbraw/zinc/11/27/18/296112718.db2.gz FGJOCSMUWVIRBB-IEBWSBKVSA-N 1 3 343.515 2.713 10 0 EFAEHO C[C@@H]([NH2+]CC1(N2CCOCC2)CCN(C)CC1)C1CCCCCC1 ZINC000414200944 244044755 /nfs/dbraw/zinc/04/47/55/244044755.db2.gz SBMGURVSWSHZBN-GOSISDBHSA-N 1 3 337.552 2.732 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1)[C@@H]1CC1(C)C ZINC000414334046 244093225 /nfs/dbraw/zinc/09/32/25/244093225.db2.gz FXWRKLKOSDLKAF-KXBFYZLASA-N 1 3 343.515 2.908 10 0 EFAEHO CC(C)NC(=O)[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000414347928 244099304 /nfs/dbraw/zinc/09/93/04/244099304.db2.gz RLRYPNKSTYRDKM-KANFNMMFSA-N 1 3 329.488 2.685 10 0 EFAEHO CCC[C@@H](C)C[NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1 ZINC000414556818 244232511 /nfs/dbraw/zinc/23/25/11/244232511.db2.gz OZGBSOXGCTVVII-MRXNPFEDSA-N 1 3 331.504 2.910 10 0 EFAEHO CC(C)[C@@H](Cc1ccc(F)cc1)[N@H+](C)C[C@@H]1CCCN(C(=O)CN)C1 ZINC000414738929 244318831 /nfs/dbraw/zinc/31/88/31/244318831.db2.gz IJTLWVFDWWJZGL-PKOBYXMFSA-N 1 3 349.494 2.522 10 0 EFAEHO CC(C)[C@@H](Cc1ccc(F)cc1)[N@@H+](C)C[C@@H]1CCCN(C(=O)CN)C1 ZINC000414738929 244318834 /nfs/dbraw/zinc/31/88/34/244318834.db2.gz IJTLWVFDWWJZGL-PKOBYXMFSA-N 1 3 349.494 2.522 10 0 EFAEHO COC(=O)[C@H](C)Oc1ccc(CNCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000414812464 244363180 /nfs/dbraw/zinc/36/31/80/244363180.db2.gz RIUSERRGSNABAK-CABCVRRESA-N 1 3 342.439 2.936 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@@H](C)NCC[C@H]1CCC[NH2+]1 ZINC000414912404 244395880 /nfs/dbraw/zinc/39/58/80/244395880.db2.gz XYRPRMCVLWDYDQ-TZMCWYRMSA-N 1 3 339.867 2.797 10 0 EFAEHO CCn1nncc1CNCC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000417960340 245107147 /nfs/dbraw/zinc/10/71/47/245107147.db2.gz XHNKSLWNDKQGSU-FUHWJXTLSA-N 1 3 327.476 2.688 10 0 EFAEHO CCn1nncc1CNCC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000417960340 245107154 /nfs/dbraw/zinc/10/71/54/245107154.db2.gz XHNKSLWNDKQGSU-FUHWJXTLSA-N 1 3 327.476 2.688 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCN(C(=O)NCC[C@H]2CC[NH2+]C2)CC1 ZINC000418340041 245128206 /nfs/dbraw/zinc/12/82/06/245128206.db2.gz NAYKFJKCDYUVFH-MRXNPFEDSA-N 1 3 338.540 2.528 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000418488509 245171122 /nfs/dbraw/zinc/17/11/22/245171122.db2.gz KUPLWLBYBQMOQC-INIZCTEOSA-N 1 3 332.492 2.724 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)N(CCN(C)C)C2CCCC2)cc1 ZINC000418492980 245172909 /nfs/dbraw/zinc/17/29/09/245172909.db2.gz QGIAAKPWPNWPMS-HNNXBMFYSA-N 1 3 332.492 2.722 10 0 EFAEHO CCCC[N@H+](C)CC1CCN(C(=O)NC[C@@H](N)c2ccccc2)CC1 ZINC000418449138 245161868 /nfs/dbraw/zinc/16/18/68/245161868.db2.gz JYPXDPWYLDHOPH-LJQANCHMSA-N 1 3 346.519 2.840 10 0 EFAEHO CCCC[N@@H+](C)CC1CCN(C(=O)NC[C@@H](N)c2ccccc2)CC1 ZINC000418449138 245161871 /nfs/dbraw/zinc/16/18/71/245161871.db2.gz JYPXDPWYLDHOPH-LJQANCHMSA-N 1 3 346.519 2.840 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)N2CCC[C@@H]2CN2CCCCC2)cc1 ZINC000418464766 245168327 /nfs/dbraw/zinc/16/83/27/245168327.db2.gz QANZVSIOFHUNCW-QFBILLFUSA-N 1 3 344.503 2.866 10 0 EFAEHO CCCN(CCC[NH+](C)C)C(=O)NC[C@@H](N)c1ccccc1CC ZINC000418656716 245230202 /nfs/dbraw/zinc/23/02/02/245230202.db2.gz SURCKADUYNPOLO-GOSISDBHSA-N 1 3 334.508 2.622 10 0 EFAEHO C[C@H]1CN(Cc2cccc(C[NH+]3CCCCC3)c2)[C@@H](C)CN1CCO ZINC000419325412 245376459 /nfs/dbraw/zinc/37/64/59/245376459.db2.gz BEYIGNJJRTVAOQ-OALUTQOASA-N 1 3 345.531 2.559 10 0 EFAEHO C[C@@H]1CN(CCO)[C@@H](C)CN1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000419337826 245386262 /nfs/dbraw/zinc/38/62/62/245386262.db2.gz LGSOPPOCKHNNCG-RBUKOAKNSA-N 1 3 345.531 2.559 10 0 EFAEHO CN(C[C@H]1CCCN1C)C(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000422144492 246270046 /nfs/dbraw/zinc/27/00/46/246270046.db2.gz QZLSEUIOSOAYDC-LJQANCHMSA-N 1 3 344.503 2.518 10 0 EFAEHO COc1ccc([C@H](NC[C@@]2(N(C)C)CCSC2)[C@@H]2CCC[NH2+]2)cc1 ZINC000422817855 246476269 /nfs/dbraw/zinc/47/62/69/246476269.db2.gz DZDHCCHUTWZDCP-FHWLQOOXSA-N 1 3 349.544 2.515 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1cn(-c2ccccc2)nc1C(C)C ZINC000422872129 246494793 /nfs/dbraw/zinc/49/47/93/246494793.db2.gz FUQIADAMMGGCOY-KRWDZBQOSA-N 1 3 330.476 2.839 10 0 EFAEHO CCN1CCN(Cc2ccc(C[NH2+][C@H]3CC[C@H]3SC)cc2)CC1 ZINC000425358555 247058412 /nfs/dbraw/zinc/05/84/12/247058412.db2.gz OTPFRNOSGMIZJZ-RBUKOAKNSA-N 1 3 333.545 2.808 10 0 EFAEHO CC(C)(C)N1CC[C@H](N2CCC(CCC[NH+]3CCCC3)CC2)C1=O ZINC000425427086 247081696 /nfs/dbraw/zinc/08/16/96/247081696.db2.gz XOCMWNHEYFHXJD-SFHVURJKSA-N 1 3 335.536 2.974 10 0 EFAEHO Cn1c2ccccc2cc(C[NH2+][C@H]2CCN(C)[C@H]3CCC[C@@H]32)c1=O ZINC000426287194 247259342 /nfs/dbraw/zinc/25/93/42/247259342.db2.gz WSDKVAWKDAJSJR-AOIWGVFYSA-N 1 3 325.456 2.501 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cc3ccccc3n(C)c2=O)[C@@H]2CCC[C@@H]21 ZINC000426287196 247259782 /nfs/dbraw/zinc/25/97/82/247259782.db2.gz WSDKVAWKDAJSJR-LNLFQRSKSA-N 1 3 325.456 2.501 10 0 EFAEHO CN(C[C@H]1CCC[N@H+](C)C1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000265298755 247383387 /nfs/dbraw/zinc/38/33/87/247383387.db2.gz LYYSXHYFOOZGRS-SFHVURJKSA-N 1 3 329.488 2.696 10 0 EFAEHO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000265298755 247383391 /nfs/dbraw/zinc/38/33/91/247383391.db2.gz LYYSXHYFOOZGRS-SFHVURJKSA-N 1 3 329.488 2.696 10 0 EFAEHO CN(C[C@@H]1CCC[N@H+](C)C1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000265298753 247383494 /nfs/dbraw/zinc/38/34/94/247383494.db2.gz LYYSXHYFOOZGRS-GOSISDBHSA-N 1 3 329.488 2.696 10 0 EFAEHO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000265298753 247383498 /nfs/dbraw/zinc/38/34/98/247383498.db2.gz LYYSXHYFOOZGRS-GOSISDBHSA-N 1 3 329.488 2.696 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)NC3CCC4(CC4)CC3)CC2)CC1 ZINC000433620112 248077013 /nfs/dbraw/zinc/07/70/13/248077013.db2.gz YDCQAVMRSRIOAX-UHFFFAOYSA-N 1 3 348.535 2.567 10 0 EFAEHO CC[NH+](CC)CCO[C@H]1CCN(Cc2ccc(-c3cc[nH]n3)o2)C1 ZINC000435129263 248213815 /nfs/dbraw/zinc/21/38/15/248213815.db2.gz MIACDUKWCMAROF-HNNXBMFYSA-N 1 3 332.448 2.602 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)c1cccc(SC)c1 ZINC000449825617 251169294 /nfs/dbraw/zinc/16/92/94/251169294.db2.gz PSQQVLDNJBBHET-KRWDZBQOSA-N 1 3 349.544 2.897 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)c1cccc(SC)c1 ZINC000449825617 251169298 /nfs/dbraw/zinc/16/92/98/251169298.db2.gz PSQQVLDNJBBHET-KRWDZBQOSA-N 1 3 349.544 2.897 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[N@@H+]1CC[C@@H]2[C@@H](CCCN2C)C1 ZINC000268740230 252189563 /nfs/dbraw/zinc/18/95/63/252189563.db2.gz POPFZCJSDQESBT-NLWGTHIKSA-N 1 3 346.515 2.966 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H]2[C@@H](CCCN2C)C1 ZINC000268740230 252189566 /nfs/dbraw/zinc/18/95/66/252189566.db2.gz POPFZCJSDQESBT-NLWGTHIKSA-N 1 3 346.515 2.966 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)CC1(C(F)(F)F)CC1 ZINC000352872351 285275702 /nfs/dbraw/zinc/27/57/02/285275702.db2.gz MNBMREUVZXEFHL-AWEZNQCLSA-N 1 3 349.441 2.594 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)CC1(C(F)(F)F)CC1 ZINC000352872351 285275704 /nfs/dbraw/zinc/27/57/04/285275704.db2.gz MNBMREUVZXEFHL-AWEZNQCLSA-N 1 3 349.441 2.594 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)Cc1cc(OC)ccc1F ZINC000353502477 285281945 /nfs/dbraw/zinc/28/19/45/285281945.db2.gz LNUHHIDFIKGEIP-KRWDZBQOSA-N 1 3 337.483 2.682 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)Cc1cc(OC)ccc1F ZINC000353502477 285281946 /nfs/dbraw/zinc/28/19/46/285281946.db2.gz LNUHHIDFIKGEIP-KRWDZBQOSA-N 1 3 337.483 2.682 10 0 EFAEHO CCN1CCN([C@H](C)C[NH2+][C@@H]2CCCOc3ccc(C)cc32)CC1 ZINC000155657527 285335928 /nfs/dbraw/zinc/33/59/28/285335928.db2.gz FBEKFSLCRIROOK-IEBWSBKVSA-N 1 3 331.504 2.824 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)C[C@@H](c2ccccc2)N(C)C)[C@@H](C)C1 ZINC000433471981 285385792 /nfs/dbraw/zinc/38/57/92/285385792.db2.gz QROOGPHYUDXNJB-WDSOQIARSA-N 1 3 331.504 2.868 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)C[C@@H](c2ccccc2)N(C)C)[C@@H](C)C1 ZINC000433471981 285385793 /nfs/dbraw/zinc/38/57/93/285385793.db2.gz QROOGPHYUDXNJB-WDSOQIARSA-N 1 3 331.504 2.868 10 0 EFAEHO Cc1cccc(NC(=O)[C@H]2CCC[N@@H+](CC[C@@H]3CCCN3C)C2)n1 ZINC000126009180 141365251 /nfs/dbraw/zinc/36/52/51/141365251.db2.gz RELFHCJMDNUIAO-IRXDYDNUSA-N 1 3 330.476 2.525 10 0 EFAEHO Cc1cccc(NC(=O)[C@H]2CCC[N@H+](CC[C@@H]3CCCN3C)C2)n1 ZINC000126009180 141365253 /nfs/dbraw/zinc/36/52/53/141365253.db2.gz RELFHCJMDNUIAO-IRXDYDNUSA-N 1 3 330.476 2.525 10 0 EFAEHO C[C@@H]([NH2+]CC(=O)NC1CCN(C2CC2)CC1)[C@@H](C)c1ccccc1 ZINC000347684730 142256250 /nfs/dbraw/zinc/25/62/50/142256250.db2.gz PJNBTXFHQBSYME-HZPDHXFCSA-N 1 3 329.488 2.511 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC[C@H](C)[N@H+](C)Cc1ccccc1 ZINC000349648473 142343416 /nfs/dbraw/zinc/34/34/16/142343416.db2.gz ZUIXTLWGLLGDOC-PKOBYXMFSA-N 1 3 331.504 2.888 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000349648473 142343417 /nfs/dbraw/zinc/34/34/17/142343417.db2.gz ZUIXTLWGLLGDOC-PKOBYXMFSA-N 1 3 331.504 2.888 10 0 EFAEHO CN(C)CCOc1cc(C[NH2+][C@@H]2CCC[C@H]([C@H]3CCOC3)C2)ccn1 ZINC000341396238 145045095 /nfs/dbraw/zinc/04/50/95/145045095.db2.gz HBSFDONYYOQTAV-GBESFXJTSA-N 1 3 347.503 2.707 10 0 EFAEHO CN(C)CCOc1cc(C[NH2+][C@@H]2CCC[C@@H]([C@@H]3CCOC3)C2)ccn1 ZINC000341396242 145045129 /nfs/dbraw/zinc/04/51/29/145045129.db2.gz HBSFDONYYOQTAV-GUDVDZBRSA-N 1 3 347.503 2.707 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)NCCN1CCCC[C@H]1C ZINC000342964385 145230977 /nfs/dbraw/zinc/23/09/77/145230977.db2.gz FNSGXZKCWBRMJF-QZTJIDSGSA-N 1 3 338.540 2.815 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)NCCN1CCCC[C@H]1C ZINC000342964385 145230978 /nfs/dbraw/zinc/23/09/78/145230978.db2.gz FNSGXZKCWBRMJF-QZTJIDSGSA-N 1 3 338.540 2.815 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)NCCN1CCCC[C@H]1C)C(C)C ZINC000343879702 145315490 /nfs/dbraw/zinc/31/54/90/145315490.db2.gz OMCZBCRCXOAIJA-QGZVFWFLSA-N 1 3 326.529 2.669 10 0 EFAEHO CCCN(C)CC(=O)N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000348827161 146009234 /nfs/dbraw/zinc/00/92/34/146009234.db2.gz MHEGYLHBFVTANI-UHFFFAOYSA-N 1 3 343.515 2.843 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H](CNC(=O)CCN2CCc3ccccc3C2)C1 ZINC000348914546 146023541 /nfs/dbraw/zinc/02/35/41/146023541.db2.gz UUHGEXMWRUEJKV-GOSISDBHSA-N 1 3 343.515 2.671 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H](CNC(=O)CCN2CCc3ccccc3C2)C1 ZINC000348914546 146023543 /nfs/dbraw/zinc/02/35/43/146023543.db2.gz UUHGEXMWRUEJKV-GOSISDBHSA-N 1 3 343.515 2.671 10 0 EFAEHO Cc1cccc(O[C@@H]2CCCC[C@H]2NC[C@H](O)C[N@@H+](C)C2CC2)c1 ZINC000351601914 146156366 /nfs/dbraw/zinc/15/63/66/146156366.db2.gz GWQZGJDRVIPVTJ-DFQSSKMNSA-N 1 3 332.488 2.730 10 0 EFAEHO Cc1cccc(O[C@@H]2CCCC[C@H]2NC[C@H](O)C[N@H+](C)C2CC2)c1 ZINC000351601914 146156368 /nfs/dbraw/zinc/15/63/68/146156368.db2.gz GWQZGJDRVIPVTJ-DFQSSKMNSA-N 1 3 332.488 2.730 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000355581810 147003063 /nfs/dbraw/zinc/00/30/63/147003063.db2.gz KVWFADINUWOBIV-SCTDSRPQSA-N 1 3 329.488 2.592 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000355581810 147003064 /nfs/dbraw/zinc/00/30/64/147003064.db2.gz KVWFADINUWOBIV-SCTDSRPQSA-N 1 3 329.488 2.592 10 0 EFAEHO CC[C@H]1C[C@H](CN2CCN(C3CC[NH+](C(C)C)CC3)CC2)CCO1 ZINC000356997557 147395557 /nfs/dbraw/zinc/39/55/57/147395557.db2.gz RWGMCIPJVNWXSZ-QUCCMNQESA-N 1 3 337.552 2.682 10 0 EFAEHO CN(C)C[C@H](NC(=O)CC[C@@H]1CCCC[N@@H+]1C)c1ccc(F)cc1 ZINC000360214014 148301113 /nfs/dbraw/zinc/30/11/13/148301113.db2.gz SLAZLEBSSJILRD-ROUUACIJSA-N 1 3 335.467 2.809 10 0 EFAEHO CN(C)C[C@H](NC(=O)CC[C@@H]1CCCC[N@H+]1C)c1ccc(F)cc1 ZINC000360214014 148301115 /nfs/dbraw/zinc/30/11/15/148301115.db2.gz SLAZLEBSSJILRD-ROUUACIJSA-N 1 3 335.467 2.809 10 0 EFAEHO CCN(C(=O)C[NH2+]CC1CC1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000368454963 150121934 /nfs/dbraw/zinc/12/19/34/150121934.db2.gz WYCIZQIBQQBFBA-APWZRJJASA-N 1 3 329.488 2.670 10 0 EFAEHO Cc1cc(N2CCC[C@H](NC3CC[NH+](C(C)(C)C)CC3)C2)n(C)n1 ZINC000368475717 150126713 /nfs/dbraw/zinc/12/67/13/150126713.db2.gz VTVGUGHHQIEGAW-KRWDZBQOSA-N 1 3 333.524 2.550 10 0 EFAEHO Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C ZINC000372904439 151078708 /nfs/dbraw/zinc/07/87/08/151078708.db2.gz SLBVGLRTCJIEHH-WRWLIDTKSA-N 1 3 345.487 2.528 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc(C[NH3+])cc1 ZINC000374461676 151352414 /nfs/dbraw/zinc/35/24/14/151352414.db2.gz YDFUTBOIGXXUCI-JXFKEZNVSA-N 1 3 337.467 2.786 10 0 EFAEHO COc1ccc([C@@H](NCCN2CCCCCC2)[C@@H]2CCC[NH2+]2)cc1 ZINC000422804949 286359210 /nfs/dbraw/zinc/35/92/10/286359210.db2.gz INBRLWFJOLUNCG-VQTJNVASSA-N 1 3 331.504 2.954 10 0 EFAEHO COc1ccc([C@@H](NCCN2CCCC2(C)C)[C@H]2CCC[NH2+]2)cc1 ZINC000423160483 286359249 /nfs/dbraw/zinc/35/92/49/286359249.db2.gz HLHSTOKBKUAUAH-RTBURBONSA-N 1 3 331.504 2.952 10 0 EFAEHO COc1ccc([C@H](C[NH3+])CN[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000420395530 286372838 /nfs/dbraw/zinc/37/28/38/286372838.db2.gz DMJKGBOFRYORLM-HLAWJBBLSA-N 1 3 339.483 2.773 10 0 EFAEHO COc1ccc([C@H](CN)C[NH2+][C@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000420395530 286372839 /nfs/dbraw/zinc/37/28/39/286372839.db2.gz DMJKGBOFRYORLM-HLAWJBBLSA-N 1 3 339.483 2.773 10 0 EFAEHO COc1ccc([C@H](NC2CCN(C3CC3)CC2)[C@H]2CCC[NH2+]2)cc1 ZINC000422798346 286375635 /nfs/dbraw/zinc/37/56/35/286375635.db2.gz QSLVLXGEHAMZFO-UXHICEINSA-N 1 3 329.488 2.705 10 0 EFAEHO COc1ccc([C@H](NCCN2CCCC2(C)C)[C@@H]2CCC[NH2+]2)cc1 ZINC000423160480 286375673 /nfs/dbraw/zinc/37/56/73/286375673.db2.gz HLHSTOKBKUAUAH-OALUTQOASA-N 1 3 331.504 2.952 10 0 EFAEHO COc1ccc([C@H](N[C@@H]2CN(C3CC3)C[C@H]2C)[C@H]2CCC[NH2+]2)cc1 ZINC000422879121 286376167 /nfs/dbraw/zinc/37/61/67/286376167.db2.gz UOLMYDGYGIMZTG-DMSXTEQDSA-N 1 3 329.488 2.561 10 0 EFAEHO CCN1CC[C@H](C[NH2+][C@@H](C)c2ccc(OCCOC)c(OC)c2)C1 ZINC000163258144 544832649 /nfs/dbraw/zinc/83/26/49/544832649.db2.gz KDBRPCMQMGYNPU-JKSUJKDBSA-N 1 3 336.476 2.713 10 0 EFAEHO CC[NH+](CC)CCOc1ccc(CN[C@@H]2CCCOC2)cc1OC ZINC000164932299 544844182 /nfs/dbraw/zinc/84/41/82/544844182.db2.gz SRKNHILGFDIAGL-QGZVFWFLSA-N 1 3 336.476 2.684 10 0 EFAEHO C[C@@H](CCNC(=O)N[C@H](CN(C)C)c1ccccc1)[NH+]1CCCCC1 ZINC000184758215 544968230 /nfs/dbraw/zinc/96/82/30/544968230.db2.gz FNUHDJLNPCNISU-PKOBYXMFSA-N 1 3 346.519 2.853 10 0 EFAEHO CCO[C@H]1C[C@@H]([NH2+]C2CCN(C3CCCC3)CC2)C12CCOCC2 ZINC000186374542 265064191 /nfs/dbraw/zinc/06/41/91/265064191.db2.gz YQBMPMKRXZZIDT-MOPGFXCFSA-N 1 3 336.520 2.957 10 0 EFAEHO CCO[C@H]1C[C@@H](NC2CC[NH+](C3CCCC3)CC2)C12CCOCC2 ZINC000186374542 265064193 /nfs/dbraw/zinc/06/41/93/265064193.db2.gz YQBMPMKRXZZIDT-MOPGFXCFSA-N 1 3 336.520 2.957 10 0 EFAEHO CC(C)N1C[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)CC1=O ZINC000272281489 266213924 /nfs/dbraw/zinc/21/39/24/266213924.db2.gz AHLFKUKAYALYPH-YSTOQKLRSA-N 1 3 341.499 2.781 10 0 EFAEHO O[C@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCOCC1 ZINC000272460953 266272534 /nfs/dbraw/zinc/27/25/34/266272534.db2.gz YKPQMNLBIGZGLR-PLACYPQZSA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCOCC1 ZINC000272460953 266272536 /nfs/dbraw/zinc/27/25/36/266272536.db2.gz YKPQMNLBIGZGLR-PLACYPQZSA-N 1 3 344.499 2.559 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)c1cc(Cl)sc1Cl ZINC000103211709 273000848 /nfs/dbraw/zinc/00/08/48/273000848.db2.gz ZLRUVAHSIQTECZ-UHFFFAOYSA-N 1 3 338.304 2.620 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000107835458 273008190 /nfs/dbraw/zinc/00/81/90/273008190.db2.gz BSDJEBVKXYIQQW-ROUUACIJSA-N 1 3 338.540 2.623 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)N(C)C)cc1 ZINC000279121528 273179024 /nfs/dbraw/zinc/17/90/24/273179024.db2.gz CVDCAZHYQAEWJS-SNRMKQJTSA-N 1 3 331.504 2.698 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)N(C)C)cc1 ZINC000279121528 273179026 /nfs/dbraw/zinc/17/90/26/273179026.db2.gz CVDCAZHYQAEWJS-SNRMKQJTSA-N 1 3 331.504 2.698 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)CC[N@@H+]1C ZINC000279265807 273195223 /nfs/dbraw/zinc/19/52/23/273195223.db2.gz VNDMGDZPOLAHLB-ULQDDVLXSA-N 1 3 349.544 2.807 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)CC[N@H+]1C ZINC000279265807 273195225 /nfs/dbraw/zinc/19/52/25/273195225.db2.gz VNDMGDZPOLAHLB-ULQDDVLXSA-N 1 3 349.544 2.807 10 0 EFAEHO CN(C)CCOc1ccccc1-c1noc(CC2CC[NH+](C)CC2)n1 ZINC000289013479 274693092 /nfs/dbraw/zinc/69/30/92/274693092.db2.gz KLNDZECOTLXRAC-UHFFFAOYSA-N 1 3 344.459 2.561 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@]2(O)CCC[C@@H]2C)CC1 ZINC000339554268 276013202 /nfs/dbraw/zinc/01/32/02/276013202.db2.gz BYZLKNLSEKRKKM-RXVVDRJESA-N 1 3 345.531 2.859 10 0 EFAEHO CCN(C(=O)N[C@H]1CCC[NH2+]C1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418491947 276062685 /nfs/dbraw/zinc/06/26/85/276062685.db2.gz TXZRAELCTZQWIZ-NEWSRXKRSA-N 1 3 344.503 2.605 10 0 EFAEHO CCN1CCC[C@@H]1CNC(=[NH2+])NC[C@H]1CC[C@H](c2ccccc2)O1 ZINC000377438644 276170891 /nfs/dbraw/zinc/17/08/91/276170891.db2.gz SOAUZNDUKJMSRY-KZNAEPCWSA-N 1 3 330.476 2.505 10 0 EFAEHO CN(C(=O)[C@H]1[NH2+]CCCC1(C)C)C1CCN(Cc2ccccc2)CC1 ZINC000261564319 276736078 /nfs/dbraw/zinc/73/60/78/276736078.db2.gz HFKQOHKQGPXENQ-LJQANCHMSA-N 1 3 343.515 2.888 10 0 EFAEHO CN1CC[C@H]([NH2+]CC2CCN(c3ccncc3)CC2)[C@H]2CCC[C@@H]21 ZINC000353397116 277170168 /nfs/dbraw/zinc/17/01/68/277170168.db2.gz WBKIGNGBOANFOO-AABGKKOBSA-N 1 3 328.504 2.760 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cc(F)ccc2N2CCOCC2)[C@H]2CCC[C@H]21 ZINC000353524758 277172249 /nfs/dbraw/zinc/17/22/49/277172249.db2.gz WVCMSQBIWQHTKF-WSTZPKSXSA-N 1 3 347.478 2.625 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cc(F)ccc2N2CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000353524755 277172408 /nfs/dbraw/zinc/17/24/08/277172408.db2.gz WVCMSQBIWQHTKF-BJLQDIEVSA-N 1 3 347.478 2.625 10 0 EFAEHO COc1cc2c(cc1OC)CC[NH+](CC[C@H]1CCCCN1C)CC2 ZINC000370496163 277393456 /nfs/dbraw/zinc/39/34/56/277393456.db2.gz KXDPAFAHGYWDBC-GOSISDBHSA-N 1 3 332.488 2.979 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@@H]1CCc2c1ccc(F)c2Br ZINC000423148022 277563807 /nfs/dbraw/zinc/56/38/07/277563807.db2.gz DUVBEJMSJDVDCB-QMTHXVAHSA-N 1 3 345.256 2.919 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21)N1CCc2ccccc2C1 ZINC000353502469 278209885 /nfs/dbraw/zinc/20/98/85/278209885.db2.gz LMPUMBLTDFEVBK-UMSONDCASA-N 1 3 327.516 2.896 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@@H+](C)[C@@H]2CCC[C@H]21)N1CCc2ccccc2C1 ZINC000353502469 278209887 /nfs/dbraw/zinc/20/98/87/278209887.db2.gz LMPUMBLTDFEVBK-UMSONDCASA-N 1 3 327.516 2.896 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000172549479 279123584 /nfs/dbraw/zinc/12/35/84/279123584.db2.gz VYBMSMHUJUDVIV-QGZVFWFLSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172549479 279123586 /nfs/dbraw/zinc/12/35/86/279123586.db2.gz VYBMSMHUJUDVIV-QGZVFWFLSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@H](CNC(=O)N(C)[C@@H]1CC[N@H+](C)[C@H](C)C1)N(C)Cc1ccccc1 ZINC000174833368 279328621 /nfs/dbraw/zinc/32/86/21/279328621.db2.gz MBSGHWWLXDXEMT-ZHALLVOQSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@H](CNC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1)N(C)Cc1ccccc1 ZINC000174833368 279328622 /nfs/dbraw/zinc/32/86/22/279328622.db2.gz MBSGHWWLXDXEMT-ZHALLVOQSA-N 1 3 346.519 2.631 10 0 EFAEHO CC1CC[NH+](C[C@H]2CCCN(C(=O)CC3CCN(C)CC3)C2)CC1 ZINC000364512060 281823813 /nfs/dbraw/zinc/82/38/13/281823813.db2.gz ASVBMSNGPKQPSB-LJQANCHMSA-N 1 3 335.536 2.689 10 0 EFAEHO CN(C)CCOc1cc(C[NH2+][C@@H]2CCCC[C@@H]2[C@@H]2CCOC2)ccn1 ZINC000364390258 289171493 /nfs/dbraw/zinc/17/14/93/289171493.db2.gz WUUNSMLECMIAGK-GUDVDZBRSA-N 1 3 347.503 2.707 10 0 EFAEHO CN(C)[C@@H](CNC(=O)C[NH2+][C@H]1CC2CCC1CC2)c1ccccc1 ZINC000433069529 289277906 /nfs/dbraw/zinc/27/79/06/289277906.db2.gz VMFOVYUNXBCOIY-VHZYLWGESA-N 1 3 329.488 2.574 10 0 EFAEHO COC[C@H](CC(C)C)[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000361698688 293090573 /nfs/dbraw/zinc/09/05/73/293090573.db2.gz KCZNIVWPTNWGMO-SFHVURJKSA-N 1 3 325.541 2.587 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000129076246 293123004 /nfs/dbraw/zinc/12/30/04/293123004.db2.gz SGQBOWROLRUCOD-QZTJIDSGSA-N 1 3 340.556 2.630 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NC[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000129076246 293123008 /nfs/dbraw/zinc/12/30/08/293123008.db2.gz SGQBOWROLRUCOD-QZTJIDSGSA-N 1 3 340.556 2.630 10 0 EFAEHO C[C@H](C[NH2+]C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)CN1CCCC1 ZINC000130007303 293150933 /nfs/dbraw/zinc/15/09/33/293150933.db2.gz QFNQDSFYSXXDCT-IAGOWNOFSA-N 1 3 339.524 2.955 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NC[C@H](c2ccccc2)N(C)C)CC1 ZINC000157654694 293550139 /nfs/dbraw/zinc/55/01/39/293550139.db2.gz ONLUVJNYSAXELF-LJQANCHMSA-N 1 3 346.519 2.711 10 0 EFAEHO C[NH+](C)CCc1ccccc1NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000290877384 294209803 /nfs/dbraw/zinc/20/98/03/294209803.db2.gz BDLJLGNUWVIMOS-LJQANCHMSA-N 1 3 335.467 2.942 10 0 EFAEHO C[NH+](C)CCc1ccccc1NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000290877373 294209878 /nfs/dbraw/zinc/20/98/78/294209878.db2.gz BDLJLGNUWVIMOS-IBGZPJMESA-N 1 3 335.467 2.942 10 0 EFAEHO NCC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2)C1 ZINC000414741896 295216454 /nfs/dbraw/zinc/21/64/54/295216454.db2.gz LFIYZKWJAQXPFX-QAPCUYQASA-N 1 3 333.451 2.550 10 0 EFAEHO NCC(=O)N1CCC[C@H](C[N@H+]2CCCC[C@H]2c2ccc(F)cc2)C1 ZINC000414741896 295216457 /nfs/dbraw/zinc/21/64/57/295216457.db2.gz LFIYZKWJAQXPFX-QAPCUYQASA-N 1 3 333.451 2.550 10 0 EFAEHO CC[C@H](NC1CC[NH+](CCc2ccccc2)CC1)[C@H](O)C(F)F ZINC000294935871 295248005 /nfs/dbraw/zinc/24/80/05/295248005.db2.gz BXBJEPYSXCZMEV-IRXDYDNUSA-N 1 3 326.431 2.688 10 0 EFAEHO CC[C@H](N[C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@H](O)C(F)F ZINC000294970443 295252617 /nfs/dbraw/zinc/25/26/17/295252617.db2.gz FRNBEQATJMDVFP-IWCQGFGOSA-N 1 3 326.431 2.891 10 0 EFAEHO CC[C@H](N[C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H](O)C(F)F ZINC000294970443 295252618 /nfs/dbraw/zinc/25/26/18/295252618.db2.gz FRNBEQATJMDVFP-IWCQGFGOSA-N 1 3 326.431 2.891 10 0 EFAEHO CN(CCN(C)C1CC[NH+](C)CC1)Cc1ccccc1OC1CC1 ZINC000294999499 295255917 /nfs/dbraw/zinc/25/59/17/295255917.db2.gz RKJDROBXZNJODW-UHFFFAOYSA-N 1 3 331.504 2.686 10 0 EFAEHO C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)NCCN1[C@@H](C)CCC[C@@H]1C ZINC000351890997 298268870 /nfs/dbraw/zinc/26/88/70/298268870.db2.gz WALKLTNEEOXPTR-YESZJQIVSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@H](C[NH2+]C1CCN(c2ccncc2)CC1)N(C)C(=O)OC(C)(C)C ZINC000298177942 310964749 /nfs/dbraw/zinc/96/47/49/310964749.db2.gz VBEUVXARBUUMTC-OAHLLOKOSA-N 1 3 348.491 2.895 10 0 EFAEHO CCc1c(C)[nH+]c2ccccc2c1N1CCN(C[C@H](O)CC)CC1 ZINC000301982135 311170269 /nfs/dbraw/zinc/17/02/69/311170269.db2.gz AEYZQQZTLUXOJU-MRXNPFEDSA-N 1 3 327.472 2.999 10 0 EFAEHO CON1CCC([NH2+][C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)CC1 ZINC000323410651 311240100 /nfs/dbraw/zinc/24/01/00/311240100.db2.gz WDQDISGHKQNPPP-YZGWKJHDSA-N 1 3 329.488 2.512 10 0 EFAEHO CC(C)n1cncc1CNCC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC000397525904 311960460 /nfs/dbraw/zinc/96/04/60/311960460.db2.gz XOUHJFUOUYCSMN-UHFFFAOYSA-N 1 3 342.487 2.581 10 0 EFAEHO C[C@H](NCC1(O)CC[NH+](Cc2ccccc2)CC1)c1cncc(F)c1 ZINC000397589393 311960656 /nfs/dbraw/zinc/96/06/56/311960656.db2.gz LJANPVWHXPYMOV-INIZCTEOSA-N 1 3 343.446 2.898 10 0 EFAEHO Clc1ccc(OC[C@H]2CCCO2)c(CNCC[C@@H]2CC[NH2+]C2)c1 ZINC000414824525 312054680 /nfs/dbraw/zinc/05/46/80/312054680.db2.gz AUMPCARJUJLLIZ-WMLDXEAASA-N 1 3 338.879 2.987 10 0 EFAEHO [NH3+]C[C@@H]1CC[C@H](NCc2cn(-c3ccc(Cl)cc3Cl)nn2)C1 ZINC000415027625 312079307 /nfs/dbraw/zinc/07/93/07/312079307.db2.gz BJPCJTJUGJPNBP-PWSUYJOCSA-N 1 3 340.258 2.791 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2CC[C@H](C)[C@@H](C[NH3+])C2)CC1 ZINC000415133249 312100331 /nfs/dbraw/zinc/10/03/31/312100331.db2.gz UZNHCCYDFGNXBW-ICSRJNTNSA-N 1 3 344.547 2.635 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2CC[C@@H](C)[C@H](C[NH3+])C2)CC1 ZINC000415133258 312100453 /nfs/dbraw/zinc/10/04/53/312100453.db2.gz UZNHCCYDFGNXBW-UYAOXDASSA-N 1 3 344.547 2.635 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)C[C@@H]1C ZINC000415961074 312185857 /nfs/dbraw/zinc/18/58/57/312185857.db2.gz QNXOHPVGRREZSC-ZFWWWQNUSA-N 1 3 348.466 2.808 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)C[C@@H]1C ZINC000415961074 312185858 /nfs/dbraw/zinc/18/58/58/312185858.db2.gz QNXOHPVGRREZSC-ZFWWWQNUSA-N 1 3 348.466 2.808 10 0 EFAEHO CCC[N@H+](C)C[C@@H]1CCN(C(=O)Nc2ccc3c(c2F)CCNC3)C1 ZINC000415964989 312186703 /nfs/dbraw/zinc/18/67/03/312186703.db2.gz YYIWYFUPJQLMPE-AWEZNQCLSA-N 1 3 348.466 2.667 10 0 EFAEHO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccc3c(c2F)CCNC3)C1 ZINC000415964989 312186705 /nfs/dbraw/zinc/18/67/05/312186705.db2.gz YYIWYFUPJQLMPE-AWEZNQCLSA-N 1 3 348.466 2.667 10 0 EFAEHO C[NH+](C)CCCC(C)(C)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415978801 312189486 /nfs/dbraw/zinc/18/94/86/312189486.db2.gz VMPIOSASFHXXHC-UHFFFAOYSA-N 1 3 336.455 2.713 10 0 EFAEHO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC[C@@H](N)c2ccccc2)C1 ZINC000417582143 312243650 /nfs/dbraw/zinc/24/36/50/312243650.db2.gz HNMYPVWNQKBSDW-FUHWJXTLSA-N 1 3 346.519 2.886 10 0 EFAEHO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NC[C@@H](N)c2ccccc2)C1 ZINC000417582143 312243653 /nfs/dbraw/zinc/24/36/53/312243653.db2.gz HNMYPVWNQKBSDW-FUHWJXTLSA-N 1 3 346.519 2.886 10 0 EFAEHO CC(C)CC[NH+]1CCC(CNC(=O)NC[C@@H](N)c2ccccc2)CC1 ZINC000417830952 312277409 /nfs/dbraw/zinc/27/74/09/312277409.db2.gz BWEGBPSAOVRSLD-LJQANCHMSA-N 1 3 346.519 2.744 10 0 EFAEHO CC1(C)CCCN[C@@H]1C(=O)Nc1cc(C[NH3+])cc(C(F)(F)F)c1 ZINC000417837751 312278601 /nfs/dbraw/zinc/27/86/01/312278601.db2.gz XUPZOYOCEZUHMG-CYBMUJFWSA-N 1 3 329.366 2.881 10 0 EFAEHO C[C@H](CCCC[NH3+])NC(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000418035670 312313687 /nfs/dbraw/zinc/31/36/87/312313687.db2.gz AVXPBOOMQZQRNY-XLIONFOSSA-N 1 3 346.519 2.858 10 0 EFAEHO CC1=CCN(CCNC(=O)NC[C@H]([NH3+])c2ccc(C(C)C)cc2)CC1 ZINC000418035154 312313715 /nfs/dbraw/zinc/31/37/15/312313715.db2.gz XQTMVHAVEPJQNA-IBGZPJMESA-N 1 3 344.503 2.761 10 0 EFAEHO CN(CC(C)(C)C[NH3+])C(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000418046847 312315900 /nfs/dbraw/zinc/31/59/00/312315900.db2.gz RJQJVKDVOYGUPO-FQEVSTJZSA-N 1 3 346.519 2.667 10 0 EFAEHO CC[C@H](C)N[C@@H](CNC(=O)NC[C@@H]([NH3+])c1ccccc1)c1ccco1 ZINC000418168366 312338669 /nfs/dbraw/zinc/33/86/69/312338669.db2.gz OBUFADFEVYCMLT-UAGQMJEPSA-N 1 3 344.459 2.708 10 0 EFAEHO CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N(C)C[C@H]1CCCN1C ZINC000420773506 312387371 /nfs/dbraw/zinc/38/73/71/312387371.db2.gz AXQVUIUPMZZDHP-LJQANCHMSA-N 1 3 346.519 2.762 10 0 EFAEHO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)N(C)C[C@H]1CCCN1C ZINC000420773506 312387372 /nfs/dbraw/zinc/38/73/72/312387372.db2.gz AXQVUIUPMZZDHP-LJQANCHMSA-N 1 3 346.519 2.762 10 0 EFAEHO C[C@@H]1C[C@H](C)[C@H](C)[N@H+](CC(=O)NC[C@H](c2ccccc2)N(C)C)C1 ZINC000475740579 313226251 /nfs/dbraw/zinc/22/62/51/313226251.db2.gz CITAOJFKMZPEKV-VUHPKUFZSA-N 1 3 331.504 2.772 10 0 EFAEHO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](CC(=O)NC[C@H](c2ccccc2)N(C)C)C1 ZINC000475740579 313226254 /nfs/dbraw/zinc/22/62/54/313226254.db2.gz CITAOJFKMZPEKV-VUHPKUFZSA-N 1 3 331.504 2.772 10 0 EFAEHO CN(C(=O)NCC1([NH+](C)C)CCCCCC1)[C@H]1CCN(C2CC2)C1 ZINC000476382897 313232676 /nfs/dbraw/zinc/23/26/76/313232676.db2.gz YBOQRGJGAMNCLQ-KRWDZBQOSA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)(C)N1CCC([NH2+]C[C@H](CO)Cc2ccc(F)c(F)c2)CC1 ZINC000477915557 313246379 /nfs/dbraw/zinc/24/63/79/313246379.db2.gz KXDUKPGTQKGDJH-OAHLLOKOSA-N 1 3 340.458 2.968 10 0 EFAEHO CC(C)(C)[NH+]1CCC(NC[C@H](CO)Cc2ccc(F)c(F)c2)CC1 ZINC000477915557 313246380 /nfs/dbraw/zinc/24/63/80/313246380.db2.gz KXDUKPGTQKGDJH-OAHLLOKOSA-N 1 3 340.458 2.968 10 0 EFAEHO CC(C)CC[C@H]1CCC[C@H]1[NH2+]CC(=O)NC1CCN(C2CC2)CC1 ZINC000493637588 314427513 /nfs/dbraw/zinc/42/75/13/314427513.db2.gz YXTVXKAPUUFHLE-VQIMIIECSA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1nc2ccc(C[NH2+]C3CCN(CCN(C)C)CC3)cc2s1 ZINC000494295452 314571291 /nfs/dbraw/zinc/57/12/91/314571291.db2.gz KNEVQZJDRJZYME-UHFFFAOYSA-N 1 3 332.517 2.720 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[N@H+](C)C1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000524300300 316153467 /nfs/dbraw/zinc/15/34/67/316153467.db2.gz JXKXIMQLOAMFOS-BHIYHBOVSA-N 1 3 329.488 2.622 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[N@@H+](C)C1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000524300300 316153471 /nfs/dbraw/zinc/15/34/71/316153471.db2.gz JXKXIMQLOAMFOS-BHIYHBOVSA-N 1 3 329.488 2.622 10 0 EFAEHO CN(CCC(=O)Nc1ccccc1CC[NH+](C)C)c1ccncc1 ZINC000527363950 316373213 /nfs/dbraw/zinc/37/32/13/316373213.db2.gz BSYVYQFIPCOWTH-UHFFFAOYSA-N 1 3 326.444 2.651 10 0 EFAEHO C[C@@]1(C[NH2+]C2CCN(c3ccncc3)CC2)COc2ccccc2O1 ZINC000529637197 316936637 /nfs/dbraw/zinc/93/66/37/316936637.db2.gz PFTZUFVZSXGXLN-HXUWFJFHSA-N 1 3 339.439 2.870 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCC1)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC000530030196 317032082 /nfs/dbraw/zinc/03/20/82/317032082.db2.gz YLMSCUURIGGHQX-MOPGFXCFSA-N 1 3 333.520 2.917 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCC1)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC000530030196 317032083 /nfs/dbraw/zinc/03/20/83/317032083.db2.gz YLMSCUURIGGHQX-MOPGFXCFSA-N 1 3 333.520 2.917 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@](C)(O)CCC)CC1 ZINC000532041011 317346574 /nfs/dbraw/zinc/34/65/74/317346574.db2.gz TXYBJEDSEUPUCS-HXUWFJFHSA-N 1 3 333.520 2.859 10 0 EFAEHO C[C@@H]1CCC[C@@](CNC(=O)CCN(C)c2ccncc2)([NH+](C)C)C1 ZINC000540927320 317759055 /nfs/dbraw/zinc/75/90/55/317759055.db2.gz DLNMZBPKHBTRBQ-VQIMIIECSA-N 1 3 332.492 2.535 10 0 EFAEHO C[C@@H](NC(=O)CCN(C)c1cc[nH+]cc1)[C@@H](c1ccccc1)N(C)C ZINC000548104540 318073713 /nfs/dbraw/zinc/07/37/13/318073713.db2.gz UXOJOHRQCVHZJW-UZLBHIALSA-N 1 3 340.471 2.716 10 0 EFAEHO CC[NH+]1CCC(NC(=O)CN[C@H](c2ccc(Cl)cc2)C2CC2)CC1 ZINC000552836708 318264576 /nfs/dbraw/zinc/26/45/76/318264576.db2.gz PVXWWUPBKHAXTH-IBGZPJMESA-N 1 3 349.906 2.981 10 0 EFAEHO CN(C)[C@H](CNC(=O)CC[C@H]1CCCC[N@@H+]1C)Cc1ccccc1 ZINC000554224640 318304166 /nfs/dbraw/zinc/30/41/66/318304166.db2.gz PYUUTCFSYFEOCH-MOPGFXCFSA-N 1 3 331.504 2.540 10 0 EFAEHO CN(C)[C@H](CNC(=O)CC[C@H]1CCCC[N@H+]1C)Cc1ccccc1 ZINC000554224640 318304168 /nfs/dbraw/zinc/30/41/68/318304168.db2.gz PYUUTCFSYFEOCH-MOPGFXCFSA-N 1 3 331.504 2.540 10 0 EFAEHO CN(C)[C@H](CNC(=O)CC[C@@H]1CCCC[N@@H+]1C)Cc1ccccc1 ZINC000554224641 318304185 /nfs/dbraw/zinc/30/41/85/318304185.db2.gz PYUUTCFSYFEOCH-OALUTQOASA-N 1 3 331.504 2.540 10 0 EFAEHO CN(C)[C@H](CNC(=O)CC[C@@H]1CCCC[N@H+]1C)Cc1ccccc1 ZINC000554224641 318304187 /nfs/dbraw/zinc/30/41/87/318304187.db2.gz PYUUTCFSYFEOCH-OALUTQOASA-N 1 3 331.504 2.540 10 0 EFAEHO N[C@@H]1CCC[C@@H]([NH2+]C2CCN(c3ccc(C(F)(F)F)cn3)CC2)C1 ZINC000566480817 319082774 /nfs/dbraw/zinc/08/27/74/319082774.db2.gz AWUMTZZYEHJIFY-UKRRQHHQSA-N 1 3 342.409 2.929 10 0 EFAEHO CCCN(CCN(C)C)C(=O)c1ccccc1CC1CC[NH2+]CC1 ZINC000566975676 319127815 /nfs/dbraw/zinc/12/78/15/319127815.db2.gz HRNPKIQGVNBHER-UHFFFAOYSA-N 1 3 331.504 2.643 10 0 EFAEHO COC(=O)[C@H](C)[C@@H](NCc1ccc2c(c1)C[NH2+]CC2)c1ccccc1 ZINC000566978352 319128175 /nfs/dbraw/zinc/12/81/75/319128175.db2.gz HTDZKHACXYBQFU-FOIQADDNSA-N 1 3 338.451 2.972 10 0 EFAEHO Cc1ccc(C)c(OC[C@@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1C ZINC000567104436 319138787 /nfs/dbraw/zinc/13/87/87/319138787.db2.gz NERMQXMPQIYTEU-NXEWRWPSSA-N 1 3 346.515 2.956 10 0 EFAEHO Cc1ccc(C)c(OC[C@@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1C ZINC000567104436 319138788 /nfs/dbraw/zinc/13/87/88/319138788.db2.gz NERMQXMPQIYTEU-NXEWRWPSSA-N 1 3 346.515 2.956 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[NH2+][C@@H]1C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000567267103 319156149 /nfs/dbraw/zinc/15/61/49/319156149.db2.gz SEZGODUCFXNQCC-ZAWLATJESA-N 1 3 329.488 2.668 10 0 EFAEHO CC(C)c1ccc([C@@H](N)CNC(=O)N2CCC[C@]3(CC[NH2+]C3)C2)cc1 ZINC000567597190 319186944 /nfs/dbraw/zinc/18/69/44/319186944.db2.gz YDQLYOYEFHQSIC-AZUAARDMSA-N 1 3 344.503 2.595 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CN(C)C(=O)CN3CC[C@@H](C)C3)C2)s1 ZINC000567750836 319207453 /nfs/dbraw/zinc/20/74/53/319207453.db2.gz JOYQAHYCOOCYJT-WBVHZDCISA-N 1 3 349.544 2.679 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)C(=O)CN3CC[C@@H](C)C3)C2)s1 ZINC000567750836 319207454 /nfs/dbraw/zinc/20/74/54/319207454.db2.gz JOYQAHYCOOCYJT-WBVHZDCISA-N 1 3 349.544 2.679 10 0 EFAEHO O=C(CC1CCN(Cc2ccc3c(c2)C[NH2+]CC3)CC1)N1CCCC1 ZINC000568051572 319240978 /nfs/dbraw/zinc/24/09/78/319240978.db2.gz RIQRFSNMMVJEMX-UHFFFAOYSA-N 1 3 341.499 2.557 10 0 EFAEHO CC[C@H](NC(=O)C1CCN(C2CC[NH+](CC)CC2)CC1)C(F)(F)F ZINC000568106478 319247802 /nfs/dbraw/zinc/24/78/02/319247802.db2.gz QZQNHUOYJBJKNF-HNNXBMFYSA-N 1 3 349.441 2.640 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)C1 ZINC000568412590 319282257 /nfs/dbraw/zinc/28/22/57/319282257.db2.gz ZQPAQSUVNJSKQL-SFHVURJKSA-N 1 3 343.515 2.877 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+][C@H]1CCCCNC1 ZINC000568486467 319287995 /nfs/dbraw/zinc/28/79/95/319287995.db2.gz AAVXAVJVWYLWSB-OCCSQVGLSA-N 1 3 339.867 2.797 10 0 EFAEHO Cc1noc(C2CCC([NH2+][C@H](C)c3ccc(CN)nc3C)CC2)n1 ZINC000568856501 319324889 /nfs/dbraw/zinc/32/48/89/319324889.db2.gz LMZGFDQTVPOROM-VCANKDNSSA-N 1 3 329.448 2.917 10 0 EFAEHO O=C1C[C@@H](N[C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CN1C1CC1 ZINC000568984238 319336875 /nfs/dbraw/zinc/33/68/75/319336875.db2.gz SMVMOFYZWVEOPV-QZTJIDSGSA-N 1 3 339.483 2.537 10 0 EFAEHO O=C1C[C@@H](N[C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CN1C1CC1 ZINC000568984238 319336878 /nfs/dbraw/zinc/33/68/78/319336878.db2.gz SMVMOFYZWVEOPV-QZTJIDSGSA-N 1 3 339.483 2.537 10 0 EFAEHO [NH3+]C[C@@H]1CCCC[C@H]1NCc1ccc(Cn2ccccc2=O)cc1 ZINC000571275854 319558308 /nfs/dbraw/zinc/55/83/08/319558308.db2.gz USNBNXOKRFZXOE-RBUKOAKNSA-N 1 3 325.456 2.504 10 0 EFAEHO Cc1nc(CCN[C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c(C)o1 ZINC000572392045 319665596 /nfs/dbraw/zinc/66/55/96/319665596.db2.gz FJEPGMDOJLEMSV-HKUYNNGSSA-N 1 3 327.428 2.679 10 0 EFAEHO OCC1(CN[C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)CC2(CCC2)C1 ZINC000572712668 319696973 /nfs/dbraw/zinc/69/69/73/319696973.db2.gz PAAHQTWDGIUHTH-DYESRHJHSA-N 1 3 342.483 2.775 10 0 EFAEHO Cc1noc(CCN[C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)n1 ZINC000576584154 320029593 /nfs/dbraw/zinc/02/95/93/320029593.db2.gz LLOKQGKUMYCHMO-QGZVFWFLSA-N 1 3 326.444 2.707 10 0 EFAEHO Cc1noc(CCN[C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)n1 ZINC000576584154 320029595 /nfs/dbraw/zinc/02/95/95/320029595.db2.gz LLOKQGKUMYCHMO-QGZVFWFLSA-N 1 3 326.444 2.707 10 0 EFAEHO [NH3+]C[C@@H]1CCCN(C(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000576687229 320039045 /nfs/dbraw/zinc/03/90/45/320039045.db2.gz GAUFACYLOFTABH-KRWDZBQOSA-N 1 3 344.503 2.553 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH+]2CCC3(CCO3)CC2)CC1 ZINC000576718980 320042906 /nfs/dbraw/zinc/04/29/06/320042906.db2.gz UTKURMMXSXEBPL-UHFFFAOYSA-N 1 3 343.515 2.974 10 0 EFAEHO CC(C)Oc1ccc([C@H](CNC(=O)C[N@@H+]2CC[C@H](C)C2)N(C)C)cc1 ZINC000576956098 320064910 /nfs/dbraw/zinc/06/49/10/320064910.db2.gz XBYJAYZBIDXCGO-LPHOPBHVSA-N 1 3 347.503 2.535 10 0 EFAEHO CC(C)Oc1ccc([C@H](CNC(=O)C[N@H+]2CC[C@H](C)C2)N(C)C)cc1 ZINC000576956098 320064913 /nfs/dbraw/zinc/06/49/13/320064913.db2.gz XBYJAYZBIDXCGO-LPHOPBHVSA-N 1 3 347.503 2.535 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)C[NH2+]C[C@H]1CCN(C2CC2)C1 ZINC000577485334 320115144 /nfs/dbraw/zinc/11/51/44/320115144.db2.gz SCVLNRVHQINMIB-AEFFLSMTSA-N 1 3 332.488 2.624 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)CNC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000577485334 320115145 /nfs/dbraw/zinc/11/51/45/320115145.db2.gz SCVLNRVHQINMIB-AEFFLSMTSA-N 1 3 332.488 2.624 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)CNC[C@H]1CC[N@H+](C2CC2)C1 ZINC000577485334 320115146 /nfs/dbraw/zinc/11/51/46/320115146.db2.gz SCVLNRVHQINMIB-AEFFLSMTSA-N 1 3 332.488 2.624 10 0 EFAEHO [NH3+]C[C@@H]1CC[C@@H](NC(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000577604632 320126451 /nfs/dbraw/zinc/12/64/51/320126451.db2.gz OYNGGHMNBGLKDV-VQIMIIECSA-N 1 3 344.503 2.599 10 0 EFAEHO [NH3+][C@H]1C[C@@H](N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)c2ccccc21 ZINC000578617095 320222105 /nfs/dbraw/zinc/22/21/05/320222105.db2.gz VPDSFJILXJUJTJ-LVFSCSRESA-N 1 3 327.472 2.902 10 0 EFAEHO CC(C)N1C[C@@H](N[C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1=O ZINC000578768445 320238263 /nfs/dbraw/zinc/23/82/63/320238263.db2.gz BTDQUZNHSSQIOB-OALUTQOASA-N 1 3 341.499 2.783 10 0 EFAEHO CC(C)N1C[C@@H](N[C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1=O ZINC000578768445 320238265 /nfs/dbraw/zinc/23/82/65/320238265.db2.gz BTDQUZNHSSQIOB-OALUTQOASA-N 1 3 341.499 2.783 10 0 EFAEHO c1cn(CCC[NH2+][C@H]2CCC[C@H]3CN(Cc4ccccc4)C[C@H]32)nn1 ZINC000183204989 323321757 /nfs/dbraw/zinc/32/17/57/323321757.db2.gz FMPMBFNUZVBUHP-ZCNNSNEGSA-N 1 3 339.487 2.559 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)N(C)CCC[NH+](C)C)CC1 ZINC000186225935 323405391 /nfs/dbraw/zinc/40/53/91/323405391.db2.gz MMMGPQFSOCHEAJ-QGZVFWFLSA-N 1 3 346.519 2.805 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H](CO)C(C)C)CC1 ZINC000579282541 323923985 /nfs/dbraw/zinc/92/39/85/323923985.db2.gz NHXMLQDQBGYXAO-LJQANCHMSA-N 1 3 333.520 2.573 10 0 EFAEHO Cc1cc(NC(=O)CC[C@@H](C)[NH3+])cc(N2CCN(C(C)C)CC2)c1 ZINC000579830363 324040899 /nfs/dbraw/zinc/04/08/99/324040899.db2.gz YZNFVIIEDSGWTE-MRXNPFEDSA-N 1 3 332.492 2.591 10 0 EFAEHO C[C@@H](NCCC1=CC[NH2+]CC1)c1ccc(-n2cncn2)cc1Cl ZINC000580062581 324088404 /nfs/dbraw/zinc/08/84/04/324088404.db2.gz BRCWEFZMUBRBHI-CYBMUJFWSA-N 1 3 331.851 2.881 10 0 EFAEHO C[C@H](C[C@H](C)[NH3+])NC(=O)NCc1ccccc1CN1CCCCC1 ZINC000580548819 324185566 /nfs/dbraw/zinc/18/55/66/324185566.db2.gz LCMAAKDDVWBRKQ-JKSUJKDBSA-N 1 3 332.492 2.598 10 0 EFAEHO CN(C)CCC[N@H+](C)CCNc1ccnc(Cc2ccc(F)cc2)n1 ZINC000621335785 450688800 /nfs/dbraw/zinc/68/88/00/450688800.db2.gz ZAIDPKRDXHSPAJ-UHFFFAOYSA-N 1 3 345.466 2.502 10 0 EFAEHO CN(C)CCC[N@@H+](C)CCNc1ccnc(Cc2ccc(F)cc2)n1 ZINC000621335785 450688805 /nfs/dbraw/zinc/68/88/05/450688805.db2.gz ZAIDPKRDXHSPAJ-UHFFFAOYSA-N 1 3 345.466 2.502 10 0 EFAEHO CCN1CCN([C@@H](C)C[NH2+][C@H]2CCCOc3ccc(C)cc32)CC1 ZINC000155657652 472589751 /nfs/dbraw/zinc/58/97/51/472589751.db2.gz FBEKFSLCRIROOK-HKUYNNGSSA-N 1 3 331.504 2.824 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000111816740 473229114 /nfs/dbraw/zinc/22/91/14/473229114.db2.gz YEGULEHGXNRTRA-DLBZAZTESA-N 1 3 334.508 2.536 10 0 EFAEHO CC[C@H](C)CN(C)c1ccc(F)cc1CNCCOCC[NH+](C)C ZINC000095997198 473250004 /nfs/dbraw/zinc/25/00/04/473250004.db2.gz SYPHNQLLWLGBQF-INIZCTEOSA-N 1 3 339.499 2.976 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@H](O)CO[C@@H]2CCCc3ccccc32)CC[N@@H+]1C ZINC000177058905 473296244 /nfs/dbraw/zinc/29/62/44/473296244.db2.gz SBTHUEFKXQEDBJ-RDPOXOKHSA-N 1 3 346.515 2.856 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@H](O)CO[C@@H]2CCCc3ccccc32)CC[N@H+]1C ZINC000177058905 473296249 /nfs/dbraw/zinc/29/62/49/473296249.db2.gz SBTHUEFKXQEDBJ-RDPOXOKHSA-N 1 3 346.515 2.856 10 0 EFAEHO Cn1cc(-c2cc(CN3CCC(CCC[NH+](C)C)CC3)on2)cn1 ZINC000185045644 473310797 /nfs/dbraw/zinc/31/07/97/473310797.db2.gz KPGXSEJQDKCDPA-UHFFFAOYSA-N 1 3 331.464 2.629 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2C[C@@H]3CCC[C@@]3([NH3+])C2)CC1 ZINC000622004347 479878307 /nfs/dbraw/zinc/87/83/07/479878307.db2.gz NPVZIOFOLRBNGH-PZJWPPBQSA-N 1 3 342.531 2.532 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)[C@@H](C)[NH3+] ZINC000399354731 476882594 /nfs/dbraw/zinc/88/25/94/476882594.db2.gz FJQBDUAPJXWVHN-QRQLOZEOSA-N 1 3 331.504 2.729 10 0 EFAEHO OC1CCN(Cc2ccc(OCCC[NH+]3CCCCC3)cc2)CC1 ZINC000001552004 471393589 /nfs/dbraw/zinc/39/35/89/471393589.db2.gz OZHWKCSDZSJHKE-UHFFFAOYSA-N 1 3 332.488 2.898 10 0 EFAEHO CC(=O)Nc1cccc(CNCC2CC[NH+](C3CCOCC3)CC2)c1 ZINC000631171574 479938218 /nfs/dbraw/zinc/93/82/18/479938218.db2.gz KAOMJLQQRPLCAC-UHFFFAOYSA-N 1 3 345.487 2.626 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000067705089 472076303 /nfs/dbraw/zinc/07/63/03/472076303.db2.gz CWVPJNFTOYUDMP-SJLPKXTDSA-N 1 3 334.508 2.627 10 0 EFAEHO C[C@@H]1C[C@H](NCc2ccccc2N(C)C2CC[NH+](C)CC2)[C@@H](C)O1 ZINC000631223309 479968967 /nfs/dbraw/zinc/96/89/67/479968967.db2.gz SYGQYVXUXDKUBP-MDZRGWNJSA-N 1 3 331.504 2.873 10 0 EFAEHO CCN1CC[C@H](C[NH2+]Cc2ccc(I)cc2)C1 ZINC000088174358 472344521 /nfs/dbraw/zinc/34/45/21/472344521.db2.gz WMPVNKUBIFJOPA-CYBMUJFWSA-N 1 3 344.240 2.723 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H]2CCC[C@@H](O)C2)CC1 ZINC000088728683 472382191 /nfs/dbraw/zinc/38/21/91/472382191.db2.gz HUMDZQQNMYORPW-AZUAARDMSA-N 1 3 345.531 2.859 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000057171711 472390557 /nfs/dbraw/zinc/39/05/57/472390557.db2.gz QHGZLGDWMNOKQE-AZUAARDMSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000057171711 472390563 /nfs/dbraw/zinc/39/05/63/472390563.db2.gz QHGZLGDWMNOKQE-AZUAARDMSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000057171944 472390996 /nfs/dbraw/zinc/39/09/96/472390996.db2.gz XETBGHINFDWPOX-GOSISDBHSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)[NH+](CCNC(=O)N[C@H](Cc1ccccc1)CN(C)C)C(C)C ZINC000057205578 472395200 /nfs/dbraw/zinc/39/52/00/472395200.db2.gz KLJKUJRAAQQQSN-LJQANCHMSA-N 1 3 348.535 2.577 10 0 EFAEHO COc1cc(Br)ccc1CNCC1CC[NH+](C)CC1 ZINC000097081252 472434788 /nfs/dbraw/zinc/43/47/88/472434788.db2.gz QSAICFZQZUTMOS-UHFFFAOYSA-N 1 3 327.266 2.889 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2cccc(CN(C)C)c2)[C@H](C)C1 ZINC000128405341 472447644 /nfs/dbraw/zinc/44/76/44/472447644.db2.gz UNIFPVYSYVCCAB-VQIMIIECSA-N 1 3 346.519 2.620 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)NCc2cccc(CN(C)C)c2)[C@H](C)C1 ZINC000128405341 472447650 /nfs/dbraw/zinc/44/76/50/472447650.db2.gz UNIFPVYSYVCCAB-VQIMIIECSA-N 1 3 346.519 2.620 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H](Cc2ccccc2)C[NH+](C)C)c1 ZINC000155878983 472632335 /nfs/dbraw/zinc/63/23/35/472632335.db2.gz VFPOYTZFXMSFFE-FQEVSTJZSA-N 1 3 339.483 2.651 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCC([NH+]3CCCC3)CC2)c1 ZINC000047505535 472723184 /nfs/dbraw/zinc/72/31/84/472723184.db2.gz FCVUICHGFSAFQD-UHFFFAOYSA-N 1 3 330.476 2.840 10 0 EFAEHO C[N@H+](C[C@@H]1CCCO1)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000105862866 472792604 /nfs/dbraw/zinc/79/26/04/472792604.db2.gz LCVJAKDIYMBPHR-PMACEKPBSA-N 1 3 332.488 2.543 10 0 EFAEHO C[N@@H+](C[C@@H]1CCCO1)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000105862866 472792611 /nfs/dbraw/zinc/79/26/11/472792611.db2.gz LCVJAKDIYMBPHR-PMACEKPBSA-N 1 3 332.488 2.543 10 0 EFAEHO O=C(NCCN1CCCCC1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000078954356 472794635 /nfs/dbraw/zinc/79/46/35/472794635.db2.gz QNTQYZMILUUHFS-UHFFFAOYSA-N 1 3 344.503 2.568 10 0 EFAEHO C[C@@H](O)C[NH+]1CCC(CN(C)Cc2cc(F)c(F)c(F)c2)CC1 ZINC000121123121 472801396 /nfs/dbraw/zinc/80/13/96/472801396.db2.gz GXEHZOCNRZOBQF-GFCCVEGCSA-N 1 3 330.394 2.629 10 0 EFAEHO CCC[C@H](C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)N(C)C ZINC000134020949 472865550 /nfs/dbraw/zinc/86/55/50/472865550.db2.gz YQNZQZWEBUTDHH-BHIYHBOVSA-N 1 3 331.504 2.886 10 0 EFAEHO CCC[C@H](C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)N(C)C ZINC000134020949 472865556 /nfs/dbraw/zinc/86/55/56/472865556.db2.gz YQNZQZWEBUTDHH-BHIYHBOVSA-N 1 3 331.504 2.886 10 0 EFAEHO C[N@H+](CC1CCN(C[C@H](O)c2ccccc2)CC1)C[C@H]1CCCCO1 ZINC000106662854 472879148 /nfs/dbraw/zinc/87/91/48/472879148.db2.gz WUWBDSDDWDHEQZ-RTWAWAEBSA-N 1 3 346.515 2.933 10 0 EFAEHO C[N@@H+](CC1CCN(C[C@H](O)c2ccccc2)CC1)C[C@H]1CCCCO1 ZINC000106662854 472879153 /nfs/dbraw/zinc/87/91/53/472879153.db2.gz WUWBDSDDWDHEQZ-RTWAWAEBSA-N 1 3 346.515 2.933 10 0 EFAEHO CCN(CC)CCOc1ccccc1/C=C/C(=O)C1CC[NH2+]CC1 ZINC000048523060 472886055 /nfs/dbraw/zinc/88/60/55/472886055.db2.gz ZOUPRDYYUVAIAT-MDZDMXLPSA-N 1 3 330.472 2.989 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NC[C@@H](C)N2CCC(C)CC2)CC1 ZINC000073897576 472896800 /nfs/dbraw/zinc/89/68/00/472896800.db2.gz WBCAKAFEYBFWSP-QGZVFWFLSA-N 1 3 338.540 2.528 10 0 EFAEHO CC[NH+]1CCC(CCN[C@H](C)c2ccc(S(C)(=O)=O)cc2)CC1 ZINC000121819759 472922605 /nfs/dbraw/zinc/92/26/05/472922605.db2.gz MRBQNFFBTMCDIH-OAHLLOKOSA-N 1 3 338.517 2.863 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)N(C)C ZINC000620191721 480021548 /nfs/dbraw/zinc/02/15/48/480021548.db2.gz BYCSDRQRQBFHAP-RTBURBONSA-N 1 3 343.515 2.745 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)N(C)C ZINC000620191721 480021551 /nfs/dbraw/zinc/02/15/51/480021551.db2.gz BYCSDRQRQBFHAP-RTBURBONSA-N 1 3 343.515 2.745 10 0 EFAEHO C[N@H+](CCC1CCN(c2ccncc2)CC1)C[C@@H](O)COC(C)(C)C ZINC000092821641 472991865 /nfs/dbraw/zinc/99/18/65/472991865.db2.gz GMQKILJXXNMADV-LJQANCHMSA-N 1 3 349.519 2.796 10 0 EFAEHO C[N@@H+](CCC1CCN(c2ccncc2)CC1)C[C@@H](O)COC(C)(C)C ZINC000092821641 472991869 /nfs/dbraw/zinc/99/18/69/472991869.db2.gz GMQKILJXXNMADV-LJQANCHMSA-N 1 3 349.519 2.796 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2CCC[C@H]([NH+](C)C)C2)CC1 ZINC000092938515 473010479 /nfs/dbraw/zinc/01/04/79/473010479.db2.gz APVDDBSMIWSSJJ-FQEVSTJZSA-N 1 3 344.547 2.745 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)N(CCN(C)C)C2CCCC2)CC1 ZINC000123059437 473091781 /nfs/dbraw/zinc/09/17/81/473091781.db2.gz LTIINDXQEXWNNR-UHFFFAOYSA-N 1 3 338.540 2.624 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](CCCCO)C2CC2)CC1 ZINC000093383160 473098974 /nfs/dbraw/zinc/09/89/74/473098974.db2.gz WSYYOTVQOZQXJD-UHFFFAOYSA-N 1 3 345.531 2.956 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](CCCCO)C2CC2)CC1 ZINC000093383160 473098981 /nfs/dbraw/zinc/09/89/81/473098981.db2.gz WSYYOTVQOZQXJD-UHFFFAOYSA-N 1 3 345.531 2.956 10 0 EFAEHO CN1CCC[C@H](NC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000052519290 473117273 /nfs/dbraw/zinc/11/72/73/473117273.db2.gz JEXIAVKTQFEQGF-IBGZPJMESA-N 1 3 344.503 2.566 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)Nc1ccc(C)s1 ZINC000075413593 473184524 /nfs/dbraw/zinc/18/45/24/473184524.db2.gz JAEAHVWMJNWAND-OAHLLOKOSA-N 1 3 338.521 2.936 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)Nc1ccc(C)s1 ZINC000075413593 473184531 /nfs/dbraw/zinc/18/45/31/473184531.db2.gz JAEAHVWMJNWAND-OAHLLOKOSA-N 1 3 338.521 2.936 10 0 EFAEHO C[C@@H]([NH2+]C(C)(C)CNC(=O)NC[C@@H]1CCCN1C)c1ccccc1 ZINC000113604372 473407896 /nfs/dbraw/zinc/40/78/96/473407896.db2.gz WNOODSZTQIVTMT-WBVHZDCISA-N 1 3 332.492 2.509 10 0 EFAEHO O=C(CN1CCC[C@]2(CC=CCC2)C1)NC1CC[NH+](C2CC2)CC1 ZINC000114494221 473476723 /nfs/dbraw/zinc/47/67/23/473476723.db2.gz ZMDDMENAPTXPLG-HXUWFJFHSA-N 1 3 331.504 2.552 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)N(C)CCC[NH+](C)C)CCN1Cc1ccccc1 ZINC000186406589 473669781 /nfs/dbraw/zinc/66/97/81/473669781.db2.gz HLPRVMSDSCZJJX-MJGOQNOKSA-N 1 3 346.519 2.633 10 0 EFAEHO Cn1c2ccc(C[NH2+]C3CCN(CC4CC4)CC3)cc2sc1=O ZINC000192484647 473684722 /nfs/dbraw/zinc/68/47/22/473684722.db2.gz SPXBFBIRMGROJX-UHFFFAOYSA-N 1 3 331.485 2.564 10 0 EFAEHO C[C@H](C[NH+]1CCCCC1)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000245702273 473738744 /nfs/dbraw/zinc/73/87/44/473738744.db2.gz ZOAGBYJFUZVSEM-NEWSRXKRSA-N 1 3 344.503 2.605 10 0 EFAEHO Cc1scc(C(=O)NC2CCN(C3CC[NH+](C)CC3)CC2)c1C ZINC000179904675 473752434 /nfs/dbraw/zinc/75/24/34/473752434.db2.gz ZDPOYZFMMHDJLH-UHFFFAOYSA-N 1 3 335.517 2.653 10 0 EFAEHO COCC[N@H+](C)CCCC1CCN(Cc2cnn3ccccc23)CC1 ZINC000180039887 473783386 /nfs/dbraw/zinc/78/33/86/473783386.db2.gz SRZWLSXSGHIOLP-UHFFFAOYSA-N 1 3 344.503 2.905 10 0 EFAEHO COCC[N@@H+](C)CCCC1CCN(Cc2cnn3ccccc23)CC1 ZINC000180039887 473783396 /nfs/dbraw/zinc/78/33/96/473783396.db2.gz SRZWLSXSGHIOLP-UHFFFAOYSA-N 1 3 344.503 2.905 10 0 EFAEHO CCC[NH+](CCC)CCCNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000246181586 473794181 /nfs/dbraw/zinc/79/41/81/473794181.db2.gz LVUDSMKRDDTLPV-IRXDYDNUSA-N 1 3 326.529 2.623 10 0 EFAEHO CC(C)N1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)C1=O ZINC000180145096 473809903 /nfs/dbraw/zinc/80/99/03/473809903.db2.gz SGAXLRBLQGNQRG-NXEWRWPSSA-N 1 3 341.499 2.781 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@@H]1C[NH+]1CCCC1 ZINC000263774621 473843140 /nfs/dbraw/zinc/84/31/40/473843140.db2.gz FXGJPOUWRKGPLX-HXUWFJFHSA-N 1 3 341.499 2.983 10 0 EFAEHO C[NH+](C)C[C@](C)(O)CNC1CC(c2ccc(Br)cc2)C1 ZINC000194124254 473846741 /nfs/dbraw/zinc/84/67/41/473846741.db2.gz YAEKTZKCHFMXOP-AVVWSFFYSA-N 1 3 341.293 2.597 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)C1 ZINC000246402721 473852755 /nfs/dbraw/zinc/85/27/55/473852755.db2.gz RQVXZHXOGXHYLY-KURKYZTESA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)C1 ZINC000246402721 473852759 /nfs/dbraw/zinc/85/27/59/473852759.db2.gz RQVXZHXOGXHYLY-KURKYZTESA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H]1CCC[C@](CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)([NH+](C)C)C1 ZINC000246450986 473867001 /nfs/dbraw/zinc/86/70/01/473867001.db2.gz UPNPRZUVJZWTND-VXNCWWDNSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)NCCC[N@H+](C)Cc2ccccc2)CCN1C ZINC000173535778 473870082 /nfs/dbraw/zinc/87/00/82/473870082.db2.gz QELUYDOBNHGCRP-PKOBYXMFSA-N 1 3 346.519 2.633 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)NCCC[N@@H+](C)Cc2ccccc2)CCN1C ZINC000173535778 473870088 /nfs/dbraw/zinc/87/00/88/473870088.db2.gz QELUYDOBNHGCRP-PKOBYXMFSA-N 1 3 346.519 2.633 10 0 EFAEHO Cc1cc(Cl)ccc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617506719 480249784 /nfs/dbraw/zinc/24/97/84/480249784.db2.gz WZASWYXOWNDSID-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO Cc1cc(Cl)ccc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617506719 480249788 /nfs/dbraw/zinc/24/97/88/480249788.db2.gz WZASWYXOWNDSID-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)NCCC[N@H+](C)C2CCCCC2)CCN1C ZINC000173850494 473942512 /nfs/dbraw/zinc/94/25/12/473942512.db2.gz JHXQKHUJULHUKD-FUHWJXTLSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)NCCC[N@@H+](C)C2CCCCC2)CCN1C ZINC000173850494 473942518 /nfs/dbraw/zinc/94/25/18/473942518.db2.gz JHXQKHUJULHUKD-FUHWJXTLSA-N 1 3 338.540 2.765 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)NC[C@@H]1CCC[N@@H+]1C)c1ccsc1 ZINC000195127603 474011671 /nfs/dbraw/zinc/01/16/71/474011671.db2.gz YQODDXJUORWPHV-JKSUJKDBSA-N 1 3 338.521 2.524 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)NC[C@@H]1CCC[N@H+]1C)c1ccsc1 ZINC000195127603 474011676 /nfs/dbraw/zinc/01/16/76/474011676.db2.gz YQODDXJUORWPHV-JKSUJKDBSA-N 1 3 338.521 2.524 10 0 EFAEHO C[C@@H]([NH2+]CCCCN1CCOCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000274974728 474026898 /nfs/dbraw/zinc/02/68/98/474026898.db2.gz YJIHIYTXWRHDNM-TZIWHRDSSA-N 1 3 345.531 2.599 10 0 EFAEHO C[C@@H]1CN(C)[C@H](C)C[C@H]1[NH2+]C[C@H]1CCN(CCc2ccccc2)C1 ZINC000247182772 474081896 /nfs/dbraw/zinc/08/18/96/474081896.db2.gz ZGTMXMXIGMNZKQ-VURPSTOHSA-N 1 3 329.532 2.869 10 0 EFAEHO Cc1nn(-c2ccccn2)c(C)c1C[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C ZINC000282613985 474129850 /nfs/dbraw/zinc/12/98/50/474129850.db2.gz IXARVACIOMTDJC-AYHJJNSGSA-N 1 3 339.487 2.989 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@@H](O)CO[C@@H]2CCCc3ccccc32)CC[N@@H+]1C ZINC000247372504 474131291 /nfs/dbraw/zinc/13/12/91/474131291.db2.gz SBTHUEFKXQEDBJ-XLBJILASSA-N 1 3 346.515 2.856 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@@H](O)CO[C@@H]2CCCc3ccccc32)CC[N@H+]1C ZINC000247372504 474131297 /nfs/dbraw/zinc/13/12/97/474131297.db2.gz SBTHUEFKXQEDBJ-XLBJILASSA-N 1 3 346.515 2.856 10 0 EFAEHO [NH3+]C1CC(c2cc(NC3CCN(Cc4ccccc4)CC3)ncn2)C1 ZINC000219675612 474148083 /nfs/dbraw/zinc/14/80/83/474148083.db2.gz RXLKMUDNCVZGIT-UHFFFAOYSA-N 1 3 337.471 2.758 10 0 EFAEHO CN1CC[C@H](NC(=O)NCCC[NH+]2CCCCC2)[C@H]1c1ccccc1 ZINC000247917177 474226390 /nfs/dbraw/zinc/22/63/90/474226390.db2.gz BGRDCZJHUQTQIS-RBUKOAKNSA-N 1 3 344.503 2.607 10 0 EFAEHO CN1CC[C@@H](NC(=O)c2ccc(C[NH+](C)C)cc2)[C@H]1c1ccccc1 ZINC000248072979 474256071 /nfs/dbraw/zinc/25/60/71/474256071.db2.gz QQSYNXWRKHLISE-WOJBJXKFSA-N 1 3 337.467 2.923 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000175606750 474261239 /nfs/dbraw/zinc/26/12/39/474261239.db2.gz YVEXOIWKXYAUAR-MRXNPFEDSA-N 1 3 336.524 2.567 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H]2CCCCO2)CC1 ZINC000236801798 474288233 /nfs/dbraw/zinc/28/82/33/474288233.db2.gz SCRYCBKQKBUHMG-LJQANCHMSA-N 1 3 331.504 2.877 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)NC2CC[NH+](C3CCCC3)CC2)CCN1C ZINC000176021016 474363915 /nfs/dbraw/zinc/36/39/15/474363915.db2.gz WWUYCTAYIQHWAM-QAPCUYQASA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@H](CNC(=O)N[C@H](CN(C)C)c1ccccc1)[N@@H+]1CCC[C@@H](C)C1 ZINC000248753010 474426885 /nfs/dbraw/zinc/42/68/85/474426885.db2.gz HLUZNGHECJLDER-ZHALLVOQSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@H](CNC(=O)N[C@H](CN(C)C)c1ccccc1)[N@H+]1CCC[C@@H](C)C1 ZINC000248753010 474426890 /nfs/dbraw/zinc/42/68/90/474426890.db2.gz HLUZNGHECJLDER-ZHALLVOQSA-N 1 3 346.519 2.709 10 0 EFAEHO NC[C@H](NC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2[NH2+]1)c1ccc2ccccc2c1 ZINC000248873338 474465446 /nfs/dbraw/zinc/46/54/46/474465446.db2.gz IMXJTAIQEZJJFD-RNQOJCNYSA-N 1 3 337.467 2.877 10 0 EFAEHO C[NH+](C)Cc1cccc(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)c1 ZINC000289875425 474465698 /nfs/dbraw/zinc/46/56/98/474465698.db2.gz RBDQFWAYPMCKQL-IBGZPJMESA-N 1 3 335.467 2.577 10 0 EFAEHO C[C@H](CN1CCCC1=O)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000248876171 474466868 /nfs/dbraw/zinc/46/68/68/474466868.db2.gz JNTJTNPPPKPJNV-RSPOEFSDSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@H](CN1CCCC1=O)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000248876171 474466874 /nfs/dbraw/zinc/46/68/74/474466874.db2.gz JNTJTNPPPKPJNV-RSPOEFSDSA-N 1 3 341.499 2.783 10 0 EFAEHO NC1(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCC1 ZINC000237894504 474495506 /nfs/dbraw/zinc/49/55/06/474495506.db2.gz DAJZDRVNVCZPGX-AYHJJNSGSA-N 1 3 327.472 2.570 10 0 EFAEHO NC1(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCC1 ZINC000237894504 474495516 /nfs/dbraw/zinc/49/55/16/474495516.db2.gz DAJZDRVNVCZPGX-AYHJJNSGSA-N 1 3 327.472 2.570 10 0 EFAEHO CCC[C@@H]1CN([C@@H]2CC[N@H+](Cc3ccccc3)C2)CCN1CCOC ZINC000271356156 474507055 /nfs/dbraw/zinc/50/70/55/474507055.db2.gz MHXFFHLDLKXLAV-NHCUHLMSSA-N 1 3 345.531 2.694 10 0 EFAEHO CCC[C@@H]1CN([C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCN1CCOC ZINC000271356156 474507057 /nfs/dbraw/zinc/50/70/57/474507057.db2.gz MHXFFHLDLKXLAV-NHCUHLMSSA-N 1 3 345.531 2.694 10 0 EFAEHO CCC[C@H]1CN([C@H]2CC[N@H+](Cc3ccccc3)C2)CCN1CCOC ZINC000271356161 474507447 /nfs/dbraw/zinc/50/74/47/474507447.db2.gz MHXFFHLDLKXLAV-SFTDATJTSA-N 1 3 345.531 2.694 10 0 EFAEHO CCC[C@H]1CN([C@H]2CC[N@@H+](Cc3ccccc3)C2)CCN1CCOC ZINC000271356161 474507453 /nfs/dbraw/zinc/50/74/53/474507453.db2.gz MHXFFHLDLKXLAV-SFTDATJTSA-N 1 3 345.531 2.694 10 0 EFAEHO O=C(NC1CCN(Cc2ccccc2)CC1)[C@@H]1C[C@H]2CCCC[C@@H]2[NH2+]1 ZINC000237991602 474517140 /nfs/dbraw/zinc/51/71/40/474517140.db2.gz ZFUAZXVBMFIOJS-HOJAQTOUSA-N 1 3 341.499 2.688 10 0 EFAEHO CCN1CC[C@H](C[NH2+]Cc2cccc(I)c2)C1 ZINC000284145275 474582666 /nfs/dbraw/zinc/58/26/66/474582666.db2.gz YYCYKIWKMIYLKE-CYBMUJFWSA-N 1 3 344.240 2.723 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)CCOCC(F)(F)C(F)(F)F)[C@@H](C)C1 ZINC000249263236 474548736 /nfs/dbraw/zinc/54/87/36/474548736.db2.gz IDVHUSSEFAISON-RYUDHWBXSA-N 1 3 332.357 2.863 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)CCOCC(F)(F)C(F)(F)F)[C@@H](C)C1 ZINC000249263236 474548742 /nfs/dbraw/zinc/54/87/42/474548742.db2.gz IDVHUSSEFAISON-RYUDHWBXSA-N 1 3 332.357 2.863 10 0 EFAEHO CC(C)NC(=O)CCNC1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000184742195 474598886 /nfs/dbraw/zinc/59/88/86/474598886.db2.gz QCPJUIKOAYNKDT-IAGOWNOFSA-N 1 3 331.504 2.647 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCCCC[NH+]2C[C@@H](C)C[C@H](C)C2)C1 ZINC000249763538 474613221 /nfs/dbraw/zinc/61/32/21/474613221.db2.gz NETAYNTVQSKSCI-BZSNNMDCSA-N 1 3 338.540 2.528 10 0 EFAEHO Cc1nc(F)ccc1C[NH2+]Cc1ccc(CN2CCN(C)CC2)cc1 ZINC000278465858 474652767 /nfs/dbraw/zinc/65/27/67/474652767.db2.gz YSINVOAVGLBTDV-UHFFFAOYSA-N 1 3 342.462 2.566 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@]2(C)CCOC2)CC1 ZINC000344372694 474695820 /nfs/dbraw/zinc/69/58/20/474695820.db2.gz REZKZGUHHWXSJL-HXUWFJFHSA-N 1 3 331.504 2.735 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)CC1CC[NH+](C)CC1)c1ccccc1 ZINC000273224541 474788357 /nfs/dbraw/zinc/78/83/57/474788357.db2.gz NOGCCTXAZOTGBJ-IBGZPJMESA-N 1 3 331.504 2.918 10 0 EFAEHO CN(C)[C@H](CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC000255289762 474827838 /nfs/dbraw/zinc/82/78/38/474827838.db2.gz NTQBYRKCSWUXFV-XVLXNVKGSA-N 1 3 344.503 2.604 10 0 EFAEHO CN(C)[C@H](CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000255289762 474827847 /nfs/dbraw/zinc/82/78/47/474827847.db2.gz NTQBYRKCSWUXFV-XVLXNVKGSA-N 1 3 344.503 2.604 10 0 EFAEHO O=C(CC[C@H]1CCC[NH2+]1)NC[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000310584631 474829775 /nfs/dbraw/zinc/82/97/75/474829775.db2.gz UFTOHMAPTPMAHD-RBUKOAKNSA-N 1 3 329.488 2.547 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)NCCCC[N@@H+]1CCCC[C@H]1C ZINC000337353087 474927433 /nfs/dbraw/zinc/92/74/33/474927433.db2.gz AMYUXLJLPOEGCV-QZTJIDSGSA-N 1 3 338.540 2.815 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)NCCCC[N@H+]1CCCC[C@H]1C ZINC000337353087 474927447 /nfs/dbraw/zinc/92/74/47/474927447.db2.gz AMYUXLJLPOEGCV-QZTJIDSGSA-N 1 3 338.540 2.815 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)Nc1cccc(OCC[NH+](C)C)c1 ZINC000337369515 474946786 /nfs/dbraw/zinc/94/67/86/474946786.db2.gz OIHKFQPRYDCNBX-INIZCTEOSA-N 1 3 348.491 2.623 10 0 EFAEHO C[C@H](CC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1CCC[NH2+]C1 ZINC000261568487 474983990 /nfs/dbraw/zinc/98/39/90/474983990.db2.gz JDYNHRBRIIRIGM-MISYRCLQSA-N 1 3 343.515 2.745 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NCCN2[C@@H](C)CCC[C@@H]2C)CC1 ZINC000341123704 475000141 /nfs/dbraw/zinc/00/01/41/475000141.db2.gz NTJZWUFAMJAOAA-IRXDYDNUSA-N 1 3 338.540 2.671 10 0 EFAEHO CC1(C)CN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC[C@@H]1[NH3+] ZINC000261816637 475072414 /nfs/dbraw/zinc/07/24/14/475072414.db2.gz HQQOCAZGWPSDAD-AEFFLSMTSA-N 1 3 347.478 2.624 10 0 EFAEHO CC1(C)CN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC[C@H]1[NH3+] ZINC000261816639 475072940 /nfs/dbraw/zinc/07/29/40/475072940.db2.gz HQQOCAZGWPSDAD-FUHWJXTLSA-N 1 3 347.478 2.624 10 0 EFAEHO CCN1CCN(C[C@@H](C)C[NH2+][C@H](C)c2cnn(C3CCCC3)c2)CC1 ZINC000337504694 475078025 /nfs/dbraw/zinc/07/80/25/475078025.db2.gz DPHXEODUJDYDCB-ZWKOTPCHSA-N 1 3 347.551 2.922 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@H](C)c2cnn(C3CCCC3)c2)CC1 ZINC000337529475 475098341 /nfs/dbraw/zinc/09/83/41/475098341.db2.gz UGAVIEPTFZCZTE-QGZVFWFLSA-N 1 3 333.524 2.676 10 0 EFAEHO CC(C)COc1ccccc1CN[C@@H]1CCC[C@H]1[C@H]1COCC[NH2+]1 ZINC000261888043 475102202 /nfs/dbraw/zinc/10/22/02/475102202.db2.gz GDGCLBWJVYPBCH-GUDVDZBRSA-N 1 3 332.488 2.968 10 0 EFAEHO c1ccc(OCC2CC2)c(CN[C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)c1 ZINC000261920905 475114404 /nfs/dbraw/zinc/11/44/04/475114404.db2.gz KJKNGEWTWHVMOB-QRVBRYPASA-N 1 3 330.472 2.722 10 0 EFAEHO CN(C)CCOc1ccccc1-c1nc(-c2ccc(C[NH3+])cc2)no1 ZINC000261941879 475121920 /nfs/dbraw/zinc/12/19/20/475121920.db2.gz DUWLQXBJKVAMLD-UHFFFAOYSA-N 1 3 338.411 2.803 10 0 EFAEHO CCC(CC)(CNC(=O)C1(N)CCOCC1)[NH2+][C@H](C)c1ccccc1 ZINC000261945975 475124560 /nfs/dbraw/zinc/12/45/60/475124560.db2.gz YFBOMXDPOUQHMS-MRXNPFEDSA-N 1 3 347.503 2.520 10 0 EFAEHO c1ccc(OC2CCC2)c(CN[C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)c1 ZINC000262029053 475149840 /nfs/dbraw/zinc/14/98/40/475149840.db2.gz XHSRKNPZKRLXND-OTWHNJEPSA-N 1 3 330.472 2.865 10 0 EFAEHO Cc1ccc(OC(F)F)c(CN[C@@H]2CCC[C@@H]2[C@H]2COCC[NH2+]2)c1 ZINC000262042382 475154979 /nfs/dbraw/zinc/15/49/79/475154979.db2.gz YSGSQPRKHCOZOQ-ARFHVFGLSA-N 1 3 340.414 2.843 10 0 EFAEHO Cc1ccc(OC(F)F)c(CN[C@@H]2CCC[C@@H]2[C@@H]2COCC[NH2+]2)c1 ZINC000262042385 475155359 /nfs/dbraw/zinc/15/53/59/475155359.db2.gz YSGSQPRKHCOZOQ-XHSDSOJGSA-N 1 3 340.414 2.843 10 0 EFAEHO COC[C@@H](C)[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000339490100 475252253 /nfs/dbraw/zinc/25/22/53/475252253.db2.gz WMPYVFQVSXZFDE-MJGOQNOKSA-N 1 3 332.488 2.540 10 0 EFAEHO COC[C@@H](C)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339490100 475252257 /nfs/dbraw/zinc/25/22/57/475252257.db2.gz WMPYVFQVSXZFDE-MJGOQNOKSA-N 1 3 332.488 2.540 10 0 EFAEHO COC[C@@H](C)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339490100 475252266 /nfs/dbraw/zinc/25/22/66/475252266.db2.gz WMPYVFQVSXZFDE-MJGOQNOKSA-N 1 3 332.488 2.540 10 0 EFAEHO C[C@@H]1OCC[C@H]1[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000339491662 475252486 /nfs/dbraw/zinc/25/24/86/475252486.db2.gz BOWBFNGTIHOKOG-YSIASYRMSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1OCC[C@H]1NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339491662 475252493 /nfs/dbraw/zinc/25/24/93/475252493.db2.gz BOWBFNGTIHOKOG-YSIASYRMSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1OCC[C@H]1NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339491662 475252498 /nfs/dbraw/zinc/25/24/98/475252498.db2.gz BOWBFNGTIHOKOG-YSIASYRMSA-N 1 3 344.499 2.682 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000352410078 475266549 /nfs/dbraw/zinc/26/65/49/475266549.db2.gz NIORZKPPWNAAHY-SJLPKXTDSA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1cccc([C@@H](C)NC2CC[NH+](CCC(=O)N(C)C)CC2)c1C ZINC000361350395 475375356 /nfs/dbraw/zinc/37/53/56/475375356.db2.gz FOJFBHWBWXHGMP-QGZVFWFLSA-N 1 3 331.504 2.897 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000352596506 475445919 /nfs/dbraw/zinc/44/59/19/475445919.db2.gz BGTFZVHRVZXJMC-YSIASYRMSA-N 1 3 343.515 2.888 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000352596506 475445926 /nfs/dbraw/zinc/44/59/26/475445926.db2.gz BGTFZVHRVZXJMC-YSIASYRMSA-N 1 3 343.515 2.888 10 0 EFAEHO CN(C)CCNC(=O)c1ccc(C[NH2+][C@H]2CC[C@@H]2C2CCC2)cc1 ZINC000337986101 475484731 /nfs/dbraw/zinc/48/47/31/475484731.db2.gz HLFVWSVJNVMBEZ-MOPGFXCFSA-N 1 3 329.488 2.646 10 0 EFAEHO CC[NH+](CC)Cc1ccc(C(=O)N(C)[C@H]2CCN(C3CC3)C2)cc1 ZINC000338173502 475650103 /nfs/dbraw/zinc/65/01/03/475650103.db2.gz HBEUUZTZKCWDFW-IBGZPJMESA-N 1 3 329.488 2.837 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C)C[C@H]2CCC[C@H]2O)CC1 ZINC000355086838 475655282 /nfs/dbraw/zinc/65/52/82/475655282.db2.gz LBMUHPHFZVWDLJ-TZIWHRDSSA-N 1 3 345.531 2.811 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C)C[C@H]2CCC[C@H]2O)CC1 ZINC000355086838 475655290 /nfs/dbraw/zinc/65/52/90/475655290.db2.gz LBMUHPHFZVWDLJ-TZIWHRDSSA-N 1 3 345.531 2.811 10 0 EFAEHO C[C@@H]1[C@H]([NH+]2CCCC2)CCN1C(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000352997131 475677978 /nfs/dbraw/zinc/67/79/78/475677978.db2.gz KLWBGTIMPBXUER-XMTFNYHQSA-N 1 3 336.524 2.518 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)NCC[N@H+]1[C@H](C)CCC[C@@H]1C ZINC000352996389 475678200 /nfs/dbraw/zinc/67/82/00/475678200.db2.gz GOSAYGGQJUESLW-HDICACEKSA-N 1 3 338.540 2.767 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000352996389 475678206 /nfs/dbraw/zinc/67/82/06/475678206.db2.gz GOSAYGGQJUESLW-HDICACEKSA-N 1 3 338.540 2.767 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000340102466 475760583 /nfs/dbraw/zinc/76/05/83/475760583.db2.gz LSAIFRUPVSLRRD-QRQLOZEOSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000340102466 475760587 /nfs/dbraw/zinc/76/05/87/475760587.db2.gz LSAIFRUPVSLRRD-QRQLOZEOSA-N 1 3 344.503 2.605 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C)CC2(O)CCC2)CC1 ZINC000355363827 475870038 /nfs/dbraw/zinc/87/00/38/475870038.db2.gz CPBGLOJETXYUAA-UHFFFAOYSA-N 1 3 331.504 2.565 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C)CC2(O)CCC2)CC1 ZINC000355363827 475870046 /nfs/dbraw/zinc/87/00/46/475870046.db2.gz CPBGLOJETXYUAA-UHFFFAOYSA-N 1 3 331.504 2.565 10 0 EFAEHO CN(C)Cc1ccc(CNC(=O)C2(C[NH+](C)C)CCCCC2)cc1 ZINC000358712531 475877559 /nfs/dbraw/zinc/87/75/59/475877559.db2.gz DSFJKOLQTNOXBC-UHFFFAOYSA-N 1 3 331.504 2.877 10 0 EFAEHO C[C@@H](CNC(=O)CCN1CCc2ccccc2C1)[NH+]1CCC(C)CC1 ZINC000348901934 475882394 /nfs/dbraw/zinc/88/23/94/475882394.db2.gz RTAFARNIOIZSFE-SFHVURJKSA-N 1 3 343.515 2.671 10 0 EFAEHO CN(C)CCN(Cc1ccco1)C(=O)C1(C[NH+](C)C)CCCCC1 ZINC000358722244 475883046 /nfs/dbraw/zinc/88/30/46/475883046.db2.gz JWXJLKJXSQBYBM-UHFFFAOYSA-N 1 3 335.492 2.682 10 0 EFAEHO Cn1cncc1CCN1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000297892616 475916631 /nfs/dbraw/zinc/91/66/31/475916631.db2.gz RAJNRKYUSDBROX-TZIWHRDSSA-N 1 3 338.499 2.949 10 0 EFAEHO Cn1cncc1CCN1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000297892616 475916636 /nfs/dbraw/zinc/91/66/36/475916636.db2.gz RAJNRKYUSDBROX-TZIWHRDSSA-N 1 3 338.499 2.949 10 0 EFAEHO Cn1cncc1CC[N@@H+]1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1 ZINC000297892616 475916641 /nfs/dbraw/zinc/91/66/41/475916641.db2.gz RAJNRKYUSDBROX-TZIWHRDSSA-N 1 3 338.499 2.949 10 0 EFAEHO Cn1cncc1CC[N@H+]1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1 ZINC000297892616 475916644 /nfs/dbraw/zinc/91/66/44/475916644.db2.gz RAJNRKYUSDBROX-TZIWHRDSSA-N 1 3 338.499 2.949 10 0 EFAEHO Cn1cncc1CCN1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000297892602 475917268 /nfs/dbraw/zinc/91/72/68/475917268.db2.gz RAJNRKYUSDBROX-FPOVZHCZSA-N 1 3 338.499 2.949 10 0 EFAEHO Cn1cncc1CCN1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000297892602 475917276 /nfs/dbraw/zinc/91/72/76/475917276.db2.gz RAJNRKYUSDBROX-FPOVZHCZSA-N 1 3 338.499 2.949 10 0 EFAEHO Cn1cncc1CC[N@@H+]1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1 ZINC000297892602 475917283 /nfs/dbraw/zinc/91/72/83/475917283.db2.gz RAJNRKYUSDBROX-FPOVZHCZSA-N 1 3 338.499 2.949 10 0 EFAEHO Cn1cncc1CC[N@H+]1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1 ZINC000297892602 475917291 /nfs/dbraw/zinc/91/72/91/475917291.db2.gz RAJNRKYUSDBROX-FPOVZHCZSA-N 1 3 338.499 2.949 10 0 EFAEHO CC(C)[N@H+](C)CCNC(=O)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000338499540 475958571 /nfs/dbraw/zinc/95/85/71/475958571.db2.gz IEEZAMNCFNIYHQ-IBGZPJMESA-N 1 3 346.519 2.681 10 0 EFAEHO CC(C)[N@@H+](C)CCNC(=O)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000338499540 475958575 /nfs/dbraw/zinc/95/85/75/475958575.db2.gz IEEZAMNCFNIYHQ-IBGZPJMESA-N 1 3 346.519 2.681 10 0 EFAEHO CN(C)CCOc1ccc(CC[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@@H]32)cc1 ZINC000353521175 476042432 /nfs/dbraw/zinc/04/24/32/476042432.db2.gz PJZOTPRZCZYRPQ-NJDAHSKKSA-N 1 3 345.531 2.632 10 0 EFAEHO CC[C@@H](COC)[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340468736 476054058 /nfs/dbraw/zinc/05/40/58/476054058.db2.gz SUKRXYWEWPYMKJ-UXHICEINSA-N 1 3 346.515 2.930 10 0 EFAEHO c1ccc(CN2C[C@@H](C[NH2+][C@@H]3CCCOC3)C3(C2)CCOCC3)cc1 ZINC000340468988 476054746 /nfs/dbraw/zinc/05/47/46/476054746.db2.gz HUDCRSOVTBHZDY-WOJBJXKFSA-N 1 3 344.499 2.684 10 0 EFAEHO c1ccc(C[N@H+]2C[C@@H](CN[C@@H]3CCCOC3)C3(C2)CCOCC3)cc1 ZINC000340468988 476054754 /nfs/dbraw/zinc/05/47/54/476054754.db2.gz HUDCRSOVTBHZDY-WOJBJXKFSA-N 1 3 344.499 2.684 10 0 EFAEHO c1ccc(C[N@@H+]2C[C@@H](CN[C@@H]3CCCOC3)C3(C2)CCOCC3)cc1 ZINC000340468988 476054758 /nfs/dbraw/zinc/05/47/58/476054758.db2.gz HUDCRSOVTBHZDY-WOJBJXKFSA-N 1 3 344.499 2.684 10 0 EFAEHO CN1CC[C@H]([NH2+]CCOc2cccc(C(F)(F)F)n2)[C@H]2CCC[C@@H]21 ZINC000353615984 476127221 /nfs/dbraw/zinc/12/72/21/476127221.db2.gz XSVYQWNVUMHPBU-RDBSUJKOSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCOc2cccc(C(F)(F)F)n2)[C@H]2CCC[C@@H]21 ZINC000353615984 476127227 /nfs/dbraw/zinc/12/72/27/476127227.db2.gz XSVYQWNVUMHPBU-RDBSUJKOSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@H+]1CC[C@H](NCCOc2cccc(C(F)(F)F)n2)[C@H]2CCC[C@@H]21 ZINC000353615984 476127233 /nfs/dbraw/zinc/12/72/33/476127233.db2.gz XSVYQWNVUMHPBU-RDBSUJKOSA-N 1 3 343.393 2.942 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]C2CC(N3CCCCC3)C2)[C@H](C)C1 ZINC000359038929 476136600 /nfs/dbraw/zinc/13/66/00/476136600.db2.gz VKRLKVPQGRROKZ-OAHAVBBTSA-N 1 3 337.552 2.730 10 0 EFAEHO CN1CC[C@H]([NH2+]CCOc2ncccc2C(F)(F)F)[C@H]2CCC[C@H]21 ZINC000353635557 476142850 /nfs/dbraw/zinc/14/28/50/476142850.db2.gz ADVPRIKISDDCIO-VHDGCEQUSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCOc2ncccc2C(F)(F)F)[C@H]2CCC[C@H]21 ZINC000353635557 476142855 /nfs/dbraw/zinc/14/28/55/476142855.db2.gz ADVPRIKISDDCIO-VHDGCEQUSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@H+]1CC[C@H](NCCOc2ncccc2C(F)(F)F)[C@H]2CCC[C@H]21 ZINC000353635557 476142859 /nfs/dbraw/zinc/14/28/59/476142859.db2.gz ADVPRIKISDDCIO-VHDGCEQUSA-N 1 3 343.393 2.942 10 0 EFAEHO CN1CC[C@H]([NH2+]CCOc2ccc(C(F)(F)F)cn2)[C@@H]2CCC[C@@H]21 ZINC000353647712 476154145 /nfs/dbraw/zinc/15/41/45/476154145.db2.gz SEMIXBAXCWZRQS-KKUMJFAQSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCOc2ccc(C(F)(F)F)cn2)[C@@H]2CCC[C@@H]21 ZINC000353647712 476154148 /nfs/dbraw/zinc/15/41/48/476154148.db2.gz SEMIXBAXCWZRQS-KKUMJFAQSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@H+]1CC[C@H](NCCOc2ccc(C(F)(F)F)cn2)[C@@H]2CCC[C@@H]21 ZINC000353647712 476154158 /nfs/dbraw/zinc/15/41/58/476154158.db2.gz SEMIXBAXCWZRQS-KKUMJFAQSA-N 1 3 343.393 2.942 10 0 EFAEHO CC[C@@H](CNC(=O)CC1CC[NH+](C)CC1)N1CCc2ccccc2C1 ZINC000362492334 476281561 /nfs/dbraw/zinc/28/15/61/476281561.db2.gz LDDOIIILEZCBCI-FQEVSTJZSA-N 1 3 343.515 2.671 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@@H]1CCCC[N@@H+]1C)Cc1ccco1 ZINC000360027349 476284961 /nfs/dbraw/zinc/28/49/61/476284961.db2.gz ICZRXBWHUBPXQE-KRWDZBQOSA-N 1 3 335.492 2.824 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@@H]1CCCC[N@H+]1C)Cc1ccco1 ZINC000360027349 476284963 /nfs/dbraw/zinc/28/49/63/476284963.db2.gz ICZRXBWHUBPXQE-KRWDZBQOSA-N 1 3 335.492 2.824 10 0 EFAEHO CC1CCC(N2CCN(C(=O)CC[C@H]3CCCC[N@@H+]3C)CC2)CC1 ZINC000353815312 476286700 /nfs/dbraw/zinc/28/67/00/476286700.db2.gz NDIQZSIPINXSBF-JLAWEPINSA-N 1 3 335.536 2.974 10 0 EFAEHO CC1CCC(N2CCN(C(=O)CC[C@H]3CCCC[N@H+]3C)CC2)CC1 ZINC000353815312 476286703 /nfs/dbraw/zinc/28/67/03/476286703.db2.gz NDIQZSIPINXSBF-JLAWEPINSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@H]1C[C@@H](c2nc(-c3ccccc3OCC[NH+](C)C)no2)CCN1C ZINC000351225843 476369963 /nfs/dbraw/zinc/36/99/63/476369963.db2.gz ZYEUJSYZENBTML-GJZGRUSLSA-N 1 3 344.459 2.875 10 0 EFAEHO c1ncn(-c2ccc(CN3CC[C@@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)cc2)n1 ZINC000360808677 476401326 /nfs/dbraw/zinc/40/13/26/476401326.db2.gz AXCZFVWQTNRFRI-FXAWDEMLSA-N 1 3 337.471 2.716 10 0 EFAEHO c1ncn(-c2ccc(CN3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)cc2)n1 ZINC000360808677 476401330 /nfs/dbraw/zinc/40/13/30/476401330.db2.gz AXCZFVWQTNRFRI-FXAWDEMLSA-N 1 3 337.471 2.716 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)C1 ZINC000377644473 476494615 /nfs/dbraw/zinc/49/46/15/476494615.db2.gz FIBSMHHFURULCU-SFHVURJKSA-N 1 3 327.488 2.624 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@@H]2CCC[C@H]([C@H]3CCOC3)C2)CC1 ZINC000360986458 476526791 /nfs/dbraw/zinc/52/67/91/476526791.db2.gz KWNARJMQNXJGMR-SLFFLAALSA-N 1 3 337.552 2.589 10 0 EFAEHO C[C@@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)CCN1CCc2ccccc2C1 ZINC000354336594 476594566 /nfs/dbraw/zinc/59/45/66/476594566.db2.gz XTBVIMXORUEJKF-ROUUACIJSA-N 1 3 343.515 2.671 10 0 EFAEHO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)CCN1CCc2ccccc2C1 ZINC000354336594 476594572 /nfs/dbraw/zinc/59/45/72/476594572.db2.gz XTBVIMXORUEJKF-ROUUACIJSA-N 1 3 343.515 2.671 10 0 EFAEHO C[C@@H](CC[NH+](C)C)NC(=O)N1CCN(Cc2ccccc2)CC[C@H]1C ZINC000370004570 476627076 /nfs/dbraw/zinc/62/70/76/476627076.db2.gz CLCHRAKZYVJECF-ZWKOTPCHSA-N 1 3 346.519 2.633 10 0 EFAEHO Cn1c2ccc(CN3CC[C@H](C4CC[NH+](C)CC4)C3)cc2sc1=O ZINC000377883929 476627948 /nfs/dbraw/zinc/62/79/48/476627948.db2.gz LMDSGEWYJSLYRV-INIZCTEOSA-N 1 3 345.512 2.764 10 0 EFAEHO CN1CCC[C@H](CNC(=O)NC(C)(C)CC[NH3+])[C@@H]1c1cccs1 ZINC000422605637 476716405 /nfs/dbraw/zinc/71/64/05/476716405.db2.gz QKNNIJYVCCAZLB-UKRRQHHQSA-N 1 3 338.521 2.558 10 0 EFAEHO CC[NH+](CC)CCNC(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000429966860 476725901 /nfs/dbraw/zinc/72/59/01/476725901.db2.gz FSDUSBOXLSXKGE-FQEVSTJZSA-N 1 3 346.519 2.682 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)C2CCC([NH3+])CC2)CCN1Cc1ccccc1 ZINC000379680710 476730453 /nfs/dbraw/zinc/73/04/53/476730453.db2.gz NSVJEKWFPYEJNL-GWFLUQINSA-N 1 3 329.488 2.673 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)C[C@H]2CCC[NH2+]C2)CCN1Cc1ccccc1 ZINC000379672339 476731261 /nfs/dbraw/zinc/73/12/61/476731261.db2.gz NCRVNOLJZYZKHT-BHIYHBOVSA-N 1 3 329.488 2.545 10 0 EFAEHO CC(C)COC[C@H](O)C[NH2+][C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000381466723 476737734 /nfs/dbraw/zinc/73/77/34/476737734.db2.gz YNANLZIVEGSPTJ-JSXRDJHFSA-N 1 3 346.515 2.520 10 0 EFAEHO CC(C)COC[C@H](O)CN[C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000381466723 476737740 /nfs/dbraw/zinc/73/77/40/476737740.db2.gz YNANLZIVEGSPTJ-JSXRDJHFSA-N 1 3 346.515 2.520 10 0 EFAEHO CC(C)COC[C@H](O)CN[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000381466723 476737744 /nfs/dbraw/zinc/73/77/44/476737744.db2.gz YNANLZIVEGSPTJ-JSXRDJHFSA-N 1 3 346.515 2.520 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@@H](C)N1CCc2ccccc2C1 ZINC000422710235 476739665 /nfs/dbraw/zinc/73/96/65/476739665.db2.gz FJTDLBPOOKPKAT-HZPDHXFCSA-N 1 3 338.499 2.946 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1cccc(NC(=O)C2CCCC2)c1 ZINC000422718696 476740465 /nfs/dbraw/zinc/74/04/65/476740465.db2.gz XJIGIMWUZNKQRZ-GOSISDBHSA-N 1 3 333.476 2.659 10 0 EFAEHO [NH3+]C[C@@H]1CCCC[C@H]1NCc1cccc(COC2CCOCC2)c1 ZINC000422716557 476741477 /nfs/dbraw/zinc/74/14/77/476741477.db2.gz UJSROLHXZHMGIA-AZUAARDMSA-N 1 3 332.488 2.989 10 0 EFAEHO CC(C)(C)[C@H](O)C[C@H](CO)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000375269274 476748635 /nfs/dbraw/zinc/74/86/35/476748635.db2.gz YKKALQCSHLEFMP-SJLPKXTDSA-N 1 3 326.525 2.531 10 0 EFAEHO CC(C)(C)[C@@H](O)C[C@@H](CO)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000375269277 476749412 /nfs/dbraw/zinc/74/94/12/476749412.db2.gz YKKALQCSHLEFMP-WMZOPIPTSA-N 1 3 326.525 2.531 10 0 EFAEHO CC(C)OC[C@H](O)C[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000383658768 476752090 /nfs/dbraw/zinc/75/20/90/476752090.db2.gz FVZBLZWIGIEDQA-WOJBJXKFSA-N 1 3 334.504 2.664 10 0 EFAEHO CC(C)OC[C@H](O)CNC[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000383658768 476752100 /nfs/dbraw/zinc/75/21/00/476752100.db2.gz FVZBLZWIGIEDQA-WOJBJXKFSA-N 1 3 334.504 2.664 10 0 EFAEHO CC(C)OC[C@H](O)CNC[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000383658768 476752105 /nfs/dbraw/zinc/75/21/05/476752105.db2.gz FVZBLZWIGIEDQA-WOJBJXKFSA-N 1 3 334.504 2.664 10 0 EFAEHO C[C@H]([NH3+])[C@@H](Cc1ccccc1)NCc1ccc(F)c(CN(C)C)c1 ZINC000422748023 476757519 /nfs/dbraw/zinc/75/75/19/476757519.db2.gz RQLPVXDZYKXGBN-MGPUTAFESA-N 1 3 329.463 2.935 10 0 EFAEHO C[C@H](N)[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(F)c(CN(C)C)c1 ZINC000422748023 476757528 /nfs/dbraw/zinc/75/75/28/476757528.db2.gz RQLPVXDZYKXGBN-MGPUTAFESA-N 1 3 329.463 2.935 10 0 EFAEHO Fc1ccc2[nH]cc(CCN[C@@H]3CCOC[C@H]3[C@@H]3CCC[NH2+]3)c2c1 ZINC000422761940 476764472 /nfs/dbraw/zinc/76/44/72/476764472.db2.gz NEKDBSQXGWPITL-JENIJYKNSA-N 1 3 331.435 2.596 10 0 EFAEHO C([NH2+][C@H](C1CC1)[C@H]1CNCCO1)C1(N2CCCCC2)CCCCC1 ZINC000422766024 476765802 /nfs/dbraw/zinc/76/58/02/476765802.db2.gz WYEDRJXNTJUJPG-RTBURBONSA-N 1 3 335.536 2.532 10 0 EFAEHO C(N[C@H](C1CC1)[C@H]1CNCCO1)C1([NH+]2CCCCC2)CCCCC1 ZINC000422766024 476765808 /nfs/dbraw/zinc/76/58/08/476765808.db2.gz WYEDRJXNTJUJPG-RTBURBONSA-N 1 3 335.536 2.532 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@H]1CCOc2ccc(Br)cc21 ZINC000422764767 476765955 /nfs/dbraw/zinc/76/59/55/476765955.db2.gz QHHSTGIFTVRTNM-JSGCOSHPSA-N 1 3 343.265 2.616 10 0 EFAEHO CCCCOCCOCCN[C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422802261 476782925 /nfs/dbraw/zinc/78/29/25/476782925.db2.gz DEXUMAPZAVGIIH-AZUAARDMSA-N 1 3 348.487 2.665 10 0 EFAEHO c1ccc2c(c1)C[C@H](CN[C@@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)O2 ZINC000422804034 476784901 /nfs/dbraw/zinc/78/49/01/476784901.db2.gz GXWRSEUEJIFMCS-BLIXFSHQSA-N 1 3 336.435 2.836 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CCc1cnn(-c2ccccc2)c1 ZINC000422815608 476790314 /nfs/dbraw/zinc/79/03/14/476790314.db2.gz CBBCNJBHYONLCL-OAHLLOKOSA-N 1 3 335.455 2.928 10 0 EFAEHO COc1ccc([C@H](NC[C@@]2(N(C)C)CCSC2)[C@H]2CCC[NH2+]2)cc1 ZINC000422817857 476791647 /nfs/dbraw/zinc/79/16/47/476791647.db2.gz DZDHCCHUTWZDCP-QYZOEREBSA-N 1 3 349.544 2.515 10 0 EFAEHO C[C@H](C[C@H](C)N)[NH2+]C1CCN(c2ccc(C(F)(F)F)cn2)CC1 ZINC000422863426 476816578 /nfs/dbraw/zinc/81/65/78/476816578.db2.gz OZKDZMDRRCVRER-NWDGAFQWSA-N 1 3 330.398 2.785 10 0 EFAEHO C[C@@H]1CCCCN1CCN[C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422862909 476817165 /nfs/dbraw/zinc/81/71/65/476817165.db2.gz OEAYKFYYSYNVJX-POAQFYNOSA-N 1 3 329.488 2.706 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@H](CN[C@@H](C)[C@@H]3CCCC[NH2+]3)C2)c1 ZINC000422874627 476821609 /nfs/dbraw/zinc/82/16/09/476821609.db2.gz NXTUMWHODXEUMK-YRNRMSPPSA-N 1 3 347.503 2.650 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@H](CN[C@H](C)[C@H]3CCCC[NH2+]3)C2)c1 ZINC000422874623 476822558 /nfs/dbraw/zinc/82/25/58/476822558.db2.gz NXTUMWHODXEUMK-JXXFODFXSA-N 1 3 347.503 2.650 10 0 EFAEHO C(CN[C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)Cc1nnc2n1CCCCC2 ZINC000422915893 476845734 /nfs/dbraw/zinc/84/57/34/476845734.db2.gz BWRHLIMCFUEUSS-OKZBNKHCSA-N 1 3 345.535 2.838 10 0 EFAEHO C(C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCCN1)Cc1nnc2n1CCCCC2 ZINC000422915893 476845737 /nfs/dbraw/zinc/84/57/37/476845737.db2.gz BWRHLIMCFUEUSS-OKZBNKHCSA-N 1 3 345.535 2.838 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@@H]1CCc2cn(C(C)C)nc2C1 ZINC000422933833 476852640 /nfs/dbraw/zinc/85/26/40/476852640.db2.gz DXWCNGJWCUIARO-CZUORRHYSA-N 1 3 327.476 2.834 10 0 EFAEHO COC[C@H](CCC[NH3+])NC1(c2cccc(Br)c2)CC1 ZINC000422936355 476853795 /nfs/dbraw/zinc/85/37/95/476853795.db2.gz BKXXZAFVIJHUGP-AWEZNQCLSA-N 1 3 327.266 2.782 10 0 EFAEHO CC1(C)C[C@@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)C(C)(C)O1 ZINC000397602953 476858509 /nfs/dbraw/zinc/85/85/09/476858509.db2.gz VNXOLVNGONPFAC-GOSISDBHSA-N 1 3 346.515 2.949 10 0 EFAEHO C[C@@]1(C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCCS1 ZINC000397679249 476859969 /nfs/dbraw/zinc/85/99/69/476859969.db2.gz KXDDKTCUHKWFQF-SFHVURJKSA-N 1 3 334.529 2.889 10 0 EFAEHO Cc1ncsc1C[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000397703620 476860258 /nfs/dbraw/zinc/86/02/58/476860258.db2.gz WGZXNNDFYFYKSO-UHFFFAOYSA-N 1 3 331.485 2.568 10 0 EFAEHO C[C@@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)c1cnccc1N ZINC000422977597 476876790 /nfs/dbraw/zinc/87/67/90/476876790.db2.gz FYIIEKSLULDPME-OAHLLOKOSA-N 1 3 340.471 2.872 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)[C@H](C)[NH3+] ZINC000399383123 476883612 /nfs/dbraw/zinc/88/36/12/476883612.db2.gz OVKIKALIBKXAED-LNLFQRSKSA-N 1 3 331.504 2.729 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)[C@@H](C)[NH3+] ZINC000399383124 476884150 /nfs/dbraw/zinc/88/41/50/476884150.db2.gz OVKIKALIBKXAED-SCTDSRPQSA-N 1 3 331.504 2.729 10 0 EFAEHO CCN(CC)CCC[NH2+][C@@H](C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000400333352 476889186 /nfs/dbraw/zinc/88/91/86/476889186.db2.gz FJHFASRVOQUNJB-JKSUJKDBSA-N 1 3 327.513 2.953 10 0 EFAEHO C[C@H](C[NH2+][C@H](C)[C@H]1CCN(C(=O)OC(C)(C)C)C1)CN1CCCC1 ZINC000400578831 476891418 /nfs/dbraw/zinc/89/14/18/476891418.db2.gz QAGTZYVCRMEGOD-ZACQAIPSSA-N 1 3 339.524 2.953 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000423105756 476929161 /nfs/dbraw/zinc/92/91/61/476929161.db2.gz IQTUTMFCUXPRNS-WFASDCNBSA-N 1 3 335.275 2.760 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)[C@H]1CC[C@H](C2CC2)[NH2+]1)c1ccccc1 ZINC000407341346 476933319 /nfs/dbraw/zinc/93/33/19/476933319.db2.gz WDKCHPKDPCAFIH-GUDVDZBRSA-N 1 3 329.488 2.716 10 0 EFAEHO CCCN1CCC[C@H]1CN[C@@H](c1ccc(OC)cc1)[C@@H]1CCC[NH2+]1 ZINC000423114462 476933501 /nfs/dbraw/zinc/93/35/01/476933501.db2.gz VUQPCQWBDKULFW-IHPCNDPISA-N 1 3 331.504 2.952 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1cc(F)c(C(F)(F)F)cc1F ZINC000423136035 476941374 /nfs/dbraw/zinc/94/13/74/476941374.db2.gz YQYFTZLUIHQRLD-SNVBAGLBSA-N 1 3 326.309 2.827 10 0 EFAEHO COc1c(C)cc(C[N@@H+]2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1C ZINC000370705762 476943222 /nfs/dbraw/zinc/94/32/22/476943222.db2.gz IYDOAJIVKIVATN-AZUAARDMSA-N 1 3 345.531 2.770 10 0 EFAEHO COc1c(C)cc(C[N@H+]2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1C ZINC000370705762 476943229 /nfs/dbraw/zinc/94/32/29/476943229.db2.gz IYDOAJIVKIVATN-AZUAARDMSA-N 1 3 345.531 2.770 10 0 EFAEHO COc1c(C)cc(CN2CC[C@@H]([NH+]3CCN(C)CC3)[C@@H](C)C2)cc1C ZINC000370705762 476943234 /nfs/dbraw/zinc/94/32/34/476943234.db2.gz IYDOAJIVKIVATN-AZUAARDMSA-N 1 3 345.531 2.770 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+]2CCC[C@@H](c3ccccn3)C2)CC1 ZINC000408518918 476961361 /nfs/dbraw/zinc/96/13/61/476961361.db2.gz KCERGKHGGDXWFI-LJQANCHMSA-N 1 3 330.520 2.677 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+]2CCC[C@@H](c3ccccn3)C2)CC1 ZINC000408518918 476961369 /nfs/dbraw/zinc/96/13/69/476961369.db2.gz KCERGKHGGDXWFI-LJQANCHMSA-N 1 3 330.520 2.677 10 0 EFAEHO COc1ccc([C@H](NC[C@@H](N)c2ccccc2)[C@H]2CCC[NH2+]2)cc1 ZINC000423249239 476975350 /nfs/dbraw/zinc/97/53/50/476975350.db2.gz OHLJVSOAATVTSC-AQNXPRMDSA-N 1 3 325.456 2.778 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2cccc(NS(C)(=O)=O)c2)cc1 ZINC000423295995 476985558 /nfs/dbraw/zinc/98/55/58/476985558.db2.gz YDIUIECBYXLJEO-ZIAGYGMSSA-N 1 3 347.484 2.929 10 0 EFAEHO C[NH+](C)CCCC1CCN(C(=O)Nc2ccc3c(c2)CNC3)CC1 ZINC000415999455 476985958 /nfs/dbraw/zinc/98/59/58/476985958.db2.gz VJFMAICBTNJAJQ-UHFFFAOYSA-N 1 3 330.476 2.876 10 0 EFAEHO Cc1cc(C)n(-c2ccc(C[NH2+][C@@H]3CCN(C)[C@H]4CCC[C@@H]43)cn2)n1 ZINC000375791645 477007895 /nfs/dbraw/zinc/00/78/95/477007895.db2.gz OVFFCIQINIRWMI-QRVBRYPASA-N 1 3 339.487 2.847 10 0 EFAEHO CC[C@@H](NC[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1cccc(OC)c1 ZINC000423378387 477011207 /nfs/dbraw/zinc/01/12/07/477011207.db2.gz FUVLWGUOFBKQDY-HZPDHXFCSA-N 1 3 345.409 2.572 10 0 EFAEHO C[C@@H](NC[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1cc2c(s1)CCC2 ZINC000423381720 477011794 /nfs/dbraw/zinc/01/17/94/477011794.db2.gz IIBAVXGDDRVLLY-IAQYHMDHSA-N 1 3 347.450 2.724 10 0 EFAEHO C[C@H]([NH2+][C@H]1CCNC[C@@H]1C)c1ccc(I)cc1 ZINC000423385724 477012812 /nfs/dbraw/zinc/01/28/12/477012812.db2.gz GYUSBGJUZCTHOX-MJVIPROJSA-N 1 3 344.240 2.940 10 0 EFAEHO COc1ccc([C@H](Cc2ccncc2)[NH2+][C@H]2CCNC[C@@H]2C)cc1 ZINC000423387130 477013757 /nfs/dbraw/zinc/01/37/57/477013757.db2.gz HOQHWXHDRYIIKD-YSSFQJQWSA-N 1 3 325.456 2.962 10 0 EFAEHO CCO[C@@H]1COCC[C@@H]1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447590406 477017905 /nfs/dbraw/zinc/01/79/05/477017905.db2.gz CKLBVDRYRZCQRP-JRSUCEMESA-N 1 3 344.499 2.966 10 0 EFAEHO CCO[C@@H]1COCC[C@@H]1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447590406 477017909 /nfs/dbraw/zinc/01/79/09/477017909.db2.gz CKLBVDRYRZCQRP-JRSUCEMESA-N 1 3 344.499 2.966 10 0 EFAEHO Fc1ccc([C@@H](NC[C@H](N2CC[NH2+]CC2)C(F)(F)F)C2CC2)cc1 ZINC000423399133 477017952 /nfs/dbraw/zinc/01/79/52/477017952.db2.gz VYJXZNJCWYANKU-HOTGVXAUSA-N 1 3 345.384 2.703 10 0 EFAEHO CCO[C@@H]1COCC[C@H]1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447590407 477018685 /nfs/dbraw/zinc/01/86/85/477018685.db2.gz CKLBVDRYRZCQRP-YMQHIKHWSA-N 1 3 344.499 2.966 10 0 EFAEHO CCO[C@@H]1COCC[C@H]1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447590407 477018686 /nfs/dbraw/zinc/01/86/86/477018686.db2.gz CKLBVDRYRZCQRP-YMQHIKHWSA-N 1 3 344.499 2.966 10 0 EFAEHO C[C@@H](Cc1ccc(Br)cc1F)[NH2+]CCOCCN(C)C ZINC000447597771 477019952 /nfs/dbraw/zinc/01/99/52/477019952.db2.gz GTZCSILUDHDFBO-LBPRGKRZSA-N 1 3 347.272 2.687 10 0 EFAEHO CC(C)[NH+]1CCC(N(C)C(=O)CCN2CCc3ccccc3C2)CC1 ZINC000416141275 477034781 /nfs/dbraw/zinc/03/47/81/477034781.db2.gz ZMENLONLRJARQQ-UHFFFAOYSA-N 1 3 343.515 2.766 10 0 EFAEHO O=C(CCN1CCc2ccccc2C1)N1CCC[C@@H]1C[NH+]1CCCC1 ZINC000416143604 477036076 /nfs/dbraw/zinc/03/60/76/477036076.db2.gz KMWFUZHUEZTIMW-HXUWFJFHSA-N 1 3 341.499 2.522 10 0 EFAEHO CN(C)[C@@H](CC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC000416153633 477042746 /nfs/dbraw/zinc/04/27/46/477042746.db2.gz DVBKUXKFINYDQC-IPQPSQTFSA-N 1 3 329.488 2.811 10 0 EFAEHO CN(C)[C@@H](CC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000416153633 477042751 /nfs/dbraw/zinc/04/27/51/477042751.db2.gz DVBKUXKFINYDQC-IPQPSQTFSA-N 1 3 329.488 2.811 10 0 EFAEHO FC1(F)CCNC[C@@H]1N[C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000423486963 477045851 /nfs/dbraw/zinc/04/58/51/477045851.db2.gz TXDMLZKLHQGGRU-MKXGPGLRSA-N 1 3 349.469 2.874 10 0 EFAEHO FC1(F)CCNC[C@@H]1N[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000423486963 477045856 /nfs/dbraw/zinc/04/58/56/477045856.db2.gz TXDMLZKLHQGGRU-MKXGPGLRSA-N 1 3 349.469 2.874 10 0 EFAEHO FC1(F)CCNC[C@@H]1N[C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000423486959 477046649 /nfs/dbraw/zinc/04/66/49/477046649.db2.gz TXDMLZKLHQGGRU-HCXYKTFWSA-N 1 3 349.469 2.874 10 0 EFAEHO FC1(F)CCNC[C@@H]1N[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000423486959 477046655 /nfs/dbraw/zinc/04/66/55/477046655.db2.gz TXDMLZKLHQGGRU-HCXYKTFWSA-N 1 3 349.469 2.874 10 0 EFAEHO CN(CCCNC(=O)CC[C@@H]1CCCC[N@@H+]1C)Cc1ccccc1 ZINC000431623476 477063387 /nfs/dbraw/zinc/06/33/87/477063387.db2.gz SPZBBDBPTITDKS-IBGZPJMESA-N 1 3 331.504 2.889 10 0 EFAEHO CN(CCCNC(=O)CC[C@@H]1CCCC[N@H+]1C)Cc1ccccc1 ZINC000431623476 477063391 /nfs/dbraw/zinc/06/33/91/477063391.db2.gz SPZBBDBPTITDKS-IBGZPJMESA-N 1 3 331.504 2.889 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@H](O)c2ccc(Cl)c(F)c2)[C@H]2CCC[C@H]21 ZINC000375896080 477068646 /nfs/dbraw/zinc/06/86/46/477068646.db2.gz SOLRZYXFQDOXNP-ZFVVBOAOSA-N 1 3 326.843 2.975 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)[C@H]2CCC[C@H]21 ZINC000375896080 477068649 /nfs/dbraw/zinc/06/86/49/477068649.db2.gz SOLRZYXFQDOXNP-ZFVVBOAOSA-N 1 3 326.843 2.975 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)[C@H]2CCC[C@H]21 ZINC000375896080 477068654 /nfs/dbraw/zinc/06/86/54/477068654.db2.gz SOLRZYXFQDOXNP-ZFVVBOAOSA-N 1 3 326.843 2.975 10 0 EFAEHO CCCC[N@H+](C)C[C@H](C)NC(=O)CCN1CCc2ccccc2C1 ZINC000416233955 477082494 /nfs/dbraw/zinc/08/24/94/477082494.db2.gz LFACVUOHFDSKCW-KRWDZBQOSA-N 1 3 331.504 2.671 10 0 EFAEHO CCCC[N@@H+](C)C[C@H](C)NC(=O)CCN1CCc2ccccc2C1 ZINC000416233955 477082498 /nfs/dbraw/zinc/08/24/98/477082498.db2.gz LFACVUOHFDSKCW-KRWDZBQOSA-N 1 3 331.504 2.671 10 0 EFAEHO CN(C)CCOc1ccc(CNC(=O)CC[C@@H]2CCCC[N@@H+]2C)cc1 ZINC000431763669 477091212 /nfs/dbraw/zinc/09/12/12/477091212.db2.gz CHCNPINCBYKXFZ-SFHVURJKSA-N 1 3 347.503 2.508 10 0 EFAEHO CN(C)CCOc1ccc(CNC(=O)CC[C@@H]2CCCC[N@H+]2C)cc1 ZINC000431763669 477091222 /nfs/dbraw/zinc/09/12/22/477091222.db2.gz CHCNPINCBYKXFZ-SFHVURJKSA-N 1 3 347.503 2.508 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000431835176 477103814 /nfs/dbraw/zinc/10/38/14/477103814.db2.gz XGIBANVSUSOIEL-YZGWKJHDSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000431835176 477103822 /nfs/dbraw/zinc/10/38/22/477103822.db2.gz XGIBANVSUSOIEL-YZGWKJHDSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H](c1ccncc1)N1CCC(NC(=O)[C@H]2[NH2+]CCCC2(C)C)CC1 ZINC000423850266 477184165 /nfs/dbraw/zinc/18/41/65/477184165.db2.gz POAVHYRMWWWOLK-MAUKXSAKSA-N 1 3 344.503 2.501 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2c(F)cccc2-n2cccn2)[C@@H]2CCC[C@@H]21 ZINC000453349194 477210894 /nfs/dbraw/zinc/21/08/94/477210894.db2.gz JGVGEWYKLSSGJW-WBAXXEDZSA-N 1 3 328.435 2.974 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+](C)[C@@H](C)[C@@H]2Cc3ccccc3O2)CC1 ZINC000367044894 477314084 /nfs/dbraw/zinc/31/40/84/477314084.db2.gz YBMZRYIVSOKMPC-RXVVDRJESA-N 1 3 345.531 2.727 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+](C)[C@@H](C)[C@@H]2Cc3ccccc3O2)CC1 ZINC000367044894 477314092 /nfs/dbraw/zinc/31/40/92/477314092.db2.gz YBMZRYIVSOKMPC-RXVVDRJESA-N 1 3 345.531 2.727 10 0 EFAEHO CC(C)N1CCN(CCC[NH+]2CCC(c3ccccn3)CC2)CC1 ZINC000367049340 477317476 /nfs/dbraw/zinc/31/74/76/477317476.db2.gz FAMWNDHSPVEHRA-UHFFFAOYSA-N 1 3 330.520 2.677 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)NC[C@H](c2ccccc2)N(C)C)cc1 ZINC000416808993 477317715 /nfs/dbraw/zinc/31/77/15/477317715.db2.gz PLVJKZZFPWQEIR-HNAYVOBHSA-N 1 3 340.471 2.808 10 0 EFAEHO COCC[C@H]1CCC[C@H]1[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000367078856 477331013 /nfs/dbraw/zinc/33/10/13/477331013.db2.gz SFYWQFVHMLNCHA-RTBURBONSA-N 1 3 337.552 2.732 10 0 EFAEHO CN1CC[C@H](NC(=O)NCCCC[N@H+](C)C2CC2)[C@H]1c1ccccc1 ZINC000454720977 477345009 /nfs/dbraw/zinc/34/50/09/477345009.db2.gz KLDVSDQYCJAGMN-RBUKOAKNSA-N 1 3 344.503 2.605 10 0 EFAEHO CN1CC[C@H](NC(=O)NCCCC[N@@H+](C)C2CC2)[C@H]1c1ccccc1 ZINC000454720977 477345014 /nfs/dbraw/zinc/34/50/14/477345014.db2.gz KLDVSDQYCJAGMN-RBUKOAKNSA-N 1 3 344.503 2.605 10 0 EFAEHO CN(C(=O)NCc1ccccc1CN1CCCCC1)C1CC[NH2+]CC1 ZINC000416892734 477356915 /nfs/dbraw/zinc/35/69/15/477356915.db2.gz BILMZNFOZROPDX-UHFFFAOYSA-N 1 3 344.503 2.566 10 0 EFAEHO C[C@H]1CC2(CN1CC(=O)N[C@H]1CCCc3ccccc31)CC[NH2+]CC2 ZINC000424289627 477357415 /nfs/dbraw/zinc/35/74/15/477357415.db2.gz MDVZHFNXUPOXFF-LPHOPBHVSA-N 1 3 341.499 2.644 10 0 EFAEHO C[NH2+][C@@H]1CCCN(C(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000416901210 477361928 /nfs/dbraw/zinc/36/19/28/477361928.db2.gz KDWYESBSYQAZBU-LJQANCHMSA-N 1 3 344.503 2.566 10 0 EFAEHO C[C@H]1CC2(CN1Cc1ccn(-c3ccc(F)cc3)n1)CC[NH2+]CC2 ZINC000424299017 477361954 /nfs/dbraw/zinc/36/19/54/477361954.db2.gz VMAKZTUWANXEKP-HNNXBMFYSA-N 1 3 328.435 2.975 10 0 EFAEHO CC(C)N1CC[C@@H]([NH2+]C2CCN([C@H](C)Cc3ccccc3)CC2)C1=O ZINC000449156430 477461798 /nfs/dbraw/zinc/46/17/98/477461798.db2.gz NYSAHROMZLXLDH-YLJYHZDGSA-N 1 3 343.515 2.681 10 0 EFAEHO [NH3+]CCCNC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000418339173 477469713 /nfs/dbraw/zinc/46/97/13/477469713.db2.gz BJRBVHIKKMPKFV-UHFFFAOYSA-N 1 3 344.503 2.566 10 0 EFAEHO CCC(=O)N1CC[C@@H](NC2CC[NH+]([C@H](C)Cc3ccccc3)CC2)C1 ZINC000449194698 477480203 /nfs/dbraw/zinc/48/02/03/477480203.db2.gz VKBBIGFMZLWMBG-YLJYHZDGSA-N 1 3 343.515 2.683 10 0 EFAEHO CN1CC[C@@H](NC(=O)NC(C)(C)C[NH+]2CCCC2)[C@H]1c1ccccc1 ZINC000458567568 477485339 /nfs/dbraw/zinc/48/53/39/477485339.db2.gz CWMFPBRVFNXLQG-QZTJIDSGSA-N 1 3 344.503 2.605 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccnc(OC3CCOCC3)c2)[C@@H]2CCC[C@@H]21 ZINC000367625213 477608938 /nfs/dbraw/zinc/60/89/38/477608938.db2.gz XHZAZRNSUGOXMH-FHWLQOOXSA-N 1 3 345.487 2.602 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2OC2CC2)CC[C@@H]1N1CCN(C)CC1 ZINC000450650632 477669134 /nfs/dbraw/zinc/66/91/34/477669134.db2.gz RJJAQBCLBXSPNT-XLIONFOSSA-N 1 3 343.515 2.686 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2OC2CC2)CC[C@@H]1N1CCN(C)CC1 ZINC000450650632 477669143 /nfs/dbraw/zinc/66/91/43/477669143.db2.gz RJJAQBCLBXSPNT-XLIONFOSSA-N 1 3 343.515 2.686 10 0 EFAEHO CCCc1ccc([C@@H](C)N(CC[C@H]2CCC[NH2+]C2)CC(N)=O)cc1 ZINC000420296874 477669423 /nfs/dbraw/zinc/66/94/23/477669423.db2.gz CIHLILBRWGTQFT-SJLPKXTDSA-N 1 3 331.504 2.877 10 0 EFAEHO CCC1(CNCc2cnnn2C)CC[NH+](Cc2ccccc2)CC1 ZINC000372230985 477703814 /nfs/dbraw/zinc/70/38/14/477703814.db2.gz IQSRXZQOKWRIGP-UHFFFAOYSA-N 1 3 327.476 2.597 10 0 EFAEHO CC[NH+](CC)CCN(Cc1cccs1)C(=O)NC[C@H](C)N(C)C ZINC000459032688 477709236 /nfs/dbraw/zinc/70/92/36/477709236.db2.gz AYEMKVCJDDXANW-HNNXBMFYSA-N 1 3 340.537 2.552 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)Nc2cccc(OCCN(C)C)c2)CC[N@@H+]1C ZINC000437782579 477753191 /nfs/dbraw/zinc/75/31/91/477753191.db2.gz WKJKSOMTOGETFM-RDJZCZTQSA-N 1 3 348.491 2.573 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)Nc2cccc(OCCN(C)C)c2)CC[N@H+]1C ZINC000437782579 477753198 /nfs/dbraw/zinc/75/31/98/477753198.db2.gz WKJKSOMTOGETFM-RDJZCZTQSA-N 1 3 348.491 2.573 10 0 EFAEHO CN(C(=O)NC[C@H]1CCC[N@@H+]1C1CCCCC1)[C@H]1CCN(C2CC2)C1 ZINC000438318246 477822745 /nfs/dbraw/zinc/82/27/45/477822745.db2.gz CYMRDYMCSSPCAG-MOPGFXCFSA-N 1 3 348.535 2.662 10 0 EFAEHO CN(C(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1)[C@H]1CCN(C2CC2)C1 ZINC000438318246 477822752 /nfs/dbraw/zinc/82/27/52/477822752.db2.gz CYMRDYMCSSPCAG-MOPGFXCFSA-N 1 3 348.535 2.662 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)CC2CC[NH+](C)CC2)C1 ZINC000456353578 477881370 /nfs/dbraw/zinc/88/13/70/477881370.db2.gz ZLVSREFLYFJRJP-GOSISDBHSA-N 1 3 343.515 2.699 10 0 EFAEHO CNC(=O)C[C@@H]([NH2+]C1CCN(c2ccncc2)CC1)c1ccccc1 ZINC000459522150 477954101 /nfs/dbraw/zinc/95/41/01/477954101.db2.gz WKZSPLJDEZOGRW-LJQANCHMSA-N 1 3 338.455 2.517 10 0 EFAEHO CC(C)n1ncc2c1C[C@@H]([NH2+]C1CCN(c3ccncc3)CC1)CC2 ZINC000459533479 477956714 /nfs/dbraw/zinc/95/67/14/477956714.db2.gz VUAJWYZRWPXFAR-SFHVURJKSA-N 1 3 339.487 2.975 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)NCC2([NH+](C)C)CCCCCC2)CCN1C ZINC000465620606 477983850 /nfs/dbraw/zinc/98/38/50/477983850.db2.gz AGVDODCELQRBLG-IRXDYDNUSA-N 1 3 338.540 2.765 10 0 EFAEHO CC1(C)NC(=O)CC[C@H]1[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000495031040 478108503 /nfs/dbraw/zinc/10/85/03/478108503.db2.gz REIMIOGDJIBVNM-RBUKOAKNSA-N 1 3 343.515 2.936 10 0 EFAEHO C[C@@H](CN(C)[C@]1(CO)CC[C@H](C)C1)C[N@H+](C)[C@@]1(CO)CC[C@H](C)C1 ZINC000495194382 478139412 /nfs/dbraw/zinc/13/94/12/478139412.db2.gz LVIDPVCTNHMVNC-FSGKZVOOSA-N 1 3 340.552 2.588 10 0 EFAEHO C[C@@H](CN(C)[C@]1(CO)CC[C@H](C)C1)C[N@@H+](C)[C@@]1(CO)CC[C@H](C)C1 ZINC000495194382 478139418 /nfs/dbraw/zinc/13/94/18/478139418.db2.gz LVIDPVCTNHMVNC-FSGKZVOOSA-N 1 3 340.552 2.588 10 0 EFAEHO C[C@H](CN(C)[C@@]1(CO)CC[C@H](C)C1)C[N@H+](C)[C@]1(CO)CC[C@H](C)C1 ZINC000495194382 478139422 /nfs/dbraw/zinc/13/94/22/478139422.db2.gz LVIDPVCTNHMVNC-FSGKZVOOSA-N 1 3 340.552 2.588 10 0 EFAEHO C[C@H](CN(C)[C@@]1(CO)CC[C@H](C)C1)C[N@@H+](C)[C@]1(CO)CC[C@H](C)C1 ZINC000495194382 478139427 /nfs/dbraw/zinc/13/94/27/478139427.db2.gz LVIDPVCTNHMVNC-FSGKZVOOSA-N 1 3 340.552 2.588 10 0 EFAEHO C[C@H](CN(C)[C@]1(CO)CC[C@@H](C)C1)C[N@H+](C)[C@]1(CO)CC[C@H](C)C1 ZINC000495194391 478139585 /nfs/dbraw/zinc/13/95/85/478139585.db2.gz LVIDPVCTNHMVNC-USYVTKNRSA-N 1 3 340.552 2.588 10 0 EFAEHO C[C@H](CN(C)[C@]1(CO)CC[C@@H](C)C1)C[N@@H+](C)[C@]1(CO)CC[C@H](C)C1 ZINC000495194391 478139592 /nfs/dbraw/zinc/13/95/92/478139592.db2.gz LVIDPVCTNHMVNC-USYVTKNRSA-N 1 3 340.552 2.588 10 0 EFAEHO C[C@@H](CN(C)[C@]1(CO)CC[C@H](C)C1)C[N@H+](C)[C@]1(CO)CC[C@@H](C)C1 ZINC000495194391 478139597 /nfs/dbraw/zinc/13/95/97/478139597.db2.gz LVIDPVCTNHMVNC-USYVTKNRSA-N 1 3 340.552 2.588 10 0 EFAEHO C[C@@H](CN(C)[C@]1(CO)CC[C@H](C)C1)C[N@@H+](C)[C@]1(CO)CC[C@@H](C)C1 ZINC000495194391 478139601 /nfs/dbraw/zinc/13/96/01/478139601.db2.gz LVIDPVCTNHMVNC-USYVTKNRSA-N 1 3 340.552 2.588 10 0 EFAEHO C[C@H]([NH2+]CCCN1CCC[C@H](C(N)=O)C1)c1ccc(Cl)c(F)c1 ZINC000534329001 478146039 /nfs/dbraw/zinc/14/60/39/478146039.db2.gz SFPWZHYDYLNLGL-JSGCOSHPSA-N 1 3 341.858 2.717 10 0 EFAEHO CC(C)[N@H+](C)CCNC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000488916110 478200245 /nfs/dbraw/zinc/20/02/45/478200245.db2.gz VAKMZYPKXUHTAT-HXUWFJFHSA-N 1 3 346.519 2.681 10 0 EFAEHO CC(C)[N@@H+](C)CCNC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000488916110 478200248 /nfs/dbraw/zinc/20/02/48/478200248.db2.gz VAKMZYPKXUHTAT-HXUWFJFHSA-N 1 3 346.519 2.681 10 0 EFAEHO CC1(C)COC[C@@H]1[NH2+]Cc1cccc(CN[C@@H]2COCC2(C)C)c1 ZINC000451811226 478212590 /nfs/dbraw/zinc/21/25/90/478212590.db2.gz MWNDEMDWXVRZRW-HDICACEKSA-N 1 3 332.488 2.716 10 0 EFAEHO CC1(C)COC[C@@H]1NCc1cccc(C[NH2+][C@@H]2COCC2(C)C)c1 ZINC000451811226 478212594 /nfs/dbraw/zinc/21/25/94/478212594.db2.gz MWNDEMDWXVRZRW-HDICACEKSA-N 1 3 332.488 2.716 10 0 EFAEHO C[C@H](CC[NH+](C)C)NC(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000489081290 478216307 /nfs/dbraw/zinc/21/63/07/478216307.db2.gz VMGRRWSCBWZSAM-XLIONFOSSA-N 1 3 346.519 2.681 10 0 EFAEHO CCOCC[C@@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000570155387 478294510 /nfs/dbraw/zinc/29/45/10/478294510.db2.gz KMUXACFEQBQFHV-RAFMOHDBSA-N 1 3 332.488 2.559 10 0 EFAEHO CCOCC[C@@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000570155387 478294518 /nfs/dbraw/zinc/29/45/18/478294518.db2.gz KMUXACFEQBQFHV-RAFMOHDBSA-N 1 3 332.488 2.559 10 0 EFAEHO C[C@H]([NH2+]Cc1cccc(C(=O)NCCN(C)C)c1)[C@@H]1C[C@H]1C1CC1 ZINC000527653585 478463215 /nfs/dbraw/zinc/46/32/15/478463215.db2.gz MRYWYVSXNNGFKM-JVPBZIDWSA-N 1 3 329.488 2.502 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@@H]3OCC[C@@H]3C2)CC1 ZINC000563157394 478463659 /nfs/dbraw/zinc/46/36/59/478463659.db2.gz CNSJOXKDEPPXDB-CTNGQTDRSA-N 1 3 343.515 2.829 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)CC1 ZINC000563157394 478463663 /nfs/dbraw/zinc/46/36/63/478463663.db2.gz CNSJOXKDEPPXDB-CTNGQTDRSA-N 1 3 343.515 2.829 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CN(C)CCC(=O)NC(C)C)C2)s1 ZINC000563214481 478483236 /nfs/dbraw/zinc/48/32/36/478483236.db2.gz AESRNZMCMNOBSX-INIZCTEOSA-N 1 3 337.533 2.725 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)CCC(=O)NC(C)C)C2)s1 ZINC000563214481 478483243 /nfs/dbraw/zinc/48/32/43/478483243.db2.gz AESRNZMCMNOBSX-INIZCTEOSA-N 1 3 337.533 2.725 10 0 EFAEHO CNC[C@@](C)(O)C[NH+]1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000563267954 478500624 /nfs/dbraw/zinc/50/06/24/478500624.db2.gz GIXKDSFJQUTIEQ-MRXNPFEDSA-N 1 3 330.394 2.855 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CCN(C)c1ccncc1)[NH+]1CCC(C)CC1 ZINC000540929419 478511480 /nfs/dbraw/zinc/51/14/80/478511480.db2.gz VSTVMIIGNBQANR-LJQANCHMSA-N 1 3 346.519 2.781 10 0 EFAEHO CC[C@@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)C1CCOCC1 ZINC000563346381 478523123 /nfs/dbraw/zinc/52/31/23/478523123.db2.gz YSYCHDYLPHTQDT-HXUWFJFHSA-N 1 3 346.515 2.808 10 0 EFAEHO CN1CC[C@H](NC(=O)N[C@@H](C[NH3+])C2CCCCC2)[C@@H]1c1ccccc1 ZINC000582171173 478530239 /nfs/dbraw/zinc/53/02/39/478530239.db2.gz RDWORXYJZZTLAA-FHWLQOOXSA-N 1 3 344.503 2.639 10 0 EFAEHO CC[N@@H+]1CC[C@H](NC[C@H]2CCN2Cc2ccc(OC)cc2)[C@H](C)C1 ZINC000527963714 478589959 /nfs/dbraw/zinc/58/99/59/478589959.db2.gz BONWBGDFYJOOKM-POAQFYNOSA-N 1 3 331.504 2.589 10 0 EFAEHO CC[N@H+]1CC[C@H](NC[C@H]2CCN2Cc2ccc(OC)cc2)[C@H](C)C1 ZINC000527963714 478589966 /nfs/dbraw/zinc/58/99/66/478589966.db2.gz BONWBGDFYJOOKM-POAQFYNOSA-N 1 3 331.504 2.589 10 0 EFAEHO COc1ccc(CN2CC[C@@H]2CNC2CC[NH+](CC3CC3)CC2)cc1 ZINC000527971106 478594513 /nfs/dbraw/zinc/59/45/13/478594513.db2.gz RXWVZZPNFGKUTO-HXUWFJFHSA-N 1 3 343.515 2.734 10 0 EFAEHO COc1ccc(CN2CC[C@@H]2C[NH2+]C2CCN(CC3CC3)CC2)cc1 ZINC000527971106 478594520 /nfs/dbraw/zinc/59/45/20/478594520.db2.gz RXWVZZPNFGKUTO-HXUWFJFHSA-N 1 3 343.515 2.734 10 0 EFAEHO CCN(C(=O)NCC1([NH3+])CCC1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000563601445 478598655 /nfs/dbraw/zinc/59/86/55/478598655.db2.gz HOPHHWVHNBXLNS-SJLPKXTDSA-N 1 3 344.503 2.735 10 0 EFAEHO CCc1ccccc1[C@@H](N)CNC(=O)N1CCCC12CC[NH+](C)CC2 ZINC000563614482 478601798 /nfs/dbraw/zinc/60/17/98/478601798.db2.gz VLSRGONLNLFHRQ-SFHVURJKSA-N 1 3 344.503 2.519 10 0 EFAEHO C[C@@H](CSCCF)[NH2+]Cc1ccc(CN2CCN(C)CC2)cc1 ZINC000595011334 478628153 /nfs/dbraw/zinc/62/81/53/478628153.db2.gz CTRPEGKMSZCFFE-INIZCTEOSA-N 1 3 339.524 2.615 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCCCNC(=O)CCN(C)c1ccncc1 ZINC000542785880 478685537 /nfs/dbraw/zinc/68/55/37/478685537.db2.gz UREVLOVFNHDBEQ-KRWDZBQOSA-N 1 3 332.492 2.679 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCCCNC(=O)CCN(C)c1ccncc1 ZINC000542785880 478685544 /nfs/dbraw/zinc/68/55/44/478685544.db2.gz UREVLOVFNHDBEQ-KRWDZBQOSA-N 1 3 332.492 2.679 10 0 EFAEHO CN(CC[N@H+](C)C1CCCCC1)C(=O)CCN(C)c1ccncc1 ZINC000542785720 478685682 /nfs/dbraw/zinc/68/56/82/478685682.db2.gz HXODHFVAUNVJFB-UHFFFAOYSA-N 1 3 332.492 2.631 10 0 EFAEHO CN(CC[N@@H+](C)C1CCCCC1)C(=O)CCN(C)c1ccncc1 ZINC000542785720 478685692 /nfs/dbraw/zinc/68/56/92/478685692.db2.gz HXODHFVAUNVJFB-UHFFFAOYSA-N 1 3 332.492 2.631 10 0 EFAEHO CN1CCC[C@@H](CNC(=O)CCCC[NH+](C)C)[C@@H]1c1cccs1 ZINC000571848321 478688711 /nfs/dbraw/zinc/68/87/11/478688711.db2.gz QCYFLXIAKKZGKD-MAUKXSAKSA-N 1 3 337.533 2.979 10 0 EFAEHO C[C@H](CN1CCC(C)CC1)NC(=O)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000582856956 478705145 /nfs/dbraw/zinc/70/51/45/478705145.db2.gz VSEPAPKEACDRNP-CVEARBPZSA-N 1 3 332.492 2.626 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)[C@@H]1C[C@H]1c1ccsc1 ZINC000528335126 478724905 /nfs/dbraw/zinc/72/49/05/478724905.db2.gz MPZOJKLKOKBVJS-FGTMMUONSA-N 1 3 349.544 2.726 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)[C@@H]1C[C@H]1c1ccsc1 ZINC000528335126 478724910 /nfs/dbraw/zinc/72/49/10/478724910.db2.gz MPZOJKLKOKBVJS-FGTMMUONSA-N 1 3 349.544 2.726 10 0 EFAEHO CN(C)Cc1ccc(NC(=O)CCN(C)c2cc[nH+]cc2)c(F)c1 ZINC000572100194 478749665 /nfs/dbraw/zinc/74/96/65/478749665.db2.gz DNKBEUKGNMXONS-UHFFFAOYSA-N 1 3 330.407 2.747 10 0 EFAEHO CC[NH+](CC)CCO[C@@H]1CCN(C[C@H](OC)c2ccc(F)cc2)C1 ZINC000528400926 478756240 /nfs/dbraw/zinc/75/62/40/478756240.db2.gz TUXBTTPODWDDLP-MOPGFXCFSA-N 1 3 338.467 2.946 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCC1CCN(C[C@@H](O)CC2(O)CCC2)CC1 ZINC000528404381 478758705 /nfs/dbraw/zinc/75/87/05/478758705.db2.gz NIINOEZMNIFXSS-HKUYNNGSSA-N 1 3 338.536 2.629 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCC1CCN(C[C@@H](O)CC2(O)CCC2)CC1 ZINC000528404381 478758712 /nfs/dbraw/zinc/75/87/12/478758712.db2.gz NIINOEZMNIFXSS-HKUYNNGSSA-N 1 3 338.536 2.629 10 0 EFAEHO CN(CCC(=O)NC[C@@H]1CCC[N@@H+]1C1CCCCC1)c1ccncc1 ZINC000564628520 478771645 /nfs/dbraw/zinc/77/16/45/478771645.db2.gz UZPIWPJNDIKGEH-IBGZPJMESA-N 1 3 344.503 2.821 10 0 EFAEHO CN(CCC(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1ccncc1 ZINC000564628520 478771651 /nfs/dbraw/zinc/77/16/51/478771651.db2.gz UZPIWPJNDIKGEH-IBGZPJMESA-N 1 3 344.503 2.821 10 0 EFAEHO O[C@@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)COCC1CC1 ZINC000499144830 478774253 /nfs/dbraw/zinc/77/42/53/478774253.db2.gz DWJRLELQCASLEY-WOZUAGRISA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)COCC1CC1 ZINC000499144830 478774257 /nfs/dbraw/zinc/77/42/57/478774257.db2.gz DWJRLELQCASLEY-WOZUAGRISA-N 1 3 344.499 2.559 10 0 EFAEHO CC[C@H]1CCCC[N@@H+]1CCNC(=O)c1ccccc1OCCN(C)C ZINC000499691752 478779636 /nfs/dbraw/zinc/77/96/36/478779636.db2.gz FZLLKNHXBYGNBD-KRWDZBQOSA-N 1 3 347.503 2.621 10 0 EFAEHO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1ccccc1OCCN(C)C ZINC000499691752 478779642 /nfs/dbraw/zinc/77/96/42/478779642.db2.gz FZLLKNHXBYGNBD-KRWDZBQOSA-N 1 3 347.503 2.621 10 0 EFAEHO c1csc(CCN2CCN(Cc3ccc4c(c3)C[NH2+]CC4)CC2)c1 ZINC000564660469 478780064 /nfs/dbraw/zinc/78/00/64/478780064.db2.gz GOFNXJIGAKDTQB-UHFFFAOYSA-N 1 3 341.524 2.754 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)NCC1([NH+](C)C)CCCCCC1 ZINC000501544485 478806511 /nfs/dbraw/zinc/80/65/11/478806511.db2.gz DOPWTLDPLODORI-KRWDZBQOSA-N 1 3 338.540 2.815 10 0 EFAEHO CC[C@@H]1CCCC[N@@H+]1CCNC(=O)N1CCc2ccccc2[C@H]1CN ZINC000564937614 478865486 /nfs/dbraw/zinc/86/54/86/478865486.db2.gz LWWGIQHDXVJJMS-IEBWSBKVSA-N 1 3 344.503 2.519 10 0 EFAEHO CC[C@@H]1CCCC[N@H+]1CCNC(=O)N1CCc2ccccc2[C@H]1CN ZINC000564937614 478865489 /nfs/dbraw/zinc/86/54/89/478865489.db2.gz LWWGIQHDXVJJMS-IEBWSBKVSA-N 1 3 344.503 2.519 10 0 EFAEHO C[C@H]1CCC[C@H](C)[NH+]1CCNC(=O)Nc1ccc2c(c1)OCCNC2 ZINC000528717632 478895332 /nfs/dbraw/zinc/89/53/32/478895332.db2.gz FFYGUTCNLOOBFK-GJZGRUSLSA-N 1 3 346.475 2.553 10 0 EFAEHO CCO[C@@H]1C[C@@H](NC[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)[C@H]1SC ZINC000592523954 478930474 /nfs/dbraw/zinc/93/04/74/478930474.db2.gz AWLUZHNXVWVSHL-RHQZKXFESA-N 1 3 334.529 2.830 10 0 EFAEHO CCO[C@@H]1C[C@@H](NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)[C@H]1SC ZINC000592523954 478930480 /nfs/dbraw/zinc/93/04/80/478930480.db2.gz AWLUZHNXVWVSHL-RHQZKXFESA-N 1 3 334.529 2.830 10 0 EFAEHO CC(C)OC[C@@H](O)CNCc1ccccc1C[NH+]1CCCCCC1 ZINC000572870102 478940460 /nfs/dbraw/zinc/94/04/60/478940460.db2.gz AYETXCCWCLMNOW-FQEVSTJZSA-N 1 3 334.504 2.938 10 0 EFAEHO C[NH+](C)CC1(CNC(=O)Nc2ccc3c(c2F)CCNC3)CCCC1 ZINC000583800735 478943864 /nfs/dbraw/zinc/94/38/64/478943864.db2.gz DUDKSQKVEGTFQB-UHFFFAOYSA-N 1 3 348.466 2.715 10 0 EFAEHO C[C@@H]1C[C@H](CCNC[C@@H](O)C(F)(F)F)C[N@@H+]1Cc1ccccc1 ZINC000514668404 479044704 /nfs/dbraw/zinc/04/47/04/479044704.db2.gz GTFLCZCNTZUFFS-VNQPRFMTSA-N 1 3 330.394 2.800 10 0 EFAEHO C[C@@H]1C[C@H](CCNC[C@@H](O)C(F)(F)F)C[N@H+]1Cc1ccccc1 ZINC000514668404 479044712 /nfs/dbraw/zinc/04/47/12/479044712.db2.gz GTFLCZCNTZUFFS-VNQPRFMTSA-N 1 3 330.394 2.800 10 0 EFAEHO CN(CCCN(C)Cc1cnc(-c2ccccn2)s1)CC[NH+](C)C ZINC000514693947 479049142 /nfs/dbraw/zinc/04/91/42/479049142.db2.gz STJMYFCYGZTAQD-UHFFFAOYSA-N 1 3 347.532 2.520 10 0 EFAEHO Cc1nsc(C)c1CN1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000514735783 479059069 /nfs/dbraw/zinc/05/90/69/479059069.db2.gz FYHSCRKCDLPMBA-UHFFFAOYSA-N 1 3 336.549 2.609 10 0 EFAEHO C[NH2+][C@@H](C)C(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000584241049 479066060 /nfs/dbraw/zinc/06/60/60/479066060.db2.gz APHZSSHPWLPIIX-SFHVURJKSA-N 1 3 339.483 2.755 10 0 EFAEHO CCCN(CCN1CCCCCC1)C(=O)N[C@@H]1CC[NH2+]C12CCC2 ZINC000529350883 479133708 /nfs/dbraw/zinc/13/37/08/479133708.db2.gz LSBLBNQRMHXFCO-QGZVFWFLSA-N 1 3 336.524 2.569 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[NH2+][C@@H](C)C1=CCN(C)CC1 ZINC000573835380 479154226 /nfs/dbraw/zinc/15/42/26/479154226.db2.gz ZFKZDVYBJKSLCE-FUHWJXTLSA-N 1 3 332.488 2.790 10 0 EFAEHO C[C@@H]([NH2+]CCCN1CCN(c2ccncc2)CC1)C1CC(F)(F)C1 ZINC000529537279 479198790 /nfs/dbraw/zinc/19/87/90/479198790.db2.gz CZBQGLJRIGQNCA-OAHLLOKOSA-N 1 3 338.446 2.617 10 0 EFAEHO c1cc2c(cc1CN1CCC(OC[C@@H]3CCCCO3)CC1)C[NH2+]CC2 ZINC000584783725 479243227 /nfs/dbraw/zinc/24/32/27/479243227.db2.gz KIWQYUJVEUPVAT-NRFANRHFSA-N 1 3 344.499 2.882 10 0 EFAEHO C[NH2+]Cc1ccccc1CNCc1ccc(O[C@@H](C)C(=O)OC)cc1 ZINC000593318039 479290903 /nfs/dbraw/zinc/29/09/03/479290903.db2.gz NOHDNEGVWUXJQG-HNNXBMFYSA-N 1 3 342.439 2.636 10 0 EFAEHO C[N@H+](CCNC(=O)Nc1ccc2c(c1)CNCC2)C1CCCCC1 ZINC000574664335 479327761 /nfs/dbraw/zinc/32/77/61/479327761.db2.gz XGHLHXFEERCXSN-UHFFFAOYSA-N 1 3 330.476 2.718 10 0 EFAEHO C[N@@H+](CCNC(=O)Nc1ccc2c(c1)CNCC2)C1CCCCC1 ZINC000574664335 479327767 /nfs/dbraw/zinc/32/77/67/479327767.db2.gz XGHLHXFEERCXSN-UHFFFAOYSA-N 1 3 330.476 2.718 10 0 EFAEHO C[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)C1CC[NH+](C)CC1 ZINC000603321797 479345926 /nfs/dbraw/zinc/34/59/26/479345926.db2.gz RIRSLZGUNBHARI-MRXNPFEDSA-N 1 3 329.488 2.743 10 0 EFAEHO COc1ccc(OCCN(C)Cc2ccc3c(c2)C[NH2+]CC3)cc1 ZINC000575187351 479417130 /nfs/dbraw/zinc/41/71/30/479417130.db2.gz KCGOQTQBUQHAGB-UHFFFAOYSA-N 1 3 326.440 2.852 10 0 EFAEHO CCOC(=O)[C@](C)(CN[C@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1 ZINC000600151827 479546529 /nfs/dbraw/zinc/54/65/29/479546529.db2.gz OUEXJCFTISHMGV-FXAWDEMLSA-N 1 3 332.488 2.970 10 0 EFAEHO CCOC(=O)[C@](C)(CN[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1 ZINC000600151827 479546531 /nfs/dbraw/zinc/54/65/31/479546531.db2.gz OUEXJCFTISHMGV-FXAWDEMLSA-N 1 3 332.488 2.970 10 0 EFAEHO COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000600157498 479550617 /nfs/dbraw/zinc/55/06/17/479550617.db2.gz XJCJERLCBWVDKH-BPQIPLTHSA-N 1 3 332.488 2.869 10 0 EFAEHO COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000600157498 479550622 /nfs/dbraw/zinc/55/06/22/479550622.db2.gz XJCJERLCBWVDKH-BPQIPLTHSA-N 1 3 332.488 2.869 10 0 EFAEHO COC(=O)c1ccc(CNC2CCN(c3cc[nH+]cc3)CC2)c(F)c1 ZINC000597223377 479628038 /nfs/dbraw/zinc/62/80/38/479628038.db2.gz WIZAWULBYPPZQA-UHFFFAOYSA-N 1 3 343.402 2.766 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N(CCN(C)C)CC1CCCCC1 ZINC000606637741 479711025 /nfs/dbraw/zinc/71/10/25/479711025.db2.gz CCNUJRFQUPQVMQ-QGZVFWFLSA-N 1 3 340.556 2.870 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NC[C@H]2N(C)CCCC2(C)C)CC1 ZINC000633196143 479712098 /nfs/dbraw/zinc/71/20/98/479712098.db2.gz CQPRHDBSMBSZRG-MRXNPFEDSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)N1CCN(C2CC[NH+](C[C@@]3(C)CCCS3)CC2)CC1 ZINC000628188094 479804516 /nfs/dbraw/zinc/80/45/16/479804516.db2.gz NLNTVPVGCYNFCF-GOSISDBHSA-N 1 3 325.566 2.763 10 0 EFAEHO C[NH+]1CCC(CNCc2cnc(C3CC3)o2)(N2CCCCC2)CC1 ZINC000628220766 479818760 /nfs/dbraw/zinc/81/87/60/479818760.db2.gz IPRJATDXMQAQOU-UHFFFAOYSA-N 1 3 332.492 2.592 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)CC[N@@H+]1C ZINC000631627989 480190392 /nfs/dbraw/zinc/19/03/92/480190392.db2.gz FDVMZBHEQVQWPE-GSEOLPGOSA-N 1 3 343.515 2.744 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)CC[N@H+]1C ZINC000631627989 480190400 /nfs/dbraw/zinc/19/04/00/480190400.db2.gz FDVMZBHEQVQWPE-GSEOLPGOSA-N 1 3 343.515 2.744 10 0 EFAEHO O[C@H]1CC[N@H+](Cc2ccc(CN[C@@H]3CCCc4ncccc43)cc2)C1 ZINC000631647171 480198032 /nfs/dbraw/zinc/19/80/32/480198032.db2.gz QBSCCHLVIOUBLX-GHTZIAJQSA-N 1 3 337.467 2.815 10 0 EFAEHO O[C@H]1CC[N@@H+](Cc2ccc(CN[C@@H]3CCCc4ncccc43)cc2)C1 ZINC000631647171 480198039 /nfs/dbraw/zinc/19/80/39/480198039.db2.gz QBSCCHLVIOUBLX-GHTZIAJQSA-N 1 3 337.467 2.815 10 0 EFAEHO C[NH+](C)[C@@H](CNC(=O)CN1C[C@@H]2CCCC[C@@]21C)c1ccccc1 ZINC000626103859 480202293 /nfs/dbraw/zinc/20/22/93/480202293.db2.gz TXUMWURYGRTLBI-BJLQDIEVSA-N 1 3 329.488 2.670 10 0 EFAEHO CN(C)[C@@H](CNC(=O)C[N@@H+]1CCCC2(CC2)CC1)c1ccccc1 ZINC000626115087 480208521 /nfs/dbraw/zinc/20/85/21/480208521.db2.gz FTLGHTRYTMSTFA-SFHVURJKSA-N 1 3 329.488 2.672 10 0 EFAEHO CN(C)[C@@H](CNC(=O)C[N@H+]1CCCC2(CC2)CC1)c1ccccc1 ZINC000626115087 480208530 /nfs/dbraw/zinc/20/85/30/480208530.db2.gz FTLGHTRYTMSTFA-SFHVURJKSA-N 1 3 329.488 2.672 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H](C)c1ccc(Cl)cc1 ZINC000617502512 480245724 /nfs/dbraw/zinc/24/57/24/480245724.db2.gz RVVGKXAHTCNIBX-GJZGRUSLSA-N 1 3 339.911 2.832 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H](C)c1ccc(Cl)cc1 ZINC000617502512 480245730 /nfs/dbraw/zinc/24/57/30/480245730.db2.gz RVVGKXAHTCNIBX-GJZGRUSLSA-N 1 3 339.911 2.832 10 0 EFAEHO Cc1nc(C(C)C)sc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617505176 480246736 /nfs/dbraw/zinc/24/67/36/480246736.db2.gz XEPVQELMOJBPFC-ZDUSSCGKSA-N 1 3 340.537 2.577 10 0 EFAEHO Cc1nc(C(C)C)sc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617505176 480246742 /nfs/dbraw/zinc/24/67/42/480246742.db2.gz XEPVQELMOJBPFC-ZDUSSCGKSA-N 1 3 340.537 2.577 10 0 EFAEHO CC(C)c1ccsc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617505202 480247111 /nfs/dbraw/zinc/24/71/11/480247111.db2.gz XSHUTBCPYAUEPM-AWEZNQCLSA-N 1 3 325.522 2.873 10 0 EFAEHO CC(C)c1ccsc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617505202 480247115 /nfs/dbraw/zinc/24/71/15/480247115.db2.gz XSHUTBCPYAUEPM-AWEZNQCLSA-N 1 3 325.522 2.873 10 0 EFAEHO Cc1cc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c(C)n1C(C)C ZINC000617503555 480247203 /nfs/dbraw/zinc/24/72/03/480247203.db2.gz OGIOGSATKJIFLK-HNNXBMFYSA-N 1 3 336.524 2.688 10 0 EFAEHO Cc1cc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c(C)n1C(C)C ZINC000617503555 480247208 /nfs/dbraw/zinc/24/72/08/480247208.db2.gz OGIOGSATKJIFLK-HNNXBMFYSA-N 1 3 336.524 2.688 10 0 EFAEHO CSc1ccc(C)c(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000617503924 480247731 /nfs/dbraw/zinc/24/77/31/480247731.db2.gz ATAOPRTYXSLGHK-HNNXBMFYSA-N 1 3 337.533 2.719 10 0 EFAEHO CSc1ccc(C)c(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000617503924 480247736 /nfs/dbraw/zinc/24/77/36/480247736.db2.gz ATAOPRTYXSLGHK-HNNXBMFYSA-N 1 3 337.533 2.719 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cccc2ccccc21 ZINC000617503500 480248286 /nfs/dbraw/zinc/24/82/86/480248286.db2.gz LUSHBUHCAPHRMK-INIZCTEOSA-N 1 3 327.472 2.842 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cccc2ccccc21 ZINC000617503500 480248290 /nfs/dbraw/zinc/24/82/90/480248290.db2.gz LUSHBUHCAPHRMK-INIZCTEOSA-N 1 3 327.472 2.842 10 0 EFAEHO CN1CC[C@@H]([NH2+]CC2(N3CCSCC3)CCCC2)CC1(C)C ZINC000623357045 480249157 /nfs/dbraw/zinc/24/91/57/480249157.db2.gz XBORSKPBNHSKJY-MRXNPFEDSA-N 1 3 325.566 2.810 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H](c1ccccc1)C1CC1 ZINC000617506633 480249240 /nfs/dbraw/zinc/24/92/40/480249240.db2.gz USQWVIDFXVZLNW-LPHOPBHVSA-N 1 3 331.504 2.568 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H](c1ccccc1)C1CC1 ZINC000617506633 480249246 /nfs/dbraw/zinc/24/92/46/480249246.db2.gz USQWVIDFXVZLNW-LPHOPBHVSA-N 1 3 331.504 2.568 10 0 EFAEHO Cc1ccc(CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c(Cl)c1 ZINC000617506709 480250292 /nfs/dbraw/zinc/25/02/92/480250292.db2.gz WRNAVEYTBQHPDZ-HNNXBMFYSA-N 1 3 339.911 2.579 10 0 EFAEHO Cc1ccc(CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c(Cl)c1 ZINC000617506709 480250295 /nfs/dbraw/zinc/25/02/95/480250295.db2.gz WRNAVEYTBQHPDZ-HNNXBMFYSA-N 1 3 339.911 2.579 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@H](C)OC1CCCCCC1 ZINC000617506442 480251116 /nfs/dbraw/zinc/25/11/16/480251116.db2.gz NMMRWTKQNBJUGN-IRXDYDNUSA-N 1 3 341.540 2.503 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@H](C)OC1CCCCCC1 ZINC000617506442 480251125 /nfs/dbraw/zinc/25/11/25/480251125.db2.gz NMMRWTKQNBJUGN-IRXDYDNUSA-N 1 3 341.540 2.503 10 0 EFAEHO Cc1ccc([C@H](C[NH2+][C@H]2CCN(C)C(C)(C)C2)N2CCOCC2)cc1 ZINC000623364148 480251754 /nfs/dbraw/zinc/25/17/54/480251754.db2.gz VPNHQCVEAIXIFQ-PMACEKPBSA-N 1 3 345.531 2.831 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cccc(NC(=O)[C@@H]3CCCO3)c2)CC1(C)C ZINC000623376019 480255114 /nfs/dbraw/zinc/25/51/14/480255114.db2.gz CBHACJWONVHIKF-ROUUACIJSA-N 1 3 345.487 2.767 10 0 EFAEHO CN1CC[C@@H]([NH2+]Cc2ccc(Cn3ccccc3=O)cc2)CC1(C)C ZINC000623374672 480255648 /nfs/dbraw/zinc/25/56/48/480255648.db2.gz KUTIXVAHOUDQLK-LJQANCHMSA-N 1 3 339.483 2.859 10 0 EFAEHO C[C@H](CN1CCN(c2ccccc2)CC1)N[C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623428838 480278647 /nfs/dbraw/zinc/27/86/47/480278647.db2.gz AKNKTMABUKUKBA-RTBURBONSA-N 1 3 344.547 2.660 10 0 EFAEHO C[C@H](CN1CCN(c2ccccc2)CC1)N[C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623428838 480278656 /nfs/dbraw/zinc/27/86/56/480278656.db2.gz AKNKTMABUKUKBA-RTBURBONSA-N 1 3 344.547 2.660 10 0 EFAEHO CN1CC[C@@H]([NH2+][C@@H](CO)c2cccc(Br)c2)CC1(C)C ZINC000623452885 480290880 /nfs/dbraw/zinc/29/08/80/480290880.db2.gz SQSJCJZQCBEDOO-CABCVRRESA-N 1 3 341.293 2.945 10 0 EFAEHO CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]CC2(N)CCOCC2)cc1 ZINC000629519481 480292135 /nfs/dbraw/zinc/29/21/35/480292135.db2.gz AITDHLSASZDNIK-HNNXBMFYSA-N 1 3 348.491 2.719 10 0 EFAEHO CC[C@@H]([NH2+]CC1(N)CCOCC1)c1ccc(Br)cc1 ZINC000629525336 480294367 /nfs/dbraw/zinc/29/43/67/480294367.db2.gz ZWYHOQSGVILLCM-CQSZACIVSA-N 1 3 327.266 2.998 10 0 EFAEHO C[C@@H]1CN(CCC(=O)Nc2c(Cl)cccc2Cl)C[C@H]1C[NH3+] ZINC000631841415 480295067 /nfs/dbraw/zinc/29/50/67/480295067.db2.gz KIJOWSMASWCFBC-GHMZBOCLSA-N 1 3 330.259 2.849 10 0 EFAEHO C[NH2+]CCOCCN[C@H]1CCCc2ccc(Br)cc21 ZINC000629529961 480295987 /nfs/dbraw/zinc/29/59/87/480295987.db2.gz RKNWGKYGXUCXEY-HNNXBMFYSA-N 1 3 327.266 2.652 10 0 EFAEHO C[NH2+]CCOCCN[C@H]1CCCc2c(Br)cccc21 ZINC000629530197 480296929 /nfs/dbraw/zinc/29/69/29/480296929.db2.gz YXJRWBCQXREAIA-HNNXBMFYSA-N 1 3 327.266 2.652 10 0 EFAEHO [NH3+]CCCOCCN[C@H](c1ccc(Br)cc1F)C1CC1 ZINC000629535385 480298064 /nfs/dbraw/zinc/29/80/64/480298064.db2.gz CFXZHGJHKSVFMD-HNNXBMFYSA-N 1 3 345.256 2.994 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@@H](CO)Cc2cc(F)c(F)c(F)c2)CC1(C)C ZINC000623508167 480319269 /nfs/dbraw/zinc/31/92/69/480319269.db2.gz LGUFFFFQQMNYJK-KBPBESRZSA-N 1 3 344.421 2.717 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@@H](CO)Cc2cc(F)c(F)c(F)c2)CC1(C)C ZINC000623508167 480319276 /nfs/dbraw/zinc/31/92/76/480319276.db2.gz LGUFFFFQQMNYJK-KBPBESRZSA-N 1 3 344.421 2.717 10 0 EFAEHO Fc1cccc(F)c1CCCN1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000629591970 480320906 /nfs/dbraw/zinc/32/09/06/480320906.db2.gz WTBLEBWQQRYSMP-INIZCTEOSA-N 1 3 338.442 2.988 10 0 EFAEHO CC(C)([NH2+]C[C@H]1CCCN(C(=O)CN)C1)c1ccc2ccccc2c1 ZINC000629664447 480350029 /nfs/dbraw/zinc/35/00/29/480350029.db2.gz HTQYEUQDGCDAIO-MRXNPFEDSA-N 1 3 339.483 2.862 10 0 EFAEHO CC(C)(C)c1nn(-c2ccccc2)cc1CNCCOCCC[NH3+] ZINC000629682258 480356178 /nfs/dbraw/zinc/35/61/78/480356178.db2.gz ZMFKXDOYYMYMTM-UHFFFAOYSA-N 1 3 330.476 2.625 10 0 EFAEHO C[C@](O)(C[C@H](O)CNCc1ccc(C[NH+]2CCCCC2)cc1)C1CC1 ZINC000634639802 480389147 /nfs/dbraw/zinc/38/91/47/480389147.db2.gz PHOXMWIGOMOKHX-SFTDATJTSA-N 1 3 346.515 2.674 10 0 EFAEHO C[NH+](C)C1(CNC(=O)NC[C@H]2CCN2C2CCCCC2)CCCC1 ZINC000623704963 480410887 /nfs/dbraw/zinc/41/08/87/480410887.db2.gz WQVWMJGRIXTWDR-QGZVFWFLSA-N 1 3 336.524 2.567 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2CO[C@@H](C3CC3)C2)CC1 ZINC000623752421 480436638 /nfs/dbraw/zinc/43/66/38/480436638.db2.gz GDEUMVIXXQOUHD-PZJWPPBQSA-N 1 3 343.515 2.876 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)[C@]23CCC[C@H]2C[NH2+]C3)CCN1Cc1ccccc1 ZINC000634767887 480510505 /nfs/dbraw/zinc/51/05/05/480510505.db2.gz ODPIDODMKBDMRU-WBKMXMRLSA-N 1 3 341.499 2.545 10 0 EFAEHO C[C@H]([NH2+]Cc1ccccc1CN1CCC(O)CC1)[C@@H]1CCCCO1 ZINC000623903099 480513003 /nfs/dbraw/zinc/51/30/03/480513003.db2.gz YTDMQLDMXMXEKN-JXFKEZNVSA-N 1 3 332.488 2.691 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccccc1CN1CCC(O)CC1)[C@H]1CCCCO1 ZINC000623903101 480513768 /nfs/dbraw/zinc/51/37/68/480513768.db2.gz YTDMQLDMXMXEKN-OXQOHEQNSA-N 1 3 332.488 2.691 10 0 EFAEHO Cc1ccc(Br)cc1[C@@H](C)NCCOCC[NH+](C)C ZINC000623967644 480546773 /nfs/dbraw/zinc/54/67/73/480546773.db2.gz FHAJHCMTJJGPQH-CYBMUJFWSA-N 1 3 329.282 2.986 10 0 EFAEHO Cc1ccccc1CN1CCCN(C(=O)c2ccc(C[NH3+])cc2)CC1 ZINC000621502486 480559808 /nfs/dbraw/zinc/55/98/08/480559808.db2.gz XCMLEDFMEOQVSU-UHFFFAOYSA-N 1 3 337.467 2.802 10 0 EFAEHO C[C@H](NC(C)(C)CNC(=O)N[C@@H]1CC[C@@H](C)[NH2+]C1)c1ccccc1 ZINC000626977860 480607186 /nfs/dbraw/zinc/60/71/86/480607186.db2.gz FIROCSXILTULGT-HLLBOEOZSA-N 1 3 332.492 2.556 10 0 EFAEHO C[C@@H]1CC[C@@H](NC(=O)N[C@@H](CN2CCCCC2)c2ccccc2)C[NH2+]1 ZINC000626978677 480607568 /nfs/dbraw/zinc/60/75/68/480607568.db2.gz HYSJIDJBARCFFB-QRQLOZEOSA-N 1 3 344.503 2.653 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)N[C@H]2CC[C@@H](C)[NH2+]C2)CC1 ZINC000626980660 480608431 /nfs/dbraw/zinc/60/84/31/480608431.db2.gz VDWYGNRUEQZEEJ-MDZRGWNJSA-N 1 3 344.503 2.652 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)NC[C@H]1CC[N@@H+]1C1CCCCC1 ZINC000624323933 480707851 /nfs/dbraw/zinc/70/78/51/480707851.db2.gz DBSDJHICVCIAHW-IAGOWNOFSA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000624323933 480707860 /nfs/dbraw/zinc/70/78/60/480707860.db2.gz DBSDJHICVCIAHW-IAGOWNOFSA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@@H](NC(=O)NC[C@H]2CCN2C2CCCCC2)C1 ZINC000624336285 480714240 /nfs/dbraw/zinc/71/42/40/480714240.db2.gz NERWTAMVEVCIND-NVXWUHKLSA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)NC[C@H]2CCN2C2CCCCC2)C1 ZINC000624336285 480714251 /nfs/dbraw/zinc/71/42/51/480714251.db2.gz NERWTAMVEVCIND-NVXWUHKLSA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@H](NC(=O)NC[C@@H]2CCN2C2CCCCC2)C1 ZINC000624336286 480714297 /nfs/dbraw/zinc/71/42/97/480714297.db2.gz NERWTAMVEVCIND-RDJZCZTQSA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@H](NC(=O)NC[C@@H]2CCN2C2CCCCC2)C1 ZINC000624336286 480714301 /nfs/dbraw/zinc/71/43/01/480714301.db2.gz NERWTAMVEVCIND-RDJZCZTQSA-N 1 3 336.524 2.565 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCC1)N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000624374751 480734851 /nfs/dbraw/zinc/73/48/51/480734851.db2.gz ZGTFTLUKMQZGDE-LPHOPBHVSA-N 1 3 348.535 2.710 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCC1)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000624374751 480734859 /nfs/dbraw/zinc/73/48/59/480734859.db2.gz ZGTFTLUKMQZGDE-LPHOPBHVSA-N 1 3 348.535 2.710 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)NCC[C@H]([NH3+])Cc2ccccc2)c1 ZINC000630580727 480791438 /nfs/dbraw/zinc/79/14/38/480791438.db2.gz FIOMBBFAKMQGMZ-SFHVURJKSA-N 1 3 340.471 2.830 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCN(C(=O)N[C@@H]2CCC[NH2+]CC2)CC1 ZINC000641078155 480797273 /nfs/dbraw/zinc/79/72/73/480797273.db2.gz YHNWGCVJNKVYOH-MRXNPFEDSA-N 1 3 338.540 2.671 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](c2ccsc2)N(CC)CC)CC[N@@H+]1C ZINC000630733718 480864270 /nfs/dbraw/zinc/86/42/70/480864270.db2.gz DPCQDYZKTGRLIC-BBWFWOEESA-N 1 3 337.533 2.978 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](c2ccsc2)N(CC)CC)CC[N@H+]1C ZINC000630733718 480864274 /nfs/dbraw/zinc/86/42/74/480864274.db2.gz DPCQDYZKTGRLIC-BBWFWOEESA-N 1 3 337.533 2.978 10 0 EFAEHO CCC1([NH+]2CCCC2)CCN(C(=O)N[C@H](C)C2=CCN(C)CC2)CC1 ZINC000633157904 480902451 /nfs/dbraw/zinc/90/24/51/480902451.db2.gz FCQZAIPFHGCJOM-QGZVFWFLSA-N 1 3 348.535 2.687 10 0 EFAEHO CC[C@H](C(=O)N1CCC(N[C@H]2C[NH2+]C[C@H](C)C2)CC1)c1ccccc1 ZINC000647550893 480997749 /nfs/dbraw/zinc/99/77/49/480997749.db2.gz NCQDBJBGKMGNME-AHRSYUTCSA-N 1 3 343.515 2.759 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1cccc2cc[nH]c21 ZINC000666791956 481103668 /nfs/dbraw/zinc/10/36/68/481103668.db2.gz HXNABFHBBXZECO-AWEZNQCLSA-N 1 3 331.464 2.561 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1cccc2cc[nH]c21 ZINC000666791956 481103672 /nfs/dbraw/zinc/10/36/72/481103672.db2.gz HXNABFHBBXZECO-AWEZNQCLSA-N 1 3 331.464 2.561 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N[C@@H](C)[C@@H](C)c1ccccc1 ZINC000664298743 481160248 /nfs/dbraw/zinc/16/02/48/481160248.db2.gz KHUYEGCAWSIHRM-KSZLIROESA-N 1 3 348.535 2.750 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N[C@@H](C)[C@@H](C)c1ccccc1 ZINC000664298743 481160253 /nfs/dbraw/zinc/16/02/53/481160253.db2.gz KHUYEGCAWSIHRM-KSZLIROESA-N 1 3 348.535 2.750 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1cccc2cccnc21 ZINC000664315655 481172258 /nfs/dbraw/zinc/17/22/58/481172258.db2.gz WAMVOIVXNBHLRZ-HNNXBMFYSA-N 1 3 343.475 2.628 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1cccc2cccnc21 ZINC000664315655 481172267 /nfs/dbraw/zinc/17/22/67/481172267.db2.gz WAMVOIVXNBHLRZ-HNNXBMFYSA-N 1 3 343.475 2.628 10 0 EFAEHO CCN(C(=O)NC1CC[NH+](C2CCCC2)CC1)[C@@H]1CCN(CC)C1 ZINC000664321642 481175206 /nfs/dbraw/zinc/17/52/06/481175206.db2.gz VSDKBKMUAPPXSV-GOSISDBHSA-N 1 3 336.524 2.519 10 0 EFAEHO CCCN(CCC[NH+](C)C)C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659045829 481188219 /nfs/dbraw/zinc/18/82/19/481188219.db2.gz ZJSOPJOHQAVIGB-SFHVURJKSA-N 1 3 348.491 2.543 10 0 EFAEHO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCN(Cc3ccnn3-c3ccccc3)C2)C1 ZINC000650707721 481279441 /nfs/dbraw/zinc/27/94/41/481279441.db2.gz LVBMIQDRCWWKQY-HLIPFELVSA-N 1 3 340.471 2.591 10 0 EFAEHO COc1cc(Br)c(CNCCC2(C[NH3+])CC2)cc1OC ZINC000650712287 481283203 /nfs/dbraw/zinc/28/32/03/481283203.db2.gz ZGUMARLCGQTXDT-UHFFFAOYSA-N 1 3 343.265 2.685 10 0 EFAEHO Cn1c2ccc(C(F)(F)F)cc2nc1CNCCC1(C[NH3+])CC1 ZINC000650712895 481283249 /nfs/dbraw/zinc/28/32/49/481283249.db2.gz ZXPDJMOOPSUOKI-UHFFFAOYSA-N 1 3 326.366 2.811 10 0 EFAEHO c1ccc2c(c1)C[C@H](N[C@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CN2 ZINC000650747720 481311191 /nfs/dbraw/zinc/31/11/91/481311191.db2.gz GJGALXWARMBCLQ-NBHGPNQESA-N 1 3 335.451 2.869 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@H](C)c1ccc2c(c1)OCC(=O)N2 ZINC000650755234 481316836 /nfs/dbraw/zinc/31/68/36/481316836.db2.gz AHRPDVRPJPWDDY-CYBMUJFWSA-N 1 3 325.412 2.588 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@H](C)CC(=O)Nc1ccccc1OC ZINC000650759068 481322208 /nfs/dbraw/zinc/32/22/08/481322208.db2.gz CKTHYWQXVZXSHO-OAHLLOKOSA-N 1 3 341.455 2.922 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@@H](C)c1ccc(NS(C)(=O)=O)cc1 ZINC000650758309 481322266 /nfs/dbraw/zinc/32/22/66/481322266.db2.gz NAIHLEOPFHIIBZ-AWEZNQCLSA-N 1 3 347.484 2.628 10 0 EFAEHO C[N@H+](CCCNC(=O)C[C@@H]1NCc2ccccc21)Cc1ccccc1 ZINC000659283893 481334126 /nfs/dbraw/zinc/33/41/26/481334126.db2.gz CXQYHFQYOUTVAR-FQEVSTJZSA-N 1 3 337.467 2.859 10 0 EFAEHO C[N@@H+](CCCNC(=O)C[C@@H]1NCc2ccccc21)Cc1ccccc1 ZINC000659283893 481334132 /nfs/dbraw/zinc/33/41/32/481334132.db2.gz CXQYHFQYOUTVAR-FQEVSTJZSA-N 1 3 337.467 2.859 10 0 EFAEHO C[C@H]([NH3+])c1ccc(NC(=O)C(C[C@H]2COCCO2)C(F)(F)F)cc1 ZINC000659295292 481343647 /nfs/dbraw/zinc/34/36/47/481343647.db2.gz WGWCDRVGQOJQAK-LEWSCRJBSA-N 1 3 346.349 2.629 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCN(C(=O)NCC2CC[NH2+]CC2)CC1 ZINC000637201677 481379454 /nfs/dbraw/zinc/37/94/54/481379454.db2.gz UZGBGZVTEKNCLO-UHFFFAOYSA-N 1 3 338.540 2.528 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)NCC[C@@H]([NH3+])C(C)C)N2CCCC2)cc1 ZINC000659444728 481439805 /nfs/dbraw/zinc/43/98/05/481439805.db2.gz IQACBYBYCSBIAO-RTBURBONSA-N 1 3 346.519 2.805 10 0 EFAEHO CCn1cnnc1CCNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000648400000 481518086 /nfs/dbraw/zinc/51/80/86/481518086.db2.gz UOJISGASMBIPBF-KRWDZBQOSA-N 1 3 341.503 2.526 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@H]2CCCc3ccccc3C2)CC1 ZINC000648419136 481531569 /nfs/dbraw/zinc/53/15/69/481531569.db2.gz UXEVWIOUUGTDLM-NRFANRHFSA-N 1 3 329.532 2.941 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)NC[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000654066665 481629261 /nfs/dbraw/zinc/62/92/61/481629261.db2.gz ASLMSSIJDSCBAM-OKILXGFUSA-N 1 3 329.444 2.564 10 0 EFAEHO COc1ccc2cc(CN(C)C[C@@H]3CCC4(C[NH2+]C4)O3)ccc2c1 ZINC000662248939 481664636 /nfs/dbraw/zinc/66/46/36/481664636.db2.gz MATAAYNGLAWZLV-IBGZPJMESA-N 1 3 326.440 2.801 10 0 EFAEHO COc1ccc([C@@H](CO)N(C)Cc2cccc3c2CC[NH2+]C3)cc1 ZINC000662256422 481670068 /nfs/dbraw/zinc/67/00/68/481670068.db2.gz VZCTXYMYBQNERQ-HXUWFJFHSA-N 1 3 326.440 2.506 10 0 EFAEHO CSc1cccc(NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000665126490 481672937 /nfs/dbraw/zinc/67/29/37/481672937.db2.gz BTFRXUGEFAPQTC-AWEZNQCLSA-N 1 3 338.521 2.802 10 0 EFAEHO CSc1cccc(NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000665126490 481672929 /nfs/dbraw/zinc/67/29/29/481672929.db2.gz BTFRXUGEFAPQTC-AWEZNQCLSA-N 1 3 338.521 2.802 10 0 EFAEHO C[C@H]([NH2+]C[C@H]1CCC2(CNC2)O1)c1ccc(OC(F)(F)F)cc1 ZINC000662279674 481686477 /nfs/dbraw/zinc/68/64/77/481686477.db2.gz AUXKLCFJBPUMQN-SMDDNHRTSA-N 1 3 330.350 2.757 10 0 EFAEHO c1cc(C[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)n(-c2ccccn2)n1 ZINC000647207798 481702331 /nfs/dbraw/zinc/70/23/31/481702331.db2.gz LRFAWWVKPCLDHW-IBGZPJMESA-N 1 3 347.466 2.879 10 0 EFAEHO CC(C)N(C(=O)CN1CCC[C@H](C2CC[NH2+]CC2)C1)C1CCCC1 ZINC000662296776 481703270 /nfs/dbraw/zinc/70/32/70/481703270.db2.gz NDRUFZRMXSTEHT-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](C(=O)NC1CCC(C)CC1)N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662298988 481704782 /nfs/dbraw/zinc/70/47/82/481704782.db2.gz YZJFQGCWDZIRRA-TXLGJMDYSA-N 1 3 335.536 2.781 10 0 EFAEHO C[C@@H](C(=O)NC1CCC(C)CC1)N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662298985 481705995 /nfs/dbraw/zinc/70/59/95/481705995.db2.gz YZJFQGCWDZIRRA-DPCKTDSQSA-N 1 3 335.536 2.781 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]C[C@H]2CN(Cc3ccccc3)CC23CCOCC3)CO1 ZINC000647212925 481706754 /nfs/dbraw/zinc/70/67/54/481706754.db2.gz DMGOZANAQRHKNA-HOJAQTOUSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)CO1 ZINC000647212925 481706760 /nfs/dbraw/zinc/70/67/60/481706760.db2.gz DMGOZANAQRHKNA-HOJAQTOUSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@H]2C[N@@H+](Cc3ccccc3)CC23CCOCC3)CO1 ZINC000647212925 481706769 /nfs/dbraw/zinc/70/67/69/481706769.db2.gz DMGOZANAQRHKNA-HOJAQTOUSA-N 1 3 344.499 2.682 10 0 EFAEHO CCN(C(=O)NCCC[N@H+](CC)C1CCCCC1)[C@@H]1CCN(C)C1 ZINC000665219049 481728137 /nfs/dbraw/zinc/72/81/37/481728137.db2.gz JTTULWPTWPURCD-GOSISDBHSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN(C(=O)NCCC[N@@H+](CC)C1CCCCC1)[C@@H]1CCN(C)C1 ZINC000665219049 481728143 /nfs/dbraw/zinc/72/81/43/481728143.db2.gz JTTULWPTWPURCD-GOSISDBHSA-N 1 3 338.540 2.767 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662337288 481735378 /nfs/dbraw/zinc/73/53/78/481735378.db2.gz KZPYRTVKWCZZIY-DLBZAZTESA-N 1 3 333.524 2.681 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662337288 481735385 /nfs/dbraw/zinc/73/53/85/481735385.db2.gz KZPYRTVKWCZZIY-DLBZAZTESA-N 1 3 333.524 2.681 10 0 EFAEHO C[C@@H]1CCCC[C@@H]1C[N@@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662338921 481736822 /nfs/dbraw/zinc/73/68/22/481736822.db2.gz WXCAOPDHIOQWGJ-KURKYZTESA-N 1 3 345.535 2.825 10 0 EFAEHO C[C@@H]1CCCC[C@@H]1C[N@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662338921 481736829 /nfs/dbraw/zinc/73/68/29/481736829.db2.gz WXCAOPDHIOQWGJ-KURKYZTESA-N 1 3 345.535 2.825 10 0 EFAEHO c1ccc2c(CCN[C@@H]3CCOC[C@H]3[C@@H]3CCC[NH2+]3)ccnc2c1 ZINC000665239093 481738077 /nfs/dbraw/zinc/73/80/77/481738077.db2.gz LXJMEURHKMSGLY-YSIASYRMSA-N 1 3 325.456 2.524 10 0 EFAEHO CC(C)C[C@H]([NH2+][C@H]1CCN(C2CCN(C)CC2)C1)c1ccncc1 ZINC000647288683 481747709 /nfs/dbraw/zinc/74/77/09/481747709.db2.gz KWRAZDWWYYSCNX-ICSRJNTNSA-N 1 3 330.520 2.927 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCC[C@H]1Cc1cnn(C)c1 ZINC000665272252 481762008 /nfs/dbraw/zinc/76/20/08/481762008.db2.gz AQMNLANPARVTMX-URLQWDBASA-N 1 3 327.476 2.644 10 0 EFAEHO c1ccc2c(CCN[C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)nsc2c1 ZINC000665276672 481764088 /nfs/dbraw/zinc/76/40/88/481764088.db2.gz JZPSYDIQJGCVCA-OWCLPIDISA-N 1 3 331.485 2.586 10 0 EFAEHO CCOc1ccccc1[C@H](C)NC1CCN(C(=O)CCC[NH2+]C)CC1 ZINC000665285368 481769594 /nfs/dbraw/zinc/76/95/94/481769594.db2.gz LDJMTQAKWXIXGO-INIZCTEOSA-N 1 3 347.503 2.727 10 0 EFAEHO CO[C@@H](CN1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1)C1CCCCC1 ZINC000660127512 481773914 /nfs/dbraw/zinc/77/39/14/481773914.db2.gz AZAZIKXXXRMTNH-JKWVGCSGSA-N 1 3 349.563 2.825 10 0 EFAEHO CO[C@@H](CN1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1)C1CCCCC1 ZINC000660127512 481773924 /nfs/dbraw/zinc/77/39/24/481773924.db2.gz AZAZIKXXXRMTNH-JKWVGCSGSA-N 1 3 349.563 2.825 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)c1ccc2c(c1)[C@H](C[NH3+])CCC2 ZINC000662387943 481778619 /nfs/dbraw/zinc/77/86/19/481778619.db2.gz NJBSESSTOXTAQX-QAPCUYQASA-N 1 3 329.488 2.669 10 0 EFAEHO CO[C@H](C[N@H+](C)CCC1CCN(c2ccncc2)CC1)[C@H]1CCOC1 ZINC000660165011 481796768 /nfs/dbraw/zinc/79/67/68/481796768.db2.gz BFNOKJYADFQKEG-AZUAARDMSA-N 1 3 347.503 2.671 10 0 EFAEHO CO[C@H](C[N@@H+](C)CCC1CCN(c2ccncc2)CC1)[C@H]1CCOC1 ZINC000660165011 481796772 /nfs/dbraw/zinc/79/67/72/481796772.db2.gz BFNOKJYADFQKEG-AZUAARDMSA-N 1 3 347.503 2.671 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000665365819 481822705 /nfs/dbraw/zinc/82/27/05/481822705.db2.gz LSEDPWGBKGKZHI-IAGOWNOFSA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000665366427 481825583 /nfs/dbraw/zinc/82/55/83/481825583.db2.gz YZEKGUCSZRTHCM-IAGOWNOFSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN(C(=O)C[C@H]1CC[NH2+]C1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000662501829 481844680 /nfs/dbraw/zinc/84/46/80/481844680.db2.gz DTCDMARUVMIEEC-YQVWRLOYSA-N 1 3 329.488 2.670 10 0 EFAEHO O=C(C[C@@H]1NCc2ccccc21)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000662505930 481848608 /nfs/dbraw/zinc/84/86/08/481848608.db2.gz VSQHDMSTBCXMKY-VDGAXYAQSA-N 1 3 339.483 2.696 10 0 EFAEHO O=C(C[C@@H]1NCc2ccccc21)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000662505930 481848614 /nfs/dbraw/zinc/84/86/14/481848614.db2.gz VSQHDMSTBCXMKY-VDGAXYAQSA-N 1 3 339.483 2.696 10 0 EFAEHO CO[C@H](C[NH+]1CCC(C)(CN2CCN(C)CC2)CC1)C1CCCC1 ZINC000660275641 481869570 /nfs/dbraw/zinc/86/95/70/481869570.db2.gz CZOARPAJBDWVMS-LJQANCHMSA-N 1 3 337.552 2.541 10 0 EFAEHO CO[C@@H](C[NH+]1CCC(C)(CN2CCN(C)CC2)CC1)C1CCCC1 ZINC000660275640 481870181 /nfs/dbraw/zinc/87/01/81/481870181.db2.gz CZOARPAJBDWVMS-IBGZPJMESA-N 1 3 337.552 2.541 10 0 EFAEHO O=C(NC[C@H](c1ccccc1)N1CCCC1)C1([NH2+]C2CC2)CCC1 ZINC000662666403 481923521 /nfs/dbraw/zinc/92/35/21/481923521.db2.gz RTOANQIONXPCKS-GOSISDBHSA-N 1 3 327.472 2.614 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)C1(NC2CC2)CCC1)Cc1ccccc1 ZINC000662678531 481929784 /nfs/dbraw/zinc/92/97/84/481929784.db2.gz GVVDSWPMESDLIJ-IBGZPJMESA-N 1 3 343.515 2.730 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)N1[C@H](C)CC[C@@H]1C ZINC000649101190 481929913 /nfs/dbraw/zinc/92/99/13/481929913.db2.gz PLTOHKZPNHHOGH-NDLGOLERSA-N 1 3 343.515 2.709 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)N1[C@H](C)CC[C@@H]1C ZINC000649101190 481929921 /nfs/dbraw/zinc/92/99/21/481929921.db2.gz PLTOHKZPNHHOGH-NDLGOLERSA-N 1 3 343.515 2.709 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)N1[C@H](C)CC[C@H]1C ZINC000649101189 481929966 /nfs/dbraw/zinc/92/99/66/481929966.db2.gz PLTOHKZPNHHOGH-GNVJSZRZSA-N 1 3 343.515 2.709 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)N1[C@H](C)CC[C@H]1C ZINC000649101189 481929976 /nfs/dbraw/zinc/92/99/76/481929976.db2.gz PLTOHKZPNHHOGH-GNVJSZRZSA-N 1 3 343.515 2.709 10 0 EFAEHO C[NH+](C)CCCC(C)(C)NC(=O)CCN1CCc2ccccc2C1 ZINC000668008706 481931168 /nfs/dbraw/zinc/93/11/68/481931168.db2.gz FOOUSMCPORBGKX-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO C[C@H](C(=O)Nc1ccc([C@@H]2CNCCO2)cc1)[C@H]([NH3+])c1ccccc1 ZINC000662685901 481933849 /nfs/dbraw/zinc/93/38/49/481933849.db2.gz IFMCJIBNPIWYPQ-JVPBZIDWSA-N 1 3 339.439 2.622 10 0 EFAEHO CC1CC[NH+](CCCCNC(=O)NC[C@@H]2CCN2C(C)(C)C)CC1 ZINC000660400416 481935987 /nfs/dbraw/zinc/93/59/87/481935987.db2.gz KVCFGUREBVAHOJ-KRWDZBQOSA-N 1 3 338.540 2.671 10 0 EFAEHO CC1CC[NH+](CCCCNC(=O)NC[C@H]2CCN2C(C)(C)C)CC1 ZINC000660400422 481936150 /nfs/dbraw/zinc/93/61/50/481936150.db2.gz KVCFGUREBVAHOJ-QGZVFWFLSA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@H]1CCN1C(C)(C)C ZINC000660403088 481937826 /nfs/dbraw/zinc/93/78/26/481937826.db2.gz NMJJPHHQRURNIL-IAGOWNOFSA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@H]1CCN1C(C)(C)C ZINC000660403088 481937831 /nfs/dbraw/zinc/93/78/31/481937831.db2.gz NMJJPHHQRURNIL-IAGOWNOFSA-N 1 3 338.540 2.813 10 0 EFAEHO CC(C)[N@H+](C)Cc1cccc(CNC(=O)C2(NC3CC3)CCC2)c1 ZINC000662696300 481938843 /nfs/dbraw/zinc/93/88/43/481938843.db2.gz WQTHPMGBIUTHPI-UHFFFAOYSA-N 1 3 329.488 2.818 10 0 EFAEHO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)C2(NC3CC3)CCC2)c1 ZINC000662696300 481938853 /nfs/dbraw/zinc/93/88/53/481938853.db2.gz WQTHPMGBIUTHPI-UHFFFAOYSA-N 1 3 329.488 2.818 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)C2(NC3CC3)CCC2)C1 ZINC000662698999 481940532 /nfs/dbraw/zinc/94/05/32/481940532.db2.gz UZYOOJBRMGGYHD-IAGOWNOFSA-N 1 3 333.520 2.774 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)C2(NC3CC3)CCC2)C1 ZINC000662698999 481940534 /nfs/dbraw/zinc/94/05/34/481940534.db2.gz UZYOOJBRMGGYHD-IAGOWNOFSA-N 1 3 333.520 2.774 10 0 EFAEHO CC[C@H](C)[C@@H](N)C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662710158 481943502 /nfs/dbraw/zinc/94/35/02/481943502.db2.gz DTZMFUHXANWWBN-YTQUADARSA-N 1 3 343.515 2.778 10 0 EFAEHO CC[C@H](C)[C@@H](N)C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662710158 481943507 /nfs/dbraw/zinc/94/35/07/481943507.db2.gz DTZMFUHXANWWBN-YTQUADARSA-N 1 3 343.515 2.778 10 0 EFAEHO CCC[C@](C)(N)C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662713286 481945122 /nfs/dbraw/zinc/94/51/22/481945122.db2.gz YRFDJNUYGIOWIB-ICSRJNTNSA-N 1 3 343.515 2.922 10 0 EFAEHO CCC[C@](C)(N)C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662713286 481945131 /nfs/dbraw/zinc/94/51/31/481945131.db2.gz YRFDJNUYGIOWIB-ICSRJNTNSA-N 1 3 343.515 2.922 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)C2(NC3CC3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000662717970 481946474 /nfs/dbraw/zinc/94/64/74/481946474.db2.gz FYPFFYIYWDWVPZ-QFBILLFUSA-N 1 3 341.499 2.830 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)C2(NC3CC3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000662717970 481946483 /nfs/dbraw/zinc/94/64/83/481946483.db2.gz FYPFFYIYWDWVPZ-QFBILLFUSA-N 1 3 341.499 2.830 10 0 EFAEHO C[NH+](C)CCn1ccc2ccc(NC(=O)C3(NC4CC4)CCC3)cc21 ZINC000662741847 481956745 /nfs/dbraw/zinc/95/67/45/481956745.db2.gz PNVZAZONJOXPRK-UHFFFAOYSA-N 1 3 340.471 2.816 10 0 EFAEHO [NH3+]Cc1cc(NC(=O)C2(NC3CC3)CCC2)cc(C(F)(F)F)c1 ZINC000662775970 481966132 /nfs/dbraw/zinc/96/61/32/481966132.db2.gz ZXSYJDCTGSEVEX-UHFFFAOYSA-N 1 3 327.350 2.777 10 0 EFAEHO C[C@H](NC(=O)C1(NC2CC2)CCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000662805333 481978736 /nfs/dbraw/zinc/97/87/36/481978736.db2.gz WOPDBSQXEYKRQW-FUHWJXTLSA-N 1 3 341.499 2.688 10 0 EFAEHO C[C@H](NC(=O)C1(NC2CC2)CCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000662805333 481978738 /nfs/dbraw/zinc/97/87/38/481978738.db2.gz WOPDBSQXEYKRQW-FUHWJXTLSA-N 1 3 341.499 2.688 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC[C@@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000651865282 481980915 /nfs/dbraw/zinc/98/09/15/481980915.db2.gz SJRYSUWQCAEABL-MRXNPFEDSA-N 1 3 340.533 2.761 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC[C@@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000651865282 481980918 /nfs/dbraw/zinc/98/09/18/481980918.db2.gz SJRYSUWQCAEABL-MRXNPFEDSA-N 1 3 340.533 2.761 10 0 EFAEHO OC1(C2CCN(Cc3ccc(OCC[NH+]4CCCC4)cc3)CC2)CC1 ZINC000651878514 481986844 /nfs/dbraw/zinc/98/68/44/481986844.db2.gz RFUDAEYLDAYKPJ-UHFFFAOYSA-N 1 3 344.499 2.898 10 0 EFAEHO CCCN(CCN1CCCCCC1)C(=O)NC[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000654663450 481988102 /nfs/dbraw/zinc/98/81/02/481988102.db2.gz OYADZNLYIWNSFH-HDICACEKSA-N 1 3 338.540 2.624 10 0 EFAEHO C[C@@H](C(=O)N[C@@H]1C[NH2+]CC[C@@H]1c1ccccc1)[C@@H](N)c1ccccc1 ZINC000662865081 481997889 /nfs/dbraw/zinc/99/78/89/481997889.db2.gz LVKDLQDAAHGAKQ-HUYLIWGRSA-N 1 3 337.467 2.584 10 0 EFAEHO CN(CCc1ccccc1)[C@H]1CCN(C(=O)[C@H]2[NH2+]CCCC2(C)C)C1 ZINC000662873322 482000064 /nfs/dbraw/zinc/00/00/64/482000064.db2.gz WGBZXTRPUBUBJR-RBUKOAKNSA-N 1 3 343.515 2.540 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)Cc1c(C2CCC2)cnn1C ZINC000668159897 482006375 /nfs/dbraw/zinc/00/63/75/482006375.db2.gz KSVBRBGMQJEUFE-GOSISDBHSA-N 1 3 347.551 2.536 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)Cc1c(C2CCC2)cnn1C ZINC000668159897 482006378 /nfs/dbraw/zinc/00/63/78/482006378.db2.gz KSVBRBGMQJEUFE-GOSISDBHSA-N 1 3 347.551 2.536 10 0 EFAEHO CCN(C(=O)[C@@H]1[NH2+]CC1(C)C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000649306013 482021210 /nfs/dbraw/zinc/02/12/10/482021210.db2.gz UBYRZFROXVSJLS-NJAFHUGGSA-N 1 3 329.488 2.668 10 0 EFAEHO CN(c1ccccc1C[NH2+]CCC1(CO)CCC1)C1CCN(C)CC1 ZINC000652036596 482044859 /nfs/dbraw/zinc/04/48/59/482044859.db2.gz OQNFMTYFVJLYPY-UHFFFAOYSA-N 1 3 345.531 2.859 10 0 EFAEHO O=C(N[C@@H]1CC[NH2+]C12CCCC2)C1CCN(Cc2ccccc2)CC1 ZINC000649372509 482046829 /nfs/dbraw/zinc/04/68/29/482046829.db2.gz ATHCFYDXMJXTPY-LJQANCHMSA-N 1 3 341.499 2.690 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)NCCC1(C[NH3+])CC1)c1ccsc1 ZINC000652127255 482087235 /nfs/dbraw/zinc/08/72/35/482087235.db2.gz JUDYNDOYHVRFCD-HNNXBMFYSA-N 1 3 338.521 2.559 10 0 EFAEHO C[NH+](C)CC[C@H](NC(=O)NC[C@@H]1CCN1C(C)(C)C)C(C)(C)C ZINC000660677734 482090531 /nfs/dbraw/zinc/09/05/31/482090531.db2.gz OTKYYADWIJNYNZ-GJZGRUSLSA-N 1 3 326.529 2.525 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccc2[nH]ccc2c1 ZINC000665922246 482112084 /nfs/dbraw/zinc/11/20/84/482112084.db2.gz OACHTGHWVHBTAY-AWEZNQCLSA-N 1 3 331.464 2.561 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccc2[nH]ccc2c1 ZINC000665922246 482112086 /nfs/dbraw/zinc/11/20/86/482112086.db2.gz OACHTGHWVHBTAY-AWEZNQCLSA-N 1 3 331.464 2.561 10 0 EFAEHO FC(F)(F)c1ncc(CNC2CCN(c3cc[nH+]cc3)CC2)cn1 ZINC000668450304 482129619 /nfs/dbraw/zinc/12/96/19/482129619.db2.gz UZIAOHZKNQFMLS-UHFFFAOYSA-N 1 3 337.349 2.649 10 0 EFAEHO C[C@@H](Cc1ccc(O)cc1)[NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000668488573 482141706 /nfs/dbraw/zinc/14/17/06/482141706.db2.gz BUWPGKURKPCMKE-KKSFZXQISA-N 1 3 340.467 2.680 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2C[C@H]3COC[C@@]3(C)C2)CC1 ZINC000668595811 482181861 /nfs/dbraw/zinc/18/18/61/482181861.db2.gz AMSDXNIVCWSQHH-PZJWPPBQSA-N 1 3 343.515 2.687 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2C[C@H]3COC[C@@]3(C)C2)CC1 ZINC000668595811 482181865 /nfs/dbraw/zinc/18/18/65/482181865.db2.gz AMSDXNIVCWSQHH-PZJWPPBQSA-N 1 3 343.515 2.687 10 0 EFAEHO CN(c1ccccc1C[N@@H+]1C[C@H]2COC[C@@]2(C)C1)C1CCN(C)CC1 ZINC000668596001 482182247 /nfs/dbraw/zinc/18/22/47/482182247.db2.gz CUNLHBCSRTVGOG-GHTZIAJQSA-N 1 3 343.515 2.685 10 0 EFAEHO CN(c1ccccc1C[N@H+]1C[C@H]2COC[C@@]2(C)C1)C1CCN(C)CC1 ZINC000668596001 482182254 /nfs/dbraw/zinc/18/22/54/482182254.db2.gz CUNLHBCSRTVGOG-GHTZIAJQSA-N 1 3 343.515 2.685 10 0 EFAEHO C[C@@]1(c2cccc(F)c2)CC[N@H+](C[C@H](O)[C@@H](N)Cc2ccccc2)C1 ZINC000652350411 482184175 /nfs/dbraw/zinc/18/41/75/482184175.db2.gz XJSIROLDEMEKIG-PCCBWWKXSA-N 1 3 342.458 2.720 10 0 EFAEHO C[C@@]1(c2cccc(F)c2)CC[N@@H+](C[C@H](O)[C@@H](N)Cc2ccccc2)C1 ZINC000652350411 482184179 /nfs/dbraw/zinc/18/41/79/482184179.db2.gz XJSIROLDEMEKIG-PCCBWWKXSA-N 1 3 342.458 2.720 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@H](C)CC(F)F)CC2)CC1 ZINC000655157129 482186125 /nfs/dbraw/zinc/18/61/25/482186125.db2.gz WMXDBCCCHPUBHQ-CQSZACIVSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(=O)c1ccccc1OCCN1CCCC[C@@H]1[C@H]1C[C@@H]([NH3+])CCO1 ZINC000652360368 482194023 /nfs/dbraw/zinc/19/40/23/482194023.db2.gz GEJHFIJKXKLRNZ-ILZDJORESA-N 1 3 346.471 2.629 10 0 EFAEHO CN(c1ccccc1C[N@@H+]1CC[C@@H]2COC[C@@H]2C1)C1CCN(C)CC1 ZINC000668706627 482221871 /nfs/dbraw/zinc/22/18/71/482221871.db2.gz UEBWBSXRQUPXGG-MOPGFXCFSA-N 1 3 343.515 2.685 10 0 EFAEHO CN(c1ccccc1C[N@H+]1CC[C@@H]2COC[C@@H]2C1)C1CCN(C)CC1 ZINC000668706627 482221879 /nfs/dbraw/zinc/22/18/79/482221879.db2.gz UEBWBSXRQUPXGG-MOPGFXCFSA-N 1 3 343.515 2.685 10 0 EFAEHO Clc1cccc([C@@H]2C[NH2+]CCN2Cc2nc3c(s2)CNCC3)c1 ZINC000663494826 482265394 /nfs/dbraw/zinc/26/53/94/482265394.db2.gz SJAGYNBJPOIURS-HNNXBMFYSA-N 1 3 348.903 2.589 10 0 EFAEHO CCN(C(=O)NCCC[N@H+](C)Cc1ccccc1)[C@@H]1CCN(CC)C1 ZINC000663506245 482269027 /nfs/dbraw/zinc/26/90/27/482269027.db2.gz KTQMNMHBLQKJHN-LJQANCHMSA-N 1 3 346.519 2.634 10 0 EFAEHO CCN(C(=O)NCCC[N@@H+](C)Cc1ccccc1)[C@@H]1CCN(CC)C1 ZINC000663506245 482269031 /nfs/dbraw/zinc/26/90/31/482269031.db2.gz KTQMNMHBLQKJHN-LJQANCHMSA-N 1 3 346.519 2.634 10 0 EFAEHO O=C(NCc1ccccc1CN1CCCCC1)N[C@H]1CCC[NH2+]CC1 ZINC000668860299 482298807 /nfs/dbraw/zinc/29/88/07/482298807.db2.gz OJFIVVSRLJWVER-IBGZPJMESA-N 1 3 344.503 2.614 10 0 EFAEHO O=C(C[NH2+][C@@H]1CCCC12CCCCC2)NC1CCN(C2CC2)CC1 ZINC000661130132 482338105 /nfs/dbraw/zinc/33/81/05/482338105.db2.gz SOVKSSULBKIPED-GOSISDBHSA-N 1 3 333.520 2.822 10 0 EFAEHO CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)N[C@@H](C)CN1CCCCC1)CC2 ZINC000246141998 519699140 /nfs/dbraw/zinc/69/91/40/519699140.db2.gz JOTCPPJJCKEDGJ-KSZLIROESA-N 1 3 336.524 2.518 10 0 EFAEHO CC(C)[N@H+]1[C@@H]2CC[C@H]1CN(C(=O)N[C@@H](C)CN1CCCCC1)CC2 ZINC000246141998 519699144 /nfs/dbraw/zinc/69/91/44/519699144.db2.gz JOTCPPJJCKEDGJ-KSZLIROESA-N 1 3 336.524 2.518 10 0 EFAEHO CC(C)COC[C@@H](O)CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245722867 519756913 /nfs/dbraw/zinc/75/69/13/519756913.db2.gz OYMZLAGZXWFHON-BURNTYAHSA-N 1 3 346.515 2.805 10 0 EFAEHO CC(C)COC[C@@H](O)CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245722867 519756914 /nfs/dbraw/zinc/75/69/14/519756914.db2.gz OYMZLAGZXWFHON-BURNTYAHSA-N 1 3 346.515 2.805 10 0 EFAEHO CC(C)COC[C@H](O)CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245722872 519758800 /nfs/dbraw/zinc/75/88/00/519758800.db2.gz OYMZLAGZXWFHON-MXEMCNAFSA-N 1 3 346.515 2.805 10 0 EFAEHO CC(C)COC[C@H](O)CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245722872 519758801 /nfs/dbraw/zinc/75/88/01/519758801.db2.gz OYMZLAGZXWFHON-MXEMCNAFSA-N 1 3 346.515 2.805 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@@H]1CCC[N@H+](CC[C@H]2CCCN2C)C1 ZINC000245558660 520416838 /nfs/dbraw/zinc/41/68/38/520416838.db2.gz BERXTIBOAILPHK-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@@H]1CCC[N@@H+](CC[C@H]2CCCN2C)C1 ZINC000245558660 520416849 /nfs/dbraw/zinc/41/68/49/520416849.db2.gz BERXTIBOAILPHK-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(CC[C@H]2CCC[N@@H+]2C)C1 ZINC000245558660 520416855 /nfs/dbraw/zinc/41/68/55/520416855.db2.gz BERXTIBOAILPHK-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(CC[C@H]2CCC[N@H+]2C)C1 ZINC000245558660 520416863 /nfs/dbraw/zinc/41/68/63/520416863.db2.gz BERXTIBOAILPHK-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(C)C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000245428507 521652235 /nfs/dbraw/zinc/65/22/35/521652235.db2.gz XISJXBILCNWBPS-HKUYNNGSSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(C)C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000245428507 521652237 /nfs/dbraw/zinc/65/22/37/521652237.db2.gz XISJXBILCNWBPS-HKUYNNGSSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[N@@H+]1CC[C@@H](Nc2ccc(OC3CCN(C)CC3)nc2)[C@@H](C)C1 ZINC000245554114 521715629 /nfs/dbraw/zinc/71/56/29/521715629.db2.gz ADNPNMKNJNLMFU-MAUKXSAKSA-N 1 3 332.492 2.697 10 0 EFAEHO CC[N@H+]1CC[C@@H](Nc2ccc(OC3CCN(C)CC3)nc2)[C@@H](C)C1 ZINC000245554114 521715630 /nfs/dbraw/zinc/71/56/30/521715630.db2.gz ADNPNMKNJNLMFU-MAUKXSAKSA-N 1 3 332.492 2.697 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)c1 ZINC000156311276 521913587 /nfs/dbraw/zinc/91/35/87/521913587.db2.gz UPHHIKOWXXAAHK-LJQANCHMSA-N 1 3 329.488 2.839 10 0 EFAEHO CN1CC[C@@H](NC(=O)N[C@H]2CCC[C@@H]([NH+](C)C)C2)[C@@H]1c1ccccc1 ZINC000245612826 522046868 /nfs/dbraw/zinc/04/68/68/522046868.db2.gz CCCZYTLDYZVYFO-MANSERQUSA-N 1 3 344.503 2.604 10 0 EFAEHO COc1cc(CN2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1O ZINC000180071080 522367941 /nfs/dbraw/zinc/36/79/41/522367941.db2.gz IIBUJHCQPFBOHB-IYBDPMFKSA-N 1 3 348.487 2.722 10 0 EFAEHO COc1cc(CN2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1O ZINC000180071080 522367952 /nfs/dbraw/zinc/36/79/52/522367952.db2.gz IIBUJHCQPFBOHB-IYBDPMFKSA-N 1 3 348.487 2.722 10 0 EFAEHO Cc1ccc(CCN2CCN(C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)cc1 ZINC000119634719 524321714 /nfs/dbraw/zinc/32/17/14/524321714.db2.gz BUQGVUHTUBKREH-WCRBZPEASA-N 1 3 327.516 2.780 10 0 EFAEHO Cc1ccc(CCN2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)cc1 ZINC000119634719 524321720 /nfs/dbraw/zinc/32/17/20/524321720.db2.gz BUQGVUHTUBKREH-WCRBZPEASA-N 1 3 327.516 2.780 10 0 EFAEHO C[C@H](CO[C@@H]1CCOC1)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245760845 524584326 /nfs/dbraw/zinc/58/43/26/524584326.db2.gz VOOBCLHCFGHEHL-LELZANKISA-N 1 3 344.499 2.966 10 0 EFAEHO C[C@H](CO[C@@H]1CCOC1)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245760845 524584335 /nfs/dbraw/zinc/58/43/35/524584335.db2.gz VOOBCLHCFGHEHL-LELZANKISA-N 1 3 344.499 2.966 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000047972280 525436023 /nfs/dbraw/zinc/43/60/23/525436023.db2.gz ZAOCZGJNXAQKBY-LJQANCHMSA-N 1 3 332.488 2.543 10 0 EFAEHO CSC[C@@H](CCO)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245704900 525641998 /nfs/dbraw/zinc/64/19/98/525641998.db2.gz MHHBTBXORAUYAA-MKXGPGLRSA-N 1 3 334.529 2.886 10 0 EFAEHO CSC[C@@H](CCO)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245704900 525642004 /nfs/dbraw/zinc/64/20/04/525642004.db2.gz MHHBTBXORAUYAA-MKXGPGLRSA-N 1 3 334.529 2.886 10 0 EFAEHO CSC[C@H](CCO)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180146662 525699261 /nfs/dbraw/zinc/69/92/61/525699261.db2.gz MHHBTBXORAUYAA-QBUWPKIASA-N 1 3 334.529 2.886 10 0 EFAEHO CSC[C@H](CCO)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180146662 525699272 /nfs/dbraw/zinc/69/92/72/525699272.db2.gz MHHBTBXORAUYAA-QBUWPKIASA-N 1 3 334.529 2.886 10 0 EFAEHO C[C@H](O)C[NH+]1CCC(CN(C)Cc2cc(-c3ccccc3)n[nH]2)CC1 ZINC000179518340 525749303 /nfs/dbraw/zinc/74/93/03/525749303.db2.gz SDXIXFDTSOPYHT-INIZCTEOSA-N 1 3 342.487 2.601 10 0 EFAEHO C[C@@H](c1ccccc1)N1CCC(NC(=O)N2CC[C@@H]([NH+](C)C)C2)CC1 ZINC000116561428 526090716 /nfs/dbraw/zinc/09/07/16/526090716.db2.gz TWWUPBWKNASMOW-QFBILLFUSA-N 1 3 344.503 2.558 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@H](Cc2ccccc2OC)C(C)C)CC1 ZINC000154322651 529145277 /nfs/dbraw/zinc/14/52/77/529145277.db2.gz OSHMXUDDHYHPLJ-HXUWFJFHSA-N 1 3 347.547 2.880 10 0 EFAEHO CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000174979272 529304739 /nfs/dbraw/zinc/30/47/39/529304739.db2.gz HTBVNPZPUIPZAN-VQTJNVASSA-N 1 3 341.499 2.981 10 0 EFAEHO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000174979272 529304740 /nfs/dbraw/zinc/30/47/40/529304740.db2.gz HTBVNPZPUIPZAN-VQTJNVASSA-N 1 3 341.499 2.981 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2CCN(C3CC3)C2)CC1 ZINC000344222180 534936954 /nfs/dbraw/zinc/93/69/54/534936954.db2.gz PJTRPIWZJUPWQR-IBGZPJMESA-N 1 3 342.531 2.545 10 0 EFAEHO CCCN(C(=O)N[C@H](C)[C@@H](C)[NH3+])[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000418711213 535225635 /nfs/dbraw/zinc/22/56/35/535225635.db2.gz WEJARSTZEFFNIA-ZHALLVOQSA-N 1 3 346.519 2.808 10 0 EFAEHO CCN(C(=O)N[C@H](C)[C@H](C)[NH3+])[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418729246 535680411 /nfs/dbraw/zinc/68/04/11/535680411.db2.gz QUYCXESRKHJLNH-LHHMISFZSA-N 1 3 332.492 2.589 10 0 EFAEHO C[NH+](C)CCCCNCc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000264072041 535832397 /nfs/dbraw/zinc/83/23/97/535832397.db2.gz MLBBXOHGMRJGRY-UHFFFAOYSA-N 1 3 333.457 2.970 10 0 EFAEHO CN(C)CCOc1cccc(NC(=O)NCC2([NH3+])CCCCCC2)c1 ZINC000414874937 535910498 /nfs/dbraw/zinc/91/04/98/535910498.db2.gz BKMYFCJRKRXRCF-UHFFFAOYSA-N 1 3 348.491 2.800 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCn1nc(-c2ccc(F)cc2)c2c1CCNC2 ZINC000211644959 536370611 /nfs/dbraw/zinc/37/06/11/536370611.db2.gz GDFMQPCQIXFLGZ-MRXNPFEDSA-N 1 3 328.435 2.819 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCn1nc(-c2ccc(F)cc2)c2c1CCNC2 ZINC000211644959 536370614 /nfs/dbraw/zinc/37/06/14/536370614.db2.gz GDFMQPCQIXFLGZ-MRXNPFEDSA-N 1 3 328.435 2.819 10 0 EFAEHO COC1(CNCc2ccccc2C[NH+]2CCCCC2)CCOCC1 ZINC000344836429 536680174 /nfs/dbraw/zinc/68/01/74/536680174.db2.gz USXZKHCXELRHNW-UHFFFAOYSA-N 1 3 332.488 2.958 10 0 EFAEHO COC1(C[NH2+]Cc2ccccc2CN2CCCCC2)CCOCC1 ZINC000344836429 536680178 /nfs/dbraw/zinc/68/01/78/536680178.db2.gz USXZKHCXELRHNW-UHFFFAOYSA-N 1 3 332.488 2.958 10 0 EFAEHO COC1(C[NH2+][C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)CCOCC1 ZINC000230212786 536684401 /nfs/dbraw/zinc/68/44/01/536684401.db2.gz GXXSENNDAGGEPV-XUVXKRRUSA-N 1 3 344.499 2.682 10 0 EFAEHO Cn1cc(CCC[NH2+][C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)cn1 ZINC000313990616 545810185 /nfs/dbraw/zinc/81/01/85/545810185.db2.gz NWLYDBULEMKORP-PWRODBHTSA-N 1 3 338.499 2.853 10 0 EFAEHO CC[C@H](Cn1cncn1)NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000340473712 545934174 /nfs/dbraw/zinc/93/41/74/545934174.db2.gz KXYYALQAXCVFFG-LJQANCHMSA-N 1 3 327.476 2.832 10 0 EFAEHO CC(CN1CCCCC[C@H]1CCO)C[N@@H+]1CCCCC[C@H]1CCO ZINC000342042284 545944505 /nfs/dbraw/zinc/94/45/05/545944505.db2.gz FVDVBLWXQCGNIO-PMACEKPBSA-N 1 3 340.552 2.877 10 0 EFAEHO CC(CN1CCCCC[C@H]1CCO)C[N@H+]1CCCCC[C@H]1CCO ZINC000342042284 545944510 /nfs/dbraw/zinc/94/45/10/545944510.db2.gz FVDVBLWXQCGNIO-PMACEKPBSA-N 1 3 340.552 2.877 10 0 EFAEHO CC[C@@H]1C[C@@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCO1 ZINC000397562090 546170371 /nfs/dbraw/zinc/17/03/71/546170371.db2.gz SJGDBPLMUXIKQE-RBUKOAKNSA-N 1 3 332.488 2.561 10 0 EFAEHO [NH3+][C@H]1CCC[C@H](NC(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000416899054 546204294 /nfs/dbraw/zinc/20/42/94/546204294.db2.gz DRBZYMAZRMOJPA-OALUTQOASA-N 1 3 344.503 2.742 10 0 EFAEHO O=C(NCc1ccccc1CN1CCCCC1)[C@H]1C[C@]12CCC[NH2+]C2 ZINC000655442915 546449560 /nfs/dbraw/zinc/44/95/60/546449560.db2.gz GMBPOWKOOAMRRY-CTNGQTDRSA-N 1 3 341.499 2.678 10 0 EFAEHO CCC[N@H+](CC)Cc1ccc(C(=O)N[C@H](CN)C(F)(F)F)cc1 ZINC000655514305 546470191 /nfs/dbraw/zinc/47/01/91/546470191.db2.gz PYSFJORWURKLKC-CQSZACIVSA-N 1 3 331.382 2.538 10 0 EFAEHO CCC[N@@H+](CC)Cc1ccc(C(=O)N[C@H](CN)C(F)(F)F)cc1 ZINC000655514305 546470194 /nfs/dbraw/zinc/47/01/94/546470194.db2.gz PYSFJORWURKLKC-CQSZACIVSA-N 1 3 331.382 2.538 10 0 EFAEHO COCC1(C[NH2+]Cc2ccccc2N(C)C2CCN(C)CC2)CC1 ZINC000655836124 546605749 /nfs/dbraw/zinc/60/57/49/546605749.db2.gz CUSQENXBHGETTK-UHFFFAOYSA-N 1 3 331.504 2.733 10 0 EFAEHO COc1cc(CN2CCC[C@H](C3CC[NH2+]CC3)C2)cc2c1OCCO2 ZINC000656786508 546924446 /nfs/dbraw/zinc/92/44/46/546924446.db2.gz TZGZNPPRSNNDKO-KRWDZBQOSA-N 1 3 346.471 2.678 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNCc2ccnn2-c2ccncc2)C1 ZINC000657311914 547103379 /nfs/dbraw/zinc/10/33/79/547103379.db2.gz ZCPQRJQBWKHGDS-QGZVFWFLSA-N 1 3 327.476 2.869 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNCc2ccnn2-c2ccncc2)C1 ZINC000657311914 547103383 /nfs/dbraw/zinc/10/33/83/547103383.db2.gz ZCPQRJQBWKHGDS-QGZVFWFLSA-N 1 3 327.476 2.869 10 0 EFAEHO CC[C@H]1C[C@@H]([NH2+]CCCCN2CCN(Cc3ccccc3)CC2)CO1 ZINC000657314897 547106955 /nfs/dbraw/zinc/10/69/55/547106955.db2.gz GBSAHDTVVIMYSH-RTWAWAEBSA-N 1 3 345.531 2.742 10 0 EFAEHO Cn1cc(CNCC2CC[NH+](C3CCOCC3)CC2)c(C(C)(C)C)n1 ZINC000657535317 547195706 /nfs/dbraw/zinc/19/57/06/547195706.db2.gz JHYNDVJVQHGGHB-UHFFFAOYSA-N 1 3 348.535 2.698 10 0 EFAEHO COc1cc(F)cc(CNCC2CC[NH+](C3CCOCC3)CC2)c1 ZINC000657537558 547196761 /nfs/dbraw/zinc/19/67/61/547196761.db2.gz PAWCRPYQNCQJLP-UHFFFAOYSA-N 1 3 336.451 2.815 10 0 EFAEHO CC(C)(C)c1ncc(CNCC2CC[NH+](C3CCOCC3)CC2)cn1 ZINC000657537582 547197019 /nfs/dbraw/zinc/19/70/19/547197019.db2.gz POGJLRSXXUHXHH-UHFFFAOYSA-N 1 3 346.519 2.755 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1csc(Br)c1 ZINC000657572710 547210935 /nfs/dbraw/zinc/21/09/35/547210935.db2.gz CHNJKOOYKRUPOJ-LBPRGKRZSA-N 1 3 348.354 2.872 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1cn(C)nc1C1CCCCC1 ZINC000657573057 547212038 /nfs/dbraw/zinc/21/20/38/547212038.db2.gz IQDKKUWHVVKRRR-KRWDZBQOSA-N 1 3 349.567 2.829 10 0 EFAEHO Cc1cc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)ccc1F ZINC000657593533 547219829 /nfs/dbraw/zinc/21/98/29/547219829.db2.gz AHOSTNFKQPEQGB-LJQANCHMSA-N 1 3 328.431 2.991 10 0 EFAEHO Cc1cc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)ccc1F ZINC000657593533 547219833 /nfs/dbraw/zinc/21/98/33/547219833.db2.gz AHOSTNFKQPEQGB-LJQANCHMSA-N 1 3 328.431 2.991 10 0 EFAEHO O[C@H]1CCN(Cc2ccc(C[NH2+][C@@H]3CCc4ccccc4C3)cc2)C1 ZINC000657593956 547220904 /nfs/dbraw/zinc/22/09/04/547220904.db2.gz DMHXBOFWVKDNIR-YADHBBJMSA-N 1 3 336.479 2.900 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CNCC1CC[NH+](CC2CC2)CC1 ZINC000657812812 547292442 /nfs/dbraw/zinc/29/24/42/547292442.db2.gz FRZGBNJVAMROSE-UHFFFAOYSA-N 1 3 339.487 2.787 10 0 EFAEHO COC[C@H](CC1CCOCC1)NCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000657839418 547299005 /nfs/dbraw/zinc/29/90/05/547299005.db2.gz UXGJSMLYZJBGEL-SCTDSRPQSA-N 1 3 326.525 2.776 10 0 EFAEHO COC[C@H](CC1CCOCC1)NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000657839418 547299009 /nfs/dbraw/zinc/29/90/09/547299009.db2.gz UXGJSMLYZJBGEL-SCTDSRPQSA-N 1 3 326.525 2.776 10 0 EFAEHO COC[C@H](CC1CCOCC1)[NH2+]CCCN1C[C@H](C)C[C@H](C)C1 ZINC000657839418 547299011 /nfs/dbraw/zinc/29/90/11/547299011.db2.gz UXGJSMLYZJBGEL-SCTDSRPQSA-N 1 3 326.525 2.776 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(C(=O)NCCN(C)C)cc1)C(C)(C)C(F)F ZINC000657919024 547316786 /nfs/dbraw/zinc/31/67/86/547316786.db2.gz JJFRCFUYLJVMOL-ZDUSSCGKSA-N 1 3 341.446 2.747 10 0 EFAEHO COC[C@@H](CC1CCOCC1)[NH2+]C[C@@H]1CCCN(CC(C)C)C1 ZINC000657932981 547319075 /nfs/dbraw/zinc/31/90/75/547319075.db2.gz YAMIHMADSYLSRC-RBUKOAKNSA-N 1 3 326.525 2.776 10 0 EFAEHO COC[C@@H](CC1CCOCC1)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000657932981 547319077 /nfs/dbraw/zinc/31/90/77/547319077.db2.gz YAMIHMADSYLSRC-RBUKOAKNSA-N 1 3 326.525 2.776 10 0 EFAEHO COC[C@@H](CC1CCOCC1)NC[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000657932981 547319080 /nfs/dbraw/zinc/31/90/80/547319080.db2.gz YAMIHMADSYLSRC-RBUKOAKNSA-N 1 3 326.525 2.776 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]C[C@@H]2CCN2C(C)(C)C)[C@@H](C)C1 ZINC000658053459 547343633 /nfs/dbraw/zinc/34/36/33/547343633.db2.gz BEEITFWUKYRFHS-BZSNNMDCSA-N 1 3 325.541 2.586 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NC[C@@H]2CCN2C(C)(C)C)[C@@H](C)C1 ZINC000658053459 547343636 /nfs/dbraw/zinc/34/36/36/547343636.db2.gz BEEITFWUKYRFHS-BZSNNMDCSA-N 1 3 325.541 2.586 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NC[C@@H]2CCN2C(C)(C)C)[C@@H](C)C1 ZINC000658053459 547343639 /nfs/dbraw/zinc/34/36/39/547343639.db2.gz BEEITFWUKYRFHS-BZSNNMDCSA-N 1 3 325.541 2.586 10 0 EFAEHO CO[C@H](CNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)[C@H]1CCOC1 ZINC000658070253 547347916 /nfs/dbraw/zinc/34/79/16/547347916.db2.gz AVJKVMNGHUREFO-HFSMHLIXSA-N 1 3 346.515 2.723 10 0 EFAEHO CO[C@@H](CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CCOC1 ZINC000658077848 547350172 /nfs/dbraw/zinc/35/01/72/547350172.db2.gz RLSSZHJWJWTWMC-WNTWWTRPSA-N 1 3 344.499 2.823 10 0 EFAEHO CO[C@@H](CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1CCOC1 ZINC000658077848 547350174 /nfs/dbraw/zinc/35/01/74/547350174.db2.gz RLSSZHJWJWTWMC-WNTWWTRPSA-N 1 3 344.499 2.823 10 0 EFAEHO COc1ccc([C@@H](C)N[C@@H](C)CN(C)CCC[NH+](C)C)c(F)c1 ZINC000658106345 547357528 /nfs/dbraw/zinc/35/75/28/547357528.db2.gz BRAZWHTYJKUNJO-LSDHHAIUSA-N 1 3 325.472 2.757 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)N[C@@H](C)c1nc2c(s1)CCCC2 ZINC000658107745 547358683 /nfs/dbraw/zinc/35/86/83/547358683.db2.gz OEVRGQMFXBNQOS-GJZGRUSLSA-N 1 3 338.565 2.945 10 0 EFAEHO CCc1nc(C)c([C@H](C)N[C@@H](C)CN(C)CCC[NH+](C)C)s1 ZINC000658108792 547359169 /nfs/dbraw/zinc/35/91/69/547359169.db2.gz QKCUKHJIWXSUIJ-KBPBESRZSA-N 1 3 326.554 2.937 10 0 EFAEHO CCc1nc(C)c([C@@H](C)N[C@@H](C)CN(C)CCC[NH+](C)C)s1 ZINC000658108801 547359656 /nfs/dbraw/zinc/35/96/56/547359656.db2.gz QKCUKHJIWXSUIJ-UONOGXRCSA-N 1 3 326.554 2.937 10 0 EFAEHO C[C@H](CC1CCOCC1)[NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000658138165 547367929 /nfs/dbraw/zinc/36/79/29/547367929.db2.gz IWHKVRGPWCNBDN-OXQOHEQNSA-N 1 3 332.488 2.548 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@@H]([NH2+]Cc3ccc(CN4CC[C@@H](O)C4)cc3)C[C@H]2C1 ZINC000658137390 547368029 /nfs/dbraw/zinc/36/80/29/547368029.db2.gz KPSFULLYXJAUFS-XNTOXWQXSA-N 1 3 344.499 2.546 10 0 EFAEHO COC[C@@H]([NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1)C1CCCC1 ZINC000658137991 547368268 /nfs/dbraw/zinc/36/82/68/547368268.db2.gz LKLJITFWCVDQCS-WOJBJXKFSA-N 1 3 332.488 2.548 10 0 EFAEHO O[C@@H]1CCN(Cc2ccc(C[NH2+][C@@H]3CCCC34CCOCC4)cc2)C1 ZINC000658138039 547368312 /nfs/dbraw/zinc/36/83/12/547368312.db2.gz MCNGJXFZRUKBQG-WOJBJXKFSA-N 1 3 344.499 2.692 10 0 EFAEHO C[C@@H](NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cccc(O)c1 ZINC000658139575 547369292 /nfs/dbraw/zinc/36/92/92/547369292.db2.gz QFQCUROEHVQBTQ-FOIQADDNSA-N 1 3 326.440 2.810 10 0 EFAEHO C[C@@H](NCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1)c1cccc(O)c1 ZINC000658139575 547369294 /nfs/dbraw/zinc/36/92/94/547369294.db2.gz QFQCUROEHVQBTQ-FOIQADDNSA-N 1 3 326.440 2.810 10 0 EFAEHO COC1([C@@H](C)[NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)CCCC1 ZINC000658140531 547369407 /nfs/dbraw/zinc/36/94/07/547369407.db2.gz VCDLHLIITWIWTJ-VQIMIIECSA-N 1 3 332.488 2.691 10 0 EFAEHO CC1(C)[C@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)[C@@H]2CCCO[C@@H]21 ZINC000658139233 547369416 /nfs/dbraw/zinc/36/94/16/547369416.db2.gz PMRKKWZOJCPORW-HAGHYFMRSA-N 1 3 344.499 2.546 10 0 EFAEHO Cc1ccncc1[C@H](C)NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000658142844 547370194 /nfs/dbraw/zinc/37/01/94/547370194.db2.gz ZHNFCWLMUSXCDV-QFBILLFUSA-N 1 3 325.456 2.807 10 0 EFAEHO Cc1ccncc1[C@H](C)NCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000658142844 547370196 /nfs/dbraw/zinc/37/01/96/547370196.db2.gz ZHNFCWLMUSXCDV-QFBILLFUSA-N 1 3 325.456 2.807 10 0 EFAEHO COC1(C[C@@H](C)[NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)CCC1 ZINC000658142503 547370265 /nfs/dbraw/zinc/37/02/65/547370265.db2.gz YLDGJEWGPRJKOA-VQIMIIECSA-N 1 3 332.488 2.691 10 0 EFAEHO CC[C@@H](CN1CCCC1)NC(=O)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000675197346 548227983 /nfs/dbraw/zinc/22/79/83/548227983.db2.gz MVDACVYRQLBVMO-ROUUACIJSA-N 1 3 336.524 2.521 10 0 EFAEHO CC(C)[C@H](C[N@H+](C)Cc1ccccc1)NC(=O)N[C@@H]1CCCN(C)C1 ZINC000681095208 549461422 /nfs/dbraw/zinc/46/14/22/549461422.db2.gz NUIIQSHIWKMNPV-MOPGFXCFSA-N 1 3 346.519 2.536 10 0 EFAEHO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N[C@@H]1CCCN(C)C1 ZINC000681095208 549461425 /nfs/dbraw/zinc/46/14/25/549461425.db2.gz NUIIQSHIWKMNPV-MOPGFXCFSA-N 1 3 346.519 2.536 10 0 EFAEHO CCN1CCN(Cc2ccc(C[NH2+][C@@H]3CCC[C@@H](OC)C3)cc2)CC1 ZINC000684370213 550031067 /nfs/dbraw/zinc/03/10/67/550031067.db2.gz PYLXBGPLXQWRAX-NHCUHLMSSA-N 1 3 345.531 2.871 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH+]2CC([C@H]3CCOC3)C2)CC1 ZINC000684415287 550036884 /nfs/dbraw/zinc/03/68/84/550036884.db2.gz ICQKZICLVHZSAH-IBGZPJMESA-N 1 3 343.515 2.687 10 0 EFAEHO O=C(NCC12CCC[NH+]1CCC2)c1cccc(CN2CCCC2)c1 ZINC000684847096 550103549 /nfs/dbraw/zinc/10/35/49/550103549.db2.gz GRIOXDLZYRLIOQ-UHFFFAOYSA-N 1 3 327.472 2.641 10 0 EFAEHO CN(C)CC[N@H+](C)CCCN(C)Cc1cnc(-c2ccncc2)s1 ZINC000685475788 550156587 /nfs/dbraw/zinc/15/65/87/550156587.db2.gz CRRYBPREPRUMJX-UHFFFAOYSA-N 1 3 347.532 2.520 10 0 EFAEHO CN(C)CC[N@@H+](C)CCCN(C)Cc1cnc(-c2ccncc2)s1 ZINC000685475788 550156588 /nfs/dbraw/zinc/15/65/88/550156588.db2.gz CRRYBPREPRUMJX-UHFFFAOYSA-N 1 3 347.532 2.520 10 0 EFAEHO CN(CCCN(C)Cc1cnc(-c2ccncc2)s1)CC[NH+](C)C ZINC000685475788 550156589 /nfs/dbraw/zinc/15/65/89/550156589.db2.gz CRRYBPREPRUMJX-UHFFFAOYSA-N 1 3 347.532 2.520 10 0 EFAEHO C[C@H](CNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)[NH+]1CCCCC1 ZINC000758849502 575878694 /nfs/dbraw/zinc/87/86/94/575878694.db2.gz KKYMWAGYSGCWSE-NEWSRXKRSA-N 1 3 344.503 2.605 10 0 EFAEHO CN1CC[C@@H](NC(=O)CCCC[NH+]2CCCC2)[C@@H]1c1ccccc1 ZINC000759953504 575961615 /nfs/dbraw/zinc/96/16/15/575961615.db2.gz IBLHMLJXUNRXGY-QUCCMNQESA-N 1 3 329.488 2.814 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCCOc1cccnc1 ZINC000765998171 577097016 /nfs/dbraw/zinc/09/70/16/577097016.db2.gz QWSIHJIBLKMOQM-YLJYHZDGSA-N 1 3 325.456 2.961 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCCOc1cccnc1 ZINC000765998171 577097018 /nfs/dbraw/zinc/09/70/18/577097018.db2.gz QWSIHJIBLKMOQM-YLJYHZDGSA-N 1 3 325.456 2.961 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC[C@H](O)c1cccnc1 ZINC000773083046 581394974 /nfs/dbraw/zinc/39/49/74/581394974.db2.gz RUSUVBJWNDXQMV-UXPWSPDFSA-N 1 3 325.456 2.615 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC[C@H](O)c1cccnc1 ZINC000773083046 581394976 /nfs/dbraw/zinc/39/49/76/581394976.db2.gz RUSUVBJWNDXQMV-UXPWSPDFSA-N 1 3 325.456 2.615 10 0 EFAEHO COCC[N@H+](C)CCCNCc1cc(C)cc(Br)c1 ZINC000774958866 581505142 /nfs/dbraw/zinc/50/51/42/581505142.db2.gz DBRABDJSEOSDJO-UHFFFAOYSA-N 1 3 329.282 2.815 10 0 EFAEHO COCC[N@@H+](C)CCCNCc1cc(C)cc(Br)c1 ZINC000774958866 581505143 /nfs/dbraw/zinc/50/51/43/581505143.db2.gz DBRABDJSEOSDJO-UHFFFAOYSA-N 1 3 329.282 2.815 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N(C)CCNCc1ccc(Cl)s1 ZINC001691317418 1248652018 /nfs/dbraw/zinc/65/20/18/1248652018.db2.gz VGDFERHYNMVCEZ-CQSZACIVSA-N 1 3 343.924 2.822 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N(C)CCNCc1ccc(Cl)s1 ZINC001691317418 1248652031 /nfs/dbraw/zinc/65/20/31/1248652031.db2.gz VGDFERHYNMVCEZ-CQSZACIVSA-N 1 3 343.924 2.822 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2C[C@@H]([NH2+]CCCC3CCCC3)C2)CCC1 ZINC001691446680 1249140861 /nfs/dbraw/zinc/14/08/61/1249140861.db2.gz ADZBGQNXNCGWFI-HDICACEKSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(CCNCc1ccc(Cl)c(Cl)c1)C(=O)CCC[NH+](C)C ZINC001691454251 1249159437 /nfs/dbraw/zinc/15/94/37/1249159437.db2.gz UZWBJXBOEACQKZ-UHFFFAOYSA-N 1 3 346.302 2.883 10 0 EFAEHO Cc1cc(CN2CC[C@@H](NC(=O)CCCC[NH+](C)C)C2)c(C)s1 ZINC001481708347 1249957920 /nfs/dbraw/zinc/95/79/20/1249957920.db2.gz CMWYFRIMGVLOOQ-QGZVFWFLSA-N 1 3 337.533 2.787 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\C[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001268551683 1250102192 /nfs/dbraw/zinc/10/21/92/1250102192.db2.gz IKTDYBQRGOVREA-OKQSBHACSA-N 1 3 345.478 2.660 10 0 EFAEHO c1nc2c([nH]1)C[C@H]([NH2+]C1[C@@H]3CC[C@H]1CN(Cc1ccccc1)C3)CC2 ZINC001772526782 1248030018 /nfs/dbraw/zinc/03/00/18/1248030018.db2.gz RRZJIWHAMYSABJ-JAQBAERBSA-N 1 3 336.483 2.767 10 0 EFAEHO c1nc2c([nH]1)CC[C@@H]([NH2+]C1[C@@H]3CC[C@H]1CN(Cc1ccccc1)C3)C2 ZINC001772526782 1248030027 /nfs/dbraw/zinc/03/00/27/1248030027.db2.gz RRZJIWHAMYSABJ-JAQBAERBSA-N 1 3 336.483 2.767 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@H]2CCC[C@H]([NH+](C)C)C2)cc1F ZINC001691556288 1251770823 /nfs/dbraw/zinc/77/08/23/1251770823.db2.gz STKLZGULLXEPKG-ROUUACIJSA-N 1 3 349.494 2.803 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[NH2+]Cc1cc2ccccc2s1 ZINC001691567182 1251778652 /nfs/dbraw/zinc/77/86/52/1251778652.db2.gz MCKMVLWXFFBTBN-UHFFFAOYSA-N 1 3 333.501 2.791 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]Cc1ccc(C2CC2)cc1 ZINC001691623165 1251840997 /nfs/dbraw/zinc/84/09/97/1251840997.db2.gz NEAALUCLCIJHOV-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@]2(C)CCN(CCCCC(F)(F)F)C2)CC1 ZINC001484059752 1252123831 /nfs/dbraw/zinc/12/38/31/1252123831.db2.gz YLEIYZOSHJYWIR-OAHLLOKOSA-N 1 3 349.441 2.641 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001484098893 1252245303 /nfs/dbraw/zinc/24/53/03/1252245303.db2.gz AJCHLQVAHREUKX-APWZRJJASA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2ccsc2)C1)N(C)C ZINC001484112087 1252261467 /nfs/dbraw/zinc/26/14/67/1252261467.db2.gz NVZDGWJNMORFKS-SJLPKXTDSA-N 1 3 337.533 2.663 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@](C)(C[NH2+]CCCC(C)(C)C)C1 ZINC001484122939 1252298715 /nfs/dbraw/zinc/29/87/15/1252298715.db2.gz MQXIRSQLVKDQKZ-IBGZPJMESA-N 1 3 325.541 2.983 10 0 EFAEHO CC[NH2+][C@H](CNC(=O)[C@@H]1CCCN1C(C)C)c1ccccc1CC ZINC001484325171 1252402059 /nfs/dbraw/zinc/40/20/59/1252402059.db2.gz OMNOTTVJEAOOPZ-MOPGFXCFSA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2ccc(CF)cc2)C1 ZINC001484383851 1252488155 /nfs/dbraw/zinc/48/81/55/1252488155.db2.gz DJWGANHHHFIGDH-LPHOPBHVSA-N 1 3 349.494 2.680 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2ccc(C)cc2C)C1 ZINC001484381834 1252494913 /nfs/dbraw/zinc/49/49/13/1252494913.db2.gz BHRSZAOSXOETEG-AZUAARDMSA-N 1 3 345.531 2.829 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@H]3CCCN3C)C2)c(C)c1 ZINC001484511519 1252735136 /nfs/dbraw/zinc/73/51/36/1252735136.db2.gz JDUSQGPHMJBOJK-UYAOXDASSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1cc(C)c(C[NH2+]CC[C@H](C)NC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001273017928 1265797900 /nfs/dbraw/zinc/79/79/00/1265797900.db2.gz FBLSGBJFJAGBTL-BEFAXECRSA-N 1 3 345.531 2.938 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@@H](C[NH2+]CCCC(C)(C)C)C2CC2)C1 ZINC001485825215 1256383019 /nfs/dbraw/zinc/38/30/19/1256383019.db2.gz BKJGZAZQUMWJLX-AEFFLSMTSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1cccc(CN2CC([C@@H](C)NC(=O)C(C)(C)[NH+]3CCCC3)C2)c1 ZINC001409938338 1257438629 /nfs/dbraw/zinc/43/86/29/1257438629.db2.gz ZJYPCNUPZITTHH-QGZVFWFLSA-N 1 3 343.515 2.806 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]CCC(F)(F)F)CC1 ZINC001272778089 1257951126 /nfs/dbraw/zinc/95/11/26/1257951126.db2.gz NZTJMHHBEJOVTI-HDJSIYSDSA-N 1 3 337.430 2.545 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@H]([C@H]2CCCCN2C(=O)CN(C)C(C)C)C1 ZINC001670924038 1258688518 /nfs/dbraw/zinc/68/85/18/1258688518.db2.gz RVTYNYHRMZYMKB-RBUKOAKNSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@H]([C@H]2CCCCN2C(=O)CN(C)C(C)C)C1 ZINC001670924038 1258688527 /nfs/dbraw/zinc/68/85/27/1258688527.db2.gz RVTYNYHRMZYMKB-RBUKOAKNSA-N 1 3 335.536 2.996 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H](C)NC(=O)[C@H](C(C)C)N(C)C)c(C)c1 ZINC001272844057 1261151847 /nfs/dbraw/zinc/15/18/47/1261151847.db2.gz BHEKOAATLYURQG-HKUYNNGSSA-N 1 3 333.520 2.874 10 0 EFAEHO CC(C)(C)[C@]1(C[NH3+])CCN(C[C@H](O)COc2ccccc2Cl)C1 ZINC000923414978 1261628418 /nfs/dbraw/zinc/62/84/18/1261628418.db2.gz NZZGCTGDARBALT-KSSFIOAISA-N 1 3 340.895 2.777 10 0 EFAEHO [NH3+]C[C@@H]1CC2(CO1)CCN(Cc1cc(-c3ccc(F)cc3)no1)CC2 ZINC000923451196 1261688620 /nfs/dbraw/zinc/68/86/20/1261688620.db2.gz ZVXBKCNPRVWUDF-KRWDZBQOSA-N 1 3 345.418 2.811 10 0 EFAEHO [NH3+]C[C@@H]1CC2(CO1)CCN(CCOc1ccc(F)cc1Cl)CC2 ZINC000923451869 1261689554 /nfs/dbraw/zinc/68/95/54/1261689554.db2.gz QMVSXSQLXWYADX-AWEZNQCLSA-N 1 3 342.842 2.688 10 0 EFAEHO C[C@H]1CN(CC(=O)N(Cc2cccc(F)c2)C(C)(C)C)CC[C@H]1C[NH3+] ZINC000923499198 1261795215 /nfs/dbraw/zinc/79/52/15/1261795215.db2.gz RDIVDNNUGNAOFW-RDJZCZTQSA-N 1 3 349.494 2.870 10 0 EFAEHO CC(C)[C@H](NC(=O)CN1CC[C@@H](C[NH3+])[C@@H](C)C1)c1ccc(F)cc1 ZINC000923500513 1261797440 /nfs/dbraw/zinc/79/74/40/1261797440.db2.gz PICACFGMKSRSJH-QOKNQOGYSA-N 1 3 335.467 2.556 10 0 EFAEHO Cn1c2cc(CN3CCC([C@H]4CCC[NH2+]CC4)CC3)ccc2oc1=O ZINC000923507995 1261808462 /nfs/dbraw/zinc/80/84/62/1261808462.db2.gz SKRIAYKSJDFTSI-INIZCTEOSA-N 1 3 343.471 2.733 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2cccc(C)c2)C[C@@H]1C ZINC001486129972 1262663476 /nfs/dbraw/zinc/66/34/76/1262663476.db2.gz PJYLXOHMSMDWLI-AZUAARDMSA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N1CC[C@@]2(NC(=O)CC[NH+](C)C)CCC[C@H]12 ZINC001486151946 1262707538 /nfs/dbraw/zinc/70/75/38/1262707538.db2.gz YWLCWYCFWCFYRB-BPAFIMBUSA-N 1 3 347.478 2.952 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CC[C@H](C[NH2+]CCC2CC2)C1)N1CCCCC1 ZINC001486199647 1262783030 /nfs/dbraw/zinc/78/30/30/1262783030.db2.gz CJCITZPJTSDWCU-ZWKOTPCHSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[C@H](C[NH2+]CCC2CC2)C1)N1CCCCC1 ZINC001486199645 1262783408 /nfs/dbraw/zinc/78/34/08/1262783408.db2.gz CJCITZPJTSDWCU-ROUUACIJSA-N 1 3 335.536 2.926 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N2C[C@@H](NC/C=C\Cl)C(C)(C)C2)C1 ZINC001486241508 1262842466 /nfs/dbraw/zinc/84/24/66/1262842466.db2.gz VAHFTGLHRPKGJX-MMAALDBVSA-N 1 3 341.927 2.688 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N2C[C@@H](NC/C=C\Cl)C(C)(C)C2)C1 ZINC001486241508 1262842481 /nfs/dbraw/zinc/84/24/81/1262842481.db2.gz VAHFTGLHRPKGJX-MMAALDBVSA-N 1 3 341.927 2.688 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCc2ccc(C)cc2)C(C)(C)C1 ZINC001486246433 1262850475 /nfs/dbraw/zinc/85/04/75/1262850475.db2.gz KRXJVSFPLKHFPE-LJQANCHMSA-N 1 3 345.531 2.706 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C(F)(F)F)[C@@H](C[NH2+]CC=C(C)C)C1 ZINC001486253161 1262860248 /nfs/dbraw/zinc/86/02/48/1262860248.db2.gz KKFWYCVHUGXGFQ-GJZGRUSLSA-N 1 3 349.441 2.521 10 0 EFAEHO CC(C)N(CC[N@H+](C)[C@@H]1CCc2ccccc21)C(=O)[C@@H]1CCCN1C ZINC001486364193 1262952682 /nfs/dbraw/zinc/95/26/82/1262952682.db2.gz DXWCIZDAIIMFDJ-UXHICEINSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(CC[N@@H+](C)[C@@H]1CCc2ccccc21)C(=O)[C@@H]1CCCN1C ZINC001486364193 1262952686 /nfs/dbraw/zinc/95/26/86/1262952686.db2.gz DXWCIZDAIIMFDJ-UXHICEINSA-N 1 3 343.515 2.937 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)[NH+]1CCCC1)C1CCN(C/C=C\Cl)CC1 ZINC001486439190 1263125595 /nfs/dbraw/zinc/12/55/95/1263125595.db2.gz OFTIXRLCWLAOCQ-WUKHSURWSA-N 1 3 341.927 2.830 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1C(F)(F)F ZINC001486452924 1263164773 /nfs/dbraw/zinc/16/47/73/1263164773.db2.gz RKHGZLFTTUGKCX-HUUCEWRRSA-N 1 3 349.441 2.662 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]CCCc2ccc(C)cc2)C1)N(C)C ZINC001486465151 1263178738 /nfs/dbraw/zinc/17/87/38/1263178738.db2.gz GCYVTRMKMYEFJL-SOAGJPPSSA-N 1 3 345.531 2.847 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+]Cc1cccc(Cl)c1F ZINC001273205357 1263215740 /nfs/dbraw/zinc/21/57/40/1263215740.db2.gz ZMOHFCHLMCJPCZ-ZDUSSCGKSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC([NH2+]CCCc2ccccc2)C1)N(C)C ZINC001486480784 1263215958 /nfs/dbraw/zinc/21/59/58/1263215958.db2.gz OAAVARXVRPOISH-ACBHZAAOSA-N 1 3 331.504 2.538 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)N1C[C@@H]2[C@@H](CNC(=O)CC[NH+](C)C)[C@@H]2C1 ZINC001410120490 1263522872 /nfs/dbraw/zinc/52/28/72/1263522872.db2.gz JLAGWGAPXMHADZ-XDKFSHSGSA-N 1 3 349.906 2.647 10 0 EFAEHO CC(C)CCC[N@@H+]1CCCC2(CN(C(=O)[C@@H](C(C)C)N(C)C)C2)C1 ZINC001410171071 1264160439 /nfs/dbraw/zinc/16/04/39/1264160439.db2.gz LSIQLSHCMPEXPX-GOSISDBHSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CCC[N@H+]1CCCC2(CN(C(=O)[C@@H](C(C)C)N(C)C)C2)C1 ZINC001410171071 1264160441 /nfs/dbraw/zinc/16/04/41/1264160441.db2.gz LSIQLSHCMPEXPX-GOSISDBHSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H]2CCCc3ccccc32)C1)N(C)C ZINC001410217072 1264340306 /nfs/dbraw/zinc/34/03/06/1264340306.db2.gz GONJZHBFQCZZIS-UHMOLFJZSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@]1(C[NH2+]Cc2cnn(CCF)c2)CCN(Cc2ccccc2)C1 ZINC000922093361 1264352112 /nfs/dbraw/zinc/35/21/12/1264352112.db2.gz CXKTVKLCWDEKHM-LJQANCHMSA-N 1 3 330.451 2.854 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(Cl)s2)C1 ZINC001410220594 1264359727 /nfs/dbraw/zinc/35/97/27/1264359727.db2.gz JXOTUUWVRSGITN-JOCQHMNTSA-N 1 3 343.924 2.728 10 0 EFAEHO CN(C/C=C\Cl)C1CCN(C(=O)[C@@H]2CCC[C@@H]3CCC[N@@H+]32)CC1 ZINC001410251297 1264513465 /nfs/dbraw/zinc/51/34/65/1264513465.db2.gz KISMWVDUQTYMPV-PEMKTUGESA-N 1 3 339.911 2.679 10 0 EFAEHO CN(C/C=C\Cl)C1CCN(C(=O)[C@@H]2CCC[C@@H]3CCC[N@H+]32)CC1 ZINC001410251297 1264513470 /nfs/dbraw/zinc/51/34/70/1264513470.db2.gz KISMWVDUQTYMPV-PEMKTUGESA-N 1 3 339.911 2.679 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC(N(C)C/C=C\Cl)CC1)[NH+]1CCCC1 ZINC001410254738 1264545433 /nfs/dbraw/zinc/54/54/33/1264545433.db2.gz CGAZCRDTEYRKDD-SKHCZCESSA-N 1 3 341.927 2.782 10 0 EFAEHO CCCN(C)CC(=O)N(C)[C@@H](C[NH2+][C@@H]1CCc2ccccc21)C1CC1 ZINC001410326713 1264809835 /nfs/dbraw/zinc/80/98/35/1264809835.db2.gz MPEQEOWKOYGFLI-UXHICEINSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](CN(C)C(=O)CN(C)CC(C)(C)C)[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001410439164 1265293527 /nfs/dbraw/zinc/29/35/27/1265293527.db2.gz QWODUAWHARXRRM-HUUCEWRRSA-N 1 3 347.494 2.836 10 0 EFAEHO CN(C/C=C/Cl)CC1CCN(C(=O)CCCC[NH+](C)C)CC1 ZINC001494211729 1268466119 /nfs/dbraw/zinc/46/61/19/1268466119.db2.gz XIWHFYXOKSKGFV-UXBLZVDNSA-N 1 3 329.916 2.641 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001273130648 1268778320 /nfs/dbraw/zinc/77/83/20/1268778320.db2.gz BNTWFVYFYZKIOV-SWLSCSKDSA-N 1 3 345.940 2.972 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]Cc2cc(C)ccc2F)[C@@H]1C ZINC001410861016 1269904009 /nfs/dbraw/zinc/90/40/09/1269904009.db2.gz OTMKEGXFUGIJQT-MAUKXSAKSA-N 1 3 335.467 2.555 10 0 EFAEHO C[C@@H]1C[C@H](NCc2ccc(F)c(Cl)c2)CN1C(=O)CC[NH+](C)C ZINC001410874725 1269988965 /nfs/dbraw/zinc/98/89/65/1269988965.db2.gz UIYFOIAAOYCIBQ-OCCSQVGLSA-N 1 3 341.858 2.510 10 0 EFAEHO C[C@H]1C[C@@H](NCc2ccc(F)c(Cl)c2)CN1C(=O)CC[NH+](C)C ZINC001410874711 1269989264 /nfs/dbraw/zinc/98/92/64/1269989264.db2.gz UIYFOIAAOYCIBQ-GXTWGEPZSA-N 1 3 341.858 2.510 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CCC(C)(C)C)[C@H]2C1 ZINC001410912379 1270200294 /nfs/dbraw/zinc/20/02/94/1270200294.db2.gz FLLOYNJGQSHJRY-BZSNNMDCSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CCC(C)(C)C)[C@@H]2C1 ZINC001410912409 1270201649 /nfs/dbraw/zinc/20/16/49/1270201649.db2.gz FLLOYNJGQSHJRY-RCCFBDPRSA-N 1 3 337.552 2.981 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H](C[NH2+]Cc3ccsc3)C2)CCC1 ZINC001410948911 1270380597 /nfs/dbraw/zinc/38/05/97/1270380597.db2.gz HPNWLDYXXAXPJG-HOCLYGCPSA-N 1 3 335.517 2.607 10 0 EFAEHO CC(C)(C(=O)N1C[C@@H]([NH2+]CCC(F)(F)F)C(C)(C)C1)N1CCCC1 ZINC001411002443 1270620834 /nfs/dbraw/zinc/62/08/34/1270620834.db2.gz UAASGGCXQXJBBZ-CYBMUJFWSA-N 1 3 349.441 2.640 10 0 EFAEHO Cc1ccc(CCC[NH+]2CC([C@@H](C)NC(=O)CN(C)C(C)C)C2)cc1 ZINC001409972956 1271107849 /nfs/dbraw/zinc/10/78/49/1271107849.db2.gz OMHALGORULQUDR-GOSISDBHSA-N 1 3 345.531 2.704 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCN(C(=O)[C@H]2CCCN2C)C(C)C)cc1 ZINC001411183186 1271681838 /nfs/dbraw/zinc/68/18/38/1271681838.db2.gz HILQFQPBZAHSBW-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCN(C(=O)[C@H]2CCCN2C)C(C)C)cc1 ZINC001411183186 1271681843 /nfs/dbraw/zinc/68/18/43/1271681843.db2.gz HILQFQPBZAHSBW-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H](CNCc1cc(F)ccc1F)C(C)(C)C ZINC001411225082 1272063252 /nfs/dbraw/zinc/06/32/52/1272063252.db2.gz QCISEDUILQETOA-INIZCTEOSA-N 1 3 341.446 2.537 10 0 EFAEHO C[C@H](NC(=O)CCC[NH+](C)C)C1CCN(Cc2ccccc2F)CC1 ZINC001411234390 1272092069 /nfs/dbraw/zinc/09/20/69/1272092069.db2.gz MKBUJYJUNQDJFS-INIZCTEOSA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1cccc(CN2C[C@@H](NC(=O)[C@H](C(C)C)[NH+](C)C)C(C)(C)C2)c1 ZINC001410011629 1276505395 /nfs/dbraw/zinc/50/53/95/1276505395.db2.gz ATCWJRWEHCBOJW-MOPGFXCFSA-N 1 3 345.531 2.908 10 0 EFAEHO O[C@@H](CNCc1cccc(C[NH+]2CCCC2)c1)c1ccc(F)cn1 ZINC000818952968 1276557067 /nfs/dbraw/zinc/55/70/67/1276557067.db2.gz DVBDQMZARNNUDY-IBGZPJMESA-N 1 3 329.419 2.640 10 0 EFAEHO Cc1ccccc1[C@@H](O)CNCc1ccccc1OCC[NH+](C)C ZINC000818985406 1276563600 /nfs/dbraw/zinc/56/36/00/1276563600.db2.gz SFLPFRKPSOVRDI-IBGZPJMESA-N 1 3 328.456 2.759 10 0 EFAEHO Cc1cc(C)cc([C@H](O)C[NH2+]C2CCN([C@H]3CCCC[C@H]3O)CC2)c1 ZINC000819175510 1276657082 /nfs/dbraw/zinc/65/70/82/1276657082.db2.gz ZDIHTFQCPVYBIV-PWRODBHTSA-N 1 3 346.515 2.694 10 0 EFAEHO Cc1cc(C)cc([C@H](O)C[NH2+]C2CCN([C@@H]3CCCC[C@H]3O)CC2)c1 ZINC000819175508 1276658081 /nfs/dbraw/zinc/65/80/81/1276658081.db2.gz ZDIHTFQCPVYBIV-NJDAHSKKSA-N 1 3 346.515 2.694 10 0 EFAEHO COC(CCN1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1)OC ZINC000585133713 1277480883 /nfs/dbraw/zinc/48/08/83/1277480883.db2.gz RTJIGZCHBOBTAW-WOJBJXKFSA-N 1 3 332.488 2.839 10 0 EFAEHO CCCC[N@H+](CCC(=O)N(C)OC)C1CC(C)(C)NC(C)(C)C1 ZINC001174982910 1287288193 /nfs/dbraw/zinc/28/81/93/1287288193.db2.gz ALGJUBDNYJKFMH-UHFFFAOYSA-N 1 3 327.513 2.808 10 0 EFAEHO CCCC[N@@H+](CCC(=O)N(C)OC)C1CC(C)(C)NC(C)(C)C1 ZINC001174982910 1287288197 /nfs/dbraw/zinc/28/81/97/1287288197.db2.gz ALGJUBDNYJKFMH-UHFFFAOYSA-N 1 3 327.513 2.808 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@H](C)c1ccc(N2CCNC2=O)cc1 ZINC000844925774 1279345606 /nfs/dbraw/zinc/34/56/06/1279345606.db2.gz URGPZKOIIRIHSV-OAHLLOKOSA-N 1 3 338.455 2.786 10 0 EFAEHO CCN1C[C@H](CN2CCC(CC[N@H+](CC)CC3CC3)CC2)OC1=O ZINC000846841321 1280568256 /nfs/dbraw/zinc/56/82/56/1280568256.db2.gz MGPORSTZDVTMHE-SFHVURJKSA-N 1 3 337.508 2.661 10 0 EFAEHO CCN1C[C@H](CN2CCC(CC[N@@H+](CC)CC3CC3)CC2)OC1=O ZINC000846841321 1280568267 /nfs/dbraw/zinc/56/82/67/1280568267.db2.gz MGPORSTZDVTMHE-SFHVURJKSA-N 1 3 337.508 2.661 10 0 EFAEHO CCN1C[C@@H](CN2CCC(CCC[NH+](CC)CC)CC2)OC1=O ZINC000846849669 1280573358 /nfs/dbraw/zinc/57/33/58/1280573358.db2.gz HLVZLZUUZSMJLF-QGZVFWFLSA-N 1 3 325.497 2.661 10 0 EFAEHO COC(=O)c1cc(CN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)ccc1C ZINC000872145689 1287443460 /nfs/dbraw/zinc/44/34/60/1287443460.db2.gz WLORUAMOURIGBS-UHOSZYNNSA-N 1 3 346.471 2.642 10 0 EFAEHO CN(CCCCCC[NH3+])CC(=O)N(C)Cc1ccc(Cl)s1 ZINC000872155104 1287449423 /nfs/dbraw/zinc/44/94/23/1287449423.db2.gz LKWCVMLBICHKET-UHFFFAOYSA-N 1 3 331.913 2.811 10 0 EFAEHO CN(CCCCCC[NH3+])CC(=O)N(C)[C@H]1CCCc2ccccc21 ZINC000872155274 1287449910 /nfs/dbraw/zinc/44/99/10/1287449910.db2.gz QACSDLQPZJAPLX-IBGZPJMESA-N 1 3 331.504 2.973 10 0 EFAEHO O=C(O[C@H]1CCN(Cc2ccccc2)C1)C1CC[NH+](C2CC2)CC1 ZINC000805885616 1280878767 /nfs/dbraw/zinc/87/87/67/1280878767.db2.gz RKQRKPVOEIREDZ-IBGZPJMESA-N 1 3 328.456 2.679 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001671084518 1281347486 /nfs/dbraw/zinc/34/74/86/1281347486.db2.gz BYEQVCFREAKBBV-SFMFPFJOSA-N 1 3 347.547 2.999 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001671084518 1281347496 /nfs/dbraw/zinc/34/74/96/1281347496.db2.gz BYEQVCFREAKBBV-SFMFPFJOSA-N 1 3 347.547 2.999 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CC[C@]2(CC[N@H+](CC3CC3)C2)C1 ZINC001671084945 1281368268 /nfs/dbraw/zinc/36/82/68/1281368268.db2.gz KAEMFKSHASMOMO-FQEVSTJZSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CC[C@]2(CC[N@@H+](CC3CC3)C2)C1 ZINC001671084945 1281368273 /nfs/dbraw/zinc/36/82/73/1281368273.db2.gz KAEMFKSHASMOMO-FQEVSTJZSA-N 1 3 335.536 2.833 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](CCCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000810147783 1282972540 /nfs/dbraw/zinc/97/25/40/1282972540.db2.gz RYIUUBBVGHUXQI-JTDSTZFVSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000810147783 1282972548 /nfs/dbraw/zinc/97/25/48/1282972548.db2.gz RYIUUBBVGHUXQI-JTDSTZFVSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000810192222 1283026210 /nfs/dbraw/zinc/02/62/10/1283026210.db2.gz DYOAIVHOPRAATN-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000810192222 1283026224 /nfs/dbraw/zinc/02/62/24/1283026224.db2.gz DYOAIVHOPRAATN-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)c1 ZINC000810193761 1283028269 /nfs/dbraw/zinc/02/82/69/1283028269.db2.gz XHIAMVRUBZDMDF-HXUWFJFHSA-N 1 3 349.494 2.967 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)c1 ZINC000810193761 1283028275 /nfs/dbraw/zinc/02/82/75/1283028275.db2.gz XHIAMVRUBZDMDF-HXUWFJFHSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810196045 1283028749 /nfs/dbraw/zinc/02/87/49/1283028749.db2.gz GYIVQCZCHPMKFW-OLMMMNRUSA-N 1 3 341.515 2.682 10 0 EFAEHO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810196045 1283028761 /nfs/dbraw/zinc/02/87/61/1283028761.db2.gz GYIVQCZCHPMKFW-OLMMMNRUSA-N 1 3 341.515 2.682 10 0 EFAEHO [NH3+][C@@H]1CC[C@H](CN(CCO)Cc2cc(Br)ccc2F)C1 ZINC000903434313 1312673279 /nfs/dbraw/zinc/67/32/79/1312673279.db2.gz BTFULSNETBSBPA-SMDDNHRTSA-N 1 3 345.256 2.510 10 0 EFAEHO [NH3+][C@@H]1CC[C@H](CN2CCCC[C@@H]2C(=O)Nc2ccc3c(c2)CCO3)C1 ZINC000903439524 1312682324 /nfs/dbraw/zinc/68/23/24/1312682324.db2.gz JKVHJMIJSCJIAP-YXJHDRRASA-N 1 3 343.471 2.542 10 0 EFAEHO CC(C)(C)c1nc(CN2CCN(C[C@@H]3CC[C@H]([NH3+])C3)CC2)cs1 ZINC000903442076 1312687766 /nfs/dbraw/zinc/68/77/66/1312687766.db2.gz IOFWZSBHRLWRRJ-CABCVRRESA-N 1 3 336.549 2.686 10 0 EFAEHO [NH3+][C@@H]1CC[C@H](CN2CC[C@@H](O)[C@H]2c2ccc(Br)cc2)C1 ZINC000903473857 1312736680 /nfs/dbraw/zinc/73/66/80/1312736680.db2.gz APBZLDNBNZEKDA-AEAUEXCSSA-N 1 3 339.277 2.684 10 0 EFAEHO C[C@H](C(=O)Nc1ccc(C(F)(F)F)cc1)N1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903496106 1312770322 /nfs/dbraw/zinc/77/03/22/1312770322.db2.gz GBKWCJACFQRGCQ-JHJVBQTASA-N 1 3 343.393 2.949 10 0 EFAEHO C[C@H](NC(=O)[C@H](C)N1C[C@@H](C)[C@H](CC[NH3+])C1)c1cc2ccccc2o1 ZINC000903496333 1312770964 /nfs/dbraw/zinc/77/09/64/1312770964.db2.gz KNEMZQRWIKNIIL-WBTNSWJXSA-N 1 3 343.471 2.915 10 0 EFAEHO C([C@@H]1CCC2(CCOCC2)O1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000878286925 1291601556 /nfs/dbraw/zinc/60/15/56/1291601556.db2.gz VJDFSZWSBDKZDW-NZSAHSFTSA-N 1 3 334.504 2.663 10 0 EFAEHO C([C@@H]1CCC2(CCOCC2)O1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000878286925 1291601565 /nfs/dbraw/zinc/60/15/65/1291601565.db2.gz VJDFSZWSBDKZDW-NZSAHSFTSA-N 1 3 334.504 2.663 10 0 EFAEHO C([C@H]1CCC2(CCOCC2)CO1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000878287370 1291603165 /nfs/dbraw/zinc/60/31/65/1291603165.db2.gz ZSHMBLNGNVIFRP-MISYRCLQSA-N 1 3 348.531 2.911 10 0 EFAEHO C([C@H]1CCC2(CCOCC2)CO1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000878287370 1291603174 /nfs/dbraw/zinc/60/31/74/1291603174.db2.gz ZSHMBLNGNVIFRP-MISYRCLQSA-N 1 3 348.531 2.911 10 0 EFAEHO C[C@@H]1COCCN(CC(C[N@@H+]2CCOC[C@@H](C)C2)C2CCCC2)C1 ZINC000878298034 1291610654 /nfs/dbraw/zinc/61/06/54/1291610654.db2.gz DYIXYGQOUKQZDQ-ROUUACIJSA-N 1 3 338.536 2.729 10 0 EFAEHO C[C@@H]1COCCN(CC(C[N@H+]2CCOC[C@@H](C)C2)C2CCCC2)C1 ZINC000878298034 1291610658 /nfs/dbraw/zinc/61/06/58/1291610658.db2.gz DYIXYGQOUKQZDQ-ROUUACIJSA-N 1 3 338.536 2.729 10 0 EFAEHO C[C@H]([NH2+]C[C@@H](O)CN1CCCC1)c1ccc(-c2cccnc2)cc1 ZINC000775540804 1292964360 /nfs/dbraw/zinc/96/43/60/1292964360.db2.gz XZDVCYBAJOERPF-OXJNMPFZSA-N 1 3 325.456 2.856 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H](C)CN(C)C(=O)C1(N(C)C)CCC1 ZINC001277845911 1313100484 /nfs/dbraw/zinc/10/04/84/1313100484.db2.gz OTFIZUXCZVSISM-GOSISDBHSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/C[NH2+][C@@H](C)c1ccc(F)cc1)N(C)C ZINC001274104674 1295456784 /nfs/dbraw/zinc/45/67/84/1295456784.db2.gz BJHBPADZPFLHDD-MLCBILRFSA-N 1 3 335.467 2.735 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C/C=C/CNC(=O)[C@H](C(C)C)N(C)C)c(C)c1 ZINC001274104709 1295456806 /nfs/dbraw/zinc/45/68/06/1295456806.db2.gz CGGJJCYWZWWKJL-IBDYFIJFSA-N 1 3 345.531 2.960 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[NH2+]CCCc1ccsc1)N(C)C ZINC001277884163 1313187204 /nfs/dbraw/zinc/18/72/04/1313187204.db2.gz YOLPPHQDEYBDOK-DLBZAZTESA-N 1 3 337.533 2.602 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]C/C=C\c1ccc(Cl)cc1)N(C)C ZINC001275410493 1296271609 /nfs/dbraw/zinc/27/16/09/1296271609.db2.gz HGHXIVWBIQFKNV-GRQQHNRBSA-N 1 3 337.895 2.788 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CCCC[C@@H]1C[NH2+]CCC1CC1)N1CCCC1 ZINC001275784731 1296407231 /nfs/dbraw/zinc/40/72/31/1296407231.db2.gz XNHLHYVUCISMQO-MSOLQXFVSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@H]([NH2+][C@@H]1C[C@@H](N)C12CCC2)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000925627391 1296863485 /nfs/dbraw/zinc/86/34/85/1296863485.db2.gz XTMYHCXQSKHYKY-WJFTUGDTSA-N 1 3 339.487 2.814 10 0 EFAEHO Cn1cc(CC[NH2+][C@@H]2CCNC[C@@H]2C2CCCC2)c2cccnc21 ZINC000925725860 1296872501 /nfs/dbraw/zinc/87/25/01/1296872501.db2.gz CORFFZBYHNHDML-RTBURBONSA-N 1 3 326.488 2.874 10 0 EFAEHO C[C@@H](CN(C)C(=O)Cc1c[nH]cn1)[NH2+]CCCc1ccccc1Cl ZINC001277946416 1313325142 /nfs/dbraw/zinc/32/51/42/1313325142.db2.gz VLZJFVGBTJETHA-AWEZNQCLSA-N 1 3 348.878 2.675 10 0 EFAEHO COc1ccc([C@@H]2CCCN2C[C@@H](C[NH3+])Cc2cnn(C)c2C)cc1 ZINC000903873025 1313326268 /nfs/dbraw/zinc/32/62/68/1313326268.db2.gz DMGYRXSEMVDKHH-UZLBHIALSA-N 1 3 342.487 2.692 10 0 EFAEHO COc1ccc([C@@H](C)N(C)C[C@H](C[NH3+])Cc2cnn(C)c2C)cc1 ZINC000903877970 1313334396 /nfs/dbraw/zinc/33/43/96/1313334396.db2.gz DHWJIFJVVGIFCC-ZBFHGGJFSA-N 1 3 330.476 2.548 10 0 EFAEHO COC[C@H](C[NH+]1CCN(CCN(C)Cc2ccccc2)CC1)C(C)C ZINC000929607132 1297194077 /nfs/dbraw/zinc/19/40/77/1297194077.db2.gz UBCCWKPDQYLRMK-NRFANRHFSA-N 1 3 347.547 2.655 10 0 EFAEHO COc1c(C)cc(CN(C)C[C@H](C[NH3+])Cc2cnn(C)c2C)cc1C ZINC000903889648 1313357950 /nfs/dbraw/zinc/35/79/50/1313357950.db2.gz UVGJLXWQVWSOFD-SFHVURJKSA-N 1 3 344.503 2.603 10 0 EFAEHO COc1ccccc1[C@@H]1CCCN1C[C@H](C[NH3+])Cc1cnn(C)c1C ZINC000903892064 1313362561 /nfs/dbraw/zinc/36/25/61/1313362561.db2.gz PHGKSMYGMIDQLX-LPHOPBHVSA-N 1 3 342.487 2.692 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN2CCC[C@@](C)(c3ccccc3)C2)cnn1C ZINC000903893275 1313364814 /nfs/dbraw/zinc/36/48/14/1313364814.db2.gz UHFWIZWFUAEAHW-WIYYLYMNSA-N 1 3 340.515 2.900 10 0 EFAEHO CC[C@H]1c2ccccc2CCN1C[C@H](C[NH3+])Cc1cnn(C)c1C ZINC000903893238 1313364852 /nfs/dbraw/zinc/36/48/52/1313364852.db2.gz SUNMDKOCYKWKFQ-JXFKEZNVSA-N 1 3 326.488 2.855 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CC[C@H](c3ccccc3)[C@H](C)C2)cnn1C ZINC000903896723 1313372120 /nfs/dbraw/zinc/37/21/20/1313372120.db2.gz DPUMKQNDYNEUTB-BLIXFSHQSA-N 1 3 340.515 2.972 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CC[C@H](c3ccccc3)[C@H](C)C2)cnn1C ZINC000903896723 1313372124 /nfs/dbraw/zinc/37/21/24/1313372124.db2.gz DPUMKQNDYNEUTB-BLIXFSHQSA-N 1 3 340.515 2.972 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CNC2(c3ccc(F)cc3)CCC2)cnn1C ZINC000903899456 1313377691 /nfs/dbraw/zinc/37/76/91/1313377691.db2.gz RNXJPMQXORKOEU-OAHLLOKOSA-N 1 3 330.451 2.654 10 0 EFAEHO COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903912212 1313401238 /nfs/dbraw/zinc/40/12/38/1313401238.db2.gz BPCSBEQODWCMMB-WLFXSESQSA-N 1 3 328.456 2.896 10 0 EFAEHO CCCN(CCc1cccs1)Cc1cnnn1[C@@H]1CCC[NH2+]C1 ZINC000903913121 1313403440 /nfs/dbraw/zinc/40/34/40/1313403440.db2.gz NBDVRXCFPQXDAD-OAHLLOKOSA-N 1 3 333.505 2.719 10 0 EFAEHO CC(C)=CC[NH2+][C@H]1C[C@@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001488774153 1297740404 /nfs/dbraw/zinc/74/04/04/1297740404.db2.gz SHNZMRXNLBMIMK-FCEWJHQRSA-N 1 3 339.499 2.650 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN[C@@H]2CCSc3ccccc32)cnn1C ZINC000903927599 1313429840 /nfs/dbraw/zinc/42/98/40/1313429840.db2.gz ZWXGMDBKARVKCN-WMLDXEAASA-N 1 3 330.501 2.673 10 0 EFAEHO Cc1c(C[C@H](CN)C[NH2+][C@@H](C)C(C)(C)c2ccccc2)cnn1C ZINC000903922993 1313424997 /nfs/dbraw/zinc/42/49/97/1313424997.db2.gz JBLHQZJHMRXVRX-DLBZAZTESA-N 1 3 328.504 2.802 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CNC2(c3cccc(C)c3)CCC2)cnn1C ZINC000903931808 1313438072 /nfs/dbraw/zinc/43/80/72/1313438072.db2.gz INRMTEQEAJIZQX-QGZVFWFLSA-N 1 3 326.488 2.823 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN[C@]2(c3ccccc3)CC2(C)C)cnn1C ZINC000903933462 1313441045 /nfs/dbraw/zinc/44/10/45/1313441045.db2.gz RRMHQJHDPFADIU-UZLBHIALSA-N 1 3 326.488 2.761 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccccc2C)C1 ZINC001488966247 1297912897 /nfs/dbraw/zinc/91/28/97/1297912897.db2.gz PJYDXWLIVHJYOU-FUHWJXTLSA-N 1 3 340.471 2.644 10 0 EFAEHO CC[C@](C)(NC[C@@H](C[NH3+])Cc1cnn(C)c1C)c1ccc(F)cc1 ZINC000903935673 1313445976 /nfs/dbraw/zinc/44/59/76/1313445976.db2.gz SFCSYGHVWVFUTC-BEFAXECRSA-N 1 3 332.467 2.900 10 0 EFAEHO CCC/C=C/CC[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)Cc1c[nH]cn1 ZINC001489049755 1297969743 /nfs/dbraw/zinc/96/97/43/1297969743.db2.gz ALVHWOAABAYQBL-BHMLKFMNSA-N 1 3 332.492 2.915 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@H](NC(=O)C23CCCN2CCC3)[C@H]1CC ZINC001489123937 1298038622 /nfs/dbraw/zinc/03/86/22/1298038622.db2.gz LRDTVEJAWJKIDM-HQYUYXFKSA-N 1 3 333.520 2.940 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@H](NC(=O)C23CCCN2CCC3)[C@H]1CC ZINC001489123937 1298038628 /nfs/dbraw/zinc/03/86/28/1298038628.db2.gz LRDTVEJAWJKIDM-HQYUYXFKSA-N 1 3 333.520 2.940 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N2CCCCC2)CC[N@@H+]1CCCF ZINC001489148071 1298083512 /nfs/dbraw/zinc/08/35/12/1298083512.db2.gz WFVYGAZAUHLGMR-KSZLIROESA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N2CCCCC2)CC[N@H+]1CCCF ZINC001489148071 1298083523 /nfs/dbraw/zinc/08/35/23/1298083523.db2.gz WFVYGAZAUHLGMR-KSZLIROESA-N 1 3 341.515 2.826 10 0 EFAEHO CN(Cc1cccc(F)c1)C[C@@H]1CCCCN1C(=O)CCC[NH+](C)C ZINC001489327740 1298180566 /nfs/dbraw/zinc/18/05/66/1298180566.db2.gz GNADMITXPNUEIS-IBGZPJMESA-N 1 3 349.494 2.980 10 0 EFAEHO COc1cc(C[NH2+]C[C@@H]2CNCCC2(F)F)ccc1OC(C)C ZINC000903954803 1313480175 /nfs/dbraw/zinc/48/01/75/1313480175.db2.gz WGUCIYJCYHNSSK-AWEZNQCLSA-N 1 3 328.403 2.817 10 0 EFAEHO FC1(F)CCNC[C@@H]1C[NH2+]Cc1ccc(Oc2cnccn2)cc1 ZINC000903955169 1313481761 /nfs/dbraw/zinc/48/17/61/1313481761.db2.gz LYFATVVOPRFYMC-CQSZACIVSA-N 1 3 334.370 2.603 10 0 EFAEHO FC1(F)CCNC[C@H]1C[NH2+]Cc1ccc(OCc2ccncc2)cc1 ZINC000903955544 1313483350 /nfs/dbraw/zinc/48/33/50/1313483350.db2.gz VFBYMHKODUXDTG-KRWDZBQOSA-N 1 3 347.409 2.995 10 0 EFAEHO c1ccc(OCCCCCN[C@H]2C[NH2+]CC3(CCOCC3)C2)cc1 ZINC000903969212 1313513824 /nfs/dbraw/zinc/51/38/24/1313513824.db2.gz CSTRKOZBUQIVJI-GOSISDBHSA-N 1 3 332.488 2.984 10 0 EFAEHO COC(=O)[C@]12C[C@H]([NH3+])C[C@H]1CN(Cc1cnc(C3CCCC3)s1)C2 ZINC000903978683 1313528102 /nfs/dbraw/zinc/52/81/02/1313528102.db2.gz KDVMICBYEKZEFD-IYOUNJFTSA-N 1 3 349.500 2.513 10 0 EFAEHO Cc1cc(C[N@@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C)cs1 ZINC001490244558 1298671340 /nfs/dbraw/zinc/67/13/40/1298671340.db2.gz SRYRHXNWUIZZMY-MRXNPFEDSA-N 1 3 325.522 2.581 10 0 EFAEHO Cc1cc(C[N@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C)cs1 ZINC001490244558 1298671345 /nfs/dbraw/zinc/67/13/45/1298671345.db2.gz SRYRHXNWUIZZMY-MRXNPFEDSA-N 1 3 325.522 2.581 10 0 EFAEHO Cc1cncc(CN(C)CCCNC(=O)[C@H](C)[NH+]2CCCCCC2)c1 ZINC001490255948 1298688079 /nfs/dbraw/zinc/68/80/79/1298688079.db2.gz KJTHIXRJAJPREW-SFHVURJKSA-N 1 3 346.519 2.593 10 0 EFAEHO CN(CCCNC(=O)[C@H]1CCC[C@H]2CCC[N@@H+]21)Cc1ccsc1 ZINC001490258003 1298690932 /nfs/dbraw/zinc/69/09/32/1298690932.db2.gz QOQQPVXKKFLGQB-DLBZAZTESA-N 1 3 335.517 2.703 10 0 EFAEHO CN(CCCNC(=O)[C@H]1CCC[C@H]2CCC[N@H+]21)Cc1ccsc1 ZINC001490258003 1298690937 /nfs/dbraw/zinc/69/09/37/1298690937.db2.gz QOQQPVXKKFLGQB-DLBZAZTESA-N 1 3 335.517 2.703 10 0 EFAEHO CN(CCCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21)Cc1ccsc1 ZINC001490258006 1298691685 /nfs/dbraw/zinc/69/16/85/1298691685.db2.gz QOQQPVXKKFLGQB-SJORKVTESA-N 1 3 335.517 2.703 10 0 EFAEHO CN(CCCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21)Cc1ccsc1 ZINC001490258006 1298691694 /nfs/dbraw/zinc/69/16/94/1298691694.db2.gz QOQQPVXKKFLGQB-SJORKVTESA-N 1 3 335.517 2.703 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@H+](C)CC1CCC(C)(C)CC1 ZINC001490282013 1298706109 /nfs/dbraw/zinc/70/61/09/1298706109.db2.gz PHEDLZBEHVIOIK-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@@H+](C)CC1CCC(C)(C)CC1 ZINC001490282013 1298706120 /nfs/dbraw/zinc/70/61/20/1298706120.db2.gz PHEDLZBEHVIOIK-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@H](C)[NH2+]CCC(F)(F)F ZINC001490313370 1298760654 /nfs/dbraw/zinc/76/06/54/1298760654.db2.gz YRRLBIAAUXZNKM-KBPBESRZSA-N 1 3 337.430 2.638 10 0 EFAEHO CCN(CCCNC(=O)C12CC[NH+](CC1)C2)Cc1cc(C)ccc1F ZINC001490355915 1298834014 /nfs/dbraw/zinc/83/40/14/1298834014.db2.gz UHICUPWCPULCOO-UHFFFAOYSA-N 1 3 347.478 2.558 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](NCc1ccccc1F)C1CC1 ZINC001490671401 1299069892 /nfs/dbraw/zinc/06/98/92/1299069892.db2.gz IUIDEOFHOFDTAA-OALUTQOASA-N 1 3 347.478 2.685 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](NCc1ccccc1F)C1CC1 ZINC001490671401 1299069901 /nfs/dbraw/zinc/06/99/01/1299069901.db2.gz IUIDEOFHOFDTAA-OALUTQOASA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+]Cc1ccc(Cl)s1)C1CC1 ZINC001490742418 1299179579 /nfs/dbraw/zinc/17/95/79/1299179579.db2.gz PKQBDGHUKGUFRI-CQSZACIVSA-N 1 3 343.924 2.726 10 0 EFAEHO CN(C/C=C/Cl)C[C@H]1CCCN(C(=O)CCCC[NH+](C)C)C1 ZINC001490774429 1299231003 /nfs/dbraw/zinc/23/10/03/1299231003.db2.gz BTQGYKIHIQPXBI-OJXHRBAXSA-N 1 3 329.916 2.641 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@H+](C)Cc2ccc(F)cc2)C1 ZINC001490776076 1299236889 /nfs/dbraw/zinc/23/68/89/1299236889.db2.gz GDHAFWDIGZARMK-SFHVURJKSA-N 1 3 349.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@@H+](C)Cc2ccc(F)cc2)C1 ZINC001490776076 1299236898 /nfs/dbraw/zinc/23/68/98/1299236898.db2.gz GDHAFWDIGZARMK-SFHVURJKSA-N 1 3 349.494 2.836 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@@H](C[N@H+](C)CCC2CC2)C1 ZINC001490781852 1299250756 /nfs/dbraw/zinc/25/07/56/1299250756.db2.gz ATSAEAQZZKFQJH-OALUTQOASA-N 1 3 335.536 2.831 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@@H](C[N@@H+](C)CCC2CC2)C1 ZINC001490781852 1299250765 /nfs/dbraw/zinc/25/07/65/1299250765.db2.gz ATSAEAQZZKFQJH-OALUTQOASA-N 1 3 335.536 2.831 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](C[N@H+](C)C/C=C/Cl)C1 ZINC001490785258 1299255378 /nfs/dbraw/zinc/25/53/78/1299255378.db2.gz YQIIVNJDVFCSTD-JSMQFAGNSA-N 1 3 341.927 2.784 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](C[N@@H+](C)C/C=C/Cl)C1 ZINC001490785258 1299255388 /nfs/dbraw/zinc/25/53/88/1299255388.db2.gz YQIIVNJDVFCSTD-JSMQFAGNSA-N 1 3 341.927 2.784 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H](C[N@H+](C)C/C=C\Cl)C1 ZINC001490785260 1299255888 /nfs/dbraw/zinc/25/58/88/1299255888.db2.gz YQIIVNJDVFCSTD-SQGUUQMOSA-N 1 3 341.927 2.784 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H](C[N@@H+](C)C/C=C\Cl)C1 ZINC001490785260 1299255899 /nfs/dbraw/zinc/25/58/99/1299255899.db2.gz YQIIVNJDVFCSTD-SQGUUQMOSA-N 1 3 341.927 2.784 10 0 EFAEHO CC1CCN([C@@H](CNC(=O)C=C2CC[NH2+]CC2)c2cccs2)CC1 ZINC000852855439 1299914750 /nfs/dbraw/zinc/91/47/50/1299914750.db2.gz ZCCCQWDYWBXSKJ-KRWDZBQOSA-N 1 3 347.528 2.947 10 0 EFAEHO O=C(C=C1CC[NH2+]CC1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000852863903 1299919238 /nfs/dbraw/zinc/91/92/38/1299919238.db2.gz TWKZVFBOFXEVQE-UHFFFAOYSA-N 1 3 345.512 2.526 10 0 EFAEHO COc1ccc2c(c1)nccc2N1CCO[C@H](CCC[NH+](C)C)C1 ZINC000853989595 1300378127 /nfs/dbraw/zinc/37/81/27/1300378127.db2.gz DCXJMBCJUVJCDL-MRXNPFEDSA-N 1 3 329.444 2.790 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)/C=C\c1ccccc1Cl ZINC000855345979 1300923854 /nfs/dbraw/zinc/92/38/54/1300923854.db2.gz LSQNFHRIGJTXDP-WOLCWHLNSA-N 1 3 337.895 2.741 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)/C=C\c1ccccc1Cl ZINC000855345979 1300923860 /nfs/dbraw/zinc/92/38/60/1300923860.db2.gz LSQNFHRIGJTXDP-WOLCWHLNSA-N 1 3 337.895 2.741 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)OCc1ccc(Cl)cc1 ZINC000859216577 1301399963 /nfs/dbraw/zinc/39/99/63/1301399963.db2.gz CRMVXHBHYPEYGO-AWEZNQCLSA-N 1 3 341.883 2.838 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)OCc1ccc(Cl)cc1 ZINC000859216577 1301399976 /nfs/dbraw/zinc/39/99/76/1301399976.db2.gz CRMVXHBHYPEYGO-AWEZNQCLSA-N 1 3 341.883 2.838 10 0 EFAEHO CCOc1cc(F)cc(C[NH2+]C[C@H](C)CN2CCN(CC)CC2)c1 ZINC000865449464 1303261191 /nfs/dbraw/zinc/26/11/91/1303261191.db2.gz VNRLYSPLFSLBEP-INIZCTEOSA-N 1 3 337.483 2.588 10 0 EFAEHO C[NH+]1CCC(CNCc2cc3n(n2)CCCC3)(c2ccccc2)CC1 ZINC000865774670 1303394562 /nfs/dbraw/zinc/39/45/62/1303394562.db2.gz KUNGFRZKSNPMOF-UHFFFAOYSA-N 1 3 338.499 2.973 10 0 EFAEHO CCCN1CCC([NH2+]C[C@@H]2CN(Cc3ccc(C)cc3)CCO2)CC1 ZINC000866558625 1303686590 /nfs/dbraw/zinc/68/65/90/1303686590.db2.gz QDPDWLKGLPOGNX-OAQYLSRUSA-N 1 3 345.531 2.660 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N[C@H]2C[C@H](C(=O)OCc3ccccc3)C2)[C@@H](C)C1 ZINC000866603665 1303706990 /nfs/dbraw/zinc/70/69/90/1303706990.db2.gz DJVVIAVNXLNVMI-DSLXNQLJSA-N 1 3 330.472 2.828 10 0 EFAEHO CC[N@H+]1CC[C@@H](N[C@H]2C[C@H](C(=O)OCc3ccccc3)C2)[C@@H](C)C1 ZINC000866603665 1303706995 /nfs/dbraw/zinc/70/69/95/1303706995.db2.gz DJVVIAVNXLNVMI-DSLXNQLJSA-N 1 3 330.472 2.828 10 0 EFAEHO CC(C)(C)[C@@]1(CN)CC[N@H+](CCC(=O)N2CCc3ccccc32)C1 ZINC000866702650 1303755529 /nfs/dbraw/zinc/75/55/29/1303755529.db2.gz DFAIMNALFXQIIU-HXUWFJFHSA-N 1 3 329.488 2.663 10 0 EFAEHO CC(C)(C)[C@@]1(CN)CC[N@@H+](CCC(=O)N2CCc3ccccc32)C1 ZINC000866702650 1303755533 /nfs/dbraw/zinc/75/55/33/1303755533.db2.gz DFAIMNALFXQIIU-HXUWFJFHSA-N 1 3 329.488 2.663 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)[C@H]2CCC[C@@H]([NH+](C)C)C2)CCN1Cc1ccccc1 ZINC001413061634 1314068623 /nfs/dbraw/zinc/06/86/23/1314068623.db2.gz STUYDBJPERYFJS-GSEOLPGOSA-N 1 3 343.515 2.886 10 0 EFAEHO C[C@H]1CCN(C(=O)CCC23CC(C2)C[NH2+]3)CCN1Cc1ccccc1 ZINC000870895712 1305666737 /nfs/dbraw/zinc/66/67/37/1305666737.db2.gz IOUSFBMRRJGHDD-OCDPCBSRSA-N 1 3 341.499 2.642 10 0 EFAEHO O=C(CCC12CC(C1)C[NH2+]2)N[C@H](CN1CCCCC1)c1ccccc1 ZINC000870918623 1305682207 /nfs/dbraw/zinc/68/22/07/1305682207.db2.gz LFWYWMULNWFXIV-MOMVYJMYSA-N 1 3 341.499 2.862 10 0 EFAEHO CN(C)C[C@H](NC(=O)CCC12CC(C1)C[NH2+]2)c1ccc(Cl)cc1 ZINC000870924921 1305687503 /nfs/dbraw/zinc/68/75/03/1305687503.db2.gz CWOZPSWWSXFNCF-MNQCNDSGSA-N 1 3 335.879 2.591 10 0 EFAEHO CC(C)(C)[C@]1(C[NH3+])CCN(C(=O)[C@@H]2CCCN2Cc2ccccc2)C1 ZINC000870991647 1305733200 /nfs/dbraw/zinc/73/32/00/1305733200.db2.gz HHBUXEKSUJRACM-RXVVDRJESA-N 1 3 343.515 2.875 10 0 EFAEHO O=C(N[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(NC2=NCCC2)cc1 ZINC000900239677 1307808920 /nfs/dbraw/zinc/80/89/20/1307808920.db2.gz DVMOINCTWHDXQE-IRXDYDNUSA-N 1 3 326.444 2.647 10 0 EFAEHO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(NC2=NCCC2)cc1 ZINC000900239677 1307808925 /nfs/dbraw/zinc/80/89/25/1307808925.db2.gz DVMOINCTWHDXQE-IRXDYDNUSA-N 1 3 326.444 2.647 10 0 EFAEHO C[C@@H](CNC(=O)c1ccc(NC2=NCCC2)cc1)C[NH+]1CCCC1 ZINC000900272074 1307852345 /nfs/dbraw/zinc/85/23/45/1307852345.db2.gz IKBLSDUNBDCBAE-HNNXBMFYSA-N 1 3 328.460 2.753 10 0 EFAEHO C[C@H](CNC(=O)c1ccc(NC2=NCCC2)cc1)C[NH+]1CCCC1 ZINC000900272075 1307852931 /nfs/dbraw/zinc/85/29/31/1307852931.db2.gz IKBLSDUNBDCBAE-OAHLLOKOSA-N 1 3 328.460 2.753 10 0 EFAEHO O=C(NC1CC[NH+](CC2CC2)CC1)c1ccc(NC2=NCCC2)cc1 ZINC000900274840 1307860101 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CCN1CCCC[C@H]1C(=O)N1CCCC[C@H]1C[NH2+]CCC(F)(F)F ZINC001491270918 1311183287 /nfs/dbraw/zinc/18/32/87/1311183287.db2.gz KKXXIPWYLOOSRK-GJZGRUSLSA-N 1 3 349.441 2.784 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001277075007 1311578529 /nfs/dbraw/zinc/57/85/29/1311578529.db2.gz QTPYTAIZOKXZIH-OSEILGGNSA-N 1 3 343.515 2.770 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@H](C[NH2+]CCc2ccccc2)C1 ZINC001277092661 1311602498 /nfs/dbraw/zinc/60/24/98/1311602498.db2.gz IWSUURAHYYLRJR-BMOGMMAESA-N 1 3 343.515 2.586 10 0 EFAEHO O[C@@H](C[NH2+][C@H](CCc1ccccc1)c1cccnc1)CN1CCCC1 ZINC000902762228 1312084936 /nfs/dbraw/zinc/08/49/36/1312084936.db2.gz JCOXNPZQABIIFQ-LEWJYISDSA-N 1 3 339.483 2.802 10 0 EFAEHO CC(C)=CC[N@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001277392934 1312104559 /nfs/dbraw/zinc/10/45/59/1312104559.db2.gz AIAUMYYRFMBJPF-LJQANCHMSA-N 1 3 333.520 2.750 10 0 EFAEHO CC(C)=CC[N@@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001277392934 1312104561 /nfs/dbraw/zinc/10/45/61/1312104561.db2.gz AIAUMYYRFMBJPF-LJQANCHMSA-N 1 3 333.520 2.750 10 0 EFAEHO COc1ccc2c(c1)C[C@@H](C)C[C@H]2[NH2+]CCN1CCN(C)C(C)(C)C1 ZINC000902982163 1312259656 /nfs/dbraw/zinc/25/96/56/1312259656.db2.gz WKXZASXBIGYLND-OXQOHEQNSA-N 1 3 345.531 2.934 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NC[C@H]1CCC=CCCC1 ZINC001230863621 1312372587 /nfs/dbraw/zinc/37/25/87/1312372587.db2.gz NLZBOBMZLRXFAN-ROUUACIJSA-N 1 3 338.540 2.694 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NC[C@H]1CCC=CCCC1 ZINC001230863621 1312372590 /nfs/dbraw/zinc/37/25/90/1312372590.db2.gz NLZBOBMZLRXFAN-ROUUACIJSA-N 1 3 338.540 2.694 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(CCN(C(=O)[C@H](CC)N(C)C)C2)CC1 ZINC001277495913 1312453436 /nfs/dbraw/zinc/45/34/36/1312453436.db2.gz KWSHXYNNFGISBL-DVBCCOPCSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@H+]1C[C@@H]2C(CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001276701719 1314553452 /nfs/dbraw/zinc/55/34/52/1314553452.db2.gz WCACZPZZJNVTRM-FUVPAVLMSA-N 1 3 347.547 2.901 10 0 EFAEHO CCC/C=C\CC[N@@H+]1C[C@@H]2C(CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001276701719 1314553456 /nfs/dbraw/zinc/55/34/56/1314553456.db2.gz WCACZPZZJNVTRM-FUVPAVLMSA-N 1 3 347.547 2.901 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)cc1 ZINC001278425059 1314564393 /nfs/dbraw/zinc/56/43/93/1314564393.db2.gz YWACRNDOMFZGAR-UYAOXDASSA-N 1 3 345.531 2.847 10 0 EFAEHO CC(C)CC[NH2+]C[C@@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001278550359 1315170723 /nfs/dbraw/zinc/17/07/23/1315170723.db2.gz PXSRKSLTELKRHM-LJQANCHMSA-N 1 3 325.541 2.839 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@](C)(C[NH2+]C/C=C\c2ccccc2)C1 ZINC001278573815 1315217133 /nfs/dbraw/zinc/21/71/33/1315217133.db2.gz YTOIQFYBBWPKDX-OMCJBDSBSA-N 1 3 343.515 2.870 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]CCc2cccs2)C1 ZINC001278613403 1315293617 /nfs/dbraw/zinc/29/36/17/1315293617.db2.gz LBKOXLFQZNVPJT-HOTGVXAUSA-N 1 3 337.533 2.505 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@@H](C[NH2+]CCc2cccs2)C1 ZINC001278613401 1315293629 /nfs/dbraw/zinc/29/36/29/1315293629.db2.gz LBKOXLFQZNVPJT-CVEARBPZSA-N 1 3 337.533 2.505 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCCC[C@H]1C[N@H+](C)CC=C(C)C ZINC001264183114 1316596673 /nfs/dbraw/zinc/59/66/73/1316596673.db2.gz HHZAMBAYIDTOBB-ZWKOTPCHSA-N 1 3 341.515 2.945 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCCC[C@H]1C[N@@H+](C)CC=C(C)C ZINC001264183114 1316596675 /nfs/dbraw/zinc/59/66/75/1316596675.db2.gz HHZAMBAYIDTOBB-ZWKOTPCHSA-N 1 3 341.515 2.945 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@@H+]2CCC2=CCCCC2)C1 ZINC001264373635 1316608372 /nfs/dbraw/zinc/60/83/72/1316608372.db2.gz XTQRXPBHWKVNJE-HKUYNNGSSA-N 1 3 333.520 2.751 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@H+]2CCC2=CCCCC2)C1 ZINC001264373635 1316608373 /nfs/dbraw/zinc/60/83/73/1316608373.db2.gz XTQRXPBHWKVNJE-HKUYNNGSSA-N 1 3 333.520 2.751 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]1C[C@@H]([NH2+]CCCC2CCC2)C1 ZINC001264390974 1316611453 /nfs/dbraw/zinc/61/14/53/1316611453.db2.gz KGUKBYNUWFNXAA-OTWHNJEPSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)CC[NH2+]CC[C@@H]1[C@H](C)CCCN1C(=O)CN(C)C(C)C ZINC001264520857 1316628042 /nfs/dbraw/zinc/62/80/42/1316628042.db2.gz QPERRADJPICJCU-QZTJIDSGSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[NH2+]CC[C@H]1[C@H](C)CCCN1C(=O)CN(C)C(C)C ZINC001264520856 1316628090 /nfs/dbraw/zinc/62/80/90/1316628090.db2.gz QPERRADJPICJCU-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@H+](C)[C@H]1CCc2ccc(F)cc21)N(C)C ZINC001265061182 1316706940 /nfs/dbraw/zinc/70/69/40/1316706940.db2.gz HEWOQKWICPYVLW-OALUTQOASA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@@H+](C)[C@H]1CCc2ccc(F)cc21)N(C)C ZINC001265061182 1316706942 /nfs/dbraw/zinc/70/69/42/1316706942.db2.gz HEWOQKWICPYVLW-OALUTQOASA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC1(C[NH2+]C/C=C/Cl)CCCC1 ZINC001318632717 1328657296 /nfs/dbraw/zinc/65/72/96/1328657296.db2.gz MTLBJJYDKGSTBN-WCLQSUPFSA-N 1 3 327.900 2.630 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@@H](C)C1)C[C@@H]1CCC(F)(F)C1 ZINC001265133995 1316732106 /nfs/dbraw/zinc/73/21/06/1316732106.db2.gz FPSKANOPTGCQGR-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@@H](C)C1)C[C@@H]1CCC(F)(F)C1 ZINC001265133995 1316732108 /nfs/dbraw/zinc/73/21/08/1316732108.db2.gz FPSKANOPTGCQGR-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001265137293 1316733338 /nfs/dbraw/zinc/73/33/38/1316733338.db2.gz QXIADFGPAWYSHJ-HYWCFLMXSA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001265137293 1316733339 /nfs/dbraw/zinc/73/33/39/1316733339.db2.gz QXIADFGPAWYSHJ-HYWCFLMXSA-N 1 3 327.900 2.584 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NCCCN(CCC(F)(F)F)C1CC1 ZINC001265183707 1316746378 /nfs/dbraw/zinc/74/63/78/1316746378.db2.gz CQDGXFOCKRWIFB-ZIAGYGMSSA-N 1 3 349.441 2.782 10 0 EFAEHO CCCCC[N@@H+]1CCC[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001265224773 1316759212 /nfs/dbraw/zinc/75/92/12/1316759212.db2.gz KCBSOHSOMLXZAU-QFBILLFUSA-N 1 3 341.515 2.970 10 0 EFAEHO CCCCC[N@H+]1CCC[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001265224773 1316759213 /nfs/dbraw/zinc/75/92/13/1316759213.db2.gz KCBSOHSOMLXZAU-QFBILLFUSA-N 1 3 341.515 2.970 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC12CC[NH+](CCCCCF)CC2)C1CCC1 ZINC001265328362 1316783175 /nfs/dbraw/zinc/78/31/75/1316783175.db2.gz ZKGAWOWKTKEOLP-QGZVFWFLSA-N 1 3 339.499 2.581 10 0 EFAEHO CC/C=C/CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[NH+]1CCCCC1 ZINC001265415977 1316802783 /nfs/dbraw/zinc/80/27/83/1316802783.db2.gz JDYNSVFCBMMXNG-HDAKTPJGSA-N 1 3 333.520 2.894 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H]([NH2+]CCCc2cccc(C)c2)C1)N(C)C ZINC001265503466 1316814656 /nfs/dbraw/zinc/81/46/56/1316814656.db2.gz WASPIABSIOSKNK-FHWLQOOXSA-N 1 3 331.504 2.505 10 0 EFAEHO C[C@H](c1ccccc1F)N(C)CCCNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001265848326 1316891252 /nfs/dbraw/zinc/89/12/52/1316891252.db2.gz IKRCEHUEGDNBMS-BFYDXBDKSA-N 1 3 335.467 2.665 10 0 EFAEHO C[C@H](c1ccccc1F)N(C)CCCNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001265848326 1316891254 /nfs/dbraw/zinc/89/12/54/1316891254.db2.gz IKRCEHUEGDNBMS-BFYDXBDKSA-N 1 3 335.467 2.665 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@H+](C)CC[C@H]2CCCC2(F)F)CCC1 ZINC001265862979 1316896138 /nfs/dbraw/zinc/89/61/38/1316896138.db2.gz OMEZVHPJZBQIQU-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@@H+](C)CC[C@H]2CCCC2(F)F)CCC1 ZINC001265862979 1316896140 /nfs/dbraw/zinc/89/61/40/1316896140.db2.gz OMEZVHPJZBQIQU-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)CCCNC(=O)CN(C)C2CCC2)c1 ZINC001265862855 1316896365 /nfs/dbraw/zinc/89/63/65/1316896365.db2.gz JUDYJAVNPLDXEV-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)CCCNC(=O)CN(C)C2CCC2)c1 ZINC001265862855 1316896368 /nfs/dbraw/zinc/89/63/68/1316896368.db2.gz JUDYJAVNPLDXEV-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C)CC1CCC(C)(C)CC1)N(C)C ZINC001265872042 1316898682 /nfs/dbraw/zinc/89/86/82/1316898682.db2.gz MOJCTLYCDPVFCF-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C)CC1CCC(C)(C)CC1)N(C)C ZINC001265872042 1316898683 /nfs/dbraw/zinc/89/86/83/1316898683.db2.gz MOJCTLYCDPVFCF-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)CCCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001265923826 1316915630 /nfs/dbraw/zinc/91/56/30/1316915630.db2.gz WYNZXCHHFVTZJP-IAGOWNOFSA-N 1 3 347.503 2.536 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)CCCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001265923826 1316915632 /nfs/dbraw/zinc/91/56/32/1316915632.db2.gz WYNZXCHHFVTZJP-IAGOWNOFSA-N 1 3 347.503 2.536 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C)Cc1cc(C)sc1C)N(C)C ZINC001265954941 1316927530 /nfs/dbraw/zinc/92/75/30/1316927530.db2.gz XRBZPGCVMVIJRH-MRXNPFEDSA-N 1 3 325.522 2.643 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C)Cc1cc(C)sc1C)N(C)C ZINC001265954941 1316927535 /nfs/dbraw/zinc/92/75/35/1316927535.db2.gz XRBZPGCVMVIJRH-MRXNPFEDSA-N 1 3 325.522 2.643 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](C[NH2+]CCC2=CCCCC2)C1)N(C)C ZINC001265986991 1316939616 /nfs/dbraw/zinc/93/96/16/1316939616.db2.gz QWCZVXAPOUQOQB-MOPGFXCFSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)CC[NH2+]C[C@@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001266015703 1316953954 /nfs/dbraw/zinc/95/39/54/1316953954.db2.gz JRXFVXDMEWOEEU-LPHOPBHVSA-N 1 3 341.515 2.683 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001266049608 1316975935 /nfs/dbraw/zinc/97/59/35/1316975935.db2.gz YBZASIRMHZVCGS-CEUCYRDJSA-N 1 3 341.927 2.974 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001266049608 1316975942 /nfs/dbraw/zinc/97/59/42/1316975942.db2.gz YBZASIRMHZVCGS-CEUCYRDJSA-N 1 3 341.927 2.974 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@H]1CCC[N@@H+]1Cc1ccccc1)N(C)C ZINC001266240891 1317188766 /nfs/dbraw/zinc/18/87/66/1317188766.db2.gz FPKRBFASXJNBPV-RBUKOAKNSA-N 1 3 331.504 2.888 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@H]1CCC[N@H+]1Cc1ccccc1)N(C)C ZINC001266240891 1317188773 /nfs/dbraw/zinc/18/87/73/1317188773.db2.gz FPKRBFASXJNBPV-RBUKOAKNSA-N 1 3 331.504 2.888 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1Cc1cccnc1)N(C)C ZINC001266241018 1317190132 /nfs/dbraw/zinc/19/01/32/1317190132.db2.gz IPENUEZIKYCTRT-RTBURBONSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[C@@H]1CCC[N@H+]1Cc1cccnc1)N(C)C ZINC001266241018 1317190136 /nfs/dbraw/zinc/19/01/36/1317190136.db2.gz IPENUEZIKYCTRT-RTBURBONSA-N 1 3 346.519 2.529 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1CC1CC(F)(F)C1)N(C)C ZINC001266242154 1317191872 /nfs/dbraw/zinc/19/18/72/1317191872.db2.gz ZVCDRIIIACAIRT-CVEARBPZSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@@H]1CCC[N@H+]1CC1CC(F)(F)C1)N(C)C ZINC001266242154 1317191876 /nfs/dbraw/zinc/19/18/76/1317191876.db2.gz ZVCDRIIIACAIRT-CVEARBPZSA-N 1 3 345.478 2.733 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NC[C@H]2CC[C@H](C[NH2+]CCF)CC2)c1 ZINC001279288492 1317227134 /nfs/dbraw/zinc/22/71/34/1317227134.db2.gz HDKWZKFSQDPHOA-QAQDUYKDSA-N 1 3 349.494 2.844 10 0 EFAEHO CCCCCCN(C)CC(=O)N1C[C@@H]2C[N@@H+](CC=C(C)C)C[C@@H]2C1 ZINC001279403473 1317257562 /nfs/dbraw/zinc/25/75/62/1317257562.db2.gz PWLQJWFETHUQDK-KDURUIRLSA-N 1 3 335.536 2.855 10 0 EFAEHO CCCCCCN(C)CC(=O)N1C[C@@H]2C[N@H+](CC=C(C)C)C[C@@H]2C1 ZINC001279403473 1317257566 /nfs/dbraw/zinc/25/75/66/1317257566.db2.gz PWLQJWFETHUQDK-KDURUIRLSA-N 1 3 335.536 2.855 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@H+](CCCC2CCC2)CC1)C1CCC1 ZINC001279573331 1317305677 /nfs/dbraw/zinc/30/56/77/1317305677.db2.gz CFGZXCYDXDEKOT-UHFFFAOYSA-N 1 3 333.520 2.799 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@@H+](CCCC2CCC2)CC1)C1CCC1 ZINC001279573331 1317305686 /nfs/dbraw/zinc/30/56/86/1317305686.db2.gz CFGZXCYDXDEKOT-UHFFFAOYSA-N 1 3 333.520 2.799 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1CC=C(CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001279637587 1317343384 /nfs/dbraw/zinc/34/33/84/1317343384.db2.gz ZCGVSOFYYGRQBG-ROUUACIJSA-N 1 3 335.536 2.759 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1CC=C(CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001279637587 1317343393 /nfs/dbraw/zinc/34/33/93/1317343393.db2.gz ZCGVSOFYYGRQBG-ROUUACIJSA-N 1 3 335.536 2.759 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H](CC[NH2+]CC=C(Cl)Cl)C1 ZINC001318777744 1328697268 /nfs/dbraw/zinc/69/72/68/1328697268.db2.gz CNWCRDYPUONKAT-KGLIPLIRSA-N 1 3 348.318 2.618 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]C/C=C/c2ccccc2)C1 ZINC001280152274 1317464799 /nfs/dbraw/zinc/46/47/99/1317464799.db2.gz KMDFBKLFVSPJST-WWUOSCAMSA-N 1 3 341.499 2.622 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@H]1CCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001280198669 1317474046 /nfs/dbraw/zinc/47/40/46/1317474046.db2.gz VIFDKFMKTMDBNK-HKUYNNGSSA-N 1 3 343.515 2.665 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H](CC[NH2+]CC2CCCC2)C1)N(C)C ZINC001318848294 1328720677 /nfs/dbraw/zinc/72/06/77/1328720677.db2.gz DYZLDSZUOZNDNI-RTBURBONSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](CC[NH2+]CCc2ccccc2)C1 ZINC001318860308 1328725831 /nfs/dbraw/zinc/72/58/31/1328725831.db2.gz NHXQTQXSPUWPHX-HXUWFJFHSA-N 1 3 345.531 2.788 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](CC[NH2+]CCc2ccccc2)C1 ZINC001318860306 1328725940 /nfs/dbraw/zinc/72/59/40/1328725940.db2.gz NHXQTQXSPUWPHX-FQEVSTJZSA-N 1 3 345.531 2.788 10 0 EFAEHO CCCCCN1Cc2ccc(CNC(=O)C34CC[NH+](CC3)C4)cc2C1 ZINC001281297624 1318154099 /nfs/dbraw/zinc/15/40/99/1318154099.db2.gz CHWDOXSSZXRGKY-UHFFFAOYSA-N 1 3 341.499 2.904 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N[C@H]2CC[C@H]([NH2+]CCCF)CC2)C1 ZINC001318976264 1328753750 /nfs/dbraw/zinc/75/37/50/1328753750.db2.gz MRJHHNDIIPYRCC-IIDMSEBBSA-N 1 3 345.478 2.576 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N[C@H]2CC[C@H]([NH2+]CCCF)CC2)C1 ZINC001318976265 1328753776 /nfs/dbraw/zinc/75/37/76/1328753776.db2.gz MRJHHNDIIPYRCC-MPGHIAIKSA-N 1 3 345.478 2.576 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H]([NH2+]CCCc2cccc(C)c2)C1 ZINC001281459021 1318329329 /nfs/dbraw/zinc/32/93/29/1318329329.db2.gz RMPNTKWIMHKFFY-QUCCMNQESA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CCCCCF)CC1(C)C ZINC001281566097 1318464783 /nfs/dbraw/zinc/46/47/83/1318464783.db2.gz DOXKTWYEAGWCKJ-INIZCTEOSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CCCCCF)CC1(C)C ZINC001281566097 1318464787 /nfs/dbraw/zinc/46/47/87/1318464787.db2.gz DOXKTWYEAGWCKJ-INIZCTEOSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1CCCCCF ZINC001281666365 1318533140 /nfs/dbraw/zinc/53/31/40/1318533140.db2.gz XKFKVRPBLIBKOE-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)CC[N@H+]1CCCCCF ZINC001281666365 1318533147 /nfs/dbraw/zinc/53/31/47/1318533147.db2.gz XKFKVRPBLIBKOE-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1Cc2ccccc2[C@H]1NCC=C(C)C ZINC001281912200 1318621474 /nfs/dbraw/zinc/62/14/74/1318621474.db2.gz GZGYVGOADGVKMR-UYAOXDASSA-N 1 3 329.488 2.666 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1Cc2ccccc2[C@H]1NCC=C(C)C ZINC001281912200 1318621486 /nfs/dbraw/zinc/62/14/86/1318621486.db2.gz GZGYVGOADGVKMR-UYAOXDASSA-N 1 3 329.488 2.666 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@@]2(C)CN(C(=O)[C@H](CC)N(C)C)C[C@@]2(C)C1 ZINC001282992864 1319243401 /nfs/dbraw/zinc/24/34/01/1319243401.db2.gz QQHXPDCVCDESNN-YIEILZMLSA-N 1 3 335.536 2.853 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@@]2(C)CN(C(=O)[C@H](CC)N(C)C)C[C@@]2(C)C1 ZINC001282992864 1319243411 /nfs/dbraw/zinc/24/34/11/1319243411.db2.gz QQHXPDCVCDESNN-YIEILZMLSA-N 1 3 335.536 2.853 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@H](C[NH2+]CCc2cccs2)C1 ZINC001283110820 1319336357 /nfs/dbraw/zinc/33/63/57/1319336357.db2.gz IZSIMKCGQVTMJK-DSPLQEQRSA-N 1 3 349.544 2.648 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@@H](C)C[NH2+]CC=C(Cl)Cl ZINC001319284163 1328832578 /nfs/dbraw/zinc/83/25/78/1328832578.db2.gz FKCHSDKXRWUGST-QWHCGFSZSA-N 1 3 336.307 2.522 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCCCCF ZINC001283681121 1319954566 /nfs/dbraw/zinc/95/45/66/1319954566.db2.gz WIOMNDPFOYZQRJ-CRAIPNDOSA-N 1 3 347.494 2.775 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001283681157 1319955061 /nfs/dbraw/zinc/95/50/61/1319955061.db2.gz WPVLXSFQSFJOPE-RTBURBONSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CCCCc2ccccc2)CN1C(=O)Cc1c[nH]cn1 ZINC001284015397 1320147659 /nfs/dbraw/zinc/14/76/59/1320147659.db2.gz RSNFBWUUKGIDSW-LPHOPBHVSA-N 1 3 340.471 2.554 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CCCCc2ccccc2)CN1C(=O)Cc1c[nH]cn1 ZINC001284015395 1320148088 /nfs/dbraw/zinc/14/80/88/1320148088.db2.gz RSNFBWUUKGIDSW-APWZRJJASA-N 1 3 340.471 2.554 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1C[C@@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001284033092 1320157990 /nfs/dbraw/zinc/15/79/90/1320157990.db2.gz NPSDYIPPNYCTPS-QUCCMNQESA-N 1 3 345.531 2.847 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]CCCC(C)(C)C)C(C)(C)C1 ZINC001284349608 1320331312 /nfs/dbraw/zinc/33/13/12/1320331312.db2.gz QOZBHUWOBSQWAA-INIZCTEOSA-N 1 3 325.541 2.980 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+]CCC(F)(F)F)C(C)(C)C)CCC1 ZINC001284597004 1320430592 /nfs/dbraw/zinc/43/05/92/1320430592.db2.gz DRDMNWKNICNBRK-GFCCVEGCSA-N 1 3 337.430 2.544 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+](CCC2=CCCCC2)CC1)N(C)C ZINC001284929481 1320601758 /nfs/dbraw/zinc/60/17/58/1320601758.db2.gz LZHICYRHMXPISZ-LJQANCHMSA-N 1 3 333.520 2.965 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+](CCC2=CCCCC2)CC1)N(C)C ZINC001284929481 1320601761 /nfs/dbraw/zinc/60/17/61/1320601761.db2.gz LZHICYRHMXPISZ-LJQANCHMSA-N 1 3 333.520 2.965 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C[NH2+]CCF)C1CCCCC1 ZINC001319662269 1328942810 /nfs/dbraw/zinc/94/28/10/1328942810.db2.gz IGZGHKZHXLNEAN-ZWKOTPCHSA-N 1 3 341.515 2.874 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H](C[NH2+]CCF)C2CCCCC2)c1 ZINC001319668779 1328945561 /nfs/dbraw/zinc/94/55/61/1328945561.db2.gz LIYVDBXCURJNMW-LJQANCHMSA-N 1 3 349.494 2.986 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]CC1CC(C)(C)C1 ZINC001319735963 1328968324 /nfs/dbraw/zinc/96/83/24/1328968324.db2.gz LGVGDYWSVPGYHY-MSOLQXFVSA-N 1 3 335.536 2.878 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@H]1CC[NH2+]CCCCCF ZINC001319735200 1328968473 /nfs/dbraw/zinc/96/84/73/1328968473.db2.gz CALORWNBQCACSF-IRXDYDNUSA-N 1 3 327.488 2.581 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]CCc1ccccc1 ZINC001319770558 1328983748 /nfs/dbraw/zinc/98/37/48/1328983748.db2.gz UCDDBPXAURTCJR-WOJBJXKFSA-N 1 3 343.515 2.684 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@H]1CC[NH2+]Cc1cnccc1C)N(C)C ZINC001319789008 1328989880 /nfs/dbraw/zinc/98/98/80/1328989880.db2.gz VYDHPTIGJUYCFG-OALUTQOASA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@H]1CCCN(C(=O)CC[N@H+](C)C2CCCCC2)[C@@H]1CNCCF ZINC001319854197 1329016064 /nfs/dbraw/zinc/01/60/64/1329016064.db2.gz PVJVQYSMDZENOP-FUHWJXTLSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H]1CCCN(C(=O)CC[N@@H+](C)C2CCCCC2)[C@@H]1CNCCF ZINC001319854197 1329016067 /nfs/dbraw/zinc/01/60/67/1329016067.db2.gz PVJVQYSMDZENOP-FUHWJXTLSA-N 1 3 341.515 2.827 10 0 EFAEHO CN(CCN(C)C(=O)C1CC[NH+](CC2CC2)CC1)CC1=CCCCC1 ZINC001320069582 1329069855 /nfs/dbraw/zinc/06/98/55/1329069855.db2.gz YXYZOWFEGPFDHW-UHFFFAOYSA-N 1 3 347.547 2.999 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@H]2CN(C(=O)CN(C)C3CCC3)CC[C@H]21 ZINC001320105262 1329081123 /nfs/dbraw/zinc/08/11/23/1329081123.db2.gz XSNQHLWKFRXFIL-PKOBYXMFSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCCCC[N@H+]1CC[C@H]2CN(C(=O)CN(C)C3CCC3)CC[C@H]21 ZINC001320105262 1329081126 /nfs/dbraw/zinc/08/11/26/1329081126.db2.gz XSNQHLWKFRXFIL-PKOBYXMFSA-N 1 3 335.536 2.974 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)[C@H]2CCCC[N@@H+]2C(C)C)c1 ZINC001491600747 1323739464 /nfs/dbraw/zinc/73/94/64/1323739464.db2.gz GZGSNWHHPNMJCF-VQIMIIECSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)[C@H]2CCCC[N@H+]2C(C)C)c1 ZINC001491600747 1323739467 /nfs/dbraw/zinc/73/94/67/1323739467.db2.gz GZGSNWHHPNMJCF-VQIMIIECSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001492034739 1324194527 /nfs/dbraw/zinc/19/45/27/1324194527.db2.gz MUBJFBCNODDPTC-CRAIPNDOSA-N 1 3 329.488 2.643 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)C23CCC[NH+](CCC2)C3)c1 ZINC001492299127 1324439163 /nfs/dbraw/zinc/43/91/63/1324439163.db2.gz RBBWGNDGWYLKBV-UHFFFAOYSA-N 1 3 343.515 2.727 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)C(C)(C)[NH+]2CCCC2)cc1C ZINC001492370445 1324459455 /nfs/dbraw/zinc/45/94/55/1324459455.db2.gz USWBXOFYSYNZEQ-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO C[C@H](CC[NH2+]Cc1cccc(Cl)c1)NC(=O)CN1CC[C@@H](C)C1 ZINC001320551020 1329160222 /nfs/dbraw/zinc/16/02/22/1329160222.db2.gz ZFOZVZIKGZEDSD-HUUCEWRRSA-N 1 3 337.895 2.666 10 0 EFAEHO Cc1cc(C[N@@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C)c(C)s1 ZINC001316846185 1324684613 /nfs/dbraw/zinc/68/46/13/1324684613.db2.gz CJOFUMJYTXESBY-QGZVFWFLSA-N 1 3 339.549 2.889 10 0 EFAEHO Cc1cc(C[N@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C)c(C)s1 ZINC001316846185 1324684615 /nfs/dbraw/zinc/68/46/15/1324684615.db2.gz CJOFUMJYTXESBY-QGZVFWFLSA-N 1 3 339.549 2.889 10 0 EFAEHO Cc1ccc(CN(C)CCCNC(=O)[C@@H]2CCC[N@H+]2C(C)C)c(C)n1 ZINC001316826204 1325179813 /nfs/dbraw/zinc/17/98/13/1325179813.db2.gz YZNOXPBMMCUZGL-IBGZPJMESA-N 1 3 346.519 2.509 10 0 EFAEHO Cc1ccc(CN(C)CCCNC(=O)[C@@H]2CCC[N@@H+]2C(C)C)c(C)n1 ZINC001316826204 1325179818 /nfs/dbraw/zinc/17/98/18/1325179818.db2.gz YZNOXPBMMCUZGL-IBGZPJMESA-N 1 3 346.519 2.509 10 0 EFAEHO CC/C=C\CC[N@H+](C)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001316850636 1325219416 /nfs/dbraw/zinc/21/94/16/1325219416.db2.gz GRQVOEJMTITIFM-QULHZPMSSA-N 1 3 341.515 2.993 10 0 EFAEHO CC/C=C\CC[N@@H+](C)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001316850636 1325219421 /nfs/dbraw/zinc/21/94/21/1325219421.db2.gz GRQVOEJMTITIFM-QULHZPMSSA-N 1 3 341.515 2.993 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](C)CC[C@@H]2CCCC2(F)F)C1 ZINC001316851371 1325221926 /nfs/dbraw/zinc/22/19/26/1325221926.db2.gz VWOLBXLPWRDWNZ-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](C)CC[C@@H]2CCCC2(F)F)C1 ZINC001316851371 1325221932 /nfs/dbraw/zinc/22/19/32/1325221932.db2.gz VWOLBXLPWRDWNZ-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](C)CC[C@H]2CCCC2(F)F)C1 ZINC001316851374 1325223082 /nfs/dbraw/zinc/22/30/82/1325223082.db2.gz VWOLBXLPWRDWNZ-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](C)CC[C@H]2CCCC2(F)F)C1 ZINC001316851374 1325223091 /nfs/dbraw/zinc/22/30/91/1325223091.db2.gz VWOLBXLPWRDWNZ-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[C@H](c1ccccc1)[N@H+](C)CCCNC(=O)Cc1nc[nH]c1C ZINC001316865043 1325233143 /nfs/dbraw/zinc/23/31/43/1325233143.db2.gz QBKSTGPNLRZYDQ-GOSISDBHSA-N 1 3 328.460 2.850 10 0 EFAEHO CC[C@H](c1ccccc1)[N@@H+](C)CCCNC(=O)Cc1nc[nH]c1C ZINC001316865043 1325233151 /nfs/dbraw/zinc/23/31/51/1325233151.db2.gz QBKSTGPNLRZYDQ-GOSISDBHSA-N 1 3 328.460 2.850 10 0 EFAEHO CC[N@H+](CCCNC(=O)Cc1nc[nH]c1C)CC1CC2(CCC2)C1 ZINC001316905845 1325314077 /nfs/dbraw/zinc/31/40/77/1325314077.db2.gz JVOLGJRNFTWLLS-UHFFFAOYSA-N 1 3 332.492 2.669 10 0 EFAEHO CC[N@@H+](CCCNC(=O)Cc1nc[nH]c1C)CC1CC2(CCC2)C1 ZINC001316905845 1325314086 /nfs/dbraw/zinc/31/40/86/1325314086.db2.gz JVOLGJRNFTWLLS-UHFFFAOYSA-N 1 3 332.492 2.669 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](CC)Cc1cccnc1C ZINC001316910678 1325327447 /nfs/dbraw/zinc/32/74/47/1325327447.db2.gz GGIYPNAIXAPNPB-IBGZPJMESA-N 1 3 346.519 2.593 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](CC)Cc1cccnc1C ZINC001316910678 1325327454 /nfs/dbraw/zinc/32/74/54/1325327454.db2.gz GGIYPNAIXAPNPB-IBGZPJMESA-N 1 3 346.519 2.593 10 0 EFAEHO Cc1cc(C[N@@H+](CCCNC(=O)CN2CC[C@@H](C)C2)C2CC2)cs1 ZINC001316924510 1325363269 /nfs/dbraw/zinc/36/32/69/1325363269.db2.gz UPIWJVGYJNWTTP-OAHLLOKOSA-N 1 3 349.544 2.869 10 0 EFAEHO Cc1cc(C[N@H+](CCCNC(=O)CN2CC[C@@H](C)C2)C2CC2)cs1 ZINC001316924510 1325363274 /nfs/dbraw/zinc/36/32/74/1325363274.db2.gz UPIWJVGYJNWTTP-OAHLLOKOSA-N 1 3 349.544 2.869 10 0 EFAEHO CC/C=C\CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001317047209 1325516825 /nfs/dbraw/zinc/51/68/25/1325516825.db2.gz LFBWAAUICPJKKD-KSULIHCOSA-N 1 3 333.520 2.892 10 0 EFAEHO CC/C=C\CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[C@H]1CCC[N@H+]1C ZINC001317047209 1325516831 /nfs/dbraw/zinc/51/68/31/1325516831.db2.gz LFBWAAUICPJKKD-KSULIHCOSA-N 1 3 333.520 2.892 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@H]([NH2+]CCCc2ccsc2)C1 ZINC001317069945 1325540208 /nfs/dbraw/zinc/54/02/08/1325540208.db2.gz VATUXXPGURRBPK-ZWKOTPCHSA-N 1 3 349.544 2.746 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001317094294 1325557091 /nfs/dbraw/zinc/55/70/91/1325557091.db2.gz ZMNOHLQUJUXRGA-WGSAOQKQSA-N 1 3 331.504 2.505 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]CCCc2cccc(F)c2)C1)N(C)C ZINC001317119472 1325588157 /nfs/dbraw/zinc/58/81/57/1325588157.db2.gz RHWWRMPTWXDWSN-CEXWTWQISA-N 1 3 349.494 2.581 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC/C=C/CNCc1csc(C)c1 ZINC001321086140 1329341343 /nfs/dbraw/zinc/34/13/43/1329341343.db2.gz YUTSLCZOEDVNJN-LAQIPUCWSA-N 1 3 335.517 2.693 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC/C=C/CNCc1csc(C)c1 ZINC001321086140 1329341344 /nfs/dbraw/zinc/34/13/44/1329341344.db2.gz YUTSLCZOEDVNJN-LAQIPUCWSA-N 1 3 335.517 2.693 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)CC[C@H]2CCC[N@H+]2C)cs1 ZINC001321096493 1329342889 /nfs/dbraw/zinc/34/28/89/1329342889.db2.gz IKLDQWQAXWDFDY-CWIOURORSA-N 1 3 335.517 2.693 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)CC[C@H]2CCC[N@@H+]2C)cs1 ZINC001321096493 1329342891 /nfs/dbraw/zinc/34/28/91/1329342891.db2.gz IKLDQWQAXWDFDY-CWIOURORSA-N 1 3 335.517 2.693 10 0 EFAEHO O=C(NC/C=C\CNCc1ccc(CF)cc1)C12CCC[NH+]1CCC2 ZINC001321138099 1329347690 /nfs/dbraw/zinc/34/76/90/1329347690.db2.gz YEFGXFRXTQLHRU-UPHRSURJSA-N 1 3 345.462 2.547 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C\CNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001321187789 1329354119 /nfs/dbraw/zinc/35/41/19/1329354119.db2.gz WSSAJWXVWJJADS-PLNGDYQASA-N 1 3 347.478 2.771 10 0 EFAEHO CC(C)(C(=O)NC/C=C\CNCc1ccc(Cl)cc1)[NH+]1CCCC1 ZINC001321185908 1329353755 /nfs/dbraw/zinc/35/37/55/1329353755.db2.gz LLBZMKMMZSQXCB-ARJAWSKDSA-N 1 3 349.906 2.976 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H](C[NH2+]CCc2ccccc2F)C1)N(C)C ZINC001317157696 1327652985 /nfs/dbraw/zinc/65/29/85/1327652985.db2.gz LABYYVMJEYOPGH-APWZRJJASA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@@H](NC/C=C\CNC(=O)CC1CC[NH+](C)CC1)c1ccc(F)cc1 ZINC001321279319 1329367167 /nfs/dbraw/zinc/36/71/67/1329367167.db2.gz IRGWFIDNKNLNOO-MJSXRHKHSA-N 1 3 347.478 2.881 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C/CNC(=O)CN2CCC(C)CC2)cc1C ZINC001321301551 1329370018 /nfs/dbraw/zinc/37/00/18/1329370018.db2.gz BGAKLVNLCSVTKM-SNAWJCMRSA-N 1 3 343.515 2.797 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C/C=C/CNC(=O)CN2CCC(C)CC2)c1 ZINC001321304022 1329370492 /nfs/dbraw/zinc/37/04/92/1329370492.db2.gz LBFPOFWUYXBQEU-SNAWJCMRSA-N 1 3 343.515 2.797 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\C[NH2+][C@@H]1CCc2ccc(F)cc21)N(C)C ZINC001321350356 1329375706 /nfs/dbraw/zinc/37/57/06/1329375706.db2.gz NKSAAXGWKJZHDY-CQQBRXBZSA-N 1 3 347.478 2.661 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/CN[C@@H](C)c1cccc(F)c1)[NH+](C)C ZINC001321351608 1329376333 /nfs/dbraw/zinc/37/63/33/1329376333.db2.gz XIOOWNBFFHJFTR-MLCBILRFSA-N 1 3 335.467 2.735 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC/C=C/C[NH2+]CCC1CCCCCC1 ZINC001321363067 1329377367 /nfs/dbraw/zinc/37/73/67/1329377367.db2.gz KJMHTFOHPOVLNA-VOTSOKGWSA-N 1 3 332.492 2.883 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](C[NH2+]CCC2CCCCCC2)C1 ZINC001317332321 1327862662 /nfs/dbraw/zinc/86/26/62/1327862662.db2.gz YJAZSQWGSLBNSU-RTBURBONSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](C[NH2+]CCCc2cccc(C)c2)C1)N(C)C ZINC001317337260 1327866628 /nfs/dbraw/zinc/86/66/28/1327866628.db2.gz KJXRZSKZFBQVBX-UXHICEINSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[NH2+]CCCc2ccc(C)cc2)C1)N(C)C ZINC001317344423 1327874665 /nfs/dbraw/zinc/87/46/65/1327874665.db2.gz RPOGOWFFVCPTSS-VQTJNVASSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@H](NC/C=C/CNC(=O)[C@@H]1CC[N@H+](C)C1)c1ccc(Cl)cc1 ZINC001321404549 1329383261 /nfs/dbraw/zinc/38/32/61/1329383261.db2.gz RKCSGAVELSFPGJ-AIROSISHSA-N 1 3 335.879 2.615 10 0 EFAEHO C[C@H](NC/C=C/CNC(=O)[C@@H]1CC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC001321404549 1329383264 /nfs/dbraw/zinc/38/32/64/1329383264.db2.gz RKCSGAVELSFPGJ-AIROSISHSA-N 1 3 335.879 2.615 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C/CNC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C ZINC001321417786 1329384182 /nfs/dbraw/zinc/38/41/82/1329384182.db2.gz VDRQYFAQRNZGHF-PSUYNTKASA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C/CNC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001321417786 1329384184 /nfs/dbraw/zinc/38/41/84/1329384184.db2.gz VDRQYFAQRNZGHF-PSUYNTKASA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1cccnc1C[N@H+]1CCC[C@@H]1CCCNC(=O)CN(C)C(C)C ZINC001317435862 1328023105 /nfs/dbraw/zinc/02/31/05/1328023105.db2.gz VQDYAUWYKJLBFU-SFHVURJKSA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1cccnc1C[N@@H+]1CCC[C@@H]1CCCNC(=O)CN(C)C(C)C ZINC001317435862 1328023116 /nfs/dbraw/zinc/02/31/16/1328023116.db2.gz VQDYAUWYKJLBFU-SFHVURJKSA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCN(CC2=CCCCC2)C2CC2)CC[N@@H+]1C ZINC001317555693 1328142236 /nfs/dbraw/zinc/14/22/36/1328142236.db2.gz UXQLBLNPYXMZRP-WMZOPIPTSA-N 1 3 333.520 2.798 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCN(CC2=CCCCC2)C2CC2)CC[N@H+]1C ZINC001317555693 1328142242 /nfs/dbraw/zinc/14/22/42/1328142242.db2.gz UXQLBLNPYXMZRP-WMZOPIPTSA-N 1 3 333.520 2.798 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+]Cc2ccc(C3CC3)cc2)CCC1 ZINC001317595453 1328174412 /nfs/dbraw/zinc/17/44/12/1328174412.db2.gz COHBDFRNTACVHO-UHFFFAOYSA-N 1 3 329.488 2.596 10 0 EFAEHO CN(CC[NH2+]C/C=C\c1ccc(Cl)cc1)C(=O)CN(C)C1CCC1 ZINC001317595444 1328174913 /nfs/dbraw/zinc/17/49/13/1328174913.db2.gz CCAUZEWTFHYQHK-PLNGDYQASA-N 1 3 349.906 2.886 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]CC[C@@H]1CCCC1(F)F ZINC001317662844 1328253811 /nfs/dbraw/zinc/25/38/11/1328253811.db2.gz ABNXPXVNWUNTGM-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]C/C=C\c1ccccc1 ZINC001321755731 1329406819 /nfs/dbraw/zinc/40/68/19/1329406819.db2.gz DYIZRRYGBLYCFW-MJWVEZKKSA-N 1 3 329.488 2.669 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]C/C=C/c1ccccc1 ZINC001321755532 1329407069 /nfs/dbraw/zinc/40/70/69/1329407069.db2.gz DYIZRRYGBLYCFW-FDRWKTFPSA-N 1 3 329.488 2.669 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](Cc1cccc(C)c1)C(C)C ZINC001317709935 1328317352 /nfs/dbraw/zinc/31/73/52/1328317352.db2.gz VZQOVKIPYNIIKB-UHFFFAOYSA-N 1 3 342.487 2.986 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](Cc1cccc(C)c1)C(C)C ZINC001317709935 1328317359 /nfs/dbraw/zinc/31/73/59/1328317359.db2.gz VZQOVKIPYNIIKB-UHFFFAOYSA-N 1 3 342.487 2.986 10 0 EFAEHO CC(C)=CCN[C@H](CNC(=O)[C@H]1C[NH+]2CCC1CC2)c1ccccc1 ZINC001317718347 1328327142 /nfs/dbraw/zinc/32/71/42/1328327142.db2.gz NDMOCGVFXAGSAA-VQTJNVASSA-N 1 3 341.499 2.742 10 0 EFAEHO CC(C)=CCN[C@H](CNC(=O)[C@@H]1C[NH+]2CCC1CC2)c1ccccc1 ZINC001317718348 1328328105 /nfs/dbraw/zinc/32/81/05/1328328105.db2.gz NDMOCGVFXAGSAA-WOJBJXKFSA-N 1 3 341.499 2.742 10 0 EFAEHO Cc1ccccc1[C@@H](C)N1CC(CNC(=O)CCCC[NH+](C)C)C1 ZINC001318168280 1328510708 /nfs/dbraw/zinc/51/07/08/1328510708.db2.gz BYUBKBCBVJVQQV-QGZVFWFLSA-N 1 3 331.504 2.836 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)CN(C)C1CCC1)c1ccccc1F ZINC001322544619 1329466506 /nfs/dbraw/zinc/46/65/06/1329466506.db2.gz WXOGJMLOCVYCMG-HNNXBMFYSA-N 1 3 335.467 2.809 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+][C@@H]1CCc2c1cccc2F)N(C)C ZINC001322565717 1329467963 /nfs/dbraw/zinc/46/79/63/1329467963.db2.gz HDCYHVZRBGCKLN-QZTJIDSGSA-N 1 3 335.467 2.591 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)[C@H]1CCCN1C)c1ccc2c(c1)CCC2 ZINC001322647566 1329475369 /nfs/dbraw/zinc/47/53/69/1329475369.db2.gz CZECVHWXDAZVDB-OXQOHEQNSA-N 1 3 343.515 2.769 10 0 EFAEHO CC[C@H](C)C[NH2+]CCCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001322695108 1329480515 /nfs/dbraw/zinc/48/05/15/1329480515.db2.gz WPLGXJRQMNWREV-MAUKXSAKSA-N 1 3 329.504 2.683 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]CCCN(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001322694800 1329480612 /nfs/dbraw/zinc/48/06/12/1329480612.db2.gz VKYYUCIJGBAXIP-DLBZAZTESA-N 1 3 347.503 2.536 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)CN1CCCC1)c1ccc(Cl)cc1 ZINC001322834759 1329492462 /nfs/dbraw/zinc/49/24/62/1329492462.db2.gz HMNQMJMXHSDLTP-HNNXBMFYSA-N 1 3 337.895 2.935 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(F)cc1Cl)C(=O)CN1CCCC1 ZINC001322835857 1329493080 /nfs/dbraw/zinc/49/30/80/1329493080.db2.gz OWEALEXMHAGXTG-UHFFFAOYSA-N 1 3 341.858 2.513 10 0 EFAEHO Cc1ccncc1CN(C)CCCN(C)C(=O)C[NH+]1[C@H](C)CC[C@H]1C ZINC001380990951 1348010488 /nfs/dbraw/zinc/01/04/88/1348010488.db2.gz WDUGCPZIOKBHNN-QZTJIDSGSA-N 1 3 346.519 2.543 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]([C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001380991917 1348010557 /nfs/dbraw/zinc/01/05/57/1348010557.db2.gz ZBBHWLGRFAGCNJ-RTBURBONSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]([C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001380991917 1348010560 /nfs/dbraw/zinc/01/05/60/1348010560.db2.gz ZBBHWLGRFAGCNJ-RTBURBONSA-N 1 3 337.552 2.933 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(CCN(C(=O)CN3CC[C@H](C)C3)C2)CC1 ZINC001323832769 1329576330 /nfs/dbraw/zinc/57/63/30/1329576330.db2.gz RJFLJNMAVUHHEP-HMECNJMJSA-N 1 3 347.547 2.999 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CCCc2ccccc2)C[C@@H]1C ZINC001324096594 1329599306 /nfs/dbraw/zinc/59/93/06/1329599306.db2.gz CWSHSPMYHIPZLI-ICSRJNTNSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001325665051 1329704908 /nfs/dbraw/zinc/70/49/08/1329704908.db2.gz HRHJZYRGXXCKAB-GUDVDZBRSA-N 1 3 337.552 2.887 10 0 EFAEHO CCC[NH2+]CCN(Cc1ccccc1)C(=O)[C@H]1CCCN1C(C)C ZINC001325690680 1329706617 /nfs/dbraw/zinc/70/66/17/1329706617.db2.gz VLLHIDJJDUJVPX-LJQANCHMSA-N 1 3 331.504 2.888 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1CC[C@H](C[NH2+]CC[C@H](C)F)CC1 ZINC001326512881 1330308981 /nfs/dbraw/zinc/30/89/81/1330308981.db2.gz OPDXFDUMHUWESE-XSLAGTTESA-N 1 3 341.515 2.872 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@@H]1C[NH2+]CCCc1ccccc1)N(C)C ZINC001326723692 1330354308 /nfs/dbraw/zinc/35/43/08/1330354308.db2.gz VZQGTSURCXMTCT-WOJBJXKFSA-N 1 3 345.531 2.930 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCCC[C@@H]2C[NH2+]CCCC2CCC2)C1 ZINC001326736733 1330356496 /nfs/dbraw/zinc/35/64/96/1330356496.db2.gz XIURFQGWECLAIX-PKOBYXMFSA-N 1 3 335.536 2.879 10 0 EFAEHO CN(Cc1cccc(F)c1)C[C@H]1CCCN1C(=O)CCCC[NH+](C)C ZINC001328787214 1330632561 /nfs/dbraw/zinc/63/25/61/1330632561.db2.gz UDALMYROEPRPIC-LJQANCHMSA-N 1 3 349.494 2.980 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1CC(C[NH2+]CCCC2CCCC2)C1 ZINC001328949413 1330649554 /nfs/dbraw/zinc/64/95/54/1330649554.db2.gz FWXURLCZQLBCAR-UHFFFAOYSA-N 1 3 332.492 2.715 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]CCCCC(F)(F)F ZINC001329053121 1330661359 /nfs/dbraw/zinc/66/13/59/1330661359.db2.gz HGEXCONNOLNTKZ-STQMWFEESA-N 1 3 337.430 2.686 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H](C)[NH2+]CC/C=C\c1ccccc1 ZINC001329173115 1330676615 /nfs/dbraw/zinc/67/66/15/1330676615.db2.gz PJUQXFGISYKJIT-ZTUZZKEQSA-N 1 3 340.471 2.847 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+]Cc1ccc(F)cc1C ZINC001330969119 1330777086 /nfs/dbraw/zinc/77/70/86/1330777086.db2.gz CDOKUPJKZTXTAA-CQSZACIVSA-N 1 3 346.450 2.783 10 0 EFAEHO CC(C)[NH2+]CCC[C@H](NC(=O)CN1CC[C@@H](C)C1)c1ccccc1 ZINC001331176040 1330802168 /nfs/dbraw/zinc/80/21/68/1330802168.db2.gz FYUHZWAMAUDSND-MJGOQNOKSA-N 1 3 331.504 2.964 10 0 EFAEHO CC(C)[NH2+]CCC[C@@H](NC(=O)CN1CC[C@H](C)C1)c1ccccc1 ZINC001331176041 1330802442 /nfs/dbraw/zinc/80/24/42/1330802442.db2.gz FYUHZWAMAUDSND-PKOBYXMFSA-N 1 3 331.504 2.964 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCCCc2ccccc2)[C@H]1C ZINC001331944677 1330895589 /nfs/dbraw/zinc/89/55/89/1330895589.db2.gz SWEGOSRXKGJVSR-UYAOXDASSA-N 1 3 345.531 2.929 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2C[C@@H](C)N(C(=O)CN3CCCC3)C2)cc1 ZINC001332046417 1330909105 /nfs/dbraw/zinc/90/91/05/1330909105.db2.gz GWQHRQAKFKWRKU-QUCCMNQESA-N 1 3 343.515 2.602 10 0 EFAEHO CC(C)[C@@H](C(=O)N1C[C@@H]([NH2+]CCCCCF)C(C)(C)C1)N(C)C ZINC001332386901 1330966346 /nfs/dbraw/zinc/96/63/46/1330966346.db2.gz HSWXSIHUCCJVDO-CVEARBPZSA-N 1 3 329.504 2.539 10 0 EFAEHO CCC/C=C/CC[NH2+][C@@H]1CN(C(=O)CN2CC[C@H](C)C2)CC1(C)C ZINC001332422097 1330970063 /nfs/dbraw/zinc/97/00/63/1330970063.db2.gz GHLCLJWJEKPNQU-KBSZCIAZSA-N 1 3 335.536 2.901 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2C[C@@H]([NH2+]CCCC(C)(C)C)C(C)(C)C2)C1 ZINC001332422451 1330970232 /nfs/dbraw/zinc/97/02/32/1330970232.db2.gz ILOJCSCTVMNPQY-DLBZAZTESA-N 1 3 337.552 2.981 10 0 EFAEHO CN(C(=O)[C@H]1CCCN1C)C1CC([NH2+]CCCCc2ccccc2)C1 ZINC001333103604 1331079043 /nfs/dbraw/zinc/07/90/43/1331079043.db2.gz ZMUOMVJRVWBREG-SOAGJPPSSA-N 1 3 343.515 2.683 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1CC=C(CNC(=O)CN(C)C2CCC2)CC1 ZINC001333354369 1331124644 /nfs/dbraw/zinc/12/46/44/1331124644.db2.gz HRXNHYZBZIHMKI-QGZVFWFLSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1CC=C(CNC(=O)CN(C)C2CCC2)CC1 ZINC001333354369 1331124649 /nfs/dbraw/zinc/12/46/49/1331124649.db2.gz HRXNHYZBZIHMKI-QGZVFWFLSA-N 1 3 335.536 2.901 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](NCCSc2ccncc2)[C@@H](C)C1 ZINC001335813719 1331405614 /nfs/dbraw/zinc/40/56/14/1331405614.db2.gz KEOGIEMAPBWMHA-FUHWJXTLSA-N 1 3 337.533 2.900 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](NCCSc2ccncc2)[C@@H](C)C1 ZINC001335813719 1331405616 /nfs/dbraw/zinc/40/56/16/1331405616.db2.gz KEOGIEMAPBWMHA-FUHWJXTLSA-N 1 3 337.533 2.900 10 0 EFAEHO C[C@H]([NH2+]C[C@@H]1CCC[C@@]2(CCOC2)O1)[C@@H]1CCCN(C2CCC2)C1 ZINC001413982895 1335384011 /nfs/dbraw/zinc/38/40/11/1335384011.db2.gz MZQDSSROAPWDJC-HNJRGHQBSA-N 1 3 336.520 2.957 10 0 EFAEHO C[C@H](NC[C@@H]1CCC[C@@]2(CCOC2)O1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001413982895 1335384012 /nfs/dbraw/zinc/38/40/12/1335384012.db2.gz MZQDSSROAPWDJC-HNJRGHQBSA-N 1 3 336.520 2.957 10 0 EFAEHO C[C@H](NC[C@@H]1CCC[C@@]2(CCOC2)O1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001413982895 1335384014 /nfs/dbraw/zinc/38/40/14/1335384014.db2.gz MZQDSSROAPWDJC-HNJRGHQBSA-N 1 3 336.520 2.957 10 0 EFAEHO C[C@H](c1ccccc1)[C@@H](O)CN1C[C@]23C[N@H+](C)C[C@@]2(C1)CCCC3 ZINC001414055674 1335549144 /nfs/dbraw/zinc/54/91/44/1335549144.db2.gz BPVKQZIEHXVELW-PMXSJFBMSA-N 1 3 328.500 2.959 10 0 EFAEHO C[C@H](c1ccccc1)[C@@H](O)CN1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001414055674 1335549147 /nfs/dbraw/zinc/54/91/47/1335549147.db2.gz BPVKQZIEHXVELW-PMXSJFBMSA-N 1 3 328.500 2.959 10 0 EFAEHO O=C(N[C@@]12CCN(C1)CCC2)c1ccc(C[NH+]2CCCCC2)cc1 ZINC001361616130 1336222977 /nfs/dbraw/zinc/22/29/77/1336222977.db2.gz NNWYVQKFXVVKQS-FQEVSTJZSA-N 1 3 327.472 2.641 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001361704765 1336284442 /nfs/dbraw/zinc/28/44/42/1336284442.db2.gz AMJAXTYJJDAFOP-MOPGFXCFSA-N 1 3 347.478 2.733 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001361704765 1336284445 /nfs/dbraw/zinc/28/44/45/1336284445.db2.gz AMJAXTYJJDAFOP-MOPGFXCFSA-N 1 3 347.478 2.733 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC)N1CCc2ccccc2C1 ZINC001361812867 1336352408 /nfs/dbraw/zinc/35/24/08/1336352408.db2.gz JDHGAOAJNNSKPT-SLFFLAALSA-N 1 3 343.515 2.670 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC)N1CCc2ccccc2C1 ZINC001361812867 1336352412 /nfs/dbraw/zinc/35/24/12/1336352412.db2.gz JDHGAOAJNNSKPT-SLFFLAALSA-N 1 3 343.515 2.670 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)[C@H](C)CC[NH+](C)C)c1ccsc1 ZINC001361917448 1336416037 /nfs/dbraw/zinc/41/60/37/1336416037.db2.gz HDCMEKROCYRCGZ-ZBFHGGJFSA-N 1 3 325.522 2.835 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N3CCN(CCC(C)(C)C)CC3)C[N@@H+]2C1 ZINC001361954377 1336435856 /nfs/dbraw/zinc/43/58/56/1336435856.db2.gz WMPCOFJPDQBJSH-KZNAEPCWSA-N 1 3 335.536 2.687 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N3CCN(CCC(C)(C)C)CC3)C[N@H+]2C1 ZINC001361954377 1336435859 /nfs/dbraw/zinc/43/58/59/1336435859.db2.gz WMPCOFJPDQBJSH-KZNAEPCWSA-N 1 3 335.536 2.687 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2CC[C@@H]3C[C@H](C)C[N@H+]3C2)N(C)C)cc1 ZINC001361975577 1336447629 /nfs/dbraw/zinc/44/76/29/1336447629.db2.gz BJEQJTSELBUTBR-NBYUQASBSA-N 1 3 343.515 2.834 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2CC[C@@H]3C[C@H](C)C[N@@H+]3C2)N(C)C)cc1 ZINC001361975577 1336447631 /nfs/dbraw/zinc/44/76/31/1336447631.db2.gz BJEQJTSELBUTBR-NBYUQASBSA-N 1 3 343.515 2.834 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001361979886 1336450062 /nfs/dbraw/zinc/45/00/62/1336450062.db2.gz VWIQPZRLNNMPEC-MJGOQNOKSA-N 1 3 349.494 2.836 10 0 EFAEHO Cc1ccc(CN(CCN(C)C)C(=O)C2CC[NH+](CC(C)C)CC2)o1 ZINC001362007218 1336461339 /nfs/dbraw/zinc/46/13/39/1336461339.db2.gz GAQZAPVYJJZVHY-UHFFFAOYSA-N 1 3 349.519 2.846 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H](C)CC[NH+](C)C)N2CCCC2)cc1 ZINC001362089811 1336498113 /nfs/dbraw/zinc/49/81/13/1336498113.db2.gz OXNAHOJGONNFQM-HKUYNNGSSA-N 1 3 331.504 2.836 10 0 EFAEHO CN1CCC(N(Cc2ccco2)C(=O)[C@H]2CCC[C@H]([NH+](C)C)C2)CC1 ZINC001362119747 1336511859 /nfs/dbraw/zinc/51/18/59/1336511859.db2.gz SKALGHIKGVWXDF-WMZOPIPTSA-N 1 3 347.503 2.823 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC001362157889 1336530110 /nfs/dbraw/zinc/53/01/10/1336530110.db2.gz KKNFGZURINAULU-QZTJIDSGSA-N 1 3 331.504 2.697 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC001362739843 1336723420 /nfs/dbraw/zinc/72/34/20/1336723420.db2.gz KFARKXAJXIDCLE-CZUORRHYSA-N 1 3 325.884 2.647 10 0 EFAEHO CN(CCCN(C)C(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1)Cc1ccco1 ZINC001362803471 1336748439 /nfs/dbraw/zinc/74/84/39/1336748439.db2.gz HOSDMWULWYMPGG-IAGOWNOFSA-N 1 3 335.492 2.680 10 0 EFAEHO CN(CCCN(C)C(=O)[C@H]1CCC[C@H]([NH+](C)C)C1)Cc1ccco1 ZINC001362803476 1336748622 /nfs/dbraw/zinc/74/86/22/1336748622.db2.gz HOSDMWULWYMPGG-IRXDYDNUSA-N 1 3 335.492 2.680 10 0 EFAEHO COc1cc(CN(C)C)ccc1NC(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001363217499 1336838863 /nfs/dbraw/zinc/83/88/63/1336838863.db2.gz LIGPXVQHSLFDIB-CVEARBPZSA-N 1 3 333.476 2.816 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)N[C@]2(C)CCN(Cc3ccccc3)C2)C1 ZINC001363771081 1337034018 /nfs/dbraw/zinc/03/40/18/1337034018.db2.gz HSUZCEVAHNLILW-SFHLNBCPSA-N 1 3 343.515 2.888 10 0 EFAEHO CN(CCC[NH+]1CCC(Cc2ccccc2)CC1)[C@H]1C[C@@H](C(N)=O)C1 ZINC001363805741 1337060133 /nfs/dbraw/zinc/06/01/33/1337060133.db2.gz BEOMCFRMCZAQCT-BGYRXZFFSA-N 1 3 343.515 2.527 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(C(C)(C)C)cc1 ZINC001363923950 1337115702 /nfs/dbraw/zinc/11/57/02/1337115702.db2.gz FJPNKBYLZGAGFU-INIZCTEOSA-N 1 3 333.520 2.986 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(C(C)(C)C)cc1 ZINC001363923950 1337115706 /nfs/dbraw/zinc/11/57/06/1337115706.db2.gz FJPNKBYLZGAGFU-INIZCTEOSA-N 1 3 333.520 2.986 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccccc2F)C1)N(C)C ZINC001365851924 1337256875 /nfs/dbraw/zinc/25/68/75/1337256875.db2.gz QQXDVWTXGHTOCD-YXJHDRRASA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCN(CCc2ccccc2)C1)[NH+]1CCCC1 ZINC001366006765 1337317033 /nfs/dbraw/zinc/31/70/33/1337317033.db2.gz WCNBFFLCHMHWLV-VQTJNVASSA-N 1 3 343.515 2.540 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001366007509 1337317729 /nfs/dbraw/zinc/31/77/29/1337317729.db2.gz XPTSAJVZLLBMMY-LJQANCHMSA-N 1 3 331.504 2.989 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001366007509 1337317731 /nfs/dbraw/zinc/31/77/31/1337317731.db2.gz XPTSAJVZLLBMMY-LJQANCHMSA-N 1 3 331.504 2.989 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001366007504 1337317758 /nfs/dbraw/zinc/31/77/58/1337317758.db2.gz XPTSAJVZLLBMMY-IBGZPJMESA-N 1 3 331.504 2.989 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001366007504 1337317761 /nfs/dbraw/zinc/31/77/61/1337317761.db2.gz XPTSAJVZLLBMMY-IBGZPJMESA-N 1 3 331.504 2.989 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC12CC[NH+](CC1CC3(CCC3)C1)CC2)N(C)C ZINC001366012730 1337321907 /nfs/dbraw/zinc/32/19/07/1337321907.db2.gz DLZUNLLPUDXLJA-ZWKOTPCHSA-N 1 3 347.547 2.878 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]([NH2+]CC2CCC3(CC3)CC2)C2CC2)CCC1 ZINC001366041427 1337341422 /nfs/dbraw/zinc/34/14/22/1337341422.db2.gz XHQSZRKNNUBLQH-SFHVURJKSA-N 1 3 347.547 2.926 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1sccc1Cl)C1CC1)N(C)C ZINC001366066112 1337359556 /nfs/dbraw/zinc/35/95/56/1337359556.db2.gz QFLCBRPLEGSOAM-ZIAGYGMSSA-N 1 3 343.924 2.726 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](CNC(=O)[C@@H](C(C)C)[NH+](C)C)C2CC2)c1 ZINC001366065600 1337358506 /nfs/dbraw/zinc/35/85/06/1337358506.db2.gz RJFLUYXQKGKPPC-RTBURBONSA-N 1 3 349.494 2.705 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@H]2CN(CCC(F)(F)F)CC[C@H]21 ZINC001366144184 1337400587 /nfs/dbraw/zinc/40/05/87/1337400587.db2.gz KYANZEBXFMUKGB-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@H]2CN(CCC(F)(F)F)CC[C@H]21 ZINC001366144184 1337400590 /nfs/dbraw/zinc/40/05/90/1337400590.db2.gz KYANZEBXFMUKGB-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2cc3ccccc3o2)C1 ZINC001366165544 1337410345 /nfs/dbraw/zinc/41/03/45/1337410345.db2.gz GJQXXNOLPFKYCP-IYBDPMFKSA-N 1 3 329.444 2.511 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC2CCC(F)(F)CC2)C1)N(C)C ZINC001366173538 1337415159 /nfs/dbraw/zinc/41/51/59/1337415159.db2.gz UFFGJELKKFZUDM-OWCLPIDISA-N 1 3 345.478 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@H+](C/C=C\c2ccccc2)C1 ZINC001366188189 1337427968 /nfs/dbraw/zinc/42/79/68/1337427968.db2.gz UUSNWYYLLGIFRE-QRGKHIHXSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2)C1 ZINC001366188189 1337427970 /nfs/dbraw/zinc/42/79/70/1337427970.db2.gz UUSNWYYLLGIFRE-QRGKHIHXSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001366189362 1337429157 /nfs/dbraw/zinc/42/91/57/1337429157.db2.gz YEJGYILTCOWHFK-QGZVFWFLSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001366189362 1337429158 /nfs/dbraw/zinc/42/91/58/1337429158.db2.gz YEJGYILTCOWHFK-QGZVFWFLSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]Cc2cccc(C)c2)CC1)N(C)C ZINC001366246120 1337475071 /nfs/dbraw/zinc/47/50/71/1337475071.db2.gz FPFPOWXIYHLPQC-CTWPCTMYSA-N 1 3 331.504 2.852 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)NCc1ccccc1Cl ZINC001366291376 1337495441 /nfs/dbraw/zinc/49/54/41/1337495441.db2.gz ZPFXHWCOFCRRLX-PBHICJAKSA-N 1 3 337.895 2.809 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)NCc1ccccc1Cl ZINC001366291376 1337495442 /nfs/dbraw/zinc/49/54/42/1337495442.db2.gz ZPFXHWCOFCRRLX-PBHICJAKSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001366341221 1337522379 /nfs/dbraw/zinc/52/23/79/1337522379.db2.gz VNKPILYXZOVOQM-HUUCEWRRSA-N 1 3 347.494 2.884 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2F)C1 ZINC001366421010 1337570859 /nfs/dbraw/zinc/57/08/59/1337570859.db2.gz BVXKCSULFZMCTM-DLBZAZTESA-N 1 3 335.467 2.683 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([N@H+](C)CC2CC3(CCC3)C2)C1 ZINC001366435899 1337585518 /nfs/dbraw/zinc/58/55/18/1337585518.db2.gz UWYIGRVKJQMLBP-GOSISDBHSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([N@@H+](C)CC2CC3(CCC3)C2)C1 ZINC001366435899 1337585520 /nfs/dbraw/zinc/58/55/20/1337585520.db2.gz UWYIGRVKJQMLBP-GOSISDBHSA-N 1 3 335.536 2.831 10 0 EFAEHO Cc1cncc(C[NH2+][C@H](C)CCNC(=O)[C@H]2CCCCN2C(C)C)c1 ZINC001366494229 1337634959 /nfs/dbraw/zinc/63/49/59/1337634959.db2.gz UMUYMQSPROGZDE-IEBWSBKVSA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001366510125 1337651453 /nfs/dbraw/zinc/65/14/53/1337651453.db2.gz HCXYCACCCJOVRL-GJZGRUSLSA-N 1 3 333.467 2.637 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@H+](C)[C@@H]2CCc3ccc(Cl)cc32)C1 ZINC001366565663 1337700766 /nfs/dbraw/zinc/70/07/66/1337700766.db2.gz KPYDZBDOTGIZLJ-RDTXWAMCSA-N 1 3 349.906 2.717 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@@H+](C)[C@@H]2CCc3ccc(Cl)cc32)C1 ZINC001366565663 1337700770 /nfs/dbraw/zinc/70/07/70/1337700770.db2.gz KPYDZBDOTGIZLJ-RDTXWAMCSA-N 1 3 349.906 2.717 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CCC[C@@H]([NH+](C)C)C2)cc1C ZINC001366585269 1337722532 /nfs/dbraw/zinc/72/25/32/1337722532.db2.gz OKSJYFIVNDKJCF-VQTJNVASSA-N 1 3 345.531 2.972 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC[N@H+](C)CC1CCC(F)(F)CC1 ZINC001366592683 1337729577 /nfs/dbraw/zinc/72/95/77/1337729577.db2.gz NVWICLOWTOOIPN-GASCZTMLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC[N@@H+](C)CC1CCC(F)(F)CC1 ZINC001366592683 1337729578 /nfs/dbraw/zinc/72/95/78/1337729578.db2.gz NVWICLOWTOOIPN-GASCZTMLSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](C(=O)NCC[N@H+](CC)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001366614903 1337753403 /nfs/dbraw/zinc/75/34/03/1337753403.db2.gz UFMDQJHKDSOLHE-LSDHHAIUSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@H](C(=O)NCC[N@@H+](CC)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001366614903 1337753409 /nfs/dbraw/zinc/75/34/09/1337753409.db2.gz UFMDQJHKDSOLHE-LSDHHAIUSA-N 1 3 333.467 2.590 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21)Cc1ccccc1 ZINC001366633016 1337776055 /nfs/dbraw/zinc/77/60/55/1337776055.db2.gz GXWGHONFWZWODD-MOPGFXCFSA-N 1 3 329.488 2.642 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21)Cc1ccccc1 ZINC001366633016 1337776060 /nfs/dbraw/zinc/77/60/60/1337776060.db2.gz GXWGHONFWZWODD-MOPGFXCFSA-N 1 3 329.488 2.642 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@@H+]1CC1CC2(CCC2)C1)N(C)C ZINC001366663459 1337819541 /nfs/dbraw/zinc/81/95/41/1337819541.db2.gz ALFWHHOGXYHDQC-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@H+]1CC1CC2(CCC2)C1)N(C)C ZINC001366663459 1337819552 /nfs/dbraw/zinc/81/95/52/1337819552.db2.gz ALFWHHOGXYHDQC-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001366692982 1337876676 /nfs/dbraw/zinc/87/66/76/1337876676.db2.gz ARYBDVHRZQZPOX-FUHWJXTLSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001366692982 1337876679 /nfs/dbraw/zinc/87/66/79/1337876679.db2.gz ARYBDVHRZQZPOX-FUHWJXTLSA-N 1 3 335.536 2.591 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCN(Cc2ccsc2)C1 ZINC001366701308 1337889569 /nfs/dbraw/zinc/88/95/69/1337889569.db2.gz KIKGZENOAJCYHI-RDJZCZTQSA-N 1 3 335.517 2.561 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCN(Cc2ccsc2)C1 ZINC001366701308 1337889574 /nfs/dbraw/zinc/88/95/74/1337889574.db2.gz KIKGZENOAJCYHI-RDJZCZTQSA-N 1 3 335.517 2.561 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+](CCCc2cccc(F)c2)C1 ZINC001366710554 1337905434 /nfs/dbraw/zinc/90/54/34/1337905434.db2.gz JQOAAOFTMUILMK-SFHVURJKSA-N 1 3 349.494 2.537 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+](CCCc2cccc(F)c2)C1 ZINC001366710554 1337905436 /nfs/dbraw/zinc/90/54/36/1337905436.db2.gz JQOAAOFTMUILMK-SFHVURJKSA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@H](F)CC[N@H+](CCNC(=O)C(C)(C)N1CCCCC1)C1CC1 ZINC001366741720 1337951588 /nfs/dbraw/zinc/95/15/88/1337951588.db2.gz QVTXUKRKEWODJX-HNNXBMFYSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](F)CC[N@@H+](CCNC(=O)C(C)(C)N1CCCCC1)C1CC1 ZINC001366741720 1337951592 /nfs/dbraw/zinc/95/15/92/1337951592.db2.gz QVTXUKRKEWODJX-HNNXBMFYSA-N 1 3 327.488 2.580 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)C[C@@H]2CC[N@@H+](C)C2)C2CC2)cc1C ZINC001366761162 1337980302 /nfs/dbraw/zinc/98/03/02/1337980302.db2.gz ZWXZTXBJFZVLRP-IBGZPJMESA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)C[C@@H]2CC[N@H+](C)C2)C2CC2)cc1C ZINC001366761162 1337980308 /nfs/dbraw/zinc/98/03/08/1337980308.db2.gz ZWXZTXBJFZVLRP-IBGZPJMESA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)C[C@H]2CC[N@@H+](C)C2)C2CC2)cc1C ZINC001366761168 1337980760 /nfs/dbraw/zinc/98/07/60/1337980760.db2.gz ZWXZTXBJFZVLRP-LJQANCHMSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)C[C@H]2CC[N@H+](C)C2)C2CC2)cc1C ZINC001366761168 1337980763 /nfs/dbraw/zinc/98/07/63/1337980763.db2.gz ZWXZTXBJFZVLRP-LJQANCHMSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]CCN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001366767283 1337987446 /nfs/dbraw/zinc/98/74/46/1337987446.db2.gz JSQQLWSUAGWRKU-KRWDZBQOSA-N 1 3 331.504 2.897 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@@H]1CCN(C/C=C/Cl)C1)[NH+]1CCCC1 ZINC001366851004 1338116986 /nfs/dbraw/zinc/11/69/86/1338116986.db2.gz JIGUHWSUPHXEMW-QQQVMXRDSA-N 1 3 341.927 2.688 10 0 EFAEHO CN(CCF)C[C@H]1CCN(C(=O)[C@H]2CCCC[N@@H+]2C2CCCC2)C1 ZINC001366865385 1338135060 /nfs/dbraw/zinc/13/50/60/1338135060.db2.gz KKBIVJOWXLKSDY-SJLPKXTDSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)C[C@H]1CCN(C(=O)[C@H]2CCCC[N@H+]2C2CCCC2)C1 ZINC001366865385 1338135062 /nfs/dbraw/zinc/13/50/62/1338135062.db2.gz KKBIVJOWXLKSDY-SJLPKXTDSA-N 1 3 339.499 2.533 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](C[N@H+](C)CCC2CCCCC2)C1 ZINC001366895816 1338179807 /nfs/dbraw/zinc/17/98/07/1338179807.db2.gz AGFMTXNNTOYYEH-RBUKOAKNSA-N 1 3 335.536 2.831 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](C[N@@H+](C)CCC2CCCCC2)C1 ZINC001366895816 1338179810 /nfs/dbraw/zinc/17/98/10/1338179810.db2.gz AGFMTXNNTOYYEH-RBUKOAKNSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N1CCCC1 ZINC001367026961 1338285090 /nfs/dbraw/zinc/28/50/90/1338285090.db2.gz YCWVTGALXDJRDK-RBUKOAKNSA-N 1 3 347.547 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N1CCCC1 ZINC001367026961 1338285095 /nfs/dbraw/zinc/28/50/95/1338285095.db2.gz YCWVTGALXDJRDK-RBUKOAKNSA-N 1 3 347.547 2.878 10 0 EFAEHO CC(C)c1ccc(CN2CC[C@@H](NC(=O)CCC[NH+](C)C)C2)cc1 ZINC001367032127 1338291492 /nfs/dbraw/zinc/29/14/92/1338291492.db2.gz HNNAAADCXYEHRH-LJQANCHMSA-N 1 3 331.504 2.842 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@H+](CC2CC(C)(C)C2)C1)N1CCCC1 ZINC001367039664 1338300359 /nfs/dbraw/zinc/30/03/59/1338300359.db2.gz RVKZLUDPMLLAIG-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@@H+](CC2CC(C)(C)C2)C1)N1CCCC1 ZINC001367039664 1338300365 /nfs/dbraw/zinc/30/03/65/1338300365.db2.gz RVKZLUDPMLLAIG-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H]1CC[N@H+](CC2CCC2)C1)N1CCCCC1 ZINC001367060543 1338329633 /nfs/dbraw/zinc/32/96/33/1338329633.db2.gz RHSAGVAHVMVOLJ-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H]1CC[N@@H+](CC2CCC2)C1)N1CCCCC1 ZINC001367060543 1338329640 /nfs/dbraw/zinc/32/96/40/1338329640.db2.gz RHSAGVAHVMVOLJ-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CCCc1ccc(CN2CC[C@H](N(C)C(=O)CC[NH+](C)C)C2)cc1 ZINC001367061204 1338330764 /nfs/dbraw/zinc/33/07/64/1338330764.db2.gz QNVVPDJMXCAIBB-IBGZPJMESA-N 1 3 331.504 2.624 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@H]1CCN([C@@H]2CCc3ccc(F)cc32)C1 ZINC001367072360 1338351371 /nfs/dbraw/zinc/35/13/71/1338351371.db2.gz KCFWBIRWOPEOLB-PKOBYXMFSA-N 1 3 347.478 2.688 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc(F)cc1C ZINC001367109598 1338396579 /nfs/dbraw/zinc/39/65/79/1338396579.db2.gz BXOVBSYAODCKQV-GOSISDBHSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cccc(Cl)c1 ZINC001367131277 1338421479 /nfs/dbraw/zinc/42/14/79/1338421479.db2.gz ZCNVRBXHOXADMK-YOEHRIQHSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1cc(C)sc1C ZINC001367147869 1338442732 /nfs/dbraw/zinc/44/27/32/1338442732.db2.gz FNHPGISSAGUWIU-MRXNPFEDSA-N 1 3 325.522 2.690 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H](C)CNC(=O)CN(C)C(C)C)c(C)s1 ZINC001367291059 1338590379 /nfs/dbraw/zinc/59/03/79/1338590379.db2.gz VBROAFIFYWCWIU-CYBMUJFWSA-N 1 3 325.522 2.547 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001367266271 1338566151 /nfs/dbraw/zinc/56/61/51/1338566151.db2.gz MMPLGJXWYCVJJQ-OAHLLOKOSA-N 1 3 349.494 2.850 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)C[NH2+]Cc1cccc(F)c1Cl)N(C)C ZINC001367295309 1338594870 /nfs/dbraw/zinc/59/48/70/1338594870.db2.gz VRMQPBVFHLIBCO-SWLSCSKDSA-N 1 3 343.874 2.661 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+]CC2CC3(CCC3)C2)CCCC1 ZINC001367324858 1338623103 /nfs/dbraw/zinc/62/31/03/1338623103.db2.gz QYQARRZITBSOAP-UHFFFAOYSA-N 1 3 335.536 2.927 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001367364558 1338659685 /nfs/dbraw/zinc/65/96/85/1338659685.db2.gz JAGWVJZACLDLNB-XJKSGUPXSA-N 1 3 325.884 2.617 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001367364553 1338660127 /nfs/dbraw/zinc/66/01/27/1338660127.db2.gz JAGWVJZACLDLNB-CZUORRHYSA-N 1 3 325.884 2.617 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cccc(C(F)F)c1)N(C)C(=O)[C@@H]1CCCN1C ZINC001367365272 1338660639 /nfs/dbraw/zinc/66/06/39/1338660639.db2.gz YIZSGQAURYPGIT-BBRMVZONSA-N 1 3 339.430 2.655 10 0 EFAEHO C[C@H](C[NH2+]CC1CCC(F)(F)CC1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001367383917 1338679479 /nfs/dbraw/zinc/67/94/79/1338679479.db2.gz QKUSARIAGRSCRY-LSDHHAIUSA-N 1 3 345.478 2.590 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](C)N(C)C(=O)C12CC[NH+](CC1)C2 ZINC001367392193 1338688627 /nfs/dbraw/zinc/68/86/27/1338688627.db2.gz ACYGMPTZHJAGSL-OAHLLOKOSA-N 1 3 349.906 2.681 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H](C)[NH2+]CC2CC(C)(C)C2)C1 ZINC001367438440 1338740457 /nfs/dbraw/zinc/74/04/57/1338740457.db2.gz DHNPZWZDMJSQFT-WMZOPIPTSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)[NH2+]Cc1ccsc1 ZINC001367486939 1338786723 /nfs/dbraw/zinc/78/67/23/1338786723.db2.gz CNLREEQRSHUZTA-CVEARBPZSA-N 1 3 325.522 2.565 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001367520748 1338820701 /nfs/dbraw/zinc/82/07/01/1338820701.db2.gz FENQDKQFAGDSFE-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001367520748 1338820706 /nfs/dbraw/zinc/82/07/06/1338820706.db2.gz FENQDKQFAGDSFE-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[N@H+](C)C[C@@H]1CCc2ccccc2C1)N(C)C ZINC001367544363 1338850851 /nfs/dbraw/zinc/85/08/51/1338850851.db2.gz BJJGAFLYCFUWAZ-XLIONFOSSA-N 1 3 345.531 2.522 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[N@@H+](C)C[C@@H]1CCc2ccccc2C1)N(C)C ZINC001367544363 1338850852 /nfs/dbraw/zinc/85/08/52/1338850852.db2.gz BJJGAFLYCFUWAZ-XLIONFOSSA-N 1 3 345.531 2.522 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CC[N@H+](C)C1)Cc1ccc(C2CCC2)cc1 ZINC001367549676 1338860062 /nfs/dbraw/zinc/86/00/62/1338860062.db2.gz FDYJSIDZXBUGQY-FQEVSTJZSA-N 1 3 343.515 2.796 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CC[N@@H+](C)C1)Cc1ccc(C2CCC2)cc1 ZINC001367549676 1338860065 /nfs/dbraw/zinc/86/00/65/1338860065.db2.gz FDYJSIDZXBUGQY-FQEVSTJZSA-N 1 3 343.515 2.796 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)C(C)(C)N2CCCCC2)c(C)n1 ZINC001367677938 1338922304 /nfs/dbraw/zinc/92/23/04/1338922304.db2.gz TVXSPGTXKJNJHI-MRXNPFEDSA-N 1 3 346.519 2.557 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C ZINC001367681712 1338925247 /nfs/dbraw/zinc/92/52/47/1338925247.db2.gz WXCRENMEJUOBLP-DNVCBOLYSA-N 1 3 331.504 2.889 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C ZINC001367700659 1338939576 /nfs/dbraw/zinc/93/95/76/1338939576.db2.gz WXCRENMEJUOBLP-BEFAXECRSA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+]Cc1cccc2ccccc21 ZINC001367732008 1338964344 /nfs/dbraw/zinc/96/43/44/1338964344.db2.gz BZIZEQCXHDPSGS-MRXNPFEDSA-N 1 3 327.472 2.774 10 0 EFAEHO CCCc1ccc(C[NH2+]C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001367758667 1338985795 /nfs/dbraw/zinc/98/57/95/1338985795.db2.gz APWURHNEJLZJSF-SJORKVTESA-N 1 3 331.504 2.575 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001367760910 1338987308 /nfs/dbraw/zinc/98/73/08/1338987308.db2.gz RUYBFYVVSVLJSX-SJORKVTESA-N 1 3 331.504 2.746 10 0 EFAEHO C[C@@H](C[NH2+]CC1CCCCC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001367760915 1338987786 /nfs/dbraw/zinc/98/77/86/1338987786.db2.gz RXJYXLJGJIQMAO-KXBFYZLASA-N 1 3 341.515 2.874 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1cc(F)ccc1C ZINC001367803269 1339022739 /nfs/dbraw/zinc/02/27/39/1339022739.db2.gz LYEAKYYPEDQTJB-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1cc(F)ccc1C ZINC001367803269 1339022741 /nfs/dbraw/zinc/02/27/41/1339022741.db2.gz LYEAKYYPEDQTJB-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(F)c1 ZINC001367816214 1339033854 /nfs/dbraw/zinc/03/38/54/1339033854.db2.gz SUSXZBWKRBCYJW-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(F)c1 ZINC001367816214 1339033857 /nfs/dbraw/zinc/03/38/57/1339033857.db2.gz SUSXZBWKRBCYJW-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001367840323 1339056323 /nfs/dbraw/zinc/05/63/23/1339056323.db2.gz XWCQKZKAGVATND-MAUKXSAKSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001367840323 1339056325 /nfs/dbraw/zinc/05/63/25/1339056325.db2.gz XWCQKZKAGVATND-MAUKXSAKSA-N 1 3 331.504 2.582 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@@H](CNCc1ccccc1F)C1CC1 ZINC001367909636 1339100700 /nfs/dbraw/zinc/10/07/00/1339100700.db2.gz RJPSJFHUJCIDLX-MJGOQNOKSA-N 1 3 347.478 2.685 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@@H](CNCc1ccccc1F)C1CC1 ZINC001367909636 1339100701 /nfs/dbraw/zinc/10/07/01/1339100701.db2.gz RJPSJFHUJCIDLX-MJGOQNOKSA-N 1 3 347.478 2.685 10 0 EFAEHO Cc1ccc(C)c([C@H](C)N2CC[C@@H]2CNC(=O)CCC[NH+](C)C)c1 ZINC001367959189 1339128640 /nfs/dbraw/zinc/12/86/40/1339128640.db2.gz JJQORIIBDXILON-ZWKOTPCHSA-N 1 3 331.504 2.897 10 0 EFAEHO C[C@@H](NC1(CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)CC1)c1ccc(F)cc1 ZINC001368015686 1339159142 /nfs/dbraw/zinc/15/91/42/1339159142.db2.gz NDPRCQDEVZRPPY-UXLLHSPISA-N 1 3 347.478 2.855 10 0 EFAEHO C[C@@H](NC1(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)CC1)c1ccc(F)cc1 ZINC001368015686 1339159144 /nfs/dbraw/zinc/15/91/44/1339159144.db2.gz NDPRCQDEVZRPPY-UXLLHSPISA-N 1 3 347.478 2.855 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+][C@H](C)c2cccc(Cl)c2)CC1)N(C)C ZINC001368018475 1339159932 /nfs/dbraw/zinc/15/99/32/1339159932.db2.gz ILYVHOFTSJVIMS-CJNGLKHVSA-N 1 3 337.895 2.980 10 0 EFAEHO CN(CC(=O)NCC1([NH2+][C@H]2CCc3ccccc32)CC1)CC(C)(C)C ZINC001368019350 1339161094 /nfs/dbraw/zinc/16/10/94/1339161094.db2.gz MAXHDKVFXLRKCE-SFHVURJKSA-N 1 3 343.515 2.890 10 0 EFAEHO CC[C@H](F)C[N@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001368051070 1339177670 /nfs/dbraw/zinc/17/76/70/1339177670.db2.gz SBMHLKDBISUORC-FUHWJXTLSA-N 1 3 339.499 2.532 10 0 EFAEHO CC[C@H](F)C[N@@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001368051070 1339177672 /nfs/dbraw/zinc/17/76/72/1339177672.db2.gz SBMHLKDBISUORC-FUHWJXTLSA-N 1 3 339.499 2.532 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(CC[N@H+](CCCC3CCC3)C2)C1 ZINC001368057625 1339181202 /nfs/dbraw/zinc/18/12/02/1339181202.db2.gz BUHGOKILCAWZQF-HXUWFJFHSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(CC[N@@H+](CCCC3CCC3)C2)C1 ZINC001368057625 1339181203 /nfs/dbraw/zinc/18/12/03/1339181203.db2.gz BUHGOKILCAWZQF-HXUWFJFHSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(CC[N@H+](CCCC3CCC3)C2)C1 ZINC001368057621 1339181219 /nfs/dbraw/zinc/18/12/19/1339181219.db2.gz BUHGOKILCAWZQF-FQEVSTJZSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(CC[N@@H+](CCCC3CCC3)C2)C1 ZINC001368057621 1339181221 /nfs/dbraw/zinc/18/12/21/1339181221.db2.gz BUHGOKILCAWZQF-FQEVSTJZSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1CC[C@@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001368070528 1339185749 /nfs/dbraw/zinc/18/57/49/1339185749.db2.gz WWVWBYYNWSHWKR-YLJYHZDGSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C)C[N@H+]1CC[C@@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001368070528 1339185750 /nfs/dbraw/zinc/18/57/50/1339185750.db2.gz WWVWBYYNWSHWKR-YLJYHZDGSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CC[NH2+][C@H]1CCN(C(=O)CN(C)CC(C)(C)C)[C@@H](C)C1 ZINC001368107980 1339197562 /nfs/dbraw/zinc/19/75/62/1339197562.db2.gz WSUCDSZLYHPWTC-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCc2cccs2)C[C@@H]1C ZINC001368109510 1339197704 /nfs/dbraw/zinc/19/77/04/1339197704.db2.gz SCMNYNCDWZCUEQ-JKSUJKDBSA-N 1 3 337.533 2.600 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001368113035 1339198912 /nfs/dbraw/zinc/19/89/12/1339198912.db2.gz CACYQRXJHZDNQC-SFHVURJKSA-N 1 3 342.487 2.590 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@]1(C)CCN([C@H](C)c2cccc(OC)c2)C1 ZINC001368184610 1339241822 /nfs/dbraw/zinc/24/18/22/1339241822.db2.gz YPBHJTKZGCIVOO-UZLBHIALSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@]1(C)CCN([C@H](C)c2cccc(OC)c2)C1 ZINC001368184610 1339241823 /nfs/dbraw/zinc/24/18/23/1339241823.db2.gz YPBHJTKZGCIVOO-UZLBHIALSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[C@@H](C)C[NH+]1CCC(C)(CNC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001368209773 1339257182 /nfs/dbraw/zinc/25/71/82/1339257182.db2.gz XPRXXWSECFBJLF-SJORKVTESA-N 1 3 325.541 2.837 10 0 EFAEHO CCC[NH+]1CCC(C)(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001368213263 1339259697 /nfs/dbraw/zinc/25/96/97/1339259697.db2.gz NYLNDCDERKJPTF-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1(C)CC[NH+](CC2CCCC2)CC1)N(C)C ZINC001368214230 1339260480 /nfs/dbraw/zinc/26/04/80/1339260480.db2.gz UTRODICHTNPHIX-GOSISDBHSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccc(F)cc1CN1CCC[C@@](C)(CNC(=O)CC[NH+](C)C)C1 ZINC001368232041 1339276749 /nfs/dbraw/zinc/27/67/49/1339276749.db2.gz VIRQEJLASMNRHG-FQEVSTJZSA-N 1 3 349.494 2.804 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@]1(C)CCC[N@H+](CCCF)C1 ZINC001368233232 1339277365 /nfs/dbraw/zinc/27/73/65/1339277365.db2.gz ZRMBKDZEIRZLPU-MJGOQNOKSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@]1(C)CCC[N@@H+](CCCF)C1 ZINC001368233232 1339277366 /nfs/dbraw/zinc/27/73/66/1339277366.db2.gz ZRMBKDZEIRZLPU-MJGOQNOKSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001368351682 1339312119 /nfs/dbraw/zinc/31/21/19/1339312119.db2.gz MOFYGOKCYNCJEH-RBUKOAKNSA-N 1 3 345.531 2.828 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2cc(C)ccc2C)C1 ZINC001368352464 1339312282 /nfs/dbraw/zinc/31/22/82/1339312282.db2.gz NXYBGARRWFYPDT-AZUAARDMSA-N 1 3 345.531 2.829 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)C[C@H]21 ZINC001368381514 1339320495 /nfs/dbraw/zinc/32/04/95/1339320495.db2.gz SEKRPWPAFBFQND-DLBZAZTESA-N 1 3 335.517 2.513 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)C[C@H]21 ZINC001368381514 1339320496 /nfs/dbraw/zinc/32/04/96/1339320496.db2.gz SEKRPWPAFBFQND-DLBZAZTESA-N 1 3 335.517 2.513 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@@H]1CC[N@@H+]1CC1CC2(CCC2)C1)N(C)C ZINC001368397333 1339331051 /nfs/dbraw/zinc/33/10/51/1339331051.db2.gz FEJSJHALLLRMKH-ZWKOTPCHSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@@H]1CC[N@H+]1CC1CC2(CCC2)C1)N(C)C ZINC001368397333 1339331056 /nfs/dbraw/zinc/33/10/56/1339331056.db2.gz FEJSJHALLLRMKH-ZWKOTPCHSA-N 1 3 335.536 2.686 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]CC[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001368418508 1339351418 /nfs/dbraw/zinc/35/14/18/1339351418.db2.gz LJAZRLOJIXYLFE-MOPGFXCFSA-N 1 3 343.515 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C[C@@H]1CCN1CC1CCC1)[NH+]1CCCCC1 ZINC001368447790 1339382572 /nfs/dbraw/zinc/38/25/72/1339382572.db2.gz BPFGBSUDIMPJNW-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@@H]1CCN1CC1CCC1)[NH+]1CCCCC1 ZINC001368448582 1339383171 /nfs/dbraw/zinc/38/31/71/1339383171.db2.gz BPFGBSUDIMPJNW-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@@H](C(=O)NCc1cccc2c1CC[N@H+](CC[C@H](C)F)C2)N(C)C ZINC001368449547 1339384714 /nfs/dbraw/zinc/38/47/14/1339384714.db2.gz OWPWNEBYYKIKTC-KXBFYZLASA-N 1 3 349.494 2.749 10 0 EFAEHO CC[C@@H](C(=O)NCc1cccc2c1CC[N@@H+](CC[C@H](C)F)C2)N(C)C ZINC001368449547 1339384723 /nfs/dbraw/zinc/38/47/23/1339384723.db2.gz OWPWNEBYYKIKTC-KXBFYZLASA-N 1 3 349.494 2.749 10 0 EFAEHO CC[C@H](C(=O)NCc1cccc2c1CC[N@H+](CC[C@@H](C)F)C2)N(C)C ZINC001368449536 1339385411 /nfs/dbraw/zinc/38/54/11/1339385411.db2.gz OWPWNEBYYKIKTC-DNVCBOLYSA-N 1 3 349.494 2.749 10 0 EFAEHO CC[C@H](C(=O)NCc1cccc2c1CC[N@@H+](CC[C@@H](C)F)C2)N(C)C ZINC001368449536 1339385412 /nfs/dbraw/zinc/38/54/12/1339385412.db2.gz OWPWNEBYYKIKTC-DNVCBOLYSA-N 1 3 349.494 2.749 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3cccc(F)c3)CCC2)CC[N@@H+]1C ZINC001368472421 1339408389 /nfs/dbraw/zinc/40/83/89/1339408389.db2.gz DCJOQMRFIAFZJZ-ZWKOTPCHSA-N 1 3 347.478 2.685 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3cccc(F)c3)CCC2)CC[N@H+]1C ZINC001368472421 1339408392 /nfs/dbraw/zinc/40/83/92/1339408392.db2.gz DCJOQMRFIAFZJZ-ZWKOTPCHSA-N 1 3 347.478 2.685 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)C[C@@H]3CC[N@@H+](C)C3)CCC2)c1 ZINC001368491538 1339428412 /nfs/dbraw/zinc/42/84/12/1339428412.db2.gz ZDUOUPVAGBDISE-INIZCTEOSA-N 1 3 347.478 2.604 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)C[C@@H]3CC[N@H+](C)C3)CCC2)c1 ZINC001368491538 1339428417 /nfs/dbraw/zinc/42/84/17/1339428417.db2.gz ZDUOUPVAGBDISE-INIZCTEOSA-N 1 3 347.478 2.604 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CCc2ccccc2)CCC1 ZINC001368498157 1339436194 /nfs/dbraw/zinc/43/61/94/1339436194.db2.gz ZKTMWACJPWYNOS-ROUUACIJSA-N 1 3 343.515 2.730 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+]CC[C@@H](C)F)CCC1)N1CCCCC1 ZINC001368499077 1339437483 /nfs/dbraw/zinc/43/74/83/1339437483.db2.gz YGJGZTYHIXFJGG-SJORKVTESA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[N@H+](C)CC2CC3(CCC3)C2)C1 ZINC001368560640 1339505423 /nfs/dbraw/zinc/50/54/23/1339505423.db2.gz YPICDZAAVKXXAZ-KRWDZBQOSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[N@@H+](C)CC2CC3(CCC3)C2)C1 ZINC001368560640 1339505430 /nfs/dbraw/zinc/50/54/30/1339505430.db2.gz YPICDZAAVKXXAZ-KRWDZBQOSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001368564064 1339510623 /nfs/dbraw/zinc/51/06/23/1339510623.db2.gz CJGVTHZHTKEOLM-MRXNPFEDSA-N 1 3 347.494 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001368564064 1339510624 /nfs/dbraw/zinc/51/06/24/1339510624.db2.gz CJGVTHZHTKEOLM-MRXNPFEDSA-N 1 3 347.494 2.932 10 0 EFAEHO CCC1([NH2+]Cc2ccccc2)CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001368593231 1339539239 /nfs/dbraw/zinc/53/92/39/1339539239.db2.gz KJNHJSPLFJBDMN-GOSISDBHSA-N 1 3 329.488 2.642 10 0 EFAEHO CC1CC(C[NH2+]C2(C)CCN(C(=O)CN(C)CC(C)(C)C)CC2)C1 ZINC001368657934 1339570767 /nfs/dbraw/zinc/57/07/67/1339570767.db2.gz TUMBZJFAUSLNFI-UHFFFAOYSA-N 1 3 337.552 2.981 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CCC(C)(NC/C(Cl)=C/Cl)CC2)CC1 ZINC001368659618 1339571987 /nfs/dbraw/zinc/57/19/87/1339571987.db2.gz UZNOVDIVIAXFSZ-RAXLEYEMSA-N 1 3 348.318 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CC2CC3(CCC3)C2)[C@@H](C)C1 ZINC001368693905 1339607998 /nfs/dbraw/zinc/60/79/98/1339607998.db2.gz DGXAVDMPAZALRK-WMZOPIPTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)[C@@H](C)C1 ZINC001368693905 1339608002 /nfs/dbraw/zinc/60/80/02/1339608002.db2.gz DGXAVDMPAZALRK-WMZOPIPTSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]C/C=C\c1ccccc1 ZINC001368737132 1339658774 /nfs/dbraw/zinc/65/87/74/1339658774.db2.gz PIRKJBAFZQJGRS-UVFSVYEVSA-N 1 3 329.488 2.526 10 0 EFAEHO O=C(CCC[NH+]1CCCCC1)N1CCCCC[C@@H](NCCF)C1 ZINC001368747084 1339670387 /nfs/dbraw/zinc/67/03/87/1339670387.db2.gz FFJWZEOCBHQCRQ-QGZVFWFLSA-N 1 3 327.488 2.583 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCCCC[C@H]([NH2+]C/C=C\Cl)C1)N(C)C ZINC001368752250 1339677298 /nfs/dbraw/zinc/67/72/98/1339677298.db2.gz BTBLDSOPHCDZDE-JIHRLENESA-N 1 3 329.916 2.686 10 0 EFAEHO C[C@@H](CCNC(=O)c1cccc(CN(C)C)c1)[NH2+]Cc1cncs1 ZINC001368755756 1339682332 /nfs/dbraw/zinc/68/23/32/1339682332.db2.gz RGAJEPYYMACZAN-AWEZNQCLSA-N 1 3 346.500 2.503 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCC[C@H]1CNCc1cc2ccccc2o1 ZINC001368775227 1339700505 /nfs/dbraw/zinc/70/05/05/1339700505.db2.gz QPLZZIFAKBEWRA-KRWDZBQOSA-N 1 3 343.471 2.855 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@@H]1C[N@H+](C)CCC1CCCCC1 ZINC001368788833 1339716735 /nfs/dbraw/zinc/71/67/35/1339716735.db2.gz LWVHUAAJHBVPGT-RTBURBONSA-N 1 3 335.536 2.974 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@@H]1C[N@@H+](C)CCC1CCCCC1 ZINC001368788833 1339716738 /nfs/dbraw/zinc/71/67/38/1339716738.db2.gz LWVHUAAJHBVPGT-RTBURBONSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@H]([NH2+]CC1CC(NC(=O)CN(C)C2CCC2)C1)c1ccccc1 ZINC001368807291 1339743464 /nfs/dbraw/zinc/74/34/64/1339743464.db2.gz GKIMNKRIUPLYQY-HJOIGYKYSA-N 1 3 329.488 2.716 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]C[C@H]2CCCC(F)(F)C2)C1 ZINC001368823948 1339763406 /nfs/dbraw/zinc/76/34/06/1339763406.db2.gz ROOULDAMFWNELX-FHERZECASA-N 1 3 345.478 2.638 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[N@H+](CCCF)CC(C)(C)C1)CC(C)(C)C ZINC001368830019 1339770687 /nfs/dbraw/zinc/77/06/87/1339770687.db2.gz XYDTVMUSVOLZBF-INIZCTEOSA-N 1 3 343.531 2.931 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[N@@H+](CCCF)CC(C)(C)C1)CC(C)(C)C ZINC001368830019 1339770690 /nfs/dbraw/zinc/77/06/90/1339770690.db2.gz XYDTVMUSVOLZBF-INIZCTEOSA-N 1 3 343.531 2.931 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@H+](CCC2CC2)CC(C)(C)C1)N(C)C ZINC001368832259 1339773539 /nfs/dbraw/zinc/77/35/39/1339773539.db2.gz MDQUIQMUGGOUDN-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@@H+](CCC2CC2)CC(C)(C)C1)N(C)C ZINC001368832259 1339773542 /nfs/dbraw/zinc/77/35/42/1339773542.db2.gz MDQUIQMUGGOUDN-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](Cc2cccnc2)CC(C)(C)C1 ZINC001368832784 1339774362 /nfs/dbraw/zinc/77/43/62/1339774362.db2.gz PAKFZIYWMZEBLF-SFHVURJKSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](Cc2cccnc2)CC(C)(C)C1 ZINC001368832784 1339774364 /nfs/dbraw/zinc/77/43/64/1339774364.db2.gz PAKFZIYWMZEBLF-SFHVURJKSA-N 1 3 346.519 2.529 10 0 EFAEHO C[C@@H](NCc1ccccc1F)[C@H](C)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001368857182 1339793755 /nfs/dbraw/zinc/79/37/55/1339793755.db2.gz BVAFFYKCELHWOL-CABCVRRESA-N 1 3 335.467 2.683 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)[C@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001368879085 1339815280 /nfs/dbraw/zinc/81/52/80/1339815280.db2.gz UEZQAXARDXWTCQ-CVEARBPZSA-N 1 3 349.494 2.991 10 0 EFAEHO CN(C(=O)[C@@H]1CC[N@H+](C)C1)C1CCC(NC/C(Cl)=C/Cl)CC1 ZINC001368895678 1339835488 /nfs/dbraw/zinc/83/54/88/1339835488.db2.gz DVXTYWWJTJCBKE-RXRYPLSASA-N 1 3 348.318 2.616 10 0 EFAEHO CN(C(=O)[C@@H]1CC[N@@H+](C)C1)C1CCC(NC/C(Cl)=C/Cl)CC1 ZINC001368895678 1339835492 /nfs/dbraw/zinc/83/54/92/1339835492.db2.gz DVXTYWWJTJCBKE-RXRYPLSASA-N 1 3 348.318 2.616 10 0 EFAEHO Cc1cccnc1CN[C@@H](C)[C@@H](C)NC(=O)CCC[NH+]1CCCCC1 ZINC001368902457 1339844271 /nfs/dbraw/zinc/84/42/71/1339844271.db2.gz UQKPSNZAVKMKMB-ZWKOTPCHSA-N 1 3 346.519 2.639 10 0 EFAEHO CC[C@H](C(=O)N(C)CC(C)(C)C[NH2+]C[C@H]1CCC(F)(F)C1)N(C)C ZINC001368910813 1339854142 /nfs/dbraw/zinc/85/41/42/1339854142.db2.gz ZSSPKMRBCGALHZ-LSDHHAIUSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1ccc(C)cc1C)C1CC1)N(C)C ZINC001370262645 1339993737 /nfs/dbraw/zinc/99/37/37/1339993737.db2.gz GPNJEQRBMJYYPP-RBUKOAKNSA-N 1 3 331.504 2.628 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001370275595 1340003181 /nfs/dbraw/zinc/00/31/81/1340003181.db2.gz ODKIRZNLAGGLKS-LPHOPBHVSA-N 1 3 331.504 2.881 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1)C1CC1 ZINC001370280147 1340006408 /nfs/dbraw/zinc/00/64/08/1340006408.db2.gz YMUDLBKTJWDJFT-KBXCAEBGSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@H+](C)CCC(C)(C)C)C1 ZINC001370318737 1340032499 /nfs/dbraw/zinc/03/24/99/1340032499.db2.gz XQIUFLCJDUSPAO-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@@H+](C)CCC(C)(C)C)C1 ZINC001370318737 1340032502 /nfs/dbraw/zinc/03/25/02/1340032502.db2.gz XQIUFLCJDUSPAO-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO C[C@@H](N[C@H]1C[C@H](NC(=O)CC[C@H]2CCC[N@@H+]2C)C1)c1ccccc1F ZINC001370486266 1340097977 /nfs/dbraw/zinc/09/79/77/1340097977.db2.gz UJFLXUBAIREJPD-QBPKDAKJSA-N 1 3 347.478 2.998 10 0 EFAEHO C[C@@H](N[C@H]1C[C@H](NC(=O)CC[C@H]2CCC[N@H+]2C)C1)c1ccccc1F ZINC001370486266 1340097981 /nfs/dbraw/zinc/09/79/81/1340097981.db2.gz UJFLXUBAIREJPD-QBPKDAKJSA-N 1 3 347.478 2.998 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)N[C@H]2C[C@H](NCC=C(Cl)Cl)C2)C1 ZINC001370531968 1340119527 /nfs/dbraw/zinc/11/95/27/1340119527.db2.gz HDJYFNNUTSMSEZ-AAVRWANBSA-N 1 3 348.318 2.663 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(F)c1)N(C)C ZINC001370593278 1340153281 /nfs/dbraw/zinc/15/32/81/1340153281.db2.gz MJYFRGSREBRZQS-IPQPSQTFSA-N 1 3 347.478 2.778 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(F)c1)N(C)C ZINC001370593278 1340153283 /nfs/dbraw/zinc/15/32/83/1340153283.db2.gz MJYFRGSREBRZQS-IPQPSQTFSA-N 1 3 347.478 2.778 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(F)c1)N(C)C ZINC001370593283 1340153395 /nfs/dbraw/zinc/15/33/95/1340153395.db2.gz MJYFRGSREBRZQS-XVLXNVKGSA-N 1 3 347.478 2.778 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(F)c1)N(C)C ZINC001370593283 1340153398 /nfs/dbraw/zinc/15/33/98/1340153398.db2.gz MJYFRGSREBRZQS-XVLXNVKGSA-N 1 3 347.478 2.778 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001370646047 1340179834 /nfs/dbraw/zinc/17/98/34/1340179834.db2.gz CVTYUWODZBUOCJ-RFQIPJPRSA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001370646047 1340179836 /nfs/dbraw/zinc/17/98/36/1340179836.db2.gz CVTYUWODZBUOCJ-RFQIPJPRSA-N 1 3 346.302 2.559 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[NH2+]CC2CCC(C)CC2)C1 ZINC001370833969 1340225477 /nfs/dbraw/zinc/22/54/77/1340225477.db2.gz VYXXURSOJGGHPW-ACBHZAAOSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[NH2+][C@@H]1CCc2ccccc21 ZINC001370949081 1340301899 /nfs/dbraw/zinc/30/18/99/1340301899.db2.gz GWVKLCQEIKYXLW-AZUAARDMSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001370972874 1340317169 /nfs/dbraw/zinc/31/71/69/1340317169.db2.gz VREKODATHKJDMI-PKOBYXMFSA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001370972874 1340317173 /nfs/dbraw/zinc/31/71/73/1340317173.db2.gz VREKODATHKJDMI-PKOBYXMFSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1ccc(CN2CCC[C@H]([C@H](C)NC(=O)CC[NH+](C)C)C2)cc1F ZINC001370981915 1340321173 /nfs/dbraw/zinc/32/11/73/1340321173.db2.gz VQVQZXCFTYNNFO-WMZOPIPTSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1[C@H]2C[N@@H+]([C@H](CC)c3ccccc3)C[C@H]21)N(C)C ZINC001371015227 1340326245 /nfs/dbraw/zinc/32/62/45/1340326245.db2.gz PBWRPEKGUPORMD-ZRSRNVLSSA-N 1 3 329.488 2.524 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1[C@H]2C[N@H+]([C@H](CC)c3ccccc3)C[C@H]21)N(C)C ZINC001371015227 1340326252 /nfs/dbraw/zinc/32/62/52/1340326252.db2.gz PBWRPEKGUPORMD-ZRSRNVLSSA-N 1 3 329.488 2.524 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1[C@H]2C[N@@H+]([C@@H](CC)c3ccccc3)C[C@H]21)N(C)C ZINC001371015228 1340326342 /nfs/dbraw/zinc/32/63/42/1340326342.db2.gz PBWRPEKGUPORMD-ZWJWXYIHSA-N 1 3 329.488 2.524 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1[C@H]2C[N@H+]([C@@H](CC)c3ccccc3)C[C@H]21)N(C)C ZINC001371015228 1340326345 /nfs/dbraw/zinc/32/63/45/1340326345.db2.gz PBWRPEKGUPORMD-ZWJWXYIHSA-N 1 3 329.488 2.524 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]Cc2ccc(C)nc2C)CC1)N(C)C ZINC001371068740 1340342204 /nfs/dbraw/zinc/34/22/04/1340342204.db2.gz CXMCSPZXNMLHLN-CTWPCTMYSA-N 1 3 346.519 2.556 10 0 EFAEHO CCc1ccc(CC[NH2+][C@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001371179162 1340397714 /nfs/dbraw/zinc/39/77/14/1340397714.db2.gz QGUKTZUOHHGBDY-XLIONFOSSA-N 1 3 345.531 2.759 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)NCc2ccc(Cl)s2)CC[N@@H+]1C ZINC001371182834 1340399904 /nfs/dbraw/zinc/39/99/04/1340399904.db2.gz CPJGNEKUGZVQEP-KWCYVHTRSA-N 1 3 343.924 2.726 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)NCc2ccc(Cl)s2)CC[N@H+]1C ZINC001371182834 1340399905 /nfs/dbraw/zinc/39/99/05/1340399905.db2.gz CPJGNEKUGZVQEP-KWCYVHTRSA-N 1 3 343.924 2.726 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)NCc1ccccc1F ZINC001371254135 1340443799 /nfs/dbraw/zinc/44/37/99/1340443799.db2.gz CVPVTFHMHMGKQQ-MAUKXSAKSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)NCc1ccccc1F ZINC001371254135 1340443801 /nfs/dbraw/zinc/44/38/01/1340443801.db2.gz CVPVTFHMHMGKQQ-MAUKXSAKSA-N 1 3 335.467 2.540 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@H]([NH2+]CC3CC(C)(C)C3)C2)CCC1 ZINC001371634094 1340685397 /nfs/dbraw/zinc/68/53/97/1340685397.db2.gz NOCPTRJHJLLWCA-DLBZAZTESA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001371828914 1340706266 /nfs/dbraw/zinc/70/62/66/1340706266.db2.gz FGMVLKUIRGMPHM-MAUKXSAKSA-N 1 3 331.504 2.630 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@@H](C)NCc1c(F)cccc1F)[NH+](C)C ZINC001371870807 1340732721 /nfs/dbraw/zinc/73/27/21/1340732721.db2.gz XANGWNZVJUUHCL-DYVFJYSZSA-N 1 3 341.446 2.535 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(F)cc1C ZINC001371886651 1340739819 /nfs/dbraw/zinc/73/98/19/1340739819.db2.gz INJXPGCZCCDCIU-VQIMIIECSA-N 1 3 349.494 2.993 10 0 EFAEHO CCCN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)Cc1ccc(C)c(F)c1 ZINC001372742012 1340785845 /nfs/dbraw/zinc/78/58/45/1340785845.db2.gz QAUVBQAPNCFTAQ-SFHVURJKSA-N 1 3 349.494 2.804 10 0 EFAEHO CCCN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)Cc1ccc(C)c(F)c1 ZINC001372742012 1340785847 /nfs/dbraw/zinc/78/58/47/1340785847.db2.gz QAUVBQAPNCFTAQ-SFHVURJKSA-N 1 3 349.494 2.804 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@H+](C2CC2)[C@H]2CCc3ccccc32)C1 ZINC001372862570 1340850767 /nfs/dbraw/zinc/85/07/67/1340850767.db2.gz ZCECIOKGJJYRGQ-JXFKEZNVSA-N 1 3 341.499 2.596 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@@H+](C2CC2)[C@H]2CCc3ccccc32)C1 ZINC001372862570 1340850771 /nfs/dbraw/zinc/85/07/71/1340850771.db2.gz ZCECIOKGJJYRGQ-JXFKEZNVSA-N 1 3 341.499 2.596 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@H+](C2CC2)[C@@H]2CCc3ccccc32)C1 ZINC001372862576 1340850821 /nfs/dbraw/zinc/85/08/21/1340850821.db2.gz ZCECIOKGJJYRGQ-OXQOHEQNSA-N 1 3 341.499 2.596 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)C1 ZINC001372862576 1340850826 /nfs/dbraw/zinc/85/08/26/1340850826.db2.gz ZCECIOKGJJYRGQ-OXQOHEQNSA-N 1 3 341.499 2.596 10 0 EFAEHO CC[C@H](C)C[NH2+][C@@H](CNC(=O)C1(N(C)C)CCC1)c1ccccc1 ZINC001373070117 1340891081 /nfs/dbraw/zinc/89/10/81/1340891081.db2.gz ZAUXPFKJPQKKEA-WMZOPIPTSA-N 1 3 331.504 2.964 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2csc(C)c2)C1)N(C)C ZINC001373202240 1340945978 /nfs/dbraw/zinc/94/59/78/1340945978.db2.gz SWYDFOYTABEMDK-NVXWUHKLSA-N 1 3 337.533 2.725 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2csc(C)c2)C1)N(C)C ZINC001373202240 1340945979 /nfs/dbraw/zinc/94/59/79/1340945979.db2.gz SWYDFOYTABEMDK-NVXWUHKLSA-N 1 3 337.533 2.725 10 0 EFAEHO CCCC[N@@H+]1CC[C@@H](CCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001373226417 1340956713 /nfs/dbraw/zinc/95/67/13/1340956713.db2.gz MCWSGIOUIDXBRK-APWZRJJASA-N 1 3 341.515 2.827 10 0 EFAEHO CCCC[N@H+]1CC[C@@H](CCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001373226417 1340956715 /nfs/dbraw/zinc/95/67/15/1340956715.db2.gz MCWSGIOUIDXBRK-APWZRJJASA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001373241396 1340964026 /nfs/dbraw/zinc/96/40/26/1340964026.db2.gz BBAWFWRFPRVLFX-SFHVURJKSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001373241396 1340964027 /nfs/dbraw/zinc/96/40/27/1340964027.db2.gz BBAWFWRFPRVLFX-SFHVURJKSA-N 1 3 331.504 2.663 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC001373381063 1341005889 /nfs/dbraw/zinc/00/58/89/1341005889.db2.gz UWZCDMWJMXVHGY-RTBURBONSA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC001373381063 1341005891 /nfs/dbraw/zinc/00/58/91/1341005891.db2.gz UWZCDMWJMXVHGY-RTBURBONSA-N 1 3 329.488 2.642 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1C[NH+](CC2CCC3(CC3)CC2)C1 ZINC001373558830 1341053648 /nfs/dbraw/zinc/05/36/48/1341053648.db2.gz APLJZNNNMQEVQG-IRXDYDNUSA-N 1 3 347.547 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCN(CCc2cccs2)C1)[NH+]1CCCC1 ZINC001373651757 1341084419 /nfs/dbraw/zinc/08/44/19/1341084419.db2.gz OKBKRVHDVCFYFM-AEFFLSMTSA-N 1 3 349.544 2.602 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccc(F)cc1C ZINC001373754947 1341135280 /nfs/dbraw/zinc/13/52/80/1341135280.db2.gz QRGFGOJHGFZBRL-MOPGFXCFSA-N 1 3 349.494 2.991 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1ccc(C)c(F)c1 ZINC001373759169 1341137105 /nfs/dbraw/zinc/13/71/05/1341137105.db2.gz JNFQCFTYLGPPGI-IEBWSBKVSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]C[C@H]1CCc2ccccc2C1 ZINC001373832332 1341166773 /nfs/dbraw/zinc/16/67/73/1341166773.db2.gz CNAQADUGXNZSSP-PXNSSMCTSA-N 1 3 345.531 2.616 10 0 EFAEHO CC[C@H](C(=O)NCc1ccc(C[NH2+]CC2CCCC2)cc1)N(C)C ZINC001373934371 1341216372 /nfs/dbraw/zinc/21/63/72/1341216372.db2.gz OJSIBBVRNZLADZ-LJQANCHMSA-N 1 3 331.504 2.923 10 0 EFAEHO CN(CC(=O)NCC[C@H]1CC[N@H+](Cc2ccsc2)C1)C1CCC1 ZINC001391307420 1355050476 /nfs/dbraw/zinc/05/04/76/1355050476.db2.gz FNGRKWBGHMIRPO-HNNXBMFYSA-N 1 3 335.517 2.561 10 0 EFAEHO CN(CC(=O)NCC[C@H]1CC[N@@H+](Cc2ccsc2)C1)C1CCC1 ZINC001391307420 1355050482 /nfs/dbraw/zinc/05/04/82/1355050482.db2.gz FNGRKWBGHMIRPO-HNNXBMFYSA-N 1 3 335.517 2.561 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]Cc1ccc(CF)cc1 ZINC001373974500 1341268883 /nfs/dbraw/zinc/26/88/83/1341268883.db2.gz ZRWCIGNRNOFPOK-GOSISDBHSA-N 1 3 335.467 2.577 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)[C@H](C)CNCc2cc(C)ccc2F)CC[N@@H+]1C ZINC001374219971 1341570285 /nfs/dbraw/zinc/57/02/85/1341570285.db2.gz AKVZATYSZZDGJK-HHXXYDBFSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)[C@H](C)CNCc2cc(C)ccc2F)CC[N@H+]1C ZINC001374219971 1341570288 /nfs/dbraw/zinc/57/02/88/1341570288.db2.gz AKVZATYSZZDGJK-HHXXYDBFSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H](C)N(C)C(=O)[C@H]2CCCCN2C)c1 ZINC001374248865 1341606439 /nfs/dbraw/zinc/60/64/39/1341606439.db2.gz XCCUKQJZCAOKBK-CRAIPNDOSA-N 1 3 335.467 2.555 10 0 EFAEHO CC[C@H](F)CNC[C@@H](C)N(C)C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001374259715 1341623183 /nfs/dbraw/zinc/62/31/83/1341623183.db2.gz KWWAKGOEYZTRPK-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001374276902 1341648036 /nfs/dbraw/zinc/64/80/36/1341648036.db2.gz BOGATCMQUTVRRP-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@@H](CNCc1sccc1Cl)N(C)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001392063169 1355744323 /nfs/dbraw/zinc/74/43/23/1355744323.db2.gz LJMZYXUWYGYKPB-YNEHKIRRSA-N 1 3 343.924 2.678 10 0 EFAEHO C[C@@H](CNCc1sccc1Cl)N(C)C(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001392063169 1355744326 /nfs/dbraw/zinc/74/43/26/1355744326.db2.gz LJMZYXUWYGYKPB-YNEHKIRRSA-N 1 3 343.924 2.678 10 0 EFAEHO C[C@@H](C[NH2+]CC1CC2(CCC2)C1)N(C)C(=O)CN1CCC(C)CC1 ZINC001374303272 1341686792 /nfs/dbraw/zinc/68/67/92/1341686792.db2.gz INCLTDKHQWFNMO-KRWDZBQOSA-N 1 3 335.536 2.735 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1csc(C)c1 ZINC001374327695 1341730818 /nfs/dbraw/zinc/73/08/18/1341730818.db2.gz JSANDMYOBKODOW-WMLDXEAASA-N 1 3 337.533 2.867 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)c1 ZINC001374435118 1341918190 /nfs/dbraw/zinc/91/81/90/1341918190.db2.gz ZOJHRXKAXXHTPC-JXFKEZNVSA-N 1 3 345.531 2.876 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]C/C=C/Cl ZINC001374438634 1341922213 /nfs/dbraw/zinc/92/22/13/1341922213.db2.gz HRVFMSUMFANKAV-GFXFGIRVSA-N 1 3 329.916 2.732 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CNCc2ccccc2Cl)CC[N@@H+]1C ZINC001392561505 1356121705 /nfs/dbraw/zinc/12/17/05/1356121705.db2.gz ALURFLSOUCHHHT-JLJPHGGASA-N 1 3 337.895 2.665 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CNCc2ccccc2Cl)CC[N@H+]1C ZINC001392561505 1356121706 /nfs/dbraw/zinc/12/17/06/1356121706.db2.gz ALURFLSOUCHHHT-JLJPHGGASA-N 1 3 337.895 2.665 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001374505710 1341994936 /nfs/dbraw/zinc/99/49/36/1341994936.db2.gz FETINHAZVDDYPQ-SJLPKXTDSA-N 1 3 349.544 2.698 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001374505710 1341994940 /nfs/dbraw/zinc/99/49/40/1341994940.db2.gz FETINHAZVDDYPQ-SJLPKXTDSA-N 1 3 349.544 2.698 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[N@H+](C)CC[C@H]1CCCC1(F)F)N(C)C ZINC001374507244 1341997204 /nfs/dbraw/zinc/99/72/04/1341997204.db2.gz QEUHKXOZERGHSY-HUUCEWRRSA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[N@@H+](C)CC[C@H]1CCCC1(F)F)N(C)C ZINC001374507244 1341997210 /nfs/dbraw/zinc/99/72/10/1341997210.db2.gz QEUHKXOZERGHSY-HUUCEWRRSA-N 1 3 333.467 2.542 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001374551645 1342060190 /nfs/dbraw/zinc/06/01/90/1342060190.db2.gz ZNVUMZPLKXIRKI-CVEARBPZSA-N 1 3 347.494 2.788 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001374551645 1342060196 /nfs/dbraw/zinc/06/01/96/1342060196.db2.gz ZNVUMZPLKXIRKI-CVEARBPZSA-N 1 3 347.494 2.788 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H]2CCC[C@H]2NC(=O)CN(C)C(C)C)cs1 ZINC001374565325 1342079009 /nfs/dbraw/zinc/07/90/09/1342079009.db2.gz BZQLSNYGBYPQRV-DLBZAZTESA-N 1 3 337.533 2.771 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H]2CCC[C@H]2NC(=O)CN(C)C(C)C)c1 ZINC001374569002 1342081497 /nfs/dbraw/zinc/08/14/97/1342081497.db2.gz KYFOKXGEQZFTTL-RBUKOAKNSA-N 1 3 331.504 2.710 10 0 EFAEHO C[C@H](CC[NH2+][C@@H]1CCc2ccccc21)NC(=O)C1(N(C)C)CCC1 ZINC001374691673 1342110679 /nfs/dbraw/zinc/11/06/79/1342110679.db2.gz FVLCUVPXEONPKK-CRAIPNDOSA-N 1 3 329.488 2.643 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc2ccccc2c1)NC(=O)CN1CC[C@H](C)C1 ZINC001374814299 1342186134 /nfs/dbraw/zinc/18/61/34/1342186134.db2.gz LYDJJLDPRFKEAI-DLBZAZTESA-N 1 3 339.483 2.776 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001374847814 1342204138 /nfs/dbraw/zinc/20/41/38/1342204138.db2.gz AJGWPAVANZDIBT-BEFAXECRSA-N 1 3 342.487 2.637 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1C ZINC001375047303 1342346650 /nfs/dbraw/zinc/34/66/50/1342346650.db2.gz QZMNOIYDWMAVQQ-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1C ZINC001375047303 1342346659 /nfs/dbraw/zinc/34/66/59/1342346659.db2.gz QZMNOIYDWMAVQQ-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C(C)(C)C)cc1)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001375153108 1342468835 /nfs/dbraw/zinc/46/88/35/1342468835.db2.gz CFYRNLAQPNWUFQ-FUHWJXTLSA-N 1 3 345.531 2.872 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C(C)(C)C)cc1)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001375153108 1342468839 /nfs/dbraw/zinc/46/88/39/1342468839.db2.gz CFYRNLAQPNWUFQ-FUHWJXTLSA-N 1 3 345.531 2.872 10 0 EFAEHO CC(C)c1ccccc1CN(C)C[C@@H](C)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001375156402 1342472892 /nfs/dbraw/zinc/47/28/92/1342472892.db2.gz WWBZNDICEGYEKT-SJLPKXTDSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)c1ccccc1CN(C)C[C@@H](C)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001375156402 1342472895 /nfs/dbraw/zinc/47/28/95/1342472895.db2.gz WWBZNDICEGYEKT-SJLPKXTDSA-N 1 3 331.504 2.698 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](NC(=O)CN(C)C(C)C)C2CC2)cc1C ZINC001375277635 1342584138 /nfs/dbraw/zinc/58/41/38/1342584138.db2.gz OLVAPRHJDQSSMH-IBGZPJMESA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]Cc1ccccc1F ZINC001375280982 1342588470 /nfs/dbraw/zinc/58/84/70/1342588470.db2.gz GAHXOGSRDNJNAU-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@H]1CCN1Cc1c(C)cc(C)cc1C ZINC001375356455 1342661969 /nfs/dbraw/zinc/66/19/69/1342661969.db2.gz LSGIYQZSKDZUJM-GOSISDBHSA-N 1 3 331.504 2.644 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@H]1CCN1Cc1c(C)cc(C)cc1C ZINC001375356455 1342661971 /nfs/dbraw/zinc/66/19/71/1342661971.db2.gz LSGIYQZSKDZUJM-GOSISDBHSA-N 1 3 331.504 2.644 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@@H+]2CCCC2CCCC2)C1 ZINC001375464103 1342769740 /nfs/dbraw/zinc/76/97/40/1342769740.db2.gz GMZJDMREXQDMEZ-MJGOQNOKSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@H+]2CCCC2CCCC2)C1 ZINC001375464103 1342769743 /nfs/dbraw/zinc/76/97/43/1342769743.db2.gz GMZJDMREXQDMEZ-MJGOQNOKSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@@H]([NH2+]CC2CCC3(CC3)CC2)C1)N(C)C ZINC001375510609 1342817706 /nfs/dbraw/zinc/81/77/06/1342817706.db2.gz ORJFRGOCLWVSRD-KSZLIROESA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)s2)C1 ZINC001375511700 1342818516 /nfs/dbraw/zinc/81/85/16/1342818516.db2.gz OUKSXGXVESBGIF-BETUJISGSA-N 1 3 343.924 2.726 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1(N[C@@H](C)c2cccc(Cl)c2)CC1 ZINC001375519066 1342827923 /nfs/dbraw/zinc/82/79/23/1342827923.db2.gz VQGKCKVUQVEHTR-AWEZNQCLSA-N 1 3 337.895 2.981 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1(N[C@@H](C)c2cccc(Cl)c2)CC1 ZINC001375519066 1342827931 /nfs/dbraw/zinc/82/79/31/1342827931.db2.gz VQGKCKVUQVEHTR-AWEZNQCLSA-N 1 3 337.895 2.981 10 0 EFAEHO C[C@H](NC1(CNC(=O)C[C@H]2CC[N@H+](C)C2)CC1)c1cccc(Cl)c1 ZINC001375523805 1342833879 /nfs/dbraw/zinc/83/38/79/1342833879.db2.gz XKPHYIHORJROSK-LSDHHAIUSA-N 1 3 349.906 2.981 10 0 EFAEHO C[C@H](NC1(CNC(=O)C[C@H]2CC[N@@H+](C)C2)CC1)c1cccc(Cl)c1 ZINC001375523805 1342833888 /nfs/dbraw/zinc/83/38/88/1342833888.db2.gz XKPHYIHORJROSK-LSDHHAIUSA-N 1 3 349.906 2.981 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2C[C@H]([NH2+][C@@H]3CCc4ccccc43)C2)CCC1 ZINC001375538271 1342850276 /nfs/dbraw/zinc/85/02/76/1342850276.db2.gz MUYDAAAUMPPDEQ-SZVBFZGTSA-N 1 3 341.499 2.643 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CC[C@@H]([NH2+]Cc3ccccc3)C2)CCC1 ZINC001375575167 1342892903 /nfs/dbraw/zinc/89/29/03/1342892903.db2.gz KRSOLGVWQPZUJK-ZWKOTPCHSA-N 1 3 329.488 2.545 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001375574778 1342893491 /nfs/dbraw/zinc/89/34/91/1342893491.db2.gz DDWUCSQTZDJUQD-UQYDPPGPSA-N 1 3 343.515 2.915 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001375582606 1342901635 /nfs/dbraw/zinc/90/16/35/1342901635.db2.gz MNFIQNJJUGQIFE-QFBILLFUSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCN(C/C=C\Cl)CC(C)(C)C1)[NH+](C)C ZINC001375690788 1342932104 /nfs/dbraw/zinc/93/21/04/1342932104.db2.gz VACRVDILJNFOSJ-LTSYXSSYSA-N 1 3 343.943 2.932 10 0 EFAEHO CC[N@H+](C)[C@H](C(=O)N(C)C1CN(CCC(C)C)C1)c1ccccc1 ZINC001375721282 1342952733 /nfs/dbraw/zinc/95/27/33/1342952733.db2.gz WENQWIBMVSWZDD-IBGZPJMESA-N 1 3 331.504 2.868 10 0 EFAEHO CC[N@@H+](C)[C@H](C(=O)N(C)C1CN(CCC(C)C)C1)c1ccccc1 ZINC001375721282 1342952736 /nfs/dbraw/zinc/95/27/36/1342952736.db2.gz WENQWIBMVSWZDD-IBGZPJMESA-N 1 3 331.504 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@H]1CCCc2ccccc21 ZINC001375768039 1342989452 /nfs/dbraw/zinc/98/94/52/1342989452.db2.gz JAFFYELPYOYYEX-QUCCMNQESA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@@H]1CCCc2ccccc21 ZINC001375768041 1342989467 /nfs/dbraw/zinc/98/94/67/1342989467.db2.gz JAFFYELPYOYYEX-UYAOXDASSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]Cc1ccc(C2CC2)cc1 ZINC001375770439 1342990733 /nfs/dbraw/zinc/99/07/33/1342990733.db2.gz VHPOOXPTNDZCMK-HXUWFJFHSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)Oc1cccc(CN2CC[C@](C)(NC(=O)CC[NH+](C)C)C2)c1 ZINC001375841996 1343079313 /nfs/dbraw/zinc/07/93/13/1343079313.db2.gz IOBFKRJZZLUYRF-FQEVSTJZSA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1cc(CN2CC[C@@](C)(NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c(C)s1 ZINC001375851022 1343094427 /nfs/dbraw/zinc/09/44/27/1343094427.db2.gz RWSNGOODMJXWFK-QFBILLFUSA-N 1 3 349.544 2.787 10 0 EFAEHO Cc1cc(CN2CC[C@@](C)(NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c(C)s1 ZINC001375851022 1343094432 /nfs/dbraw/zinc/09/44/32/1343094432.db2.gz RWSNGOODMJXWFK-QFBILLFUSA-N 1 3 349.544 2.787 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(C)CCN(C/C=C/Cl)CC2)CC[N@@H+]1C ZINC001375920482 1343168374 /nfs/dbraw/zinc/16/83/74/1343168374.db2.gz AGEUPNFLNLITAD-FXEMMDDYSA-N 1 3 341.927 2.688 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(C)CCN(C/C=C/Cl)CC2)CC[N@H+]1C ZINC001375920482 1343168375 /nfs/dbraw/zinc/16/83/75/1343168375.db2.gz AGEUPNFLNLITAD-FXEMMDDYSA-N 1 3 341.927 2.688 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001376028950 1343270273 /nfs/dbraw/zinc/27/02/73/1343270273.db2.gz IAFFXHXIORAGKT-FGTMMUONSA-N 1 3 335.536 2.687 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(C)([NH2+]C/C=C\Cl)CC1 ZINC001393750165 1357124352 /nfs/dbraw/zinc/12/43/52/1357124352.db2.gz JHRABLGVNRGMCM-MLBQELRYSA-N 1 3 327.900 2.584 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC12CC[NH+](CCC1CCCC1)CC2)N(C)C ZINC001376175368 1343375623 /nfs/dbraw/zinc/37/56/23/1343375623.db2.gz UWJJTHJXLOWJJZ-QZTJIDSGSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC12CC[NH+](CC1CC3(CCC3)C1)CC2 ZINC001376180752 1343382168 /nfs/dbraw/zinc/38/21/68/1343382168.db2.gz RICROEKWDVFTJV-GOSISDBHSA-N 1 3 347.547 2.879 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NC[C@H](NCC=C(Cl)Cl)C1CC1 ZINC001376210941 1343401453 /nfs/dbraw/zinc/40/14/53/1343401453.db2.gz BEUAXPLAIGTASX-KBPBESRZSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NC[C@H](NCC=C(Cl)Cl)C1CC1 ZINC001376210941 1343401455 /nfs/dbraw/zinc/40/14/55/1343401455.db2.gz BEUAXPLAIGTASX-KBPBESRZSA-N 1 3 348.318 2.663 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](CNC(=O)CN2CC[C@H](C)C2)C2CC2)c1 ZINC001376250265 1343427724 /nfs/dbraw/zinc/42/77/24/1343427724.db2.gz GXSGVIPWPHKEDG-MGPUTAFESA-N 1 3 343.515 2.630 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](CNC(=O)CN2CC[C@@H](C)C2)C2CC2)c1 ZINC001376250260 1343427766 /nfs/dbraw/zinc/42/77/66/1343427766.db2.gz GXSGVIPWPHKEDG-FOIQADDNSA-N 1 3 343.515 2.630 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C2CC2)cc1C ZINC001376277702 1343446692 /nfs/dbraw/zinc/44/66/92/1343446692.db2.gz KZHRYOLMNJNHAC-IBGZPJMESA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC1CC[NH+](C)CC1 ZINC001376302163 1343468346 /nfs/dbraw/zinc/46/83/46/1343468346.db2.gz HRTFCMNGONOMNH-KDURUIRLSA-N 1 3 335.536 2.830 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CC[C@H]([NH2+]Cc2cc(C)ccc2C)C1 ZINC001376322412 1343482093 /nfs/dbraw/zinc/48/20/93/1343482093.db2.gz LPLSWWLWNOXZDS-RBUKOAKNSA-N 1 3 349.494 2.674 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([C@@H](C)[NH2+]CC2CC3(CCC3)C2)C1 ZINC001376350677 1343504855 /nfs/dbraw/zinc/50/48/55/1343504855.db2.gz UMCNUGYSGCZMNW-SJLPKXTDSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@@H](F)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C2 ZINC001376376508 1343528944 /nfs/dbraw/zinc/52/89/44/1343528944.db2.gz IOVPDTWASYUSTK-UYTYNIKBSA-N 1 3 341.515 2.680 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C2 ZINC001376376508 1343528945 /nfs/dbraw/zinc/52/89/45/1343528945.db2.gz IOVPDTWASYUSTK-UYTYNIKBSA-N 1 3 341.515 2.680 10 0 EFAEHO C[C@@H]([NH2+][C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)C1)c1ccc(F)cc1 ZINC001376462976 1343610608 /nfs/dbraw/zinc/61/06/08/1343610608.db2.gz KANJNXZONIWSMF-XYPHTWIQSA-N 1 3 333.451 2.608 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@H+](Cc2ccsc2)CC1(C)C ZINC001393765681 1357138089 /nfs/dbraw/zinc/13/80/89/1357138089.db2.gz FMXNEMOHSKZYCQ-MRXNPFEDSA-N 1 3 337.533 2.807 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@@H+](Cc2ccsc2)CC1(C)C ZINC001393765681 1357138091 /nfs/dbraw/zinc/13/80/91/1357138091.db2.gz FMXNEMOHSKZYCQ-MRXNPFEDSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(F)cc2F)C1)N(C)C ZINC001376469747 1343614100 /nfs/dbraw/zinc/61/41/00/1343614100.db2.gz OLBOPYPYIJDXTH-HVOFVXBASA-N 1 3 339.430 2.603 10 0 EFAEHO CC[C@@H]([NH2+][C@@H]1C[C@H](NC(=O)[C@H](CC)N(C)C)C1)c1ccc(F)cc1 ZINC001376486748 1343622232 /nfs/dbraw/zinc/62/22/32/1343622232.db2.gz HDGLVIYFIAJIMY-XDNAFOTISA-N 1 3 335.467 2.854 10 0 EFAEHO CCCc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)cc1 ZINC001376486581 1343622464 /nfs/dbraw/zinc/62/24/64/1343622464.db2.gz FWHUCVHXXXQKIG-ZCNNSNEGSA-N 1 3 345.531 2.962 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccc(F)cc32)C1)N(C)C ZINC001376488166 1343623185 /nfs/dbraw/zinc/62/31/85/1343623185.db2.gz KDMVSBMZTZVVPE-JFRXWTBNSA-N 1 3 347.478 2.780 10 0 EFAEHO Cc1cc(F)ccc1CN1CC[C@H](NC(=O)CC[NH+](C)C)C(C)(C)C1 ZINC001393770175 1357140157 /nfs/dbraw/zinc/14/01/57/1357140157.db2.gz RXQKSWWEZWLAIF-SFHVURJKSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1cc(F)ccc1CN1CC[C@@H](NC(=O)CC[NH+](C)C)C(C)(C)C1 ZINC001393770167 1357140278 /nfs/dbraw/zinc/14/02/78/1357140278.db2.gz RXQKSWWEZWLAIF-GOSISDBHSA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@@H](c1ccccc1F)N1CCC[C@H](CNC(=O)CC[NH+](C)C)C1 ZINC001376536427 1343662216 /nfs/dbraw/zinc/66/22/16/1343662216.db2.gz DILMEMAKXZYQAC-JKSUJKDBSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N1CCC[C@@H](CNC(=O)CC[NH+](C)C)C1 ZINC001376542906 1343666640 /nfs/dbraw/zinc/66/66/40/1343666640.db2.gz QUXFAAAUKKBHKQ-CVEARBPZSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@@H]([NH2+]CC1CC1)c1ccc(CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001376577846 1343696345 /nfs/dbraw/zinc/69/63/45/1343696345.db2.gz SCYXENJNACZITB-HZPDHXFCSA-N 1 3 329.488 2.705 10 0 EFAEHO CC(C)[C@H](C(=O)NC1CCC([NH2+]Cc2ccsc2)CC1)N(C)C ZINC001376680592 1343761828 /nfs/dbraw/zinc/76/18/28/1343761828.db2.gz YRUZYQIITZFFML-OFLPRAFFSA-N 1 3 337.533 2.851 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)NCc1cc2ccccc2o1 ZINC001376713745 1343778545 /nfs/dbraw/zinc/77/85/45/1343778545.db2.gz BUVSOMKUHPHYCS-MAUKXSAKSA-N 1 3 343.471 2.900 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)NCc1cc2ccccc2o1 ZINC001376713745 1343778548 /nfs/dbraw/zinc/77/85/48/1343778548.db2.gz BUVSOMKUHPHYCS-MAUKXSAKSA-N 1 3 343.471 2.900 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)NCc1cc2ccccc2o1 ZINC001376713771 1343779259 /nfs/dbraw/zinc/77/92/59/1343779259.db2.gz BUVSOMKUHPHYCS-YJBOKZPZSA-N 1 3 343.471 2.900 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)NCc1cc2ccccc2o1 ZINC001376713771 1343779261 /nfs/dbraw/zinc/77/92/61/1343779261.db2.gz BUVSOMKUHPHYCS-YJBOKZPZSA-N 1 3 343.471 2.900 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)NCc1cc(C)ccc1F ZINC001376731243 1343788586 /nfs/dbraw/zinc/78/85/86/1343788586.db2.gz NFQZLWODBDFICV-QAPCUYQASA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)NCc1cc(C)ccc1F ZINC001376731243 1343788588 /nfs/dbraw/zinc/78/85/88/1343788588.db2.gz NFQZLWODBDFICV-QAPCUYQASA-N 1 3 335.467 2.603 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)NCc1ccc(Cl)s1 ZINC001376790582 1343841749 /nfs/dbraw/zinc/84/17/49/1343841749.db2.gz HQOQLBDPRINMAG-AVGNSLFASA-N 1 3 343.924 2.726 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)NCc1ccc(Cl)s1 ZINC001376790582 1343841753 /nfs/dbraw/zinc/84/17/53/1343841753.db2.gz HQOQLBDPRINMAG-AVGNSLFASA-N 1 3 343.924 2.726 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@@H]2CCCCN2C(C)C)cc1 ZINC001376826646 1343876136 /nfs/dbraw/zinc/87/61/36/1343876136.db2.gz PZWNMHNRZOEPMR-HKUYNNGSSA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CNC(=O)[C@H]2CCCCN2C(C)C)cc1 ZINC001376826650 1343876228 /nfs/dbraw/zinc/87/62/28/1343876228.db2.gz PZWNMHNRZOEPMR-IEBWSBKVSA-N 1 3 331.504 2.852 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC001376883766 1343919820 /nfs/dbraw/zinc/91/98/20/1343919820.db2.gz SZDSBGSYIOZGQY-KGLIPLIRSA-N 1 3 325.884 2.836 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[N@H+](Cc2cc(C)ccc2F)CC1 ZINC001376911459 1343950479 /nfs/dbraw/zinc/95/04/79/1343950479.db2.gz KGNITUHILBAVEY-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[N@@H+](Cc2cc(C)ccc2F)CC1 ZINC001376911459 1343950481 /nfs/dbraw/zinc/95/04/81/1343950481.db2.gz KGNITUHILBAVEY-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](NCc2ccccc2F)C1)[NH+](CC)CC ZINC001376912282 1343951184 /nfs/dbraw/zinc/95/11/84/1343951184.db2.gz OHTCSWPHRSMSMV-FUHWJXTLSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)(C(=O)N1CC[C@@H](CNC/C(Cl)=C\Cl)C1)[NH+]1CCCC1 ZINC001376941694 1343972691 /nfs/dbraw/zinc/97/26/91/1343972691.db2.gz OHKOMGOZTAYFFF-FYQHACEVSA-N 1 3 348.318 2.618 10 0 EFAEHO CN(CCCN(C)C(=O)CC[NH+](C)C)Cc1ccc(F)c(Cl)c1 ZINC001376970075 1343998528 /nfs/dbraw/zinc/99/85/28/1343998528.db2.gz FAVNRDSSYAAZNW-UHFFFAOYSA-N 1 3 343.874 2.711 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)[C@H]1CCCC[N@@H+]1C(C)C ZINC001376990896 1344026831 /nfs/dbraw/zinc/02/68/31/1344026831.db2.gz HXWXMQCROSKYOL-IAGOWNOFSA-N 1 3 329.504 2.778 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)[C@H]1CCCC[N@H+]1C(C)C ZINC001376990896 1344026833 /nfs/dbraw/zinc/02/68/33/1344026833.db2.gz HXWXMQCROSKYOL-IAGOWNOFSA-N 1 3 329.504 2.778 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCN(C)C(=O)CN2CCCC2)cc1F ZINC001377014882 1344061745 /nfs/dbraw/zinc/06/17/45/1344061745.db2.gz BFXXSYPNZMJGJQ-UHFFFAOYSA-N 1 3 335.467 2.510 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCN(C)C(=O)CN2CCCC2)cc1F ZINC001377014882 1344061747 /nfs/dbraw/zinc/06/17/47/1344061747.db2.gz BFXXSYPNZMJGJQ-UHFFFAOYSA-N 1 3 335.467 2.510 10 0 EFAEHO CC(=O)N1C[C@H]2CC[C@@H](C1)[N@H+]2C1CCN(C[C@H](C)CC(C)C)CC1 ZINC001377031749 1344078117 /nfs/dbraw/zinc/07/81/17/1344078117.db2.gz LATBFAPVWHYQQF-AHRSYUTCSA-N 1 3 335.536 2.828 10 0 EFAEHO CC(=O)N1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CCN(C[C@H](C)CC(C)C)CC1 ZINC001377031749 1344078123 /nfs/dbraw/zinc/07/81/23/1344078123.db2.gz LATBFAPVWHYQQF-AHRSYUTCSA-N 1 3 335.536 2.828 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@H](C)C2)c(C)s1 ZINC001377070825 1344115105 /nfs/dbraw/zinc/11/51/05/1344115105.db2.gz WLLMYLGHITVBEN-KBPBESRZSA-N 1 3 337.533 2.691 10 0 EFAEHO CCC1([NH2+]C/C=C\Cl)CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001377112962 1344137612 /nfs/dbraw/zinc/13/76/12/1344137612.db2.gz CDWHTFKWKQTHFA-WDZFZDKYSA-N 1 3 327.900 2.584 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](CC1CC(C)(C)C1)C1CC1 ZINC001377567535 1344177411 /nfs/dbraw/zinc/17/74/11/1344177411.db2.gz LEAURVISZQLJFD-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](CC1CC(C)(C)C1)C1CC1 ZINC001377567535 1344177415 /nfs/dbraw/zinc/17/74/15/1344177415.db2.gz LEAURVISZQLJFD-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](F)C[N@H+](CC)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001377588445 1344194624 /nfs/dbraw/zinc/19/46/24/1344194624.db2.gz LTANZYRSZBAGDB-KRWDZBQOSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](F)C[N@@H+](CC)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001377588445 1344194630 /nfs/dbraw/zinc/19/46/30/1344194630.db2.gz LTANZYRSZBAGDB-KRWDZBQOSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+][C@@H](C)c1ccc(F)c(Cl)c1 ZINC001377605315 1344211841 /nfs/dbraw/zinc/21/18/41/1344211841.db2.gz VYCNEKQJLIBRSA-ZDUSSCGKSA-N 1 3 343.874 2.928 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+][C@H]1CCc2ccccc21 ZINC001377606596 1344213163 /nfs/dbraw/zinc/21/31/63/1344213163.db2.gz YEGNXDYQPHUEAK-RBUKOAKNSA-N 1 3 329.488 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H](C)[NH2+]CCC(C)(C)C)CC1 ZINC001377613886 1344222363 /nfs/dbraw/zinc/22/23/63/1344222363.db2.gz WATQNYXXPFUCTR-INIZCTEOSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CCCCN2C(=O)CN(C)C(C)C)cc1F ZINC001377617491 1344225178 /nfs/dbraw/zinc/22/51/78/1344225178.db2.gz XTANWEYRSKIASJ-SFHVURJKSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)C[NH2+][C@H](CNC(=O)[C@H]1CCCN1C(C)C)c1ccccc1 ZINC001377618730 1344227150 /nfs/dbraw/zinc/22/71/50/1344227150.db2.gz GNAVCWCYROPXJU-RTBURBONSA-N 1 3 331.504 2.962 10 0 EFAEHO CC[C@H](F)C[NH2+][C@@H](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001377619774 1344229061 /nfs/dbraw/zinc/22/90/61/1344229061.db2.gz XPPAVYUXLCIQBQ-RDJZCZTQSA-N 1 3 343.531 2.929 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H]2C[N@H+](C)CCCC2CCC2)C1 ZINC001377659940 1344281537 /nfs/dbraw/zinc/28/15/37/1344281537.db2.gz HFWKSTONFXAXEJ-PKOBYXMFSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H]2C[N@@H+](C)CCCC2CCC2)C1 ZINC001377659940 1344281541 /nfs/dbraw/zinc/28/15/41/1344281541.db2.gz HFWKSTONFXAXEJ-PKOBYXMFSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001377675729 1344305187 /nfs/dbraw/zinc/30/51/87/1344305187.db2.gz WTCFFQNNAYQRRF-UYAOXDASSA-N 1 3 343.515 2.939 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001377675729 1344305189 /nfs/dbraw/zinc/30/51/89/1344305189.db2.gz WTCFFQNNAYQRRF-UYAOXDASSA-N 1 3 343.515 2.939 10 0 EFAEHO CN(CC(=O)NCC[C@@H]1CC[N@H+](CC2CCCC2)C1)CC(C)(C)C ZINC001377712337 1344359116 /nfs/dbraw/zinc/35/91/16/1344359116.db2.gz WNRDIHDAHAXLDY-GOSISDBHSA-N 1 3 337.552 2.983 10 0 EFAEHO CN(CC(=O)NCC[C@@H]1CC[N@@H+](CC2CCCC2)C1)CC(C)(C)C ZINC001377712337 1344359119 /nfs/dbraw/zinc/35/91/19/1344359119.db2.gz WNRDIHDAHAXLDY-GOSISDBHSA-N 1 3 337.552 2.983 10 0 EFAEHO CN(C)C1(C(=O)NC2CC(C[NH2+]CC3CCCCCC3)C2)CCC1 ZINC001377715209 1344362116 /nfs/dbraw/zinc/36/21/16/1344362116.db2.gz KUMUONJWCHTVOZ-UHFFFAOYSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)CC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001377786741 1344437754 /nfs/dbraw/zinc/43/77/54/1344437754.db2.gz BZECQYANOFESNX-AEFFLSMTSA-N 1 3 325.541 2.789 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)CC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001377786741 1344437758 /nfs/dbraw/zinc/43/77/58/1344437758.db2.gz BZECQYANOFESNX-AEFFLSMTSA-N 1 3 325.541 2.789 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCCC1)[C@@H](C)[NH2+]Cc1ccccc1 ZINC001377804355 1344454892 /nfs/dbraw/zinc/45/48/92/1344454892.db2.gz VHEQYYAGAKMJCM-IAGOWNOFSA-N 1 3 331.504 2.934 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001377862792 1344524618 /nfs/dbraw/zinc/52/46/18/1344524618.db2.gz NKIGTPPDBRHWRZ-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001377862792 1344524622 /nfs/dbraw/zinc/52/46/22/1344524622.db2.gz NKIGTPPDBRHWRZ-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)c1ccc(CN2CCC[C@@H](NC(=O)CC[NH+](C)C)C2)cc1 ZINC001377879406 1344540655 /nfs/dbraw/zinc/54/06/55/1344540655.db2.gz YLNISIHVOTXOLN-LJQANCHMSA-N 1 3 331.504 2.842 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)[C@@H](C)NC(=O)C12CC[NH+](CC1)C2 ZINC001377888412 1344549656 /nfs/dbraw/zinc/54/96/56/1344549656.db2.gz YNLJSPSIFYYIJZ-LSDHHAIUSA-N 1 3 349.906 2.727 10 0 EFAEHO Cc1cc(CN2CC[C@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c(C)s1 ZINC001378062653 1344714663 /nfs/dbraw/zinc/71/46/63/1344714663.db2.gz JPTGXUMOZMAZSF-ROUUACIJSA-N 1 3 349.544 2.930 10 0 EFAEHO Cc1cc(CN2CC[C@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c(C)s1 ZINC001378062653 1344714665 /nfs/dbraw/zinc/71/46/65/1344714665.db2.gz JPTGXUMOZMAZSF-ROUUACIJSA-N 1 3 349.544 2.930 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@H](C)CNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001378112849 1344774958 /nfs/dbraw/zinc/77/49/58/1344774958.db2.gz HWZIEGZTBHLICY-MRXNPFEDSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001378114884 1344777018 /nfs/dbraw/zinc/77/70/18/1344777018.db2.gz GJUJPTQSROYXLQ-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001378114884 1344777019 /nfs/dbraw/zinc/77/70/19/1344777019.db2.gz GJUJPTQSROYXLQ-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@H+](C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001378117223 1344779584 /nfs/dbraw/zinc/77/95/84/1344779584.db2.gz YKWSZRQJZCGZPQ-ARFHVFGLSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001378117223 1344779588 /nfs/dbraw/zinc/77/95/88/1344779588.db2.gz YKWSZRQJZCGZPQ-ARFHVFGLSA-N 1 3 345.478 2.589 10 0 EFAEHO Cc1ccc(CCC[N@@H+](C)[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001378140306 1344802648 /nfs/dbraw/zinc/80/26/48/1344802648.db2.gz LNWCOXMQRDLEOO-MOPGFXCFSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CCC[N@H+](C)[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001378140306 1344802651 /nfs/dbraw/zinc/80/26/51/1344802651.db2.gz LNWCOXMQRDLEOO-MOPGFXCFSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[N@H+](C)Cc1ccccc1C1CC1 ZINC001378150007 1344814034 /nfs/dbraw/zinc/81/40/34/1344814034.db2.gz WORXLARMXFTLFU-DLBZAZTESA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[N@@H+](C)Cc1ccccc1C1CC1 ZINC001378150007 1344814037 /nfs/dbraw/zinc/81/40/37/1344814037.db2.gz WORXLARMXFTLFU-DLBZAZTESA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H]1CCN(CC2CC(F)(F)C2)C1)[NH+](CC)CC ZINC001378167572 1344836547 /nfs/dbraw/zinc/83/65/47/1344836547.db2.gz HWCKGANAQWOCOJ-HZPDHXFCSA-N 1 3 345.478 2.685 10 0 EFAEHO C[C@@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)N(C)Cc1ccccc1C1CC1 ZINC001378181208 1344853020 /nfs/dbraw/zinc/85/30/20/1344853020.db2.gz GANIKYZDDRRPPN-DLBZAZTESA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)N(C)Cc1ccccc1C1CC1 ZINC001378181208 1344853024 /nfs/dbraw/zinc/85/30/24/1344853024.db2.gz GANIKYZDDRRPPN-DLBZAZTESA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)N(C)Cc1ccccc1C1CC1 ZINC001378181228 1344853085 /nfs/dbraw/zinc/85/30/85/1344853085.db2.gz GANIKYZDDRRPPN-IRXDYDNUSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)N(C)Cc1ccccc1C1CC1 ZINC001378181228 1344853090 /nfs/dbraw/zinc/85/30/90/1344853090.db2.gz GANIKYZDDRRPPN-IRXDYDNUSA-N 1 3 343.515 2.842 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@H+](Cc2cccc(C)c2)C1 ZINC001378185418 1344860089 /nfs/dbraw/zinc/86/00/89/1344860089.db2.gz BFIQPXNRQWLAPY-ICSRJNTNSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@@H+](Cc2cccc(C)c2)C1 ZINC001378185418 1344860092 /nfs/dbraw/zinc/86/00/92/1344860092.db2.gz BFIQPXNRQWLAPY-ICSRJNTNSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)[C@@H](C)N1CCCCCC1)[C@H]1CC[N@H+](CCC2CC2)C1 ZINC001378205282 1344886489 /nfs/dbraw/zinc/88/64/89/1344886489.db2.gz YWWFFLMXSWMGJZ-MJGOQNOKSA-N 1 3 335.536 2.974 10 0 EFAEHO CCN(C(=O)[C@@H](C)N1CCCCCC1)[C@H]1CC[N@@H+](CCC2CC2)C1 ZINC001378205282 1344886494 /nfs/dbraw/zinc/88/64/94/1344886494.db2.gz YWWFFLMXSWMGJZ-MJGOQNOKSA-N 1 3 335.536 2.974 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]Cc1ccccc1 ZINC001378295269 1344963670 /nfs/dbraw/zinc/96/36/70/1344963670.db2.gz NFAIMCCCOJDBGE-HKUYNNGSSA-N 1 3 331.504 2.936 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]CC1CC(F)(F)C1 ZINC001378297483 1344965281 /nfs/dbraw/zinc/96/52/81/1344965281.db2.gz PWYMCRXEVMFZSK-HZPDHXFCSA-N 1 3 345.478 2.779 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]CC1CC(F)(F)C1 ZINC001378297479 1344965677 /nfs/dbraw/zinc/96/56/77/1344965677.db2.gz PWYMCRXEVMFZSK-HOTGVXAUSA-N 1 3 345.478 2.779 10 0 EFAEHO CC[C@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)NCc1sccc1Cl ZINC001378316714 1344980091 /nfs/dbraw/zinc/98/00/91/1344980091.db2.gz KVZPUNYAZTWQIO-QWHCGFSZSA-N 1 3 343.924 2.728 10 0 EFAEHO CC[C@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)NCc1sccc1Cl ZINC001378316714 1344980088 /nfs/dbraw/zinc/98/00/88/1344980088.db2.gz KVZPUNYAZTWQIO-QWHCGFSZSA-N 1 3 343.924 2.728 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1cccc2cccnc21 ZINC001378334954 1344994824 /nfs/dbraw/zinc/99/48/24/1344994824.db2.gz FXHJEEDMRARAAN-GOSISDBHSA-N 1 3 342.487 2.559 10 0 EFAEHO C[C@@H]1CCCC[C@]1(CNCc1ccccc1F)NC(=O)CC[NH+](C)C ZINC001378441403 1345079481 /nfs/dbraw/zinc/07/94/81/1345079481.db2.gz YSNMNVGJUZQXDS-OXQOHEQNSA-N 1 3 349.494 2.932 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N[C@H]2CC[C@H](NC/C(Cl)=C\Cl)CC2)C1 ZINC001378455849 1345091947 /nfs/dbraw/zinc/09/19/47/1345091947.db2.gz SWCOHEXDKWYWLK-QTTSWBFFSA-N 1 3 348.318 2.664 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N[C@H]2CC[C@H](NC/C(Cl)=C\Cl)CC2)C1 ZINC001378455849 1345091950 /nfs/dbraw/zinc/09/19/50/1345091950.db2.gz SWCOHEXDKWYWLK-QTTSWBFFSA-N 1 3 348.318 2.664 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCCC[N@@H+]1CC1CC1)N1CCCC1 ZINC001378477266 1345111064 /nfs/dbraw/zinc/11/10/64/1345111064.db2.gz OKROHBUEPPZTKF-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCCC[N@H+]1CC1CC1)N1CCCC1 ZINC001378477266 1345111065 /nfs/dbraw/zinc/11/10/65/1345111065.db2.gz OKROHBUEPPZTKF-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)C1C[NH+]([C@@H]2CCc3ccccc32)C1 ZINC001378530556 1345143833 /nfs/dbraw/zinc/14/38/33/1345143833.db2.gz MDVZQDSFILZSOI-HNAYVOBHSA-N 1 3 341.499 2.595 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)C1C[NH+](CC2CC3(CCC3)C2)C1 ZINC001378530892 1345144434 /nfs/dbraw/zinc/14/44/34/1345144434.db2.gz GXLHGRISUGCZEU-MRXNPFEDSA-N 1 3 347.547 2.878 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)C[NH2+]CC1CC2(CCC2)C1 ZINC001378556973 1345161196 /nfs/dbraw/zinc/16/11/96/1345161196.db2.gz FKRROHBBQMXYCK-SJLPKXTDSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1cc(C)cc(C[NH+]2CC([C@@H](C)NC(=O)CN(C)C(C)C)C2)c1 ZINC001378581442 1345177472 /nfs/dbraw/zinc/17/74/72/1345177472.db2.gz AARVJEUSOQPPMT-QGZVFWFLSA-N 1 3 331.504 2.580 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@H+](CCCC2CCC2)CC1(C)C)N(C)C ZINC001378636681 1345215493 /nfs/dbraw/zinc/21/54/93/1345215493.db2.gz ASOBMYPTUCZQQY-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@@H+](CCCC2CCC2)CC1(C)C)N(C)C ZINC001378636681 1345215494 /nfs/dbraw/zinc/21/54/94/1345215494.db2.gz ASOBMYPTUCZQQY-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1cccc(CN2C[C@H](NC(=O)[C@@H](C(C)C)[NH+](C)C)C(C)(C)C2)c1 ZINC001378646087 1345221352 /nfs/dbraw/zinc/22/13/52/1345221352.db2.gz ATCWJRWEHCBOJW-RBUKOAKNSA-N 1 3 345.531 2.908 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@H+](CCC(C)(C)C)CC1(C)C)N(C)C ZINC001378645348 1345221950 /nfs/dbraw/zinc/22/19/50/1345221950.db2.gz LYYAYAFSHYYHPF-HOTGVXAUSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@H+](CCC(C)(C)C)CC1(C)C)N(C)C ZINC001378645347 1345221693 /nfs/dbraw/zinc/22/16/93/1345221693.db2.gz LYYAYAFSHYYHPF-CVEARBPZSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@@H+](CCC(C)(C)C)CC1(C)C)N(C)C ZINC001378645347 1345221698 /nfs/dbraw/zinc/22/16/98/1345221698.db2.gz LYYAYAFSHYYHPF-CVEARBPZSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@@H+](CCC(C)(C)C)CC1(C)C)N(C)C ZINC001378645348 1345221953 /nfs/dbraw/zinc/22/19/53/1345221953.db2.gz LYYAYAFSHYYHPF-HOTGVXAUSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@H+](CCCC2CCC2)CC1(C)C)N(C)C ZINC001378646890 1345222293 /nfs/dbraw/zinc/22/22/93/1345222293.db2.gz ASOBMYPTUCZQQY-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@@H+](CCCC2CCC2)CC1(C)C)N(C)C ZINC001378646890 1345222298 /nfs/dbraw/zinc/22/22/98/1345222298.db2.gz ASOBMYPTUCZQQY-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@H+](CC2CC2)CC1(C)C)N1CCCCC1 ZINC001378678457 1345244345 /nfs/dbraw/zinc/24/43/45/1345244345.db2.gz LOMRRXUHZWOMLY-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@@H+](CC2CC2)CC1(C)C)N1CCCCC1 ZINC001378678457 1345244347 /nfs/dbraw/zinc/24/43/47/1345244347.db2.gz LOMRRXUHZWOMLY-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1(CNC(=O)C(C)(C)N2CCCC2)CCCC1 ZINC001378705993 1345261705 /nfs/dbraw/zinc/26/17/05/1345261705.db2.gz GRRHYAFLQQHOII-OAHLLOKOSA-N 1 3 327.488 2.628 10 0 EFAEHO C[C@@H](c1ccccc1F)N1C[C@@H]2[C@@H](CNC(=O)CCC[NH+](C)C)[C@@H]2C1 ZINC001378720949 1345274281 /nfs/dbraw/zinc/27/42/81/1345274281.db2.gz IMBCOIJXGQMYJY-LEUOFYLZSA-N 1 3 347.478 2.523 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@@H](C)c3cccc(F)c3)C[C@H]21 ZINC001378740017 1345286232 /nfs/dbraw/zinc/28/62/32/1345286232.db2.gz APMOOGAYTYDEBG-UDTPNQRGSA-N 1 3 347.478 2.521 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@@H](C)c3cccc(F)c3)C[C@H]21 ZINC001378740017 1345286236 /nfs/dbraw/zinc/28/62/36/1345286236.db2.gz APMOOGAYTYDEBG-UDTPNQRGSA-N 1 3 347.478 2.521 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001378824160 1345341873 /nfs/dbraw/zinc/34/18/73/1345341873.db2.gz DCBAJTZVWIRASM-AEFFLSMTSA-N 1 3 331.504 2.582 10 0 EFAEHO C[C@@H](CNCc1sccc1Cl)N(C)C(=O)C[N@@H+]1CC[C@H](C)C1 ZINC001378837603 1345351133 /nfs/dbraw/zinc/35/11/33/1345351133.db2.gz WYJKPGXSPVMEMP-STQMWFEESA-N 1 3 343.924 2.680 10 0 EFAEHO C[C@@H](CNCc1sccc1Cl)N(C)C(=O)C[N@H+]1CC[C@H](C)C1 ZINC001378837603 1345351136 /nfs/dbraw/zinc/35/11/36/1345351136.db2.gz WYJKPGXSPVMEMP-STQMWFEESA-N 1 3 343.924 2.680 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(F)c(Cl)c1)N(C)C ZINC001378846470 1345359564 /nfs/dbraw/zinc/35/95/64/1345359564.db2.gz RGUNYCQDRZYDFR-BLLLJJGKSA-N 1 3 343.874 2.756 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccccc1C ZINC001378855910 1345367481 /nfs/dbraw/zinc/36/74/81/1345367481.db2.gz IHJLZZPTBCGBNU-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(OC)cc1 ZINC001378863583 1345373828 /nfs/dbraw/zinc/37/38/28/1345373828.db2.gz XSSKWGVKYLQGCM-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)C[C@H](C[NH2+]Cc1ccsc1)NC(=O)C1(N(C)C)CCC1 ZINC001378872415 1345381405 /nfs/dbraw/zinc/38/14/05/1345381405.db2.gz GWCVKDFFPMKFJB-MRXNPFEDSA-N 1 3 337.533 2.853 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@@H](C)CN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001379152472 1345628716 /nfs/dbraw/zinc/62/87/16/1345628716.db2.gz WKGZAWDXNOCMDP-HOTGVXAUSA-N 1 3 347.503 2.677 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001379280440 1345696390 /nfs/dbraw/zinc/69/63/90/1345696390.db2.gz GBZWOUUIOXJVSD-WMLDXEAASA-N 1 3 339.911 2.925 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]CCc1ccccc1F ZINC001379327906 1345731258 /nfs/dbraw/zinc/73/12/58/1345731258.db2.gz LRFUNGNRTKVEJF-LPHOPBHVSA-N 1 3 349.494 2.679 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]CCc1ccccc1F ZINC001379327913 1345731377 /nfs/dbraw/zinc/73/13/77/1345731377.db2.gz LRFUNGNRTKVEJF-VQIMIIECSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@H](CNCc1cc2ccccc2o1)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001379383831 1345757416 /nfs/dbraw/zinc/75/74/16/1345757416.db2.gz LYOPIHKFVGFACC-NVXWUHKLSA-N 1 3 343.471 2.902 10 0 EFAEHO C[C@H](CNCc1cc2ccccc2o1)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001379383831 1345757422 /nfs/dbraw/zinc/75/74/22/1345757422.db2.gz LYOPIHKFVGFACC-NVXWUHKLSA-N 1 3 343.471 2.902 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+][C@@H](C)c1cccc(Cl)c1)N(C)C ZINC001379521398 1345824967 /nfs/dbraw/zinc/82/49/67/1345824967.db2.gz JOLQFTOPTVIFMR-HEHGZKQESA-N 1 3 325.884 2.836 10 0 EFAEHO C[C@@H](NC[C@H](C)NC(=O)C12CC[NH+](CC1)C2)c1ccccc1Cl ZINC001379583971 1345890511 /nfs/dbraw/zinc/89/05/11/1345890511.db2.gz ZMFSHGLVDLTGNA-UONOGXRCSA-N 1 3 335.879 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc3c(c2)CCC3)C[C@H]1C ZINC001379589741 1345898047 /nfs/dbraw/zinc/89/80/47/1345898047.db2.gz UACCQBJMPRPEQE-UZLBHIALSA-N 1 3 343.515 2.595 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC001379598312 1345909356 /nfs/dbraw/zinc/90/93/56/1345909356.db2.gz LEPGRASBXFRZLR-ZDUSSCGKSA-N 1 3 345.409 2.640 10 0 EFAEHO CCCC[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001418790583 1374505421 /nfs/dbraw/zinc/50/54/21/1374505421.db2.gz WPUUBJAWHOIUMG-SFHVURJKSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCC[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001418790583 1374505426 /nfs/dbraw/zinc/50/54/26/1374505426.db2.gz WPUUBJAWHOIUMG-SFHVURJKSA-N 1 3 327.488 2.580 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)cc1F ZINC001393953538 1357318725 /nfs/dbraw/zinc/31/87/25/1357318725.db2.gz DYOZDWUQRGXMNN-CVEARBPZSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@@H](NC(=O)CCC[NH+](C)C)[C@H](C)NCc1cc2ccccc2o1 ZINC001393960830 1357326498 /nfs/dbraw/zinc/32/64/98/1357326498.db2.gz GPUREFVIYZHPGY-LSDHHAIUSA-N 1 3 331.460 2.757 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(CF)cc1)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001379722639 1347286237 /nfs/dbraw/zinc/28/62/37/1347286237.db2.gz IIKRISHQXDBATE-BXWFABGCSA-N 1 3 349.494 2.823 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(CF)cc1)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001379722639 1347286238 /nfs/dbraw/zinc/28/62/38/1347286238.db2.gz IIKRISHQXDBATE-BXWFABGCSA-N 1 3 349.494 2.823 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+][C@H]2CCc3ccccc32)C(C)(C)C1 ZINC001379730145 1347292175 /nfs/dbraw/zinc/29/21/75/1347292175.db2.gz MFIDTCYAIOWPOJ-OALUTQOASA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](C[N@H+](C)CC1CCC2(CC2)CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001379734238 1347294218 /nfs/dbraw/zinc/29/42/18/1347294218.db2.gz BFBUPIGLVPOVLR-IAGOWNOFSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@H](C[N@@H+](C)CC1CCC2(CC2)CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001379734238 1347294221 /nfs/dbraw/zinc/29/42/21/1347294221.db2.gz BFBUPIGLVPOVLR-IAGOWNOFSA-N 1 3 335.536 2.735 10 0 EFAEHO CCc1cccc(C[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001379745328 1347301909 /nfs/dbraw/zinc/30/19/09/1347301909.db2.gz QIYXYRGQFYTDGY-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(C[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001379745328 1347301911 /nfs/dbraw/zinc/30/19/11/1347301911.db2.gz QIYXYRGQFYTDGY-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C[NH2+]CC1CC(C)(C)C1)C1CC1 ZINC001379880525 1347384874 /nfs/dbraw/zinc/38/48/74/1347384874.db2.gz SQWCSYZUJUTTLM-MSOLQXFVSA-N 1 3 335.536 2.781 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]CC1CC(C)(C)C1)C1CC1 ZINC001379880533 1347384913 /nfs/dbraw/zinc/38/49/13/1347384913.db2.gz SQWCSYZUJUTTLM-ZWKOTPCHSA-N 1 3 335.536 2.781 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]CC1CC(C)(C)C1)C1CC1 ZINC001379880528 1347384977 /nfs/dbraw/zinc/38/49/77/1347384977.db2.gz SQWCSYZUJUTTLM-QZTJIDSGSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@@H+]1CC1CC(C)(C)C1)N1CCCCC1 ZINC001379976670 1347431805 /nfs/dbraw/zinc/43/18/05/1347431805.db2.gz WNNSATKHMDJNJP-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@H+]1CC1CC(C)(C)C1)N1CCCCC1 ZINC001379976670 1347431810 /nfs/dbraw/zinc/43/18/10/1347431810.db2.gz WNNSATKHMDJNJP-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO CCc1ccccc1CN(C)CCN(C(=O)[C@@H]1CC[N@H+](C)C1)C(C)C ZINC001380039128 1347478348 /nfs/dbraw/zinc/47/83/48/1347478348.db2.gz IGWMPGWBVBKDNF-HXUWFJFHSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1ccccc1CN(C)CCN(C(=O)[C@@H]1CC[N@@H+](C)C1)C(C)C ZINC001380039128 1347478350 /nfs/dbraw/zinc/47/83/50/1347478350.db2.gz IGWMPGWBVBKDNF-HXUWFJFHSA-N 1 3 345.531 2.870 10 0 EFAEHO CC(C)N(CC[N@H+](C)C[C@H]1CCC(F)(F)C1)C(=O)Cc1c[nH]cn1 ZINC001380040519 1347479295 /nfs/dbraw/zinc/47/92/95/1347479295.db2.gz FRAJZTKLFCUNJA-AWEZNQCLSA-N 1 3 342.434 2.556 10 0 EFAEHO CC(C)N(CC[N@@H+](C)C[C@H]1CCC(F)(F)C1)C(=O)Cc1c[nH]cn1 ZINC001380040519 1347479298 /nfs/dbraw/zinc/47/92/98/1347479298.db2.gz FRAJZTKLFCUNJA-AWEZNQCLSA-N 1 3 342.434 2.556 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1ccc(OC)cc1)C(C)(C)C)N(C)C ZINC001380092116 1347512092 /nfs/dbraw/zinc/51/20/92/1347512092.db2.gz YEYRWJXUSRXCMJ-MSOLQXFVSA-N 1 3 349.519 2.656 10 0 EFAEHO C[C@@H](NC1(CNC(=O)CC[C@H]2CCC[N@@H+]2C)CC1)c1ccc(F)cc1 ZINC001380100126 1347514546 /nfs/dbraw/zinc/51/45/46/1347514546.db2.gz DYBCTDTXAUOSEW-CRAIPNDOSA-N 1 3 347.478 3.000 10 0 EFAEHO C[C@@H](NC1(CNC(=O)CC[C@H]2CCC[N@H+]2C)CC1)c1ccc(F)cc1 ZINC001380100126 1347514548 /nfs/dbraw/zinc/51/45/48/1347514548.db2.gz DYBCTDTXAUOSEW-CRAIPNDOSA-N 1 3 347.478 3.000 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC001380127773 1347523777 /nfs/dbraw/zinc/52/37/77/1347523777.db2.gz DWVHYKRFEVWFAI-QGZVFWFLSA-N 1 3 331.504 2.745 10 0 EFAEHO Cc1ccc(F)cc1CNC1(CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)CC1 ZINC001380128657 1347524432 /nfs/dbraw/zinc/52/44/32/1347524432.db2.gz CGKULESTNFTAFQ-HOTGVXAUSA-N 1 3 347.478 2.603 10 0 EFAEHO Cc1ccc(F)cc1CNC1(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)CC1 ZINC001380128657 1347524435 /nfs/dbraw/zinc/52/44/35/1347524435.db2.gz CGKULESTNFTAFQ-HOTGVXAUSA-N 1 3 347.478 2.603 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C1CC[NH+](Cc2ccccc2)CC1)N(C)C ZINC001380132068 1347526294 /nfs/dbraw/zinc/52/62/94/1347526294.db2.gz WKDJQSKGBVJVAH-XLIONFOSSA-N 1 3 345.531 2.990 10 0 EFAEHO C[C@@H]([NH2+]C1(CNC(=O)C(C)(C)N2CCCC2)CC1)c1ccc(F)cc1 ZINC001380143670 1347531847 /nfs/dbraw/zinc/53/18/47/1347531847.db2.gz PIBVZWLLNDIUTB-OAHLLOKOSA-N 1 3 347.478 3.000 10 0 EFAEHO CN(C(=O)C(C)(C)[NH+]1CCCC1)C1CC(NCC=C(Cl)Cl)C1 ZINC001380166340 1347544397 /nfs/dbraw/zinc/54/43/97/1347544397.db2.gz HQAPDJGQOHXMJT-UHFFFAOYSA-N 1 3 348.318 2.759 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1(N[C@H](C)c2ccc(Cl)cc2)CC1 ZINC001380158990 1347540137 /nfs/dbraw/zinc/54/01/37/1347540137.db2.gz HJIQHKWJDGWYOX-CQSZACIVSA-N 1 3 337.895 2.981 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1(N[C@H](C)c2ccc(Cl)cc2)CC1 ZINC001380158990 1347540141 /nfs/dbraw/zinc/54/01/41/1347540141.db2.gz HJIQHKWJDGWYOX-CQSZACIVSA-N 1 3 337.895 2.981 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC([NH2+]CC2CCC3(CC3)CC2)C1)N(C)C ZINC001380173631 1347548355 /nfs/dbraw/zinc/54/83/55/1347548355.db2.gz WVRANMZVLUGGQS-ABHNRTSZSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001380179859 1347553099 /nfs/dbraw/zinc/55/30/99/1347553099.db2.gz GKVMVHPOYHMOQD-GOSISDBHSA-N 1 3 346.519 2.949 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001380179859 1347553101 /nfs/dbraw/zinc/55/31/01/1347553101.db2.gz GKVMVHPOYHMOQD-GOSISDBHSA-N 1 3 346.519 2.949 10 0 EFAEHO C[NH+](C)CCC(=O)NC1(C)CCN(C/C=C\c2ccccc2)CC1 ZINC001380304741 1347579351 /nfs/dbraw/zinc/57/93/51/1347579351.db2.gz GQLHWBFLHQYUQR-YFHOEESVSA-N 1 3 329.488 2.622 10 0 EFAEHO C[C@H](F)CC[NH+]1CCC(C)(NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001380318892 1347590035 /nfs/dbraw/zinc/59/00/35/1347590035.db2.gz UWJWYXOIBQYPRQ-HNNXBMFYSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001380411109 1347653882 /nfs/dbraw/zinc/65/38/82/1347653882.db2.gz WGUNGDKCPUHKGZ-TZIWHRDSSA-N 1 3 345.531 2.972 10 0 EFAEHO CN(C)C1(C(=O)NC[C@]2(C)CCC[N@H+](Cc3ccsc3)C2)CCC1 ZINC001380475152 1347705185 /nfs/dbraw/zinc/70/51/85/1347705185.db2.gz XMXVNLISEQTWCA-SFHVURJKSA-N 1 3 349.544 2.951 10 0 EFAEHO CN(C)C1(C(=O)NC[C@]2(C)CCC[N@@H+](Cc3ccsc3)C2)CCC1 ZINC001380475152 1347705189 /nfs/dbraw/zinc/70/51/89/1347705189.db2.gz XMXVNLISEQTWCA-SFHVURJKSA-N 1 3 349.544 2.951 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]CC)c1ccccc1CC ZINC001380658890 1347795165 /nfs/dbraw/zinc/79/51/65/1347795165.db2.gz ULTFLJGGVRMNBW-OALUTQOASA-N 1 3 331.504 2.890 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001380677352 1347805962 /nfs/dbraw/zinc/80/59/62/1347805962.db2.gz KVSDFBRNXOUOOR-QUCCMNQESA-N 1 3 345.531 2.970 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001380687449 1347814277 /nfs/dbraw/zinc/81/42/77/1347814277.db2.gz LRMAUCGCPPYRPB-FXAWDEMLSA-N 1 3 345.531 2.773 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2cc(C)cc(C)c2)C1 ZINC001380693914 1347818669 /nfs/dbraw/zinc/81/86/69/1347818669.db2.gz YOAIGMUXIVUJKA-QUCCMNQESA-N 1 3 345.531 2.829 10 0 EFAEHO CC[C@H](F)CN[C@H](C)c1ccc(CNC(=O)C23CC[NH+](CC2)C3)cc1 ZINC001380786115 1347877152 /nfs/dbraw/zinc/87/71/52/1347877152.db2.gz YJUGZEQCIIVLSS-QAPCUYQASA-N 1 3 347.478 2.797 10 0 EFAEHO C[C@@H](NC(=O)c1cccc(CN(C)C)c1)[C@H](C)[NH2+]CCC(F)(F)F ZINC001394006524 1357379162 /nfs/dbraw/zinc/37/91/62/1357379162.db2.gz SIQXSUNAOPDEFQ-QWHCGFSZSA-N 1 3 345.409 2.797 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+]Cc2ccc3cc[nH]c3c2)CCC1)N(C)C ZINC001380898916 1347944351 /nfs/dbraw/zinc/94/43/51/1347944351.db2.gz VVPKYFZGNJIOQR-GOSISDBHSA-N 1 3 342.487 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]C/C=C/c2ccccc2)CCC1 ZINC001380901311 1347945853 /nfs/dbraw/zinc/94/58/53/1347945853.db2.gz GGOUFEHYSSMDBJ-YRNVUSSQSA-N 1 3 329.488 2.669 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CCCN(C/C=C\Cl)CC1 ZINC001380933336 1347965762 /nfs/dbraw/zinc/96/57/62/1347965762.db2.gz WBLZLHTYILQTCW-CDUNHOTPSA-N 1 3 327.900 2.584 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CCCN(C/C=C\Cl)CC1 ZINC001380933336 1347965765 /nfs/dbraw/zinc/96/57/65/1347965765.db2.gz WBLZLHTYILQTCW-CDUNHOTPSA-N 1 3 327.900 2.584 10 0 EFAEHO C[C@H](c1cccc(F)c1)[N@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001380978278 1347999516 /nfs/dbraw/zinc/99/95/16/1347999516.db2.gz BBAPXHHRRIRCKR-MRXNPFEDSA-N 1 3 335.467 2.763 10 0 EFAEHO C[C@H](c1cccc(F)c1)[N@@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001380978278 1347999520 /nfs/dbraw/zinc/99/95/20/1347999520.db2.gz BBAPXHHRRIRCKR-MRXNPFEDSA-N 1 3 335.467 2.763 10 0 EFAEHO CN(CCC[N@H+](C)[C@@H]1CCc2c1cccc2F)C(=O)CN1CCCC1 ZINC001380978872 1347999728 /nfs/dbraw/zinc/99/97/28/1347999728.db2.gz GTQHVRYVMPLJMV-LJQANCHMSA-N 1 3 347.478 2.689 10 0 EFAEHO CN(CCC[N@@H+](C)[C@@H]1CCc2c1cccc2F)C(=O)CN1CCCC1 ZINC001380978872 1347999732 /nfs/dbraw/zinc/99/97/32/1347999732.db2.gz GTQHVRYVMPLJMV-LJQANCHMSA-N 1 3 347.478 2.689 10 0 EFAEHO CN(CCC[N@H+](C)CC[C@H]1CCCC1(F)F)C(=O)CN1CCCC1 ZINC001380979356 1348001128 /nfs/dbraw/zinc/00/11/28/1348001128.db2.gz INHRVNWASLTGCK-MRXNPFEDSA-N 1 3 345.478 2.688 10 0 EFAEHO CN(CCC[N@@H+](C)CC[C@H]1CCCC1(F)F)C(=O)CN1CCCC1 ZINC001380979356 1348001132 /nfs/dbraw/zinc/00/11/32/1348001132.db2.gz INHRVNWASLTGCK-MRXNPFEDSA-N 1 3 345.478 2.688 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001380980229 1348001787 /nfs/dbraw/zinc/00/17/87/1348001787.db2.gz MWUOHTUAJFOJMZ-UHFFFAOYSA-N 1 3 335.467 2.510 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001380980229 1348001790 /nfs/dbraw/zinc/00/17/90/1348001790.db2.gz MWUOHTUAJFOJMZ-UHFFFAOYSA-N 1 3 335.467 2.510 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCC[C@@H]1[C@H]1CCCN(C/C=C\Cl)C1 ZINC001380991129 1348009775 /nfs/dbraw/zinc/00/97/75/1348009775.db2.gz UQKBGQWIXFWPBI-IRMRGROASA-N 1 3 341.927 2.784 10 0 EFAEHO CCC1(NC/C(Cl)=C\Cl)CCN(C(=O)[C@H]2CC[N@H+](C)C2)CC1 ZINC001381024419 1348026267 /nfs/dbraw/zinc/02/62/67/1348026267.db2.gz YJFNPPZSIIVDNT-LFGHMXSPSA-N 1 3 348.318 2.618 10 0 EFAEHO CCC1(NC/C(Cl)=C\Cl)CCN(C(=O)[C@H]2CC[N@@H+](C)C2)CC1 ZINC001381024419 1348026268 /nfs/dbraw/zinc/02/62/68/1348026268.db2.gz YJFNPPZSIIVDNT-LFGHMXSPSA-N 1 3 348.318 2.618 10 0 EFAEHO CC[C@@H](C)C[NH2+]C1(CC)CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001381027208 1348029168 /nfs/dbraw/zinc/02/91/68/1348029168.db2.gz YBFVDDZLKDKFKB-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccsc2)[C@@H](C)C1 ZINC001381173945 1348121788 /nfs/dbraw/zinc/12/17/88/1348121788.db2.gz OVCMETGDJNAZDL-RDJZCZTQSA-N 1 3 337.533 2.949 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccsc2)[C@@H](C)C1 ZINC001381173945 1348121792 /nfs/dbraw/zinc/12/17/92/1348121792.db2.gz OVCMETGDJNAZDL-RDJZCZTQSA-N 1 3 337.533 2.949 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@H](C)[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001381214273 1348143955 /nfs/dbraw/zinc/14/39/55/1348143955.db2.gz NJQMZQOHSPZOTF-ZNMIVQPWSA-N 1 3 333.467 2.637 10 0 EFAEHO CC[C@@H](C)C[N@H+](CC)CC1CCN(C(=O)[C@H](CC)N(C)C)CC1 ZINC001381252978 1348165537 /nfs/dbraw/zinc/16/55/37/1348165537.db2.gz BKJUTKCMZKZPRP-AEFFLSMTSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C)C[N@@H+](CC)CC1CCN(C(=O)[C@H](CC)N(C)C)CC1 ZINC001381252978 1348165538 /nfs/dbraw/zinc/16/55/38/1348165538.db2.gz BKJUTKCMZKZPRP-AEFFLSMTSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CCC(C)C)N(C)C ZINC001381276769 1348180994 /nfs/dbraw/zinc/18/09/94/1348180994.db2.gz QRHMRFMBLDIYEF-CEXWTWQISA-N 1 3 331.504 2.745 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@@H](C)CC ZINC001381280450 1348183715 /nfs/dbraw/zinc/18/37/15/1348183715.db2.gz YAISZYUVIKVRTE-QKYXUNIQSA-N 1 3 331.504 2.746 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001381311776 1348205237 /nfs/dbraw/zinc/20/52/37/1348205237.db2.gz HWRBCIRFEOTPJY-ZWKOTPCHSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001381311776 1348205238 /nfs/dbraw/zinc/20/52/38/1348205238.db2.gz HWRBCIRFEOTPJY-ZWKOTPCHSA-N 1 3 325.541 2.932 10 0 EFAEHO CN(C)C1(C(=O)NC2CC(C[NH2+][C@@H]3CCc4ccccc43)C2)CCC1 ZINC001381324483 1348210645 /nfs/dbraw/zinc/21/06/45/1348210645.db2.gz WGWMVHKCLVMOTQ-GXOAENINSA-N 1 3 341.499 2.643 10 0 EFAEHO CN(C)C1(C(=O)NC2CC(C[NH2+][C@H]3CCc4ccccc43)C2)CCC1 ZINC001381324491 1348211308 /nfs/dbraw/zinc/21/13/08/1348211308.db2.gz WGWMVHKCLVMOTQ-KVWWFHCMSA-N 1 3 341.499 2.643 10 0 EFAEHO CN(CC(=O)NC1CC(C[NH2+][C@H]2CCc3ccccc32)C1)C1CCC1 ZINC001381331667 1348212820 /nfs/dbraw/zinc/21/28/20/1348212820.db2.gz PCGINIYBLZBOLA-LAGYLCCXSA-N 1 3 341.499 2.643 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+][C@H]2CCCc3ccccc32)C1 ZINC001381340433 1348215836 /nfs/dbraw/zinc/21/58/36/1348215836.db2.gz HTIRLQDPZXWUSH-NLPFYKDJSA-N 1 3 343.515 2.889 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]Cc2cc(C)sc2C)C1 ZINC001381343239 1348217512 /nfs/dbraw/zinc/21/75/12/1348217512.db2.gz YBPAXKUDUNEKCQ-UHFFFAOYSA-N 1 3 337.533 2.691 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)[C@H](C(C)C)N(C)C)C2)c(C)c1 ZINC001381344515 1348217987 /nfs/dbraw/zinc/21/79/87/1348217987.db2.gz ZVEVNEOAYPMSOL-UUKMXZOPSA-N 1 3 345.531 2.874 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001381393707 1348239635 /nfs/dbraw/zinc/23/96/35/1348239635.db2.gz QFQIREWIZJXSGH-DLBZAZTESA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)cc1C ZINC001381397432 1348241560 /nfs/dbraw/zinc/24/15/60/1348241560.db2.gz UDWJLDBGKSRCBY-IAGOWNOFSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(CN[C@H](C)[C@H](C)NC(=O)CCC[NH+](C)C)c(Cl)c1 ZINC001381413953 1348255884 /nfs/dbraw/zinc/25/58/84/1348255884.db2.gz IYWUQJCCVAOXER-CABCVRRESA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C(C)C ZINC001381459029 1348289296 /nfs/dbraw/zinc/28/92/96/1348289296.db2.gz WZEJSLOHDYBJPY-CABCVRRESA-N 1 3 339.911 2.971 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@H](C)CNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001381527889 1348331612 /nfs/dbraw/zinc/33/16/12/1348331612.db2.gz FWBVBDSQBYARJK-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@H](C)CNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001381527889 1348331615 /nfs/dbraw/zinc/33/16/15/1348331615.db2.gz FWBVBDSQBYARJK-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@H](C)CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001381527892 1348331893 /nfs/dbraw/zinc/33/18/93/1348331893.db2.gz FWBVBDSQBYARJK-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@H](C)CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001381527892 1348331894 /nfs/dbraw/zinc/33/18/94/1348331894.db2.gz FWBVBDSQBYARJK-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@H+](C)Cc1cccc(C(F)F)c1)N(C)C ZINC001381535972 1348338112 /nfs/dbraw/zinc/33/81/12/1348338112.db2.gz NTKAIDDNZAWTGJ-XJKSGUPXSA-N 1 3 341.446 2.901 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@@H+](C)Cc1cccc(C(F)F)c1)N(C)C ZINC001381535972 1348338113 /nfs/dbraw/zinc/33/81/13/1348338113.db2.gz NTKAIDDNZAWTGJ-XJKSGUPXSA-N 1 3 341.446 2.901 10 0 EFAEHO CC(C)CC[N@H+](C)[C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001381582730 1348377665 /nfs/dbraw/zinc/37/76/65/1348377665.db2.gz MHHHWNUSVUWDID-CRAIPNDOSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)CC[N@@H+](C)[C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001381582730 1348377668 /nfs/dbraw/zinc/37/76/68/1348377668.db2.gz MHHHWNUSVUWDID-CRAIPNDOSA-N 1 3 329.504 2.682 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+](C)[C@@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001381582744 1348377853 /nfs/dbraw/zinc/37/78/53/1348377853.db2.gz MLTYIUHHEAIZCL-QAPCUYQASA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cccc(C)c1C[N@H+](C)[C@@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001381582744 1348377858 /nfs/dbraw/zinc/37/78/58/1348377858.db2.gz MLTYIUHHEAIZCL-QAPCUYQASA-N 1 3 331.504 2.582 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@H+](C)CCc1ccc(Cl)cc1)N(C)C ZINC001381602191 1348394725 /nfs/dbraw/zinc/39/47/25/1348394725.db2.gz BYWCZOROBBPHLE-WMLDXEAASA-N 1 3 339.911 2.659 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@@H+](C)CCc1ccc(Cl)cc1)N(C)C ZINC001381602191 1348394729 /nfs/dbraw/zinc/39/47/29/1348394729.db2.gz BYWCZOROBBPHLE-WMLDXEAASA-N 1 3 339.911 2.659 10 0 EFAEHO C[C@@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)N(C)Cc1cccc(Cl)c1 ZINC001381613916 1348404849 /nfs/dbraw/zinc/40/48/49/1348404849.db2.gz ZQEGVYHPQCMFNB-GOEBONIOSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)N(C)Cc1cccc(Cl)c1 ZINC001381613916 1348404851 /nfs/dbraw/zinc/40/48/51/1348404851.db2.gz ZQEGVYHPQCMFNB-GOEBONIOSA-N 1 3 337.895 2.618 10 0 EFAEHO CC[C@H](C(=O)NC1(C[NH2+]Cc2ncccc2C)CCCCC1)N(C)C ZINC001381724009 1348478789 /nfs/dbraw/zinc/47/87/89/1348478789.db2.gz OCOPPAHIJFMBEK-GOSISDBHSA-N 1 3 346.519 2.639 10 0 EFAEHO CC1(C)CN(Cc2ccccc2)C[C@H]1NC(=O)CC[NH+]1CCCCC1 ZINC001381859986 1348572450 /nfs/dbraw/zinc/57/24/50/1348572450.db2.gz APOJOPCTBPJDDN-LJQANCHMSA-N 1 3 343.515 2.889 10 0 EFAEHO CN(CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCCCC3)C[C@H]21)CC(C)(C)C ZINC001381906338 1348599275 /nfs/dbraw/zinc/59/92/75/1348599275.db2.gz SKEJMQZDVUVUHP-LDLYASANSA-N 1 3 349.563 2.839 10 0 EFAEHO CN(CC(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCCCC3)C[C@H]21)CC(C)(C)C ZINC001381906338 1348599277 /nfs/dbraw/zinc/59/92/77/1348599277.db2.gz SKEJMQZDVUVUHP-LDLYASANSA-N 1 3 349.563 2.839 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccccc2Cl)C1)N(C)C ZINC001381971268 1348631095 /nfs/dbraw/zinc/63/10/95/1348631095.db2.gz NFQBBYZCRCCGMZ-QRTARXTBSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001382088330 1348710341 /nfs/dbraw/zinc/71/03/41/1348710341.db2.gz GOHQAZFXDPRTCP-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@@H](NCc2cc(C)ccc2F)[C@@H]1C ZINC001382300717 1348854532 /nfs/dbraw/zinc/85/45/32/1348854532.db2.gz DAWDUFNAQNYIFC-MAUKXSAKSA-N 1 3 335.467 2.555 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@@H](NCc2cc(C)ccc2F)[C@@H]1C ZINC001382300717 1348854536 /nfs/dbraw/zinc/85/45/36/1348854536.db2.gz DAWDUFNAQNYIFC-MAUKXSAKSA-N 1 3 335.467 2.555 10 0 EFAEHO Cc1cccc(C[N@@H+](C)[C@@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001394062225 1357431646 /nfs/dbraw/zinc/43/16/46/1357431646.db2.gz YXOFRVLYCNVZGN-HKUYNNGSSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1cccc(C[N@H+](C)[C@@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001394062225 1357431648 /nfs/dbraw/zinc/43/16/48/1357431648.db2.gz YXOFRVLYCNVZGN-HKUYNNGSSA-N 1 3 331.504 2.804 10 0 EFAEHO CC(C)C[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN(C)CC(C)(C)C)C[C@H]21 ZINC001382336159 1348888802 /nfs/dbraw/zinc/88/88/02/1348888802.db2.gz PNFRBXPEQCSPGQ-RCCFBDPRSA-N 1 3 337.552 2.837 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]C[C@H](C)CC(C)C)C(C)(C)C1 ZINC001382382106 1348924410 /nfs/dbraw/zinc/92/44/10/1348924410.db2.gz XQMYBAUSYQTZLD-IAGOWNOFSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1cccc(C)c1)C(C)(C)C)N(C)C ZINC001382534022 1349000073 /nfs/dbraw/zinc/00/00/73/1349000073.db2.gz MYOSXGLQEUPCHN-QZTJIDSGSA-N 1 3 333.520 2.956 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C[NH2+]CC1CC(C)(C)C1)C(C)(C)C)N(C)C ZINC001382542968 1349009221 /nfs/dbraw/zinc/00/92/21/1349009221.db2.gz VWLZIBTXDNNWTR-JKSUJKDBSA-N 1 3 325.541 2.883 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C1CC[NH+](Cc2ccsc2)CC1)N(C)C ZINC001382566881 1349025201 /nfs/dbraw/zinc/02/52/01/1349025201.db2.gz VOKIYKJJFGCQBC-YOEHRIQHSA-N 1 3 337.533 2.805 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N(C)C2CC(NCC=C(Cl)Cl)C2)CC[N@@H+]1C ZINC001382586000 1349034469 /nfs/dbraw/zinc/03/44/69/1349034469.db2.gz FCLDUZMIHPHVDP-FEPKRQSRSA-N 1 3 348.318 2.615 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N(C)C2CC(NCC=C(Cl)Cl)C2)CC[N@H+]1C ZINC001382586000 1349034476 /nfs/dbraw/zinc/03/44/76/1349034476.db2.gz FCLDUZMIHPHVDP-FEPKRQSRSA-N 1 3 348.318 2.615 10 0 EFAEHO C[C@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)N(C)CCc1ccccc1F ZINC001394079586 1357447988 /nfs/dbraw/zinc/44/79/88/1357447988.db2.gz UHRUVOBNNJYOBR-AEFFLSMTSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)N(C)CCc1ccccc1F ZINC001394079586 1357447989 /nfs/dbraw/zinc/44/79/89/1357447989.db2.gz UHRUVOBNNJYOBR-AEFFLSMTSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[N@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001394106164 1357477019 /nfs/dbraw/zinc/47/70/19/1357477019.db2.gz KGUXQCUZXZOAQX-CABCVRRESA-N 1 3 347.494 2.836 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001394106164 1357477022 /nfs/dbraw/zinc/47/70/22/1357477022.db2.gz KGUXQCUZXZOAQX-CABCVRRESA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]C/C=C\Cl ZINC001394194774 1357576421 /nfs/dbraw/zinc/57/64/21/1357576421.db2.gz XDYRCYTYNLSXKW-RQTGCPSESA-N 1 3 329.916 2.543 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]Cc1cc(Cl)cc(Cl)c1)N(C)C ZINC001420309556 1376709845 /nfs/dbraw/zinc/70/98/45/1376709845.db2.gz MXZRLPAUHNJGJO-IAQYHMDHSA-N 1 3 346.302 2.928 10 0 EFAEHO CC[C@@H](C(=O)NC1(C[NH2+]Cc2cnccc2C)CCCCC1)N(C)C ZINC001394198336 1357580979 /nfs/dbraw/zinc/58/09/79/1357580979.db2.gz UUSMATCTYICSRW-SFHVURJKSA-N 1 3 346.519 2.639 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H](C)C1C[NH+](Cc2cccc(C)c2)C1 ZINC001394225192 1357616836 /nfs/dbraw/zinc/61/68/36/1357616836.db2.gz PJZCNYXSCQHHIH-QFBILLFUSA-N 1 3 349.494 2.611 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](CCCc2ccccc2C)C1)N(C)C ZINC001394232009 1357621854 /nfs/dbraw/zinc/62/18/54/1357621854.db2.gz VOYFNTARTWQFLB-YLJYHZDGSA-N 1 3 345.531 2.704 10 0 EFAEHO CCc1ccccc1CN1CC([C@@H](C)NC(=O)C[C@@H]2CC[N@H+](C)C2)C1 ZINC001394268094 1357652470 /nfs/dbraw/zinc/65/24/70/1357652470.db2.gz SGGSVULDRUYCQG-SJORKVTESA-N 1 3 343.515 2.527 10 0 EFAEHO CCc1ccccc1CN1CC([C@@H](C)NC(=O)C[C@@H]2CC[N@@H+](C)C2)C1 ZINC001394268094 1357652474 /nfs/dbraw/zinc/65/24/74/1357652474.db2.gz SGGSVULDRUYCQG-SJORKVTESA-N 1 3 343.515 2.527 10 0 EFAEHO CCc1ccccc1CN1CC([C@@H](C)NC(=O)C[C@H]2CC[N@H+](C)C2)C1 ZINC001394268088 1357652559 /nfs/dbraw/zinc/65/25/59/1357652559.db2.gz SGGSVULDRUYCQG-IAGOWNOFSA-N 1 3 343.515 2.527 10 0 EFAEHO CCc1ccccc1CN1CC([C@@H](C)NC(=O)C[C@H]2CC[N@@H+](C)C2)C1 ZINC001394268088 1357652563 /nfs/dbraw/zinc/65/25/63/1357652563.db2.gz SGGSVULDRUYCQG-IAGOWNOFSA-N 1 3 343.515 2.527 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)N2CC[C@@H]2CN(C)C(=O)CC[NH+](C)C)c1 ZINC001388651018 1352890745 /nfs/dbraw/zinc/89/07/45/1352890745.db2.gz WGNLLURQKKSRAX-QZTJIDSGSA-N 1 3 331.504 2.849 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2C[C@@H]([NH2+][C@H]3CCc4ccccc43)C2)C1 ZINC001388688130 1352921984 /nfs/dbraw/zinc/92/19/84/1352921984.db2.gz POVHQFOTEJZRNX-YTXYEVPYSA-N 1 3 341.499 2.500 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccsc2)C1)N1CCCC1 ZINC001388691763 1352925164 /nfs/dbraw/zinc/92/51/64/1352925164.db2.gz YZVMATMPAAJQOZ-IYBDPMFKSA-N 1 3 335.517 2.607 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[NH+]1CCCC1 ZINC001388726765 1352954206 /nfs/dbraw/zinc/95/42/06/1352954206.db2.gz MDLSKTPHIXZKCP-JOCQHMNTSA-N 1 3 348.318 2.664 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN1CCC(C)CC1 ZINC001388766402 1352990246 /nfs/dbraw/zinc/99/02/46/1352990246.db2.gz MDDCEFLOXPGXAG-QRQLOZEOSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[C@H]2CCC[N@@H+]2C)CCN1CCC(F)(F)F ZINC001388771179 1352997203 /nfs/dbraw/zinc/99/72/03/1352997203.db2.gz IEUSXPHUCNBOMW-QLFBSQMISA-N 1 3 349.441 2.782 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[C@H]2CCC[N@H+]2C)CCN1CCC(F)(F)F ZINC001388771179 1352997206 /nfs/dbraw/zinc/99/72/06/1352997206.db2.gz IEUSXPHUCNBOMW-QLFBSQMISA-N 1 3 349.441 2.782 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@@H+](C/C=C\Cl)CC(C)(C)C1 ZINC001388843775 1353083952 /nfs/dbraw/zinc/08/39/52/1353083952.db2.gz VZYDKWCJVPBZFN-DDJMYBDESA-N 1 3 329.916 2.688 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@H+](C/C=C\Cl)CC(C)(C)C1 ZINC001388843775 1353083945 /nfs/dbraw/zinc/08/39/45/1353083945.db2.gz VZYDKWCJVPBZFN-DDJMYBDESA-N 1 3 329.916 2.688 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCCC(C)(C)C)C[C@H]21 ZINC001394311971 1357693519 /nfs/dbraw/zinc/69/35/19/1357693519.db2.gz KFEKZBLIEIXUTF-AKHDSKFASA-N 1 3 349.563 2.981 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]1[C@H]2C[N@H+](CCCC(C)(C)C)C[C@H]21 ZINC001394311971 1357693520 /nfs/dbraw/zinc/69/35/20/1357693520.db2.gz KFEKZBLIEIXUTF-AKHDSKFASA-N 1 3 349.563 2.981 10 0 EFAEHO CC[C@@H](F)CN1CCC2(C[C@@H]2NC(=O)CC[NH+]2CCCCC2)CC1 ZINC001389519475 1353448139 /nfs/dbraw/zinc/44/81/39/1353448139.db2.gz CCDGXFCALGYHQU-SJORKVTESA-N 1 3 339.499 2.581 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC12CC[NH+](Cc1ccc(F)cc1)CC2 ZINC001389532595 1353460505 /nfs/dbraw/zinc/46/05/05/1353460505.db2.gz UAOMPZJKWLFEAZ-GOSISDBHSA-N 1 3 347.478 2.637 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC12CC[NH+](CCc1cccs1)CC2)N(C)C ZINC001389533542 1353461250 /nfs/dbraw/zinc/46/12/50/1353461250.db2.gz UJNVJJNHGUFGEC-SJORKVTESA-N 1 3 349.544 2.602 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1csc(C)c1)C1CC1 ZINC001389604583 1353503993 /nfs/dbraw/zinc/50/39/93/1353503993.db2.gz ISQRARCQJYAVSV-QZTJIDSGSA-N 1 3 349.544 2.915 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1csc(C)c1)C1CC1 ZINC001389604594 1353504060 /nfs/dbraw/zinc/50/40/60/1353504060.db2.gz ISQRARCQJYAVSV-ROUUACIJSA-N 1 3 349.544 2.915 10 0 EFAEHO CC(C)(C(=O)NC[C@H]([NH2+]Cc1ccsc1)C1CC1)N1CCCC1 ZINC001389645893 1353529417 /nfs/dbraw/zinc/52/94/17/1353529417.db2.gz GWGMYLYWVUGPTO-INIZCTEOSA-N 1 3 335.517 2.607 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[N@H+](C)CCC(C)(C)C)C1 ZINC001389762902 1353606447 /nfs/dbraw/zinc/60/64/47/1353606447.db2.gz PACUWIPLYLIOTQ-KRWDZBQOSA-N 1 3 325.541 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[N@@H+](C)CCC(C)(C)C)C1 ZINC001389762902 1353606453 /nfs/dbraw/zinc/60/64/53/1353606453.db2.gz PACUWIPLYLIOTQ-KRWDZBQOSA-N 1 3 325.541 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccc(Cl)cc32)C1 ZINC001389907848 1353681744 /nfs/dbraw/zinc/68/17/44/1353681744.db2.gz OUYVPIIOLWEUOS-JFIYKMOQSA-N 1 3 349.906 2.904 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(C)cc1)N(C)C ZINC001389946163 1353703865 /nfs/dbraw/zinc/70/38/65/1353703865.db2.gz ZWQOAAFTHBQOJC-NXEWRWPSSA-N 1 3 343.515 2.947 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(C)cc1)N(C)C ZINC001389946163 1353703869 /nfs/dbraw/zinc/70/38/69/1353703869.db2.gz ZWQOAAFTHBQOJC-NXEWRWPSSA-N 1 3 343.515 2.947 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCCN(Cc2ccsc2)C1)[NH+]1CCCC1 ZINC001390045510 1353763199 /nfs/dbraw/zinc/76/31/99/1353763199.db2.gz RSZDPUZRAGMEJK-MRXNPFEDSA-N 1 3 349.544 2.951 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[NH2+]C[C@H]2CCC(F)(F)C2)C1 ZINC001390099845 1353804416 /nfs/dbraw/zinc/80/44/16/1353804416.db2.gz BHTOKGWKGCUJIY-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@@](F)(C(=O)NC[C@@H]2CCCCN2CCCF)C1 ZINC001390138316 1353849841 /nfs/dbraw/zinc/84/98/41/1353849841.db2.gz IEUOTQBJMBBFHK-YJBOKZPZSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)NC[C@@H]2CCCCN2CCCF)C1 ZINC001390138316 1353849845 /nfs/dbraw/zinc/84/98/45/1353849845.db2.gz IEUOTQBJMBBFHK-YJBOKZPZSA-N 1 3 345.478 2.529 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](Cc3ccsc3)C[C@H]2C1 ZINC001394350704 1357724299 /nfs/dbraw/zinc/72/42/99/1357724299.db2.gz PEIAGOIDBLFAPI-KZNAEPCWSA-N 1 3 349.544 2.807 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccsc3)C[C@H]2C1 ZINC001394350704 1357724303 /nfs/dbraw/zinc/72/43/03/1357724303.db2.gz PEIAGOIDBLFAPI-KZNAEPCWSA-N 1 3 349.544 2.807 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H]2CCCCN2C(=O)CN(C)C(C)C)c1 ZINC001390152772 1353866310 /nfs/dbraw/zinc/86/63/10/1353866310.db2.gz DWHTWJOITRDEGN-SFHVURJKSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1C[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001390154386 1353867045 /nfs/dbraw/zinc/86/70/45/1353867045.db2.gz IKBJCZFBRQGDNW-HZPDHXFCSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H]1CN(C(=O)CN(C)C(C)C)CC1(C)C ZINC001394727505 1358052645 /nfs/dbraw/zinc/05/26/45/1358052645.db2.gz TZCBFLGHZNENGI-LJQANCHMSA-N 1 3 345.531 2.970 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@@H]1CC[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001394699155 1358024528 /nfs/dbraw/zinc/02/45/28/1358024528.db2.gz CKHKHOCXYFWODD-VQIMIIECSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](C)CNC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001390359506 1354027803 /nfs/dbraw/zinc/02/78/03/1354027803.db2.gz JAIWTPVGNUWANB-PKOBYXMFSA-N 1 3 331.504 2.771 10 0 EFAEHO CC(C)N(CC[N@H+](C)CC1CC2(CCC2)C1)C(=O)[C@H]1CCCN1C ZINC001394802488 1358087279 /nfs/dbraw/zinc/08/72/79/1358087279.db2.gz WDUKGFOMRGRLRV-GOSISDBHSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CC1CC2(CCC2)C1)C(=O)[C@H]1CCCN1C ZINC001394802488 1358087281 /nfs/dbraw/zinc/08/72/81/1358087281.db2.gz WDUKGFOMRGRLRV-GOSISDBHSA-N 1 3 335.536 2.830 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001390396009 1354061689 /nfs/dbraw/zinc/06/16/89/1354061689.db2.gz CVHYNUPZGPXMFF-YOEHRIQHSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)NCc1cc2ccccc2o1 ZINC001390406607 1354068210 /nfs/dbraw/zinc/06/82/10/1354068210.db2.gz USFSULUDISTMSB-RDJZCZTQSA-N 1 3 343.471 2.902 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)NCc1cc2ccccc2o1 ZINC001390406607 1354068215 /nfs/dbraw/zinc/06/82/15/1354068215.db2.gz USFSULUDISTMSB-RDJZCZTQSA-N 1 3 343.471 2.902 10 0 EFAEHO Cc1ccc(CN[C@H](C)CNC(=O)C23CCC[NH+]2CCC3)c(Cl)c1 ZINC001390438992 1354080217 /nfs/dbraw/zinc/08/02/17/1354080217.db2.gz NGAZIVUCOQGDMC-OAHLLOKOSA-N 1 3 349.906 2.871 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC[C@H](C)NCc2cccc(F)c2)C1 ZINC001390455209 1354091724 /nfs/dbraw/zinc/09/17/24/1354091724.db2.gz GRSAUFGBTYVTSE-RDJZCZTQSA-N 1 3 335.467 2.542 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC[C@H](C)NCc2cccc(F)c2)C1 ZINC001390455209 1354091732 /nfs/dbraw/zinc/09/17/32/1354091732.db2.gz GRSAUFGBTYVTSE-RDJZCZTQSA-N 1 3 335.467 2.542 10 0 EFAEHO CC(C)c1ccc(C[NH2+][C@@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001390479924 1354113397 /nfs/dbraw/zinc/11/33/97/1354113397.db2.gz KGGRELXCKHYIDS-IRXDYDNUSA-N 1 3 331.504 2.746 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]Cc1ccc(C(F)F)cc1)N(C)C ZINC001390511203 1354136814 /nfs/dbraw/zinc/13/68/14/1354136814.db2.gz PCKXRYLIINNECV-IUODEOHRSA-N 1 3 327.419 2.559 10 0 EFAEHO C[C@H](CCNC(=O)C(C)(C)[NH+]1CCCC1)NC/C(Cl)=C/Cl ZINC001390695944 1354287837 /nfs/dbraw/zinc/28/78/37/1354287837.db2.gz LBNPFBYEHMYZSP-YGYTWAPGSA-N 1 3 336.307 2.664 10 0 EFAEHO C[C@H](CCNC(=O)C(C)(C)[NH+]1CCCC1)NC/C(Cl)=C\Cl ZINC001390695939 1354287895 /nfs/dbraw/zinc/28/78/95/1354287895.db2.gz LBNPFBYEHMYZSP-GMCKNXKJSA-N 1 3 336.307 2.664 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1cccc(F)c1Cl)N(C)C ZINC001390714001 1354305549 /nfs/dbraw/zinc/30/55/49/1354305549.db2.gz NVJKWOAQQDSVRH-IUODEOHRSA-N 1 3 343.874 2.804 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]Cc1cccc(C)c1 ZINC001390739272 1354328925 /nfs/dbraw/zinc/32/89/25/1354328925.db2.gz ZYTHJEIPRBFRKD-PKOBYXMFSA-N 1 3 331.504 2.854 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@H+](C)[C@H]2CCc3ccc(Cl)cc32)CCC1 ZINC001390765761 1354352225 /nfs/dbraw/zinc/35/22/25/1354352225.db2.gz QDBOPNKFEMYXEZ-KRWDZBQOSA-N 1 3 349.906 2.860 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@@H+](C)[C@H]2CCc3ccc(Cl)cc32)CCC1 ZINC001390765761 1354352233 /nfs/dbraw/zinc/35/22/33/1354352233.db2.gz QDBOPNKFEMYXEZ-KRWDZBQOSA-N 1 3 349.906 2.860 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)c1 ZINC001390777834 1354364601 /nfs/dbraw/zinc/36/46/01/1354364601.db2.gz GSSAFBWYBGFWNV-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)c1 ZINC001390777834 1354364607 /nfs/dbraw/zinc/36/46/07/1354364607.db2.gz GSSAFBWYBGFWNV-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@@H]2CCC[C@H]3CCC[N@@H+]32)c1 ZINC001390826143 1354412675 /nfs/dbraw/zinc/41/26/75/1354412675.db2.gz MQQUWVSEVRBEKV-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@@H]2CCC[C@H]3CCC[N@H+]32)c1 ZINC001390826143 1354412677 /nfs/dbraw/zinc/41/26/77/1354412677.db2.gz MQQUWVSEVRBEKV-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO CCc1cccc(CN(CC)CCNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001390968081 1354602256 /nfs/dbraw/zinc/60/22/56/1354602256.db2.gz ZPIICUFDVYJPKB-PXNSSMCTSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1cccc(CN(CC)CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001390968081 1354602261 /nfs/dbraw/zinc/60/22/61/1354602261.db2.gz ZPIICUFDVYJPKB-PXNSSMCTSA-N 1 3 345.531 2.917 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)c(C)c1 ZINC001391104522 1354799960 /nfs/dbraw/zinc/79/99/60/1354799960.db2.gz WRVWVTCAJACGKE-HKUYNNGSSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)c(C)c1 ZINC001391104522 1354799965 /nfs/dbraw/zinc/79/99/65/1354799965.db2.gz WRVWVTCAJACGKE-HKUYNNGSSA-N 1 3 343.515 2.583 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@H]2CCN(Cc3cccc(Cl)c3)C2)C1 ZINC001391117350 1354819305 /nfs/dbraw/zinc/81/93/05/1354819305.db2.gz YOZJKCNUZKUQRB-IAGOWNOFSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@H]2CCN(Cc3cccc(Cl)c3)C2)C1 ZINC001391117350 1354819308 /nfs/dbraw/zinc/81/93/08/1354819308.db2.gz YOZJKCNUZKUQRB-IAGOWNOFSA-N 1 3 349.906 2.620 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+]([C@@H]2CCCc3ccccc32)C1 ZINC001391120796 1354825180 /nfs/dbraw/zinc/82/51/80/1354825180.db2.gz WNVGPSVYLNMTPG-FXAWDEMLSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+]([C@@H]2CCCc3ccccc32)C1 ZINC001391120796 1354825184 /nfs/dbraw/zinc/82/51/84/1354825184.db2.gz WNVGPSVYLNMTPG-FXAWDEMLSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+]([C@H]2CCCc3ccccc32)C1 ZINC001391120805 1354825308 /nfs/dbraw/zinc/82/53/08/1354825308.db2.gz WNVGPSVYLNMTPG-PXNSSMCTSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+]([C@H]2CCCc3ccccc32)C1 ZINC001391120805 1354825310 /nfs/dbraw/zinc/82/53/10/1354825310.db2.gz WNVGPSVYLNMTPG-PXNSSMCTSA-N 1 3 343.515 2.842 10 0 EFAEHO CCc1cccc(C[N@@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001391120312 1354825494 /nfs/dbraw/zinc/82/54/94/1354825494.db2.gz UQGZXICEYRLKDU-LJQANCHMSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(C[N@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001391120312 1354825498 /nfs/dbraw/zinc/82/54/98/1354825498.db2.gz UQGZXICEYRLKDU-LJQANCHMSA-N 1 3 331.504 2.527 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)CC[N@@H+]1CCCC(C)C ZINC001397747526 1360100913 /nfs/dbraw/zinc/10/09/13/1360100913.db2.gz GVHVTNDUKVCCPM-RCCFBDPRSA-N 1 3 325.541 2.978 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)CC[N@H+]1CCCC(C)C ZINC001397747526 1360100919 /nfs/dbraw/zinc/10/09/19/1360100919.db2.gz GVHVTNDUKVCCPM-RCCFBDPRSA-N 1 3 325.541 2.978 10 0 EFAEHO CCCN(CCNC(=O)[C@H]1CCC[N@@H+]1C(C)C)Cc1ccsc1 ZINC001391127526 1354835738 /nfs/dbraw/zinc/83/57/38/1354835738.db2.gz NSHDPDBJOUGZPD-QGZVFWFLSA-N 1 3 337.533 2.949 10 0 EFAEHO CCCN(CCNC(=O)[C@H]1CCC[N@H+]1C(C)C)Cc1ccsc1 ZINC001391127526 1354835746 /nfs/dbraw/zinc/83/57/46/1354835746.db2.gz NSHDPDBJOUGZPD-QGZVFWFLSA-N 1 3 337.533 2.949 10 0 EFAEHO CC[C@H](C(=O)NCC[N@H+](Cc1ccc2cc[nH]c2c1)C1CC1)N(C)C ZINC001391173257 1354898958 /nfs/dbraw/zinc/89/89/58/1354898958.db2.gz LLPHYZNLNNPOFB-LJQANCHMSA-N 1 3 342.487 2.589 10 0 EFAEHO CC[C@H](C(=O)NCC[N@@H+](Cc1ccc2cc[nH]c2c1)C1CC1)N(C)C ZINC001391173257 1354898964 /nfs/dbraw/zinc/89/89/64/1354898964.db2.gz LLPHYZNLNNPOFB-LJQANCHMSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)C1CC1 ZINC001391203180 1354931122 /nfs/dbraw/zinc/93/11/22/1354931122.db2.gz XPOHJTUZRRFDQE-CVEARBPZSA-N 1 3 347.478 2.809 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)C1CC1 ZINC001391203180 1354931127 /nfs/dbraw/zinc/93/11/27/1354931127.db2.gz XPOHJTUZRRFDQE-CVEARBPZSA-N 1 3 347.478 2.809 10 0 EFAEHO CCCN(C(=O)[C@H]1CCCN1C(C)C)[C@H]1CC[N@H+](CCC2CC2)C1 ZINC001391279651 1355012209 /nfs/dbraw/zinc/01/22/09/1355012209.db2.gz LXVAWRSJZDGHQT-RBUKOAKNSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C(=O)[C@H]1CCCN1C(C)C)[C@H]1CC[N@@H+](CCC2CC2)C1 ZINC001391279651 1355012212 /nfs/dbraw/zinc/01/22/12/1355012212.db2.gz LXVAWRSJZDGHQT-RBUKOAKNSA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](C/C=C/c2ccccc2)C1)N(C)C ZINC001391297928 1355037451 /nfs/dbraw/zinc/03/74/51/1355037451.db2.gz KQTCJFVVOZMWMS-IEJDHCNXSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](C/C=C/c2ccccc2)C1)N(C)C ZINC001391297928 1355037457 /nfs/dbraw/zinc/03/74/57/1355037457.db2.gz KQTCJFVVOZMWMS-IEJDHCNXSA-N 1 3 343.515 2.868 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H]1CC[N@H+](CC2CCCC2)C1 ZINC001391335521 1355089888 /nfs/dbraw/zinc/08/98/88/1355089888.db2.gz KFYYIZDPQCNARO-OALUTQOASA-N 1 3 335.536 2.879 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC001391335521 1355089892 /nfs/dbraw/zinc/08/98/92/1355089892.db2.gz KFYYIZDPQCNARO-OALUTQOASA-N 1 3 335.536 2.879 10 0 EFAEHO CCc1ccc(C[N@@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)cc1 ZINC001391340530 1355097393 /nfs/dbraw/zinc/09/73/93/1355097393.db2.gz VAFDJMIUKNKMDL-HXUWFJFHSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccc(C[N@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)cc1 ZINC001391340530 1355097398 /nfs/dbraw/zinc/09/73/98/1355097398.db2.gz VAFDJMIUKNKMDL-HXUWFJFHSA-N 1 3 345.531 2.917 10 0 EFAEHO CC[C@H](F)CN(C)C[C@H]1CCN(C(=O)C2CC[NH+](C(C)C)CC2)C1 ZINC001391348634 1355105543 /nfs/dbraw/zinc/10/55/43/1355105543.db2.gz CNTXUJWXFPLVGB-AEFFLSMTSA-N 1 3 341.515 2.635 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001391354068 1355114608 /nfs/dbraw/zinc/11/46/08/1355114608.db2.gz IEXKJFHXMXPTPC-GOSISDBHSA-N 1 3 331.504 2.616 10 0 EFAEHO Cc1ccccc1C[N@H+](C)C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001391354068 1355114610 /nfs/dbraw/zinc/11/46/10/1355114610.db2.gz IEXKJFHXMXPTPC-GOSISDBHSA-N 1 3 331.504 2.616 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)N1CC[C@H](NC/C=C\Cl)C1 ZINC001398496710 1360603143 /nfs/dbraw/zinc/60/31/43/1360603143.db2.gz BGXZUNRPNPXRIE-APFBBLRHSA-N 1 3 327.900 2.582 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)N1CC[C@H](NC/C=C\Cl)C1 ZINC001398496710 1360603146 /nfs/dbraw/zinc/60/31/46/1360603146.db2.gz BGXZUNRPNPXRIE-APFBBLRHSA-N 1 3 327.900 2.582 10 0 EFAEHO Cc1cc(C[N@@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001391364949 1355132537 /nfs/dbraw/zinc/13/25/37/1355132537.db2.gz ZQYLJUJCBKCSTC-MRXNPFEDSA-N 1 3 337.533 2.677 10 0 EFAEHO Cc1cc(C[N@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001391364949 1355132540 /nfs/dbraw/zinc/13/25/40/1355132540.db2.gz ZQYLJUJCBKCSTC-MRXNPFEDSA-N 1 3 337.533 2.677 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@H+](CC2CCC2)C1)N1CCCCC1 ZINC001391404369 1355175308 /nfs/dbraw/zinc/17/53/08/1355175308.db2.gz OQLJCELTKRERRR-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@@H+](CC2CCC2)C1)N1CCCCC1 ZINC001391404369 1355175313 /nfs/dbraw/zinc/17/53/13/1355175313.db2.gz OQLJCELTKRERRR-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(C)c(CN2CC(CNC(=O)C[N@H+]3[C@H](C)CC[C@@H]3C)C2)c1 ZINC001391523050 1355273738 /nfs/dbraw/zinc/27/37/38/1355273738.db2.gz IMNWIUBNAZONKU-HDICACEKSA-N 1 3 343.515 2.724 10 0 EFAEHO Cc1ccc(C)c(CN2CC(CNC(=O)C[N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1 ZINC001391523050 1355273742 /nfs/dbraw/zinc/27/37/42/1355273742.db2.gz IMNWIUBNAZONKU-HDICACEKSA-N 1 3 343.515 2.724 10 0 EFAEHO CC(C)CCCN1C[C@@H]2C[C@H]1CN2C(=O)C1CC[NH+](CC2CC2)CC1 ZINC001391535956 1355284707 /nfs/dbraw/zinc/28/47/07/1355284707.db2.gz DWKHMVSQUWLSHM-PMACEKPBSA-N 1 3 347.547 2.830 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](CC)NCc1cc(C)ccc1F ZINC001391690469 1355437338 /nfs/dbraw/zinc/43/73/38/1355437338.db2.gz HBUAEZOBKMSOMW-MJGOQNOKSA-N 1 3 349.494 2.993 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](CC)NCc1cc(C)ccc1F ZINC001391690469 1355437341 /nfs/dbraw/zinc/43/73/41/1355437341.db2.gz HBUAEZOBKMSOMW-MJGOQNOKSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](CC)N(C)C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001391693122 1355439275 /nfs/dbraw/zinc/43/92/75/1355439275.db2.gz BZSAUEZGXJTKQG-CZUORRHYSA-N 1 3 343.874 2.804 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1cccc(C)c1 ZINC001391695833 1355441787 /nfs/dbraw/zinc/44/17/87/1355441787.db2.gz VVNLKGHJRJKKIW-MOPGFXCFSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](CC)N(C)C)[NH2+]Cc1c(C)cc(C)cc1C ZINC001391739945 1355484705 /nfs/dbraw/zinc/48/47/05/1355484705.db2.gz LOVFGOXBIUPDMB-IEBWSBKVSA-N 1 3 333.520 2.936 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(Cl)s1 ZINC001391754409 1355499362 /nfs/dbraw/zinc/49/93/62/1355499362.db2.gz RTJAJLMUKBSMTN-GFCCVEGCSA-N 1 3 331.913 2.726 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H]1CCc2c1cccc2F ZINC001391757611 1355502684 /nfs/dbraw/zinc/50/26/84/1355502684.db2.gz ZXUZJGZDDKPJIS-KSSFIOAISA-N 1 3 335.467 2.638 10 0 EFAEHO CC[C@H](C(=O)N[C@@](C)(C[NH2+]Cc1cc(F)ccc1C)C1CC1)N(C)C ZINC001391801333 1355543879 /nfs/dbraw/zinc/54/38/79/1355543879.db2.gz YAKUEWZYOZNMMR-QUCCMNQESA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@](C)(C[NH2+][C@H]1CCc2ccccc21)C1CC1 ZINC001391801722 1355545027 /nfs/dbraw/zinc/54/50/27/1355545027.db2.gz HQKTYNYCIBZYIQ-FPOVZHCZSA-N 1 3 343.515 2.889 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[C@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001391830369 1355573124 /nfs/dbraw/zinc/57/31/24/1355573124.db2.gz DGHAULBLIHSOLN-KLHDSHLOSA-N 1 3 345.478 2.779 10 0 EFAEHO CC[C@@H](C)C[NH2+]Cc1ccc(CNC(=O)Cc2nc[nH]c2C)cc1 ZINC001391839901 1355583579 /nfs/dbraw/zinc/58/35/79/1355583579.db2.gz PJZUFWXBSKBPMH-CQSZACIVSA-N 1 3 328.460 2.713 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1CNCc1ncccc1C)[NH+](CC)CC ZINC001391864077 1355603272 /nfs/dbraw/zinc/60/32/72/1355603272.db2.gz HGUSQWOKGSQHKB-IEBWSBKVSA-N 1 3 346.519 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CC[C@H](C)F)CC(C)(C)C1 ZINC001440526557 1389728836 /nfs/dbraw/zinc/72/88/36/1389728836.db2.gz FMLXYRCGTBTLFY-JKSUJKDBSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)c1cccc(C[NH2+]C[C@@H](C)CNC(=O)C2(N(C)C)CCC2)n1 ZINC001391919031 1355648156 /nfs/dbraw/zinc/64/81/56/1355648156.db2.gz MCRYFJUTZQRNJC-MRXNPFEDSA-N 1 3 346.519 2.531 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001391933684 1355660814 /nfs/dbraw/zinc/66/08/14/1355660814.db2.gz IMEVCEJUOWLAIM-MRXNPFEDSA-N 1 3 331.504 2.711 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)CNC(=O)CN(C)CC(C)(C)C)c(C)n1 ZINC001391941810 1355667548 /nfs/dbraw/zinc/66/75/48/1355667548.db2.gz WJFQSQFLQPLWOB-OAHLLOKOSA-N 1 3 348.535 2.518 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+][C@H](C)c1ccc(F)cc1F ZINC001391960810 1355683644 /nfs/dbraw/zinc/68/36/44/1355683644.db2.gz CZZOERQHHFQDFM-ZIAGYGMSSA-N 1 3 341.446 2.708 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+][C@@H](C)c1ccc(F)cc1F ZINC001391960786 1355683655 /nfs/dbraw/zinc/68/36/55/1355683655.db2.gz CZZOERQHHFQDFM-KBPBESRZSA-N 1 3 341.446 2.708 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C[N@H+](C)Cc2ccsc2)CC1 ZINC001400250495 1361886048 /nfs/dbraw/zinc/88/60/48/1361886048.db2.gz RCPKQZUFSCZSMD-UHFFFAOYSA-N 1 3 337.533 2.760 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C[N@@H+](C)Cc2ccsc2)CC1 ZINC001400250495 1361886051 /nfs/dbraw/zinc/88/60/51/1361886051.db2.gz RCPKQZUFSCZSMD-UHFFFAOYSA-N 1 3 337.533 2.760 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](C)N(C)C(=O)[C@H](C(C)C)[NH+](C)C)n1 ZINC001392071915 1355749171 /nfs/dbraw/zinc/74/91/71/1355749171.db2.gz DOHSFJNUUGRPPC-LPHOPBHVSA-N 1 3 348.535 2.728 10 0 EFAEHO CCCc1ccc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CCCC2)cc1 ZINC001392135033 1355793277 /nfs/dbraw/zinc/79/32/77/1355793277.db2.gz RJYRWQNBYQAMGC-KRWDZBQOSA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001392136309 1355794283 /nfs/dbraw/zinc/79/42/83/1355794283.db2.gz DGMPZLWFMCIUOZ-GJZGRUSLSA-N 1 3 333.467 2.589 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001392185618 1355839532 /nfs/dbraw/zinc/83/95/32/1355839532.db2.gz WGALXGRSUATQDT-AZUAARDMSA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H](C)[NH2+]Cc2ccc(F)cc2)C1 ZINC001392188613 1355843599 /nfs/dbraw/zinc/84/35/99/1355843599.db2.gz JREBYAZUWYZMMY-SJLPKXTDSA-N 1 3 349.494 2.883 10 0 EFAEHO C[N@H+](CCC1CCN(C(=O)Cc2c[nH]cn2)CC1)CC1CC(C)(C)C1 ZINC001392192327 1355847970 /nfs/dbraw/zinc/84/79/70/1355847970.db2.gz HHJKURMRZLFIFN-UHFFFAOYSA-N 1 3 346.519 2.949 10 0 EFAEHO C[N@@H+](CCC1CCN(C(=O)Cc2c[nH]cn2)CC1)CC1CC(C)(C)C1 ZINC001392192327 1355847974 /nfs/dbraw/zinc/84/79/74/1355847974.db2.gz HHJKURMRZLFIFN-UHFFFAOYSA-N 1 3 346.519 2.949 10 0 EFAEHO C[N@H+](CCC1CCN(C(=O)CN2CCCC2)CC1)Cc1ccsc1 ZINC001392200908 1355857561 /nfs/dbraw/zinc/85/75/61/1355857561.db2.gz KEXFQBYFQMRIEO-UHFFFAOYSA-N 1 3 349.544 2.904 10 0 EFAEHO C[N@@H+](CCC1CCN(C(=O)CN2CCCC2)CC1)Cc1ccsc1 ZINC001392200908 1355857567 /nfs/dbraw/zinc/85/75/67/1355857567.db2.gz KEXFQBYFQMRIEO-UHFFFAOYSA-N 1 3 349.544 2.904 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccccc1 ZINC001392225705 1355879347 /nfs/dbraw/zinc/87/93/47/1355879347.db2.gz YCSLAWQFJYQZJZ-OALUTQOASA-N 1 3 331.504 2.790 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccccc1 ZINC001392225702 1355879836 /nfs/dbraw/zinc/87/98/36/1355879836.db2.gz YCSLAWQFJYQZJZ-MOPGFXCFSA-N 1 3 331.504 2.790 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H]2C[C@H](NC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001394368315 1357741873 /nfs/dbraw/zinc/74/18/73/1357741873.db2.gz XLMWTJMANVETLU-JCNLHEQBSA-N 1 3 347.478 2.603 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@@H]2C[NH+]3CCC2CC3)c(C)c1 ZINC001392278344 1355934365 /nfs/dbraw/zinc/93/43/65/1355934365.db2.gz HPEDTJKZWYDBJM-HXUWFJFHSA-N 1 3 343.515 2.535 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001394372368 1357744243 /nfs/dbraw/zinc/74/42/43/1357744243.db2.gz ZRBUDTLUYMOYKG-VAMGGRTRSA-N 1 3 345.531 2.820 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001392323534 1355987836 /nfs/dbraw/zinc/98/78/36/1355987836.db2.gz UUUSFBUVPOVKMK-OAHLLOKOSA-N 1 3 333.467 2.544 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001392323534 1355987842 /nfs/dbraw/zinc/98/78/42/1355987842.db2.gz UUUSFBUVPOVKMK-OAHLLOKOSA-N 1 3 333.467 2.544 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N(C)CC[N@H+](C)CC2CCCC2)c1 ZINC001392339501 1356006503 /nfs/dbraw/zinc/00/65/03/1356006503.db2.gz VFOKYVNEGITCRO-UHFFFAOYSA-N 1 3 331.504 2.942 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N(C)CC[N@@H+](C)CC2CCCC2)c1 ZINC001392339501 1356006508 /nfs/dbraw/zinc/00/65/08/1356006508.db2.gz VFOKYVNEGITCRO-UHFFFAOYSA-N 1 3 331.504 2.942 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2Cc2ccccc2F)C1 ZINC001392340683 1356008367 /nfs/dbraw/zinc/00/83/67/1356008367.db2.gz GIKIPCQNPPECTQ-IEBWSBKVSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2Cc2ccccc2F)C1 ZINC001392340683 1356008369 /nfs/dbraw/zinc/00/83/69/1356008369.db2.gz GIKIPCQNPPECTQ-IEBWSBKVSA-N 1 3 347.478 2.589 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2cccc(C)c2)C1)N(C)C ZINC001394377984 1357749341 /nfs/dbraw/zinc/74/93/41/1357749341.db2.gz ZSFHNDMBVLIHKW-PBWTXFEYSA-N 1 3 331.504 2.881 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1ccccc1Cl ZINC001392565436 1356124638 /nfs/dbraw/zinc/12/46/38/1356124638.db2.gz FWSVKRBIMZLAQK-YOEHRIQHSA-N 1 3 337.895 2.809 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1ccccc1Cl ZINC001392565436 1356124641 /nfs/dbraw/zinc/12/46/41/1356124641.db2.gz FWSVKRBIMZLAQK-YOEHRIQHSA-N 1 3 337.895 2.809 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+][C@H](C)c1ccc(F)c(Cl)c1 ZINC001392617366 1356164521 /nfs/dbraw/zinc/16/45/21/1356164521.db2.gz ISYSSFCYBDMABT-QWHCGFSZSA-N 1 3 343.874 2.975 10 0 EFAEHO COc1ccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CCC[N@@H+]2C(C)C)cc1 ZINC001392652547 1356198473 /nfs/dbraw/zinc/19/84/73/1356198473.db2.gz FUPRPKNJQNRGLZ-LPHOPBHVSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CCC[N@H+]2C(C)C)cc1 ZINC001392652547 1356198475 /nfs/dbraw/zinc/19/84/75/1356198475.db2.gz FUPRPKNJQNRGLZ-LPHOPBHVSA-N 1 3 347.503 2.505 10 0 EFAEHO C[C@H](C[N@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)C1(N(C)C)CCC1 ZINC001392660981 1356208604 /nfs/dbraw/zinc/20/86/04/1356208604.db2.gz NALCFAFBCPFFHL-MRXNPFEDSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@H](C[N@@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)C1(N(C)C)CCC1 ZINC001392660981 1356208607 /nfs/dbraw/zinc/20/86/07/1356208607.db2.gz NALCFAFBCPFFHL-MRXNPFEDSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1 ZINC001392678311 1356227504 /nfs/dbraw/zinc/22/75/04/1356227504.db2.gz JURRRCQMJGAONZ-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1 ZINC001392678311 1356227507 /nfs/dbraw/zinc/22/75/07/1356227507.db2.gz JURRRCQMJGAONZ-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccccc1 ZINC001392679065 1356227690 /nfs/dbraw/zinc/22/76/90/1356227690.db2.gz LNKFICQOPVQJLF-PKOBYXMFSA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccccc1 ZINC001392679065 1356227696 /nfs/dbraw/zinc/22/76/96/1356227696.db2.gz LNKFICQOPVQJLF-PKOBYXMFSA-N 1 3 331.504 2.744 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C[N@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001392715345 1356269267 /nfs/dbraw/zinc/26/92/67/1356269267.db2.gz DJTVTMZBXYFTLZ-KXBFYZLASA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001392715345 1356269270 /nfs/dbraw/zinc/26/92/70/1356269270.db2.gz DJTVTMZBXYFTLZ-KXBFYZLASA-N 1 3 331.504 2.841 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)C[C@H](C)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001392731607 1356290027 /nfs/dbraw/zinc/29/00/27/1356290027.db2.gz WUTPJBKSLLAUFR-GOEBONIOSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)C[C@H](C)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001392731607 1356290033 /nfs/dbraw/zinc/29/00/33/1356290033.db2.gz WUTPJBKSLLAUFR-GOEBONIOSA-N 1 3 337.895 2.537 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+][C@H](C)c1ccc(F)cc1)C1CC1 ZINC001392796455 1356334194 /nfs/dbraw/zinc/33/41/94/1356334194.db2.gz COAFQNDEDRJTHK-KDOFPFPSSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1 ZINC001401746333 1363078598 /nfs/dbraw/zinc/07/85/98/1363078598.db2.gz AVGOHPWMVGTTIK-MAUKXSAKSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1 ZINC001401746333 1363078603 /nfs/dbraw/zinc/07/86/03/1363078603.db2.gz AVGOHPWMVGTTIK-MAUKXSAKSA-N 1 3 335.467 2.635 10 0 EFAEHO C[C@@H]([NH2+]C1(CNC(=O)CN(C)C2CCC2)CC1)c1cccc(F)c1 ZINC001392910982 1356424755 /nfs/dbraw/zinc/42/47/55/1356424755.db2.gz JCKFCJRGHJDGOL-CQSZACIVSA-N 1 3 333.451 2.609 10 0 EFAEHO C[C@H]([NH2+]C1(CNC(=O)CN(C)C2CCC2)CC1)c1ccc(F)cc1 ZINC001392911634 1356425531 /nfs/dbraw/zinc/42/55/31/1356425531.db2.gz NBBMIDJJRBLHLL-AWEZNQCLSA-N 1 3 333.451 2.609 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(NCc3ccc(CF)cc3)CC2)CC[N@@H+]1C ZINC001392926606 1356437264 /nfs/dbraw/zinc/43/72/64/1356437264.db2.gz CNWUQINLGOZTRZ-YJBOKZPZSA-N 1 3 347.478 2.625 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(NCc3ccc(CF)cc3)CC2)CC[N@H+]1C ZINC001392926606 1356437268 /nfs/dbraw/zinc/43/72/68/1356437268.db2.gz CNWUQINLGOZTRZ-YJBOKZPZSA-N 1 3 347.478 2.625 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+][C@@H]2CCCc3ccc(F)cc32)CC1)N(C)C ZINC001392935611 1356445098 /nfs/dbraw/zinc/44/50/98/1356445098.db2.gz DYJFDWFQLNUKMJ-MSOLQXFVSA-N 1 3 347.478 2.782 10 0 EFAEHO Cc1ccccc1C[NH2+]C1(CNC(=O)CN2[C@H](C)CC[C@H]2C)CC1 ZINC001392960436 1356467945 /nfs/dbraw/zinc/46/79/45/1356467945.db2.gz KIWMPZBRIMYFFP-IAGOWNOFSA-N 1 3 329.488 2.606 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2ccc(C(F)F)cc2)CC1 ZINC001392963219 1356470068 /nfs/dbraw/zinc/47/00/68/1356470068.db2.gz IIFOIHXJBDADFL-UHFFFAOYSA-N 1 3 339.430 2.703 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]Cc2cccc(Cl)c2)CC1 ZINC001392964321 1356471013 /nfs/dbraw/zinc/47/10/13/1356471013.db2.gz UFNRMPGTYMDQMS-GASCZTMLSA-N 1 3 349.906 2.951 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@H+](C/C=C/Cl)C1 ZINC001392965146 1356471628 /nfs/dbraw/zinc/47/16/28/1356471628.db2.gz WXHZPBKFBHJKPY-RUZMYDRRSA-N 1 3 341.927 2.784 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@@H+](C/C=C/Cl)C1 ZINC001392965146 1356471632 /nfs/dbraw/zinc/47/16/32/1356471632.db2.gz WXHZPBKFBHJKPY-RUZMYDRRSA-N 1 3 341.927 2.784 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CC[C@@]3(CCN(Cc4ccsc4)C3)C2)CC1 ZINC001392986480 1356492139 /nfs/dbraw/zinc/49/21/39/1356492139.db2.gz PSDSUXHOACRWNW-GOSISDBHSA-N 1 3 347.528 2.514 10 0 EFAEHO CC[C@@H](F)CNC[C@@H]1CCCN1C(=O)CC[N@H+](C)C1CCCCC1 ZINC001393053331 1356540871 /nfs/dbraw/zinc/54/08/71/1356540871.db2.gz VBUGNQQPYYVCMZ-AEFFLSMTSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@@H](F)CNC[C@@H]1CCCN1C(=O)CC[N@@H+](C)C1CCCCC1 ZINC001393053331 1356540873 /nfs/dbraw/zinc/54/08/73/1356540873.db2.gz VBUGNQQPYYVCMZ-AEFFLSMTSA-N 1 3 341.515 2.970 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1(C)CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001393071504 1356558795 /nfs/dbraw/zinc/55/87/95/1356558795.db2.gz WOUSGAGXBAAZNY-ZACQAIPSSA-N 1 3 344.503 2.668 10 0 EFAEHO CCCN(C)CC(=O)NC1(C)CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC001393071234 1356558851 /nfs/dbraw/zinc/55/88/51/1356558851.db2.gz TVDMLUGDOQMTSK-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCCC[C@@]2(CCN(C/C=C\Cl)C2)C1 ZINC001393084706 1356577576 /nfs/dbraw/zinc/57/75/76/1356577576.db2.gz ACNPRZOBBXTWAL-TWVNLXSWSA-N 1 3 341.927 2.785 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCCC[C@@]2(CCN(C/C=C\Cl)C2)C1 ZINC001393084706 1356577579 /nfs/dbraw/zinc/57/75/79/1356577579.db2.gz ACNPRZOBBXTWAL-TWVNLXSWSA-N 1 3 341.927 2.785 10 0 EFAEHO CCc1cccc(CN2CC[C@](C)(NC(=O)C[C@H]3CC[N@H+](C)C3)C2)c1 ZINC001393121022 1356620895 /nfs/dbraw/zinc/62/08/95/1356620895.db2.gz SZPFAIXFDNNERY-CTNGQTDRSA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1cccc(CN2CC[C@](C)(NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)c1 ZINC001393121022 1356620900 /nfs/dbraw/zinc/62/09/00/1356620900.db2.gz SZPFAIXFDNNERY-CTNGQTDRSA-N 1 3 343.515 2.671 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@]1(C)CCC[N@H+](CCC2CC2)C1 ZINC001393201844 1356712966 /nfs/dbraw/zinc/71/29/66/1356712966.db2.gz GHULVTLATNIRFI-AZUAARDMSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@]1(C)CCC[N@@H+](CCC2CC2)C1 ZINC001393201844 1356712969 /nfs/dbraw/zinc/71/29/69/1356712969.db2.gz GHULVTLATNIRFI-AZUAARDMSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@]1(C)CCC[N@H+](CC2CC2)C1 ZINC001393204724 1356716387 /nfs/dbraw/zinc/71/63/87/1356716387.db2.gz LSDDSOJPNUWSQD-AZUAARDMSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@]1(C)CCC[N@@H+](CC2CC2)C1 ZINC001393204724 1356716389 /nfs/dbraw/zinc/71/63/89/1356716389.db2.gz LSDDSOJPNUWSQD-AZUAARDMSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[N@H+](CCC(C)(C)C)CCC1(F)F)N(C)C ZINC001393246698 1356748683 /nfs/dbraw/zinc/74/86/83/1356748683.db2.gz ZVRFSIWYAHQEEP-GJZGRUSLSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[N@@H+](CCC(C)(C)C)CCC1(F)F)N(C)C ZINC001393246698 1356748686 /nfs/dbraw/zinc/74/86/86/1356748686.db2.gz ZVRFSIWYAHQEEP-GJZGRUSLSA-N 1 3 347.494 2.836 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001393394626 1356814050 /nfs/dbraw/zinc/81/40/50/1356814050.db2.gz JFNWPGFQMHRENT-FUHWJXTLSA-N 1 3 349.494 2.658 10 0 EFAEHO C[C@H]([NH2+]CC[C@@H]1CCN(C(=O)CN2CCCC2)C1)c1ccc(F)cc1 ZINC001393473337 1356873786 /nfs/dbraw/zinc/87/37/86/1356873786.db2.gz KZKOQEXYOVFYHH-DLBZAZTESA-N 1 3 347.478 2.811 10 0 EFAEHO CC(C)[C@@H](C(=O)NCc1cccc2c1CC[N@@H+](C(C)C)C2)N(C)C ZINC001393523754 1356919015 /nfs/dbraw/zinc/91/90/15/1356919015.db2.gz OTZIUQBUUKOURH-IBGZPJMESA-N 1 3 331.504 2.656 10 0 EFAEHO CC(C)[C@@H](C(=O)NCc1cccc2c1CC[N@H+](C(C)C)C2)N(C)C ZINC001393523754 1356919017 /nfs/dbraw/zinc/91/90/17/1356919017.db2.gz OTZIUQBUUKOURH-IBGZPJMESA-N 1 3 331.504 2.656 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC1([NH2+]CC[C@@H](C)F)CCC1 ZINC001393565129 1356954489 /nfs/dbraw/zinc/95/44/89/1356954489.db2.gz FSQCXCIMQYXWGQ-CVEARBPZSA-N 1 3 327.488 2.626 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CCCN(Cc2cccnc2)CC1)[NH+](CC)CC ZINC001393598720 1356982514 /nfs/dbraw/zinc/98/25/14/1356982514.db2.gz VOFVXBLUNJDHAL-MOPGFXCFSA-N 1 3 346.519 2.673 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1C[C@@]2(C)CN(C(=O)Cc3c[nH]cn3)C[C@@]2(C)C1 ZINC001394355840 1357730322 /nfs/dbraw/zinc/73/03/22/1357730322.db2.gz ILIVRQNXQBGSHC-AHRSYUTCSA-N 1 3 346.519 2.805 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1C[C@@]2(C)CN(C(=O)Cc3c[nH]cn3)C[C@@]2(C)C1 ZINC001394355840 1357730326 /nfs/dbraw/zinc/73/03/26/1357730326.db2.gz ILIVRQNXQBGSHC-AHRSYUTCSA-N 1 3 346.519 2.805 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC)([NH2+]Cc2ccccc2)CC1)N(C)C ZINC001393681045 1357074441 /nfs/dbraw/zinc/07/44/41/1357074441.db2.gz QEKSWZYYHAGAHQ-SFHVURJKSA-N 1 3 331.504 2.888 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)[C@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001394425507 1357803172 /nfs/dbraw/zinc/80/31/72/1357803172.db2.gz DNWMNVIFHOVLCS-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@H](C)[NH2+]CC1CCC(C)(C)CC1)N(C)C ZINC001394494634 1357876627 /nfs/dbraw/zinc/87/66/27/1357876627.db2.gz IJDOPDPFQQDRRK-DOTOQJQBSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]CC1CCC2(CC2)CC1 ZINC001394498310 1357880244 /nfs/dbraw/zinc/88/02/44/1357880244.db2.gz QJUZVUYUACNEMV-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](CN(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1)NC/C=C\Cl ZINC001394514811 1357897565 /nfs/dbraw/zinc/89/75/65/1357897565.db2.gz UINHEHQMPDAPGQ-KOTGUFOOSA-N 1 3 329.916 2.828 10 0 EFAEHO C[C@H](CN(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1)NC/C=C\Cl ZINC001394514811 1357897567 /nfs/dbraw/zinc/89/75/67/1357897567.db2.gz UINHEHQMPDAPGQ-KOTGUFOOSA-N 1 3 329.916 2.828 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCC1 ZINC001394529271 1357913628 /nfs/dbraw/zinc/91/36/28/1357913628.db2.gz OGNHPRKINBDKKK-DNVCBOLYSA-N 1 3 341.515 2.826 10 0 EFAEHO CCCN(C)CC(=O)N(C)C[C@@H](C)[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC001394538682 1357925100 /nfs/dbraw/zinc/92/51/00/1357925100.db2.gz IJMCYHMGXUBHOW-QZTJIDSGSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]CC[C@H]1CCc2ccccc21 ZINC001394566329 1357960439 /nfs/dbraw/zinc/96/04/39/1357960439.db2.gz JXJOKLINWOYROF-PKOBYXMFSA-N 1 3 345.531 2.883 10 0 EFAEHO C[C@H]1C[C@H](NCc2ccc(Cl)c(F)c2)CN1C(=O)CC[NH+](C)C ZINC001394669242 1357986577 /nfs/dbraw/zinc/98/65/77/1357986577.db2.gz LTNDHOMMCORCFP-JSGCOSHPSA-N 1 3 341.858 2.510 10 0 EFAEHO CC[C@H](F)CN1CC[C@]2(NC(=O)CC[NH+]3CCCCC3)CCC[C@H]12 ZINC001394684879 1358003233 /nfs/dbraw/zinc/00/32/33/1358003233.db2.gz HOFKFPQDINBXNL-JENIJYKNSA-N 1 3 339.499 2.724 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CC3CCCC3)[C@@H]2C1 ZINC001394684171 1358003566 /nfs/dbraw/zinc/00/35/66/1358003566.db2.gz GTDGOYNPPNLQKU-OTWHNJEPSA-N 1 3 335.536 2.734 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@]12CCC[C@H]1N(Cc1ccsc1)CC2 ZINC001394691839 1358014578 /nfs/dbraw/zinc/01/45/78/1358014578.db2.gz NYAVEIXAYWUZIB-SJLPKXTDSA-N 1 3 335.517 2.703 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)CCN(C(=O)[C@H]1CCCN1C)C(C)C ZINC001394800779 1358085459 /nfs/dbraw/zinc/08/54/59/1358085459.db2.gz GSWVMWXVZXSPAZ-QZTJIDSGSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)CCN(C(=O)[C@H]1CCCN1C)C(C)C ZINC001394800779 1358085462 /nfs/dbraw/zinc/08/54/62/1358085462.db2.gz GSWVMWXVZXSPAZ-QZTJIDSGSA-N 1 3 325.541 2.932 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+]Cc1ccsc1)C(C)(C)C)C1CCC1 ZINC001394825055 1358123047 /nfs/dbraw/zinc/12/30/47/1358123047.db2.gz YALLNMXBYUYZNK-MRXNPFEDSA-N 1 3 337.533 2.853 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]2CN(Cc3ccccc3F)CC[C@H]21 ZINC001436943360 1387342011 /nfs/dbraw/zinc/34/20/11/1387342011.db2.gz JIEGQIFQDZZQSF-PKOBYXMFSA-N 1 3 347.478 2.590 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@H]1C[C@@H](CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001397093145 1359670404 /nfs/dbraw/zinc/67/04/04/1359670404.db2.gz PAXCAICUBMRNKT-KYJSFNMBSA-N 1 3 335.467 2.594 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)NCc1ccccc1Cl ZINC001437137266 1387410420 /nfs/dbraw/zinc/41/04/20/1387410420.db2.gz ZAOWZXMJNCILMF-PBHICJAKSA-N 1 3 337.895 2.807 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)NCc1ccccc1Cl ZINC001437137266 1387410424 /nfs/dbraw/zinc/41/04/24/1387410424.db2.gz ZAOWZXMJNCILMF-PBHICJAKSA-N 1 3 337.895 2.807 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cc1 ZINC001397165853 1359718622 /nfs/dbraw/zinc/71/86/22/1359718622.db2.gz HIJMDTHCMWXGSP-YZGWKJHDSA-N 1 3 343.515 2.711 10 0 EFAEHO CC(C)CC[NH2+][C@H]1CCCCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001397211335 1359752787 /nfs/dbraw/zinc/75/27/87/1359752787.db2.gz ARDVTPQCIKFUGP-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001437142115 1387417514 /nfs/dbraw/zinc/41/75/14/1387417514.db2.gz CJWGTAUKZDEREA-FZKQIMNGSA-N 1 3 349.906 2.906 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2C[C@H](CNC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001397652241 1360027485 /nfs/dbraw/zinc/02/74/85/1360027485.db2.gz RFPQPCYBBXEQFA-JCNLHEQBSA-N 1 3 347.478 2.603 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]Cc2ccsc2)C1 ZINC001397681137 1360046542 /nfs/dbraw/zinc/04/65/42/1360046542.db2.gz SASKGOWMGCGGTH-MUIFIZLQSA-N 1 3 335.517 2.605 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]C/C=C/c1ccc(Cl)cc1)N(C)C ZINC001437164601 1387433672 /nfs/dbraw/zinc/43/36/72/1387433672.db2.gz GKTOLUITWSUYNG-CMFPSAGXSA-N 1 3 337.895 2.788 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]C/C=C/c1ccc(Cl)cc1)N(C)C ZINC001437164609 1387433883 /nfs/dbraw/zinc/43/38/83/1387433883.db2.gz GKTOLUITWSUYNG-PRDNVKDRSA-N 1 3 337.895 2.788 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2[N@@H+](CC(CC)CC)C1 ZINC001397737618 1360092253 /nfs/dbraw/zinc/09/22/53/1360092253.db2.gz CBLJVRVVCZNYFO-MUGJNUQGSA-N 1 3 349.563 2.933 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2[N@H+](CC(CC)CC)C1 ZINC001397737618 1360092257 /nfs/dbraw/zinc/09/22/57/1360092257.db2.gz CBLJVRVVCZNYFO-MUGJNUQGSA-N 1 3 349.563 2.933 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]Cc1ccccc1C(F)(F)F)N(C)C ZINC001437167212 1387436433 /nfs/dbraw/zinc/43/64/33/1387436433.db2.gz IKPRAVLSYZLSGA-IUODEOHRSA-N 1 3 345.409 2.640 10 0 EFAEHO Cc1cccc(C)c1C[N@H+]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@H]1C ZINC001397802599 1360152533 /nfs/dbraw/zinc/15/25/33/1360152533.db2.gz MQHOPLXLUYOVKM-YZGWKJHDSA-N 1 3 345.531 2.969 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@H]1C ZINC001397802599 1360152538 /nfs/dbraw/zinc/15/25/38/1360152538.db2.gz MQHOPLXLUYOVKM-YZGWKJHDSA-N 1 3 345.531 2.969 10 0 EFAEHO CCc1ccc(CN2CC[C@H](NC(=O)CCC[NH+](C)C)[C@H]2C)cc1 ZINC001397806676 1360158910 /nfs/dbraw/zinc/15/89/10/1360158910.db2.gz WLRKPSMNBIAWSN-APWZRJJASA-N 1 3 331.504 2.670 10 0 EFAEHO CC(C)CCC[NH+]1CCC(N(C)C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001398200606 1360374493 /nfs/dbraw/zinc/37/44/93/1360374493.db2.gz LVYKMVGXFOGFNY-GOSISDBHSA-N 1 3 325.541 2.932 10 0 EFAEHO CCCc1ccc(CN2CCC[C@@H](NC(=O)CC[NH+](C)C)C2)cc1 ZINC001398245051 1360413563 /nfs/dbraw/zinc/41/35/63/1360413563.db2.gz ZDSWAWKZPGXFJK-LJQANCHMSA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC12CC[NH+](CCc1cccs1)CC2 ZINC001398361716 1360484367 /nfs/dbraw/zinc/48/43/67/1360484367.db2.gz KWZLXEGVNMIYBS-QGZVFWFLSA-N 1 3 349.544 2.602 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@H](NCc1ccccc1F)C1CC1 ZINC001398400715 1360517094 /nfs/dbraw/zinc/51/70/94/1360517094.db2.gz OWOKNVZLQYNUCG-HKUYNNGSSA-N 1 3 347.478 2.685 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@H](NCc1ccccc1F)C1CC1 ZINC001398400715 1360517096 /nfs/dbraw/zinc/51/70/96/1360517096.db2.gz OWOKNVZLQYNUCG-HKUYNNGSSA-N 1 3 347.478 2.685 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc2ccccc2c1 ZINC001437201130 1387461179 /nfs/dbraw/zinc/46/11/79/1387461179.db2.gz GDBDSQAYAZKOFY-IAGOWNOFSA-N 1 3 339.483 2.776 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001437204920 1387464843 /nfs/dbraw/zinc/46/48/43/1387464843.db2.gz KOVGTPBBBOTTMK-DZGCQCFKSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)c1 ZINC001398536472 1360632087 /nfs/dbraw/zinc/63/20/87/1360632087.db2.gz HEUNNHCQKBOEJB-BZSNNMDCSA-N 1 3 347.478 2.745 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)c1 ZINC001398536472 1360632090 /nfs/dbraw/zinc/63/20/90/1360632090.db2.gz HEUNNHCQKBOEJB-BZSNNMDCSA-N 1 3 347.478 2.745 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NCCN(C)Cc1ccc2cc[nH]c2c1 ZINC001492873659 1360635686 /nfs/dbraw/zinc/63/56/86/1360635686.db2.gz OOBHRSBPTWJCNB-HZPDHXFCSA-N 1 3 342.487 2.589 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001398609043 1360668544 /nfs/dbraw/zinc/66/85/44/1360668544.db2.gz HEUNNHCQKBOEJB-FGTMMUONSA-N 1 3 347.478 2.745 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001398609043 1360668548 /nfs/dbraw/zinc/66/85/48/1360668548.db2.gz HEUNNHCQKBOEJB-FGTMMUONSA-N 1 3 347.478 2.745 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccccc32)C1)N(C)C ZINC001398611480 1360669595 /nfs/dbraw/zinc/66/95/95/1360669595.db2.gz LVHHUGSZHADAPW-BWPNAZKDSA-N 1 3 343.515 2.887 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)cc2F)C1 ZINC001398660264 1360694243 /nfs/dbraw/zinc/69/42/43/1360694243.db2.gz AVOPGOIFQWRVJE-YUELXQCFSA-N 1 3 339.430 2.603 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H](CC)c2ccc(F)cc2)C1 ZINC001398675023 1360705683 /nfs/dbraw/zinc/70/56/83/1360705683.db2.gz WSCJFPVEDYGKGF-FGTMMUONSA-N 1 3 335.467 2.855 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc(Cl)c2)C1)N(C)C ZINC001398676781 1360706995 /nfs/dbraw/zinc/70/69/95/1360706995.db2.gz ZXFLBXKINMVLBY-BBWFWOEESA-N 1 3 337.895 2.663 10 0 EFAEHO CCc1cccc(C[N@@H+]2CCC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001398682258 1360712766 /nfs/dbraw/zinc/71/27/66/1360712766.db2.gz ICVPHXDRYIXGHI-HXUWFJFHSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1cccc(C[N@H+]2CCC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001398682258 1360712768 /nfs/dbraw/zinc/71/27/68/1360712768.db2.gz ICVPHXDRYIXGHI-HXUWFJFHSA-N 1 3 345.531 2.917 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCCN(Cc2ccsc2)C1 ZINC001398685709 1360715889 /nfs/dbraw/zinc/71/58/89/1360715889.db2.gz FTHWCDSDFPBIDN-WMZOPIPTSA-N 1 3 349.544 2.951 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCCN(Cc2ccsc2)C1 ZINC001398685709 1360715891 /nfs/dbraw/zinc/71/58/91/1360715891.db2.gz FTHWCDSDFPBIDN-WMZOPIPTSA-N 1 3 349.544 2.951 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCCN(CCC(F)(F)F)C1)[NH+]1CCCC1 ZINC001398701368 1360728002 /nfs/dbraw/zinc/72/80/02/1360728002.db2.gz VNLSCNSKNOOQBO-CQSZACIVSA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+]C[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001398738960 1360754558 /nfs/dbraw/zinc/75/45/58/1360754558.db2.gz RXUPHRQYESVAMQ-ZWKOTPCHSA-N 1 3 325.541 2.837 10 0 EFAEHO Cc1ccc(CN2CCCC[C@@H]2CNC(=O)C[C@H]2CC[N@@H+](C)C2)cc1 ZINC001398751774 1360762961 /nfs/dbraw/zinc/76/29/61/1360762961.db2.gz BGWPBJFRBZVMME-WOJBJXKFSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1ccc(CN2CCCC[C@@H]2CNC(=O)C[C@H]2CC[N@H+](C)C2)cc1 ZINC001398751774 1360762962 /nfs/dbraw/zinc/76/29/62/1360762962.db2.gz BGWPBJFRBZVMME-WOJBJXKFSA-N 1 3 343.515 2.808 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@H](C)[NH2+]CCc1cccs1 ZINC001437212881 1387473783 /nfs/dbraw/zinc/47/37/83/1387473783.db2.gz HHBUPHIHBIESHW-WBVHZDCISA-N 1 3 337.533 2.648 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)[NH+]1CCCC1)[C@@H]1CCCN(C/C=C\Cl)C1 ZINC001398800588 1360802128 /nfs/dbraw/zinc/80/21/28/1360802128.db2.gz XSFLWBSXVBPQNW-LTSYXSSYSA-N 1 3 341.927 2.830 10 0 EFAEHO C[C@H](C(=O)NC[C@H](C)[NH2+]CCc1ccccc1F)N1CCCCCC1 ZINC001437215379 1387475845 /nfs/dbraw/zinc/47/58/45/1387475845.db2.gz MUTGWIVZZDEFCR-DLBZAZTESA-N 1 3 349.494 2.727 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CCC([NH2+]CCc2ccccc2F)CC1 ZINC001398844121 1360830043 /nfs/dbraw/zinc/83/00/43/1360830043.db2.gz KJXXFYSBAOEIKX-UHFFFAOYSA-N 1 3 349.494 2.725 10 0 EFAEHO Cc1ccc(C[NH2+]C2CCC(NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001398844618 1360830582 /nfs/dbraw/zinc/83/05/82/1360830582.db2.gz LLVPRFGDWNXREW-UHFFFAOYSA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001398931607 1360879487 /nfs/dbraw/zinc/87/94/87/1360879487.db2.gz XZDNKIWXAYMBJF-HKUYNNGSSA-N 1 3 331.504 2.505 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1cc(C)cc(C)c1 ZINC001398944292 1360886047 /nfs/dbraw/zinc/88/60/47/1360886047.db2.gz CLCDKVIMHPXCOI-HKUYNNGSSA-N 1 3 331.504 2.772 10 0 EFAEHO C[C@H](CNC(=O)c1ccc(CC[NH+](C)C)cc1)NCc1ccsc1 ZINC001399038901 1360951556 /nfs/dbraw/zinc/95/15/56/1360951556.db2.gz TYZDYLXJUQTIKG-OAHLLOKOSA-N 1 3 345.512 2.760 10 0 EFAEHO Cc1ccc(CN[C@H](C)CNC(=O)[C@H](C(C)C)[NH+](C)C)c(Cl)c1 ZINC001399114887 1361004846 /nfs/dbraw/zinc/00/48/46/1361004846.db2.gz SUCHKUBQSLZZMW-PBHICJAKSA-N 1 3 339.911 2.829 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C)Cc1cccc2ccccc21 ZINC001492879207 1361039053 /nfs/dbraw/zinc/03/90/53/1361039053.db2.gz PTEFXYPUQINSGJ-UHFFFAOYSA-N 1 3 327.472 2.728 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C)Cc1cccc2ccccc21 ZINC001492879207 1361039056 /nfs/dbraw/zinc/03/90/56/1361039056.db2.gz PTEFXYPUQINSGJ-UHFFFAOYSA-N 1 3 327.472 2.728 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]Cc1ccccc1C(F)(F)F ZINC001399167851 1361044466 /nfs/dbraw/zinc/04/44/66/1361044466.db2.gz QDWGKUBQOMBBSN-CYBMUJFWSA-N 1 3 345.409 2.640 10 0 EFAEHO CC[N@H+](C)[C@H](C(=O)N1CCC[C@@H](N(C)CCF)C1)c1ccccc1 ZINC001399278458 1361119893 /nfs/dbraw/zinc/11/98/93/1361119893.db2.gz IAVQDLINKZEWJS-MSOLQXFVSA-N 1 3 335.467 2.572 10 0 EFAEHO CC[N@@H+](C)[C@H](C(=O)N1CCC[C@@H](N(C)CCF)C1)c1ccccc1 ZINC001399278458 1361119901 /nfs/dbraw/zinc/11/99/01/1361119901.db2.gz IAVQDLINKZEWJS-MSOLQXFVSA-N 1 3 335.467 2.572 10 0 EFAEHO CCN(C)[C@H](C(=O)N1CCC[C@@H]([N@H+](C)CCF)C1)c1ccccc1 ZINC001399278458 1361119903 /nfs/dbraw/zinc/11/99/03/1361119903.db2.gz IAVQDLINKZEWJS-MSOLQXFVSA-N 1 3 335.467 2.572 10 0 EFAEHO CCN(C)[C@H](C(=O)N1CCC[C@@H]([N@@H+](C)CCF)C1)c1ccccc1 ZINC001399278458 1361119908 /nfs/dbraw/zinc/11/99/08/1361119908.db2.gz IAVQDLINKZEWJS-MSOLQXFVSA-N 1 3 335.467 2.572 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(Cl)cc1F)N(C)C ZINC001399374214 1361178201 /nfs/dbraw/zinc/17/82/01/1361178201.db2.gz MBXTUZHRFXQIGZ-MLGOLLRUSA-N 1 3 343.874 2.804 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001399404404 1361199928 /nfs/dbraw/zinc/19/99/28/1361199928.db2.gz WXFCQUOSYBLDHN-WMZOPIPTSA-N 1 3 331.504 2.630 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@H](C)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001399420197 1361210931 /nfs/dbraw/zinc/21/09/31/1361210931.db2.gz PXDUGDRTQAAOGD-JSGCOSHPSA-N 1 3 342.434 2.571 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]CCc1cccs1 ZINC001399429906 1361219387 /nfs/dbraw/zinc/21/93/87/1361219387.db2.gz JFTYQSXVXRUMFR-RDJZCZTQSA-N 1 3 337.533 2.649 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001399435288 1361222707 /nfs/dbraw/zinc/22/27/07/1361222707.db2.gz RXNSIKCUUDCDQU-GFCCVEGCSA-N 1 3 331.913 2.726 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@H](C)c2ccc(F)cc2)CC[N@@H+]1C ZINC001399480583 1361263354 /nfs/dbraw/zinc/26/33/54/1361263354.db2.gz FQWYUSSDKNMAEH-FHLIZLRMSA-N 1 3 335.467 2.665 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@H](C)c2ccc(F)cc2)CC[N@H+]1C ZINC001399480583 1361263357 /nfs/dbraw/zinc/26/33/57/1361263357.db2.gz FQWYUSSDKNMAEH-FHLIZLRMSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)c1ccccc1CN(C)CCNC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001399486069 1361268685 /nfs/dbraw/zinc/26/86/85/1361268685.db2.gz OKJSFFIOOOOFSB-HXUWFJFHSA-N 1 3 343.515 2.700 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@@H+]1C)[C@@H]1CCc2ccc(F)cc21 ZINC001399499536 1361281568 /nfs/dbraw/zinc/28/15/68/1361281568.db2.gz BCYHMEAFROXBKI-IEBWSBKVSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@H+]1C)[C@@H]1CCc2ccc(F)cc21 ZINC001399499536 1361281571 /nfs/dbraw/zinc/28/15/71/1361281571.db2.gz BCYHMEAFROXBKI-IEBWSBKVSA-N 1 3 347.478 2.735 10 0 EFAEHO CC[C@H](C(=O)NCC[N@H+](C)[C@@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001399501973 1361284009 /nfs/dbraw/zinc/28/40/09/1361284009.db2.gz OWIKGIXHYWKECQ-IAGOWNOFSA-N 1 3 337.895 2.716 10 0 EFAEHO CC[C@H](C(=O)NCC[N@@H+](C)[C@@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001399501973 1361284013 /nfs/dbraw/zinc/28/40/13/1361284013.db2.gz OWIKGIXHYWKECQ-IAGOWNOFSA-N 1 3 337.895 2.716 10 0 EFAEHO COc1cccc([C@H](C)N(C)CCNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001399565733 1361336165 /nfs/dbraw/zinc/33/61/65/1361336165.db2.gz FMKKHFPYVHMHIO-BQFCYCMXSA-N 1 3 347.503 2.535 10 0 EFAEHO COc1cccc([C@H](C)N(C)CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001399565733 1361336168 /nfs/dbraw/zinc/33/61/68/1361336168.db2.gz FMKKHFPYVHMHIO-BQFCYCMXSA-N 1 3 347.503 2.535 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C)Cc1ccc2ccccc2c1 ZINC001399651709 1361405500 /nfs/dbraw/zinc/40/55/00/1361405500.db2.gz ATXKCOLCYWCHQY-UHFFFAOYSA-N 1 3 327.472 2.728 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C)Cc1ccc2ccccc2c1 ZINC001399651709 1361405504 /nfs/dbraw/zinc/40/55/04/1361405504.db2.gz ATXKCOLCYWCHQY-UHFFFAOYSA-N 1 3 327.472 2.728 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)[C@H](C(C)C)[NH+]2CCCC2)c1 ZINC001437263958 1387515752 /nfs/dbraw/zinc/51/57/52/1387515752.db2.gz JYODWDALNNYJRE-LPHOPBHVSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)[C@H](C(C)C)[NH+]2CCCC2)c1 ZINC001437263955 1387516021 /nfs/dbraw/zinc/51/60/21/1387516021.db2.gz JYODWDALNNYJRE-APWZRJJASA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CNC(=O)C(C)(C)N3CCCC3)C2)cc1 ZINC001399914412 1361571842 /nfs/dbraw/zinc/57/18/42/1361571842.db2.gz DIODYZOIJAPDPB-LJQANCHMSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CNC(=O)C(C)(C)N3CCCC3)C2)cc1 ZINC001399914412 1361571845 /nfs/dbraw/zinc/57/18/45/1361571845.db2.gz DIODYZOIJAPDPB-LJQANCHMSA-N 1 3 343.515 2.808 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCN(Cc2ccc(F)cc2)C1)[NH+](CC)CC ZINC001399925842 1361581459 /nfs/dbraw/zinc/58/14/59/1361581459.db2.gz BWMLJUAFACPGQE-IEBWSBKVSA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1cc(C)cc(CN(CCNC(=O)C[C@H]2CC[N@@H+](C)C2)C2CC2)c1 ZINC001400033594 1361684540 /nfs/dbraw/zinc/68/45/40/1361684540.db2.gz PPUVFWHIMKGBDD-GOSISDBHSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1cc(C)cc(CN(CCNC(=O)C[C@H]2CC[N@H+](C)C2)C2CC2)c1 ZINC001400033594 1361684544 /nfs/dbraw/zinc/68/45/44/1361684544.db2.gz PPUVFWHIMKGBDD-GOSISDBHSA-N 1 3 343.515 2.726 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)C12CCC[NH+](CCC1)C2)c1ccccc1F ZINC001400052155 1361700373 /nfs/dbraw/zinc/70/03/73/1361700373.db2.gz MUHHYOYAIXDFMO-MRXNPFEDSA-N 1 3 347.478 2.811 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NCC[C@@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001400179874 1361818946 /nfs/dbraw/zinc/81/89/46/1361818946.db2.gz COZLFOSXQXLVFA-IAGOWNOFSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NCC[C@@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001400179874 1361818948 /nfs/dbraw/zinc/81/89/48/1361818948.db2.gz COZLFOSXQXLVFA-IAGOWNOFSA-N 1 3 349.906 2.620 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H]1CC[N@H+](CCC(F)(F)F)C1 ZINC001400193195 1361834190 /nfs/dbraw/zinc/83/41/90/1361834190.db2.gz GAFAFQSZSWZQKX-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H]1CC[N@@H+](CCC(F)(F)F)C1 ZINC001400193195 1361834196 /nfs/dbraw/zinc/83/41/96/1361834196.db2.gz GAFAFQSZSWZQKX-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)(C(=O)NCC1C[NH+](CC2CC3(CCC3)C2)C1)N1CCCCC1 ZINC001400487797 1361994713 /nfs/dbraw/zinc/99/47/13/1361994713.db2.gz MULAZNGDOQNRBM-UHFFFAOYSA-N 1 3 347.547 2.879 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@H+](CCCC2CCC2)C1 ZINC001400773424 1362156701 /nfs/dbraw/zinc/15/67/01/1362156701.db2.gz ZINAAWGZFXLQOW-HKUYNNGSSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@@H+](CCCC2CCC2)C1 ZINC001400773424 1362156702 /nfs/dbraw/zinc/15/67/02/1362156702.db2.gz ZINAAWGZFXLQOW-HKUYNNGSSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@@H]1CC[N@H+](CCCC2CCC2)C1 ZINC001400773427 1362156806 /nfs/dbraw/zinc/15/68/06/1362156806.db2.gz ZINAAWGZFXLQOW-PKOBYXMFSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@@H]1CC[N@@H+](CCCC2CCC2)C1 ZINC001400773427 1362156808 /nfs/dbraw/zinc/15/68/08/1362156808.db2.gz ZINAAWGZFXLQOW-PKOBYXMFSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]CCc1cccs1 ZINC001400800669 1362172003 /nfs/dbraw/zinc/17/20/03/1362172003.db2.gz IKFVIAITPZMOTM-DOTOQJQBSA-N 1 3 337.533 2.648 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001437334695 1387556475 /nfs/dbraw/zinc/55/64/75/1387556475.db2.gz WZIGUKUKVMHGHT-MSOLQXFVSA-N 1 3 331.504 2.834 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC[C@H](CC)NCc2ccccc2F)C1 ZINC001400881120 1362232286 /nfs/dbraw/zinc/23/22/86/1362232286.db2.gz ZEVXJJNPYHFEGL-MSOLQXFVSA-N 1 3 349.494 2.932 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC[C@H](CC)NCc2ccccc2F)C1 ZINC001400881120 1362232289 /nfs/dbraw/zinc/23/22/89/1362232289.db2.gz ZEVXJJNPYHFEGL-MSOLQXFVSA-N 1 3 349.494 2.932 10 0 EFAEHO CC[C@H](F)C[NH2+]CC1(NC(=O)CN(C)CC(C)(C)C)CCCC1 ZINC001400953228 1362293595 /nfs/dbraw/zinc/29/35/95/1362293595.db2.gz IQHFWJBYOLJGJB-HNNXBMFYSA-N 1 3 329.504 2.731 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[C@H]([NH2+]C/C=C/Cl)CC1)N1CCCC1 ZINC001401059550 1362401860 /nfs/dbraw/zinc/40/18/60/1362401860.db2.gz NRLKSKWJUVLPFO-IFDUGMKFSA-N 1 3 327.900 2.630 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[C@H]([NH2+]C/C=C\Cl)CC1)N1CCCC1 ZINC001401059556 1362402193 /nfs/dbraw/zinc/40/21/93/1362402193.db2.gz NRLKSKWJUVLPFO-XMCIUCFESA-N 1 3 327.900 2.630 10 0 EFAEHO CC[C@H](F)C[NH+]1CCC(CCNC(=O)CN(C)CC(C)(C)C)CC1 ZINC001401073635 1362414419 /nfs/dbraw/zinc/41/44/19/1362414419.db2.gz GFNCYOGODLVBRO-KRWDZBQOSA-N 1 3 343.531 2.931 10 0 EFAEHO CC[C@H](F)CN1CCC(CCNC(=O)CC[C@H]2CCC[N@@H+]2C)CC1 ZINC001401075465 1362417710 /nfs/dbraw/zinc/41/77/10/1362417710.db2.gz OAPNAFJFCRHKLP-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](F)CN1CCC(CCNC(=O)CC[C@H]2CCC[N@H+]2C)CC1 ZINC001401075465 1362417713 /nfs/dbraw/zinc/41/77/13/1362417713.db2.gz OAPNAFJFCRHKLP-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([N@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001437352582 1387573521 /nfs/dbraw/zinc/57/35/21/1387573521.db2.gz USMSBQZIDKNEIY-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([N@@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001437352582 1387573528 /nfs/dbraw/zinc/57/35/28/1387573528.db2.gz USMSBQZIDKNEIY-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)C[NH2+][C@H]1CCc2ccccc21 ZINC001401113641 1362452129 /nfs/dbraw/zinc/45/21/29/1362452129.db2.gz JMCNCLRLZSXSIK-BEFAXECRSA-N 1 3 329.488 2.500 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)C[NH2+][C@H]1CCc2ccccc21 ZINC001401113647 1362452182 /nfs/dbraw/zinc/45/21/82/1362452182.db2.gz JMCNCLRLZSXSIK-KXBFYZLASA-N 1 3 329.488 2.500 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001401127250 1362464456 /nfs/dbraw/zinc/46/44/56/1362464456.db2.gz XDLCXCBMJOGUMG-LSDHHAIUSA-N 1 3 345.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC001401152707 1362489487 /nfs/dbraw/zinc/48/94/87/1362489487.db2.gz JPRJMRIDWKWHIS-KGLIPLIRSA-N 1 3 341.446 2.708 10 0 EFAEHO CC(C)CCC[NH+]1CC2(C1)CCN(C(=O)CN1CC[C@@H](C)C1)CC2 ZINC001401192328 1362532723 /nfs/dbraw/zinc/53/27/23/1362532723.db2.gz DOLZUQOLUQQFOX-GOSISDBHSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@@H](C[NH2+]CC1CCC2(CC2)CC1)N(C)C(=O)C1(N(C)C)CCC1 ZINC001401219835 1362558756 /nfs/dbraw/zinc/55/87/56/1362558756.db2.gz HNXICGBMOIROLY-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](F)CNC[C@@H](C)N(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001401224156 1362563266 /nfs/dbraw/zinc/56/32/66/1362563266.db2.gz MCTMVSOITQQHGD-CABCVRRESA-N 1 3 329.504 2.824 10 0 EFAEHO CC[C@H](F)CNC[C@@H](C)N(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001401224156 1362563268 /nfs/dbraw/zinc/56/32/68/1362563268.db2.gz MCTMVSOITQQHGD-CABCVRRESA-N 1 3 329.504 2.824 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(Cl)s1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001401247503 1362585601 /nfs/dbraw/zinc/58/56/01/1362585601.db2.gz PLOHSUVPLUYKCA-CHWSQXEVSA-N 1 3 343.924 2.680 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(CF)cc1 ZINC001401265609 1362606405 /nfs/dbraw/zinc/60/64/05/1362606405.db2.gz HRMRPBGBWKOXCU-APWZRJJASA-N 1 3 349.494 2.967 10 0 EFAEHO CC[C@H](F)CNC[C@@H](CC(C)C)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001401283324 1362629489 /nfs/dbraw/zinc/62/94/89/1362629489.db2.gz LAZMJLHXMJUHES-DLBZAZTESA-N 1 3 341.515 2.731 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C[NH2+]CC1CC2(CCC2)C1)CC(C)C ZINC001401289109 1362634989 /nfs/dbraw/zinc/63/49/89/1362634989.db2.gz WGIPYEKPMGBNAT-QGZVFWFLSA-N 1 3 346.519 2.961 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(CF)cc2)[C@@H](C)C1 ZINC001401304209 1362649803 /nfs/dbraw/zinc/64/98/03/1362649803.db2.gz WLXQSRPXPIKZNG-QFBILLFUSA-N 1 3 349.494 2.823 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@@H]1C[NH2+]Cc1ccsc1 ZINC001401306085 1362651790 /nfs/dbraw/zinc/65/17/90/1362651790.db2.gz MTDQDVNOGWUUFE-WBVHZDCISA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C12CC[NH+](CC1)C2)N[C@@H](C)c1ccccc1F ZINC001401380112 1362732155 /nfs/dbraw/zinc/73/21/55/1362732155.db2.gz KUFYGJDCHXWYGC-MAUKXSAKSA-N 1 3 347.478 2.713 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1ccc(Cl)cc1)C(C)C)N(C)C ZINC001401382496 1362733202 /nfs/dbraw/zinc/73/32/02/1362733202.db2.gz PYDYUUOUWTUZHJ-DLBZAZTESA-N 1 3 339.911 2.911 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@H+](C)[C@@H]1CCc2ccccc21)N(C)C ZINC001401387260 1362740555 /nfs/dbraw/zinc/74/05/55/1362740555.db2.gz NFAZUWHMIGMXDK-RTBURBONSA-N 1 3 331.504 2.650 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@@H+](C)[C@@H]1CCc2ccccc21)N(C)C ZINC001401387260 1362740559 /nfs/dbraw/zinc/74/05/59/1362740559.db2.gz NFAZUWHMIGMXDK-RTBURBONSA-N 1 3 331.504 2.650 10 0 EFAEHO CN(CCc1ccccc1)CCN(C)C(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001401433515 1362800225 /nfs/dbraw/zinc/80/02/25/1362800225.db2.gz CQUVZJRKJQBUQV-PMACEKPBSA-N 1 3 345.531 2.740 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H](C)NC(=O)[C@@H]1CCCCN1C(C)C ZINC001401654366 1363003730 /nfs/dbraw/zinc/00/37/30/1363003730.db2.gz WIOBCDCWPPPEDQ-MJGOQNOKSA-N 1 3 331.504 2.852 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc2c(c1)CCC2 ZINC001401676252 1363019430 /nfs/dbraw/zinc/01/94/30/1363019430.db2.gz VUMNDBZKEHTJOI-OXQOHEQNSA-N 1 3 343.515 2.644 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc2c(c1)CCC2 ZINC001401676257 1363019504 /nfs/dbraw/zinc/01/95/04/1363019504.db2.gz VUMNDBZKEHTJOI-UZLBHIALSA-N 1 3 343.515 2.644 10 0 EFAEHO C[C@@H](CNCc1ccccc1F)NC(=O)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001401684828 1363024229 /nfs/dbraw/zinc/02/42/29/1363024229.db2.gz HMXYMROHYDPDNQ-HNAYVOBHSA-N 1 3 347.478 2.827 10 0 EFAEHO C[C@@H](CNCc1ccccc1F)NC(=O)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001401684828 1363024231 /nfs/dbraw/zinc/02/42/31/1363024231.db2.gz HMXYMROHYDPDNQ-HNAYVOBHSA-N 1 3 347.478 2.827 10 0 EFAEHO COc1cccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CCC[N@@H+]2C(C)C)c1 ZINC001401747938 1363081084 /nfs/dbraw/zinc/08/10/84/1363081084.db2.gz CZMLQHYBXITVLO-LPHOPBHVSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CCC[N@H+]2C(C)C)c1 ZINC001401747938 1363081088 /nfs/dbraw/zinc/08/10/88/1363081088.db2.gz CZMLQHYBXITVLO-LPHOPBHVSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc(CN(C)C[C@H](C)NC(=O)[C@H]2CCC[N@@H+]2C(C)C)c1 ZINC001401747943 1363081632 /nfs/dbraw/zinc/08/16/32/1363081632.db2.gz CZMLQHYBXITVLO-QFBILLFUSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc(CN(C)C[C@H](C)NC(=O)[C@H]2CCC[N@H+]2C(C)C)c1 ZINC001401747943 1363081638 /nfs/dbraw/zinc/08/16/38/1363081638.db2.gz CZMLQHYBXITVLO-QFBILLFUSA-N 1 3 347.503 2.505 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CCC[N@@H+]2C(C)C)cc1F ZINC001401748328 1363081863 /nfs/dbraw/zinc/08/18/63/1363081863.db2.gz DQCXCQKTCNQKLM-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CCC[N@H+]2C(C)C)cc1F ZINC001401748328 1363081865 /nfs/dbraw/zinc/08/18/65/1363081865.db2.gz DQCXCQKTCNQKLM-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@@H](C)NC(=O)[C@H]1CCC[N@@H+]1C(C)C ZINC001401754409 1363087633 /nfs/dbraw/zinc/08/76/33/1363087633.db2.gz JZCFKBRWUUWLKQ-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@@H](C)NC(=O)[C@H]1CCC[N@H+]1C(C)C ZINC001401754409 1363087636 /nfs/dbraw/zinc/08/76/36/1363087636.db2.gz JZCFKBRWUUWLKQ-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO C[C@@H](CN(C)Cc1ccccc1C1CC1)NC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001401809016 1363159031 /nfs/dbraw/zinc/15/90/31/1363159031.db2.gz XCLXAEFVRLADEZ-IRXDYDNUSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](CN(C)Cc1ccccc1C1CC1)NC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001401809016 1363159034 /nfs/dbraw/zinc/15/90/34/1363159034.db2.gz XCLXAEFVRLADEZ-IRXDYDNUSA-N 1 3 343.515 2.842 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCCC[C@H]1C[NH2+]Cc1ccsc1 ZINC001401818362 1363166514 /nfs/dbraw/zinc/16/65/14/1363166514.db2.gz IMYPXDDYPQIALH-IRXDYDNUSA-N 1 3 337.533 2.855 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+][C@@H](C)c2cccc(F)c2)CC1 ZINC001401945222 1363265556 /nfs/dbraw/zinc/26/55/56/1363265556.db2.gz SAUSKGVCQRIPCT-MAUKXSAKSA-N 1 3 347.478 2.998 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C2(CNC(=O)[C@H](C(C)C)N(C)C)CC2)c(C)c1 ZINC001401946300 1363266488 /nfs/dbraw/zinc/26/64/88/1363266488.db2.gz FCJOWLAIFUSXJS-IBGZPJMESA-N 1 3 345.531 2.936 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+][C@H]3CCc4ccc(F)cc43)CC2)CCC1 ZINC001401950677 1363269617 /nfs/dbraw/zinc/26/96/17/1363269617.db2.gz UQKSUBZTGXUBTE-KRWDZBQOSA-N 1 3 345.462 2.536 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1(N[C@@H]2CCc3ccc(F)cc32)CC1)[NH+](C)C ZINC001401976496 1363292922 /nfs/dbraw/zinc/29/29/22/1363292922.db2.gz DWXNWPXCFZIBIE-MSOLQXFVSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1(N[C@H]2CCc3ccc(F)cc32)CC1)[NH+](C)C ZINC001401976500 1363293270 /nfs/dbraw/zinc/29/32/70/1363293270.db2.gz DWXNWPXCFZIBIE-ROUUACIJSA-N 1 3 347.478 2.638 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@H](C(=O)NCC2(NCc3ccsc3)CC2)C1 ZINC001401979842 1363296733 /nfs/dbraw/zinc/29/67/33/1363296733.db2.gz RQJFVPGGCWPXPG-HOTGVXAUSA-N 1 3 335.517 2.607 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@@]2(CCN(Cc3ccccc3Cl)C2)C1 ZINC001402004321 1363323625 /nfs/dbraw/zinc/32/36/25/1363323625.db2.gz SSNRQRPOCRAPDP-LJQANCHMSA-N 1 3 349.906 2.716 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@@H](C)[NH2+]Cc1ccccc1 ZINC001402035078 1363345994 /nfs/dbraw/zinc/34/59/94/1363345994.db2.gz GXVGOQKRBNRICS-MJGOQNOKSA-N 1 3 331.504 2.886 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CC=C(Cl)Cl)C[C@H]1C ZINC001402048290 1363357801 /nfs/dbraw/zinc/35/78/01/1363357801.db2.gz FVTYVORUPXKIOE-OLZOCXBDSA-N 1 3 336.307 2.615 10 0 EFAEHO Cc1ccc(CN2CCC[C@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)cc1 ZINC001402075979 1363380611 /nfs/dbraw/zinc/38/06/11/1363380611.db2.gz GLNLMMNXUQICNT-PMACEKPBSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(CN2CCC[C@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)cc1 ZINC001402075979 1363380614 /nfs/dbraw/zinc/38/06/14/1363380614.db2.gz GLNLMMNXUQICNT-PMACEKPBSA-N 1 3 343.515 2.950 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@@H]1CCCN1C(=O)CN(C)C(C)C ZINC001402084914 1363388468 /nfs/dbraw/zinc/38/84/68/1363388468.db2.gz YVOOKLHTZHXFGW-IBGZPJMESA-N 1 3 331.504 2.670 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]Cc1ccccc1F)C1CCCC1 ZINC001402096561 1363402419 /nfs/dbraw/zinc/40/24/19/1363402419.db2.gz BZWYKHJIJFPDCO-LJQANCHMSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)[NH2+]C[C@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CCCC1 ZINC001402102855 1363409588 /nfs/dbraw/zinc/40/95/88/1363409588.db2.gz RZMXLWZHABYXSG-QFBILLFUSA-N 1 3 341.515 2.872 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@]1(C)CCN(Cc2ccc(C(F)F)cc2)C1 ZINC001402141997 1363449677 /nfs/dbraw/zinc/44/96/77/1363449677.db2.gz MNOAWEUCVDLFDM-GOSISDBHSA-N 1 3 339.430 2.657 10 0 EFAEHO CC[C@H](F)C[NH+]1CCC(C)(CNC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001402197705 1363505450 /nfs/dbraw/zinc/50/54/50/1363505450.db2.gz BLRCWFQLPIZQFF-HOTGVXAUSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1(C)CC[NH+](CC2CC(F)(F)C2)CC1 ZINC001402201322 1363509842 /nfs/dbraw/zinc/50/98/42/1363509842.db2.gz HLDOFXHVBLDVFS-UHFFFAOYSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@@H](C(=O)NC[C@]1(C)CCC[N@H+](Cc2ccsc2)C1)N(C)C ZINC001402216964 1363534035 /nfs/dbraw/zinc/53/40/35/1363534035.db2.gz XTHFQMSYKKROBL-WMZOPIPTSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@@H](C(=O)NC[C@]1(C)CCC[N@@H+](Cc2ccsc2)C1)N(C)C ZINC001402216964 1363534038 /nfs/dbraw/zinc/53/40/38/1363534038.db2.gz XTHFQMSYKKROBL-WMZOPIPTSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CC2CC(C)(C)C2)C1)N1CCCC1 ZINC001402235445 1363556764 /nfs/dbraw/zinc/55/67/64/1363556764.db2.gz RVKZLUDPMLLAIG-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CC2CC(C)(C)C2)C1)N1CCCC1 ZINC001402235445 1363556768 /nfs/dbraw/zinc/55/67/68/1363556768.db2.gz RVKZLUDPMLLAIG-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C(=O)[C@@H](CC)N(C)C)C1CC[NH+](CC[C@H](C)F)CC1 ZINC001402245480 1363565608 /nfs/dbraw/zinc/56/56/08/1363565608.db2.gz NNJDXAYRPCWNRX-DOTOQJQBSA-N 1 3 329.504 2.778 10 0 EFAEHO Cc1cc(C[NH+]2CCC3(C[C@@H]3NC(=O)CN(C)C(C)C)CC2)cs1 ZINC001402244346 1363565106 /nfs/dbraw/zinc/56/51/06/1363565106.db2.gz TZFAQPONQAECSD-KRWDZBQOSA-N 1 3 349.544 2.867 10 0 EFAEHO C[C@@H](c1ccccc1F)N1CCC2(C[C@H]2NC(=O)CC[NH+](C)C)CC1 ZINC001402245707 1363566951 /nfs/dbraw/zinc/56/69/51/1363566951.db2.gz QSIDYALZSXWOPM-MAUKXSAKSA-N 1 3 347.478 2.809 10 0 EFAEHO CC[C@@H](F)C[NH+]1CCC2(C[C@H]2NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001402246881 1363567214 /nfs/dbraw/zinc/56/72/14/1363567214.db2.gz SAUPWOSJOWZTBS-HZPDHXFCSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@H](N[C@@H](CNC(=O)CC[NH+](C)C)C1CC1)c1ccccc1Cl ZINC001402331053 1363609281 /nfs/dbraw/zinc/60/92/81/1363609281.db2.gz BIKZTKFNFNQVME-GUYCJALGSA-N 1 3 337.895 2.837 10 0 EFAEHO C[C@H](C(=O)NC[C@H]([NH2+]Cc1ccsc1)C1CC1)N1CCCCCC1 ZINC001402342848 1363615513 /nfs/dbraw/zinc/61/55/13/1363615513.db2.gz LNKQDEZTIFYWBA-QAPCUYQASA-N 1 3 349.544 2.997 10 0 EFAEHO C[C@H](C(=O)NC[C@H]([NH2+]CCC(F)(F)F)C1CC1)N1CCCCCC1 ZINC001402346592 1363617984 /nfs/dbraw/zinc/61/79/84/1363617984.db2.gz RFTZBHVWAZWTOC-HIFRSBDPSA-N 1 3 349.441 2.688 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]([NH2+]CC1CCC2(CC2)CC1)C1CC1 ZINC001402378756 1363637398 /nfs/dbraw/zinc/63/73/98/1363637398.db2.gz RUBLLPCIFSIEQN-GOSISDBHSA-N 1 3 344.503 2.715 10 0 EFAEHO CC[NH2+][C@H](CNC(=O)C(C)(C)N1CCCC1)c1ccccc1CC ZINC001402396952 1363655680 /nfs/dbraw/zinc/65/56/80/1363655680.db2.gz QIQWSLRFBKXWDV-GOSISDBHSA-N 1 3 331.504 2.890 10 0 EFAEHO CC(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001402403534 1363663344 /nfs/dbraw/zinc/66/33/44/1363663344.db2.gz IVMZNZKRFUIWLY-QRVBRYPASA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[C@H]1CCC[N@H+]1C ZINC001402403534 1363663347 /nfs/dbraw/zinc/66/33/47/1363663347.db2.gz IVMZNZKRFUIWLY-QRVBRYPASA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)CC[NH2+][C@H](C)[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001402406772 1363666573 /nfs/dbraw/zinc/66/65/73/1363666573.db2.gz YXUDMKINXXLYEE-IAGOWNOFSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@H](F)CN(C)C[C@H]1CCCN(C(=O)CC[NH+]2CCCCC2)C1 ZINC001402409060 1363669130 /nfs/dbraw/zinc/66/91/30/1363669130.db2.gz QNJLHQNVLJDXJI-MSOLQXFVSA-N 1 3 341.515 2.781 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001437430162 1387641894 /nfs/dbraw/zinc/64/18/94/1387641894.db2.gz XCCPWHRFOAFMRA-QAPCUYQASA-N 1 3 335.467 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2ccc3c(c2)CCC3)CCC1 ZINC001402574195 1363802576 /nfs/dbraw/zinc/80/25/76/1363802576.db2.gz DVJCTYVGHLNJIE-UHFFFAOYSA-N 1 3 343.515 2.644 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)c2ccc(C[NH+](C)C)cc2)CCC1 ZINC001402580497 1363809934 /nfs/dbraw/zinc/80/99/34/1363809934.db2.gz QLKQIDQPXIOCFR-KRWDZBQOSA-N 1 3 335.467 2.738 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]21 ZINC001402583071 1363811279 /nfs/dbraw/zinc/81/12/79/1363811279.db2.gz QRRBWURDTXEFLQ-UXHICEINSA-N 1 3 343.515 2.840 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]21 ZINC001402583071 1363811285 /nfs/dbraw/zinc/81/12/85/1363811285.db2.gz QRRBWURDTXEFLQ-UXHICEINSA-N 1 3 343.515 2.840 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@H+](Cc3ccccc3)CC[C@H]21 ZINC001402583083 1363811835 /nfs/dbraw/zinc/81/18/35/1363811835.db2.gz QRRBWURDTXEFLQ-VQTJNVASSA-N 1 3 343.515 2.840 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]21 ZINC001402583083 1363811840 /nfs/dbraw/zinc/81/18/40/1363811840.db2.gz QRRBWURDTXEFLQ-VQTJNVASSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@H]([NH2+][C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)C1)c1ccccc1F ZINC001402606973 1363830823 /nfs/dbraw/zinc/83/08/23/1363830823.db2.gz YZXBDKXTWKXZRB-SOUVJXGZSA-N 1 3 333.451 2.608 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001402620017 1363844786 /nfs/dbraw/zinc/84/47/86/1363844786.db2.gz DLZIFYMUVSBKRB-XJFOESAGSA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001402620017 1363844791 /nfs/dbraw/zinc/84/47/91/1363844791.db2.gz DLZIFYMUVSBKRB-XJFOESAGSA-N 1 3 346.302 2.559 10 0 EFAEHO COc1cccc(C[N@@H+]2CCC[C@H](NC(=O)CN(C)C(C)C)CC2)c1 ZINC001402621377 1363845655 /nfs/dbraw/zinc/84/56/55/1363845655.db2.gz PVECGWXUIZTKRW-SFHVURJKSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1cccc(C[N@H+]2CCC[C@H](NC(=O)CN(C)C(C)C)CC2)c1 ZINC001402621377 1363845660 /nfs/dbraw/zinc/84/56/60/1363845660.db2.gz PVECGWXUIZTKRW-SFHVURJKSA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c(C)c1 ZINC001402627425 1363854898 /nfs/dbraw/zinc/85/48/98/1363854898.db2.gz IAKPRAJCBCPAIG-CEXWTWQISA-N 1 3 331.504 2.626 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(F)cc2)C1)N(C)C ZINC001402630095 1363857839 /nfs/dbraw/zinc/85/78/39/1363857839.db2.gz MBPLHTSNUAXHDB-RUGDWHBFSA-N 1 3 335.467 2.710 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](Cc2ccccc2C)C1)N(C)C ZINC001402669395 1363916961 /nfs/dbraw/zinc/91/69/61/1363916961.db2.gz VFSUFTLWHKVQRS-PKOBYXMFSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccccc2C)C1)N(C)C ZINC001402669395 1363916964 /nfs/dbraw/zinc/91/69/64/1363916964.db2.gz VFSUFTLWHKVQRS-PKOBYXMFSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1CCCN(Cc2cccnc2)C1)[NH+](CC)CC ZINC001402670100 1363918156 /nfs/dbraw/zinc/91/81/56/1363918156.db2.gz WUVKFZBGKGHCII-OALUTQOASA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1CCC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001402693595 1363941892 /nfs/dbraw/zinc/94/18/92/1363941892.db2.gz XJVFRBBMVLXMBB-ROUUACIJSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1CCC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001402693595 1363941895 /nfs/dbraw/zinc/94/18/95/1363941895.db2.gz XJVFRBBMVLXMBB-ROUUACIJSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(CC)CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001402702666 1363950650 /nfs/dbraw/zinc/95/06/50/1363950650.db2.gz FEGLVNOZZWJGED-HOTGVXAUSA-N 1 3 329.504 2.682 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](CCCC(C)C)C1 ZINC001402772843 1364021186 /nfs/dbraw/zinc/02/11/86/1364021186.db2.gz FGFYCHZPYJPCPY-RDJZCZTQSA-N 1 3 334.508 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H]1CCC[N@H+](CCCC(C)C)C1 ZINC001402772843 1364021189 /nfs/dbraw/zinc/02/11/89/1364021189.db2.gz FGFYCHZPYJPCPY-RDJZCZTQSA-N 1 3 334.508 2.914 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CCCCN1C(C)C ZINC001402797578 1364044873 /nfs/dbraw/zinc/04/48/73/1364044873.db2.gz YHEKNZQKSYHCOR-SLHNCBLASA-N 1 3 349.563 2.978 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CCCCN1C(C)C ZINC001402797578 1364044876 /nfs/dbraw/zinc/04/48/76/1364044876.db2.gz YHEKNZQKSYHCOR-SLHNCBLASA-N 1 3 349.563 2.978 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]Cc1ccc(C)c(F)c1 ZINC001402860205 1364097731 /nfs/dbraw/zinc/09/77/31/1364097731.db2.gz SHHYDSWDPURCMY-LPHOPBHVSA-N 1 3 349.494 2.993 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]Cc1cc(Cl)ccc1F ZINC001402865518 1364100823 /nfs/dbraw/zinc/10/08/23/1364100823.db2.gz XKDFSKGBKMNCTR-ZDUSSCGKSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)c1ccc(C[NH2+][C@@H](C)CNC(=O)[C@H](C(C)C)N(C)C)cc1 ZINC001402905629 1364123269 /nfs/dbraw/zinc/12/32/69/1364123269.db2.gz DFOSPARWGRZCIJ-LPHOPBHVSA-N 1 3 333.520 2.991 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)CC[NH+](C)C)CCN1C/C=C\c1ccccc1 ZINC001402916706 1364132013 /nfs/dbraw/zinc/13/20/13/1364132013.db2.gz HTCQLOILWAPFIM-OSKOBQJQSA-N 1 3 329.488 2.621 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H]2CC[N@H+](CC3CCC3)C2)C1 ZINC001402919518 1364134061 /nfs/dbraw/zinc/13/40/61/1364134061.db2.gz AKPVRGPMSSZUAM-MOPGFXCFSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H]2CC[N@@H+](CC3CCC3)C2)C1 ZINC001402919518 1364134067 /nfs/dbraw/zinc/13/40/67/1364134067.db2.gz AKPVRGPMSSZUAM-MOPGFXCFSA-N 1 3 335.536 2.687 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1)N(C)C ZINC001402920274 1364136086 /nfs/dbraw/zinc/13/60/86/1364136086.db2.gz PEUXOSBKZLQQBL-IAQYHMDHSA-N 1 3 346.302 2.928 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@@H]1CCCN1C(=O)CC[NH+](C)C ZINC001402923864 1364139135 /nfs/dbraw/zinc/13/91/35/1364139135.db2.gz HHGYNGHHUDZNNR-SFHVURJKSA-N 1 3 335.467 2.509 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCCC1)[C@@H](C)[NH2+]CCc1ccccc1 ZINC001402989229 1364185620 /nfs/dbraw/zinc/18/56/20/1364185620.db2.gz YZYFFZKCYCZCLU-QZTJIDSGSA-N 1 3 345.531 2.976 10 0 EFAEHO C[C@@H]([NH2+]CCc1ccccc1)[C@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001402989198 1364185950 /nfs/dbraw/zinc/18/59/50/1364185950.db2.gz YZYFFZKCYCZCLU-MSOLQXFVSA-N 1 3 345.531 2.976 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001402989976 1364186622 /nfs/dbraw/zinc/18/66/22/1364186622.db2.gz AWOPVUCPMLVPPT-JKSUJKDBSA-N 1 3 329.488 2.500 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001402989843 1364187035 /nfs/dbraw/zinc/18/70/35/1364187035.db2.gz AWOPVUCPMLVPPT-CVEARBPZSA-N 1 3 329.488 2.500 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001403018552 1364218755 /nfs/dbraw/zinc/21/87/55/1364218755.db2.gz BZBKVMPNOGCDJJ-UONOGXRCSA-N 1 3 325.884 2.663 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001403020384 1364221918 /nfs/dbraw/zinc/22/19/18/1364221918.db2.gz VELPGMTYEULORO-CRAIPNDOSA-N 1 3 329.488 2.643 10 0 EFAEHO C[C@@H](NCc1ccccc1Cl)[C@@H](C)NC(=O)C1(C[NH+](C)C)CC1 ZINC001403023522 1364225076 /nfs/dbraw/zinc/22/50/76/1364225076.db2.gz CZBGNOGACHVKBO-ZIAGYGMSSA-N 1 3 337.895 2.665 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001403035692 1364239827 /nfs/dbraw/zinc/23/98/27/1364239827.db2.gz WMIJTSCXYWNLHC-DLBZAZTESA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)CNC(=O)[C@@H](C)N2CCCCCC2)cc1 ZINC001403040321 1364244077 /nfs/dbraw/zinc/24/40/77/1364244077.db2.gz BGYRHXBJQKUPAE-RTBURBONSA-N 1 3 345.531 2.896 10 0 EFAEHO Cc1ccc(CN[C@H](C)CNC(=O)C2CC[NH+](C)CC2)c(Cl)c1 ZINC001403056801 1364262294 /nfs/dbraw/zinc/26/22/94/1364262294.db2.gz YEANZTZCYWIWGD-CQSZACIVSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)CNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001403083769 1364287625 /nfs/dbraw/zinc/28/76/25/1364287625.db2.gz NXBZPXAPMZVGTN-CABCVRRESA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)CNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001403083769 1364287633 /nfs/dbraw/zinc/28/76/33/1364287633.db2.gz NXBZPXAPMZVGTN-CABCVRRESA-N 1 3 337.895 2.585 10 0 EFAEHO COc1cccc(CN(C)[C@@H](C)CNC(=O)[C@H]2CCC[N@@H+]2C(C)C)c1 ZINC001403111210 1364322446 /nfs/dbraw/zinc/32/24/46/1364322446.db2.gz DQCRBPRLAQCKRI-QFBILLFUSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc(CN(C)[C@@H](C)CNC(=O)[C@H]2CCC[N@H+]2C(C)C)c1 ZINC001403111210 1364322449 /nfs/dbraw/zinc/32/24/49/1364322449.db2.gz DQCRBPRLAQCKRI-QFBILLFUSA-N 1 3 347.503 2.505 10 0 EFAEHO CCc1ccc(C[NH2+][C@H]2CCN(C(=O)[C@H](F)CN(CC)CC)C2)cc1 ZINC001403167607 1364387992 /nfs/dbraw/zinc/38/79/92/1364387992.db2.gz LEAPGXXYHQDLHU-RBUKOAKNSA-N 1 3 349.494 2.619 10 0 EFAEHO Cc1cc(C)cc(C[NH+]2CC([C@H](C)NC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001403332052 1364548655 /nfs/dbraw/zinc/54/86/55/1364548655.db2.gz RKRYROKFLRUYIC-QAPCUYQASA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(CN2CC([C@H](C)NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)cc1 ZINC001403331683 1364548774 /nfs/dbraw/zinc/54/87/74/1364548774.db2.gz ULTJXEWPKOZNJQ-PXNSSMCTSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1ccc(CN2CC([C@H](C)NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)cc1 ZINC001403331683 1364548777 /nfs/dbraw/zinc/54/87/77/1364548777.db2.gz ULTJXEWPKOZNJQ-PXNSSMCTSA-N 1 3 343.515 2.806 10 0 EFAEHO CCc1ccc(CC[NH+]2CC([C@@H](C)NC(=O)CN(C)C(C)C)C2)cc1 ZINC001403359592 1364569822 /nfs/dbraw/zinc/56/98/22/1364569822.db2.gz XCXXECFECOWKMW-QGZVFWFLSA-N 1 3 345.531 2.568 10 0 EFAEHO Cc1ccccc1CN1C[C@@H](NC(=O)C2(C[NH+](C)C)CC2)C(C)(C)C1 ZINC001403378856 1364587599 /nfs/dbraw/zinc/58/75/99/1364587599.db2.gz INZKWOGFADOCOB-GOSISDBHSA-N 1 3 343.515 2.663 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[N@H+](CCC(C)C)CC1(C)C)N(CC)CC ZINC001403381763 1364590673 /nfs/dbraw/zinc/59/06/73/1364590673.db2.gz KVHPEBSBSRSQEI-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[N@@H+](CCC(C)C)CC1(C)C)N(CC)CC ZINC001403381763 1364590675 /nfs/dbraw/zinc/59/06/75/1364590675.db2.gz KVHPEBSBSRSQEI-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCC4(CC4)CC3)C[C@H]21)N(C)C ZINC001403388369 1364596221 /nfs/dbraw/zinc/59/62/21/1364596221.db2.gz OISZALYZEGTUCN-AKHDSKFASA-N 1 3 347.547 2.591 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCC4(CC4)CC3)C[C@H]21)N(C)C ZINC001403388369 1364596223 /nfs/dbraw/zinc/59/62/23/1364596223.db2.gz OISZALYZEGTUCN-AKHDSKFASA-N 1 3 347.547 2.591 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1ccccc1 ZINC001403440646 1364643848 /nfs/dbraw/zinc/64/38/48/1364643848.db2.gz FNAXZPZNKWZJTL-MJGOQNOKSA-N 1 3 331.504 2.934 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C)C[C@@H]2CCC(F)(F)C2)CC1 ZINC001403465373 1364667722 /nfs/dbraw/zinc/66/77/22/1364667722.db2.gz HRJMJABRKUIZIG-OAHLLOKOSA-N 1 3 345.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C)C[C@@H]2CCC(F)(F)C2)CC1 ZINC001403465373 1364667728 /nfs/dbraw/zinc/66/77/28/1364667728.db2.gz HRJMJABRKUIZIG-OAHLLOKOSA-N 1 3 345.478 2.685 10 0 EFAEHO CCCC[N@H+](C)C1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001403486262 1364693925 /nfs/dbraw/zinc/69/39/25/1364693925.db2.gz NNWPTXWJZLUTAM-IBGZPJMESA-N 1 3 341.515 2.922 10 0 EFAEHO CCCC[N@@H+](C)C1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001403486262 1364693928 /nfs/dbraw/zinc/69/39/28/1364693928.db2.gz NNWPTXWJZLUTAM-IBGZPJMESA-N 1 3 341.515 2.922 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)[C@@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001403504120 1364710040 /nfs/dbraw/zinc/71/00/40/1364710040.db2.gz CPUIOIWNUBZLKE-PMACEKPBSA-N 1 3 343.515 2.888 10 0 EFAEHO CCCc1ccc(CN(C)CCNC(=O)[C@H]2C[NH+]3CCC2CC3)cc1 ZINC001403564134 1364765980 /nfs/dbraw/zinc/76/59/80/1364765980.db2.gz KWUMTSPEKWVLIX-FQEVSTJZSA-N 1 3 343.515 2.529 10 0 EFAEHO CC[C@@H](N[C@@H](C)CN(C)C(=O)CC[NH+](C)C)c1ccc(F)cc1F ZINC001403607915 1364811850 /nfs/dbraw/zinc/81/18/50/1364811850.db2.gz XLMAIVLBIVUPKD-SUMWQHHRSA-N 1 3 341.446 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001403619046 1364821716 /nfs/dbraw/zinc/82/17/16/1364821716.db2.gz FINKBPUEPQQTPN-CQSZACIVSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001403698045 1364871920 /nfs/dbraw/zinc/87/19/20/1364871920.db2.gz BKCGTSSVLSTYIK-WOJBJXKFSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001403698045 1364871923 /nfs/dbraw/zinc/87/19/23/1364871923.db2.gz BKCGTSSVLSTYIK-WOJBJXKFSA-N 1 3 343.515 2.985 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@H]2CCC[C@H]3CCC[N@@H+]32)c1 ZINC001403701383 1364875003 /nfs/dbraw/zinc/87/50/03/1364875003.db2.gz RURUGYYMZKMJCH-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@H]2CCC[C@H]3CCC[N@H+]32)c1 ZINC001403701383 1364875006 /nfs/dbraw/zinc/87/50/06/1364875006.db2.gz RURUGYYMZKMJCH-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO CN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)[C@H]1CCc2c1cccc2Cl ZINC001403728787 1364888221 /nfs/dbraw/zinc/88/82/21/1364888221.db2.gz DCJLEFBWPRYWRZ-KDOFPFPSSA-N 1 3 349.906 2.717 10 0 EFAEHO CN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)[C@H]1CCc2c1cccc2Cl ZINC001403728787 1364888223 /nfs/dbraw/zinc/88/82/23/1364888223.db2.gz DCJLEFBWPRYWRZ-KDOFPFPSSA-N 1 3 349.906 2.717 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H]2C)cc1C ZINC001403742814 1364896059 /nfs/dbraw/zinc/89/60/59/1364896059.db2.gz HAKLBNQEUSGQRP-PKOBYXMFSA-N 1 3 331.504 2.723 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)cc1C ZINC001403761163 1364910268 /nfs/dbraw/zinc/91/02/68/1364910268.db2.gz BHXYVOSAZZPSOO-PKOBYXMFSA-N 1 3 331.504 2.723 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@]12CCC[C@@H]1N(Cc1cccc(F)c1)CC2 ZINC001403778125 1364928325 /nfs/dbraw/zinc/92/83/25/1364928325.db2.gz RBPHNJKRSQWFRB-AZUAARDMSA-N 1 3 347.478 2.781 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@]12CCC[C@@H]1N(Cc1cccc(F)c1)CC2 ZINC001403778125 1364928328 /nfs/dbraw/zinc/92/83/28/1364928328.db2.gz RBPHNJKRSQWFRB-AZUAARDMSA-N 1 3 347.478 2.781 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc(CF)cc1 ZINC001403807939 1364962014 /nfs/dbraw/zinc/96/20/14/1364962014.db2.gz VJWSAHLNFLADHJ-QAPCUYQASA-N 1 3 335.467 2.577 10 0 EFAEHO CC[C@@H](C)C[N@H+](CC)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001403910710 1365032719 /nfs/dbraw/zinc/03/27/19/1365032719.db2.gz GPVRNQJMKFIPGB-CRAIPNDOSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@@H](C)C[N@@H+](CC)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001403910710 1365032722 /nfs/dbraw/zinc/03/27/22/1365032722.db2.gz GPVRNQJMKFIPGB-CRAIPNDOSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC1CC(C)C1 ZINC001403910822 1365033935 /nfs/dbraw/zinc/03/39/35/1365033935.db2.gz HFFXXNDINMOPDB-RJYAGPCLSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC1CC(C)C1 ZINC001403910822 1365033938 /nfs/dbraw/zinc/03/39/38/1365033938.db2.gz HFFXXNDINMOPDB-RJYAGPCLSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)CC(C)(C)C)CC1CC2(CCC2)C1 ZINC001403914465 1365037295 /nfs/dbraw/zinc/03/72/95/1365037295.db2.gz QQZUSSGLSKMLKV-UHFFFAOYSA-N 1 3 337.552 2.983 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)CC(C)(C)C)CC1CC2(CCC2)C1 ZINC001403914465 1365037298 /nfs/dbraw/zinc/03/72/98/1365037298.db2.gz QQZUSSGLSKMLKV-UHFFFAOYSA-N 1 3 337.552 2.983 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)[C@H](C)c1ccc(F)cc1 ZINC001403926234 1365050712 /nfs/dbraw/zinc/05/07/12/1365050712.db2.gz RIWKRFBFRUVXQX-CVEARBPZSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)[C@H](C)c1ccc(F)cc1 ZINC001403926234 1365050719 /nfs/dbraw/zinc/05/07/19/1365050719.db2.gz RIWKRFBFRUVXQX-CVEARBPZSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCNC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C)Cc1ccc(OC)cc1 ZINC001403948781 1365090370 /nfs/dbraw/zinc/09/03/70/1365090370.db2.gz JWXTUCVJKPVGKQ-CALCHBBNSA-N 1 3 347.503 2.506 10 0 EFAEHO CCN(CCNC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C)Cc1ccc(OC)cc1 ZINC001403948781 1365090374 /nfs/dbraw/zinc/09/03/74/1365090374.db2.gz JWXTUCVJKPVGKQ-CALCHBBNSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@@H](NC(=O)CCC[NH+](C)C)C1CCN(Cc2cccc(F)c2)CC1 ZINC001403978668 1365126582 /nfs/dbraw/zinc/12/65/82/1365126582.db2.gz XFCAHYVZZVBQPN-MRXNPFEDSA-N 1 3 349.494 2.884 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C1CC[NH+](CC2CC(F)(F)C2)CC1 ZINC001403982076 1365131098 /nfs/dbraw/zinc/13/10/98/1365131098.db2.gz CZPGZISRONAJCT-CQSZACIVSA-N 1 3 345.478 2.590 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C1CC[NH+](CCC(C)(C)C)CC1 ZINC001403986896 1365136426 /nfs/dbraw/zinc/13/64/26/1365136426.db2.gz PUCIQTYSVQCAGN-MRXNPFEDSA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1cc(CN2CCC[C@@H]2CNC(=O)C[C@@H]2CC[N@@H+](C)C2)c(C)s1 ZINC001404021173 1365177494 /nfs/dbraw/zinc/17/74/94/1365177494.db2.gz MTHDYLARBPCXHO-FUHWJXTLSA-N 1 3 349.544 2.787 10 0 EFAEHO Cc1cc(CN2CCC[C@@H]2CNC(=O)C[C@@H]2CC[N@H+](C)C2)c(C)s1 ZINC001404021173 1365177499 /nfs/dbraw/zinc/17/74/99/1365177499.db2.gz MTHDYLARBPCXHO-FUHWJXTLSA-N 1 3 349.544 2.787 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C2CC(N(C)C(=O)CN(C)C(C)C)C2)c1 ZINC001404021702 1365178857 /nfs/dbraw/zinc/17/88/57/1365178857.db2.gz OJXRADZFDMTTTI-ZLPCBKJTSA-N 1 3 347.503 2.675 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]CC2CCC3(CC3)CC2)C1 ZINC001404026410 1365184697 /nfs/dbraw/zinc/18/46/97/1365184697.db2.gz WXLBLACIEGHWMH-UHFFFAOYSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001404097939 1365258608 /nfs/dbraw/zinc/25/86/08/1365258608.db2.gz SEUZVYCGBKNJFK-VQIMIIECSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001404097939 1365258612 /nfs/dbraw/zinc/25/86/12/1365258612.db2.gz SEUZVYCGBKNJFK-VQIMIIECSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@H](c1ccc(Cl)cc1)N(C)CCNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001437543573 1387748460 /nfs/dbraw/zinc/74/84/60/1387748460.db2.gz ZHCYTFDAGWKHNR-HUUCEWRRSA-N 1 3 337.895 2.791 10 0 EFAEHO C[C@H](c1ccc(Cl)cc1)N(C)CCNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001437543573 1387748464 /nfs/dbraw/zinc/74/84/64/1387748464.db2.gz ZHCYTFDAGWKHNR-HUUCEWRRSA-N 1 3 337.895 2.791 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2ccsc2)C1)N(C)C ZINC001404537058 1365636331 /nfs/dbraw/zinc/63/63/31/1365636331.db2.gz UCRDFFJJMCBVGZ-WBVHZDCISA-N 1 3 337.533 2.663 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2ccsc2)C1)N(C)C ZINC001404537058 1365636335 /nfs/dbraw/zinc/63/63/35/1365636335.db2.gz UCRDFFJJMCBVGZ-WBVHZDCISA-N 1 3 337.533 2.663 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)cc1F ZINC001404548583 1365641830 /nfs/dbraw/zinc/64/18/30/1365641830.db2.gz MWTUDYFJCTZTNO-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)cc1F ZINC001404548583 1365641833 /nfs/dbraw/zinc/64/18/33/1365641833.db2.gz MWTUDYFJCTZTNO-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)(C(=O)NCC1C[NH+](CC2CCCCCC2)C1)N1CCCC1 ZINC001404906860 1365897703 /nfs/dbraw/zinc/89/77/03/1365897703.db2.gz YFWYACPJZSJKTH-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](CC)[NH2+]Cc1ccc(F)cc1 ZINC001405251683 1366118635 /nfs/dbraw/zinc/11/86/35/1366118635.db2.gz JUXYBEALOXDVPC-ZWKOTPCHSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC)NCC=C(Cl)Cl ZINC001405271115 1366127064 /nfs/dbraw/zinc/12/70/64/1366127064.db2.gz WSAJZKOCDBTVAF-FRRDWIJNSA-N 1 3 336.307 2.520 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC)NCC=C(Cl)Cl ZINC001405271115 1366127065 /nfs/dbraw/zinc/12/70/65/1366127065.db2.gz WSAJZKOCDBTVAF-FRRDWIJNSA-N 1 3 336.307 2.520 10 0 EFAEHO CC[C@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)NCc1cccc(C(C)C)n1 ZINC001405332504 1366149665 /nfs/dbraw/zinc/14/96/65/1366149665.db2.gz IADJSUYBUNNWMJ-IAGOWNOFSA-N 1 3 346.519 2.531 10 0 EFAEHO CC[C@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)NCc1cccc(C(C)C)n1 ZINC001405332504 1366149670 /nfs/dbraw/zinc/14/96/70/1366149670.db2.gz IADJSUYBUNNWMJ-IAGOWNOFSA-N 1 3 346.519 2.531 10 0 EFAEHO CC[C@H](C(=O)N[C@@](C)(C[NH2+]Cc1ccc(C)c(F)c1)C1CC1)N(C)C ZINC001405451468 1366209504 /nfs/dbraw/zinc/20/95/04/1366209504.db2.gz YYZVTFHIZQARKJ-QUCCMNQESA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@H]1CC[C@H](NC(=O)C(C)(C)N2CCCC2)CC1 ZINC001405530513 1366273461 /nfs/dbraw/zinc/27/34/61/1366273461.db2.gz WSXICQCFCDRVHA-BZUAXINKSA-N 1 3 327.488 2.626 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCc1ccc(C[NH2+]CC2CC2)cc1 ZINC001405538318 1366278363 /nfs/dbraw/zinc/27/83/63/1366278363.db2.gz FOZPQBBJSSQOKY-IYBDPMFKSA-N 1 3 329.488 2.675 10 0 EFAEHO COc1ccc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCCC2)cc1 ZINC001405784915 1366413055 /nfs/dbraw/zinc/41/30/55/1366413055.db2.gz ULISGKITBBORFS-UHFFFAOYSA-N 1 3 347.503 2.554 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)N(C)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001405821178 1366439470 /nfs/dbraw/zinc/43/94/70/1366439470.db2.gz YIVNIUKDASVBFE-SQWLQELKSA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)N(C)C(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001405821178 1366439472 /nfs/dbraw/zinc/43/94/72/1366439472.db2.gz YIVNIUKDASVBFE-SQWLQELKSA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C(=O)CN(C)C1CCC1 ZINC001405838810 1366452724 /nfs/dbraw/zinc/45/27/24/1366452724.db2.gz VQQDGPADUPTCMK-HNNXBMFYSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@H](C[NH2+]CC1CC2(CCC2)C1)N(C)C(=O)CN(C)CC(C)(C)C ZINC001405862701 1366472417 /nfs/dbraw/zinc/47/24/17/1366472417.db2.gz JQCJWYPDWMAIQX-MRXNPFEDSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@H](C)C2)c(C)s1 ZINC001405871482 1366480199 /nfs/dbraw/zinc/48/01/99/1366480199.db2.gz QSPUBAFZYCORDN-KBPBESRZSA-N 1 3 337.533 2.643 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C[C@H](C)N(C)C(=O)CN1CCCC1 ZINC001405887691 1366493150 /nfs/dbraw/zinc/49/31/50/1366493150.db2.gz KIQCHXGGRLWLSJ-KRWDZBQOSA-N 1 3 331.504 2.842 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(C)nc1C ZINC001405901728 1366506312 /nfs/dbraw/zinc/50/63/12/1366506312.db2.gz FEVMLGFXWXHCDV-QFBILLFUSA-N 1 3 346.519 2.509 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21)Cc1ccc(F)cc1 ZINC001437603420 1387817613 /nfs/dbraw/zinc/81/76/13/1387817613.db2.gz UUCUXRMTNWPZEP-MOPGFXCFSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21)Cc1ccc(F)cc1 ZINC001437603420 1387817622 /nfs/dbraw/zinc/81/76/22/1387817622.db2.gz UUCUXRMTNWPZEP-MOPGFXCFSA-N 1 3 347.478 2.781 10 0 EFAEHO Cc1cc(C)c(CN(C)CCN(C)C(=O)C23CC[NH+](CC2)C3)c(C)c1 ZINC001406150633 1367323703 /nfs/dbraw/zinc/32/37/03/1367323703.db2.gz DRRZWXGYIYQVGR-UHFFFAOYSA-N 1 3 343.515 2.598 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]Cc1ccc(CF)cc1 ZINC001406203561 1367399202 /nfs/dbraw/zinc/39/92/02/1367399202.db2.gz RMJCRDIWNARQAK-RTBURBONSA-N 1 3 349.494 2.871 10 0 EFAEHO CC[N@H+](CCNC(=O)Cc1nc[nH]c1C)CC1CCC2(CC2)CC1 ZINC001437642811 1387880756 /nfs/dbraw/zinc/88/07/56/1387880756.db2.gz TUGZGMXHHRVQSZ-UHFFFAOYSA-N 1 3 332.492 2.669 10 0 EFAEHO CC[N@@H+](CCNC(=O)Cc1nc[nH]c1C)CC1CCC2(CC2)CC1 ZINC001437642811 1387880763 /nfs/dbraw/zinc/88/07/63/1387880763.db2.gz TUGZGMXHHRVQSZ-UHFFFAOYSA-N 1 3 332.492 2.669 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1C[NH+]2CCC1CC2)Cc1cc(C)sc1C ZINC001492951034 1367545225 /nfs/dbraw/zinc/54/52/25/1367545225.db2.gz BVKXIMYYJWBSAT-GOSISDBHSA-N 1 3 349.544 2.645 10 0 EFAEHO C[C@H](C[NH2+]CC1CC(C)(C)C1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001406399191 1367547383 /nfs/dbraw/zinc/54/73/83/1367547383.db2.gz IMSDUJNFOREKEX-KUHUBIRLSA-N 1 3 341.515 2.729 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001406419510 1367569825 /nfs/dbraw/zinc/56/98/25/1367569825.db2.gz IPSSSPBZILFWHK-DYVFJYSZSA-N 1 3 337.895 2.763 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC001406429446 1367581339 /nfs/dbraw/zinc/58/13/39/1367581339.db2.gz HKUARUGCNLNGEG-GFCCVEGCSA-N 1 3 346.302 2.928 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]Cc1ccc(C(F)(F)F)cc1)N(C)C ZINC001406504242 1367660558 /nfs/dbraw/zinc/66/05/58/1367660558.db2.gz UWFCTGYHPAQQMJ-SWLSCSKDSA-N 1 3 345.409 2.640 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@@H]2CCCC[N@@H+]2C(C)C)c1 ZINC001406533175 1367695224 /nfs/dbraw/zinc/69/52/24/1367695224.db2.gz NYPPZWLGDXTCAR-LPHOPBHVSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@@H]2CCCC[N@H+]2C(C)C)c1 ZINC001406533175 1367695233 /nfs/dbraw/zinc/69/52/33/1367695233.db2.gz NYPPZWLGDXTCAR-LPHOPBHVSA-N 1 3 349.494 2.991 10 0 EFAEHO CCc1cccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)c1 ZINC001406594934 1367773052 /nfs/dbraw/zinc/77/30/52/1367773052.db2.gz BVFYIORDQGCPAB-LSTHTHJFSA-N 1 3 345.531 2.916 10 0 EFAEHO CCc1cccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)c1 ZINC001406594934 1367773058 /nfs/dbraw/zinc/77/30/58/1367773058.db2.gz BVFYIORDQGCPAB-LSTHTHJFSA-N 1 3 345.531 2.916 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C[N@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001406690133 1367923032 /nfs/dbraw/zinc/92/30/32/1367923032.db2.gz JYEDWCWHUSVXAF-HNAYVOBHSA-N 1 3 344.503 2.691 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001406690133 1367923036 /nfs/dbraw/zinc/92/30/36/1367923036.db2.gz JYEDWCWHUSVXAF-HNAYVOBHSA-N 1 3 344.503 2.691 10 0 EFAEHO CC(C)Cc1ccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CC[N@H+](C)C2)cc1 ZINC001406697310 1367939100 /nfs/dbraw/zinc/93/91/00/1367939100.db2.gz HINUPZZMVDMYOZ-YLJYHZDGSA-N 1 3 345.531 2.773 10 0 EFAEHO CC(C)Cc1ccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001406697310 1367939104 /nfs/dbraw/zinc/93/91/04/1367939104.db2.gz HINUPZZMVDMYOZ-YLJYHZDGSA-N 1 3 345.531 2.773 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCCC[C@H]1CNC/C(Cl)=C\Cl ZINC001406719740 1367968068 /nfs/dbraw/zinc/96/80/68/1367968068.db2.gz NWEAHHRPDGHRQH-LACBQNOSSA-N 1 3 336.307 2.522 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCCC[C@H]1CNC/C(Cl)=C/Cl ZINC001406719794 1367968328 /nfs/dbraw/zinc/96/83/28/1367968328.db2.gz NWEAHHRPDGHRQH-OIZKETEYSA-N 1 3 336.307 2.522 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCCC[C@@H]1CNC/C(Cl)=C\Cl ZINC001406719808 1367969147 /nfs/dbraw/zinc/96/91/47/1367969147.db2.gz NWEAHHRPDGHRQH-QGBLLJAOSA-N 1 3 336.307 2.522 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)[C@@H]1CCc2c1cccc2F ZINC001406726638 1367973012 /nfs/dbraw/zinc/97/30/12/1367973012.db2.gz RBSPMJIRQNRCRM-KBXCAEBGSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)[C@@H]1CCc2c1cccc2F ZINC001406726638 1367973019 /nfs/dbraw/zinc/97/30/19/1367973019.db2.gz RBSPMJIRQNRCRM-KBXCAEBGSA-N 1 3 335.467 2.590 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN2CCCC2)CC[C@@H]1[NH2+]C/C(Cl)=C/Cl ZINC001406806513 1368079241 /nfs/dbraw/zinc/07/92/41/1368079241.db2.gz KMIOHNGNAPEFMZ-RSDGBYALSA-N 1 3 348.318 2.618 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@H]1CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001406837389 1368111224 /nfs/dbraw/zinc/11/12/24/1368111224.db2.gz GKNCWFZHYONBGE-MOPGFXCFSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@H]1CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001406837389 1368111231 /nfs/dbraw/zinc/11/12/31/1368111231.db2.gz GKNCWFZHYONBGE-MOPGFXCFSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+][C@H](C)c1cccc(F)c1)C1CC1 ZINC001406841046 1368114750 /nfs/dbraw/zinc/11/47/50/1368114750.db2.gz ZVBLLECGTFFIMW-KDOFPFPSSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCN1CCC1CCCC1)[NH+]1CCCC1 ZINC001406889110 1368172883 /nfs/dbraw/zinc/17/28/83/1368172883.db2.gz CTPINYVPLLCMRB-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCN1CCC1CCCC1)[NH+]1CCCC1 ZINC001406889104 1368173051 /nfs/dbraw/zinc/17/30/51/1368173051.db2.gz CTPINYVPLLCMRB-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+]Cc2ccc(C3CC3)cc2)CC1)N(C)C ZINC001406942183 1368233195 /nfs/dbraw/zinc/23/31/95/1368233195.db2.gz YGFNKQIBVNOJRE-GOSISDBHSA-N 1 3 329.488 2.643 10 0 EFAEHO C[C@@H]([NH2+]C1(CNC(=O)C2(N(C)C)CCC2)CC1)c1ccc(F)cc1 ZINC001406941381 1368233251 /nfs/dbraw/zinc/23/32/51/1368233251.db2.gz BOYVIFZHGDMWPI-CQSZACIVSA-N 1 3 333.451 2.609 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(NC/C=C\c3ccccc3)CC2)CC[N@@H+]1C ZINC001406957673 1368246829 /nfs/dbraw/zinc/24/68/29/1368246829.db2.gz LUSDGMKPJDHJDK-DSUQPAJGSA-N 1 3 341.499 2.669 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(NC/C=C\c3ccccc3)CC2)CC[N@H+]1C ZINC001406957673 1368246837 /nfs/dbraw/zinc/24/68/37/1368246837.db2.gz LUSDGMKPJDHJDK-DSUQPAJGSA-N 1 3 341.499 2.669 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@H](C(=O)NCC2(NCc3ccccc3)CC2)C1 ZINC001406992836 1368290347 /nfs/dbraw/zinc/29/03/47/1368290347.db2.gz YANJHLJZMIAQHL-ROUUACIJSA-N 1 3 329.488 2.545 10 0 EFAEHO Cc1cccc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@H]3C)CC2)c1 ZINC001407010236 1368318217 /nfs/dbraw/zinc/31/82/17/1368318217.db2.gz RPYPHIHYRRUTFK-IAGOWNOFSA-N 1 3 329.488 2.606 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+][C@H](C)c2cccc(Cl)c2)CC1 ZINC001407013402 1368323379 /nfs/dbraw/zinc/32/33/79/1368323379.db2.gz ZFXNTQDDJARKNS-CQSZACIVSA-N 1 3 337.895 2.980 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)c1 ZINC001407093462 1368418152 /nfs/dbraw/zinc/41/81/52/1368418152.db2.gz NGMXBEFDFVNNSG-FUHWJXTLSA-N 1 3 349.494 2.943 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@@H]1CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001407108808 1368434778 /nfs/dbraw/zinc/43/47/78/1368434778.db2.gz IZVCFKQFVWYLKB-APWZRJJASA-N 1 3 331.504 2.989 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@]1(C)CCN(Cc2ccccc2)C1 ZINC001407170212 1368535692 /nfs/dbraw/zinc/53/56/92/1368535692.db2.gz CBLURTJZSAYPKV-UYAOXDASSA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@]1(C)CCN(Cc2ccccc2)C1 ZINC001407170212 1368535696 /nfs/dbraw/zinc/53/56/96/1368535696.db2.gz CBLURTJZSAYPKV-UYAOXDASSA-N 1 3 329.488 2.642 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCCC[C@]2(CCN(C/C=C/Cl)C2)C1 ZINC001407174123 1368540895 /nfs/dbraw/zinc/54/08/95/1368540895.db2.gz RREZGKAQEIYYCO-WGLAMXGCSA-N 1 3 341.927 2.785 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(C)CCN(C/C=C/Cl)CC2)CC[N@@H+]1C ZINC001407264331 1368673104 /nfs/dbraw/zinc/67/31/04/1368673104.db2.gz WDMTYXODMXNRHH-NJEVBOHQSA-N 1 3 341.927 2.688 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(C)CCN(C/C=C/Cl)CC2)CC[N@H+]1C ZINC001407264331 1368673108 /nfs/dbraw/zinc/67/31/08/1368673108.db2.gz WDMTYXODMXNRHH-NJEVBOHQSA-N 1 3 341.927 2.688 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1(C)CC[NH+](CC[C@@H](C)F)CC1)N(C)C ZINC001407273117 1368685279 /nfs/dbraw/zinc/68/52/79/1368685279.db2.gz IYWFMNLYNTXHJX-CVEARBPZSA-N 1 3 329.504 2.539 10 0 EFAEHO CC[C@@H](C(=O)NCC1(C)CC[NH+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001407276354 1368691409 /nfs/dbraw/zinc/69/14/09/1368691409.db2.gz YACQOWVNUJNAGA-KRWDZBQOSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1cc(CN2CCC[C@](C)(CNC(=O)CC[NH+](C)C)C2)cs1 ZINC001407286814 1368708184 /nfs/dbraw/zinc/70/81/84/1368708184.db2.gz DMUCZWWBCNNJKW-GOSISDBHSA-N 1 3 337.533 2.727 10 0 EFAEHO CC[C@H](C(=O)NC[C@@]1(C)CCC[N@H+](CCC(C)(C)C)C1)N(C)C ZINC001407290106 1368713312 /nfs/dbraw/zinc/71/33/12/1368713312.db2.gz CMFUPAJPZHEFNV-VQIMIIECSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CCC(C)(C)C)C1)N(C)C ZINC001407290106 1368713318 /nfs/dbraw/zinc/71/33/18/1368713318.db2.gz CMFUPAJPZHEFNV-VQIMIIECSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C(=O)NC[C@]1(C)CCC[N@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001407298155 1368728729 /nfs/dbraw/zinc/72/87/29/1368728729.db2.gz IYGKYAWQPVODQH-PXNSSMCTSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H](C(=O)NC[C@]1(C)CCC[N@@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001407298155 1368728732 /nfs/dbraw/zinc/72/87/32/1368728732.db2.gz IYGKYAWQPVODQH-PXNSSMCTSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C2CC[NH+](CC3CC3)CC2)C1 ZINC001407503606 1368918396 /nfs/dbraw/zinc/91/83/96/1368918396.db2.gz YECQNIMJUBWOMA-LJQANCHMSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](Cc3ccc(Cl)cc3)C[C@@H]2C1 ZINC001407574362 1369004204 /nfs/dbraw/zinc/00/42/04/1369004204.db2.gz YBWIIPTTXFIZGX-CALCHBBNSA-N 1 3 349.906 2.570 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](Cc3ccc(Cl)cc3)C[C@@H]2C1 ZINC001407574362 1369004209 /nfs/dbraw/zinc/00/42/09/1369004209.db2.gz YBWIIPTTXFIZGX-CALCHBBNSA-N 1 3 349.906 2.570 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](C[C@@H]1CC[C@H]3C[C@H]3C1)CC2 ZINC001407721031 1369160259 /nfs/dbraw/zinc/16/02/59/1369160259.db2.gz RWECKUHZTZEMBE-CEXWTWQISA-N 1 3 347.547 2.689 10 0 EFAEHO Cc1ccccc1CCC[N@H+]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001437737947 1387988323 /nfs/dbraw/zinc/98/83/23/1387988323.db2.gz KEXOQOUIYAJHAQ-LJQANCHMSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccccc1CCC[N@@H+]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001437737947 1387988326 /nfs/dbraw/zinc/98/83/26/1387988326.db2.gz KEXOQOUIYAJHAQ-LJQANCHMSA-N 1 3 345.531 2.706 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001407789341 1369234640 /nfs/dbraw/zinc/23/46/40/1369234640.db2.gz ZUXUMMNLWARQTH-IAGOWNOFSA-N 1 3 347.528 2.894 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001407789341 1369234644 /nfs/dbraw/zinc/23/46/44/1369234644.db2.gz ZUXUMMNLWARQTH-IAGOWNOFSA-N 1 3 347.528 2.894 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@H](NC(=O)CCC[NH+]2CCCC2)CC1 ZINC001407883270 1369346098 /nfs/dbraw/zinc/34/60/98/1369346098.db2.gz IDPDEKSFNFGHHR-SJORKVTESA-N 1 3 327.488 2.581 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](Cc2ccc(CF)cc2)CC1)N(C)C ZINC001407888043 1369353412 /nfs/dbraw/zinc/35/34/12/1369353412.db2.gz JBUXCHXAVPCPJN-RBUKOAKNSA-N 1 3 349.494 2.967 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](Cc2ccc(CF)cc2)CC1)N(C)C ZINC001407888043 1369353416 /nfs/dbraw/zinc/35/34/16/1369353416.db2.gz JBUXCHXAVPCPJN-RBUKOAKNSA-N 1 3 349.494 2.967 10 0 EFAEHO Cc1ccc(C[N@H+]2CCC[C@@H](NC(=O)CN(C)C(C)C)CC2)cc1F ZINC001407893965 1369360097 /nfs/dbraw/zinc/36/00/97/1369360097.db2.gz XBLNUGDFFBWHRR-GOSISDBHSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(C[N@@H+]2CCC[C@@H](NC(=O)CN(C)C(C)C)CC2)cc1F ZINC001407893965 1369360101 /nfs/dbraw/zinc/36/01/01/1369360101.db2.gz XBLNUGDFFBWHRR-GOSISDBHSA-N 1 3 349.494 2.945 10 0 EFAEHO CN(CCC[N@H+](C)Cc1cc2ccccc2o1)C(=O)CN1CCCC1 ZINC001407945369 1369442212 /nfs/dbraw/zinc/44/22/12/1369442212.db2.gz COLVUTCXRZTILG-UHFFFAOYSA-N 1 3 343.471 2.809 10 0 EFAEHO CN(CCC[N@@H+](C)Cc1cc2ccccc2o1)C(=O)CN1CCCC1 ZINC001407945369 1369442216 /nfs/dbraw/zinc/44/22/16/1369442216.db2.gz COLVUTCXRZTILG-UHFFFAOYSA-N 1 3 343.471 2.809 10 0 EFAEHO CN(CCC[N@H+](C)C/C=C/c1ccccc1)C(=O)CN1CCCC1 ZINC001407947967 1369445780 /nfs/dbraw/zinc/44/57/80/1369445780.db2.gz LLHPVQYIOBEPNG-XYOKQWHBSA-N 1 3 329.488 2.576 10 0 EFAEHO CN(CCC[N@@H+](C)C/C=C/c1ccccc1)C(=O)CN1CCCC1 ZINC001407947967 1369445788 /nfs/dbraw/zinc/44/57/88/1369445788.db2.gz LLHPVQYIOBEPNG-XYOKQWHBSA-N 1 3 329.488 2.576 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001407948148 1369446832 /nfs/dbraw/zinc/44/68/32/1369446832.db2.gz NEPDEIBSXIUVLU-UHFFFAOYSA-N 1 3 335.467 2.510 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001407948148 1369446837 /nfs/dbraw/zinc/44/68/37/1369446837.db2.gz NEPDEIBSXIUVLU-UHFFFAOYSA-N 1 3 335.467 2.510 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(CC)([NH2+]C/C=C\Cl)CC1 ZINC001408003501 1369516354 /nfs/dbraw/zinc/51/63/54/1369516354.db2.gz PSQBYPLLZWOQEB-MRDWYFFCSA-N 1 3 341.927 2.974 10 0 EFAEHO CCCN1Cc2ccc(CNC(=O)C(C)(C)[NH+]3CCCC3)cc2C1 ZINC001408061580 1369574502 /nfs/dbraw/zinc/57/45/02/1369574502.db2.gz VJKSEESVJHHTLM-UHFFFAOYSA-N 1 3 329.488 2.903 10 0 EFAEHO C[C@@H]1CC[N@H+](CC(=O)N2CCC(C)(NC/C(Cl)=C/Cl)CC2)C1 ZINC001408116328 1369621534 /nfs/dbraw/zinc/62/15/34/1369621534.db2.gz KZTPDTJJWJBFTJ-CKXDQPNJSA-N 1 3 348.318 2.618 10 0 EFAEHO C[C@@H]1CC[N@@H+](CC(=O)N2CCC(C)(NC/C(Cl)=C/Cl)CC2)C1 ZINC001408116328 1369621540 /nfs/dbraw/zinc/62/15/40/1369621540.db2.gz KZTPDTJJWJBFTJ-CKXDQPNJSA-N 1 3 348.318 2.618 10 0 EFAEHO CCCCN1CCc2ccccc2[C@@H]1CNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001408251078 1369751671 /nfs/dbraw/zinc/75/16/71/1369751671.db2.gz HSESMXZUOHTRQX-XLIONFOSSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCCN1CCc2ccccc2[C@@H]1CNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001408251078 1369751681 /nfs/dbraw/zinc/75/16/81/1369751681.db2.gz HSESMXZUOHTRQX-XLIONFOSSA-N 1 3 343.515 2.844 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](CC1CCC2(CC2)CC1)C1CC1 ZINC001437810602 1388106053 /nfs/dbraw/zinc/10/60/53/1388106053.db2.gz BLFYKHRPFQZVMA-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](CC1CCC2(CC2)CC1)C1CC1 ZINC001437810602 1388106057 /nfs/dbraw/zinc/10/60/57/1388106057.db2.gz BLFYKHRPFQZVMA-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(CC(=O)N(C)CC[NH2+][C@@H]1CCc2ccccc21)CC(C)(C)C ZINC001437846532 1388138361 /nfs/dbraw/zinc/13/83/61/1388138361.db2.gz XDVULBLIJKZOHF-GOSISDBHSA-N 1 3 331.504 2.700 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N3CCN(CC4CCCCC4)CC3)C[N@@H+]2C1 ZINC001417621427 1373100850 /nfs/dbraw/zinc/10/08/50/1373100850.db2.gz KLXBZHLINMXBMT-MISYRCLQSA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N3CCN(CC4CCCCC4)CC3)C[N@H+]2C1 ZINC001417621427 1373100851 /nfs/dbraw/zinc/10/08/51/1373100851.db2.gz KLXBZHLINMXBMT-MISYRCLQSA-N 1 3 347.547 2.831 10 0 EFAEHO CN(CC[N@H+](C)C1CCCCC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001417633020 1373109931 /nfs/dbraw/zinc/10/99/31/1373109931.db2.gz VPLOLQLYFDKCFH-LJQANCHMSA-N 1 3 341.515 2.922 10 0 EFAEHO CN(CC[N@@H+](C)C1CCCCC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001417633020 1373109935 /nfs/dbraw/zinc/10/99/35/1373109935.db2.gz VPLOLQLYFDKCFH-LJQANCHMSA-N 1 3 341.515 2.922 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2CC[N@H+](CC3CC(C)(C)C3)C2)C1 ZINC001437935790 1388247314 /nfs/dbraw/zinc/24/73/14/1388247314.db2.gz CTYLBXOFLVODTC-SJORKVTESA-N 1 3 335.536 2.593 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2CC[N@@H+](CC3CC(C)(C)C3)C2)C1 ZINC001437935790 1388247322 /nfs/dbraw/zinc/24/73/22/1388247322.db2.gz CTYLBXOFLVODTC-SJORKVTESA-N 1 3 335.536 2.593 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2cccc(F)c2)C1 ZINC001417777853 1373243079 /nfs/dbraw/zinc/24/30/79/1373243079.db2.gz MVTSXDUDQKBEFK-CTTJMJGYSA-N 1 3 347.478 2.683 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CC(C)(C)C2)C1 ZINC001417777844 1373243445 /nfs/dbraw/zinc/24/34/45/1373243445.db2.gz MPELTXOXXJICMX-KONPQCLYSA-N 1 3 335.536 2.780 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CCc2cccs2)C1 ZINC001417777861 1373243626 /nfs/dbraw/zinc/24/36/26/1373243626.db2.gz MXNRRZSEUWNADB-WNKDZCFJSA-N 1 3 349.544 2.648 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2C[C@H](CNC(=O)CN3[C@H](C)CC[C@H]3C)C2)c1 ZINC001417797634 1373264516 /nfs/dbraw/zinc/26/45/16/1373264516.db2.gz FRKSDBPMNDUTQL-HNBVOPMISA-N 1 3 343.515 2.852 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+]CC[C@H]2CCCC2(F)F)C1)N(C)C ZINC001417797771 1373265004 /nfs/dbraw/zinc/26/50/04/1373265004.db2.gz JCYJLBKRMIUYTG-FPCVCCKLSA-N 1 3 345.478 2.637 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@H](CCNC(=O)CN3CC[C@H](C)C3)C2)cs1 ZINC001437941088 1388253264 /nfs/dbraw/zinc/25/32/64/1388253264.db2.gz OHFRCMBRKRAXRU-RDJZCZTQSA-N 1 3 349.544 2.727 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2csc(C)c2)C1 ZINC001417815497 1373287045 /nfs/dbraw/zinc/28/70/45/1373287045.db2.gz UANQDGBUBWVTRM-DOTOQJQBSA-N 1 3 337.533 2.773 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@H](CCNC(=O)CN3CC[C@H](C)C3)C2)cs1 ZINC001437941088 1388253265 /nfs/dbraw/zinc/25/32/65/1388253265.db2.gz OHFRCMBRKRAXRU-RDJZCZTQSA-N 1 3 349.544 2.727 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CC1CCCC1 ZINC001417823810 1373298919 /nfs/dbraw/zinc/29/89/19/1373298919.db2.gz STWCUYVYDPYUEC-YRPNKDGESA-N 1 3 347.547 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CC1CCCC1 ZINC001417823810 1373298920 /nfs/dbraw/zinc/29/89/20/1373298920.db2.gz STWCUYVYDPYUEC-YRPNKDGESA-N 1 3 347.547 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCCC[C@H]([NH2+]Cc2ccccc2)C1 ZINC001417838156 1373318358 /nfs/dbraw/zinc/31/83/58/1373318358.db2.gz OMENPOZZJNPBKQ-IBGZPJMESA-N 1 3 331.504 2.888 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@@H](NC(=O)[C@H](C(C)C)N(C)C)CC(C)(C)C1 ZINC001417863447 1373357537 /nfs/dbraw/zinc/35/75/37/1373357537.db2.gz JMTCDQNGTMFUPB-SJORKVTESA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)C[N@H+]1CC[C@@H](NC(=O)[C@H](C(C)C)N(C)C)CC(C)(C)C1 ZINC001417863447 1373357545 /nfs/dbraw/zinc/35/75/45/1373357545.db2.gz JMTCDQNGTMFUPB-SJORKVTESA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@@H](CCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001437944965 1388259185 /nfs/dbraw/zinc/25/91/85/1388259185.db2.gz WLGLOWOXQRAZKB-VQIMIIECSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)C[N@H+]1CC[C@@H](CCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001437944965 1388259191 /nfs/dbraw/zinc/25/91/91/1388259191.db2.gz WLGLOWOXQRAZKB-VQIMIIECSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1c(C)cccc1C)C1CC1)N(C)C ZINC001417982609 1373483476 /nfs/dbraw/zinc/48/34/76/1373483476.db2.gz JPFHVOIWRMLQNT-RTBURBONSA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]([NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001417984915 1373487017 /nfs/dbraw/zinc/48/70/17/1373487017.db2.gz JKWSXOOWWLUBOS-MSOLQXFVSA-N 1 3 335.536 2.637 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1ccc(C)cc1)C1CC1 ZINC001417991292 1373495474 /nfs/dbraw/zinc/49/54/74/1373495474.db2.gz OANFUVYDOHSLMH-UXHICEINSA-N 1 3 343.515 2.854 10 0 EFAEHO CN(CC(=O)NC[C@@H]([NH2+]Cc1ccsc1)C1CC1)CC(C)(C)C ZINC001417994397 1373498557 /nfs/dbraw/zinc/49/85/57/1373498557.db2.gz DMVUNAXGECETGN-MRXNPFEDSA-N 1 3 337.533 2.710 10 0 EFAEHO CN(C/C=C/Cl)C[C@@H]1CCCN(C(=O)C(C)(C)[NH+]2CCCC2)C1 ZINC001418035648 1373551025 /nfs/dbraw/zinc/55/10/25/1373551025.db2.gz WYCUVINACDRZFD-DYLHUKMJSA-N 1 3 341.927 2.784 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H]([NH2+]CC[C@H]2CCCC2(F)F)C1)N(C)C ZINC001418075988 1373580496 /nfs/dbraw/zinc/58/04/96/1373580496.db2.gz RUPFRDZJFYOOHF-FPCVCCKLSA-N 1 3 345.478 2.635 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)CC[NH+]3CCCCC3)C2)c1 ZINC001418077219 1373582341 /nfs/dbraw/zinc/58/23/41/1373582341.db2.gz UPCCWHYCTCUJAG-IYARVYRRSA-N 1 3 347.478 2.747 10 0 EFAEHO CC(C)N(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC(C)(C)C1 ZINC001418082582 1373589620 /nfs/dbraw/zinc/58/96/20/1373589620.db2.gz HJXZHXJRHJHBKD-AYHJJNSGSA-N 1 3 335.536 2.874 10 0 EFAEHO CC(C)N(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC(C)(C)C1 ZINC001418082582 1373589624 /nfs/dbraw/zinc/58/96/24/1373589624.db2.gz HJXZHXJRHJHBKD-AYHJJNSGSA-N 1 3 335.536 2.874 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@H]2CN(C/C=C\Cl)CC[C@H]21 ZINC001418082941 1373590331 /nfs/dbraw/zinc/59/03/31/1373590331.db2.gz PYWJAEOWTWMVOZ-VANPALJFSA-N 1 3 341.927 2.784 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@H]2CN(C/C=C\Cl)CC[C@H]21 ZINC001418082941 1373590334 /nfs/dbraw/zinc/59/03/34/1373590334.db2.gz PYWJAEOWTWMVOZ-VANPALJFSA-N 1 3 341.927 2.784 10 0 EFAEHO CC(C)(C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[NH+]1CCCCC1 ZINC001418093428 1373597666 /nfs/dbraw/zinc/59/76/66/1373597666.db2.gz WAFYBQVYACRJLT-BETUJISGSA-N 1 3 348.318 2.807 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCCc3ccccc32)C1)C1CCC1 ZINC001418095360 1373599507 /nfs/dbraw/zinc/59/95/07/1373599507.db2.gz SYFDNROVCRBDAJ-QKLQHJQFSA-N 1 3 341.499 2.785 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccccc32)C1)C1CCC1 ZINC001418095359 1373599639 /nfs/dbraw/zinc/59/96/39/1373599639.db2.gz SYFDNROVCRBDAJ-FUHIMQAGSA-N 1 3 341.499 2.785 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C(C)C)nc2C)C1 ZINC001418109656 1373613651 /nfs/dbraw/zinc/61/36/51/1373613651.db2.gz VCYQJWBTQJCZKQ-HDICACEKSA-N 1 3 346.519 2.592 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001418111050 1373614605 /nfs/dbraw/zinc/61/46/05/1373614605.db2.gz SDONVDIWHIWHIM-OTWHNJEPSA-N 1 3 329.488 2.641 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccccc2C2CC2)C1 ZINC001418112734 1373616380 /nfs/dbraw/zinc/61/63/80/1373616380.db2.gz HYJHWYFNYZTDKS-HDICACEKSA-N 1 3 329.488 2.641 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CCC[N@H+](CCCC(C)(C)C)C2)C1 ZINC001418128325 1373649015 /nfs/dbraw/zinc/64/90/15/1373649015.db2.gz KCCSNLNWMNFKJX-ZWKOTPCHSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CCC[N@@H+](CCCC(C)(C)C)C2)C1 ZINC001418128325 1373649023 /nfs/dbraw/zinc/64/90/23/1373649023.db2.gz KCCSNLNWMNFKJX-ZWKOTPCHSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CCC[N@H+](CCCC(C)(C)C)C2)C1 ZINC001418128323 1373649246 /nfs/dbraw/zinc/64/92/46/1373649246.db2.gz KCCSNLNWMNFKJX-QZTJIDSGSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CCC[N@@H+](CCCC(C)(C)C)C2)C1 ZINC001418128323 1373649251 /nfs/dbraw/zinc/64/92/51/1373649251.db2.gz KCCSNLNWMNFKJX-QZTJIDSGSA-N 1 3 337.552 2.983 10 0 EFAEHO CCc1ccc(CC[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)cc1 ZINC001418133076 1373657226 /nfs/dbraw/zinc/65/72/26/1373657226.db2.gz UHKRJSSTRWOJER-KDURUIRLSA-N 1 3 343.515 2.513 10 0 EFAEHO Cc1cc(CN2CCCC[C@@H]2CNC(=O)CC[NH+](C)C)c(C)s1 ZINC001418157686 1373698470 /nfs/dbraw/zinc/69/84/70/1373698470.db2.gz ZKCKLACJYXWCOS-QGZVFWFLSA-N 1 3 337.533 2.787 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001418169783 1373720413 /nfs/dbraw/zinc/72/04/13/1373720413.db2.gz UFFAIFIRIBYIPI-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H]2CCCCN2C(=O)CN(C)C(C)C)c1 ZINC001418173554 1373726914 /nfs/dbraw/zinc/72/69/14/1373726914.db2.gz YVCATANUCBWPLD-IBGZPJMESA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC1CCC([NH2+]CCC(F)(F)F)CC1 ZINC001418186395 1373750645 /nfs/dbraw/zinc/75/06/45/1373750645.db2.gz FTEHLUFNOOFYKS-NRXISQOPSA-N 1 3 349.441 2.830 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)NCc1cccc(C(C)C)n1 ZINC001418228154 1373783322 /nfs/dbraw/zinc/78/33/22/1373783322.db2.gz FLYYZDUOIUDEJA-APWZRJJASA-N 1 3 346.519 2.674 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)NCc1cccc(C(C)C)n1 ZINC001418228154 1373783325 /nfs/dbraw/zinc/78/33/25/1373783325.db2.gz FLYYZDUOIUDEJA-APWZRJJASA-N 1 3 346.519 2.674 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1)NCc1ccsc1 ZINC001418227953 1373783645 /nfs/dbraw/zinc/78/36/45/1373783645.db2.gz PZWUYDYKAAKWJK-NVXWUHKLSA-N 1 3 349.544 2.997 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1)NCc1ccsc1 ZINC001418227953 1373783653 /nfs/dbraw/zinc/78/36/53/1373783653.db2.gz PZWUYDYKAAKWJK-NVXWUHKLSA-N 1 3 349.544 2.997 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1cc(C)ccc1C ZINC001418227972 1373784034 /nfs/dbraw/zinc/78/40/34/1373784034.db2.gz DKLGXHVMWUPDQS-HKUYNNGSSA-N 1 3 331.504 2.772 10 0 EFAEHO C[C@@H](CNC(=O)C12CCC[NH+](CCC1)C2)N[C@@H](C)c1ccccc1F ZINC001418235811 1373791335 /nfs/dbraw/zinc/79/13/35/1373791335.db2.gz LYQKQOQTFVVXMH-HOTGVXAUSA-N 1 3 347.478 2.857 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCC[C@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001418357148 1373929337 /nfs/dbraw/zinc/92/93/37/1373929337.db2.gz KINMICCUPSMKES-OALUTQOASA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCC[C@@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001418357162 1373929601 /nfs/dbraw/zinc/92/96/01/1373929601.db2.gz KINMICCUPSMKES-RTBURBONSA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@H](C)C[N@H+](C)[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001418381096 1373963171 /nfs/dbraw/zinc/96/31/71/1373963171.db2.gz VGEVUQGBVMAWFW-IRXDYDNUSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001418381096 1373963174 /nfs/dbraw/zinc/96/31/74/1373963174.db2.gz VGEVUQGBVMAWFW-IRXDYDNUSA-N 1 3 325.541 2.933 10 0 EFAEHO Cc1ncccc1C[NH2+][C@H](C)CCNC(=O)[C@H]1CCCCN1C(C)C ZINC001418415948 1373999346 /nfs/dbraw/zinc/99/93/46/1373999346.db2.gz ANQJYTIQQKIPDO-VQIMIIECSA-N 1 3 346.519 2.637 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1cccc(F)c1 ZINC001418440540 1374029630 /nfs/dbraw/zinc/02/96/30/1374029630.db2.gz HGAABOYBSCVAEG-QAPCUYQASA-N 1 3 335.467 2.685 10 0 EFAEHO C[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CCC(C)(C)C ZINC001418493612 1374089007 /nfs/dbraw/zinc/08/90/07/1374089007.db2.gz HEEBSVBJHKNNLD-GOSISDBHSA-N 1 3 329.504 2.683 10 0 EFAEHO C[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CCC(C)(C)C ZINC001418493612 1374089010 /nfs/dbraw/zinc/08/90/10/1374089010.db2.gz HEEBSVBJHKNNLD-GOSISDBHSA-N 1 3 329.504 2.683 10 0 EFAEHO C[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC1CCCCC1 ZINC001418493299 1374089153 /nfs/dbraw/zinc/08/91/53/1374089153.db2.gz HBHNQLMBSRRMQI-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO C[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC1CCCCC1 ZINC001418493299 1374089156 /nfs/dbraw/zinc/08/91/56/1374089156.db2.gz HBHNQLMBSRRMQI-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@@H+]1CC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001418697217 1374382112 /nfs/dbraw/zinc/38/21/12/1374382112.db2.gz IIJMXXHSKAQVHP-MSOLQXFVSA-N 1 3 331.504 2.834 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@H+]1CC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001418697217 1374382116 /nfs/dbraw/zinc/38/21/16/1374382116.db2.gz IIJMXXHSKAQVHP-MSOLQXFVSA-N 1 3 331.504 2.834 10 0 EFAEHO CCc1ccccc1CC[N@@H+]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001418701236 1374386883 /nfs/dbraw/zinc/38/68/83/1374386883.db2.gz VVLNFDHORNWUGV-GOSISDBHSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[N@H+]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001418701236 1374386885 /nfs/dbraw/zinc/38/68/85/1374386885.db2.gz VVLNFDHORNWUGV-GOSISDBHSA-N 1 3 345.531 2.570 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CC[C@@H]([NH2+]CCC3CCCC3)C2)CCC1 ZINC001418714610 1374406292 /nfs/dbraw/zinc/40/62/92/1374406292.db2.gz FZQNCIZENMKSOJ-ZWKOTPCHSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]CCC3CCCC3)C2)C1 ZINC001418733461 1374435250 /nfs/dbraw/zinc/43/52/50/1374435250.db2.gz ORYIFXKSLIERSA-NZSAHSFTSA-N 1 3 335.536 2.783 10 0 EFAEHO C[C@H](NCCN(C)C(=O)[C@H]1C[NH+]2CCC1CC2)c1ccccc1Cl ZINC001418809220 1374529605 /nfs/dbraw/zinc/52/96/05/1374529605.db2.gz CYJRWZBYTPKPKE-YOEHRIQHSA-N 1 3 349.906 2.791 10 0 EFAEHO CCCC[N@@H+]1CC[C@@H](NC(=O)[C@H](C(C)C)N(C)C)CC(C)(C)C1 ZINC001418826973 1374548205 /nfs/dbraw/zinc/54/82/05/1374548205.db2.gz PLQSHXNLAYOLLT-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CCCC[N@H+]1CC[C@@H](NC(=O)[C@H](C(C)C)N(C)C)CC(C)(C)C1 ZINC001418826973 1374548208 /nfs/dbraw/zinc/54/82/08/1374548208.db2.gz PLQSHXNLAYOLLT-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@H](NC(=O)CN(C)C(C)C)CC(C)(C)C1 ZINC001418836281 1374559453 /nfs/dbraw/zinc/55/94/53/1374559453.db2.gz LUHMXWCPJMGNNY-KRWDZBQOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@H](NC(=O)CN(C)C(C)C)CC(C)(C)C1 ZINC001418836281 1374559458 /nfs/dbraw/zinc/55/94/58/1374559458.db2.gz LUHMXWCPJMGNNY-KRWDZBQOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H](C)[NH2+]Cc2ccc(F)cc2)CC1 ZINC001418841231 1374563701 /nfs/dbraw/zinc/56/37/01/1374563701.db2.gz DTTSTVGEVBNDHW-MRXNPFEDSA-N 1 3 349.494 2.883 10 0 EFAEHO CCC(CC)C[NH2+][C@@H](C)C1CCN(C(=O)[C@@H](CC)N(C)C)CC1 ZINC001418850023 1374573896 /nfs/dbraw/zinc/57/38/96/1374573896.db2.gz YDVRQXKLQYYPPB-MAUKXSAKSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC[NH+]([C@H]2CCc3ccccc32)CC1)N(C)C ZINC001419081846 1374821392 /nfs/dbraw/zinc/82/13/92/1374821392.db2.gz GJNKHFROKMCEHG-PMACEKPBSA-N 1 3 343.515 2.937 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)[C@H]1CCN([C@H](C)c2cccc(OC)c2)C1 ZINC001419138736 1374886931 /nfs/dbraw/zinc/88/69/31/1374886931.db2.gz KQCKISUNAGEQIA-AEFFLSMTSA-N 1 3 347.503 2.631 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)[C@H]1CCN([C@H](C)c2cccc(OC)c2)C1 ZINC001419138736 1374886933 /nfs/dbraw/zinc/88/69/33/1374886933.db2.gz KQCKISUNAGEQIA-AEFFLSMTSA-N 1 3 347.503 2.631 10 0 EFAEHO C[C@@H](F)CC[NH+]1CCC2(C[C@H]2NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001419201900 1374947411 /nfs/dbraw/zinc/94/74/11/1374947411.db2.gz AHXXDUJTCPZULN-HZPDHXFCSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC12CC[NH+](CC1CC(C)(C)C1)CC2)N(C)C ZINC001419213083 1374959234 /nfs/dbraw/zinc/95/92/34/1374959234.db2.gz XWKDFLLYTDGATG-MSOLQXFVSA-N 1 3 349.563 2.980 10 0 EFAEHO CC[C@H](CNC(=O)CC[NH+](C)C)N[C@H](C)c1ccccc1Cl ZINC001419222169 1374969010 /nfs/dbraw/zinc/96/90/10/1374969010.db2.gz OEZQQKFSPBIQHJ-ZIAGYGMSSA-N 1 3 325.884 2.837 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]CCC(F)(F)F ZINC001419237559 1374983771 /nfs/dbraw/zinc/98/37/71/1374983771.db2.gz QXIKGQQMLADUGU-KBPBESRZSA-N 1 3 337.430 2.688 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1cccc(F)c1)C1CC1 ZINC001419250445 1374997389 /nfs/dbraw/zinc/99/73/89/1374997389.db2.gz KZCCEJQEDSJFQP-RBUKOAKNSA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)(C(=O)NC[C@H]([NH2+]CC1CC(C)(C)C1)C1CC1)N1CCCC1 ZINC001419266788 1375014102 /nfs/dbraw/zinc/01/41/02/1375014102.db2.gz BCUWVCBAZJHNRS-KRWDZBQOSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)(C(=O)NC[C@H]([NH2+]Cc1cccc(F)c1)C1CC1)N1CCCC1 ZINC001419279410 1375027048 /nfs/dbraw/zinc/02/70/48/1375027048.db2.gz PATVLVLGYZKSLU-SFHVURJKSA-N 1 3 347.478 2.685 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](CNC(=O)CN1CC[C@H](C)C1)C1CC1 ZINC001419301606 1375063021 /nfs/dbraw/zinc/06/30/21/1375063021.db2.gz WPYBJJIJOCCOGO-YWZLYKJASA-N 1 3 343.515 2.630 10 0 EFAEHO CC[C@@H](C(=O)NC1(C[NH2+]Cc2cc(C)ccc2F)CCCC1)N(C)C ZINC001419305962 1375070980 /nfs/dbraw/zinc/07/09/80/1375070980.db2.gz MLJPLPXRFJHMCD-SFHVURJKSA-N 1 3 349.494 2.993 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+][C@@H](C)c1cccc(F)c1)C1CC1 ZINC001419328981 1375109740 /nfs/dbraw/zinc/10/97/40/1375109740.db2.gz UMYASDWGOMVTLZ-KSSFIOAISA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+]Cc1ccccc1Cl)C1CC1 ZINC001419331676 1375115293 /nfs/dbraw/zinc/11/52/93/1375115293.db2.gz XXYFYHQXZYQVBP-QGZVFWFLSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)CC[N@H+](C)C[C@@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001419336518 1375123600 /nfs/dbraw/zinc/12/36/00/1375123600.db2.gz DFKKKAQOACDSEF-ZWKOTPCHSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)CC[N@@H+](C)C[C@@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001419336518 1375123604 /nfs/dbraw/zinc/12/36/04/1375123604.db2.gz DFKKKAQOACDSEF-ZWKOTPCHSA-N 1 3 325.541 2.789 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[N@H+](C)Cc2ccsc2)C1 ZINC001419352159 1375150450 /nfs/dbraw/zinc/15/04/50/1375150450.db2.gz WOEBCMRXWJAHOB-MRXNPFEDSA-N 1 3 337.533 2.760 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[N@@H+](C)Cc2ccsc2)C1 ZINC001419352159 1375150452 /nfs/dbraw/zinc/15/04/52/1375150452.db2.gz WOEBCMRXWJAHOB-MRXNPFEDSA-N 1 3 337.533 2.760 10 0 EFAEHO CC[C@H](F)CN[C@H]1CCN(C(=O)CC[N@H+](C)C2CCCCC2)C1 ZINC001419367135 1375175569 /nfs/dbraw/zinc/17/55/69/1375175569.db2.gz MXYJESVCIQQHQN-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H](F)CN[C@H]1CCN(C(=O)CC[N@@H+](C)C2CCCCC2)C1 ZINC001419367135 1375175574 /nfs/dbraw/zinc/17/55/74/1375175574.db2.gz MXYJESVCIQQHQN-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)[NH2+]CC[C@H]1CCCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001419374036 1375186395 /nfs/dbraw/zinc/18/63/95/1375186395.db2.gz MCLMISYLFPRVTA-APWZRJJASA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC2CC[NH+](Cc3ccsc3)CC2)C1 ZINC001419398525 1375222422 /nfs/dbraw/zinc/22/24/22/1375222422.db2.gz JGUOACZNHLZQTB-INIZCTEOSA-N 1 3 349.544 2.808 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC1CC[NH+](CCc2ccccc2)CC1 ZINC001419418437 1375248434 /nfs/dbraw/zinc/24/84/34/1375248434.db2.gz YFCMYTFSYDUABP-UHFFFAOYSA-N 1 3 345.531 2.788 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001419424415 1375255056 /nfs/dbraw/zinc/25/50/56/1375255056.db2.gz UIQSDQZVIXGJEL-QZTJIDSGSA-N 1 3 331.504 2.977 10 0 EFAEHO Cc1ccccc1[C@H](C)N1CC(CNC(=O)CC[C@H]2CCC[N@@H+]2C)C1 ZINC001438128450 1388368208 /nfs/dbraw/zinc/36/82/08/1388368208.db2.gz LWYFSDYUZXHYTG-PKOBYXMFSA-N 1 3 343.515 2.978 10 0 EFAEHO Cc1ccccc1[C@H](C)N1CC(CNC(=O)CC[C@H]2CCC[N@H+]2C)C1 ZINC001438128450 1388368216 /nfs/dbraw/zinc/36/82/16/1388368216.db2.gz LWYFSDYUZXHYTG-PKOBYXMFSA-N 1 3 343.515 2.978 10 0 EFAEHO CC[C@@H]([NH2+][C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)C1)c1ccc(F)cc1 ZINC001419477615 1375321902 /nfs/dbraw/zinc/32/19/02/1375321902.db2.gz ZRZCLLYWFMYFJZ-ZIFCJYIRSA-N 1 3 347.478 2.998 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001419536316 1375408786 /nfs/dbraw/zinc/40/87/86/1375408786.db2.gz LIJDJJBWTUFNFS-CYBMUJFWSA-N 1 3 343.874 2.661 10 0 EFAEHO C[C@H](C[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C(=O)C1(N(C)C)CCC1 ZINC001419668967 1375673791 /nfs/dbraw/zinc/67/37/91/1375673791.db2.gz YXYMRUKNUKYMAX-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001419674688 1375687484 /nfs/dbraw/zinc/68/74/84/1375687484.db2.gz RDLCKVLYTYCFAI-SJLPKXTDSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001419674688 1375687491 /nfs/dbraw/zinc/68/74/91/1375687491.db2.gz RDLCKVLYTYCFAI-SJLPKXTDSA-N 1 3 349.494 2.945 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]C/C=C\c1ccccc1 ZINC001419754683 1375818033 /nfs/dbraw/zinc/81/80/33/1375818033.db2.gz IJBOXWLWLVCQGN-YIEHMZNDSA-N 1 3 329.488 2.669 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C[C@@H](C)N(C)C(=O)CN(C)C(C)C ZINC001419756772 1375822763 /nfs/dbraw/zinc/82/27/63/1375822763.db2.gz DJBKSNFJOVYSDA-OAHLLOKOSA-N 1 3 339.911 2.925 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1cccc(F)c1 ZINC001419762018 1375829689 /nfs/dbraw/zinc/82/96/89/1375829689.db2.gz IJNZCJXYHAGZSE-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(F)cc1C ZINC001419762212 1375832239 /nfs/dbraw/zinc/83/22/39/1375832239.db2.gz IWTLJKWUQZGCGU-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001419770171 1375846358 /nfs/dbraw/zinc/84/63/58/1375846358.db2.gz IASDBHJIUCSSHC-DYVFJYSZSA-N 1 3 349.906 2.906 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001419817582 1375930869 /nfs/dbraw/zinc/93/08/69/1375930869.db2.gz IFFRHFQVZOREKZ-AZUAARDMSA-N 1 3 345.531 2.704 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@@H](NC(=O)Cc1nc[nH]c1C)C1CCCCC1 ZINC001419822358 1375939346 /nfs/dbraw/zinc/93/93/46/1375939346.db2.gz QCQNFHVAIKUMAW-KBXCAEBGSA-N 1 3 334.508 2.961 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)CC1 ZINC001419844177 1375981595 /nfs/dbraw/zinc/98/15/95/1375981595.db2.gz CMLIFUITPIOLOZ-MSOLQXFVSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)CC1 ZINC001419844177 1375981598 /nfs/dbraw/zinc/98/15/98/1375981598.db2.gz CMLIFUITPIOLOZ-MSOLQXFVSA-N 1 3 339.499 2.533 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H](C)c1ccccc1F ZINC001419940124 1376162496 /nfs/dbraw/zinc/16/24/96/1376162496.db2.gz XOVNABCKJXYHFI-MAUKXSAKSA-N 1 3 337.483 2.957 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+][C@@H]1CCc2c1cccc2Cl ZINC001419942513 1376167584 /nfs/dbraw/zinc/16/75/84/1376167584.db2.gz XLSMEBDOJBKLLO-CXAGYDPISA-N 1 3 337.895 2.762 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001420010858 1376277281 /nfs/dbraw/zinc/27/72/81/1376277281.db2.gz SVEXCHQGZASAGH-SFHVURJKSA-N 1 3 343.515 2.844 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+][C@H](C)c2ccc(F)cc2)C1 ZINC001420022953 1376303534 /nfs/dbraw/zinc/30/35/34/1376303534.db2.gz YLKFYOZUSGDZGQ-HZPDHXFCSA-N 1 3 335.467 2.665 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCN(C)C(=O)C[C@@H]2CC[N@H+](C)C2)c1 ZINC001420033178 1376331073 /nfs/dbraw/zinc/33/10/73/1376331073.db2.gz AAJAZPPWVZPSPS-SFHVURJKSA-N 1 3 331.504 2.535 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCN(C)C(=O)C[C@@H]2CC[N@@H+](C)C2)c1 ZINC001420033178 1376331080 /nfs/dbraw/zinc/33/10/80/1376331080.db2.gz AAJAZPPWVZPSPS-SFHVURJKSA-N 1 3 331.504 2.535 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001420041154 1376355295 /nfs/dbraw/zinc/35/52/95/1376355295.db2.gz AYLUREZKGDFQEH-QZTJIDSGSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001420041154 1376355299 /nfs/dbraw/zinc/35/52/99/1376355299.db2.gz AYLUREZKGDFQEH-QZTJIDSGSA-N 1 3 325.541 2.932 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)[C@H]1CCN(Cc2cc3ccccc3s2)C1 ZINC001438241372 1388438722 /nfs/dbraw/zinc/43/87/22/1388438722.db2.gz LPBKIHBTVATWTN-INIZCTEOSA-N 1 3 345.512 2.886 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)CC[C@H]1CCC[C@H](C)C1 ZINC001420055703 1376393502 /nfs/dbraw/zinc/39/35/02/1376393502.db2.gz BBPAZIJUQYGKGM-ZWKOTPCHSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)CC[C@H]1CCC[C@H](C)C1 ZINC001420055703 1376393505 /nfs/dbraw/zinc/39/35/05/1376393505.db2.gz BBPAZIJUQYGKGM-ZWKOTPCHSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)Cc2c(C)cc(C)cc2C)CC[N@@H+]1C ZINC001420223075 1376576211 /nfs/dbraw/zinc/57/62/11/1376576211.db2.gz YICYZTPKHLPPHB-AZUAARDMSA-N 1 3 345.531 2.890 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)Cc2c(C)cc(C)cc2C)CC[N@H+]1C ZINC001420223075 1376576216 /nfs/dbraw/zinc/57/62/16/1376576216.db2.gz YICYZTPKHLPPHB-AZUAARDMSA-N 1 3 345.531 2.890 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001420286232 1376669454 /nfs/dbraw/zinc/66/94/54/1376669454.db2.gz VGYQKFUHJYVASQ-MJGOQNOKSA-N 1 3 331.504 2.771 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@H]2CCC[C@@H]3CCC[N@@H+]32)cc1 ZINC001420306897 1376703510 /nfs/dbraw/zinc/70/35/10/1376703510.db2.gz BPFHJWCKGAMWRQ-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@H]2CCC[C@@H]3CCC[N@H+]32)cc1 ZINC001420306897 1376703513 /nfs/dbraw/zinc/70/35/13/1376703513.db2.gz BPFHJWCKGAMWRQ-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001420338005 1376760725 /nfs/dbraw/zinc/76/07/25/1376760725.db2.gz LHEAOPKLFAXQDV-QZTJIDSGSA-N 1 3 345.531 2.821 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001420341964 1376768385 /nfs/dbraw/zinc/76/83/85/1376768385.db2.gz YHLIQFKYQYBSLO-KBXCAEBGSA-N 1 3 331.504 2.548 10 0 EFAEHO CCN(C(=O)[C@H](C)[NH+]1CCCCCC1)[C@H]1CCN(CCCF)C1 ZINC001438265052 1388462468 /nfs/dbraw/zinc/46/24/68/1388462468.db2.gz GIBXYSBDNQYBIL-IRXDYDNUSA-N 1 3 327.488 2.533 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@@H](C(C)C)[NH+]1CCCC1 ZINC001420356854 1376794820 /nfs/dbraw/zinc/79/48/20/1376794820.db2.gz GXGSCOPECDAGIJ-LJQANCHMSA-N 1 3 331.504 2.663 10 0 EFAEHO CCc1cccc(CN(CC)CCNC(=O)[C@@H]2C[NH+]3CCC2CC3)c1 ZINC001420387057 1376860699 /nfs/dbraw/zinc/86/06/99/1376860699.db2.gz LQVNRNBMZZPXNC-HXUWFJFHSA-N 1 3 343.515 2.529 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12)Cc1cccc(C)c1 ZINC001420394889 1376874413 /nfs/dbraw/zinc/87/44/13/1376874413.db2.gz GOSOJWWVHCGZDD-VQTJNVASSA-N 1 3 343.515 2.950 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12)Cc1cccc(C)c1 ZINC001420394889 1376874418 /nfs/dbraw/zinc/87/44/18/1376874418.db2.gz GOSOJWWVHCGZDD-VQTJNVASSA-N 1 3 343.515 2.950 10 0 EFAEHO C[C@@H](NC[C@H](C)NC(=O)C12CCC[NH+](CCC1)C2)c1ccccc1F ZINC001420432027 1376959748 /nfs/dbraw/zinc/95/97/48/1376959748.db2.gz FUKNTFPXYLMVQE-JKSUJKDBSA-N 1 3 347.478 2.857 10 0 EFAEHO Cc1ccc(CN2CCC[C@H]2CNC(=O)CC[C@H]2CCC[N@H+]2C)cc1 ZINC001420466637 1377027452 /nfs/dbraw/zinc/02/74/52/1377027452.db2.gz DUSAKSQKARIQMT-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(CN2CCC[C@H]2CNC(=O)CC[C@H]2CCC[N@@H+]2C)cc1 ZINC001420466637 1377027454 /nfs/dbraw/zinc/02/74/54/1377027454.db2.gz DUSAKSQKARIQMT-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]Cc1cc2ccccc2s1)N(C)C ZINC001420506089 1377098322 /nfs/dbraw/zinc/09/83/22/1377098322.db2.gz JLPQEEUDCNANKN-XJKSGUPXSA-N 1 3 333.501 2.836 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001420557740 1377192730 /nfs/dbraw/zinc/19/27/30/1377192730.db2.gz MVNLVUATDVDUQP-DLBZAZTESA-N 1 3 347.503 2.535 10 0 EFAEHO COc1cccc([C@H](C)[N@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001420557740 1377192733 /nfs/dbraw/zinc/19/27/33/1377192733.db2.gz MVNLVUATDVDUQP-DLBZAZTESA-N 1 3 347.503 2.535 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001420557749 1377192818 /nfs/dbraw/zinc/19/28/18/1377192818.db2.gz MVNLVUATDVDUQP-IRXDYDNUSA-N 1 3 347.503 2.535 10 0 EFAEHO COc1cccc([C@H](C)[N@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001420557749 1377192822 /nfs/dbraw/zinc/19/28/22/1377192822.db2.gz MVNLVUATDVDUQP-IRXDYDNUSA-N 1 3 347.503 2.535 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+](CC2CCC(C)(C)CC2)C1 ZINC001420558413 1377195116 /nfs/dbraw/zinc/19/51/16/1377195116.db2.gz NPZAOKCTJLHLPQ-GOSISDBHSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+](CC2CCC(C)(C)CC2)C1 ZINC001420558413 1377195125 /nfs/dbraw/zinc/19/51/25/1377195125.db2.gz NPZAOKCTJLHLPQ-GOSISDBHSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001420574670 1377229762 /nfs/dbraw/zinc/22/97/62/1377229762.db2.gz FDMWCUZYWBLWBF-KBXCAEBGSA-N 1 3 349.906 2.618 10 0 EFAEHO CCc1ccc(CN(C)C[C@H](C)NC(=O)[C@@H]2C[NH+]3CCC2CC3)cc1 ZINC001420584511 1377252952 /nfs/dbraw/zinc/25/29/52/1377252952.db2.gz XLVKJZRCLNMIHZ-OXJNMPFZSA-N 1 3 343.515 2.527 10 0 EFAEHO C[C@H](CN(C)CCc1ccccc1F)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001420596355 1377281581 /nfs/dbraw/zinc/28/15/81/1377281581.db2.gz HUDGXPFIWABABL-AEFFLSMTSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@H](CN(C)CCc1ccccc1F)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001420596355 1377281584 /nfs/dbraw/zinc/28/15/84/1377281584.db2.gz HUDGXPFIWABABL-AEFFLSMTSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[N@@H+]1CC[C@H](C)C1 ZINC001420622883 1377351308 /nfs/dbraw/zinc/35/13/08/1377351308.db2.gz JZWUREXRJPOPGG-JKSUJKDBSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[N@H+]1CC[C@H](C)C1 ZINC001420622883 1377351312 /nfs/dbraw/zinc/35/13/12/1377351312.db2.gz JZWUREXRJPOPGG-JKSUJKDBSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001420656937 1377433553 /nfs/dbraw/zinc/43/35/53/1377433553.db2.gz CPRZMCKOKQZRKR-CVEARBPZSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001420656937 1377433556 /nfs/dbraw/zinc/43/35/56/1377433556.db2.gz CPRZMCKOKQZRKR-CVEARBPZSA-N 1 3 343.471 2.711 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)C12CCC[NH+](CCC1)C2 ZINC001420661806 1377446016 /nfs/dbraw/zinc/44/60/16/1377446016.db2.gz VPGCWAUGQXUOQS-UHFFFAOYSA-N 1 3 341.499 2.643 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)Cc1ccc(C)cc1 ZINC001420673023 1377478693 /nfs/dbraw/zinc/47/86/93/1377478693.db2.gz GKPPKOBBOUGJHF-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc(C)cc1 ZINC001420673023 1377478695 /nfs/dbraw/zinc/47/86/95/1377478695.db2.gz GKPPKOBBOUGJHF-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)CC1CCC(C)(C)CC1 ZINC001420688368 1377506698 /nfs/dbraw/zinc/50/66/98/1377506698.db2.gz ZMBBZUIOMONKFR-INIZCTEOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)CC1CCC(C)(C)CC1 ZINC001420688368 1377506703 /nfs/dbraw/zinc/50/67/03/1377506703.db2.gz ZMBBZUIOMONKFR-INIZCTEOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](CNCc2ccccc2F)C2CC2)CC[N@@H+]1C ZINC001420727135 1377572941 /nfs/dbraw/zinc/57/29/41/1377572941.db2.gz AKCMZQWZKNFKEE-YTQUADARSA-N 1 3 347.478 2.540 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](CNCc2ccccc2F)C2CC2)CC[N@H+]1C ZINC001420727135 1377572943 /nfs/dbraw/zinc/57/29/43/1377572943.db2.gz AKCMZQWZKNFKEE-YTQUADARSA-N 1 3 347.478 2.540 10 0 EFAEHO CC(C)CC[NH2+][C@H](CNC(=O)C1(N(C)C)CCC1)c1ccccc1 ZINC001420776545 1377648249 /nfs/dbraw/zinc/64/82/49/1377648249.db2.gz PAHLOQGNPPTUFL-GOSISDBHSA-N 1 3 331.504 2.964 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CC1CC1)c1ccccc1 ZINC001420779659 1377654108 /nfs/dbraw/zinc/65/41/08/1377654108.db2.gz WYHNJYSDANAXCK-RTBURBONSA-N 1 3 329.488 2.718 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@@H]2CCN2CC/C=C\c2ccccc2)C1 ZINC001420878922 1377823368 /nfs/dbraw/zinc/82/33/68/1377823368.db2.gz CIBAIIFOUDSJCD-NIKFVJRQSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@@H]2CCN2CC/C=C\c2ccccc2)C1 ZINC001420878922 1377823371 /nfs/dbraw/zinc/82/33/71/1377823371.db2.gz CIBAIIFOUDSJCD-NIKFVJRQSA-N 1 3 341.499 2.622 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@H]1CC[N@@H+]([C@@H]2CCc3ccccc32)C1 ZINC001420885642 1377835349 /nfs/dbraw/zinc/83/53/49/1377835349.db2.gz FCTOITWTKCOBSX-FXAWDEMLSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@H]1CC[N@H+]([C@@H]2CCc3ccccc32)C1 ZINC001420885642 1377835351 /nfs/dbraw/zinc/83/53/51/1377835351.db2.gz FCTOITWTKCOBSX-FXAWDEMLSA-N 1 3 343.515 2.844 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1)N1CCCCC1 ZINC001420941827 1377914204 /nfs/dbraw/zinc/91/42/04/1377914204.db2.gz HLZDKUMGBKXJPU-KURKYZTESA-N 1 3 347.547 2.926 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](C[N@H+](C)CCCC(C)(C)C)C2)C1 ZINC001420948735 1377925884 /nfs/dbraw/zinc/92/58/84/1377925884.db2.gz RFGAVBXXURVBQH-ZWKOTPCHSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](C[N@@H+](C)CCCC(C)(C)C)C2)C1 ZINC001420948735 1377925888 /nfs/dbraw/zinc/92/58/88/1377925888.db2.gz RFGAVBXXURVBQH-ZWKOTPCHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CCC[N@H+](C)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001420950441 1377929096 /nfs/dbraw/zinc/92/90/96/1377929096.db2.gz DNIDIWFTSSVANB-SFHVURJKSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CCC[N@@H+](C)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001420950441 1377929101 /nfs/dbraw/zinc/92/91/01/1377929101.db2.gz DNIDIWFTSSVANB-SFHVURJKSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@H](NC1(CNC(=O)C23CCC[NH+]2CCC3)CC1)c1ccc(F)cc1 ZINC001420958255 1377940050 /nfs/dbraw/zinc/94/00/50/1377940050.db2.gz BAHJMHAEQCXPDB-HNNXBMFYSA-N 1 3 345.462 2.754 10 0 EFAEHO C[N@H+](CCCC1CCCC1)C[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001420960207 1377943065 /nfs/dbraw/zinc/94/30/65/1377943065.db2.gz YSCRNTRNZMRLBC-IBGZPJMESA-N 1 3 335.536 2.833 10 0 EFAEHO C[N@@H+](CCCC1CCCC1)C[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001420960207 1377943067 /nfs/dbraw/zinc/94/30/67/1377943067.db2.gz YSCRNTRNZMRLBC-IBGZPJMESA-N 1 3 335.536 2.833 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCCN(CCF)C1CCCCCC1 ZINC001421016581 1378026111 /nfs/dbraw/zinc/02/61/11/1378026111.db2.gz PTARYRPMGCALAA-KRWDZBQOSA-N 1 3 341.515 2.971 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCCN(CCF)C1CCCCCC1 ZINC001421016581 1378026117 /nfs/dbraw/zinc/02/61/17/1378026117.db2.gz PTARYRPMGCALAA-KRWDZBQOSA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@]2(CCN(C(=O)[C@@H](C(C)C)N(C)C)C2)C1 ZINC001421040757 1378057959 /nfs/dbraw/zinc/05/79/59/1378057959.db2.gz SWBZGQUACFWJGG-UYAOXDASSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@]2(CCN(C(=O)[C@@H](C(C)C)N(C)C)C2)C1 ZINC001421040757 1378057963 /nfs/dbraw/zinc/05/79/63/1378057963.db2.gz SWBZGQUACFWJGG-UYAOXDASSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CCc2ccccc2)C[C@H]1C ZINC001421103747 1378131703 /nfs/dbraw/zinc/13/17/03/1378131703.db2.gz LGSSQMAIAUCRRU-MJGOQNOKSA-N 1 3 331.504 2.538 10 0 EFAEHO Cc1cccc([C@H](C)N2CC(CNC(=O)C(C)(C)[NH+]3CCCC3)C2)c1 ZINC001421152984 1378194522 /nfs/dbraw/zinc/19/45/22/1378194522.db2.gz QEASBOFMOHDTCD-KRWDZBQOSA-N 1 3 343.515 2.978 10 0 EFAEHO CC[C@@H](CNC(=O)C12CC[NH+](CC1)C2)N[C@@H](C)c1ccccc1Cl ZINC001438373964 1388544557 /nfs/dbraw/zinc/54/45/57/1388544557.db2.gz IJQBABZXIRSZQV-GJZGRUSLSA-N 1 3 349.906 2.981 10 0 EFAEHO C[C@H](C(=O)NC[C@@]1(C)CCC[N@H+](CC2CC2)C1)N1CCCCCC1 ZINC001421294882 1378449194 /nfs/dbraw/zinc/44/91/94/1378449194.db2.gz KATFFFJDZSGCHW-YLJYHZDGSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CC2CC2)C1)N1CCCCCC1 ZINC001421294882 1378449196 /nfs/dbraw/zinc/44/91/96/1378449196.db2.gz KATFFFJDZSGCHW-YLJYHZDGSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@H+](Cc2ccccc2C)C1 ZINC001421347144 1378524399 /nfs/dbraw/zinc/52/43/99/1378524399.db2.gz BIMAGIUAUMCSIB-PXNSSMCTSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@@H+](Cc2ccccc2C)C1 ZINC001421347144 1378524406 /nfs/dbraw/zinc/52/44/06/1378524406.db2.gz BIMAGIUAUMCSIB-PXNSSMCTSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@H+](CC2CC(C)(C)C2)C1 ZINC001421355998 1378536903 /nfs/dbraw/zinc/53/69/03/1378536903.db2.gz UPLVIIWPDKNTKS-WMZOPIPTSA-N 1 3 335.536 2.687 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001421355998 1378536909 /nfs/dbraw/zinc/53/69/09/1378536909.db2.gz UPLVIIWPDKNTKS-WMZOPIPTSA-N 1 3 335.536 2.687 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](CC)[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001421416999 1378595006 /nfs/dbraw/zinc/59/50/06/1378595006.db2.gz FQNFVOIIOPZYSK-JKSUJKDBSA-N 1 3 325.884 2.665 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1(C[NH2+]CC2CC(C)(C)C2)CCCC1 ZINC001438400517 1388562015 /nfs/dbraw/zinc/56/20/15/1388562015.db2.gz MVTIYTBBZYNWLF-UHFFFAOYSA-N 1 3 332.492 2.715 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CC1(NC(=O)CN(C)C(C)C)CCCC1 ZINC001421527817 1378755813 /nfs/dbraw/zinc/75/58/13/1378755813.db2.gz KUNDXTBIERPMSS-UHFFFAOYSA-N 1 3 349.494 2.993 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H](C)[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001421542378 1378783769 /nfs/dbraw/zinc/78/37/69/1378783769.db2.gz MILIBVYSBPPZPY-PXNSSMCTSA-N 1 3 345.531 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H]([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001421612155 1378882481 /nfs/dbraw/zinc/88/24/81/1378882481.db2.gz URDWYHLIXNBJQA-RHQZKXFESA-N 1 3 335.536 2.780 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2C[C@@H](F)CC ZINC001421632983 1378917906 /nfs/dbraw/zinc/91/79/06/1378917906.db2.gz JDEVYRXCRXIULT-GVDBMIGSSA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2C[C@@H](F)CC ZINC001421632983 1378917922 /nfs/dbraw/zinc/91/79/22/1378917922.db2.gz JDEVYRXCRXIULT-GVDBMIGSSA-N 1 3 327.488 2.532 10 0 EFAEHO Cc1ccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)CC[NH+](C)C)cc1F ZINC001421637193 1378924093 /nfs/dbraw/zinc/92/40/93/1378924093.db2.gz NMYQRMSMYWNAIT-MOPGFXCFSA-N 1 3 347.478 2.651 10 0 EFAEHO Cc1ccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)CC[NH+](C)C)cc1F ZINC001421637196 1378924385 /nfs/dbraw/zinc/92/43/85/1378924385.db2.gz NMYQRMSMYWNAIT-OALUTQOASA-N 1 3 347.478 2.651 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CC[NH+](CC1CC3(CCC3)C1)CC2 ZINC001421678489 1378984085 /nfs/dbraw/zinc/98/40/85/1378984085.db2.gz HIMXULDGQQWIQY-UHFFFAOYSA-N 1 3 347.547 2.831 10 0 EFAEHO CC(C)[C@@H](C(=O)NCc1cccc2c1CC[N@H+](CCCF)C2)N(C)C ZINC001421696224 1379002113 /nfs/dbraw/zinc/00/21/13/1379002113.db2.gz HJARVVHXOVRXKI-IBGZPJMESA-N 1 3 349.494 2.607 10 0 EFAEHO CC(C)[C@@H](C(=O)NCc1cccc2c1CC[N@@H+](CCCF)C2)N(C)C ZINC001421696224 1379002118 /nfs/dbraw/zinc/00/21/18/1379002118.db2.gz HJARVVHXOVRXKI-IBGZPJMESA-N 1 3 349.494 2.607 10 0 EFAEHO C[C@@H](CNC/C(Cl)=C/Cl)CNC(=O)C12CCC[NH+](CCC1)C2 ZINC001421726463 1379040320 /nfs/dbraw/zinc/04/03/20/1379040320.db2.gz VTTHZPJCAKFOLG-IAOKNECISA-N 1 3 348.318 2.523 10 0 EFAEHO CC[C@@H](C)C[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CCC1 ZINC001421768960 1379108178 /nfs/dbraw/zinc/10/81/78/1379108178.db2.gz YGDNIZSMZXLKPC-DNVCBOLYSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](CCc2ccc(C)cc2)CC1)N(C)C ZINC001421827278 1379190188 /nfs/dbraw/zinc/19/01/88/1379190188.db2.gz CNROMOVIBOCHLG-VQTJNVASSA-N 1 3 345.531 2.848 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](CCc2ccc(C)cc2)CC1)N(C)C ZINC001421827278 1379190191 /nfs/dbraw/zinc/19/01/91/1379190191.db2.gz CNROMOVIBOCHLG-VQTJNVASSA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@H](c1ccccc1F)N1CCC[C@@H](NC(=O)CC[NH+](C)C)CC1 ZINC001421831530 1379197447 /nfs/dbraw/zinc/19/74/47/1379197447.db2.gz WPHJKYIMGIOXFL-HZPDHXFCSA-N 1 3 335.467 2.809 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1CC[C@H]([NH2+]CC[C@@H](C)F)CC1 ZINC001438437356 1388599365 /nfs/dbraw/zinc/59/93/65/1388599365.db2.gz ALNUBIAWOYTBGO-VQHPVUNQSA-N 1 3 327.488 2.624 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1CC[C@H]([NH2+]CC[C@@H](C)F)CC1 ZINC001438437354 1388599552 /nfs/dbraw/zinc/59/95/52/1388599552.db2.gz ALNUBIAWOYTBGO-QBPKDAKJSA-N 1 3 327.488 2.624 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[N@H+](C)CC2CC3(CCC3)C2)CCC1 ZINC001421871673 1379281442 /nfs/dbraw/zinc/28/14/42/1379281442.db2.gz XJJJQXNVTILLEV-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[N@@H+](C)CC2CC3(CCC3)C2)CCC1 ZINC001421871673 1379281446 /nfs/dbraw/zinc/28/14/46/1379281446.db2.gz XJJJQXNVTILLEV-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H](F)CC[NH2+][C@H]1CC[C@H](NC(=O)C(C)(C)N2CCCC2)CC1 ZINC001438442248 1388604405 /nfs/dbraw/zinc/60/44/05/1388604405.db2.gz QQEJHTDZNAOBHC-JYJNAYRXSA-N 1 3 327.488 2.626 10 0 EFAEHO CCC1([NH2+]CCc2ccccc2)CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001421931762 1379368361 /nfs/dbraw/zinc/36/83/61/1379368361.db2.gz LSDQECXRKCAPHZ-LJQANCHMSA-N 1 3 343.515 2.684 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[C@H]([NH2+]Cc2ccc(C)nc2C)CC1 ZINC001438443016 1388605193 /nfs/dbraw/zinc/60/51/93/1388605193.db2.gz GXQPVOICBOGSKP-WGSAOQKQSA-N 1 3 346.519 2.557 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(C)c(F)c1 ZINC001421978956 1379433321 /nfs/dbraw/zinc/43/33/21/1379433321.db2.gz GDRBIYGPHLAWJF-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1ccc(C[NH2+]Cc2ccsc2)cc1 ZINC001438446478 1388609118 /nfs/dbraw/zinc/60/91/18/1388609118.db2.gz YIMMOZVECDJBIM-UHFFFAOYSA-N 1 3 345.512 2.994 10 0 EFAEHO Cc1ccc(CNC[C@H](C)N(C)C(=O)[C@H]2CC[N@H+](C)C2)c(Cl)c1 ZINC001421985326 1379439715 /nfs/dbraw/zinc/43/97/15/1379439715.db2.gz IZMDQRAOVCLGON-HOCLYGCPSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1ccc(CNC[C@H](C)N(C)C(=O)[C@H]2CC[N@@H+](C)C2)c(Cl)c1 ZINC001421985326 1379439718 /nfs/dbraw/zinc/43/97/18/1379439718.db2.gz IZMDQRAOVCLGON-HOCLYGCPSA-N 1 3 337.895 2.537 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC001421985361 1379440606 /nfs/dbraw/zinc/44/06/06/1379440606.db2.gz NULKOOGZOBOBDW-ZIAGYGMSSA-N 1 3 341.446 2.803 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(F)cc1 ZINC001421985619 1379440801 /nfs/dbraw/zinc/44/08/01/1379440801.db2.gz OKOUQUMPBWYVCF-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@H](C)N(C)C(=O)CN2CCCC2)c(C)c1 ZINC001421986280 1379442150 /nfs/dbraw/zinc/44/21/50/1379442150.db2.gz GEMHMJALVHVSKA-SFHVURJKSA-N 1 3 331.504 2.644 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1cc(F)ccc1C ZINC001421989799 1379445425 /nfs/dbraw/zinc/44/54/25/1379445425.db2.gz UNRHVNZCQPDMMP-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H]2[C@H](C)CCCN2C(=O)CC[NH+](C)C)c1 ZINC001422070273 1379571806 /nfs/dbraw/zinc/57/18/06/1379571806.db2.gz WWBBNWZCPGBEMW-VQIMIIECSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]([NH2+]CC1CC(C)(C)C1)C(C)C)N(C)C ZINC001422139246 1379672451 /nfs/dbraw/zinc/67/24/51/1379672451.db2.gz YYKJGZILUHDVBH-IAGOWNOFSA-N 1 3 325.541 2.739 10 0 EFAEHO C[C@@H](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]Cc1ccccc1 ZINC001422157962 1379698941 /nfs/dbraw/zinc/69/89/41/1379698941.db2.gz CCOIGSYVFHUAKU-OXJNMPFZSA-N 1 3 349.494 2.884 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@H+](C)CC[C@@H]2CCCC2(F)F)CCC1 ZINC001422170173 1379717758 /nfs/dbraw/zinc/71/77/58/1379717758.db2.gz QUQUBAKOEBFVGV-HNNXBMFYSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@@H+](C)CC[C@@H]2CCCC2(F)F)CCC1 ZINC001422170173 1379717766 /nfs/dbraw/zinc/71/77/66/1379717766.db2.gz QUQUBAKOEBFVGV-HNNXBMFYSA-N 1 3 345.478 2.686 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001422203544 1379766270 /nfs/dbraw/zinc/76/62/70/1379766270.db2.gz WZJAFHCULIEFJW-HKUYNNGSSA-N 1 3 331.504 2.616 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001422203544 1379766276 /nfs/dbraw/zinc/76/62/76/1379766276.db2.gz WZJAFHCULIEFJW-HKUYNNGSSA-N 1 3 331.504 2.616 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+][C@H]1CCc2c1cccc2Cl)N(C)C ZINC001422509167 1380223118 /nfs/dbraw/zinc/22/31/18/1380223118.db2.gz XOIFZYUVQXVKPJ-OAUYIBNBSA-N 1 3 337.895 2.762 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)CCc2ccccc2F)CC[N@@H+]1C ZINC001422510970 1380227500 /nfs/dbraw/zinc/22/75/00/1380227500.db2.gz YDLAWQKGIHCCFV-VDZJLULYSA-N 1 3 349.494 2.535 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)CCc2ccccc2F)CC[N@H+]1C ZINC001422510970 1380227507 /nfs/dbraw/zinc/22/75/07/1380227507.db2.gz YDLAWQKGIHCCFV-VDZJLULYSA-N 1 3 349.494 2.535 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc2cc[nH]c2c1)NC(=O)CN(C)CC(C)(C)C ZINC001422550020 1380302269 /nfs/dbraw/zinc/30/22/69/1380302269.db2.gz OHUOXUCEGJMUDL-OAHLLOKOSA-N 1 3 344.503 2.740 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[N@H+](C)Cc1ccc(Cl)cc1 ZINC001422559887 1380321915 /nfs/dbraw/zinc/32/19/15/1380321915.db2.gz JEGFYKNUJJMUBW-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001422559887 1380321917 /nfs/dbraw/zinc/32/19/17/1380321917.db2.gz JEGFYKNUJJMUBW-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO CCCc1ccc(C[N@H+](C)[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001422563209 1380330721 /nfs/dbraw/zinc/33/07/21/1380330721.db2.gz POYOLCBOFVMVTP-QZTJIDSGSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(C[N@@H+](C)[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001422563209 1380330722 /nfs/dbraw/zinc/33/07/22/1380330722.db2.gz POYOLCBOFVMVTP-QZTJIDSGSA-N 1 3 345.531 2.917 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@H](C)[N@H+](C)Cc1ccc(F)cc1C ZINC001422595965 1380395139 /nfs/dbraw/zinc/39/51/39/1380395139.db2.gz DNYZJJFKQYEWQB-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@H](C)[N@@H+](C)Cc1ccc(F)cc1C ZINC001422595965 1380395142 /nfs/dbraw/zinc/39/51/42/1380395142.db2.gz DNYZJJFKQYEWQB-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(Cl)ccc1C[N@@H+](C)[C@@H](C)CNC(=O)CN(C)C(C)C ZINC001422597434 1380398432 /nfs/dbraw/zinc/39/84/32/1380398432.db2.gz FUPYZUGNEJPEOR-HNNXBMFYSA-N 1 3 339.911 2.925 10 0 EFAEHO Cc1cc(Cl)ccc1C[N@H+](C)[C@@H](C)CNC(=O)CN(C)C(C)C ZINC001422597434 1380398436 /nfs/dbraw/zinc/39/84/36/1380398436.db2.gz FUPYZUGNEJPEOR-HNNXBMFYSA-N 1 3 339.911 2.925 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(Cl)s1 ZINC001422616497 1380440738 /nfs/dbraw/zinc/44/07/38/1380440738.db2.gz HMPXQZPGMUKRNY-OCCSQVGLSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@@H](CNCc1sccc1Cl)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001422686269 1380591707 /nfs/dbraw/zinc/59/17/07/1380591707.db2.gz LDMZZOYNSNSXJI-AVGNSLFASA-N 1 3 343.924 2.726 10 0 EFAEHO C[C@@H](CNCc1sccc1Cl)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001422686269 1380591709 /nfs/dbraw/zinc/59/17/09/1380591709.db2.gz LDMZZOYNSNSXJI-AVGNSLFASA-N 1 3 343.924 2.726 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H](C)NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)c1 ZINC001422697060 1380622456 /nfs/dbraw/zinc/62/24/56/1380622456.db2.gz OYHOPHZDCHTINA-JXFKEZNVSA-N 1 3 349.494 2.802 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)C1C[NH+](CCC2CCCC2)C1 ZINC001422735665 1380734083 /nfs/dbraw/zinc/73/40/83/1380734083.db2.gz FWVPCQQXNMXTSF-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](Cc2ccc(C)cc2C)C1)N(C)C ZINC001422754914 1380761629 /nfs/dbraw/zinc/76/16/29/1380761629.db2.gz RQLFRZPDOZCYOP-VQIMIIECSA-N 1 3 331.504 2.580 10 0 EFAEHO CC(C)CCC[NH+]1CC([C@H](C)NC(=O)CN(C)CC(C)(C)C)C1 ZINC001422756251 1380763675 /nfs/dbraw/zinc/76/36/75/1380763675.db2.gz WAMUJJUOZYGXMA-INIZCTEOSA-N 1 3 325.541 2.837 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1cc(C)sc1C ZINC001422759694 1380767986 /nfs/dbraw/zinc/76/79/86/1380767986.db2.gz IXIAHMWWZIRAQR-GUYCJALGSA-N 1 3 337.533 2.834 10 0 EFAEHO Cc1cccc([C@H](C)[NH+]2CC([C@H](C)NC(=O)CN(C)C(C)C)C2)c1 ZINC001422761312 1380769700 /nfs/dbraw/zinc/76/97/00/1380769700.db2.gz MDVJYIZPAYXBHX-IRXDYDNUSA-N 1 3 331.504 2.833 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCCC3)C[C@H]21)N1CCCCCC1 ZINC001422818268 1380853943 /nfs/dbraw/zinc/85/39/43/1380853943.db2.gz FARQMGYHEFELIC-FRYIKTPZSA-N 1 3 347.547 2.735 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCCC3)C[C@H]21)N1CCCCCC1 ZINC001422818268 1380853950 /nfs/dbraw/zinc/85/39/50/1380853950.db2.gz FARQMGYHEFELIC-FRYIKTPZSA-N 1 3 347.547 2.735 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2[C@H]3C[N@@H+](CCCC4CCCC4)C[C@H]32)C1 ZINC001422836079 1380888986 /nfs/dbraw/zinc/88/89/86/1380888986.db2.gz XWNQECADMGUDJM-AFYVEPGGSA-N 1 3 347.547 2.593 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2[C@H]3C[N@H+](CCCC4CCCC4)C[C@H]32)C1 ZINC001422836079 1380889002 /nfs/dbraw/zinc/88/90/02/1380889002.db2.gz XWNQECADMGUDJM-AFYVEPGGSA-N 1 3 347.547 2.593 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2[C@H]3C[N@@H+](CC4CCCCCC4)C[C@H]32)C1 ZINC001422836369 1380891771 /nfs/dbraw/zinc/89/17/71/1380891771.db2.gz YUUGYAROJLZLHQ-FRYIKTPZSA-N 1 3 347.547 2.593 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2[C@H]3C[N@H+](CC4CCCCCC4)C[C@H]32)C1 ZINC001422836369 1380891793 /nfs/dbraw/zinc/89/17/93/1380891793.db2.gz YUUGYAROJLZLHQ-FRYIKTPZSA-N 1 3 347.547 2.593 10 0 EFAEHO COc1ccc(CN(C)C[C@@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)cc1 ZINC001422859488 1380957477 /nfs/dbraw/zinc/95/74/77/1380957477.db2.gz IATFRJKIZKXOSJ-MRXNPFEDSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@@H](C[N@H+](C)Cc1ccccc1C1CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001422876786 1380986831 /nfs/dbraw/zinc/98/68/31/1380986831.db2.gz MNPOLEZTJHKSAO-SJORKVTESA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](C[N@@H+](C)Cc1ccccc1C1CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001422876786 1380986835 /nfs/dbraw/zinc/98/68/35/1380986835.db2.gz MNPOLEZTJHKSAO-SJORKVTESA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1ccc(CCC[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001422879715 1380991143 /nfs/dbraw/zinc/99/11/43/1380991143.db2.gz RJNOENHEIQQPNT-MOPGFXCFSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CCC[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001422879715 1380991151 /nfs/dbraw/zinc/99/11/51/1380991151.db2.gz RJNOENHEIQQPNT-MOPGFXCFSA-N 1 3 345.531 2.706 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](CC(CC)CC)C[C@H]2C1 ZINC001422881664 1380997163 /nfs/dbraw/zinc/99/71/63/1380997163.db2.gz SFKORMLYTGQPSN-GUDVDZBRSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](CC(CC)CC)C[C@H]2C1 ZINC001422881664 1380997164 /nfs/dbraw/zinc/99/71/64/1380997164.db2.gz SFKORMLYTGQPSN-GUDVDZBRSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)CCC[NH+]1CC2(C1)CCN(C(=O)[C@@H](C(C)C)N(C)C)CC2 ZINC001438608190 1388694337 /nfs/dbraw/zinc/69/43/37/1388694337.db2.gz BOJYYFHYGIDDOJ-GOSISDBHSA-N 1 3 337.552 2.933 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001422912713 1381042653 /nfs/dbraw/zinc/04/26/53/1381042653.db2.gz WLIXFMKDRVNHFT-CABCVRRESA-N 1 3 333.467 2.590 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001422912713 1381042649 /nfs/dbraw/zinc/04/26/49/1381042649.db2.gz WLIXFMKDRVNHFT-CABCVRRESA-N 1 3 333.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)CC[C@H]1CCc2ccccc21 ZINC001422915247 1381048231 /nfs/dbraw/zinc/04/82/31/1381048231.db2.gz GGDNPVYLWGNGEB-IEBWSBKVSA-N 1 3 345.531 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)CC[C@H]1CCc2ccccc21 ZINC001422915247 1381048233 /nfs/dbraw/zinc/04/82/33/1381048233.db2.gz GGDNPVYLWGNGEB-IEBWSBKVSA-N 1 3 345.531 2.883 10 0 EFAEHO CN(C/C=C\Cl)C1CCN(C(=O)[C@H]2CCC[C@@H]([NH+](C)C)C2)CC1 ZINC001422932803 1381084765 /nfs/dbraw/zinc/08/47/65/1381084765.db2.gz NBXQSNFWAWGVMH-SRFSPHLKSA-N 1 3 341.927 2.782 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([N@H+](C)[C@@H]2CCc3ccccc32)CC1 ZINC001422934555 1381087747 /nfs/dbraw/zinc/08/77/47/1381087747.db2.gz VCHDZOMJMXOEKX-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([N@@H+](C)[C@@H]2CCc3ccccc32)CC1 ZINC001422934555 1381087755 /nfs/dbraw/zinc/08/77/55/1381087755.db2.gz VCHDZOMJMXOEKX-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C2CC2)N(C)C(=O)CN(C)C(C)C)cc1 ZINC001422993676 1381174684 /nfs/dbraw/zinc/17/46/84/1381174684.db2.gz MZDDWEXGBRFMQI-LJQANCHMSA-N 1 3 331.504 2.662 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001423000789 1381186136 /nfs/dbraw/zinc/18/61/36/1381186136.db2.gz LJYJSXDJGAHQPH-RBUKOAKNSA-N 1 3 347.547 2.926 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C[NH2+]Cc1csc(C)c1)C1CC1 ZINC001423004337 1381191475 /nfs/dbraw/zinc/19/14/75/1381191475.db2.gz PHBOMURFNVUWNJ-MSOLQXFVSA-N 1 3 349.544 2.915 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN(C)C1CCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001423073963 1381304566 /nfs/dbraw/zinc/30/45/66/1381304566.db2.gz CVAIPUYFLWMABB-HNAYVOBHSA-N 1 3 329.488 2.595 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]CC[C@@H]3CCCC3(F)F)CC2)CCC1 ZINC001423225323 1381618911 /nfs/dbraw/zinc/61/89/11/1381618911.db2.gz DOMCTRPVMABTNT-AWEZNQCLSA-N 1 3 343.462 2.535 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001438680063 1388735575 /nfs/dbraw/zinc/73/55/75/1388735575.db2.gz HXSDBAYRSLPJOG-YJBOKZPZSA-N 1 3 331.504 2.582 10 0 EFAEHO CN(CC(=O)NCC1([NH2+]CC2CC3(CCC3)C2)CC1)CC(C)(C)C ZINC001423282760 1381741834 /nfs/dbraw/zinc/74/18/34/1381741834.db2.gz VGBKYWAKCIQRBU-UHFFFAOYSA-N 1 3 335.536 2.783 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CC2CC3(CCC3)C2)CC1 ZINC001423304230 1381761029 /nfs/dbraw/zinc/76/10/29/1381761029.db2.gz CSPAWXAIKWJPKE-HOTGVXAUSA-N 1 3 333.520 2.678 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NCC2(NCc3ccccc3C3CC3)CC2)C1 ZINC001423308012 1381763217 /nfs/dbraw/zinc/76/32/17/1381763217.db2.gz WIWNKTWGTRDDAH-INIZCTEOSA-N 1 3 341.499 2.644 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NCC2(NCc3ccccc3C3CC3)CC2)C1 ZINC001423308012 1381763221 /nfs/dbraw/zinc/76/32/21/1381763221.db2.gz WIWNKTWGTRDDAH-INIZCTEOSA-N 1 3 341.499 2.644 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@H+](CCC2CC2)C1 ZINC001423320029 1381779022 /nfs/dbraw/zinc/77/90/22/1381779022.db2.gz IRMBNCXBMZNHKK-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@@H+](CCC2CC2)C1 ZINC001423320029 1381779028 /nfs/dbraw/zinc/77/90/28/1381779028.db2.gz IRMBNCXBMZNHKK-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)c(C)s1 ZINC001423328749 1381790974 /nfs/dbraw/zinc/79/09/74/1381790974.db2.gz MZDOBFYUVTUVII-PBHICJAKSA-N 1 3 337.533 2.784 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H]1CCN(C(=O)CC[NH+](C)C)[C@H]1C ZINC001423330644 1381794384 /nfs/dbraw/zinc/79/43/84/1381794384.db2.gz XEFNPOJEAXRECS-WMLDXEAASA-N 1 3 337.895 2.679 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)c1 ZINC001423331964 1381795087 /nfs/dbraw/zinc/79/50/87/1381795087.db2.gz SYGVANHTKMKACO-IEBWSBKVSA-N 1 3 331.504 2.723 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H]2C)c1 ZINC001423333170 1381797738 /nfs/dbraw/zinc/79/77/38/1381797738.db2.gz WQRCSHXOCIXTJN-MAUKXSAKSA-N 1 3 335.467 2.553 10 0 EFAEHO CC[C@H](C(=O)N[C@]12CCC[C@H]1[N@H+](CCCF)CC2)N(CC)CC ZINC001423344229 1381816163 /nfs/dbraw/zinc/81/61/63/1381816163.db2.gz DTNUISUCFXYOJJ-NUJGCVRESA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H](C(=O)N[C@]12CCC[C@H]1[N@@H+](CCCF)CC2)N(CC)CC ZINC001423344229 1381816170 /nfs/dbraw/zinc/81/61/70/1381816170.db2.gz DTNUISUCFXYOJJ-NUJGCVRESA-N 1 3 327.488 2.580 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CC3CCC3)[C@H]2C1)CC(C)(C)C ZINC001423366283 1381854611 /nfs/dbraw/zinc/85/46/11/1381854611.db2.gz WHZICRZQLJGJAB-FHWLQOOXSA-N 1 3 349.563 2.981 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@]12CCC[C@H]1N(Cc1ccsc1)CC2 ZINC001423372276 1381866300 /nfs/dbraw/zinc/86/63/00/1381866300.db2.gz RYKPRNWUSXHINC-SJLPKXTDSA-N 1 3 335.517 2.703 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@]12CCC[C@H]1N(Cc1ccsc1)CC2 ZINC001423372276 1381866303 /nfs/dbraw/zinc/86/63/03/1381866303.db2.gz RYKPRNWUSXHINC-SJLPKXTDSA-N 1 3 335.517 2.703 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@@]12CCC[C@@H]1N(CCC(F)(F)F)CC2 ZINC001423374410 1381872336 /nfs/dbraw/zinc/87/23/36/1381872336.db2.gz YBJQZRKNMABVNM-GOEBONIOSA-N 1 3 349.441 2.784 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@@]12CCC[C@@H]1N(CCC(F)(F)F)CC2 ZINC001423374410 1381872344 /nfs/dbraw/zinc/87/23/44/1381872344.db2.gz YBJQZRKNMABVNM-GOEBONIOSA-N 1 3 349.441 2.784 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(CC[N@H+](CC3CCCCC3)C2)C1 ZINC001423382915 1381883887 /nfs/dbraw/zinc/88/38/87/1381883887.db2.gz VCAAUTZTDIBHIW-HXUWFJFHSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(CC[N@@H+](CC3CCCCC3)C2)C1 ZINC001423382915 1381883897 /nfs/dbraw/zinc/88/38/97/1381883897.db2.gz VCAAUTZTDIBHIW-HXUWFJFHSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1C[C@H]([NH2+]Cc2ccccc2)C(C)(C)C1 ZINC001423393777 1381899800 /nfs/dbraw/zinc/89/98/00/1381899800.db2.gz MDLDWIHQGSVIKF-MSOLQXFVSA-N 1 3 349.494 2.693 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@H](NCc2ccccc2F)C(C)(C)C1 ZINC001423402195 1381910132 /nfs/dbraw/zinc/91/01/32/1381910132.db2.gz KKVBLKVBQKCVFK-SFHVURJKSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@H](NCc2ccccc2F)C(C)(C)C1 ZINC001423402195 1381910137 /nfs/dbraw/zinc/91/01/37/1381910137.db2.gz KKVBLKVBQKCVFK-SFHVURJKSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@H](C)C[NH2+][C@@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001423407313 1381915562 /nfs/dbraw/zinc/91/55/62/1381915562.db2.gz VALSBYBHJKAEQG-JKSUJKDBSA-N 1 3 325.541 2.837 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001423408471 1381916564 /nfs/dbraw/zinc/91/65/64/1381916564.db2.gz CLXKAIMXMNVWBP-MOPGFXCFSA-N 1 3 331.504 2.710 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H]1C[NH2+]Cc1ccsc1 ZINC001423456950 1381959437 /nfs/dbraw/zinc/95/94/37/1381959437.db2.gz WGPIBMJJQSGREB-HOTGVXAUSA-N 1 3 341.496 2.509 10 0 EFAEHO C[C@@H](NC[C@@H]1CCCN1C(=O)CC[NH+](C)C)c1ccc(F)cc1F ZINC001423477074 1381972591 /nfs/dbraw/zinc/97/25/91/1381972591.db2.gz JYSJBCFAVAZEDJ-HIFRSBDPSA-N 1 3 339.430 2.558 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001423482632 1381976516 /nfs/dbraw/zinc/97/65/16/1381976516.db2.gz OQBVVPLMZXXETF-IBGZPJMESA-N 1 3 331.504 2.670 10 0 EFAEHO CC[C@@H]([NH2+]C[C@@H]1CCCN1C(=O)CN1CCCC1)c1ccccc1 ZINC001423492102 1381984189 /nfs/dbraw/zinc/98/41/89/1381984189.db2.gz RLBGWWGGEFGTLZ-RBUKOAKNSA-N 1 3 329.488 2.814 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H](C)CNCc1cccnc1)[NH+]1CCCCC1 ZINC001438718496 1388760941 /nfs/dbraw/zinc/76/09/41/1388760941.db2.gz YCXLWEMCZFDWJP-PKOBYXMFSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)N(CCN(C)[C@H](C)c1ccccc1)C(=O)[C@H]1CC[N@H+](C)C1 ZINC001423584165 1382117296 /nfs/dbraw/zinc/11/72/96/1382117296.db2.gz XYOLYVFKEDXIFH-MJGOQNOKSA-N 1 3 331.504 2.868 10 0 EFAEHO CC(C)N(CCN(C)[C@H](C)c1ccccc1)C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001423584165 1382117301 /nfs/dbraw/zinc/11/73/01/1382117301.db2.gz XYOLYVFKEDXIFH-MJGOQNOKSA-N 1 3 331.504 2.868 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H](CNCc1ccccc1Cl)C(C)(C)C ZINC001423614515 1382169763 /nfs/dbraw/zinc/16/97/63/1382169763.db2.gz DGGXIWLVMBPQQS-MRXNPFEDSA-N 1 3 339.911 2.912 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001423952908 1382541367 /nfs/dbraw/zinc/54/13/67/1382541367.db2.gz YFYPHWKYJTVMNF-QUCCMNQESA-N 1 3 345.531 2.828 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1C ZINC001423952713 1382541475 /nfs/dbraw/zinc/54/14/75/1382541475.db2.gz XQBIHBBVHGAISP-ICSRJNTNSA-N 1 3 345.531 2.828 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](C)[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001423954609 1382543672 /nfs/dbraw/zinc/54/36/72/1382543672.db2.gz NETNTKJSIYWQQJ-RTBURBONSA-N 1 3 345.531 2.970 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[N@@H+](C)C[C@@H](C)CC)CC1)N(C)C ZINC001438768276 1388797720 /nfs/dbraw/zinc/79/77/20/1388797720.db2.gz WMAJJDWQLNEWSG-FUHWJXTLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[N@H+](C)C[C@@H](C)CC)CC1)N(C)C ZINC001438768276 1388797727 /nfs/dbraw/zinc/79/77/27/1388797727.db2.gz WMAJJDWQLNEWSG-FUHWJXTLSA-N 1 3 325.541 2.933 10 0 EFAEHO C[C@H](c1ccccc1F)N(C)CCCN(C)C(=O)C12CC[NH+](CC1)C2 ZINC001424326819 1382938340 /nfs/dbraw/zinc/93/83/40/1382938340.db2.gz PQMAHRGGKHASBF-MRXNPFEDSA-N 1 3 347.478 2.763 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N2CCC(C)(NC/C(Cl)=C\Cl)CC2)CC[N@@H+]1C ZINC001424484718 1383044567 /nfs/dbraw/zinc/04/45/67/1383044567.db2.gz BYIYLDDFEMGVLT-AOSXOHOOSA-N 1 3 348.318 2.616 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N2CCC(C)(NC/C(Cl)=C\Cl)CC2)CC[N@H+]1C ZINC001424484718 1383044575 /nfs/dbraw/zinc/04/45/75/1383044575.db2.gz BYIYLDDFEMGVLT-AOSXOHOOSA-N 1 3 348.318 2.616 10 0 EFAEHO CC[C@H](C)C[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H](C(C)C)N(C)C ZINC001424686011 1383256091 /nfs/dbraw/zinc/25/60/91/1383256091.db2.gz RJBCLQJYVSDZTH-OBZTUIKSSA-N 1 3 345.531 2.991 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([C@H]2CC[N@H+](CCC(C)C)C2)C1 ZINC001424696067 1383269263 /nfs/dbraw/zinc/26/92/63/1383269263.db2.gz IHGOGYUGUXUQJF-OALUTQOASA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([C@H]2CC[N@@H+](CCC(C)C)C2)C1 ZINC001424696067 1383269268 /nfs/dbraw/zinc/26/92/68/1383269268.db2.gz IHGOGYUGUXUQJF-OALUTQOASA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CC[NH+](C)C)NCc1cccc(Cl)c1F ZINC001438830179 1388846598 /nfs/dbraw/zinc/84/65/98/1388846598.db2.gz NQPRRNIQUMPPET-OAHLLOKOSA-N 1 3 343.874 2.661 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001424794502 1383351310 /nfs/dbraw/zinc/35/13/10/1383351310.db2.gz JRJWQXZNSKFGFQ-CVEARBPZSA-N 1 3 331.504 2.716 10 0 EFAEHO C[C@@H](NC(=O)C1CC[NH+](C)CC1)[C@H](C)NCc1sccc1Cl ZINC001424803311 1383362495 /nfs/dbraw/zinc/36/24/95/1383362495.db2.gz JGGJSHJPCJPPJC-NWDGAFQWSA-N 1 3 343.924 2.726 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)c(C)c1 ZINC001424806525 1383367913 /nfs/dbraw/zinc/36/79/13/1383367913.db2.gz WUWZHENPDCYHNB-IRXDYDNUSA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@H](NC(=O)CN(C)CC(C)(C)C)[C@H](C)[NH2+]Cc1cccc(F)c1 ZINC001424807509 1383368616 /nfs/dbraw/zinc/36/86/16/1383368616.db2.gz PEPDJOSIXLICNP-GJZGRUSLSA-N 1 3 337.483 2.786 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)cc1 ZINC001424817468 1383377010 /nfs/dbraw/zinc/37/70/10/1383377010.db2.gz OWMRPSWVKFDPIV-QZTJIDSGSA-N 1 3 345.531 2.895 10 0 EFAEHO CCc1ccc(CC[NH2+][C@@H](C)[C@@H](C)NC(=O)Cc2nc[nH]c2C)cc1 ZINC001424831716 1383391736 /nfs/dbraw/zinc/39/17/36/1383391736.db2.gz GJNMEKBHOPIMSH-LSDHHAIUSA-N 1 3 342.487 2.549 10 0 EFAEHO C[C@@H](NCc1sccc1Cl)[C@H](C)NC(=O)C1(C[NH+](C)C)CC1 ZINC001424838345 1383399187 /nfs/dbraw/zinc/39/91/87/1383399187.db2.gz YDOUNYKMNUOUOR-NEPJUHHUSA-N 1 3 343.924 2.726 10 0 EFAEHO C[C@@H](NC(=O)C1(C[NH+](C)C)CC1)[C@H](C)NCc1sccc1Cl ZINC001424838352 1383399250 /nfs/dbraw/zinc/39/92/50/1383399250.db2.gz YDOUNYKMNUOUOR-NWDGAFQWSA-N 1 3 343.924 2.726 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)[C@@H](C)NCc1cc2ccccc2o1 ZINC001424844753 1383408187 /nfs/dbraw/zinc/40/81/87/1383408187.db2.gz UCYPKPFMLPFKLW-CABCVRRESA-N 1 3 331.460 2.757 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)[C@@H](C)NCc1cc2ccccc2o1 ZINC001424844753 1383408192 /nfs/dbraw/zinc/40/81/92/1383408192.db2.gz UCYPKPFMLPFKLW-CABCVRRESA-N 1 3 331.460 2.757 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CCC([NH2+]CC2CC(F)(F)C2)CC1 ZINC001424867598 1383440768 /nfs/dbraw/zinc/44/07/68/1383440768.db2.gz NYZFSZLMIYRDJB-UHFFFAOYSA-N 1 3 345.478 2.731 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC(C)(C)CN(C)C(=O)[C@@H]1CCCN1C(C)C ZINC001424869175 1383443179 /nfs/dbraw/zinc/44/31/79/1383443179.db2.gz KRXNAHHZLCCWRN-CVEARBPZSA-N 1 3 329.504 2.682 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)[C@H](C)CNC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001425070580 1383515984 /nfs/dbraw/zinc/51/59/84/1383515984.db2.gz LKTRYFKWGAZHFM-GDBMZVCRSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)[C@H](C)CNC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001425070580 1383515992 /nfs/dbraw/zinc/51/59/92/1383515992.db2.gz LKTRYFKWGAZHFM-GDBMZVCRSA-N 1 3 337.895 2.537 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@@H](C)c3ccccc3F)C[C@H]21 ZINC001425373207 1383633849 /nfs/dbraw/zinc/63/38/49/1383633849.db2.gz HPEPEUOBMQLBDF-LEUOFYLZSA-N 1 3 347.478 2.523 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@@H](C)c3ccccc3F)C[C@H]21 ZINC001425373207 1383633850 /nfs/dbraw/zinc/63/38/50/1383633850.db2.gz HPEPEUOBMQLBDF-LEUOFYLZSA-N 1 3 347.478 2.523 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001425378289 1383638598 /nfs/dbraw/zinc/63/85/98/1383638598.db2.gz FANBCOKJFADUMH-SLFFLAALSA-N 1 3 343.515 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001425378289 1383638602 /nfs/dbraw/zinc/63/86/02/1383638602.db2.gz FANBCOKJFADUMH-SLFFLAALSA-N 1 3 343.515 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C)Cc2ccccc2F)CC1 ZINC001425438438 1383657796 /nfs/dbraw/zinc/65/77/96/1383657796.db2.gz XMERTGJGGFBSTL-UHFFFAOYSA-N 1 3 335.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C)Cc2ccccc2F)CC1 ZINC001425438438 1383657801 /nfs/dbraw/zinc/65/78/01/1383657801.db2.gz XMERTGJGGFBSTL-UHFFFAOYSA-N 1 3 335.467 2.589 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N(C)C[C@H](C)NCc1cc(C)ccc1F ZINC001425557862 1383691343 /nfs/dbraw/zinc/69/13/43/1383691343.db2.gz LIKXMTBWYDWZNC-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N(C)C[C@H](C)NCc1cc(C)ccc1F ZINC001425557862 1383691347 /nfs/dbraw/zinc/69/13/47/1383691347.db2.gz LIKXMTBWYDWZNC-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+][C@H]1CCCc2ccccc21 ZINC001425689119 1383767116 /nfs/dbraw/zinc/76/71/16/1383767116.db2.gz BJUSHDXUKDWFGD-LPHOPBHVSA-N 1 3 331.504 2.841 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H]2C[C@@H](C)N(C(=O)CCC[NH+](C)C)C2)c1 ZINC001425886965 1383829202 /nfs/dbraw/zinc/82/92/02/1383829202.db2.gz CRQRXXPIEPVFPV-NVXWUHKLSA-N 1 3 335.467 2.555 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CCC(C)(C)C)CN1C(=O)CN(C)CC(C)(C)C ZINC001425903516 1383839698 /nfs/dbraw/zinc/83/96/98/1383839698.db2.gz MSUSGBHUPNJTBF-JKSUJKDBSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc3cc[nH]c3c2)C[C@@H]1C ZINC001425907773 1383844942 /nfs/dbraw/zinc/84/49/42/1383844942.db2.gz GZARSQBVDLSWDO-YJBOKZPZSA-N 1 3 342.487 2.589 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CC3CC(C)(C)C3)[C@@H]2C1 ZINC001425913892 1383850329 /nfs/dbraw/zinc/85/03/29/1383850329.db2.gz FDPDHRKCGMVWDW-OTWHNJEPSA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc(C2CC2)cc1 ZINC001425921789 1383857901 /nfs/dbraw/zinc/85/79/01/1383857901.db2.gz DZDFAWDAPIDOFT-OXQOHEQNSA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@@H](F)CN[C@H]1CN(C(=O)CCC[NH+]2CCCCC2)CC1(C)C ZINC001425969395 1383908114 /nfs/dbraw/zinc/90/81/14/1383908114.db2.gz HBCDPGNKMHTEAQ-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](F)CN[C@@H]1CN(C(=O)CCC[NH+]2CCCCC2)CC1(C)C ZINC001425969381 1383908208 /nfs/dbraw/zinc/90/82/08/1383908208.db2.gz HBCDPGNKMHTEAQ-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]C/C=C/c2ccccc2)C(C)(C)C1 ZINC001425979099 1383914610 /nfs/dbraw/zinc/91/46/10/1383914610.db2.gz UHWWUUNSWKRQJE-DLENHJPASA-N 1 3 343.515 2.867 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCCC(C)C)C[C@H]21 ZINC001506798443 1406286506 /nfs/dbraw/zinc/28/65/06/1406286506.db2.gz YQJYYDUVCYPPNW-AKHDSKFASA-N 1 3 335.536 2.591 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]1[C@H]2C[N@H+](CCCC(C)C)C[C@H]21 ZINC001506798443 1406286515 /nfs/dbraw/zinc/28/65/15/1406286515.db2.gz YQJYYDUVCYPPNW-AKHDSKFASA-N 1 3 335.536 2.591 10 0 EFAEHO CC[C@H](c1ccccc1)[N@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)C(C)C)[C@@H]2C1 ZINC001506827938 1406305962 /nfs/dbraw/zinc/30/59/62/1406305962.db2.gz CRHOMKCKTDZQOW-YSTOQKLRSA-N 1 3 343.515 2.772 10 0 EFAEHO CC[C@H](c1ccccc1)[N@@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)C(C)C)[C@@H]2C1 ZINC001506827938 1406305972 /nfs/dbraw/zinc/30/59/72/1406305972.db2.gz CRHOMKCKTDZQOW-YSTOQKLRSA-N 1 3 343.515 2.772 10 0 EFAEHO CN(CCc1ccc2c(c1)OC(F)(F)O2)C[C@@H]1CCC[N@H+](C)C1 ZINC001434459268 1387161622 /nfs/dbraw/zinc/16/16/22/1387161622.db2.gz QGWMADPTXWHTDP-CQSZACIVSA-N 1 3 326.387 2.824 10 0 EFAEHO CN(CCc1ccc2c(c1)OC(F)(F)O2)C[C@@H]1CCC[N@@H+](C)C1 ZINC001434459268 1387161624 /nfs/dbraw/zinc/16/16/24/1387161624.db2.gz QGWMADPTXWHTDP-CQSZACIVSA-N 1 3 326.387 2.824 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cc2ccccc2s1)NC(=O)C1(N(C)C)CCC1 ZINC001439212183 1389050251 /nfs/dbraw/zinc/05/02/51/1389050251.db2.gz AJDLVSVNTXDORX-AWEZNQCLSA-N 1 3 345.512 2.980 10 0 EFAEHO C[C@@H](CNCc1cc2ccccc2o1)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001439238593 1389066298 /nfs/dbraw/zinc/06/62/98/1389066298.db2.gz NEMSVCSEMLKEMR-HNNXBMFYSA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N[C@@H](C)CNCc2cc(C)ccc2F)C1 ZINC001439240597 1389068099 /nfs/dbraw/zinc/06/80/99/1389068099.db2.gz AJMGZIWQABYBEK-IRXDYDNUSA-N 1 3 349.494 2.850 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N[C@@H](C)CNCc2cc(C)ccc2F)C1 ZINC001439240597 1389068102 /nfs/dbraw/zinc/06/81/02/1389068102.db2.gz AJMGZIWQABYBEK-IRXDYDNUSA-N 1 3 349.494 2.850 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)n1 ZINC001439241924 1389069158 /nfs/dbraw/zinc/06/91/58/1389069158.db2.gz YXASNLMDXOMURD-INIZCTEOSA-N 1 3 346.519 2.674 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)CC1CC2(CCC2)C1 ZINC001439321750 1389139943 /nfs/dbraw/zinc/13/99/43/1389139943.db2.gz DFRRDFLLOYTDBX-FUHWJXTLSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001439321750 1389139951 /nfs/dbraw/zinc/13/99/51/1389139951.db2.gz DFRRDFLLOYTDBX-FUHWJXTLSA-N 1 3 335.536 2.876 10 0 EFAEHO Cc1cccc(CN(C)C[C@@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001439329523 1389148260 /nfs/dbraw/zinc/14/82/60/1389148260.db2.gz BHQJTMRHVUYOHV-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1cccc(CN(C)C[C@@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001439329523 1389148265 /nfs/dbraw/zinc/14/82/65/1389148265.db2.gz BHQJTMRHVUYOHV-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@H](C)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001439361953 1389188023 /nfs/dbraw/zinc/18/80/23/1389188023.db2.gz ANAFHPPLXWSBFU-ULQDDVLXSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@H](C)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001439361953 1389188028 /nfs/dbraw/zinc/18/80/28/1389188028.db2.gz ANAFHPPLXWSBFU-ULQDDVLXSA-N 1 3 349.494 2.801 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2csc(C)c2)C1 ZINC001440137845 1389407177 /nfs/dbraw/zinc/40/71/77/1389407177.db2.gz RCNIZHFLARHMQP-PBHICJAKSA-N 1 3 337.533 2.582 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CCCC3CCCC3)C[C@@H]2C1 ZINC001440153803 1389412309 /nfs/dbraw/zinc/41/23/09/1389412309.db2.gz YTUAEFFIVFIMEM-KDURUIRLSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CCCC3CCCC3)C[C@@H]2C1 ZINC001440153803 1389412313 /nfs/dbraw/zinc/41/23/13/1389412313.db2.gz YTUAEFFIVFIMEM-KDURUIRLSA-N 1 3 335.536 2.687 10 0 EFAEHO C[C@H]([NH2+]CC[C@@H]1CCN(C(=O)CN2CCCC2)C1)c1ccccc1F ZINC001440224172 1389454713 /nfs/dbraw/zinc/45/47/13/1389454713.db2.gz XKCFYWIPKFDMPV-DLBZAZTESA-N 1 3 347.478 2.811 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CC2(C1)CCN(Cc1ccc(F)cc1)CC2 ZINC001440229555 1389459263 /nfs/dbraw/zinc/45/92/63/1389459263.db2.gz HLRZRYANIDXUGK-UHFFFAOYSA-N 1 3 347.478 2.592 10 0 EFAEHO C[C@H](C(=O)N(C)C[C@H]1CC[N@@H+]1CC1CCCC1)N1CCCCCC1 ZINC001440232480 1389461315 /nfs/dbraw/zinc/46/13/15/1389461315.db2.gz AYONQZDBVPMSOO-IEBWSBKVSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@H](C(=O)N(C)C[C@H]1CC[N@H+]1CC1CCCC1)N1CCCCCC1 ZINC001440232480 1389461326 /nfs/dbraw/zinc/46/13/26/1389461326.db2.gz AYONQZDBVPMSOO-IEBWSBKVSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@@H+]2CCC2CCCCC2)C1 ZINC001440240334 1389467485 /nfs/dbraw/zinc/46/74/85/1389467485.db2.gz ILTSELKEIIEFSQ-MJGOQNOKSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@H+]2CCC2CCCCC2)C1 ZINC001440240334 1389467487 /nfs/dbraw/zinc/46/74/87/1389467487.db2.gz ILTSELKEIIEFSQ-MJGOQNOKSA-N 1 3 335.536 2.831 10 0 EFAEHO CN(C[C@H]1CCN1Cc1cccc2ccccc21)C(=O)CC[NH+](C)C ZINC001440246047 1389472300 /nfs/dbraw/zinc/47/23/00/1389472300.db2.gz QFGSMCGBZKNYIW-LJQANCHMSA-N 1 3 339.483 2.824 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](Cc2ccccc2C)CC1)N(C)C ZINC001440386022 1389583011 /nfs/dbraw/zinc/58/30/11/1389583011.db2.gz ILFWNNRUVFKYJH-RBUKOAKNSA-N 1 3 331.504 2.806 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2C)CC1)N(C)C ZINC001440386022 1389583018 /nfs/dbraw/zinc/58/30/18/1389583018.db2.gz ILFWNNRUVFKYJH-RBUKOAKNSA-N 1 3 331.504 2.806 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@H]1CCCN(CCC(F)(F)F)CC1 ZINC001440389839 1389586411 /nfs/dbraw/zinc/58/64/11/1389586411.db2.gz LZARWCGEDVLBLN-GJZGRUSLSA-N 1 3 349.441 2.784 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@H]1CCCN(CCC(F)(F)F)CC1 ZINC001440389839 1389586416 /nfs/dbraw/zinc/58/64/16/1389586416.db2.gz LZARWCGEDVLBLN-GJZGRUSLSA-N 1 3 349.441 2.784 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@H+](CCc2cccs2)CC1 ZINC001440400959 1389599090 /nfs/dbraw/zinc/59/90/90/1389599090.db2.gz VJHQBQHDUVOTTH-MRXNPFEDSA-N 1 3 337.533 2.602 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@@H+](CCc2cccs2)CC1 ZINC001440400959 1389599095 /nfs/dbraw/zinc/59/90/95/1389599095.db2.gz VJHQBQHDUVOTTH-MRXNPFEDSA-N 1 3 337.533 2.602 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]CCc3cccs3)C2)C1 ZINC001440402744 1389600822 /nfs/dbraw/zinc/60/08/22/1389600822.db2.gz RNIRJLLYIIKOBC-YESZJQIVSA-N 1 3 349.544 2.507 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C/Cl)C1)N1CCCCCC1 ZINC001440406458 1389606508 /nfs/dbraw/zinc/60/65/08/1389606508.db2.gz ONPTWTIRELWTED-UCMYZZLCSA-N 1 3 341.927 2.878 10 0 EFAEHO C[C@H]1CC2(CN1C(=O)CC[NH+](C)C)CCN(CCC(F)(F)F)CC2 ZINC001440419064 1389616547 /nfs/dbraw/zinc/61/65/47/1389616547.db2.gz RILZZSFLBLCUHY-AWEZNQCLSA-N 1 3 349.441 2.594 10 0 EFAEHO CN(CCCN(C)C(=O)C12CCC[NH+]1CCC2)Cc1ccsc1 ZINC001440441979 1389639709 /nfs/dbraw/zinc/63/97/09/1389639709.db2.gz MFIJPKWAEMFWOP-UHFFFAOYSA-N 1 3 335.517 2.657 10 0 EFAEHO C[N@H+](CCC(=O)N1CCCCC[C@@H](NCCF)C1)C1CCCCC1 ZINC001440472909 1389678414 /nfs/dbraw/zinc/67/84/14/1389678414.db2.gz LLNIZNJFHHONIE-QGZVFWFLSA-N 1 3 341.515 2.971 10 0 EFAEHO C[N@@H+](CCC(=O)N1CCCCC[C@@H](NCCF)C1)C1CCCCC1 ZINC001440472909 1389678419 /nfs/dbraw/zinc/67/84/19/1389678419.db2.gz LLNIZNJFHHONIE-QGZVFWFLSA-N 1 3 341.515 2.971 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccc(C)cc2)[C@@H]1C ZINC001440487169 1389692287 /nfs/dbraw/zinc/69/22/87/1389692287.db2.gz CQBUWYKSEMGBSC-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccc(C)cc2)[C@@H]1C ZINC001440487169 1389692292 /nfs/dbraw/zinc/69/22/92/1389692292.db2.gz CQBUWYKSEMGBSC-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C)[NH+]1CCCC1 ZINC001440505968 1389707307 /nfs/dbraw/zinc/70/73/07/1389707307.db2.gz BZZFKMYPIISJSZ-YZGWKJHDSA-N 1 3 343.515 2.886 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CC[C@H](C)F)CC(C)(C)C1 ZINC001440526557 1389728833 /nfs/dbraw/zinc/72/88/33/1389728833.db2.gz FMLXYRCGTBTLFY-JKSUJKDBSA-N 1 3 329.504 2.682 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@]2(CC[N@H+](CC3CCCC3)C2)C1 ZINC001440533683 1389736564 /nfs/dbraw/zinc/73/65/64/1389736564.db2.gz BZTFZJBXRGPZPR-FQEVSTJZSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@]2(CC[N@@H+](CC3CCCC3)C2)C1 ZINC001440533683 1389736570 /nfs/dbraw/zinc/73/65/70/1389736570.db2.gz BZTFZJBXRGPZPR-FQEVSTJZSA-N 1 3 335.536 2.833 10 0 EFAEHO CC(C)CN1Cc2ccccc2C[C@@H]1CNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001440544868 1389746566 /nfs/dbraw/zinc/74/65/66/1389746566.db2.gz QSBATEDIQDJUNC-FXAWDEMLSA-N 1 3 343.515 2.527 10 0 EFAEHO CC(C)CN1Cc2ccccc2C[C@@H]1CNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001440544868 1389746572 /nfs/dbraw/zinc/74/65/72/1389746572.db2.gz QSBATEDIQDJUNC-FXAWDEMLSA-N 1 3 343.515 2.527 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1[NH2+]Cc1ccsc1 ZINC001440609994 1389771674 /nfs/dbraw/zinc/77/16/74/1389771674.db2.gz PUKWLSOAEAEXJI-HOCLYGCPSA-N 1 3 337.533 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C)([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC001440613246 1389774353 /nfs/dbraw/zinc/77/43/53/1389774353.db2.gz KNUZVHXYJAPLDH-OAHLLOKOSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001440619332 1389778653 /nfs/dbraw/zinc/77/86/53/1389778653.db2.gz KFPJGJROEBVBAF-IRXDYDNUSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001440619332 1389778656 /nfs/dbraw/zinc/77/86/56/1389778656.db2.gz KFPJGJROEBVBAF-IRXDYDNUSA-N 1 3 337.552 2.980 10 0 EFAEHO O=C(NCCN1CCCC1)[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC001440724486 1389842859 /nfs/dbraw/zinc/84/28/59/1389842859.db2.gz QUJSCIMRKUTRPX-IBGZPJMESA-N 1 3 341.499 2.501 10 0 EFAEHO O=C(NCCN1CCCC1)[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC001440724486 1389842864 /nfs/dbraw/zinc/84/28/64/1389842864.db2.gz QUJSCIMRKUTRPX-IBGZPJMESA-N 1 3 341.499 2.501 10 0 EFAEHO O=C(NCCN1CCCC1)[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC001440724490 1389843242 /nfs/dbraw/zinc/84/32/42/1389843242.db2.gz QUJSCIMRKUTRPX-LJQANCHMSA-N 1 3 341.499 2.501 10 0 EFAEHO O=C(NCCN1CCCC1)[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC001440724490 1389843244 /nfs/dbraw/zinc/84/32/44/1389843244.db2.gz QUJSCIMRKUTRPX-LJQANCHMSA-N 1 3 341.499 2.501 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)C[C@@H]1CCCN1C(=O)CN(C)C(C)C ZINC001440746100 1389866642 /nfs/dbraw/zinc/86/66/42/1389866642.db2.gz IRTBTIKMLAAZBH-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1ccccc1C[N@H+](C)C[C@@H]1CCCN1C(=O)CN(C)C(C)C ZINC001440746100 1389866647 /nfs/dbraw/zinc/86/66/47/1389866647.db2.gz IRTBTIKMLAAZBH-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001440764646 1389877904 /nfs/dbraw/zinc/87/79/04/1389877904.db2.gz XSSLGLBSWRBFTF-UHFFFAOYSA-N 1 3 335.536 2.781 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@@H](C)[NH2+]Cc1ccc(CF)cc1 ZINC001440797808 1389904803 /nfs/dbraw/zinc/90/48/03/1389904803.db2.gz MYHQFNJFRGPKKU-HUUCEWRRSA-N 1 3 335.467 2.623 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001440802112 1389907980 /nfs/dbraw/zinc/90/79/80/1389907980.db2.gz VDSYPCSMIVIRMB-CABCVRRESA-N 1 3 335.467 2.601 10 0 EFAEHO CC(C)c1cccc(CN[C@@H](C)[C@H](C)NC(=O)C2(C[NH+](C)C)CC2)n1 ZINC001440826036 1389928618 /nfs/dbraw/zinc/92/86/18/1389928618.db2.gz ZFWKTBWRMWPGKS-HOTGVXAUSA-N 1 3 346.519 2.530 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1cccc2cccnc21 ZINC001440846642 1389946905 /nfs/dbraw/zinc/94/69/05/1389946905.db2.gz GOQZWKXBJINQEA-HZPDHXFCSA-N 1 3 342.487 2.559 10 0 EFAEHO CN(CC(C)(C)C[NH2+]Cc1cccnc1)C(=O)C(C)(C)N1CCCC1 ZINC001440883671 1389976951 /nfs/dbraw/zinc/97/69/51/1389976951.db2.gz MPMFXAMSYRIKPT-UHFFFAOYSA-N 1 3 346.519 2.530 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@H]2C[C@H](C[NH2+]CCC3CCCCC3)C2)C1 ZINC001506896875 1406414268 /nfs/dbraw/zinc/41/42/68/1406414268.db2.gz BDZLTRBUHWCEDP-WDSOQIARSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001440974233 1390066495 /nfs/dbraw/zinc/06/64/95/1390066495.db2.gz SXSRWFFPEYJJKS-QAPCUYQASA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001440974233 1390066499 /nfs/dbraw/zinc/06/64/99/1390066499.db2.gz SXSRWFFPEYJJKS-QAPCUYQASA-N 1 3 331.504 2.582 10 0 EFAEHO C[C@@H](CCC[NH2+]Cc1ccccc1F)NC(=O)CN1CC[C@@H](C)C1 ZINC001506937422 1406467526 /nfs/dbraw/zinc/46/75/26/1406467526.db2.gz APLQYXQLDHHIFP-CVEARBPZSA-N 1 3 335.467 2.542 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC[NH+]([C@H]2CCc3ccccc32)CC1)N(C)C ZINC001440983917 1391003253 /nfs/dbraw/zinc/00/32/53/1391003253.db2.gz GJNKHFROKMCEHG-UXHICEINSA-N 1 3 343.515 2.937 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001440991376 1391009341 /nfs/dbraw/zinc/00/93/41/1391009341.db2.gz KMHXDIJHGMTFJS-GXTWGEPZSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001440991376 1391009345 /nfs/dbraw/zinc/00/93/45/1391009345.db2.gz KMHXDIJHGMTFJS-GXTWGEPZSA-N 1 3 342.434 2.523 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccccc1 ZINC001441078969 1391073460 /nfs/dbraw/zinc/07/34/60/1391073460.db2.gz HLEIZZWGIYQMOU-UYAOXDASSA-N 1 3 345.531 2.991 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)CN1CCCC1)[NH2+]CC1CC(C)(C)C1 ZINC001441090961 1391083608 /nfs/dbraw/zinc/08/36/08/1391083608.db2.gz KXJZTKAFCAVAQS-SFHVURJKSA-N 1 3 337.552 2.981 10 0 EFAEHO CCc1ccccc1CN1CC[C@@H](NC(=O)CC[C@H]2CCC[N@@H+]2C)C1 ZINC001441100904 1391092358 /nfs/dbraw/zinc/09/23/58/1391092358.db2.gz ZVWFMYQGQWAEKV-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccccc1CN1CC[C@@H](NC(=O)CC[C@H]2CCC[N@H+]2C)C1 ZINC001441100904 1391092362 /nfs/dbraw/zinc/09/23/62/1391092362.db2.gz ZVWFMYQGQWAEKV-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccccc1CN1CC[C@@H](NC(=O)CC[C@@H]2CCC[N@@H+]2C)C1 ZINC001441100895 1391093017 /nfs/dbraw/zinc/09/30/17/1391093017.db2.gz ZVWFMYQGQWAEKV-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccccc1CN1CC[C@@H](NC(=O)CC[C@@H]2CCC[N@H+]2C)C1 ZINC001441100895 1391093024 /nfs/dbraw/zinc/09/30/24/1391093024.db2.gz ZVWFMYQGQWAEKV-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO C[C@@H](NC(=O)CC[NH+](C)C)C1CN([C@@H]2CCCc3ccc(F)cc32)C1 ZINC001441184510 1391166328 /nfs/dbraw/zinc/16/63/28/1391166328.db2.gz VUNJAFBXEXUACJ-AUUYWEPGSA-N 1 3 347.478 2.591 10 0 EFAEHO Cc1cccc(C)c1C[NH+]1CC([C@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001441215438 1391187594 /nfs/dbraw/zinc/18/75/94/1391187594.db2.gz UETOJAPEVRHAJJ-KRWDZBQOSA-N 1 3 331.504 2.580 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)[C@@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001441271268 1391223862 /nfs/dbraw/zinc/22/38/62/1391223862.db2.gz WCKNSZFZVVTADP-OKYOBFRVSA-N 1 3 335.536 2.589 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)[C@@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001441271268 1391223864 /nfs/dbraw/zinc/22/38/64/1391223864.db2.gz WCKNSZFZVVTADP-OKYOBFRVSA-N 1 3 335.536 2.589 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001441303415 1391242711 /nfs/dbraw/zinc/24/27/11/1391242711.db2.gz RDVPYESUIWGCMO-SJORKVTESA-N 1 3 343.531 2.883 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001441303415 1391242715 /nfs/dbraw/zinc/24/27/15/1391242715.db2.gz RDVPYESUIWGCMO-SJORKVTESA-N 1 3 343.531 2.883 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@H](C)C3)C[C@@]2(C)C1 ZINC001441338693 1391257757 /nfs/dbraw/zinc/25/77/57/1391257757.db2.gz USYSLKJSXYUKTO-SESVDKBCSA-N 1 3 349.563 2.935 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@H](C)C3)C[C@@]2(C)C1 ZINC001441338693 1391257761 /nfs/dbraw/zinc/25/77/61/1391257761.db2.gz USYSLKJSXYUKTO-SESVDKBCSA-N 1 3 349.563 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](Cc3ccsc3)C[C@H]2C1 ZINC001441341833 1391259263 /nfs/dbraw/zinc/25/92/63/1391259263.db2.gz QEZGWCVJPCWFCT-KZNAEPCWSA-N 1 3 349.544 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccsc3)C[C@H]2C1 ZINC001441341833 1391259268 /nfs/dbraw/zinc/25/92/68/1391259268.db2.gz QEZGWCVJPCWFCT-KZNAEPCWSA-N 1 3 349.544 2.805 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001441381748 1391273802 /nfs/dbraw/zinc/27/38/02/1391273802.db2.gz WJPIFJIAOSFLSK-VDGAXYAQSA-N 1 3 343.515 2.889 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@H]2CCc3ccc(F)cc32)C1 ZINC001441383414 1391274898 /nfs/dbraw/zinc/27/48/98/1391274898.db2.gz ZLQTZJBIBCQXEP-FNHZYXHNSA-N 1 3 347.478 2.639 10 0 EFAEHO Cc1ccc(CN[C@H]2C[C@H](NC(=O)C3(C[NH+](C)C)CC3)C2)c(Cl)c1 ZINC001441402297 1391284587 /nfs/dbraw/zinc/28/45/87/1391284587.db2.gz AFUVTCURTGGHJF-WKILWMFISA-N 1 3 349.906 2.727 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001441537453 1391354182 /nfs/dbraw/zinc/35/41/82/1391354182.db2.gz LXKBAGVFXDIKOH-FUHWJXTLSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001441537453 1391354188 /nfs/dbraw/zinc/35/41/88/1391354188.db2.gz LXKBAGVFXDIKOH-FUHWJXTLSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@H](CNC(=O)CCC[NH+]2CCCCC2)C1 ZINC001441577240 1391371040 /nfs/dbraw/zinc/37/10/40/1391371040.db2.gz VRBRDNOZCCQDJB-QZTJIDSGSA-N 1 3 341.515 2.829 10 0 EFAEHO Cc1cccc(C[N@H+]2CCC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001441578013 1391372559 /nfs/dbraw/zinc/37/25/59/1391372559.db2.gz XHSMTJLKIBGIIJ-LJQANCHMSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1cccc(C[N@@H+]2CCC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001441578013 1391372567 /nfs/dbraw/zinc/37/25/67/1391372567.db2.gz XHSMTJLKIBGIIJ-LJQANCHMSA-N 1 3 331.504 2.663 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001441587264 1391379093 /nfs/dbraw/zinc/37/90/93/1391379093.db2.gz ASTJEFHVJZLFAO-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001441841594 1391422472 /nfs/dbraw/zinc/42/24/72/1391422472.db2.gz LXQXFDCARSQYEF-HNNXBMFYSA-N 1 3 329.488 2.643 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001441849364 1391423812 /nfs/dbraw/zinc/42/38/12/1391423812.db2.gz LTTXEINDTOEINS-APWZRJJASA-N 1 3 331.504 2.716 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+]Cc1ccc(Cl)cc1 ZINC001444436625 1391491106 /nfs/dbraw/zinc/49/11/06/1391491106.db2.gz JJIHKTRWWVFHFQ-AWEZNQCLSA-N 1 3 325.884 2.522 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]CC1CCC(C)CC1 ZINC001444940998 1391516003 /nfs/dbraw/zinc/51/60/03/1391516003.db2.gz ORBJFVHUAYHCMB-DAWZGUTISA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H](C)c1cccc(F)c1 ZINC001444940278 1391516116 /nfs/dbraw/zinc/51/61/16/1391516116.db2.gz MKZUINRAGDDNBV-MAUKXSAKSA-N 1 3 337.483 2.957 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H](C)c1cccc(F)c1 ZINC001444940277 1391516276 /nfs/dbraw/zinc/51/62/76/1391516276.db2.gz MKZUINRAGDDNBV-CRAIPNDOSA-N 1 3 337.483 2.957 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CNCc1ccccc1F)[NH+]1CCCCC1 ZINC001445495902 1391530107 /nfs/dbraw/zinc/53/01/07/1391530107.db2.gz DVHXZKINZIRIDJ-VQIMIIECSA-N 1 3 349.494 2.931 10 0 EFAEHO C[N@H+](CCC1CCCCC1)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001447770812 1391756728 /nfs/dbraw/zinc/75/67/28/1391756728.db2.gz PSKCRKFVRXKWTN-LJQANCHMSA-N 1 3 335.536 2.975 10 0 EFAEHO C[N@@H+](CCC1CCCCC1)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001447770812 1391756730 /nfs/dbraw/zinc/75/67/30/1391756730.db2.gz PSKCRKFVRXKWTN-LJQANCHMSA-N 1 3 335.536 2.975 10 0 EFAEHO CN(C/C=C\c1ccccc1)C[C@@H]1CCCN1C(=O)[C@H]1CC[N@H+](C)C1 ZINC001447771903 1391758047 /nfs/dbraw/zinc/75/80/47/1391758047.db2.gz RKFUEYGRBNLDLE-VZDLESTCSA-N 1 3 341.499 2.574 10 0 EFAEHO CN(C/C=C\c1ccccc1)C[C@@H]1CCCN1C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001447771903 1391758050 /nfs/dbraw/zinc/75/80/50/1391758050.db2.gz RKFUEYGRBNLDLE-VZDLESTCSA-N 1 3 341.499 2.574 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](C)[C@@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001447884855 1391790885 /nfs/dbraw/zinc/79/08/85/1391790885.db2.gz MJUAKJDNRIDVED-IAGOWNOFSA-N 1 3 331.504 2.852 10 0 EFAEHO C[C@@H](NCc1cncs1)[C@H](C)NC(=O)c1ccc(C[NH+](C)C)cc1 ZINC001447888814 1391791591 /nfs/dbraw/zinc/79/15/91/1391791591.db2.gz BXZRAZOXCCYNTO-KGLIPLIRSA-N 1 3 346.500 2.501 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)[C@@H](C)NCc1sccc1Cl ZINC001447911428 1391799156 /nfs/dbraw/zinc/79/91/56/1391799156.db2.gz QFRIIOZXGGAALK-NEPJUHHUSA-N 1 3 331.913 2.726 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)[C@@H](C)NCc1sccc1Cl ZINC001447911428 1391799159 /nfs/dbraw/zinc/79/91/59/1391799159.db2.gz QFRIIOZXGGAALK-NEPJUHHUSA-N 1 3 331.913 2.726 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H](C)[NH2+]CCc1ccccc1Cl ZINC001447927594 1391823486 /nfs/dbraw/zinc/82/34/86/1391823486.db2.gz VSDWMFFSPTUQIO-CHWSQXEVSA-N 1 3 348.878 2.640 10 0 EFAEHO CC[C@H](F)C[NH2+]C1CCC(N(C)C(=O)C2(N(C)C)CCC2)CC1 ZINC001447933367 1391830629 /nfs/dbraw/zinc/83/06/29/1391830629.db2.gz RZXAIOGYPFRTGB-FHERZECASA-N 1 3 327.488 2.578 10 0 EFAEHO CCc1cccc(CN(C)[C@@H](C)CNC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)c1 ZINC001448036035 1391906959 /nfs/dbraw/zinc/90/69/59/1391906959.db2.gz KFCUFQKBCPFNLW-FRQCXROJSA-N 1 3 331.504 2.526 10 0 EFAEHO CCc1cccc(CN(C)[C@@H](C)CNC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)c1 ZINC001448036035 1391906963 /nfs/dbraw/zinc/90/69/63/1391906963.db2.gz KFCUFQKBCPFNLW-FRQCXROJSA-N 1 3 331.504 2.526 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@@H](C)CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001448083768 1391939540 /nfs/dbraw/zinc/93/95/40/1391939540.db2.gz XHVHFKMQOHLCAB-ULQDDVLXSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@@H](C)CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001448083768 1391939546 /nfs/dbraw/zinc/93/95/46/1391939546.db2.gz XHVHFKMQOHLCAB-ULQDDVLXSA-N 1 3 349.494 2.801 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C)[C@H]2CCc3ccccc32)CC1 ZINC001506977811 1406538183 /nfs/dbraw/zinc/53/81/83/1406538183.db2.gz NTXFPQCZLHHMCS-FQEVSTJZSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C)[C@H]2CCc3ccccc32)CC1 ZINC001506977811 1406538187 /nfs/dbraw/zinc/53/81/87/1406538187.db2.gz NTXFPQCZLHHMCS-FQEVSTJZSA-N 1 3 343.515 2.937 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001449068472 1392249617 /nfs/dbraw/zinc/24/96/17/1392249617.db2.gz WFGQIYTXQFYHFD-RBUKOAKNSA-N 1 3 331.504 2.710 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@@H](NCc2ccc(Cl)s2)C(C)(C)C1 ZINC001449098952 1392252996 /nfs/dbraw/zinc/25/29/96/1392252996.db2.gz STLUYEAYIONHEE-CYBMUJFWSA-N 1 3 343.924 2.680 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H](C1CC1)N(C)C(=O)C(C)(C)N1CCCCC1 ZINC001507013432 1406589249 /nfs/dbraw/zinc/58/92/49/1406589249.db2.gz PFQPAOXJFQJDRO-NVXWUHKLSA-N 1 3 341.515 2.826 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C1(C)C ZINC001452129434 1392890578 /nfs/dbraw/zinc/89/05/78/1392890578.db2.gz HWJJPNACMVYULY-CVEARBPZSA-N 1 3 328.460 2.749 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@@H]1C[NH+]2CCC1CC2)NCc1ccccc1Cl ZINC001507072453 1406665297 /nfs/dbraw/zinc/66/52/97/1406665297.db2.gz HBJUSHFRMCDCGN-WMLDXEAASA-N 1 3 349.906 2.618 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCCC(F)(F)F)[C@H]1C ZINC001717803081 1419548492 /nfs/dbraw/zinc/54/84/92/1419548492.db2.gz SAYKMYOBWIVVAN-ZIAGYGMSSA-N 1 3 337.430 2.640 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001507127536 1406740339 /nfs/dbraw/zinc/74/03/39/1406740339.db2.gz QWWCUKPATQQHTQ-OALUTQOASA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccco1 ZINC001457819147 1395345691 /nfs/dbraw/zinc/34/56/91/1395345691.db2.gz ZIDREDURCZMTRI-MWDXBVQZSA-N 1 3 335.492 2.945 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1csc(C)c1 ZINC001507161010 1406790312 /nfs/dbraw/zinc/79/03/12/1406790312.db2.gz HIAXGXZRAITLKR-YOEHRIQHSA-N 1 3 337.533 2.867 10 0 EFAEHO Cc1ccc(CN(CCN(C)C)C(=O)[C@H]2CCC[C@@H]([NH+](C)C)C2)o1 ZINC001464636595 1396592238 /nfs/dbraw/zinc/59/22/38/1396592238.db2.gz MOZWLRLYRQUQQK-DLBZAZTESA-N 1 3 335.492 2.599 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N(CCN(C)C)C3CCCCC3)C[N@@H+]2C1 ZINC001464843010 1396617674 /nfs/dbraw/zinc/61/76/74/1396617674.db2.gz ZYHXKQOXUWPRLJ-AOIWGVFYSA-N 1 3 335.536 2.830 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N(CCN(C)C)C3CCCCC3)C[N@H+]2C1 ZINC001464843010 1396617679 /nfs/dbraw/zinc/61/76/79/1396617679.db2.gz ZYHXKQOXUWPRLJ-AOIWGVFYSA-N 1 3 335.536 2.830 10 0 EFAEHO C[C@@H]1[C@H]([NH2+]CCCCC(F)(F)F)CCN1C(=O)CN(C)C1CCC1 ZINC001507284039 1406847662 /nfs/dbraw/zinc/84/76/62/1406847662.db2.gz OICSIVOCVHFYFU-UKRRQHHQSA-N 1 3 349.441 2.782 10 0 EFAEHO C[C@@H](CN1CCOCC1)CN1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001473148385 1397285535 /nfs/dbraw/zinc/28/55/35/1397285535.db2.gz XPLCWONJZKMFRL-VQTJNVASSA-N 1 3 337.552 2.543 10 0 EFAEHO C[C@H](CN1CCOCC1)CN1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001473148386 1397285595 /nfs/dbraw/zinc/28/55/95/1397285595.db2.gz XPLCWONJZKMFRL-WOJBJXKFSA-N 1 3 337.552 2.543 10 0 EFAEHO C[C@@H]1C[C@H](N(C)CCc2ccc3c(c2)OC(F)(F)O3)CC[N@@H+]1C ZINC001473210109 1397289950 /nfs/dbraw/zinc/28/99/50/1397289950.db2.gz CIBAFWNFOAERCX-TZMCWYRMSA-N 1 3 326.387 2.965 10 0 EFAEHO C[C@@H]1C[C@H](N(C)CCc2ccc3c(c2)OC(F)(F)O3)CC[N@H+]1C ZINC001473210109 1397289951 /nfs/dbraw/zinc/28/99/51/1397289951.db2.gz CIBAFWNFOAERCX-TZMCWYRMSA-N 1 3 326.387 2.965 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H]2C[C@@H](C)N(C(=O)C3(C[NH+](C)C)CC3)C2)c1 ZINC001507321783 1406886767 /nfs/dbraw/zinc/88/67/67/1406886767.db2.gz QLLOVXSMFFHNTB-NVXWUHKLSA-N 1 3 347.478 2.555 10 0 EFAEHO CN(C[C@H]1CCN1[C@@H]1CCc2ccccc21)C(=O)CCCC[NH+](C)C ZINC001479261614 1397652103 /nfs/dbraw/zinc/65/21/03/1397652103.db2.gz XTFASDBOLFMTGO-UYAOXDASSA-N 1 3 343.515 2.939 10 0 EFAEHO CCc1cccc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001479345730 1397696427 /nfs/dbraw/zinc/69/64/27/1397696427.db2.gz AMFFHVLQUNDDEP-KDURUIRLSA-N 1 3 331.504 2.574 10 0 EFAEHO CC[C@H](C)C[NH2+][C@H]1C[C@@H](CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001479346171 1397697584 /nfs/dbraw/zinc/69/75/84/1397697584.db2.gz DGYMHEHJPCXURX-VDZJLULYSA-N 1 3 331.504 2.892 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001479349128 1397700300 /nfs/dbraw/zinc/70/03/00/1397700300.db2.gz XHAKWEVMYAJKPR-KDURUIRLSA-N 1 3 331.504 2.628 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]C[C@@H]2CCC(F)(F)C2)C1 ZINC001479489810 1397736156 /nfs/dbraw/zinc/73/61/56/1397736156.db2.gz SZRXHMJIUZZULC-ARFHVFGLSA-N 1 3 345.478 2.638 10 0 EFAEHO CN(CCCNC(=O)C1(C[NH+](C)C)CCCCC1)Cc1cccnc1 ZINC001479786998 1397859755 /nfs/dbraw/zinc/85/97/55/1397859755.db2.gz MGXBRUQWYHZYTH-UHFFFAOYSA-N 1 3 346.519 2.532 10 0 EFAEHO CC[N@H+](CCCNC(=O)Cc1nc[nH]c1C)Cc1cc(C)ccc1C ZINC001479859598 1397962489 /nfs/dbraw/zinc/96/24/89/1397962489.db2.gz QISPCNMRTPHAHA-UHFFFAOYSA-N 1 3 342.487 2.906 10 0 EFAEHO CC[N@@H+](CCCNC(=O)Cc1nc[nH]c1C)Cc1cc(C)ccc1C ZINC001479859598 1397962494 /nfs/dbraw/zinc/96/24/94/1397962494.db2.gz QISPCNMRTPHAHA-UHFFFAOYSA-N 1 3 342.487 2.906 10 0 EFAEHO CC[C@H](F)CN(CCCNC(=O)C12CCC[NH+](CCC1)C2)C1CC1 ZINC001479871130 1397979992 /nfs/dbraw/zinc/97/99/92/1397979992.db2.gz XKEZHZYARADGJK-INIZCTEOSA-N 1 3 339.499 2.581 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]([NH2+][C@@H]2CCc3ccccc32)C2CC2)CCC1 ZINC001480024335 1398099828 /nfs/dbraw/zinc/09/98/28/1398099828.db2.gz SSCPGOZZRLEBRF-RTBURBONSA-N 1 3 341.499 2.643 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N1CCC[C@H](CN(C)C/C=C\Cl)C1 ZINC001480078717 1398113148 /nfs/dbraw/zinc/11/31/48/1398113148.db2.gz MRLSEJLJVBOLDF-REEAJDFCSA-N 1 3 341.927 2.784 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N1CCC[C@H](CN(C)C/C=C\Cl)C1 ZINC001480078717 1398113154 /nfs/dbraw/zinc/11/31/54/1398113154.db2.gz MRLSEJLJVBOLDF-REEAJDFCSA-N 1 3 341.927 2.784 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N1CCC[C@@H](CN(C)C/C=C\Cl)C1 ZINC001480078715 1398113650 /nfs/dbraw/zinc/11/36/50/1398113650.db2.gz MRLSEJLJVBOLDF-HYHHROLSSA-N 1 3 341.927 2.784 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N1CCC[C@@H](CN(C)C/C=C\Cl)C1 ZINC001480078715 1398113654 /nfs/dbraw/zinc/11/36/54/1398113654.db2.gz MRLSEJLJVBOLDF-HYHHROLSSA-N 1 3 341.927 2.784 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]([NH2+]CCCc2ccccc2)C1)CC(C)(C)C ZINC001480158507 1398132657 /nfs/dbraw/zinc/13/26/57/1398132657.db2.gz QZKPOBJNSLHHSC-WGSAOQKQSA-N 1 3 345.531 2.834 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@H]([NH2+]C/C=C\c2ccccc2)C1 ZINC001480174678 1398143598 /nfs/dbraw/zinc/14/35/98/1398143598.db2.gz XWDOOCLATZBQPI-KJGKJSHASA-N 1 3 341.499 2.809 10 0 EFAEHO CN(C)C1(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CCCC2)CCC1 ZINC001480179191 1398147919 /nfs/dbraw/zinc/14/79/19/1398147919.db2.gz CGUOXRFHGHPYOG-AYHJJNSGSA-N 1 3 333.520 2.773 10 0 EFAEHO CN(C)C1(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CCCC2)CCC1 ZINC001480179191 1398147924 /nfs/dbraw/zinc/14/79/24/1398147924.db2.gz CGUOXRFHGHPYOG-AYHJJNSGSA-N 1 3 333.520 2.773 10 0 EFAEHO C[C@@H]([NH2+][C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)C1)c1ccccc1F ZINC001480208203 1398165033 /nfs/dbraw/zinc/16/50/33/1398165033.db2.gz QTRSKCGLQRRKSJ-KFWWJZLASA-N 1 3 333.451 2.608 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[NH2+]CCc1ccccc1F ZINC001480366662 1398180942 /nfs/dbraw/zinc/18/09/42/1398180942.db2.gz BRWNDRXGIFHZMZ-SFHVURJKSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CC(C)(C)C1 ZINC001480536797 1398198389 /nfs/dbraw/zinc/19/83/89/1398198389.db2.gz KJKGKYGKPQWEIF-AUUYWEPGSA-N 1 3 341.515 2.729 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@H]1CCC[N@@H+]1Cc1ccccc1C ZINC001493107690 1398446738 /nfs/dbraw/zinc/44/67/38/1398446738.db2.gz NFVDIPRHVGDSAQ-RTBURBONSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@H]1CCC[N@H+]1Cc1ccccc1C ZINC001493107690 1398446741 /nfs/dbraw/zinc/44/67/41/1398446741.db2.gz NFVDIPRHVGDSAQ-RTBURBONSA-N 1 3 349.494 2.756 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N1CCCC1 ZINC001493223626 1398543312 /nfs/dbraw/zinc/54/33/12/1398543312.db2.gz QPFSPUNVPDDIAU-KRWDZBQOSA-N 1 3 347.547 2.879 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N1CCCC1 ZINC001493223626 1398543319 /nfs/dbraw/zinc/54/33/19/1398543319.db2.gz QPFSPUNVPDDIAU-KRWDZBQOSA-N 1 3 347.547 2.879 10 0 EFAEHO Cc1cc(C)cc(C[N@H+]2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001493238456 1398554540 /nfs/dbraw/zinc/55/45/40/1398554540.db2.gz WKOOJOPQQLDWBA-QFBILLFUSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+]2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001493238456 1398554543 /nfs/dbraw/zinc/55/45/43/1398554543.db2.gz WKOOJOPQQLDWBA-QFBILLFUSA-N 1 3 343.515 2.583 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCN(Cc2cccc(F)c2)C1)[NH+](CC)CC ZINC001493237761 1398554715 /nfs/dbraw/zinc/55/47/15/1398554715.db2.gz SOJHOXIDVMZKRY-IEBWSBKVSA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1cc(C)cc(C[N@H+]2CC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001493238454 1398554841 /nfs/dbraw/zinc/55/48/41/1398554841.db2.gz WKOOJOPQQLDWBA-APWZRJJASA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+]2CC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001493238454 1398554845 /nfs/dbraw/zinc/55/48/45/1398554845.db2.gz WKOOJOPQQLDWBA-APWZRJJASA-N 1 3 343.515 2.583 10 0 EFAEHO CCC[N@H+](CCNC(=O)Cc1nc[nH]c1C)[C@@H]1CCc2ccccc21 ZINC001493331529 1398619308 /nfs/dbraw/zinc/61/93/08/1398619308.db2.gz TVQCXBVDJWEWPW-LJQANCHMSA-N 1 3 340.471 2.776 10 0 EFAEHO CCC[N@@H+](CCNC(=O)Cc1nc[nH]c1C)[C@@H]1CCc2ccccc21 ZINC001493331529 1398619311 /nfs/dbraw/zinc/61/93/11/1398619311.db2.gz TVQCXBVDJWEWPW-LJQANCHMSA-N 1 3 340.471 2.776 10 0 EFAEHO Cc1cc(C)c(CN(CCNC(=O)CC[NH+](C)C)C2CC2)c(C)c1 ZINC001493406957 1398681585 /nfs/dbraw/zinc/68/15/85/1398681585.db2.gz JKFJVHGSMTXOFT-UHFFFAOYSA-N 1 3 331.504 2.644 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[N@@H+](CC[C@@H](C)F)C1CC1 ZINC001493424701 1398697085 /nfs/dbraw/zinc/69/70/85/1398697085.db2.gz VJWSRQHYUFDDRG-NVXWUHKLSA-N 1 3 327.488 2.578 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[N@H+](CC[C@@H](C)F)C1CC1 ZINC001493424701 1398697089 /nfs/dbraw/zinc/69/70/89/1398697089.db2.gz VJWSRQHYUFDDRG-NVXWUHKLSA-N 1 3 327.488 2.578 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001493429295 1398700190 /nfs/dbraw/zinc/70/01/90/1398700190.db2.gz IQTVWTJXEFSOQW-WOJBJXKFSA-N 1 3 341.499 2.784 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001493429295 1398700195 /nfs/dbraw/zinc/70/01/95/1398700195.db2.gz IQTVWTJXEFSOQW-WOJBJXKFSA-N 1 3 341.499 2.784 10 0 EFAEHO CCc1ccccc1CN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)C1CC1 ZINC001493436837 1398707249 /nfs/dbraw/zinc/70/72/49/1398707249.db2.gz ZPBWHZNEZALYDA-QGZVFWFLSA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1ccccc1CN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)C1CC1 ZINC001493436837 1398707255 /nfs/dbraw/zinc/70/72/55/1398707255.db2.gz ZPBWHZNEZALYDA-QGZVFWFLSA-N 1 3 343.515 2.671 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)C[C@H]2CC[N@@H+](C)C2)C2CC2)c(C)c1 ZINC001493436331 1398707404 /nfs/dbraw/zinc/70/74/04/1398707404.db2.gz SOPWLFYTRIGZKO-GOSISDBHSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)C[C@H]2CC[N@H+](C)C2)C2CC2)c(C)c1 ZINC001493436331 1398707411 /nfs/dbraw/zinc/70/74/11/1398707411.db2.gz SOPWLFYTRIGZKO-GOSISDBHSA-N 1 3 343.515 2.726 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCN(Cc1ccccc1)C1CC1)[NH+]1CCCC1 ZINC001493448629 1398715379 /nfs/dbraw/zinc/71/53/79/1398715379.db2.gz DLYPQZCVAILDBO-FQEVSTJZSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC001493694442 1398813255 /nfs/dbraw/zinc/81/32/55/1398813255.db2.gz DXJBSNGYUCGASA-CQSZACIVSA-N 1 3 339.430 2.514 10 0 EFAEHO CN(CC(=O)N(C)CC[NH2+]CC[C@H]1CCCC1(F)F)CC(C)(C)C ZINC001493695611 1398814752 /nfs/dbraw/zinc/81/47/52/1398814752.db2.gz JIISUWBCWJJKJX-OAHLLOKOSA-N 1 3 347.494 2.838 10 0 EFAEHO CN(CC[NH2+]CC1CCC(C(C)(C)C)CC1)C(=O)Cc1c[nH]cn1 ZINC001493708090 1398824425 /nfs/dbraw/zinc/82/44/25/1398824425.db2.gz BTIQWDAUNSPDNT-UHFFFAOYSA-N 1 3 334.508 2.853 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)N(C)CCNCc1ccccc1F ZINC001493721691 1398835732 /nfs/dbraw/zinc/83/57/32/1398835732.db2.gz YRSKOMPAOHFUKF-GOSISDBHSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)N(C)CCNCc1ccccc1F ZINC001493721691 1398835734 /nfs/dbraw/zinc/83/57/34/1398835734.db2.gz YRSKOMPAOHFUKF-GOSISDBHSA-N 1 3 335.467 2.637 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]Cc1ccc(CF)cc1 ZINC001493806106 1398895476 /nfs/dbraw/zinc/89/54/76/1398895476.db2.gz FVQQPKHZANBIQP-GOSISDBHSA-N 1 3 335.467 2.579 10 0 EFAEHO C[C@@H]([NH2+]CCCC1CCC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001493838417 1398914126 /nfs/dbraw/zinc/91/41/26/1398914126.db2.gz ZKTVJJZESSESMP-VQIMIIECSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C(=O)CC[NH+](C)C)[C@H]1CCN(CCc2ccccc2F)C1 ZINC001493958967 1399009416 /nfs/dbraw/zinc/00/94/16/1399009416.db2.gz DAJUFVYOOAOWLG-SFHVURJKSA-N 1 3 349.494 2.633 10 0 EFAEHO CC[NH2+][C@@H](CCNC(=O)[C@H]1CCCCN1CC)Cc1ccccc1 ZINC001507388665 1407000993 /nfs/dbraw/zinc/00/09/93/1407000993.db2.gz IIBUJZNJZBLYJK-RBUKOAKNSA-N 1 3 331.504 2.588 10 0 EFAEHO O=C(NCC[C@@H]1CCN(CCF)C1)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001494044327 1399086267 /nfs/dbraw/zinc/08/62/67/1399086267.db2.gz XRPFFFNKYCQIBS-SJLPKXTDSA-N 1 3 339.499 2.581 10 0 EFAEHO O=C(NCC[C@@H]1CCN(CCF)C1)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001494044327 1399086271 /nfs/dbraw/zinc/08/62/71/1399086271.db2.gz XRPFFFNKYCQIBS-SJLPKXTDSA-N 1 3 339.499 2.581 10 0 EFAEHO C[N@H+](CCC1CCCCC1)C[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001494182303 1399194955 /nfs/dbraw/zinc/19/49/55/1399194955.db2.gz XWPIOQSHOQGNKI-LJQANCHMSA-N 1 3 335.536 2.833 10 0 EFAEHO C[N@@H+](CCC1CCCCC1)C[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001494182303 1399194957 /nfs/dbraw/zinc/19/49/57/1399194957.db2.gz XWPIOQSHOQGNKI-LJQANCHMSA-N 1 3 335.536 2.833 10 0 EFAEHO CCC[N@H+](C)CC1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001494206067 1399212197 /nfs/dbraw/zinc/21/21/97/1399212197.db2.gz JCVQRLBOIURXHJ-IBGZPJMESA-N 1 3 341.515 2.779 10 0 EFAEHO CCC[N@@H+](C)CC1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001494206067 1399212201 /nfs/dbraw/zinc/21/22/01/1399212201.db2.gz JCVQRLBOIURXHJ-IBGZPJMESA-N 1 3 341.515 2.779 10 0 EFAEHO CCC/C=C/CCN1C[C@@H]2C[C@H]1CN2C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001494658383 1399418286 /nfs/dbraw/zinc/41/82/86/1399418286.db2.gz HKVCZQMNCBMQJW-OISZBXDOSA-N 1 3 333.520 2.892 10 0 EFAEHO CCC/C=C/CCN1C[C@@H]2C[C@H]1CN2C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001494658383 1399418288 /nfs/dbraw/zinc/41/82/88/1399418288.db2.gz HKVCZQMNCBMQJW-OISZBXDOSA-N 1 3 333.520 2.892 10 0 EFAEHO CCN(C(=O)CC[C@H]1CCC[N@@H+]1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001494907188 1399546870 /nfs/dbraw/zinc/54/68/70/1399546870.db2.gz XKBPUBYLRWNKTL-WOJBJXKFSA-N 1 3 343.515 2.984 10 0 EFAEHO CCN(C(=O)CC[C@H]1CCC[N@H+]1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001494907188 1399546873 /nfs/dbraw/zinc/54/68/73/1399546873.db2.gz XKBPUBYLRWNKTL-WOJBJXKFSA-N 1 3 343.515 2.984 10 0 EFAEHO CCN(C(=O)CC[C@H]1CCC[N@@H+]1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC001494907184 1399546934 /nfs/dbraw/zinc/54/69/34/1399546934.db2.gz XKBPUBYLRWNKTL-UXHICEINSA-N 1 3 343.515 2.984 10 0 EFAEHO CCN(C(=O)CC[C@H]1CCC[N@H+]1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC001494907184 1399546936 /nfs/dbraw/zinc/54/69/36/1399546936.db2.gz XKBPUBYLRWNKTL-UXHICEINSA-N 1 3 343.515 2.984 10 0 EFAEHO CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@H+](CC(C)C)C1 ZINC001494909989 1399549363 /nfs/dbraw/zinc/54/93/63/1399549363.db2.gz JWZODDLKQQBVFG-APWZRJJASA-N 1 3 341.515 2.778 10 0 EFAEHO CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@@H+](CC(C)C)C1 ZINC001494909989 1399549365 /nfs/dbraw/zinc/54/93/65/1399549365.db2.gz JWZODDLKQQBVFG-APWZRJJASA-N 1 3 341.515 2.778 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001494911625 1399551279 /nfs/dbraw/zinc/55/12/79/1399551279.db2.gz WIFCHIIGFYIUOZ-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C1CCC1)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001495002296 1399597137 /nfs/dbraw/zinc/59/71/37/1399597137.db2.gz KJGXFRRJFLIQSK-KRWDZBQOSA-N 1 3 342.487 2.637 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]C/C=C\c1ccccc1 ZINC001495057104 1399633012 /nfs/dbraw/zinc/63/30/12/1399633012.db2.gz DGHZFBFFFLUYJK-OSKOBQJQSA-N 1 3 329.488 2.526 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@](C)(NC(=O)CN2CC[C@H](C)C2)C2CC2)c1 ZINC001495277849 1399787111 /nfs/dbraw/zinc/78/71/11/1399787111.db2.gz RIUFHDVHOOMBGF-LAUBAEHRSA-N 1 3 343.515 2.711 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@](C)(C[NH2+]CC1CCC(C)CC1)C1CC1 ZINC001495298898 1399807062 /nfs/dbraw/zinc/80/70/62/1399807062.db2.gz QGSLNBZLXAEHCY-QJXPYNDKSA-N 1 3 346.519 2.961 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@](C)(C[NH2+]C/C=C/Cl)C2CC2)c1 ZINC001495304858 1399816689 /nfs/dbraw/zinc/81/66/89/1399816689.db2.gz YHBPKGSHVHIBJX-CEQQRPIWSA-N 1 3 349.906 2.989 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H](CC[NH2+]C/C=C/Cl)C1)N(C)C ZINC001495381059 1399926795 /nfs/dbraw/zinc/92/67/95/1399926795.db2.gz RLPHDDGEGIARQK-VKFONMJVSA-N 1 3 329.916 2.543 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](CC[NH2+]CC2CC(C)(C)C2)C1 ZINC001495380909 1399927253 /nfs/dbraw/zinc/92/72/53/1399927253.db2.gz UCGORAOBRSBLSO-QGZVFWFLSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N2C[C@H](NC/C=C\Cl)C(C)(C)C2)CC1 ZINC001507449905 1407067271 /nfs/dbraw/zinc/06/72/71/1407067271.db2.gz NFZUWRZCQMVBCS-SBSDFTTDSA-N 1 3 341.927 2.686 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1C[C@@H](NCc2cc(C)ccc2F)C(C)(C)C1 ZINC001507449671 1407067333 /nfs/dbraw/zinc/06/73/33/1407067333.db2.gz JCGCGAMSFXTDAA-GOSISDBHSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1C[C@@H](NCc2cc(C)ccc2F)C(C)(C)C1 ZINC001507449671 1407067344 /nfs/dbraw/zinc/06/73/44/1407067344.db2.gz JCGCGAMSFXTDAA-GOSISDBHSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](CC[NH2+]Cc2ccc(F)cc2)C1 ZINC001495393447 1399938742 /nfs/dbraw/zinc/93/87/42/1399938742.db2.gz ONDOFTDNGKKRLI-SFHVURJKSA-N 1 3 349.494 2.884 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC(CC[NH2+]CC2CC3(CCC3)C2)CC1 ZINC001495404433 1399949767 /nfs/dbraw/zinc/94/97/67/1399949767.db2.gz WUSOXAJYSWWZQC-LJQANCHMSA-N 1 3 347.547 2.879 10 0 EFAEHO CC[C@H](C)C[NH2+]CCC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001495429076 1399973082 /nfs/dbraw/zinc/97/30/82/1399973082.db2.gz OOTPEDWHGXBTSQ-KRWDZBQOSA-N 1 3 337.552 2.983 10 0 EFAEHO CC1(C)CN(C(=O)CCC[NH+]2CCCCC2)C[C@H]1NC/C=C\Cl ZINC001507452416 1407071182 /nfs/dbraw/zinc/07/11/82/1407071182.db2.gz MVJBLCMPHMAFQB-DZFYGRHCSA-N 1 3 341.927 2.832 10 0 EFAEHO C[NH+](C)CCC(=O)NCc1ccc(CNCc2cccc(F)c2)cc1 ZINC001495495397 1400028746 /nfs/dbraw/zinc/02/87/46/1400028746.db2.gz OUAADVHUYMZRRT-UHFFFAOYSA-N 1 3 343.446 2.683 10 0 EFAEHO CC(C)CCOCC[NH2+]C[C@H]1CCCN1C(=O)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1 ZINC001495596305 1400103738 /nfs/dbraw/zinc/10/37/38/1400103738.db2.gz IGSPDVWSIFGXEH-WMDIELAYSA-N 1 3 348.531 2.922 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)C[NH2+]CCc1cccs1 ZINC001495670157 1400155025 /nfs/dbraw/zinc/15/50/25/1400155025.db2.gz YFMMUZUDZBDNJH-NVXWUHKLSA-N 1 3 337.533 2.505 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001495685495 1400165196 /nfs/dbraw/zinc/16/51/96/1400165196.db2.gz RRGKAPIJJLLDOQ-HUUCEWRRSA-N 1 3 345.478 2.638 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001495685493 1400165443 /nfs/dbraw/zinc/16/54/43/1400165443.db2.gz RRGKAPIJJLLDOQ-CABCVRRESA-N 1 3 345.478 2.638 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](C)N(C)C(=O)[C@H]1CC[N@H+](C)C1 ZINC001496230376 1400557144 /nfs/dbraw/zinc/55/71/44/1400557144.db2.gz VKTXNWCJJBSXSG-CABCVRRESA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](C)N(C)C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001496230376 1400557148 /nfs/dbraw/zinc/55/71/48/1400557148.db2.gz VKTXNWCJJBSXSG-CABCVRRESA-N 1 3 337.895 2.537 10 0 EFAEHO CC(C)C[C@H](CNCc1ccccc1F)NC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001496300781 1400616344 /nfs/dbraw/zinc/61/63/44/1400616344.db2.gz NWLLUHZCJNHGQU-SJLPKXTDSA-N 1 3 349.494 2.788 10 0 EFAEHO CC(C)C[C@H](CNCc1ccccc1F)NC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001496300781 1400616349 /nfs/dbraw/zinc/61/63/49/1400616349.db2.gz NWLLUHZCJNHGQU-SJLPKXTDSA-N 1 3 349.494 2.788 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]Cc1cccnc1)C1CCCCC1 ZINC001496327297 1400643347 /nfs/dbraw/zinc/64/33/47/1400643347.db2.gz SDWJZPBZXTWEPT-LJQANCHMSA-N 1 3 346.519 2.577 10 0 EFAEHO CC(C)CC[NH2+][C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C[C@H]1C ZINC001496355688 1400666856 /nfs/dbraw/zinc/66/68/56/1400666856.db2.gz HPAVIPIUDWINAG-SJORKVTESA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@H]1CN(C(=O)c2cccc(CN(C)C)c2)CC[C@H]1[NH2+]CCCF ZINC001496368951 1400677930 /nfs/dbraw/zinc/67/79/30/1400677930.db2.gz JCXXQTRFZWBARA-MAUKXSAKSA-N 1 3 335.467 2.548 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C)[C@@H]1C[NH2+]Cc1ccsc1 ZINC001496486209 1400763602 /nfs/dbraw/zinc/76/36/02/1400763602.db2.gz IHJNXJJFHUTPIM-RDJZCZTQSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001496507756 1400782635 /nfs/dbraw/zinc/78/26/35/1400782635.db2.gz CGPCXAOBMVRYPW-MSOLQXFVSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001496507756 1400782638 /nfs/dbraw/zinc/78/26/38/1400782638.db2.gz CGPCXAOBMVRYPW-MSOLQXFVSA-N 1 3 337.552 2.935 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@@H]2CCC[C@@H]3CCC[N@@H+]32)CC1 ZINC001496510452 1400785016 /nfs/dbraw/zinc/78/50/16/1400785016.db2.gz HHNAWCKSTJKSMU-MSOLQXFVSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@@H]2CCC[C@@H]3CCC[N@H+]32)CC1 ZINC001496510452 1400785021 /nfs/dbraw/zinc/78/50/21/1400785021.db2.gz HHNAWCKSTJKSMU-MSOLQXFVSA-N 1 3 339.499 2.533 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1ccsc1)C(C)C ZINC001496567609 1400833225 /nfs/dbraw/zinc/83/32/25/1400833225.db2.gz SMGNWNLQRIXCFY-IRXDYDNUSA-N 1 3 337.533 2.853 10 0 EFAEHO CC(C)[C@H](CNC(=O)CC[NH+](C)C)N[C@H](C)c1cc(F)ccc1F ZINC001496598995 1400860248 /nfs/dbraw/zinc/86/02/48/1400860248.db2.gz VMTVKCXXJHHCBV-DYVFJYSZSA-N 1 3 341.446 2.708 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)CC[C@@H]1CCc2ccccc21 ZINC001496846077 1401036271 /nfs/dbraw/zinc/03/62/71/1401036271.db2.gz ZGBCUSDRCKJWGW-IBGZPJMESA-N 1 3 345.531 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)CC[C@@H]1CCc2ccccc21 ZINC001496846077 1401036279 /nfs/dbraw/zinc/03/62/79/1401036279.db2.gz ZGBCUSDRCKJWGW-IBGZPJMESA-N 1 3 345.531 2.837 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H]3CN(C(=O)CN(C)C(C)C)CC[C@H]32)cc1 ZINC001496866772 1401062996 /nfs/dbraw/zinc/06/29/96/1401062996.db2.gz IRDGPOQLDIORLG-VQTJNVASSA-N 1 3 343.515 2.758 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H]3CN(C(=O)CN(C)C(C)C)CC[C@H]32)cc1 ZINC001496866772 1401063003 /nfs/dbraw/zinc/06/30/03/1401063003.db2.gz IRDGPOQLDIORLG-VQTJNVASSA-N 1 3 343.515 2.758 10 0 EFAEHO C[C@H](CC[NH2+]C/C=C\c1ccccc1)NC(=O)C1(N(C)C)CCC1 ZINC001497205225 1401218806 /nfs/dbraw/zinc/21/88/06/1401218806.db2.gz INBDBVCERDMFDH-CGICMKJESA-N 1 3 329.488 2.669 10 0 EFAEHO C[C@H](CC[NH2+]C/C=C/c1ccccc1)NC(=O)C1(N(C)C)CCC1 ZINC001497205229 1401218889 /nfs/dbraw/zinc/21/88/89/1401218889.db2.gz INBDBVCERDMFDH-VDZSZVPASA-N 1 3 329.488 2.669 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H](C)NC(=O)[C@@H](C(C)C)N(C)C)c(C)c1 ZINC001497261139 1401254017 /nfs/dbraw/zinc/25/40/17/1401254017.db2.gz BHEKOAATLYURQG-PKOBYXMFSA-N 1 3 333.520 2.874 10 0 EFAEHO Cc1ncccc1C[NH2+]CC[C@H](C)NC(=O)[C@H]1CCCCN1C(C)C ZINC001497277165 1401264873 /nfs/dbraw/zinc/26/48/73/1401264873.db2.gz QHBVOUSBOARUJK-QFBILLFUSA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+][C@@H](C)c1ccc(F)cc1F ZINC001497329729 1401306091 /nfs/dbraw/zinc/30/60/91/1401306091.db2.gz DECDSEUIIPIBNX-KGLIPLIRSA-N 1 3 341.446 2.850 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+][C@H](C)c1ccc(F)cc1F ZINC001497329735 1401306811 /nfs/dbraw/zinc/30/68/11/1401306811.db2.gz DECDSEUIIPIBNX-ZIAGYGMSSA-N 1 3 341.446 2.850 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(Cl)cc1C)C(=O)[C@H]1CCCN1C ZINC001497361754 1401327164 /nfs/dbraw/zinc/32/71/64/1401327164.db2.gz IYNZTBQLPIILOT-QGZVFWFLSA-N 1 3 337.895 2.681 10 0 EFAEHO CCN(CCN[C@@H](C)c1ccccc1F)C(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001497384408 1401340639 /nfs/dbraw/zinc/34/06/39/1401340639.db2.gz XDPHBGUNOULZHC-YJBOKZPZSA-N 1 3 347.478 2.667 10 0 EFAEHO CC[C@@H](F)CNCCN(CC)C(=O)[C@H]1C[N@H+](C)C[C@@H]1c1ccccc1 ZINC001497455266 1401387779 /nfs/dbraw/zinc/38/77/79/1401387779.db2.gz IPYLXEWSJGRXHY-QRVBRYPASA-N 1 3 349.494 2.518 10 0 EFAEHO CC[C@@H](F)CNCCN(CC)C(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1 ZINC001497455266 1401387781 /nfs/dbraw/zinc/38/77/81/1401387781.db2.gz IPYLXEWSJGRXHY-QRVBRYPASA-N 1 3 349.494 2.518 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\C[NH2+][C@H]1CCc2c1cccc2F)N(C)C ZINC001497673310 1401539983 /nfs/dbraw/zinc/53/99/83/1401539983.db2.gz XMTQDZRCPYRNEI-ZYHOBAKYSA-N 1 3 347.478 2.661 10 0 EFAEHO C[NH+](C)CCC(=O)NC/C=C\CNCc1ccc(Cl)c(Cl)c1 ZINC001497675594 1401541645 /nfs/dbraw/zinc/54/16/45/1401541645.db2.gz SHGOTXXKHBSNEU-ARJAWSKDSA-N 1 3 344.286 2.707 10 0 EFAEHO O=C(NC/C=C\CNCc1ccsc1)C1CC[NH+](CC2CC2)CC1 ZINC001497722044 1401582711 /nfs/dbraw/zinc/58/27/11/1401582711.db2.gz IKTIQNCTROIRGB-UPHRSURJSA-N 1 3 347.528 2.632 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]C/C=C/CNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001497725275 1401586646 /nfs/dbraw/zinc/58/66/46/1401586646.db2.gz KLSVBTFNPUZLHX-SUVIQUNHSA-N 1 3 331.504 2.904 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C\C[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001497726619 1401587376 /nfs/dbraw/zinc/58/73/76/1401587376.db2.gz JIMREDKUUVOXES-TUYSUELWSA-N 1 3 337.895 2.751 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C/C[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001497726618 1401587448 /nfs/dbraw/zinc/58/74/48/1401587448.db2.gz JIMREDKUUVOXES-LXXRFIIISA-N 1 3 337.895 2.751 10 0 EFAEHO CC(C)N(C)CC(=O)NC/C=C/C[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001497765669 1401637020 /nfs/dbraw/zinc/63/70/20/1401637020.db2.gz SXFODWAQGMSOIE-WRFKIARRSA-N 1 3 349.906 2.930 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C)C[NH2+]CCCc1cccc(F)c1 ZINC001497816594 1401672880 /nfs/dbraw/zinc/67/28/80/1401672880.db2.gz VLNSFZZCUPIACG-APWZRJJASA-N 1 3 349.494 2.725 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+][C@H](C)c1cccc(Cl)c1)N(C)C ZINC001497835716 1401685883 /nfs/dbraw/zinc/68/58/83/1401685883.db2.gz JOLQFTOPTVIFMR-XJKCOSOUSA-N 1 3 325.884 2.836 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001497910681 1401734738 /nfs/dbraw/zinc/73/47/38/1401734738.db2.gz MEDNGGMMJJTWAN-FKUVRRMFSA-N 1 3 327.488 2.650 10 0 EFAEHO C[C@H](C[NH2+][C@@H]1CCc2ccccc21)NC(=O)CN(C)CC(C)(C)C ZINC001497910175 1401734945 /nfs/dbraw/zinc/73/49/45/1401734945.db2.gz HHGDRDKZAFOHGK-CRAIPNDOSA-N 1 3 331.504 2.746 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC001497992335 1401798772 /nfs/dbraw/zinc/79/87/72/1401798772.db2.gz DYPVNMIICPSTQG-GFCCVEGCSA-N 1 3 346.302 2.928 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CNCc2sccc2Cl)CC[N@@H+]1C ZINC001498045492 1401827261 /nfs/dbraw/zinc/82/72/61/1401827261.db2.gz XNQCWAOQORVEMY-SGMGOOAPSA-N 1 3 343.924 2.726 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CNCc2sccc2Cl)CC[N@H+]1C ZINC001498045492 1401827269 /nfs/dbraw/zinc/82/72/69/1401827269.db2.gz XNQCWAOQORVEMY-SGMGOOAPSA-N 1 3 343.924 2.726 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CCCc1ccccc1 ZINC001498131919 1401870887 /nfs/dbraw/zinc/87/08/87/1401870887.db2.gz FKRSNUFYQHGTCO-AZUAARDMSA-N 1 3 345.531 2.976 10 0 EFAEHO Cc1cc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)c(C)s1 ZINC001498287262 1401978227 /nfs/dbraw/zinc/97/82/27/1401978227.db2.gz FIKGPIZNWODATG-SUYBPPKGSA-N 1 3 337.533 2.642 10 0 EFAEHO Cc1cc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)c(C)s1 ZINC001498287262 1401978235 /nfs/dbraw/zinc/97/82/35/1401978235.db2.gz FIKGPIZNWODATG-SUYBPPKGSA-N 1 3 337.533 2.642 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)cc1 ZINC001498305692 1401993564 /nfs/dbraw/zinc/99/35/64/1401993564.db2.gz MIYBZGUAVBAWIF-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)cc1 ZINC001498305692 1401993567 /nfs/dbraw/zinc/99/35/67/1401993567.db2.gz MIYBZGUAVBAWIF-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCc1ccc(C[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001498381508 1402056501 /nfs/dbraw/zinc/05/65/01/1402056501.db2.gz PWMSSMXUGVMPRE-ROUUACIJSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(C[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001498381508 1402056506 /nfs/dbraw/zinc/05/65/06/1402056506.db2.gz PWMSSMXUGVMPRE-ROUUACIJSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(CN(C)C[C@H](C)NC(=O)C[C@@H]2CC[N@H+](C)C2)cc1 ZINC001498424984 1402090234 /nfs/dbraw/zinc/09/02/34/1402090234.db2.gz KTTLQGUKHRHPTA-PXNSSMCTSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(CN(C)C[C@H](C)NC(=O)C[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001498424984 1402090239 /nfs/dbraw/zinc/09/02/39/1402090239.db2.gz KTTLQGUKHRHPTA-PXNSSMCTSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(CN(C)C[C@@H](C)NC(=O)C[C@@H]2CC[N@H+](C)C2)cc1 ZINC001498424985 1402090681 /nfs/dbraw/zinc/09/06/81/1402090681.db2.gz KTTLQGUKHRHPTA-XLIONFOSSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(CN(C)C[C@@H](C)NC(=O)C[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001498424985 1402090685 /nfs/dbraw/zinc/09/06/85/1402090685.db2.gz KTTLQGUKHRHPTA-XLIONFOSSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@@H](CN(C)[C@@H]1CCc2ccc(F)cc21)NC(=O)CCCC[NH+](C)C ZINC001498426793 1402092602 /nfs/dbraw/zinc/09/26/02/1402092602.db2.gz DQMHMBMSQFYNOX-HNAYVOBHSA-N 1 3 349.494 2.981 10 0 EFAEHO C[C@H](CN(C)[C@@H]1CCc2ccc(F)cc21)NC(=O)CCCC[NH+](C)C ZINC001498426792 1402092908 /nfs/dbraw/zinc/09/29/08/1402092908.db2.gz DQMHMBMSQFYNOX-DNVCBOLYSA-N 1 3 349.494 2.981 10 0 EFAEHO C[C@H](CN(C)C/C=C\c1ccc(Cl)cc1)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001498450469 1402114074 /nfs/dbraw/zinc/11/40/74/1402114074.db2.gz PQWHMHGJIXGLNZ-BUZJKLBMSA-N 1 3 349.906 2.741 10 0 EFAEHO C[C@H](CN(C)C/C=C\c1ccc(Cl)cc1)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001498450469 1402114076 /nfs/dbraw/zinc/11/40/76/1402114076.db2.gz PQWHMHGJIXGLNZ-BUZJKLBMSA-N 1 3 349.906 2.741 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCCC[C@@H]1C[NH2+]CCC(F)(F)F ZINC001498505881 1402151503 /nfs/dbraw/zinc/15/15/03/1402151503.db2.gz UZZXZWDRZRCHPH-KGLIPLIRSA-N 1 3 337.430 2.544 10 0 EFAEHO CN(CCC[NH2+][C@@H]1CCc2c1cccc2F)C(=O)CN(C)C1CCC1 ZINC001498559573 1402175514 /nfs/dbraw/zinc/17/55/14/1402175514.db2.gz IXTAOVHYMAQIEN-LJQANCHMSA-N 1 3 347.478 2.735 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001498584065 1402185752 /nfs/dbraw/zinc/18/57/52/1402185752.db2.gz JEPSGKPRSHNXCH-LSDHHAIUSA-N 1 3 333.467 2.590 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001498611223 1402200316 /nfs/dbraw/zinc/20/03/16/1402200316.db2.gz VFLSBWKTPHDQOC-JKSUJKDBSA-N 1 3 347.494 2.836 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[NH2+]Cc1cc(C)ccc1F ZINC001498658431 1402232424 /nfs/dbraw/zinc/23/24/24/1402232424.db2.gz OOBOTRHMKYQDJT-IBGZPJMESA-N 1 3 349.494 2.947 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)C ZINC001508025086 1407245831 /nfs/dbraw/zinc/24/58/31/1407245831.db2.gz SYTJQODKZZYQRX-CABCVRRESA-N 1 3 331.520 2.833 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]C2(CNC(=O)CN(C)C3CCC3)CC2)c1 ZINC001499250968 1402538192 /nfs/dbraw/zinc/53/81/92/1402538192.db2.gz QEUKDZQHOHKPTI-MRXNPFEDSA-N 1 3 329.488 2.779 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001499616789 1402721990 /nfs/dbraw/zinc/72/19/90/1402721990.db2.gz UAGNFZSMAAMLHK-WHXUGTBJSA-N 1 3 335.536 2.999 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001499616789 1402721991 /nfs/dbraw/zinc/72/19/91/1402721991.db2.gz UAGNFZSMAAMLHK-WHXUGTBJSA-N 1 3 335.536 2.999 10 0 EFAEHO CC[C@H](F)CN1CC[C@]2(CCN(C(=O)CCC[NH+]3CCCC3)C2)C1 ZINC001499618622 1402722905 /nfs/dbraw/zinc/72/29/05/1402722905.db2.gz DZGJWPIMRWOQGU-HKUYNNGSSA-N 1 3 339.499 2.535 10 0 EFAEHO CC[NH2+]C[C@H](NC(=O)CN1CC[C@H](C)C1)c1ccc2ccccc2c1 ZINC001500060853 1402918307 /nfs/dbraw/zinc/91/83/07/1402918307.db2.gz WKGSSVLVTCSTER-JXFKEZNVSA-N 1 3 339.483 2.948 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C[NH2+]CCC1CC1)C1CCCC1 ZINC001500089083 1402933446 /nfs/dbraw/zinc/93/34/46/1402933446.db2.gz RXNKVFGIMKBMIZ-MOPGFXCFSA-N 1 3 335.536 2.924 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@]2(CC[N@H+](C[C@@H](F)CC)C2)C1 ZINC001500161376 1402962691 /nfs/dbraw/zinc/96/26/91/1402962691.db2.gz KVBASCSNLDIRPZ-HKUYNNGSSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@]2(CC[N@@H+](C[C@@H](F)CC)C2)C1 ZINC001500161376 1402962694 /nfs/dbraw/zinc/96/26/94/1402962694.db2.gz KVBASCSNLDIRPZ-HKUYNNGSSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCOc1cccc(CN2CC[C@@](C)(NC(=O)CC[NH+](C)C)C2)c1 ZINC001500259082 1403012691 /nfs/dbraw/zinc/01/26/91/1403012691.db2.gz ZTQHNXAIIPPIQU-HXUWFJFHSA-N 1 3 347.503 2.508 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N[C@]2(C)CCN(C/C=C/c3ccccc3)C2)C1 ZINC001500281210 1403028877 /nfs/dbraw/zinc/02/88/77/1403028877.db2.gz SICNBDJBTKVCIU-HHGHRULOSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N[C@]2(C)CCN(C/C=C/c3ccccc3)C2)C1 ZINC001500281210 1403028883 /nfs/dbraw/zinc/02/88/83/1403028883.db2.gz SICNBDJBTKVCIU-HHGHRULOSA-N 1 3 341.499 2.622 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@]1(C)CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001500405572 1403102114 /nfs/dbraw/zinc/10/21/14/1403102114.db2.gz ZEMHJQZQBOYPKN-OXJNMPFZSA-N 1 3 349.494 2.938 10 0 EFAEHO CC(C)CCC[NH+]1CCC(C)(CNC(=O)CN(C)C(C)C)CC1 ZINC001500465930 1403141180 /nfs/dbraw/zinc/14/11/80/1403141180.db2.gz MNZKDHRDTASAAT-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@]1(C)CCC[N@H+](CC2CCC2)C1 ZINC001500497810 1403171678 /nfs/dbraw/zinc/17/16/78/1403171678.db2.gz ASGFSCYEZHYCNY-QUCCMNQESA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@]1(C)CCC[N@@H+](CC2CCC2)C1 ZINC001500497810 1403171681 /nfs/dbraw/zinc/17/16/81/1403171681.db2.gz ASGFSCYEZHYCNY-QUCCMNQESA-N 1 3 335.536 2.879 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001500613676 1403248309 /nfs/dbraw/zinc/24/83/09/1403248309.db2.gz MLYJAHSUBYSPFA-APPUJDCNSA-N 1 3 345.478 2.756 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001500613676 1403248311 /nfs/dbraw/zinc/24/83/11/1403248311.db2.gz MLYJAHSUBYSPFA-APPUJDCNSA-N 1 3 345.478 2.756 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1C[N@H+](CCC(C)(C)C)CCC1(F)F ZINC001500617022 1403252027 /nfs/dbraw/zinc/25/20/27/1403252027.db2.gz OJNRRSOPPQVUEF-OAHLLOKOSA-N 1 3 347.494 2.838 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1C[N@@H+](CCC(C)(C)C)CCC1(F)F ZINC001500617022 1403252029 /nfs/dbraw/zinc/25/20/29/1403252029.db2.gz OJNRRSOPPQVUEF-OAHLLOKOSA-N 1 3 347.494 2.838 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CC3(CCC3)C1)C2 ZINC001501013744 1403404671 /nfs/dbraw/zinc/40/46/71/1403404671.db2.gz XLSARLCAMBWSED-WDSOQIARSA-N 1 3 347.547 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CC1CC3(CCC3)C1)C2 ZINC001501013744 1403404673 /nfs/dbraw/zinc/40/46/73/1403404673.db2.gz XLSARLCAMBWSED-WDSOQIARSA-N 1 3 347.547 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CC3(CCC3)C1)C2 ZINC001501013743 1403404715 /nfs/dbraw/zinc/40/47/15/1403404715.db2.gz XLSARLCAMBWSED-UHOSZYNNSA-N 1 3 347.547 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CC1CC3(CCC3)C1)C2 ZINC001501013743 1403404717 /nfs/dbraw/zinc/40/47/17/1403404717.db2.gz XLSARLCAMBWSED-UHOSZYNNSA-N 1 3 347.547 2.878 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C2CC[NH+](CC3CC3)CC2)C1 ZINC001501015560 1403405093 /nfs/dbraw/zinc/40/50/93/1403405093.db2.gz IJQKZOACYXFJJU-IBGZPJMESA-N 1 3 335.536 2.689 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001501091118 1403436711 /nfs/dbraw/zinc/43/67/11/1403436711.db2.gz LDZZJSKIHZYGJP-HKUYNNGSSA-N 1 3 331.504 2.662 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2ccc(C)c(F)c2)C1 ZINC001501150560 1403460479 /nfs/dbraw/zinc/46/04/79/1403460479.db2.gz ULGZPBKPPCGONN-WMZOPIPTSA-N 1 3 349.494 2.660 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2cccc(CC)c2)C1 ZINC001501150735 1403461357 /nfs/dbraw/zinc/46/13/57/1403461357.db2.gz XQYHDFSVVZRJML-FXAWDEMLSA-N 1 3 345.531 2.775 10 0 EFAEHO CC[C@H](C)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1(N(C)C)CCC1)C2 ZINC001501165932 1403469768 /nfs/dbraw/zinc/46/97/68/1403469768.db2.gz AVUOOSAZPRIQBD-FJIDUMEYSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@H](C)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1(N(C)C)CCC1)C2 ZINC001501165932 1403469772 /nfs/dbraw/zinc/46/97/72/1403469772.db2.gz AVUOOSAZPRIQBD-FJIDUMEYSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[NH2+]CCN(Cc1ccccc1)C(=O)C(C)(C)N1CCCCC1 ZINC001501193381 1403485640 /nfs/dbraw/zinc/48/56/40/1403485640.db2.gz ASEZOZUTZJTKEZ-UHFFFAOYSA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)[NH2+]CCN(Cc1ccccc1)C(=O)C(C)(C)N1CCCC1 ZINC001501198181 1403488396 /nfs/dbraw/zinc/48/83/96/1403488396.db2.gz YCSNRVZMCBQMRT-UHFFFAOYSA-N 1 3 331.504 2.888 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(F)cc1 ZINC001501403403 1403589959 /nfs/dbraw/zinc/58/99/59/1403589959.db2.gz IJQJAHVCPNHEJJ-OALUTQOASA-N 1 3 347.478 2.733 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(F)cc1 ZINC001501403403 1403589962 /nfs/dbraw/zinc/58/99/62/1403589962.db2.gz IJQJAHVCPNHEJJ-OALUTQOASA-N 1 3 347.478 2.733 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@@H](CC[NH2+]CCC3CC3)C2)c1 ZINC001501652298 1403668853 /nfs/dbraw/zinc/66/88/53/1403668853.db2.gz YWPFYBXCOGSHRR-GOSISDBHSA-N 1 3 343.515 2.990 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]CCc2cccs2)CCC1)N1CCCC1 ZINC001501988994 1403929579 /nfs/dbraw/zinc/92/95/79/1403929579.db2.gz TUNMNWINZZOOKT-UHFFFAOYSA-N 1 3 349.544 2.794 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)CC1 ZINC001502145550 1404044750 /nfs/dbraw/zinc/04/47/50/1404044750.db2.gz TZABRJMNIFITGY-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[N@@H+](C[C@H]2CCC(F)(F)C2)CC1 ZINC001502145550 1404044755 /nfs/dbraw/zinc/04/47/55/1404044755.db2.gz TZABRJMNIFITGY-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@@H](NC(=O)CC[NH+]2CCCCC2)CC1 ZINC001502147454 1404047192 /nfs/dbraw/zinc/04/71/92/1404047192.db2.gz JOPVPCFMUHKEGF-IAGOWNOFSA-N 1 3 327.488 2.581 10 0 EFAEHO CC(C)=CC[N@@H+](C)CCCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001502375765 1404115445 /nfs/dbraw/zinc/11/54/45/1404115445.db2.gz TXYNDEYRKAEPPM-IBGZPJMESA-N 1 3 341.515 2.945 10 0 EFAEHO CC(C)=CC[N@H+](C)CCCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001502375765 1404115454 /nfs/dbraw/zinc/11/54/54/1404115454.db2.gz TXYNDEYRKAEPPM-IBGZPJMESA-N 1 3 341.515 2.945 10 0 EFAEHO CCC1([NH2+]CC2CCCC2)CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001502505846 1404205041 /nfs/dbraw/zinc/20/50/41/1404205041.db2.gz ATJOVRXWZZEPRZ-KRWDZBQOSA-N 1 3 335.536 2.879 10 0 EFAEHO CCC1([NH2+]CCc2ccccc2)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001502508456 1404209159 /nfs/dbraw/zinc/20/91/59/1404209159.db2.gz WAANCLFFADQSRI-UHFFFAOYSA-N 1 3 340.471 2.556 10 0 EFAEHO CCC1([NH2+]Cc2ncccc2C)CCN(C(=O)CN(C)C(C)C)CC1 ZINC001502517872 1404214710 /nfs/dbraw/zinc/21/47/10/1404214710.db2.gz JQLQIBCGMOVZOQ-UHFFFAOYSA-N 1 3 346.519 2.591 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@]2(CCN(C[C@@H](F)CC)C2)C1 ZINC001502547810 1404238942 /nfs/dbraw/zinc/23/89/42/1404238942.db2.gz FTYSUNPMHYYFFP-PKOBYXMFSA-N 1 3 341.515 2.781 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@]2(CCN(C[C@@H](F)CC)C2)C1 ZINC001502547810 1404238945 /nfs/dbraw/zinc/23/89/45/1404238945.db2.gz FTYSUNPMHYYFFP-PKOBYXMFSA-N 1 3 341.515 2.781 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1[NH2+]CCC(C)(C)C ZINC001502741736 1404320008 /nfs/dbraw/zinc/32/00/08/1404320008.db2.gz KMWUKERLVNUWQV-CVEARBPZSA-N 1 3 325.541 2.837 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001502762063 1404331054 /nfs/dbraw/zinc/33/10/54/1404331054.db2.gz KBUUDRUGTQSGMV-QFBILLFUSA-N 1 3 331.504 2.526 10 0 EFAEHO CC[C@H](C)C[NH2+]C1(C)CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001502797710 1404349129 /nfs/dbraw/zinc/34/91/29/1404349129.db2.gz QRIRCPCVVVJTBD-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@@H+](CCCCCF)CC1(C)C)N(C)C ZINC001502835994 1404392046 /nfs/dbraw/zinc/39/20/46/1404392046.db2.gz GDBGHFMBBGUXCO-HOTGVXAUSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@H+](CCCCCF)CC1(C)C)N(C)C ZINC001502835994 1404392035 /nfs/dbraw/zinc/39/20/35/1404392035.db2.gz GDBGHFMBBGUXCO-HOTGVXAUSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[N@H+](C)[C@@H](C(=O)N[C@H]1CCN(CCF)CC1(C)C)c1ccccc1 ZINC001502835860 1404392328 /nfs/dbraw/zinc/39/23/28/1404392328.db2.gz CQFVQRNMAYOXLB-ZWKOTPCHSA-N 1 3 349.494 2.866 10 0 EFAEHO CC[N@@H+](C)[C@@H](C(=O)N[C@H]1CCN(CCF)CC1(C)C)c1ccccc1 ZINC001502835860 1404392330 /nfs/dbraw/zinc/39/23/30/1404392330.db2.gz CQFVQRNMAYOXLB-ZWKOTPCHSA-N 1 3 349.494 2.866 10 0 EFAEHO O=C([C@@H]1CC[N@@H+](C2CCCCC2)C1)N1CCCC[C@H]1CNCCF ZINC001505404780 1404561397 /nfs/dbraw/zinc/56/13/97/1404561397.db2.gz NSFLIETXBFRUBZ-AEFFLSMTSA-N 1 3 339.499 2.581 10 0 EFAEHO O=C([C@@H]1CC[N@H+](C2CCCCC2)C1)N1CCCC[C@H]1CNCCF ZINC001505404780 1404561404 /nfs/dbraw/zinc/56/14/04/1404561404.db2.gz NSFLIETXBFRUBZ-AEFFLSMTSA-N 1 3 339.499 2.581 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+](C)C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001505466393 1404693535 /nfs/dbraw/zinc/69/35/35/1404693535.db2.gz XVIINGSNSHEMIE-LJQANCHMSA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+](C)C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001505466393 1404693550 /nfs/dbraw/zinc/69/35/50/1404693550.db2.gz XVIINGSNSHEMIE-LJQANCHMSA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)CN(C)C3CCC3)C2)c(C)c1 ZINC001505501916 1404729491 /nfs/dbraw/zinc/72/94/91/1404729491.db2.gz POEXGTYVPDAMLE-UHFFFAOYSA-N 1 3 343.515 2.772 10 0 EFAEHO CN(C)C1(C(=O)NC2CC(C[NH2+]C/C=C\c3ccccc3)C2)CCC1 ZINC001505501758 1404729622 /nfs/dbraw/zinc/72/96/22/1404729622.db2.gz IMLZIULQRZLCBG-POHAHGRESA-N 1 3 341.499 2.669 10 0 EFAEHO C[C@@H](NCc1cc2ccccc2o1)[C@@H](C)NC(=O)C12CC[NH+](CC1)C2 ZINC001505733783 1404998403 /nfs/dbraw/zinc/99/84/03/1404998403.db2.gz YAPFRNMVHOPIPN-HUUCEWRRSA-N 1 3 341.455 2.511 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@H](C)[C@@H](C)NC(=O)Cc1nc[nH]c1C ZINC001505738514 1405006317 /nfs/dbraw/zinc/00/63/17/1405006317.db2.gz LIPDFHZYPRNYBT-HUUCEWRRSA-N 1 3 342.487 2.549 10 0 EFAEHO C[C@H](F)CC[NH2+]CC(C)(C)CN(C)C(=O)C(C)(C)N1CCCC1 ZINC001505828525 1405117067 /nfs/dbraw/zinc/11/70/67/1405117067.db2.gz VWRLPDJMVRMBAQ-HNNXBMFYSA-N 1 3 329.504 2.683 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)[C@@H](C)CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001505918528 1405222455 /nfs/dbraw/zinc/22/24/55/1405222455.db2.gz MVRUTODEMUFAMG-AZUAARDMSA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1ccc(CC[N@H+](C)[C@@H](C)CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001505918528 1405222463 /nfs/dbraw/zinc/22/24/63/1405222463.db2.gz MVRUTODEMUFAMG-AZUAARDMSA-N 1 3 345.531 2.847 10 0 EFAEHO CCc1cccc(CN(C)[C@H](C)CNC(=O)C[C@H]2CC[N@H+](C)C2)c1 ZINC001506037934 1405385726 /nfs/dbraw/zinc/38/57/26/1405385726.db2.gz CWNAQXIKMRLDQV-VQIMIIECSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(CN(C)[C@H](C)CNC(=O)C[C@H]2CC[N@@H+](C)C2)c1 ZINC001506037934 1405385734 /nfs/dbraw/zinc/38/57/34/1405385734.db2.gz CWNAQXIKMRLDQV-VQIMIIECSA-N 1 3 331.504 2.527 10 0 EFAEHO CC[C@@H](F)CN1CCCCC[C@@H]1CNC(=O)CC1CC[NH+](C)CC1 ZINC001506576600 1405992832 /nfs/dbraw/zinc/99/28/32/1405992832.db2.gz UCLIRPRSFYOCMS-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)Cc1ccc(CN2CC([C@H](C)NC(=O)CC[NH+](C)C)C2)cc1 ZINC001506647580 1406095713 /nfs/dbraw/zinc/09/57/13/1406095713.db2.gz BBYVIVJVUAMJAN-KRWDZBQOSA-N 1 3 345.531 2.773 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1C[NH+](CC/C=C/c2ccccc2)C1 ZINC001506676462 1406136038 /nfs/dbraw/zinc/13/60/38/1406136038.db2.gz AUCOWSQVVBNQCR-HCWHUNCVSA-N 1 3 343.515 2.867 10 0 EFAEHO CC[C@H](c1ccccc1)[NH+]1CC([C@@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001506678513 1406139860 /nfs/dbraw/zinc/13/98/60/1406139860.db2.gz JEENCNXPSILVBO-VQIMIIECSA-N 1 3 331.504 2.914 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CC[C@@H]([NH2+]CC3=CCCCC3)C2)CCC1 ZINC001565897978 1415445928 /nfs/dbraw/zinc/44/59/28/1415445928.db2.gz GGVRUKFAIFQFMJ-ZWKOTPCHSA-N 1 3 333.520 2.846 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H](C)[C@H]1CCC[NH2+]CC(C)C)N(C)C ZINC001565987032 1415470971 /nfs/dbraw/zinc/47/09/71/1415470971.db2.gz YMSYQLRJBZSBPS-FGTMMUONSA-N 1 3 325.541 2.980 10 0 EFAEHO CC/C=C\CC[N@H+](C)C[C@@H]1CCCCN1C(=O)CN1CC[C@@H](C)C1 ZINC001566124497 1415522826 /nfs/dbraw/zinc/52/28/26/1415522826.db2.gz VQDZKIOEOMIUQR-WYNBNGFRSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](C)C[C@@H]1CCCCN1C(=O)CN1CC[C@@H](C)C1 ZINC001566124497 1415522831 /nfs/dbraw/zinc/52/28/31/1415522831.db2.gz VQDZKIOEOMIUQR-WYNBNGFRSA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@H+](C)CCCNC(=O)CN(C)C1CCC1 ZINC001566461015 1415560270 /nfs/dbraw/zinc/56/02/70/1415560270.db2.gz KVQVSSWYGDIUKY-KRWDZBQOSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@@H+](C)CCCNC(=O)CN(C)C1CCC1 ZINC001566461015 1415560273 /nfs/dbraw/zinc/56/02/73/1415560273.db2.gz KVQVSSWYGDIUKY-KRWDZBQOSA-N 1 3 331.504 2.978 10 0 EFAEHO CN(CC(=O)NCCC[N@H+](C)[C@H]1CCc2ccc(F)cc21)C1CCC1 ZINC001566462589 1415561212 /nfs/dbraw/zinc/56/12/12/1415561212.db2.gz ZEQMLYDUDLRQBK-IBGZPJMESA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CC(=O)NCCC[N@@H+](C)[C@H]1CCc2ccc(F)cc21)C1CCC1 ZINC001566462589 1415561216 /nfs/dbraw/zinc/56/12/16/1415561216.db2.gz ZEQMLYDUDLRQBK-IBGZPJMESA-N 1 3 347.478 2.735 10 0 EFAEHO CC/C=C/CC[NH+]1CCC(N(C)C(=O)CN2CCC(C)CC2)CC1 ZINC001566614101 1415696247 /nfs/dbraw/zinc/69/62/47/1415696247.db2.gz ZVQYJYUNOAKCDK-AATRIKPKSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC1CC[NH+](C)CC1 ZINC001566755993 1415764262 /nfs/dbraw/zinc/76/42/62/1415764262.db2.gz YTBUBYPBXASCBW-DHAGBVFISA-N 1 3 333.520 2.750 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)C1 ZINC001566792937 1415777127 /nfs/dbraw/zinc/77/71/27/1415777127.db2.gz DAASPNVLTGQZDC-WGSAOQKQSA-N 1 3 343.515 2.649 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1C[C@H](NC(=O)CN2CC[C@@H](C)C2)C1 ZINC001566803772 1415780603 /nfs/dbraw/zinc/78/06/03/1415780603.db2.gz MUHCAOOTQSWUFY-NSISKUIASA-N 1 3 343.515 2.506 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001566811164 1415782827 /nfs/dbraw/zinc/78/28/27/1415782827.db2.gz OMASIOWXEIGYPR-VAMGGRTRSA-N 1 3 345.531 2.751 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@H]1CCCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001566893920 1415828360 /nfs/dbraw/zinc/82/83/60/1415828360.db2.gz RGGQNNJSYMKDPF-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](C[NH2+]CCC2CCCCCC2)C1 ZINC001567117320 1415938220 /nfs/dbraw/zinc/93/82/20/1415938220.db2.gz YJAZSQWGSLBNSU-OALUTQOASA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](C[NH2+]CCCC3CCCC3)C2)C1 ZINC001567141187 1415949679 /nfs/dbraw/zinc/94/96/79/1415949679.db2.gz WTRWNZBVJOEYHJ-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](C[NH2+]CCCC3CCCC3)C2)C1 ZINC001567141190 1415949779 /nfs/dbraw/zinc/94/97/79/1415949779.db2.gz WTRWNZBVJOEYHJ-PKOBYXMFSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)C[NH2+]CCc1ccc(CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001567182050 1415976108 /nfs/dbraw/zinc/97/61/08/1415976108.db2.gz YPLDXHVXFQCYCI-HXUWFJFHSA-N 1 3 345.531 2.964 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001567516165 1416169974 /nfs/dbraw/zinc/16/99/74/1416169974.db2.gz KLLZLIPHSKVJPQ-MOPGFXCFSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001567516165 1416169977 /nfs/dbraw/zinc/16/99/77/1416169977.db2.gz KLLZLIPHSKVJPQ-MOPGFXCFSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1cccc(Cl)c1CNCCN(C)C(=O)C12CCC[NH+]1CCC2 ZINC001567525168 1416173128 /nfs/dbraw/zinc/17/31/28/1416173128.db2.gz YFOIZBHWRPOFSZ-UHFFFAOYSA-N 1 3 349.906 2.825 10 0 EFAEHO Cc1ccc(C[NH2+]CCN(C)C(=O)CN(C)CC(C)(C)C)cc1F ZINC001567561586 1416187875 /nfs/dbraw/zinc/18/78/75/1416187875.db2.gz VHWFBTKADFDOJW-UHFFFAOYSA-N 1 3 337.483 2.660 10 0 EFAEHO Cc1cccc(Cl)c1CNCCN(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001567591004 1416200292 /nfs/dbraw/zinc/20/02/92/1416200292.db2.gz SQYIMWKLVAONAF-HNNXBMFYSA-N 1 3 337.895 2.538 10 0 EFAEHO Cc1cccc(Cl)c1CNCCN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001567591004 1416200295 /nfs/dbraw/zinc/20/02/95/1416200295.db2.gz SQYIMWKLVAONAF-HNNXBMFYSA-N 1 3 337.895 2.538 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N(C)CCNCc1ccc(Cl)s1 ZINC001567611139 1416209143 /nfs/dbraw/zinc/20/91/43/1416209143.db2.gz VYRHDDAJKNJYQA-BETUJISGSA-N 1 3 343.924 2.822 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N(C)CCNCc1ccc(Cl)s1 ZINC001567611139 1416209146 /nfs/dbraw/zinc/20/91/46/1416209146.db2.gz VYRHDDAJKNJYQA-BETUJISGSA-N 1 3 343.924 2.822 10 0 EFAEHO CCc1ccc(C[NH2+]CCN(C)C(=O)[C@@H]2CCCCN2CC)cc1 ZINC001567611466 1416209725 /nfs/dbraw/zinc/20/97/25/1416209725.db2.gz IAIZNFNXGOVHLD-IBGZPJMESA-N 1 3 331.504 2.671 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001567611850 1416209861 /nfs/dbraw/zinc/20/98/61/1416209861.db2.gz XDKGRRGYCQSXDW-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO CCc1ccc(CC[NH2+]CCN(C)C(=O)[C@@H]2CCCCN2CC)cc1 ZINC001567611817 1416210070 /nfs/dbraw/zinc/21/00/70/1416210070.db2.gz WEBZWGZADIINON-FQEVSTJZSA-N 1 3 345.531 2.714 10 0 EFAEHO CCC[N@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001567648838 1416227725 /nfs/dbraw/zinc/22/77/25/1416227725.db2.gz JJCUZBMGKQFOFJ-SFHVURJKSA-N 1 3 329.504 2.826 10 0 EFAEHO CCC[N@@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001567648838 1416227726 /nfs/dbraw/zinc/22/77/26/1416227726.db2.gz JJCUZBMGKQFOFJ-SFHVURJKSA-N 1 3 329.504 2.826 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)CN1CC[C@@H](C)C1)CC1CC(C)(C)C1 ZINC001567649628 1416228963 /nfs/dbraw/zinc/22/89/63/1416228963.db2.gz YMPGLHIAQUHEQQ-QGZVFWFLSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)CN1CC[C@@H](C)C1)CC1CC(C)(C)C1 ZINC001567649628 1416228966 /nfs/dbraw/zinc/22/89/66/1416228966.db2.gz YMPGLHIAQUHEQQ-QGZVFWFLSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N(C)[C@H]1CC[N@H+](CCCCCF)C1 ZINC001567921569 1416323861 /nfs/dbraw/zinc/32/38/61/1416323861.db2.gz AWVNOHIRLRMLLV-ZWKOTPCHSA-N 1 3 341.515 2.922 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N(C)[C@H]1CC[N@@H+](CCCCCF)C1 ZINC001567921569 1416323865 /nfs/dbraw/zinc/32/38/65/1416323865.db2.gz AWVNOHIRLRMLLV-ZWKOTPCHSA-N 1 3 341.515 2.922 10 0 EFAEHO CCN(C(=O)[C@H]1CC[N@H+](C)C1)[C@@H]1CCN(CCCCC(F)(F)F)C1 ZINC001567944962 1416338780 /nfs/dbraw/zinc/33/87/80/1416338780.db2.gz FFNVBHKCPVRKAQ-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(C(=O)[C@H]1CC[N@@H+](C)C1)[C@@H]1CCN(CCCCC(F)(F)F)C1 ZINC001567944962 1416338786 /nfs/dbraw/zinc/33/87/86/1416338786.db2.gz FFNVBHKCPVRKAQ-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(CC[NH2+]Cc2ccsc2)CC1 ZINC001568080945 1416400890 /nfs/dbraw/zinc/40/08/90/1416400890.db2.gz NGCLAQRRGCTGJU-KRWDZBQOSA-N 1 3 335.517 2.561 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC(CC[NH2+]CC2CCCC2)CC1)N(C)C ZINC001568087768 1416404349 /nfs/dbraw/zinc/40/43/49/1416404349.db2.gz NCJPSIZGOLMXDW-IBGZPJMESA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[C@H]([NH2+]CCCc2ccccc2)CC1)N(C)C ZINC001568112501 1416414264 /nfs/dbraw/zinc/41/42/64/1416414264.db2.gz AEUPTYFVSTWQTL-UFYCRDLUSA-N 1 3 345.531 2.976 10 0 EFAEHO CCCCC[N@@H+]1CCC2(C1)CCN(C(=O)C1(N(C)C)CCC1)CC2 ZINC001568155666 1416428315 /nfs/dbraw/zinc/42/83/15/1416428315.db2.gz XNNSNVXJYLTTGO-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCC[N@H+]1CCC2(C1)CCN(C(=O)C1(N(C)C)CCC1)CC2 ZINC001568155666 1416428319 /nfs/dbraw/zinc/42/83/19/1416428319.db2.gz XNNSNVXJYLTTGO-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]CC[C@H]1CCCC1(F)F ZINC001568320338 1416475564 /nfs/dbraw/zinc/47/55/64/1416475564.db2.gz FXUQDMQCISEIOM-LSDHHAIUSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N[C@H](CNCCF)C1CCCCC1 ZINC001568343997 1416484616 /nfs/dbraw/zinc/48/46/16/1416484616.db2.gz UVSPKOKOONWBAE-QZTJIDSGSA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N[C@H](CNCCF)C1CCCCC1 ZINC001568343997 1416484617 /nfs/dbraw/zinc/48/46/17/1416484617.db2.gz UVSPKOKOONWBAE-QZTJIDSGSA-N 1 3 341.515 2.731 10 0 EFAEHO C[C@@H]([NH2+]CCCF)[C@@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001568416978 1416523819 /nfs/dbraw/zinc/52/38/19/1416523819.db2.gz QPAZWOHKFWPFDS-VQIMIIECSA-N 1 3 349.494 2.938 10 0 EFAEHO CC(C)CCC[NH2+][C@@H](C)[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001568417265 1416524287 /nfs/dbraw/zinc/52/42/87/1416524287.db2.gz UUNVLYDXNVTROC-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]CCCC(C)(C)C ZINC001568461787 1416539310 /nfs/dbraw/zinc/53/93/10/1416539310.db2.gz DLKYYRGABODPFU-IRXDYDNUSA-N 1 3 325.541 2.885 10 0 EFAEHO CCN(CC[NH2+]Cc1ncc(C)s1)C(=O)C1CCCC(F)C1 ZINC001568742314 1416545239 /nfs/dbraw/zinc/54/52/39/1416545239.db2.gz QCMJVYCYMHLYCR-UONOGXRCSA-N 1 3 327.469 2.918 10 0 EFAEHO CC[N@H+](CCCNC(=O)NCCN1CCCCC1)C1CCCCC1 ZINC001686968020 1416823844 /nfs/dbraw/zinc/82/38/44/1416823844.db2.gz HWPZVQCUWAKVOZ-UHFFFAOYSA-N 1 3 338.540 2.816 10 0 EFAEHO CC[N@@H+](CCCNC(=O)NCCN1CCCCC1)C1CCCCC1 ZINC001686968020 1416823847 /nfs/dbraw/zinc/82/38/47/1416823847.db2.gz HWPZVQCUWAKVOZ-UHFFFAOYSA-N 1 3 338.540 2.816 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]CCCC3CCC3)C2)C1 ZINC001689003109 1417011040 /nfs/dbraw/zinc/01/10/40/1417011040.db2.gz NVXADFYBDMXSLV-NZSAHSFTSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]([NH2+]CCC1=CCCCC1)C1CC1 ZINC001690178133 1417170382 /nfs/dbraw/zinc/17/03/82/1417170382.db2.gz LKWSRQGTQSIMFG-SFHVURJKSA-N 1 3 330.476 2.636 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1=CCCCC1)N(C)C ZINC001690312303 1417188273 /nfs/dbraw/zinc/18/82/73/1417188273.db2.gz LMFZCMKAQMMERS-IPQPSQTFSA-N 1 3 333.520 2.939 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1=CCCCC1)N(C)C ZINC001690312303 1417188276 /nfs/dbraw/zinc/18/82/76/1417188276.db2.gz LMFZCMKAQMMERS-IPQPSQTFSA-N 1 3 333.520 2.939 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@H]1CCC[N@@H+]1Cc1ccsc1)N(C)C ZINC001690901474 1417245423 /nfs/dbraw/zinc/24/54/23/1417245423.db2.gz HPLFAWXLHUPJBW-DLBZAZTESA-N 1 3 337.533 2.949 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@H]1CCC[N@H+]1Cc1ccsc1)N(C)C ZINC001690901474 1417245425 /nfs/dbraw/zinc/24/54/25/1417245425.db2.gz HPLFAWXLHUPJBW-DLBZAZTESA-N 1 3 337.533 2.949 10 0 EFAEHO CC/C=C/CC[N@H+](C)CC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001692014388 1417252869 /nfs/dbraw/zinc/25/28/69/1417252869.db2.gz VEHMQGYNWCPPJZ-AATRIKPKSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](C)CC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001692014388 1417252872 /nfs/dbraw/zinc/25/28/72/1417252872.db2.gz VEHMQGYNWCPPJZ-AATRIKPKSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@H](NC(=O)C23CCCN2CCC3)[C@H]1C ZINC001692374906 1417281947 /nfs/dbraw/zinc/28/19/47/1417281947.db2.gz BXVRCFYFVZYFEC-WIJVFFIESA-N 1 3 333.520 2.940 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@H](NC(=O)C23CCCN2CCC3)[C@H]1C ZINC001692374906 1417281949 /nfs/dbraw/zinc/28/19/49/1417281949.db2.gz BXVRCFYFVZYFEC-WIJVFFIESA-N 1 3 333.520 2.940 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2CC[N@H+](CCCCCF)C2)c1 ZINC001698549315 1417301416 /nfs/dbraw/zinc/30/14/16/1417301416.db2.gz SOFVOQHCSRTYDQ-SFHVURJKSA-N 1 3 335.467 2.692 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2CC[N@@H+](CCCCCF)C2)c1 ZINC001698549315 1417301423 /nfs/dbraw/zinc/30/14/23/1417301423.db2.gz SOFVOQHCSRTYDQ-SFHVURJKSA-N 1 3 335.467 2.692 10 0 EFAEHO C[C@H](C[NH2+]CC/C=C\c1ccccc1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001698845773 1417339013 /nfs/dbraw/zinc/33/90/13/1417339013.db2.gz OLKCIWYNMIMLJF-OFIWPEFUSA-N 1 3 343.515 2.868 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc2cc[nH]c2c1)C(=O)CN(C)C1CCC1 ZINC001699186534 1417411817 /nfs/dbraw/zinc/41/18/17/1417411817.db2.gz XFQXUECBGUVPAU-UHFFFAOYSA-N 1 3 342.487 2.590 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@@H]2CCN(C(=O)C3(N(C)C)CCC3)C2)c1 ZINC001700069047 1417551245 /nfs/dbraw/zinc/55/12/45/1417551245.db2.gz ZATUUTJUDXKFSO-GOSISDBHSA-N 1 3 343.515 2.808 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(C)c(C)c2)C1 ZINC001700088211 1417561187 /nfs/dbraw/zinc/56/11/87/1417561187.db2.gz RNWVWXZFUZOKJP-LJQANCHMSA-N 1 3 345.531 2.973 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[C@H](C[NH2+]CCC2CC2)CC1)N1CCCC1 ZINC001700102301 1417571628 /nfs/dbraw/zinc/57/16/28/1417571628.db2.gz KPWLAVDJTPKEIE-IYARVYRRSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)(C(=O)N1C[C@@H]([NH2+]CCCCCF)C(C)(C)C1)N1CCCC1 ZINC001700919901 1417689005 /nfs/dbraw/zinc/68/90/05/1417689005.db2.gz OFJBZJBXBSVDPT-MRXNPFEDSA-N 1 3 341.515 2.827 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NCCCN(C)Cc2ccsc2)C1 ZINC001707398923 1418239025 /nfs/dbraw/zinc/23/90/25/1418239025.db2.gz BCMFUEFFVWXIFV-KRWDZBQOSA-N 1 3 337.533 2.808 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NCCCN(C)Cc2ccsc2)C1 ZINC001707398923 1418239033 /nfs/dbraw/zinc/23/90/33/1418239033.db2.gz BCMFUEFFVWXIFV-KRWDZBQOSA-N 1 3 337.533 2.808 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC001713221391 1418393827 /nfs/dbraw/zinc/39/38/27/1418393827.db2.gz IAYVBLWCSGTWBH-GOSISDBHSA-N 1 3 349.494 2.886 10 0 EFAEHO CCC/C=C\CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1C(C)C ZINC001713281575 1418450884 /nfs/dbraw/zinc/45/08/84/1418450884.db2.gz PTVXGVSIPYWHGK-QOQCFQCMSA-N 1 3 333.520 2.652 10 0 EFAEHO CCC/C=C\CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1C(C)C ZINC001713281575 1418450888 /nfs/dbraw/zinc/45/08/88/1418450888.db2.gz PTVXGVSIPYWHGK-QOQCFQCMSA-N 1 3 333.520 2.652 10 0 EFAEHO CCC/C=C\CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H]1CCCN1C(C)C ZINC001713281576 1418451091 /nfs/dbraw/zinc/45/10/91/1418451091.db2.gz PTVXGVSIPYWHGK-UVRFHUFISA-N 1 3 333.520 2.652 10 0 EFAEHO CCC/C=C\CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H]1CCCN1C(C)C ZINC001713281576 1418451096 /nfs/dbraw/zinc/45/10/96/1418451096.db2.gz PTVXGVSIPYWHGK-UVRFHUFISA-N 1 3 333.520 2.652 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](C[NH2+]CCCc2ccsc2)C1)C1CCC1 ZINC001713344049 1418482747 /nfs/dbraw/zinc/48/27/47/1418482747.db2.gz HDUFQXGEGYGWTP-KRWDZBQOSA-N 1 3 349.544 2.603 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]CC[C@H]2CCCC2(F)F)C1 ZINC001713366245 1418494029 /nfs/dbraw/zinc/49/40/29/1418494029.db2.gz ZJXHHUMWTMGPPM-HZPDHXFCSA-N 1 3 345.478 2.590 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H]([N@H+](C)CCCCCF)C1 ZINC001713400942 1418507586 /nfs/dbraw/zinc/50/75/86/1418507586.db2.gz MEIFORPQJIYUHG-ZWKOTPCHSA-N 1 3 341.515 2.923 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H]([N@@H+](C)CCCCCF)C1 ZINC001713400942 1418507587 /nfs/dbraw/zinc/50/75/87/1418507587.db2.gz MEIFORPQJIYUHG-ZWKOTPCHSA-N 1 3 341.515 2.923 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[C@H]1CCC[N@@H+]1CCCF ZINC001713442165 1418538463 /nfs/dbraw/zinc/53/84/63/1418538463.db2.gz HYDISLIQFQICPN-IRXDYDNUSA-N 1 3 327.488 2.581 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[C@H]1CCC[N@H+]1CCCF ZINC001713442165 1418538464 /nfs/dbraw/zinc/53/84/64/1418538464.db2.gz HYDISLIQFQICPN-IRXDYDNUSA-N 1 3 327.488 2.581 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H](CC[NH2+]Cc3ccccc3)C2)C1 ZINC001714224988 1418589766 /nfs/dbraw/zinc/58/97/66/1418589766.db2.gz KAINBZNZENEVQX-QUCCMNQESA-N 1 3 343.515 2.747 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H](CC[NH2+]Cc3ccccc3)C2)C1 ZINC001714224986 1418589980 /nfs/dbraw/zinc/58/99/80/1418589980.db2.gz KAINBZNZENEVQX-ICSRJNTNSA-N 1 3 343.515 2.747 10 0 EFAEHO C[C@@H]1CCCC[C@@]1(C[NH2+]CCCF)NC(=O)CN(C)CC(C)(C)C ZINC001715141631 1418653517 /nfs/dbraw/zinc/65/35/17/1418653517.db2.gz ILGSBVDVSJEMJV-APWZRJJASA-N 1 3 343.531 2.979 10 0 EFAEHO C[C@H]1CCCC[C@]1(C[NH2+]CCCF)NC(=O)CN(C)CC(C)(C)C ZINC001715141635 1418653666 /nfs/dbraw/zinc/65/36/66/1418653666.db2.gz ILGSBVDVSJEMJV-QFBILLFUSA-N 1 3 343.531 2.979 10 0 EFAEHO CCC/C=C\CC[NH+]1CC2(C1)CCN(C(=O)CN(C)C(C)C)CC2 ZINC001715316571 1418663170 /nfs/dbraw/zinc/66/31/70/1418663170.db2.gz JPMBNHURCRYHIJ-FPLPWBNLSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/C[NH2+][C@H]1CCc2c1cccc2F)N(C)C ZINC001715831174 1418685131 /nfs/dbraw/zinc/68/51/31/1418685131.db2.gz XMTQDZRCPYRNEI-WLMAVBAVSA-N 1 3 347.478 2.661 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)cs1 ZINC001715833109 1418686233 /nfs/dbraw/zinc/68/62/33/1418686233.db2.gz LEAWBRGNQZDRKB-GUDHTMSVSA-N 1 3 347.528 2.835 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)cs1 ZINC001715833109 1418686235 /nfs/dbraw/zinc/68/62/35/1418686235.db2.gz LEAWBRGNQZDRKB-GUDHTMSVSA-N 1 3 347.528 2.835 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC[C@@H](C)NC(=O)[C@@H](C(C)C)N(C)C ZINC001716172756 1418712249 /nfs/dbraw/zinc/71/22/49/1418712249.db2.gz UPTGQLVDXCUQFW-IEBWSBKVSA-N 1 3 333.520 2.874 10 0 EFAEHO CC(C)c1cccc(C[NH2+]CC[C@@H](C)NC(=O)CN2CC[C@H](C)C2)n1 ZINC001716174588 1418713552 /nfs/dbraw/zinc/71/35/52/1418713552.db2.gz VCVYQSSEPMEQQD-DLBZAZTESA-N 1 3 346.519 2.531 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CC[C@H](C)NC(=O)[C@H](C(C)C)N(C)C)c1 ZINC001716189173 1418718917 /nfs/dbraw/zinc/71/89/17/1418718917.db2.gz UVCNWCYXTOUMKR-YJBOKZPZSA-N 1 3 337.483 2.705 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(C)ccc1C)C(=O)CN1CCC(C)CC1 ZINC001716245804 1418737295 /nfs/dbraw/zinc/73/72/95/1418737295.db2.gz OOZJUDJWBHXRKK-UHFFFAOYSA-N 1 3 345.531 2.973 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)c(F)c1)C(=O)[C@H]1CCCCN1CC ZINC001716255981 1418742928 /nfs/dbraw/zinc/74/29/28/1418742928.db2.gz LFDKWCNZPHYFBK-LJQANCHMSA-N 1 3 349.494 2.947 10 0 EFAEHO C[C@H](NC/C=C\CNC(=O)CC[NH+](C)C)c1ccc(F)c(Cl)c1 ZINC001716339873 1418784944 /nfs/dbraw/zinc/78/49/44/1418784944.db2.gz OKOVGMHQGOFGFC-ZFDPJTLLSA-N 1 3 341.858 2.754 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C\C[NH2+][C@@H]1CCc2c1cccc2Cl)N(C)C ZINC001716344164 1418787906 /nfs/dbraw/zinc/78/79/06/1418787906.db2.gz RAENWQTXZNFZPG-WIJVFFIESA-N 1 3 349.906 2.930 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C/C=C\CNC(=O)CN1CCC(C)CC1 ZINC001716356886 1418797244 /nfs/dbraw/zinc/79/72/44/1418797244.db2.gz BSCQBHQGGSXHEL-ARJAWSKDSA-N 1 3 347.478 2.628 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)C[NH+]2[C@H](C)CC[C@H]2C)cs1 ZINC001716378584 1418860568 /nfs/dbraw/zinc/86/05/68/1418860568.db2.gz JSBHBOVEQBXKHE-DPOFCPOHSA-N 1 3 335.517 2.691 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCCC[C@@H]1C[NH2+]C/C=C/Cl)CC(C)(C)C ZINC001716518702 1418904740 /nfs/dbraw/zinc/90/47/40/1418904740.db2.gz RROWHYXCFKIQQZ-XKQHDHNFSA-N 1 3 343.943 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC001716586942 1418919172 /nfs/dbraw/zinc/91/91/72/1418919172.db2.gz LKZCILQDTPFJRN-GOSISDBHSA-N 1 3 345.531 2.570 10 0 EFAEHO CCCCC[NH2+]C[C@@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001716620992 1418927297 /nfs/dbraw/zinc/92/72/97/1418927297.db2.gz CKFYLWWAWZDXRI-VQIMIIECSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C[NH2+]CCC(F)(F)F)C1CC1 ZINC001716624009 1418928151 /nfs/dbraw/zinc/92/81/51/1418928151.db2.gz NBPOBIYYOIQMLR-HUUCEWRRSA-N 1 3 349.441 2.686 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCN1CCC1=CCCCC1 ZINC001716654077 1418942593 /nfs/dbraw/zinc/94/25/93/1418942593.db2.gz VDPZOSIOGBKLPY-MOPGFXCFSA-N 1 3 333.520 2.942 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCN1CCC1=CCCCC1 ZINC001716654077 1418942598 /nfs/dbraw/zinc/94/25/98/1418942598.db2.gz VDPZOSIOGBKLPY-MOPGFXCFSA-N 1 3 333.520 2.942 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC[C@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001716723448 1418973953 /nfs/dbraw/zinc/97/39/53/1418973953.db2.gz ILUHVAWTMFCSQT-LLHWWHOWSA-N 1 3 330.476 2.623 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC[C@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001716723448 1418973958 /nfs/dbraw/zinc/97/39/58/1418973958.db2.gz ILUHVAWTMFCSQT-LLHWWHOWSA-N 1 3 330.476 2.623 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC[C@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001716724304 1418975343 /nfs/dbraw/zinc/97/53/43/1418975343.db2.gz ZFXUVWDXZNYTNA-YJJPMGAVSA-N 1 3 335.536 2.999 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC[C@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001716724304 1418975344 /nfs/dbraw/zinc/97/53/44/1418975344.db2.gz ZFXUVWDXZNYTNA-YJJPMGAVSA-N 1 3 335.536 2.999 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@]3(CC[N@H+](CCCCCF)C3)C2)CCC1 ZINC001716732244 1418982008 /nfs/dbraw/zinc/98/20/08/1418982008.db2.gz UHMZEMUCMMAAII-GOSISDBHSA-N 1 3 339.499 2.535 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@]3(CC[N@@H+](CCCCCF)C3)C2)CCC1 ZINC001716732244 1418982010 /nfs/dbraw/zinc/98/20/10/1418982010.db2.gz UHMZEMUCMMAAII-GOSISDBHSA-N 1 3 339.499 2.535 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@H]1C[NH2+]CCCc1ccccc1)N(C)C ZINC001716780734 1419005022 /nfs/dbraw/zinc/00/50/22/1419005022.db2.gz VRKSFQRZRBDGKP-PMACEKPBSA-N 1 3 345.531 2.786 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@H]1CNCc1ccccc1F ZINC001716788593 1419009062 /nfs/dbraw/zinc/00/90/62/1419009062.db2.gz NIXDIEJXVKBXFN-KRWDZBQOSA-N 1 3 335.467 2.638 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC[C@](C)(CNC(=O)Cc2nc[nH]c2C)C1 ZINC001716901279 1419086792 /nfs/dbraw/zinc/08/67/92/1419086792.db2.gz FHRDBSDYPLROKZ-SFFCAUCYSA-N 1 3 332.492 2.835 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC[C@](C)(CNC(=O)Cc2nc[nH]c2C)C1 ZINC001716901279 1419086796 /nfs/dbraw/zinc/08/67/96/1419086796.db2.gz FHRDBSDYPLROKZ-SFFCAUCYSA-N 1 3 332.492 2.835 10 0 EFAEHO C[C@@H]1CN(C(=O)CN2CCC(C)CC2)C[C@@H]1C[NH2+]CCC1CCCC1 ZINC001716992157 1419129428 /nfs/dbraw/zinc/12/94/28/1419129428.db2.gz MVPBKKHKRIGBCL-QUCCMNQESA-N 1 3 349.563 2.983 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[N@H+](CCCCCF)CC2)CCC1 ZINC001717195281 1419257211 /nfs/dbraw/zinc/25/72/11/1419257211.db2.gz GPMWIJZDYSDAEO-INIZCTEOSA-N 1 3 327.488 2.581 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[N@@H+](CCCCCF)CC2)CCC1 ZINC001717195281 1419257215 /nfs/dbraw/zinc/25/72/15/1419257215.db2.gz GPMWIJZDYSDAEO-INIZCTEOSA-N 1 3 327.488 2.581 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H]1CCC[N@H+](CCCCCF)CC1 ZINC001717195728 1419257486 /nfs/dbraw/zinc/25/74/86/1419257486.db2.gz OXNCHGVZFLRVJF-ZWKOTPCHSA-N 1 3 341.515 2.971 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H]1CCC[N@@H+](CCCCCF)CC1 ZINC001717195728 1419257489 /nfs/dbraw/zinc/25/74/89/1419257489.db2.gz OXNCHGVZFLRVJF-ZWKOTPCHSA-N 1 3 341.515 2.971 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N[C@@H]1CCCN(C/C=C/Cl)CC1 ZINC001717203586 1419265164 /nfs/dbraw/zinc/26/51/64/1419265164.db2.gz YDVSMWDOXQGCKN-DKISHCGFSA-N 1 3 341.927 2.976 10 0 EFAEHO CC/C=C\CCN1Cc2ccccc2C[C@H]1CNC(=O)CC[NH+](C)C ZINC001717243814 1419286020 /nfs/dbraw/zinc/28/60/20/1419286020.db2.gz LVEYBIWNUXZMFG-PRPIBZDOSA-N 1 3 343.515 2.838 10 0 EFAEHO CC(C)CN1Cc2ccccc2C[C@@H]1CNC(=O)CCCC[NH+](C)C ZINC001717245244 1419287916 /nfs/dbraw/zinc/28/79/16/1419287916.db2.gz PLZCSFYEOIEOFY-HXUWFJFHSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@@H]1[NH2+]CCCc1ccsc1 ZINC001717279677 1419304505 /nfs/dbraw/zinc/30/45/05/1419304505.db2.gz MTVGWAFTVMQEON-WBVHZDCISA-N 1 3 349.544 2.602 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@H]1C[N@H+](C)CCCCC(F)(F)F ZINC001717369245 1419362336 /nfs/dbraw/zinc/36/23/36/1419362336.db2.gz KESZVGOMKHVIJC-LSDHHAIUSA-N 1 3 349.441 2.736 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@H]1C[N@@H+](C)CCCCC(F)(F)F ZINC001717369245 1419362340 /nfs/dbraw/zinc/36/23/40/1419362340.db2.gz KESZVGOMKHVIJC-LSDHHAIUSA-N 1 3 349.441 2.736 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC2CC(C[NH2+]CCC3=CCCCC3)C2)C1 ZINC001717390082 1419375753 /nfs/dbraw/zinc/37/57/53/1419375753.db2.gz LUNPMZAAYZYDRA-IPJUCJBFSA-N 1 3 333.520 2.703 10 0 EFAEHO CC(C)=CC[NH2+]CC1CC(NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001717394779 1419376888 /nfs/dbraw/zinc/37/68/88/1419376888.db2.gz UKKBODRARJRMAV-UHFFFAOYSA-N 1 3 329.488 2.812 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H](C)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001717412789 1419384048 /nfs/dbraw/zinc/38/40/48/1419384048.db2.gz KTCFSENTWMABJE-ROUUACIJSA-N 1 3 345.531 2.895 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C1CCC([NH2+]CCCF)CC1 ZINC001717449883 1419399467 /nfs/dbraw/zinc/39/94/67/1419399467.db2.gz RLORIAJDUKGYGG-JCYILVPMSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N(C)CC(C)(C)C[NH2+]C/C=C/Cl ZINC001717459578 1419402725 /nfs/dbraw/zinc/40/27/25/1419402725.db2.gz HMBFCMZJJOLRQL-VOTDVEDPSA-N 1 3 329.916 2.686 10 0 EFAEHO C[C@H](CNC(=O)CCCC[NH+](C)C)N(C)[C@H]1CCc2c1cccc2F ZINC001717494795 1419416791 /nfs/dbraw/zinc/41/67/91/1419416791.db2.gz MBGPGYWKWXHIGW-BEFAXECRSA-N 1 3 349.494 2.981 10 0 EFAEHO C[C@@H](CCC[NH2+]Cc1cccc(F)c1)NC(=O)CN1CC[C@H](C)C1 ZINC001717684422 1419504799 /nfs/dbraw/zinc/50/47/99/1419504799.db2.gz MHESQOAFTSXGCV-HOTGVXAUSA-N 1 3 335.467 2.542 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C[NH2+]CCc1cccs1)C(C)(C)C)N(C)C ZINC001717971887 1419635265 /nfs/dbraw/zinc/63/52/65/1419635265.db2.gz VELJKFKFQLTHEH-HOTGVXAUSA-N 1 3 339.549 2.751 10 0 EFAEHO CCCCC[NH+]1CCC([C@@H](C)NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001717980480 1419640352 /nfs/dbraw/zinc/64/03/52/1419640352.db2.gz YYIQCKBTPASARX-SJLPKXTDSA-N 1 3 325.541 2.980 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC=C(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001718022395 1419661962 /nfs/dbraw/zinc/66/19/62/1419661962.db2.gz SSFYRJROVXOXFK-VOTSOKGWSA-N 1 3 333.520 2.965 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC=C(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001718022395 1419661965 /nfs/dbraw/zinc/66/19/65/1419661965.db2.gz SSFYRJROVXOXFK-VOTSOKGWSA-N 1 3 333.520 2.965 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[NH2+][C@@H]2CCc3ccccc32)CCC1 ZINC001723040962 1424408730 /nfs/dbraw/zinc/40/87/30/1424408730.db2.gz ZFFLPUWHJAZYFH-GOSISDBHSA-N 1 3 329.488 2.596 10 0 EFAEHO C[C@@H](C(=O)N[C@H](C[NH2+]CCC(F)(F)F)C1CC1)N1CCCCCC1 ZINC001723334661 1424470195 /nfs/dbraw/zinc/47/01/95/1424470195.db2.gz RSQKOWHGSKIJFC-DZGCQCFKSA-N 1 3 349.441 2.688 10 0 EFAEHO CCC/C=C\CC[NH2+][C@@H]1CCN(C(=O)Cc2c[nH]cn2)C[C@H]1CC ZINC001723380410 1424481088 /nfs/dbraw/zinc/48/10/88/1424481088.db2.gz YOWAMRIVTVULAD-MYOVTOPRSA-N 1 3 332.492 2.915 10 0 EFAEHO CC(C)=CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)CN(C)C1CCC1 ZINC001723614876 1424536720 /nfs/dbraw/zinc/53/67/20/1424536720.db2.gz PEOMUHAZDXHMDT-JLYLLQBASA-N 1 3 333.520 2.939 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CC[C@@]2(CCN(Cc3ccsc3)C2)C1 ZINC001723727448 1424571110 /nfs/dbraw/zinc/57/11/10/1424571110.db2.gz RXGIXZJUDOKSIJ-LJQANCHMSA-N 1 3 349.544 2.904 10 0 EFAEHO CCCC[NH2+]C[C@@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001723939967 1424611783 /nfs/dbraw/zinc/61/17/83/1424611783.db2.gz NEFHHMRXVSNGMD-MAUKXSAKSA-N 1 3 327.488 2.580 10 0 EFAEHO Cc1cc(CN2CC[C@@](C)(NC(=O)CCCC[NH+](C)C)C2)cs1 ZINC001724184629 1424692448 /nfs/dbraw/zinc/69/24/48/1424692448.db2.gz UAOOHORSVIOSKH-GOSISDBHSA-N 1 3 337.533 2.869 10 0 EFAEHO C[C@H](C(=O)N(CCNCCF)Cc1ccccc1)[NH+]1CCCCCC1 ZINC001724616579 1424840584 /nfs/dbraw/zinc/84/05/84/1424840584.db2.gz GGQNIZATEBECKN-GOSISDBHSA-N 1 3 349.494 2.839 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](CC[NH2+]Cc2ccc(F)cc2)C1)N(C)C ZINC001724713043 1424931760 /nfs/dbraw/zinc/93/17/60/1424931760.db2.gz UTSJKQVTXQQQKY-HKUYNNGSSA-N 1 3 349.494 2.740 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H](CC[NH2+]CC3CCCC3)C2)CC1 ZINC001724728744 1424950120 /nfs/dbraw/zinc/95/01/20/1424950120.db2.gz NZMAPSYGXQKQAT-IBGZPJMESA-N 1 3 335.536 2.737 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H](CC[NH2+]Cc3ccsc3)C2)CC1 ZINC001724731554 1424954725 /nfs/dbraw/zinc/95/47/25/1424954725.db2.gz XWEGDEOBVJOFPP-KRWDZBQOSA-N 1 3 349.544 2.808 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]CC2=CCCCC2)CCC1)N1CCCC1 ZINC001724794978 1425018409 /nfs/dbraw/zinc/01/84/09/1425018409.db2.gz RGEWWHLVZQPLDF-UHFFFAOYSA-N 1 3 333.520 2.990 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([C@H]2CC[N@H+](CC=C(C)C)C2)C1 ZINC001725054973 1425265153 /nfs/dbraw/zinc/26/51/53/1425265153.db2.gz CKEDZWYYFWFPGB-MOPGFXCFSA-N 1 3 335.536 2.855 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([C@H]2CC[N@@H+](CC=C(C)C)C2)C1 ZINC001725054973 1425265157 /nfs/dbraw/zinc/26/51/57/1425265157.db2.gz CKEDZWYYFWFPGB-MOPGFXCFSA-N 1 3 335.536 2.855 10 0 EFAEHO CC(C)[C@H](C(=O)NC1CC(C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001725075123 1425284261 /nfs/dbraw/zinc/28/42/61/1425284261.db2.gz QTPYTAIZOKXZIH-QMEOEDOASA-N 1 3 343.515 2.770 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H](C)[NH2+]CCCc1ccccc1C ZINC001725132095 1425321955 /nfs/dbraw/zinc/32/19/55/1425321955.db2.gz RZQBLJOHPXLESI-HOTGVXAUSA-N 1 3 342.487 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3=CCCCC3)C[C@H]21 ZINC001725314753 1425461909 /nfs/dbraw/zinc/46/19/09/1425461909.db2.gz GIXAGUFQNDUZKA-LDLYASANSA-N 1 3 333.520 2.511 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3=CCCCC3)C[C@H]21 ZINC001725314753 1425461912 /nfs/dbraw/zinc/46/19/12/1425461912.db2.gz GIXAGUFQNDUZKA-LDLYASANSA-N 1 3 333.520 2.511 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CCCc2ccccc2)CN1C(=O)CN(C)C1CCC1 ZINC001725606051 1425694325 /nfs/dbraw/zinc/69/43/25/1425694325.db2.gz YCYCQHSMEYODCG-HKUYNNGSSA-N 1 3 343.515 2.683 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@]12CCC[C@@H]1[N@H+](CC=C(C)C)CC2 ZINC001725608689 1425698317 /nfs/dbraw/zinc/69/83/17/1425698317.db2.gz MMBNRBJYZDTDHK-LNLFQRSKSA-N 1 3 339.499 2.746 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@]12CCC[C@@H]1[N@@H+](CC=C(C)C)CC2 ZINC001725608689 1425698321 /nfs/dbraw/zinc/69/83/21/1425698321.db2.gz MMBNRBJYZDTDHK-LNLFQRSKSA-N 1 3 339.499 2.746 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)[C@@H]1C ZINC001725610752 1425701983 /nfs/dbraw/zinc/70/19/83/1425701983.db2.gz YBUIIDAULADABA-UYAOXDASSA-N 1 3 345.531 2.847 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C[NH2+]CCCF)C(C)(C)C ZINC001725752733 1425819478 /nfs/dbraw/zinc/81/94/78/1425819478.db2.gz YZYLCCKZAJMMOK-CVEARBPZSA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)=CC[NH+]1CCC(C2(NC(=O)CN3CC[C@H](C)C3)CC2)CC1 ZINC001725794607 1425857589 /nfs/dbraw/zinc/85/75/89/1425857589.db2.gz NCTWQFARZJSOKN-KRWDZBQOSA-N 1 3 333.520 2.655 10 0 EFAEHO CC(C)=CC[NH+]1CCC(C2(NC(=O)CN3CC[C@@H](C)C3)CC2)CC1 ZINC001725794608 1425857759 /nfs/dbraw/zinc/85/77/59/1425857759.db2.gz NCTWQFARZJSOKN-QGZVFWFLSA-N 1 3 333.520 2.655 10 0 EFAEHO CC/C=C\CC[N@H+]1CC=C(CNC(=O)[C@@H]2CCCCN2CC)CC1 ZINC001725828572 1425893497 /nfs/dbraw/zinc/89/34/97/1425893497.db2.gz FPENBAFXDYKHOT-VOFKWLDRSA-N 1 3 333.520 2.965 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC=C(CNC(=O)[C@@H]2CCCCN2CC)CC1 ZINC001725828572 1425893505 /nfs/dbraw/zinc/89/35/05/1425893505.db2.gz FPENBAFXDYKHOT-VOFKWLDRSA-N 1 3 333.520 2.965 10 0 EFAEHO CC/C=C\CC[N@H+]1CC=C(CNC(=O)[C@H]2CCCCN2CC)CC1 ZINC001725828570 1425893629 /nfs/dbraw/zinc/89/36/29/1425893629.db2.gz FPENBAFXDYKHOT-SFFCAUCYSA-N 1 3 333.520 2.965 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC=C(CNC(=O)[C@H]2CCCCN2CC)CC1 ZINC001725828570 1425893633 /nfs/dbraw/zinc/89/36/33/1425893633.db2.gz FPENBAFXDYKHOT-SFFCAUCYSA-N 1 3 333.520 2.965 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](C)CC2CCC(C)(C)CC2)C1 ZINC001731267950 1426361478 /nfs/dbraw/zinc/36/14/78/1426361478.db2.gz ZKQCCXAHVLDYKN-QGZVFWFLSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](C)CC2CCC(C)(C)CC2)C1 ZINC001731267950 1426361481 /nfs/dbraw/zinc/36/14/81/1426361481.db2.gz ZKQCCXAHVLDYKN-QGZVFWFLSA-N 1 3 337.552 2.983 10 0 EFAEHO COc1ccc(CCNC(=[NH2+])NCCN(C)C2CCCCC2)cc1 ZINC000066244733 713080677 /nfs/dbraw/zinc/08/06/77/713080677.db2.gz PEMFDGITBHXEKS-UHFFFAOYSA-N 1 3 332.492 2.616 10 0 EFAEHO C[C@@H]1CN(Cc2cc(Br)cc3c2OCC3)C[C@H]1CC[NH3+] ZINC000723902901 715006935 /nfs/dbraw/zinc/00/69/35/715006935.db2.gz QJRZDZWCYZCKPI-DGCLKSJQSA-N 1 3 339.277 2.801 10 0 EFAEHO C[C@H](NCCN1CCC([NH3+])CC1)c1ccc(F)cc1OC(F)F ZINC000925814581 718877624 /nfs/dbraw/zinc/87/76/24/718877624.db2.gz JZEWMFXSRQXQEG-NSHDSACASA-N 1 3 331.382 2.501 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@H]1CCC[C@@H](C(F)(F)F)O1 ZINC000925835241 719520754 /nfs/dbraw/zinc/52/07/54/719520754.db2.gz QYMUQCKULGMKOG-XEGUGMAKSA-N 1 3 331.382 2.999 10 0 EFAEHO CCOC(=O)C1([C@H](C)NCc2c(F)cc(C)cc2F)CC[NH2+]CC1 ZINC000925873813 719932087 /nfs/dbraw/zinc/93/20/87/719932087.db2.gz DLLYLTNVDUWALJ-ZDUSSCGKSA-N 1 3 340.414 2.684 10 0 EFAEHO CCN1CCC2(CC1)C[N@@H+](C1CCOCC1)Cc1ccccc1O2 ZINC000257189921 720068644 /nfs/dbraw/zinc/06/86/44/720068644.db2.gz OEHNLQMLNMUIAS-UHFFFAOYSA-N 1 3 330.472 2.915 10 0 EFAEHO CCN1CCC2(CC1)C[N@H+](C1CCOCC1)Cc1ccccc1O2 ZINC000257189921 720068649 /nfs/dbraw/zinc/06/86/49/720068649.db2.gz OEHNLQMLNMUIAS-UHFFFAOYSA-N 1 3 330.472 2.915 10 0 EFAEHO CC1(C)C[C@@H]([NH3+])C[C@H](NC[C@H](O)c2cccc(Br)c2)C1 ZINC000925661116 720818809 /nfs/dbraw/zinc/81/88/09/720818809.db2.gz SJLFJOVHQARHQV-KKUMJFAQSA-N 1 3 341.293 2.978 10 0 EFAEHO CC1(C)C[C@H]([NH3+])C[C@@H](N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)C1 ZINC000925675615 720866124 /nfs/dbraw/zinc/86/61/24/720866124.db2.gz XAEUXIXTMKACGV-MGPQQGTHSA-N 1 3 349.441 2.816 10 0 EFAEHO Cc1noc2ncc(CNCc3ccc(OCC[NH+](C)C)cc3)cc12 ZINC000894190353 721188935 /nfs/dbraw/zinc/18/89/35/721188935.db2.gz OGDOCHOWXIIGER-UHFFFAOYSA-N 1 3 340.427 2.761 10 0 EFAEHO Cc1noc2ncc(C[NH2+]CCCCN3C[C@@H](C)O[C@@H](C)C3)cc12 ZINC000894299924 722004975 /nfs/dbraw/zinc/00/49/75/722004975.db2.gz RUMOHXKVEIBZII-OKILXGFUSA-N 1 3 332.448 2.510 10 0 EFAEHO CCO[C@@H]1C[C@H](N[C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)[C@@H]1OC ZINC000894467185 722747489 /nfs/dbraw/zinc/74/74/89/722747489.db2.gz XKLPJODYKKDNOX-FITZOCOBSA-N 1 3 344.499 2.822 10 0 EFAEHO CCO[C@@H]1C[C@H](N[C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)[C@@H]1OC ZINC000894467185 722747491 /nfs/dbraw/zinc/74/74/91/722747491.db2.gz XKLPJODYKKDNOX-FITZOCOBSA-N 1 3 344.499 2.822 10 0 EFAEHO COc1ccc([C@H](NC(C)C)C(=O)N(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000896621874 723410649 /nfs/dbraw/zinc/41/06/49/723410649.db2.gz BVDXNZOURJKIET-IEZWGBDMSA-N 1 3 347.503 2.675 10 0 EFAEHO COc1ccc([C@H](NC(C)C)C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000896621874 723410651 /nfs/dbraw/zinc/41/06/51/723410651.db2.gz BVDXNZOURJKIET-IEZWGBDMSA-N 1 3 347.503 2.675 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@H]1CC[N@H+](C)[C@@H]1C)c1ccsc1 ZINC000914065815 725996316 /nfs/dbraw/zinc/99/63/16/725996316.db2.gz GHLOBOCRYDMLPZ-VNQPRFMTSA-N 1 3 338.521 2.523 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@H]1CC[N@@H+](C)[C@@H]1C)c1ccsc1 ZINC000914065815 725996317 /nfs/dbraw/zinc/99/63/17/725996317.db2.gz GHLOBOCRYDMLPZ-VNQPRFMTSA-N 1 3 338.521 2.523 10 0 EFAEHO CC[C@@H]1C[N@H+](C)CCCN1C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000907931236 727048584 /nfs/dbraw/zinc/04/85/84/727048584.db2.gz SKXDQHLMHPDYRC-QGZVFWFLSA-N 1 3 328.460 2.847 10 0 EFAEHO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000907931236 727048586 /nfs/dbraw/zinc/04/85/86/727048586.db2.gz SKXDQHLMHPDYRC-QGZVFWFLSA-N 1 3 328.460 2.847 10 0 EFAEHO CN(CCCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21)Cc1ccco1 ZINC000908184307 727124848 /nfs/dbraw/zinc/12/48/48/727124848.db2.gz XRJOIYQPAMPAOK-WMZOPIPTSA-N 1 3 333.476 2.577 10 0 EFAEHO CN(CCCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21)Cc1ccco1 ZINC000908184307 727124852 /nfs/dbraw/zinc/12/48/52/727124852.db2.gz XRJOIYQPAMPAOK-WMZOPIPTSA-N 1 3 333.476 2.577 10 0 EFAEHO CC(C)Cc1ccc([C@@H](CNC(=O)C23CC[NH+](CC2)C3)N(C)C)cc1 ZINC000908220875 727129248 /nfs/dbraw/zinc/12/92/48/727129248.db2.gz RWQQSFPNKKUCJJ-LJQANCHMSA-N 1 3 343.515 2.700 10 0 EFAEHO CN(CC[NH+]1CCCCC1)C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000911919897 727618348 /nfs/dbraw/zinc/61/83/48/727618348.db2.gz FLFLOQARHVBFOC-UHFFFAOYSA-N 1 3 328.460 2.849 10 0 EFAEHO C[C@]1(NC(=O)c2ccc(NC3=NCCC3)cc2)C[NH+]2CCC1CC2 ZINC000912374158 727702964 /nfs/dbraw/zinc/70/29/64/727702964.db2.gz KZVFCLSZZQJEJY-IBGZPJMESA-N 1 3 326.444 2.505 10 0 EFAEHO C[C@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000913099545 727782087 /nfs/dbraw/zinc/78/20/87/727782087.db2.gz MZSVFQBJGHRXME-QGZVKYPTSA-N 1 3 343.515 2.744 10 0 EFAEHO C[C@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000913099545 727782089 /nfs/dbraw/zinc/78/20/89/727782089.db2.gz MZSVFQBJGHRXME-QGZVKYPTSA-N 1 3 343.515 2.744 10 0 EFAEHO CC(C)Oc1ccc(CN2CCC3(C[N@H+](C)C[C@H]3CO)CC2)cc1 ZINC000169783963 728402036 /nfs/dbraw/zinc/40/20/36/728402036.db2.gz JQSXMJPPOPWCHO-SFHVURJKSA-N 1 3 332.488 2.610 10 0 EFAEHO CC(C)Oc1ccc(CN2CCC3(C[N@@H+](C)C[C@H]3CO)CC2)cc1 ZINC000169783963 728402039 /nfs/dbraw/zinc/40/20/39/728402039.db2.gz JQSXMJPPOPWCHO-SFHVURJKSA-N 1 3 332.488 2.610 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C[NH2+]CCC(C)(C)C)C1CCCC1 ZINC001569614657 1085440137 /nfs/dbraw/zinc/44/01/37/1085440137.db2.gz ZCTNYCFLGKBGJJ-QGZVFWFLSA-N 1 3 334.508 2.961 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@@]2(C1)CCCCN(C(=O)CN(C)C(C)C)C2 ZINC001569623850 1085452549 /nfs/dbraw/zinc/45/25/49/1085452549.db2.gz BPOAXIDYHKLAMB-HXUWFJFHSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@@]2(C1)CCCCN(C(=O)CN(C)C(C)C)C2 ZINC001569623850 1085452552 /nfs/dbraw/zinc/45/25/52/1085452552.db2.gz BPOAXIDYHKLAMB-HXUWFJFHSA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1ccc(CN2CC[C@](C)(NC(=O)CCCC[NH+](C)C)C2)cc1 ZINC001569651381 1085484173 /nfs/dbraw/zinc/48/41/73/1085484173.db2.gz QDUUSSOGYROVOX-FQEVSTJZSA-N 1 3 331.504 2.808 10 0 EFAEHO C[C@@H]([NH2+]CCCC1CCCC1)[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001569824781 1085644522 /nfs/dbraw/zinc/64/45/22/1085644522.db2.gz UCPFULJCBRERDD-IEBWSBKVSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H]1CN(C(=O)Cc2c[nH]cn2)C[C@@H]1C[NH2+]CCCC1CCCC1 ZINC001569849016 1085672611 /nfs/dbraw/zinc/67/26/11/1085672611.db2.gz RYYKJTISYZBYSX-RDJZCZTQSA-N 1 3 332.492 2.607 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001569864862 1085692040 /nfs/dbraw/zinc/69/20/40/1085692040.db2.gz LDDYZLSJVALOFP-GUDVDZBRSA-N 1 3 335.536 2.807 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[C@H](C[NH2+]C/C=C\Cl)CC1)N(C)C ZINC001569865968 1085692797 /nfs/dbraw/zinc/69/27/97/1085692797.db2.gz BTBCZMMJBMUWKZ-TWEFDCCFSA-N 1 3 343.943 2.837 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CC[C@H]2CCN(C(=O)[C@H]3CCCN3C)C2)c1 ZINC001569968487 1085796649 /nfs/dbraw/zinc/79/66/49/1085796649.db2.gz JNXITUODESNQDU-QFBILLFUSA-N 1 3 347.478 2.557 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CC[C@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)c1 ZINC001569968486 1085797029 /nfs/dbraw/zinc/79/70/29/1085797029.db2.gz JNXITUODESNQDU-LPHOPBHVSA-N 1 3 347.478 2.557 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CC[C@@H]2CCN(C(=O)[C@H]3CCCN3C)C2)c1 ZINC001569968488 1085797143 /nfs/dbraw/zinc/79/71/43/1085797143.db2.gz JNXITUODESNQDU-VQIMIIECSA-N 1 3 347.478 2.557 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](CC[NH2+]CC3CC4(CCC4)C3)C2)C1 ZINC001570004505 1085846999 /nfs/dbraw/zinc/84/69/99/1085846999.db2.gz KAXHKYFKDBJCHF-MSOLQXFVSA-N 1 3 347.547 2.737 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001570018277 1085865506 /nfs/dbraw/zinc/86/55/06/1085865506.db2.gz BFYRRRVUXHMDKL-LJQANCHMSA-N 1 3 343.515 2.727 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@@H](CC[NH2+]Cc2ccccc2)C1 ZINC001570021203 1085869005 /nfs/dbraw/zinc/86/90/05/1085869005.db2.gz CMTUUAFXLJDDER-UXHICEINSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[C@H](C[NH2+]C/C=C\Cl)CC1)N1CCCC1 ZINC001570042972 1085896639 /nfs/dbraw/zinc/89/66/39/1085896639.db2.gz BEEBEHWQZJQWFX-NGRBPPKXSA-N 1 3 341.927 2.878 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@]2(C1)CCCN(C(=O)CN(C)C(C)C)C2 ZINC001570274593 1086116099 /nfs/dbraw/zinc/11/60/99/1086116099.db2.gz HBYDHVLAVZUKRX-HCZHMGAMSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@]2(C1)CCCN(C(=O)CN(C)C(C)C)C2 ZINC001570274593 1086116108 /nfs/dbraw/zinc/11/61/08/1086116108.db2.gz HBYDHVLAVZUKRX-HCZHMGAMSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)CCCC[NH+](C)C)CCN1Cc1ccsc1 ZINC001570449066 1086250836 /nfs/dbraw/zinc/25/08/36/1086250836.db2.gz LVRORSNTPNZPPP-DOTOQJQBSA-N 1 3 337.533 2.949 10 0 EFAEHO CC(C)=CCN(C)C[C@H]1CCCN1C(=O)C12CCC[NH+](CCC1)C2 ZINC001570535131 1086326358 /nfs/dbraw/zinc/32/63/58/1086326358.db2.gz XLOIWJJCEWAQIK-GOSISDBHSA-N 1 3 333.520 2.751 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC1CC(C[NH2+]CC=C(Cl)Cl)C1 ZINC001570582529 1086381514 /nfs/dbraw/zinc/38/15/14/1086381514.db2.gz MBEJDIPNBDVAND-RUXDESIVSA-N 1 3 348.318 2.664 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N(C)CC(C)(C)C[NH2+]C/C=C/Cl ZINC001570674247 1086453802 /nfs/dbraw/zinc/45/38/02/1086453802.db2.gz VYDGAYODNGCHNT-HEWZJLJBSA-N 1 3 329.916 2.686 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CCCC2CCC2)C1 ZINC001571197636 1086675417 /nfs/dbraw/zinc/67/54/17/1086675417.db2.gz HCSWBRNBYWHJBF-GUDVDZBRSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(C[NH2+]CCC[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001571269773 1086693231 /nfs/dbraw/zinc/69/32/31/1086693231.db2.gz DIDADPRBZJHKFP-QGZVFWFLSA-N 1 3 331.504 2.854 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CCC[C@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001571308218 1086707593 /nfs/dbraw/zinc/70/75/93/1086707593.db2.gz LNULWTXSGYXVHF-RDJZCZTQSA-N 1 3 349.494 2.850 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)CCC[NH2+]Cc1cccnc1 ZINC001571315170 1086711905 /nfs/dbraw/zinc/71/19/05/1086711905.db2.gz SEWJSTJJXHIVDF-HKUYNNGSSA-N 1 3 346.519 2.719 10 0 EFAEHO CCCCC[NH2+][C@@H](C)CN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001571406196 1086790099 /nfs/dbraw/zinc/79/00/99/1086790099.db2.gz XBIZEPMPPXVWHB-MAUKXSAKSA-N 1 3 329.504 2.826 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H]1CCN(C(=O)CN2CCCC2)[C@@H]1C ZINC001571468022 1086843345 /nfs/dbraw/zinc/84/33/45/1086843345.db2.gz VYFVGJZXNRCYHY-UYAOXDASSA-N 1 3 343.515 2.602 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CC[C@@H](C[NH2+]CCCC(C)(C)C)C1 ZINC001571548416 1086952176 /nfs/dbraw/zinc/95/21/76/1086952176.db2.gz ODQMITGPUHPHRB-CVEARBPZSA-N 1 3 334.508 2.961 10 0 EFAEHO CCCCCC[NH2+][C@@H]1CN(C(=O)[C@@H](C(C)C)N(C)C)CC1(C)C ZINC001571563113 1086963608 /nfs/dbraw/zinc/96/36/08/1086963608.db2.gz CLIAJKPDDDZWEZ-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]CCCc2ccccc2C)C1)N(C)C ZINC001571658636 1087027300 /nfs/dbraw/zinc/02/73/00/1087027300.db2.gz GHGWNSJPYDGIDP-SOAGJPPSSA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1cccc(C[N@H+]2CC=C(CNC(=O)[C@@H](C(C)C)N(C)C)CC2)c1 ZINC001571694419 1087061374 /nfs/dbraw/zinc/06/13/74/1087061374.db2.gz HZZMBOFQRFBPDQ-HXUWFJFHSA-N 1 3 343.515 2.830 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC=C(CNC(=O)[C@@H](C(C)C)N(C)C)CC2)c1 ZINC001571694419 1087061378 /nfs/dbraw/zinc/06/13/78/1087061378.db2.gz HZZMBOFQRFBPDQ-HXUWFJFHSA-N 1 3 343.515 2.830 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](Cc2cc(C)cc(C)c2)CC1 ZINC001571698685 1087069750 /nfs/dbraw/zinc/06/97/50/1087069750.db2.gz NQLAUUDLJSJWKK-UHFFFAOYSA-N 1 3 343.515 2.894 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](Cc2cc(C)cc(C)c2)CC1 ZINC001571698685 1087069757 /nfs/dbraw/zinc/06/97/57/1087069757.db2.gz NQLAUUDLJSJWKK-UHFFFAOYSA-N 1 3 343.515 2.894 10 0 EFAEHO CCN(C(=O)C[NH2+]CC(C)C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC001647248399 1089162563 /nfs/dbraw/zinc/16/25/63/1089162563.db2.gz HPPVTDBZBNGBEJ-PKOBYXMFSA-N 1 3 331.504 2.916 10 0 EFAEHO C[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1=CCCCC1 ZINC001266971675 1092220760 /nfs/dbraw/zinc/22/07/60/1092220760.db2.gz NYTSWSFSOMXOOJ-HNAYVOBHSA-N 1 3 339.499 2.794 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](C[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001267067274 1092524542 /nfs/dbraw/zinc/52/45/42/1092524542.db2.gz OUZQFGIMCOJOES-IRXDYDNUSA-N 1 3 325.541 2.837 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@@H]1CCN(C(=O)[C@H](CC)N(C)C)C1 ZINC001267068013 1092526940 /nfs/dbraw/zinc/52/69/40/1092526940.db2.gz VTGFJPWKHAQJIP-PXNSSMCTSA-N 1 3 345.531 2.570 10 0 EFAEHO CCC[NH2+]CCc1ccc(CNC(=O)CN2[C@H](C)CC[C@@H]2C)cc1 ZINC001267098445 1092697172 /nfs/dbraw/zinc/69/71/72/1092697172.db2.gz QTYIAIXRRXURQU-CALCHBBNSA-N 1 3 331.504 2.718 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H]2CCC[C@H]3CCC[N@@H+]32)c(C)c1 ZINC001480923281 1093139846 /nfs/dbraw/zinc/13/98/46/1093139846.db2.gz RJGKQGAFMPQPGU-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H]2CCC[C@H]3CCC[N@H+]32)c(C)c1 ZINC001480923281 1093139848 /nfs/dbraw/zinc/13/98/48/1093139848.db2.gz RJGKQGAFMPQPGU-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H]2CCC[C@@H]3CCC[N@@H+]32)c(C)c1 ZINC001480923282 1093140368 /nfs/dbraw/zinc/14/03/68/1093140368.db2.gz RJGKQGAFMPQPGU-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H]2CCC[C@@H]3CCC[N@H+]32)c(C)c1 ZINC001480923282 1093140372 /nfs/dbraw/zinc/14/03/72/1093140372.db2.gz RJGKQGAFMPQPGU-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO CN(CC[NH2+]Cc1ccc(Cl)c(F)c1)C(=O)[C@@H]1CCCCN1C ZINC001267391134 1094468511 /nfs/dbraw/zinc/46/85/11/1094468511.db2.gz BJZHCERFPONGTO-INIZCTEOSA-N 1 3 341.858 2.511 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1C[C@H]2CC[C@@H](C1)N2CC1=CCCCC1 ZINC001267432144 1094517435 /nfs/dbraw/zinc/51/74/35/1094517435.db2.gz GXAFKGGQNLHHJR-KDURUIRLSA-N 1 3 333.520 2.894 10 0 EFAEHO Cc1c(C)c(C)c(C[NH2+]CCN(C)C(=O)Cc2c[nH]cn2)c(C)c1C ZINC001267434748 1094520952 /nfs/dbraw/zinc/52/09/52/1094520952.db2.gz OKAGGNRNPAWREQ-UHFFFAOYSA-N 1 3 342.487 2.743 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@H+](Cc2ccsc2)C1)CC(C)(C)C ZINC001481113000 1094619077 /nfs/dbraw/zinc/61/90/77/1094619077.db2.gz VEIPJEXCSWHAOF-OAHLLOKOSA-N 1 3 337.533 2.664 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[N@@H+](Cc2ccsc2)C1)CC(C)(C)C ZINC001481113000 1094619085 /nfs/dbraw/zinc/61/90/85/1094619085.db2.gz VEIPJEXCSWHAOF-OAHLLOKOSA-N 1 3 337.533 2.664 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]Cc1ccccc1C1CC1 ZINC001267473636 1094763519 /nfs/dbraw/zinc/76/35/19/1094763519.db2.gz HUGSMSOOPNYVRX-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CN(CCNC(=O)CCC[NH+]1CCCC1)Cc1ccc2cc[nH]c2c1 ZINC001480951367 1094796285 /nfs/dbraw/zinc/79/62/85/1094796285.db2.gz YWLBYZZZVSQJIY-UHFFFAOYSA-N 1 3 342.487 2.592 10 0 EFAEHO Cc1ccc(C[N@@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001481509575 1095006108 /nfs/dbraw/zinc/00/61/08/1095006108.db2.gz PSQWAICRKGZKFB-LJQANCHMSA-N 1 3 331.504 2.616 10 0 EFAEHO Cc1ccc(C[N@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001481509575 1095006114 /nfs/dbraw/zinc/00/61/14/1095006114.db2.gz PSQWAICRKGZKFB-LJQANCHMSA-N 1 3 331.504 2.616 10 0 EFAEHO CCC/C=C/CCN1CCC[C@H](NC(=O)C23CCC[NH+]2CCC3)C1 ZINC001481535658 1095175999 /nfs/dbraw/zinc/17/59/99/1095175999.db2.gz ILHYRPATFPMHFP-WRFKIARRSA-N 1 3 333.520 2.942 10 0 EFAEHO CCC/C=C\CCN1CCC[C@H](NC(=O)C23CCC[NH+]2CCC3)C1 ZINC001481535659 1095176153 /nfs/dbraw/zinc/17/61/53/1095176153.db2.gz ILHYRPATFPMHFP-XDXAGZTOSA-N 1 3 333.520 2.942 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]Cc1ccccc1F ZINC001268160508 1095589004 /nfs/dbraw/zinc/58/90/04/1095589004.db2.gz UEGZFSALSNDLQW-IEBWSBKVSA-N 1 3 347.478 2.781 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@H]1CC[NH2+]CC1CC(F)(F)C1)N(C)C ZINC001268159678 1095589048 /nfs/dbraw/zinc/58/90/48/1095589048.db2.gz CHMPGCNWQIBAHG-HOTGVXAUSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@@H]1CC[NH2+]CC1CC(F)(F)C1)N(C)C ZINC001268159677 1095589485 /nfs/dbraw/zinc/58/94/85/1095589485.db2.gz CHMPGCNWQIBAHG-CVEARBPZSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC[C@@H]1CCCCN1C(=O)CN1CCC(C)CC1 ZINC001268168288 1095853211 /nfs/dbraw/zinc/85/32/11/1095853211.db2.gz VOOAPIQSOLEIKQ-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CCC[C@@H]1CNC(=O)C(C)(C)N1CCCCC1 ZINC001481039592 1096107315 /nfs/dbraw/zinc/10/73/15/1096107315.db2.gz NMPUGZUWWRCXIZ-HZPDHXFCSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CCC[C@@H]1CNC(=O)C(C)(C)N1CCCCC1 ZINC001481039592 1096107318 /nfs/dbraw/zinc/10/73/18/1096107318.db2.gz NMPUGZUWWRCXIZ-HZPDHXFCSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CCC[C@H]1CNC(=O)C(C)(C)N1CCCCC1 ZINC001481039582 1096107546 /nfs/dbraw/zinc/10/75/46/1096107546.db2.gz NMPUGZUWWRCXIZ-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CCC[C@H]1CNC(=O)C(C)(C)N1CCCCC1 ZINC001481039582 1096107552 /nfs/dbraw/zinc/10/75/52/1096107552.db2.gz NMPUGZUWWRCXIZ-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)CC[C@@H]21 ZINC001268263798 1096200339 /nfs/dbraw/zinc/20/03/39/1096200339.db2.gz BZYCDWKMNCQNMM-UHDDOPSISA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)CC[C@@H]21 ZINC001268263798 1096200348 /nfs/dbraw/zinc/20/03/48/1096200348.db2.gz BZYCDWKMNCQNMM-UHDDOPSISA-N 1 3 347.547 2.997 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)NCC1CN([C@H]2CCc3ccccc32)C1 ZINC001481660912 1096258813 /nfs/dbraw/zinc/25/88/13/1096258813.db2.gz PJGHGFULTGBWOZ-FQEVSTJZSA-N 1 3 341.499 2.598 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001268372096 1096411204 /nfs/dbraw/zinc/41/12/04/1096411204.db2.gz BNTWFVYFYZKIOV-DOMZBBRYSA-N 1 3 345.940 2.972 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CC[C@@H](C)NC(=O)[C@H](C(C)C)N(C)C ZINC001268418577 1096567946 /nfs/dbraw/zinc/56/79/46/1096567946.db2.gz YMZRMVTWCCFZQY-QAPCUYQASA-N 1 3 337.483 2.705 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+]Cc1cccc2cccnc21 ZINC001268425438 1096577650 /nfs/dbraw/zinc/57/76/50/1096577650.db2.gz FRCMAGVWLQBVNT-INIZCTEOSA-N 1 3 342.487 2.559 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc2ccccc2c1)C(=O)[C@H]1CCCN1C ZINC001268440137 1096599263 /nfs/dbraw/zinc/59/92/63/1096599263.db2.gz XDGUIGGFJPEQTL-HXUWFJFHSA-N 1 3 339.483 2.872 10 0 EFAEHO CCN(CCNCc1ccc(Cl)s1)C(=O)[C@H](C(C)C)[NH+](C)C ZINC001268457562 1096716544 /nfs/dbraw/zinc/71/65/44/1096716544.db2.gz IFUARHOKLRLVMX-HNNXBMFYSA-N 1 3 345.940 2.926 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]CCc1ccccc1F ZINC001481811463 1096736967 /nfs/dbraw/zinc/73/69/67/1096736967.db2.gz SKAIBCLTLHFQON-IEBWSBKVSA-N 1 3 349.494 2.725 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc(F)cc1 ZINC001481838617 1096777163 /nfs/dbraw/zinc/77/71/63/1096777163.db2.gz DMEMVVIMVBIZTD-QGZVFWFLSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]Cc1ccccc1 ZINC001481849264 1096792250 /nfs/dbraw/zinc/79/22/50/1096792250.db2.gz CBHVVPOEHGXFDI-PXNSSMCTSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C[NH2+]Cc2ccc(F)cc2)CCCC1 ZINC001481913349 1096916379 /nfs/dbraw/zinc/91/63/79/1096916379.db2.gz SRNUBKGRPVGMRF-UHFFFAOYSA-N 1 3 335.467 2.685 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001268491159 1096959202 /nfs/dbraw/zinc/95/92/02/1096959202.db2.gz LIQOVKARJSRXLW-DLBZAZTESA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@@H](C(=O)N(CC)CC[NH2+]Cc1ccc2ncccc2c1)N(C)C ZINC001268492774 1096963267 /nfs/dbraw/zinc/96/32/67/1096963267.db2.gz NMRGVMSNBZJSCC-IBGZPJMESA-N 1 3 342.487 2.513 10 0 EFAEHO CCN(CC[NH2+]C[C@@H]1CCCC(F)(F)C1)C(=O)CN(C)C(C)C ZINC001268499057 1096994779 /nfs/dbraw/zinc/99/47/79/1096994779.db2.gz DZNYNQLDXQLUON-OAHLLOKOSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H](CC[NH2+]Cc2ccccc2)C1)N(C)C ZINC001481987785 1097044517 /nfs/dbraw/zinc/04/45/17/1097044517.db2.gz KZRGQFJKFNVDHH-OALUTQOASA-N 1 3 331.504 2.745 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001481990544 1097056051 /nfs/dbraw/zinc/05/60/51/1097056051.db2.gz ZWWWZHMHMBYSBO-QZTJIDSGSA-N 1 3 341.515 2.685 10 0 EFAEHO C[C@H]([NH2+]C/C=C\CNC(=O)[C@H]1CCCN1C)c1ccc2c(c1)CCC2 ZINC001268523476 1097127451 /nfs/dbraw/zinc/12/74/51/1097127451.db2.gz QWVLCTYIWSIVPZ-YAAATUCXSA-N 1 3 341.499 2.593 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/CNCc1ccc(Cl)s1)[NH+](C)C ZINC001268553056 1097181844 /nfs/dbraw/zinc/18/18/44/1097181844.db2.gz WGRMUBLIIWJQPW-NFAHFFEMSA-N 1 3 343.924 2.750 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC1CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001482051539 1097183952 /nfs/dbraw/zinc/18/39/52/1097183952.db2.gz FZUQACIRQNTJTH-HSALFYBXSA-N 1 3 349.563 2.981 10 0 EFAEHO CCCC[NH2+]C[C@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001482062966 1097210403 /nfs/dbraw/zinc/21/04/03/1097210403.db2.gz NEFHHMRXVSNGMD-QAPCUYQASA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]CC[C@H]1CCCC1(F)F ZINC001482107163 1097268147 /nfs/dbraw/zinc/26/81/47/1097268147.db2.gz FYBZEZNZTFHSEE-LSDHHAIUSA-N 1 3 345.478 2.638 10 0 EFAEHO C[C@H](NC/C=C/CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(F)c1 ZINC001268584367 1097290989 /nfs/dbraw/zinc/29/09/89/1097290989.db2.gz YTVFZASCFNKGNK-QOSFWDOTSA-N 1 3 347.478 2.879 10 0 EFAEHO C[C@H](NC/C=C/CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(F)c1 ZINC001268584367 1097290992 /nfs/dbraw/zinc/29/09/92/1097290992.db2.gz YTVFZASCFNKGNK-QOSFWDOTSA-N 1 3 347.478 2.879 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC/C=C\C[NH2+]CCC2CCCCCC2)C1 ZINC001268591787 1097315903 /nfs/dbraw/zinc/31/59/03/1097315903.db2.gz UHQSMOFOXAYOOU-MJRGOJFPSA-N 1 3 335.536 2.951 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C/C=C/CNC(=O)CN(C)CC(C)(C)C ZINC001268592209 1097316740 /nfs/dbraw/zinc/31/67/40/1097316740.db2.gz XRWUIXBIRYXMLX-VOTSOKGWSA-N 1 3 349.494 2.874 10 0 EFAEHO CCCCC[NH2+]C[C@@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001482141447 1097396149 /nfs/dbraw/zinc/39/61/49/1097396149.db2.gz DDPNJDUMVBKXKC-CRAIPNDOSA-N 1 3 329.504 2.731 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C\CNC(=O)CC1CC[NH+](C)CC1 ZINC001268598955 1097442123 /nfs/dbraw/zinc/44/21/23/1097442123.db2.gz ZHQLHJNBWDOVLK-ARJAWSKDSA-N 1 3 347.478 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+]Cc1cc2ccccc2o1 ZINC001482173411 1097442623 /nfs/dbraw/zinc/44/26/23/1097442623.db2.gz LGYMHXFNSJAPBE-OAHLLOKOSA-N 1 3 331.460 2.615 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C/C=C\CNC(=O)CN1CCC(C)CC1 ZINC001268607897 1097454882 /nfs/dbraw/zinc/45/48/82/1097454882.db2.gz KFQLNLKORISLKE-ARJAWSKDSA-N 1 3 347.478 2.628 10 0 EFAEHO Cc1cc(Cl)ccc1CNC/C=C\CNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001268612621 1097461659 /nfs/dbraw/zinc/46/16/59/1097461659.db2.gz GXCXXANCAJGHMU-QGZUEGPWSA-N 1 3 349.906 2.752 10 0 EFAEHO Cc1cc(Cl)ccc1CNC/C=C\CNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001268612621 1097461662 /nfs/dbraw/zinc/46/16/62/1097461662.db2.gz GXCXXANCAJGHMU-QGZUEGPWSA-N 1 3 349.906 2.752 10 0 EFAEHO Cc1cc(C[NH2+]C/C=C\CNC(=O)[C@H](C(C)C)N(C)C)c(C)s1 ZINC001268618490 1097469115 /nfs/dbraw/zinc/46/91/15/1097469115.db2.gz WRSOEIKHJSKXTG-QWPQOLDESA-N 1 3 337.533 2.713 10 0 EFAEHO Cc1cc(C[NH2+]C/C=C\CNC(=O)[C@@H](C(C)C)N(C)C)c(C)s1 ZINC001268618491 1097469479 /nfs/dbraw/zinc/46/94/79/1097469479.db2.gz WRSOEIKHJSKXTG-ZPUOCTKUSA-N 1 3 337.533 2.713 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\C[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001268619353 1097470285 /nfs/dbraw/zinc/47/02/85/1097470285.db2.gz ZTNCRYWAJFSEKY-VOFKWLDRSA-N 1 3 342.487 2.516 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)c(C)s1 ZINC001268629319 1097483529 /nfs/dbraw/zinc/48/35/29/1097483529.db2.gz VMGYCDUSDHBCHL-FKZIUMHTSA-N 1 3 349.544 3.000 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)c(C)s1 ZINC001268629319 1097483534 /nfs/dbraw/zinc/48/35/34/1097483534.db2.gz VMGYCDUSDHBCHL-FKZIUMHTSA-N 1 3 349.544 3.000 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]C/C=C\c1ccc(Cl)cc1)N(C)C ZINC001268651016 1097505229 /nfs/dbraw/zinc/50/52/29/1097505229.db2.gz HGHXIVWBIQFKNV-FIXGOIDJSA-N 1 3 337.895 2.788 10 0 EFAEHO CCc1ccc(CC[NH2+]C[C@H](C)NC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001268688636 1097542031 /nfs/dbraw/zinc/54/20/31/1097542031.db2.gz KOXLVHMIAJTEAW-FXAWDEMLSA-N 1 3 345.531 2.759 10 0 EFAEHO CCc1ccc(CC[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001268688637 1097542252 /nfs/dbraw/zinc/54/22/52/1097542252.db2.gz KOXLVHMIAJTEAW-PXNSSMCTSA-N 1 3 345.531 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+]CC[C@H]1CCc2ccccc21 ZINC001268717288 1097567001 /nfs/dbraw/zinc/56/70/01/1097567001.db2.gz VMTRFJPGYDSVLH-FUHWJXTLSA-N 1 3 331.504 2.541 10 0 EFAEHO CN(CCC[NH2+][C@@H]1CCCc2ccc(F)cc21)C(=O)[C@@H]1CCCN1C ZINC001268784652 1097632750 /nfs/dbraw/zinc/63/27/50/1097632750.db2.gz ZVHFNQDZKLMUGQ-MOPGFXCFSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CCC[NH2+][C@@H]1CCCc2ccc(F)cc21)C(=O)[C@H]1CCCN1C ZINC001268784655 1097632847 /nfs/dbraw/zinc/63/28/47/1097632847.db2.gz ZVHFNQDZKLMUGQ-RTBURBONSA-N 1 3 347.478 2.735 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CCCN(C)C(=O)CN(C)C2CCC2)c1 ZINC001268797233 1097645962 /nfs/dbraw/zinc/64/59/62/1097645962.db2.gz JVZJSVKFSPGFJS-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]Cc1c(C)cccc1Cl)N(C)C ZINC001268800607 1097648589 /nfs/dbraw/zinc/64/85/89/1097648589.db2.gz PVUJNWRXHGXSDR-QGZVFWFLSA-N 1 3 339.911 2.927 10 0 EFAEHO CC(C)c1cccc(C[NH2+]CCCN(C)C(=O)[C@H]2CCCCN2C)n1 ZINC001268803255 1097652276 /nfs/dbraw/zinc/65/22/76/1097652276.db2.gz XSUYHPJOCWCDRD-LJQANCHMSA-N 1 3 346.519 2.627 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)[C@H]1CCCN1C)c1cccc(Cl)c1 ZINC001268811691 1097660330 /nfs/dbraw/zinc/66/03/30/1097660330.db2.gz PZESSXNPVIATTL-WMLDXEAASA-N 1 3 337.895 2.933 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[NH2+]CC2CCC(C)(C)CC2)C1 ZINC001268847501 1097682605 /nfs/dbraw/zinc/68/26/05/1097682605.db2.gz KMBIZFSUZXKTFJ-QGZVFWFLSA-N 1 3 337.552 2.983 10 0 EFAEHO CC1CC(C[NH2+]CCCN(C)C(=O)c2cccc(CN(C)C)c2)C1 ZINC001268958885 1097746487 /nfs/dbraw/zinc/74/64/87/1097746487.db2.gz PZWGYHSGMHKPLK-UHFFFAOYSA-N 1 3 331.504 2.846 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[NH2+]Cc1ccc(C)cc1 ZINC001268959316 1097749367 /nfs/dbraw/zinc/74/93/67/1097749367.db2.gz YDDRGPQDRHBXHY-LJQANCHMSA-N 1 3 331.504 2.808 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](NC(=O)CCCC[NH+](C)C)C2)cc1C ZINC001269192073 1097937654 /nfs/dbraw/zinc/93/76/54/1097937654.db2.gz LCOQUECCTPBTQI-LJQANCHMSA-N 1 3 331.504 2.726 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+]CCC2=CCCCC2)CC1 ZINC001269411468 1098119221 /nfs/dbraw/zinc/11/92/21/1098119221.db2.gz IMWRICVGKJBBCQ-GOSISDBHSA-N 1 3 333.520 2.988 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H]2CC[N@H+](CC=C(C)C)C2)CC1 ZINC001269553154 1098241790 /nfs/dbraw/zinc/24/17/90/1098241790.db2.gz OKBXMIGJKHURSB-LJQANCHMSA-N 1 3 335.536 2.855 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H]2CC[N@@H+](CC=C(C)C)C2)CC1 ZINC001269553154 1098241793 /nfs/dbraw/zinc/24/17/93/1098241793.db2.gz OKBXMIGJKHURSB-LJQANCHMSA-N 1 3 335.536 2.855 10 0 EFAEHO CC(C)=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCC[NH+]1CCCC1 ZINC001269602219 1098282672 /nfs/dbraw/zinc/28/26/72/1098282672.db2.gz VUFSLPJDYAHYJR-MOPGFXCFSA-N 1 3 333.520 2.894 10 0 EFAEHO CC(C)=CC[N@H+](CC1CC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001269633180 1098311510 /nfs/dbraw/zinc/31/15/10/1098311510.db2.gz UJNUTOPLTPCUCN-UHFFFAOYSA-N 1 3 333.520 2.751 10 0 EFAEHO CC(C)=CC[N@@H+](CC1CC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001269633180 1098311514 /nfs/dbraw/zinc/31/15/14/1098311514.db2.gz UJNUTOPLTPCUCN-UHFFFAOYSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC[C@@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269693396 1098374159 /nfs/dbraw/zinc/37/41/59/1098374159.db2.gz UOZMATUORAYGHV-MJIPRMEISA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC[C@@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269693396 1098374163 /nfs/dbraw/zinc/37/41/63/1098374163.db2.gz UOZMATUORAYGHV-MJIPRMEISA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[NH+]1CC2(C1)CCN(C(=O)CN1CC[C@H](C)C1)CC2 ZINC001482245236 1098467945 /nfs/dbraw/zinc/46/79/45/1098467945.db2.gz UHNWPTLTDUCIBB-WRFKIARRSA-N 1 3 333.520 2.609 10 0 EFAEHO CC/C=C\CC[NH+]1CC2(C1)CCN(C(=O)CN1CCC(C)CC1)CC2 ZINC001482245490 1098472541 /nfs/dbraw/zinc/47/25/41/1098472541.db2.gz HTIQERKFVSQANS-PLNGDYQASA-N 1 3 347.547 2.999 10 0 EFAEHO Cc1ccc(C[NH+]2CC3(C2)CCN(C(=O)CN(C)C(C)C)CC3)cc1 ZINC001482246250 1098477590 /nfs/dbraw/zinc/47/75/90/1098477590.db2.gz GVTZNYHTGWTVQE-UHFFFAOYSA-N 1 3 343.515 2.760 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC(CC[NH2+]Cc2cccc(F)c2)CC1 ZINC001267912730 1098603752 /nfs/dbraw/zinc/60/37/52/1098603752.db2.gz ZPVVAOZLTSCMLR-LJQANCHMSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H]1C[NH2+]C/C=C\c1ccccc1)N(C)C ZINC001270174027 1098766259 /nfs/dbraw/zinc/76/62/59/1098766259.db2.gz HXSCBCLNJGIDSN-MYPZJPOHSA-N 1 3 343.515 2.867 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H]2C[NH2+]CCC2CCCCC2)C1 ZINC001270263554 1098879694 /nfs/dbraw/zinc/87/96/94/1098879694.db2.gz PITRQHOBEWHCBN-IEBWSBKVSA-N 1 3 335.536 2.879 10 0 EFAEHO CN1CCC[C@@H]1CC[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 ZINC000709486982 1099006315 /nfs/dbraw/zinc/00/63/15/1099006315.db2.gz PEUIPQGZZFVRDT-HZMVEIRTSA-N 1 3 337.508 2.848 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[NH2+]Cc1ccc(Cl)cc1C ZINC001481306407 1099196772 /nfs/dbraw/zinc/19/67/72/1099196772.db2.gz POFDJWNLAVVTCX-UHFFFAOYSA-N 1 3 325.884 2.538 10 0 EFAEHO Cc1cnc(C2CC[NH+](Cc3cc(F)cc(F)c3)CC2)n1CCO ZINC000675021623 1099664478 /nfs/dbraw/zinc/66/44/78/1099664478.db2.gz RSPKMWYZCJSRHZ-UHFFFAOYSA-N 1 3 335.398 2.842 10 0 EFAEHO CCCC[NH2+]C[C@@]1(C)CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001270847417 1099712029 /nfs/dbraw/zinc/71/20/29/1099712029.db2.gz MTKJCYHSFZNNEI-HXUWFJFHSA-N 1 3 331.504 2.990 10 0 EFAEHO CCCN(C)CC(=O)N[C@]1(C[NH2+]C/C=C\Cl)CCCC[C@H]1C ZINC001267874354 1099792963 /nfs/dbraw/zinc/79/29/63/1099792963.db2.gz SXAVDXGOGIUSLB-VONQVCDISA-N 1 3 329.916 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+][C@H]1CCCc2ccccc21 ZINC001482368937 1099870534 /nfs/dbraw/zinc/87/05/34/1099870534.db2.gz JUTPYOKTIKPSKK-APWZRJJASA-N 1 3 331.504 2.841 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]CC=C(Cl)Cl ZINC001482453732 1100447274 /nfs/dbraw/zinc/44/72/74/1100447274.db2.gz CWPFHFGDZFAPEZ-ZIAGYGMSSA-N 1 3 348.318 2.760 10 0 EFAEHO COc1cccc(-c2n[nH]cc2C[NH2+]C[C@@H]2CCN(C3CC3)C2)c1 ZINC000048711585 1100596205 /nfs/dbraw/zinc/59/62/05/1100596205.db2.gz GGLSPIPBNRGAJC-AWEZNQCLSA-N 1 3 326.444 2.659 10 0 EFAEHO CCC(CC)[NH2+]CCNC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC001635073277 1100642816 /nfs/dbraw/zinc/64/28/16/1100642816.db2.gz DALFGRPDJNTZAH-QAPCUYQASA-N 1 3 334.508 2.755 10 0 EFAEHO CCC(CC)[NH2+]CCNC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC001635073275 1100642883 /nfs/dbraw/zinc/64/28/83/1100642883.db2.gz DALFGRPDJNTZAH-CRAIPNDOSA-N 1 3 334.508 2.755 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H]2CCCN2C(=O)C2(N(C)C)CCC2)cc1 ZINC001671308371 1101707726 /nfs/dbraw/zinc/70/77/26/1101707726.db2.gz CQXWESRDVGFJIE-IBGZPJMESA-N 1 3 343.515 2.602 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]CCCc2ccc(C)cc2)C1)N(C)C ZINC001266695155 1101927828 /nfs/dbraw/zinc/92/78/28/1101927828.db2.gz MSIUSZCAPFGFDM-CEXWTWQISA-N 1 3 331.504 2.505 10 0 EFAEHO C[C@@H]1CCCN(C(=O)c2ccc(C[NH+](C)C)cc2)[C@H]1CNCCF ZINC001482491248 1101951578 /nfs/dbraw/zinc/95/15/78/1101951578.db2.gz ACIVQKCSRGGRGA-QAPCUYQASA-N 1 3 335.467 2.548 10 0 EFAEHO CCCCC[NH2+][C@H]1C[C@@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001266712840 1101989928 /nfs/dbraw/zinc/98/99/28/1101989928.db2.gz FYZOJFOXUVIZPE-RVKKMQEKSA-N 1 3 327.488 2.626 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CN(C)C2CCC2)[C@@H]1CC[NH2+]C/C=C\Cl ZINC001656434312 1102076279 /nfs/dbraw/zinc/07/62/79/1102076279.db2.gz JXZXSNRUHWEBTJ-YCDQCDSPSA-N 1 3 341.927 2.830 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCCC[C@@H]2CC[NH2+]CCC(F)(F)F)C1 ZINC001271578030 1102131196 /nfs/dbraw/zinc/13/11/96/1102131196.db2.gz ZREZHTCYXSHVPP-HUUCEWRRSA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCCC[C@H]2CC[NH2+]CCF)C1 ZINC001271575196 1102138605 /nfs/dbraw/zinc/13/86/05/1102138605.db2.gz BKTCHUITOBHGPI-MAUKXSAKSA-N 1 3 345.478 2.529 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@@H+]1C)Cc1ccccc1C1CC1 ZINC001480874884 1102138989 /nfs/dbraw/zinc/13/89/89/1102138989.db2.gz LWWJPUDWNWGUKM-IBGZPJMESA-N 1 3 343.515 2.986 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@H+]1C)Cc1ccccc1C1CC1 ZINC001480874884 1102138996 /nfs/dbraw/zinc/13/89/96/1102138996.db2.gz LWWJPUDWNWGUKM-IBGZPJMESA-N 1 3 343.515 2.986 10 0 EFAEHO C[C@@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@@H]1C[NH2+]CCCC1CCC1 ZINC001271628382 1102184419 /nfs/dbraw/zinc/18/44/19/1102184419.db2.gz GJUWKVIEKSZQSG-AEFFLSMTSA-N 1 3 335.536 2.735 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)CN3CC[C@H](C)C3)C[C@@H]2C1 ZINC001656833475 1102215784 /nfs/dbraw/zinc/21/57/84/1102215784.db2.gz RQYNDAXEPHJOFL-IWHMKIPHSA-N 1 3 347.547 2.855 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)CN3CC[C@H](C)C3)C[C@@H]2C1 ZINC001656833475 1102215793 /nfs/dbraw/zinc/21/57/93/1102215793.db2.gz RQYNDAXEPHJOFL-IWHMKIPHSA-N 1 3 347.547 2.855 10 0 EFAEHO CCOC(=O)/C=C/C[NH2+]C1[C@H](C)CN(Cc2ccccc2)C[C@H]1C ZINC001658142150 1102438923 /nfs/dbraw/zinc/43/89/23/1102438923.db2.gz DYGOYFQQWFNVLF-ZJJGVRJWSA-N 1 3 330.472 2.852 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001482507590 1102444804 /nfs/dbraw/zinc/44/48/04/1102444804.db2.gz XTLGBEFVFCMFNO-SJLPKXTDSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001482507590 1102444810 /nfs/dbraw/zinc/44/48/10/1102444810.db2.gz XTLGBEFVFCMFNO-SJLPKXTDSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)=CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C2 ZINC001271737263 1102541473 /nfs/dbraw/zinc/54/14/73/1102541473.db2.gz ZGIZDOUUFQIHEM-RDGPPVDQSA-N 1 3 335.536 2.898 10 0 EFAEHO CC(C)=CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C2 ZINC001271737263 1102541483 /nfs/dbraw/zinc/54/14/83/1102541483.db2.gz ZGIZDOUUFQIHEM-RDGPPVDQSA-N 1 3 335.536 2.898 10 0 EFAEHO C[C@H]1CC[N@H+](CC(=O)N2CCCC[C@H]2CNCC=C(Cl)Cl)C1 ZINC001266877063 1102572083 /nfs/dbraw/zinc/57/20/83/1102572083.db2.gz BIQUIKFCADPNPX-KBPBESRZSA-N 1 3 348.318 2.618 10 0 EFAEHO C[C@H]1CC[N@@H+](CC(=O)N2CCCC[C@H]2CNCC=C(Cl)Cl)C1 ZINC001266877063 1102572087 /nfs/dbraw/zinc/57/20/87/1102572087.db2.gz BIQUIKFCADPNPX-KBPBESRZSA-N 1 3 348.318 2.618 10 0 EFAEHO C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)[C@@H]1C[NH2+]CCCF ZINC001271741183 1102573988 /nfs/dbraw/zinc/57/39/88/1102573988.db2.gz WARDUGQSCJYTFF-JKSUJKDBSA-N 1 3 329.504 2.541 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1C[NH2+]CCc1cccs1 ZINC001266881518 1102580279 /nfs/dbraw/zinc/58/02/79/1102580279.db2.gz WZJFQBXEVUOFGT-MRXNPFEDSA-N 1 3 337.533 2.603 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[NH2+]CCc1cccs1 ZINC001266885664 1102592530 /nfs/dbraw/zinc/59/25/30/1102592530.db2.gz ZXTJCLLQUFDUGN-INIZCTEOSA-N 1 3 337.533 2.602 10 0 EFAEHO CC1CC(C[N@H+](C)CCCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001660304371 1102679651 /nfs/dbraw/zinc/67/96/51/1102679651.db2.gz ZFLNGBOGMGDJFV-LADRWXRNSA-N 1 3 341.515 2.683 10 0 EFAEHO CC1CC(C[N@@H+](C)CCCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001660304371 1102679654 /nfs/dbraw/zinc/67/96/54/1102679654.db2.gz ZFLNGBOGMGDJFV-LADRWXRNSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@@H](C(=O)NC1CCC([NH2+]CCCF)CC1)N1CCCCCC1 ZINC001266914698 1102680983 /nfs/dbraw/zinc/68/09/83/1102680983.db2.gz WRYCENIPUHDDDQ-GTPINHCMSA-N 1 3 327.488 2.628 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001480903072 1102712885 /nfs/dbraw/zinc/71/28/85/1102712885.db2.gz MIWMVMYGCCEROF-HKUYNNGSSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001480903072 1102712891 /nfs/dbraw/zinc/71/28/91/1102712891.db2.gz MIWMVMYGCCEROF-HKUYNNGSSA-N 1 3 331.504 2.582 10 0 EFAEHO CCN(CCCNC(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12)CCC(F)(F)F ZINC001660545756 1102839604 /nfs/dbraw/zinc/83/96/04/1102839604.db2.gz IEYCDGNPCJGXHL-LSDHHAIUSA-N 1 3 349.441 2.784 10 0 EFAEHO CCN(CCCNC(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12)CCC(F)(F)F ZINC001660545756 1102839625 /nfs/dbraw/zinc/83/96/25/1102839625.db2.gz IEYCDGNPCJGXHL-LSDHHAIUSA-N 1 3 349.441 2.784 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CC1CC(F)(F)C1)C(C)C ZINC001482532068 1102843782 /nfs/dbraw/zinc/84/37/82/1102843782.db2.gz IYXDYGGWPZXWLG-JKSUJKDBSA-N 1 3 345.478 2.637 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCCC[N@H+](C/C=C/c1ccccc1)C1CC1 ZINC001660659914 1102914307 /nfs/dbraw/zinc/91/43/07/1102914307.db2.gz GPSUSIYLYUMMST-JOCSGSGBSA-N 1 3 341.499 2.765 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCCC[N@@H+](C/C=C/c1ccccc1)C1CC1 ZINC001660659914 1102914313 /nfs/dbraw/zinc/91/43/13/1102914313.db2.gz GPSUSIYLYUMMST-JOCSGSGBSA-N 1 3 341.499 2.765 10 0 EFAEHO CC[C@H](C(=O)NC1(C[NH2+]Cc2cncc(C)c2)CCCCC1)N(C)C ZINC001409770494 1103110705 /nfs/dbraw/zinc/11/07/05/1103110705.db2.gz AXOAHGZGFMEMIY-GOSISDBHSA-N 1 3 346.519 2.639 10 0 EFAEHO CC/C=C/CC[N@H+](C)C[C@@H]1CCCN(C(=O)CN(C)C2CCC2)C1 ZINC001661213607 1103179541 /nfs/dbraw/zinc/17/95/41/1103179541.db2.gz VFMFUDCGJHMBHA-QWNKOJSDSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](C)C[C@@H]1CCCN(C(=O)CN(C)C2CCC2)C1 ZINC001661213607 1103179546 /nfs/dbraw/zinc/17/95/46/1103179546.db2.gz VFMFUDCGJHMBHA-QWNKOJSDSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+](C)C[C@@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001661226697 1103189038 /nfs/dbraw/zinc/18/90/38/1103189038.db2.gz JBHZSQBBXXFJGV-WLMAVBAVSA-N 1 3 335.536 2.855 10 0 EFAEHO CC/C=C/CC[N@@H+](C)C[C@@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001661226697 1103189041 /nfs/dbraw/zinc/18/90/41/1103189041.db2.gz JBHZSQBBXXFJGV-WLMAVBAVSA-N 1 3 335.536 2.855 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CCc1ccccc1 ZINC001483272066 1103206979 /nfs/dbraw/zinc/20/69/79/1103206979.db2.gz IWVMWRYJJUCFCF-PKOBYXMFSA-N 1 3 331.504 2.586 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@@H]2CN(C/C=C\Cl)CC[C@H]21 ZINC001661554882 1103316348 /nfs/dbraw/zinc/31/63/48/1103316348.db2.gz HPTOJIARLQYYDD-HJMWAZGYSA-N 1 3 341.927 2.784 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)C1 ZINC001661609934 1103336545 /nfs/dbraw/zinc/33/65/45/1103336545.db2.gz DAASPNVLTGQZDC-KDURUIRLSA-N 1 3 343.515 2.649 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@@H]1CCCN(Cc2ccc(F)cc2)C1 ZINC001661748712 1103406125 /nfs/dbraw/zinc/40/61/25/1103406125.db2.gz VWMKNCZHEIPINX-SFHVURJKSA-N 1 3 349.494 2.886 10 0 EFAEHO CC(C)(C(=O)N1CCC[C@@H](C[NH2+]C/C=C/Cl)C1)N1CCCCC1 ZINC001661783144 1103422745 /nfs/dbraw/zinc/42/27/45/1103422745.db2.gz OMZGPCYYVYPYFE-DYLHUKMJSA-N 1 3 341.927 2.832 10 0 EFAEHO CCc1cccc(CN(C)C[C@@H](C)NC(=O)[C@H]2C[NH+]3CCC2CC3)c1 ZINC001483339729 1103429147 /nfs/dbraw/zinc/42/91/47/1103429147.db2.gz SGUVXTYTUQBCFB-UZLBHIALSA-N 1 3 343.515 2.527 10 0 EFAEHO C[C@H](C[N@H+](C)C[C@@H]1CCCC(F)(F)C1)NC(=O)CN(C)C1CCC1 ZINC001483347722 1103449405 /nfs/dbraw/zinc/44/94/05/1103449405.db2.gz NAWUBDBIYUIFTB-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)NC(=O)CN(C)C1CCC1 ZINC001483347722 1103449411 /nfs/dbraw/zinc/44/94/11/1103449411.db2.gz NAWUBDBIYUIFTB-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO CN(CC(C)(C)C[NH2+][C@H]1CCc2ccccc21)C(=O)Cc1c[nH]cn1 ZINC001409481852 1103453524 /nfs/dbraw/zinc/45/35/24/1103453524.db2.gz BNURENRTPQFIAI-SFHVURJKSA-N 1 3 340.471 2.714 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC[C@H](C[NH2+]CCCF)C2)c1 ZINC001661841548 1103457133 /nfs/dbraw/zinc/45/71/33/1103457133.db2.gz BYEXUFMIVBKXIF-QGZVFWFLSA-N 1 3 335.467 2.550 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC[C@@H](C[NH2+]CCCF)C2)c1 ZINC001661841547 1103457651 /nfs/dbraw/zinc/45/76/51/1103457651.db2.gz BYEXUFMIVBKXIF-KRWDZBQOSA-N 1 3 335.467 2.550 10 0 EFAEHO CCCC[NH2+]C[C@@H]1CCCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001661945726 1103515417 /nfs/dbraw/zinc/51/54/17/1103515417.db2.gz ATVAAKWYIKJSFK-LPHOPBHVSA-N 1 3 341.515 2.970 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCCC[C@@H]2C[NH2+]CCCF)c1 ZINC001661971714 1103525444 /nfs/dbraw/zinc/52/54/44/1103525444.db2.gz CXFRRMHKNSJLIS-GOSISDBHSA-N 1 3 335.467 2.692 10 0 EFAEHO CC/C=C/CC[NH2+][C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001662334043 1103667024 /nfs/dbraw/zinc/66/70/24/1103667024.db2.gz BQTZZMIMYNNCBZ-ZIEDNJRCSA-N 1 3 327.488 2.650 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)CCc1ccccc1F ZINC001483421044 1103672242 /nfs/dbraw/zinc/67/22/42/1103672242.db2.gz NTRZWQRCTSUOCN-QFBILLFUSA-N 1 3 349.494 2.679 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCc1ccccc1F ZINC001483421044 1103672250 /nfs/dbraw/zinc/67/22/50/1103672250.db2.gz NTRZWQRCTSUOCN-QFBILLFUSA-N 1 3 349.494 2.679 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@H+](C)CCc1ccccc1 ZINC001483422809 1103677964 /nfs/dbraw/zinc/67/79/64/1103677964.db2.gz ZGCYDUCGHQGXGK-MJGOQNOKSA-N 1 3 331.504 2.540 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@@H+](C)CCc1ccccc1 ZINC001483422809 1103677969 /nfs/dbraw/zinc/67/79/69/1103677969.db2.gz ZGCYDUCGHQGXGK-MJGOQNOKSA-N 1 3 331.504 2.540 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)CC[C@@H]1CCCC1(F)F ZINC001483421958 1103679476 /nfs/dbraw/zinc/67/94/76/1103679476.db2.gz TZWCWUHWSMQGNI-CABCVRRESA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC001483421958 1103679481 /nfs/dbraw/zinc/67/94/81/1103679481.db2.gz TZWCWUHWSMQGNI-CABCVRRESA-N 1 3 333.467 2.589 10 0 EFAEHO CN(CC(=O)N1CC[C@H](C[NH2+]CCCc2ccccc2)C1)C1CCC1 ZINC001662641587 1103741564 /nfs/dbraw/zinc/74/15/64/1103741564.db2.gz SLMUGUYZNCKHLP-LJQANCHMSA-N 1 3 343.515 2.542 10 0 EFAEHO CC[C@@H]([NH2+]CCCN(C)C(=O)[C@@H]1CCCN1C)c1ccc(F)cc1 ZINC001483456460 1103749725 /nfs/dbraw/zinc/74/97/25/1103749725.db2.gz WOPCZXUCHVHWPK-MSOLQXFVSA-N 1 3 335.467 2.809 10 0 EFAEHO CN(CCC[NH2+]Cc1cc(Cl)ccc1F)C(=O)[C@@H]1CCCN1C ZINC001483456547 1103749985 /nfs/dbraw/zinc/74/99/85/1103749985.db2.gz ZHESKRAZFSCUOG-INIZCTEOSA-N 1 3 341.858 2.511 10 0 EFAEHO CN(CCC[NH2+]Cc1cc(Cl)ccc1F)C(=O)[C@H]1CCCN1C ZINC001483456548 1103750087 /nfs/dbraw/zinc/75/00/87/1103750087.db2.gz ZHESKRAZFSCUOG-MRXNPFEDSA-N 1 3 341.858 2.511 10 0 EFAEHO CC[C@H]([NH2+]CCCN(C)C(=O)[C@@H]1CCCN1C)c1ccc(F)cc1 ZINC001483456462 1103750327 /nfs/dbraw/zinc/75/03/27/1103750327.db2.gz WOPCZXUCHVHWPK-ROUUACIJSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)CN(C)C1CCC1)c1ccc(F)cc1 ZINC001483470108 1103769853 /nfs/dbraw/zinc/76/98/53/1103769853.db2.gz JWZUWUXGFDCVMT-OAHLLOKOSA-N 1 3 335.467 2.809 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]CCCc2cccc(F)c2)C1 ZINC001662726762 1103773130 /nfs/dbraw/zinc/77/31/30/1103773130.db2.gz CEFIPNMXXNUTAS-SFHVURJKSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001483475353 1103782551 /nfs/dbraw/zinc/78/25/51/1103782551.db2.gz ZAKLDBAXJVUWMR-CYBMUJFWSA-N 1 3 331.913 2.680 10 0 EFAEHO CCc1ccc(C[NH2+]CCCN(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001483493130 1103827700 /nfs/dbraw/zinc/82/77/00/1103827700.db2.gz TVTNBFKFIIGUFV-KRWDZBQOSA-N 1 3 331.504 2.529 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001483511852 1103883206 /nfs/dbraw/zinc/88/32/06/1103883206.db2.gz KFPZIPDQCCBTRZ-SFHVURJKSA-N 1 3 335.467 2.591 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@@H](CNCC=C(Cl)Cl)C1CC1 ZINC001483564084 1103956530 /nfs/dbraw/zinc/95/65/30/1103956530.db2.gz LVYOTVQCAOCQHZ-KBPBESRZSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H](CNCC=C(Cl)Cl)C1CC1 ZINC001483564084 1103956537 /nfs/dbraw/zinc/95/65/37/1103956537.db2.gz LVYOTVQCAOCQHZ-KBPBESRZSA-N 1 3 348.318 2.664 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@H]1CCC[N@@H+]1C/C=C/Cl)N(C)C ZINC001663071761 1103960652 /nfs/dbraw/zinc/96/06/52/1103960652.db2.gz IPGGRZHDAYUVJG-MOVUHUBBSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@H]1CCC[N@H+]1C/C=C/Cl)N(C)C ZINC001663071761 1103960659 /nfs/dbraw/zinc/96/06/59/1103960659.db2.gz IPGGRZHDAYUVJG-MOVUHUBBSA-N 1 3 329.916 2.686 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H](C[NH2+]C/C=C/Cl)C2CC2)c1 ZINC001483606515 1104055289 /nfs/dbraw/zinc/05/52/89/1104055289.db2.gz DFRUJXCHKLMASB-QVNOTHCHSA-N 1 3 335.879 2.599 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)[C@H](C)CNC(=O)CN(C)C2CCC2)c1 ZINC001409557868 1104225006 /nfs/dbraw/zinc/22/50/06/1104225006.db2.gz AZBYKNMCEZAIJH-CVEARBPZSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)[C@H](C)CNC(=O)CN(C)C2CCC2)c1 ZINC001409557868 1104225011 /nfs/dbraw/zinc/22/50/11/1104225011.db2.gz AZBYKNMCEZAIJH-CVEARBPZSA-N 1 3 347.503 2.677 10 0 EFAEHO C[C@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)N(C)Cc1ccc(CF)cc1 ZINC001409567752 1104283512 /nfs/dbraw/zinc/28/35/12/1104283512.db2.gz PLGYVYXREWZKQE-VQIMIIECSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)N(C)Cc1ccc(CF)cc1 ZINC001409567752 1104283517 /nfs/dbraw/zinc/28/35/17/1104283517.db2.gz PLGYVYXREWZKQE-VQIMIIECSA-N 1 3 349.494 2.967 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)Cc2ccc(CF)cc2)CC[N@@H+]1C ZINC001409568336 1104285205 /nfs/dbraw/zinc/28/52/05/1104285205.db2.gz HPLZOFVQPLDCCR-AYOQOUSVSA-N 1 3 349.494 2.823 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)Cc2ccc(CF)cc2)CC[N@H+]1C ZINC001409568336 1104285213 /nfs/dbraw/zinc/28/52/13/1104285213.db2.gz HPLZOFVQPLDCCR-AYOQOUSVSA-N 1 3 349.494 2.823 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[NH2+]Cc1cccc(C(F)(F)F)c1)N(C)C ZINC001664313344 1104346193 /nfs/dbraw/zinc/34/61/93/1104346193.db2.gz HWGYJHNUZWSLKQ-OAHLLOKOSA-N 1 3 345.409 2.594 10 0 EFAEHO Cc1cccnc1CNCC1(NC(=O)CCC[NH+](C)C)CCCCC1 ZINC001409793298 1104407912 /nfs/dbraw/zinc/40/79/12/1104407912.db2.gz XKYNCHQFCUHLEN-UHFFFAOYSA-N 1 3 346.519 2.641 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(C)CCN(C)C(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001482599530 1104417308 /nfs/dbraw/zinc/41/73/08/1104417308.db2.gz WLLINQZPRZHYOU-HNAYVOBHSA-N 1 3 347.478 2.619 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N(C)CC[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001482600137 1104419969 /nfs/dbraw/zinc/41/99/69/1104419969.db2.gz CYTZXXLUEKTUGR-RBUKOAKNSA-N 1 3 349.494 2.744 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N(C)CC[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001482600137 1104419971 /nfs/dbraw/zinc/41/99/71/1104419971.db2.gz CYTZXXLUEKTUGR-RBUKOAKNSA-N 1 3 349.494 2.744 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001482603673 1104454285 /nfs/dbraw/zinc/45/42/85/1104454285.db2.gz NSFNGXAPHCVUBT-IBGZPJMESA-N 1 3 331.504 2.760 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001482603673 1104454288 /nfs/dbraw/zinc/45/42/88/1104454288.db2.gz NSFNGXAPHCVUBT-IBGZPJMESA-N 1 3 331.504 2.760 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC[C@@H](C)N(C)Cc2cccc(F)c2)C1 ZINC001409607676 1104466527 /nfs/dbraw/zinc/46/65/27/1104466527.db2.gz AUGHYBZTYQAPFU-AEFFLSMTSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC[C@@H](C)N(C)Cc2cccc(F)c2)C1 ZINC001409607676 1104466531 /nfs/dbraw/zinc/46/65/31/1104466531.db2.gz AUGHYBZTYQAPFU-AEFFLSMTSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@@H]2CC[N@H+](CC3=CCCCC3)C2)C1 ZINC001664740033 1104532174 /nfs/dbraw/zinc/53/21/74/1104532174.db2.gz DQVQEIADWDDOAU-PKOBYXMFSA-N 1 3 333.520 2.657 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@@H]2CC[N@@H+](CC3=CCCCC3)C2)C1 ZINC001664740033 1104532179 /nfs/dbraw/zinc/53/21/79/1104532179.db2.gz DQVQEIADWDDOAU-PKOBYXMFSA-N 1 3 333.520 2.657 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@@H](C)CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001409622571 1104539906 /nfs/dbraw/zinc/53/99/06/1104539906.db2.gz YXAANVCUVLSQEU-ULQDDVLXSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@@H](C)CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001409622571 1104539914 /nfs/dbraw/zinc/53/99/14/1104539914.db2.gz YXAANVCUVLSQEU-ULQDDVLXSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001483237006 1104547386 /nfs/dbraw/zinc/54/73/86/1104547386.db2.gz XHBIXBCQDQIBGY-DOTOQJQBSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001483237006 1104547395 /nfs/dbraw/zinc/54/73/95/1104547395.db2.gz XHBIXBCQDQIBGY-DOTOQJQBSA-N 1 3 335.467 2.603 10 0 EFAEHO COc1cccc([C@H](C)N(C)[C@H](C)CNC(=O)C2(C[NH+](C)C)CC2)c1 ZINC001409630666 1104558044 /nfs/dbraw/zinc/55/80/44/1104558044.db2.gz PYMDJQGJMPMANF-CVEARBPZSA-N 1 3 347.503 2.535 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)N(C)Cc1ccc(C2CCC2)cc1 ZINC001409678964 1104641666 /nfs/dbraw/zinc/64/16/66/1104641666.db2.gz JYBQMQDDUSSWAG-UZLBHIALSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(C2CCC2)cc1 ZINC001409678964 1104641668 /nfs/dbraw/zinc/64/16/68/1104641668.db2.gz JYBQMQDDUSSWAG-UZLBHIALSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H](CC[NH2+]CC3CCCC3)C2)C1 ZINC001666146945 1104882875 /nfs/dbraw/zinc/88/28/75/1104882875.db2.gz VFNADXJHLKPORJ-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](CC[NH2+]Cc2ccccc2F)C1 ZINC001666172380 1104892290 /nfs/dbraw/zinc/89/22/90/1104892290.db2.gz GRYTUIKTKPQAPN-QGZVFWFLSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@@H](F)C[NH2+]CCC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001666219789 1104905461 /nfs/dbraw/zinc/90/54/61/1104905461.db2.gz ZPXBXDQYWLVADC-SJORKVTESA-N 1 3 329.504 2.539 10 0 EFAEHO CCCCC[NH2+]C[C@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001666458862 1104945828 /nfs/dbraw/zinc/94/58/28/1104945828.db2.gz ZPHLWSSZBBMFTG-APWZRJJASA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]1C[NH2+]Cc1ccc(F)cc1 ZINC001482696591 1104953250 /nfs/dbraw/zinc/95/32/50/1104953250.db2.gz CUUHFOIRMRFBCX-WMZOPIPTSA-N 1 3 335.467 2.540 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]C/C=C/c1ccccc1 ZINC001666599378 1104968320 /nfs/dbraw/zinc/96/83/20/1104968320.db2.gz FKZPUIRXCVHBNX-PEKVBPLLSA-N 1 3 343.515 2.916 10 0 EFAEHO CCCCC[NH2+][C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C[C@H]1C ZINC001667196852 1105076237 /nfs/dbraw/zinc/07/62/37/1105076237.db2.gz DSLHLUKFYOJGSY-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001482867851 1105118310 /nfs/dbraw/zinc/11/83/10/1105118310.db2.gz LYRJJNWLLAOJLO-WMLDXEAASA-N 1 3 339.911 2.911 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CC[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001482889262 1105147559 /nfs/dbraw/zinc/14/75/59/1105147559.db2.gz PJHYLUOIBSRZRR-GOEBONIOSA-N 1 3 347.494 2.883 10 0 EFAEHO Cc1cc(C)c(C[NH2+]CC[C@@H](C)NC(=O)CN(C)C(C)C)c(C)c1 ZINC001482903044 1105160953 /nfs/dbraw/zinc/16/09/53/1105160953.db2.gz WIPGQCZUBSUFIP-GOSISDBHSA-N 1 3 333.520 2.936 10 0 EFAEHO CCN(CCNCc1cc2ccccc2o1)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001482925239 1105182484 /nfs/dbraw/zinc/18/24/84/1105182484.db2.gz OOSCPMFRXUMTAS-CRAIPNDOSA-N 1 3 343.471 2.711 10 0 EFAEHO CCN(CCNCc1cc2ccccc2o1)C(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001482925239 1105182486 /nfs/dbraw/zinc/18/24/86/1105182486.db2.gz OOSCPMFRXUMTAS-CRAIPNDOSA-N 1 3 343.471 2.711 10 0 EFAEHO CC[C@H](F)CNCCN(CC)C(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001482945586 1105231780 /nfs/dbraw/zinc/23/17/80/1105231780.db2.gz OWNYNURGYRPTNB-FUHWJXTLSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@H](F)CNCCN(CC)C(=O)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001482945586 1105231782 /nfs/dbraw/zinc/23/17/82/1105231782.db2.gz OWNYNURGYRPTNB-FUHWJXTLSA-N 1 3 341.515 2.970 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(F)cc1C)C(=O)CN1CCC(C)CC1 ZINC001482957724 1105242125 /nfs/dbraw/zinc/24/21/25/1105242125.db2.gz CHOSVALTGAXWRP-UHFFFAOYSA-N 1 3 349.494 2.804 10 0 EFAEHO CCN(CC[NH2+]Cc1c(C)cc(C)cc1C)C(=O)CN1CC[C@@H](C)C1 ZINC001482950071 1105246968 /nfs/dbraw/zinc/24/69/68/1105246968.db2.gz DSRSWVBXIUMMNQ-MRXNPFEDSA-N 1 3 345.531 2.892 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC001668320351 1105281162 /nfs/dbraw/zinc/28/11/62/1105281162.db2.gz PUNZGEGYYQVSSS-QZTJIDSGSA-N 1 3 345.531 2.616 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001668582142 1105325442 /nfs/dbraw/zinc/32/54/42/1105325442.db2.gz WFWBCNKVDNXXGE-IRXDYDNUSA-N 1 3 335.517 2.703 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001668582142 1105325449 /nfs/dbraw/zinc/32/54/49/1105325449.db2.gz WFWBCNKVDNXXGE-IRXDYDNUSA-N 1 3 335.517 2.703 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C(C)C)nc1C)C(=O)CN1CCCC1 ZINC001668644623 1105338607 /nfs/dbraw/zinc/33/86/07/1105338607.db2.gz FBDCGEJJIJDFHU-UHFFFAOYSA-N 1 3 346.519 2.547 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C/C=C/CNC(=O)[C@@H]2CCCN2C)cc1 ZINC001668745365 1105360590 /nfs/dbraw/zinc/36/05/90/1105360590.db2.gz FDYVFXPPPYMZFM-PXPVJAHISA-N 1 3 329.488 2.666 10 0 EFAEHO O=C(NC/C=C/CNCc1cccc(F)c1)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001668884278 1105393575 /nfs/dbraw/zinc/39/35/75/1105393575.db2.gz ZXRKJJQVAOAIRX-KTBRJVSMSA-N 1 3 345.462 2.605 10 0 EFAEHO O=C(NC/C=C/CNCc1cccc(F)c1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001668884278 1105393582 /nfs/dbraw/zinc/39/35/82/1105393582.db2.gz ZXRKJJQVAOAIRX-KTBRJVSMSA-N 1 3 345.462 2.605 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)NC/C=C\CNCc1ccc(F)cc1 ZINC001668906516 1105396988 /nfs/dbraw/zinc/39/69/88/1105396988.db2.gz ZFPJHASUJSFRNV-LLHWWHOWSA-N 1 3 347.478 2.708 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)NC/C=C\CNCc1ccc(F)cc1 ZINC001668906516 1105396993 /nfs/dbraw/zinc/39/69/93/1105396993.db2.gz ZFPJHASUJSFRNV-LLHWWHOWSA-N 1 3 347.478 2.708 10 0 EFAEHO C[NH+](C)CCC(=O)NC/C=C\CN[C@@H]1CCc2ccc(Cl)cc21 ZINC001669020804 1105418785 /nfs/dbraw/zinc/41/87/85/1105418785.db2.gz JVVWZBPDSAHABD-CWIOURORSA-N 1 3 335.879 2.541 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\C[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001669027506 1105420017 /nfs/dbraw/zinc/42/00/17/1105420017.db2.gz SEKRULPKJGPQGG-OGZRUICASA-N 1 3 345.478 2.660 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@H]1C(=O)NC/C=C/CNCc1ccsc1 ZINC001669074805 1105429850 /nfs/dbraw/zinc/42/98/50/1105429850.db2.gz DZNFDSGCGLTMEV-BDUNBXCCSA-N 1 3 335.517 2.773 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@H]1C(=O)NC/C=C/CNCc1ccsc1 ZINC001669074805 1105429852 /nfs/dbraw/zinc/42/98/52/1105429852.db2.gz DZNFDSGCGLTMEV-BDUNBXCCSA-N 1 3 335.517 2.773 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC/C=C\CN[C@@H]1CCc2ccc(Cl)cc21 ZINC001669126865 1105439915 /nfs/dbraw/zinc/43/99/15/1105439915.db2.gz QDHQSJXPWMDHLV-PYTPGESOSA-N 1 3 349.906 2.931 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC/C=C\CN[C@@H]1CCc2ccc(Cl)cc21 ZINC001669126865 1105439921 /nfs/dbraw/zinc/43/99/21/1105439921.db2.gz QDHQSJXPWMDHLV-PYTPGESOSA-N 1 3 349.906 2.931 10 0 EFAEHO O=C(CN1CCCC1)NC/C=C/C[NH2+][C@@H]1CCc2c1cccc2Cl ZINC001669189453 1105453194 /nfs/dbraw/zinc/45/31/94/1105453194.db2.gz NKPOUBFDHKRCHG-ZMXQLYDGSA-N 1 3 347.890 2.685 10 0 EFAEHO Cc1ccc(CNC/C=C\CNC(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)cc1F ZINC001669201067 1105456283 /nfs/dbraw/zinc/45/62/83/1105456283.db2.gz LRWPKAUVDDDABO-FPXTWJHWSA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1ccc(CNC/C=C\CNC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)cc1F ZINC001669201067 1105456289 /nfs/dbraw/zinc/45/62/89/1105456289.db2.gz LRWPKAUVDDDABO-FPXTWJHWSA-N 1 3 347.478 2.769 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\CNC/C=C/Cl)[NH+]1CCCCC1 ZINC001669207874 1105458194 /nfs/dbraw/zinc/45/81/94/1105458194.db2.gz PSJJUEAJBJSOIN-QRWLQPOCSA-N 1 3 327.900 2.511 10 0 EFAEHO C[C@H]([NH2+]C/C=C/CNC(=O)CN(C)C1CCC1)c1ccc(F)cc1 ZINC001483018793 1105561477 /nfs/dbraw/zinc/56/14/77/1105561477.db2.gz RLGNHIIJKURFMS-BWPKMQGJSA-N 1 3 333.451 2.633 10 0 EFAEHO C[C@@H]([NH2+]C/C=C/CNC(=O)CN(C)C1CCC1)c1ccc(F)cc1 ZINC001483018795 1105561526 /nfs/dbraw/zinc/56/15/26/1105561526.db2.gz RLGNHIIJKURFMS-NHZBNJEXSA-N 1 3 333.451 2.633 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@@H]1CCCC[C@@H]1NC(=O)Cc1nc[nH]c1C ZINC001669979241 1105562121 /nfs/dbraw/zinc/56/21/21/1105562121.db2.gz ATFOMKIZZHVWKJ-XLYSIVADSA-N 1 3 332.492 2.882 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H]2CCCC[C@@H]2C[NH2+]CCCF)c1 ZINC001669985833 1105564915 /nfs/dbraw/zinc/56/49/15/1105564915.db2.gz NDMFXKGFQAJKOC-RTBURBONSA-N 1 3 349.494 2.986 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)C23CCC[NH+](CCC2)C3)cs1 ZINC001483021887 1105573034 /nfs/dbraw/zinc/57/30/34/1105573034.db2.gz DZWPQUDKDLPFPO-IHWYPQMZSA-N 1 3 347.528 2.695 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)C1(N(C)C)CCC1)c1ccc(F)cc1 ZINC001670124700 1105584357 /nfs/dbraw/zinc/58/43/57/1105584357.db2.gz ZMIYLMDCRLTKGK-HNNXBMFYSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H]2C[NH2+]CCCC2CCCC2)C1 ZINC001671346359 1105628512 /nfs/dbraw/zinc/62/85/12/1105628512.db2.gz GZXMOMHUBYGGCX-MJGOQNOKSA-N 1 3 335.536 2.879 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@H]2C[NH2+]CCCC2CCC2)CC1 ZINC001671359615 1105629494 /nfs/dbraw/zinc/62/94/94/1105629494.db2.gz LIMAPLSAPSNFOL-IBGZPJMESA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@]1(C)CCC[N@H+](CCCCCF)C1 ZINC001671917117 1105731628 /nfs/dbraw/zinc/73/16/28/1105731628.db2.gz VRXDAAZOAGRXGV-GOSISDBHSA-N 1 3 338.471 2.619 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@]1(C)CCC[N@@H+](CCCCCF)C1 ZINC001671917117 1105731637 /nfs/dbraw/zinc/73/16/37/1105731637.db2.gz VRXDAAZOAGRXGV-GOSISDBHSA-N 1 3 338.471 2.619 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)C2CCC2)C[C@H]1C[NH2+]CCCC1CCC1 ZINC001672286421 1105792953 /nfs/dbraw/zinc/79/29/53/1105792953.db2.gz HVXPIZZAIZEBCZ-FUHWJXTLSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)C2CCC2)C[C@@H]1C[NH2+]CCCC1CCC1 ZINC001672286420 1105793233 /nfs/dbraw/zinc/79/32/33/1105793233.db2.gz HVXPIZZAIZEBCZ-AEFFLSMTSA-N 1 3 335.536 2.735 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)NC[C@H]1C[C@H]2CC[C@@H](C1)N2CCF ZINC001672361164 1105813147 /nfs/dbraw/zinc/81/31/47/1105813147.db2.gz RNSBWSPUIMVHIE-BCDXTJNWSA-N 1 3 339.499 2.581 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001672377328 1105816692 /nfs/dbraw/zinc/81/66/92/1105816692.db2.gz USSQZBZGWGIEAZ-BRSBDYLESA-N 1 3 341.515 2.589 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CC[C@H]1CCN(C(=O)[C@@H]2CCCN2C)C1 ZINC001672762529 1105897448 /nfs/dbraw/zinc/89/74/48/1105897448.db2.gz YHWOMAGJJJONNS-LPHOPBHVSA-N 1 3 347.478 2.557 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](CC[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001672859344 1105922892 /nfs/dbraw/zinc/92/28/92/1105922892.db2.gz RPGGLIRPMJRVJW-PKOBYXMFSA-N 1 3 349.563 2.981 10 0 EFAEHO CC/C=C\CC[NH2+]CC[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001672884777 1105927894 /nfs/dbraw/zinc/92/78/94/1105927894.db2.gz DJKMYNAHHAVGPD-HMECNJMJSA-N 1 3 335.536 2.903 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+]Cc2cc(F)ccc2C)C1 ZINC001672901471 1105932903 /nfs/dbraw/zinc/93/29/03/1105932903.db2.gz IADOPXRRSFCIGM-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1C[NH2+]CCc1ccc(C)cc1 ZINC001673129174 1105975814 /nfs/dbraw/zinc/97/58/14/1105975814.db2.gz NBYJCCINDXWGJG-HXUWFJFHSA-N 1 3 345.531 2.850 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@H]([NH2+]CCCCc2ccccc2)C1 ZINC001673929677 1106104850 /nfs/dbraw/zinc/10/48/50/1106104850.db2.gz VEJYOUYSZFXSLL-AZUAARDMSA-N 1 3 345.531 2.786 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1CC1=CCCCC1 ZINC001674132630 1106142933 /nfs/dbraw/zinc/14/29/33/1106142933.db2.gz ANVPMZYQWXVGRQ-FUHWJXTLSA-N 1 3 333.520 2.940 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@H+]1CC1=CCCCC1 ZINC001674132630 1106142938 /nfs/dbraw/zinc/14/29/38/1106142938.db2.gz ANVPMZYQWXVGRQ-FUHWJXTLSA-N 1 3 333.520 2.940 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@H]([C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001674505224 1106209596 /nfs/dbraw/zinc/20/95/96/1106209596.db2.gz LUBMQMVGDNFMJQ-OOUWWJCLSA-N 1 3 344.503 2.869 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@H]([C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001674505224 1106209598 /nfs/dbraw/zinc/20/95/98/1106209598.db2.gz LUBMQMVGDNFMJQ-OOUWWJCLSA-N 1 3 344.503 2.869 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3=CCCCC3)C[C@H]21)N(C)C ZINC001675522550 1106379299 /nfs/dbraw/zinc/37/92/99/1106379299.db2.gz PYWZTHWJQLDDSN-HAGHYFMRSA-N 1 3 347.547 2.757 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3=CCCCC3)C[C@H]21)N(C)C ZINC001675522550 1106379303 /nfs/dbraw/zinc/37/93/03/1106379303.db2.gz PYWZTHWJQLDDSN-HAGHYFMRSA-N 1 3 347.547 2.757 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3=CCCCC3)C[C@H]21)N1CCCC1 ZINC001675532789 1106381064 /nfs/dbraw/zinc/38/10/64/1106381064.db2.gz JYFQNHZGIKAIIH-LDLYASANSA-N 1 3 345.531 2.655 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1[C@H]2C[N@H+](CC3=CCCCC3)C[C@H]21)N1CCCC1 ZINC001675532789 1106381068 /nfs/dbraw/zinc/38/10/68/1106381068.db2.gz JYFQNHZGIKAIIH-LDLYASANSA-N 1 3 345.531 2.655 10 0 EFAEHO CCCCC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)C3(N(C)C)CCC3)C[C@@H]2C1 ZINC001675636424 1106400396 /nfs/dbraw/zinc/40/03/96/1106400396.db2.gz VLLUPDVQPHMJLM-KSZLIROESA-N 1 3 335.536 2.878 10 0 EFAEHO CCCCC[N@H+]1C[C@@H]2CC[C@H](NC(=O)C3(N(C)C)CCC3)C[C@@H]2C1 ZINC001675636424 1106400397 /nfs/dbraw/zinc/40/03/97/1106400397.db2.gz VLLUPDVQPHMJLM-KSZLIROESA-N 1 3 335.536 2.878 10 0 EFAEHO CCCCCC[N@@H+]1CCCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001675673577 1106408433 /nfs/dbraw/zinc/40/84/33/1106408433.db2.gz UETMZQWGGPAUDK-SFHVURJKSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCCC[N@H+]1CCCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001675673577 1106408435 /nfs/dbraw/zinc/40/84/35/1106408435.db2.gz UETMZQWGGPAUDK-SFHVURJKSA-N 1 3 335.536 2.833 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+]CC1CC2(CCC2)C1 ZINC001676012287 1106468244 /nfs/dbraw/zinc/46/82/44/1106468244.db2.gz KUDCFRRDJTVZOL-AWEZNQCLSA-N 1 3 332.492 2.715 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CCC[NH2+]CC1CC(F)(F)C1 ZINC001676024769 1106471295 /nfs/dbraw/zinc/47/12/95/1106471295.db2.gz XYCMHKBGCURFPN-ZBFHGGJFSA-N 1 3 345.478 2.781 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CCC[NH2+]CC1CC(F)(F)C1 ZINC001676024767 1106471399 /nfs/dbraw/zinc/47/13/99/1106471399.db2.gz XYCMHKBGCURFPN-GOEBONIOSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1C[C@@H](C)N(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001676784526 1106579929 /nfs/dbraw/zinc/57/99/29/1106579929.db2.gz WKNJSKDHJUBMNA-VQIMIIECSA-N 1 3 329.488 2.907 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CC[C@@H](C[NH2+]CCC2CCCC2)C1 ZINC001676970234 1106639310 /nfs/dbraw/zinc/63/93/10/1106639310.db2.gz MYMRWGUWWZTPQM-SJORKVTESA-N 1 3 332.492 2.715 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@@H](CNCCF)C(C)(C)C)CCCCC1 ZINC001677271639 1106688004 /nfs/dbraw/zinc/68/80/04/1106688004.db2.gz GYHACHJAPOTFQE-HNNXBMFYSA-N 1 3 329.504 2.589 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C(F)(F)F)[C@@H]([NH2+]CC=C(C)C)C1 ZINC001677376077 1106709488 /nfs/dbraw/zinc/70/94/88/1106709488.db2.gz MZCLTJFLPQERMB-CABCVRRESA-N 1 3 349.441 2.663 10 0 EFAEHO Cc1ccc(CCC[NH2+]C2CC(N(C)C(=O)CN(C)C(C)C)C2)cc1 ZINC001677448235 1106718812 /nfs/dbraw/zinc/71/88/12/1106718812.db2.gz AXORDLGTDUSSAK-UHFFFAOYSA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1cccc(C[N@H+]2CC=C(CNC(=O)C3(N(C)C)CCC3)CC2)c1 ZINC001677570865 1106747264 /nfs/dbraw/zinc/74/72/64/1106747264.db2.gz QUILGPVYGRMATA-UHFFFAOYSA-N 1 3 341.499 2.728 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC=C(CNC(=O)C3(N(C)C)CCC3)CC2)c1 ZINC001677570865 1106747279 /nfs/dbraw/zinc/74/72/79/1106747279.db2.gz QUILGPVYGRMATA-UHFFFAOYSA-N 1 3 341.499 2.728 10 0 EFAEHO Cc1c(C)c(C)c(CN2CC[C@H]2CNC(=O)CC[NH+](C)C)c(C)c1C ZINC001483675509 1107414980 /nfs/dbraw/zinc/41/49/80/1107414980.db2.gz BJBXCCCTQJKESR-IBGZPJMESA-N 1 3 345.531 2.871 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)cc1F ZINC001409344050 1107562122 /nfs/dbraw/zinc/56/21/22/1107562122.db2.gz CJQHYRGTFVGILN-GJZGRUSLSA-N 1 3 335.467 2.601 10 0 EFAEHO CCCCCCN(O)C(=O)NC1CCN(C2CC[NH+](C)CC2)CC1 ZINC000904167252 1107684294 /nfs/dbraw/zinc/68/42/94/1107684294.db2.gz TXLZOBRTNPIZEJ-UHFFFAOYSA-N 1 3 340.512 2.526 10 0 EFAEHO CC/C=C/CCN1CC[C@H]1CNC(=O)C1CC[NH+](CC2CC2)CC1 ZINC001483691272 1107836811 /nfs/dbraw/zinc/83/68/11/1107836811.db2.gz DWYLZCSAZUHTPG-RTLBZRNLSA-N 1 3 333.520 2.655 10 0 EFAEHO CC(C)CCC[NH2+]C/C=C/CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001483060239 1107848339 /nfs/dbraw/zinc/84/83/39/1107848339.db2.gz GMAKLKUBHULSKU-GHOSXJJBSA-N 1 3 341.515 2.897 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CCC[C@H]1C[NH2+]CCC1CCCC1 ZINC001272331096 1107849517 /nfs/dbraw/zinc/84/95/17/1107849517.db2.gz BYKHELBDSOGCGB-IRXDYDNUSA-N 1 3 332.492 2.715 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]CCC1CCCC1 ZINC001272331094 1107849962 /nfs/dbraw/zinc/84/99/62/1107849962.db2.gz BYKHELBDSOGCGB-DLBZAZTESA-N 1 3 332.492 2.715 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]CCC1CCCC1 ZINC001272331095 1107850379 /nfs/dbraw/zinc/85/03/79/1107850379.db2.gz BYKHELBDSOGCGB-IAGOWNOFSA-N 1 3 332.492 2.715 10 0 EFAEHO Cn1cc(CN2CCC3(CO[C@H](C[NH3+])C3)CC2)c(C2CCCCC2)n1 ZINC000904391840 1107880748 /nfs/dbraw/zinc/88/07/48/1107880748.db2.gz KUWAYIPYSQTRJS-SFHVURJKSA-N 1 3 346.519 2.798 10 0 EFAEHO C[C@H]([NH2+]C/C=C/CNC(=O)CN(C)CC(C)(C)C)c1ccccc1 ZINC001483060713 1107893186 /nfs/dbraw/zinc/89/31/86/1107893186.db2.gz OVKGANIULLZMIJ-FVNWOWOISA-N 1 3 331.504 2.988 10 0 EFAEHO C[C@H](NCc1ccccc1Cl)[C@H](C)NC(=O)CCC[NH+](C)C ZINC001409365797 1107934313 /nfs/dbraw/zinc/93/43/13/1107934313.db2.gz AELANTBZRLKUFZ-KBPBESRZSA-N 1 3 325.884 2.665 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NC/C=C/C[NH2+]CC2CCCC2)C1 ZINC001483061971 1107949790 /nfs/dbraw/zinc/94/97/90/1107949790.db2.gz YCDJFGQCYNCYMG-OVKVCFKUSA-N 1 3 339.499 2.651 10 0 EFAEHO c1[nH]nc2cc(CN[C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)ccc12 ZINC000904476565 1107964696 /nfs/dbraw/zinc/96/46/96/1107964696.db2.gz UELIOFMDYQWXOK-QUCCMNQESA-N 1 3 334.423 2.908 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](CC[NH2+]CCCC2CCCC2)C1 ZINC001272385125 1108140381 /nfs/dbraw/zinc/14/03/81/1108140381.db2.gz VHVQAGUSGTWHIY-OALUTQOASA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccc(CN[C@H](C)[C@H](C)NC(=O)C23CC[NH+](CC2)C3)c(Cl)c1 ZINC001409419983 1108253548 /nfs/dbraw/zinc/25/35/48/1108253548.db2.gz LFRJJTIENBKXMU-CABCVRRESA-N 1 3 349.906 2.727 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2CC2CC2)C1 ZINC001272226168 1108297977 /nfs/dbraw/zinc/29/79/77/1108297977.db2.gz RCPZEMXFVCUYLV-MOPGFXCFSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2CC2CC2)C1 ZINC001272226168 1108297983 /nfs/dbraw/zinc/29/79/83/1108297983.db2.gz RCPZEMXFVCUYLV-MOPGFXCFSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC/C=C/CN[C@@H]1CCCc2ccc(F)cc21 ZINC001483078721 1108422209 /nfs/dbraw/zinc/42/22/09/1108422209.db2.gz FTEOWUSPMBATPX-VZSQWMKGSA-N 1 3 347.478 2.807 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC/C=C/CN[C@@H]1CCCc2ccc(F)cc21 ZINC001483078721 1108422213 /nfs/dbraw/zinc/42/22/13/1108422213.db2.gz FTEOWUSPMBATPX-VZSQWMKGSA-N 1 3 347.478 2.807 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)NC/C=C/CNCc2ccc(F)cc2)C1 ZINC001483082655 1108454966 /nfs/dbraw/zinc/45/49/66/1108454966.db2.gz UBYAASCWAVPYOZ-HECAZONMSA-N 1 3 347.478 2.708 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC(C)(C)C[NH2+]Cc1ccsc1)N(C)C ZINC001409441435 1108496608 /nfs/dbraw/zinc/49/66/08/1108496608.db2.gz IMYQREWCPCYRAS-MRXNPFEDSA-N 1 3 339.549 2.909 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CC[C@@H]1CCN(C(=O)[C@H]2CCCN2C)C1 ZINC001272525142 1108616895 /nfs/dbraw/zinc/61/68/95/1108616895.db2.gz YHWOMAGJJJONNS-VQIMIIECSA-N 1 3 347.478 2.557 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]Cc2c(C)cc(C)cc2C)C1 ZINC001409275302 1109253266 /nfs/dbraw/zinc/25/32/66/1109253266.db2.gz HQUCYEBSEDNBCC-UHFFFAOYSA-N 1 3 345.531 2.938 10 0 EFAEHO CN(C)Cc1ccc(NC(=O)[C@H]2CC[N@H+](C)C2)cc1C(F)(F)F ZINC000899671736 1109437220 /nfs/dbraw/zinc/43/72/20/1109437220.db2.gz ARZKPHPSFSANRZ-LBPRGKRZSA-N 1 3 329.366 2.657 10 0 EFAEHO CN(C)Cc1ccc(NC(=O)[C@H]2CC[N@@H+](C)C2)cc1C(F)(F)F ZINC000899671736 1109437224 /nfs/dbraw/zinc/43/72/24/1109437224.db2.gz ARZKPHPSFSANRZ-LBPRGKRZSA-N 1 3 329.366 2.657 10 0 EFAEHO C[C@H](C[NH2+]C[C@H]1CCC(F)(F)C1)NC(=O)C(C)(C)N1CCCCC1 ZINC001483129559 1109438009 /nfs/dbraw/zinc/43/80/09/1109438009.db2.gz XLNBLYVADJYJRK-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO CN1C[C@H]2CC[C@@H](C1)C2[NH2+]CC1(c2ccc(F)cc2)CCOCC1 ZINC000924766505 1109527160 /nfs/dbraw/zinc/52/71/60/1109527160.db2.gz QYQXKSHLUQJLDV-MCPYQZEQSA-N 1 3 332.463 2.804 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C[NH2+]CCCc1ccccc1Cl ZINC001483188768 1109975395 /nfs/dbraw/zinc/97/53/95/1109975395.db2.gz VNIZCQJHJIQTDP-CYBMUJFWSA-N 1 3 348.878 2.641 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2csc(C)c2)C1)N(C)C ZINC001272617588 1111751637 /nfs/dbraw/zinc/75/16/37/1111751637.db2.gz XOEWNDWDXPHXIF-NVXWUHKLSA-N 1 3 337.533 2.725 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+]Cc2ccccc2C)C1 ZINC001272625572 1111763966 /nfs/dbraw/zinc/76/39/66/1111763966.db2.gz WAJFWZHMRPXTQS-GOSISDBHSA-N 1 3 331.504 2.665 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H]3CCC[C@@H]([NH+](C)C)C3)CC2)cs1 ZINC001483783011 1112457173 /nfs/dbraw/zinc/45/71/73/1112457173.db2.gz IINFXHCDSCCTCX-DLBZAZTESA-N 1 3 349.544 2.915 10 0 EFAEHO Cc1ccc(CNC2(CNC(=O)[C@H]3CCC[C@@H]([NH+](C)C)C3)CC2)cc1 ZINC001483783307 1112457509 /nfs/dbraw/zinc/45/75/09/1112457509.db2.gz LFOXCUQZBGQKIQ-RBUKOAKNSA-N 1 3 343.515 2.854 10 0 EFAEHO CC(C)=CC[N@H+](CC1CC1)C1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001483817436 1112467824 /nfs/dbraw/zinc/46/78/24/1112467824.db2.gz MDFNXIDQTJBVOU-SFHVURJKSA-N 1 3 347.547 2.997 10 0 EFAEHO CC(C)=CC[N@@H+](CC1CC1)C1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001483817436 1112467827 /nfs/dbraw/zinc/46/78/27/1112467827.db2.gz MDFNXIDQTJBVOU-SFHVURJKSA-N 1 3 347.547 2.997 10 0 EFAEHO CCc1cccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)CC[NH+](C)C)c1 ZINC001483811545 1112478583 /nfs/dbraw/zinc/47/85/83/1112478583.db2.gz QTCDQDSMOVCZDD-UXHICEINSA-N 1 3 343.515 2.766 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001483848244 1112508918 /nfs/dbraw/zinc/50/89/18/1112508918.db2.gz RPADQHRGYVESHK-AQWUKCDYSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001483848244 1112508922 /nfs/dbraw/zinc/50/89/22/1112508922.db2.gz RPADQHRGYVESHK-AQWUKCDYSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CCCCCF)CCN1C(=O)CN(C)C1CCC1 ZINC001483905495 1112565747 /nfs/dbraw/zinc/56/57/47/1112565747.db2.gz NRGMAIZEZKFRNO-JKSUJKDBSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+][C@H]1CCc2ccccc21 ZINC001483959479 1112590588 /nfs/dbraw/zinc/59/05/88/1112590588.db2.gz VJDPBOQGAARESS-HKUYNNGSSA-N 1 3 329.488 2.595 10 0 EFAEHO CCCC[NH+]1CCC(C)(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001483971570 1112602927 /nfs/dbraw/zinc/60/29/27/1112602927.db2.gz UASFPGUFFRULIP-LJQANCHMSA-N 1 3 341.515 2.970 10 0 EFAEHO Cc1ccc(C[NH+]2CCC(C)(NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001483977069 1112619031 /nfs/dbraw/zinc/61/90/31/1112619031.db2.gz SQQIIYIIDAOAFP-UHFFFAOYSA-N 1 3 331.504 2.806 10 0 EFAEHO C[C@H](C(=O)N[C@H](C[NH2+]CCCF)C1CCCC1)N1CCCCCC1 ZINC001484008612 1112657182 /nfs/dbraw/zinc/65/71/82/1112657182.db2.gz SRRLQYYGHFCAMT-SJLPKXTDSA-N 1 3 341.515 2.875 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](CNCCF)C1CCCC1)[NH+]1CCCCC1 ZINC001484014020 1112664019 /nfs/dbraw/zinc/66/40/19/1112664019.db2.gz HIEMHGXTQKQUMN-ROUUACIJSA-N 1 3 341.515 2.731 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@]2(C)CCC[N@H+](CCCCCF)C2)CCC1 ZINC001484161608 1112858101 /nfs/dbraw/zinc/85/81/01/1112858101.db2.gz XQCRACQAOJLCTK-GOSISDBHSA-N 1 3 341.515 2.829 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@]2(C)CCC[N@@H+](CCCCCF)C2)CCC1 ZINC001484161608 1112858103 /nfs/dbraw/zinc/85/81/03/1112858103.db2.gz XQCRACQAOJLCTK-GOSISDBHSA-N 1 3 341.515 2.829 10 0 EFAEHO CC[C@H](C)C[N@@H+]1CCC(F)(F)[C@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001484194633 1112906737 /nfs/dbraw/zinc/90/67/37/1112906737.db2.gz FUSKYSJDAWZZDT-LSDHHAIUSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C)C[N@H+]1CCC(F)(F)[C@H](CNC(=O)CN(C)C2CCC2)C1 ZINC001484194633 1112906743 /nfs/dbraw/zinc/90/67/43/1112906743.db2.gz FUSKYSJDAWZZDT-LSDHHAIUSA-N 1 3 345.478 2.590 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1C[N@H+](CC2CCCC2)CCC1(F)F ZINC001484195712 1112913038 /nfs/dbraw/zinc/91/30/38/1112913038.db2.gz KDKLNYPRMUEKDN-MRXNPFEDSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1C[N@@H+](CC2CCCC2)CCC1(F)F ZINC001484195712 1112913043 /nfs/dbraw/zinc/91/30/43/1112913043.db2.gz KDKLNYPRMUEKDN-MRXNPFEDSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(C)cc2)C1 ZINC001484548394 1113000806 /nfs/dbraw/zinc/00/08/06/1113000806.db2.gz DXQUWHGKMHLCOH-LJQANCHMSA-N 1 3 331.504 2.665 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]Cc2ccsc2)C1 ZINC001484551237 1113003458 /nfs/dbraw/zinc/00/34/58/1113003458.db2.gz FAHUCLAAJCXUAO-SJLPKXTDSA-N 1 3 349.544 2.951 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001484572402 1113024769 /nfs/dbraw/zinc/02/47/69/1113024769.db2.gz GLUPWUPICKMLSS-BRWVUGGUSA-N 1 3 343.531 2.977 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](Cc1cccc(F)c1)CC2 ZINC001484581514 1113034492 /nfs/dbraw/zinc/03/44/92/1113034492.db2.gz LHYWGYNOQMVGEZ-UHFFFAOYSA-N 1 3 347.478 2.592 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCC2)c(C)c1 ZINC001484662916 1113102869 /nfs/dbraw/zinc/10/28/69/1113102869.db2.gz AKXLYHUUDLLTGD-UHFFFAOYSA-N 1 3 331.504 2.772 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]1C ZINC001484987895 1117914567 /nfs/dbraw/zinc/91/45/67/1117914567.db2.gz LGHGXSFOFFEGEO-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]1C ZINC001484987895 1117914571 /nfs/dbraw/zinc/91/45/71/1117914571.db2.gz LGHGXSFOFFEGEO-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@H+](C)CCc1cccs1 ZINC001485080269 1118029215 /nfs/dbraw/zinc/02/92/15/1118029215.db2.gz SLEFYAXUJBJLMU-INIZCTEOSA-N 1 3 337.533 2.554 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[N@@H+](C)CCc1cccs1 ZINC001485080269 1118029219 /nfs/dbraw/zinc/02/92/19/1118029219.db2.gz SLEFYAXUJBJLMU-INIZCTEOSA-N 1 3 337.533 2.554 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@H]2CCc3ccccc32)C1 ZINC001485109202 1118056157 /nfs/dbraw/zinc/05/61/57/1118056157.db2.gz VHSOTXMFQCMOME-KVWWFHCMSA-N 1 3 329.488 2.500 10 0 EFAEHO CCc1ccc(CC[NH2+][C@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001485158515 1118101151 /nfs/dbraw/zinc/10/11/51/1118101151.db2.gz ZGBIOEVPUGGHHU-IAGOWNOFSA-N 1 3 345.531 2.759 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001485158925 1118101544 /nfs/dbraw/zinc/10/15/44/1118101544.db2.gz TUPSUGZLVRGXST-SJORKVTESA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001485219559 1118139601 /nfs/dbraw/zinc/13/96/01/1118139601.db2.gz YDLFPOFOSCQOSJ-KGLIPLIRSA-N 1 3 332.492 2.714 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001485214223 1118150826 /nfs/dbraw/zinc/15/08/26/1118150826.db2.gz FKMSBWUTYXTPRE-STQMWFEESA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001485230182 1118155760 /nfs/dbraw/zinc/15/57/60/1118155760.db2.gz QSDFLSLAYPJLTM-KBPBESRZSA-N 1 3 333.467 2.635 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)CC(C)(C)C[NH2+]C/C=C\Cl ZINC001485253026 1118168850 /nfs/dbraw/zinc/16/88/50/1118168850.db2.gz XITNBEHRJGWSDK-SOIVGHGOSA-N 1 3 329.916 2.688 10 0 EFAEHO CC(C)CC[NH2+]CC(C)(C)CN(C)C(=O)CN1[C@@H](C)CC[C@@H]1C ZINC001485265468 1118184102 /nfs/dbraw/zinc/18/41/02/1118184102.db2.gz AXCLBGXYQLMNKE-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)N(C)CCc1ccccc1F ZINC001485344742 1118264881 /nfs/dbraw/zinc/26/48/81/1118264881.db2.gz QAHAHFVTNXWKBX-JZXOWHBKSA-N 1 3 349.494 2.535 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)N(C)CCc1ccccc1F ZINC001485344742 1118264885 /nfs/dbraw/zinc/26/48/85/1118264885.db2.gz QAHAHFVTNXWKBX-JZXOWHBKSA-N 1 3 349.494 2.535 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)N(C)CCc1ccccc1F ZINC001485344741 1118265174 /nfs/dbraw/zinc/26/51/74/1118265174.db2.gz QAHAHFVTNXWKBX-BQFCYCMXSA-N 1 3 349.494 2.535 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)N(C)CCc1ccccc1F ZINC001485344741 1118265180 /nfs/dbraw/zinc/26/51/80/1118265180.db2.gz QAHAHFVTNXWKBX-BQFCYCMXSA-N 1 3 349.494 2.535 10 0 EFAEHO CC/C=C\CC[N@H+](C)[C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001485349490 1118271699 /nfs/dbraw/zinc/27/16/99/1118271699.db2.gz GYAJPAOXHFFJEC-BUFKOALHSA-N 1 3 341.515 2.992 10 0 EFAEHO CC/C=C\CC[N@@H+](C)[C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001485349490 1118271702 /nfs/dbraw/zinc/27/17/02/1118271702.db2.gz GYAJPAOXHFFJEC-BUFKOALHSA-N 1 3 341.515 2.992 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)CN1CCCC1)[NH2+]CC1CC(F)(F)C1 ZINC001485441525 1118353891 /nfs/dbraw/zinc/35/38/91/1118353891.db2.gz OSUJLQRXTKYRNI-MRXNPFEDSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)CN1CCCC1)[NH2+]CC1CC(F)(F)C1 ZINC001485441524 1118353999 /nfs/dbraw/zinc/35/39/99/1118353999.db2.gz OSUJLQRXTKYRNI-INIZCTEOSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]CCC(C)(C)C ZINC001485428462 1118357948 /nfs/dbraw/zinc/35/79/48/1118357948.db2.gz JNKBGWZYBBQKPX-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)C1C[NH+](CC2CCC(C)CC2)C1 ZINC001485510770 1118428217 /nfs/dbraw/zinc/42/82/17/1118428217.db2.gz SXUWROYCRFCQHE-AQFXKWCLSA-N 1 3 335.536 2.734 10 0 EFAEHO Cc1ccc(C)c(C[NH+]2CC([C@@H](C)NC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001485526576 1118437161 /nfs/dbraw/zinc/43/71/61/1118437161.db2.gz OZQUYKGIDWBEQM-SJLPKXTDSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(C)c(C[NH+]2CC([C@H](C)NC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001485526579 1118437218 /nfs/dbraw/zinc/43/72/18/1118437218.db2.gz OZQUYKGIDWBEQM-WMZOPIPTSA-N 1 3 343.515 2.582 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1C[NH+]([C@@H]2CCCc3ccccc32)C1 ZINC001485540712 1118440867 /nfs/dbraw/zinc/44/08/67/1118440867.db2.gz UETNCGAGVHZVPL-OXJNMPFZSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C1C[NH+](CC[C@@H]2CCCC2(F)F)C1 ZINC001485532938 1118444092 /nfs/dbraw/zinc/44/40/92/1118444092.db2.gz LQEVOEGCSGSYLO-HOCLYGCPSA-N 1 3 345.478 2.590 10 0 EFAEHO CCc1ccc(CN2CC([C@H](C)NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)cc1 ZINC001485534119 1118445372 /nfs/dbraw/zinc/44/53/72/1118445372.db2.gz YPMKWLYKPWSDMH-LPHOPBHVSA-N 1 3 343.515 2.527 10 0 EFAEHO CCc1ccc(CN2CC([C@H](C)NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)cc1 ZINC001485534119 1118445375 /nfs/dbraw/zinc/44/53/75/1118445375.db2.gz YPMKWLYKPWSDMH-LPHOPBHVSA-N 1 3 343.515 2.527 10 0 EFAEHO CCCCC[N@@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@@H](C)C3)C[C@@]2(C)C1 ZINC001485669195 1118517998 /nfs/dbraw/zinc/51/79/98/1118517998.db2.gz QMWVRUHYLNCDOJ-RLLQIKCJSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCCC[N@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@@H](C)C3)C[C@@]2(C)C1 ZINC001485669195 1118517999 /nfs/dbraw/zinc/51/79/99/1118517999.db2.gz QMWVRUHYLNCDOJ-RLLQIKCJSA-N 1 3 335.536 2.689 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C3CCC3)C2)c(C)s1 ZINC001485686604 1118527667 /nfs/dbraw/zinc/52/76/67/1118527667.db2.gz ZSHSIDNZUYEWCY-JCNLHEQBSA-N 1 3 349.544 2.834 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001485688531 1118528699 /nfs/dbraw/zinc/52/86/99/1118528699.db2.gz IYTCZAVQTBJFGA-YXTFVYDWSA-N 1 3 329.488 2.524 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2cccc(F)c2)C1 ZINC001485702907 1118537318 /nfs/dbraw/zinc/53/73/18/1118537318.db2.gz IDHRMGYLDXOWQE-IIDMSEBBSA-N 1 3 335.467 2.713 10 0 EFAEHO C[N@H+](CCC1CCN(c2ccncc2)CC1)C[C@@H](O)CC(F)(F)F ZINC000189807321 529877731 /nfs/dbraw/zinc/87/77/31/529877731.db2.gz JPPIKGJSEBSCGL-INIZCTEOSA-N 1 3 345.409 2.933 10 0 EFAEHO C[N@@H+](CCC1CCN(c2ccncc2)CC1)C[C@@H](O)CC(F)(F)F ZINC000189807321 529877732 /nfs/dbraw/zinc/87/77/32/529877732.db2.gz JPPIKGJSEBSCGL-INIZCTEOSA-N 1 3 345.409 2.933 10 0 EFAEHO CN(c1ccccc1C[NH2+][C@@H]1CCC[C@H]1CCO)C1CCN(C)CC1 ZINC000249432199 282600266 /nfs/dbraw/zinc/60/02/66/282600266.db2.gz HLYQEMOGZMLQNU-FXAWDEMLSA-N 1 3 345.531 2.858 10 0 EFAEHO CC[C@H]1CN(CC[NH2+]Cc2cc(Br)cs2)CCN1C ZINC000104136287 219350582 /nfs/dbraw/zinc/35/05/82/219350582.db2.gz PACPLMCOZHPGAQ-ZDUSSCGKSA-N 1 3 346.338 2.626 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000343546198 283337943 /nfs/dbraw/zinc/33/79/43/283337943.db2.gz PIPDKNBYGZRAGB-MOPGFXCFSA-N 1 3 335.536 2.975 10 0 EFAEHO CCc1ccc(CN2CCC3(CC2)c2ccccc2[C@@H]([NH3+])[C@@H]3O)nc1 ZINC000072168999 216060758 /nfs/dbraw/zinc/06/07/58/216060758.db2.gz FERHMIUKVQFYCA-UXHICEINSA-N 1 3 337.467 2.552 10 0 EFAEHO C[C@H](NC[C@@H]1CC[N@H+](C)C1)c1ccc(I)cc1 ZINC000037646832 213161102 /nfs/dbraw/zinc/16/11/02/213161102.db2.gz MRTPJLWNQUUFAC-RYUDHWBXSA-N 1 3 344.240 2.894 10 0 EFAEHO C[C@H](NC[C@@H]1CC[N@@H+](C)C1)c1ccc(I)cc1 ZINC000037646832 213161106 /nfs/dbraw/zinc/16/11/06/213161106.db2.gz MRTPJLWNQUUFAC-RYUDHWBXSA-N 1 3 344.240 2.894 10 0 EFAEHO Cc1cc(NC[C@](C)(O)C[NH+](C)C)c2cc(OC(F)F)ccc2n1 ZINC000133022394 223382473 /nfs/dbraw/zinc/38/24/73/223382473.db2.gz OCSQQLPXXJTXPF-KRWDZBQOSA-N 1 3 339.386 2.869 10 0 EFAEHO C[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000247207680 243393952 /nfs/dbraw/zinc/39/39/52/243393952.db2.gz LWMFFJPHIBUPSP-LPHOPBHVSA-N 1 3 327.472 2.591 10 0 EFAEHO C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000247207680 243393960 /nfs/dbraw/zinc/39/39/60/243393960.db2.gz LWMFFJPHIBUPSP-LPHOPBHVSA-N 1 3 327.472 2.591 10 0 EFAEHO C[C@@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)[C@@]1(C)CCCO1 ZINC000414308443 244081232 /nfs/dbraw/zinc/08/12/32/244081232.db2.gz QEUBSDZURXRXHE-IEBWSBKVSA-N 1 3 332.488 2.561 10 0 EFAEHO CC(C)C1CC([NH2+]Cc2ccc(CN3CCC(C(N)=O)CC3)cc2)C1 ZINC000414337600 244092277 /nfs/dbraw/zinc/09/22/77/244092277.db2.gz JFKDNTCVNYSORT-UHFFFAOYSA-N 1 3 343.515 2.908 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1)[C@@H]1C[C@H]1C ZINC000414336599 244093147 /nfs/dbraw/zinc/09/31/47/244093147.db2.gz IKQWLFAHMFSQJE-ZRGWGRIASA-N 1 3 329.488 2.518 10 0 EFAEHO CC(C)NC(=O)[C@@H](C)[NH2+]C1CCN([C@@H](C)Cc2ccccc2)CC1 ZINC000414344868 244095901 /nfs/dbraw/zinc/09/59/01/244095901.db2.gz OJPPQUKILAVKTN-DLBZAZTESA-N 1 3 331.504 2.585 10 0 EFAEHO CN(C)c1ncc(C[NH2+]C[C@@H]2CCCN(C)[C@H]2c2cccs2)n1C ZINC000414360547 244106334 /nfs/dbraw/zinc/10/63/34/244106334.db2.gz RDBOQALPGMPPLP-WMLDXEAASA-N 1 3 347.532 2.720 10 0 EFAEHO CN(c1ccccc1C[NH2+][C@@H]1CCC[C@@H](CO)C1)C1CCN(C)CC1 ZINC000414573768 244239536 /nfs/dbraw/zinc/23/95/36/244239536.db2.gz MHGGUHGJRNEZEF-IEBWSBKVSA-N 1 3 345.531 2.858 10 0 EFAEHO C[C@@H](c1cc2ccccc2o1)[N@H+](C)C[C@@H]1CCCN(C(=O)CN)C1 ZINC000414675847 244289242 /nfs/dbraw/zinc/28/92/42/244289242.db2.gz GSLVLFGOSDXEAW-GJZGRUSLSA-N 1 3 329.444 2.623 10 0 EFAEHO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)C[C@@H]1CCCN(C(=O)CN)C1 ZINC000414675847 244289246 /nfs/dbraw/zinc/28/92/46/244289246.db2.gz GSLVLFGOSDXEAW-GJZGRUSLSA-N 1 3 329.444 2.623 10 0 EFAEHO Cc1cc2c(ncnc2N2CCN(C[C@H]3CC[NH2+][C@H](C)C3)CC2)s1 ZINC000414752483 244326553 /nfs/dbraw/zinc/32/65/53/244326553.db2.gz KUHSECUXYADUAY-HIFRSBDPSA-N 1 3 345.516 2.510 10 0 EFAEHO C[C@H](CC(=O)NCCc1ccccc1)[NH2+]CC1(N)CCCCCC1 ZINC000414858642 244374418 /nfs/dbraw/zinc/37/44/18/244374418.db2.gz KIGJJEMSWMLKPY-QGZVFWFLSA-N 1 3 331.504 2.765 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)N[C@@H]1CC[NH2+]C[C@@H]1C ZINC000414945144 244398819 /nfs/dbraw/zinc/39/88/19/244398819.db2.gz RAMZMYFBTXXQRC-JJRVBVJISA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+][C@@H]1CCNC[C@@H]1C ZINC000414945144 244398823 /nfs/dbraw/zinc/39/88/23/244398823.db2.gz RAMZMYFBTXXQRC-JJRVBVJISA-N 1 3 337.895 2.665 10 0 EFAEHO CCN(C(=O)NC1CC[NH2+]CC1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418313754 245120125 /nfs/dbraw/zinc/12/01/25/245120125.db2.gz WEYYNQBIYMZZCN-LPHOPBHVSA-N 1 3 344.503 2.605 10 0 EFAEHO CC(C)[NH2+]C1CCN(C(=O)NC[C@@H](N)c2ccc(C(C)C)cc2)CC1 ZINC000418340199 245127555 /nfs/dbraw/zinc/12/75/55/245127555.db2.gz CDRHDSBRBLJKBS-LJQANCHMSA-N 1 3 346.519 2.982 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000418493619 245172466 /nfs/dbraw/zinc/17/24/66/245172466.db2.gz RCTMEEOLFWIZGA-INIZCTEOSA-N 1 3 344.503 2.866 10 0 EFAEHO CCN(C(=O)N[C@H](C[NH3+])C1CC1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418457225 245165113 /nfs/dbraw/zinc/16/51/13/245165113.db2.gz IGZAZQCGLOLUGZ-AYOQOUSVSA-N 1 3 344.503 2.591 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)N(C)[C@H]1CC[N@@H+](CC)C[C@@H]1C ZINC000418644564 245223906 /nfs/dbraw/zinc/22/39/06/245223906.db2.gz CHUUIJVUBNLFRO-IPELMVKDSA-N 1 3 346.519 2.621 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)N(C)[C@H]1CC[N@H+](CC)C[C@@H]1C ZINC000418644564 245223909 /nfs/dbraw/zinc/22/39/09/245223909.db2.gz CHUUIJVUBNLFRO-IPELMVKDSA-N 1 3 346.519 2.621 10 0 EFAEHO C[C@@H](CCC[NH3+])NC(=O)N1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000418700181 245250196 /nfs/dbraw/zinc/25/01/96/245250196.db2.gz JDAPXLSCATUDJX-HNNXBMFYSA-N 1 3 326.529 2.656 10 0 EFAEHO CCN(C(=O)N[C@H](C)CCC[NH3+])[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418689781 245246954 /nfs/dbraw/zinc/24/69/54/245246954.db2.gz OUZJTPQGIJQKJQ-LMMKCTJWSA-N 1 3 346.519 2.981 10 0 EFAEHO O=C(c1ccco1)N1CCC([NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCCN2)CC1 ZINC000422817066 246474917 /nfs/dbraw/zinc/47/49/17/246474917.db2.gz GOCGQEWRQANCJJ-FGTMMUONSA-N 1 3 345.487 2.785 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CCC[C@H]2CN2CCCCC2)CCCCC1 ZINC000426460164 247281789 /nfs/dbraw/zinc/28/17/89/247281789.db2.gz MGCYXNJACXTPMB-SFHVURJKSA-N 1 3 335.536 2.975 10 0 EFAEHO C[C@H]1CC2(CCC2)CN1C(=O)NC1CCN(C2CC[NH+](C)CC2)CC1 ZINC000432906386 248005262 /nfs/dbraw/zinc/00/52/62/248005262.db2.gz NFGJRLIATMESAL-INIZCTEOSA-N 1 3 348.535 2.519 10 0 EFAEHO CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+]CC(=O)NC1CCN(C2CC2)CC1 ZINC000440058041 249887584 /nfs/dbraw/zinc/88/75/84/249887584.db2.gz BIWQYYUWRSEPTC-QZTJIDSGSA-N 1 3 335.536 2.924 10 0 EFAEHO CN1CCN(CC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1(C)C ZINC000442878697 250134408 /nfs/dbraw/zinc/13/44/08/250134408.db2.gz ULOXWCLVBAXNBM-ICSRJNTNSA-N 1 3 345.531 2.770 10 0 EFAEHO CN(c1ccccc1CNCC1=CCOCC1)C1CC[NH+](C)CC1 ZINC000449401246 251015583 /nfs/dbraw/zinc/01/55/83/251015583.db2.gz GCHIYHIAMGBJQE-UHFFFAOYSA-N 1 3 329.488 2.653 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC2(CC)COC2)CC1 ZINC000449597383 251076609 /nfs/dbraw/zinc/07/66/09/251076609.db2.gz FBTXJZVCMUCQLF-UHFFFAOYSA-N 1 3 331.504 2.735 10 0 EFAEHO COC(=O)C1(CN2CC[C@@]3(C2)CCC[N@H+](Cc2ccccc2)C3)CC1 ZINC000450453028 251391903 /nfs/dbraw/zinc/39/19/03/251391903.db2.gz LFCNJXYPXMGSLX-FQEVSTJZSA-N 1 3 342.483 2.928 10 0 EFAEHO COC(=O)C1(CN2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)CC1 ZINC000450453028 251391908 /nfs/dbraw/zinc/39/19/08/251391908.db2.gz LFCNJXYPXMGSLX-FQEVSTJZSA-N 1 3 342.483 2.928 10 0 EFAEHO OCC[C@@H]1CSCCN1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000411319690 285264864 /nfs/dbraw/zinc/26/48/64/285264864.db2.gz RTEVWTSVFAYVOM-LJQANCHMSA-N 1 3 334.529 2.972 10 0 EFAEHO CN(C)CCN(C(=O)NC1CC[NH+](C2CCC2)CC1)C1CCCC1 ZINC000459092088 255820709 /nfs/dbraw/zinc/82/07/09/255820709.db2.gz FNEVKWKBIBBEHB-UHFFFAOYSA-N 1 3 336.524 2.519 10 0 EFAEHO CC[NH+](CC)[C@@H](C)CNC(=O)c1oc2ccccc2c1CN(C)C ZINC000118771120 221180450 /nfs/dbraw/zinc/18/04/50/221180450.db2.gz OPQJQOQNGGEFJV-AWEZNQCLSA-N 1 3 331.460 2.955 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN2CC[C@@H](C(C)(C)C)[C@@H](O)C2)cc1 ZINC000680476838 549331386 /nfs/dbraw/zinc/33/13/86/549331386.db2.gz URBKBWIIHVFXKA-MOPGFXCFSA-N 1 3 334.504 2.856 10 0 EFAEHO Cc1cccc(NC(=O)[C@@H]2CCC[N@@H+](CC[C@@H]3CCCN3C)C2)n1 ZINC000126008997 141365114 /nfs/dbraw/zinc/36/51/14/141365114.db2.gz RELFHCJMDNUIAO-SJORKVTESA-N 1 3 330.476 2.525 10 0 EFAEHO Cc1cccc(NC(=O)[C@@H]2CCC[N@H+](CC[C@@H]3CCCN3C)C2)n1 ZINC000126008997 141365116 /nfs/dbraw/zinc/36/51/16/141365116.db2.gz RELFHCJMDNUIAO-SJORKVTESA-N 1 3 330.476 2.525 10 0 EFAEHO C[C@@H]1CN(C(=O)C2(C[NH+](C)C)CCCCC2)CCN(C2CCC2)C1 ZINC000344766724 142075038 /nfs/dbraw/zinc/07/50/38/142075038.db2.gz FOUQHOAZUPWYQS-KRWDZBQOSA-N 1 3 335.536 2.831 10 0 EFAEHO O=C(CN[C@@H](c1cccs1)C1CC1)NC1CC[NH+](C2CC2)CC1 ZINC000347540587 142232790 /nfs/dbraw/zinc/23/27/90/142232790.db2.gz XDKUSRXZJXSAOA-GOSISDBHSA-N 1 3 333.501 2.532 10 0 EFAEHO CN(C(=O)c1ccc(C[NH+]2CCCCC2)cc1)[C@H]1CN2CCC1CC2 ZINC000347949511 142298463 /nfs/dbraw/zinc/29/84/63/142298463.db2.gz NIDLDJNMPIWVPA-FQEVSTJZSA-N 1 3 341.499 2.839 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC[C@@H](C)[N@H+](C)Cc1ccccc1 ZINC000349648472 142343350 /nfs/dbraw/zinc/34/33/50/142343350.db2.gz ZUIXTLWGLLGDOC-MJGOQNOKSA-N 1 3 331.504 2.888 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000349648472 142343352 /nfs/dbraw/zinc/34/33/52/142343352.db2.gz ZUIXTLWGLLGDOC-MJGOQNOKSA-N 1 3 331.504 2.888 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000341341102 145036032 /nfs/dbraw/zinc/03/60/32/145036032.db2.gz FEMPRYSIFPBOQW-FGTMMUONSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000341341102 145036034 /nfs/dbraw/zinc/03/60/34/145036034.db2.gz FEMPRYSIFPBOQW-FGTMMUONSA-N 1 3 336.524 2.519 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)NCCN1CCCC[C@H]1C ZINC000342964384 145231333 /nfs/dbraw/zinc/23/13/33/145231333.db2.gz FNSGXZKCWBRMJF-MSOLQXFVSA-N 1 3 338.540 2.815 10 0 EFAEHO CCCC[N@H+]1CCCC[C@H]1CNC(=O)NCCN1CCCC[C@H]1C ZINC000342964384 145231336 /nfs/dbraw/zinc/23/13/36/145231336.db2.gz FNSGXZKCWBRMJF-MSOLQXFVSA-N 1 3 338.540 2.815 10 0 EFAEHO Cc1ccccc1[C@H](NCC(=O)NC1CC[NH+](C2CC2)CC1)C1CC1 ZINC000343616137 145253356 /nfs/dbraw/zinc/25/33/56/145253356.db2.gz UKVAMDVJGJCZPX-OAQYLSRUSA-N 1 3 341.499 2.779 10 0 EFAEHO CN(C[C@H]1CC=CCC1)C(=O)NC1CCN(C2CC[NH+](C)CC2)CC1 ZINC000343681306 145270261 /nfs/dbraw/zinc/27/02/61/145270261.db2.gz GDOQXLOBTBJHSF-KRWDZBQOSA-N 1 3 348.535 2.543 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+]Cc2cc(-n3ccnc3)cs2)C[C@@H](C)O1 ZINC000344112289 145371075 /nfs/dbraw/zinc/37/10/75/145371075.db2.gz LGTFFIMXYGQGGU-HZPDHXFCSA-N 1 3 348.516 2.913 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)Cc1c(C)cc(OC)nc1C ZINC000349034004 146040467 /nfs/dbraw/zinc/04/04/67/146040467.db2.gz BRKDARRQJLLYNF-GOSISDBHSA-N 1 3 348.535 2.555 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)Cc1c(C)cc(OC)nc1C ZINC000349034004 146040468 /nfs/dbraw/zinc/04/04/68/146040468.db2.gz BRKDARRQJLLYNF-GOSISDBHSA-N 1 3 348.535 2.555 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)Cc1cc(C)c(O)c(C)c1 ZINC000349062432 146045396 /nfs/dbraw/zinc/04/53/96/146045396.db2.gz LVBVHTINUUBHNN-LJQANCHMSA-N 1 3 333.520 2.857 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)Cc1cc(C)c(O)c(C)c1 ZINC000349062432 146045398 /nfs/dbraw/zinc/04/53/98/146045398.db2.gz LVBVHTINUUBHNN-LJQANCHMSA-N 1 3 333.520 2.857 10 0 EFAEHO C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000351890992 146227767 /nfs/dbraw/zinc/22/77/67/146227767.db2.gz WALKLTNEEOXPTR-BBWFWOEESA-N 1 3 338.540 2.621 10 0 EFAEHO COC(C)(C)CCN1CCN([C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000352876563 146338379 /nfs/dbraw/zinc/33/83/79/146338379.db2.gz NWJCPBIRNXQFGI-FQEVSTJZSA-N 1 3 345.531 2.694 10 0 EFAEHO COC(C)(C)CCN1CCN([C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000352876563 146338381 /nfs/dbraw/zinc/33/83/81/146338381.db2.gz NWJCPBIRNXQFGI-FQEVSTJZSA-N 1 3 345.531 2.694 10 0 EFAEHO C[N@@H+]1CCCC[C@@H]1CCC(=O)NCC1CCN(c2ccncc2)CC1 ZINC000355584780 147004007 /nfs/dbraw/zinc/00/40/07/147004007.db2.gz MXTGQYCXESETSP-GOSISDBHSA-N 1 3 344.503 2.679 10 0 EFAEHO C[N@H+]1CCCC[C@@H]1CCC(=O)NCC1CCN(c2ccncc2)CC1 ZINC000355584780 147004009 /nfs/dbraw/zinc/00/40/09/147004009.db2.gz MXTGQYCXESETSP-GOSISDBHSA-N 1 3 344.503 2.679 10 0 EFAEHO CN(C)[C@@H](CNC(=O)C1(C[NH+](C)C)CCCCC1)c1ccccc1 ZINC000358898374 147931320 /nfs/dbraw/zinc/93/13/20/147931320.db2.gz FINMVGXUPTYVBC-SFHVURJKSA-N 1 3 331.504 2.918 10 0 EFAEHO O=C([C@@H]1CC12CC[NH+](CCCN1CCCCC1)CC2)N1CCCCC1 ZINC000364601937 149194184 /nfs/dbraw/zinc/19/41/84/149194184.db2.gz DMRHUSVMUHKTHZ-IBGZPJMESA-N 1 3 347.547 2.977 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NC2CC[NH+](C(C)(C)C)CC2)C1 ZINC000368126099 150045093 /nfs/dbraw/zinc/04/50/93/150045093.db2.gz OKZUZXCXAFZHSG-GOSISDBHSA-N 1 3 327.488 2.578 10 0 EFAEHO CCN1CCC[C@@H]1CNC(=[NH2+])NC[C@H]1CC[C@@H](c2ccccc2)O1 ZINC000368186505 150060784 /nfs/dbraw/zinc/06/07/84/150060784.db2.gz SOAUZNDUKJMSRY-KURKYZTESA-N 1 3 330.476 2.505 10 0 EFAEHO O=C(NC1CC([NH+]2CCCCC2)C1)N1CCN(C2CCCCC2)CC1 ZINC000373500522 151179850 /nfs/dbraw/zinc/17/98/50/151179850.db2.gz FDZFLMIPQJZQGW-UHFFFAOYSA-N 1 3 348.535 2.663 10 0 EFAEHO CCO[C@@H]1C[C@H](NCCC[NH+]2C[C@@H](C)C[C@H](C)C2)C12CCOCC2 ZINC000248974405 286385464 /nfs/dbraw/zinc/38/54/64/286385464.db2.gz HHGNYFMTLPPGRG-CADBVGFASA-N 1 3 338.536 2.918 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]CCCN2C[C@@H](C)C[C@H](C)C2)C12CCOCC2 ZINC000248974405 286385465 /nfs/dbraw/zinc/38/54/65/286385465.db2.gz HHGNYFMTLPPGRG-CADBVGFASA-N 1 3 338.536 2.918 10 0 EFAEHO C[C@@H](NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1CCCC[NH2+]1 ZINC000423081081 287009777 /nfs/dbraw/zinc/00/97/77/287009777.db2.gz BBPAIRKVKCWCOF-TWRYWWQQSA-N 1 3 333.442 2.912 10 0 EFAEHO C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)NCCN2CCCC[C@H]2C)C1 ZINC000338295886 287344305 /nfs/dbraw/zinc/34/43/05/287344305.db2.gz JJYHLYOHNQKCBJ-IAGOWNOFSA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NCCN2CCCC[C@H]2C)C1 ZINC000338295886 287344306 /nfs/dbraw/zinc/34/43/06/287344306.db2.gz JJYHLYOHNQKCBJ-IAGOWNOFSA-N 1 3 338.540 2.671 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+](C)[C@@H](C)Cc2ccc(O)cc2)CC1 ZINC000192761139 265307844 /nfs/dbraw/zinc/30/78/44/265307844.db2.gz BGCFKYWSUZJKNJ-SFHVURJKSA-N 1 3 333.520 2.671 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+](C)[C@@H](C)Cc2ccc(O)cc2)CC1 ZINC000192761139 265307852 /nfs/dbraw/zinc/30/78/52/265307852.db2.gz BGCFKYWSUZJKNJ-SFHVURJKSA-N 1 3 333.520 2.671 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000194143566 265364001 /nfs/dbraw/zinc/36/40/01/265364001.db2.gz ZIUMLRDJMCCZDZ-LJQANCHMSA-N 1 3 344.503 2.566 10 0 EFAEHO CCCC[N@H+](C)CC1CCN(C(=O)N[C@@H]2CCCN(CC)C2)CC1 ZINC000194170136 265365766 /nfs/dbraw/zinc/36/57/66/265365766.db2.gz HFNWQOIJUIXBAH-GOSISDBHSA-N 1 3 338.540 2.624 10 0 EFAEHO CCCC[N@@H+](C)CC1CCN(C(=O)N[C@@H]2CCCN(CC)C2)CC1 ZINC000194170136 265365767 /nfs/dbraw/zinc/36/57/67/265365767.db2.gz HFNWQOIJUIXBAH-GOSISDBHSA-N 1 3 338.540 2.624 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)c1ccc(-c2ccc(F)cc2)o1 ZINC000103211272 273000885 /nfs/dbraw/zinc/00/08/85/273000885.db2.gz PUAMVXIWWNTLIT-UHFFFAOYSA-N 1 3 347.434 2.651 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000107835468 273008300 /nfs/dbraw/zinc/00/83/00/273008300.db2.gz BSDJEBVKXYIQQW-QZTJIDSGSA-N 1 3 338.540 2.623 10 0 EFAEHO CCc1ccc([C@@H](CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)N(C)C)cc1 ZINC000279121537 273179162 /nfs/dbraw/zinc/17/91/62/273179162.db2.gz CVDCAZHYQAEWJS-ZYSHUDEJSA-N 1 3 331.504 2.698 10 0 EFAEHO CCc1ccc([C@@H](CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)N(C)C)cc1 ZINC000279121537 273179164 /nfs/dbraw/zinc/17/91/64/273179164.db2.gz CVDCAZHYQAEWJS-ZYSHUDEJSA-N 1 3 331.504 2.698 10 0 EFAEHO CN(C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)c1 ZINC000282057668 273508304 /nfs/dbraw/zinc/50/83/04/273508304.db2.gz GQHSEKZDKCGFLB-GGPKGHCWSA-N 1 3 329.488 2.646 10 0 EFAEHO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]C2CCN(CCN(C)C)CC2)cc1 ZINC000284060284 273792018 /nfs/dbraw/zinc/79/20/18/273792018.db2.gz AIFVMRFCULPAGI-MAODMQOUSA-N 1 3 345.531 2.803 10 0 EFAEHO CCC[NH2+]CCNC(=O)N(CC)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418469748 276017127 /nfs/dbraw/zinc/01/71/27/276017127.db2.gz KPSYQBWEYIUQGV-IEBWSBKVSA-N 1 3 346.519 2.853 10 0 EFAEHO CCC[C@H](C(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)N(C)C ZINC000162357370 276037136 /nfs/dbraw/zinc/03/71/36/276037136.db2.gz MKEJONLLNMIKRN-RTBURBONSA-N 1 3 331.504 2.697 10 0 EFAEHO CCC[C@H](C(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)N(C)C ZINC000162357370 276037137 /nfs/dbraw/zinc/03/71/37/276037137.db2.gz MKEJONLLNMIKRN-RTBURBONSA-N 1 3 331.504 2.697 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3[NH2+]2)cc1 ZINC000236827320 276058332 /nfs/dbraw/zinc/05/83/32/276058332.db2.gz GAVTVINRTVTMGB-RDGPPVDQSA-N 1 3 329.488 2.847 10 0 EFAEHO CCN(C(=O)NC[C@@H]1CCC[NH2+]1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418379837 276062291 /nfs/dbraw/zinc/06/22/91/276062291.db2.gz WJNSROVSQNPBCZ-WDSOQIARSA-N 1 3 344.503 2.605 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)N[C@@H](CN(C)C)c2ccccc2)CC1 ZINC000173561628 276148763 /nfs/dbraw/zinc/14/87/63/276148763.db2.gz UHAMXGGXMAGAJJ-IBGZPJMESA-N 1 3 346.519 2.711 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000245428508 276168674 /nfs/dbraw/zinc/16/86/74/276168674.db2.gz XISJXBILCNWBPS-PKOBYXMFSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000245428508 276168675 /nfs/dbraw/zinc/16/86/75/276168675.db2.gz XISJXBILCNWBPS-PKOBYXMFSA-N 1 3 346.519 2.633 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C)C[C@@H]2CCC[C@H]2O)CC1 ZINC000355086837 276262877 /nfs/dbraw/zinc/26/28/77/276262877.db2.gz LBMUHPHFZVWDLJ-PZJWPPBQSA-N 1 3 345.531 2.811 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C)C[C@@H]2CCC[C@H]2O)CC1 ZINC000355086837 276262879 /nfs/dbraw/zinc/26/28/79/276262879.db2.gz LBMUHPHFZVWDLJ-PZJWPPBQSA-N 1 3 345.531 2.811 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cc(F)ccc2N2CCOCC2)[C@H]2CCC[C@@H]21 ZINC000353524757 277172425 /nfs/dbraw/zinc/17/24/25/277172425.db2.gz WVCMSQBIWQHTKF-HBFSDRIKSA-N 1 3 347.478 2.625 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@H]1CCc2c1ccc(F)c2Br ZINC000423148023 277563820 /nfs/dbraw/zinc/56/38/20/277563820.db2.gz DUVBEJMSJDVDCB-YGRLFVJLSA-N 1 3 345.256 2.919 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3[NH2+]2)cc1 ZINC000262423054 278049630 /nfs/dbraw/zinc/04/96/30/278049630.db2.gz GAVTVINRTVTMGB-MANSERQUSA-N 1 3 329.488 2.847 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(C)C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000177504536 279325828 /nfs/dbraw/zinc/32/58/28/279325828.db2.gz XISJXBILCNWBPS-MJGOQNOKSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(C)C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000177504536 279325830 /nfs/dbraw/zinc/32/58/30/279325830.db2.gz XISJXBILCNWBPS-MJGOQNOKSA-N 1 3 346.519 2.633 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H](C)C[C@@H](C)O)CC1 ZINC000088728112 292830635 /nfs/dbraw/zinc/83/06/35/292830635.db2.gz JJTGEMDJUOBYFS-QZTJIDSGSA-N 1 3 333.520 2.715 10 0 EFAEHO CCN1CC[C@H](C[NH2+]C[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000130004987 293150744 /nfs/dbraw/zinc/15/07/44/293150744.db2.gz PCEBWMWZKLHUOZ-JKSUJKDBSA-N 1 3 325.497 2.565 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@]2(C)CCCO2)CC1 ZINC000152903411 293351785 /nfs/dbraw/zinc/35/17/85/293351785.db2.gz MNCFFBBQGKJOBZ-HXUWFJFHSA-N 1 3 331.504 2.877 10 0 EFAEHO Cc1ccc2c(c1)[C@@H]([NH2+]CCCCN1CCN(C)CC1)CCCO2 ZINC000154390084 293423675 /nfs/dbraw/zinc/42/36/75/293423675.db2.gz WCTLNKOUTWFNQY-IBGZPJMESA-N 1 3 331.504 2.826 10 0 EFAEHO CN1CCC(CC(=O)Nc2cccc(OCCC[NH+](C)C)c2)CC1 ZINC000291937129 294527569 /nfs/dbraw/zinc/52/75/69/294527569.db2.gz NBHTXVHFORVCBN-UHFFFAOYSA-N 1 3 333.476 2.688 10 0 EFAEHO CC[C@H](NC1CC[NH+](CCc2ccccc2)CC1)[C@@H](O)C(F)F ZINC000294935865 295247902 /nfs/dbraw/zinc/24/79/02/295247902.db2.gz BXBJEPYSXCZMEV-DLBZAZTESA-N 1 3 326.431 2.688 10 0 EFAEHO COc1ccccc1N1CC[C@@H]([NH2+][C@@H](C)c2ccc(CN)nc2C)C1 ZINC000422870166 295368737 /nfs/dbraw/zinc/36/87/37/295368737.db2.gz BGMWIYBQZAYZEO-DOTOQJQBSA-N 1 3 340.471 2.787 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000337361958 297227996 /nfs/dbraw/zinc/22/79/96/297227996.db2.gz IQRDFZDHEBBGLZ-KURKYZTESA-N 1 3 338.540 2.528 10 0 EFAEHO Cc1cc(C)n2c(CN3CCCC4(CC[NH+](C)CC4)C3)cnc2n1 ZINC000369705647 301258109 /nfs/dbraw/zinc/25/81/09/301258109.db2.gz ZVMHMKGMQCXGKC-UHFFFAOYSA-N 1 3 327.476 2.654 10 0 EFAEHO Cc1ccncc1[C@H](C)[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000357793424 302295169 /nfs/dbraw/zinc/29/51/69/302295169.db2.gz KTZVAMDIBRTXSE-SFHVURJKSA-N 1 3 330.520 2.991 10 0 EFAEHO [NH3+]CCCN[C@@H](c1cccc(Br)c1)C1CCOCC1 ZINC000423197254 303379565 /nfs/dbraw/zinc/37/95/65/303379565.db2.gz YPQUWRYBDMVSRO-OAHLLOKOSA-N 1 3 327.266 2.855 10 0 EFAEHO O=C(NCCCC[NH+]1CCCC1)N1CCC[C@@H]1CN1CCCCC1 ZINC000105134168 303765873 /nfs/dbraw/zinc/76/58/73/303765873.db2.gz UCWWHVJSZKUQFL-GOSISDBHSA-N 1 3 336.524 2.522 10 0 EFAEHO c1cc(N2CCC([NH2+]Cc3ccc(C4OCCO4)cc3)CC2)ccn1 ZINC000298440983 310990043 /nfs/dbraw/zinc/99/00/43/310990043.db2.gz NKXCOSQAYORTIC-UHFFFAOYSA-N 1 3 339.439 2.886 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000298769701 311021898 /nfs/dbraw/zinc/02/18/98/311021898.db2.gz SZTWHARBAXENFW-QGZVFWFLSA-N 1 3 329.488 2.887 10 0 EFAEHO CC(C)[NH+]1CCC(N(C)C(=O)c2ccccc2OCCN(C)C)CC1 ZINC000299656341 311107947 /nfs/dbraw/zinc/10/79/47/311107947.db2.gz YJEARMZVETWVCC-UHFFFAOYSA-N 1 3 347.503 2.572 10 0 EFAEHO CCc1c(C)[nH+]c2ccccc2c1N1CCN(C[C@@H](O)CC)CC1 ZINC000301982134 311170241 /nfs/dbraw/zinc/17/02/41/311170241.db2.gz AEYZQQZTLUXOJU-INIZCTEOSA-N 1 3 327.472 2.999 10 0 EFAEHO CCc1c(C)nc2ccccc2c1N1CCC([N@H+](C)CCO)CC1 ZINC000302014090 311171939 /nfs/dbraw/zinc/17/19/39/311171939.db2.gz BKXFCMTWNCFDRN-UHFFFAOYSA-N 1 3 327.472 2.999 10 0 EFAEHO CCc1c(C)nc2ccccc2c1N1CCC([N@@H+](C)CCO)CC1 ZINC000302014090 311171940 /nfs/dbraw/zinc/17/19/40/311171940.db2.gz BKXFCMTWNCFDRN-UHFFFAOYSA-N 1 3 327.472 2.999 10 0 EFAEHO CCN(CC)CC(=O)N1CCN(c2cc[nH+]c3ccc(C)cc32)CC1 ZINC000302160295 311181618 /nfs/dbraw/zinc/18/16/18/311181618.db2.gz OVHISQKRXLABKR-UHFFFAOYSA-N 1 3 340.471 2.534 10 0 EFAEHO CC(C)N1CC[C@H](C[NH2+]C[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000304975745 311214531 /nfs/dbraw/zinc/21/45/31/311214531.db2.gz ZJWYLWMHIHMEJZ-IAGOWNOFSA-N 1 3 339.524 2.953 10 0 EFAEHO CON1CCC([NH2+][C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CC1 ZINC000323410648 311240267 /nfs/dbraw/zinc/24/02/67/311240267.db2.gz WDQDISGHKQNPPP-YSIASYRMSA-N 1 3 329.488 2.512 10 0 EFAEHO CC[C@H](Cn1cncn1)[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000340463115 311718323 /nfs/dbraw/zinc/71/83/23/311718323.db2.gz NRROPRHUHNBKCN-MRXNPFEDSA-N 1 3 333.505 2.620 10 0 EFAEHO Clc1ccc(OC[C@H]2CCCO2)c(CNCC[C@H]2CC[NH2+]C2)c1 ZINC000414824524 312054667 /nfs/dbraw/zinc/05/46/67/312054667.db2.gz AUMPCARJUJLLIZ-RHSMWYFYSA-N 1 3 338.879 2.987 10 0 EFAEHO COc1c(Br)cccc1CNCC[C@H]1CCC[NH2+]C1 ZINC000414841424 312057054 /nfs/dbraw/zinc/05/70/54/312057054.db2.gz ODABWMLJHVMHQP-GFCCVEGCSA-N 1 3 327.266 2.937 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1ccccc1Cl)N[C@@H]1CC[NH2+]C[C@@H]1C ZINC000414940419 312067874 /nfs/dbraw/zinc/06/78/74/312067874.db2.gz KJEXTTSNEPZISI-JJRVBVJISA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+][C@@H]1CCNC[C@@H]1C ZINC000414940419 312067877 /nfs/dbraw/zinc/06/78/77/312067877.db2.gz KJEXTTSNEPZISI-JJRVBVJISA-N 1 3 337.895 2.665 10 0 EFAEHO COCC1(CNCc2ccc(-c3ccncc3)cc2F)CC[NH2+]CC1 ZINC000414980751 312071041 /nfs/dbraw/zinc/07/10/41/312071041.db2.gz WLWARIJXMKSPSU-UHFFFAOYSA-N 1 3 343.446 2.994 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000415057049 312085166 /nfs/dbraw/zinc/08/51/66/312085166.db2.gz SZFLWACSCASSLW-QFBILLFUSA-N 1 3 325.460 2.540 10 0 EFAEHO C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+][C@H]1CCCCNC1 ZINC000415070558 312087975 /nfs/dbraw/zinc/08/79/75/312087975.db2.gz QYGMGNWSIBCUTG-HOCLYGCPSA-N 1 3 337.895 2.809 10 0 EFAEHO [NH3+]CC1(O)CCN(CC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000415135284 312101111 /nfs/dbraw/zinc/10/11/11/312101111.db2.gz AUPWYPAGAPUOCA-UHFFFAOYSA-N 1 3 346.421 2.882 10 0 EFAEHO CCC[NH+]1CCC(N(C)C(=O)Nc2ccc3c(c2F)CCNC3)CC1 ZINC000415950510 312184240 /nfs/dbraw/zinc/18/42/40/312184240.db2.gz DORLPAQQMFVXFB-UHFFFAOYSA-N 1 3 348.466 2.810 10 0 EFAEHO C[NH2+]Cc1cccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c1 ZINC000415958091 312185328 /nfs/dbraw/zinc/18/53/28/312185328.db2.gz KTYWMOXSOLHCQU-MOPGFXCFSA-N 1 3 338.455 2.973 10 0 EFAEHO C[NH2+]Cc1cccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c1 ZINC000415958093 312185486 /nfs/dbraw/zinc/18/54/86/312185486.db2.gz KTYWMOXSOLHCQU-OALUTQOASA-N 1 3 338.455 2.973 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)C[C@H]1C ZINC000415961071 312185885 /nfs/dbraw/zinc/18/58/85/312185885.db2.gz QNXOHPVGRREZSC-HIFRSBDPSA-N 1 3 348.466 2.808 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)C[C@H]1C ZINC000415961071 312185886 /nfs/dbraw/zinc/18/58/86/312185886.db2.gz QNXOHPVGRREZSC-HIFRSBDPSA-N 1 3 348.466 2.808 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)NC[C@H](C)N2CCC(C)CC2)cc1 ZINC000417317342 312208421 /nfs/dbraw/zinc/20/84/21/312208421.db2.gz WJDDVIIJKKYPCU-HOTGVXAUSA-N 1 3 332.492 2.626 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)NC[C@H](N)c2ccccc2)c1 ZINC000417408904 312220794 /nfs/dbraw/zinc/22/07/94/312220794.db2.gz UYEJIMKJGDYZCY-IBGZPJMESA-N 1 3 340.471 2.638 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@H](N)c2ccccc2)c1 ZINC000417408904 312220796 /nfs/dbraw/zinc/22/07/96/312220796.db2.gz UYEJIMKJGDYZCY-IBGZPJMESA-N 1 3 340.471 2.638 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)NCCN2[C@@H](C)CCC[C@@H]2C)cc1 ZINC000417529360 312235284 /nfs/dbraw/zinc/23/52/84/312235284.db2.gz GIUXMLHNRNCIKY-JYJNAYRXSA-N 1 3 332.492 2.768 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)N1CCCC[C@H]1[C@@H](C)[NH3+])c1ccco1 ZINC000418163794 312337943 /nfs/dbraw/zinc/33/79/43/312337943.db2.gz HUDHMSWJAWMFEK-JJXSEGSLSA-N 1 3 336.480 2.620 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccco1 ZINC000418171713 312339312 /nfs/dbraw/zinc/33/93/12/312339312.db2.gz VHJLAGCBUPYXKN-PQAIKRCPSA-N 1 3 348.491 2.633 10 0 EFAEHO CC[C@H](C)N[C@@H](CNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccco1 ZINC000418171714 312339349 /nfs/dbraw/zinc/33/93/49/312339349.db2.gz VHJLAGCBUPYXKN-REOARJMMSA-N 1 3 348.491 2.633 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)N[C@H](C)[C@H](C)[NH3+])N(CC)CC)cc1 ZINC000418221896 312349434 /nfs/dbraw/zinc/34/94/34/312349434.db2.gz WIBLSTNAQVDZST-DAYGRLMNSA-N 1 3 334.508 2.667 10 0 EFAEHO CC1(C(=O)N2CCC3(CC[NH2+]3)CC2)CCN(Cc2ccccc2)CC1 ZINC000424050707 312503754 /nfs/dbraw/zinc/50/37/54/312503754.db2.gz FLASBQZYVQRTTE-UHFFFAOYSA-N 1 3 341.499 2.643 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)NC(C)(C)C(C)(C)C)CC2)CC1 ZINC000458131490 313076566 /nfs/dbraw/zinc/07/65/66/313076566.db2.gz QHUQWQZPRZWHNB-UHFFFAOYSA-N 1 3 338.540 2.669 10 0 EFAEHO C[N@@H+]1CCC[C@H](CCNC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000458163935 313081859 /nfs/dbraw/zinc/08/18/59/313081859.db2.gz JUMKTWJEWDJEFL-QGZVFWFLSA-N 1 3 329.488 2.744 10 0 EFAEHO C[N@H+]1CCC[C@H](CCNC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000458163935 313081862 /nfs/dbraw/zinc/08/18/62/313081862.db2.gz JUMKTWJEWDJEFL-QGZVFWFLSA-N 1 3 329.488 2.744 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N(CCN(C)C)Cc1cccc(C)c1 ZINC000472444091 313189840 /nfs/dbraw/zinc/18/98/40/313189840.db2.gz NQSMHUSQDAMKBV-GOSISDBHSA-N 1 3 348.535 2.799 10 0 EFAEHO CC(C)C[C@H]([NH2+][C@@H]1CS[C@H](C(C)(C)C)C1)C(=O)NCCN(C)C ZINC000488436749 313484143 /nfs/dbraw/zinc/48/41/43/313484143.db2.gz VGWXEHIXCNCTMA-JYJNAYRXSA-N 1 3 343.581 2.589 10 0 EFAEHO CN(C)[C@@H](CNC(=O)C1(C[NH+](C)C)CCCCC1)Cc1ccccc1 ZINC000492911132 314174598 /nfs/dbraw/zinc/17/45/98/314174598.db2.gz HSCIQWSOWFULPU-LJQANCHMSA-N 1 3 345.531 2.788 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H]2CCOC[C@H]2C)CC1 ZINC000512884628 315528637 /nfs/dbraw/zinc/52/86/37/315528637.db2.gz GJHRPQLBXOZBBM-MOPGFXCFSA-N 1 3 345.531 2.981 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[N@H+](C)C1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000524300306 316153378 /nfs/dbraw/zinc/15/33/78/316153378.db2.gz JXKXIMQLOAMFOS-UHOSZYNNSA-N 1 3 329.488 2.622 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[N@@H+](C)C1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000524300306 316153380 /nfs/dbraw/zinc/15/33/80/316153380.db2.gz JXKXIMQLOAMFOS-UHOSZYNNSA-N 1 3 329.488 2.622 10 0 EFAEHO C[C@H](NCc1ccncc1OCCC[NH+](C)C)C1CC(F)(F)C1 ZINC000529570621 316919169 /nfs/dbraw/zinc/91/91/69/316919169.db2.gz OYNNMQAGDHVNFN-ZDUSSCGKSA-N 1 3 327.419 2.936 10 0 EFAEHO C[C@@H](NCc1ccncc1OCCC[NH+](C)C)C1CC(F)(F)C1 ZINC000529570616 316919404 /nfs/dbraw/zinc/91/94/04/316919404.db2.gz OYNNMQAGDHVNFN-CYBMUJFWSA-N 1 3 327.419 2.936 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCC1)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC000530030199 317031793 /nfs/dbraw/zinc/03/17/93/317031793.db2.gz YLMSCUURIGGHQX-RTBURBONSA-N 1 3 333.520 2.917 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCC1)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC000530030199 317031797 /nfs/dbraw/zinc/03/17/97/317031797.db2.gz YLMSCUURIGGHQX-RTBURBONSA-N 1 3 333.520 2.917 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@]1(C)COc2ccccc2O1 ZINC000530211045 317081439 /nfs/dbraw/zinc/08/14/39/317081439.db2.gz LYDJBXUQBSADDP-BFUOFWGJSA-N 1 3 327.428 2.729 10 0 EFAEHO Clc1ccccc1OCCN1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530239811 317088883 /nfs/dbraw/zinc/08/88/83/317088883.db2.gz VMIULQHBGXVMEN-MRXNPFEDSA-N 1 3 338.879 2.809 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)N(C)CCC[NH+](C)C)c1ccsc1 ZINC000541786013 317790186 /nfs/dbraw/zinc/79/01/86/317790186.db2.gz SODUAVPQHFEPBP-INIZCTEOSA-N 1 3 340.537 2.724 10 0 EFAEHO CC(C)OC[C@@H](O)CNCc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000564849000 318899857 /nfs/dbraw/zinc/89/98/57/318899857.db2.gz PGEHILLLMQYBHH-FQEVSTJZSA-N 1 3 334.504 2.794 10 0 EFAEHO [NH3+][C@@H]1CCC[C@@H]1N[C@@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 ZINC000567639696 319191313 /nfs/dbraw/zinc/19/13/13/319191313.db2.gz LKRCUBGCNUXRQZ-WQVCFCJDSA-N 1 3 332.398 2.613 10 0 EFAEHO [NH3+][C@@H]1CCC[C@H]1N[C@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 ZINC000567639693 319191581 /nfs/dbraw/zinc/19/15/81/319191581.db2.gz LKRCUBGCNUXRQZ-APHBMKBZSA-N 1 3 332.398 2.613 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+][C@H]1CCCCNC1 ZINC000568486466 319288191 /nfs/dbraw/zinc/28/81/91/319288191.db2.gz AAVXAVJVWYLWSB-JSGCOSHPSA-N 1 3 339.867 2.797 10 0 EFAEHO O[C@H](CN[C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)C1CCCCC1 ZINC000568617070 319301220 /nfs/dbraw/zinc/30/12/20/319301220.db2.gz AJUZQHQBGPACRS-NSHGMRRFSA-N 1 3 330.472 2.773 10 0 EFAEHO O=C1C[C@H](N[C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CN1C1CC1 ZINC000568984241 319336920 /nfs/dbraw/zinc/33/69/20/319336920.db2.gz SMVMOFYZWVEOPV-ROUUACIJSA-N 1 3 339.483 2.537 10 0 EFAEHO O=C1C[C@H](N[C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CN1C1CC1 ZINC000568984241 319336923 /nfs/dbraw/zinc/33/69/23/319336923.db2.gz SMVMOFYZWVEOPV-ROUUACIJSA-N 1 3 339.483 2.537 10 0 EFAEHO CCO[C@@H]1C[C@H](N[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)[C@@H]1n1cccn1 ZINC000569330375 319370473 /nfs/dbraw/zinc/37/04/73/319370473.db2.gz VGTYYAOMEVRINN-KSCVBYKOSA-N 1 3 332.492 2.502 10 0 EFAEHO CC(C)OC[C@@H](O)CNCc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000569449080 319381203 /nfs/dbraw/zinc/38/12/03/319381203.db2.gz IHWPWIBGGQCXTO-XLIONFOSSA-N 1 3 334.504 2.794 10 0 EFAEHO CC(C)OC[C@@H](O)CNCc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC000569449080 319381205 /nfs/dbraw/zinc/38/12/05/319381205.db2.gz IHWPWIBGGQCXTO-XLIONFOSSA-N 1 3 334.504 2.794 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCc2cnn(C(C)C)c2C1 ZINC000572951485 319719858 /nfs/dbraw/zinc/71/98/58/319719858.db2.gz ZOORGOVHWHMXQC-XJKSGUPXSA-N 1 3 327.476 2.834 10 0 EFAEHO CN1CCC(C[NH2+]CC2Cc3ccccc3C2)(N2CCCCC2)CC1 ZINC000573194819 319742488 /nfs/dbraw/zinc/74/24/88/319742488.db2.gz IAPJAHYLIDGLGN-UHFFFAOYSA-N 1 3 341.543 2.941 10 0 EFAEHO Cc1noc(CCN[C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)n1 ZINC000576584150 320029788 /nfs/dbraw/zinc/02/97/88/320029788.db2.gz LLOKQGKUMYCHMO-KRWDZBQOSA-N 1 3 326.444 2.707 10 0 EFAEHO Cc1noc(CCN[C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)n1 ZINC000576584150 320029791 /nfs/dbraw/zinc/02/97/91/320029791.db2.gz LLOKQGKUMYCHMO-KRWDZBQOSA-N 1 3 326.444 2.707 10 0 EFAEHO [NH3+][C@@H]1CCC[C@H](NC[C@H](CO)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000576886922 320058344 /nfs/dbraw/zinc/05/83/44/320058344.db2.gz BWWJXGDLZNXAHB-BMFZPTHFSA-N 1 3 330.394 2.716 10 0 EFAEHO N[C@@H]1CCC[C@H]([NH2+]C[C@H](CO)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000576886922 320058345 /nfs/dbraw/zinc/05/83/45/320058345.db2.gz BWWJXGDLZNXAHB-BMFZPTHFSA-N 1 3 330.394 2.716 10 0 EFAEHO C[C@H]1C[C@@H](C(C)(C)C)CCN1CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000577882953 320154268 /nfs/dbraw/zinc/15/42/68/320154268.db2.gz UZOPWFWJSQFYBQ-HOTGVXAUSA-N 1 3 335.536 2.876 10 0 EFAEHO CCO[C@@H]1C[C@@H]([NH2+]CC2(N3CCCCC3)CCN(C)CC2)C1(C)C ZINC000181827375 323252344 /nfs/dbraw/zinc/25/23/44/323252344.db2.gz QATJHBXVSUOPJX-QZTJIDSGSA-N 1 3 337.552 2.730 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NCC[C@@H](C)[NH+]1CCCCC1 ZINC000184866046 323376410 /nfs/dbraw/zinc/37/64/10/323376410.db2.gz VLOSIBXCTGQNGI-SJORKVTESA-N 1 3 326.529 2.526 10 0 EFAEHO C[NH+](C)CC1CCC(NC(=O)NCC(C)(C)N2CCCCC2)CC1 ZINC000137428580 473204920 /nfs/dbraw/zinc/20/49/20/473204920.db2.gz BKECJJZYUWQPNU-UHFFFAOYSA-N 1 3 338.540 2.671 10 0 EFAEHO O=C(CN1CCCC2(CCCCC2)C1)NC1CC[NH+](C2CC2)CC1 ZINC000111323164 473207012 /nfs/dbraw/zinc/20/70/12/473207012.db2.gz LQJCZDDQZYTMHM-UHFFFAOYSA-N 1 3 333.520 2.776 10 0 EFAEHO CCC[C@H](C(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1)N(C)C ZINC000161846764 473270777 /nfs/dbraw/zinc/27/07/77/473270777.db2.gz KKPMYXKNZFQCPI-NVXWUHKLSA-N 1 3 337.533 2.807 10 0 EFAEHO CCC[C@H](C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)N(C)C ZINC000161846764 473270783 /nfs/dbraw/zinc/27/07/83/473270783.db2.gz KKPMYXKNZFQCPI-NVXWUHKLSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)c1cccc(CN2CCCC2)c1 ZINC000176986381 473280888 /nfs/dbraw/zinc/28/08/88/473280888.db2.gz CHHFRNBVFVFLFN-LJQANCHMSA-N 1 3 329.488 2.839 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1cccc(CN2CCCC2)c1 ZINC000176986381 473280893 /nfs/dbraw/zinc/28/08/93/473280893.db2.gz CHHFRNBVFVFLFN-LJQANCHMSA-N 1 3 329.488 2.839 10 0 EFAEHO CCOC(C[NH+]1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)OCC ZINC000184979318 473289833 /nfs/dbraw/zinc/28/98/33/473289833.db2.gz WZKMVOPNUKAHIO-CALCHBBNSA-N 1 3 342.524 2.597 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@H](O)COCc2ccccc2Cl)CC[N@@H+]1C ZINC000177058709 473296644 /nfs/dbraw/zinc/29/66/44/473296644.db2.gz BBPRCBADUCMAKJ-OIISXLGYSA-N 1 3 340.895 2.632 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@H](O)COCc2ccccc2Cl)CC[N@H+]1C ZINC000177058709 473296647 /nfs/dbraw/zinc/29/66/47/473296647.db2.gz BBPRCBADUCMAKJ-OIISXLGYSA-N 1 3 340.895 2.632 10 0 EFAEHO CCN(CCNC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)C1CC1 ZINC000171155971 473304105 /nfs/dbraw/zinc/30/41/05/473304105.db2.gz RNHMDDRNJQDWGB-UHFFFAOYSA-N 1 3 344.503 2.566 10 0 EFAEHO CN(C)Cc1ccc(C(=O)N2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000112918735 473331908 /nfs/dbraw/zinc/33/19/08/473331908.db2.gz TZDPDCXTVPJMTJ-UHFFFAOYSA-N 1 3 329.488 2.696 10 0 EFAEHO CC[N@H+](Cc1ccc(C(=O)N2CCN3CCC[C@@H]3C2)cc1)C(C)C ZINC000171278833 473348251 /nfs/dbraw/zinc/34/82/51/473348251.db2.gz FAYVMEVRTNEUOT-LJQANCHMSA-N 1 3 329.488 2.837 10 0 EFAEHO CC[N@@H+](Cc1ccc(C(=O)N2CCN3CCC[C@@H]3C2)cc1)C(C)C ZINC000171278833 473348260 /nfs/dbraw/zinc/34/82/60/473348260.db2.gz FAYVMEVRTNEUOT-LJQANCHMSA-N 1 3 329.488 2.837 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CC[C@@H]([NH+]2CCCC2)C1 ZINC000171439341 473388155 /nfs/dbraw/zinc/38/81/55/473388155.db2.gz IIOMNJGXIDCWAH-LJQANCHMSA-N 1 3 327.472 2.593 10 0 EFAEHO C[C@H](Cc1ccc(O)cc1)[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000352634070 475476095 /nfs/dbraw/zinc/47/60/95/475476095.db2.gz VXAKCASMDVJKJW-GOSISDBHSA-N 1 3 345.531 2.863 10 0 EFAEHO Cc1cc(Br)cc(C)c1CN[C@@H]1CCOC[C@@H]1[C@@H](C)[NH3+] ZINC000422833144 476800705 /nfs/dbraw/zinc/80/07/05/476800705.db2.gz YPTQHQWCZIDDBO-DAXOMENPSA-N 1 3 341.293 2.908 10 0 EFAEHO C[C@@H]1OCC[C@@H]1N(CCO)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000411658600 477314438 /nfs/dbraw/zinc/31/44/38/477314438.db2.gz CQPANGNYPFXANP-PXNSSMCTSA-N 1 3 332.488 2.644 10 0 EFAEHO Cn1nc2c(c1C[NH2+]CC1CCN(c3ccncc3)CC1)CCCC2 ZINC000631105388 479897802 /nfs/dbraw/zinc/89/78/02/479897802.db2.gz NIOIDACPKQDLDF-UHFFFAOYSA-N 1 3 339.487 2.700 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C)CC2(C)COC2)CC1 ZINC000628424026 479897833 /nfs/dbraw/zinc/89/78/33/479897833.db2.gz VAIYLXXHFGRWFT-UHFFFAOYSA-N 1 3 331.504 2.687 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C)CC2(C)COC2)CC1 ZINC000628424026 479897837 /nfs/dbraw/zinc/89/78/37/479897837.db2.gz VAIYLXXHFGRWFT-UHFFFAOYSA-N 1 3 331.504 2.687 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](CNCc2ncc(Br)cc2Cl)C1 ZINC000631169020 479937261 /nfs/dbraw/zinc/93/72/61/479937261.db2.gz NWEFSBMWHILRHC-JGZJWPJOSA-N 1 3 332.673 2.927 10 0 EFAEHO CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@@H]1CCCN(CC)C1 ZINC000067408082 472028771 /nfs/dbraw/zinc/02/87/71/472028771.db2.gz QDFLMQZVGSRWID-LJQANCHMSA-N 1 3 346.519 2.764 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000054719584 472110696 /nfs/dbraw/zinc/11/06/96/472110696.db2.gz CIYDSSDIGPCPQW-ZIFCJYIRSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)NCCC[N@H+](C)Cc1ccccc1 ZINC000045125946 472375872 /nfs/dbraw/zinc/37/58/72/472375872.db2.gz SLQYGWDOOMPPMM-SFHVURJKSA-N 1 3 346.519 2.682 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)NCCC[N@@H+](C)Cc1ccccc1 ZINC000045125946 472375875 /nfs/dbraw/zinc/37/58/75/472375875.db2.gz SLQYGWDOOMPPMM-SFHVURJKSA-N 1 3 346.519 2.682 10 0 EFAEHO CCCN1CCN(c2ccccc2CNCCC[NH+]2CCCC2)CC1 ZINC000088670710 472380106 /nfs/dbraw/zinc/38/01/06/472380106.db2.gz YQSOYXZUSGFLBM-UHFFFAOYSA-N 1 3 344.547 2.794 10 0 EFAEHO CC(C)N1CCC([NH2+][C@@H]2CC(=O)N(C)[C@@H]2c2ccc(F)cc2)CC1 ZINC000097082166 472435892 /nfs/dbraw/zinc/43/58/92/472435892.db2.gz MLTWGLGTTWCIOK-IEBWSBKVSA-N 1 3 333.451 2.560 10 0 EFAEHO CCN1CCC[C@H](NC(=O)Nc2ccc(C)cc2OCC[NH+](C)C)C1 ZINC000154591787 472450430 /nfs/dbraw/zinc/45/04/30/472450430.db2.gz UEJIQFJOEQBSIW-INIZCTEOSA-N 1 3 348.491 2.541 10 0 EFAEHO CN(C)CCN(C(=O)NC1CCC(C[NH+](C)C)CC1)C1CCCC1 ZINC000119000768 472519140 /nfs/dbraw/zinc/51/91/40/472519140.db2.gz KEXAFLRRTBXLCV-UHFFFAOYSA-N 1 3 338.540 2.623 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)c2ccccc2OCC[NH+](C)C)c1 ZINC000129456266 472545001 /nfs/dbraw/zinc/54/50/01/472545001.db2.gz TYHXLKHYTFWFAX-UHFFFAOYSA-N 1 3 341.455 2.941 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@H]3CCCC34CC4)CC2)CC1 ZINC000633780468 479994868 /nfs/dbraw/zinc/99/48/68/479994868.db2.gz VDCKPVMCECPAGR-SFHVURJKSA-N 1 3 333.520 2.632 10 0 EFAEHO O=C(C[N@@H+]1CCC[C@@H]1C1CCCCC1)NC1CCN(C2CC2)CC1 ZINC000119708028 472577834 /nfs/dbraw/zinc/57/78/34/472577834.db2.gz FGLZBYMPHHZPLG-LJQANCHMSA-N 1 3 333.520 2.774 10 0 EFAEHO O=C(C[N@H+]1CCC[C@@H]1C1CCCCC1)NC1CCN(C2CC2)CC1 ZINC000119708028 472577837 /nfs/dbraw/zinc/57/78/37/472577837.db2.gz FGLZBYMPHHZPLG-LJQANCHMSA-N 1 3 333.520 2.774 10 0 EFAEHO CC[C@H]1CCCCN1CCNC(=O)NC1CCC(C[NH+](C)C)CC1 ZINC000119894462 472598148 /nfs/dbraw/zinc/59/81/48/472598148.db2.gz ASOORDSGIAHQBR-ABHNRTSZSA-N 1 3 338.540 2.671 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCc1ccc(OCCC[NH+](C)C)cc1 ZINC000103125590 472613490 /nfs/dbraw/zinc/61/34/90/472613490.db2.gz MVOSTWOROUEXLN-LJQANCHMSA-N 1 3 347.503 2.508 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H](Cc2ccccc2)C[NH+](C)C)c1 ZINC000155879090 472631433 /nfs/dbraw/zinc/63/14/33/472631433.db2.gz VFPOYTZFXMSFFE-HXUWFJFHSA-N 1 3 339.483 2.651 10 0 EFAEHO CC[NH+]1CCC(CCNCc2cc(OC)ccc2OCOC)CC1 ZINC000120170866 472642855 /nfs/dbraw/zinc/64/28/55/472642855.db2.gz QRYHWNTZOPZCEM-UHFFFAOYSA-N 1 3 336.476 2.890 10 0 EFAEHO O=C(NCCCC[NH+]1CCCC1)N1CCC[C@H]1CN1CCCCC1 ZINC000105134163 472726194 /nfs/dbraw/zinc/72/61/94/472726194.db2.gz UCWWHVJSZKUQFL-SFHVURJKSA-N 1 3 336.524 2.522 10 0 EFAEHO CC[N@@H+]1CC[C@@H](Nc2ccc(OC3CCN(C)CC3)nc2)[C@H](C)C1 ZINC000132739200 472751258 /nfs/dbraw/zinc/75/12/58/472751258.db2.gz ADNPNMKNJNLMFU-CRAIPNDOSA-N 1 3 332.492 2.697 10 0 EFAEHO CC[N@H+]1CC[C@@H](Nc2ccc(OC3CCN(C)CC3)nc2)[C@H](C)C1 ZINC000132739200 472751265 /nfs/dbraw/zinc/75/12/65/472751265.db2.gz ADNPNMKNJNLMFU-CRAIPNDOSA-N 1 3 332.492 2.697 10 0 EFAEHO COC(=O)[C@H]1C[C@@H](c2ccccc2)C[N@H+](CCCN2CCCC2)C1 ZINC000120860537 472759819 /nfs/dbraw/zinc/75/98/19/472759819.db2.gz GRLQGARQGRXSMI-MOPGFXCFSA-N 1 3 330.472 2.751 10 0 EFAEHO COC(=O)[C@H]1C[C@@H](c2ccccc2)C[N@@H+](CCCN2CCCC2)C1 ZINC000120860537 472759827 /nfs/dbraw/zinc/75/98/27/472759827.db2.gz GRLQGARQGRXSMI-MOPGFXCFSA-N 1 3 330.472 2.751 10 0 EFAEHO C[N@@H+](CC1=CCCOC1)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000121179692 472811373 /nfs/dbraw/zinc/81/13/73/472811373.db2.gz PLGYQPUKPGILDB-NRFANRHFSA-N 1 3 344.499 2.711 10 0 EFAEHO C[N@H+](CC1=CCCOC1)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000121179692 472811380 /nfs/dbraw/zinc/81/13/80/472811380.db2.gz PLGYQPUKPGILDB-NRFANRHFSA-N 1 3 344.499 2.711 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NC[C@H](C)N2CCCC[C@@H]2C)CC1 ZINC000073657589 472847014 /nfs/dbraw/zinc/84/70/14/472847014.db2.gz RTOVKAPUAVPCSE-IRXDYDNUSA-N 1 3 338.540 2.671 10 0 EFAEHO Cn1cc(CN2CCC(C[NH+]3CCCC3)CC2)c(-c2cccnc2)n1 ZINC000134204680 472885970 /nfs/dbraw/zinc/88/59/70/472885970.db2.gz TUJKPHVOVXWQJG-UHFFFAOYSA-N 1 3 339.487 2.790 10 0 EFAEHO CC[NH+](CC)[C@@H](C)CNC(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000065469528 472949946 /nfs/dbraw/zinc/94/99/46/472949946.db2.gz CWVPJNFTOYUDMP-FUHWJXTLSA-N 1 3 334.508 2.627 10 0 EFAEHO C[N@H+](CCC1CCN(c2ccncc2)CC1)C[C@H](O)COC(C)(C)C ZINC000092821642 472991535 /nfs/dbraw/zinc/99/15/35/472991535.db2.gz GMQKILJXXNMADV-IBGZPJMESA-N 1 3 349.519 2.796 10 0 EFAEHO C[N@@H+](CCC1CCN(c2ccncc2)CC1)C[C@H](O)COC(C)(C)C ZINC000092821642 472991541 /nfs/dbraw/zinc/99/15/41/472991541.db2.gz GMQKILJXXNMADV-IBGZPJMESA-N 1 3 349.519 2.796 10 0 EFAEHO CC(C)[N@@H+]1C[C@H](C)[C@H](Nc2cccc(CN3CCC(O)CC3)c2)C1 ZINC000108355417 473016675 /nfs/dbraw/zinc/01/66/75/473016675.db2.gz PEYFKWGZBTZVPI-OXJNMPFZSA-N 1 3 331.504 2.784 10 0 EFAEHO CC(C)[N@H+]1C[C@H](C)[C@H](Nc2cccc(CN3CCC(O)CC3)c2)C1 ZINC000108355417 473016682 /nfs/dbraw/zinc/01/66/82/473016682.db2.gz PEYFKWGZBTZVPI-OXJNMPFZSA-N 1 3 331.504 2.784 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@@H]2C[C@@H](C)O)CC1 ZINC000093482625 473113508 /nfs/dbraw/zinc/11/35/08/473113508.db2.gz XZAAIMSXEGYBPT-UYAOXDASSA-N 1 3 345.531 2.954 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@@H]2C[C@@H](C)O)CC1 ZINC000093482625 473113514 /nfs/dbraw/zinc/11/35/14/473113514.db2.gz XZAAIMSXEGYBPT-UYAOXDASSA-N 1 3 345.531 2.954 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@@H](CNC(=O)N[C@@H](CN(C)C)c2ccccc2)C1 ZINC000162889041 473392665 /nfs/dbraw/zinc/39/26/65/473392665.db2.gz CUFLXLGKSWFXFO-HKUYNNGSSA-N 1 3 346.519 2.566 10 0 EFAEHO CC(C)C[N@H+]1CC[C@@H](CNC(=O)N[C@@H](CN(C)C)c2ccccc2)C1 ZINC000162889041 473392672 /nfs/dbraw/zinc/39/26/72/473392672.db2.gz CUFLXLGKSWFXFO-HKUYNNGSSA-N 1 3 346.519 2.566 10 0 EFAEHO CCC[C@H](C(=O)NC[C@H](C1CC1)[N@H+](C)Cc1ccccc1)N(C)C ZINC000185332803 473396541 /nfs/dbraw/zinc/39/65/41/473396541.db2.gz ZGQMFGFLBFBOAS-RTBURBONSA-N 1 3 331.504 2.744 10 0 EFAEHO CCC[C@H](C(=O)NC[C@H](C1CC1)[N@@H+](C)Cc1ccccc1)N(C)C ZINC000185332803 473396547 /nfs/dbraw/zinc/39/65/47/473396547.db2.gz ZGQMFGFLBFBOAS-RTBURBONSA-N 1 3 331.504 2.744 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)N(CCN(C)C)C2CCCC2)CC1 ZINC000151271412 473434862 /nfs/dbraw/zinc/43/48/62/473434862.db2.gz DQGMCVKVENIWKP-UHFFFAOYSA-N 1 3 338.540 2.624 10 0 EFAEHO C[C@H](NC[C@H](O)COCc1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185711343 473495009 /nfs/dbraw/zinc/49/50/09/473495009.db2.gz JQCCHJOHGSHFHG-CUWPLCDZSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@H](NC[C@H](O)COCc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185711343 473495013 /nfs/dbraw/zinc/49/50/13/473495013.db2.gz JQCCHJOHGSHFHG-CUWPLCDZSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@H]([NH2+]C[C@H](O)COCc1ccccc1)[C@H]1CCCN(C2CCC2)C1 ZINC000185711343 473495020 /nfs/dbraw/zinc/49/50/20/473495020.db2.gz JQCCHJOHGSHFHG-CUWPLCDZSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@@H](NCC1CC[NH+](C[C@H](O)c2ccccc2)CC1)c1cnccn1 ZINC000151916198 473506877 /nfs/dbraw/zinc/50/68/77/473506877.db2.gz FQOYYZHAJTYOFQ-UZLBHIALSA-N 1 3 340.471 2.573 10 0 EFAEHO CN(C)CCOc1ccccc1C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000616983163 480042969 /nfs/dbraw/zinc/04/29/69/480042969.db2.gz JHVOWOVFZUAFHE-UHFFFAOYSA-N 1 3 347.503 2.666 10 0 EFAEHO CN1CCN(CCCC[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000166146949 473522302 /nfs/dbraw/zinc/52/23/02/473522302.db2.gz BYBMSZIDOGRVJX-TZIWHRDSSA-N 1 3 345.531 2.772 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)NCCN2CCCC[C@H]2C)C1 ZINC000178734295 473549973 /nfs/dbraw/zinc/54/99/73/473549973.db2.gz IDOUPNXFSQVHIS-MSOLQXFVSA-N 1 3 338.540 2.528 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NCCN2CCCC[C@H]2C)C1 ZINC000178734295 473549975 /nfs/dbraw/zinc/54/99/75/473549975.db2.gz IDOUPNXFSQVHIS-MSOLQXFVSA-N 1 3 338.540 2.528 10 0 EFAEHO C[C@H]([NH2+]C(C)(C)CNC(=O)N1CCN2CCC[C@@H]2C1)c1ccccc1 ZINC000172269367 473566162 /nfs/dbraw/zinc/56/61/62/473566162.db2.gz USJOXVOTRSUITI-FUHWJXTLSA-N 1 3 344.503 2.605 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCC[N@H+](C)C2CCCC2)[C@@H]1c1ccccc1 ZINC000179152824 473640683 /nfs/dbraw/zinc/64/06/83/473640683.db2.gz FZZQGZRNPVTVEP-MOPGFXCFSA-N 1 3 344.503 2.605 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCC[N@@H+](C)C2CCCC2)[C@@H]1c1ccccc1 ZINC000179152824 473640689 /nfs/dbraw/zinc/64/06/89/473640689.db2.gz FZZQGZRNPVTVEP-MOPGFXCFSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)c2cccc(CN3CCCC3)c2)CC[N@@H+]1C ZINC000127705270 473643329 /nfs/dbraw/zinc/64/33/29/473643329.db2.gz OEENARYXSNRCAZ-LPHOPBHVSA-N 1 3 329.488 2.837 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)c2cccc(CN3CCCC3)c2)CC[N@H+]1C ZINC000127705270 473643333 /nfs/dbraw/zinc/64/33/33/473643333.db2.gz OEENARYXSNRCAZ-LPHOPBHVSA-N 1 3 329.488 2.837 10 0 EFAEHO NC[C@H](NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2[NH2+]1)c1ccc2ccccc2c1 ZINC000192547765 473691180 /nfs/dbraw/zinc/69/11/80/473691180.db2.gz IMXJTAIQEZJJFD-LEAZDLGRSA-N 1 3 337.467 2.877 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3[NH2+]2)CN1Cc1ccccc1 ZINC000262655648 473706419 /nfs/dbraw/zinc/70/64/19/473706419.db2.gz CNMFJCYHGQBFJL-LGKHCZOZSA-N 1 3 341.499 2.686 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2[NH2+]1)N(C)Cc1ccccc1 ZINC000262681489 473709830 /nfs/dbraw/zinc/70/98/30/473709830.db2.gz XOECPJOQVJPJOR-LULLPPNCSA-N 1 3 329.488 2.544 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1CNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000245616114 473727745 /nfs/dbraw/zinc/72/77/45/473727745.db2.gz CYDXNYIVWOHVQS-QYZOEREBSA-N 1 3 344.503 2.605 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1CNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000245616114 473727753 /nfs/dbraw/zinc/72/77/53/473727753.db2.gz CYDXNYIVWOHVQS-QYZOEREBSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)CCc1ccc(Cl)cc1 ZINC000617504036 480247069 /nfs/dbraw/zinc/24/70/69/480247069.db2.gz FZHGMIKOEHQSQV-HNNXBMFYSA-N 1 3 339.911 2.661 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)CCc1ccc(Cl)cc1 ZINC000617504036 480247072 /nfs/dbraw/zinc/24/70/72/480247072.db2.gz FZHGMIKOEHQSQV-HNNXBMFYSA-N 1 3 339.911 2.661 10 0 EFAEHO C[C@H](C[NH+]1CCCCC1)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000245702278 473739011 /nfs/dbraw/zinc/73/90/11/473739011.db2.gz ZOAGBYJFUZVSEM-QRQLOZEOSA-N 1 3 344.503 2.605 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000617007554 480058671 /nfs/dbraw/zinc/05/86/71/480058671.db2.gz VPFYFZQWJDEWKE-RTBURBONSA-N 1 3 343.515 2.855 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)[C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000245848154 473750209 /nfs/dbraw/zinc/75/02/09/473750209.db2.gz FVXQKDIWESXNLD-LMMKCTJWSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000245848154 473750214 /nfs/dbraw/zinc/75/02/14/473750214.db2.gz FVXQKDIWESXNLD-LMMKCTJWSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)NCCCC[N@@H+]2CCCC[C@H]2C)CCN1C ZINC000246181282 473793205 /nfs/dbraw/zinc/79/32/05/473793205.db2.gz LVHYPADKPMVYEG-KURKYZTESA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)NCCCC[N@H+]2CCCC[C@H]2C)CCN1C ZINC000246181282 473793210 /nfs/dbraw/zinc/79/32/10/473793210.db2.gz LVHYPADKPMVYEG-KURKYZTESA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@H]1C[C@H](CC[NH+]2CCC(C(=O)NCCN(C)C)CC2)C[C@@H](C)C1 ZINC000246214475 473799145 /nfs/dbraw/zinc/79/91/45/473799145.db2.gz KTSPIWQFTVWFBF-PIIMJCKOSA-N 1 3 337.552 2.839 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NC[C@@H](c2ccccc2)N(C)C)CC1 ZINC000173323293 473805854 /nfs/dbraw/zinc/80/58/54/473805854.db2.gz UXFWQEXCYUHPSN-IBGZPJMESA-N 1 3 346.519 2.711 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H](CNC(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000246286731 473816592 /nfs/dbraw/zinc/81/65/92/473816592.db2.gz IDOUPNXFSQVHIS-ZWKOTPCHSA-N 1 3 338.540 2.528 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H](CNC(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000246286731 473816603 /nfs/dbraw/zinc/81/66/03/473816603.db2.gz IDOUPNXFSQVHIS-ZWKOTPCHSA-N 1 3 338.540 2.528 10 0 EFAEHO CC(C)[C@@](C)(O)C[NH+]1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000187135629 473823497 /nfs/dbraw/zinc/82/34/97/473823497.db2.gz ZUCOQKYFSFPLMS-SCTDSRPQSA-N 1 3 326.525 2.605 10 0 EFAEHO CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCC(C)(C)N1CCCCC1 ZINC000173395407 473824971 /nfs/dbraw/zinc/82/49/71/473824971.db2.gz MNHWWXRBWSYUQF-IAGOWNOFSA-N 1 3 336.524 2.519 10 0 EFAEHO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCC(C)(C)N1CCCCC1 ZINC000173395407 473824976 /nfs/dbraw/zinc/82/49/76/473824976.db2.gz MNHWWXRBWSYUQF-IAGOWNOFSA-N 1 3 336.524 2.519 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NC[C@H](C)N2CCC[C@@H](C)C2)CC1 ZINC000246320176 473828295 /nfs/dbraw/zinc/82/82/95/473828295.db2.gz NZAYZPMAIYJJAX-SJORKVTESA-N 1 3 338.540 2.528 10 0 EFAEHO C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)C1 ZINC000246352395 473836765 /nfs/dbraw/zinc/83/67/65/473836765.db2.gz PIWMGGYYSPIMDS-IXDOHACOSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)C1 ZINC000246352395 473836773 /nfs/dbraw/zinc/83/67/73/473836773.db2.gz PIWMGGYYSPIMDS-IXDOHACOSA-N 1 3 338.540 2.621 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1 ZINC000246365165 473840860 /nfs/dbraw/zinc/84/08/60/473840860.db2.gz PYTLTTVXIKWKTN-LPHOPBHVSA-N 1 3 346.519 2.762 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1 ZINC000246365165 473840871 /nfs/dbraw/zinc/84/08/71/473840871.db2.gz PYTLTTVXIKWKTN-LPHOPBHVSA-N 1 3 346.519 2.762 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000617015312 480066548 /nfs/dbraw/zinc/06/65/48/480066548.db2.gz ZOXDYTFCAKHTOG-LJQANCHMSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@H](C(=O)NCC1CCN(c2cc[nH+]cc2)CC1)N1[C@H](C)CC[C@H]1C ZINC000246457584 473869840 /nfs/dbraw/zinc/86/98/40/473869840.db2.gz PPENAOWOZDUXGL-BRWVUGGUSA-N 1 3 344.503 2.676 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2cccc(CN(C)C)c2)[C@@H](C)C1 ZINC000246516810 473889024 /nfs/dbraw/zinc/88/90/24/473889024.db2.gz UNIFPVYSYVCCAB-QFBILLFUSA-N 1 3 346.519 2.620 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)NCc2cccc(CN(C)C)c2)[C@@H](C)C1 ZINC000246516810 473889035 /nfs/dbraw/zinc/88/90/35/473889035.db2.gz UNIFPVYSYVCCAB-QFBILLFUSA-N 1 3 346.519 2.620 10 0 EFAEHO C[C@@H](O)C[NH+]1CCC(CN(C)Cc2cnc(-c3ccco3)s2)CC1 ZINC000194385652 473889129 /nfs/dbraw/zinc/88/91/29/473889129.db2.gz FJPWUSVRHYQLNR-CQSZACIVSA-N 1 3 349.500 2.928 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1)CC(C)C ZINC000246577174 473906795 /nfs/dbraw/zinc/90/67/95/473906795.db2.gz ZPULGLVZUMTQGN-BZSNNMDCSA-N 1 3 340.556 2.867 10 0 EFAEHO CC(C)[N@@H+]1C[C@@H](C)[C@H](NC(=O)NC[C@H](C)N(C)Cc2ccccc2)C1 ZINC000246732629 473945270 /nfs/dbraw/zinc/94/52/70/473945270.db2.gz APZDHLBOFBYGPN-ZIFCJYIRSA-N 1 3 346.519 2.535 10 0 EFAEHO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NC[C@H](C)N(C)Cc2ccccc2)C1 ZINC000246732629 473945275 /nfs/dbraw/zinc/94/52/75/473945275.db2.gz APZDHLBOFBYGPN-ZIFCJYIRSA-N 1 3 346.519 2.535 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)NCCCC[N@@H+]2CCCC[C@H]2C)CCN1C ZINC000173892701 473952136 /nfs/dbraw/zinc/95/21/36/473952136.db2.gz LVHYPADKPMVYEG-KZNAEPCWSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)NCCCC[N@H+]2CCCC[C@H]2C)CCN1C ZINC000173892701 473952145 /nfs/dbraw/zinc/95/21/45/473952145.db2.gz LVHYPADKPMVYEG-KZNAEPCWSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1CCC[C@](CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)([NH+](C)C)C1 ZINC000174231212 474009589 /nfs/dbraw/zinc/00/95/89/474009589.db2.gz UPNPRZUVJZWTND-MTNOOBJLSA-N 1 3 338.540 2.621 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)N2CCCN(C(C)(C)C)CC2)CC1 ZINC000608712657 480077086 /nfs/dbraw/zinc/07/70/86/480077086.db2.gz FEEQEFTXESHJOG-UHFFFAOYSA-N 1 3 338.540 2.624 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)N[C@@H](CC1CC1)c1ccccc1 ZINC000608717123 480078795 /nfs/dbraw/zinc/07/87/95/480078795.db2.gz UWBNQJHQQISOGZ-IBGZPJMESA-N 1 3 346.519 2.663 10 0 EFAEHO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N2CC[C@H](N3CC=CC3)C2)C1 ZINC000174838621 474105074 /nfs/dbraw/zinc/10/50/74/474105074.db2.gz CLKBQKJDVOFOOX-MSOLQXFVSA-N 1 3 348.535 2.543 10 0 EFAEHO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CC[C@H](N3CC=CC3)C2)C1 ZINC000174838621 474105078 /nfs/dbraw/zinc/10/50/78/474105078.db2.gz CLKBQKJDVOFOOX-MSOLQXFVSA-N 1 3 348.535 2.543 10 0 EFAEHO C[C@H](CCNC(=O)c1ccccc1OCCN(C)C)[NH+]1CCCCC1 ZINC000182248334 474133369 /nfs/dbraw/zinc/13/33/69/474133369.db2.gz ARXLDHHYJBLMFB-QGZVFWFLSA-N 1 3 347.503 2.621 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)C2C[C@H](c3ccccc3)OC2=O)CC1 ZINC000289074550 474140389 /nfs/dbraw/zinc/14/03/89/474140389.db2.gz AMIVKSKMFAYGMF-QZTJIDSGSA-N 1 3 344.455 2.529 10 0 EFAEHO CN1CC[C@H](NC(=O)c2cccc(C[NH+](C)C)c2)[C@H]1c1ccccc1 ZINC000248032106 474247393 /nfs/dbraw/zinc/24/73/93/474247393.db2.gz KMICVXMLJUOUTI-VQTJNVASSA-N 1 3 337.467 2.923 10 0 EFAEHO CC(C)CN(CC[NH+](C)C)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000248056979 474253239 /nfs/dbraw/zinc/25/32/39/474253239.db2.gz OLZHTZRCWAIXAX-OALUTQOASA-N 1 3 346.519 2.661 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CC[N@@H+]1C ZINC000248129059 474263224 /nfs/dbraw/zinc/26/32/24/474263224.db2.gz WFDPFAULFVYECF-OWYHZJEWSA-N 1 3 344.503 2.556 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CC[N@H+]1C ZINC000248129059 474263229 /nfs/dbraw/zinc/26/32/29/474263229.db2.gz WFDPFAULFVYECF-OWYHZJEWSA-N 1 3 344.503 2.556 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)Nc1ccccc1CC[NH+](C)C ZINC000275725243 474296190 /nfs/dbraw/zinc/29/61/90/474296190.db2.gz WNAORDWEFYQHEF-INIZCTEOSA-N 1 3 332.492 2.787 10 0 EFAEHO COCCOCC[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000248399745 474307519 /nfs/dbraw/zinc/30/75/19/474307519.db2.gz KDEIQCKENJLRKN-VAMGGRTRSA-N 1 3 332.488 2.540 10 0 EFAEHO COCCOCCN[C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248399745 474307523 /nfs/dbraw/zinc/30/75/23/474307523.db2.gz KDEIQCKENJLRKN-VAMGGRTRSA-N 1 3 332.488 2.540 10 0 EFAEHO COCCOCCN[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248399745 474307527 /nfs/dbraw/zinc/30/75/27/474307527.db2.gz KDEIQCKENJLRKN-VAMGGRTRSA-N 1 3 332.488 2.540 10 0 EFAEHO CC(C)NC(=O)CC[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000248400102 474307769 /nfs/dbraw/zinc/30/77/69/474307769.db2.gz KNBSNWBGUFIMLD-XUVXKRRUSA-N 1 3 343.515 2.791 10 0 EFAEHO CC(C)NC(=O)CCN[C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248400102 474307772 /nfs/dbraw/zinc/30/77/72/474307772.db2.gz KNBSNWBGUFIMLD-XUVXKRRUSA-N 1 3 343.515 2.791 10 0 EFAEHO CC(C)NC(=O)CCN[C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248400102 474307775 /nfs/dbraw/zinc/30/77/75/474307775.db2.gz KNBSNWBGUFIMLD-XUVXKRRUSA-N 1 3 343.515 2.791 10 0 EFAEHO OC[C@H]1C=C[C@@H](N[C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000248407173 474311120 /nfs/dbraw/zinc/31/11/20/474311120.db2.gz BNIYRLJICJHUPO-WRTQPQOASA-N 1 3 326.484 2.814 10 0 EFAEHO OC[C@H]1C=C[C@@H](N[C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000248407173 474311125 /nfs/dbraw/zinc/31/11/25/474311125.db2.gz BNIYRLJICJHUPO-WRTQPQOASA-N 1 3 326.484 2.814 10 0 EFAEHO OC[C@H]1C=C[C@@H]([NH2+][C@@H]2CCC[C@H]3CN(Cc4ccccc4)C[C@H]32)C1 ZINC000248407173 474311130 /nfs/dbraw/zinc/31/11/30/474311130.db2.gz BNIYRLJICJHUPO-WRTQPQOASA-N 1 3 326.484 2.814 10 0 EFAEHO CNC(=O)C(C)(C)C[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000248410050 474312454 /nfs/dbraw/zinc/31/24/54/474312454.db2.gz DAEMCIBPRDDZIQ-IPMKNSEASA-N 1 3 343.515 2.649 10 0 EFAEHO CC(C)[C@](C)(O)C[N@H+](C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000248426579 474318846 /nfs/dbraw/zinc/31/88/46/474318846.db2.gz NEOJQUXFCHLJPX-NHCUHLMSSA-N 1 3 348.531 2.771 10 0 EFAEHO CC(C)[C@](C)(O)C[N@@H+](C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000248426579 474318851 /nfs/dbraw/zinc/31/88/51/474318851.db2.gz NEOJQUXFCHLJPX-NHCUHLMSSA-N 1 3 348.531 2.771 10 0 EFAEHO CC(C)[C@@](C)(O)C[N@H+](C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000248426581 474318984 /nfs/dbraw/zinc/31/89/84/474318984.db2.gz NEOJQUXFCHLJPX-RTWAWAEBSA-N 1 3 348.531 2.771 10 0 EFAEHO CC(C)[C@@](C)(O)C[N@@H+](C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000248426581 474318990 /nfs/dbraw/zinc/31/89/90/474318990.db2.gz NEOJQUXFCHLJPX-RTWAWAEBSA-N 1 3 348.531 2.771 10 0 EFAEHO c1cn(CCC[NH2+][C@@H]2CCC[C@H]3CN(Cc4ccccc4)C[C@@H]32)nn1 ZINC000248450275 474327192 /nfs/dbraw/zinc/32/71/92/474327192.db2.gz FMPMBFNUZVBUHP-SLFFLAALSA-N 1 3 339.487 2.559 10 0 EFAEHO CN1CCC[C@H](CNC(=O)CC[NH3+])[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000237085560 474335440 /nfs/dbraw/zinc/33/54/40/474335440.db2.gz PIYXWVHHZUOQQK-CJNGLKHVSA-N 1 3 343.393 2.553 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)C2CCN(Cc3ccccc3)CC2)CC[N@@H+]1C ZINC000265915177 474383934 /nfs/dbraw/zinc/38/39/34/474383934.db2.gz AJQSERUCNZSYIB-XLIONFOSSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)C2CCN(Cc3ccccc3)CC2)CC[N@H+]1C ZINC000265915177 474383941 /nfs/dbraw/zinc/38/39/41/474383941.db2.gz AJQSERUCNZSYIB-XLIONFOSSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CCCN2Cc2ccccc2)CC[N@@H+]1C ZINC000265917573 474385932 /nfs/dbraw/zinc/38/59/32/474385932.db2.gz AZNQTAUBCWVQBJ-NZSAHSFTSA-N 1 3 329.488 2.592 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CCCN2Cc2ccccc2)CC[N@H+]1C ZINC000265917573 474385937 /nfs/dbraw/zinc/38/59/37/474385937.db2.gz AZNQTAUBCWVQBJ-NZSAHSFTSA-N 1 3 329.488 2.592 10 0 EFAEHO CCCN(CCC[NH+](C)C)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000248702073 474408835 /nfs/dbraw/zinc/40/88/35/474408835.db2.gz NEHTZUZRRXIGOY-MOPGFXCFSA-N 1 3 346.519 2.805 10 0 EFAEHO CCN(C)C(=O)[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000248747195 474423704 /nfs/dbraw/zinc/42/37/04/474423704.db2.gz BFJJARNFFBUCGE-DSLXNQLJSA-N 1 3 329.488 2.638 10 0 EFAEHO CCN1CC[C@H]([N@H+](C)Cc2ccc3c(c2)sc(=O)n3C)[C@@H](C)C1 ZINC000248796907 474439202 /nfs/dbraw/zinc/43/92/02/474439202.db2.gz ZDYIEXFDBRMEBM-ZFWWWQNUSA-N 1 3 333.501 2.762 10 0 EFAEHO CCN1CC[C@H]([N@@H+](C)Cc2ccc3c(c2)sc(=O)n3C)[C@@H](C)C1 ZINC000248796907 474439208 /nfs/dbraw/zinc/43/92/08/474439208.db2.gz ZDYIEXFDBRMEBM-ZFWWWQNUSA-N 1 3 333.501 2.762 10 0 EFAEHO NC[C@H](NC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2[NH2+]1)c1ccc2ccccc2c1 ZINC000248873336 474464984 /nfs/dbraw/zinc/46/49/84/474464984.db2.gz IMXJTAIQEZJJFD-GTAWCEEGSA-N 1 3 337.467 2.877 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CC(=O)N(C)CC1CC1 ZINC000249488925 474579084 /nfs/dbraw/zinc/57/90/84/474579084.db2.gz UWSQNTIBMHTELZ-LFUKPOHLSA-N 1 3 343.515 2.601 10 0 EFAEHO Cc1csc(C2(NCCCN3CC[NH+](C(C)C)CC3)CCC2)n1 ZINC000253397505 474737816 /nfs/dbraw/zinc/73/78/16/474737816.db2.gz ZNTQKWQDCMAJQD-UHFFFAOYSA-N 1 3 336.549 2.836 10 0 EFAEHO C[C@@H]([NH2+]CC1(N2CCCCC2)CCN(C)CC1)c1cccc(CO)c1 ZINC000305645977 474741625 /nfs/dbraw/zinc/74/16/25/474741625.db2.gz LYSKJCWVHBWWBC-GOSISDBHSA-N 1 3 345.531 2.780 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCc3ccccc3[C@@H]2C[NH3+])c1 ZINC000623066452 480126953 /nfs/dbraw/zinc/12/69/53/480126953.db2.gz IALWXHTWMLHWTL-IBGZPJMESA-N 1 3 338.455 2.838 10 0 EFAEHO O[C@H](C[NH2+][C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21)CC(F)(F)F ZINC000307951745 474813862 /nfs/dbraw/zinc/81/38/62/474813862.db2.gz VBWXKHTYJAPLHD-MWDXBVQZSA-N 1 3 342.405 2.800 10 0 EFAEHO O[C@H](CN[C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)CC(F)(F)F ZINC000307951745 474813873 /nfs/dbraw/zinc/81/38/73/474813873.db2.gz VBWXKHTYJAPLHD-MWDXBVQZSA-N 1 3 342.405 2.800 10 0 EFAEHO O[C@H](CN[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)CC(F)(F)F ZINC000307951745 474813879 /nfs/dbraw/zinc/81/38/79/474813879.db2.gz VBWXKHTYJAPLHD-MWDXBVQZSA-N 1 3 342.405 2.800 10 0 EFAEHO CN1CC[C@]2(CC[N@H+](CCCc3nc(-c4ccccc4)no3)C2)C1 ZINC000292069466 474832173 /nfs/dbraw/zinc/83/21/73/474832173.db2.gz DLHLNKYXCFBMEI-IBGZPJMESA-N 1 3 326.444 2.697 10 0 EFAEHO CN1CC[C@]2(CC[N@@H+](CCCc3nc(-c4ccccc4)no3)C2)C1 ZINC000292069466 474832179 /nfs/dbraw/zinc/83/21/79/474832179.db2.gz DLHLNKYXCFBMEI-IBGZPJMESA-N 1 3 326.444 2.697 10 0 EFAEHO CCC[C@@H](NCC(=O)NC1CC[NH+](C2CC2)CC1)c1ccccc1 ZINC000341037498 474902854 /nfs/dbraw/zinc/90/28/54/474902854.db2.gz MBDZKMYXPVCRGV-LJQANCHMSA-N 1 3 329.488 2.860 10 0 EFAEHO CC[NH+]1CCC(NC(=O)CN[C@H](c2cccc(C)c2)C(C)C)CC1 ZINC000625984216 480134124 /nfs/dbraw/zinc/13/41/24/480134124.db2.gz OKPQAUYJJXQQNB-FQEVSTJZSA-N 1 3 331.504 2.882 10 0 EFAEHO Cn1ccnc1COc1ccc(C[N@H+]2CC[C@]3(CCN(C)C3)C2)cc1 ZINC000292262953 474930931 /nfs/dbraw/zinc/93/09/31/474930931.db2.gz YWIHLYHLUYSYKG-FQEVSTJZSA-N 1 3 340.471 2.527 10 0 EFAEHO Cn1ccnc1COc1ccc(C[N@@H+]2CC[C@]3(CCN(C)C3)C2)cc1 ZINC000292262953 474930943 /nfs/dbraw/zinc/93/09/43/474930943.db2.gz YWIHLYHLUYSYKG-FQEVSTJZSA-N 1 3 340.471 2.527 10 0 EFAEHO Cn1ccnc1COc1ccc(C[N@H+]2CC[C@@]3(CCN(C)C3)C2)cc1 ZINC000292262954 474931011 /nfs/dbraw/zinc/93/10/11/474931011.db2.gz YWIHLYHLUYSYKG-HXUWFJFHSA-N 1 3 340.471 2.527 10 0 EFAEHO Cn1ccnc1COc1ccc(C[N@@H+]2CC[C@@]3(CCN(C)C3)C2)cc1 ZINC000292262954 474931019 /nfs/dbraw/zinc/93/10/19/474931019.db2.gz YWIHLYHLUYSYKG-HXUWFJFHSA-N 1 3 340.471 2.527 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)NCCC[N@H+](C)C1CCCCC1 ZINC000337368022 474944710 /nfs/dbraw/zinc/94/47/10/474944710.db2.gz NFOPJTDEMVATGV-QGZVFWFLSA-N 1 3 338.540 2.815 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)NCCC[N@@H+](C)C1CCCCC1 ZINC000337368022 474944720 /nfs/dbraw/zinc/94/47/20/474944720.db2.gz NFOPJTDEMVATGV-QGZVFWFLSA-N 1 3 338.540 2.815 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)c3cc[nH]c3C3CCC3)CC2)CC1 ZINC000345157313 474945190 /nfs/dbraw/zinc/94/51/90/474945190.db2.gz XFHYXAIYMWNGBK-UHFFFAOYSA-N 1 3 344.503 2.571 10 0 EFAEHO C[C@H]1CCC[C@H](C)[NH+]1CCNC(=O)NCCN(C)Cc1ccccc1 ZINC000341102097 474975675 /nfs/dbraw/zinc/97/56/75/474975675.db2.gz QBKUXCRJINAQMK-ROUUACIJSA-N 1 3 346.519 2.681 10 0 EFAEHO CN(C(=O)[C@@H]1[NH2+]CCCC1(C)C)C1CCN(Cc2ccccc2)CC1 ZINC000261564318 474982461 /nfs/dbraw/zinc/98/24/61/474982461.db2.gz HFKQOHKQGPXENQ-IBGZPJMESA-N 1 3 343.515 2.888 10 0 EFAEHO Cc1nocc1C[NH2+]CCCCN1CCN(Cc2ccccc2)CC1 ZINC000293444789 474982739 /nfs/dbraw/zinc/98/27/39/474982739.db2.gz CCMIALSGETWKST-UHFFFAOYSA-N 1 3 342.487 2.671 10 0 EFAEHO C[C@H](CC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)[C@H]1CCC[NH2+]C1 ZINC000261568486 474985209 /nfs/dbraw/zinc/98/52/09/474985209.db2.gz JDYNHRBRIIRIGM-HOJAQTOUSA-N 1 3 343.515 2.745 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)c1cc[nH]c1C1CCC1 ZINC000345206238 474989837 /nfs/dbraw/zinc/98/98/37/474989837.db2.gz VCNKNWYGIRGXKF-KRWDZBQOSA-N 1 3 346.519 2.770 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)c1cc[nH]c1C1CCC1 ZINC000345206238 474989844 /nfs/dbraw/zinc/98/98/44/474989844.db2.gz VCNKNWYGIRGXKF-KRWDZBQOSA-N 1 3 346.519 2.770 10 0 EFAEHO Cc1nocc1C[NH2+]CCCCN1CCN(c2ccccc2)CC1 ZINC000293547602 475033528 /nfs/dbraw/zinc/03/35/28/475033528.db2.gz KVKJOVWYDXBWKG-UHFFFAOYSA-N 1 3 328.460 2.675 10 0 EFAEHO O=C(CC[C@H]1CC[NH2+]C1)NCc1ccccc1CN1CCCCC1 ZINC000261794542 475065817 /nfs/dbraw/zinc/06/58/17/475065817.db2.gz DCCPVAYNBOAHNZ-KRWDZBQOSA-N 1 3 329.488 2.678 10 0 EFAEHO C[C@H](CNC(=O)NCCN1[C@H](C)CCC[C@@H]1C)C[NH+]1CCCCC1 ZINC000341471297 475070485 /nfs/dbraw/zinc/07/04/85/475070485.db2.gz ZCNBPNQUGFBXPK-KURKYZTESA-N 1 3 338.540 2.671 10 0 EFAEHO CC1(C)CN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC[C@H]1[NH3+] ZINC000261816640 475072892 /nfs/dbraw/zinc/07/28/92/475072892.db2.gz HQQOCAZGWPSDAD-SJLPKXTDSA-N 1 3 347.478 2.624 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCCN1CCOCC1(C)C ZINC000268949016 475089923 /nfs/dbraw/zinc/08/99/23/475089923.db2.gz XEZXKTCVWDRGNU-AZUAARDMSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCCN1CCOCC1(C)C ZINC000268949016 475089932 /nfs/dbraw/zinc/08/99/32/475089932.db2.gz XEZXKTCVWDRGNU-AZUAARDMSA-N 1 3 345.531 2.597 10 0 EFAEHO C[N@H+](CCNC1CCN(Cc2ccccn2)CC1)C1CCCCC1 ZINC000341512893 475103383 /nfs/dbraw/zinc/10/33/83/475103383.db2.gz KCEIUBQLEXLRJF-UHFFFAOYSA-N 1 3 330.520 2.900 10 0 EFAEHO C[N@@H+](CCNC1CCN(Cc2ccccn2)CC1)C1CCCCC1 ZINC000341512893 475103392 /nfs/dbraw/zinc/10/33/92/475103392.db2.gz KCEIUBQLEXLRJF-UHFFFAOYSA-N 1 3 330.520 2.900 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@]1(N(C)C)CCSC1 ZINC000269004630 475123286 /nfs/dbraw/zinc/12/32/86/475123286.db2.gz VTTMHGYDBPITOT-HOJAQTOUSA-N 1 3 347.572 2.924 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@H]2CCc3cc(F)c(OC)cc32)CC1 ZINC000281241328 475132474 /nfs/dbraw/zinc/13/24/74/475132474.db2.gz NEZWJFPNWQSROY-IBGZPJMESA-N 1 3 349.494 2.829 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)N1CCN(C2CCCC2)CC1 ZINC000341551965 475136852 /nfs/dbraw/zinc/13/68/52/475136852.db2.gz CTIPYCFMVHJQCJ-IAGOWNOFSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@H]1CCC[C@H](C)[NH+]1CCNC(=O)N1CCN(C2CCCC2)CC1 ZINC000341551967 475137306 /nfs/dbraw/zinc/13/73/06/475137306.db2.gz CTIPYCFMVHJQCJ-IRXDYDNUSA-N 1 3 336.524 2.519 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)Nc1c(C)ccnc1C ZINC000287453684 475153169 /nfs/dbraw/zinc/15/31/69/475153169.db2.gz IHPJITADMFPYSV-QGZVFWFLSA-N 1 3 347.507 2.578 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)Nc1c(C)ccnc1C ZINC000287453684 475153175 /nfs/dbraw/zinc/15/31/75/475153175.db2.gz IHPJITADMFPYSV-QGZVFWFLSA-N 1 3 347.507 2.578 10 0 EFAEHO C([NH2+][C@@H]1CCC[C@H]1[C@@H]1COCCN1)[C@H]1CCCN1CC1CCCCC1 ZINC000262037268 475154264 /nfs/dbraw/zinc/15/42/64/475154264.db2.gz YDYIARJRGKAEGR-NCYKPQTJSA-N 1 3 349.563 2.778 10 0 EFAEHO FC(F)COCCN(Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000262148669 475185195 /nfs/dbraw/zinc/18/51/95/475185195.db2.gz QSLWDDLVRCVQTG-CQSZACIVSA-N 1 3 330.444 2.974 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@H]2CCC[C@@H]([NH3+])C2)CCN1Cc1ccccc1 ZINC000262267219 475210586 /nfs/dbraw/zinc/21/05/86/475210586.db2.gz HOQLTVMFRANLTJ-QXCFHYIPSA-N 1 3 329.488 2.673 10 0 EFAEHO C[C@H](C[NH3+])C(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000262333856 475222215 /nfs/dbraw/zinc/22/22/15/475222215.db2.gz HBJBWCFYLJZWLD-GOSISDBHSA-N 1 3 339.483 2.742 10 0 EFAEHO c1ccc(CN2C[C@@H](C[NH2+]C3CCOCC3)C3(C2)CCOCC3)cc1 ZINC000339485946 475249789 /nfs/dbraw/zinc/24/97/89/475249789.db2.gz BEHCPEFFMGSZIR-LJQANCHMSA-N 1 3 344.499 2.684 10 0 EFAEHO CN(CCN(C)C1CC[NH+](C)CC1)Cc1cncc(C(F)(F)F)c1 ZINC000361328930 475357677 /nfs/dbraw/zinc/35/76/77/475357677.db2.gz SVDGPWFKUCENCD-UHFFFAOYSA-N 1 3 344.425 2.558 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000352596505 475446628 /nfs/dbraw/zinc/44/66/28/475446628.db2.gz BGTFZVHRVZXJMC-MISYRCLQSA-N 1 3 343.515 2.888 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000352596505 475446632 /nfs/dbraw/zinc/44/66/32/475446632.db2.gz BGTFZVHRVZXJMC-MISYRCLQSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCNC(=O)c1ccc(Nc2ccncc2)cc1 ZINC000345814456 475474677 /nfs/dbraw/zinc/47/46/77/475474677.db2.gz KKGFWVJZQKRSCE-INIZCTEOSA-N 1 3 338.455 2.851 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc(Nc2ccncc2)cc1 ZINC000345814456 475474682 /nfs/dbraw/zinc/47/46/82/475474682.db2.gz KKGFWVJZQKRSCE-INIZCTEOSA-N 1 3 338.455 2.851 10 0 EFAEHO C[C@H]([NH2+]C[C@H](CO)c1cccnc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000348202913 475483894 /nfs/dbraw/zinc/48/38/94/475483894.db2.gz BGLJJZNOXAICIX-IOMROCGXSA-N 1 3 339.483 2.658 10 0 EFAEHO C[C@H](NC[C@H](CO)c1cccnc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000348202913 475483901 /nfs/dbraw/zinc/48/39/01/475483901.db2.gz BGLJJZNOXAICIX-IOMROCGXSA-N 1 3 339.483 2.658 10 0 EFAEHO C[C@H](NC[C@H](CO)c1cccnc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000348202913 475483906 /nfs/dbraw/zinc/48/39/06/475483906.db2.gz BGLJJZNOXAICIX-IOMROCGXSA-N 1 3 339.483 2.658 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](NCCc2cnc(C3CC3)nc2)[C@H](C)C1 ZINC000358221686 475503551 /nfs/dbraw/zinc/50/35/51/475503551.db2.gz HSDMHQQSVMAYEG-VQIMIIECSA-N 1 3 346.519 2.623 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](NCCc2cnc(C3CC3)nc2)[C@H](C)C1 ZINC000358221686 475503559 /nfs/dbraw/zinc/50/35/59/475503559.db2.gz HSDMHQQSVMAYEG-VQIMIIECSA-N 1 3 346.519 2.623 10 0 EFAEHO CN(CCNC(=O)NCc1ccccc1C[NH+]1CCCCC1)C1CC1 ZINC000352662863 475503930 /nfs/dbraw/zinc/50/39/30/475503930.db2.gz CQTLXXVUIFXAJS-UHFFFAOYSA-N 1 3 344.503 2.566 10 0 EFAEHO CC(C)C[C@H](NCc1ccc2occc2c1)C(=O)NCC[NH+](C)C ZINC000352771704 475608914 /nfs/dbraw/zinc/60/89/14/475608914.db2.gz PHOKSVUNXOUDFV-KRWDZBQOSA-N 1 3 331.460 2.615 10 0 EFAEHO CN(C)[C@@H](CNC(=O)C[N@@H+](C)C[C@@H]1CC=CCC1)c1ccccc1 ZINC000355069924 475642513 /nfs/dbraw/zinc/64/25/13/475642513.db2.gz YUSHUCLQIGFLQM-MJGOQNOKSA-N 1 3 329.488 2.694 10 0 EFAEHO Cc1ccccc1C[NH+]1CCC(NC(=O)CN2CCCC2(C)C)CC1 ZINC000343050098 475721304 /nfs/dbraw/zinc/72/13/04/475721304.db2.gz WVJXPWAZGWLIEE-UHFFFAOYSA-N 1 3 343.515 2.950 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000338292906 475754298 /nfs/dbraw/zinc/75/42/98/475754298.db2.gz CIYDSSDIGPCPQW-ZHALLVOQSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000338295887 475758530 /nfs/dbraw/zinc/75/85/30/475758530.db2.gz JJYHLYOHNQKCBJ-IRXDYDNUSA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000338295887 475758535 /nfs/dbraw/zinc/75/85/35/475758535.db2.gz JJYHLYOHNQKCBJ-IRXDYDNUSA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCCN1CCCC[C@H]1C ZINC000338300247 475762604 /nfs/dbraw/zinc/76/26/04/475762604.db2.gz ZCEXDMUWNNUVCN-XWTMOSNGSA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCCN1CCCC[C@H]1C ZINC000338300247 475762609 /nfs/dbraw/zinc/76/26/09/475762609.db2.gz ZCEXDMUWNNUVCN-XWTMOSNGSA-N 1 3 338.540 2.526 10 0 EFAEHO CN(C)Cc1cccc(CNC(=O)C2(C[NH+](C)C)CCCCC2)c1 ZINC000358650715 475836336 /nfs/dbraw/zinc/83/63/36/475836336.db2.gz PXXDIXKLGVDYTB-UHFFFAOYSA-N 1 3 331.504 2.877 10 0 EFAEHO COc1ccccc1N1CC[C@H](N[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)C1 ZINC000353400602 475939591 /nfs/dbraw/zinc/93/95/91/475939591.db2.gz FZBIIIHBTOPNHM-BSDSXHPESA-N 1 3 329.488 2.736 10 0 EFAEHO COc1ccccc1N1CC[C@H](N[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@@H]32)C1 ZINC000353400602 475939595 /nfs/dbraw/zinc/93/95/95/475939595.db2.gz FZBIIIHBTOPNHM-BSDSXHPESA-N 1 3 329.488 2.736 10 0 EFAEHO CN1CC[C@H]([NH2+][C@@H]2CC(=O)N(c3c(F)cccc3F)C2)[C@@H]2CCC[C@H]21 ZINC000353410347 475945206 /nfs/dbraw/zinc/94/52/06/475945206.db2.gz WQDIPLRCGMNFMZ-OSRSDYAFSA-N 1 3 349.425 2.533 10 0 EFAEHO CN(C(=O)[C@H]1CCC[N@H+](Cc2ccccc2)C1)[C@@H]1CCN(C2CC2)C1 ZINC000347007657 476026945 /nfs/dbraw/zinc/02/69/45/476026945.db2.gz HHQCODMAAHGUTJ-AZUAARDMSA-N 1 3 341.499 2.594 10 0 EFAEHO CN(C(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1CCN(C2CC2)C1 ZINC000347007657 476026949 /nfs/dbraw/zinc/02/69/49/476026949.db2.gz HHQCODMAAHGUTJ-AZUAARDMSA-N 1 3 341.499 2.594 10 0 EFAEHO CN(C(=O)[C@H]1CCC[N@H+](Cc2ccccc2)C1)[C@H]1CCN(C2CC2)C1 ZINC000347007660 476027369 /nfs/dbraw/zinc/02/73/69/476027369.db2.gz HHQCODMAAHGUTJ-ICSRJNTNSA-N 1 3 341.499 2.594 10 0 EFAEHO CN(C(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@H]1CCN(C2CC2)C1 ZINC000347007660 476027374 /nfs/dbraw/zinc/02/73/74/476027374.db2.gz HHQCODMAAHGUTJ-ICSRJNTNSA-N 1 3 341.499 2.594 10 0 EFAEHO C[C@H](CNC(=O)CC[C@@H]1CCCC[N@@H+]1C)N(C)Cc1ccccc1 ZINC000353505859 476029244 /nfs/dbraw/zinc/02/92/44/476029244.db2.gz ZCYSHFUERJWCAS-MJGOQNOKSA-N 1 3 331.504 2.888 10 0 EFAEHO C[C@H](CNC(=O)CC[C@@H]1CCCC[N@H+]1C)N(C)Cc1ccccc1 ZINC000353505859 476029252 /nfs/dbraw/zinc/02/92/52/476029252.db2.gz ZCYSHFUERJWCAS-MJGOQNOKSA-N 1 3 331.504 2.888 10 0 EFAEHO CCOC[C@@H](C)[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340463938 476051144 /nfs/dbraw/zinc/05/11/44/476051144.db2.gz REMCSRVXLMZAMF-UYAOXDASSA-N 1 3 346.515 2.930 10 0 EFAEHO CCOC[C@@H](C)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000340463938 476051150 /nfs/dbraw/zinc/05/11/50/476051150.db2.gz REMCSRVXLMZAMF-UYAOXDASSA-N 1 3 346.515 2.930 10 0 EFAEHO CCOC[C@@H](C)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000340463938 476051156 /nfs/dbraw/zinc/05/11/56/476051156.db2.gz REMCSRVXLMZAMF-UYAOXDASSA-N 1 3 346.515 2.930 10 0 EFAEHO c1csc(C[NH+]2CCC(CNCc3cn4cccnc4n3)CC2)c1 ZINC000298352568 476065529 /nfs/dbraw/zinc/06/55/29/476065529.db2.gz JWWCPBVZGBKVSC-UHFFFAOYSA-N 1 3 341.484 2.793 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)[C@@H]2CCC[C@@H]21 ZINC000353598515 476112620 /nfs/dbraw/zinc/11/26/20/476112620.db2.gz VZNYOWXJOXWTTJ-XWSJACJDSA-N 1 3 342.487 2.755 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)[C@@H]2CCC[C@@H]21 ZINC000353598515 476112623 /nfs/dbraw/zinc/11/26/23/476112623.db2.gz VZNYOWXJOXWTTJ-XWSJACJDSA-N 1 3 342.487 2.755 10 0 EFAEHO CN1CC[C@]2(CC[N@H+](CCOc3ccc(Br)cc3)C2)C1 ZINC000336831195 476136126 /nfs/dbraw/zinc/13/61/26/476136126.db2.gz ISPVSDSIZDROKN-INIZCTEOSA-N 1 3 339.277 2.856 10 0 EFAEHO CN1CC[C@]2(CC[N@@H+](CCOc3ccc(Br)cc3)C2)C1 ZINC000336831195 476136133 /nfs/dbraw/zinc/13/61/33/476136133.db2.gz ISPVSDSIZDROKN-INIZCTEOSA-N 1 3 339.277 2.856 10 0 EFAEHO CN1CC[C@H]([NH2+]CCOc2ncccc2C(F)(F)F)[C@@H]2CCC[C@@H]21 ZINC000353635555 476141609 /nfs/dbraw/zinc/14/16/09/476141609.db2.gz ADVPRIKISDDCIO-QEJZJMRPSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCOc2ncccc2C(F)(F)F)[C@@H]2CCC[C@@H]21 ZINC000353635555 476141622 /nfs/dbraw/zinc/14/16/22/476141622.db2.gz ADVPRIKISDDCIO-QEJZJMRPSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@H+]1CC[C@H](NCCOc2ncccc2C(F)(F)F)[C@@H]2CCC[C@@H]21 ZINC000353635555 476141629 /nfs/dbraw/zinc/14/16/29/476141629.db2.gz ADVPRIKISDDCIO-QEJZJMRPSA-N 1 3 343.393 2.942 10 0 EFAEHO Cc1nc(C)c([C@H](C)N[C@@H](CC(C)C)C(=O)NCC[NH+](C)C)s1 ZINC000347182725 476155952 /nfs/dbraw/zinc/15/59/52/476155952.db2.gz AKEBHLMGQJIXTE-ZFWWWQNUSA-N 1 3 340.537 2.503 10 0 EFAEHO CCN1CC[C@H]([N@H+](C)Cc2cc(OC)c3c(c2)OCCO3)C[C@@H]1C ZINC000353754888 476250605 /nfs/dbraw/zinc/25/06/05/476250605.db2.gz RFTXNBBLULTMBI-HOCLYGCPSA-N 1 3 334.460 2.771 10 0 EFAEHO CCN1CC[C@H]([N@@H+](C)Cc2cc(OC)c3c(c2)OCCO3)C[C@@H]1C ZINC000353754888 476250612 /nfs/dbraw/zinc/25/06/12/476250612.db2.gz RFTXNBBLULTMBI-HOCLYGCPSA-N 1 3 334.460 2.771 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000362532666 476299339 /nfs/dbraw/zinc/29/93/39/476299339.db2.gz YCKCYKPRSBNWNI-WOJBJXKFSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000362532666 476299343 /nfs/dbraw/zinc/29/93/43/476299343.db2.gz YCKCYKPRSBNWNI-WOJBJXKFSA-N 1 3 343.515 2.841 10 0 EFAEHO C[N@@H+]1CCCC[C@H]1CCC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000352219951 476560169 /nfs/dbraw/zinc/56/01/69/476560169.db2.gz UAFGGKKTDMUJMG-IBGZPJMESA-N 1 3 335.536 2.975 10 0 EFAEHO C[N@H+]1CCCC[C@H]1CCC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000352219951 476560173 /nfs/dbraw/zinc/56/01/73/476560173.db2.gz UAFGGKKTDMUJMG-IBGZPJMESA-N 1 3 335.536 2.975 10 0 EFAEHO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)CCN1CCc2ccccc2C1 ZINC000354336593 476594517 /nfs/dbraw/zinc/59/45/17/476594517.db2.gz XTBVIMXORUEJKF-QZTJIDSGSA-N 1 3 343.515 2.671 10 0 EFAEHO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)CCN1CCc2ccccc2C1 ZINC000354336593 476594527 /nfs/dbraw/zinc/59/45/27/476594527.db2.gz XTBVIMXORUEJKF-QZTJIDSGSA-N 1 3 343.515 2.671 10 0 EFAEHO C[C@H](CC[NH+](C)C)NC(=O)N1CCN(Cc2ccccc2)CC[C@H]1C ZINC000370004566 476626705 /nfs/dbraw/zinc/62/67/05/476626705.db2.gz CLCHRAKZYVJECF-QZTJIDSGSA-N 1 3 346.519 2.633 10 0 EFAEHO CCC[NH+]1CCC(NC[C@H](CO)Cc2ccc(F)c(F)c2)CC1 ZINC000357844608 476645259 /nfs/dbraw/zinc/64/52/59/476645259.db2.gz FHOLRVGDWOBZSJ-OAHLLOKOSA-N 1 3 326.431 2.580 10 0 EFAEHO C(=C\C[N@@H+]1CCC[C@@]2(CCOC2)C1)\CN1CCC[C@]2(CCOC2)C1 ZINC000451912946 476721113 /nfs/dbraw/zinc/72/11/13/476721113.db2.gz VLIBMYYGMMEZBC-DZNLNZEASA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C\C[N@H+]1CCC[C@@]2(CCOC2)C1)\CN1CCC[C@]2(CCOC2)C1 ZINC000451912946 476721120 /nfs/dbraw/zinc/72/11/20/476721120.db2.gz VLIBMYYGMMEZBC-DZNLNZEASA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C\C[N@@H+]1CCC[C@]2(CCOC2)C1)\CN1CCC[C@@]2(CCOC2)C1 ZINC000451912946 476721125 /nfs/dbraw/zinc/72/11/25/476721125.db2.gz VLIBMYYGMMEZBC-DZNLNZEASA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C\C[N@H+]1CCC[C@]2(CCOC2)C1)\CN1CCC[C@@]2(CCOC2)C1 ZINC000451912946 476721128 /nfs/dbraw/zinc/72/11/28/476721128.db2.gz VLIBMYYGMMEZBC-DZNLNZEASA-N 1 3 334.504 2.548 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H](Cc1ccccc1)CN(C)C ZINC000422709142 476737661 /nfs/dbraw/zinc/73/76/61/476737661.db2.gz CWOTVVCRQFIEDH-LPHOPBHVSA-N 1 3 326.488 2.672 10 0 EFAEHO Cc1cccc2[nH]cc(CCN[C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)c21 ZINC000422716436 476741638 /nfs/dbraw/zinc/74/16/38/476741638.db2.gz NDVRTDVIFDWTSR-KZNAEPCWSA-N 1 3 327.472 2.766 10 0 EFAEHO CC(C)(C)[C@@H](O)C[C@H](CO)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000375269270 476749007 /nfs/dbraw/zinc/74/90/07/476749007.db2.gz YKKALQCSHLEFMP-AEFFLSMTSA-N 1 3 326.525 2.531 10 0 EFAEHO C([NH2+][C@@H](C1CC1)[C@@H]1CNCCO1)C1(N2CCCCC2)CCCCC1 ZINC000422766022 476765910 /nfs/dbraw/zinc/76/59/10/476765910.db2.gz WYEDRJXNTJUJPG-OALUTQOASA-N 1 3 335.536 2.532 10 0 EFAEHO C(N[C@@H](C1CC1)[C@@H]1CNCCO1)C1([NH+]2CCCCC2)CCCCC1 ZINC000422766022 476765916 /nfs/dbraw/zinc/76/59/16/476765916.db2.gz WYEDRJXNTJUJPG-OALUTQOASA-N 1 3 335.536 2.532 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@@H]1CCOc2ccc(Br)cc21 ZINC000422764769 476766235 /nfs/dbraw/zinc/76/62/35/476766235.db2.gz QHHSTGIFTVRTNM-TZMCWYRMSA-N 1 3 343.265 2.616 10 0 EFAEHO C([NH2+][C@H](C1CC1)[C@@H]1CNCCO1)C1(N2CCCCC2)CCCCC1 ZINC000422766023 476766592 /nfs/dbraw/zinc/76/65/92/476766592.db2.gz WYEDRJXNTJUJPG-RBUKOAKNSA-N 1 3 335.536 2.532 10 0 EFAEHO C(N[C@H](C1CC1)[C@@H]1CNCCO1)C1([NH+]2CCCCC2)CCCCC1 ZINC000422766023 476766600 /nfs/dbraw/zinc/76/66/00/476766600.db2.gz WYEDRJXNTJUJPG-RBUKOAKNSA-N 1 3 335.536 2.532 10 0 EFAEHO COc1cccc(O[C@H](C)C[NH2+][C@H](C)c2ccc(CN)nc2C)c1 ZINC000422779156 476772708 /nfs/dbraw/zinc/77/27/08/476772708.db2.gz BPYAIMJCMJQVEE-ZIAGYGMSSA-N 1 3 329.444 2.975 10 0 EFAEHO [NH3+]CCc1ccccc1C(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000390702270 476797081 /nfs/dbraw/zinc/79/70/81/476797081.db2.gz DKUXQMOTNKGYBZ-LJQANCHMSA-N 1 3 337.467 2.582 10 0 EFAEHO C[C@@H]([NH3+])[C@H](Cc1ccccc1)NCc1ccc(Cn2ccnc2)cc1 ZINC000422836705 476803497 /nfs/dbraw/zinc/80/34/97/476803497.db2.gz RTNOTPAKTHFEIU-UTKZUKDTSA-N 1 3 334.467 2.980 10 0 EFAEHO C[C@@H](N)[C@H](Cc1ccccc1)[NH2+]Cc1ccc(Cn2ccnc2)cc1 ZINC000422836705 476803505 /nfs/dbraw/zinc/80/35/05/476803505.db2.gz RTNOTPAKTHFEIU-UTKZUKDTSA-N 1 3 334.467 2.980 10 0 EFAEHO COC[C@@H]1CCCN(CCC[N@@H+]2CCC[C@@H](COC)CC2)CC1 ZINC000452076291 476808299 /nfs/dbraw/zinc/80/82/99/476808299.db2.gz BMFFVQLVAMXGHA-RTBURBONSA-N 1 3 326.525 2.874 10 0 EFAEHO COC[C@@H]1CCCN(CCC[N@H+]2CCC[C@@H](COC)CC2)CC1 ZINC000452076291 476808308 /nfs/dbraw/zinc/80/83/08/476808308.db2.gz BMFFVQLVAMXGHA-RTBURBONSA-N 1 3 326.525 2.874 10 0 EFAEHO C[C@H](N)C[C@H](C)[NH2+]C1CCN(c2ccc(C(F)(F)F)cn2)CC1 ZINC000422863428 476817574 /nfs/dbraw/zinc/81/75/74/476817574.db2.gz OZKDZMDRRCVRER-RYUDHWBXSA-N 1 3 330.398 2.785 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@H](C[NH2+][C@H]3CCCC[C@H]3CN)C2)c1 ZINC000422870194 476820754 /nfs/dbraw/zinc/82/07/54/476820754.db2.gz BKQWVWNPVLOXTG-GUXCAODWSA-N 1 3 347.503 2.637 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@@H]1CCN(c2ncccc2Cl)C1 ZINC000422872036 476821725 /nfs/dbraw/zinc/82/17/25/476821725.db2.gz FJUXFBUGTWCAMA-UKRRQHHQSA-N 1 3 345.878 2.827 10 0 EFAEHO C[C@H](NCc1ccc(OCC[NH+]2CCCC2)cc1)c1cnccc1N ZINC000422908375 476841512 /nfs/dbraw/zinc/84/15/12/476841512.db2.gz DHOQDANXSFKGHB-INIZCTEOSA-N 1 3 340.471 2.820 10 0 EFAEHO COC1(C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCCCC1 ZINC000397542820 476858181 /nfs/dbraw/zinc/85/81/81/476858181.db2.gz CAUCVWVPRJINFN-UHFFFAOYSA-N 1 3 346.515 2.952 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(C(=O)NCCN2CCCC2)cc1)[C@@H]1C[C@H]1C ZINC000414069518 476862817 /nfs/dbraw/zinc/86/28/17/476862817.db2.gz BTRHPAWMKVHVCQ-JTDSTZFVSA-N 1 3 329.488 2.646 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)c2ccccc2CC[NH3+])CN1Cc1ccccc1 ZINC000398127732 476868008 /nfs/dbraw/zinc/86/80/08/476868008.db2.gz IODDJVPHKAUUKT-APWZRJJASA-N 1 3 337.467 2.581 10 0 EFAEHO C[C@H]([NH2+]CC1(N2CCOCC2)CCN(C)CC1)C1CCCCCC1 ZINC000414200946 476875472 /nfs/dbraw/zinc/87/54/72/476875472.db2.gz SBMGURVSWSHZBN-SFHVURJKSA-N 1 3 337.552 2.732 10 0 EFAEHO FC(F)(F)c1ccc(OCCN[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)nc1 ZINC000422987087 476879557 /nfs/dbraw/zinc/87/95/57/476879557.db2.gz FDAIOQPUCXNSOW-KFWWJZLASA-N 1 3 343.393 2.990 10 0 EFAEHO OC[C@H](CNC1C[C@H]2CC[C@@H](C1)[NH2+]2)Cc1ccc(C(F)(F)F)cc1 ZINC000422993661 476883538 /nfs/dbraw/zinc/88/35/38/476883538.db2.gz TTYUVYRYKTYJMU-JTUUTPGSSA-N 1 3 342.405 2.729 10 0 EFAEHO NCC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2CCc2ccccc2)C1 ZINC000414694279 476887532 /nfs/dbraw/zinc/88/75/32/476887532.db2.gz NASHDASDWBXQHA-PMACEKPBSA-N 1 3 343.515 2.671 10 0 EFAEHO NCC(=O)N1CCC[C@@H](C[N@H+]2CCCC[C@H]2CCc2ccccc2)C1 ZINC000414694279 476887535 /nfs/dbraw/zinc/88/75/35/476887535.db2.gz NASHDASDWBXQHA-PMACEKPBSA-N 1 3 343.515 2.671 10 0 EFAEHO COc1ccc2c(c1)OC[C@H](N[C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)C2 ZINC000423020837 476894451 /nfs/dbraw/zinc/89/44/51/476894451.db2.gz CWUNVYRUVPVYCO-NXWXRZEISA-N 1 3 330.472 2.899 10 0 EFAEHO COC[C@@]1(C[NH2+][C@@H](C)CCc2ccc(OC(F)F)cc2)CCCN1 ZINC000414956269 476902226 /nfs/dbraw/zinc/90/22/26/476902226.db2.gz OOWAGRYJYAUZJU-KSSFIOAISA-N 1 3 342.430 2.967 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@]1(O)CCC[C@H](C(F)(F)F)C1 ZINC000423058023 476908441 /nfs/dbraw/zinc/90/84/41/476908441.db2.gz BIGZLIGXJGJRLE-RBOXIYTFSA-N 1 3 345.409 2.983 10 0 EFAEHO CCOC(=O)c1csc(CC[NH2+][C@H]2C[C@@H](N)c3ccccc32)n1 ZINC000423065406 476912194 /nfs/dbraw/zinc/91/21/94/476912194.db2.gz BGLZNDRYPLMWGF-KGLIPLIRSA-N 1 3 331.441 2.597 10 0 EFAEHO CCOC(=O)C1([C@H](C)N[C@@H]2CCOc3c(C)cccc32)CC[NH2+]CC1 ZINC000423069014 476915673 /nfs/dbraw/zinc/91/56/73/476915673.db2.gz LFYRUMBXTLABHO-DOTOQJQBSA-N 1 3 346.471 2.730 10 0 EFAEHO FC(F)C(F)(F)COCCN[C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000423072982 476917152 /nfs/dbraw/zinc/91/71/52/476917152.db2.gz HZWLMIPGKIZITR-JHJVBQTASA-N 1 3 326.378 2.804 10 0 EFAEHO Cc1cc(N2CCC[C@H](N[C@H](C)C[C@@H]3CCCCC[NH2+]3)C2)n(C)n1 ZINC000423074379 476917334 /nfs/dbraw/zinc/91/73/34/476917334.db2.gz LLEBWNKQTYDJGI-NJAFHUGGSA-N 1 3 333.524 2.598 10 0 EFAEHO CC[C@H](NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1CCC[NH2+]1 ZINC000423080741 476921124 /nfs/dbraw/zinc/92/11/24/476921124.db2.gz AICDHNKCVWQBJJ-CKUJCDMFSA-N 1 3 333.442 2.912 10 0 EFAEHO CCOC(=O)[C@@H]1CC[C@H](N[C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423097863 476928255 /nfs/dbraw/zinc/92/82/55/476928255.db2.gz RHSCWSAFJIUVSN-TXDAXLQXSA-N 1 3 344.455 2.564 10 0 EFAEHO C[N@H+](CCCCNC(=O)c1cccc(CN2CCCC2)c1)C1CC1 ZINC000457207536 476928299 /nfs/dbraw/zinc/92/82/99/476928299.db2.gz SRCFGUMFXUESCP-UHFFFAOYSA-N 1 3 329.488 2.887 10 0 EFAEHO C[N@@H+](CCCCNC(=O)c1cccc(CN2CCCC2)c1)C1CC1 ZINC000457207536 476928303 /nfs/dbraw/zinc/92/83/03/476928303.db2.gz SRCFGUMFXUESCP-UHFFFAOYSA-N 1 3 329.488 2.887 10 0 EFAEHO [NH3+]C[C@H]1CCCC[C@H]1NCc1cc(Cl)ccc1N1CCOCC1 ZINC000423106873 476929699 /nfs/dbraw/zinc/92/96/99/476929699.db2.gz RNVJSRIIQFNAES-RHSMWYFYSA-N 1 3 337.895 2.784 10 0 EFAEHO c1ccc([C@@H]2CC[C@H](CN[C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)O2)cc1 ZINC000423127418 476937965 /nfs/dbraw/zinc/93/79/65/476937965.db2.gz SZERQGNEPROSLS-WAPOTWQKSA-N 1 3 330.472 2.653 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@@H]1CCc2c1ccc(F)c2Br ZINC000423148021 476944272 /nfs/dbraw/zinc/94/42/72/476944272.db2.gz DUVBEJMSJDVDCB-IINYFYTJSA-N 1 3 345.256 2.919 10 0 EFAEHO C[NH2+]Cc1ccccc1NC(=O)N(C)CCCN(C)Cc1ccco1 ZINC000415896198 476961123 /nfs/dbraw/zinc/96/11/23/476961123.db2.gz CTNYGAOOXZUDQU-UHFFFAOYSA-N 1 3 344.459 2.985 10 0 EFAEHO C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CC1(N)CCCCCC1 ZINC000423206979 476964403 /nfs/dbraw/zinc/96/44/03/476964403.db2.gz XLIBIBHINUUAME-PKOBYXMFSA-N 1 3 330.520 2.933 10 0 EFAEHO C[C@H]1CN(Cc2ccccn2)CC[C@H]1NCC1([NH3+])CCCCCC1 ZINC000423206979 476964409 /nfs/dbraw/zinc/96/44/09/476964409.db2.gz XLIBIBHINUUAME-PKOBYXMFSA-N 1 3 330.520 2.933 10 0 EFAEHO C[NH2+]Cc1cccc(NC(=O)N[C@H](Cc2ccccc2)CN(C)C)c1 ZINC000415915210 476967203 /nfs/dbraw/zinc/96/72/03/476967203.db2.gz DDYPWXNSHJNLMQ-LJQANCHMSA-N 1 3 340.471 2.700 10 0 EFAEHO C[NH2+]Cc1cccc(NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)c1 ZINC000415915209 476967990 /nfs/dbraw/zinc/96/79/90/476967990.db2.gz DDYPWXNSHJNLMQ-IBGZPJMESA-N 1 3 340.471 2.700 10 0 EFAEHO C[NH2+]Cc1ccccc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000415919315 476968882 /nfs/dbraw/zinc/96/88/82/476968882.db2.gz HJIDVUVRFGHCJS-OALUTQOASA-N 1 3 338.455 2.973 10 0 EFAEHO CC[NH2+]Cc1ccccc1NC(=O)N1CC[C@]2(C1)CCCN(C)C2 ZINC000415928624 476972703 /nfs/dbraw/zinc/97/27/03/476972703.db2.gz GDTGHJWQZFWFSY-LJQANCHMSA-N 1 3 330.476 2.746 10 0 EFAEHO C[C@H](NCC[C@@H]1CC[NH2+]C1)c1ccccc1I ZINC000423243991 476974647 /nfs/dbraw/zinc/97/46/47/476974647.db2.gz HDIOAMNSTIAQQW-RYUDHWBXSA-N 1 3 344.240 2.941 10 0 EFAEHO O=C(Nc1ccc2c(c1)CNC2)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000415993660 476981644 /nfs/dbraw/zinc/98/16/44/476981644.db2.gz FTSVNPDOPCQGIN-BEFAXECRSA-N 1 3 340.471 2.770 10 0 EFAEHO O=C(Nc1ccc2c(c1)CNC2)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000415993660 476981648 /nfs/dbraw/zinc/98/16/48/476981648.db2.gz FTSVNPDOPCQGIN-BEFAXECRSA-N 1 3 340.471 2.770 10 0 EFAEHO C[NH2+]Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000416003583 476988298 /nfs/dbraw/zinc/98/82/98/476988298.db2.gz FMQTXYTWOFZZQU-MOPGFXCFSA-N 1 3 338.455 2.973 10 0 EFAEHO COCCOc1cc(C)ccc1C[NH2+][C@@H]1CCN(C)[C@H]2CCC[C@@H]21 ZINC000375783010 477003159 /nfs/dbraw/zinc/00/31/59/477003159.db2.gz BCECKIHFMNYQEO-QRVBRYPASA-N 1 3 332.488 2.983 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccccc2CN2CCCC2=O)[C@H]2CCC[C@@H]21 ZINC000375791166 477007570 /nfs/dbraw/zinc/00/75/70/477007570.db2.gz NZTVIKYTNWQJOF-AABGKKOBSA-N 1 3 341.499 2.771 10 0 EFAEHO Fc1ccc([C@@H](NC[C@@H](N2CC[NH2+]CC2)C(F)(F)F)C2CC2)cc1 ZINC000423399132 477017131 /nfs/dbraw/zinc/01/71/31/477017131.db2.gz VYJXZNJCWYANKU-CVEARBPZSA-N 1 3 345.384 2.703 10 0 EFAEHO CC(C)Oc1ccc([C@H](O)CN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@H]32)cc1 ZINC000375840490 477039374 /nfs/dbraw/zinc/03/93/74/477039374.db2.gz PNCPLPYCQHSSBK-ZGXWSNOMSA-N 1 3 332.488 2.970 10 0 EFAEHO CC(C)Oc1ccc([C@H](O)CN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)cc1 ZINC000375840490 477039368 /nfs/dbraw/zinc/03/93/68/477039368.db2.gz PNCPLPYCQHSSBK-ZGXWSNOMSA-N 1 3 332.488 2.970 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)CCN2CCc3ccccc3C2)[C@H](C)C1 ZINC000416157313 477045533 /nfs/dbraw/zinc/04/55/33/477045533.db2.gz QPSCUVALXFJLGF-XLIONFOSSA-N 1 3 343.515 2.624 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)CCN2CCc3ccccc3C2)[C@H](C)C1 ZINC000416157313 477045536 /nfs/dbraw/zinc/04/55/36/477045536.db2.gz QPSCUVALXFJLGF-XLIONFOSSA-N 1 3 343.515 2.624 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)CCN2CCc3ccccc3C2)[C@@H](C)C1 ZINC000416157311 477045791 /nfs/dbraw/zinc/04/57/91/477045791.db2.gz QPSCUVALXFJLGF-FXAWDEMLSA-N 1 3 343.515 2.624 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)CCN2CCc3ccccc3C2)[C@@H](C)C1 ZINC000416157311 477045797 /nfs/dbraw/zinc/04/57/97/477045797.db2.gz QPSCUVALXFJLGF-FXAWDEMLSA-N 1 3 343.515 2.624 10 0 EFAEHO CCN(CCC[NH+]1CCCC1)C(=O)CCN1CCc2ccccc2C1 ZINC000416215009 477074465 /nfs/dbraw/zinc/07/44/65/477074465.db2.gz MWVAOQDKTYWGEI-UHFFFAOYSA-N 1 3 343.515 2.769 10 0 EFAEHO CN(C)CCOc1cccc(CNC(=O)CC[C@@H]2CCCC[N@@H+]2C)c1 ZINC000431729302 477083486 /nfs/dbraw/zinc/08/34/86/477083486.db2.gz QFUNRZACJPDOGY-SFHVURJKSA-N 1 3 347.503 2.508 10 0 EFAEHO CN(C)CCOc1cccc(CNC(=O)CC[C@@H]2CCCC[N@H+]2C)c1 ZINC000431729302 477083492 /nfs/dbraw/zinc/08/34/92/477083492.db2.gz QFUNRZACJPDOGY-SFHVURJKSA-N 1 3 347.503 2.508 10 0 EFAEHO CCC[NH+]1CCC(CN[C@@H](c2c[nH]nn2)c2ccc(F)cc2)CC1 ZINC000453102731 477169105 /nfs/dbraw/zinc/16/91/05/477169105.db2.gz BCNHRGOUVFAWGZ-GOSISDBHSA-N 1 3 331.439 2.745 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](C)N2CCCC[C@@H]2C)[C@@H](C)C1 ZINC000448462154 477177055 /nfs/dbraw/zinc/17/70/55/477177055.db2.gz QXFFGUBRBBHMRG-XSLAGTTESA-N 1 3 338.540 2.621 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NC[C@H](C)N2CCCC[C@@H]2C)[C@@H](C)C1 ZINC000448462154 477177061 /nfs/dbraw/zinc/17/70/61/477177061.db2.gz QXFFGUBRBBHMRG-XSLAGTTESA-N 1 3 338.540 2.621 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@@H]2C)[C@H](C)C1 ZINC000448518848 477183111 /nfs/dbraw/zinc/18/31/11/477183111.db2.gz AYSBVYGTKSQBHV-BDXSIMOUSA-N 1 3 338.540 2.621 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@@H]2C)[C@H](C)C1 ZINC000448518848 477183120 /nfs/dbraw/zinc/18/31/20/477183120.db2.gz AYSBVYGTKSQBHV-BDXSIMOUSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@H](c1ccncc1)N1CCC(NC(=O)[C@@H]2[NH2+]CCCC2(C)C)CC1 ZINC000423850268 477184350 /nfs/dbraw/zinc/18/43/50/477184350.db2.gz POAVHYRMWWWOLK-QAPCUYQASA-N 1 3 344.503 2.501 10 0 EFAEHO CC[C@H](CO)N1CCN(Cc2cccc(C[NH+]3CCCCC3)c2)CC1 ZINC000411293683 477185539 /nfs/dbraw/zinc/18/55/39/477185539.db2.gz MDVRSWRHCCCQEK-OAQYLSRUSA-N 1 3 345.531 2.561 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)[C@@H]2CCC[C@@H]21 ZINC000453392313 477219400 /nfs/dbraw/zinc/21/94/00/477219400.db2.gz YUWSWXKODWOVGM-UIFYRBHJSA-N 1 3 346.519 2.843 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)[C@@H]2CCC[C@@H]21 ZINC000453392313 477219406 /nfs/dbraw/zinc/21/94/06/477219406.db2.gz YUWSWXKODWOVGM-UIFYRBHJSA-N 1 3 346.519 2.843 10 0 EFAEHO C[C@]1(CNCc2ccc(C(N)=O)cc2)CCC[N@@H+]1Cc1ccccc1 ZINC000376341844 477291843 /nfs/dbraw/zinc/29/18/43/477291843.db2.gz RVHXBOLFRIWERK-OAQYLSRUSA-N 1 3 337.467 2.930 10 0 EFAEHO C[C@]1(CNCc2ccc(C(N)=O)cc2)CCC[N@H+]1Cc1ccccc1 ZINC000376341844 477291852 /nfs/dbraw/zinc/29/18/52/477291852.db2.gz RVHXBOLFRIWERK-OAQYLSRUSA-N 1 3 337.467 2.930 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+](C)[C@H](C)[C@H]2Cc3ccccc3O2)CC1 ZINC000367044895 477313893 /nfs/dbraw/zinc/31/38/93/477313893.db2.gz YBMZRYIVSOKMPC-WIYYLYMNSA-N 1 3 345.531 2.727 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+](C)[C@H](C)[C@H]2Cc3ccccc3O2)CC1 ZINC000367044895 477313897 /nfs/dbraw/zinc/31/38/97/477313897.db2.gz YBMZRYIVSOKMPC-WIYYLYMNSA-N 1 3 345.531 2.727 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)N1CCN2CCC1CC2)c1ccccc1 ZINC000367062914 477323824 /nfs/dbraw/zinc/32/38/24/477323824.db2.gz QYJNDORDYPROTL-LJQANCHMSA-N 1 3 344.503 2.559 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)NC[C@H]1CCCCN1C1CC1 ZINC000433918025 477329155 /nfs/dbraw/zinc/32/91/55/477329155.db2.gz HQOBTPKHDXYDHF-SOLBZPMBSA-N 1 3 336.524 2.565 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NC[C@H]1CCCCN1C1CC1 ZINC000433918025 477329160 /nfs/dbraw/zinc/32/91/60/477329160.db2.gz HQOBTPKHDXYDHF-SOLBZPMBSA-N 1 3 336.524 2.565 10 0 EFAEHO C[C@@H](CCCC[NH3+])NC(=O)NCc1ccccc1CN1CCCCC1 ZINC000416892006 477356529 /nfs/dbraw/zinc/35/65/29/477356529.db2.gz AEZKEBASXHYGKJ-KRWDZBQOSA-N 1 3 346.519 2.989 10 0 EFAEHO C[C@H](CCCC[NH3+])NC(=O)NCc1ccccc1CN1CCCCC1 ZINC000416892008 477357224 /nfs/dbraw/zinc/35/72/24/477357224.db2.gz AEZKEBASXHYGKJ-QGZVFWFLSA-N 1 3 346.519 2.989 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCNC(=O)CCCc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000424334206 477373682 /nfs/dbraw/zinc/37/36/82/477373682.db2.gz WPQDACDBOWHNAL-AABGKKOBSA-N 1 3 343.515 2.588 10 0 EFAEHO C[N@H+]1CC[C@H](NCCNC(=O)CCCc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000424334206 477373686 /nfs/dbraw/zinc/37/36/86/477373686.db2.gz WPQDACDBOWHNAL-AABGKKOBSA-N 1 3 343.515 2.588 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)NC[C@H](N)c1ccccc1)CC(C)C ZINC000416943095 477379580 /nfs/dbraw/zinc/37/95/80/477379580.db2.gz CBDJJWAOTBHHKI-ROUUACIJSA-N 1 3 334.508 2.742 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(N[C@@H](C)CN2CCCC2=O)CC1 ZINC000449089770 477433035 /nfs/dbraw/zinc/43/30/35/477433035.db2.gz LIFVJJCAKVBDSA-ZWKOTPCHSA-N 1 3 343.515 2.683 10 0 EFAEHO C[C@@H](Cc1ccccc1)N1CCC([NH2+][C@@H](C)C(=O)NC(C)(C)C)CC1 ZINC000449099418 477437637 /nfs/dbraw/zinc/43/76/37/477437637.db2.gz TUUMGHGVGGOIQL-IRXDYDNUSA-N 1 3 345.531 2.975 10 0 EFAEHO C[C@@H](Cc1ccoc1)[NH2+]Cc1ccccc1CN1CCC(O)CC1 ZINC000449178816 477472602 /nfs/dbraw/zinc/47/26/02/477472602.db2.gz USJRCGFAICVZOC-INIZCTEOSA-N 1 3 328.456 2.957 10 0 EFAEHO CN1CC[C@H](NC(=O)NC(C)(C)C[NH+]2CCCC2)[C@H]1c1ccccc1 ZINC000458567570 477485906 /nfs/dbraw/zinc/48/59/06/477485906.db2.gz CWMFPBRVFNXLQG-ZWKOTPCHSA-N 1 3 344.503 2.605 10 0 EFAEHO Cc1nn(C)c(C)c1CCC[NH2+]C1CCN(c2ccncc2)CC1 ZINC000436469768 477486080 /nfs/dbraw/zinc/48/60/80/477486080.db2.gz FUUZMPVHLKWRGH-UHFFFAOYSA-N 1 3 327.476 2.623 10 0 EFAEHO CC[C@H](C)NC(=O)[C@H](C)[NH2+]C1CCN([C@H](C)Cc2ccccc2)CC1 ZINC000449221862 477494143 /nfs/dbraw/zinc/49/41/43/477494143.db2.gz UUDRQJAOTPECEG-KSZLIROESA-N 1 3 345.531 2.975 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NCCc2ccn(C)n2)CC1 ZINC000449244836 477505165 /nfs/dbraw/zinc/50/51/65/477505165.db2.gz WEOUJZWEDKPCFZ-QGZVFWFLSA-N 1 3 326.488 2.648 10 0 EFAEHO C[C@H]1OCC[C@@]1(O)CNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449291278 477529069 /nfs/dbraw/zinc/52/90/69/477529069.db2.gz KENHDKBOYRJMDM-DNVCBOLYSA-N 1 3 326.525 2.795 10 0 EFAEHO C[NH2+]C1CCN(C(=O)[C@H]2CCCCN2Cc2cccc(C)c2)CC1 ZINC000377128572 477656608 /nfs/dbraw/zinc/65/66/08/477656608.db2.gz QTGHJOZRJIIGSB-LJQANCHMSA-N 1 3 329.488 2.560 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)N(C)C ZINC000459034438 477708386 /nfs/dbraw/zinc/70/83/86/477708386.db2.gz DFGDVGSAZKOWFU-LNLFQRSKSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)N(C)C ZINC000459034438 477708392 /nfs/dbraw/zinc/70/83/92/477708392.db2.gz DFGDVGSAZKOWFU-LNLFQRSKSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1)[NH+](C)C ZINC000459034438 477708399 /nfs/dbraw/zinc/70/83/99/477708399.db2.gz DFGDVGSAZKOWFU-LNLFQRSKSA-N 1 3 346.519 2.631 10 0 EFAEHO O=C([C@H]1CCCN1C1CC1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000426484617 477711611 /nfs/dbraw/zinc/71/16/11/477711611.db2.gz GXHXREHDWDZLGW-PKOBYXMFSA-N 1 3 333.520 2.728 10 0 EFAEHO c1cc(OCCCN2CCCC[C@H]2[C@@H]2CC[NH2+]C2)cc2c1OCO2 ZINC000420376201 477733056 /nfs/dbraw/zinc/73/30/56/477733056.db2.gz AIDHDPLOKBZAKY-WBVHZDCISA-N 1 3 332.444 2.648 10 0 EFAEHO c1cc(OCCCN2CCCC[C@@H]2[C@H]2CC[NH2+]C2)cc2c1OCO2 ZINC000420376192 477733783 /nfs/dbraw/zinc/73/37/83/477733783.db2.gz AIDHDPLOKBZAKY-DOTOQJQBSA-N 1 3 332.444 2.648 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)Nc2cccc(OCCN(C)C)c2)CC[N@@H+]1C ZINC000437782578 477752841 /nfs/dbraw/zinc/75/28/41/477752841.db2.gz WKJKSOMTOGETFM-NVXWUHKLSA-N 1 3 348.491 2.573 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)Nc2cccc(OCCN(C)C)c2)CC[N@H+]1C ZINC000437782578 477752847 /nfs/dbraw/zinc/75/28/47/477752847.db2.gz WKJKSOMTOGETFM-NVXWUHKLSA-N 1 3 348.491 2.573 10 0 EFAEHO [NH3+]CCc1ccccc1C(=O)N1CCN(CC2CCCCC2)CC1 ZINC000516659570 477970148 /nfs/dbraw/zinc/97/01/48/477970148.db2.gz UOBJLONZNOZLLX-UHFFFAOYSA-N 1 3 329.488 2.526 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000516837228 477992176 /nfs/dbraw/zinc/99/21/76/477992176.db2.gz UWIZKKOMLZBDDE-FQEVSTJZSA-N 1 3 331.504 2.889 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000465873008 477992374 /nfs/dbraw/zinc/99/23/74/477992374.db2.gz KTKQMOUZYVGVQB-KZNAEPCWSA-N 1 3 338.540 2.765 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000465873008 477992377 /nfs/dbraw/zinc/99/23/77/477992377.db2.gz KTKQMOUZYVGVQB-KZNAEPCWSA-N 1 3 338.540 2.765 10 0 EFAEHO CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCCN2[C@H](C)CCC[C@@H]2C)C1 ZINC000465894324 477994617 /nfs/dbraw/zinc/99/46/17/477994617.db2.gz AESVLSKESRAEMH-KSZLIROESA-N 1 3 338.540 2.623 10 0 EFAEHO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NCCN2[C@H](C)CCC[C@@H]2C)C1 ZINC000465894324 477994621 /nfs/dbraw/zinc/99/46/21/477994621.db2.gz AESVLSKESRAEMH-KSZLIROESA-N 1 3 338.540 2.623 10 0 EFAEHO CN(c1ccccc1CN1CC2(C1)CCCOC2)C1CC[NH+](C)CC1 ZINC000459607522 478007182 /nfs/dbraw/zinc/00/71/82/478007182.db2.gz ONPOUACVFHYGJF-UHFFFAOYSA-N 1 3 343.515 2.829 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NCCc2cn(C)cn2)CC1 ZINC000459653182 478024501 /nfs/dbraw/zinc/02/45/01/478024501.db2.gz DAKIPOHOFVQIOY-KRWDZBQOSA-N 1 3 326.488 2.648 10 0 EFAEHO Cn1cnc(CC[NH2+][C@@H]2CCC[C@@H]3CN(Cc4ccccc4)C[C@H]32)c1 ZINC000459654406 478024671 /nfs/dbraw/zinc/02/46/71/478024671.db2.gz FMKJNSQZGDUAHR-HMXCVIKNSA-N 1 3 338.499 2.853 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)N(C)C ZINC000495019350 478106788 /nfs/dbraw/zinc/10/67/88/478106788.db2.gz PTWKWQXRPKWVDP-HYVNUMGLSA-N 1 3 337.533 2.833 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1)N(C)C ZINC000495019350 478106793 /nfs/dbraw/zinc/10/67/93/478106793.db2.gz PTWKWQXRPKWVDP-HYVNUMGLSA-N 1 3 337.533 2.833 10 0 EFAEHO CCN(C(=O)CC[NH2+]C1CC1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000517755988 478121038 /nfs/dbraw/zinc/12/10/38/478121038.db2.gz CCFRDRHVEVLXFS-APWZRJJASA-N 1 3 329.488 2.813 10 0 EFAEHO OC1(C[NH2+][C@@H]2CCC23CCOCC3)CCN(Cc2ccccc2)CC1 ZINC000560883981 478140142 /nfs/dbraw/zinc/14/01/42/478140142.db2.gz COMAFNTXCNROFS-LJQANCHMSA-N 1 3 344.499 2.562 10 0 EFAEHO C[C@H](CNC(=O)NC1CCC(C[NH+](C)C)CC1)N1CCCC[C@H]1C ZINC000440823892 478165578 /nfs/dbraw/zinc/16/55/78/478165578.db2.gz GXNZUOLNTOBMMW-MRLCAUJQSA-N 1 3 338.540 2.669 10 0 EFAEHO CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)CN1CC[C@H](C)C1 ZINC000561269960 478173720 /nfs/dbraw/zinc/17/37/20/478173720.db2.gz JGFVEBFFXSCFQD-AZUAARDMSA-N 1 3 343.515 2.699 10 0 EFAEHO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)CN1CC[C@H](C)C1 ZINC000561269960 478173724 /nfs/dbraw/zinc/17/37/24/478173724.db2.gz JGFVEBFFXSCFQD-AZUAARDMSA-N 1 3 343.515 2.699 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000561291369 478175159 /nfs/dbraw/zinc/17/51/59/478175159.db2.gz ADJXGXTXAVNZQL-OALUTQOASA-N 1 3 331.504 2.601 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000561291369 478175161 /nfs/dbraw/zinc/17/51/61/478175161.db2.gz ADJXGXTXAVNZQL-OALUTQOASA-N 1 3 331.504 2.601 10 0 EFAEHO CC1(C)COC[C@H]1NCc1ccccc1C[NH2+][C@@H]1COCC1(C)C ZINC000451812772 478212955 /nfs/dbraw/zinc/21/29/55/478212955.db2.gz PPMYPPXHEWPFGO-QZTJIDSGSA-N 1 3 332.488 2.716 10 0 EFAEHO C[C@@H](CC[NH+](C)C)NC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000489081286 478216949 /nfs/dbraw/zinc/21/69/49/478216949.db2.gz VMGRRWSCBWZSAM-FXAWDEMLSA-N 1 3 346.519 2.681 10 0 EFAEHO C[C@H]1CN(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)CCN(C2CCC2)C1 ZINC000489414556 478243469 /nfs/dbraw/zinc/24/34/69/478243469.db2.gz ULEVKIRPQSLSNY-VBZNHOPUSA-N 1 3 348.535 2.518 10 0 EFAEHO C[C@H]1CN(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)CCN(C2CCC2)C1 ZINC000489414556 478243473 /nfs/dbraw/zinc/24/34/73/478243473.db2.gz ULEVKIRPQSLSNY-VBZNHOPUSA-N 1 3 348.535 2.518 10 0 EFAEHO CC[NH+](CC)CCSCC(=O)NC[C@H]1CCN1C1CCCCC1 ZINC000600229429 478299209 /nfs/dbraw/zinc/29/92/09/478299209.db2.gz SGQQRPTUIGZIHN-QGZVFWFLSA-N 1 3 341.565 2.585 10 0 EFAEHO COc1ccc([C@H](CO)N(C)Cc2ccc3c(c2)C[NH2+]CC3)cc1 ZINC000520592763 478329275 /nfs/dbraw/zinc/32/92/75/478329275.db2.gz FLRHXBBECYBFNR-FQEVSTJZSA-N 1 3 326.440 2.506 10 0 EFAEHO c1nnc([C@H]2CCCN(Cc3ccc4c(c3)C[NH2+]CC4)C2)n1C1CC1 ZINC000570456293 478363411 /nfs/dbraw/zinc/36/34/11/478363411.db2.gz RFDDBENVZKFGAT-KRWDZBQOSA-N 1 3 337.471 2.638 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)N1CCc2ccccc2[C@@H]1CN ZINC000563091823 478446168 /nfs/dbraw/zinc/44/61/68/478446168.db2.gz FKXWLCBBHZTENI-FCEWJHQRSA-N 1 3 344.503 2.517 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N1CCc2ccccc2[C@@H]1CN ZINC000563091823 478446173 /nfs/dbraw/zinc/44/61/73/478446173.db2.gz FKXWLCBBHZTENI-FCEWJHQRSA-N 1 3 344.503 2.517 10 0 EFAEHO C[NH+](C)CC1CCC(NCc2cnnn2Cc2ccccc2)CC1 ZINC000491222272 478476093 /nfs/dbraw/zinc/47/60/93/478476093.db2.gz FWBGXNXZXVFYFP-UHFFFAOYSA-N 1 3 327.476 2.536 10 0 EFAEHO C[C@H]1CCC[C@](CNC(=O)CCN(C)c2ccncc2)([NH+](C)C)C1 ZINC000540927317 478511579 /nfs/dbraw/zinc/51/15/79/478511579.db2.gz DLNMZBPKHBTRBQ-LPHOPBHVSA-N 1 3 332.492 2.535 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNC(=O)CCN(C)c2ccncc2)C1 ZINC000540927211 478512944 /nfs/dbraw/zinc/51/29/44/478512944.db2.gz LBPCCXBNZPQLAK-QGZVFWFLSA-N 1 3 332.492 2.536 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNC(=O)CCN(C)c2ccncc2)C1 ZINC000540927211 478512952 /nfs/dbraw/zinc/51/29/52/478512952.db2.gz LBPCCXBNZPQLAK-QGZVFWFLSA-N 1 3 332.492 2.536 10 0 EFAEHO CCO[C@@]1(C)C[C@H]1NCc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000527783512 478517321 /nfs/dbraw/zinc/51/73/21/478517321.db2.gz XODTVADOITWTKV-UXHICEINSA-N 1 3 331.504 2.874 10 0 EFAEHO CN1CC[C@H](NC(=O)N[C@H](C[NH3+])C2CCCCC2)[C@H]1c1ccccc1 ZINC000582171175 478529986 /nfs/dbraw/zinc/52/99/86/478529986.db2.gz RDWORXYJZZTLAA-IPMKNSEASA-N 1 3 344.503 2.639 10 0 EFAEHO CC[C@H]1CCCC[N@@H+]1CCNC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000571266662 478554662 /nfs/dbraw/zinc/55/46/62/478554662.db2.gz FYRHQJYJGWDXEF-HNNXBMFYSA-N 1 3 348.466 2.857 10 0 EFAEHO CC[C@H]1CCCC[N@H+]1CCNC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000571266662 478554665 /nfs/dbraw/zinc/55/46/65/478554665.db2.gz FYRHQJYJGWDXEF-HNNXBMFYSA-N 1 3 348.466 2.857 10 0 EFAEHO [NH3+]C[C@@H]1CCCC[C@@H]1NCc1ccc(Cn2ccccc2=O)cc1 ZINC000571275853 478557446 /nfs/dbraw/zinc/55/74/46/478557446.db2.gz USNBNXOKRFZXOE-OALUTQOASA-N 1 3 325.456 2.504 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)CCN(C)c2ccncc2)C1 ZINC000541856167 478596660 /nfs/dbraw/zinc/59/66/60/478596660.db2.gz JMXCTEFZVUGISF-HDICACEKSA-N 1 3 346.519 2.782 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)CCN(C)c2ccncc2)C1 ZINC000541856167 478596668 /nfs/dbraw/zinc/59/66/68/478596668.db2.gz JMXCTEFZVUGISF-HDICACEKSA-N 1 3 346.519 2.782 10 0 EFAEHO COc1ccc(CC[NH2+][C@@H](C)c2cccc(OCCN(C)C)c2)cn1 ZINC000527989116 478600773 /nfs/dbraw/zinc/60/07/73/478600773.db2.gz XJBQCWFBKKCQIM-INIZCTEOSA-N 1 3 343.471 2.924 10 0 EFAEHO CC[NH+](CC)[C@@H]1CCN(C(=O)NC[C@@H]2CCN2C2CCCCC2)C1 ZINC000528146445 478656769 /nfs/dbraw/zinc/65/67/69/478656769.db2.gz ADRXITJMERDQEL-ZWKOTPCHSA-N 1 3 336.524 2.519 10 0 EFAEHO CC[NH+](CC)[C@H]1CCN(C(=O)NC[C@@H]2CCN2C2CCCCC2)C1 ZINC000528146444 478657670 /nfs/dbraw/zinc/65/76/70/478657670.db2.gz ADRXITJMERDQEL-ROUUACIJSA-N 1 3 336.524 2.519 10 0 EFAEHO Cc1ccc(OC[C@H](O)CNCc2cccc(C[NH+](C)C)c2)cc1 ZINC000564321685 478723127 /nfs/dbraw/zinc/72/31/27/478723127.db2.gz RADSGSULEZRGNE-LJQANCHMSA-N 1 3 328.456 2.586 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000582973696 478734159 /nfs/dbraw/zinc/73/41/59/478734159.db2.gz HGJZFFRIKJWZKJ-HBFSDRIKSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000582973696 478734161 /nfs/dbraw/zinc/73/41/61/478734161.db2.gz HGJZFFRIKJWZKJ-HBFSDRIKSA-N 1 3 343.515 2.840 10 0 EFAEHO Cc1ccc(NC(=O)CCN(C)c2cc[nH+]cc2)c(CN(C)C)c1 ZINC000543713143 478769871 /nfs/dbraw/zinc/76/98/71/478769871.db2.gz JDTPVDXGPPHSRB-UHFFFAOYSA-N 1 3 326.444 2.917 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)CCN(C)c2ccncc2)C1 ZINC000543715363 478772343 /nfs/dbraw/zinc/77/23/43/478772343.db2.gz CWJKSTGLZQFOIC-IAGOWNOFSA-N 1 3 346.519 2.781 10 0 EFAEHO O[C@@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)COCC1CC1 ZINC000499144827 478774408 /nfs/dbraw/zinc/77/44/08/478774408.db2.gz DWJRLELQCASLEY-BURNTYAHSA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)COCC1CC1 ZINC000499144827 478774416 /nfs/dbraw/zinc/77/44/16/478774416.db2.gz DWJRLELQCASLEY-BURNTYAHSA-N 1 3 344.499 2.559 10 0 EFAEHO COCCOC[C@@H](C)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499255725 478776105 /nfs/dbraw/zinc/77/61/05/478776105.db2.gz ZCMPNZCQNJEBAR-RSPOEFSDSA-N 1 3 332.488 2.823 10 0 EFAEHO COCCOC[C@@H](C)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499255725 478776107 /nfs/dbraw/zinc/77/61/07/478776107.db2.gz ZCMPNZCQNJEBAR-RSPOEFSDSA-N 1 3 332.488 2.823 10 0 EFAEHO CC[NH+](CC)CC1CCN(CCOc2ccccc2C(=O)OC)CC1 ZINC000543859440 478795670 /nfs/dbraw/zinc/79/56/70/478795670.db2.gz FDPMSGUAFVTOTD-UHFFFAOYSA-N 1 3 348.487 2.906 10 0 EFAEHO C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccccc2CC[NH3+])C1 ZINC000565151334 478926267 /nfs/dbraw/zinc/92/62/67/478926267.db2.gz LIDHWOUREMZCTG-VQIMIIECSA-N 1 3 337.467 2.753 10 0 EFAEHO CCC[C@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc3c(c2)C[NH2+]CC3)C1 ZINC000572888539 478944988 /nfs/dbraw/zinc/94/49/88/478944988.db2.gz VQZADHMGMPPSGQ-QFBILLFUSA-N 1 3 343.515 2.849 10 0 EFAEHO CCC[C@@H](C)NC(=O)[C@H]1CCCN(Cc2ccc3c(c2)C[NH2+]CC3)C1 ZINC000572888535 478945460 /nfs/dbraw/zinc/94/54/60/478945460.db2.gz VQZADHMGMPPSGQ-APWZRJJASA-N 1 3 343.515 2.849 10 0 EFAEHO C[C@@H]1C[C@H](CCNC[C@H](O)C(F)(F)F)C[N@@H+]1Cc1ccccc1 ZINC000514668403 479044652 /nfs/dbraw/zinc/04/46/52/479044652.db2.gz GTFLCZCNTZUFFS-KBMXLJTQSA-N 1 3 330.394 2.800 10 0 EFAEHO C[C@@H]1C[C@H](CCNC[C@H](O)C(F)(F)F)C[N@H+]1Cc1ccccc1 ZINC000514668403 479044658 /nfs/dbraw/zinc/04/46/58/479044658.db2.gz GTFLCZCNTZUFFS-KBMXLJTQSA-N 1 3 330.394 2.800 10 0 EFAEHO CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N(C)CCC[NH+](C)C ZINC000546716500 479061765 /nfs/dbraw/zinc/06/17/65/479061765.db2.gz UZAGOFBOBDLNQH-LJQANCHMSA-N 1 3 348.535 2.736 10 0 EFAEHO c1ccc(CCN2CCN(Cc3ccc4c(c3)C[NH2+]CC4)CC2)cc1 ZINC000573570954 479096351 /nfs/dbraw/zinc/09/63/51/479096351.db2.gz PATWPEXAJFARNS-UHFFFAOYSA-N 1 3 335.495 2.693 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(CN2CCN(C)CC2)cc1)C1CC(F)(F)C1 ZINC000529535298 479196905 /nfs/dbraw/zinc/19/69/05/479196905.db2.gz RFIMLHKHNJXTGG-OAHLLOKOSA-N 1 3 337.458 2.957 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(CN2CCN(C)CC2)cc1)C1CC(F)(F)C1 ZINC000529535297 479197479 /nfs/dbraw/zinc/19/74/79/479197479.db2.gz RFIMLHKHNJXTGG-HNNXBMFYSA-N 1 3 337.458 2.957 10 0 EFAEHO c1ncn2cc(CN[C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)ccc12 ZINC000584714361 479214386 /nfs/dbraw/zinc/21/43/86/479214386.db2.gz KQHDZOJJUFDJQH-QUCCMNQESA-N 1 3 334.423 2.680 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2cccc(C[NH+]3CCC(C)CC3)c2)C1 ZINC000557588289 479290917 /nfs/dbraw/zinc/29/09/17/479290917.db2.gz AJAQKSASDLHTAK-GOSISDBHSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)C1 ZINC000557647436 479298215 /nfs/dbraw/zinc/29/82/15/479298215.db2.gz ZKQWZUYAKVNGLI-QZTJIDSGSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)C1 ZINC000557647436 479298224 /nfs/dbraw/zinc/29/82/24/479298224.db2.gz ZKQWZUYAKVNGLI-QZTJIDSGSA-N 1 3 335.536 2.831 10 0 EFAEHO CSCC[C@@H](N)C(=O)N[C@@H]1CCCCC[N@H+](Cc2ccccc2)C1 ZINC000602594651 479414908 /nfs/dbraw/zinc/41/49/08/479414908.db2.gz ZETXUODRJPSLLT-QZTJIDSGSA-N 1 3 349.544 2.628 10 0 EFAEHO CSCC[C@@H](N)C(=O)N[C@@H]1CCCCC[N@@H+](Cc2ccccc2)C1 ZINC000602594651 479414915 /nfs/dbraw/zinc/41/49/15/479414915.db2.gz ZETXUODRJPSLLT-QZTJIDSGSA-N 1 3 349.544 2.628 10 0 EFAEHO CCCC[NH+]1CCC(NC(=O)N2CCc3ccccc3[C@@H]2CN)CC1 ZINC000575745730 479466850 /nfs/dbraw/zinc/46/68/50/479466850.db2.gz KMFCSHSPNYNUTM-IBGZPJMESA-N 1 3 344.503 2.519 10 0 EFAEHO CCOC(=O)c1cccc(CNCCCC[N@@H+]2CCC[C@H](C)C2)n1 ZINC000600122969 479529644 /nfs/dbraw/zinc/52/96/44/479529644.db2.gz FYWDQCHKDFCWDJ-INIZCTEOSA-N 1 3 333.476 2.860 10 0 EFAEHO CCOC(=O)c1cccc(CNCCCC[N@H+]2CCC[C@H](C)C2)n1 ZINC000600122969 479529652 /nfs/dbraw/zinc/52/96/52/479529652.db2.gz FYWDQCHKDFCWDJ-INIZCTEOSA-N 1 3 333.476 2.860 10 0 EFAEHO COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000600157501 479550996 /nfs/dbraw/zinc/55/09/96/479550996.db2.gz XJCJERLCBWVDKH-RYQLBKOJSA-N 1 3 332.488 2.869 10 0 EFAEHO COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000600157501 479551002 /nfs/dbraw/zinc/55/10/02/479551002.db2.gz XJCJERLCBWVDKH-RYQLBKOJSA-N 1 3 332.488 2.869 10 0 EFAEHO CC[C@@](CN[C@@H]1CC[N@H+](C)C(C)(C)C1)(C(=O)OC)c1ccccc1 ZINC000600165025 479555404 /nfs/dbraw/zinc/55/54/04/479555404.db2.gz OOUUPLKLHPQBHE-XLIONFOSSA-N 1 3 332.488 2.970 10 0 EFAEHO CC[C@@](CN[C@@H]1CC[N@@H+](C)C(C)(C)C1)(C(=O)OC)c1ccccc1 ZINC000600165025 479555410 /nfs/dbraw/zinc/55/54/10/479555410.db2.gz OOUUPLKLHPQBHE-XLIONFOSSA-N 1 3 332.488 2.970 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000589946346 479584932 /nfs/dbraw/zinc/58/49/32/479584932.db2.gz BHJSGNBNUUYUFB-LJQANCHMSA-N 1 3 335.536 2.975 10 0 EFAEHO COC(=O)[C@H]1C[C@H](NC2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)C1 ZINC000597247080 479642025 /nfs/dbraw/zinc/64/20/25/479642025.db2.gz YDHPSNFIMSSTHJ-IEZWGBDMSA-N 1 3 330.472 2.623 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@@](C)(CC)C3CC3)CC2)CC1 ZINC000618959812 479652761 /nfs/dbraw/zinc/65/27/61/479652761.db2.gz BPVYOZKJQYSSEP-FQEVSTJZSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]Cc2c(C(F)(F)F)nc3n2CCCC3)CCN1C ZINC000606445475 479687900 /nfs/dbraw/zinc/68/79/00/479687900.db2.gz QNQOWCAOHFIWCU-RYUDHWBXSA-N 1 3 330.398 2.811 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]Cc2c(C(F)(F)F)nc3n2CCCC3)CCN1C ZINC000606445470 479687941 /nfs/dbraw/zinc/68/79/41/479687941.db2.gz QNQOWCAOHFIWCU-NEPJUHHUSA-N 1 3 330.398 2.811 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)CC[N@@H+]1C ZINC000630806976 479717230 /nfs/dbraw/zinc/71/72/30/479717230.db2.gz CMHHLGRDBKTTBP-XGXHKWSGSA-N 1 3 329.488 2.668 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)CC[N@H+]1C ZINC000630806976 479717236 /nfs/dbraw/zinc/71/72/36/479717236.db2.gz CMHHLGRDBKTTBP-XGXHKWSGSA-N 1 3 329.488 2.668 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cc(C2CC2)[nH]c1C1CC1 ZINC000628050565 479746821 /nfs/dbraw/zinc/74/68/21/479746821.db2.gz HCISIZCFYFZHMP-AWEZNQCLSA-N 1 3 346.519 2.771 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cc(C2CC2)[nH]c1C1CC1 ZINC000628050565 479746826 /nfs/dbraw/zinc/74/68/26/479746826.db2.gz HCISIZCFYFZHMP-AWEZNQCLSA-N 1 3 346.519 2.771 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2CCN(Cc3cccs3)CC2)CC[N@@H+]1C ZINC000630857345 479747487 /nfs/dbraw/zinc/74/74/87/479747487.db2.gz RZOAYQKFCPEHCI-ZWKOTPCHSA-N 1 3 349.544 2.807 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2CCN(Cc3cccs3)CC2)CC[N@H+]1C ZINC000630857345 479747490 /nfs/dbraw/zinc/74/74/90/479747490.db2.gz RZOAYQKFCPEHCI-ZWKOTPCHSA-N 1 3 349.544 2.807 10 0 EFAEHO COc1cc(CN(C)C)ccc1NC(=O)CCN(C)c1cc[nH+]cc1 ZINC000633375961 479798181 /nfs/dbraw/zinc/79/81/81/479798181.db2.gz QYBRKLUTEGIDDW-UHFFFAOYSA-N 1 3 342.443 2.617 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)CC[N@@H+]1C ZINC000631627990 480189858 /nfs/dbraw/zinc/18/98/58/480189858.db2.gz FDVMZBHEQVQWPE-IJXRJRJASA-N 1 3 343.515 2.744 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)CC[N@H+]1C ZINC000631627990 480189865 /nfs/dbraw/zinc/18/98/65/480189865.db2.gz FDVMZBHEQVQWPE-IJXRJRJASA-N 1 3 343.515 2.744 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@@H](c2cccs2)N2CCOCC2)CC1(C)C ZINC000623337614 480239170 /nfs/dbraw/zinc/23/91/70/480239170.db2.gz QIVFJGINHGDKKY-HOTGVXAUSA-N 1 3 337.533 2.584 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1c(Cl)cccc1Cl ZINC000617505613 480247670 /nfs/dbraw/zinc/24/76/70/480247670.db2.gz KBGMESBFRPGKLR-LBPRGKRZSA-N 1 3 346.302 2.995 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1c(Cl)cccc1Cl ZINC000617505613 480247673 /nfs/dbraw/zinc/24/76/73/480247673.db2.gz KBGMESBFRPGKLR-LBPRGKRZSA-N 1 3 346.302 2.995 10 0 EFAEHO Cc1ccsc1[C@H]1C[C@H]1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617506506 480249278 /nfs/dbraw/zinc/24/92/78/480249278.db2.gz QBNJETOTJNSJNC-HRCADAONSA-N 1 3 337.533 2.548 10 0 EFAEHO Cc1ccsc1[C@H]1C[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617506506 480249280 /nfs/dbraw/zinc/24/92/80/480249280.db2.gz QBNJETOTJNSJNC-HRCADAONSA-N 1 3 337.533 2.548 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@H]1CCCc2sccc21 ZINC000617506708 480249525 /nfs/dbraw/zinc/24/95/25/480249525.db2.gz WRIWLNJRKIYHSH-HOCLYGCPSA-N 1 3 337.533 2.556 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@H]1CCCc2sccc21 ZINC000617506708 480249530 /nfs/dbraw/zinc/24/95/30/480249530.db2.gz WRIWLNJRKIYHSH-HOCLYGCPSA-N 1 3 337.533 2.556 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@H](C)c1ccc(Cl)s1 ZINC000617506032 480250681 /nfs/dbraw/zinc/25/06/81/480250681.db2.gz YMTVBFLKEPKDKV-QWHCGFSZSA-N 1 3 345.940 2.893 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@H](C)c1ccc(Cl)s1 ZINC000617506032 480250686 /nfs/dbraw/zinc/25/06/86/480250686.db2.gz YMTVBFLKEPKDKV-QWHCGFSZSA-N 1 3 345.940 2.893 10 0 EFAEHO Cc1ccc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c(Cl)c1C ZINC000617506292 480251046 /nfs/dbraw/zinc/25/10/46/480251046.db2.gz JBSVKDHSSQXTBP-AWEZNQCLSA-N 1 3 339.911 2.959 10 0 EFAEHO Cc1ccc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c(Cl)c1C ZINC000617506292 480251051 /nfs/dbraw/zinc/25/10/51/480251051.db2.gz JBSVKDHSSQXTBP-AWEZNQCLSA-N 1 3 339.911 2.959 10 0 EFAEHO Cc1nc(C(C)C)ccc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617507742 480251679 /nfs/dbraw/zinc/25/16/79/480251679.db2.gz HZJURIQIYKUZMX-HNNXBMFYSA-N 1 3 334.508 2.515 10 0 EFAEHO Cc1nc(C(C)C)ccc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617507742 480251682 /nfs/dbraw/zinc/25/16/82/480251682.db2.gz HZJURIQIYKUZMX-HNNXBMFYSA-N 1 3 334.508 2.515 10 0 EFAEHO Cc1ccsc1[C@@H]1C[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617506508 480251885 /nfs/dbraw/zinc/25/18/85/480251885.db2.gz QBNJETOTJNSJNC-XHSDSOJGSA-N 1 3 337.533 2.548 10 0 EFAEHO Cc1ccsc1[C@@H]1C[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617506508 480251888 /nfs/dbraw/zinc/25/18/88/480251888.db2.gz QBNJETOTJNSJNC-XHSDSOJGSA-N 1 3 337.533 2.548 10 0 EFAEHO CN1CC[C@@H]([NH2+]Cc2ccnc(OC3CCOCC3)c2)CC1(C)C ZINC000623417515 480273274 /nfs/dbraw/zinc/27/32/74/480273274.db2.gz AVXPWOUSDBDWKF-MRXNPFEDSA-N 1 3 333.476 2.602 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@@H](N[C@@H]3CC[N@H+](C)C(C)(C)C3)C2)c1 ZINC000623439742 480285214 /nfs/dbraw/zinc/28/52/14/480285214.db2.gz WPLFCHOPPKVZSR-HZPDHXFCSA-N 1 3 347.503 2.745 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@@H](N[C@@H]3CC[N@@H+](C)C(C)(C)C3)C2)c1 ZINC000623439742 480285222 /nfs/dbraw/zinc/28/52/22/480285222.db2.gz WPLFCHOPPKVZSR-HZPDHXFCSA-N 1 3 347.503 2.745 10 0 EFAEHO NC1(C[NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)CCOCC1 ZINC000629521060 480292636 /nfs/dbraw/zinc/29/26/36/480292636.db2.gz KXMSCFZVPUPPDO-CQSZACIVSA-N 1 3 330.350 2.670 10 0 EFAEHO Cc1c([C@H](C)NCCOCCC[NH3+])cnn1-c1cccc(Cl)c1 ZINC000629534706 480298573 /nfs/dbraw/zinc/29/85/73/480298573.db2.gz BHAWQBDUBUFXOY-ZDUSSCGKSA-N 1 3 336.867 2.850 10 0 EFAEHO Cc1ccncc1CN1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000629544760 480299107 /nfs/dbraw/zinc/29/91/07/480299107.db2.gz GMVBUJCKMHJRAC-UHFFFAOYSA-N 1 3 339.487 2.960 10 0 EFAEHO Cc1ccncc1CN1CCC(c2cc(C3CC[NH2+]CC3)n[nH]2)CC1 ZINC000629544760 480299110 /nfs/dbraw/zinc/29/91/10/480299110.db2.gz GMVBUJCKMHJRAC-UHFFFAOYSA-N 1 3 339.487 2.960 10 0 EFAEHO O[C@H](CNCCc1c[nH]c2cc(F)c(Cl)cc12)C[NH+]1CCCC1 ZINC000629613199 480333451 /nfs/dbraw/zinc/33/34/51/480333451.db2.gz KTTIIOHDVAPWIB-CYBMUJFWSA-N 1 3 339.842 2.549 10 0 EFAEHO [NH3+]CCCOCCNCc1c[nH]nc1-c1ccc(C(F)(F)F)cc1 ZINC000629681759 480356103 /nfs/dbraw/zinc/35/61/03/480356103.db2.gz UENUMEHKEPGABC-UHFFFAOYSA-N 1 3 342.365 2.551 10 0 EFAEHO C[NH+](C)CCNc1ccc(-c2cc(CN3CCCC3)ccc2F)cn1 ZINC000629701680 480362272 /nfs/dbraw/zinc/36/22/72/480362272.db2.gz AXLCZEZXYZKESN-UHFFFAOYSA-N 1 3 342.462 2.879 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@H]3CCCC34CC4)CC2)CC1 ZINC000629829151 480411438 /nfs/dbraw/zinc/41/14/38/480411438.db2.gz DDMCYBVULIBSAQ-GOSISDBHSA-N 1 3 347.547 2.879 10 0 EFAEHO C[C@](O)(C[C@@H](O)CNCc1ccccc1C[NH+]1CCCCC1)C1CC1 ZINC000634698804 480439122 /nfs/dbraw/zinc/43/91/22/480439122.db2.gz YORGRYPIOYEOCV-RTWAWAEBSA-N 1 3 346.515 2.674 10 0 EFAEHO CC(C)[N@H+](C)Cc1ccccc1CNC[C@@H](O)C[C@@](C)(O)C1CC1 ZINC000634700335 480439871 /nfs/dbraw/zinc/43/98/71/480439871.db2.gz XQVNHYYAUKWMHY-VQTJNVASSA-N 1 3 334.504 2.528 10 0 EFAEHO CC(C)[N@@H+](C)Cc1ccccc1CNC[C@@H](O)C[C@@](C)(O)C1CC1 ZINC000634700335 480439876 /nfs/dbraw/zinc/43/98/76/480439876.db2.gz XQVNHYYAUKWMHY-VQTJNVASSA-N 1 3 334.504 2.528 10 0 EFAEHO CCN1CCN(Cc2ccccc2C[NH2+][C@H](C)[C@H]2CCCCO2)CC1 ZINC000623865806 480491958 /nfs/dbraw/zinc/49/19/58/480491958.db2.gz BKFNLOPCPWNGQF-WIYYLYMNSA-N 1 3 345.531 2.871 10 0 EFAEHO CCN1CCN(Cc2ccccc2C[NH2+][C@@H](C)[C@H]2CCCCO2)CC1 ZINC000623865803 480492558 /nfs/dbraw/zinc/49/25/58/480492558.db2.gz BKFNLOPCPWNGQF-GHTZIAJQSA-N 1 3 345.531 2.871 10 0 EFAEHO Cc1ccc(Br)cc1[C@H](C)[NH2+]C[C@H](O)CN1CCCC1 ZINC000623871339 480496716 /nfs/dbraw/zinc/49/67/16/480496716.db2.gz BNOSQHMWZKQCJE-ZFWWWQNUSA-N 1 3 341.293 2.865 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(CN2CCC(O)CC2)cc1)[C@H]1CCCCO1 ZINC000623888367 480504246 /nfs/dbraw/zinc/50/42/46/480504246.db2.gz DHGOVYWZESYCDJ-OXJNMPFZSA-N 1 3 332.488 2.691 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(CN2CCC(O)CC2)cc1)[C@H]1CCCCO1 ZINC000623888368 480504546 /nfs/dbraw/zinc/50/45/46/480504546.db2.gz DHGOVYWZESYCDJ-OXQOHEQNSA-N 1 3 332.488 2.691 10 0 EFAEHO C[NH+](C)C[C@H](O)CN[C@H]1CCCC[C@@H]1Sc1ccc(F)cc1 ZINC000623889088 480506745 /nfs/dbraw/zinc/50/67/45/480506745.db2.gz CJYLAOYNAHMOPY-PVAVHDDUSA-N 1 3 326.481 2.741 10 0 EFAEHO C[C@H]([NH2+]Cc1ccccc1CN1CCC(O)CC1)[C@H]1CCCCO1 ZINC000623903100 480512632 /nfs/dbraw/zinc/51/26/32/480512632.db2.gz YTDMQLDMXMXEKN-OXJNMPFZSA-N 1 3 332.488 2.691 10 0 EFAEHO CN1CCN(Cc2cccc(N[C@H]3CC[N@H+](C)C(C)(C)C3)c2)CC1 ZINC000623933038 480527946 /nfs/dbraw/zinc/52/79/46/480527946.db2.gz NWBSHPODOAQJHS-IBGZPJMESA-N 1 3 330.520 2.719 10 0 EFAEHO CN1CCN(Cc2cccc(N[C@H]3CC[N@@H+](C)C(C)(C)C3)c2)CC1 ZINC000623933038 480527952 /nfs/dbraw/zinc/52/79/52/480527952.db2.gz NWBSHPODOAQJHS-IBGZPJMESA-N 1 3 330.520 2.719 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NC[C@@H]2Cc3ccccc3CO2)[C@H](C)C1 ZINC000624054666 480585569 /nfs/dbraw/zinc/58/55/69/480585569.db2.gz JYQHUAUVZZHMRW-QMMLZNLJSA-N 1 3 346.515 2.855 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NC[C@@H]2Cc3ccccc3CO2)[C@H](C)C1 ZINC000624054666 480585578 /nfs/dbraw/zinc/58/55/78/480585578.db2.gz JYQHUAUVZZHMRW-QMMLZNLJSA-N 1 3 346.515 2.855 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@H]1CC[C@H](C)[NH2+]C1)c1ccsc1 ZINC000626934385 480587726 /nfs/dbraw/zinc/58/77/26/480587726.db2.gz YEOUFWRWKUZLLM-CWRNSKLLSA-N 1 3 338.521 2.571 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@H]2CN(c3ccc(Cl)cc3)CCO2)CC[N@@H+]1C ZINC000624118860 480617610 /nfs/dbraw/zinc/61/76/10/480617610.db2.gz QNZCXGRFNNPDSK-KYJSFNMBSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H]1C[C@H](NC[C@H]2CN(c3ccc(Cl)cc3)CCO2)CC[N@H+]1C ZINC000624118860 480617616 /nfs/dbraw/zinc/61/76/16/480617616.db2.gz QNZCXGRFNNPDSK-KYJSFNMBSA-N 1 3 337.895 2.618 10 0 EFAEHO C[N@H+](CCCCNC(=O)NC[C@@H]1CCN1C1CCCCC1)C1CC1 ZINC000624185446 480650277 /nfs/dbraw/zinc/65/02/77/480650277.db2.gz UETRLHROJDGPMN-SFHVURJKSA-N 1 3 336.524 2.567 10 0 EFAEHO C[N@@H+](CCCCNC(=O)NC[C@@H]1CCN1C1CCCCC1)C1CC1 ZINC000624185446 480650285 /nfs/dbraw/zinc/65/02/85/480650285.db2.gz UETRLHROJDGPMN-SFHVURJKSA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@H](Cc1ccccc1)N1CCC([NH2+]Cc2ccc[nH]c2=O)CC1 ZINC000624259153 480681491 /nfs/dbraw/zinc/68/14/91/480681491.db2.gz CYUMPPAQGMNGAO-MRXNPFEDSA-N 1 3 325.456 2.972 10 0 EFAEHO C[C@@H](Cc1ccccc1)N1CCC([NH2+]Cc2ccc[nH]c2=O)CC1 ZINC000624259152 480681619 /nfs/dbraw/zinc/68/16/19/480681619.db2.gz CYUMPPAQGMNGAO-INIZCTEOSA-N 1 3 325.456 2.972 10 0 EFAEHO O=C(NC[C@@H]1CC[N@@H+]1C1CCCCC1)N[C@H]1CCCN2CCCC[C@H]12 ZINC000624316394 480705628 /nfs/dbraw/zinc/70/56/28/480705628.db2.gz PAAHNVGTSMSKJW-GBESFXJTSA-N 1 3 348.535 2.710 10 0 EFAEHO O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)N[C@H]1CCCN2CCCC[C@H]12 ZINC000624316394 480705637 /nfs/dbraw/zinc/70/56/37/480705637.db2.gz PAAHNVGTSMSKJW-GBESFXJTSA-N 1 3 348.535 2.710 10 0 EFAEHO C[C@H]([NH2+][C@@H]1CCN(C2CCC2)C1=O)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000624343945 480718941 /nfs/dbraw/zinc/71/89/41/480718941.db2.gz DAWIWQQOVMMZAM-ILZDJORESA-N 1 3 341.499 2.640 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)N[C@H](C)CN2CCC[C@@H](C)C2)CC1 ZINC000633080876 480874587 /nfs/dbraw/zinc/87/45/87/480874587.db2.gz ACNHHPOALOBHKD-IAGOWNOFSA-N 1 3 338.540 2.623 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)N[C@H](C)CN2CCC[C@H](C)C2)CC1 ZINC000633080875 480874732 /nfs/dbraw/zinc/87/47/32/480874732.db2.gz ACNHHPOALOBHKD-DLBZAZTESA-N 1 3 338.540 2.623 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)N[C@@H](C)CN2CCC[C@H](C)C2)CC1 ZINC000633080877 480874923 /nfs/dbraw/zinc/87/49/23/480874923.db2.gz ACNHHPOALOBHKD-IRXDYDNUSA-N 1 3 338.540 2.623 10 0 EFAEHO [NH3+][C@@H]1CC[C@@H](C(=O)N[C@@H]2CCCCCN(Cc3ccccc3)C2)C1 ZINC000638850859 480895990 /nfs/dbraw/zinc/89/59/90/480895990.db2.gz HRAKUIVKJIAKFJ-GUDVDZBRSA-N 1 3 329.488 2.675 10 0 EFAEHO O=C(C[C@H]1CCC[NH2+]C1)N[C@@H]1CCCCCN(Cc2ccccc2)C1 ZINC000638851551 480896307 /nfs/dbraw/zinc/89/63/07/480896307.db2.gz OHKUULJQPFLJEJ-WOJBJXKFSA-N 1 3 343.515 2.937 10 0 EFAEHO N[C@H](CC(F)F)C(=O)N[C@H]1CCCCC[N@H+](Cc2ccccc2)C1 ZINC000638851693 480897217 /nfs/dbraw/zinc/89/72/17/480897217.db2.gz PMWXTFPBNCCXMG-JKSUJKDBSA-N 1 3 339.430 2.530 10 0 EFAEHO N[C@H](CC(F)F)C(=O)N[C@H]1CCCCC[N@@H+](Cc2ccccc2)C1 ZINC000638851693 480897219 /nfs/dbraw/zinc/89/72/19/480897219.db2.gz PMWXTFPBNCCXMG-JKSUJKDBSA-N 1 3 339.430 2.530 10 0 EFAEHO Cc1cccc2c1CC[C@@H]2NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000664005817 480964805 /nfs/dbraw/zinc/96/48/05/480964805.db2.gz CJECAITUVRRQSW-LPHOPBHVSA-N 1 3 346.519 2.554 10 0 EFAEHO Cc1cccc2c1CC[C@@H]2NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000664005817 480964810 /nfs/dbraw/zinc/96/48/10/480964810.db2.gz CJECAITUVRRQSW-LPHOPBHVSA-N 1 3 346.519 2.554 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H](CNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000661404398 480993541 /nfs/dbraw/zinc/99/35/41/480993541.db2.gz YBJDMPOTQDCZJP-IAGOWNOFSA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000661404398 480993553 /nfs/dbraw/zinc/99/35/53/480993553.db2.gz YBJDMPOTQDCZJP-IAGOWNOFSA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)N[C@H]2CC[N@@H+](C3CCCCC3)C2)CCN1C ZINC000666664356 481019803 /nfs/dbraw/zinc/01/98/03/481019803.db2.gz CEULYJHAVHPVGL-RYRKJORJSA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)N[C@H]2CC[N@H+](C3CCCCC3)C2)CCN1C ZINC000666664356 481019811 /nfs/dbraw/zinc/01/98/11/481019811.db2.gz CEULYJHAVHPVGL-RYRKJORJSA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CC[N@@H+](C3CCCCC3)C2)CCN1C ZINC000666664357 481021838 /nfs/dbraw/zinc/02/18/38/481021838.db2.gz CEULYJHAVHPVGL-SOLBZPMBSA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CC[N@H+](C3CCCCC3)C2)CCN1C ZINC000666664357 481021847 /nfs/dbraw/zinc/02/18/47/481021847.db2.gz CEULYJHAVHPVGL-SOLBZPMBSA-N 1 3 336.524 2.518 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[NH2+][C@@H](C)c1ccccc1)[C@@H]1CCN(C)C1 ZINC000664109576 481027534 /nfs/dbraw/zinc/02/75/34/481027534.db2.gz QMWWBTCKFPRORC-FUHWJXTLSA-N 1 3 346.519 2.851 10 0 EFAEHO O=C([C@@H]1CC[C@H](C2CC2)[NH2+]1)N1CCCN(CC2CCCCC2)CC1 ZINC000653112046 481086220 /nfs/dbraw/zinc/08/62/20/481086220.db2.gz KDVBLLXJMTYHTL-MOPGFXCFSA-N 1 3 333.520 2.632 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N[C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC000664227710 481110906 /nfs/dbraw/zinc/11/09/06/481110906.db2.gz DMHVOBMGOSDIEY-XLAORIBOSA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N[C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC000664227710 481110910 /nfs/dbraw/zinc/11/09/10/481110910.db2.gz DMHVOBMGOSDIEY-XLAORIBOSA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)c1noc(-c2ccnc(NCC[N@H+](C)CCCN(C)C)c2)n1 ZINC000664248505 481130072 /nfs/dbraw/zinc/13/00/72/481130072.db2.gz ZKDAYVQBKYCFMP-UHFFFAOYSA-N 1 3 346.479 2.550 10 0 EFAEHO CC(C)c1noc(-c2ccnc(NCC[N@@H+](C)CCCN(C)C)c2)n1 ZINC000664248505 481130073 /nfs/dbraw/zinc/13/00/73/481130073.db2.gz ZKDAYVQBKYCFMP-UHFFFAOYSA-N 1 3 346.479 2.550 10 0 EFAEHO CN(C)CCC[N@H+](C)CCNc1ncc(Cl)cc1Br ZINC000664248372 481130304 /nfs/dbraw/zinc/13/03/04/481130304.db2.gz ULTJRQHKAZZFJU-UHFFFAOYSA-N 1 3 349.704 2.793 10 0 EFAEHO CN(C)CCC[N@@H+](C)CCNc1ncc(Cl)cc1Br ZINC000664248372 481130309 /nfs/dbraw/zinc/13/03/09/481130309.db2.gz ULTJRQHKAZZFJU-UHFFFAOYSA-N 1 3 349.704 2.793 10 0 EFAEHO C[NH+](C)CCc1ccccc1NC(=O)NC[C@H]1CCN1C(C)(C)C ZINC000666839717 481139455 /nfs/dbraw/zinc/13/94/55/481139455.db2.gz FODHFFSCRUDJPQ-MRXNPFEDSA-N 1 3 332.492 2.785 10 0 EFAEHO N[C@@H]1CN(C(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)CC[C@H]1F ZINC000658986730 481143190 /nfs/dbraw/zinc/14/31/90/481143190.db2.gz ANYWHGLYUQXHMM-QZTJIDSGSA-N 1 3 348.466 2.618 10 0 EFAEHO CC1(C)CC(NC(=O)N2CCc3ccccc3[C@@H]2CN)CC(C)(C)[NH2+]1 ZINC000646181458 481143893 /nfs/dbraw/zinc/14/38/93/481143893.db2.gz OMZSCECZANHTNC-KRWDZBQOSA-N 1 3 344.503 2.563 10 0 EFAEHO CCN(C(=O)NCC[C@H](C)[N@H+](C)Cc1ccccc1)[C@@H]1CCN(C)C1 ZINC000664292844 481157216 /nfs/dbraw/zinc/15/72/16/481157216.db2.gz SFWAUSGUYCFYLJ-PKOBYXMFSA-N 1 3 346.519 2.633 10 0 EFAEHO CCN(C(=O)NCC[C@H](C)[N@@H+](C)Cc1ccccc1)[C@@H]1CCN(C)C1 ZINC000664292844 481157222 /nfs/dbraw/zinc/15/72/22/481157222.db2.gz SFWAUSGUYCFYLJ-PKOBYXMFSA-N 1 3 346.519 2.633 10 0 EFAEHO CCN(C(=O)NC1CC[NH+](C2CCCC2)CC1)[C@H]1CCN(CC)C1 ZINC000664321644 481175886 /nfs/dbraw/zinc/17/58/86/481175886.db2.gz VSDKBKMUAPPXSV-SFHVURJKSA-N 1 3 336.524 2.519 10 0 EFAEHO c1cc(CN2CCC(OCC[NH+]3CCCC3)CC2)c2c(c1)COCC2 ZINC000639508515 481266357 /nfs/dbraw/zinc/26/63/57/481266357.db2.gz NAPMOHSUSGPYFC-UHFFFAOYSA-N 1 3 344.499 2.836 10 0 EFAEHO COc1ccc(Cl)c(N2CCN(C[C@H]3CC[NH2+][C@@H](C)C3)CC2)c1 ZINC000650704231 481270998 /nfs/dbraw/zinc/27/09/98/481270998.db2.gz OPTVDCHBSLLJJE-GJZGRUSLSA-N 1 3 337.895 2.859 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC[NH2+]1 ZINC000646408904 481281474 /nfs/dbraw/zinc/28/14/74/481281474.db2.gz RQEKGKFMSLNRPX-YTQUADARSA-N 1 3 329.488 2.718 10 0 EFAEHO COc1ccc(OC)c(CN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)c1 ZINC000650722111 481289043 /nfs/dbraw/zinc/28/90/43/481289043.db2.gz LAZIKDJGFMJHDO-SUMDDJOVSA-N 1 3 334.460 2.565 10 0 EFAEHO COc1cccc(CN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)c1OC ZINC000650722553 481290531 /nfs/dbraw/zinc/29/05/31/481290531.db2.gz WIWMQBVCORZBFP-NUJGCVRESA-N 1 3 334.460 2.565 10 0 EFAEHO CCN(C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)[C@H]1CC[N@H+](CC)C1 ZINC000664542173 481320789 /nfs/dbraw/zinc/32/07/89/481320789.db2.gz UDUKOLNGYKSBMR-IPMKNSEASA-N 1 3 344.503 2.558 10 0 EFAEHO CCN(C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)[C@H]1CC[N@@H+](CC)C1 ZINC000664542173 481320795 /nfs/dbraw/zinc/32/07/95/481320795.db2.gz UDUKOLNGYKSBMR-IPMKNSEASA-N 1 3 344.503 2.558 10 0 EFAEHO C[NH+](C)CCOc1cccc(NC(=O)C[C@@H]2NCc3ccccc32)c1 ZINC000659285823 481335790 /nfs/dbraw/zinc/33/57/90/481335790.db2.gz RVUKYYOJIBOZOF-IBGZPJMESA-N 1 3 339.439 2.800 10 0 EFAEHO CCN1CCN(c2ccc(C(=O)Nc3cccc(C[NH3+])c3)cc2)CC1 ZINC000646578950 481387050 /nfs/dbraw/zinc/38/70/50/481387050.db2.gz KMXNXTPHFPMIPU-UHFFFAOYSA-N 1 3 338.455 2.540 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccc2cnccc2c1 ZINC000667215620 481408704 /nfs/dbraw/zinc/40/87/04/481408704.db2.gz KUKBUXZYXSXRPG-HNNXBMFYSA-N 1 3 343.475 2.628 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccc2cnccc2c1 ZINC000667215620 481408708 /nfs/dbraw/zinc/40/87/08/481408708.db2.gz KUKBUXZYXSXRPG-HNNXBMFYSA-N 1 3 343.475 2.628 10 0 EFAEHO CCc1ccc([C@@H](CNC(=O)NCC[C@@H]([NH3+])C(C)C)N(C)C)cc1 ZINC000659428145 481429026 /nfs/dbraw/zinc/42/90/26/481429026.db2.gz XOJDBOQQWXVGRW-QZTJIDSGSA-N 1 3 334.508 2.524 10 0 EFAEHO Cc1c(NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)ccc(F)c1F ZINC000667253449 481434070 /nfs/dbraw/zinc/43/40/70/481434070.db2.gz CXAPZDOAEHWWKZ-LBPRGKRZSA-N 1 3 342.434 2.667 10 0 EFAEHO Cc1c(NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)ccc(F)c1F ZINC000667253449 481434075 /nfs/dbraw/zinc/43/40/75/481434075.db2.gz CXAPZDOAEHWWKZ-LBPRGKRZSA-N 1 3 342.434 2.667 10 0 EFAEHO CCN(C(=O)NCC[NH2+]C1CC1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000637297646 481438774 /nfs/dbraw/zinc/43/87/74/481438774.db2.gz PXMDJOZKHIZGDM-LPHOPBHVSA-N 1 3 344.503 2.605 10 0 EFAEHO CCCN1CC[C@@H](NC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000661953330 481442391 /nfs/dbraw/zinc/44/23/91/481442391.db2.gz AKBPSZFNJIZRMN-LJQANCHMSA-N 1 3 344.503 2.566 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)NCC1(N(C)Cc2ccccc2)CCC1 ZINC000659499815 481472380 /nfs/dbraw/zinc/47/23/80/481472380.db2.gz MXRXOCQJUDFOOD-GOSISDBHSA-N 1 3 346.519 2.714 10 0 EFAEHO C[C@H]([NH2+]CC(=O)NC[C@@H](c1ccccc1)N(C)C)C1CCC(F)CC1 ZINC000661999915 481475805 /nfs/dbraw/zinc/47/58/05/481475805.db2.gz DRQDABLTXWLSME-GSHBMFQSSA-N 1 3 349.494 2.912 10 0 EFAEHO CN(CC[NH+]1CCCCC1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000650996079 481490649 /nfs/dbraw/zinc/49/06/49/481490649.db2.gz WUAHWYYHABXEGX-RTBURBONSA-N 1 3 344.503 2.559 10 0 EFAEHO CCC[N@H+](CC)Cc1ccc(C(=O)N2CC[C@@H]3CN(C)C[C@H]32)cc1 ZINC000646912186 481547005 /nfs/dbraw/zinc/54/70/05/481547005.db2.gz OVSPYWJPNKFDQS-RTBURBONSA-N 1 3 329.488 2.695 10 0 EFAEHO CCC[N@@H+](CC)Cc1ccc(C(=O)N2CC[C@@H]3CN(C)C[C@H]32)cc1 ZINC000646912186 481547013 /nfs/dbraw/zinc/54/70/13/481547013.db2.gz OVSPYWJPNKFDQS-RTBURBONSA-N 1 3 329.488 2.695 10 0 EFAEHO CCN(C(=O)N[C@@H](CC(C)C)C[NH+]1CCCC1)[C@@H]1CCN(CC)C1 ZINC000664984285 481604664 /nfs/dbraw/zinc/60/46/64/481604664.db2.gz YKNHZJPTKXPXJB-ZWKOTPCHSA-N 1 3 338.540 2.623 10 0 EFAEHO CC1CC[NH+](C[C@H]2CCCN(CC3(O)CCSCC3)C2)CC1 ZINC000659862755 481605930 /nfs/dbraw/zinc/60/59/30/481605930.db2.gz DRAJLWMPWXGNBO-QGZVFWFLSA-N 1 3 326.550 2.688 10 0 EFAEHO CC1CCN(C[C@H]2CCC[N@H+](CC3(O)CCSCC3)C2)CC1 ZINC000659862755 481605936 /nfs/dbraw/zinc/60/59/36/481605936.db2.gz DRAJLWMPWXGNBO-QGZVFWFLSA-N 1 3 326.550 2.688 10 0 EFAEHO CC1CCN(C[C@H]2CCC[N@@H+](CC3(O)CCSCC3)C2)CC1 ZINC000659862755 481605942 /nfs/dbraw/zinc/60/59/42/481605942.db2.gz DRAJLWMPWXGNBO-QGZVFWFLSA-N 1 3 326.550 2.688 10 0 EFAEHO CC(C)[N@H+](C)CC1CCN(Cc2ccnn2-c2ccncc2)CC1 ZINC000667534801 481628215 /nfs/dbraw/zinc/62/82/15/481628215.db2.gz LSNNQFBKNVLGBJ-UHFFFAOYSA-N 1 3 327.476 2.820 10 0 EFAEHO CC(C)[N@@H+](C)CC1CCN(Cc2ccnn2-c2ccncc2)CC1 ZINC000667534801 481628221 /nfs/dbraw/zinc/62/82/21/481628221.db2.gz LSNNQFBKNVLGBJ-UHFFFAOYSA-N 1 3 327.476 2.820 10 0 EFAEHO c1cc(C[N@@H+](C[C@H]2CCC3(CNC3)O2)C2CCCC2)cc2c1OCO2 ZINC000662248623 481664047 /nfs/dbraw/zinc/66/40/47/481664047.db2.gz HZAPRAKGMCIHRU-QGZVFWFLSA-N 1 3 344.455 2.681 10 0 EFAEHO c1cc(C[N@H+](C[C@H]2CCC3(CNC3)O2)C2CCCC2)cc2c1OCO2 ZINC000662248623 481664050 /nfs/dbraw/zinc/66/40/50/481664050.db2.gz HZAPRAKGMCIHRU-QGZVFWFLSA-N 1 3 344.455 2.681 10 0 EFAEHO CC(C)[NH+]1CCN(c2ccc(-c3nc([C@H]4CCCN4)no3)cc2)CC1 ZINC000647147985 481665381 /nfs/dbraw/zinc/66/53/81/481665381.db2.gz CSYFFCLQOKORMA-QGZVFWFLSA-N 1 3 341.459 2.692 10 0 EFAEHO CC[C@H](NCc1ccc(OCC[NH+]2CCCC2)cc1)[C@H](O)C(F)F ZINC000648694042 481672294 /nfs/dbraw/zinc/67/22/94/481672294.db2.gz VGDWYAYZAWOPDA-IRXDYDNUSA-N 1 3 342.430 2.655 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNCc2ccnn2-c2ccccn2)C1 ZINC000647171390 481682358 /nfs/dbraw/zinc/68/23/58/481682358.db2.gz IECNDXQMRKTHOS-QGZVFWFLSA-N 1 3 327.476 2.869 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNCc2ccnn2-c2ccccn2)C1 ZINC000647171390 481682366 /nfs/dbraw/zinc/68/23/66/481682366.db2.gz IECNDXQMRKTHOS-QGZVFWFLSA-N 1 3 327.476 2.869 10 0 EFAEHO C[C@@H](C(=O)N(C)C1CCCCC1)N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662293446 481696907 /nfs/dbraw/zinc/69/69/07/481696907.db2.gz LDMQTSQPKZPIKQ-FUHWJXTLSA-N 1 3 335.536 2.878 10 0 EFAEHO O=C(CN1CCC[C@H](C2CC[NH2+]CC2)C1)N1CCCc2ccccc21 ZINC000662292981 481698413 /nfs/dbraw/zinc/69/84/13/481698413.db2.gz DDFDCWNDBXAYBN-IBGZPJMESA-N 1 3 341.499 2.677 10 0 EFAEHO O=C(CN1CCC[C@H](C2CC[NH2+]CC2)C1)N1CCC[C@H]2CCCC[C@@H]21 ZINC000662295843 481700001 /nfs/dbraw/zinc/70/00/01/481700001.db2.gz HZYZPQPPYXRNCB-AABGKKOBSA-N 1 3 347.547 2.879 10 0 EFAEHO C[C@@H]1CCC[C@H](NC(=O)CN2CCC[C@H](C3CC[NH2+]CC3)C2)[C@@H]1C ZINC000662294308 481700691 /nfs/dbraw/zinc/70/06/91/481700691.db2.gz LGRQGWIQGQTHQH-FPAYPSAMSA-N 1 3 335.536 2.639 10 0 EFAEHO CC(C)N(C(=O)CN1CCC[C@@H](C2CC[NH2+]CC2)C1)C1CCCC1 ZINC000662296774 481703428 /nfs/dbraw/zinc/70/34/28/481703428.db2.gz NDRUFZRMXSTEHT-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO CCc1ccc(NC(=O)CN2CCC[C@H](C3CC[NH2+]CC3)C2)cc1 ZINC000662296092 481703871 /nfs/dbraw/zinc/70/38/71/481703871.db2.gz VXGSGFJQJZSNDZ-SFHVURJKSA-N 1 3 329.488 2.899 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662337290 481734307 /nfs/dbraw/zinc/73/43/07/481734307.db2.gz KZPYRTVKWCZZIY-IAGOWNOFSA-N 1 3 333.524 2.681 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662337290 481734315 /nfs/dbraw/zinc/73/43/15/481734315.db2.gz KZPYRTVKWCZZIY-IAGOWNOFSA-N 1 3 333.524 2.681 10 0 EFAEHO c1c([C@@H]2CCC[N@@H+](CC3CCCCCC3)C2)[nH]nc1N1CCNCC1 ZINC000662338951 481737784 /nfs/dbraw/zinc/73/77/84/481737784.db2.gz XOUATZZKMWFTNS-GOSISDBHSA-N 1 3 345.535 2.969 10 0 EFAEHO c1c([C@@H]2CCC[N@H+](CC3CCCCCC3)C2)[nH]nc1N1CCNCC1 ZINC000662338951 481737791 /nfs/dbraw/zinc/73/77/91/481737791.db2.gz XOUATZZKMWFTNS-GOSISDBHSA-N 1 3 345.535 2.969 10 0 EFAEHO CCOc1ccc([C@@H]2CCNC[C@@H]2[NH2+]C2CCN(CC)CC2)cc1 ZINC000665254430 481749424 /nfs/dbraw/zinc/74/94/24/481749424.db2.gz PZYYULUNPREYHG-PMACEKPBSA-N 1 3 331.504 2.605 10 0 EFAEHO CCOc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@H]2CN(C3CC3)C[C@H]2C)cc1 ZINC000665255194 481751245 /nfs/dbraw/zinc/75/12/45/481751245.db2.gz LHVBUGYUTKDJPQ-DVMWJLJYSA-N 1 3 343.515 2.603 10 0 EFAEHO CCOc1ccc([C@@H]2CCNC[C@@H]2[NH2+][C@H]2CCN(C)[C@@H](C)C2)cc1 ZINC000665255126 481751490 /nfs/dbraw/zinc/75/14/90/481751490.db2.gz JPTWWOGLPVXTGP-UHMOLFJZSA-N 1 3 331.504 2.603 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](N[C@H]2CCc3cc(N)ccc32)[C@H](C)C1 ZINC000665269262 481758507 /nfs/dbraw/zinc/75/85/07/481758507.db2.gz CKOHZBXHNYXLTO-XPGWFJOJSA-N 1 3 331.504 2.983 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](N[C@H]2CCc3cc(N)ccc32)[C@H](C)C1 ZINC000665269262 481758512 /nfs/dbraw/zinc/75/85/12/481758512.db2.gz CKOHZBXHNYXLTO-XPGWFJOJSA-N 1 3 331.504 2.983 10 0 EFAEHO CN(C(=O)Nc1cccc(C[NH3+])c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000667725296 481763550 /nfs/dbraw/zinc/76/35/50/481763550.db2.gz CHDKFGNXVPVGFC-LJQANCHMSA-N 1 3 338.455 2.884 10 0 EFAEHO c1ccc2c(CCN[C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)nsc2c1 ZINC000665276670 481763664 /nfs/dbraw/zinc/76/36/64/481763664.db2.gz JZPSYDIQJGCVCA-BZUAXINKSA-N 1 3 331.485 2.586 10 0 EFAEHO CN(C(=O)Nc1cccc(C[NH3+])c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000667725294 481763843 /nfs/dbraw/zinc/76/38/43/481763843.db2.gz CHDKFGNXVPVGFC-IBGZPJMESA-N 1 3 338.455 2.884 10 0 EFAEHO CCC[C@@H](NC1CCN(C(=O)CCC[NH2+]C)CC1)c1ccccn1 ZINC000665287433 481772595 /nfs/dbraw/zinc/77/25/95/481772595.db2.gz KWGBEXSLUUVKPD-GOSISDBHSA-N 1 3 332.492 2.503 10 0 EFAEHO C[C@H]1CCC[N@H+](CCCCNC(=O)C[C@H]2NCc3ccccc32)C1 ZINC000662389591 481779652 /nfs/dbraw/zinc/77/96/52/481779652.db2.gz SXSOVMQBOZIMAC-QFBILLFUSA-N 1 3 329.488 2.849 10 0 EFAEHO C[C@H]1CCC[N@@H+](CCCCNC(=O)C[C@H]2NCc3ccccc32)C1 ZINC000662389591 481779659 /nfs/dbraw/zinc/77/96/59/481779659.db2.gz SXSOVMQBOZIMAC-QFBILLFUSA-N 1 3 329.488 2.849 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNC(=O)C[C@H]2NCc3ccccc32)C1 ZINC000662389592 481779706 /nfs/dbraw/zinc/77/97/06/481779706.db2.gz SXSOVMQBOZIMAC-VQIMIIECSA-N 1 3 329.488 2.849 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNC(=O)C[C@H]2NCc3ccccc32)C1 ZINC000662389592 481779715 /nfs/dbraw/zinc/77/97/15/481779715.db2.gz SXSOVMQBOZIMAC-VQIMIIECSA-N 1 3 329.488 2.849 10 0 EFAEHO CC(C)(C)CCN1CCN(C(=O)C[C@@H]2[NH2+]Cc3ccccc32)CC1 ZINC000662400386 481786331 /nfs/dbraw/zinc/78/63/31/481786331.db2.gz UYZGPHSDLZXHNG-SFHVURJKSA-N 1 3 329.488 2.801 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)C[C@H]1NCc2ccccc21 ZINC000662429560 481801025 /nfs/dbraw/zinc/80/10/25/481801025.db2.gz OQWDQNKZYBNHNZ-PKOBYXMFSA-N 1 3 329.488 2.992 10 0 EFAEHO CCCC[N@H+]1CCCC[C@H]1CNC(=O)C[C@H]1NCc2ccccc21 ZINC000662429560 481801027 /nfs/dbraw/zinc/80/10/27/481801027.db2.gz OQWDQNKZYBNHNZ-PKOBYXMFSA-N 1 3 329.488 2.992 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)C[C@@H]1NCc2ccccc21 ZINC000662429559 481801175 /nfs/dbraw/zinc/80/11/75/481801175.db2.gz OQWDQNKZYBNHNZ-MJGOQNOKSA-N 1 3 329.488 2.992 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)C[C@@H]1NCc2ccccc21 ZINC000662429559 481801180 /nfs/dbraw/zinc/80/11/80/481801180.db2.gz OQWDQNKZYBNHNZ-MJGOQNOKSA-N 1 3 329.488 2.992 10 0 EFAEHO c1ccc(N2CCN(CCCC[NH2+][C@@H]3CO[C@@H](C4CC4)C3)CC2)cc1 ZINC000667793021 481808183 /nfs/dbraw/zinc/80/81/83/481808183.db2.gz PEEGBZXGLTUDTA-PZJWPPBQSA-N 1 3 343.515 2.746 10 0 EFAEHO c1ccc(N2CCN(CCCC[NH2+][C@@H]3CO[C@H](C4CC4)C3)CC2)cc1 ZINC000667793020 481808609 /nfs/dbraw/zinc/80/86/09/481808609.db2.gz PEEGBZXGLTUDTA-FPOVZHCZSA-N 1 3 343.515 2.746 10 0 EFAEHO CCCN(CC[NH+](CC)CC)C(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000665361219 481820601 /nfs/dbraw/zinc/82/06/01/481820601.db2.gz LMCFTJZLEQWXTM-INIZCTEOSA-N 1 3 326.529 2.623 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000665365818 481822630 /nfs/dbraw/zinc/82/26/30/481822630.db2.gz LSEDPWGBKGKZHI-DLBZAZTESA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000665366429 481826232 /nfs/dbraw/zinc/82/62/32/481826232.db2.gz YZEKGUCSZRTHCM-SJORKVTESA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)CN(CCN(C)C)C(=O)c1ccc2c(c1)[C@@H](C[NH3+])CCC2 ZINC000662525412 481860157 /nfs/dbraw/zinc/86/01/57/481860157.db2.gz SZGMJOQTIHDEFD-GOSISDBHSA-N 1 3 331.504 2.725 10 0 EFAEHO C[C@H](NC(C)(C)CNC(=O)NC[C@H]1C[C@@H]([NH+](C)C)C1)c1ccccc1 ZINC000654442616 481874343 /nfs/dbraw/zinc/87/43/43/481874343.db2.gz OBXWOBKBUKXKFJ-XYJFISCASA-N 1 3 346.519 2.755 10 0 EFAEHO Cc1cccc(O[C@@H]2CCCC[C@@H]2[NH2+]C[C@@H](O)CN(C)C(C)C)c1 ZINC000660321346 481895172 /nfs/dbraw/zinc/89/51/72/481895172.db2.gz OFDQDKMCCLMFAM-YZGWKJHDSA-N 1 3 334.504 2.976 10 0 EFAEHO C[C@H](C(=O)Nc1ccc([C@@H]2CNCCO2)cc1)[C@@H]([NH3+])c1ccccc1 ZINC000662685904 481933460 /nfs/dbraw/zinc/93/34/60/481933460.db2.gz IFMCJIBNPIWYPQ-ZOCIIQOWSA-N 1 3 339.439 2.622 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](CCCNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000660396862 481935268 /nfs/dbraw/zinc/93/52/68/481935268.db2.gz PFFCQRAODSVJBD-BBWFWOEESA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000660396862 481935274 /nfs/dbraw/zinc/93/52/74/481935274.db2.gz PFFCQRAODSVJBD-BBWFWOEESA-N 1 3 338.540 2.526 10 0 EFAEHO CCC[C@](C)(N)C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662713290 481944902 /nfs/dbraw/zinc/94/49/02/481944902.db2.gz YRFDJNUYGIOWIB-QUCCMNQESA-N 1 3 343.515 2.922 10 0 EFAEHO CCC[C@](C)(N)C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662713290 481944911 /nfs/dbraw/zinc/94/49/11/481944911.db2.gz YRFDJNUYGIOWIB-QUCCMNQESA-N 1 3 343.515 2.922 10 0 EFAEHO [NH3+]C1(CC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)CC1 ZINC000662748494 481958599 /nfs/dbraw/zinc/95/85/99/481958599.db2.gz WLEPHUPAWGCKKT-UHFFFAOYSA-N 1 3 341.499 2.915 10 0 EFAEHO CC(C)(N)C(=O)N1CC(C)(C)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000662760409 481961829 /nfs/dbraw/zinc/96/18/29/481961829.db2.gz WLUUUXCKNXPEKF-GOSISDBHSA-N 1 3 343.515 2.873 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N(C)[C@H]1CCc2ccccc21 ZINC000665637896 481974758 /nfs/dbraw/zinc/97/47/58/481974758.db2.gz SHBDFRFOBSQJKX-LPHOPBHVSA-N 1 3 346.519 2.587 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N(C)[C@H]1CCc2ccccc21 ZINC000665637896 481974763 /nfs/dbraw/zinc/97/47/63/481974763.db2.gz SHBDFRFOBSQJKX-LPHOPBHVSA-N 1 3 346.519 2.587 10 0 EFAEHO C[C@@H](NC(=O)C1(NC2CC2)CCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000662805332 481978759 /nfs/dbraw/zinc/97/87/59/481978759.db2.gz WOPDBSQXEYKRQW-AEFFLSMTSA-N 1 3 341.499 2.688 10 0 EFAEHO C[C@@H](NC(=O)C1(NC2CC2)CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000662805332 481978764 /nfs/dbraw/zinc/97/87/64/481978764.db2.gz WOPDBSQXEYKRQW-AEFFLSMTSA-N 1 3 341.499 2.688 10 0 EFAEHO CC(C)[C@@H](C(=O)Nc1ccc([C@@H]2CNCCO2)cc1)[NH+]1CCCCC1 ZINC000662884837 482004917 /nfs/dbraw/zinc/00/49/17/482004917.db2.gz PRLOEPKPQFFDMC-OALUTQOASA-N 1 3 345.487 2.797 10 0 EFAEHO CC[C@H](NC1CC[NH+](CCN2CCOCC2)CC1)c1ccccc1F ZINC000651933236 482006520 /nfs/dbraw/zinc/00/65/20/482006520.db2.gz ROXQKFBGPAWIPC-FQEVSTJZSA-N 1 3 349.494 2.663 10 0 EFAEHO CC[C@@H](C)[C@H](N)C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662918523 482012914 /nfs/dbraw/zinc/01/29/14/482012914.db2.gz DTZMFUHXANWWBN-QRQLOZEOSA-N 1 3 343.515 2.778 10 0 EFAEHO CC[C@@H](C)[C@H](N)C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662918523 482012918 /nfs/dbraw/zinc/01/29/18/482012918.db2.gz DTZMFUHXANWWBN-QRQLOZEOSA-N 1 3 343.515 2.778 10 0 EFAEHO CO[C@H](CN1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1)[C@H]1CCOC1 ZINC000660542099 482014545 /nfs/dbraw/zinc/01/45/45/482014545.db2.gz ZYVKCRPLSRBFHY-HBMCJLEFSA-N 1 3 344.499 2.636 10 0 EFAEHO CO[C@H](CN1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1)[C@H]1CCOC1 ZINC000660542099 482014550 /nfs/dbraw/zinc/01/45/50/482014550.db2.gz ZYVKCRPLSRBFHY-HBMCJLEFSA-N 1 3 344.499 2.636 10 0 EFAEHO C[NH+](C)CCCOc1ccc(NC(=O)[C@@H]2NCCCC2(C)C)cc1 ZINC000649329026 482029716 /nfs/dbraw/zinc/02/97/16/482029716.db2.gz YALIUZSQRSFMMD-KRWDZBQOSA-N 1 3 333.476 2.734 10 0 EFAEHO CCC(C)(C)[C@H](C)NC(=O)NC1CCN(C2CC[NH+](C)CC2)CC1 ZINC000660573571 482034443 /nfs/dbraw/zinc/03/44/43/482034443.db2.gz IPLGKECTZZLTEY-HNNXBMFYSA-N 1 3 338.540 2.669 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CC2(CC2)c2ccccc21 ZINC000665758758 482038992 /nfs/dbraw/zinc/03/89/92/482038992.db2.gz OLFVILZQGMSMNL-INIZCTEOSA-N 1 3 344.503 2.520 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CC2(CC2)c2ccccc21 ZINC000665758758 482038995 /nfs/dbraw/zinc/03/89/95/482038995.db2.gz OLFVILZQGMSMNL-INIZCTEOSA-N 1 3 344.503 2.520 10 0 EFAEHO Cc1ccc(C)c(CN(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000665761677 482040074 /nfs/dbraw/zinc/04/00/74/482040074.db2.gz MQCHAEPFVKXHKI-SFHVURJKSA-N 1 3 348.535 2.717 10 0 EFAEHO Cc1ccc(C)c(CN(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000665761677 482040082 /nfs/dbraw/zinc/04/00/82/482040082.db2.gz MQCHAEPFVKXHKI-SFHVURJKSA-N 1 3 348.535 2.717 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCC2(CO)CCC2)CC1 ZINC000652036390 482044779 /nfs/dbraw/zinc/04/47/79/482044779.db2.gz HCCYRMUYEBJGMQ-UHFFFAOYSA-N 1 3 345.531 2.861 10 0 EFAEHO O=C(N[C@H]1CC[NH2+]C12CCCC2)c1cccc(CN2CCCC2)c1 ZINC000649372551 482046697 /nfs/dbraw/zinc/04/66/97/482046697.db2.gz CACLCKDUYKXEBA-SFHVURJKSA-N 1 3 327.472 2.687 10 0 EFAEHO COc1cc(F)ccc1N1CCN(CCCC2CC[NH2+]CC2)CC1 ZINC000649413657 482067973 /nfs/dbraw/zinc/06/79/73/482067973.db2.gz XEEIZQUBSIWYEA-UHFFFAOYSA-N 1 3 335.467 2.736 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)C[N@@H+]1CCC[C@]2(CCN(C)C2)C1 ZINC000660652835 482072381 /nfs/dbraw/zinc/07/23/81/482072381.db2.gz MUPDFWXJPZGMAS-GHTZIAJQSA-N 1 3 346.515 2.967 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@]2(CCN(C)C2)C1 ZINC000660652835 482072389 /nfs/dbraw/zinc/07/23/89/482072389.db2.gz MUPDFWXJPZGMAS-GHTZIAJQSA-N 1 3 346.515 2.967 10 0 EFAEHO C[C@@H](c1ccccc1)N1CCC(NC(=O)NCCC2(C[NH3+])CC2)CC1 ZINC000652154036 482100797 /nfs/dbraw/zinc/10/07/97/482100797.db2.gz ULWKHWUZJOTPDB-INIZCTEOSA-N 1 3 344.503 2.640 10 0 EFAEHO Cc1cc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc(C)c1O ZINC000668489742 482142224 /nfs/dbraw/zinc/14/22/24/482142224.db2.gz LYWYXOGCQRYVKT-FQEVSTJZSA-N 1 3 340.467 2.865 10 0 EFAEHO Cc1cc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)cc(C)c1O ZINC000668489742 482142234 /nfs/dbraw/zinc/14/22/34/482142234.db2.gz LYWYXOGCQRYVKT-FQEVSTJZSA-N 1 3 340.467 2.865 10 0 EFAEHO CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)CS1 ZINC000668488575 482143007 /nfs/dbraw/zinc/14/30/07/482143007.db2.gz BVXFKZNTUWWLLT-OTWHNJEPSA-N 1 3 334.529 2.873 10 0 EFAEHO COCC1(C2CCC2)CN(Cc2ccc(OCC[NH+](C)C)cc2)C1 ZINC000668513321 482149691 /nfs/dbraw/zinc/14/96/91/482149691.db2.gz HCVIBLPCNNJXBP-UHFFFAOYSA-N 1 3 332.488 2.876 10 0 EFAEHO C[NH2+]Cc1ccccc1CNC(=O)N1CCN(C2CCCCC2)CC1 ZINC000652288222 482158384 /nfs/dbraw/zinc/15/83/84/482158384.db2.gz ZZEAIELGPQYOFK-UHFFFAOYSA-N 1 3 344.503 2.566 10 0 EFAEHO Cn1cc(C[C@H]2CCC[C@H]2[NH2+]C2CCN(c3ccncc3)CC2)cn1 ZINC000668609874 482187955 /nfs/dbraw/zinc/18/79/55/482187955.db2.gz IQXLNKOCIQDSBE-YLJYHZDGSA-N 1 3 339.487 2.785 10 0 EFAEHO CN(c1ccccc1C[N@@H+]1CC[C@H]2COC[C@H]2C1)C1CCN(C)CC1 ZINC000668706629 482221772 /nfs/dbraw/zinc/22/17/72/482221772.db2.gz UEBWBSXRQUPXGG-RBUKOAKNSA-N 1 3 343.515 2.685 10 0 EFAEHO CN(c1ccccc1C[N@H+]1CC[C@H]2COC[C@H]2C1)C1CCN(C)CC1 ZINC000668706629 482221776 /nfs/dbraw/zinc/22/17/76/482221776.db2.gz UEBWBSXRQUPXGG-RBUKOAKNSA-N 1 3 343.515 2.685 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2C[C@H](C)[C@](C)(CO)C2)CC1 ZINC000668739063 482241089 /nfs/dbraw/zinc/24/10/89/482241089.db2.gz LYSVGNWWNNXOGI-RXVVDRJESA-N 1 3 345.531 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2C[C@H](C)[C@](C)(CO)C2)CC1 ZINC000668739063 482241099 /nfs/dbraw/zinc/24/10/99/482241099.db2.gz LYSVGNWWNNXOGI-RXVVDRJESA-N 1 3 345.531 2.669 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(NCc2cccc(Cl)c2F)CC1 ZINC000663503451 482268266 /nfs/dbraw/zinc/26/82/66/482268266.db2.gz IIBINZQSMRKUBE-UHFFFAOYSA-N 1 3 341.858 2.559 10 0 EFAEHO C[C@H](C[N@@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1)C(C)(C)C ZINC000663510215 482271707 /nfs/dbraw/zinc/27/17/07/482271707.db2.gz DUYWKXPMVXOSRG-CVEARBPZSA-N 1 3 333.524 2.681 10 0 EFAEHO C[C@H](C[N@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1)C(C)(C)C ZINC000663510215 482271713 /nfs/dbraw/zinc/27/17/13/482271713.db2.gz DUYWKXPMVXOSRG-CVEARBPZSA-N 1 3 333.524 2.681 10 0 EFAEHO C[C@@H]1CCC[C@@H](C[N@@H+]2CCC[C@H](c3cc(N4CCNCC4)n[nH]3)C2)C1 ZINC000663513653 482273732 /nfs/dbraw/zinc/27/37/32/482273732.db2.gz TUXULSRFYZDDRR-KURKYZTESA-N 1 3 345.535 2.825 10 0 EFAEHO C[C@@H]1CCC[C@@H](C[N@H+]2CCC[C@H](c3cc(N4CCNCC4)n[nH]3)C2)C1 ZINC000663513653 482273735 /nfs/dbraw/zinc/27/37/35/482273735.db2.gz TUXULSRFYZDDRR-KURKYZTESA-N 1 3 345.535 2.825 10 0 EFAEHO O=C(NCc1ccccc1CN1CCCCC1)NC[C@H]1CCCC[NH2+]1 ZINC000668864788 482300841 /nfs/dbraw/zinc/30/08/41/482300841.db2.gz WGRFMJFRSZVCAX-LJQANCHMSA-N 1 3 344.503 2.614 10 0 EFAEHO CCN(C(=O)NCc1ccccc1C[N@H+](C)C(C)C)[C@@H]1CCN(C)C1 ZINC000663583708 482308732 /nfs/dbraw/zinc/30/87/32/482308732.db2.gz YLIVRLFFYOOMJR-LJQANCHMSA-N 1 3 346.519 2.762 10 0 EFAEHO CCN(C(=O)NCc1ccccc1C[N@@H+](C)C(C)C)[C@@H]1CCN(C)C1 ZINC000663583708 482308737 /nfs/dbraw/zinc/30/87/37/482308737.db2.gz YLIVRLFFYOOMJR-LJQANCHMSA-N 1 3 346.519 2.762 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000666427127 482326545 /nfs/dbraw/zinc/32/65/45/482326545.db2.gz NUAAUVLPTOJCOP-AZUAARDMSA-N 1 3 343.515 2.857 10 0 EFAEHO CCN(C(=O)NCCCC[N@@H+]1CCCC[C@H]1C)[C@@H]1CCN(CC)C1 ZINC000663653719 482331277 /nfs/dbraw/zinc/33/12/77/482331277.db2.gz CCSXOPIWNKNVMS-QZTJIDSGSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN(C(=O)NCCCC[N@H+]1CCCC[C@H]1C)[C@@H]1CCN(CC)C1 ZINC000663653719 482331280 /nfs/dbraw/zinc/33/12/80/482331280.db2.gz CCSXOPIWNKNVMS-QZTJIDSGSA-N 1 3 338.540 2.767 10 0 EFAEHO C[C@@]1(C2CC2)CN(CCCC[N@@H+]2CCO[C@](C)(C3CC3)C2)CCO1 ZINC000661167220 482352385 /nfs/dbraw/zinc/35/23/85/482352385.db2.gz FURVJHVOQYQXNO-PMACEKPBSA-N 1 3 336.520 2.768 10 0 EFAEHO C[C@@]1(C2CC2)CN(CCCC[N@H+]2CCO[C@](C)(C3CC3)C2)CCO1 ZINC000661167220 482352388 /nfs/dbraw/zinc/35/23/88/482352388.db2.gz FURVJHVOQYQXNO-PMACEKPBSA-N 1 3 336.520 2.768 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NCc1cc2ccccc2o1 ZINC000663719660 482361756 /nfs/dbraw/zinc/36/17/56/482361756.db2.gz KYXODLZBODYHPH-HNNXBMFYSA-N 1 3 346.475 2.504 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NCc1cc2ccccc2o1 ZINC000663719660 482361759 /nfs/dbraw/zinc/36/17/59/482361759.db2.gz KYXODLZBODYHPH-HNNXBMFYSA-N 1 3 346.475 2.504 10 0 EFAEHO C[C@@H](Cc1ccccc1)CN1CCN(C[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000132321155 534247611 /nfs/dbraw/zinc/24/76/11/534247611.db2.gz WDARIUOJXXDCFN-FPOVZHCZSA-N 1 3 329.532 2.967 10 0 EFAEHO C[C@@H](Cc1ccccc1)CN1CCN(C[C@@H]2CCCC[N@H+]2C)CC1 ZINC000132321155 534247613 /nfs/dbraw/zinc/24/76/13/534247613.db2.gz WDARIUOJXXDCFN-FPOVZHCZSA-N 1 3 329.532 2.967 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+]2CCCC[C@H]2c2cccn2C)CC1 ZINC000192751354 519681474 /nfs/dbraw/zinc/68/14/74/519681474.db2.gz IGJNTLJIRZOYDG-FQEVSTJZSA-N 1 3 332.536 2.968 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+]2CCCC[C@H]2c2cccn2C)CC1 ZINC000192751354 519681477 /nfs/dbraw/zinc/68/14/77/519681477.db2.gz IGJNTLJIRZOYDG-FQEVSTJZSA-N 1 3 332.536 2.968 10 0 EFAEHO CC(C)C[C@@H](C[NH+](C)C)NC(=O)N[C@H](CN(C)C)c1ccccc1 ZINC000121442105 519775460 /nfs/dbraw/zinc/77/54/60/519775460.db2.gz GMUZJZBQVYZGKB-ZWKOTPCHSA-N 1 3 334.508 2.565 10 0 EFAEHO CCN1CCN([C@@H](C)C[NH2+][C@@H]2CCCOc3ccc(C)cc32)CC1 ZINC000155657416 521691355 /nfs/dbraw/zinc/69/13/55/521691355.db2.gz FBEKFSLCRIROOK-PKOBYXMFSA-N 1 3 331.504 2.824 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@H](C)c1ccc(OC)c(Br)c1 ZINC000234750675 522289081 /nfs/dbraw/zinc/28/90/81/522289081.db2.gz YDXNYUOEPCAKEQ-DGCLKSJQSA-N 1 3 345.281 2.862 10 0 EFAEHO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N2CC[C@@H](N3CC=CC3)C2)C1 ZINC000245655159 523245975 /nfs/dbraw/zinc/24/59/75/523245975.db2.gz CLKBQKJDVOFOOX-QZTJIDSGSA-N 1 3 348.535 2.543 10 0 EFAEHO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CC[C@@H](N3CC=CC3)C2)C1 ZINC000245655159 523245986 /nfs/dbraw/zinc/24/59/86/523245986.db2.gz CLKBQKJDVOFOOX-QZTJIDSGSA-N 1 3 348.535 2.543 10 0 EFAEHO Cc1cccc(NC(=O)[C@@H]2CCC[N@H+](CCCN3CCCC3)C2)n1 ZINC000193474194 524648444 /nfs/dbraw/zinc/64/84/44/524648444.db2.gz JCEIZQGSACKUSG-QGZVFWFLSA-N 1 3 330.476 2.526 10 0 EFAEHO Cc1cccc(NC(=O)[C@@H]2CCC[N@@H+](CCCN3CCCC3)C2)n1 ZINC000193474194 524648450 /nfs/dbraw/zinc/64/84/50/524648450.db2.gz JCEIZQGSACKUSG-QGZVFWFLSA-N 1 3 330.476 2.526 10 0 EFAEHO CSC[C@@H](CCO)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180146646 525639856 /nfs/dbraw/zinc/63/98/56/525639856.db2.gz MHHBTBXORAUYAA-MVCQKVDPSA-N 1 3 334.529 2.886 10 0 EFAEHO CSC[C@@H](CCO)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180146646 525639859 /nfs/dbraw/zinc/63/98/59/525639859.db2.gz MHHBTBXORAUYAA-MVCQKVDPSA-N 1 3 334.529 2.886 10 0 EFAEHO O=C1C[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)CN1C1CC1 ZINC000245742365 527021868 /nfs/dbraw/zinc/02/18/68/527021868.db2.gz RUYIXCKJMQWNOD-LFGUQSLTSA-N 1 3 339.483 2.535 10 0 EFAEHO OCCCSCCN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245694686 527542761 /nfs/dbraw/zinc/54/27/61/527542761.db2.gz KVFSVALOTWDSPT-REPLKXPHSA-N 1 3 334.529 2.887 10 0 EFAEHO OCCCSCCN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245694686 527542766 /nfs/dbraw/zinc/54/27/66/527542766.db2.gz KVFSVALOTWDSPT-REPLKXPHSA-N 1 3 334.529 2.887 10 0 EFAEHO Cc1nn(C)c(C)c1CC[NH2+][C@H](C)c1ccc(OCCN(C)C)cc1 ZINC000177743664 527625863 /nfs/dbraw/zinc/62/58/63/527625863.db2.gz MHSTZRMWXYOLQS-OAHLLOKOSA-N 1 3 344.503 2.871 10 0 EFAEHO Cc1nn(C)c(C)c1CC[NH2+][C@@H](C)c1ccc(OCCN(C)C)cc1 ZINC000177743654 527626037 /nfs/dbraw/zinc/62/60/37/527626037.db2.gz MHSTZRMWXYOLQS-HNNXBMFYSA-N 1 3 344.503 2.871 10 0 EFAEHO CCC[C@H](C(=O)NCC1CC[NH+](Cc2ccccc2)CC1)N(C)C ZINC000179621796 527978043 /nfs/dbraw/zinc/97/80/43/527978043.db2.gz RPJRGOWVOXTLBS-LJQANCHMSA-N 1 3 331.504 2.745 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)Nc2cccc(CN(C)C)c2)CC1 ZINC000174867564 528964782 /nfs/dbraw/zinc/96/47/82/528964782.db2.gz JXZYVKRPSJFAJM-UHFFFAOYSA-N 1 3 332.492 2.992 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC(C)(C)C(=O)OC)CC1 ZINC000359225116 534936503 /nfs/dbraw/zinc/93/65/03/534936503.db2.gz MIVIETGHKICSMC-UHFFFAOYSA-N 1 3 347.503 2.507 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC2CCOCC2)CC1 ZINC000344124297 534936850 /nfs/dbraw/zinc/93/68/50/534936850.db2.gz XRNQOUFTOSZGSM-UHFFFAOYSA-N 1 3 331.504 2.735 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC2(CO)CCCC2)CC1 ZINC000349827884 534937033 /nfs/dbraw/zinc/93/70/33/534937033.db2.gz KVDJVUKHHZBGIB-UHFFFAOYSA-N 1 3 345.531 2.861 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)C[C@H](c2ccccc2)N(C)C)CC1 ZINC000433382106 535447007 /nfs/dbraw/zinc/44/70/07/535447007.db2.gz MXKHHOXWGPPJRK-LJQANCHMSA-N 1 3 331.504 2.918 10 0 EFAEHO CCC[C@H](N)C(=O)N(C)[C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000246183177 535674568 /nfs/dbraw/zinc/67/45/68/535674568.db2.gz CIJXXOMZUFTTKH-OGWHTMIXSA-N 1 3 331.504 2.729 10 0 EFAEHO CCC[C@H](N)C(=O)N(C)[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000246183177 535674572 /nfs/dbraw/zinc/67/45/72/535674572.db2.gz CIJXXOMZUFTTKH-OGWHTMIXSA-N 1 3 331.504 2.729 10 0 EFAEHO CCN(C(=O)N[C@H](C)[C@H](C)[NH3+])[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418729248 535680946 /nfs/dbraw/zinc/68/09/46/535680946.db2.gz QUYCXESRKHJLNH-UIBIWLFHSA-N 1 3 332.492 2.589 10 0 EFAEHO CN(C)CCNC(=O)c1ccc(C[NH2+][C@@H]2CC[C@@H]2C2CCC2)cc1 ZINC000337986104 535889537 /nfs/dbraw/zinc/88/95/37/535889537.db2.gz HLFVWSVJNVMBEZ-RTBURBONSA-N 1 3 329.488 2.646 10 0 EFAEHO CC[C@@H]1C[C@H](CN2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)CCO1 ZINC000356998344 535898365 /nfs/dbraw/zinc/89/83/65/535898365.db2.gz UBWLVGBXAHKKFV-IYWMVGAKSA-N 1 3 337.552 2.682 10 0 EFAEHO CC[C@@H]1C[C@H](CN2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)CCO1 ZINC000356998344 535898368 /nfs/dbraw/zinc/89/83/68/535898368.db2.gz UBWLVGBXAHKKFV-IYWMVGAKSA-N 1 3 337.552 2.682 10 0 EFAEHO CC(C)C[C@H](C[NH3+])CC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000310547844 545809085 /nfs/dbraw/zinc/80/90/85/545809085.db2.gz VNCOHUJPWRQSLC-RBUKOAKNSA-N 1 3 331.504 2.730 10 0 EFAEHO C[C@]1(CNC(=O)N[C@H]2CCC[C@H]([NH3+])C2)CCCN1Cc1ccccc1 ZINC000418046779 546213017 /nfs/dbraw/zinc/21/30/17/546213017.db2.gz RBWCFLIUZXSFGU-CMKODMSKSA-N 1 3 344.503 2.610 10 0 EFAEHO O=C(NCc1ccccc1CN1CCCCC1)[C@H]1C[C@@]12CCC[NH2+]C2 ZINC000655442918 546449550 /nfs/dbraw/zinc/44/95/50/546449550.db2.gz GMBPOWKOOAMRRY-TZIWHRDSSA-N 1 3 341.499 2.678 10 0 EFAEHO CN(C)Cc1cc(C[NH2+]C2CCN(C[C@@H]3CCCO3)CC2)ccc1F ZINC000655716140 546546674 /nfs/dbraw/zinc/54/66/74/546546674.db2.gz QJBFWBQDYGRYLR-IBGZPJMESA-N 1 3 349.494 2.620 10 0 EFAEHO CN(C)Cc1cc(CNC2CC[NH+](C[C@@H]3CCCO3)CC2)ccc1F ZINC000655716140 546546678 /nfs/dbraw/zinc/54/66/78/546546678.db2.gz QJBFWBQDYGRYLR-IBGZPJMESA-N 1 3 349.494 2.620 10 0 EFAEHO C[C@@H](NC[C@H]1C[C@@H]([NH+](C)C)C1)c1ncc(Br)cc1F ZINC000655804839 546591654 /nfs/dbraw/zinc/59/16/54/546591654.db2.gz CZEDULGUBDAXFZ-FOGDFJRCSA-N 1 3 330.245 2.974 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](CNCc2csc(-c3ccc4c(c3)OCO4)n2)C1 ZINC000655826550 546601533 /nfs/dbraw/zinc/60/15/33/546601533.db2.gz IJCVEXSIAQBSJQ-JNSHFYNHSA-N 1 3 345.468 2.969 10 0 EFAEHO CCS(=O)(=O)c1c(Cl)cccc1CNC[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655826541 546601579 /nfs/dbraw/zinc/60/15/79/546601579.db2.gz IBOKSDCKIDTPSQ-XBXGTLAGSA-N 1 3 344.908 2.563 10 0 EFAEHO [NH3+][C@@H](Cc1cn([C@@H]2CCN(Cc3ccccc3)C2)nn1)c1ccccc1 ZINC000656455946 546806716 /nfs/dbraw/zinc/80/67/16/546806716.db2.gz PXWMLNNCYSXUEK-RTWAWAEBSA-N 1 3 347.466 2.968 10 0 EFAEHO C[N@H+](CCCNCc1ccnn1-c1ccncc1)Cc1ccccc1 ZINC000657296382 547093054 /nfs/dbraw/zinc/09/30/54/547093054.db2.gz TXTBUNWBIPJYTL-UHFFFAOYSA-N 1 3 335.455 2.879 10 0 EFAEHO C[N@@H+](CCCNCc1ccnn1-c1ccncc1)Cc1ccccc1 ZINC000657296382 547093058 /nfs/dbraw/zinc/09/30/58/547093058.db2.gz TXTBUNWBIPJYTL-UHFFFAOYSA-N 1 3 335.455 2.879 10 0 EFAEHO CN(CCC[NH2+]Cc1ccnn1-c1ccncc1)Cc1ccccc1 ZINC000657296382 547093062 /nfs/dbraw/zinc/09/30/62/547093062.db2.gz TXTBUNWBIPJYTL-UHFFFAOYSA-N 1 3 335.455 2.879 10 0 EFAEHO CC(C)(C)n1cc(CNCC2CC[NH+](C3CCOCC3)CC2)cn1 ZINC000657535394 547195412 /nfs/dbraw/zinc/19/54/12/547195412.db2.gz NBXFDXGZZVZQEZ-UHFFFAOYSA-N 1 3 334.508 2.619 10 0 EFAEHO CC(C)(C)c1n[nH]cc1CNCC1CC[NH+](C2CCOCC2)CC1 ZINC000657535617 547195863 /nfs/dbraw/zinc/19/58/63/547195863.db2.gz QBQZYUXTJXIRBW-UHFFFAOYSA-N 1 3 334.508 2.688 10 0 EFAEHO COc1cc(C)ccc1CNCC1CC[NH+](C2CCOCC2)CC1 ZINC000657537498 547196391 /nfs/dbraw/zinc/19/63/91/547196391.db2.gz MYRRSVZHOJLPOU-UHFFFAOYSA-N 1 3 332.488 2.984 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1cc(Br)cs1 ZINC000657574561 547211969 /nfs/dbraw/zinc/21/19/69/547211969.db2.gz ZSYNPVTUMDZAKC-LBPRGKRZSA-N 1 3 348.354 2.872 10 0 EFAEHO CN(C)c1ccccc1CNCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000657593456 547220271 /nfs/dbraw/zinc/22/02/71/547220271.db2.gz AAGMMTMAMZMHGY-FQEVSTJZSA-N 1 3 339.483 2.609 10 0 EFAEHO CN(C)c1ccccc1CNCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1 ZINC000657593456 547220275 /nfs/dbraw/zinc/22/02/75/547220275.db2.gz AAGMMTMAMZMHGY-FQEVSTJZSA-N 1 3 339.483 2.609 10 0 EFAEHO COc1ccc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000657593044 547220842 /nfs/dbraw/zinc/22/08/42/547220842.db2.gz CKPDIKOLVFSYCQ-LJQANCHMSA-N 1 3 326.440 2.552 10 0 EFAEHO COc1ccc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000657593044 547220844 /nfs/dbraw/zinc/22/08/44/547220844.db2.gz CKPDIKOLVFSYCQ-LJQANCHMSA-N 1 3 326.440 2.552 10 0 EFAEHO CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)CCO1 ZINC000657595658 547221851 /nfs/dbraw/zinc/22/18/51/547221851.db2.gz JEHATMUXUIMJNQ-UFYCRDLUSA-N 1 3 332.488 2.546 10 0 EFAEHO CCOc1cccc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000657594229 547222715 /nfs/dbraw/zinc/22/27/15/547222715.db2.gz HAXWRZPUTNHWMI-HXUWFJFHSA-N 1 3 340.467 2.942 10 0 EFAEHO CCOc1cccc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000657594229 547222723 /nfs/dbraw/zinc/22/27/23/547222723.db2.gz HAXWRZPUTNHWMI-HXUWFJFHSA-N 1 3 340.467 2.942 10 0 EFAEHO COc1cc(C)nc(C[NH2+]CC2CCN(Cc3ccncc3)CC2)c1 ZINC000657613865 547229449 /nfs/dbraw/zinc/22/94/49/547229449.db2.gz UZEFRPZSFVECAX-UHFFFAOYSA-N 1 3 340.471 2.795 10 0 EFAEHO C[C@@H]([NH2+]Cc1cccc(C(=O)NCCN(C)C)c1)C(C)(C)C(F)F ZINC000657868994 547306264 /nfs/dbraw/zinc/30/62/64/547306264.db2.gz SSRBPHYEUZAXLE-CYBMUJFWSA-N 1 3 341.446 2.747 10 0 EFAEHO COC[C@H](CC1CCOCC1)[NH2+]C[C@@H]1CCCN(CC(C)C)C1 ZINC000657932980 547319096 /nfs/dbraw/zinc/31/90/96/547319096.db2.gz YAMIHMADSYLSRC-OALUTQOASA-N 1 3 326.525 2.776 10 0 EFAEHO COC[C@H](CC1CCOCC1)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000657932980 547319099 /nfs/dbraw/zinc/31/90/99/547319099.db2.gz YAMIHMADSYLSRC-OALUTQOASA-N 1 3 326.525 2.776 10 0 EFAEHO COC[C@H](CC1CCOCC1)NC[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000657932980 547319100 /nfs/dbraw/zinc/31/91/00/547319100.db2.gz YAMIHMADSYLSRC-OALUTQOASA-N 1 3 326.525 2.776 10 0 EFAEHO CO[C@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CCOC1 ZINC000658077851 547349571 /nfs/dbraw/zinc/34/95/71/547349571.db2.gz RLSSZHJWJWTWMC-YMQHIKHWSA-N 1 3 344.499 2.823 10 0 EFAEHO CO[C@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1CCOC1 ZINC000658077851 547349577 /nfs/dbraw/zinc/34/95/77/547349577.db2.gz RLSSZHJWJWTWMC-YMQHIKHWSA-N 1 3 344.499 2.823 10 0 EFAEHO CO[C@@H](CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CCOC1 ZINC000658077844 547349897 /nfs/dbraw/zinc/34/98/97/547349897.db2.gz RLSSZHJWJWTWMC-QNXAMLQOSA-N 1 3 344.499 2.823 10 0 EFAEHO CO[C@@H](CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@H]1CCOC1 ZINC000658077844 547349902 /nfs/dbraw/zinc/34/99/02/547349902.db2.gz RLSSZHJWJWTWMC-QNXAMLQOSA-N 1 3 344.499 2.823 10 0 EFAEHO CO[C@H](CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CCOC1 ZINC000658077849 547350056 /nfs/dbraw/zinc/35/00/56/547350056.db2.gz RLSSZHJWJWTWMC-XICAJGIJSA-N 1 3 344.499 2.823 10 0 EFAEHO CO[C@H](CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@H]1CCOC1 ZINC000658077849 547350061 /nfs/dbraw/zinc/35/00/61/547350061.db2.gz RLSSZHJWJWTWMC-XICAJGIJSA-N 1 3 344.499 2.823 10 0 EFAEHO CC(=O)Nc1cccc([C@@H](C)N[C@@H](C)CN(C)CCC[NH+](C)C)c1 ZINC000658106317 547357666 /nfs/dbraw/zinc/35/76/66/547357666.db2.gz BGHXHNQBUPSOOB-JKSUJKDBSA-N 1 3 334.508 2.568 10 0 EFAEHO CCOC1CCC([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)CC1 ZINC000658135442 547367121 /nfs/dbraw/zinc/36/71/21/547367121.db2.gz DTJUXSWBWKAZFF-GPJFCIFZSA-N 1 3 332.488 2.691 10 0 EFAEHO Cc1cncc([C@H](C)NCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000658138797 547367686 /nfs/dbraw/zinc/36/76/86/547367686.db2.gz OFPTXTNOGWSNEQ-OXJNMPFZSA-N 1 3 325.456 2.807 10 0 EFAEHO Cc1cncc([C@H](C)NCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000658138797 547367692 /nfs/dbraw/zinc/36/76/92/547367692.db2.gz OFPTXTNOGWSNEQ-OXJNMPFZSA-N 1 3 325.456 2.807 10 0 EFAEHO C[C@@H](NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cccc(CO)c1 ZINC000658136390 547367977 /nfs/dbraw/zinc/36/79/77/547367977.db2.gz HAVNGOBURQDYMM-IIBYNOLFSA-N 1 3 340.467 2.596 10 0 EFAEHO C[C@@H](NCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1)c1cccc(CO)c1 ZINC000658136390 547367980 /nfs/dbraw/zinc/36/79/80/547367980.db2.gz HAVNGOBURQDYMM-IIBYNOLFSA-N 1 3 340.467 2.596 10 0 EFAEHO C[C@H]([NH2+]CCO[C@H]1CC1(F)F)c1ccc(OCCN(C)C)cc1 ZINC000658171495 547379536 /nfs/dbraw/zinc/37/95/36/547379536.db2.gz ZDGMYAQENMPLCZ-BBRMVZONSA-N 1 3 328.403 2.702 10 0 EFAEHO C[C@H](NCCO[C@H]1CC1(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000658171495 547379542 /nfs/dbraw/zinc/37/95/42/547379542.db2.gz ZDGMYAQENMPLCZ-BBRMVZONSA-N 1 3 328.403 2.702 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(N[C@H]2C[C@@H](O)C23CCC3)CC1 ZINC000658248948 547396748 /nfs/dbraw/zinc/39/67/48/547396748.db2.gz GXQYNEGUZNCOFZ-LSTHTHJFSA-N 1 3 328.500 2.975 10 0 EFAEHO Fc1ccc([C@H](NCC2CC[NH+](CC3CC3)CC2)c2c[nH]nn2)cc1 ZINC000658354021 547424362 /nfs/dbraw/zinc/42/43/62/547424362.db2.gz VOHXBNPVKJEQHB-IBGZPJMESA-N 1 3 343.450 2.745 10 0 EFAEHO C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)CCCC[NH+](C)C ZINC000673750719 547950623 /nfs/dbraw/zinc/95/06/23/547950623.db2.gz FBKZCKCTJTXULD-GOSISDBHSA-N 1 3 331.504 2.841 10 0 EFAEHO CN(C)CCOc1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CCOC3)C2)cc1 ZINC000678339565 548903214 /nfs/dbraw/zinc/90/32/14/548903214.db2.gz PFACNSCLIYFNOM-MOPGFXCFSA-N 1 3 332.488 2.876 10 0 EFAEHO CN(C)CCOc1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)cc1 ZINC000678339565 548903220 /nfs/dbraw/zinc/90/32/20/548903220.db2.gz PFACNSCLIYFNOM-MOPGFXCFSA-N 1 3 332.488 2.876 10 0 EFAEHO CN(C)CCOc1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CCOC3)C2)cc1 ZINC000678339568 548903367 /nfs/dbraw/zinc/90/33/67/548903367.db2.gz PFACNSCLIYFNOM-RBUKOAKNSA-N 1 3 332.488 2.876 10 0 EFAEHO CN(C)CCOc1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)cc1 ZINC000678339568 548903370 /nfs/dbraw/zinc/90/33/70/548903370.db2.gz PFACNSCLIYFNOM-RBUKOAKNSA-N 1 3 332.488 2.876 10 0 EFAEHO O=C(CN[C@@H](CC1CC1)c1ccccc1)NC1CC[NH+](C2CC2)CC1 ZINC000678776799 548986204 /nfs/dbraw/zinc/98/62/04/548986204.db2.gz JJMLFFZXHIGPPR-FQEVSTJZSA-N 1 3 341.499 2.860 10 0 EFAEHO c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](NCCOC[C@@H]2CCCO2)C3)cc1 ZINC000679394217 549118863 /nfs/dbraw/zinc/11/88/63/549118863.db2.gz IJMDPZDOEMZLSW-WOZUAGRISA-N 1 3 344.499 2.967 10 0 EFAEHO c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](NCCOC[C@@H]2CCCO2)C3)cc1 ZINC000679394217 549118868 /nfs/dbraw/zinc/11/88/68/549118868.db2.gz IJMDPZDOEMZLSW-WOZUAGRISA-N 1 3 344.499 2.967 10 0 EFAEHO Cc1nc2ccc(C[NH2+][C@H]3CCN(C4CCN(C)CC4)C3)cc2s1 ZINC000683145593 549856129 /nfs/dbraw/zinc/85/61/29/549856129.db2.gz QUQSMNUXHCVXDF-INIZCTEOSA-N 1 3 344.528 2.863 10 0 EFAEHO CO[C@H]1CCC[C@H]([NH2+]Cc2ccc(CN3CCC(O)CC3)cc2)C1 ZINC000684366957 550030756 /nfs/dbraw/zinc/03/07/56/550030756.db2.gz XOQGJEPNKXPPJZ-ICSRJNTNSA-N 1 3 332.488 2.691 10 0 EFAEHO c1ccc(CN2C[C@H]3C[C@@H](C2)C3[NH2+][C@@H]2CCN3CCCC[C@@H]23)cc1 ZINC000399640323 577329979 /nfs/dbraw/zinc/32/99/79/577329979.db2.gz GZHRONMUHXYXJS-DQKSBWHRSA-N 1 3 325.500 2.723 10 0 EFAEHO C[C@@H]1CN(Cc2cncc3ccccc32)CC[C@H]1[NH+]1CCN(C)CC1 ZINC000769524651 577369982 /nfs/dbraw/zinc/36/99/82/577369982.db2.gz GPCYSEDLRJBNLN-DYESRHJHSA-N 1 3 338.499 2.693 10 0 EFAEHO CN(C)C1(C(=O)N2CCCCC[C@@H]([NH2+]CCCCCF)C2)CCC1 ZINC001692121256 1248705131 /nfs/dbraw/zinc/70/51/31/1248705131.db2.gz QWLFVNJGFXHFAS-QGZVFWFLSA-N 1 3 341.515 2.971 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN1CC[C@@H](C)C1 ZINC001691370448 1248705636 /nfs/dbraw/zinc/70/56/36/1248705636.db2.gz QUCXJAWHEXJJQV-AXTJNSDUSA-N 1 3 335.536 2.901 10 0 EFAEHO CN(CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2=CCCCC2)C1)CC(C)(C)C ZINC001691463771 1249181273 /nfs/dbraw/zinc/18/12/73/1249181273.db2.gz TUVVCGLPGKLHBG-HDICACEKSA-N 1 3 335.536 2.949 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]CCCc2ccccc2C)C1)N(C)C ZINC001266725671 1248240337 /nfs/dbraw/zinc/24/03/37/1248240337.db2.gz PMNOCMRUQQGHAQ-OTWHNJEPSA-N 1 3 331.504 2.505 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]CCCc2cccc(C)c2)C1)N(C)C ZINC001266725831 1248240430 /nfs/dbraw/zinc/24/04/30/1248240430.db2.gz WASPIABSIOSKNK-CEXWTWQISA-N 1 3 331.504 2.505 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+]CCC2=CCCCC2)C1)N(C)C ZINC001691150401 1248477557 /nfs/dbraw/zinc/47/75/57/1248477557.db2.gz KUUXXEBLJGGFHP-FHWLQOOXSA-N 1 3 335.536 2.948 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@H+](CCC2=CCCCC2)C2CC2)CCC1 ZINC001691213023 1248539857 /nfs/dbraw/zinc/53/98/57/1248539857.db2.gz HKTIMOQYNUZXGJ-UHFFFAOYSA-N 1 3 333.520 2.942 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@@H+](CCC2=CCCCC2)C2CC2)CCC1 ZINC001691213023 1248539866 /nfs/dbraw/zinc/53/98/66/1248539866.db2.gz HKTIMOQYNUZXGJ-UHFFFAOYSA-N 1 3 333.520 2.942 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@H](O)c2cc(F)c(F)c(F)c2)[C@H]2CCC[C@@H]21 ZINC000850581395 1250546736 /nfs/dbraw/zinc/54/67/36/1250546736.db2.gz VVKYYLBTJDBOCA-MEYUZBJRSA-N 1 3 328.378 2.600 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@H](O)c2cc(F)c(F)c(F)c2)[C@H]2CCC[C@@H]21 ZINC000850581395 1250546739 /nfs/dbraw/zinc/54/67/39/1250546739.db2.gz VVKYYLBTJDBOCA-MEYUZBJRSA-N 1 3 328.378 2.600 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@H](O)c2cc(F)c(F)c(F)c2)[C@H]2CCC[C@@H]21 ZINC000850581395 1250546749 /nfs/dbraw/zinc/54/67/49/1250546749.db2.gz VVKYYLBTJDBOCA-MEYUZBJRSA-N 1 3 328.378 2.600 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@H](O)c2cc(F)c(F)c(F)c2)[C@@H]2CCC[C@@H]21 ZINC000850581393 1250547066 /nfs/dbraw/zinc/54/70/66/1250547066.db2.gz VVKYYLBTJDBOCA-DDWPSWQVSA-N 1 3 328.378 2.600 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@H](O)c2cc(F)c(F)c(F)c2)[C@@H]2CCC[C@@H]21 ZINC000850581393 1250547072 /nfs/dbraw/zinc/54/70/72/1250547072.db2.gz VVKYYLBTJDBOCA-DDWPSWQVSA-N 1 3 328.378 2.600 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@H](O)c2cc(F)c(F)c(F)c2)[C@@H]2CCC[C@@H]21 ZINC000850581393 1250547081 /nfs/dbraw/zinc/54/70/81/1250547081.db2.gz VVKYYLBTJDBOCA-DDWPSWQVSA-N 1 3 328.378 2.600 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]CCCc1cccc(C)c1 ZINC001691622918 1251839911 /nfs/dbraw/zinc/83/99/11/1251839911.db2.gz DQESDMLDOROPJA-HXUWFJFHSA-N 1 3 345.531 2.850 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N1CC[C@](C)(NC(=O)CC[NH+](C)C)C1 ZINC001484058431 1252121000 /nfs/dbraw/zinc/12/10/00/1252121000.db2.gz RNOVTUSCSWXSLH-MJGOQNOKSA-N 1 3 335.467 2.809 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@](C)(C[NH2+]CCC2CCCC2)C1)N(C)C ZINC001484103544 1252257265 /nfs/dbraw/zinc/25/72/65/1252257265.db2.gz WJJKAMUXXMYBIS-ICSRJNTNSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([C@@H](C)[NH2+]CC2CC3(CCC3)C2)C1 ZINC001484358592 1252443541 /nfs/dbraw/zinc/44/35/41/1252443541.db2.gz OEIZCBPOLLUXEJ-AEFFLSMTSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([C@H](C)[NH2+]CCCC(C)(C)C)C1 ZINC001484356278 1252448947 /nfs/dbraw/zinc/44/89/47/1252448947.db2.gz BSIRASLSUGQORW-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001484357966 1252451359 /nfs/dbraw/zinc/45/13/59/1252451359.db2.gz KHGJILVUBOOGGU-UYAOXDASSA-N 1 3 345.531 2.704 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CC[C@H](C[NH2+]CCF)CC1)N1CCCCCC1 ZINC001484396597 1252520293 /nfs/dbraw/zinc/52/02/93/1252520293.db2.gz HYVGYJKPEOILCL-KZNAEPCWSA-N 1 3 341.515 2.733 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2ccsc2)CC1 ZINC001484460511 1252650274 /nfs/dbraw/zinc/65/02/74/1252650274.db2.gz BYZFHOYPERLIDA-SJORKVTESA-N 1 3 347.528 2.655 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)CCCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001484758297 1252928453 /nfs/dbraw/zinc/92/84/53/1252928453.db2.gz BKTNKXCMZGFXNA-QAPCUYQASA-N 1 3 347.494 2.727 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)CCCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001484758297 1252928460 /nfs/dbraw/zinc/92/84/60/1252928460.db2.gz BKTNKXCMZGFXNA-QAPCUYQASA-N 1 3 347.494 2.727 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001484768172 1252972559 /nfs/dbraw/zinc/97/25/59/1252972559.db2.gz HLNGDTNDJKLSLD-UHFFFAOYSA-N 1 3 331.504 2.680 10 0 EFAEHO Cc1cccc(C)c1C[N@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001484768172 1252972574 /nfs/dbraw/zinc/97/25/74/1252972574.db2.gz HLNGDTNDJKLSLD-UHFFFAOYSA-N 1 3 331.504 2.680 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001484768556 1252976431 /nfs/dbraw/zinc/97/64/31/1252976431.db2.gz BDTOYEWNWLPFLL-LJQANCHMSA-N 1 3 331.504 2.794 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001484768556 1252976443 /nfs/dbraw/zinc/97/64/43/1252976443.db2.gz BDTOYEWNWLPFLL-LJQANCHMSA-N 1 3 331.504 2.794 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001273018514 1265825976 /nfs/dbraw/zinc/82/59/76/1265825976.db2.gz KXNQPUVHLACRKZ-AAEUAGOBSA-N 1 3 331.913 2.726 10 0 EFAEHO CCCCC[NH2+][C@H]1CN(C(=O)Cc2c[nH]cn2)CC[C@H]1C(F)(F)F ZINC001279170558 1258064587 /nfs/dbraw/zinc/06/45/87/1258064587.db2.gz DEZFMFUHWBOPMI-KGLIPLIRSA-N 1 3 346.397 2.511 10 0 EFAEHO c1ccc(CN2CCCC[C@H](C[NH2+][C@H]3CCO[C@]34CCOC4)C2)cc1 ZINC000903173324 1259895645 /nfs/dbraw/zinc/89/56/45/1259895645.db2.gz YUUAAUBUFRCBSG-HKBOAZHASA-N 1 3 344.499 2.826 10 0 EFAEHO C[C@H](CC[NH2+]CC1CCC2(CC2)CC1)NC(=O)C1(N(C)C)CCC1 ZINC001272831013 1261107182 /nfs/dbraw/zinc/10/71/82/1261107182.db2.gz RSVTYPDQHPYZMI-MRXNPFEDSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[N@H+](C[C@@H](CN)Cc1cnn(C)c1C)[C@H](C)Cc1ccsc1 ZINC000903916485 1261542994 /nfs/dbraw/zinc/54/29/94/1261542994.db2.gz SOZKGXVUHPNJKO-RHSMWYFYSA-N 1 3 334.533 2.861 10 0 EFAEHO CC[N@@H+](C[C@@H](CN)Cc1cnn(C)c1C)[C@H](C)Cc1ccsc1 ZINC000903916485 1261542999 /nfs/dbraw/zinc/54/29/99/1261542999.db2.gz SOZKGXVUHPNJKO-RHSMWYFYSA-N 1 3 334.533 2.861 10 0 EFAEHO Fc1ccc([C@H](CC(F)(F)F)NC[C@H]2CC3(C[NH2+]C3)CO2)cc1 ZINC000923377460 1261577614 /nfs/dbraw/zinc/57/76/14/1261577614.db2.gz UQSHIYIGQJVUBA-KGLIPLIRSA-N 1 3 332.341 2.787 10 0 EFAEHO Fc1ccc([C@H](CC(F)(F)F)NC[C@@H]2CC3(C[NH2+]C3)CO2)cc1 ZINC000923377459 1261577663 /nfs/dbraw/zinc/57/76/63/1261577663.db2.gz UQSHIYIGQJVUBA-KBPBESRZSA-N 1 3 332.341 2.787 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)cnn1C ZINC000903954330 1261598068 /nfs/dbraw/zinc/59/80/68/1261598068.db2.gz QRQOZJPFPMUFLE-BPUTZDHNSA-N 1 3 344.425 2.510 10 0 EFAEHO CC1(C)[C@H]([NH3+])C[C@H]1NC[C@@H]1Cc2ccccc2O[C@H]1C(F)(F)F ZINC000923423814 1261631994 /nfs/dbraw/zinc/63/19/94/1261631994.db2.gz ZORHPCUMFBYNIU-ZGKBOVNRSA-N 1 3 328.378 2.884 10 0 EFAEHO C[C@]12C[NH2+]C[C@H]1CN(C[C@H](O)Cn1c3ccccc3c3ccccc31)C2 ZINC000923425127 1261633490 /nfs/dbraw/zinc/63/34/90/1261633490.db2.gz IDZUMUYABGGIJK-PNLZDCPESA-N 1 3 349.478 2.697 10 0 EFAEHO CC[C@H](C(=O)Nc1ccc(C)cc1)N1CCC2(CO[C@@H](C[NH3+])C2)CC1 ZINC000923446308 1261666129 /nfs/dbraw/zinc/66/61/29/1261666129.db2.gz MTSSUYIQWKLDQL-QZTJIDSGSA-N 1 3 345.487 2.542 10 0 EFAEHO [NH3+]C[C@@H]1CC2(CO1)CCN(Cc1c(Cl)cncc1Cl)CC2 ZINC000923447030 1261667153 /nfs/dbraw/zinc/66/71/53/1261667153.db2.gz PARRUPYZXLVHBV-NSHDSACASA-N 1 3 330.259 2.718 10 0 EFAEHO [NH3+]C[C@@H]1CC2(CO1)CCN(Cc1cc(Cl)nc(Cl)c1)CC2 ZINC000923448935 1261670087 /nfs/dbraw/zinc/67/00/87/1261670087.db2.gz IMUVXDGPDKUBCP-LBPRGKRZSA-N 1 3 330.259 2.718 10 0 EFAEHO Cc1cc(CN2CCC3(CO[C@H](C[NH3+])C3)CC2)c2ccccc2n1 ZINC000923449770 1261686335 /nfs/dbraw/zinc/68/63/35/1261686335.db2.gz BYNPUFFXEBYEKU-KRWDZBQOSA-N 1 3 325.456 2.873 10 0 EFAEHO Cc1cc(F)ccc1N1CCC[C@H](N2CC[C@H](C[NH3+])[C@H](C)C2)C1=O ZINC000923496397 1261764759 /nfs/dbraw/zinc/76/47/59/1261764759.db2.gz HRRCPVQWRCQKDZ-RKVPGOIHSA-N 1 3 333.451 2.546 10 0 EFAEHO Cc1cc(C)c(N2CC[C@H](N3CC[C@@H](C[NH3+])[C@@H](C)C3)C2=O)c(C)c1 ZINC000923494970 1261780244 /nfs/dbraw/zinc/78/02/44/1261780244.db2.gz RGKCXOJXIYUKML-BZSNNMDCSA-N 1 3 329.488 2.634 10 0 EFAEHO CC(C)C[C@H](NC(=O)CN1CC[C@@H](C[NH3+])[C@@H](C)C1)c1ccccc1 ZINC000923502101 1261781509 /nfs/dbraw/zinc/78/15/09/1261781509.db2.gz YABRXRWYBOHKGU-WDSOQIARSA-N 1 3 331.504 2.807 10 0 EFAEHO CCCN(Cc1ccc(C)cc1)C(=O)CN1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923497808 1261788943 /nfs/dbraw/zinc/78/89/43/1261788943.db2.gz DZFWPOGXBNXPQP-IEBWSBKVSA-N 1 3 331.504 2.650 10 0 EFAEHO CCc1ccc([C@H](C)NC(=O)[C@H](C)N2CC[C@@H](C[NH3+])[C@H](C)C2)cc1 ZINC000923498158 1261790235 /nfs/dbraw/zinc/79/02/35/1261790235.db2.gz JRKVEOWURVRWGI-DRMAHVMPSA-N 1 3 331.504 2.731 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H](C2CC2)N(C)C(=O)CN(C)C(C)C)c1 ZINC001485839538 1262072874 /nfs/dbraw/zinc/07/28/74/1262072874.db2.gz ZLYCLHSONZZBNS-HXUWFJFHSA-N 1 3 345.531 2.970 10 0 EFAEHO C[C@H](CN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]CC1CCC(F)(F)CC1 ZINC001485922304 1262502583 /nfs/dbraw/zinc/50/25/83/1262502583.db2.gz IWIOBBFUXYSOOO-LSDHHAIUSA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@H](CN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cc2ccccc2o1 ZINC001485922668 1262502671 /nfs/dbraw/zinc/50/26/71/1262502671.db2.gz PGQUYWZPJAJQNE-JKSUJKDBSA-N 1 3 343.471 2.711 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)cc1 ZINC001486094897 1262617926 /nfs/dbraw/zinc/61/79/26/1262617926.db2.gz DRTDLNJECXJUJC-UYAOXDASSA-N 1 3 345.531 2.847 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CC2CC(C)(C)C2)CN1C(=O)CN(C)CC(C)(C)C ZINC001486124353 1262660556 /nfs/dbraw/zinc/66/05/56/1262660556.db2.gz OKYZVZIRQQMBJL-WBVHZDCISA-N 1 3 337.552 2.980 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1C[C@@H](NCc2cc(C)ccc2F)C[C@H]1C ZINC001486132482 1262665038 /nfs/dbraw/zinc/66/50/38/1262665038.db2.gz ULBKAIVDOOGKDH-WBVHZDCISA-N 1 3 335.467 2.555 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1C[C@@H](NCc2cc(C)ccc2F)C[C@H]1C ZINC001486132482 1262665042 /nfs/dbraw/zinc/66/50/42/1262665042.db2.gz ULBKAIVDOOGKDH-WBVHZDCISA-N 1 3 335.467 2.555 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]CCCc2cccc(F)c2)C[C@@H]1C ZINC001486139150 1262675978 /nfs/dbraw/zinc/67/59/78/1262675978.db2.gz ZMOHKJXOYRQMSP-QFBILLFUSA-N 1 3 349.494 2.678 10 0 EFAEHO Cc1ccc(F)c(CN2CC[C@]3(NC(=O)CC[NH+](C)C)CCC[C@H]23)c1 ZINC001486148840 1262698776 /nfs/dbraw/zinc/69/87/76/1262698776.db2.gz VCRCZSRXJSUREU-AZUAARDMSA-N 1 3 347.478 2.699 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N1CC[C@]2(NC(=O)CC[NH+](C)C)CCC[C@H]12 ZINC001486151947 1262707064 /nfs/dbraw/zinc/70/70/64/1262707064.db2.gz YWLCWYCFWCFYRB-MOXGXCLJSA-N 1 3 347.478 2.952 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CC[C@H](C[NH2+]C/C=C\Cl)C1)N1CCCCC1 ZINC001486200929 1262784772 /nfs/dbraw/zinc/78/47/72/1262784772.db2.gz PEQKFYKJBCNOIE-HPRJGHKQSA-N 1 3 341.927 2.878 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@H](NC(=O)C(C)(C)N1CCCC1)C(C)(C)C ZINC001486407630 1263024258 /nfs/dbraw/zinc/02/42/58/1263024258.db2.gz SWILRUVTFNHZOM-LSDHHAIUSA-N 1 3 329.504 2.729 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001486449907 1263143461 /nfs/dbraw/zinc/14/34/61/1263143461.db2.gz UIRWPLIZFKRUPK-INIZCTEOSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC001486450908 1263144579 /nfs/dbraw/zinc/14/45/79/1263144579.db2.gz ISUMSAHXKUMNLN-KRWDZBQOSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1ccc(F)c(CNC2CC(N(C)C(=O)CCCC[NH+](C)C)C2)c1 ZINC001486481267 1263217969 /nfs/dbraw/zinc/21/79/69/1263217969.db2.gz HUJBWFIXGLXUED-UHFFFAOYSA-N 1 3 349.494 2.945 10 0 EFAEHO CCCC[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C[C@H]2C1 ZINC001410190700 1264258074 /nfs/dbraw/zinc/25/80/74/1264258074.db2.gz QBSKPYKTJGORFW-OKZBNKHCSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCC[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C[C@H]2C1 ZINC001410190700 1264258082 /nfs/dbraw/zinc/25/80/82/1264258082.db2.gz QBSKPYKTJGORFW-OKZBNKHCSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001410232022 1264433030 /nfs/dbraw/zinc/43/30/30/1264433030.db2.gz XBDHKYJMXLJZLT-QWFCFKBJSA-N 1 3 345.531 2.874 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC(N(C)C/C=C/Cl)CC1)[NH+]1CCCC1 ZINC001410254719 1264544283 /nfs/dbraw/zinc/54/42/83/1264544283.db2.gz CGAZCRDTEYRKDD-NADMHLTPSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N(C)C[C@@H](C)NCc1ccccc1F ZINC001410407513 1265044982 /nfs/dbraw/zinc/04/49/82/1265044982.db2.gz MQHCAFAZCAQVDG-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N(C)C[C@@H](C)NCc1ccccc1F ZINC001410407513 1265044989 /nfs/dbraw/zinc/04/49/89/1265044989.db2.gz MQHCAFAZCAQVDG-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N(C)C[C@H](C)NCc1ccccc1F ZINC001410407516 1265045150 /nfs/dbraw/zinc/04/51/50/1265045150.db2.gz MQHCAFAZCAQVDG-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N(C)C[C@H](C)NCc1ccccc1F ZINC001410407516 1265045155 /nfs/dbraw/zinc/04/51/55/1265045155.db2.gz MQHCAFAZCAQVDG-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(F)cc1F)N(C)C ZINC001273002318 1265070153 /nfs/dbraw/zinc/07/01/53/1265070153.db2.gz UKYVBWAVLCHRAF-CXAGYDPISA-N 1 3 341.446 2.535 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)CN(C)C(=O)[C@@H]1CC[N@H+](C)C1 ZINC001410494587 1266914161 /nfs/dbraw/zinc/91/41/61/1266914161.db2.gz LXXNDMXXQAYQMB-LSDHHAIUSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)CN(C)C(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001410494587 1266914171 /nfs/dbraw/zinc/91/41/71/1266914171.db2.gz LXXNDMXXQAYQMB-LSDHHAIUSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)cc1F ZINC001410847824 1269795575 /nfs/dbraw/zinc/79/55/75/1269795575.db2.gz JXGUCYOGYCNZNV-DOTOQJQBSA-N 1 3 335.467 2.553 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CC3CC(C)(C)C3)[C@@H]2C1 ZINC001410916145 1270231156 /nfs/dbraw/zinc/23/11/56/1270231156.db2.gz MLYHUUMNOVFVON-OTWHNJEPSA-N 1 3 349.563 2.980 10 0 EFAEHO Cc1cc(F)ccc1CN1CC[C@@]2(NC(=O)CC[NH+](C)C)CCC[C@H]12 ZINC001410917560 1270235945 /nfs/dbraw/zinc/23/59/45/1270235945.db2.gz WSQAIXVFYHHPFR-ICSRJNTNSA-N 1 3 347.478 2.699 10 0 EFAEHO CC[NH2+][C@@H](CCNC(=O)[C@H]1CCCCN1C(C)C)Cc1ccccc1 ZINC001410924769 1270281022 /nfs/dbraw/zinc/28/10/22/1270281022.db2.gz FUAMLGWTXAULDT-VQTJNVASSA-N 1 3 345.531 2.976 10 0 EFAEHO CC(C)[C@H](C(=O)N1C[C@H]([NH2+]CCC(C)(C)C)C(C)(C)C1)N(C)C ZINC001410977607 1270524096 /nfs/dbraw/zinc/52/40/96/1270524096.db2.gz HPRJMCGVJUTUQX-JKSUJKDBSA-N 1 3 325.541 2.835 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@@H]([NH2+]C/C=C/c2ccccc2)C(C)(C)C1)N(C)C ZINC001410980650 1270533542 /nfs/dbraw/zinc/53/35/42/1270533542.db2.gz JOOUSBGHFVUOHC-HEBLUMGWSA-N 1 3 343.515 2.867 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CC2CCC(C)CC2)C(C)(C)C1 ZINC001411134707 1271402583 /nfs/dbraw/zinc/40/25/83/1271402583.db2.gz WVSLTIRZFBKIGD-DAWZGUTISA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)N(CC[N@H+](C)C[C@H]1CCC(F)(F)C1)C(C)C)N(C)C ZINC001411197229 1271884526 /nfs/dbraw/zinc/88/45/26/1271884526.db2.gz WYIJCSGUTBKTGH-JKSUJKDBSA-N 1 3 347.494 2.931 10 0 EFAEHO CC[C@H](C(=O)N(CC[N@@H+](C)C[C@H]1CCC(F)(F)C1)C(C)C)N(C)C ZINC001411197229 1271884536 /nfs/dbraw/zinc/88/45/36/1271884536.db2.gz WYIJCSGUTBKTGH-JKSUJKDBSA-N 1 3 347.494 2.931 10 0 EFAEHO CC(C)N(CC[N@H+](C)CC1CC2(CCC2)C1)C(=O)CN1CCCC1 ZINC001411200817 1271901965 /nfs/dbraw/zinc/90/19/65/1271901965.db2.gz CMYVJNQZMRLFPQ-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CC1CC2(CCC2)C1)C(=O)CN1CCCC1 ZINC001411200817 1271901974 /nfs/dbraw/zinc/90/19/74/1271901974.db2.gz CMYVJNQZMRLFPQ-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N(CC[N@H+](C)CC1CC(F)(F)C1)C(C)C ZINC001411200816 1271902631 /nfs/dbraw/zinc/90/26/31/1271902631.db2.gz CMLYALBQVHVWPZ-UHFFFAOYSA-N 1 3 333.467 2.541 10 0 EFAEHO CC(C)N(C)CC(=O)N(CC[N@@H+](C)CC1CC(F)(F)C1)C(C)C ZINC001411200816 1271902641 /nfs/dbraw/zinc/90/26/41/1271902641.db2.gz CMLYALBQVHVWPZ-UHFFFAOYSA-N 1 3 333.467 2.541 10 0 EFAEHO CC(C)[NH2+]C[C@@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)(C)C ZINC001411215494 1272023982 /nfs/dbraw/zinc/02/39/82/1272023982.db2.gz HBOXAFQSJQLPQL-RDTXWAMCSA-N 1 3 329.504 2.728 10 0 EFAEHO CC(C)[NH2+]C[C@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)(C)C ZINC001411215483 1272025373 /nfs/dbraw/zinc/02/53/73/1272025373.db2.gz HBOXAFQSJQLPQL-KBXCAEBGSA-N 1 3 329.504 2.728 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1CC[NH+](CCC(C)(C)C)CC1)N(C)C ZINC001411240079 1272106415 /nfs/dbraw/zinc/10/64/15/1272106415.db2.gz SVOMDXFIBVAPPV-DOTOQJQBSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[NH+]1CCC(C2(NC(=O)[C@]3(F)CCN(C(C)(C)C)C3)CC2)CC1 ZINC001411251621 1272140271 /nfs/dbraw/zinc/14/02/71/1272140271.db2.gz LIGZUZBIZWLYLU-SFHVURJKSA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]Cc2cccc(Cl)c2)C1 ZINC001411252090 1272143900 /nfs/dbraw/zinc/14/39/00/1272143900.db2.gz HFNVNJNESMVKAP-UHFFFAOYSA-N 1 3 337.895 2.759 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CC[NH2+]CCc1ccc(Cl)cc1 ZINC001273139952 1273056433 /nfs/dbraw/zinc/05/64/33/1273056433.db2.gz IQDCYCMJKDXISL-ZDUSSCGKSA-N 1 3 348.878 2.641 10 0 EFAEHO CC[N@H+](CCC1CCN(C[C@H]2CN(C3CC3)C(=O)O2)CC1)CC1CC1 ZINC000844314063 1278860130 /nfs/dbraw/zinc/86/01/30/1278860130.db2.gz BNPAEDMLNNOPJI-IBGZPJMESA-N 1 3 349.519 2.804 10 0 EFAEHO CC[N@@H+](CCC1CCN(C[C@H]2CN(C3CC3)C(=O)O2)CC1)CC1CC1 ZINC000844314063 1278860141 /nfs/dbraw/zinc/86/01/41/1278860141.db2.gz BNPAEDMLNNOPJI-IBGZPJMESA-N 1 3 349.519 2.804 10 0 EFAEHO O=C1O[C@@H](CN2CCC(C[NH+]3CCCCCC3)CC2)CN1C1CC1 ZINC000844283554 1278860901 /nfs/dbraw/zinc/86/09/01/1278860901.db2.gz ZRNVSOOFEPVMRW-SFHVURJKSA-N 1 3 335.492 2.558 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)C1(N(C)C)CCC1)Cc1ccsc1 ZINC001691733257 1275750572 /nfs/dbraw/zinc/75/05/72/1275750572.db2.gz VGLSVVBHYCJDKT-UHFFFAOYSA-N 1 3 337.533 2.949 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)C1(N(C)C)CCC1)Cc1ccsc1 ZINC001691733257 1275750579 /nfs/dbraw/zinc/75/05/79/1275750579.db2.gz VGLSVVBHYCJDKT-UHFFFAOYSA-N 1 3 337.533 2.949 10 0 EFAEHO CC[NH+](CC)Cc1ccccc1CNC[C@H](O)c1ccc(F)cn1 ZINC000818942501 1276553666 /nfs/dbraw/zinc/55/36/66/1276553666.db2.gz FFIRDDGEOMGMTH-IBGZPJMESA-N 1 3 331.435 2.886 10 0 EFAEHO O[C@H](CNCc1ccccc1C[NH+]1CCCC1)c1ccc(F)cn1 ZINC000818943137 1276555037 /nfs/dbraw/zinc/55/50/37/1276555037.db2.gz PUHKGPNKRXUJSS-LJQANCHMSA-N 1 3 329.419 2.640 10 0 EFAEHO Cc1cc(C)cc([C@@H](O)CNCC2([NH+]3CCCC3)CCOCC2)c1 ZINC000819020728 1276592823 /nfs/dbraw/zinc/59/28/23/1276592823.db2.gz KLVKRDKWWJHAJD-IBGZPJMESA-N 1 3 332.488 2.571 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@H]2CCCCc3ccccc3C2)CC1 ZINC000872022814 1287403668 /nfs/dbraw/zinc/40/36/68/1287403668.db2.gz LOUDPBWAUFXLPB-NRFANRHFSA-N 1 3 329.532 2.941 10 0 EFAEHO CC[C@@H]([NH2+]Cc1ccc(CN2CCN(C)CC2)cc1)[C@@H]1CCCOC1 ZINC000872023047 1287404009 /nfs/dbraw/zinc/40/40/09/1287404009.db2.gz BGCYLDQKOCAQQX-NHCUHLMSSA-N 1 3 345.531 2.729 10 0 EFAEHO CCN1C[C@@H](CN2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)OC1=O ZINC000846819345 1280551165 /nfs/dbraw/zinc/55/11/65/1280551165.db2.gz YVVOYWGGOYBCJS-FUHWJXTLSA-N 1 3 337.508 2.804 10 0 EFAEHO CCN1C[C@@H](CN2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)OC1=O ZINC000846819345 1280551170 /nfs/dbraw/zinc/55/11/70/1280551170.db2.gz YVVOYWGGOYBCJS-FUHWJXTLSA-N 1 3 337.508 2.804 10 0 EFAEHO CCN1C[C@H](CN2CCC(CC[N@H+](CC)CC(C)C)CC2)OC1=O ZINC000846839650 1280568821 /nfs/dbraw/zinc/56/88/21/1280568821.db2.gz HJSDAGTXUDWVFY-SFHVURJKSA-N 1 3 339.524 2.907 10 0 EFAEHO CCN1C[C@H](CN2CCC(CC[N@@H+](CC)CC(C)C)CC2)OC1=O ZINC000846839650 1280568824 /nfs/dbraw/zinc/56/88/24/1280568824.db2.gz HJSDAGTXUDWVFY-SFHVURJKSA-N 1 3 339.524 2.907 10 0 EFAEHO N[C@@H](Cc1ccccc1)[C@@H](O)C[N@@H+]1CC[C@@]2(CCc3ccccc32)C1 ZINC000872146410 1287443361 /nfs/dbraw/zinc/44/33/61/1287443361.db2.gz NAVKAKDIXFJWDL-FKBYEOEOSA-N 1 3 336.479 2.507 10 0 EFAEHO N[C@@H](Cc1ccccc1)[C@@H](O)C[N@H+]1CC[C@@]2(CCc3ccccc32)C1 ZINC000872146410 1287443363 /nfs/dbraw/zinc/44/33/63/1287443363.db2.gz NAVKAKDIXFJWDL-FKBYEOEOSA-N 1 3 336.479 2.507 10 0 EFAEHO C[C@H](C(=O)NCc1ccccc1Cl)N(C)CCCCCC[NH3+] ZINC000872155776 1287449928 /nfs/dbraw/zinc/44/99/28/1287449928.db2.gz ZDMZIQJWDQIJHJ-CQSZACIVSA-N 1 3 325.884 2.796 10 0 EFAEHO O=C(OCC1CCN(Cc2ccco2)CC1)C1CC[NH+](C2CC2)CC1 ZINC000805901661 1280858188 /nfs/dbraw/zinc/85/81/88/1280858188.db2.gz SYOFKXOVCLJFCC-UHFFFAOYSA-N 1 3 346.471 2.909 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000809967598 1282659924 /nfs/dbraw/zinc/65/99/24/1282659924.db2.gz CSSHAAQBQZFKLG-CRAIPNDOSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000809967598 1282659934 /nfs/dbraw/zinc/65/99/34/1282659934.db2.gz CSSHAAQBQZFKLG-CRAIPNDOSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NCCCCC[NH+]2CCCCC2)C1 ZINC000810381414 1283200363 /nfs/dbraw/zinc/20/03/63/1283200363.db2.gz NETNBSXIWRLKEK-LJQANCHMSA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCC[C@H]([NH+]3CCCC3)CC2)C1 ZINC000810425231 1283220574 /nfs/dbraw/zinc/22/05/74/1283220574.db2.gz HLRLLHXKPKFKLP-LPHOPBHVSA-N 1 3 339.499 2.676 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CC[C@@H](C[NH+]3CCCCC3)C2)C1 ZINC000810443168 1283245207 /nfs/dbraw/zinc/24/52/07/1283245207.db2.gz LKNOLEUREHVOKX-QFBILLFUSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CC[C@H]1CCCC[N@@H+]1C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810444879 1283246378 /nfs/dbraw/zinc/24/63/78/1283246378.db2.gz AACAFWPQAOGDQZ-QAPCUYQASA-N 1 3 327.488 2.532 10 0 EFAEHO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810444879 1283246383 /nfs/dbraw/zinc/24/63/83/1283246383.db2.gz AACAFWPQAOGDQZ-QAPCUYQASA-N 1 3 327.488 2.532 10 0 EFAEHO C[C@H](C[N@H+](C)Cc1ccccc1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810664358 1283469848 /nfs/dbraw/zinc/46/98/48/1283469848.db2.gz DMGSKOIDICPGAR-OXQOHEQNSA-N 1 3 349.494 2.836 10 0 EFAEHO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810664358 1283469851 /nfs/dbraw/zinc/46/98/51/1283469851.db2.gz DMGSKOIDICPGAR-OXQOHEQNSA-N 1 3 349.494 2.836 10 0 EFAEHO CC[C@H](c1ccc(F)cc1F)N1C[C@@H]2C[C@@H]([NH3+])C[C@]2(C(=O)OC)C1 ZINC000903492565 1312765921 /nfs/dbraw/zinc/76/59/21/1312765921.db2.gz FINBCDIKMMANGM-QLYPKJEUSA-N 1 3 338.398 2.628 10 0 EFAEHO C[C@@H](C(=O)Nc1cccc(C(F)(F)F)c1)N1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903494767 1312769237 /nfs/dbraw/zinc/76/92/37/1312769237.db2.gz NZRYFSZZNLBMIV-FRRDWIJNSA-N 1 3 343.393 2.949 10 0 EFAEHO C[C@H](C(=O)Nc1ccc(OC(F)F)cc1)N1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903495862 1312770067 /nfs/dbraw/zinc/77/00/67/1312770067.db2.gz AIZQZQJPSAFISM-JHJVBQTASA-N 1 3 341.402 2.532 10 0 EFAEHO C[C@@H]1CN(Cc2nc(-c3cc(F)c(F)c(F)c3)no2)C[C@H]1CC[NH3+] ZINC000903499237 1312777110 /nfs/dbraw/zinc/77/71/10/1312777110.db2.gz KYTPCWHWAJDJPR-NXEZZACHSA-N 1 3 340.349 2.571 10 0 EFAEHO CC(C)[NH+]1CCC(N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C)CC1 ZINC000721920347 1312800812 /nfs/dbraw/zinc/80/08/12/1312800812.db2.gz OVOURZDQVVAWNT-GOEBONIOSA-N 1 3 325.497 2.704 10 0 EFAEHO C([C@@H]1CCC2(CCOCC2)O1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000878286924 1291601132 /nfs/dbraw/zinc/60/11/32/1291601132.db2.gz VJDFSZWSBDKZDW-NEWSRXKRSA-N 1 3 334.504 2.663 10 0 EFAEHO C([C@@H]1CCC2(CCOCC2)O1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000878286924 1291601142 /nfs/dbraw/zinc/60/11/42/1291601142.db2.gz VJDFSZWSBDKZDW-NEWSRXKRSA-N 1 3 334.504 2.663 10 0 EFAEHO C([C@H]1CCC2(CCOCC2)CO1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000878287371 1291602700 /nfs/dbraw/zinc/60/27/00/1291602700.db2.gz ZSHMBLNGNVIFRP-RLLQIKCJSA-N 1 3 348.531 2.911 10 0 EFAEHO C([C@H]1CCC2(CCOCC2)CO1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000878287371 1291602704 /nfs/dbraw/zinc/60/27/04/1291602704.db2.gz ZSHMBLNGNVIFRP-RLLQIKCJSA-N 1 3 348.531 2.911 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H](C)CN(C)C(=O)C1(N(C)C)CCC1 ZINC001277845912 1313100987 /nfs/dbraw/zinc/10/09/87/1313100987.db2.gz OTFIZUXCZVSISM-SFHVURJKSA-N 1 3 345.531 2.848 10 0 EFAEHO O=C1CCCN1CCC[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000886491787 1294990414 /nfs/dbraw/zinc/99/04/14/1294990414.db2.gz ROJPOFGNEXABTG-ZCNNSNEGSA-N 1 3 341.499 2.642 10 0 EFAEHO O[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C12CCC2 ZINC000886637904 1295077602 /nfs/dbraw/zinc/07/76/02/1295077602.db2.gz HPXIHGHMHNQSOJ-PXTPFGJHSA-N 1 3 326.484 2.933 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(OC)cc1)C(=O)[C@@H]1CCCCN1CC ZINC001273772037 1295244742 /nfs/dbraw/zinc/24/47/42/1295244742.db2.gz QBMHCUUVMOBXPZ-IBGZPJMESA-N 1 3 347.503 2.508 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]C/C=C/CNC(=O)CN(C)C2CCC2)c1 ZINC001274089991 1295450503 /nfs/dbraw/zinc/45/05/03/1295450503.db2.gz TZNMVJGVTSIHSJ-LAQIPUCWSA-N 1 3 329.488 2.802 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\C[NH2+][C@@H](C)c1ccc(F)cc1)N(C)C ZINC001274104675 1295456851 /nfs/dbraw/zinc/45/68/51/1295456851.db2.gz BJHBPADZPFLHDD-UHCGQYCJSA-N 1 3 335.467 2.735 10 0 EFAEHO Brc1ccc(OCCCCN2C[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000903746636 1313156502 /nfs/dbraw/zinc/15/65/02/1313156502.db2.gz IZOPOECGTLOMKW-OKILXGFUSA-N 1 3 339.277 2.759 10 0 EFAEHO C[C@H](C[NH2+]C/C=C/c1ccc(Cl)cc1)NC(=O)C1(N(C)C)CCC1 ZINC001274787938 1296173072 /nfs/dbraw/zinc/17/30/72/1296173072.db2.gz YOSLUKYYAJAVLU-CSPWOOARSA-N 1 3 349.906 2.932 10 0 EFAEHO CN(C[C@H](O)C(F)(F)F)CC1CC[NH+](Cc2ccccc2)CC1 ZINC000720035774 1296690679 /nfs/dbraw/zinc/69/06/79/1296690679.db2.gz DRAKXXSALVLGMH-INIZCTEOSA-N 1 3 330.394 2.754 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H]1C[NH2+]CCCCC(F)(F)F)N(C)C ZINC001277940004 1313302415 /nfs/dbraw/zinc/30/24/15/1313302415.db2.gz BNEUVOXWMIQUFZ-KGLIPLIRSA-N 1 3 337.430 2.640 10 0 EFAEHO CC1(C)C[C@H]([NH3+])C[C@@H](N[C@H]2CCCN(Cc3ccccc3)C2=O)C1 ZINC000925628439 1296864453 /nfs/dbraw/zinc/86/44/53/1296864453.db2.gz FXDAPXJHDQNEKI-KURKYZTESA-N 1 3 329.488 2.673 10 0 EFAEHO CC1(C)[C@H]([NH2+]CCCNC(=O)/C=C/c2ccccc2)[C@@H]2CCCN[C@@H]21 ZINC000925664208 1296867042 /nfs/dbraw/zinc/86/70/42/1296867042.db2.gz CXJNJIPYVLRBPI-YNBUQLHZSA-N 1 3 341.499 2.572 10 0 EFAEHO Cc1ccc([C@@H](NC[C@@H]2CC3(CC[NH2+]CC3)C(=O)O2)C2CCC2)o1 ZINC000925851248 1296881805 /nfs/dbraw/zinc/88/18/05/1296881805.db2.gz QWTWRJOJULQRQR-RDJZCZTQSA-N 1 3 332.444 2.704 10 0 EFAEHO Cc1ccc([C@H](NC[C@H]2CC3(CC[NH2+]CC3)C(=O)O2)C2CCC2)o1 ZINC000925851247 1296883047 /nfs/dbraw/zinc/88/30/47/1296883047.db2.gz QWTWRJOJULQRQR-NVXWUHKLSA-N 1 3 332.444 2.704 10 0 EFAEHO C[N@H+]1C[C@H]2CC[C@@H](C1)C2NC[C@@H](O)c1ccc(C(F)(F)F)cc1 ZINC000926424789 1296927445 /nfs/dbraw/zinc/92/74/45/1296927445.db2.gz QFFKSUIWEJCTGS-XFDYKOMQSA-N 1 3 328.378 2.669 10 0 EFAEHO C[N@@H+]1C[C@H]2CC[C@@H](C1)C2NC[C@@H](O)c1ccc(C(F)(F)F)cc1 ZINC000926424789 1296927453 /nfs/dbraw/zinc/92/74/53/1296927453.db2.gz QFFKSUIWEJCTGS-XFDYKOMQSA-N 1 3 328.378 2.669 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@]34C[C@H]3CCCC4)CC2)CC1 ZINC000927431515 1297020264 /nfs/dbraw/zinc/02/02/64/1297020264.db2.gz AJLFLMZJCJALCL-NQIIRXRSSA-N 1 3 347.547 2.879 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN(Cc2cccc(F)c2)C(C)C)cnn1C ZINC000903883244 1313343165 /nfs/dbraw/zinc/34/31/65/1313343165.db2.gz GGJRGEXXDGOPNT-QGZVFWFLSA-N 1 3 332.467 2.896 10 0 EFAEHO CN(C)C1CC[NH+](C[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)CC1 ZINC000929263810 1297172351 /nfs/dbraw/zinc/17/23/51/1297172351.db2.gz NYWJZQYAVVLXEE-CABCVRRESA-N 1 3 325.497 2.706 10 0 EFAEHO CC(C)CN(CCc1ccccc1)Cc1cnnn1[C@H]1CCC[NH2+]C1 ZINC000903887108 1313353147 /nfs/dbraw/zinc/35/31/47/1313353147.db2.gz YWMBKQIMPXSNSJ-IBGZPJMESA-N 1 3 341.503 2.903 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN2CCC[C@](C)(c3ccccc3)C2)cnn1C ZINC000903893273 1313364128 /nfs/dbraw/zinc/36/41/28/1313364128.db2.gz UHFWIZWFUAEAHW-NQIIRXRSSA-N 1 3 340.515 2.900 10 0 EFAEHO CC[N@H+](C[C@H](CN)Cc1cnn(C)c1C)[C@@H](C)Cc1ccsc1 ZINC000903916488 1313408889 /nfs/dbraw/zinc/40/88/89/1313408889.db2.gz SOZKGXVUHPNJKO-YOEHRIQHSA-N 1 3 334.533 2.861 10 0 EFAEHO CC[N@@H+](C[C@H](CN)Cc1cnn(C)c1C)[C@@H](C)Cc1ccsc1 ZINC000903916488 1313408892 /nfs/dbraw/zinc/40/88/92/1313408892.db2.gz SOZKGXVUHPNJKO-YOEHRIQHSA-N 1 3 334.533 2.861 10 0 EFAEHO Cc1c(C[C@H](CN)C[NH2+]CC(C)(C)c2ccccc2C)cnn1C ZINC000903920224 1313418672 /nfs/dbraw/zinc/41/86/72/1313418672.db2.gz HFHIGZBRRLMVQV-QGZVFWFLSA-N 1 3 328.504 2.722 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H]1C[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001488803012 1297762671 /nfs/dbraw/zinc/76/26/71/1297762671.db2.gz BWWJPJKAQLSDFJ-HDICACEKSA-N 1 3 331.504 2.628 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccsc2)C1 ZINC001488805453 1297765937 /nfs/dbraw/zinc/76/59/37/1297765937.db2.gz SASKGOWMGCGGTH-SRABZTEZSA-N 1 3 335.517 2.605 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccsc2)C1 ZINC001488805442 1297766485 /nfs/dbraw/zinc/76/64/85/1297766485.db2.gz SASKGOWMGCGGTH-MDBPOYHNSA-N 1 3 335.517 2.605 10 0 EFAEHO Cc1c(C[C@H](CN)C[NH2+]CC(C)(C)Cc2ccccc2)cnn1C ZINC000903927037 1313428907 /nfs/dbraw/zinc/42/89/07/1313428907.db2.gz WXEQQWAZNFDFRT-GOSISDBHSA-N 1 3 328.504 2.704 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[C@@H]([NH2+]CC2CCC2)C1)N1CCCCC1 ZINC001488912484 1297846479 /nfs/dbraw/zinc/84/64/79/1297846479.db2.gz PPERGPGYMBPBQA-ZWKOTPCHSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN2CCc3ccc(F)cc3[C@@H](C)C2)cnn1C ZINC000903931628 1313437439 /nfs/dbraw/zinc/43/74/39/1313437439.db2.gz GOIJUWQTPCYMIK-GOEBONIOSA-N 1 3 344.478 2.647 10 0 EFAEHO CC[C@@](C)(NC[C@H](C[NH3+])Cc1cnn(C)c1C)c1ccc(F)cc1 ZINC000903935675 1313446000 /nfs/dbraw/zinc/44/60/00/1313446000.db2.gz SFCSYGHVWVFUTC-HNAYVOBHSA-N 1 3 332.467 2.900 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CC[NH+](C)C)CCN1Cc1cc2ccccc2s1 ZINC001489288827 1298157822 /nfs/dbraw/zinc/15/78/22/1298157822.db2.gz NVYSVNKPFRVNMW-PBHICJAKSA-N 1 3 345.512 2.932 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCN(C/C=C\Cl)CC(C)(C)C1 ZINC001489349065 1298205070 /nfs/dbraw/zinc/20/50/70/1298205070.db2.gz CFKWAURQKRRQFJ-AJHXJQRKSA-N 1 3 329.916 2.688 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCN(C/C=C\Cl)CC(C)(C)C1 ZINC001489349065 1298205081 /nfs/dbraw/zinc/20/50/81/1298205081.db2.gz CFKWAURQKRRQFJ-AJHXJQRKSA-N 1 3 329.916 2.688 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C)Cc1ccc2ncccc2c1)N(C)C ZINC001490213741 1298605575 /nfs/dbraw/zinc/60/55/75/1298605575.db2.gz MIQQMWQTGZUQOG-LJQANCHMSA-N 1 3 342.487 2.513 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C)Cc1ccc2ncccc2c1)N(C)C ZINC001490213741 1298605583 /nfs/dbraw/zinc/60/55/83/1298605583.db2.gz MIQQMWQTGZUQOG-LJQANCHMSA-N 1 3 342.487 2.513 10 0 EFAEHO C[C@H](c1ccccc1F)N(C)CCCNC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001490196788 1298627400 /nfs/dbraw/zinc/62/74/00/1298627400.db2.gz RGMGHBCVXQPMEE-CRAIPNDOSA-N 1 3 347.478 2.667 10 0 EFAEHO Cc1cncc(C[NH2+][C@@H](C)[C@@H]2CCCCN2C(=O)CN(C)C(C)C)c1 ZINC001490309658 1298753904 /nfs/dbraw/zinc/75/39/04/1298753904.db2.gz MHKHGLNLHXQUCG-HKUYNNGSSA-N 1 3 346.519 2.589 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CC[N@H+](CCCCCF)C1)N1CCCCC1 ZINC001490540689 1298950979 /nfs/dbraw/zinc/95/09/79/1298950979.db2.gz PYYHOJLPSLNQAN-MRXNPFEDSA-N 1 3 327.488 2.581 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CC[N@@H+](CCCCCF)C1)N1CCCCC1 ZINC001490540689 1298950984 /nfs/dbraw/zinc/95/09/84/1298950984.db2.gz PYYHOJLPSLNQAN-MRXNPFEDSA-N 1 3 327.488 2.581 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N[C@H]1CCN(CCc2cccs2)C1 ZINC001490581205 1299001735 /nfs/dbraw/zinc/00/17/35/1299001735.db2.gz WQVURWHFZJWHNH-KRWDZBQOSA-N 1 3 349.544 2.747 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC1(C)CC[NH+](CCCCCF)CC1 ZINC001278050902 1313584642 /nfs/dbraw/zinc/58/46/42/1313584642.db2.gz BWLRMFHJEFQNBA-KRWDZBQOSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC1(C)CC[NH+](CCCCCF)CC1 ZINC001278050903 1313584737 /nfs/dbraw/zinc/58/47/37/1313584737.db2.gz BWLRMFHJEFQNBA-QGZVFWFLSA-N 1 3 341.515 2.970 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)CN2CC[C@@H](C)C2)C2CC2)cc1C ZINC001490708234 1299116584 /nfs/dbraw/zinc/11/65/84/1299116584.db2.gz AQJIXTOHLWFZPQ-QRWLVFNGSA-N 1 3 343.515 2.630 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)CN2CC[C@H](C)C2)C2CC2)cc1C ZINC001490708233 1299116886 /nfs/dbraw/zinc/11/68/86/1299116886.db2.gz AQJIXTOHLWFZPQ-MGPUTAFESA-N 1 3 343.515 2.630 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]([NH2+]CC2CCCCCC2)C2CC2)C1 ZINC001490710927 1299120307 /nfs/dbraw/zinc/12/03/07/1299120307.db2.gz VXINBSUCBGVFCF-APWZRJJASA-N 1 3 335.536 2.783 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H]([NH2+]CCC(F)(F)F)C1CC1 ZINC001490718375 1299126871 /nfs/dbraw/zinc/12/68/71/1299126871.db2.gz SHXLHXWBRHFORN-GJZGRUSLSA-N 1 3 349.441 2.686 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]([NH2+]CC1=CCCCC1)C1CC1)N1CCCC1 ZINC001490695436 1299150370 /nfs/dbraw/zinc/15/03/70/1299150370.db2.gz WMGPOTYEISWWGQ-GOSISDBHSA-N 1 3 333.520 2.846 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]([NH2+]CC1CCC(C)CC1)C1CC1 ZINC001490736253 1299171254 /nfs/dbraw/zinc/17/12/54/1299171254.db2.gz DBVVXGDFXNTEGA-LEHRNKBSSA-N 1 3 332.492 2.571 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)C1CC1 ZINC001490740005 1299177817 /nfs/dbraw/zinc/17/78/17/1299177817.db2.gz ADLOAZMNUHVQOR-GDBMZVCRSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)C1CC1 ZINC001490740008 1299177994 /nfs/dbraw/zinc/17/79/94/1299177994.db2.gz ADLOAZMNUHVQOR-ZBFHGGJFSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+]Cc1ccc(Cl)s1)C1CC1 ZINC001490742417 1299179030 /nfs/dbraw/zinc/17/90/30/1299179030.db2.gz PKQBDGHUKGUFRI-AWEZNQCLSA-N 1 3 343.924 2.726 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N1CCC[C@@H](CN(C)C/C=C/Cl)C1 ZINC001490758742 1299199527 /nfs/dbraw/zinc/19/95/27/1299199527.db2.gz MCOIORCJZPLOCT-RUZMYDRRSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N1CCC[C@@H](CN(C)C/C=C/Cl)C1 ZINC001490758742 1299199534 /nfs/dbraw/zinc/19/95/34/1299199534.db2.gz MCOIORCJZPLOCT-RUZMYDRRSA-N 1 3 341.927 2.782 10 0 EFAEHO CC[C@H](F)C[N@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001490773077 1299226081 /nfs/dbraw/zinc/22/60/81/1299226081.db2.gz BKANVMCHKBJIGQ-MSOLQXFVSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001490773077 1299226086 /nfs/dbraw/zinc/22/60/86/1299226086.db2.gz BKANVMCHKBJIGQ-MSOLQXFVSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](C)C[NH2+]CC[C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001326363971 1329750286 /nfs/dbraw/zinc/75/02/86/1329750286.db2.gz IXDBXKSRKDYEAT-IRXDYDNUSA-N 1 3 325.541 2.839 10 0 EFAEHO CCOP(=O)(OCC)[C@H](O)CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000851777787 1299389426 /nfs/dbraw/zinc/38/94/26/1299389426.db2.gz BVWOQUZEOHOCRB-HOTGVXAUSA-N 1 3 348.424 2.521 10 0 EFAEHO CN(Cc1ccc(C[NH+](C)C)cc1)C(=O)NC[C@H]1CCN1C(C)(C)C ZINC000854247497 1300487166 /nfs/dbraw/zinc/48/71/66/1300487166.db2.gz YSBVGUOPLMNJOK-GOSISDBHSA-N 1 3 346.519 2.762 10 0 EFAEHO CCOC(=O)C(F)(F)[C@@H]1CCC[C@H]([NH2+][C@H]2CCNC23CCC3)C1 ZINC000863482490 1302628597 /nfs/dbraw/zinc/62/85/97/1302628597.db2.gz IPMVXKMJBPTGEH-RDBSUJKOSA-N 1 3 330.419 2.618 10 0 EFAEHO C[C@@H]1CC[C@H](N[C@@H]2CCCN(C(=O)Oc3ccccc3)CC2)C[NH2+]1 ZINC000863544891 1302644814 /nfs/dbraw/zinc/64/48/14/1302644814.db2.gz DPWLIEZBADROEJ-ZACQAIPSSA-N 1 3 331.460 2.770 10 0 EFAEHO CC(C)c1ccc(CN2CCC(N3C(=O)O[C@H]4C[NH2+]C[C@H]43)CC2)cc1 ZINC000863550311 1302646173 /nfs/dbraw/zinc/64/61/73/1302646173.db2.gz UDXUSWQDJCMLET-MOPGFXCFSA-N 1 3 343.471 2.567 10 0 EFAEHO CCN1CCC[C@@H](C[NH2+]CC23CC(C2)CN3C(=O)OC(C)(C)C)C1 ZINC000865437819 1303256961 /nfs/dbraw/zinc/25/69/61/1303256961.db2.gz SQGCVDRVYSYHBL-LYGPFTKASA-N 1 3 337.508 2.707 10 0 EFAEHO Cc1ccc(CN2CCO[C@@H](CN[C@H]3CC[N@@H+](C)C(C)(C)C3)C2)cc1 ZINC000865800560 1303406378 /nfs/dbraw/zinc/40/63/78/1303406378.db2.gz PCKWONYIKHVIIM-PMACEKPBSA-N 1 3 345.531 2.658 10 0 EFAEHO Cc1ccc(CN2CCO[C@@H](CN[C@H]3CC[N@H+](C)C(C)(C)C3)C2)cc1 ZINC000865800560 1303406380 /nfs/dbraw/zinc/40/63/80/1303406380.db2.gz PCKWONYIKHVIIM-PMACEKPBSA-N 1 3 345.531 2.658 10 0 EFAEHO C[C@H](CCc1cncc2ccccc21)NC[C@H](O)C[NH+]1CCCC1 ZINC000866242179 1303576719 /nfs/dbraw/zinc/57/67/19/1303576719.db2.gz AWKKOSMVNJRONR-APWZRJJASA-N 1 3 327.472 2.602 10 0 EFAEHO CC(=O)NCC1CCC([NH2+][C@@H](C)[C@@H]2CCCN(C3CCC3)C2)CC1 ZINC000866335556 1303606529 /nfs/dbraw/zinc/60/65/29/1303606529.db2.gz BKHNQKCWQHNORE-WEOZKBJRSA-N 1 3 335.536 2.924 10 0 EFAEHO CCC[NH+]1CCC(NC[C@@H]2CN(Cc3cccc(C)c3)CCO2)CC1 ZINC000866556113 1303682465 /nfs/dbraw/zinc/68/24/65/1303682465.db2.gz XZCOWMWZWUKUAD-OAQYLSRUSA-N 1 3 345.531 2.660 10 0 EFAEHO CCCN1CCC([NH2+]C[C@@H]2CN(Cc3cccc(C)c3)CCO2)CC1 ZINC000866556113 1303682470 /nfs/dbraw/zinc/68/24/70/1303682470.db2.gz XZCOWMWZWUKUAD-OAQYLSRUSA-N 1 3 345.531 2.660 10 0 EFAEHO CC[N@@H+]1CC[C@H](NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)[C@@H](C)C1 ZINC000866557656 1303684060 /nfs/dbraw/zinc/68/40/60/1303684060.db2.gz CCLZSHPVNACKGW-TYPHKJRUSA-N 1 3 345.531 2.516 10 0 EFAEHO CC[N@H+]1CC[C@H](NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)[C@@H](C)C1 ZINC000866557656 1303684066 /nfs/dbraw/zinc/68/40/66/1303684066.db2.gz CCLZSHPVNACKGW-TYPHKJRUSA-N 1 3 345.531 2.516 10 0 EFAEHO CC1CCN([C@@H](CNC(=O)[C@]23C[C@H]2C[C@H]([NH3+])C3)c2cccs2)CC1 ZINC000870853790 1305629363 /nfs/dbraw/zinc/62/93/63/1305629363.db2.gz CWAPXAZVIKRARW-DRMAHVMPSA-N 1 3 347.528 2.765 10 0 EFAEHO O=C(CCC12CC(C1)C[NH2+]2)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000870874906 1305646458 /nfs/dbraw/zinc/64/64/58/1305646458.db2.gz RYUYVNNHXHPJID-OBXNSHGQSA-N 1 3 341.499 2.690 10 0 EFAEHO CC(C)(C)[C@@]1(C[NH3+])CCN(C(=O)[C@H]2CCCN2Cc2ccccc2)C1 ZINC000870991649 1305733414 /nfs/dbraw/zinc/73/34/14/1305733414.db2.gz HHBUXEKSUJRACM-WIYYLYMNSA-N 1 3 343.515 2.875 10 0 EFAEHO C[NH+](C)C1(C)CCC(NC(=O)C2C[C@H](c3ccccc3)OC2=O)CC1 ZINC000871360565 1306021045 /nfs/dbraw/zinc/02/10/45/1306021045.db2.gz GPKWKEXLIFKQRH-MUZJZNNISA-N 1 3 344.455 2.670 10 0 EFAEHO C[NH+](C)C1(C)CCC(NC(=O)C2C[C@@H](c3ccccc3)OC2=O)CC1 ZINC000871360566 1306021124 /nfs/dbraw/zinc/02/11/24/1306021124.db2.gz GPKWKEXLIFKQRH-RXCRORICSA-N 1 3 344.455 2.670 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)c1 ZINC001278326000 1314100818 /nfs/dbraw/zinc/10/08/18/1314100818.db2.gz MEXHQKIZSPJYPO-QUCCMNQESA-N 1 3 345.531 2.847 10 0 EFAEHO O=C(N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(NC2=NCCC2)cc1 ZINC000900239676 1307808875 /nfs/dbraw/zinc/80/88/75/1307808875.db2.gz DVMOINCTWHDXQE-IAGOWNOFSA-N 1 3 326.444 2.647 10 0 EFAEHO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(NC2=NCCC2)cc1 ZINC000900239676 1307808879 /nfs/dbraw/zinc/80/88/79/1307808879.db2.gz DVMOINCTWHDXQE-IAGOWNOFSA-N 1 3 326.444 2.647 10 0 EFAEHO O=C(N[C@H]1CC[N@H+](CC2CC2)C1)c1ccc(NC2=NCCC2)cc1 ZINC000900628355 1308433333 /nfs/dbraw/zinc/43/33/33/1308433333.db2.gz XTOYLCRUYYXAHL-KRWDZBQOSA-N 1 3 326.444 2.505 10 0 EFAEHO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1ccc(NC2=NCCC2)cc1 ZINC000900628355 1308433336 /nfs/dbraw/zinc/43/33/36/1308433336.db2.gz XTOYLCRUYYXAHL-KRWDZBQOSA-N 1 3 326.444 2.505 10 0 EFAEHO C[N@@H+]1CCC[C@@H]2CN(C(=O)c3ccc(NC4=NCCC4)cc3)CC[C@H]21 ZINC000901104674 1309472976 /nfs/dbraw/zinc/47/29/76/1309472976.db2.gz PJFHUMZHUBHZSI-SJLPKXTDSA-N 1 3 340.471 2.847 10 0 EFAEHO C[N@H+]1CCC[C@@H]2CN(C(=O)c3ccc(NC4=NCCC4)cc3)CC[C@H]21 ZINC000901104674 1309472981 /nfs/dbraw/zinc/47/29/81/1309472981.db2.gz PJFHUMZHUBHZSI-SJLPKXTDSA-N 1 3 340.471 2.847 10 0 EFAEHO C[N@@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000901135339 1309576858 /nfs/dbraw/zinc/57/68/58/1309576858.db2.gz LTWZEUGAUBGYEI-FUHWJXTLSA-N 1 3 340.471 2.847 10 0 EFAEHO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000901135339 1309576862 /nfs/dbraw/zinc/57/68/62/1309576862.db2.gz LTWZEUGAUBGYEI-FUHWJXTLSA-N 1 3 340.471 2.847 10 0 EFAEHO C[N@@H+]1CCCC12CCN(C(=O)c1ccc(NC3=NCCC3)cc1)CC2 ZINC000901303463 1310093542 /nfs/dbraw/zinc/09/35/42/1310093542.db2.gz LUAKSNBASIGWFN-UHFFFAOYSA-N 1 3 340.471 2.991 10 0 EFAEHO C[N@H+]1CCCC12CCN(C(=O)c1ccc(NC3=NCCC3)cc1)CC2 ZINC000901303463 1310093554 /nfs/dbraw/zinc/09/35/54/1310093554.db2.gz LUAKSNBASIGWFN-UHFFFAOYSA-N 1 3 340.471 2.991 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NC[C@@H]1CCN1CCC1=CCCCC1 ZINC001276977606 1311403273 /nfs/dbraw/zinc/40/32/73/1311403273.db2.gz IXSOMTXASYFXCD-IBGZPJMESA-N 1 3 333.520 2.943 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001277075003 1311578863 /nfs/dbraw/zinc/57/88/63/1311578863.db2.gz QTPYTAIZOKXZIH-AIIUMHCMSA-N 1 3 343.515 2.770 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@H](C[NH2+]CCc2ccccc2)C1 ZINC001277092663 1311602168 /nfs/dbraw/zinc/60/21/68/1311602168.db2.gz IWSUURAHYYLRJR-ZULIPRJHSA-N 1 3 343.515 2.586 10 0 EFAEHO C[C@H](CCC[NH2+]C/C=C/Cl)NC(=O)C(C)(C)N1CCCCC1 ZINC001277186211 1311771535 /nfs/dbraw/zinc/77/15/35/1311771535.db2.gz DESNXQMUNPFQJB-TUPIDYKKSA-N 1 3 329.916 2.878 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC1([NH2+]CC2=CCCCC2)CC1 ZINC001277188862 1311776681 /nfs/dbraw/zinc/77/66/81/1311776681.db2.gz CWULJHOSVWAJRC-GOSISDBHSA-N 1 3 333.520 2.988 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H](C2CCN(C(=O)[C@@H]3CCCN3C)CC2)C1 ZINC001277276414 1311911777 /nfs/dbraw/zinc/91/17/77/1311911777.db2.gz ZLVQNHWELBKGRK-OALUTQOASA-N 1 3 335.536 2.831 10 0 EFAEHO CCCCC[N@H+]1CC[C@H](C2CCN(C(=O)[C@@H]3CCCN3C)CC2)C1 ZINC001277276414 1311911781 /nfs/dbraw/zinc/91/17/81/1311911781.db2.gz ZLVQNHWELBKGRK-OALUTQOASA-N 1 3 335.536 2.831 10 0 EFAEHO CCN1CCN([C@@H](C)C[NH2+][C@@H](C)c2cccc(-n3ccnc3)c2)CC1 ZINC000902747431 1312072919 /nfs/dbraw/zinc/07/29/19/1312072919.db2.gz UKQOSBPGEIWMCC-ROUUACIJSA-N 1 3 341.503 2.549 10 0 EFAEHO O[C@H](C[NH2+][C@@H](CCc1cccnc1)c1ccccc1)CN1CCCC1 ZINC000902763778 1312085771 /nfs/dbraw/zinc/08/57/71/1312085771.db2.gz YWXJMGVNMJAAMK-RTWAWAEBSA-N 1 3 339.483 2.802 10 0 EFAEHO O[C@@H](C[NH2+][C@@H](CCc1cccnc1)c1ccccc1)CN1CCCC1 ZINC000902763779 1312085891 /nfs/dbraw/zinc/08/58/91/1312085891.db2.gz YWXJMGVNMJAAMK-SFTDATJTSA-N 1 3 339.483 2.802 10 0 EFAEHO CCC/C=C/CC[N@H+](C)C1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001277429069 1312155678 /nfs/dbraw/zinc/15/56/78/1312155678.db2.gz HQXGPDVOHZWRNU-DKFQHHCZSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[N@@H+](C)C1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001277429069 1312155680 /nfs/dbraw/zinc/15/56/80/1312155680.db2.gz HQXGPDVOHZWRNU-DKFQHHCZSA-N 1 3 335.536 2.997 10 0 EFAEHO COc1ccc2c(c1)C[C@@H](C)C[C@@H]2[NH2+]CCN1CCN(C)C(C)(C)C1 ZINC000902982164 1312259494 /nfs/dbraw/zinc/25/94/94/1312259494.db2.gz WKXZASXBIGYLND-UZLBHIALSA-N 1 3 345.531 2.934 10 0 EFAEHO c1cc(CN2CCC(C[NH2+][C@H]3CC[C@@H]4[C@H]5OCC[C@H]5[C@@H]43)CC2)ccn1 ZINC000903050094 1312310666 /nfs/dbraw/zinc/31/06/66/1312310666.db2.gz PZCJWMOCSGHXRL-ALGQRKQJSA-N 1 3 341.499 2.697 10 0 EFAEHO C[C@H](CN[C@H](C)C1(NC(=O)OC(C)(C)C)CC1)C[NH+]1CCCC1 ZINC000903071732 1312325448 /nfs/dbraw/zinc/32/54/48/1312325448.db2.gz AQXPFTUOZDHGHW-HUUCEWRRSA-N 1 3 325.497 2.754 10 0 EFAEHO C[C@H](C[NH2+][C@H](C)C1(NC(=O)OC(C)(C)C)CC1)CN1CCCC1 ZINC000903071732 1312325450 /nfs/dbraw/zinc/32/54/50/1312325450.db2.gz AQXPFTUOZDHGHW-HUUCEWRRSA-N 1 3 325.497 2.754 10 0 EFAEHO CN(C(=O)C(C)(C)N1CCCC1)[C@H]1CC[N@H+](CCCCCF)C1 ZINC001318423584 1328584308 /nfs/dbraw/zinc/58/43/08/1328584308.db2.gz MEUTYOQOSVXRDC-INIZCTEOSA-N 1 3 327.488 2.533 10 0 EFAEHO CN(C(=O)C(C)(C)N1CCCC1)[C@H]1CC[N@@H+](CCCCCF)C1 ZINC001318423584 1328584309 /nfs/dbraw/zinc/58/43/09/1328584309.db2.gz MEUTYOQOSVXRDC-INIZCTEOSA-N 1 3 327.488 2.533 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C(F)(F)F ZINC001278703348 1315580751 /nfs/dbraw/zinc/58/07/51/1315580751.db2.gz GZAGDKGQRVHJRP-CABCVRRESA-N 1 3 349.441 2.519 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([C@H](C)[NH2+]CCCc2ccccc2)C1 ZINC001279047603 1316094083 /nfs/dbraw/zinc/09/40/83/1316094083.db2.gz XHXLVAKDIXMHOL-AZUAARDMSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([C@@H](C)[NH2+]CCCc2ccccc2)C1 ZINC001279047608 1316094179 /nfs/dbraw/zinc/09/41/79/1316094179.db2.gz XHXLVAKDIXMHOL-UYAOXDASSA-N 1 3 345.531 2.786 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]CCCN(C)C(=O)CN1CCCC1 ZINC001276386539 1316423717 /nfs/dbraw/zinc/42/37/17/1316423717.db2.gz DWRRSBNLRUENSS-UHFFFAOYSA-N 1 3 337.895 2.682 10 0 EFAEHO CC(C)CN1CCC([NH2+]C[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1 ZINC000378882584 1316527523 /nfs/dbraw/zinc/52/75/23/1316527523.db2.gz ITLNXHOPUPXOPG-MRXNPFEDSA-N 1 3 339.524 2.953 10 0 EFAEHO Cc1ccccc1CN1CC[C@@H]1CN(C)C(=O)CCCC[NH+](C)C ZINC001263817070 1316565493 /nfs/dbraw/zinc/56/54/93/1316565493.db2.gz NXRFTOMTMGQLCK-LJQANCHMSA-N 1 3 331.504 2.760 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2C[C@H]([NH2+]CCCc3ccccc3)C2)CCC1 ZINC001263863715 1316569850 /nfs/dbraw/zinc/56/98/50/1316569850.db2.gz BDAVQXUBDDROQX-WGSAOQKQSA-N 1 3 343.515 2.588 10 0 EFAEHO C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@@H]1CC[NH2+]CCC(C)(C)C ZINC001264517628 1316626762 /nfs/dbraw/zinc/62/67/62/1316626762.db2.gz IRUKXVWWCFGGQG-NVXWUHKLSA-N 1 3 334.508 2.995 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C)[C@H]1CC[NH2+]Cc1cccnc1 ZINC001264520507 1316627646 /nfs/dbraw/zinc/62/76/46/1316627646.db2.gz MBPUXWXCCBQPCY-PKOBYXMFSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]CCC1CC1 ZINC001264549378 1316630168 /nfs/dbraw/zinc/63/01/68/1316630168.db2.gz DNRDISDTFWSPDI-NEWSRXKRSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]CCC1CC1 ZINC001264549380 1316630278 /nfs/dbraw/zinc/63/02/78/1316630278.db2.gz DNRDISDTFWSPDI-NZSAHSFTSA-N 1 3 335.536 2.876 10 0 EFAEHO CN(CCCNC(=O)[C@@H]1CCC[N@H+]1C1CCCC1)CCC(F)(F)F ZINC001264995235 1316682881 /nfs/dbraw/zinc/68/28/81/1316682881.db2.gz YHTGJDMMDFHUHL-HNNXBMFYSA-N 1 3 349.441 2.784 10 0 EFAEHO CN(CCCNC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1)CCC(F)(F)F ZINC001264995235 1316682878 /nfs/dbraw/zinc/68/28/78/1316682878.db2.gz YHTGJDMMDFHUHL-HNNXBMFYSA-N 1 3 349.441 2.784 10 0 EFAEHO C[C@H](c1ccccc1F)N(C)CCCNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001265057935 1316705147 /nfs/dbraw/zinc/70/51/47/1316705147.db2.gz BASRXYCIAKIGEW-CVEARBPZSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@H](c1ccccc1F)N(C)CCCNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001265057935 1316705148 /nfs/dbraw/zinc/70/51/48/1316705148.db2.gz BASRXYCIAKIGEW-CVEARBPZSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@H](c1ccccc1F)N(C)CCCNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001265057937 1316705328 /nfs/dbraw/zinc/70/53/28/1316705328.db2.gz BASRXYCIAKIGEW-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@H](c1ccccc1F)N(C)CCCNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001265057937 1316705330 /nfs/dbraw/zinc/70/53/30/1316705330.db2.gz BASRXYCIAKIGEW-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)[C@@H]1CCCc2ccc(F)cc21)N(C)C ZINC001265060023 1316705654 /nfs/dbraw/zinc/70/56/54/1316705654.db2.gz TTXXIHVJAIBYMJ-RBUKOAKNSA-N 1 3 349.494 2.981 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)[C@@H]1CCCc2ccc(F)cc21)N(C)C ZINC001265060023 1316705656 /nfs/dbraw/zinc/70/56/56/1316705656.db2.gz TTXXIHVJAIBYMJ-RBUKOAKNSA-N 1 3 349.494 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@H+](C)CC1CCC(F)(F)CC1)N(C)C ZINC001265061404 1316706706 /nfs/dbraw/zinc/70/67/06/1316706706.db2.gz PIFNYICBKSXWOO-INIZCTEOSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@@H+](C)CC1CCC(F)(F)CC1)N(C)C ZINC001265061404 1316706709 /nfs/dbraw/zinc/70/67/09/1316706709.db2.gz PIFNYICBKSXWOO-INIZCTEOSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC1(C[NH2+]C/C=C/Cl)CCCC1 ZINC001318632721 1328657209 /nfs/dbraw/zinc/65/72/09/1328657209.db2.gz MTLBJJYDKGSTBN-WGPYJDKQSA-N 1 3 327.900 2.630 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC1(C[NH2+]C/C=C\Cl)CCCC1 ZINC001318632684 1328657669 /nfs/dbraw/zinc/65/76/69/1328657669.db2.gz MTLBJJYDKGSTBN-IZIDJEDMSA-N 1 3 327.900 2.630 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC12CC[NH+](CC1=CCCCC1)CC2)N(C)C ZINC001265334559 1316785118 /nfs/dbraw/zinc/78/51/18/1316785118.db2.gz URCDXMNVTPBDKU-ZWKOTPCHSA-N 1 3 333.520 2.798 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC12CC[NH+](CC1=CCCCC1)CC2)N(C)C ZINC001265334558 1316785169 /nfs/dbraw/zinc/78/51/69/1316785169.db2.gz URCDXMNVTPBDKU-ROUUACIJSA-N 1 3 333.520 2.798 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]CC1=CCCCC1)C1CC1 ZINC001265358553 1316789745 /nfs/dbraw/zinc/78/97/45/1316789745.db2.gz LORSFFGKKBZVIU-OALUTQOASA-N 1 3 333.520 2.846 10 0 EFAEHO CCCCC[NH2+][C@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001265447089 1316807456 /nfs/dbraw/zinc/80/74/56/1316807456.db2.gz YJLCEBROYJQHRW-YJBOKZPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1C[C@@H]([NH2+]CCCc2ccsc2)C1 ZINC001265539132 1316822870 /nfs/dbraw/zinc/82/28/70/1316822870.db2.gz YMJAHZZDMAABJN-FGTMMUONSA-N 1 3 349.544 2.790 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H](C[NH2+]CCC3CCCC3)C2)C1 ZINC001265623916 1316837192 /nfs/dbraw/zinc/83/71/92/1316837192.db2.gz GUATYUMHXDAGPM-MJGOQNOKSA-N 1 3 335.536 2.737 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NC[C@@H]2CCCCN2CCCCC(F)(F)F)C1 ZINC001265657447 1316846127 /nfs/dbraw/zinc/84/61/27/1316846127.db2.gz CYAOIFMNMRITIK-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NC[C@@H]2CCCCN2CCCCC(F)(F)F)C1 ZINC001265657447 1316846130 /nfs/dbraw/zinc/84/61/30/1316846130.db2.gz CYAOIFMNMRITIK-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[NH2+]CCc1ccccc1F ZINC001265689810 1316855015 /nfs/dbraw/zinc/85/50/15/1316855015.db2.gz LFLCXRXJIDWBQB-SFHVURJKSA-N 1 3 349.494 2.681 10 0 EFAEHO C[C@H](c1cccc(F)c1)[N@H+](C)CCCNC(=O)CN(C)C1CCC1 ZINC001265862894 1316895916 /nfs/dbraw/zinc/89/59/16/1316895916.db2.gz KYQJMZMAUNOHJW-OAHLLOKOSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@H](c1cccc(F)c1)[N@@H+](C)CCCNC(=O)CN(C)C1CCC1 ZINC001265862894 1316895919 /nfs/dbraw/zinc/89/59/19/1316895919.db2.gz KYQJMZMAUNOHJW-OAHLLOKOSA-N 1 3 335.467 2.809 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001265862975 1316895992 /nfs/dbraw/zinc/89/59/92/1316895992.db2.gz OJLIJDMYJAREOZ-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001265862975 1316895995 /nfs/dbraw/zinc/89/59/95/1316895995.db2.gz OJLIJDMYJAREOZ-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO CC(C)=CC[N@H+](C)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001265923901 1316915667 /nfs/dbraw/zinc/91/56/67/1316915667.db2.gz YZXARCNTNKLLQK-SFHVURJKSA-N 1 3 327.488 2.603 10 0 EFAEHO CC(C)=CC[N@@H+](C)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001265923901 1316915669 /nfs/dbraw/zinc/91/56/69/1316915669.db2.gz YZXARCNTNKLLQK-SFHVURJKSA-N 1 3 327.488 2.603 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@H+](C)[C@@H]1CCc2c1cccc2F ZINC001265978240 1316935581 /nfs/dbraw/zinc/93/55/81/1316935581.db2.gz GERZFBIQTVTXBK-GOSISDBHSA-N 1 3 335.467 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@@H+](C)[C@@H]1CCc2c1cccc2F ZINC001265978240 1316935585 /nfs/dbraw/zinc/93/55/85/1316935585.db2.gz GERZFBIQTVTXBK-GOSISDBHSA-N 1 3 335.467 2.591 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](C)Cc1ccc(CF)cc1 ZINC001265978362 1316936215 /nfs/dbraw/zinc/93/62/15/1316936215.db2.gz KPOCXTJAXVBWMG-LJQANCHMSA-N 1 3 349.494 2.969 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](C)Cc1ccc(CF)cc1 ZINC001265978362 1316936218 /nfs/dbraw/zinc/93/62/18/1316936218.db2.gz KPOCXTJAXVBWMG-LJQANCHMSA-N 1 3 349.494 2.969 10 0 EFAEHO O[C@@]1(CNCCc2c(F)cccc2F)CC[N@H+](Cc2ccccc2)C1 ZINC000702563672 1316976298 /nfs/dbraw/zinc/97/62/98/1316976298.db2.gz RFKZIHZGQRNEMV-HXUWFJFHSA-N 1 3 346.421 2.734 10 0 EFAEHO O[C@@]1(CNCCc2c(F)cccc2F)CC[N@@H+](Cc2ccccc2)C1 ZINC000702563672 1316976300 /nfs/dbraw/zinc/97/63/00/1316976300.db2.gz RFKZIHZGQRNEMV-HXUWFJFHSA-N 1 3 346.421 2.734 10 0 EFAEHO CCCC[N@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001266158978 1317109201 /nfs/dbraw/zinc/10/92/01/1317109201.db2.gz AKPHAZGBMDFMKK-LJQANCHMSA-N 1 3 341.515 2.970 10 0 EFAEHO CCCC[N@@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001266158978 1317109207 /nfs/dbraw/zinc/10/92/07/1317109207.db2.gz AKPHAZGBMDFMKK-LJQANCHMSA-N 1 3 341.515 2.970 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NCCCN(Cc2ccsc2)C2CC2)C1 ZINC001266169090 1317119421 /nfs/dbraw/zinc/11/94/21/1317119421.db2.gz PVUJQLPGKPSQOG-HNNXBMFYSA-N 1 3 335.517 2.561 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NCCCN(Cc2ccsc2)C2CC2)C1 ZINC001266169090 1317119425 /nfs/dbraw/zinc/11/94/25/1317119425.db2.gz PVUJQLPGKPSQOG-HNNXBMFYSA-N 1 3 335.517 2.561 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@H]1CCCN(CC2=CCCCC2)C1 ZINC001266222146 1317162338 /nfs/dbraw/zinc/16/23/38/1317162338.db2.gz OMGSSJXKOYMPBK-OALUTQOASA-N 1 3 333.520 2.942 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@H]1CCCN(CC2=CCCCC2)C1 ZINC001266222146 1317162344 /nfs/dbraw/zinc/16/23/44/1317162344.db2.gz OMGSSJXKOYMPBK-OALUTQOASA-N 1 3 333.520 2.942 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)C2CCC2)C[C@H]1C[NH2+]CCCC(C)(C)C ZINC001279115973 1317193122 /nfs/dbraw/zinc/19/31/22/1317193122.db2.gz XXXHNQDUBCKPAR-DLBZAZTESA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC([NH2+]CCCc2cccc(C)c2)C1)N(C)C ZINC001279315643 1317234550 /nfs/dbraw/zinc/23/45/50/1317234550.db2.gz OILKMJXJTUKDMB-MHJFOBGBSA-N 1 3 345.531 2.847 10 0 EFAEHO CCC[NH2+]CCN(Cc1ccccc1)C(=O)[C@H]1CCCCN1CC ZINC001279327607 1317236665 /nfs/dbraw/zinc/23/66/65/1317236665.db2.gz KOLNLKJTGLXAAS-LJQANCHMSA-N 1 3 331.504 2.889 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@H+](Cc2cc(C)sc2C)CC1)N(C)C ZINC001279675260 1317354418 /nfs/dbraw/zinc/35/44/18/1317354418.db2.gz CGJCDPDYIWBQME-SFHVURJKSA-N 1 3 349.544 2.953 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@@H+](Cc2cc(C)sc2C)CC1)N(C)C ZINC001279675260 1317354428 /nfs/dbraw/zinc/35/44/28/1317354428.db2.gz CGJCDPDYIWBQME-SFHVURJKSA-N 1 3 349.544 2.953 10 0 EFAEHO Cc1cc(C)cc(C[N@H+]2CC=C(CNC(=O)CN(C)C(C)C)CC2)c1 ZINC001279694819 1317362479 /nfs/dbraw/zinc/36/24/79/1317362479.db2.gz FERRISKBYAAPSJ-UHFFFAOYSA-N 1 3 343.515 2.892 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+]2CC=C(CNC(=O)CN(C)C(C)C)CC2)c1 ZINC001279694819 1317362488 /nfs/dbraw/zinc/36/24/88/1317362488.db2.gz FERRISKBYAAPSJ-UHFFFAOYSA-N 1 3 343.515 2.892 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@H]3CCCN3C)C2)cc1C ZINC001279999381 1317433321 /nfs/dbraw/zinc/43/33/21/1317433321.db2.gz JSONPDDCGWOKLM-UYAOXDASSA-N 1 3 343.515 2.726 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@@H](CC[NH2+]CC3CC3)C2)c1 ZINC001280308897 1317503769 /nfs/dbraw/zinc/50/37/69/1317503769.db2.gz WLSPPROJKXIJOQ-QGZVFWFLSA-N 1 3 329.488 2.600 10 0 EFAEHO CCC/C=C\CCN1CC[C@@H]1CN(C)C(=O)CC1CC[NH+](C)CC1 ZINC001316605463 1317714306 /nfs/dbraw/zinc/71/43/06/1317714306.db2.gz XRXCZVJAMIIXMT-LIXSYLKWSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@H](CC[NH2+]CC2CCCC2)C1)N(C)C ZINC001318848285 1328720996 /nfs/dbraw/zinc/72/09/96/1328720996.db2.gz DYZLDSZUOZNDNI-MOPGFXCFSA-N 1 3 337.552 2.981 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC(CC[NH2+]CCC2CCCC2)CC1 ZINC001318875040 1328729785 /nfs/dbraw/zinc/72/97/85/1328729785.db2.gz PAMJSNUKMIBWEP-LJQANCHMSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(CC[NH2+]CC2CCC2)CC1 ZINC001318936673 1328744962 /nfs/dbraw/zinc/74/49/62/1328744962.db2.gz ABOPJSBVQPWJGP-LJQANCHMSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H](C)C[NH2+]CCC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001318929953 1328743858 /nfs/dbraw/zinc/74/38/58/1328743858.db2.gz VFRXYDHAVZJCPJ-AEFFLSMTSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H]([NH2+]CCCc2ccccc2)CC1 ZINC001318983171 1328755794 /nfs/dbraw/zinc/75/57/94/1328755794.db2.gz FDGHOAURMODUIF-MXVIHJGJSA-N 1 3 345.531 2.976 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2cccc(C)c2)[C@@H](C)C1 ZINC001281459019 1318329677 /nfs/dbraw/zinc/32/96/77/1318329677.db2.gz RMPNTKWIMHKFFY-ICSRJNTNSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[N@H+](CCCCCF)CC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001281833723 1318599086 /nfs/dbraw/zinc/59/90/86/1318599086.db2.gz OWMVLRHVKCAUTR-GOSISDBHSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[N@@H+](CCCCCF)CC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001281833723 1318599095 /nfs/dbraw/zinc/59/90/95/1318599095.db2.gz OWMVLRHVKCAUTR-GOSISDBHSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[NH2+]CCCc1ccccc1C)N(C)C ZINC001319124823 1328784827 /nfs/dbraw/zinc/78/48/27/1328784827.db2.gz UBSSPECWAKVNPY-WOJBJXKFSA-N 1 3 345.531 2.848 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC2(C1)CCN(C(=O)CN1CC[C@@H](C)C1)CC2 ZINC001319145115 1328791119 /nfs/dbraw/zinc/79/11/19/1328791119.db2.gz OFZSOHWDZSZZFB-VZSQWMKGSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC2(C1)CCN(C(=O)CN1CC[C@@H](C)C1)CC2 ZINC001319145115 1328791123 /nfs/dbraw/zinc/79/11/23/1328791123.db2.gz OFZSOHWDZSZZFB-VZSQWMKGSA-N 1 3 347.547 2.999 10 0 EFAEHO C[C@@H](CCC[NH2+]Cc1ccc(F)cc1)NC(=O)C1(N(C)C)CCC1 ZINC001283185708 1319408945 /nfs/dbraw/zinc/40/89/45/1319408945.db2.gz LTPVDUQWLNWXIW-HNNXBMFYSA-N 1 3 335.467 2.685 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@H](C)C[NH2+]CC=C(Cl)Cl ZINC001319284158 1328831909 /nfs/dbraw/zinc/83/19/09/1328831909.db2.gz FKCHSDKXRWUGST-CHWSQXEVSA-N 1 3 336.307 2.522 10 0 EFAEHO C[C@H](CN(C)C(=O)Cc1c[nH]cn1)[NH2+]CCCc1ccc(Cl)cc1 ZINC001283679185 1319951778 /nfs/dbraw/zinc/95/17/78/1319951778.db2.gz KHNYSAHSELZYKX-CQSZACIVSA-N 1 3 348.878 2.675 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCCCCF ZINC001283681137 1319954183 /nfs/dbraw/zinc/95/41/83/1319954183.db2.gz WIOMNDPFOYZQRJ-QAPCUYQASA-N 1 3 347.494 2.775 10 0 EFAEHO CC[C@@H](C(=O)N1CCC2(CN(CC=C(C)C)C2)CC1)[NH+](CC)CC ZINC001319404485 1328873593 /nfs/dbraw/zinc/87/35/93/1328873593.db2.gz DYZPZBVYCNBPNS-SFHVURJKSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@H](C(=O)N1CCC2(CN(CC=C(C)C)C2)CC1)[NH+](CC)CC ZINC001319404484 1328873935 /nfs/dbraw/zinc/87/39/35/1328873935.db2.gz DYZPZBVYCNBPNS-GOSISDBHSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H](C[NH2+]CCc2ccccc2F)C1 ZINC001284242554 1320283009 /nfs/dbraw/zinc/28/30/09/1320283009.db2.gz FENQNYFEHVSSJZ-SJLPKXTDSA-N 1 3 349.494 2.583 10 0 EFAEHO CC1(C)CN(C(=O)CCCC[NH+]2CCCC2)C[C@@H]1NC/C=C\Cl ZINC001284346845 1320329016 /nfs/dbraw/zinc/32/90/16/1320329016.db2.gz BXWXXJVAWPQPFQ-GQSKFBFOSA-N 1 3 341.927 2.832 10 0 EFAEHO CC1(C)CN(C(=O)CCCC[NH+]2CCCC2)C[C@H]1NC/C=C/Cl ZINC001284346848 1320329145 /nfs/dbraw/zinc/32/91/45/1320329145.db2.gz BXWXXJVAWPQPFQ-MNDMWVCDSA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]CCCC(C)(C)C)C(C)(C)C1 ZINC001284349609 1320331012 /nfs/dbraw/zinc/33/10/12/1320331012.db2.gz QOZBHUWOBSQWAA-MRXNPFEDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC/C=C/CC[NH+]1CCC(C2(NC(=O)Cc3nc[nH]c3C)CC2)CC1 ZINC001284845843 1320560653 /nfs/dbraw/zinc/56/06/53/1320560653.db2.gz DFQLXKAIAUXSNU-SNAWJCMRSA-N 1 3 344.503 2.978 10 0 EFAEHO Cc1cccc(C[N@H+]2CC=C(CNC(=O)[C@H](C(C)C)N(C)C)CC2)c1 ZINC001284927713 1320599563 /nfs/dbraw/zinc/59/95/63/1320599563.db2.gz HZZMBOFQRFBPDQ-FQEVSTJZSA-N 1 3 343.515 2.830 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC=C(CNC(=O)[C@H](C(C)C)N(C)C)CC2)c1 ZINC001284927713 1320599565 /nfs/dbraw/zinc/59/95/65/1320599565.db2.gz HZZMBOFQRFBPDQ-FQEVSTJZSA-N 1 3 343.515 2.830 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2C[C@H]([NH2+]CCCC3CCCC3)C2)C1 ZINC001316637023 1320731735 /nfs/dbraw/zinc/73/17/35/1320731735.db2.gz TXTRCFFPDXPRFF-WDSOQIARSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1ccc(CCC[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001319533924 1328911087 /nfs/dbraw/zinc/91/10/87/1328911087.db2.gz LJWJOPYMIDRUEC-MOPGFXCFSA-N 1 3 345.531 2.706 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]CCc1ccc(C)cc1 ZINC001319594050 1328923432 /nfs/dbraw/zinc/92/34/32/1328923432.db2.gz RCJWNUIBGNDYDM-ICSRJNTNSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]CC1=CCCCC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001319635734 1328934919 /nfs/dbraw/zinc/93/49/19/1328934919.db2.gz YYWDPCJZLCXKIY-MJGOQNOKSA-N 1 3 335.536 2.949 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCCCN2C(=O)Cc2c[nH]cn2)cc1 ZINC001319779350 1328986634 /nfs/dbraw/zinc/98/66/34/1328986634.db2.gz SIQNOHHCHQBYCA-LJQANCHMSA-N 1 3 340.471 2.822 10 0 EFAEHO Cc1ncccc1C[NH2+]CC[C@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001319789625 1328990381 /nfs/dbraw/zinc/99/03/81/1328990381.db2.gz CFUBOQAGPSPFGW-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CC[N@H+](C)C2CCCCC2)[C@H]1CNCCF ZINC001319854196 1329015747 /nfs/dbraw/zinc/01/57/47/1329015747.db2.gz PVJVQYSMDZENOP-AEFFLSMTSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CC[N@@H+](C)C2CCCCC2)[C@H]1CNCCF ZINC001319854196 1329015752 /nfs/dbraw/zinc/01/57/52/1329015752.db2.gz PVJVQYSMDZENOP-AEFFLSMTSA-N 1 3 341.515 2.827 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21)CC1=CCCCC1 ZINC001320058299 1329066147 /nfs/dbraw/zinc/06/61/47/1329066147.db2.gz LWLSPPPLFVWSLC-MOPGFXCFSA-N 1 3 333.520 2.894 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21)CC1=CCCCC1 ZINC001320058299 1329066149 /nfs/dbraw/zinc/06/61/49/1329066149.db2.gz LWLSPPPLFVWSLC-MOPGFXCFSA-N 1 3 333.520 2.894 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H](C)NCc1ccccc1F)[NH+]1CCCCC1 ZINC001491682334 1323787962 /nfs/dbraw/zinc/78/79/62/1323787962.db2.gz LDPIAOIERNUUIF-APWZRJJASA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+][C@@H](C)c1cccc(Cl)c1 ZINC001491685108 1323789937 /nfs/dbraw/zinc/78/99/37/1323789937.db2.gz XRONUPZHKFJBEV-KGLIPLIRSA-N 1 3 325.884 2.836 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NC1c2ccccc2-c2ccccc21 ZINC001491674228 1323821551 /nfs/dbraw/zinc/82/15/51/1323821551.db2.gz SLHBTDJVLFSLNG-HOTGVXAUSA-N 1 3 349.478 2.802 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NC1c2ccccc2-c2ccccc21 ZINC001491674228 1323821555 /nfs/dbraw/zinc/82/15/55/1323821555.db2.gz SLHBTDJVLFSLNG-HOTGVXAUSA-N 1 3 349.478 2.802 10 0 EFAEHO CN(CC(=O)N1CC[C@H](C[NH2+]Cc2ccsc2)C1)CC(C)(C)C ZINC001491835005 1323929429 /nfs/dbraw/zinc/92/94/29/1323929429.db2.gz RSVIBOXEIBHUDQ-OAHLLOKOSA-N 1 3 337.533 2.664 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](C[NH2+]CCCc2ccccc2)C1)N(C)C ZINC001491849820 1323945615 /nfs/dbraw/zinc/94/56/15/1323945615.db2.gz MVHZFGODUQJRLF-UXHICEINSA-N 1 3 345.531 2.644 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]Cc2ccc(Cl)s2)C1 ZINC001491856026 1323950384 /nfs/dbraw/zinc/95/03/84/1323950384.db2.gz NEYVCBCYERZXKK-CYBMUJFWSA-N 1 3 343.924 2.680 10 0 EFAEHO CC[C@H]([NH2+]C[C@H]1CCN(C(=O)CN(C)C(C)C)C1)c1ccccc1 ZINC001491855990 1323950441 /nfs/dbraw/zinc/95/04/41/1323950441.db2.gz MYSJLJOXQLJKFG-MJGOQNOKSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+][C@H](C)c2ccccc2F)C1 ZINC001491857382 1323953326 /nfs/dbraw/zinc/95/33/26/1323953326.db2.gz ZPPJMEKCDZPIHL-HZPDHXFCSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CCNC/C(Cl)=C\Cl ZINC001320416402 1329126967 /nfs/dbraw/zinc/12/69/67/1329126967.db2.gz TXVDQMGIKDQKOX-QGBLLJAOSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CCNC/C(Cl)=C\Cl ZINC001320416402 1329126970 /nfs/dbraw/zinc/12/69/70/1329126970.db2.gz TXVDQMGIKDQKOX-QGBLLJAOSA-N 1 3 336.307 2.663 10 0 EFAEHO C[C@H](F)CC[N@H+](C)[C@H]1CCCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001491924392 1324039714 /nfs/dbraw/zinc/03/97/14/1324039714.db2.gz BXZMOCRZQOIAEV-IRXDYDNUSA-N 1 3 341.515 2.922 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)[C@H]1CCCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001491924392 1324039718 /nfs/dbraw/zinc/03/97/18/1324039718.db2.gz BXZMOCRZQOIAEV-IRXDYDNUSA-N 1 3 341.515 2.922 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@H+](C)CC2CC3(CCC3)C2)C1 ZINC001491964913 1324085457 /nfs/dbraw/zinc/08/54/57/1324085457.db2.gz DHCNTAGIIHZBED-SFHVURJKSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@@H+](C)CC2CC3(CCC3)C2)C1 ZINC001491964913 1324085461 /nfs/dbraw/zinc/08/54/61/1324085461.db2.gz DHCNTAGIIHZBED-SFHVURJKSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc2ncccc2c1)N(C)C ZINC001320463737 1329137634 /nfs/dbraw/zinc/13/76/34/1329137634.db2.gz JBYWQKDEHSFBIF-DNVCBOLYSA-N 1 3 342.487 2.559 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCCC[C@H]2CCC[N@@H+]2CCF)c1 ZINC001492177097 1324315778 /nfs/dbraw/zinc/31/57/78/1324315778.db2.gz CHARJLONRBVXDX-SFHVURJKSA-N 1 3 335.467 2.692 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCCC[C@H]2CCC[N@H+]2CCF)c1 ZINC001492177097 1324315787 /nfs/dbraw/zinc/31/57/87/1324315787.db2.gz CHARJLONRBVXDX-SFHVURJKSA-N 1 3 335.467 2.692 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCN(C)[C@@H]2CCc3c2cccc3F)CC[N@@H+]1C ZINC001492386846 1324469483 /nfs/dbraw/zinc/46/94/83/1324469483.db2.gz QOZJLAKTKICVJV-YZVOILCLSA-N 1 3 347.478 2.591 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCN(C)[C@@H]2CCc3c2cccc3F)CC[N@H+]1C ZINC001492386846 1324469494 /nfs/dbraw/zinc/46/94/94/1324469494.db2.gz QOZJLAKTKICVJV-YZVOILCLSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)NCCCN(C)Cc1ccsc1 ZINC001316832338 1324607517 /nfs/dbraw/zinc/60/75/17/1324607517.db2.gz CBLPWYITICWOLT-QGZVFWFLSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NCCCN(C)Cc1ccsc1 ZINC001316832338 1324607530 /nfs/dbraw/zinc/60/75/30/1324607530.db2.gz CBLPWYITICWOLT-QGZVFWFLSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)NCCCN(C)Cc1ccsc1 ZINC001316853486 1324708455 /nfs/dbraw/zinc/70/84/55/1324708455.db2.gz GFGGYRHFLDGOJV-QGZVFWFLSA-N 1 3 337.533 2.949 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)NCCCN(C)Cc1ccsc1 ZINC001316853486 1324708459 /nfs/dbraw/zinc/70/84/59/1324708459.db2.gz GFGGYRHFLDGOJV-QGZVFWFLSA-N 1 3 337.533 2.949 10 0 EFAEHO CC[C@H](C(=O)N1CCCCC[C@@H]([NH2+]CCCOC(C)C)C1)N(C)C ZINC001316774601 1325046990 /nfs/dbraw/zinc/04/69/90/1325046990.db2.gz VIONIMWIXSJXMO-QZTJIDSGSA-N 1 3 341.540 2.503 10 0 EFAEHO CN(CCCNC(=O)C12CCC[NH+](CCC1)C2)Cc1ccsc1 ZINC001316835582 1325193689 /nfs/dbraw/zinc/19/36/89/1325193689.db2.gz PMDQDLMFVWCVFP-UHFFFAOYSA-N 1 3 335.517 2.562 10 0 EFAEHO CC[C@@H](c1ccccc1)[N@H+](C)CCCNC(=O)Cc1nc[nH]c1C ZINC001316865045 1325235113 /nfs/dbraw/zinc/23/51/13/1325235113.db2.gz QBKSTGPNLRZYDQ-SFHVURJKSA-N 1 3 328.460 2.850 10 0 EFAEHO CC[C@@H](c1ccccc1)[N@@H+](C)CCCNC(=O)Cc1nc[nH]c1C ZINC001316865045 1325235119 /nfs/dbraw/zinc/23/51/19/1325235119.db2.gz QBKSTGPNLRZYDQ-SFHVURJKSA-N 1 3 328.460 2.850 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@H+](C)Cc1ccc(Cl)c(F)c1 ZINC001316870557 1325239905 /nfs/dbraw/zinc/23/99/05/1325239905.db2.gz QHPGUJQZBSWMED-UHFFFAOYSA-N 1 3 343.874 2.757 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC001316870557 1325239911 /nfs/dbraw/zinc/23/99/11/1325239911.db2.gz QHPGUJQZBSWMED-UHFFFAOYSA-N 1 3 343.874 2.757 10 0 EFAEHO CCN(CCCNC(=O)C[NH+]1[C@H](C)CC[C@H]1C)CCC(F)(F)F ZINC001316911684 1325329304 /nfs/dbraw/zinc/32/93/04/1325329304.db2.gz TWLXCDCMLPWVFI-ZIAGYGMSSA-N 1 3 337.430 2.640 10 0 EFAEHO CCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C1CC[NH+](C(C)C)CC1 ZINC001317050966 1325523247 /nfs/dbraw/zinc/52/32/47/1325523247.db2.gz XOSSMZSOISOWOA-KDURUIRLSA-N 1 3 335.536 2.972 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)c(F)c1)C(=O)[C@@H](C(C)C)N(C)C ZINC001320843671 1329309190 /nfs/dbraw/zinc/30/91/90/1329309190.db2.gz INAFCWOWZVJLIZ-GOSISDBHSA-N 1 3 337.483 2.658 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@H](C)[NH+]1CCCCCC1 ZINC001320864677 1329311858 /nfs/dbraw/zinc/31/18/58/1329311858.db2.gz ZRCVUSURUABHCM-INIZCTEOSA-N 1 3 337.533 2.951 10 0 EFAEHO CCN(CC[NH2+]Cc1ccccc1C)C(=O)[C@H]1CCCCN1CC ZINC001320928429 1329320627 /nfs/dbraw/zinc/32/06/27/1329320627.db2.gz KHVCHQUEBJBVQN-LJQANCHMSA-N 1 3 331.504 2.808 10 0 EFAEHO CN(C)C1(C(=O)NC/C=C/C[NH2+]CC2CCC3(CC3)CC2)CCC1 ZINC001321092735 1329341907 /nfs/dbraw/zinc/34/19/07/1329341907.db2.gz RZAXJOISSMTIND-ONEGZZNKSA-N 1 3 333.520 2.703 10 0 EFAEHO CN(CC(=O)NC/C=C\C[NH2+]Cc1cccc(Cl)c1)C1CCC1 ZINC001321094879 1329342265 /nfs/dbraw/zinc/34/22/65/1329342265.db2.gz DALARYWPQLYHHI-IHWYPQMZSA-N 1 3 335.879 2.586 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@@H](C)CNC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001317240834 1327781335 /nfs/dbraw/zinc/78/13/35/1327781335.db2.gz JAIZBJVYAGLFPM-AZUAARDMSA-N 1 3 345.531 2.895 10 0 EFAEHO CC(C)c1ccc(C[NH2+]CCN(C)C(=O)CN(C)C2CCC2)cc1 ZINC001317596841 1328176098 /nfs/dbraw/zinc/17/60/98/1328176098.db2.gz WCXDYSMALXHHHU-UHFFFAOYSA-N 1 3 331.504 2.842 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[NH2+]C[C@@H]2CCCC(F)(F)C2)CC1 ZINC001317643349 1328227289 /nfs/dbraw/zinc/22/72/89/1328227289.db2.gz YQVPODJYEOXYTM-MRXNPFEDSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[N@H+](C)CCC2=CCCCC2)C1)N(C)C ZINC001317857266 1328420782 /nfs/dbraw/zinc/42/07/82/1328420782.db2.gz PLTOAROUSXYEGB-RBUKOAKNSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[N@@H+](C)CCC2=CCCCC2)C1)N(C)C ZINC001317857266 1328420786 /nfs/dbraw/zinc/42/07/86/1328420786.db2.gz PLTOAROUSXYEGB-RBUKOAKNSA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1cccc(CCC[NH2+]C[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001321871004 1329414177 /nfs/dbraw/zinc/41/41/77/1329414177.db2.gz UYXXEHAENWZNOS-KRWDZBQOSA-N 1 3 331.504 2.506 10 0 EFAEHO CN(C)C1(C(=O)N2CCC(C[N@H+](C)CCCCCF)CC2)CCC1 ZINC001317869757 1328429359 /nfs/dbraw/zinc/42/93/59/1328429359.db2.gz GXDHWNRDARMCTJ-UHFFFAOYSA-N 1 3 341.515 2.781 10 0 EFAEHO CN(C)C1(C(=O)N2CCC(C[N@@H+](C)CCCCCF)CC2)CCC1 ZINC001317869757 1328429364 /nfs/dbraw/zinc/42/93/64/1328429364.db2.gz GXDHWNRDARMCTJ-UHFFFAOYSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CCCC[C@@H]1C[NH2+]CCCF)N1CCCCC1 ZINC001322328602 1329447385 /nfs/dbraw/zinc/44/73/85/1329447385.db2.gz CVPCRBZIUOPCFC-SJORKVTESA-N 1 3 341.515 2.875 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+][C@@H]1CCc2c1cccc2F)N(C)C ZINC001322555951 1329467267 /nfs/dbraw/zinc/46/72/67/1329467267.db2.gz XCSHDCMFHPHEFM-MOPGFXCFSA-N 1 3 349.494 2.837 10 0 EFAEHO CN(CCCNCc1c(Cl)cccc1Cl)C(=O)CC[NH+](C)C ZINC001322678391 1329478946 /nfs/dbraw/zinc/47/89/46/1329478946.db2.gz OGUOJTQYGDCEQJ-UHFFFAOYSA-N 1 3 346.302 2.883 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001322756450 1329485469 /nfs/dbraw/zinc/48/54/69/1329485469.db2.gz NCNMLCRAWOHFCX-CEXWTWQISA-N 1 3 335.536 2.593 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001323639409 1329557716 /nfs/dbraw/zinc/55/77/16/1329557716.db2.gz ZIUHTZSUXAIZMF-JXCVUKRWSA-N 1 3 344.503 2.869 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@H](C2CCN(C(=O)Cc3c[nH]cn3)CC2)C1 ZINC001323639409 1329557718 /nfs/dbraw/zinc/55/77/18/1329557718.db2.gz ZIUHTZSUXAIZMF-JXCVUKRWSA-N 1 3 344.503 2.869 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C(C)C)N(C)C ZINC001323683855 1329561244 /nfs/dbraw/zinc/56/12/44/1329561244.db2.gz HOOWDHVCRQONGS-WYBNUAJGSA-N 1 3 335.536 2.994 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C(C)C)N(C)C ZINC001323683855 1329561246 /nfs/dbraw/zinc/56/12/46/1329561246.db2.gz HOOWDHVCRQONGS-WYBNUAJGSA-N 1 3 335.536 2.994 10 0 EFAEHO CCCCC[N@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001323720617 1329564629 /nfs/dbraw/zinc/56/46/29/1329564629.db2.gz QBOLVRZRRIQJQE-IBGZPJMESA-N 1 3 335.536 2.974 10 0 EFAEHO CCCCC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001323720617 1329564630 /nfs/dbraw/zinc/56/46/30/1329564630.db2.gz QBOLVRZRRIQJQE-IBGZPJMESA-N 1 3 335.536 2.974 10 0 EFAEHO CN(CC(=O)N1CC[C@@]2(CC[N@H+](CCCCCF)C2)C1)C1CCC1 ZINC001323859349 1329579812 /nfs/dbraw/zinc/57/98/12/1329579812.db2.gz VTDYFDUBRQGBEO-LJQANCHMSA-N 1 3 339.499 2.535 10 0 EFAEHO CN(CC(=O)N1CC[C@@]2(CC[N@@H+](CCCCCF)C2)C1)C1CCC1 ZINC001323859349 1329579815 /nfs/dbraw/zinc/57/98/15/1329579815.db2.gz VTDYFDUBRQGBEO-LJQANCHMSA-N 1 3 339.499 2.535 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001324226771 1329609545 /nfs/dbraw/zinc/60/95/45/1329609545.db2.gz VHKBQDKAJQQCNP-VQIMIIECSA-N 1 3 341.515 2.826 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@]1(C)CCN(CCc2ccccc2F)C1 ZINC001324669795 1329650086 /nfs/dbraw/zinc/65/00/86/1329650086.db2.gz RECMRTXHODSTEF-HXUWFJFHSA-N 1 3 349.494 2.681 10 0 EFAEHO C[C@@H](NC(=O)CC1CC[NH+](C)CC1)[C@H](C)NCC=C(Cl)Cl ZINC001381446297 1348280996 /nfs/dbraw/zinc/28/09/96/1348280996.db2.gz WQTYBPXVJLIGEN-NWDGAFQWSA-N 1 3 336.307 2.520 10 0 EFAEHO CCc1ccccc1[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NCC=C(C)C ZINC001325366331 1329683229 /nfs/dbraw/zinc/68/32/29/1329683229.db2.gz MPVBVRYMGMAQFG-UYAOXDASSA-N 1 3 343.515 2.914 10 0 EFAEHO CCc1ccccc1[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NCC=C(C)C ZINC001325366331 1329683231 /nfs/dbraw/zinc/68/32/31/1329683231.db2.gz MPVBVRYMGMAQFG-UYAOXDASSA-N 1 3 343.515 2.914 10 0 EFAEHO CCc1ccccc1[C@@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NCC=C(C)C ZINC001325366325 1329683276 /nfs/dbraw/zinc/68/32/76/1329683276.db2.gz MPVBVRYMGMAQFG-AZUAARDMSA-N 1 3 343.515 2.914 10 0 EFAEHO CCc1ccccc1[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NCC=C(C)C ZINC001325366325 1329683278 /nfs/dbraw/zinc/68/32/78/1329683278.db2.gz MPVBVRYMGMAQFG-AZUAARDMSA-N 1 3 343.515 2.914 10 0 EFAEHO CCC/C=C\CC[N@H+]1C[C@H]2CN(C(=O)[C@H](C(C)C)N(C)C)C[C@H]2C1 ZINC001325753977 1329710999 /nfs/dbraw/zinc/71/09/99/1329710999.db2.gz PARDWYKRQNKXKQ-ATESFJAQSA-N 1 3 335.536 2.709 10 0 EFAEHO CCC/C=C\CC[N@@H+]1C[C@H]2CN(C(=O)[C@H](C(C)C)N(C)C)C[C@H]2C1 ZINC001325753977 1329711000 /nfs/dbraw/zinc/71/10/00/1329711000.db2.gz PARDWYKRQNKXKQ-ATESFJAQSA-N 1 3 335.536 2.709 10 0 EFAEHO CC[C@H](F)CN1CC[C@@H]2[C@H]1CCCN2C(=O)CCCC[NH+](C)C ZINC001325923161 1329725463 /nfs/dbraw/zinc/72/54/63/1329725463.db2.gz VKBJIUSUTCFGKZ-GVDBMIGSSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@H](F)CN1CC[C@H]2[C@@H]1CCCN2C(=O)CCCC[NH+](C)C ZINC001325923163 1329725498 /nfs/dbraw/zinc/72/54/98/1329725498.db2.gz VKBJIUSUTCFGKZ-ULQDDVLXSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@H](F)CN1CC[C@H]2[C@H]1CCCN2C(=O)CCCC[NH+](C)C ZINC001325923159 1329725554 /nfs/dbraw/zinc/72/55/54/1329725554.db2.gz VKBJIUSUTCFGKZ-BBWFWOEESA-N 1 3 327.488 2.532 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@H]3CCCN3C)C2)c1 ZINC001326225825 1329740327 /nfs/dbraw/zinc/74/03/27/1329740327.db2.gz WXVVUGGDGYARLC-UYAOXDASSA-N 1 3 343.515 2.671 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC[C@H]1CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001326369784 1329750764 /nfs/dbraw/zinc/75/07/64/1329750764.db2.gz MSWISKPVQWJTMS-KRWDZBQOSA-N 1 3 340.471 2.597 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](CC[NH2+]CC2CC(C)(C)C2)C1)N(C)C ZINC001326417282 1329754621 /nfs/dbraw/zinc/75/46/21/1329754621.db2.gz BJTFONQJZQBBKN-WMZOPIPTSA-N 1 3 337.552 2.837 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@@H](CC[NH2+]C/C=C/Cl)C2)c1 ZINC001326440034 1329757070 /nfs/dbraw/zinc/75/70/70/1329757070.db2.gz YWRDZUDBVGXSST-VCIFKONDSA-N 1 3 349.906 2.943 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](C)CN(C)C(=O)CN1CC[C@@H](C)C1 ZINC001382112351 1348732764 /nfs/dbraw/zinc/73/27/64/1348732764.db2.gz AKJITKVBGWLBKA-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1C[C@H]([NH2+]C/C=C/Cl)C(C)(C)C1 ZINC001382368672 1348919383 /nfs/dbraw/zinc/91/93/83/1348919383.db2.gz LOIORKWJVHJBAB-FEPMCFLQSA-N 1 3 341.927 2.828 10 0 EFAEHO CCN1CCN(c2ccc(NC(=O)c3ccc(C[NH3+])cc3)cc2)CC1 ZINC001326748671 1330358358 /nfs/dbraw/zinc/35/83/58/1330358358.db2.gz GTAUBWBCMLIGAQ-UHFFFAOYSA-N 1 3 338.455 2.540 10 0 EFAEHO CC/C=C\CCN1Cc2ccc(CNC(=O)[C@H]3CC[N@H+](C)C3)cc2C1 ZINC001327694968 1330509879 /nfs/dbraw/zinc/50/98/79/1330509879.db2.gz FCNQUQOSKGSCCF-HMECNJMJSA-N 1 3 341.499 2.926 10 0 EFAEHO CC/C=C\CCN1Cc2ccc(CNC(=O)[C@H]3CC[N@@H+](C)C3)cc2C1 ZINC001327694968 1330509880 /nfs/dbraw/zinc/50/98/80/1330509880.db2.gz FCNQUQOSKGSCCF-HMECNJMJSA-N 1 3 341.499 2.926 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCCC[C@H]2C[NH2+]CCc2cccs2)C1 ZINC001328643663 1330611459 /nfs/dbraw/zinc/61/14/59/1330611459.db2.gz FWGIEDPSHPHMRW-SJORKVTESA-N 1 3 349.544 2.603 10 0 EFAEHO CC[C@H](C(=O)NC1(C[NH2+]CCc2ccccc2)CCCCC1)N(C)C ZINC001329828417 1330741067 /nfs/dbraw/zinc/74/10/67/1330741067.db2.gz DEALSMDBQPTJFN-LJQANCHMSA-N 1 3 345.531 2.978 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)[C@@H](C[NH2+]CCC(F)(F)F)C1CC1 ZINC001331289934 1330816704 /nfs/dbraw/zinc/81/67/04/1330816704.db2.gz OJFOFZMYSXUBIK-CABCVRRESA-N 1 3 349.441 2.640 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)[C@H](C[NH2+]CCC(F)(F)F)C1CC1 ZINC001331289940 1330816971 /nfs/dbraw/zinc/81/69/71/1330816971.db2.gz OJFOFZMYSXUBIK-LSDHHAIUSA-N 1 3 349.441 2.640 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+]CCc2ccccc2)C(C)(C)C)CCC1 ZINC001332807436 1331028971 /nfs/dbraw/zinc/02/89/71/1331028971.db2.gz PHBHOWXLEPGFIR-SFHVURJKSA-N 1 3 345.531 2.834 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C[NH2+]CC=C(Cl)Cl)C(C)(C)C ZINC001332893076 1331035742 /nfs/dbraw/zinc/03/57/42/1331035742.db2.gz OAAISHIQMAREHW-LBPRGKRZSA-N 1 3 338.323 2.768 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC2=CC[N@H+](CC3CC(C)(C)C3)CC2)C1 ZINC001333405263 1331135956 /nfs/dbraw/zinc/13/59/56/1331135956.db2.gz GRCFZJWAOVHOOI-INIZCTEOSA-N 1 3 333.520 2.513 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC2=CC[N@@H+](CC3CC(C)(C)C3)CC2)C1 ZINC001333405263 1331135959 /nfs/dbraw/zinc/13/59/59/1331135959.db2.gz GRCFZJWAOVHOOI-INIZCTEOSA-N 1 3 333.520 2.513 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=S)Nc1cccc(F)c1F ZINC001346686883 1332672979 /nfs/dbraw/zinc/67/29/79/1332672979.db2.gz FOLFZKNIHXWHAW-LBPRGKRZSA-N 1 3 344.475 2.523 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=S)Nc1cccc(F)c1F ZINC001346686883 1332672984 /nfs/dbraw/zinc/67/29/84/1332672984.db2.gz FOLFZKNIHXWHAW-LBPRGKRZSA-N 1 3 344.475 2.523 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C1CC1)[C@H]1CCc2ccccc21)N(C)C ZINC001479876428 1332689420 /nfs/dbraw/zinc/68/94/20/1332689420.db2.gz MSJFONBCXALSPE-PMACEKPBSA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C1CC1)[C@H]1CCc2ccccc21)N(C)C ZINC001479876428 1332689423 /nfs/dbraw/zinc/68/94/23/1332689423.db2.gz MSJFONBCXALSPE-PMACEKPBSA-N 1 3 343.515 2.985 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)CCC[Si](C)(C)C)CC2)CC1 ZINC000847409784 1333673859 /nfs/dbraw/zinc/67/38/59/1333673859.db2.gz UAMYMIVOSXHMPN-UHFFFAOYSA-N 1 3 339.600 2.780 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](CNCc2c(F)ccc(C3OCCO3)c2Cl)C1 ZINC000848562386 1334796252 /nfs/dbraw/zinc/79/62/52/1334796252.db2.gz IYLKDLRMYDKWOU-TXEJJXNPSA-N 1 3 342.842 2.954 10 0 EFAEHO [NH2+]=C(NCCCN1CCc2ccccc2C1)NCCc1cccs1 ZINC000849063072 1335064535 /nfs/dbraw/zinc/06/45/35/1335064535.db2.gz UJRAEVYNYJDZKL-UHFFFAOYSA-N 1 3 342.512 2.853 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C[C@@H]1C ZINC001408188528 1369694982 /nfs/dbraw/zinc/69/49/82/1369694982.db2.gz QIFITRLCTSTSFV-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C[C@@H]1C ZINC001408188528 1369694993 /nfs/dbraw/zinc/69/49/93/1369694993.db2.gz QIFITRLCTSTSFV-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO C[N@@H+]1C[C@@]23CN(CCC(=O)NCC4CCCCC4)C[C@]2(C1)CCCC3 ZINC001414058670 1335550183 /nfs/dbraw/zinc/55/01/83/1335550183.db2.gz LIOLTZWWGZUREZ-OYRHEFFESA-N 1 3 347.547 2.881 10 0 EFAEHO C[N@H+]1C[C@@]23CN(CCC(=O)NCC4CCCCC4)C[C@]2(C1)CCCC3 ZINC001414058670 1335550186 /nfs/dbraw/zinc/55/01/86/1335550186.db2.gz LIOLTZWWGZUREZ-OYRHEFFESA-N 1 3 347.547 2.881 10 0 EFAEHO C[C@H]1C[C@H](CN2Cc3ccc(NC(=O)C(F)(F)F)cc3C2)CC[NH2+]1 ZINC000849349502 1335596964 /nfs/dbraw/zinc/59/69/64/1335596964.db2.gz BNMZMOMSWJXCQW-NWDGAFQWSA-N 1 3 341.377 2.891 10 0 EFAEHO C[C@@H]1CCC[C@@](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)([NH+](C)C)C1 ZINC001361673503 1336262421 /nfs/dbraw/zinc/26/24/21/1336262421.db2.gz IPZBWEUTSXKVDU-LZQZEXGQSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H]1CCC[C@@](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)([NH+](C)C)C1 ZINC001361673485 1336262536 /nfs/dbraw/zinc/26/25/36/1336262536.db2.gz IPZBWEUTSXKVDU-ATZDWAIDSA-N 1 3 341.515 2.826 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)N(C)C)cc1 ZINC001361728648 1336299669 /nfs/dbraw/zinc/29/96/69/1336299669.db2.gz ZVBPNIUMOKBXMS-UFYCRDLUSA-N 1 3 343.515 2.985 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)N(C)C)cc1 ZINC001361728648 1336299673 /nfs/dbraw/zinc/29/96/73/1336299673.db2.gz ZVBPNIUMOKBXMS-UFYCRDLUSA-N 1 3 343.515 2.985 10 0 EFAEHO CN(C)[C@@H](CNC(=O)c1ccc(C[NH+]2CCCC2)o1)c1ccsc1 ZINC001361779963 1336330868 /nfs/dbraw/zinc/33/08/68/1336330868.db2.gz FNSXOCLKOWAMFU-INIZCTEOSA-N 1 3 347.484 2.970 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@H](C(=O)N(CCN(C)C)Cc3ccccc3)C[N@@H+]2C1 ZINC001361879142 1336392979 /nfs/dbraw/zinc/39/29/79/1336392979.db2.gz DMGWPKKNCRFCKO-YZGWKJHDSA-N 1 3 343.515 2.697 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@H](C(=O)N(CCN(C)C)Cc3ccccc3)C[N@H+]2C1 ZINC001361879142 1336392981 /nfs/dbraw/zinc/39/29/81/1336392981.db2.gz DMGWPKKNCRFCKO-YZGWKJHDSA-N 1 3 343.515 2.697 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N(CCN(C)C)c3ccccc3)C[N@@H+]2C1 ZINC001361951551 1336434416 /nfs/dbraw/zinc/43/44/16/1336434416.db2.gz HBSNMUGYHPPUIH-AOIWGVFYSA-N 1 3 329.488 2.702 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N(CCN(C)C)c3ccccc3)C[N@H+]2C1 ZINC001361951551 1336434418 /nfs/dbraw/zinc/43/44/18/1336434418.db2.gz HBSNMUGYHPPUIH-AOIWGVFYSA-N 1 3 329.488 2.702 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)NC[C@@H](C)N(C)Cc2ccccc2)CC1 ZINC001361966678 1336443620 /nfs/dbraw/zinc/44/36/20/1336443620.db2.gz IBZRQTYBOSLNGM-GOSISDBHSA-N 1 3 345.531 2.991 10 0 EFAEHO CN1CCC(N(Cc2ccco2)C(=O)[C@H]2CCC[C@@H]([NH+](C)C)C2)CC1 ZINC001362119742 1336511742 /nfs/dbraw/zinc/51/17/42/1336511742.db2.gz SKALGHIKGVWXDF-FUHWJXTLSA-N 1 3 347.503 2.823 10 0 EFAEHO C[C@H](C(=O)NC1CCN(C2CC[NH+](C)CC2)CC1)[C@H](C)C(C)(C)C ZINC001362172604 1336537837 /nfs/dbraw/zinc/53/78/37/1336537837.db2.gz QLIJEELWBUMGHA-HOTGVXAUSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@H]([C@H](C)C(=O)NC1CCN(C2CC[NH+](C)CC2)CC1)C(C)(C)C ZINC001362172610 1336538084 /nfs/dbraw/zinc/53/80/84/1336538084.db2.gz QLIJEELWBUMGHA-JKSUJKDBSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@@H](CC[NH+](C)C)C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC001362230897 1336564846 /nfs/dbraw/zinc/56/48/46/1336564846.db2.gz UDVZDOYKURHLME-ROUUACIJSA-N 1 3 331.504 2.697 10 0 EFAEHO CC[N@@H+]1CCCC[C@H]1CNC(=O)c1ccc(NC2=NCCC2)cc1 ZINC001362276961 1336584374 /nfs/dbraw/zinc/58/43/74/1336584374.db2.gz MQMWOFBSSUHRSL-KRWDZBQOSA-N 1 3 328.460 2.895 10 0 EFAEHO CC[N@H+]1CCCC[C@H]1CNC(=O)c1ccc(NC2=NCCC2)cc1 ZINC001362276961 1336584377 /nfs/dbraw/zinc/58/43/77/1336584377.db2.gz MQMWOFBSSUHRSL-KRWDZBQOSA-N 1 3 328.460 2.895 10 0 EFAEHO CN1CCCC(C)(C)[C@@H]1CNC(=O)c1cccc(CC[NH+](C)C)c1 ZINC001362493853 1336632581 /nfs/dbraw/zinc/63/25/81/1336632581.db2.gz LFRXNLVSFXSHAF-SFHVURJKSA-N 1 3 331.504 2.641 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)CC[N@@H+]1C ZINC001362709448 1336712897 /nfs/dbraw/zinc/71/28/97/1336712897.db2.gz YWGGZCPNVCAVPW-SLFFLAALSA-N 1 3 345.531 2.990 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)CC[N@H+]1C ZINC001362709448 1336712900 /nfs/dbraw/zinc/71/29/00/1336712900.db2.gz YWGGZCPNVCAVPW-SLFFLAALSA-N 1 3 345.531 2.990 10 0 EFAEHO COc1cc(CN(C)C)ccc1NC(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001363217502 1336838792 /nfs/dbraw/zinc/83/87/92/1336838792.db2.gz LIGPXVQHSLFDIB-HOTGVXAUSA-N 1 3 333.476 2.816 10 0 EFAEHO CCC[N@H+](CC)Cc1ccc(C(=O)N[C@H]2CN(C)CC2(C)C)cc1 ZINC001363589334 1336943404 /nfs/dbraw/zinc/94/34/04/1336943404.db2.gz AWLCOUZWTDWKLK-SFHVURJKSA-N 1 3 331.504 2.989 10 0 EFAEHO CCC[N@@H+](CC)Cc1ccc(C(=O)N[C@H]2CN(C)CC2(C)C)cc1 ZINC001363589334 1336943406 /nfs/dbraw/zinc/94/34/06/1336943406.db2.gz AWLCOUZWTDWKLK-SFHVURJKSA-N 1 3 331.504 2.989 10 0 EFAEHO CC[NH+]1CCC(C(=O)NC[C@@H]2CCCCN2C)(c2ccccc2)CC1 ZINC001363654080 1336975351 /nfs/dbraw/zinc/97/53/51/1336975351.db2.gz NWNXDQYOJZAJHY-IBGZPJMESA-N 1 3 343.515 2.641 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)N[C@]2(C)CCN(Cc3ccccc3)C2)C1 ZINC001363771071 1337034201 /nfs/dbraw/zinc/03/42/01/1337034201.db2.gz HSUZCEVAHNLILW-QKNQBKEWSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](CCN2CC3(CCCC3)OC[C@@H]2CN(C)C)C1 ZINC001363810988 1337062432 /nfs/dbraw/zinc/06/24/32/1337062432.db2.gz UIEZOAKGRPCHCF-QRVBRYPASA-N 1 3 337.552 2.540 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](CCN2CC3(CCCC3)OC[C@@H]2CN(C)C)C1 ZINC001363810962 1337062614 /nfs/dbraw/zinc/06/26/14/1337062614.db2.gz UIEZOAKGRPCHCF-OTWHNJEPSA-N 1 3 337.552 2.540 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](CCN2CC3(CCCC3)OC[C@@H]2CN(C)C)C1 ZINC001363810962 1337062618 /nfs/dbraw/zinc/06/26/18/1337062618.db2.gz UIEZOAKGRPCHCF-OTWHNJEPSA-N 1 3 337.552 2.540 10 0 EFAEHO C[C@H](CN1CCOCC1)CN1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC001364344456 1337184458 /nfs/dbraw/zinc/18/44/58/1337184458.db2.gz JJVDBODKTCLTNA-VAMGGRTRSA-N 1 3 337.552 2.541 10 0 EFAEHO C[C@H](CN1CCOCC1)CN1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC001364344456 1337184459 /nfs/dbraw/zinc/18/44/59/1337184459.db2.gz JJVDBODKTCLTNA-VAMGGRTRSA-N 1 3 337.552 2.541 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1 ZINC001364609723 1337195783 /nfs/dbraw/zinc/19/57/83/1337195783.db2.gz UJVZJZLDVXBSOS-XLIONFOSSA-N 1 3 346.519 2.681 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCCN(CC2CC(F)(F)C2)C1)[NH+](CC)CC ZINC001365942208 1337273323 /nfs/dbraw/zinc/27/33/23/1337273323.db2.gz KQPMQHDDYCPBNX-HZPDHXFCSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1cc(C)c(C[N@H+]2CC[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c(C)c1 ZINC001365985948 1337302506 /nfs/dbraw/zinc/30/25/06/1337302506.db2.gz QXJHIYHSFKHXAC-UYAOXDASSA-N 1 3 345.531 2.889 10 0 EFAEHO Cc1cc(C)c(C[N@@H+]2CC[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c(C)c1 ZINC001365985948 1337302510 /nfs/dbraw/zinc/30/25/10/1337302510.db2.gz QXJHIYHSFKHXAC-UYAOXDASSA-N 1 3 345.531 2.889 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC12CC[NH+](CC1CCCCC1)CC2)N(C)C ZINC001366016039 1337325254 /nfs/dbraw/zinc/32/52/54/1337325254.db2.gz JXTUTBDOHHBFIL-QZTJIDSGSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC12CC[NH+](CC1CCCCC1)CC2)N(C)C ZINC001366016036 1337325640 /nfs/dbraw/zinc/32/56/40/1337325640.db2.gz JXTUTBDOHHBFIL-MSOLQXFVSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC12CC[NH+](Cc1cccc(F)c1)CC2)N(C)C ZINC001366024180 1337331242 /nfs/dbraw/zinc/33/12/42/1337331242.db2.gz ZHPONHIBHBRRQM-QZTJIDSGSA-N 1 3 347.478 2.637 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@H](NCC=C(Cl)Cl)C2CC2)CC[N@@H+]1C ZINC001366046180 1337344730 /nfs/dbraw/zinc/34/47/30/1337344730.db2.gz AVLHKTHINCGLFV-UBHSHLNASA-N 1 3 348.318 2.520 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@H](NCC=C(Cl)Cl)C2CC2)CC[N@H+]1C ZINC001366046180 1337344735 /nfs/dbraw/zinc/34/47/35/1337344735.db2.gz AVLHKTHINCGLFV-UBHSHLNASA-N 1 3 348.318 2.520 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001366055079 1337350994 /nfs/dbraw/zinc/35/09/94/1337350994.db2.gz BOKOAKSBSVEIRE-LJQANCHMSA-N 1 3 331.504 2.628 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]([NH2+]Cc1ccccc1)C1CC1)N1CCCCCC1 ZINC001366071254 1337363855 /nfs/dbraw/zinc/36/38/55/1337363855.db2.gz YPMFRBJGSVHVLX-PXNSSMCTSA-N 1 3 343.515 2.936 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366077926 1337369356 /nfs/dbraw/zinc/36/93/56/1337369356.db2.gz XRJFSCHAUZBLJN-QZTJIDSGSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366077926 1337369360 /nfs/dbraw/zinc/36/93/60/1337369360.db2.gz XRJFSCHAUZBLJN-QZTJIDSGSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[N@H+]1[C@H](C)CC[C@@H]1C ZINC001366084265 1337373841 /nfs/dbraw/zinc/37/38/41/1337373841.db2.gz UZFSAGYZHNGSMX-QGFMHUBQSA-N 1 3 335.536 2.971 10 0 EFAEHO CC(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001366084265 1337373842 /nfs/dbraw/zinc/37/38/42/1337373842.db2.gz UZFSAGYZHNGSMX-QGFMHUBQSA-N 1 3 335.536 2.971 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001366114621 1337384746 /nfs/dbraw/zinc/38/47/46/1337384746.db2.gz CVTYUWODZBUOCJ-XUXIUFHCSA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001366114621 1337384750 /nfs/dbraw/zinc/38/47/50/1337384750.db2.gz CVTYUWODZBUOCJ-XUXIUFHCSA-N 1 3 346.302 2.559 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C1)C1CCC1 ZINC001366146474 1337401673 /nfs/dbraw/zinc/40/16/73/1337401673.db2.gz BFBOCSCJXHBQBM-KDURUIRLSA-N 1 3 341.499 2.785 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H](NC(=O)C2(C[NH+](C)C)CC2)C1)c1ccccc1Cl ZINC001366155993 1337405887 /nfs/dbraw/zinc/40/58/87/1337405887.db2.gz OIUCTAHSNVZHLC-SOUVJXGZSA-N 1 3 349.906 2.980 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(CF)cc2)C1)CC(C)(C)C ZINC001366158594 1337406719 /nfs/dbraw/zinc/40/67/19/1337406719.db2.gz GVOWEJJNNLGUTD-HDICACEKSA-N 1 3 349.494 2.871 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccccc2C2CC2)C1)N(C)C ZINC001366163320 1337409074 /nfs/dbraw/zinc/40/90/74/1337409074.db2.gz RTKXFNJSJXTYEY-ZIFCJYIRSA-N 1 3 329.488 2.641 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc(OC(C)C)c2)C1)N(C)C ZINC001366168061 1337411773 /nfs/dbraw/zinc/41/17/73/1337411773.db2.gz HAWOMXGDTUKCJM-SCTDSRPQSA-N 1 3 347.503 2.551 10 0 EFAEHO Cc1cc(C[N@H+]2CCC[C@H](CNC(=O)CN(C)C(C)C)C2)cs1 ZINC001366186283 1337426693 /nfs/dbraw/zinc/42/66/93/1337426693.db2.gz NBEDJCKRGIQJED-MRXNPFEDSA-N 1 3 337.533 2.725 10 0 EFAEHO Cc1cc(C[N@@H+]2CCC[C@H](CNC(=O)CN(C)C(C)C)C2)cs1 ZINC001366186283 1337426695 /nfs/dbraw/zinc/42/66/95/1337426695.db2.gz NBEDJCKRGIQJED-MRXNPFEDSA-N 1 3 337.533 2.725 10 0 EFAEHO Cc1ccc(CC[N@H+]2CCC[C@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001366188856 1337428683 /nfs/dbraw/zinc/42/86/83/1337428683.db2.gz WJJOQLOXRZIGMC-HXUWFJFHSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CC[N@@H+]2CCC[C@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001366188856 1337428686 /nfs/dbraw/zinc/42/86/86/1337428686.db2.gz WJJOQLOXRZIGMC-HXUWFJFHSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[NH2+][C@H]2CCc3ccccc32)C1 ZINC001366199129 1337436473 /nfs/dbraw/zinc/43/64/73/1337436473.db2.gz AILQRKGGVJYNQI-PXNSSMCTSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[NH2+][C@H]2CCc3ccccc32)C1 ZINC001366199142 1337436734 /nfs/dbraw/zinc/43/67/34/1337436734.db2.gz AILQRKGGVJYNQI-XLIONFOSSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CCCC[C@@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001366214449 1337449742 /nfs/dbraw/zinc/44/97/42/1337449742.db2.gz SXZWAUDUDWDVSC-JKSUJKDBSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](F)CC[N@H+]1CCCC[C@@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001366214449 1337449746 /nfs/dbraw/zinc/44/97/46/1337449746.db2.gz SXZWAUDUDWDVSC-JKSUJKDBSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001366285532 1337490858 /nfs/dbraw/zinc/49/08/58/1337490858.db2.gz JOOJTMKJDKHLGO-HNNXBMFYSA-N 1 3 329.488 2.643 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001366312001 1337505536 /nfs/dbraw/zinc/50/55/36/1337505536.db2.gz QDOUAGYUKAPBRY-LSDHHAIUSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+][C@H]2CCc3ccc(F)cc32)C1 ZINC001366407644 1337563061 /nfs/dbraw/zinc/56/30/61/1337563061.db2.gz JDVNLZRYOOJVJO-KXBFYZLASA-N 1 3 347.478 2.591 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([N@H+](C)[C@@H]2CCc3ccccc32)C1 ZINC001366423920 1337573836 /nfs/dbraw/zinc/57/38/36/1337573836.db2.gz AATCBEQBHYZZET-AZUAARDMSA-N 1 3 343.515 2.939 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([N@@H+](C)[C@@H]2CCc3ccccc32)C1 ZINC001366423920 1337573839 /nfs/dbraw/zinc/57/38/39/1337573839.db2.gz AATCBEQBHYZZET-AZUAARDMSA-N 1 3 343.515 2.939 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@H+](C)Cc2cccc(F)c2)C1 ZINC001366424022 1337573961 /nfs/dbraw/zinc/57/39/61/1337573961.db2.gz ALPVTIMTQNZASE-GOSISDBHSA-N 1 3 335.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@@H+](C)Cc2cccc(F)c2)C1 ZINC001366424022 1337573965 /nfs/dbraw/zinc/57/39/65/1337573965.db2.gz ALPVTIMTQNZASE-GOSISDBHSA-N 1 3 335.467 2.589 10 0 EFAEHO CC(C)[NH2+]CCc1ccc(CNC(=O)CN2[C@H](C)CC[C@H]2C)cc1 ZINC001366423810 1337574426 /nfs/dbraw/zinc/57/44/26/1337574426.db2.gz WCLWBUVOTWOITE-IAGOWNOFSA-N 1 3 331.504 2.716 10 0 EFAEHO Cc1cc(C[N@@H+](C)[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001366435884 1337585903 /nfs/dbraw/zinc/58/59/03/1337585903.db2.gz UVHHGZCXFIXCGH-QGZVFWFLSA-N 1 3 337.533 2.820 10 0 EFAEHO Cc1cc(C[N@H+](C)[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001366435884 1337585904 /nfs/dbraw/zinc/58/59/04/1337585904.db2.gz UVHHGZCXFIXCGH-QGZVFWFLSA-N 1 3 337.533 2.820 10 0 EFAEHO C[C@@H](CCNC(=O)CN(C)C1CCC1)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001366469632 1337612619 /nfs/dbraw/zinc/61/26/19/1337612619.db2.gz GSUBJTDSWXUITF-HNNXBMFYSA-N 1 3 342.487 2.637 10 0 EFAEHO C[C@@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+]CC1CCC2(CC2)CC1 ZINC001366473472 1337616219 /nfs/dbraw/zinc/61/62/19/1337616219.db2.gz LPGGKQZYAKOMCP-INIZCTEOSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+][C@H]1CCCc2ccccc21 ZINC001366512896 1337653718 /nfs/dbraw/zinc/65/37/18/1337653718.db2.gz PONOUZOFCQNOII-APWZRJJASA-N 1 3 331.504 2.889 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC[N@H+](C)CC1CCC(F)(F)CC1 ZINC001366592687 1337729955 /nfs/dbraw/zinc/72/99/55/1337729955.db2.gz NVWICLOWTOOIPN-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC[N@@H+](C)CC1CCC(F)(F)CC1 ZINC001366592687 1337729956 /nfs/dbraw/zinc/72/99/56/1337729956.db2.gz NVWICLOWTOOIPN-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCN(C)[C@@H](C)c1ccccc1)[NH+]1CCCC1 ZINC001366597737 1337735253 /nfs/dbraw/zinc/73/52/53/1337735253.db2.gz UFCNOHUSVPADNH-HKUYNNGSSA-N 1 3 331.504 2.916 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@H+](Cc2c(C)cccc2C)C1)N(C)C ZINC001366698148 1337883752 /nfs/dbraw/zinc/88/37/52/1337883752.db2.gz PVAYITRBCJASJG-IEBWSBKVSA-N 1 3 331.504 2.582 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@@H+](Cc2c(C)cccc2C)C1)N(C)C ZINC001366698148 1337883758 /nfs/dbraw/zinc/88/37/58/1337883758.db2.gz PVAYITRBCJASJG-IEBWSBKVSA-N 1 3 331.504 2.582 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCN(Cc2ccsc2)C1 ZINC001366701305 1337889602 /nfs/dbraw/zinc/88/96/02/1337889602.db2.gz KIKGZENOAJCYHI-NVXWUHKLSA-N 1 3 335.517 2.561 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCN(Cc2ccsc2)C1 ZINC001366701305 1337889605 /nfs/dbraw/zinc/88/96/05/1337889605.db2.gz KIKGZENOAJCYHI-NVXWUHKLSA-N 1 3 335.517 2.561 10 0 EFAEHO CCc1ccccc1C[N@H+]1CC[C@@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001366702360 1337891668 /nfs/dbraw/zinc/89/16/68/1337891668.db2.gz DJLCBESPBJJNFU-QFBILLFUSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CC[C@@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001366702360 1337891673 /nfs/dbraw/zinc/89/16/73/1337891673.db2.gz DJLCBESPBJJNFU-QFBILLFUSA-N 1 3 331.504 2.527 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCN(Cc2ccccc2F)C1 ZINC001366703559 1337893741 /nfs/dbraw/zinc/89/37/41/1337893741.db2.gz OXCBPMDJJODWHV-AEFFLSMTSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCN(Cc2ccccc2F)C1 ZINC001366703559 1337893747 /nfs/dbraw/zinc/89/37/47/1337893747.db2.gz OXCBPMDJJODWHV-AEFFLSMTSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+]([C@H](C)c2ccc(F)cc2)C1 ZINC001366710753 1337905869 /nfs/dbraw/zinc/90/58/69/1337905869.db2.gz KLUKCWZPXKUJHR-HZPDHXFCSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+]([C@H](C)c2ccc(F)cc2)C1 ZINC001366710753 1337905874 /nfs/dbraw/zinc/90/58/74/1337905874.db2.gz KLUKCWZPXKUJHR-HZPDHXFCSA-N 1 3 335.467 2.665 10 0 EFAEHO CCC[N@H+](CCNC(=O)[C@@H](CC)N(C)C)[C@H]1CCc2ccccc21 ZINC001366730543 1337937732 /nfs/dbraw/zinc/93/77/32/1337937732.db2.gz BPYUZRPASKNXOF-MOPGFXCFSA-N 1 3 331.504 2.842 10 0 EFAEHO CCC[N@@H+](CCNC(=O)[C@@H](CC)N(C)C)[C@H]1CCc2ccccc21 ZINC001366730543 1337937736 /nfs/dbraw/zinc/93/77/36/1337937736.db2.gz BPYUZRPASKNXOF-MOPGFXCFSA-N 1 3 331.504 2.842 10 0 EFAEHO Cc1ccccc1CN(CCNC(=O)CC[C@@H]1CCC[N@H+]1C)C1CC1 ZINC001366738097 1337946708 /nfs/dbraw/zinc/94/67/08/1337946708.db2.gz AGCAXTFJIWNZMU-IBGZPJMESA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccccc1CN(CCNC(=O)CC[C@@H]1CCC[N@@H+]1C)C1CC1 ZINC001366738097 1337946709 /nfs/dbraw/zinc/94/67/09/1337946709.db2.gz AGCAXTFJIWNZMU-IBGZPJMESA-N 1 3 343.515 2.950 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@H+](C[C@H]1CCCC(F)(F)C1)C1CC1)N(C)C ZINC001366751236 1337965847 /nfs/dbraw/zinc/96/58/47/1337965847.db2.gz KZZMUVTWUOXTPP-HOCLYGCPSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@@H+](C[C@H]1CCCC(F)(F)C1)C1CC1)N(C)C ZINC001366751236 1337965851 /nfs/dbraw/zinc/96/58/51/1337965851.db2.gz KZZMUVTWUOXTPP-HOCLYGCPSA-N 1 3 345.478 2.733 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@H](C(=O)NCCN(Cc2ccccc2)C2CC2)C1 ZINC001366755355 1337972387 /nfs/dbraw/zinc/97/23/87/1337972387.db2.gz CZIOGSDQASHNRX-ICSRJNTNSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)CC[NH2+][C@@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001366785888 1338004654 /nfs/dbraw/zinc/00/46/54/1338004654.db2.gz VNGUZCNQXBGZPU-SFHVURJKSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)CC[NH2+][C@@H](CNC(=O)CN1CC[C@H](C)C1)c1ccccc1 ZINC001366786796 1338005154 /nfs/dbraw/zinc/00/51/54/1338005154.db2.gz KKRXHUWJJMSSCX-HKUYNNGSSA-N 1 3 331.504 2.821 10 0 EFAEHO CCc1ccccc1C[N@H+]1CC[C@H](CCNC(=O)[C@@H](CC)N(C)C)C1 ZINC001366844568 1338107876 /nfs/dbraw/zinc/10/78/76/1338107876.db2.gz QJDOHWIHPPBFSQ-FXAWDEMLSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CC[C@H](CCNC(=O)[C@@H](CC)N(C)C)C1 ZINC001366844568 1338107879 /nfs/dbraw/zinc/10/78/79/1338107879.db2.gz QJDOHWIHPPBFSQ-FXAWDEMLSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H]1CCN(C/C=C\Cl)C1)[NH+]1CCCC1 ZINC001366850992 1338116919 /nfs/dbraw/zinc/11/69/19/1338116919.db2.gz JIGUHWSUPHXEMW-BGHPOGFGSA-N 1 3 341.927 2.688 10 0 EFAEHO CCCC[N@H+](C)C[C@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001366865937 1338134942 /nfs/dbraw/zinc/13/49/42/1338134942.db2.gz MMTVNSFUYODMLI-VQIMIIECSA-N 1 3 341.515 2.779 10 0 EFAEHO CCCC[N@@H+](C)C[C@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001366865937 1338134945 /nfs/dbraw/zinc/13/49/45/1338134945.db2.gz MMTVNSFUYODMLI-VQIMIIECSA-N 1 3 341.515 2.779 10 0 EFAEHO CN(CCF)C[C@@H]1CCN(C(=O)[C@@H]2CCCC[N@@H+]2C2CCCC2)C1 ZINC001366865387 1338135307 /nfs/dbraw/zinc/13/53/07/1338135307.db2.gz KKBIVJOWXLKSDY-WMZOPIPTSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)C[C@@H]1CCN(C(=O)[C@@H]2CCCC[N@H+]2C2CCCC2)C1 ZINC001366865387 1338135308 /nfs/dbraw/zinc/13/53/08/1338135308.db2.gz KKBIVJOWXLKSDY-WMZOPIPTSA-N 1 3 339.499 2.533 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H]1CC[N@H+](CC2CCC2)C1)N1CCCCC1 ZINC001367060541 1338329980 /nfs/dbraw/zinc/32/99/80/1338329980.db2.gz RHSAGVAHVMVOLJ-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H]1CC[N@@H+](CC2CCC2)C1)N1CCCCC1 ZINC001367060541 1338329983 /nfs/dbraw/zinc/32/99/83/1338329983.db2.gz RHSAGVAHVMVOLJ-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](CC)[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001367130115 1338419081 /nfs/dbraw/zinc/41/90/81/1338419081.db2.gz FHUCNXWVLHJWIU-JKSUJKDBSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cccc(Cl)c1 ZINC001367131276 1338420925 /nfs/dbraw/zinc/42/09/25/1338420925.db2.gz ZCNVRBXHOXADMK-WMLDXEAASA-N 1 3 337.895 2.666 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](CC)CNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001367131136 1338421260 /nfs/dbraw/zinc/42/12/60/1338421260.db2.gz XTSOBTQYZPSAQY-VQIMIIECSA-N 1 3 331.504 2.575 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@](C)(NC(=O)CN2CC[C@H](C)C2)C2CC2)cs1 ZINC001367175960 1338476782 /nfs/dbraw/zinc/47/67/82/1338476782.db2.gz JWAIGJPFYFKXIL-IFXJQAMLSA-N 1 3 349.544 2.773 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[C@H]([NH2+]Cc2cc(C)ccc2F)CC1)N(C)C ZINC001367197606 1338503076 /nfs/dbraw/zinc/50/30/76/1338503076.db2.gz KOMTYGMIAYJWJF-ZHALLVOQSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[C@H]([NH2+]Cc2cc(C)ccc2F)CC1)N(C)C ZINC001367197599 1338503414 /nfs/dbraw/zinc/50/34/14/1338503414.db2.gz KOMTYGMIAYJWJF-LNLFQRSKSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001367229017 1338536494 /nfs/dbraw/zinc/53/64/94/1338536494.db2.gz VFNGJOFGBZSCKV-LJQANCHMSA-N 1 3 331.504 2.724 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)cc1F ZINC001367228542 1338536784 /nfs/dbraw/zinc/53/67/84/1338536784.db2.gz PMDAWTMIRBNRHX-QGZVFWFLSA-N 1 3 335.467 2.555 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]Cc1ccc(CF)cc1 ZINC001367266274 1338565900 /nfs/dbraw/zinc/56/59/00/1338565900.db2.gz MOILBUDGRQEXFA-INIZCTEOSA-N 1 3 349.494 2.872 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H](C)CNC(=O)CN(C)C(C)C)c(C)s1 ZINC001367291066 1338591013 /nfs/dbraw/zinc/59/10/13/1338591013.db2.gz VBROAFIFYWCWIU-ZDUSSCGKSA-N 1 3 325.522 2.547 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H](C)C[NH2+]Cc1cccc(F)c1Cl)N(C)C ZINC001367295321 1338595262 /nfs/dbraw/zinc/59/52/62/1338595262.db2.gz VRMQPBVFHLIBCO-WFASDCNBSA-N 1 3 343.874 2.661 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]C/C=C\Cl)CCCC1)N1CCCC1 ZINC001367329956 1338629394 /nfs/dbraw/zinc/62/93/94/1338629394.db2.gz KNDVIRXAQGBDHA-YFHOEESVSA-N 1 3 327.900 2.632 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C(=O)CN(C)C1CCC1 ZINC001367356515 1338652318 /nfs/dbraw/zinc/65/23/18/1338652318.db2.gz IAVXENDLVJXJMF-MRXNPFEDSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@H](C[NH2+]C[C@@H]1CCC(F)(F)C1)N(C)C(=O)CN(C)CC(C)(C)C ZINC001367387582 1338684486 /nfs/dbraw/zinc/68/44/86/1338684486.db2.gz VQRYHGKZHPSKAX-HUUCEWRRSA-N 1 3 347.494 2.836 10 0 EFAEHO C[C@H](CNCc1cc2ccccc2o1)N(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001367400270 1338697696 /nfs/dbraw/zinc/69/76/96/1338697696.db2.gz UQSAABRGOKZXSM-HZPDHXFCSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@H](CNCc1cc2ccccc2o1)N(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001367400270 1338697699 /nfs/dbraw/zinc/69/76/99/1338697699.db2.gz UQSAABRGOKZXSM-HZPDHXFCSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@@H](C[NH2+][C@H]1CCCc2ccc(F)cc21)N(C)C(=O)CN1CCCC1 ZINC001367404379 1338702150 /nfs/dbraw/zinc/70/21/50/1338702150.db2.gz LPDATBHRYBOTPZ-KXBFYZLASA-N 1 3 347.478 2.735 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(C)cc1 ZINC001367413422 1338711796 /nfs/dbraw/zinc/71/17/96/1338711796.db2.gz LJKSVYSOHIOCIQ-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([C@H](C)[NH2+]Cc2ccsc2)C1 ZINC001367434218 1338735457 /nfs/dbraw/zinc/73/54/57/1338735457.db2.gz AXLKYVRXHKUJOZ-DOTOQJQBSA-N 1 3 337.533 2.807 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)c1 ZINC001367486422 1338786134 /nfs/dbraw/zinc/78/61/34/1338786134.db2.gz NIHLHJQWIOSHFK-XLIONFOSSA-N 1 3 345.531 2.876 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1c(C)cccc1C)C(C)C)N(C)C ZINC001367496360 1338795063 /nfs/dbraw/zinc/79/50/63/1338795063.db2.gz VSYMTFIMABIRET-RTBURBONSA-N 1 3 333.520 2.874 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)NC(=O)[C@H]2CCC[N@@H+]2C(C)C)n1 ZINC001367672187 1338918562 /nfs/dbraw/zinc/91/85/62/1338918562.db2.gz OJKBSZYRNVSCBQ-VQIMIIECSA-N 1 3 346.519 2.672 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)NC(=O)[C@H]2CCC[N@H+]2C(C)C)n1 ZINC001367672187 1338918565 /nfs/dbraw/zinc/91/85/65/1338918565.db2.gz OJKBSZYRNVSCBQ-VQIMIIECSA-N 1 3 346.519 2.672 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C(C)(C)C)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001367694922 1338934551 /nfs/dbraw/zinc/93/45/51/1338934551.db2.gz KXIZZMZJYBZECT-DLBZAZTESA-N 1 3 345.531 2.920 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+][C@@H](C)c1cccc(Cl)c1 ZINC001367776023 1338999776 /nfs/dbraw/zinc/99/97/76/1338999776.db2.gz WQVYBBHOSFYCQB-KBPBESRZSA-N 1 3 325.884 2.836 10 0 EFAEHO Cc1ccccc1CCC[N@@H+](C)C[C@@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001367834558 1339051223 /nfs/dbraw/zinc/05/12/23/1339051223.db2.gz NEFHDKOJFNIPGW-IEBWSBKVSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccccc1CCC[N@H+](C)C[C@@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001367834558 1339051225 /nfs/dbraw/zinc/05/12/25/1339051225.db2.gz NEFHDKOJFNIPGW-IEBWSBKVSA-N 1 3 345.531 2.706 10 0 EFAEHO CCc1ccccc1CC[N@H+](C)C[C@@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001367836046 1339052510 /nfs/dbraw/zinc/05/25/10/1339052510.db2.gz OMPZBTRLOVFCBG-QZTJIDSGSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[N@@H+](C)C[C@@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001367836046 1339052511 /nfs/dbraw/zinc/05/25/11/1339052511.db2.gz OMPZBTRLOVFCBG-QZTJIDSGSA-N 1 3 345.531 2.570 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H](NC(=O)[C@@H]2CCCN2C(C)C)C2CC2)c1 ZINC001367908554 1339099548 /nfs/dbraw/zinc/09/95/48/1339099548.db2.gz XYCHDXRNEZPCTN-UXHICEINSA-N 1 3 343.515 2.852 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+][C@@H]1CCc2c1cccc2F)C1CC1 ZINC001367919609 1339108006 /nfs/dbraw/zinc/10/80/06/1339108006.db2.gz LMUSPVVHJJPSLN-RTBURBONSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCN1CC1CC2(CCC2)C1 ZINC001367943579 1339120424 /nfs/dbraw/zinc/12/04/24/1339120424.db2.gz KHVGBIRZJNFZFZ-MSOLQXFVSA-N 1 3 333.520 2.632 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCN1CC1CC2(CCC2)C1 ZINC001367943579 1339120426 /nfs/dbraw/zinc/12/04/26/1339120426.db2.gz KHVGBIRZJNFZFZ-MSOLQXFVSA-N 1 3 333.520 2.632 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCN1CC1CC2(CCC2)C1)[NH+]1CCCC1 ZINC001367980442 1339141826 /nfs/dbraw/zinc/14/18/26/1339141826.db2.gz STBXOMVYXBOYBT-RTBURBONSA-N 1 3 347.547 2.878 10 0 EFAEHO CC[C@H]([NH2+]C1(CNC(=O)[C@H](C(C)C)N(C)C)CC1)c1ccccc1 ZINC001368005286 1339153675 /nfs/dbraw/zinc/15/36/75/1339153675.db2.gz CEAXFZUSLHAODF-ROUUACIJSA-N 1 3 331.504 2.962 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CC1)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001368011986 1339157024 /nfs/dbraw/zinc/15/70/24/1339157024.db2.gz HJXQXDBKUFNUSL-HZPDHXFCSA-N 1 3 333.501 2.503 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CC1)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001368011986 1339157027 /nfs/dbraw/zinc/15/70/27/1339157027.db2.gz HJXQXDBKUFNUSL-HZPDHXFCSA-N 1 3 333.501 2.503 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)C(C)(C)[N@H+](C)C2CCCC2)CC1 ZINC001368011426 1339157064 /nfs/dbraw/zinc/15/70/64/1339157064.db2.gz HIHIZDOCZSZBSC-CQSZACIVSA-N 1 3 327.488 2.626 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)C(C)(C)[N@@H+](C)C2CCCC2)CC1 ZINC001368011426 1339157066 /nfs/dbraw/zinc/15/70/66/1339157066.db2.gz HIHIZDOCZSZBSC-CQSZACIVSA-N 1 3 327.488 2.626 10 0 EFAEHO C[NH+](C)CCCC(=O)NCC1(N[C@H]2CCc3c2cccc3Cl)CC1 ZINC001368024979 1339163424 /nfs/dbraw/zinc/16/34/24/1339163424.db2.gz ZVTCWZHWDDLQOW-KRWDZBQOSA-N 1 3 349.906 2.908 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1CC[C@@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001368042142 1339171920 /nfs/dbraw/zinc/17/19/20/1339171920.db2.gz GVMFQQFNHHNMAE-QZTJIDSGSA-N 1 3 341.515 2.635 10 0 EFAEHO CC[C@@H](F)C[N@H+]1CC[C@@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001368042142 1339171923 /nfs/dbraw/zinc/17/19/23/1339171923.db2.gz GVMFQQFNHHNMAE-QZTJIDSGSA-N 1 3 341.515 2.635 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC1CC1)[NH+](CC)CC ZINC001368054550 1339180080 /nfs/dbraw/zinc/18/00/80/1339180080.db2.gz VTYVCLNPKBGDTB-OTWHNJEPSA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](C)C[N@@H+]1CC[C@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001368070513 1339185785 /nfs/dbraw/zinc/18/57/85/1339185785.db2.gz WWVWBYYNWSHWKR-PXNSSMCTSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C)C[N@H+]1CC[C@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001368070513 1339185786 /nfs/dbraw/zinc/18/57/86/1339185786.db2.gz WWVWBYYNWSHWKR-PXNSSMCTSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1CC[C@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001368070520 1339185832 /nfs/dbraw/zinc/18/58/32/1339185832.db2.gz WWVWBYYNWSHWKR-XLIONFOSSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C)C[N@H+]1CC[C@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001368070520 1339185833 /nfs/dbraw/zinc/18/58/33/1339185833.db2.gz WWVWBYYNWSHWKR-XLIONFOSSA-N 1 3 337.552 2.935 10 0 EFAEHO COc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)cc1 ZINC001368102384 1339195564 /nfs/dbraw/zinc/19/55/64/1339195564.db2.gz GLDUWTMBZUJGCR-WMZOPIPTSA-N 1 3 347.503 2.505 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)cc1 ZINC001368109396 1339197804 /nfs/dbraw/zinc/19/78/04/1339197804.db2.gz RVDRQEWCQMQBDL-IEBWSBKVSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)cc1 ZINC001368109403 1339197888 /nfs/dbraw/zinc/19/78/88/1339197888.db2.gz RVDRQEWCQMQBDL-MJGOQNOKSA-N 1 3 331.504 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C)CC[NH+](CC2CC3(CCC3)C2)CC1 ZINC001368130769 1339207963 /nfs/dbraw/zinc/20/79/63/1339207963.db2.gz ZJGUKEVVXSAXOP-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@]2(CC[N@H+](CC3CCC3)C2)C1 ZINC001368149711 1339220425 /nfs/dbraw/zinc/22/04/25/1339220425.db2.gz WSAUZDAKANOMCI-HXUWFJFHSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@]2(CC[N@@H+](CC3CCC3)C2)C1 ZINC001368149711 1339220426 /nfs/dbraw/zinc/22/04/26/1339220426.db2.gz WSAUZDAKANOMCI-HXUWFJFHSA-N 1 3 335.536 2.833 10 0 EFAEHO CC[C@H](C(=O)N[C@]1(C)CC[N@H+](CC2CC(F)(F)C2)C1)N(CC)CC ZINC001368168878 1339232580 /nfs/dbraw/zinc/23/25/80/1339232580.db2.gz FCLOHMQLTPKVCP-NVXWUHKLSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](C(=O)N[C@]1(C)CC[N@@H+](CC2CC(F)(F)C2)C1)N(CC)CC ZINC001368168878 1339232583 /nfs/dbraw/zinc/23/25/83/1339232583.db2.gz FCLOHMQLTPKVCP-NVXWUHKLSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@]1(C)CCN([C@@H](C)c2cccc(OC)c2)C1 ZINC001368184605 1339242167 /nfs/dbraw/zinc/24/21/67/1339242167.db2.gz YPBHJTKZGCIVOO-OXJNMPFZSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@]1(C)CCN([C@@H](C)c2cccc(OC)c2)C1 ZINC001368184605 1339242171 /nfs/dbraw/zinc/24/21/71/1339242171.db2.gz YPBHJTKZGCIVOO-OXJNMPFZSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[C@@H](F)CN1CCC(C)(CNC(=O)CCC[NH+]2CCCC2)CC1 ZINC001368209587 1339257150 /nfs/dbraw/zinc/25/71/50/1339257150.db2.gz KEIPOAKIMQOTGW-QGZVFWFLSA-N 1 3 341.515 2.829 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@]1(C)CCC[N@H+](CCCF)C1 ZINC001368233231 1339277411 /nfs/dbraw/zinc/27/74/11/1339277411.db2.gz ZRMBKDZEIRZLPU-IEBWSBKVSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@]1(C)CCC[N@@H+](CCCF)C1 ZINC001368233231 1339277413 /nfs/dbraw/zinc/27/74/13/1339277413.db2.gz ZRMBKDZEIRZLPU-IEBWSBKVSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccsc1)C2 ZINC001368328632 1339300040 /nfs/dbraw/zinc/30/00/40/1339300040.db2.gz VWFWEICTYFHRAX-ULQDDVLXSA-N 1 3 335.517 2.559 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccsc1)C2 ZINC001368328632 1339300042 /nfs/dbraw/zinc/30/00/42/1339300042.db2.gz VWFWEICTYFHRAX-ULQDDVLXSA-N 1 3 335.517 2.559 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC[C@@H](C)F)N(C)C ZINC001368345576 1339309134 /nfs/dbraw/zinc/30/91/34/1339309134.db2.gz HWFRYNMEHBRFEZ-UYTYNIKBSA-N 1 3 341.515 2.680 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC[C@@H](C)F)N(C)C ZINC001368345576 1339309137 /nfs/dbraw/zinc/30/91/37/1339309137.db2.gz HWFRYNMEHBRFEZ-UYTYNIKBSA-N 1 3 341.515 2.680 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([C@H](C)[NH2+]Cc2cc(C)ccc2F)C1 ZINC001368348013 1339309954 /nfs/dbraw/zinc/30/99/54/1339309954.db2.gz ULKGXVKLQSFWJW-IRXDYDNUSA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CCCC2)C1 ZINC001368349618 1339310956 /nfs/dbraw/zinc/31/09/56/1339310956.db2.gz VIFQWEQADCPLQI-RSPOEFSDSA-N 1 3 347.547 2.878 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CCCC2)C1 ZINC001368349618 1339310958 /nfs/dbraw/zinc/31/09/58/1339310958.db2.gz VIFQWEQADCPLQI-RSPOEFSDSA-N 1 3 347.547 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@H]1CC[N@@H+]1CC1CC2(CCC2)C1)N(C)C ZINC001368397331 1339331578 /nfs/dbraw/zinc/33/15/78/1339331578.db2.gz FEJSJHALLLRMKH-QZTJIDSGSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@H]1CC[N@H+]1CC1CC2(CCC2)C1)N(C)C ZINC001368397331 1339331580 /nfs/dbraw/zinc/33/15/80/1339331580.db2.gz FEJSJHALLLRMKH-QZTJIDSGSA-N 1 3 335.536 2.686 10 0 EFAEHO CN(C[C@H]1CCN1CC1CCC1)C(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001368403187 1339341633 /nfs/dbraw/zinc/34/16/33/1339341633.db2.gz PTIYGRSIIBSXQW-VQIMIIECSA-N 1 3 339.499 2.532 10 0 EFAEHO CN(C[C@H]1CCN1CC1CCC1)C(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001368403187 1339341642 /nfs/dbraw/zinc/34/16/42/1339341642.db2.gz PTIYGRSIIBSXQW-VQIMIIECSA-N 1 3 339.499 2.532 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]Cc2ccsc2)CC1 ZINC001368417069 1339351158 /nfs/dbraw/zinc/35/11/58/1339351158.db2.gz JGMLBNNWFTZIDH-JCNLHEQBSA-N 1 3 337.533 2.855 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+][C@H]2CCc3ccccc32)C1 ZINC001368425519 1339359156 /nfs/dbraw/zinc/35/91/56/1339359156.db2.gz TWWBINDQEIJLMO-XLIONFOSSA-N 1 3 343.515 2.844 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCCN(Cc2ccccn2)CC1)[NH+](CC)CC ZINC001368518599 1339454280 /nfs/dbraw/zinc/45/42/80/1339454280.db2.gz XEYOMXDFLWIEDW-IEBWSBKVSA-N 1 3 346.519 2.673 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)CCCN(C)C(=O)[C@H]2CCCN2C)c1 ZINC001368524254 1339460876 /nfs/dbraw/zinc/46/08/76/1339460876.db2.gz HJVZEFSBNISBPX-VQIMIIECSA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)CCCN(C)C(=O)[C@H]2CCCN2C)c1 ZINC001368524254 1339460878 /nfs/dbraw/zinc/46/08/78/1339460878.db2.gz HJVZEFSBNISBPX-VQIMIIECSA-N 1 3 347.503 2.631 10 0 EFAEHO CCC1([NH2+]CC2CC(C)(C)C2)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001368594478 1339541254 /nfs/dbraw/zinc/54/12/54/1339541254.db2.gz NGXCUJFELYLEDS-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(CC)CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001368601644 1339544521 /nfs/dbraw/zinc/54/45/21/1339544521.db2.gz TXMHWKOWLJQGRS-HNNXBMFYSA-N 1 3 327.488 2.580 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H]1C[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001368607801 1339547602 /nfs/dbraw/zinc/54/76/02/1339547602.db2.gz KPDWCMRLXHWJKN-RUCARUNLSA-N 1 3 331.504 2.574 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CC=C(Cl)Cl)C1)N(C)C ZINC001368642406 1339561993 /nfs/dbraw/zinc/56/19/93/1339561993.db2.gz ZHESNUTZJDLYRN-YNEHKIRRSA-N 1 3 336.307 2.520 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001368664165 1339576520 /nfs/dbraw/zinc/57/65/20/1339576520.db2.gz PGDJSMZWYDGEJA-FGTMMUONSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c(C)s1 ZINC001368670656 1339584145 /nfs/dbraw/zinc/58/41/45/1339584145.db2.gz TYHNQYTXJOZMHP-SUMWQHHRSA-N 1 3 337.533 2.642 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]2[C@@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)[C@@H]21 ZINC001368692203 1339606829 /nfs/dbraw/zinc/60/68/29/1339606829.db2.gz FICKEUPJYZCUAI-KBAYOESNSA-N 1 3 337.552 2.980 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]2[C@@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)[C@@H]21 ZINC001368692203 1339606830 /nfs/dbraw/zinc/60/68/30/1339606830.db2.gz FICKEUPJYZCUAI-KBAYOESNSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)CC[N@@H+]1Cc1ccsc1 ZINC001368693298 1339608550 /nfs/dbraw/zinc/60/85/50/1339608550.db2.gz LDQZXVPIZXVDDJ-HOCLYGCPSA-N 1 3 335.517 2.702 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)CC[N@H+]1Cc1ccsc1 ZINC001368693298 1339608552 /nfs/dbraw/zinc/60/85/52/1339608552.db2.gz LDQZXVPIZXVDDJ-HOCLYGCPSA-N 1 3 335.517 2.702 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CCc2ccccc2)[C@@H](C)C1 ZINC001368695615 1339610274 /nfs/dbraw/zinc/61/02/74/1339610274.db2.gz JLNAWSRSOQRHAX-PKOBYXMFSA-N 1 3 331.504 2.538 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CCc2ccccc2)[C@@H](C)C1 ZINC001368695615 1339610275 /nfs/dbraw/zinc/61/02/75/1339610275.db2.gz JLNAWSRSOQRHAX-PKOBYXMFSA-N 1 3 331.504 2.538 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CCc2ccccc2)[C@H](C)C1 ZINC001368695598 1339611128 /nfs/dbraw/zinc/61/11/28/1339611128.db2.gz JLNAWSRSOQRHAX-IEBWSBKVSA-N 1 3 331.504 2.538 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CCc2ccccc2)[C@H](C)C1 ZINC001368695598 1339611132 /nfs/dbraw/zinc/61/11/32/1339611132.db2.gz JLNAWSRSOQRHAX-IEBWSBKVSA-N 1 3 331.504 2.538 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2cccnc2C)[C@@H]1CC ZINC001368706068 1339625669 /nfs/dbraw/zinc/62/56/69/1339625669.db2.gz QSLFKJGVKJIZAK-RBUKOAKNSA-N 1 3 346.519 2.591 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2cccnc2C)[C@@H]1CC ZINC001368706068 1339625673 /nfs/dbraw/zinc/62/56/73/1339625673.db2.gz QSLFKJGVKJIZAK-RBUKOAKNSA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@@H](CCNC(=O)[C@@H]1CCCN1C)[NH2+]Cc1cc(F)ccc1Cl ZINC001368708279 1339627987 /nfs/dbraw/zinc/62/79/87/1339627987.db2.gz JAMJSZBDKVTFGS-LRDDRELGSA-N 1 3 341.858 2.558 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1ccc(F)cc1Cl)N(C)C ZINC001368722408 1339641378 /nfs/dbraw/zinc/64/13/78/1339641378.db2.gz INXURZKZEYIKTJ-BLLLJJGKSA-N 1 3 343.874 2.804 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)C[C@@H]3C2)c1 ZINC001368736817 1339658243 /nfs/dbraw/zinc/65/82/43/1339658243.db2.gz TWOKDXPMNLEJBF-UXHICEINSA-N 1 3 343.515 2.616 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)C[C@@H]3C2)c1 ZINC001368736817 1339658247 /nfs/dbraw/zinc/65/82/47/1339658247.db2.gz TWOKDXPMNLEJBF-UXHICEINSA-N 1 3 343.515 2.616 10 0 EFAEHO CCCN(C)CC(=O)N1CCCCC[C@H]([NH2+]CCc2ccccc2)C1 ZINC001368748910 1339672357 /nfs/dbraw/zinc/67/23/57/1339672357.db2.gz LWPUUXBHIKVFRP-FQEVSTJZSA-N 1 3 345.531 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001368755901 1339681531 /nfs/dbraw/zinc/68/15/31/1339681531.db2.gz RXNSIKCUUDCDQU-LBPRGKRZSA-N 1 3 331.913 2.726 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+][C@H]1CCc2c1cccc2F ZINC001368757472 1339684825 /nfs/dbraw/zinc/68/48/25/1339684825.db2.gz ZQIOTHUAOQPOQK-KSSFIOAISA-N 1 3 335.467 2.638 10 0 EFAEHO CC[C@@H](F)C[N@H+](CC)CC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001368770799 1339695803 /nfs/dbraw/zinc/69/58/03/1339695803.db2.gz PAFLQRCTLZDGDP-MSOLQXFVSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[C@@H](F)C[N@@H+](CC)CC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001368770799 1339695809 /nfs/dbraw/zinc/69/58/09/1339695809.db2.gz PAFLQRCTLZDGDP-MSOLQXFVSA-N 1 3 343.531 2.881 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@H+](C)CCC1CCCCC1 ZINC001368788831 1339716656 /nfs/dbraw/zinc/71/66/56/1339716656.db2.gz LWVHUAAJHBVPGT-OALUTQOASA-N 1 3 335.536 2.974 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@@H+](C)CCC1CCCCC1 ZINC001368788831 1339716658 /nfs/dbraw/zinc/71/66/58/1339716658.db2.gz LWVHUAAJHBVPGT-OALUTQOASA-N 1 3 335.536 2.974 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC2CC(NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001368817560 1339757509 /nfs/dbraw/zinc/75/75/09/1339757509.db2.gz BCXSUUKRTNKYIY-SOAGJPPSSA-N 1 3 345.531 2.874 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]Cc2ccccc2Cl)C1 ZINC001368823173 1339762768 /nfs/dbraw/zinc/76/27/68/1339762768.db2.gz QGDOCYXONUSVPP-UHFFFAOYSA-N 1 3 337.895 2.666 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]Cc2cccc(Cl)c2)C1 ZINC001368824916 1339764722 /nfs/dbraw/zinc/76/47/22/1339764722.db2.gz JAJYRBCORQPDAI-UHFFFAOYSA-N 1 3 337.895 2.665 10 0 EFAEHO CCc1ccccc1C[NH2+]CC1CC(NC(=O)CN(C)C(C)C)C1 ZINC001368825980 1339766497 /nfs/dbraw/zinc/76/64/97/1339766497.db2.gz SFEZSSMWTDPCSU-UHFFFAOYSA-N 1 3 331.504 2.574 10 0 EFAEHO Cc1ccc(CN[C@H](C)[C@H](C)NC(=O)CC[NH+](C)C)c(Cl)c1 ZINC001368856965 1339793481 /nfs/dbraw/zinc/79/34/81/1339793481.db2.gz ANBBFAZEAKOVRP-KGLIPLIRSA-N 1 3 325.884 2.583 10 0 EFAEHO CC(C)[NH2+]CC(C)(C)CN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001368920200 1339865627 /nfs/dbraw/zinc/86/56/27/1339865627.db2.gz UDWQTCBYHUIMEF-SFHVURJKSA-N 1 3 329.504 2.682 10 0 EFAEHO Cc1cccc(C[NH2+]CC(C)(C)CN(C)C(=O)CN(C)C(C)C)c1 ZINC001368927178 1339872731 /nfs/dbraw/zinc/87/27/31/1339872731.db2.gz VMKXUZPBEWWPFC-UHFFFAOYSA-N 1 3 333.520 2.909 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)C1C[NH+](CCC2CCCCC2)C1 ZINC001369085979 1339905538 /nfs/dbraw/zinc/90/55/38/1339905538.db2.gz XETXUNLBRNYKHD-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(C)c(CN2CC([C@@H](C)NC(=O)C[C@H]3CC[N@H+](C)C3)C2)c1 ZINC001369089964 1339908682 /nfs/dbraw/zinc/90/86/82/1339908682.db2.gz FROAKSFNIIOMPU-QZTJIDSGSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(C)c(CN2CC([C@@H](C)NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)c1 ZINC001369089964 1339908686 /nfs/dbraw/zinc/90/86/86/1339908686.db2.gz FROAKSFNIIOMPU-QZTJIDSGSA-N 1 3 343.515 2.582 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@H](C)C1)C1C[NH+](CCCC2CCCC2)C1 ZINC001369094769 1339912017 /nfs/dbraw/zinc/91/20/17/1339912017.db2.gz PUKNSFBDVUATQN-DLBZAZTESA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@H+](CCc2ccccc2)CC1(C)C)N(C)C ZINC001369113320 1339924873 /nfs/dbraw/zinc/92/48/73/1339924873.db2.gz CXWWFIODCWOIHH-RBUKOAKNSA-N 1 3 345.531 2.642 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@@H+](CCc2ccccc2)CC1(C)C)N(C)C ZINC001369113320 1339924875 /nfs/dbraw/zinc/92/48/75/1339924875.db2.gz CXWWFIODCWOIHH-RBUKOAKNSA-N 1 3 345.531 2.642 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@H+](CC2CC3(CCC3)C2)CC1(C)C)N(C)C ZINC001369129267 1339934195 /nfs/dbraw/zinc/93/41/95/1339934195.db2.gz OQOZTPNNBASDGI-ZWKOTPCHSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@@H+](CC2CC3(CCC3)C2)CC1(C)C)N(C)C ZINC001369129267 1339934196 /nfs/dbraw/zinc/93/41/96/1339934196.db2.gz OQOZTPNNBASDGI-ZWKOTPCHSA-N 1 3 349.563 2.980 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[N@H+](C)CC2CC(C)(C)C2)C1 ZINC001370319532 1340033280 /nfs/dbraw/zinc/03/32/80/1340033280.db2.gz ZYCYJJNUEJJJSI-QGZVFWFLSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[N@@H+](C)CC2CC(C)(C)C2)C1 ZINC001370319532 1340033285 /nfs/dbraw/zinc/03/32/85/1340033285.db2.gz ZYCYJJNUEJJJSI-QGZVFWFLSA-N 1 3 337.552 2.935 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](F)CN(CC)CC ZINC001370331346 1340039270 /nfs/dbraw/zinc/03/92/70/1340039270.db2.gz NSBRLJNRKRPNIR-FGTMMUONSA-N 1 3 341.515 2.778 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](F)CN(CC)CC ZINC001370331346 1340039273 /nfs/dbraw/zinc/03/92/73/1340039273.db2.gz NSBRLJNRKRPNIR-FGTMMUONSA-N 1 3 341.515 2.778 10 0 EFAEHO C[C@H](N[C@H]1C[C@H](NC(=O)CC[C@H]2CCC[N@@H+]2C)C1)c1ccccc1F ZINC001370486257 1340098332 /nfs/dbraw/zinc/09/83/32/1340098332.db2.gz UJFLXUBAIREJPD-LUKYLMHMSA-N 1 3 347.478 2.998 10 0 EFAEHO C[C@H](N[C@H]1C[C@H](NC(=O)CC[C@H]2CCC[N@H+]2C)C1)c1ccccc1F ZINC001370486257 1340098335 /nfs/dbraw/zinc/09/83/35/1340098335.db2.gz UJFLXUBAIREJPD-LUKYLMHMSA-N 1 3 347.478 2.998 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H]([NH2+][C@@H](C)c2cc(C)ccc2C)C1)N(C)C ZINC001370488406 1340099332 /nfs/dbraw/zinc/09/93/32/1340099332.db2.gz JNCLSVRQOSNZMF-LSTDLKDCSA-N 1 3 331.504 2.941 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001370591158 1340152172 /nfs/dbraw/zinc/15/21/72/1340152172.db2.gz LNEPSRMHPXIZBJ-FUHWJXTLSA-N 1 3 332.492 2.701 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001370591158 1340152174 /nfs/dbraw/zinc/15/21/74/1340152174.db2.gz LNEPSRMHPXIZBJ-FUHWJXTLSA-N 1 3 332.492 2.701 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC(C)(C)C1)N(C)C ZINC001370592008 1340152846 /nfs/dbraw/zinc/15/28/46/1340152846.db2.gz GLCIRPDAUBNNAA-HQSKLWIPSA-N 1 3 335.536 2.874 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC(C)(C)C1)N(C)C ZINC001370592008 1340152848 /nfs/dbraw/zinc/15/28/48/1340152848.db2.gz GLCIRPDAUBNNAA-HQSKLWIPSA-N 1 3 335.536 2.874 10 0 EFAEHO C[C@@H](N[C@H]1C[C@@H](NC(=O)CC[C@H]2CCC[N@@H+]2C)C1)c1ccccc1F ZINC001370640938 1340179118 /nfs/dbraw/zinc/17/91/18/1340179118.db2.gz UJFLXUBAIREJPD-WCXIOVBPSA-N 1 3 347.478 2.998 10 0 EFAEHO C[C@@H](N[C@H]1C[C@@H](NC(=O)CC[C@H]2CCC[N@H+]2C)C1)c1ccccc1F ZINC001370640938 1340179120 /nfs/dbraw/zinc/17/91/20/1340179120.db2.gz UJFLXUBAIREJPD-WCXIOVBPSA-N 1 3 347.478 2.998 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(Cl)cc2)C1)N(C)C ZINC001370652530 1340180278 /nfs/dbraw/zinc/18/02/78/1340180278.db2.gz XOGBVCJTNFFUJW-KKBVYLPWSA-N 1 3 337.895 2.978 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1C[C@@H](NCc2cccc(Cl)c2F)C1 ZINC001370666641 1340182453 /nfs/dbraw/zinc/18/24/53/1340182453.db2.gz OTIHLOBBJNEOFA-OKILXGFUSA-N 1 3 341.858 2.558 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccccc2C2CC2)C1)N(C)C ZINC001370680172 1340184467 /nfs/dbraw/zinc/18/44/67/1340184467.db2.gz RTKXFNJSJXTYEY-SCTDSRPQSA-N 1 3 329.488 2.641 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[NH2+]CC2CCC(C)CC2)C1 ZINC001370833970 1340225438 /nfs/dbraw/zinc/22/54/38/1340225438.db2.gz VYXXURSOJGGHPW-CTWPCTMYSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[NH2+]Cc1cccc(F)c1 ZINC001370961837 1340308210 /nfs/dbraw/zinc/30/82/10/1340308210.db2.gz SOMDULKBCHGZGI-SFHVURJKSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](Cc2ccc(F)cc2)C1 ZINC001370971092 1340315707 /nfs/dbraw/zinc/31/57/07/1340315707.db2.gz PFSIGDGGSUSLGC-FUHWJXTLSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2)C1 ZINC001370971092 1340315711 /nfs/dbraw/zinc/31/57/11/1340315711.db2.gz PFSIGDGGSUSLGC-FUHWJXTLSA-N 1 3 349.494 2.883 10 0 EFAEHO Cc1ccc(CN2CCC[C@H]([C@@H](C)NC(=O)CC[NH+](C)C)C2)cc1F ZINC001370981903 1340320999 /nfs/dbraw/zinc/32/09/99/1340320999.db2.gz VQVQZXCFTYNNFO-AEFFLSMTSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(CN2CCC[C@@H]([C@@H](C)NC(=O)CC[NH+](C)C)C2)cc1F ZINC001370981911 1340321149 /nfs/dbraw/zinc/32/11/49/1340321149.db2.gz VQVQZXCFTYNNFO-SJLPKXTDSA-N 1 3 349.494 2.803 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](C)CNC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001371179918 1340397623 /nfs/dbraw/zinc/39/76/23/1340397623.db2.gz SHQYFTXSSRKKBR-VQIMIIECSA-N 1 3 331.504 2.716 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](C)CNC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001371179917 1340397923 /nfs/dbraw/zinc/39/79/23/1340397923.db2.gz SHQYFTXSSRKKBR-QFBILLFUSA-N 1 3 331.504 2.716 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)NCc1cc2ccccc2o1 ZINC001371335556 1340505990 /nfs/dbraw/zinc/50/59/90/1340505990.db2.gz QWCCLUIXEXQHKU-VYDXJSESSA-N 1 3 343.471 2.757 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)NCc1cc2ccccc2o1 ZINC001371335556 1340505994 /nfs/dbraw/zinc/50/59/94/1340505994.db2.gz QWCCLUIXEXQHKU-VYDXJSESSA-N 1 3 343.471 2.757 10 0 EFAEHO CC[C@@](C)(NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccccc1 ZINC001371602241 1340669163 /nfs/dbraw/zinc/66/91/63/1340669163.db2.gz VNLYQUUJZQAKBI-FXAWDEMLSA-N 1 3 348.535 2.883 10 0 EFAEHO CC[C@@](C)(NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccccc1 ZINC001371602241 1340669166 /nfs/dbraw/zinc/66/91/66/1340669166.db2.gz VNLYQUUJZQAKBI-FXAWDEMLSA-N 1 3 348.535 2.883 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)NCC[C@H]1CCN(C/C=C/Cl)C1 ZINC001373186631 1340938631 /nfs/dbraw/zinc/93/86/31/1340938631.db2.gz BMNWBVYOEUJUTQ-ACISRZNPSA-N 1 3 341.927 2.688 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NCC[C@H]1CCN(C/C=C/Cl)C1 ZINC001373186631 1340938632 /nfs/dbraw/zinc/93/86/32/1340938632.db2.gz BMNWBVYOEUJUTQ-ACISRZNPSA-N 1 3 341.927 2.688 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@H+](C/C=C/c2ccccc2)C1 ZINC001373245643 1340965974 /nfs/dbraw/zinc/96/59/74/1340965974.db2.gz KLPRWARQEAIZHD-JRMCHAMMSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@@H+](C/C=C/c2ccccc2)C1 ZINC001373245643 1340965975 /nfs/dbraw/zinc/96/59/75/1340965975.db2.gz KLPRWARQEAIZHD-JRMCHAMMSA-N 1 3 343.515 2.868 10 0 EFAEHO C[N@H+](C/C=C\c1ccccc1)C[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001373318337 1340989122 /nfs/dbraw/zinc/98/91/22/1340989122.db2.gz WBGIVEFQVXIABX-ROFLEHJCSA-N 1 3 341.499 2.576 10 0 EFAEHO C[N@@H+](C/C=C\c1ccccc1)C[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001373318337 1340989123 /nfs/dbraw/zinc/98/91/23/1340989123.db2.gz WBGIVEFQVXIABX-ROFLEHJCSA-N 1 3 341.499 2.576 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@H+](C[C@@H]2CCC(F)(F)C2)C1)N(C)C ZINC001373379782 1341005423 /nfs/dbraw/zinc/00/54/23/1341005423.db2.gz POGMSLGLLNLKDK-OAGGEKHMSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@@H+](C[C@@H]2CCC(F)(F)C2)C1)N(C)C ZINC001373379782 1341005425 /nfs/dbraw/zinc/00/54/25/1341005425.db2.gz POGMSLGLLNLKDK-OAGGEKHMSA-N 1 3 345.478 2.589 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCCN(Cc2ccc3ccccc3c2)C1 ZINC001373382015 1341006262 /nfs/dbraw/zinc/00/62/62/1341006262.db2.gz LBNVQJKEQHFNDY-HXUWFJFHSA-N 1 3 339.483 2.872 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@H]1CCCN(Cc2ccc(C3CC3)cc2)C1 ZINC001373382165 1341006430 /nfs/dbraw/zinc/00/64/30/1341006430.db2.gz MIGICWIVBYYYIG-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)C1)N(C)C ZINC001373400310 1341012858 /nfs/dbraw/zinc/01/28/58/1341012858.db2.gz SAQAKWLUHDEBDJ-DFQSSKMNSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)C1)N(C)C ZINC001373400310 1341012860 /nfs/dbraw/zinc/01/28/60/1341012860.db2.gz SAQAKWLUHDEBDJ-DFQSSKMNSA-N 1 3 343.515 2.841 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1C[NH+](CC2CCC3(CC3)CC2)C1 ZINC001373558829 1341053573 /nfs/dbraw/zinc/05/35/73/1341053573.db2.gz APLJZNNNMQEVQG-IAGOWNOFSA-N 1 3 347.547 2.878 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N1CC[C@@H](N(C)C(=O)CC[NH+](C)C)C1 ZINC001373678035 1341095700 /nfs/dbraw/zinc/09/57/00/1341095700.db2.gz ANRIKLIVOLUMFZ-QZTJIDSGSA-N 1 3 335.467 2.761 10 0 EFAEHO CCN(C(=O)C[C@H]1CC[N@H+](C)C1)[C@H]1CCN(Cc2cccc(C)c2)C1 ZINC001373714562 1341117440 /nfs/dbraw/zinc/11/74/40/1341117440.db2.gz FOTOFRSLZFAOGP-UXHICEINSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)C[C@H]1CC[N@@H+](C)C1)[C@H]1CCN(Cc2cccc(C)c2)C1 ZINC001373714562 1341117441 /nfs/dbraw/zinc/11/74/41/1341117441.db2.gz FOTOFRSLZFAOGP-UXHICEINSA-N 1 3 343.515 2.760 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1ccc(C)c(F)c1 ZINC001373759170 1341137184 /nfs/dbraw/zinc/13/71/84/1341137184.db2.gz JNFQCFTYLGPPGI-MJGOQNOKSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@@H](CNC(=O)C12CCC[NH+](CCC1)C2)NCc1ccccc1F ZINC001373765790 1341139166 /nfs/dbraw/zinc/13/91/66/1341139166.db2.gz YOJQORUOFLTDOU-KRWDZBQOSA-N 1 3 347.478 2.686 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1csc(C)c1 ZINC001373778762 1341143649 /nfs/dbraw/zinc/14/36/49/1341143649.db2.gz ATTZGHVGTZWABL-MRXNPFEDSA-N 1 3 337.533 2.915 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1cccc(C)c1 ZINC001373786751 1341146695 /nfs/dbraw/zinc/14/66/95/1341146695.db2.gz ZGCFZXIEWJALRI-SFHVURJKSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@@H](CNC(=O)CC[NH+](C)C)NCc1c(C)cccc1Cl ZINC001373789735 1341148202 /nfs/dbraw/zinc/14/82/02/1341148202.db2.gz IDDUHGLKXMSAJJ-AWEZNQCLSA-N 1 3 325.884 2.585 10 0 EFAEHO C[C@H](F)CC[NH2+][C@H]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001373920209 1341203751 /nfs/dbraw/zinc/20/37/51/1341203751.db2.gz KIQSBLPEUBWQAL-JYJNAYRXSA-N 1 3 329.504 2.729 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001373973112 1341267570 /nfs/dbraw/zinc/26/75/70/1341267570.db2.gz SSFYRLIKXWXAEK-LJQANCHMSA-N 1 3 331.504 2.724 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H](C)C[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001374096957 1341397392 /nfs/dbraw/zinc/39/73/92/1341397392.db2.gz IQTOJWKXRWEVAJ-PBHICJAKSA-N 1 3 339.911 2.831 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)C[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001374096963 1341397578 /nfs/dbraw/zinc/39/75/78/1341397578.db2.gz IQTOJWKXRWEVAJ-RHSMWYFYSA-N 1 3 339.911 2.831 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+]C[C@H](F)CC)CCCC1 ZINC001374161615 1341482475 /nfs/dbraw/zinc/48/24/75/1341482475.db2.gz SJDDXCUGJDKRAX-CVEARBPZSA-N 1 3 327.488 2.628 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+]Cc2ccc(C)nc2C)CCCC1)N(C)C ZINC001374162833 1341485379 /nfs/dbraw/zinc/48/53/79/1341485379.db2.gz JDYLDUZGFLTOCW-GOSISDBHSA-N 1 3 346.519 2.557 10 0 EFAEHO CCc1cccc(CN2CC3(C2)CCN(C(=O)CC[NH+](C)C)CC3)c1 ZINC001374183100 1341525228 /nfs/dbraw/zinc/52/52/28/1341525228.db2.gz AWJQZPHYIPGJKP-UHFFFAOYSA-N 1 3 343.515 2.625 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C[C@@H](C)N(C)C(=O)[C@@H]1CCCN1C ZINC001374204204 1341552458 /nfs/dbraw/zinc/55/24/58/1341552458.db2.gz CRMXPMZBIAHHCV-APWZRJJASA-N 1 3 331.504 2.841 10 0 EFAEHO C[C@H](CNCc1ccccn1)N(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001374246903 1341603394 /nfs/dbraw/zinc/60/33/94/1341603394.db2.gz IZJATMLQQOUKLE-MRXNPFEDSA-N 1 3 346.519 2.671 10 0 EFAEHO C[C@H](CNCc1ccccn1)N(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001374246903 1341603397 /nfs/dbraw/zinc/60/33/97/1341603397.db2.gz IZJATMLQQOUKLE-MRXNPFEDSA-N 1 3 346.519 2.671 10 0 EFAEHO C[C@H](C[NH2+]CC1CC2(CCC2)C1)N(C)C(=O)CN1CCC(C)CC1 ZINC001374303274 1341686897 /nfs/dbraw/zinc/68/68/97/1341686897.db2.gz INCLTDKHQWFNMO-QGZVFWFLSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C[C@@H](C)N(C)C(=O)CN1CCCC1 ZINC001374323488 1341723186 /nfs/dbraw/zinc/72/31/86/1341723186.db2.gz BUNLMZORFXOVDF-OAHLLOKOSA-N 1 3 337.895 2.681 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+]C[C@H](C)N(C)C(=O)CN(C)C(C)C ZINC001374332635 1341740397 /nfs/dbraw/zinc/74/03/97/1341740397.db2.gz WUNJLHPLXGULGB-INIZCTEOSA-N 1 3 348.535 2.790 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+]C[C@@H](C)N(C)C(=O)CN(C)C(C)C ZINC001374332639 1341740424 /nfs/dbraw/zinc/74/04/24/1341740424.db2.gz WUNJLHPLXGULGB-MRXNPFEDSA-N 1 3 348.535 2.790 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C(C)C)c1 ZINC001392248905 1355905735 /nfs/dbraw/zinc/90/57/35/1355905735.db2.gz IEXCFLDJCXJUBO-LJQANCHMSA-N 1 3 333.520 2.874 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1C ZINC001374383383 1341832922 /nfs/dbraw/zinc/83/29/22/1341832922.db2.gz JNTMJNQVJSKSDP-ICSRJNTNSA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]CCC(F)(F)F ZINC001374419795 1341898313 /nfs/dbraw/zinc/89/83/13/1341898313.db2.gz PSWFGHXMILSBRH-ZIAGYGMSSA-N 1 3 337.430 2.542 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]CCC(F)(F)F ZINC001374419794 1341898843 /nfs/dbraw/zinc/89/88/43/1341898843.db2.gz PSWFGHXMILSBRH-UONOGXRCSA-N 1 3 337.430 2.542 10 0 EFAEHO CC(C)[C@H](CNC(=O)CC[NH+](C)C)N[C@@H](C)c1ccc(F)cc1F ZINC001374432582 1341914981 /nfs/dbraw/zinc/91/49/81/1341914981.db2.gz VOUUJTKVHJOQLV-GUYCJALGSA-N 1 3 341.446 2.708 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]C/C=C/c1ccccc1 ZINC001374433973 1341916912 /nfs/dbraw/zinc/91/69/12/1341916912.db2.gz NENABWQKIUCPTE-KIKKHNSFSA-N 1 3 343.515 2.772 10 0 EFAEHO C[C@@H](C[NH2+]CC1CCC2(CC2)CC1)NC(=O)C(C)(C)N1CCCC1 ZINC001392583589 1356137686 /nfs/dbraw/zinc/13/76/86/1356137686.db2.gz SANQAUOOJJYAHG-INIZCTEOSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001374551648 1342060477 /nfs/dbraw/zinc/06/04/77/1342060477.db2.gz ZNVUMZPLKXIRKI-JKSUJKDBSA-N 1 3 347.494 2.788 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001374551648 1342060482 /nfs/dbraw/zinc/06/04/82/1342060482.db2.gz ZNVUMZPLKXIRKI-JKSUJKDBSA-N 1 3 347.494 2.788 10 0 EFAEHO C[C@@H](C[NH2+]CC1CC2(CCC2)C1)NC(=O)C(C)(C)N1CCCCC1 ZINC001374886865 1342223923 /nfs/dbraw/zinc/22/39/23/1342223923.db2.gz NIQGEFMTFWWVLO-INIZCTEOSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1ccccc1F ZINC001374903020 1342232389 /nfs/dbraw/zinc/23/23/89/1342232389.db2.gz AERYRIDBQQLAJR-YJBOKZPZSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CNCc1ccccc1F ZINC001374903020 1342232390 /nfs/dbraw/zinc/23/23/90/1342232390.db2.gz AERYRIDBQQLAJR-YJBOKZPZSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc(F)cc1 ZINC001374939233 1342253886 /nfs/dbraw/zinc/25/38/86/1342253886.db2.gz DINFGHDYUPKMQS-YJBOKZPZSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C[N@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001375059305 1342362453 /nfs/dbraw/zinc/36/24/53/1342362453.db2.gz JYEDWCWHUSVXAF-BEFAXECRSA-N 1 3 344.503 2.691 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C[N@@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001375059305 1342362457 /nfs/dbraw/zinc/36/24/57/1342362457.db2.gz JYEDWCWHUSVXAF-BEFAXECRSA-N 1 3 344.503 2.691 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(F)c1)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001375064300 1342368070 /nfs/dbraw/zinc/36/80/70/1342368070.db2.gz ZAFCQLVHXSXQOT-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(F)c1)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001375064300 1342368081 /nfs/dbraw/zinc/36/80/81/1342368081.db2.gz ZAFCQLVHXSXQOT-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(F)c1)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001375064289 1342368272 /nfs/dbraw/zinc/36/82/72/1342368272.db2.gz ZAFCQLVHXSXQOT-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(F)c1)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001375064289 1342368278 /nfs/dbraw/zinc/36/82/78/1342368278.db2.gz ZAFCQLVHXSXQOT-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)Cc1ccc(Cl)cc1 ZINC001375157323 1342473672 /nfs/dbraw/zinc/47/36/72/1342473672.db2.gz HSGDJKPJBQQNHT-CQSZACIVSA-N 1 3 325.884 2.617 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001375157323 1342473675 /nfs/dbraw/zinc/47/36/75/1342473675.db2.gz HSGDJKPJBQQNHT-CQSZACIVSA-N 1 3 325.884 2.617 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@@H](CNCc1ccccc1F)C1CC1 ZINC001375221769 1342524292 /nfs/dbraw/zinc/52/42/92/1342524292.db2.gz CUPFKYXDHHOHDN-OALUTQOASA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@@H](CNCc1ccccc1F)C1CC1 ZINC001375221769 1342524296 /nfs/dbraw/zinc/52/42/96/1342524296.db2.gz CUPFKYXDHHOHDN-OALUTQOASA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@H](CNCc1ccccc1F)C1CC1 ZINC001375221776 1342524585 /nfs/dbraw/zinc/52/45/85/1342524585.db2.gz CUPFKYXDHHOHDN-RTBURBONSA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@H](CNCc1ccccc1F)C1CC1 ZINC001375221776 1342524589 /nfs/dbraw/zinc/52/45/89/1342524589.db2.gz CUPFKYXDHHOHDN-RTBURBONSA-N 1 3 347.478 2.683 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001375228779 1342532165 /nfs/dbraw/zinc/53/21/65/1342532165.db2.gz LEGQQRPIRAEBOT-OALUTQOASA-N 1 3 329.488 2.545 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]Cc1cccc(F)c1 ZINC001375290346 1342597607 /nfs/dbraw/zinc/59/76/07/1342597607.db2.gz UGRFYQDBDXDLNS-PKOBYXMFSA-N 1 3 349.494 2.883 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@H]2CCCN2C(C)C)CC1 ZINC001393493522 1356895167 /nfs/dbraw/zinc/89/51/67/1356895167.db2.gz KXTTZAUDBGKSIF-BRSBDYLESA-N 1 3 341.515 2.872 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+][C@@H]2CCc3ccccc32)CC1 ZINC001375419937 1342724049 /nfs/dbraw/zinc/72/40/49/1342724049.db2.gz GFCNSMRSRIVFGI-MOPGFXCFSA-N 1 3 341.499 2.785 10 0 EFAEHO CN(CC(=O)NCC1([NH2+][C@@H]2CCCc3ccccc32)CC1)C1CCC1 ZINC001375428730 1342732169 /nfs/dbraw/zinc/73/21/69/1342732169.db2.gz FSEJIOXZFSMAIU-LJQANCHMSA-N 1 3 341.499 2.787 10 0 EFAEHO C[C@@H](NC1(CNC(=O)CCC[NH+](C)C)CC1)c1cccc(Cl)c1 ZINC001375469618 1342776511 /nfs/dbraw/zinc/77/65/11/1342776511.db2.gz JJWWDUZUYGNQFI-CQSZACIVSA-N 1 3 337.895 2.981 10 0 EFAEHO CN(CC(=O)NCC1([NH2+]C[C@H]2CCC(F)(F)C2)CC1)CC(C)(C)C ZINC001375491359 1342797219 /nfs/dbraw/zinc/79/72/19/1342797219.db2.gz OPAITFVGWXWKTE-AWEZNQCLSA-N 1 3 345.478 2.638 10 0 EFAEHO C[C@H]([NH2+]C1(CNC(=O)CN2CC[C@@H](C)C2)CC1)c1ccc(Cl)cc1 ZINC001375493539 1342800313 /nfs/dbraw/zinc/80/03/13/1342800313.db2.gz YXZHEAWYCYSNQY-CABCVRRESA-N 1 3 349.906 2.981 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001375509637 1342815763 /nfs/dbraw/zinc/81/57/63/1342815763.db2.gz DVMDLYADUJKNFH-IZAXUBKRSA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+][C@@H](C)c2ccc3c(c2)CCC3)CC1)N(C)C ZINC001375521095 1342830251 /nfs/dbraw/zinc/83/02/51/1342830251.db2.gz LANMAJKNQIGMHA-KXBFYZLASA-N 1 3 343.515 2.815 10 0 EFAEHO C[C@@H](NC1(CNC(=O)C[C@@H]2CC[N@H+](C)C2)CC1)c1cccc(Cl)c1 ZINC001375523792 1342833743 /nfs/dbraw/zinc/83/37/43/1342833743.db2.gz XKPHYIHORJROSK-CABCVRRESA-N 1 3 349.906 2.981 10 0 EFAEHO C[C@@H](NC1(CNC(=O)C[C@@H]2CC[N@@H+](C)C2)CC1)c1cccc(Cl)c1 ZINC001375523792 1342833753 /nfs/dbraw/zinc/83/37/53/1342833753.db2.gz XKPHYIHORJROSK-CABCVRRESA-N 1 3 349.906 2.981 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]([NH2+]Cc2ccccc2)C1)N1CCCC1 ZINC001375544118 1342856167 /nfs/dbraw/zinc/85/61/67/1342856167.db2.gz RSILZEIDJAYJIT-IYARVYRRSA-N 1 3 329.488 2.545 10 0 EFAEHO CC(C)CC[NH2+][C@H]1C[C@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001375551112 1342865429 /nfs/dbraw/zinc/86/54/29/1342865429.db2.gz UDCVYLJLXNELGD-GPMSIDNRSA-N 1 3 341.515 2.729 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1C[C@@H]([NH2+]CC2CCCC2)C1)N1CCCCCC1 ZINC001375559669 1342872116 /nfs/dbraw/zinc/87/21/16/1342872116.db2.gz DDZRQIGHDDERHN-YTQUADARSA-N 1 3 335.536 2.926 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2cccc(F)c2)C1 ZINC001375575510 1342894599 /nfs/dbraw/zinc/89/45/99/1342894599.db2.gz FHYINWUVTTZNHB-FUHWJXTLSA-N 1 3 335.467 2.542 10 0 EFAEHO C[NH+](C)CCC(=O)NCCN(Cc1ccccn1)C1CCCCCC1 ZINC001375591870 1342909796 /nfs/dbraw/zinc/90/97/96/1342909796.db2.gz BXAFRDYOMNHBGV-UHFFFAOYSA-N 1 3 346.519 2.674 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CC2CC3(CCC3)C2)C[C@H]1C ZINC001375741062 1342967933 /nfs/dbraw/zinc/96/79/33/1342967933.db2.gz OZDIQTUXOVZPQI-SJLPKXTDSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)c(C)n1 ZINC001375741355 1342968280 /nfs/dbraw/zinc/96/82/80/1342968280.db2.gz PZLJOWHBPXLFLQ-APWZRJJASA-N 1 3 346.519 2.508 10 0 EFAEHO CC[NH2+]C[C@@H](NC(=O)[C@@H](CC)N(C)C)c1ccc2ccccc2c1 ZINC001375787350 1343013015 /nfs/dbraw/zinc/01/30/15/1343013015.db2.gz YYFCWAOJZXDHRR-RTBURBONSA-N 1 3 327.472 2.947 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C[NH2+]Cc1ccsc1)C1CCCC1)N(C)C ZINC001375798349 1343026204 /nfs/dbraw/zinc/02/62/04/1343026204.db2.gz WCYKKXCDTYJROE-IRXDYDNUSA-N 1 3 337.533 2.853 10 0 EFAEHO CC(C)c1ccc(CN2CC[C@](C)(NC(=O)CC[NH+](C)C)C2)cc1 ZINC001375844096 1343081408 /nfs/dbraw/zinc/08/14/08/1343081408.db2.gz ORMXWOMBOJNMOL-FQEVSTJZSA-N 1 3 331.504 2.842 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2cccc(C)c2)C1)N(C)C ZINC001375895101 1343141820 /nfs/dbraw/zinc/14/18/20/1343141820.db2.gz GPEIRBLAAAGZOS-UYAOXDASSA-N 1 3 331.504 2.663 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(C)CCN(C/C=C\Cl)CC2)CC[N@@H+]1C ZINC001375920484 1343168560 /nfs/dbraw/zinc/16/85/60/1343168560.db2.gz AGEUPNFLNLITAD-YDULJECNSA-N 1 3 341.927 2.688 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(C)CCN(C/C=C\Cl)CC2)CC[N@H+]1C ZINC001375920484 1343168561 /nfs/dbraw/zinc/16/85/61/1343168561.db2.gz AGEUPNFLNLITAD-YDULJECNSA-N 1 3 341.927 2.688 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](NCC=C(Cl)Cl)C1CC1 ZINC001376210952 1343401435 /nfs/dbraw/zinc/40/14/35/1343401435.db2.gz BEUAXPLAIGTASX-KGLIPLIRSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NC[C@@H](NCC=C(Cl)Cl)C1CC1 ZINC001376210952 1343401437 /nfs/dbraw/zinc/40/14/37/1343401437.db2.gz BEUAXPLAIGTASX-KGLIPLIRSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]([NH2+]CC1CCCC1)C1CC1)N1CCCCC1 ZINC001376219837 1343407386 /nfs/dbraw/zinc/40/73/86/1343407386.db2.gz NUJYUZCVHVJAFY-GOSISDBHSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CCC1CCCC1)C1CC1 ZINC001376223418 1343409089 /nfs/dbraw/zinc/40/90/89/1343409089.db2.gz RVYBUTQZLYYHNY-RBUKOAKNSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+][C@H](C)c2ccc(Cl)cc2)C1 ZINC001376353035 1343506686 /nfs/dbraw/zinc/50/66/86/1343506686.db2.gz NFQOJSRUGHIIOE-PBHICJAKSA-N 1 3 337.895 2.932 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001376361776 1343515378 /nfs/dbraw/zinc/51/53/78/1343515378.db2.gz LHKGNWIJUVWFNV-WMZOPIPTSA-N 1 3 349.494 2.658 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@H]2CCc3c2cccc3Cl)C1 ZINC001376405647 1343560867 /nfs/dbraw/zinc/56/08/67/1343560867.db2.gz JOZLGESOASOXMS-DEYYWGMASA-N 1 3 349.906 2.904 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2Cl)C1 ZINC001376410540 1343566137 /nfs/dbraw/zinc/56/61/37/1343566137.db2.gz VOOREAUPQLENDR-KKUMJFAQSA-N 1 3 337.895 2.978 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2C[N@@H+](Cc3ccsc3)C[C@@H]2C1)CC(C)(C)C ZINC001376418580 1343572861 /nfs/dbraw/zinc/57/28/61/1343572861.db2.gz OKQLZSMMEBRBJN-CALCHBBNSA-N 1 3 349.544 2.616 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2C[N@H+](Cc3ccsc3)C[C@@H]2C1)CC(C)(C)C ZINC001376418580 1343572863 /nfs/dbraw/zinc/57/28/63/1343572863.db2.gz OKQLZSMMEBRBJN-CALCHBBNSA-N 1 3 349.544 2.616 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)CC[C@@H]21 ZINC001376451148 1343604028 /nfs/dbraw/zinc/60/40/28/1343604028.db2.gz KOXALVNJBIXSEI-IRXDYDNUSA-N 1 3 335.517 2.513 10 0 EFAEHO C[C@H]([NH2+][C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)C1)c1ccc(F)cc1 ZINC001376462972 1343610447 /nfs/dbraw/zinc/61/04/47/1343610447.db2.gz KANJNXZONIWSMF-RRQGHBQHSA-N 1 3 333.451 2.608 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC2CCC3(CC3)CC2)C1)N(C)C ZINC001376469365 1343614356 /nfs/dbraw/zinc/61/43/56/1343614356.db2.gz LKFULJAEFXUWAM-KSZLIROESA-N 1 3 335.536 2.780 10 0 EFAEHO CCCc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001376486578 1343622303 /nfs/dbraw/zinc/62/23/03/1343622303.db2.gz FWHUCVHXXXQKIG-HSALFYBXSA-N 1 3 345.531 2.962 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001376492318 1343625166 /nfs/dbraw/zinc/62/51/66/1343625166.db2.gz UZWQTYQMPCZPGO-YSHGAJCASA-N 1 3 331.504 2.879 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2cc(C)ccc2C)C1 ZINC001376493236 1343625434 /nfs/dbraw/zinc/62/54/34/1343625434.db2.gz IKJOKRPVJKSJAS-KURKYZTESA-N 1 3 331.504 2.943 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H]2C[N@H+](CCC3CC3)C[C@H]21)N(CC)CC ZINC001376531169 1343656330 /nfs/dbraw/zinc/65/63/30/1343656330.db2.gz NTHWQPFOVHFZBN-GBESFXJTSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H]2C[N@@H+](CCC3CC3)C[C@H]21)N(CC)CC ZINC001376531169 1343656331 /nfs/dbraw/zinc/65/63/31/1343656331.db2.gz NTHWQPFOVHFZBN-GBESFXJTSA-N 1 3 335.536 2.830 10 0 EFAEHO CN(Cc1ccccc1)Cc1ccccc1CNC(=O)CC[NH+](C)C ZINC001376559019 1343675116 /nfs/dbraw/zinc/67/51/16/1343675116.db2.gz DMMYUNWDAIFWCM-UHFFFAOYSA-N 1 3 339.483 2.887 10 0 EFAEHO C[C@H]([NH2+]CC1CC1)c1ccc(CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001376577841 1343696155 /nfs/dbraw/zinc/69/61/55/1343696155.db2.gz SCYXENJNACZITB-HOTGVXAUSA-N 1 3 329.488 2.705 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H](C)N1CCCCCC1 ZINC001376656540 1343747640 /nfs/dbraw/zinc/74/76/40/1343747640.db2.gz BPAHAVCWBJOTFG-UEDWAMCQSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H](C)N1CCCCCC1 ZINC001376656540 1343747641 /nfs/dbraw/zinc/74/76/41/1343747641.db2.gz BPAHAVCWBJOTFG-UEDWAMCQSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)NCc1cccc2c1CC[N@H+](CCCF)C2)N(C)C ZINC001376671557 1343755564 /nfs/dbraw/zinc/75/55/64/1343755564.db2.gz HJARVVHXOVRXKI-LJQANCHMSA-N 1 3 349.494 2.607 10 0 EFAEHO CC(C)[C@H](C(=O)NCc1cccc2c1CC[N@@H+](CCCF)C2)N(C)C ZINC001376671557 1343755568 /nfs/dbraw/zinc/75/55/68/1343755568.db2.gz HJARVVHXOVRXKI-LJQANCHMSA-N 1 3 349.494 2.607 10 0 EFAEHO COc1cccc(C[NH2+]C[C@H]2CCCCN2C(=O)CN(C)C(C)C)c1 ZINC001376706921 1343775192 /nfs/dbraw/zinc/77/51/92/1343775192.db2.gz LZDRCLGEWJECDM-GOSISDBHSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC(CC)C[NH2+][C@@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001376797059 1343846396 /nfs/dbraw/zinc/84/63/96/1343846396.db2.gz DLHRPGCERRFGKD-KBXCAEBGSA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)c1ccccc1C[NH2+][C@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001376800339 1343849996 /nfs/dbraw/zinc/84/99/96/1343849996.db2.gz LLEJOOWVFKAJPH-IAGOWNOFSA-N 1 3 331.504 2.746 10 0 EFAEHO CC(C)c1ccccc1C[NH2+][C@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001376800338 1343850020 /nfs/dbraw/zinc/85/00/20/1343850020.db2.gz LLEJOOWVFKAJPH-DLBZAZTESA-N 1 3 331.504 2.746 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)CCC[NH+]2CCCC2)c1 ZINC001376877091 1343913090 /nfs/dbraw/zinc/91/30/90/1343913090.db2.gz JJGAVGHGVBQWNE-INIZCTEOSA-N 1 3 335.467 2.604 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H]([N@H+](C)CCCC3CCC3)C2)C1 ZINC001376983610 1344016206 /nfs/dbraw/zinc/01/62/06/1344016206.db2.gz VJQCSTHJOPCVMM-MJGOQNOKSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H]([N@@H+](C)CCCC3CCC3)C2)C1 ZINC001376983610 1344016215 /nfs/dbraw/zinc/01/62/15/1344016215.db2.gz VJQCSTHJOPCVMM-MJGOQNOKSA-N 1 3 335.536 2.831 10 0 EFAEHO CN(CCC[N@H+](C)[C@H]1CCc2ccccc21)C(=O)CN1CCCC1 ZINC001377021776 1344069014 /nfs/dbraw/zinc/06/90/14/1344069014.db2.gz SINOPEWFLOIHOV-IBGZPJMESA-N 1 3 329.488 2.550 10 0 EFAEHO CN(CCC[N@@H+](C)[C@H]1CCc2ccccc21)C(=O)CN1CCCC1 ZINC001377021776 1344069016 /nfs/dbraw/zinc/06/90/16/1344069016.db2.gz SINOPEWFLOIHOV-IBGZPJMESA-N 1 3 329.488 2.550 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(Cl)s1 ZINC001377070842 1344115176 /nfs/dbraw/zinc/11/51/76/1344115176.db2.gz WNLOGNAIHUFMRB-CHWSQXEVSA-N 1 3 343.924 2.728 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC[N@H+](CC1CC(C)(C)C1)C1CC1 ZINC001377566323 1344175996 /nfs/dbraw/zinc/17/59/96/1344175996.db2.gz GNNNVKPXYXEVFP-HZPDHXFCSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC[N@@H+](CC1CC(C)(C)C1)C1CC1 ZINC001377566323 1344175997 /nfs/dbraw/zinc/17/59/97/1344175997.db2.gz GNNNVKPXYXEVFP-HZPDHXFCSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[NH2+][C@@H]2CCc3ccc(Cl)cc32)C1 ZINC001377590704 1344196503 /nfs/dbraw/zinc/19/65/03/1344196503.db2.gz JRELHDNNHSICKC-RDTXWAMCSA-N 1 3 349.906 2.717 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]CCN(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001377590635 1344196537 /nfs/dbraw/zinc/19/65/37/1344196537.db2.gz JMZOYCANDYEWRU-WMZOPIPTSA-N 1 3 331.504 2.754 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]CCN(C)C(=O)CN2CCC(C)CC2)c1 ZINC001377590986 1344197835 /nfs/dbraw/zinc/19/78/35/1344197835.db2.gz GPHNDYOFVNWEHV-KRWDZBQOSA-N 1 3 347.503 2.536 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[N@H+](C)C/C=C\c1ccccc1)N(C)C ZINC001377639513 1344249012 /nfs/dbraw/zinc/24/90/12/1344249012.db2.gz IJGFBKRKWGKYNP-JORPEJITSA-N 1 3 343.515 2.963 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[N@@H+](C)C/C=C\c1ccccc1)N(C)C ZINC001377639513 1344249018 /nfs/dbraw/zinc/24/90/18/1344249018.db2.gz IJGFBKRKWGKYNP-JORPEJITSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@H]([C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001377673904 1344301388 /nfs/dbraw/zinc/30/13/88/1344301388.db2.gz HQVXEKDQWBOGHI-MSOLQXFVSA-N 1 3 346.519 2.949 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@H]([C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001377673904 1344301395 /nfs/dbraw/zinc/30/13/95/1344301395.db2.gz HQVXEKDQWBOGHI-MSOLQXFVSA-N 1 3 346.519 2.949 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2CC[N@H+](CCCC3CCC3)C2)C1 ZINC001377713376 1344358220 /nfs/dbraw/zinc/35/82/20/1344358220.db2.gz XPLOSEHIVFZDBT-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2CC[N@@H+](CCCC3CCC3)C2)C1 ZINC001377713376 1344358224 /nfs/dbraw/zinc/35/82/24/1344358224.db2.gz XPLOSEHIVFZDBT-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO Cc1ccccc1C[NH2+]CC1CC(NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001377716439 1344362702 /nfs/dbraw/zinc/36/27/02/1344362702.db2.gz GRUKERRDTHGROD-NKELODKYSA-N 1 3 331.504 2.566 10 0 EFAEHO CN(C)C1(C(=O)NC2CC(C[NH2+]Cc3ccccc3Cl)C2)CCC1 ZINC001377716643 1344362917 /nfs/dbraw/zinc/36/29/17/1344362917.db2.gz PLGVGRHPZZMVRJ-UHFFFAOYSA-N 1 3 349.906 2.809 10 0 EFAEHO CN(CC(=O)NC1CC(C[NH2+]Cc2ccc(Cl)cc2)C1)C1CCC1 ZINC001377717811 1344364245 /nfs/dbraw/zinc/36/42/45/1344364245.db2.gz SXUGPCGZVBEICG-UHFFFAOYSA-N 1 3 349.906 2.809 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@@H]1CC[N@H+](CCC(C)(C)C)C1)N(C)C ZINC001377718135 1344365462 /nfs/dbraw/zinc/36/54/62/1344365462.db2.gz HIVBJJVBSRGBGO-SJORKVTESA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@@H]1CC[N@@H+](CCC(C)(C)C)C1)N(C)C ZINC001377718135 1344365465 /nfs/dbraw/zinc/36/54/65/1344365465.db2.gz HIVBJJVBSRGBGO-SJORKVTESA-N 1 3 325.541 2.837 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001377734984 1344383279 /nfs/dbraw/zinc/38/32/79/1344383279.db2.gz FHXGEVIUZZXZMP-AFMYVXGZSA-N 1 3 345.531 2.936 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](C[N@H+](C)C/C=C\c2ccccc2)C1 ZINC001377751304 1344397314 /nfs/dbraw/zinc/39/73/14/1344397314.db2.gz LXCNOXZBWPIQGC-VZDLESTCSA-N 1 3 341.499 2.574 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](C[N@@H+](C)C/C=C\c2ccccc2)C1 ZINC001377751304 1344397320 /nfs/dbraw/zinc/39/73/20/1344397320.db2.gz LXCNOXZBWPIQGC-VZDLESTCSA-N 1 3 341.499 2.574 10 0 EFAEHO CCc1cccc(C[N@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001377778218 1344427397 /nfs/dbraw/zinc/42/73/97/1344427397.db2.gz CIOISKANMABNPU-FQEVSTJZSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1cccc(C[N@@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001377778218 1344427401 /nfs/dbraw/zinc/42/74/01/1344427401.db2.gz CIOISKANMABNPU-FQEVSTJZSA-N 1 3 345.531 2.870 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001377804369 1344455482 /nfs/dbraw/zinc/45/54/82/1344455482.db2.gz HISXPXNPXCVYRJ-KBPBESRZSA-N 1 3 337.895 2.807 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)[C@H](C)NC(=O)CCC[NH+](C)C ZINC001377836696 1344492399 /nfs/dbraw/zinc/49/23/99/1344492399.db2.gz FWJIUQOCBVVDTH-CABCVRRESA-N 1 3 339.911 2.973 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)[C@H](C)NCc1cc(Cl)ccc1F ZINC001377869508 1344531608 /nfs/dbraw/zinc/53/16/08/1344531608.db2.gz IVROOYKEDCIXIP-STQMWFEESA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)[C@H](C)NCc1cc(Cl)ccc1F ZINC001377869508 1344531615 /nfs/dbraw/zinc/53/16/15/1344531615.db2.gz IVROOYKEDCIXIP-STQMWFEESA-N 1 3 343.874 2.804 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]Cc1cc(F)ccc1C ZINC001393830784 1357194673 /nfs/dbraw/zinc/19/46/73/1357194673.db2.gz QXVVVGYCGCCNQY-LPHOPBHVSA-N 1 3 349.494 2.993 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]Cc1csc(C)c1 ZINC001393830639 1357194788 /nfs/dbraw/zinc/19/47/88/1357194788.db2.gz MJEKSIMRZGTJNL-WMLDXEAASA-N 1 3 337.533 2.915 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@H+](C)Cc1ccc(Cl)cc1C)N(C)C ZINC001378073505 1344728347 /nfs/dbraw/zinc/72/83/47/1344728347.db2.gz ORPLMPZIADWGJI-WMLDXEAASA-N 1 3 339.911 2.925 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@@H+](C)Cc1ccc(Cl)cc1C)N(C)C ZINC001378073505 1344728353 /nfs/dbraw/zinc/72/83/53/1344728353.db2.gz ORPLMPZIADWGJI-WMLDXEAASA-N 1 3 339.911 2.925 10 0 EFAEHO CC(C)Cc1ccc(CN2CC[C@@H](NC(=O)CC[NH+](C)C)C2)cc1 ZINC001378114059 1344775982 /nfs/dbraw/zinc/77/59/82/1344775982.db2.gz ACQCLGYJVMTIJX-LJQANCHMSA-N 1 3 331.504 2.527 10 0 EFAEHO Cc1ccc(CCC[N@@H+](C)[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001378140311 1344804513 /nfs/dbraw/zinc/80/45/13/1344804513.db2.gz LNWCOXMQRDLEOO-OALUTQOASA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CCC[N@H+](C)[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001378140311 1344804516 /nfs/dbraw/zinc/80/45/16/1344804516.db2.gz LNWCOXMQRDLEOO-OALUTQOASA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)Cc1cccc(C(F)F)c1 ZINC001378246444 1344927497 /nfs/dbraw/zinc/92/74/97/1344927497.db2.gz ZKTMPOPHWDJUHD-CQSZACIVSA-N 1 3 341.446 2.901 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC001378246444 1344927501 /nfs/dbraw/zinc/92/75/01/1344927501.db2.gz ZKTMPOPHWDJUHD-CQSZACIVSA-N 1 3 341.446 2.901 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)NCc1cc2ccccc2o1 ZINC001378248547 1344929493 /nfs/dbraw/zinc/92/94/93/1344929493.db2.gz DTITYQHSZVOGGX-UWWQBHOKSA-N 1 3 343.471 2.757 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)NCc1cc2ccccc2o1 ZINC001378248547 1344929496 /nfs/dbraw/zinc/92/94/96/1344929496.db2.gz DTITYQHSZVOGGX-UWWQBHOKSA-N 1 3 343.471 2.757 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001378254337 1344933240 /nfs/dbraw/zinc/93/32/40/1344933240.db2.gz FSQFYCDWMWHGNY-HKUYNNGSSA-N 1 3 344.503 2.739 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]Cc1ccccc1 ZINC001378295282 1344963648 /nfs/dbraw/zinc/96/36/48/1344963648.db2.gz NFAIMCCCOJDBGE-IEBWSBKVSA-N 1 3 331.504 2.936 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]CCc1ccccc1 ZINC001378301875 1344968744 /nfs/dbraw/zinc/96/87/44/1344968744.db2.gz XSGYXQZFKISNDA-QUCCMNQESA-N 1 3 345.531 2.978 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc2ncccc2c1 ZINC001378332148 1344992955 /nfs/dbraw/zinc/99/29/55/1344992955.db2.gz BXLUNYQATVABBX-SFHVURJKSA-N 1 3 342.487 2.559 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCCN1CC)[NH2+]Cc1cc(C)ccc1F ZINC001378341494 1344999186 /nfs/dbraw/zinc/99/91/86/1344999186.db2.gz PCYYZIMVYCUVFI-IEBWSBKVSA-N 1 3 349.494 2.993 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H]([NH2+]Cc2ccccc2F)CC1 ZINC001378454198 1345090708 /nfs/dbraw/zinc/09/07/08/1345090708.db2.gz OELVJVHZROXQDX-QAQDUYKDSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[C@H]([NH2+]CCC(F)(F)F)CC1)N1CCCC1 ZINC001378455704 1345091431 /nfs/dbraw/zinc/09/14/31/1345091431.db2.gz VNSWPMCNRLWAEG-HDJSIYSDSA-N 1 3 349.441 2.830 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccc(C[NH2+]CC3CCCC3)cc2)C1 ZINC001378468098 1345102970 /nfs/dbraw/zinc/10/29/70/1345102970.db2.gz QEOVXFPNBZTHQA-KRWDZBQOSA-N 1 3 343.515 2.924 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC1CC[NH+](Cc2cccc(F)c2)CC1 ZINC001378499889 1345125734 /nfs/dbraw/zinc/12/57/34/1345125734.db2.gz YMIVYAHRXZFUIA-UHFFFAOYSA-N 1 3 349.494 2.884 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCCC[C@@H](NCC=C(Cl)Cl)C1 ZINC001417841580 1373322270 /nfs/dbraw/zinc/32/22/70/1373322270.db2.gz STIYSLSJVZNJQL-CYBMUJFWSA-N 1 3 336.307 2.618 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH+]1CC([C@@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001378582328 1345177958 /nfs/dbraw/zinc/17/79/58/1345177958.db2.gz DPPQQEUDCORTBJ-IAGOWNOFSA-N 1 3 331.504 2.833 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@H](C)C[NH2+]Cc1cc(C)ccc1F ZINC001378632913 1345211985 /nfs/dbraw/zinc/21/19/85/1345211985.db2.gz KOSZXALZFVEIMF-VQIMIIECSA-N 1 3 349.494 2.850 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001378662101 1345234352 /nfs/dbraw/zinc/23/43/52/1345234352.db2.gz YZGTXIXTFUMTKG-IAGOWNOFSA-N 1 3 337.552 2.835 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001378662101 1345234354 /nfs/dbraw/zinc/23/43/54/1345234354.db2.gz YZGTXIXTFUMTKG-IAGOWNOFSA-N 1 3 337.552 2.835 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+]C[C@H]2CCC(F)(F)C2)CCCC1)N(C)C ZINC001378711709 1345266406 /nfs/dbraw/zinc/26/64/06/1345266406.db2.gz ZONQOJKAVSWHGR-GJZGRUSLSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@H](C)N(C)C(=O)[C@@H]2CCCN2C)cc1 ZINC001378750847 1345292139 /nfs/dbraw/zinc/29/21/39/1345292139.db2.gz HQYKNSHSZRAPGW-LPHOPBHVSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1cccc2cccnc21)N(C)C ZINC001378779510 1345309984 /nfs/dbraw/zinc/30/99/84/1345309984.db2.gz PUYOZZAJDNBRGD-MAUKXSAKSA-N 1 3 342.487 2.512 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001378824166 1345342322 /nfs/dbraw/zinc/34/23/22/1345342322.db2.gz DCBAJTZVWIRASM-WMZOPIPTSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H](C)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001378828492 1345345433 /nfs/dbraw/zinc/34/54/33/1345345433.db2.gz KXAXIPXHSNDBHQ-YJBOKZPZSA-N 1 3 331.504 2.582 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(Cl)s1 ZINC001378853434 1345365405 /nfs/dbraw/zinc/36/54/05/1345365405.db2.gz BMLRCYGHMGJPKA-GFCCVEGCSA-N 1 3 331.913 2.678 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C[C@H](C)N(C)C(=O)CN2CCCC2)c1 ZINC001378856634 1345368005 /nfs/dbraw/zinc/36/80/05/1345368005.db2.gz WORMVDATQAGXGL-ROUUACIJSA-N 1 3 331.504 2.897 10 0 EFAEHO CC[C@@H]([NH2+]C[C@H]1C[C@H](NC(=O)[C@@H](CC)N(C)C)C1)c1ccccc1 ZINC001378868931 1345378449 /nfs/dbraw/zinc/37/84/49/1345378449.db2.gz IZCCNLLSFJCENL-NXWXRZEISA-N 1 3 331.504 2.962 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]CC1CC1)C1CCCCC1 ZINC001378888240 1345398124 /nfs/dbraw/zinc/39/81/24/1345398124.db2.gz UFWPCOZOWHFNKM-RTBURBONSA-N 1 3 335.536 2.926 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]CC1CC1)C1CCCCC1 ZINC001378888239 1345398597 /nfs/dbraw/zinc/39/85/97/1345398597.db2.gz UFWPCOZOWHFNKM-RBUKOAKNSA-N 1 3 335.536 2.926 10 0 EFAEHO C[N@H+](CCC1CCN(C(=O)CN2CCCC2)CC1)CCC(F)(F)F ZINC001378928116 1345433471 /nfs/dbraw/zinc/43/34/71/1345433471.db2.gz YKIKLJKNFRTOTM-UHFFFAOYSA-N 1 3 349.441 2.595 10 0 EFAEHO C[N@@H+](CCC1CCN(C(=O)CN2CCCC2)CC1)CCC(F)(F)F ZINC001378928116 1345433475 /nfs/dbraw/zinc/43/34/75/1345433475.db2.gz YKIKLJKNFRTOTM-UHFFFAOYSA-N 1 3 349.441 2.595 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[N@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001393884121 1357251016 /nfs/dbraw/zinc/25/10/16/1357251016.db2.gz PWDNUTXIDWEBLY-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001393884121 1357251021 /nfs/dbraw/zinc/25/10/21/1357251021.db2.gz PWDNUTXIDWEBLY-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)CN(C)C(=O)[C@@H]1CCCN1C ZINC001379099388 1345576040 /nfs/dbraw/zinc/57/60/40/1345576040.db2.gz DOHMCFOGEAMHAW-KXBFYZLASA-N 1 3 346.519 2.544 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)C[C@H]2CC[N@H+](C)C2)cc1C ZINC001379123195 1345600877 /nfs/dbraw/zinc/60/08/77/1345600877.db2.gz BRGLRIZMFQUZND-LJQANCHMSA-N 1 3 331.504 2.535 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)C[C@H]2CC[N@@H+](C)C2)cc1C ZINC001379123195 1345600880 /nfs/dbraw/zinc/60/08/80/1345600880.db2.gz BRGLRIZMFQUZND-LJQANCHMSA-N 1 3 331.504 2.535 10 0 EFAEHO CC(C)c1ccccc1C[N@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001379132152 1345609793 /nfs/dbraw/zinc/60/97/93/1345609793.db2.gz NVHAONATCJDJAO-UHFFFAOYSA-N 1 3 331.504 2.796 10 0 EFAEHO CC(C)c1ccccc1C[N@@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001379132152 1345609795 /nfs/dbraw/zinc/60/97/95/1345609795.db2.gz NVHAONATCJDJAO-UHFFFAOYSA-N 1 3 331.504 2.796 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@@H]2C[NH2+]CC2CC(C)(C)C2)CCC1 ZINC001379156684 1345632257 /nfs/dbraw/zinc/63/22/57/1345632257.db2.gz QQTFQHRQMGQVGP-SJORKVTESA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc1cc2ccccc2o1)N(C)C ZINC001379264912 1345686906 /nfs/dbraw/zinc/68/69/06/1345686906.db2.gz ZQCWDSYPSRBKQC-RHSMWYFYSA-N 1 3 331.460 2.710 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]CCc1ccccc1 ZINC001379331315 1345733122 /nfs/dbraw/zinc/73/31/22/1345733122.db2.gz QBKHRDUFCVXVSC-HKUYNNGSSA-N 1 3 331.504 2.540 10 0 EFAEHO C[C@H](CN[C@@H](C)c1cccc(Cl)c1F)NC(=O)CCC[NH+](C)C ZINC001379411913 1345769546 /nfs/dbraw/zinc/76/95/46/1345769546.db2.gz ACWHTADVZUPNKV-OLZOCXBDSA-N 1 3 343.874 2.976 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCCN2C(C)C)c(C)n1 ZINC001379432881 1345783089 /nfs/dbraw/zinc/78/30/89/1345783089.db2.gz LLQMVLTYGPYNAZ-APWZRJJASA-N 1 3 346.519 2.556 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCCN2C(C)C)cc1F ZINC001379563945 1345868533 /nfs/dbraw/zinc/86/85/33/1345868533.db2.gz QCJRRJXIFYYLEJ-LPHOPBHVSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)CN[C@H](C)c1cccc(Cl)c1F ZINC001379579093 1345884310 /nfs/dbraw/zinc/88/43/10/1345884310.db2.gz IAPFELWYGLFMAS-QWHCGFSZSA-N 1 3 343.874 2.976 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)CN[C@H](C)c1cccc(Cl)c1F ZINC001379579093 1345884311 /nfs/dbraw/zinc/88/43/11/1345884311.db2.gz IAPFELWYGLFMAS-QWHCGFSZSA-N 1 3 343.874 2.976 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@H]([C@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001393899931 1357269937 /nfs/dbraw/zinc/26/99/37/1357269937.db2.gz VOVLCXITHRNXMG-OALUTQOASA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@H]([C@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001393899931 1357269943 /nfs/dbraw/zinc/26/99/43/1357269943.db2.gz VOVLCXITHRNXMG-OALUTQOASA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2cc(C)ccc2C)C1)N(C)C ZINC001393906594 1357275065 /nfs/dbraw/zinc/27/50/65/1357275065.db2.gz IXXVHFBVZSXEKP-NKELODKYSA-N 1 3 331.504 2.628 10 0 EFAEHO C[C@@H](NCc1cc2ccccc2o1)[C@@H](C)NC(=O)CCC[NH+](C)C ZINC001393960828 1357326709 /nfs/dbraw/zinc/32/67/09/1357326709.db2.gz GPUREFVIYZHPGY-HUUCEWRRSA-N 1 3 331.460 2.757 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H](C)[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001393966948 1357333093 /nfs/dbraw/zinc/33/30/93/1357333093.db2.gz WSOBMNULCRQDHN-HOTGVXAUSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(CN2CCC[C@@H](NC(=O)CC[NH+](C)C)[C@@H]2C)cc1C ZINC001379647411 1347225421 /nfs/dbraw/zinc/22/54/21/1347225421.db2.gz CYTYCLPCJODAHJ-PKOBYXMFSA-N 1 3 331.504 2.724 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NCC2(NCC=C(Cl)Cl)CCCC2)C1 ZINC001419620315 1375557905 /nfs/dbraw/zinc/55/79/05/1375557905.db2.gz HTAJYVSBKPUZDM-CYBMUJFWSA-N 1 3 348.318 2.666 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NCC2(NCC=C(Cl)Cl)CCCC2)C1 ZINC001419620315 1375557914 /nfs/dbraw/zinc/55/79/14/1375557914.db2.gz HTAJYVSBKPUZDM-CYBMUJFWSA-N 1 3 348.318 2.666 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NCC2(NCC=C(Cl)Cl)CCCC2)C1 ZINC001419620318 1375558565 /nfs/dbraw/zinc/55/85/65/1375558565.db2.gz HTAJYVSBKPUZDM-ZDUSSCGKSA-N 1 3 348.318 2.666 10 0 EFAEHO COc1cccc([C@@H](C)N(C)C[C@@H](C)NC(=O)C2(C[NH+](C)C)CC2)c1 ZINC001379724163 1347287212 /nfs/dbraw/zinc/28/72/12/1347287212.db2.gz NVNGAJBHAQKHFC-HZPDHXFCSA-N 1 3 347.503 2.535 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H]1CN(C(=O)CN(C)C(C)C)CC1(C)C ZINC001379731554 1347292638 /nfs/dbraw/zinc/29/26/38/1347292638.db2.gz XGCBHFIOTCJJBB-SFHVURJKSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@H](CN(C)[C@H](C)c1cccc(Cl)c1)NC(=O)CC[NH+](C)C ZINC001379744856 1347301171 /nfs/dbraw/zinc/30/11/71/1347301171.db2.gz SDOARJWMUUGRIO-ZIAGYGMSSA-N 1 3 325.884 2.789 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C[N@H+](C)CCC1CCCCC1)N(C)C ZINC001379776300 1347326548 /nfs/dbraw/zinc/32/65/48/1347326548.db2.gz ZLCIFZMVSJWQSY-AEFFLSMTSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C[N@@H+](C)CCC1CCCCC1)N(C)C ZINC001379776300 1347326552 /nfs/dbraw/zinc/32/65/52/1347326552.db2.gz ZLCIFZMVSJWQSY-AEFFLSMTSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC001379792793 1347342914 /nfs/dbraw/zinc/34/29/14/1347342914.db2.gz BQRUKKZOHOZDFV-VQIMIIECSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC001379792793 1347342917 /nfs/dbraw/zinc/34/29/17/1347342917.db2.gz BQRUKKZOHOZDFV-VQIMIIECSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1)[NH+]1CCCC1 ZINC001379797694 1347346484 /nfs/dbraw/zinc/34/64/84/1347346484.db2.gz LTNVRLDVXYUQML-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]CC1CCC(F)(F)CC1)C1CC1)N(C)C ZINC001379877374 1347382752 /nfs/dbraw/zinc/38/27/52/1347382752.db2.gz XPRWNKNGANGXHW-HZPDHXFCSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]Cc1cccc(Cl)c1)C1CC1 ZINC001379922178 1347405828 /nfs/dbraw/zinc/40/58/28/1347405828.db2.gz QTQVPITYAKCWMH-QGZVFWFLSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CC[C@H](C)F)C(=O)CN1CCC(C)CC1 ZINC001380037046 1347476435 /nfs/dbraw/zinc/47/64/35/1347476435.db2.gz UPXFTGHSVFZJMA-KRWDZBQOSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)N(CC[N@H+](C)CC[C@H](C)F)C(=O)CN1CCC(C)CC1 ZINC001380037046 1347476436 /nfs/dbraw/zinc/47/64/36/1347476436.db2.gz UPXFTGHSVFZJMA-KRWDZBQOSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)N(CCN(C)CCc1cccs1)C(=O)C12CC[NH+](CC1)C2 ZINC001380048983 1347486353 /nfs/dbraw/zinc/48/63/53/1347486353.db2.gz XPITXOJWNIXQAR-UHFFFAOYSA-N 1 3 349.544 2.555 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](NC(=O)CN(C)C(C)C)C(C)(C)C)c(C)n1 ZINC001380097276 1347514086 /nfs/dbraw/zinc/51/40/86/1347514086.db2.gz XFUGNWQMCLAUSS-SFHVURJKSA-N 1 3 348.535 2.659 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C1CC[NH+](CC2CC(F)(F)C2)CC1)N(C)C ZINC001380127750 1347523962 /nfs/dbraw/zinc/52/39/62/1347523962.db2.gz CFRHEOMDSKENNR-CJNGLKHVSA-N 1 3 345.478 2.589 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1(N[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC001380158985 1347540248 /nfs/dbraw/zinc/54/02/48/1347540248.db2.gz HJIQHKWJDGWYOX-AWEZNQCLSA-N 1 3 337.895 2.981 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1(N[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC001380158985 1347540251 /nfs/dbraw/zinc/54/02/51/1347540251.db2.gz HJIQHKWJDGWYOX-AWEZNQCLSA-N 1 3 337.895 2.981 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C2(CNC(=O)[C@H](C(C)C)N(C)C)CC2)c1 ZINC001380159565 1347540516 /nfs/dbraw/zinc/54/05/16/1347540516.db2.gz KKMDSLAGKWPESY-YJBOKZPZSA-N 1 3 347.503 2.581 10 0 EFAEHO Cc1ccc(F)c(CNC2CC(N(C)C(=O)CCC[NH+](C)C)C2)c1 ZINC001380167868 1347545425 /nfs/dbraw/zinc/54/54/25/1347545425.db2.gz PKSJZZGOSOMSBU-UHFFFAOYSA-N 1 3 335.467 2.555 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2cc(C)ccc2C)C1)N(C)C ZINC001380175395 1347549512 /nfs/dbraw/zinc/54/95/12/1347549512.db2.gz CKCFWIFILDHOOB-CTWPCTMYSA-N 1 3 331.504 2.723 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)[C@@H](C)C1 ZINC001380272189 1347563733 /nfs/dbraw/zinc/56/37/33/1347563733.db2.gz SUEWBUHDSKIDDU-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO C[C@H](NC[C@H]1CCCN1C(=O)CC[NH+](C)C)c1ccccc1Cl ZINC001380290111 1347571115 /nfs/dbraw/zinc/57/11/15/1347571115.db2.gz MOSSEUMVZHPANU-LSDHHAIUSA-N 1 3 337.895 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001380293154 1347572674 /nfs/dbraw/zinc/57/26/74/1347572674.db2.gz WJZORXRMMUQOFI-MJGOQNOKSA-N 1 3 347.478 2.734 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C[NH2+]CC1CCC1)C1CCCC1 ZINC001380319963 1347591299 /nfs/dbraw/zinc/59/12/99/1347591299.db2.gz VHQCYQAYQHWKTB-MOPGFXCFSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)(C(=O)N[C@@H](C[NH2+]CC1CCC1)C1CCCC1)N1CCCC1 ZINC001380321505 1347592252 /nfs/dbraw/zinc/59/22/52/1347592252.db2.gz HASRECVKBCRLNX-SFHVURJKSA-N 1 3 335.536 2.926 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@]1(C)CCN(C(=O)[C@@H](CC)N(C)C)C1 ZINC001380410085 1347653158 /nfs/dbraw/zinc/65/31/58/1347653158.db2.gz UCDXYLIXMROCAB-CTNGQTDRSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1(C)CC[NH+](C[C@@H](F)CC)CC1 ZINC001380437666 1347670345 /nfs/dbraw/zinc/67/03/45/1347670345.db2.gz CWHSFKQSQOIUPE-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCCC(C)C)C2 ZINC001380655797 1347792677 /nfs/dbraw/zinc/79/26/77/1347792677.db2.gz CFIREIMBPXHOMP-ULQDDVLXSA-N 1 3 332.492 2.666 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCCC(C)C)C2 ZINC001380655797 1347792682 /nfs/dbraw/zinc/79/26/82/1347792682.db2.gz CFIREIMBPXHOMP-ULQDDVLXSA-N 1 3 332.492 2.666 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001380677353 1347806093 /nfs/dbraw/zinc/80/60/93/1347806093.db2.gz KVSDFBRNXOUOOR-UYAOXDASSA-N 1 3 345.531 2.970 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001380679413 1347808623 /nfs/dbraw/zinc/80/86/23/1347808623.db2.gz OXMGNRCYSUNFDU-QUCCMNQESA-N 1 3 345.531 2.970 10 0 EFAEHO CC[C@@H](C)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)C2 ZINC001380686169 1347813525 /nfs/dbraw/zinc/81/35/25/1347813525.db2.gz YJPGGQDVIWWSEQ-IEWDOMPSSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)C2 ZINC001380686169 1347813528 /nfs/dbraw/zinc/81/35/28/1347813528.db2.gz YJPGGQDVIWWSEQ-IEWDOMPSSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001380689720 1347815764 /nfs/dbraw/zinc/81/57/64/1347815764.db2.gz LUHFLHKFZAAUSE-AEFFLSMTSA-N 1 3 335.536 2.593 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](CC[NH2+][C@H](C)c2ccccc2)C1 ZINC001380783917 1347875543 /nfs/dbraw/zinc/87/55/43/1347875543.db2.gz RLVDYFNITLGTJR-QZTJIDSGSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+]CC2CC3(CCC3)C2)CCC1)N(C)C ZINC001380863484 1347921898 /nfs/dbraw/zinc/92/18/98/1347921898.db2.gz VNVDNPFELWRUMQ-KRWDZBQOSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+]Cc2ccc3cc[nH]c3c2)CCC1)N(C)C ZINC001380898919 1347944130 /nfs/dbraw/zinc/94/41/30/1347944130.db2.gz VVPKYFZGNJIOQR-SFHVURJKSA-N 1 3 342.487 2.637 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CCCN(C/C=C/Cl)CC1 ZINC001380933341 1347965998 /nfs/dbraw/zinc/96/59/98/1347965998.db2.gz WBLZLHTYILQTCW-HDRDLZFGSA-N 1 3 327.900 2.584 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CCCN(C/C=C/Cl)CC1 ZINC001380933341 1347966001 /nfs/dbraw/zinc/96/60/01/1347966001.db2.gz WBLZLHTYILQTCW-HDRDLZFGSA-N 1 3 327.900 2.584 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@H+](CCc2ccccc2F)CC1 ZINC001380953196 1347981694 /nfs/dbraw/zinc/98/16/94/1347981694.db2.gz YXDHJFXNEULWLX-GOSISDBHSA-N 1 3 349.494 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@@H+](CCc2ccccc2F)CC1 ZINC001380953196 1347981699 /nfs/dbraw/zinc/98/16/99/1347981699.db2.gz YXDHJFXNEULWLX-GOSISDBHSA-N 1 3 349.494 2.679 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001380960267 1347986405 /nfs/dbraw/zinc/98/64/05/1347986405.db2.gz FWCOUELHKABBPY-LJQANCHMSA-N 1 3 344.503 2.788 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001380960267 1347986410 /nfs/dbraw/zinc/98/64/10/1347986410.db2.gz FWCOUELHKABBPY-LJQANCHMSA-N 1 3 344.503 2.788 10 0 EFAEHO C[C@@H](c1cccc(F)c1)[N@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001380978274 1348000107 /nfs/dbraw/zinc/00/01/07/1348000107.db2.gz BBAPXHHRRIRCKR-INIZCTEOSA-N 1 3 335.467 2.763 10 0 EFAEHO C[C@@H](c1cccc(F)c1)[N@@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001380978274 1348000109 /nfs/dbraw/zinc/00/01/09/1348000109.db2.gz BBAPXHHRRIRCKR-INIZCTEOSA-N 1 3 335.467 2.763 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001380980745 1348002047 /nfs/dbraw/zinc/00/20/47/1348002047.db2.gz ICNQBUIPWUJHHD-JKSUJKDBSA-N 1 3 347.494 2.932 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001380980745 1348002049 /nfs/dbraw/zinc/00/20/49/1348002049.db2.gz ICNQBUIPWUJHHD-JKSUJKDBSA-N 1 3 347.494 2.932 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N(C)CCCN(C)Cc1ccsc1 ZINC001380987377 1348007339 /nfs/dbraw/zinc/00/73/39/1348007339.db2.gz GYKGYVUQNGSBCW-IYBDPMFKSA-N 1 3 337.533 2.901 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N(C)CCCN(C)Cc1ccsc1 ZINC001380987377 1348007343 /nfs/dbraw/zinc/00/73/43/1348007343.db2.gz GYKGYVUQNGSBCW-IYBDPMFKSA-N 1 3 337.533 2.901 10 0 EFAEHO CCC1([NH2+]CC[C@@H](C)F)CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001381020992 1348023047 /nfs/dbraw/zinc/02/30/47/1348023047.db2.gz UBLGXDSOUXSLMM-OAHLLOKOSA-N 1 3 327.488 2.580 10 0 EFAEHO CCC1(NC/C(Cl)=C/Cl)CCN(C(=O)[C@@H]2CC[N@H+](C)C2)CC1 ZINC001381024415 1348026369 /nfs/dbraw/zinc/02/63/69/1348026369.db2.gz YJFNPPZSIIVDNT-JFBXQDQPSA-N 1 3 348.318 2.618 10 0 EFAEHO CCC1(NC/C(Cl)=C/Cl)CCN(C(=O)[C@@H]2CC[N@@H+](C)C2)CC1 ZINC001381024415 1348026373 /nfs/dbraw/zinc/02/63/73/1348026373.db2.gz YJFNPPZSIIVDNT-JFBXQDQPSA-N 1 3 348.318 2.618 10 0 EFAEHO CN(CC(=O)NCc1ccc2c(c1)C[N@@H+](CCC1CC1)C2)C1CCC1 ZINC001381071659 1348057620 /nfs/dbraw/zinc/05/76/20/1348057620.db2.gz YCCWPFMVVJBINS-UHFFFAOYSA-N 1 3 341.499 2.903 10 0 EFAEHO CN(CC(=O)NCc1ccc2c(c1)C[N@H+](CCC1CC1)C2)C1CCC1 ZINC001381071659 1348057624 /nfs/dbraw/zinc/05/76/24/1348057624.db2.gz YCCWPFMVVJBINS-UHFFFAOYSA-N 1 3 341.499 2.903 10 0 EFAEHO CC(C)CC[NH2+][C@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@@H]1C ZINC001381126924 1348094389 /nfs/dbraw/zinc/09/43/89/1348094389.db2.gz ZKSWUOXGQQUFPO-LPHOPBHVSA-N 1 3 331.504 2.844 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)N2CCC(C)(NC/C(Cl)=C\Cl)CC2)C1 ZINC001381127861 1348095551 /nfs/dbraw/zinc/09/55/51/1348095551.db2.gz HLTWHNRQJXKKBM-LFGHMXSPSA-N 1 3 348.318 2.618 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)N2CCC(C)(NC/C(Cl)=C\Cl)CC2)C1 ZINC001381127861 1348095552 /nfs/dbraw/zinc/09/55/52/1348095552.db2.gz HLTWHNRQJXKKBM-LFGHMXSPSA-N 1 3 348.318 2.618 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@H+](CCCC(C)C)CC1(C)C)N(C)C ZINC001381137007 1348103046 /nfs/dbraw/zinc/10/30/46/1348103046.db2.gz CMOKDNJXDCEOCA-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@@H+](CCCC(C)C)CC1(C)C)N(C)C ZINC001381137007 1348103052 /nfs/dbraw/zinc/10/30/52/1348103052.db2.gz CMOKDNJXDCEOCA-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C[N@H+](CC)CCC(C)C)CC1)N(C)C ZINC001381252861 1348165161 /nfs/dbraw/zinc/16/51/61/1348165161.db2.gz AEORXGFYWBXPDE-SFHVURJKSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C[N@@H+](CC)CCC(C)C)CC1)N(C)C ZINC001381252861 1348165163 /nfs/dbraw/zinc/16/51/63/1348165163.db2.gz AEORXGFYWBXPDE-SFHVURJKSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[N@H+](CCCC(C)C)CC1CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001381256952 1348167431 /nfs/dbraw/zinc/16/74/31/1348167431.db2.gz PAARIOURNGJORS-UHFFFAOYSA-N 1 3 334.508 2.949 10 0 EFAEHO CC[N@@H+](CCCC(C)C)CC1CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001381256952 1348167436 /nfs/dbraw/zinc/16/74/36/1348167436.db2.gz PAARIOURNGJORS-UHFFFAOYSA-N 1 3 334.508 2.949 10 0 EFAEHO CC[N@H+](CC[C@H](C)F)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001381257023 1348167504 /nfs/dbraw/zinc/16/75/04/1348167504.db2.gz PUBSBAIRSNSRAK-INIZCTEOSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[N@@H+](CC[C@H](C)F)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001381257023 1348167507 /nfs/dbraw/zinc/16/75/07/1348167507.db2.gz PUBSBAIRSNSRAK-INIZCTEOSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C[N@H+](CC)CC[C@@H](C)F)CC1)N(C)C ZINC001381258907 1348168778 /nfs/dbraw/zinc/16/87/78/1348168778.db2.gz WCWIYYQYPPVKKD-WBVHZDCISA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C[N@@H+](CC)CC[C@@H](C)F)CC1)N(C)C ZINC001381258907 1348168781 /nfs/dbraw/zinc/16/87/81/1348168781.db2.gz WCWIYYQYPPVKKD-WBVHZDCISA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@H](F)CC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN(C)C1CCC1 ZINC001381274845 1348179357 /nfs/dbraw/zinc/17/93/57/1348179357.db2.gz HTNUTDVQHHJQBG-BOUXLOLZSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]C[C@@H]2CCCC(F)(F)C2)C1 ZINC001381339294 1348215198 /nfs/dbraw/zinc/21/51/98/1348215198.db2.gz FQGZIVFLWBRSOY-QQFBHYJXSA-N 1 3 345.478 2.637 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001381380837 1348233509 /nfs/dbraw/zinc/23/35/09/1348233509.db2.gz CCIKDPUCLLRIHU-KBPBESRZSA-N 1 3 345.478 2.779 10 0 EFAEHO C[C@@H](NCc1cccnc1)[C@@H](C)NC(=O)CC[N@H+](C)C1CCCCC1 ZINC001381420465 1348260762 /nfs/dbraw/zinc/26/07/62/1348260762.db2.gz YSSAMCPMTGXCHJ-IAGOWNOFSA-N 1 3 346.519 2.719 10 0 EFAEHO C[C@@H](NCc1cccnc1)[C@@H](C)NC(=O)CC[N@@H+](C)C1CCCCC1 ZINC001381420465 1348260768 /nfs/dbraw/zinc/26/07/68/1348260768.db2.gz YSSAMCPMTGXCHJ-IAGOWNOFSA-N 1 3 346.519 2.719 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C(C)C ZINC001381459035 1348289549 /nfs/dbraw/zinc/28/95/49/1348289549.db2.gz WZEJSLOHDYBJPY-HUUCEWRRSA-N 1 3 339.911 2.971 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CCC([NH2+]CCC(F)(F)F)CC1)N(C)C ZINC001381461444 1348290841 /nfs/dbraw/zinc/29/08/41/1348290841.db2.gz DFJIWJYNLOXSCD-JXQTWKCFSA-N 1 3 337.430 2.638 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)N(C)Cc1ccc(C(F)F)cc1 ZINC001381621346 1348410614 /nfs/dbraw/zinc/41/06/14/1348410614.db2.gz PXILNNHSTSNKIS-CZUORRHYSA-N 1 3 339.430 2.512 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(C(F)F)cc1 ZINC001381621346 1348410617 /nfs/dbraw/zinc/41/06/17/1348410617.db2.gz PXILNNHSTSNKIS-CZUORRHYSA-N 1 3 339.430 2.512 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@@H](C)[N@H+](C)Cc1ccc(OC)cc1 ZINC001381639254 1348424190 /nfs/dbraw/zinc/42/41/90/1348424190.db2.gz APAGKCJJCZACKH-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc(OC)cc1 ZINC001381639254 1348424191 /nfs/dbraw/zinc/42/41/91/1348424191.db2.gz APAGKCJJCZACKH-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@@H](C(=O)NC1(C[NH2+]Cc2cncc(C)c2)CCCCC1)N(C)C ZINC001381725680 1348480047 /nfs/dbraw/zinc/48/00/47/1348480047.db2.gz AXOAHGZGFMEMIY-SFHVURJKSA-N 1 3 346.519 2.639 10 0 EFAEHO Cc1ccc(F)c(CN2CCCCC[C@H]2CNC(=O)CC[NH+](C)C)c1 ZINC001381756210 1348504168 /nfs/dbraw/zinc/50/41/68/1348504168.db2.gz GPWYRTXTWFOZTE-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO C[C@@H](NC(=O)CN(C)CC(C)(C)C)C1C[NH+](CCC(C)(C)C)C1 ZINC001381816809 1348547374 /nfs/dbraw/zinc/54/73/74/1348547374.db2.gz CVBZGBVZFHXQQI-OAHLLOKOSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@@H](NC(=O)CN(C)CC(C)(C)C)C1C[NH+](CC2CC3(CCC3)C2)C1 ZINC001381819372 1348549420 /nfs/dbraw/zinc/54/94/20/1348549420.db2.gz FXCZYXVEKDPIKG-MRXNPFEDSA-N 1 3 349.563 2.981 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C3CCC3)C2)c1 ZINC001381964697 1348627997 /nfs/dbraw/zinc/62/79/97/1348627997.db2.gz YUFPVDFEFPRIOU-JCNLHEQBSA-N 1 3 347.478 2.603 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([N@H+](C)Cc2cc(C)ccc2F)CC1 ZINC001381988146 1348643888 /nfs/dbraw/zinc/64/38/88/1348643888.db2.gz IHTXUPBKPNAKIS-UHFFFAOYSA-N 1 3 349.494 2.899 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([N@@H+](C)Cc2cc(C)ccc2F)CC1 ZINC001381988146 1348643893 /nfs/dbraw/zinc/64/38/93/1348643893.db2.gz IHTXUPBKPNAKIS-UHFFFAOYSA-N 1 3 349.494 2.899 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([N@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001381990744 1348646328 /nfs/dbraw/zinc/64/63/28/1348646328.db2.gz YDBOEHRNQBGMDE-KURKYZTESA-N 1 3 335.536 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([N@@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001381990744 1348646331 /nfs/dbraw/zinc/64/63/31/1348646331.db2.gz YDBOEHRNQBGMDE-KURKYZTESA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2cccc(F)c2)C1 ZINC001382014259 1348661957 /nfs/dbraw/zinc/66/19/57/1348661957.db2.gz QSXKMUUDXJCQHY-MPGHIAIKSA-N 1 3 335.467 2.711 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001382030321 1348672733 /nfs/dbraw/zinc/67/27/33/1348672733.db2.gz BKWCRUCANDHQSU-UXHICEINSA-N 1 3 343.515 2.888 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001382092713 1348713411 /nfs/dbraw/zinc/71/34/11/1348713411.db2.gz XKBDCUOVNOCIFA-IEBWSBKVSA-N 1 3 333.520 2.889 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(C)c(F)c1 ZINC001382170497 1348791300 /nfs/dbraw/zinc/79/13/00/1348791300.db2.gz XPVHMWQBNMIDSF-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC001382170526 1348791514 /nfs/dbraw/zinc/79/15/14/1348791514.db2.gz XXWWPNZLROBDBZ-KBPBESRZSA-N 1 3 341.446 2.803 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(C)c(F)c1 ZINC001382170499 1348791632 /nfs/dbraw/zinc/79/16/32/1348791632.db2.gz XPVHMWQBNMIDSF-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)[C@H]1C ZINC001382299702 1348853707 /nfs/dbraw/zinc/85/37/07/1348853707.db2.gz AQLCYYAYEIKJKT-QFBILLFUSA-N 1 3 331.504 2.668 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)Cc2ccc(C)c(F)c2)CC[N@@H+]1C ZINC001394063203 1357431974 /nfs/dbraw/zinc/43/19/74/1357431974.db2.gz UANAWDWXIQWLKV-HHXXYDBFSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)Cc2ccc(C)c(F)c2)CC[N@H+]1C ZINC001394063203 1357431978 /nfs/dbraw/zinc/43/19/78/1357431978.db2.gz UANAWDWXIQWLKV-HHXXYDBFSA-N 1 3 349.494 2.801 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@@H](NCc2cc3ccccc3o2)C(C)(C)C1 ZINC001382369960 1348920613 /nfs/dbraw/zinc/92/06/13/1348920613.db2.gz PRXRKZIRKLRJSI-GOSISDBHSA-N 1 3 343.471 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)N(CC[N@H+](C)CC1CC(C)(C)C1)C(C)C ZINC001382507001 1348973348 /nfs/dbraw/zinc/97/33/48/1348973348.db2.gz XMRJWUASWNMMIB-UHFFFAOYSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N(CC[N@@H+](C)CC1CC(C)(C)C1)C(C)C ZINC001382507001 1348973352 /nfs/dbraw/zinc/97/33/52/1348973352.db2.gz XMRJWUASWNMMIB-UHFFFAOYSA-N 1 3 325.541 2.932 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1ccccc1C)C(C)(C)C)N(C)C ZINC001382530567 1348995732 /nfs/dbraw/zinc/99/57/32/1348995732.db2.gz GROFBTCMLGQPHY-QZTJIDSGSA-N 1 3 333.520 2.956 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C[NH2+]Cc1ccsc1)C(C)(C)C)N(C)C ZINC001382530164 1348996312 /nfs/dbraw/zinc/99/63/12/1348996312.db2.gz HGQIQJKLLGHLIR-LSDHHAIUSA-N 1 3 325.522 2.709 10 0 EFAEHO CC(C)C[NH2+]C[C@@H](NC(=O)[C@@H]1CCCN1CC(C)C)C(C)(C)C ZINC001382539204 1349005665 /nfs/dbraw/zinc/00/56/65/1349005665.db2.gz ZFGDJCCIXZIRFJ-DLBZAZTESA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)C[NH2+]C[C@H](NC(=O)[C@H]1CCCN1CC(C)C)C(C)(C)C ZINC001382539210 1349006195 /nfs/dbraw/zinc/00/61/95/1349006195.db2.gz ZFGDJCCIXZIRFJ-SJORKVTESA-N 1 3 325.541 2.883 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001382563884 1349023230 /nfs/dbraw/zinc/02/32/30/1349023230.db2.gz JOYRRNXGVMVVTQ-AWEZNQCLSA-N 1 3 346.519 2.914 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1CC[NH+](Cc2ccsc2)CC1)N(C)C ZINC001382566880 1349024726 /nfs/dbraw/zinc/02/47/26/1349024726.db2.gz VOKIYKJJFGCQBC-WMLDXEAASA-N 1 3 337.533 2.805 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)N(C)CCc1ccccc1F ZINC001394079590 1357447717 /nfs/dbraw/zinc/44/77/17/1357447717.db2.gz UHRUVOBNNJYOBR-FUHWJXTLSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)N(C)CCc1ccccc1F ZINC001394079590 1357447720 /nfs/dbraw/zinc/44/77/20/1357447720.db2.gz UHRUVOBNNJYOBR-FUHWJXTLSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)N(C)CCc1ccccc1F ZINC001394079613 1357448199 /nfs/dbraw/zinc/44/81/99/1357448199.db2.gz UHRUVOBNNJYOBR-WMZOPIPTSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)N(C)CCc1ccccc1F ZINC001394079613 1357448201 /nfs/dbraw/zinc/44/82/01/1357448201.db2.gz UHRUVOBNNJYOBR-WMZOPIPTSA-N 1 3 349.494 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)CC[C@@H]1CCC[C@@H](C)C1 ZINC001420055694 1376392334 /nfs/dbraw/zinc/39/23/34/1376392334.db2.gz BBPAZIJUQYGKGM-MSOLQXFVSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)CC[C@@H]1CCC[C@@H](C)C1 ZINC001420055694 1376392347 /nfs/dbraw/zinc/39/23/47/1376392347.db2.gz BBPAZIJUQYGKGM-MSOLQXFVSA-N 1 3 325.541 2.933 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[N@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001394106171 1357476790 /nfs/dbraw/zinc/47/67/90/1357476790.db2.gz KGUXQCUZXZOAQX-HUUCEWRRSA-N 1 3 347.494 2.836 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001394106171 1357476791 /nfs/dbraw/zinc/47/67/91/1357476791.db2.gz KGUXQCUZXZOAQX-HUUCEWRRSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@H+](C)Cc1ccccc1C1CC1)N(C)C ZINC001394123012 1357497569 /nfs/dbraw/zinc/49/75/69/1357497569.db2.gz GQRXRAPAHDHTDX-DNVCBOLYSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccccc1C1CC1)N(C)C ZINC001394123012 1357497573 /nfs/dbraw/zinc/49/75/73/1357497573.db2.gz GQRXRAPAHDHTDX-DNVCBOLYSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)Cc1ccc(Cl)cc1 ZINC001394139835 1357523576 /nfs/dbraw/zinc/52/35/76/1357523576.db2.gz RKIILHJDCGDUNE-AWEZNQCLSA-N 1 3 325.884 2.617 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001394139835 1357523579 /nfs/dbraw/zinc/52/35/79/1357523579.db2.gz RKIILHJDCGDUNE-AWEZNQCLSA-N 1 3 325.884 2.617 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)CN1CCCC1)[NH2+]Cc1ccccc1 ZINC001394180208 1357557128 /nfs/dbraw/zinc/55/71/28/1357557128.db2.gz AMTKGEUMJXDHBY-LJQANCHMSA-N 1 3 331.504 2.745 10 0 EFAEHO CCCC[C@@H](CNCc1cc(C)ccc1F)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001394205631 1357591962 /nfs/dbraw/zinc/59/19/62/1357591962.db2.gz RBEBTERROQRWBO-AEFFLSMTSA-N 1 3 349.494 2.850 10 0 EFAEHO CCCC[C@@H](CNCc1cc(C)ccc1F)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001394205631 1357591966 /nfs/dbraw/zinc/59/19/66/1357591966.db2.gz RBEBTERROQRWBO-AEFFLSMTSA-N 1 3 349.494 2.850 10 0 EFAEHO CC(C)CC[N@@H+]1CCCCC[C@@H]1CNC(=O)[C@H](C(C)C)N(C)C ZINC001394212791 1357602505 /nfs/dbraw/zinc/60/25/05/1357602505.db2.gz RUSRZQXLBOKCMR-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[N@H+]1CCCCC[C@@H]1CNC(=O)[C@H](C(C)C)N(C)C ZINC001394212791 1357602508 /nfs/dbraw/zinc/60/25/08/1357602508.db2.gz RUSRZQXLBOKCMR-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[N@@H+]1CCCCC[C@@H]1CNC(=O)[C@@H](C(C)C)N(C)C ZINC001394212796 1357602624 /nfs/dbraw/zinc/60/26/24/1357602624.db2.gz RUSRZQXLBOKCMR-QZTJIDSGSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[N@H+]1CCCCC[C@@H]1CNC(=O)[C@@H](C(C)C)N(C)C ZINC001394212796 1357602627 /nfs/dbraw/zinc/60/26/27/1357602627.db2.gz RUSRZQXLBOKCMR-QZTJIDSGSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)C1C[NH+]([C@@H]2CCc3ccccc32)C1 ZINC001394226271 1357617582 /nfs/dbraw/zinc/61/75/82/1357617582.db2.gz KQILYIZWQKMBKD-FOIQADDNSA-N 1 3 341.499 2.595 10 0 EFAEHO CN(C[C@@H]1CCN1[C@H]1CCc2ccccc21)C(=O)CCC[NH+](C)C ZINC001388650184 1352889978 /nfs/dbraw/zinc/88/99/78/1352889978.db2.gz URKUZANSDRBSNJ-HKUYNNGSSA-N 1 3 329.488 2.548 10 0 EFAEHO CN(C[C@H]1CCN1CC/C=C/c1ccccc1)C(=O)[C@H]1CC[N@H+](C)C1 ZINC001388662628 1352903689 /nfs/dbraw/zinc/90/36/89/1352903689.db2.gz OXKGYTNGNMBWPY-HZQWVYJSSA-N 1 3 341.499 2.574 10 0 EFAEHO CN(C[C@H]1CCN1CC/C=C/c1ccccc1)C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001388662628 1352903692 /nfs/dbraw/zinc/90/36/92/1352903692.db2.gz OXKGYTNGNMBWPY-HZQWVYJSSA-N 1 3 341.499 2.574 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc32)C1)N(C)C ZINC001388724106 1352951922 /nfs/dbraw/zinc/95/19/22/1352951922.db2.gz ZQNXGRVYKOLTOS-QOJCHSLYSA-N 1 3 343.515 2.745 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001388758063 1352984206 /nfs/dbraw/zinc/98/42/06/1352984206.db2.gz PDUKBLRCWVUVHP-VQTJNVASSA-N 1 3 345.531 2.964 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN1CCC(C)CC1 ZINC001388766405 1352990775 /nfs/dbraw/zinc/99/07/75/1352990775.db2.gz MDDCEFLOXPGXAG-UHOSZYNNSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@H]2CCN(C/C=C/Cl)C[C@H]2C1)[NH+](CC)CC ZINC001388792645 1353022448 /nfs/dbraw/zinc/02/24/48/1353022448.db2.gz IHZOOPGQHHVLFW-RUGHOMSSSA-N 1 3 341.927 2.640 10 0 EFAEHO CC[C@H](C(=O)N1C[C@H]2CCN(C/C=C\Cl)C[C@H]2C1)[NH+](CC)CC ZINC001388792630 1353022857 /nfs/dbraw/zinc/02/28/57/1353022857.db2.gz IHZOOPGQHHVLFW-MLYGRIBFSA-N 1 3 341.927 2.640 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@H+](C/C=C/Cl)CC(C)(C)C1)N(C)C ZINC001388834692 1353072239 /nfs/dbraw/zinc/07/22/39/1353072239.db2.gz FVVTZLNXXICENK-LPXAQJHASA-N 1 3 329.916 2.686 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@@H+](C/C=C/Cl)CC(C)(C)C1)N(C)C ZINC001388834692 1353072241 /nfs/dbraw/zinc/07/22/41/1353072241.db2.gz FVVTZLNXXICENK-LPXAQJHASA-N 1 3 329.916 2.686 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@H+](C/C=C\Cl)CC(C)(C)C1 ZINC001388843780 1353084232 /nfs/dbraw/zinc/08/42/32/1353084232.db2.gz VZYDKWCJVPBZFN-LYASGUKUSA-N 1 3 329.916 2.688 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@@H+](C/C=C\Cl)CC(C)(C)C1 ZINC001388843780 1353084238 /nfs/dbraw/zinc/08/42/38/1353084238.db2.gz VZYDKWCJVPBZFN-LYASGUKUSA-N 1 3 329.916 2.688 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001394309762 1357691474 /nfs/dbraw/zinc/69/14/74/1357691474.db2.gz FXMYBRLLKQUVNK-NNZMDNLPSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001394309762 1357691478 /nfs/dbraw/zinc/69/14/78/1357691478.db2.gz FXMYBRLLKQUVNK-NNZMDNLPSA-N 1 3 335.536 2.591 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CC12CCN(C/C=C\Cl)CC2 ZINC001389527617 1353454984 /nfs/dbraw/zinc/45/49/84/1353454984.db2.gz SZXAKNBXPZEBHG-PVFHKVBPSA-N 1 3 339.911 2.584 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CC12CCN(C/C=C\Cl)CC2 ZINC001389527617 1353454987 /nfs/dbraw/zinc/45/49/87/1353454987.db2.gz SZXAKNBXPZEBHG-PVFHKVBPSA-N 1 3 339.911 2.584 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](CNC(=O)[C@@H]1CCCN1C(C)C)C1CC1 ZINC001389612337 1353510100 /nfs/dbraw/zinc/51/01/00/1353510100.db2.gz PSRDUXCTTUKUJH-UXHICEINSA-N 1 3 343.515 2.852 10 0 EFAEHO CC(C)(C(=O)NC[C@H]([NH2+]CCc1ccccc1)C1CC1)N1CCCC1 ZINC001389664028 1353538912 /nfs/dbraw/zinc/53/89/12/1353538912.db2.gz QBTCNWOJJMNYMJ-IBGZPJMESA-N 1 3 343.515 2.588 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]([NH2+]CC1CCC2(CC2)CC1)C1CC1)N(C)C ZINC001389686952 1353555005 /nfs/dbraw/zinc/55/50/05/1353555005.db2.gz GFMPMPUWIRAACP-ROUUACIJSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@H+](C)Cc2ccccc2F)C1 ZINC001389731038 1353587157 /nfs/dbraw/zinc/58/71/57/1353587157.db2.gz CJKNGBOXAGADAZ-KRWDZBQOSA-N 1 3 349.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@@H+](C)Cc2ccccc2F)C1 ZINC001389731038 1353587160 /nfs/dbraw/zinc/58/71/60/1353587160.db2.gz CJKNGBOXAGADAZ-KRWDZBQOSA-N 1 3 349.494 2.836 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H]([NH2+]C/C=C\c2ccc(Cl)cc2)C1 ZINC001389780709 1353616358 /nfs/dbraw/zinc/61/63/58/1353616358.db2.gz NROMFTGSBHCOOA-FLJZSQCOSA-N 1 3 347.890 2.638 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001389901500 1353676836 /nfs/dbraw/zinc/67/68/36/1353676836.db2.gz RWHYYFKIYRTQFA-XPYUAMARSA-N 1 3 347.503 2.579 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@H](C)c3ccccc3F)C[C@H]21 ZINC001394338590 1357711476 /nfs/dbraw/zinc/71/14/76/1357711476.db2.gz JMSWXXCHBSMHRA-DDBAPUKQSA-N 1 3 347.478 2.521 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@H](C)c3ccccc3F)C[C@H]21 ZINC001394338590 1357711481 /nfs/dbraw/zinc/71/14/81/1357711481.db2.gz JMSWXXCHBSMHRA-DDBAPUKQSA-N 1 3 347.478 2.521 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@H+](CC3CCCC3)CC[C@@H]21 ZINC001389946966 1353704323 /nfs/dbraw/zinc/70/43/23/1353704323.db2.gz FXQODFXDYHTRPU-MOPGFXCFSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]2C[N@@H+](CC3CCCC3)CC[C@@H]21 ZINC001389946966 1353704327 /nfs/dbraw/zinc/70/43/27/1353704327.db2.gz FXQODFXDYHTRPU-MOPGFXCFSA-N 1 3 335.536 2.831 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+][C@H]1C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001390008508 1353739195 /nfs/dbraw/zinc/73/91/95/1353739195.db2.gz IEAOZJWBEORQFT-BMFAXAFESA-N 1 3 331.504 2.879 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+][C@H]1C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001390008511 1353739520 /nfs/dbraw/zinc/73/95/20/1353739520.db2.gz IEAOZJWBEORQFT-IMBTUZDBSA-N 1 3 331.504 2.879 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(Cl)c2)C1 ZINC001390013747 1353743615 /nfs/dbraw/zinc/74/36/15/1353743615.db2.gz VYMQOJXIXMKDQF-RRQGHBQHSA-N 1 3 337.895 2.980 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@@H]3C[N@H+](CC4CCCC4)C[C@@H]3C2)CCC1 ZINC001394351182 1357724403 /nfs/dbraw/zinc/72/44/03/1357724403.db2.gz MDAVPOZQZOSQHZ-CEXWTWQISA-N 1 3 347.547 2.878 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@@H]3C[N@@H+](CC4CCCC4)C[C@@H]3C2)CCC1 ZINC001394351182 1357724409 /nfs/dbraw/zinc/72/44/09/1357724409.db2.gz MDAVPOZQZOSQHZ-CEXWTWQISA-N 1 3 347.547 2.878 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCC[C@@H]1[C@H]1CCCN1C/C=C/Cl ZINC001390179058 1353898972 /nfs/dbraw/zinc/89/89/72/1353898972.db2.gz ZHULNMACTNODNL-SNWBSQOPSA-N 1 3 327.900 2.536 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]Cc2ccccc2C)CC1)N(C)C ZINC001390267145 1353965219 /nfs/dbraw/zinc/96/52/19/1353965219.db2.gz UUGGUAKWQAXMNR-CTWPCTMYSA-N 1 3 331.504 2.852 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc(CF)cc1 ZINC001390359808 1354027889 /nfs/dbraw/zinc/02/78/89/1354027889.db2.gz JSFIVPSVZHTONR-CRAIPNDOSA-N 1 3 335.467 2.623 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001390397563 1354062406 /nfs/dbraw/zinc/06/24/06/1354062406.db2.gz GLWROARVUAYWPW-ZBFHGGJFSA-N 1 3 345.478 2.781 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1cccc(CC)c1 ZINC001390410288 1354070318 /nfs/dbraw/zinc/07/03/18/1354070318.db2.gz WJXXXHKMDGLICP-APWZRJJASA-N 1 3 331.504 2.718 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N(C)C1CC(NCC=C(Cl)Cl)C1 ZINC001394851319 1358157231 /nfs/dbraw/zinc/15/72/31/1358157231.db2.gz AQXSLEUNOIBWTL-JXQTWKCFSA-N 1 3 348.318 2.757 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N(C)C1CC(NCC=C(Cl)Cl)C1 ZINC001394851319 1358157235 /nfs/dbraw/zinc/15/72/35/1358157235.db2.gz AQXSLEUNOIBWTL-JXQTWKCFSA-N 1 3 348.318 2.757 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1F ZINC001390462370 1354098083 /nfs/dbraw/zinc/09/80/83/1354098083.db2.gz SEVAOVYAHCARDW-HNNXBMFYSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](C)CNC(=O)[C@@H](C)N2CCCCCC2)c1 ZINC001390479021 1354112907 /nfs/dbraw/zinc/11/29/07/1354112907.db2.gz KWBITNINFBHYBE-ZWKOTPCHSA-N 1 3 331.504 2.854 10 0 EFAEHO CC(C)c1ccccc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001390574891 1354182848 /nfs/dbraw/zinc/18/28/48/1354182848.db2.gz JUNGTHMMARPFGN-SFHVURJKSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+][C@H]2CCCc3ccccc32)C1 ZINC001390596817 1354193741 /nfs/dbraw/zinc/19/37/41/1354193741.db2.gz NNHQYAIQPZBOIO-XLIONFOSSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC001390607524 1354202152 /nfs/dbraw/zinc/20/21/52/1354202152.db2.gz IQKUCQSWYMIUAU-ZWKOTPCHSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]([NH2+]CC2CC3(CCC3)C2)C1 ZINC001390608512 1354202930 /nfs/dbraw/zinc/20/29/30/1354202930.db2.gz KOBPXFKMDKUFCK-ROUUACIJSA-N 1 3 335.536 2.924 10 0 EFAEHO COc1cccc(C[NH2+][C@H]2CCC[C@@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001390613739 1354209113 /nfs/dbraw/zinc/20/91/13/1354209113.db2.gz TVLYJRUBRLTACU-ZWKOTPCHSA-N 1 3 347.503 2.552 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@@H]([N@H+](C)CCCF)C1 ZINC001390632255 1354230162 /nfs/dbraw/zinc/23/01/62/1354230162.db2.gz KAHGPCFNEJKXEI-SJORKVTESA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@@H]([N@@H+](C)CCCF)C1 ZINC001390632255 1354230169 /nfs/dbraw/zinc/23/01/69/1354230169.db2.gz KAHGPCFNEJKXEI-SJORKVTESA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)CCC[N@H+](C)[C@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001390633161 1354231824 /nfs/dbraw/zinc/23/18/24/1354231824.db2.gz CGBNAXQTQQLCCM-ZWKOTPCHSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)CCC[N@@H+](C)[C@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001390633161 1354231828 /nfs/dbraw/zinc/23/18/28/1354231828.db2.gz CGBNAXQTQQLCCM-ZWKOTPCHSA-N 1 3 325.541 2.932 10 0 EFAEHO C[C@H](CCNC(=O)[C@@H]1CCCN1C)[NH2+]Cc1cc(Cl)ccc1F ZINC001390647614 1354245450 /nfs/dbraw/zinc/24/54/50/1354245450.db2.gz QIRVGRXSVFAFMW-WBMJQRKESA-N 1 3 341.858 2.558 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001390699617 1354291398 /nfs/dbraw/zinc/29/13/98/1354291398.db2.gz BGYLKSQDNLHQDQ-DLBZAZTESA-N 1 3 343.515 2.502 10 0 EFAEHO Cc1cccnc1C[NH2+][C@H](C)CCNC(=O)[C@H]1CCCCN1C(C)C ZINC001390708479 1354299481 /nfs/dbraw/zinc/29/94/81/1354299481.db2.gz ZPFODYXTBOBJHT-IEBWSBKVSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H](C)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001390719011 1354311427 /nfs/dbraw/zinc/31/14/27/1354311427.db2.gz LFPRFNPDXSXNQY-OCCSQVGLSA-N 1 3 342.434 2.571 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]Cc1cc(F)ccc1Cl ZINC001390725605 1354317883 /nfs/dbraw/zinc/31/78/83/1354317883.db2.gz DELFZVKDQVJEPR-ZDUSSCGKSA-N 1 3 343.874 2.804 10 0 EFAEHO CN(CC(=O)NCC[N@H+](C)Cc1ccc(C2CC2)cc1)C1CCC1 ZINC001390765816 1354353219 /nfs/dbraw/zinc/35/32/19/1354353219.db2.gz RYYGYAUYUPJVTI-UHFFFAOYSA-N 1 3 329.488 2.596 10 0 EFAEHO CN(CC(=O)NCC[N@@H+](C)Cc1ccc(C2CC2)cc1)C1CCC1 ZINC001390765816 1354353224 /nfs/dbraw/zinc/35/32/24/1354353224.db2.gz RYYGYAUYUPJVTI-UHFFFAOYSA-N 1 3 329.488 2.596 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)c1 ZINC001390777835 1354365039 /nfs/dbraw/zinc/36/50/39/1354365039.db2.gz GSSAFBWYBGFWNV-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)c1 ZINC001390777835 1354365047 /nfs/dbraw/zinc/36/50/47/1354365047.db2.gz GSSAFBWYBGFWNV-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[N@H+](CCNC(=O)C1(N(C)C)CCC1)[C@H](C)c1cccc(OC)c1 ZINC001390906520 1354502096 /nfs/dbraw/zinc/50/20/96/1354502096.db2.gz ILJDVSMDCCIJBD-MRXNPFEDSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[N@@H+](CCNC(=O)C1(N(C)C)CCC1)[C@H](C)c1cccc(OC)c1 ZINC001390906520 1354502099 /nfs/dbraw/zinc/50/20/99/1354502099.db2.gz ILJDVSMDCCIJBD-MRXNPFEDSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CC)C/C=C/c2ccccc2)CC[N@@H+]1C ZINC001390907459 1354504503 /nfs/dbraw/zinc/50/45/03/1354504503.db2.gz QLHKLBWHKVBBCV-WQEUXLNQSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CC)C/C=C/c2ccccc2)CC[N@H+]1C ZINC001390907459 1354504509 /nfs/dbraw/zinc/50/45/09/1354504509.db2.gz QLHKLBWHKVBBCV-WQEUXLNQSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@H+](CC2CC(C)(C)C2)C1)N1CCCC1 ZINC001391095740 1354788523 /nfs/dbraw/zinc/78/85/23/1354788523.db2.gz HZIVLFYVHJFCJN-INIZCTEOSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@@H+](CC2CC(C)(C)C2)C1)N1CCCC1 ZINC001391095740 1354788531 /nfs/dbraw/zinc/78/85/31/1354788531.db2.gz HZIVLFYVHJFCJN-INIZCTEOSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@H](CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001391096197 1354789964 /nfs/dbraw/zinc/78/99/64/1354789964.db2.gz KIVSQKQDMYOFCH-GOSISDBHSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@H](CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001391096197 1354789968 /nfs/dbraw/zinc/78/99/68/1354789968.db2.gz KIVSQKQDMYOFCH-GOSISDBHSA-N 1 3 343.515 2.808 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCN(Cc2ccc(F)cc2)C1 ZINC001391108269 1354804578 /nfs/dbraw/zinc/80/45/78/1354804578.db2.gz WEIZXZWBCQNADO-IEBWSBKVSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCN(Cc2ccc(F)cc2)C1 ZINC001391108269 1354804582 /nfs/dbraw/zinc/80/45/82/1354804582.db2.gz WEIZXZWBCQNADO-IEBWSBKVSA-N 1 3 347.478 2.638 10 0 EFAEHO Cc1cccc([C@H](C)[N@@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001391116067 1354818616 /nfs/dbraw/zinc/81/86/16/1354818616.db2.gz KGYZSHKRUKELTI-ZWKOTPCHSA-N 1 3 331.504 2.834 10 0 EFAEHO Cc1cccc([C@H](C)[N@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001391116067 1354818620 /nfs/dbraw/zinc/81/86/20/1354818620.db2.gz KGYZSHKRUKELTI-ZWKOTPCHSA-N 1 3 331.504 2.834 10 0 EFAEHO CC(C)CC[NH2+][C@@H](C)C1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001391235403 1354958429 /nfs/dbraw/zinc/95/84/29/1354958429.db2.gz DQNSOPOXKRXLMU-FUHWJXTLSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)N1CC[C@@H](CN(C)C/C=C\Cl)C1 ZINC001391354577 1355116551 /nfs/dbraw/zinc/11/65/51/1355116551.db2.gz IMQCMNMOLXCSSX-HYHHROLSSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)N1CC[C@@H](CN(C)C/C=C\Cl)C1 ZINC001391354577 1355116555 /nfs/dbraw/zinc/11/65/55/1355116555.db2.gz IMQCMNMOLXCSSX-HYHHROLSSA-N 1 3 341.927 2.782 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(C[N@H+](C)CC[C@@H](C)F)CC1 ZINC001391365924 1355133573 /nfs/dbraw/zinc/13/35/73/1355133573.db2.gz QITHKBGHSCWIJC-AEFFLSMTSA-N 1 3 341.515 2.779 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(C[N@@H+](C)CC[C@@H](C)F)CC1 ZINC001391365924 1355133577 /nfs/dbraw/zinc/13/35/77/1355133577.db2.gz QITHKBGHSCWIJC-AEFFLSMTSA-N 1 3 341.515 2.779 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@@H]1CCN(CCCc2ccsc2)C1 ZINC001391580929 1355322937 /nfs/dbraw/zinc/32/29/37/1355322937.db2.gz XMTUMPRTDYOROB-MSOLQXFVSA-N 1 3 349.544 2.746 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@@H]1CCN(CCCc2ccsc2)C1 ZINC001391580929 1355322939 /nfs/dbraw/zinc/32/29/39/1355322939.db2.gz XMTUMPRTDYOROB-MSOLQXFVSA-N 1 3 349.544 2.746 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)[C@@H]1CCN([C@@H]2CCCc3ccc(F)cc32)C1 ZINC001391617599 1355359659 /nfs/dbraw/zinc/35/96/59/1355359659.db2.gz FSWDSPPLPATJSP-IEBWSBKVSA-N 1 3 347.478 2.688 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)[C@H]1CCN([C@@H]2CCCc3ccc(F)cc32)C1 ZINC001391617611 1355359888 /nfs/dbraw/zinc/35/98/88/1355359888.db2.gz FSWDSPPLPATJSP-PKOBYXMFSA-N 1 3 347.478 2.688 10 0 EFAEHO CCN(C(=O)[C@@H](C)N1CCCCCC1)[C@@H]1CC[N@H+](CC2CCC2)C1 ZINC001391657128 1355410185 /nfs/dbraw/zinc/41/01/85/1355410185.db2.gz TZADEJOCCNWALS-IEBWSBKVSA-N 1 3 335.536 2.974 10 0 EFAEHO CCN(C(=O)[C@@H](C)N1CCCCCC1)[C@@H]1CC[N@@H+](CC2CCC2)C1 ZINC001391657128 1355410188 /nfs/dbraw/zinc/41/01/88/1355410188.db2.gz TZADEJOCCNWALS-IEBWSBKVSA-N 1 3 335.536 2.974 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](CC)NCc1cc(C)ccc1F ZINC001391690458 1355437228 /nfs/dbraw/zinc/43/72/28/1355437228.db2.gz HBUAEZOBKMSOMW-HKUYNNGSSA-N 1 3 349.494 2.993 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](CC)NCc1cc(C)ccc1F ZINC001391690458 1355437231 /nfs/dbraw/zinc/43/72/31/1355437231.db2.gz HBUAEZOBKMSOMW-HKUYNNGSSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCC[N@@H+]1CC(C)C)NCc1ccccc1F ZINC001391694321 1355440775 /nfs/dbraw/zinc/44/07/75/1355440775.db2.gz BZKQRDZTLJKQBB-MJGOQNOKSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCC[N@H+]1CC(C)C)NCc1ccccc1F ZINC001391694321 1355440778 /nfs/dbraw/zinc/44/07/78/1355440778.db2.gz BZKQRDZTLJKQBB-MJGOQNOKSA-N 1 3 349.494 2.931 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1cccc(C)c1 ZINC001391695906 1355441734 /nfs/dbraw/zinc/44/17/34/1355441734.db2.gz VVNLKGHJRJKKIW-RTBURBONSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@H](C(=O)N[C@](C)(C[NH2+]Cc1cc(F)ccc1C)C1CC1)N(C)C ZINC001391801342 1355543787 /nfs/dbraw/zinc/54/37/87/1355543787.db2.gz YAKUEWZYOZNMMR-UYAOXDASSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@](C)(NC(=O)CN1CC[C@@H](C)C1)C1CC1 ZINC001391819345 1355562933 /nfs/dbraw/zinc/56/29/33/1355562933.db2.gz RXYUOLBGXGIWOL-IERDGZPVSA-N 1 3 343.515 2.711 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@@](C)(C[NH2+]Cc2ccccc2F)C2CC2)C1 ZINC001391821776 1355565227 /nfs/dbraw/zinc/56/52/27/1355565227.db2.gz WFBZLNJQKHRZKG-QRWLVFNGSA-N 1 3 347.478 2.542 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001391867793 1355606942 /nfs/dbraw/zinc/60/69/42/1355606942.db2.gz YVOOKLHTZHXFGW-LJQANCHMSA-N 1 3 331.504 2.670 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]Cc3ccsc3)CCCC2)CCC1 ZINC001392008002 1355711499 /nfs/dbraw/zinc/71/14/99/1355711499.db2.gz HGRWFEJOFSNPLR-UHFFFAOYSA-N 1 3 335.517 2.751 10 0 EFAEHO CCCc1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CCCC2)cc1 ZINC001392135035 1355792875 /nfs/dbraw/zinc/79/28/75/1355792875.db2.gz RJYRWQNBYQAMGC-QGZVFWFLSA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001392137960 1355795985 /nfs/dbraw/zinc/79/59/85/1355795985.db2.gz LMZVUCQWIBVLDF-ZDUSSCGKSA-N 1 3 343.874 2.756 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](CC(C)C)NC(=O)[C@@H]2CC[N@H+](C)C2)c1 ZINC001392158145 1355812370 /nfs/dbraw/zinc/81/23/70/1355812370.db2.gz HXPQIECFOLBCQZ-AEFFLSMTSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](CC(C)C)NC(=O)[C@@H]2CC[N@@H+](C)C2)c1 ZINC001392158145 1355812372 /nfs/dbraw/zinc/81/23/72/1355812372.db2.gz HXPQIECFOLBCQZ-AEFFLSMTSA-N 1 3 349.494 2.706 10 0 EFAEHO CC(C)C[C@H](C[NH2+]Cc1ccc(F)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001392159691 1355814329 /nfs/dbraw/zinc/81/43/29/1355814329.db2.gz FKYBZHCNLWKUNF-VQIMIIECSA-N 1 3 349.494 2.788 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H](C)[NH2+]CCC(C)(C)C)C1 ZINC001392188710 1355843510 /nfs/dbraw/zinc/84/35/10/1355843510.db2.gz KIPOMEHSJXTCJI-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001392195240 1355851515 /nfs/dbraw/zinc/85/15/15/1355851515.db2.gz RMGRRVOKSRVEDI-DLBZAZTESA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001392195240 1355851519 /nfs/dbraw/zinc/85/15/19/1355851519.db2.gz RMGRRVOKSRVEDI-DLBZAZTESA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1ccc(F)cc1C)C(C)C)N(C)C ZINC001392228888 1355883204 /nfs/dbraw/zinc/88/32/04/1355883204.db2.gz PTNNOOWWBDMBLN-ZWKOTPCHSA-N 1 3 337.483 2.705 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H]1CCc2c1cccc2F ZINC001392256212 1355913426 /nfs/dbraw/zinc/91/34/26/1355913426.db2.gz QCHHWGINYXZAOC-MOPGFXCFSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)[C@H]1CCc2c1cccc2F ZINC001392332228 1355997963 /nfs/dbraw/zinc/99/79/63/1355997963.db2.gz FPAALZYWYMZXOX-SFHVURJKSA-N 1 3 335.467 2.543 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)[C@H]1CCc2c1cccc2F ZINC001392332228 1355997967 /nfs/dbraw/zinc/99/79/67/1355997967.db2.gz FPAALZYWYMZXOX-SFHVURJKSA-N 1 3 335.467 2.543 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)C[N@H+]1[C@H](C)CC[C@@H]1C ZINC001392335913 1356003273 /nfs/dbraw/zinc/00/32/73/1356003273.db2.gz OUFDLQFZPQLNOM-HDICACEKSA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001392335913 1356003277 /nfs/dbraw/zinc/00/32/77/1356003277.db2.gz OUFDLQFZPQLNOM-HDICACEKSA-N 1 3 331.504 2.758 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2Cc2ccsc2)C1 ZINC001392356535 1356016785 /nfs/dbraw/zinc/01/67/85/1356016785.db2.gz ZFKDKPDMKLEUCX-IAGOWNOFSA-N 1 3 335.517 2.513 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2Cc2ccsc2)C1 ZINC001392356535 1356016789 /nfs/dbraw/zinc/01/67/89/1356016789.db2.gz ZFKDKPDMKLEUCX-IAGOWNOFSA-N 1 3 335.517 2.513 10 0 EFAEHO CCN(CC[NH2+][C@@H](C)c1ccc(F)c(F)c1)C(=O)CN1CCCC1 ZINC001392463100 1356054790 /nfs/dbraw/zinc/05/47/90/1356054790.db2.gz YUOLWNBTCLHJLA-AWEZNQCLSA-N 1 3 339.430 2.560 10 0 EFAEHO C[C@H](CN[C@H](C)c1ccccc1F)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001392486808 1356068897 /nfs/dbraw/zinc/06/88/97/1356068897.db2.gz FUKNTFPXYLMVQE-HZPDHXFCSA-N 1 3 347.478 2.857 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C)C[NH2+]CC1CCC2(CC2)CC1 ZINC001392488298 1356070156 /nfs/dbraw/zinc/07/01/56/1356070156.db2.gz SBXFVSIIZCAZSS-AEFFLSMTSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCCN2C(C)C)cc1 ZINC001392511992 1356088093 /nfs/dbraw/zinc/08/80/93/1356088093.db2.gz MUCJTMNXWVARJK-IEBWSBKVSA-N 1 3 331.504 2.852 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+]Cc1ccc2ccccc2c1 ZINC001392620873 1356168838 /nfs/dbraw/zinc/16/88/38/1356168838.db2.gz YCTFBTYTODEMIZ-INIZCTEOSA-N 1 3 327.472 2.774 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)C[N@H+](C)CCc1ccccc1 ZINC001392711374 1356264342 /nfs/dbraw/zinc/26/43/42/1356264342.db2.gz ZRASFMVQPAGBQW-ICSRJNTNSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCc1ccccc1 ZINC001392711374 1356264346 /nfs/dbraw/zinc/26/43/46/1356264346.db2.gz ZRASFMVQPAGBQW-ICSRJNTNSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1 ZINC001401746335 1363078807 /nfs/dbraw/zinc/07/88/07/1363078807.db2.gz AVGOHPWMVGTTIK-QAPCUYQASA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1 ZINC001401746335 1363078808 /nfs/dbraw/zinc/07/88/08/1363078808.db2.gz AVGOHPWMVGTTIK-QAPCUYQASA-N 1 3 335.467 2.635 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)C[C@@H](C)NC(=O)c1sccc1CN(C)C ZINC001401755977 1363090816 /nfs/dbraw/zinc/09/08/16/1363090816.db2.gz KTMUINOSGYWGNN-TZMCWYRMSA-N 1 3 329.485 2.608 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)C[C@@H](C)NC(=O)c1sccc1CN(C)C ZINC001401755977 1363090821 /nfs/dbraw/zinc/09/08/21/1363090821.db2.gz KTMUINOSGYWGNN-TZMCWYRMSA-N 1 3 329.485 2.608 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+]CC2CCC3(CC3)CC2)CC1)N(C)C ZINC001392949792 1356458886 /nfs/dbraw/zinc/45/88/86/1356458886.db2.gz ORZHVQCTPCFFJC-QGZVFWFLSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+][C@H]2CCc3ccc(Cl)cc32)CC1)N(C)C ZINC001392951862 1356460161 /nfs/dbraw/zinc/46/01/61/1356460161.db2.gz VQCRAKMFMFTECR-IRXDYDNUSA-N 1 3 349.906 2.906 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1CC[C@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001392995372 1356498711 /nfs/dbraw/zinc/49/87/11/1356498711.db2.gz WLMZQALUBOVURW-APWZRJJASA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](F)C[N@H+]1CC[C@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001392995372 1356498713 /nfs/dbraw/zinc/49/87/13/1356498713.db2.gz WLMZQALUBOVURW-APWZRJJASA-N 1 3 341.515 2.637 10 0 EFAEHO C[NH+](C)CCC(=O)NC1(C)CCN([C@@H]2CCc3c2cccc3F)CC1 ZINC001393067902 1356555816 /nfs/dbraw/zinc/55/58/16/1356555816.db2.gz KWXOWRZSDKGUJV-GOSISDBHSA-N 1 3 347.478 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@]2(CC[N@@H+](CC[C@H](C)F)C2)C1 ZINC001393084832 1356577789 /nfs/dbraw/zinc/57/77/89/1356577789.db2.gz BGISXHLPRIBMPA-HKUYNNGSSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@]2(CC[N@H+](CC[C@H](C)F)C2)C1 ZINC001393084832 1356577794 /nfs/dbraw/zinc/57/77/94/1356577794.db2.gz BGISXHLPRIBMPA-HKUYNNGSSA-N 1 3 341.515 2.779 10 0 EFAEHO CCc1cccc(CN2CC[C@@](C)(NC(=O)C[C@H]3CC[N@H+](C)C3)C2)c1 ZINC001393121044 1356623198 /nfs/dbraw/zinc/62/31/98/1356623198.db2.gz SZPFAIXFDNNERY-TZIWHRDSSA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1cccc(CN2CC[C@@](C)(NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)c1 ZINC001393121044 1356623204 /nfs/dbraw/zinc/62/32/04/1356623204.db2.gz SZPFAIXFDNNERY-TZIWHRDSSA-N 1 3 343.515 2.671 10 0 EFAEHO CC(C)C[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C[C@@H]2C1 ZINC001394352785 1357727350 /nfs/dbraw/zinc/72/73/50/1357727350.db2.gz UZMKSBGGSQILEV-RCCFBDPRSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C[C@@H]2C1 ZINC001394352785 1357727360 /nfs/dbraw/zinc/72/73/60/1357727360.db2.gz UZMKSBGGSQILEV-RCCFBDPRSA-N 1 3 337.552 2.837 10 0 EFAEHO CCC(CC)C[N@@H+]1CCC(F)(F)[C@H](CNC(=O)[C@H](CC)N(C)C)C1 ZINC001393240054 1356745339 /nfs/dbraw/zinc/74/53/39/1356745339.db2.gz IYNMUVDJMWDVPP-CVEARBPZSA-N 1 3 347.494 2.836 10 0 EFAEHO CCC(CC)C[N@H+]1CCC(F)(F)[C@H](CNC(=O)[C@H](CC)N(C)C)C1 ZINC001393240054 1356745342 /nfs/dbraw/zinc/74/53/42/1356745342.db2.gz IYNMUVDJMWDVPP-CVEARBPZSA-N 1 3 347.494 2.836 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H](C)[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001393385330 1356805381 /nfs/dbraw/zinc/80/53/81/1356805381.db2.gz GKCYIUJFVVCDHY-WMZOPIPTSA-N 1 3 349.494 2.801 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2cccc(C)c2)C1 ZINC001393397184 1356816635 /nfs/dbraw/zinc/81/66/35/1356816635.db2.gz LRYCNLUBZWUXHT-MJGOQNOKSA-N 1 3 331.504 2.521 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2C[N@@H+](CCC(C)(C)C)C[C@@H]2C1)CC(C)(C)C ZINC001393415593 1356831860 /nfs/dbraw/zinc/83/18/60/1356831860.db2.gz FZQGEAYKMOPISQ-CALCHBBNSA-N 1 3 337.552 2.791 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2C[N@H+](CCC(C)(C)C)C[C@@H]2C1)CC(C)(C)C ZINC001393415593 1356831864 /nfs/dbraw/zinc/83/18/64/1356831864.db2.gz FZQGEAYKMOPISQ-CALCHBBNSA-N 1 3 337.552 2.791 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCCN(C/C=C\Cl)CC1)[NH+](CC)CC ZINC001393590863 1356971291 /nfs/dbraw/zinc/97/12/91/1356971291.db2.gz AHVKNFNVLGXULT-BMEWNCGWSA-N 1 3 329.916 2.830 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](Cc2cccc(OC)c2)CC1)N(C)C ZINC001393593299 1356974332 /nfs/dbraw/zinc/97/43/32/1356974332.db2.gz ABXFGZSGBWWSLE-IEBWSBKVSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2cccc(OC)c2)CC1)N(C)C ZINC001393593299 1356974335 /nfs/dbraw/zinc/97/43/35/1356974335.db2.gz ABXFGZSGBWWSLE-IEBWSBKVSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](Cc2cc(C)ccc2F)CC1)N(C)C ZINC001393600930 1356987162 /nfs/dbraw/zinc/98/71/62/1356987162.db2.gz KMPBUAVQFQURCU-PKOBYXMFSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](Cc2cc(C)ccc2F)CC1)N(C)C ZINC001393600930 1356987165 /nfs/dbraw/zinc/98/71/65/1356987165.db2.gz KMPBUAVQFQURCU-PKOBYXMFSA-N 1 3 349.494 2.945 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)CCCN(C)C(=O)Cc2c[nH]cn2)c1 ZINC001393635041 1357032012 /nfs/dbraw/zinc/03/20/12/1357032012.db2.gz VYCVQOGIAWIOEW-HNNXBMFYSA-N 1 3 344.459 2.502 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)CCCN(C)C(=O)Cc2c[nH]cn2)c1 ZINC001393635041 1357032019 /nfs/dbraw/zinc/03/20/19/1357032019.db2.gz VYCVQOGIAWIOEW-HNNXBMFYSA-N 1 3 344.459 2.502 10 0 EFAEHO CCC1([NH2+]Cc2ccccc2C)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001393680261 1357073342 /nfs/dbraw/zinc/07/33/42/1357073342.db2.gz LHIDTGBIFRKGQH-UHFFFAOYSA-N 1 3 340.471 2.822 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2cccc(OC)c2)C1)N(C)C ZINC001394397796 1357772081 /nfs/dbraw/zinc/77/20/81/1357772081.db2.gz ZANBJKLMLKJYOS-LFEHRJTNSA-N 1 3 347.503 2.581 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H](C2CC2)N(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001394445974 1357825884 /nfs/dbraw/zinc/82/58/84/1357825884.db2.gz UKCRMRGGJPNDLQ-YLJYHZDGSA-N 1 3 343.515 2.663 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H](C2CC2)N(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001394445968 1357826052 /nfs/dbraw/zinc/82/60/52/1357826052.db2.gz UKCRMRGGJPNDLQ-XLIONFOSSA-N 1 3 343.515 2.663 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCC1 ZINC001394529285 1357913531 /nfs/dbraw/zinc/91/35/31/1357913531.db2.gz OGNHPRKINBDKKK-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001394563432 1357956486 /nfs/dbraw/zinc/95/64/86/1357956486.db2.gz ATFDUARHJDEKCE-AWEZNQCLSA-N 1 3 325.884 2.617 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H]2CCN(C(=O)C3(C[NH+](C)C)CC3)[C@@H]2C)c1 ZINC001394666027 1357984645 /nfs/dbraw/zinc/98/46/45/1357984645.db2.gz FEOFPBJDRDDLIG-CRAIPNDOSA-N 1 3 347.478 2.555 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CC2CCC3(CC3)CC2)[C@@H]1C ZINC001394675844 1357993579 /nfs/dbraw/zinc/99/35/79/1357993579.db2.gz KSSWDMQRRNOALG-FUHWJXTLSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](F)CN1CC[C@]2(NC(=O)CC[NH+]3CCCCC3)CCC[C@@H]12 ZINC001394684909 1358003686 /nfs/dbraw/zinc/00/36/86/1358003686.db2.gz HOFKFPQDINBXNL-YQVWRLOYSA-N 1 3 339.499 2.724 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@]12CCC[C@H]1N(Cc1ccsc1)CC2 ZINC001394691832 1358014453 /nfs/dbraw/zinc/01/44/53/1358014453.db2.gz NYAVEIXAYWUZIB-AEFFLSMTSA-N 1 3 335.517 2.703 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H](Cc1ccccc1)[NH2+]C(C)C ZINC001394694203 1358018649 /nfs/dbraw/zinc/01/86/49/1358018649.db2.gz DRJVLSJMVLKHHC-VQTJNVASSA-N 1 3 345.531 2.976 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CC2CC3(CCC3)C2)C(C)(C)C1 ZINC001394713043 1358040218 /nfs/dbraw/zinc/04/02/18/1358040218.db2.gz JCQYMXJIYNLKJN-KRWDZBQOSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(CC[N@H+](C)C[C@H]1CCC(F)(F)C1)C(=O)CN1CCCC1 ZINC001394812413 1358104280 /nfs/dbraw/zinc/10/42/80/1358104280.db2.gz IPFIRWQFZGEACO-INIZCTEOSA-N 1 3 345.478 2.686 10 0 EFAEHO CC(C)N(CC[N@@H+](C)C[C@H]1CCC(F)(F)C1)C(=O)CN1CCCC1 ZINC001394812413 1358104282 /nfs/dbraw/zinc/10/42/82/1358104282.db2.gz IPFIRWQFZGEACO-INIZCTEOSA-N 1 3 345.478 2.686 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CC([NH2+][C@@H]2CCc3ccccc32)C1 ZINC001394857290 1358163404 /nfs/dbraw/zinc/16/34/04/1358163404.db2.gz NQSNVFUQAHXVFM-FAFZWHIHSA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C2CC(N(C)C(=O)CN(C)C(C)C)C2)c1 ZINC001394862890 1358171332 /nfs/dbraw/zinc/17/13/32/1358171332.db2.gz XEJTZYYRNCEOSW-UHFFFAOYSA-N 1 3 331.504 2.723 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)CC(C)(C)C)C2)c1 ZINC001436970371 1387347617 /nfs/dbraw/zinc/34/76/17/1387347617.db2.gz XZINLYARLYXGMS-HDICACEKSA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[NH2+]C[C@@H]2CCC(F)(F)C2)C1 ZINC001437030068 1387366477 /nfs/dbraw/zinc/36/64/77/1387366477.db2.gz JCODKQHYNMHKHN-CVEARBPZSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[NH2+]C[C@H]2CCC(F)(F)C2)C1 ZINC001437030070 1387366967 /nfs/dbraw/zinc/36/69/67/1387366967.db2.gz JCODKQHYNMHKHN-HOTGVXAUSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCC[N@@H+]1CC1CC1)N1CCCCC1 ZINC001437048027 1387387612 /nfs/dbraw/zinc/38/76/12/1387387612.db2.gz WOWGGNWLHOWRIY-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCC[N@H+]1CC1CC1)N1CCCCC1 ZINC001437048027 1387387614 /nfs/dbraw/zinc/38/76/14/1387387614.db2.gz WOWGGNWLHOWRIY-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H](CNC(=O)C[C@@H]2CC[N@H+](C)C2)C1)c1ccccc1F ZINC001397094530 1359671893 /nfs/dbraw/zinc/67/18/93/1359671893.db2.gz HPKLXCSHJPTPLT-LUKYLMHMSA-N 1 3 347.478 2.713 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H](CNC(=O)C[C@@H]2CC[N@@H+](C)C2)C1)c1ccccc1F ZINC001397094530 1359671896 /nfs/dbraw/zinc/67/18/96/1359671896.db2.gz HPKLXCSHJPTPLT-LUKYLMHMSA-N 1 3 347.478 2.713 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]([NH2+]Cc2ccsc2)C1)N1CCCC1 ZINC001397138592 1359699632 /nfs/dbraw/zinc/69/96/32/1359699632.db2.gz YZVMATMPAAJQOZ-WKILWMFISA-N 1 3 335.517 2.607 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1)NCc1ccccc1F ZINC001437149536 1387423328 /nfs/dbraw/zinc/42/33/28/1387423328.db2.gz RWNDGGDLNNIXEM-BEFAXECRSA-N 1 3 347.478 2.827 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CCC[N@H+]1C1CCCC1)NCc1ccccc1F ZINC001437149536 1387423416 /nfs/dbraw/zinc/42/34/16/1387423416.db2.gz RWNDGGDLNNIXEM-BEFAXECRSA-N 1 3 347.478 2.827 10 0 EFAEHO C[C@@H](F)CCN1CC[C@H]1CN(C)C(=O)CCC[NH+]1CCCCC1 ZINC001397554200 1359956738 /nfs/dbraw/zinc/95/67/38/1359956738.db2.gz LMPUHEIFJBTEPF-SJORKVTESA-N 1 3 327.488 2.533 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)C[C@H]1CCN1C[C@H]1CCCC(F)(F)C1 ZINC001397556316 1359958342 /nfs/dbraw/zinc/95/83/42/1359958342.db2.gz PROYTHALIHRAHD-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)C[C@H]1CCN1C[C@H]1CCCC(F)(F)C1 ZINC001397556316 1359958347 /nfs/dbraw/zinc/95/83/47/1359958347.db2.gz PROYTHALIHRAHD-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccccc1CC ZINC001437158722 1387428477 /nfs/dbraw/zinc/42/84/77/1387428477.db2.gz UJWORTKRNHCDHM-APWZRJJASA-N 1 3 331.504 2.718 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]([NH2+]Cc2cccc(C(C)C)n2)C1)N(C)C ZINC001397662710 1360032745 /nfs/dbraw/zinc/03/27/45/1360032745.db2.gz FXMJOJXJOWYGIV-SZVBFZGTSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C\Cl)C1)N1CCCCC1 ZINC001397678595 1360044396 /nfs/dbraw/zinc/04/43/96/1360044396.db2.gz JOYJSVKLUAYXAT-HPRJGHKQSA-N 1 3 341.927 2.878 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CC(CC)CC ZINC001397737636 1360092167 /nfs/dbraw/zinc/09/21/67/1360092167.db2.gz CBLJVRVVCZNYFO-NMLBUPMWSA-N 1 3 349.563 2.933 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CC(CC)CC ZINC001397737636 1360092169 /nfs/dbraw/zinc/09/21/69/1360092169.db2.gz CBLJVRVVCZNYFO-NMLBUPMWSA-N 1 3 349.563 2.933 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[NH+]2CCCCC2)CCN1CCC(F)(F)F ZINC001397750837 1360105340 /nfs/dbraw/zinc/10/53/40/1360105340.db2.gz YPJGVOQYDLJDQR-LSDHHAIUSA-N 1 3 349.441 2.784 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001437167211 1387436307 /nfs/dbraw/zinc/43/63/07/1387436307.db2.gz IIQOTWSJFLPLTI-XJKSGUPXSA-N 1 3 325.884 2.583 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCCN([C@H]2CCCc3ccc(F)cc32)C1 ZINC001398225933 1360396015 /nfs/dbraw/zinc/39/60/15/1360396015.db2.gz FFRKFVQIDGELNJ-MJGOQNOKSA-N 1 3 347.478 2.735 10 0 EFAEHO CCCN(C(=O)CN1CC[C@H](C)C1)C1CC[NH+](CC[C@@H](C)F)CC1 ZINC001398369407 1360490760 /nfs/dbraw/zinc/49/07/60/1360490760.db2.gz RQQSQVLMOPUEFT-DLBZAZTESA-N 1 3 341.515 2.779 10 0 EFAEHO CCCN(C(=O)CN1CC[C@@H](C)C1)C1CC[NH+](CC[C@H](C)F)CC1 ZINC001398369414 1360490808 /nfs/dbraw/zinc/49/08/08/1360490808.db2.gz RQQSQVLMOPUEFT-SJORKVTESA-N 1 3 341.515 2.779 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](NCC=C(Cl)Cl)C1CC1 ZINC001398413896 1360532523 /nfs/dbraw/zinc/53/25/23/1360532523.db2.gz SWHOQRLGBMNGMH-KBPBESRZSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](NCC=C(Cl)Cl)C1CC1 ZINC001398413896 1360532525 /nfs/dbraw/zinc/53/25/25/1360532525.db2.gz SWHOQRLGBMNGMH-KBPBESRZSA-N 1 3 348.318 2.664 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@H](NCc2ccccc2Cl)C2CC2)C1 ZINC001398445588 1360562922 /nfs/dbraw/zinc/56/29/22/1360562922.db2.gz LYYZKGNJPCAUDQ-KSSFIOAISA-N 1 3 349.906 2.666 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@H](NCc2ccccc2Cl)C2CC2)C1 ZINC001398445588 1360562929 /nfs/dbraw/zinc/56/29/29/1360562929.db2.gz LYYZKGNJPCAUDQ-KSSFIOAISA-N 1 3 349.906 2.666 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](CNC(=O)CN2CC[C@H](C)C2)C2CC2)cc1 ZINC001398455316 1360572740 /nfs/dbraw/zinc/57/27/40/1360572740.db2.gz PPHOVJGQQLFVPL-OXJNMPFZSA-N 1 3 343.515 2.575 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@H+](C)CCc2ccccc2)C1 ZINC001398456939 1360574507 /nfs/dbraw/zinc/57/45/07/1360574507.db2.gz CHPGOGVOGNZGNO-FQEVSTJZSA-N 1 3 345.531 2.740 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C[N@@H+](C)CCc2ccccc2)C1 ZINC001398456939 1360574511 /nfs/dbraw/zinc/57/45/11/1360574511.db2.gz CHPGOGVOGNZGNO-FQEVSTJZSA-N 1 3 345.531 2.740 10 0 EFAEHO O=C([C@@H]1CCCC[N@@H+]1C1CCCC1)N1CC[C@H](NC/C=C\Cl)C1 ZINC001398523549 1360623480 /nfs/dbraw/zinc/62/34/80/1360623480.db2.gz CNWICCRMMFKUGV-ODZVBOMLSA-N 1 3 339.911 2.727 10 0 EFAEHO O=C([C@@H]1CCCC[N@H+]1C1CCCC1)N1CC[C@H](NC/C=C\Cl)C1 ZINC001398523549 1360623488 /nfs/dbraw/zinc/62/34/88/1360623488.db2.gz CNWICCRMMFKUGV-ODZVBOMLSA-N 1 3 339.911 2.727 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001398536541 1360631832 /nfs/dbraw/zinc/63/18/32/1360631832.db2.gz HEUNNHCQKBOEJB-KZNAEPCWSA-N 1 3 347.478 2.745 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001398536541 1360631838 /nfs/dbraw/zinc/63/18/38/1360631838.db2.gz HEUNNHCQKBOEJB-KZNAEPCWSA-N 1 3 347.478 2.745 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)NCCN(C)Cc1ccc2cc[nH]c2c1 ZINC001492873658 1360635730 /nfs/dbraw/zinc/63/57/30/1360635730.db2.gz OOBHRSBPTWJCNB-HOTGVXAUSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC[N@H+](C)CC1CCC2(CC2)CC1 ZINC001492873806 1360640644 /nfs/dbraw/zinc/64/06/44/1360640644.db2.gz UZSSXZHZAWYZHW-IRXDYDNUSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001492873806 1360640646 /nfs/dbraw/zinc/64/06/46/1360640646.db2.gz UZSSXZHZAWYZHW-IRXDYDNUSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001398552627 1360641498 /nfs/dbraw/zinc/64/14/98/1360641498.db2.gz HGNQYGDOPGELQK-KLHDSHLOSA-N 1 3 345.478 2.635 10 0 EFAEHO CC(C)[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CCC(F)(F)F)N(C)C ZINC001398571666 1360651905 /nfs/dbraw/zinc/65/19/05/1360651905.db2.gz FHQVTZSDCBWCRT-JALIKCBVSA-N 1 3 349.441 2.637 10 0 EFAEHO CC(C)[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC(F)(F)F)N(C)C ZINC001398571666 1360651909 /nfs/dbraw/zinc/65/19/09/1360651909.db2.gz FHQVTZSDCBWCRT-JALIKCBVSA-N 1 3 349.441 2.637 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]2CN(Cc3cccc(F)c3)CC[C@@H]21 ZINC001398596468 1360663854 /nfs/dbraw/zinc/66/38/54/1360663854.db2.gz SVMCQGGTOJFKDY-MJGOQNOKSA-N 1 3 347.478 2.590 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)C3CCC3)C2)c(C)c1 ZINC001398615896 1360672077 /nfs/dbraw/zinc/67/20/77/1360672077.db2.gz DOFYXDZPRWGOMS-HDICACEKSA-N 1 3 329.488 2.525 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+][C@H]2C[C@@H](NC(=O)CN(C)C3CCC3)C2)c1 ZINC001398619865 1360674493 /nfs/dbraw/zinc/67/44/93/1360674493.db2.gz KSDUMRBDPWNHPK-RYQLBKOJSA-N 1 3 329.488 2.777 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC[C@H]2CCc3ccccc32)C1)N(C)C ZINC001398656750 1360691835 /nfs/dbraw/zinc/69/18/35/1360691835.db2.gz CRZJBBGCWSEZEW-FTEYMNFISA-N 1 3 343.515 2.684 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccccc32)C1)N(C)C ZINC001398659634 1360693511 /nfs/dbraw/zinc/69/35/11/1360693511.db2.gz HEVYBNYYRKPHFV-JFRXWTBNSA-N 1 3 329.488 2.641 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1CCC[N@H+](CC2CCC2)C1)N1CCCCCC1 ZINC001398667992 1360699250 /nfs/dbraw/zinc/69/92/50/1360699250.db2.gz GRADDUSPNZCEMZ-MJGOQNOKSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1CCC[N@@H+](CC2CCC2)C1)N1CCCCCC1 ZINC001398667992 1360699254 /nfs/dbraw/zinc/69/92/54/1360699254.db2.gz GRADDUSPNZCEMZ-MJGOQNOKSA-N 1 3 335.536 2.879 10 0 EFAEHO CCc1cccc(C[N@@H+]2CCC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001398682253 1360713301 /nfs/dbraw/zinc/71/33/01/1360713301.db2.gz ICVPHXDRYIXGHI-FQEVSTJZSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1cccc(C[N@H+]2CCC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001398682253 1360713305 /nfs/dbraw/zinc/71/33/05/1360713305.db2.gz ICVPHXDRYIXGHI-FQEVSTJZSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CCCC[N@@H+]1CCCF)N1CCCCCC1 ZINC001398770401 1360776024 /nfs/dbraw/zinc/77/60/24/1360776024.db2.gz ZAAWPNKJZRURLH-DLBZAZTESA-N 1 3 327.488 2.581 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CCCC[N@H+]1CCCF)N1CCCCCC1 ZINC001398770401 1360776027 /nfs/dbraw/zinc/77/60/27/1360776027.db2.gz ZAAWPNKJZRURLH-DLBZAZTESA-N 1 3 327.488 2.581 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001398772406 1360777634 /nfs/dbraw/zinc/77/76/34/1360777634.db2.gz PSMPUDMAUIURDV-LJQANCHMSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H](C)[NH2+]CCc1ccccc1 ZINC001437213093 1387474320 /nfs/dbraw/zinc/47/43/20/1387474320.db2.gz ITOFQJOZWMSRNQ-PKOBYXMFSA-N 1 3 331.504 2.586 10 0 EFAEHO Cc1ccc(F)c(CN2CCC[C@H]([C@H](C)NC(=O)CC[NH+](C)C)C2)c1 ZINC001398785480 1360788791 /nfs/dbraw/zinc/78/87/91/1360788791.db2.gz IGXKFKBLIJYGIJ-IRXDYDNUSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC001398788051 1360791095 /nfs/dbraw/zinc/79/10/95/1360791095.db2.gz FJAZPTHVOGDGFH-AEFFLSMTSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC001398788051 1360791097 /nfs/dbraw/zinc/79/10/97/1360791097.db2.gz FJAZPTHVOGDGFH-AEFFLSMTSA-N 1 3 349.494 2.883 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@@H]2CCCCN2C(C)C)c(C)n1 ZINC001437217250 1387477046 /nfs/dbraw/zinc/47/70/46/1387477046.db2.gz SWJKOZLJMDAPEF-LPHOPBHVSA-N 1 3 346.519 2.556 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc(C)cc1C ZINC001398955588 1360893127 /nfs/dbraw/zinc/89/31/27/1360893127.db2.gz MMTXQZKRRXJLLP-MJGOQNOKSA-N 1 3 331.504 2.772 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]Cc1ccc(Cl)c(Cl)c1)N(C)C ZINC001398985467 1360912368 /nfs/dbraw/zinc/91/23/68/1360912368.db2.gz VDEQLQUTHQJQHN-XHDPSFHLSA-N 1 3 346.302 2.928 10 0 EFAEHO C[C@@H]([NH2+][C@@H](C)CNC(=O)C(C)(C)N1CCCC1)c1cccc(F)c1 ZINC001399047229 1360957308 /nfs/dbraw/zinc/95/73/08/1360957308.db2.gz ZIZHKFZXEVWIGW-LSDHHAIUSA-N 1 3 335.467 2.855 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H]2CCC[C@@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001399284827 1361126490 /nfs/dbraw/zinc/12/64/90/1361126490.db2.gz WHBFDILOTMDIQP-RTBURBONSA-N 1 3 331.504 2.852 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NCC[C@@H](C)NC/C(Cl)=C\Cl ZINC001399346052 1361163673 /nfs/dbraw/zinc/16/36/73/1361163673.db2.gz OSRUXMPAURZZIW-AOSXOHOOSA-N 1 3 336.307 2.664 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](C)CCNC(=O)CN(C)C2CCC2)c1 ZINC001399345104 1361163070 /nfs/dbraw/zinc/16/30/70/1361163070.db2.gz VHNMPBPIPPEQSM-HNNXBMFYSA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NCC[C@@H](C)NC/C(Cl)=C\Cl ZINC001399346052 1361163669 /nfs/dbraw/zinc/16/36/69/1361163669.db2.gz OSRUXMPAURZZIW-AOSXOHOOSA-N 1 3 336.307 2.664 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001399404394 1361199768 /nfs/dbraw/zinc/19/97/68/1361199768.db2.gz WXFCQUOSYBLDHN-AEFFLSMTSA-N 1 3 331.504 2.630 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]Cc1ccc(C)cc1 ZINC001399436579 1361224655 /nfs/dbraw/zinc/22/46/55/1361224655.db2.gz UQMCALBZRMOWTN-PKOBYXMFSA-N 1 3 331.504 2.854 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)c1 ZINC001399478658 1361261328 /nfs/dbraw/zinc/26/13/28/1361261328.db2.gz ACKCTWNLKIFXEE-RBUKOAKNSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)c1 ZINC001399478658 1361261331 /nfs/dbraw/zinc/26/13/31/1361261331.db2.gz ACKCTWNLKIFXEE-RBUKOAKNSA-N 1 3 331.504 2.527 10 0 EFAEHO CN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)Cc1cc2ccccc2s1 ZINC001399643993 1361397538 /nfs/dbraw/zinc/39/75/38/1361397538.db2.gz QBMSMMYFSRXCIP-OAHLLOKOSA-N 1 3 345.512 2.791 10 0 EFAEHO CN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)Cc1cc2ccccc2s1 ZINC001399643993 1361397542 /nfs/dbraw/zinc/39/75/42/1361397542.db2.gz QBMSMMYFSRXCIP-OAHLLOKOSA-N 1 3 345.512 2.791 10 0 EFAEHO C[C@@H](c1ccc(Cl)cc1)N(C)CCNC(=O)C12CC[NH+](CC1)C2 ZINC001399644489 1361399394 /nfs/dbraw/zinc/39/93/94/1361399394.db2.gz STUJAWOYSVZSOZ-AWEZNQCLSA-N 1 3 335.879 2.545 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001437262031 1387514775 /nfs/dbraw/zinc/51/47/75/1387514775.db2.gz NWNOAKDYPIRLFX-GXTWGEPZSA-N 1 3 343.924 2.870 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001437262032 1387515200 /nfs/dbraw/zinc/51/52/00/1387515200.db2.gz NWNOAKDYPIRLFX-JSGCOSHPSA-N 1 3 343.924 2.870 10 0 EFAEHO CCN(C/C=C\c1ccccc1)CCNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001399756097 1361481200 /nfs/dbraw/zinc/48/12/00/1361481200.db2.gz RGVHISAUSHGIJP-HWJGFJICSA-N 1 3 343.515 2.868 10 0 EFAEHO CCN(C/C=C\c1ccccc1)CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001399756097 1361481204 /nfs/dbraw/zinc/48/12/04/1361481204.db2.gz RGVHISAUSHGIJP-HWJGFJICSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CCN(CCC(F)(F)F)C1)[NH+]1CCCCCC1 ZINC001399920066 1361576257 /nfs/dbraw/zinc/57/62/57/1361576257.db2.gz BEONEJHHWKXLOL-HUUCEWRRSA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCN(Cc2ccc(F)cc2)C1)[NH+]1CCCC1 ZINC001399928771 1361583788 /nfs/dbraw/zinc/58/37/88/1361583788.db2.gz XERGWPGQHPHSJH-KRWDZBQOSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[N@H+](C1CC1)[C@H]1CCc2ccccc21)N(C)C ZINC001400038573 1361689368 /nfs/dbraw/zinc/68/93/68/1361689368.db2.gz JNHFLNMRCFLXRR-VQTJNVASSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[N@@H+](C1CC1)[C@H]1CCc2ccccc21)N(C)C ZINC001400038573 1361689374 /nfs/dbraw/zinc/68/93/74/1361689374.db2.gz JNHFLNMRCFLXRR-VQTJNVASSA-N 1 3 343.515 2.841 10 0 EFAEHO CC[C@H]([NH2+]CCN(C)C(=O)CN1CCCC1)c1ccc(Cl)cc1 ZINC001400080307 1361718997 /nfs/dbraw/zinc/71/89/97/1361718997.db2.gz GIZFBJDEOAEXDC-KRWDZBQOSA-N 1 3 337.895 2.935 10 0 EFAEHO C[C@H](C(=O)NCC[C@H]1CCN(C/C=C/Cl)C1)[NH+]1CCCCCC1 ZINC001400182630 1361821656 /nfs/dbraw/zinc/82/16/56/1361821656.db2.gz LEHDNTUSJFDPSJ-BRBWODKKSA-N 1 3 341.927 2.832 10 0 EFAEHO O=C(CN1CCCC1)NCC[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC001400192549 1361833492 /nfs/dbraw/zinc/83/34/92/1361833492.db2.gz XYYVTJMRBGSQCD-KRWDZBQOSA-N 1 3 349.906 2.764 10 0 EFAEHO O=C(CN1CCCC1)NCC[C@H]1CC[N@H+](Cc2ccc(Cl)cc2)C1 ZINC001400192549 1361833494 /nfs/dbraw/zinc/83/34/94/1361833494.db2.gz XYYVTJMRBGSQCD-KRWDZBQOSA-N 1 3 349.906 2.764 10 0 EFAEHO C[C@H](C(=O)N1CC[C@@H](CN(C)C/C=C/Cl)C1)[NH+]1CCCCCC1 ZINC001400237229 1361873336 /nfs/dbraw/zinc/87/33/36/1361873336.db2.gz ZTZSOYYZOMIKDS-DGEHHSODSA-N 1 3 341.927 2.784 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2CCC[C@@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001437320117 1387539771 /nfs/dbraw/zinc/53/97/71/1387539771.db2.gz HUJMPLGADBKTJQ-ZWKOTPCHSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@@H](c1ccc2c(c1)CCC2)N1CCC[C@@H](NC(=O)CC[NH+](C)C)C1 ZINC001400288795 1361909369 /nfs/dbraw/zinc/90/93/69/1361909369.db2.gz IEZNJFUMJQXACS-OXJNMPFZSA-N 1 3 343.515 2.769 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@H+](CC2CCCCC2)C1)N1CCCC1 ZINC001400686761 1362094296 /nfs/dbraw/zinc/09/42/96/1362094296.db2.gz QQNUHDZOXOHZIH-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@@H+](CC2CCCCC2)C1)N1CCCC1 ZINC001400686761 1362094299 /nfs/dbraw/zinc/09/42/99/1362094299.db2.gz QQNUHDZOXOHZIH-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@H+](CCCC2CCC2)C1 ZINC001400773425 1362156722 /nfs/dbraw/zinc/15/67/22/1362156722.db2.gz ZINAAWGZFXLQOW-IEBWSBKVSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@@H+](CCCC2CCC2)C1 ZINC001400773425 1362156723 /nfs/dbraw/zinc/15/67/23/1362156723.db2.gz ZINAAWGZFXLQOW-IEBWSBKVSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccc(C)cc1 ZINC001400799540 1362171155 /nfs/dbraw/zinc/17/11/55/1362171155.db2.gz HSELBXMHAXSQNU-RBUKOAKNSA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]CC1CCC2(CC2)CC1 ZINC001400807160 1362176162 /nfs/dbraw/zinc/17/61/62/1362176162.db2.gz BMNWOCJMLQCLKC-QGZVFWFLSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001400930815 1362271555 /nfs/dbraw/zinc/27/15/55/1362271555.db2.gz YKAROSLWPZRAPX-AWEZNQCLSA-N 1 3 343.874 2.804 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@](C)(C[NH2+]CC1CC(C)(C)C1)C1CC1 ZINC001401048752 1362394755 /nfs/dbraw/zinc/39/47/55/1362394755.db2.gz UMEHVPRXMVDMJH-LJQANCHMSA-N 1 3 332.492 2.571 10 0 EFAEHO CC[C@@H](F)CN1CCC(CCNC(=O)CC[C@H]2CCC[N@@H+]2C)CC1 ZINC001401075459 1362417524 /nfs/dbraw/zinc/41/75/24/1362417524.db2.gz OAPNAFJFCRHKLP-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](F)CN1CCC(CCNC(=O)CC[C@H]2CCC[N@H+]2C)CC1 ZINC001401075459 1362417531 /nfs/dbraw/zinc/41/75/31/1362417531.db2.gz OAPNAFJFCRHKLP-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC001401152709 1362489450 /nfs/dbraw/zinc/48/94/50/1362489450.db2.gz JPRJMRIDWKWHIS-ZIAGYGMSSA-N 1 3 341.446 2.708 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1cc2ccccc2o1)N(C)C ZINC001401253837 1362592499 /nfs/dbraw/zinc/59/24/99/1362592499.db2.gz MDXPSFZFQDCQLI-WMLDXEAASA-N 1 3 331.460 2.710 10 0 EFAEHO CC[C@H]([NH2+]C[C@H](C)N(C)C(=O)CN1CCCC1)c1ccc(F)cc1 ZINC001401257288 1362596473 /nfs/dbraw/zinc/59/64/73/1362596473.db2.gz KLUIEBJHEJYZCI-YJBOKZPZSA-N 1 3 335.467 2.809 10 0 EFAEHO CC[C@@H]([NH2+]C[C@H](C)N(C)C(=O)CN1CCCC1)c1ccc(F)cc1 ZINC001401257281 1362596814 /nfs/dbraw/zinc/59/68/14/1362596814.db2.gz KLUIEBJHEJYZCI-MAUKXSAKSA-N 1 3 335.467 2.809 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C[C@@H](C)N(C)C(=O)CN(C)C(C)C)c1 ZINC001401266267 1362606905 /nfs/dbraw/zinc/60/69/05/1362606905.db2.gz LEBMIEZBRCFMEQ-HZPDHXFCSA-N 1 3 335.492 2.533 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(C2CC2)cc1 ZINC001401268255 1362609635 /nfs/dbraw/zinc/60/96/35/1362609635.db2.gz XEGFIXHZNJSBEK-INIZCTEOSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)C[C@H](C[NH2+]Cc1cccc(F)c1)NC(=O)CN1CC[C@@H](C)C1 ZINC001401269763 1362611545 /nfs/dbraw/zinc/61/15/45/1362611545.db2.gz CBEBIMXBAJOZDY-VQIMIIECSA-N 1 3 349.494 2.788 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(CF)cc2)[C@H](C)C1 ZINC001401304212 1362649419 /nfs/dbraw/zinc/64/94/19/1362649419.db2.gz WLXQSRPXPIKZNG-VQIMIIECSA-N 1 3 349.494 2.823 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(CF)cc2)[C@@H](C)C1 ZINC001401304206 1362649716 /nfs/dbraw/zinc/64/97/16/1362649716.db2.gz WLXQSRPXPIKZNG-LPHOPBHVSA-N 1 3 349.494 2.823 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CCC(F)(F)F)C(C)C ZINC001401337390 1362683663 /nfs/dbraw/zinc/68/36/63/1362683663.db2.gz UYBIOCUZYVCLHD-KGLIPLIRSA-N 1 3 337.430 2.544 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(CF)cc1 ZINC001401345421 1362693567 /nfs/dbraw/zinc/69/35/67/1362693567.db2.gz VSHUAURFWYVOEW-LPHOPBHVSA-N 1 3 349.494 2.728 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCN(C)C(=O)[C@H]2C[NH+]3CCC2CC3)c1 ZINC001401366015 1362716353 /nfs/dbraw/zinc/71/63/53/1362716353.db2.gz JYNOKTMXRRFARJ-FQEVSTJZSA-N 1 3 343.515 2.535 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@H+](C)[C@H]1CCc2ccccc21)N(C)C ZINC001401387258 1362740216 /nfs/dbraw/zinc/74/02/16/1362740216.db2.gz NFAZUWHMIGMXDK-RBUKOAKNSA-N 1 3 331.504 2.650 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@@H+](C)[C@H]1CCc2ccccc21)N(C)C ZINC001401387258 1362740217 /nfs/dbraw/zinc/74/02/17/1362740217.db2.gz NFAZUWHMIGMXDK-RBUKOAKNSA-N 1 3 331.504 2.650 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(C)CCN(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001401437779 1362806120 /nfs/dbraw/zinc/80/61/20/1362806120.db2.gz HKPLHURAOGMXKW-JKSUJKDBSA-N 1 3 335.467 2.619 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(C)CCN(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001401437779 1362806125 /nfs/dbraw/zinc/80/61/25/1362806125.db2.gz HKPLHURAOGMXKW-JKSUJKDBSA-N 1 3 335.467 2.619 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC001401439668 1362809242 /nfs/dbraw/zinc/80/92/42/1362809242.db2.gz OGRYAJWOBMTRDY-SFHVURJKSA-N 1 3 335.467 2.543 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC001401439668 1362809246 /nfs/dbraw/zinc/80/92/46/1362809246.db2.gz OGRYAJWOBMTRDY-SFHVURJKSA-N 1 3 335.467 2.543 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2Cl)C1 ZINC001401493358 1362885419 /nfs/dbraw/zinc/88/54/19/1362885419.db2.gz ODKGPXNTFHXARX-SJLPKXTDSA-N 1 3 349.906 2.715 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+][C@H](C)c1ccc(Cl)cc1)N(C)C ZINC001401634752 1362986719 /nfs/dbraw/zinc/98/67/19/1362986719.db2.gz WNYRHWNHXCFLBF-XJKCOSOUSA-N 1 3 325.884 2.836 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H](C)NC(=O)[C@H]1CCCCN1C(C)C ZINC001401654364 1363003804 /nfs/dbraw/zinc/00/38/04/1363003804.db2.gz WIOBCDCWPPPEDQ-IEBWSBKVSA-N 1 3 331.504 2.852 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+][C@H](C)c1ccc(Cl)cc1 ZINC001401666256 1363013864 /nfs/dbraw/zinc/01/38/64/1363013864.db2.gz HJXZCOGUVDYHCY-ZIAGYGMSSA-N 1 3 325.884 2.836 10 0 EFAEHO C[C@@H](NC[C@H](C)NC(=O)CC[NH+](C)C)c1cccc(Cl)c1F ZINC001401700264 1363036007 /nfs/dbraw/zinc/03/60/07/1363036007.db2.gz PBYPXELCJDTDSN-NWDGAFQWSA-N 1 3 329.847 2.586 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@H](C)NC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001401710429 1363043794 /nfs/dbraw/zinc/04/37/94/1363043794.db2.gz YHLIQFKYQYBSLO-KSSFIOAISA-N 1 3 331.504 2.548 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+][C@H]1CCc2c1cccc2Cl ZINC001401724309 1363056302 /nfs/dbraw/zinc/05/63/02/1363056302.db2.gz PHTMRKOISIVBOY-GUYCJALGSA-N 1 3 337.895 2.762 10 0 EFAEHO C[C@H](C[N@H+](C)[C@@H]1CCc2ccccc21)NC(=O)CN(C)C1CCC1 ZINC001401787253 1363129666 /nfs/dbraw/zinc/12/96/66/1363129666.db2.gz VTSWGWHGNAEQMX-DNVCBOLYSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@H](C[N@@H+](C)[C@@H]1CCc2ccccc21)NC(=O)CN(C)C1CCC1 ZINC001401787253 1363129670 /nfs/dbraw/zinc/12/96/70/1363129670.db2.gz VTSWGWHGNAEQMX-DNVCBOLYSA-N 1 3 329.488 2.595 10 0 EFAEHO CCc1ccc(CN(C)C[C@@H](C)NC(=O)C[C@H]2CC[N@H+](C)C2)cc1 ZINC001401797054 1363142346 /nfs/dbraw/zinc/14/23/46/1363142346.db2.gz HTTJDXGLMYMTMK-VQIMIIECSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(CN(C)C[C@@H](C)NC(=O)C[C@H]2CC[N@@H+](C)C2)cc1 ZINC001401797054 1363142350 /nfs/dbraw/zinc/14/23/50/1363142350.db2.gz HTTJDXGLMYMTMK-VQIMIIECSA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CN(C)Cc1ccccc1)[NH+]1CCCC1 ZINC001401830450 1363172938 /nfs/dbraw/zinc/17/29/38/1363172938.db2.gz SHWVQLWTLAGFCV-MJGOQNOKSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H](NC(=O)[C@@H]2CCCN2C(C)C)C2CC2)cs1 ZINC001401848936 1363185360 /nfs/dbraw/zinc/18/53/60/1363185360.db2.gz SEDRPHTXUINEGI-ROUUACIJSA-N 1 3 349.544 2.914 10 0 EFAEHO CC(C)(C(=O)N[C@H](C[NH2+]CC1CCCC1)C1CC1)N1CCCCC1 ZINC001401850069 1363186077 /nfs/dbraw/zinc/18/60/77/1363186077.db2.gz VHIGVRUYTXCPNR-GOSISDBHSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+][C@@H]1CCc2ccc(F)cc21)C1CC1 ZINC001401874700 1363205906 /nfs/dbraw/zinc/20/59/06/1363205906.db2.gz QPEAMKFLFWOATB-MOPGFXCFSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@H]([NH2+]C1(CNC(=O)CN(C)C2CCC2)CC1)c1ccc(F)cc1 ZINC001401950047 1363269430 /nfs/dbraw/zinc/26/94/30/1363269430.db2.gz RDPVSPKVKDYWMO-SFHVURJKSA-N 1 3 347.478 3.000 10 0 EFAEHO Cc1ccc(CNC2(CNC(=O)[C@H]3CC[N@H+](C)[C@@H](C)C3)CC2)cc1F ZINC001401956968 1363274447 /nfs/dbraw/zinc/27/44/47/1363274447.db2.gz HZYPEOLHAYLILL-RDJZCZTQSA-N 1 3 347.478 2.603 10 0 EFAEHO Cc1ccc(CNC2(CNC(=O)[C@H]3CC[N@@H+](C)[C@@H](C)C3)CC2)cc1F ZINC001401956968 1363274450 /nfs/dbraw/zinc/27/44/50/1363274450.db2.gz HZYPEOLHAYLILL-RDJZCZTQSA-N 1 3 347.478 2.603 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1(N[C@@H]2CCCc3ccc(F)cc32)CC1 ZINC001401977396 1363293985 /nfs/dbraw/zinc/29/39/85/1363293985.db2.gz WJSNFRWIBJBLMB-GOSISDBHSA-N 1 3 347.478 2.783 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1(N[C@@H]2CCCc3ccc(F)cc32)CC1 ZINC001401977396 1363293990 /nfs/dbraw/zinc/29/39/90/1363293990.db2.gz WJSNFRWIBJBLMB-GOSISDBHSA-N 1 3 347.478 2.783 10 0 EFAEHO C[C@H](F)CC[N@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001402002526 1363320469 /nfs/dbraw/zinc/32/04/69/1363320469.db2.gz JASWLVFCAXXGPK-MAUKXSAKSA-N 1 3 339.499 2.532 10 0 EFAEHO C[C@H](F)CC[N@@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001402002526 1363320473 /nfs/dbraw/zinc/32/04/73/1363320473.db2.gz JASWLVFCAXXGPK-MAUKXSAKSA-N 1 3 339.499 2.532 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@]2(CCN(Cc3ccccc3Cl)C2)C1 ZINC001402004316 1363323129 /nfs/dbraw/zinc/32/31/29/1363323129.db2.gz SSNRQRPOCRAPDP-IBGZPJMESA-N 1 3 349.906 2.716 10 0 EFAEHO CC(C)Oc1ccccc1CNC[C@@H]1CCCN1C(=O)CC[NH+](C)C ZINC001402062070 1363369030 /nfs/dbraw/zinc/36/90/30/1363369030.db2.gz SGHJBCXSHKCMOV-SFHVURJKSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2cccc(F)c2)C[C@H]1C ZINC001402063377 1363370214 /nfs/dbraw/zinc/37/02/14/1363370214.db2.gz OZLGHIARVSYXTB-CRAIPNDOSA-N 1 3 335.467 2.635 10 0 EFAEHO C[C@@H](NC[C@H]1CCCN1C(=O)CC[NH+](C)C)c1cc(F)ccc1F ZINC001402064402 1363370941 /nfs/dbraw/zinc/37/09/41/1363370941.db2.gz XTFHEXOIALFIAD-UKRRQHHQSA-N 1 3 339.430 2.558 10 0 EFAEHO C[NH+](C)CCC(=O)NC1(C)CCN([C@@H]2CCc3ccc(F)cc32)CC1 ZINC001402081018 1363385452 /nfs/dbraw/zinc/38/54/52/1363385452.db2.gz OEPDBWTZXCOZHX-GOSISDBHSA-N 1 3 347.478 2.735 10 0 EFAEHO CC[C@H](C(=O)NC1(C)CC[NH+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001402093341 1363399171 /nfs/dbraw/zinc/39/91/71/1363399171.db2.gz XAGXMMKOYVQZOR-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCCN(Cc2ccc(C3CC3)cc2)C1 ZINC001402097384 1363403806 /nfs/dbraw/zinc/40/38/06/1363403806.db2.gz XGQNVNYZGINSLA-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001437419663 1387628818 /nfs/dbraw/zinc/62/88/18/1387628818.db2.gz DGVOZTAQKFEVRI-CQSZACIVSA-N 1 3 332.492 2.715 10 0 EFAEHO C[NH+](C)CC1(C(=O)NC[C@@]2(C)CCCN(Cc3ccsc3)C2)CC1 ZINC001402208269 1363521515 /nfs/dbraw/zinc/52/15/15/1363521515.db2.gz JAAIUWILWJPVRO-GOSISDBHSA-N 1 3 349.544 2.808 10 0 EFAEHO Cc1cc(C[NH+]2CCC3(C[C@H]3NC(=O)CN(C)C(C)C)CC2)cs1 ZINC001402244374 1363564891 /nfs/dbraw/zinc/56/48/91/1363564891.db2.gz TZFAQPONQAECSD-QGZVFWFLSA-N 1 3 349.544 2.867 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC12CC[NH+](CC1CC(C)(C)C1)CC2)N(C)C ZINC001402244992 1363565819 /nfs/dbraw/zinc/56/58/19/1363565819.db2.gz GIOIYQZRUABQIK-IAGOWNOFSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@@H](N[C@H](CNC(=O)CC[NH+](C)C)C1CC1)c1ccccc1Cl ZINC001402331051 1363609270 /nfs/dbraw/zinc/60/92/70/1363609270.db2.gz BIKZTKFNFNQVME-CXAGYDPISA-N 1 3 337.895 2.837 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C1CC1 ZINC001402369125 1363629203 /nfs/dbraw/zinc/62/92/03/1363629203.db2.gz DRWMQRNBUSJYMG-LJQANCHMSA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)C1CC1 ZINC001402389097 1363647611 /nfs/dbraw/zinc/64/76/11/1363647611.db2.gz XOMFTUCUHRIJKK-MOPGFXCFSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@H](F)CN(C)C[C@@H]1CCCN(C(=O)CC[NH+]2CCCCC2)C1 ZINC001402409067 1363668693 /nfs/dbraw/zinc/66/86/93/1363668693.db2.gz QNJLHQNVLJDXJI-ROUUACIJSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[C@@H](F)CN(C)C[C@@H]1CCCN(C(=O)CC[NH+]2CCCCC2)C1 ZINC001402409071 1363668975 /nfs/dbraw/zinc/66/89/75/1363668975.db2.gz QNJLHQNVLJDXJI-ZWKOTPCHSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](C[N@H+](C)CCc2ccccc2)C1)N(C)C ZINC001402414229 1363674060 /nfs/dbraw/zinc/67/40/60/1363674060.db2.gz YBBZPAJOBNWHDJ-VQTJNVASSA-N 1 3 345.531 2.740 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](C[N@@H+](C)CCc2ccccc2)C1)N(C)C ZINC001402414229 1363674063 /nfs/dbraw/zinc/67/40/63/1363674063.db2.gz YBBZPAJOBNWHDJ-VQTJNVASSA-N 1 3 345.531 2.740 10 0 EFAEHO CC1(C)CC(CN2C[C@H]3CC[C@@H](C2)N3C(=O)CCC[NH+]2CCCC2)C1 ZINC001402424565 1363684576 /nfs/dbraw/zinc/68/45/76/1363684576.db2.gz YBNPUHDVXZJRJZ-KDURUIRLSA-N 1 3 347.547 2.974 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)N1CCCC1 ZINC001402427326 1363686050 /nfs/dbraw/zinc/68/60/50/1363686050.db2.gz UNCDHMRYAKVFHG-BCDXTJNWSA-N 1 3 333.520 2.630 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)N1CCCC1 ZINC001402427326 1363686052 /nfs/dbraw/zinc/68/60/52/1363686052.db2.gz UNCDHMRYAKVFHG-BCDXTJNWSA-N 1 3 333.520 2.630 10 0 EFAEHO C[C@@H]([NH2+]CCC(C)(C)C)[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001402427461 1363687010 /nfs/dbraw/zinc/68/70/10/1363687010.db2.gz MSGOVGKACNATGA-QZTJIDSGSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+]([C@@H](C)c3ccccc3F)C[C@@H]2C1 ZINC001402437308 1363692169 /nfs/dbraw/zinc/69/21/69/1363692169.db2.gz YIIXRWAIBRZAGF-YESZJQIVSA-N 1 3 347.478 2.617 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+]([C@@H](C)c3ccccc3F)C[C@@H]2C1 ZINC001402437308 1363692176 /nfs/dbraw/zinc/69/21/76/1363692176.db2.gz YIIXRWAIBRZAGF-YESZJQIVSA-N 1 3 347.478 2.617 10 0 EFAEHO CC1CC(C[NH+]2CCC3(CN(C(=O)CN(C)CC(C)(C)C)C3)CC2)C1 ZINC001402506358 1363748638 /nfs/dbraw/zinc/74/86/38/1363748638.db2.gz VZFZARSNGDRFBZ-UHFFFAOYSA-N 1 3 349.563 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+][C@H]1CCc2c1cccc2F ZINC001437430622 1387641558 /nfs/dbraw/zinc/64/15/58/1387641558.db2.gz ZQIOTHUAOQPOQK-KDOFPFPSSA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2ccccc2C2CC2)C1 ZINC001402548413 1363778974 /nfs/dbraw/zinc/77/89/74/1363778974.db2.gz HYJHWYFNYZTDKS-IYARVYRRSA-N 1 3 329.488 2.641 10 0 EFAEHO CC1CCC(C[NH2+]C2(CNC(=O)C3(N(C)C)CCC3)CCC2)CC1 ZINC001402562755 1363790603 /nfs/dbraw/zinc/79/06/03/1363790603.db2.gz VCHJGLURIIMSDA-UHFFFAOYSA-N 1 3 335.536 2.926 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1(NCc2ccc(Cl)c(F)c2)CCC1 ZINC001402579755 1363808950 /nfs/dbraw/zinc/80/89/50/1363808950.db2.gz UPJQESKQLXKJQD-UHFFFAOYSA-N 1 3 341.858 2.559 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]21 ZINC001402583059 1363811220 /nfs/dbraw/zinc/81/12/20/1363811220.db2.gz QRRBWURDTXEFLQ-PMACEKPBSA-N 1 3 343.515 2.840 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]21 ZINC001402583059 1363811224 /nfs/dbraw/zinc/81/12/24/1363811224.db2.gz QRRBWURDTXEFLQ-PMACEKPBSA-N 1 3 343.515 2.840 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+][C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)C1 ZINC001402601493 1363824995 /nfs/dbraw/zinc/82/49/95/1363824995.db2.gz RRTFEYVIPVUMPX-ZACQAIPSSA-N 1 3 329.488 2.777 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(F)cc32)C1)N(C)C ZINC001402601589 1363826087 /nfs/dbraw/zinc/82/60/87/1363826087.db2.gz SULNSTTZDHTCGW-NBMJBFSESA-N 1 3 347.478 2.636 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(Cl)cc32)C1)N(C)C ZINC001402627904 1363855570 /nfs/dbraw/zinc/85/55/70/1363855570.db2.gz KIOIRHTXRCTYME-MVJTYMMSSA-N 1 3 349.906 2.904 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccccc2C(C)C)C1 ZINC001402635455 1363864056 /nfs/dbraw/zinc/86/40/56/1363864056.db2.gz NLZMBRXOLFDMHR-HDICACEKSA-N 1 3 331.504 2.889 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001402683012 1363931605 /nfs/dbraw/zinc/93/16/05/1363931605.db2.gz DATXKUYORVIWRP-KRWDZBQOSA-N 1 3 335.536 2.737 10 0 EFAEHO CCC1([NH2+]CCC(F)(F)F)CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001402696264 1363944860 /nfs/dbraw/zinc/94/48/60/1363944860.db2.gz AYBJJDPEVRAUHX-CQSZACIVSA-N 1 3 349.441 2.641 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001402712228 1363959664 /nfs/dbraw/zinc/95/96/64/1363959664.db2.gz FFWRBBTWINWUGF-PKOBYXMFSA-N 1 3 349.494 2.938 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@]2(CCN(C/C=C\Cl)C2)C1 ZINC001402718716 1363965238 /nfs/dbraw/zinc/96/52/38/1363965238.db2.gz PFNRISKQXIVYJE-JIGZGPPQSA-N 1 3 341.927 2.785 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@]2(CCN(C/C=C\Cl)C2)C1 ZINC001402718716 1363965243 /nfs/dbraw/zinc/96/52/43/1363965243.db2.gz PFNRISKQXIVYJE-JIGZGPPQSA-N 1 3 341.927 2.785 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001402724907 1363970045 /nfs/dbraw/zinc/97/00/45/1363970045.db2.gz VQXJRZBXYFROAQ-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NCc2ccc3c(c2)CN(CC2CCC2)C3)C1 ZINC001402751328 1363999213 /nfs/dbraw/zinc/99/92/13/1363999213.db2.gz VRDSFENEGACQGT-SFHVURJKSA-N 1 3 341.499 2.760 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NCc2ccc3c(c2)CN(CC2CCC2)C3)C1 ZINC001402751328 1363999216 /nfs/dbraw/zinc/99/92/16/1363999216.db2.gz VRDSFENEGACQGT-SFHVURJKSA-N 1 3 341.499 2.760 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)C1 ZINC001402787550 1364034752 /nfs/dbraw/zinc/03/47/52/1364034752.db2.gz AFSSPUILVJQXGV-CVEARBPZSA-N 1 3 343.531 2.929 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)C1 ZINC001402787550 1364034755 /nfs/dbraw/zinc/03/47/55/1364034755.db2.gz AFSSPUILVJQXGV-CVEARBPZSA-N 1 3 343.531 2.929 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N(C)CCNC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001437454371 1387657511 /nfs/dbraw/zinc/65/75/11/1387657511.db2.gz AVVLUGLSDLQUKT-MOPGFXCFSA-N 1 3 347.478 2.667 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC1CCC([NH2+]C/C=C/Cl)CC1 ZINC001402835831 1364080938 /nfs/dbraw/zinc/08/09/38/1364080938.db2.gz SQJSRVAMJOZEHV-WJZHIMPJSA-N 1 3 327.900 2.629 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CCC[N@H+](CCCF)C2)CC1 ZINC001402915353 1364130989 /nfs/dbraw/zinc/13/09/89/1364130989.db2.gz OZUDNWCDWMETLH-SFHVURJKSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CCC[N@@H+](CCCF)C2)CC1 ZINC001402915353 1364130992 /nfs/dbraw/zinc/13/09/92/1364130992.db2.gz OZUDNWCDWMETLH-SFHVURJKSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)CC[NH+](C)C)CCN1C/C=C/c1ccccc1 ZINC001402916677 1364132509 /nfs/dbraw/zinc/13/25/09/1364132509.db2.gz HTCQLOILWAPFIM-FFRPFHMCSA-N 1 3 329.488 2.621 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@H]1CCCN1C(=O)CC[NH+](C)C ZINC001402923843 1364139023 /nfs/dbraw/zinc/13/90/23/1364139023.db2.gz HHGYNGHHUDZNNR-GOSISDBHSA-N 1 3 335.467 2.509 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@H+](Cc2ccc(C)nc2C)[C@H](C)C1 ZINC001402932398 1364140240 /nfs/dbraw/zinc/14/02/40/1364140240.db2.gz KFJNQEVLKSVYPT-VQIMIIECSA-N 1 3 346.519 2.509 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C)nc2C)[C@H](C)C1 ZINC001402932398 1364140243 /nfs/dbraw/zinc/14/02/43/1364140243.db2.gz KFJNQEVLKSVYPT-VQIMIIECSA-N 1 3 346.519 2.509 10 0 EFAEHO C[C@H]([NH2+]CC1CC(NC(=O)CN(C)C2CCC2)C1)c1ccccc1F ZINC001402930186 1364143836 /nfs/dbraw/zinc/14/38/36/1364143836.db2.gz XTWNOKPRDQCZFD-FHERZECASA-N 1 3 347.478 2.855 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2ccc(Cl)cc2)C1)N(C)C ZINC001402951186 1364157442 /nfs/dbraw/zinc/15/74/42/1364157442.db2.gz QHPUKVQLZZDZPR-BDVYOWHSSA-N 1 3 337.895 2.665 10 0 EFAEHO Cc1ccncc1C[NH2+][C@H](C)[C@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001402971068 1364170865 /nfs/dbraw/zinc/17/08/65/1364170865.db2.gz HDYLOUHBMWCXTI-SJORKVTESA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001403018556 1364218616 /nfs/dbraw/zinc/21/86/16/1364218616.db2.gz BZBKVMPNOGCDJJ-ZIAGYGMSSA-N 1 3 325.884 2.663 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001403144631 1364362354 /nfs/dbraw/zinc/36/23/54/1364362354.db2.gz ONYLDSHZGJFKID-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001403144631 1364362360 /nfs/dbraw/zinc/36/23/60/1364362360.db2.gz ONYLDSHZGJFKID-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001403144647 1364362588 /nfs/dbraw/zinc/36/25/88/1364362588.db2.gz ONYLDSHZGJFKID-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001403144647 1364362591 /nfs/dbraw/zinc/36/25/91/1364362591.db2.gz ONYLDSHZGJFKID-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001437480197 1387680255 /nfs/dbraw/zinc/68/02/55/1387680255.db2.gz BUWSZHVTJMJDJF-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001437480197 1387680257 /nfs/dbraw/zinc/68/02/57/1387680257.db2.gz BUWSZHVTJMJDJF-WOJBJXKFSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001437480187 1387681216 /nfs/dbraw/zinc/68/12/16/1387681216.db2.gz BUWSZHVTJMJDJF-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001437480187 1387681222 /nfs/dbraw/zinc/68/12/22/1387681222.db2.gz BUWSZHVTJMJDJF-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCCC[N@@H+]1CCCF)N1CCCC1 ZINC001403297693 1364513009 /nfs/dbraw/zinc/51/30/09/1364513009.db2.gz YXEDLCPJAROWLP-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCCC[N@H+]1CCCF)N1CCCC1 ZINC001403297693 1364513012 /nfs/dbraw/zinc/51/30/12/1364513012.db2.gz YXEDLCPJAROWLP-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCCC[N@@H+]1CCCF)N1CCCC1 ZINC001403297688 1364513324 /nfs/dbraw/zinc/51/33/24/1364513324.db2.gz YXEDLCPJAROWLP-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCCC[N@H+]1CCCF)N1CCCC1 ZINC001403297688 1364513329 /nfs/dbraw/zinc/51/33/29/1364513329.db2.gz YXEDLCPJAROWLP-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)c1ccccc1CN1CC([C@H](C)NC(=O)CC[NH+](C)C)C1 ZINC001403325146 1364543784 /nfs/dbraw/zinc/54/37/84/1364543784.db2.gz NFCOAYJKPUVWEU-INIZCTEOSA-N 1 3 331.504 2.698 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](CC2CCC(C)(C)CC2)C1)N(C)C ZINC001403360260 1364571386 /nfs/dbraw/zinc/57/13/86/1364571386.db2.gz VZVATSYSIWDEIY-MAUKXSAKSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](Cc2ccccc2C2CC2)C1)N(C)C ZINC001403362328 1364573874 /nfs/dbraw/zinc/57/38/74/1364573874.db2.gz YZNXKVIWLDFRFO-FOIQADDNSA-N 1 3 343.515 2.841 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@@]2(C)CN(C[C@H](F)CC)C[C@@]2(C)C1 ZINC001403396196 1364600781 /nfs/dbraw/zinc/60/07/81/1364600781.db2.gz CEGZHUFZVCHFNU-QRQLOZEOSA-N 1 3 341.515 2.637 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@@]2(C)CN(C[C@H](F)CC)C[C@@]2(C)C1 ZINC001403396196 1364600788 /nfs/dbraw/zinc/60/07/88/1364600788.db2.gz CEGZHUFZVCHFNU-QRQLOZEOSA-N 1 3 341.515 2.637 10 0 EFAEHO CN(CC(=O)N1C[C@]2(C)C[N@H+](CC3CCC3)C[C@]2(C)C1)CC(C)(C)C ZINC001403408241 1364612969 /nfs/dbraw/zinc/61/29/69/1364612969.db2.gz VFDVBUKYNFXBEI-OYRHEFFESA-N 1 3 349.563 2.935 10 0 EFAEHO CN(CC(=O)N1C[C@]2(C)C[N@@H+](CC3CCC3)C[C@]2(C)C1)CC(C)(C)C ZINC001403408241 1364612974 /nfs/dbraw/zinc/61/29/74/1364612974.db2.gz VFDVBUKYNFXBEI-OYRHEFFESA-N 1 3 349.563 2.935 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001403412819 1364616898 /nfs/dbraw/zinc/61/68/98/1364616898.db2.gz KATQQAWKVFKQOL-GBESFXJTSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001403412819 1364616902 /nfs/dbraw/zinc/61/69/02/1364616902.db2.gz KATQQAWKVFKQOL-GBESFXJTSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H]2CCc3c2cccc3F)C1)N(C)C ZINC001403415903 1364620259 /nfs/dbraw/zinc/62/02/59/1364620259.db2.gz BBKQOHYBJXFEBG-TWKYDXJASA-N 1 3 347.478 2.638 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](CC3CCC3)C[C@@H]2C1)CC(C)(C)C ZINC001403435533 1364638564 /nfs/dbraw/zinc/63/85/64/1364638564.db2.gz WYOCGZUDNCBAOS-CEXWTWQISA-N 1 3 349.563 2.981 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](CC3CCC3)C[C@@H]2C1)CC(C)(C)C ZINC001403435533 1364638567 /nfs/dbraw/zinc/63/85/67/1364638567.db2.gz WYOCGZUDNCBAOS-CEXWTWQISA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)c1cccc(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@@H](C)C2)n1 ZINC001403442058 1364644701 /nfs/dbraw/zinc/64/47/01/1364644701.db2.gz GFXBFRNPFGGVOX-IAGOWNOFSA-N 1 3 346.519 2.531 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2cccc(Cl)c2)C1)N(C)C ZINC001403459944 1364662005 /nfs/dbraw/zinc/66/20/05/1364662005.db2.gz PBSLJTCGMDVYAH-XIRDDKMYSA-N 1 3 337.895 2.665 10 0 EFAEHO CCCC[N@H+](C)C1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001403486266 1364693842 /nfs/dbraw/zinc/69/38/42/1364693842.db2.gz NNWPTXWJZLUTAM-LJQANCHMSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCC[N@@H+](C)C1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001403486266 1364693846 /nfs/dbraw/zinc/69/38/46/1364693846.db2.gz NNWPTXWJZLUTAM-LJQANCHMSA-N 1 3 341.515 2.922 10 0 EFAEHO COc1cccc([C@@H](C)N(C)CCNC(=O)[C@H]2CCC[N@@H+]2C(C)C)c1 ZINC001403555420 1364758043 /nfs/dbraw/zinc/75/80/43/1364758043.db2.gz GFUFPLCIGCSNAC-VQIMIIECSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@@H](C)N(C)CCNC(=O)[C@H]2CCC[N@H+]2C(C)C)c1 ZINC001403555420 1364758048 /nfs/dbraw/zinc/75/80/48/1364758048.db2.gz GFUFPLCIGCSNAC-VQIMIIECSA-N 1 3 347.503 2.677 10 0 EFAEHO C[C@H](CN(C)C(=O)C12CCC[NH+](CCC1)C2)NCc1ccccc1F ZINC001403559521 1364761723 /nfs/dbraw/zinc/76/17/23/1364761723.db2.gz BOSGMIQFLBVMLP-MRXNPFEDSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001403578287 1364779585 /nfs/dbraw/zinc/77/95/85/1364779585.db2.gz JEBPKSAGPYINGU-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)cc1 ZINC001403591761 1364794717 /nfs/dbraw/zinc/79/47/17/1364794717.db2.gz PPPYKMMAAZHCSR-MOPGFXCFSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)cc1 ZINC001403591761 1364794720 /nfs/dbraw/zinc/79/47/20/1364794720.db2.gz PPPYKMMAAZHCSR-MOPGFXCFSA-N 1 3 329.488 2.560 10 0 EFAEHO C[C@H](CN(C)C(=O)CN(C)CC(C)(C)C)[NH2+]CC1CC(C)(C)C1 ZINC001403595423 1364798996 /nfs/dbraw/zinc/79/89/96/1364798996.db2.gz QDSRATCMCMERCX-OAHLLOKOSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(Cl)cc1 ZINC001403596239 1364799565 /nfs/dbraw/zinc/79/95/65/1364799565.db2.gz JSOIQTHQDPQQEI-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO CC[C@@H](N[C@H](C)CN(C)C(=O)CC[NH+](C)C)c1ccc(F)cc1F ZINC001403607909 1364812362 /nfs/dbraw/zinc/81/23/62/1364812362.db2.gz XLMAIVLBIVUPKD-CXAGYDPISA-N 1 3 341.446 2.804 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1cccc(F)c1 ZINC001403622233 1364824710 /nfs/dbraw/zinc/82/47/10/1364824710.db2.gz LHJIMXJWGWVLMC-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CN(CC(=O)NCC[N@H+](C)CC[C@H]1CCCC1(F)F)CC(C)(C)C ZINC001403683147 1364861644 /nfs/dbraw/zinc/86/16/44/1364861644.db2.gz GUBOJXMJFWGNLG-OAHLLOKOSA-N 1 3 347.494 2.838 10 0 EFAEHO CN(CC(=O)NCC[N@@H+](C)CC[C@H]1CCCC1(F)F)CC(C)(C)C ZINC001403683147 1364861647 /nfs/dbraw/zinc/86/16/47/1364861647.db2.gz GUBOJXMJFWGNLG-OAHLLOKOSA-N 1 3 347.494 2.838 10 0 EFAEHO CC(C)Oc1ccccc1CN[C@H]1CCN(C(=O)CC[NH+](C)C)[C@@H]1C ZINC001403741165 1364894454 /nfs/dbraw/zinc/89/44/54/1364894454.db2.gz HCJAFOCFFSDENL-AEFFLSMTSA-N 1 3 347.503 2.505 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CC2CCC(F)(F)CC2)[C@H]1C ZINC001403740937 1364895172 /nfs/dbraw/zinc/89/51/72/1364895172.db2.gz GJNIRZYGCUFUQR-ZBFHGGJFSA-N 1 3 345.478 2.731 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1CC[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001403830599 1364983592 /nfs/dbraw/zinc/98/35/92/1364983592.db2.gz ZXAGZTZKSVFNPL-FXAWDEMLSA-N 1 3 345.531 2.964 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]Cc2cccc(CC)c2)C(C)(C)C1 ZINC001403835156 1364986312 /nfs/dbraw/zinc/98/63/12/1364986312.db2.gz XXIQLLOFYZBDTJ-IBGZPJMESA-N 1 3 345.531 2.917 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)[C@H](C)c1ccc(F)cc1 ZINC001403926240 1365051023 /nfs/dbraw/zinc/05/10/23/1365051023.db2.gz RIWKRFBFRUVXQX-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)[C@H](C)c1ccc(F)cc1 ZINC001403926240 1365051027 /nfs/dbraw/zinc/05/10/27/1365051027.db2.gz RIWKRFBFRUVXQX-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO Cc1ccc(CN(C)CCN(C(=O)CC[NH+](C)C)C(C)C)c(C)c1 ZINC001403938651 1365072900 /nfs/dbraw/zinc/07/29/00/1365072900.db2.gz CKIZYIMDFFKIBT-UHFFFAOYSA-N 1 3 333.520 2.924 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1CC[NH+](CCc2ccccc2)CC1)N(C)C ZINC001404002035 1365154226 /nfs/dbraw/zinc/15/42/26/1365154226.db2.gz FKYTXPDUEUTTQQ-FXAWDEMLSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@@H+]1CC1CC2(CCC2)C1)N(C)C ZINC001404007867 1365161901 /nfs/dbraw/zinc/16/19/01/1365161901.db2.gz ALFWHHOGXYHDQC-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@H+]1CC1CC2(CCC2)C1)N(C)C ZINC001404007867 1365161907 /nfs/dbraw/zinc/16/19/07/1365161907.db2.gz ALFWHHOGXYHDQC-ROUUACIJSA-N 1 3 335.536 2.734 10 0 EFAEHO CCc1cccc(C[NH2+]C2CC(N(C)C(=O)[C@@H](CC)N(C)C)C2)c1 ZINC001404015809 1365169133 /nfs/dbraw/zinc/16/91/33/1365169133.db2.gz ILGUAQMJUBNNRN-CTWPCTMYSA-N 1 3 331.504 2.668 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)C1CC(NCc2ccc(Cl)cc2F)C1 ZINC001404016779 1365170907 /nfs/dbraw/zinc/17/09/07/1365170907.db2.gz LTPKPYCLKLCINM-UHFFFAOYSA-N 1 3 341.858 2.510 10 0 EFAEHO CC[C@@H](C(=O)NC1(C2CC[NH+](CCC(F)(F)F)CC2)CC1)N(C)C ZINC001404022043 1365177160 /nfs/dbraw/zinc/17/71/60/1365177160.db2.gz UFUPZOLPPHCHSW-AWEZNQCLSA-N 1 3 349.441 2.640 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CC[C@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001404069919 1365228201 /nfs/dbraw/zinc/22/82/01/1365228201.db2.gz BTQXROWCBOFOOC-ZWKOTPCHSA-N 1 3 343.515 2.529 10 0 EFAEHO CCc1ccccc1C[N@H+]1CC[C@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001404069919 1365228205 /nfs/dbraw/zinc/22/82/05/1365228205.db2.gz BTQXROWCBOFOOC-ZWKOTPCHSA-N 1 3 343.515 2.529 10 0 EFAEHO Cc1ccc(F)c(C[N@H+]2CC[C@H](CNC(=O)CN(C)C3CCC3)C2)c1 ZINC001404076710 1365236680 /nfs/dbraw/zinc/23/66/80/1365236680.db2.gz FUTQURJYLSIXAB-MRXNPFEDSA-N 1 3 347.478 2.557 10 0 EFAEHO Cc1ccc(F)c(C[N@@H+]2CC[C@H](CNC(=O)CN(C)C3CCC3)C2)c1 ZINC001404076710 1365236682 /nfs/dbraw/zinc/23/66/82/1365236682.db2.gz FUTQURJYLSIXAB-MRXNPFEDSA-N 1 3 347.478 2.557 10 0 EFAEHO CCCN(C(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1)[C@@H]1CCN(CC)C1 ZINC001404437248 1365541889 /nfs/dbraw/zinc/54/18/89/1365541889.db2.gz HWJMBGUSZSEXLL-IEBWSBKVSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN(C(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1)[C@@H]1CCN(CC)C1 ZINC001404437248 1365541891 /nfs/dbraw/zinc/54/18/91/1365541891.db2.gz HWJMBGUSZSEXLL-IEBWSBKVSA-N 1 3 335.536 2.974 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2cc(C)ccc2C)C1)N(C)C ZINC001404534642 1365636210 /nfs/dbraw/zinc/63/62/10/1365636210.db2.gz RJNRCHYHUHNHOD-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2cc(C)ccc2C)C1)N(C)C ZINC001404534642 1365636213 /nfs/dbraw/zinc/63/62/13/1365636213.db2.gz RJNRCHYHUHNHOD-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCC[N@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)c1 ZINC001437561351 1387768373 /nfs/dbraw/zinc/76/83/73/1387768373.db2.gz ALPMHXOOXZCPRB-GGPKGHCWSA-N 1 3 343.515 2.846 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCC[N@@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)c1 ZINC001437561351 1387768381 /nfs/dbraw/zinc/76/83/81/1387768381.db2.gz ALPMHXOOXZCPRB-GGPKGHCWSA-N 1 3 343.515 2.846 10 0 EFAEHO CC(C)CCC[NH+]1CC(CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001404931176 1365916633 /nfs/dbraw/zinc/91/66/33/1365916633.db2.gz NZPCEPAGKZUYAD-UHFFFAOYSA-N 1 3 331.504 2.846 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@H+](Cc2ccc(C)cc2)C1 ZINC001405183556 1366094017 /nfs/dbraw/zinc/09/40/17/1366094017.db2.gz NETFEYWQZRCSKI-UYAOXDASSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@@H+](Cc2ccc(C)cc2)C1 ZINC001405183556 1366094021 /nfs/dbraw/zinc/09/40/21/1366094021.db2.gz NETFEYWQZRCSKI-UYAOXDASSA-N 1 3 343.515 2.760 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](CC)[NH2+]Cc1ccc(F)cc1 ZINC001405251675 1366118351 /nfs/dbraw/zinc/11/83/51/1366118351.db2.gz JUXYBEALOXDVPC-ROUUACIJSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC)NCC=C(Cl)Cl ZINC001405271138 1366127344 /nfs/dbraw/zinc/12/73/44/1366127344.db2.gz WSAJZKOCDBTVAF-RWMBFGLXSA-N 1 3 336.307 2.520 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC)NCC=C(Cl)Cl ZINC001405271138 1366127348 /nfs/dbraw/zinc/12/73/48/1366127348.db2.gz WSAJZKOCDBTVAF-RWMBFGLXSA-N 1 3 336.307 2.520 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)[N@H+](C)C1CCCC1)NCc1ccccn1 ZINC001405273592 1366128152 /nfs/dbraw/zinc/12/81/52/1366128152.db2.gz UMUGUMAYJUENDT-MRXNPFEDSA-N 1 3 346.519 2.719 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)[N@@H+](C)C1CCCC1)NCc1ccccn1 ZINC001405273592 1366128154 /nfs/dbraw/zinc/12/81/54/1366128154.db2.gz UMUGUMAYJUENDT-MRXNPFEDSA-N 1 3 346.519 2.719 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CC1CC2(CCC2)C1 ZINC001405274691 1366128959 /nfs/dbraw/zinc/12/89/59/1366128959.db2.gz OPGRDMZTRDIRLV-KRWDZBQOSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(C)cc1C ZINC001405301239 1366139218 /nfs/dbraw/zinc/13/92/18/1366139218.db2.gz JLZVQDCIHHSSSQ-VQIMIIECSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H]1CCCc2ccccc21 ZINC001405358837 1366162260 /nfs/dbraw/zinc/16/22/60/1366162260.db2.gz CVRVTSDKZZWAEK-MJGOQNOKSA-N 1 3 331.504 2.889 10 0 EFAEHO CC[C@H](F)C[NH2+][C@H]1CC[C@H](NC(=O)[C@H]2CCCN2C(C)C)CC1 ZINC001405522639 1366265937 /nfs/dbraw/zinc/26/59/37/1366265937.db2.gz RGPYJYSBLDHTHF-LUKYLMHMSA-N 1 3 327.488 2.624 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[C@H]([NH2+]CC2CC3(CCC3)C2)CC1)N(C)C ZINC001405525314 1366270016 /nfs/dbraw/zinc/27/00/16/1366270016.db2.gz OLRUGJRSUMODEL-KZNAEPCWSA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H](C)CNC(=O)C(C)(C)N2CCCC2)cs1 ZINC001405696187 1366344873 /nfs/dbraw/zinc/34/48/73/1366344873.db2.gz XIJYABSKZKDELY-AWEZNQCLSA-N 1 3 337.533 2.773 10 0 EFAEHO Cc1cccnc1CNC[C@H](C)N(C)C(=O)[C@@H]1CCCC[N@H+]1C(C)C ZINC001405868303 1366477277 /nfs/dbraw/zinc/47/72/77/1366477277.db2.gz UAEUSWZMNDDHMM-HKUYNNGSSA-N 1 3 346.519 2.589 10 0 EFAEHO Cc1cccnc1CNC[C@H](C)N(C)C(=O)[C@@H]1CCCC[N@@H+]1C(C)C ZINC001405868303 1366477280 /nfs/dbraw/zinc/47/72/80/1366477280.db2.gz UAEUSWZMNDDHMM-HKUYNNGSSA-N 1 3 346.519 2.589 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)N(C)C(=O)C[N@@H+]1CC[C@H](C)C1 ZINC001405875721 1366484310 /nfs/dbraw/zinc/48/43/10/1366484310.db2.gz YHWUMNAUAFYTEA-LSDHHAIUSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)N(C)C(=O)C[N@H+]1CC[C@H](C)C1 ZINC001405875721 1366484311 /nfs/dbraw/zinc/48/43/11/1366484311.db2.gz YHWUMNAUAFYTEA-LSDHHAIUSA-N 1 3 337.895 2.618 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(C)nc1C ZINC001405901735 1366506393 /nfs/dbraw/zinc/50/63/93/1366506393.db2.gz FEVMLGFXWXHCDV-VQIMIIECSA-N 1 3 346.519 2.509 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CC2CC3(CCC3)C2)[C@H](C)C1 ZINC001405967870 1367022673 /nfs/dbraw/zinc/02/26/73/1367022673.db2.gz KJKZPLBSVKGRIS-SJLPKXTDSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@H](F)CC[N@H+](C)CCC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001405969753 1367024932 /nfs/dbraw/zinc/02/49/32/1367024932.db2.gz ITJWZTKSDPFCKE-INIZCTEOSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)CCC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001405969753 1367024937 /nfs/dbraw/zinc/02/49/37/1367024937.db2.gz ITJWZTKSDPFCKE-INIZCTEOSA-N 1 3 341.515 2.779 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)c(C)c1 ZINC001405990634 1367061443 /nfs/dbraw/zinc/06/14/43/1367061443.db2.gz ZWMUUDWEKNSGST-ICSRJNTNSA-N 1 3 345.531 2.970 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001406140883 1367306331 /nfs/dbraw/zinc/30/63/31/1367306331.db2.gz DLWHVBBLKWMKRX-WMZOPIPTSA-N 1 3 349.544 2.698 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001406140883 1367306336 /nfs/dbraw/zinc/30/63/36/1367306336.db2.gz DLWHVBBLKWMKRX-WMZOPIPTSA-N 1 3 349.544 2.698 10 0 EFAEHO CN(CC[N@H+](C)[C@@H]1CCCc2ccc(F)cc21)C(=O)CN1CCCC1 ZINC001406163565 1367348599 /nfs/dbraw/zinc/34/85/99/1367348599.db2.gz JSLMOTDQTOPAOK-LJQANCHMSA-N 1 3 347.478 2.689 10 0 EFAEHO CN(CC[N@@H+](C)[C@@H]1CCCc2ccc(F)cc21)C(=O)CN1CCCC1 ZINC001406163565 1367348605 /nfs/dbraw/zinc/34/86/05/1367348605.db2.gz JSLMOTDQTOPAOK-LJQANCHMSA-N 1 3 347.478 2.689 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCC[C@H]2NC(=O)CN(C)C(C)C)cc1 ZINC001406194470 1367392626 /nfs/dbraw/zinc/39/26/26/1367392626.db2.gz LPRBGXYNLXYNCJ-RTBURBONSA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+][C@@H]1CCc2c1cccc2F ZINC001406307702 1367461536 /nfs/dbraw/zinc/46/15/36/1367461536.db2.gz KNNLFGXWFFGOSM-KBXCAEBGSA-N 1 3 335.467 2.638 10 0 EFAEHO CCN(CC[NH2+][C@H](C)c1cc(C)ccc1C)C(=O)CN1CCCC1 ZINC001406332335 1367493992 /nfs/dbraw/zinc/49/39/92/1367493992.db2.gz AKVQNPGIRUJGOD-GOSISDBHSA-N 1 3 331.504 2.898 10 0 EFAEHO C[C@H](CNCc1cc2ccccc2o1)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001406379863 1367536553 /nfs/dbraw/zinc/53/65/53/1367536553.db2.gz NEMSVCSEMLKEMR-OAHLLOKOSA-N 1 3 343.471 2.902 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001406419503 1367569598 /nfs/dbraw/zinc/56/95/98/1367569598.db2.gz IPSSSPBZILFWHK-CXAGYDPISA-N 1 3 337.895 2.763 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1cc2ccccc2o1 ZINC001406482881 1367635517 /nfs/dbraw/zinc/63/55/17/1367635517.db2.gz RWQLDPBGLMWRGH-MAUKXSAKSA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1cc2ccccc2o1 ZINC001406482881 1367635521 /nfs/dbraw/zinc/63/55/21/1367635521.db2.gz RWQLDPBGLMWRGH-MAUKXSAKSA-N 1 3 343.471 2.902 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1cccc(C(C)C)n1 ZINC001406484506 1367636914 /nfs/dbraw/zinc/63/69/14/1367636914.db2.gz WQXDQEHFINYMGL-QFBILLFUSA-N 1 3 346.519 2.674 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1cccc(C(C)C)n1 ZINC001406484506 1367636919 /nfs/dbraw/zinc/63/69/19/1367636919.db2.gz WQXDQEHFINYMGL-QFBILLFUSA-N 1 3 346.519 2.674 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001406496488 1367649409 /nfs/dbraw/zinc/64/94/09/1367649409.db2.gz OQDODJWOHQRKAS-HOCLYGCPSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001406496488 1367649415 /nfs/dbraw/zinc/64/94/15/1367649415.db2.gz OQDODJWOHQRKAS-HOCLYGCPSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@@H](C[NH2+]C[C@@H]1CCCC(F)(F)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001406513288 1367669469 /nfs/dbraw/zinc/66/94/69/1367669469.db2.gz CEMLNCPWTVAKTJ-LSDHHAIUSA-N 1 3 345.478 2.781 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc(Cl)s1 ZINC001406555950 1367721553 /nfs/dbraw/zinc/72/15/53/1367721553.db2.gz HMPXQZPGMUKRNY-GXTWGEPZSA-N 1 3 343.924 2.870 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)Cc2ccc(C)c(F)c2)CC[N@@H+]1C ZINC001406611002 1367801367 /nfs/dbraw/zinc/80/13/67/1367801367.db2.gz MYFDFRULRPXGSY-VDZJLULYSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)Cc2ccc(C)c(F)c2)CC[N@H+]1C ZINC001406611002 1367801373 /nfs/dbraw/zinc/80/13/73/1367801373.db2.gz MYFDFRULRPXGSY-VDZJLULYSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)Cc2ccc(C)cc2)CC[N@@H+]1C ZINC001406622515 1367819590 /nfs/dbraw/zinc/81/95/90/1367819590.db2.gz XROSAFKNRXEZLV-YTQUADARSA-N 1 3 331.504 2.662 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)Cc2ccc(C)cc2)CC[N@H+]1C ZINC001406622515 1367819598 /nfs/dbraw/zinc/81/95/98/1367819598.db2.gz XROSAFKNRXEZLV-YTQUADARSA-N 1 3 331.504 2.662 10 0 EFAEHO C[C@@H](C[N@H+](C)C[C@@H]1CCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001406667698 1367892850 /nfs/dbraw/zinc/89/28/50/1367892850.db2.gz LCRJYGFKOSTYLK-LSDHHAIUSA-N 1 3 347.494 2.836 10 0 EFAEHO C[C@@H](C[N@@H+](C)C[C@@H]1CCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001406667698 1367892856 /nfs/dbraw/zinc/89/28/56/1367892856.db2.gz LCRJYGFKOSTYLK-LSDHHAIUSA-N 1 3 347.494 2.836 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C[NH2+]Cc1ccc(F)cc1)C1CC1 ZINC001406760603 1368014412 /nfs/dbraw/zinc/01/44/12/1368014412.db2.gz LDCWSKPWHGKURY-MOPGFXCFSA-N 1 3 347.478 2.685 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]Cc1ccc(F)cc1)C1CC1 ZINC001406760605 1368014642 /nfs/dbraw/zinc/01/46/42/1368014642.db2.gz LDCWSKPWHGKURY-RBUKOAKNSA-N 1 3 347.478 2.685 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CCN1CC1CC2(CCC2)C1)[NH+](CC)CC ZINC001406845199 1368119742 /nfs/dbraw/zinc/11/97/42/1368119742.db2.gz FQBTWPVTAMHRDH-MSOLQXFVSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)(C)CCCN1CC[C@@H]1CNC(=O)C12CCC[NH+](CCC1)C2 ZINC001406875653 1368152920 /nfs/dbraw/zinc/15/29/20/1368152920.db2.gz XLPZLMTXVOCWGY-QGZVFWFLSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+]CC[C@H]2CCCC2(F)F)CC1)N(C)C ZINC001406939684 1368230391 /nfs/dbraw/zinc/23/03/91/1368230391.db2.gz UXZKUVHGHWIXMM-CABCVRRESA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+]CC[C@@H]2CCCC2(F)F)CC1)N(C)C ZINC001406939687 1368230496 /nfs/dbraw/zinc/23/04/96/1368230496.db2.gz UXZKUVHGHWIXMM-GJZGRUSLSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](CC[C@H](C)F)CC2CC2)CC1 ZINC001407019187 1368331783 /nfs/dbraw/zinc/33/17/83/1368331783.db2.gz FNNIGNXUQFWJOG-INIZCTEOSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](CC[C@H](C)F)CC2CC2)CC1 ZINC001407019187 1368331789 /nfs/dbraw/zinc/33/17/89/1368331789.db2.gz FNNIGNXUQFWJOG-INIZCTEOSA-N 1 3 341.515 2.778 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@]2(CC[N@H+](Cc3ccsc3)C2)C1 ZINC001407030816 1368352303 /nfs/dbraw/zinc/35/23/03/1368352303.db2.gz PXQJIJGHWQWYFW-GOSISDBHSA-N 1 3 335.517 2.514 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@]2(CC[N@@H+](Cc3ccsc3)C2)C1 ZINC001407030816 1368352307 /nfs/dbraw/zinc/35/23/07/1368352307.db2.gz PXQJIJGHWQWYFW-GOSISDBHSA-N 1 3 335.517 2.514 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C)CC[NH+](CCc2ccccc2)CC1 ZINC001407129699 1368463112 /nfs/dbraw/zinc/46/31/12/1368463112.db2.gz VHTRJEJEALHKMA-UHFFFAOYSA-N 1 3 331.504 2.540 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@]2(CC[N@H+](CCC3CC3)C2)C1 ZINC001407158701 1368514816 /nfs/dbraw/zinc/51/48/16/1368514816.db2.gz AGELHSANUIWYIG-FQEVSTJZSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@]2(CC[N@@H+](CCC3CC3)C2)C1 ZINC001407158701 1368514826 /nfs/dbraw/zinc/51/48/26/1368514826.db2.gz AGELHSANUIWYIG-FQEVSTJZSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]Cc1ccccc1)C1CCCC1 ZINC001407160353 1368517970 /nfs/dbraw/zinc/51/79/70/1368517970.db2.gz DFMGINZBJJRACQ-IBGZPJMESA-N 1 3 331.504 2.791 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(C)CCN(C/C=C\Cl)CC2)CC[N@@H+]1C ZINC001407264333 1368673419 /nfs/dbraw/zinc/67/34/19/1368673419.db2.gz WDMTYXODMXNRHH-ZIDUMWFYSA-N 1 3 341.927 2.688 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(C)CCN(C/C=C\Cl)CC2)CC[N@H+]1C ZINC001407264333 1368673432 /nfs/dbraw/zinc/67/34/32/1368673432.db2.gz WDMTYXODMXNRHH-ZIDUMWFYSA-N 1 3 341.927 2.688 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[N@H+](CCC(C)(C)C)CCC1(F)F ZINC001407316390 1368759301 /nfs/dbraw/zinc/75/93/01/1368759301.db2.gz JAQNODIPVCAJJF-HNNXBMFYSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[N@@H+](CCC(C)(C)C)CCC1(F)F ZINC001407316390 1368759305 /nfs/dbraw/zinc/75/93/05/1368759305.db2.gz JAQNODIPVCAJJF-HNNXBMFYSA-N 1 3 347.494 2.836 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@]1(C)CCC[N@@H+](CCCC(C)C)C1 ZINC001407317258 1368762372 /nfs/dbraw/zinc/76/23/72/1368762372.db2.gz WYACJILUBJMRMG-IBGZPJMESA-N 1 3 334.508 2.915 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@]1(C)CCC[N@H+](CCCC(C)C)C1 ZINC001407317258 1368762377 /nfs/dbraw/zinc/76/23/77/1368762377.db2.gz WYACJILUBJMRMG-IBGZPJMESA-N 1 3 334.508 2.915 10 0 EFAEHO CCCC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001407336624 1368789431 /nfs/dbraw/zinc/78/94/31/1368789431.db2.gz VAWRRMSZUWZHMZ-OAHLLOKOSA-N 1 3 347.494 2.838 10 0 EFAEHO CCCC[N@H+]1CCC(F)(F)[C@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001407336624 1368789435 /nfs/dbraw/zinc/78/94/35/1368789435.db2.gz VAWRRMSZUWZHMZ-OAHLLOKOSA-N 1 3 347.494 2.838 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C2CC[NH+](CC(C)C)CC2)C1 ZINC001407495962 1368911308 /nfs/dbraw/zinc/91/13/08/1368911308.db2.gz OHKPWHRCWGAJOG-IBGZPJMESA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@@H](c1ccccc1Cl)N1C[C@@H]2CN(C(=O)CC[NH+](C)C)C[C@@H]2C1 ZINC001407573551 1369002623 /nfs/dbraw/zinc/00/26/23/1369002623.db2.gz SRPJCUUISIABFD-HRCADAONSA-N 1 3 349.906 2.743 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@H+](CCCc2cccc(C)c2)C1)N(C)C ZINC001437737799 1387987809 /nfs/dbraw/zinc/98/78/09/1387987809.db2.gz RLFQRAYMELTSOR-WOJBJXKFSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@@H+](CCCc2cccc(C)c2)C1)N(C)C ZINC001437737799 1387987815 /nfs/dbraw/zinc/98/78/15/1387987815.db2.gz RLFQRAYMELTSOR-WOJBJXKFSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+]([C@@H](C)c2cccc(F)c2)C1 ZINC001437741049 1387992752 /nfs/dbraw/zinc/99/27/52/1387992752.db2.gz PHECEVZDHLNOIR-JKSUJKDBSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+]([C@@H](C)c2cccc(F)c2)C1 ZINC001437741049 1387992756 /nfs/dbraw/zinc/99/27/56/1387992756.db2.gz PHECEVZDHLNOIR-JKSUJKDBSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@H+](Cc2ccsc2)CC1)N(C)C ZINC001407843443 1369297492 /nfs/dbraw/zinc/29/74/92/1369297492.db2.gz BHQDOQYAUAKJSV-DLBZAZTESA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@@H+](Cc2ccsc2)CC1)N(C)C ZINC001407843443 1369297501 /nfs/dbraw/zinc/29/75/01/1369297501.db2.gz BHQDOQYAUAKJSV-DLBZAZTESA-N 1 3 337.533 2.805 10 0 EFAEHO CCC1([NH2+]C/C(Cl)=C\Cl)CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001408010240 1369524780 /nfs/dbraw/zinc/52/47/80/1369524780.db2.gz RKEJLRFUCARHBF-YPDDLIOESA-N 1 3 348.318 2.760 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@H+](CCC(C)(C)C)CC1(C)C)N(C)C ZINC001408116190 1369620182 /nfs/dbraw/zinc/62/01/82/1369620182.db2.gz GPCUAKCKSJHAQO-HOTGVXAUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@@H+](CCC(C)(C)C)CC1(C)C)N(C)C ZINC001408116190 1369620189 /nfs/dbraw/zinc/62/01/89/1369620189.db2.gz GPCUAKCKSJHAQO-HOTGVXAUSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CC[N@@H+](CCCC(C)C)CC1(C)C ZINC001408141862 1369643219 /nfs/dbraw/zinc/64/32/19/1369643219.db2.gz KKHXZKHFQSBQHH-QGZVFWFLSA-N 1 3 334.508 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CC[N@H+](CCCC(C)C)CC1(C)C ZINC001408141862 1369643226 /nfs/dbraw/zinc/64/32/26/1369643226.db2.gz KKHXZKHFQSBQHH-QGZVFWFLSA-N 1 3 334.508 2.914 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC001408253828 1369754964 /nfs/dbraw/zinc/75/49/64/1369754964.db2.gz VHHATFCKCVLQHW-INIZCTEOSA-N 1 3 342.487 2.559 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H](C(C)C)N(C)C ZINC001408313836 1369812465 /nfs/dbraw/zinc/81/24/65/1369812465.db2.gz ZVLDJXQSDSBIPI-AQNXPRMDSA-N 1 3 345.531 2.991 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[N@H+](C)CC1CC2(CCC2)C1 ZINC001408333850 1369836610 /nfs/dbraw/zinc/83/66/10/1369836610.db2.gz KXKPEIVIXHPUFR-GOSISDBHSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001408333850 1369836614 /nfs/dbraw/zinc/83/66/14/1369836614.db2.gz KXKPEIVIXHPUFR-GOSISDBHSA-N 1 3 335.536 2.831 10 0 EFAEHO CN(C/C=C/c1ccccc1)C[C@H]1CCCN1C(=O)CC[NH+](C)C ZINC001408352218 1369862578 /nfs/dbraw/zinc/86/25/78/1369862578.db2.gz ZIIRUZXVMHKCSV-BQHJZSHBSA-N 1 3 329.488 2.574 10 0 EFAEHO CCCN(CCNC(=O)C[NH+]1[C@@H](C)CC[C@@H]1C)Cc1ccsc1 ZINC001437769798 1388045606 /nfs/dbraw/zinc/04/56/06/1388045606.db2.gz SXODJSYSESTBMW-HOTGVXAUSA-N 1 3 337.533 2.949 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N(C)C1CCC(C)(C)CC1 ZINC001414694884 1370596351 /nfs/dbraw/zinc/59/63/51/1370596351.db2.gz DRJHGOWWVJBPBZ-INIZCTEOSA-N 1 3 340.556 2.869 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N(C)C1CCC(C)(C)CC1 ZINC001414694884 1370596357 /nfs/dbraw/zinc/59/63/57/1370596357.db2.gz DRJHGOWWVJBPBZ-INIZCTEOSA-N 1 3 340.556 2.869 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+][C@H](C)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001437850638 1388140858 /nfs/dbraw/zinc/14/08/58/1388140858.db2.gz DHEJATFXJWMDRS-QZTJIDSGSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]([NH2+]CC1CCCC1)c1ccccc1 ZINC001437871728 1388159128 /nfs/dbraw/zinc/15/91/28/1388159128.db2.gz LRWAJGYJAADRCC-LJQANCHMSA-N 1 3 340.471 2.898 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1C[C@H]2CC[C@@H](C1)[N@H+]2CCC(C)(C)C ZINC001437881279 1388165890 /nfs/dbraw/zinc/16/58/90/1388165890.db2.gz VWSYEUNQMZQDGX-BBWFWOEESA-N 1 3 341.515 2.778 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC(C)(C)C ZINC001437881279 1388165894 /nfs/dbraw/zinc/16/58/94/1388165894.db2.gz VWSYEUNQMZQDGX-BBWFWOEESA-N 1 3 341.515 2.778 10 0 EFAEHO CCC[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(=O)NCCN1CCCC1 ZINC001417601341 1373081450 /nfs/dbraw/zinc/08/14/50/1373081450.db2.gz JVKAMMQSCDAOGY-WOJBJXKFSA-N 1 3 343.515 2.747 10 0 EFAEHO CCC[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)NCCN1CCCC1 ZINC001417601341 1373081453 /nfs/dbraw/zinc/08/14/53/1373081453.db2.gz JVKAMMQSCDAOGY-WOJBJXKFSA-N 1 3 343.515 2.747 10 0 EFAEHO Cc1cccc(CN(CCN(C)C)C(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)c1 ZINC001417633015 1373109481 /nfs/dbraw/zinc/10/94/81/1373109481.db2.gz VOGLAROUIBWPST-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN(CCN(C)C)C(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)c1 ZINC001417633015 1373109488 /nfs/dbraw/zinc/10/94/88/1373109488.db2.gz VOGLAROUIBWPST-PMACEKPBSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN(CCN(C)C)C(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)c1 ZINC001417633018 1373109593 /nfs/dbraw/zinc/10/95/93/1373109593.db2.gz VOGLAROUIBWPST-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN(CCN(C)C)C(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)c1 ZINC001417633018 1373109598 /nfs/dbraw/zinc/10/95/98/1373109598.db2.gz VOGLAROUIBWPST-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CC(C)(C)C2)C1 ZINC001417777846 1373243848 /nfs/dbraw/zinc/24/38/48/1373243848.db2.gz MPELTXOXXJICMX-OMPZMXGASA-N 1 3 335.536 2.780 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN3[C@@H](C)CC[C@@H]3C)C2)cs1 ZINC001417778940 1373246037 /nfs/dbraw/zinc/24/60/37/1373246037.db2.gz XSTGOUXVAWGDBZ-ILXVDBEPSA-N 1 3 349.544 2.914 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+][C@H]2CCc3c2cccc3F)C1 ZINC001417799942 1373267505 /nfs/dbraw/zinc/26/75/05/1373267505.db2.gz ANPFANPVFRKPNA-DOXZYTNZSA-N 1 3 347.478 2.638 10 0 EFAEHO CCc1cccc(C[NH2+][C@H]2C[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001417799940 1373268085 /nfs/dbraw/zinc/26/80/85/1373268085.db2.gz AMFFHVLQUNDDEP-WGSAOQKQSA-N 1 3 331.504 2.574 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CC1CCCC1 ZINC001417822939 1373298216 /nfs/dbraw/zinc/29/82/16/1373298216.db2.gz OKLHWNBYYCXFOC-HAGHYFMRSA-N 1 3 347.547 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CC1CCCC1 ZINC001417822939 1373298220 /nfs/dbraw/zinc/29/82/20/1373298220.db2.gz OKLHWNBYYCXFOC-HAGHYFMRSA-N 1 3 347.547 2.687 10 0 EFAEHO CC[C@H](F)C[NH2+][C@@H]1CCCCCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001417846751 1373330217 /nfs/dbraw/zinc/33/02/17/1373330217.db2.gz OQRADPYRBWSHHD-JKSUJKDBSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2cccnc2)CC(C)(C)C1 ZINC001417863856 1373358011 /nfs/dbraw/zinc/35/80/11/1373358011.db2.gz XBYYTYFLWYONET-SFHVURJKSA-N 1 3 346.519 2.530 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2cccnc2)CC(C)(C)C1 ZINC001417863856 1373358014 /nfs/dbraw/zinc/35/80/14/1373358014.db2.gz XBYYTYFLWYONET-SFHVURJKSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C1CC[NH+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001417896175 1373384358 /nfs/dbraw/zinc/38/43/58/1373384358.db2.gz AESHXWKTBYAWIO-SFHVURJKSA-N 1 3 337.552 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC[NH+](CC2CC3(CCC3)C2)CC1 ZINC001417900213 1373389777 /nfs/dbraw/zinc/38/97/77/1373389777.db2.gz GAUSKMRLYOMBPM-UHFFFAOYSA-N 1 3 335.536 2.830 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC12CC[NH+](Cc1ccsc1)CC2 ZINC001417954679 1373447565 /nfs/dbraw/zinc/44/75/65/1373447565.db2.gz LZLKEGLYBQSOCT-INIZCTEOSA-N 1 3 335.517 2.561 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@@H]1CCCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001418020966 1373533205 /nfs/dbraw/zinc/53/32/05/1373533205.db2.gz MFJNRYOSKDHURG-MOPGFXCFSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@@H]1CCCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001418020966 1373533209 /nfs/dbraw/zinc/53/32/09/1373533209.db2.gz MFJNRYOSKDHURG-MOPGFXCFSA-N 1 3 337.552 2.935 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]2C[N@H+](CC3CC3)CC[C@H]21)CC(C)(C)C ZINC001418080521 1373585911 /nfs/dbraw/zinc/58/59/11/1373585911.db2.gz CPUFIIRPWMBUEF-QZTJIDSGSA-N 1 3 335.536 2.687 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]2C[N@@H+](CC3CC3)CC[C@H]21)CC(C)(C)C ZINC001418080521 1373585916 /nfs/dbraw/zinc/58/59/16/1373585916.db2.gz CPUFIIRPWMBUEF-QZTJIDSGSA-N 1 3 335.536 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]21 ZINC001418082801 1373591009 /nfs/dbraw/zinc/59/10/09/1373591009.db2.gz PNCJTXVHAVVXBQ-PMACEKPBSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]21 ZINC001418082801 1373591011 /nfs/dbraw/zinc/59/10/11/1373591011.db2.gz PNCJTXVHAVVXBQ-PMACEKPBSA-N 1 3 343.515 2.841 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](Cc2c(C)cccc2C)C1)N(C)C ZINC001418128170 1373646669 /nfs/dbraw/zinc/64/66/69/1373646669.db2.gz SPLCGCUQBHNTSV-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](Cc2c(C)cccc2C)C1)N(C)C ZINC001418128170 1373646673 /nfs/dbraw/zinc/64/66/73/1373646673.db2.gz SPLCGCUQBHNTSV-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)NC[C@H]1CCCN(Cc2ccsc2)C1 ZINC001418140677 1373667497 /nfs/dbraw/zinc/66/74/97/1373667497.db2.gz USMMLJCKQOYXRU-QGZVFWFLSA-N 1 3 349.544 2.952 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC1CCC([NH2+]C/C=C/Cl)CC1 ZINC001418188075 1373752078 /nfs/dbraw/zinc/75/20/78/1373752078.db2.gz UNWJZNMIVGEANK-WJZHIMPJSA-N 1 3 327.900 2.630 10 0 EFAEHO CC(C)c1ccc(C[NH2+][C@@H](C)CNC(=O)[C@@H](C(C)C)N(C)C)cc1 ZINC001418266993 1373835190 /nfs/dbraw/zinc/83/51/90/1373835190.db2.gz DFOSPARWGRZCIJ-QFBILLFUSA-N 1 3 333.520 2.991 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC[C@@H](C)NCc2cc(C)ccc2F)C1 ZINC001418275743 1373847049 /nfs/dbraw/zinc/84/70/49/1373847049.db2.gz YOUMJTSNMTYPKB-IAGOWNOFSA-N 1 3 349.494 2.850 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC[C@@H](C)NCc2cc(C)ccc2F)C1 ZINC001418275743 1373847058 /nfs/dbraw/zinc/84/70/58/1373847058.db2.gz YOUMJTSNMTYPKB-IAGOWNOFSA-N 1 3 349.494 2.850 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H](C)[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001418301282 1373878717 /nfs/dbraw/zinc/87/87/17/1373878717.db2.gz WCVIKXSHFYPADD-CXAGYDPISA-N 1 3 337.895 2.763 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](C[NH2+]CC2CC(C)(C)C2)C1)CC(C)(C)C ZINC001418357264 1373929532 /nfs/dbraw/zinc/92/95/32/1373929532.db2.gz MVAZUDBKMLPXHD-INIZCTEOSA-N 1 3 337.552 2.839 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCC[C@H]([NH2+]Cc2ccsc2)C1)C1CCC1 ZINC001418359426 1373932370 /nfs/dbraw/zinc/93/23/70/1373932370.db2.gz DFEMQCDGIZYZDS-JKSUJKDBSA-N 1 3 335.517 2.749 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H]1CCC[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001418361983 1373934493 /nfs/dbraw/zinc/93/44/93/1373934493.db2.gz SRTUDAIXRPVMKK-RTBURBONSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]C/C=C/c1ccccc1 ZINC001418415923 1373997756 /nfs/dbraw/zinc/99/77/56/1373997756.db2.gz PIRKJBAFZQJGRS-OKMWKSJFSA-N 1 3 329.488 2.526 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@@H]2CCc3c2cccc3F)CC[N@@H+]1C ZINC001418462940 1374053647 /nfs/dbraw/zinc/05/36/47/1374053647.db2.gz XYXHJYVXATXSKA-QXAKKESOSA-N 1 3 347.478 2.591 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@@H]2CCc3c2cccc3F)CC[N@H+]1C ZINC001418462940 1374053651 /nfs/dbraw/zinc/05/36/51/1374053651.db2.gz XYXHJYVXATXSKA-QXAKKESOSA-N 1 3 347.478 2.591 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)cc1 ZINC001418476596 1374068608 /nfs/dbraw/zinc/06/86/08/1374068608.db2.gz QCTWESNLDXXMFO-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)cc1 ZINC001418476596 1374068612 /nfs/dbraw/zinc/06/86/12/1374068612.db2.gz QCTWESNLDXXMFO-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO CN(CCNC(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1)Cc1ccc(CF)cc1 ZINC001418511441 1374113246 /nfs/dbraw/zinc/11/32/46/1374113246.db2.gz SKSBACBSEHDRDQ-RTBURBONSA-N 1 3 349.494 2.825 10 0 EFAEHO CN(CCNC(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1)Cc1ccc(CF)cc1 ZINC001418511440 1374114024 /nfs/dbraw/zinc/11/40/24/1374114024.db2.gz SKSBACBSEHDRDQ-RBUKOAKNSA-N 1 3 349.494 2.825 10 0 EFAEHO CCN(CCNC(=O)[C@H](C(C)C)[NH+]1CCCC1)Cc1cccc(F)c1 ZINC001418585473 1374227727 /nfs/dbraw/zinc/22/77/27/1374227727.db2.gz GTTJADUSQJWSNQ-IBGZPJMESA-N 1 3 349.494 2.884 10 0 EFAEHO CN(C[C@@H]1CCN1C[C@@H]1CCCC(F)(F)C1)C(=O)CCC[NH+](C)C ZINC001418586920 1374230051 /nfs/dbraw/zinc/23/00/51/1374230051.db2.gz GMBQODSYNYEGDL-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@H]1CCN1CCC1CC1)[NH+]1CCCCC1 ZINC001418599750 1374250065 /nfs/dbraw/zinc/25/00/65/1374250065.db2.gz IZHLWDXXJBCVLJ-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001418637433 1374305094 /nfs/dbraw/zinc/30/50/94/1374305094.db2.gz XXVFEQRWROBRJK-HZSPNIEDSA-N 1 3 348.318 2.664 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001418637433 1374305102 /nfs/dbraw/zinc/30/51/02/1374305102.db2.gz XXVFEQRWROBRJK-HZSPNIEDSA-N 1 3 348.318 2.664 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@H+](CCCC2CCC2)C1)N1CCCC1 ZINC001418694517 1374377666 /nfs/dbraw/zinc/37/76/66/1374377666.db2.gz YWIUQAUWIVBALE-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@@H+](CCCC2CCC2)C1)N1CCCC1 ZINC001418694517 1374377670 /nfs/dbraw/zinc/37/76/70/1374377670.db2.gz YWIUQAUWIVBALE-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC001418694465 1374378167 /nfs/dbraw/zinc/37/81/67/1374378167.db2.gz VXJSMLKOTNLPDJ-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC001418694465 1374378170 /nfs/dbraw/zinc/37/81/70/1374378170.db2.gz VXJSMLKOTNLPDJ-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC001418695385 1374379041 /nfs/dbraw/zinc/37/90/41/1374379041.db2.gz CQZFBSZIEXTURU-HNAYVOBHSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC001418695385 1374379045 /nfs/dbraw/zinc/37/90/45/1374379045.db2.gz CQZFBSZIEXTURU-HNAYVOBHSA-N 1 3 347.478 2.591 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2C[C@H](CNC(=O)C(C)(C)N3CCCC3)C2)cs1 ZINC001418698059 1374383486 /nfs/dbraw/zinc/38/34/86/1374383486.db2.gz LOICOTJIFLOCTB-JCNLHEQBSA-N 1 3 349.544 2.915 10 0 EFAEHO CCc1ccc(C[N@@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001418700046 1374385471 /nfs/dbraw/zinc/38/54/71/1374385471.db2.gz QKDFGWLWQTZOGY-LJQANCHMSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(C[N@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001418700046 1374385474 /nfs/dbraw/zinc/38/54/74/1374385474.db2.gz QKDFGWLWQTZOGY-LJQANCHMSA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1 ZINC001418701161 1374387291 /nfs/dbraw/zinc/38/72/91/1374387291.db2.gz VIXSJICXHPGFPO-GOSISDBHSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+](CC2CCC3(CC3)CC2)C1 ZINC001418701161 1374387294 /nfs/dbraw/zinc/38/72/94/1374387294.db2.gz VIXSJICXHPGFPO-GOSISDBHSA-N 1 3 335.536 2.735 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001418768089 1374476792 /nfs/dbraw/zinc/47/67/92/1374476792.db2.gz LBXHLTMQAVEHLT-WOJBJXKFSA-N 1 3 341.499 2.784 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001418768089 1374476796 /nfs/dbraw/zinc/47/67/96/1374476796.db2.gz LBXHLTMQAVEHLT-WOJBJXKFSA-N 1 3 341.499 2.784 10 0 EFAEHO CCCC[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001418790577 1374506162 /nfs/dbraw/zinc/50/61/62/1374506162.db2.gz WPUUBJAWHOIUMG-GOSISDBHSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCC[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001418790577 1374506165 /nfs/dbraw/zinc/50/61/65/1374506165.db2.gz WPUUBJAWHOIUMG-GOSISDBHSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@H+](CC2CCC2)CC(C)(C)C1)N(C)C ZINC001418821314 1374542494 /nfs/dbraw/zinc/54/24/94/1374542494.db2.gz ACHRSMAPWAOBLJ-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@@H+](CC2CCC2)CC(C)(C)C1)N(C)C ZINC001418821314 1374542499 /nfs/dbraw/zinc/54/24/99/1374542499.db2.gz ACHRSMAPWAOBLJ-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1CCN(C/C=C/Cl)CC(C)(C)C1 ZINC001418823971 1374544363 /nfs/dbraw/zinc/54/43/63/1374544363.db2.gz HIHRBIIBMZTZST-PPYMECGQSA-N 1 3 329.916 2.688 10 0 EFAEHO C[C@H](NCCN(C)C(=O)C[C@H]1CC[N@H+](C)C1)c1ccccc1Cl ZINC001418825784 1374547717 /nfs/dbraw/zinc/54/77/17/1374547717.db2.gz HHYUCDMHXOABFM-LSDHHAIUSA-N 1 3 337.895 2.791 10 0 EFAEHO C[C@H](NCCN(C)C(=O)C[C@H]1CC[N@@H+](C)C1)c1ccccc1Cl ZINC001418825784 1374547722 /nfs/dbraw/zinc/54/77/22/1374547722.db2.gz HHYUCDMHXOABFM-LSDHHAIUSA-N 1 3 337.895 2.791 10 0 EFAEHO CN(Cc1cccc(F)c1)C[C@@H]1CCCCN1C(=O)CC[NH+](C)C ZINC001418827562 1374549528 /nfs/dbraw/zinc/54/95/28/1374549528.db2.gz QUOFFSRTOXSKLJ-SFHVURJKSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001418832520 1374554665 /nfs/dbraw/zinc/55/46/65/1374554665.db2.gz PZAYGDNYPPIMJK-GOSISDBHSA-N 1 3 335.467 2.591 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@@H](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001418844085 1374566919 /nfs/dbraw/zinc/56/69/19/1374566919.db2.gz JJDOLRUCIFLJDP-CVEARBPZSA-N 1 3 343.531 2.929 10 0 EFAEHO CN(Cc1ccc(Cl)s1)C[C@H]1CCN(C(=O)CC[NH+](C)C)C1 ZINC001418940835 1374710930 /nfs/dbraw/zinc/71/09/30/1374710930.db2.gz POUUXRHTPZNQNV-CYBMUJFWSA-N 1 3 343.924 2.634 10 0 EFAEHO Cc1cccc([C@H](C)N2CC(CNC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001419022532 1374770578 /nfs/dbraw/zinc/77/05/78/1374770578.db2.gz KQZUZCIKGRPKFD-FXAWDEMLSA-N 1 3 343.515 2.978 10 0 EFAEHO Cc1cccc([C@H](C)N2CC(CNC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001419022532 1374770584 /nfs/dbraw/zinc/77/05/84/1374770584.db2.gz KQZUZCIKGRPKFD-FXAWDEMLSA-N 1 3 343.515 2.978 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@@H]1CC[N@H+](CCC2CCCC2)C1 ZINC001419165284 1374913934 /nfs/dbraw/zinc/91/39/34/1374913934.db2.gz YVXLKQOZCDQSPV-PKOBYXMFSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@@H]1CC[N@@H+](CCC2CCCC2)C1 ZINC001419165284 1374913936 /nfs/dbraw/zinc/91/39/36/1374913936.db2.gz YVXLKQOZCDQSPV-PKOBYXMFSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)NCc1ccccc1F ZINC001419193783 1374939755 /nfs/dbraw/zinc/93/97/55/1374939755.db2.gz KWEABIFPRMMFHN-IAGOWNOFSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)NCc1ccccc1F ZINC001419193783 1374939759 /nfs/dbraw/zinc/93/97/59/1374939759.db2.gz KWEABIFPRMMFHN-IAGOWNOFSA-N 1 3 335.467 2.685 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](CC)NCC=C(Cl)Cl ZINC001419201286 1374946744 /nfs/dbraw/zinc/94/67/44/1374946744.db2.gz QFCHOVNZQBUHNM-QWHCGFSZSA-N 1 3 336.307 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](CC)NCC=C(Cl)Cl ZINC001419201286 1374946748 /nfs/dbraw/zinc/94/67/48/1374946748.db2.gz QFCHOVNZQBUHNM-QWHCGFSZSA-N 1 3 336.307 2.664 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cc(C)sc1C ZINC001419238370 1374984154 /nfs/dbraw/zinc/98/41/54/1374984154.db2.gz FDLVBPJBFSXQMX-GUYCJALGSA-N 1 3 337.533 2.691 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]([NH2+]CC2CC3(CCC3)C2)C2CC2)CCC1 ZINC001419255746 1375002946 /nfs/dbraw/zinc/00/29/46/1375002946.db2.gz FPMUBNZYCITFMI-KRWDZBQOSA-N 1 3 333.520 2.535 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@H](NCC=C(Cl)Cl)C1CC1 ZINC001419258834 1375004726 /nfs/dbraw/zinc/00/47/26/1375004726.db2.gz BCLGCPKDSNOYLH-KBPBESRZSA-N 1 3 348.318 2.664 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@H](NCC=C(Cl)Cl)C1CC1 ZINC001419258834 1375004730 /nfs/dbraw/zinc/00/47/30/1375004730.db2.gz BCLGCPKDSNOYLH-KBPBESRZSA-N 1 3 348.318 2.664 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]([NH2+]CCC2CCCCC2)C2CC2)C1 ZINC001419300477 1375061611 /nfs/dbraw/zinc/06/16/11/1375061611.db2.gz RTRAPRJJPBLPPF-VQIMIIECSA-N 1 3 335.536 2.783 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C[NH2+]C[C@H]2CCC(F)(F)C2)CCCC1 ZINC001419319828 1375094953 /nfs/dbraw/zinc/09/49/53/1375094953.db2.gz MIRJWDKBAQZDDQ-HNNXBMFYSA-N 1 3 345.478 2.781 10 0 EFAEHO CC[C@H](F)CN(C)C[C@@H]1CCCN(C(=O)C23CCC[NH+]2CCC3)C1 ZINC001419342663 1375133679 /nfs/dbraw/zinc/13/36/79/1375133679.db2.gz KTOCEIZZLHAYRA-IRXDYDNUSA-N 1 3 339.499 2.533 10 0 EFAEHO CC(C)[NH2+]CC[C@@H]1CCCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001419374039 1375186287 /nfs/dbraw/zinc/18/62/87/1375186287.db2.gz MCLMISYLFPRVTA-QFBILLFUSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC001419432506 1375265489 /nfs/dbraw/zinc/26/54/89/1375265489.db2.gz PWBCUBJUXURSSA-WKILWMFISA-N 1 3 339.430 2.701 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccccc32)C1 ZINC001419519811 1375379423 /nfs/dbraw/zinc/37/94/23/1375379423.db2.gz PGECYDYKPRFECM-ZIFCJYIRSA-N 1 3 329.488 2.641 10 0 EFAEHO C[C@H](c1cccc(F)c1)N1CCC[C@@H](CNC(=O)CC[NH+](C)C)C1 ZINC001419555754 1375445107 /nfs/dbraw/zinc/44/51/07/1375445107.db2.gz MKGRXLUQDCLKTK-CVEARBPZSA-N 1 3 335.467 2.667 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001419555960 1375445578 /nfs/dbraw/zinc/44/55/78/1375445578.db2.gz LAXORZLVUWQVOJ-VQTJNVASSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001419555960 1375445587 /nfs/dbraw/zinc/44/55/87/1375445587.db2.gz LAXORZLVUWQVOJ-VQTJNVASSA-N 1 3 345.531 2.972 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NCC2(NCC=C(Cl)Cl)CCCC2)C1 ZINC001419620318 1375558562 /nfs/dbraw/zinc/55/85/62/1375558562.db2.gz HTAJYVSBKPUZDM-ZDUSSCGKSA-N 1 3 348.318 2.666 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001419674685 1375687777 /nfs/dbraw/zinc/68/77/77/1375687777.db2.gz RDLCKVLYTYCFAI-FUHWJXTLSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001419674685 1375687779 /nfs/dbraw/zinc/68/77/79/1375687779.db2.gz RDLCKVLYTYCFAI-FUHWJXTLSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(Cl)cc1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001419722214 1375770092 /nfs/dbraw/zinc/77/00/92/1375770092.db2.gz PYNUNQFXHCPNRY-LSDHHAIUSA-N 1 3 337.895 2.618 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2C[C@@H]3C[C@H]2CN3CCC2CCCCC2)CC1 ZINC001438175657 1388401464 /nfs/dbraw/zinc/40/14/64/1388401464.db2.gz VTWRSKMCSUMVDT-ROUUACIJSA-N 1 3 333.520 2.584 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]Cc1cccc(Cl)c1 ZINC001419762204 1375831983 /nfs/dbraw/zinc/83/19/83/1375831983.db2.gz IWPBUBXBCLKNFT-AWEZNQCLSA-N 1 3 325.884 2.617 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(F)cc1C ZINC001419762223 1375832312 /nfs/dbraw/zinc/83/23/12/1375832312.db2.gz IWTLJKWUQZGCGU-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]Cc1cccc(C(F)(F)F)c1)N(C)C ZINC001419775217 1375856460 /nfs/dbraw/zinc/85/64/60/1375856460.db2.gz OWCWFDZZKGZPHW-IUODEOHRSA-N 1 3 345.409 2.640 10 0 EFAEHO CC(C)(C(=O)N[C@H](C[NH2+]CC1CC1)C1CCCCC1)N1CCCC1 ZINC001419809952 1375919644 /nfs/dbraw/zinc/91/96/44/1375919644.db2.gz ZLMUOTSWFXMBHO-GOSISDBHSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001419817450 1375930903 /nfs/dbraw/zinc/93/09/03/1375930903.db2.gz HXUXQFVOIMURAT-UYAOXDASSA-N 1 3 345.531 2.970 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001419817444 1375931053 /nfs/dbraw/zinc/93/10/53/1375931053.db2.gz HXUXQFVOIMURAT-ICSRJNTNSA-N 1 3 345.531 2.970 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001419817446 1375931334 /nfs/dbraw/zinc/93/13/34/1375931334.db2.gz HXUXQFVOIMURAT-QUCCMNQESA-N 1 3 345.531 2.970 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001419831675 1375951651 /nfs/dbraw/zinc/95/16/51/1375951651.db2.gz VUCUJXFYFAVHAW-YLJYHZDGSA-N 1 3 345.531 2.916 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001419831653 1375952164 /nfs/dbraw/zinc/95/21/64/1375952164.db2.gz VUCUJXFYFAVHAW-FXAWDEMLSA-N 1 3 345.531 2.916 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)CCC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001419840317 1375971005 /nfs/dbraw/zinc/97/10/05/1375971005.db2.gz OQBFMTCKQVALJZ-QZTJIDSGSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)CCC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001419840317 1375971009 /nfs/dbraw/zinc/97/10/09/1375971009.db2.gz OQBFMTCKQVALJZ-QZTJIDSGSA-N 1 3 343.531 2.881 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]Cc1cccnc1 ZINC001419899403 1376096893 /nfs/dbraw/zinc/09/68/93/1376096893.db2.gz FIXRAYHIGPZWDK-MJGOQNOKSA-N 1 3 346.519 2.577 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]C/C=C\Cl ZINC001419906821 1376107568 /nfs/dbraw/zinc/10/75/68/1376107568.db2.gz MSPJJRBWJRSGDL-ALLYREJPSA-N 1 3 329.916 2.734 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(F)c(F)c1 ZINC001419940111 1376162866 /nfs/dbraw/zinc/16/28/66/1376162866.db2.gz XMQLKEPMZFSYEP-QGZVFWFLSA-N 1 3 341.446 2.535 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H](C)c1ccccc1F ZINC001419940117 1376162939 /nfs/dbraw/zinc/16/29/39/1376162939.db2.gz XOVNABCKJXYHFI-CRAIPNDOSA-N 1 3 337.483 2.957 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H](C)c1ccccc1F ZINC001419940131 1376163028 /nfs/dbraw/zinc/16/30/28/1376163028.db2.gz XOVNABCKJXYHFI-QAPCUYQASA-N 1 3 337.483 2.957 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21)Cc1ccccc1 ZINC001419989717 1376243554 /nfs/dbraw/zinc/24/35/54/1376243554.db2.gz KYRPVXXYXHXZBL-RTBURBONSA-N 1 3 329.488 2.594 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CC[C@H]2CCCC[N@H+]21)Cc1ccccc1 ZINC001419989717 1376243563 /nfs/dbraw/zinc/24/35/63/1376243563.db2.gz KYRPVXXYXHXZBL-RTBURBONSA-N 1 3 329.488 2.594 10 0 EFAEHO CN(CC[N@H+](C)Cc1ccc(C2CCC2)cc1)C(=O)[C@H]1CCCN1C ZINC001419996959 1376254698 /nfs/dbraw/zinc/25/46/98/1376254698.db2.gz LSYJNNJWLRQQFI-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO CN(CC[N@@H+](C)Cc1ccc(C2CCC2)cc1)C(=O)[C@H]1CCCN1C ZINC001419996959 1376254704 /nfs/dbraw/zinc/25/47/04/1376254704.db2.gz LSYJNNJWLRQQFI-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]Cc2cc3ccccc3o2)C1 ZINC001420005971 1376268423 /nfs/dbraw/zinc/26/84/23/1376268423.db2.gz AMLKQMZSKVFNOD-MRXNPFEDSA-N 1 3 343.471 2.711 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@@H]([NH2+]Cc3ccsc3)C2)CCC1 ZINC001420022594 1376303571 /nfs/dbraw/zinc/30/35/71/1376303571.db2.gz DZDCVXKHSIKSHN-CVEARBPZSA-N 1 3 335.517 2.749 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](C)CCNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001420125012 1376480798 /nfs/dbraw/zinc/48/07/98/1376480798.db2.gz MMDWEFSETIKRBH-CRAIPNDOSA-N 1 3 337.483 2.705 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC001420235700 1376593624 /nfs/dbraw/zinc/59/36/24/1376593624.db2.gz CLODSQIJEMIRCQ-KBPBESRZSA-N 1 3 341.446 2.850 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CNCc2ccccc2Cl)CC[N@@H+]1C ZINC001420288248 1376671444 /nfs/dbraw/zinc/67/14/44/1376671444.db2.gz ALURFLSOUCHHHT-UKPHBRMFSA-N 1 3 337.895 2.665 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CNCc2ccccc2Cl)CC[N@H+]1C ZINC001420288248 1376671449 /nfs/dbraw/zinc/67/14/49/1376671449.db2.gz ALURFLSOUCHHHT-UKPHBRMFSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)c1ccc(CN(C)CCNC(=O)C[C@H]2CC[N@H+](C)C2)cc1 ZINC001420332684 1376747707 /nfs/dbraw/zinc/74/77/07/1376747707.db2.gz FGYIYXFVTNLFSW-GOSISDBHSA-N 1 3 331.504 2.700 10 0 EFAEHO CC(C)c1ccc(CN(C)CCNC(=O)C[C@H]2CC[N@@H+](C)C2)cc1 ZINC001420332684 1376747712 /nfs/dbraw/zinc/74/77/12/1376747712.db2.gz FGYIYXFVTNLFSW-GOSISDBHSA-N 1 3 331.504 2.700 10 0 EFAEHO CN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)Cc1ccc(C(F)F)cc1 ZINC001420336008 1376754878 /nfs/dbraw/zinc/75/48/78/1376754878.db2.gz YKLFSYBDNRUPQI-HNNXBMFYSA-N 1 3 339.430 2.514 10 0 EFAEHO CN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)Cc1ccc(C(F)F)cc1 ZINC001420336008 1376754885 /nfs/dbraw/zinc/75/48/85/1376754885.db2.gz YKLFSYBDNRUPQI-HNNXBMFYSA-N 1 3 339.430 2.514 10 0 EFAEHO CCN(CCNC(=O)C12CCC[NH+](CCC1)C2)Cc1ccc(F)cc1 ZINC001420392709 1376870563 /nfs/dbraw/zinc/87/05/63/1376870563.db2.gz BNVVJOVEPDEHPF-UHFFFAOYSA-N 1 3 347.478 2.640 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21)Cc1cccc(C)c1 ZINC001420394893 1376874452 /nfs/dbraw/zinc/87/44/52/1376874452.db2.gz GOSOJWWVHCGZDD-WOJBJXKFSA-N 1 3 343.515 2.950 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[C@H]2CCCC[N@H+]21)Cc1cccc(C)c1 ZINC001420394893 1376874458 /nfs/dbraw/zinc/87/44/58/1376874458.db2.gz GOSOJWWVHCGZDD-WOJBJXKFSA-N 1 3 343.515 2.950 10 0 EFAEHO C[C@@H](C[NH2+]CC1CCC(F)(F)CC1)NC(=O)C(C)(C)N1CCCC1 ZINC001420460452 1377015940 /nfs/dbraw/zinc/01/59/40/1377015940.db2.gz UHTJMACTNCNIIX-AWEZNQCLSA-N 1 3 345.478 2.781 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1cccc(Cl)c1 ZINC001420521329 1377125123 /nfs/dbraw/zinc/12/51/23/1377125123.db2.gz ZRRMGORDLHNKJS-WMLDXEAASA-N 1 3 337.895 2.809 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@H+](CCC(C)(C)C)C1)CC(C)(C)C ZINC001420553316 1377180657 /nfs/dbraw/zinc/18/06/57/1377180657.db2.gz WHEMTQKAHYFVPT-INIZCTEOSA-N 1 3 325.541 2.839 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@@H+](CCC(C)(C)C)C1)CC(C)(C)C ZINC001420553316 1377180658 /nfs/dbraw/zinc/18/06/58/1377180658.db2.gz WHEMTQKAHYFVPT-INIZCTEOSA-N 1 3 325.541 2.839 10 0 EFAEHO Cc1ccc(C)c(C[N@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001420561084 1377202289 /nfs/dbraw/zinc/20/22/89/1377202289.db2.gz VGIFTDKLJAZTPD-GOSISDBHSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001420561084 1377202296 /nfs/dbraw/zinc/20/22/96/1377202296.db2.gz VGIFTDKLJAZTPD-GOSISDBHSA-N 1 3 331.504 2.582 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@H+](CC2CCC(F)(F)CC2)C1)N(C)C ZINC001420571758 1377224942 /nfs/dbraw/zinc/22/49/42/1377224942.db2.gz ZJKMKSYBJIUDEE-HZPDHXFCSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[N@@H+](CC2CCC(F)(F)CC2)C1)N(C)C ZINC001420571758 1377224944 /nfs/dbraw/zinc/22/49/44/1377224944.db2.gz ZJKMKSYBJIUDEE-HZPDHXFCSA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001420574682 1377230527 /nfs/dbraw/zinc/23/05/27/1377230527.db2.gz FDMWCUZYWBLWBF-RDTXWAMCSA-N 1 3 349.906 2.618 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1 ZINC001420582235 1377246085 /nfs/dbraw/zinc/24/60/85/1377246085.db2.gz MSIHWBQSOXDWAE-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1 ZINC001420582235 1377246089 /nfs/dbraw/zinc/24/60/89/1377246089.db2.gz MSIHWBQSOXDWAE-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1 ZINC001420582237 1377247250 /nfs/dbraw/zinc/24/72/50/1377247250.db2.gz MSIHWBQSOXDWAE-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1 ZINC001420582237 1377247252 /nfs/dbraw/zinc/24/72/52/1377247252.db2.gz MSIHWBQSOXDWAE-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1[C@H](C)CC[C@H]1C)CC1CC(F)(F)C1 ZINC001420622152 1377349123 /nfs/dbraw/zinc/34/91/23/1377349123.db2.gz GNSNABPATIZAIC-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1[C@H](C)CC[C@H]1C)CC1CC(F)(F)C1 ZINC001420622152 1377349119 /nfs/dbraw/zinc/34/91/19/1377349119.db2.gz GNSNABPATIZAIC-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[NH+](CC)CC[C@@H](NC(=O)CN1CC[C@@H](C)C1)c1ccccc1 ZINC001420662361 1377447452 /nfs/dbraw/zinc/44/74/52/1377447452.db2.gz MWHIFLJMYYOOSP-IEBWSBKVSA-N 1 3 331.504 2.918 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@H+](Cc2ccsc2)C1)N1CCCCC1 ZINC001420676212 1377484373 /nfs/dbraw/zinc/48/43/73/1377484373.db2.gz TZJGBIPJWUGCLR-INIZCTEOSA-N 1 3 349.544 2.951 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@@H+](Cc2ccsc2)C1)N1CCCCC1 ZINC001420676212 1377484375 /nfs/dbraw/zinc/48/43/75/1377484375.db2.gz TZJGBIPJWUGCLR-INIZCTEOSA-N 1 3 349.544 2.951 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]Cc1ccsc1)C1CC1 ZINC001420740794 1377588265 /nfs/dbraw/zinc/58/82/65/1377588265.db2.gz OOMLXLLRZSDYHT-DLBZAZTESA-N 1 3 335.517 2.605 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C[NH2+]Cc1cccc(C)c1)C1CC1 ZINC001420746300 1377593556 /nfs/dbraw/zinc/59/35/56/1377593556.db2.gz YCQMTMVKFARAHF-PMACEKPBSA-N 1 3 343.515 2.854 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001420766547 1377624875 /nfs/dbraw/zinc/62/48/75/1377624875.db2.gz ARJPOJQVHZTJHN-RBUKOAKNSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[NH2+][C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)c1ccccc1 ZINC001420776404 1377646194 /nfs/dbraw/zinc/64/61/94/1377646194.db2.gz NKJDVXHNEHHGDI-LPHOPBHVSA-N 1 3 335.467 2.666 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]Cc1ccc(Cl)cc1)C1CC1 ZINC001420798880 1377686175 /nfs/dbraw/zinc/68/61/75/1377686175.db2.gz OSZUUNZXBGWBBJ-KRWDZBQOSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001420940291 1377912856 /nfs/dbraw/zinc/91/28/56/1377912856.db2.gz LYVUQANAJRHKHD-IBGZPJMESA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001420940291 1377912865 /nfs/dbraw/zinc/91/28/65/1377912865.db2.gz LYVUQANAJRHKHD-IBGZPJMESA-N 1 3 337.552 2.935 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NCC1([NH2+][C@@H]2CCc3ccccc32)CC1 ZINC001420955415 1377935746 /nfs/dbraw/zinc/93/57/46/1377935746.db2.gz SCXNRXSPELWATB-ZWKOTPCHSA-N 1 3 347.478 2.592 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+][C@@H]2CCc3c2cccc3Cl)CC1)N(C)C ZINC001420958047 1377940038 /nfs/dbraw/zinc/94/00/38/1377940038.db2.gz ZTYHBRMPRMGBQK-IAGOWNOFSA-N 1 3 349.906 2.906 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]CC2CC3(CCC3)C2)CC1)N1CCCC1 ZINC001420968251 1377954066 /nfs/dbraw/zinc/95/40/66/1377954066.db2.gz GQTSJRIPGQSXRR-UHFFFAOYSA-N 1 3 333.520 2.680 10 0 EFAEHO CCc1ccc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@H]3C)CC2)cc1 ZINC001421004211 1378007535 /nfs/dbraw/zinc/00/75/35/1378007535.db2.gz IPQPPPNNIJHURA-IAGOWNOFSA-N 1 3 343.515 2.860 10 0 EFAEHO CC[C@H](C(=O)N1CCC([N@H+](C[C@@H](F)CC)CC2CC2)CC1)N(C)C ZINC001421018148 1378028238 /nfs/dbraw/zinc/02/82/38/1378028238.db2.gz KEVDEXJUUQSJBO-FUHWJXTLSA-N 1 3 341.515 2.778 10 0 EFAEHO CC[C@H](C(=O)N1CCC([N@@H+](C[C@@H](F)CC)CC2CC2)CC1)N(C)C ZINC001421018148 1378028241 /nfs/dbraw/zinc/02/82/41/1378028241.db2.gz KEVDEXJUUQSJBO-FUHWJXTLSA-N 1 3 341.515 2.778 10 0 EFAEHO C[NH+](C)CCCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCCC1CCC1 ZINC001421021724 1378034949 /nfs/dbraw/zinc/03/49/49/1378034949.db2.gz KQFLSIRQYGDMSS-KDURUIRLSA-N 1 3 335.536 2.974 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001421134582 1378164737 /nfs/dbraw/zinc/16/47/37/1378164737.db2.gz BNDUFGVEXVSHBF-KRWDZBQOSA-N 1 3 335.467 2.555 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@@H]2CCCN2C(=O)CN(C)C(C)C)cc1 ZINC001421135779 1378166323 /nfs/dbraw/zinc/16/63/23/1378166323.db2.gz GDCLPHAWHYYZAB-IBGZPJMESA-N 1 3 331.504 2.670 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH+]2CC(CNC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001421148246 1378186477 /nfs/dbraw/zinc/18/64/77/1378186477.db2.gz MTVAXJBJGPPDMN-QGZVFWFLSA-N 1 3 343.515 2.897 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1C[NH+](CCCc2ccccc2)C1 ZINC001421202598 1378268815 /nfs/dbraw/zinc/26/88/15/1378268815.db2.gz PNNHDFGVTSXHRN-QZTJIDSGSA-N 1 3 343.515 2.540 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2ccc(C)cc2C)C1)N(C)C ZINC001421250385 1378347635 /nfs/dbraw/zinc/34/76/35/1378347635.db2.gz GHIGTOHVGBQCCR-CTNGQTDRSA-N 1 3 345.531 2.972 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@]1(C)CCCN(C/C=C\c2ccccc2)C1 ZINC001421283475 1378423261 /nfs/dbraw/zinc/42/32/61/1378423261.db2.gz JHLOODRVZLEQPM-OQFUBPRESA-N 1 3 343.515 2.870 10 0 EFAEHO C[C@H](C(=O)NC[C@]1(C)CCC[N@H+](CC2CC2)C1)N1CCCCCC1 ZINC001421294879 1378448613 /nfs/dbraw/zinc/44/86/13/1378448613.db2.gz KATFFFJDZSGCHW-XLIONFOSSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H](C(=O)NC[C@]1(C)CCC[N@@H+](CC2CC2)C1)N1CCCCCC1 ZINC001421294879 1378448615 /nfs/dbraw/zinc/44/86/15/1378448615.db2.gz KATFFFJDZSGCHW-XLIONFOSSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1C[N@H+](CCCC(C)C)CCC1(F)F)N(C)C ZINC001421332544 1378508625 /nfs/dbraw/zinc/50/86/25/1378508625.db2.gz HMRXJQYRNBFUSY-HZPDHXFCSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1C[N@@H+](CCCC(C)C)CCC1(F)F)N(C)C ZINC001421332544 1378508628 /nfs/dbraw/zinc/50/86/28/1378508628.db2.gz HMRXJQYRNBFUSY-HZPDHXFCSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cc(C)cc(C)c1 ZINC001421455119 1378640095 /nfs/dbraw/zinc/64/00/95/1378640095.db2.gz ZETFQHKQFREIKI-HNAYVOBHSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1cc2ccccc2o1 ZINC001421493861 1378691588 /nfs/dbraw/zinc/69/15/88/1378691588.db2.gz FIXPEKLLHVIXMA-INIZCTEOSA-N 1 3 331.460 2.757 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(CCF)C2 ZINC001421512187 1378721640 /nfs/dbraw/zinc/72/16/40/1378721640.db2.gz IWIPXFHVUXZELZ-UXLLHSPISA-N 1 3 339.499 2.578 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(CCF)C2 ZINC001421512187 1378721644 /nfs/dbraw/zinc/72/16/44/1378721644.db2.gz IWIPXFHVUXZELZ-UXLLHSPISA-N 1 3 339.499 2.578 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccc(C)cc1)C2 ZINC001421519603 1378736179 /nfs/dbraw/zinc/73/61/79/1378736179.db2.gz ZCAPHRXVYIOSCA-UFYCRDLUSA-N 1 3 343.515 2.806 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccc(C)cc1)C2 ZINC001421519603 1378736183 /nfs/dbraw/zinc/73/61/83/1378736183.db2.gz ZCAPHRXVYIOSCA-UFYCRDLUSA-N 1 3 343.515 2.806 10 0 EFAEHO CCCN(C)CC(=O)NC1(C[NH2+]Cc2ccc(C)nc2C)CCCC1 ZINC001421538006 1378775047 /nfs/dbraw/zinc/77/50/47/1378775047.db2.gz VCXDIHZUEGCNLX-UHFFFAOYSA-N 1 3 346.519 2.559 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](C)[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001421542381 1378783466 /nfs/dbraw/zinc/78/34/66/1378783466.db2.gz MILIBVYSBPPZPY-XLIONFOSSA-N 1 3 345.531 2.916 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001421547368 1378790972 /nfs/dbraw/zinc/79/09/72/1378790972.db2.gz RXGGKQRASMCXIF-AEFFLSMTSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@@](C)(C[NH2+]Cc2cccc(F)c2)C2CC2)C1 ZINC001421550637 1378795415 /nfs/dbraw/zinc/79/54/15/1378795415.db2.gz JCOLSFAWFXMKMA-QRWLVFNGSA-N 1 3 347.478 2.542 10 0 EFAEHO CC(C)CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C2 ZINC001421563148 1378816562 /nfs/dbraw/zinc/81/65/62/1378816562.db2.gz FUESORKRKHZNMY-RDGPPVDQSA-N 1 3 337.552 2.978 10 0 EFAEHO CC(C)CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C2 ZINC001421563148 1378816569 /nfs/dbraw/zinc/81/65/69/1378816569.db2.gz FUESORKRKHZNMY-RDGPPVDQSA-N 1 3 337.552 2.978 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001421563813 1378817866 /nfs/dbraw/zinc/81/78/66/1378817866.db2.gz UTGYIUPKCZDHKL-PKOBYXMFSA-N 1 3 331.504 2.519 10 0 EFAEHO Cc1cc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)CCC[NH+](C)C)cs1 ZINC001421629026 1378907587 /nfs/dbraw/zinc/90/75/87/1378907587.db2.gz CQSIUUBMGJWNSE-QZTJIDSGSA-N 1 3 349.544 2.964 10 0 EFAEHO CC(C)C[N@H+](C)Cc1ccccc1CNC(=O)[C@H](C(C)C)N(C)C ZINC001421654229 1378954110 /nfs/dbraw/zinc/95/41/10/1378954110.db2.gz IXGCJFKIJKVXPG-IBGZPJMESA-N 1 3 333.520 2.977 10 0 EFAEHO CC(C)C[N@@H+](C)Cc1ccccc1CNC(=O)[C@H](C(C)C)N(C)C ZINC001421654229 1378954113 /nfs/dbraw/zinc/95/41/13/1378954113.db2.gz IXGCJFKIJKVXPG-IBGZPJMESA-N 1 3 333.520 2.977 10 0 EFAEHO C[C@H](NC/C=C/Cl)c1ccc(CNC(=O)C23CC[NH+](CC2)C3)cc1 ZINC001421657363 1378958968 /nfs/dbraw/zinc/95/89/68/1378958968.db2.gz YHHJOZPISQGDPC-OSNGDGKXSA-N 1 3 347.890 2.802 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CC2(C1)CCN(CCC(F)(F)F)CC2 ZINC001421686301 1378992209 /nfs/dbraw/zinc/99/22/09/1378992209.db2.gz TVUWRBOHAPUCGO-UHFFFAOYSA-N 1 3 349.441 2.595 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CC2(C1)CCN(CCC(F)(F)F)CC2 ZINC001421686301 1378992216 /nfs/dbraw/zinc/99/22/16/1378992216.db2.gz TVUWRBOHAPUCGO-UHFFFAOYSA-N 1 3 349.441 2.595 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]Cc1ccccc1F ZINC001421718682 1379032249 /nfs/dbraw/zinc/03/22/49/1379032249.db2.gz JKLGQFSSAMUVJB-OAHLLOKOSA-N 1 3 335.467 2.542 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H](C)CNC(=O)C(C)(C)N2CCCC2)c1 ZINC001421720947 1379034737 /nfs/dbraw/zinc/03/47/37/1379034737.db2.gz QPDKMFWERVANPP-KRWDZBQOSA-N 1 3 345.531 2.965 10 0 EFAEHO CC[C@@H](C)C[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CCC1 ZINC001421768957 1379108404 /nfs/dbraw/zinc/10/84/04/1379108404.db2.gz YGDNIZSMZXLKPC-BEFAXECRSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+]C[C@H]2CCC(F)(F)C2)CCC1)N(C)C ZINC001421779911 1379128771 /nfs/dbraw/zinc/12/87/71/1379128771.db2.gz UOVWZYQVTNGBML-GJZGRUSLSA-N 1 3 345.478 2.637 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+]CC2CC3(CCC3)C2)CCCC1)N(C)C ZINC001421841070 1379220288 /nfs/dbraw/zinc/22/02/88/1379220288.db2.gz CIZVFTPTFQSLII-QGZVFWFLSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1CC[C@H]([NH2+]CC[C@H](C)F)CC1 ZINC001438437352 1388599579 /nfs/dbraw/zinc/59/95/79/1388599579.db2.gz ALNUBIAWOYTBGO-QAETUUGQSA-N 1 3 327.488 2.624 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001421889281 1379306304 /nfs/dbraw/zinc/30/63/04/1379306304.db2.gz MXKRANNZMVWDSG-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001421889281 1379306313 /nfs/dbraw/zinc/30/63/13/1379306313.db2.gz MXKRANNZMVWDSG-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N1Cc2ccccc2C[C@H]1CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001421952320 1379399652 /nfs/dbraw/zinc/39/96/52/1379399652.db2.gz JKLCIVPLXIKWJZ-UXHICEINSA-N 1 3 343.515 2.812 10 0 EFAEHO CC(C)N1Cc2ccccc2C[C@H]1CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001421952320 1379399659 /nfs/dbraw/zinc/39/96/59/1379399659.db2.gz JKLCIVPLXIKWJZ-UXHICEINSA-N 1 3 343.515 2.812 10 0 EFAEHO CC(C)N1Cc2ccccc2C[C@@H]1CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001421952325 1379399935 /nfs/dbraw/zinc/39/99/35/1379399935.db2.gz JKLCIVPLXIKWJZ-WOJBJXKFSA-N 1 3 343.515 2.812 10 0 EFAEHO CC(C)N1Cc2ccccc2C[C@@H]1CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001421952325 1379399945 /nfs/dbraw/zinc/39/99/45/1379399945.db2.gz JKLCIVPLXIKWJZ-WOJBJXKFSA-N 1 3 343.515 2.812 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1cc(F)ccc1C ZINC001421989791 1379445703 /nfs/dbraw/zinc/44/57/03/1379445703.db2.gz UNRHVNZCQPDMMP-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO O=C(CN1CCCC1)NCCC1CC[NH+](Cc2ccccc2F)CC1 ZINC001438451788 1388615632 /nfs/dbraw/zinc/61/56/32/1388615632.db2.gz IVJBIVMWSLWWCE-UHFFFAOYSA-N 1 3 347.478 2.640 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NCCC1CCN(C/C=C/Cl)CC1 ZINC001438451843 1388615934 /nfs/dbraw/zinc/61/59/34/1388615934.db2.gz KQLDVQFLBRZGST-ZRNALYAGSA-N 1 3 341.927 2.830 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H](CNC(=O)CN1CC[C@@H](C)C1)C(C)C ZINC001422105927 1379618137 /nfs/dbraw/zinc/61/81/37/1379618137.db2.gz CDYDAAAKQGAFHZ-DNVCBOLYSA-N 1 3 349.494 2.706 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1CC1CC(C)(C)C1 ZINC001422125392 1379650312 /nfs/dbraw/zinc/65/03/12/1379650312.db2.gz TUYWZAOXACJKRS-RDJZCZTQSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)CC[N@H+]1CC1CC(C)(C)C1 ZINC001422125392 1379650317 /nfs/dbraw/zinc/65/03/17/1379650317.db2.gz TUYWZAOXACJKRS-RDJZCZTQSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H](C)[NH2+][C@H]1CCc2ccccc21)N(C)C ZINC001422157646 1379699289 /nfs/dbraw/zinc/69/92/89/1379699289.db2.gz GRPRIQZAQDFRCF-ZYSHUDEJSA-N 1 3 331.504 2.745 10 0 EFAEHO C[C@@H](CCNC(=O)CN(C)CC(C)(C)C)[NH2+]Cc1ccsc1 ZINC001422159139 1379701918 /nfs/dbraw/zinc/70/19/18/1379701918.db2.gz WXGMUKRBFMMBBE-AWEZNQCLSA-N 1 3 325.522 2.710 10 0 EFAEHO COc1cccc([C@H](C)N(C)CCN(C)C(=O)[C@@H](C(C)C)[NH+](C)C)c1 ZINC001422230013 1379818976 /nfs/dbraw/zinc/81/89/76/1379818976.db2.gz QCFQBQURDYHWFR-QFBILLFUSA-N 1 3 349.519 2.733 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CC[C@@H](C)F)N(C)C ZINC001422232998 1379824441 /nfs/dbraw/zinc/82/44/41/1379824441.db2.gz NQQMIPPMNBJTSG-AXUOBQJMSA-N 1 3 349.494 2.693 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@H]1CCCN1C(=O)[C@H](C(C)C)N(C)C ZINC001422236617 1379831132 /nfs/dbraw/zinc/83/11/32/1379831132.db2.gz XGSVJPRCFSNHKS-MSOLQXFVSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@H]1CCCN1C(=O)[C@H](C(C)C)N(C)C ZINC001422236617 1379831136 /nfs/dbraw/zinc/83/11/36/1379831136.db2.gz XGSVJPRCFSNHKS-MSOLQXFVSA-N 1 3 325.541 2.932 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[N@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001422247534 1379855341 /nfs/dbraw/zinc/85/53/41/1379855341.db2.gz OQPSTXSPMLPVEZ-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001422247534 1379855345 /nfs/dbraw/zinc/85/53/45/1379855345.db2.gz OQPSTXSPMLPVEZ-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@@H]2C[NH2+]CC2CC3(CCC3)C2)CCC1 ZINC001422278547 1379893767 /nfs/dbraw/zinc/89/37/67/1379893767.db2.gz NYUQPVNYIFNZTJ-MSOLQXFVSA-N 1 3 347.547 2.926 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]Cc1cc(C)ccc1F ZINC001422288993 1379899778 /nfs/dbraw/zinc/89/97/78/1379899778.db2.gz XKPHKUIKZNJWAI-VQIMIIECSA-N 1 3 349.494 2.850 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CC1CC(NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001422293158 1379903296 /nfs/dbraw/zinc/90/32/96/1379903296.db2.gz JMLBLMQCSOKXDC-XUJQIHCRSA-N 1 3 349.494 2.705 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001422315267 1379924517 /nfs/dbraw/zinc/92/45/17/1379924517.db2.gz CKHDPUORFPZADT-HUUCEWRRSA-N 1 3 343.471 2.900 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001422325851 1379933417 /nfs/dbraw/zinc/93/34/17/1379933417.db2.gz NKFKRVPWQOZWHO-CVEARBPZSA-N 1 3 331.504 2.716 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)[C@H](C)NC(=O)CC2CC[NH+](C)CC2)c1 ZINC001422380156 1380009366 /nfs/dbraw/zinc/00/93/66/1380009366.db2.gz QLDBNJLKOSODPM-HOTGVXAUSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)c1cccc(CN[C@H](C)[C@H](C)NC(=O)C2CC[NH+](C)CC2)n1 ZINC001422397880 1380036698 /nfs/dbraw/zinc/03/66/98/1380036698.db2.gz YPNGIVQETRBXNX-CVEARBPZSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1cccc2cccnc21 ZINC001422432339 1380089451 /nfs/dbraw/zinc/08/94/51/1380089451.db2.gz DJJWUHMAKJPUQY-HOTGVXAUSA-N 1 3 342.487 2.558 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1cccc2cccnc21 ZINC001422432336 1380089572 /nfs/dbraw/zinc/08/95/72/1380089572.db2.gz DJJWUHMAKJPUQY-CVEARBPZSA-N 1 3 342.487 2.558 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC001422451918 1380124396 /nfs/dbraw/zinc/12/43/96/1380124396.db2.gz OJVUYPYXCJMUFE-JKSUJKDBSA-N 1 3 342.487 2.558 10 0 EFAEHO CCN(CC[NH2+][C@H](C)c1ccc(Cl)cc1)C(=O)CN1CCCC1 ZINC001422458653 1380137230 /nfs/dbraw/zinc/13/72/30/1380137230.db2.gz LCMXSKASCIPOCL-OAHLLOKOSA-N 1 3 337.895 2.935 10 0 EFAEHO CN(CC(C)(C)C[NH2+]CC1CC2(CCC2)C1)C(=O)Cc1c[nH]cn1 ZINC001422468178 1380156656 /nfs/dbraw/zinc/15/66/56/1380156656.db2.gz QWDVEIYQLSNPLZ-UHFFFAOYSA-N 1 3 332.492 2.607 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC(C)(C)C[NH2+]Cc1ccccc1F ZINC001422476607 1380168598 /nfs/dbraw/zinc/16/85/98/1380168598.db2.gz VWRTZGLNXNQQDQ-UHFFFAOYSA-N 1 3 337.483 2.740 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001422494632 1380197734 /nfs/dbraw/zinc/19/77/34/1380197734.db2.gz KHVNMNDTNSNHKF-MJGOQNOKSA-N 1 3 331.504 2.771 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(OC)cc1 ZINC001422518316 1380240535 /nfs/dbraw/zinc/24/05/35/1380240535.db2.gz MTDUHJMEDGCXEZ-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(OC)cc1 ZINC001422518316 1380240536 /nfs/dbraw/zinc/24/05/36/1380240536.db2.gz MTDUHJMEDGCXEZ-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001422521193 1380246691 /nfs/dbraw/zinc/24/66/91/1380246691.db2.gz FJQHWFRFWMXIOD-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001422521193 1380246694 /nfs/dbraw/zinc/24/66/94/1380246694.db2.gz FJQHWFRFWMXIOD-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CC2)cc1)NC(=O)C1(N(C)C)CCC1 ZINC001422658367 1380516733 /nfs/dbraw/zinc/51/67/33/1380516733.db2.gz BZMCYHKPJPOSCK-HNNXBMFYSA-N 1 3 329.488 2.643 10 0 EFAEHO C[C@@H](NC(=O)CC[NH+](C)C)C1CN([C@H](C)c2ccc3c(c2)CCC3)C1 ZINC001422736714 1380735355 /nfs/dbraw/zinc/73/53/55/1380735355.db2.gz WQOQETLKCLYEHH-HZPDHXFCSA-N 1 3 343.515 2.625 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCCC3)C[C@H]21)N1CCCCCC1 ZINC001422818263 1380854066 /nfs/dbraw/zinc/85/40/66/1380854066.db2.gz FARQMGYHEFELIC-AFYVEPGGSA-N 1 3 347.547 2.735 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCCC3)C[C@H]21)N1CCCCCC1 ZINC001422818263 1380854075 /nfs/dbraw/zinc/85/40/75/1380854075.db2.gz FARQMGYHEFELIC-AFYVEPGGSA-N 1 3 347.547 2.735 10 0 EFAEHO C[C@H](C[N@H+](C)[C@@H]1CCc2ccccc21)NC(=O)C1(N(C)C)CCC1 ZINC001422825077 1380864818 /nfs/dbraw/zinc/86/48/18/1380864818.db2.gz PUGUHRYGNNGUBH-CRAIPNDOSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@H](C[N@@H+](C)[C@@H]1CCc2ccccc21)NC(=O)C1(N(C)C)CCC1 ZINC001422825077 1380864826 /nfs/dbraw/zinc/86/48/26/1380864826.db2.gz PUGUHRYGNNGUBH-CRAIPNDOSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2[C@H]3C[N@@H+](CCCC4CCCC4)C[C@H]32)C1 ZINC001422836080 1380892561 /nfs/dbraw/zinc/89/25/61/1380892561.db2.gz XWNQECADMGUDJM-FRYIKTPZSA-N 1 3 347.547 2.593 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2[C@H]3C[N@H+](CCCC4CCCC4)C[C@H]32)C1 ZINC001422836080 1380892564 /nfs/dbraw/zinc/89/25/64/1380892564.db2.gz XWNQECADMGUDJM-FRYIKTPZSA-N 1 3 347.547 2.593 10 0 EFAEHO Cc1cc(F)ccc1CN1CCCC2(CN(C(=O)CC[NH+](C)C)C2)C1 ZINC001422853435 1380945143 /nfs/dbraw/zinc/94/51/43/1380945143.db2.gz BQHATILIOXKRHQ-UHFFFAOYSA-N 1 3 347.478 2.510 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](CC(CC)CC)C[C@H]2C1 ZINC001422881665 1380997012 /nfs/dbraw/zinc/99/70/12/1380997012.db2.gz SFKORMLYTGQPSN-IPMKNSEASA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CC(CC)CC)C[C@H]2C1 ZINC001422881665 1380997016 /nfs/dbraw/zinc/99/70/16/1380997016.db2.gz SFKORMLYTGQPSN-IPMKNSEASA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H](CN(C)C/C=C\c1ccc(Cl)cc1)NC(=O)CC[NH+](C)C ZINC001422883779 1380999645 /nfs/dbraw/zinc/99/96/45/1380999645.db2.gz IHZRBKUFELWCON-IYKSTZQJSA-N 1 3 337.895 2.741 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001422912715 1381041845 /nfs/dbraw/zinc/04/18/45/1381041845.db2.gz WLIXFMKDRVNHFT-GJZGRUSLSA-N 1 3 333.467 2.590 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001422912715 1381041852 /nfs/dbraw/zinc/04/18/52/1381041852.db2.gz WLIXFMKDRVNHFT-GJZGRUSLSA-N 1 3 333.467 2.590 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001422917012 1381051749 /nfs/dbraw/zinc/05/17/49/1381051749.db2.gz JHJSJDAQCBZYMB-UAPYVXQJSA-N 1 3 331.504 2.628 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001422994589 1381176590 /nfs/dbraw/zinc/17/65/90/1381176590.db2.gz NMKRDYLJQMVAEQ-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C[NH2+][C@H]1CCc2ccccc21)C1CC1 ZINC001423001471 1381188115 /nfs/dbraw/zinc/18/81/15/1381188115.db2.gz ZFJQRQFMRMPOIW-PMACEKPBSA-N 1 3 343.515 2.841 10 0 EFAEHO C[C@H](CNCc1cc2ccccc2o1)N(C)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001438638339 1388711536 /nfs/dbraw/zinc/71/15/36/1388711536.db2.gz DRZLNWBZHOVZJI-IIDMSEBBSA-N 1 3 343.471 2.710 10 0 EFAEHO C[C@H](CNCc1cc2ccccc2o1)N(C)C(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001438638339 1388711540 /nfs/dbraw/zinc/71/15/40/1388711540.db2.gz DRZLNWBZHOVZJI-IIDMSEBBSA-N 1 3 343.471 2.710 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C[C@@H](C)NC/C=C/Cl)[NH+]1CCCCC1 ZINC001423171416 1381499346 /nfs/dbraw/zinc/49/93/46/1381499346.db2.gz MJSGXUBNXYKEST-USQNJUIBSA-N 1 3 329.916 2.686 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+][C@@H](C)c2ccc(F)cc2)CC1 ZINC001423232561 1381635551 /nfs/dbraw/zinc/63/55/51/1381635551.db2.gz TZIJVKNGRSNHGN-YJBOKZPZSA-N 1 3 347.478 3.000 10 0 EFAEHO C[C@H](NC1(CNC(=O)CC[NH+](C)C)CC1)c1ccc(F)c(Cl)c1 ZINC001423275574 1381734664 /nfs/dbraw/zinc/73/46/64/1381734664.db2.gz PWKZJWSWQXXMOJ-LBPRGKRZSA-N 1 3 341.858 2.730 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CC[N@H+](CC3CC(C)C3)C2)CC1 ZINC001423318052 1381776737 /nfs/dbraw/zinc/77/67/37/1381776737.db2.gz DRELQYSBEKLNDL-QLOJAFMTSA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CC[N@@H+](CC3CC(C)C3)C2)CC1 ZINC001423318052 1381776741 /nfs/dbraw/zinc/77/67/41/1381776741.db2.gz DRELQYSBEKLNDL-QLOJAFMTSA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@H]1CC[N@H+](CCC2CC2)C1 ZINC001423320028 1381778834 /nfs/dbraw/zinc/77/88/34/1381778834.db2.gz IRMBNCXBMZNHKK-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@H]1CC[N@@H+](CCC2CC2)C1 ZINC001423320028 1381778838 /nfs/dbraw/zinc/77/88/38/1381778838.db2.gz IRMBNCXBMZNHKK-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@]2(C1)CCCN(Cc1ccsc1)C2 ZINC001423355123 1381834468 /nfs/dbraw/zinc/83/44/68/1381834468.db2.gz UTPDFYDOSFYZRU-LJQANCHMSA-N 1 3 349.544 2.904 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@]2(C1)CCCN(Cc1ccsc1)C2 ZINC001423355123 1381834475 /nfs/dbraw/zinc/83/44/75/1381834475.db2.gz UTPDFYDOSFYZRU-LJQANCHMSA-N 1 3 349.544 2.904 10 0 EFAEHO CC[C@H](C)C[NH2+][C@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001423407305 1381915978 /nfs/dbraw/zinc/91/59/78/1381915978.db2.gz VALSBYBHJKAEQG-HOTGVXAUSA-N 1 3 325.541 2.837 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001423408481 1381916845 /nfs/dbraw/zinc/91/68/45/1381916845.db2.gz CLXKAIMXMNVWBP-RBUKOAKNSA-N 1 3 331.504 2.710 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2CC[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001423421786 1381931662 /nfs/dbraw/zinc/93/16/62/1381931662.db2.gz QALFRFKASQHHLR-PMACEKPBSA-N 1 3 345.531 2.964 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc2ncccc2c1 ZINC001438710971 1388754977 /nfs/dbraw/zinc/75/49/77/1388754977.db2.gz GGAKKLLZOQKWLP-INIZCTEOSA-N 1 3 342.487 2.512 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC1(C)CCN(CCC(F)(F)F)CC1 ZINC001423502759 1381992218 /nfs/dbraw/zinc/99/22/18/1381992218.db2.gz FYCKNXKXFXDYKL-AWEZNQCLSA-N 1 3 349.441 2.784 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC1(C)CCN(CCC(F)(F)F)CC1 ZINC001423502759 1381992225 /nfs/dbraw/zinc/99/22/25/1381992225.db2.gz FYCKNXKXFXDYKL-AWEZNQCLSA-N 1 3 349.441 2.784 10 0 EFAEHO CCC[NH+]1CCC(C)(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001423503951 1381993603 /nfs/dbraw/zinc/99/36/03/1381993603.db2.gz AXAWTLBWGGNFFD-GOSISDBHSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NC1(C)CCN(CCC(F)(F)F)CC1 ZINC001423510910 1381999539 /nfs/dbraw/zinc/99/95/39/1381999539.db2.gz DUWXXJSAVIOQAP-OKILXGFUSA-N 1 3 349.441 2.782 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NC1(C)CCN(CCC(F)(F)F)CC1 ZINC001423510910 1381999541 /nfs/dbraw/zinc/99/95/41/1381999541.db2.gz DUWXXJSAVIOQAP-OKILXGFUSA-N 1 3 349.441 2.782 10 0 EFAEHO Cc1cccc(CN(C)CCN(C(=O)[C@H]2CC[N@H+](C)C2)C(C)C)c1 ZINC001423578276 1382105703 /nfs/dbraw/zinc/10/57/03/1382105703.db2.gz MCPQVFMXQIVNKS-IBGZPJMESA-N 1 3 331.504 2.616 10 0 EFAEHO Cc1cccc(CN(C)CCN(C(=O)[C@H]2CC[N@@H+](C)C2)C(C)C)c1 ZINC001423578276 1382105708 /nfs/dbraw/zinc/10/57/08/1382105708.db2.gz MCPQVFMXQIVNKS-IBGZPJMESA-N 1 3 331.504 2.616 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@](C)(C[NH2+]Cc2ccccc2Cl)C1 ZINC001423627235 1382189868 /nfs/dbraw/zinc/18/98/68/1382189868.db2.gz GGTWBYYYBCWTLB-HKUYNNGSSA-N 1 3 349.906 2.762 10 0 EFAEHO CC(C)CC[NH+]1CCC([C@H](C)NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001423661078 1382242811 /nfs/dbraw/zinc/24/28/11/1382242811.db2.gz CYDDRUADMKQWQP-WMZOPIPTSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)(C(=O)NCC1(C)CC[NH+](CCC2CC2)CC1)N1CCCC1 ZINC001423674665 1382264913 /nfs/dbraw/zinc/26/49/13/1382264913.db2.gz RMTNTPMLAKYVLA-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H](C)[NH2+]Cc2ccccc2)C1 ZINC001438760688 1388791350 /nfs/dbraw/zinc/79/13/50/1388791350.db2.gz BFGTXSZBKYVPAJ-PKOBYXMFSA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@@H]1C[NH2+]Cc1ccc(F)cc1 ZINC001438770934 1388799780 /nfs/dbraw/zinc/79/97/80/1388799780.db2.gz VTHFJCCGWAWFDY-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CN(CC(=O)NCc1ccccc1C[N@H+](C)CC1CC1)C1CCC1 ZINC001424059914 1382715291 /nfs/dbraw/zinc/71/52/91/1382715291.db2.gz ABCDHZNJBPCHBO-UHFFFAOYSA-N 1 3 329.488 2.629 10 0 EFAEHO CN(CC(=O)NCc1ccccc1C[N@@H+](C)CC1CC1)C1CCC1 ZINC001424059914 1382715307 /nfs/dbraw/zinc/71/53/07/1382715307.db2.gz ABCDHZNJBPCHBO-UHFFFAOYSA-N 1 3 329.488 2.629 10 0 EFAEHO CN(CCCN(C)C(=O)[C@H]1CCC[C@H]2CCC[N@@H+]21)CCC(F)(F)F ZINC001424325258 1382935783 /nfs/dbraw/zinc/93/57/83/1382935783.db2.gz DNDVOAXTGSGUOU-LSDHHAIUSA-N 1 3 349.441 2.736 10 0 EFAEHO CN(CCCN(C)C(=O)[C@H]1CCC[C@H]2CCC[N@H+]21)CCC(F)(F)F ZINC001424325258 1382935788 /nfs/dbraw/zinc/93/57/88/1382935788.db2.gz DNDVOAXTGSGUOU-LSDHHAIUSA-N 1 3 349.441 2.736 10 0 EFAEHO CN(CCCN(C)C(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21)CCC(F)(F)F ZINC001424324767 1382936652 /nfs/dbraw/zinc/93/66/52/1382936652.db2.gz DNDVOAXTGSGUOU-GJZGRUSLSA-N 1 3 349.441 2.736 10 0 EFAEHO CN(CCCN(C)C(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21)CCC(F)(F)F ZINC001424324767 1382936658 /nfs/dbraw/zinc/93/66/58/1382936658.db2.gz DNDVOAXTGSGUOU-GJZGRUSLSA-N 1 3 349.441 2.736 10 0 EFAEHO CCCN(C)CC(=O)N(C)CCC[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001424325721 1382937959 /nfs/dbraw/zinc/93/79/59/1382937959.db2.gz ILMAAHOSFZFINI-LJQANCHMSA-N 1 3 331.504 2.796 10 0 EFAEHO CCCN(C)CC(=O)N(C)CCC[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001424325721 1382937963 /nfs/dbraw/zinc/93/79/63/1382937963.db2.gz ILMAAHOSFZFINI-LJQANCHMSA-N 1 3 331.504 2.796 10 0 EFAEHO CN(CCC[N@H+](C)Cc1ccc(Cl)cc1)C(=O)CN1CCCC1 ZINC001424331898 1382946923 /nfs/dbraw/zinc/94/69/23/1382946923.db2.gz NXAWAHJYRJZGRV-UHFFFAOYSA-N 1 3 337.895 2.716 10 0 EFAEHO CN(CCC[N@@H+](C)Cc1ccc(Cl)cc1)C(=O)CN1CCCC1 ZINC001424331898 1382946929 /nfs/dbraw/zinc/94/69/29/1382946929.db2.gz NXAWAHJYRJZGRV-UHFFFAOYSA-N 1 3 337.895 2.716 10 0 EFAEHO CCC1([NH2+]Cc2ccccc2F)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001424359149 1382964925 /nfs/dbraw/zinc/96/49/25/1382964925.db2.gz PEYASZSXEWWZAE-SFHVURJKSA-N 1 3 347.478 2.781 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+]C1(C)CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001424489557 1383046365 /nfs/dbraw/zinc/04/63/65/1383046365.db2.gz GWAYZYYOENEZJV-MSOLQXFVSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001424556959 1383105213 /nfs/dbraw/zinc/10/52/13/1383105213.db2.gz GEDLIOWVEQXNRT-PKOBYXMFSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001424556959 1383105219 /nfs/dbraw/zinc/10/52/19/1383105219.db2.gz GEDLIOWVEQXNRT-PKOBYXMFSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001424556957 1383105460 /nfs/dbraw/zinc/10/54/60/1383105460.db2.gz GEDLIOWVEQXNRT-MJGOQNOKSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001424556957 1383105463 /nfs/dbraw/zinc/10/54/63/1383105463.db2.gz GEDLIOWVEQXNRT-MJGOQNOKSA-N 1 3 331.504 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001424624608 1383215010 /nfs/dbraw/zinc/21/50/10/1383215010.db2.gz CLVKUBVUYXQBQU-AWEZNQCLSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H](C(C)C)N(C)C ZINC001424686014 1383256598 /nfs/dbraw/zinc/25/65/98/1383256598.db2.gz RJBCLQJYVSDZTH-XLNTUCKNSA-N 1 3 345.531 2.991 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@H+](C)Cc1ccc(CF)cc1 ZINC001424697604 1383269865 /nfs/dbraw/zinc/26/98/65/1383269865.db2.gz KHGCRFROFHKBOI-LJQANCHMSA-N 1 3 349.494 2.919 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@@H+](C)Cc1ccc(CF)cc1 ZINC001424697604 1383269866 /nfs/dbraw/zinc/26/98/66/1383269866.db2.gz KHGCRFROFHKBOI-LJQANCHMSA-N 1 3 349.494 2.919 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@H+](C)C/C=C\c1ccccc1 ZINC001424697920 1383270259 /nfs/dbraw/zinc/27/02/59/1383270259.db2.gz KLGLQWUIWLAEGJ-VUBAQRPUSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@@H+](C)C/C=C\c1ccccc1 ZINC001424697920 1383270263 /nfs/dbraw/zinc/27/02/63/1383270263.db2.gz KLGLQWUIWLAEGJ-VUBAQRPUSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H]2CC[N@H+](C/C=C\Cl)C2)C1 ZINC001424699440 1383270891 /nfs/dbraw/zinc/27/08/91/1383270891.db2.gz MRSCVKPFBZWXSL-YZNPXCOXSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H]2CC[N@@H+](C/C=C\Cl)C2)C1 ZINC001424699440 1383270893 /nfs/dbraw/zinc/27/08/93/1383270893.db2.gz MRSCVKPFBZWXSL-YZNPXCOXSA-N 1 3 341.927 2.640 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)[C@H](C(C)C)N(C)C)C2)cc1C ZINC001424752295 1383321165 /nfs/dbraw/zinc/32/11/65/1383321165.db2.gz OENHQSXMXNSLQP-MHJFOBGBSA-N 1 3 345.531 2.874 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1C ZINC001424803449 1383362571 /nfs/dbraw/zinc/36/25/71/1383362571.db2.gz RPUGXPDXGHEOPY-SJORKVTESA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@@H](NCc1cc(Cl)ccc1F)[C@H](C)NC(=O)CCC[NH+](C)C ZINC001424823422 1383383043 /nfs/dbraw/zinc/38/30/43/1383383043.db2.gz MFQVKGNDFKNNDI-OLZOCXBDSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)[C@H](C)NCc1cc2ccccc2o1 ZINC001424844759 1383408375 /nfs/dbraw/zinc/40/83/75/1383408375.db2.gz UCYPKPFMLPFKLW-GJZGRUSLSA-N 1 3 331.460 2.757 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)[C@H](C)NCc1cc2ccccc2o1 ZINC001424844759 1383408380 /nfs/dbraw/zinc/40/83/80/1383408380.db2.gz UCYPKPFMLPFKLW-GJZGRUSLSA-N 1 3 331.460 2.757 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[N@H+](C)CCCc1ccccc1 ZINC001424937309 1383492853 /nfs/dbraw/zinc/49/28/53/1383492853.db2.gz JBQJNXRWAWEFDD-QUCCMNQESA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[N@@H+](C)CCCc1ccccc1 ZINC001424937309 1383492858 /nfs/dbraw/zinc/49/28/58/1383492858.db2.gz JBQJNXRWAWEFDD-QUCCMNQESA-N 1 3 345.531 2.929 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CCCCC[N@@H+]1CCCF)N1CCCCCC1 ZINC001425194622 1383539921 /nfs/dbraw/zinc/53/99/21/1383539921.db2.gz XTUICZPHCOBFAR-QZTJIDSGSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CCCCC[N@H+]1CCCF)N1CCCCCC1 ZINC001425194622 1383539924 /nfs/dbraw/zinc/53/99/24/1383539924.db2.gz XTUICZPHCOBFAR-QZTJIDSGSA-N 1 3 341.515 2.971 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@]2(C)C[N@H+](CCCC(C)C)C[C@]2(C)C1)N(C)C ZINC001425376550 1383636299 /nfs/dbraw/zinc/63/62/99/1383636299.db2.gz JFSXLBMVKDHWAN-YSIASYRMSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@]2(C)C[N@@H+](CCCC(C)C)C[C@]2(C)C1)N(C)C ZINC001425376550 1383636302 /nfs/dbraw/zinc/63/63/02/1383636302.db2.gz JFSXLBMVKDHWAN-YSIASYRMSA-N 1 3 337.552 2.933 10 0 EFAEHO C[C@H]([NH2+]C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)C1)c1ccc(F)cc1 ZINC001425394764 1383646339 /nfs/dbraw/zinc/64/63/39/1383646339.db2.gz VNUAPDVSXZEDJF-MPGHIAIKSA-N 1 3 347.478 2.855 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001425414793 1383651746 /nfs/dbraw/zinc/65/17/46/1383651746.db2.gz GVSONTYBEKXRGM-FHWLQOOXSA-N 1 3 331.504 2.566 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)cs1 ZINC001425424412 1383655407 /nfs/dbraw/zinc/65/54/07/1383655407.db2.gz RCDAVAGFEXGGQY-DJIMGWMZSA-N 1 3 337.533 2.627 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C[C@H](C)NCc1cc(C)ccc1F ZINC001425557900 1383691424 /nfs/dbraw/zinc/69/14/24/1383691424.db2.gz LIKXMTBWYDWZNC-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N(C)C[C@H](C)NCc1cc(C)ccc1F ZINC001425557900 1383691425 /nfs/dbraw/zinc/69/14/25/1383691425.db2.gz LIKXMTBWYDWZNC-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cccnc1CN[C@H](C)CN(C)C(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC001425642380 1383731898 /nfs/dbraw/zinc/73/18/98/1383731898.db2.gz PWRAYMSAKDEOCE-QZTJIDSGSA-N 1 3 346.519 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+][C@@H]1CCCc2ccccc21 ZINC001425689121 1383766962 /nfs/dbraw/zinc/76/69/62/1383766962.db2.gz BJUSHDXUKDWFGD-VQIMIIECSA-N 1 3 331.504 2.841 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc3cc[nH]c3c2)C[C@H]1C ZINC001425907770 1383845156 /nfs/dbraw/zinc/84/51/56/1383845156.db2.gz GZARSQBVDLSWDO-QAPCUYQASA-N 1 3 342.487 2.589 10 0 EFAEHO CCc1cccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)c1 ZINC001438875339 1388883595 /nfs/dbraw/zinc/88/35/95/1388883595.db2.gz WAOVXAORPXIBIZ-VQTJNVASSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1cccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)c1 ZINC001438875339 1388883600 /nfs/dbraw/zinc/88/36/00/1388883600.db2.gz WAOVXAORPXIBIZ-VQTJNVASSA-N 1 3 345.531 2.870 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]Cc2cc(C)cc(C)c2)C(C)(C)C1 ZINC001425968480 1383907475 /nfs/dbraw/zinc/90/74/75/1383907475.db2.gz HBQJTQGHSSOGLH-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](F)CN[C@H]1CN(C(=O)CCC[NH+]2CCCCC2)CC1(C)C ZINC001425969390 1383908006 /nfs/dbraw/zinc/90/80/06/1383908006.db2.gz HBCDPGNKMHTEAQ-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(CC[N@H+](C)CCc1cccs1)C(=O)[C@H]1CCCN1C ZINC001426114527 1383995826 /nfs/dbraw/zinc/99/58/26/1383995826.db2.gz XVGPMRJRXULZGK-QGZVFWFLSA-N 1 3 337.533 2.554 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CCc1cccs1)C(=O)[C@H]1CCCN1C ZINC001426114527 1383995830 /nfs/dbraw/zinc/99/58/30/1383995830.db2.gz XVGPMRJRXULZGK-QGZVFWFLSA-N 1 3 337.533 2.554 10 0 EFAEHO CC(C)Oc1ccc([C@H](CNC(=O)[C@@H](C)CC[NH+](C)C)N(C)C)cc1 ZINC001434040564 1387070510 /nfs/dbraw/zinc/07/05/10/1387070510.db2.gz MUVBUQILTCIVKO-LPHOPBHVSA-N 1 3 349.519 2.781 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+][C@@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001439132976 1389007400 /nfs/dbraw/zinc/00/74/00/1389007400.db2.gz QPNNJRMGDSNQND-CSMYWGQOSA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1sccc1Cl ZINC001439212870 1389051396 /nfs/dbraw/zinc/05/13/96/1389051396.db2.gz HOODQKXALFZLBY-GXTWGEPZSA-N 1 3 343.924 2.869 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1sccc1Cl ZINC001439212870 1389051399 /nfs/dbraw/zinc/05/13/99/1389051399.db2.gz HOODQKXALFZLBY-GXTWGEPZSA-N 1 3 343.924 2.869 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H](C)NC(=O)[C@@H]1CCCN1C(C)C ZINC001439215106 1389052184 /nfs/dbraw/zinc/05/21/84/1389052184.db2.gz MRSZTBNSAJWICZ-HKUYNNGSSA-N 1 3 331.504 2.771 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3nc[nH]c3C)C[C@@H]2C1 ZINC001506860192 1406356948 /nfs/dbraw/zinc/35/69/48/1406356948.db2.gz VVZMDSXKNINZHK-SFNRIZHHSA-N 1 3 344.503 2.834 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3nc[nH]c3C)C[C@@H]2C1 ZINC001506860192 1406356958 /nfs/dbraw/zinc/35/69/58/1406356958.db2.gz VVZMDSXKNINZHK-SFNRIZHHSA-N 1 3 344.503 2.834 10 0 EFAEHO Cc1cccc(CN(C)C[C@@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001439329526 1389147164 /nfs/dbraw/zinc/14/71/64/1389147164.db2.gz BHQJTMRHVUYOHV-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1cccc(CN(C)C[C@@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001439329526 1389147172 /nfs/dbraw/zinc/14/71/72/1389147172.db2.gz BHQJTMRHVUYOHV-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO C[C@H](C[N@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)CN(C)C1CCC1 ZINC001439335390 1389157957 /nfs/dbraw/zinc/15/79/57/1389157957.db2.gz ZONBMIGAXWRTDJ-MRXNPFEDSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@H](C[N@@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)CN(C)C1CCC1 ZINC001439335390 1389157965 /nfs/dbraw/zinc/15/79/65/1389157965.db2.gz ZONBMIGAXWRTDJ-MRXNPFEDSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H](CN(C)[C@@H](C)c1cccc(Cl)c1)NC(=O)C12CC[NH+](CC1)C2 ZINC001439393977 1389231485 /nfs/dbraw/zinc/23/14/85/1389231485.db2.gz APOJVTOGMREJLP-GJZGRUSLSA-N 1 3 349.906 2.933 10 0 EFAEHO C[NH+](C)CCCC(=O)NCC1(N[C@@H]2CCc3ccc(Cl)cc32)CC1 ZINC001439637899 1389327804 /nfs/dbraw/zinc/32/78/04/1389327804.db2.gz FUYIEZAPIZDACU-QGZVFWFLSA-N 1 3 349.906 2.908 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2csc(C)c2)C1 ZINC001440137848 1389407206 /nfs/dbraw/zinc/40/72/06/1389407206.db2.gz RCNIZHFLARHMQP-WMLDXEAASA-N 1 3 337.533 2.582 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+]([C@@H](C)c3cccc(F)c3)C[C@@H]2C1 ZINC001440151168 1389411164 /nfs/dbraw/zinc/41/11/64/1389411164.db2.gz OXNHKKFPAGPDND-RYQLBKOJSA-N 1 3 347.478 2.617 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+]([C@@H](C)c3cccc(F)c3)C[C@@H]2C1 ZINC001440151168 1389411168 /nfs/dbraw/zinc/41/11/68/1389411168.db2.gz OXNHKKFPAGPDND-RYQLBKOJSA-N 1 3 347.478 2.617 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H](C[NH2+]Cc3ccsc3)CC2)CCC1 ZINC001440222759 1389452712 /nfs/dbraw/zinc/45/27/12/1389452712.db2.gz ZXWMYEFFQDCMLL-JCNLHEQBSA-N 1 3 349.544 2.997 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]CC[C@@H]2CCN(C(=O)CN3CCCC3)C2)c1 ZINC001440224331 1389454091 /nfs/dbraw/zinc/45/40/91/1389454091.db2.gz YGOZKGKJZSIROS-RBUKOAKNSA-N 1 3 343.515 2.980 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NCc1ccc([C@@H](C)NCCF)cc1 ZINC001440226792 1389457631 /nfs/dbraw/zinc/45/76/31/1389457631.db2.gz VTQMACXCHGCIMT-CRAIPNDOSA-N 1 3 335.467 2.796 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NCc1ccc([C@@H](C)NCCF)cc1 ZINC001440226792 1389457636 /nfs/dbraw/zinc/45/76/36/1389457636.db2.gz VTQMACXCHGCIMT-CRAIPNDOSA-N 1 3 335.467 2.796 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@@H]([NH2+][C@H](C)c2cccc(OC)c2)C1)N(C)C ZINC001440300671 1389514595 /nfs/dbraw/zinc/51/45/95/1389514595.db2.gz HGEFAKZIWHCAPP-RRIFGTCXSA-N 1 3 347.503 2.581 10 0 EFAEHO C[C@@H](N[C@H]1C[C@@H](CNC(=O)CC[NH+](C)C)C1)c1ccccc1Cl ZINC001440301821 1389515162 /nfs/dbraw/zinc/51/51/62/1389515162.db2.gz DUWBRJSWEKVULD-KFWWJZLASA-N 1 3 337.895 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)cc2)C1 ZINC001440321421 1389533166 /nfs/dbraw/zinc/53/31/66/1389533166.db2.gz SAXDDOUUDPTWJX-RKVPGOIHSA-N 1 3 335.467 2.711 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]Cc2cccc(F)c2)C1 ZINC001440362661 1389567486 /nfs/dbraw/zinc/56/74/86/1389567486.db2.gz MVTSXDUDQKBEFK-UBWZFYQTSA-N 1 3 347.478 2.683 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](Cc2ccccc2C)CC1)N(C)C ZINC001440386031 1389583509 /nfs/dbraw/zinc/58/35/09/1389583509.db2.gz ILFWNNRUVFKYJH-RTBURBONSA-N 1 3 331.504 2.806 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2C)CC1)N(C)C ZINC001440386031 1389583512 /nfs/dbraw/zinc/58/35/12/1389583512.db2.gz ILFWNNRUVFKYJH-RTBURBONSA-N 1 3 331.504 2.806 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)[C@H](CC)N(C)C)C2)c1 ZINC001440403769 1389601731 /nfs/dbraw/zinc/60/17/31/1389601731.db2.gz WVQVIZIYCHTHCX-ZCNNSNEGSA-N 1 3 345.531 2.964 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@@H]([NH2+][C@@H](C)c2ccccc2)C1 ZINC001440409419 1389609468 /nfs/dbraw/zinc/60/94/68/1389609468.db2.gz HLMQMZPDQJWEHH-QILLFSRXSA-N 1 3 340.471 2.896 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[N@H+](C)[C@@H]2CCc3ccccc32)CCC1 ZINC001440433006 1389631314 /nfs/dbraw/zinc/63/13/14/1389631314.db2.gz OIFSACOSRWLTQJ-LJQANCHMSA-N 1 3 343.515 2.939 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[N@@H+](C)[C@@H]2CCc3ccccc32)CCC1 ZINC001440433006 1389631318 /nfs/dbraw/zinc/63/13/18/1389631318.db2.gz OIFSACOSRWLTQJ-LJQANCHMSA-N 1 3 343.515 2.939 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CCC[NH+](C)C)CCN1Cc1cccc(OC)c1 ZINC001440443804 1389641933 /nfs/dbraw/zinc/64/19/33/1389641933.db2.gz CESCMQJYPGFSNV-RBUKOAKNSA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1cccnc1CN(C)CCCN(C)C(=O)C(C)(C)[NH+]1CCCC1 ZINC001440448136 1389646188 /nfs/dbraw/zinc/64/61/88/1389646188.db2.gz SEPHABZLEZNJDJ-UHFFFAOYSA-N 1 3 346.519 2.545 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)CCCN(C)C(=O)CN2CCCC2)c1 ZINC001440481793 1389687289 /nfs/dbraw/zinc/68/72/89/1389687289.db2.gz LWYNHPPMEPHEDH-QGZVFWFLSA-N 1 3 347.503 2.632 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)CCCN(C)C(=O)CN2CCCC2)c1 ZINC001440481793 1389687292 /nfs/dbraw/zinc/68/72/92/1389687292.db2.gz LWYNHPPMEPHEDH-QGZVFWFLSA-N 1 3 347.503 2.632 10 0 EFAEHO Cc1cc(C)cc(C[N@H+]2CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]2C)c1 ZINC001440491411 1389695886 /nfs/dbraw/zinc/69/58/86/1389695886.db2.gz WPBUODYMXFOEQQ-HOJAQTOUSA-N 1 3 345.531 2.969 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+]2CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]2C)c1 ZINC001440491411 1389695889 /nfs/dbraw/zinc/69/58/89/1389695889.db2.gz WPBUODYMXFOEQQ-HOJAQTOUSA-N 1 3 345.531 2.969 10 0 EFAEHO CCC1([NH2+]Cc2ccccc2C)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001440523164 1389725736 /nfs/dbraw/zinc/72/57/36/1389725736.db2.gz RPVXTDIVIYEVLB-IBGZPJMESA-N 1 3 343.515 2.950 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[N@H+](CCC3CC3)CC(C)(C)C2)CCC1 ZINC001440527355 1389729221 /nfs/dbraw/zinc/72/92/21/1389729221.db2.gz BMUADGJIOLZWOX-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[N@@H+](CCC3CC3)CC(C)(C)C2)CCC1 ZINC001440527355 1389729223 /nfs/dbraw/zinc/72/92/23/1389729223.db2.gz BMUADGJIOLZWOX-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)CN1Cc2ccccc2C[C@H]1CNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001440544869 1389746736 /nfs/dbraw/zinc/74/67/36/1389746736.db2.gz QSBATEDIQDJUNC-PXNSSMCTSA-N 1 3 343.515 2.527 10 0 EFAEHO CC(C)CN1Cc2ccccc2C[C@H]1CNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001440544869 1389746740 /nfs/dbraw/zinc/74/67/40/1389746740.db2.gz QSBATEDIQDJUNC-PXNSSMCTSA-N 1 3 343.515 2.527 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)NCc1ccc2c(c1)CN(CC1CC1)C2 ZINC001440579411 1389759112 /nfs/dbraw/zinc/75/91/12/1389759112.db2.gz NQYYXHMSNXXPPF-HOTGVXAUSA-N 1 3 341.499 2.901 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]Cc2cccc(F)c2)CC1 ZINC001440602691 1389767630 /nfs/dbraw/zinc/76/76/30/1389767630.db2.gz CGIRVPGDRVRREB-UHFFFAOYSA-N 1 3 335.467 2.638 10 0 EFAEHO CCN1CCN(c2ccc(NC(=O)[C@H](C)CC[NH+](C)C)c(C)c2)CC1 ZINC001440621284 1389778995 /nfs/dbraw/zinc/77/89/95/1389778995.db2.gz ZPFMZJBXYKNJGI-MRXNPFEDSA-N 1 3 346.519 2.663 10 0 EFAEHO CCN1CCN(c2ccc(NC(=O)[C@@H](C)CC[NH+](C)C)c(C)c2)CC1 ZINC001440621282 1389779001 /nfs/dbraw/zinc/77/90/01/1389779001.db2.gz ZPFMZJBXYKNJGI-INIZCTEOSA-N 1 3 346.519 2.663 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CCc2cccs2)[C@@H](C)C1 ZINC001440652961 1389800352 /nfs/dbraw/zinc/80/03/52/1389800352.db2.gz OINQYGRKNRGQCD-JKSUJKDBSA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CCc2cccs2)[C@@H](C)C1 ZINC001440652961 1389800355 /nfs/dbraw/zinc/80/03/55/1389800355.db2.gz OINQYGRKNRGQCD-JKSUJKDBSA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C/Cl ZINC001440659392 1389805483 /nfs/dbraw/zinc/80/54/83/1389805483.db2.gz VKXCQDSHDQXMIJ-OIZKETEYSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C/Cl ZINC001440659392 1389805490 /nfs/dbraw/zinc/80/54/90/1389805490.db2.gz VKXCQDSHDQXMIJ-OIZKETEYSA-N 1 3 336.307 2.663 10 0 EFAEHO C[C@@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001440665041 1389807085 /nfs/dbraw/zinc/80/70/85/1389807085.db2.gz MUBJFBCNODDPTC-MAUKXSAKSA-N 1 3 329.488 2.643 10 0 EFAEHO Cc1ccc2sc(CN[C@@H](C)CCNC(=O)CC[NH+](C)C)nc2c1 ZINC001440668738 1389808107 /nfs/dbraw/zinc/80/81/07/1389808107.db2.gz JKVJJBDEMWGMKH-AWEZNQCLSA-N 1 3 348.516 2.541 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]Cc2ccc(C)cc2C)C1 ZINC001440762534 1389876840 /nfs/dbraw/zinc/87/68/40/1389876840.db2.gz XDZYZEXOHYWMQN-UHFFFAOYSA-N 1 3 331.504 2.630 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)c(C)s1 ZINC001440795955 1389903470 /nfs/dbraw/zinc/90/34/70/1389903470.db2.gz JRSMVOSUVDWKBM-ZIAGYGMSSA-N 1 3 337.533 2.832 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)c(C)s1 ZINC001440795946 1389903798 /nfs/dbraw/zinc/90/37/98/1389903798.db2.gz JRSMVOSUVDWKBM-KGLIPLIRSA-N 1 3 337.533 2.832 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc2c(c1)CCC2)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001440805091 1389910695 /nfs/dbraw/zinc/91/06/95/1389910695.db2.gz YZCXKJIDTMNFQJ-CVEARBPZSA-N 1 3 343.515 2.642 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H](C)[N@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001440934970 1390022926 /nfs/dbraw/zinc/02/29/26/1390022926.db2.gz KZUMACPNXDEKFI-KXBFYZLASA-N 1 3 344.503 2.691 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H](C)[N@@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001440934970 1390022931 /nfs/dbraw/zinc/02/29/31/1390022931.db2.gz KZUMACPNXDEKFI-KXBFYZLASA-N 1 3 344.503 2.691 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)[C@@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001440950523 1390039098 /nfs/dbraw/zinc/03/90/98/1390039098.db2.gz FLMBKNIZPXXYBQ-KRWDZBQOSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccccc1C[N@H+](C)[C@@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001440950523 1390039107 /nfs/dbraw/zinc/03/91/07/1390039107.db2.gz FLMBKNIZPXXYBQ-KRWDZBQOSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001440974230 1390066357 /nfs/dbraw/zinc/06/63/57/1390066357.db2.gz SXSRWFFPEYJJKS-CRAIPNDOSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001440974230 1390066364 /nfs/dbraw/zinc/06/63/64/1390066364.db2.gz SXSRWFFPEYJJKS-CRAIPNDOSA-N 1 3 331.504 2.582 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001506903227 1406420710 /nfs/dbraw/zinc/42/07/10/1406420710.db2.gz IYTCZAVQTBJFGA-COLGRIRVSA-N 1 3 329.488 2.524 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2cc(C)sc2C)C1 ZINC001506904110 1406422086 /nfs/dbraw/zinc/42/20/86/1406422086.db2.gz YBPAXKUDUNEKCQ-JCNLHEQBSA-N 1 3 337.533 2.691 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@@H]2CCCc3ccccc32)C1 ZINC001506906159 1406424617 /nfs/dbraw/zinc/42/46/17/1406424617.db2.gz HTIRLQDPZXWUSH-YVWKXTFCSA-N 1 3 343.515 2.889 10 0 EFAEHO Cc1cccc(C[NH2+]CCC[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001506922353 1406446859 /nfs/dbraw/zinc/44/68/59/1406446859.db2.gz CIKAPJVMRRYANB-QGZVFWFLSA-N 1 3 331.504 2.854 10 0 EFAEHO C[C@H](CCC[NH2+]Cc1ccccc1F)NC(=O)CN1CC[C@H](C)C1 ZINC001506937425 1406467225 /nfs/dbraw/zinc/46/72/25/1406467225.db2.gz APLQYXQLDHHIFP-JKSUJKDBSA-N 1 3 335.467 2.542 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccccc1 ZINC001441078962 1391073489 /nfs/dbraw/zinc/07/34/89/1391073489.db2.gz HLEIZZWGIYQMOU-ICSRJNTNSA-N 1 3 345.531 2.991 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccccc1 ZINC001441078958 1391073584 /nfs/dbraw/zinc/07/35/84/1391073584.db2.gz HLEIZZWGIYQMOU-AZUAARDMSA-N 1 3 345.531 2.991 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)CN1CCCC1)[NH2+]Cc1ccc(F)cc1 ZINC001441094300 1391086852 /nfs/dbraw/zinc/08/68/52/1391086852.db2.gz WKYZGQVZGXNKLJ-IBGZPJMESA-N 1 3 349.494 2.884 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@H]1CCCCCN1Cc1cccc(F)c1 ZINC001441124808 1391119282 /nfs/dbraw/zinc/11/92/82/1391119282.db2.gz CLXWRIUAOLMSTO-SFHVURJKSA-N 1 3 335.467 2.638 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+][C@@H]1CCc2ccccc21 ZINC001506947438 1406483702 /nfs/dbraw/zinc/48/37/02/1406483702.db2.gz YPAABMTYNWPOMA-KBXCAEBGSA-N 1 3 340.471 2.823 10 0 EFAEHO C[C@@H](NC(=O)[C@H](C)[NH+]1CCCCCC1)C1CN(Cc2ccccc2)C1 ZINC001441177968 1391162498 /nfs/dbraw/zinc/16/24/98/1391162498.db2.gz BJSALROTQUTHPV-MSOLQXFVSA-N 1 3 343.515 2.888 10 0 EFAEHO Cc1ccc(C[NH+]2CC([C@H](C)NC(=O)CN3CC[C@@H](C)C3)C2)c(C)c1 ZINC001441189387 1391169723 /nfs/dbraw/zinc/16/97/23/1391169723.db2.gz ZVRWXRHXDCLERM-AEFFLSMTSA-N 1 3 343.515 2.582 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CC1CC(C)(C)C1)C1CC1 ZINC001441201204 1391177997 /nfs/dbraw/zinc/17/79/97/1391177997.db2.gz LTBQJOBRJFIEQN-MSOLQXFVSA-N 1 3 335.536 2.781 10 0 EFAEHO C[C@H](c1ccccc1Cl)N1C[C@@H]2[C@@H](CNC(=O)CC[NH+](C)C)[C@@H]2C1 ZINC001441281942 1391230813 /nfs/dbraw/zinc/23/08/13/1391230813.db2.gz NRDXIAXQOVFMEU-DZUCGIPZSA-N 1 3 349.906 2.647 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@@H](C)C3)C[C@@]2(C)C1 ZINC001441338690 1391257900 /nfs/dbraw/zinc/25/79/00/1391257900.db2.gz USYSLKJSXYUKTO-NRSPTQNISA-N 1 3 349.563 2.935 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@@H](C)C3)C[C@@]2(C)C1 ZINC001441338690 1391257904 /nfs/dbraw/zinc/25/79/04/1391257904.db2.gz USYSLKJSXYUKTO-NRSPTQNISA-N 1 3 349.563 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](Cc3ccsc3)C[C@H]2C1 ZINC001441341845 1391259305 /nfs/dbraw/zinc/25/93/05/1391259305.db2.gz QEZGWCVJPCWFCT-RCCFBDPRSA-N 1 3 349.544 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccsc3)C[C@H]2C1 ZINC001441341845 1391259308 /nfs/dbraw/zinc/25/93/08/1391259308.db2.gz QEZGWCVJPCWFCT-RCCFBDPRSA-N 1 3 349.544 2.805 10 0 EFAEHO Cc1cccc(C[N@H+]2CCC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001441578011 1391372147 /nfs/dbraw/zinc/37/21/47/1391372147.db2.gz XHSMTJLKIBGIIJ-IBGZPJMESA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1cccc(C[N@@H+]2CCC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001441578011 1391372151 /nfs/dbraw/zinc/37/21/51/1391372151.db2.gz XHSMTJLKIBGIIJ-IBGZPJMESA-N 1 3 331.504 2.663 10 0 EFAEHO C[C@@H]1[C@H](NCc2cccc(Cl)c2F)CCN1C(=O)CC[NH+](C)C ZINC001441823531 1391420425 /nfs/dbraw/zinc/42/04/25/1391420425.db2.gz NFSSFPLSVVBWTA-IUODEOHRSA-N 1 3 341.858 2.510 10 0 EFAEHO Cc1ncccc1CN[C@@H](C)CNC(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001441875371 1391428137 /nfs/dbraw/zinc/42/81/37/1391428137.db2.gz NJPWGPVKYBSZDQ-HNNXBMFYSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1ncccc1CN[C@@H](C)CNC(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001441875371 1391428139 /nfs/dbraw/zinc/42/81/39/1391428139.db2.gz NJPWGPVKYBSZDQ-HNNXBMFYSA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+]Cc1ccc(Cl)cc1 ZINC001444436626 1391491225 /nfs/dbraw/zinc/49/12/25/1391491225.db2.gz JJIHKTRWWVFHFQ-CQSZACIVSA-N 1 3 325.884 2.522 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@]1(C)CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001446618602 1391560531 /nfs/dbraw/zinc/56/05/31/1391560531.db2.gz XGQPWMOEFDTYLH-ICSRJNTNSA-N 1 3 349.494 2.938 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1C[NH2+]CC1CCCC1 ZINC001446973308 1391649256 /nfs/dbraw/zinc/64/92/56/1391649256.db2.gz PNGLJTRNETYJIY-WMZOPIPTSA-N 1 3 337.552 2.839 10 0 EFAEHO C[N@H+](CCCc1ccccc1)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001447770182 1391755850 /nfs/dbraw/zinc/75/58/50/1391755850.db2.gz NQLMXRFIZCJQLO-HXUWFJFHSA-N 1 3 343.515 2.638 10 0 EFAEHO C[N@@H+](CCCc1ccccc1)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001447770182 1391755853 /nfs/dbraw/zinc/75/58/53/1391755853.db2.gz NQLMXRFIZCJQLO-HXUWFJFHSA-N 1 3 343.515 2.638 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccsc1)[C@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001447848074 1391780596 /nfs/dbraw/zinc/78/05/96/1391780596.db2.gz LQLBYYWEHKLIGE-CABCVRRESA-N 1 3 337.533 2.995 10 0 EFAEHO COc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)cc1 ZINC001447894271 1391793944 /nfs/dbraw/zinc/79/39/44/1391793944.db2.gz XLQRXEWXJMSYDX-CVEARBPZSA-N 1 3 347.503 2.552 10 0 EFAEHO Cc1ccc(CN(C)[C@H](C)CNC(=O)[C@H]2CCC[N@H+]2C(C)C)cc1F ZINC001448035545 1391905988 /nfs/dbraw/zinc/90/59/88/1391905988.db2.gz LSVUUGNYWPLMSW-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(CN(C)[C@H](C)CNC(=O)[C@H]2CCC[N@@H+]2C(C)C)cc1F ZINC001448035545 1391905991 /nfs/dbraw/zinc/90/59/91/1391905991.db2.gz LSVUUGNYWPLMSW-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)[C@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001448062100 1391925976 /nfs/dbraw/zinc/92/59/76/1391925976.db2.gz AIUOSHHTQFGHJX-GOSISDBHSA-N 1 3 345.531 2.848 10 0 EFAEHO Cc1ccc(CC[N@H+](C)[C@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001448062100 1391925979 /nfs/dbraw/zinc/92/59/79/1391925979.db2.gz AIUOSHHTQFGHJX-GOSISDBHSA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)N(C)Cc1ccc(C(C)(C)C)cc1 ZINC001448141656 1391985065 /nfs/dbraw/zinc/98/50/65/1391985065.db2.gz ASMCNRLAABMMFC-FUHWJXTLSA-N 1 3 345.531 2.872 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(C(C)(C)C)cc1 ZINC001448141656 1391985072 /nfs/dbraw/zinc/98/50/72/1391985072.db2.gz ASMCNRLAABMMFC-FUHWJXTLSA-N 1 3 345.531 2.872 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C[NH2+]Cc2ccccc2)CCCCC1 ZINC001448239309 1392043071 /nfs/dbraw/zinc/04/30/71/1392043071.db2.gz XFIIFESZKKGEIL-UHFFFAOYSA-N 1 3 331.504 2.936 10 0 EFAEHO Cc1ccc(F)cc1CN1CCCCC[C@H]1CNC(=O)CC[NH+](C)C ZINC001448268948 1392069299 /nfs/dbraw/zinc/06/92/99/1392069299.db2.gz SLZNSRKYQDUIRV-IBGZPJMESA-N 1 3 349.494 2.947 10 0 EFAEHO C[NH+](C)CCc1cccc(C(=O)NC[C@@H]2CCCCN2C2CC2)c1 ZINC001449062792 1392246170 /nfs/dbraw/zinc/24/61/70/1392246170.db2.gz HRGRFLXILRZHEI-IBGZPJMESA-N 1 3 329.488 2.537 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H]2CC[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001449068471 1392249534 /nfs/dbraw/zinc/24/95/34/1392249534.db2.gz WFGQIYTXQFYHFD-OALUTQOASA-N 1 3 331.504 2.710 10 0 EFAEHO CN(C)C1(C(=O)N(C)[C@@H](C[NH2+]CC2CC3(CCC3)C2)C2CC2)CCC1 ZINC001507013530 1406589189 /nfs/dbraw/zinc/58/91/89/1406589189.db2.gz YJYWXELUUCJREL-SFHVURJKSA-N 1 3 347.547 2.878 10 0 EFAEHO C[C@H](CN(C)C(=O)CC[C@H]1CCC[N@@H+]1C)NCc1ccccc1F ZINC001507085841 1406683520 /nfs/dbraw/zinc/68/35/20/1406683520.db2.gz PJNNVDKMMYVEII-NVXWUHKLSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CN(C)C(=O)CC[C@H]1CCC[N@H+]1C)NCc1ccccc1F ZINC001507085841 1406683523 /nfs/dbraw/zinc/68/35/23/1406683523.db2.gz PJNNVDKMMYVEII-NVXWUHKLSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)N(C)C ZINC001457074738 1394956149 /nfs/dbraw/zinc/95/61/49/1394956149.db2.gz YMPWHFJZOBUCJX-FYQPLNBISA-N 1 3 343.515 2.744 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)N(C)C ZINC001457074738 1394956156 /nfs/dbraw/zinc/95/61/56/1394956156.db2.gz YMPWHFJZOBUCJX-FYQPLNBISA-N 1 3 343.515 2.744 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccco1 ZINC001457819153 1395345827 /nfs/dbraw/zinc/34/58/27/1395345827.db2.gz ZIDREDURCZMTRI-VVLHAWIVSA-N 1 3 335.492 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001507163290 1406794784 /nfs/dbraw/zinc/79/47/84/1406794784.db2.gz UGWWJEFTEOPLJR-CABCVRRESA-N 1 3 333.467 2.589 10 0 EFAEHO NC(=O)C[C@H]1CCN(CCC[NH+]2CCC(Cc3ccccc3)CC2)C1 ZINC001460197338 1396012295 /nfs/dbraw/zinc/01/22/95/1396012295.db2.gz MJRJJTISXRKSNQ-HXUWFJFHSA-N 1 3 343.515 2.529 10 0 EFAEHO NC(=O)C[C@@H]1CCN(CCC[NH+]2CCC(Cc3ccccc3)CC2)C1 ZINC001460197335 1396012441 /nfs/dbraw/zinc/01/24/41/1396012441.db2.gz MJRJJTISXRKSNQ-FQEVSTJZSA-N 1 3 343.515 2.529 10 0 EFAEHO C[C@H](C[NH+]1CCCCC1)NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC001464074807 1396544995 /nfs/dbraw/zinc/54/49/95/1396544995.db2.gz XCXUZHOJXJEGRL-OAHLLOKOSA-N 1 3 328.460 2.895 10 0 EFAEHO Cc1ccc(CN(CCN(C)C)C(=O)[C@H]2CCC[C@H]([NH+](C)C)C2)o1 ZINC001464636603 1396592162 /nfs/dbraw/zinc/59/21/62/1396592162.db2.gz MOZWLRLYRQUQQK-IRXDYDNUSA-N 1 3 335.492 2.599 10 0 EFAEHO CCN(C(=O)[C@H](C)CC[NH+](C)C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001466678057 1396771702 /nfs/dbraw/zinc/77/17/02/1396771702.db2.gz BVJWNHKYAOSQSU-IEBWSBKVSA-N 1 3 331.504 2.697 10 0 EFAEHO CCN(C(=O)[C@H](C)CC[NH+](C)C)[C@H]1CCN(Cc2ccccc2)C1 ZINC001466678058 1396772024 /nfs/dbraw/zinc/77/20/24/1396772024.db2.gz BVJWNHKYAOSQSU-MJGOQNOKSA-N 1 3 331.504 2.697 10 0 EFAEHO C[C@H]1[C@H]([NH2+]CCCCC(F)(F)F)CCN1C(=O)CN(C)C1CCC1 ZINC001507284033 1406847050 /nfs/dbraw/zinc/84/70/50/1406847050.db2.gz OICSIVOCVHFYFU-DZGCQCFKSA-N 1 3 349.441 2.782 10 0 EFAEHO COc1ccc([C@@H](CN(C)C)NC(=O)[C@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC001467936228 1396911286 /nfs/dbraw/zinc/91/12/86/1396911286.db2.gz KVKKNUIHFIZNGE-PKOBYXMFSA-N 1 3 347.503 2.535 10 0 EFAEHO COc1ccc([C@@H](CN(C)C)NC(=O)[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC001467936228 1396911289 /nfs/dbraw/zinc/91/12/89/1396911289.db2.gz KVKKNUIHFIZNGE-PKOBYXMFSA-N 1 3 347.503 2.535 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)CCN1Cc1ccccc1 ZINC001468705924 1396981447 /nfs/dbraw/zinc/98/14/47/1396981447.db2.gz ZFXOBQQIONMYKB-MDNKFWRPSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)CCN1Cc1ccccc1 ZINC001468705924 1396981452 /nfs/dbraw/zinc/98/14/52/1396981452.db2.gz ZFXOBQQIONMYKB-MDNKFWRPSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1C ZINC001470775485 1397120949 /nfs/dbraw/zinc/12/09/49/1397120949.db2.gz DFXVNAJSEFIDEN-YQVWRLOYSA-N 1 3 331.504 2.601 10 0 EFAEHO CC[C@@H](C)[C@H]1CCCCN1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001470772507 1397120993 /nfs/dbraw/zinc/12/09/93/1397120993.db2.gz PYIYPAWCENJFIF-FGTMMUONSA-N 1 3 340.556 2.869 10 0 EFAEHO CC[C@@H](C)[C@H]1CCCCN1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001470772507 1397121000 /nfs/dbraw/zinc/12/10/00/1397121000.db2.gz PYIYPAWCENJFIF-FGTMMUONSA-N 1 3 340.556 2.869 10 0 EFAEHO C[C@H]1C[C@@H](N(C)CCc2ccc3c(c2)OC(F)(F)O3)CC[N@@H+]1C ZINC001473210107 1397290263 /nfs/dbraw/zinc/29/02/63/1397290263.db2.gz CIBAFWNFOAERCX-JSGCOSHPSA-N 1 3 326.387 2.965 10 0 EFAEHO C[C@H]1C[C@@H](N(C)CCc2ccc3c(c2)OC(F)(F)O3)CC[N@H+]1C ZINC001473210107 1397290266 /nfs/dbraw/zinc/29/02/66/1397290266.db2.gz CIBAFWNFOAERCX-JSGCOSHPSA-N 1 3 326.387 2.965 10 0 EFAEHO CN(C)[C@H](CNC(=O)C[N@@H+]1CCC[C@H](C2CCC2)C1)c1ccccc1 ZINC001473656890 1397318820 /nfs/dbraw/zinc/31/88/20/1397318820.db2.gz ALQHTERCFGSDNB-VQTJNVASSA-N 1 3 343.515 2.918 10 0 EFAEHO CN(C)[C@H](CNC(=O)C[N@H+]1CCC[C@H](C2CCC2)C1)c1ccccc1 ZINC001473656890 1397318826 /nfs/dbraw/zinc/31/88/26/1397318826.db2.gz ALQHTERCFGSDNB-VQTJNVASSA-N 1 3 343.515 2.918 10 0 EFAEHO CC[C@]1(C(=O)OC(C)(C)C)CCC[N@H+](C[C@H](O)CN(C)C(C)C)C1 ZINC001473847972 1397339367 /nfs/dbraw/zinc/33/93/67/1397339367.db2.gz NLEIZZZMESYRAL-APWZRJJASA-N 1 3 342.524 2.521 10 0 EFAEHO CC[C@]1(C(=O)OC(C)(C)C)CCC[N@@H+](C[C@H](O)CN(C)C(C)C)C1 ZINC001473847972 1397339371 /nfs/dbraw/zinc/33/93/71/1397339371.db2.gz NLEIZZZMESYRAL-APWZRJJASA-N 1 3 342.524 2.521 10 0 EFAEHO CC[C@]1(C(=O)OC(C)(C)C)CCC[N@H+](C[C@@H](O)CN(C)C(C)C)C1 ZINC001473847973 1397339399 /nfs/dbraw/zinc/33/93/99/1397339399.db2.gz NLEIZZZMESYRAL-LPHOPBHVSA-N 1 3 342.524 2.521 10 0 EFAEHO CC[C@]1(C(=O)OC(C)(C)C)CCC[N@@H+](C[C@@H](O)CN(C)C(C)C)C1 ZINC001473847973 1397339404 /nfs/dbraw/zinc/33/94/04/1397339404.db2.gz NLEIZZZMESYRAL-LPHOPBHVSA-N 1 3 342.524 2.521 10 0 EFAEHO CN(C)c1ccccc1CN1CCC(O)(C[NH+]2CCCCC2)CC1 ZINC001473874733 1397342287 /nfs/dbraw/zinc/34/22/87/1397342287.db2.gz FOVQZBNGHLMQJT-UHFFFAOYSA-N 1 3 331.504 2.565 10 0 EFAEHO Cc1cnc(CCN2CCC(O)(C[NH+]3CCCCC3)CC2)c(C)c1 ZINC001473877000 1397342970 /nfs/dbraw/zinc/34/29/70/1397342970.db2.gz QUXOETKNESSQMT-UHFFFAOYSA-N 1 3 331.504 2.554 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@H](C)N(C(=O)C3(C[NH+](C)C)CC3)C2)c1 ZINC001507321784 1406886549 /nfs/dbraw/zinc/88/65/49/1406886549.db2.gz QLLOVXSMFFHNTB-RDJZCZTQSA-N 1 3 347.478 2.555 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CC/C=C\c2ccccc2)CN1C(=O)Cc1c[nH]cn1 ZINC001507329268 1406893657 /nfs/dbraw/zinc/89/36/57/1406893657.db2.gz ZUWUWVNJFXILMV-XCPAHUIFSA-N 1 3 338.455 2.635 10 0 EFAEHO CC(C)[C@H]1CCCCCN1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001478958110 1397597228 /nfs/dbraw/zinc/59/72/28/1397597228.db2.gz ZPTYPTUKMLLSGR-ZWKOTPCHSA-N 1 3 340.556 2.869 10 0 EFAEHO CC(C)[C@H]1CCCCCN1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001478958110 1397597231 /nfs/dbraw/zinc/59/72/31/1397597231.db2.gz ZPTYPTUKMLLSGR-ZWKOTPCHSA-N 1 3 340.556 2.869 10 0 EFAEHO CN1CCC[C@@H]1CNC(=O)N1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC001478991060 1397599896 /nfs/dbraw/zinc/59/98/96/1397599896.db2.gz ZHQIKWGWUWRMEK-MRXNPFEDSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@@H]([NH2+]CC2CC3(CCC3)C2)C1)N1CCCC1 ZINC001479315946 1397681060 /nfs/dbraw/zinc/68/10/60/1397681060.db2.gz RMYUGHZORAUFBY-MAEOIBBWSA-N 1 3 347.547 2.926 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2=CCCCC2)C1 ZINC001479346890 1397697964 /nfs/dbraw/zinc/69/79/64/1397697964.db2.gz JCUQDJUDTGUKKF-AMBYYYRHSA-N 1 3 333.520 2.844 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC001479346185 1397698012 /nfs/dbraw/zinc/69/80/12/1397698012.db2.gz DKFPWBTWXVGOON-CTTJMJGYSA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+][C@@H](C)c2cccc(F)c2)C1 ZINC001479415526 1397719889 /nfs/dbraw/zinc/71/98/89/1397719889.db2.gz CXISNFKWOFNJAG-MPGHIAIKSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@H+](C)Cc1ccc2c(c1)CCC2)N(C)C ZINC001479777392 1397845586 /nfs/dbraw/zinc/84/55/86/1397845586.db2.gz NWSRRQYCLKJBIU-FQEVSTJZSA-N 1 3 345.531 2.700 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@@H+](C)Cc1ccc2c(c1)CCC2)N(C)C ZINC001479777392 1397845588 /nfs/dbraw/zinc/84/55/88/1397845588.db2.gz NWSRRQYCLKJBIU-FQEVSTJZSA-N 1 3 345.531 2.700 10 0 EFAEHO CN(CCCNC(=O)C1(C[NH+](C)C)CC1)Cc1ccc(Cl)s1 ZINC001479791794 1397868112 /nfs/dbraw/zinc/86/81/12/1397868112.db2.gz IVQSIEUWMDNOBZ-UHFFFAOYSA-N 1 3 343.924 2.681 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](C)Cc1ccc(C)cc1 ZINC001479816279 1397911816 /nfs/dbraw/zinc/91/18/16/1397911816.db2.gz SEGHFCIPKIRIJL-IBGZPJMESA-N 1 3 331.504 2.808 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](C)Cc1ccc(C)cc1 ZINC001479816279 1397911818 /nfs/dbraw/zinc/91/18/18/1397911818.db2.gz SEGHFCIPKIRIJL-IBGZPJMESA-N 1 3 331.504 2.808 10 0 EFAEHO Cc1cccnc1C[NH2+][C@@H](C)[C@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001479835862 1397931384 /nfs/dbraw/zinc/93/13/84/1397931384.db2.gz YFQNQRZHDHKWAZ-PKOBYXMFSA-N 1 3 346.519 2.589 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@]12CCC[C@@H]1N(Cc1cccc(F)c1)CC2 ZINC001507346930 1406923130 /nfs/dbraw/zinc/92/31/30/1406923130.db2.gz FVYBMFOQZLVIJB-AZUAARDMSA-N 1 3 347.478 2.781 10 0 EFAEHO CC[N@H+](CCCNC(=O)Cc1nc[nH]c1C)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001479859169 1397961967 /nfs/dbraw/zinc/96/19/67/1397961967.db2.gz IHZFLUGYMJKEFX-IXDOHACOSA-N 1 3 332.492 2.525 10 0 EFAEHO CC[N@@H+](CCCNC(=O)Cc1nc[nH]c1C)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001479859169 1397961972 /nfs/dbraw/zinc/96/19/72/1397961972.db2.gz IHZFLUGYMJKEFX-IXDOHACOSA-N 1 3 332.492 2.525 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](CC)[C@@H]1CCc2ccccc21)N(C)C ZINC001479859379 1397962236 /nfs/dbraw/zinc/96/22/36/1397962236.db2.gz DTPVZVPAPKZUBY-RBUKOAKNSA-N 1 3 331.504 2.842 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](CC)[C@@H]1CCc2ccccc21)N(C)C ZINC001479859379 1397962239 /nfs/dbraw/zinc/96/22/39/1397962239.db2.gz DTPVZVPAPKZUBY-RBUKOAKNSA-N 1 3 331.504 2.842 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(C[C@H]2NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001479984713 1398070016 /nfs/dbraw/zinc/07/00/16/1398070016.db2.gz HJVRXCMYRXORTH-BTFXCVNISA-N 1 3 335.536 2.900 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]([NH2+]CCC1CCCCC1)C1CC1 ZINC001480063507 1398108387 /nfs/dbraw/zinc/10/83/87/1398108387.db2.gz QMIUXWYUJPWLTI-SFHVURJKSA-N 1 3 332.492 2.715 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@H]([NH2+]CCCCC(F)(F)F)C1 ZINC001480172248 1398142243 /nfs/dbraw/zinc/14/22/43/1398142243.db2.gz PERZBXHRYJCETK-BIQWYFBQSA-N 1 3 349.441 2.829 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1C[NH2+]CCc1ccccc1F ZINC001480366660 1398180758 /nfs/dbraw/zinc/18/07/58/1398180758.db2.gz BRWNDRXGIFHZMZ-GOSISDBHSA-N 1 3 349.494 2.679 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001480679969 1398279128 /nfs/dbraw/zinc/27/91/28/1398279128.db2.gz FLMNOMOVSBCSSM-AEFFLSMTSA-N 1 3 331.504 2.846 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1C(=O)N1CC[C@@H](CNC/C(Cl)=C/Cl)C1 ZINC001480681323 1398279859 /nfs/dbraw/zinc/27/98/59/1398279859.db2.gz YPTRJYIWKDDYTO-DJRMKIQDSA-N 1 3 348.318 2.618 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1C(=O)N1CC[C@@H](CNC/C(Cl)=C/Cl)C1 ZINC001480681323 1398279864 /nfs/dbraw/zinc/27/98/64/1398279864.db2.gz YPTRJYIWKDDYTO-DJRMKIQDSA-N 1 3 348.318 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+][C@H]2CCc3c2cccc3F)C1 ZINC001480683172 1398280522 /nfs/dbraw/zinc/28/05/22/1398280522.db2.gz KOPHPJRZWCROGX-BEFAXECRSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+][C@H]2CCc3c2cccc3F)C1 ZINC001480683179 1398280669 /nfs/dbraw/zinc/28/06/69/1398280669.db2.gz KOPHPJRZWCROGX-KXBFYZLASA-N 1 3 347.478 2.591 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)[C@@H]1CCc2c1cccc2F ZINC001493042338 1398386651 /nfs/dbraw/zinc/38/66/51/1398386651.db2.gz BTGSRTAYWDGHNL-DNVCBOLYSA-N 1 3 347.478 2.593 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)[C@@H]1CCc2c1cccc2F ZINC001493042338 1398386658 /nfs/dbraw/zinc/38/66/58/1398386658.db2.gz BTGSRTAYWDGHNL-DNVCBOLYSA-N 1 3 347.478 2.593 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C(C)C)C[C@H]1CCc2ccccc2C1 ZINC001493061842 1398405511 /nfs/dbraw/zinc/40/55/11/1398405511.db2.gz IJKSFNHNKHIHRR-SFHVURJKSA-N 1 3 345.531 2.570 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C(C)C)C[C@H]1CCc2ccccc2C1 ZINC001493061842 1398405514 /nfs/dbraw/zinc/40/55/14/1398405514.db2.gz IJKSFNHNKHIHRR-SFHVURJKSA-N 1 3 345.531 2.570 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1CCN(Cc2cccc(F)c2)C1)[NH+](CC)CC ZINC001493237760 1398554889 /nfs/dbraw/zinc/55/48/89/1398554889.db2.gz SOJHOXIDVMZKRY-HKUYNNGSSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CC[N@H+](CC3CCC(C)(C)CC3)C2)C1 ZINC001493240998 1398557695 /nfs/dbraw/zinc/55/76/95/1398557695.db2.gz YEWOLLLIQNKARR-MJGOQNOKSA-N 1 3 349.563 2.983 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2CC[N@@H+](CC3CCC(C)(C)CC3)C2)C1 ZINC001493240998 1398557697 /nfs/dbraw/zinc/55/76/97/1398557697.db2.gz YEWOLLLIQNKARR-MJGOQNOKSA-N 1 3 349.563 2.983 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H]1CC[N@H+](CCCCCF)C1 ZINC001493242274 1398558270 /nfs/dbraw/zinc/55/82/70/1398558270.db2.gz ZKUODLBPKVRSMH-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H]1CC[N@@H+](CCCCCF)C1 ZINC001493242274 1398558275 /nfs/dbraw/zinc/55/82/75/1398558275.db2.gz ZKUODLBPKVRSMH-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC001493265944 1398573287 /nfs/dbraw/zinc/57/32/87/1398573287.db2.gz AKZCUYJEZQAWBZ-HOTGVXAUSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC001493265944 1398573291 /nfs/dbraw/zinc/57/32/91/1398573291.db2.gz AKZCUYJEZQAWBZ-HOTGVXAUSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC001493265941 1398573356 /nfs/dbraw/zinc/57/33/56/1398573356.db2.gz AKZCUYJEZQAWBZ-CVEARBPZSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+](CC[C@@H]2CCCC2(F)F)C1 ZINC001493265941 1398573357 /nfs/dbraw/zinc/57/33/57/1398573357.db2.gz AKZCUYJEZQAWBZ-CVEARBPZSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[N@@H+](CC[C@H](C)F)C1CC1 ZINC001493424703 1398696880 /nfs/dbraw/zinc/69/68/80/1398696880.db2.gz VJWSRQHYUFDDRG-RDJZCZTQSA-N 1 3 327.488 2.578 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[N@H+](CC[C@H](C)F)C1CC1 ZINC001493424703 1398696882 /nfs/dbraw/zinc/69/68/82/1398696882.db2.gz VJWSRQHYUFDDRG-RDJZCZTQSA-N 1 3 327.488 2.578 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001493429290 1398699763 /nfs/dbraw/zinc/69/97/63/1398699763.db2.gz IQTVWTJXEFSOQW-PMACEKPBSA-N 1 3 341.499 2.784 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001493429290 1398699766 /nfs/dbraw/zinc/69/97/66/1398699766.db2.gz IQTVWTJXEFSOQW-PMACEKPBSA-N 1 3 341.499 2.784 10 0 EFAEHO CCc1ccc(C[NH2+]CCN(C)C(=O)CN(C)CC(C)(C)C)cc1 ZINC001493695036 1398814478 /nfs/dbraw/zinc/81/44/78/1398814478.db2.gz CIABOIUDKSVVIC-UHFFFAOYSA-N 1 3 333.520 2.775 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)[C@@H](C)[NH+]2CCCCCC2)c1 ZINC001493716371 1398830648 /nfs/dbraw/zinc/83/06/48/1398830648.db2.gz CQFSKPDZCOAMER-QGZVFWFLSA-N 1 3 349.494 2.947 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N(C)CC[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)c1 ZINC001493803904 1398894624 /nfs/dbraw/zinc/89/46/24/1398894624.db2.gz UTQWEVCSZGWFGD-IMFGXOCKSA-N 1 3 343.515 2.846 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]([NH2+]CC2CCCC2)c2ccccc2)C1 ZINC001493900649 1398965226 /nfs/dbraw/zinc/96/52/26/1398965226.db2.gz ZALUTLFCFZLSLB-YLJYHZDGSA-N 1 3 343.515 2.966 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N1C[C@H]2CC[C@@H](C1)N2CCCCCF ZINC001493931030 1398982826 /nfs/dbraw/zinc/98/28/26/1398982826.db2.gz ZIENISZSDOPDHJ-USTZCAOPSA-N 1 3 339.499 2.674 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N1C[C@H]2CC[C@@H](C1)N2CCCCCF ZINC001493931030 1398982831 /nfs/dbraw/zinc/98/28/31/1398982831.db2.gz ZIENISZSDOPDHJ-USTZCAOPSA-N 1 3 339.499 2.674 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC001494083729 1399122346 /nfs/dbraw/zinc/12/23/46/1399122346.db2.gz QHFWKTBMSLQSHF-MSOLQXFVSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC001494083729 1399122349 /nfs/dbraw/zinc/12/23/49/1399122349.db2.gz QHFWKTBMSLQSHF-MSOLQXFVSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N1CC[C@H](CN(C)C/C=C/Cl)C1 ZINC001494141934 1399163024 /nfs/dbraw/zinc/16/30/24/1399163024.db2.gz PVAFSRWWRUZLMW-QQQVMXRDSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N1CC[C@H](CN(C)C/C=C/Cl)C1 ZINC001494141934 1399163025 /nfs/dbraw/zinc/16/30/25/1399163025.db2.gz PVAFSRWWRUZLMW-QQQVMXRDSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N1CC[C@@H](CN(C)C/C=C/Cl)C1 ZINC001494141933 1399163169 /nfs/dbraw/zinc/16/31/69/1399163169.db2.gz PVAFSRWWRUZLMW-QBUOGWAXSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N1CC[C@@H](CN(C)C/C=C/Cl)C1 ZINC001494141933 1399163171 /nfs/dbraw/zinc/16/31/71/1399163171.db2.gz PVAFSRWWRUZLMW-QBUOGWAXSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@H+](C)Cc2cccc(F)c2)CC1 ZINC001494214989 1399218224 /nfs/dbraw/zinc/21/82/24/1399218224.db2.gz SLEYVJIBFJLFRN-UHFFFAOYSA-N 1 3 349.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@@H+](C)Cc2cccc(F)c2)CC1 ZINC001494214989 1399218225 /nfs/dbraw/zinc/21/82/25/1399218225.db2.gz SLEYVJIBFJLFRN-UHFFFAOYSA-N 1 3 349.494 2.836 10 0 EFAEHO O=C(NCC1C[NH+](CCCCc2ccccc2)C1)C1CC2CCC1O2 ZINC001494596391 1399394019 /nfs/dbraw/zinc/39/40/19/1399394019.db2.gz AQFMVDGTBIDEKN-AQNXPRMDSA-N 1 3 342.483 2.625 10 0 EFAEHO CCC/C=C\CCN1C[C@@H]2C[C@H]1CN2C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001494658379 1399418398 /nfs/dbraw/zinc/41/83/98/1399418398.db2.gz HKVCZQMNCBMQJW-CXLTZZKYSA-N 1 3 333.520 2.892 10 0 EFAEHO CCC/C=C\CCN1C[C@@H]2C[C@H]1CN2C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001494658379 1399418401 /nfs/dbraw/zinc/41/84/01/1399418401.db2.gz HKVCZQMNCBMQJW-CXLTZZKYSA-N 1 3 333.520 2.892 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1)N(C)C ZINC001494723285 1399443544 /nfs/dbraw/zinc/44/35/44/1399443544.db2.gz VGGFELQNXRIICH-OWCLPIDISA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CC[C@H]2CCCC2(F)F)C1)N(C)C ZINC001494723285 1399443547 /nfs/dbraw/zinc/44/35/47/1399443547.db2.gz VGGFELQNXRIICH-OWCLPIDISA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)=CCN1CC[C@@H](N(C)C(=O)[C@H](C(C)C)[NH+]2CCCCC2)C1 ZINC001494873445 1399520294 /nfs/dbraw/zinc/52/02/94/1399520294.db2.gz BQTHXYDJBLOPPK-MOPGFXCFSA-N 1 3 335.536 2.996 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@H]1CCN(Cc2ccc(C)c(C)c2)C1 ZINC001494911616 1399551111 /nfs/dbraw/zinc/55/11/11/1399551111.db2.gz WCDWLTUIAPFMRG-IBGZPJMESA-N 1 3 331.504 2.678 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]CCc1ccc(C)cc1 ZINC001494985617 1399590489 /nfs/dbraw/zinc/59/04/89/1399590489.db2.gz QKNBPSITGKVXFI-PMACEKPBSA-N 1 3 345.531 2.895 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]CCc1ccc(C)cc1 ZINC001494985618 1399590498 /nfs/dbraw/zinc/59/04/98/1399590498.db2.gz QKNBPSITGKVXFI-UXHICEINSA-N 1 3 345.531 2.895 10 0 EFAEHO Cc1cnc(C[NH2+]CC2(NC(=O)C3CC4C=CC3C4)CCCC2)cn1 ZINC001495125723 1399683207 /nfs/dbraw/zinc/68/32/07/1399683207.db2.gz BPTAXZXKKYJIKA-BQFCYCMXSA-N 1 3 340.471 2.516 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@@](C)(C[NH2+]CC2=CCCCC2)C2CC2)C1 ZINC001495278543 1399788362 /nfs/dbraw/zinc/78/83/62/1399788362.db2.gz WHTIFCKWHXGDRU-UZLBHIALSA-N 1 3 333.520 2.703 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N[C@](C)(CNCc2ccccc2F)C2CC2)C1 ZINC001495294873 1399801285 /nfs/dbraw/zinc/80/12/85/1399801285.db2.gz VWXLNCOREVQGTO-FOIQADDNSA-N 1 3 347.478 2.542 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N[C@](C)(CNCc2ccccc2F)C2CC2)C1 ZINC001495294873 1399801295 /nfs/dbraw/zinc/80/12/95/1399801295.db2.gz VWXLNCOREVQGTO-FOIQADDNSA-N 1 3 347.478 2.542 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@@H](NCc2ccccn2)C(C)(C)C1)[NH+](CC)CC ZINC001507446238 1407062473 /nfs/dbraw/zinc/06/24/73/1407062473.db2.gz QWLWKPWREPHKSD-ZWKOTPCHSA-N 1 3 346.519 2.529 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@@H](CC[NH2+]Cc3ccccc3)C2)CCC1 ZINC001495362077 1399907256 /nfs/dbraw/zinc/90/72/56/1399907256.db2.gz DRPDSQQUGPECGS-IBGZPJMESA-N 1 3 343.515 2.889 10 0 EFAEHO CCCC[NH2+]CC[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001495383975 1399930080 /nfs/dbraw/zinc/93/00/80/1399930080.db2.gz ALZXULGXQRYBQG-KRWDZBQOSA-N 1 3 325.541 2.983 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@H](CC[NH2+]CC3CCC3)C2)CC1 ZINC001495376158 1399922125 /nfs/dbraw/zinc/92/21/25/1399922125.db2.gz AGHISOVUMZGPNS-LJQANCHMSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@@H](C)C[NH2+]CC[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001495377152 1399923293 /nfs/dbraw/zinc/92/32/93/1399923293.db2.gz JUGKLXVCVGHQJM-IEBWSBKVSA-N 1 3 337.552 2.983 10 0 EFAEHO CCCN(C)CC(=O)NCCC1CC[NH+](Cc2ccsc2)CC1 ZINC001495536446 1400067171 /nfs/dbraw/zinc/06/71/71/1400067171.db2.gz QRKATERHFWWRBU-UHFFFAOYSA-N 1 3 337.533 2.808 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)C[NH2+]Cc1cc(C)ccc1F ZINC001495680803 1400161762 /nfs/dbraw/zinc/16/17/62/1400161762.db2.gz RLUTVPGHLKGFDT-QFBILLFUSA-N 1 3 349.494 2.850 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)C[NH2+]Cc1cc(C)ccc1F ZINC001495680805 1400161839 /nfs/dbraw/zinc/16/18/39/1400161839.db2.gz RLUTVPGHLKGFDT-VQIMIIECSA-N 1 3 349.494 2.850 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C[C@@H](C)CNC(=O)C2(N(C)C)CCC2)c1 ZINC001495685859 1400166215 /nfs/dbraw/zinc/16/62/15/1400166215.db2.gz XISOSZAJSIBRTA-CVEARBPZSA-N 1 3 347.503 2.582 10 0 EFAEHO C[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C[NH2+]CC1CCCC1 ZINC001495744576 1400220428 /nfs/dbraw/zinc/22/04/28/1400220428.db2.gz XMYAEAJDZMYOIE-BEFAXECRSA-N 1 3 341.515 2.731 10 0 EFAEHO C[C@H](C[NH2+]C/C=C\c1ccc(Cl)cc1)N(C)C(=O)[C@@H]1CCCN1C ZINC001496027331 1400423470 /nfs/dbraw/zinc/42/34/70/1400423470.db2.gz HUBHSZYAYXYZIP-MTWCHYJXSA-N 1 3 349.906 2.884 10 0 EFAEHO C[C@@H](C[NH2+]CC1CC(C)(C)C1)N(C)C(=O)CN(C)CC(C)(C)C ZINC001496153319 1400505973 /nfs/dbraw/zinc/50/59/73/1400505973.db2.gz HCRVQSRAMHSDBW-HNNXBMFYSA-N 1 3 325.541 2.837 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001496156422 1400507923 /nfs/dbraw/zinc/50/79/23/1400507923.db2.gz YCKJUQQSDYPBAO-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@H](CN[C@@H](C)c1ccccc1Cl)N(C)C(=O)C12CC[NH+](CC1)C2 ZINC001496207534 1400540108 /nfs/dbraw/zinc/54/01/08/1400540108.db2.gz QNFMTGRYSBRQJF-CABCVRRESA-N 1 3 349.906 2.933 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C(F)F)cc1)N(C)C(=O)CN1CCCC1 ZINC001496229498 1400556046 /nfs/dbraw/zinc/55/60/46/1400556046.db2.gz ISBOGGFUJSNVQM-CQSZACIVSA-N 1 3 339.430 2.657 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+][C@H]1CCc2c1cccc2F ZINC001496251151 1400572580 /nfs/dbraw/zinc/57/25/80/1400572580.db2.gz UBADHRFYRDNARP-KSSFIOAISA-N 1 3 335.467 2.590 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CC2CC3(CCC3)C2)[C@H](C)C1 ZINC001496366768 1400675880 /nfs/dbraw/zinc/67/58/80/1400675880.db2.gz FUQIYTFCCVYSAB-SJLPKXTDSA-N 1 3 335.536 2.735 10 0 EFAEHO CC1CCN(CC(=O)N2CCCC[C@H]2CC[NH2+]C/C=C/Cl)CC1 ZINC001496412731 1400714719 /nfs/dbraw/zinc/71/47/19/1400714719.db2.gz CPDXIPLPYMWSOC-QVNOTHCHSA-N 1 3 341.927 2.832 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@@H]1CC[NH2+]CC1CC(F)(F)C1)N(C)C ZINC001496417847 1400719444 /nfs/dbraw/zinc/71/94/44/1400719444.db2.gz CHMPGCNWQIBAHG-HZPDHXFCSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H](C)[NH2+]CCc2ccccc2)C1 ZINC001496457934 1400743708 /nfs/dbraw/zinc/74/37/08/1400743708.db2.gz ASSGYOBFPHKGAZ-ICSRJNTNSA-N 1 3 345.531 2.786 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1cccc(F)c1)C(C)C ZINC001496565134 1400832405 /nfs/dbraw/zinc/83/24/05/1400832405.db2.gz HSLPIKCPAVNULW-RTBURBONSA-N 1 3 349.494 2.931 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1ccsc1)C(C)C ZINC001496567612 1400832897 /nfs/dbraw/zinc/83/28/97/1400832897.db2.gz SMGNWNLQRIXCFY-SJORKVTESA-N 1 3 337.533 2.853 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]([NH2+]CC1CCC2(CC2)CC1)C(C)C ZINC001496626005 1400880495 /nfs/dbraw/zinc/88/04/95/1400880495.db2.gz ADKNLNXATLKTEU-SFHVURJKSA-N 1 3 346.519 2.961 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1ccccc1F)C(C)C ZINC001496640726 1400892574 /nfs/dbraw/zinc/89/25/74/1400892574.db2.gz CGMXFRZWNULWFN-OALUTQOASA-N 1 3 349.494 2.931 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21)CC1=CCCCC1 ZINC001496731312 1400947074 /nfs/dbraw/zinc/94/70/74/1400947074.db2.gz OBHCXWGYKBLUML-OALUTQOASA-N 1 3 333.520 2.894 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21)CC1=CCCCC1 ZINC001496731312 1400947078 /nfs/dbraw/zinc/94/70/78/1400947078.db2.gz OBHCXWGYKBLUML-OALUTQOASA-N 1 3 333.520 2.894 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[N@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001496825084 1401011747 /nfs/dbraw/zinc/01/17/47/1401011747.db2.gz OIBPHBOKKWCRCN-GOSISDBHSA-N 1 3 345.531 2.524 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[N@@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001496825084 1401011755 /nfs/dbraw/zinc/01/17/55/1401011755.db2.gz OIBPHBOKKWCRCN-GOSISDBHSA-N 1 3 345.531 2.524 10 0 EFAEHO Cc1ccc(CC[NH2+]CC[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001497206934 1401219427 /nfs/dbraw/zinc/21/94/27/1401219427.db2.gz WHVGSPAXMVEMOR-KRWDZBQOSA-N 1 3 331.504 2.506 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1C ZINC001497271145 1401260465 /nfs/dbraw/zinc/26/04/65/1401260465.db2.gz JRVUUEIWUBIJOS-CRAIPNDOSA-N 1 3 331.504 2.630 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1C ZINC001497271148 1401260982 /nfs/dbraw/zinc/26/09/82/1401260982.db2.gz JRVUUEIWUBIJOS-YJBOKZPZSA-N 1 3 331.504 2.630 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(Cl)cc1)C(=O)[C@H](C(C)C)N(C)C ZINC001497407150 1401352950 /nfs/dbraw/zinc/35/29/50/1401352950.db2.gz WGUXSBDSNGTVEU-KRWDZBQOSA-N 1 3 339.911 2.864 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)C1CC[NH+](CC2CC2)CC1 ZINC001497483119 1401408224 /nfs/dbraw/zinc/40/82/24/1401408224.db2.gz USVWHRAFIMBOME-UHFFFAOYSA-N 1 3 349.544 2.808 10 0 EFAEHO CC[C@H]([NH2+]C/C=C\CNC(=O)[C@@H]1CCCN1C)c1ccc(F)cc1 ZINC001497550303 1401450487 /nfs/dbraw/zinc/45/04/87/1401450487.db2.gz YQUSFIUOQMUMLQ-VMLVWOMUSA-N 1 3 333.451 2.633 10 0 EFAEHO CC(C)(C(=O)NC/C=C\CNCc1ccsc1)[NH+]1CCCCC1 ZINC001497580677 1401470722 /nfs/dbraw/zinc/47/07/22/1401470722.db2.gz WRNFDXKTVNEJNJ-PLNGDYQASA-N 1 3 335.517 2.775 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)NC/C=C\CNCc1ccc(F)cc1 ZINC001497690562 1401554673 /nfs/dbraw/zinc/55/46/73/1401554673.db2.gz GYNUTXDBYMLTAU-PHWHVTFISA-N 1 3 347.478 2.851 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)NC/C=C\CNCc1ccc(F)cc1 ZINC001497690562 1401554674 /nfs/dbraw/zinc/55/46/74/1401554674.db2.gz GYNUTXDBYMLTAU-PHWHVTFISA-N 1 3 347.478 2.851 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/CNCc1ccsc1)[NH+]1CCCC1 ZINC001497762560 1401631666 /nfs/dbraw/zinc/63/16/66/1401631666.db2.gz ISKGLDJBOXVRQF-REMYHPOOSA-N 1 3 335.517 2.631 10 0 EFAEHO C[C@H](CNCc1ccccc1F)NC(=O)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001497827154 1401680931 /nfs/dbraw/zinc/68/09/31/1401680931.db2.gz HMXYMROHYDPDNQ-DNVCBOLYSA-N 1 3 347.478 2.827 10 0 EFAEHO C[C@H](CNCc1ccccc1F)NC(=O)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001497827154 1401680939 /nfs/dbraw/zinc/68/09/39/1401680939.db2.gz HMXYMROHYDPDNQ-DNVCBOLYSA-N 1 3 347.478 2.827 10 0 EFAEHO C[C@H](C[NH2+]CC1=CCCCC1)NC(=O)c1cccc(CN(C)C)c1 ZINC001497990676 1401796647 /nfs/dbraw/zinc/79/66/47/1401796647.db2.gz PSIRHYZIQLDXJC-MRXNPFEDSA-N 1 3 329.488 2.957 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]CCCCC(F)(F)F ZINC001497993258 1401798696 /nfs/dbraw/zinc/79/86/96/1401798696.db2.gz NTLGHVIBVGWJJS-KGLIPLIRSA-N 1 3 337.430 2.688 10 0 EFAEHO CCC(CC)C[NH2+]C[C@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001498118249 1401864626 /nfs/dbraw/zinc/86/46/26/1401864626.db2.gz QAUPIIPRWBIELA-KBXCAEBGSA-N 1 3 329.504 2.729 10 0 EFAEHO C[C@H](C[N@H+](C)CC1CC2(CCC2)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001498358106 1402035482 /nfs/dbraw/zinc/03/54/82/1402035482.db2.gz WUYJNYNLPUAXRX-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](C[N@@H+](C)CC1CC2(CCC2)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001498358106 1402035485 /nfs/dbraw/zinc/03/54/85/1402035485.db2.gz WUYJNYNLPUAXRX-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](C[N@H+](C)CC1CCCC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001498380183 1402054331 /nfs/dbraw/zinc/05/43/31/1402054331.db2.gz FIWFERFXNMZVCF-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC1CCCC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001498380183 1402054335 /nfs/dbraw/zinc/05/43/35/1402054335.db2.gz FIWFERFXNMZVCF-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(F)c(Cl)c1)C(=O)[C@H]1CCCN1C ZINC001498525756 1402160385 /nfs/dbraw/zinc/16/03/85/1402160385.db2.gz FGJSGKSJYNKCKK-MRXNPFEDSA-N 1 3 341.858 2.511 10 0 EFAEHO Cc1cc(C[NH2+]CCCN(C)C(=O)CN(C)CC(C)(C)C)cs1 ZINC001498612446 1402201076 /nfs/dbraw/zinc/20/10/76/1402201076.db2.gz IUTPBAHTWYQMTG-UHFFFAOYSA-N 1 3 339.549 2.973 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CC[N@@H+]1CC1CCCC1)N1CCCCC1 ZINC001499128473 1402487287 /nfs/dbraw/zinc/48/72/87/1402487287.db2.gz XMJNBZKUUZWUFV-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CC[N@H+]1CC1CCCC1)N1CCCCC1 ZINC001499128473 1402487290 /nfs/dbraw/zinc/48/72/90/1402487290.db2.gz XMJNBZKUUZWUFV-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](NC1(CNC(=O)CC[C@@H]2CCC[N@@H+]2C)CC1)c1cccc(F)c1 ZINC001499253690 1402539540 /nfs/dbraw/zinc/53/95/40/1402539540.db2.gz GQXBXJDNXSJHBW-QAPCUYQASA-N 1 3 347.478 3.000 10 0 EFAEHO C[C@@H](NC1(CNC(=O)CC[C@@H]2CCC[N@H+]2C)CC1)c1cccc(F)c1 ZINC001499253690 1402539544 /nfs/dbraw/zinc/53/95/44/1402539544.db2.gz GQXBXJDNXSJHBW-QAPCUYQASA-N 1 3 347.478 3.000 10 0 EFAEHO Cc1ccc(CC[NH2+]C2(CNC(=O)CN3[C@@H](C)CC[C@@H]3C)CC2)cc1 ZINC001499462113 1402625525 /nfs/dbraw/zinc/62/55/25/1402625525.db2.gz YXZXWLISNMNMNA-ROUUACIJSA-N 1 3 343.515 2.649 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@H+](C/C=C\Cl)C1 ZINC001499480468 1402635087 /nfs/dbraw/zinc/63/50/87/1402635087.db2.gz HCLFVIIHWNFFAX-REEAJDFCSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@@H+](C/C=C\Cl)C1 ZINC001499480468 1402635090 /nfs/dbraw/zinc/63/50/90/1402635090.db2.gz HCLFVIIHWNFFAX-REEAJDFCSA-N 1 3 341.927 2.782 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCN(CCF)C2CCCCCC2)CC[N@@H+]1C ZINC001499522455 1402658770 /nfs/dbraw/zinc/65/87/70/1402658770.db2.gz IRTRWZGGDLPFBA-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCN(CCF)C2CCCCCC2)CC[N@H+]1C ZINC001499522455 1402658775 /nfs/dbraw/zinc/65/87/75/1402658775.db2.gz IRTRWZGGDLPFBA-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(C1)CC[NH+](CC1CCCC1)CC2 ZINC001499590877 1402704617 /nfs/dbraw/zinc/70/46/17/1402704617.db2.gz ZPSFMNUUPHSVKB-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001499616788 1402721442 /nfs/dbraw/zinc/72/14/42/1402721442.db2.gz UAGNFZSMAAMLHK-DUIUGDAFSA-N 1 3 335.536 2.999 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001499616788 1402721445 /nfs/dbraw/zinc/72/14/45/1402721445.db2.gz UAGNFZSMAAMLHK-DUIUGDAFSA-N 1 3 335.536 2.999 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)cc1 ZINC001499857232 1402823775 /nfs/dbraw/zinc/82/37/75/1402823775.db2.gz IQUXBIKAWCHJAN-AZUAARDMSA-N 1 3 345.531 2.847 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H]2C[NH2+]CCCc2ccsc2)C1 ZINC001499927141 1402857649 /nfs/dbraw/zinc/85/76/49/1402857649.db2.gz YMIUSFZDOBWOPM-SJLPKXTDSA-N 1 3 349.544 2.603 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)C1CCN(Cc2ccc(F)cc2)CC1 ZINC001508089949 1407291611 /nfs/dbraw/zinc/29/16/11/1407291611.db2.gz XRLISJJRHUTMQR-INIZCTEOSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)C1CCN(Cc2ccc(F)cc2)CC1 ZINC001508089949 1407291617 /nfs/dbraw/zinc/29/16/17/1407291617.db2.gz XRLISJJRHUTMQR-INIZCTEOSA-N 1 3 349.494 2.884 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@](C)(C[NH2+]CCCF)C2)c1 ZINC001500405170 1403102011 /nfs/dbraw/zinc/10/20/11/1403102011.db2.gz RRUGNTHEWLGJBM-LJQANCHMSA-N 1 3 335.467 2.550 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCC1(C)CCN(C/C=C/Cl)CC1 ZINC001500431181 1403117993 /nfs/dbraw/zinc/11/79/93/1403117993.db2.gz MQWRCFVWGYWXHA-IGKXFLDPSA-N 1 3 341.927 2.832 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCC1(C)CCN(C/C=C/Cl)CC1 ZINC001500431181 1403117998 /nfs/dbraw/zinc/11/79/98/1403117998.db2.gz MQWRCFVWGYWXHA-IGKXFLDPSA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]Cc2cc3ccccc3o2)C1 ZINC001508153953 1407316996 /nfs/dbraw/zinc/31/69/96/1407316996.db2.gz CSFRIAYVVVEWEP-UHFFFAOYSA-N 1 3 343.471 2.852 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2ccc(C)c(C)c2)C1 ZINC001501150418 1403460361 /nfs/dbraw/zinc/46/03/61/1403460361.db2.gz RBLBRBVBUNBNFA-ICSRJNTNSA-N 1 3 345.531 2.829 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001501152815 1403462322 /nfs/dbraw/zinc/46/23/22/1403462322.db2.gz FFXVRCKSYBPSIT-HKUYNNGSSA-N 1 3 331.504 2.519 10 0 EFAEHO C[C@H](F)CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1(N(C)C)CCC1)C2 ZINC001501165953 1403469678 /nfs/dbraw/zinc/46/96/78/1403469678.db2.gz BHVOUMKNRIERLX-NXOAAHMSSA-N 1 3 339.499 2.578 10 0 EFAEHO C[C@H](F)CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1(N(C)C)CCC1)C2 ZINC001501165953 1403469682 /nfs/dbraw/zinc/46/96/82/1403469682.db2.gz BHVOUMKNRIERLX-NXOAAHMSSA-N 1 3 339.499 2.578 10 0 EFAEHO CCC[NH+]1CCC(N(Cc2ccccn2)C(=O)CN(C)C(C)C)CC1 ZINC001501202788 1403490533 /nfs/dbraw/zinc/49/05/33/1403490533.db2.gz CBCYRDDIGWTCOH-UHFFFAOYSA-N 1 3 346.519 2.625 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@H]1CCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001501577724 1403634140 /nfs/dbraw/zinc/63/41/40/1403634140.db2.gz CKMZLTDTEXLLRH-ICSRJNTNSA-N 1 3 345.531 2.909 10 0 EFAEHO CC(C)C[N@@H+]1CCc2c(CNC(=O)CN3CC[C@@H](C)C3)cccc2C1 ZINC001501854584 1403829625 /nfs/dbraw/zinc/82/96/25/1403829625.db2.gz XKHFPLUPMRRUGR-QGZVFWFLSA-N 1 3 343.515 2.659 10 0 EFAEHO CC(C)C[N@H+]1CCc2c(CNC(=O)CN3CC[C@@H](C)C3)cccc2C1 ZINC001501854584 1403829629 /nfs/dbraw/zinc/82/96/29/1403829629.db2.gz XKHFPLUPMRRUGR-QGZVFWFLSA-N 1 3 343.515 2.659 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1CCC[C@H](NC(=O)CN(C)C(C)C)CC1 ZINC001502147461 1404047669 /nfs/dbraw/zinc/04/76/69/1404047669.db2.gz JRDYFDWXIUCIMT-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1CCC[C@H](NC(=O)CN(C)C(C)C)CC1 ZINC001502147461 1404047675 /nfs/dbraw/zinc/04/76/75/1404047675.db2.gz JRDYFDWXIUCIMT-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(CC)([NH2+]Cc2cccnc2C)CC1 ZINC001502513454 1404212880 /nfs/dbraw/zinc/21/28/80/1404212880.db2.gz MWYMSNDMXSVTOW-UHFFFAOYSA-N 1 3 346.519 2.593 10 0 EFAEHO CCC1([NH2+]CC2=CCCCC2)CCN(C(=O)CN2CCCC2)CC1 ZINC001502515901 1404213170 /nfs/dbraw/zinc/21/31/70/1404213170.db2.gz REJGTAWNZRCHDK-UHFFFAOYSA-N 1 3 333.520 2.943 10 0 EFAEHO CCC1([NH2+]Cc2ccc(F)cc2)CCN(C(=O)CN2CCCC2)CC1 ZINC001502515904 1404213667 /nfs/dbraw/zinc/21/36/67/1404213667.db2.gz RIRTYDAFMRAIMG-UHFFFAOYSA-N 1 3 347.478 2.782 10 0 EFAEHO CC(C)=CC[NH2+][C@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@H]1C ZINC001502759534 1404329025 /nfs/dbraw/zinc/32/90/25/1404329025.db2.gz IIIYQZAVHKDRQT-APWZRJJASA-N 1 3 329.488 2.765 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+][C@H](C)c1cc(F)ccc1F)N(C)C ZINC001503290609 1404479494 /nfs/dbraw/zinc/47/94/94/1404479494.db2.gz KOWOFRRBILXGNU-OGHNNQOOSA-N 1 3 341.446 2.850 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CCCF ZINC001505414737 1404573830 /nfs/dbraw/zinc/57/38/30/1404573830.db2.gz RKGNPDMLRZZZTD-GUDVDZBRSA-N 1 3 347.478 2.592 10 0 EFAEHO CC(C)CCC[NH2+][C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)[C@@H]1C ZINC001725561261 1425649612 /nfs/dbraw/zinc/64/96/12/1425649612.db2.gz ASQZBZWZLPJTGE-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)CN(C)C3CCC3)C2)cc1C ZINC001505501764 1404729537 /nfs/dbraw/zinc/72/95/37/1404729537.db2.gz IRYNQHKZJYITOV-UHFFFAOYSA-N 1 3 343.515 2.772 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@H](C)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001505621379 1404863448 /nfs/dbraw/zinc/86/34/48/1404863448.db2.gz GPRDGKQNHXZZSP-SJORKVTESA-N 1 3 345.531 2.759 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001505621814 1404864314 /nfs/dbraw/zinc/86/43/14/1404864314.db2.gz LXDSKCKIFFFSKR-UONOGXRCSA-N 1 3 337.895 2.807 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@H](C)[NH2+]Cc1cccc(F)c1 ZINC001505667278 1404915324 /nfs/dbraw/zinc/91/53/24/1404915324.db2.gz KKAZYJWSWHQSLR-LSDHHAIUSA-N 1 3 335.467 2.683 10 0 EFAEHO C[C@@H](NC(=O)CCC[NH+](C)C)[C@H](C)NCc1ccc(Cl)cc1F ZINC001505677081 1404926902 /nfs/dbraw/zinc/92/69/02/1404926902.db2.gz CWTLYDMWFRBOFZ-QWHCGFSZSA-N 1 3 343.874 2.804 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)CC(C)(C)C)cc1 ZINC001505694214 1404948500 /nfs/dbraw/zinc/94/85/00/1404948500.db2.gz LICIUCFPUKBFRU-ZWKOTPCHSA-N 1 3 347.547 2.998 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)[C@H](C)NCc1ccc(C)cc1Cl ZINC001505723450 1404983649 /nfs/dbraw/zinc/98/36/49/1404983649.db2.gz AHJYUHUJSYRNAZ-LSDHHAIUSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)[C@H](C)NCc1ccc(C)cc1Cl ZINC001505723450 1404983656 /nfs/dbraw/zinc/98/36/56/1404983656.db2.gz AHJYUHUJSYRNAZ-LSDHHAIUSA-N 1 3 339.911 2.973 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1cc(C)sc1C ZINC001505736558 1405003637 /nfs/dbraw/zinc/00/36/37/1405003637.db2.gz UVEIDTSLRGKCIW-KGLIPLIRSA-N 1 3 325.522 2.690 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1cccc(OC)c1 ZINC001505930516 1405242028 /nfs/dbraw/zinc/24/20/28/1405242028.db2.gz JTAINQNCVIFSHI-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](C)N(C)Cc1cccc(OC)c1 ZINC001505930516 1405242031 /nfs/dbraw/zinc/24/20/31/1405242031.db2.gz JTAINQNCVIFSHI-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)[C@H]1CCc2c1cccc2F ZINC001506065584 1405425485 /nfs/dbraw/zinc/42/54/85/1405425485.db2.gz RNXIHFCLQOHLFK-KDOFPFPSSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)[C@H]1CCc2c1cccc2F ZINC001506065584 1405425487 /nfs/dbraw/zinc/42/54/87/1405425487.db2.gz RNXIHFCLQOHLFK-KDOFPFPSSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCF ZINC001506480615 1405824693 /nfs/dbraw/zinc/82/46/93/1405824693.db2.gz OXKLCXLRVCDXMG-CRAIPNDOSA-N 1 3 347.494 2.631 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NC2(CNCc3ccccc3F)CCCCC2)C1 ZINC001506525724 1405908214 /nfs/dbraw/zinc/90/82/14/1405908214.db2.gz MJRWDOHNBWDWCH-KRWDZBQOSA-N 1 3 347.478 2.686 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NC2(CNCc3ccccc3F)CCCCC2)C1 ZINC001506525724 1405908219 /nfs/dbraw/zinc/90/82/19/1405908219.db2.gz MJRWDOHNBWDWCH-KRWDZBQOSA-N 1 3 347.478 2.686 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@H](C)C1C[NH+](Cc2ccccc2C)C1 ZINC001506621635 1406054697 /nfs/dbraw/zinc/05/46/97/1406054697.db2.gz YJJMKVFMKMECHQ-QFBILLFUSA-N 1 3 349.494 2.611 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H](C)C1C[NH+](Cc2ccccc2C)C1 ZINC001506621626 1406055250 /nfs/dbraw/zinc/05/52/50/1406055250.db2.gz YJJMKVFMKMECHQ-APWZRJJASA-N 1 3 349.494 2.611 10 0 EFAEHO C/C=C\C[C@H]1CCCN(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)C1 ZINC001565055607 1415388806 /nfs/dbraw/zinc/38/88/06/1415388806.db2.gz GXPGIGVBOSSGQD-LUNNPTDRSA-N 1 3 338.540 2.646 10 0 EFAEHO C/C=C\C[C@H]1CCCN(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)C1 ZINC001565055607 1415388809 /nfs/dbraw/zinc/38/88/09/1415388809.db2.gz GXPGIGVBOSSGQD-LUNNPTDRSA-N 1 3 338.540 2.646 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@H]1CC[NH2+]C/C=C/Cl ZINC001565942912 1415461062 /nfs/dbraw/zinc/46/10/62/1415461062.db2.gz IGAZPJCRPCMGCW-HKFHSAMXSA-N 1 3 329.916 2.686 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)[C@H](C(C)C)N(C)C)C[C@@H]2C1 ZINC001566052727 1415494144 /nfs/dbraw/zinc/49/41/44/1415494144.db2.gz KDLYLFPAMRFRHB-ZIGQXYKSSA-N 1 3 335.536 2.709 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)[C@H](C(C)C)N(C)C)C[C@@H]2C1 ZINC001566052727 1415494145 /nfs/dbraw/zinc/49/41/45/1415494145.db2.gz KDLYLFPAMRFRHB-ZIGQXYKSSA-N 1 3 335.536 2.709 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)[C@H]1C ZINC001566103192 1415515403 /nfs/dbraw/zinc/51/54/03/1415515403.db2.gz AKISBYSUXHGVKQ-JTDSTZFVSA-N 1 3 341.515 2.968 10 0 EFAEHO CCCCC[N@H+]1CC[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)[C@H]1C ZINC001566103192 1415515405 /nfs/dbraw/zinc/51/54/05/1415515405.db2.gz AKISBYSUXHGVKQ-JTDSTZFVSA-N 1 3 341.515 2.968 10 0 EFAEHO CCc1ccc(C[N@H+](C)CCCNC(=O)C2(N(C)C)CCC2)cc1 ZINC001566461154 1415560911 /nfs/dbraw/zinc/56/09/11/1415560911.db2.gz QBIPSQNXPGGHJC-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO CCc1ccc(C[N@@H+](C)CCCNC(=O)C2(N(C)C)CCC2)cc1 ZINC001566461154 1415560913 /nfs/dbraw/zinc/56/09/13/1415560913.db2.gz QBIPSQNXPGGHJC-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@H+](C)[C@@H]2CCCc3ccccc32)CCC1 ZINC001566461222 1415561387 /nfs/dbraw/zinc/56/13/87/1415561387.db2.gz SGLQTZPWDJQZFB-LJQANCHMSA-N 1 3 343.515 2.986 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@@H+](C)[C@@H]2CCCc3ccccc32)CCC1 ZINC001566461222 1415561391 /nfs/dbraw/zinc/56/13/91/1415561391.db2.gz SGLQTZPWDJQZFB-LJQANCHMSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@H+](C)[C@@H](C)c1ccc(F)cc1)N(C)C ZINC001566462935 1415562366 /nfs/dbraw/zinc/56/23/66/1415562366.db2.gz FRLZESJSOAJCAZ-YJBOKZPZSA-N 1 3 337.483 2.911 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@@H+](C)[C@@H](C)c1ccc(F)cc1)N(C)C ZINC001566462935 1415562368 /nfs/dbraw/zinc/56/23/68/1415562368.db2.gz FRLZESJSOAJCAZ-YJBOKZPZSA-N 1 3 337.483 2.911 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@H+](C)[C@H](C)c1ccc(F)cc1)N(C)C ZINC001566462934 1415562533 /nfs/dbraw/zinc/56/25/33/1415562533.db2.gz FRLZESJSOAJCAZ-QAPCUYQASA-N 1 3 337.483 2.911 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@@H+](C)[C@H](C)c1ccc(F)cc1)N(C)C ZINC001566462934 1415562535 /nfs/dbraw/zinc/56/25/35/1415562535.db2.gz FRLZESJSOAJCAZ-QAPCUYQASA-N 1 3 337.483 2.911 10 0 EFAEHO Cc1ccc(CN(C)CCCNC(=O)CC[C@@H]2CCC[N@@H+]2C)c(C)n1 ZINC001566463096 1415563135 /nfs/dbraw/zinc/56/31/35/1415563135.db2.gz KQQWAFPRWOWXIO-IBGZPJMESA-N 1 3 346.519 2.511 10 0 EFAEHO Cc1ccc(CN(C)CCCNC(=O)CC[C@@H]2CCC[N@H+]2C)c(C)n1 ZINC001566463096 1415563137 /nfs/dbraw/zinc/56/31/37/1415563137.db2.gz KQQWAFPRWOWXIO-IBGZPJMESA-N 1 3 346.519 2.511 10 0 EFAEHO C[C@H](c1ccccc1F)N(CCCNC(=O)[C@@H]1CC[N@H+](C)C1)C1CC1 ZINC001566602895 1415688212 /nfs/dbraw/zinc/68/82/12/1415688212.db2.gz SCJCUVBUTFCDTK-HZPDHXFCSA-N 1 3 347.478 2.809 10 0 EFAEHO C[C@H](c1ccccc1F)N(CCCNC(=O)[C@@H]1CC[N@@H+](C)C1)C1CC1 ZINC001566602895 1415688218 /nfs/dbraw/zinc/68/82/18/1415688218.db2.gz SCJCUVBUTFCDTK-HZPDHXFCSA-N 1 3 347.478 2.809 10 0 EFAEHO CN(CC(=O)N1CC[C@H]([NH2+]CC/C=C\c2ccccc2)C1)C1CCC1 ZINC001566766739 1415768631 /nfs/dbraw/zinc/76/86/31/1415768631.db2.gz MJLBGFWDFVKTNC-AJWDXOCTSA-N 1 3 341.499 2.765 10 0 EFAEHO CC/C=C\CC[NH2+][C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001566779401 1415772504 /nfs/dbraw/zinc/77/25/04/1415772504.db2.gz YVROFBXHINLVQW-VOFKWLDRSA-N 1 3 329.488 2.909 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H]([NH2+]CCCc2ccsc2)C1)N(C)C ZINC001566811702 1415782804 /nfs/dbraw/zinc/78/28/04/1415782804.db2.gz XHEPWDJNJADZDK-ULQDDVLXSA-N 1 3 337.533 2.504 10 0 EFAEHO CC(C)CCC[NH2+][C@H]1C[C@@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001566852103 1415799278 /nfs/dbraw/zinc/79/92/78/1415799278.db2.gz KNVZQKBWVUHFPC-JTDSTZFVSA-N 1 3 341.515 2.872 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@@H]1CCCN(Cc2ccsc2)C1 ZINC001566879656 1415821105 /nfs/dbraw/zinc/82/11/05/1415821105.db2.gz QXVTXJCVWGOHDX-INIZCTEOSA-N 1 3 337.533 2.808 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H](C[NH2+]CCc2ccccc2)C1)N(C)C ZINC001566903698 1415834614 /nfs/dbraw/zinc/83/46/14/1415834614.db2.gz SIJDMAXJDDTLSS-VQTJNVASSA-N 1 3 345.531 2.644 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001566908431 1415836879 /nfs/dbraw/zinc/83/68/79/1415836879.db2.gz MTVLZKFJSXJSGP-HMECNJMJSA-N 1 3 335.536 2.903 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001566908432 1415837106 /nfs/dbraw/zinc/83/71/06/1415837106.db2.gz MTVLZKFJSXJSGP-PHWHVTFISA-N 1 3 335.536 2.903 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](C[NH2+]CC/C=C\c2ccccc2)C1 ZINC001567153953 1415955295 /nfs/dbraw/zinc/95/52/95/1415955295.db2.gz YJAFQMSBZALPOG-YMUVJOOCSA-N 1 3 341.499 2.624 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001567155531 1415955942 /nfs/dbraw/zinc/95/59/42/1415955942.db2.gz REQFJFHWWUULTC-DOTOQJQBSA-N 1 3 335.467 2.548 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@H]1CCC[N@@H+]1CCC(F)(F)F)N(C)C ZINC001567254862 1416025421 /nfs/dbraw/zinc/02/54/21/1416025421.db2.gz RTGBRDRELAZAAZ-UONOGXRCSA-N 1 3 337.430 2.640 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@H]1CCC[N@H+]1CCC(F)(F)F)N(C)C ZINC001567254862 1416025429 /nfs/dbraw/zinc/02/54/29/1416025429.db2.gz RTGBRDRELAZAAZ-UONOGXRCSA-N 1 3 337.430 2.640 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1CCC(F)(F)F)N(C)C ZINC001567254863 1416025532 /nfs/dbraw/zinc/02/55/32/1416025532.db2.gz RTGBRDRELAZAAZ-ZIAGYGMSSA-N 1 3 337.430 2.640 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@@H]1CCC[N@H+]1CCC(F)(F)F)N(C)C ZINC001567254863 1416025535 /nfs/dbraw/zinc/02/55/35/1416025535.db2.gz RTGBRDRELAZAAZ-ZIAGYGMSSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@H+](CC2=CCCCC2)C1)N1CCCC1 ZINC001567406742 1416120568 /nfs/dbraw/zinc/12/05/68/1416120568.db2.gz VSTAWVTYMWOCLG-GOSISDBHSA-N 1 3 333.520 2.799 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[N@@H+](CC2=CCCCC2)C1)N1CCCC1 ZINC001567406742 1416120577 /nfs/dbraw/zinc/12/05/77/1416120577.db2.gz VSTAWVTYMWOCLG-GOSISDBHSA-N 1 3 333.520 2.799 10 0 EFAEHO CN(CCNCc1cc(Cl)cc(Cl)c1)C(=O)CCC[NH+](C)C ZINC001567552256 1416183542 /nfs/dbraw/zinc/18/35/42/1416183542.db2.gz UZAISZVSMKEQKI-UHFFFAOYSA-N 1 3 346.302 2.883 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]Cc1ccc2c(c1)CCC2 ZINC001567611700 1416209781 /nfs/dbraw/zinc/20/97/81/1416209781.db2.gz RRCSKMSULGVNAR-FQEVSTJZSA-N 1 3 343.515 2.598 10 0 EFAEHO CC(C)(C(=O)NCC1C[NH+](CCC2=CCCCC2)C1)N1CCCC1 ZINC001567835744 1416293704 /nfs/dbraw/zinc/29/37/04/1416293704.db2.gz IRLLRNNJHOHKKH-UHFFFAOYSA-N 1 3 333.520 2.799 10 0 EFAEHO C[C@H](C(=O)N[C@@](C)(C[NH2+]C/C=C/Cl)C1CC1)N1CCCCCC1 ZINC001568029506 1416366164 /nfs/dbraw/zinc/36/61/64/1416366164.db2.gz UIEAOZARTHITHT-DPHZFHMASA-N 1 3 341.927 2.878 10 0 EFAEHO CC(C)=CC[NH2+]CC[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001568070684 1416393667 /nfs/dbraw/zinc/39/36/67/1416393667.db2.gz VNTVDKXWZYLXNZ-IBGZPJMESA-N 1 3 335.536 2.903 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](CC[NH2+]Cc2ccccc2F)C1 ZINC001568073849 1416396377 /nfs/dbraw/zinc/39/63/77/1416396377.db2.gz VRELAGYIFFOLDV-KRWDZBQOSA-N 1 3 349.494 2.886 10 0 EFAEHO CC1CC(C[NH2+]CCC2CCN(C(=O)C3(N(C)C)CCC3)CC2)C1 ZINC001568087670 1416403982 /nfs/dbraw/zinc/40/39/82/1416403982.db2.gz JJVGIXHSTPSTSF-UHFFFAOYSA-N 1 3 335.536 2.735 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC(CC[NH2+]CC2=CCCCC2)CC1 ZINC001568094661 1416407275 /nfs/dbraw/zinc/40/72/75/1416407275.db2.gz JYMMULABXBSZFX-UHFFFAOYSA-N 1 3 330.476 2.671 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(CC[NH2+]C/C=C/Cl)CC1 ZINC001568097456 1416408948 /nfs/dbraw/zinc/40/89/48/1416408948.db2.gz BGOZDDLROLIPTM-HQWZXOHUSA-N 1 3 341.927 2.832 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]C/C=C\c1ccccc1 ZINC001568176747 1416433680 /nfs/dbraw/zinc/43/36/80/1416433680.db2.gz XQIVEJLBXAAUDK-GJBHZFNWSA-N 1 3 329.488 2.526 10 0 EFAEHO CC(C)CCC[NH2+]C[C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001568193618 1416437199 /nfs/dbraw/zinc/43/71/99/1416437199.db2.gz HJSBFLLCZBTPGI-QFBILLFUSA-N 1 3 343.531 2.977 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@H](C)C[NH2+]CCc1ccccc1 ZINC001568197419 1416438718 /nfs/dbraw/zinc/43/87/18/1416438718.db2.gz UNIMUJGRANLOHW-ICSRJNTNSA-N 1 3 345.531 2.834 10 0 EFAEHO C[C@@H](C[NH2+]CCCCc1ccccc1)N(C)C(=O)[C@@H]1CCCN1C ZINC001568262423 1416459557 /nfs/dbraw/zinc/45/95/57/1416459557.db2.gz JFXAEBYLCUOMRD-HKUYNNGSSA-N 1 3 331.504 2.540 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H](C)C[NH2+]C/C=C\c1ccccc1)N(C)C ZINC001568280078 1416464397 /nfs/dbraw/zinc/46/43/97/1416464397.db2.gz WTJXDXVRTWGUEC-AHSCJQSNSA-N 1 3 331.504 2.723 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)CC(C)(C)C)CC[C@@H]1[NH2+]CCCCCF ZINC001568364786 1416493931 /nfs/dbraw/zinc/49/39/31/1416493931.db2.gz IGOOPRDFQUTNRM-SJORKVTESA-N 1 3 343.531 2.931 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCCC[C@@H]2CC[NH2+]CC2CCCC2)C1 ZINC001568393704 1416510944 /nfs/dbraw/zinc/51/09/44/1416510944.db2.gz QWHJQHAAZYPCHE-PKOBYXMFSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@@H]1CC[NH2+]Cc1cccnc1C)N(C)C ZINC001568398103 1416514312 /nfs/dbraw/zinc/51/43/12/1416514312.db2.gz OCZAMTPSLPJQFJ-MOPGFXCFSA-N 1 3 346.519 2.591 10 0 EFAEHO CCN(CC[NH2+]Cc1ncc(C)s1)C(=O)C1CCCC(F)C1 ZINC001568742313 1416545400 /nfs/dbraw/zinc/54/54/00/1416545400.db2.gz QCMJVYCYMHLYCR-KGLIPLIRSA-N 1 3 327.469 2.918 10 0 EFAEHO CCN(CC[NH2+]Cc1ccn(C(C)C)n1)C(=O)C1CCCC(F)C1 ZINC001568742231 1416545423 /nfs/dbraw/zinc/54/54/23/1416545423.db2.gz OCHJAQATFHCTTD-CVEARBPZSA-N 1 3 338.471 2.930 10 0 EFAEHO Cc1cc(C[N@@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C)c(C)s1 ZINC001689808298 1417073360 /nfs/dbraw/zinc/07/33/60/1417073360.db2.gz CJOFUMJYTXESBY-KRWDZBQOSA-N 1 3 339.549 2.889 10 0 EFAEHO Cc1cc(C[N@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C)c(C)s1 ZINC001689808298 1417073363 /nfs/dbraw/zinc/07/33/63/1417073363.db2.gz CJOFUMJYTXESBY-KRWDZBQOSA-N 1 3 339.549 2.889 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1CCC[N@H+](CCCCCF)C1 ZINC001690037901 1417139937 /nfs/dbraw/zinc/13/99/37/1417139937.db2.gz UTIBOXMGIBIHSN-DLBZAZTESA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1CCC[N@@H+](CCCCCF)C1 ZINC001690037901 1417139941 /nfs/dbraw/zinc/13/99/41/1417139941.db2.gz UTIBOXMGIBIHSN-DLBZAZTESA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CCC[N@H+](CCCCCF)C1 ZINC001690037902 1417140261 /nfs/dbraw/zinc/14/02/61/1417140261.db2.gz UTIBOXMGIBIHSN-IAGOWNOFSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CCC[N@@H+](CCCCCF)C1 ZINC001690037902 1417140266 /nfs/dbraw/zinc/14/02/66/1417140266.db2.gz UTIBOXMGIBIHSN-IAGOWNOFSA-N 1 3 327.488 2.580 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(C[C@@H]2NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001690127960 1417160696 /nfs/dbraw/zinc/16/06/96/1417160696.db2.gz HJVRXCMYRXORTH-VUOWKATKSA-N 1 3 335.536 2.900 10 0 EFAEHO CCCN(C(=O)C[C@@H]1CC[N@H+](C)C1)C1CCN(CC=C(C)C)CC1 ZINC001690138818 1417163969 /nfs/dbraw/zinc/16/39/69/1417163969.db2.gz QJTTYZPCPKMJFL-SFHVURJKSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCN(C(=O)C[C@@H]1CC[N@@H+](C)C1)C1CCN(CC=C(C)C)CC1 ZINC001690138818 1417163974 /nfs/dbraw/zinc/16/39/74/1417163974.db2.gz QJTTYZPCPKMJFL-SFHVURJKSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CC[C@H]([NH2+]CCCCCF)C2)C1 ZINC001690246793 1417178512 /nfs/dbraw/zinc/17/85/12/1417178512.db2.gz WWEOCBDLGBJNRJ-MAUKXSAKSA-N 1 3 345.478 2.529 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1=CCCCC1)N(C)C ZINC001690312304 1417188521 /nfs/dbraw/zinc/18/85/21/1417188521.db2.gz LMFZCMKAQMMERS-XVLXNVKGSA-N 1 3 333.520 2.939 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1=CCCCC1)N(C)C ZINC001690312304 1417188522 /nfs/dbraw/zinc/18/85/22/1417188522.db2.gz LMFZCMKAQMMERS-XVLXNVKGSA-N 1 3 333.520 2.939 10 0 EFAEHO C[C@@H](C[NH2+]CC/C=C/c1ccccc1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001698845774 1417339099 /nfs/dbraw/zinc/33/90/99/1417339099.db2.gz OLKCIWYNMIMLJF-ZWQQMPCFSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@@H](CC[NH2+]C/C=C\c1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001699133618 1417398293 /nfs/dbraw/zinc/39/82/93/1417398293.db2.gz FKZKJPXITKCBRR-UVFSVYEVSA-N 1 3 329.488 2.526 10 0 EFAEHO C[C@@H](CC[NH2+]CC=C(Cl)Cl)NC(=O)CN(C)CC(C)(C)C ZINC001699134234 1417399696 /nfs/dbraw/zinc/39/96/96/1417399696.db2.gz VEOJZHVHDZMVGL-LBPRGKRZSA-N 1 3 338.323 2.768 10 0 EFAEHO CCN(CC[NH2+]Cc1cc2ccccc2o1)C(=O)[C@H]1CCCCN1C ZINC001699187280 1417412395 /nfs/dbraw/zinc/41/23/95/1417412395.db2.gz LWRNFWLUCISCJF-GOSISDBHSA-N 1 3 343.471 2.855 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC/C=C/CNCc1cccc(Cl)c1 ZINC001699269649 1417415887 /nfs/dbraw/zinc/41/58/87/1417415887.db2.gz ABOXZYKFIFBYBZ-DCKQQPRJSA-N 1 3 349.906 2.976 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC/C=C/CNCc1cccc(Cl)c1 ZINC001699269649 1417415889 /nfs/dbraw/zinc/41/58/89/1417415889.db2.gz ABOXZYKFIFBYBZ-DCKQQPRJSA-N 1 3 349.906 2.976 10 0 EFAEHO CN(CCC[NH2+][C@@H]1CCCc2ccccc21)C(=O)[C@H]1CCCN1C ZINC001699500341 1417426779 /nfs/dbraw/zinc/42/67/79/1417426779.db2.gz TWSZTAWUKCYJEA-RTBURBONSA-N 1 3 329.488 2.596 10 0 EFAEHO CC/C=C\CCN1CC[C@@H]1CNC(=O)c1ccc(C[NH+](C)C)cc1 ZINC001699632490 1417439790 /nfs/dbraw/zinc/43/97/90/1417439790.db2.gz LTSBZYBZVZQHHL-SFFCAUCYSA-N 1 3 329.488 2.909 10 0 EFAEHO C[C@H]([NH2+]CCCCC(F)(F)F)[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001699950604 1417520083 /nfs/dbraw/zinc/52/00/83/1417520083.db2.gz DYLYDGYDAQJCOK-GJZGRUSLSA-N 1 3 349.441 2.641 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@H](C[NH2+]C/C=C/Cl)CC1 ZINC001699981595 1417536524 /nfs/dbraw/zinc/53/65/24/1417536524.db2.gz KHGWTRYQDCJWDL-OYHUUDPBSA-N 1 3 338.883 2.525 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001700093546 1417564550 /nfs/dbraw/zinc/56/45/50/1417564550.db2.gz LJORYYFYQYZLHS-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001700686272 1417614619 /nfs/dbraw/zinc/61/46/19/1417614619.db2.gz YCRGJENZZLHKEW-TZMCWYRMSA-N 1 3 342.434 2.571 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1C[C@@H](NC(=O)CN2CC[C@@H](C)C2)C1 ZINC001713201234 1418373724 /nfs/dbraw/zinc/37/37/24/1418373724.db2.gz MUHCAOOTQSWUFY-AHRSYUTCSA-N 1 3 343.515 2.506 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC001713221392 1418394525 /nfs/dbraw/zinc/39/45/25/1418394525.db2.gz IAYVBLWCSGTWBH-SFHVURJKSA-N 1 3 349.494 2.886 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001713266236 1418433105 /nfs/dbraw/zinc/43/31/05/1418433105.db2.gz NPVODXMSEUITLU-HOTGVXAUSA-N 1 3 329.504 2.683 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[C@@H]1CCC[N@@H+]1CCCF ZINC001713442164 1418538424 /nfs/dbraw/zinc/53/84/24/1418538424.db2.gz HYDISLIQFQICPN-IAGOWNOFSA-N 1 3 327.488 2.581 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[C@@H]1CCC[N@H+]1CCCF ZINC001713442164 1418538426 /nfs/dbraw/zinc/53/84/26/1418538426.db2.gz HYDISLIQFQICPN-IAGOWNOFSA-N 1 3 327.488 2.581 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H](CC[NH2+]Cc3ccccc3)C2)C1 ZINC001714224990 1418589845 /nfs/dbraw/zinc/58/98/45/1418589845.db2.gz KAINBZNZENEVQX-UYAOXDASSA-N 1 3 343.515 2.747 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccccc1F)NC(=O)CN(C)CC(C)(C)C ZINC001716174507 1418713515 /nfs/dbraw/zinc/71/35/15/1418713515.db2.gz SYHKFXUCKMTDJR-OAHLLOKOSA-N 1 3 337.483 2.788 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001716174365 1418713538 /nfs/dbraw/zinc/71/35/38/1418713538.db2.gz QLRYHWMFZWQQTR-FUHWJXTLSA-N 1 3 331.504 2.630 10 0 EFAEHO CN(CC(=O)NC/C=C\C[NH2+][C@@H]1CCc2ccc(F)cc21)C1CCC1 ZINC001716306001 1418762552 /nfs/dbraw/zinc/76/25/52/1418762552.db2.gz MQIPDOTXKQPTJJ-FFPCURRISA-N 1 3 345.462 2.559 10 0 EFAEHO C[C@H](C[NH2+]CCCc1ccccc1)NC(=O)C(C)(C)N1CCCCC1 ZINC001716395108 1418871452 /nfs/dbraw/zinc/87/14/52/1418871452.db2.gz MNJPIXAYGZRUIE-GOSISDBHSA-N 1 3 345.531 2.978 10 0 EFAEHO C[C@H](C[NH2+]CC/C=C\c1ccccc1)NC(=O)C1(N(C)C)CCC1 ZINC001716399419 1418873682 /nfs/dbraw/zinc/87/36/82/1418873682.db2.gz JKMKJGVLWFTFAK-UUKWBXHYSA-N 1 3 329.488 2.669 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[NH2+]Cc2ccc(Cl)s2)CCC1 ZINC001716546534 1418910069 /nfs/dbraw/zinc/91/00/69/1418910069.db2.gz VVSHEIUFWRYRQS-UHFFFAOYSA-N 1 3 343.924 2.824 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+][C@@H]1CCc2c1cccc2F ZINC001716586686 1418918786 /nfs/dbraw/zinc/91/87/86/1418918786.db2.gz DATRKCLYUPXOHM-GOSISDBHSA-N 1 3 335.467 2.591 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@@H]2CCN2CCCCc2ccccc2)CC[N@@H+]1C ZINC001716650718 1418940008 /nfs/dbraw/zinc/94/00/08/1418940008.db2.gz GTMBAYASIGJOAT-YZGWKJHDSA-N 1 3 343.515 2.540 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@@H]2CCN2CCCCc2ccccc2)CC[N@H+]1C ZINC001716650718 1418940011 /nfs/dbraw/zinc/94/00/11/1418940011.db2.gz GTMBAYASIGJOAT-YZGWKJHDSA-N 1 3 343.515 2.540 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCN1CCC1=CCCCC1 ZINC001716654079 1418942639 /nfs/dbraw/zinc/94/26/39/1418942639.db2.gz VDPZOSIOGBKLPY-RBUKOAKNSA-N 1 3 333.520 2.942 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCN1CCC1=CCCCC1 ZINC001716654079 1418942641 /nfs/dbraw/zinc/94/26/41/1418942641.db2.gz VDPZOSIOGBKLPY-RBUKOAKNSA-N 1 3 333.520 2.942 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC[C@@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001716723450 1418974601 /nfs/dbraw/zinc/97/46/01/1418974601.db2.gz ILUHVAWTMFCSQT-ZRHASKPBSA-N 1 3 330.476 2.623 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC[C@@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001716723450 1418974610 /nfs/dbraw/zinc/97/46/10/1418974610.db2.gz ILUHVAWTMFCSQT-ZRHASKPBSA-N 1 3 330.476 2.623 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2ccccc2)C[C@@H]1C ZINC001716770962 1419000931 /nfs/dbraw/zinc/00/09/31/1419000931.db2.gz PPODWFVBJKTGEI-AZUAARDMSA-N 1 3 345.531 2.930 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H]2C[NH2+]CCCCC(F)(F)F)C1 ZINC001716784194 1419006696 /nfs/dbraw/zinc/00/66/96/1419006696.db2.gz NDSPOVVUQCRFRL-CABCVRRESA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)(C(=O)N1CC[C@@](C)(C[NH2+]C/C=C\Cl)C1)N1CCCCC1 ZINC001716864029 1419062708 /nfs/dbraw/zinc/06/27/08/1419062708.db2.gz DFOYIYYIBJWOKC-CNRGFGOASA-N 1 3 341.927 2.832 10 0 EFAEHO C[C@H]1CN(C(=O)CN2CCC(C)CC2)C[C@H]1C[NH2+]CCC1CCCC1 ZINC001716992155 1419129414 /nfs/dbraw/zinc/12/94/14/1419129414.db2.gz MVPBKKHKRIGBCL-AZUAARDMSA-N 1 3 349.563 2.983 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H]1CC[C@H](CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001717002025 1419137498 /nfs/dbraw/zinc/13/74/98/1419137498.db2.gz OZBCANQMSAHKEG-IYARVYRRSA-N 1 3 335.536 2.949 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@H](C[NH2+]C/C=C/Cl)CC1)N(C)C ZINC001717004283 1419139505 /nfs/dbraw/zinc/13/95/05/1419139505.db2.gz FGACJQWYCCRQHS-MIDHCONTSA-N 1 3 329.916 2.591 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](CC[NH2+]Cc2ccc(CF)cc2)C1 ZINC001717077165 1419189863 /nfs/dbraw/zinc/18/98/63/1419189863.db2.gz XASFXGJDOGOISI-OALUTQOASA-N 1 3 347.478 2.579 10 0 EFAEHO CC1CC(C[NH2+]CC[C@@H]2CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001717099595 1419207709 /nfs/dbraw/zinc/20/77/09/1419207709.db2.gz ZKISXIHBXOKDIS-LXPRWKDFSA-N 1 3 337.552 2.839 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H]1CCC[N@H+](CCCCCF)CC1 ZINC001717195725 1419257311 /nfs/dbraw/zinc/25/73/11/1419257311.db2.gz OXNCHGVZFLRVJF-MSOLQXFVSA-N 1 3 341.515 2.971 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H]1CCC[N@@H+](CCCCCF)CC1 ZINC001717195725 1419257313 /nfs/dbraw/zinc/25/73/13/1419257313.db2.gz OXNCHGVZFLRVJF-MSOLQXFVSA-N 1 3 341.515 2.971 10 0 EFAEHO CCCCCC[NH2+][C@@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1C ZINC001717285419 1419307932 /nfs/dbraw/zinc/30/79/32/1419307932.db2.gz CJERAQGYKKFJNR-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001717292878 1419311402 /nfs/dbraw/zinc/31/14/02/1419311402.db2.gz CDZJYAPUTPNCOF-ICSRJNTNSA-N 1 3 345.531 2.704 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@H]2C[N@H+](C)CCCCCF)CC1 ZINC001717372315 1419364347 /nfs/dbraw/zinc/36/43/47/1419364347.db2.gz GLNDIPHICZXFJZ-SFHVURJKSA-N 1 3 341.515 2.781 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@H]2C[N@@H+](C)CCCCCF)CC1 ZINC001717372315 1419364352 /nfs/dbraw/zinc/36/43/52/1419364352.db2.gz GLNDIPHICZXFJZ-SFHVURJKSA-N 1 3 341.515 2.781 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N(C)CC(C)(C)C[NH2+]C/C=C\Cl ZINC001717459579 1419402891 /nfs/dbraw/zinc/40/28/91/1419402891.db2.gz HMBFCMZJJOLRQL-VUEDLFODSA-N 1 3 329.916 2.686 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@H](NC(=O)C23CCCN2CCC3)C(C)(C)C1 ZINC001717582892 1419455284 /nfs/dbraw/zinc/45/52/84/1419455284.db2.gz RSBSAGXBXBJILM-OSJSJHBBSA-N 1 3 333.520 2.798 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@H](NC(=O)C23CCCN2CCC3)C(C)(C)C1 ZINC001717582892 1419455286 /nfs/dbraw/zinc/45/52/86/1419455286.db2.gz RSBSAGXBXBJILM-OSJSJHBBSA-N 1 3 333.520 2.798 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CCC[NH2+]Cc1ncccc1C ZINC001717695143 1419510905 /nfs/dbraw/zinc/51/09/05/1419510905.db2.gz ATNOIHAGFWZWDD-MJGOQNOKSA-N 1 3 346.519 2.639 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CCCCC(F)(F)F)[C@H]1C ZINC001717803079 1419548793 /nfs/dbraw/zinc/54/87/93/1419548793.db2.gz SAYKMYOBWIVVAN-KGLIPLIRSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)CCC[NH2+][C@@H]1CN(C(=O)[C@@H](C(C)C)N(C)C)CC1(C)C ZINC001717905063 1419612531 /nfs/dbraw/zinc/61/25/31/1419612531.db2.gz FROWXXGCLNEZEH-IAGOWNOFSA-N 1 3 325.541 2.835 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]CCCc2ccsc2)C1)N(C)C ZINC001717998571 1419649441 /nfs/dbraw/zinc/64/94/41/1419649441.db2.gz JPIKTVZSAOYPQT-OFLPRAFFSA-N 1 3 337.533 2.600 10 0 EFAEHO CCC[NH2+]Cc1ccc(CNC(=O)[C@@H]2CCCN2C(C)C)c(F)c1 ZINC001718034494 1419672638 /nfs/dbraw/zinc/67/26/38/1419672638.db2.gz KNRXRIYZGSGWQG-SFHVURJKSA-N 1 3 335.467 2.814 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001723122752 1424428700 /nfs/dbraw/zinc/42/87/00/1424428700.db2.gz JEPSGKPRSHNXCH-GJZGRUSLSA-N 1 3 333.467 2.590 10 0 EFAEHO CN(CC(=O)N(C)CCC[NH2+]Cc1cccc(F)c1)CC(C)(C)C ZINC001723122850 1424429320 /nfs/dbraw/zinc/42/93/20/1424429320.db2.gz KDMJWBJZMIOXPG-UHFFFAOYSA-N 1 3 337.483 2.742 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C1(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001723522034 1424517682 /nfs/dbraw/zinc/51/76/82/1424517682.db2.gz VGINXWAHCOPDRN-UHFFFAOYSA-N 1 3 343.515 2.650 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(CCN(C(=O)CN(C)CCC)C2)CC1 ZINC001723699683 1424561933 /nfs/dbraw/zinc/56/19/33/1424561933.db2.gz NOUSSDXONMCGNO-VOTSOKGWSA-N 1 3 335.536 2.999 10 0 EFAEHO CN(C(=O)CCCC[NH+]1CCCC1)C1CN(C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC001723825305 1424586073 /nfs/dbraw/zinc/58/60/73/1424586073.db2.gz GPSSJQAJODVJSY-CEXWTWQISA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@H]1C[NH2+]CCC1CC1 ZINC001724609769 1424829255 /nfs/dbraw/zinc/82/92/55/1424829255.db2.gz RXLGVZJRLAHDMP-OXJNMPFZSA-N 1 3 343.515 2.846 10 0 EFAEHO O=C([C@H]1CCC[C@H]2CCC[N@@H+]21)N(CCNCCF)Cc1ccccc1 ZINC001724615208 1424837148 /nfs/dbraw/zinc/83/71/48/1424837148.db2.gz DVSSLJXROODMSY-RBUKOAKNSA-N 1 3 347.478 2.591 10 0 EFAEHO O=C([C@H]1CCC[C@H]2CCC[N@H+]21)N(CCNCCF)Cc1ccccc1 ZINC001724615208 1424837152 /nfs/dbraw/zinc/83/71/52/1424837152.db2.gz DVSSLJXROODMSY-RBUKOAKNSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(F)cc2)C1)N(C)C ZINC001724713053 1424931914 /nfs/dbraw/zinc/93/19/14/1424931914.db2.gz UTSJKQVTXQQQKY-MJGOQNOKSA-N 1 3 349.494 2.740 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC(C)([NH2+]CCCF)CC2)c1 ZINC001724963317 1425170981 /nfs/dbraw/zinc/17/09/81/1425170981.db2.gz NUODQDHPEZDLLL-UHFFFAOYSA-N 1 3 335.467 2.692 10 0 EFAEHO Cc1ccc(CC[NH2+]CC(C)(C)CN(C)C(=O)Cc2c[nH]cn2)cc1 ZINC001725150988 1425335244 /nfs/dbraw/zinc/33/52/44/1425335244.db2.gz YLJSLGVBEKKISM-UHFFFAOYSA-N 1 3 342.487 2.578 10 0 EFAEHO CC(C)=CCN1CC([C@H](C)NC(=O)C2(C[NH+](C)C)CCCCC2)C1 ZINC001725261680 1425422116 /nfs/dbraw/zinc/42/21/16/1425422116.db2.gz VWFDOTORYFXBOB-KRWDZBQOSA-N 1 3 335.536 2.901 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+]Cc1ccc(C)cc1C ZINC001725414934 1425559663 /nfs/dbraw/zinc/55/96/63/1425559663.db2.gz RWROTMPQDZGHFG-INIZCTEOSA-N 1 3 342.487 2.952 10 0 EFAEHO Cc1cccc(C[NH2+]CCC[C@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001725421916 1425565694 /nfs/dbraw/zinc/56/56/94/1425565694.db2.gz YFLJFBGTUMTMOU-ROUUACIJSA-N 1 3 331.504 2.711 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@]12CCC[C@H]1[N@H+](CC=C(C)C)CC2 ZINC001725608691 1425699341 /nfs/dbraw/zinc/69/93/41/1425699341.db2.gz MMBNRBJYZDTDHK-YQVWRLOYSA-N 1 3 339.499 2.746 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@]12CCC[C@H]1[N@@H+](CC=C(C)C)CC2 ZINC001725608691 1425699342 /nfs/dbraw/zinc/69/93/42/1425699342.db2.gz MMBNRBJYZDTDHK-YQVWRLOYSA-N 1 3 339.499 2.746 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H](C[NH2+]C/C=C\c2ccccc2)C1 ZINC001725653505 1425755772 /nfs/dbraw/zinc/75/57/72/1425755772.db2.gz JBYIHSKWDQLWTK-RKLIJYKOSA-N 1 3 343.515 2.915 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCC(C)(C)C)C(C)(C)C1 ZINC001725683237 1425779138 /nfs/dbraw/zinc/77/91/38/1425779138.db2.gz SPTYVWACGYVTLX-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C[NH2+]CCCF)C(C)(C)C ZINC001725752736 1425819280 /nfs/dbraw/zinc/81/92/80/1425819280.db2.gz YZYLCCKZAJMMOK-JKSUJKDBSA-N 1 3 329.504 2.729 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+]CCC1CC1)C(C)(C)C)CC(C)(C)C ZINC001725752499 1425819332 /nfs/dbraw/zinc/81/93/32/1425819332.db2.gz RELXZKBNRZGWGJ-INIZCTEOSA-N 1 3 325.541 2.885 10 0 EFAEHO Cc1cccc(C[N@H+]2CC=C(CNC(=O)CN3CC[C@H](C)C3)CC2)c1 ZINC001725823976 1425882880 /nfs/dbraw/zinc/88/28/80/1425882880.db2.gz NHCSOSKAIRPUPN-SFHVURJKSA-N 1 3 341.499 2.585 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC=C(CNC(=O)CN3CC[C@H](C)C3)CC2)c1 ZINC001725823976 1425882884 /nfs/dbraw/zinc/88/28/84/1425882884.db2.gz NHCSOSKAIRPUPN-SFHVURJKSA-N 1 3 341.499 2.585 10 0 EFAEHO COc1ccc(CN2C[C@@H](C)[C@H](CC[NH3+])C2)cc1Br ZINC000723902996 715007093 /nfs/dbraw/zinc/00/70/93/715007093.db2.gz SFGPPGDUJCHLAC-DGCLKSJQSA-N 1 3 327.266 2.874 10 0 EFAEHO CN1C[C@@H]2C[N@H+](C[C@@H](O)c3cccc(C(F)(F)F)c3)C[C@]2(C)C1 ZINC000933744668 715036950 /nfs/dbraw/zinc/03/69/50/715036950.db2.gz NUPQSPSQTIJMLP-OAGGEKHMSA-N 1 3 328.378 2.622 10 0 EFAEHO CN1C[C@@H]2C[N@@H+](C[C@@H](O)c3cccc(C(F)(F)F)c3)C[C@]2(C)C1 ZINC000933744668 715036954 /nfs/dbraw/zinc/03/69/54/715036954.db2.gz NUPQSPSQTIJMLP-OAGGEKHMSA-N 1 3 328.378 2.622 10 0 EFAEHO CN1CC[C@]2(CC[N@H+](C[C@@H](O)COc3cccc4ccccc43)C2)C1 ZINC000292179641 715813170 /nfs/dbraw/zinc/81/31/70/715813170.db2.gz QLGDQFCNDGSBIR-NQIIRXRSSA-N 1 3 340.467 2.607 10 0 EFAEHO CN1CC[C@]2(CC[N@@H+](C[C@@H](O)COc3cccc4ccccc43)C2)C1 ZINC000292179641 715813177 /nfs/dbraw/zinc/81/31/77/715813177.db2.gz QLGDQFCNDGSBIR-NQIIRXRSSA-N 1 3 340.467 2.607 10 0 EFAEHO COc1ccc([C@@H](C)[NH2+]C[C@H]2CNCCC2(F)F)c(C)c1OC ZINC000925777431 717621454 /nfs/dbraw/zinc/62/14/54/717621454.db2.gz OXXVOWHPDAKBJS-CHWSQXEVSA-N 1 3 328.403 2.908 10 0 EFAEHO COCc1cc([C@H](C)[NH2+]C[C@@H]2CNCCC2(F)F)ccc1OC ZINC000925779923 717694036 /nfs/dbraw/zinc/69/40/36/717694036.db2.gz QGXJDUJKUADISP-WFASDCNBSA-N 1 3 328.403 2.737 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@@H]1CC[C@H](C(F)(F)F)O1 ZINC000925829005 719403327 /nfs/dbraw/zinc/40/33/27/719403327.db2.gz LPMFKMLAUOZSJH-VZJVUDMVSA-N 1 3 331.382 2.999 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@@H]1CC[C@@H](C(F)(F)F)O1 ZINC000925829006 719403725 /nfs/dbraw/zinc/40/37/25/719403725.db2.gz LPMFKMLAUOZSJH-XEGUGMAKSA-N 1 3 331.382 2.999 10 0 EFAEHO C[C@H](N[C@@H]1C[C@H]([NH3+])CC(C)(C)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000925588308 720500605 /nfs/dbraw/zinc/50/06/05/720500605.db2.gz VBLRHNVHCUWJSG-DUVNUKRYSA-N 1 3 339.505 2.615 10 0 EFAEHO C[C@H](N[C@H]1C[C@H]([NH3+])CC(C)(C)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000925588312 720500715 /nfs/dbraw/zinc/50/07/15/720500715.db2.gz VBLRHNVHCUWJSG-NOLJZWGESA-N 1 3 339.505 2.615 10 0 EFAEHO FC(F)C(F)(F)COCCN[C@@H]1CC[NH2+]C[C@@H]1C1CCCC1 ZINC000925652824 720753422 /nfs/dbraw/zinc/75/34/22/720753422.db2.gz UELHYCGIRDZODO-CHWSQXEVSA-N 1 3 326.378 2.661 10 0 EFAEHO CC1(C)C[C@@H]([NH3+])C[C@H](N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)C1 ZINC000925675616 720866077 /nfs/dbraw/zinc/86/60/77/720866077.db2.gz XAEUXIXTMKACGV-MJBXVCDLSA-N 1 3 349.441 2.816 10 0 EFAEHO CCN1CCN(C[C@H](C)C[NH2+][C@@H](C)c2cnn(C3CCC3)c2)CC1 ZINC000924953664 721864036 /nfs/dbraw/zinc/86/40/36/721864036.db2.gz RZXQSMIMADNVGG-SJORKVTESA-N 1 3 333.524 2.532 10 0 EFAEHO CC[NH+](CC)CCCC1CCN(C[C@H]2[C@H](C(=O)OC)C2(F)F)CC1 ZINC000894436141 722736909 /nfs/dbraw/zinc/73/69/09/722736909.db2.gz DIKKHWWNZXJION-JKSUJKDBSA-N 1 3 346.462 2.875 10 0 EFAEHO CCN(CCC[NH+]1CCCC1)CC1CN(C(=O)OC(C)(C)C)C1 ZINC000894775707 722840905 /nfs/dbraw/zinc/84/09/05/722840905.db2.gz AOKXTJZMACUMMI-UHFFFAOYSA-N 1 3 325.497 2.661 10 0 EFAEHO CCc1[nH]c(CN2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1C(=O)OC ZINC000894779812 722846009 /nfs/dbraw/zinc/84/60/09/722846009.db2.gz PPWJKGRZKBEPFV-OAHLLOKOSA-N 1 3 333.476 2.527 10 0 EFAEHO COCC1([NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)CCOCC1 ZINC000894854934 722897788 /nfs/dbraw/zinc/89/77/88/722897788.db2.gz KUDWCLLBSZTSBJ-UFYCRDLUSA-N 1 3 344.499 2.825 10 0 EFAEHO CC[C@@H](C[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C(=O)OC ZINC000895138068 723431038 /nfs/dbraw/zinc/43/10/38/723431038.db2.gz BRGUNSXKLBQHPD-VJANTYMQSA-N 1 3 330.472 2.828 10 0 EFAEHO C[N@H+](CCCCNC(=O)c1ccc(NC2=NCCC2)cc1)C1CC1 ZINC000909556429 723797407 /nfs/dbraw/zinc/79/74/07/723797407.db2.gz RDLZRFSMVFELKR-UHFFFAOYSA-N 1 3 328.460 2.895 10 0 EFAEHO C[N@@H+](CCCCNC(=O)c1ccc(NC2=NCCC2)cc1)C1CC1 ZINC000909556429 723797411 /nfs/dbraw/zinc/79/74/11/723797411.db2.gz RDLZRFSMVFELKR-UHFFFAOYSA-N 1 3 328.460 2.895 10 0 EFAEHO C[C@@H](CCNC[C@@H]1CC(F)(F)CN1C(=O)OC(C)(C)C)[NH+](C)C ZINC000895293050 723997053 /nfs/dbraw/zinc/99/70/53/723997053.db2.gz IVGMASXODDHWFN-STQMWFEESA-N 1 3 335.439 2.561 10 0 EFAEHO C[C@@H](CC[NH2+]C[C@@H]1CC(F)(F)CN1C(=O)OC(C)(C)C)N(C)C ZINC000895293050 723997057 /nfs/dbraw/zinc/99/70/57/723997057.db2.gz IVGMASXODDHWFN-STQMWFEESA-N 1 3 335.439 2.561 10 0 EFAEHO COc1ccc(C2=NO[C@@H](C[NH2+][C@@H]3CCN(C)C(C)(C)C3)C2)cc1 ZINC000895497350 724168752 /nfs/dbraw/zinc/16/87/52/724168752.db2.gz HWAHTSFKWHRJJF-NVXWUHKLSA-N 1 3 331.460 2.651 10 0 EFAEHO c1nn2c(c1C[N@H+]1C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C1)CCC2 ZINC000895792435 724317219 /nfs/dbraw/zinc/31/72/19/724317219.db2.gz JJJIQSBFOCASIG-AZUAARDMSA-N 1 3 336.483 2.783 10 0 EFAEHO c1nn2c(c1C[N@@H+]1C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C1)CCC2 ZINC000895792435 724317225 /nfs/dbraw/zinc/31/72/25/724317225.db2.gz JJJIQSBFOCASIG-AZUAARDMSA-N 1 3 336.483 2.783 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC[N@@H+]1C ZINC000918861058 728936104 /nfs/dbraw/zinc/93/61/04/728936104.db2.gz IBOGFWRANDLTSZ-BHIYHBOVSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC[N@H+]1C ZINC000918861058 728936108 /nfs/dbraw/zinc/93/61/08/728936108.db2.gz IBOGFWRANDLTSZ-BHIYHBOVSA-N 1 3 344.503 2.605 10 0 EFAEHO C[N@H+]1C[C@H]2CC[C@@H](C1)C2NC[C@@H](O)c1cccc(C(F)(F)F)c1 ZINC000925376285 725456574 /nfs/dbraw/zinc/45/65/74/725456574.db2.gz KGDYFJMOKHQPRT-XFDYKOMQSA-N 1 3 328.378 2.669 10 0 EFAEHO C[N@@H+]1C[C@H]2CC[C@@H](C1)C2NC[C@@H](O)c1cccc(C(F)(F)F)c1 ZINC000925376285 725456575 /nfs/dbraw/zinc/45/65/75/725456575.db2.gz KGDYFJMOKHQPRT-XFDYKOMQSA-N 1 3 328.378 2.669 10 0 EFAEHO CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C12CC[NH+](CC1)C2 ZINC000913780866 725857773 /nfs/dbraw/zinc/85/77/73/725857773.db2.gz ROKZZMYUUTVCLX-LJQANCHMSA-N 1 3 341.499 2.595 10 0 EFAEHO C[NH+](C)[C@@H]1CCCN(C(=O)c2ccc(NC3=NCCC3)cc2)CC1 ZINC000907745545 727000054 /nfs/dbraw/zinc/00/00/54/727000054.db2.gz BSHDJITZMOHSGI-QGZVFWFLSA-N 1 3 328.460 2.847 10 0 EFAEHO C[N@@H+]1CC[C@]2(C1)CCCN(C(=O)c1ccc(NC3=NCCC3)cc1)C2 ZINC000908536258 727207869 /nfs/dbraw/zinc/20/78/69/727207869.db2.gz FYICUNPZJXTAQM-FQEVSTJZSA-N 1 3 340.471 2.849 10 0 EFAEHO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1ccc(NC3=NCCC3)cc1)C2 ZINC000908536258 727207872 /nfs/dbraw/zinc/20/78/72/727207872.db2.gz FYICUNPZJXTAQM-FQEVSTJZSA-N 1 3 340.471 2.849 10 0 EFAEHO C[NH+]1C[C@]2(C)CN(C(=O)c3ccc(NC4=NCCC4)cc3)C[C@@]2(C)C1 ZINC000913273678 727811929 /nfs/dbraw/zinc/81/19/29/727811929.db2.gz GNCNPARAFDASGM-WOJBJXKFSA-N 1 3 340.471 2.705 10 0 EFAEHO Cc1ncsc1CN1CCC2(C[N@@H+](C3CCC3)C[C@@H]2CO)CC1 ZINC000169783593 728405435 /nfs/dbraw/zinc/40/54/35/728405435.db2.gz NYTBGBGMFAAZEF-OAHLLOKOSA-N 1 3 335.517 2.510 10 0 EFAEHO Cc1ncsc1CN1CCC2(C[N@H+](C3CCC3)C[C@@H]2CO)CC1 ZINC000169783593 728405438 /nfs/dbraw/zinc/40/54/38/728405438.db2.gz NYTBGBGMFAAZEF-OAHLLOKOSA-N 1 3 335.517 2.510 10 0 EFAEHO C[C@H](C(=O)NCC1([NH2+]CC2=CCCCC2)CC1)N1CCCCCC1 ZINC001569421308 1085194310 /nfs/dbraw/zinc/19/43/10/1085194310.db2.gz RITGFIUBKNNZFD-QGZVFWFLSA-N 1 3 333.520 2.990 10 0 EFAEHO CC[C@H](C(=O)N1CCC2(C1)CC[NH+](CCCCCF)CC2)N(C)C ZINC001569468919 1085266052 /nfs/dbraw/zinc/26/60/52/1085266052.db2.gz AOMDHQLQINSCRP-QGZVFWFLSA-N 1 3 341.515 2.781 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@]2(CCN(C(=O)CN3CCC(C)CC3)C2)C1 ZINC001569479444 1085286680 /nfs/dbraw/zinc/28/66/80/1085286680.db2.gz WNHUGNHOEPNOFO-OLEQZPESSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@]2(CCN(C(=O)CN3CCC(C)CC3)C2)C1 ZINC001569479444 1085286688 /nfs/dbraw/zinc/28/66/88/1085286688.db2.gz WNHUGNHOEPNOFO-OLEQZPESSA-N 1 3 347.547 2.999 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@@H]2C[NH2+]CCCc2ccccc2)CCC1 ZINC001569543406 1085358961 /nfs/dbraw/zinc/35/89/61/1085358961.db2.gz CVWGOEVLIUWIJF-LJQANCHMSA-N 1 3 343.515 2.684 10 0 EFAEHO C[C@H]([NH2+]CCCC1CCCC1)[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001569824784 1085644447 /nfs/dbraw/zinc/64/44/47/1085644447.db2.gz UCPFULJCBRERDD-PKOBYXMFSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001569864861 1085692874 /nfs/dbraw/zinc/69/28/74/1085692874.db2.gz LDDYZLSJVALOFP-FHWLQOOXSA-N 1 3 335.536 2.807 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H]2[C@H]1CC[N@@H+]2CCCCCF)N(C)C ZINC001569912190 1085753364 /nfs/dbraw/zinc/75/33/64/1085753364.db2.gz GARLRKBJJBZBLT-KZNAEPCWSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H]2[C@H]1CC[N@H+]2CCCCCF)N(C)C ZINC001569912190 1085753367 /nfs/dbraw/zinc/75/33/67/1085753367.db2.gz GARLRKBJJBZBLT-KZNAEPCWSA-N 1 3 341.515 2.778 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H](CC[NH2+]CCCC3CCC3)C2)CCC1 ZINC001569983846 1085816663 /nfs/dbraw/zinc/81/66/63/1085816663.db2.gz KHUKTDSGPOSNBF-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CC[C@@H](CC[NH2+]CC2CCCCCC2)C1 ZINC001570004236 1085846187 /nfs/dbraw/zinc/84/61/87/1085846187.db2.gz BSEWGAQUTREREU-QGZVFWFLSA-N 1 3 332.492 2.751 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@@H]2CCN(C(=O)CN3CCCC3)C2)c1 ZINC001570018417 1085866814 /nfs/dbraw/zinc/86/68/14/1085866814.db2.gz DSBXKJAQWNWASC-LJQANCHMSA-N 1 3 343.515 2.727 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@H+](CCCCCF)CC1)N(C)C ZINC001570177693 1086015755 /nfs/dbraw/zinc/01/57/55/1086015755.db2.gz QDAAEUXCSAOOOF-IRXDYDNUSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@@H+](CCCCCF)CC1)N(C)C ZINC001570177693 1086015764 /nfs/dbraw/zinc/01/57/64/1086015764.db2.gz QDAAEUXCSAOOOF-IRXDYDNUSA-N 1 3 329.504 2.683 10 0 EFAEHO Cc1cccnc1CN1CCC[C@@H](NC(=O)CCCC[NH+](C)C)CC1 ZINC001570185721 1086033760 /nfs/dbraw/zinc/03/37/60/1086033760.db2.gz QGIFRNZSXKFPSU-GOSISDBHSA-N 1 3 346.519 2.593 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2CN(C(=O)CCCC[NH+](C)C)C[C@@H]2C)c1 ZINC001570362465 1086168406 /nfs/dbraw/zinc/16/84/06/1086168406.db2.gz VSKKKQFPOVWGDR-LPHOPBHVSA-N 1 3 349.494 2.803 10 0 EFAEHO CC1([NH2+]CCCCC(F)(F)F)CCN(C(=O)CN2CCCC2)CC1 ZINC001570385682 1086186572 /nfs/dbraw/zinc/18/65/72/1086186572.db2.gz KWXQMUCZNHEGLT-UHFFFAOYSA-N 1 3 349.441 2.786 10 0 EFAEHO C[N@H+](CCCCC(F)(F)F)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001570545622 1086342995 /nfs/dbraw/zinc/34/29/95/1086342995.db2.gz WKBPBUCISPCFER-HNNXBMFYSA-N 1 3 349.441 2.738 10 0 EFAEHO C[N@@H+](CCCCC(F)(F)F)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001570545622 1086343008 /nfs/dbraw/zinc/34/30/08/1086343008.db2.gz WKBPBUCISPCFER-HNNXBMFYSA-N 1 3 349.441 2.738 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1C[C@H](C[NH2+]CC[C@@H]2CCC[C@@H](C)C2)C1 ZINC001571187313 1086675307 /nfs/dbraw/zinc/67/53/07/1086675307.db2.gz WJXQMJNNVRSDAX-BZZMCLGOSA-N 1 3 346.519 2.961 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CCCCCF)CN1C(=O)CN(C)CC(C)(C)C ZINC001571487591 1086876001 /nfs/dbraw/zinc/87/60/01/1086876001.db2.gz UPXCXLQILFELGB-HOTGVXAUSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)N(CCN(C)CC1=CCCCC1)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001571616154 1086989094 /nfs/dbraw/zinc/98/90/94/1086989094.db2.gz SLOVUVHQALZYNZ-IBGZPJMESA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)N(CCN(C)CC1=CCCCC1)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001571616154 1086989098 /nfs/dbraw/zinc/98/90/98/1086989098.db2.gz SLOVUVHQALZYNZ-IBGZPJMESA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C[NH2+]CCCF)C(C)(C)C)N1CCCC1 ZINC001571639308 1087010680 /nfs/dbraw/zinc/01/06/80/1087010680.db2.gz LKOQZESPHZXFPK-JKSUJKDBSA-N 1 3 329.504 2.587 10 0 EFAEHO CC(C)=CCN[C@H]1CN(C(=O)CCC[NH+](C)C)CC[C@H]1C(F)(F)F ZINC001571652357 1087022600 /nfs/dbraw/zinc/02/26/00/1087022600.db2.gz MOUMSOJJKGLFKA-CABCVRRESA-N 1 3 349.441 2.663 10 0 EFAEHO CC(C)=CCN[C@H]1CN(C(=O)CCC[NH+](C)C)CC[C@@H]1C(F)(F)F ZINC001571652358 1087022707 /nfs/dbraw/zinc/02/27/07/1087022707.db2.gz MOUMSOJJKGLFKA-GJZGRUSLSA-N 1 3 349.441 2.663 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@@H+]([C@H](C)c2ccccc2)CC1)N(C)C ZINC001571695125 1087062954 /nfs/dbraw/zinc/06/29/54/1087062954.db2.gz DYKKQSDSHZEQNZ-APWZRJJASA-N 1 3 329.488 2.836 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@H+]([C@H](C)c2ccccc2)CC1)N(C)C ZINC001571695125 1087062958 /nfs/dbraw/zinc/06/29/58/1087062958.db2.gz DYKKQSDSHZEQNZ-APWZRJJASA-N 1 3 329.488 2.836 10 0 EFAEHO Cc1ccc(CN2CC=C(CNC(=O)C[C@H]3CC[N@@H+](C)C3)CC2)cc1 ZINC001571698963 1087069919 /nfs/dbraw/zinc/06/99/19/1087069919.db2.gz YRBXLMAEZGMXJY-HXUWFJFHSA-N 1 3 341.499 2.585 10 0 EFAEHO Cc1ccc(CN2CC=C(CNC(=O)C[C@H]3CC[N@H+](C)C3)CC2)cc1 ZINC001571698963 1087069928 /nfs/dbraw/zinc/06/99/28/1087069928.db2.gz YRBXLMAEZGMXJY-HXUWFJFHSA-N 1 3 341.499 2.585 10 0 EFAEHO CCN(C(=O)C[NH2+]CC(C)C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC001647248396 1089161455 /nfs/dbraw/zinc/16/14/55/1089161455.db2.gz HPPVTDBZBNGBEJ-HKUYNNGSSA-N 1 3 331.504 2.916 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H]([NH2+]CCCCc2ccccc2)C1)N(C)C ZINC001267012411 1092325304 /nfs/dbraw/zinc/32/53/04/1092325304.db2.gz MARZTQYFINFBCU-RBUKOAKNSA-N 1 3 331.504 2.540 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](C[NH2+]CCC2=CCCCC2)C1)C1CCC1 ZINC001267043803 1092443732 /nfs/dbraw/zinc/44/37/32/1092443732.db2.gz DUZNTWPNXQPNJB-SFHVURJKSA-N 1 3 333.520 2.799 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)CCC[NH2+]Cc1cnccc1C ZINC001649471888 1092515369 /nfs/dbraw/zinc/51/53/69/1092515369.db2.gz LZDYYNITACJILQ-IEBWSBKVSA-N 1 3 346.519 2.639 10 0 EFAEHO C[NH+](C)[C@H]1CCCC[C@H]1NC(=O)c1cccc(CN2CCCC2)c1 ZINC001649698495 1092596284 /nfs/dbraw/zinc/59/62/84/1092596284.db2.gz AOFHYVTVDMRZMX-MOPGFXCFSA-N 1 3 329.488 2.885 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H]([N@H+](C)CCCCCF)C1)N(C)C ZINC001267112335 1092778729 /nfs/dbraw/zinc/77/87/29/1092778729.db2.gz YDEJCISDXVOQBW-IAGOWNOFSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H]([N@@H+](C)CCCCCF)C1)N(C)C ZINC001267112335 1092778738 /nfs/dbraw/zinc/77/87/38/1092778738.db2.gz YDEJCISDXVOQBW-IAGOWNOFSA-N 1 3 329.504 2.635 10 0 EFAEHO Cc1ccc(F)c(CN2CC[C@@H](CNC(=O)CCCC[NH+](C)C)C2)c1 ZINC001267307178 1093536928 /nfs/dbraw/zinc/53/69/28/1093536928.db2.gz NGEVUTMNSISDCY-KRWDZBQOSA-N 1 3 349.494 2.804 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H](C[NH2+]CCC(C)(C)C)C1CC1)N(C)C ZINC001283552670 1093627874 /nfs/dbraw/zinc/62/78/74/1093627874.db2.gz JJLASHZHADSZGA-IAGOWNOFSA-N 1 3 325.541 2.835 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@H](NCC1=CCCCC1)c1ccccc1 ZINC001267371326 1094342064 /nfs/dbraw/zinc/34/20/64/1094342064.db2.gz XWHQBDINQNKPEZ-LJQANCHMSA-N 1 3 329.488 2.886 10 0 EFAEHO COc1cccc(C[NH2+]CCN(C)C(=O)CN(C)CC(C)(C)C)c1C ZINC001267428947 1094514511 /nfs/dbraw/zinc/51/45/11/1094514511.db2.gz HOUVNQXRHJHYPC-UHFFFAOYSA-N 1 3 349.519 2.530 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[NH2+]C/C=C\c1ccc(Cl)cc1)N(C)C ZINC001267456601 1094556572 /nfs/dbraw/zinc/55/65/72/1094556572.db2.gz CISMFNVFRPSURR-TUYSUELWSA-N 1 3 337.895 2.741 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NCC[C@@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001481465138 1094739373 /nfs/dbraw/zinc/73/93/73/1094739373.db2.gz OWHUSMPWMHJDPX-NVXWUHKLSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NCC[C@@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001481465138 1094739378 /nfs/dbraw/zinc/73/93/78/1094739378.db2.gz OWHUSMPWMHJDPX-NVXWUHKLSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NCC[C@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001481465133 1094740116 /nfs/dbraw/zinc/74/01/16/1094740116.db2.gz OWHUSMPWMHJDPX-DOTOQJQBSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NCC[C@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001481465133 1094740129 /nfs/dbraw/zinc/74/01/29/1094740129.db2.gz OWHUSMPWMHJDPX-DOTOQJQBSA-N 1 3 349.906 2.620 10 0 EFAEHO CC[N@@H+]1CCCC[C@H]1C(=O)N(C)CCNCc1cc2ccccc2o1 ZINC001267474702 1094767153 /nfs/dbraw/zinc/76/71/53/1094767153.db2.gz SNQGYRUDFJHMON-SFHVURJKSA-N 1 3 343.471 2.855 10 0 EFAEHO CC[N@H+]1CCCC[C@H]1C(=O)N(C)CCNCc1cc2ccccc2o1 ZINC001267474702 1094767164 /nfs/dbraw/zinc/76/71/64/1094767164.db2.gz SNQGYRUDFJHMON-SFHVURJKSA-N 1 3 343.471 2.855 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1C(=O)N(C)CCNCc1cc2ccccc2o1 ZINC001267474701 1094767751 /nfs/dbraw/zinc/76/77/51/1094767751.db2.gz SNQGYRUDFJHMON-GOSISDBHSA-N 1 3 343.471 2.855 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1C(=O)N(C)CCNCc1cc2ccccc2o1 ZINC001267474701 1094767762 /nfs/dbraw/zinc/76/77/62/1094767762.db2.gz SNQGYRUDFJHMON-GOSISDBHSA-N 1 3 343.471 2.855 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+](CC/C=C/c2ccccc2)C1 ZINC001481125255 1094833621 /nfs/dbraw/zinc/83/36/21/1094833621.db2.gz BSNGRFFOXZSBKX-WUTDNEBXSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+](CC/C=C/c2ccccc2)C1 ZINC001481125255 1094833638 /nfs/dbraw/zinc/83/36/38/1094833638.db2.gz BSNGRFFOXZSBKX-WUTDNEBXSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cccc(CCC[N@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001481125324 1094834378 /nfs/dbraw/zinc/83/43/78/1094834378.db2.gz CEOZSWFIHKUTRE-FQEVSTJZSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1cccc(CCC[N@@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001481125324 1094834395 /nfs/dbraw/zinc/83/43/95/1094834395.db2.gz CEOZSWFIHKUTRE-FQEVSTJZSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)C1CC1 ZINC001481194210 1095239725 /nfs/dbraw/zinc/23/97/25/1095239725.db2.gz DGKAEKQGGRHOJH-CVEARBPZSA-N 1 3 347.478 2.809 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)C1CC1 ZINC001481194210 1095239739 /nfs/dbraw/zinc/23/97/39/1095239739.db2.gz DGKAEKQGGRHOJH-CVEARBPZSA-N 1 3 347.478 2.809 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[C@H](C[NH2+]C/C=C/Cl)CC1)C1CCC1 ZINC001279261972 1095416557 /nfs/dbraw/zinc/41/65/57/1095416557.db2.gz KLJPFRCGLAGFIX-NNESJEAZSA-N 1 3 341.927 2.735 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H]2CCCCN2C(=O)Cc2c[nH]cn2)cs1 ZINC001268161896 1095597060 /nfs/dbraw/zinc/59/70/60/1095597060.db2.gz SFGJGWLBOCVBBE-KRWDZBQOSA-N 1 3 346.500 2.883 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1C[C@@H]2C[C@H]1CN2CCCCc1ccccc1 ZINC001267713809 1095597641 /nfs/dbraw/zinc/59/76/41/1095597641.db2.gz QUPSGKRGILUEQA-PMACEKPBSA-N 1 3 343.515 2.636 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1C[C@@H]2C[C@H]1CN2CCCCc1ccccc1 ZINC001267713809 1095597647 /nfs/dbraw/zinc/59/76/47/1095597647.db2.gz QUPSGKRGILUEQA-PMACEKPBSA-N 1 3 343.515 2.636 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C(C)C)[C@@H]1CCCc2ccc(F)cc21 ZINC001481019580 1095886595 /nfs/dbraw/zinc/88/65/95/1095886595.db2.gz XWENZJAWBAIHML-LJQANCHMSA-N 1 3 349.494 2.981 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C(C)C)[C@@H]1CCCc2ccc(F)cc21 ZINC001481019580 1095886615 /nfs/dbraw/zinc/88/66/15/1095886615.db2.gz XWENZJAWBAIHML-LJQANCHMSA-N 1 3 349.494 2.981 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)CC[C@@H]21 ZINC001268263800 1096201290 /nfs/dbraw/zinc/20/12/90/1096201290.db2.gz BZYCDWKMNCQNMM-UNQUKWGNSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)CN3CCC(C)CC3)CC[C@@H]21 ZINC001268263800 1096201298 /nfs/dbraw/zinc/20/12/98/1096201298.db2.gz BZYCDWKMNCQNMM-UNQUKWGNSA-N 1 3 347.547 2.997 10 0 EFAEHO C[C@H](CC[NH2+]CCc1ccccc1)NC(=O)C(C)(C)N1CCCCC1 ZINC001268366964 1096398010 /nfs/dbraw/zinc/39/80/10/1096398010.db2.gz PYQALTPVJPCSIT-GOSISDBHSA-N 1 3 345.531 2.978 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccc(CF)cc1)NC(=O)C1(N(C)C)CCC1 ZINC001268367831 1096403176 /nfs/dbraw/zinc/40/31/76/1096403176.db2.gz DEGRTBFNWIJENB-HNNXBMFYSA-N 1 3 335.467 2.625 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1cccc(F)c1Cl)N(C)C ZINC001268412811 1096542338 /nfs/dbraw/zinc/54/23/38/1096542338.db2.gz AZKTXZMTTBCLSB-IUODEOHRSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CCNCc1c(F)cccc1F)[NH+](C)C ZINC001268412718 1096545544 /nfs/dbraw/zinc/54/55/44/1096545544.db2.gz BHGTUDZXHZMSJS-GUYCJALGSA-N 1 3 341.446 2.535 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CC[NH2+]Cc1cc(C)cc(C)c1 ZINC001268418140 1096561597 /nfs/dbraw/zinc/56/15/97/1096561597.db2.gz CFSCJWFPDPVYPA-HNNXBMFYSA-N 1 3 328.460 2.562 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CC[NH2+]Cc1cc(C)cc(C)c1 ZINC001268418141 1096561737 /nfs/dbraw/zinc/56/17/37/1096561737.db2.gz CFSCJWFPDPVYPA-OAHLLOKOSA-N 1 3 328.460 2.562 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@@H]1CCN([C@@H]2CCc3c2cccc3F)C1 ZINC001481774357 1096673057 /nfs/dbraw/zinc/67/30/57/1096673057.db2.gz JTUBOKVZHAFQMW-DNVCBOLYSA-N 1 3 347.478 2.688 10 0 EFAEHO CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@@H+](C(C)C)C1 ZINC001481775104 1096674801 /nfs/dbraw/zinc/67/48/01/1096674801.db2.gz RJGKNDWQPXLKKT-QAPCUYQASA-N 1 3 327.488 2.530 10 0 EFAEHO CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@@H]1CC[N@H+](C(C)C)C1 ZINC001481775104 1096674807 /nfs/dbraw/zinc/67/48/07/1096674807.db2.gz RJGKNDWQPXLKKT-QAPCUYQASA-N 1 3 327.488 2.530 10 0 EFAEHO CCN(CCNC/C=C\Cl)C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001268466829 1096794734 /nfs/dbraw/zinc/79/47/34/1096794734.db2.gz AYLBHCRPAXZLFT-FLIBITNWSA-N 1 3 329.916 2.689 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H](C(C)C)[NH+]1CCCC1)NCc1ccccc1F ZINC001481882209 1096854115 /nfs/dbraw/zinc/85/41/15/1096854115.db2.gz PQKCPQHGEODEQQ-PKOBYXMFSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H](CC[NH2+]CCc2ccccc2)C1)N(C)C ZINC001481987639 1097044079 /nfs/dbraw/zinc/04/40/79/1097044079.db2.gz JYIFQLXMPMYDEO-UXHICEINSA-N 1 3 345.531 2.788 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H](CC[NH2+]Cc2ccc(F)cc2)C1)N(C)C ZINC001481989413 1097053746 /nfs/dbraw/zinc/05/37/46/1097053746.db2.gz ZJXZWCYCKJQZAR-HKUYNNGSSA-N 1 3 349.494 2.884 10 0 EFAEHO O=C(CN1CCCC1)N1CCC[C@H](CC[NH2+]CC=C(Cl)Cl)C1 ZINC001481990913 1097056530 /nfs/dbraw/zinc/05/65/30/1097056530.db2.gz FYRGDTVQQRAYNI-CQSZACIVSA-N 1 3 348.318 2.620 10 0 EFAEHO CC(C)CC[NH2+]CCC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001481999414 1097070099 /nfs/dbraw/zinc/07/00/99/1097070099.db2.gz NGWCNRAHGNENQW-SFHVURJKSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@H]([NH2+]C/C=C/CNC(=O)[C@@H]1CCCN1C)c1ccc2c(c1)CCC2 ZINC001268523480 1097126976 /nfs/dbraw/zinc/12/69/76/1097126976.db2.gz QWVLCTYIWSIVPZ-ZLSGJYCMSA-N 1 3 341.499 2.593 10 0 EFAEHO C[C@H]([NH2+]C/C=C/CNC(=O)[C@H]1CCCN1C)c1ccc2c(c1)CCC2 ZINC001268523478 1097127102 /nfs/dbraw/zinc/12/71/02/1097127102.db2.gz QWVLCTYIWSIVPZ-YPHPSYCRSA-N 1 3 341.499 2.593 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)[C@H]2CCC[N@H+]2C(C)C)c(C)s1 ZINC001268541765 1097155041 /nfs/dbraw/zinc/15/50/41/1097155041.db2.gz LWWQCZUSKAUNIG-OOFWQKGWSA-N 1 3 349.544 3.000 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)[C@H]2CCC[N@@H+]2C(C)C)c(C)s1 ZINC001268541765 1097155045 /nfs/dbraw/zinc/15/50/45/1097155045.db2.gz LWWQCZUSKAUNIG-OOFWQKGWSA-N 1 3 349.544 3.000 10 0 EFAEHO Cc1ccc(CCC[NH2+]C[C@H]2CCCN2C(=O)[C@H]2CCCN2C)cc1 ZINC001482060319 1097202053 /nfs/dbraw/zinc/20/20/53/1097202053.db2.gz BYPGANMPHJLFQQ-WOJBJXKFSA-N 1 3 343.515 2.602 10 0 EFAEHO CCCC[NH2+]C[C@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001482062965 1097210774 /nfs/dbraw/zinc/21/07/74/1097210774.db2.gz NEFHHMRXVSNGMD-CRAIPNDOSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@H]1C[NH2+]CCCC(C)(C)C ZINC001279113176 1097211943 /nfs/dbraw/zinc/21/19/43/1097211943.db2.gz NBFRWOKXMSBXOH-DLBZAZTESA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H](C)CNC(=O)C(C)(C)N2CCCC2)c1 ZINC001482128510 1097298610 /nfs/dbraw/zinc/29/86/10/1097298610.db2.gz DQIZXOIHFCWBAQ-QGZVFWFLSA-N 1 3 331.504 2.711 10 0 EFAEHO CC[C@H](C(=O)NC/C=C\C[NH2+][C@H](C)c1ccc2c(c1)CCC2)N(C)C ZINC001268615997 1097466002 /nfs/dbraw/zinc/46/60/02/1097466002.db2.gz FKFBVJHAUYJIER-YCLSTDHLSA-N 1 3 343.515 2.839 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]C/C=C\CNC(=O)CN2CCCC2)c1 ZINC001268624992 1097477949 /nfs/dbraw/zinc/47/79/49/1097477949.db2.gz JTHCZADPMSDVIW-PYTPGESOSA-N 1 3 329.488 2.722 10 0 EFAEHO CC(C)(C)c1ccc(C[NH2+]C/C=C/CNC(=O)CN2CCCC2)cc1 ZINC001268625285 1097479161 /nfs/dbraw/zinc/47/91/61/1097479161.db2.gz MLOXJWFLANWMKQ-SNAWJCMRSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/CNCc1cccc(F)c1)[NH+]1CCCC1 ZINC001268630148 1097484066 /nfs/dbraw/zinc/48/40/66/1097484066.db2.gz GFPHLJFFQDMGEB-GNAXCBTBSA-N 1 3 347.478 2.708 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]C/C=C/CNC(=O)CN(C)C(C)C)c1 ZINC001268630890 1097484790 /nfs/dbraw/zinc/48/47/90/1097484790.db2.gz RYXHDQHWKBKVLZ-LKGOPFMKSA-N 1 3 331.504 2.967 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C/C=C\CNC(=O)CN(C)C(C)C)c1 ZINC001268630891 1097484901 /nfs/dbraw/zinc/48/49/01/1097484901.db2.gz RYXHDQHWKBKVLZ-ZEVQVBBLSA-N 1 3 331.504 2.967 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC/C=C/C[NH2+]CC1CCC(C)CC1 ZINC001268630866 1097484933 /nfs/dbraw/zinc/48/49/33/1097484933.db2.gz RGQWBCSXOZRMMJ-LKFCSYKXSA-N 1 3 335.536 2.949 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]C/C=C\CNC(=O)CN(C)C(C)C)c1 ZINC001268630889 1097485074 /nfs/dbraw/zinc/48/50/74/1097485074.db2.gz RYXHDQHWKBKVLZ-JTHGQSKGSA-N 1 3 331.504 2.967 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]CCCc1cccc(F)c1 ZINC001268674028 1097527976 /nfs/dbraw/zinc/52/79/76/1097527976.db2.gz NFNRJMHRNSILOQ-APWZRJJASA-N 1 3 349.494 2.727 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@H]1C(=O)N[C@@H](C)CNCC=C(Cl)Cl ZINC001268706355 1097556868 /nfs/dbraw/zinc/55/68/68/1097556868.db2.gz FTJSCUBRTITESN-STQMWFEESA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@H]1C(=O)N[C@@H](C)CNCC=C(Cl)Cl ZINC001268706355 1097556874 /nfs/dbraw/zinc/55/68/74/1097556874.db2.gz FTJSCUBRTITESN-STQMWFEESA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)Oc1ccccc1C[NH2+]CCCN(C)C(=O)[C@@H]1CCCN1C ZINC001268783352 1097633232 /nfs/dbraw/zinc/63/32/32/1097633232.db2.gz HPMRONWBMSQBBF-SFHVURJKSA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CCCN(C)C(=O)CN(C)C1CCC1 ZINC001268797583 1097644500 /nfs/dbraw/zinc/64/45/00/1097644500.db2.gz SOAYMHUDVZGTJN-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO CN(CCC[NH2+]C/C=C\c1ccc(Cl)cc1)C(=O)[C@H]1CCCN1C ZINC001268811707 1097660410 /nfs/dbraw/zinc/66/04/10/1097660410.db2.gz QYCBRQYYEOHCKL-VDNIUXDYSA-N 1 3 349.906 2.886 10 0 EFAEHO CN(C)C1(C(=O)NCC2C[NH+](CCCCc3ccccc3)C2)CCC1 ZINC001268837635 1097676221 /nfs/dbraw/zinc/67/62/21/1097676221.db2.gz AFGNWCDVUKQWNP-UHFFFAOYSA-N 1 3 343.515 2.542 10 0 EFAEHO Cc1ccc(C[NH2+]CCCN(C)C(=O)[C@H](C(C)C)N(C)C)c(C)c1 ZINC001268920434 1097719581 /nfs/dbraw/zinc/71/95/81/1097719581.db2.gz PRIBQARRXLZTQY-IBGZPJMESA-N 1 3 333.520 2.828 10 0 EFAEHO CN(CCC[NH2+]Cc1cccc2ccccc21)C(=O)CN1CCCC1 ZINC001268950455 1097739365 /nfs/dbraw/zinc/73/93/65/1097739365.db2.gz ZRCUHAZRONJZKY-UHFFFAOYSA-N 1 3 339.483 2.874 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)CN1CCCC1)c1ccc(F)cc1F ZINC001268950458 1097739749 /nfs/dbraw/zinc/73/97/49/1097739749.db2.gz ZYFRPNRKTUHCBI-CQSZACIVSA-N 1 3 339.430 2.560 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@@H](NC(=O)CCCC[NH+](C)C)C2)c1 ZINC001269192042 1097936829 /nfs/dbraw/zinc/93/68/29/1097936829.db2.gz JRUCFALXIHBIPN-LJQANCHMSA-N 1 3 331.504 2.726 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+]CCCCC(F)(F)F)CC1 ZINC001269411557 1098119171 /nfs/dbraw/zinc/11/91/71/1098119171.db2.gz LIENLXPCGKLGKD-CQSZACIVSA-N 1 3 349.441 2.830 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H]2CC[N@H+](CC=C(C)C)C2)CC1 ZINC001269553153 1098242406 /nfs/dbraw/zinc/24/24/06/1098242406.db2.gz OKBXMIGJKHURSB-IBGZPJMESA-N 1 3 335.536 2.855 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H]2CC[N@@H+](CC=C(C)C)C2)CC1 ZINC001269553153 1098242409 /nfs/dbraw/zinc/24/24/09/1098242409.db2.gz OKBXMIGJKHURSB-IBGZPJMESA-N 1 3 335.536 2.855 10 0 EFAEHO CC[C@@H](C(=O)NC1(C[NH2+]CCc2ccc(C)cc2)CCCC1)N(C)C ZINC001269576082 1098262603 /nfs/dbraw/zinc/26/26/03/1098262603.db2.gz WKSKWSFKYREYOL-IBGZPJMESA-N 1 3 345.531 2.896 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@](C)(C[NH2+]CC=C(Cl)Cl)C2CC2)C1 ZINC001269633799 1098311899 /nfs/dbraw/zinc/31/18/99/1098311899.db2.gz GAHSGKSEDHVWEJ-MLGOLLRUSA-N 1 3 348.318 2.522 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC[NH2+]CCc2ccccc2)CC1)N(C)C ZINC001269935174 1098530882 /nfs/dbraw/zinc/53/08/82/1098530882.db2.gz LLARDWAPYFQNOA-FQEVSTJZSA-N 1 3 345.531 2.788 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC[NH2+]Cc2ccccc2F)CC1)N(C)C ZINC001269934898 1098531307 /nfs/dbraw/zinc/53/13/07/1098531307.db2.gz DZJFAWOMBJKNGD-IBGZPJMESA-N 1 3 349.494 2.884 10 0 EFAEHO CN(CC[NH2+]CC1CCCCC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001481280368 1098659262 /nfs/dbraw/zinc/65/92/62/1098659262.db2.gz YKEXJKSFNGIIQB-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H]1C[NH2+]C/C=C/c1ccccc1)N(C)C ZINC001270174026 1098765959 /nfs/dbraw/zinc/76/59/59/1098765959.db2.gz HXSCBCLNJGIDSN-IJQANDGASA-N 1 3 343.515 2.867 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@@H]1CCN(Cc2ccc(CF)cc2)C1 ZINC001267751582 1098790626 /nfs/dbraw/zinc/79/06/26/1098790626.db2.gz FIUDKDINILSAOF-GOSISDBHSA-N 1 3 335.467 2.579 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[NH2+]CCCc1ccsc1)N(C)C ZINC001267958759 1098905249 /nfs/dbraw/zinc/90/52/49/1098905249.db2.gz YOLPPHQDEYBDOK-IAGOWNOFSA-N 1 3 337.533 2.602 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC2(C1)CCN(C(=O)[C@H](CC)N(C)C)CC2 ZINC001270339181 1098981765 /nfs/dbraw/zinc/98/17/65/1098981765.db2.gz CBGMHTMWFNWICV-ZEVQVBBLSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC2(C1)CCN(C(=O)[C@H](CC)N(C)C)CC2 ZINC001270339181 1098981776 /nfs/dbraw/zinc/98/17/76/1098981776.db2.gz CBGMHTMWFNWICV-ZEVQVBBLSA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001481290537 1099022858 /nfs/dbraw/zinc/02/28/58/1099022858.db2.gz LWZYRFZNNBMCER-OALUTQOASA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001481290537 1099022869 /nfs/dbraw/zinc/02/28/69/1099022869.db2.gz LWZYRFZNNBMCER-OALUTQOASA-N 1 3 347.478 2.699 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C[NH2+]CCCF)C1CCCC1 ZINC001270442373 1099093326 /nfs/dbraw/zinc/09/33/26/1099093326.db2.gz LUFPLZVHNRAGBG-ZWKOTPCHSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)CCNCc1ccccc1C(F)(F)F ZINC001481298072 1099118769 /nfs/dbraw/zinc/11/87/69/1099118769.db2.gz WHJVAQMRUKJQOL-UHFFFAOYSA-N 1 3 345.409 2.595 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)CCNCc1ccccc1C(F)(F)F ZINC001481298072 1099118779 /nfs/dbraw/zinc/11/87/79/1099118779.db2.gz WHJVAQMRUKJQOL-UHFFFAOYSA-N 1 3 345.409 2.595 10 0 EFAEHO CC[C@@H](C(=O)N1CCC([C@@H](C)[NH2+]CCCC(C)C)CC1)N(C)C ZINC001481340408 1099372631 /nfs/dbraw/zinc/37/26/31/1099372631.db2.gz QXNORBWQMCMAGZ-AEFFLSMTSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](CC[NH2+]CCC2CCCC2)C1)N(C)C ZINC001280264577 1099381339 /nfs/dbraw/zinc/38/13/39/1099381339.db2.gz YOZFGAWNLZPXJO-MOPGFXCFSA-N 1 3 337.552 2.981 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC([C@@H](C)[NH2+]C/C=C\Cl)CC1 ZINC001481344190 1099392612 /nfs/dbraw/zinc/39/26/12/1099392612.db2.gz VROPBJHBUOKIOC-ULEBIONPSA-N 1 3 341.927 2.830 10 0 EFAEHO Cc1ccc(F)c(C[N@@H+](CCCNC(=O)[C@H]2CCCN2C)C(C)C)c1 ZINC001481353636 1099435599 /nfs/dbraw/zinc/43/55/99/1099435599.db2.gz MRBJEYUOZJTFDH-LJQANCHMSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(C[N@H+](CCCNC(=O)[C@H]2CCCN2C)C(C)C)c1 ZINC001481353636 1099435604 /nfs/dbraw/zinc/43/56/04/1099435604.db2.gz MRBJEYUOZJTFDH-LJQANCHMSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CC1CC1)c1ccccc1 ZINC001481367477 1099488648 /nfs/dbraw/zinc/48/86/48/1099488648.db2.gz TUUQSRZOVZFIGW-RBUKOAKNSA-N 1 3 329.488 2.716 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CC1CC1)c1ccccc1 ZINC001481367478 1099488815 /nfs/dbraw/zinc/48/88/15/1099488815.db2.gz TUUQSRZOVZFIGW-RTBURBONSA-N 1 3 329.488 2.716 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]CCCc2ccccc2)C1)N(C)C ZINC001270745105 1099518393 /nfs/dbraw/zinc/51/83/93/1099518393.db2.gz UXZKYFOSJCJWDX-CTNGQTDRSA-N 1 3 345.531 2.788 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@](C)(C[NH2+]CCC3CCCC3)C2)C1 ZINC001270795837 1099567233 /nfs/dbraw/zinc/56/72/33/1099567233.db2.gz BATNLYZZJVGDOY-FXAWDEMLSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC1(C[NH2+]C/C=C/Cl)CCCC1 ZINC001267846308 1099615565 /nfs/dbraw/zinc/61/55/65/1099615565.db2.gz FFPUXMSRIHCVKC-JXSYMDBTSA-N 1 3 327.900 2.630 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC1(C[NH2+]C/C=C/Cl)CCCC1 ZINC001267846310 1099615838 /nfs/dbraw/zinc/61/58/38/1099615838.db2.gz FFPUXMSRIHCVKC-SHADCFSKSA-N 1 3 327.900 2.630 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC1(C[NH2+]C/C=C\Cl)CCCC1 ZINC001267846309 1099616196 /nfs/dbraw/zinc/61/61/96/1099616196.db2.gz FFPUXMSRIHCVKC-OWEGLKQLSA-N 1 3 327.900 2.630 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@H](C)N(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001482330588 1099629257 /nfs/dbraw/zinc/62/92/57/1099629257.db2.gz KJNYQUBAFJSYCK-XERWZBGXSA-N 1 3 341.515 2.992 10 0 EFAEHO C[C@H](C[NH2+]CC1CCC(C)CC1)N(C)C(=O)CN1CCC(C)CC1 ZINC001482343099 1099703315 /nfs/dbraw/zinc/70/33/15/1099703315.db2.gz FRBWJUHNJKBGIH-CUYAVPTFSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[NH2+]CC[C@@H]1CCc2ccccc21)N(C)C ZINC001481277131 1099758340 /nfs/dbraw/zinc/75/83/40/1099758340.db2.gz KTULMSUBGMDJHO-AZUAARDMSA-N 1 3 345.531 2.741 10 0 EFAEHO CC[C@@H](C(=O)N(C)[C@H](C)C[NH2+]CCc1ccc(Cl)cc1)N(C)C ZINC001482354809 1099784561 /nfs/dbraw/zinc/78/45/61/1099784561.db2.gz UHBQKOVDNIPMNR-PBHICJAKSA-N 1 3 339.911 2.659 10 0 EFAEHO C[C@@H]([NH2+]C[C@H](C)N(C)C(=O)CN1CCCC1)c1ccccc1Cl ZINC001482364240 1099843907 /nfs/dbraw/zinc/84/39/07/1099843907.db2.gz FHBMUUHDAIQPMZ-LSDHHAIUSA-N 1 3 337.895 2.933 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccccc1C1CC1)N(C)C(=O)CN1CCCC1 ZINC001482364555 1099846116 /nfs/dbraw/zinc/84/61/16/1099846116.db2.gz LPJWFBZQLWFWNC-INIZCTEOSA-N 1 3 329.488 2.596 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1cccc(C)c1 ZINC001482369850 1099872170 /nfs/dbraw/zinc/87/21/70/1099872170.db2.gz PTKYAAVCMZMTMB-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1cccc(C)c1 ZINC001482369851 1099872643 /nfs/dbraw/zinc/87/26/43/1099872643.db2.gz PTKYAAVCMZMTMB-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)C[C@H](CNCc1ccccn1)NC(=O)[C@@H]1CCC[N@@H+]1C(C)C ZINC001482384543 1099960757 /nfs/dbraw/zinc/96/07/57/1099960757.db2.gz SLXRZFMZIFDYET-MOPGFXCFSA-N 1 3 346.519 2.575 10 0 EFAEHO CC(C)C[C@H](CNCc1ccccn1)NC(=O)[C@@H]1CCC[N@H+]1C(C)C ZINC001482384543 1099960772 /nfs/dbraw/zinc/96/07/72/1099960772.db2.gz SLXRZFMZIFDYET-MOPGFXCFSA-N 1 3 346.519 2.575 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001271092234 1100466142 /nfs/dbraw/zinc/46/61/42/1100466142.db2.gz GCKMYMYVJBHRRR-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001271092234 1100466145 /nfs/dbraw/zinc/46/61/45/1100466145.db2.gz GCKMYMYVJBHRRR-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001271092236 1100467460 /nfs/dbraw/zinc/46/74/60/1100467460.db2.gz GCKMYMYVJBHRRR-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001271092236 1100467465 /nfs/dbraw/zinc/46/74/65/1100467465.db2.gz GCKMYMYVJBHRRR-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC1CCN(CC(=O)N2CCCC[C@@H]2CC[NH2+]CCC2CC2)CC1 ZINC001482459362 1100519849 /nfs/dbraw/zinc/51/98/49/1100519849.db2.gz XPSFNWUHJNBCEL-LJQANCHMSA-N 1 3 335.536 2.879 10 0 EFAEHO CCC(CC)[NH2+]CCNC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC001635073276 1100642614 /nfs/dbraw/zinc/64/26/14/1100642614.db2.gz DALFGRPDJNTZAH-MAUKXSAKSA-N 1 3 334.508 2.755 10 0 EFAEHO C[C@H](C[NH2+]CC/C=C/c1ccccc1)N(C)C(=O)CN1CCCC1 ZINC001271207568 1101286585 /nfs/dbraw/zinc/28/65/85/1101286585.db2.gz NWGTXHZYPNOILH-NORHQAJESA-N 1 3 329.488 2.622 10 0 EFAEHO CC(C)(C(=O)N[C@H]1C[C@H]([NH2+]CCCCCF)C1)N1CCCCC1 ZINC001266593552 1101318650 /nfs/dbraw/zinc/31/86/50/1101318650.db2.gz ODKONMOTFVLFBK-WKILWMFISA-N 1 3 327.488 2.628 10 0 EFAEHO CC(C)C[C@H](C[NH2+]CCC(C)(C)C)NC(=O)CN1CC[C@H](C)C1 ZINC001271292486 1101343594 /nfs/dbraw/zinc/34/35/94/1101343594.db2.gz BSVQKFSGKDDTQD-DLBZAZTESA-N 1 3 325.541 2.885 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]CCCF)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001271295853 1101348460 /nfs/dbraw/zinc/34/84/60/1101348460.db2.gz YILZWSWAXSNQPE-YJBOKZPZSA-N 1 3 347.494 2.679 10 0 EFAEHO CC(C)(C)OC(=O)NCCNC1CC[NH+](CCc2ccccc2)CC1 ZINC000066112364 1101372203 /nfs/dbraw/zinc/37/22/03/1101372203.db2.gz WSDGUNMLUALKBF-UHFFFAOYSA-N 1 3 347.503 2.808 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C[NH2+]C/C=C\Cl)C1CCCCC1)N(C)C ZINC001271355612 1101433145 /nfs/dbraw/zinc/43/31/45/1101433145.db2.gz YFHDVFRSCLDKHM-BEBBCNLGSA-N 1 3 343.943 2.980 10 0 EFAEHO CC/C=C\CC[NH2+][C@H]1C[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001266620472 1101540981 /nfs/dbraw/zinc/54/09/81/1101540981.db2.gz YHSZUYOFFQQRCS-ALPWIFEQSA-N 1 3 339.499 2.792 10 0 EFAEHO C=C/C=C\CCN1CCN(c2ccccc2OCC[NH+](C)C)CC1 ZINC001652804812 1101548591 /nfs/dbraw/zinc/54/85/91/1101548591.db2.gz IUOYZHHCOFGMNN-WAYWQWQTSA-N 1 3 329.488 2.881 10 0 EFAEHO COc1ccc([C@@H](C)[NH2+]CCCN2CCN(C(C)C)CC2)c(OC)c1 ZINC001655092869 1101783879 /nfs/dbraw/zinc/78/38/79/1101783879.db2.gz NXJCILSXLQZDOU-QGZVFWFLSA-N 1 3 349.519 2.771 10 0 EFAEHO CCCCCC[NH+]1CCC2(C[C@H]2NC(=O)Cc2nc[nH]c2C)CC1 ZINC001266381060 1101791386 /nfs/dbraw/zinc/79/13/86/1101791386.db2.gz WZWOEMNLYVFPHF-QGZVFWFLSA-N 1 3 332.492 2.812 10 0 EFAEHO CCC[N@@H+]1CC[C@H](CN[C@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)C1 ZINC000693030705 1101987859 /nfs/dbraw/zinc/98/78/59/1101987859.db2.gz JHYNZISIDJVLDR-BBWFWOEESA-N 1 3 339.524 2.953 10 0 EFAEHO CCC[N@H+]1CC[C@H](CN[C@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)C1 ZINC000693030705 1101987866 /nfs/dbraw/zinc/98/78/66/1101987866.db2.gz JHYNZISIDJVLDR-BBWFWOEESA-N 1 3 339.524 2.953 10 0 EFAEHO CCCN1CC[C@H](C[NH2+][C@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)C1 ZINC000693030705 1101987874 /nfs/dbraw/zinc/98/78/74/1101987874.db2.gz JHYNZISIDJVLDR-BBWFWOEESA-N 1 3 339.524 2.953 10 0 EFAEHO CN(CC[NH2+]Cc1ccc(C(F)F)cc1)C(=O)CN(C)C1CCC1 ZINC001266726438 1102034699 /nfs/dbraw/zinc/03/46/99/1102034699.db2.gz VXHVLDYYQCPETI-UHFFFAOYSA-N 1 3 339.430 2.657 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CN(C)C2CCC2)[C@H]1CC[NH2+]C/C=C/Cl ZINC001656434311 1102074860 /nfs/dbraw/zinc/07/48/60/1102074860.db2.gz JXZXSNRUHWEBTJ-UKMLVYKYSA-N 1 3 341.927 2.830 10 0 EFAEHO CCCC[NH2+][C@@H](C)[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001271562736 1102119241 /nfs/dbraw/zinc/11/92/41/1102119241.db2.gz UQOBLLDFMUELHY-LPHOPBHVSA-N 1 3 331.504 2.989 10 0 EFAEHO Cc1ccncc1C[NH2+]CC[C@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001271608021 1102171950 /nfs/dbraw/zinc/17/19/50/1102171950.db2.gz ICNWTICEFCWLEX-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H](C[NH2+]CCCC2CCC2)C1)C1CCC1 ZINC001266790729 1102241915 /nfs/dbraw/zinc/24/19/15/1102241915.db2.gz MNFABPYZGJSEDJ-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001266807028 1102289711 /nfs/dbraw/zinc/28/97/11/1102289711.db2.gz BODFBOAWDNDTQE-CVEARBPZSA-N 1 3 329.504 2.541 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]CCCc2ccccc2)C1 ZINC001271721170 1102311624 /nfs/dbraw/zinc/31/16/24/1102311624.db2.gz KNVHZKCSMDVFJR-AZUAARDMSA-N 1 3 345.531 2.644 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC[C@H](C[NH2+]C/C=C/Cl)C2)c1 ZINC001266823315 1102354601 /nfs/dbraw/zinc/35/46/01/1102354601.db2.gz OTDVQHVSIFGHOO-HFTQHKIXSA-N 1 3 349.906 2.943 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC[C@@H](C[NH2+]C/C=C\Cl)C2)c1 ZINC001266823318 1102354967 /nfs/dbraw/zinc/35/49/67/1102354967.db2.gz OTDVQHVSIFGHOO-OOYWPUHTSA-N 1 3 349.906 2.943 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C)[C@@H]1C[NH2+]CCC(C)(C)C ZINC001482497573 1102362199 /nfs/dbraw/zinc/36/21/99/1102362199.db2.gz HLNPXKZYGRDXRW-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@H]1C[NH2+]C/C=C/c1ccccc1 ZINC001266865309 1102517305 /nfs/dbraw/zinc/51/73/05/1102517305.db2.gz SFQLTQUMLPRYQR-ZFYMRNONSA-N 1 3 341.499 2.765 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CCCC[C@@H]2CNCC=C(Cl)Cl)CC1 ZINC001266878356 1102570977 /nfs/dbraw/zinc/57/09/77/1102570977.db2.gz YMABJYYJHSNQDU-CYBMUJFWSA-N 1 3 348.318 2.618 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCCC[C@@H]1CNCC=C(Cl)Cl ZINC001266879708 1102576239 /nfs/dbraw/zinc/57/62/39/1102576239.db2.gz CKSWYBIYDYDSSS-CYBMUJFWSA-N 1 3 336.307 2.618 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCCC[C@@H]1CNCC=C(Cl)Cl ZINC001266879708 1102576244 /nfs/dbraw/zinc/57/62/44/1102576244.db2.gz CKSWYBIYDYDSSS-CYBMUJFWSA-N 1 3 336.307 2.618 10 0 EFAEHO CN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1ccc2cc[nH]c2c1 ZINC001480898184 1102613180 /nfs/dbraw/zinc/61/31/80/1102613180.db2.gz HGAHEDYZDRPBGC-UHFFFAOYSA-N 1 3 342.487 2.590 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@H+](C)[C@@H]2CCc3c2cccc3F)CCC1 ZINC001660170663 1102625751 /nfs/dbraw/zinc/62/57/51/1102625751.db2.gz QYKVWARWHFLMQF-GOSISDBHSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@@H+](C)[C@@H]2CCc3c2cccc3F)CCC1 ZINC001660170663 1102625759 /nfs/dbraw/zinc/62/57/59/1102625759.db2.gz QYKVWARWHFLMQF-GOSISDBHSA-N 1 3 347.478 2.735 10 0 EFAEHO Cc1cc(C[N@@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C)cs1 ZINC001660180281 1102628164 /nfs/dbraw/zinc/62/81/64/1102628164.db2.gz SRYRHXNWUIZZMY-INIZCTEOSA-N 1 3 325.522 2.581 10 0 EFAEHO Cc1cc(C[N@H+](C)CCCNC(=O)[C@H](C(C)C)N(C)C)cs1 ZINC001660180281 1102628172 /nfs/dbraw/zinc/62/81/72/1102628172.db2.gz SRYRHXNWUIZZMY-INIZCTEOSA-N 1 3 325.522 2.581 10 0 EFAEHO CC(C)[C@H](C(=O)NCCCN(C)[C@H](C)c1ccccc1F)[NH+](C)C ZINC001660295788 1102674966 /nfs/dbraw/zinc/67/49/66/1102674966.db2.gz YXQFKZNCSGSSJP-CRAIPNDOSA-N 1 3 337.483 2.911 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H]([NH2+]CC/C=C/c2ccccc2)C1)N(C)C ZINC001266559628 1102746234 /nfs/dbraw/zinc/74/62/34/1102746234.db2.gz HHXPGNOHQMIENT-GLUHHYBVSA-N 1 3 329.488 2.621 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1cc(C)cc(C)c1 ZINC001660590010 1102871943 /nfs/dbraw/zinc/87/19/43/1102871943.db2.gz UJUQTLLMGJFGIK-QGZVFWFLSA-N 1 3 345.531 2.973 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1cc(C)cc(C)c1 ZINC001660590010 1102871951 /nfs/dbraw/zinc/87/19/51/1102871951.db2.gz UJUQTLLMGJFGIK-QGZVFWFLSA-N 1 3 345.531 2.973 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(C[C@H]2NC(=O)CN(C)C2CCC2)CC1 ZINC001661066958 1103108278 /nfs/dbraw/zinc/10/82/78/1103108278.db2.gz SEXAJBLHQQJTTA-SHCNBLLESA-N 1 3 333.520 2.798 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(C[C@@H]2NC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001661073145 1103114298 /nfs/dbraw/zinc/11/42/98/1103114298.db2.gz MAJNVMCSGDPCJF-ZLKFPQNLSA-N 1 3 333.520 2.655 10 0 EFAEHO CN(CC(=O)NC[C@@H]([NH2+]CC1=CCCCC1)C1CC1)CC(C)(C)C ZINC001661167845 1103155603 /nfs/dbraw/zinc/15/56/03/1103155603.db2.gz KUSJAPXDGZDLPT-GOSISDBHSA-N 1 3 335.536 2.949 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001661554528 1103310016 /nfs/dbraw/zinc/31/00/16/1103310016.db2.gz CHVMFHZXGYYOEL-CMDLKFMISA-N 1 3 330.476 2.621 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001661554528 1103310030 /nfs/dbraw/zinc/31/00/30/1103310030.db2.gz CHVMFHZXGYYOEL-CMDLKFMISA-N 1 3 330.476 2.621 10 0 EFAEHO C[C@H](C[N@H+](C)C[C@H]1CCCC(F)(F)C1)NC(=O)CN(C)C1CCC1 ZINC001483347719 1103449770 /nfs/dbraw/zinc/44/97/70/1103449770.db2.gz NAWUBDBIYUIFTB-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C[N@@H+](C)C[C@H]1CCCC(F)(F)C1)NC(=O)CN(C)C1CCC1 ZINC001483347719 1103449773 /nfs/dbraw/zinc/44/97/73/1103449773.db2.gz NAWUBDBIYUIFTB-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)(C(=O)N1CCCC[C@H]1C[NH2+]CCCF)N1CCCCC1 ZINC001661921439 1103505254 /nfs/dbraw/zinc/50/52/54/1103505254.db2.gz ANDWQQWFVYEXMB-INIZCTEOSA-N 1 3 327.488 2.581 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(C(F)F)c1)NC(=O)CC[NH+](C)C ZINC001483380311 1103547336 /nfs/dbraw/zinc/54/73/36/1103547336.db2.gz BCBGBJMBMSVPLK-ZDUSSCGKSA-N 1 3 327.419 2.512 10 0 EFAEHO C[C@@H](CN(C)Cc1ccccc1C(F)(F)F)NC(=O)CC[NH+](C)C ZINC001483380327 1103547565 /nfs/dbraw/zinc/54/75/65/1103547565.db2.gz BHYZRSJIJAIAHP-ZDUSSCGKSA-N 1 3 345.409 2.594 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC(C)(C)C[NH2+]Cc1ccc(F)cc1 ZINC001409504160 1103561247 /nfs/dbraw/zinc/56/12/47/1103561247.db2.gz HZPGQTCHFRSWDP-UHFFFAOYSA-N 1 3 337.483 2.740 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]([NH2+]CCC1CCCCC1)C(C)C ZINC001482568924 1103651259 /nfs/dbraw/zinc/65/12/59/1103651259.db2.gz XLEVRLYOAOMCEX-GOSISDBHSA-N 1 3 334.508 2.961 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC/C=C\c1ccccc1 ZINC001662334694 1103666626 /nfs/dbraw/zinc/66/66/26/1103666626.db2.gz KOCQJHSDAJVNEI-QPLDTRMYSA-N 1 3 329.488 2.526 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)CCc1cccs1 ZINC001483419285 1103669982 /nfs/dbraw/zinc/66/99/82/1103669982.db2.gz AGSRZMIRUOTJNM-DOTOQJQBSA-N 1 3 337.533 2.602 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCc1cccs1 ZINC001483419285 1103669987 /nfs/dbraw/zinc/66/99/87/1103669987.db2.gz AGSRZMIRUOTJNM-DOTOQJQBSA-N 1 3 337.533 2.602 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C(C)C)c(C)s1 ZINC001482572431 1103712729 /nfs/dbraw/zinc/71/27/29/1103712729.db2.gz SNMOYBCUEGKBSE-KRWDZBQOSA-N 1 3 339.549 2.936 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(Cl)s1 ZINC001482573149 1103716729 /nfs/dbraw/zinc/71/67/29/1103716729.db2.gz UZOSCXNQDXBGQM-CQSZACIVSA-N 1 3 345.940 2.972 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H](C[NH2+]C/C=C/c3ccccc3)C2)CCC1 ZINC001662639678 1103740555 /nfs/dbraw/zinc/74/05/55/1103740555.db2.gz CLVSHNVSVHFQRY-IUYMFKLXSA-N 1 3 341.499 2.622 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)CN1CC[C@@H](C)C1)c1ccc(F)cc1 ZINC001483492787 1103827068 /nfs/dbraw/zinc/82/70/68/1103827068.db2.gz KLKBXMBHOIGUHY-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]Cc1ccc(F)c(Cl)c1)N(C)C ZINC001483504173 1103856296 /nfs/dbraw/zinc/85/62/96/1103856296.db2.gz HXHIDIFASIDDGO-INIZCTEOSA-N 1 3 343.874 2.757 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001483504116 1103864906 /nfs/dbraw/zinc/86/49/06/1103864906.db2.gz FJRAKUUQOPZLPW-QGZVFWFLSA-N 1 3 339.911 2.927 10 0 EFAEHO CCCCC[NH2+][C@H](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001662975047 1103914011 /nfs/dbraw/zinc/91/40/11/1103914011.db2.gz SPWKJYKRYZPUPO-CRAIPNDOSA-N 1 3 329.504 2.874 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1C/C=C\Cl)N(C)C ZINC001663071762 1103960076 /nfs/dbraw/zinc/96/00/76/1103960076.db2.gz IPGGRZHDAYUVJG-SELBCVKXSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@@H]1CCC[N@H+]1C/C=C\Cl)N(C)C ZINC001663071762 1103960083 /nfs/dbraw/zinc/96/00/83/1103960083.db2.gz IPGGRZHDAYUVJG-SELBCVKXSA-N 1 3 329.916 2.686 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[C@@H]1CCC[N@@H+]1CC1CCCC1 ZINC001663119376 1103993665 /nfs/dbraw/zinc/99/36/65/1103993665.db2.gz GXPNGHVKOWGSKV-QGZVFWFLSA-N 1 3 332.492 2.812 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[C@@H]1CCC[N@H+]1CC1CCCC1 ZINC001663119376 1103993672 /nfs/dbraw/zinc/99/36/72/1103993672.db2.gz GXPNGHVKOWGSKV-QGZVFWFLSA-N 1 3 332.492 2.812 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[C@H]1CCC[N@@H+]1CCC(F)(F)F ZINC001663124018 1103998759 /nfs/dbraw/zinc/99/87/59/1103998759.db2.gz OXBCFSZBBVSRGY-AWEZNQCLSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[C@H]1CCC[N@H+]1CCC(F)(F)F ZINC001663124018 1103998766 /nfs/dbraw/zinc/99/87/66/1103998766.db2.gz OXBCFSZBBVSRGY-AWEZNQCLSA-N 1 3 337.430 2.640 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H](C[NH2+]C/C=C/Cl)C2CC2)c1 ZINC001483606513 1104055748 /nfs/dbraw/zinc/05/57/48/1104055748.db2.gz DFRUJXCHKLMASB-MDGVGCGJSA-N 1 3 335.879 2.599 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H](C[NH2+]C/C=C\Cl)C2CC2)c1 ZINC001483606511 1104055772 /nfs/dbraw/zinc/05/57/72/1104055772.db2.gz DFRUJXCHKLMASB-ASRSSLEJSA-N 1 3 335.879 2.599 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCNCc1ccc(Cl)c(F)c1)[NH+](C)C ZINC001663996128 1104259072 /nfs/dbraw/zinc/25/90/72/1104259072.db2.gz RZSWWTQQRPVCEH-INIZCTEOSA-N 1 3 343.874 2.613 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N(C)CCNCc2cc3ccccc3o2)CC[N@@H+]1C ZINC001664142260 1104296805 /nfs/dbraw/zinc/29/68/05/1104296805.db2.gz IKOLXMCRZCMIDF-RDJZCZTQSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N(C)CCNCc2cc3ccccc3o2)CC[N@H+]1C ZINC001664142260 1104296809 /nfs/dbraw/zinc/29/68/09/1104296809.db2.gz IKOLXMCRZCMIDF-RDJZCZTQSA-N 1 3 343.471 2.711 10 0 EFAEHO CCCc1ccc(C[NH2+]CCN(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001664186544 1104311578 /nfs/dbraw/zinc/31/15/78/1104311578.db2.gz OWOCGRIVIWAHLA-KRWDZBQOSA-N 1 3 331.504 2.529 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@@H](C(C)C)[NH+](C)C)c(Cl)c1 ZINC001664321298 1104350579 /nfs/dbraw/zinc/35/05/79/1104350579.db2.gz NUSOXNBCKXDOMH-QGZVFWFLSA-N 1 3 339.911 2.783 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]C/C=C\c1ccccc1 ZINC001664395489 1104377393 /nfs/dbraw/zinc/37/73/93/1104377393.db2.gz RYVBBYJPXPVDPX-UZRURVBFSA-N 1 3 329.488 2.622 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N(C)CC[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001482600138 1104420324 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2.677 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[N@H+](C)CC1CCC(C)(C)CC1 ZINC001409612572 1104507607 /nfs/dbraw/zinc/50/76/07/1104507607.db2.gz CKFKLJRGNLNBGZ-IRXDYDNUSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[N@@H+](C)CC1CCC(C)(C)CC1 ZINC001409612572 1104507617 /nfs/dbraw/zinc/50/76/17/1104507617.db2.gz CKFKLJRGNLNBGZ-IRXDYDNUSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccccc1CCC[N@@H+](C)[C@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001409614621 1104512525 /nfs/dbraw/zinc/51/25/25/1104512525.db2.gz GREJAAKFARVLGC-PKOBYXMFSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccccc1CCC[N@H+](C)[C@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001409614621 1104512535 /nfs/dbraw/zinc/51/25/35/1104512535.db2.gz GREJAAKFARVLGC-PKOBYXMFSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H](C)[N@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001409616877 1104527579 /nfs/dbraw/zinc/52/75/79/1104527579.db2.gz WQIZVXKJTNKBDH-KXBFYZLASA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H](C)[N@@H+](C)Cc1ccc(C2CC2)cc1)N(C)C ZINC001409616877 1104527591 /nfs/dbraw/zinc/52/75/91/1104527591.db2.gz WQIZVXKJTNKBDH-KXBFYZLASA-N 1 3 331.504 2.841 10 0 EFAEHO C[C@H](CNC(=O)CC[NH+](C)C)N(C)C/C=C/c1ccc(Cl)cc1 ZINC001409618333 1104531040 /nfs/dbraw/zinc/53/10/40/1104531040.db2.gz CMDCYEWLAZWARF-LLYBFZRZSA-N 1 3 337.895 2.741 10 0 EFAEHO C[C@H](CNC(=O)CC[NH+](C)C)N(C)Cc1ccc(C(F)F)cc1 ZINC001409633047 1104568214 /nfs/dbraw/zinc/56/82/14/1104568214.db2.gz SEFPHBQWWPILRH-CYBMUJFWSA-N 1 3 327.419 2.512 10 0 EFAEHO CN(CC[N@H+](C)CC1CCCC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001482628502 1104687917 /nfs/dbraw/zinc/68/79/17/1104687917.db2.gz UHODDDOREXRHGO-IBGZPJMESA-N 1 3 341.515 2.779 10 0 EFAEHO CN(CC[N@@H+](C)CC1CCCC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001482628502 1104687921 /nfs/dbraw/zinc/68/79/21/1104687921.db2.gz UHODDDOREXRHGO-IBGZPJMESA-N 1 3 341.515 2.779 10 0 EFAEHO CC/C=C\CCN1C[C@@H]2C[C@H]1CN2C(=O)CCCC[NH+]1CCCC1 ZINC001665432417 1104695073 /nfs/dbraw/zinc/69/50/73/1104695073.db2.gz ADRBOQLBYYLEHJ-FPXQDXNASA-N 1 3 333.520 2.894 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@@](F)(C(=O)N[C@@H]2CCN(CCCCCF)C2)C1 ZINC001665574282 1104717269 /nfs/dbraw/zinc/71/72/69/1104717269.db2.gz WNSHFBVXXSMRMD-QAPCUYQASA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)N[C@@H]2CCN(CCCCCF)C2)C1 ZINC001665574282 1104717276 /nfs/dbraw/zinc/71/72/76/1104717276.db2.gz WNSHFBVXXSMRMD-QAPCUYQASA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N[C@@H]2CC[N@H+](CCCCCF)C2)C1 ZINC001665574282 1104717281 /nfs/dbraw/zinc/71/72/81/1104717281.db2.gz WNSHFBVXXSMRMD-QAPCUYQASA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N[C@@H]2CC[N@@H+](CCCCCF)C2)C1 ZINC001665574282 1104717287 /nfs/dbraw/zinc/71/72/87/1104717287.db2.gz WNSHFBVXXSMRMD-QAPCUYQASA-N 1 3 345.478 2.529 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](CC[NH2+]Cc2ccsc2)C1)N(C)C ZINC001666119899 1104873223 /nfs/dbraw/zinc/87/32/23/1104873223.db2.gz JCAQTDAEDFGORC-NVXWUHKLSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](CC[NH2+]Cc2cccc(F)c2)C1 ZINC001666172602 1104892681 /nfs/dbraw/zinc/89/26/81/1104892681.db2.gz JRJXDYOWLLSCJG-QGZVFWFLSA-N 1 3 349.494 2.884 10 0 EFAEHO CN(C)C1(C(=O)N2CCC(CC[NH2+]CC3CCCC3)CC2)CCC1 ZINC001666219206 1104905390 /nfs/dbraw/zinc/90/53/90/1104905390.db2.gz NZVMSVBNEVMWHT-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CCC[C@@H]1C[NH2+]CCC(F)(F)F)N1CCCC1 ZINC001482684066 1104922490 /nfs/dbraw/zinc/92/24/90/1104922490.db2.gz KVAQBRVOKXDNLY-KGLIPLIRSA-N 1 3 349.441 2.688 10 0 EFAEHO CCCCC[NH2+]C[C@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001666458863 1104945944 /nfs/dbraw/zinc/94/59/44/1104945944.db2.gz ZPHLWSSZBBMFTG-VQIMIIECSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]Cc1ccc(F)cc1 ZINC001482696588 1104952741 /nfs/dbraw/zinc/95/27/41/1104952741.db2.gz CUUHFOIRMRFBCX-SJLPKXTDSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]1C[NH2+]CC1CC2(CCC2)C1 ZINC001482697717 1104953520 /nfs/dbraw/zinc/95/35/20/1104953520.db2.gz HEMYRYRDFFADEV-ROUUACIJSA-N 1 3 335.536 2.781 10 0 EFAEHO O=C(CN1CCCC1)N1CCC2(CC[N@@H+](CCCCCF)C2)CC1 ZINC001666501256 1104954331 /nfs/dbraw/zinc/95/43/31/1104954331.db2.gz RZYOVMQJCJVWDH-UHFFFAOYSA-N 1 3 339.499 2.537 10 0 EFAEHO O=C(CN1CCCC1)N1CCC2(CC[N@H+](CCCCCF)C2)CC1 ZINC001666501256 1104954338 /nfs/dbraw/zinc/95/43/38/1104954338.db2.gz RZYOVMQJCJVWDH-UHFFFAOYSA-N 1 3 339.499 2.537 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H]1CCC[C@@H]1NC(=O)CN(C)C(C)C ZINC001482698763 1104955968 /nfs/dbraw/zinc/95/59/68/1104955968.db2.gz MYOANPSCXYBANB-MJGOQNOKSA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@@H](C[NH2+]C/C=C/c1ccc(Cl)cc1)N(C)C(=O)CN1CCCC1 ZINC001667054965 1105042968 /nfs/dbraw/zinc/04/29/68/1105042968.db2.gz VXZLYOYBXUORPT-JFDDCEBESA-N 1 3 349.906 2.886 10 0 EFAEHO C[C@H](C[NH2+]C/C=C\c1ccc(Cl)cc1)N(C)C(=O)CN1CCCC1 ZINC001667054967 1105043318 /nfs/dbraw/zinc/04/33/18/1105043318.db2.gz VXZLYOYBXUORPT-OGZRUICASA-N 1 3 349.906 2.886 10 0 EFAEHO C[C@H](CNCC=C(Cl)Cl)N(C)C(=O)CC[NH+]1CCCCC1 ZINC001667058383 1105043324 /nfs/dbraw/zinc/04/33/24/1105043324.db2.gz DTXQQWZVNCMCDC-CYBMUJFWSA-N 1 3 336.307 2.618 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@H]1CC[NH2+]Cc1ccsc1 ZINC001667279179 1105106428 /nfs/dbraw/zinc/10/64/28/1105106428.db2.gz NJKLIYQZKQYZQW-DLBZAZTESA-N 1 3 335.517 2.703 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]Cc1ccsc1 ZINC001667279180 1105106490 /nfs/dbraw/zinc/10/64/90/1105106490.db2.gz NJKLIYQZKQYZQW-IAGOWNOFSA-N 1 3 335.517 2.703 10 0 EFAEHO C[C@@H](CCNCc1nccs1)NC(=O)c1ccc(C[NH+](C)C)cc1 ZINC001482880346 1105137560 /nfs/dbraw/zinc/13/75/60/1105137560.db2.gz NBMZBLPAFMCXEW-AWEZNQCLSA-N 1 3 346.500 2.503 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@@H]1C[NH2+]CCC(C)(C)C ZINC001667400685 1105140645 /nfs/dbraw/zinc/14/06/45/1105140645.db2.gz MLGSXZIYVATACC-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)cc1F ZINC001482900713 1105145305 /nfs/dbraw/zinc/14/53/05/1105145305.db2.gz FISPOMSORFPSRA-ZDUSSCGKSA-N 1 3 343.874 2.804 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(CC(C)C)cc1)C(=O)[C@@H]1CCCN1C ZINC001482914915 1105176886 /nfs/dbraw/zinc/17/68/86/1105176886.db2.gz WXTFYTCKEHZTCK-FQEVSTJZSA-N 1 3 345.531 2.917 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C(F)F)cc1)C(=O)[C@H]1CCCN1C ZINC001482942436 1105212162 /nfs/dbraw/zinc/21/21/62/1105212162.db2.gz NKGUXHFRBULGPP-MRXNPFEDSA-N 1 3 339.430 2.657 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccccc1)NC(=O)C(C)(C)N1CCCCC1 ZINC001668059424 1105228060 /nfs/dbraw/zinc/22/80/60/1105228060.db2.gz GHZSJSVHQTVKOC-QGZVFWFLSA-N 1 3 331.504 2.936 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccc2cc[nH]c2c1)NC(=O)C1(N(C)C)CCC1 ZINC001668086435 1105233054 /nfs/dbraw/zinc/23/30/54/1105233054.db2.gz BHRLFIDCCARKFQ-HNNXBMFYSA-N 1 3 342.487 2.637 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H](C)NC(=O)CN(C)C2CCC2)cc1C ZINC001668091720 1105233781 /nfs/dbraw/zinc/23/37/81/1105233781.db2.gz APIOXDCKRKFNHR-KRWDZBQOSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)CC[NH2+]CC[C@@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001668215042 1105258835 /nfs/dbraw/zinc/25/88/35/1105258835.db2.gz VDAOARYMTJMDBR-CRAIPNDOSA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)CC[NH2+]CCc1ccccc1 ZINC001668234279 1105262947 /nfs/dbraw/zinc/26/29/47/1105262947.db2.gz HJPWYLFEJIURKE-QUCCMNQESA-N 1 3 345.531 2.976 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+]C[C@H]1CCc2ccccc2C1 ZINC001668320352 1105281066 /nfs/dbraw/zinc/28/10/66/1105281066.db2.gz PUNZGEGYYQVSSS-ROUUACIJSA-N 1 3 345.531 2.616 10 0 EFAEHO CCN(CCNCc1ccc(C)nc1C)C(=O)C(C)(C)[NH+]1CCCC1 ZINC001668516865 1105312703 /nfs/dbraw/zinc/31/27/03/1105312703.db2.gz FWTFZFYVSHAUIN-UHFFFAOYSA-N 1 3 346.519 2.511 10 0 EFAEHO CCN(CCNCc1cc(Cl)cc(Cl)c1)C(=O)CC[NH+](C)C ZINC001668541683 1105317748 /nfs/dbraw/zinc/31/77/48/1105317748.db2.gz COTBDANIFMWRPA-UHFFFAOYSA-N 1 3 346.302 2.883 10 0 EFAEHO CN(C)C1(C(=O)NC/C=C/C[NH2+]C[C@@H]2CCCC(F)(F)C2)CCC1 ZINC001668864185 1105388719 /nfs/dbraw/zinc/38/87/19/1105388719.db2.gz DFKFEMRJNQKPON-NHZBNJEXSA-N 1 3 343.462 2.558 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C\CNC(=O)C12CCC[NH+]1CCC2 ZINC001668912939 1105397966 /nfs/dbraw/zinc/39/79/66/1105397966.db2.gz WULRFIBNGJFQRW-IHWYPQMZSA-N 1 3 345.462 2.525 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)[C@@H]2CCC[C@@H]([NH+](C)C)C2)cs1 ZINC001669138371 1105441611 /nfs/dbraw/zinc/44/16/11/1105441611.db2.gz HJVQPCJMXWVLID-UBZMYNMCSA-N 1 3 349.544 2.939 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\CNCc1cc2ccccc2o1)[NH+](C)C ZINC001669151816 1105444968 /nfs/dbraw/zinc/44/49/68/1105444968.db2.gz XUDLNABBGROXDW-QULHZPMSSA-N 1 3 343.471 2.781 10 0 EFAEHO O=C(CN1CCCC1)NC/C=C/C[NH2+][C@H]1CCc2c1cccc2Cl ZINC001669189447 1105453293 /nfs/dbraw/zinc/45/32/93/1105453293.db2.gz NKPOUBFDHKRCHG-KROLTMCQSA-N 1 3 347.890 2.685 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C\C[NH2+]Cc1c(C)cccc1C ZINC001669206718 1105456902 /nfs/dbraw/zinc/45/69/02/1105456902.db2.gz GPFKHOVRRHMYDH-PXDRNWIDSA-N 1 3 343.515 2.940 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\CNC/C=C\Cl)[NH+]1CCCCC1 ZINC001669207873 1105457883 /nfs/dbraw/zinc/45/78/83/1105457883.db2.gz PSJJUEAJBJSOIN-GHYJPDCTSA-N 1 3 327.900 2.511 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]C/C=C\c1ccccc1 ZINC001669750113 1105514589 /nfs/dbraw/zinc/51/45/89/1105514589.db2.gz DYIZRRYGBLYCFW-OIPCOOBTSA-N 1 3 329.488 2.669 10 0 EFAEHO CN(CC(=O)NC/C=C/C[NH2+][C@@H]1CCCc2ccccc21)C1CCC1 ZINC001483018864 1105561623 /nfs/dbraw/zinc/56/16/23/1105561623.db2.gz SAKAMZIUORJUBS-DPZZJQGRSA-N 1 3 341.499 2.810 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)C1(N(C)C)CCC1)c1ccc(F)cc1 ZINC001670124701 1105584191 /nfs/dbraw/zinc/58/41/91/1105584191.db2.gz ZMIYLMDCRLTKGK-OAHLLOKOSA-N 1 3 335.467 2.809 10 0 EFAEHO CCc1ccccc1C[NH2+]CCCN(C)C(=O)CN1CCC(C)CC1 ZINC001670291643 1105611585 /nfs/dbraw/zinc/61/15/85/1105611585.db2.gz SNLPGWRWPJMXHR-UHFFFAOYSA-N 1 3 345.531 2.919 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC[C@H]2C[NH2+]C/C=C\Cl)c1 ZINC001671385434 1105632485 /nfs/dbraw/zinc/63/24/85/1105632485.db2.gz WOHOQVKANLMCLB-OOYWPUHTSA-N 1 3 335.879 2.695 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]C/C=C/Cl)C1CCCC1 ZINC001671530547 1105652131 /nfs/dbraw/zinc/65/21/31/1105652131.db2.gz OOWAPDGVTGQMQJ-HYMNUWHNSA-N 1 3 341.927 2.876 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)[C@H](CC)N(C)C)C1 ZINC001671972119 1105742227 /nfs/dbraw/zinc/74/22/27/1105742227.db2.gz MLYJAHSUBYSPFA-KJMJWJSPSA-N 1 3 345.478 2.756 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC(F)(F)[C@H](CNC(=O)[C@H](CC)N(C)C)C1 ZINC001671972119 1105742232 /nfs/dbraw/zinc/74/22/32/1105742232.db2.gz MLYJAHSUBYSPFA-KJMJWJSPSA-N 1 3 345.478 2.756 10 0 EFAEHO CCCCC[N@@H+]1C[C@@H]2CCCN(C(=O)[C@@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001672554616 1105871950 /nfs/dbraw/zinc/87/19/50/1105871950.db2.gz WRKWAJPCUVNIPY-GBESFXJTSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCCC[N@H+]1C[C@@H]2CCCN(C(=O)[C@@H]3CCCN3C(C)C)[C@@H]2C1 ZINC001672554616 1105871959 /nfs/dbraw/zinc/87/19/59/1105871959.db2.gz WRKWAJPCUVNIPY-GBESFXJTSA-N 1 3 335.536 2.972 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H](CC[NH2+]CC3CCCCC3)C2)CCC1 ZINC001672805985 1105908176 /nfs/dbraw/zinc/90/81/76/1105908176.db2.gz RPDLQPKTQHHZIY-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@@H]1CCCN(CCC(F)(F)F)CC1 ZINC001673402339 1106019413 /nfs/dbraw/zinc/01/94/13/1106019413.db2.gz RHMWCKLJLDHNFL-CQSZACIVSA-N 1 3 337.430 2.641 10 0 EFAEHO C[C@@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@@H]1[NH2+]CCCC1CCCC1 ZINC001673876999 1106094930 /nfs/dbraw/zinc/09/49/30/1106094930.db2.gz BJQZUJAYHKTFDY-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(CC(=O)NC1(C[NH2+]CCC(F)(F)F)CCCCC1)C1CCC1 ZINC001675185521 1106314124 /nfs/dbraw/zinc/31/41/24/1106314124.db2.gz ZFHSOCDLEMTAOQ-UHFFFAOYSA-N 1 3 349.441 2.832 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@H](C)C1)C1C[NH+](CCC2=CCCCC2)C1 ZINC001675343902 1106344621 /nfs/dbraw/zinc/34/46/21/1106344621.db2.gz XPWDMQZNPJCKPO-DLBZAZTESA-N 1 3 333.520 2.655 10 0 EFAEHO Cc1ccccc1CN1CC([C@@H](C)NC(=O)CCCC[NH+](C)C)C1 ZINC001675360274 1106347482 /nfs/dbraw/zinc/34/74/82/1106347482.db2.gz VYUXIHVQTALULQ-QGZVFWFLSA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3=CCCCC3)C[C@H]21)N(C)C ZINC001675539605 1106382403 /nfs/dbraw/zinc/38/24/03/1106382403.db2.gz PYWZTHWJQLDDSN-YSTOQKLRSA-N 1 3 347.547 2.757 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3=CCCCC3)C[C@H]21)N(C)C ZINC001675539605 1106382409 /nfs/dbraw/zinc/38/24/09/1106382409.db2.gz PYWZTHWJQLDDSN-YSTOQKLRSA-N 1 3 347.547 2.757 10 0 EFAEHO CCCCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)c3cccc(CN(C)C)c3)[C@@H]2C1 ZINC001675563566 1106386398 /nfs/dbraw/zinc/38/63/98/1106386398.db2.gz HUAQZVGBLZHMCM-OWZKRDHZSA-N 1 3 343.515 2.846 10 0 EFAEHO CCCCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)c3cccc(CN(C)C)c3)[C@@H]2C1 ZINC001675563566 1106386401 /nfs/dbraw/zinc/38/64/01/1106386401.db2.gz HUAQZVGBLZHMCM-OWZKRDHZSA-N 1 3 343.515 2.846 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CCC[NH2+]Cc1ccccc1 ZINC001676024564 1106471578 /nfs/dbraw/zinc/47/15/78/1106471578.db2.gz WBDOSRLGCAUQHI-HKUYNNGSSA-N 1 3 331.504 2.936 10 0 EFAEHO CN(C(=O)C(C)(C)N1CCCCC1)[C@H](C[NH2+]CCC1CC1)C1CC1 ZINC001676215005 1106500084 /nfs/dbraw/zinc/50/00/84/1106500084.db2.gz BBXCMCBQCRBSAX-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@H](C[NH2+]CC2=CCCCC2)C2CC2)C1 ZINC001676249993 1106505827 /nfs/dbraw/zinc/50/58/27/1106505827.db2.gz RAFDZGQLYCBPIO-VQIMIIECSA-N 1 3 333.520 2.655 10 0 EFAEHO C[C@@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]CCCc1ccccc1 ZINC001676360154 1106520070 /nfs/dbraw/zinc/52/00/70/1106520070.db2.gz QTYDZTHYWWQAHU-KRWDZBQOSA-N 1 3 331.504 2.540 10 0 EFAEHO C[C@H]1[C@H]([NH2+]CCCCc2ccccc2)CCN1C(=O)CN1CCCC1 ZINC001676692417 1106559433 /nfs/dbraw/zinc/55/94/33/1106559433.db2.gz DUEIIIDRLZNVHX-AZUAARDMSA-N 1 3 343.515 2.684 10 0 EFAEHO CN(C(=O)[C@@H]1CCCN1C)C1CC([NH2+]CCCCc2ccccc2)C1 ZINC001677386594 1106711623 /nfs/dbraw/zinc/71/16/23/1106711623.db2.gz ZMUOMVJRVWBREG-MHJFOBGBSA-N 1 3 343.515 2.683 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@H+](Cc2ccccc2)CC1)CC(C)(C)C ZINC001677603399 1106771643 /nfs/dbraw/zinc/77/16/43/1106771643.db2.gz QCERSORITPBSJR-UHFFFAOYSA-N 1 3 343.515 2.913 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@@H+](Cc2ccccc2)CC1)CC(C)(C)C ZINC001677603399 1106771655 /nfs/dbraw/zinc/77/16/55/1106771655.db2.gz QCERSORITPBSJR-UHFFFAOYSA-N 1 3 343.515 2.913 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1=CC[N@H+](CCC2CCCC2)CC1)N(C)C ZINC001677623773 1106789482 /nfs/dbraw/zinc/78/94/82/1106789482.db2.gz DBAVHPQTLDWJHQ-LJQANCHMSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1=CC[N@@H+](CCC2CCCC2)CC1)N(C)C ZINC001677623773 1106789494 /nfs/dbraw/zinc/78/94/94/1106789494.db2.gz DBAVHPQTLDWJHQ-LJQANCHMSA-N 1 3 335.536 2.901 10 0 EFAEHO Cc1cc(N2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)nc(N)n1 ZINC000311036135 1107264749 /nfs/dbraw/zinc/26/47/49/1107264749.db2.gz UHTMUAKMUQASTQ-UHFFFAOYSA-N 1 3 337.471 2.860 10 0 EFAEHO C[C@H]([NH2+]CC1CC(NC(=O)C2(N(C)C)CCC2)C1)c1ccccc1 ZINC001409266549 1107686376 /nfs/dbraw/zinc/68/63/76/1107686376.db2.gz UBSBXEZSWKUIQC-HJOIGYKYSA-N 1 3 329.488 2.716 10 0 EFAEHO CC/C=C/CCN1CC[C@@H]1CNC(=O)C1CC[NH+](CC2CC2)CC1 ZINC001483691270 1107836330 /nfs/dbraw/zinc/83/63/30/1107836330.db2.gz DWYLZCSAZUHTPG-GNAXCBTBSA-N 1 3 333.520 2.655 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CCC[C@@H]1C[NH2+]CCCC(C)(C)C ZINC001272331306 1107851534 /nfs/dbraw/zinc/85/15/34/1107851534.db2.gz FODSLBWEHIYQRN-CVEARBPZSA-N 1 3 334.508 2.961 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CCC[C@H]1C[NH2+]CCCC(C)(C)C ZINC001272331307 1107852358 /nfs/dbraw/zinc/85/23/58/1107852358.db2.gz FODSLBWEHIYQRN-HOTGVXAUSA-N 1 3 334.508 2.961 10 0 EFAEHO C[C@H]([NH2+]C/C=C\CNC(=O)CN(C)CC(C)(C)C)c1ccccc1 ZINC001483060714 1107893706 /nfs/dbraw/zinc/89/37/06/1107893706.db2.gz OVKGANIULLZMIJ-IBSYWUHOSA-N 1 3 331.504 2.988 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@H]1CCN1C[C@@H]1CCCC(F)(F)C1 ZINC001483693101 1107928045 /nfs/dbraw/zinc/92/80/45/1107928045.db2.gz KMFANTLPCNVJHF-HZPDHXFCSA-N 1 3 345.478 2.734 10 0 EFAEHO c1[nH]nc2cc(CN[C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)ccc12 ZINC000904476562 1107964612 /nfs/dbraw/zinc/96/46/12/1107964612.db2.gz UELIOFMDYQWXOK-AZUAARDMSA-N 1 3 334.423 2.908 10 0 EFAEHO C[C@@H](NC(=O)CCC[NH+](C)C)[C@H](C)NCc1cccc(Cl)c1F ZINC001409369881 1107965314 /nfs/dbraw/zinc/96/53/14/1107965314.db2.gz BYHCOHLRXGCJIC-QWHCGFSZSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCN1CC1CC(C)(C)C1)[NH+]1CCCC1 ZINC001483704930 1108052294 /nfs/dbraw/zinc/05/22/94/1108052294.db2.gz FGEIIBNNFINGQF-QZTJIDSGSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@@H](NCc1ccccn1)[C@H](C)NC(=O)CC[N@H+](C)C1CCCCC1 ZINC001409380512 1108071597 /nfs/dbraw/zinc/07/15/97/1108071597.db2.gz QTAXZJQTSVDBDW-SJORKVTESA-N 1 3 346.519 2.719 10 0 EFAEHO C[C@@H](NCc1ccccn1)[C@H](C)NC(=O)CC[N@@H+](C)C1CCCCC1 ZINC001409380512 1108071613 /nfs/dbraw/zinc/07/16/13/1108071613.db2.gz QTAXZJQTSVDBDW-SJORKVTESA-N 1 3 346.519 2.719 10 0 EFAEHO CCc1cccc(C[NH2+]C/C=C\CNC(=O)CN2CCC(C)CC2)c1 ZINC001483076255 1108402386 /nfs/dbraw/zinc/40/23/86/1108402386.db2.gz DAOMAUHJIUTVGS-PLNGDYQASA-N 1 3 343.515 2.743 10 0 EFAEHO CCCN(C)CC(=O)NC/C=C\C[NH2+][C@@H]1CCc2c1cccc2Cl ZINC001483087550 1108485899 /nfs/dbraw/zinc/48/58/99/1108485899.db2.gz QOLXTZCJMRATAH-PYTPGESOSA-N 1 3 349.906 2.931 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC/C=C\C[NH2+]Cc1ccc(CF)cc1 ZINC001483097164 1108624041 /nfs/dbraw/zinc/62/40/41/1108624041.db2.gz ISQQYUUWSUKKHH-HMECNJMJSA-N 1 3 347.478 2.793 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C\C[NH2+][C@@H](C)c1ccccc1 ZINC001483098529 1108649276 /nfs/dbraw/zinc/64/92/76/1108649276.db2.gz RMQVAZACPNGSMY-CZXSNVBGSA-N 1 3 329.488 2.884 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+][C@H]2CCc3ccccc32)CC1 ZINC001483738663 1108699541 /nfs/dbraw/zinc/69/95/41/1108699541.db2.gz SGXGHKSYVIWNEK-OALUTQOASA-N 1 3 341.499 2.787 10 0 EFAEHO CN1CCN(Cc2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)S4)cc2)CC1 ZINC000924723470 1108870657 /nfs/dbraw/zinc/87/06/57/1108870657.db2.gz RTLDPHGILMCPDM-IHWFROFDSA-N 1 3 345.556 2.950 10 0 EFAEHO CC(C)[C@H]1COCC[C@@H]1[NH2+]Cc1ccc(CN2CCN(C)CC2)cc1 ZINC000924723737 1108872326 /nfs/dbraw/zinc/87/23/26/1108872326.db2.gz ULZBZLWRIOFMFZ-RTWAWAEBSA-N 1 3 345.531 2.585 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+][C@@H](C)c2cccc(Cl)c2)CC1)N(C)C ZINC001483745931 1111155152 /nfs/dbraw/zinc/15/51/52/1111155152.db2.gz ILYVHOFTSJVIMS-XJKSGUPXSA-N 1 3 337.895 2.980 10 0 EFAEHO Cc1ccc(CNC2(CNC(=O)C(C)(C)[NH+]3CCCC3)CC2)cc1F ZINC001483756821 1111983074 /nfs/dbraw/zinc/98/30/74/1111983074.db2.gz JNUQWINPAUVVDR-UHFFFAOYSA-N 1 3 347.478 2.747 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+][C@@H](C)c2cc(C)ccc2C)CC1 ZINC001483786870 1112448882 /nfs/dbraw/zinc/44/88/82/1112448882.db2.gz HUFCYBGTQFCFBC-KRWDZBQOSA-N 1 3 331.504 2.945 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(F)c1)C2 ZINC001483832324 1112492907 /nfs/dbraw/zinc/49/29/07/1112492907.db2.gz BONGLZYSUXURIP-FQEVSTJZSA-N 1 3 347.478 2.592 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CCCc2ccsc2)CCN1C(=O)CN1CCCC1 ZINC001483912580 1112554850 /nfs/dbraw/zinc/55/48/50/1112554850.db2.gz AVHWZKVVQGSUQM-AEFFLSMTSA-N 1 3 349.544 2.746 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@H]1CCCN1C(=O)C(C)(C)N1CCCCC1 ZINC001483929246 1112571390 /nfs/dbraw/zinc/57/13/90/1112571390.db2.gz ISTIRBUFTCWJNX-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]C/C=C\Cl)C1CCCC1 ZINC001484001731 1112652628 /nfs/dbraw/zinc/65/26/28/1112652628.db2.gz RYEDZUNGVGUFHC-IRMRGROASA-N 1 3 341.927 2.878 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1CC[C@@]2(C1)CCCCN(C(=O)CN(C)C(C)C)C2 ZINC001484022711 1112675743 /nfs/dbraw/zinc/67/57/43/1112675743.db2.gz NZOGKOLZWDPOIW-IEBWSBKVSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](F)C[N@H+]1CC[C@@]2(C1)CCCCN(C(=O)CN(C)C(C)C)C2 ZINC001484022711 1112675744 /nfs/dbraw/zinc/67/57/44/1112675744.db2.gz NZOGKOLZWDPOIW-IEBWSBKVSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001484196740 1112915267 /nfs/dbraw/zinc/91/52/67/1112915267.db2.gz WCGHEMSSHKZVND-CABCVRRESA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@@H](C)C[N@H+]1CCC(F)(F)[C@@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001484196740 1112915273 /nfs/dbraw/zinc/91/52/73/1112915273.db2.gz WCGHEMSSHKZVND-CABCVRRESA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N1CCC(F)(F)[C@@H](CNC(=O)CCCC[NH+]2CCCC2)C1 ZINC001484198982 1112919859 /nfs/dbraw/zinc/91/98/59/1112919859.db2.gz YPAXALDSXBUNJR-INIZCTEOSA-N 1 3 345.478 2.734 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H](CC[NH2+]Cc3ccc(F)cc3)C2)CCC1 ZINC001484522845 1112979010 /nfs/dbraw/zinc/97/90/10/1112979010.db2.gz LTBZFPYGRQDLPO-QGZVFWFLSA-N 1 3 347.478 2.638 10 0 EFAEHO CN(CC(=O)N1CC[C@H](CC[NH2+]Cc2ccsc2)C1)C1CCC1 ZINC001484523583 1112979588 /nfs/dbraw/zinc/97/95/88/1112979588.db2.gz BJUDOPBHXJDKLC-HNNXBMFYSA-N 1 3 335.517 2.561 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]CCc2ccccc2F)C1)N(C)C ZINC001484537983 1112992135 /nfs/dbraw/zinc/99/21/35/1112992135.db2.gz RCQGNFXJMYMZEW-APWZRJJASA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](CC[NH2+]CC3CC(C)(C)C3)C2)C1 ZINC001484538216 1112992867 /nfs/dbraw/zinc/99/28/67/1112992867.db2.gz VOQGPCFUXLQMLR-SJORKVTESA-N 1 3 335.536 2.593 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](CC[NH2+]CC3CC(C)(C)C3)C2)C1 ZINC001484538213 1112993157 /nfs/dbraw/zinc/99/31/57/1112993157.db2.gz VOQGPCFUXLQMLR-DLBZAZTESA-N 1 3 335.536 2.593 10 0 EFAEHO CC(C)=CCN(C)Cc1ccccc1CNC(=O)[C@H]1CC[N@H+](C)C1 ZINC001484557655 1113010517 /nfs/dbraw/zinc/01/05/17/1113010517.db2.gz VVSXFNWMOOCQQF-IBGZPJMESA-N 1 3 329.488 2.653 10 0 EFAEHO CC(C)=CCN(C)Cc1ccccc1CNC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001484557655 1113010521 /nfs/dbraw/zinc/01/05/21/1113010521.db2.gz VVSXFNWMOOCQQF-IBGZPJMESA-N 1 3 329.488 2.653 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NCc1ccc([C@@H](C)NCCF)cc1 ZINC001484558312 1113012464 /nfs/dbraw/zinc/01/24/64/1113012464.db2.gz DHXXYTYNKGPOHW-CRAIPNDOSA-N 1 3 335.467 2.797 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NCc1ccc([C@@H](C)NCCF)cc1 ZINC001484558312 1113012466 /nfs/dbraw/zinc/01/24/66/1113012466.db2.gz DHXXYTYNKGPOHW-CRAIPNDOSA-N 1 3 335.467 2.797 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@H]2CC[C@H](C[NH2+]CCC(F)(F)F)CC2)C1 ZINC001484571990 1113032761 /nfs/dbraw/zinc/03/27/61/1113032761.db2.gz PUJJRJGMKUQQCD-RBSFLKMASA-N 1 3 349.441 2.545 10 0 EFAEHO CC(C)[N@@H+]1CCc2c(CNC(=O)CN(C)C3CCC3)cccc2C1 ZINC001484612776 1113055576 /nfs/dbraw/zinc/05/55/76/1113055576.db2.gz OKBIZMRIFIPOTB-UHFFFAOYSA-N 1 3 329.488 2.554 10 0 EFAEHO CC(C)[N@H+]1CCc2c(CNC(=O)CN(C)C3CCC3)cccc2C1 ZINC001484612776 1113055580 /nfs/dbraw/zinc/05/55/80/1113055580.db2.gz OKBIZMRIFIPOTB-UHFFFAOYSA-N 1 3 329.488 2.554 10 0 EFAEHO Cc1ccc(CN[C@@H]2CN(C(=O)CC[NH+](C)C)C[C@@H]2C)c(Cl)c1 ZINC001484900993 1117805289 /nfs/dbraw/zinc/80/52/89/1117805289.db2.gz WOOZPHZCMWFEBT-WMLDXEAASA-N 1 3 337.895 2.537 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1[NH2+]CC1=CCCCC1 ZINC001484899150 1117815167 /nfs/dbraw/zinc/81/51/67/1117815167.db2.gz FKFVCRGEVQWKAU-WMZOPIPTSA-N 1 3 335.536 2.901 10 0 EFAEHO CC[N@H+](CC[C@H](C)F)CC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001485030766 1117956221 /nfs/dbraw/zinc/95/62/21/1117956221.db2.gz CJXXSSQUKKRWAS-INIZCTEOSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[N@@H+](CC[C@H](C)F)CC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001485030766 1117956224 /nfs/dbraw/zinc/95/62/24/1117956224.db2.gz CJXXSSQUKKRWAS-INIZCTEOSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CC[C@@H](C)F)N(C)C ZINC001485044205 1117962765 /nfs/dbraw/zinc/96/27/65/1117962765.db2.gz NQQMIPPMNBJTSG-UTRMSSBJSA-N 1 3 349.494 2.693 10 0 EFAEHO CC[N@H+](CCC(C)C)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001485032902 1117965801 /nfs/dbraw/zinc/96/58/01/1117965801.db2.gz NSOJGAYAJIUAGX-GOSISDBHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[N@@H+](CCC(C)C)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001485032902 1117965803 /nfs/dbraw/zinc/96/58/03/1117965803.db2.gz NSOJGAYAJIUAGX-GOSISDBHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[N@H+](CCC(C)C)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001485034040 1117967105 /nfs/dbraw/zinc/96/71/05/1117967105.db2.gz COJLPVQFYOVIEC-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[N@@H+](CCC(C)C)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001485034040 1117967108 /nfs/dbraw/zinc/96/71/08/1117967108.db2.gz COJLPVQFYOVIEC-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CCc1ccc(CC[NH2+][C@@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001485158514 1118101350 /nfs/dbraw/zinc/10/13/50/1118101350.db2.gz ZGBIOEVPUGGHHU-DLBZAZTESA-N 1 3 345.531 2.759 10 0 EFAEHO CCc1ccc(CC[NH2+][C@@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001485158516 1118101374 /nfs/dbraw/zinc/10/13/74/1118101374.db2.gz ZGBIOEVPUGGHHU-IRXDYDNUSA-N 1 3 345.531 2.759 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)c(C)n1 ZINC001485180613 1118114915 /nfs/dbraw/zinc/11/49/15/1118114915.db2.gz NREVKTVLELSYEX-JKSUJKDBSA-N 1 3 346.519 2.556 10 0 EFAEHO C[C@@H]([NH2+]CCc1ccccc1F)[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001485181226 1118116002 /nfs/dbraw/zinc/11/60/02/1118116002.db2.gz RAKCPCLRYNGSMX-CVEARBPZSA-N 1 3 349.494 2.725 10 0 EFAEHO C[C@@H](NC(=O)c1ccc(C[NH+](C)C)cc1)[C@H](C)NCc1ccns1 ZINC001485201260 1118125679 /nfs/dbraw/zinc/12/56/79/1118125679.db2.gz XCRSRGGFUNEKPQ-UONOGXRCSA-N 1 3 346.500 2.501 10 0 EFAEHO C[C@@H](NCc1ccns1)[C@@H](C)NC(=O)c1ccc(C[NH+](C)C)cc1 ZINC001485201263 1118126437 /nfs/dbraw/zinc/12/64/37/1118126437.db2.gz XCRSRGGFUNEKPQ-ZIAGYGMSSA-N 1 3 346.500 2.501 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)CC(C)(C)C[NH2+]C/C=C/Cl ZINC001485253025 1118169134 /nfs/dbraw/zinc/16/91/34/1118169134.db2.gz XITNBEHRJGWSDK-LOWQCSRCSA-N 1 3 329.916 2.688 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC(C)(C)C[NH2+]CCC(C)C ZINC001485265569 1118184427 /nfs/dbraw/zinc/18/44/27/1118184427.db2.gz FNNWDSUHVZGNLX-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)Cc2cc(F)ccc2C)CC[N@@H+]1C ZINC001485307825 1118220915 /nfs/dbraw/zinc/22/09/15/1118220915.db2.gz RLXSAPRBOMKJLX-ZYSHUDEJSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)Cc2cc(F)ccc2C)CC[N@H+]1C ZINC001485307825 1118220918 /nfs/dbraw/zinc/22/09/18/1118220918.db2.gz RLXSAPRBOMKJLX-ZYSHUDEJSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@@H](CNC(=O)C12CCC[NH+](CCC1)C2)N(C)Cc1ccc(F)cc1 ZINC001485320734 1118232645 /nfs/dbraw/zinc/23/26/45/1118232645.db2.gz VKIADUGPLRATDV-INIZCTEOSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC001485389780 1118331029 /nfs/dbraw/zinc/33/10/29/1118331029.db2.gz VMASMFCVWNRUOZ-VQIMIIECSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC001485389780 1118331030 /nfs/dbraw/zinc/33/10/30/1118331030.db2.gz VMASMFCVWNRUOZ-VQIMIIECSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]Cc1ccccc1F ZINC001485429141 1118358702 /nfs/dbraw/zinc/35/87/02/1118358702.db2.gz POOTYUOXZIAPPW-MOPGFXCFSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[C@@H](C)C[NH+]1CC([C@@H](C)NC(=O)C(C)(C)N2CCCC2)C1 ZINC001485519927 1118433072 /nfs/dbraw/zinc/43/30/72/1118433072.db2.gz LIDSIUDBZUKWFI-IAGOWNOFSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1C[NH+](CCCc2cccc(F)c2)C1 ZINC001485538185 1118439034 /nfs/dbraw/zinc/43/90/34/1118439034.db2.gz BDCJWYCITINYSK-MRXNPFEDSA-N 1 3 349.494 2.535 10 0 EFAEHO CC(C)(C)CC[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001485600583 1118478403 /nfs/dbraw/zinc/47/84/03/1118478403.db2.gz FFXJENOMFXUBTG-NNZMDNLPSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)(C)CC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001485600583 1118478406 /nfs/dbraw/zinc/47/84/06/1118478406.db2.gz FFXJENOMFXUBTG-NNZMDNLPSA-N 1 3 349.563 2.981 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]CC[C@H]2CCCC2(F)F)C1)N(C)C ZINC001485688320 1118528121 /nfs/dbraw/zinc/52/81/21/1118528121.db2.gz FFAPLERTGIWSCA-KLHDSHLOSA-N 1 3 345.478 2.637 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2cccc(F)c2)C1 ZINC001485702908 1118537310 /nfs/dbraw/zinc/53/73/10/1118537310.db2.gz IDHRMGYLDXOWQE-MPGHIAIKSA-N 1 3 335.467 2.713 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC000174870035 231329969 /nfs/dbraw/zinc/32/99/69/231329969.db2.gz KGOFJYDMILRLNN-AYHJJNSGSA-N 1 3 330.476 2.885 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC000174870035 231329973 /nfs/dbraw/zinc/32/99/73/231329973.db2.gz KGOFJYDMILRLNN-AYHJJNSGSA-N 1 3 330.476 2.885 10 0 EFAEHO CCCN(CCC[NH+](C)C)C(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000344403134 283219812 /nfs/dbraw/zinc/21/98/12/283219812.db2.gz WFXWNJLCLJJRRO-CALCHBBNSA-N 1 3 326.529 2.623 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)NCC[NH+]1[C@@H](C)CCC[C@@H]1C ZINC000352996391 283237500 /nfs/dbraw/zinc/23/75/00/283237500.db2.gz GOSAYGGQJUESLW-ROUUACIJSA-N 1 3 338.540 2.767 10 0 EFAEHO CNC(=[NH2+])NC[C@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000363432214 283273177 /nfs/dbraw/zinc/27/31/77/283273177.db2.gz GTHHNAYWSDQQLT-OCCSQVGLSA-N 1 3 328.382 2.832 10 0 EFAEHO C[NH+](C)C1CCN([C@@H](CN)c2cc(Br)cs2)CC1 ZINC000036191713 213076051 /nfs/dbraw/zinc/07/60/51/213076051.db2.gz NCVPYNIICXCTBZ-LBPRGKRZSA-N 1 3 332.311 2.536 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000343546201 283332667 /nfs/dbraw/zinc/33/26/67/283332667.db2.gz PIPDKNBYGZRAGB-RBUKOAKNSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000343546204 283332781 /nfs/dbraw/zinc/33/27/81/283332781.db2.gz PIPDKNBYGZRAGB-RTBURBONSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCN1CCN(c2ccccc2CN(C)C[C@H]2CCC[N@@H+]2C)CC1 ZINC000421409253 283349420 /nfs/dbraw/zinc/34/94/20/283349420.db2.gz MGEDPNAQMQXVMW-HXUWFJFHSA-N 1 3 344.547 2.745 10 0 EFAEHO CCCN1CCN(c2ccccc2CN(C)C[C@H]2CCC[N@H+]2C)CC1 ZINC000421409253 283349423 /nfs/dbraw/zinc/34/94/23/283349423.db2.gz MGEDPNAQMQXVMW-HXUWFJFHSA-N 1 3 344.547 2.745 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)NCCN2CCCC(C)(C)C2)cc1 ZINC000418469062 296030223 /nfs/dbraw/zinc/03/02/23/296030223.db2.gz BBMZKQWYHZCZQV-OAHLLOKOSA-N 1 3 332.492 2.628 10 0 EFAEHO CCN1CCC[C@H]1CNC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000073539412 216394252 /nfs/dbraw/zinc/39/42/52/216394252.db2.gz XZHNPTUUFXCZGO-IBGZPJMESA-N 1 3 344.503 2.566 10 0 EFAEHO C[C@H](Cc1ccccc1)CN1CCN(C[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000132321345 223319963 /nfs/dbraw/zinc/31/99/63/223319963.db2.gz WDARIUOJXXDCFN-CTNGQTDRSA-N 1 3 329.532 2.967 10 0 EFAEHO C[C@H](Cc1ccccc1)CN1CCN(C[C@@H]2CCCC[N@H+]2C)CC1 ZINC000132321345 223319965 /nfs/dbraw/zinc/31/99/65/223319965.db2.gz WDARIUOJXXDCFN-CTNGQTDRSA-N 1 3 329.532 2.967 10 0 EFAEHO C[C@H](Cc1ccccc1)CN1CCN(C[C@H]2CCCC[N@@H+]2C)CC1 ZINC000132321747 223320259 /nfs/dbraw/zinc/32/02/59/223320259.db2.gz WDARIUOJXXDCFN-TZIWHRDSSA-N 1 3 329.532 2.967 10 0 EFAEHO C[C@H](Cc1ccccc1)CN1CCN(C[C@H]2CCCC[N@H+]2C)CC1 ZINC000132321747 223320260 /nfs/dbraw/zinc/32/02/60/223320260.db2.gz WDARIUOJXXDCFN-TZIWHRDSSA-N 1 3 329.532 2.967 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)c1ccc(C[NH3+])cc1)c1ccccc1 ZINC000236837992 242379338 /nfs/dbraw/zinc/37/93/38/242379338.db2.gz NSMLUMDBCKOPAN-IBGZPJMESA-N 1 3 325.456 2.958 10 0 EFAEHO C[C@@H]([NH2+]C1(CN[C@H]2CCN(C3CC3)C2)CCOCC1)c1ccccc1 ZINC000095422927 296112628 /nfs/dbraw/zinc/11/26/28/296112628.db2.gz FGJOCSMUWVIRBB-MJGOQNOKSA-N 1 3 343.515 2.713 10 0 EFAEHO COc1cc(Br)cc(CNCC2CC[NH2+]CC2)c1OC ZINC000020968298 212193887 /nfs/dbraw/zinc/19/38/87/212193887.db2.gz AEUUFLJFWUBQTA-UHFFFAOYSA-N 1 3 343.265 2.556 10 0 EFAEHO Cn1cnc(CCN[C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)c1 ZINC000414121264 244013503 /nfs/dbraw/zinc/01/35/03/244013503.db2.gz GFEOPJDGEJVYMA-HBMCJLEFSA-N 1 3 338.499 2.995 10 0 EFAEHO Cn1cnc(CCN[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)c1 ZINC000414121264 244013511 /nfs/dbraw/zinc/01/35/11/244013511.db2.gz GFEOPJDGEJVYMA-HBMCJLEFSA-N 1 3 338.499 2.995 10 0 EFAEHO COC[C@@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)C1CCCC1 ZINC000414302985 244080225 /nfs/dbraw/zinc/08/02/25/244080225.db2.gz LCWSIETZDQSSSL-HXUWFJFHSA-N 1 3 346.515 2.808 10 0 EFAEHO C[C@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)[C@]1(C)CCCO1 ZINC000414308442 244081708 /nfs/dbraw/zinc/08/17/08/244081708.db2.gz QEUBSDZURXRXHE-HKUYNNGSSA-N 1 3 332.488 2.561 10 0 EFAEHO C[C@@H](Cc1ccoc1)[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000414301569 244082476 /nfs/dbraw/zinc/08/24/76/244082476.db2.gz JVWCAJVBQLTXAM-KRWDZBQOSA-N 1 3 328.456 2.827 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)CC(=O)NCCc2ccccc2)cc1 ZINC000414808557 244362060 /nfs/dbraw/zinc/36/20/60/244362060.db2.gz FGBVVYPKHVBIHB-IAGOWNOFSA-N 1 3 339.483 2.933 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@H](C)NCC[C@H]1CCC[NH2+]1 ZINC000414912133 244394788 /nfs/dbraw/zinc/39/47/88/244394788.db2.gz XYRPRMCVLWDYDQ-GXTWGEPZSA-N 1 3 339.867 2.797 10 0 EFAEHO CCN(C(=O)NC[C@H](C)C[NH2+]C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418369012 245138429 /nfs/dbraw/zinc/13/84/29/245138429.db2.gz STNYVWAMNUEZOZ-LMMKCTJWSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)N(CCN(C)C)C2CCCC2)cc1 ZINC000418492981 245173267 /nfs/dbraw/zinc/17/32/67/245173267.db2.gz QGIAAKPWPNWPMS-OAHLLOKOSA-N 1 3 332.492 2.722 10 0 EFAEHO CCN(C(=O)NC[C@H]([NH3+])C1CC1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418495853 245175636 /nfs/dbraw/zinc/17/56/36/245175636.db2.gz GRMRCGUCEGFWGF-IPELMVKDSA-N 1 3 344.503 2.591 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[NH3+])[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418434961 245157143 /nfs/dbraw/zinc/15/71/43/245157143.db2.gz VXLDCPMKJGMYKA-WBVHZDCISA-N 1 3 332.492 2.591 10 0 EFAEHO [NH3+][C@H](CNC(=O)N1CCN(CC2CCCCC2)CC1)c1ccccc1 ZINC000418454734 245163487 /nfs/dbraw/zinc/16/34/87/245163487.db2.gz QVIFRWUUWKKPHG-LJQANCHMSA-N 1 3 344.503 2.594 10 0 EFAEHO CC1CCC(N2CCN(C(=O)NC[C@H]([NH3+])c3ccccc3)CC2)CC1 ZINC000418456161 245164708 /nfs/dbraw/zinc/16/47/08/245164708.db2.gz SQMQDMKKPRLAKZ-KVZIAJEVSA-N 1 3 344.503 2.592 10 0 EFAEHO CCN(C(=O)N[C@H](C[NH3+])C1CC1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418457227 245165010 /nfs/dbraw/zinc/16/50/10/245165010.db2.gz IGZAZQCGLOLUGZ-ZYSHUDEJSA-N 1 3 344.503 2.591 10 0 EFAEHO CC[C@H]([NH3+])CNC(=O)N(CC)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418711241 245255431 /nfs/dbraw/zinc/25/54/31/245255431.db2.gz WGKRVPAJVOJCLD-SZMVWBNQSA-N 1 3 332.492 2.591 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)N[C@H](CCC[NH3+])c2ccccc2)CCN1C ZINC000418680713 245242387 /nfs/dbraw/zinc/24/23/87/245242387.db2.gz UUAQIFHUCGVMOX-KBAYOESNSA-N 1 3 332.492 2.591 10 0 EFAEHO O=C(Nc1ccc2c(c1)CNC2)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000415993663 284327253 /nfs/dbraw/zinc/32/72/53/284327253.db2.gz FTSVNPDOPCQGIN-KXBFYZLASA-N 1 3 340.471 2.770 10 0 EFAEHO O=C(Nc1ccc2c(c1)CNC2)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000415993663 284327254 /nfs/dbraw/zinc/32/72/54/284327254.db2.gz FTSVNPDOPCQGIN-KXBFYZLASA-N 1 3 340.471 2.770 10 0 EFAEHO CN(C[C@@H]1CCCN1C)C(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000422144491 246271129 /nfs/dbraw/zinc/27/11/29/246271129.db2.gz QZLSEUIOSOAYDC-IBGZPJMESA-N 1 3 344.503 2.518 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(-n3cncn3)c(C)c2)[C@H](C)C1 ZINC000093638702 218236618 /nfs/dbraw/zinc/23/66/18/218236618.db2.gz UWYFLEHXVYESBT-SJLPKXTDSA-N 1 3 327.476 2.738 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(-n3cncn3)c(C)c2)[C@H](C)C1 ZINC000093638702 218236619 /nfs/dbraw/zinc/23/66/19/218236619.db2.gz UWYFLEHXVYESBT-SJLPKXTDSA-N 1 3 327.476 2.738 10 0 EFAEHO CC[NH+](CC)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000174153367 284782558 /nfs/dbraw/zinc/78/25/58/284782558.db2.gz IJNHNLZNNRCQRE-LJQANCHMSA-N 1 3 329.488 2.839 10 0 EFAEHO CN(Cc1ccccc1)CC(C)(C)C[N@H+](C)[C@H]1CCN2CCO[C@H]1C2 ZINC000449367062 251002566 /nfs/dbraw/zinc/00/25/66/251002566.db2.gz YWJNIUIQXNOYCW-PMACEKPBSA-N 1 3 345.531 2.550 10 0 EFAEHO CN(Cc1ccccc1)CC(C)(C)C[N@@H+](C)[C@H]1CCN2CCO[C@H]1C2 ZINC000449367062 251002572 /nfs/dbraw/zinc/00/25/72/251002572.db2.gz YWJNIUIQXNOYCW-PMACEKPBSA-N 1 3 345.531 2.550 10 0 EFAEHO CN(CC(C)(C)C[N@H+](C)Cc1ccccc1)[C@H]1CCN2CCO[C@H]1C2 ZINC000449367062 251002576 /nfs/dbraw/zinc/00/25/76/251002576.db2.gz YWJNIUIQXNOYCW-PMACEKPBSA-N 1 3 345.531 2.550 10 0 EFAEHO CN(CC(C)(C)C[N@@H+](C)Cc1ccccc1)[C@H]1CCN2CCO[C@H]1C2 ZINC000449367062 251002580 /nfs/dbraw/zinc/00/25/80/251002580.db2.gz YWJNIUIQXNOYCW-PMACEKPBSA-N 1 3 345.531 2.550 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@@H](CCCO)C2)CC1 ZINC000449792167 251156851 /nfs/dbraw/zinc/15/68/51/251156851.db2.gz RYJHXSDOCMSDAL-LJQANCHMSA-N 1 3 345.531 2.813 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@@H](CCCO)C2)CC1 ZINC000449792167 251156854 /nfs/dbraw/zinc/15/68/54/251156854.db2.gz RYJHXSDOCMSDAL-LJQANCHMSA-N 1 3 345.531 2.813 10 0 EFAEHO COC[C@H](O)C[N@@H+]1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000453026488 252020785 /nfs/dbraw/zinc/02/07/85/252020785.db2.gz UTLZODZUBSXREQ-WOJBJXKFSA-N 1 3 346.515 2.616 10 0 EFAEHO COC[C@H](O)C[N@H+]1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000453026488 252020790 /nfs/dbraw/zinc/02/07/90/252020790.db2.gz UTLZODZUBSXREQ-WOJBJXKFSA-N 1 3 346.515 2.616 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[N@@H+]1CC[C@H]2[C@@H](CCCN2C)C1 ZINC000268740231 252190467 /nfs/dbraw/zinc/19/04/67/252190467.db2.gz POPFZCJSDQESBT-NSHGMRRFSA-N 1 3 346.515 2.966 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H]2[C@@H](CCCN2C)C1 ZINC000268740231 252190472 /nfs/dbraw/zinc/19/04/72/252190472.db2.gz POPFZCJSDQESBT-NSHGMRRFSA-N 1 3 346.515 2.966 10 0 EFAEHO O=C(CCNC1CC[NH+](CCc2ccccc2)CC1)N1CCCCC1 ZINC000268752277 252204197 /nfs/dbraw/zinc/20/41/97/252204197.db2.gz CPBVMFIFRSWPRT-UHFFFAOYSA-N 1 3 343.515 2.686 10 0 EFAEHO CC(=O)NC1CCC([NH2+][C@H](C)c2cccc(OCCN(C)C)c2)CC1 ZINC000268832317 252281621 /nfs/dbraw/zinc/28/16/21/252281621.db2.gz KLRPFYLJPNZMRM-VNCLNFNDSA-N 1 3 347.503 2.725 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)NCC(C)(C)C[NH+]1CCCC1 ZINC000358240089 296428035 /nfs/dbraw/zinc/42/80/35/296428035.db2.gz SUXZCQSAOZPWOP-IAGOWNOFSA-N 1 3 338.540 2.671 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)Cc1cc(C)c(O)c(C)c1 ZINC000349062430 285281697 /nfs/dbraw/zinc/28/16/97/285281697.db2.gz LVBVHTINUUBHNN-IBGZPJMESA-N 1 3 333.520 2.857 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)Cc1cc(C)c(O)c(C)c1 ZINC000349062430 285281700 /nfs/dbraw/zinc/28/17/00/285281700.db2.gz LVBVHTINUUBHNN-IBGZPJMESA-N 1 3 333.520 2.857 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN2CC[C@H](C(C)(C)C)[C@H](O)C2)cc1 ZINC000680476840 549330938 /nfs/dbraw/zinc/33/09/38/549330938.db2.gz URBKBWIIHVFXKA-RBUKOAKNSA-N 1 3 334.504 2.856 10 0 EFAEHO C[N@@H+]1C[C@H](COCC2CC2)C2(C1)CCN(Cc1ccncc1)CC2 ZINC000248024891 257668261 /nfs/dbraw/zinc/66/82/61/257668261.db2.gz LIANXBAXFSAVGF-LJQANCHMSA-N 1 3 329.488 2.652 10 0 EFAEHO C[N@H+]1C[C@H](COCC2CC2)C2(C1)CCN(Cc1ccncc1)CC2 ZINC000248024891 257668262 /nfs/dbraw/zinc/66/82/62/257668262.db2.gz LIANXBAXFSAVGF-LJQANCHMSA-N 1 3 329.488 2.652 10 0 EFAEHO CN(C)C1CC[NH+](CCCCCn2nnc(-c3ccccc3)n2)CC1 ZINC000104945968 141355919 /nfs/dbraw/zinc/35/59/19/141355919.db2.gz WBAUFRHUHVKPIO-UHFFFAOYSA-N 1 3 342.491 2.536 10 0 EFAEHO CCC[NH+]1CCC(N(C)C(=O)NCCN2[C@H](C)CCC[C@H]2C)CC1 ZINC000341562573 141831282 /nfs/dbraw/zinc/83/12/82/141831282.db2.gz UTOAEAVGGMQALT-IAGOWNOFSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@H]([NH2+]CC(=O)NC1CCN(C2CC2)CC1)[C@@H](C)c1ccccc1 ZINC000347684726 142256269 /nfs/dbraw/zinc/25/62/69/142256269.db2.gz PJNBTXFHQBSYME-CVEARBPZSA-N 1 3 329.488 2.511 10 0 EFAEHO Cn1cncc1CCN1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000347754935 142267358 /nfs/dbraw/zinc/26/73/58/142267358.db2.gz MQLJVMOUUSHNNC-UHFFFAOYSA-N 1 3 326.488 2.807 10 0 EFAEHO Cn1cncc1CCN1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000347754935 142267359 /nfs/dbraw/zinc/26/73/59/142267359.db2.gz MQLJVMOUUSHNNC-UHFFFAOYSA-N 1 3 326.488 2.807 10 0 EFAEHO CN(C(=O)c1ccc(C[NH+]2CCCCC2)cc1)[C@@H]1CN2CCC1CC2 ZINC000347949515 142298432 /nfs/dbraw/zinc/29/84/32/142298432.db2.gz NIDLDJNMPIWVPA-HXUWFJFHSA-N 1 3 341.499 2.839 10 0 EFAEHO CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N1CCN2CCC1CC2 ZINC000341301172 145029291 /nfs/dbraw/zinc/02/92/91/145029291.db2.gz MKRZLYUOPQDSKS-UHFFFAOYSA-N 1 3 344.503 2.516 10 0 EFAEHO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)N1CCN2CCC1CC2 ZINC000341301172 145029292 /nfs/dbraw/zinc/02/92/92/145029292.db2.gz MKRZLYUOPQDSKS-UHFFFAOYSA-N 1 3 344.503 2.516 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NCCN2[C@@H](C)CCC[C@@H]2C)CC1 ZINC000341430490 145051019 /nfs/dbraw/zinc/05/10/19/145051019.db2.gz IMGIRWXKUYMYRE-IRXDYDNUSA-N 1 3 338.540 2.671 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H](CNC(=O)NCCN2[C@H](C)CCC[C@@H]2C)C1 ZINC000341433921 145051495 /nfs/dbraw/zinc/05/14/95/145051495.db2.gz QOCYQCZCGCEWSP-FGTMMUONSA-N 1 3 338.540 2.669 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H](CNC(=O)NCCN2[C@H](C)CCC[C@@H]2C)C1 ZINC000341433921 145051496 /nfs/dbraw/zinc/05/14/96/145051496.db2.gz QOCYQCZCGCEWSP-FGTMMUONSA-N 1 3 338.540 2.669 10 0 EFAEHO C[C@H](N[C@H](CO)C[C@H](O)C(C)(C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000342813106 145199193 /nfs/dbraw/zinc/19/91/93/145199193.db2.gz GAMKBBFRBBEZJR-RNQOJCNYSA-N 1 3 348.531 2.645 10 0 EFAEHO C[C@H](N[C@H](CO)C[C@H](O)C(C)(C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000342813106 145199196 /nfs/dbraw/zinc/19/91/96/145199196.db2.gz GAMKBBFRBBEZJR-RNQOJCNYSA-N 1 3 348.531 2.645 10 0 EFAEHO O=C(CC[N@H+]1CCc2ccccc2C1)N1CCN(C2CCCC2)CC1 ZINC000348939385 146027072 /nfs/dbraw/zinc/02/70/72/146027072.db2.gz GTSGFTQXQRULFO-UHFFFAOYSA-N 1 3 341.499 2.522 10 0 EFAEHO C[C@H](CNC(=O)CCN1CCc2ccccc2C1)C[NH+]1CCCCC1 ZINC000348960732 146030076 /nfs/dbraw/zinc/03/00/76/146030076.db2.gz FDZFZAAZWJWRAL-GOSISDBHSA-N 1 3 343.515 2.673 10 0 EFAEHO CC(C)Cc1ncc(CN(C)CCN(C)C2CC[NH+](C)CC2)s1 ZINC000349074340 146047215 /nfs/dbraw/zinc/04/72/15/146047215.db2.gz MFVROOGETKRLSU-UHFFFAOYSA-N 1 3 338.565 2.799 10 0 EFAEHO CCc1cccc(F)c1CN1CCC(C[NH+]2CCN(C)CC2)CC1 ZINC000349083840 146049816 /nfs/dbraw/zinc/04/98/16/146049816.db2.gz ZNNQTTMXDFENAT-UHFFFAOYSA-N 1 3 333.495 2.848 10 0 EFAEHO CN(C)C[C@@H](Cc1ccccc1)NC(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000351917267 146234905 /nfs/dbraw/zinc/23/49/05/146234905.db2.gz OFGJCAACQOQFAP-RTBURBONSA-N 1 3 331.504 2.540 10 0 EFAEHO CN(C)C[C@@H](Cc1ccccc1)NC(=O)CC[C@H]1CCCC[N@H+]1C ZINC000351917267 146234907 /nfs/dbraw/zinc/23/49/07/146234907.db2.gz OFGJCAACQOQFAP-RTBURBONSA-N 1 3 331.504 2.540 10 0 EFAEHO O[C@@H]1CCN(Cc2ccccc2C[NH2+]C2CC(c3ccccn3)C2)C1 ZINC000368031135 150015386 /nfs/dbraw/zinc/01/53/86/150015386.db2.gz RQMKLDGOHIPRSQ-SOAGJPPSSA-N 1 3 337.467 2.684 10 0 EFAEHO Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C ZINC000372904441 151078907 /nfs/dbraw/zinc/07/89/07/151078907.db2.gz SLBVGLRTCJIEHH-XAUMDUMWSA-N 1 3 345.487 2.528 10 0 EFAEHO CC(C)(C)OC(=O)N1CC[C@](C)(CN[C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000373850955 151237474 /nfs/dbraw/zinc/23/74/74/151237474.db2.gz OLTDJDQYPNAXTJ-TXPKVOOTSA-N 1 3 337.508 2.850 10 0 EFAEHO CC(C)(C)OC(=O)N1CC[C@](C)(CN[C@H]2CC[N@H+]3CCC[C@H]3C2)C1 ZINC000373850955 151237476 /nfs/dbraw/zinc/23/74/76/151237476.db2.gz OLTDJDQYPNAXTJ-TXPKVOOTSA-N 1 3 337.508 2.850 10 0 EFAEHO CC(C)(C)OC(=O)N1CC[C@](C)(C[NH2+][C@H]2CCN3CCC[C@H]3C2)C1 ZINC000373850955 151237477 /nfs/dbraw/zinc/23/74/77/151237477.db2.gz OLTDJDQYPNAXTJ-TXPKVOOTSA-N 1 3 337.508 2.850 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccc(C[NH3+])cc1 ZINC000374461677 151352290 /nfs/dbraw/zinc/35/22/90/151352290.db2.gz YDFUTBOIGXXUCI-OXJNMPFZSA-N 1 3 337.467 2.786 10 0 EFAEHO C[C@@H]1CCOCCN1Cc1ccc(C[N@@H+]2CCOCC[C@H]2C)cc1 ZINC000378463502 152092030 /nfs/dbraw/zinc/09/20/30/152092030.db2.gz QXKJHGHKLBOFSE-QZTJIDSGSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@@H]1CCOCCN1Cc1ccc(C[N@H+]2CCOCC[C@H]2C)cc1 ZINC000378463502 152092033 /nfs/dbraw/zinc/09/20/33/152092033.db2.gz QXKJHGHKLBOFSE-QZTJIDSGSA-N 1 3 332.488 2.908 10 0 EFAEHO COc1ccc([C@H](NCCN2CCCC[C@@H]2C)[C@H]2CCC[NH2+]2)cc1 ZINC000422858539 286375647 /nfs/dbraw/zinc/37/56/47/286375647.db2.gz IYUOAUGOCATNNE-DBVUQKKJSA-N 1 3 331.504 2.952 10 0 EFAEHO Cc1ccc2c(c1)[C@H]([NH2+]CCN1CCN(C)C(C)(C)C1)CCCO2 ZINC000374239965 292367605 /nfs/dbraw/zinc/36/76/05/292367605.db2.gz HFWJNRFSXCQYIB-GOSISDBHSA-N 1 3 331.504 2.824 10 0 EFAEHO CC[C@@H]1C[C@@H](C[N@H+](CCN(C)C)C[C@H]2CCCN2CC)CCO1 ZINC000349039061 287281363 /nfs/dbraw/zinc/28/13/63/287281363.db2.gz WUHRPQJRYKDUOX-IPMKNSEASA-N 1 3 325.541 2.540 10 0 EFAEHO CC[C@@H]1C[C@@H](C[N@@H+](CCN(C)C)C[C@H]2CCCN2CC)CCO1 ZINC000349039061 287281365 /nfs/dbraw/zinc/28/13/65/287281365.db2.gz WUHRPQJRYKDUOX-IPMKNSEASA-N 1 3 325.541 2.540 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000341341104 287390025 /nfs/dbraw/zinc/39/00/25/287390025.db2.gz FEMPRYSIFPBOQW-KURKYZTESA-N 1 3 336.524 2.519 10 0 EFAEHO CC[C@](C)(O)C[N@H+](C)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000123546894 222294599 /nfs/dbraw/zinc/29/45/99/222294599.db2.gz QABFQPLOHPIOLT-PMACEKPBSA-N 1 3 334.504 2.525 10 0 EFAEHO CC[C@](C)(O)C[N@@H+](C)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000123546894 222294602 /nfs/dbraw/zinc/29/46/02/222294602.db2.gz QABFQPLOHPIOLT-PMACEKPBSA-N 1 3 334.504 2.525 10 0 EFAEHO C[C@H](CCNC(=O)N[C@@H](CN(C)C)c1ccccc1)[NH+]1CCCCC1 ZINC000184758198 544968496 /nfs/dbraw/zinc/96/84/96/544968496.db2.gz FNUHDJLNPCNISU-MJGOQNOKSA-N 1 3 346.519 2.853 10 0 EFAEHO C[C@H](CCNC(=O)N[C@H](CN(C)C)c1ccccc1)[NH+]1CCCCC1 ZINC000184758235 544968623 /nfs/dbraw/zinc/96/86/23/544968623.db2.gz FNUHDJLNPCNISU-IEBWSBKVSA-N 1 3 346.519 2.853 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H]2CCCC[C@@H]2O)CC1 ZINC000088728438 264655802 /nfs/dbraw/zinc/65/58/02/264655802.db2.gz HCAZAZOMPLQOCG-CTNGQTDRSA-N 1 3 345.531 2.859 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCc2cccc(C[NH+](CC)CC)c2)C1 ZINC000194143618 265364516 /nfs/dbraw/zinc/36/45/16/265364516.db2.gz WDONTWLJCFQDRK-LJQANCHMSA-N 1 3 346.519 2.812 10 0 EFAEHO O[C@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCOCC1 ZINC000272460951 266272872 /nfs/dbraw/zinc/27/28/72/266272872.db2.gz YKPQMNLBIGZGLR-MXEMCNAFSA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCOCC1 ZINC000272460951 266272875 /nfs/dbraw/zinc/27/28/75/266272875.db2.gz YKPQMNLBIGZGLR-MXEMCNAFSA-N 1 3 344.499 2.559 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000107835461 273008395 /nfs/dbraw/zinc/00/83/95/273008395.db2.gz BSDJEBVKXYIQQW-MSOLQXFVSA-N 1 3 338.540 2.623 10 0 EFAEHO COC1(C[C@@H](C)[NH2+]CCCN2CCN(c3ccncc3)CC2)CCC1 ZINC000277048914 267106145 /nfs/dbraw/zinc/10/61/45/267106145.db2.gz GXGLOBBCRUDLQR-GOSISDBHSA-N 1 3 346.519 2.531 10 0 EFAEHO C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)C1 ZINC000174271520 273027906 /nfs/dbraw/zinc/02/79/06/273027906.db2.gz PIWMGGYYSPIMDS-BRWVUGGUSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)C1 ZINC000174271520 273027908 /nfs/dbraw/zinc/02/79/08/273027908.db2.gz PIWMGGYYSPIMDS-BRWVUGGUSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@H](c2cccs2)N2CCCC2)CC[N@@H+]1C ZINC000279233938 273191405 /nfs/dbraw/zinc/19/14/05/273191405.db2.gz QQBDOJHJNDNVIU-HRCADAONSA-N 1 3 335.517 2.732 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@H](c2cccs2)N2CCCC2)CC[N@H+]1C ZINC000279233938 273191407 /nfs/dbraw/zinc/19/14/07/273191407.db2.gz QQBDOJHJNDNVIU-HRCADAONSA-N 1 3 335.517 2.732 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N(CCCc2ccccc2)CCN(C)C)CC[N@@H+]1C ZINC000279260412 273194417 /nfs/dbraw/zinc/19/44/17/273194417.db2.gz TXBSTHQVJINMEX-ICSRJNTNSA-N 1 3 345.531 2.740 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N(CCCc2ccccc2)CCN(C)C)CC[N@H+]1C ZINC000279260412 273194419 /nfs/dbraw/zinc/19/44/19/273194419.db2.gz TXBSTHQVJINMEX-ICSRJNTNSA-N 1 3 345.531 2.740 10 0 EFAEHO C[NH2+]Cc1ccccc1NC(=O)N[C@@H](Cc1ccccc1)CN(C)C ZINC000415899352 273969267 /nfs/dbraw/zinc/96/92/67/273969267.db2.gz JNWDPZMGJOXVIB-SFHVURJKSA-N 1 3 340.471 2.700 10 0 EFAEHO C[C@@H](Cc1ccccc1)C[N@H+](C)[C@H]1CCN(C2CCN(C)CC2)C1 ZINC000377633064 274230861 /nfs/dbraw/zinc/23/08/61/274230861.db2.gz UOKLQMSVJMDGRM-RXVVDRJESA-N 1 3 329.532 2.966 10 0 EFAEHO C[C@@H](Cc1ccccc1)C[N@@H+](C)[C@H]1CCN(C2CCN(C)CC2)C1 ZINC000377633064 274230862 /nfs/dbraw/zinc/23/08/62/274230862.db2.gz UOKLQMSVJMDGRM-RXVVDRJESA-N 1 3 329.532 2.966 10 0 EFAEHO CCN(C(=O)N[C@@H]1CCC[NH2+]C1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418387558 276062747 /nfs/dbraw/zinc/06/27/47/276062747.db2.gz TXZRAELCTZQWIZ-QRQLOZEOSA-N 1 3 344.503 2.605 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000355592961 276116837 /nfs/dbraw/zinc/11/68/37/276116837.db2.gz BQGCQZBWKLNXPW-ZHALLVOQSA-N 1 3 346.519 2.679 10 0 EFAEHO CCN(CCC[NH+]1CCCC1)C(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000349777018 276123077 /nfs/dbraw/zinc/12/30/77/276123077.db2.gz USQHPKQDLALWKZ-HDICACEKSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN1CCCC[C@@H]1CN[C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422903951 276158018 /nfs/dbraw/zinc/15/80/18/276158018.db2.gz GDAGLKMCFAOVOJ-KPFFTGBYSA-N 1 3 329.488 2.706 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)CCc1ccc(C)cc1 ZINC000337579335 276170524 /nfs/dbraw/zinc/17/05/24/276170524.db2.gz MFMWPZLZQGARBY-HXUWFJFHSA-N 1 3 345.531 2.802 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)CCc1ccc(C)cc1 ZINC000337579335 276170525 /nfs/dbraw/zinc/17/05/25/276170525.db2.gz MFMWPZLZQGARBY-HXUWFJFHSA-N 1 3 345.531 2.802 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@@H]2CCCC[C@@H]2[C@H]2CCOC2)CC1 ZINC000365067048 276194718 /nfs/dbraw/zinc/19/47/18/276194718.db2.gz UQCPXVNTCBTFHZ-XUVXKRRUSA-N 1 3 337.552 2.589 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@@H]2CCC[C@@H]([C@@H]3CCOC3)C2)CC1 ZINC000360986459 276194761 /nfs/dbraw/zinc/19/47/61/276194761.db2.gz KWNARJMQNXJGMR-VAMGGRTRSA-N 1 3 337.552 2.589 10 0 EFAEHO CCN1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H]2CN(C)C[C@H]2C)CC1 ZINC000361182721 276203472 /nfs/dbraw/zinc/20/34/72/276203472.db2.gz HDVJEYBTTVFDQT-GJYPPUQNSA-N 1 3 348.510 2.568 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@H]1CCC[N@H+](CC[C@H]2CCCN2C)C1 ZINC000245558661 276315983 /nfs/dbraw/zinc/31/59/83/276315983.db2.gz BERXTIBOAILPHK-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@H]1CCC[N@@H+](CC[C@H]2CCCN2C)C1 ZINC000245558661 276315985 /nfs/dbraw/zinc/31/59/85/276315985.db2.gz BERXTIBOAILPHK-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(CC[C@H]2CCC[N@@H+]2C)C1 ZINC000245558661 276315987 /nfs/dbraw/zinc/31/59/87/276315987.db2.gz BERXTIBOAILPHK-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(CC[C@H]2CCC[N@H+]2C)C1 ZINC000245558661 276315990 /nfs/dbraw/zinc/31/59/90/276315990.db2.gz BERXTIBOAILPHK-LSDHHAIUSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000104410221 276360965 /nfs/dbraw/zinc/36/09/65/276360965.db2.gz LRYWWVGGRIEBEZ-RTBURBONSA-N 1 3 335.536 2.975 10 0 EFAEHO CN1CC[C@H](NC(=O)CC[C@H]2CCCC[N@@H+]2C)[C@@H]1c1ccccc1 ZINC000355243417 277165206 /nfs/dbraw/zinc/16/52/06/277165206.db2.gz STERXLQTEOAMBG-HBFSDRIKSA-N 1 3 329.488 2.813 10 0 EFAEHO CN1CC[C@H](NC(=O)CC[C@H]2CCCC[N@H+]2C)[C@@H]1c1ccccc1 ZINC000355243417 277165207 /nfs/dbraw/zinc/16/52/07/277165207.db2.gz STERXLQTEOAMBG-HBFSDRIKSA-N 1 3 329.488 2.813 10 0 EFAEHO CCN1CCC[C@H]1CN(C)C(=O)NCCCC[N@@H+]1CCCC[C@H]1C ZINC000245416743 279325004 /nfs/dbraw/zinc/32/50/04/279325004.db2.gz ISHYMTAMOOMGNE-MSOLQXFVSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN1CCC[C@H]1CN(C)C(=O)NCCCC[N@H+]1CCCC[C@H]1C ZINC000245416743 279325007 /nfs/dbraw/zinc/32/50/07/279325007.db2.gz ISHYMTAMOOMGNE-MSOLQXFVSA-N 1 3 338.540 2.767 10 0 EFAEHO CC(C)[C@H](C(=O)NCc1ccccc1C[NH+]1CCCCC1)N(C)C ZINC000106427651 280175879 /nfs/dbraw/zinc/17/58/79/280175879.db2.gz VIRRXWCJETUXLN-LJQANCHMSA-N 1 3 331.504 2.875 10 0 EFAEHO CN1CC[C@H](NC(=O)NC(C)(C)CCC[NH+](C)C)[C@H]1c1ccccc1 ZINC000458575415 289109007 /nfs/dbraw/zinc/10/90/07/289109007.db2.gz IUKQAMNSIDDCOT-ZWKOTPCHSA-N 1 3 346.519 2.851 10 0 EFAEHO CN1CC[C@H](NC(=O)N[C@H]2CCC[C@@H]([NH+](C)C)C2)[C@@H]1c1ccccc1 ZINC000245612831 289307453 /nfs/dbraw/zinc/30/74/53/289307453.db2.gz CCCZYTLDYZVYFO-RDGPPVDQSA-N 1 3 344.503 2.604 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H](C)C[C@@H](C)O)CC1 ZINC000088728111 292830581 /nfs/dbraw/zinc/83/05/81/292830581.db2.gz JJTGEMDJUOBYFS-ZWKOTPCHSA-N 1 3 333.520 2.715 10 0 EFAEHO Cc1ccc(OC[C@@H](O)CN2CCC(CCC[NH+](C)C)CC2)cc1 ZINC000123541127 292982916 /nfs/dbraw/zinc/98/29/16/292982916.db2.gz PYCPGBNVCKJVSH-IBGZPJMESA-N 1 3 334.504 2.789 10 0 EFAEHO CCc1ccc(NC(=O)N(CCN(C)C)CC[NH+](C)C)cc1CC ZINC000133397335 293256153 /nfs/dbraw/zinc/25/61/53/293256153.db2.gz MAKKMHXLZIOOPX-UHFFFAOYSA-N 1 3 334.508 2.769 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H](CC)CCO)CC1 ZINC000152635410 293342992 /nfs/dbraw/zinc/34/29/92/293342992.db2.gz BHZOCYNTMOASKP-GOSISDBHSA-N 1 3 333.520 2.717 10 0 EFAEHO CC(=O)N[C@H]1CCC[N@@H+](CC(C)(C)CN(C)Cc2ccccc2)C1 ZINC000153895426 293399919 /nfs/dbraw/zinc/39/99/19/293399919.db2.gz RFPXHFPVJYODFS-IBGZPJMESA-N 1 3 331.504 2.745 10 0 EFAEHO CC(=O)N[C@H]1CCC[N@H+](CC(C)(C)CN(C)Cc2ccccc2)C1 ZINC000153895426 293399921 /nfs/dbraw/zinc/39/99/21/293399921.db2.gz RFPXHFPVJYODFS-IBGZPJMESA-N 1 3 331.504 2.745 10 0 EFAEHO CCCC[NH+]1CCC(NC(=O)N[C@@H](CN(C)C)c2ccccc2)CC1 ZINC000158602335 293579141 /nfs/dbraw/zinc/57/91/41/293579141.db2.gz MDMLBWNDAGTLPS-IBGZPJMESA-N 1 3 346.519 2.853 10 0 EFAEHO C[NH+](C)CCCCNCc1c(Cl)cccc1N1CCOCC1 ZINC000293605916 295010216 /nfs/dbraw/zinc/01/02/16/295010216.db2.gz PGBCZEQSROHEFX-UHFFFAOYSA-N 1 3 325.884 2.608 10 0 EFAEHO COc1ccc([C@H](NCCN2CCCC[C@H]2C)[C@H]2CCC[NH2+]2)cc1 ZINC000422858538 295244936 /nfs/dbraw/zinc/24/49/36/295244936.db2.gz IYUOAUGOCATNNE-AHRSYUTCSA-N 1 3 331.504 2.952 10 0 EFAEHO CC[C@@H](NC1CC[NH+](CCc2ccccc2)CC1)[C@H](O)C(F)F ZINC000294935875 295247948 /nfs/dbraw/zinc/24/79/48/295247948.db2.gz BXBJEPYSXCZMEV-SJORKVTESA-N 1 3 326.431 2.688 10 0 EFAEHO NC[C@H]1CCCC[C@H]1[NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000423085361 295268490 /nfs/dbraw/zinc/26/84/90/295268490.db2.gz KIUUIFWMOJKSRA-TWRYWWQQSA-N 1 3 333.442 2.899 10 0 EFAEHO COc1nccc(CN(C)CCC2CCN(c3cc[nH+]cc3)CC2)n1 ZINC000295472736 295326248 /nfs/dbraw/zinc/32/62/48/295326248.db2.gz RNTPRTQZHJSDQD-UHFFFAOYSA-N 1 3 341.459 2.619 10 0 EFAEHO O=C(C1CCN(C2CC2)CC1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000376080155 295447428 /nfs/dbraw/zinc/44/74/28/295447428.db2.gz JADHEDNOUVGGOY-SFHVURJKSA-N 1 3 347.547 2.975 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000371243453 304545872 /nfs/dbraw/zinc/54/58/72/304545872.db2.gz KGXKOHAJFMRPSH-WOJBJXKFSA-N 1 3 341.499 2.887 10 0 EFAEHO C[C@H]1C[N@H+](C)CC[C@@H]1N(C)C(=O)c1cccc(CN2CCCC2)c1 ZINC000126152922 300217313 /nfs/dbraw/zinc/21/73/13/300217313.db2.gz DVQJVPFXQDXBAF-LPHOPBHVSA-N 1 3 329.488 2.695 10 0 EFAEHO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cccc(CN2CCCC2)c1 ZINC000126152922 300217316 /nfs/dbraw/zinc/21/73/16/300217316.db2.gz DVQJVPFXQDXBAF-LPHOPBHVSA-N 1 3 329.488 2.695 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@H](c1ccc(F)cc1)N(C)C ZINC000422705953 302588301 /nfs/dbraw/zinc/58/83/01/302588301.db2.gz DEXUYFNRCMCGPG-BFUOFWGJSA-N 1 3 330.451 2.941 10 0 EFAEHO COc1cc(C[NH2+]C2CCN(C3CCC3)CC2)cc2c1OCCO2 ZINC000299350015 311075141 /nfs/dbraw/zinc/07/51/41/311075141.db2.gz REZRFXQIWGIKBU-UHFFFAOYSA-N 1 3 332.444 2.573 10 0 EFAEHO C[C@H](C[NH2+][C@H](C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)CN(C)C ZINC000309699281 311228641 /nfs/dbraw/zinc/22/86/41/311228641.db2.gz FMYRVBDOMQSEHC-OAGGEKHMSA-N 1 3 327.513 2.809 10 0 EFAEHO CC(C)n1nccc1CNCC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC000397601009 311960425 /nfs/dbraw/zinc/96/04/25/311960425.db2.gz UIGPKCZHUZWCNS-UHFFFAOYSA-N 1 3 342.487 2.581 10 0 EFAEHO C[C@@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)c1ccncc1 ZINC000397576330 311960543 /nfs/dbraw/zinc/96/05/43/311960543.db2.gz CMDRSQMHTPGHEN-QGZVFWFLSA-N 1 3 325.456 2.759 10 0 EFAEHO CCN(CC)CCC[NH2+][C@H](C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000400333347 311968560 /nfs/dbraw/zinc/96/85/60/311968560.db2.gz FJHFASRVOQUNJB-CVEARBPZSA-N 1 3 327.513 2.953 10 0 EFAEHO CC(C)(C)c1ccc(CNC[C@H](N2CC[NH2+]CC2)C(F)(F)F)s1 ZINC000414972530 312069331 /nfs/dbraw/zinc/06/93/31/312069331.db2.gz JRBKYFBJBYBMDN-ZDUSSCGKSA-N 1 3 349.466 2.971 10 0 EFAEHO CC(C)(C)c1nc(CNC2CCC([NH+]3CCNCC3)CC2)cs1 ZINC000415058105 312085537 /nfs/dbraw/zinc/08/55/37/312085537.db2.gz SJRASLZATBNJAE-UHFFFAOYSA-N 1 3 336.549 2.747 10 0 EFAEHO CC(C)(C)c1nc(CNC2CCC(N3CC[NH2+]CC3)CC2)cs1 ZINC000415058105 312085540 /nfs/dbraw/zinc/08/55/40/312085540.db2.gz SJRASLZATBNJAE-UHFFFAOYSA-N 1 3 336.549 2.747 10 0 EFAEHO C[C@H](CCCCN1C(=O)c2ccccc2C1=O)N[C@H]1CCCC[NH2+]C1 ZINC000415079218 312089280 /nfs/dbraw/zinc/08/92/80/312089280.db2.gz WPKQXKJOLRBOKJ-CVEARBPZSA-N 1 3 343.471 2.573 10 0 EFAEHO CC[NH+](CC)CC1CCN(C(=O)Nc2ccc3c(c2)CNCC3)CC1 ZINC000415883964 312179225 /nfs/dbraw/zinc/17/92/25/312179225.db2.gz PFCBGYJAYDZTBR-UHFFFAOYSA-N 1 3 344.503 2.918 10 0 EFAEHO CCC[N@H+](CC)C[C@H](C)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415954124 312184575 /nfs/dbraw/zinc/18/45/75/312184575.db2.gz JQVAYFDPDJGNLT-ZDUSSCGKSA-N 1 3 336.455 2.713 10 0 EFAEHO CCC[N@@H+](CC)C[C@H](C)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415954124 312184577 /nfs/dbraw/zinc/18/45/77/312184577.db2.gz JQVAYFDPDJGNLT-ZDUSSCGKSA-N 1 3 336.455 2.713 10 0 EFAEHO O=C(Nc1ccc2c(c1F)CCNC2)N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000415960588 312185339 /nfs/dbraw/zinc/18/53/39/312185339.db2.gz QIKOUKNDVOVENB-OAHLLOKOSA-N 1 3 346.450 2.564 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)C[C@H]1C ZINC000415961072 312185935 /nfs/dbraw/zinc/18/59/35/312185935.db2.gz QNXOHPVGRREZSC-UKRRQHHQSA-N 1 3 348.466 2.808 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)C[C@H]1C ZINC000415961072 312185937 /nfs/dbraw/zinc/18/59/37/312185937.db2.gz QNXOHPVGRREZSC-UKRRQHHQSA-N 1 3 348.466 2.808 10 0 EFAEHO C[NH2+]Cc1ccc(NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)cc1 ZINC000415978100 312189118 /nfs/dbraw/zinc/18/91/18/312189118.db2.gz ZZFFRHOLNNKCER-IBGZPJMESA-N 1 3 340.471 2.700 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)NC[C@@H]([NH3+])c2ccccc2)N(C)C)cc1 ZINC000417313092 312207526 /nfs/dbraw/zinc/20/75/26/312207526.db2.gz OSAUSWHJSHYNEU-MOPGFXCFSA-N 1 3 340.471 2.597 10 0 EFAEHO C[C@H](CNC(=O)NCc1ccc([C@H](C)[NH3+])cc1)N1CCC(C)CC1 ZINC000417317341 312208031 /nfs/dbraw/zinc/20/80/31/312208031.db2.gz WJDDVIIJKKYPCU-CVEARBPZSA-N 1 3 332.492 2.626 10 0 EFAEHO CC[C@H](C)[N@H+](C)CCNC(=O)NC[C@@H](N)c1ccc(C(C)C)cc1 ZINC000417441145 312223929 /nfs/dbraw/zinc/22/39/29/312223929.db2.gz AKBTZZOJSYCNHG-MAUKXSAKSA-N 1 3 334.508 2.839 10 0 EFAEHO CC[C@H](C)[N@@H+](C)CCNC(=O)NC[C@@H](N)c1ccc(C(C)C)cc1 ZINC000417441145 312223930 /nfs/dbraw/zinc/22/39/30/312223930.db2.gz AKBTZZOJSYCNHG-MAUKXSAKSA-N 1 3 334.508 2.839 10 0 EFAEHO C[C@H](CCC[NH3+])NC(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000417728050 312262490 /nfs/dbraw/zinc/26/24/90/312262490.db2.gz AHMDJWOEJVTQRF-YCPHGPKFSA-N 1 3 338.521 2.558 10 0 EFAEHO CC(C)Cc1ccc([C@H](CNC(=O)N[C@H](C)[C@H](C)[NH3+])N(C)C)cc1 ZINC000418198919 312345710 /nfs/dbraw/zinc/34/57/10/312345710.db2.gz WCBXLXCSHPMQEA-DAYGRLMNSA-N 1 3 334.508 2.523 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000479164089 313262487 /nfs/dbraw/zinc/26/24/87/313262487.db2.gz SQYLPPBGCWATNK-PMACEKPBSA-N 1 3 345.531 2.991 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000479164089 313262490 /nfs/dbraw/zinc/26/24/90/313262490.db2.gz SQYLPPBGCWATNK-PMACEKPBSA-N 1 3 345.531 2.991 10 0 EFAEHO CN1CCC(O)(C[NH2+][C@H]2CCCOc3cc4c(cc32)CCCC4)CC1 ZINC000489491820 313581624 /nfs/dbraw/zinc/58/16/24/313581624.db2.gz YORKRKPENQTGGF-IBGZPJMESA-N 1 3 344.499 2.825 10 0 EFAEHO CCCNC(=O)C1(NCc2ccc3c(c2)C[NH2+]CC3)CCCCC1 ZINC000518384562 315809951 /nfs/dbraw/zinc/80/99/51/315809951.db2.gz DNCHQJHUDMOLGC-UHFFFAOYSA-N 1 3 329.488 2.651 10 0 EFAEHO C[C@H]1CCC[C@H](C)[NH+]1CCNC(=O)Nc1ccc2c(c1)CNCCO2 ZINC000521214798 316006999 /nfs/dbraw/zinc/00/69/99/316006999.db2.gz SCWGEFVJTWADHI-GJZGRUSLSA-N 1 3 346.475 2.553 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000527381843 316376228 /nfs/dbraw/zinc/37/62/28/316376228.db2.gz AGCKRBYVJBYJQX-UHFFFAOYSA-N 1 3 342.434 2.755 10 0 EFAEHO C[C@H]([NH2+]CC1(N2CCCCC2)CCN(C)CC1)C1CC(F)(F)C1 ZINC000529546810 316913123 /nfs/dbraw/zinc/91/31/23/316913123.db2.gz FKVSFCMHGYSBSL-HNNXBMFYSA-N 1 3 329.479 2.960 10 0 EFAEHO O=C1Nc2ccccc2C12CCC([NH2+][C@H]1CCNC13CCC3)CC2 ZINC000530221376 317083752 /nfs/dbraw/zinc/08/37/52/317083752.db2.gz PVLDVVGIXOKOFO-KGYZHSKHSA-N 1 3 325.456 2.693 10 0 EFAEHO CCCn1nc(C)c(CN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)c1C ZINC000530247881 317090663 /nfs/dbraw/zinc/09/06/63/317090663.db2.gz CIWRNVNSSPWECO-GOSISDBHSA-N 1 3 334.508 2.500 10 0 EFAEHO CC[C@H]([NH2+]CC1(N2CCCCC2)CCN(C)CC1)C1CCOCC1 ZINC000531981719 317338575 /nfs/dbraw/zinc/33/85/75/317338575.db2.gz CFOTVKGZXCGLKC-IBGZPJMESA-N 1 3 337.552 2.732 10 0 EFAEHO CN(CCC(=O)NC[C@@H](C1CCCCC1)[NH+](C)C)c1ccncc1 ZINC000541852552 317792584 /nfs/dbraw/zinc/79/25/84/317792584.db2.gz ZZGXBQFYGDEMDL-SFHVURJKSA-N 1 3 332.492 2.535 10 0 EFAEHO C[C@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)CCN(C)c2ccncc2)C1 ZINC000543715364 317860795 /nfs/dbraw/zinc/86/07/95/317860795.db2.gz CWJKSTGLZQFOIC-IRXDYDNUSA-N 1 3 346.519 2.781 10 0 EFAEHO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCCCN2CCN(C)CC2)cc1 ZINC000551536538 318209244 /nfs/dbraw/zinc/20/92/44/318209244.db2.gz GLCGQNAUBBPCKR-DUXKGJEZSA-N 1 3 345.531 2.804 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccc(OCC(F)(F)F)nc2)[C@@H]2CCC[C@H]21 ZINC000552033335 318238772 /nfs/dbraw/zinc/23/87/72/318238772.db2.gz ZBVFBDSLLWOBQV-SOUVJXGZSA-N 1 3 343.393 2.985 10 0 EFAEHO CCCC[N@H+](C)C[C@@H](C)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000555154049 318347033 /nfs/dbraw/zinc/34/70/33/318347033.db2.gz NELRGZWITHODIA-BHIYHBOVSA-N 1 3 346.519 2.851 10 0 EFAEHO CCCC[N@@H+](C)C[C@@H](C)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000555154049 318347036 /nfs/dbraw/zinc/34/70/36/318347036.db2.gz NELRGZWITHODIA-BHIYHBOVSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]Cc2ccc(CN3CCC(C(N)=O)CC3)cc2)[C@@H]1C ZINC000556881902 318417530 /nfs/dbraw/zinc/41/75/30/318417530.db2.gz QZGKMUBJKOLWHS-CLCXKQKWSA-N 1 3 329.488 2.518 10 0 EFAEHO [NH3+]C1(CNC(=O)N2CCC[C@@H]2CN2CCCCC2)CCCCCC1 ZINC000563595167 318800631 /nfs/dbraw/zinc/80/06/31/318800631.db2.gz OEWHISZLTDFFRJ-QGZVFWFLSA-N 1 3 336.524 2.698 10 0 EFAEHO C[C@@H]([NH3+])C[C@H](C)NC(=O)N1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000565595137 318985617 /nfs/dbraw/zinc/98/56/17/318985617.db2.gz AYRVAZHTBQSDPH-CABCVRRESA-N 1 3 326.529 2.654 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)N1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000565954933 319017917 /nfs/dbraw/zinc/01/79/17/319017917.db2.gz ZGTMNXRBLPSBEK-FQEVSTJZSA-N 1 3 341.455 2.710 10 0 EFAEHO CC(C)OC[C@@H](O)CNCc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000566107936 319033357 /nfs/dbraw/zinc/03/33/57/319033357.db2.gz BZKUPKQAIPAOJL-FQEVSTJZSA-N 1 3 334.504 2.938 10 0 EFAEHO C[C@H](C[NH+]1CCC(C)CC1)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000566505392 319084834 /nfs/dbraw/zinc/08/48/34/319084834.db2.gz VKOZBEUVHWXWCK-CQSZACIVSA-N 1 3 348.466 2.713 10 0 EFAEHO CNC(=O)[C@@H](N[C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000566795974 319111444 /nfs/dbraw/zinc/11/14/44/319111444.db2.gz CEFSUMACQWMCJK-MSOLQXFVSA-N 1 3 329.488 2.544 10 0 EFAEHO CNC(=O)[C@@H](N[C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000566795974 319111445 /nfs/dbraw/zinc/11/14/45/319111445.db2.gz CEFSUMACQWMCJK-MSOLQXFVSA-N 1 3 329.488 2.544 10 0 EFAEHO COC(=O)[C@H](C)[C@H](NCc1ccc2c(c1)C[NH2+]CC2)c1ccccc1 ZINC000566978354 319127912 /nfs/dbraw/zinc/12/79/12/319127912.db2.gz HTDZKHACXYBQFU-QRWLVFNGSA-N 1 3 338.451 2.972 10 0 EFAEHO COC(=O)[C@@H](C)[C@@H](NCc1ccc2c(c1)C[NH2+]CC2)c1ccccc1 ZINC000566978353 319128230 /nfs/dbraw/zinc/12/82/30/319128230.db2.gz HTDZKHACXYBQFU-MGPUTAFESA-N 1 3 338.451 2.972 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)C1 ZINC000568291662 319269573 /nfs/dbraw/zinc/26/95/73/319269573.db2.gz QJVVWPOUHZUTHN-QWFCFKBJSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000568291662 319269575 /nfs/dbraw/zinc/26/95/75/319269575.db2.gz QJVVWPOUHZUTHN-QWFCFKBJSA-N 1 3 343.515 2.745 10 0 EFAEHO O[C@H](CN[C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)C1CCCCC1 ZINC000568617071 319301138 /nfs/dbraw/zinc/30/11/38/319301138.db2.gz AJUZQHQBGPACRS-QWFCFKBJSA-N 1 3 330.472 2.773 10 0 EFAEHO O[C@H](CN[C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)C1CCCCC1 ZINC000568617069 319301375 /nfs/dbraw/zinc/30/13/75/319301375.db2.gz AJUZQHQBGPACRS-NLWGTHIKSA-N 1 3 330.472 2.773 10 0 EFAEHO Cc1ccc(Cl)c(NC(=O)N(CCN(C)C)CC[NH+](C)C)c1C ZINC000568831044 319321292 /nfs/dbraw/zinc/32/12/92/319321292.db2.gz BEZTZJGPINUZSQ-UHFFFAOYSA-N 1 3 340.899 2.914 10 0 EFAEHO CCO[C@@H]1C[C@H](N[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)[C@H]1n1cccn1 ZINC000569330377 319370393 /nfs/dbraw/zinc/37/03/93/319370393.db2.gz VGTYYAOMEVRINN-WVXCVLBUSA-N 1 3 332.492 2.502 10 0 EFAEHO C[NH+](C)CC1CCC(NC(=O)Nc2ccc3c(c2F)CCNC3)CC1 ZINC000569793139 319414237 /nfs/dbraw/zinc/41/42/37/319414237.db2.gz WZUINWDCRPVERQ-UHFFFAOYSA-N 1 3 348.466 2.713 10 0 EFAEHO [NH3+]C[C@H]1CCCC[C@@H]1NCc1ccc(Cn2ccccc2=O)cc1 ZINC000571275852 319557921 /nfs/dbraw/zinc/55/79/21/319557921.db2.gz USNBNXOKRFZXOE-MOPGFXCFSA-N 1 3 325.456 2.504 10 0 EFAEHO Cc1nc(CCN[C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c(C)o1 ZINC000572392048 319665687 /nfs/dbraw/zinc/66/56/87/319665687.db2.gz FJEPGMDOJLEMSV-PKOBYXMFSA-N 1 3 327.428 2.679 10 0 EFAEHO OCC1(CN[C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)CC2(CCC2)C1 ZINC000572712670 319697151 /nfs/dbraw/zinc/69/71/51/319697151.db2.gz PAAHQTWDGIUHTH-UTKZUKDTSA-N 1 3 342.483 2.775 10 0 EFAEHO O=C(C1CCN(Cc2ccc3c(c2)C[NH2+]CC3)CC1)N1CCCCC1 ZINC000573097215 319733934 /nfs/dbraw/zinc/73/39/34/319733934.db2.gz LEGCZWSEMGQNIG-UHFFFAOYSA-N 1 3 341.499 2.557 10 0 EFAEHO CC[NH+]1CCC(CNCc2cnc(-c3ccccc3OC)nc2)CC1 ZINC000573777792 319796942 /nfs/dbraw/zinc/79/69/42/319796942.db2.gz LKQXHLRVBMXVSW-UHFFFAOYSA-N 1 3 340.471 2.974 10 0 EFAEHO Clc1ccc(-n2cc(CNCC[C@@H]3CC[NH2+]C3)nn2)c(Cl)c1 ZINC000574052998 319825881 /nfs/dbraw/zinc/82/58/81/319825881.db2.gz BNDJVGKCSXVXMW-NSHDSACASA-N 1 3 340.258 2.663 10 0 EFAEHO CC(C)Oc1ccc([C@@H](CNC(=O)C[N@@H+]2CC[C@@H](C)C2)N(C)C)cc1 ZINC000576956100 320064887 /nfs/dbraw/zinc/06/48/87/320064887.db2.gz XBYJAYZBIDXCGO-VQIMIIECSA-N 1 3 347.503 2.535 10 0 EFAEHO CC(C)Oc1ccc([C@@H](CNC(=O)C[N@H+]2CC[C@@H](C)C2)N(C)C)cc1 ZINC000576956100 320064888 /nfs/dbraw/zinc/06/48/88/320064888.db2.gz XBYJAYZBIDXCGO-VQIMIIECSA-N 1 3 347.503 2.535 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2cccc3c2CCNC3)[C@@H](C)C1 ZINC000578048756 320168329 /nfs/dbraw/zinc/16/83/29/320168329.db2.gz IJAOGXWASXTRJE-KBXCAEBGSA-N 1 3 330.476 2.526 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2cccc3c2CCNC3)[C@@H](C)C1 ZINC000578048756 320168331 /nfs/dbraw/zinc/16/83/31/320168331.db2.gz IJAOGXWASXTRJE-KBXCAEBGSA-N 1 3 330.476 2.526 10 0 EFAEHO CN(CCC[NH+](C)C)C(=O)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000185776794 323397726 /nfs/dbraw/zinc/39/77/26/323397726.db2.gz BBJGLIIEDJXJHB-LJQANCHMSA-N 1 3 346.519 2.634 10 0 EFAEHO OC[C@@H](CNC1CC[NH+](CC2CC2)CC1)Cc1ccc(F)c(F)c1 ZINC000580927063 324267318 /nfs/dbraw/zinc/26/73/18/324267318.db2.gz GWGRZPCYEFZMKL-MRXNPFEDSA-N 1 3 338.442 2.580 10 0 EFAEHO CC[C@@H](C)CN(C)c1ccc(F)cc1CNCCOCC[NH+](C)C ZINC000095997197 473250389 /nfs/dbraw/zinc/25/03/89/473250389.db2.gz SYPHNQLLWLGBQF-MRXNPFEDSA-N 1 3 339.499 2.976 10 0 EFAEHO OC1CCN(CCNc2c3ccccc3[nH+]c3c2CCCC3)CC1 ZINC000143657325 473277337 /nfs/dbraw/zinc/27/73/37/473277337.db2.gz HDOVZHIPYJJRKE-UHFFFAOYSA-N 1 3 325.456 2.982 10 0 EFAEHO CC(C)[C@@](C)(O)C[N@H+](C)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000185002849 473298009 /nfs/dbraw/zinc/29/80/09/473298009.db2.gz NEOJQUXFCHLJPX-SFTDATJTSA-N 1 3 348.531 2.771 10 0 EFAEHO CC(C)[C@@](C)(O)C[N@@H+](C)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000185002849 473298014 /nfs/dbraw/zinc/29/80/14/473298014.db2.gz NEOJQUXFCHLJPX-SFTDATJTSA-N 1 3 348.531 2.771 10 0 EFAEHO CN1CCC(C[NH2+][C@@H]2CC(C)(C)OC2(C)C)(N2CCCCC2)CC1 ZINC000124759498 473298883 /nfs/dbraw/zinc/29/88/83/473298883.db2.gz YDRVXFRCCSIODU-QGZVFWFLSA-N 1 3 337.552 2.872 10 0 EFAEHO CN(CCN1CCCC1)C(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000112741198 473307266 /nfs/dbraw/zinc/30/72/66/473307266.db2.gz ZIADTCUHFVWUFO-UHFFFAOYSA-N 1 3 344.503 2.520 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)[C@H]3C[C@H]3C3CCCCC3)CC2)CC1 ZINC000162474741 473344996 /nfs/dbraw/zinc/34/49/96/473344996.db2.gz LPGWJOJJFCIFTF-PMACEKPBSA-N 1 3 347.547 2.878 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2C[C@H]3CCC[C@@]3([NH3+])C2)CC1 ZINC000622004348 479878351 /nfs/dbraw/zinc/87/83/51/479878351.db2.gz NPVZIOFOLRBNGH-TZIWHRDSSA-N 1 3 342.531 2.532 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC000625361037 479885538 /nfs/dbraw/zinc/88/55/38/479885538.db2.gz DCRPEMJJVBOPLE-QGZVKYPTSA-N 1 3 343.515 2.711 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000625361037 479885542 /nfs/dbraw/zinc/88/55/42/479885542.db2.gz DCRPEMJJVBOPLE-QGZVKYPTSA-N 1 3 343.515 2.711 10 0 EFAEHO Cc1cc(Br)cc(C)c1CN[C@@H]1CCOC[C@H]1[C@@H](C)[NH3+] ZINC000422833145 476801701 /nfs/dbraw/zinc/80/17/01/476801701.db2.gz YPTQHQWCZIDDBO-UHOFOFEASA-N 1 3 341.293 2.908 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)[C@H](C)[NH3+] ZINC000399354732 476882102 /nfs/dbraw/zinc/88/21/02/476882102.db2.gz FJQBDUAPJXWVHN-UHOSZYNNSA-N 1 3 331.504 2.729 10 0 EFAEHO COc1cncc(C[NH2+]CC2CCN(c3ccncc3)CC2)c1C ZINC000631106586 479897735 /nfs/dbraw/zinc/89/77/35/479897735.db2.gz WMMAUWYMZNTUEF-UHFFFAOYSA-N 1 3 326.444 2.800 10 0 EFAEHO OCCNCCC[NH2+]Cc1ccc(OCc2ccccc2Cl)cc1 ZINC000013732773 471841274 /nfs/dbraw/zinc/84/12/74/471841274.db2.gz IJNLJCAAFBXMNY-UHFFFAOYSA-N 1 3 348.874 2.981 10 0 EFAEHO OCCNCCC[NH2+]Cc1cccc(OCc2ccccc2Cl)c1 ZINC000013732890 471841624 /nfs/dbraw/zinc/84/16/24/471841624.db2.gz WTLMNEGLBANNBS-UHFFFAOYSA-N 1 3 348.874 2.981 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H]2CCC[C@H](O)C2)CC1 ZINC000088728681 472382042 /nfs/dbraw/zinc/38/20/42/472382042.db2.gz HUMDZQQNMYORPW-ICSRJNTNSA-N 1 3 345.531 2.859 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000069849233 472450689 /nfs/dbraw/zinc/45/06/89/472450689.db2.gz KYSPPHGRSIYFPH-FQEVSTJZSA-N 1 3 341.499 2.983 10 0 EFAEHO COc1ccccc1C[C@@H]([NH2+]CCCN1CCCN(C)CC1)C(C)C ZINC000128637163 472478960 /nfs/dbraw/zinc/47/89/60/472478960.db2.gz NOVBMPNFAZRVQB-HXUWFJFHSA-N 1 3 347.547 2.880 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@@H]3CCCC34CC4)CC2)CC1 ZINC000633780466 479994724 /nfs/dbraw/zinc/99/47/24/479994724.db2.gz VDCKPVMCECPAGR-GOSISDBHSA-N 1 3 333.520 2.632 10 0 EFAEHO CN(CCC[NH+](C)C)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000119645197 472572110 /nfs/dbraw/zinc/57/21/10/472572110.db2.gz LOAKNHAIUUOCMM-HXUWFJFHSA-N 1 3 346.519 2.634 10 0 EFAEHO CC[NH+](CC)[C@@H](C)CNC(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000077793528 472615700 /nfs/dbraw/zinc/61/57/00/472615700.db2.gz JXKLSFICCORXOB-PKOBYXMFSA-N 1 3 346.519 2.853 10 0 EFAEHO C[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccccc1)C(C)(C)C[NH+](C)C ZINC000120162729 472641773 /nfs/dbraw/zinc/64/17/73/472641773.db2.gz ITHFLMHCQYGLMU-WBVHZDCISA-N 1 3 334.508 2.565 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CCC([NH+]2CCCC2)CC1 ZINC000104125078 472656580 /nfs/dbraw/zinc/65/65/80/472656580.db2.gz PQINRZQCRUZAFD-UHFFFAOYSA-N 1 3 341.499 2.983 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)NCCN2CCCC[C@@H]2C)CC1 ZINC000072956242 472746989 /nfs/dbraw/zinc/74/69/89/472746989.db2.gz GEFDPPQMZSBTKC-KRWDZBQOSA-N 1 3 344.503 2.597 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000156755982 472748832 /nfs/dbraw/zinc/74/88/32/472748832.db2.gz NWQJSVFVAOUOMQ-ZWKOTPCHSA-N 1 3 338.540 2.623 10 0 EFAEHO CN(C)CCOc1ccccc1C(=O)NCC1([NH+](C)C)CCCCC1 ZINC000620158630 480008388 /nfs/dbraw/zinc/00/83/88/480008388.db2.gz SFROKWYIZCSLCU-UHFFFAOYSA-N 1 3 347.503 2.621 10 0 EFAEHO O=C(CCN1CCC(C[NH+]2CCCC2)CC1)Nc1cccc(F)c1 ZINC000047972969 472789882 /nfs/dbraw/zinc/78/98/82/472789882.db2.gz NNJPDDLISNHNLZ-UHFFFAOYSA-N 1 3 333.451 2.962 10 0 EFAEHO C[N@@H+](CC1=CCCOC1)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000121179862 472812069 /nfs/dbraw/zinc/81/20/69/472812069.db2.gz PLGYQPUKPGILDB-OAQYLSRUSA-N 1 3 344.499 2.711 10 0 EFAEHO C[N@H+](CC1=CCCOC1)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000121179862 472812072 /nfs/dbraw/zinc/81/20/72/472812072.db2.gz PLGYQPUKPGILDB-OAQYLSRUSA-N 1 3 344.499 2.711 10 0 EFAEHO CC1CC[NH+](CCCCNC(=O)NCCN2CCCC[C@@H]2C)CC1 ZINC000079268750 472841853 /nfs/dbraw/zinc/84/18/53/472841853.db2.gz JUIXNYPNQLMMQT-SFHVURJKSA-N 1 3 338.540 2.672 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[NH+](C(C)(C)CC(C)(C)C)CC1)N(C)C ZINC000622662568 480013841 /nfs/dbraw/zinc/01/38/41/480013841.db2.gz MQUUGCYYWUVCGS-INIZCTEOSA-N 1 3 325.541 2.932 10 0 EFAEHO CC[NH+]1CCC(CCN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)CC1 ZINC000121819612 472922690 /nfs/dbraw/zinc/92/26/90/472922690.db2.gz MRBQNFFBTMCDIH-HNNXBMFYSA-N 1 3 338.517 2.863 10 0 EFAEHO C[NH+](C)C1CCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC1 ZINC000066395640 473089120 /nfs/dbraw/zinc/08/91/20/473089120.db2.gz KTCRYRFSNDEIOC-KRWDZBQOSA-N 1 3 347.478 2.590 10 0 EFAEHO Cc1cc(C)n2c(CN3CCC(CCC[NH+](C)C)CC3)cnc2n1 ZINC000093688546 473134341 /nfs/dbraw/zinc/13/43/41/473134341.db2.gz QHSLHWAUWYEBJD-UHFFFAOYSA-N 1 3 329.492 2.900 10 0 EFAEHO COc1ccccc1C[C@@H]([NH2+]C1CCN(CCN(C)C)CC1)C(C)C ZINC000150997720 473394515 /nfs/dbraw/zinc/39/45/15/473394515.db2.gz ANYTVOZCEZNXFA-HXUWFJFHSA-N 1 3 347.547 2.878 10 0 EFAEHO CCN1CC[C@H](C[NH2+]C2CCN(CCc3ccc(F)cc3)CC2)C1 ZINC000163256437 473426856 /nfs/dbraw/zinc/42/68/56/473426856.db2.gz RZODXNOWQSHOON-GOSISDBHSA-N 1 3 333.495 2.764 10 0 EFAEHO C[C@@H](NC[C@H](O)COCc1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185711365 473494302 /nfs/dbraw/zinc/49/43/02/473494302.db2.gz JQCCHJOHGSHFHG-LMNJBCLMSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@@H](NC[C@H](O)COCc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185711365 473494309 /nfs/dbraw/zinc/49/43/09/473494309.db2.gz JQCCHJOHGSHFHG-LMNJBCLMSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@@H]([NH2+]C[C@H](O)COCc1ccccc1)[C@H]1CCCN(C2CCC2)C1 ZINC000185711365 473494314 /nfs/dbraw/zinc/49/43/14/473494314.db2.gz JQCCHJOHGSHFHG-LMNJBCLMSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1O)c1cccc(OCCN(C)C)c1 ZINC000178356117 473497640 /nfs/dbraw/zinc/49/76/40/473497640.db2.gz KVBWEYIUTCUTDL-RVHYNSKXSA-N 1 3 340.467 2.936 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000166145819 473522158 /nfs/dbraw/zinc/52/21/58/473522158.db2.gz XVFYJZFXQREUTO-FPOVZHCZSA-N 1 3 345.531 2.772 10 0 EFAEHO Cc1ccc(OCC[N@@H+](C)CCCN2CCN(C(C)C)CC2)cc1 ZINC000191400796 473534813 /nfs/dbraw/zinc/53/48/13/473534813.db2.gz CTXDOENOSGJLGO-UHFFFAOYSA-N 1 3 333.520 2.722 10 0 EFAEHO Cc1ccc(OCC[N@H+](C)CCCN2CCN(C(C)C)CC2)cc1 ZINC000191400796 473534818 /nfs/dbraw/zinc/53/48/18/473534818.db2.gz CTXDOENOSGJLGO-UHFFFAOYSA-N 1 3 333.520 2.722 10 0 EFAEHO COc1ccc([C@H](C)[NH2+]C[C@H]2CCN(C3CC3)C2)cc1NC(C)=O ZINC000152454786 473565136 /nfs/dbraw/zinc/56/51/36/473565136.db2.gz SLUXFFVOGXOOEW-DZGCQCFKSA-N 1 3 331.460 2.789 10 0 EFAEHO C[C@@H]([NH2+]C(C)(C)CNC(=O)N1CCN2CCC[C@@H]2C1)c1ccccc1 ZINC000172269369 473565675 /nfs/dbraw/zinc/56/56/75/473565675.db2.gz USJOXVOTRSUITI-SJLPKXTDSA-N 1 3 344.503 2.605 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)CC1 ZINC000152915802 473599532 /nfs/dbraw/zinc/59/95/32/473599532.db2.gz CPEKHNLFEASGNQ-GGPKGHCWSA-N 1 3 329.488 2.628 10 0 EFAEHO CCO[C@H]1C[C@H]([NH2+]Cc2cccc(CN(C)C)c2)C12CCOCC2 ZINC000186226230 473621748 /nfs/dbraw/zinc/62/17/48/473621748.db2.gz NPKXGJQFRSSFAF-OALUTQOASA-N 1 3 332.488 2.812 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]Cc2cccc(CN(C)C)c2)C12CCOCC2 ZINC000186226211 473621788 /nfs/dbraw/zinc/62/17/88/473621788.db2.gz NPKXGJQFRSSFAF-RBUKOAKNSA-N 1 3 332.488 2.812 10 0 EFAEHO CC(C)CN(CC[NH+](C)C)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000179470325 473689696 /nfs/dbraw/zinc/68/96/96/473689696.db2.gz OLZHTZRCWAIXAX-RBUKOAKNSA-N 1 3 346.519 2.661 10 0 EFAEHO Cn1c2ccc(CNCc3cccc(C[NH+](C)C)c3)cc2sc1=O ZINC000192673786 473702933 /nfs/dbraw/zinc/70/29/33/473702933.db2.gz WYTILPQCKYVVTL-UHFFFAOYSA-N 1 3 341.480 2.951 10 0 EFAEHO COc1ccc([C@@H](C)[NH2+]CCCN2CCN(C(C)C)CC2)cc1OC ZINC000192787316 473725289 /nfs/dbraw/zinc/72/52/89/473725289.db2.gz BFMYLNKRSSOQMN-QGZVFWFLSA-N 1 3 349.519 2.771 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1CNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000245616105 473727017 /nfs/dbraw/zinc/72/70/17/473727017.db2.gz CYDXNYIVWOHVQS-QRVBRYPASA-N 1 3 344.503 2.605 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1CNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000245616105 473727025 /nfs/dbraw/zinc/72/70/25/473727025.db2.gz CYDXNYIVWOHVQS-QRVBRYPASA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)C(=O)N1CCCC1 ZINC000281662603 473799303 /nfs/dbraw/zinc/79/93/03/473799303.db2.gz QGUAKZXZDWTNHF-FFGOWVMKSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@H](CO[C@H]1CCOC1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180160269 473815700 /nfs/dbraw/zinc/81/57/00/473815700.db2.gz VOOBCLHCFGHEHL-FWZVCBSNSA-N 1 3 344.499 2.966 10 0 EFAEHO C[C@H](CO[C@H]1CCOC1)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180160269 473815708 /nfs/dbraw/zinc/81/57/08/473815708.db2.gz VOOBCLHCFGHEHL-FWZVCBSNSA-N 1 3 344.499 2.966 10 0 EFAEHO CN1CC[C@@H](NC(=O)c2ccc(C[NH+](C)C)cc2)[C@@H]1c1ccccc1 ZINC000180177742 473820079 /nfs/dbraw/zinc/82/00/79/473820079.db2.gz QQSYNXWRKHLISE-UXHICEINSA-N 1 3 337.467 2.923 10 0 EFAEHO CC(C)[C@@](C)(O)C[NH+]1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000187137049 473824554 /nfs/dbraw/zinc/82/45/54/473824554.db2.gz ZUCOQKYFSFPLMS-LMMKCTJWSA-N 1 3 326.525 2.605 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000617015311 480066980 /nfs/dbraw/zinc/06/69/80/480066980.db2.gz ZOXDYTFCAKHTOG-IBGZPJMESA-N 1 3 343.515 2.888 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N(C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)N(C)C)cc1 ZINC000246511477 473885012 /nfs/dbraw/zinc/88/50/12/473885012.db2.gz XARPJSCJBFDFGW-UHOSZYNNSA-N 1 3 346.519 2.722 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)N(C)C)cc1 ZINC000246511477 473885017 /nfs/dbraw/zinc/88/50/17/473885017.db2.gz XARPJSCJBFDFGW-UHOSZYNNSA-N 1 3 346.519 2.722 10 0 EFAEHO CSc1cc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)ccc1F ZINC000617506597 480249817 /nfs/dbraw/zinc/24/98/17/480249817.db2.gz SMNHNAZVUXSRAT-ZDUSSCGKSA-N 1 3 341.496 2.549 10 0 EFAEHO CSc1cc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)ccc1F ZINC000617506597 480249822 /nfs/dbraw/zinc/24/98/22/480249822.db2.gz SMNHNAZVUXSRAT-ZDUSSCGKSA-N 1 3 341.496 2.549 10 0 EFAEHO CN(C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CCC[C@H]3C[C@]32C)c1 ZINC000282057671 473932613 /nfs/dbraw/zinc/93/26/13/473932613.db2.gz GQHSEKZDKCGFLB-NLWGTHIKSA-N 1 3 329.488 2.646 10 0 EFAEHO CC(C)[N@@H+]1C[C@@H](C)[C@H](NC(=O)NC[C@@H](C)N(C)Cc2ccccc2)C1 ZINC000246732613 473945952 /nfs/dbraw/zinc/94/59/52/473945952.db2.gz APZDHLBOFBYGPN-ZHALLVOQSA-N 1 3 346.519 2.535 10 0 EFAEHO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NC[C@@H](C)N(C)Cc2ccccc2)C1 ZINC000246732613 473945956 /nfs/dbraw/zinc/94/59/56/473945956.db2.gz APZDHLBOFBYGPN-ZHALLVOQSA-N 1 3 346.519 2.535 10 0 EFAEHO CC[N@@H+]1CC[C@@H](CNC(=O)c2ccc(CN3CCCCC3)cc2)C1 ZINC000264529523 474025361 /nfs/dbraw/zinc/02/53/61/474025361.db2.gz KYAVFUZYZCNVGU-SFHVURJKSA-N 1 3 329.488 2.744 10 0 EFAEHO CC[N@H+]1CC[C@@H](CNC(=O)c2ccc(CN3CCCCC3)cc2)C1 ZINC000264529523 474025371 /nfs/dbraw/zinc/02/53/71/474025371.db2.gz KYAVFUZYZCNVGU-SFHVURJKSA-N 1 3 329.488 2.744 10 0 EFAEHO C[C@H]([NH2+]CCCCN1CCOCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000274974725 474027557 /nfs/dbraw/zinc/02/75/57/474027557.db2.gz YJIHIYTXWRHDNM-PZJWPPBQSA-N 1 3 345.531 2.599 10 0 EFAEHO C[N@H+](C[C@H]1CCCO1)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000247143959 474075579 /nfs/dbraw/zinc/07/55/79/474075579.db2.gz LCVJAKDIYMBPHR-UXHICEINSA-N 1 3 332.488 2.543 10 0 EFAEHO C[N@@H+](C[C@H]1CCCO1)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000247143959 474075588 /nfs/dbraw/zinc/07/55/88/474075588.db2.gz LCVJAKDIYMBPHR-UXHICEINSA-N 1 3 332.488 2.543 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCC2([NH+](C)C)CCCC2)[C@@H]1c1ccccc1 ZINC000270330501 474076146 /nfs/dbraw/zinc/07/61/46/474076146.db2.gz HVQRKVNWDUFMRZ-MSOLQXFVSA-N 1 3 344.503 2.605 10 0 EFAEHO CC[C@@H]1CCCCN1CCNC(=O)NCCC1CC[NH+](CC)CC1 ZINC000175100099 474143127 /nfs/dbraw/zinc/14/31/27/474143127.db2.gz XKFNXJAXYZVGOH-GOSISDBHSA-N 1 3 338.540 2.672 10 0 EFAEHO CN(C)CCc1ccccc1NC(=O)N1CCC[C@@H]1C[NH+]1CCCC1 ZINC000275562512 474237639 /nfs/dbraw/zinc/23/76/39/474237639.db2.gz BLIOHDZKSRSGBJ-GOSISDBHSA-N 1 3 344.503 2.883 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000175606772 474262271 /nfs/dbraw/zinc/26/22/71/474262271.db2.gz YVEXOIWKXYAUAR-INIZCTEOSA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CC[N@@H+]1C ZINC000248129062 474263831 /nfs/dbraw/zinc/26/38/31/474263831.db2.gz WFDPFAULFVYECF-YSHGAJCASA-N 1 3 344.503 2.556 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CC[N@H+]1C ZINC000248129062 474263834 /nfs/dbraw/zinc/26/38/34/474263834.db2.gz WFDPFAULFVYECF-YSHGAJCASA-N 1 3 344.503 2.556 10 0 EFAEHO C[N@@H+]1CCC[C@@H]2CN(CCCOc3ccc4c(c3)OCO4)CC[C@H]21 ZINC000248141086 474268355 /nfs/dbraw/zinc/26/83/55/474268355.db2.gz PQTUDGFBBISSDV-NVXWUHKLSA-N 1 3 332.444 2.600 10 0 EFAEHO C[N@H+]1CCC[C@@H]2CN(CCCOc3ccc4c(c3)OCO4)CC[C@H]21 ZINC000248141086 474268360 /nfs/dbraw/zinc/26/83/60/474268360.db2.gz PQTUDGFBBISSDV-NVXWUHKLSA-N 1 3 332.444 2.600 10 0 EFAEHO CN1CCC[C@@H]2C[N@H+](CCCOc3ccc4c(c3)OCO4)CC[C@H]21 ZINC000248141086 474268368 /nfs/dbraw/zinc/26/83/68/474268368.db2.gz PQTUDGFBBISSDV-NVXWUHKLSA-N 1 3 332.444 2.600 10 0 EFAEHO CN1CCC[C@@H]2C[N@@H+](CCCOc3ccc4c(c3)OCO4)CC[C@H]21 ZINC000248141086 474268377 /nfs/dbraw/zinc/26/83/77/474268377.db2.gz PQTUDGFBBISSDV-NVXWUHKLSA-N 1 3 332.444 2.600 10 0 EFAEHO CC(C)[NH2+]C1CCN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CC1 ZINC000248144056 474268442 /nfs/dbraw/zinc/26/84/42/474268442.db2.gz ZCQHCDBVCOUQIA-OALUTQOASA-N 1 3 344.503 2.604 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000248165752 474274651 /nfs/dbraw/zinc/27/46/51/474274651.db2.gz ZSLSOKYNNYSTII-WOJBJXKFSA-N 1 3 341.499 2.981 10 0 EFAEHO C[N@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000248165752 474274660 /nfs/dbraw/zinc/27/46/60/474274660.db2.gz ZSLSOKYNNYSTII-WOJBJXKFSA-N 1 3 341.499 2.981 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)Nc2ccccc2CCN(C)C)CC[N@@H+]1C ZINC000275725332 474295434 /nfs/dbraw/zinc/29/54/34/474295434.db2.gz WOLLECYRIRBHFH-NVXWUHKLSA-N 1 3 332.492 2.737 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)Nc2ccccc2CCN(C)C)CC[N@H+]1C ZINC000275725332 474295440 /nfs/dbraw/zinc/29/54/40/474295440.db2.gz WOLLECYRIRBHFH-NVXWUHKLSA-N 1 3 332.492 2.737 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)Nc2ccccc2CCN(C)C)CC[N@@H+]1C ZINC000275725339 474296622 /nfs/dbraw/zinc/29/66/22/474296622.db2.gz WOLLECYRIRBHFH-RDJZCZTQSA-N 1 3 332.492 2.737 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)Nc2ccccc2CCN(C)C)CC[N@H+]1C ZINC000275725339 474296631 /nfs/dbraw/zinc/29/66/31/474296631.db2.gz WOLLECYRIRBHFH-RDJZCZTQSA-N 1 3 332.492 2.737 10 0 EFAEHO OC[C@H]1C=C[C@@H](N[C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000248407171 474311217 /nfs/dbraw/zinc/31/12/17/474311217.db2.gz BNIYRLJICJHUPO-JRSUCEMESA-N 1 3 326.484 2.814 10 0 EFAEHO OC[C@H]1C=C[C@@H](N[C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000248407171 474311225 /nfs/dbraw/zinc/31/12/25/474311225.db2.gz BNIYRLJICJHUPO-JRSUCEMESA-N 1 3 326.484 2.814 10 0 EFAEHO OC[C@H]1C=C[C@@H]([NH2+][C@@H]2CCC[C@H]3CN(Cc4ccccc4)C[C@@H]32)C1 ZINC000248407171 474311232 /nfs/dbraw/zinc/31/12/32/474311232.db2.gz BNIYRLJICJHUPO-JRSUCEMESA-N 1 3 326.484 2.814 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3[NH2+]2)N(C)C)cc1 ZINC000236976032 474314651 /nfs/dbraw/zinc/31/46/51/474314651.db2.gz NYPYJJZKOUFGNV-MUGJNUQGSA-N 1 3 343.515 2.889 10 0 EFAEHO C[N@H+](CC[C@H]1CCCO1)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000189181405 474317476 /nfs/dbraw/zinc/31/74/76/474317476.db2.gz XPPXYSVKBJGLKH-RTWAWAEBSA-N 1 3 346.515 2.933 10 0 EFAEHO C[N@@H+](CC[C@H]1CCCO1)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000189181405 474317484 /nfs/dbraw/zinc/31/74/84/474317484.db2.gz XPPXYSVKBJGLKH-RTWAWAEBSA-N 1 3 346.515 2.933 10 0 EFAEHO COc1ccccc1/C=C/CN1CCC(C[NH+]2CCN(C)CC2)CC1 ZINC000289550937 474319999 /nfs/dbraw/zinc/31/99/99/474319999.db2.gz XRPKJUMGDDTWER-FNORWQNLSA-N 1 3 343.515 2.668 10 0 EFAEHO CC[NH2+]Cc1ccccc1NC(=O)CC1(N2CCOCC2)CCCC1 ZINC000237028866 474325195 /nfs/dbraw/zinc/32/51/95/474325195.db2.gz MIOIQNRQKUXNFK-UHFFFAOYSA-N 1 3 345.487 2.770 10 0 EFAEHO CCN1CC[C@H](C[NH2+][C@H](CCn2cncn2)c2ccc(C)cc2)C1 ZINC000275867096 474346327 /nfs/dbraw/zinc/34/63/27/474346327.db2.gz NVENOWYERSREEA-IEBWSBKVSA-N 1 3 327.476 2.649 10 0 EFAEHO CC[N@@H+]1CC[C@H](CN[C@H](CCn2cncn2)c2ccc(C)cc2)C1 ZINC000275867096 474346335 /nfs/dbraw/zinc/34/63/35/474346335.db2.gz NVENOWYERSREEA-IEBWSBKVSA-N 1 3 327.476 2.649 10 0 EFAEHO CC[N@H+]1CC[C@H](CN[C@H](CCn2cncn2)c2ccc(C)cc2)C1 ZINC000275867096 474346340 /nfs/dbraw/zinc/34/63/40/474346340.db2.gz NVENOWYERSREEA-IEBWSBKVSA-N 1 3 327.476 2.649 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)NC2CC[NH+](C3CCCC3)CC2)CCN1C ZINC000176020989 474364536 /nfs/dbraw/zinc/36/45/36/474364536.db2.gz WWUYCTAYIQHWAM-CRAIPNDOSA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@H](C(=O)N1CCC(C[NH+]2CCCC2)CC1)[C@@H](N)c1ccccc1 ZINC000237409341 474397035 /nfs/dbraw/zinc/39/70/35/474397035.db2.gz IEFCODUVRIFGCB-QFBILLFUSA-N 1 3 329.488 2.657 10 0 EFAEHO CO[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2N(C)C2CCN(C)CC2)C1 ZINC000248739620 474421425 /nfs/dbraw/zinc/42/14/25/474421425.db2.gz ICQBFJXUFIKNJP-IEBWSBKVSA-N 1 3 331.504 2.874 10 0 EFAEHO CCN1CC[C@@H]([N@H+](C)Cc2ccc3c(c2)sc(=O)n3C)[C@@H](C)C1 ZINC000248796901 474437147 /nfs/dbraw/zinc/43/71/47/474437147.db2.gz ZDYIEXFDBRMEBM-DZGCQCFKSA-N 1 3 333.501 2.762 10 0 EFAEHO CCN1CC[C@@H]([N@@H+](C)Cc2ccc3c(c2)sc(=O)n3C)[C@@H](C)C1 ZINC000248796901 474437151 /nfs/dbraw/zinc/43/71/51/474437151.db2.gz ZDYIEXFDBRMEBM-DZGCQCFKSA-N 1 3 333.501 2.762 10 0 EFAEHO C[N@@H+](C[C@H]1CC2(CCC2)C(=O)O1)C[C@H]1CCN(Cc2ccccc2)C1 ZINC000248846907 474456512 /nfs/dbraw/zinc/45/65/12/474456512.db2.gz NKSMJROAWQKVJM-RTBURBONSA-N 1 3 342.483 2.926 10 0 EFAEHO C[N@H+](C[C@H]1CC2(CCC2)C(=O)O1)C[C@H]1CCN(Cc2ccccc2)C1 ZINC000248846907 474456518 /nfs/dbraw/zinc/45/65/18/474456518.db2.gz NKSMJROAWQKVJM-RTBURBONSA-N 1 3 342.483 2.926 10 0 EFAEHO C[C@H](CN1CCCC1=O)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000248876161 474467017 /nfs/dbraw/zinc/46/70/17/474467017.db2.gz JNTJTNPPPKPJNV-AFYVEPGGSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@H](CN1CCCC1=O)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000248876161 474467021 /nfs/dbraw/zinc/46/70/21/474467021.db2.gz JNTJTNPPPKPJNV-AFYVEPGGSA-N 1 3 341.499 2.783 10 0 EFAEHO CN(CC1([NH+](C)C)CCC1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000248956949 474490815 /nfs/dbraw/zinc/49/08/15/474490815.db2.gz DFANNVUHOSHODZ-QZTJIDSGSA-N 1 3 344.503 2.558 10 0 EFAEHO [NH3+][C@@H]1CCC[C@H](C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)C1 ZINC000237897957 474496627 /nfs/dbraw/zinc/49/66/27/474496627.db2.gz MIRFJCPRGBMAER-OTWHNJEPSA-N 1 3 329.488 2.675 10 0 EFAEHO CC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)OCCCO1 ZINC000249051702 474512283 /nfs/dbraw/zinc/51/22/83/474512283.db2.gz XPLSECWBXXWHTJ-REPLKXPHSA-N 1 3 330.472 2.925 10 0 EFAEHO C[C@@H]1CC[C@@H](C[N@H+](C)CC2CCN(C[C@@H](O)c3ccccc3)CC2)O1 ZINC000249102602 474526373 /nfs/dbraw/zinc/52/63/73/474526373.db2.gz PTZSFXYCCDTXQJ-JRGCBEDISA-N 1 3 346.515 2.931 10 0 EFAEHO C[C@@H]1CC[C@@H](C[N@@H+](C)CC2CCN(C[C@@H](O)c3ccccc3)CC2)O1 ZINC000249102602 474526379 /nfs/dbraw/zinc/52/63/79/474526379.db2.gz PTZSFXYCCDTXQJ-JRGCBEDISA-N 1 3 346.515 2.931 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)CCOCC(F)(F)C(F)(F)F)[C@@H](C)C1 ZINC000249263229 474549392 /nfs/dbraw/zinc/54/93/92/474549392.db2.gz IDVHUSSEFAISON-NWDGAFQWSA-N 1 3 332.357 2.863 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)CCOCC(F)(F)C(F)(F)F)[C@@H](C)C1 ZINC000249263229 474549387 /nfs/dbraw/zinc/54/93/87/474549387.db2.gz IDVHUSSEFAISON-NWDGAFQWSA-N 1 3 332.357 2.863 10 0 EFAEHO CCN(CCC[NH+]1CCCC1)C(=O)c1ccccc1OCCN(C)C ZINC000276471494 474555827 /nfs/dbraw/zinc/55/58/27/474555827.db2.gz PJGJZSOESUBQIE-UHFFFAOYSA-N 1 3 347.503 2.575 10 0 EFAEHO C[N@H+](CC1CCN(C[C@@H](O)c2ccccc2)CC1)C[C@H]1CCCCO1 ZINC000242155976 474558989 /nfs/dbraw/zinc/55/89/89/474558989.db2.gz WUWBDSDDWDHEQZ-NHCUHLMSSA-N 1 3 346.515 2.933 10 0 EFAEHO C[N@@H+](CC1CCN(C[C@@H](O)c2ccccc2)CC1)C[C@H]1CCCCO1 ZINC000242155976 474558994 /nfs/dbraw/zinc/55/89/94/474558994.db2.gz WUWBDSDDWDHEQZ-NHCUHLMSSA-N 1 3 346.515 2.933 10 0 EFAEHO CCN1CC[C@@H](C[NH2+]Cc2cccc(I)c2)C1 ZINC000284145278 474582253 /nfs/dbraw/zinc/58/22/53/474582253.db2.gz YYCYKIWKMIYLKE-ZDUSSCGKSA-N 1 3 344.240 2.723 10 0 EFAEHO CCCN(CC[NH+](CC)CC)C(=O)Nc1ccc2c(c1)OCCNC2 ZINC000625941798 480113553 /nfs/dbraw/zinc/11/35/53/480113553.db2.gz FQSQADDYLLYRLK-UHFFFAOYSA-N 1 3 348.491 2.754 10 0 EFAEHO CN1CCC(CC(=O)NCc2cccc(C[NH+]3CCCC3)c2)CC1 ZINC000291539394 474614504 /nfs/dbraw/zinc/61/45/04/474614504.db2.gz VAYNVSXIXPMQLW-UHFFFAOYSA-N 1 3 329.488 2.631 10 0 EFAEHO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCCN2CCCN(C)CC2)cc1 ZINC000284345562 474624313 /nfs/dbraw/zinc/62/43/13/474624313.db2.gz MZSHRJPCNVZCQC-DUXKGJEZSA-N 1 3 345.531 2.804 10 0 EFAEHO C[C@@H]1C[N@H+](C[C@@H]2CCCO2)CC[C@H]1NCc1cccc2c[nH]nc21 ZINC000252477922 474664389 /nfs/dbraw/zinc/66/43/89/474664389.db2.gz XUZTXJJJPVTKBR-FHLIZLRMSA-N 1 3 328.460 2.542 10 0 EFAEHO C[C@@H]1C[N@@H+](C[C@@H]2CCCO2)CC[C@H]1NCc1cccc2c[nH]nc21 ZINC000252477922 474664395 /nfs/dbraw/zinc/66/43/95/474664395.db2.gz XUZTXJJJPVTKBR-FHLIZLRMSA-N 1 3 328.460 2.542 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC2(O)CCCC2)CC1 ZINC000304963422 474669614 /nfs/dbraw/zinc/66/96/14/474669614.db2.gz NTICFGZJLXXEGP-UHFFFAOYSA-N 1 3 331.504 2.613 10 0 EFAEHO CC[NH+](CC)Cc1cccc(CNC(=O)CC2CCN(C)CC2)c1 ZINC000273156798 474747098 /nfs/dbraw/zinc/74/70/98/474747098.db2.gz AWKTUHAZHWAEPG-UHFFFAOYSA-N 1 3 331.504 2.877 10 0 EFAEHO CC[NH+](CC)Cc1ccccc1CNC(=O)CC1CCN(C)CC1 ZINC000273176532 474760551 /nfs/dbraw/zinc/76/05/51/474760551.db2.gz CZNYUVYZHQRRBC-UHFFFAOYSA-N 1 3 331.504 2.877 10 0 EFAEHO C[C@@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000344785937 474791514 /nfs/dbraw/zinc/79/15/14/474791514.db2.gz BZCKBRFTXXTFRW-XDNAFOTISA-N 1 3 336.524 2.518 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@]34C[C@H]3CCCC4)CC2)CC1 ZINC000634089237 480126232 /nfs/dbraw/zinc/12/62/32/480126232.db2.gz IYPPSAVTNXIAQA-YLJYHZDGSA-N 1 3 333.520 2.632 10 0 EFAEHO CN1CCC(n2cc(NC(=O)C3(C[NH+](C)C)CCCCC3)cn2)CC1 ZINC000634092998 480127389 /nfs/dbraw/zinc/12/73/89/480127389.db2.gz GITIZUSNFBANFS-UHFFFAOYSA-N 1 3 347.507 2.600 10 0 EFAEHO CN(C)CCN(CCCc1ccccc1)C(=O)CC1CC[NH+](C)CC1 ZINC000273266331 474811362 /nfs/dbraw/zinc/81/13/62/474811362.db2.gz UKWUTBYEBRKOKR-UHFFFAOYSA-N 1 3 345.531 2.741 10 0 EFAEHO C[NH+]1CCC(CC(=O)N[C@@H](CN2CCCC2)c2ccccc2)CC1 ZINC000273267854 474813489 /nfs/dbraw/zinc/81/34/89/474813489.db2.gz UQQDCGHUJLLLIX-IBGZPJMESA-N 1 3 329.488 2.672 10 0 EFAEHO O[C@H](C[NH2+][C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)CC(F)(F)F ZINC000307951743 474814317 /nfs/dbraw/zinc/81/43/17/474814317.db2.gz VBWXKHTYJAPLHD-LTIDMASMSA-N 1 3 342.405 2.800 10 0 EFAEHO O[C@H](CN[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12)CC(F)(F)F ZINC000307951743 474814325 /nfs/dbraw/zinc/81/43/25/474814325.db2.gz VBWXKHTYJAPLHD-LTIDMASMSA-N 1 3 342.405 2.800 10 0 EFAEHO O[C@H](CN[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12)CC(F)(F)F ZINC000307951743 474814335 /nfs/dbraw/zinc/81/43/35/474814335.db2.gz VBWXKHTYJAPLHD-LTIDMASMSA-N 1 3 342.405 2.800 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)CC2CC[NH+](C)CC2)N2CCCC2)cc1 ZINC000273291784 474826602 /nfs/dbraw/zinc/82/66/02/474826602.db2.gz YFRRUOPSOQBPDF-FQEVSTJZSA-N 1 3 343.515 2.980 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CCN1C ZINC000340981485 474843599 /nfs/dbraw/zinc/84/35/99/474843599.db2.gz FMBZOAPVHOVVPZ-QFBILLFUSA-N 1 3 344.503 2.564 10 0 EFAEHO Cc1cc(=O)oc2cc(OCC[N@H+]3CC[C@@]4(CCN(C)C4)C3)ccc12 ZINC000292119543 474859534 /nfs/dbraw/zinc/85/95/34/474859534.db2.gz KBIFRNUYRGZYLP-HXUWFJFHSA-N 1 3 342.439 2.508 10 0 EFAEHO Cc1cc(=O)oc2cc(OCC[N@@H+]3CC[C@@]4(CCN(C)C4)C3)ccc12 ZINC000292119543 474859541 /nfs/dbraw/zinc/85/95/41/474859541.db2.gz KBIFRNUYRGZYLP-HXUWFJFHSA-N 1 3 342.439 2.508 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000337305732 474879918 /nfs/dbraw/zinc/87/99/18/474879918.db2.gz UIUGOCSIEKBZML-LJQANCHMSA-N 1 3 335.536 2.975 10 0 EFAEHO CN1CC[C@@]2(CC[N@H+](CCc3nc(-c4cccc(Cl)c4)no3)C2)C1 ZINC000292264731 474930573 /nfs/dbraw/zinc/93/05/73/474930573.db2.gz YXMYTDXUAKIYOH-GOSISDBHSA-N 1 3 346.862 2.960 10 0 EFAEHO CN1CC[C@@]2(CC[N@@H+](CCc3nc(-c4cccc(Cl)c4)no3)C2)C1 ZINC000292264731 474930580 /nfs/dbraw/zinc/93/05/80/474930580.db2.gz YXMYTDXUAKIYOH-GOSISDBHSA-N 1 3 346.862 2.960 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)Nc1cccc(OCC[NH+](C)C)c1 ZINC000337369517 474946662 /nfs/dbraw/zinc/94/66/62/474946662.db2.gz OIHKFQPRYDCNBX-MRXNPFEDSA-N 1 3 348.491 2.623 10 0 EFAEHO CCN1CCN([C@H](C)C[NH2+][C@H](C)c2cnn(C3CCCC3)c2)CC1 ZINC000337408657 474986487 /nfs/dbraw/zinc/98/64/87/474986487.db2.gz UQVCNSISRDTJGL-IAGOWNOFSA-N 1 3 333.524 2.675 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N(C)CC[C@@H]1CCCC[N@@H+]1C ZINC000341117017 474992094 /nfs/dbraw/zinc/99/20/94/474992094.db2.gz HBCLTICZSWHMDC-KURKYZTESA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000341117017 474992103 /nfs/dbraw/zinc/99/21/03/474992103.db2.gz HBCLTICZSWHMDC-KURKYZTESA-N 1 3 338.540 2.765 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)[C@H]2CCCN2Cc2ccccc2)CC1 ZINC000634121462 480139370 /nfs/dbraw/zinc/13/93/70/480139370.db2.gz XEOHIMDOUKBJBB-LJQANCHMSA-N 1 3 343.515 2.984 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000341341103 475042525 /nfs/dbraw/zinc/04/25/25/475042525.db2.gz FEMPRYSIFPBOQW-KSZLIROESA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000341341103 475042533 /nfs/dbraw/zinc/04/25/33/475042533.db2.gz FEMPRYSIFPBOQW-KSZLIROESA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000341351834 475043886 /nfs/dbraw/zinc/04/38/86/475043886.db2.gz CMENELSPIOTOPK-ZIFCJYIRSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000341351834 475043892 /nfs/dbraw/zinc/04/38/92/475043892.db2.gz CMENELSPIOTOPK-ZIFCJYIRSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@H](C(=O)Nc1ccc2c(c1F)CC[NH2+]C2)[C@@H](N)c1ccccc1 ZINC000261746545 475047201 /nfs/dbraw/zinc/04/72/01/475047201.db2.gz ORVPBWGMPLZIRH-KPZWWZAWSA-N 1 3 327.403 2.746 10 0 EFAEHO CC(C)C[C@@H](C[NH+](C)C)NC(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000341393875 475048269 /nfs/dbraw/zinc/04/82/69/475048269.db2.gz RVGYHYLKOHSUAU-MJGOQNOKSA-N 1 3 348.535 2.782 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CC1(N(C)C)CCOCC1 ZINC000268885947 475051564 /nfs/dbraw/zinc/05/15/64/475051564.db2.gz MRZTUPGGHJYKST-ICSRJNTNSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)[C@@H](N)C2CCOCC2)cc1 ZINC000261860664 475088776 /nfs/dbraw/zinc/08/87/76/475088776.db2.gz SEXAVGLMFQZZRX-KXBFYZLASA-N 1 3 345.487 2.753 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCCN1CCOCC1(C)C ZINC000268949017 475088749 /nfs/dbraw/zinc/08/87/49/475088749.db2.gz XEZXKTCVWDRGNU-ICSRJNTNSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCCN1CCOCC1(C)C ZINC000268949017 475088760 /nfs/dbraw/zinc/08/87/60/475088760.db2.gz XEZXKTCVWDRGNU-ICSRJNTNSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)[C@@H](N)C2CCOCC2)cc1 ZINC000261860664 475088784 /nfs/dbraw/zinc/08/87/84/475088784.db2.gz SEXAVGLMFQZZRX-KXBFYZLASA-N 1 3 345.487 2.753 10 0 EFAEHO COc1cc2c(cc1F)CC[C@H]2[NH2+]C1CCN(C[C@H]2CCOC2)CC1 ZINC000281145888 475089736 /nfs/dbraw/zinc/08/97/36/475089736.db2.gz APXXKPLHGLGMSM-AUUYWEPGSA-N 1 3 348.462 2.912 10 0 EFAEHO C[C@@H](CCc1ccc(OC(F)F)cc1)[NH2+]CC1(O)CCN(C)CC1 ZINC000268978160 475107125 /nfs/dbraw/zinc/10/71/25/475107125.db2.gz JXUGPZPMNGAPPP-AWEZNQCLSA-N 1 3 342.430 2.655 10 0 EFAEHO CC[C@H](C)[C@@H]1CN(Cc2ccc(C)nc2)CCN1C[C@@H]1CCC[NH2+]C1 ZINC000261921766 475114823 /nfs/dbraw/zinc/11/48/23/475114823.db2.gz KOEQILQCCNJADT-DSKINZAPSA-N 1 3 344.547 2.922 10 0 EFAEHO C1C[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)[C@H]([C@@H]2COCCN2)C1 ZINC000262017442 475146128 /nfs/dbraw/zinc/14/61/28/475146128.db2.gz WDMHNCDAKFDXBY-AQNXPRMDSA-N 1 3 335.536 2.530 10 0 EFAEHO c1ccc(OC2CCC2)c(CN[C@@H]2CCC[C@H]2[C@@H]2COCC[NH2+]2)c1 ZINC000262029054 475151364 /nfs/dbraw/zinc/15/13/64/475151364.db2.gz XHSRKNPZKRLXND-QRVBRYPASA-N 1 3 330.472 2.865 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)[C@H]2CC[NH2+][C@@H](C)C2)CC1 ZINC000262300229 475216025 /nfs/dbraw/zinc/21/60/25/475216025.db2.gz AFDXMBWWPDYJSI-JZXOWHBKSA-N 1 3 329.488 2.716 10 0 EFAEHO CN(C)C(=O)CC[NH+]1CCC(N[C@@H]2CCCc3cc(F)ccc32)CC1 ZINC000341692173 475226219 /nfs/dbraw/zinc/22/62/19/475226219.db2.gz CHHHEXQFKHFZFE-LJQANCHMSA-N 1 3 347.478 2.735 10 0 EFAEHO c1ccc(CN2C[C@H](C[NH2+]C3CCOCC3)C3(C2)CCOCC3)cc1 ZINC000339485941 475249348 /nfs/dbraw/zinc/24/93/48/475249348.db2.gz BEHCPEFFMGSZIR-IBGZPJMESA-N 1 3 344.499 2.684 10 0 EFAEHO CC1(C[NH2+]C[C@@H]2CN(Cc3ccccc3)CC23CCOCC3)COC1 ZINC000339488206 475251206 /nfs/dbraw/zinc/25/12/06/475251206.db2.gz NUQXIOGZYCEWFJ-LJQANCHMSA-N 1 3 344.499 2.541 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]CCN2[C@H](C)CCC[C@@H]2C)[C@@H](C)C1 ZINC000361218486 475276624 /nfs/dbraw/zinc/27/66/24/475276624.db2.gz YTHAFKGHJCVHLW-HAGHYFMRSA-N 1 3 339.568 2.976 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](N[C@H]2CCN(c3ccccc3)C2)[C@H](C)C1 ZINC000361216944 475277372 /nfs/dbraw/zinc/27/73/72/475277372.db2.gz OXSQIMAOJQNNJS-DYXWJJEUSA-N 1 3 345.531 2.992 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](N[C@H]2CCN(c3ccccc3)C2)[C@H](C)C1 ZINC000361216944 475277379 /nfs/dbraw/zinc/27/73/79/475277379.db2.gz OXSQIMAOJQNNJS-DYXWJJEUSA-N 1 3 345.531 2.992 10 0 EFAEHO O=C(CC(F)(F)F)NC[C@H]1CCC[N@H+](CCCN2CCCCC2)C1 ZINC000352469379 475325752 /nfs/dbraw/zinc/32/57/52/475325752.db2.gz XFQDJEZBACQANW-OAHLLOKOSA-N 1 3 349.441 2.643 10 0 EFAEHO O=C(CC(F)(F)F)NC[C@H]1CCC[N@@H+](CCCN2CCCCC2)C1 ZINC000352469379 475325758 /nfs/dbraw/zinc/32/57/58/475325758.db2.gz XFQDJEZBACQANW-OAHLLOKOSA-N 1 3 349.441 2.643 10 0 EFAEHO C[NH+](C)CC1CCN(C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000358012557 475334498 /nfs/dbraw/zinc/33/44/98/475334498.db2.gz IUUHNFDZKWJOBM-UHFFFAOYSA-N 1 3 329.488 2.696 10 0 EFAEHO CN(C)CCNC(=O)c1cccc(C[NH2+][C@H]2CC[C@@H]2C(C)(C)C)c1 ZINC000348112747 475400400 /nfs/dbraw/zinc/40/04/00/475400400.db2.gz RGRUDTBDNJKFMO-ROUUACIJSA-N 1 3 331.504 2.892 10 0 EFAEHO CN(C)CCNC(=O)c1cccc(C[NH2+][C@H]2CC[C@@H]2C2CCC2)c1 ZINC000337992920 475489077 /nfs/dbraw/zinc/48/90/77/475489077.db2.gz RJRGOIZHSXMVRE-MOPGFXCFSA-N 1 3 329.488 2.646 10 0 EFAEHO CN(C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CC[C@@H]2C2CCC2)c1 ZINC000337992947 475489225 /nfs/dbraw/zinc/48/92/25/475489225.db2.gz RJRGOIZHSXMVRE-RTBURBONSA-N 1 3 329.488 2.646 10 0 EFAEHO CC1=CCN(CC[NH2+][C@H](C)c2ccc(OCCN(C)C)cc2)CC1 ZINC000358249530 475525213 /nfs/dbraw/zinc/52/52/13/475525213.db2.gz KIMHYDUPNZOIGN-GOSISDBHSA-N 1 3 331.504 2.930 10 0 EFAEHO CN(C(=O)CC[C@H]1CCCC[N@@H+]1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000354930742 475530406 /nfs/dbraw/zinc/53/04/06/475530406.db2.gz NORAOGYURPCGKA-UXHICEINSA-N 1 3 343.515 2.984 10 0 EFAEHO CN(C(=O)CC[C@H]1CCCC[N@H+]1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000354930742 475530416 /nfs/dbraw/zinc/53/04/16/475530416.db2.gz NORAOGYURPCGKA-UXHICEINSA-N 1 3 343.515 2.984 10 0 EFAEHO CN(C(=O)CC[C@H]1CCCC[N@@H+]1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000354930744 475532014 /nfs/dbraw/zinc/53/20/14/475532014.db2.gz NORAOGYURPCGKA-WOJBJXKFSA-N 1 3 343.515 2.984 10 0 EFAEHO CN(C(=O)CC[C@H]1CCCC[N@H+]1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000354930744 475532024 /nfs/dbraw/zinc/53/20/24/475532024.db2.gz NORAOGYURPCGKA-WOJBJXKFSA-N 1 3 343.515 2.984 10 0 EFAEHO CCN(Cc1ccccc1C[N@H+](CC)[C@@H]1CCOC1)[C@@H]1CCOC1 ZINC000361587774 475573073 /nfs/dbraw/zinc/57/30/73/475573073.db2.gz KSHHKYUXAJWLSN-WOJBJXKFSA-N 1 3 332.488 2.908 10 0 EFAEHO CCN(Cc1ccccc1C[N@@H+](CC)[C@@H]1CCOC1)[C@@H]1CCOC1 ZINC000361587774 475573078 /nfs/dbraw/zinc/57/30/78/475573078.db2.gz KSHHKYUXAJWLSN-WOJBJXKFSA-N 1 3 332.488 2.908 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]Cc2ccc(CO)c(F)c2)[C@@H](C)C1 ZINC000358368107 475624347 /nfs/dbraw/zinc/62/43/47/475624347.db2.gz NDVLMFJXLNNGOA-HNAYVOBHSA-N 1 3 338.467 2.545 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000355061563 475635700 /nfs/dbraw/zinc/63/57/00/475635700.db2.gz VNGIRGHMUJCLNM-IBGZPJMESA-N 1 3 349.494 2.980 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000355061563 475635707 /nfs/dbraw/zinc/63/57/07/475635707.db2.gz VNGIRGHMUJCLNM-IBGZPJMESA-N 1 3 349.494 2.980 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)NCCCCC[NH+]1CCCCC1 ZINC000348406406 475645547 /nfs/dbraw/zinc/64/55/47/475645547.db2.gz TUMQNHQYPSSZSL-SFHVURJKSA-N 1 3 338.540 2.816 10 0 EFAEHO CN(C)[C@H](CNC(=O)NCC[N@H+](C)C1CCCCC1)c1ccccc1 ZINC000338313048 475774612 /nfs/dbraw/zinc/77/46/12/475774612.db2.gz HDSHVCSTMGUVOY-LJQANCHMSA-N 1 3 346.519 2.853 10 0 EFAEHO CN(C)[C@H](CNC(=O)NCC[N@@H+](C)C1CCCCC1)c1ccccc1 ZINC000338313048 475774618 /nfs/dbraw/zinc/77/46/18/475774618.db2.gz HDSHVCSTMGUVOY-LJQANCHMSA-N 1 3 346.519 2.853 10 0 EFAEHO CN(C)Cc1ccccc1CNC(=O)C1(C[NH+](C)C)CCCCC1 ZINC000358596660 475795197 /nfs/dbraw/zinc/79/51/97/475795197.db2.gz GDUWGMARLHUKPJ-UHFFFAOYSA-N 1 3 331.504 2.877 10 0 EFAEHO Cc1ccc(CN(CCN(C)C)C(=O)C2(C[NH+](C)C)CCCCC2)o1 ZINC000358603851 475803370 /nfs/dbraw/zinc/80/33/70/475803370.db2.gz QUPWYMVMYDREIO-UHFFFAOYSA-N 1 3 349.519 2.990 10 0 EFAEHO CN1CCC(N2CCC([NH2+][C@@H]3CCC[C@H]([C@H]4CCOC4)C3)CC2)CC1 ZINC000361895472 475849838 /nfs/dbraw/zinc/84/98/38/475849838.db2.gz XXRRJFHCDIYBDD-CMKODMSKSA-N 1 3 349.563 2.730 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@H]1CCCC[N@@H+]1C)N(C)Cc1ccccc1 ZINC000353505860 476028972 /nfs/dbraw/zinc/02/89/72/476028972.db2.gz ZCYSHFUERJWCAS-PKOBYXMFSA-N 1 3 331.504 2.888 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@H]1CCCC[N@H+]1C)N(C)Cc1ccccc1 ZINC000353505860 476028979 /nfs/dbraw/zinc/02/89/79/476028979.db2.gz ZCYSHFUERJWCAS-PKOBYXMFSA-N 1 3 331.504 2.888 10 0 EFAEHO CN(C(=O)c1ccc(C[NH+]2CCCCC2)cc1)[C@@H]1CCN(C2CC2)C1 ZINC000347007825 476029792 /nfs/dbraw/zinc/02/97/92/476029792.db2.gz HUOJRYSGGLUEBL-HXUWFJFHSA-N 1 3 341.499 2.981 10 0 EFAEHO CN(C(=O)C1CC[NH+](Cc2ccccc2)CC1)[C@H]1CCN(C2CC2)C1 ZINC000347020215 476040382 /nfs/dbraw/zinc/04/03/82/476040382.db2.gz SVIPZZIWEWGRAY-FQEVSTJZSA-N 1 3 341.499 2.594 10 0 EFAEHO CN(C)C1(C[NH2+][C@H]2CCN(C)[C@H]3CCC[C@H]32)Cc2ccccc2C1 ZINC000353520657 476042759 /nfs/dbraw/zinc/04/27/59/476042759.db2.gz OJWAZFZXWOEXML-UFYCRDLUSA-N 1 3 327.516 2.548 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000355604845 476043657 /nfs/dbraw/zinc/04/36/57/476043657.db2.gz UHNZSRWNZNJEFA-JFIYKMOQSA-N 1 3 334.508 2.707 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000355604848 476044123 /nfs/dbraw/zinc/04/41/23/476044123.db2.gz UHNZSRWNZNJEFA-SOLBZPMBSA-N 1 3 334.508 2.707 10 0 EFAEHO C[N@@H+]1CC[C@H](NCc2ccc(-n3ccnc3)c(F)c2)[C@H]2CCC[C@@H]21 ZINC000353521554 476044672 /nfs/dbraw/zinc/04/46/72/476044672.db2.gz QAVPLFVFAJPZNW-NJAFHUGGSA-N 1 3 328.435 2.974 10 0 EFAEHO C[N@H+]1CC[C@H](NCc2ccc(-n3ccnc3)c(F)c2)[C@H]2CCC[C@@H]21 ZINC000353521554 476044677 /nfs/dbraw/zinc/04/46/77/476044677.db2.gz QAVPLFVFAJPZNW-NJAFHUGGSA-N 1 3 328.435 2.974 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccc(-n3ccnc3)c(F)c2)[C@H]2CCC[C@@H]21 ZINC000353521554 476044683 /nfs/dbraw/zinc/04/46/83/476044683.db2.gz QAVPLFVFAJPZNW-NJAFHUGGSA-N 1 3 328.435 2.974 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cc(F)ccc2N2CCOCC2)[C@@H]2CCC[C@H]21 ZINC000353524756 476046727 /nfs/dbraw/zinc/04/67/27/476046727.db2.gz WVCMSQBIWQHTKF-CMKODMSKSA-N 1 3 347.478 2.625 10 0 EFAEHO COCC[C@H](C)[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340465922 476053357 /nfs/dbraw/zinc/05/33/57/476053357.db2.gz JUZFCTXJAGDXMK-AZUAARDMSA-N 1 3 346.515 2.930 10 0 EFAEHO CC[C@@H](COC)[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340468735 476053654 /nfs/dbraw/zinc/05/36/54/476053654.db2.gz SUKRXYWEWPYMKJ-PMACEKPBSA-N 1 3 346.515 2.930 10 0 EFAEHO CO[C@H](C)[C@H](C)[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340469976 476053923 /nfs/dbraw/zinc/05/39/23/476053923.db2.gz YBILXYXFDJJVEW-NSHGMRRFSA-N 1 3 346.515 2.928 10 0 EFAEHO C[N@H+](Cc1ccccc1)C1CCC(NCc2cc(C(N)=O)co2)CC1 ZINC000340508148 476072976 /nfs/dbraw/zinc/07/29/76/476072976.db2.gz XGLFIIMRQPSWCM-UHFFFAOYSA-N 1 3 341.455 2.911 10 0 EFAEHO C[N@@H+](Cc1ccccc1)C1CCC(NCc2cc(C(N)=O)co2)CC1 ZINC000340508148 476072980 /nfs/dbraw/zinc/07/29/80/476072980.db2.gz XGLFIIMRQPSWCM-UHFFFAOYSA-N 1 3 341.455 2.911 10 0 EFAEHO CC[C@H](Cn1cncn1)[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000353576205 476093212 /nfs/dbraw/zinc/09/32/12/476093212.db2.gz MXWOPFXRQVWRKJ-VQTJNVASSA-N 1 3 341.503 2.949 10 0 EFAEHO CC[C@H](Cn1cncn1)NC[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000353576205 476093218 /nfs/dbraw/zinc/09/32/18/476093218.db2.gz MXWOPFXRQVWRKJ-VQTJNVASSA-N 1 3 341.503 2.949 10 0 EFAEHO CC[C@H](Cn1cncn1)NC[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000353576205 476093223 /nfs/dbraw/zinc/09/32/23/476093223.db2.gz MXWOPFXRQVWRKJ-VQTJNVASSA-N 1 3 341.503 2.949 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)[C@H]1n1cccn1 ZINC000340541358 476096686 /nfs/dbraw/zinc/09/66/86/476096686.db2.gz QGPLBLWGZYXRNI-XUVXKRRUSA-N 1 3 346.519 2.988 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)[C@@H]1n1cccn1 ZINC000340541359 476096774 /nfs/dbraw/zinc/09/67/74/476096774.db2.gz QGPLBLWGZYXRNI-ZCNNSNEGSA-N 1 3 346.519 2.988 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)CCN1C ZINC000336693906 476125543 /nfs/dbraw/zinc/12/55/43/476125543.db2.gz IBXRTHRSZSJRAB-LELZANKISA-N 1 3 327.516 2.969 10 0 EFAEHO Cc1nn(C)c(C)c1C[C@@H](C)[NH2+]C1CCN(c2ccncc2)CC1 ZINC000362279499 476136096 /nfs/dbraw/zinc/13/60/96/476136096.db2.gz QPZYAJUNDFXXEX-CQSZACIVSA-N 1 3 327.476 2.622 10 0 EFAEHO CC[C@@H]1C[C@H](CN2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)CCO1 ZINC000356998347 476151901 /nfs/dbraw/zinc/15/19/01/476151901.db2.gz UBWLVGBXAHKKFV-VNTMZGSJSA-N 1 3 337.552 2.682 10 0 EFAEHO C[C@@H]1CCC[C@@H]([NH+]2CCC(N[C@H]3CCC(=O)NC34CCC4)CC2)C1 ZINC000338774020 476175703 /nfs/dbraw/zinc/17/57/03/476175703.db2.gz CLXIBTSJVJOIIV-NXHRZFHOSA-N 1 3 333.520 2.820 10 0 EFAEHO C[C@@H]1CCC[C@@H](N2CCC([NH2+][C@H]3CCC(=O)NC34CCC4)CC2)C1 ZINC000338774020 476175710 /nfs/dbraw/zinc/17/57/10/476175710.db2.gz CLXIBTSJVJOIIV-NXHRZFHOSA-N 1 3 333.520 2.820 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC[C@@H]2CCOC2)CC1 ZINC000344259048 476193785 /nfs/dbraw/zinc/19/37/85/476193785.db2.gz CUPGWBCGAGEPQU-GOSISDBHSA-N 1 3 331.504 2.735 10 0 EFAEHO O=C(N[C@@H]1CCN(C2CC2)C1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000359245189 476218393 /nfs/dbraw/zinc/21/83/93/476218393.db2.gz ZDOUCFZSFAFYOG-ZWKOTPCHSA-N 1 3 348.535 2.521 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@@H]2C[C@H](C)O)CC1 ZINC000353860578 476303914 /nfs/dbraw/zinc/30/39/14/476303914.db2.gz XZAAIMSXEGYBPT-AZUAARDMSA-N 1 3 345.531 2.954 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@@H]2C[C@H](C)O)CC1 ZINC000353860578 476303916 /nfs/dbraw/zinc/30/39/16/476303916.db2.gz XZAAIMSXEGYBPT-AZUAARDMSA-N 1 3 345.531 2.954 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@@H]1CC[N@H+](C)[C@@H](C)C1)[C@H](c1ccccc1)N(C)C ZINC000357278727 476313030 /nfs/dbraw/zinc/31/30/30/476313030.db2.gz WSYYNGGJSKSJSJ-RNIPGJKVSA-N 1 3 346.519 2.802 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1)[C@H](c1ccccc1)N(C)C ZINC000357278727 476313031 /nfs/dbraw/zinc/31/30/31/476313031.db2.gz WSYYNGGJSKSJSJ-RNIPGJKVSA-N 1 3 346.519 2.802 10 0 EFAEHO C[C@H]1C[C@@H](c2nc(-c3cccc(OCC[NH+](C)C)c3)no2)CCN1C ZINC000351225771 476370649 /nfs/dbraw/zinc/37/06/49/476370649.db2.gz ZXFYNFVIKIYVKK-HOCLYGCPSA-N 1 3 344.459 2.875 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)N(C)C1CCCCC1 ZINC000362770884 476399817 /nfs/dbraw/zinc/39/98/17/476399817.db2.gz VQTNFAJAKLIBGB-GOSISDBHSA-N 1 3 338.540 2.719 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)N(C)C1CCCCC1 ZINC000362770884 476399824 /nfs/dbraw/zinc/39/98/24/476399824.db2.gz VQTNFAJAKLIBGB-GOSISDBHSA-N 1 3 338.540 2.719 10 0 EFAEHO C[C@@H](CCNC(=O)CC1CCN(C)CC1)[N@H+](C)Cc1ccccc1 ZINC000362855565 476444846 /nfs/dbraw/zinc/44/48/46/476444846.db2.gz MXMJLMDYNQTWTC-KRWDZBQOSA-N 1 3 331.504 2.745 10 0 EFAEHO C[C@@H](CCNC(=O)CC1CCN(C)CC1)[N@@H+](C)Cc1ccccc1 ZINC000362855565 476444854 /nfs/dbraw/zinc/44/48/54/476444854.db2.gz MXMJLMDYNQTWTC-KRWDZBQOSA-N 1 3 331.504 2.745 10 0 EFAEHO Cc1cc(C[NH+]2CCC(C)(CN3CCN(C)CC3)CC2)cc(C)c1O ZINC000377703163 476532049 /nfs/dbraw/zinc/53/20/49/476532049.db2.gz VWDVLQSQLZHJEQ-UHFFFAOYSA-N 1 3 345.531 2.859 10 0 EFAEHO CC(C)CCNC(=[NH2+])NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000369876484 476568784 /nfs/dbraw/zinc/56/87/84/476568784.db2.gz ADBKPNXRVJRMJK-UHFFFAOYSA-N 1 3 334.430 2.952 10 0 EFAEHO CC1CC[NH+](CCCCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC000377773154 476572685 /nfs/dbraw/zinc/57/26/85/476572685.db2.gz GAIXDRQYXFXFMX-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](CC[NH+](C)C)NC(=O)N1CCN(Cc2ccccc2)CC[C@@H]1C ZINC000370004564 476627562 /nfs/dbraw/zinc/62/75/62/476627562.db2.gz CLCHRAKZYVJECF-MSOLQXFVSA-N 1 3 346.519 2.633 10 0 EFAEHO CCC[NH+]1CCC(NC[C@@H](CO)Cc2ccc(F)c(F)c2)CC1 ZINC000357844606 476645848 /nfs/dbraw/zinc/64/58/48/476645848.db2.gz FHOLRVGDWOBZSJ-HNNXBMFYSA-N 1 3 326.431 2.580 10 0 EFAEHO COC(=O)C1CC[NH+](CCCNc2ccnc3ccc(C)cc32)CC1 ZINC000354520828 476704105 /nfs/dbraw/zinc/70/41/05/476704105.db2.gz FOBBMANBASTQIO-UHFFFAOYSA-N 1 3 341.455 2.652 10 0 EFAEHO CCOC(=O)C1([C@H](C)NCc2ccc3ccccc3n2)CC[NH2+]CC1 ZINC000422707689 476736735 /nfs/dbraw/zinc/73/67/35/476736735.db2.gz WYKIAZHYZQJVDY-HNNXBMFYSA-N 1 3 341.455 2.646 10 0 EFAEHO N[C@@H]1CCC[C@H]1[NH2+][C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000422725153 476745719 /nfs/dbraw/zinc/74/57/19/476745719.db2.gz ARFJXLYOTWPZHE-ARFHVFGLSA-N 1 3 327.394 2.749 10 0 EFAEHO [NH3+][C@@H]1CCC[C@H]1N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000422725153 476745727 /nfs/dbraw/zinc/74/57/27/476745727.db2.gz ARFJXLYOTWPZHE-ARFHVFGLSA-N 1 3 327.394 2.749 10 0 EFAEHO [NH3+]C1CCC(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CC1 ZINC000383415914 476750356 /nfs/dbraw/zinc/75/03/56/476750356.db2.gz WMMDNQPQXXGFAK-LMDPOFIKSA-N 1 3 329.488 2.532 10 0 EFAEHO C[C@H]([NH3+])[C@H](Cc1ccccc1)NCc1ccc(F)c(CN(C)C)c1 ZINC000422748025 476757611 /nfs/dbraw/zinc/75/76/11/476757611.db2.gz RQLPVXDZYKXGBN-YWZLYKJASA-N 1 3 329.463 2.935 10 0 EFAEHO C[C@H](N)[C@H](Cc1ccccc1)[NH2+]Cc1ccc(F)c(CN(C)C)c1 ZINC000422748025 476757615 /nfs/dbraw/zinc/75/76/15/476757615.db2.gz RQLPVXDZYKXGBN-YWZLYKJASA-N 1 3 329.463 2.935 10 0 EFAEHO NC[C@H]1CCCC[C@H]1[NH2+]CC1CCN(C(=O)c2ccccc2)CC1 ZINC000422770282 476769763 /nfs/dbraw/zinc/76/97/63/476769763.db2.gz UUDKWLOJPXWUDO-RTBURBONSA-N 1 3 329.488 2.646 10 0 EFAEHO COc1cccc(O[C@@H](C)C[NH2+][C@@H](C)c2ccc(CN)nc2C)c1 ZINC000422779153 476772332 /nfs/dbraw/zinc/77/23/32/476772332.db2.gz BPYAIMJCMJQVEE-KBPBESRZSA-N 1 3 329.444 2.975 10 0 EFAEHO c1ccc2nc(CCN[C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)ccc2c1 ZINC000422779012 476772670 /nfs/dbraw/zinc/77/26/70/476772670.db2.gz IBTZPXOHJPRHRM-YZGWKJHDSA-N 1 3 325.456 2.524 10 0 EFAEHO COC[C@H]([NH2+]CC1(N2CCCCC2)CCN(C)CC1)C1CCCC1 ZINC000375343529 476789429 /nfs/dbraw/zinc/78/94/29/476789429.db2.gz FKMXZURSWBIGNE-IBGZPJMESA-N 1 3 337.552 2.732 10 0 EFAEHO COc1ccc([C@H](NC[C@]2(N(C)C)CCSC2)[C@@H]2CCC[NH2+]2)cc1 ZINC000422817856 476791616 /nfs/dbraw/zinc/79/16/16/476791616.db2.gz DZDHCCHUTWZDCP-GBESFXJTSA-N 1 3 349.544 2.515 10 0 EFAEHO COc1ccc([C@H](NCCN2CCC[C@H](C)C2)[C@H]2CCC[NH2+]2)cc1 ZINC000422859703 476815749 /nfs/dbraw/zinc/81/57/49/476815749.db2.gz KTBCIKYJPHKSEA-DBVUQKKJSA-N 1 3 331.504 2.810 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCN(c2ncccc2Cl)C1 ZINC000422872034 476821893 /nfs/dbraw/zinc/82/18/93/476821893.db2.gz FJUXFBUGTWCAMA-DZGCQCFKSA-N 1 3 345.878 2.827 10 0 EFAEHO COc1ccc(CCN[C@@H]2CCOC[C@H]2[C@H]2CCC[NH2+]2)c(Cl)c1 ZINC000422892423 476830489 /nfs/dbraw/zinc/83/04/89/476830489.db2.gz YNBDIFNRDRPYEG-CGTJXYLNSA-N 1 3 338.879 2.638 10 0 EFAEHO Fc1cccc(F)c1CN1CCC[C@@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000422901084 476837422 /nfs/dbraw/zinc/83/74/22/476837422.db2.gz BHZXSRCOHVXRHR-IUOOZAAYSA-N 1 3 335.442 2.802 10 0 EFAEHO Fc1cccc(F)c1CN1CCC[C@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000422901085 476837657 /nfs/dbraw/zinc/83/76/57/476837657.db2.gz BHZXSRCOHVXRHR-QGPPMGRFSA-N 1 3 335.442 2.802 10 0 EFAEHO CCN1CCCC[C@@H]1CN[C@H](c1ccc(OC)cc1)[C@@H]1CCC[NH2+]1 ZINC000422908468 476841881 /nfs/dbraw/zinc/84/18/81/476841881.db2.gz MQJHAGVVTLTTHR-YZGWKJHDSA-N 1 3 331.504 2.952 10 0 EFAEHO C(CN[C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)Cc1nnc2n1CCCCC2 ZINC000422915894 476844454 /nfs/dbraw/zinc/84/44/54/476844454.db2.gz BWRHLIMCFUEUSS-RCCFBDPRSA-N 1 3 345.535 2.838 10 0 EFAEHO C(C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCCN1)Cc1nnc2n1CCCCC2 ZINC000422915894 476844466 /nfs/dbraw/zinc/84/44/66/476844466.db2.gz BWRHLIMCFUEUSS-RCCFBDPRSA-N 1 3 345.535 2.838 10 0 EFAEHO COC[C@@H](CCC[NH3+])NC1(c2cccc(Br)c2)CC1 ZINC000422936356 476853380 /nfs/dbraw/zinc/85/33/80/476853380.db2.gz BKXXZAFVIJHUGP-CQSZACIVSA-N 1 3 327.266 2.782 10 0 EFAEHO CC1(C)C[C@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCO1 ZINC000397498736 476856548 /nfs/dbraw/zinc/85/65/48/476856548.db2.gz DWDBDOVCBPSOBB-GOSISDBHSA-N 1 3 332.488 2.561 10 0 EFAEHO Cc1nc(C)c(C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)s1 ZINC000397634391 476857665 /nfs/dbraw/zinc/85/76/65/476857665.db2.gz OWZDRSUZPJJTRU-UHFFFAOYSA-N 1 3 345.512 2.877 10 0 EFAEHO Cc1ccc(CNCC2(O)CC[NH+](Cc3ccccc3)CC2)nc1 ZINC000397617381 476857915 /nfs/dbraw/zinc/85/79/15/476857915.db2.gz USOZAALYCNSKAU-UHFFFAOYSA-N 1 3 325.456 2.507 10 0 EFAEHO COc1cc(Br)ccc1CCCN[C@@H]1CCC[C@H]1[NH3+] ZINC000423028346 476897274 /nfs/dbraw/zinc/89/72/74/476897274.db2.gz GDGILZYSMGVVAI-ZIAGYGMSSA-N 1 3 327.266 2.860 10 0 EFAEHO CC(C)[N@@H+]1CC[C@@H](N(C)C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000457119316 476886071 /nfs/dbraw/zinc/88/60/71/476886071.db2.gz NKUWANFMMSZMFP-LJQANCHMSA-N 1 3 329.488 2.837 10 0 EFAEHO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000457119316 476886075 /nfs/dbraw/zinc/88/60/75/476886075.db2.gz NKUWANFMMSZMFP-LJQANCHMSA-N 1 3 329.488 2.837 10 0 EFAEHO NCC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2CCc2ccccc2)C1 ZINC000414694283 476886778 /nfs/dbraw/zinc/88/67/78/476886778.db2.gz NASHDASDWBXQHA-VQTJNVASSA-N 1 3 343.515 2.671 10 0 EFAEHO NCC(=O)N1CCC[C@@H](C[N@H+]2CCCC[C@@H]2CCc2ccccc2)C1 ZINC000414694283 476886788 /nfs/dbraw/zinc/88/67/88/476886788.db2.gz NASHDASDWBXQHA-VQTJNVASSA-N 1 3 343.515 2.671 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@@H](Cn1ccnc1)c1ccc(C)cc1C ZINC000423007862 476889252 /nfs/dbraw/zinc/88/92/52/476889252.db2.gz YULGWQXHRCMYAH-MJGOQNOKSA-N 1 3 330.476 2.585 10 0 EFAEHO [NH3+][C@@H]1CCC[C@H]1NCCCOc1ncc(C(F)(F)F)cc1Cl ZINC000423008374 476889434 /nfs/dbraw/zinc/88/94/34/476889434.db2.gz AAQDKZWRAZMCCB-VXGBXAGGSA-N 1 3 337.773 2.992 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@H](Cn1ccnc1)c1ccc(C)cc1C ZINC000423007861 476889807 /nfs/dbraw/zinc/88/98/07/476889807.db2.gz YULGWQXHRCMYAH-IEBWSBKVSA-N 1 3 330.476 2.585 10 0 EFAEHO COC[C@]1(C[NH2+][C@H](C)CCc2ccc(OC(F)F)cc2)CCCN1 ZINC000414956270 476901646 /nfs/dbraw/zinc/90/16/46/476901646.db2.gz OOWAGRYJYAUZJU-RDTXWAMCSA-N 1 3 342.430 2.967 10 0 EFAEHO COc1cccc([C@@H]2[C@@H](NC3C[C@H]4CC[C@@H](C3)[NH2+]4)CCN2C2CC2)c1 ZINC000423043206 476902534 /nfs/dbraw/zinc/90/25/34/476902534.db2.gz NVYHFPSEZGHYRL-WLALMCHYSA-N 1 3 341.499 2.846 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@H](CO)Cc1ccc(F)c(F)c1 ZINC000423069341 476914769 /nfs/dbraw/zinc/91/47/69/476914769.db2.gz DTILFEYUHJWRJF-SWLSCSKDSA-N 1 3 349.425 2.629 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@H](C)c1ccc(Br)cc1OC ZINC000423074523 476916136 /nfs/dbraw/zinc/91/61/36/476916136.db2.gz UXQDQCBHVUNKFP-YPMHNXCESA-N 1 3 345.281 2.862 10 0 EFAEHO Cc1cc(N2CCC[C@H](N[C@@H](C)C[C@H]3CCCCC[NH2+]3)C2)n(C)n1 ZINC000423074378 476916949 /nfs/dbraw/zinc/91/69/49/476916949.db2.gz LLEBWNKQTYDJGI-JQHSSLGASA-N 1 3 333.524 2.598 10 0 EFAEHO OC[C@H](CN[C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1)Cc1ccc(F)c(F)c1 ZINC000423082171 476920534 /nfs/dbraw/zinc/92/05/34/476920534.db2.gz WGSHQDWGKHTIMR-ILRDRHFLSA-N 1 3 338.442 2.626 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2CCC[C@H]2N)ccc1I ZINC000423092332 476926433 /nfs/dbraw/zinc/92/64/33/476926433.db2.gz BJIUSVYJNSRBNT-OLZOCXBDSA-N 1 3 330.213 2.569 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2CNCC[C@@H]2C)ccc1I ZINC000423092087 476926544 /nfs/dbraw/zinc/92/65/44/476926544.db2.gz ANSSHJFLMQVCAW-IINYFYTJSA-N 1 3 344.240 2.687 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@@H]1CCN(c2ccccc2F)C1 ZINC000423122832 476935727 /nfs/dbraw/zinc/93/57/27/476935727.db2.gz DFYAPEHRVXZWGL-GDBMZVCRSA-N 1 3 328.435 2.917 10 0 EFAEHO C[C@H](CCc1ccc(I)cc1)[NH2+]CCCN ZINC000423184871 476958001 /nfs/dbraw/zinc/95/80/01/476958001.db2.gz IYAGEBMZMXYUEC-LLVKDONJSA-N 1 3 332.229 2.551 10 0 EFAEHO C[NH2+]Cc1ccccc1NC(=O)N[C@H](Cc1ccccc1)CN(C)C ZINC000415899349 476962676 /nfs/dbraw/zinc/96/26/76/476962676.db2.gz JNWDPZMGJOXVIB-GOSISDBHSA-N 1 3 340.471 2.700 10 0 EFAEHO O=C(Nc1ccc2c(c1)CNC2)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000415993661 476982128 /nfs/dbraw/zinc/98/21/28/476982128.db2.gz FTSVNPDOPCQGIN-DNVCBOLYSA-N 1 3 340.471 2.770 10 0 EFAEHO O=C(Nc1ccc2c(c1)CNC2)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000415993661 476982133 /nfs/dbraw/zinc/98/21/33/476982133.db2.gz FTSVNPDOPCQGIN-DNVCBOLYSA-N 1 3 340.471 2.770 10 0 EFAEHO C[C@H]([NH2+][C@H]1CCNC[C@H]1C)c1ccc(OCc2nccn2C)cc1 ZINC000423362568 477007337 /nfs/dbraw/zinc/00/73/37/477007337.db2.gz BGBPKQPUWFIPIS-VKJFTORMSA-N 1 3 328.460 2.648 10 0 EFAEHO C[C@H]([NH2+][C@H]1CCNC[C@H]1C)c1ccc(I)cc1 ZINC000423385726 477012564 /nfs/dbraw/zinc/01/25/64/477012564.db2.gz GYUSBGJUZCTHOX-SUNKGSAMSA-N 1 3 344.240 2.940 10 0 EFAEHO COc1ccc([C@H](Cc2ccncc2)[NH2+][C@H]2CCNC[C@H]2C)cc1 ZINC000423387128 477014028 /nfs/dbraw/zinc/01/40/28/477014028.db2.gz HOQHWXHDRYIIKD-XPGWFJOJSA-N 1 3 325.456 2.962 10 0 EFAEHO CO[C@@]1(CN[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCOC1 ZINC000447598412 477020381 /nfs/dbraw/zinc/02/03/81/477020381.db2.gz HFAAABYKYMEDDE-IYWMVGAKSA-N 1 3 330.472 2.577 10 0 EFAEHO CO[C@@]1(CN[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCOC1 ZINC000447598412 477020384 /nfs/dbraw/zinc/02/03/84/477020384.db2.gz HFAAABYKYMEDDE-IYWMVGAKSA-N 1 3 330.472 2.577 10 0 EFAEHO CN(C)[C@H](CC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC000416153634 477042640 /nfs/dbraw/zinc/04/26/40/477042640.db2.gz DVBKUXKFINYDQC-XVLXNVKGSA-N 1 3 329.488 2.811 10 0 EFAEHO CN(C)[C@H](CC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000416153634 477042646 /nfs/dbraw/zinc/04/26/46/477042646.db2.gz DVBKUXKFINYDQC-XVLXNVKGSA-N 1 3 329.488 2.811 10 0 EFAEHO FC1(F)CCNC[C@@H]1N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000423488737 477046373 /nfs/dbraw/zinc/04/63/73/477046373.db2.gz VPOFURLXLYOJAS-MHORFTMASA-N 1 3 335.442 2.769 10 0 EFAEHO FC1(F)CCNC[C@@H]1N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000423488737 477046378 /nfs/dbraw/zinc/04/63/78/477046378.db2.gz VPOFURLXLYOJAS-MHORFTMASA-N 1 3 335.442 2.769 10 0 EFAEHO CCC[N@H+](C)C[C@@H]1CCN(C(=O)CCN2CCc3ccccc3C2)C1 ZINC000416163576 477049633 /nfs/dbraw/zinc/04/96/33/477049633.db2.gz UTGZUCOHHVFREH-SFHVURJKSA-N 1 3 343.515 2.625 10 0 EFAEHO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)CCN2CCc3ccccc3C2)C1 ZINC000416163576 477049637 /nfs/dbraw/zinc/04/96/37/477049637.db2.gz UTGZUCOHHVFREH-SFHVURJKSA-N 1 3 343.515 2.625 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCc2nnc(-c3ccccc3)o2)[C@@H]2CCC[C@@H]21 ZINC000375855652 477050746 /nfs/dbraw/zinc/05/07/46/477050746.db2.gz BMUQIMLHEXYGIR-ULQDDVLXSA-N 1 3 326.444 2.742 10 0 EFAEHO C[N@H+]1CC[C@H](NCCc2nnc(-c3ccccc3)o2)[C@@H]2CCC[C@@H]21 ZINC000375855652 477050752 /nfs/dbraw/zinc/05/07/52/477050752.db2.gz BMUQIMLHEXYGIR-ULQDDVLXSA-N 1 3 326.444 2.742 10 0 EFAEHO COc1cc(OC)cc(OCC[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@H]32)c1 ZINC000375891930 477066253 /nfs/dbraw/zinc/06/62/53/477066253.db2.gz XKAIKBIBZRXQRP-IPMKNSEASA-N 1 3 334.460 2.545 10 0 EFAEHO COc1cc(OC)cc(OCCN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)c1 ZINC000375891930 477066261 /nfs/dbraw/zinc/06/62/61/477066261.db2.gz XKAIKBIBZRXQRP-IPMKNSEASA-N 1 3 334.460 2.545 10 0 EFAEHO COc1cc(OC)cc(OCCN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@H]32)c1 ZINC000375891930 477066263 /nfs/dbraw/zinc/06/62/63/477066263.db2.gz XKAIKBIBZRXQRP-IPMKNSEASA-N 1 3 334.460 2.545 10 0 EFAEHO C[N@@H+]1CCCC12CCN(C(=O)CCN1CCc3ccccc3C1)CC2 ZINC000416197130 477066591 /nfs/dbraw/zinc/06/65/91/477066591.db2.gz XSRSIRIQXZFQHS-UHFFFAOYSA-N 1 3 341.499 2.522 10 0 EFAEHO C[N@H+]1CCCC12CCN(C(=O)CCN1CCc3ccccc3C1)CC2 ZINC000416197130 477066595 /nfs/dbraw/zinc/06/65/95/477066595.db2.gz XSRSIRIQXZFQHS-UHFFFAOYSA-N 1 3 341.499 2.522 10 0 EFAEHO COc1cccc(C[C@H](C)NCC2([NH3+])C3CC4CC(C3)CC2C4)n1 ZINC000423533114 477067002 /nfs/dbraw/zinc/06/70/02/477067002.db2.gz WUHPPLJVJCGQHF-IJGSYPAGSA-N 1 3 329.488 2.764 10 0 EFAEHO COc1cccc(C[C@H](C)[NH2+]CC2(N)C3CC4CC(C3)CC2C4)n1 ZINC000423533114 477067008 /nfs/dbraw/zinc/06/70/08/477067008.db2.gz WUHPPLJVJCGQHF-IJGSYPAGSA-N 1 3 329.488 2.764 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@H](O)c2ccc(Cl)c(F)c2)[C@@H]2CCC[C@@H]21 ZINC000375896078 477068252 /nfs/dbraw/zinc/06/82/52/477068252.db2.gz SOLRZYXFQDOXNP-STECZYCISA-N 1 3 326.843 2.975 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)[C@@H]2CCC[C@@H]21 ZINC000375896078 477068258 /nfs/dbraw/zinc/06/82/58/477068258.db2.gz SOLRZYXFQDOXNP-STECZYCISA-N 1 3 326.843 2.975 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)[C@@H]2CCC[C@@H]21 ZINC000375896078 477068264 /nfs/dbraw/zinc/06/82/64/477068264.db2.gz SOLRZYXFQDOXNP-STECZYCISA-N 1 3 326.843 2.975 10 0 EFAEHO CN1CCN(c2ccc(N[C@@H]3CC[N@H+](C)[C@H]4CCC[C@@H]43)cc2)CC1 ZINC000375898265 477069892 /nfs/dbraw/zinc/06/98/92/477069892.db2.gz QSBNEGBXQYBFJO-AQNXPRMDSA-N 1 3 328.504 2.723 10 0 EFAEHO CN1CCN(c2ccc(N[C@@H]3CC[N@@H+](C)[C@H]4CCC[C@@H]43)cc2)CC1 ZINC000375898265 477069900 /nfs/dbraw/zinc/06/99/00/477069900.db2.gz QSBNEGBXQYBFJO-AQNXPRMDSA-N 1 3 328.504 2.723 10 0 EFAEHO C[C@H](CCNC(=O)CCN1CCc2ccccc2C1)[NH+]1CCCCC1 ZINC000416204614 477070542 /nfs/dbraw/zinc/07/05/42/477070542.db2.gz PAKWSNSRRMIAAI-GOSISDBHSA-N 1 3 343.515 2.816 10 0 EFAEHO O=C([C@@H]1CCCN1Cc1ccccc1)N1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000371020232 477085676 /nfs/dbraw/zinc/08/56/76/477085676.db2.gz XNHBFGMWIFQJNF-ZCNNSNEGSA-N 1 3 341.499 2.642 10 0 EFAEHO CN(C)CCOc1ccc(CNC(=O)CC[C@H]2CCCC[N@@H+]2C)cc1 ZINC000431763668 477091644 /nfs/dbraw/zinc/09/16/44/477091644.db2.gz CHCNPINCBYKXFZ-GOSISDBHSA-N 1 3 347.503 2.508 10 0 EFAEHO CN(C)CCOc1ccc(CNC(=O)CC[C@H]2CCCC[N@H+]2C)cc1 ZINC000431763668 477091649 /nfs/dbraw/zinc/09/16/49/477091649.db2.gz CHCNPINCBYKXFZ-GOSISDBHSA-N 1 3 347.503 2.508 10 0 EFAEHO CN(C)[C@@H](CC(=O)NC1CCC(C[NH+](C)C)CC1)c1ccccc1 ZINC000431830134 477102168 /nfs/dbraw/zinc/10/21/68/477102168.db2.gz HYXSXXJDHMHVOY-KVZIAJEVSA-N 1 3 331.504 2.916 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000431835172 477104460 /nfs/dbraw/zinc/10/44/60/477104460.db2.gz XGIBANVSUSOIEL-MISYRCLQSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CC[C@H]1CCCC[N@H+]1C ZINC000431835172 477104467 /nfs/dbraw/zinc/10/44/67/477104467.db2.gz XGIBANVSUSOIEL-MISYRCLQSA-N 1 3 343.515 2.888 10 0 EFAEHO C[NH+](C)CC1CCC(NC(=O)C(C)(C)[C@H](N)c2ccccc2)CC1 ZINC000423743313 477130227 /nfs/dbraw/zinc/13/02/27/477130227.db2.gz JZEKHHNTTZQZRS-VMWRSERWSA-N 1 3 331.504 2.949 10 0 EFAEHO CC1(C)CCCN[C@@H]1C(=O)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000423785749 477143621 /nfs/dbraw/zinc/14/36/21/477143621.db2.gz ABUSQSYVYNEKDM-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H](CO)N1CCN(Cc2cccc(C[NH+]3CCCCC3)c2)CC1 ZINC000411293681 477185169 /nfs/dbraw/zinc/18/51/69/477185169.db2.gz MDVRSWRHCCCQEK-NRFANRHFSA-N 1 3 345.531 2.561 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2c(F)cccc2-n2cccn2)[C@@H]2CCC[C@H]21 ZINC000453349186 477211386 /nfs/dbraw/zinc/21/13/86/477211386.db2.gz JGVGEWYKLSSGJW-JCGIZDLHSA-N 1 3 328.435 2.974 10 0 EFAEHO CC[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@H]2CCC[C@@H]21)C(=O)NC ZINC000453398932 477222068 /nfs/dbraw/zinc/22/20/68/477222068.db2.gz JTXKYQAIOUCRFP-HCXYKTFWSA-N 1 3 329.488 2.544 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H]2CC[C@H](C)O2)CC1 ZINC000453638100 477258794 /nfs/dbraw/zinc/25/87/94/477258794.db2.gz ZEGFQBIYGZNOOA-HKUYNNGSSA-N 1 3 331.504 2.876 10 0 EFAEHO CC(C)n1cncc1C[NH2+]CCc1ccc(OCCN(C)C)cc1 ZINC000424155645 477311410 /nfs/dbraw/zinc/31/14/10/477311410.db2.gz NHTFWXRGMJINFM-UHFFFAOYSA-N 1 3 330.476 2.737 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@@H](c2ccccc2)[C@@H]2CCOC2)CC1 ZINC000367045077 477313974 /nfs/dbraw/zinc/31/39/74/477313974.db2.gz ZCRYEUGJRTXJMV-RTWAWAEBSA-N 1 3 345.531 2.770 10 0 EFAEHO C[N@H+](CCCNC(=O)NC[C@@H](N)c1ccccc1)Cc1ccccc1 ZINC000416867690 477345662 /nfs/dbraw/zinc/34/56/62/477345662.db2.gz CZNKIQJNPBXBFL-LJQANCHMSA-N 1 3 340.471 2.508 10 0 EFAEHO C[N@@H+](CCCNC(=O)NC[C@@H](N)c1ccccc1)Cc1ccccc1 ZINC000416867690 477345667 /nfs/dbraw/zinc/34/56/67/477345667.db2.gz CZNKIQJNPBXBFL-LJQANCHMSA-N 1 3 340.471 2.508 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@@H]([NH2+]Cc3ccccc3CN3CC[C@H](O)C3)C[C@H]2C1 ZINC000424281472 477355446 /nfs/dbraw/zinc/35/54/46/477355446.db2.gz NMVRNIKVQBQRQE-HGJUEJDCSA-N 1 3 344.499 2.546 10 0 EFAEHO C[C@H]1NCCN(C(=O)NCc2ccccc2C[NH+]2CCCCC2)[C@@H]1C ZINC000416902664 477361392 /nfs/dbraw/zinc/36/13/92/477361392.db2.gz LUHZZAHKOGRXIR-IAGOWNOFSA-N 1 3 344.503 2.564 10 0 EFAEHO C[C@@H]1[C@H](C)NCCN1C(=O)NCc1ccccc1C[NH+]1CCCCC1 ZINC000416902661 477361450 /nfs/dbraw/zinc/36/14/50/477361450.db2.gz LUHZZAHKOGRXIR-DLBZAZTESA-N 1 3 344.503 2.564 10 0 EFAEHO C[C@H]1NCCN(C(=O)NCc2ccccc2C[NH+]2CCCCC2)[C@H]1C ZINC000416902669 477361616 /nfs/dbraw/zinc/36/16/16/477361616.db2.gz LUHZZAHKOGRXIR-SJORKVTESA-N 1 3 344.503 2.564 10 0 EFAEHO CC(C)[C@H](CNC(=O)NC[C@H](N)c1ccccc1)[NH+]1CCC(C)CC1 ZINC000416999930 477415738 /nfs/dbraw/zinc/41/57/38/477415738.db2.gz CNBXFBQHJVAUJM-OALUTQOASA-N 1 3 346.519 2.742 10 0 EFAEHO COC(=O)C(C)(C)CNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449062658 477416228 /nfs/dbraw/zinc/41/62/28/477416228.db2.gz ZEAPCUROJXOXCU-INIZCTEOSA-N 1 3 332.488 2.871 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(N[C@@H](C)Cn2cccn2)CC1 ZINC000449078355 477426386 /nfs/dbraw/zinc/42/63/86/477426386.db2.gz ULTJIQXAYRKVIA-ZWKOTPCHSA-N 1 3 326.488 2.957 10 0 EFAEHO C[C@@H](Cc1ccccc1)N1CCC([NH2+][C@@H]2CCN(C3CC3)C2)CC1 ZINC000449130727 477452437 /nfs/dbraw/zinc/45/24/37/477452437.db2.gz HOFIVPYGFCPZOJ-FXAWDEMLSA-N 1 3 327.516 2.908 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(N[C@@H]2CCN(C3CC3)C2)CC1 ZINC000449130727 477452453 /nfs/dbraw/zinc/45/24/53/477452453.db2.gz HOFIVPYGFCPZOJ-FXAWDEMLSA-N 1 3 327.516 2.908 10 0 EFAEHO CC(C)N1CC[C@@H]([NH2+]C2CCN([C@@H](C)Cc3ccccc3)CC2)C1=O ZINC000449156427 477461625 /nfs/dbraw/zinc/46/16/25/477461625.db2.gz NYSAHROMZLXLDH-FXAWDEMLSA-N 1 3 343.515 2.681 10 0 EFAEHO CCC(=O)N1CC[C@H](NC2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)C1 ZINC000449194696 477479603 /nfs/dbraw/zinc/47/96/03/477479603.db2.gz VKBBIGFMZLWMBG-PXNSSMCTSA-N 1 3 343.515 2.683 10 0 EFAEHO Cc1c(C[NH2+]C2CCN([C@@H](C)Cc3ccccc3)CC2)cnn1C ZINC000449205308 477485440 /nfs/dbraw/zinc/48/54/40/477485440.db2.gz NYRVWMKKGMYNIE-INIZCTEOSA-N 1 3 326.488 2.914 10 0 EFAEHO CC[C@H](C)NC(=O)[C@@H](C)[NH2+]C1CCN([C@@H](C)Cc2ccccc2)CC1 ZINC000449221864 477494290 /nfs/dbraw/zinc/49/42/90/477494290.db2.gz UUDRQJAOTPECEG-OKZBNKHCSA-N 1 3 345.531 2.975 10 0 EFAEHO CC[C@H](C)NC(=O)[C@H](C)[NH2+]C1CCN([C@@H](C)Cc2ccccc2)CC1 ZINC000449221861 477494467 /nfs/dbraw/zinc/49/44/67/477494467.db2.gz UUDRQJAOTPECEG-BZSNNMDCSA-N 1 3 345.531 2.975 10 0 EFAEHO CC[C@H](C)NC(=O)[C@@H](C)[NH2+]C1CCN([C@H](C)Cc2ccccc2)CC1 ZINC000449221866 477494652 /nfs/dbraw/zinc/49/46/52/477494652.db2.gz UUDRQJAOTPECEG-RCCFBDPRSA-N 1 3 345.531 2.975 10 0 EFAEHO CCO[C@@H]1COCC[C@H]1NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449238253 477501729 /nfs/dbraw/zinc/50/17/29/477501729.db2.gz QLSPDVJKIPCXEY-IOMROCGXSA-N 1 3 346.515 2.866 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NCCc2ccn(C)n2)CC1 ZINC000449244835 477504917 /nfs/dbraw/zinc/50/49/17/477504917.db2.gz WEOUJZWEDKPCFZ-KRWDZBQOSA-N 1 3 326.488 2.648 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NCCOCC(F)F)CC1 ZINC000449270513 477515894 /nfs/dbraw/zinc/51/58/94/477515894.db2.gz ADNFSFMXDMEHNE-OAHLLOKOSA-N 1 3 326.431 2.953 10 0 EFAEHO COCC[C@H](COC)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449337018 477554552 /nfs/dbraw/zinc/55/45/52/477554552.db2.gz OYTPVFLRSWNNDR-FXAWDEMLSA-N 1 3 334.504 2.723 10 0 EFAEHO CC1CC[NH+](C2CCC(NC(=O)N3CCN4CCC3CC4)CC2)CC1 ZINC000376914159 477560557 /nfs/dbraw/zinc/56/05/57/477560557.db2.gz JPTAVURCJCUESZ-UHFFFAOYSA-N 1 3 348.535 2.519 10 0 EFAEHO COc1cc(C[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@@H]32)cc(OC)c1OC ZINC000367537947 477563334 /nfs/dbraw/zinc/56/33/34/477563334.db2.gz KKMRMHKRUMPSLX-BZUAXINKSA-N 1 3 334.460 2.675 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cccc(N3CCCC3=O)c2)[C@@H]2CCC[C@H]21 ZINC000367612323 477601622 /nfs/dbraw/zinc/60/16/22/477601622.db2.gz ADTDTDKGDFSHHZ-GBESFXJTSA-N 1 3 327.472 2.776 10 0 EFAEHO CCCNC(=O)c1cccc(C[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@@H]32)c1 ZINC000367639253 477614263 /nfs/dbraw/zinc/61/42/63/477614263.db2.gz UNPFCWCTZNJEST-QRVBRYPASA-N 1 3 329.488 2.789 10 0 EFAEHO CCCNC(=O)c1cccc(C[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@@H]32)c1 ZINC000367639250 477614743 /nfs/dbraw/zinc/61/47/43/477614743.db2.gz UNPFCWCTZNJEST-GUDVDZBRSA-N 1 3 329.488 2.789 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccnc(OCC(F)(F)F)c2)[C@H]2CCC[C@@H]21 ZINC000367753352 477673785 /nfs/dbraw/zinc/67/37/85/477673785.db2.gz JVBNIEFVRFRYKP-ILXRZTDVSA-N 1 3 343.393 2.985 10 0 EFAEHO CN(C(=O)c1cccc(C[NH+]2CCCCC2)c1)[C@H]1CN2CCC1CC2 ZINC000413424627 477674215 /nfs/dbraw/zinc/67/42/15/477674215.db2.gz GQLOGTPVVQAIFX-FQEVSTJZSA-N 1 3 341.499 2.839 10 0 EFAEHO CN1CCC(O)(C[NH2+][C@H]2CCCc3ncc(C(F)(F)F)cc32)CC1 ZINC000427689765 477777341 /nfs/dbraw/zinc/77/73/41/477777341.db2.gz JSIWIJSWACPWGU-HNNXBMFYSA-N 1 3 343.393 2.524 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCN(Cc3ccccc3)C[C@@H](C)C2)CC[N@@H+]1C ZINC000456326943 477862437 /nfs/dbraw/zinc/86/24/37/477862437.db2.gz HACYZGWVTJAMIV-HBFSDRIKSA-N 1 3 343.515 2.697 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCN(Cc3ccccc3)C[C@@H](C)C2)CC[N@H+]1C ZINC000456326943 477862446 /nfs/dbraw/zinc/86/24/46/477862446.db2.gz HACYZGWVTJAMIV-HBFSDRIKSA-N 1 3 343.515 2.697 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)C1 ZINC000558652133 477905930 /nfs/dbraw/zinc/90/59/30/477905930.db2.gz AOHKOPBDWMDKCK-ROUUACIJSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)C1 ZINC000558652133 477905939 /nfs/dbraw/zinc/90/59/39/477905939.db2.gz AOHKOPBDWMDKCK-ROUUACIJSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)C1 ZINC000558652132 477906355 /nfs/dbraw/zinc/90/63/55/477906355.db2.gz AOHKOPBDWMDKCK-QZTJIDSGSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccccc2C[N@H+]2CCC[C@@H](C)C2)C1 ZINC000558652132 477906362 /nfs/dbraw/zinc/90/63/62/477906362.db2.gz AOHKOPBDWMDKCK-QZTJIDSGSA-N 1 3 343.515 2.877 10 0 EFAEHO c1ccc2c(c1)OC[C@H](CC[NH2+]C1CCN(c3ccncc3)CC1)O2 ZINC000459439046 477907981 /nfs/dbraw/zinc/90/79/81/477907981.db2.gz VJUFLKWDWDIFSY-SFHVURJKSA-N 1 3 339.439 2.870 10 0 EFAEHO CC(C)C[C@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccccc1)C(=O)NCCN(C)C ZINC000558975568 477948638 /nfs/dbraw/zinc/94/86/38/477948638.db2.gz WPJQMQZVVRDHGW-LEAZDLGRSA-N 1 3 345.531 2.861 10 0 EFAEHO CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCC[NH+]1[C@H](C)CCC[C@H]1C ZINC000439310698 477961998 /nfs/dbraw/zinc/96/19/98/477961998.db2.gz VRABCZNQYXZPHQ-TVFCKZIOSA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)NCC2([NH+](C)C)CCCCCC2)CCN1C ZINC000465620604 477981534 /nfs/dbraw/zinc/98/15/34/477981534.db2.gz AGVDODCELQRBLG-IAGOWNOFSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H](NCCC[NH2+]Cc1cccnc1)c1ccc2c(c1)CCC(=O)N2 ZINC000516759563 477981899 /nfs/dbraw/zinc/98/18/99/477981899.db2.gz HUGGAITZFLSEHF-OAHLLOKOSA-N 1 3 338.455 2.797 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)NCC2([NH+](C)C)CCCCCC2)CCN1C ZINC000465620602 477982757 /nfs/dbraw/zinc/98/27/57/477982757.db2.gz AGVDODCELQRBLG-DLBZAZTESA-N 1 3 338.540 2.765 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000465873009 477992305 /nfs/dbraw/zinc/99/23/05/477992305.db2.gz KTKQMOUZYVGVQB-OKZBNKHCSA-N 1 3 338.540 2.765 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000465873009 477992309 /nfs/dbraw/zinc/99/23/09/477992309.db2.gz KTKQMOUZYVGVQB-OKZBNKHCSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NCCOC[C@@H]2CCCO2)CC1 ZINC000560112396 478022223 /nfs/dbraw/zinc/02/22/23/478022223.db2.gz DOGLEMZXYBJOJX-RXVVDRJESA-N 1 3 346.515 2.867 10 0 EFAEHO CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+]CC(=O)NC1CCN(C2CC2)CC1 ZINC000440058042 478066253 /nfs/dbraw/zinc/06/62/53/478066253.db2.gz BIWQYYUWRSEPTC-ROUUACIJSA-N 1 3 335.536 2.924 10 0 EFAEHO CCCN1CCN(c2ccccc2CN(C)C[C@@H]2CCC[N@@H+]2C)CC1 ZINC000421409252 478077488 /nfs/dbraw/zinc/07/74/88/478077488.db2.gz MGEDPNAQMQXVMW-FQEVSTJZSA-N 1 3 344.547 2.745 10 0 EFAEHO CCCN1CCN(c2ccccc2CN(C)C[C@@H]2CCC[N@H+]2C)CC1 ZINC000421409252 478077494 /nfs/dbraw/zinc/07/74/94/478077494.db2.gz MGEDPNAQMQXVMW-FQEVSTJZSA-N 1 3 344.547 2.745 10 0 EFAEHO OC[C@@H]1CCC[N@@H+]1CCCCNCc1cnc(-c2ccncc2)s1 ZINC000440333943 478104655 /nfs/dbraw/zinc/10/46/55/478104655.db2.gz GASVKEHEEIYPIF-INIZCTEOSA-N 1 3 346.500 2.532 10 0 EFAEHO OC[C@@H]1CCC[N@H+]1CCCCNCc1cnc(-c2ccncc2)s1 ZINC000440333943 478104661 /nfs/dbraw/zinc/10/46/61/478104661.db2.gz GASVKEHEEIYPIF-INIZCTEOSA-N 1 3 346.500 2.532 10 0 EFAEHO OC[C@H]1CCC[N@@H+]1CCCCNCc1cnc(-c2ccncc2)s1 ZINC000440333945 478105755 /nfs/dbraw/zinc/10/57/55/478105755.db2.gz GASVKEHEEIYPIF-MRXNPFEDSA-N 1 3 346.500 2.532 10 0 EFAEHO OC[C@H]1CCC[N@H+]1CCCCNCc1cnc(-c2ccncc2)s1 ZINC000440333945 478105766 /nfs/dbraw/zinc/10/57/66/478105766.db2.gz GASVKEHEEIYPIF-MRXNPFEDSA-N 1 3 346.500 2.532 10 0 EFAEHO COC[C@@H](C)C[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000560598565 478115226 /nfs/dbraw/zinc/11/52/26/478115226.db2.gz VQDFVHSNAJXZLR-ICSRJNTNSA-N 1 3 346.515 2.787 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NCC3CCCCC3)CC2)CC1 ZINC000561069701 478150166 /nfs/dbraw/zinc/15/01/66/478150166.db2.gz LVLAJPKWMSSFJJ-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)NC1CCC(C[NH+](C)C)CC1 ZINC000440789884 478161442 /nfs/dbraw/zinc/16/14/42/478161442.db2.gz DFHHUYLJKVIZKT-MRLCAUJQSA-N 1 3 338.540 2.669 10 0 EFAEHO CC[NH+](CC)CCO[C@H]1CCN(CCN2CCCc3ccccc32)C1 ZINC000536377430 478249335 /nfs/dbraw/zinc/24/93/35/478249335.db2.gz GJYJBJBXPDCJNI-FQEVSTJZSA-N 1 3 345.531 2.872 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)NCC1CC[NH+](CCC)CC1 ZINC000490223991 478323730 /nfs/dbraw/zinc/32/37/30/478323730.db2.gz WMTSVWFNSQPHCQ-UHFFFAOYSA-N 1 3 338.540 2.626 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)N1CCC[N@@H+](C(C)(C)C)CC1 ZINC000594310526 478327311 /nfs/dbraw/zinc/32/73/11/478327311.db2.gz FKRGPGVMJPHRTK-IRXDYDNUSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)N1CCC[N@H+](C(C)(C)C)CC1 ZINC000594310526 478327318 /nfs/dbraw/zinc/32/73/18/478327318.db2.gz FKRGPGVMJPHRTK-IRXDYDNUSA-N 1 3 338.540 2.765 10 0 EFAEHO Cc1ccc(OC[C@@H](O)CN2CCC(C[N@@H+](C)C(C)C)CC2)cc1 ZINC000590786596 478340217 /nfs/dbraw/zinc/34/02/17/478340217.db2.gz GWSQCEHINUPHTA-IBGZPJMESA-N 1 3 334.504 2.787 10 0 EFAEHO Cc1ccc(OC[C@@H](O)CN2CCC(C[N@H+](C)C(C)C)CC2)cc1 ZINC000590786596 478340222 /nfs/dbraw/zinc/34/02/22/478340222.db2.gz GWSQCEHINUPHTA-IBGZPJMESA-N 1 3 334.504 2.787 10 0 EFAEHO CCC[N@H+](CC)Cc1ccc(C(=O)N[C@H]2CNCCC2(F)F)cc1 ZINC000563115686 478452907 /nfs/dbraw/zinc/45/29/07/478452907.db2.gz ZNHRKCYWSDDVHK-INIZCTEOSA-N 1 3 339.430 2.646 10 0 EFAEHO CCC[N@@H+](CC)Cc1ccc(C(=O)N[C@H]2CNCCC2(F)F)cc1 ZINC000563115686 478452916 /nfs/dbraw/zinc/45/29/16/478452916.db2.gz ZNHRKCYWSDDVHK-INIZCTEOSA-N 1 3 339.430 2.646 10 0 EFAEHO CN(C)CCNC(=O)[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C1CCCC1 ZINC000527641775 478459104 /nfs/dbraw/zinc/45/91/04/478459104.db2.gz FUULWCXMQATLIB-VQTJNVASSA-N 1 3 343.515 2.603 10 0 EFAEHO CN(C)CCNC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C1CCCC1 ZINC000527641775 478459114 /nfs/dbraw/zinc/45/91/14/478459114.db2.gz FUULWCXMQATLIB-VQTJNVASSA-N 1 3 343.515 2.603 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N(C)CCC[NH+](C)C)c1ccsc1 ZINC000541786014 478590434 /nfs/dbraw/zinc/59/04/34/478590434.db2.gz SODUAVPQHFEPBP-MRXNPFEDSA-N 1 3 340.537 2.724 10 0 EFAEHO CCCN1CCN(c2ccccc2CNC[C@@H](C)C[NH+](C)C)CC1 ZINC000491588305 478596903 /nfs/dbraw/zinc/59/69/03/478596903.db2.gz GWYRRZBAUGGIEC-GOSISDBHSA-N 1 3 332.536 2.506 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)CCN(C)c2ccncc2)C1 ZINC000541856168 478597986 /nfs/dbraw/zinc/59/79/86/478597986.db2.gz JMXCTEFZVUGISF-QZTJIDSGSA-N 1 3 346.519 2.782 10 0 EFAEHO C[C@@H](NC(=O)CCN(C)c1ccncc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541893819 478608739 /nfs/dbraw/zinc/60/87/39/478608739.db2.gz KPRBQDBZYPLTKW-IAGOWNOFSA-N 1 3 344.503 2.677 10 0 EFAEHO C[C@@H](NC(=O)CCN(C)c1ccncc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000541893819 478608745 /nfs/dbraw/zinc/60/87/45/478608745.db2.gz KPRBQDBZYPLTKW-IAGOWNOFSA-N 1 3 344.503 2.677 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]C[C@@H]2CCN2C2CCCC2)[C@H](C)C1 ZINC000528014941 478614301 /nfs/dbraw/zinc/61/43/01/478614301.db2.gz VZHODDUKUKMVAO-HOJAQTOUSA-N 1 3 337.552 2.730 10 0 EFAEHO CCc1nncn1CCN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000563870095 478650445 /nfs/dbraw/zinc/65/04/45/478650445.db2.gz SEEHRDOQQGQAJT-REPLKXPHSA-N 1 3 339.487 2.626 10 0 EFAEHO CCc1nncn1CCN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000563870095 478650450 /nfs/dbraw/zinc/65/04/50/478650450.db2.gz SEEHRDOQQGQAJT-REPLKXPHSA-N 1 3 339.487 2.626 10 0 EFAEHO CC[NH+](CC)[C@H]1CCN(C(=O)NC[C@H]2CCN2C2CCCCC2)C1 ZINC000528146442 478657209 /nfs/dbraw/zinc/65/72/09/478657209.db2.gz ADRXITJMERDQEL-MSOLQXFVSA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)N1CCC([N@H+](C)Cc2cc3ccccc3n(C)c2=O)CC1 ZINC000564035651 478682741 /nfs/dbraw/zinc/68/27/41/478682741.db2.gz WZSVVXMRNUFINU-UHFFFAOYSA-N 1 3 327.472 2.843 10 0 EFAEHO CC(C)N1CCC([N@@H+](C)Cc2cc3ccccc3n(C)c2=O)CC1 ZINC000564035651 478682746 /nfs/dbraw/zinc/68/27/46/478682746.db2.gz WZSVVXMRNUFINU-UHFFFAOYSA-N 1 3 327.472 2.843 10 0 EFAEHO CN1CCC[C@@H](CNC(=O)CCCC[NH+](C)C)[C@H]1c1cccs1 ZINC000571848326 478688776 /nfs/dbraw/zinc/68/87/76/478688776.db2.gz QCYFLXIAKKZGKD-YJBOKZPZSA-N 1 3 337.533 2.979 10 0 EFAEHO O=C(NCc1ccc(C[NH+]2CCCC2)cc1)[C@H]1CNCc2ccccc21 ZINC000571996244 478726030 /nfs/dbraw/zinc/72/60/30/478726030.db2.gz QOBHURZPENKJQJ-NRFANRHFSA-N 1 3 349.478 2.786 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@@H](O)CC2(O)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000528399742 478754404 /nfs/dbraw/zinc/75/44/04/478754404.db2.gz XJESIPCIYBMHNQ-RLLQIKCJSA-N 1 3 346.515 2.637 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@@H](O)CC2(O)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000528399742 478754414 /nfs/dbraw/zinc/75/44/14/478754414.db2.gz XJESIPCIYBMHNQ-RLLQIKCJSA-N 1 3 346.515 2.637 10 0 EFAEHO CC[NH+](CC)CCO[C@H]1CCN(C[C@@H](OC)c2ccc(F)cc2)C1 ZINC000528400928 478755834 /nfs/dbraw/zinc/75/58/34/478755834.db2.gz TUXBTTPODWDDLP-RBUKOAKNSA-N 1 3 338.467 2.946 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)C[NH2+]C[C@H](C)CN1CCCC1 ZINC000564650987 478776957 /nfs/dbraw/zinc/77/69/57/478776957.db2.gz FRSLMQMGGWYVQS-ROUUACIJSA-N 1 3 334.504 2.871 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)Nc1ccc2c(c1)CNCC2 ZINC000583251489 478802749 /nfs/dbraw/zinc/80/27/49/478802749.db2.gz IFOQVEKDNOJCEF-HUUCEWRRSA-N 1 3 330.476 2.717 10 0 EFAEHO Cc1ccc(OC[C@H](O)CNCc2ccc(CC[NH+](C)C)cc2)cc1 ZINC000564864002 478838124 /nfs/dbraw/zinc/83/81/24/478838124.db2.gz LBZXFHBCJNHFNB-HXUWFJFHSA-N 1 3 342.483 2.629 10 0 EFAEHO CCN(C)C[C@H](O)C[NH+]1CCC(c2nc3cccc(C)c3o2)CC1 ZINC000572494306 478850916 /nfs/dbraw/zinc/85/09/16/478850916.db2.gz QUGRIZFTXOQFMT-INIZCTEOSA-N 1 3 331.460 2.628 10 0 EFAEHO CCCC[N@H+](CCO)Cc1ccccc1N1CCN(CCC)CC1 ZINC000505912419 478891840 /nfs/dbraw/zinc/89/18/40/478891840.db2.gz LOOORXVICJXVAJ-UHFFFAOYSA-N 1 3 333.520 2.813 10 0 EFAEHO CCCC[N@@H+](CCO)Cc1ccccc1N1CCN(CCC)CC1 ZINC000505912419 478891846 /nfs/dbraw/zinc/89/18/46/478891846.db2.gz LOOORXVICJXVAJ-UHFFFAOYSA-N 1 3 333.520 2.813 10 0 EFAEHO COC(=O)[C@@H](C)[C@H](NCc1cccc2c1CC[NH2+]C2)c1ccccc1 ZINC000595889961 479054737 /nfs/dbraw/zinc/05/47/37/479054737.db2.gz ANANTRLTRSEITN-YWZLYKJASA-N 1 3 338.451 2.972 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)C1 ZINC000565667794 479059317 /nfs/dbraw/zinc/05/93/17/479059317.db2.gz UNUGOYJVUBSZAP-ICSRJNTNSA-N 1 3 343.515 2.747 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000565667794 479059321 /nfs/dbraw/zinc/05/93/21/479059321.db2.gz UNUGOYJVUBSZAP-ICSRJNTNSA-N 1 3 343.515 2.747 10 0 EFAEHO CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)CCC[NH+](C)C ZINC000546716499 479061668 /nfs/dbraw/zinc/06/16/68/479061668.db2.gz UZAGOFBOBDLNQH-IBGZPJMESA-N 1 3 348.535 2.736 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCC2([NH3+])CCCCCC2)[C@H]1c1ccccc1 ZINC000515047581 479110209 /nfs/dbraw/zinc/11/02/09/479110209.db2.gz IGVRPIIBJQTFIV-QZTJIDSGSA-N 1 3 344.503 2.783 10 0 EFAEHO CSC[C@@H](O)C[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000596064698 479117468 /nfs/dbraw/zinc/11/74/68/479117468.db2.gz HSMAMHCKMQYIPH-MSOLQXFVSA-N 1 3 334.529 2.602 10 0 EFAEHO CSC[C@@H](O)CNC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000596064698 479117476 /nfs/dbraw/zinc/11/74/76/479117476.db2.gz HSMAMHCKMQYIPH-MSOLQXFVSA-N 1 3 334.529 2.602 10 0 EFAEHO CSC[C@@H](O)CNC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000596064698 479117485 /nfs/dbraw/zinc/11/74/85/479117485.db2.gz HSMAMHCKMQYIPH-MSOLQXFVSA-N 1 3 334.529 2.602 10 0 EFAEHO CCC[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(=O)N[C@@H](C)CN(C)C ZINC000529389810 479143903 /nfs/dbraw/zinc/14/39/03/479143903.db2.gz ZCVKZMORCPIJGF-QXAKKESOSA-N 1 3 331.504 2.601 10 0 EFAEHO CCC[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)N[C@@H](C)CN(C)C ZINC000529389810 479143909 /nfs/dbraw/zinc/14/39/09/479143909.db2.gz ZCVKZMORCPIJGF-QXAKKESOSA-N 1 3 331.504 2.601 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)C[NH2+][C@@H](C)C1=CCN(C)CC1 ZINC000573835382 479154559 /nfs/dbraw/zinc/15/45/59/479154559.db2.gz ZFKZDVYBJKSLCE-WMZOPIPTSA-N 1 3 332.488 2.790 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)C[NH2+][C@H](C)C1=CCN(C)CC1 ZINC000573835378 479155481 /nfs/dbraw/zinc/15/54/81/479155481.db2.gz ZFKZDVYBJKSLCE-AEFFLSMTSA-N 1 3 332.488 2.790 10 0 EFAEHO CC(C)OCC[C@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000573954960 479182924 /nfs/dbraw/zinc/18/29/24/479182924.db2.gz WETAZSHTDNMGDG-VTHDOGFWSA-N 1 3 346.515 2.948 10 0 EFAEHO CC(C)OCC[C@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000573954960 479182932 /nfs/dbraw/zinc/18/29/32/479182932.db2.gz WETAZSHTDNMGDG-VTHDOGFWSA-N 1 3 346.515 2.948 10 0 EFAEHO COc1cccc([C@@H]2[C@H](N[C@H]3CCC[C@@H]([NH3+])C3)CCN2C2CC2)c1 ZINC000569867897 479197563 /nfs/dbraw/zinc/19/75/63/479197563.db2.gz QMLGKHAOBRBNDD-WOUAJJJCSA-N 1 3 329.488 2.833 10 0 EFAEHO C[NH2+]Cc1ccccc1CNCc1ccc(O[C@H](C)C(=O)OC)cc1 ZINC000593318040 479290876 /nfs/dbraw/zinc/29/08/76/479290876.db2.gz NOHDNEGVWUXJQG-OAHLLOKOSA-N 1 3 342.439 2.636 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)C1 ZINC000557647438 479297876 /nfs/dbraw/zinc/29/78/76/479297876.db2.gz ZKQWZUYAKVNGLI-ZWKOTPCHSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)C1 ZINC000557647438 479297881 /nfs/dbraw/zinc/29/78/81/479297881.db2.gz ZKQWZUYAKVNGLI-ZWKOTPCHSA-N 1 3 335.536 2.831 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN2CC[C@@H](C(=O)OC(C)(C)C)C2)cc1 ZINC000611274320 479333878 /nfs/dbraw/zinc/33/38/78/479333878.db2.gz JOHGSHAYLZDPCK-QGZVFWFLSA-N 1 3 348.487 2.791 10 0 EFAEHO C[C@@H]([NH2+]C(C)(C)CNC(=O)N[C@@H]1CCCN(C)C1)c1ccccc1 ZINC000603593563 479410309 /nfs/dbraw/zinc/41/03/09/479410309.db2.gz MLBUGBAQQULUOJ-NVXWUHKLSA-N 1 3 332.492 2.509 10 0 EFAEHO CCC[N@H+](CC)C[C@@H](C)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000575633548 479460243 /nfs/dbraw/zinc/46/02/43/479460243.db2.gz SDDRJBYOPMVAQD-QRQLOZEOSA-N 1 3 346.519 2.851 10 0 EFAEHO CCC[N@@H+](CC)C[C@@H](C)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000575633548 479460249 /nfs/dbraw/zinc/46/02/49/479460249.db2.gz SDDRJBYOPMVAQD-QRQLOZEOSA-N 1 3 346.519 2.851 10 0 EFAEHO CCOC(=O)c1cccc(CNCCCC[N@@H+]2CCC[C@@H](C)C2)n1 ZINC000600122977 479529392 /nfs/dbraw/zinc/52/93/92/479529392.db2.gz FYWDQCHKDFCWDJ-MRXNPFEDSA-N 1 3 333.476 2.860 10 0 EFAEHO CCOC(=O)c1cccc(CNCCCC[N@H+]2CCC[C@@H](C)C2)n1 ZINC000600122977 479529402 /nfs/dbraw/zinc/52/94/02/479529402.db2.gz FYWDQCHKDFCWDJ-MRXNPFEDSA-N 1 3 333.476 2.860 10 0 EFAEHO CCOC(=O)[C@@](C)(CN[C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1 ZINC000600151829 479546498 /nfs/dbraw/zinc/54/64/98/479546498.db2.gz OUEXJCFTISHMGV-XLIONFOSSA-N 1 3 332.488 2.970 10 0 EFAEHO CCOC(=O)[C@@](C)(CN[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1 ZINC000600151829 479546499 /nfs/dbraw/zinc/54/64/99/479546499.db2.gz OUEXJCFTISHMGV-XLIONFOSSA-N 1 3 332.488 2.970 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000589946345 479584985 /nfs/dbraw/zinc/58/49/85/479584985.db2.gz BHJSGNBNUUYUFB-IBGZPJMESA-N 1 3 335.536 2.975 10 0 EFAEHO CC[NH+](CC)CCOc1ccc(NC(=O)N[C@@H]2CCCN(C)C2)cc1 ZINC000605339839 479634659 /nfs/dbraw/zinc/63/46/59/479634659.db2.gz RRFWLAAWBZUOGV-QGZVFWFLSA-N 1 3 348.491 2.623 10 0 EFAEHO Cc1ccccc1C[C@@H](C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000628051365 479747847 /nfs/dbraw/zinc/74/78/47/479747847.db2.gz CQJLRYVLBHLLMB-MSOLQXFVSA-N 1 3 333.520 2.562 10 0 EFAEHO Cc1ccccc1C[C@@H](C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000628051365 479747851 /nfs/dbraw/zinc/74/78/51/479747851.db2.gz CQJLRYVLBHLLMB-MSOLQXFVSA-N 1 3 333.520 2.562 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC(C)(C)N[C@@H](C)c2ccccc2)CC[N@@H+]1C ZINC000630919471 479779011 /nfs/dbraw/zinc/77/90/11/479779011.db2.gz XURCAORPZRLRMJ-RYQLBKOJSA-N 1 3 331.504 2.962 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC(C)(C)N[C@@H](C)c2ccccc2)CC[N@H+]1C ZINC000630919471 479779018 /nfs/dbraw/zinc/77/90/18/479779018.db2.gz XURCAORPZRLRMJ-RYQLBKOJSA-N 1 3 331.504 2.962 10 0 EFAEHO COc1ccc(CN2CCC(OCC[NH+](C)C)CC2)cc1OC1CC1 ZINC000628170247 479797416 /nfs/dbraw/zinc/79/74/16/479797416.db2.gz UXKAZOAUUDDEST-UHFFFAOYSA-N 1 3 348.487 2.779 10 0 EFAEHO CC[C@H]1CCCC[C@H]1C[NH2+]CC1(N2CCOCC2)CCN(C)CC1 ZINC000628309953 479851738 /nfs/dbraw/zinc/85/17/38/479851738.db2.gz DKMRVJVZYFDFFI-OALUTQOASA-N 1 3 337.552 2.589 10 0 EFAEHO CN1CCC(C[NH2+][C@@H]2CCCc3ncccc32)(N2CCCCC2)CC1 ZINC000631587371 480169267 /nfs/dbraw/zinc/16/92/67/480169267.db2.gz IQBATSVBOUNDTC-HXUWFJFHSA-N 1 3 342.531 2.999 10 0 EFAEHO CN1CCC(C[NH2+][C@H]2CCCc3ncccc32)(N2CCCCC2)CC1 ZINC000631587370 480169860 /nfs/dbraw/zinc/16/98/60/480169860.db2.gz IQBATSVBOUNDTC-FQEVSTJZSA-N 1 3 342.531 2.999 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)CC[N@@H+]1C ZINC000631627987 480190048 /nfs/dbraw/zinc/19/00/48/480190048.db2.gz FDVMZBHEQVQWPE-BTHPGYMESA-N 1 3 343.515 2.744 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)CC[N@H+]1C ZINC000631627987 480190051 /nfs/dbraw/zinc/19/00/51/480190051.db2.gz FDVMZBHEQVQWPE-BTHPGYMESA-N 1 3 343.515 2.744 10 0 EFAEHO O[C@@H]1CC[N@H+](Cc2ccc(CN[C@@H]3CCCc4ncccc43)cc2)C1 ZINC000631647176 480197820 /nfs/dbraw/zinc/19/78/20/480197820.db2.gz QBSCCHLVIOUBLX-WIYYLYMNSA-N 1 3 337.467 2.815 10 0 EFAEHO O[C@@H]1CC[N@@H+](Cc2ccc(CN[C@@H]3CCCc4ncccc43)cc2)C1 ZINC000631647176 480197825 /nfs/dbraw/zinc/19/78/25/480197825.db2.gz QBSCCHLVIOUBLX-WIYYLYMNSA-N 1 3 337.467 2.815 10 0 EFAEHO C[C@H](Cc1ccc(Br)cc1F)NCC1([NH3+])CCOCC1 ZINC000629389502 480244821 /nfs/dbraw/zinc/24/48/21/480244821.db2.gz YXMPOZFDHDLKHS-LLVKDONJSA-N 1 3 345.256 2.617 10 0 EFAEHO O[C@H](CC[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21)C(F)F ZINC000631704828 480228804 /nfs/dbraw/zinc/22/88/04/480228804.db2.gz XVSWYLFDCOKMIR-WNRNVDISSA-N 1 3 338.442 2.893 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1coc2ccc(F)cc12 ZINC000617502713 480245278 /nfs/dbraw/zinc/24/52/78/480245278.db2.gz ZNKUGCLKKXEECO-ZDUSSCGKSA-N 1 3 335.423 2.574 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1coc2ccc(F)cc12 ZINC000617502713 480245283 /nfs/dbraw/zinc/24/52/83/480245283.db2.gz ZNKUGCLKKXEECO-ZDUSSCGKSA-N 1 3 335.423 2.574 10 0 EFAEHO Cc1cc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c2ccccc2n1 ZINC000617503580 480247763 /nfs/dbraw/zinc/24/77/63/480247763.db2.gz PHJQAPCXNOHOPK-INIZCTEOSA-N 1 3 342.487 2.545 10 0 EFAEHO Cc1cc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c2ccccc2n1 ZINC000617503580 480247770 /nfs/dbraw/zinc/24/77/70/480247770.db2.gz PHJQAPCXNOHOPK-INIZCTEOSA-N 1 3 342.487 2.545 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccnc(OCC(F)(F)F)c2)CC1(C)C ZINC000623357203 480248009 /nfs/dbraw/zinc/24/80/09/480248009.db2.gz CQFBSXXOSCYZES-ZDUSSCGKSA-N 1 3 331.382 2.985 10 0 EFAEHO C[C@@H](CN[C@H]1CC[N@H+](C)C(C)(C)C1)N1CCN(c2ccccc2)CC1 ZINC000623357586 480248459 /nfs/dbraw/zinc/24/84/59/480248459.db2.gz WWDZYFCGYKLGND-OALUTQOASA-N 1 3 344.547 2.660 10 0 EFAEHO C[C@@H](CN[C@H]1CC[N@@H+](C)C(C)(C)C1)N1CCN(c2ccccc2)CC1 ZINC000623357586 480248465 /nfs/dbraw/zinc/24/84/65/480248465.db2.gz WWDZYFCGYKLGND-OALUTQOASA-N 1 3 344.547 2.660 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)CC(C)(C)c1ccccc1 ZINC000617505053 480248590 /nfs/dbraw/zinc/24/85/90/480248590.db2.gz VJKZMJQWNKQZHU-KRWDZBQOSA-N 1 3 333.520 2.743 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)CC(C)(C)c1ccccc1 ZINC000617505053 480248596 /nfs/dbraw/zinc/24/85/96/480248596.db2.gz VJKZMJQWNKQZHU-KRWDZBQOSA-N 1 3 333.520 2.743 10 0 EFAEHO Cc1ccc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1Cl ZINC000617505481 480248623 /nfs/dbraw/zinc/24/86/23/480248623.db2.gz DXZAGFRSNHQHIB-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO Cc1ccc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1Cl ZINC000617505481 480248628 /nfs/dbraw/zinc/24/86/28/480248628.db2.gz DXZAGFRSNHQHIB-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO C[C@@H]1CN(c2ccc(C[NH2+][C@H]3CCN(C)C(C)(C)C3)cn2)C[C@H](C)O1 ZINC000623358128 480248635 /nfs/dbraw/zinc/24/86/35/480248635.db2.gz PASWMDSQTOKUHM-JZXOWHBKSA-N 1 3 346.519 2.658 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cc2c(s1)CCCC2 ZINC000617504216 480248790 /nfs/dbraw/zinc/24/87/90/480248790.db2.gz LFJXDLMQCLSGNO-AWEZNQCLSA-N 1 3 337.533 2.629 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cc2c(s1)CCCC2 ZINC000617504216 480248798 /nfs/dbraw/zinc/24/87/98/480248798.db2.gz LFJXDLMQCLSGNO-AWEZNQCLSA-N 1 3 337.533 2.629 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C1CC(c2ccc(F)cc2)C1 ZINC000617508148 480250163 /nfs/dbraw/zinc/25/01/63/480250163.db2.gz UPRDXJXCXCCRRN-ZLPCBKJTSA-N 1 3 349.494 2.708 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C1CC(c2ccc(F)cc2)C1 ZINC000617508148 480250169 /nfs/dbraw/zinc/25/01/69/480250169.db2.gz UPRDXJXCXCCRRN-ZLPCBKJTSA-N 1 3 349.494 2.708 10 0 EFAEHO Cc1cc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)ccc1Cl ZINC000617506520 480250710 /nfs/dbraw/zinc/25/07/10/480250710.db2.gz QMRMMUMNMSEHID-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO Cc1cc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)ccc1Cl ZINC000617506520 480250713 /nfs/dbraw/zinc/25/07/13/480250713.db2.gz QMRMMUMNMSEHID-AWEZNQCLSA-N 1 3 325.884 2.650 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C1(Cc2ccccc2F)CC1 ZINC000617507466 480251292 /nfs/dbraw/zinc/25/12/92/480251292.db2.gz XQNXGOJVRDDJPB-INIZCTEOSA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C1(Cc2ccccc2F)CC1 ZINC000617507466 480251298 /nfs/dbraw/zinc/25/12/98/480251298.db2.gz XQNXGOJVRDDJPB-INIZCTEOSA-N 1 3 349.494 2.537 10 0 EFAEHO CN1CC[C@@H]([NH2+]Cc2cccc(NC(=O)[C@@H]3CCCO3)c2)CC1(C)C ZINC000623376017 480255173 /nfs/dbraw/zinc/25/51/73/480255173.db2.gz CBHACJWONVHIKF-MSOLQXFVSA-N 1 3 345.487 2.767 10 0 EFAEHO C[C@H]1CN(Cc2cccc(CN[C@@H]3CC[N@H+](C)C(C)(C)C3)c2)CCO1 ZINC000623375961 480256012 /nfs/dbraw/zinc/25/60/12/480256012.db2.gz AOCJBOJSBZAMOE-FXAWDEMLSA-N 1 3 345.531 2.870 10 0 EFAEHO C[C@H]1CN(Cc2cccc(CN[C@@H]3CC[N@@H+](C)C(C)(C)C3)c2)CCO1 ZINC000623375961 480256017 /nfs/dbraw/zinc/25/60/17/480256017.db2.gz AOCJBOJSBZAMOE-FXAWDEMLSA-N 1 3 345.531 2.870 10 0 EFAEHO C[C@H]1CN(Cc2cccc(C[NH2+][C@@H]3CCN(C)C(C)(C)C3)c2)CCO1 ZINC000623375961 480256023 /nfs/dbraw/zinc/25/60/23/480256023.db2.gz AOCJBOJSBZAMOE-FXAWDEMLSA-N 1 3 345.531 2.870 10 0 EFAEHO C[C@H](N[C@@H]1CC[N@H+](C)C(C)(C)C1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000623429231 480280253 /nfs/dbraw/zinc/28/02/53/480280253.db2.gz UBQXPIWFIOQQRL-SXLOBPIMSA-N 1 3 345.531 2.738 10 0 EFAEHO C[C@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000623429231 480280257 /nfs/dbraw/zinc/28/02/57/480280257.db2.gz UBQXPIWFIOQQRL-SXLOBPIMSA-N 1 3 345.531 2.738 10 0 EFAEHO C[C@@H]1C[C@H](NCCOCCC[NH3+])c2cccc(Br)c21 ZINC000629538662 480298690 /nfs/dbraw/zinc/29/86/90/480298690.db2.gz MTMFJPFSEJRZBI-RISCZKNCSA-N 1 3 327.266 2.952 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)CC1(C)C ZINC000623445598 480287976 /nfs/dbraw/zinc/28/79/76/480287976.db2.gz XWPUZYFTGRHOFG-RBUKOAKNSA-N 1 3 343.515 2.683 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)CC1(C)C ZINC000623445598 480287983 /nfs/dbraw/zinc/28/79/83/480287983.db2.gz XWPUZYFTGRHOFG-RBUKOAKNSA-N 1 3 343.515 2.683 10 0 EFAEHO NC1(C[NH2+][C@@H]2CCc3ccc(Br)cc32)CCOCC1 ZINC000629520991 480292696 /nfs/dbraw/zinc/29/26/96/480292696.db2.gz NQMSJCJKBUWYDG-CQSZACIVSA-N 1 3 325.250 2.534 10 0 EFAEHO [NH3+]C[C@@H]1CCCC[C@@H]1NC[C@H]1CN(c2ccc(Cl)cc2)CCO1 ZINC000629523680 480295276 /nfs/dbraw/zinc/29/52/76/480295276.db2.gz NKLYUWCINYIVLV-WBAXXEDZSA-N 1 3 337.895 2.652 10 0 EFAEHO NC[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1CN(c2ccc(Cl)cc2)CCO1 ZINC000629523680 480295283 /nfs/dbraw/zinc/29/52/83/480295283.db2.gz NKLYUWCINYIVLV-WBAXXEDZSA-N 1 3 337.895 2.652 10 0 EFAEHO C[NH2+]CCOCCN[C@@H]1CCc2c1cc(Br)cc2Cl ZINC000629529781 480296027 /nfs/dbraw/zinc/29/60/27/480296027.db2.gz MTZGHWMGPHPWQL-CQSZACIVSA-N 1 3 347.684 2.915 10 0 EFAEHO C[NH2+]CCOCCN[C@@H](C)c1sc(Cc2ccccc2)nc1C ZINC000629529139 480296413 /nfs/dbraw/zinc/29/64/13/480296413.db2.gz SKZOWECTDRZQTA-AWEZNQCLSA-N 1 3 333.501 2.929 10 0 EFAEHO C[NH2+]CCOCCN[C@@H]1C[C@H](C)c2c1cccc2Br ZINC000629528733 480296747 /nfs/dbraw/zinc/29/67/47/480296747.db2.gz HWWBJQLBBNEDLU-SMDDNHRTSA-N 1 3 327.266 2.823 10 0 EFAEHO [NH3+]CCCOCCN[C@H]1CCCc2ccc(Br)cc21 ZINC000629541183 480297840 /nfs/dbraw/zinc/29/78/40/480297840.db2.gz YAXRGLAFDLCRLX-HNNXBMFYSA-N 1 3 327.266 2.782 10 0 EFAEHO [NH3+]CCCOCCN[C@H]1CCSc2ccc(Br)cc21 ZINC000629534765 480297917 /nfs/dbraw/zinc/29/79/17/480297917.db2.gz BKHWSGWFJGVEPV-ZDUSSCGKSA-N 1 3 345.306 2.941 10 0 EFAEHO [NH3+]CCCOCCN[C@@H]1CCCc2ccc(Br)cc21 ZINC000629541184 480298207 /nfs/dbraw/zinc/29/82/07/480298207.db2.gz YAXRGLAFDLCRLX-OAHLLOKOSA-N 1 3 327.266 2.782 10 0 EFAEHO C[C@H](N)[C@@H]1COCC[C@H]1[NH2+]CCc1c[nH]c2cc(F)c(Cl)cc12 ZINC000629544855 480299971 /nfs/dbraw/zinc/29/99/71/480299971.db2.gz JUZOZNRZVRQOGP-YNZJMPHRSA-N 1 3 339.842 2.845 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@H](CO)Cc2ccc(F)c(F)c2)CC1(C)C ZINC000623506154 480316988 /nfs/dbraw/zinc/31/69/88/480316988.db2.gz FBCYQGKTDZTVJV-CABCVRRESA-N 1 3 326.431 2.578 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@H](CO)Cc2ccc(F)c(F)c2)CC1(C)C ZINC000623506154 480316997 /nfs/dbraw/zinc/31/69/97/480316997.db2.gz FBCYQGKTDZTVJV-CABCVRRESA-N 1 3 326.431 2.578 10 0 EFAEHO C[N@@H+]1CC[C@@H](NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)CC1(C)C ZINC000623508170 480318242 /nfs/dbraw/zinc/31/82/42/480318242.db2.gz LGUFFFFQQMNYJK-ZIAGYGMSSA-N 1 3 344.421 2.717 10 0 EFAEHO C[N@H+]1CC[C@@H](NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)CC1(C)C ZINC000623508170 480318249 /nfs/dbraw/zinc/31/82/49/480318249.db2.gz LGUFFFFQQMNYJK-ZIAGYGMSSA-N 1 3 344.421 2.717 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@@H]2CN(Cc3ccccc3)CCCO2)CC1(C)C ZINC000623507256 480318549 /nfs/dbraw/zinc/31/85/49/480318549.db2.gz AQQAWNYDMSFDEJ-VQTJNVASSA-N 1 3 345.531 2.740 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)CC1(C)C ZINC000623515831 480322801 /nfs/dbraw/zinc/32/28/01/480322801.db2.gz RUQSRXMJGLOGPI-OALUTQOASA-N 1 3 343.515 2.683 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)CC1(C)C ZINC000623515831 480322806 /nfs/dbraw/zinc/32/28/06/480322806.db2.gz RUQSRXMJGLOGPI-OALUTQOASA-N 1 3 343.515 2.683 10 0 EFAEHO C[N@@H+]1CC[C@@H](N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)CC1(C)C ZINC000623515833 480322834 /nfs/dbraw/zinc/32/28/34/480322834.db2.gz RUQSRXMJGLOGPI-RTBURBONSA-N 1 3 343.515 2.683 10 0 EFAEHO C[N@H+]1CC[C@@H](N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)CC1(C)C ZINC000623515833 480322838 /nfs/dbraw/zinc/32/28/38/480322838.db2.gz RUQSRXMJGLOGPI-RTBURBONSA-N 1 3 343.515 2.683 10 0 EFAEHO CNC(=O)[C@H](CN[C@@H]1CC[N@H+](C)C(C)(C)C1)Cc1ccc(F)cc1C ZINC000623556644 480339149 /nfs/dbraw/zinc/33/91/49/480339149.db2.gz QZCNMJJVZQUXLF-FUHWJXTLSA-N 1 3 349.494 2.501 10 0 EFAEHO CNC(=O)[C@H](CN[C@@H]1CC[N@@H+](C)C(C)(C)C1)Cc1ccc(F)cc1C ZINC000623556644 480339154 /nfs/dbraw/zinc/33/91/54/480339154.db2.gz QZCNMJJVZQUXLF-FUHWJXTLSA-N 1 3 349.494 2.501 10 0 EFAEHO C[N@H+](CCNC(=O)NC[C@H]1CCN1C1CCCCC1)C1CCCC1 ZINC000623576719 480347139 /nfs/dbraw/zinc/34/71/39/480347139.db2.gz JLBKZLNBJBNCBD-GOSISDBHSA-N 1 3 336.524 2.567 10 0 EFAEHO C[N@@H+](CCNC(=O)NC[C@H]1CCN1C1CCCCC1)C1CCCC1 ZINC000623576719 480347142 /nfs/dbraw/zinc/34/71/42/480347142.db2.gz JLBKZLNBJBNCBD-GOSISDBHSA-N 1 3 336.524 2.567 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@@H]3CCCC34CC4)CC2)CC1 ZINC000629829154 480411405 /nfs/dbraw/zinc/41/14/05/480411405.db2.gz DDMCYBVULIBSAQ-SFHVURJKSA-N 1 3 347.547 2.879 10 0 EFAEHO CC(C)OC[C@@H](O)CNCc1cccc(C[NH+]2CCCCCC2)c1 ZINC000644532399 480421864 /nfs/dbraw/zinc/42/18/64/480421864.db2.gz FNPSPCIKHQPLDX-FQEVSTJZSA-N 1 3 334.504 2.938 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CCN1CCN(CC2CCSCC2)CC1 ZINC000637984104 480437768 /nfs/dbraw/zinc/43/77/68/480437768.db2.gz BKYSWILMGBXMPA-IRXDYDNUSA-N 1 3 325.566 2.620 10 0 EFAEHO O[C@]1(CNCC2(C(F)(F)F)CC2)CC[N@H+](Cc2ccccc2)C1 ZINC000634713869 480456932 /nfs/dbraw/zinc/45/69/32/480456932.db2.gz BWWQOLGBPPIOCQ-INIZCTEOSA-N 1 3 328.378 2.556 10 0 EFAEHO O[C@]1(CNCC2(C(F)(F)F)CC2)CC[N@@H+](Cc2ccccc2)C1 ZINC000634713869 480456940 /nfs/dbraw/zinc/45/69/40/480456940.db2.gz BWWQOLGBPPIOCQ-INIZCTEOSA-N 1 3 328.378 2.556 10 0 EFAEHO CC(C)OC[C@H](O)C[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000644619405 480477197 /nfs/dbraw/zinc/47/71/97/480477197.db2.gz GVHAQAGZKPNTGJ-DOIPELPJSA-N 1 3 346.515 2.663 10 0 EFAEHO CC(C)OC[C@H](O)CN[C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000644619405 480477204 /nfs/dbraw/zinc/47/72/04/480477204.db2.gz GVHAQAGZKPNTGJ-DOIPELPJSA-N 1 3 346.515 2.663 10 0 EFAEHO CC(C)OC[C@H](O)CN[C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000644619405 480477206 /nfs/dbraw/zinc/47/72/06/480477206.db2.gz GVHAQAGZKPNTGJ-DOIPELPJSA-N 1 3 346.515 2.663 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)N1C[C@@]2(C)C[NH2+]C[C@@]2(C)C1 ZINC000634744809 480485632 /nfs/dbraw/zinc/48/56/32/480485632.db2.gz LLLJNJSZRHRYLS-BGYRXZFFSA-N 1 3 341.455 2.566 10 0 EFAEHO CCN1CCN(Cc2ccccc2C[NH2+][C@@H](C)[C@@H]2CCCCO2)CC1 ZINC000623865805 480492951 /nfs/dbraw/zinc/49/29/51/480492951.db2.gz BKFNLOPCPWNGQF-RXVVDRJESA-N 1 3 345.531 2.871 10 0 EFAEHO C[C@@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)[C@@H]1CCCCO1 ZINC000624000612 480559902 /nfs/dbraw/zinc/55/99/02/480559902.db2.gz HIPCJNLLIFIIHN-MJGOQNOKSA-N 1 3 332.488 2.561 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@H]1CC[NH2+]C12CCC2)c1ccccc1 ZINC000626921839 480581766 /nfs/dbraw/zinc/58/17/66/480581766.db2.gz KHGQNZLNKYRIMJ-MSOLQXFVSA-N 1 3 344.503 2.653 10 0 EFAEHO C[C@@H]1CC[C@@H](NC(=O)NCc2ccccc2CN2CCCCC2)C[NH2+]1 ZINC000626926790 480584910 /nfs/dbraw/zinc/58/49/10/480584910.db2.gz DRZDWYCNBGBTFM-VQIMIIECSA-N 1 3 344.503 2.612 10 0 EFAEHO CC[C@@H]1[NH2+]CC[C@H]1NC(=O)NCC(C)(C)N[C@H](C)c1ccccc1 ZINC000626978863 480607809 /nfs/dbraw/zinc/60/78/09/480607809.db2.gz XXNJXSPJUFMCAV-HYVNUMGLSA-N 1 3 332.492 2.556 10 0 EFAEHO C[C@@H](c1ccccc1)N1CCC(NC(=O)N[C@@H]2CC[C@@H](C)[NH2+]C2)CC1 ZINC000626980658 480609109 /nfs/dbraw/zinc/60/91/09/480609109.db2.gz VDWYGNRUEQZEEJ-JTDSTZFVSA-N 1 3 344.503 2.652 10 0 EFAEHO O=C(NCCCCC[NH+]1CCCC1)NC[C@H]1CCN1C1CCCC1 ZINC000624125608 480621817 /nfs/dbraw/zinc/62/18/17/480621817.db2.gz IFDIOFBXOAWWAH-GOSISDBHSA-N 1 3 336.524 2.569 10 0 EFAEHO C[N@H+](CCCCNC(=O)NC[C@H]1CCN1C1CCCCC1)C1CC1 ZINC000624185445 480650205 /nfs/dbraw/zinc/65/02/05/480650205.db2.gz UETRLHROJDGPMN-GOSISDBHSA-N 1 3 336.524 2.567 10 0 EFAEHO C[N@@H+](CCCCNC(=O)NC[C@H]1CCN1C1CCCCC1)C1CC1 ZINC000624185445 480650211 /nfs/dbraw/zinc/65/02/11/480650211.db2.gz UETRLHROJDGPMN-GOSISDBHSA-N 1 3 336.524 2.567 10 0 EFAEHO CCN(C(=O)N[C@@H]1CC[NH2+][C@H]1C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000627240873 480708802 /nfs/dbraw/zinc/70/88/02/480708802.db2.gz BSASKYANNMKUMA-OGWHTMIXSA-N 1 3 344.503 2.604 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCC1)N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000624374752 480734925 /nfs/dbraw/zinc/73/49/25/480734925.db2.gz ZGTFTLUKMQZGDE-QFBILLFUSA-N 1 3 348.535 2.710 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCC1)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000624374752 480734933 /nfs/dbraw/zinc/73/49/33/480734933.db2.gz ZGTFTLUKMQZGDE-QFBILLFUSA-N 1 3 348.535 2.710 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](c2cccs2)N2CCCC2)CC[N@@H+]1C ZINC000630578894 480790446 /nfs/dbraw/zinc/79/04/46/480790446.db2.gz MCKZYXOVQKKNDD-ARFHVFGLSA-N 1 3 335.517 2.732 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](c2cccs2)N2CCCC2)CC[N@H+]1C ZINC000630578894 480790452 /nfs/dbraw/zinc/79/04/52/480790452.db2.gz MCKZYXOVQKKNDD-ARFHVFGLSA-N 1 3 335.517 2.732 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](c2cccs2)N2CCCC2)CC[N@@H+]1C ZINC000630578898 480790672 /nfs/dbraw/zinc/79/06/72/480790672.db2.gz MCKZYXOVQKKNDD-XHSDSOJGSA-N 1 3 335.517 2.732 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](c2cccs2)N2CCCC2)CC[N@H+]1C ZINC000630578898 480790676 /nfs/dbraw/zinc/79/06/76/480790676.db2.gz MCKZYXOVQKKNDD-XHSDSOJGSA-N 1 3 335.517 2.732 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)Nc2ccc3c(c2F)CCNC3)CC1 ZINC000632951766 480819254 /nfs/dbraw/zinc/81/92/54/480819254.db2.gz QQHQCVLMJIQNPK-UHFFFAOYSA-N 1 3 348.466 2.810 10 0 EFAEHO CCCN(C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)[C@H]1CC[N@H+](C)C1 ZINC000645395438 480824460 /nfs/dbraw/zinc/82/44/60/480824460.db2.gz STWGFQUYGDDVEM-IPMKNSEASA-N 1 3 344.503 2.558 10 0 EFAEHO CCCN(C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)[C@H]1CC[N@@H+](C)C1 ZINC000645395438 480824464 /nfs/dbraw/zinc/82/44/64/480824464.db2.gz STWGFQUYGDDVEM-IPMKNSEASA-N 1 3 344.503 2.558 10 0 EFAEHO O=C(C[C@@H]1CCC[NH2+]C1)N[C@@H]1CCCCCN(Cc2ccccc2)C1 ZINC000638851550 480896068 /nfs/dbraw/zinc/89/60/68/480896068.db2.gz OHKUULJQPFLJEJ-VQTJNVASSA-N 1 3 343.515 2.937 10 0 EFAEHO C[N@H+](CCN1CCN(CCC[C@H]2CCOC2)CC1)Cc1ccccc1 ZINC000645801367 480934252 /nfs/dbraw/zinc/93/42/52/480934252.db2.gz ZPROXJANASZVGU-NRFANRHFSA-N 1 3 345.531 2.553 10 0 EFAEHO C[N@@H+](CCN1CCN(CCC[C@H]2CCOC2)CC1)Cc1ccccc1 ZINC000645801367 480934256 /nfs/dbraw/zinc/93/42/56/480934256.db2.gz ZPROXJANASZVGU-NRFANRHFSA-N 1 3 345.531 2.553 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2CC[C@@H]([NH3+])[C@H](CC)C2)CC1 ZINC000647497390 480967101 /nfs/dbraw/zinc/96/71/01/480967101.db2.gz FMRGAPFQAVDETH-UYAOXDASSA-N 1 3 344.547 2.778 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)NC[C@H]2CCN2C(C)(C)C)c1 ZINC000661397106 480984868 /nfs/dbraw/zinc/98/48/68/480984868.db2.gz BVGXUKFMMOZPMP-GOSISDBHSA-N 1 3 346.519 2.810 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@H]2CCN2C(C)(C)C)c1 ZINC000661397106 480984875 /nfs/dbraw/zinc/98/48/75/480984875.db2.gz BVGXUKFMMOZPMP-GOSISDBHSA-N 1 3 346.519 2.810 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000661404397 480993908 /nfs/dbraw/zinc/99/39/08/480993908.db2.gz YBJDMPOTQDCZJP-DLBZAZTESA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000661404397 480993914 /nfs/dbraw/zinc/99/39/14/480993914.db2.gz YBJDMPOTQDCZJP-DLBZAZTESA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CC[N@@H+](C3CCCCC3)C2)CCN1C ZINC000666664354 481020385 /nfs/dbraw/zinc/02/03/85/481020385.db2.gz CEULYJHAVHPVGL-JFIYKMOQSA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)CCN1C ZINC000666664354 481020390 /nfs/dbraw/zinc/02/03/90/481020390.db2.gz CEULYJHAVHPVGL-JFIYKMOQSA-N 1 3 336.524 2.518 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[NH2+][C@H](C)c1ccccc1)[C@@H]1CCN(C)C1 ZINC000664109577 481026902 /nfs/dbraw/zinc/02/69/02/481026902.db2.gz QMWWBTCKFPRORC-SJLPKXTDSA-N 1 3 346.519 2.851 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[NH2+][C@@H](C)c1ccccc1)[C@H]1CCN(C)C1 ZINC000664109578 481027117 /nfs/dbraw/zinc/02/71/17/481027117.db2.gz QMWWBTCKFPRORC-WMZOPIPTSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NCc1coc2ccccc12 ZINC000664123782 481037372 /nfs/dbraw/zinc/03/73/72/481037372.db2.gz HYEIGAZOYZYRRB-HNNXBMFYSA-N 1 3 346.475 2.504 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NCc1coc2ccccc12 ZINC000664123782 481037380 /nfs/dbraw/zinc/03/73/80/481037380.db2.gz HYEIGAZOYZYRRB-HNNXBMFYSA-N 1 3 346.475 2.504 10 0 EFAEHO CC[NH+]1CCC(NC(=O)CN2CC[C@H]([C@@H]3CCCC3(C)C)C2)CC1 ZINC000646049588 481041248 /nfs/dbraw/zinc/04/12/48/481041248.db2.gz OBQRAVQIWGXBQE-WMZOPIPTSA-N 1 3 335.536 2.735 10 0 EFAEHO C[NH+]1CCC2(CCN(C(=O)[C@H]3CCCCN3C3CCCC3)C2)CC1 ZINC000647725385 481076106 /nfs/dbraw/zinc/07/61/06/481076106.db2.gz ZOQXCMNNYAYACY-GOSISDBHSA-N 1 3 333.520 2.728 10 0 EFAEHO O=C([C@H]1CC[C@H](C2CC2)[NH2+]1)N1CCCN(CC2CCCCC2)CC1 ZINC000653112049 481086796 /nfs/dbraw/zinc/08/67/96/481086796.db2.gz KDVBLLXJMTYHTL-RTBURBONSA-N 1 3 333.520 2.632 10 0 EFAEHO C[C@H](NC(C)(C)CNC(=O)[C@@H]1CC[C@@H](C2CC2)[NH2+]1)c1ccccc1 ZINC000653117178 481090431 /nfs/dbraw/zinc/09/04/31/481090431.db2.gz CDUMKYKZBGUYQD-WBAXXEDZSA-N 1 3 329.488 2.763 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N[C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000664227706 481109842 /nfs/dbraw/zinc/10/98/42/481109842.db2.gz DMHVOBMGOSDIEY-BSDSXHPESA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N[C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000664227706 481109852 /nfs/dbraw/zinc/10/98/52/481109852.db2.gz DMHVOBMGOSDIEY-BSDSXHPESA-N 1 3 338.540 2.526 10 0 EFAEHO CCN(Cc1ccc(CN(C)C)cc1)C(=O)[C@H]1CC[C@@H](C2CC2)[NH2+]1 ZINC000653148940 481111230 /nfs/dbraw/zinc/11/12/30/481111230.db2.gz QNPNSAHBJHQVET-RBUKOAKNSA-N 1 3 329.488 2.627 10 0 EFAEHO [NH3+]CCc1ccccc1C(=O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1 ZINC000653166051 481120968 /nfs/dbraw/zinc/12/09/68/481120968.db2.gz SONVMKHMRARQMZ-PZJWPPBQSA-N 1 3 349.478 2.534 10 0 EFAEHO COc1cc2c(cc1F)nccc2NCCN(C)CCC[NH+](C)C ZINC000664248285 481130005 /nfs/dbraw/zinc/13/00/05/481130005.db2.gz RZJFCRHJKURUPA-UHFFFAOYSA-N 1 3 334.439 2.678 10 0 EFAEHO COc1cc2c(cc1F)nccc2NCC[N@H+](C)CCCN(C)C ZINC000664248285 481130007 /nfs/dbraw/zinc/13/00/07/481130007.db2.gz RZJFCRHJKURUPA-UHFFFAOYSA-N 1 3 334.439 2.678 10 0 EFAEHO COc1cc2c(cc1F)nccc2NCC[N@@H+](C)CCCN(C)C ZINC000664248285 481130013 /nfs/dbraw/zinc/13/00/13/481130013.db2.gz RZJFCRHJKURUPA-UHFFFAOYSA-N 1 3 334.439 2.678 10 0 EFAEHO COc1cc(CCC2CCN(C[C@@H]3CC[NH2+]C3)CC2)cc(OC)c1 ZINC000647874156 481150432 /nfs/dbraw/zinc/15/04/32/481150432.db2.gz AGMTWJLBLJCHNT-GOSISDBHSA-N 1 3 332.488 2.958 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)N[C@H]2C[NH2+]CC[C@H]2C)CC1 ZINC000669486870 481154851 /nfs/dbraw/zinc/15/48/51/481154851.db2.gz IBOZVSOFDCDFSE-MDZRGWNJSA-N 1 3 344.503 2.509 10 0 EFAEHO CC(C)c1cnc(NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)s1 ZINC000666885941 481167732 /nfs/dbraw/zinc/16/77/32/481167732.db2.gz IHKPMVQNTXPYBJ-ZDUSSCGKSA-N 1 3 341.525 2.660 10 0 EFAEHO CC(C)c1cnc(NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)s1 ZINC000666885941 481167742 /nfs/dbraw/zinc/16/77/42/481167742.db2.gz IHKPMVQNTXPYBJ-ZDUSSCGKSA-N 1 3 341.525 2.660 10 0 EFAEHO Fc1cc(CN[C@@H]2CC23CC[NH2+]CC3)ccc1OCC(F)(F)F ZINC000666953512 481216544 /nfs/dbraw/zinc/21/65/44/481216544.db2.gz AFLAUXIIMIWFOA-CQSZACIVSA-N 1 3 332.341 2.999 10 0 EFAEHO CCCN(C)[C@@H](CNC(=O)NC/C=C/C[NH3+])c1ccc(Cl)cc1 ZINC000669583648 481224831 /nfs/dbraw/zinc/22/48/31/481224831.db2.gz PWMMQCWDPFKESQ-APHBUQMISA-N 1 3 338.883 2.537 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@H](C)CC(=O)Nc1cccc(OC)c1 ZINC000650719358 481286769 /nfs/dbraw/zinc/28/67/69/481286769.db2.gz NHRQXENIGHELRL-OAHLLOKOSA-N 1 3 341.455 2.922 10 0 EFAEHO COc1cccc(CN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)c1OC ZINC000650722552 481289241 /nfs/dbraw/zinc/28/92/41/481289241.db2.gz WIWMQBVCORZBFP-LZLYRXPVSA-N 1 3 334.460 2.565 10 0 EFAEHO COc1ccc(CN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)c(OC)c1 ZINC000650721957 481289651 /nfs/dbraw/zinc/28/96/51/481289651.db2.gz HEZBABRFFDUJSF-WDYCEAGBSA-N 1 3 334.460 2.565 10 0 EFAEHO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCCN2Cc2cccc3c2OCCCO3)C1 ZINC000650722226 481289836 /nfs/dbraw/zinc/28/98/36/481289836.db2.gz NJUPAWIOCCBPME-ZIFCJYIRSA-N 1 3 346.471 2.709 10 0 EFAEHO COc1ccc(OC)c(CN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)c1 ZINC000650722113 481290124 /nfs/dbraw/zinc/29/01/24/481290124.db2.gz LAZIKDJGFMJHDO-WDYCEAGBSA-N 1 3 334.460 2.565 10 0 EFAEHO COc1ccc(CN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)cc1OC ZINC000650722450 481290505 /nfs/dbraw/zinc/29/05/05/481290505.db2.gz UERKHUKJCJQMFP-JZXOWHBKSA-N 1 3 334.460 2.565 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](N[C@H]2CNc3ccccc3C2)[C@H](C)C1 ZINC000650750194 481312243 /nfs/dbraw/zinc/31/22/43/481312243.db2.gz AOMQWWRMJYMTCQ-QRQLOZEOSA-N 1 3 331.504 2.750 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](N[C@H]2CNc3ccccc3C2)[C@H](C)C1 ZINC000650750194 481312248 /nfs/dbraw/zinc/31/22/48/481312248.db2.gz AOMQWWRMJYMTCQ-QRQLOZEOSA-N 1 3 331.504 2.750 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](N[C@@H]2CNc3ccccc3C2)[C@@H](C)C1 ZINC000650750196 481312911 /nfs/dbraw/zinc/31/29/11/481312911.db2.gz AOMQWWRMJYMTCQ-WDSOQIARSA-N 1 3 331.504 2.750 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](N[C@@H]2CNc3ccccc3C2)[C@@H](C)C1 ZINC000650750196 481312923 /nfs/dbraw/zinc/31/29/23/481312923.db2.gz AOMQWWRMJYMTCQ-WDSOQIARSA-N 1 3 331.504 2.750 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000664539156 481317070 /nfs/dbraw/zinc/31/70/70/481317070.db2.gz CXBHWWUYYUCQOU-QZTJIDSGSA-N 1 3 346.519 2.851 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000664539156 481317075 /nfs/dbraw/zinc/31/70/75/481317075.db2.gz CXBHWWUYYUCQOU-QZTJIDSGSA-N 1 3 346.519 2.851 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@@H](C)c1ccc(C(=O)N(C)C)cc1 ZINC000650755716 481320049 /nfs/dbraw/zinc/32/00/49/481320049.db2.gz LDNFPHNOWCHVAD-HNNXBMFYSA-N 1 3 325.456 2.959 10 0 EFAEHO [NH3+][C@@H]1CCCCCC[C@H]1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659368290 481388664 /nfs/dbraw/zinc/38/86/64/481388664.db2.gz OSGAPVKSBVTCQF-KZNAEPCWSA-N 1 3 331.460 2.584 10 0 EFAEHO C[C@@H](CCNC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1)[NH+](C)C ZINC000664715546 481434720 /nfs/dbraw/zinc/43/47/20/481434720.db2.gz QAHLJTFYMAHQBM-FXAWDEMLSA-N 1 3 346.519 2.681 10 0 EFAEHO CCCN1CC[C@H](NC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000661953329 481443255 /nfs/dbraw/zinc/44/32/55/481443255.db2.gz AKBPSZFNJIZRMN-IBGZPJMESA-N 1 3 344.503 2.566 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NCc1ccc(C2CC2)cc1 ZINC000664739685 481449541 /nfs/dbraw/zinc/44/95/41/481449541.db2.gz CEBZJQPTYXWOIH-INIZCTEOSA-N 1 3 346.519 2.635 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NCc1ccc(C2CC2)cc1 ZINC000664739685 481449544 /nfs/dbraw/zinc/44/95/44/481449544.db2.gz CEBZJQPTYXWOIH-INIZCTEOSA-N 1 3 346.519 2.635 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000659465736 481451678 /nfs/dbraw/zinc/45/16/78/481451678.db2.gz RHBIFPYNAPELJY-YTQUADARSA-N 1 3 346.519 2.712 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C ZINC000659466030 481454106 /nfs/dbraw/zinc/45/41/06/481454106.db2.gz OGSJQSVVISVSMB-QXAKKESOSA-N 1 3 346.519 2.570 10 0 EFAEHO C[C@@]1(CNC(=O)NCC2([NH3+])CCCC2)CCCN1Cc1ccccc1 ZINC000659484445 481463700 /nfs/dbraw/zinc/46/37/00/481463700.db2.gz UVANUPDEUTXUST-IBGZPJMESA-N 1 3 344.503 2.612 10 0 EFAEHO C[C@H]([NH2+]CC(=O)NC[C@H](c1ccccc1)N(C)C)C1CCC(F)CC1 ZINC000661999928 481475459 /nfs/dbraw/zinc/47/54/59/481475459.db2.gz DRQDABLTXWLSME-NHFHULPWSA-N 1 3 349.494 2.912 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CN[C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000643463865 481478018 /nfs/dbraw/zinc/47/80/18/481478018.db2.gz FAGBBSSOKNKNSU-FUMNGEBKSA-N 1 3 346.515 2.944 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N1CCN(Cc2ccccc2)C[C@H](C)C1 ZINC000659619716 481518700 /nfs/dbraw/zinc/51/87/00/481518700.db2.gz SDVJQQFKYRYQMR-PKOBYXMFSA-N 1 3 346.519 2.523 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000659623124 481520764 /nfs/dbraw/zinc/52/07/64/481520764.db2.gz DIWVKMWXGDLOQY-PKOBYXMFSA-N 1 3 346.519 2.666 10 0 EFAEHO CCC[N@H+](CC)Cc1ccc(C(=O)N2CC[C@H]3CN(C)C[C@@H]32)cc1 ZINC000646912184 481547244 /nfs/dbraw/zinc/54/72/44/481547244.db2.gz OVSPYWJPNKFDQS-OALUTQOASA-N 1 3 329.488 2.695 10 0 EFAEHO CCC[N@@H+](CC)Cc1ccc(C(=O)N2CC[C@H]3CN(C)C[C@@H]32)cc1 ZINC000646912184 481547253 /nfs/dbraw/zinc/54/72/53/481547253.db2.gz OVSPYWJPNKFDQS-OALUTQOASA-N 1 3 329.488 2.695 10 0 EFAEHO CC[N@H+](Cc1ccc(C(=O)N2CC[C@H]3CN(C)C[C@H]32)cc1)C(C)C ZINC000646928289 481557547 /nfs/dbraw/zinc/55/75/47/481557547.db2.gz XFXWRKORYKHRNI-RBUKOAKNSA-N 1 3 329.488 2.693 10 0 EFAEHO CC[N@@H+](Cc1ccc(C(=O)N2CC[C@H]3CN(C)C[C@H]32)cc1)C(C)C ZINC000646928289 481557556 /nfs/dbraw/zinc/55/75/56/481557556.db2.gz XFXWRKORYKHRNI-RBUKOAKNSA-N 1 3 329.488 2.693 10 0 EFAEHO CC[N@H+](CCCNC(=O)N1CC[C@@H](N2CC=CC2)C1)C1CCCCC1 ZINC000651219976 481638247 /nfs/dbraw/zinc/63/82/47/481638247.db2.gz ODCBGGDISTUKEV-LJQANCHMSA-N 1 3 348.535 2.687 10 0 EFAEHO CC[N@@H+](CCCNC(=O)N1CC[C@@H](N2CC=CC2)C1)C1CCCCC1 ZINC000651219976 481638255 /nfs/dbraw/zinc/63/82/55/481638255.db2.gz ODCBGGDISTUKEV-LJQANCHMSA-N 1 3 348.535 2.687 10 0 EFAEHO CC[C@H](NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)C1CCCC1 ZINC000665055005 481639369 /nfs/dbraw/zinc/63/93/69/481639369.db2.gz VNIMMOBPCSYTLG-RDJZCZTQSA-N 1 3 326.529 2.526 10 0 EFAEHO CC[C@H](NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)C1CCCC1 ZINC000665055005 481639376 /nfs/dbraw/zinc/63/93/76/481639376.db2.gz VNIMMOBPCSYTLG-RDJZCZTQSA-N 1 3 326.529 2.526 10 0 EFAEHO CCc1cccc(C)c1NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000665126159 481672269 /nfs/dbraw/zinc/67/22/69/481672269.db2.gz KFOYLONWIAIRRJ-INIZCTEOSA-N 1 3 334.508 2.951 10 0 EFAEHO CCc1cccc(C)c1NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000665126159 481672275 /nfs/dbraw/zinc/67/22/75/481672275.db2.gz KFOYLONWIAIRRJ-INIZCTEOSA-N 1 3 334.508 2.951 10 0 EFAEHO COC[C@@H](CN1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2)OC ZINC000659979659 481680482 /nfs/dbraw/zinc/68/04/82/481680482.db2.gz NLCGECRZGUMCKA-UXHICEINSA-N 1 3 332.488 2.636 10 0 EFAEHO COC[C@@H](CN1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2)OC ZINC000659979659 481680487 /nfs/dbraw/zinc/68/04/87/481680487.db2.gz NLCGECRZGUMCKA-UXHICEINSA-N 1 3 332.488 2.636 10 0 EFAEHO CC(C)C[N@H+](C[C@@H]1CCC2(CNC2)O1)[C@@H]1CCCc2cccnc21 ZINC000662281415 481688865 /nfs/dbraw/zinc/68/88/65/481688865.db2.gz WRNFHWZTOLRVGC-ZWKOTPCHSA-N 1 3 329.488 2.938 10 0 EFAEHO CC(C)C[N@@H+](C[C@@H]1CCC2(CNC2)O1)[C@@H]1CCCc2cccnc21 ZINC000662281415 481688872 /nfs/dbraw/zinc/68/88/72/481688872.db2.gz WRNFHWZTOLRVGC-ZWKOTPCHSA-N 1 3 329.488 2.938 10 0 EFAEHO CC(C)C[N@H+](C[C@H]1CCC2(CNC2)O1)[C@H]1CCCc2cccnc21 ZINC000662281411 481688899 /nfs/dbraw/zinc/68/88/99/481688899.db2.gz WRNFHWZTOLRVGC-MSOLQXFVSA-N 1 3 329.488 2.938 10 0 EFAEHO CC(C)C[N@@H+](C[C@H]1CCC2(CNC2)O1)[C@H]1CCCc2cccnc21 ZINC000662281411 481688907 /nfs/dbraw/zinc/68/89/07/481688907.db2.gz WRNFHWZTOLRVGC-MSOLQXFVSA-N 1 3 329.488 2.938 10 0 EFAEHO CN(CCOc1ccc(C(F)(F)F)cc1)C[C@@H]1CCC2(C[NH2+]C2)O1 ZINC000662281662 481689555 /nfs/dbraw/zinc/68/95/55/481689555.db2.gz KWHHCWUPMHNQCJ-HNNXBMFYSA-N 1 3 344.377 2.537 10 0 EFAEHO C[C@@H]1CCCC[C@@H]1N(C)C(=O)CN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662294031 481697139 /nfs/dbraw/zinc/69/71/39/481697139.db2.gz AFVWAIZYUVIIPB-NEWSRXKRSA-N 1 3 335.536 2.735 10 0 EFAEHO O=C(CN1CCC[C@H](C2CC[NH2+]CC2)C1)NCCC1CCCCC1 ZINC000662295693 481700628 /nfs/dbraw/zinc/70/06/28/481700628.db2.gz HUVAEYFLWASIAP-IBGZPJMESA-N 1 3 335.536 2.785 10 0 EFAEHO C[C@H](C(=O)NCC1CCCCC1)N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662297785 481704982 /nfs/dbraw/zinc/70/49/82/481704982.db2.gz RSHOMXRLCAFREG-APWZRJJASA-N 1 3 335.536 2.783 10 0 EFAEHO CN1C[C@@H](C[NH2+]Cc2cc(-c3cccnc3)n[nH]2)[C@H](c2ccccc2)C1 ZINC000647248773 481727884 /nfs/dbraw/zinc/72/78/84/481727884.db2.gz BSHLCUGBZAKTSM-QUCCMNQESA-N 1 3 347.466 2.907 10 0 EFAEHO CC(C)C[C@H](NC1CC[NH+](CCC(=O)N(C)C)CC1)c1ccncc1 ZINC000647288415 481746982 /nfs/dbraw/zinc/74/69/82/481746982.db2.gz CDMICRWTLFPFCV-IBGZPJMESA-N 1 3 346.519 2.701 10 0 EFAEHO COc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@H](C)[C@H]2CCCOC2)cc1F ZINC000665259764 481753978 /nfs/dbraw/zinc/75/39/78/481753978.db2.gz PCVFSVQERSGXKU-VKZRIFJHSA-N 1 3 336.451 2.685 10 0 EFAEHO C[NH+](C)C1(CNC(=O)C[C@@H]2NCc3ccccc32)CCCCCC1 ZINC000662367481 481759885 /nfs/dbraw/zinc/75/98/85/481759885.db2.gz AOAWKRRGPDHAOQ-SFHVURJKSA-N 1 3 329.488 2.992 10 0 EFAEHO CCOc1ccccc1[C@@H](C)NC1CCN(C(=O)CCC[NH2+]C)CC1 ZINC000665285369 481770507 /nfs/dbraw/zinc/77/05/07/481770507.db2.gz LDJMTQAKWXIXGO-MRXNPFEDSA-N 1 3 347.503 2.727 10 0 EFAEHO C[C@@H]1CCC[C@@H]([NH+]2CCC(NCC(C)(C)[C@@]3(O)CCOC3)CC2)C1 ZINC000647341651 481770969 /nfs/dbraw/zinc/77/09/69/481770969.db2.gz ZKAXXJOJXDCLQQ-YVWKXTFCSA-N 1 3 338.536 2.797 10 0 EFAEHO C[C@@H]1CCC[C@@H](N2CCC([NH2+]CC(C)(C)[C@@]3(O)CCOC3)CC2)C1 ZINC000647341651 481770977 /nfs/dbraw/zinc/77/09/77/481770977.db2.gz ZKAXXJOJXDCLQQ-YVWKXTFCSA-N 1 3 338.536 2.797 10 0 EFAEHO CO[C@H](CN1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1)C1CCCCC1 ZINC000660127510 481775123 /nfs/dbraw/zinc/77/51/23/481775123.db2.gz AZAZIKXXXRMTNH-JGUMPVPUSA-N 1 3 349.563 2.825 10 0 EFAEHO CO[C@H](CN1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1)C1CCCCC1 ZINC000660127510 481775129 /nfs/dbraw/zinc/77/51/29/481775129.db2.gz AZAZIKXXXRMTNH-JGUMPVPUSA-N 1 3 349.563 2.825 10 0 EFAEHO C[C@H](CNC(=O)c1ccc2c(c1)[C@H](C[NH3+])CCC2)N1CCC(C)CC1 ZINC000662417104 481796000 /nfs/dbraw/zinc/79/60/00/481796000.db2.gz HXHWJOLZDKFDAK-APWZRJJASA-N 1 3 343.515 2.915 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)N1CCC([NH+]2CCCCC2)CC1 ZINC000665367227 481825964 /nfs/dbraw/zinc/82/59/64/481825964.db2.gz SNAXMFAHHLUYNL-KRWDZBQOSA-N 1 3 336.524 2.519 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)N2CCN(C(C)(C)CC)CC2)CC1 ZINC000654414678 481860204 /nfs/dbraw/zinc/86/02/04/481860204.db2.gz UNXLUKXXBQFNAV-UHFFFAOYSA-N 1 3 338.540 2.624 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000654433731 481868962 /nfs/dbraw/zinc/86/89/62/481868962.db2.gz WGPJNKUBONKPIX-XMTFNYHQSA-N 1 3 336.524 2.565 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000654433731 481868958 /nfs/dbraw/zinc/86/89/58/481868958.db2.gz WGPJNKUBONKPIX-XMTFNYHQSA-N 1 3 336.524 2.565 10 0 EFAEHO Cc1cccc(O[C@@H]2CCCC[C@H]2[NH2+]C[C@H](O)CN(C)C(C)C)c1 ZINC000660321337 481895208 /nfs/dbraw/zinc/89/52/08/481895208.db2.gz OFDQDKMCCLMFAM-DFQSSKMNSA-N 1 3 334.504 2.976 10 0 EFAEHO CC[NH+](CC)[C@@H](CNC(=O)C1(NC2CC2)CCC1)Cc1ccccc1 ZINC000662678532 481930214 /nfs/dbraw/zinc/93/02/14/481930214.db2.gz GVVDSWPMESDLIJ-LJQANCHMSA-N 1 3 343.515 2.730 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)N(CC)CC ZINC000649102046 481931131 /nfs/dbraw/zinc/93/11/31/481931131.db2.gz RYLWDHYAXVMVNM-CEXWTWQISA-N 1 3 331.504 2.568 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)N(CC)CC ZINC000649102046 481931135 /nfs/dbraw/zinc/93/11/35/481931135.db2.gz RYLWDHYAXVMVNM-CEXWTWQISA-N 1 3 331.504 2.568 10 0 EFAEHO C[NH+](C)Cc1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)cc1 ZINC000662686360 481932542 /nfs/dbraw/zinc/93/25/42/481932542.db2.gz DNUBTRUAYKZBAO-LJQANCHMSA-N 1 3 339.439 2.661 10 0 EFAEHO C[C@H](C(=O)Nc1ccc([C@H]2CNCCO2)cc1)[C@@H]([NH3+])c1ccccc1 ZINC000662685761 481932707 /nfs/dbraw/zinc/93/27/07/481932707.db2.gz IFMCJIBNPIWYPQ-GDIGMMSISA-N 1 3 339.439 2.622 10 0 EFAEHO Cc1ccccc1[C@H]([C@@H](C)NC(=O)NC[C@H]1C[C@@H]([NH+](C)C)C1)N(C)C ZINC000654562098 481937466 /nfs/dbraw/zinc/93/74/66/481937466.db2.gz VVYZYXRSTKDQQA-VXNCWWDNSA-N 1 3 346.519 2.626 10 0 EFAEHO C[C@@H](CN1CCC(C)CC1)NC(=O)c1ccc2c(c1)[C@H](C[NH3+])CCC2 ZINC000662695212 481938557 /nfs/dbraw/zinc/93/85/57/481938557.db2.gz XMLSQLLXQOMJPN-LPHOPBHVSA-N 1 3 343.515 2.915 10 0 EFAEHO C[C@H](CN1CCC(C)CC1)NC(=O)c1ccc2c(c1)[C@@H](C[NH3+])CCC2 ZINC000662695214 481938703 /nfs/dbraw/zinc/93/87/03/481938703.db2.gz XMLSQLLXQOMJPN-VQIMIIECSA-N 1 3 343.515 2.915 10 0 EFAEHO NC1(C(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)CC2(CCC2)C1 ZINC000662715119 481944726 /nfs/dbraw/zinc/94/47/26/481944726.db2.gz FRBWJIAJOSXPKI-KRWDZBQOSA-N 1 3 333.520 2.763 10 0 EFAEHO O=C(N1CCC[C@H](C[NH+]2CCCCCC2)C1)C1(NC2CC2)CCC1 ZINC000662716474 481947119 /nfs/dbraw/zinc/94/71/19/481947119.db2.gz SYCLWZZMRUBWHS-QGZVFWFLSA-N 1 3 333.520 2.776 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000662731050 481952594 /nfs/dbraw/zinc/95/25/94/481952594.db2.gz WXZFDSHZLFIPEG-SJLPKXTDSA-N 1 3 335.467 2.527 10 0 EFAEHO CC(C)CN(C)CCC[NH2+][C@H](C)CCN1C(=O)c2ccccc2C1=O ZINC000651865790 481981233 /nfs/dbraw/zinc/98/12/33/481981233.db2.gz HXAABADKKRJAKT-MRXNPFEDSA-N 1 3 345.487 2.629 10 0 EFAEHO CC(C)C[N@H+](C)CCCN[C@H](C)CCN1C(=O)c2ccccc2C1=O ZINC000651865790 481981237 /nfs/dbraw/zinc/98/12/37/481981237.db2.gz HXAABADKKRJAKT-MRXNPFEDSA-N 1 3 345.487 2.629 10 0 EFAEHO CC(C)C[N@@H+](C)CCCN[C@H](C)CCN1C(=O)c2ccccc2C1=O ZINC000651865790 481981239 /nfs/dbraw/zinc/98/12/39/481981239.db2.gz HXAABADKKRJAKT-MRXNPFEDSA-N 1 3 345.487 2.629 10 0 EFAEHO CC(C)CN(C)CCC[NH2+][C@@H](C)CCN1C(=O)c2ccccc2C1=O ZINC000651865789 481981481 /nfs/dbraw/zinc/98/14/81/481981481.db2.gz HXAABADKKRJAKT-INIZCTEOSA-N 1 3 345.487 2.629 10 0 EFAEHO CC(C)C[N@H+](C)CCCN[C@@H](C)CCN1C(=O)c2ccccc2C1=O ZINC000651865789 481981485 /nfs/dbraw/zinc/98/14/85/481981485.db2.gz HXAABADKKRJAKT-INIZCTEOSA-N 1 3 345.487 2.629 10 0 EFAEHO CC(C)C[N@@H+](C)CCCN[C@@H](C)CCN1C(=O)c2ccccc2C1=O ZINC000651865789 481981492 /nfs/dbraw/zinc/98/14/92/481981492.db2.gz HXAABADKKRJAKT-INIZCTEOSA-N 1 3 345.487 2.629 10 0 EFAEHO CCN(Cc1ccc(CN(C)C)cc1)C(=O)NC[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000654658822 481986211 /nfs/dbraw/zinc/98/62/11/481986211.db2.gz SPYMMYZAPPGTCO-KDURUIRLSA-N 1 3 346.519 2.620 10 0 EFAEHO C[C@@H](C(=O)N[C@@H]1C[NH2+]CC[C@@H]1c1ccccc1)[C@H](N)c1ccccc1 ZINC000662865085 481997715 /nfs/dbraw/zinc/99/77/15/481997715.db2.gz LVKDLQDAAHGAKQ-XLNTUCKNSA-N 1 3 337.467 2.584 10 0 EFAEHO C[C@H](C(=O)N[C@@H]1C[NH2+]CC[C@@H]1c1ccccc1)N1CCCCCC1 ZINC000662866499 481999352 /nfs/dbraw/zinc/99/93/52/481999352.db2.gz BVYZNWQHLRXDQL-BHIYHBOVSA-N 1 3 329.488 2.513 10 0 EFAEHO CO[C@H](CN1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1)[C@@H]1CCOC1 ZINC000660542100 482014288 /nfs/dbraw/zinc/01/42/88/482014288.db2.gz ZYVKCRPLSRBFHY-NJDAHSKKSA-N 1 3 344.499 2.636 10 0 EFAEHO CO[C@H](CN1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1)[C@@H]1CCOC1 ZINC000660542100 482014293 /nfs/dbraw/zinc/01/42/93/482014293.db2.gz ZYVKCRPLSRBFHY-NJDAHSKKSA-N 1 3 344.499 2.636 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)C1(c2ccccc2)CC[NH2+]CC1 ZINC000649318711 482026519 /nfs/dbraw/zinc/02/65/19/482026519.db2.gz DZVISQFXDAZEBG-QZTJIDSGSA-N 1 3 343.515 2.687 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CCC2(C1)CCCCC2 ZINC000665758612 482037385 /nfs/dbraw/zinc/03/73/85/482037385.db2.gz KVAJOKWSCRVXDQ-KRWDZBQOSA-N 1 3 338.540 2.624 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CCC2(C1)CCCCC2 ZINC000665758612 482037389 /nfs/dbraw/zinc/03/73/89/482037389.db2.gz KVAJOKWSCRVXDQ-KRWDZBQOSA-N 1 3 338.540 2.624 10 0 EFAEHO Cc1cc(C)cc(CN(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000665761462 482040395 /nfs/dbraw/zinc/04/03/95/482040395.db2.gz FCAVAJFGJBIPFP-SFHVURJKSA-N 1 3 348.535 2.717 10 0 EFAEHO Cc1cc(C)cc(CN(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000665761462 482040401 /nfs/dbraw/zinc/04/04/01/482040401.db2.gz FCAVAJFGJBIPFP-SFHVURJKSA-N 1 3 348.535 2.717 10 0 EFAEHO CCN(C[C@@H]1CC[NH2+]C1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000649413656 482068212 /nfs/dbraw/zinc/06/82/12/482068212.db2.gz XBBIJCOUELEXCB-QGZVFWFLSA-N 1 3 345.535 2.809 10 0 EFAEHO C[NH2+]Cc1ccccc1CNC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000652118006 482082401 /nfs/dbraw/zinc/08/24/01/482082401.db2.gz KGETUHZFVMROBC-IBGZPJMESA-N 1 3 340.471 2.508 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)NCCC1(C[NH3+])CC1)c1ccsc1 ZINC000652127256 482087117 /nfs/dbraw/zinc/08/71/17/482087117.db2.gz JUDYNDOYHVRFCD-OAHLLOKOSA-N 1 3 338.521 2.559 10 0 EFAEHO C[NH+](C)CC[C@H](NC(=O)NC[C@H]1CCN1C(C)(C)C)C(C)(C)C ZINC000660677731 482090695 /nfs/dbraw/zinc/09/06/95/482090695.db2.gz OTKYYADWIJNYNZ-CABCVRRESA-N 1 3 326.529 2.525 10 0 EFAEHO Cc1ccc(CCC[NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)cn1 ZINC000668490240 482142406 /nfs/dbraw/zinc/14/24/06/482142406.db2.gz SZFFIBLCCISWKS-OAQYLSRUSA-N 1 3 339.483 2.679 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NCCC3(F)CCC3)CC2)CC1 ZINC000655079436 482154097 /nfs/dbraw/zinc/15/40/97/482154097.db2.gz UVZNGWIDVJKQEU-UHFFFAOYSA-N 1 3 339.499 2.581 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)CC1 ZINC000668554563 482165626 /nfs/dbraw/zinc/16/56/26/482165626.db2.gz NXHQDGHXOWNSDV-WGMWDUQUSA-N 1 3 345.531 2.667 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)CC1 ZINC000668554563 482165631 /nfs/dbraw/zinc/16/56/31/482165631.db2.gz NXHQDGHXOWNSDV-WGMWDUQUSA-N 1 3 345.531 2.667 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH+]2C[C@@H](C)C(O)[C@H](C)C2)CC1 ZINC000668554561 482166070 /nfs/dbraw/zinc/16/60/70/482166070.db2.gz NXHQDGHXOWNSDV-QZTJIDSGSA-N 1 3 345.531 2.667 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CNC[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663346214 482173267 /nfs/dbraw/zinc/17/32/67/482173267.db2.gz QUILBAYKBYMDKI-GOSISDBHSA-N 1 3 339.487 2.787 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CNC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663346214 482173274 /nfs/dbraw/zinc/17/32/74/482173274.db2.gz QUILBAYKBYMDKI-GOSISDBHSA-N 1 3 339.487 2.787 10 0 EFAEHO CCc1ccncc1NC(=O)C1CCN(C2CC[NH+](CC)CC2)CC1 ZINC000655165971 482190947 /nfs/dbraw/zinc/19/09/47/482190947.db2.gz ZAVKCNVSAYQIBN-UHFFFAOYSA-N 1 3 344.503 2.779 10 0 EFAEHO CC(=O)c1ccccc1OCCN1CCCC[C@@H]1[C@@H]1C[C@@H]([NH3+])CCO1 ZINC000652360367 482193325 /nfs/dbraw/zinc/19/33/25/482193325.db2.gz GEJHFIJKXKLRNZ-HQRMLTQVSA-N 1 3 346.471 2.629 10 0 EFAEHO Cn1ncc(C2CCC2)c1C[NH2+]C1CCN(c2ccncc2)CC1 ZINC000668639595 482196428 /nfs/dbraw/zinc/19/64/28/482196428.db2.gz YQMBGMJCIXCNMM-UHFFFAOYSA-N 1 3 325.460 2.841 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2C[C@@H](C)[C@](C)(CO)C2)CC1 ZINC000668739060 482241212 /nfs/dbraw/zinc/24/12/12/482241212.db2.gz LYSVGNWWNNXOGI-NQIIRXRSSA-N 1 3 345.531 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2C[C@@H](C)[C@](C)(CO)C2)CC1 ZINC000668739060 482241218 /nfs/dbraw/zinc/24/12/18/482241218.db2.gz LYSVGNWWNNXOGI-NQIIRXRSSA-N 1 3 345.531 2.669 10 0 EFAEHO O[C@H]1CCN(C2CC[NH+](CCCCCOc3ccccc3)CC2)C1 ZINC000668740008 482241423 /nfs/dbraw/zinc/24/14/23/482241423.db2.gz QTXWIWFYFTXXOZ-IBGZPJMESA-N 1 3 332.488 2.767 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2C[C@H](C)[C@@](C)(CO)C2)CC1 ZINC000668739059 482242595 /nfs/dbraw/zinc/24/25/95/482242595.db2.gz LYSVGNWWNNXOGI-GHTZIAJQSA-N 1 3 345.531 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2C[C@H](C)[C@@](C)(CO)C2)CC1 ZINC000668739059 482242601 /nfs/dbraw/zinc/24/26/01/482242601.db2.gz LYSVGNWWNNXOGI-GHTZIAJQSA-N 1 3 345.531 2.669 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC[C@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000668748009 482244318 /nfs/dbraw/zinc/24/43/18/482244318.db2.gz PKKQJDKBZQOPCN-HNNXBMFYSA-N 1 3 340.533 2.904 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC[C@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000668748009 482244321 /nfs/dbraw/zinc/24/43/21/482244321.db2.gz PKKQJDKBZQOPCN-HNNXBMFYSA-N 1 3 340.533 2.904 10 0 EFAEHO c1ccc(CN(Cc2nc3c(s2)CNCC3)[C@@H]2CCC[NH2+]C2)cc1 ZINC000663496776 482265871 /nfs/dbraw/zinc/26/58/71/482265871.db2.gz YIPMSFUXTRGXSL-MRXNPFEDSA-N 1 3 342.512 2.543 10 0 EFAEHO CC(C)[C@H](N)CC[NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000663500136 482266511 /nfs/dbraw/zinc/26/65/11/482266511.db2.gz PIJOPZLXZPRIDP-QGZVFWFLSA-N 1 3 337.895 2.908 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000663500136 482266519 /nfs/dbraw/zinc/26/65/19/482266519.db2.gz PIJOPZLXZPRIDP-QGZVFWFLSA-N 1 3 337.895 2.908 10 0 EFAEHO CCN(C(=O)NCc1ccc(C[NH+](CC)CC)cc1)[C@H]1CCN(C)C1 ZINC000663517498 482277022 /nfs/dbraw/zinc/27/70/22/482277022.db2.gz XMZAMJMRTMFJIU-IBGZPJMESA-N 1 3 346.519 2.764 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000666427128 482326772 /nfs/dbraw/zinc/32/67/72/482326772.db2.gz NUAAUVLPTOJCOP-ICSRJNTNSA-N 1 3 343.515 2.857 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000666427129 482327109 /nfs/dbraw/zinc/32/71/09/482327109.db2.gz NUAAUVLPTOJCOP-QUCCMNQESA-N 1 3 343.515 2.857 10 0 EFAEHO O=C(C[NH2+][C@H]1CCCC12CCCCC2)NC1CCN(C2CC2)CC1 ZINC000661130135 482338020 /nfs/dbraw/zinc/33/80/20/482338020.db2.gz SOVKSSULBKIPED-SFHVURJKSA-N 1 3 333.520 2.822 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccc(C2CC2)cc1 ZINC000666541225 482371882 /nfs/dbraw/zinc/37/18/82/482371882.db2.gz JQHUELFVPRJRAC-HNNXBMFYSA-N 1 3 332.492 2.958 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccc(C2CC2)cc1 ZINC000666541225 482371885 /nfs/dbraw/zinc/37/18/85/482371885.db2.gz JQHUELFVPRJRAC-HNNXBMFYSA-N 1 3 332.492 2.958 10 0 EFAEHO C[C@H](NC(=O)c1cccc(CN2CCCC2)c1)C(C)(C)C[NH+](C)C ZINC000173044998 533757982 /nfs/dbraw/zinc/75/79/82/533757982.db2.gz VELOTKMUZSUPQM-INIZCTEOSA-N 1 3 331.504 2.989 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000078545702 517641414 /nfs/dbraw/zinc/64/14/14/517641414.db2.gz DFDFLAGKFDLTLV-IEBWSBKVSA-N 1 3 346.519 2.853 10 0 EFAEHO CC(C)Cc1ncc(CN(C)CC2CC[NH+](C[C@H](C)O)CC2)s1 ZINC000179518370 519460330 /nfs/dbraw/zinc/46/03/30/519460330.db2.gz NWVHVIUXCANQQT-HNNXBMFYSA-N 1 3 339.549 2.866 10 0 EFAEHO CCC[N@H+](CC)Cc1ccc(-c2nc([C@@H]3CNCCN3C)no2)cc1 ZINC000263225215 521613518 /nfs/dbraw/zinc/61/35/18/521613518.db2.gz MRJZBOOWUSGXII-KRWDZBQOSA-N 1 3 343.475 2.545 10 0 EFAEHO CCC[N@@H+](CC)Cc1ccc(-c2nc([C@@H]3CNCCN3C)no2)cc1 ZINC000263225215 521613521 /nfs/dbraw/zinc/61/35/21/521613521.db2.gz MRJZBOOWUSGXII-KRWDZBQOSA-N 1 3 343.475 2.545 10 0 EFAEHO CCN1CCC[C@@H]1CN(C)C(=O)NCCCC[NH+]1CCC(C)CC1 ZINC000177399200 521628148 /nfs/dbraw/zinc/62/81/48/521628148.db2.gz CRXRKIPGRTYFBH-GOSISDBHSA-N 1 3 338.540 2.624 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]CCN2CCCC[C@@H]2C)[C@H](C)C1 ZINC000156612884 521708201 /nfs/dbraw/zinc/70/82/01/521708201.db2.gz QBRFKXOMYYZEDR-QYZOEREBSA-N 1 3 325.541 2.587 10 0 EFAEHO C[NH+](C)C[C@@](C)(O)CNC1CC(c2cccc(Br)c2)C1 ZINC000234243453 521854632 /nfs/dbraw/zinc/85/46/32/521854632.db2.gz JIKJOQKXRBNIIA-BCLQGDPASA-N 1 3 341.293 2.597 10 0 EFAEHO C[NH+](C)C[C@](C)(O)CNC1CC(c2cccc(Br)c2)C1 ZINC000234231321 521884314 /nfs/dbraw/zinc/88/43/14/521884314.db2.gz JIKJOQKXRBNIIA-AVVWSFFYSA-N 1 3 341.293 2.597 10 0 EFAEHO Cc1cccc(NC(=O)[C@H]2CCC[N@H+](CCCN3CCCC3)C2)n1 ZINC000193474212 524656268 /nfs/dbraw/zinc/65/62/68/524656268.db2.gz JCEIZQGSACKUSG-KRWDZBQOSA-N 1 3 330.476 2.526 10 0 EFAEHO Cc1cccc(NC(=O)[C@H]2CCC[N@@H+](CCCN3CCCC3)C2)n1 ZINC000193474212 524656275 /nfs/dbraw/zinc/65/62/75/524656275.db2.gz JCEIZQGSACKUSG-KRWDZBQOSA-N 1 3 330.476 2.526 10 0 EFAEHO C[C@@H](c1ccncc1)N1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)N3C)CC1 ZINC000193040565 526152824 /nfs/dbraw/zinc/15/28/24/526152824.db2.gz BTRPNRZCJPEYIR-FAXKSRBJSA-N 1 3 328.504 2.822 10 0 EFAEHO c1ccc(N2CCOCC2)c(CN2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000152685373 526481328 /nfs/dbraw/zinc/48/13/28/526481328.db2.gz KFOPZCNHIOJVRZ-UHFFFAOYSA-N 1 3 343.515 2.831 10 0 EFAEHO O=C1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)CN1C1CC1 ZINC000180175848 527028638 /nfs/dbraw/zinc/02/86/38/527028638.db2.gz RUYIXCKJMQWNOD-WOCFUTGOSA-N 1 3 339.483 2.535 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1 ZINC000174450411 527840061 /nfs/dbraw/zinc/84/00/61/527840061.db2.gz PYTLTTVXIKWKTN-APWZRJJASA-N 1 3 346.519 2.762 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1 ZINC000174450411 527840068 /nfs/dbraw/zinc/84/00/68/527840068.db2.gz PYTLTTVXIKWKTN-APWZRJJASA-N 1 3 346.519 2.762 10 0 EFAEHO CC[NH+](CC)Cc1ccc(CNC(=O)N2CCN3CCC[C@H]3C2)cc1 ZINC000171899224 528188535 /nfs/dbraw/zinc/18/85/35/528188535.db2.gz STWVMNSPIOZRPV-IBGZPJMESA-N 1 3 344.503 2.518 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@@H](Cc2ccccc2OC)C(C)C)CC1 ZINC000154322534 529144900 /nfs/dbraw/zinc/14/49/00/529144900.db2.gz OSHMXUDDHYHPLJ-FQEVSTJZSA-N 1 3 347.547 2.880 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C)CCCCCO)CC1 ZINC000435053452 534935153 /nfs/dbraw/zinc/93/51/53/534935153.db2.gz QTFNCRBOCYBMSV-UHFFFAOYSA-N 1 3 333.520 2.813 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C)CCCCCO)CC1 ZINC000435053452 534935159 /nfs/dbraw/zinc/93/51/59/534935159.db2.gz QTFNCRBOCYBMSV-UHFFFAOYSA-N 1 3 333.520 2.813 10 0 EFAEHO CC(C)[NH+](CCNC(=O)NCCN1[C@H](C)CCC[C@@H]1C)C(C)C ZINC000341351836 535070513 /nfs/dbraw/zinc/07/05/13/535070513.db2.gz CMYUYINIFFEHMY-CALCHBBNSA-N 1 3 326.529 2.667 10 0 EFAEHO CCN1CCC[C@H](NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000342206710 535581165 /nfs/dbraw/zinc/58/11/65/535581165.db2.gz NCRYYHYOLJNQSJ-IBGZPJMESA-N 1 3 329.488 2.887 10 0 EFAEHO CCc1ccccc1[C@@H](N)CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000418656867 535977609 /nfs/dbraw/zinc/97/76/09/535977609.db2.gz SYEHRQNUGHDMHC-MJGOQNOKSA-N 1 3 344.503 2.519 10 0 EFAEHO C[N@H+](Cc1ccccc1)CC(C)(C)CNC[C@@H](CO)c1cccnc1 ZINC000342285608 536480498 /nfs/dbraw/zinc/48/04/98/536480498.db2.gz IWSSKXYWXGVKRM-FQEVSTJZSA-N 1 3 341.499 2.905 10 0 EFAEHO C[N@@H+](Cc1ccccc1)CC(C)(C)CNC[C@@H](CO)c1cccnc1 ZINC000342285608 536480499 /nfs/dbraw/zinc/48/04/99/536480499.db2.gz IWSSKXYWXGVKRM-FQEVSTJZSA-N 1 3 341.499 2.905 10 0 EFAEHO Cn1cc(CCC[NH2+][C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)cn1 ZINC000313990615 545810268 /nfs/dbraw/zinc/81/02/68/545810268.db2.gz NWLYDBULEMKORP-PCCBWWKXSA-N 1 3 338.499 2.853 10 0 EFAEHO CC[NH+](CC)C[C@@H](C)NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000355056831 546076916 /nfs/dbraw/zinc/07/69/16/546076916.db2.gz RIRPCOMQTYDIOV-IEBWSBKVSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[NH+](CC)C[C@@H](C)NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000355056833 546077192 /nfs/dbraw/zinc/07/71/92/546077192.db2.gz RIRPCOMQTYDIOV-MJGOQNOKSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[C@@H]1C[C@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCO1 ZINC000397562091 546170483 /nfs/dbraw/zinc/17/04/83/546170483.db2.gz SJGDBPLMUXIKQE-RTBURBONSA-N 1 3 332.488 2.561 10 0 EFAEHO CCCN1CCN(c2ccccc2CN[C@H]2CCC[C@H]([NH3+])C2)CC1 ZINC000414926936 546194319 /nfs/dbraw/zinc/19/43/19/546194319.db2.gz OHYNDYHBGNDVDO-OALUTQOASA-N 1 3 330.520 2.578 10 0 EFAEHO C[C@@H]1CC[C@@H]([NH2+]CC2(N3CCCCC3)CCN(C)CC2)CS1 ZINC000655719194 546548223 /nfs/dbraw/zinc/54/82/23/546548223.db2.gz HUQCYFIKWSXXET-IAGOWNOFSA-N 1 3 325.566 2.810 10 0 EFAEHO C[C@H]1CC[C@@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CS1 ZINC000655777781 546577426 /nfs/dbraw/zinc/57/74/26/546577426.db2.gz ZEGYRLPPECBECA-FUHWJXTLSA-N 1 3 334.529 2.887 10 0 EFAEHO CCC(C)(C)N1CCN(C(=O)NCc2ccc([C@H](C)[NH3+])cc2)CC1 ZINC000655962465 546652859 /nfs/dbraw/zinc/65/28/59/546652859.db2.gz BYPVVOKVMJXCDL-HNNXBMFYSA-N 1 3 332.492 2.722 10 0 EFAEHO COc1cc(CN2CCC[C@H](C3CC[NH2+]CC3)C2)cc(OC)c1O ZINC000656783061 546923382 /nfs/dbraw/zinc/92/33/82/546923382.db2.gz NMLWUEFCIICYDW-INIZCTEOSA-N 1 3 334.460 2.621 10 0 EFAEHO COc1cc(OC)c(OC)cc1CN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656786220 546924686 /nfs/dbraw/zinc/92/46/86/546924686.db2.gz PYBFAHJCBMWWDJ-INIZCTEOSA-N 1 3 348.487 2.924 10 0 EFAEHO CC[C@H]1C[C@H]([NH2+]CCCCN2CCN(Cc3ccccc3)CC2)CO1 ZINC000657314898 547106200 /nfs/dbraw/zinc/10/62/00/547106200.db2.gz GBSAHDTVVIMYSH-SFTDATJTSA-N 1 3 345.531 2.742 10 0 EFAEHO c1csc(C[NH+]2CCC(CNCc3cc4n(n3)CCC4)CC2)c1 ZINC000657337777 547117878 /nfs/dbraw/zinc/11/78/78/547117878.db2.gz AQFJOZPKHMTPTQ-UHFFFAOYSA-N 1 3 330.501 2.893 10 0 EFAEHO c1csc(CN2CCC(C[NH2+]Cc3cnn4c3CCC4)CC2)c1 ZINC000657337834 547118223 /nfs/dbraw/zinc/11/82/23/547118223.db2.gz CLDARMQFTJIURL-UHFFFAOYSA-N 1 3 330.501 2.893 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H](CNCc2ccnn2-c2ccncc2)C1 ZINC000657413605 547152969 /nfs/dbraw/zinc/15/29/69/547152969.db2.gz NMELKCCDYMDAAO-QGZVFWFLSA-N 1 3 327.476 2.725 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H](CNCc2ccnn2-c2ccncc2)C1 ZINC000657413605 547152972 /nfs/dbraw/zinc/15/29/72/547152972.db2.gz NMELKCCDYMDAAO-QGZVFWFLSA-N 1 3 327.476 2.725 10 0 EFAEHO COc1cccc(OC)c1CNCC1CC[NH+](C2CCOCC2)CC1 ZINC000657535157 547195818 /nfs/dbraw/zinc/19/58/18/547195818.db2.gz GVVYRPWANSABHS-UHFFFAOYSA-N 1 3 348.487 2.684 10 0 EFAEHO COc1ccc(CNCC2CC[NH+](C3CCOCC3)CC2)c(F)c1 ZINC000657537381 547196714 /nfs/dbraw/zinc/19/67/14/547196714.db2.gz JAYNDDOVCOSAFA-UHFFFAOYSA-N 1 3 336.451 2.815 10 0 EFAEHO c1c2cccnc2oc1CNCC1CC[NH+](C2CCOCC2)CC1 ZINC000657537247 547196854 /nfs/dbraw/zinc/19/68/54/547196854.db2.gz FCMIKMXGSIEYLW-UHFFFAOYSA-N 1 3 329.444 2.808 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1cnc(C(C)(C)C)s1 ZINC000657572674 547210949 /nfs/dbraw/zinc/21/09/49/547210949.db2.gz BIPRKTDLUYQWQD-AWEZNQCLSA-N 1 3 326.554 2.802 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1ccc(Br)s1 ZINC000657573658 547211940 /nfs/dbraw/zinc/21/19/40/547211940.db2.gz NXTABDUXUAKBTF-LBPRGKRZSA-N 1 3 348.354 2.872 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1sccc1Br ZINC000657573142 547212586 /nfs/dbraw/zinc/21/25/86/547212586.db2.gz KIGLGDSETBUTIH-LBPRGKRZSA-N 1 3 348.354 2.872 10 0 EFAEHO O[C@H]1CC[N@H+](Cc2ccc(CNCc3ccc(F)c(F)c3)cc2)C1 ZINC000657595311 547222456 /nfs/dbraw/zinc/22/24/56/547222456.db2.gz ONSODUSXCNTPAP-KRWDZBQOSA-N 1 3 332.394 2.821 10 0 EFAEHO O[C@H]1CC[N@@H+](Cc2ccc(CNCc3ccc(F)c(F)c3)cc2)C1 ZINC000657595311 547222459 /nfs/dbraw/zinc/22/24/59/547222459.db2.gz ONSODUSXCNTPAP-KRWDZBQOSA-N 1 3 332.394 2.821 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC2CCC(O)CC2)CC1 ZINC000657740180 547269185 /nfs/dbraw/zinc/26/91/85/547269185.db2.gz HKROSALWIRQWQR-UHFFFAOYSA-N 1 3 345.531 2.859 10 0 EFAEHO COC[C@H](CC1CCOCC1)NCCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000657839417 547298426 /nfs/dbraw/zinc/29/84/26/547298426.db2.gz UXGJSMLYZJBGEL-LNLFQRSKSA-N 1 3 326.525 2.776 10 0 EFAEHO COC[C@H](CC1CCOCC1)[NH2+]CCCN1C[C@@H](C)C[C@H](C)C1 ZINC000657839417 547298434 /nfs/dbraw/zinc/29/84/34/547298434.db2.gz UXGJSMLYZJBGEL-LNLFQRSKSA-N 1 3 326.525 2.776 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@H](C)c2cc3cnccc3o2)CC1 ZINC000657836567 547299066 /nfs/dbraw/zinc/29/90/66/547299066.db2.gz TZJPFHCHPLKBTE-MRXNPFEDSA-N 1 3 330.476 2.896 10 0 EFAEHO COC[C@H](CC1CCOCC1)[NH2+]C[C@H]1CCCN(CC(C)C)C1 ZINC000657932979 547319249 /nfs/dbraw/zinc/31/92/49/547319249.db2.gz YAMIHMADSYLSRC-MOPGFXCFSA-N 1 3 326.525 2.776 10 0 EFAEHO COC[C@H](CC1CCOCC1)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000657932979 547319252 /nfs/dbraw/zinc/31/92/52/547319252.db2.gz YAMIHMADSYLSRC-MOPGFXCFSA-N 1 3 326.525 2.776 10 0 EFAEHO COC[C@H](CC1CCOCC1)NC[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000657932979 547319254 /nfs/dbraw/zinc/31/92/54/547319254.db2.gz YAMIHMADSYLSRC-MOPGFXCFSA-N 1 3 326.525 2.776 10 0 EFAEHO Cc1ncc([C@@H](C)NCC2CC[NH+](C3CCOCC3)CC2)c(C)n1 ZINC000658067904 547347002 /nfs/dbraw/zinc/34/70/02/547347002.db2.gz RQBUXGBETGBFIM-CQSZACIVSA-N 1 3 332.492 2.635 10 0 EFAEHO CO[C@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CCOC1 ZINC000658077836 547349391 /nfs/dbraw/zinc/34/93/91/547349391.db2.gz RLSSZHJWJWTWMC-ALGQRKQJSA-N 1 3 344.499 2.823 10 0 EFAEHO CO[C@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@H]1CCOC1 ZINC000658077836 547349396 /nfs/dbraw/zinc/34/93/96/547349396.db2.gz RLSSZHJWJWTWMC-ALGQRKQJSA-N 1 3 344.499 2.823 10 0 EFAEHO CO[C@H](CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CCOC1 ZINC000658077839 547349524 /nfs/dbraw/zinc/34/95/24/547349524.db2.gz RLSSZHJWJWTWMC-JPGZLTHCSA-N 1 3 344.499 2.823 10 0 EFAEHO CO[C@H](CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1CCOC1 ZINC000658077839 547349526 /nfs/dbraw/zinc/34/95/26/547349526.db2.gz RLSSZHJWJWTWMC-JPGZLTHCSA-N 1 3 344.499 2.823 10 0 EFAEHO COC[C@H](CC[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21)OC ZINC000658082238 547351504 /nfs/dbraw/zinc/35/15/04/547351504.db2.gz KNHWYTYOBFZPPC-PLACYPQZSA-N 1 3 346.515 2.928 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)N[C@@H]1CCc2c1cc(F)cc2F ZINC000658105811 547357698 /nfs/dbraw/zinc/35/76/98/547357698.db2.gz FBASROPFCXHNGV-SCLBCKFNSA-N 1 3 325.447 2.814 10 0 EFAEHO CCOC1CCC([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)CC1 ZINC000658135444 547366944 /nfs/dbraw/zinc/36/69/44/547366944.db2.gz DTJUXSWBWKAZFF-IOJLRTSASA-N 1 3 332.488 2.691 10 0 EFAEHO CC[C@H]([NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1)C1CCOCC1 ZINC000658137554 547367847 /nfs/dbraw/zinc/36/78/47/547367847.db2.gz HKTRYRWQBXQJCS-UXHICEINSA-N 1 3 332.488 2.548 10 0 EFAEHO CC1(C)C[C@H]([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)C(C)(C)O1 ZINC000658138703 547368285 /nfs/dbraw/zinc/36/82/85/547368285.db2.gz JYKBXZDQKBBJMI-MSOLQXFVSA-N 1 3 332.488 2.689 10 0 EFAEHO CC1(C)[C@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)[C@@H]2CCCO[C@H]21 ZINC000658139239 547368675 /nfs/dbraw/zinc/36/86/75/547368675.db2.gz PMRKKWZOJCPORW-VNTMZGSJSA-N 1 3 344.499 2.546 10 0 EFAEHO CC[C@H](NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1ccncc1 ZINC000658141994 547368734 /nfs/dbraw/zinc/36/87/34/547368734.db2.gz YAAXTTCQZBAYLY-UXHICEINSA-N 1 3 325.456 2.889 10 0 EFAEHO CC[C@H](NCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1)c1ccncc1 ZINC000658141994 547368737 /nfs/dbraw/zinc/36/87/37/547368737.db2.gz YAAXTTCQZBAYLY-UXHICEINSA-N 1 3 325.456 2.889 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1)C1CCSCC1 ZINC000658142566 547370121 /nfs/dbraw/zinc/37/01/21/547370121.db2.gz YOPVAKCFTLEALS-KXBFYZLASA-N 1 3 334.529 2.875 10 0 EFAEHO C[C@@H](NCCO[C@@H]1CC1(F)F)c1cccc(OCC[NH+](C)C)c1 ZINC000658168948 547379553 /nfs/dbraw/zinc/37/95/53/547379553.db2.gz JVTIQANBCXGYCI-CZUORRHYSA-N 1 3 328.403 2.702 10 0 EFAEHO Cc1cncc(CC[NH2+][C@@H](C)c2cccc(OCCN(C)C)c2)n1 ZINC000658260932 547400327 /nfs/dbraw/zinc/40/03/27/547400327.db2.gz GBBGAGWNTHIHMD-INIZCTEOSA-N 1 3 328.460 2.619 10 0 EFAEHO c1ccc(CN2C[C@H]3C[C@@H](C2)C3[NH2+]CCCN2CCCCC2)cc1 ZINC000671098175 547533367 /nfs/dbraw/zinc/53/33/67/547533367.db2.gz IURLYZVACYMNOJ-WCRBZPEASA-N 1 3 327.516 2.973 10 0 EFAEHO CC[C@H](CN1CCCC1)NC(=O)C1CCN(c2cc[nH+]cc2C)CC1 ZINC000674412874 548088649 /nfs/dbraw/zinc/08/86/49/548088649.db2.gz UWGQAPZTHPPAFA-GOSISDBHSA-N 1 3 344.503 2.597 10 0 EFAEHO C[C@H](N[C@H](CO)c1cccc(Br)c1)C1CC[NH+](C)CC1 ZINC000678598835 548958971 /nfs/dbraw/zinc/95/89/71/548958971.db2.gz NWSYCWGBLZBZOZ-BLLLJJGKSA-N 1 3 341.293 2.802 10 0 EFAEHO C[C@@H](N[C@@H](CO)c1cccc(Br)c1)C1CC[NH+](C)CC1 ZINC000678598838 548959017 /nfs/dbraw/zinc/95/90/17/548959017.db2.gz NWSYCWGBLZBZOZ-WBMJQRKESA-N 1 3 341.293 2.802 10 0 EFAEHO CCN1CCN(c2ccccc2N[C@H](C)C2CC[NH+](C)CC2)CC1 ZINC000679086093 549053293 /nfs/dbraw/zinc/05/32/93/549053293.db2.gz GXXLGDLAQIVNLZ-QGZVFWFLSA-N 1 3 330.520 2.971 10 0 EFAEHO c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](NCCOC[C@H]2CCOC2)C3)cc1 ZINC000679392581 549117814 /nfs/dbraw/zinc/11/78/14/549117814.db2.gz BVYUKJXKZCURHU-BURNTYAHSA-N 1 3 344.499 2.825 10 0 EFAEHO c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](NCCOC[C@H]2CCOC2)C3)cc1 ZINC000679392581 549117818 /nfs/dbraw/zinc/11/78/18/549117818.db2.gz BVYUKJXKZCURHU-BURNTYAHSA-N 1 3 344.499 2.825 10 0 EFAEHO c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H](NCCOC[C@H]2CCOC2)C3)cc1 ZINC000679392588 549118495 /nfs/dbraw/zinc/11/84/95/549118495.db2.gz BVYUKJXKZCURHU-XSDIEEQYSA-N 1 3 344.499 2.825 10 0 EFAEHO c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H](NCCOC[C@H]2CCOC2)C3)cc1 ZINC000679392588 549118498 /nfs/dbraw/zinc/11/84/98/549118498.db2.gz BVYUKJXKZCURHU-XSDIEEQYSA-N 1 3 344.499 2.825 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)CCN(C)c1ccncc1 ZINC000679407384 549123013 /nfs/dbraw/zinc/12/30/13/549123013.db2.gz LOIZFKKMAHTOAW-GOSISDBHSA-N 1 3 332.492 2.679 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)CCN(C)c1ccncc1 ZINC000679407384 549123017 /nfs/dbraw/zinc/12/30/17/549123017.db2.gz LOIZFKKMAHTOAW-GOSISDBHSA-N 1 3 332.492 2.679 10 0 EFAEHO COc1ccccc1/C=C\CN1CCC(C[NH+]2CCN(C)CC2)CC1 ZINC000685455312 550153581 /nfs/dbraw/zinc/15/35/81/550153581.db2.gz XRPKJUMGDDTWER-ALCCZGGFSA-N 1 3 343.515 2.668 10 0 EFAEHO CN(Cc1cccc2cnccc21)[C@@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000685457760 550154430 /nfs/dbraw/zinc/15/44/30/550154430.db2.gz MGYKXTFVMBPGHC-HXUWFJFHSA-N 1 3 338.499 2.835 10 0 EFAEHO CN(Cc1cccc2cnccc21)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000685457760 550154434 /nfs/dbraw/zinc/15/44/34/550154434.db2.gz MGYKXTFVMBPGHC-HXUWFJFHSA-N 1 3 338.499 2.835 10 0 EFAEHO CN(Cc1ccc(C[NH+](C)C)cc1)C[C@@H](O)COCc1ccccc1 ZINC000769100648 577334244 /nfs/dbraw/zinc/33/42/44/577334244.db2.gz MKEUSSGAVDWDGM-OAQYLSRUSA-N 1 3 342.483 2.758 10 0 EFAEHO C[C@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@@H]1CC[NH2+]CC1CC(C)(C)C1 ZINC001691306618 1248639662 /nfs/dbraw/zinc/63/96/62/1248639662.db2.gz VXQYQDRIEHFJII-MAUKXSAKSA-N 1 3 346.519 2.995 10 0 EFAEHO CN(CCNCc1ccc(Cl)s1)C(=O)C(C)(C)[NH+]1CCCC1 ZINC001691423637 1248762142 /nfs/dbraw/zinc/76/21/42/1248762142.db2.gz IAMTZUKNOGCDKK-UHFFFAOYSA-N 1 3 343.924 2.824 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCC[N@@H+]1CCCCCF)N1CCCCC1 ZINC001691080386 1248371467 /nfs/dbraw/zinc/37/14/67/1248371467.db2.gz XAYGBJIBEASEKL-QGZVFWFLSA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCC[N@H+]1CCCCCF)N1CCCCC1 ZINC001691080386 1248371479 /nfs/dbraw/zinc/37/14/79/1248371479.db2.gz XAYGBJIBEASEKL-QGZVFWFLSA-N 1 3 341.515 2.971 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001691159983 1248488202 /nfs/dbraw/zinc/48/82/02/1248488202.db2.gz PIYWPZKRINQQDQ-VQIMIIECSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCCC[N@H+]1CC[C@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001691159983 1248488209 /nfs/dbraw/zinc/48/82/09/1248488209.db2.gz PIYWPZKRINQQDQ-VQIMIIECSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)=CCN1C[C@@H](c2ccccc2)[C@H](NC(=O)CCC[NH+](C)C)C1 ZINC001691554004 1251765228 /nfs/dbraw/zinc/76/52/28/1251765228.db2.gz PIWNOEZJGWYLCQ-VQTJNVASSA-N 1 3 343.515 2.879 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)[C@@H](CC)N(C)C)C[C@@H]2C1 ZINC001691558036 1251769844 /nfs/dbraw/zinc/76/98/44/1251769844.db2.gz QLYLUOZBFZDYNG-UMPVYUTHSA-N 1 3 335.536 2.853 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)[C@@H](CC)N(C)C)C[C@@H]2C1 ZINC001691558036 1251769852 /nfs/dbraw/zinc/76/98/52/1251769852.db2.gz QLYLUOZBFZDYNG-UMPVYUTHSA-N 1 3 335.536 2.853 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001691556549 1251771113 /nfs/dbraw/zinc/77/11/13/1251771113.db2.gz UZWZEBHPEVQFBN-LPHOPBHVSA-N 1 3 349.494 2.803 10 0 EFAEHO CN(CC[NH2+]CC1CCC(C(C)(C)C)CC1)C(=O)CN1CCCC1 ZINC001691602995 1251814247 /nfs/dbraw/zinc/81/42/47/1251814247.db2.gz NOERJRCGHPJZGW-UHFFFAOYSA-N 1 3 337.552 2.983 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]Cc1ccc(C)c(C)c1 ZINC001691622966 1251842108 /nfs/dbraw/zinc/84/21/08/1251842108.db2.gz GLGXZYRKGSXSHR-LJQANCHMSA-N 1 3 331.504 2.726 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N1CC[C@@](C)(NC(=O)CC[NH+](C)C)C1 ZINC001484058432 1252121310 /nfs/dbraw/zinc/12/13/10/1252121310.db2.gz RNOVTUSCSWXSLH-PKOBYXMFSA-N 1 3 335.467 2.809 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001484098894 1252245408 /nfs/dbraw/zinc/24/54/08/1252245408.db2.gz AJCHLQVAHREUKX-VQIMIIECSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2ccsc2)C1)N(C)C ZINC001484112083 1252261489 /nfs/dbraw/zinc/26/14/89/1252261489.db2.gz NVZDGWJNMORFKS-AEFFLSMTSA-N 1 3 337.533 2.663 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]CCCCCF)C2)CC1 ZINC001484120546 1252294407 /nfs/dbraw/zinc/29/44/07/1252294407.db2.gz UQDDSOLIGINRHW-IBGZPJMESA-N 1 3 341.515 2.686 10 0 EFAEHO CC[NH2+][C@H](CNC(=O)[C@H]1CCCN1C(C)C)c1ccccc1CC ZINC001484325176 1252401961 /nfs/dbraw/zinc/40/19/61/1252401961.db2.gz OMNOTTVJEAOOPZ-RTBURBONSA-N 1 3 331.504 2.889 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001484359815 1252454726 /nfs/dbraw/zinc/45/47/26/1252454726.db2.gz YOUNMUSAHLCQKZ-FXAWDEMLSA-N 1 3 345.531 2.916 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccsc1 ZINC001484390048 1252496467 /nfs/dbraw/zinc/49/64/67/1252496467.db2.gz FIZBCLPLULLZMX-BCDXTJNWSA-N 1 3 349.544 2.949 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccsc1 ZINC001484390048 1252496473 /nfs/dbraw/zinc/49/64/73/1252496473.db2.gz FIZBCLPLULLZMX-BCDXTJNWSA-N 1 3 349.544 2.949 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001484396094 1252519097 /nfs/dbraw/zinc/51/90/97/1252519097.db2.gz QAQNDPCJIAOCBI-TVFCKZIOSA-N 1 3 341.515 2.589 10 0 EFAEHO CC(C)C[NH2+]CCN(Cc1ccccc1)C(=O)CN1CC[C@@H](C)C1 ZINC001484400336 1252538811 /nfs/dbraw/zinc/53/88/11/1252538811.db2.gz QSINYGYRWZSXND-GOSISDBHSA-N 1 3 331.504 2.603 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@H+]1C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001484415353 1252570886 /nfs/dbraw/zinc/57/08/86/1252570886.db2.gz YWYNVXDPBSEQSU-QRVBRYPASA-N 1 3 343.515 2.786 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@@H+]1C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001484415353 1252570890 /nfs/dbraw/zinc/57/08/90/1252570890.db2.gz YWYNVXDPBSEQSU-QRVBRYPASA-N 1 3 343.515 2.786 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1CCCN(Cc2cc(C)ccc2F)CC1 ZINC001484724686 1252809448 /nfs/dbraw/zinc/80/94/48/1252809448.db2.gz TXNQIACDMQOMQH-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1CCCN(Cc2cc(C)ccc2F)CC1 ZINC001484724686 1252809456 /nfs/dbraw/zinc/80/94/56/1252809456.db2.gz TXNQIACDMQOMQH-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO Cc1cc(C[N@H+]2CCC[C@@H](NC(=O)CN(C)C(C)C)CC2)cs1 ZINC001484727848 1252817189 /nfs/dbraw/zinc/81/71/89/1252817189.db2.gz HBHLHJZRSKMLFH-QGZVFWFLSA-N 1 3 337.533 2.867 10 0 EFAEHO Cc1cc(C[N@@H+]2CCC[C@@H](NC(=O)CN(C)C(C)C)CC2)cs1 ZINC001484727848 1252817201 /nfs/dbraw/zinc/81/72/01/1252817201.db2.gz HBHLHJZRSKMLFH-QGZVFWFLSA-N 1 3 337.533 2.867 10 0 EFAEHO CN(CCCN(C)C(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21)CCC(F)(F)F ZINC001484747234 1252904008 /nfs/dbraw/zinc/90/40/08/1252904008.db2.gz NOHTVYHUHOQLLX-HUUCEWRRSA-N 1 3 349.441 2.736 10 0 EFAEHO CN(CCCN(C)C(=O)[C@H]1CC[C@H]2CCCC[N@H+]21)CCC(F)(F)F ZINC001484747234 1252904012 /nfs/dbraw/zinc/90/40/12/1252904012.db2.gz NOHTVYHUHOQLLX-HUUCEWRRSA-N 1 3 349.441 2.736 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)CCCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001484758295 1252929128 /nfs/dbraw/zinc/92/91/28/1252929128.db2.gz BKTNKXCMZGFXNA-CRAIPNDOSA-N 1 3 347.494 2.727 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)CCCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001484758295 1252929140 /nfs/dbraw/zinc/92/91/40/1252929140.db2.gz BKTNKXCMZGFXNA-CRAIPNDOSA-N 1 3 347.494 2.727 10 0 EFAEHO Cc1cccc(CN2CC([C@H](C)NC(=O)C(C)(C)[NH+]3CCCC3)C2)c1 ZINC001409938290 1257438852 /nfs/dbraw/zinc/43/88/52/1257438852.db2.gz ZJYPCNUPZITTHH-KRWDZBQOSA-N 1 3 343.515 2.806 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@@H]([C@@H]2CCCCN2C(=O)CN(C)C(C)C)C1 ZINC001670924036 1258707161 /nfs/dbraw/zinc/70/71/61/1258707161.db2.gz RVTYNYHRMZYMKB-MOPGFXCFSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@@H]([C@@H]2CCCCN2C(=O)CN(C)C(C)C)C1 ZINC001670924036 1258707166 /nfs/dbraw/zinc/70/71/66/1258707166.db2.gz RVTYNYHRMZYMKB-MOPGFXCFSA-N 1 3 335.536 2.996 10 0 EFAEHO Cc1ccc(CCC[NH2+]C[C@@H]2CCCN2C(=O)[C@H]2CCCN2C)cc1 ZINC001671280417 1260069010 /nfs/dbraw/zinc/06/90/10/1260069010.db2.gz BYPGANMPHJLFQQ-VQTJNVASSA-N 1 3 343.515 2.602 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1nsc2ccccc12)N(C)C ZINC001272865131 1261192795 /nfs/dbraw/zinc/19/27/95/1261192795.db2.gz JVRMNZKDXWEGPX-CZUORRHYSA-N 1 3 348.516 2.621 10 0 EFAEHO CCCN(C)CC(=O)NCc1cccc2c1CC[N@H+](CC=C(C)C)C2 ZINC001272916557 1261326923 /nfs/dbraw/zinc/32/69/23/1261326923.db2.gz BJKWOZYBZKKWJP-UHFFFAOYSA-N 1 3 343.515 2.969 10 0 EFAEHO CCCN(C)CC(=O)NCc1cccc2c1CC[N@@H+](CC=C(C)C)C2 ZINC001272916557 1261326928 /nfs/dbraw/zinc/32/69/28/1261326928.db2.gz BJKWOZYBZKKWJP-UHFFFAOYSA-N 1 3 343.515 2.969 10 0 EFAEHO CC[N@H+](C[C@@H](CN)Cc1cnn(C)c1C)[C@@H](C)Cc1ccsc1 ZINC000903916487 1261543406 /nfs/dbraw/zinc/54/34/06/1261543406.db2.gz SOZKGXVUHPNJKO-WMLDXEAASA-N 1 3 334.533 2.861 10 0 EFAEHO CC[N@@H+](C[C@@H](CN)Cc1cnn(C)c1C)[C@@H](C)Cc1ccsc1 ZINC000903916487 1261543409 /nfs/dbraw/zinc/54/34/09/1261543409.db2.gz SOZKGXVUHPNJKO-WMLDXEAASA-N 1 3 334.533 2.861 10 0 EFAEHO Cc1ccc(C)c(OC[C@H](O)CN2CCCC[C@H]2[C@H]2CC[NH2+]C2)c1 ZINC000923364503 1261557422 /nfs/dbraw/zinc/55/74/22/1261557422.db2.gz NGDHEGSYPBCERX-OTWHNJEPSA-N 1 3 332.488 2.507 10 0 EFAEHO CC(C)(C)[C@]1(C[NH3+])CCN(C[C@@H](O)COc2ccccc2Cl)C1 ZINC000923414975 1261628345 /nfs/dbraw/zinc/62/83/45/1261628345.db2.gz NZZGCTGDARBALT-KDOFPFPSSA-N 1 3 340.895 2.777 10 0 EFAEHO Cc1cc(C)cc(OC[C@H](O)CN2CC[C@@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000923414656 1261628386 /nfs/dbraw/zinc/62/83/86/1261628386.db2.gz MXHOLQWAGDSSSN-XLIONFOSSA-N 1 3 334.504 2.740 10 0 EFAEHO Cc1ccc(C)c(OC[C@@H](O)CN2CC[C@@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000923414528 1261628548 /nfs/dbraw/zinc/62/85/48/1261628548.db2.gz LQKLHXWGDPFVMA-PXNSSMCTSA-N 1 3 334.504 2.740 10 0 EFAEHO C[C@]12C[NH2+]C[C@H]1CN(C[C@@H](O)Cn1c3ccccc3c3ccccc31)C2 ZINC000923424705 1261632880 /nfs/dbraw/zinc/63/28/80/1261632880.db2.gz IDZUMUYABGGIJK-GSHUGGBRSA-N 1 3 349.478 2.697 10 0 EFAEHO CC[C@H](C(=O)Nc1ccc(C)cc1)N1CCC2(CO[C@H](C[NH3+])C2)CC1 ZINC000923446310 1261665618 /nfs/dbraw/zinc/66/56/18/1261665618.db2.gz MTSSUYIQWKLDQL-ZWKOTPCHSA-N 1 3 345.487 2.542 10 0 EFAEHO [NH3+]C[C@@H]1CC2(CO1)CCN(Cc1ccccc1OC(F)F)CC2 ZINC000923456284 1261680417 /nfs/dbraw/zinc/68/04/17/1261680417.db2.gz XEHAEBAXHKBTSA-AWEZNQCLSA-N 1 3 326.387 2.618 10 0 EFAEHO [NH3+]C[C@@H]1CC2(CO1)CCN(Cc1cccc(F)c1OC(F)F)CC2 ZINC000923449612 1261686446 /nfs/dbraw/zinc/68/64/46/1261686446.db2.gz ARSNYJVJSJNIIM-ZDUSSCGKSA-N 1 3 344.377 2.757 10 0 EFAEHO [NH3+]C[C@H]1CC2(CO1)CCN(CCc1c(F)cccc1Cl)CC2 ZINC000923449682 1261686462 /nfs/dbraw/zinc/68/64/62/1261686462.db2.gz QANCPQNZVIRMLV-CYBMUJFWSA-N 1 3 326.843 2.851 10 0 EFAEHO [NH3+]C[C@@H]1CC2(CO1)CCN(CCSc1ccc(F)cc1F)CC2 ZINC000923453252 1261692504 /nfs/dbraw/zinc/69/25/04/1261692504.db2.gz WOIWMZAIEDYTFY-AWEZNQCLSA-N 1 3 342.455 2.887 10 0 EFAEHO C[C@H]1CN(Cc2nn(-c3ccc(F)cc3)c3c2CCC3)CC[C@H]1C[NH3+] ZINC000923497878 1261788537 /nfs/dbraw/zinc/78/85/37/1261788537.db2.gz NAZIYUOARJEDKE-GJZGRUSLSA-N 1 3 342.462 2.917 10 0 EFAEHO C[C@H]1CN(Cc2nn(-c3ccc(F)cc3)c3c2CCC3)CC[C@@H]1C[NH3+] ZINC000923497881 1261788803 /nfs/dbraw/zinc/78/88/03/1261788803.db2.gz NAZIYUOARJEDKE-LSDHHAIUSA-N 1 3 342.462 2.917 10 0 EFAEHO CCCN(Cc1ccc(C)cc1)C(=O)CN1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923497811 1261788972 /nfs/dbraw/zinc/78/89/72/1261788972.db2.gz DZFWPOGXBNXPQP-MJGOQNOKSA-N 1 3 331.504 2.650 10 0 EFAEHO C[C@@H]1CN([C@@H](C(=O)N2CCCCC2)c2ccccc2)CC[C@H]1C[NH3+] ZINC000923499639 1261795583 /nfs/dbraw/zinc/79/55/83/1261795583.db2.gz MJYXUHCAPSVRNT-NZSAHSFTSA-N 1 3 329.488 2.657 10 0 EFAEHO CCC[C@H](NC(=O)[C@H](C)N1CC[C@H](C[NH3+])[C@H](C)C1)c1ccccc1 ZINC000923500193 1261796558 /nfs/dbraw/zinc/79/65/58/1261796558.db2.gz PCNKXIFMWUOPND-JFRXWTBNSA-N 1 3 331.504 2.949 10 0 EFAEHO CC(C)[C@H](NC(=O)CN1CC[C@@H](C[NH3+])[C@H](C)C1)c1ccc(F)cc1 ZINC000923500510 1261798086 /nfs/dbraw/zinc/79/80/86/1261798086.db2.gz PICACFGMKSRSJH-ALKREAHSSA-N 1 3 335.467 2.556 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C[NH3+])[C@@H](C)C1)c1ccc2ccccc2c1 ZINC000923504440 1261801725 /nfs/dbraw/zinc/80/17/25/1261801725.db2.gz SCLQRCMMLWUNDE-FTRWYGJKSA-N 1 3 339.483 2.934 10 0 EFAEHO [NH3+]CCCCCCCN1C[C@H](C[C@@H]2COCCN2)c2ccccc21 ZINC000923540416 1261874747 /nfs/dbraw/zinc/87/47/47/1261874747.db2.gz JIHUAOYDXVLTEW-ZWKOTPCHSA-N 1 3 331.504 2.878 10 0 EFAEHO CCCCCN1CC[C@@H]1CN(C)C(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001691661518 1262209313 /nfs/dbraw/zinc/20/93/13/1262209313.db2.gz UWHDBOROBSCKNH-VQIMIIECSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCCCN1CC[C@@H]1CN(C)C(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001691661518 1262209319 /nfs/dbraw/zinc/20/93/19/1262209319.db2.gz UWHDBOROBSCKNH-VQIMIIECSA-N 1 3 341.515 2.922 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)CN(C)C(=O)C12CC[NH+](CC1)C2 ZINC001485943826 1262542628 /nfs/dbraw/zinc/54/26/28/1262542628.db2.gz FKYIEEOQMZJPAR-OAHLLOKOSA-N 1 3 349.906 2.681 10 0 EFAEHO C[C@@H](CN(C)C(=O)c1cccc(CN(C)C)c1)[NH2+]CC1CCCC1 ZINC001485960167 1262559811 /nfs/dbraw/zinc/55/98/11/1262559811.db2.gz ALJYJJTYWJSBBB-INIZCTEOSA-N 1 3 331.504 2.989 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(C)cc1 ZINC001485962189 1262562423 /nfs/dbraw/zinc/56/24/23/1262562423.db2.gz WNAYYRVJAMBEGO-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO C[C@H]1[C@H]([NH2+]CCCCc2ccccc2)CCN1C(=O)Cc1c[nH]cn1 ZINC001486088479 1262610492 /nfs/dbraw/zinc/61/04/92/1262610492.db2.gz HVGGONDCSMEUAV-QFBILLFUSA-N 1 3 340.471 2.554 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2cccc(F)c2)[C@H]1C ZINC001486090868 1262613330 /nfs/dbraw/zinc/61/33/30/1262613330.db2.gz DCFMZTMVBNQMFK-VQIMIIECSA-N 1 3 349.494 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2cc3ccccc3o2)[C@H]1C ZINC001486095882 1262618391 /nfs/dbraw/zinc/61/83/91/1262618391.db2.gz NTMXDPXNIUUASE-CRAIPNDOSA-N 1 3 343.471 2.852 10 0 EFAEHO CCCCC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]21 ZINC001486156531 1262713318 /nfs/dbraw/zinc/71/33/18/1262713318.db2.gz NPRBESYKUMDLKO-YTQUADARSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](N[C@H]1CN(C(=O)CC[NH+](C)C)CC1(C)C)c1ccccc1F ZINC001486240677 1262841372 /nfs/dbraw/zinc/84/13/72/1262841372.db2.gz OQSGKTIOKMBQBP-YOEHRIQHSA-N 1 3 335.467 2.665 10 0 EFAEHO CC[C@H](C(=O)N1C[C@@H](NCc2cccnc2)C(C)(C)C1)[NH+](CC)CC ZINC001486243042 1262845992 /nfs/dbraw/zinc/84/59/92/1262845992.db2.gz PSNZWABKJLHDPQ-QZTJIDSGSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)N(CC[N@H+](C)[C@H]1CCc2ccccc21)C(=O)[C@@H]1CCCN1C ZINC001486364192 1262952668 /nfs/dbraw/zinc/95/26/68/1262952668.db2.gz DXWCIZDAIIMFDJ-PMACEKPBSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(CC[N@@H+](C)[C@H]1CCc2ccccc21)C(=O)[C@@H]1CCCN1C ZINC001486364192 1262952669 /nfs/dbraw/zinc/95/26/69/1262952669.db2.gz DXWCIZDAIIMFDJ-PMACEKPBSA-N 1 3 343.515 2.937 10 0 EFAEHO C[C@@H](NC(=O)NC1CCC(C)([NH+]2CCCC2)CC1)C1=CCN(C)CC1 ZINC000921880475 1263110124 /nfs/dbraw/zinc/11/01/24/1263110124.db2.gz JPALIODFVXDJJA-PPDQVPDSSA-N 1 3 348.535 2.733 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)[NH+]1CCCC1)C1CCN(C/C=C/Cl)CC1 ZINC001486439189 1263125754 /nfs/dbraw/zinc/12/57/54/1263125754.db2.gz OFTIXRLCWLAOCQ-RZIFZGNASA-N 1 3 341.927 2.830 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C1CC[NH+](CCCC(C)C)CC1)N(C)C ZINC001486449469 1263141388 /nfs/dbraw/zinc/14/13/88/1263141388.db2.gz XRVPVWJCDJVERI-WMZOPIPTSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C1CC[NH+](CC2CC(F)(F)C2)CC1 ZINC001486449334 1263141679 /nfs/dbraw/zinc/14/16/79/1263141679.db2.gz CZPGZISRONAJCT-AWEZNQCLSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1CC[NH+](Cc2cccc(F)c2)CC1)N(C)C ZINC001486441768 1263153761 /nfs/dbraw/zinc/15/37/61/1263153761.db2.gz YCVMKIKAKUGLSK-DNVCBOLYSA-N 1 3 349.494 2.883 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)C1CC(NCc2cccc(Cl)c2F)C1 ZINC001486475826 1263202111 /nfs/dbraw/zinc/20/21/11/1263202111.db2.gz YIMMQILKJUWMEU-UHFFFAOYSA-N 1 3 341.858 2.510 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2)C1)N(C)C ZINC001410212871 1264325947 /nfs/dbraw/zinc/32/59/47/1264325947.db2.gz YQSRHVNWIZKIAD-LNMJFAINSA-N 1 3 349.494 2.957 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2ccccc2C)C1 ZINC001410232075 1264432605 /nfs/dbraw/zinc/43/26/05/1264432605.db2.gz XUNOFDBHTCFDQW-KZNAEPCWSA-N 1 3 331.504 2.882 10 0 EFAEHO Cc1ccc(F)c(CN(C)C2CCN(C(=O)CCC[NH+](C)C)CC2)c1 ZINC001410248204 1264501231 /nfs/dbraw/zinc/50/12/31/1264501231.db2.gz LVPKSXPWAGCLOJ-UHFFFAOYSA-N 1 3 349.494 2.899 10 0 EFAEHO CN(C/C=C/Cl)C1CCN(C(=O)[C@@H]2CCC[C@@H]3CCC[N@@H+]32)CC1 ZINC001410251246 1264514030 /nfs/dbraw/zinc/51/40/30/1264514030.db2.gz KISMWVDUQTYMPV-AAPAXSNKSA-N 1 3 339.911 2.679 10 0 EFAEHO CN(C/C=C/Cl)C1CCN(C(=O)[C@@H]2CCC[C@@H]3CCC[N@H+]32)CC1 ZINC001410251246 1264514034 /nfs/dbraw/zinc/51/40/34/1264514034.db2.gz KISMWVDUQTYMPV-AAPAXSNKSA-N 1 3 339.911 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C)Cc2cccc(F)c2)CC1 ZINC001410260419 1264584790 /nfs/dbraw/zinc/58/47/90/1264584790.db2.gz PSEJKNDMYHJGEK-UHFFFAOYSA-N 1 3 335.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C)Cc2cccc(F)c2)CC1 ZINC001410260419 1264584798 /nfs/dbraw/zinc/58/47/98/1264584798.db2.gz PSEJKNDMYHJGEK-UHFFFAOYSA-N 1 3 335.467 2.589 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)C1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001410265026 1264592311 /nfs/dbraw/zinc/59/23/11/1264592311.db2.gz YMIJTBXZLCEUMD-UHFFFAOYSA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1ccccc1C[N@H+](C)C1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001410265026 1264592318 /nfs/dbraw/zinc/59/23/18/1264592318.db2.gz YMIJTBXZLCEUMD-UHFFFAOYSA-N 1 3 331.504 2.758 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)NCc1cc2ccccc2o1 ZINC001410391970 1264991003 /nfs/dbraw/zinc/99/10/03/1264991003.db2.gz YBKRRXMOQYLJNH-HDMKZQKVSA-N 1 3 343.471 2.710 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)NCc1cc2ccccc2o1 ZINC001410391970 1264991013 /nfs/dbraw/zinc/99/10/13/1264991013.db2.gz YBKRRXMOQYLJNH-HDMKZQKVSA-N 1 3 343.471 2.710 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N(C)C[C@@H](C)NCc1ccccc1F ZINC001410407523 1265044758 /nfs/dbraw/zinc/04/47/58/1265044758.db2.gz MQHCAFAZCAQVDG-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N(C)C[C@@H](C)NCc1ccccc1F ZINC001410407523 1265044766 /nfs/dbraw/zinc/04/47/66/1265044766.db2.gz MQHCAFAZCAQVDG-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001410428592 1265145133 /nfs/dbraw/zinc/14/51/33/1265145133.db2.gz CEZNZXUALVLJGN-MAUKXSAKSA-N 1 3 331.504 2.582 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)c(F)c1)N(C)C ZINC001273122920 1268556434 /nfs/dbraw/zinc/55/64/34/1268556434.db2.gz JTUFVIWBBXPYEF-LRDDRELGSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001273123326 1268577141 /nfs/dbraw/zinc/57/71/41/1268577141.db2.gz ROIQIVAVDDVXLK-RHSMWYFYSA-N 1 3 339.911 2.973 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(F)cc1F)N(C)C ZINC001273131565 1268782745 /nfs/dbraw/zinc/78/27/45/1268782745.db2.gz UKYVBWAVLCHRAF-DYVFJYSZSA-N 1 3 341.446 2.535 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccccc2C2CC2)[C@H]1C ZINC001410840219 1269722275 /nfs/dbraw/zinc/72/22/75/1269722275.db2.gz FXHFJIOUEBLKHA-UZLBHIALSA-N 1 3 343.515 2.983 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)cc1F ZINC001410847854 1269795300 /nfs/dbraw/zinc/79/53/00/1269795300.db2.gz JXGUCYOGYCNZNV-NVXWUHKLSA-N 1 3 335.467 2.553 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)c1 ZINC001410876186 1270009141 /nfs/dbraw/zinc/00/91/41/1270009141.db2.gz YHPZABDLNQEIQU-IEBWSBKVSA-N 1 3 331.504 2.723 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CC3CC(C)(C)C3)[C@H]2C1 ZINC001410916075 1270212154 /nfs/dbraw/zinc/21/21/54/1270212154.db2.gz MLYHUUMNOVFVON-GBESFXJTSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]21 ZINC001410927378 1270289499 /nfs/dbraw/zinc/28/94/99/1270289499.db2.gz PBDHVTJVZPTXNK-NZSAHSFTSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@H]21 ZINC001410927372 1270290222 /nfs/dbraw/zinc/29/02/22/1270290222.db2.gz PBDHVTJVZPTXNK-BHIYHBOVSA-N 1 3 335.536 2.734 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@@H](NCc2ccccc2Cl)C(C)(C)C1 ZINC001411003775 1270628730 /nfs/dbraw/zinc/62/87/30/1270628730.db2.gz ZEBJWARLPBFPLX-MRXNPFEDSA-N 1 3 337.895 2.618 10 0 EFAEHO Cc1ccc(CN(C)CCN(C(=O)C23CC[NH+](CC2)C3)C(C)C)cc1 ZINC001411194981 1271857053 /nfs/dbraw/zinc/85/70/53/1271857053.db2.gz KKXPKPSOWYVYQY-UHFFFAOYSA-N 1 3 343.515 2.760 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H](NC(=O)CN(C)C(C)C)C(C)(C)C)c1 ZINC001411223221 1272054765 /nfs/dbraw/zinc/05/47/65/1272054765.db2.gz LPUFULYZIPMSMK-SFHVURJKSA-N 1 3 333.520 2.956 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)C1CC[NH+](CCC(F)(F)F)CC1 ZINC001411240559 1272108356 /nfs/dbraw/zinc/10/83/56/1272108356.db2.gz VBZWDFWHQPRGAR-ZDUSSCGKSA-N 1 3 349.441 2.640 10 0 EFAEHO CC[C@@H](C)C[NH+]1CCC([C@@H](C)NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001411240652 1272109158 /nfs/dbraw/zinc/10/91/58/1272109158.db2.gz WIRPOPAHDAAKDP-NUJGCVRESA-N 1 3 325.541 2.835 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)C1CC(NCc2cccc(C(C)C)n2)C1 ZINC001411250950 1272138640 /nfs/dbraw/zinc/13/86/40/1272138640.db2.gz YIVSVCZOMYRWOE-UHFFFAOYSA-N 1 3 346.519 2.626 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)C1CC(NCc2cccc(C(C)C)n2)C1 ZINC001411250950 1272138651 /nfs/dbraw/zinc/13/86/51/1272138651.db2.gz YIVSVCZOMYRWOE-UHFFFAOYSA-N 1 3 346.519 2.626 10 0 EFAEHO CC[C@H](F)C[NH2+]C1CC(N(C)C(=O)c2cccc(CN(C)C)c2)C1 ZINC001411255864 1272158001 /nfs/dbraw/zinc/15/80/01/1272158001.db2.gz VZCPQEVTGZBEKQ-AOCRQIFASA-N 1 3 335.467 2.689 10 0 EFAEHO CCN1CCN(c2ccc(NC(=O)[C@H]3[NH2+]CCCC3(C)C)cc2)CC1 ZINC000844191355 1278786289 /nfs/dbraw/zinc/78/62/89/1278786289.db2.gz MVBQNTSAYDWWOB-GOSISDBHSA-N 1 3 344.503 2.545 10 0 EFAEHO CN(CC(=O)Nc1ccnn1CC1CCCCC1)C1CCC([NH3+])CC1 ZINC000844221117 1278795136 /nfs/dbraw/zinc/79/51/36/1278795136.db2.gz VSXVNLHXYDTKRE-UHFFFAOYSA-N 1 3 347.507 2.604 10 0 EFAEHO CC[C@@H](NCC[C@H]1CCC[NH2+]1)[C@H]1CCCN1C(=O)OC(C)(C)C ZINC000817967833 1276409958 /nfs/dbraw/zinc/40/99/58/1276409958.db2.gz CQPAFGCTQUIZMM-BZUAXINKSA-N 1 3 325.497 2.896 10 0 EFAEHO O[C@@H](CNCc1ccccc1C[NH+]1CCCC1)c1ccc(F)cn1 ZINC000818943136 1276554991 /nfs/dbraw/zinc/55/49/91/1276554991.db2.gz PUHKGPNKRXUJSS-IBGZPJMESA-N 1 3 329.419 2.640 10 0 EFAEHO Cc1cc(F)ccc1[C@@H](O)CNCc1ccccc1OCC[NH+](C)C ZINC000818984803 1276563238 /nfs/dbraw/zinc/56/32/38/1276563238.db2.gz LSLNCKYSRWIWSC-IBGZPJMESA-N 1 3 346.446 2.898 10 0 EFAEHO C[N@@H+]1CCC[C@H](CNC[C@@H](O)c2ccc(F)cn2)[C@@H]1c1cccs1 ZINC000819101445 1276606685 /nfs/dbraw/zinc/60/66/85/1276606685.db2.gz UODKAIOFHYFVOV-MZMPZRCHSA-N 1 3 349.475 2.988 10 0 EFAEHO C[N@H+]1CCC[C@H](CNC[C@@H](O)c2ccc(F)cn2)[C@@H]1c1cccs1 ZINC000819101445 1276606701 /nfs/dbraw/zinc/60/67/01/1276606701.db2.gz UODKAIOFHYFVOV-MZMPZRCHSA-N 1 3 349.475 2.988 10 0 EFAEHO C[N@@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000923261303 1277390925 /nfs/dbraw/zinc/39/09/25/1277390925.db2.gz OOMQXNBSDKOIEW-DLBZAZTESA-N 1 3 326.444 2.600 10 0 EFAEHO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000923261303 1277390937 /nfs/dbraw/zinc/39/09/37/1277390937.db2.gz OOMQXNBSDKOIEW-DLBZAZTESA-N 1 3 326.444 2.600 10 0 EFAEHO CC[C@@H]([NH2+]Cc1ccc(CN2CCN(C)CC2)cc1)[C@H]1CCCOC1 ZINC000872023046 1287403852 /nfs/dbraw/zinc/40/38/52/1287403852.db2.gz BGCYLDQKOCAQQX-LEWJYISDSA-N 1 3 345.531 2.729 10 0 EFAEHO COC(=O)c1cc(CN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)ccc1C ZINC000872145688 1287442670 /nfs/dbraw/zinc/44/26/70/1287442670.db2.gz WLORUAMOURIGBS-QXAKKESOSA-N 1 3 346.471 2.642 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC[C@@H](O)CC(C)(C)O ZINC000872201236 1287472966 /nfs/dbraw/zinc/47/29/66/1287472966.db2.gz UDHYWYUBKUMHHA-APWZRJJASA-N 1 3 334.504 2.673 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC[C@@H](O)CC(C)(C)O ZINC000872201236 1287472969 /nfs/dbraw/zinc/47/29/69/1287472969.db2.gz UDHYWYUBKUMHHA-APWZRJJASA-N 1 3 334.504 2.673 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NCCC[NH+]2CCCCCC2)C1 ZINC000809947848 1282643760 /nfs/dbraw/zinc/64/37/60/1282643760.db2.gz NIUAXEOKVIUWGR-GOSISDBHSA-N 1 3 327.488 2.581 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC([NH+]3CCCCC3)CC2)C1 ZINC000810189291 1283024006 /nfs/dbraw/zinc/02/40/06/1283024006.db2.gz NXMAMSZGRBAPOT-LJQANCHMSA-N 1 3 339.499 2.676 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)c1 ZINC000810193758 1283027367 /nfs/dbraw/zinc/02/73/67/1283027367.db2.gz XHIAMVRUBZDMDF-FQEVSTJZSA-N 1 3 349.494 2.967 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)c1 ZINC000810193758 1283027376 /nfs/dbraw/zinc/02/73/76/1283027376.db2.gz XHIAMVRUBZDMDF-FQEVSTJZSA-N 1 3 349.494 2.967 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)C1 ZINC000810367996 1283158821 /nfs/dbraw/zinc/15/88/21/1283158821.db2.gz SNUTZAIJHYVPEF-LPHOPBHVSA-N 1 3 339.499 2.676 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)C1 ZINC000810367998 1283159136 /nfs/dbraw/zinc/15/91/36/1283159136.db2.gz SNUTZAIJHYVPEF-QFBILLFUSA-N 1 3 339.499 2.676 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NCCCCC[NH+]2CCCCC2)C1 ZINC000810381404 1283202777 /nfs/dbraw/zinc/20/27/77/1283202777.db2.gz NETNBSXIWRLKEK-IBGZPJMESA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CC[C@@H](C[NH+]3CCCCC3)C2)C1 ZINC000810443167 1283245703 /nfs/dbraw/zinc/24/57/03/1283245703.db2.gz LKNOLEUREHVOKX-LPHOPBHVSA-N 1 3 339.499 2.533 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NC2CC[NH+](C3CCCC3)CC2)C1 ZINC000810478903 1283275233 /nfs/dbraw/zinc/27/52/33/1283275233.db2.gz CVIPMRXPYNMJSI-LJQANCHMSA-N 1 3 339.499 2.722 10 0 EFAEHO CC[NH+]1CCC(N2CCCN(Cc3ccc(F)nc3C)CC2)CC1 ZINC000817413734 1288591535 /nfs/dbraw/zinc/59/15/35/1288591535.db2.gz CXKWYNXHDDPDMG-UHFFFAOYSA-N 1 3 334.483 2.521 10 0 EFAEHO CC(C)[C@H](CNC(=O)OC(C)(C)C)C[NH+]1CCC(N(C)C)CC1 ZINC000823404336 1289293640 /nfs/dbraw/zinc/29/36/40/1289293640.db2.gz PIKDOEMHSSSVTI-OAHLLOKOSA-N 1 3 327.513 2.809 10 0 EFAEHO c1ccc(CCN2CCC([NH2+]C[C@H]3Cc4ccccc4CN3)CC2)cc1 ZINC000873292605 1289707809 /nfs/dbraw/zinc/70/78/09/1289707809.db2.gz CAIUCNQBKUYURS-HSZRJFAPSA-N 1 3 349.522 2.998 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1C[C@@H](C)[C@H](CC[NH3+])C1)c1cc2ccccc2o1 ZINC000903496331 1312770612 /nfs/dbraw/zinc/77/06/12/1312770612.db2.gz KNEMZQRWIKNIIL-KCYZZUKISA-N 1 3 343.471 2.915 10 0 EFAEHO C[C@@H]1CN(CC(=O)N[C@@H](c2cccs2)C(C)(C)C)C[C@H]1CC[NH3+] ZINC000903496875 1312772926 /nfs/dbraw/zinc/77/29/26/1312772926.db2.gz IKHQOVWJMZOOLV-CPUCHLNUSA-N 1 3 337.533 2.868 10 0 EFAEHO C[C@@H]1CN(Cc2cc3c(c(Br)c2)OCO3)C[C@H]1CC[NH3+] ZINC000903496948 1312774073 /nfs/dbraw/zinc/77/40/73/1312774073.db2.gz KUMYQCFYCYPZGO-ZYHUDNBSSA-N 1 3 341.249 2.595 10 0 EFAEHO C[C@@H]1CN([C@@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)C[C@H]1CC[NH3+] ZINC000903498710 1312776486 /nfs/dbraw/zinc/77/64/86/1312776486.db2.gz BPDYMNFWVXJUHX-XHBSWPGZSA-N 1 3 339.842 2.501 10 0 EFAEHO Fc1cccc(F)c1CCCN1C[C@H]2CC[C@@H](C1)[N@H+]2C1CCNCC1 ZINC000903507187 1312786820 /nfs/dbraw/zinc/78/68/20/1312786820.db2.gz QKFZTNXUGYMUGO-CALCHBBNSA-N 1 3 349.469 2.798 10 0 EFAEHO Fc1cccc(F)c1CCCN1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CCNCC1 ZINC000903507187 1312786823 /nfs/dbraw/zinc/78/68/23/1312786823.db2.gz QKFZTNXUGYMUGO-CALCHBBNSA-N 1 3 349.469 2.798 10 0 EFAEHO CSc1ccc(CN2C[C@H]3CC[C@@H](C2)[N@H+]3C2CCNCC2)cc1 ZINC000903509886 1312791396 /nfs/dbraw/zinc/79/13/96/1312791396.db2.gz CQDMYZSCPZVYKE-HDICACEKSA-N 1 3 331.529 2.809 10 0 EFAEHO CSc1ccc(CN2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CCNCC2)cc1 ZINC000903509886 1312791399 /nfs/dbraw/zinc/79/13/99/1312791399.db2.gz CQDMYZSCPZVYKE-HDICACEKSA-N 1 3 331.529 2.809 10 0 EFAEHO CC/C=C(/C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CC2CC2)CC1 ZINC001273599498 1292123881 /nfs/dbraw/zinc/12/38/81/1292123881.db2.gz SBVIWKZZXGAASN-LXLHDPCUSA-N 1 3 345.531 2.892 10 0 EFAEHO CCc1ccccc1C[NH2+]CCN(CC)C(=O)CN1CC[C@H](C)C1 ZINC001273610836 1292379853 /nfs/dbraw/zinc/37/98/53/1292379853.db2.gz QTFRNZPEWWCPAX-KRWDZBQOSA-N 1 3 331.504 2.529 10 0 EFAEHO CCN(CC[NH2+]CC1CCC(C)CC1)C(=O)CN1CCC(C)CC1 ZINC001273674087 1293569970 /nfs/dbraw/zinc/56/99/70/1293569970.db2.gz PMOXRUDGTYVJFM-UHFFFAOYSA-N 1 3 337.552 2.983 10 0 EFAEHO O=C1CCCN1CCC[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000886491786 1294990429 /nfs/dbraw/zinc/99/04/29/1294990429.db2.gz ROJPOFGNEXABTG-UFYCRDLUSA-N 1 3 341.499 2.642 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C\CNCc2ccc(F)cc2C)CC[N@@H+]1C ZINC001274035262 1295433959 /nfs/dbraw/zinc/43/39/59/1295433959.db2.gz JOIYQUUZEDMYPP-ZYHOBAKYSA-N 1 3 347.478 2.626 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C\CNCc2ccc(F)cc2C)CC[N@H+]1C ZINC001274035262 1295433962 /nfs/dbraw/zinc/43/39/62/1295433962.db2.gz JOIYQUUZEDMYPP-ZYHOBAKYSA-N 1 3 347.478 2.626 10 0 EFAEHO CC[C@H](C(=O)NC/C=C\C[NH2+][C@@H](C)c1cc(C)ccc1C)N(C)C ZINC001274125940 1295483488 /nfs/dbraw/zinc/48/34/88/1295483488.db2.gz VXWDJRBKBKSGJU-CZXSNVBGSA-N 1 3 331.504 2.967 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]C/C=C\CNC(=O)[C@H]2CCCN2C)cc1 ZINC001274262201 1296047360 /nfs/dbraw/zinc/04/73/60/1296047360.db2.gz BGFAELDQBCIOAX-BBIZLLLXSA-N 1 3 343.515 2.741 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]C/C=C/c1ccc(Cl)cc1)N(C)C ZINC001275410495 1296270773 /nfs/dbraw/zinc/27/07/73/1296270773.db2.gz HGHXIVWBIQFKNV-PRDNVKDRSA-N 1 3 337.895 2.788 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(C2CC2)cc1)C(=O)[C@H]1CCCN1C ZINC001275915146 1296450582 /nfs/dbraw/zinc/45/05/82/1296450582.db2.gz KDLNFZIQGDFVDG-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO CSc1ccc([C@H](CNC(=O)[C@@H](C)CC[NH+](C)C)N(C)C)cc1 ZINC001413002660 1296606386 /nfs/dbraw/zinc/60/63/86/1296606386.db2.gz LIASEXDKQSLHBY-YOEHRIQHSA-N 1 3 337.533 2.715 10 0 EFAEHO CC[C@H]([NH2+][C@@H]1C[C@@H](N)C12CCC2)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000925627389 1296865851 /nfs/dbraw/zinc/86/58/51/1296865851.db2.gz XTMYHCXQSKHYKY-MANSERQUSA-N 1 3 339.487 2.814 10 0 EFAEHO COc1ccc([C@H]2CCCN2C[C@H](C[NH3+])Cc2cnn(C)c2C)cc1 ZINC000903873023 1313326400 /nfs/dbraw/zinc/32/64/00/1313326400.db2.gz DMGYRXSEMVDKHH-OXJNMPFZSA-N 1 3 342.487 2.692 10 0 EFAEHO COCCN(C[C@H](C[NH3+])Cc1cnn(C)c1C)[C@H](C)c1ccccc1 ZINC000903885552 1313348484 /nfs/dbraw/zinc/34/84/84/1313348484.db2.gz LMBHLSWCBCBPED-MSOLQXFVSA-N 1 3 344.503 2.556 10 0 EFAEHO CC[C@@H](Cc1ccccc1)N(C)Cc1cnnn1[C@@H]1CCC[NH2+]C1 ZINC000903894862 1313368089 /nfs/dbraw/zinc/36/80/89/1313368089.db2.gz GLBXZICUFDGTOQ-ZWKOTPCHSA-N 1 3 327.476 2.656 10 0 EFAEHO CC[C@H](Cc1ccc(C)cc1)N(C)Cc1cnnn1[C@@H]1CCC[NH2+]C1 ZINC000903898500 1313375731 /nfs/dbraw/zinc/37/57/31/1313375731.db2.gz NYZJPMRRSMBQRN-RTBURBONSA-N 1 3 341.503 2.964 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN2CCSC3(CCCCC3)C2)cnn1C ZINC000903900063 1313378122 /nfs/dbraw/zinc/37/81/22/1313378122.db2.gz ZLFLPLLRFJWEHV-INIZCTEOSA-N 1 3 336.549 2.598 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+](C)CC2(c3ccccc3)CC2)cnn1C ZINC000903909557 1313395454 /nfs/dbraw/zinc/39/54/54/1313395454.db2.gz FODADYNRVHRXOZ-QGZVFWFLSA-N 1 3 326.488 2.510 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+](C)CC2(c3ccccc3)CC2)cnn1C ZINC000903909557 1313395456 /nfs/dbraw/zinc/39/54/56/1313395456.db2.gz FODADYNRVHRXOZ-QGZVFWFLSA-N 1 3 326.488 2.510 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CCC[C@@]2(C)Cc2ccccc2)cnn1C ZINC000903914603 1313406737 /nfs/dbraw/zinc/40/67/37/1313406737.db2.gz JRTJNUNSOCVRNS-CTNGQTDRSA-N 1 3 340.515 2.943 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CCC[C@@]2(C)Cc2ccccc2)cnn1C ZINC000903914603 1313406740 /nfs/dbraw/zinc/40/67/40/1313406740.db2.gz JRTJNUNSOCVRNS-CTNGQTDRSA-N 1 3 340.515 2.943 10 0 EFAEHO Cc1c(C[C@H](CN)C[NH2+][C@H](Cc2ccc(F)cc2)C(C)C)cnn1C ZINC000903926473 1313428146 /nfs/dbraw/zinc/42/81/46/1313428146.db2.gz SMHNXJAHYIGVCD-YLJYHZDGSA-N 1 3 346.494 2.842 10 0 EFAEHO Cc1c(C[C@H](CN)C[NH2+][C@@H](Cc2ccc(F)cc2)C(C)C)cnn1C ZINC000903926472 1313428268 /nfs/dbraw/zinc/42/82/68/1313428268.db2.gz SMHNXJAHYIGVCD-XLIONFOSSA-N 1 3 346.494 2.842 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN[C@@H]2CCc3c2cccc3Cl)cnn1C ZINC000903926479 1313428317 /nfs/dbraw/zinc/42/83/17/1313428317.db2.gz SQIOYQWQYULWRQ-SCLBCKFNSA-N 1 3 332.879 2.776 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN[C@H]2CCSc3ccccc32)cnn1C ZINC000903927597 1313430004 /nfs/dbraw/zinc/43/00/04/1313430004.db2.gz ZWXGMDBKARVKCN-PBHICJAKSA-N 1 3 330.501 2.673 10 0 EFAEHO CSc1cc(C)ccc1CNC[C@H](C[NH3+])Cc1cnn(C)c1C ZINC000903922644 1313424039 /nfs/dbraw/zinc/42/40/39/1313424039.db2.gz BFMLWPACCZASOI-HNNXBMFYSA-N 1 3 332.517 2.666 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CNC2(c3ccccc3C)CCC2)cnn1C ZINC000903931792 1313438271 /nfs/dbraw/zinc/43/82/71/1313438271.db2.gz IESNMYODZUICIR-KRWDZBQOSA-N 1 3 326.488 2.823 10 0 EFAEHO C[NH+]1CCC(C(=O)NC[C@H]2CC[C@@H](NC/C(Cl)=C\Cl)C2)CC1 ZINC001488948840 1297894576 /nfs/dbraw/zinc/89/45/76/1297894576.db2.gz OZICRNKSBWCPOP-SWKXHUPFSA-N 1 3 348.318 2.522 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN[C@@H]2CCc3cc(Cl)ccc32)cnn1C ZINC000903934238 1313443064 /nfs/dbraw/zinc/44/30/64/1313443064.db2.gz FFMNTFVHONDEKN-FZKQIMNGSA-N 1 3 332.879 2.776 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN[C@H]2CCc3ccc(Cl)cc32)cnn1C ZINC000903933972 1313443104 /nfs/dbraw/zinc/44/31/04/1313443104.db2.gz CJQAWKIVDMKBIM-ACJLOTCBSA-N 1 3 332.879 2.776 10 0 EFAEHO COc1ccc(C(C)(C)NC[C@@H](C[NH3+])Cc2cnn(C)c2C)cc1F ZINC000903936192 1313447054 /nfs/dbraw/zinc/44/70/54/1313447054.db2.gz ZBMZLQKJVOQNCP-CQSZACIVSA-N 1 3 348.466 2.519 10 0 EFAEHO [NH3+][C@@H](CN[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12)CC(F)F ZINC000903936141 1313447060 /nfs/dbraw/zinc/44/70/60/1313447060.db2.gz YSIGPZIHUGXGQG-QEGRKFQGSA-N 1 3 331.204 2.659 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@H](NC(=O)C23CCCN2CCC3)[C@H]1CC ZINC001489123935 1298039117 /nfs/dbraw/zinc/03/91/17/1298039117.db2.gz LRDTVEJAWJKIDM-FDICQLOXSA-N 1 3 333.520 2.940 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@H](NC(=O)C23CCCN2CCC3)[C@H]1CC ZINC001489123935 1298039124 /nfs/dbraw/zinc/03/91/24/1298039124.db2.gz LRDTVEJAWJKIDM-FDICQLOXSA-N 1 3 333.520 2.940 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@H+](CC2CC(C)C2)CC(C)(C)C1 ZINC001489349136 1298205745 /nfs/dbraw/zinc/20/57/45/1298205745.db2.gz DCGYKOXKKVWTDB-ABHNRTSZSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@@H+](CC2CC(C)C2)CC(C)(C)C1 ZINC001489349136 1298205754 /nfs/dbraw/zinc/20/57/54/1298205754.db2.gz DCGYKOXKKVWTDB-ABHNRTSZSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCOc1cc(C[NH2+]C[C@H]2CNCCC2(F)F)ccc1OC ZINC000903955064 1313480761 /nfs/dbraw/zinc/48/07/61/1313480761.db2.gz JVUMOBPUZUCDGG-CQSZACIVSA-N 1 3 328.403 2.818 10 0 EFAEHO FC1(F)CCNC[C@H]1C[NH2+]Cc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000903955312 1313482534 /nfs/dbraw/zinc/48/25/34/1313482534.db2.gz OWVOEFBMWUIKAW-RDJZCZTQSA-N 1 3 340.414 2.579 10 0 EFAEHO C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)NC[C@@H]1C[NH2+]C[C@H]1C ZINC000903968351 1313512512 /nfs/dbraw/zinc/51/25/12/1313512512.db2.gz UEAHOUWJRCVAGP-AGIUHOORSA-N 1 3 343.393 2.868 10 0 EFAEHO CN(CC(=O)NCCC[N@H+](C)[C@H]1CCc2c1cccc2F)C1CCC1 ZINC001490207214 1298598474 /nfs/dbraw/zinc/59/84/74/1298598474.db2.gz BGIOACJMJGEXTQ-IBGZPJMESA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CC(=O)NCCC[N@@H+](C)[C@H]1CCc2c1cccc2F)C1CCC1 ZINC001490207214 1298598483 /nfs/dbraw/zinc/59/84/83/1298598483.db2.gz BGIOACJMJGEXTQ-IBGZPJMESA-N 1 3 347.478 2.735 10 0 EFAEHO Fc1ccc(/C=C/CN2C[C@H]3CC[C@@H](C2)[N@H+]3C2CCNCC2)cc1 ZINC000903980704 1313531295 /nfs/dbraw/zinc/53/12/95/1313531295.db2.gz YBMCDCXBMPZSDM-FWDLARJDSA-N 1 3 329.463 2.740 10 0 EFAEHO Fc1ccc(/C=C/CN2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CCNCC2)cc1 ZINC000903980704 1313531299 /nfs/dbraw/zinc/53/12/99/1313531299.db2.gz YBMCDCXBMPZSDM-FWDLARJDSA-N 1 3 329.463 2.740 10 0 EFAEHO Cc1ccc(CN(C)CCCNC(=O)C[NH+]2[C@@H](C)CC[C@@H]2C)c(C)n1 ZINC001490280964 1298705132 /nfs/dbraw/zinc/70/51/32/1298705132.db2.gz CKLMXQVBKSCMGC-IRXDYDNUSA-N 1 3 346.519 2.509 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC001490348967 1298742342 /nfs/dbraw/zinc/74/23/42/1298742342.db2.gz LSCSCTFIJKUSEN-XAVKZTDYSA-N 1 3 329.916 2.832 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@H](C)[NH+]1CCCCCC1 ZINC001490348965 1298743287 /nfs/dbraw/zinc/74/32/87/1298743287.db2.gz LSCSCTFIJKUSEN-DZZUKKPASA-N 1 3 329.916 2.832 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN(C)C(C)C)[C@H]1CCc2ccccc21 ZINC001490360287 1298843236 /nfs/dbraw/zinc/84/32/36/1298843236.db2.gz AQGHFYPBHVTRIE-IBGZPJMESA-N 1 3 331.504 2.842 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN(C)C(C)C)[C@H]1CCc2ccccc21 ZINC001490360287 1298843245 /nfs/dbraw/zinc/84/32/45/1298843245.db2.gz AQGHFYPBHVTRIE-IBGZPJMESA-N 1 3 331.504 2.842 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CC1=CCCCC1)C1CC1 ZINC001490660096 1299101085 /nfs/dbraw/zinc/10/10/85/1299101085.db2.gz DSPKELFMPQJZOW-RBUKOAKNSA-N 1 3 333.520 2.844 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](CNC(=O)[C@@H]2CCCN2C(C)C)C2CC2)c1 ZINC001490661527 1299103869 /nfs/dbraw/zinc/10/38/69/1299103869.db2.gz OENMNPAOPFNHHO-PMACEKPBSA-N 1 3 343.515 2.852 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]([NH2+]CCc1cccs1)C1CC1 ZINC001490662047 1299105463 /nfs/dbraw/zinc/10/54/63/1299105463.db2.gz QHEZQIKCZVNLKG-ROUUACIJSA-N 1 3 349.544 2.648 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@H]([NH2+]CCC(F)(F)F)C1CC1 ZINC001490718376 1299126919 /nfs/dbraw/zinc/12/69/19/1299126919.db2.gz SHXLHXWBRHFORN-HUUCEWRRSA-N 1 3 349.441 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+]CC1CCC2(CC2)CC1)C1CC1 ZINC001490741173 1299179258 /nfs/dbraw/zinc/17/92/58/1299179258.db2.gz HTXROOJMEBSEMX-SFHVURJKSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@H+](C)Cc2ccc(F)cc2)C1 ZINC001490776073 1299237669 /nfs/dbraw/zinc/23/76/69/1299237669.db2.gz GDHAFWDIGZARMK-GOSISDBHSA-N 1 3 349.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@@H+](C)Cc2ccc(F)cc2)C1 ZINC001490776073 1299237677 /nfs/dbraw/zinc/23/76/77/1299237677.db2.gz GDHAFWDIGZARMK-GOSISDBHSA-N 1 3 349.494 2.836 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCC[C@@H](C[N@H+](C)CCCF)C1 ZINC001490776791 1299240955 /nfs/dbraw/zinc/24/09/55/1299240955.db2.gz RVARGUUPMPUTEN-ZWKOTPCHSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCC[C@@H](C[N@@H+](C)CCCF)C1 ZINC001490776791 1299240962 /nfs/dbraw/zinc/24/09/62/1299240962.db2.gz RVARGUUPMPUTEN-ZWKOTPCHSA-N 1 3 341.515 2.779 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@H](C[N@H+](C)CCC2CC2)C1 ZINC001490781851 1299251510 /nfs/dbraw/zinc/25/15/10/1299251510.db2.gz ATSAEAQZZKFQJH-MOPGFXCFSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@H](C[N@@H+](C)CCC2CC2)C1 ZINC001490781851 1299251520 /nfs/dbraw/zinc/25/15/20/1299251520.db2.gz ATSAEAQZZKFQJH-MOPGFXCFSA-N 1 3 335.536 2.831 10 0 EFAEHO Cc1ccc(N2CC[C@H](N3CCC[C@H](C4CC[NH2+]CC4)C3)C2=O)cc1 ZINC000852754239 1299863947 /nfs/dbraw/zinc/86/39/47/1299863947.db2.gz QQJFRMUTWDBIDX-ICSRJNTNSA-N 1 3 341.499 2.812 10 0 EFAEHO CN1CCCC(C)(C)[C@@H]1CNC(=O)[C@H]1CC[N@H+](C)[C@H]1c1ccccc1 ZINC001412834425 1300302407 /nfs/dbraw/zinc/30/24/07/1300302407.db2.gz FISYOSCSNUHAQV-FHWLQOOXSA-N 1 3 343.515 2.916 10 0 EFAEHO CN1CCCC(C)(C)[C@@H]1CNC(=O)[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1 ZINC001412834425 1300302424 /nfs/dbraw/zinc/30/24/24/1300302424.db2.gz FISYOSCSNUHAQV-FHWLQOOXSA-N 1 3 343.515 2.916 10 0 EFAEHO C[S@](=O)CC[N@@H+]1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000854044308 1300403933 /nfs/dbraw/zinc/40/39/33/1300403933.db2.gz FUYLAOORDKQCJZ-DVECYGJZSA-N 1 3 348.556 2.988 10 0 EFAEHO C[S@](=O)CC[N@H+]1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000854044308 1300403938 /nfs/dbraw/zinc/40/39/38/1300403938.db2.gz FUYLAOORDKQCJZ-DVECYGJZSA-N 1 3 348.556 2.988 10 0 EFAEHO COc1ccc([C@@H](C)NCC[C@@H]([NH3+])C(C)C)cc1Cn1cccn1 ZINC000854230810 1300480349 /nfs/dbraw/zinc/48/03/49/1300480349.db2.gz ZFPCDAUEWOSSKD-CRAIPNDOSA-N 1 3 330.476 2.964 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)/C=C\Sc1ccccc1 ZINC000855346085 1300924832 /nfs/dbraw/zinc/92/48/32/1300924832.db2.gz NUXDKISBMZGYIG-QBOMHBFWSA-N 1 3 335.517 2.681 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)/C=C\Sc1ccccc1 ZINC000855346085 1300924834 /nfs/dbraw/zinc/92/48/34/1300924834.db2.gz NUXDKISBMZGYIG-QBOMHBFWSA-N 1 3 335.517 2.681 10 0 EFAEHO C/C(=C/c1ccc(F)cc1)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000855345546 1300925042 /nfs/dbraw/zinc/92/50/42/1300925042.db2.gz CRCDYHMAYJJFQW-KGAUPUERSA-N 1 3 335.467 2.617 10 0 EFAEHO C/C(=C/c1ccc(F)cc1)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000855345546 1300925049 /nfs/dbraw/zinc/92/50/49/1300925049.db2.gz CRCDYHMAYJJFQW-KGAUPUERSA-N 1 3 335.467 2.617 10 0 EFAEHO Cc1c(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cnc2ccccc12 ZINC000855345432 1300925348 /nfs/dbraw/zinc/92/53/48/1300925348.db2.gz AELZTQWYPUFKEY-HNNXBMFYSA-N 1 3 342.487 2.545 10 0 EFAEHO Cc1c(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cnc2ccccc12 ZINC000855345432 1300925355 /nfs/dbraw/zinc/92/53/55/1300925355.db2.gz AELZTQWYPUFKEY-HNNXBMFYSA-N 1 3 342.487 2.545 10 0 EFAEHO CC(C)(C(=O)N[C@H](C[NH2+]CCCF)C1CCCC1)N1CCCCC1 ZINC001278241839 1313832305 /nfs/dbraw/zinc/83/23/05/1313832305.db2.gz SAZWMHOUNJRFCN-QGZVFWFLSA-N 1 3 341.515 2.875 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1CCC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001402693597 1363942345 /nfs/dbraw/zinc/94/23/45/1363942345.db2.gz XJVFRBBMVLXMBB-ZWKOTPCHSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1CCC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001402693597 1363942351 /nfs/dbraw/zinc/94/23/51/1363942351.db2.gz XJVFRBBMVLXMBB-ZWKOTPCHSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@@H]1CC[C@H](N[C@H]2CCCN(C(=O)Oc3ccccc3)CC2)C[NH2+]1 ZINC000863544889 1302645150 /nfs/dbraw/zinc/64/51/50/1302645150.db2.gz DPWLIEZBADROEJ-IKGGRYGDSA-N 1 3 331.460 2.770 10 0 EFAEHO C[C@@H]1CC[C@@H](NCC2CCN(C(=O)OCc3ccccc3)CC2)C[NH2+]1 ZINC000863649268 1302668692 /nfs/dbraw/zinc/66/86/92/1302668692.db2.gz BFIVRNFFPRPWEO-VQIMIIECSA-N 1 3 345.487 2.765 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+]C/C=C\Cl)C1CCCC1)CC(C)(C)C ZINC001278275383 1313863612 /nfs/dbraw/zinc/86/36/12/1313863612.db2.gz PDZNMDALCPUBDD-BJIFSAINSA-N 1 3 343.943 2.981 10 0 EFAEHO CCC[NH2+]C[C@@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CCCC1 ZINC001278276897 1313864715 /nfs/dbraw/zinc/86/47/15/1313864715.db2.gz ZCYPFQGHDVXVEN-APWZRJJASA-N 1 3 341.515 2.874 10 0 EFAEHO CC[NH+]1CCC(CNCc2cnc(NC(=O)OC(C)(C)C)cn2)CC1 ZINC000865451395 1303263139 /nfs/dbraw/zinc/26/31/39/1303263139.db2.gz MBYFYYNZFQMOHC-UHFFFAOYSA-N 1 3 349.479 2.645 10 0 EFAEHO CC(C)(C)[C@]1(CN)CC[N@H+](CCC(=O)N2CCc3ccccc32)C1 ZINC000866702649 1303756257 /nfs/dbraw/zinc/75/62/57/1303756257.db2.gz DFAIMNALFXQIIU-FQEVSTJZSA-N 1 3 329.488 2.663 10 0 EFAEHO CC(C)(C)[C@]1(CN)CC[N@@H+](CCC(=O)N2CCc3ccccc32)C1 ZINC000866702649 1303756263 /nfs/dbraw/zinc/75/62/63/1303756263.db2.gz DFAIMNALFXQIIU-FQEVSTJZSA-N 1 3 329.488 2.663 10 0 EFAEHO COc1cccc(NC(=O)CC[N@@H+]2CC[C@](CN)(C(C)(C)C)C2)c1 ZINC000866705538 1303760835 /nfs/dbraw/zinc/76/08/35/1303760835.db2.gz BYCBGMWDWRWBCC-LJQANCHMSA-N 1 3 333.476 2.721 10 0 EFAEHO COc1cccc(NC(=O)CC[N@H+]2CC[C@](CN)(C(C)(C)C)C2)c1 ZINC000866705538 1303760840 /nfs/dbraw/zinc/76/08/40/1303760840.db2.gz BYCBGMWDWRWBCC-LJQANCHMSA-N 1 3 333.476 2.721 10 0 EFAEHO CCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001490802317 1303941538 /nfs/dbraw/zinc/94/15/38/1303941538.db2.gz WWRSQJKIYVTGDC-CADBVGFASA-N 1 3 335.536 2.972 10 0 EFAEHO CCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001490802317 1303941545 /nfs/dbraw/zinc/94/15/45/1303941545.db2.gz WWRSQJKIYVTGDC-CADBVGFASA-N 1 3 335.536 2.972 10 0 EFAEHO CCCCCC[N@@H+]1C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001276607554 1314068337 /nfs/dbraw/zinc/06/83/37/1314068337.db2.gz LPZZKDFYNNPNBS-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CCCCCC[N@H+]1C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001276607554 1314068340 /nfs/dbraw/zinc/06/83/40/1314068340.db2.gz LPZZKDFYNNPNBS-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO C[NH+](C)C1(C)CCC(NC(=O)C2C[C@H](c3ccccc3)OC2=O)CC1 ZINC000871360567 1306020555 /nfs/dbraw/zinc/02/05/55/1306020555.db2.gz GPKWKEXLIFKQRH-ZEVUXNIQSA-N 1 3 344.455 2.670 10 0 EFAEHO O=C(NCCCN1CCc2ccccc2C1)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC000900160296 1307727589 /nfs/dbraw/zinc/72/75/89/1307727589.db2.gz UACXJEPQHCDHSE-WOJBJXKFSA-N 1 3 341.499 2.568 10 0 EFAEHO O=C(NCCCN1CCc2ccccc2C1)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC000900160296 1307727594 /nfs/dbraw/zinc/72/75/94/1307727594.db2.gz UACXJEPQHCDHSE-WOJBJXKFSA-N 1 3 341.499 2.568 10 0 EFAEHO O=C(NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(NC2=NCCC2)cc1 ZINC000900306833 1307929914 /nfs/dbraw/zinc/92/99/14/1307929914.db2.gz BEBMAXZPOOZMSM-AWEZNQCLSA-N 1 3 326.444 2.505 10 0 EFAEHO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(NC2=NCCC2)cc1 ZINC000900306833 1307929918 /nfs/dbraw/zinc/92/99/18/1307929918.db2.gz BEBMAXZPOOZMSM-AWEZNQCLSA-N 1 3 326.444 2.505 10 0 EFAEHO CC1CCN([C@H](CNC(=O)C23CC[NH+](CC2)C3)c2ccccc2)CC1 ZINC000900320587 1307964745 /nfs/dbraw/zinc/96/47/45/1307964745.db2.gz HDRSPSVVIHYJQE-LJQANCHMSA-N 1 3 341.499 2.672 10 0 EFAEHO CC[NH+]1CCC(N(C)C(=O)c2ccc(NC3=NCCC3)cc2)CC1 ZINC000900516340 1308244384 /nfs/dbraw/zinc/24/43/84/1308244384.db2.gz BBPJUYDTBOITSE-UHFFFAOYSA-N 1 3 328.460 2.847 10 0 EFAEHO O=C(c1ccc(NC2=NCCC2)cc1)N1CC[C@@H]([NH+]2CCCC2)C1 ZINC000900519410 1308250331 /nfs/dbraw/zinc/25/03/31/1308250331.db2.gz JNAKZCUDNWHOLF-QGZVFWFLSA-N 1 3 326.444 2.601 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C[N@@H+]1C1CC1 ZINC000900994086 1309131673 /nfs/dbraw/zinc/13/16/73/1309131673.db2.gz FVUGFXZJXFGZNT-BBRMVZONSA-N 1 3 326.444 2.646 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C[N@H+]1C1CC1 ZINC000900994086 1309131675 /nfs/dbraw/zinc/13/16/75/1309131675.db2.gz FVUGFXZJXFGZNT-BBRMVZONSA-N 1 3 326.444 2.646 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@H](F)CC1CCCCC1 ZINC001413265860 1309157996 /nfs/dbraw/zinc/15/79/96/1309157996.db2.gz DJXDKCRRKSCEEK-DOTOQJQBSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@H](F)CC1CCCCC1 ZINC001413265860 1309158003 /nfs/dbraw/zinc/15/80/03/1309158003.db2.gz DJXDKCRRKSCEEK-DOTOQJQBSA-N 1 3 329.504 2.683 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1C[C@@H](NCc2ccc(Cl)cc2Cl)C1 ZINC001491050853 1311155753 /nfs/dbraw/zinc/15/57/53/1311155753.db2.gz OMNLCTNHLISTET-OKILXGFUSA-N 1 3 344.286 2.682 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)NCc1ccc(Cl)s1 ZINC001491487086 1311192454 /nfs/dbraw/zinc/19/24/54/1311192454.db2.gz UHTQLRYARMEMQJ-QWHCGFSZSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)NCc1ccc(Cl)s1 ZINC001491487086 1311192459 /nfs/dbraw/zinc/19/24/59/1311192459.db2.gz UHTQLRYARMEMQJ-QWHCGFSZSA-N 1 3 343.924 2.870 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001491487041 1311192663 /nfs/dbraw/zinc/19/26/63/1311192663.db2.gz TUVFDDJOHATLOU-WBVHZDCISA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001491487041 1311192664 /nfs/dbraw/zinc/19/26/64/1311192664.db2.gz TUVFDDJOHATLOU-WBVHZDCISA-N 1 3 335.467 2.603 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@H]2C[C@H](C[NH2+]C/C=C/c3ccccc3)C2)C1 ZINC001277046222 1311527565 /nfs/dbraw/zinc/52/75/65/1311527565.db2.gz KHGJJZGRWHMRFT-SBGOFHNDSA-N 1 3 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CC[C@@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1Cc1ccccc1)N(C)C ZINC001266240889 1317189187 /nfs/dbraw/zinc/18/91/87/1317189187.db2.gz FPKRBFASXJNBPV-MOPGFXCFSA-N 1 3 331.504 2.888 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@@H]1CCC[N@H+]1Cc1ccccc1)N(C)C ZINC001266240889 1317189189 /nfs/dbraw/zinc/18/91/89/1317189189.db2.gz FPKRBFASXJNBPV-MOPGFXCFSA-N 1 3 331.504 2.888 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@H]1CCC[N@@H+]1Cc1cccnc1)N(C)C ZINC001266241016 1317190532 /nfs/dbraw/zinc/19/05/32/1317190532.db2.gz IPENUEZIKYCTRT-OALUTQOASA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@H]1CCC[N@H+]1Cc1cccnc1)N(C)C ZINC001266241016 1317190538 /nfs/dbraw/zinc/19/05/38/1317190538.db2.gz IPENUEZIKYCTRT-OALUTQOASA-N 1 3 346.519 2.529 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+]([C@H]2CCc3ccccc32)CC1)N(C)C ZINC001279582162 1317311550 /nfs/dbraw/zinc/31/15/50/1317311550.db2.gz LPGGHERYEBDDNG-UXHICEINSA-N 1 3 341.499 2.762 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+]([C@H]2CCc3ccccc32)CC1)N(C)C ZINC001279582162 1317311561 /nfs/dbraw/zinc/31/15/61/1317311561.db2.gz LPGGHERYEBDDNG-UXHICEINSA-N 1 3 341.499 2.762 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]CC2CCCCCC2)C1 ZINC001280153080 1317466032 /nfs/dbraw/zinc/46/60/32/1317466032.db2.gz PONKFUUGTBXLLY-RTBURBONSA-N 1 3 335.536 2.879 10 0 EFAEHO CC1CC(C[NH2+]CC[C@H]2CCCN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001318802614 1328704747 /nfs/dbraw/zinc/70/47/47/1328704747.db2.gz AQGHPNKTETUYIH-LXPRWKDFSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)CCC[NH2+]CC[C@H]1CCCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001318830468 1328713875 /nfs/dbraw/zinc/71/38/75/1328713875.db2.gz GMFZYMKVOFDQGX-RTBURBONSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)CCC[NH2+]CC[C@@H]1CCCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001318830465 1328714462 /nfs/dbraw/zinc/71/44/62/1328714462.db2.gz GMFZYMKVOFDQGX-MOPGFXCFSA-N 1 3 337.552 2.983 10 0 EFAEHO CCC/C=C\CCN1CC[C@H]1CN(C)C(=O)CC1CC[NH+](C)CC1 ZINC001316605471 1317714284 /nfs/dbraw/zinc/71/42/84/1317714284.db2.gz XRXCZVJAMIIXMT-RURPWVQCSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CCN1CC[C@H]1CN(C)C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001316606236 1317803789 /nfs/dbraw/zinc/80/37/89/1317803789.db2.gz NFSIJSDJZXPFRF-QHWWWDCYSA-N 1 3 335.536 2.996 10 0 EFAEHO CCC/C=C\CCN1CC[C@H]1CN(C)C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001316606236 1317803798 /nfs/dbraw/zinc/80/37/98/1317803798.db2.gz NFSIJSDJZXPFRF-QHWWWDCYSA-N 1 3 335.536 2.996 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001281088441 1318011044 /nfs/dbraw/zinc/01/10/44/1318011044.db2.gz RTRJOQLQKLNWBV-ZRHASKPBSA-N 1 3 330.476 2.623 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001281088441 1318011052 /nfs/dbraw/zinc/01/10/52/1318011052.db2.gz RTRJOQLQKLNWBV-ZRHASKPBSA-N 1 3 330.476 2.623 10 0 EFAEHO CC1CCN(CC(=O)N2CCC(CC[NH2+]C/C=C/Cl)CC2)CC1 ZINC001318926021 1328742527 /nfs/dbraw/zinc/74/25/27/1328742527.db2.gz GTNKBOODRFFICG-KRXBUXKQSA-N 1 3 341.927 2.689 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001282013695 1318664174 /nfs/dbraw/zinc/66/41/74/1318664174.db2.gz IYTCZAVQTBJFGA-WOMUIKKVSA-N 1 3 329.488 2.524 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC2(C1)CCN(C(=O)CN1CC[C@H](C)C1)CC2 ZINC001319145112 1328791275 /nfs/dbraw/zinc/79/12/75/1328791275.db2.gz OFZSOHWDZSZZFB-PXPVJAHISA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC2(C1)CCN(C(=O)CN1CC[C@H](C)C1)CC2 ZINC001319145112 1328791279 /nfs/dbraw/zinc/79/12/79/1328791279.db2.gz OFZSOHWDZSZZFB-PXPVJAHISA-N 1 3 347.547 2.999 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC2(C1)CCC[N@H+](CCCCCF)C2)N(C)C ZINC001282964566 1319221747 /nfs/dbraw/zinc/22/17/47/1319221747.db2.gz IQXFLDCNVQEQGW-KRWDZBQOSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC2(C1)CCC[N@@H+](CCCCCF)C2)N(C)C ZINC001282964566 1319221758 /nfs/dbraw/zinc/22/17/58/1319221758.db2.gz IQXFLDCNVQEQGW-KRWDZBQOSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CCC2CCCC2)C1 ZINC001283042371 1319281137 /nfs/dbraw/zinc/28/11/37/1319281137.db2.gz WVQORMQRZSNMAQ-FHWLQOOXSA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1C[C@H](C[NH2+]CCC2CCCCC2)C1 ZINC001283102645 1319328582 /nfs/dbraw/zinc/32/85/82/1319328582.db2.gz AJLQUBACFZOCTC-QAQDUYKDSA-N 1 3 332.492 2.715 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1C[C@H](C[NH2+]CCc2cccs2)C1 ZINC001283110824 1319336412 /nfs/dbraw/zinc/33/64/12/1319336412.db2.gz IZSIMKCGQVTMJK-QBPKDAKJSA-N 1 3 349.544 2.648 10 0 EFAEHO C[C@H](CCC[NH2+]CC1CCC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001283239769 1319455316 /nfs/dbraw/zinc/45/53/16/1319455316.db2.gz OPHRRPNIDFMTDK-DNVCBOLYSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001283681155 1319954030 /nfs/dbraw/zinc/95/40/30/1319954030.db2.gz WPVLXSFQSFJOPE-OALUTQOASA-N 1 3 345.531 2.706 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@@]12CCC[C@@H]1N(CCC(F)(F)F)CC2 ZINC001284068274 1320176873 /nfs/dbraw/zinc/17/68/73/1320176873.db2.gz DXQHEKPYBNURRD-GOEBONIOSA-N 1 3 349.441 2.784 10 0 EFAEHO C[C@H]1[C@H](NC(=O)C(C)(C)N2CCCC2)CCC[N@@H+]1CCCCCF ZINC001284130961 1320220808 /nfs/dbraw/zinc/22/08/08/1320220808.db2.gz OIDJWDBVDFTOJT-DLBZAZTESA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H]1[C@H](NC(=O)C(C)(C)N2CCCC2)CCC[N@H+]1CCCCCF ZINC001284130961 1320220813 /nfs/dbraw/zinc/22/08/13/1320220813.db2.gz OIDJWDBVDFTOJT-DLBZAZTESA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]CCc2ccccc2F)C1 ZINC001284242557 1320282935 /nfs/dbraw/zinc/28/29/35/1320282935.db2.gz FENQNYFEHVSSJZ-WMZOPIPTSA-N 1 3 349.494 2.583 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@H]([NH2+]CCCc2ccccc2)C(C)(C)C1)N(C)C ZINC001284323605 1320319343 /nfs/dbraw/zinc/31/93/43/1320319343.db2.gz NQECUEPKKMPBGB-OALUTQOASA-N 1 3 345.531 2.786 10 0 EFAEHO CCCCC[NH2+][C@@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001284322814 1320319880 /nfs/dbraw/zinc/31/98/80/1320319880.db2.gz JLVONXUYPYFODB-MRXNPFEDSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)N1C[C@@H]([NH2+]CCCC2CCC2)C(C)(C)C1)N(C)C ZINC001284347374 1320329722 /nfs/dbraw/zinc/32/97/22/1320329722.db2.gz MUIIDBAWDGVHKF-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)(C)[C@@H](C[NH2+]C/C=C\Cl)NC(=O)C(C)(C)N1CCCC1 ZINC001284613263 1320439637 /nfs/dbraw/zinc/43/96/37/1320439637.db2.gz CSCAVSWKIBTQSD-QIAWRQBBSA-N 1 3 329.916 2.734 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]CCCc2cccc(F)c2)C1)N(C)C ZINC001284774623 1320519878 /nfs/dbraw/zinc/51/98/78/1320519878.db2.gz YOUOULSNVNJCHJ-CTWPCTMYSA-N 1 3 349.494 2.678 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]CCc1ccc(C)cc1 ZINC001319594052 1328924099 /nfs/dbraw/zinc/92/40/99/1328924099.db2.gz RCJWNUIBGNDYDM-UYAOXDASSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]CC1=CCCCC1)NC(=O)CN1CC[C@H](C)C1 ZINC001319635730 1328935082 /nfs/dbraw/zinc/93/50/82/1328935082.db2.gz YYWDPCJZLCXKIY-HKUYNNGSSA-N 1 3 335.536 2.949 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+]C/C=C/Cl)C2CCCCC2)CCC1 ZINC001319654440 1328939997 /nfs/dbraw/zinc/93/99/97/1328939997.db2.gz FSOKPJWPSMUTRY-NYUWMOHMSA-N 1 3 341.927 2.878 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+]CCF)C1CCCCC1)CC(C)(C)C ZINC001319659148 1328941557 /nfs/dbraw/zinc/94/15/57/1328941557.db2.gz HOOKVQNXEBHXDX-MRXNPFEDSA-N 1 3 329.504 2.589 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]CC1=CCCCC1 ZINC001319769004 1328982912 /nfs/dbraw/zinc/98/29/12/1328982912.db2.gz JNKKTTMHGPUXRY-RTBURBONSA-N 1 3 333.520 2.942 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@@H]1CC[NH2+]CCc1ccccc1)N(C)C ZINC001319787634 1328989243 /nfs/dbraw/zinc/98/92/43/1328989243.db2.gz HDPZMHUGTWOJAF-WOJBJXKFSA-N 1 3 345.531 2.930 10 0 EFAEHO CCCC[NH2+]C[C@H]1[C@H](C)CCCN1C(=O)CN(C)CC(C)(C)C ZINC001319862289 1329018800 /nfs/dbraw/zinc/01/88/00/1329018800.db2.gz UYTQVSZGZCHSMC-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@H]21 ZINC001320105260 1329081460 /nfs/dbraw/zinc/08/14/60/1329081460.db2.gz XSNQHLWKFRXFIL-IEBWSBKVSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCCCC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@H]21 ZINC001320105260 1329081461 /nfs/dbraw/zinc/08/14/61/1329081461.db2.gz XSNQHLWKFRXFIL-IEBWSBKVSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cccc(C(F)F)c1 ZINC001491579838 1323720593 /nfs/dbraw/zinc/72/05/93/1323720593.db2.gz PBBATWGCGFFSER-KGLIPLIRSA-N 1 3 339.430 2.560 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cccc(C(F)F)c1 ZINC001491579840 1323721351 /nfs/dbraw/zinc/72/13/51/1323721351.db2.gz PBBATWGCGFFSER-ZIAGYGMSSA-N 1 3 339.430 2.560 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H]([NH2+]CCCc2cccc(F)c2)C1)N(C)C ZINC001491765409 1323873472 /nfs/dbraw/zinc/87/34/72/1323873472.db2.gz CIHVUOSFUGOEFR-OALUTQOASA-N 1 3 349.494 2.535 10 0 EFAEHO CC[C@H]([NH2+]C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1)c1ccccc1 ZINC001491855985 1323950676 /nfs/dbraw/zinc/95/06/76/1323950676.db2.gz MYSJLJOXQLJKFG-HKUYNNGSSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+][C@@H](C)c2ccccc2F)C1 ZINC001491857381 1323952790 /nfs/dbraw/zinc/95/27/90/1323952790.db2.gz ZPPJMEKCDZPIHL-HOTGVXAUSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+][C@H](C)c2ccccc2F)C1 ZINC001491857380 1323953115 /nfs/dbraw/zinc/95/31/15/1323953115.db2.gz ZPPJMEKCDZPIHL-CVEARBPZSA-N 1 3 335.467 2.665 10 0 EFAEHO CN(C/C=C\c1ccccc1)[C@H]1CCCN(C(=O)CC[NH+](C)C)C1 ZINC001491946160 1324061863 /nfs/dbraw/zinc/06/18/63/1324061863.db2.gz APEVLEDRYWEJOA-ABMFHFBKSA-N 1 3 329.488 2.574 10 0 EFAEHO C[C@@H](CC[NH2+]CC1CCC(F)(F)CC1)NC(=O)C1(N(C)C)CCC1 ZINC001320446062 1329133564 /nfs/dbraw/zinc/13/35/64/1329133564.db2.gz LHQAXNFFTUZEQH-AWEZNQCLSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@H](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]Cc1ccccc1 ZINC001492084662 1324245920 /nfs/dbraw/zinc/24/59/20/1324245920.db2.gz CCOIGSYVFHUAKU-OXQOHEQNSA-N 1 3 349.494 2.884 10 0 EFAEHO CN(CC(=O)NCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)CC(C)(C)C ZINC001492423180 1324500929 /nfs/dbraw/zinc/50/09/29/1324500929.db2.gz MUADXKABBYIQNN-OAHLLOKOSA-N 1 3 347.494 2.838 10 0 EFAEHO CN(CC(=O)NCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)CC(C)(C)C ZINC001492423180 1324500935 /nfs/dbraw/zinc/50/09/35/1324500935.db2.gz MUADXKABBYIQNN-OAHLLOKOSA-N 1 3 347.494 2.838 10 0 EFAEHO CC/C=C/CC[N@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001492423230 1324501504 /nfs/dbraw/zinc/50/15/04/1324501504.db2.gz NMAVLZSHFZWJQW-DVBCCOPCSA-N 1 3 327.488 2.603 10 0 EFAEHO CC/C=C/CC[N@@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001492423230 1324501510 /nfs/dbraw/zinc/50/15/10/1324501510.db2.gz NMAVLZSHFZWJQW-DVBCCOPCSA-N 1 3 327.488 2.603 10 0 EFAEHO CC[N@@H+]1C[C@@H](NC(=O)c2ccc(Nc3ccncc3)cc2)C(C)(C)C1 ZINC001304042021 1324633882 /nfs/dbraw/zinc/63/38/82/1324633882.db2.gz CCEAIPHSGFBHJG-GOSISDBHSA-N 1 3 338.455 2.707 10 0 EFAEHO CC[N@H+]1C[C@@H](NC(=O)c2ccc(Nc3ccncc3)cc2)C(C)(C)C1 ZINC001304042021 1324633885 /nfs/dbraw/zinc/63/38/85/1324633885.db2.gz CCEAIPHSGFBHJG-GOSISDBHSA-N 1 3 338.455 2.707 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@@H]([N@H+](C)CCCCCF)C2)CCC1 ZINC001317374899 1324669219 /nfs/dbraw/zinc/66/92/19/1324669219.db2.gz HDEJESKRFZZBEM-MRXNPFEDSA-N 1 3 327.488 2.533 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@@H]([N@@H+](C)CCCCCF)C2)CCC1 ZINC001317374899 1324669228 /nfs/dbraw/zinc/66/92/28/1324669228.db2.gz HDEJESKRFZZBEM-MRXNPFEDSA-N 1 3 327.488 2.533 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H](C)NC(=O)[C@H](C(C)C)N(C)C)cc1F ZINC001320615736 1329178910 /nfs/dbraw/zinc/17/89/10/1329178910.db2.gz VODIJCVNUFPHPO-YJBOKZPZSA-N 1 3 337.483 2.705 10 0 EFAEHO C[C@@H]1CCN(C(=O)Cc2c[nH]cn2)[C@H](C[NH2+]CCCC(C)(C)C)C1 ZINC001316704341 1325047511 /nfs/dbraw/zinc/04/75/11/1325047511.db2.gz UBVQHQAVTQKHQR-WBVHZDCISA-N 1 3 334.508 2.995 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CCCC[NH+](C)C)CCN1CCc1ccccc1F ZINC001316796940 1325144634 /nfs/dbraw/zinc/14/46/34/1325144634.db2.gz WMGGCVYQPCHEQH-APWZRJJASA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@@H](c1cccc(F)c1)[N@H+](C)CCCNC(=O)CN1CC[C@H](C)C1 ZINC001316851470 1325221603 /nfs/dbraw/zinc/22/16/03/1325221603.db2.gz XLINNXVDEKGIBI-HOTGVXAUSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@@H](c1cccc(F)c1)[N@@H+](C)CCCNC(=O)CN1CC[C@H](C)C1 ZINC001316851470 1325221611 /nfs/dbraw/zinc/22/16/11/1325221611.db2.gz XLINNXVDEKGIBI-HOTGVXAUSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](C)Cc2cc3ccccc3o2)C1 ZINC001316850952 1325223809 /nfs/dbraw/zinc/22/38/09/1325223809.db2.gz MMAPMOJXPRPVOT-MRXNPFEDSA-N 1 3 343.471 2.713 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](C)Cc2cc3ccccc3o2)C1 ZINC001316850952 1325223820 /nfs/dbraw/zinc/22/38/20/1325223820.db2.gz MMAPMOJXPRPVOT-MRXNPFEDSA-N 1 3 343.471 2.713 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001316861920 1325231400 /nfs/dbraw/zinc/23/14/00/1325231400.db2.gz JFBMTYMDHQZEOV-AWEZNQCLSA-N 1 3 342.434 2.524 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001316861920 1325231409 /nfs/dbraw/zinc/23/14/09/1325231409.db2.gz JFBMTYMDHQZEOV-AWEZNQCLSA-N 1 3 342.434 2.524 10 0 EFAEHO CC[N@H+](CCCNC(=O)C1(N(C)C)CCC1)Cc1ccc(C)nc1C ZINC001316892329 1325281069 /nfs/dbraw/zinc/28/10/69/1325281069.db2.gz GCZVNKABJSPGCI-UHFFFAOYSA-N 1 3 346.519 2.511 10 0 EFAEHO CC[N@@H+](CCCNC(=O)C1(N(C)C)CCC1)Cc1ccc(C)nc1C ZINC001316892329 1325281078 /nfs/dbraw/zinc/28/10/78/1325281078.db2.gz GCZVNKABJSPGCI-UHFFFAOYSA-N 1 3 346.519 2.511 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1c(C)cccc1C ZINC001316902194 1325305021 /nfs/dbraw/zinc/30/50/21/1325305021.db2.gz GSLGPFKMCBETTB-KRWDZBQOSA-N 1 3 345.531 2.973 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1c(C)cccc1C ZINC001316902194 1325305038 /nfs/dbraw/zinc/30/50/38/1325305038.db2.gz GSLGPFKMCBETTB-KRWDZBQOSA-N 1 3 345.531 2.973 10 0 EFAEHO CC[N@H+](CCCNC(=O)Cc1nc[nH]c1C)[C@@H]1CCc2ccccc21 ZINC001316906578 1325316871 /nfs/dbraw/zinc/31/68/71/1325316871.db2.gz ZWTMPNACFYQDHF-LJQANCHMSA-N 1 3 340.471 2.776 10 0 EFAEHO CC[N@@H+](CCCNC(=O)Cc1nc[nH]c1C)[C@@H]1CCc2ccccc21 ZINC001316906578 1325316874 /nfs/dbraw/zinc/31/68/74/1325316874.db2.gz ZWTMPNACFYQDHF-LJQANCHMSA-N 1 3 340.471 2.776 10 0 EFAEHO CC(C)=CC[N@@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001317041669 1325509936 /nfs/dbraw/zinc/50/99/36/1325509936.db2.gz VSDXZIOFIRQSLA-IBGZPJMESA-N 1 3 335.536 2.855 10 0 EFAEHO CC(C)=CC[N@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001317041669 1325509944 /nfs/dbraw/zinc/50/99/44/1325509944.db2.gz VSDXZIOFIRQSLA-IBGZPJMESA-N 1 3 335.536 2.855 10 0 EFAEHO CC/C=C/CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001317047210 1325517187 /nfs/dbraw/zinc/51/71/87/1325517187.db2.gz LFBWAAUICPJKKD-NLMHJGSFSA-N 1 3 333.520 2.892 10 0 EFAEHO CC/C=C/CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001317047210 1325517195 /nfs/dbraw/zinc/51/71/95/1325517195.db2.gz LFBWAAUICPJKKD-NLMHJGSFSA-N 1 3 333.520 2.892 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H]([NH2+]CC/C=C/c3ccccc3)C2)C1 ZINC001317062647 1325533854 /nfs/dbraw/zinc/53/38/54/1325533854.db2.gz OECDQTVPGROBFJ-QKHICEAHSA-N 1 3 341.499 2.622 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@H]1CCC[N@@H+]1CC(C)C ZINC001320777269 1329300977 /nfs/dbraw/zinc/30/09/77/1329300977.db2.gz JNKUGUVGXTXFDC-QGZVFWFLSA-N 1 3 337.533 2.807 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@H]1CCC[N@H+]1CC(C)C ZINC001320777269 1329300980 /nfs/dbraw/zinc/30/09/80/1329300980.db2.gz JNKUGUVGXTXFDC-QGZVFWFLSA-N 1 3 337.533 2.807 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(C)sc1C)C(=O)CN1CC[C@@H](C)C1 ZINC001320841484 1329308981 /nfs/dbraw/zinc/30/89/81/1329308981.db2.gz YRRGHRKOSJWNRL-CQSZACIVSA-N 1 3 337.533 2.645 10 0 EFAEHO CCN(CC[NH2+]CCc1ccc(C)cc1)C(=O)[C@@H]1CCCCN1CC ZINC001320928959 1329321019 /nfs/dbraw/zinc/32/10/19/1329321019.db2.gz NYWWEDCNBCHXCS-FQEVSTJZSA-N 1 3 345.531 2.850 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC/C=C\CNCc1csc(C)c1 ZINC001321086141 1329341264 /nfs/dbraw/zinc/34/12/64/1329341264.db2.gz YUTSLCZOEDVNJN-VGOKWCNXSA-N 1 3 335.517 2.693 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC/C=C\CNCc1csc(C)c1 ZINC001321086141 1329341265 /nfs/dbraw/zinc/34/12/65/1329341265.db2.gz YUTSLCZOEDVNJN-VGOKWCNXSA-N 1 3 335.517 2.693 10 0 EFAEHO C[C@@H]1CCC[C@H](CC[NH2+]C/C=C\CNC(=O)C2(N(C)C)CCC2)C1 ZINC001321091251 1329341648 /nfs/dbraw/zinc/34/16/48/1329341648.db2.gz HLZDJDTZUBIZMP-IFOCYFHOSA-N 1 3 335.536 2.949 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C/C[NH2+][C@@H](C)c1cc(C)ccc1C)N(C)C ZINC001321253598 1329363632 /nfs/dbraw/zinc/36/36/32/1329363632.db2.gz VXWDJRBKBKSGJU-ZERCDLRSSA-N 1 3 331.504 2.967 10 0 EFAEHO CN(CC(=O)NC/C=C/C[NH2+]Cc1cccc(F)c1)CC(C)(C)C ZINC001321252917 1329363873 /nfs/dbraw/zinc/36/38/73/1329363873.db2.gz YUMZEOUOWQYZCB-AATRIKPKSA-N 1 3 335.467 2.566 10 0 EFAEHO CN(CC(=O)NC/C=C\C[NH2+]Cc1cccc(F)c1)CC(C)(C)C ZINC001321252919 1329363888 /nfs/dbraw/zinc/36/38/88/1329363888.db2.gz YUMZEOUOWQYZCB-WAYWQWQTSA-N 1 3 335.467 2.566 10 0 EFAEHO CCC/C=C\CC[NH2+]C[C@@H]1CCCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001317157964 1327653073 /nfs/dbraw/zinc/65/30/73/1327653073.db2.gz NWNJHFJBMWYPLY-WYNBNGFRSA-N 1 3 335.536 2.903 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H](C)CNC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001317240855 1327780611 /nfs/dbraw/zinc/78/06/11/1327780611.db2.gz JAIZBJVYAGLFPM-UYAOXDASSA-N 1 3 345.531 2.895 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC/C=C\C[NH2+]CCC1CCCCCC1 ZINC001321363066 1329377469 /nfs/dbraw/zinc/37/74/69/1329377469.db2.gz KJMHTFOHPOVLNA-SREVYHEPSA-N 1 3 332.492 2.883 10 0 EFAEHO CC(C)=CC[NH2+]C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001317346451 1327876236 /nfs/dbraw/zinc/87/62/36/1327876236.db2.gz VALCSZVPSHGZSE-SFHVURJKSA-N 1 3 329.488 2.766 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]([NH2+]CCCc2ccccc2)C1 ZINC001317366277 1327905765 /nfs/dbraw/zinc/90/57/65/1327905765.db2.gz OZPJONGOMXNIOS-WOJBJXKFSA-N 1 3 345.531 2.976 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]([NH2+]CCCc2ccccc2)C1 ZINC001317366274 1327905929 /nfs/dbraw/zinc/90/59/29/1327905929.db2.gz OZPJONGOMXNIOS-PMACEKPBSA-N 1 3 345.531 2.976 10 0 EFAEHO CC(C)C[NH2+]CCc1ccc(CNC(=O)CN2[C@H](C)CC[C@@H]2C)cc1 ZINC001317373439 1327917879 /nfs/dbraw/zinc/91/78/79/1327917879.db2.gz DAEGFWQRAGCKFT-HDICACEKSA-N 1 3 345.531 2.964 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C/CNC(=O)C[NH+]1[C@H](C)CC[C@H]1C ZINC001321417783 1329384519 /nfs/dbraw/zinc/38/45/19/1329384519.db2.gz VDRQYFAQRNZGHF-ADDHZHGLSA-N 1 3 347.478 2.769 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1Cc1cnccc1C)N(C)C ZINC001317435163 1328023022 /nfs/dbraw/zinc/02/30/22/1328023022.db2.gz MEFOSFTYYMFCJK-MOPGFXCFSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@@H]1CCC[N@H+]1Cc1cnccc1C)N(C)C ZINC001317435163 1328023024 /nfs/dbraw/zinc/02/30/24/1328023024.db2.gz MEFOSFTYYMFCJK-MOPGFXCFSA-N 1 3 346.519 2.591 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+]C/C=C/c2ccc(Cl)cc2)CCC1 ZINC001317596292 1328175890 /nfs/dbraw/zinc/17/58/90/1328175890.db2.gz QUXWVYRBWAPOQC-GQCTYLIASA-N 1 3 349.906 2.886 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]CCN(C)C(=O)[C@@H](C(C)C)N(C)C ZINC001317625265 1328206610 /nfs/dbraw/zinc/20/66/10/1328206610.db2.gz CFFWPFJCWRKAKR-LJQANCHMSA-N 1 3 333.520 2.944 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]CCN(C)C(=O)CN1CC[C@H](C)C1 ZINC001317625046 1328206831 /nfs/dbraw/zinc/20/68/31/1328206831.db2.gz ARXKKWFNEVYXDO-AWEZNQCLSA-N 1 3 337.895 2.538 10 0 EFAEHO CC(C)=CC[NH2+][C@@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001317684705 1328286020 /nfs/dbraw/zinc/28/60/20/1328286020.db2.gz YYWXCAMRBWAGLI-SFHVURJKSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)[N@H+](CCCF)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001317701581 1328308025 /nfs/dbraw/zinc/30/80/25/1328308025.db2.gz DDMSNBFCRGMBKS-SFHVURJKSA-N 1 3 347.494 2.775 10 0 EFAEHO CC(C)[N@@H+](CCCF)CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001317701581 1328308036 /nfs/dbraw/zinc/30/80/36/1328308036.db2.gz DDMSNBFCRGMBKS-SFHVURJKSA-N 1 3 347.494 2.775 10 0 EFAEHO CC(C)N(C/C=C/Cl)CCCNC(=O)CC1CC[NH+](C)CC1 ZINC001317706064 1328311227 /nfs/dbraw/zinc/31/12/27/1328311227.db2.gz ZXFUGDBLZIMONA-XBXARRHUSA-N 1 3 329.916 2.688 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@H](C[N@H+](C)CCCCCF)C1 ZINC001317861469 1328423153 /nfs/dbraw/zinc/42/31/53/1328423153.db2.gz ASNZBDRQQPMQLQ-MSOLQXFVSA-N 1 3 341.515 2.781 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@H](C[N@@H+](C)CCCCCF)C1 ZINC001317861469 1328423155 /nfs/dbraw/zinc/42/31/55/1328423155.db2.gz ASNZBDRQQPMQLQ-MSOLQXFVSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H]1CCC[N@H+](CCCCCF)C1 ZINC001317947583 1328452730 /nfs/dbraw/zinc/45/27/30/1328452730.db2.gz CLFAGUQBAMWSHE-MSOLQXFVSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H]1CCC[N@@H+](CCCCCF)C1 ZINC001317947583 1328452734 /nfs/dbraw/zinc/45/27/34/1328452734.db2.gz CLFAGUQBAMWSHE-MSOLQXFVSA-N 1 3 341.515 2.970 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CCc1ccc(C)cc1 ZINC001322088822 1329427734 /nfs/dbraw/zinc/42/77/34/1329427734.db2.gz OZOMRLOPVPFXSR-HKUYNNGSSA-N 1 3 331.504 2.506 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CCCc1ccccc1 ZINC001322089324 1329427808 /nfs/dbraw/zinc/42/78/08/1329427808.db2.gz PMWDKDDYUFYRQM-PKOBYXMFSA-N 1 3 331.504 2.588 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+][C@H]1CCc2c1cccc2F)N(C)C ZINC001322555954 1329467317 /nfs/dbraw/zinc/46/73/17/1329467317.db2.gz XCSHDCMFHPHEFM-OALUTQOASA-N 1 3 349.494 2.837 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)[C@H]1CCCN1C)c1ccc2c(c1)CCC2 ZINC001322647565 1329475541 /nfs/dbraw/zinc/47/55/41/1329475541.db2.gz CZECVHWXDAZVDB-OXJNMPFZSA-N 1 3 343.515 2.769 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CCCN(C)C(=O)[C@@H](C(C)C)N(C)C ZINC001322683823 1329479302 /nfs/dbraw/zinc/47/93/02/1329479302.db2.gz VOVKFCVJAKWDDS-GOSISDBHSA-N 1 3 337.483 2.658 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]CCCN(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001322694803 1329480465 /nfs/dbraw/zinc/48/04/65/1329480465.db2.gz VKYYUCIJGBAXIP-SJORKVTESA-N 1 3 347.503 2.536 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)CN1CCCC1)c1ccc(F)c(F)c1 ZINC001322834926 1329492541 /nfs/dbraw/zinc/49/25/41/1329492541.db2.gz IMRKEKDDDNQOSM-AWEZNQCLSA-N 1 3 339.430 2.560 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)NC[C@@H]1CCN1CCC1=CCCCC1 ZINC001323357404 1329537413 /nfs/dbraw/zinc/53/74/13/1329537413.db2.gz NWCDLDWGLLIEFX-IBGZPJMESA-N 1 3 333.520 2.943 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(CCN(C(=O)CN3CC[C@H](C)C3)C2)CC1 ZINC001323832775 1329576471 /nfs/dbraw/zinc/57/64/71/1329576471.db2.gz RJFLJNMAVUHHEP-PXPVJAHISA-N 1 3 347.547 2.999 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001325050007 1329667450 /nfs/dbraw/zinc/66/74/50/1329667450.db2.gz HABQWQGHRJGUHN-CVEARBPZSA-N 1 3 347.494 2.836 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@H](CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001325050007 1329667451 /nfs/dbraw/zinc/66/74/51/1329667451.db2.gz HABQWQGHRJGUHN-CVEARBPZSA-N 1 3 347.494 2.836 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]C/C=C/c2ccccc2)C1 ZINC001325582816 1329698854 /nfs/dbraw/zinc/69/88/54/1329698854.db2.gz SDPNLAWHOUAEDM-CSXIPAGWSA-N 1 3 343.515 2.726 10 0 EFAEHO CCC[NH2+]CCN(Cc1ccccc1)C(=O)[C@@H]1CCCN1C(C)C ZINC001325690678 1329706638 /nfs/dbraw/zinc/70/66/38/1329706638.db2.gz VLLHIDJJDUJVPX-IBGZPJMESA-N 1 3 331.504 2.888 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]CCC2=CCCCC2)C1 ZINC001326224921 1329740435 /nfs/dbraw/zinc/74/04/35/1329740435.db2.gz RBHZMJGIUFRMCP-RTBURBONSA-N 1 3 333.520 2.799 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@H]2CCN(C(=O)[C@H]3CCCN3C)C2)c1 ZINC001326225822 1329740463 /nfs/dbraw/zinc/74/04/63/1329740463.db2.gz WXVVUGGDGYARLC-AZUAARDMSA-N 1 3 343.515 2.671 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](CC[NH2+]CCc2ccccc2F)C1)N(C)C ZINC001326304818 1329745719 /nfs/dbraw/zinc/74/57/19/1329745719.db2.gz RCQGNFXJMYMZEW-QFBILLFUSA-N 1 3 349.494 2.537 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@H]1CCN(C(=O)[C@H]2CCCN2C)C1 ZINC001326332023 1329747866 /nfs/dbraw/zinc/74/78/66/1329747866.db2.gz KWKUZDWCMIZCQP-FXAWDEMLSA-N 1 3 343.515 2.671 10 0 EFAEHO CC[C@@H](C)C[NH2+]CC[C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001326363973 1329750177 /nfs/dbraw/zinc/75/01/77/1329750177.db2.gz IXDBXKSRKDYEAT-SJORKVTESA-N 1 3 325.541 2.839 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)CN3CC[C@@H](C)C3)C2)cc1 ZINC001326366169 1329750461 /nfs/dbraw/zinc/75/04/61/1329750461.db2.gz ZGHIGUWUOPRPKN-QUCCMNQESA-N 1 3 343.515 2.665 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001326436601 1329756491 /nfs/dbraw/zinc/75/64/91/1329756491.db2.gz FLMZVIAJJMDHOW-VQIMIIECSA-N 1 3 349.494 2.938 10 0 EFAEHO C[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[N@H+](C)CC1CC(F)(F)C1 ZINC001381585706 1348381260 /nfs/dbraw/zinc/38/12/60/1348381260.db2.gz FKXUXZNGMLCJGW-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[N@@H+](C)CC1CC(F)(F)C1 ZINC001381585706 1348381264 /nfs/dbraw/zinc/38/12/64/1348381264.db2.gz FKXUXZNGMLCJGW-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381855441 1348568326 /nfs/dbraw/zinc/56/83/26/1348568326.db2.gz RANXQKUIDBYJJR-IRXDYDNUSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381855441 1348568329 /nfs/dbraw/zinc/56/83/29/1348568329.db2.gz RANXQKUIDBYJJR-IRXDYDNUSA-N 1 3 325.541 2.835 10 0 EFAEHO CC/C=C/CCN1Cc2ccc(CNC(=O)[C@@H]3CC[N@H+](C)C3)cc2C1 ZINC001327695090 1330509308 /nfs/dbraw/zinc/50/93/08/1330509308.db2.gz FCNQUQOSKGSCCF-VZSQWMKGSA-N 1 3 341.499 2.926 10 0 EFAEHO CC/C=C/CCN1Cc2ccc(CNC(=O)[C@@H]3CC[N@@H+](C)C3)cc2C1 ZINC001327695090 1330509311 /nfs/dbraw/zinc/50/93/11/1330509311.db2.gz FCNQUQOSKGSCCF-VZSQWMKGSA-N 1 3 341.499 2.926 10 0 EFAEHO CCC[NH2+]CC1(c2ccccc2)CCN(C(=O)CN(C)C(C)C)CC1 ZINC001328127971 1330560443 /nfs/dbraw/zinc/56/04/43/1330560443.db2.gz MHKRSVBZXONLAI-UHFFFAOYSA-N 1 3 345.531 2.887 10 0 EFAEHO CCCC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H](C(C)C)N(C)C ZINC001328693205 1330616557 /nfs/dbraw/zinc/61/65/57/1330616557.db2.gz FSTNHBRCQJJJAP-GUDVDZBRSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)C[NH2+]CCC[C@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001330915935 1330769957 /nfs/dbraw/zinc/76/99/57/1330769957.db2.gz LCOFLDVTDHGBJL-MAUKXSAKSA-N 1 3 329.504 2.729 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccsc2)C[C@@H]1C ZINC001332048595 1330909444 /nfs/dbraw/zinc/90/94/44/1330909444.db2.gz LGXVBSXZKJXWQI-DOTOQJQBSA-N 1 3 337.533 2.602 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC2=CC[N@H+](CC3=CCCCC3)CC2)C1 ZINC001333400020 1331134798 /nfs/dbraw/zinc/13/47/98/1331134798.db2.gz KOBPTTYPSBEUQE-QGZVFWFLSA-N 1 3 331.504 2.577 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC2=CC[N@@H+](CC3=CCCCC3)CC2)C1 ZINC001333400020 1331134802 /nfs/dbraw/zinc/13/48/02/1331134802.db2.gz KOBPTTYPSBEUQE-QGZVFWFLSA-N 1 3 331.504 2.577 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C1CC1)[C@@H]1CCc2ccccc21)N(C)C ZINC001479876437 1332689664 /nfs/dbraw/zinc/68/96/64/1332689664.db2.gz MSJFONBCXALSPE-VQTJNVASSA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21)N(C)C ZINC001479876437 1332689668 /nfs/dbraw/zinc/68/96/68/1332689668.db2.gz MSJFONBCXALSPE-VQTJNVASSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@H](CSCCF)[NH2+]Cc1cccc(CN2CCN(C)CC2)c1 ZINC001346854377 1332697309 /nfs/dbraw/zinc/69/73/09/1332697309.db2.gz CQCHFCVKODXVMZ-MRXNPFEDSA-N 1 3 339.524 2.615 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@H]1CCCCN1Cc1ccc(C2CC2)cc1 ZINC001480323688 1333623733 /nfs/dbraw/zinc/62/37/33/1333623733.db2.gz KUJGXFQJVIBUCU-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO OCCCOCCNC1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001354248968 1334195983 /nfs/dbraw/zinc/19/59/83/1334195983.db2.gz WSPSPLYKMDFYAW-IHWFROFDSA-N 1 3 332.488 2.561 10 0 EFAEHO OCCCOCCNC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001354248968 1334195988 /nfs/dbraw/zinc/19/59/88/1334195988.db2.gz WSPSPLYKMDFYAW-IHWFROFDSA-N 1 3 332.488 2.561 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@H+](C)CC1CCC(C)CC1)N(C)C ZINC001407918357 1369397247 /nfs/dbraw/zinc/39/72/47/1369397247.db2.gz GPGLTZYACPQHCC-DAWZGUTISA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@@H+](C)CC1CCC(C)CC1)N(C)C ZINC001407918357 1369397256 /nfs/dbraw/zinc/39/72/56/1369397256.db2.gz GPGLTZYACPQHCC-DAWZGUTISA-N 1 3 325.541 2.933 10 0 EFAEHO O=C1O[C@]2(CN1CN1CCC[C@H]1CC1CCCC1)C[NH+]1CCC2CC1 ZINC000848507264 1334763531 /nfs/dbraw/zinc/76/35/31/1334763531.db2.gz VEFMGHKJPQSJPN-ICSRJNTNSA-N 1 3 347.503 2.905 10 0 EFAEHO CC1(C)SC[C@H]1NC(=[NH2+])NC1CCN(Cc2ccccc2)CC1 ZINC000848992693 1335028838 /nfs/dbraw/zinc/02/88/38/1335028838.db2.gz PUWZKSIVRQVOPP-MRXNPFEDSA-N 1 3 332.517 2.659 10 0 EFAEHO Cc1ccc(NC(=S)N[C@@H](C)C[N@H+](C)CCCN(C)C)c(C)c1 ZINC000849277325 1335586259 /nfs/dbraw/zinc/58/62/59/1335586259.db2.gz ZPOKJCKNUGSMMU-INIZCTEOSA-N 1 3 336.549 2.862 10 0 EFAEHO Cc1ccc(NC(=S)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c(C)c1 ZINC000849277325 1335586261 /nfs/dbraw/zinc/58/62/61/1335586261.db2.gz ZPOKJCKNUGSMMU-INIZCTEOSA-N 1 3 336.549 2.862 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NCC1C[C@H](C)C[C@@H](C)C1 ZINC001413889572 1335839832 /nfs/dbraw/zinc/83/98/32/1335839832.db2.gz AZBBEMLZTRUOHL-ZACQAIPSSA-N 1 3 340.556 2.630 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NCC1C[C@H](C)C[C@@H](C)C1 ZINC001413889572 1335839834 /nfs/dbraw/zinc/83/98/34/1335839834.db2.gz AZBBEMLZTRUOHL-ZACQAIPSSA-N 1 3 340.556 2.630 10 0 EFAEHO COc1ccc(CN(C)C)cc1NC(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001361610798 1336219753 /nfs/dbraw/zinc/21/97/53/1336219753.db2.gz LBPWAUJHFWXYHI-HOTGVXAUSA-N 1 3 333.476 2.816 10 0 EFAEHO CN(C)CCN(CC1CCCCC1)C(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001361856077 1336378135 /nfs/dbraw/zinc/37/81/35/1336378135.db2.gz MSGSBUDLEKLLPH-RBUKOAKNSA-N 1 3 335.536 2.974 10 0 EFAEHO CN(C)CCN(CC1CCCCC1)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001361856077 1336378139 /nfs/dbraw/zinc/37/81/39/1336378139.db2.gz MSGSBUDLEKLLPH-RBUKOAKNSA-N 1 3 335.536 2.974 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)N(CCN(C)C)Cc2ccccc2)CC1 ZINC001361880837 1336394324 /nfs/dbraw/zinc/39/43/24/1336394324.db2.gz PEMHJMUCCXBHFP-UHFFFAOYSA-N 1 3 345.531 2.945 10 0 EFAEHO CC(C)CN(C(=O)C1CC[NH+](CC(C)C)CC1)C1CCN(C)CC1 ZINC001361926782 1336420108 /nfs/dbraw/zinc/42/01/08/1336420108.db2.gz ONMMKNXLKVOIFL-UHFFFAOYSA-N 1 3 337.552 2.933 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)N3CCN(CCC(C)(C)C)CC3)C[N@@H+]2C1 ZINC001361954375 1336435954 /nfs/dbraw/zinc/43/59/54/1336435954.db2.gz WMPCOFJPDQBJSH-KURKYZTESA-N 1 3 335.536 2.687 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)N3CCN(CCC(C)(C)C)CC3)C[N@H+]2C1 ZINC001361954375 1336435956 /nfs/dbraw/zinc/43/59/56/1336435956.db2.gz WMPCOFJPDQBJSH-KURKYZTESA-N 1 3 335.536 2.687 10 0 EFAEHO CN(C)CCN(Cc1cccs1)C(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001362056192 1336483207 /nfs/dbraw/zinc/48/32/07/1336483207.db2.gz CAZSASUYQWVSTQ-JKSUJKDBSA-N 1 3 337.533 2.759 10 0 EFAEHO CN(C)CCN(Cc1cccs1)C(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001362056190 1336483283 /nfs/dbraw/zinc/48/32/83/1336483283.db2.gz CAZSASUYQWVSTQ-HZPDHXFCSA-N 1 3 337.533 2.759 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@H](C)CC[NH+](C)C)N2CCCC2)cc1 ZINC001362089822 1336498245 /nfs/dbraw/zinc/49/82/45/1336498245.db2.gz OXNAHOJGONNFQM-MJGOQNOKSA-N 1 3 331.504 2.836 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC001362163581 1336532461 /nfs/dbraw/zinc/53/24/61/1336532461.db2.gz WWFLVXSJCGVHQH-MRXNPFEDSA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@@H](CC[NH+](C)C)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC001362163577 1336532768 /nfs/dbraw/zinc/53/27/68/1336532768.db2.gz WWFLVXSJCGVHQH-INIZCTEOSA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1)N(C)Cc1ccccc1 ZINC001362170609 1336536578 /nfs/dbraw/zinc/53/65/78/1336536578.db2.gz ATZMPKPDWHYEIR-BHIYHBOVSA-N 1 3 331.504 2.744 10 0 EFAEHO C[C@@H](C(=O)NC1CCN(C2CC[NH+](C)CC2)CC1)[C@H](C)C(C)(C)C ZINC001362172601 1336538059 /nfs/dbraw/zinc/53/80/59/1336538059.db2.gz QLIJEELWBUMGHA-CVEARBPZSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001362503570 1336636356 /nfs/dbraw/zinc/63/63/56/1336636356.db2.gz KYCPNUJRCJXTCL-QRQLOZEOSA-N 1 3 331.504 2.744 10 0 EFAEHO C[C@@H](CC[NH+](C)C)C(=O)NC[C@H]1CCCCN1Cc1ccccc1 ZINC001362802649 1336748569 /nfs/dbraw/zinc/74/85/69/1336748569.db2.gz NNAIMDUKNAJXFE-PKOBYXMFSA-N 1 3 331.504 2.745 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)[C@@H]1CC[C@H]2C[C@@H](C)C[N@@H+]2C1 ZINC001363192306 1336824218 /nfs/dbraw/zinc/82/42/18/1336824218.db2.gz RIXGDQIRDXNVGI-QRVBRYPASA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)[C@@H]1CC[C@H]2C[C@@H](C)C[N@H+]2C1 ZINC001363192306 1336824220 /nfs/dbraw/zinc/82/42/20/1336824220.db2.gz RIXGDQIRDXNVGI-QRVBRYPASA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)[C@@H]1CC[C@@H]2C[C@H](C)C[N@@H+]2C1 ZINC001363192301 1336824759 /nfs/dbraw/zinc/82/47/59/1336824759.db2.gz RIXGDQIRDXNVGI-IPMKNSEASA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)[C@@H]1CC[C@@H]2C[C@H](C)C[N@H+]2C1 ZINC001363192301 1336824762 /nfs/dbraw/zinc/82/47/62/1336824762.db2.gz RIXGDQIRDXNVGI-IPMKNSEASA-N 1 3 335.536 2.831 10 0 EFAEHO C[NH+]1CCC(NC(=O)CN[C@@H](c2ccc(Cl)cc2)C2CC2)CC1 ZINC001363224104 1336842227 /nfs/dbraw/zinc/84/22/27/1336842227.db2.gz APIXKTZYRBRTMZ-GOSISDBHSA-N 1 3 335.879 2.591 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@]1(C)CC[C@H](C)C1(C)C ZINC001363230436 1336845579 /nfs/dbraw/zinc/84/55/79/1336845579.db2.gz BEARXHFTVBFSEF-BXWFABGCSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@]1(C)CC[C@H](C)C1(C)C ZINC001363230436 1336845580 /nfs/dbraw/zinc/84/55/80/1336845580.db2.gz BEARXHFTVBFSEF-BXWFABGCSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001365998673 1337311679 /nfs/dbraw/zinc/31/16/79/1337311679.db2.gz YDQFDIHMQZVZIF-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001365998673 1337311682 /nfs/dbraw/zinc/31/16/82/1337311682.db2.gz YDQFDIHMQZVZIF-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CC12CCN(Cc1cccc(Cl)c1)CC2 ZINC001366014017 1337323203 /nfs/dbraw/zinc/32/32/03/1337323203.db2.gz APEAIJGERJHYMA-QGZVFWFLSA-N 1 3 349.906 2.762 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](CNC(=O)[C@H]2CCCN2C(C)C)C2CC2)cs1 ZINC001366048151 1337345985 /nfs/dbraw/zinc/34/59/85/1337345985.db2.gz VVSKZWSUZORKKD-ZWKOTPCHSA-N 1 3 349.544 2.914 10 0 EFAEHO Cc1cc(C[NH2+][C@H](CNC(=O)[C@@H]2CCCN2C(C)C)C2CC2)cs1 ZINC001366048142 1337346089 /nfs/dbraw/zinc/34/60/89/1337346089.db2.gz VVSKZWSUZORKKD-MSOLQXFVSA-N 1 3 349.544 2.914 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001366058117 1337352952 /nfs/dbraw/zinc/35/29/52/1337352952.db2.gz HTZXIEHLOBBAQQ-LJQANCHMSA-N 1 3 331.504 2.628 10 0 EFAEHO CCC(CC)C[N@H+](C)C[C@@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001366076602 1337368815 /nfs/dbraw/zinc/36/88/15/1337368815.db2.gz UJNKHEGXNNXQNB-HKUYNNGSSA-N 1 3 337.552 2.935 10 0 EFAEHO CCC(CC)C[N@@H+](C)C[C@@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001366076602 1337368818 /nfs/dbraw/zinc/36/88/18/1337368818.db2.gz UJNKHEGXNNXQNB-HKUYNNGSSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[NH+]1[C@H](C)CC[C@H]1C ZINC001366084264 1337374029 /nfs/dbraw/zinc/37/40/29/1337374029.db2.gz UZFSAGYZHNGSMX-MKXGPGLRSA-N 1 3 335.536 2.971 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H]([NH2+]C/C=C/c2ccc(Cl)cc2)C1)N(C)C ZINC001366105093 1337381765 /nfs/dbraw/zinc/38/17/65/1337381765.db2.gz QDDYJLJXKXLMOR-HQYUYXFKSA-N 1 3 349.906 2.884 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H]([NH2+]C/C=C\c2ccc(Cl)cc2)C1)N(C)C ZINC001366105092 1337381796 /nfs/dbraw/zinc/38/17/96/1337381796.db2.gz QDDYJLJXKXLMOR-FDICQLOXSA-N 1 3 349.906 2.884 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[NH+]1CCCC1 ZINC001366131017 1337392665 /nfs/dbraw/zinc/39/26/65/1337392665.db2.gz KPVPTBDOSUEDBY-UMVBOHGHSA-N 1 3 348.318 2.663 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1F)N(C)C ZINC001366138143 1337397306 /nfs/dbraw/zinc/39/73/06/1337397306.db2.gz VKBUEWOTBMHRBH-PHSGOXPASA-N 1 3 347.478 2.778 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1F)N(C)C ZINC001366138143 1337397309 /nfs/dbraw/zinc/39/73/09/1337397309.db2.gz VKBUEWOTBMHRBH-PHSGOXPASA-N 1 3 347.478 2.778 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@H]2CN(CCC(F)(F)F)CC[C@@H]21 ZINC001366144175 1337400489 /nfs/dbraw/zinc/40/04/89/1337400489.db2.gz KYANZEBXFMUKGB-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@H]2CN(CCC(F)(F)F)CC[C@@H]21 ZINC001366144175 1337400491 /nfs/dbraw/zinc/40/04/91/1337400491.db2.gz KYANZEBXFMUKGB-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2cc3ccccc3o2)C1)C1CCC1 ZINC001366148591 1337402380 /nfs/dbraw/zinc/40/23/80/1337402380.db2.gz HHNXWCNSWKOZQV-IYBDPMFKSA-N 1 3 341.455 2.654 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2)C1)N(C)C ZINC001366153398 1337404618 /nfs/dbraw/zinc/40/46/18/1337404618.db2.gz GAMGMYGKLDNLHD-IXDOHACOSA-N 1 3 337.895 2.663 10 0 EFAEHO C[C@@H](N[C@H]1C[C@@H](NC(=O)C2(C[NH+](C)C)CC2)C1)c1ccccc1Cl ZINC001366155991 1337405809 /nfs/dbraw/zinc/40/58/09/1337405809.db2.gz OIUCTAHSNVZHLC-KFWWJZLASA-N 1 3 349.906 2.980 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](C/C=C\c2ccccc2)C1)N(C)C ZINC001366173439 1337415142 /nfs/dbraw/zinc/41/51/42/1337415142.db2.gz BVYVMCUOIOZWAI-MYPZJPOHSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2)C1)N(C)C ZINC001366173439 1337415145 /nfs/dbraw/zinc/41/51/45/1337415145.db2.gz BVYVMCUOIOZWAI-MYPZJPOHSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC001366186912 1337426726 /nfs/dbraw/zinc/42/67/26/1337426726.db2.gz PHFADGCRGBLHJY-ZWKOTPCHSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC001366186912 1337426728 /nfs/dbraw/zinc/42/67/28/1337426728.db2.gz PHFADGCRGBLHJY-ZWKOTPCHSA-N 1 3 331.504 2.916 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](CCc2ccccc2F)C1)N(C)C ZINC001366186892 1337426947 /nfs/dbraw/zinc/42/69/47/1337426947.db2.gz JJBXOWRQFDTMRO-QFBILLFUSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](CCc2ccccc2F)C1)N(C)C ZINC001366186892 1337426949 /nfs/dbraw/zinc/42/69/49/1337426949.db2.gz JJBXOWRQFDTMRO-QFBILLFUSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]Cc2cccc(OC)c2)CC1)N(C)C ZINC001366242402 1337473049 /nfs/dbraw/zinc/47/30/49/1337473049.db2.gz JFZUDOSRADRSMZ-FAFZWHIHSA-N 1 3 347.503 2.552 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]C/C=C\c1ccccc1 ZINC001366271062 1337484135 /nfs/dbraw/zinc/48/41/35/1337484135.db2.gz AJGDPYDPIUJNLG-YIEHMZNDSA-N 1 3 329.488 2.667 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001366312026 1337505656 /nfs/dbraw/zinc/50/56/56/1337505656.db2.gz QFCILWWDFNWAAS-OAHLLOKOSA-N 1 3 335.467 2.603 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NCc1cc(Cl)cc(Cl)c1 ZINC001366358481 1337533937 /nfs/dbraw/zinc/53/39/37/1337533937.db2.gz OXLVMCGJMJSAHC-DGCLKSJQSA-N 1 3 344.286 2.539 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NCc1cc(Cl)cc(Cl)c1 ZINC001366358481 1337533939 /nfs/dbraw/zinc/53/39/39/1337533939.db2.gz OXLVMCGJMJSAHC-DGCLKSJQSA-N 1 3 344.286 2.539 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]Cc1cc2ccccc2s1 ZINC001366365895 1337539136 /nfs/dbraw/zinc/53/91/36/1337539136.db2.gz LDBGDTNFYMONIG-CQSZACIVSA-N 1 3 333.501 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001366387776 1337552958 /nfs/dbraw/zinc/55/29/58/1337552958.db2.gz FXHSANSGXHYSTI-IBGZPJMESA-N 1 3 329.488 2.595 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([N@H+](C)[C@@H]2CCc3ccccc32)C1 ZINC001366423938 1337574103 /nfs/dbraw/zinc/57/41/03/1337574103.db2.gz AATCBEQBHYZZET-UYAOXDASSA-N 1 3 343.515 2.939 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([N@@H+](C)[C@@H]2CCc3ccccc32)C1 ZINC001366423938 1337574105 /nfs/dbraw/zinc/57/41/05/1337574105.db2.gz AATCBEQBHYZZET-UYAOXDASSA-N 1 3 343.515 2.939 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([N@H+](C)[C@H]2CCc3ccccc32)C1 ZINC001366423932 1337574275 /nfs/dbraw/zinc/57/42/75/1337574275.db2.gz AATCBEQBHYZZET-QUCCMNQESA-N 1 3 343.515 2.939 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([N@@H+](C)[C@H]2CCc3ccccc32)C1 ZINC001366423932 1337574279 /nfs/dbraw/zinc/57/42/79/1337574279.db2.gz AATCBEQBHYZZET-QUCCMNQESA-N 1 3 343.515 2.939 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]([N@H+](C)CCCc2ccccc2)C1)N(C)C ZINC001366438138 1337586764 /nfs/dbraw/zinc/58/67/64/1337586764.db2.gz SBJYJGSUWDRAJW-WOJBJXKFSA-N 1 3 345.531 2.882 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]([N@@H+](C)CCCc2ccccc2)C1)N(C)C ZINC001366438138 1337586769 /nfs/dbraw/zinc/58/67/69/1337586769.db2.gz SBJYJGSUWDRAJW-WOJBJXKFSA-N 1 3 345.531 2.882 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001366503418 1337645513 /nfs/dbraw/zinc/64/55/13/1337645513.db2.gz CVOUAMOGTANKBN-PBHICJAKSA-N 1 3 339.911 2.973 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+]Cc1nsc2ccccc12 ZINC001366508320 1337648795 /nfs/dbraw/zinc/64/87/95/1337648795.db2.gz DGYWABOKEUDKRK-CQSZACIVSA-N 1 3 348.516 2.621 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001366539301 1337674499 /nfs/dbraw/zinc/67/44/99/1337674499.db2.gz HGPWLYJAIXOGKZ-MOPGFXCFSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001366539301 1337674500 /nfs/dbraw/zinc/67/45/00/1337674500.db2.gz HGPWLYJAIXOGKZ-MOPGFXCFSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)c1 ZINC001366539227 1337674970 /nfs/dbraw/zinc/67/49/70/1337674970.db2.gz GYNINOGHNLRFJX-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)c1 ZINC001366539227 1337674971 /nfs/dbraw/zinc/67/49/71/1337674971.db2.gz GYNINOGHNLRFJX-UXHICEINSA-N 1 3 343.515 2.868 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](C)CC[C@H]1CCCC1(F)F ZINC001366595424 1337732773 /nfs/dbraw/zinc/73/27/73/1337732773.db2.gz JPUDQHTUSLTAIX-HZPDHXFCSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC001366595424 1337732775 /nfs/dbraw/zinc/73/27/75/1337732775.db2.gz JPUDQHTUSLTAIX-HZPDHXFCSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](C)CC[C@@H]1CCCC1(F)F ZINC001366595427 1337733079 /nfs/dbraw/zinc/73/30/79/1337733079.db2.gz JPUDQHTUSLTAIX-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC001366595427 1337733081 /nfs/dbraw/zinc/73/30/81/1337733081.db2.gz JPUDQHTUSLTAIX-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C)CCc1ccc2ccccc2c1 ZINC001366596918 1337734704 /nfs/dbraw/zinc/73/47/04/1337734704.db2.gz PNAUDDJXAPRKBM-UHFFFAOYSA-N 1 3 341.499 2.771 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C)CCc1ccc2ccccc2c1 ZINC001366596918 1337734707 /nfs/dbraw/zinc/73/47/07/1337734707.db2.gz PNAUDDJXAPRKBM-UHFFFAOYSA-N 1 3 341.499 2.771 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@H+](CC)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001366630249 1337772395 /nfs/dbraw/zinc/77/23/95/1337772395.db2.gz UFMDQJHKDSOLHE-GJZGRUSLSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@@H+](CC)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001366630249 1337772398 /nfs/dbraw/zinc/77/23/98/1337772398.db2.gz UFMDQJHKDSOLHE-GJZGRUSLSA-N 1 3 333.467 2.590 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CC[N@H+](CC3CCCCCC3)C2)C1 ZINC001366701887 1337891343 /nfs/dbraw/zinc/89/13/43/1337891343.db2.gz VVIAGNHPHPVMBW-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CC[N@@H+](CC3CCCCCC3)C2)C1 ZINC001366701887 1337891352 /nfs/dbraw/zinc/89/13/52/1337891352.db2.gz VVIAGNHPHPVMBW-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+](Cc2ccc(C3CC3)cc2)C1 ZINC001366706537 1337900745 /nfs/dbraw/zinc/90/07/45/1337900745.db2.gz BCHRLNRJXNTXKD-GOSISDBHSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+](Cc2ccc(C3CC3)cc2)C1 ZINC001366706537 1337900749 /nfs/dbraw/zinc/90/07/49/1337900749.db2.gz BCHRLNRJXNTXKD-GOSISDBHSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c(C)s1 ZINC001366708477 1337901744 /nfs/dbraw/zinc/90/17/44/1337901744.db2.gz FHRVZCBLUQZSTA-MRXNPFEDSA-N 1 3 337.533 2.643 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c(C)s1 ZINC001366708477 1337901747 /nfs/dbraw/zinc/90/17/47/1337901747.db2.gz FHRVZCBLUQZSTA-MRXNPFEDSA-N 1 3 337.533 2.643 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1 ZINC001366712090 1337906615 /nfs/dbraw/zinc/90/66/15/1337906615.db2.gz WFECIFLYCGYILA-GOSISDBHSA-N 1 3 335.536 2.737 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@@H+](CC2CCC3(CC3)CC2)C1 ZINC001366712090 1337906618 /nfs/dbraw/zinc/90/66/18/1337906618.db2.gz WFECIFLYCGYILA-GOSISDBHSA-N 1 3 335.536 2.737 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001366714134 1337909230 /nfs/dbraw/zinc/90/92/30/1337909230.db2.gz ZNTWUYFCPCVQEC-JKSUJKDBSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001366714134 1337909233 /nfs/dbraw/zinc/90/92/33/1337909233.db2.gz ZNTWUYFCPCVQEC-JKSUJKDBSA-N 1 3 349.906 2.620 10 0 EFAEHO CCC[N@H+](CCNC(=O)[C@@H](CC)N(C)C)[C@@H]1CCc2ccccc21 ZINC001366730570 1337937653 /nfs/dbraw/zinc/93/76/53/1337937653.db2.gz BPYUZRPASKNXOF-RTBURBONSA-N 1 3 331.504 2.842 10 0 EFAEHO CCC[N@@H+](CCNC(=O)[C@@H](CC)N(C)C)[C@@H]1CCc2ccccc21 ZINC001366730570 1337937661 /nfs/dbraw/zinc/93/76/61/1337937661.db2.gz BPYUZRPASKNXOF-RTBURBONSA-N 1 3 331.504 2.842 10 0 EFAEHO Cc1cccc(CN(CCNC(=O)C(C)(C)[NH+]2CCCC2)C2CC2)c1 ZINC001366745713 1337956974 /nfs/dbraw/zinc/95/69/74/1337956974.db2.gz BALFADOMKMTMBO-UHFFFAOYSA-N 1 3 343.515 2.950 10 0 EFAEHO C[C@H](F)CC[NH2+][C@@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001366782549 1338000814 /nfs/dbraw/zinc/00/08/14/1338000814.db2.gz MAXHFHVLOPDNSW-IRXDYDNUSA-N 1 3 341.515 2.683 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@@H]2CC[N@H+](CC3CC(C)(C)C3)C2)CCC1 ZINC001366833063 1338087445 /nfs/dbraw/zinc/08/74/45/1338087445.db2.gz XXBXGZWAFBIZSU-MRXNPFEDSA-N 1 3 335.536 2.735 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@@H]2CC[N@@H+](CC3CC(C)(C)C3)C2)CCC1 ZINC001366833063 1338087451 /nfs/dbraw/zinc/08/74/51/1338087451.db2.gz XXBXGZWAFBIZSU-MRXNPFEDSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2ccc(C)cc2)C1)N(C)C ZINC001366835961 1338093305 /nfs/dbraw/zinc/09/33/05/1338093305.db2.gz DAJZSOKIPVMIRG-RBUKOAKNSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2ccc(C)cc2)C1)N(C)C ZINC001366835961 1338093313 /nfs/dbraw/zinc/09/33/13/1338093313.db2.gz DAJZSOKIPVMIRG-RBUKOAKNSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2ccc(C)c(F)c2)C1)N(C)C ZINC001366850327 1338117402 /nfs/dbraw/zinc/11/74/02/1338117402.db2.gz HBEKWTRWBROHAG-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2ccc(C)c(F)c2)C1)N(C)C ZINC001366850327 1338117406 /nfs/dbraw/zinc/11/74/06/1338117406.db2.gz HBEKWTRWBROHAG-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C[N@H+](C)CCC(C)(C)C)CC1)N(C)C ZINC001366884469 1338163274 /nfs/dbraw/zinc/16/32/74/1338163274.db2.gz MMIHNOTULOLABW-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C[N@@H+](C)CCC(C)(C)C)CC1)N(C)C ZINC001366884469 1338163278 /nfs/dbraw/zinc/16/32/78/1338163278.db2.gz MMIHNOTULOLABW-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](C[N@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001366885359 1338165886 /nfs/dbraw/zinc/16/58/86/1338165886.db2.gz UYDJKMXWFWNLBQ-IRXDYDNUSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](C[N@@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001366885359 1338165888 /nfs/dbraw/zinc/16/58/88/1338165888.db2.gz UYDJKMXWFWNLBQ-IRXDYDNUSA-N 1 3 325.541 2.789 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1CCCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001366900375 1338185748 /nfs/dbraw/zinc/18/57/48/1338185748.db2.gz DBULWHNBAQHSCX-SFHVURJKSA-N 1 3 342.487 2.590 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@H+](CC2CCCC2)C1)N1CCCC1 ZINC001366903581 1338189110 /nfs/dbraw/zinc/18/91/10/1338189110.db2.gz LAHNKZJMMJEHII-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@@H+](CC2CCCC2)C1)N1CCCC1 ZINC001366903581 1338189112 /nfs/dbraw/zinc/18/91/12/1338189112.db2.gz LAHNKZJMMJEHII-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1CN(C2c3ccccc3-c3ccccc32)C1 ZINC001366974597 1338232488 /nfs/dbraw/zinc/23/24/88/1338232488.db2.gz JHXFHJMOJKUKLY-UHFFFAOYSA-N 1 3 349.478 2.756 10 0 EFAEHO CC[C@H](C(=O)NCC1C[NH+](Cc2c(C)cc(C)cc2C)C1)N(C)C ZINC001366980986 1338239183 /nfs/dbraw/zinc/23/91/83/1338239183.db2.gz GOGAYYIPFBRRNJ-LJQANCHMSA-N 1 3 331.504 2.500 10 0 EFAEHO CCc1cccc(CN2CC[C@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001367008750 1338264969 /nfs/dbraw/zinc/26/49/69/1338264969.db2.gz KMQAPAHKQZEDRK-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1cccc(CN2CC[C@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001367008750 1338264973 /nfs/dbraw/zinc/26/49/73/1338264973.db2.gz KMQAPAHKQZEDRK-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](CC)N(C)C)[NH2+]Cc1ccc2ncccc2c1 ZINC001367097651 1338384354 /nfs/dbraw/zinc/38/43/54/1338384354.db2.gz DCVKNZNFLCAYIJ-IEBWSBKVSA-N 1 3 342.487 2.559 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]Cc1cncc(C)c1 ZINC001367125401 1338413560 /nfs/dbraw/zinc/41/35/60/1338413560.db2.gz DVRWOSCYMXPMRP-RBUKOAKNSA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1c(C)cccc1C ZINC001367128141 1338416490 /nfs/dbraw/zinc/41/64/90/1338416490.db2.gz QPSHPKOEFYCXDK-QAPCUYQASA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1c(C)cccc1C ZINC001367128137 1338416566 /nfs/dbraw/zinc/41/65/66/1338416566.db2.gz QPSHPKOEFYCXDK-MAUKXSAKSA-N 1 3 331.504 2.630 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](CC)CNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001367131128 1338421369 /nfs/dbraw/zinc/42/13/69/1338421369.db2.gz XTSOBTQYZPSAQY-APWZRJJASA-N 1 3 331.504 2.575 10 0 EFAEHO CC[C@@H](F)CNCc1ccc(CNC(=O)C23CCC[NH+]2CCC3)cc1 ZINC001367210308 1338520096 /nfs/dbraw/zinc/52/00/96/1338520096.db2.gz PZPADMBTMWRAOA-GOSISDBHSA-N 1 3 347.478 2.769 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC1CC[NH+](CC[C@@H](C)F)CC1 ZINC001367214101 1338524166 /nfs/dbraw/zinc/52/41/66/1338524166.db2.gz OOHSIMCIZSNCSL-SJLPKXTDSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](CNCc1cc2ccccc2o1)N(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001367400232 1338697875 /nfs/dbraw/zinc/69/78/75/1338697875.db2.gz UQSAABRGOKZXSM-CVEARBPZSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@H](CNCc1cc2ccccc2o1)N(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001367400232 1338697880 /nfs/dbraw/zinc/69/78/80/1338697880.db2.gz UQSAABRGOKZXSM-CVEARBPZSA-N 1 3 343.471 2.711 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]([NH2+]Cc1ccc2cc[nH]c2c1)C(C)C)N(C)C ZINC001367489802 1338789186 /nfs/dbraw/zinc/78/91/86/1338789186.db2.gz IOHYRJYZRMTIFA-OALUTQOASA-N 1 3 344.503 2.739 10 0 EFAEHO CC(C)[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1cccc(F)c1 ZINC001367493884 1338793189 /nfs/dbraw/zinc/79/31/89/1338793189.db2.gz ZJLXVHFYOOVPTN-SFHVURJKSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1c(C)cccc1C)C(C)C)N(C)C ZINC001367496357 1338795459 /nfs/dbraw/zinc/79/54/59/1338795459.db2.gz VSYMTFIMABIRET-RBUKOAKNSA-N 1 3 333.520 2.874 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@H]2CN(C(=O)CN(C)C(C)C)CC[C@@H]21 ZINC001367552700 1338862574 /nfs/dbraw/zinc/86/25/74/1338862574.db2.gz FOMJBRINTRZCKV-PMACEKPBSA-N 1 3 343.515 2.758 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@H]2CN(C(=O)CN(C)C(C)C)CC[C@@H]21 ZINC001367552700 1338862577 /nfs/dbraw/zinc/86/25/77/1338862577.db2.gz FOMJBRINTRZCKV-PMACEKPBSA-N 1 3 343.515 2.758 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCCc2ccccc21)C(=O)CN(C)C(C)C ZINC001367656744 1338908524 /nfs/dbraw/zinc/90/85/24/1338908524.db2.gz MOKHVQBJLUIETI-IBGZPJMESA-N 1 3 331.504 2.842 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C(F)F)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001367761852 1338988490 /nfs/dbraw/zinc/98/84/90/1338988490.db2.gz VOFMRBJNCPCDRG-KBPBESRZSA-N 1 3 339.430 2.560 10 0 EFAEHO CCc1ccccc1CC[N@H+](C)C[C@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001367836041 1339051119 /nfs/dbraw/zinc/05/11/19/1339051119.db2.gz OMPZBTRLOVFCBG-MSOLQXFVSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[N@@H+](C)C[C@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001367836041 1339051121 /nfs/dbraw/zinc/05/11/21/1339051121.db2.gz OMPZBTRLOVFCBG-MSOLQXFVSA-N 1 3 345.531 2.570 10 0 EFAEHO Cc1ccccc1CCC[N@@H+](C)C[C@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001367834555 1339051160 /nfs/dbraw/zinc/05/11/60/1339051160.db2.gz NEFHDKOJFNIPGW-HKUYNNGSSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccccc1CCC[N@H+](C)C[C@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001367834555 1339051161 /nfs/dbraw/zinc/05/11/61/1339051161.db2.gz NEFHDKOJFNIPGW-HKUYNNGSSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)CC1CC(F)(F)C1 ZINC001367839702 1339056669 /nfs/dbraw/zinc/05/66/69/1339056669.db2.gz XFRNIZJYEIGZRJ-GOEBONIOSA-N 1 3 345.478 2.731 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)CC1CC(F)(F)C1 ZINC001367839702 1339056671 /nfs/dbraw/zinc/05/66/71/1339056671.db2.gz XFRNIZJYEIGZRJ-GOEBONIOSA-N 1 3 345.478 2.731 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C[N@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001367847635 1339064087 /nfs/dbraw/zinc/06/40/87/1339064087.db2.gz PGOLWALZKWKQCQ-WMZOPIPTSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C[N@@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001367847635 1339064088 /nfs/dbraw/zinc/06/40/88/1339064088.db2.gz PGOLWALZKWKQCQ-WMZOPIPTSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C[N@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001367847632 1339064306 /nfs/dbraw/zinc/06/43/06/1339064306.db2.gz PGOLWALZKWKQCQ-AEFFLSMTSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C[N@@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001367847632 1339064308 /nfs/dbraw/zinc/06/43/08/1339064308.db2.gz PGOLWALZKWKQCQ-AEFFLSMTSA-N 1 3 337.552 2.980 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+][C@H]1CCc2ccccc21)C1CC1)C1CCC1 ZINC001367909312 1339100417 /nfs/dbraw/zinc/10/04/17/1339100417.db2.gz ZBPWMLGAHFCSBH-PMACEKPBSA-N 1 3 341.499 2.643 10 0 EFAEHO C[C@@H](C(=O)N[C@H](C[NH2+]Cc1ccccc1)C1CC1)N1CCCCCC1 ZINC001367910596 1339100933 /nfs/dbraw/zinc/10/09/33/1339100933.db2.gz IKVSTXMGDJRZNO-FXAWDEMLSA-N 1 3 343.515 2.936 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCN1CC1CC2(CCC2)C1 ZINC001367943598 1339120068 /nfs/dbraw/zinc/12/00/68/1339120068.db2.gz KHVGBIRZJNFZFZ-QZTJIDSGSA-N 1 3 333.520 2.632 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCN1CC1CC2(CCC2)C1 ZINC001367943598 1339120076 /nfs/dbraw/zinc/12/00/76/1339120076.db2.gz KHVGBIRZJNFZFZ-QZTJIDSGSA-N 1 3 333.520 2.632 10 0 EFAEHO Cc1ccc(C)c([C@H](C)N2CC[C@H]2CNC(=O)CCC[NH+](C)C)c1 ZINC001367959188 1339128645 /nfs/dbraw/zinc/12/86/45/1339128645.db2.gz JJQORIIBDXILON-ROUUACIJSA-N 1 3 331.504 2.897 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CC1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001368011985 1339157052 /nfs/dbraw/zinc/15/70/52/1339157052.db2.gz HJXQXDBKUFNUSL-HOTGVXAUSA-N 1 3 333.501 2.503 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CC1)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001368011985 1339157054 /nfs/dbraw/zinc/15/70/54/1339157054.db2.gz HJXQXDBKUFNUSL-HOTGVXAUSA-N 1 3 333.501 2.503 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NCC2(N[C@H]3CCc4ccc(Cl)cc43)CC2)C1 ZINC001368034655 1339168098 /nfs/dbraw/zinc/16/80/98/1339168098.db2.gz JMFUNPWLDJHTOM-PBHICJAKSA-N 1 3 347.890 2.517 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NCC2(N[C@H]3CCc4ccc(Cl)cc43)CC2)C1 ZINC001368034655 1339168102 /nfs/dbraw/zinc/16/81/02/1339168102.db2.gz JMFUNPWLDJHTOM-PBHICJAKSA-N 1 3 347.890 2.517 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]Cc2cc(C)ccc2F)C[C@H]1C ZINC001368105130 1339196116 /nfs/dbraw/zinc/19/61/16/1339196116.db2.gz LEFDYZSDCLMTNO-SJLPKXTDSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1cccc(F)c1)C1CCCC1)N(C)C ZINC001368137045 1339212492 /nfs/dbraw/zinc/21/24/92/1339212492.db2.gz IDZKHYQUXNZQQU-RTBURBONSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1ccccc1)C1CCCC1)N(C)C ZINC001368141185 1339215138 /nfs/dbraw/zinc/21/51/38/1339215138.db2.gz BUIKOKUYUQEFOQ-RBUKOAKNSA-N 1 3 331.504 2.791 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@]2(C)CCN(C(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001368188944 1339244705 /nfs/dbraw/zinc/24/47/05/1339244705.db2.gz IQDAADGZTLANSK-CTNGQTDRSA-N 1 3 345.531 2.917 10 0 EFAEHO CC[C@H](F)CN1CCC(C)(CNC(=O)CCC[NH+]2CCCC2)CC1 ZINC001368209585 1339257145 /nfs/dbraw/zinc/25/71/45/1339257145.db2.gz KEIPOAKIMQOTGW-KRWDZBQOSA-N 1 3 341.515 2.829 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1(C)CC[NH+](CC2CCC2)CC1 ZINC001368211125 1339258273 /nfs/dbraw/zinc/25/82/73/1339258273.db2.gz PURBCMJMPLWQRM-CALCHBBNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@]1(C)CCC[N@H+](CC2CC(F)(F)C2)C1 ZINC001368227257 1339273130 /nfs/dbraw/zinc/27/31/30/1339273130.db2.gz YVFKOZUWOAVWPG-KRWDZBQOSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@]1(C)CCC[N@@H+](CC2CC(F)(F)C2)C1 ZINC001368227257 1339273131 /nfs/dbraw/zinc/27/31/31/1339273131.db2.gz YVFKOZUWOAVWPG-KRWDZBQOSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[N@H+](CCCC(C)C)CCC1(F)F)N(C)C ZINC001368244805 1339282621 /nfs/dbraw/zinc/28/26/21/1339282621.db2.gz HMRXJQYRNBFUSY-HOTGVXAUSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[N@@H+](CCCC(C)C)CCC1(F)F)N(C)C ZINC001368244805 1339282623 /nfs/dbraw/zinc/28/26/23/1339282623.db2.gz HMRXJQYRNBFUSY-HOTGVXAUSA-N 1 3 347.494 2.836 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)N[C@@H]1C[C@H]2C[C@@H](C1)N(C/C=C/Cl)C2 ZINC001368328028 1339300206 /nfs/dbraw/zinc/30/02/06/1339300206.db2.gz TYBWBWWSDPNORT-PTCOBTGCSA-N 1 3 339.911 2.584 10 0 EFAEHO CN(C[C@@H]1CCN1CC[C@@H]1CCCC1(F)F)C(=O)CCC[NH+](C)C ZINC001368399794 1339334414 /nfs/dbraw/zinc/33/44/14/1339334414.db2.gz KZFVJEVYENJRNM-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)C[C@H]1CCN1CC[C@H]1CCCC1(F)F ZINC001368419903 1339353688 /nfs/dbraw/zinc/35/36/88/1339353688.db2.gz KJRGPXXRFZEQFJ-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)C[C@H]1CCN1CC[C@H]1CCCC1(F)F ZINC001368419903 1339353696 /nfs/dbraw/zinc/35/36/96/1339353696.db2.gz KJRGPXXRFZEQFJ-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO CC(C)C[N@@H+]1CCc2c(CNC(=O)[C@H](C(C)C)N(C)C)cccc2C1 ZINC001368448060 1339384221 /nfs/dbraw/zinc/38/42/21/1339384221.db2.gz LZUZUGRLSZEBQG-FQEVSTJZSA-N 1 3 345.531 2.903 10 0 EFAEHO CC(C)C[N@H+]1CCc2c(CNC(=O)[C@H](C(C)C)N(C)C)cccc2C1 ZINC001368448060 1339384224 /nfs/dbraw/zinc/38/42/24/1339384224.db2.gz LZUZUGRLSZEBQG-FQEVSTJZSA-N 1 3 345.531 2.903 10 0 EFAEHO CC[C@H](C(=O)NCc1cccc2c1CC[N@H+](CC(C)C)C2)N(C)C ZINC001368449580 1339384937 /nfs/dbraw/zinc/38/49/37/1339384937.db2.gz PCQHAUYXMMIMJF-LJQANCHMSA-N 1 3 331.504 2.657 10 0 EFAEHO CC[C@H](C(=O)NCc1cccc2c1CC[N@@H+](CC(C)C)C2)N(C)C ZINC001368449580 1339384938 /nfs/dbraw/zinc/38/49/38/1339384938.db2.gz PCQHAUYXMMIMJF-LJQANCHMSA-N 1 3 331.504 2.657 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)[C@@H]3CC[N@H+](C)[C@@H]3C)CCC2)c1 ZINC001368472780 1339408774 /nfs/dbraw/zinc/40/87/74/1339408774.db2.gz GGTNZMXTCPAAJT-NVXWUHKLSA-N 1 3 347.478 2.603 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)[C@@H]3CC[N@@H+](C)[C@@H]3C)CCC2)c1 ZINC001368472780 1339408777 /nfs/dbraw/zinc/40/87/77/1339408777.db2.gz GGTNZMXTCPAAJT-NVXWUHKLSA-N 1 3 347.478 2.603 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2C[C@@H](CNC(=O)C(C)(C)N3CCCC3)C2)cs1 ZINC001368497958 1339436715 /nfs/dbraw/zinc/43/67/15/1339436715.db2.gz LOICOTJIFLOCTB-WOVMCDHWSA-N 1 3 349.544 2.915 10 0 EFAEHO CN(CCC[N@H+](C)CC[C@@H]1CCCC1(F)F)C(=O)[C@H]1CCCN1C ZINC001368531924 1339469866 /nfs/dbraw/zinc/46/98/66/1339469866.db2.gz XVUUBUBACMEJHS-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCC[N@@H+](C)CC[C@@H]1CCCC1(F)F)C(=O)[C@H]1CCCN1C ZINC001368531924 1339469867 /nfs/dbraw/zinc/46/98/67/1339469867.db2.gz XVUUBUBACMEJHS-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCCN(C)Cc1ccsc1)[NH+](C)C ZINC001368555869 1339496150 /nfs/dbraw/zinc/49/61/50/1339496150.db2.gz ZLKLYPDETSBCCH-MRXNPFEDSA-N 1 3 325.522 2.615 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@H+](C)Cc1ccc(F)c(F)c1)N(C)C ZINC001368558545 1339502158 /nfs/dbraw/zinc/50/21/58/1339502158.db2.gz QQIRPCIAMQPCJT-KRWDZBQOSA-N 1 3 341.446 2.585 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@@H+](C)Cc1ccc(F)c(F)c1)N(C)C ZINC001368558545 1339502160 /nfs/dbraw/zinc/50/21/60/1339502160.db2.gz QQIRPCIAMQPCJT-KRWDZBQOSA-N 1 3 341.446 2.585 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2C[C@H]([NH2+]CC3CCC4(CC4)CC3)C2)C1 ZINC001368588223 1339535055 /nfs/dbraw/zinc/53/50/55/1339535055.db2.gz HLNXEQZABWPKHD-BHIYHBOVSA-N 1 3 347.547 2.783 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CC[C@@H]([NH2+]CC3CC(C)(C)C3)C2)CCC1 ZINC001368641370 1339561144 /nfs/dbraw/zinc/56/11/44/1339561144.db2.gz PGQGAMWGZBNHIQ-DOTOQJQBSA-N 1 3 335.536 2.781 10 0 EFAEHO CCC[N@@H+]1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001368674483 1339589469 /nfs/dbraw/zinc/58/94/69/1339589469.db2.gz PGCHHZJYQCTBIM-AQNXPRMDSA-N 1 3 345.531 2.957 10 0 EFAEHO CCC[N@H+]1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001368674483 1339589473 /nfs/dbraw/zinc/58/94/73/1339589473.db2.gz PGCHHZJYQCTBIM-AQNXPRMDSA-N 1 3 345.531 2.957 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)CN(C)CC(C)(C)C ZINC001368692196 1339606521 /nfs/dbraw/zinc/60/65/21/1339606521.db2.gz FICKEUPJYZCUAI-BPQIPLTHSA-N 1 3 337.552 2.980 10 0 EFAEHO CCC[N@H+]1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)CN(C)CC(C)(C)C ZINC001368692196 1339606526 /nfs/dbraw/zinc/60/65/26/1339606526.db2.gz FICKEUPJYZCUAI-BPQIPLTHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CCC[NH+](C)C)CCN1CCc1ccccc1F ZINC001368697136 1339611683 /nfs/dbraw/zinc/61/16/83/1339611683.db2.gz FWVPQVHDKOSKIF-RBUKOAKNSA-N 1 3 349.494 2.679 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]C/C=C/c1ccccc1 ZINC001368737131 1339658533 /nfs/dbraw/zinc/65/85/33/1339658533.db2.gz PIRKJBAFZQJGRS-TYKASLFTSA-N 1 3 329.488 2.526 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]CC1CCC2(CC2)CC1 ZINC001368738554 1339660598 /nfs/dbraw/zinc/66/05/98/1339660598.db2.gz ZVEGAQUBFHBGTL-IRXDYDNUSA-N 1 3 335.536 2.783 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCCCC[C@H]([NH2+]C/C=C/Cl)C1)N(C)C ZINC001368753842 1339678223 /nfs/dbraw/zinc/67/82/23/1339678223.db2.gz BTBLDSOPHCDZDE-OZVGAOPWSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+][C@H](C)c1ccc(F)cc1F ZINC001368756293 1339681832 /nfs/dbraw/zinc/68/18/32/1339681832.db2.gz UOUUJJJJVKIHPL-UONOGXRCSA-N 1 3 341.446 2.850 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H]2CCCCN2C(=O)CC[NH+](C)C)n1 ZINC001368776635 1339701819 /nfs/dbraw/zinc/70/18/19/1339701819.db2.gz UJCKFLSMNQQYDS-SFHVURJKSA-N 1 3 346.519 2.627 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CC1CC(NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001368808808 1339746603 /nfs/dbraw/zinc/74/66/03/1339746603.db2.gz IHUKOHSTLQJXIF-PPSBMQLTSA-N 1 3 349.494 2.705 10 0 EFAEHO C[C@H](NCc1ccccc1F)[C@H](C)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001368857188 1339793295 /nfs/dbraw/zinc/79/32/95/1339793295.db2.gz BVAFFYKCELHWOL-GJZGRUSLSA-N 1 3 335.467 2.683 10 0 EFAEHO Cc1ccc(CN[C@@H](C)[C@H](C)NC(=O)CC[NH+](C)C)c(Cl)c1 ZINC001368856957 1339793735 /nfs/dbraw/zinc/79/37/35/1339793735.db2.gz ANBBFAZEAKOVRP-KBPBESRZSA-N 1 3 325.884 2.583 10 0 EFAEHO CN(C(=O)[C@@H]1CC[N@H+](C)C1)C1CCC(NC/C(Cl)=C\Cl)CC1 ZINC001368895673 1339835094 /nfs/dbraw/zinc/83/50/94/1339835094.db2.gz DVXTYWWJTJCBKE-LEPUHVQPSA-N 1 3 348.318 2.616 10 0 EFAEHO CN(C(=O)[C@@H]1CC[N@@H+](C)C1)C1CCC(NC/C(Cl)=C\Cl)CC1 ZINC001368895673 1339835097 /nfs/dbraw/zinc/83/50/97/1339835097.db2.gz DVXTYWWJTJCBKE-LEPUHVQPSA-N 1 3 348.318 2.616 10 0 EFAEHO CN(C(=O)[C@H]1CC[N@H+](C)C1)C1CCC(NC/C(Cl)=C\Cl)CC1 ZINC001368895666 1339835417 /nfs/dbraw/zinc/83/54/17/1339835417.db2.gz DVXTYWWJTJCBKE-DPKIYNSFSA-N 1 3 348.318 2.616 10 0 EFAEHO CN(C(=O)[C@H]1CC[N@@H+](C)C1)C1CCC(NC/C(Cl)=C\Cl)CC1 ZINC001368895666 1339835419 /nfs/dbraw/zinc/83/54/19/1339835419.db2.gz DVXTYWWJTJCBKE-DPKIYNSFSA-N 1 3 348.318 2.616 10 0 EFAEHO Cc1cccnc1CN[C@H](C)[C@H](C)NC(=O)CCC[NH+]1CCCCC1 ZINC001368902443 1339843970 /nfs/dbraw/zinc/84/39/70/1339843970.db2.gz UQKPSNZAVKMKMB-MSOLQXFVSA-N 1 3 346.519 2.639 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC(C)(C)C[NH2+]Cc2ccsc2)C1 ZINC001368918817 1339863903 /nfs/dbraw/zinc/86/39/03/1339863903.db2.gz KUWRRQGIFLKBGW-OAHLLOKOSA-N 1 3 337.533 2.664 10 0 EFAEHO Cc1ccccc1CCC[NH+]1CC([C@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001369097005 1339912646 /nfs/dbraw/zinc/91/26/46/1339912646.db2.gz PBBOGWJCSLRJCL-SFHVURJKSA-N 1 3 345.531 2.704 10 0 EFAEHO Cc1cc(CN2CC([C@@H](C)NC(=O)C[C@H]3CC[N@H+](C)C3)C2)c(C)s1 ZINC001369097199 1339913440 /nfs/dbraw/zinc/91/34/40/1339913440.db2.gz PNPTUQDKBZCAFG-GDBMZVCRSA-N 1 3 349.544 2.643 10 0 EFAEHO Cc1cc(CN2CC([C@@H](C)NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)c(C)s1 ZINC001369097199 1339913444 /nfs/dbraw/zinc/91/34/44/1339913444.db2.gz PNPTUQDKBZCAFG-GDBMZVCRSA-N 1 3 349.544 2.643 10 0 EFAEHO C[C@@H](NC(=O)CN(C)CC(C)(C)C)C1C[NH+](CC2CC(C)(C)C2)C1 ZINC001369099255 1339915343 /nfs/dbraw/zinc/91/53/43/1339915343.db2.gz XOQMDARWCBQTCC-OAHLLOKOSA-N 1 3 337.552 2.837 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCC(C)(C)CC3)C[C@H]21)N(C)C ZINC001369136270 1339937297 /nfs/dbraw/zinc/93/72/97/1339937297.db2.gz UIBITJGSEVJSGV-AKHDSKFASA-N 1 3 349.563 2.837 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCC(C)(C)CC3)C[C@H]21)N(C)C ZINC001369136270 1339937299 /nfs/dbraw/zinc/93/72/99/1339937299.db2.gz UIBITJGSEVJSGV-AKHDSKFASA-N 1 3 349.563 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1)C1CC1 ZINC001370280149 1340006282 /nfs/dbraw/zinc/00/62/82/1340006282.db2.gz YMUDLBKTJWDJFT-KSSFIOAISA-N 1 3 335.467 2.711 10 0 EFAEHO CCC[N@H+](C)C[C@@H]1CCCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001370303316 1340022044 /nfs/dbraw/zinc/02/20/44/1340022044.db2.gz LAQOXJLZIKTJGS-QFBILLFUSA-N 1 3 341.515 2.779 10 0 EFAEHO CCC[N@@H+](C)C[C@@H]1CCCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001370303316 1340022050 /nfs/dbraw/zinc/02/20/50/1340022050.db2.gz LAQOXJLZIKTJGS-QFBILLFUSA-N 1 3 341.515 2.779 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]([NH2+]C[C@H]3CCCC(F)(F)C3)C2)CCC1 ZINC001370481627 1340095633 /nfs/dbraw/zinc/09/56/33/1340095633.db2.gz FFERPQVFMHXCNS-KKUMJFAQSA-N 1 3 343.462 2.533 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CCc1cccs1)N(C)C ZINC001370597462 1340156050 /nfs/dbraw/zinc/15/60/50/1340156050.db2.gz YDRCNWZBKFHZCJ-MMNRESRNSA-N 1 3 349.544 2.742 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCc1cccs1)N(C)C ZINC001370597462 1340156051 /nfs/dbraw/zinc/15/60/51/1340156051.db2.gz YDRCNWZBKFHZCJ-MMNRESRNSA-N 1 3 349.544 2.742 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+]Cc3sccc3Cl)C2)CCC1 ZINC001370643256 1340179642 /nfs/dbraw/zinc/17/96/42/1340179642.db2.gz ZMONOJHWVGWTKP-TXEJJXNPSA-N 1 3 341.908 2.623 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(Cl)cc32)C1 ZINC001370713885 1340187765 /nfs/dbraw/zinc/18/77/65/1340187765.db2.gz PHAXOKUHFCEKRS-SOLBZPMBSA-N 1 3 349.906 2.906 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](Cc2ccc(C)cc2)C1)N(C)C ZINC001370756007 1340200200 /nfs/dbraw/zinc/20/02/00/1340200200.db2.gz VXWDHUCECWCWQJ-RTBURBONSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](Cc2ccc(C)cc2)C1)N(C)C ZINC001370756007 1340200201 /nfs/dbraw/zinc/20/02/01/1340200201.db2.gz VXWDHUCECWCWQJ-RTBURBONSA-N 1 3 331.504 2.663 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)C1 ZINC001370776736 1340205268 /nfs/dbraw/zinc/20/52/68/1340205268.db2.gz BAJMLMDDHZYMMN-XLIONFOSSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CCC[N@H+]([C@H]2CCc3ccccc32)C1 ZINC001370776736 1340205270 /nfs/dbraw/zinc/20/52/70/1340205270.db2.gz BAJMLMDDHZYMMN-XLIONFOSSA-N 1 3 343.515 2.844 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1C[NH2+][C@H]1CCc2ccccc21 ZINC001370949102 1340302070 /nfs/dbraw/zinc/30/20/70/1340302070.db2.gz GWVKLCQEIKYXLW-QUCCMNQESA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)NCc2ccc(Cl)s2)CC[N@@H+]1C ZINC001371182832 1340399496 /nfs/dbraw/zinc/39/94/96/1340399496.db2.gz CPJGNEKUGZVQEP-FPMFFAJLSA-N 1 3 343.924 2.726 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)NCc2ccc(Cl)s2)CC[N@H+]1C ZINC001371182832 1340399499 /nfs/dbraw/zinc/39/94/99/1340399499.db2.gz CPJGNEKUGZVQEP-FPMFFAJLSA-N 1 3 343.924 2.726 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)NCc1ccccc1F ZINC001371254132 1340443940 /nfs/dbraw/zinc/44/39/40/1340443940.db2.gz CVPVTFHMHMGKQQ-CRAIPNDOSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)NCc1ccccc1F ZINC001371254132 1340443944 /nfs/dbraw/zinc/44/39/44/1340443944.db2.gz CVPVTFHMHMGKQQ-CRAIPNDOSA-N 1 3 335.467 2.540 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001371305690 1340486922 /nfs/dbraw/zinc/48/69/22/1340486922.db2.gz IPYZKVNEWWRDIJ-QGZVFWFLSA-N 1 3 345.531 2.760 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](C)CNC(=O)C(C)(C)N2CCCC2)c1 ZINC001371310052 1340489406 /nfs/dbraw/zinc/48/94/06/1340489406.db2.gz VWMZYMDYBYNZOQ-INIZCTEOSA-N 1 3 331.504 2.718 10 0 EFAEHO C[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCCC1 ZINC001371362548 1340529729 /nfs/dbraw/zinc/52/97/29/1340529729.db2.gz JMJCKJRESHKPHO-KXBFYZLASA-N 1 3 341.515 2.874 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@H]([NH2+]CC3CC(C)(C)C3)C2)CCC1 ZINC001371634126 1340685737 /nfs/dbraw/zinc/68/57/37/1340685737.db2.gz NOCPTRJHJLLWCA-IRXDYDNUSA-N 1 3 335.536 2.924 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1ccccc1C ZINC001371884841 1340739051 /nfs/dbraw/zinc/73/90/51/1340739051.db2.gz DYFVWUABPOVFNC-MJGOQNOKSA-N 1 3 331.504 2.854 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]Cc1ccccc1C ZINC001371884932 1340739162 /nfs/dbraw/zinc/73/91/62/1340739162.db2.gz DYFVWUABPOVFNC-PKOBYXMFSA-N 1 3 331.504 2.854 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)CC[C@H]2CCC[N@H+]2C)C2CC2)cc1 ZINC001372806616 1340810299 /nfs/dbraw/zinc/81/02/99/1340810299.db2.gz CAFSHBZTLMJCCL-LJQANCHMSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)CC[C@H]2CCC[N@@H+]2C)C2CC2)cc1 ZINC001372806616 1340810302 /nfs/dbraw/zinc/81/03/02/1340810302.db2.gz CAFSHBZTLMJCCL-LJQANCHMSA-N 1 3 343.515 2.950 10 0 EFAEHO C[C@@H](F)CC[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001372860179 1340848378 /nfs/dbraw/zinc/84/83/78/1340848378.db2.gz QDKHNZICPUZISV-RDTXWAMCSA-N 1 3 345.478 2.528 10 0 EFAEHO C[C@@H](F)CC[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001372860179 1340848381 /nfs/dbraw/zinc/84/83/81/1340848381.db2.gz QDKHNZICPUZISV-RDTXWAMCSA-N 1 3 345.478 2.528 10 0 EFAEHO CC[C@H](C)C[NH2+][C@H](CNC(=O)C1(N(C)C)CCC1)c1ccccc1 ZINC001373070115 1340891209 /nfs/dbraw/zinc/89/12/09/1340891209.db2.gz ZAUXPFKJPQKKEA-FUHWJXTLSA-N 1 3 331.504 2.964 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CC[C@@H](CCNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001373190688 1340940696 /nfs/dbraw/zinc/94/06/96/1340940696.db2.gz LCAKATOIPNBMJV-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](F)CC[N@H+]1CC[C@@H](CCNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001373190688 1340940698 /nfs/dbraw/zinc/94/06/98/1340940698.db2.gz LCAKATOIPNBMJV-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO CCCC[N@@H+]1CC[C@H](CCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001373226430 1340956899 /nfs/dbraw/zinc/95/68/99/1340956899.db2.gz MCWSGIOUIDXBRK-LPHOPBHVSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCC[N@H+]1CC[C@H](CCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001373226430 1340956900 /nfs/dbraw/zinc/95/69/00/1340956900.db2.gz MCWSGIOUIDXBRK-LPHOPBHVSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](F)CN(C)C[C@H]1CCN(C(=O)CCC[NH+]2CCCCC2)C1 ZINC001373308195 1340984803 /nfs/dbraw/zinc/98/48/03/1340984803.db2.gz AQVJLNICMFCLES-QZTJIDSGSA-N 1 3 341.515 2.781 10 0 EFAEHO C[N@H+](C/C=C/c1ccccc1)C[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001373318322 1340989138 /nfs/dbraw/zinc/98/91/38/1340989138.db2.gz WBGIVEFQVXIABX-JRMCHAMMSA-N 1 3 341.499 2.576 10 0 EFAEHO C[N@@H+](C/C=C/c1ccccc1)C[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001373318322 1340989139 /nfs/dbraw/zinc/98/91/39/1340989139.db2.gz WBGIVEFQVXIABX-JRMCHAMMSA-N 1 3 341.499 2.576 10 0 EFAEHO CC(C)CC[N@H+](C)CC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001373330968 1340993866 /nfs/dbraw/zinc/99/38/66/1340993866.db2.gz WMIHJNOCYOTUMU-GOSISDBHSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)CC[N@@H+](C)CC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001373330968 1340993867 /nfs/dbraw/zinc/99/38/67/1340993867.db2.gz WMIHJNOCYOTUMU-GOSISDBHSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)C1)N(C)C ZINC001373400311 1341012805 /nfs/dbraw/zinc/01/28/05/1341012805.db2.gz SAQAKWLUHDEBDJ-YSIASYRMSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCC[N@H+]([C@H]2CCc3ccccc32)C1)N(C)C ZINC001373400311 1341012807 /nfs/dbraw/zinc/01/28/07/1341012807.db2.gz SAQAKWLUHDEBDJ-YSIASYRMSA-N 1 3 343.515 2.841 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@@H]2C[C@H]1CN2CCC1CCCC1)[NH+](CC)CC ZINC001373572814 1341057550 /nfs/dbraw/zinc/05/75/50/1341057550.db2.gz AHMVLLITZFUMJF-FHWLQOOXSA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCN(CCc2cccs2)C1)[NH+]1CCCC1 ZINC001373651758 1341084330 /nfs/dbraw/zinc/08/43/30/1341084330.db2.gz OKBKRVHDVCFYFM-SJLPKXTDSA-N 1 3 349.544 2.602 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](CC)[NH2+]Cc1csc(C)c1 ZINC001373762986 1341138510 /nfs/dbraw/zinc/13/85/10/1341138510.db2.gz VJDIIMZGCBAKFH-DLBZAZTESA-N 1 3 337.533 2.915 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]C[C@H]1CCc2ccccc2C1 ZINC001373832323 1341166827 /nfs/dbraw/zinc/16/68/27/1341166827.db2.gz CNAQADUGXNZSSP-FXAWDEMLSA-N 1 3 345.531 2.616 10 0 EFAEHO CC[C@H](C(=O)NC1(C[NH2+]CC2CC3(CCC3)C2)CCCC1)N(C)C ZINC001373853033 1341175065 /nfs/dbraw/zinc/17/50/65/1341175065.db2.gz ZACXDAPQKTXBKK-QGZVFWFLSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@](C)(NC(=O)CN(C)C(C)C)C2CC2)cs1 ZINC001373903358 1341197368 /nfs/dbraw/zinc/19/73/68/1341197368.db2.gz WVDQFZKYURLWGG-GOSISDBHSA-N 1 3 337.533 2.771 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[C@H]([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001373924818 1341205662 /nfs/dbraw/zinc/20/56/62/1341205662.db2.gz ZVNSAPBLRMJUKZ-UJWQCDCRSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@@H](C(=O)NCc1ccc(C[NH2+]CC2CCCC2)cc1)N(C)C ZINC001373934370 1341216402 /nfs/dbraw/zinc/21/64/02/1341216402.db2.gz OJSIBBVRNZLADZ-IBGZPJMESA-N 1 3 331.504 2.923 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H](C)C[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001374028378 1341317688 /nfs/dbraw/zinc/31/76/88/1341317688.db2.gz QZWZUTIWWLMMDL-KXBFYZLASA-N 1 3 344.503 2.596 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001374079816 1341374144 /nfs/dbraw/zinc/37/41/44/1341374144.db2.gz QESFNWICJBOLAD-ROUUACIJSA-N 1 3 345.531 2.994 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001374112070 1341422289 /nfs/dbraw/zinc/42/22/89/1341422289.db2.gz IMNLJFYBXZTDFJ-CYBMUJFWSA-N 1 3 343.874 2.661 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC001374112983 1341423186 /nfs/dbraw/zinc/42/31/86/1341423186.db2.gz VHHSLAOMOBVVSB-KXBFYZLASA-N 1 3 349.494 2.885 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)N(C)C(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001374227472 1341579815 /nfs/dbraw/zinc/57/98/15/1341579815.db2.gz YUGRLYFZPZSAHM-PBHICJAKSA-N 1 3 349.906 2.618 10 0 EFAEHO C[C@H](C[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C(=O)CN(C)C1CCC1 ZINC001374231658 1341583212 /nfs/dbraw/zinc/58/32/12/1341583212.db2.gz FXXMRTQZJKVNPU-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C(=O)CN(C)C1CCC1 ZINC001374231661 1341584545 /nfs/dbraw/zinc/58/45/45/1341584545.db2.gz FXXMRTQZJKVNPU-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C(=O)C1(N(C)C)CCC1 ZINC001374235061 1341588739 /nfs/dbraw/zinc/58/87/39/1341588739.db2.gz UMVJEVDJCUUKOR-MRXNPFEDSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccccc1C1CC1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001374280189 1341651576 /nfs/dbraw/zinc/65/15/76/1341651576.db2.gz LPYNLHCGVAKCCH-SJORKVTESA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)[C@@H](C(C)C)[NH+](C)C)c1 ZINC001374285553 1341660627 /nfs/dbraw/zinc/66/06/27/1341660627.db2.gz RTZDGLCDTVICAL-CRAIPNDOSA-N 1 3 337.483 2.657 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C[C@H](C)N(C)C(=O)CN1CCCC1 ZINC001374323486 1341723173 /nfs/dbraw/zinc/72/31/73/1341723173.db2.gz BUNLMZORFXOVDF-HNNXBMFYSA-N 1 3 337.895 2.681 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001374325708 1341727284 /nfs/dbraw/zinc/72/72/84/1341727284.db2.gz DHBUEZUFGKBMAU-KDOFPFPSSA-N 1 3 335.467 2.590 10 0 EFAEHO C[C@H]([NH2+]C/C(Cl)=C\Cl)[C@H]1CCCN(C(=O)CN2CCCC2)C1 ZINC001374386309 1341837398 /nfs/dbraw/zinc/83/73/98/1341837398.db2.gz CDPPBBUUUNHHIT-CAMKDYJDSA-N 1 3 348.318 2.618 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[N@H+](C)CCC(C)C)CC1)N(C)C ZINC001374404598 1341872635 /nfs/dbraw/zinc/87/26/35/1341872635.db2.gz PRFWFBNNPIQVDC-GOSISDBHSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[N@@H+](C)CCC(C)C)CC1)N(C)C ZINC001374404598 1341872640 /nfs/dbraw/zinc/87/26/40/1341872640.db2.gz PRFWFBNNPIQVDC-GOSISDBHSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccsc1 ZINC001374419120 1341897308 /nfs/dbraw/zinc/89/73/08/1341897308.db2.gz KWZXASSBDMDFOP-DLBZAZTESA-N 1 3 337.533 2.851 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccsc1 ZINC001374419121 1341897513 /nfs/dbraw/zinc/89/75/13/1341897513.db2.gz KWZXASSBDMDFOP-IAGOWNOFSA-N 1 3 337.533 2.851 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CCCCN1C(C)C)[NH2+]C/C=C/Cl ZINC001374438636 1341922121 /nfs/dbraw/zinc/92/21/21/1341922121.db2.gz HRVFMSUMFANKAV-KBUFDJFCSA-N 1 3 329.916 2.732 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NCc1sccc1Cl ZINC001374444542 1341929494 /nfs/dbraw/zinc/92/94/94/1341929494.db2.gz AFUNGMCPHACVLW-JSGCOSHPSA-N 1 3 343.924 2.584 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NCc1sccc1Cl ZINC001374444542 1341929496 /nfs/dbraw/zinc/92/94/96/1341929496.db2.gz AFUNGMCPHACVLW-JSGCOSHPSA-N 1 3 343.924 2.584 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]CC1CCC(F)(F)CC1 ZINC001374452016 1341934393 /nfs/dbraw/zinc/93/43/93/1341934393.db2.gz KBWAVHJZOMXYKC-MRXNPFEDSA-N 1 3 347.494 2.883 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2cc(C)ccc2C)CC[N@@H+]1C ZINC001374493251 1341973238 /nfs/dbraw/zinc/97/32/38/1341973238.db2.gz VIZHXWKWKGEKCN-VQTJNVASSA-N 1 3 345.531 2.924 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2cc(C)ccc2C)CC[N@H+]1C ZINC001374493251 1341973239 /nfs/dbraw/zinc/97/32/39/1341973239.db2.gz VIZHXWKWKGEKCN-VQTJNVASSA-N 1 3 345.531 2.924 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001374551647 1342060017 /nfs/dbraw/zinc/06/00/17/1342060017.db2.gz ZNVUMZPLKXIRKI-HZPDHXFCSA-N 1 3 347.494 2.788 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001374551647 1342060020 /nfs/dbraw/zinc/06/00/20/1342060020.db2.gz ZNVUMZPLKXIRKI-HZPDHXFCSA-N 1 3 347.494 2.788 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCN(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001374552304 1342061692 /nfs/dbraw/zinc/06/16/92/1342061692.db2.gz IJUPIYCCAODYPW-GOSISDBHSA-N 1 3 331.504 2.535 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCN(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001374552304 1342061698 /nfs/dbraw/zinc/06/16/98/1342061698.db2.gz IJUPIYCCAODYPW-GOSISDBHSA-N 1 3 331.504 2.535 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]CC[C@@H](C)NC(=O)Cc2nc[nH]c2C)c1 ZINC001374702953 1342121049 /nfs/dbraw/zinc/12/10/49/1342121049.db2.gz AWHQABUJKJKGHE-KGLIPLIRSA-N 1 3 344.459 2.515 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccsc1)NC(=O)c1cccc(CN(C)C)c1 ZINC001374854644 1342209133 /nfs/dbraw/zinc/20/91/33/1342209133.db2.gz RYXCBHPTMQIFHO-CQSZACIVSA-N 1 3 331.485 2.718 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N[C@@H](C)CNCc2ccccc2F)C1 ZINC001374927605 1342246211 /nfs/dbraw/zinc/24/62/11/1342246211.db2.gz JONKCAQAVFDPFV-RDJZCZTQSA-N 1 3 335.467 2.542 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N[C@@H](C)CNCc2ccccc2F)C1 ZINC001374927605 1342246216 /nfs/dbraw/zinc/24/62/16/1342246216.db2.gz JONKCAQAVFDPFV-RDJZCZTQSA-N 1 3 335.467 2.542 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@]2(CC[N@H+](CC3CC(C)(C)C3)C2)C1 ZINC001392994136 1356498177 /nfs/dbraw/zinc/49/81/77/1356498177.db2.gz UHTTWXXZEIOSAB-HXUWFJFHSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@]2(CC[N@@H+](CC3CC(C)(C)C3)C2)C1 ZINC001392994136 1356498181 /nfs/dbraw/zinc/49/81/81/1356498181.db2.gz UHTTWXXZEIOSAB-HXUWFJFHSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001374962692 1342272326 /nfs/dbraw/zinc/27/23/26/1342272326.db2.gz IPSSSPBZILFWHK-GUYCJALGSA-N 1 3 337.895 2.763 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1C ZINC001375047288 1342347196 /nfs/dbraw/zinc/34/71/96/1342347196.db2.gz QZMNOIYDWMAVQQ-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1C ZINC001375047288 1342347200 /nfs/dbraw/zinc/34/72/00/1342347200.db2.gz QZMNOIYDWMAVQQ-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCCC[C@H]2C[NH2+]Cc2ccsc2)CCC1 ZINC001375179119 1342494279 /nfs/dbraw/zinc/49/42/79/1342494279.db2.gz YMFXOLUMSMHIQE-DLBZAZTESA-N 1 3 349.544 2.997 10 0 EFAEHO Cc1ccc(CNC[C@H](NC(=O)[C@H]2CC[N@@H+](C)C2)C2CC2)c(Cl)c1 ZINC001375275302 1342582351 /nfs/dbraw/zinc/58/23/51/1342582351.db2.gz WMUOPIAGTPQOCX-WMZOPIPTSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1ccc(CNC[C@H](NC(=O)[C@H]2CC[N@H+](C)C2)C2CC2)c(Cl)c1 ZINC001375275302 1342582356 /nfs/dbraw/zinc/58/23/56/1342582356.db2.gz WMUOPIAGTPQOCX-WMZOPIPTSA-N 1 3 349.906 2.585 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]CC3CCC4(CC4)CC3)CC2)CCC1 ZINC001375428673 1342732214 /nfs/dbraw/zinc/73/22/14/1342732214.db2.gz DZDBJBKGLPQANW-UHFFFAOYSA-N 1 3 333.520 2.680 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCC1(NCc2ccc(Cl)cc2)CC1 ZINC001375433664 1342737628 /nfs/dbraw/zinc/73/76/28/1342737628.db2.gz VOMLLXGHNVCZEZ-KRWDZBQOSA-N 1 3 349.906 2.953 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCC1(NCc2ccc(Cl)cc2)CC1 ZINC001375433664 1342737630 /nfs/dbraw/zinc/73/76/30/1342737630.db2.gz VOMLLXGHNVCZEZ-KRWDZBQOSA-N 1 3 349.906 2.953 10 0 EFAEHO Cc1cc(F)ccc1CNC1(CNC(=O)CC[C@H]2CCC[N@H+]2C)CC1 ZINC001375433568 1342738039 /nfs/dbraw/zinc/73/80/39/1342738039.db2.gz UPHYSDDMJZQFJT-GOSISDBHSA-N 1 3 347.478 2.747 10 0 EFAEHO Cc1cc(F)ccc1CNC1(CNC(=O)CC[C@H]2CCC[N@@H+]2C)CC1 ZINC001375433568 1342738043 /nfs/dbraw/zinc/73/80/43/1342738043.db2.gz UPHYSDDMJZQFJT-GOSISDBHSA-N 1 3 347.478 2.747 10 0 EFAEHO C[C@H]([NH2+]C1(CNC(=O)C(C)(C)N2CCCC2)CC1)c1cccc(F)c1 ZINC001375456800 1342759719 /nfs/dbraw/zinc/75/97/19/1342759719.db2.gz XQEWXAZJAHGVDG-HNNXBMFYSA-N 1 3 347.478 3.000 10 0 EFAEHO C[C@H](NC1(CNC(=O)C(C)(C)[NH+]2CCCC2)CC1)c1cccc(F)c1 ZINC001375456800 1342759721 /nfs/dbraw/zinc/75/97/21/1342759721.db2.gz XQEWXAZJAHGVDG-HNNXBMFYSA-N 1 3 347.478 3.000 10 0 EFAEHO CCCCN1CC[C@H]1CN(C)C(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001375461662 1342766617 /nfs/dbraw/zinc/76/66/17/1342766617.db2.gz BZQDLAXCNGDINB-MAUKXSAKSA-N 1 3 327.488 2.532 10 0 EFAEHO CCCCN1CC[C@H]1CN(C)C(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001375461662 1342766619 /nfs/dbraw/zinc/76/66/19/1342766619.db2.gz BZQDLAXCNGDINB-MAUKXSAKSA-N 1 3 327.488 2.532 10 0 EFAEHO C[C@@H]([NH2+]C1(CNC(=O)CN2CC[C@@H](C)C2)CC1)c1cccc(Cl)c1 ZINC001375490986 1342797269 /nfs/dbraw/zinc/79/72/69/1342797269.db2.gz NIBFAGRGBFRRFO-HUUCEWRRSA-N 1 3 349.906 2.981 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H]2C[C@@H](NCC=C(Cl)Cl)C2)CC[N@@H+]1C ZINC001375500803 1342807734 /nfs/dbraw/zinc/80/77/34/1342807734.db2.gz SKRUVSNJLBFNIH-RFQIPJPRSA-N 1 3 348.318 2.520 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H]2C[C@@H](NCC=C(Cl)Cl)C2)CC[N@H+]1C ZINC001375500803 1342807740 /nfs/dbraw/zinc/80/77/40/1342807740.db2.gz SKRUVSNJLBFNIH-RFQIPJPRSA-N 1 3 348.318 2.520 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccccc32)C1 ZINC001375508963 1342816375 /nfs/dbraw/zinc/81/63/75/1342816375.db2.gz CTOCPJXDTKDWSU-IMFGXOCKSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@@H]1CC[N@H+](CC2CCC2)C1 ZINC001375568371 1342885252 /nfs/dbraw/zinc/88/52/52/1342885252.db2.gz DWLBFJMLQZYQIW-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@@H]1CC[N@@H+](CC2CCC2)C1 ZINC001375568371 1342885257 /nfs/dbraw/zinc/88/52/57/1342885257.db2.gz DWLBFJMLQZYQIW-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]Cc3ccc(F)cc3)C2)C1 ZINC001375574953 1342892506 /nfs/dbraw/zinc/89/25/06/1342892506.db2.gz UCSOLOBMEZJPRR-HHXXYDBFSA-N 1 3 347.478 2.542 10 0 EFAEHO CC[C@@H](C)C[N@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001375598635 1342916873 /nfs/dbraw/zinc/91/68/73/1342916873.db2.gz RLANMXFYNRREGA-VQIMIIECSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@@H](C)C[N@@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001375598635 1342916877 /nfs/dbraw/zinc/91/68/77/1342916877.db2.gz RLANMXFYNRREGA-VQIMIIECSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@H](F)CN1CC[C@@H](NC(=O)C2(C[NH+](C)C)CC2)CC(C)(C)C1 ZINC001375691742 1342933156 /nfs/dbraw/zinc/93/31/56/1342933156.db2.gz YCDPBYYCRADSJP-JKSUJKDBSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2cc(C)sc2C)[C@@H]1C ZINC001375702667 1342942195 /nfs/dbraw/zinc/94/21/95/1342942195.db2.gz XRUJDLARAASDKQ-PBHICJAKSA-N 1 3 337.533 2.786 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2cc(C)sc2C)[C@@H]1C ZINC001375702667 1342942198 /nfs/dbraw/zinc/94/21/98/1342942198.db2.gz XRUJDLARAASDKQ-PBHICJAKSA-N 1 3 337.533 2.786 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H]2CN(C(=O)[C@@H](C(C)C)N(C)C)C[C@@H]2C1 ZINC001375713014 1342948154 /nfs/dbraw/zinc/94/81/54/1342948154.db2.gz ZTBOWXCZDRSYOI-CEXWTWQISA-N 1 3 337.552 2.789 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H]2CN(C(=O)[C@@H](C(C)C)N(C)C)C[C@@H]2C1 ZINC001375713014 1342948156 /nfs/dbraw/zinc/94/81/56/1342948156.db2.gz ZTBOWXCZDRSYOI-CEXWTWQISA-N 1 3 337.552 2.789 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CC2CC3(CCC3)C2)C[C@@H]1C ZINC001375741058 1342968339 /nfs/dbraw/zinc/96/83/39/1342968339.db2.gz OZDIQTUXOVZPQI-FUHWJXTLSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]Cc1ccc(F)cc1)C1CCCC1 ZINC001375794431 1343021871 /nfs/dbraw/zinc/02/18/71/1343021871.db2.gz XGZAWZXQWAFWGR-LJQANCHMSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C[NH2+]CC1CC1)C1CCCC1 ZINC001375795055 1343023342 /nfs/dbraw/zinc/02/33/42/1343023342.db2.gz VKGDXZDHEXGFJI-OALUTQOASA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@]2(C)CCN(C(=O)[C@@H]3CCCN3C)C2)c1 ZINC001375865010 1343112164 /nfs/dbraw/zinc/11/21/64/1343112164.db2.gz AWHYSVJBDHWHSO-AZUAARDMSA-N 1 3 347.478 2.557 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2ccccc2C)C1)N(C)C ZINC001375879448 1343125448 /nfs/dbraw/zinc/12/54/48/1343125448.db2.gz LRBUAUGISZLYEX-UYAOXDASSA-N 1 3 331.504 2.663 10 0 EFAEHO CCCN1CCC(F)(F)[C@@H](CNC(=O)CCC[NH+]2CCCCC2)C1 ZINC001375988767 1343243197 /nfs/dbraw/zinc/24/31/97/1343243197.db2.gz NFADDSYAQHAMJC-INIZCTEOSA-N 1 3 345.478 2.736 10 0 EFAEHO CCCc1ccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001393742596 1357118725 /nfs/dbraw/zinc/11/87/25/1357118725.db2.gz LOMJJUHDONHERN-XLIONFOSSA-N 1 3 345.531 2.916 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001376146576 1343354248 /nfs/dbraw/zinc/35/42/48/1343354248.db2.gz UEYNJODLFHACOG-QFBILLFUSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001376146576 1343354250 /nfs/dbraw/zinc/35/42/50/1343354250.db2.gz UEYNJODLFHACOG-QFBILLFUSA-N 1 3 341.515 2.826 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(C)([NH2+]C/C=C/Cl)CC1 ZINC001393750342 1357124172 /nfs/dbraw/zinc/12/41/72/1357124172.db2.gz JHRABLGVNRGMCM-WCLQSUPFSA-N 1 3 327.900 2.584 10 0 EFAEHO CCCN(C(=O)Cc1c[nH]cn1)C1CC[NH+](CC2CCCC2)CC1 ZINC001376187618 1343387603 /nfs/dbraw/zinc/38/76/03/1343387603.db2.gz XKUFRUYWNHGZFF-UHFFFAOYSA-N 1 3 332.492 2.845 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001376352447 1343506553 /nfs/dbraw/zinc/50/65/53/1343506553.db2.gz YCWWRSARAYCTII-OALUTQOASA-N 1 3 345.531 2.970 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(C)c1)N(C)C ZINC001376425995 1343581162 /nfs/dbraw/zinc/58/11/62/1343581162.db2.gz FKRASIGRUYGLNJ-NXEWRWPSSA-N 1 3 343.515 2.947 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(C)c1)N(C)C ZINC001376425995 1343581165 /nfs/dbraw/zinc/58/11/65/1343581165.db2.gz FKRASIGRUYGLNJ-NXEWRWPSSA-N 1 3 343.515 2.947 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)C1 ZINC001376459014 1343607873 /nfs/dbraw/zinc/60/78/73/1343607873.db2.gz BZSRHYCMXPSAHT-CALCHBBNSA-N 1 3 329.488 2.525 10 0 EFAEHO CCc1cccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001376468489 1343614362 /nfs/dbraw/zinc/61/43/62/1343614362.db2.gz YVSHXQDYCBDMNM-OTWHNJEPSA-N 1 3 331.504 2.572 10 0 EFAEHO CC[C@@H]([NH2+][C@H]1C[C@@H](NC(=O)[C@@H](CC)N(C)C)C1)c1ccc(F)cc1 ZINC001376469072 1343614379 /nfs/dbraw/zinc/61/43/79/1343614379.db2.gz HDGLVIYFIAJIMY-XMTFNYHQSA-N 1 3 335.467 2.854 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCCc3ccc(F)cc32)C1)N(C)C ZINC001376488186 1343623319 /nfs/dbraw/zinc/62/33/19/1343623319.db2.gz KDMVSBMZTZVVPE-NBMJBFSESA-N 1 3 347.478 2.780 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)c(F)c2)C1)N(C)C ZINC001376492212 1343624065 /nfs/dbraw/zinc/62/40/65/1343624065.db2.gz UCKDUNOZRVSJNU-ZENOOKHLSA-N 1 3 341.858 2.556 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)c(F)c2)C1)N(C)C ZINC001376492207 1343624160 /nfs/dbraw/zinc/62/41/60/1343624160.db2.gz UCKDUNOZRVSJNU-DVOMOZLQSA-N 1 3 341.858 2.556 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC[C@H]2CCCC2(F)F)C1)N(C)C ZINC001376491753 1343624198 /nfs/dbraw/zinc/62/41/98/1343624198.db2.gz RUPFRDZJFYOOHF-WCVJEAGWSA-N 1 3 345.478 2.635 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]CC[C@H]2CCc3ccccc32)C1 ZINC001376493583 1343625101 /nfs/dbraw/zinc/62/51/01/1343625101.db2.gz JSRHQZJVDFXACP-QRVBRYPASA-N 1 3 343.515 2.685 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@H]1C[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001376511772 1343639223 /nfs/dbraw/zinc/63/92/23/1343639223.db2.gz KSJWEWGDQNSFNN-CALCHBBNSA-N 1 3 337.895 2.725 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2[C@@H]1CC[N@@H+]2CC1CCC1)N(CC)CC ZINC001376521907 1343646421 /nfs/dbraw/zinc/64/64/21/1343646421.db2.gz XEXDIBJNKVQRSZ-QYZOEREBSA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2[C@@H]1CC[N@H+]2CC1CCC1)N(CC)CC ZINC001376521907 1343646423 /nfs/dbraw/zinc/64/64/23/1343646423.db2.gz XEXDIBJNKVQRSZ-QYZOEREBSA-N 1 3 335.536 2.972 10 0 EFAEHO C[C@H](c1cccc(F)c1)N1C[C@@H]2CCCN(C(=O)CC[NH+](C)C)[C@@H]2C1 ZINC001376531803 1343657615 /nfs/dbraw/zinc/65/76/15/1343657615.db2.gz PENSTGVYZUUKTJ-HHXXYDBFSA-N 1 3 347.478 2.761 10 0 EFAEHO C[C@@H](NCCF)c1ccc(CNC(=O)C(C)(C)[NH+]2CCCC2)cc1 ZINC001376565114 1343681669 /nfs/dbraw/zinc/68/16/69/1343681669.db2.gz CBLUOVLGNUTRNB-OAHLLOKOSA-N 1 3 335.467 2.797 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCC[N@@H+]1CCC(C)(C)C)N(C)C ZINC001376585783 1343705492 /nfs/dbraw/zinc/70/54/92/1343705492.db2.gz SCUZDYKFXMNLAB-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCC[N@H+]1CCC(C)(C)C)N(C)C ZINC001376585783 1343705493 /nfs/dbraw/zinc/70/54/93/1343705493.db2.gz SCUZDYKFXMNLAB-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+]C[C@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001376618351 1343725893 /nfs/dbraw/zinc/72/58/93/1343725893.db2.gz RWHVITAPOZQXPU-QZTJIDSGSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H]1CCC[N@H+](CC2CCCC2)C1 ZINC001376622592 1343729463 /nfs/dbraw/zinc/72/94/63/1343729463.db2.gz HTFMJFSRMIXRGC-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H]1CCC[N@@H+](CC2CCCC2)C1 ZINC001376622592 1343729466 /nfs/dbraw/zinc/72/94/66/1343729466.db2.gz HTFMJFSRMIXRGC-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](CCC(C)(C)C)C1 ZINC001376623621 1343729911 /nfs/dbraw/zinc/72/99/11/1343729911.db2.gz LJXLHCRJTVOXPP-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](CCC(C)(C)C)C1 ZINC001376623621 1343729916 /nfs/dbraw/zinc/72/99/16/1343729916.db2.gz LJXLHCRJTVOXPP-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H]1CCC[N@H+](CCC(C)(C)C)C1 ZINC001376626128 1343733456 /nfs/dbraw/zinc/73/34/56/1343733456.db2.gz OVLMTRXOBZTHJF-GDBMZVCRSA-N 1 3 334.508 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](CCC(C)(C)C)C1 ZINC001376626128 1343733460 /nfs/dbraw/zinc/73/34/60/1343733460.db2.gz OVLMTRXOBZTHJF-GDBMZVCRSA-N 1 3 334.508 2.914 10 0 EFAEHO CC(C)(C)CCC[NH+]1CCC2(CN(C(=O)Cc3c[nH]cn3)C2)CC1 ZINC001376629796 1343735748 /nfs/dbraw/zinc/73/57/48/1343735748.db2.gz YAPYKRITBQKWEA-UHFFFAOYSA-N 1 3 332.492 2.703 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H](C)N1CCCCCC1 ZINC001376656527 1343746717 /nfs/dbraw/zinc/74/67/17/1343746717.db2.gz BPAHAVCWBJOTFG-RMMWZPCPSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H](C)N1CCCCCC1 ZINC001376656527 1343746720 /nfs/dbraw/zinc/74/67/20/1343746720.db2.gz BPAHAVCWBJOTFG-RMMWZPCPSA-N 1 3 349.563 2.980 10 0 EFAEHO CC[N@@H+]1CCc2c(CNC(=O)C(C)(C)N3CCCCC3)cccc2C1 ZINC001376673290 1343756130 /nfs/dbraw/zinc/75/61/30/1343756130.db2.gz LXNRRYUQDOURCF-UHFFFAOYSA-N 1 3 343.515 2.945 10 0 EFAEHO CC[N@H+]1CCc2c(CNC(=O)C(C)(C)N3CCCCC3)cccc2C1 ZINC001376673290 1343756131 /nfs/dbraw/zinc/75/61/31/1343756131.db2.gz LXNRRYUQDOURCF-UHFFFAOYSA-N 1 3 343.515 2.945 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+]Cc2ccc3cc[nH]c3c2)CCC1 ZINC001376807548 1343857336 /nfs/dbraw/zinc/85/73/36/1343857336.db2.gz JCUDENBHUUMXTH-UHFFFAOYSA-N 1 3 342.487 2.638 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)NCC1(NCc2ccccc2F)CCC1 ZINC001376820345 1343871748 /nfs/dbraw/zinc/87/17/48/1343871748.db2.gz SPOSECNQERKMEX-HOTGVXAUSA-N 1 3 347.478 2.827 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)C2CC[NH+](C(C)C)CC2)c1 ZINC001376833417 1343880920 /nfs/dbraw/zinc/88/09/20/1343880920.db2.gz XAMZWINPXLVAHQ-MRXNPFEDSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC001376883763 1343919279 /nfs/dbraw/zinc/91/92/79/1343919279.db2.gz SZDSBGSYIOZGQY-KBPBESRZSA-N 1 3 325.884 2.836 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](CCCc2ccccc2)CC1)N(C)C ZINC001376896688 1343935826 /nfs/dbraw/zinc/93/58/26/1343935826.db2.gz OARSSRZXWVPEJI-VQTJNVASSA-N 1 3 345.531 2.930 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](CCCc2ccccc2)CC1)N(C)C ZINC001376896688 1343935827 /nfs/dbraw/zinc/93/58/27/1343935827.db2.gz OARSSRZXWVPEJI-VQTJNVASSA-N 1 3 345.531 2.930 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001376958335 1343988912 /nfs/dbraw/zinc/98/89/12/1343988912.db2.gz PXCMLEPVOCVFEY-MSOLQXFVSA-N 1 3 331.504 2.834 10 0 EFAEHO CN(CCC[N@H+](C)CC1CCC2(CC2)CC1)C(=O)[C@H]1CCCN1C ZINC001376968196 1343996348 /nfs/dbraw/zinc/99/63/48/1343996348.db2.gz ZGBOYDAXGUDZST-GOSISDBHSA-N 1 3 335.536 2.831 10 0 EFAEHO CN(CCC[N@@H+](C)CC1CCC2(CC2)CC1)C(=O)[C@H]1CCCN1C ZINC001376968196 1343996351 /nfs/dbraw/zinc/99/63/51/1343996351.db2.gz ZGBOYDAXGUDZST-GOSISDBHSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)C[N@H+](C)CCCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001376978814 1344009722 /nfs/dbraw/zinc/00/97/22/1344009722.db2.gz DTPZWYICGVPHNJ-GOSISDBHSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)C[N@@H+](C)CCCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001376978814 1344009728 /nfs/dbraw/zinc/00/97/28/1344009728.db2.gz DTPZWYICGVPHNJ-GOSISDBHSA-N 1 3 329.504 2.635 10 0 EFAEHO Cc1ncccc1CN(C)CCCN(C)C(=O)C[N@H+]1[C@H](C)CC[C@@H]1C ZINC001377017143 1344063154 /nfs/dbraw/zinc/06/31/54/1344063154.db2.gz JKWQLGIOOROXGQ-CALCHBBNSA-N 1 3 346.519 2.543 10 0 EFAEHO Cc1ncccc1CN(C)CCCN(C)C(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001377017143 1344063158 /nfs/dbraw/zinc/06/31/58/1344063158.db2.gz JKWQLGIOOROXGQ-CALCHBBNSA-N 1 3 346.519 2.543 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001377019177 1344066023 /nfs/dbraw/zinc/06/60/23/1344066023.db2.gz NBCPJPMBHPKRBM-SFHVURJKSA-N 1 3 331.504 2.932 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001377019177 1344066024 /nfs/dbraw/zinc/06/60/24/1344066024.db2.gz NBCPJPMBHPKRBM-SFHVURJKSA-N 1 3 331.504 2.932 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CCNC(=O)[C@H]2CCCN2C)c(Cl)c1 ZINC001393797201 1357165536 /nfs/dbraw/zinc/16/55/36/1357165536.db2.gz LRBBBVXSHPYULA-WMLDXEAASA-N 1 3 337.895 2.727 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001377067604 1344112621 /nfs/dbraw/zinc/11/26/21/1344112621.db2.gz ORLRTJAMUXEAGZ-SJORKVTESA-N 1 3 343.515 2.890 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@H+](C1CC1)[C@H]1CCc2ccccc21)N(C)C ZINC001377563568 1344171769 /nfs/dbraw/zinc/17/17/69/1344171769.db2.gz CVCCZXFPBZDOGX-OALUTQOASA-N 1 3 329.488 2.595 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@@H+](C1CC1)[C@H]1CCc2ccccc21)N(C)C ZINC001377563568 1344171773 /nfs/dbraw/zinc/17/17/73/1344171773.db2.gz CVCCZXFPBZDOGX-OALUTQOASA-N 1 3 329.488 2.595 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C[N@H+](CC)CCC(C)C)CC1)N(C)C ZINC001377586552 1344193228 /nfs/dbraw/zinc/19/32/28/1344193228.db2.gz AEORXGFYWBXPDE-GOSISDBHSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C[N@@H+](CC)CCC(C)C)CC1)N(C)C ZINC001377586552 1344193232 /nfs/dbraw/zinc/19/32/32/1344193232.db2.gz AEORXGFYWBXPDE-GOSISDBHSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](F)C[N@H+](CC)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001377588458 1344194490 /nfs/dbraw/zinc/19/44/90/1344194490.db2.gz LTANZYRSZBAGDB-QGZVFWFLSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](F)C[N@@H+](CC)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001377588458 1344194494 /nfs/dbraw/zinc/19/44/94/1344194494.db2.gz LTANZYRSZBAGDB-QGZVFWFLSA-N 1 3 329.504 2.635 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]CCN(C)C(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001377589376 1344195799 /nfs/dbraw/zinc/19/57/99/1344195799.db2.gz KUWSYPOCJLXVRY-PKOBYXMFSA-N 1 3 333.520 2.999 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C[N@@H+](CC)C[C@@H](F)CC)CC1)N(C)C ZINC001377590250 1344196550 /nfs/dbraw/zinc/19/65/50/1344196550.db2.gz DUFVPFTVQZOUQN-DLBZAZTESA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C[N@H+](CC)C[C@@H](F)CC)CC1)N(C)C ZINC001377590250 1344196554 /nfs/dbraw/zinc/19/65/54/1344196554.db2.gz DUFVPFTVQZOUQN-DLBZAZTESA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]C[C@H]1CCc2ccccc2C1)N(C)C ZINC001393808237 1357173837 /nfs/dbraw/zinc/17/38/37/1357173837.db2.gz PTDXZOMOVIWETB-ABSDTBQOSA-N 1 3 345.531 2.616 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]CC1CCCC1)c1ccccc1)N(C)C ZINC001377619499 1344228055 /nfs/dbraw/zinc/22/80/55/1344228055.db2.gz ICCVBGVDBPIWJK-RTBURBONSA-N 1 3 331.504 2.964 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[N@H+](C)C/C=C/c1ccccc1)N(C)C ZINC001377639504 1344249264 /nfs/dbraw/zinc/24/92/64/1344249264.db2.gz IJGFBKRKWGKYNP-HQNNKSEMSA-N 1 3 343.515 2.963 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[N@@H+](C)C/C=C/c1ccccc1)N(C)C ZINC001377639504 1344249269 /nfs/dbraw/zinc/24/92/69/1344249269.db2.gz IJGFBKRKWGKYNP-HQNNKSEMSA-N 1 3 343.515 2.963 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[N@H+](C)C/C=C\c1ccccc1)N(C)C ZINC001377639524 1344249717 /nfs/dbraw/zinc/24/97/17/1344249717.db2.gz IJGFBKRKWGKYNP-WBDJMKMOSA-N 1 3 343.515 2.963 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[N@@H+](C)C/C=C\c1ccccc1)N(C)C ZINC001377639524 1344249719 /nfs/dbraw/zinc/24/97/19/1344249719.db2.gz IJGFBKRKWGKYNP-WBDJMKMOSA-N 1 3 343.515 2.963 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(C)C[C@H]1CCCN1C(=O)CC[NH+](C)C ZINC001377659655 1344280242 /nfs/dbraw/zinc/28/02/42/1344280242.db2.gz GMAGGJOGAWVNDS-MAUKXSAKSA-N 1 3 335.467 2.761 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001393813319 1357177706 /nfs/dbraw/zinc/17/77/06/1357177706.db2.gz AAXPSNSRIXTQLY-WMZOPIPTSA-N 1 3 331.504 2.630 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CCC[N@H+](CC3CC3)C2)CC1 ZINC001377679218 1344311068 /nfs/dbraw/zinc/31/10/68/1344311068.db2.gz VGGZOIYEDLDVRB-LJQANCHMSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CCC[N@@H+](CC3CC3)C2)CC1 ZINC001377679218 1344311069 /nfs/dbraw/zinc/31/10/69/1344311069.db2.gz VGGZOIYEDLDVRB-LJQANCHMSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@H+](C)[C@H]1CCc2ccccc21 ZINC001377681909 1344315817 /nfs/dbraw/zinc/31/58/17/1344315817.db2.gz XRNIKANUINKOLI-QUCCMNQESA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001377681909 1344315821 /nfs/dbraw/zinc/31/58/21/1344315821.db2.gz XRNIKANUINKOLI-QUCCMNQESA-N 1 3 343.515 2.937 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2c(C)cccc2C)C1)N(C)C ZINC001377692783 1344330780 /nfs/dbraw/zinc/33/07/80/1344330780.db2.gz DFIDEBDIEGUNLX-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2c(C)cccc2C)C1)N(C)C ZINC001377692783 1344330784 /nfs/dbraw/zinc/33/07/84/1344330784.db2.gz DFIDEBDIEGUNLX-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@H]2CC[N@@H+](CCCC3CCC3)C2)C1 ZINC001377713367 1344358293 /nfs/dbraw/zinc/35/82/93/1344358293.db2.gz XPLOSEHIVFZDBT-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@H]2CC[N@H+](CCCC3CCC3)C2)C1 ZINC001377713367 1344358291 /nfs/dbraw/zinc/35/82/91/1344358291.db2.gz XPLOSEHIVFZDBT-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]CC2CCC3(CC3)CC2)C1)N(C)C ZINC001377737759 1344386106 /nfs/dbraw/zinc/38/61/06/1344386106.db2.gz WXURBSKAACVSNY-DAWZGUTISA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[N@H+](C)CCCC(C)(C)C)C1)N(C)C ZINC001377750350 1344395406 /nfs/dbraw/zinc/39/54/06/1344395406.db2.gz BVXAJPUZRZGGEA-IAGOWNOFSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[N@@H+](C)CCCC(C)(C)C)C1)N(C)C ZINC001377750350 1344395407 /nfs/dbraw/zinc/39/54/07/1344395407.db2.gz BVXAJPUZRZGGEA-IAGOWNOFSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001377776730 1344425428 /nfs/dbraw/zinc/42/54/28/1344425428.db2.gz AYPYACNPCJHGCR-HZPDHXFCSA-N 1 3 345.478 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001377776730 1344425433 /nfs/dbraw/zinc/42/54/33/1344425433.db2.gz AYPYACNPCJHGCR-HZPDHXFCSA-N 1 3 345.478 2.542 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+](C)C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001377782776 1344432738 /nfs/dbraw/zinc/43/27/38/1344432738.db2.gz KUMUZKMPSYACJL-KRWDZBQOSA-N 1 3 349.494 2.755 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+](C)C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001377782776 1344432740 /nfs/dbraw/zinc/43/27/40/1344432740.db2.gz KUMUZKMPSYACJL-KRWDZBQOSA-N 1 3 349.494 2.755 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)cc1 ZINC001377808963 1344460434 /nfs/dbraw/zinc/46/04/34/1344460434.db2.gz QCEYOPMNOJHHFW-JKSUJKDBSA-N 1 3 331.504 2.716 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H](C)[C@@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001377824676 1344481067 /nfs/dbraw/zinc/48/10/67/1344481067.db2.gz MPWNZDARTVCLLT-JKSUJKDBSA-N 1 3 331.504 2.716 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H]1CCC[N@H+](CCC2CCCC2)C1 ZINC001377827815 1344485592 /nfs/dbraw/zinc/48/55/92/1344485592.db2.gz GZHLZOYVGXZTON-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H]1CCC[N@@H+](CCC2CCCC2)C1 ZINC001377827815 1344485596 /nfs/dbraw/zinc/48/55/96/1344485596.db2.gz GZHLZOYVGXZTON-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](NCc1sccc1Cl)[C@H](C)NC(=O)CCC[NH+](C)C ZINC001377838334 1344493327 /nfs/dbraw/zinc/49/33/27/1344493327.db2.gz JQDSKCHTUCLRMK-NEPJUHHUSA-N 1 3 331.913 2.726 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)C1)N(C)C ZINC001377838348 1344493917 /nfs/dbraw/zinc/49/39/17/1344493917.db2.gz POGMSLGLLNLKDK-JYJNAYRXSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@@H+](C[C@H]2CCC(F)(F)C2)C1)N(C)C ZINC001377838348 1344493921 /nfs/dbraw/zinc/49/39/21/1344493921.db2.gz POGMSLGLLNLKDK-JYJNAYRXSA-N 1 3 345.478 2.589 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)[C@H](C)NCc1cc(Cl)ccc1F ZINC001377869507 1344531124 /nfs/dbraw/zinc/53/11/24/1344531124.db2.gz IVROOYKEDCIXIP-QWHCGFSZSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)[C@H](C)NCc1cc(Cl)ccc1F ZINC001377869507 1344531134 /nfs/dbraw/zinc/53/11/34/1344531134.db2.gz IVROOYKEDCIXIP-QWHCGFSZSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001377915711 1344579719 /nfs/dbraw/zinc/57/97/19/1344579719.db2.gz RPSZGEOURYQMSN-OLZOCXBDSA-N 1 3 343.874 2.802 10 0 EFAEHO Cc1ncccc1C[NH2+]C1CCC(N(C)C(=O)CN(C)C(C)C)CC1 ZINC001377932061 1344593399 /nfs/dbraw/zinc/59/33/99/1344593399.db2.gz SIUQUENIRHOUIX-UHFFFAOYSA-N 1 3 346.519 2.589 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]Cc1csc(C)c1 ZINC001393830640 1357194492 /nfs/dbraw/zinc/19/44/92/1357194492.db2.gz MJEKSIMRZGTJNL-YOEHRIQHSA-N 1 3 337.533 2.915 10 0 EFAEHO Cc1cccc(CN2CC(CNC(=O)[C@H](C(C)C)[NH+]3CCCC3)C2)c1 ZINC001378021586 1344672029 /nfs/dbraw/zinc/67/20/29/1344672029.db2.gz MGPHHHZJQHPOQZ-FQEVSTJZSA-N 1 3 343.515 2.663 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[N@H+](C)CCc1ccccc1 ZINC001378046536 1344697225 /nfs/dbraw/zinc/69/72/25/1344697225.db2.gz IYDUQFMWVCYDAN-IEBWSBKVSA-N 1 3 331.504 2.538 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[N@@H+](C)CCc1ccccc1 ZINC001378046536 1344697227 /nfs/dbraw/zinc/69/72/27/1344697227.db2.gz IYDUQFMWVCYDAN-IEBWSBKVSA-N 1 3 331.504 2.538 10 0 EFAEHO CC[C@H](F)C[NH+]1CCC2(CCN(C(=O)CN(C)C(C)C)CC2)CC1 ZINC001393836501 1357200255 /nfs/dbraw/zinc/20/02/55/1357200255.db2.gz ONPNYVPTIYGFCK-KRWDZBQOSA-N 1 3 341.515 2.779 10 0 EFAEHO Cc1ccc(CCC[N@@H+](C)[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001378140321 1344803771 /nfs/dbraw/zinc/80/37/71/1344803771.db2.gz LNWCOXMQRDLEOO-RTBURBONSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CCC[N@H+](C)[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001378140321 1344803777 /nfs/dbraw/zinc/80/37/77/1344803777.db2.gz LNWCOXMQRDLEOO-RTBURBONSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@](C)(NC(=O)CN(C)C(C)C)C2CC2)cc1 ZINC001378411369 1345054905 /nfs/dbraw/zinc/05/49/05/1345054905.db2.gz COMJTEZGHAHDNP-FQEVSTJZSA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C1C[NH+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001378549578 1345156337 /nfs/dbraw/zinc/15/63/37/1345156337.db2.gz DYPXWONHUMJLOZ-MAUKXSAKSA-N 1 3 335.536 2.589 10 0 EFAEHO C[C@@H](NC(=O)[C@H](C)N1CCCCCC1)C1C[NH+](CC2CCCC2)C1 ZINC001378555050 1345159663 /nfs/dbraw/zinc/15/96/63/1345159663.db2.gz IWPGKTUIDGYEIG-SJORKVTESA-N 1 3 335.536 2.878 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001378583588 1345179385 /nfs/dbraw/zinc/17/93/85/1345179385.db2.gz CWZSLZFXBJMWAU-QGZVFWFLSA-N 1 3 345.531 2.965 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]Cc1cccc(F)c1 ZINC001378590510 1345183899 /nfs/dbraw/zinc/18/38/99/1345183899.db2.gz QVCYBWJKAXXDDL-HNNXBMFYSA-N 1 3 335.467 2.542 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)C[NH2+]CC1CCC2(CC2)CC1 ZINC001378601660 1345191208 /nfs/dbraw/zinc/19/12/08/1345191208.db2.gz BYEHZFGWETWHHU-IAGOWNOFSA-N 1 3 335.536 2.641 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@H+](CCCC2CCC2)CC1(C)C)N(C)C ZINC001378646886 1345222632 /nfs/dbraw/zinc/22/26/32/1345222632.db2.gz ASOBMYPTUCZQQY-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@@H+](CCCC2CCC2)CC1(C)C)N(C)C ZINC001378646886 1345222636 /nfs/dbraw/zinc/22/26/36/1345222636.db2.gz ASOBMYPTUCZQQY-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@H+](CC2CCCCC2)CC1(C)C)N(C)C ZINC001378650300 1345225692 /nfs/dbraw/zinc/22/56/92/1345225692.db2.gz GZBKQRRNRIGZOC-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@@H+](CC2CCCCC2)CC1(C)C)N(C)C ZINC001378650300 1345225694 /nfs/dbraw/zinc/22/56/94/1345225694.db2.gz GZBKQRRNRIGZOC-QZTJIDSGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@H+](CC2CCCCC2)CC1(C)C)N(C)C ZINC001378650303 1345225953 /nfs/dbraw/zinc/22/59/53/1345225953.db2.gz GZBKQRRNRIGZOC-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@@H+](CC2CCCCC2)CC1(C)C)N(C)C ZINC001378650303 1345225954 /nfs/dbraw/zinc/22/59/54/1345225954.db2.gz GZBKQRRNRIGZOC-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+]Cc2ccc(C)nc2C)CCCC1)N(C)C ZINC001378708694 1345263886 /nfs/dbraw/zinc/26/38/86/1345263886.db2.gz JDYLDUZGFLTOCW-SFHVURJKSA-N 1 3 346.519 2.557 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]CCc2ccccc2F)CCCC1 ZINC001378719268 1345273296 /nfs/dbraw/zinc/27/32/96/1345273296.db2.gz QBUQBEVJAUFJOS-UHFFFAOYSA-N 1 3 349.494 2.727 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@H](C)c3cccc(F)c3)C[C@H]21 ZINC001378740010 1345286120 /nfs/dbraw/zinc/28/61/20/1345286120.db2.gz APMOOGAYTYDEBG-AXUOBQJMSA-N 1 3 347.478 2.521 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@H](C)c3cccc(F)c3)C[C@H]21 ZINC001378740010 1345286123 /nfs/dbraw/zinc/28/61/23/1345286123.db2.gz APMOOGAYTYDEBG-AXUOBQJMSA-N 1 3 347.478 2.521 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N1CCCC2(CN(C(=O)CC[NH+](C)C)C2)C1 ZINC001378793922 1345318102 /nfs/dbraw/zinc/31/81/02/1345318102.db2.gz ANQFLHBZMMRIOI-MRXNPFEDSA-N 1 3 347.478 2.763 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)N(C)C(=O)[C@@H](C(C)C)[NH+](C)C)n1 ZINC001378807503 1345329496 /nfs/dbraw/zinc/32/94/96/1345329496.db2.gz DOHSFJNUUGRPPC-VQIMIIECSA-N 1 3 348.535 2.728 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)N(C)C(=O)C[N@@H+]1CC[C@H](C)C1 ZINC001378837602 1345350858 /nfs/dbraw/zinc/35/08/58/1345350858.db2.gz WYJKPGXSPVMEMP-QWHCGFSZSA-N 1 3 343.924 2.680 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)N(C)C(=O)C[N@H+]1CC[C@H](C)C1 ZINC001378837602 1345350862 /nfs/dbraw/zinc/35/08/62/1345350862.db2.gz WYJKPGXSPVMEMP-QWHCGFSZSA-N 1 3 343.924 2.680 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(OC)cc1 ZINC001378863591 1345374151 /nfs/dbraw/zinc/37/41/51/1345374151.db2.gz XSSKWGVKYLQGCM-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1C[C@@H](C[NH2+][C@@H](CC)c2ccccc2)C1)N(C)C ZINC001378868929 1345378501 /nfs/dbraw/zinc/37/85/01/1345378501.db2.gz IZCCNLLSFJCENL-DSLXNQLJSA-N 1 3 331.504 2.962 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1C[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001378892039 1345402110 /nfs/dbraw/zinc/40/21/10/1345402110.db2.gz OSKAIJNQZMMKBC-SZMVWBNQSA-N 1 3 335.467 2.594 10 0 EFAEHO CCc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001378899769 1345409434 /nfs/dbraw/zinc/40/94/34/1345409434.db2.gz PKDYQTMXTCFZET-XLIONFOSSA-N 1 3 345.531 2.916 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccc(C)c(C)c1)C(C)C)N(C)C ZINC001378970374 1345468370 /nfs/dbraw/zinc/46/83/70/1345468370.db2.gz UZDOALWEMLKCBQ-RTBURBONSA-N 1 3 333.520 2.874 10 0 EFAEHO CC(C)[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccsc1 ZINC001378971281 1345469229 /nfs/dbraw/zinc/46/92/29/1345469229.db2.gz JTCIDISMJJOSLC-INIZCTEOSA-N 1 3 337.533 2.853 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)[C@@H](C[NH2+]CC2CCCCC2)C2CC2)C1 ZINC001379032016 1345513814 /nfs/dbraw/zinc/51/38/14/1345513814.db2.gz OMYLFRCROMXSKA-LPHOPBHVSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C2CC2)N(C)C(=O)CN(C)C(C)C)cc1C ZINC001379064704 1345544457 /nfs/dbraw/zinc/54/44/57/1345544457.db2.gz ZNZQKOGNYMSMNZ-FQEVSTJZSA-N 1 3 345.531 2.970 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001379110828 1345588469 /nfs/dbraw/zinc/58/84/69/1345588469.db2.gz LIZTZLGVZYOQPU-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@H]1CCC[C@H]2CCC[N@H+]21 ZINC001379110828 1345588470 /nfs/dbraw/zinc/58/84/70/1345588470.db2.gz LIZTZLGVZYOQPU-VQTJNVASSA-N 1 3 343.515 2.902 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[N@H+](C)C[C@@H]2CCC(F)(F)C2)CC1 ZINC001379115575 1345591612 /nfs/dbraw/zinc/59/16/12/1345591612.db2.gz XRGYKJNEYPNJFZ-MRXNPFEDSA-N 1 3 345.478 2.544 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[N@@H+](C)C[C@@H]2CCC(F)(F)C2)CC1 ZINC001379115575 1345591615 /nfs/dbraw/zinc/59/16/15/1345591615.db2.gz XRGYKJNEYPNJFZ-MRXNPFEDSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001379128067 1345606617 /nfs/dbraw/zinc/60/66/17/1345606617.db2.gz SSXCKMMYLVXQTM-JKSUJKDBSA-N 1 3 335.467 2.619 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001379128067 1345606621 /nfs/dbraw/zinc/60/66/21/1345606621.db2.gz SSXCKMMYLVXQTM-JKSUJKDBSA-N 1 3 335.467 2.619 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001379387704 1345759527 /nfs/dbraw/zinc/75/95/27/1345759527.db2.gz XHBIXBCQDQIBGY-WBVHZDCISA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001379387704 1345759532 /nfs/dbraw/zinc/75/95/32/1345759532.db2.gz XHBIXBCQDQIBGY-WBVHZDCISA-N 1 3 335.467 2.603 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001379420663 1345775168 /nfs/dbraw/zinc/77/51/68/1345775168.db2.gz RUYBFYVVSVLJSX-IAGOWNOFSA-N 1 3 331.504 2.746 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+][C@H](C)c1cccc(Cl)c1)N(C)C ZINC001379521400 1345825028 /nfs/dbraw/zinc/82/50/28/1345825028.db2.gz JOLQFTOPTVIFMR-WOSRLPQWSA-N 1 3 325.884 2.836 10 0 EFAEHO C[C@@H](C[NH2+]C[C@H]1CCCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001379549762 1345849006 /nfs/dbraw/zinc/84/90/06/1345849006.db2.gz FFXCIHUNDCFMKO-GJZGRUSLSA-N 1 3 347.494 2.884 10 0 EFAEHO CC(C)CC[NH2+][C@H]1C[C@H](C)N(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001379589711 1345898129 /nfs/dbraw/zinc/89/81/29/1345898129.db2.gz TVNRHJWJIOZMIM-LPHOPBHVSA-N 1 3 331.504 2.987 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@@H]([C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001393899939 1357269820 /nfs/dbraw/zinc/26/98/20/1357269820.db2.gz VOVLCXITHRNXMG-RTBURBONSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@@H]([C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001393899939 1357269824 /nfs/dbraw/zinc/26/98/24/1357269824.db2.gz VOVLCXITHRNXMG-RTBURBONSA-N 1 3 337.552 2.933 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CCC3CC3)[C@H]2C1)CC(C)(C)C ZINC001379634025 1345954638 /nfs/dbraw/zinc/95/46/38/1345954638.db2.gz YVZWHIUCEQPKKX-GBESFXJTSA-N 1 3 349.563 2.981 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1sccc1Cl)N(C)C ZINC001418403319 1373983545 /nfs/dbraw/zinc/98/35/45/1373983545.db2.gz BOBFBLYGXLJRLG-DGCLKSJQSA-N 1 3 331.913 2.726 10 0 EFAEHO COc1cccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)c1 ZINC001393962336 1357328522 /nfs/dbraw/zinc/32/85/22/1357328522.db2.gz RXLVPUJPBFPJKO-JKSUJKDBSA-N 1 3 347.503 2.552 10 0 EFAEHO Cc1ccc(CN2CCC[C@@H](NC(=O)CC[NH+](C)C)[C@H]2C)cc1C ZINC001379647403 1347224529 /nfs/dbraw/zinc/22/45/29/1347224529.db2.gz CYTYCLPCJODAHJ-IEBWSBKVSA-N 1 3 331.504 2.724 10 0 EFAEHO Cc1cc(CN2CCC[C@@H](NC(=O)CC[NH+](C)C)[C@@H]2C)c(C)s1 ZINC001379671000 1347246476 /nfs/dbraw/zinc/24/64/76/1347246476.db2.gz VBHDQLQBOOUNIX-WMLDXEAASA-N 1 3 337.533 2.786 10 0 EFAEHO CN(CC(=O)N1C[C@H]([NH2+]C/C=C/Cl)C(C)(C)C1)CC(C)(C)C ZINC001379720751 1347283744 /nfs/dbraw/zinc/28/37/44/1347283744.db2.gz VXUFXQPNTUVVED-NPQIQWPPSA-N 1 3 329.916 2.543 10 0 EFAEHO COc1cccc([C@@H](C)N(C)C[C@H](C)NC(=O)C2(C[NH+](C)C)CC2)c1 ZINC001379724171 1347286877 /nfs/dbraw/zinc/28/68/77/1347286877.db2.gz NVNGAJBHAQKHFC-JKSUJKDBSA-N 1 3 347.503 2.535 10 0 EFAEHO C[C@@H](CN(C)[C@@H](C)c1cccc(Cl)c1)NC(=O)CC[NH+](C)C ZINC001379744851 1347301566 /nfs/dbraw/zinc/30/15/66/1347301566.db2.gz SDOARJWMUUGRIO-KBPBESRZSA-N 1 3 325.884 2.789 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@H+](C)CC1CCC(F)(F)CC1)N(C)C ZINC001379770999 1347322075 /nfs/dbraw/zinc/32/20/75/1347322075.db2.gz YGVPBJFKPUSLLQ-UKRRQHHQSA-N 1 3 333.467 2.589 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@@H+](C)CC1CCC(F)(F)CC1)N(C)C ZINC001379770999 1347322077 /nfs/dbraw/zinc/32/20/77/1347322077.db2.gz YGVPBJFKPUSLLQ-UKRRQHHQSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C[N@H+](C)CCC1CCCCC1)N(C)C ZINC001379776338 1347326205 /nfs/dbraw/zinc/32/62/05/1347326205.db2.gz ZLCIFZMVSJWQSY-WMZOPIPTSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C[N@@H+](C)CCC1CCCCC1)N(C)C ZINC001379776338 1347326211 /nfs/dbraw/zinc/32/62/11/1347326211.db2.gz ZLCIFZMVSJWQSY-WMZOPIPTSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC001379792789 1347343142 /nfs/dbraw/zinc/34/31/42/1347343142.db2.gz BQRUKKZOHOZDFV-QFBILLFUSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC001379792789 1347343146 /nfs/dbraw/zinc/34/31/46/1347343146.db2.gz BQRUKKZOHOZDFV-QFBILLFUSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CN(C)Cc1cccc(F)c1)[NH+]1CCCC1 ZINC001379799503 1347348235 /nfs/dbraw/zinc/34/82/35/1347348235.db2.gz OYGSXZDUNHTPGU-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)(C(=O)N[C@@H](C[NH2+]Cc1cccc(F)c1)C1CC1)N1CCCC1 ZINC001379898659 1347394376 /nfs/dbraw/zinc/39/43/76/1347394376.db2.gz RHPPKTGXUXRBJQ-SFHVURJKSA-N 1 3 347.478 2.685 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]CCc1ccccc1 ZINC001379940827 1347415076 /nfs/dbraw/zinc/41/50/76/1347415076.db2.gz ORACUWFBPMFCOQ-VQTJNVASSA-N 1 3 345.531 2.786 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]CCc1ccccc1 ZINC001379940820 1347415209 /nfs/dbraw/zinc/41/52/09/1347415209.db2.gz ORACUWFBPMFCOQ-UXHICEINSA-N 1 3 345.531 2.786 10 0 EFAEHO CCc1ccc(CN(C)CCN(C(=O)[C@H]2CC[N@H+](C)C2)C(C)C)cc1 ZINC001380044008 1347482389 /nfs/dbraw/zinc/48/23/89/1347482389.db2.gz YXJUEFXNJBCQJN-FQEVSTJZSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1ccc(CN(C)CCN(C(=O)[C@H]2CC[N@@H+](C)C2)C(C)C)cc1 ZINC001380044008 1347482390 /nfs/dbraw/zinc/48/23/90/1347482390.db2.gz YXJUEFXNJBCQJN-FQEVSTJZSA-N 1 3 345.531 2.870 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+][C@H](C)c2ccc(Cl)cc2)CC1)N(C)C ZINC001380099666 1347514451 /nfs/dbraw/zinc/51/44/51/1347514451.db2.gz GSFXDXVJTSZETM-CZUORRHYSA-N 1 3 337.895 2.980 10 0 EFAEHO CN(CC(=O)NCC1([NH2+][C@@H]2CCc3ccc(F)cc32)CC1)C1CCC1 ZINC001380107772 1347517497 /nfs/dbraw/zinc/51/74/97/1347517497.db2.gz YBVISKVWLGBFFS-GOSISDBHSA-N 1 3 345.462 2.536 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]C2(CNC(=O)[C@@H](C(C)C)N(C)C)CC2)c1 ZINC001380138315 1347528928 /nfs/dbraw/zinc/52/89/28/1347528928.db2.gz OLVVBXCVFUVXIA-SJLPKXTDSA-N 1 3 331.504 2.881 10 0 EFAEHO CN(C)C1(C(=O)N(C)C2CC([NH2+][C@H]3CCc4ccccc43)C2)CCC1 ZINC001380158168 1347539963 /nfs/dbraw/zinc/53/99/63/1347539963.db2.gz YUHNTVFEXKFEDB-TVPLGVNVSA-N 1 3 341.499 2.737 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+][C@@H]2CCCc3ccc(F)cc32)CC1 ZINC001380169949 1347546300 /nfs/dbraw/zinc/54/63/00/1347546300.db2.gz JABVIYWYBGGTGJ-GOSISDBHSA-N 1 3 347.478 2.782 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@](C)(C[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001380427957 1347665083 /nfs/dbraw/zinc/66/50/83/1347665083.db2.gz VLQGKYQBIQGYAB-PKOBYXMFSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](F)C[NH+]1CCC(C)(CNC(=O)CN(C)CC(C)(C)C)CC1 ZINC001380450845 1347680913 /nfs/dbraw/zinc/68/09/13/1347680913.db2.gz VDPQORHRVIGEHC-INIZCTEOSA-N 1 3 343.531 2.931 10 0 EFAEHO CC(C)[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001380519957 1347738883 /nfs/dbraw/zinc/73/88/83/1347738883.db2.gz QGLFOVYJXXLLRO-HNNXBMFYSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)[N@H+]1CCC(F)(F)[C@@H](CNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001380519957 1347738887 /nfs/dbraw/zinc/73/88/87/1347738887.db2.gz QGLFOVYJXXLLRO-HNNXBMFYSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1C[N@H+](CC2CCCC2)CCC1(F)F ZINC001380520414 1347739028 /nfs/dbraw/zinc/73/90/28/1347739028.db2.gz MFOVMNMJMACFET-MRXNPFEDSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1C[N@@H+](CC2CCCC2)CCC1(F)F ZINC001380520414 1347739030 /nfs/dbraw/zinc/73/90/30/1347739030.db2.gz MFOVMNMJMACFET-MRXNPFEDSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)[C@@H](C)NCc1ccccc1Cl ZINC001393999941 1357370424 /nfs/dbraw/zinc/37/04/24/1357370424.db2.gz RWQXQSXABVEGOB-KGLIPLIRSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)[C@@H](C)NCc1ccccc1Cl ZINC001393999941 1357370427 /nfs/dbraw/zinc/37/04/27/1357370427.db2.gz RWQXQSXABVEGOB-KGLIPLIRSA-N 1 3 325.884 2.665 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001380689722 1347815744 /nfs/dbraw/zinc/81/57/44/1347815744.db2.gz LUHFLHKFZAAUSE-WMZOPIPTSA-N 1 3 335.536 2.593 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2ccccc2C)C1 ZINC001380692030 1347816934 /nfs/dbraw/zinc/81/69/34/1347816934.db2.gz SGRLCFXKSMTUPH-MJGOQNOKSA-N 1 3 331.504 2.521 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CCC3CCCCC3)C[C@@H]2C1 ZINC001380707260 1347826680 /nfs/dbraw/zinc/82/66/80/1347826680.db2.gz XMVFHQGHEBSBPV-KDURUIRLSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CCC3CCCCC3)C[C@@H]2C1 ZINC001380707260 1347826686 /nfs/dbraw/zinc/82/66/86/1347826686.db2.gz XMVFHQGHEBSBPV-KDURUIRLSA-N 1 3 335.536 2.687 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1CC[C@H](C[NH2+]CC2CC2)CC1 ZINC001380707898 1347827468 /nfs/dbraw/zinc/82/74/68/1347827468.db2.gz QRAJAMQIFVTMFC-YOQCTACHSA-N 1 3 335.536 2.781 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1CC[C@H](C[NH2+]CC2CC2)CC1 ZINC001380707896 1347827584 /nfs/dbraw/zinc/82/75/84/1347827584.db2.gz QRAJAMQIFVTMFC-CAMMJAKZSA-N 1 3 335.536 2.781 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@H]2[C@H]1CCN2CCC(F)(F)F ZINC001380754547 1347849853 /nfs/dbraw/zinc/84/98/53/1347849853.db2.gz ARORBSUOZKLDAV-LSDHHAIUSA-N 1 3 349.441 2.736 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@H]2[C@H]1CCN2CCC(F)(F)F ZINC001380754547 1347849856 /nfs/dbraw/zinc/84/98/56/1347849856.db2.gz ARORBSUOZKLDAV-LSDHHAIUSA-N 1 3 349.441 2.736 10 0 EFAEHO CC[C@@H](F)CN[C@H](C)c1ccc(CNC(=O)C23CC[NH+](CC2)C3)cc1 ZINC001380786111 1347877677 /nfs/dbraw/zinc/87/76/77/1347877677.db2.gz YJUGZEQCIIVLSS-CRAIPNDOSA-N 1 3 347.478 2.797 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](Cc2csc(C)c2)CC1)N(C)C ZINC001380928710 1347961015 /nfs/dbraw/zinc/96/10/15/1347961015.db2.gz GWVGHSCEIZOVGK-DLBZAZTESA-N 1 3 337.533 2.867 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](Cc2csc(C)c2)CC1)N(C)C ZINC001380928710 1347961019 /nfs/dbraw/zinc/96/10/19/1347961019.db2.gz GWVGHSCEIZOVGK-DLBZAZTESA-N 1 3 337.533 2.867 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](CCc2ccccc2F)CC1)N(C)C ZINC001380940192 1347971918 /nfs/dbraw/zinc/97/19/18/1347971918.db2.gz RSUUHNRGUXGMNN-PKOBYXMFSA-N 1 3 349.494 2.679 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](CCc2ccccc2F)CC1)N(C)C ZINC001380940192 1347971921 /nfs/dbraw/zinc/97/19/21/1347971921.db2.gz RSUUHNRGUXGMNN-PKOBYXMFSA-N 1 3 349.494 2.679 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[N@H+](C)CC1CC(C)(C)C1)N(C)C ZINC001380956695 1347984084 /nfs/dbraw/zinc/98/40/84/1347984084.db2.gz ABZQLLHZUWFCNS-KRWDZBQOSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[N@@H+](C)CC1CC(C)(C)C1)N(C)C ZINC001380956695 1347984086 /nfs/dbraw/zinc/98/40/86/1347984086.db2.gz ABZQLLHZUWFCNS-KRWDZBQOSA-N 1 3 325.541 2.789 10 0 EFAEHO CN(CCC[N@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)[C@H]1CCCN1C ZINC001380945177 1347975261 /nfs/dbraw/zinc/97/52/61/1347975261.db2.gz AZHUTRYHRCQCFJ-LJQANCHMSA-N 1 3 342.487 2.542 10 0 EFAEHO CN(CCC[N@@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)[C@H]1CCCN1C ZINC001380945177 1347975262 /nfs/dbraw/zinc/97/52/62/1347975262.db2.gz AZHUTRYHRCQCFJ-LJQANCHMSA-N 1 3 342.487 2.542 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@H]1CCC[N@@H+]1C)Cc1ccsc1 ZINC001380957162 1347983863 /nfs/dbraw/zinc/98/38/63/1347983863.db2.gz GBJSADPAQGPRRL-QGZVFWFLSA-N 1 3 337.533 2.903 10 0 EFAEHO CN(CCCN(C)C(=O)CC[C@H]1CCC[N@H+]1C)Cc1ccsc1 ZINC001380957162 1347983866 /nfs/dbraw/zinc/98/38/66/1347983866.db2.gz GBJSADPAQGPRRL-QGZVFWFLSA-N 1 3 337.533 2.903 10 0 EFAEHO CN(CCCN(C)C(=O)C12CCC[NH+](CCC1)C2)Cc1ccsc1 ZINC001380963009 1347987781 /nfs/dbraw/zinc/98/77/81/1347987781.db2.gz UYPALYQVOYVEJM-UHFFFAOYSA-N 1 3 349.544 2.904 10 0 EFAEHO CCC(CC)C[NH2+]C1(C)CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001381127003 1348094624 /nfs/dbraw/zinc/09/46/24/1348094624.db2.gz BUSYKFRIHTXCQL-QGZVFWFLSA-N 1 3 325.541 2.980 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@@H]1CCN(Cc2ccsc2)[C@@H](C)C1 ZINC001381173940 1348121569 /nfs/dbraw/zinc/12/15/69/1348121569.db2.gz OVCMETGDJNAZDL-DOTOQJQBSA-N 1 3 337.533 2.949 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@@H]1CCN(Cc2ccsc2)[C@@H](C)C1 ZINC001381173940 1348121568 /nfs/dbraw/zinc/12/15/68/1348121568.db2.gz OVCMETGDJNAZDL-DOTOQJQBSA-N 1 3 337.533 2.949 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@H](C)[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001381214272 1348144153 /nfs/dbraw/zinc/14/41/53/1348144153.db2.gz NJQMZQOHSPZOTF-KKUMJFAQSA-N 1 3 333.467 2.637 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(Cl)cc1 ZINC001381215084 1348144483 /nfs/dbraw/zinc/14/44/83/1348144483.db2.gz YTHDRZDEUYLIAJ-CABCVRRESA-N 1 3 337.895 2.666 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001381232995 1348157125 /nfs/dbraw/zinc/15/71/25/1348157125.db2.gz BNTHCNPJBYDFGR-ZDUSSCGKSA-N 1 3 343.874 2.804 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@@H](C)CCNC(=O)CN(C)C(C)C ZINC001381234505 1348158194 /nfs/dbraw/zinc/15/81/94/1348158194.db2.gz TYUOGKDLXZUVMM-HNNXBMFYSA-N 1 3 339.911 2.973 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN(C)C1CCC1 ZINC001381274846 1348179013 /nfs/dbraw/zinc/17/90/13/1348179013.db2.gz HTNUTDVQHHJQBG-LXGCGDOSSA-N 1 3 347.478 2.591 10 0 EFAEHO C[C@H]([NH2+]CC1CC(NC(=O)CN(C)C2CCC2)C1)c1cccc(F)c1 ZINC001381332416 1348212888 /nfs/dbraw/zinc/21/28/88/1348212888.db2.gz VJUBMGROZFTZIG-SYJJWHGVSA-N 1 3 347.478 2.855 10 0 EFAEHO CN(CC(=O)NC1CC(C[NH2+][C@@H]2CCc3ccccc32)C1)C1CCC1 ZINC001381331669 1348213068 /nfs/dbraw/zinc/21/30/68/1348213068.db2.gz PCGINIYBLZBOLA-MKJPBZQASA-N 1 3 341.499 2.643 10 0 EFAEHO C[C@@H]([NH2+]CC1CC(F)(F)C1)[C@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001381369118 1348228148 /nfs/dbraw/zinc/22/81/48/1348228148.db2.gz FCMXNCAWTUMWGK-KGLIPLIRSA-N 1 3 345.478 2.779 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001381380854 1348233413 /nfs/dbraw/zinc/23/34/13/1348233413.db2.gz CCIKDPUCLLRIHU-UONOGXRCSA-N 1 3 345.478 2.779 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001381386469 1348235870 /nfs/dbraw/zinc/23/58/70/1348235870.db2.gz IAOMYZUTTOIFRX-CABCVRRESA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001381390291 1348237211 /nfs/dbraw/zinc/23/72/11/1348237211.db2.gz MDCWQNREZQFZRX-GJZGRUSLSA-N 1 3 335.467 2.601 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]C/C=C/c1ccccc1 ZINC001381394976 1348240351 /nfs/dbraw/zinc/24/03/51/1348240351.db2.gz RNFICWVVUCULAI-VESHTZQJSA-N 1 3 329.488 2.667 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]CCc1ccc(Cl)cc1 ZINC001381440931 1348277057 /nfs/dbraw/zinc/27/70/57/1348277057.db2.gz CIBVDRMVSIKDMZ-LSDHHAIUSA-N 1 3 339.911 2.706 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@@H](C)CNC(=O)[C@H]1CCC[N@H+]1C(C)C ZINC001381513728 1348322908 /nfs/dbraw/zinc/32/29/08/1348322908.db2.gz FDKBAFJQZXATFM-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@@H](C)CNC(=O)[C@H]1CCC[N@@H+]1C(C)C ZINC001381513728 1348322913 /nfs/dbraw/zinc/32/29/13/1348322913.db2.gz FDKBAFJQZXATFM-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@H](C)CNC(=O)[C@@H]1CCC[N@H+]1C(C)C ZINC001381513006 1348323251 /nfs/dbraw/zinc/32/32/51/1348323251.db2.gz CVWSUNQPBZCYFQ-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@H](C)CNC(=O)[C@@H]1CCC[N@@H+]1C(C)C ZINC001381513006 1348323254 /nfs/dbraw/zinc/32/32/54/1348323254.db2.gz CVWSUNQPBZCYFQ-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(C)c(F)c1 ZINC001381528213 1348332111 /nfs/dbraw/zinc/33/21/11/1348332111.db2.gz DTCIFKFYCWTSSF-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(C)c(F)c1 ZINC001381528213 1348332113 /nfs/dbraw/zinc/33/21/13/1348332113.db2.gz DTCIFKFYCWTSSF-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[N@H+](C)Cc1ccc(C)cc1 ZINC001381535655 1348337249 /nfs/dbraw/zinc/33/72/49/1348337249.db2.gz SYYKJUZPKPXADG-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[N@@H+](C)Cc1ccc(C)cc1 ZINC001381535655 1348337252 /nfs/dbraw/zinc/33/72/52/1348337252.db2.gz SYYKJUZPKPXADG-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC001381639306 1348424144 /nfs/dbraw/zinc/42/41/44/1348424144.db2.gz AVRRHTSEFKSKJV-HNAYVOBHSA-N 1 3 349.494 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC001381639306 1348424145 /nfs/dbraw/zinc/42/41/45/1348424145.db2.gz AVRRHTSEFKSKJV-HNAYVOBHSA-N 1 3 349.494 2.980 10 0 EFAEHO CCCC[C@@H](C[NH2+]CC1CC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001381745890 1348495636 /nfs/dbraw/zinc/49/56/36/1348495636.db2.gz IZQKHXCDVKKBIK-LPHOPBHVSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1C[NH+](CC/C=C\c2ccccc2)C1)N(C)C ZINC001381798386 1348533231 /nfs/dbraw/zinc/53/32/31/1348533231.db2.gz WKKCKYBZQSADQP-JENDGRHMSA-N 1 3 343.515 2.867 10 0 EFAEHO C[C@H](NC(=O)CC[NH+](C)C)C1CN(Cc2ccc3ccccc3c2)C1 ZINC001381801187 1348534867 /nfs/dbraw/zinc/53/48/67/1348534867.db2.gz GYOQCRUEVCMEFJ-INIZCTEOSA-N 1 3 339.483 2.728 10 0 EFAEHO C[C@H](NC(=O)CN(C)CC(C)(C)C)C1C[NH+](CC2CC3(CCC3)C2)C1 ZINC001381819367 1348549214 /nfs/dbraw/zinc/54/92/14/1348549214.db2.gz FXCZYXVEKDPIKG-INIZCTEOSA-N 1 3 349.563 2.981 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381860134 1348572225 /nfs/dbraw/zinc/57/22/25/1348572225.db2.gz BRGYLZLPDDITBH-SJORKVTESA-N 1 3 325.541 2.835 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381860134 1348572227 /nfs/dbraw/zinc/57/22/27/1348572227.db2.gz BRGYLZLPDDITBH-SJORKVTESA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CC(C)(C)C3)C[C@H]21)N1CCCC1 ZINC001381917413 1348604168 /nfs/dbraw/zinc/60/41/68/1348604168.db2.gz OIWAQKABNRWCTO-NNZMDNLPSA-N 1 3 347.547 2.591 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CC(C)(C)C3)C[C@H]21)N1CCCC1 ZINC001381917413 1348604170 /nfs/dbraw/zinc/60/41/70/1348604170.db2.gz OIWAQKABNRWCTO-NNZMDNLPSA-N 1 3 347.547 2.591 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001381977743 1348634513 /nfs/dbraw/zinc/63/45/13/1348634513.db2.gz ZOMIUXZNVZKKNQ-GUDVDZBRSA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)c1cccc(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)n1 ZINC001382007063 1348655909 /nfs/dbraw/zinc/65/59/09/1348655909.db2.gz JEUUQALOJLFTBZ-SAABIXHNSA-N 1 3 346.519 2.530 10 0 EFAEHO C[C@@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]CC[C@H]1CCCC1(F)F ZINC001382088333 1348710141 /nfs/dbraw/zinc/71/01/41/1348710141.db2.gz GOHQAZFXDPRTCP-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@H](C)[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001382121078 1348741829 /nfs/dbraw/zinc/74/18/29/1348741829.db2.gz HQMZFNBIOCLPJG-FUHWJXTLSA-N 1 3 337.552 2.980 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001382165844 1348788065 /nfs/dbraw/zinc/78/80/65/1348788065.db2.gz MUBYDTCAQBXDJM-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1cc(F)ccc1C ZINC001382166742 1348789057 /nfs/dbraw/zinc/78/90/57/1348789057.db2.gz OTBATKKXYYVQLT-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)[C@H]1C ZINC001382308329 1348858993 /nfs/dbraw/zinc/85/89/93/1348858993.db2.gz NVVIMEWDDGSQLE-MAUKXSAKSA-N 1 3 335.467 2.553 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)Cc2cccc(C)c2)CC[N@@H+]1C ZINC001394063412 1357432739 /nfs/dbraw/zinc/43/27/39/1357432739.db2.gz VIZGWTQTGVDAFI-NZSAHSFTSA-N 1 3 331.504 2.662 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)Cc2cccc(C)c2)CC[N@H+]1C ZINC001394063412 1357432742 /nfs/dbraw/zinc/43/27/42/1357432742.db2.gz VIZGWTQTGVDAFI-NZSAHSFTSA-N 1 3 331.504 2.662 10 0 EFAEHO CN(CC(=O)N1C[C@@H]([NH2+]CC2CCCC2)C(C)(C)C1)CC(C)(C)C ZINC001382367791 1348918653 /nfs/dbraw/zinc/91/86/53/1348918653.db2.gz IUDRCUZHGJDSMJ-QGZVFWFLSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)CCN(C(=O)CN2CCCC2)C(C)C)cc1 ZINC001382503042 1348968408 /nfs/dbraw/zinc/96/84/08/1348968408.db2.gz DFBPXSXMVLNQOR-UHFFFAOYSA-N 1 3 345.531 2.802 10 0 EFAEHO Cc1ccc(CC[N@H+](C)CCN(C(=O)CN2CCCC2)C(C)C)cc1 ZINC001382503042 1348968414 /nfs/dbraw/zinc/96/84/14/1348968414.db2.gz DFBPXSXMVLNQOR-UHFFFAOYSA-N 1 3 345.531 2.802 10 0 EFAEHO CC(C)N(CC[N@H+](C)CC1CC1)C(=O)c1cccc(CN(C)C)c1 ZINC001382505947 1348972123 /nfs/dbraw/zinc/97/21/23/1348972123.db2.gz QXTNTFSBDCGKRE-UHFFFAOYSA-N 1 3 331.504 2.941 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CC1CC1)C(=O)c1cccc(CN(C)C)c1 ZINC001382505947 1348972128 /nfs/dbraw/zinc/97/21/28/1348972128.db2.gz QXTNTFSBDCGKRE-UHFFFAOYSA-N 1 3 331.504 2.941 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1cccc(C)c1)C(C)(C)C)N(C)C ZINC001382534019 1349000186 /nfs/dbraw/zinc/00/01/86/1349000186.db2.gz MYOSXGLQEUPCHN-MSOLQXFVSA-N 1 3 333.520 2.956 10 0 EFAEHO CC(C)C[NH2+]C[C@H](NC(=O)[C@@H]1CCCN1CC(C)C)C(C)(C)C ZINC001382539208 1349006363 /nfs/dbraw/zinc/00/63/63/1349006363.db2.gz ZFGDJCCIXZIRFJ-IRXDYDNUSA-N 1 3 325.541 2.883 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1CC[NH+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001382551989 1349013169 /nfs/dbraw/zinc/01/31/69/1349013169.db2.gz OTXAILGGUPEHLZ-CRAIPNDOSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[N@@H+]1CCCC[C@H]1C(=O)N(C)C1CC(NCC=C(Cl)Cl)C1 ZINC001382588795 1349035772 /nfs/dbraw/zinc/03/57/72/1349035772.db2.gz GHHZWZLOONZSQZ-RUXDESIVSA-N 1 3 348.318 2.759 10 0 EFAEHO CC[N@H+]1CCCC[C@H]1C(=O)N(C)C1CC(NCC=C(Cl)Cl)C1 ZINC001382588795 1349035774 /nfs/dbraw/zinc/03/57/74/1349035774.db2.gz GHHZWZLOONZSQZ-RUXDESIVSA-N 1 3 348.318 2.759 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C1CC([NH2+]CC=C(Cl)Cl)C1 ZINC001382588795 1349035783 /nfs/dbraw/zinc/03/57/83/1349035783.db2.gz GHHZWZLOONZSQZ-RUXDESIVSA-N 1 3 348.318 2.759 10 0 EFAEHO CC[NH2+][C@H](CCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001394188140 1357568340 /nfs/dbraw/zinc/56/83/40/1357568340.db2.gz MQARBBKKGZLVHM-QAPCUYQASA-N 1 3 329.504 2.682 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H](C)C1C[NH+](Cc2cccc(C)c2)C1 ZINC001394225188 1357616269 /nfs/dbraw/zinc/61/62/69/1357616269.db2.gz PJZCNYXSCQHHIH-LPHOPBHVSA-N 1 3 349.494 2.611 10 0 EFAEHO C[C@@H](NC(=O)CCC[NH+](C)C)C1CN(Cc2ccc(C3CC3)cc2)C1 ZINC001394247737 1357635111 /nfs/dbraw/zinc/63/51/11/1357635111.db2.gz IUHQFFMNKVDYBL-MRXNPFEDSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2C[C@@H]([NH2+][C@H]3CCc4ccccc43)C2)C1 ZINC001388688103 1352921855 /nfs/dbraw/zinc/92/18/55/1352921855.db2.gz POVHQFOTEJZRNX-HBXLWWENSA-N 1 3 341.499 2.500 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccccc2C2CC2)C1 ZINC001388702698 1352933210 /nfs/dbraw/zinc/93/32/10/1352933210.db2.gz JHIHJPQGMPMRKX-UWUNEBHHSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@H](F)CC[NH2+][C@@H]1CC[C@H](CNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001388744844 1352971775 /nfs/dbraw/zinc/97/17/75/1352971775.db2.gz FWPSZEKKENMEOU-YESZJQIVSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccccc2C)C1)N(C)C ZINC001388758607 1352984069 /nfs/dbraw/zinc/98/40/69/1352984069.db2.gz IAXKORUGYSZMRE-QXAKKESOSA-N 1 3 331.504 2.710 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001388758358 1352984437 /nfs/dbraw/zinc/98/44/37/1352984437.db2.gz RICQTEDYWLPBLZ-RBUKOAKNSA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H](C)[NH2+]Cc1ccsc1 ZINC001389326428 1353305355 /nfs/dbraw/zinc/30/53/55/1353305355.db2.gz SIWYJSBYDRRGBO-NVXWUHKLSA-N 1 3 337.533 2.948 10 0 EFAEHO C[C@@H](F)CCN1CCC[C@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001389375977 1353345921 /nfs/dbraw/zinc/34/59/21/1353345921.db2.gz OEDFEWNABLHLRD-CVEARBPZSA-N 1 3 341.515 2.968 10 0 EFAEHO C[C@@H](F)CCN1CCC[C@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001389375977 1353345926 /nfs/dbraw/zinc/34/59/26/1353345926.db2.gz OEDFEWNABLHLRD-CVEARBPZSA-N 1 3 341.515 2.968 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC12CC[NH+](CCc1ccccc1)CC2)N(C)C ZINC001389519694 1353448424 /nfs/dbraw/zinc/44/84/24/1353448424.db2.gz JSVDXHIFAKASIS-RTBURBONSA-N 1 3 343.515 2.540 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC12CC[NH+](Cc1cccc(F)c1)CC2 ZINC001389530153 1353457702 /nfs/dbraw/zinc/45/77/02/1353457702.db2.gz PFRIKIQICUKLBH-GOSISDBHSA-N 1 3 347.478 2.637 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC12CC[NH+](CCc1cccs1)CC2)N(C)C ZINC001389533540 1353460999 /nfs/dbraw/zinc/46/09/99/1353460999.db2.gz UJNVJJNHGUFGEC-IAGOWNOFSA-N 1 3 349.544 2.602 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](NCc1ccccc1F)C1CC1 ZINC001389604303 1353504035 /nfs/dbraw/zinc/50/40/35/1353504035.db2.gz FKEMUFIGEFVZQF-RTBURBONSA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](NCc1ccccc1F)C1CC1 ZINC001389604303 1353504040 /nfs/dbraw/zinc/50/40/40/1353504040.db2.gz FKEMUFIGEFVZQF-RTBURBONSA-N 1 3 347.478 2.683 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2[C@H]3C[N@@H+](CCC4CCCCC4)C[C@H]32)CCC1 ZINC001394323755 1357701214 /nfs/dbraw/zinc/70/12/14/1357701214.db2.gz WSNYCWHNUHRKDV-LDLYASANSA-N 1 3 347.547 2.735 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2[C@H]3C[N@H+](CCC4CCCCC4)C[C@H]32)CCC1 ZINC001394323755 1357701219 /nfs/dbraw/zinc/70/12/19/1357701219.db2.gz WSNYCWHNUHRKDV-LDLYASANSA-N 1 3 347.547 2.735 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1ccccc1Cl)C1CC1)N(C)C ZINC001389699221 1353564124 /nfs/dbraw/zinc/56/41/24/1353564124.db2.gz UQYQXXBEKRFQCK-DLBZAZTESA-N 1 3 337.895 2.665 10 0 EFAEHO CCC(CC)C[NH2+][C@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001389806569 1353628556 /nfs/dbraw/zinc/62/85/56/1353628556.db2.gz YJEXWDLSWNROPV-QFBILLFUSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCc3c2cccc3F)C1)N(C)C ZINC001389983497 1353725061 /nfs/dbraw/zinc/72/50/61/1353725061.db2.gz FDSYLRHVHVAXGY-GTYSZEQSSA-N 1 3 347.478 2.636 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H]1C[C@@H](NC(=O)C2(C[NH+](C)C)CC2)C1 ZINC001389992927 1353729920 /nfs/dbraw/zinc/72/99/20/1353729920.db2.gz PTWDAOLVSINKFS-GASCZTMLSA-N 1 3 349.906 2.727 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2cccc(Cl)c2)C1 ZINC001390013750 1353743623 /nfs/dbraw/zinc/74/36/23/1353743623.db2.gz VYMQOJXIXMKDQF-XYPHTWIQSA-N 1 3 337.895 2.980 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CCC[N@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001390064941 1353778927 /nfs/dbraw/zinc/77/89/27/1353778927.db2.gz MDTCCDZMQNEENG-ROUUACIJSA-N 1 3 347.547 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CCC[N@@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001390064941 1353778931 /nfs/dbraw/zinc/77/89/31/1353778931.db2.gz MDTCCDZMQNEENG-ROUUACIJSA-N 1 3 347.547 2.737 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001390103667 1353808379 /nfs/dbraw/zinc/80/83/79/1353808379.db2.gz JFXMPLZDTHIGJE-HXUWFJFHSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1C[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001390154405 1353866920 /nfs/dbraw/zinc/86/69/20/1353866920.db2.gz IKBJCZFBRQGDNW-JKSUJKDBSA-N 1 3 345.478 2.733 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc(C)c(F)c1 ZINC001390394136 1354060406 /nfs/dbraw/zinc/06/04/06/1354060406.db2.gz AAWUPBOLXLIPLT-CRAIPNDOSA-N 1 3 335.467 2.603 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1cccc(CC)c1 ZINC001390410296 1354070545 /nfs/dbraw/zinc/07/05/45/1354070545.db2.gz WJXXXHKMDGLICP-VQIMIIECSA-N 1 3 331.504 2.718 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc(CF)cc1 ZINC001390452129 1354089726 /nfs/dbraw/zinc/08/97/26/1354089726.db2.gz HEAYHAXGBMDOMF-OAHLLOKOSA-N 1 3 335.467 2.625 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]Cc1cc2ccccc2s1)N(C)C ZINC001390505239 1354132580 /nfs/dbraw/zinc/13/25/80/1354132580.db2.gz HACHUTPVFJDQCN-CZUORRHYSA-N 1 3 333.501 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC001390541726 1354161113 /nfs/dbraw/zinc/16/11/13/1354161113.db2.gz SGCCTJONCBXCSP-ZDUSSCGKSA-N 1 3 345.409 2.640 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N1CC[C@@H](CNC/C(Cl)=C/Cl)C1 ZINC001390584561 1354187169 /nfs/dbraw/zinc/18/71/69/1354187169.db2.gz RKMATGITEITSRG-DDWFUKRFSA-N 1 3 348.318 2.616 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N1CC[C@@H](CNC/C(Cl)=C/Cl)C1 ZINC001390584561 1354187173 /nfs/dbraw/zinc/18/71/73/1354187173.db2.gz RKMATGITEITSRG-DDWFUKRFSA-N 1 3 348.318 2.616 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC001390607516 1354201650 /nfs/dbraw/zinc/20/16/50/1354201650.db2.gz IQKUCQSWYMIUAU-QZTJIDSGSA-N 1 3 335.467 2.683 10 0 EFAEHO C[C@@H](CCNC(=O)C(C)(C)[NH+]1CCCC1)NC/C(Cl)=C\Cl ZINC001390695937 1354287771 /nfs/dbraw/zinc/28/77/71/1354287771.db2.gz LBNPFBYEHMYZSP-CVCOIXHCSA-N 1 3 336.307 2.664 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@H](C)[NH2+]CC[C@H]1CCCC1(F)F ZINC001390719007 1354311106 /nfs/dbraw/zinc/31/11/06/1354311106.db2.gz LFPRFNPDXSXNQY-GXTWGEPZSA-N 1 3 342.434 2.571 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@H](C)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001390719008 1354311549 /nfs/dbraw/zinc/31/15/49/1354311549.db2.gz LFPRFNPDXSXNQY-JSGCOSHPSA-N 1 3 342.434 2.571 10 0 EFAEHO C[C@H](CCNC(=O)c1cccc(CN(C)C)c1)[NH2+]Cc1cncs1 ZINC001390730310 1354322155 /nfs/dbraw/zinc/32/21/55/1354322155.db2.gz RGAJEPYYMACZAN-CQSZACIVSA-N 1 3 346.500 2.503 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@H+](C)[C@@H]2CCc3ccc(Cl)cc32)CCC1 ZINC001390765762 1354352977 /nfs/dbraw/zinc/35/29/77/1354352977.db2.gz QDBOPNKFEMYXEZ-QGZVFWFLSA-N 1 3 349.906 2.860 10 0 EFAEHO CN(C)C1(C(=O)NCC[N@@H+](C)[C@@H]2CCc3ccc(Cl)cc32)CCC1 ZINC001390765762 1354352981 /nfs/dbraw/zinc/35/29/81/1354352981.db2.gz QDBOPNKFEMYXEZ-QGZVFWFLSA-N 1 3 349.906 2.860 10 0 EFAEHO CN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)[C@H]1CCc2ccc(Cl)cc21 ZINC001390847905 1354431671 /nfs/dbraw/zinc/43/16/71/1354431671.db2.gz VJAXTYIKVQZUAD-KSSFIOAISA-N 1 3 349.906 2.717 10 0 EFAEHO CN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)[C@H]1CCc2ccc(Cl)cc21 ZINC001390847905 1354431674 /nfs/dbraw/zinc/43/16/74/1354431674.db2.gz VJAXTYIKVQZUAD-KSSFIOAISA-N 1 3 349.906 2.717 10 0 EFAEHO CC(C)[C@H](C(=O)NCCN(C)Cc1ccc(C2CC2)cc1)[NH+](C)C ZINC001390850102 1354432970 /nfs/dbraw/zinc/43/29/70/1354432970.db2.gz KVCBQIVXNWHZJK-LJQANCHMSA-N 1 3 331.504 2.698 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)C3(N(C)C)CCC3)C2)c(C)c1 ZINC001394363911 1357737605 /nfs/dbraw/zinc/73/76/05/1357737605.db2.gz CTUHIQBNQIXXSR-UAPYVXQJSA-N 1 3 343.515 2.772 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(CCNC(=O)C[C@H]1CC[N@H+](C)C1)C1CC1 ZINC001391203187 1354931034 /nfs/dbraw/zinc/93/10/34/1354931034.db2.gz XPOHJTUZRRFDQE-JKSUJKDBSA-N 1 3 347.478 2.809 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)C1CC1 ZINC001391203187 1354931038 /nfs/dbraw/zinc/93/10/38/1354931038.db2.gz XPOHJTUZRRFDQE-JKSUJKDBSA-N 1 3 347.478 2.809 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H](C)[NH2+]CC2CC(C)(C)C2)CC1 ZINC001391240931 1354963841 /nfs/dbraw/zinc/96/38/41/1354963841.db2.gz GZEKEHURHNBFMD-INIZCTEOSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H](C)[NH2+]CC2CC(C)(C)C2)CC1 ZINC001391241857 1354964843 /nfs/dbraw/zinc/96/48/43/1354964843.db2.gz IDQGHOYFCSMVSP-MRXNPFEDSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](C/C=C/c2ccccc2)C1)N(C)C ZINC001391297939 1355038133 /nfs/dbraw/zinc/03/81/33/1355038133.db2.gz KQTCJFVVOZMWMS-RHYMJRRZSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](C/C=C/c2ccccc2)C1)N(C)C ZINC001391297939 1355038138 /nfs/dbraw/zinc/03/81/38/1355038138.db2.gz KQTCJFVVOZMWMS-RHYMJRRZSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CC[C@@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001391335638 1355090879 /nfs/dbraw/zinc/09/08/79/1355090879.db2.gz KPPJJUVNBFCJPS-IAGOWNOFSA-N 1 3 349.494 2.938 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CC[C@@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001391335638 1355090884 /nfs/dbraw/zinc/09/08/84/1355090884.db2.gz KPPJJUVNBFCJPS-IAGOWNOFSA-N 1 3 349.494 2.938 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[N@H+](C)CC2CCC(C)CC2)C1 ZINC001391350288 1355108961 /nfs/dbraw/zinc/10/89/61/1355108961.db2.gz CUWIMPGDNIEXSA-ACBHZAAOSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[N@@H+](C)CC2CCC(C)CC2)C1 ZINC001391350288 1355108962 /nfs/dbraw/zinc/10/89/62/1355108962.db2.gz CUWIMPGDNIEXSA-ACBHZAAOSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)N1CC[C@H](CN(C)C/C=C\Cl)C1 ZINC001391354580 1355116220 /nfs/dbraw/zinc/11/62/20/1355116220.db2.gz IMQCMNMOLXCSSX-REEAJDFCSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)N1CC[C@H](CN(C)C/C=C\Cl)C1 ZINC001391354580 1355116223 /nfs/dbraw/zinc/11/62/23/1355116223.db2.gz IMQCMNMOLXCSSX-REEAJDFCSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1C[NH2+]Cc1ccc(F)cc1 ZINC001398762397 1360770411 /nfs/dbraw/zinc/77/04/11/1360770411.db2.gz CBYPWKDQQAEBQD-GOSISDBHSA-N 1 3 335.467 2.637 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)[C@@H]1CCN([C@H]2CCCc3ccc(F)cc32)C1 ZINC001391617605 1355360019 /nfs/dbraw/zinc/36/00/19/1355360019.db2.gz FSWDSPPLPATJSP-MJGOQNOKSA-N 1 3 347.478 2.688 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](CC)[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001391694534 1355440793 /nfs/dbraw/zinc/44/07/93/1355440793.db2.gz HOCXDXATAWTWGQ-DLBZAZTESA-N 1 3 339.911 2.973 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@](C)(C[NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001391797606 1355540197 /nfs/dbraw/zinc/54/01/97/1355540197.db2.gz AYQDAZQQBYCDAE-IBGZPJMESA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@](C)(C[NH2+][C@H](C)c1ccccc1)C1CC1 ZINC001391799483 1355541453 /nfs/dbraw/zinc/54/14/53/1355541453.db2.gz DAOKGTMGRHPCIV-UZLBHIALSA-N 1 3 331.504 2.962 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@](C)(C[NH2+][C@@H]1CCc2ccccc21)C1CC1 ZINC001391801742 1355545162 /nfs/dbraw/zinc/54/51/62/1355545162.db2.gz HQKTYNYCIBZYIQ-TZIWHRDSSA-N 1 3 343.515 2.889 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@](C)(NC(=O)CN2CC[C@H](C)C2)C2CC2)cc1 ZINC001391809636 1355552698 /nfs/dbraw/zinc/55/26/98/1355552698.db2.gz GUEIFNOFKGZFLV-LAUBAEHRSA-N 1 3 343.515 2.711 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@](C)(NC(=O)CN1CC[C@H](C)C1)C1CC1 ZINC001391819327 1355563416 /nfs/dbraw/zinc/56/34/16/1355563416.db2.gz RXYUOLBGXGIWOL-HRAATJIYSA-N 1 3 343.515 2.711 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N[C@H]1CC[C@H]([NH2+]CCC(F)(F)F)CC1 ZINC001391829761 1355572202 /nfs/dbraw/zinc/57/22/02/1355572202.db2.gz BUTCSGKCOMBTGV-AJNGGQMLSA-N 1 3 349.441 2.829 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[C@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001391830376 1355572943 /nfs/dbraw/zinc/57/29/43/1355572943.db2.gz DGHAULBLIHSOLN-YHUYYLMFSA-N 1 3 345.478 2.779 10 0 EFAEHO Cc1cc(CNCc2ccc(CNC(=O)CC[NH+](C)C)cc2)cs1 ZINC001391834527 1355577268 /nfs/dbraw/zinc/57/72/68/1355577268.db2.gz BPHSSNFMEPXUKY-UHFFFAOYSA-N 1 3 345.512 2.914 10 0 EFAEHO CC(C)CCC[NH+]1CCC(CCNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001391846999 1355590920 /nfs/dbraw/zinc/59/09/20/1355590920.db2.gz LXYJMUTZPSXMNM-GOSISDBHSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+][C@H](C)c1ccc(F)cc1F ZINC001391960800 1355683882 /nfs/dbraw/zinc/68/38/82/1355683882.db2.gz CZZOERQHHFQDFM-UONOGXRCSA-N 1 3 341.446 2.708 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+]Cc1cc(F)ccc1Cl ZINC001391965256 1355687447 /nfs/dbraw/zinc/68/74/47/1355687447.db2.gz PYIVQTLJHWKUMM-CYBMUJFWSA-N 1 3 343.874 2.661 10 0 EFAEHO C[C@H](C[NH2+][C@@H]1CCc2ccccc21)N(C)C(=O)CN1CCC(C)CC1 ZINC001392112922 1355776171 /nfs/dbraw/zinc/77/61/71/1355776171.db2.gz PGNSORNNSHLSFW-YLJYHZDGSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001392126983 1355787778 /nfs/dbraw/zinc/78/77/78/1355787778.db2.gz USUNYZDEZHCIRC-IEBWSBKVSA-N 1 3 333.520 2.889 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]Cc1ccc(F)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001392159159 1355813496 /nfs/dbraw/zinc/81/34/96/1355813496.db2.gz FKYBZHCNLWKUNF-LPHOPBHVSA-N 1 3 349.494 2.788 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H](NC(=O)C1(N(C)C)CCC1)C1CCCCC1 ZINC001392163832 1355817661 /nfs/dbraw/zinc/81/76/61/1355817661.db2.gz KKVVFYYFVVLHLC-IRXDYDNUSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccc(F)cc1 ZINC001392225682 1355879506 /nfs/dbraw/zinc/87/95/06/1355879506.db2.gz XZCHAFQDTHKAGE-OALUTQOASA-N 1 3 349.494 2.929 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H]1CCc2c1cccc2F ZINC001392256215 1355912790 /nfs/dbraw/zinc/91/27/90/1355912790.db2.gz QCHHWGINYXZAOC-RBUKOAKNSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)[C@@H](C)c2ccccc2)CC[N@@H+]1C ZINC001392281078 1355936543 /nfs/dbraw/zinc/93/65/43/1355936543.db2.gz UODWYVQGMWOVIQ-YTQUADARSA-N 1 3 331.504 2.868 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)[C@@H](C)c2ccccc2)CC[N@H+]1C ZINC001392281078 1355936546 /nfs/dbraw/zinc/93/65/46/1355936546.db2.gz UODWYVQGMWOVIQ-YTQUADARSA-N 1 3 331.504 2.868 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001392286163 1355941965 /nfs/dbraw/zinc/94/19/65/1355941965.db2.gz UOYVIJKKTSGOBI-IBGZPJMESA-N 1 3 331.504 2.760 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001392286163 1355941969 /nfs/dbraw/zinc/94/19/69/1355941969.db2.gz UOYVIJKKTSGOBI-IBGZPJMESA-N 1 3 331.504 2.760 10 0 EFAEHO CCc1ccccc1CN(C)CCN(C)C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001392298094 1355954757 /nfs/dbraw/zinc/95/47/57/1355954757.db2.gz OCQQVCIGJVZSSX-HKUYNNGSSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1ccccc1CN(C)CCN(C)C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001392298094 1355954761 /nfs/dbraw/zinc/95/47/61/1355954761.db2.gz OCQQVCIGJVZSSX-HKUYNNGSSA-N 1 3 345.531 2.870 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[N@H+](C)CC1CC2(CCC2)C1 ZINC001392334715 1356002123 /nfs/dbraw/zinc/00/21/23/1356002123.db2.gz VHNOXJCABKIAAA-GOSISDBHSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[N@@H+](C)CC1CC2(CCC2)C1 ZINC001392334715 1356002126 /nfs/dbraw/zinc/00/21/26/1356002126.db2.gz VHNOXJCABKIAAA-GOSISDBHSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[C@H]1C[NH2+]CC1CC2(CCC2)C1 ZINC001392353545 1356015331 /nfs/dbraw/zinc/01/53/31/1356015331.db2.gz NAOOUMKXYFMGRP-ROUUACIJSA-N 1 3 335.536 2.783 10 0 EFAEHO C[C@H](C[NH2+]Cc1cccc2ccccc21)NC(=O)CN1CC[C@@H](C)C1 ZINC001392511034 1356087349 /nfs/dbraw/zinc/08/73/49/1356087349.db2.gz KUKDQGLIQRCZMY-IAGOWNOFSA-N 1 3 339.483 2.776 10 0 EFAEHO C[C@@H](C[N@H+](C)Cc1ccc2cc[nH]c2c1)NC(=O)CN(C)C1CCC1 ZINC001392662885 1356209997 /nfs/dbraw/zinc/20/99/97/1356209997.db2.gz UYRKTYQMDQDPQB-HNNXBMFYSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@@H](C[N@@H+](C)Cc1ccc2cc[nH]c2c1)NC(=O)CN(C)C1CCC1 ZINC001392662885 1356210005 /nfs/dbraw/zinc/21/00/05/1356210005.db2.gz UYRKTYQMDQDPQB-HNNXBMFYSA-N 1 3 342.487 2.589 10 0 EFAEHO CC(C)CC[N@H+](C)C[C@@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001392688143 1356238345 /nfs/dbraw/zinc/23/83/45/1356238345.db2.gz RHBCHEVFHPNBTR-CRAIPNDOSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)CC[N@@H+](C)C[C@@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001392688143 1356238350 /nfs/dbraw/zinc/23/83/50/1356238350.db2.gz RHBCHEVFHPNBTR-CRAIPNDOSA-N 1 3 329.504 2.682 10 0 EFAEHO Cc1cccc(CCC[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001392691077 1356243261 /nfs/dbraw/zinc/24/32/61/1356243261.db2.gz XYFVQDFVUCCRKG-OALUTQOASA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1cccc(CCC[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001392691077 1356243265 /nfs/dbraw/zinc/24/32/65/1356243265.db2.gz XYFVQDFVUCCRKG-OALUTQOASA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001392728610 1356287350 /nfs/dbraw/zinc/28/73/50/1356287350.db2.gz NRDBKIBLJMVGIQ-ZWKOTPCHSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001392728610 1356287356 /nfs/dbraw/zinc/28/73/56/1356287356.db2.gz NRDBKIBLJMVGIQ-ZWKOTPCHSA-N 1 3 345.531 2.568 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCc2ccccc21)C(=O)CN(C)C1CCC1 ZINC001401610137 1362970650 /nfs/dbraw/zinc/97/06/50/1362970650.db2.gz QUIWFLYHJIEUKO-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]C[C@@H](NC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001392803144 1356340201 /nfs/dbraw/zinc/34/02/01/1356340201.db2.gz SDBDCYXKJODWPH-QFBILLFUSA-N 1 3 331.504 2.881 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN2CCC(C)CC2)CC[C@H]1[NH2+]CCC(C)C ZINC001392805390 1356342285 /nfs/dbraw/zinc/34/22/85/1356342285.db2.gz FQZZMPKOFMCIBY-RTBURBONSA-N 1 3 337.552 2.981 10 0 EFAEHO CN(CC(=O)NCC1([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CC1)CC(C)(C)C ZINC001392933808 1356443773 /nfs/dbraw/zinc/44/37/73/1356443773.db2.gz ZPSHKFJTDVPRIG-IXDOHACOSA-N 1 3 335.536 2.639 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+][C@H]2CCCc3ccc(F)cc32)CC1)N(C)C ZINC001392935613 1356445259 /nfs/dbraw/zinc/44/52/59/1356445259.db2.gz DYJFDWFQLNUKMJ-ROUUACIJSA-N 1 3 347.478 2.782 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+][C@H](C)c2cccc(Cl)c2)CC1 ZINC001392949317 1356458010 /nfs/dbraw/zinc/45/80/10/1356458010.db2.gz LHGCOECBFQIZLD-CQSZACIVSA-N 1 3 337.895 2.981 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C1(CNC(=O)CN(C)C(C)C)CC1 ZINC001392963949 1356471120 /nfs/dbraw/zinc/47/11/20/1356471120.db2.gz KOKBZRSWTZCFOE-UHFFFAOYSA-N 1 3 331.504 2.889 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H]2CC[N@H+](C[C@H](F)CC)C2)CC1 ZINC001392971737 1356478680 /nfs/dbraw/zinc/47/86/80/1356478680.db2.gz RSUPAJBLDXHEPJ-QZTJIDSGSA-N 1 3 341.515 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H]2CC[N@@H+](C[C@H](F)CC)C2)CC1 ZINC001392971737 1356478682 /nfs/dbraw/zinc/47/86/82/1356478682.db2.gz RSUPAJBLDXHEPJ-QZTJIDSGSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](C(=O)N1CCC([N@H+](CC[C@H](C)F)CC2CC2)CC1)N(C)C ZINC001392976394 1356483936 /nfs/dbraw/zinc/48/39/36/1356483936.db2.gz VBEWQBMWJNUQNC-YJBOKZPZSA-N 1 3 341.515 2.778 10 0 EFAEHO CC[C@@H](C(=O)N1CCC([N@@H+](CC[C@H](C)F)CC2CC2)CC1)N(C)C ZINC001392976394 1356483938 /nfs/dbraw/zinc/48/39/38/1356483938.db2.gz VBEWQBMWJNUQNC-YJBOKZPZSA-N 1 3 341.515 2.778 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CC[C@]3(CCN(Cc4ccsc4)C3)C2)CC1 ZINC001392986485 1356491940 /nfs/dbraw/zinc/49/19/40/1356491940.db2.gz PSDSUXHOACRWNW-SFHVURJKSA-N 1 3 347.528 2.514 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(CC[N@H+](Cc3ccsc3)C2)C1 ZINC001392991314 1356495801 /nfs/dbraw/zinc/49/58/01/1356495801.db2.gz LONQXPZPNYNQAI-SFHVURJKSA-N 1 3 335.517 2.513 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(CC[N@@H+](Cc3ccsc3)C2)C1 ZINC001392991314 1356495804 /nfs/dbraw/zinc/49/58/04/1356495804.db2.gz LONQXPZPNYNQAI-SFHVURJKSA-N 1 3 335.517 2.513 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@]2(CC[N@H+](CC3CC(C)(C)C3)C2)C1 ZINC001392994128 1356497966 /nfs/dbraw/zinc/49/79/66/1356497966.db2.gz UHTTWXXZEIOSAB-FQEVSTJZSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@]2(CC[N@@H+](CC3CC(C)(C)C3)C2)C1 ZINC001392994128 1356497969 /nfs/dbraw/zinc/49/79/69/1356497969.db2.gz UHTTWXXZEIOSAB-FQEVSTJZSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@]2(CC[N@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001402014240 1363331233 /nfs/dbraw/zinc/33/12/33/1363331233.db2.gz NNWQAZQPCBKBKH-NRFANRHFSA-N 1 3 347.547 2.833 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@]2(CC[N@@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001402014240 1363331240 /nfs/dbraw/zinc/33/12/40/1363331240.db2.gz NNWQAZQPCBKBKH-NRFANRHFSA-N 1 3 347.547 2.833 10 0 EFAEHO CCCN(C)CC(=O)NC1(C)CC[NH+](C[C@H]2CCC(F)(F)C2)CC1 ZINC001393071230 1356558735 /nfs/dbraw/zinc/55/87/35/1356558735.db2.gz TVDMLUGDOQMTSK-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCCC[C@]2(CCN(C/C=C/Cl)C2)C1 ZINC001393084707 1356577891 /nfs/dbraw/zinc/57/78/91/1356577891.db2.gz ACNPRZOBBXTWAL-WGLAMXGCSA-N 1 3 341.927 2.785 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCCC[C@]2(CCN(C/C=C/Cl)C2)C1 ZINC001393084707 1356577895 /nfs/dbraw/zinc/57/78/95/1356577895.db2.gz ACNPRZOBBXTWAL-WGLAMXGCSA-N 1 3 341.927 2.785 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@]1(C)CCN([C@@H]2CCCc3ccc(F)cc32)C1 ZINC001393107340 1356602453 /nfs/dbraw/zinc/60/24/53/1356602453.db2.gz LPHXZCXMAVYSAA-UYAOXDASSA-N 1 3 347.478 2.735 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@]1(C)CCC[N@H+](CCC2CC2)C1 ZINC001393201847 1356713007 /nfs/dbraw/zinc/71/30/07/1356713007.db2.gz GHULVTLATNIRFI-UYAOXDASSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@]1(C)CCC[N@@H+](CCC2CC2)C1 ZINC001393201847 1356713010 /nfs/dbraw/zinc/71/30/10/1356713010.db2.gz GHULVTLATNIRFI-UYAOXDASSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCc1ccccc1)C2 ZINC001393365962 1356789249 /nfs/dbraw/zinc/78/92/49/1356789249.db2.gz GHKYWOGGJGGXMG-ZCNNSNEGSA-N 1 3 343.515 2.540 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCc1ccccc1)C2 ZINC001393365962 1356789253 /nfs/dbraw/zinc/78/92/53/1356789253.db2.gz GHKYWOGGJGGXMG-ZCNNSNEGSA-N 1 3 343.515 2.540 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C2CC[NH+](CCCF)CC2)C1 ZINC001393367612 1356791116 /nfs/dbraw/zinc/79/11/16/1356791116.db2.gz LMVDEMIRNCDUAO-GOSISDBHSA-N 1 3 341.515 2.638 10 0 EFAEHO CC[C@H](F)CN1CCC([C@H]2CCCN(C(=O)CC[NH+](C)C)C2)CC1 ZINC001393375634 1356797599 /nfs/dbraw/zinc/79/75/99/1356797599.db2.gz ZUYHSDCTVPCQQZ-ROUUACIJSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1C[NH2+]Cc1ccccc1 ZINC001393392739 1356813002 /nfs/dbraw/zinc/81/30/02/1356813002.db2.gz FKRHFCQLGVIZPG-MJGOQNOKSA-N 1 3 345.531 2.849 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]CC2CCCCCC2)C1 ZINC001393395758 1356814813 /nfs/dbraw/zinc/81/48/13/1356814813.db2.gz JQTRSCCFVFQBRD-PKOBYXMFSA-N 1 3 337.552 2.983 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]CC2CCCCCC2)C1 ZINC001393395752 1356815076 /nfs/dbraw/zinc/81/50/76/1356815076.db2.gz JQTRSCCFVFQBRD-MJGOQNOKSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]([NH2+]Cc2cccc(Cl)c2)C2CC2)C1 ZINC001402326946 1363607707 /nfs/dbraw/zinc/60/77/07/1363607707.db2.gz PLEADTBKBUUTDX-KBXCAEBGSA-N 1 3 349.906 2.666 10 0 EFAEHO CC[C@H](F)CN1CC[C@H]2[C@H]1CCCN2C(=O)CCC[NH+]1CCCC1 ZINC001393466320 1356867658 /nfs/dbraw/zinc/86/76/58/1356867658.db2.gz QCMDCJICGZJXMT-KSZLIROESA-N 1 3 339.499 2.676 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001393502071 1356903932 /nfs/dbraw/zinc/90/39/32/1356903932.db2.gz VCSSCKCYHJQVAE-VQHPVUNQSA-N 1 3 329.504 2.585 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C1(CNC(=O)CN(C)C(C)C)CCC1 ZINC001393567405 1356956555 /nfs/dbraw/zinc/95/65/55/1356956555.db2.gz FHTOVMQKCTUXDK-UHFFFAOYSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1cccc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@H]3C)CCC2)c1 ZINC001393567916 1356957063 /nfs/dbraw/zinc/95/70/63/1356957063.db2.gz IAKRHXWVQMHURQ-QZTJIDSGSA-N 1 3 343.515 2.996 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001394382498 1357753972 /nfs/dbraw/zinc/75/39/72/1357753972.db2.gz VFLZSHSUMUMVSU-ZHALLVOQSA-N 1 3 331.504 2.881 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@H+](C)[C@H]1CCc2ccccc21)N(C)C ZINC001393643823 1357045414 /nfs/dbraw/zinc/04/54/14/1357045414.db2.gz PNCGEGGLOAABTK-MOPGFXCFSA-N 1 3 331.504 2.794 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[N@@H+](C)[C@H]1CCc2ccccc21)N(C)C ZINC001393643823 1357045416 /nfs/dbraw/zinc/04/54/16/1357045416.db2.gz PNCGEGGLOAABTK-MOPGFXCFSA-N 1 3 331.504 2.794 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC)([NH2+]Cc2cnccc2C)CC1)N(C)C ZINC001393679166 1357072997 /nfs/dbraw/zinc/07/29/97/1357072997.db2.gz JOSKMNDJIURBQR-GOSISDBHSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC)([NH2+]CC2CC(F)(F)C2)CC1)N(C)C ZINC001393679874 1357073904 /nfs/dbraw/zinc/07/39/04/1357073904.db2.gz NHKUYNVOUPAUSF-OAHLLOKOSA-N 1 3 345.478 2.733 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)cc1 ZINC001394397842 1357772601 /nfs/dbraw/zinc/77/26/01/1357772601.db2.gz ZRBUDTLUYMOYKG-UFYCRDLUSA-N 1 3 345.531 2.820 10 0 EFAEHO Cc1ccc(F)c(C[N@@H+](C)C2CCN(C(=O)CN(C)C(C)C)CC2)c1 ZINC001394398600 1357774829 /nfs/dbraw/zinc/77/48/29/1357774829.db2.gz ODRDTMNCUINVDK-UHFFFAOYSA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1ccc(F)c(C[N@H+](C)C2CCN(C(=O)CN(C)C(C)C)CC2)c1 ZINC001394398600 1357774837 /nfs/dbraw/zinc/77/48/37/1357774837.db2.gz ODRDTMNCUINVDK-UHFFFAOYSA-N 1 3 349.494 2.897 10 0 EFAEHO CC(C)CC[NH2+][C@H](C)CN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001394530535 1357914954 /nfs/dbraw/zinc/91/49/54/1357914954.db2.gz SECDXFOLJMLXGB-QAPCUYQASA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)CC[NH2+][C@@H](C)CN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001394530532 1357915475 /nfs/dbraw/zinc/91/54/75/1357915475.db2.gz SECDXFOLJMLXGB-MAUKXSAKSA-N 1 3 329.504 2.682 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(Cl)s1 ZINC001394530730 1357916281 /nfs/dbraw/zinc/91/62/81/1357916281.db2.gz UAUAZHVRJRXKIG-OLZOCXBDSA-N 1 3 343.924 2.680 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001394568523 1357961225 /nfs/dbraw/zinc/96/12/25/1357961225.db2.gz SPMDHFKNJIRHHY-ZDUSSCGKSA-N 1 3 343.874 2.756 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(CF)cc1 ZINC001394570439 1357962535 /nfs/dbraw/zinc/96/25/35/1357962535.db2.gz ZAIMHHGBGXIFSE-LPHOPBHVSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@@H]1C[C@H](NCc2ccc(Cl)c(F)c2)CN1C(=O)CC[NH+](C)C ZINC001394669244 1357986976 /nfs/dbraw/zinc/98/69/76/1357986976.db2.gz LTNDHOMMCORCFP-OCCSQVGLSA-N 1 3 341.858 2.510 10 0 EFAEHO CC(C)c1cccc(CN[C@@H]2CCN(C(=O)CCC[NH+](C)C)[C@@H]2C)n1 ZINC001394677961 1357996516 /nfs/dbraw/zinc/99/65/16/1357996516.db2.gz XFRZPGGKMCJSTA-VQIMIIECSA-N 1 3 346.519 2.626 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CC3CCCC3)[C@@H]2C1 ZINC001394684163 1358004079 /nfs/dbraw/zinc/00/40/79/1358004079.db2.gz GTDGOYNPPNLQKU-IPMKNSEASA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@H](c1cccc(F)c1)N1CC[C@@]2(NC(=O)CC[NH+](C)C)CCC[C@H]12 ZINC001394693714 1358016684 /nfs/dbraw/zinc/01/66/84/1358016684.db2.gz UIEFTMNUNFLYSL-BPAFIMBUSA-N 1 3 347.478 2.952 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001394706793 1358033142 /nfs/dbraw/zinc/03/31/42/1358033142.db2.gz CTEAIQVXFALLJY-HUUCEWRRSA-N 1 3 329.504 2.539 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CC2CC3(CCC3)C2)C(C)(C)C1 ZINC001394713046 1358040075 /nfs/dbraw/zinc/04/00/75/1358040075.db2.gz JCQYMXJIYNLKJN-QGZVFWFLSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001394814823 1358107305 /nfs/dbraw/zinc/10/73/05/1358107305.db2.gz KDAPGHAIZDACQF-DLBZAZTESA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C[NH2+]Cc1ccsc1)C(C)(C)C)N(C)C ZINC001394837645 1358139545 /nfs/dbraw/zinc/13/95/45/1358139545.db2.gz TVPYVKHGLUXHJS-HZPDHXFCSA-N 1 3 339.549 2.955 10 0 EFAEHO CC(C)CCC[NH+]1CCC([C@@H](C)NC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001394841023 1358143375 /nfs/dbraw/zinc/14/33/75/1358143375.db2.gz PKYRXYHHXULZLQ-QZTJIDSGSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+][C@@H]2CCc3ccccc32)C1 ZINC001394860228 1358166757 /nfs/dbraw/zinc/16/67/57/1358166757.db2.gz IPORDCDWHQPNBK-FAFZWHIHSA-N 1 3 329.488 2.593 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC1(C2CCN(Cc3ccsc3)CC2)CC1 ZINC001394860119 1358166804 /nfs/dbraw/zinc/16/68/04/1358166804.db2.gz LWKBVDFJNXTAIU-UHFFFAOYSA-N 1 3 349.544 2.951 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC1(C2CCN(Cc3ccsc3)CC2)CC1 ZINC001394860119 1358166807 /nfs/dbraw/zinc/16/68/07/1358166807.db2.gz LWKBVDFJNXTAIU-UHFFFAOYSA-N 1 3 349.544 2.951 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccc(F)cc32)C1 ZINC001436979353 1387349618 /nfs/dbraw/zinc/34/96/18/1387349618.db2.gz SUCJITUABRYDDF-ZIFCJYIRSA-N 1 3 347.478 2.780 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[NH2+]C[C@@H]2CCC(F)(F)C2)C1 ZINC001437030648 1387367688 /nfs/dbraw/zinc/36/76/88/1387367688.db2.gz JCODKQHYNMHKHN-HZPDHXFCSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001437134373 1387409596 /nfs/dbraw/zinc/40/95/96/1387409596.db2.gz PTSXMZCTJHBSNP-ZBFHGGJFSA-N 1 3 345.478 2.779 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccccc2)C1 ZINC001397094178 1359671995 /nfs/dbraw/zinc/67/19/95/1359671995.db2.gz RNROASSMYDBSJL-PBWTXFEYSA-N 1 3 329.488 2.544 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+][C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001397094258 1359672180 /nfs/dbraw/zinc/67/21/80/1359672180.db2.gz SGBNTOOYLUXRRX-LMMKCTJWSA-N 1 3 331.504 2.881 10 0 EFAEHO CN(CC(=O)NC[C@H]1C[C@H]([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)C1)CC(C)(C)C ZINC001397130941 1359693518 /nfs/dbraw/zinc/69/35/18/1359693518.db2.gz SBRHVDCTCNXCKW-UJWQCDCRSA-N 1 3 349.563 2.885 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H]1C[C@H](CNC(=O)CN2[C@H](C)CC[C@H]2C)C1 ZINC001397140968 1359702223 /nfs/dbraw/zinc/70/22/23/1359702223.db2.gz RKJTVQGUZHCWRY-SOAMZJECSA-N 1 3 343.515 2.852 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+][C@@H]2CCc3ccccc32)C1 ZINC001397163435 1359716009 /nfs/dbraw/zinc/71/60/09/1359716009.db2.gz DGMASBGSQJXAAE-ILZDJORESA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CC3CCC(C)CC3)CC[C@@H]2C1 ZINC001397213878 1359755013 /nfs/dbraw/zinc/75/50/13/1359755013.db2.gz FWLGXLVOMAFTAN-TUNPWDSISA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CC3CCC(C)CC3)CC[C@@H]2C1 ZINC001397213878 1359755016 /nfs/dbraw/zinc/75/50/16/1359755016.db2.gz FWLGXLVOMAFTAN-TUNPWDSISA-N 1 3 349.563 2.933 10 0 EFAEHO CN(C)C1(C(=O)N2CCCCC[C@H]([NH2+]CCC(F)(F)F)C2)CCC1 ZINC001397228349 1359768019 /nfs/dbraw/zinc/76/80/19/1359768019.db2.gz WQFLKQWOAMDZJN-AWEZNQCLSA-N 1 3 349.441 2.784 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@H]1C[N@H+](C)CCc1cccs1 ZINC001397261701 1359794616 /nfs/dbraw/zinc/79/46/16/1359794616.db2.gz GOASJWCGMWYONI-WMZOPIPTSA-N 1 3 349.544 2.698 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@H]1C[N@@H+](C)CCc1cccs1 ZINC001397261701 1359794619 /nfs/dbraw/zinc/79/46/19/1359794619.db2.gz GOASJWCGMWYONI-WMZOPIPTSA-N 1 3 349.544 2.698 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001437142118 1387417503 /nfs/dbraw/zinc/41/75/03/1387417503.db2.gz CJWGTAUKZDEREA-SCLBCKFNSA-N 1 3 349.906 2.906 10 0 EFAEHO CN(C[C@@H]1CC[N@@H+]1CC1CC(C)(C)C1)C(=O)C(C)(C)N1CCCC1 ZINC001397542986 1359947211 /nfs/dbraw/zinc/94/72/11/1359947211.db2.gz GYRQVENELAUQSY-KRWDZBQOSA-N 1 3 335.536 2.830 10 0 EFAEHO CN(C[C@@H]1CC[N@H+]1CC1CC(C)(C)C1)C(=O)C(C)(C)N1CCCC1 ZINC001397542986 1359947217 /nfs/dbraw/zinc/94/72/17/1359947217.db2.gz GYRQVENELAUQSY-KRWDZBQOSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)C[C@@H]1CCN1C[C@H]1CCCC(F)(F)C1 ZINC001397556310 1359958050 /nfs/dbraw/zinc/95/80/50/1359958050.db2.gz PROYTHALIHRAHD-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)C[C@@H]1CCN1C[C@H]1CCCC(F)(F)C1 ZINC001397556310 1359958055 /nfs/dbraw/zinc/95/80/55/1359958055.db2.gz PROYTHALIHRAHD-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@@H+]2CC2CCC3(CC3)CC2)C1 ZINC001397579060 1359976782 /nfs/dbraw/zinc/97/67/82/1359976782.db2.gz OYYDOKLWTGWCOM-MJGOQNOKSA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@H+]2CC2CCC3(CC3)CC2)C1 ZINC001397579060 1359976789 /nfs/dbraw/zinc/97/67/89/1359976789.db2.gz OYYDOKLWTGWCOM-MJGOQNOKSA-N 1 3 347.547 2.831 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CCC(C)CC2)C1 ZINC001397616044 1360005362 /nfs/dbraw/zinc/00/53/62/1360005362.db2.gz LVLZVIWPQINIGF-BWPPORJPSA-N 1 3 332.492 2.571 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+]Cc2ccccc2C2CC2)C1 ZINC001397673256 1360040885 /nfs/dbraw/zinc/04/08/85/1360040885.db2.gz JHIHJPQGMPMRKX-RUCARUNLSA-N 1 3 343.515 2.889 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@H+](CC[C@H](C)F)CC(C)(C)C1 ZINC001397819008 1360171202 /nfs/dbraw/zinc/17/12/02/1360171202.db2.gz URTOLWYUNUPSSD-HOTGVXAUSA-N 1 3 329.504 2.683 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@@H+](CC[C@H](C)F)CC(C)(C)C1 ZINC001397819008 1360171203 /nfs/dbraw/zinc/17/12/03/1360171203.db2.gz URTOLWYUNUPSSD-HOTGVXAUSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+][C@H]1CCc2c1cccc2F ZINC001437187914 1387449887 /nfs/dbraw/zinc/44/98/87/1387449887.db2.gz NPSSUHFUOQGQSW-KDOFPFPSSA-N 1 3 347.478 2.782 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CC[N@H+](Cc2c(C)cccc2C)C1 ZINC001398287792 1360443706 /nfs/dbraw/zinc/44/37/06/1360443706.db2.gz JQSDBYRXSYSHKE-HKUYNNGSSA-N 1 3 349.494 2.674 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CC[N@@H+](Cc2c(C)cccc2C)C1 ZINC001398287792 1360443709 /nfs/dbraw/zinc/44/37/09/1360443709.db2.gz JQSDBYRXSYSHKE-HKUYNNGSSA-N 1 3 349.494 2.674 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+][C@@H]1CCc2c1cccc2F)C1CC1 ZINC001398447401 1360565503 /nfs/dbraw/zinc/56/55/03/1360565503.db2.gz GLTZYIURWSNZSA-RTBURBONSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H](C[N@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001398460971 1360578755 /nfs/dbraw/zinc/57/87/55/1360578755.db2.gz GCHQAFGYOIICIP-IRXDYDNUSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H](C[N@@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001398460971 1360578760 /nfs/dbraw/zinc/57/87/60/1360578760.db2.gz GCHQAFGYOIICIP-IRXDYDNUSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](C[N@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001398460962 1360578853 /nfs/dbraw/zinc/57/88/53/1360578853.db2.gz GCHQAFGYOIICIP-DLBZAZTESA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](C[N@@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001398460962 1360578854 /nfs/dbraw/zinc/57/88/54/1360578854.db2.gz GCHQAFGYOIICIP-DLBZAZTESA-N 1 3 325.541 2.933 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc2ccccc2c1 ZINC001437201141 1387461192 /nfs/dbraw/zinc/46/11/92/1387461192.db2.gz GDBDSQAYAZKOFY-IRXDYDNUSA-N 1 3 339.483 2.776 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@H]2CN(CCC(F)(F)F)CC[C@@H]21 ZINC001398572959 1360651741 /nfs/dbraw/zinc/65/17/41/1360651741.db2.gz AWLFPVGZNPUTHW-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C/Cl ZINC001398589119 1360659895 /nfs/dbraw/zinc/65/98/95/1360659895.db2.gz ILIGACPAAOBHRB-UABBJRHPSA-N 1 3 339.911 2.725 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C/Cl ZINC001398589119 1360659899 /nfs/dbraw/zinc/65/98/99/1360659899.db2.gz ILIGACPAAOBHRB-UABBJRHPSA-N 1 3 339.911 2.725 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+]CC3CCC(F)(F)CC3)C2)CCC1 ZINC001398617908 1360672686 /nfs/dbraw/zinc/67/26/86/1360672686.db2.gz INVOCXIJWAMIAJ-GASCZTMLSA-N 1 3 343.462 2.533 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1C[C@@H](NCc2cccc(Cl)c2Cl)C1 ZINC001398623018 1360674121 /nfs/dbraw/zinc/67/41/21/1360674121.db2.gz JYCADLWDNWLFQG-BETUJISGSA-N 1 3 344.286 2.682 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(Cl)cc2)C1)N(C)C ZINC001398669872 1360701275 /nfs/dbraw/zinc/70/12/75/1360701275.db2.gz XOGBVCJTNFFUJW-SJWGOKEGSA-N 1 3 337.895 2.978 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc(Cl)c2)C1)N(C)C ZINC001398676802 1360707600 /nfs/dbraw/zinc/70/76/00/1360707600.db2.gz ZXFLBXKINMVLBY-IXDOHACOSA-N 1 3 337.895 2.663 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]CCc1ccccc1F ZINC001437212956 1387473649 /nfs/dbraw/zinc/47/36/49/1387473649.db2.gz HXHPKMRKZYRWFM-VQIMIIECSA-N 1 3 349.494 2.725 10 0 EFAEHO Cc1ccc(F)c(CN2CCC[C@@H]([C@H](C)NC(=O)CC[NH+](C)C)C2)c1 ZINC001398785470 1360788901 /nfs/dbraw/zinc/78/89/01/1360788901.db2.gz IGXKFKBLIJYGIJ-DLBZAZTESA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@H+](CCc2ccccc2)C1 ZINC001398787114 1360790587 /nfs/dbraw/zinc/79/05/87/1360790587.db2.gz DGUPOQKPGVUJDW-ICSRJNTNSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](CCc2ccccc2)C1 ZINC001398787114 1360790591 /nfs/dbraw/zinc/79/05/91/1360790591.db2.gz DGUPOQKPGVUJDW-ICSRJNTNSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@@H](C)[NH2+]CCc1ccccc1 ZINC001437213090 1387474646 /nfs/dbraw/zinc/47/46/46/1387474646.db2.gz ITOFQJOZWMSRNQ-MJGOQNOKSA-N 1 3 331.504 2.586 10 0 EFAEHO C[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]CCc1ccccc1F ZINC001437215382 1387475528 /nfs/dbraw/zinc/47/55/28/1387475528.db2.gz MUTGWIVZZDEFCR-IAGOWNOFSA-N 1 3 349.494 2.727 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cc2ccccc2s1 ZINC001437214794 1387476261 /nfs/dbraw/zinc/47/62/61/1387476261.db2.gz XTUQVQZIYBYRGW-GJZGRUSLSA-N 1 3 345.512 2.837 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cc2ccccc2s1 ZINC001437214800 1387476329 /nfs/dbraw/zinc/47/63/29/1387476329.db2.gz XTUQVQZIYBYRGW-LSDHHAIUSA-N 1 3 345.512 2.837 10 0 EFAEHO C[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]CCc1cccs1 ZINC001437217614 1387477981 /nfs/dbraw/zinc/47/79/81/1387477981.db2.gz VJMZXNKEKCFPIV-CVEARBPZSA-N 1 3 337.533 2.649 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@@H](C)CNC(=O)[C@H]1CCCN1C(C)C ZINC001398929665 1360877943 /nfs/dbraw/zinc/87/79/43/1360877943.db2.gz UFHHULVWGIQOGD-FXAWDEMLSA-N 1 3 345.531 2.759 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@H](C)CNC(=O)[C@@H]1CCCN1C(C)C ZINC001398929671 1360878045 /nfs/dbraw/zinc/87/80/45/1360878045.db2.gz UFHHULVWGIQOGD-XLIONFOSSA-N 1 3 345.531 2.759 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001398931611 1360879544 /nfs/dbraw/zinc/87/95/44/1360879544.db2.gz XZDNKIWXAYMBJF-PKOBYXMFSA-N 1 3 331.504 2.505 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001399274232 1361115448 /nfs/dbraw/zinc/11/54/48/1361115448.db2.gz FGZZSQJTMPHMEN-SFHVURJKSA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001399274232 1361115453 /nfs/dbraw/zinc/11/54/53/1361115453.db2.gz FGZZSQJTMPHMEN-SFHVURJKSA-N 1 3 349.494 2.897 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@H]([N@H+](C)Cc2ccccc2)C1 ZINC001399285567 1361127496 /nfs/dbraw/zinc/12/74/96/1361127496.db2.gz IFNIZKLQHICADQ-RBUKOAKNSA-N 1 3 349.494 2.789 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC001399285567 1361127497 /nfs/dbraw/zinc/12/74/97/1361127497.db2.gz IFNIZKLQHICADQ-RBUKOAKNSA-N 1 3 349.494 2.789 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(C)cc1 ZINC001399436572 1361224585 /nfs/dbraw/zinc/22/45/85/1361224585.db2.gz UQMCALBZRMOWTN-IEBWSBKVSA-N 1 3 331.504 2.854 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]Cc1ccc(C)cc1 ZINC001399436567 1361224609 /nfs/dbraw/zinc/22/46/09/1361224609.db2.gz UQMCALBZRMOWTN-HKUYNNGSSA-N 1 3 331.504 2.854 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC001399437824 1361225285 /nfs/dbraw/zinc/22/52/85/1361225285.db2.gz WBQBONDMDTXFJY-QZTJIDSGSA-N 1 3 345.531 2.616 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NCCN(C)Cc1ccc(C2CC2)cc1 ZINC001399483087 1361265596 /nfs/dbraw/zinc/26/55/96/1361265596.db2.gz MPAIPXLVLGUZQL-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NCCN(C)Cc1ccc(C2CC2)cc1 ZINC001399483087 1361265600 /nfs/dbraw/zinc/26/56/00/1361265600.db2.gz MPAIPXLVLGUZQL-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO CN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)Cc1cc2ccccc2s1 ZINC001399643988 1361397364 /nfs/dbraw/zinc/39/73/64/1361397364.db2.gz QBMSMMYFSRXCIP-HNNXBMFYSA-N 1 3 345.512 2.791 10 0 EFAEHO CN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)Cc1cc2ccccc2s1 ZINC001399643988 1361397369 /nfs/dbraw/zinc/39/73/69/1361397369.db2.gz QBMSMMYFSRXCIP-HNNXBMFYSA-N 1 3 345.512 2.791 10 0 EFAEHO CN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)Cc1ccc(C(C)(C)C)cc1 ZINC001399648347 1361402602 /nfs/dbraw/zinc/40/26/02/1361402602.db2.gz YXKCDKRZYISUKI-GOSISDBHSA-N 1 3 345.531 2.874 10 0 EFAEHO CN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)Cc1ccc(C(C)(C)C)cc1 ZINC001399648347 1361402605 /nfs/dbraw/zinc/40/26/05/1361402605.db2.gz YXKCDKRZYISUKI-GOSISDBHSA-N 1 3 345.531 2.874 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)Cc1ccc(C)c(F)c1 ZINC001399750918 1361478257 /nfs/dbraw/zinc/47/82/57/1361478257.db2.gz MNLZWMUCAFXYQF-WMZOPIPTSA-N 1 3 349.494 2.803 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)Cc1ccc(C)c(F)c1 ZINC001399750918 1361478261 /nfs/dbraw/zinc/47/82/61/1361478261.db2.gz MNLZWMUCAFXYQF-WMZOPIPTSA-N 1 3 349.494 2.803 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)[C@H](C)c1cccc(OC)c1 ZINC001399813254 1361513859 /nfs/dbraw/zinc/51/38/59/1361513859.db2.gz XXVZPZFGCAEJBS-IAGOWNOFSA-N 1 3 347.503 2.536 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)[C@H](C)c1cccc(OC)c1 ZINC001399813254 1361513861 /nfs/dbraw/zinc/51/38/61/1361513861.db2.gz XXVZPZFGCAEJBS-IAGOWNOFSA-N 1 3 347.503 2.536 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@H]1CCCN1Cc1cc2ccccc2s1 ZINC001399850569 1361528908 /nfs/dbraw/zinc/52/89/08/1361528908.db2.gz GTEFDQZFCSZKFG-INIZCTEOSA-N 1 3 345.512 2.934 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@H]2CCCN2Cc2ccc(CF)cc2)C1 ZINC001399859786 1361534296 /nfs/dbraw/zinc/53/42/96/1361534296.db2.gz CCIGQHRLLQSKIA-RBUKOAKNSA-N 1 3 347.478 2.579 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@H]2CCCN2Cc2ccc(CF)cc2)C1 ZINC001399859786 1361534298 /nfs/dbraw/zinc/53/42/98/1361534298.db2.gz CCIGQHRLLQSKIA-RBUKOAKNSA-N 1 3 347.478 2.579 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1CCN(CCC(F)(F)F)C1)[NH+]1CCCCCC1 ZINC001399920077 1361576378 /nfs/dbraw/zinc/57/63/78/1361576378.db2.gz BEONEJHHWKXLOL-LSDHHAIUSA-N 1 3 349.441 2.641 10 0 EFAEHO Cc1cccc(C)c1C[N@H+]1CC[C@@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001399930422 1361585429 /nfs/dbraw/zinc/58/54/29/1361585429.db2.gz IXUHONNBCYBHFE-LPHOPBHVSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+]1CC[C@@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001399930422 1361585433 /nfs/dbraw/zinc/58/54/33/1361585433.db2.gz IXUHONNBCYBHFE-LPHOPBHVSA-N 1 3 343.515 2.583 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@H+](CCCc2ccc(C)cc2)C1)N(C)C ZINC001399935439 1361591545 /nfs/dbraw/zinc/59/15/45/1361591545.db2.gz BUGXHRKGLGHXBN-VQTJNVASSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@@H+](CCCc2ccc(C)cc2)C1)N(C)C ZINC001399935439 1361591547 /nfs/dbraw/zinc/59/15/47/1361591547.db2.gz BUGXHRKGLGHXBN-VQTJNVASSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1CC[N@H+](Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001399957545 1361611595 /nfs/dbraw/zinc/61/15/95/1361611595.db2.gz WBKKXSFXWQWWRP-PXNSSMCTSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1CC[N@@H+](Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001399957545 1361611597 /nfs/dbraw/zinc/61/15/97/1361611597.db2.gz WBKKXSFXWQWWRP-PXNSSMCTSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](C(=O)NCC[C@@H]1CCN(C/C=C\Cl)C1)[NH+]1CCCCCC1 ZINC001400182634 1361821706 /nfs/dbraw/zinc/82/17/06/1361821706.db2.gz LEHDNTUSJFDPSJ-REEAJDFCSA-N 1 3 341.927 2.832 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2CC[N@H+](CCC3CCCC3)C2)C1 ZINC001400188525 1361829633 /nfs/dbraw/zinc/82/96/33/1361829633.db2.gz VVYJBMSJGAOJJR-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2CC[N@@H+](CCC3CCCC3)C2)C1 ZINC001400188525 1361829637 /nfs/dbraw/zinc/82/96/37/1361829637.db2.gz VVYJBMSJGAOJJR-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@H]2CC[N@H+](CCC3CCCC3)C2)C1 ZINC001400188509 1361830054 /nfs/dbraw/zinc/83/00/54/1361830054.db2.gz VVYJBMSJGAOJJR-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@H]2CC[N@@H+](CCC3CCCC3)C2)C1 ZINC001400188509 1361830058 /nfs/dbraw/zinc/83/00/58/1361830058.db2.gz VVYJBMSJGAOJJR-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+]1CC[C@@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001400209538 1361845577 /nfs/dbraw/zinc/84/55/77/1361845577.db2.gz ZKSUEWIPROJMBZ-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+]1CC[C@@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001400209538 1361845580 /nfs/dbraw/zinc/84/55/80/1361845580.db2.gz ZKSUEWIPROJMBZ-QGZVFWFLSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[N@H+](C)CCCc2ccccc2)C1)N(C)C ZINC001400227513 1361861713 /nfs/dbraw/zinc/86/17/13/1361861713.db2.gz RAIDPUCSZOYKMQ-VQTJNVASSA-N 1 3 345.531 2.740 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C[N@@H+](C)CCCc2ccccc2)C1)N(C)C ZINC001400227513 1361861717 /nfs/dbraw/zinc/86/17/17/1361861717.db2.gz RAIDPUCSZOYKMQ-VQTJNVASSA-N 1 3 345.531 2.740 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]Cc2ccccc2Cl)C1 ZINC001437320535 1387539467 /nfs/dbraw/zinc/53/94/67/1387539467.db2.gz AQPVNMYCLSORTN-OAHLLOKOSA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]Cc2ccccc2Cl)C1 ZINC001437320528 1387539591 /nfs/dbraw/zinc/53/95/91/1387539591.db2.gz AQPVNMYCLSORTN-HNNXBMFYSA-N 1 3 337.895 2.618 10 0 EFAEHO Cc1cc(C)c(CN2CC(CNC(=O)C[C@H]3CC[N@@H+](C)C3)C2)c(C)c1 ZINC001400545840 1362020160 /nfs/dbraw/zinc/02/01/60/1362020160.db2.gz HFEHBSBZCVRGIE-GOSISDBHSA-N 1 3 343.515 2.502 10 0 EFAEHO Cc1cc(C)c(CN2CC(CNC(=O)C[C@H]3CC[N@H+](C)C3)C2)c(C)c1 ZINC001400545840 1362020167 /nfs/dbraw/zinc/02/01/67/1362020167.db2.gz HFEHBSBZCVRGIE-GOSISDBHSA-N 1 3 343.515 2.502 10 0 EFAEHO Cc1ccccc1CN1CC(CNC(=O)[C@H](C(C)C)[NH+]2CCCC2)C1 ZINC001400566795 1362027429 /nfs/dbraw/zinc/02/74/29/1362027429.db2.gz BYBQETOSLCCNSV-FQEVSTJZSA-N 1 3 343.515 2.663 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@H+](CC2CCCCC2)C1)N1CCCC1 ZINC001400686768 1362094408 /nfs/dbraw/zinc/09/44/08/1362094408.db2.gz QQNUHDZOXOHZIH-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@@H+](CC2CCCCC2)C1)N1CCCC1 ZINC001400686768 1362094414 /nfs/dbraw/zinc/09/44/14/1362094414.db2.gz QQNUHDZOXOHZIH-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)[C@@H]1CCN(Cc2ccc(C(F)F)cc2)C1 ZINC001400708203 1362111236 /nfs/dbraw/zinc/11/12/36/1362111236.db2.gz MZHSMLYFINECLK-MRXNPFEDSA-N 1 3 339.430 2.609 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001437334917 1387557811 /nfs/dbraw/zinc/55/78/11/1387557811.db2.gz WZIGUKUKVMHGHT-ROUUACIJSA-N 1 3 331.504 2.834 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1cccc(F)c1 ZINC001400797279 1362169354 /nfs/dbraw/zinc/16/93/54/1362169354.db2.gz HVIDYFCMZSBINN-QZTJIDSGSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]CCc1cccs1 ZINC001400800715 1362171782 /nfs/dbraw/zinc/17/17/82/1362171782.db2.gz IKFVIAITPZMOTM-WBVHZDCISA-N 1 3 337.533 2.648 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1ccc(C)nc1C ZINC001400804017 1362173662 /nfs/dbraw/zinc/17/36/62/1362173662.db2.gz OQXDBZMCOWWJKD-MOPGFXCFSA-N 1 3 346.519 2.557 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](CC)N(C)C)[NH2+]Cc1cc(C)sc1C ZINC001400835474 1362198027 /nfs/dbraw/zinc/19/80/27/1362198027.db2.gz VPSVQZJTOKVUJD-HZPDHXFCSA-N 1 3 325.522 2.690 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCc1ccccc1 ZINC001400850726 1362209986 /nfs/dbraw/zinc/20/99/86/1362209986.db2.gz SVZSXYLZPDSYAF-GOSISDBHSA-N 1 3 331.504 2.588 10 0 EFAEHO CC[C@@H](CNC(=O)Cc1nc[nH]c1C)[NH2+]CC1CCC2(CC2)CC1 ZINC001400905449 1362245433 /nfs/dbraw/zinc/24/54/33/1362245433.db2.gz PHZWNNUDQUAHRV-INIZCTEOSA-N 1 3 332.492 2.715 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@]1(C[NH2+]Cc2ccccn2)CCCC[C@H]1C ZINC001401040463 1362389684 /nfs/dbraw/zinc/38/96/84/1362389684.db2.gz DFSHEMACIUALRX-XLIONFOSSA-N 1 3 346.519 2.577 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@@H]1C[NH2+]Cc1ccsc1 ZINC001401087410 1362430745 /nfs/dbraw/zinc/43/07/45/1362430745.db2.gz WGPIBMJJQSGREB-CVEARBPZSA-N 1 3 341.496 2.509 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([N@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001437352579 1387573597 /nfs/dbraw/zinc/57/35/97/1387573597.db2.gz USMSBQZIDKNEIY-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([N@@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001437352579 1387573599 /nfs/dbraw/zinc/57/35/99/1387573599.db2.gz USMSBQZIDKNEIY-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001401127245 1362464385 /nfs/dbraw/zinc/46/43/85/1362464385.db2.gz XDLCXCBMJOGUMG-CABCVRRESA-N 1 3 345.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+]Cc1ccc(Cl)s1 ZINC001401154279 1362490961 /nfs/dbraw/zinc/49/09/61/1362490961.db2.gz NBPBMHZDEZVFMU-GFCCVEGCSA-N 1 3 331.913 2.584 10 0 EFAEHO Cc1ccccc1C[NH2+]C1(CNC(=O)CN(C)C(C)C)CCCC1 ZINC001401192020 1362531382 /nfs/dbraw/zinc/53/13/82/1362531382.db2.gz YQCZDEOAPAVHRE-UHFFFAOYSA-N 1 3 331.504 2.854 10 0 EFAEHO CC(C)C[C@@H](C)C[NH+]1CC2(C1)CCN(C(=O)CN1CCCC1)CC2 ZINC001401194598 1362535351 /nfs/dbraw/zinc/53/53/51/1362535351.db2.gz ORIZUWQOAGRTQC-GOSISDBHSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(C[NH+](C[C@@H]3CC[C@H]4C[C@H]4C3)C2)CC1 ZINC001401197449 1362537096 /nfs/dbraw/zinc/53/70/96/1362537096.db2.gz NRQSLONDUTYIGL-CEXWTWQISA-N 1 3 347.547 2.687 10 0 EFAEHO CC[C@@H](F)CNC[C@@H](C)N(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001401224166 1362563304 /nfs/dbraw/zinc/56/33/04/1362563304.db2.gz MCTMVSOITQQHGD-HUUCEWRRSA-N 1 3 329.504 2.824 10 0 EFAEHO CC[C@@H](F)CNC[C@@H](C)N(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001401224166 1362563307 /nfs/dbraw/zinc/56/33/07/1362563307.db2.gz MCTMVSOITQQHGD-HUUCEWRRSA-N 1 3 329.504 2.824 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(Cl)s1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001401247510 1362585823 /nfs/dbraw/zinc/58/58/23/1362585823.db2.gz PLOHSUVPLUYKCA-STQMWFEESA-N 1 3 343.924 2.680 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H](C)CNCc1ccccc1F)[NH+]1CCCC1 ZINC001401267319 1362609161 /nfs/dbraw/zinc/60/91/61/1362609161.db2.gz RXEJJZNBPSUKHT-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCc1ccccc1 ZINC001401336227 1362681371 /nfs/dbraw/zinc/68/13/71/1362681371.db2.gz KUQNYMSRKYDSAC-LJQANCHMSA-N 1 3 345.531 2.834 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CCC(F)(F)F)C(C)C ZINC001401337401 1362683486 /nfs/dbraw/zinc/68/34/86/1362683486.db2.gz UYBIOCUZYVCLHD-ZIAGYGMSSA-N 1 3 337.430 2.544 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NCc1ccccc1Cl ZINC001401355796 1362705615 /nfs/dbraw/zinc/70/56/15/1362705615.db2.gz VPGXWUCENSXGDG-WBVHZDCISA-N 1 3 337.895 2.522 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NCc1ccccc1Cl ZINC001401355796 1362705619 /nfs/dbraw/zinc/70/56/19/1362705619.db2.gz VPGXWUCENSXGDG-WBVHZDCISA-N 1 3 337.895 2.522 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NCc1ccccc1Cl ZINC001401355768 1362705681 /nfs/dbraw/zinc/70/56/81/1362705681.db2.gz VPGXWUCENSXGDG-DOTOQJQBSA-N 1 3 337.895 2.522 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NCc1ccccc1Cl ZINC001401355768 1362705685 /nfs/dbraw/zinc/70/56/85/1362705685.db2.gz VPGXWUCENSXGDG-DOTOQJQBSA-N 1 3 337.895 2.522 10 0 EFAEHO CC(C)[C@H](CNC(=O)C12CC[NH+](CC1)C2)N[C@@H](C)c1ccccc1F ZINC001401380114 1362732142 /nfs/dbraw/zinc/73/21/42/1362732142.db2.gz KUFYGJDCHXWYGC-YJBOKZPZSA-N 1 3 347.478 2.713 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@@H]21 ZINC001401509817 1362898035 /nfs/dbraw/zinc/89/80/35/1362898035.db2.gz XBSOJBQEQGNCGM-MSOLQXFVSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@@H]21 ZINC001401509817 1362898039 /nfs/dbraw/zinc/89/80/39/1362898039.db2.gz XBSOJBQEQGNCGM-MSOLQXFVSA-N 1 3 337.552 2.933 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCCc2ccccc21)C(=O)CN1CCCC1 ZINC001401607817 1362968772 /nfs/dbraw/zinc/96/87/72/1362968772.db2.gz HTOSELRAZCYGBA-IBGZPJMESA-N 1 3 329.488 2.598 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC001401666247 1363013700 /nfs/dbraw/zinc/01/37/00/1363013700.db2.gz HJXZCOGUVDYHCY-KGLIPLIRSA-N 1 3 325.884 2.836 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CNCc1ccccc1F)[NH+]1CCCC1 ZINC001401669158 1363015264 /nfs/dbraw/zinc/01/52/64/1363015264.db2.gz JTIAYCBFLAJLGS-CRAIPNDOSA-N 1 3 335.467 2.540 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CCC[N@@H+]2C(C)C)cc1F ZINC001401748345 1363081824 /nfs/dbraw/zinc/08/18/24/1363081824.db2.gz DQCXCQKTCNQKLM-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CCC[N@H+]2C(C)C)cc1F ZINC001401748345 1363081826 /nfs/dbraw/zinc/08/18/26/1363081826.db2.gz DQCXCQKTCNQKLM-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CN(C)Cc1ccccc1)[NH+]1CCCC1 ZINC001401830418 1363172956 /nfs/dbraw/zinc/17/29/56/1363172956.db2.gz SHWVQLWTLAGFCV-HKUYNNGSSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](C)CCNC(=O)CN1CC[C@H](C)C1 ZINC001437404092 1387613656 /nfs/dbraw/zinc/61/36/56/1387613656.db2.gz RHRDGUSQYIGSSP-MAUKXSAKSA-N 1 3 331.504 2.630 10 0 EFAEHO C[C@H](C(=O)N[C@@H](C[NH2+]CC1CCCC1)C1CC1)N1CCCCCC1 ZINC001401859707 1363194873 /nfs/dbraw/zinc/19/48/73/1363194873.db2.gz QAVZXZQOCHAGFB-APWZRJJASA-N 1 3 335.536 2.926 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1(N[C@H]2CCCc3ccc(F)cc32)CC1 ZINC001401977397 1363293651 /nfs/dbraw/zinc/29/36/51/1363293651.db2.gz WJSNFRWIBJBLMB-SFHVURJKSA-N 1 3 347.478 2.783 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1(N[C@H]2CCCc3ccc(F)cc32)CC1 ZINC001401977397 1363293653 /nfs/dbraw/zinc/29/36/53/1363293653.db2.gz WJSNFRWIBJBLMB-SFHVURJKSA-N 1 3 347.478 2.783 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C1(CNC(=O)CN2[C@H](C)CC[C@H]2C)CC1 ZINC001401990086 1363306970 /nfs/dbraw/zinc/30/69/70/1363306970.db2.gz ZLNSGHMDZICAIA-QZTJIDSGSA-N 1 3 343.515 2.915 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CC[N@@H+](CC[C@H](C)F)C2)CC1 ZINC001401990984 1363308527 /nfs/dbraw/zinc/30/85/27/1363308527.db2.gz UQYAAHYLNVXGGB-FUHWJXTLSA-N 1 3 341.515 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H]2CC[N@H+](CC[C@H](C)F)C2)CC1 ZINC001401990984 1363308532 /nfs/dbraw/zinc/30/85/32/1363308532.db2.gz UQYAAHYLNVXGGB-FUHWJXTLSA-N 1 3 341.515 2.635 10 0 EFAEHO C[C@@H](NC[C@@H]1CCCN1C(=O)CC[NH+](C)C)c1cc(F)ccc1F ZINC001402064397 1363371468 /nfs/dbraw/zinc/37/14/68/1363371468.db2.gz XTFHEXOIALFIAD-HIFRSBDPSA-N 1 3 339.430 2.558 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCCN(Cc2ccc(C3CC3)cc2)C1 ZINC001402097374 1363403659 /nfs/dbraw/zinc/40/36/59/1363403659.db2.gz XGQNVNYZGINSLA-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N[C@]2(C)CC[N@H+](CCC3CC3)C2)C1 ZINC001402133883 1363440837 /nfs/dbraw/zinc/44/08/37/1363440837.db2.gz NHSCFKSTNFMAKQ-MOPGFXCFSA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N[C@]2(C)CC[N@@H+](CCC3CC3)C2)C1 ZINC001402133883 1363440841 /nfs/dbraw/zinc/44/08/41/1363440841.db2.gz NHSCFKSTNFMAKQ-MOPGFXCFSA-N 1 3 339.499 2.580 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1(C)CC[NH+](CCCC(C)C)CC1 ZINC001402198707 1363506150 /nfs/dbraw/zinc/50/61/50/1363506150.db2.gz BDKPMMSTGZQXND-UHFFFAOYSA-N 1 3 334.508 2.915 10 0 EFAEHO C[C@H](c1ccccc1F)N1CCC2(C[C@H]2NC(=O)CC[NH+](C)C)CC1 ZINC001402245704 1363565690 /nfs/dbraw/zinc/56/56/90/1363565690.db2.gz QSIDYALZSXWOPM-CRAIPNDOSA-N 1 3 347.478 2.809 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC12CC[NH+](Cc1csc(C)c1)CC2)N(C)C ZINC001402246918 1363566662 /nfs/dbraw/zinc/56/66/62/1363566662.db2.gz HPGHPPVENUVSOH-IAGOWNOFSA-N 1 3 349.544 2.867 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]([NH2+]CC1CCCCC1)C1CC1)N1CCCC1 ZINC001402328837 1363608407 /nfs/dbraw/zinc/60/84/07/1363608407.db2.gz LITXBNNBIUNSQB-GOSISDBHSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]([NH2+]CCC(F)(F)F)C1CC1)N1CCCCCC1 ZINC001402346586 1363618386 /nfs/dbraw/zinc/61/83/86/1363618386.db2.gz RFTZBHVWAZWTOC-DZGCQCFKSA-N 1 3 349.441 2.688 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H](C[N@H+](C)CCC(C)(C)C)C2)C1 ZINC001402393488 1363652927 /nfs/dbraw/zinc/65/29/27/1363652927.db2.gz RGDZOVFGQSPPRP-MSOLQXFVSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H](C[N@@H+](C)CCC(C)(C)C)C2)C1 ZINC001402393488 1363652932 /nfs/dbraw/zinc/65/29/32/1363652932.db2.gz RGDZOVFGQSPPRP-MSOLQXFVSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@H+](C)Cc2ccsc2)C1 ZINC001402400823 1363659309 /nfs/dbraw/zinc/65/93/09/1363659309.db2.gz GZEFHFMJMFYDNR-MRXNPFEDSA-N 1 3 337.533 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@@H+](C)Cc2ccsc2)C1 ZINC001402400823 1363659311 /nfs/dbraw/zinc/65/93/11/1363659311.db2.gz GZEFHFMJMFYDNR-MRXNPFEDSA-N 1 3 337.533 2.759 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)[N@H+](CCC(C)(C)C)C3)CCC1 ZINC001402403093 1363662169 /nfs/dbraw/zinc/66/21/69/1363662169.db2.gz KDTRHOIBMWEUJA-BBWFWOEESA-N 1 3 335.536 2.876 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](CCC(C)(C)C)C3)CCC1 ZINC001402403093 1363662171 /nfs/dbraw/zinc/66/21/71/1363662171.db2.gz KDTRHOIBMWEUJA-BBWFWOEESA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([C@H](C)[NH2+]C/C=C\c2ccccc2)C1 ZINC001402407649 1363667333 /nfs/dbraw/zinc/66/73/33/1363667333.db2.gz KZWQNWBSTPJSKB-HWJGFJICSA-N 1 3 343.515 2.867 10 0 EFAEHO C[C@@H]([NH2+]CCC(C)(C)C)[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001402427460 1363685940 /nfs/dbraw/zinc/68/59/40/1363685940.db2.gz MSGOVGKACNATGA-MSOLQXFVSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+]([C@H](C)c3ccccc3F)C[C@@H]2C1 ZINC001402437316 1363692303 /nfs/dbraw/zinc/69/23/03/1363692303.db2.gz YIIXRWAIBRZAGF-ZACQAIPSSA-N 1 3 347.478 2.617 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+]([C@H](C)c3ccccc3F)C[C@@H]2C1 ZINC001402437316 1363692307 /nfs/dbraw/zinc/69/23/07/1363692307.db2.gz YIIXRWAIBRZAGF-ZACQAIPSSA-N 1 3 347.478 2.617 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](NCc2cc(C)ccc2F)C1)[NH+](CC)CC ZINC001402453406 1363703603 /nfs/dbraw/zinc/70/36/03/1363703603.db2.gz UJWLTUGFFLWUJQ-PKOBYXMFSA-N 1 3 349.494 2.945 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+][C@H](C)c2cc(C)ccc2C)C1 ZINC001402463019 1363709638 /nfs/dbraw/zinc/70/96/38/1363709638.db2.gz UUJUTSHVEGYHDB-MSOLQXFVSA-N 1 3 331.504 2.897 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2[C@H]1CC[N@@H+]2CCCF)N(CC)CC ZINC001402479471 1363723390 /nfs/dbraw/zinc/72/33/90/1363723390.db2.gz QTUMVBUNMAGXSS-IXDOHACOSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2[C@H]1CC[N@H+]2CCCF)N(CC)CC ZINC001402479471 1363723394 /nfs/dbraw/zinc/72/33/94/1363723394.db2.gz QTUMVBUNMAGXSS-IXDOHACOSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)C[C@H](C)C[NH+]1CCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)CC1 ZINC001402498632 1363741186 /nfs/dbraw/zinc/74/11/86/1363741186.db2.gz JHMDLFYQOFOLKJ-OALUTQOASA-N 1 3 349.563 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+][C@H](C)c1ccc(F)cc1F ZINC001437429402 1387640813 /nfs/dbraw/zinc/64/08/13/1387640813.db2.gz UOUUJJJJVKIHPL-ZIAGYGMSSA-N 1 3 341.446 2.850 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+][C@@H]1CCc2c1cccc2F ZINC001437430627 1387641876 /nfs/dbraw/zinc/64/18/76/1387641876.db2.gz ZQIOTHUAOQPOQK-RDTXWAMCSA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@@H](C)c2ccc(Cl)cc2)C1 ZINC001402550210 1363780427 /nfs/dbraw/zinc/78/04/27/1363780427.db2.gz LSJHRBKJXOPLDK-JQFCIGGWSA-N 1 3 337.895 2.978 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001402607334 1363830108 /nfs/dbraw/zinc/83/01/08/1363830108.db2.gz MAIFPXOPUJMVTH-HSALFYBXSA-N 1 3 343.515 2.887 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001402620008 1363844092 /nfs/dbraw/zinc/84/40/92/1363844092.db2.gz DLZIFYMUVSBKRB-CRWXNKLISA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001402620008 1363844094 /nfs/dbraw/zinc/84/40/94/1363844094.db2.gz DLZIFYMUVSBKRB-CRWXNKLISA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001402620014 1363844258 /nfs/dbraw/zinc/84/42/58/1363844258.db2.gz DLZIFYMUVSBKRB-RQJABVFESA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001402620014 1363844262 /nfs/dbraw/zinc/84/42/62/1363844262.db2.gz DLZIFYMUVSBKRB-RQJABVFESA-N 1 3 346.302 2.559 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(Cl)c2)C1)N(C)C ZINC001402630409 1363858685 /nfs/dbraw/zinc/85/86/85/1363858685.db2.gz MYOGZPDARMELAO-SJWGOKEGSA-N 1 3 337.895 2.978 10 0 EFAEHO CC(C)c1ccccc1C[NH2+][C@H]1C[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001402646795 1363880456 /nfs/dbraw/zinc/88/04/56/1363880456.db2.gz WXTBGZACHHUSDM-HDICACEKSA-N 1 3 331.504 2.887 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H]1CCC[N@H+](CC2CC2)C1 ZINC001402672610 1363921648 /nfs/dbraw/zinc/92/16/48/1363921648.db2.gz GDYHENIVXSEQBY-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001402672610 1363921652 /nfs/dbraw/zinc/92/16/52/1363921652.db2.gz GDYHENIVXSEQBY-RBUKOAKNSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1CCC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001402693593 1363942317 /nfs/dbraw/zinc/94/23/17/1363942317.db2.gz XJVFRBBMVLXMBB-QZTJIDSGSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1CCC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001402693593 1363942310 /nfs/dbraw/zinc/94/23/10/1363942310.db2.gz XJVFRBBMVLXMBB-QZTJIDSGSA-N 1 3 325.541 2.837 10 0 EFAEHO CCC1([NH2+]CCC(F)(F)F)CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001402696261 1363943692 /nfs/dbraw/zinc/94/36/92/1363943692.db2.gz AYBJJDPEVRAUHX-AWEZNQCLSA-N 1 3 349.441 2.641 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001402712219 1363959027 /nfs/dbraw/zinc/95/90/27/1363959027.db2.gz FFWRBBTWINWUGF-HKUYNNGSSA-N 1 3 349.494 2.938 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001402751132 1363997723 /nfs/dbraw/zinc/99/77/23/1363997723.db2.gz MLQUFODWGGVERI-VQIMIIECSA-N 1 3 341.515 2.970 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001402751132 1363997724 /nfs/dbraw/zinc/99/77/24/1363997724.db2.gz MLQUFODWGGVERI-VQIMIIECSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C)([NH2+]C[C@H](C)CC(C)C)CC1)N(C)C ZINC001402768535 1364017866 /nfs/dbraw/zinc/01/78/66/1364017866.db2.gz FAUDRJHAKQXMTN-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001402777628 1364025457 /nfs/dbraw/zinc/02/54/57/1364025457.db2.gz XHSXSZNFAFVWNA-VQIMIIECSA-N 1 3 331.504 2.526 10 0 EFAEHO Cc1ccc(CC[NH2+]C2(C)CCN(C(=O)CN(C)C(C)C)CC2)cc1 ZINC001402784074 1364031785 /nfs/dbraw/zinc/03/17/85/1364031785.db2.gz WCSNVZIGHWHCTR-UHFFFAOYSA-N 1 3 345.531 2.848 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]CCc2ccccc2)CC1)N(C)C ZINC001402827776 1364074732 /nfs/dbraw/zinc/07/47/32/1364074732.db2.gz OSYWZQXIFQTOBV-CTWPCTMYSA-N 1 3 331.504 2.586 10 0 EFAEHO CN(C)C1(C(=O)NC2CCC([NH2+]Cc3ccsc3)CC2)CCC1 ZINC001402837624 1364081554 /nfs/dbraw/zinc/08/15/54/1364081554.db2.gz YXMXHHRRTXRNHP-UHFFFAOYSA-N 1 3 335.517 2.749 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]Cc1ccccc1 ZINC001402841952 1364084232 /nfs/dbraw/zinc/08/42/32/1364084232.db2.gz FNAXZPZNKWZJTL-PKOBYXMFSA-N 1 3 331.504 2.934 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]CCc1ccccc1 ZINC001402844324 1364086486 /nfs/dbraw/zinc/08/64/86/1364086486.db2.gz SXCLNMCHRBOEOY-AZUAARDMSA-N 1 3 345.531 2.976 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC001402865566 1364100474 /nfs/dbraw/zinc/10/04/74/1364100474.db2.gz XNKLPFPUGPUTQU-KBXCAEBGSA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H]2CC[N@H+](CC3CCC3)C2)C1 ZINC001402919634 1364135336 /nfs/dbraw/zinc/13/53/36/1364135336.db2.gz AKPVRGPMSSZUAM-RTBURBONSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H]2CC[N@@H+](CC3CCC3)C2)C1 ZINC001402919634 1364135339 /nfs/dbraw/zinc/13/53/39/1364135339.db2.gz AKPVRGPMSSZUAM-RTBURBONSA-N 1 3 335.536 2.687 10 0 EFAEHO C[N@H+](CCCC1CCCC1)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001402948259 1364155138 /nfs/dbraw/zinc/15/51/38/1364155138.db2.gz VHXFXBXKCQDOHH-LJQANCHMSA-N 1 3 335.536 2.975 10 0 EFAEHO C[N@@H+](CCCC1CCCC1)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001402948259 1364155141 /nfs/dbraw/zinc/15/51/41/1364155141.db2.gz VHXFXBXKCQDOHH-LJQANCHMSA-N 1 3 335.536 2.975 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001402989890 1364186898 /nfs/dbraw/zinc/18/68/98/1364186898.db2.gz AWOPVUCPMLVPPT-HOTGVXAUSA-N 1 3 329.488 2.500 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cccc2ccccc21 ZINC001402997138 1364194778 /nfs/dbraw/zinc/19/47/78/1364194778.db2.gz HXPCEMSYXVGDMQ-SJORKVTESA-N 1 3 339.483 2.776 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)CC(C)(C)C ZINC001403015077 1364215049 /nfs/dbraw/zinc/21/50/49/1364215049.db2.gz OOLLFOGFDBRQTD-SJORKVTESA-N 1 3 333.520 2.956 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001403020397 1364221794 /nfs/dbraw/zinc/22/17/94/1364221794.db2.gz VELPGMTYEULORO-MAUKXSAKSA-N 1 3 329.488 2.643 10 0 EFAEHO C[C@@H](NC(=O)C1(C[NH+](C)C)CC1)[C@H](C)NCc1ccccc1Cl ZINC001403023520 1364225598 /nfs/dbraw/zinc/22/55/98/1364225598.db2.gz CZBGNOGACHVKBO-UONOGXRCSA-N 1 3 337.895 2.665 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C(C)C)c(Cl)c1 ZINC001403056945 1364261844 /nfs/dbraw/zinc/26/18/44/1364261844.db2.gz XZRHPWAEXJETRE-CABCVRRESA-N 1 3 339.911 2.971 10 0 EFAEHO CCc1ccccc1C[NH2+]CC1CC(NC(=O)[C@@H](CC)N(C)C)C1 ZINC001403057342 1364261991 /nfs/dbraw/zinc/26/19/91/1364261991.db2.gz JDWCWNWSUROWMA-XUJQIHCRSA-N 1 3 331.504 2.574 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)C/C=C/c2ccccc2)CC[N@@H+]1C ZINC001403118028 1364329392 /nfs/dbraw/zinc/32/93/92/1364329392.db2.gz DJBNGEXGFZMAOP-BUHLVJSKSA-N 1 3 343.515 2.867 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)C/C=C/c2ccccc2)CC[N@H+]1C ZINC001403118028 1364329397 /nfs/dbraw/zinc/32/93/97/1364329397.db2.gz DJBNGEXGFZMAOP-BUHLVJSKSA-N 1 3 343.515 2.867 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)C/C=C\c2ccccc2)CC[N@@H+]1C ZINC001403118032 1364329938 /nfs/dbraw/zinc/32/99/38/1364329938.db2.gz DJBNGEXGFZMAOP-ODFMHNGNSA-N 1 3 343.515 2.867 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)C/C=C\c2ccccc2)CC[N@H+]1C ZINC001403118032 1364329943 /nfs/dbraw/zinc/32/99/43/1364329943.db2.gz DJBNGEXGFZMAOP-ODFMHNGNSA-N 1 3 343.515 2.867 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)N(C)Cc1ccc(C2CC2)cc1 ZINC001403127294 1364340682 /nfs/dbraw/zinc/34/06/82/1364340682.db2.gz PPUYBWQUYAQWMW-RZQQEMMASA-N 1 3 343.515 2.841 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)N(C)Cc1ccc(C2CC2)cc1 ZINC001403127294 1364340686 /nfs/dbraw/zinc/34/06/86/1364340686.db2.gz PPUYBWQUYAQWMW-RZQQEMMASA-N 1 3 343.515 2.841 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@@H+](C)CC1CCC(C)(C)CC1)N(C)C ZINC001403152236 1364371997 /nfs/dbraw/zinc/37/19/97/1364371997.db2.gz RDSFZWSYFCETDP-DOTOQJQBSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@H+](C)CC1CCC(C)(C)CC1)N(C)C ZINC001403152236 1364371993 /nfs/dbraw/zinc/37/19/93/1364371993.db2.gz RDSFZWSYFCETDP-DOTOQJQBSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccc(CN(C)[C@@H](C)CNC(=O)C(C)(C)[NH+]2CCCC2)cc1F ZINC001403155217 1364373760 /nfs/dbraw/zinc/37/37/60/1364373760.db2.gz DFGMWPUNWFOHAU-INIZCTEOSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+][C@@H](C)c2ccc3c(c2)CCC3)C1 ZINC001403215310 1364440026 /nfs/dbraw/zinc/44/00/26/1364440026.db2.gz KWRLQUJZVKMSQD-JXFKEZNVSA-N 1 3 343.515 2.767 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]CC2CCC(C)(C)CC2)C1 ZINC001403248023 1364459513 /nfs/dbraw/zinc/45/95/13/1364459513.db2.gz ASGCJCKMMBMDDJ-GOSISDBHSA-N 1 3 337.552 2.981 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001437480167 1387680988 /nfs/dbraw/zinc/68/09/88/1387680988.db2.gz BUWSZHVTJMJDJF-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001437480167 1387680992 /nfs/dbraw/zinc/68/09/92/1387680992.db2.gz BUWSZHVTJMJDJF-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO Cc1cncc(C[NH2+]CC2(NC(=O)CN(C)C(C)C)CCCCC2)c1 ZINC001403260467 1364472411 /nfs/dbraw/zinc/47/24/11/1364472411.db2.gz HFRSIQBYSREICY-UHFFFAOYSA-N 1 3 346.519 2.639 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]([NH2+]CCc2ccccc2F)C1 ZINC001403265908 1364478762 /nfs/dbraw/zinc/47/87/62/1364478762.db2.gz BODJBWLFIKQEJL-ROUUACIJSA-N 1 3 349.494 2.725 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCCC[N@@H+]1CCCF)N1CCCC1 ZINC001403297698 1364513399 /nfs/dbraw/zinc/51/33/99/1364513399.db2.gz YXEDLCPJAROWLP-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCCC[N@H+]1CCCF)N1CCCC1 ZINC001403297698 1364513402 /nfs/dbraw/zinc/51/34/02/1364513402.db2.gz YXEDLCPJAROWLP-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@H+](C)[C@H]2CCc3ccccc32)C1 ZINC001403316638 1364534467 /nfs/dbraw/zinc/53/44/67/1364534467.db2.gz CABGVQIERRSPGS-QUCCMNQESA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@@H+](C)[C@H]2CCc3ccccc32)C1 ZINC001403316638 1364534471 /nfs/dbraw/zinc/53/44/71/1364534471.db2.gz CABGVQIERRSPGS-QUCCMNQESA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@H+](C)[C@H]2CCc3ccccc32)C1 ZINC001403316623 1364534568 /nfs/dbraw/zinc/53/45/68/1364534568.db2.gz CABGVQIERRSPGS-ICSRJNTNSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@@H+](C)[C@H]2CCc3ccccc32)C1 ZINC001403316623 1364534571 /nfs/dbraw/zinc/53/45/71/1364534571.db2.gz CABGVQIERRSPGS-ICSRJNTNSA-N 1 3 343.515 2.937 10 0 EFAEHO COc1cccc([C@H](C)N2C[C@H](NC(=O)CC[NH+](C)C)C(C)(C)C2)c1 ZINC001403373928 1364584098 /nfs/dbraw/zinc/58/40/98/1364584098.db2.gz DFEQYYQSGHOKSQ-YJBOKZPZSA-N 1 3 347.503 2.535 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@H+](CCCF)CC1(C)C)N1CCCCC1 ZINC001403392997 1364598224 /nfs/dbraw/zinc/59/82/24/1364598224.db2.gz UNINODOJWCKIDD-SJORKVTESA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@@H+](CCCF)CC1(C)C)N1CCCCC1 ZINC001403392997 1364598229 /nfs/dbraw/zinc/59/82/29/1364598229.db2.gz UNINODOJWCKIDD-SJORKVTESA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001403412817 1364616653 /nfs/dbraw/zinc/61/66/53/1364616653.db2.gz KATQQAWKVFKQOL-FHWLQOOXSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001403412817 1364616657 /nfs/dbraw/zinc/61/66/57/1364616657.db2.gz KATQQAWKVFKQOL-FHWLQOOXSA-N 1 3 337.552 2.980 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H](C[NH2+]Cc3ccc(Cl)cc3)C2)CCC1 ZINC001403426107 1364630565 /nfs/dbraw/zinc/63/05/65/1364630565.db2.gz ZAWDCJBGGLUMFG-JCNLHEQBSA-N 1 3 349.906 2.809 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1ccc(C)nc1C ZINC001403487106 1364694768 /nfs/dbraw/zinc/69/47/68/1364694768.db2.gz MRXKZYXQVKQASN-BEFAXECRSA-N 1 3 346.519 2.557 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C[NH2+]Cc1csc(C)c1)C1CC1)N(C)C ZINC001403502429 1364709495 /nfs/dbraw/zinc/70/94/95/1364709495.db2.gz BTFKIGYYNIIULB-IAGOWNOFSA-N 1 3 337.533 2.723 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C[NH2+]Cc1ccc(C)c(F)c1)C1CC1)N(C)C ZINC001403508325 1364714295 /nfs/dbraw/zinc/71/42/95/1364714295.db2.gz MLBURNKCCQXMAV-RTBURBONSA-N 1 3 349.494 2.801 10 0 EFAEHO CN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1ccc(CF)cc1 ZINC001437497846 1387698345 /nfs/dbraw/zinc/69/83/45/1387698345.db2.gz JZEYRDFYAFMLHD-UHFFFAOYSA-N 1 3 335.467 2.579 10 0 EFAEHO CN(CCNC(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21)Cc1ccc(CF)cc1 ZINC001403583845 1364786855 /nfs/dbraw/zinc/78/68/55/1364786855.db2.gz DNKOXNPUMJQJLS-RTBURBONSA-N 1 3 347.478 2.721 10 0 EFAEHO CN(CCNC(=O)[C@H]1CC[C@H]2CCCC[N@H+]21)Cc1ccc(CF)cc1 ZINC001403583845 1364786857 /nfs/dbraw/zinc/78/68/57/1364786857.db2.gz DNKOXNPUMJQJLS-RTBURBONSA-N 1 3 347.478 2.721 10 0 EFAEHO C[C@H](CN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(Cl)cc1 ZINC001403596244 1364799471 /nfs/dbraw/zinc/79/94/71/1364799471.db2.gz JSOIQTHQDPQQEI-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO Cc1ccc(CN[C@@H](C)CN(C)C(=O)CCC[NH+]2CCCC2)c(C)n1 ZINC001403617208 1364820555 /nfs/dbraw/zinc/82/05/55/1364820555.db2.gz CPJBDCUTAZULNF-KRWDZBQOSA-N 1 3 346.519 2.511 10 0 EFAEHO Cc1nc(C(C)C)ccc1CN[C@H]1C[C@@H](C)N(C(=O)CC[NH+](C)C)C1 ZINC001403729684 1364888430 /nfs/dbraw/zinc/88/84/30/1364888430.db2.gz APYXESPKVOEETM-QAPCUYQASA-N 1 3 346.519 2.544 10 0 EFAEHO Cc1nc(C(C)C)ccc1CN[C@@H]1C[C@@H](C)N(C(=O)CC[NH+](C)C)C1 ZINC001403729675 1364888576 /nfs/dbraw/zinc/88/85/76/1364888576.db2.gz APYXESPKVOEETM-CRAIPNDOSA-N 1 3 346.519 2.544 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C[C@@H]1C ZINC001403739055 1364894270 /nfs/dbraw/zinc/89/42/70/1364894270.db2.gz CEPZKXPRSVLSDV-OXJNMPFZSA-N 1 3 343.515 2.985 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@@H+](C)CCNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001403752984 1364902304 /nfs/dbraw/zinc/90/23/04/1364902304.db2.gz SPHUECBNAZPKLC-IEBWSBKVSA-N 1 3 333.520 2.999 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@H+](C)CCNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001403752984 1364902307 /nfs/dbraw/zinc/90/23/07/1364902307.db2.gz SPHUECBNAZPKLC-IEBWSBKVSA-N 1 3 333.520 2.999 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc3cc[nH]c3c2)[C@H]1C ZINC001403752681 1364902874 /nfs/dbraw/zinc/90/28/74/1364902874.db2.gz PGZBIZQFSUMYIS-QAPCUYQASA-N 1 3 342.487 2.587 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)cc1 ZINC001403772651 1364920767 /nfs/dbraw/zinc/92/07/67/1364920767.db2.gz LMUXOAKRMFNIQK-QFBILLFUSA-N 1 3 331.504 2.668 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[C@@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001403796580 1364949297 /nfs/dbraw/zinc/94/92/97/1364949297.db2.gz BRBUUBSVKUMOSI-AEFFLSMTSA-N 1 3 335.536 2.783 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@]12CCC[C@H]1N(Cc1ccc(F)cc1)CC2 ZINC001403823224 1364976887 /nfs/dbraw/zinc/97/68/87/1364976887.db2.gz PPZPADRMTVERAD-UYAOXDASSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)CCc1ccccc1F ZINC001403876096 1365012847 /nfs/dbraw/zinc/01/28/47/1365012847.db2.gz IJMJVHOZVUJFQR-WMZOPIPTSA-N 1 3 349.494 2.537 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)CCc1ccccc1F ZINC001403876096 1365012852 /nfs/dbraw/zinc/01/28/52/1365012852.db2.gz IJMJVHOZVUJFQR-WMZOPIPTSA-N 1 3 349.494 2.537 10 0 EFAEHO CC(C)N(CC[N@H+](C)CC1CC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001403932314 1365059978 /nfs/dbraw/zinc/05/99/78/1365059978.db2.gz IGEFFUFSQLDSQE-IBGZPJMESA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CC1CC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001403932314 1365059981 /nfs/dbraw/zinc/05/99/81/1365059981.db2.gz IGEFFUFSQLDSQE-IBGZPJMESA-N 1 3 341.515 2.778 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2cccc(Cl)c2)C1)N(C)C ZINC001404016915 1365172432 /nfs/dbraw/zinc/17/24/32/1365172432.db2.gz LMOFYLKUIDUBRL-OFLPRAFFSA-N 1 3 337.895 2.759 10 0 EFAEHO CC(C)[NH2+]Cc1ccc(CNC(=O)CN2[C@@H](C)CC[C@@H]2C)c(F)c1 ZINC001404026526 1365184317 /nfs/dbraw/zinc/18/43/17/1365184317.db2.gz CCYKOXMZPVDKFU-GJZGRUSLSA-N 1 3 335.467 2.813 10 0 EFAEHO CC(C)[NH2+]Cc1ccc(CNC(=O)CN2[C@H](C)CC[C@H]2C)c(F)c1 ZINC001404026530 1365184502 /nfs/dbraw/zinc/18/45/02/1365184502.db2.gz CCYKOXMZPVDKFU-HUUCEWRRSA-N 1 3 335.467 2.813 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001404097931 1365257373 /nfs/dbraw/zinc/25/73/73/1365257373.db2.gz SEUZVYCGBKNJFK-QFBILLFUSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001404097931 1365257376 /nfs/dbraw/zinc/25/73/76/1365257376.db2.gz SEUZVYCGBKNJFK-QFBILLFUSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@H+](CC2CCC(C)CC2)C2CC2)C1 ZINC001404272204 1365418665 /nfs/dbraw/zinc/41/86/65/1365418665.db2.gz QRLAJFBABIAZOR-LXPRWKDFSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@@H+](CC2CCC(C)CC2)C2CC2)C1 ZINC001404272204 1365418673 /nfs/dbraw/zinc/41/86/73/1365418673.db2.gz QRLAJFBABIAZOR-LXPRWKDFSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@@H+](CCNC(=O)CN(C)C(C)C)C1CC1 ZINC001404292152 1365433397 /nfs/dbraw/zinc/43/33/97/1365433397.db2.gz KNGBWTQWKXPLCR-KRWDZBQOSA-N 1 3 331.504 2.977 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@H+](CCNC(=O)CN(C)C(C)C)C1CC1 ZINC001404292152 1365433400 /nfs/dbraw/zinc/43/34/00/1365433400.db2.gz KNGBWTQWKXPLCR-KRWDZBQOSA-N 1 3 331.504 2.977 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+][C@@H](C)c1cccc(Cl)c1 ZINC001404327520 1365452353 /nfs/dbraw/zinc/45/23/53/1365452353.db2.gz MEQPZGVMUKQIQE-AWEZNQCLSA-N 1 3 325.884 2.789 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1)[C@H]1CCN(CC)C1 ZINC001404437233 1365541629 /nfs/dbraw/zinc/54/16/29/1365541629.db2.gz HWJMBGUSZSEXLL-HKUYNNGSSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@H+](C2CCCCC2)C1)[C@H]1CCN(CC)C1 ZINC001404437233 1365541635 /nfs/dbraw/zinc/54/16/35/1365541635.db2.gz HWJMBGUSZSEXLL-HKUYNNGSSA-N 1 3 335.536 2.974 10 0 EFAEHO CCc1ccc(C[N@H+]2CC[C@@H](CCNC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001404512780 1365615227 /nfs/dbraw/zinc/61/52/27/1365615227.db2.gz HQRVVJSEYZTAHW-WOJBJXKFSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccc(C[N@@H+]2CC[C@@H](CCNC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001404512780 1365615230 /nfs/dbraw/zinc/61/52/30/1365615230.db2.gz HQRVVJSEYZTAHW-WOJBJXKFSA-N 1 3 345.531 2.917 10 0 EFAEHO CN(C/C=C\Cl)CC1CCN(C(=O)C(C)(C)[NH+]2CCCC2)CC1 ZINC001404619533 1365720544 /nfs/dbraw/zinc/72/05/44/1365720544.db2.gz NKTBFNTWTXQBAQ-TWGQIWQCSA-N 1 3 341.927 2.784 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(C[N@H+](C)CCC(C)(C)C)CC2)C1 ZINC001404624389 1365725952 /nfs/dbraw/zinc/72/59/52/1365725952.db2.gz YTIYTHYXKFDSHB-QGZVFWFLSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(C[N@@H+](C)CCC(C)(C)C)CC2)C1 ZINC001404624389 1365725956 /nfs/dbraw/zinc/72/59/56/1365725956.db2.gz YTIYTHYXKFDSHB-QGZVFWFLSA-N 1 3 337.552 2.935 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)c1 ZINC001437566072 1387774854 /nfs/dbraw/zinc/77/48/54/1387774854.db2.gz QGBPZSPZGVEWNE-HDICACEKSA-N 1 3 331.504 2.724 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)c1 ZINC001437566072 1387774857 /nfs/dbraw/zinc/77/48/57/1387774857.db2.gz QGBPZSPZGVEWNE-HDICACEKSA-N 1 3 331.504 2.724 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH+]2CC(CNC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001404909989 1365901566 /nfs/dbraw/zinc/90/15/66/1365901566.db2.gz UURNZNOPOZOTGZ-FXAWDEMLSA-N 1 3 345.531 2.999 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1ccc(F)cc1 ZINC001405251657 1366118622 /nfs/dbraw/zinc/11/86/22/1366118622.db2.gz JUXYBEALOXDVPC-MSOLQXFVSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NCc1c(C)cccc1Cl ZINC001405352498 1366159074 /nfs/dbraw/zinc/15/90/74/1366159074.db2.gz VBNXOVWIFFRLRO-GJZGRUSLSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NCc1c(C)cccc1Cl ZINC001405352498 1366159078 /nfs/dbraw/zinc/15/90/78/1366159078.db2.gz VBNXOVWIFFRLRO-GJZGRUSLSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NCc1c(C)cccc1Cl ZINC001405352500 1366159187 /nfs/dbraw/zinc/15/91/87/1366159187.db2.gz VBNXOVWIFFRLRO-LSDHHAIUSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NCc1c(C)cccc1Cl ZINC001405352500 1366159196 /nfs/dbraw/zinc/15/91/96/1366159196.db2.gz VBNXOVWIFFRLRO-LSDHHAIUSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NCc1c(C)cccc1Cl ZINC001405352497 1366159276 /nfs/dbraw/zinc/15/92/76/1366159276.db2.gz VBNXOVWIFFRLRO-CABCVRRESA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NCc1c(C)cccc1Cl ZINC001405352497 1366159280 /nfs/dbraw/zinc/15/92/80/1366159280.db2.gz VBNXOVWIFFRLRO-CABCVRRESA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H]1CCCc2ccccc21 ZINC001405358834 1366162234 /nfs/dbraw/zinc/16/22/34/1366162234.db2.gz CVRVTSDKZZWAEK-IEBWSBKVSA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@](C)(C[NH2+]Cc1ccccc1)C1CC1 ZINC001405428609 1366194162 /nfs/dbraw/zinc/19/41/62/1366194162.db2.gz HAGGMYUXSQPBJU-FPOVZHCZSA-N 1 3 343.515 2.934 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1CC[C@H]([NH2+]C/C=C\Cl)CC1 ZINC001405518143 1366262924 /nfs/dbraw/zinc/26/29/24/1366262924.db2.gz AEUNYEHIXSAYBD-BXTNXBSWSA-N 1 3 327.900 2.629 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCCC1CCN(C/C=C/Cl)CC1 ZINC001405557428 1366293351 /nfs/dbraw/zinc/29/33/51/1366293351.db2.gz HXKIFOWQYXUTIY-QYSIDVQXSA-N 1 3 341.927 2.832 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCCC1CCN(C/C=C/Cl)CC1 ZINC001405557428 1366293356 /nfs/dbraw/zinc/29/33/56/1366293356.db2.gz HXKIFOWQYXUTIY-QYSIDVQXSA-N 1 3 341.927 2.832 10 0 EFAEHO CC[C@@H](C(=O)NCCC1CC[NH+](Cc2ccsc2)CC1)N(C)C ZINC001405560492 1366296107 /nfs/dbraw/zinc/29/61/07/1366296107.db2.gz VBBBIZQXZXKMTJ-KRWDZBQOSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@H](F)CN1CCC(CCNC(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)CC1 ZINC001405565655 1366299466 /nfs/dbraw/zinc/29/94/66/1366299466.db2.gz WLKPVGYOBZTHFZ-OKZBNKHCSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[C@H](F)CN1CCC(CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)CC1 ZINC001405565655 1366299469 /nfs/dbraw/zinc/29/94/69/1366299469.db2.gz WLKPVGYOBZTHFZ-OKZBNKHCSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC2(C1)CCN(C(=O)[C@H]1CCCN1C)CC2 ZINC001405612682 1366313728 /nfs/dbraw/zinc/31/37/28/1366313728.db2.gz XVIQODYCTFBJTQ-GOSISDBHSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)CCC[N@H+]1CCC2(C1)CCN(C(=O)[C@H]1CCCN1C)CC2 ZINC001405612682 1366313732 /nfs/dbraw/zinc/31/37/32/1366313732.db2.gz XVIQODYCTFBJTQ-GOSISDBHSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCCC1)C[NH2+]Cc1ccsc1 ZINC001405678159 1366331851 /nfs/dbraw/zinc/33/18/51/1366331851.db2.gz PKQYVXZAFHLJBX-HNNXBMFYSA-N 1 3 337.533 2.855 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001405686951 1366338072 /nfs/dbraw/zinc/33/80/72/1366338072.db2.gz GVPYUVOBRUCUJX-HNNXBMFYSA-N 1 3 349.494 2.850 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+][C@H]1CCCc2ccccc21 ZINC001405724871 1366365856 /nfs/dbraw/zinc/36/58/56/1366365856.db2.gz XTAKSFHRQPAOAC-APWZRJJASA-N 1 3 331.504 2.746 10 0 EFAEHO C[C@@H](C[NH2+]CC1CC2(CCC2)C1)N(C)C(=O)CN(C)CC(C)(C)C ZINC001405862697 1366471647 /nfs/dbraw/zinc/47/16/47/1366471647.db2.gz JQCJWYPDWMAIQX-INIZCTEOSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]C[C@@H](C)N(C)C(=O)Cc2c[nH]cn2)c1 ZINC001405866415 1366475361 /nfs/dbraw/zinc/47/53/61/1366475361.db2.gz GHRWHLFFJDFYMB-HZPDHXFCSA-N 1 3 328.460 2.767 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C[C@H](C)N(C)C(=O)Cc2c[nH]cn2)c1 ZINC001405866412 1366475663 /nfs/dbraw/zinc/47/56/63/1366475663.db2.gz GHRWHLFFJDFYMB-HOTGVXAUSA-N 1 3 328.460 2.767 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)N(C)C(=O)C[N@@H+]1CC[C@H](C)C1 ZINC001405875716 1366484123 /nfs/dbraw/zinc/48/41/23/1366484123.db2.gz YHWUMNAUAFYTEA-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)N(C)C(=O)C[N@H+]1CC[C@H](C)C1 ZINC001405875716 1366484125 /nfs/dbraw/zinc/48/41/25/1366484125.db2.gz YHWUMNAUAFYTEA-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H](CC(C)C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001405937355 1366540182 /nfs/dbraw/zinc/54/01/82/1366540182.db2.gz RQMMCPWUABRKNP-AZUAARDMSA-N 1 3 345.531 2.957 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(CC[N@@H+](C)CC[C@H](C)F)CC1 ZINC001405994710 1367067938 /nfs/dbraw/zinc/06/79/38/1367067938.db2.gz BZACISXAIHOPLW-INIZCTEOSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(CC[N@H+](C)CC[C@H](C)F)CC1 ZINC001405994710 1367067944 /nfs/dbraw/zinc/06/79/44/1367067944.db2.gz BZACISXAIHOPLW-INIZCTEOSA-N 1 3 329.504 2.635 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)c(C)c1 ZINC001405990650 1367061881 /nfs/dbraw/zinc/06/18/81/1367061881.db2.gz ZWMUUDWEKNSGST-UYAOXDASSA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]C/C=C/Cl ZINC001406035000 1367122193 /nfs/dbraw/zinc/12/21/93/1367122193.db2.gz CSQUEXTVPNMZPK-KLYJYZACSA-N 1 3 347.906 2.682 10 0 EFAEHO CC(C)[C@H](CNC(=O)CC[NH+](C)C)NCc1cc(F)ccc1Cl ZINC001406034849 1367122611 /nfs/dbraw/zinc/12/26/11/1367122611.db2.gz IPDBNVBHVUSMEM-INIZCTEOSA-N 1 3 343.874 2.661 10 0 EFAEHO CN(CCN(C)C(=O)C(C)(C)[NH+]1CCCC1)Cc1ccc(CF)cc1 ZINC001406128063 1367281313 /nfs/dbraw/zinc/28/13/13/1367281313.db2.gz SECOMZWIMVXKTQ-UHFFFAOYSA-N 1 3 349.494 2.921 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCc2ccc(Cl)cc21)C(=O)CN1CCCC1 ZINC001406336831 1367500656 /nfs/dbraw/zinc/50/06/56/1367500656.db2.gz FVEKMOMKUIGZHZ-SFHVURJKSA-N 1 3 349.906 2.861 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)C23CCC[NH+](CCC2)C3)c1 ZINC001406365905 1367526787 /nfs/dbraw/zinc/52/67/87/1367526787.db2.gz SCUGTQQAAJHXAQ-MRXNPFEDSA-N 1 3 347.478 2.604 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)C[C@@H]2CC[N@H+](C)C2)c(Cl)c1 ZINC001406543875 1367706984 /nfs/dbraw/zinc/70/69/84/1367706984.db2.gz LIJXWWNRSKLZOY-GJZGRUSLSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)C[C@@H]2CC[N@@H+](C)C2)c(Cl)c1 ZINC001406543875 1367706989 /nfs/dbraw/zinc/70/69/89/1367706989.db2.gz LIJXWWNRSKLZOY-GJZGRUSLSA-N 1 3 337.895 2.585 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001406552559 1367718261 /nfs/dbraw/zinc/71/82/61/1367718261.db2.gz AJGWPAVANZDIBT-HNAYVOBHSA-N 1 3 342.487 2.637 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)cc1F ZINC001406641664 1367849851 /nfs/dbraw/zinc/84/98/51/1367849851.db2.gz YHBFKTKQSZQWMM-SJLPKXTDSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)cc1F ZINC001406641664 1367849854 /nfs/dbraw/zinc/84/98/54/1367849854.db2.gz YHBFKTKQSZQWMM-SJLPKXTDSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1C[NH+]2CCC1CC2)[C@H](C)c1ccc(F)cc1 ZINC001492954027 1367862449 /nfs/dbraw/zinc/86/24/49/1367862449.db2.gz OSIXHUIBPWMLRO-DNVCBOLYSA-N 1 3 347.478 2.667 10 0 EFAEHO CC(C)c1ccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CC[N@H+](C)C2)cc1 ZINC001406690663 1367928964 /nfs/dbraw/zinc/92/89/64/1367928964.db2.gz AATKPQQMMPDEJV-QFBILLFUSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)c1ccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001406690663 1367928966 /nfs/dbraw/zinc/92/89/66/1367928966.db2.gz AATKPQQMMPDEJV-QFBILLFUSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)CCc1ccc(Cl)cc1 ZINC001406722950 1367971459 /nfs/dbraw/zinc/97/14/59/1367971459.db2.gz OLUZYENJSJIMOW-OAHLLOKOSA-N 1 3 339.911 2.659 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)CCc1ccc(Cl)cc1 ZINC001406722950 1367971462 /nfs/dbraw/zinc/97/14/62/1367971462.db2.gz OLUZYENJSJIMOW-OAHLLOKOSA-N 1 3 339.911 2.659 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1sccc1Cl)C1CC1)N(C)C ZINC001406781170 1368042151 /nfs/dbraw/zinc/04/21/51/1368042151.db2.gz JYYGLMSIGCEUIN-ZIAGYGMSSA-N 1 3 343.924 2.726 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](NC(=O)CN(C)C(C)C)C2CC2)c(C)c1 ZINC001406836728 1368111623 /nfs/dbraw/zinc/11/16/23/1368111623.db2.gz XTOAQWCUVOZELA-LJQANCHMSA-N 1 3 331.504 2.628 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@@H]1CC[N@@H+]1CC1CCCCCC1 ZINC001406836886 1368111755 /nfs/dbraw/zinc/11/17/55/1368111755.db2.gz STEWUTOPEWWEHC-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@@H]1CC[N@H+]1CC1CCCCCC1 ZINC001406836886 1368111764 /nfs/dbraw/zinc/11/17/64/1368111764.db2.gz STEWUTOPEWWEHC-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)NC[C@@H]1CCCN1CCCF ZINC001437673910 1387923552 /nfs/dbraw/zinc/92/35/52/1387923552.db2.gz OOXCXPNKKUVOTH-INIZCTEOSA-N 1 3 327.488 2.580 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)NC[C@@H]1CCCN1CCCF ZINC001437673910 1387923559 /nfs/dbraw/zinc/92/35/59/1387923559.db2.gz OOXCXPNKKUVOTH-INIZCTEOSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+][C@H](C)c2ccc(F)cc2)CC1 ZINC001406924004 1368218569 /nfs/dbraw/zinc/21/85/69/1368218569.db2.gz YUDDLEBCTWOZGU-CRAIPNDOSA-N 1 3 347.478 2.998 10 0 EFAEHO C[C@H]([NH2+]C1(CNC(=O)C2(N(C)C)CCC2)CC1)c1ccc(F)cc1 ZINC001406941375 1368232340 /nfs/dbraw/zinc/23/23/40/1368232340.db2.gz BOYVIFZHGDMWPI-AWEZNQCLSA-N 1 3 333.451 2.609 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]C1(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001406941599 1368232386 /nfs/dbraw/zinc/23/23/86/1368232386.db2.gz IBMXHYAEBBOGRL-MRXNPFEDSA-N 1 3 329.488 2.779 10 0 EFAEHO C[C@@H]([NH2+]C1(CNC(=O)C2(N(C)C)CCC2)CC1)c1cccc(F)c1 ZINC001406945408 1368235147 /nfs/dbraw/zinc/23/51/47/1368235147.db2.gz JSDJETCFIMJIGM-CQSZACIVSA-N 1 3 333.451 2.609 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+][C@@H](C)c1ccc(F)cc1 ZINC001407110502 1368437250 /nfs/dbraw/zinc/43/72/50/1368437250.db2.gz QKYYWEDDPKUTLL-YJBOKZPZSA-N 1 3 335.467 2.808 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC1(C)CCN(Cc2ccsc2)CC1 ZINC001407131062 1368464575 /nfs/dbraw/zinc/46/45/75/1368464575.db2.gz ICWJOBWVSXPMGJ-UHFFFAOYSA-N 1 3 337.533 2.951 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC1(C)CCN(Cc2ccsc2)CC1 ZINC001407131062 1368464569 /nfs/dbraw/zinc/46/45/69/1368464569.db2.gz ICWJOBWVSXPMGJ-UHFFFAOYSA-N 1 3 337.533 2.951 10 0 EFAEHO CC(C)C[NH+]1CCC(C)(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001407132838 1368468496 /nfs/dbraw/zinc/46/84/96/1368468496.db2.gz YWGSKPVRPYAKQW-LJQANCHMSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@@H]1CCCN1[C@@H](C)c1cccc(OC)c1 ZINC001437688128 1387943082 /nfs/dbraw/zinc/94/30/82/1387943082.db2.gz RJBKMGKAQSDAOW-WMZOPIPTSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@@H]1CCCN1[C@@H](C)c1cccc(OC)c1 ZINC001437688128 1387943087 /nfs/dbraw/zinc/94/30/87/1387943087.db2.gz RJBKMGKAQSDAOW-WMZOPIPTSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@H]1CCCN1[C@@H](C)c1cccc(OC)c1 ZINC001437688121 1387944210 /nfs/dbraw/zinc/94/42/10/1387944210.db2.gz RJBKMGKAQSDAOW-FUHWJXTLSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@H]1CCCN1[C@@H](C)c1cccc(OC)c1 ZINC001437688121 1387944215 /nfs/dbraw/zinc/94/42/15/1387944215.db2.gz RJBKMGKAQSDAOW-FUHWJXTLSA-N 1 3 347.503 2.679 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@]1(C)CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001407175657 1368544705 /nfs/dbraw/zinc/54/47/05/1368544705.db2.gz JLXKXJPTUOAJFL-FQEVSTJZSA-N 1 3 329.488 2.596 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2cc(F)ccc2C)C1)N(C)C ZINC001407219161 1368603392 /nfs/dbraw/zinc/60/33/92/1368603392.db2.gz DQNRWEVSHMYLKO-UYAOXDASSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C2CC[NH+](CC3CC3)CC2)C1 ZINC001407503603 1368918334 /nfs/dbraw/zinc/91/83/34/1368918334.db2.gz YECQNIMJUBWOMA-IBGZPJMESA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C2 ZINC001407539673 1368958306 /nfs/dbraw/zinc/95/83/06/1368958306.db2.gz ZNGQMOYYOZOJIR-BCDXTJNWSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C2 ZINC001407539673 1368958307 /nfs/dbraw/zinc/95/83/07/1368958307.db2.gz ZNGQMOYYOZOJIR-BCDXTJNWSA-N 1 3 335.536 2.876 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](C[C@@H]1CC[C@@H]3C[C@@H]3C1)CC2 ZINC001407721075 1369160012 /nfs/dbraw/zinc/16/00/12/1369160012.db2.gz RWECKUHZTZEMBE-QRVBRYPASA-N 1 3 347.547 2.689 10 0 EFAEHO Cc1ccccc1CCC[N@H+]1CC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001437737936 1387987795 /nfs/dbraw/zinc/98/77/95/1387987795.db2.gz KEXOQOUIYAJHAQ-IBGZPJMESA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccccc1CCC[N@@H+]1CC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001437737936 1387987800 /nfs/dbraw/zinc/98/78/00/1387987800.db2.gz KEXOQOUIYAJHAQ-IBGZPJMESA-N 1 3 345.531 2.706 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001407812898 1369262785 /nfs/dbraw/zinc/26/27/85/1369262785.db2.gz VCSZLMQJWNCDMW-IRXDYDNUSA-N 1 3 347.528 2.894 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001407812898 1369262793 /nfs/dbraw/zinc/26/27/93/1369262793.db2.gz VCSZLMQJWNCDMW-IRXDYDNUSA-N 1 3 347.528 2.894 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+]([C@H](C)c2cccc(F)c2)C1 ZINC001437741040 1387991819 /nfs/dbraw/zinc/99/18/19/1387991819.db2.gz PHECEVZDHLNOIR-CVEARBPZSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+]([C@H](C)c2cccc(F)c2)C1 ZINC001437741040 1387991835 /nfs/dbraw/zinc/99/18/35/1387991835.db2.gz PHECEVZDHLNOIR-CVEARBPZSA-N 1 3 335.467 2.665 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)CC1 ZINC001407899418 1369366792 /nfs/dbraw/zinc/36/67/92/1369366792.db2.gz ZOQGKCXQPHSLMU-ICSRJNTNSA-N 1 3 343.515 2.986 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[N@H+]([C@H]2CCc3ccccc32)CC1 ZINC001407899418 1369366798 /nfs/dbraw/zinc/36/67/98/1369366798.db2.gz ZOQGKCXQPHSLMU-ICSRJNTNSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[N@H+](C)CC1CC(C)(C)C1)N(C)C ZINC001407913511 1369387115 /nfs/dbraw/zinc/38/71/15/1369387115.db2.gz ABZQLLHZUWFCNS-QGZVFWFLSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[N@@H+](C)CC1CC(C)(C)C1)N(C)C ZINC001407913511 1369387120 /nfs/dbraw/zinc/38/71/20/1369387120.db2.gz ABZQLLHZUWFCNS-QGZVFWFLSA-N 1 3 325.541 2.789 10 0 EFAEHO CN(CCC[N@H+](C)C[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)CN(C)C1CCC1 ZINC001407917624 1369395291 /nfs/dbraw/zinc/39/52/91/1369395291.db2.gz NIXMOZWGLOEWEM-KURKYZTESA-N 1 3 335.536 2.687 10 0 EFAEHO CN(CCC[N@@H+](C)C[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)CN(C)C1CCC1 ZINC001407917624 1369395300 /nfs/dbraw/zinc/39/53/00/1369395300.db2.gz NIXMOZWGLOEWEM-KURKYZTESA-N 1 3 335.536 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(CC)([NH2+]Cc2ncccc2C)CC1 ZINC001407983678 1369493051 /nfs/dbraw/zinc/49/30/51/1369493051.db2.gz QLEHEUJPSGVQCN-UHFFFAOYSA-N 1 3 346.519 2.593 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001408080005 1369587072 /nfs/dbraw/zinc/58/70/72/1369587072.db2.gz AKXKNCCLJHUVMZ-OXJNMPFZSA-N 1 3 343.515 2.841 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CC[N@@H+](CCCC(C)C)CC1(C)C ZINC001408141854 1369642952 /nfs/dbraw/zinc/64/29/52/1369642952.db2.gz KKHXZKHFQSBQHH-KRWDZBQOSA-N 1 3 334.508 2.914 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CC[N@H+](CCCC(C)C)CC1(C)C ZINC001408141854 1369642956 /nfs/dbraw/zinc/64/29/56/1369642956.db2.gz KKHXZKHFQSBQHH-KRWDZBQOSA-N 1 3 334.508 2.914 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)C2(C[NH+](C)C)CC2)CCN1Cc1ccsc1 ZINC001408179393 1369685845 /nfs/dbraw/zinc/68/58/45/1369685845.db2.gz JBBKZPUAWIHMLE-GOEBONIOSA-N 1 3 335.517 2.559 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cccc(Cl)c1 ZINC001408211092 1369717128 /nfs/dbraw/zinc/71/71/28/1369717128.db2.gz CNSVCONWYWQFRI-CABCVRRESA-N 1 3 337.895 2.666 10 0 EFAEHO CCCCN1CCc2ccccc2[C@H]1CNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001408251022 1369752336 /nfs/dbraw/zinc/75/23/36/1369752336.db2.gz HSESMXZUOHTRQX-FXAWDEMLSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCCN1CCc2ccccc2[C@H]1CNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001408251022 1369752338 /nfs/dbraw/zinc/75/23/38/1369752338.db2.gz HSESMXZUOHTRQX-FXAWDEMLSA-N 1 3 343.515 2.844 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@H]1c2ccccc2CCN1CC[C@@H](C)F ZINC001408269610 1369766941 /nfs/dbraw/zinc/76/69/41/1369766941.db2.gz XANSGKPZKLVOOF-APWZRJJASA-N 1 3 349.494 2.792 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@H]1c2ccccc2CCN1CC[C@@H](C)F ZINC001408269610 1369766944 /nfs/dbraw/zinc/76/69/44/1369766944.db2.gz XANSGKPZKLVOOF-APWZRJJASA-N 1 3 349.494 2.792 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@@H]1C[N@H+](C)CCC1CC1 ZINC001408357888 1369870990 /nfs/dbraw/zinc/87/09/90/1369870990.db2.gz SJUJJRBGFXIDQG-MOPGFXCFSA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@@H]1C[N@@H+](C)CCC1CC1 ZINC001408357888 1369870993 /nfs/dbraw/zinc/87/09/93/1369870993.db2.gz SJUJJRBGFXIDQG-MOPGFXCFSA-N 1 3 335.536 2.972 10 0 EFAEHO C[C@@H]([NH2+]CCc1cccs1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001437851046 1388141307 /nfs/dbraw/zinc/14/13/07/1388141307.db2.gz FADBSMDUSDCMCR-MRXNPFEDSA-N 1 3 349.544 2.603 10 0 EFAEHO CCC(CC)C[NH2+][C@@H](C)C1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001437852599 1388141914 /nfs/dbraw/zinc/14/19/14/1388141914.db2.gz NZBRKKBHQKXAID-IRXDYDNUSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N3CCN(CC4CCCCC4)CC3)C[N@@H+]2C1 ZINC001417621426 1373100996 /nfs/dbraw/zinc/10/09/96/1373100996.db2.gz KLXBZHLINMXBMT-HOJAQTOUSA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N3CCN(CC4CCCCC4)CC3)C[N@H+]2C1 ZINC001417621426 1373101009 /nfs/dbraw/zinc/10/10/09/1373101009.db2.gz KLXBZHLINMXBMT-HOJAQTOUSA-N 1 3 347.547 2.831 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001417625295 1373103889 /nfs/dbraw/zinc/10/38/89/1373103889.db2.gz MODNCYSLLXRZQX-OALUTQOASA-N 1 3 329.488 2.594 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001417625295 1373103893 /nfs/dbraw/zinc/10/38/93/1373103893.db2.gz MODNCYSLLXRZQX-OALUTQOASA-N 1 3 329.488 2.594 10 0 EFAEHO O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001417646246 1373120190 /nfs/dbraw/zinc/12/01/90/1373120190.db2.gz AJWPAJHDRWTELQ-HSALFYBXSA-N 1 3 341.499 2.784 10 0 EFAEHO O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001417646246 1373120197 /nfs/dbraw/zinc/12/01/97/1373120197.db2.gz AJWPAJHDRWTELQ-HSALFYBXSA-N 1 3 341.499 2.784 10 0 EFAEHO CN(C[C@@H]1CC[N@@H+]1CC1CC2(CCC2)C1)C(=O)C(C)(C)N1CCCC1 ZINC001417741183 1373196879 /nfs/dbraw/zinc/19/68/79/1373196879.db2.gz MZBGNZJHKDFJQY-SFHVURJKSA-N 1 3 347.547 2.974 10 0 EFAEHO CN(C[C@@H]1CC[N@H+]1CC1CC2(CCC2)C1)C(=O)C(C)(C)N1CCCC1 ZINC001417741183 1373196880 /nfs/dbraw/zinc/19/68/80/1373196880.db2.gz MZBGNZJHKDFJQY-SFHVURJKSA-N 1 3 347.547 2.974 10 0 EFAEHO CN(C[C@@H]1CCN1CC1CC2(CCC2)C1)C(=O)C(C)(C)[NH+]1CCCC1 ZINC001417741183 1373196884 /nfs/dbraw/zinc/19/68/84/1373196884.db2.gz MZBGNZJHKDFJQY-SFHVURJKSA-N 1 3 347.547 2.974 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1C[C@H]([NH2+]CCC2CCCCC2)C1 ZINC001417802458 1373272125 /nfs/dbraw/zinc/27/21/25/1373272125.db2.gz XUZRMDMVKZTPIU-QAQDUYKDSA-N 1 3 332.492 2.715 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2[N@@H+](CCC(C)C)C1 ZINC001417819702 1373291193 /nfs/dbraw/zinc/29/11/93/1373291193.db2.gz ATVHZTHSPSYLKW-VJANTYMQSA-N 1 3 335.536 2.543 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2[N@H+](CCC(C)C)C1 ZINC001417819702 1373291198 /nfs/dbraw/zinc/29/11/98/1373291198.db2.gz ATVHZTHSPSYLKW-VJANTYMQSA-N 1 3 335.536 2.543 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@H]2CCC[N@H+](CCC(C)C)[C@@H]2C1(C)C ZINC001417821057 1373292649 /nfs/dbraw/zinc/29/26/49/1373292649.db2.gz HFXPEYGMXJMOAN-QRQLOZEOSA-N 1 3 337.552 2.980 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1[C@H]2CCC[N@@H+](CCC(C)C)[C@@H]2C1(C)C ZINC001417821057 1373292654 /nfs/dbraw/zinc/29/26/54/1373292654.db2.gz HFXPEYGMXJMOAN-QRQLOZEOSA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@H]2C)c(C)c1 ZINC001417852962 1373340754 /nfs/dbraw/zinc/34/07/54/1373340754.db2.gz XDZWWIYSIAXILZ-YZGWKJHDSA-N 1 3 345.531 2.969 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@H]2C)c(C)c1 ZINC001417852962 1373340760 /nfs/dbraw/zinc/34/07/60/1373340760.db2.gz XDZWWIYSIAXILZ-YZGWKJHDSA-N 1 3 345.531 2.969 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[N@H+](C/C=C\Cl)CC(C)(C)C2)CCC1 ZINC001417864435 1373359521 /nfs/dbraw/zinc/35/95/21/1373359521.db2.gz UYBOYFWUAJTSNL-IZIDJEDMSA-N 1 3 341.927 2.830 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[N@@H+](C/C=C\Cl)CC(C)(C)C2)CCC1 ZINC001417864435 1373359526 /nfs/dbraw/zinc/35/95/26/1373359526.db2.gz UYBOYFWUAJTSNL-IZIDJEDMSA-N 1 3 341.927 2.830 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CC[C@H]2C[C@@H](C)C[N@@H+]2C1 ZINC001417886052 1373374197 /nfs/dbraw/zinc/37/41/97/1373374197.db2.gz IMPAUCVGRZXWJZ-JYBIWHBTSA-N 1 3 343.515 2.744 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CC[C@H]2C[C@@H](C)C[N@H+]2C1 ZINC001417886052 1373374204 /nfs/dbraw/zinc/37/42/04/1373374204.db2.gz IMPAUCVGRZXWJZ-JYBIWHBTSA-N 1 3 343.515 2.744 10 0 EFAEHO Cc1ccccc1CN1CCC[C@H](NC(=O)CC[C@H]2CCC[N@H+]2C)C1 ZINC001417907322 1373401842 /nfs/dbraw/zinc/40/18/42/1373401842.db2.gz DRGNPZANTWGJMH-VQTJNVASSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccccc1CN1CCC[C@H](NC(=O)CC[C@H]2CCC[N@@H+]2C)C1 ZINC001417907322 1373401846 /nfs/dbraw/zinc/40/18/46/1373401846.db2.gz DRGNPZANTWGJMH-VQTJNVASSA-N 1 3 343.515 2.950 10 0 EFAEHO C[NH+](C)CCC(=O)NCC[C@H]1CCN(Cc2ccc(Cl)cc2)C1 ZINC001437944766 1388260305 /nfs/dbraw/zinc/26/03/05/1388260305.db2.gz NRCCALZVYSPFMO-INIZCTEOSA-N 1 3 337.895 2.620 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC12CC[NH+](Cc1cccc(C)c1)CC2)N(C)C ZINC001417954640 1373447893 /nfs/dbraw/zinc/44/78/93/1373447893.db2.gz LVFOGBWMWHMTPT-RTBURBONSA-N 1 3 343.515 2.806 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1ccccc1)C1CC1 ZINC001417981592 1373483690 /nfs/dbraw/zinc/48/36/90/1373483690.db2.gz YOGKYWWDGZXAHX-RTBURBONSA-N 1 3 329.488 2.544 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]([NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001417995426 1373500216 /nfs/dbraw/zinc/50/02/16/1373500216.db2.gz JKWSXOOWWLUBOS-ZWKOTPCHSA-N 1 3 335.536 2.637 10 0 EFAEHO Cc1cc(C[NH2+][C@H](CNC(=O)C(C)(C)N2CCCC2)C2CC2)cs1 ZINC001417996550 1373500893 /nfs/dbraw/zinc/50/08/93/1373500893.db2.gz WEYHUMUTMOGWEF-QGZVFWFLSA-N 1 3 349.544 2.915 10 0 EFAEHO CC[C@@H](F)CN(C)C[C@@H]1CCCN(C(=O)CCC[NH+]2CCCC2)C1 ZINC001418018272 1373528850 /nfs/dbraw/zinc/52/88/50/1373528850.db2.gz CSYIJYHEAIHOTK-ZWKOTPCHSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001418020968 1373532872 /nfs/dbraw/zinc/53/28/72/1373532872.db2.gz MFJNRYOSKDHURG-OALUTQOASA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001418020968 1373532879 /nfs/dbraw/zinc/53/28/79/1373532879.db2.gz MFJNRYOSKDHURG-OALUTQOASA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@@H]1CC[N@H+](CC2CCC2)C1 ZINC001437951826 1388269878 /nfs/dbraw/zinc/26/98/78/1388269878.db2.gz WSVLKCIWOBVPNE-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@@H]1CC[N@@H+](CC2CCC2)C1 ZINC001437951826 1388269884 /nfs/dbraw/zinc/26/98/84/1388269884.db2.gz WSVLKCIWOBVPNE-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001418095326 1373598686 /nfs/dbraw/zinc/59/86/86/1373598686.db2.gz RWHYYFKIYRTQFA-RMRDIRSESA-N 1 3 347.503 2.579 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC001437956914 1388273375 /nfs/dbraw/zinc/27/33/75/1388273375.db2.gz IJWHSXVTXLXKHW-HOTGVXAUSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC001437956914 1388273378 /nfs/dbraw/zinc/27/33/78/1388273378.db2.gz IJWHSXVTXLXKHW-HOTGVXAUSA-N 1 3 345.478 2.590 10 0 EFAEHO CCCN(C)CC(=O)NC1CCC([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC001418190061 1373754179 /nfs/dbraw/zinc/75/41/79/1373754179.db2.gz VNXLJSPZPRNYJA-QQFBHYJXSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001418222409 1373777116 /nfs/dbraw/zinc/77/71/16/1373777116.db2.gz PRWMNGXKDWGXHC-KXBFYZLASA-N 1 3 342.487 2.635 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)NCc1cccc(C(C)C)n1 ZINC001418228156 1373783108 /nfs/dbraw/zinc/78/31/08/1373783108.db2.gz FLYYZDUOIUDEJA-QFBILLFUSA-N 1 3 346.519 2.674 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)NCc1cccc(C(C)C)n1 ZINC001418228156 1373783115 /nfs/dbraw/zinc/78/31/15/1373783115.db2.gz FLYYZDUOIUDEJA-QFBILLFUSA-N 1 3 346.519 2.674 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1cc(C)ccc1C ZINC001418227980 1373783366 /nfs/dbraw/zinc/78/33/66/1373783366.db2.gz DKLGXHVMWUPDQS-MJGOQNOKSA-N 1 3 331.504 2.772 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+][C@H](C)CNC(=O)CN(C)C2CCC2)c1 ZINC001418234946 1373790102 /nfs/dbraw/zinc/79/01/02/1373790102.db2.gz MFMBMMYHWKUTNE-SJORKVTESA-N 1 3 331.504 2.943 10 0 EFAEHO Cc1ccc(CN[C@H](C)CNC(=O)CCC[NH+]2CCCCC2)c(C)n1 ZINC001418317173 1373897324 /nfs/dbraw/zinc/89/73/24/1373897324.db2.gz USCCKSMMCJOYPX-QGZVFWFLSA-N 1 3 346.519 2.559 10 0 EFAEHO C[C@]1(NC(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)CCN(Cc2ccccc2)C1 ZINC001418345602 1373920975 /nfs/dbraw/zinc/92/09/75/1373920975.db2.gz DLKCMTQLGHWVCQ-SBHAEUEKSA-N 1 3 341.499 2.784 10 0 EFAEHO C[C@]1(NC(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)CCN(Cc2ccccc2)C1 ZINC001418345602 1373920978 /nfs/dbraw/zinc/92/09/78/1373920978.db2.gz DLKCMTQLGHWVCQ-SBHAEUEKSA-N 1 3 341.499 2.784 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCC[C@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001418357141 1373929358 /nfs/dbraw/zinc/92/93/58/1373929358.db2.gz KINMICCUPSMKES-MOPGFXCFSA-N 1 3 331.504 2.852 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]([NH2+]CC=C(Cl)Cl)C1 ZINC001418361902 1373934922 /nfs/dbraw/zinc/93/49/22/1373934922.db2.gz SHTGLTKLEDOMOV-CHWSQXEVSA-N 1 3 336.307 2.663 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1cc(F)ccc1Cl)N(C)C ZINC001418409325 1373990743 /nfs/dbraw/zinc/99/07/43/1373990743.db2.gz XZAOCTCYYQEQKC-MLGOLLRUSA-N 1 3 343.874 2.804 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]CC1CCC2(CC2)CC1 ZINC001418419314 1374002691 /nfs/dbraw/zinc/00/26/91/1374002691.db2.gz ZVEGAQUBFHBGTL-DLBZAZTESA-N 1 3 335.536 2.783 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@H]([NH2+]Cc2cc3ccccc3o2)C1 ZINC001418544953 1374157768 /nfs/dbraw/zinc/15/77/68/1374157768.db2.gz NXJGICOBBIHNEJ-CRAIPNDOSA-N 1 3 343.471 2.710 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CCC[C@@H]2CCC[N@@H+]21)Cc1ccc(F)cc1 ZINC001418571347 1374201228 /nfs/dbraw/zinc/20/12/28/1374201228.db2.gz VOCOGRREHCTTCX-RTBURBONSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CCC[C@@H]2CCC[N@H+]21)Cc1ccc(F)cc1 ZINC001418571347 1374201234 /nfs/dbraw/zinc/20/12/34/1374201234.db2.gz VOCOGRREHCTTCX-RTBURBONSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CCC[C@H]2CCC[N@@H+]21)Cc1ccc(F)cc1 ZINC001418571344 1374201871 /nfs/dbraw/zinc/20/18/71/1374201871.db2.gz VOCOGRREHCTTCX-RBUKOAKNSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CCC[C@H]2CCC[N@H+]21)Cc1ccc(F)cc1 ZINC001418571344 1374201878 /nfs/dbraw/zinc/20/18/78/1374201878.db2.gz VOCOGRREHCTTCX-RBUKOAKNSA-N 1 3 347.478 2.781 10 0 EFAEHO CC[C@H](F)C[N@H+](C)C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001437991520 1388303347 /nfs/dbraw/zinc/30/33/47/1388303347.db2.gz POWJMDWWZIWILO-MJGOQNOKSA-N 1 3 349.494 2.890 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001437991520 1388303351 /nfs/dbraw/zinc/30/33/51/1388303351.db2.gz POWJMDWWZIWILO-MJGOQNOKSA-N 1 3 349.494 2.890 10 0 EFAEHO CCN(CCNC(=O)[C@@H](C(C)C)[NH+]1CCCC1)Cc1cccc(F)c1 ZINC001418585477 1374228140 /nfs/dbraw/zinc/22/81/40/1374228140.db2.gz GTTJADUSQJWSNQ-LJQANCHMSA-N 1 3 349.494 2.884 10 0 EFAEHO CN(C[C@H]1CCN1C[C@H]1CCCC(F)(F)C1)C(=O)CCC[NH+](C)C ZINC001418586930 1374229396 /nfs/dbraw/zinc/22/93/96/1374229396.db2.gz GMBQODSYNYEGDL-JKSUJKDBSA-N 1 3 345.478 2.686 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC[C@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001418681286 1374362484 /nfs/dbraw/zinc/36/24/84/1374362484.db2.gz IPBUPDMRYGFJJD-DLBZAZTESA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC[C@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001418681286 1374362488 /nfs/dbraw/zinc/36/24/88/1374362488.db2.gz IPBUPDMRYGFJJD-DLBZAZTESA-N 1 3 349.906 2.620 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC001418694467 1374378214 /nfs/dbraw/zinc/37/82/14/1374378214.db2.gz VXJSMLKOTNLPDJ-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC001418694467 1374378219 /nfs/dbraw/zinc/37/82/19/1374378219.db2.gz VXJSMLKOTNLPDJ-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC001418695372 1374379481 /nfs/dbraw/zinc/37/94/81/1374379481.db2.gz CQZFBSZIEXTURU-BEFAXECRSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC001418695372 1374379486 /nfs/dbraw/zinc/37/94/86/1374379486.db2.gz CQZFBSZIEXTURU-BEFAXECRSA-N 1 3 347.478 2.591 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@H](CNC(=O)CN(C)C(C)C)C2)cc1C ZINC001418711854 1374400093 /nfs/dbraw/zinc/40/00/93/1374400093.db2.gz WIWFBYWDCNZCMA-WGSAOQKQSA-N 1 3 331.504 2.628 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CC[C@@H]([NH2+]Cc3ccc(F)cc3)C2)CCC1 ZINC001418714165 1374404781 /nfs/dbraw/zinc/40/47/81/1374404781.db2.gz BGRUNBHAIPFOEN-FUHWJXTLSA-N 1 3 347.478 2.685 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NC[C@H]2CC[C@@H]([NH2+]C/C=C/Cl)C2)c1 ZINC001418730899 1374431626 /nfs/dbraw/zinc/43/16/26/1374431626.db2.gz NYFNOAMECDNOFX-MKQQKPNSSA-N 1 3 349.906 2.989 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cs1 ZINC001418735003 1374437219 /nfs/dbraw/zinc/43/72/19/1374437219.db2.gz XZYVTCQDFZIERN-UWWQBHOKSA-N 1 3 349.544 2.773 10 0 EFAEHO CN(CC(=O)N[C@@H]1[C@H]2CCC[N@H+](CC3CC3)[C@H]2C1(C)C)CC(C)(C)C ZINC001418740484 1374442504 /nfs/dbraw/zinc/44/25/04/1374442504.db2.gz BATLCTJXFXVBQQ-BHIYHBOVSA-N 1 3 349.563 2.980 10 0 EFAEHO CN(CC(=O)N[C@@H]1[C@H]2CCC[N@@H+](CC3CC3)[C@H]2C1(C)C)CC(C)(C)C ZINC001418740484 1374442508 /nfs/dbraw/zinc/44/25/08/1374442508.db2.gz BATLCTJXFXVBQQ-BHIYHBOVSA-N 1 3 349.563 2.980 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCC[N@H+](Cc1ccc(C2CC2)cc1)C1CC1 ZINC001418778154 1374490117 /nfs/dbraw/zinc/49/01/17/1374490117.db2.gz SLSCVWYQQCBDDP-HXUWFJFHSA-N 1 3 341.499 2.739 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCC[N@@H+](Cc1ccc(C2CC2)cc1)C1CC1 ZINC001418778154 1374490121 /nfs/dbraw/zinc/49/01/21/1374490121.db2.gz SLSCVWYQQCBDDP-HXUWFJFHSA-N 1 3 341.499 2.739 10 0 EFAEHO Cc1ccc(C)c(C[N@H+]2CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]2C)c1 ZINC001418799940 1374519911 /nfs/dbraw/zinc/51/99/11/1374519911.db2.gz CEOKSQXJJKEYNR-HOJAQTOUSA-N 1 3 345.531 2.969 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+]2CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]2C)c1 ZINC001418799940 1374519914 /nfs/dbraw/zinc/51/99/14/1374519914.db2.gz CEOKSQXJJKEYNR-HOJAQTOUSA-N 1 3 345.531 2.969 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@H](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001418844114 1374567132 /nfs/dbraw/zinc/56/71/32/1374567132.db2.gz JJDOLRUCIFLJDP-HZPDHXFCSA-N 1 3 343.531 2.929 10 0 EFAEHO CC[NH2+][C@H](CNC(=O)CN1CC[C@@H](C)C1)c1ccc(C(C)C)cc1 ZINC001418844708 1374567490 /nfs/dbraw/zinc/56/74/90/1374567490.db2.gz QPHMWZVCLXHEIF-VQIMIIECSA-N 1 3 331.504 2.919 10 0 EFAEHO Cc1cc(C)cc(CN2CC(CNC(=O)C(C)(C)[NH+]3CCCC3)C2)c1 ZINC001419023081 1374770530 /nfs/dbraw/zinc/77/05/30/1374770530.db2.gz MKEZISQJUVKSSF-UHFFFAOYSA-N 1 3 343.515 2.726 10 0 EFAEHO CCCN(C)CC(=O)NCC1C[NH+]([C@@H](C)c2cc(C)ccc2C)C1 ZINC001419044391 1374786898 /nfs/dbraw/zinc/78/68/98/1374786898.db2.gz ZACBRILNEJWIGG-KRWDZBQOSA-N 1 3 331.504 2.754 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1C[C@@H]2C[C@H]1C[N@@H+]2CC1CCCCC1 ZINC001419050005 1374791541 /nfs/dbraw/zinc/79/15/41/1374791541.db2.gz DZXXSAOYUCWTLD-OKZBNKHCSA-N 1 3 339.499 2.532 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1C[C@@H]2C[C@H]1C[N@H+]2CC1CCCCC1 ZINC001419050005 1374791543 /nfs/dbraw/zinc/79/15/43/1374791543.db2.gz DZXXSAOYUCWTLD-OKZBNKHCSA-N 1 3 339.499 2.532 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC[NH+]([C@@H]2CCc3ccccc32)CC1)N(C)C ZINC001419081850 1374821015 /nfs/dbraw/zinc/82/10/15/1374821015.db2.gz GJNKHFROKMCEHG-VQTJNVASSA-N 1 3 343.515 2.937 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1cccc(F)c1 ZINC001419187177 1374933063 /nfs/dbraw/zinc/93/30/63/1374933063.db2.gz WNJQVWCVOOUIBX-MSOLQXFVSA-N 1 3 335.467 2.683 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1cccc(F)c1 ZINC001419187178 1374933245 /nfs/dbraw/zinc/93/32/45/1374933245.db2.gz WNJQVWCVOOUIBX-QZTJIDSGSA-N 1 3 335.467 2.683 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1cccc(F)c1 ZINC001419187179 1374933288 /nfs/dbraw/zinc/93/32/88/1374933288.db2.gz WNJQVWCVOOUIBX-ROUUACIJSA-N 1 3 335.467 2.683 10 0 EFAEHO CC[C@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)NCc1ccccc1F ZINC001419193786 1374939836 /nfs/dbraw/zinc/93/98/36/1374939836.db2.gz KWEABIFPRMMFHN-SJORKVTESA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)NCc1ccccc1F ZINC001419193786 1374939838 /nfs/dbraw/zinc/93/98/38/1374939838.db2.gz KWEABIFPRMMFHN-SJORKVTESA-N 1 3 335.467 2.685 10 0 EFAEHO C[C@H](F)CC[NH+]1CCC2(C[C@H]2NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001419201903 1374947703 /nfs/dbraw/zinc/94/77/03/1374947703.db2.gz AHXXDUJTCPZULN-JKSUJKDBSA-N 1 3 341.515 2.683 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1ccccc1)C1CC1 ZINC001419260031 1375006550 /nfs/dbraw/zinc/00/65/50/1375006550.db2.gz JBDUIEGIOYAJBX-RBUKOAKNSA-N 1 3 329.488 2.545 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]([NH2+]Cc2ccc(Cl)cc2)C2CC2)C1 ZINC001419297881 1375055974 /nfs/dbraw/zinc/05/59/74/1375055974.db2.gz NPQYZCZSJVZTRU-RDTXWAMCSA-N 1 3 349.906 2.666 10 0 EFAEHO CC(C)CC[NH2+][C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001419298056 1375057562 /nfs/dbraw/zinc/05/75/62/1375057562.db2.gz PIWVYSTVQPUEEV-APWZRJJASA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C[NH2+]C[C@@H]2CCC(F)(F)C2)CCCC1 ZINC001419319831 1375093952 /nfs/dbraw/zinc/09/39/52/1375093952.db2.gz MIRJWDKBAQZDDQ-OAHLLOKOSA-N 1 3 345.478 2.781 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@@](C)(NC(=O)CN(C)C(C)C)C1CC1 ZINC001419356188 1375156725 /nfs/dbraw/zinc/15/67/25/1375156725.db2.gz GOMXQBKRUVUPJF-HXUWFJFHSA-N 1 3 349.494 2.849 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]2CN(Cc3ccc(F)cc3)CC[C@H]21 ZINC001419450663 1375290874 /nfs/dbraw/zinc/29/08/74/1375290874.db2.gz QDHHHHOEIINYAK-IEBWSBKVSA-N 1 3 347.478 2.590 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)CC[C@H]21 ZINC001419453941 1375295272 /nfs/dbraw/zinc/29/52/72/1375295272.db2.gz YTIKGPQXGCIFOE-ZWKOTPCHSA-N 1 3 349.544 2.903 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]CC1CCC2(CC2)CC1 ZINC001419470167 1375313513 /nfs/dbraw/zinc/31/35/13/1375313513.db2.gz NIFSFYFZMMVFLD-MRXNPFEDSA-N 1 3 335.536 2.783 10 0 EFAEHO C[C@H](C[NH2+]Cc1cc2ccccc2o1)N(C)C(=O)[C@H]1CCCCN1C ZINC001419681774 1375704161 /nfs/dbraw/zinc/70/41/61/1375704161.db2.gz IFBNBQAVKRPJAI-CRAIPNDOSA-N 1 3 343.471 2.854 10 0 EFAEHO CCCc1ccc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001419719350 1375767255 /nfs/dbraw/zinc/76/72/55/1375767255.db2.gz KHSMLBHCPRTKEB-MSOLQXFVSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(Cl)cc1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001419722207 1375769692 /nfs/dbraw/zinc/76/96/92/1375769692.db2.gz PYNUNQFXHCPNRY-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001419735557 1375788259 /nfs/dbraw/zinc/78/82/59/1375788259.db2.gz QCBVCGAWNZIBPW-YOEHRIQHSA-N 1 3 337.895 2.807 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C(=O)CN1CCCC1 ZINC001419750795 1375813330 /nfs/dbraw/zinc/81/33/30/1375813330.db2.gz WHVODWWXIJMVLT-MRXNPFEDSA-N 1 3 329.488 2.596 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001419770168 1375847133 /nfs/dbraw/zinc/84/71/33/1375847133.db2.gz IASDBHJIUCSSHC-CXAGYDPISA-N 1 3 349.906 2.906 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+][C@@H](C)CNC(=O)C2(N(C)C)CCC2)c1 ZINC001419776161 1375857825 /nfs/dbraw/zinc/85/78/25/1375857825.db2.gz NZDJIUKBEMOGBX-IRXDYDNUSA-N 1 3 331.504 2.943 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@@H](NC(=O)Cc1nc[nH]c1C)C1CCCCC1 ZINC001419822388 1375939137 /nfs/dbraw/zinc/93/91/37/1375939137.db2.gz QCQNFHVAIKUMAW-RDTXWAMCSA-N 1 3 334.508 2.961 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1cccc(Cl)c1 ZINC001419829845 1375951090 /nfs/dbraw/zinc/95/10/90/1375951090.db2.gz GEKYMDVGNNWNHH-CQSZACIVSA-N 1 3 337.895 2.809 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)CNC(=O)C(C)(C)N2CCCC2)c(C)s1 ZINC001419837456 1375963143 /nfs/dbraw/zinc/96/31/43/1375963143.db2.gz YZHDHVPJOKOPAD-CYBMUJFWSA-N 1 3 337.533 2.834 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C)[C@@H]1C[NH2+]CC1CC(C)(C)C1 ZINC001419849193 1375995178 /nfs/dbraw/zinc/99/51/78/1375995178.db2.gz SBXNTZRESKZRPN-WMZOPIPTSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCc1ccccc1 ZINC001419848832 1375995217 /nfs/dbraw/zinc/99/52/17/1375995217.db2.gz LDBVGQGKEGJTPT-OXQOHEQNSA-N 1 3 349.494 2.536 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](C)CNC(=O)[C@@H](C)N1CCCCCC1 ZINC001419871919 1376039520 /nfs/dbraw/zinc/03/95/20/1376039520.db2.gz RPAKOUSKSZQCPG-QZTJIDSGSA-N 1 3 331.504 2.854 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](C)CNC(=O)[C@@H](C)N1CCCCCC1 ZINC001419871923 1376039947 /nfs/dbraw/zinc/03/99/47/1376039947.db2.gz RPAKOUSKSZQCPG-ZWKOTPCHSA-N 1 3 331.504 2.854 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]Cc1cccnc1 ZINC001419899399 1376096474 /nfs/dbraw/zinc/09/64/74/1376096474.db2.gz FIXRAYHIGPZWDK-IEBWSBKVSA-N 1 3 346.519 2.577 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](CNC(=O)CC[NH+](C)C)C(C)C ZINC001419900084 1376096577 /nfs/dbraw/zinc/09/65/77/1376096577.db2.gz IWUWPADJTAHRKO-QGZVFWFLSA-N 1 3 339.911 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+][C@H]1CCc2c1cccc2Cl ZINC001419942518 1376167944 /nfs/dbraw/zinc/16/79/44/1376167944.db2.gz XLSMEBDOJBKLLO-GUYCJALGSA-N 1 3 337.895 2.762 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2ccc(C)cc2C)CC[N@@H+]1C ZINC001419967642 1376205533 /nfs/dbraw/zinc/20/55/33/1376205533.db2.gz RQYVRPNBNHZQFW-VQTJNVASSA-N 1 3 345.531 2.924 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2ccc(C)cc2C)CC[N@H+]1C ZINC001419967642 1376205538 /nfs/dbraw/zinc/20/55/38/1376205538.db2.gz RQYVRPNBNHZQFW-VQTJNVASSA-N 1 3 345.531 2.924 10 0 EFAEHO CC(C)c1ccc(C[N@H+](C)CCN(C)C(=O)[C@H]2CCCN2C)cc1 ZINC001419999449 1376258436 /nfs/dbraw/zinc/25/84/36/1376258436.db2.gz SOQPQFQODVQRBW-LJQANCHMSA-N 1 3 331.504 2.794 10 0 EFAEHO CC(C)c1ccc(C[N@@H+](C)CCN(C)C(=O)[C@H]2CCCN2C)cc1 ZINC001419999449 1376258438 /nfs/dbraw/zinc/25/84/38/1376258438.db2.gz SOQPQFQODVQRBW-LJQANCHMSA-N 1 3 331.504 2.794 10 0 EFAEHO Cc1cccc(CN2CC[C@H](N(C)C(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001438234858 1388432216 /nfs/dbraw/zinc/43/22/16/1388432216.db2.gz OLFAJDZCJJOMCU-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN2CC[C@H](N(C)C(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001438234858 1388432220 /nfs/dbraw/zinc/43/22/20/1388432220.db2.gz OLFAJDZCJJOMCU-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN2CC[C@@H](N(C)C(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001438234863 1388432689 /nfs/dbraw/zinc/43/26/89/1388432689.db2.gz OLFAJDZCJJOMCU-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1cccc(CN2CC[C@@H](N(C)C(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001438234863 1388432695 /nfs/dbraw/zinc/43/26/95/1388432695.db2.gz OLFAJDZCJJOMCU-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001420010848 1376277050 /nfs/dbraw/zinc/27/70/50/1376277050.db2.gz SVEXCHQGZASAGH-GOSISDBHSA-N 1 3 343.515 2.844 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+][C@H](C)CCNC(=O)[C@@H]1CCCN1C ZINC001420068689 1376413450 /nfs/dbraw/zinc/41/34/50/1376413450.db2.gz POOMQXSYTRVKQK-PBHICJAKSA-N 1 3 337.895 2.727 10 0 EFAEHO CC(C)c1cccc(C[NH2+][C@H](C)CCNC(=O)C2(N(C)C)CCC2)n1 ZINC001420098236 1376453645 /nfs/dbraw/zinc/45/36/45/1376453645.db2.gz IHCYRIFNZQIDLY-MRXNPFEDSA-N 1 3 346.519 2.674 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC ZINC001420217428 1376569565 /nfs/dbraw/zinc/56/95/65/1376569565.db2.gz HMGAWURPBHAJMW-RBUKOAKNSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC ZINC001420217428 1376569569 /nfs/dbraw/zinc/56/95/69/1376569569.db2.gz HMGAWURPBHAJMW-RBUKOAKNSA-N 1 3 331.504 2.527 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NCCN(C)Cc1ccc2cc[nH]c2c1 ZINC001420238661 1376598627 /nfs/dbraw/zinc/59/86/27/1376598627.db2.gz OOVCJBQIQPDUGI-IBGZPJMESA-N 1 3 342.487 2.590 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NCCN(C)Cc1ccc2cc[nH]c2c1 ZINC001420238661 1376598632 /nfs/dbraw/zinc/59/86/32/1376598632.db2.gz OOVCJBQIQPDUGI-IBGZPJMESA-N 1 3 342.487 2.590 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@]2(F)CC[N@@H+](C(C)(C)C)C2)cc1 ZINC001420295667 1376682832 /nfs/dbraw/zinc/68/28/32/1376682832.db2.gz KHUPLDLWTBWLRE-FQEVSTJZSA-N 1 3 349.494 2.756 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)cc1 ZINC001420295667 1376682834 /nfs/dbraw/zinc/68/28/34/1376682834.db2.gz KHUPLDLWTBWLRE-FQEVSTJZSA-N 1 3 349.494 2.756 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001420324329 1376734039 /nfs/dbraw/zinc/73/40/39/1376734039.db2.gz MVAADYKMPSIYMP-ILXRZTDVSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001420324329 1376734040 /nfs/dbraw/zinc/73/40/40/1376734040.db2.gz MVAADYKMPSIYMP-ILXRZTDVSA-N 1 3 337.895 2.665 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)C[NH+]1[C@@H](C)CC[C@@H]1C ZINC001420348060 1376779428 /nfs/dbraw/zinc/77/94/28/1376779428.db2.gz CGSMKEJEDMBGIG-IRXDYDNUSA-N 1 3 331.504 2.670 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(F)cc1 ZINC001420351106 1376785100 /nfs/dbraw/zinc/78/51/00/1376785100.db2.gz DINFGHDYUPKMQS-QAPCUYQASA-N 1 3 335.467 2.683 10 0 EFAEHO COc1cccc(C[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCCN2C(C)C)c1 ZINC001420352121 1376787387 /nfs/dbraw/zinc/78/73/87/1376787387.db2.gz GXBQOKLKDSIQJC-APWZRJJASA-N 1 3 347.503 2.552 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C1CCC1)[C@H]1CCc2ccccc21 ZINC001420394467 1376873382 /nfs/dbraw/zinc/87/33/82/1376873382.db2.gz RKEHLPLPNXGDST-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C1CCC1)[C@H]1CCc2ccccc21 ZINC001420394467 1376873385 /nfs/dbraw/zinc/87/33/85/1376873385.db2.gz RKEHLPLPNXGDST-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)Cc1cc2ccccc2o1 ZINC001420438105 1376973334 /nfs/dbraw/zinc/97/33/34/1376973334.db2.gz OJZBVLKVBJVOBL-INIZCTEOSA-N 1 3 343.471 2.713 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)Cc1cc2ccccc2o1 ZINC001420438105 1376973340 /nfs/dbraw/zinc/97/33/40/1376973340.db2.gz OJZBVLKVBJVOBL-INIZCTEOSA-N 1 3 343.471 2.713 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cccc2ccccc21)NC(=O)CN1CC[C@H](C)C1 ZINC001420468779 1377028638 /nfs/dbraw/zinc/02/86/38/1377028638.db2.gz KUKDQGLIQRCZMY-IRXDYDNUSA-N 1 3 339.483 2.776 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+](Cc2cc3ccccc3o2)C1 ZINC001420559564 1377197678 /nfs/dbraw/zinc/19/76/78/1377197678.db2.gz REUZDTJPTXBDDZ-MRXNPFEDSA-N 1 3 343.471 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+](Cc2cc3ccccc3o2)C1 ZINC001420559564 1377197680 /nfs/dbraw/zinc/19/76/80/1377197680.db2.gz REUZDTJPTXBDDZ-MRXNPFEDSA-N 1 3 343.471 2.711 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)CC1CC2(CCC2)C1 ZINC001420587474 1377261220 /nfs/dbraw/zinc/26/12/20/1377261220.db2.gz WYDTYBVVFVCFHT-FUHWJXTLSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001420587474 1377261224 /nfs/dbraw/zinc/26/12/24/1377261224.db2.gz WYDTYBVVFVCFHT-FUHWJXTLSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(F)c1)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001420588755 1377262626 /nfs/dbraw/zinc/26/26/26/1377262626.db2.gz DTMANXCBIZPPGU-INIZCTEOSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@H+](C)Cc1cccc(C(F)F)c1)N(C)C ZINC001420591546 1377268676 /nfs/dbraw/zinc/26/86/76/1377268676.db2.gz JIXUVWLCFFFMSW-CZUORRHYSA-N 1 3 341.446 2.901 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@@H+](C)Cc1cccc(C(F)F)c1)N(C)C ZINC001420591546 1377268679 /nfs/dbraw/zinc/26/86/79/1377268679.db2.gz JIXUVWLCFFFMSW-CZUORRHYSA-N 1 3 341.446 2.901 10 0 EFAEHO C[C@H](C[N@@H+](C)C[C@H]1CCC(F)(F)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001420616139 1377330829 /nfs/dbraw/zinc/33/08/29/1377330829.db2.gz UUOJGDLPRXESLO-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C[N@H+](C)C[C@H]1CCC(F)(F)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001420616139 1377330823 /nfs/dbraw/zinc/33/08/23/1377330823.db2.gz UUOJGDLPRXESLO-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)C[C@H](C)NC(=O)C12CC[NH+](CC1)C2 ZINC001420658595 1377437102 /nfs/dbraw/zinc/43/71/02/1377437102.db2.gz DXLKLQHJBSBYJD-HNNXBMFYSA-N 1 3 349.906 2.681 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2s1)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001420661347 1377443707 /nfs/dbraw/zinc/44/37/07/1377443707.db2.gz NYJZCXUDZHJYIO-GOEBONIOSA-N 1 3 345.512 2.790 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2s1)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001420661347 1377443708 /nfs/dbraw/zinc/44/37/08/1377443708.db2.gz NYJZCXUDZHJYIO-GOEBONIOSA-N 1 3 345.512 2.790 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C[N@H+](C)CC[C@H]1CCCC1(F)F ZINC001420661856 1377445636 /nfs/dbraw/zinc/44/56/36/1377445636.db2.gz KVAXVRMUQJRDSJ-TZMCWYRMSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC001420661856 1377445639 /nfs/dbraw/zinc/44/56/39/1377445639.db2.gz KVAXVRMUQJRDSJ-TZMCWYRMSA-N 1 3 342.434 2.523 10 0 EFAEHO CC[NH+](CC)CC[C@@H](NC(=O)CN1CC[C@H](C)C1)c1ccccc1 ZINC001420662375 1377448304 /nfs/dbraw/zinc/44/83/04/1377448304.db2.gz MWHIFLJMYYOOSP-PKOBYXMFSA-N 1 3 331.504 2.918 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)CCc1ccccc1Cl)N(C)C ZINC001420665344 1377457202 /nfs/dbraw/zinc/45/72/02/1377457202.db2.gz VEGCKHQIYNBXHX-WMLDXEAASA-N 1 3 339.911 2.659 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)CCc1ccccc1Cl)N(C)C ZINC001420665344 1377457205 /nfs/dbraw/zinc/45/72/05/1377457205.db2.gz VEGCKHQIYNBXHX-WMLDXEAASA-N 1 3 339.911 2.659 10 0 EFAEHO CC[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001438315241 1388502519 /nfs/dbraw/zinc/50/25/19/1388502519.db2.gz YJDNPKULFIAKGH-HUUCEWRRSA-N 1 3 345.478 2.781 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+](CCNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001420708973 1377546078 /nfs/dbraw/zinc/54/60/78/1377546078.db2.gz TVEAEPHWWAYLGM-UHFFFAOYSA-N 1 3 331.504 2.724 10 0 EFAEHO Cc1ccc(C)c(C[N@H+](CCNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001420708973 1377546080 /nfs/dbraw/zinc/54/60/80/1377546080.db2.gz TVEAEPHWWAYLGM-UHFFFAOYSA-N 1 3 331.504 2.724 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](CNCc2ccccc2F)C2CC2)CC[N@@H+]1C ZINC001420727132 1377573048 /nfs/dbraw/zinc/57/30/48/1377573048.db2.gz AKCMZQWZKNFKEE-QXAKKESOSA-N 1 3 347.478 2.540 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](CNCc2ccccc2F)C2CC2)CC[N@H+]1C ZINC001420727132 1377573049 /nfs/dbraw/zinc/57/30/49/1377573049.db2.gz AKCMZQWZKNFKEE-QXAKKESOSA-N 1 3 347.478 2.540 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+][C@@H]2CCc3ccccc32)C2CC2)CCC1 ZINC001420733203 1377580358 /nfs/dbraw/zinc/58/03/58/1377580358.db2.gz CXSMRFJJXBIHJA-RTBURBONSA-N 1 3 341.499 2.643 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+][C@H]2CCc3ccccc32)C2CC2)CCC1 ZINC001420733195 1377580526 /nfs/dbraw/zinc/58/05/26/1377580526.db2.gz CXSMRFJJXBIHJA-OALUTQOASA-N 1 3 341.499 2.643 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]Cc1ccccc1C)C1CC1 ZINC001420736876 1377583838 /nfs/dbraw/zinc/58/38/38/1377583838.db2.gz KRCARHOYNJSNSQ-WOJBJXKFSA-N 1 3 343.515 2.854 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C[NH2+]Cc1ccsc1)C1CC1 ZINC001420740801 1377588314 /nfs/dbraw/zinc/58/83/14/1377588314.db2.gz OOMLXLLRZSDYHT-SJORKVTESA-N 1 3 335.517 2.605 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1cc(C)sc1C)C1CC1)N(C)C ZINC001420749474 1377596530 /nfs/dbraw/zinc/59/65/30/1377596530.db2.gz KKNYDXYMBWBZAS-IAGOWNOFSA-N 1 3 337.533 2.690 10 0 EFAEHO CC[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC(C)C ZINC001438322906 1388506308 /nfs/dbraw/zinc/50/63/08/1388506308.db2.gz AMXHRHKQGDFLJO-YJBOKZPZSA-N 1 3 329.504 2.729 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC(C)C ZINC001438322898 1388506784 /nfs/dbraw/zinc/50/67/84/1388506784.db2.gz AMXHRHKQGDFLJO-MAUKXSAKSA-N 1 3 329.504 2.729 10 0 EFAEHO C[C@H]([NH2+]CCc1ccccc1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001420771733 1377635471 /nfs/dbraw/zinc/63/54/71/1377635471.db2.gz UVWIRZCXAFSKQA-SFHVURJKSA-N 1 3 343.515 2.542 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1ccc(C)cc1C)C1CC1)N(C)C ZINC001420786788 1377667556 /nfs/dbraw/zinc/66/75/56/1377667556.db2.gz PKKTYKUMPXNGOX-RBUKOAKNSA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]Cc1cc2ccccc2o1)C1CC1 ZINC001420803039 1377691257 /nfs/dbraw/zinc/69/12/57/1377691257.db2.gz XFKUSSIYTVUTOX-SFHVURJKSA-N 1 3 343.471 2.757 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CCC2(CC2)CC1 ZINC001438334948 1388514554 /nfs/dbraw/zinc/51/45/54/1388514554.db2.gz OQFYEAQHGJZBPE-AEFFLSMTSA-N 1 3 335.536 2.783 10 0 EFAEHO CCCN(C(=O)[C@@H]1CC[N@H+](C)C1)[C@@H]1CCN(Cc2cccc(C)c2)C1 ZINC001420830383 1377742110 /nfs/dbraw/zinc/74/21/10/1377742110.db2.gz VRCURNSLICTWBO-WOJBJXKFSA-N 1 3 343.515 2.760 10 0 EFAEHO CCCN(C(=O)[C@@H]1CC[N@@H+](C)C1)[C@@H]1CCN(Cc2cccc(C)c2)C1 ZINC001420830383 1377742113 /nfs/dbraw/zinc/74/21/13/1377742113.db2.gz VRCURNSLICTWBO-WOJBJXKFSA-N 1 3 343.515 2.760 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@H+](C)C1)[C@@H]1CCN(Cc2cccc(C)c2)C1 ZINC001420830379 1377742227 /nfs/dbraw/zinc/74/22/27/1377742227.db2.gz VRCURNSLICTWBO-VQTJNVASSA-N 1 3 343.515 2.760 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@@H+](C)C1)[C@@H]1CCN(Cc2cccc(C)c2)C1 ZINC001420830379 1377742229 /nfs/dbraw/zinc/74/22/29/1377742229.db2.gz VRCURNSLICTWBO-VQTJNVASSA-N 1 3 343.515 2.760 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)cs1 ZINC001420890112 1377844430 /nfs/dbraw/zinc/84/44/30/1377844430.db2.gz SVKFPSBYDMJCHS-MRXNPFEDSA-N 1 3 337.533 2.725 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)cs1 ZINC001420890112 1377844433 /nfs/dbraw/zinc/84/44/33/1377844433.db2.gz SVKFPSBYDMJCHS-MRXNPFEDSA-N 1 3 337.533 2.725 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+]1CC[C@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001420891478 1377847430 /nfs/dbraw/zinc/84/74/30/1377847430.db2.gz YMJICNYFFUPVTK-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+]1CC[C@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001420891478 1377847432 /nfs/dbraw/zinc/84/74/32/1377847432.db2.gz YMJICNYFFUPVTK-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001420940293 1377913136 /nfs/dbraw/zinc/91/31/36/1377913136.db2.gz LYVUQANAJRHKHD-LJQANCHMSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001420940293 1377913139 /nfs/dbraw/zinc/91/31/39/1377913139.db2.gz LYVUQANAJRHKHD-LJQANCHMSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](C[N@H+](C)CCCC(C)(C)C)C2)C1 ZINC001420948731 1377925772 /nfs/dbraw/zinc/92/57/72/1377925772.db2.gz RFGAVBXXURVBQH-ROUUACIJSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](C[N@@H+](C)CCCC(C)(C)C)C2)C1 ZINC001420948731 1377925777 /nfs/dbraw/zinc/92/57/77/1377925777.db2.gz RFGAVBXXURVBQH-ROUUACIJSA-N 1 3 337.552 2.935 10 0 EFAEHO Cc1ccc(CNC2(CNC(=O)CC[C@H]3CCC[N@H+]3C)CC2)cc1F ZINC001420956929 1377938604 /nfs/dbraw/zinc/93/86/04/1377938604.db2.gz YNXDMKPJDFWFCY-QGZVFWFLSA-N 1 3 347.478 2.747 10 0 EFAEHO Cc1ccc(CNC2(CNC(=O)CC[C@H]3CCC[N@@H+]3C)CC2)cc1F ZINC001420956929 1377938610 /nfs/dbraw/zinc/93/86/10/1377938610.db2.gz YNXDMKPJDFWFCY-QGZVFWFLSA-N 1 3 347.478 2.747 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C2(CNC(=O)CN3[C@@H](C)CC[C@@H]3C)CC2)c1 ZINC001421006985 1378011769 /nfs/dbraw/zinc/01/17/69/1378011769.db2.gz QWPIZWVYGSBQCC-ROUUACIJSA-N 1 3 343.515 2.915 10 0 EFAEHO CC[C@@H](F)C[N@H+](CC1CC1)C1CCN(C(=O)[C@@H](CC)N(C)C)CC1 ZINC001421018150 1378027673 /nfs/dbraw/zinc/02/76/73/1378027673.db2.gz KEVDEXJUUQSJBO-SJLPKXTDSA-N 1 3 341.515 2.778 10 0 EFAEHO CC[C@@H](F)C[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H](CC)N(C)C)CC1 ZINC001421018150 1378027676 /nfs/dbraw/zinc/02/76/76/1378027676.db2.gz KEVDEXJUUQSJBO-SJLPKXTDSA-N 1 3 341.515 2.778 10 0 EFAEHO CC[C@H](F)C[N@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001421020493 1378032124 /nfs/dbraw/zinc/03/21/24/1378032124.db2.gz SBMHLKDBISUORC-WMZOPIPTSA-N 1 3 339.499 2.532 10 0 EFAEHO CC[C@H](F)C[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001421020493 1378032126 /nfs/dbraw/zinc/03/21/26/1378032126.db2.gz SBMHLKDBISUORC-WMZOPIPTSA-N 1 3 339.499 2.532 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH+]2CC(CNC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001421184726 1378245379 /nfs/dbraw/zinc/24/53/79/1378245379.db2.gz UURNZNOPOZOTGZ-XLIONFOSSA-N 1 3 345.531 2.999 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CCCC(C)(C)C ZINC001421209728 1378280626 /nfs/dbraw/zinc/28/06/26/1378280626.db2.gz ZZZQCZOVFICJKL-BZSNNMDCSA-N 1 3 335.536 2.971 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CCCC(C)(C)C ZINC001421209728 1378280632 /nfs/dbraw/zinc/28/06/32/1378280632.db2.gz ZZZQCZOVFICJKL-BZSNNMDCSA-N 1 3 335.536 2.971 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2ccc(C)cc2C)C1)N(C)C ZINC001421250388 1378347586 /nfs/dbraw/zinc/34/75/86/1378347586.db2.gz GHIGTOHVGBQCCR-TZIWHRDSSA-N 1 3 345.531 2.972 10 0 EFAEHO C[NH+](C)CCCC(=O)NC[C@@]1(C)CCCN(Cc2ccsc2)C1 ZINC001421281772 1378418835 /nfs/dbraw/zinc/41/88/35/1378418835.db2.gz OFQVEJMALRQIMB-GOSISDBHSA-N 1 3 337.533 2.808 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@]1(C)CCCN(C/C=C/c2ccccc2)C1 ZINC001421283469 1378423949 /nfs/dbraw/zinc/42/39/49/1378423949.db2.gz JHLOODRVZLEQPM-FTUXVVSKSA-N 1 3 343.515 2.870 10 0 EFAEHO CC[C@H](C(=O)NC[C@]1(C)CCC[N@H+](CCCC(C)C)C1)N(C)C ZINC001421285461 1378429647 /nfs/dbraw/zinc/42/96/47/1378429647.db2.gz BAAARWZKIJZLFH-MJGOQNOKSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)NC[C@]1(C)CCC[N@@H+](CCCC(C)C)C1)N(C)C ZINC001421285461 1378429650 /nfs/dbraw/zinc/42/96/50/1378429650.db2.gz BAAARWZKIJZLFH-MJGOQNOKSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C(=O)NC[C@]1(C)CCC[N@H+](CCCC(C)C)C1)N(C)C ZINC001421285455 1378430185 /nfs/dbraw/zinc/43/01/85/1378430185.db2.gz BAAARWZKIJZLFH-HKUYNNGSSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C(=O)NC[C@]1(C)CCC[N@@H+](CCCC(C)C)C1)N(C)C ZINC001421285455 1378430188 /nfs/dbraw/zinc/43/01/88/1378430188.db2.gz BAAARWZKIJZLFH-HKUYNNGSSA-N 1 3 325.541 2.981 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@H+](Cc2ccccc2C)C1 ZINC001421347151 1378523871 /nfs/dbraw/zinc/52/38/71/1378523871.db2.gz BIMAGIUAUMCSIB-YLJYHZDGSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2C)C1 ZINC001421347151 1378523874 /nfs/dbraw/zinc/52/38/74/1378523874.db2.gz BIMAGIUAUMCSIB-YLJYHZDGSA-N 1 3 343.515 2.760 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](CC)N(C)C)[NH2+]Cc1ccc(Cl)cc1 ZINC001421416997 1378595014 /nfs/dbraw/zinc/59/50/14/1378595014.db2.gz FQNFVOIIOPZYSK-HZPDHXFCSA-N 1 3 325.884 2.665 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1cc(F)ccc1C ZINC001421423322 1378600543 /nfs/dbraw/zinc/60/05/43/1378600543.db2.gz PQNMWNYJUJHWET-RBUKOAKNSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1cccc(OC)c1 ZINC001421425215 1378601676 /nfs/dbraw/zinc/60/16/76/1378601676.db2.gz RMANJXUSUQUSRE-HKUYNNGSSA-N 1 3 347.503 2.552 10 0 EFAEHO CC[C@@H](CNC(=O)Cc1nc[nH]c1C)[NH2+]CC[C@H]1CCCC1(F)F ZINC001421471308 1378661411 /nfs/dbraw/zinc/66/14/11/1378661411.db2.gz ARWIRSWSDREJBF-KGLIPLIRSA-N 1 3 342.434 2.571 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C2CC[NH+](CCCF)CC2)C1 ZINC001421517252 1378731546 /nfs/dbraw/zinc/73/15/46/1378731546.db2.gz RRIDOECSUONDMY-GOSISDBHSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@H](NC/C=C\Cl)c1ccc(CNC(=O)C23CC[NH+](CC2)C3)cc1 ZINC001421657373 1378959053 /nfs/dbraw/zinc/95/90/53/1378959053.db2.gz YHHJOZPISQGDPC-TVNLJNBVSA-N 1 3 347.890 2.802 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCC1(NCc2cccc(F)c2)CCC1 ZINC001421750199 1379076092 /nfs/dbraw/zinc/07/60/92/1379076092.db2.gz DPCUBWPHGJPRKU-SFHVURJKSA-N 1 3 347.478 2.829 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCC1(NCc2cccc(F)c2)CCC1 ZINC001421750199 1379076100 /nfs/dbraw/zinc/07/61/00/1379076100.db2.gz DPCUBWPHGJPRKU-SFHVURJKSA-N 1 3 347.478 2.829 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(CNC(=O)[C@@H]2CCCN2C(C)C)CCCC1 ZINC001421835355 1379204698 /nfs/dbraw/zinc/20/46/98/1379204698.db2.gz UJYCWBINQALDAS-HOTGVXAUSA-N 1 3 327.488 2.626 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(C[NH+](CCc3cccs3)C2)CC1 ZINC001421852274 1379241021 /nfs/dbraw/zinc/24/10/21/1379241021.db2.gz PTUGOKCCBKCDET-UHFFFAOYSA-N 1 3 349.544 2.555 10 0 EFAEHO Cc1ccncc1CN(C)CCCN(C)C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001421866662 1379264533 /nfs/dbraw/zinc/26/45/33/1379264533.db2.gz LEWJVLYTWXMVHP-IBGZPJMESA-N 1 3 346.519 2.545 10 0 EFAEHO Cc1ccncc1CN(C)CCCN(C)C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001421866662 1379264538 /nfs/dbraw/zinc/26/45/38/1379264538.db2.gz LEWJVLYTWXMVHP-IBGZPJMESA-N 1 3 346.519 2.545 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001421889283 1379306466 /nfs/dbraw/zinc/30/64/66/1379306466.db2.gz MXKRANNZMVWDSG-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001421889283 1379306469 /nfs/dbraw/zinc/30/64/69/1379306469.db2.gz MXKRANNZMVWDSG-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CN(CCC[N@H+](C)CC1CCC(F)(F)CC1)C(=O)CN1CCCC1 ZINC001421902905 1379329515 /nfs/dbraw/zinc/32/95/15/1379329515.db2.gz KEULNTGXAHWEHC-UHFFFAOYSA-N 1 3 345.478 2.688 10 0 EFAEHO CN(CCC[N@@H+](C)CC1CCC(F)(F)CC1)C(=O)CN1CCCC1 ZINC001421902905 1379329521 /nfs/dbraw/zinc/32/95/21/1379329521.db2.gz KEULNTGXAHWEHC-UHFFFAOYSA-N 1 3 345.478 2.688 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)C23CCC[NH+]2CCC3)c1 ZINC001421932201 1379370297 /nfs/dbraw/zinc/37/02/97/1379370297.db2.gz SIMRKMOWOCXTHF-INIZCTEOSA-N 1 3 347.478 2.699 10 0 EFAEHO CCC1([NH2+]Cc2ccccc2F)CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001421933877 1379372708 /nfs/dbraw/zinc/37/27/08/1379372708.db2.gz PEYASZSXEWWZAE-GOSISDBHSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(C)c(F)c1 ZINC001421978955 1379433567 /nfs/dbraw/zinc/43/35/67/1379433567.db2.gz GDRBIYGPHLAWJF-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@@H](C)N(C)C(=O)CN(C)C(C)C)c(C)c1 ZINC001421984354 1379439357 /nfs/dbraw/zinc/43/93/57/1379439357.db2.gz NILIEQWNNFTGPY-GOSISDBHSA-N 1 3 333.520 2.889 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2CC[N@H+](C)C2)c(Cl)c1 ZINC001421985338 1379439392 /nfs/dbraw/zinc/43/93/92/1379439392.db2.gz IZMDQRAOVCLGON-ZBFHGGJFSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2CC[N@@H+](C)C2)c(Cl)c1 ZINC001421985338 1379439393 /nfs/dbraw/zinc/43/93/93/1379439393.db2.gz IZMDQRAOVCLGON-ZBFHGGJFSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@H]2CC[N@H+](C)C2)c(Cl)c1 ZINC001421985302 1379439652 /nfs/dbraw/zinc/43/96/52/1379439652.db2.gz IZMDQRAOVCLGON-GDBMZVCRSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@H]2CC[N@@H+](C)C2)c(Cl)c1 ZINC001421985302 1379439659 /nfs/dbraw/zinc/43/96/59/1379439659.db2.gz IZMDQRAOVCLGON-GDBMZVCRSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+]C[C@H](C)N(C)C(=O)CN(C)C(C)C ZINC001421991725 1379449362 /nfs/dbraw/zinc/44/93/62/1379449362.db2.gz XSTUHWXXVCOTID-HNNXBMFYSA-N 1 3 339.911 2.925 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@H]2CCC[C@@H]([NH+](C)C)C2)CC1 ZINC001422059742 1379556687 /nfs/dbraw/zinc/55/66/87/1379556687.db2.gz DKGXZAXFISXBMY-ZWKOTPCHSA-N 1 3 341.515 2.637 10 0 EFAEHO CCC(CC)C[NH2+][C@@H](C)[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001422069192 1379569359 /nfs/dbraw/zinc/56/93/59/1379569359.db2.gz YIFPWKLTYLXUGV-WMZOPIPTSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1CC1CC(C)(C)C1 ZINC001422125416 1379650197 /nfs/dbraw/zinc/65/01/97/1379650197.db2.gz TUYWZAOXACJKRS-WBVHZDCISA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)CC[N@H+]1CC1CC(C)(C)C1 ZINC001422125416 1379650200 /nfs/dbraw/zinc/65/02/00/1379650200.db2.gz TUYWZAOXACJKRS-WBVHZDCISA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccc(Cl)s1)C(C)C)N(C)C ZINC001422130462 1379658144 /nfs/dbraw/zinc/65/81/44/1379658144.db2.gz HBWOFVDVDFFDOR-ZIAGYGMSSA-N 1 3 345.940 2.972 10 0 EFAEHO C[C@@H](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]Cc1ccccc1 ZINC001422157961 1379699610 /nfs/dbraw/zinc/69/96/10/1379699610.db2.gz CCOIGSYVFHUAKU-JXFKEZNVSA-N 1 3 349.494 2.884 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@H+](C)CCN(C)C(=O)[C@H]2CCCN2C)c1 ZINC001422180793 1379738606 /nfs/dbraw/zinc/73/86/06/1379738606.db2.gz GANBJICPABDQMO-PKOBYXMFSA-N 1 3 331.504 2.849 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@@H+](C)CCN(C)C(=O)[C@H]2CCCN2C)c1 ZINC001422180793 1379738607 /nfs/dbraw/zinc/73/86/07/1379738607.db2.gz GANBJICPABDQMO-PKOBYXMFSA-N 1 3 331.504 2.849 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC2(C1)CCN(C(=O)CN1CCCC1)CC2 ZINC001438466156 1388627195 /nfs/dbraw/zinc/62/71/95/1388627195.db2.gz YAYGWMRDMQDRAS-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO CC(C)CCC[N@H+]1CCC2(C1)CCN(C(=O)CN1CCCC1)CC2 ZINC001438466156 1388627200 /nfs/dbraw/zinc/62/72/00/1388627200.db2.gz YAYGWMRDMQDRAS-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO CN(CCc1ccc2ccccc2c1)CCN(C)C(=O)CC[NH+](C)C ZINC001422201855 1379763143 /nfs/dbraw/zinc/76/31/43/1379763143.db2.gz UJBLPPULCFIRNT-UHFFFAOYSA-N 1 3 341.499 2.724 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@H+](C)CC1CCC(C)CC1)N(C)C ZINC001422227479 1379813198 /nfs/dbraw/zinc/81/31/98/1379813198.db2.gz OKPRTOYUIHKAAV-ABHNRTSZSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@@H+](C)CC1CCC(C)CC1)N(C)C ZINC001422227479 1379813199 /nfs/dbraw/zinc/81/31/99/1379813199.db2.gz OKPRTOYUIHKAAV-ABHNRTSZSA-N 1 3 325.541 2.789 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CC[N@H+](C)C1)Cc1cc2ccccc2s1 ZINC001422237816 1379834548 /nfs/dbraw/zinc/83/45/48/1379834548.db2.gz ONJRADXXPSBBJM-INIZCTEOSA-N 1 3 345.512 2.743 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CC[N@@H+](C)C1)Cc1cc2ccccc2s1 ZINC001422237816 1379834553 /nfs/dbraw/zinc/83/45/53/1379834553.db2.gz ONJRADXXPSBBJM-INIZCTEOSA-N 1 3 345.512 2.743 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)[C@H](C)NC(=O)CC2CC[NH+](C)CC2)c1 ZINC001422380151 1380009319 /nfs/dbraw/zinc/00/93/19/1380009319.db2.gz QLDBNJLKOSODPM-CVEARBPZSA-N 1 3 349.494 2.849 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1ccc(C)cc1Cl ZINC001422410470 1380052569 /nfs/dbraw/zinc/05/25/69/1380052569.db2.gz HITCJUJRRDKQGQ-HUUCEWRRSA-N 1 3 339.911 2.973 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1ccc(C)cc1Cl ZINC001422410466 1380052810 /nfs/dbraw/zinc/05/28/10/1380052810.db2.gz HITCJUJRRDKQGQ-GJZGRUSLSA-N 1 3 339.911 2.973 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC001422421453 1380069051 /nfs/dbraw/zinc/06/90/51/1380069051.db2.gz ALFUMFLQFSYNPA-KBXCAEBGSA-N 1 3 335.467 2.638 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001422428275 1380080643 /nfs/dbraw/zinc/08/06/43/1380080643.db2.gz UYBSVQOPMYDDHH-STQMWFEESA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1cccc2cccnc21 ZINC001422432357 1380089335 /nfs/dbraw/zinc/08/93/35/1380089335.db2.gz DJJWUHMAKJPUQY-JKSUJKDBSA-N 1 3 342.487 2.558 10 0 EFAEHO CC(C)[NH+]1CCC(NC(=O)CN2CCC[C@H](C3CCCC3)C2)CC1 ZINC001422445039 1380112105 /nfs/dbraw/zinc/11/21/05/1380112105.db2.gz KPSXEJCIKSGTRV-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001422451811 1380123779 /nfs/dbraw/zinc/12/37/79/1380123779.db2.gz NXABTKDCIORCLG-HZPDHXFCSA-N 1 3 331.504 2.887 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](C)NC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001422493637 1380196822 /nfs/dbraw/zinc/19/68/22/1380196822.db2.gz VLQFZYMYIHNQRO-RHSMWYFYSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H](C)CNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001438517619 1388651189 /nfs/dbraw/zinc/65/11/89/1388651189.db2.gz HGUKPXJWEJXTMM-CRAIPNDOSA-N 1 3 337.483 2.562 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[N@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001422550133 1380302342 /nfs/dbraw/zinc/30/23/42/1380302342.db2.gz YBRHUHXYQUOMMR-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001422550133 1380302343 /nfs/dbraw/zinc/30/23/43/1380302343.db2.gz YBRHUHXYQUOMMR-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC1c2ccccc2-c2ccccc21)NC(=O)CC[NH+](C)C ZINC001422551073 1380304004 /nfs/dbraw/zinc/30/40/04/1380304004.db2.gz JTMLDYBWIBXYGM-OAHLLOKOSA-N 1 3 337.467 2.802 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)C[NH2+]CC1CC2(CCC2)C1 ZINC001438526314 1388656586 /nfs/dbraw/zinc/65/65/86/1388656586.db2.gz CIBSDSPYMRCCNY-INIZCTEOSA-N 1 3 337.552 2.887 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@H]1C(=O)N[C@H](C)CNCc1ccccc1F ZINC001422569690 1380341115 /nfs/dbraw/zinc/34/11/15/1380341115.db2.gz FMGLDISFMVPMQI-QAPCUYQASA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@H]1C(=O)N[C@H](C)CNCc1ccccc1F ZINC001422569690 1380341117 /nfs/dbraw/zinc/34/11/17/1380341117.db2.gz FMGLDISFMVPMQI-QAPCUYQASA-N 1 3 335.467 2.683 10 0 EFAEHO C[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[N@H+](C)CCc1ccccc1 ZINC001422572059 1380345868 /nfs/dbraw/zinc/34/58/68/1380345868.db2.gz GRXSRNQDNHKBNN-MOPGFXCFSA-N 1 3 345.531 2.930 10 0 EFAEHO C[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[N@@H+](C)CCc1ccccc1 ZINC001422572059 1380345870 /nfs/dbraw/zinc/34/58/70/1380345870.db2.gz GRXSRNQDNHKBNN-MOPGFXCFSA-N 1 3 345.531 2.930 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@@H](C)[N@H+](C)Cc1ccc(F)cc1C ZINC001422595958 1380395097 /nfs/dbraw/zinc/39/50/97/1380395097.db2.gz DNYZJJFKQYEWQB-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc(F)cc1C ZINC001422595958 1380395100 /nfs/dbraw/zinc/39/51/00/1380395100.db2.gz DNYZJJFKQYEWQB-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)N(C)C/C=C\c1ccc(Cl)cc1 ZINC001422603847 1380407399 /nfs/dbraw/zinc/40/73/99/1380407399.db2.gz QLTSWIAYCKLWMI-XQJUWPJRSA-N 1 3 349.906 2.741 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)N(C)C/C=C\c1ccc(Cl)cc1 ZINC001422603847 1380407401 /nfs/dbraw/zinc/40/74/01/1380407401.db2.gz QLTSWIAYCKLWMI-XQJUWPJRSA-N 1 3 349.906 2.741 10 0 EFAEHO C[C@H](C[NH2+]CC1CC(C)(C)C1)NC(=O)c1cccc(CN(C)C)c1 ZINC001422604119 1380407403 /nfs/dbraw/zinc/40/74/03/1380407403.db2.gz MMAJBJSOLVFOEY-OAHLLOKOSA-N 1 3 331.504 2.892 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CC1CCC2(CC2)CC1 ZINC001422645517 1380478286 /nfs/dbraw/zinc/47/82/86/1380478286.db2.gz HITKVVFZRCNXTC-WMZOPIPTSA-N 1 3 335.536 2.924 10 0 EFAEHO COc1ccc(CN2CCCCC[C@@H]2CNC(=O)CC[NH+](C)C)cc1 ZINC001422700723 1380632001 /nfs/dbraw/zinc/63/20/01/1380632001.db2.gz LRWHNDHSKXTWRX-GOSISDBHSA-N 1 3 347.503 2.508 10 0 EFAEHO CC(C)CCC[NH+]1CC([C@@H](C)NC(=O)CN(C)CC(C)(C)C)C1 ZINC001422756260 1380763441 /nfs/dbraw/zinc/76/34/41/1380763441.db2.gz WAMUJJUOZYGXMA-MRXNPFEDSA-N 1 3 325.541 2.837 10 0 EFAEHO Cc1cc(C)cc(CN2CC([C@H](C)NC(=O)C[C@H]3CC[N@H+](C)C3)C2)c1 ZINC001422755505 1380763716 /nfs/dbraw/zinc/76/37/16/1380763716.db2.gz SCLSOCORUJZNMT-ZWKOTPCHSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1cc(C)cc(CN2CC([C@H](C)NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)c1 ZINC001422755505 1380763721 /nfs/dbraw/zinc/76/37/21/1380763721.db2.gz SCLSOCORUJZNMT-ZWKOTPCHSA-N 1 3 343.515 2.582 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1C[NH+](CC[C@H]2CCCC2(F)F)C1 ZINC001422760831 1380768794 /nfs/dbraw/zinc/76/87/94/1380768794.db2.gz JVLXNIGTOLSJPP-GOEBONIOSA-N 1 3 345.478 2.589 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)C[C@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001422835726 1380890222 /nfs/dbraw/zinc/89/02/22/1380890222.db2.gz PCMLPIRXNCLLGK-JKSUJKDBSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)C[C@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001422835726 1380890227 /nfs/dbraw/zinc/89/02/27/1380890227.db2.gz PCMLPIRXNCLLGK-JKSUJKDBSA-N 1 3 347.503 2.677 10 0 EFAEHO C[C@@H](C[N@H+](C)Cc1ccccc1C1CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001422876779 1380985637 /nfs/dbraw/zinc/98/56/37/1380985637.db2.gz MNPOLEZTJHKSAO-IRXDYDNUSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](C[N@@H+](C)Cc1ccccc1C1CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001422876779 1380985641 /nfs/dbraw/zinc/98/56/41/1380985641.db2.gz MNPOLEZTJHKSAO-IRXDYDNUSA-N 1 3 343.515 2.842 10 0 EFAEHO CCc1ccc(C[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001422880307 1380993306 /nfs/dbraw/zinc/99/33/06/1380993306.db2.gz SKWPCKLICSVTQC-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(C[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001422880307 1380993310 /nfs/dbraw/zinc/99/33/10/1380993310.db2.gz SKWPCKLICSVTQC-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccccc2Cl)C1)C1CCC1 ZINC001422893617 1381016535 /nfs/dbraw/zinc/01/65/35/1381016535.db2.gz IOAGDXPKFSHHRF-KOMQPUFPSA-N 1 3 349.906 2.809 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2c(C)cc(C)cc2C)C1 ZINC001422906419 1381033774 /nfs/dbraw/zinc/03/37/74/1381033774.db2.gz HQUCYEBSEDNBCC-WGSAOQKQSA-N 1 3 345.531 2.938 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccccc2F)C1)N(C)C ZINC001422909860 1381038127 /nfs/dbraw/zinc/03/81/27/1381038127.db2.gz SFXQUAACYCJUEO-YRBFXIGRSA-N 1 3 335.467 2.711 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001422912718 1381041643 /nfs/dbraw/zinc/04/16/43/1381041643.db2.gz WLIXFMKDRVNHFT-HUUCEWRRSA-N 1 3 333.467 2.590 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001422912718 1381041650 /nfs/dbraw/zinc/04/16/50/1381041650.db2.gz WLIXFMKDRVNHFT-HUUCEWRRSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H]2CCc3ccc(F)cc32)C1)N(C)C ZINC001422912377 1381041744 /nfs/dbraw/zinc/04/17/44/1381041744.db2.gz NTCDYNYEBMLCPU-ZQNRLITLSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]CC2CCC3(CC3)CC2)C1)N(C)C ZINC001422912507 1381042055 /nfs/dbraw/zinc/04/20/55/1381042055.db2.gz WXURBSKAACVSNY-BZSNNMDCSA-N 1 3 335.536 2.781 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)CCCc1ccccc1 ZINC001422913737 1381045486 /nfs/dbraw/zinc/04/54/86/1381045486.db2.gz CFXWNZQHBCZPRL-AZUAARDMSA-N 1 3 345.531 2.930 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCCc1ccccc1 ZINC001422913737 1381045493 /nfs/dbraw/zinc/04/54/93/1381045493.db2.gz CFXWNZQHBCZPRL-AZUAARDMSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)CC[C@@H]1CCc2ccccc21 ZINC001422915248 1381048844 /nfs/dbraw/zinc/04/88/44/1381048844.db2.gz GGDNPVYLWGNGEB-MJGOQNOKSA-N 1 3 345.531 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)CC[C@@H]1CCc2ccccc21 ZINC001422915248 1381048852 /nfs/dbraw/zinc/04/88/52/1381048852.db2.gz GGDNPVYLWGNGEB-MJGOQNOKSA-N 1 3 345.531 2.883 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@H+](C)CCc1ccc(C)cc1 ZINC001422917982 1381052779 /nfs/dbraw/zinc/05/27/79/1381052779.db2.gz NFLWYAJWHCUGLB-QUCCMNQESA-N 1 3 345.531 2.848 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@@H+](C)CCc1ccc(C)cc1 ZINC001422917982 1381052782 /nfs/dbraw/zinc/05/27/82/1381052782.db2.gz NFLWYAJWHCUGLB-QUCCMNQESA-N 1 3 345.531 2.848 10 0 EFAEHO CN(C/C=C\Cl)C1CCN(C(=O)[C@@H]2CCC[C@@H]([NH+](C)C)C2)CC1 ZINC001422932810 1381084963 /nfs/dbraw/zinc/08/49/63/1381084963.db2.gz NBXQSNFWAWGVMH-YCDQCDSPSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(C[NH+](CCC3CCCC3)C2)CC1 ZINC001438620460 1388703700 /nfs/dbraw/zinc/70/37/00/1388703700.db2.gz GCXCMLAUQXDEPB-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccsc2)[C@H](CC)C1 ZINC001423067795 1381296783 /nfs/dbraw/zinc/29/67/83/1381296783.db2.gz RGCQZAKSGVQUSV-SJORKVTESA-N 1 3 337.533 2.807 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@@H](C)[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001423070463 1381300679 /nfs/dbraw/zinc/30/06/79/1381300679.db2.gz FQDFUEOBILSTJC-UKRRQHHQSA-N 1 3 333.467 2.589 10 0 EFAEHO CC[C@@H](F)CN[C@@H](C)CN(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001423083402 1381319570 /nfs/dbraw/zinc/31/95/70/1381319570.db2.gz NCEJSLSNALGCCQ-LSDHHAIUSA-N 1 3 329.504 2.824 10 0 EFAEHO CC[C@@H](F)CN[C@@H](C)CN(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001423083402 1381319577 /nfs/dbraw/zinc/31/95/77/1381319577.db2.gz NCEJSLSNALGCCQ-LSDHHAIUSA-N 1 3 329.504 2.824 10 0 EFAEHO C[C@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001423084039 1381320213 /nfs/dbraw/zinc/32/02/13/1381320213.db2.gz VEOFTDYDPONEAS-QAPCUYQASA-N 1 3 329.488 2.595 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC[C@@H]1CCN1[C@@H]1CCc2ccccc21 ZINC001423150559 1381446186 /nfs/dbraw/zinc/44/61/86/1381446186.db2.gz GWHKJKLESKLWBW-PKOBYXMFSA-N 1 3 329.488 2.596 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC[C@@H]1CCN1[C@@H]1CCc2ccccc21 ZINC001423150559 1381446193 /nfs/dbraw/zinc/44/61/93/1381446193.db2.gz GWHKJKLESKLWBW-PKOBYXMFSA-N 1 3 329.488 2.596 10 0 EFAEHO Cc1cc(C)c(CN2CC[C@@H]2CNC(=O)C[C@@H]2CC[N@@H+](C)C2)c(C)c1 ZINC001423161784 1381475005 /nfs/dbraw/zinc/47/50/05/1381475005.db2.gz BAJUVQVOLNVRSU-RBUKOAKNSA-N 1 3 343.515 2.644 10 0 EFAEHO Cc1cc(C)c(CN2CC[C@@H]2CNC(=O)C[C@@H]2CC[N@H+](C)C2)c(C)c1 ZINC001423161784 1381475032 /nfs/dbraw/zinc/47/50/32/1381475032.db2.gz BAJUVQVOLNVRSU-RBUKOAKNSA-N 1 3 343.515 2.644 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@@H](C)NC/C=C\Cl)[NH+]1CCCCC1 ZINC001423171409 1381499556 /nfs/dbraw/zinc/49/95/56/1381499556.db2.gz MJSGXUBNXYKEST-NKIGNDQYSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001423173689 1381505099 /nfs/dbraw/zinc/50/50/99/1381505099.db2.gz QGQDWAOKWRYNLW-CABCVRRESA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001438670894 1388728773 /nfs/dbraw/zinc/72/87/73/1388728773.db2.gz TUEQRMACIVZZMX-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001438670894 1388728777 /nfs/dbraw/zinc/72/87/77/1388728777.db2.gz TUEQRMACIVZZMX-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@@H]3CC[C@@H]4CCCC[N@@H+]43)CC2)cs1 ZINC001423243919 1381665323 /nfs/dbraw/zinc/66/53/23/1381665323.db2.gz KKCLQFNFWXBWKK-IRXDYDNUSA-N 1 3 347.528 2.812 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@@H]3CC[C@@H]4CCCC[N@H+]43)CC2)cs1 ZINC001423243919 1381665339 /nfs/dbraw/zinc/66/53/39/1381665339.db2.gz KKCLQFNFWXBWKK-IRXDYDNUSA-N 1 3 347.528 2.812 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H]3CC[C@H]4CCCC[N@@H+]43)CC2)cs1 ZINC001423243906 1381669761 /nfs/dbraw/zinc/66/97/61/1381669761.db2.gz KKCLQFNFWXBWKK-IAGOWNOFSA-N 1 3 347.528 2.812 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H]3CC[C@H]4CCCC[N@H+]43)CC2)cs1 ZINC001423243906 1381669772 /nfs/dbraw/zinc/66/97/72/1381669772.db2.gz KKCLQFNFWXBWKK-IAGOWNOFSA-N 1 3 347.528 2.812 10 0 EFAEHO Cc1ccc(F)cc1CNC1(CNC(=O)CC[C@H]2CCC[N@H+]2C)CC1 ZINC001423246963 1381677625 /nfs/dbraw/zinc/67/76/25/1381677625.db2.gz ZZFWWPFVOZIDLK-GOSISDBHSA-N 1 3 347.478 2.747 10 0 EFAEHO Cc1ccc(F)cc1CNC1(CNC(=O)CC[C@H]2CCC[N@@H+]2C)CC1 ZINC001423246963 1381677639 /nfs/dbraw/zinc/67/76/39/1381677639.db2.gz ZZFWWPFVOZIDLK-GOSISDBHSA-N 1 3 347.478 2.747 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H]2C)c(C)c1 ZINC001423319967 1381779329 /nfs/dbraw/zinc/77/93/29/1381779329.db2.gz BEMWCDKJZLOEOX-IEBWSBKVSA-N 1 3 331.504 2.723 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(CF)cc2)[C@@H]1C ZINC001423333413 1381797396 /nfs/dbraw/zinc/79/73/96/1381797396.db2.gz XIPQROBFJSRADU-MAUKXSAKSA-N 1 3 335.467 2.575 10 0 EFAEHO CC[C@H](C(=O)N[C@@]12CCC[C@H]1[N@H+](CCCF)CC2)N(CC)CC ZINC001423344227 1381815184 /nfs/dbraw/zinc/81/51/84/1381815184.db2.gz DTNUISUCFXYOJJ-JFIYKMOQSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H](C(=O)N[C@@]12CCC[C@H]1[N@@H+](CCCF)CC2)N(CC)CC ZINC001423344227 1381815191 /nfs/dbraw/zinc/81/51/91/1381815191.db2.gz DTNUISUCFXYOJJ-JFIYKMOQSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](F)CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)C1(N(C)C)CCC1 ZINC001423351402 1381827826 /nfs/dbraw/zinc/82/78/26/1381827826.db2.gz XCFVURWQWLFHOQ-XYTVBORESA-N 1 3 339.499 2.721 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)C1(N(C)C)CCC1 ZINC001423351399 1381828440 /nfs/dbraw/zinc/82/84/40/1381828440.db2.gz XCFVURWQWLFHOQ-MGNMYUMUSA-N 1 3 339.499 2.721 10 0 EFAEHO C[C@@H](NC[C@@H](C)N(C)C(=O)CC[NH+](C)C)c1ccccc1Cl ZINC001438696629 1388745601 /nfs/dbraw/zinc/74/56/01/1388745601.db2.gz VZTRGKMTLBZONL-ZIAGYGMSSA-N 1 3 325.884 2.789 10 0 EFAEHO C[C@H]1[C@@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc2c(c1)CCC2 ZINC001423368906 1381860049 /nfs/dbraw/zinc/86/00/49/1381860049.db2.gz GXZWLKYZVXHQAG-JXFKEZNVSA-N 1 3 343.515 2.596 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)c1 ZINC001423401457 1381908368 /nfs/dbraw/zinc/90/83/68/1381908368.db2.gz JODAHZIDONPTPY-IBGZPJMESA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001423424367 1381934435 /nfs/dbraw/zinc/93/44/35/1381934435.db2.gz VPLCPVKZDSXEGH-FUHWJXTLSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(F)cc2)C[C@H]1C ZINC001423447735 1381952299 /nfs/dbraw/zinc/95/22/99/1381952299.db2.gz FXSKZUZYVIQHFB-CRAIPNDOSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(F)cc2)C[C@@H]1C ZINC001423447741 1381952653 /nfs/dbraw/zinc/95/26/53/1381952653.db2.gz FXSKZUZYVIQHFB-YJBOKZPZSA-N 1 3 335.467 2.635 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]1CNCc1cccc(Cl)c1F ZINC001423481584 1381975013 /nfs/dbraw/zinc/97/50/13/1381975013.db2.gz XOTKIRARGHJJNB-AWEZNQCLSA-N 1 3 341.858 2.511 10 0 EFAEHO CC[N@@H+]1CCCC[C@H]1C(=O)N(C)[C@@H](C)CNCc1cc(C)ccc1F ZINC001438717189 1388759842 /nfs/dbraw/zinc/75/98/42/1388759842.db2.gz VKBOOTIIQGRXHX-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[N@H+]1CCCC[C@H]1C(=O)N(C)[C@@H](C)CNCc1cc(C)ccc1F ZINC001438717189 1388759844 /nfs/dbraw/zinc/75/98/44/1388759844.db2.gz VKBOOTIIQGRXHX-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C(=O)CN1CCCC1 ZINC001438723213 1388764783 /nfs/dbraw/zinc/76/47/83/1388764783.db2.gz QBHANXXESOJXHT-KRWDZBQOSA-N 1 3 343.515 2.986 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@]1(C)CC[N@H+](Cc2ccccc2C)C1 ZINC001423590197 1382127469 /nfs/dbraw/zinc/12/74/69/1382127469.db2.gz ZDNMSUDUPQYWGG-UYAOXDASSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@]1(C)CC[N@@H+](Cc2ccccc2C)C1 ZINC001423590197 1382127474 /nfs/dbraw/zinc/12/74/74/1382127474.db2.gz ZDNMSUDUPQYWGG-UYAOXDASSA-N 1 3 349.494 2.756 10 0 EFAEHO CC(C)C[NH2+]C[C@@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)(C)C ZINC001423601083 1382146471 /nfs/dbraw/zinc/14/64/71/1382146471.db2.gz CPLCLZJJLGKHDD-BEFAXECRSA-N 1 3 343.531 2.975 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]CC3CC4(CCC4)C3)C2)C1 ZINC001423624658 1382186011 /nfs/dbraw/zinc/18/60/11/1382186011.db2.gz CNFZDDRZVIOZBQ-XLIONFOSSA-N 1 3 347.547 2.737 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@](C)(C[NH2+]Cc2ccccc2Cl)C1 ZINC001423627245 1382190407 /nfs/dbraw/zinc/19/04/07/1382190407.db2.gz GGTWBYYYBCWTLB-PKOBYXMFSA-N 1 3 349.906 2.762 10 0 EFAEHO CC[C@H](C(=O)NC1(C2CC[NH+](CC3CCCC3)CC2)CC1)N(C)C ZINC001423695663 1382307128 /nfs/dbraw/zinc/30/71/28/1382307128.db2.gz XJOTZQFIOROXOO-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C2CC[NH+](CC3CC(C)C3)CC2)CC1 ZINC001423707874 1382330667 /nfs/dbraw/zinc/33/06/67/1382330667.db2.gz QIZYOCWMICNIHC-UHFFFAOYSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1cccnc1)C1CCCCC1)N(C)C ZINC001438747377 1388783357 /nfs/dbraw/zinc/78/33/57/1388783357.db2.gz NMUUOSQARYMQOI-RBUKOAKNSA-N 1 3 346.519 2.577 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H](CNCc1ccccc1F)C1CCCCC1 ZINC001438748717 1388784943 /nfs/dbraw/zinc/78/49/43/1388784943.db2.gz RJZHTEJMJYRWAY-LJQANCHMSA-N 1 3 349.494 2.932 10 0 EFAEHO CCc1ccccc1[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)[NH2+]C(C)C ZINC001423923755 1382505430 /nfs/dbraw/zinc/50/54/30/1382505430.db2.gz GSCKEPRRSCVQGI-MOPGFXCFSA-N 1 3 333.520 2.991 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCc1ccccc1)C2 ZINC001423932962 1382516118 /nfs/dbraw/zinc/51/61/18/1382516118.db2.gz RKXWVZMIBLWOGU-ZCNNSNEGSA-N 1 3 343.515 2.538 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCc1ccccc1)C2 ZINC001423932962 1382516123 /nfs/dbraw/zinc/51/61/23/1382516123.db2.gz RKXWVZMIBLWOGU-ZCNNSNEGSA-N 1 3 343.515 2.538 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+]([C@H](C)c3ccc(F)cc3)C[C@@H]2C1 ZINC001423994660 1382606392 /nfs/dbraw/zinc/60/63/92/1382606392.db2.gz ALLLHVHVPIEVOZ-NXHRZFHOSA-N 1 3 347.478 2.617 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+]([C@H](C)c3ccc(F)cc3)C[C@@H]2C1 ZINC001423994660 1382606394 /nfs/dbraw/zinc/60/63/94/1382606394.db2.gz ALLLHVHVPIEVOZ-NXHRZFHOSA-N 1 3 347.478 2.617 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](CCCC1CCC1)CC2 ZINC001424111187 1382766841 /nfs/dbraw/zinc/76/68/41/1382766841.db2.gz KICKFERUXQSMDO-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO Cc1ccccc1C[NH2+]C1(CNC(=O)C(C)(C)N2CCCC2)CCC1 ZINC001424199929 1382856058 /nfs/dbraw/zinc/85/60/58/1382856058.db2.gz ZQCJEPSMJNBJTD-UHFFFAOYSA-N 1 3 343.515 2.998 10 0 EFAEHO CN(CCC[N@H+](C)[C@H]1CCc2ccccc21)C(=O)[C@@H]1CCCN1C ZINC001424272573 1382915266 /nfs/dbraw/zinc/91/52/66/1382915266.db2.gz GVHHXHJPLMUQOI-OALUTQOASA-N 1 3 329.488 2.548 10 0 EFAEHO CN(CCC[N@@H+](C)[C@H]1CCc2ccccc21)C(=O)[C@@H]1CCCN1C ZINC001424272573 1382915271 /nfs/dbraw/zinc/91/52/71/1382915271.db2.gz GVHHXHJPLMUQOI-OALUTQOASA-N 1 3 329.488 2.548 10 0 EFAEHO CC(C)N1Cc2ccc(CNC(=O)C[NH+]3[C@H](C)CC[C@H]3C)cc2C1 ZINC001424440746 1383020863 /nfs/dbraw/zinc/02/08/63/1383020863.db2.gz XUBRRAVFCIZFRG-HZPDHXFCSA-N 1 3 329.488 2.900 10 0 EFAEHO CC(C)N1Cc2ccc(CNC(=O)C[NH+]3[C@@H](C)CC[C@@H]3C)cc2C1 ZINC001424440745 1383021405 /nfs/dbraw/zinc/02/14/05/1383021405.db2.gz XUBRRAVFCIZFRG-HOTGVXAUSA-N 1 3 329.488 2.900 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCC1 ZINC001438825967 1388842695 /nfs/dbraw/zinc/84/26/95/1388842695.db2.gz GTCMGRMXHBIMCB-APWZRJJASA-N 1 3 341.515 2.729 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)c(C)c1 ZINC001438825067 1388842914 /nfs/dbraw/zinc/84/29/14/1388842914.db2.gz COZYNPGYBQHCDX-XLIONFOSSA-N 1 3 345.531 2.876 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)c(C)c1 ZINC001438825058 1388843026 /nfs/dbraw/zinc/84/30/26/1388843026.db2.gz COZYNPGYBQHCDX-PXNSSMCTSA-N 1 3 345.531 2.876 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CC1CC(NC(=O)C2(N(C)C)CCC2)C1 ZINC001424727038 1383299530 /nfs/dbraw/zinc/29/95/30/1383299530.db2.gz PNKDHWVVYBHTFY-UHFFFAOYSA-N 1 3 347.478 2.603 10 0 EFAEHO CCc1ccc(C[NH2+]CC2CC(NC(=O)C3(N(C)C)CCC3)C2)cc1 ZINC001424728878 1383301417 /nfs/dbraw/zinc/30/14/17/1383301417.db2.gz YVWPRZVNDLLZCW-UHFFFAOYSA-N 1 3 343.515 2.718 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC1CC(NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001424757728 1383324085 /nfs/dbraw/zinc/32/40/85/1383324085.db2.gz XBDHKYJMXLJZLT-QLOJAFMTSA-N 1 3 345.531 2.874 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@H]2CCc3ccc(F)cc32)C1 ZINC001424758270 1383325219 /nfs/dbraw/zinc/32/52/19/1383325219.db2.gz ZLQTZJBIBCQXEP-YVNUBYTISA-N 1 3 347.478 2.639 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]Cc1ccsc1 ZINC001438829780 1388846837 /nfs/dbraw/zinc/84/68/37/1388846837.db2.gz QEMBZABDPJPPCM-INIZCTEOSA-N 1 3 339.549 2.956 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001424796311 1383353900 /nfs/dbraw/zinc/35/39/00/1383353900.db2.gz LCYKSWDIZRMZDB-DLBZAZTESA-N 1 3 331.504 2.505 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001424805550 1383365483 /nfs/dbraw/zinc/36/54/83/1383365483.db2.gz ULIKMHNDVZVWSN-CABCVRRESA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001424805557 1383365776 /nfs/dbraw/zinc/36/57/76/1383365776.db2.gz ULIKMHNDVZVWSN-HUUCEWRRSA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)cs1 ZINC001424820219 1383379521 /nfs/dbraw/zinc/37/95/21/1383379521.db2.gz NFMPVRUDPHIZOI-CABCVRRESA-N 1 3 337.533 2.914 10 0 EFAEHO C[C@@H](NCc1cc(Cl)ccc1F)[C@@H](C)NC(=O)CCC[NH+](C)C ZINC001424823416 1383383104 /nfs/dbraw/zinc/38/31/04/1383383104.db2.gz MFQVKGNDFKNNDI-CHWSQXEVSA-N 1 3 343.874 2.804 10 0 EFAEHO C[C@@H](NCc1sccc1Cl)[C@@H](C)NC(=O)C1(C[NH+](C)C)CC1 ZINC001424838363 1383398774 /nfs/dbraw/zinc/39/87/74/1383398774.db2.gz YDOUNYKMNUOUOR-VXGBXAGGSA-N 1 3 343.924 2.726 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001424850799 1383415733 /nfs/dbraw/zinc/41/57/33/1383415733.db2.gz RKSWLMVPSISPJX-NEPJUHHUSA-N 1 3 331.913 2.726 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C)C1)C1C[NH+](CC2CCC(C)(C)CC2)C1 ZINC001425246783 1383562428 /nfs/dbraw/zinc/56/24/28/1383562428.db2.gz OGRJBEKLIRYECE-SJORKVTESA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1C[NH+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC001425262186 1383578379 /nfs/dbraw/zinc/57/83/79/1383578379.db2.gz GOEKZXHJMUOVEZ-LSDHHAIUSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C1C[NH+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001425268307 1383583126 /nfs/dbraw/zinc/58/31/26/1383583126.db2.gz MNFGRQWGVLAJTA-APWZRJJASA-N 1 3 349.563 2.980 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2[C@H]3C[N@@H+](CCCC4CCCC4)C[C@H]32)CCC1 ZINC001425317399 1383605006 /nfs/dbraw/zinc/60/50/06/1383605006.db2.gz BQLQYEZXOFRWGD-LDLYASANSA-N 1 3 347.547 2.735 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2[C@H]3C[N@H+](CCCC4CCCC4)C[C@H]32)CCC1 ZINC001425317399 1383605011 /nfs/dbraw/zinc/60/50/11/1383605011.db2.gz BQLQYEZXOFRWGD-LDLYASANSA-N 1 3 347.547 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001425378296 1383637566 /nfs/dbraw/zinc/63/75/66/1383637566.db2.gz FANBCOKJFADUMH-VAMGGRTRSA-N 1 3 343.515 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001425378296 1383637570 /nfs/dbraw/zinc/63/75/70/1383637570.db2.gz FANBCOKJFADUMH-VAMGGRTRSA-N 1 3 343.515 2.744 10 0 EFAEHO Cc1cc(C[N@H+]2CCCC3(CN(C(=O)CN(C)C(C)C)C3)C2)cs1 ZINC001425384194 1383643632 /nfs/dbraw/zinc/64/36/32/1383643632.db2.gz NSNNPWWNWUIWPH-UHFFFAOYSA-N 1 3 349.544 2.821 10 0 EFAEHO Cc1cc(C[N@@H+]2CCCC3(CN(C(=O)CN(C)C(C)C)C3)C2)cs1 ZINC001425384194 1383643637 /nfs/dbraw/zinc/64/36/37/1383643637.db2.gz NSNNPWWNWUIWPH-UHFFFAOYSA-N 1 3 349.544 2.821 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H]2C[C@H](NC(=O)C3(N(C)C)CCC3)C2)c(C)s1 ZINC001425391174 1383646015 /nfs/dbraw/zinc/64/60/15/1383646015.db2.gz FPGFVMZURQABRV-JCNLHEQBSA-N 1 3 349.544 2.834 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001425426202 1383656583 /nfs/dbraw/zinc/65/65/83/1383656583.db2.gz WIRRTGWEZWTYJY-FHWLQOOXSA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+][C@@H]1CCCc2ccccc21 ZINC001425689120 1383766937 /nfs/dbraw/zinc/76/69/37/1383766937.db2.gz BJUSHDXUKDWFGD-QFBILLFUSA-N 1 3 331.504 2.841 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CCC(C)(C)C)CN1C(=O)CN(C)CC(C)(C)C ZINC001425903504 1383839663 /nfs/dbraw/zinc/83/96/63/1383839663.db2.gz MSUSGBHUPNJTBF-HOTGVXAUSA-N 1 3 325.541 2.980 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@@]23CCC[C@@H]2N(Cc2ccsc2)CC3)CC1 ZINC001425904491 1383842788 /nfs/dbraw/zinc/84/27/88/1383842788.db2.gz JPOSXGCKVCTXSZ-QFBILLFUSA-N 1 3 347.528 2.703 10 0 EFAEHO CN(CC[N@H+](C)[C@@H]1CCc2ccccc21)C(=O)CN(C)C1CCC1 ZINC001438880785 1388887558 /nfs/dbraw/zinc/88/75/58/1388887558.db2.gz BFWHKQULINKSMO-LJQANCHMSA-N 1 3 329.488 2.548 10 0 EFAEHO CN(CC[N@@H+](C)[C@@H]1CCc2ccccc21)C(=O)CN(C)C1CCC1 ZINC001438880785 1388887565 /nfs/dbraw/zinc/88/75/65/1388887565.db2.gz BFWHKQULINKSMO-LJQANCHMSA-N 1 3 329.488 2.548 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCN(C(=O)[C@@H]2CC[N@H+](C)C2)C(C)C)c1 ZINC001426131132 1384013110 /nfs/dbraw/zinc/01/31/10/1384013110.db2.gz YCQKRYCTAQMKEA-LJQANCHMSA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCN(C(=O)[C@@H]2CC[N@@H+](C)C2)C(C)C)c1 ZINC001426131132 1384013114 /nfs/dbraw/zinc/01/31/14/1384013114.db2.gz YCQKRYCTAQMKEA-LJQANCHMSA-N 1 3 345.531 2.924 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)C1CC(NCc2cc(F)ccc2Cl)C1 ZINC001426221132 1384080819 /nfs/dbraw/zinc/08/08/19/1384080819.db2.gz ZVTMDBJZABYLLK-UHFFFAOYSA-N 1 3 341.858 2.510 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccccc1)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001426222743 1384081501 /nfs/dbraw/zinc/08/15/01/1384081501.db2.gz YCWXQHAMGCFWLJ-LJQANCHMSA-N 1 3 331.504 2.697 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccccc1)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001426222743 1384081504 /nfs/dbraw/zinc/08/15/04/1384081504.db2.gz YCWXQHAMGCFWLJ-LJQANCHMSA-N 1 3 331.504 2.697 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)Cc1ccccc1C1CC1 ZINC001438939235 1388939354 /nfs/dbraw/zinc/93/93/54/1388939354.db2.gz SPYHUPJCSWRZDK-UHFFFAOYSA-N 1 3 331.504 2.794 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)Cc1ccccc1C1CC1 ZINC001438939235 1388939359 /nfs/dbraw/zinc/93/93/59/1388939359.db2.gz SPYHUPJCSWRZDK-UHFFFAOYSA-N 1 3 331.504 2.794 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(Cl)cc2)C1 ZINC001438947199 1388944653 /nfs/dbraw/zinc/94/46/53/1388944653.db2.gz HHKZZFQXPHVQAK-AEFFLSMTSA-N 1 3 349.906 2.715 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H]2CCC[C@@H]2NC(=O)CN(C)C(C)C)c1 ZINC001438966167 1388955822 /nfs/dbraw/zinc/95/58/22/1388955822.db2.gz REQAAPPGECDLSM-LPHOPBHVSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+][C@@H]1CCCc2ccccc21 ZINC001439071811 1388978343 /nfs/dbraw/zinc/97/83/43/1388978343.db2.gz KXOSRDFFVOWCNQ-VQIMIIECSA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+][C@H](C)c1cc(F)ccc1F ZINC001439079297 1388983389 /nfs/dbraw/zinc/98/33/89/1388983389.db2.gz WORDIXKGNSBKQW-ZIAGYGMSSA-N 1 3 341.446 2.850 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@H]1CN(CCc2ccccc2F)CC1(C)C ZINC001506749960 1406249879 /nfs/dbraw/zinc/24/98/79/1406249879.db2.gz WEBIJSVYOQKCHS-GOSISDBHSA-N 1 3 349.494 2.537 10 0 EFAEHO CC(C)CC[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001506785119 1406280660 /nfs/dbraw/zinc/28/06/60/1406280660.db2.gz LMWFKMVBEMSNAF-NNZMDNLPSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)CC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001506785119 1406280665 /nfs/dbraw/zinc/28/06/65/1406280665.db2.gz LMWFKMVBEMSNAF-NNZMDNLPSA-N 1 3 335.536 2.591 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N3CCN(C)C4(CCCCC4)C3)C[N@@H+]2C1 ZINC001434006511 1387053451 /nfs/dbraw/zinc/05/34/51/1387053451.db2.gz JLZNPMTYIPWUAZ-SQNIBIBYSA-N 1 3 333.520 2.584 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N3CCN(C)C4(CCCCC4)C3)C[N@H+]2C1 ZINC001434006511 1387053459 /nfs/dbraw/zinc/05/34/59/1387053459.db2.gz JLZNPMTYIPWUAZ-SQNIBIBYSA-N 1 3 333.520 2.584 10 0 EFAEHO C[C@H](C[NH2+][C@@H]1CCc2ccc(Cl)cc21)NC(=O)C1(N(C)C)CCC1 ZINC001439120410 1389001273 /nfs/dbraw/zinc/00/12/73/1389001273.db2.gz PLLQMKLKYZHYLH-CXAGYDPISA-N 1 3 349.906 2.906 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1cccc(Cl)c1 ZINC001439183207 1389036511 /nfs/dbraw/zinc/03/65/11/1389036511.db2.gz ZRRMGORDLHNKJS-PBHICJAKSA-N 1 3 337.895 2.809 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC001439256771 1389077004 /nfs/dbraw/zinc/07/70/04/1389077004.db2.gz VYYINUXHFCLAKP-JXFKEZNVSA-N 1 3 349.494 2.802 10 0 EFAEHO C[C@@H](C[N@H+](C)CC[C@H]1CCCC1(F)F)NC(=O)CN(C)C1CCC1 ZINC001439331351 1389149241 /nfs/dbraw/zinc/14/92/41/1389149241.db2.gz LOEZARFGJAYSSN-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC[C@H]1CCCC1(F)F)NC(=O)CN(C)C1CCC1 ZINC001439331351 1389149250 /nfs/dbraw/zinc/14/92/50/1389149250.db2.gz LOEZARFGJAYSSN-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N[C@@H](C)CN(C)Cc2ccccc2)C1 ZINC001439371699 1389202091 /nfs/dbraw/zinc/20/20/91/1389202091.db2.gz SFBNOPISLGABBT-PKOBYXMFSA-N 1 3 331.504 2.745 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N[C@@H](C)CN(C)Cc2ccccc2)C1 ZINC001439371699 1389202095 /nfs/dbraw/zinc/20/20/95/1389202095.db2.gz SFBNOPISLGABBT-PKOBYXMFSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC001439403318 1389249935 /nfs/dbraw/zinc/24/99/35/1389249935.db2.gz GKWWNHOWSGALTJ-KDOFPFPSSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC001439403318 1389249943 /nfs/dbraw/zinc/24/99/43/1389249943.db2.gz GKWWNHOWSGALTJ-KDOFPFPSSA-N 1 3 335.467 2.590 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC2(C1)CCCN(CCCCC(F)(F)F)C2 ZINC001506865402 1406370850 /nfs/dbraw/zinc/37/08/50/1406370850.db2.gz KNHPPCQYYFRUIU-UHFFFAOYSA-N 1 3 349.441 2.595 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CC(C)(C)C1)C2 ZINC001440112904 1389391391 /nfs/dbraw/zinc/39/13/91/1389391391.db2.gz QXRDXYGKAOEPIU-SZMVWBNQSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CC1CC(C)(C)C1)C2 ZINC001440112904 1389391397 /nfs/dbraw/zinc/39/13/97/1389391397.db2.gz QXRDXYGKAOEPIU-SZMVWBNQSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]CC2CCCCCC2)C1 ZINC001440136446 1389406144 /nfs/dbraw/zinc/40/61/44/1389406144.db2.gz NJYSVJFXWSCZEP-MJGOQNOKSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001440136472 1389406413 /nfs/dbraw/zinc/40/64/13/1389406413.db2.gz NROKLZBBVPSRCN-HKUYNNGSSA-N 1 3 349.563 2.981 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CC3(C2)CCCN(Cc2ccsc2)C3)CC1 ZINC001506867060 1406376633 /nfs/dbraw/zinc/37/66/33/1406376633.db2.gz UFKVPJUEFKWSLA-UHFFFAOYSA-N 1 3 347.528 2.514 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H](C[NH2+]CC3CCCC3)CC2)CCC1 ZINC001440220453 1389450991 /nfs/dbraw/zinc/45/09/91/1389450991.db2.gz KKGNJXSKWCRCOA-IYARVYRRSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]CC[C@H]2CCN(C(=O)CN3CCCC3)C2)c1 ZINC001440224327 1389454736 /nfs/dbraw/zinc/45/47/36/1389454736.db2.gz YGOZKGKJZSIROS-OALUTQOASA-N 1 3 343.515 2.980 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NCc1ccc([C@H](C)NCCF)cc1 ZINC001440226794 1389457332 /nfs/dbraw/zinc/45/73/32/1389457332.db2.gz VTQMACXCHGCIMT-MAUKXSAKSA-N 1 3 335.467 2.796 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NCc1ccc([C@H](C)NCCF)cc1 ZINC001440226794 1389457334 /nfs/dbraw/zinc/45/73/34/1389457334.db2.gz VTQMACXCHGCIMT-MAUKXSAKSA-N 1 3 335.467 2.796 10 0 EFAEHO C[C@@H](C(=O)N(C)C[C@H]1CC[N@@H+]1CC1CCCC1)N1CCCCCC1 ZINC001440232488 1389461156 /nfs/dbraw/zinc/46/11/56/1389461156.db2.gz AYONQZDBVPMSOO-PKOBYXMFSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@@H](C(=O)N(C)C[C@H]1CC[N@H+]1CC1CCCC1)N1CCCCCC1 ZINC001440232488 1389461159 /nfs/dbraw/zinc/46/11/59/1389461159.db2.gz AYONQZDBVPMSOO-PKOBYXMFSA-N 1 3 335.536 2.974 10 0 EFAEHO CN(C[C@H]1CCN1CC1CCC1)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001440233943 1389462421 /nfs/dbraw/zinc/46/24/21/1389462421.db2.gz KKGQNYOSEFNYDR-GOSISDBHSA-N 1 3 335.536 2.972 10 0 EFAEHO CN(C[C@H]1CCN1CC1CCC1)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001440233943 1389462422 /nfs/dbraw/zinc/46/24/22/1389462422.db2.gz KKGQNYOSEFNYDR-GOSISDBHSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](CCc1cccs1)CC2 ZINC001440240270 1389466897 /nfs/dbraw/zinc/46/68/97/1389466897.db2.gz NAYGKKCMWVIADZ-UHFFFAOYSA-N 1 3 349.544 2.557 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001440321347 1389532699 /nfs/dbraw/zinc/53/26/99/1389532699.db2.gz RQFHSUMGCNVBSS-IZAXUBKRSA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(F)cc2)C1 ZINC001440321428 1389532711 /nfs/dbraw/zinc/53/27/11/1389532711.db2.gz SAXDDOUUDPTWJX-RLFYNMQTSA-N 1 3 335.467 2.711 10 0 EFAEHO C[C@@H](N[C@H]1C[C@H](CNC(=O)C[C@@H]2CC[N@H+](C)C2)C1)c1ccccc1F ZINC001440363490 1389568840 /nfs/dbraw/zinc/56/88/40/1389568840.db2.gz HPKLXCSHJPTPLT-YYIAUSFCSA-N 1 3 347.478 2.713 10 0 EFAEHO C[C@@H](N[C@H]1C[C@H](CNC(=O)C[C@@H]2CC[N@@H+](C)C2)C1)c1ccccc1F ZINC001440363490 1389568847 /nfs/dbraw/zinc/56/88/47/1389568847.db2.gz HPKLXCSHJPTPLT-YYIAUSFCSA-N 1 3 347.478 2.713 10 0 EFAEHO C[C@@H]1CC2(CN1C(=O)CC[NH+](C)C)CCN(CCC(F)(F)F)CC2 ZINC001440419066 1389615905 /nfs/dbraw/zinc/61/59/05/1389615905.db2.gz RILZZSFLBLCUHY-CQSZACIVSA-N 1 3 349.441 2.594 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N(C)CCCN(C)Cc2ccsc2)CC[N@@H+]1C ZINC001440448575 1389646568 /nfs/dbraw/zinc/64/65/68/1389646568.db2.gz JRJHJVXSKYGVPM-RDJZCZTQSA-N 1 3 337.533 2.759 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N(C)CCCN(C)Cc2ccsc2)CC[N@H+]1C ZINC001440448575 1389646570 /nfs/dbraw/zinc/64/65/70/1389646570.db2.gz JRJHJVXSKYGVPM-RDJZCZTQSA-N 1 3 337.533 2.759 10 0 EFAEHO C[C@H](F)CC[NH2+][C@@H]1CCCCCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001440460692 1389660115 /nfs/dbraw/zinc/66/01/15/1389660115.db2.gz KJHRKSZPTLPALY-JKSUJKDBSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC)([NH2+]Cc2ccccc2)CC1)N(C)C ZINC001440521357 1389724096 /nfs/dbraw/zinc/72/40/96/1389724096.db2.gz QEKSWZYYHAGAHQ-GOSISDBHSA-N 1 3 331.504 2.888 10 0 EFAEHO CCC1([NH2+]CC2CC(C)C2)CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001440535012 1389737470 /nfs/dbraw/zinc/73/74/70/1389737470.db2.gz XOCFOLBIDSYEIG-AOCRQIFASA-N 1 3 335.536 2.735 10 0 EFAEHO CCC1([NH2+]CCc2ccccc2)CCN(C(=O)CN(C)C(C)C)CC1 ZINC001440536939 1389739473 /nfs/dbraw/zinc/73/94/73/1389739473.db2.gz GGHFOKGUGVNLEA-UHFFFAOYSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CCc2cccs2)[C@H](C)C1 ZINC001440652959 1389800281 /nfs/dbraw/zinc/80/02/81/1389800281.db2.gz OINQYGRKNRGQCD-HZPDHXFCSA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CCc2cccs2)[C@H](C)C1 ZINC001440652959 1389800286 /nfs/dbraw/zinc/80/02/86/1389800286.db2.gz OINQYGRKNRGQCD-HZPDHXFCSA-N 1 3 337.533 2.600 10 0 EFAEHO CC[C@H](F)C[N@H+](CC)CC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001440701592 1389826125 /nfs/dbraw/zinc/82/61/25/1389826125.db2.gz IVELCOTUWZSXBZ-KRWDZBQOSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](F)C[N@@H+](CC)CC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001440701592 1389826127 /nfs/dbraw/zinc/82/61/27/1389826127.db2.gz IVELCOTUWZSXBZ-KRWDZBQOSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN1CC[C@@H](C)C1 ZINC001440722728 1389841024 /nfs/dbraw/zinc/84/10/24/1389841024.db2.gz UKWRKCAYTUCRHB-OZOXKJRCSA-N 1 3 343.515 2.746 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NC1CC(CNC/C(Cl)=C\Cl)C1 ZINC001440751152 1389870017 /nfs/dbraw/zinc/87/00/17/1389870017.db2.gz ASRHJRTZWVQLSF-LJUVTXDXSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NC1CC(CNC/C(Cl)=C\Cl)C1 ZINC001440751152 1389870021 /nfs/dbraw/zinc/87/00/21/1389870021.db2.gz ASRHJRTZWVQLSF-LJUVTXDXSA-N 1 3 348.318 2.663 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@@H](C)c2ccc(F)cc2)C1 ZINC001440758897 1389874076 /nfs/dbraw/zinc/87/40/76/1389874076.db2.gz BZVGQJFJGNPFOZ-SYJJWHGVSA-N 1 3 335.467 2.713 10 0 EFAEHO CCc1cccc(C[NH2+]CC2CC(NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001440761417 1389875436 /nfs/dbraw/zinc/87/54/36/1389875436.db2.gz PYNYXYJDUKUSCM-SOAGJPPSSA-N 1 3 345.531 2.820 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001440802117 1389907615 /nfs/dbraw/zinc/90/76/15/1389907615.db2.gz VDSYPCSMIVIRMB-GJZGRUSLSA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C1CCC1 ZINC001440802124 1389908137 /nfs/dbraw/zinc/90/81/37/1389908137.db2.gz VDSYPCSMIVIRMB-LSDHHAIUSA-N 1 3 335.467 2.601 10 0 EFAEHO C[C@@H](NCc1cc2ccccc2o1)[C@H](C)NC(=O)C1(C[NH+](C)C)CC1 ZINC001440819658 1389923427 /nfs/dbraw/zinc/92/34/27/1389923427.db2.gz NFSLFGHDIKXHDF-CABCVRRESA-N 1 3 343.471 2.757 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H](C)[NH2+]CC1CCC(C)(C)CC1 ZINC001440831738 1389932674 /nfs/dbraw/zinc/93/26/74/1389932674.db2.gz ACMOMNIIMVSPPE-KGLIPLIRSA-N 1 3 334.508 2.960 10 0 EFAEHO C[C@@H](NCc1ccccc1Cl)[C@H](C)NC(=O)C1CC[NH+](C)CC1 ZINC001440834550 1389934781 /nfs/dbraw/zinc/93/47/81/1389934781.db2.gz LMOPLBKNSMMTRD-KGLIPLIRSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@H](NCC=C(Cl)Cl)[C@H](C)NC(=O)CC[NH+]1CCCCC1 ZINC001440850488 1389951477 /nfs/dbraw/zinc/95/14/77/1389951477.db2.gz COCJMHLNIDLXQY-STQMWFEESA-N 1 3 336.307 2.664 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1CCC(N(C)C(=O)CN2CCC(C)CC2)CC1 ZINC001440860011 1389961927 /nfs/dbraw/zinc/96/19/27/1389961927.db2.gz SSWSHJXJUHGIFY-WWDZGPRUSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1C[NH+]2CCC1CC2)N(C)Cc1cccc(Cl)c1 ZINC001440925144 1390012972 /nfs/dbraw/zinc/01/29/72/1390012972.db2.gz LVNMXDVEBYBOMD-KSSFIOAISA-N 1 3 349.906 2.618 10 0 EFAEHO CCc1cccc(CN(C)[C@H](C)CNC(=O)[C@@H]2C[NH+]3CCC2CC3)c1 ZINC001440926091 1390014082 /nfs/dbraw/zinc/01/40/82/1390014082.db2.gz QDYBKHGHLHGGQC-OXQOHEQNSA-N 1 3 343.515 2.527 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H](C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)C1)CC(C)(C)C ZINC001506897349 1406414572 /nfs/dbraw/zinc/41/45/72/1406414572.db2.gz MMVUAABGWAMNSI-UJWQCDCRSA-N 1 3 349.563 2.885 10 0 EFAEHO CCc1ccccc1CC[N@H+](C)[C@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001440964817 1390055823 /nfs/dbraw/zinc/05/58/23/1390055823.db2.gz APHXRALRPDKWAQ-ZWKOTPCHSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[N@@H+](C)[C@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001440964817 1390055830 /nfs/dbraw/zinc/05/58/30/1390055830.db2.gz APHXRALRPDKWAQ-ZWKOTPCHSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[N@H+](C)[C@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001440964812 1390056522 /nfs/dbraw/zinc/05/65/22/1390056522.db2.gz APHXRALRPDKWAQ-QZTJIDSGSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[N@@H+](C)[C@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001440964812 1390056526 /nfs/dbraw/zinc/05/65/26/1390056526.db2.gz APHXRALRPDKWAQ-QZTJIDSGSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C)CCC[NH2+]CC1CC(F)(F)C1 ZINC001506921144 1406444323 /nfs/dbraw/zinc/44/43/23/1406444323.db2.gz FBTVGCVMSWPHSQ-HOCLYGCPSA-N 1 3 345.478 2.779 10 0 EFAEHO Cc1cccc(C[NH2+]CCC[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001506922350 1406447070 /nfs/dbraw/zinc/44/70/70/1406447070.db2.gz CIKAPJVMRRYANB-KRWDZBQOSA-N 1 3 331.504 2.854 10 0 EFAEHO C[C@@H](CCC[NH2+]CC=C(Cl)Cl)NC(=O)C1(N(C)C)CCC1 ZINC001506926048 1406452315 /nfs/dbraw/zinc/45/23/15/1406452315.db2.gz ZTSUVJMTLFYDCN-LBPRGKRZSA-N 1 3 336.307 2.664 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001440991387 1391009470 /nfs/dbraw/zinc/00/94/70/1391009470.db2.gz KMHXDIJHGMTFJS-OCCSQVGLSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001440991387 1391009477 /nfs/dbraw/zinc/00/94/77/1391009477.db2.gz KMHXDIJHGMTFJS-OCCSQVGLSA-N 1 3 342.434 2.523 10 0 EFAEHO C[C@H](NC(=O)CC[NH+](C)C)C1CN([C@H]2CCCc3ccc(F)cc32)C1 ZINC001441184528 1391165915 /nfs/dbraw/zinc/16/59/15/1391165915.db2.gz VUNJAFBXEXUACJ-LIRRHRJNSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCCCCC3)C[C@H]21)N(C)C ZINC001441312427 1391247246 /nfs/dbraw/zinc/24/72/46/1391247246.db2.gz KRPLHWKERITIMK-HAGHYFMRSA-N 1 3 349.563 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCCCCC3)C[C@H]21)N(C)C ZINC001441312427 1391247249 /nfs/dbraw/zinc/24/72/49/1391247249.db2.gz KRPLHWKERITIMK-HAGHYFMRSA-N 1 3 349.563 2.837 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@H]1C[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001441366498 1391268251 /nfs/dbraw/zinc/26/82/51/1391268251.db2.gz RCPIMMBEAGBAAJ-FPXQBCRKSA-N 1 3 341.515 2.729 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(C)cc2C)C1 ZINC001441382591 1391275063 /nfs/dbraw/zinc/27/50/63/1391275063.db2.gz XDZYZEXOHYWMQN-UAPYVXQJSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC(N(C)Cc2cc(C)ccc2F)CC1 ZINC001441386364 1391276577 /nfs/dbraw/zinc/27/65/77/1391276577.db2.gz GPBCTNUCAMIAKC-UHFFFAOYSA-N 1 3 349.494 2.899 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC(N(C)Cc2cc(C)ccc2F)CC1 ZINC001441386364 1391276579 /nfs/dbraw/zinc/27/65/79/1391276579.db2.gz GPBCTNUCAMIAKC-UHFFFAOYSA-N 1 3 349.494 2.899 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1C[C@@H](NCc2c(Cl)oc3ccccc32)C1 ZINC001441504033 1391338166 /nfs/dbraw/zinc/33/81/66/1391338166.db2.gz KQCGZPDTUNUQPC-BETUJISGSA-N 1 3 349.862 2.775 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc1cc(C)sc1C)N(C)C ZINC001441548992 1391357771 /nfs/dbraw/zinc/35/77/71/1391357771.db2.gz OPFKHAOWEVIYEI-MLGOLLRUSA-N 1 3 325.522 2.642 10 0 EFAEHO CC(C)Oc1ccccc1C[NH2+][C@H]1C[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001441552938 1391361919 /nfs/dbraw/zinc/36/19/19/1391361919.db2.gz WYJFDNHAVMQOMQ-HDICACEKSA-N 1 3 347.503 2.551 10 0 EFAEHO CCCN(C)CC(=O)NCCC1CC[NH+](CCC(C)(C)C)CC1 ZINC001444229183 1391464806 /nfs/dbraw/zinc/46/48/06/1391464806.db2.gz XLHAHEJRISMBTP-UHFFFAOYSA-N 1 3 325.541 2.983 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+]CC1CCC(C)CC1 ZINC001444940997 1391516420 /nfs/dbraw/zinc/51/64/20/1391516420.db2.gz ORBJFVHUAYHCMB-ABHNRTSZSA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(C1)CCC[N@H+](Cc1ccsc1)C2 ZINC001446324035 1391552966 /nfs/dbraw/zinc/55/29/66/1391552966.db2.gz BCLQAMLUKSRFAT-IBGZPJMESA-N 1 3 349.544 2.903 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(C1)CCC[N@@H+](Cc1ccsc1)C2 ZINC001446324035 1391552974 /nfs/dbraw/zinc/55/29/74/1391552974.db2.gz BCLQAMLUKSRFAT-IBGZPJMESA-N 1 3 349.544 2.903 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1(C)CC[NH+](CCC(C)(C)C)CC1 ZINC001446674925 1391576710 /nfs/dbraw/zinc/57/67/10/1391576710.db2.gz RBCIVIAVLMACPK-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)C[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001446730262 1391593243 /nfs/dbraw/zinc/59/32/43/1391593243.db2.gz WLDHLWLHUOTGTE-HNNXBMFYSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)C[N@H+]1CCC(F)(F)[C@@H](CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001446730262 1391593245 /nfs/dbraw/zinc/59/32/45/1391593245.db2.gz WLDHLWLHUOTGTE-HNNXBMFYSA-N 1 3 345.478 2.590 10 0 EFAEHO Cc1ccc(CN(C)[C@@H](C)CNC(=O)[C@H]2CCC[N@H+]2C(C)C)cc1F ZINC001448035533 1391906502 /nfs/dbraw/zinc/90/65/02/1391906502.db2.gz LSVUUGNYWPLMSW-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(CN(C)[C@@H](C)CNC(=O)[C@H]2CCC[N@@H+]2C(C)C)cc1F ZINC001448035533 1391906510 /nfs/dbraw/zinc/90/65/10/1391906510.db2.gz LSVUUGNYWPLMSW-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[N@H+](C)[C@H]1CCc2ccccc21 ZINC001448036548 1391906989 /nfs/dbraw/zinc/90/69/89/1391906989.db2.gz FIYWPEOHRZHPMD-YJBOKZPZSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001448036548 1391906993 /nfs/dbraw/zinc/90/69/93/1391906993.db2.gz FIYWPEOHRZHPMD-YJBOKZPZSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[N@H+](C)CCCc1cccc(F)c1 ZINC001448100914 1391960119 /nfs/dbraw/zinc/96/01/19/1391960119.db2.gz SMOFVPIYJHMPHC-IRXDYDNUSA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@H](C)C1)[N@@H+](C)CCCc1cccc(F)c1 ZINC001448100914 1391960123 /nfs/dbraw/zinc/96/01/23/1391960123.db2.gz SMOFVPIYJHMPHC-IRXDYDNUSA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[N@H+](C)CCCc1cccc(F)c1 ZINC001448100915 1391960757 /nfs/dbraw/zinc/96/07/57/1391960757.db2.gz SMOFVPIYJHMPHC-SJORKVTESA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[N@@H+](C)CCCc1cccc(F)c1 ZINC001448100915 1391960760 /nfs/dbraw/zinc/96/07/60/1391960760.db2.gz SMOFVPIYJHMPHC-SJORKVTESA-N 1 3 349.494 2.537 10 0 EFAEHO COc1cccc(CN2CCCCC[C@@H]2CNC(=O)CC[NH+](C)C)c1 ZINC001448270237 1392070941 /nfs/dbraw/zinc/07/09/41/1392070941.db2.gz UVJRHQJZVZFORT-GOSISDBHSA-N 1 3 347.503 2.508 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2[C@H]3C[N@@H+](CCC4CCCCC4)C[C@H]32)C1 ZINC001448436470 1392084081 /nfs/dbraw/zinc/08/40/81/1392084081.db2.gz FNKCHUFIDMEVKM-AFYVEPGGSA-N 1 3 347.547 2.593 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]2[C@H]3C[N@H+](CCC4CCCCC4)C[C@H]32)C1 ZINC001448436470 1392084085 /nfs/dbraw/zinc/08/40/85/1392084085.db2.gz FNKCHUFIDMEVKM-AFYVEPGGSA-N 1 3 347.547 2.593 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@@H](C1CC1)N(C)C(=O)C(C)(C)N1CCCCC1 ZINC001448580653 1392092344 /nfs/dbraw/zinc/09/23/44/1392092344.db2.gz DGSHUIKMONCTCS-SJORKVTESA-N 1 3 341.515 2.826 10 0 EFAEHO CN(CC(=O)N(C)[C@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1)C1CCC1 ZINC001507012799 1406588126 /nfs/dbraw/zinc/58/81/26/1406588126.db2.gz SWMFKGIQPFJBAY-LJQANCHMSA-N 1 3 347.547 2.878 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@H](C1CC1)N(C)C(=O)C(C)(C)N1CCCCC1 ZINC001507013438 1406589103 /nfs/dbraw/zinc/58/91/03/1406589103.db2.gz PFQPAOXJFQJDRO-WBVHZDCISA-N 1 3 341.515 2.826 10 0 EFAEHO CN(C(=O)C(C)(C)N1CCCCC1)[C@@H](C[NH2+]C/C=C\Cl)C1CC1 ZINC001507014182 1406590712 /nfs/dbraw/zinc/59/07/12/1406590712.db2.gz WRACJVVQLMQJNX-BJIFSAINSA-N 1 3 341.927 2.830 10 0 EFAEHO C[NH+](C)[C@@H]1C[C@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C1(C)C ZINC001452129453 1392890588 /nfs/dbraw/zinc/89/05/88/1392890588.db2.gz HWJJPNACMVYULY-JKSUJKDBSA-N 1 3 328.460 2.749 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@@H]1CCCN1C)[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001507064961 1406656217 /nfs/dbraw/zinc/65/62/17/1406656217.db2.gz YAAYPPPHSQZDJU-WBMJQRKESA-N 1 3 341.858 2.510 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+]Cc1ccccc1Cl ZINC001716586662 1418918571 /nfs/dbraw/zinc/91/85/71/1418918571.db2.gz CAKKJVIEQCTCCU-UHFFFAOYSA-N 1 3 325.884 2.618 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001507126892 1406739397 /nfs/dbraw/zinc/73/93/97/1406739397.db2.gz OPOBFVUMQFMXBB-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]Cc1ccccc1C1CC1 ZINC001507160769 1406790621 /nfs/dbraw/zinc/79/06/21/1406790621.db2.gz FXEFFERBJPUFGD-MRXNPFEDSA-N 1 3 331.504 2.841 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1csc(C)c1 ZINC001507161009 1406790688 /nfs/dbraw/zinc/79/06/88/1406790688.db2.gz HIAXGXZRAITLKR-WMLDXEAASA-N 1 3 337.533 2.867 10 0 EFAEHO Cc1ccc(CN(CCN(C)C)C(=O)[C@@H]2CCC[C@@H]([NH+](C)C)C2)o1 ZINC001464636599 1396592382 /nfs/dbraw/zinc/59/23/82/1396592382.db2.gz MOZWLRLYRQUQQK-IAGOWNOFSA-N 1 3 335.492 2.599 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H](C(=O)N(Cc2ccco2)C2CCN(C)CC2)C1 ZINC001464868290 1396624760 /nfs/dbraw/zinc/62/47/60/1396624760.db2.gz LKVZMIOVIGCEBF-QGZVFWFLSA-N 1 3 347.503 2.823 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H](C(=O)N(Cc2ccco2)C2CCN(C)CC2)C1 ZINC001464868290 1396624765 /nfs/dbraw/zinc/62/47/65/1396624765.db2.gz LKVZMIOVIGCEBF-QGZVFWFLSA-N 1 3 347.503 2.823 10 0 EFAEHO CC[NH+]1CCC(C(=O)N(C)[C@@H]2CCCN(C)C2)(c2ccccc2)CC1 ZINC001465547273 1396690072 /nfs/dbraw/zinc/69/00/72/1396690072.db2.gz SMWMMLNHYSEQGK-LJQANCHMSA-N 1 3 343.515 2.593 10 0 EFAEHO CCN(C(=O)[C@@H](C)CC[NH+](C)C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001466678059 1396771927 /nfs/dbraw/zinc/77/19/27/1396771927.db2.gz BVJWNHKYAOSQSU-PKOBYXMFSA-N 1 3 331.504 2.697 10 0 EFAEHO C[C@@H]1[C@@H](NCc2cc(Cl)ccc2F)CCN1C(=O)CC[NH+](C)C ZINC001507289232 1406854268 /nfs/dbraw/zinc/85/42/68/1406854268.db2.gz IZKLHLVXBUZYJE-WBMJQRKESA-N 1 3 341.858 2.510 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@]1(c2ccccc2)CC1(C)C ZINC001470025106 1397067573 /nfs/dbraw/zinc/06/75/73/1397067573.db2.gz BSQLKOHNVMAQSB-UWJYYQICSA-N 1 3 345.531 2.743 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@]1(c2ccccc2)CC1(C)C ZINC001470025106 1397067579 /nfs/dbraw/zinc/06/75/79/1397067579.db2.gz BSQLKOHNVMAQSB-UWJYYQICSA-N 1 3 345.531 2.743 10 0 EFAEHO CC[C@@H]1CCCC[C@@H]1CNC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001470351180 1397087230 /nfs/dbraw/zinc/08/72/30/1397087230.db2.gz DUQKFWZFKWHTBN-RCCFBDPRSA-N 1 3 340.556 2.774 10 0 EFAEHO CC[C@@H]1CCCC[C@@H]1CNC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001470351180 1397087235 /nfs/dbraw/zinc/08/72/35/1397087235.db2.gz DUQKFWZFKWHTBN-RCCFBDPRSA-N 1 3 340.556 2.774 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NCC1(C)CCCCC1 ZINC001470384229 1397089794 /nfs/dbraw/zinc/08/97/94/1397089794.db2.gz HTWZTLGEWAAYCB-INIZCTEOSA-N 1 3 326.529 2.528 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NCC1(C)CCCCC1 ZINC001470384229 1397089803 /nfs/dbraw/zinc/08/98/03/1397089803.db2.gz HTWZTLGEWAAYCB-INIZCTEOSA-N 1 3 326.529 2.528 10 0 EFAEHO CC[NH+](CC)CC[C@@H](NC(=O)N(C)CCN(C)C)c1ccccc1 ZINC001471586366 1397186408 /nfs/dbraw/zinc/18/64/08/1397186408.db2.gz HOATVMZFSUFNQO-GOSISDBHSA-N 1 3 334.508 2.663 10 0 EFAEHO C[C@H]1C[C@H](N(C)CCc2ccc3c(c2)OC(F)(F)O3)CC[N@@H+]1C ZINC001473210106 1397290659 /nfs/dbraw/zinc/29/06/59/1397290659.db2.gz CIBAFWNFOAERCX-GXTWGEPZSA-N 1 3 326.387 2.965 10 0 EFAEHO C[C@H]1C[C@H](N(C)CCc2ccc3c(c2)OC(F)(F)O3)CC[N@H+]1C ZINC001473210106 1397290660 /nfs/dbraw/zinc/29/06/60/1397290660.db2.gz CIBAFWNFOAERCX-GXTWGEPZSA-N 1 3 326.387 2.965 10 0 EFAEHO CN(C)[C@H](CNC(=O)C[N@@H+]1CCC[C@@H](C2CCC2)C1)c1ccccc1 ZINC001473656891 1397319299 /nfs/dbraw/zinc/31/92/99/1397319299.db2.gz ALQHTERCFGSDNB-WOJBJXKFSA-N 1 3 343.515 2.918 10 0 EFAEHO CN(C)[C@H](CNC(=O)C[N@H+]1CCC[C@@H](C2CCC2)C1)c1ccccc1 ZINC001473656891 1397319303 /nfs/dbraw/zinc/31/93/03/1397319303.db2.gz ALQHTERCFGSDNB-WOJBJXKFSA-N 1 3 343.515 2.918 10 0 EFAEHO C[C@@H]1CN(c2ccncc2)CC[N@@H+]1C[Si](C)(C)c1ccccc1 ZINC001473808907 1397334987 /nfs/dbraw/zinc/33/49/87/1397334987.db2.gz JCQXSYPRQJUTPV-QGZVFWFLSA-N 1 3 325.532 2.747 10 0 EFAEHO C[C@@H]1CN(c2ccncc2)CC[N@H+]1C[Si](C)(C)c1ccccc1 ZINC001473808907 1397334989 /nfs/dbraw/zinc/33/49/89/1397334989.db2.gz JCQXSYPRQJUTPV-QGZVFWFLSA-N 1 3 325.532 2.747 10 0 EFAEHO CN(C)c1cccc(CN2CCC(O)(C[NH+]3CCCCC3)CC2)c1 ZINC001473877887 1397342932 /nfs/dbraw/zinc/34/29/32/1397342932.db2.gz YINIYMXPTVKLQI-UHFFFAOYSA-N 1 3 331.504 2.565 10 0 EFAEHO CN(C[C@@H]1CCN1[C@@H]1CCCc2ccccc21)C(=O)CC[NH+](C)C ZINC001479242870 1397635854 /nfs/dbraw/zinc/63/58/54/1397635854.db2.gz LJLIOVVDHKWTMU-PKOBYXMFSA-N 1 3 329.488 2.548 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@@H]2CN(C)C(=O)C[C@@H]2CC[N@H+](C)C2)c1 ZINC001479260176 1397650019 /nfs/dbraw/zinc/65/00/19/1397650019.db2.gz HMYOJCVYKSZMGI-AZUAARDMSA-N 1 3 343.515 2.678 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@@H]2CN(C)C(=O)C[C@@H]2CC[N@@H+](C)C2)c1 ZINC001479260176 1397650025 /nfs/dbraw/zinc/65/00/25/1397650025.db2.gz HMYOJCVYKSZMGI-AZUAARDMSA-N 1 3 343.515 2.678 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+][C@H]1C[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001479348081 1397699595 /nfs/dbraw/zinc/69/95/95/1397699595.db2.gz NHDRZMQOJPKTBC-OKZBNKHCSA-N 1 3 331.504 2.881 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@H]2C[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001479417083 1397720707 /nfs/dbraw/zinc/72/07/07/1397720707.db2.gz QPCPYSYBDOFZIA-JFIYKMOQSA-N 1 3 347.503 2.581 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H](C(C)C)N2CCCCC2)CC[N@@H+]1CC1CC1 ZINC001479647224 1397760320 /nfs/dbraw/zinc/76/03/20/1397760320.db2.gz GBAWUFDHSKEGCG-IPMKNSEASA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H](C(C)C)N2CCCCC2)CC[N@H+]1CC1CC1 ZINC001479647224 1397760325 /nfs/dbraw/zinc/76/03/25/1397760325.db2.gz GBAWUFDHSKEGCG-IPMKNSEASA-N 1 3 335.536 2.876 10 0 EFAEHO CN(CC(=O)NCCC[N@H+](C)Cc1ccc(F)cc1)CC(C)(C)C ZINC001479797076 1397876585 /nfs/dbraw/zinc/87/65/85/1397876585.db2.gz RLJVVFROUOKOLO-UHFFFAOYSA-N 1 3 337.483 2.742 10 0 EFAEHO CN(CC(=O)NCCC[N@@H+](C)Cc1ccc(F)cc1)CC(C)(C)C ZINC001479797076 1397876594 /nfs/dbraw/zinc/87/65/94/1397876594.db2.gz RLJVVFROUOKOLO-UHFFFAOYSA-N 1 3 337.483 2.742 10 0 EFAEHO CC[N@H+](CCCNC(=O)Cc1nc[nH]c1C)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001479859170 1397962005 /nfs/dbraw/zinc/96/20/05/1397962005.db2.gz IHZFLUGYMJKEFX-ZACQAIPSSA-N 1 3 332.492 2.525 10 0 EFAEHO CC[N@@H+](CCCNC(=O)Cc1nc[nH]c1C)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001479859170 1397962010 /nfs/dbraw/zinc/96/20/10/1397962010.db2.gz IHZFLUGYMJKEFX-ZACQAIPSSA-N 1 3 332.492 2.525 10 0 EFAEHO Cc1ccc(CN2CCC[C@@H](NC(=O)CCCC[NH+](C)C)C2)cc1 ZINC001479913287 1398018755 /nfs/dbraw/zinc/01/87/55/1398018755.db2.gz WEPQLKJWRQLDPW-LJQANCHMSA-N 1 3 331.504 2.808 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]([NH2+][C@@H]2CCc3ccccc32)C2CC2)CCC1 ZINC001480024331 1398099648 /nfs/dbraw/zinc/09/96/48/1398099648.db2.gz SSCPGOZZRLEBRF-MOPGFXCFSA-N 1 3 341.499 2.643 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1ccc(F)cc1)C1CC1 ZINC001480023606 1398100149 /nfs/dbraw/zinc/10/01/49/1398100149.db2.gz GQBZOANEXQKDQX-MOPGFXCFSA-N 1 3 347.478 2.685 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CNC(=O)[C@H]2CCCCN2C(C)C)cc1F ZINC001480548986 1398202243 /nfs/dbraw/zinc/20/22/43/1398202243.db2.gz OYHUMJDCDDBIAO-VQIMIIECSA-N 1 3 349.494 2.991 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@H](C[NH2+]CCCC(C)(C)C)C2)CC1 ZINC001480667584 1398272966 /nfs/dbraw/zinc/27/29/66/1398272966.db2.gz AJQVXBBKUSVRNM-SFHVURJKSA-N 1 3 337.552 2.983 10 0 EFAEHO CCC/C=C/CC[NH2+]C[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001480669425 1398273233 /nfs/dbraw/zinc/27/32/33/1398273233.db2.gz TZZWAEBJHYWSQL-ZMBJWTFHSA-N 1 3 335.536 2.903 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](C[NH2+]CCCCc2ccccc2)C1 ZINC001480679244 1398279135 /nfs/dbraw/zinc/27/91/35/1398279135.db2.gz IUPQYMKRWLXNMH-HXUWFJFHSA-N 1 3 343.515 2.543 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1C(=O)N1CC[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001480681326 1398279796 /nfs/dbraw/zinc/27/97/96/1398279796.db2.gz YPTRJYIWKDDYTO-VEWWLGSESA-N 1 3 348.318 2.618 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1C(=O)N1CC[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001480681326 1398279801 /nfs/dbraw/zinc/27/98/01/1398279801.db2.gz YPTRJYIWKDDYTO-VEWWLGSESA-N 1 3 348.318 2.618 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001480682122 1398280825 /nfs/dbraw/zinc/28/08/25/1398280825.db2.gz CFXOKVKPKUCINO-QGZVFWFLSA-N 1 3 331.504 2.527 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N1CCC[C@H]1CNC(=O)CC[NH+](C)C ZINC001493134450 1398468832 /nfs/dbraw/zinc/46/88/32/1398468832.db2.gz WKZJNLJVXYYLJE-ZWKOTPCHSA-N 1 3 335.467 2.809 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@@H]2CCCN2C/C=C/c2ccccc2)C1 ZINC001493153282 1398483928 /nfs/dbraw/zinc/48/39/28/1398483928.db2.gz ZQGDBSDDRYKPDY-OIJNNWEZSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@@H]2CCCN2C/C=C/c2ccccc2)C1 ZINC001493153282 1398483935 /nfs/dbraw/zinc/48/39/35/1398483935.db2.gz ZQGDBSDDRYKPDY-OIJNNWEZSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@H]2CCCN2C/C=C/c2ccccc2)C1 ZINC001493153283 1398484527 /nfs/dbraw/zinc/48/45/27/1398484527.db2.gz ZQGDBSDDRYKPDY-PEABSYDSSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@H]2CCCN2C/C=C/c2ccccc2)C1 ZINC001493153283 1398484531 /nfs/dbraw/zinc/48/45/31/1398484531.db2.gz ZQGDBSDDRYKPDY-PEABSYDSSA-N 1 3 341.499 2.622 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@H]1CCN(Cc2cccc(C(F)F)c2)C1 ZINC001493236004 1398552541 /nfs/dbraw/zinc/55/25/41/1398552541.db2.gz ZMLQRUBGWLAVOM-HNNXBMFYSA-N 1 3 339.430 2.514 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@H]1CC[N@H+](CCCCCF)C1 ZINC001493242277 1398559151 /nfs/dbraw/zinc/55/91/51/1398559151.db2.gz ZKUODLBPKVRSMH-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@H]1CC[N@@H+](CCCCCF)C1 ZINC001493242277 1398559153 /nfs/dbraw/zinc/55/91/53/1398559153.db2.gz ZKUODLBPKVRSMH-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CCC[N@H+](CCNC(=O)Cc1nc[nH]c1C)C[C@@H]1CCC(F)(F)C1 ZINC001493330956 1398618759 /nfs/dbraw/zinc/61/87/59/1398618759.db2.gz ODHXCOKCAVVXRO-CQSZACIVSA-N 1 3 342.434 2.524 10 0 EFAEHO CCC[N@@H+](CCNC(=O)Cc1nc[nH]c1C)C[C@@H]1CCC(F)(F)C1 ZINC001493330956 1398618762 /nfs/dbraw/zinc/61/87/62/1398618762.db2.gz ODHXCOKCAVVXRO-CQSZACIVSA-N 1 3 342.434 2.524 10 0 EFAEHO CN(CC(=O)N(C)CC[NH2+]CC1CCCCCC1)CC(C)(C)C ZINC001493695409 1398814353 /nfs/dbraw/zinc/81/43/53/1398814353.db2.gz IDNODXHGLKSFNO-UHFFFAOYSA-N 1 3 325.541 2.983 10 0 EFAEHO CN(CC[NH2+]CC1=CCCCC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001493696732 1398815552 /nfs/dbraw/zinc/81/55/52/1398815552.db2.gz ZSXXUYBGENDZPQ-IBGZPJMESA-N 1 3 339.499 2.747 10 0 EFAEHO CC[C@H](F)C[NH2+][C@@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001493845415 1398918351 /nfs/dbraw/zinc/91/83/51/1398918351.db2.gz XOVXAZPNFYMVTM-WMZOPIPTSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H](C)[NH2+]CCc2ccccc2)CC1 ZINC001493849781 1398921443 /nfs/dbraw/zinc/92/14/43/1398921443.db2.gz KFHOIKAYCMBDCU-SFHVURJKSA-N 1 3 345.531 2.786 10 0 EFAEHO CCCN(C(=O)C12CC[NH+](CC1)C2)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001493974000 1399026935 /nfs/dbraw/zinc/02/69/35/1399026935.db2.gz NPAKNGONXXHLQW-LJQANCHMSA-N 1 3 341.499 2.595 10 0 EFAEHO O=C(NCC[C@H]1CCN(CCF)C1)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001494044328 1399086368 /nfs/dbraw/zinc/08/63/68/1399086368.db2.gz XRPFFFNKYCQIBS-WMZOPIPTSA-N 1 3 339.499 2.581 10 0 EFAEHO O=C(NCC[C@H]1CCN(CCF)C1)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001494044328 1399086371 /nfs/dbraw/zinc/08/63/71/1399086371.db2.gz XRPFFFNKYCQIBS-WMZOPIPTSA-N 1 3 339.499 2.581 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC001494083730 1399122241 /nfs/dbraw/zinc/12/22/41/1399122241.db2.gz QHFWKTBMSLQSHF-QZTJIDSGSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC001494083730 1399122242 /nfs/dbraw/zinc/12/22/42/1399122242.db2.gz QHFWKTBMSLQSHF-QZTJIDSGSA-N 1 3 331.504 2.916 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H](C[NH2+]Cc2ccsc2)C1)C1CCC1 ZINC001507402256 1407014183 /nfs/dbraw/zinc/01/41/83/1407014183.db2.gz XCLSRDRGOGAEQW-GOEBONIOSA-N 1 3 335.517 2.607 10 0 EFAEHO Cc1cc(C[NH+]2CC(CNC(=O)CC3CC4CCC3O4)C2)c(C)s1 ZINC001494557946 1399378426 /nfs/dbraw/zinc/37/84/26/1399378426.db2.gz JNFNTVLWXSWVCO-CGTJXYLNSA-N 1 3 348.512 2.871 10 0 EFAEHO CCC/C=C/CCN1C[C@@H]2C[C@H]1CN2C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001494658385 1399418359 /nfs/dbraw/zinc/41/83/59/1399418359.db2.gz HKVCZQMNCBMQJW-PEHGNSNYSA-N 1 3 333.520 2.892 10 0 EFAEHO CCC/C=C/CCN1C[C@@H]2C[C@H]1CN2C(=O)CC[C@H]1CCC[N@H+]1C ZINC001494658385 1399418360 /nfs/dbraw/zinc/41/83/60/1399418360.db2.gz HKVCZQMNCBMQJW-PEHGNSNYSA-N 1 3 333.520 2.892 10 0 EFAEHO CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@H+](CC(C)C)C1 ZINC001494909991 1399549617 /nfs/dbraw/zinc/54/96/17/1399549617.db2.gz JWZODDLKQQBVFG-QFBILLFUSA-N 1 3 341.515 2.778 10 0 EFAEHO CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@@H+](CC(C)C)C1 ZINC001494909991 1399549620 /nfs/dbraw/zinc/54/96/20/1399549620.db2.gz JWZODDLKQQBVFG-QFBILLFUSA-N 1 3 341.515 2.778 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](CC)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001495058673 1399633379 /nfs/dbraw/zinc/63/33/79/1399633379.db2.gz QPKFQFKTOMIOLJ-APWZRJJASA-N 1 3 331.504 2.575 10 0 EFAEHO CC[C@@H](CNC(=O)CC1CC[NH+](C)CC1)NCc1cc(C)ccc1F ZINC001495068437 1399641912 /nfs/dbraw/zinc/64/19/12/1399641912.db2.gz DGLUJOOKSZCCQN-SFHVURJKSA-N 1 3 349.494 2.850 10 0 EFAEHO C[C@H](F)CC[NH2+][C@@H]1CN(C(=O)C(C)(C)N2CCCCC2)CC1(C)C ZINC001507431002 1407045332 /nfs/dbraw/zinc/04/53/32/1407045332.db2.gz IOQPRUKOOSWSEY-JKSUJKDBSA-N 1 3 341.515 2.826 10 0 EFAEHO CCCN(C)CC(=O)N[C@](C)(C[NH2+][C@@H]1CCc2ccccc21)C1CC1 ZINC001495298932 1399806504 /nfs/dbraw/zinc/80/65/04/1399806504.db2.gz QOMMNERRVRRIHW-TZIWHRDSSA-N 1 3 343.515 2.890 10 0 EFAEHO CCCN(C)CC(=O)N[C@](C)(C[NH2+][C@H]1CCc2ccccc21)C1CC1 ZINC001495298930 1399807701 /nfs/dbraw/zinc/80/77/01/1399807701.db2.gz QOMMNERRVRRIHW-PZJWPPBQSA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2C[C@@H]([NH2+]CCCC3CCC3)C(C)(C)C2)C1 ZINC001507446411 1407062352 /nfs/dbraw/zinc/06/23/52/1407062352.db2.gz VHQPVEHRAZLCOH-SJLPKXTDSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@H](NCc2ccccn2)C(C)(C)C1)[NH+](CC)CC ZINC001507446237 1407062520 /nfs/dbraw/zinc/06/25/20/1407062520.db2.gz QWLWKPWREPHKSD-ROUUACIJSA-N 1 3 346.519 2.529 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H](CC[NH2+]CCC(C)(C)C)C1)N(C)C ZINC001495380495 1399927184 /nfs/dbraw/zinc/92/71/84/1399927184.db2.gz RBFGDHHBXBPOCP-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@H](CC[NH2+]Cc3ccccc3)C2)CCC1 ZINC001495362078 1399907321 /nfs/dbraw/zinc/90/73/21/1399907321.db2.gz DRPDSQQUGPECGS-LJQANCHMSA-N 1 3 343.515 2.889 10 0 EFAEHO CC[C@H](C)C[NH2+]CC[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001495377150 1399923401 /nfs/dbraw/zinc/92/34/01/1399923401.db2.gz JUGKLXVCVGHQJM-HKUYNNGSSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N2C[C@H](NC/C=C/Cl)C(C)(C)C2)CC1 ZINC001507449906 1407067427 /nfs/dbraw/zinc/06/74/27/1407067427.db2.gz NFZUWRZCQMVBCS-WHWKNOJMSA-N 1 3 341.927 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(CC[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001495437993 1399979917 /nfs/dbraw/zinc/97/99/17/1399979917.db2.gz QUFDJEAWHZIUFV-AQNXPRMDSA-N 1 3 349.563 2.981 10 0 EFAEHO CC1(C)CN(C(=O)CCC[NH+]2CCCCC2)C[C@H]1NC/C=C/Cl ZINC001507452418 1407070984 /nfs/dbraw/zinc/07/09/84/1407070984.db2.gz MVJBLCMPHMAFQB-MNDMWVCDSA-N 1 3 341.927 2.832 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)C[NH2+]Cc1cc(C)ccc1F ZINC001495680801 1400161967 /nfs/dbraw/zinc/16/19/67/1400161967.db2.gz RLUTVPGHLKGFDT-LPHOPBHVSA-N 1 3 349.494 2.850 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]CCc1ccccc1Cl)N(C)C ZINC001496096768 1400468676 /nfs/dbraw/zinc/46/86/76/1400468676.db2.gz NAVVZIGXAAHWLQ-RHSMWYFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CC(C)C[C@@H](CNCCF)NC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001496284326 1400598945 /nfs/dbraw/zinc/59/89/45/1400598945.db2.gz HAVODCMQUFGZFO-FUHWJXTLSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)C[C@@H](CNCCF)NC(=O)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001496284326 1400598949 /nfs/dbraw/zinc/59/89/49/1400598949.db2.gz HAVODCMQUFGZFO-FUHWJXTLSA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)CC[C@H]1[NH2+]CCCF ZINC001496368947 1400678121 /nfs/dbraw/zinc/67/81/21/1400678121.db2.gz JCXXQTRFZWBARA-CRAIPNDOSA-N 1 3 335.467 2.548 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCCCN2C(=O)[C@@H]2CCCN2C)cc1 ZINC001496388511 1400695697 /nfs/dbraw/zinc/69/56/97/1400695697.db2.gz NRACEGLFTMWYDM-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO CC1CCN(CC(=O)N2CCCC[C@@H]2CC[NH2+]C/C=C/Cl)CC1 ZINC001496412728 1400714698 /nfs/dbraw/zinc/71/46/98/1400714698.db2.gz CPDXIPLPYMWSOC-MDGVGCGJSA-N 1 3 341.927 2.832 10 0 EFAEHO CC/C=C/CC[N@H+](C)CCC1CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001496508130 1400783071 /nfs/dbraw/zinc/78/30/71/1400783071.db2.gz GTRXJFWTMDVSAN-SNAWJCMRSA-N 1 3 332.492 2.869 10 0 EFAEHO CC/C=C/CC[N@@H+](C)CCC1CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001496508130 1400783074 /nfs/dbraw/zinc/78/30/74/1400783074.db2.gz GTRXJFWTMDVSAN-SNAWJCMRSA-N 1 3 332.492 2.869 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccccc1Cl ZINC001496638391 1400891082 /nfs/dbraw/zinc/89/10/82/1400891082.db2.gz DRCZKQYLVBMSPC-KRWDZBQOSA-N 1 3 339.911 2.911 10 0 EFAEHO CN(CC[N@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)[C@H]1CCCCN1C ZINC001496730522 1400945832 /nfs/dbraw/zinc/94/58/32/1400945832.db2.gz VETKUQRTBJGAQJ-LJQANCHMSA-N 1 3 342.487 2.542 10 0 EFAEHO CN(CC[N@@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)[C@H]1CCCCN1C ZINC001496730522 1400945836 /nfs/dbraw/zinc/94/58/36/1400945836.db2.gz VETKUQRTBJGAQJ-LJQANCHMSA-N 1 3 342.487 2.542 10 0 EFAEHO CC(C)c1ccc(C[N@H+](C)CCN(C)C(=O)CN2CCCC2)cc1 ZINC001496835201 1401023576 /nfs/dbraw/zinc/02/35/76/1401023576.db2.gz HUSPAVKXGSGRBM-UHFFFAOYSA-N 1 3 331.504 2.796 10 0 EFAEHO CC(C)c1ccc(C[N@@H+](C)CCN(C)C(=O)CN2CCCC2)cc1 ZINC001496835201 1401023583 /nfs/dbraw/zinc/02/35/83/1401023583.db2.gz HUSPAVKXGSGRBM-UHFFFAOYSA-N 1 3 331.504 2.796 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@@H]2C[NH2+]CCC2CCCC2)CCC1 ZINC001496889441 1401079165 /nfs/dbraw/zinc/07/91/65/1401079165.db2.gz SGSMKJUGJDIUOI-QZTJIDSGSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@H]2C[NH2+]CCC2CCCC2)CCC1 ZINC001496889443 1401079500 /nfs/dbraw/zinc/07/95/00/1401079500.db2.gz SGSMKJUGJDIUOI-ZWKOTPCHSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]1C[NH2+]CCc1cccs1 ZINC001496922760 1401103948 /nfs/dbraw/zinc/10/39/48/1401103948.db2.gz JYKVFNBXVVJACH-RDJZCZTQSA-N 1 3 337.533 2.505 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@@H]2CCC[C@@H]2NC(=O)CN(C)C(C)C)c1 ZINC001496925933 1401105286 /nfs/dbraw/zinc/10/52/86/1401105286.db2.gz XKBDCWUOXRRVGG-PMACEKPBSA-N 1 3 345.531 2.964 10 0 EFAEHO Cc1ncccc1C[NH2+]CC[C@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001497188777 1401207590 /nfs/dbraw/zinc/20/75/90/1401207590.db2.gz MYBSDRUOXKHFEQ-INIZCTEOSA-N 1 3 346.519 2.639 10 0 EFAEHO Cc1ccc(CC[NH2+]CC[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001497206939 1401219710 /nfs/dbraw/zinc/21/97/10/1401219710.db2.gz WHVGSPAXMVEMOR-QGZVFWFLSA-N 1 3 331.504 2.506 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001507811035 1407165691 /nfs/dbraw/zinc/16/56/91/1407165691.db2.gz YQALNGDKQNHEBH-DLBZAZTESA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001507811035 1407165696 /nfs/dbraw/zinc/16/56/96/1407165696.db2.gz YQALNGDKQNHEBH-DLBZAZTESA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccccc1Cl)N(C)C ZINC001497311589 1401291428 /nfs/dbraw/zinc/29/14/28/1401291428.db2.gz JNVLCFNBOJXGKX-WMLDXEAASA-N 1 3 339.911 2.911 10 0 EFAEHO CCN(CCN[C@@H](C)c1ccccc1F)C(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001497384406 1401340906 /nfs/dbraw/zinc/34/09/06/1401340906.db2.gz XDPHBGUNOULZHC-MAUKXSAKSA-N 1 3 347.478 2.667 10 0 EFAEHO CC[C@H](C(=O)N(CC)CC[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001497486969 1401411253 /nfs/dbraw/zinc/41/12/53/1401411253.db2.gz SRTBTOGDSMEZHH-CYBMUJFWSA-N 1 3 331.913 2.680 10 0 EFAEHO CCN(CCNCc1ccc(C)nc1C)C(=O)C[NH+]1[C@H](C)CC[C@H]1C ZINC001497500834 1401422649 /nfs/dbraw/zinc/42/26/49/1401422649.db2.gz LPNQZRCYROJKGK-IAGOWNOFSA-N 1 3 346.519 2.509 10 0 EFAEHO CC(C)(C(=O)NC/C=C/CNCc1ccsc1)[NH+]1CCCCC1 ZINC001497580679 1401471159 /nfs/dbraw/zinc/47/11/59/1401471159.db2.gz WRNFDXKTVNEJNJ-SNAWJCMRSA-N 1 3 335.517 2.775 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C/CNCc2cccc(Cl)c2)CC[N@@H+]1C ZINC001497585881 1401474116 /nfs/dbraw/zinc/47/41/16/1401474116.db2.gz NRUPFKGIAXWEFM-WYIDIVSCSA-N 1 3 349.906 2.832 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C/CNCc2cccc(Cl)c2)CC[N@H+]1C ZINC001497585881 1401474117 /nfs/dbraw/zinc/47/41/17/1401474117.db2.gz NRUPFKGIAXWEFM-WYIDIVSCSA-N 1 3 349.906 2.832 10 0 EFAEHO Cc1ccc(CNC/C=C/CNC(=O)C(C)(C)[NH+]2CCCC2)cc1F ZINC001497659987 1401529189 /nfs/dbraw/zinc/52/91/89/1401529189.db2.gz ZRWSLLDSLOGLMU-SNAWJCMRSA-N 1 3 347.478 2.771 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@H]1C(=O)NC/C=C\CNCc1ccc(F)cc1 ZINC001497690561 1401554367 /nfs/dbraw/zinc/55/43/67/1401554367.db2.gz GYNUTXDBYMLTAU-HMECNJMJSA-N 1 3 347.478 2.851 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@H]1C(=O)NC/C=C\CNCc1ccc(F)cc1 ZINC001497690561 1401554374 /nfs/dbraw/zinc/55/43/74/1401554374.db2.gz GYNUTXDBYMLTAU-HMECNJMJSA-N 1 3 347.478 2.851 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)CC2CC[NH+](C)CC2)c(C)s1 ZINC001497693677 1401557536 /nfs/dbraw/zinc/55/75/36/1401557536.db2.gz ZAJRNBXNXJUFSO-PLNGDYQASA-N 1 3 349.544 2.859 10 0 EFAEHO O=C(NC/C=C/CNCc1ccsc1)C1CC[NH+](CC2CC2)CC1 ZINC001497722043 1401582725 /nfs/dbraw/zinc/58/27/25/1401582725.db2.gz IKTIQNCTROIRGB-OWOJBTEDSA-N 1 3 347.528 2.632 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\CNCc1ccsc1)[NH+]1CCCC1 ZINC001497762559 1401632066 /nfs/dbraw/zinc/63/20/66/1401632066.db2.gz ISKGLDJBOXVRQF-LIMHQNJXSA-N 1 3 335.517 2.631 10 0 EFAEHO C[C@H](C[NH2+]CCc1ccccc1)NC(=O)C(C)(C)N1CCCCC1 ZINC001497816943 1401672746 /nfs/dbraw/zinc/67/27/46/1401672746.db2.gz IJAOPOHSGCLLPQ-QGZVFWFLSA-N 1 3 331.504 2.588 10 0 EFAEHO C[C@H](CNCc1ccccc1F)NC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001497827152 1401680815 /nfs/dbraw/zinc/68/08/15/1401680815.db2.gz HMXYMROHYDPDNQ-BEFAXECRSA-N 1 3 347.478 2.827 10 0 EFAEHO C[C@H](CNCc1ccccc1F)NC(=O)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001497827152 1401680823 /nfs/dbraw/zinc/68/08/23/1401680823.db2.gz HMXYMROHYDPDNQ-BEFAXECRSA-N 1 3 347.478 2.827 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CNCc2cc3ccccc3o2)CC[N@@H+]1C ZINC001498045462 1401827628 /nfs/dbraw/zinc/82/76/28/1401827628.db2.gz WCOHNFBIEDGURV-JCGIZDLHSA-N 1 3 343.471 2.757 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CNCc2cc3ccccc3o2)CC[N@H+]1C ZINC001498045462 1401827634 /nfs/dbraw/zinc/82/76/34/1401827634.db2.gz WCOHNFBIEDGURV-JCGIZDLHSA-N 1 3 343.471 2.757 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)cc1 ZINC001498305694 1401993601 /nfs/dbraw/zinc/99/36/01/1401993601.db2.gz MIYBZGUAVBAWIF-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)cc1 ZINC001498305694 1401993603 /nfs/dbraw/zinc/99/36/03/1401993603.db2.gz MIYBZGUAVBAWIF-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCc1ccc(CN(C)C[C@H](C)NC(=O)C[C@H]2CC[N@H+](C)C2)cc1 ZINC001498424983 1402090365 /nfs/dbraw/zinc/09/03/65/1402090365.db2.gz KTTLQGUKHRHPTA-FXAWDEMLSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(CN(C)C[C@H](C)NC(=O)C[C@H]2CC[N@@H+](C)C2)cc1 ZINC001498424983 1402090372 /nfs/dbraw/zinc/09/03/72/1402090372.db2.gz KTTLQGUKHRHPTA-FXAWDEMLSA-N 1 3 345.531 2.917 10 0 EFAEHO C[N@H+](CCC(=O)N[C@@H](CNCCF)C(C)(C)C)C1CCCCC1 ZINC001507985056 1407233338 /nfs/dbraw/zinc/23/33/38/1407233338.db2.gz UHNKRQXBLDDLEU-INIZCTEOSA-N 1 3 329.504 2.731 10 0 EFAEHO C[N@@H+](CCC(=O)N[C@@H](CNCCF)C(C)(C)C)C1CCCCC1 ZINC001507985056 1407233340 /nfs/dbraw/zinc/23/33/40/1407233340.db2.gz UHNKRQXBLDDLEU-INIZCTEOSA-N 1 3 329.504 2.731 10 0 EFAEHO CN(CCC[NH2+][C@@H]1CCc2c1cccc2Cl)C(=O)[C@@H]1CCCN1C ZINC001498525731 1402160648 /nfs/dbraw/zinc/16/06/48/1402160648.db2.gz DSMTXACBZVISPN-MSOLQXFVSA-N 1 3 349.906 2.860 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc2c(c1)CCC2)C(=O)CN(C)C1CCC1 ZINC001498559360 1402175034 /nfs/dbraw/zinc/17/50/34/1402175034.db2.gz FWIFHSOTRBGBKA-UHFFFAOYSA-N 1 3 343.515 2.598 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[NH2+]Cc2ccc3cc[nH]c3c2)CCC1 ZINC001498560869 1402176255 /nfs/dbraw/zinc/17/62/55/1402176255.db2.gz VLNBUPIKFVDVCA-UHFFFAOYSA-N 1 3 342.487 2.590 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+]Cc1cc2ccccc2o1)N(C)C ZINC001498560286 1402176313 /nfs/dbraw/zinc/17/63/13/1402176313.db2.gz AYFQUYSTFFXDBJ-IBGZPJMESA-N 1 3 345.487 2.957 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CCCN(C)C(=O)[C@H]2CCCCN2C)c1 ZINC001498567721 1402179171 /nfs/dbraw/zinc/17/91/71/1402179171.db2.gz KIUJRTJWJLVOJT-GOSISDBHSA-N 1 3 335.467 2.557 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)C ZINC001508025106 1407245534 /nfs/dbraw/zinc/24/55/34/1407245534.db2.gz SYTJQODKZZYQRX-HUUCEWRRSA-N 1 3 331.520 2.833 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C[NH2+]CCc1ccccc1)C1CC1 ZINC001498761822 1402273147 /nfs/dbraw/zinc/27/31/47/1402273147.db2.gz SMMFKLDJFGULHP-PMACEKPBSA-N 1 3 343.515 2.586 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]CCc1ccccc1)C1CC1 ZINC001498761825 1402273189 /nfs/dbraw/zinc/27/31/89/1402273189.db2.gz SMMFKLDJFGULHP-VQTJNVASSA-N 1 3 343.515 2.586 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C[NH2+]CC1=CCCCC1)C1CC1 ZINC001498770049 1402278323 /nfs/dbraw/zinc/27/83/23/1402278323.db2.gz OXMIZFNCFCZHRO-MOPGFXCFSA-N 1 3 333.520 2.846 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[N@@H+]1CC1CCCC1)N1CCCCC1 ZINC001499128472 1402487385 /nfs/dbraw/zinc/48/73/85/1402487385.db2.gz XMJNBZKUUZWUFV-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[N@H+]1CC1CCCC1)N1CCCCC1 ZINC001499128472 1402487387 /nfs/dbraw/zinc/48/73/87/1402487387.db2.gz XMJNBZKUUZWUFV-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(CC(=O)NCC1([NH2+]Cc2ccc(C3CC3)cc2)CC1)C1CCC1 ZINC001499248679 1402537621 /nfs/dbraw/zinc/53/76/21/1402537621.db2.gz IXNNPCADVHBOHP-UHFFFAOYSA-N 1 3 341.499 2.787 10 0 EFAEHO Cc1cccc(C[NH2+]C2(CNC(=O)C(C)(C)N3CCCC3)CC2)c1 ZINC001499311560 1402560974 /nfs/dbraw/zinc/56/09/74/1402560974.db2.gz GVLZQUMGJBJFOY-UHFFFAOYSA-N 1 3 329.488 2.608 10 0 EFAEHO CCc1ccccc1C[NH2+]C1(CNC(=O)C(C)(C)N2CCCC2)CC1 ZINC001499312090 1402561637 /nfs/dbraw/zinc/56/16/37/1402561637.db2.gz PHEBMPKBVAFDAO-UHFFFAOYSA-N 1 3 343.515 2.862 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+][C@@H]2CCc3c2cccc3Cl)CC1 ZINC001499426009 1402607650 /nfs/dbraw/zinc/60/76/50/1402607650.db2.gz ACXZMJSTQVNFAV-QGZVFWFLSA-N 1 3 349.906 2.908 10 0 EFAEHO C[C@@H](NC1(CNC(=O)[C@@H]2CC[N@H+](C)C2)CC1)c1ccc(Cl)cc1 ZINC001499448718 1402619054 /nfs/dbraw/zinc/61/90/54/1402619054.db2.gz PLAZUGYCMGEDOT-UKRRQHHQSA-N 1 3 335.879 2.591 10 0 EFAEHO C[C@@H](NC1(CNC(=O)[C@@H]2CC[N@@H+](C)C2)CC1)c1ccc(Cl)cc1 ZINC001499448718 1402619057 /nfs/dbraw/zinc/61/90/57/1402619057.db2.gz PLAZUGYCMGEDOT-UKRRQHHQSA-N 1 3 335.879 2.591 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C2(CNC(=O)CN(C)C(C)C)CC2)c1 ZINC001499459360 1402624066 /nfs/dbraw/zinc/62/40/66/1402624066.db2.gz XMODMRGUFSMPGB-KRWDZBQOSA-N 1 3 331.504 2.943 10 0 EFAEHO C[C@H](C(=O)N[C@@H](C)C1CC[NH+](CCCF)CC1)N1CCCCCC1 ZINC001508080676 1407286067 /nfs/dbraw/zinc/28/60/67/1407286067.db2.gz GZFAPAHZBXGOIH-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC/C=C/CC[NH+]1CCC([C@H](C)NC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001508081136 1407286302 /nfs/dbraw/zinc/28/63/02/1407286302.db2.gz LXVKRTLOVNEXEQ-VGRIIWOTSA-N 1 3 335.536 2.901 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@@H](C(F)(F)F)[C@@H](NCC=C(C)C)C1 ZINC001508087677 1407290942 /nfs/dbraw/zinc/29/09/42/1407290942.db2.gz QQVBNUCRYUQZNR-CABCVRRESA-N 1 3 349.441 2.663 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@@H](C(F)(F)F)[C@@H](NCC=C(C)C)C1 ZINC001508087677 1407290945 /nfs/dbraw/zinc/29/09/45/1407290945.db2.gz QQVBNUCRYUQZNR-CABCVRRESA-N 1 3 349.441 2.663 10 0 EFAEHO CC[NH2+]C[C@H](NC(=O)CN1CC[C@@H](C)C1)c1ccc2ccccc2c1 ZINC001500060856 1402918681 /nfs/dbraw/zinc/91/86/81/1402918681.db2.gz WKGSSVLVTCSTER-UZLBHIALSA-N 1 3 339.483 2.948 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1CC[NH+](Cc2cccc(F)c2)CC1 ZINC001508090667 1407292546 /nfs/dbraw/zinc/29/25/46/1407292546.db2.gz LOOMIBNCDHOGKF-INIZCTEOSA-N 1 3 349.494 2.883 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@]2(CC[N@H+](C[C@H](F)CC)C2)C1 ZINC001500161381 1402962642 /nfs/dbraw/zinc/96/26/42/1402962642.db2.gz KVBASCSNLDIRPZ-MJGOQNOKSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@]2(CC[N@@H+](C[C@H](F)CC)C2)C1 ZINC001500161381 1402962646 /nfs/dbraw/zinc/96/26/46/1402962646.db2.gz KVBASCSNLDIRPZ-MJGOQNOKSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCOc1cccc(CN2CC[C@](C)(NC(=O)CC[NH+](C)C)C2)c1 ZINC001500259080 1403013178 /nfs/dbraw/zinc/01/31/78/1403013178.db2.gz ZTQHNXAIIPPIQU-FQEVSTJZSA-N 1 3 347.503 2.508 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001500378949 1403085811 /nfs/dbraw/zinc/08/58/11/1403085811.db2.gz ZTTAAIISYOXKGI-LPHOPBHVSA-N 1 3 325.541 2.839 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@](C)(C[NH2+]CCc2ccccc2)C1)N(C)C ZINC001500356439 1403072477 /nfs/dbraw/zinc/07/24/77/1403072477.db2.gz ROFKXGIYJFZWLM-FPOVZHCZSA-N 1 3 345.531 2.644 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@]1(C)CCC[N@H+](CC2CCC2)C1 ZINC001500497808 1403171842 /nfs/dbraw/zinc/17/18/42/1403171842.db2.gz ASGFSCYEZHYCNY-AZUAARDMSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@]1(C)CCC[N@@H+](CC2CCC2)C1 ZINC001500497808 1403171848 /nfs/dbraw/zinc/17/18/48/1403171848.db2.gz ASGFSCYEZHYCNY-AZUAARDMSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C2CC([NH2+]CCCc3ccsc3)C2)C1 ZINC001508137769 1407311335 /nfs/dbraw/zinc/31/13/35/1407311335.db2.gz VENVFIFEGAOULI-FAEJEUNOSA-N 1 3 349.544 2.602 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001500613677 1403248069 /nfs/dbraw/zinc/24/80/69/1403248069.db2.gz MLYJAHSUBYSPFA-XLBHYRNJSA-N 1 3 345.478 2.756 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC(F)(F)[C@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001500613677 1403248074 /nfs/dbraw/zinc/24/80/74/1403248074.db2.gz MLYJAHSUBYSPFA-XLBHYRNJSA-N 1 3 345.478 2.756 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+][C@H]2CCc3c2cccc3F)C1 ZINC001508155262 1407318197 /nfs/dbraw/zinc/31/81/97/1407318197.db2.gz OKEYRYYENWMUEF-ZOJXTTQQSA-N 1 3 347.478 2.732 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC2(C3CC[NH+](CC4CCCC4)CC3)CC2)C1 ZINC001508166572 1407327696 /nfs/dbraw/zinc/32/76/96/1407327696.db2.gz UKPWRLNPVVTOGG-KRWDZBQOSA-N 1 3 347.547 2.879 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](C/C=C\Cl)C2)CC(C)(C)C ZINC001501010474 1403403148 /nfs/dbraw/zinc/40/31/48/1403403148.db2.gz HTWWCVVOEYFYOL-FCLICNRPSA-N 1 3 341.927 2.686 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](C/C=C\Cl)C2)CC(C)(C)C ZINC001501010474 1403403151 /nfs/dbraw/zinc/40/31/51/1403403151.db2.gz HTWWCVVOEYFYOL-FCLICNRPSA-N 1 3 341.927 2.686 10 0 EFAEHO CCCC[NH2+]C[C@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@@H]1C ZINC001501153408 1403462295 /nfs/dbraw/zinc/46/22/95/1403462295.db2.gz OUHKVYOECNMQIZ-LPHOPBHVSA-N 1 3 331.504 2.846 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](Cc3ccccc3Cl)C[C@@H]2C1 ZINC001501242481 1403510020 /nfs/dbraw/zinc/51/00/20/1403510020.db2.gz GXVGQWLIVBCEMQ-CALCHBBNSA-N 1 3 349.906 2.570 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](Cc3ccccc3Cl)C[C@@H]2C1 ZINC001501242481 1403510023 /nfs/dbraw/zinc/51/00/23/1403510023.db2.gz GXVGQWLIVBCEMQ-CALCHBBNSA-N 1 3 349.906 2.570 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(F)cc1 ZINC001501403404 1403590615 /nfs/dbraw/zinc/59/06/15/1403590615.db2.gz IJQJAHVCPNHEJJ-RBUKOAKNSA-N 1 3 347.478 2.733 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(F)cc1 ZINC001501403404 1403590617 /nfs/dbraw/zinc/59/06/17/1403590617.db2.gz IJQJAHVCPNHEJJ-RBUKOAKNSA-N 1 3 347.478 2.733 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H](CC[NH2+]CCc3ccccc3)C2)CCC1 ZINC001501574643 1403633572 /nfs/dbraw/zinc/63/35/72/1403633572.db2.gz QIWYDKMAIWRRKC-LJQANCHMSA-N 1 3 343.515 2.542 10 0 EFAEHO C[C@H]([NH2+]CC[C@@H]1CCN(C(=O)CN2CCCC2)C1)c1ccccc1 ZINC001501647090 1403665083 /nfs/dbraw/zinc/66/50/83/1403665083.db2.gz BMKFAKVPKQBWFE-ZWKOTPCHSA-N 1 3 329.488 2.672 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001501889126 1403857072 /nfs/dbraw/zinc/85/70/72/1403857072.db2.gz WBOZOZFHUUFHIO-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)[C@@H](CC)N(C)C)C2 ZINC001502543693 1404231911 /nfs/dbraw/zinc/23/19/11/1404231911.db2.gz LGHBMXFGBPRHML-PORCLINASA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@]2(C1)CCCN(C(=O)[C@@H](CC)N(C)C)C2 ZINC001502543693 1404231919 /nfs/dbraw/zinc/23/19/19/1404231919.db2.gz LGHBMXFGBPRHML-PORCLINASA-N 1 3 335.536 2.997 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@]2(CCN(C[C@H](F)CC)C2)C1 ZINC001502547808 1404239531 /nfs/dbraw/zinc/23/95/31/1404239531.db2.gz FTYSUNPMHYYFFP-IEBWSBKVSA-N 1 3 341.515 2.781 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@]2(CCN(C[C@H](F)CC)C2)C1 ZINC001502547808 1404239540 /nfs/dbraw/zinc/23/95/40/1404239540.db2.gz FTYSUNPMHYYFFP-IEBWSBKVSA-N 1 3 341.515 2.781 10 0 EFAEHO C[NH+](C)CCCCC(=O)NCc1ccc2c(c1)CN(CC1CC1)C2 ZINC001502653013 1404288782 /nfs/dbraw/zinc/28/87/82/1404288782.db2.gz NPUNGVQEKRMXRB-UHFFFAOYSA-N 1 3 329.488 2.760 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@@H]1C ZINC001502759536 1404329287 /nfs/dbraw/zinc/32/92/87/1404329287.db2.gz IIIYQZAVHKDRQT-QFBILLFUSA-N 1 3 329.488 2.765 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H]([NH2+]CC2CCC(C)(C)CC2)C1 ZINC001502762925 1404331835 /nfs/dbraw/zinc/33/18/35/1404331835.db2.gz YPMBZRIHOSIOPT-AEFFLSMTSA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(C)CCN(C(=O)[C@@H]2CCCCN2CC)CC1 ZINC001502811204 1404357429 /nfs/dbraw/zinc/35/74/29/1404357429.db2.gz OYAUMQXHMVGMLV-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001503690913 1404499368 /nfs/dbraw/zinc/49/93/68/1404499368.db2.gz JHIBPLBEYBXNTI-QUCCMNQESA-N 1 3 343.515 2.844 10 0 EFAEHO CCCCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001503690913 1404499373 /nfs/dbraw/zinc/49/93/73/1404499373.db2.gz JHIBPLBEYBXNTI-QUCCMNQESA-N 1 3 343.515 2.844 10 0 EFAEHO CC[C@H](C)C[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)C1(N(C)C)CCC1 ZINC001505414590 1404573077 /nfs/dbraw/zinc/57/30/77/1404573077.db2.gz MDKWSLNABFMICC-KFKAGJAMSA-N 1 3 343.515 2.889 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CC1CCCC1 ZINC001505416552 1404576653 /nfs/dbraw/zinc/57/66/53/1404576653.db2.gz NQKHDRFAJUKDDD-TZIWHRDSSA-N 1 3 343.515 2.890 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N2CCC[C@@H]2CN(C)CC=C(C)C)C1 ZINC001505443361 1404628813 /nfs/dbraw/zinc/62/88/13/1404628813.db2.gz IWXZQJYOPNJYPJ-RBUKOAKNSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N2CCC[C@@H]2CN(C)CC=C(C)C)C1 ZINC001505443361 1404628825 /nfs/dbraw/zinc/62/88/25/1404628825.db2.gz IWXZQJYOPNJYPJ-RBUKOAKNSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@H](C)C[N@H+](C)C[C@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001505447000 1404640377 /nfs/dbraw/zinc/64/03/77/1404640377.db2.gz XFPVKDJIDGPHOC-DLBZAZTESA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)C[C@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001505447000 1404640395 /nfs/dbraw/zinc/64/03/95/1404640395.db2.gz XFPVKDJIDGPHOC-DLBZAZTESA-N 1 3 325.541 2.933 10 0 EFAEHO Cc1cc(C)c(C[NH2+]CC2CC(NC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001505537683 1404747624 /nfs/dbraw/zinc/74/76/24/1404747624.db2.gz IQUVSGYGZKGTBT-UHFFFAOYSA-N 1 3 345.531 2.936 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)c(C)s1 ZINC001505624821 1404866804 /nfs/dbraw/zinc/86/68/04/1404866804.db2.gz BHGHBIHEWMTYNT-KGLIPLIRSA-N 1 3 337.533 2.832 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc2cc[nH]c2c1)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001505626092 1404868062 /nfs/dbraw/zinc/86/80/62/1404868062.db2.gz QVRVNZBMCLNAEB-CABCVRRESA-N 1 3 342.487 2.635 10 0 EFAEHO C[C@@H](NCc1cc2ccccc2o1)[C@H](C)NC(=O)C12CC[NH+](CC1)C2 ZINC001505733781 1404998618 /nfs/dbraw/zinc/99/86/18/1404998618.db2.gz YAPFRNMVHOPIPN-CABCVRRESA-N 1 3 341.455 2.511 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001505735864 1405002369 /nfs/dbraw/zinc/00/23/69/1405002369.db2.gz PFWVWTHTDMUWKF-ZIAGYGMSSA-N 1 3 333.467 2.637 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC001505736042 1405002411 /nfs/dbraw/zinc/00/24/11/1405002411.db2.gz QDODXWNMXTWVKZ-CVEARBPZSA-N 1 3 342.487 2.559 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1cc(C)sc1C ZINC001505736559 1405003342 /nfs/dbraw/zinc/00/33/42/1405003342.db2.gz UVEIDTSLRGKCIW-UONOGXRCSA-N 1 3 325.522 2.690 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1ccc(C(F)F)cc1 ZINC001505761789 1405037289 /nfs/dbraw/zinc/03/72/89/1405037289.db2.gz VUQATEBQJKJTJT-ZIAGYGMSSA-N 1 3 341.446 2.947 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[N@H+](C)CCc1cccs1 ZINC001505931352 1405242211 /nfs/dbraw/zinc/24/22/11/1405242211.db2.gz YPVZRXQAFQHMTM-DOTOQJQBSA-N 1 3 337.533 2.602 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[N@@H+](C)CCc1cccs1 ZINC001505931352 1405242216 /nfs/dbraw/zinc/24/22/16/1405242216.db2.gz YPVZRXQAFQHMTM-DOTOQJQBSA-N 1 3 337.533 2.602 10 0 EFAEHO Cc1ccc(CN(C)[C@H](C)CNC(=O)CC[C@@H]2CCC[N@@H+]2C)cc1F ZINC001505937851 1405249795 /nfs/dbraw/zinc/24/97/95/1405249795.db2.gz NFUNIICORCHPMD-AEFFLSMTSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(CN(C)[C@H](C)CNC(=O)CC[C@@H]2CCC[N@H+]2C)cc1F ZINC001505937851 1405249802 /nfs/dbraw/zinc/24/98/02/1405249802.db2.gz NFUNIICORCHPMD-AEFFLSMTSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(CN(C)[C@H](C)CNC(=O)CC[C@H]2CCC[N@@H+]2C)cc1F ZINC001505937853 1405250145 /nfs/dbraw/zinc/25/01/45/1405250145.db2.gz NFUNIICORCHPMD-SJLPKXTDSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(CN(C)[C@H](C)CNC(=O)CC[C@H]2CCC[N@H+]2C)cc1F ZINC001505937853 1405250149 /nfs/dbraw/zinc/25/01/49/1405250149.db2.gz NFUNIICORCHPMD-SJLPKXTDSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](CNC(=O)CC[NH+](C)C)N(C)[C@@H](C)c1ccc(F)c(Cl)c1 ZINC001505995231 1405320544 /nfs/dbraw/zinc/32/05/44/1405320544.db2.gz UIVSUSSXWMDBPK-OLZOCXBDSA-N 1 3 343.874 2.928 10 0 EFAEHO CCc1cccc(C[N@H+](C)[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)c1 ZINC001506001703 1405330772 /nfs/dbraw/zinc/33/07/72/1405330772.db2.gz GYZXTNWZMNFVFS-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(C[N@@H+](C)[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)c1 ZINC001506001703 1405330781 /nfs/dbraw/zinc/33/07/81/1405330781.db2.gz GYZXTNWZMNFVFS-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H](C)[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001506043302 1405392319 /nfs/dbraw/zinc/39/23/19/1405392319.db2.gz NWOQDWMPQKZDOL-GJZGRUSLSA-N 1 3 333.467 2.590 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H](C)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001506043302 1405392328 /nfs/dbraw/zinc/39/23/28/1405392328.db2.gz NWOQDWMPQKZDOL-GJZGRUSLSA-N 1 3 333.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001506065756 1405425004 /nfs/dbraw/zinc/42/50/04/1405425004.db2.gz VKHCOPWOWSLAOJ-QZTJIDSGSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001506065756 1405425011 /nfs/dbraw/zinc/42/50/11/1405425011.db2.gz VKHCOPWOWSLAOJ-QZTJIDSGSA-N 1 3 345.531 2.568 10 0 EFAEHO CCC[N@@H+]1CCCCC[C@@H]1CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001506574153 1405989098 /nfs/dbraw/zinc/98/90/98/1405989098.db2.gz DQDDMIXCWKVYNW-APWZRJJASA-N 1 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Cc1ccc(CN2CC([C@H](C)NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c(C)c1 ZINC001506660836 1406115001 /nfs/dbraw/zinc/11/50/01/1406115001.db2.gz AGGGIELCIYKLFM-ROUUACIJSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(CN2CC([C@H](C)NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c(C)c1 ZINC001506660836 1406115011 /nfs/dbraw/zinc/11/50/11/1406115011.db2.gz AGGGIELCIYKLFM-ROUUACIJSA-N 1 3 343.515 2.582 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N1CCCCC[C@@H]([NH2+]CCCF)C1 ZINC001566068951 1415501645 /nfs/dbraw/zinc/50/16/45/1415501645.db2.gz NVKXTBMNTZDGTD-IAGOWNOFSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)C(C)(C)N2CCCC2)CC[N@@H+]1CCCCCF ZINC001566099535 1415514213 /nfs/dbraw/zinc/51/42/13/1415514213.db2.gz LFKQRGVKVSKBGS-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)C(C)(C)N2CCCC2)CC[N@H+]1CCCCCF ZINC001566099535 1415514214 /nfs/dbraw/zinc/51/42/14/1415514214.db2.gz LFKQRGVKVSKBGS-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C)CC1CCC(F)(F)CC1)N(C)C ZINC001566508819 1415598801 /nfs/dbraw/zinc/59/88/01/1415598801.db2.gz QNLQYBVUOCUVDZ-OAHLLOKOSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C)CC1CCC(F)(F)CC1)N(C)C ZINC001566508819 1415598807 /nfs/dbraw/zinc/59/88/07/1415598807.db2.gz QNLQYBVUOCUVDZ-OAHLLOKOSA-N 1 3 333.467 2.590 10 0 EFAEHO CCCN(C)CC(=O)NCCC[N@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC001566510642 1415600308 /nfs/dbraw/zinc/60/03/08/1415600308.db2.gz LJVKTMSCAHYIOU-GOSISDBHSA-N 1 3 335.467 2.593 10 0 EFAEHO CCCN(C)CC(=O)NCCC[N@@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC001566510642 1415600311 /nfs/dbraw/zinc/60/03/11/1415600311.db2.gz LJVKTMSCAHYIOU-GOSISDBHSA-N 1 3 335.467 2.593 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(C[C@H]2NC(=O)C2(N(C)C)CCC2)CC1 ZINC001566689539 1415732431 /nfs/dbraw/zinc/73/24/31/1415732431.db2.gz PHDCPODZGIDACT-FUTAKVPZSA-N 1 3 333.520 2.798 10 0 EFAEHO CC(C)CCC[NH2+][C@H]1C[C@@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001566852102 1415799054 /nfs/dbraw/zinc/79/90/54/1415799054.db2.gz KNVZQKBWVUHFPC-FCEWJHQRSA-N 1 3 341.515 2.872 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@@H]([NH2+]CCCc2ccccc2)C1 ZINC001566862905 1415803207 /nfs/dbraw/zinc/80/32/07/1415803207.db2.gz OGRUZGODNHNCRR-QGZVKYPTSA-N 1 3 343.515 2.729 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@H](C[NH2+]CCC2CCCC2)C1)N(C)C ZINC001566909988 1415838307 /nfs/dbraw/zinc/83/83/07/1415838307.db2.gz JPMOFOKYYSYTDI-MOPGFXCFSA-N 1 3 337.552 2.981 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@@H]1C[NH2+]CCCc1ccsc1 ZINC001566948920 1415863523 /nfs/dbraw/zinc/86/35/23/1415863523.db2.gz UMMRAEGBHWRPFN-QGZVFWFLSA-N 1 3 346.500 2.617 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H](C)CNC(=O)C1(N(C)C)CCC1 ZINC001567023658 1415904384 /nfs/dbraw/zinc/90/43/84/1415904384.db2.gz XXLCFNNSDPCCII-QGZVFWFLSA-N 1 3 331.504 2.506 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](C[NH2+]CCCC3CCCC3)C2)C1 ZINC001567141188 1415949724 /nfs/dbraw/zinc/94/97/24/1415949724.db2.gz WTRWNZBVJOEYHJ-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](C[NH2+]CCC3=CCCCC3)C2)C1 ZINC001567141040 1415949752 /nfs/dbraw/zinc/94/97/52/1415949752.db2.gz UFQOSZSTZPUBSO-IEBWSBKVSA-N 1 3 333.520 2.657 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[C@@H]1CCC[N@@H+]1C/C=C/Cl ZINC001567265657 1416043371 /nfs/dbraw/zinc/04/33/71/1416043371.db2.gz ALXVXNQVGGJTCP-FRFGOACMSA-N 1 3 341.927 2.974 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[C@@H]1CCC[N@H+]1C/C=C/Cl ZINC001567265657 1416043377 /nfs/dbraw/zinc/04/33/77/1416043377.db2.gz ALXVXNQVGGJTCP-FRFGOACMSA-N 1 3 341.927 2.974 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+]Cc2ccc(C3CCC3)cc2)CCC1 ZINC001567508264 1416165899 /nfs/dbraw/zinc/16/58/99/1416165899.db2.gz SWWKRHIVXNYAMR-UHFFFAOYSA-N 1 3 343.515 2.986 10 0 EFAEHO CN(CCNCc1ccsc1)C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001567535988 1416178756 /nfs/dbraw/zinc/17/87/56/1416178756.db2.gz UTSOPGPFMNRXMH-UHFFFAOYSA-N 1 3 337.533 2.808 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N(C)CCNCc2ccc(C)c(F)c2)C1 ZINC001567548552 1416183185 /nfs/dbraw/zinc/18/31/85/1416183185.db2.gz NDAXBJSJAKIKIH-GOSISDBHSA-N 1 3 349.494 2.804 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N(C)CCNCc2ccc(C)c(F)c2)C1 ZINC001567548552 1416183187 /nfs/dbraw/zinc/18/31/87/1416183187.db2.gz NDAXBJSJAKIKIH-GOSISDBHSA-N 1 3 349.494 2.804 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]CCN(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001567561120 1416187994 /nfs/dbraw/zinc/18/79/94/1416187994.db2.gz AFEOUFYWBWRIEY-SFHVURJKSA-N 1 3 345.531 2.775 10 0 EFAEHO Cc1ccc(C[NH2+]CCN(C)C(=O)CN(C)CC(C)(C)C)c(C)c1 ZINC001567561459 1416188085 /nfs/dbraw/zinc/18/80/85/1416188085.db2.gz OYQNBHRXQDDJMQ-UHFFFAOYSA-N 1 3 333.520 2.829 10 0 EFAEHO CN(CCNCc1ccccc1F)C(=O)c1cccc(C[NH+](C)C)c1 ZINC001567611282 1416209178 /nfs/dbraw/zinc/20/91/78/1416209178.db2.gz ARTGGZBXWQTNNQ-UHFFFAOYSA-N 1 3 343.446 2.749 10 0 EFAEHO CCc1cccc(C[NH2+]CCN(C)C(=O)[C@@H]2CCCCN2CC)c1 ZINC001567611695 1416210153 /nfs/dbraw/zinc/21/01/53/1416210153.db2.gz RNPJSKAAQQKLFA-IBGZPJMESA-N 1 3 331.504 2.671 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001567611852 1416210287 /nfs/dbraw/zinc/21/02/87/1416210287.db2.gz XDKGRRGYCQSXDW-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)CCC[NH2+][C@H](C)C1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001567630526 1416217483 /nfs/dbraw/zinc/21/74/83/1416217483.db2.gz SVJAQWYEPXZHFO-ZWKOTPCHSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC1CC1 ZINC001567648888 1416228346 /nfs/dbraw/zinc/22/83/46/1416228346.db2.gz LBVPRRAQZLQGAH-IBGZPJMESA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC1CC1 ZINC001567648888 1416228352 /nfs/dbraw/zinc/22/83/52/1416228352.db2.gz LBVPRRAQZLQGAH-IBGZPJMESA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H]1CC[N@H+](CCC2=CCCCC2)C1)N(C)C ZINC001567925926 1416326209 /nfs/dbraw/zinc/32/62/09/1416326209.db2.gz VYAOYCQPOQALHA-RTBURBONSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H]1CC[N@@H+](CCC2=CCCCC2)C1)N(C)C ZINC001567925926 1416326212 /nfs/dbraw/zinc/32/62/12/1416326212.db2.gz VYAOYCQPOQALHA-RTBURBONSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC2(C[NH2+]CCCF)CCCC2)C1 ZINC001568005219 1416356925 /nfs/dbraw/zinc/35/69/25/1416356925.db2.gz AVIMRFIWVAXTKU-SFHVURJKSA-N 1 3 345.478 2.577 10 0 EFAEHO C[C@H](C(=O)N[C@](C)(C[NH2+]C/C=C/Cl)C1CC1)N1CCCCCC1 ZINC001568029507 1416366251 /nfs/dbraw/zinc/36/62/51/1416366251.db2.gz UIEAOZARTHITHT-VMMSNCAXSA-N 1 3 341.927 2.878 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H](CC[NH2+]CCC(C)(C)C)C2)C1 ZINC001568068237 1416392271 /nfs/dbraw/zinc/39/22/71/1416392271.db2.gz SGETYMBBTFXIQW-ZWKOTPCHSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)CC[NH2+]CC[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001568070421 1416394144 /nfs/dbraw/zinc/39/41/44/1416394144.db2.gz RQSOUQNMRXBSRV-IBGZPJMESA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)=CC[NH2+]CCC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001568095822 1416407938 /nfs/dbraw/zinc/40/79/38/1416407938.db2.gz FZXUJPJBVZWTNG-UHFFFAOYSA-N 1 3 335.536 2.903 10 0 EFAEHO C[C@@H](C[NH2+]CCCCc1ccccc1)N(C)C(=O)[C@H]1CCCN1C ZINC001568262426 1416459582 /nfs/dbraw/zinc/45/95/82/1416459582.db2.gz JFXAEBYLCUOMRD-PKOBYXMFSA-N 1 3 331.504 2.540 10 0 EFAEHO C[C@H](C[NH2+]CC[C@H]1CCCC1(F)F)N(C)C(=O)CN(C)C1CCC1 ZINC001568277778 1416463592 /nfs/dbraw/zinc/46/35/92/1416463592.db2.gz FUVYMBPWOVUFMM-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1CC[NH2+]CCC(F)(F)F ZINC001568401635 1416516286 /nfs/dbraw/zinc/51/62/86/1416516286.db2.gz WGQHURNHWOFVOE-AWEZNQCLSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]CCCC(C)(C)C ZINC001568461785 1416539209 /nfs/dbraw/zinc/53/92/09/1416539209.db2.gz DLKYYRGABODPFU-DLBZAZTESA-N 1 3 325.541 2.885 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc(OC)n1)C(=O)C1CCCC(F)C1 ZINC001568742472 1416545477 /nfs/dbraw/zinc/54/54/77/1416545477.db2.gz UHELFYSGAVQOMB-CABCVRRESA-N 1 3 337.439 2.557 10 0 EFAEHO Cc1ccccc1CN1CCCN(C(=O)[C@H]2CCCC[C@H]2[NH3+])CC1 ZINC001645892268 1416580969 /nfs/dbraw/zinc/58/09/69/1416580969.db2.gz BNAOXBPQYJHBJT-RBUKOAKNSA-N 1 3 329.488 2.547 10 0 EFAEHO CC(C)=CC[NH2+][C@H]1C[C@@H](CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001691758042 1416672322 /nfs/dbraw/zinc/67/23/22/1416672322.db2.gz QMIKGVSQTCXSAD-IZAXUBKRSA-N 1 3 329.488 2.812 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@H+](C)CC2CCC(F)(F)CC2)CCC1 ZINC001689806948 1417072544 /nfs/dbraw/zinc/07/25/44/1417072544.db2.gz AWGNMUPYDUOUOD-UHFFFAOYSA-N 1 3 345.478 2.734 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@@H+](C)CC2CCC(F)(F)CC2)CCC1 ZINC001689806948 1417072548 /nfs/dbraw/zinc/07/25/48/1417072548.db2.gz AWGNMUPYDUOUOD-UHFFFAOYSA-N 1 3 345.478 2.734 10 0 EFAEHO Cc1cc(C[N@@H+](CCCNC(=O)[C@H]2CCCN2C)C2CC2)c(C)s1 ZINC001689978916 1417117144 /nfs/dbraw/zinc/11/71/44/1417117144.db2.gz KYTUFIFZKVIZPF-GOSISDBHSA-N 1 3 349.544 2.930 10 0 EFAEHO Cc1cc(C[N@H+](CCCNC(=O)[C@H]2CCCN2C)C2CC2)c(C)s1 ZINC001689978916 1417117147 /nfs/dbraw/zinc/11/71/47/1417117147.db2.gz KYTUFIFZKVIZPF-GOSISDBHSA-N 1 3 349.544 2.930 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CCC[N@H+](CCCCCF)C1 ZINC001690037904 1417140420 /nfs/dbraw/zinc/14/04/20/1417140420.db2.gz UTIBOXMGIBIHSN-SJORKVTESA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CCC[N@@H+](CCCCCF)C1 ZINC001690037904 1417140422 /nfs/dbraw/zinc/14/04/22/1417140422.db2.gz UTIBOXMGIBIHSN-SJORKVTESA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)CCC[NH2+][C@H]1C[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001690289652 1417184094 /nfs/dbraw/zinc/18/40/94/1417184094.db2.gz KNVZQKBWVUHFPC-GPMSIDNRSA-N 1 3 341.515 2.872 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC/C=C/c2ccccc2)C1)N(C)C ZINC001690343382 1417193563 /nfs/dbraw/zinc/19/35/63/1417193563.db2.gz QBOHDSUPMNCUJE-OJTMXKLZSA-N 1 3 343.515 2.913 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CCC[C@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001690388211 1417205617 /nfs/dbraw/zinc/20/56/17/1417205617.db2.gz FEGRXPQQIHKRFT-ZYHOBAKYSA-N 1 3 335.536 2.903 10 0 EFAEHO CCC/C=C\CC[N@H+]1CCC[C@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001690388211 1417205618 /nfs/dbraw/zinc/20/56/18/1417205618.db2.gz FEGRXPQQIHKRFT-ZYHOBAKYSA-N 1 3 335.536 2.903 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1CCC[N@H+](CCC2=CCCCC2)C1 ZINC001690392505 1417208831 /nfs/dbraw/zinc/20/88/31/1417208831.db2.gz ZKDYAOLZWHDCCC-SFHVURJKSA-N 1 3 344.503 2.979 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1CCC[N@@H+](CCC2=CCCCC2)C1 ZINC001690392505 1417208833 /nfs/dbraw/zinc/20/88/33/1417208833.db2.gz ZKDYAOLZWHDCCC-SFHVURJKSA-N 1 3 344.503 2.979 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@@H](C[NH2+]CCC2CCCC2)C1 ZINC001690757565 1417239314 /nfs/dbraw/zinc/23/93/14/1417239314.db2.gz LOXAGPCMPQHRSH-RBUKOAKNSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N[C@](C)(CNCC=C(Cl)Cl)C2CC2)CC[N@@H+]1C ZINC001698641935 1417308192 /nfs/dbraw/zinc/30/81/92/1417308192.db2.gz ADGLLASOFPFETM-AXAPSJFSSA-N 1 3 348.318 2.520 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N[C@](C)(CNCC=C(Cl)Cl)C2CC2)CC[N@H+]1C ZINC001698641935 1417308194 /nfs/dbraw/zinc/30/81/94/1417308194.db2.gz ADGLLASOFPFETM-AXAPSJFSSA-N 1 3 348.318 2.520 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@](C)(C[NH2+]CCC(F)(F)F)C1CC1 ZINC001698642031 1417308416 /nfs/dbraw/zinc/30/84/16/1417308416.db2.gz BAWKFIAKGNVZKY-HOCLYGCPSA-N 1 3 349.441 2.686 10 0 EFAEHO C[C@H](CC[NH2+]C[C@@H]1CCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001699134504 1417399893 /nfs/dbraw/zinc/39/98/93/1417399893.db2.gz XATXPYUZTFLLRV-HUUCEWRRSA-N 1 3 347.494 2.884 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1csc(C)c1 ZINC001699158351 1417407972 /nfs/dbraw/zinc/40/79/72/1417407972.db2.gz DOISVRJHXOIMLU-WMLDXEAASA-N 1 3 337.533 2.915 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc2ccccc21)C(=O)[C@@H]1CCCN1C ZINC001699172357 1417409943 /nfs/dbraw/zinc/40/99/43/1417409943.db2.gz BLLLOWOWEGOQTH-FQEVSTJZSA-N 1 3 339.483 2.872 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C/C=C\CNC(=O)CN1CC[C@@H](C)C1 ZINC001699308732 1417418882 /nfs/dbraw/zinc/41/88/82/1417418882.db2.gz OGLIVRRBWLRKJV-HPFMTEOYSA-N 1 3 343.515 2.914 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)CN1CC[C@H](C)C1)c1cccc(F)c1 ZINC001699533065 1417428630 /nfs/dbraw/zinc/42/86/30/1417428630.db2.gz ARUOBCMVTXWGIT-JKSUJKDBSA-N 1 3 335.467 2.667 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@](C)(C[NH2+]CCCc2ccccc2)C1)N(C)C ZINC001699846449 1417475810 /nfs/dbraw/zinc/47/58/10/1417475810.db2.gz UXZKYFOSJCJWDX-FPOVZHCZSA-N 1 3 345.531 2.788 10 0 EFAEHO C[C@H]([NH2+]CCC1=CCCCC1)[C@H]1CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001699953114 1417522193 /nfs/dbraw/zinc/52/21/93/1417522193.db2.gz ZSJYAMMWLFIDDQ-RDJZCZTQSA-N 1 3 330.476 2.669 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001699969452 1417530610 /nfs/dbraw/zinc/53/06/10/1417530610.db2.gz LADGFWYONJNVRV-QUCCMNQESA-N 1 3 345.531 2.562 10 0 EFAEHO Cc1ccc(CC[NH2+]CC[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001700094953 1417566187 /nfs/dbraw/zinc/56/61/87/1417566187.db2.gz YXXASQSLIFTVII-FQEVSTJZSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CCCCCF)N(C)C ZINC001713179044 1418355940 /nfs/dbraw/zinc/35/59/40/1418355940.db2.gz AVMQYVXMFOVQRM-FBVQUNGASA-N 1 3 341.515 2.824 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCCCF)N(C)C ZINC001713179044 1418355945 /nfs/dbraw/zinc/35/59/45/1418355945.db2.gz AVMQYVXMFOVQRM-FBVQUNGASA-N 1 3 341.515 2.824 10 0 EFAEHO CC(C)CC[NH2+]C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001713364234 1418492692 /nfs/dbraw/zinc/49/26/92/1418492692.db2.gz KXMZZACYOYEDPB-SFHVURJKSA-N 1 3 331.504 2.846 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[C@H]1CCC[N@@H+]1CC1CC(F)(F)C1 ZINC001713442200 1418538491 /nfs/dbraw/zinc/53/84/91/1418538491.db2.gz IPAQPVRFEFVXOU-INIZCTEOSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[C@H]1CCC[N@H+]1CC1CC(F)(F)C1 ZINC001713442200 1418538493 /nfs/dbraw/zinc/53/84/93/1418538493.db2.gz IPAQPVRFEFVXOU-INIZCTEOSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H](C)N(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001714754041 1418625623 /nfs/dbraw/zinc/62/56/23/1418625623.db2.gz XIKAZIPLOQUNGO-MAUKXSAKSA-N 1 3 327.488 2.602 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]CCc1ccccc1 ZINC001714774584 1418632316 /nfs/dbraw/zinc/63/23/16/1418632316.db2.gz WQPJQMLSVPDGCM-QUCCMNQESA-N 1 3 345.531 2.929 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+]C/C=C\Cl)C1CCCCC1)C1CCC1 ZINC001714973904 1418644229 /nfs/dbraw/zinc/64/42/29/1418644229.db2.gz GTQSZUZMZRPYDI-ACAQERRYSA-N 1 3 341.927 2.878 10 0 EFAEHO C[C@H]1CCCC[C@@]1(C[NH2+]CCCF)NC(=O)CN(C)CC(C)(C)C ZINC001715141633 1418653762 /nfs/dbraw/zinc/65/37/62/1418653762.db2.gz ILGSBVDVSJEMJV-LPHOPBHVSA-N 1 3 343.531 2.979 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc2c(c1)CCC2)C(=O)C1(N(C)C)CCC1 ZINC001715737297 1418681679 /nfs/dbraw/zinc/68/16/79/1418681679.db2.gz CQJBXKLAASDKFU-UHFFFAOYSA-N 1 3 343.515 2.598 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccccc1F)NC(=O)CN(C)CC(C)(C)C ZINC001716174506 1418713604 /nfs/dbraw/zinc/71/36/04/1418713604.db2.gz SYHKFXUCKMTDJR-HNNXBMFYSA-N 1 3 337.483 2.788 10 0 EFAEHO C[C@H](CC[NH2+]Cc1cc2ccccc2o1)NC(=O)CN1CC[C@@H](C)C1 ZINC001716174514 1418713726 /nfs/dbraw/zinc/71/37/26/1418713726.db2.gz TYSQRWSSVJRVPP-HZPDHXFCSA-N 1 3 343.471 2.759 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C/CNC(=O)C2(N(C)C)CCC2)cc1C ZINC001716303196 1418761867 /nfs/dbraw/zinc/76/18/67/1418761867.db2.gz MVTMQPCHTUZBMP-AATRIKPKSA-N 1 3 329.488 2.550 10 0 EFAEHO CN(CC(=O)NC/C=C\C[NH2+][C@H]1CCc2ccc(F)cc21)C1CCC1 ZINC001716305996 1418762588 /nfs/dbraw/zinc/76/25/88/1418762588.db2.gz MQIPDOTXKQPTJJ-AXMVSILFSA-N 1 3 345.462 2.559 10 0 EFAEHO C[C@@H](NC/C=C\CNC(=O)CC[NH+](C)C)c1ccc(F)c(Cl)c1 ZINC001716339870 1418784830 /nfs/dbraw/zinc/78/48/30/1418784830.db2.gz OKOVGMHQGOFGFC-DSYXLKISSA-N 1 3 341.858 2.754 10 0 EFAEHO CC[C@H]([NH2+]C/C=C/CNC(=O)CN1CC[C@H](C)C1)c1ccc(F)cc1 ZINC001716344294 1418787985 /nfs/dbraw/zinc/78/79/85/1418787985.db2.gz SZIVMLLKWLHISQ-BSCWQEJHSA-N 1 3 347.478 2.881 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC/C=C\C[NH2+]Cc1cc(C)cc(C)c1 ZINC001716380268 1418862154 /nfs/dbraw/zinc/86/21/54/1418862154.db2.gz ZMNRLTVQADKLLQ-HCZHMGAMSA-N 1 3 343.515 2.940 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]CCCc1ccc(C)cc1 ZINC001716424961 1418878634 /nfs/dbraw/zinc/87/86/34/1418878634.db2.gz ZYHMLBRLWRXSJW-QUCCMNQESA-N 1 3 345.531 2.896 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(Cl)cc1)C(=O)[C@H]1CCCCN1C ZINC001716549395 1418911830 /nfs/dbraw/zinc/91/18/30/1418911830.db2.gz VEROAGGUGCBIFH-QGZVFWFLSA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C[NH2+]CCC(F)(F)F)C1CC1 ZINC001716624010 1418927862 /nfs/dbraw/zinc/92/78/62/1418927862.db2.gz NBPOBIYYOIQMLR-LSDHHAIUSA-N 1 3 349.441 2.686 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC[C@@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001716723447 1418974304 /nfs/dbraw/zinc/97/43/04/1418974304.db2.gz ILUHVAWTMFCSQT-GNAXCBTBSA-N 1 3 330.476 2.623 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC[C@@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001716723447 1418974308 /nfs/dbraw/zinc/97/43/08/1418974308.db2.gz ILUHVAWTMFCSQT-GNAXCBTBSA-N 1 3 330.476 2.623 10 0 EFAEHO CCCCCC[NH+]1CCC2(CCN(C(=O)Cc3c[nH]cn3)C2)CC1 ZINC001716727908 1418978099 /nfs/dbraw/zinc/97/80/99/1418978099.db2.gz LDRUITQWUDGVOW-UHFFFAOYSA-N 1 3 332.492 2.847 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@]3(CC[N@H+](CCCCCF)C3)C2)CCC1 ZINC001716732247 1418982340 /nfs/dbraw/zinc/98/23/40/1418982340.db2.gz UHMZEMUCMMAAII-SFHVURJKSA-N 1 3 339.499 2.535 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@]3(CC[N@@H+](CCCCCF)C3)C2)CCC1 ZINC001716732247 1418982342 /nfs/dbraw/zinc/98/23/42/1418982342.db2.gz UHMZEMUCMMAAII-SFHVURJKSA-N 1 3 339.499 2.535 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H]2C[NH2+]C/C=C\c2ccccc2)C1 ZINC001716784168 1419006869 /nfs/dbraw/zinc/00/68/69/1419006869.db2.gz MDMJXDHCGHCXHB-NKSPSUOSSA-N 1 3 341.499 2.622 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@H]1CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001716790641 1419009756 /nfs/dbraw/zinc/00/97/56/1419009756.db2.gz JBQXTHOBSXEDPE-YJBOKZPZSA-N 1 3 335.467 2.691 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@]1(C)CCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001716864394 1419063211 /nfs/dbraw/zinc/06/32/11/1419063211.db2.gz HZAPFMURBCFKRV-LPHOPBHVSA-N 1 3 341.515 2.827 10 0 EFAEHO CCC[NH2+]CCN(Cc1ccccc1)C(=O)CN1[C@@H](C)CC[C@@H]1C ZINC001717006574 1419143241 /nfs/dbraw/zinc/14/32/41/1419143241.db2.gz UDYROFBTVWOINE-ROUUACIJSA-N 1 3 331.504 2.888 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H]2C[N@H+](CC=C(C)C)C[C@H]21 ZINC001717040648 1419174273 /nfs/dbraw/zinc/17/42/73/1419174273.db2.gz BHLSINGBVMVOKK-OKZBNKHCSA-N 1 3 339.499 2.555 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H]2C[N@@H+](CC=C(C)C)C[C@H]21 ZINC001717040648 1419174276 /nfs/dbraw/zinc/17/42/76/1419174276.db2.gz BHLSINGBVMVOKK-OKZBNKHCSA-N 1 3 339.499 2.555 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](CC[NH2+]CCC2CCCCC2)C1 ZINC001717076948 1419190110 /nfs/dbraw/zinc/19/01/10/1419190110.db2.gz RPCCVBJDQFBRNW-MOPGFXCFSA-N 1 3 335.536 2.879 10 0 EFAEHO CC1CC(C[NH2+]CC[C@H]2CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001717099594 1419207364 /nfs/dbraw/zinc/20/73/64/1419207364.db2.gz ZKISXIHBXOKDIS-ADKAHSJRSA-N 1 3 337.552 2.839 10 0 EFAEHO CC(C)CCC[NH2+]CC[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001717104817 1419211131 /nfs/dbraw/zinc/21/11/31/1419211131.db2.gz ZVGXPHFTPWOUSM-LJQANCHMSA-N 1 3 337.552 2.983 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]CCC(F)(F)F)C1 ZINC001717110532 1419215367 /nfs/dbraw/zinc/21/53/67/1419215367.db2.gz FPRLWLBJYDMKBO-HUUCEWRRSA-N 1 3 349.441 2.641 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H]([NH2+]CCCc2ccccc2C)C1 ZINC001717290642 1419310489 /nfs/dbraw/zinc/31/04/89/1419310489.db2.gz PAWQWVJLKJZCAD-AZUAARDMSA-N 1 3 345.531 2.706 10 0 EFAEHO CCCN1CCc2ccccc2[C@H]1CNC(=O)CCCC[NH+](C)C ZINC001717344627 1419343750 /nfs/dbraw/zinc/34/37/50/1419343750.db2.gz VCNJKQMYVXXHFU-LJQANCHMSA-N 1 3 331.504 2.844 10 0 EFAEHO CC/C=C/CC[N@H+](C)C[C@H]1CCCN1C(=O)CN1CCC(C)CC1 ZINC001717372539 1419364726 /nfs/dbraw/zinc/36/47/26/1419364726.db2.gz GWYMONDTJRVUGL-ZMBJWTFHSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](C)C[C@H]1CCCN1C(=O)CN1CCC(C)CC1 ZINC001717372539 1419364730 /nfs/dbraw/zinc/36/47/30/1419364730.db2.gz GWYMONDTJRVUGL-ZMBJWTFHSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N(C)CC(C)(C)C[NH2+]C/C=C\Cl ZINC001717459576 1419402932 /nfs/dbraw/zinc/40/29/32/1419402932.db2.gz HMBFCMZJJOLRQL-AJNJCKRNSA-N 1 3 329.916 2.686 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@@H](NC(=O)C23CCCN2CCC3)C(C)(C)C1 ZINC001717582890 1419455091 /nfs/dbraw/zinc/45/50/91/1419455091.db2.gz RSBSAGXBXBJILM-FUTAKVPZSA-N 1 3 333.520 2.798 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@@H](NC(=O)C23CCCN2CCC3)C(C)(C)C1 ZINC001717582890 1419455093 /nfs/dbraw/zinc/45/50/93/1419455093.db2.gz RSBSAGXBXBJILM-FUTAKVPZSA-N 1 3 333.520 2.798 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H](C[NH2+]C/C=C\c2ccccc2)C1)C1CCC1 ZINC001717642271 1419484515 /nfs/dbraw/zinc/48/45/15/1419484515.db2.gz PDQKGDLDYKHYAM-BJRLLPQXSA-N 1 3 341.499 2.669 10 0 EFAEHO CC[NH2+]CCCN(Cc1ccccc1)C(=O)[C@H]1CCCCN1CC ZINC001717707537 1419520124 /nfs/dbraw/zinc/52/01/24/1419520124.db2.gz XTTBHUBAFINYHX-LJQANCHMSA-N 1 3 331.504 2.889 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)c1 ZINC001717831512 1419562354 /nfs/dbraw/zinc/56/23/54/1419562354.db2.gz YHJPSDZKFYZTGZ-UYAOXDASSA-N 1 3 345.531 2.847 10 0 EFAEHO C[C@@H](C(=O)N[C@H](C[NH2+]CCCF)C(C)(C)C)N1CCCCCC1 ZINC001717968785 1419633997 /nfs/dbraw/zinc/63/39/97/1419633997.db2.gz HYKJZSLJYWFTNY-JKSUJKDBSA-N 1 3 329.504 2.731 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC=C(CNC(=O)CN(C)C2CCC2)CC1 ZINC001718022454 1419661952 /nfs/dbraw/zinc/66/19/52/1419661952.db2.gz VRCFWOYBECPXQJ-UHFFFAOYSA-N 1 3 341.499 2.728 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC=C(CNC(=O)CN(C)C2CCC2)CC1 ZINC001718022454 1419661954 /nfs/dbraw/zinc/66/19/54/1419661954.db2.gz VRCFWOYBECPXQJ-UHFFFAOYSA-N 1 3 341.499 2.728 10 0 EFAEHO C[C@H](c1ccccc1)[N@H+]1CC=C(CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001718028502 1419667666 /nfs/dbraw/zinc/66/76/66/1419667666.db2.gz PARVJOQISKBPKX-ZWKOTPCHSA-N 1 3 341.499 2.838 10 0 EFAEHO C[C@H](c1ccccc1)[N@@H+]1CC=C(CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001718028502 1419667670 /nfs/dbraw/zinc/66/76/70/1419667670.db2.gz PARVJOQISKBPKX-ZWKOTPCHSA-N 1 3 341.499 2.838 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@H+]([C@H](C)c2ccccc2)CC1 ZINC001718033328 1419671213 /nfs/dbraw/zinc/67/12/13/1419671213.db2.gz GKKQAQPZWNVASE-QGZVFWFLSA-N 1 3 329.488 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@@H+]([C@H](C)c2ccccc2)CC1 ZINC001718033328 1419671210 /nfs/dbraw/zinc/67/12/10/1419671210.db2.gz GKKQAQPZWNVASE-QGZVFWFLSA-N 1 3 329.488 2.836 10 0 EFAEHO CN(CCC[NH2+][C@@H]1CCCc2ccccc21)C(=O)CN(C)C1CCC1 ZINC001723038209 1424408175 /nfs/dbraw/zinc/40/81/75/1424408175.db2.gz DLNSLFWPUZTXJG-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]Cc1c(C)cccc1Cl)N(C)C ZINC001723123721 1424430434 /nfs/dbraw/zinc/43/04/34/1424430434.db2.gz PVUJNWRXHGXSDR-KRWDZBQOSA-N 1 3 339.911 2.927 10 0 EFAEHO CN(CCC[NH2+][C@@H]1CCCc2ccc(F)cc21)C(=O)CN1CCCC1 ZINC001723195294 1424448601 /nfs/dbraw/zinc/44/86/01/1424448601.db2.gz YMWLTFWODNCOMG-LJQANCHMSA-N 1 3 347.478 2.737 10 0 EFAEHO CN(CCC[NH2+][C@@H]1CCCc2ccccc21)C(=O)CN1CCCC1 ZINC001723195324 1424448672 /nfs/dbraw/zinc/44/86/72/1424448672.db2.gz ZEWUGPIZHYMLRC-LJQANCHMSA-N 1 3 329.488 2.598 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[NH2+][C@@H]1CCc2ccccc21 ZINC001723203511 1424451304 /nfs/dbraw/zinc/45/13/04/1424451304.db2.gz KXFWZCUNLXMMKX-UXHICEINSA-N 1 3 343.515 2.986 10 0 EFAEHO C[C@H]1CN(C(=O)CN2CCC(C)CC2)C[C@H]1C[NH2+]CCCCCF ZINC001724602555 1424819315 /nfs/dbraw/zinc/81/93/15/1424819315.db2.gz JPZIIKLTNVDILL-ZWKOTPCHSA-N 1 3 341.515 2.542 10 0 EFAEHO O=C([C@H]1CCC[C@@H]2CCC[N@@H+]21)N(CCNCCF)Cc1ccccc1 ZINC001724615209 1424837747 /nfs/dbraw/zinc/83/77/47/1424837747.db2.gz DVSSLJXROODMSY-RTBURBONSA-N 1 3 347.478 2.591 10 0 EFAEHO O=C([C@H]1CCC[C@@H]2CCC[N@H+]21)N(CCNCCF)Cc1ccccc1 ZINC001724615209 1424837755 /nfs/dbraw/zinc/83/77/55/1424837755.db2.gz DVSSLJXROODMSY-RTBURBONSA-N 1 3 347.478 2.591 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC[C@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)c1 ZINC001724695815 1424914390 /nfs/dbraw/zinc/91/43/90/1424914390.db2.gz DZIMTPIROCKXJK-ICSRJNTNSA-N 1 3 343.515 2.726 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](CC[NH2+]CCC2CCCC2)C1)C1CCC1 ZINC001724712068 1424930880 /nfs/dbraw/zinc/93/08/80/1424930880.db2.gz ICJVNWUSDZKPEV-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](CC[NH2+]CCc2ccccc2)C1)N(C)C ZINC001724713087 1424932034 /nfs/dbraw/zinc/93/20/34/1424932034.db2.gz UXKQXWUEBPJFSV-PMACEKPBSA-N 1 3 345.531 2.644 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](CC[NH2+]CCC3CCCC3)C2)C1 ZINC001724719081 1424938354 /nfs/dbraw/zinc/93/83/54/1424938354.db2.gz GVEIBRWXEXJXTK-MJGOQNOKSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](CC[NH2+]CCC3CCCC3)C2)C1 ZINC001724719079 1424938457 /nfs/dbraw/zinc/93/84/57/1424938457.db2.gz GVEIBRWXEXJXTK-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([C@@H]2CC[N@H+](CC=C(C)C)C2)C1 ZINC001725054975 1425265062 /nfs/dbraw/zinc/26/50/62/1425265062.db2.gz CKEDZWYYFWFPGB-RBUKOAKNSA-N 1 3 335.536 2.855 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([C@@H]2CC[N@@H+](CC=C(C)C)C2)C1 ZINC001725054975 1425265067 /nfs/dbraw/zinc/26/50/67/1425265067.db2.gz CKEDZWYYFWFPGB-RBUKOAKNSA-N 1 3 335.536 2.855 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@H]([C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001725063004 1425275386 /nfs/dbraw/zinc/27/53/86/1425275386.db2.gz ZITUVGOGOSIRII-IAGOWNOFSA-N 1 3 332.492 2.703 10 0 EFAEHO CCCCC[N@H+]1CC[C@@H]([C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001725063004 1425275391 /nfs/dbraw/zinc/27/53/91/1425275391.db2.gz ZITUVGOGOSIRII-IAGOWNOFSA-N 1 3 332.492 2.703 10 0 EFAEHO C[C@@H](CCC[NH2+]Cc1ccccc1F)NC(=O)C1(N(C)C)CCC1 ZINC001725390009 1425530678 /nfs/dbraw/zinc/53/06/78/1425530678.db2.gz NJDILPBMLDLKAU-HNNXBMFYSA-N 1 3 335.467 2.685 10 0 EFAEHO CC/C=C\CC[N@H+](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001725424051 1425570057 /nfs/dbraw/zinc/57/00/57/1425570057.db2.gz HBFAMAYMOFKLLL-WAYWQWQTSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001725424051 1425570063 /nfs/dbraw/zinc/57/00/63/1425570063.db2.gz HBFAMAYMOFKLLL-WAYWQWQTSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)[NH2+]CCCN(Cc1ccccc1)C(=O)CN1CC[C@H](C)C1 ZINC001725427139 1425574000 /nfs/dbraw/zinc/57/40/00/1425574000.db2.gz INBLZWJJPMXXQC-SFHVURJKSA-N 1 3 331.504 2.745 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccccc2)C[C@H]1C ZINC001725597224 1425683200 /nfs/dbraw/zinc/68/32/00/1425683200.db2.gz RVOYVEUXEOYTLN-IEBWSBKVSA-N 1 3 331.504 2.540 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CCCCc2ccccc2)CN1C(=O)CN1CCCC1 ZINC001725598241 1425684382 /nfs/dbraw/zinc/68/43/82/1425684382.db2.gz UFWYDJGODSUSHN-ICSRJNTNSA-N 1 3 343.515 2.684 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccc(C)cc2)C[C@@H]1C ZINC001725601423 1425687777 /nfs/dbraw/zinc/68/77/77/1425687777.db2.gz XMGNYTDUZYKUAV-AZUAARDMSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CCCCCF)[C@@H]2C1 ZINC001725616828 1425710015 /nfs/dbraw/zinc/71/00/15/1425710015.db2.gz BXHMMDCBRPFXKM-KSZLIROESA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C[NH2+]CCCF)C(C)(C)C ZINC001725752735 1425819044 /nfs/dbraw/zinc/81/90/44/1425819044.db2.gz YZYLCCKZAJMMOK-HZPDHXFCSA-N 1 3 329.504 2.729 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](Cc2ccc(C)cc2C)CC1 ZINC001725832093 1425898699 /nfs/dbraw/zinc/89/86/99/1425898699.db2.gz CTDWLBFIMAGEDZ-UHFFFAOYSA-N 1 3 343.515 2.894 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](Cc2ccc(C)cc2C)CC1 ZINC001725832093 1425898707 /nfs/dbraw/zinc/89/87/07/1425898707.db2.gz CTDWLBFIMAGEDZ-UHFFFAOYSA-N 1 3 343.515 2.894 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NCC1=CCN(Cc2ccccc2)CC1 ZINC001725831971 1425899435 /nfs/dbraw/zinc/89/94/35/1425899435.db2.gz BGJMPJILDHTBGG-UHFFFAOYSA-N 1 3 329.488 2.667 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NCC1=CCN(Cc2ccccc2)CC1 ZINC001725831971 1425899440 /nfs/dbraw/zinc/89/94/40/1425899440.db2.gz BGJMPJILDHTBGG-UHFFFAOYSA-N 1 3 329.488 2.667 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](C)CC2CCC(C)(C)CC2)C1 ZINC001731267945 1426361413 /nfs/dbraw/zinc/36/14/13/1426361413.db2.gz ZKQCCXAHVLDYKN-KRWDZBQOSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](C)CC2CCC(C)(C)CC2)C1 ZINC001731267945 1426361416 /nfs/dbraw/zinc/36/14/16/1426361416.db2.gz ZKQCCXAHVLDYKN-KRWDZBQOSA-N 1 3 337.552 2.983 10 0 EFAEHO COc1cccc(C[C@H](N[C@@H]2C[NH2+]CC3(CCOCC3)C2)C2CC2)c1 ZINC000925795295 718498319 /nfs/dbraw/zinc/49/83/19/718498319.db2.gz JRTOYYCGAHFETK-ICSRJNTNSA-N 1 3 344.499 2.765 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@H]1CCC[C@H](C(F)(F)F)O1 ZINC000925835190 719517497 /nfs/dbraw/zinc/51/74/97/719517497.db2.gz QYMUQCKULGMKOG-PSOPSSQASA-N 1 3 331.382 2.999 10 0 EFAEHO Cc1cc(N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)nc(N)n1 ZINC000066813016 720127002 /nfs/dbraw/zinc/12/70/02/720127002.db2.gz IUPJIFGXNNFWAM-UHFFFAOYSA-N 1 3 325.460 2.716 10 0 EFAEHO Cc1cc(N2CCC(C[N@H+](C)Cc3ccccc3)CC2)nc(N)n1 ZINC000066813016 720127007 /nfs/dbraw/zinc/12/70/07/720127007.db2.gz IUPJIFGXNNFWAM-UHFFFAOYSA-N 1 3 325.460 2.716 10 0 EFAEHO COC[C@H]1CCN(Cc2ccc(CN(C)C)c3c2OC(F)(F)O3)C1 ZINC000894020223 720222322 /nfs/dbraw/zinc/22/23/22/720222322.db2.gz GLGBBEMRXRCWKF-LBPRGKRZSA-N 1 3 342.386 2.538 10 0 EFAEHO COC[C@H]1CC[N@H+](Cc2ccc(CN(C)C)c3c2OC(F)(F)O3)C1 ZINC000894020223 720222325 /nfs/dbraw/zinc/22/23/25/720222325.db2.gz GLGBBEMRXRCWKF-LBPRGKRZSA-N 1 3 342.386 2.538 10 0 EFAEHO COC[C@H]1CC[N@@H+](Cc2ccc(CN(C)C)c3c2OC(F)(F)O3)C1 ZINC000894020223 720222329 /nfs/dbraw/zinc/22/23/29/720222329.db2.gz GLGBBEMRXRCWKF-LBPRGKRZSA-N 1 3 342.386 2.538 10 0 EFAEHO COC(=O)[C@@H]1[C@H](CN2CCC(CCC[NH+]3CCCC3)CC2)C1(F)F ZINC000894070538 720266039 /nfs/dbraw/zinc/26/60/39/720266039.db2.gz BVHZVXGIFWENFN-HOTGVXAUSA-N 1 3 344.446 2.629 10 0 EFAEHO COc1ccc(CCN[C@H]2C[C@H]([NH3+])C23CCC3)cc1OC(F)F ZINC000925557152 720390318 /nfs/dbraw/zinc/39/03/18/720390318.db2.gz KISYJCWWWPWOKZ-GJZGRUSLSA-N 1 3 326.387 2.699 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000925588307 720500423 /nfs/dbraw/zinc/50/04/23/720500423.db2.gz VBLRHNVHCUWJSG-BJJXKVORSA-N 1 3 339.505 2.615 10 0 EFAEHO CC1(C)C[C@@H]([NH3+])C[C@H](NCCOc2ccc(C(F)(F)F)cn2)C1 ZINC000925619694 720598793 /nfs/dbraw/zinc/59/87/93/720598793.db2.gz QRAXTHCGIIWYFX-STQMWFEESA-N 1 3 331.382 2.975 10 0 EFAEHO CC[NH+](CC)Cc1ccc(CNC[C@@H]2[C@@H](C(=O)OC)C2(F)F)cc1 ZINC000894152818 720944178 /nfs/dbraw/zinc/94/41/78/720944178.db2.gz DSVFTJWRERELOD-CVEARBPZSA-N 1 3 340.414 2.672 10 0 EFAEHO CC[NH+](CC)Cc1ccccc1CNC[C@@H]1[C@@H](C(=O)OC)C1(F)F ZINC000894158527 720971602 /nfs/dbraw/zinc/97/16/02/720971602.db2.gz SVSVRIWILPDTCU-CVEARBPZSA-N 1 3 340.414 2.672 10 0 EFAEHO CCN1CCN(C[C@@H](C)C[NH2+][C@H](C)c2cnn(C3CCC3)c2)CC1 ZINC000924953661 721864098 /nfs/dbraw/zinc/86/40/98/721864098.db2.gz RZXQSMIMADNVGG-DLBZAZTESA-N 1 3 333.524 2.532 10 0 EFAEHO C[C@@H](N[C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccnnc1 ZINC000924962844 721906967 /nfs/dbraw/zinc/90/69/67/721906967.db2.gz GVLSHJZZFQWOPW-CABCVRRESA-N 1 3 343.450 2.779 10 0 EFAEHO CC(C)N(CCN(C)C)C(=O)NC1CCC(C)([NH+]2CCCC2)CC1 ZINC000925052561 722669966 /nfs/dbraw/zinc/66/99/66/722669966.db2.gz UQUBSTPQKOQXEK-UHFFFAOYSA-N 1 3 338.540 2.765 10 0 EFAEHO CCO[C@@H]1C[C@H](N[C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)[C@H]1OC ZINC000894467187 722747424 /nfs/dbraw/zinc/74/74/24/722747424.db2.gz XKLPJODYKKDNOX-NXMWLWCLSA-N 1 3 344.499 2.822 10 0 EFAEHO CCO[C@@H]1C[C@H](N[C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)[C@H]1OC ZINC000894467187 722747426 /nfs/dbraw/zinc/74/74/26/722747426.db2.gz XKLPJODYKKDNOX-NXMWLWCLSA-N 1 3 344.499 2.822 10 0 EFAEHO Cc1noc2ncc(C[NH2+]C[C@@H]3CN(C)C[C@H]3c3ccccc3)cc12 ZINC000895085796 723240253 /nfs/dbraw/zinc/24/02/53/723240253.db2.gz PAGMIZGZTRHSPA-MJGOQNOKSA-N 1 3 336.439 2.966 10 0 EFAEHO COC(=O)[C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000895352027 724063036 /nfs/dbraw/zinc/06/30/36/724063036.db2.gz MRXPLJVZFSFAQQ-FSGKZVOOSA-N 1 3 342.483 2.971 10 0 EFAEHO C[C@@H](CN(C)C)[C@H]1CCCC[N@@H+]1Cc1cccn(C(F)F)c1=O ZINC000895378548 724088880 /nfs/dbraw/zinc/08/88/80/724088880.db2.gz IPJDSOUGJNVNIC-DZGCQCFKSA-N 1 3 327.419 2.796 10 0 EFAEHO C[C@@H](CN(C)C)[C@H]1CCCC[N@H+]1Cc1cccn(C(F)F)c1=O ZINC000895378548 724088882 /nfs/dbraw/zinc/08/88/82/724088882.db2.gz IPJDSOUGJNVNIC-DZGCQCFKSA-N 1 3 327.419 2.796 10 0 EFAEHO COc1ccc(C2=NO[C@@H](C[NH2+][C@@H]3CCN(C)C(C)(C)C3)C2)cc1C ZINC000895500543 724170709 /nfs/dbraw/zinc/17/07/09/724170709.db2.gz AOZMWPBIPODMHY-IAGOWNOFSA-N 1 3 345.487 2.959 10 0 EFAEHO CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C[NH+]2CCC(C)(N3CCC3)CC2)C1 ZINC000895672319 724253622 /nfs/dbraw/zinc/25/36/22/724253622.db2.gz WMOBUGJPDPVQBX-OXQOHEQNSA-N 1 3 349.519 2.804 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)[C@H](NC(C)C)c1ccc(OC)cc1 ZINC000895707732 724266802 /nfs/dbraw/zinc/26/68/02/724266802.db2.gz NIJRPFOBEDNCFX-CRAIPNDOSA-N 1 3 335.492 2.581 10 0 EFAEHO CC(C)Cc1ccc([C@H](CNC(=O)C23CC[NH+](CC2)C3)N(C)C)cc1 ZINC000908220874 727129294 /nfs/dbraw/zinc/12/92/94/727129294.db2.gz RWQQSFPNKKUCJJ-IBGZPJMESA-N 1 3 343.515 2.700 10 0 EFAEHO C[C@]1(NC(=O)c2cccc(C[NH+]3CCCCC3)c2)CN2CCC1CC2 ZINC000912374096 727702979 /nfs/dbraw/zinc/70/29/79/727702979.db2.gz KFDXUHZFYULWMT-NRFANRHFSA-N 1 3 341.499 2.887 10 0 EFAEHO CCN(C(=O)c1ccc(NC2=NCCC2)cc1)[C@H]1CC[N@H+](CC)C1 ZINC000912402144 727706139 /nfs/dbraw/zinc/70/61/39/727706139.db2.gz ZMZHROKAHJPJFI-KRWDZBQOSA-N 1 3 328.460 2.847 10 0 EFAEHO CCN(C(=O)c1ccc(NC2=NCCC2)cc1)[C@H]1CC[N@@H+](CC)C1 ZINC000912402144 727706140 /nfs/dbraw/zinc/70/61/40/727706140.db2.gz ZMZHROKAHJPJFI-KRWDZBQOSA-N 1 3 328.460 2.847 10 0 EFAEHO C[NH+](C)C1(C)CCN(C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000913398197 727832107 /nfs/dbraw/zinc/83/21/07/727832107.db2.gz HDHPERGULXWMHT-UHFFFAOYSA-N 1 3 329.488 2.839 10 0 EFAEHO C[NH+](C)C1(C)CCN(C(=O)[C@H]2CCCN2Cc2ccccc2)CC1 ZINC000913398740 727832136 /nfs/dbraw/zinc/83/21/36/727832136.db2.gz ONBMGNCMNYVBRG-GOSISDBHSA-N 1 3 329.488 2.594 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[N@H+](CCCF)CC1(C)C)N1CCCCC1 ZINC000940744291 728229203 /nfs/dbraw/zinc/22/92/03/728229203.db2.gz IEWGFNRKAODQKY-INIZCTEOSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CC[N@@H+](CCCF)CC1(C)C)N1CCCCC1 ZINC000940744291 728229204 /nfs/dbraw/zinc/22/92/04/728229204.db2.gz IEWGFNRKAODQKY-INIZCTEOSA-N 1 3 341.515 2.827 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@H]2CCN2CCCCc2ccccc2)C1 ZINC001569379766 1085159290 /nfs/dbraw/zinc/15/92/90/1085159290.db2.gz IFNZNTBYMLBUNS-WOJBJXKFSA-N 1 3 343.515 2.542 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@H]2CCN2CCCCc2ccccc2)C1 ZINC001569379766 1085159296 /nfs/dbraw/zinc/15/92/96/1085159296.db2.gz IFNZNTBYMLBUNS-WOJBJXKFSA-N 1 3 343.515 2.542 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@H+](CC=C(C)C)C1 ZINC001569436591 1085210970 /nfs/dbraw/zinc/21/09/70/1085210970.db2.gz JLSSRFQVFJYMJK-RTBURBONSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@@H+](CC=C(C)C)C1 ZINC001569436591 1085210979 /nfs/dbraw/zinc/21/09/79/1085210979.db2.gz JLSSRFQVFJYMJK-RTBURBONSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC[C@@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001569466063 1085260309 /nfs/dbraw/zinc/26/03/09/1085260309.db2.gz UOZMATUORAYGHV-HTJOGQSXSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC[C@@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001569466063 1085260315 /nfs/dbraw/zinc/26/03/15/1085260315.db2.gz UOZMATUORAYGHV-HTJOGQSXSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H]2C[NH2+]CCCc2ccccc2)C1 ZINC001569554909 1085371131 /nfs/dbraw/zinc/37/11/31/1085371131.db2.gz CVCGINIALNCXDX-QUCCMNQESA-N 1 3 343.515 2.542 10 0 EFAEHO C[C@H]([NH2+]CCC1=CCCCC1)[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001569824084 1085643373 /nfs/dbraw/zinc/64/33/73/1085643373.db2.gz NBLLHJQQTPGAEN-HKUYNNGSSA-N 1 3 333.520 2.799 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[C@H](C[NH2+]C/C=C\Cl)CC1)N(C)C ZINC001569865969 1085692908 /nfs/dbraw/zinc/69/29/08/1085692908.db2.gz BTBCZMMJBMUWKZ-ZWLOACGPSA-N 1 3 343.943 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](CC[NH2+]CC2CCCCC2)C1)N(C)C ZINC001570000336 1085841557 /nfs/dbraw/zinc/84/15/57/1085841557.db2.gz LBFNGLOKAYMAFL-RTBURBONSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](CC[NH2+]CC3CC4(CCC4)C3)C2)C1 ZINC001570004507 1085846905 /nfs/dbraw/zinc/84/69/05/1085846905.db2.gz KAXHKYFKDBJCHF-ROUUACIJSA-N 1 3 347.547 2.737 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@H]2CCN(C(=O)CN3CCCC3)C2)c1 ZINC001570018416 1085867614 /nfs/dbraw/zinc/86/76/14/1085867614.db2.gz DSBXKJAQWNWASC-IBGZPJMESA-N 1 3 343.515 2.727 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)CCCC[NH+](C)C)CCN1Cc1ccsc1 ZINC001570449069 1086250372 /nfs/dbraw/zinc/25/03/72/1086250372.db2.gz LVRORSNTPNZPPP-WBVHZDCISA-N 1 3 337.533 2.949 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCCC[C@H]2C[NH2+]CCCF)C1 ZINC001570514394 1086300246 /nfs/dbraw/zinc/30/02/46/1086300246.db2.gz XBLSIKVIBDKANE-YJBOKZPZSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]CC[C@@H]2CCCC2(F)F)C1 ZINC001570582371 1086381166 /nfs/dbraw/zinc/38/11/66/1086381166.db2.gz GONWSJIAXQABJD-PCKAHOCUSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N(C)C1CCC([NH2+]CCCF)CC1 ZINC001570664622 1086447060 /nfs/dbraw/zinc/44/70/60/1086447060.db2.gz UGDQVMMXIMHHLV-ABHNRTSZSA-N 1 3 341.515 2.968 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@H]1CCCCC[N@@H+]1CC=C(C)C ZINC001570822865 1086542827 /nfs/dbraw/zinc/54/28/27/1086542827.db2.gz MVVLWCLVSYGJSL-QZTJIDSGSA-N 1 3 341.515 2.993 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@H]1CCCCC[N@H+]1CC=C(C)C ZINC001570822865 1086542832 /nfs/dbraw/zinc/54/28/32/1086542832.db2.gz MVVLWCLVSYGJSL-QZTJIDSGSA-N 1 3 341.515 2.993 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@H+](CCCCCF)CC1(C)C)N(C)C ZINC001570907666 1086605092 /nfs/dbraw/zinc/60/50/92/1086605092.db2.gz LWPDYVCXEOLYKK-CVEARBPZSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@@H+](CCCCCF)CC1(C)C)N(C)C ZINC001570907666 1086605099 /nfs/dbraw/zinc/60/50/99/1086605099.db2.gz LWPDYVCXEOLYKK-CVEARBPZSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@H+](CCCCCF)CC1(C)C)N(C)C ZINC001570907668 1086605221 /nfs/dbraw/zinc/60/52/21/1086605221.db2.gz LWPDYVCXEOLYKK-HZPDHXFCSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@@H+](CCCCCF)CC1(C)C)N(C)C ZINC001570907668 1086605225 /nfs/dbraw/zinc/60/52/25/1086605225.db2.gz LWPDYVCXEOLYKK-HZPDHXFCSA-N 1 3 329.504 2.539 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H](C[NH2+]CCCc3ccsc3)C2)CCC1 ZINC001571125816 1086668256 /nfs/dbraw/zinc/66/82/56/1086668256.db2.gz OGJMAMCSEWOWSK-QAQDUYKDSA-N 1 3 349.544 2.649 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1C[C@H](C[NH2+]CC[C@@H]2CCC[C@H](C)C2)C1 ZINC001571187314 1086675226 /nfs/dbraw/zinc/67/52/26/1086675226.db2.gz WJXQMJNNVRSDAX-DKIMLUQUSA-N 1 3 346.519 2.961 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)CCC[NH2+]Cc1cccnc1 ZINC001571315171 1086712420 /nfs/dbraw/zinc/71/24/20/1086712420.db2.gz SEWJSTJJXHIVDF-IEBWSBKVSA-N 1 3 346.519 2.719 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+]Cc1ccc(Cl)cc1 ZINC001571323717 1086720576 /nfs/dbraw/zinc/72/05/76/1086720576.db2.gz RAQGMJCLNGTLQE-ZDUSSCGKSA-N 1 3 348.878 2.989 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+]Cc1ccc(Cl)cc1 ZINC001571323716 1086721277 /nfs/dbraw/zinc/72/12/77/1086721277.db2.gz RAQGMJCLNGTLQE-CYBMUJFWSA-N 1 3 348.878 2.989 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CCC[NH2+]Cc1ccsc1 ZINC001571326202 1086724376 /nfs/dbraw/zinc/72/43/76/1086724376.db2.gz PNLPSSXWCOADSQ-DOTOQJQBSA-N 1 3 337.533 2.997 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N(C)[C@@H](C[NH2+]CCC(F)(F)F)C1CC1 ZINC001571360108 1086754924 /nfs/dbraw/zinc/75/49/24/1086754924.db2.gz LUPUIRCRXRMJTG-GJZGRUSLSA-N 1 3 349.441 2.638 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H]1CCN(C(=O)CN2CCCC2)[C@H]1C ZINC001571468020 1086843027 /nfs/dbraw/zinc/84/30/27/1086843027.db2.gz VYFVGJZXNRCYHY-AZUAARDMSA-N 1 3 343.515 2.602 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCc2ccccc2C)C[C@@H]1C ZINC001571490291 1086880140 /nfs/dbraw/zinc/88/01/40/1086880140.db2.gz BTALBGOBEDQTHX-ICSRJNTNSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)(C)[C@@H](CNCCF)NC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001571630312 1087001196 /nfs/dbraw/zinc/00/11/96/1087001196.db2.gz FBULLQSFWCFOKB-IAGOWNOFSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)(C)[C@@H](CNCCF)NC(=O)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001571630312 1087001203 /nfs/dbraw/zinc/00/12/03/1087001203.db2.gz FBULLQSFWCFOKB-IAGOWNOFSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)=CCN[C@@H]1CN(C(=O)CCC[NH+](C)C)CC[C@@H]1C(F)(F)F ZINC001571652360 1087023218 /nfs/dbraw/zinc/02/32/18/1087023218.db2.gz MOUMSOJJKGLFKA-LSDHHAIUSA-N 1 3 349.441 2.663 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001571699550 1087071268 /nfs/dbraw/zinc/07/12/68/1087071268.db2.gz UXEDYNHUBWMUDW-CEXWTWQISA-N 1 3 333.520 2.513 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001571699550 1087071273 /nfs/dbraw/zinc/07/12/73/1087071273.db2.gz UXEDYNHUBWMUDW-CEXWTWQISA-N 1 3 333.520 2.513 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCCC2(CC[NH2+]CC2)C1)c1ccccc1 ZINC001647334634 1089269445 /nfs/dbraw/zinc/26/94/45/1089269445.db2.gz LQFGPSWUCYDGJG-IAGOWNOFSA-N 1 3 329.488 2.718 10 0 EFAEHO CC(C)CCC[NH2+][C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001266970583 1092218193 /nfs/dbraw/zinc/21/81/93/1092218193.db2.gz FLAZODPQFCVQLT-QAPCUYQASA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)NC[C@H](Cc2ccccc2)N(C)C)CC1 ZINC000063637027 1092224095 /nfs/dbraw/zinc/22/40/95/1092224095.db2.gz QORVMXLMLXTENN-FQEVSTJZSA-N 1 3 345.531 2.644 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@@H]2CCCN2CCCCC(F)(F)F)CC[N@@H+]1C ZINC001267267960 1093426029 /nfs/dbraw/zinc/42/60/29/1093426029.db2.gz UUBWRKRWGGLFTI-QLFBSQMISA-N 1 3 349.441 2.640 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@@H]2CCCN2CCCCC(F)(F)F)CC[N@H+]1C ZINC001267267960 1093426035 /nfs/dbraw/zinc/42/60/35/1093426035.db2.gz UUBWRKRWGGLFTI-QLFBSQMISA-N 1 3 349.441 2.640 10 0 EFAEHO CC(C)=CCN1CCC[C@H]1CNC(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001267277072 1093455889 /nfs/dbraw/zinc/45/58/89/1093455889.db2.gz YPYCZLVURCTQJR-LPHOPBHVSA-N 1 3 339.499 2.746 10 0 EFAEHO CC(C)=CCN1CCC[C@H]1CNC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001267277072 1093455896 /nfs/dbraw/zinc/45/58/96/1093455896.db2.gz YPYCZLVURCTQJR-LPHOPBHVSA-N 1 3 339.499 2.746 10 0 EFAEHO CC(C)=CCN1CCC[C@H]1CNC(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001267277073 1093456414 /nfs/dbraw/zinc/45/64/14/1093456414.db2.gz YPYCZLVURCTQJR-QFBILLFUSA-N 1 3 339.499 2.746 10 0 EFAEHO CC(C)=CCN1CCC[C@H]1CNC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001267277073 1093456420 /nfs/dbraw/zinc/45/64/20/1093456420.db2.gz YPYCZLVURCTQJR-QFBILLFUSA-N 1 3 339.499 2.746 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1cccc(F)c1 ZINC001267319389 1093566740 /nfs/dbraw/zinc/56/67/40/1093566740.db2.gz MFYKXZHNVOANET-QGZVFWFLSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1cccc(F)c1 ZINC001267319389 1093566744 /nfs/dbraw/zinc/56/67/44/1093566744.db2.gz MFYKXZHNVOANET-QGZVFWFLSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)CCNCc1cc2ccccc2o1 ZINC001267380714 1094403259 /nfs/dbraw/zinc/40/32/59/1094403259.db2.gz NYZOGULYHXPBMC-GOSISDBHSA-N 1 3 343.471 2.855 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N(C)CCNCc1cc2ccccc2o1 ZINC001267380714 1094403265 /nfs/dbraw/zinc/40/32/65/1094403265.db2.gz NYZOGULYHXPBMC-GOSISDBHSA-N 1 3 343.471 2.855 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NCCCN2CCc3ccccc3C2)C1 ZINC001595655324 1094481453 /nfs/dbraw/zinc/48/14/53/1094481453.db2.gz JRNFAEMOCLDDQZ-FQEVSTJZSA-N 1 3 343.515 2.673 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NCCCN2CCc3ccccc3C2)C1 ZINC001595655324 1094481459 /nfs/dbraw/zinc/48/14/59/1094481459.db2.gz JRNFAEMOCLDDQZ-FQEVSTJZSA-N 1 3 343.515 2.673 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NCC[C@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001481465139 1094739437 /nfs/dbraw/zinc/73/94/37/1094739437.db2.gz OWHUSMPWMHJDPX-RDJZCZTQSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NCC[C@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001481465139 1094739441 /nfs/dbraw/zinc/73/94/41/1094739441.db2.gz OWHUSMPWMHJDPX-RDJZCZTQSA-N 1 3 349.906 2.620 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]CCCc1ccsc1 ZINC001267474381 1094766751 /nfs/dbraw/zinc/76/67/51/1094766751.db2.gz QYENDUAIOQZISB-QGZVFWFLSA-N 1 3 337.533 2.603 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[N@H+](CCC2=CCCCC2)C1 ZINC001481120974 1094783900 /nfs/dbraw/zinc/78/39/00/1094783900.db2.gz QGMWWLIMZJWSQI-QGZVFWFLSA-N 1 3 330.476 2.589 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[N@@H+](CCC2=CCCCC2)C1 ZINC001481120974 1094783911 /nfs/dbraw/zinc/78/39/11/1094783911.db2.gz QGMWWLIMZJWSQI-QGZVFWFLSA-N 1 3 330.476 2.589 10 0 EFAEHO Cc1cccc(C)c1C[N@H+]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001481127143 1094855057 /nfs/dbraw/zinc/85/50/57/1094855057.db2.gz PCJSAJAZEHNRIR-GOSISDBHSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+]1CC[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001481127143 1094855070 /nfs/dbraw/zinc/85/50/70/1094855070.db2.gz PCJSAJAZEHNRIR-GOSISDBHSA-N 1 3 331.504 2.582 10 0 EFAEHO CCCN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)Cc1csc(C)c1 ZINC001481151421 1094999266 /nfs/dbraw/zinc/99/92/66/1094999266.db2.gz FWERAAWPPQCBLZ-INIZCTEOSA-N 1 3 337.533 2.727 10 0 EFAEHO CCCN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)Cc1csc(C)c1 ZINC001481151421 1094999274 /nfs/dbraw/zinc/99/92/74/1094999274.db2.gz FWERAAWPPQCBLZ-INIZCTEOSA-N 1 3 337.533 2.727 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001481510095 1095009026 /nfs/dbraw/zinc/00/90/26/1095009026.db2.gz TXYMCUBIQILTSW-AEFFLSMTSA-N 1 3 349.494 2.890 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001481510095 1095009033 /nfs/dbraw/zinc/00/90/33/1095009033.db2.gz TXYMCUBIQILTSW-AEFFLSMTSA-N 1 3 349.494 2.890 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1ccccc1 ZINC001267508740 1095118548 /nfs/dbraw/zinc/11/85/48/1095118548.db2.gz GBPWOVIMIFCHOH-GOSISDBHSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1ccccc1 ZINC001267508740 1095118556 /nfs/dbraw/zinc/11/85/56/1095118556.db2.gz GBPWOVIMIFCHOH-GOSISDBHSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H]1CCC[N@H+](CCCCCF)C1 ZINC001481537395 1095187497 /nfs/dbraw/zinc/18/74/97/1095187497.db2.gz CLFAGUQBAMWSHE-ZWKOTPCHSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H]1CCC[N@@H+](CCCCCF)C1 ZINC001481537395 1095187501 /nfs/dbraw/zinc/18/75/01/1095187501.db2.gz CLFAGUQBAMWSHE-ZWKOTPCHSA-N 1 3 341.515 2.970 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]CCc1cccs1 ZINC001268151457 1095538068 /nfs/dbraw/zinc/53/80/68/1095538068.db2.gz PTMUWIBGEJZRMZ-AEFFLSMTSA-N 1 3 349.544 2.746 10 0 EFAEHO CCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)C12CCC[NH+](CCC1)C2 ZINC001267709035 1095570686 /nfs/dbraw/zinc/57/06/86/1095570686.db2.gz NKGTUDWZCUMDJM-ROUUACIJSA-N 1 3 333.520 2.728 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H]2CCCCN2C(=O)Cc2c[nH]cn2)cs1 ZINC001268161897 1095595922 /nfs/dbraw/zinc/59/59/22/1095595922.db2.gz SFGJGWLBOCVBBE-QGZVFWFLSA-N 1 3 346.500 2.883 10 0 EFAEHO CN(CC[NH2+]Cc1ccc(C2CCC2)cc1)C(=O)[C@H]1CCCN1C ZINC001481214796 1095674275 /nfs/dbraw/zinc/67/42/75/1095674275.db2.gz AOXCVIFIFDLEJD-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO CCN(CCNC(=O)C12CC[NH+](CC1)C2)Cc1ccccc1C1CC1 ZINC001481012463 1095824228 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C[N@H+](CCCCC(F)(F)F)C[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001267596664 1096120995 /nfs/dbraw/zinc/12/09/95/1096120995.db2.gz OKZCJGOLSBWIKZ-OAHLLOKOSA-N 1 3 349.441 2.595 10 0 EFAEHO C[N@@H+](CCCCC(F)(F)F)C[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001267596664 1096120998 /nfs/dbraw/zinc/12/09/98/1096120998.db2.gz OKZCJGOLSBWIKZ-OAHLLOKOSA-N 1 3 349.441 2.595 10 0 EFAEHO CCc1ccc(CN2CC[C@H](NC(=O)CCCC[NH+](C)C)C2)cc1 ZINC001481695478 1096326541 /nfs/dbraw/zinc/32/65/41/1096326541.db2.gz NZKDOUWKVMWUOM-IBGZPJMESA-N 1 3 331.504 2.671 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H](C)NC(=O)CN(C)C2CCC2)c(C)c1 ZINC001268371867 1096411020 /nfs/dbraw/zinc/41/10/20/1096411020.db2.gz FRXRGLJEFQCDBK-QGZVFWFLSA-N 1 3 331.504 2.772 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)[C@H]1CCN(Cc2ccc(C(C)(C)C)cc2)C1 ZINC001481740860 1096483610 /nfs/dbraw/zinc/48/36/10/1096483610.db2.gz TTZGMYAQLQIJLT-IBGZPJMESA-N 1 3 345.531 2.969 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccccc1C1CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001268400169 1096494155 /nfs/dbraw/zinc/49/41/55/1096494155.db2.gz SBTMEULIMWVKMH-SJORKVTESA-N 1 3 343.515 2.890 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1CC[C@H](N(C)C(=O)C(C)(C)c2c[nH]cn2)C1 ZINC001481746206 1096503146 /nfs/dbraw/zinc/50/31/46/1096503146.db2.gz BPYDOIPXZHFJLI-CVEARBPZSA-N 1 3 334.508 2.902 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1CC[C@H](N(C)C(=O)C(C)(C)c2c[nH]cn2)C1 ZINC001481746206 1096503151 /nfs/dbraw/zinc/50/31/51/1096503151.db2.gz BPYDOIPXZHFJLI-CVEARBPZSA-N 1 3 334.508 2.902 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc2ncccc2c1)N(C)C ZINC001268403190 1096505768 /nfs/dbraw/zinc/50/57/68/1096505768.db2.gz JBYWQKDEHSFBIF-KXBFYZLASA-N 1 3 342.487 2.559 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccsc1)NC(=O)CN(C)CC(C)(C)C ZINC001268403221 1096507507 /nfs/dbraw/zinc/50/75/07/1096507507.db2.gz JHZZXGMTBSUQLD-CQSZACIVSA-N 1 3 325.522 2.710 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1cc(C)ccc1F ZINC001268425184 1096584099 /nfs/dbraw/zinc/58/40/99/1096584099.db2.gz DAKXDBYWDFCGRK-QFBILLFUSA-N 1 3 349.494 2.993 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC(C)(C)C[NH2+]CC[C@H](C)F ZINC001282334793 1096590440 /nfs/dbraw/zinc/59/04/40/1096590440.db2.gz ILSFTMZBRGKYFW-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C2CC2)cc1)C(=O)[C@H]1CCCN1C ZINC001268438135 1096596759 /nfs/dbraw/zinc/59/67/59/1096596759.db2.gz DABZVTNXBWDNBL-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@H]1CCN([C@@H]2CCc3c2cccc3F)C1 ZINC001481774359 1096672808 /nfs/dbraw/zinc/67/28/08/1096672808.db2.gz JTUBOKVZHAFQMW-HNAYVOBHSA-N 1 3 347.478 2.688 10 0 EFAEHO CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@@H+](C(C)C)C1 ZINC001481775103 1096674362 /nfs/dbraw/zinc/67/43/62/1096674362.db2.gz RJGKNDWQPXLKKT-MAUKXSAKSA-N 1 3 327.488 2.530 10 0 EFAEHO CCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@H+](C(C)C)C1 ZINC001481775103 1096674368 /nfs/dbraw/zinc/67/43/68/1096674368.db2.gz RJGKNDWQPXLKKT-MAUKXSAKSA-N 1 3 327.488 2.530 10 0 EFAEHO CC[C@@H](CNC(=O)CC[NH+](C)C)N[C@@H](C)c1cccc(Cl)c1F ZINC001481848503 1096779149 /nfs/dbraw/zinc/77/91/49/1096779149.db2.gz ORTYSCORXCOVIN-STQMWFEESA-N 1 3 343.874 2.976 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(C)c(C)c1 ZINC001481850280 1096794639 /nfs/dbraw/zinc/79/46/39/1096794639.db2.gz JTBHGDLZIWZTIH-HNAYVOBHSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@@H](C(=O)N(CC)CC[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001268476460 1096881446 /nfs/dbraw/zinc/88/14/46/1096881446.db2.gz DWMZSCDBSJRMDA-GJZGRUSLSA-N 1 3 333.467 2.590 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(F)cc1C)C(=O)[C@@H](C(C)C)N(C)C ZINC001268477881 1096885845 /nfs/dbraw/zinc/88/58/45/1096885845.db2.gz YYIKNBCHGHCSRU-GOSISDBHSA-N 1 3 337.483 2.658 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](CC[NH2+]Cc2ccccc2)C1)N(C)C ZINC001481981173 1097036217 /nfs/dbraw/zinc/03/62/17/1097036217.db2.gz KZRGQFJKFNVDHH-RTBURBONSA-N 1 3 331.504 2.745 10 0 EFAEHO CC[C@H](F)C[NH2+]CC[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001481990547 1097055607 /nfs/dbraw/zinc/05/56/07/1097055607.db2.gz ZWWWZHMHMBYSBO-ROUUACIJSA-N 1 3 341.515 2.685 10 0 EFAEHO CC/C=C/CC[NH2+]CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001482003570 1097077309 /nfs/dbraw/zinc/07/73/09/1097077309.db2.gz GTQWGLPYNQTSSL-SHCNBLLESA-N 1 3 335.536 2.903 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCc2ccc(CNC/C=C\Cl)cc2)CC[N@@H+]1C ZINC001482031505 1097121317 /nfs/dbraw/zinc/12/13/17/1097121317.db2.gz PRQXNHOHOCHBLG-XZWWOTKMSA-N 1 3 349.906 2.875 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCc2ccc(CNC/C=C\Cl)cc2)CC[N@H+]1C ZINC001482031505 1097121320 /nfs/dbraw/zinc/12/13/20/1097121320.db2.gz PRQXNHOHOCHBLG-XZWWOTKMSA-N 1 3 349.906 2.875 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)[C@@H]2CCC[N@H+]2C(C)C)c(C)s1 ZINC001268541767 1097155181 /nfs/dbraw/zinc/15/51/81/1097155181.db2.gz LWWQCZUSKAUNIG-XFHJGTJQSA-N 1 3 349.544 3.000 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)[C@@H]2CCC[N@@H+]2C(C)C)c(C)s1 ZINC001268541767 1097155186 /nfs/dbraw/zinc/15/51/86/1097155186.db2.gz LWWQCZUSKAUNIG-XFHJGTJQSA-N 1 3 349.544 3.000 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001482059054 1097200549 /nfs/dbraw/zinc/20/05/49/1097200549.db2.gz YPYMBSBQQSRELI-ZIAGYGMSSA-N 1 3 348.318 2.760 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001482059054 1097200553 /nfs/dbraw/zinc/20/05/53/1097200553.db2.gz YPYMBSBQQSRELI-ZIAGYGMSSA-N 1 3 348.318 2.760 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001482065700 1097215412 /nfs/dbraw/zinc/21/54/12/1097215412.db2.gz OCUOONBMUKPAJD-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(CC[N@H+](CCCCCF)C2)CC1 ZINC001482071334 1097231594 /nfs/dbraw/zinc/23/15/94/1097231594.db2.gz SABNQTDFPIWKMO-UHFFFAOYSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(CC[N@@H+](CCCCCF)C2)CC1 ZINC001482071334 1097231598 /nfs/dbraw/zinc/23/15/98/1097231598.db2.gz SABNQTDFPIWKMO-UHFFFAOYSA-N 1 3 341.515 2.781 10 0 EFAEHO C[NH+](C)CCCC(=O)NC/C=C\CN[C@H]1CCc2ccc(Cl)cc21 ZINC001268583535 1097288037 /nfs/dbraw/zinc/28/80/37/1097288037.db2.gz FTAGINPHBCXIRZ-JXCVUKRWSA-N 1 3 349.906 2.931 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C\C[NH2+]Cc1ccc2ccccc2c1)N(C)C ZINC001268591890 1097315885 /nfs/dbraw/zinc/31/58/85/1097315885.db2.gz CVTMQRLXTKZGHO-AQWUKCDYSA-N 1 3 339.483 2.942 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C\C[NH2+]CC2CCC3(CC3)CC2)CC1 ZINC001268609420 1097457108 /nfs/dbraw/zinc/45/71/08/1097457108.db2.gz RPOHMXSZJCYREM-IHWYPQMZSA-N 1 3 347.547 2.951 10 0 EFAEHO Cc1cc(C[NH2+]C/C=C/CNC(=O)[C@H](C(C)C)N(C)C)c(C)s1 ZINC001268618489 1097468988 /nfs/dbraw/zinc/46/89/88/1097468988.db2.gz WRSOEIKHJSKXTG-OZSKJFCKSA-N 1 3 337.533 2.713 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\CNCc1ccc(Cl)s1)[NH+](C)C ZINC001268618464 1097469487 /nfs/dbraw/zinc/46/94/87/1097469487.db2.gz WGRMUBLIIWJQPW-IYKSTZQJSA-N 1 3 343.924 2.750 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]CCCc1ccccc1 ZINC001268674118 1097528188 /nfs/dbraw/zinc/52/81/88/1097528188.db2.gz PMWDKDDYUFYRQM-MJGOQNOKSA-N 1 3 331.504 2.588 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C[NH2+]CC[C@@H]1CCc2ccccc21)N(C)C ZINC001268704394 1097555219 /nfs/dbraw/zinc/55/52/19/1097555219.db2.gz AKKPNDYYONCMAD-IEZWGBDMSA-N 1 3 331.504 2.541 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CCCN(C)C(=O)CN(C)C2CCC2)c1 ZINC001268797075 1097646204 /nfs/dbraw/zinc/64/62/04/1097646204.db2.gz CQVAPXSWTMZGEG-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+][C@H](C)c1ccc(F)c(F)c1)N(C)C ZINC001268799945 1097647168 /nfs/dbraw/zinc/64/71/68/1097647168.db2.gz IVNQTBYJVDJERK-CXAGYDPISA-N 1 3 341.446 2.804 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[NH2+][C@@H]2CCc3ccccc32)CC1 ZINC001268893715 1097706558 /nfs/dbraw/zinc/70/65/58/1097706558.db2.gz FJRAEUBJLCJUCQ-HXUWFJFHSA-N 1 3 343.515 2.844 10 0 EFAEHO Cc1cc(C)cc(CN2CC(CNC(=O)CCCC[NH+](C)C)C2)c1 ZINC001268896183 1097707358 /nfs/dbraw/zinc/70/73/58/1097707358.db2.gz LMNTYFBTQCIQIA-UHFFFAOYSA-N 1 3 331.504 2.583 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[NH2+]Cc1ccc(C)cc1 ZINC001268959315 1097749316 /nfs/dbraw/zinc/74/93/16/1097749316.db2.gz YDDRGPQDRHBXHY-IBGZPJMESA-N 1 3 331.504 2.808 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1C[C@@H]2C[C@H]1CN2CCCc1ccccc1 ZINC001268979208 1097766922 /nfs/dbraw/zinc/76/69/22/1097766922.db2.gz ZRKZZQUZQREAHJ-PMACEKPBSA-N 1 3 343.515 2.636 10 0 EFAEHO CCC/C=C\CCN1C[C@@H]2C[C@H]1CN2C(=O)CC[NH+]1CCCCC1 ZINC001268989088 1097775308 /nfs/dbraw/zinc/77/53/08/1097775308.db2.gz ZDNAGNXFAIANIO-DHJFXDNESA-N 1 3 333.520 2.894 10 0 EFAEHO C[C@@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@@H]1C[NH2+]CCC1CCCC1 ZINC001279114566 1097779162 /nfs/dbraw/zinc/77/91/62/1097779162.db2.gz SJLJPVISWBIZJY-AEFFLSMTSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N(C)[C@H]1CC[N@H+](CCCCCF)C1 ZINC001269240422 1097976281 /nfs/dbraw/zinc/97/62/81/1097976281.db2.gz LDEUUEDIPOFDGC-DLBZAZTESA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N(C)[C@H]1CC[N@@H+](CCCCCF)C1 ZINC001269240422 1097976284 /nfs/dbraw/zinc/97/62/84/1097976284.db2.gz LDEUUEDIPOFDGC-DLBZAZTESA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NCC2([NH2+]CCCF)CCCC2)C1 ZINC001482230300 1098234695 /nfs/dbraw/zinc/23/46/95/1098234695.db2.gz PGEVRXQQBDAZJA-SFHVURJKSA-N 1 3 345.478 2.577 10 0 EFAEHO CC(C)C[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CCCC1 ZINC001482230317 1098235088 /nfs/dbraw/zinc/23/50/88/1098235088.db2.gz PZKXNOIUKJHGQN-IBGZPJMESA-N 1 3 341.515 2.874 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+]Cc2cc(C)ccc2F)CCCC1 ZINC001482237172 1098353046 /nfs/dbraw/zinc/35/30/46/1098353046.db2.gz VLTILYAEMMTSDF-UHFFFAOYSA-N 1 3 349.494 2.995 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269742169 1098417121 /nfs/dbraw/zinc/41/71/21/1098417121.db2.gz QUPXOBOJWIVWAW-YDFHMDALSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269742169 1098417123 /nfs/dbraw/zinc/41/71/23/1098417123.db2.gz QUPXOBOJWIVWAW-YDFHMDALSA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)cc1 ZINC001269770371 1098436293 /nfs/dbraw/zinc/43/62/93/1098436293.db2.gz KPFBZAJUOIDWNK-GOSISDBHSA-N 1 3 340.471 2.679 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](CC[NH2+]Cc2ccsc2)C1 ZINC001269792273 1098448469 /nfs/dbraw/zinc/44/84/69/1098448469.db2.gz SBZABZXUBMHGLO-MRXNPFEDSA-N 1 3 337.533 2.808 10 0 EFAEHO Cc1cc(C[NH2+]CCC2CCN(C(=O)[C@@H]3CCCN3C)CC2)cs1 ZINC001269837025 1098470699 /nfs/dbraw/zinc/47/06/99/1098470699.db2.gz AYYHOMXSEXAXCP-SFHVURJKSA-N 1 3 349.544 2.869 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC[NH2+]CCC(C)(C)C)CC1)N(C)C ZINC001269907644 1098513372 /nfs/dbraw/zinc/51/33/72/1098513372.db2.gz DXYVZSHCXYFAQS-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC1CC(C[NH2+]CCC2CCN(C(=O)CN3CCC(C)CC3)CC2)C1 ZINC001269920132 1098523000 /nfs/dbraw/zinc/52/30/00/1098523000.db2.gz MIYKOGQUZWWAJZ-UHFFFAOYSA-N 1 3 349.563 2.983 10 0 EFAEHO Cc1ccccc1C[NH2+]CCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001481279556 1098604878 /nfs/dbraw/zinc/60/48/78/1098604878.db2.gz JGAFMABGQYGPEW-HXUWFJFHSA-N 1 3 349.494 2.756 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C(=O)[C@H]1CCCN1C ZINC001482265468 1098700745 /nfs/dbraw/zinc/70/07/45/1098700745.db2.gz HHKKPZCXDDXLNU-OXJNMPFZSA-N 1 3 343.515 2.985 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H]2CCCN2C(=O)[C@@H](C(C)C)N(C)C)cc1 ZINC001270173241 1098762124 /nfs/dbraw/zinc/76/21/24/1098762124.db2.gz AJYGAJYYAKKWGH-VQTJNVASSA-N 1 3 345.531 2.704 10 0 EFAEHO O=C(CN1CCCC1)N1CCC[C@H]1C[NH2+]CCc1ccccc1Cl ZINC001270188941 1098779831 /nfs/dbraw/zinc/77/98/31/1098779831.db2.gz UYFFKRRARWOBAH-KRWDZBQOSA-N 1 3 349.906 2.559 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H]2CCCN2C(=O)CN(C)C2CCC2)cc1 ZINC001270222498 1098820400 /nfs/dbraw/zinc/82/04/00/1098820400.db2.gz XVYRDBVMFNLLQK-HXUWFJFHSA-N 1 3 343.515 2.602 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H]2C[NH2+]CCC2=CCCCC2)C1 ZINC001270263882 1098878631 /nfs/dbraw/zinc/87/86/31/1098878631.db2.gz ZVZHWFFELXCMII-PKOBYXMFSA-N 1 3 333.520 2.799 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H]2C[NH2+]CCC2CCCCC2)C1 ZINC001270263555 1098879792 /nfs/dbraw/zinc/87/97/92/1098879792.db2.gz PITRQHOBEWHCBN-PKOBYXMFSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccncc1CN1CCC(C)(NC(=O)CCCC[NH+](C)C)CC1 ZINC001270260600 1098880936 /nfs/dbraw/zinc/88/09/36/1098880936.db2.gz CWHGLSLXZFSFNM-UHFFFAOYSA-N 1 3 346.519 2.593 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@@H]2C[NH2+]CCCc2ccsc2)CCC1 ZINC001267957496 1098892569 /nfs/dbraw/zinc/89/25/69/1098892569.db2.gz BLGTXOOZKYUZNT-QGZVFWFLSA-N 1 3 349.544 2.746 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H]1C[NH2+]CC[C@@H]1CCCC1(F)F)N(C)C ZINC001267963213 1098945135 /nfs/dbraw/zinc/94/51/35/1098945135.db2.gz JOUNQPKIEMDYDC-XHSDSOJGSA-N 1 3 345.478 2.733 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC2(C1)CCN(C(=O)[C@H](CC)N(C)C)CC2 ZINC001270339178 1098981267 /nfs/dbraw/zinc/98/12/67/1098981267.db2.gz CBGMHTMWFNWICV-DVBCCOPCSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC2(C1)CCN(C(=O)[C@H](CC)N(C)C)CC2 ZINC001270339178 1098981273 /nfs/dbraw/zinc/98/12/73/1098981273.db2.gz CBGMHTMWFNWICV-DVBCCOPCSA-N 1 3 335.536 2.997 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]CC1CCC2(CC2)CC1 ZINC001481319783 1099277534 /nfs/dbraw/zinc/27/75/34/1099277534.db2.gz NNPJTTFXGDYZDQ-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H](C(=O)N[C@]1(C)CC[N@H+](CCCCCF)C1)N1CCCCCC1 ZINC001270633274 1099331147 /nfs/dbraw/zinc/33/11/47/1099331147.db2.gz RRYFPKLBVHDLPQ-IEBWSBKVSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@H](C(=O)N[C@]1(C)CC[N@@H+](CCCCCF)C1)N1CCCCCC1 ZINC001270633274 1099331159 /nfs/dbraw/zinc/33/11/59/1099331159.db2.gz RRYFPKLBVHDLPQ-IEBWSBKVSA-N 1 3 341.515 2.971 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC([C@@H](C)[NH2+]CCC2CC2)CC1 ZINC001481341908 1099375756 /nfs/dbraw/zinc/37/57/56/1099375756.db2.gz BHITYWDOJCXLKW-VQIMIIECSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC([C@@H](C)[NH2+]CCC2CC2)CC1 ZINC001481341901 1099376483 /nfs/dbraw/zinc/37/64/83/1099376483.db2.gz BHITYWDOJCXLKW-APWZRJJASA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H]([NH2+]CCCF)C1CCN(C(=O)c2cccc(CN(C)C)c2)CC1 ZINC001481343728 1099388873 /nfs/dbraw/zinc/38/88/73/1099388873.db2.gz QMZPSKARPFQVJO-MRXNPFEDSA-N 1 3 349.494 2.938 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]CCCc2ccccc2)C1)N(C)C ZINC001270745106 1099518295 /nfs/dbraw/zinc/51/82/95/1099518295.db2.gz UXZKYFOSJCJWDX-TZIWHRDSSA-N 1 3 345.531 2.788 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001270796646 1099569057 /nfs/dbraw/zinc/56/90/57/1099569057.db2.gz IHFVEQYDHNWEPQ-QAPCUYQASA-N 1 3 329.504 2.541 10 0 EFAEHO CCCN(C(=O)CC1CC[NH+](C)CC1)[C@@H]1CCN(CC=C(C)C)C1 ZINC001481406372 1099656105 /nfs/dbraw/zinc/65/61/05/1099656105.db2.gz IARVVCZTPIHLLB-LJQANCHMSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+]CCCF)CCCC1)N1CCCCC1 ZINC001270826674 1099667365 /nfs/dbraw/zinc/66/73/65/1099667365.db2.gz SXNCWWSXYHTXSY-KRWDZBQOSA-N 1 3 341.515 2.875 10 0 EFAEHO CC(C)CCC[NH2+]C[C@@]1(C)CCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001270829269 1099677698 /nfs/dbraw/zinc/67/76/98/1099677698.db2.gz KYUOVSYBWBSCIM-IEBWSBKVSA-N 1 3 325.541 2.837 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@H](C(=O)NCCCN2CCc3ccccc3C2)C1 ZINC001625490106 1099817450 /nfs/dbraw/zinc/81/74/50/1099817450.db2.gz YJSHWAJXKZMRGY-ICSRJNTNSA-N 1 3 343.515 2.671 10 0 EFAEHO C[C@H](C[NH2+][C@H](C)c1ccccc1Cl)N(C)C(=O)CN1CCCC1 ZINC001482364239 1099843772 /nfs/dbraw/zinc/84/37/72/1099843772.db2.gz FHBMUUHDAIQPMZ-HUUCEWRRSA-N 1 3 337.895 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+][C@H]1CCCc2ccccc21 ZINC001482368940 1099870368 /nfs/dbraw/zinc/87/03/68/1099870368.db2.gz JUTPYOKTIKPSKK-LPHOPBHVSA-N 1 3 331.504 2.841 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@H]1CC[NH2+]CC=C(Cl)Cl ZINC001482453730 1100448921 /nfs/dbraw/zinc/44/89/21/1100448921.db2.gz CWPFHFGDZFAPEZ-UONOGXRCSA-N 1 3 348.318 2.760 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@H]1CC[NH2+]Cc1cccc(F)c1 ZINC001482454772 1100455526 /nfs/dbraw/zinc/45/55/26/1100455526.db2.gz HUDRYTXYIATBRP-RBUKOAKNSA-N 1 3 347.478 2.781 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H](C)C[NH2+]CCC1CCCCC1)N(C)C ZINC001271090869 1100463839 /nfs/dbraw/zinc/46/38/39/1100463839.db2.gz BVJBGQUJACSKFV-FUHWJXTLSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001271094622 1100475856 /nfs/dbraw/zinc/47/58/56/1100475856.db2.gz YCRVBHLDIVPSDJ-HUUCEWRRSA-N 1 3 333.467 2.590 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001271094622 1100475858 /nfs/dbraw/zinc/47/58/58/1100475858.db2.gz YCRVBHLDIVPSDJ-HUUCEWRRSA-N 1 3 333.467 2.590 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@H]1CN(CC2=CCCCC2)CCC1(F)F ZINC001271100895 1100481505 /nfs/dbraw/zinc/48/15/05/1100481505.db2.gz OGUQGXBIYPWCBA-MRXNPFEDSA-N 1 3 343.462 2.512 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1CC[NH2+]CCC(F)(F)F ZINC001482463133 1100634483 /nfs/dbraw/zinc/63/44/83/1100634483.db2.gz PXSAFSHDPGHOEZ-AWEZNQCLSA-N 1 3 337.430 2.641 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)c1ccc(NC2=NCCC2)cc1 ZINC001640747360 1101075037 /nfs/dbraw/zinc/07/50/37/1101075037.db2.gz WHVXAVORWUUXMC-UHFFFAOYSA-N 1 3 330.476 2.999 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)c1ccc(NC2=NCCC2)cc1 ZINC001640747360 1101075046 /nfs/dbraw/zinc/07/50/46/1101075046.db2.gz WHVXAVORWUUXMC-UHFFFAOYSA-N 1 3 330.476 2.999 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001266599300 1101344386 /nfs/dbraw/zinc/34/43/86/1101344386.db2.gz FYSRSRZSTYWUHD-UFYCRDLUSA-N 1 3 345.531 2.751 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]CCCF)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001271295851 1101347572 /nfs/dbraw/zinc/34/75/72/1101347572.db2.gz YILZWSWAXSNQPE-MAUKXSAKSA-N 1 3 347.494 2.679 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001266341631 1101608571 /nfs/dbraw/zinc/60/85/71/1101608571.db2.gz LBGMDUDJBMDZHR-MAUKXSAKSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCCC[N@H+]1CC[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001266341631 1101608576 /nfs/dbraw/zinc/60/85/76/1101608576.db2.gz LBGMDUDJBMDZHR-MAUKXSAKSA-N 1 3 327.488 2.580 10 0 EFAEHO CN(CC[NH2+]Cc1ccc(C(C)(C)C)cc1)C(=O)[C@@H]1CCCN1C ZINC001266660991 1101705304 /nfs/dbraw/zinc/70/53/04/1101705304.db2.gz ZEVNAKVVZQUOPF-SFHVURJKSA-N 1 3 331.504 2.626 10 0 EFAEHO CO[C@@H]1CCOC[C@H]1[NH2+]CCCN1CCC(Cc2ccccc2)CC1 ZINC001655695708 1101872782 /nfs/dbraw/zinc/87/27/82/1101872782.db2.gz MDMKCEUFJUMGPM-NHCUHLMSSA-N 1 3 346.515 2.725 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@H]1CCCCN1C(=O)[C@H]1CCCN1C ZINC001271567272 1102125644 /nfs/dbraw/zinc/12/56/44/1102125644.db2.gz WXVMBODAIQZSGE-WOJBJXKFSA-N 1 3 343.515 2.950 10 0 EFAEHO CCCCC[N@H+](C)C[C@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001266466341 1102186112 /nfs/dbraw/zinc/18/61/12/1102186112.db2.gz MRZWCRJIOGAMLC-QZTJIDSGSA-N 1 3 325.541 2.933 10 0 EFAEHO CCCCC[N@@H+](C)C[C@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001266466341 1102186115 /nfs/dbraw/zinc/18/61/15/1102186115.db2.gz MRZWCRJIOGAMLC-QZTJIDSGSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCCCC[C@@H]([NH2+]CCCF)C1 ZINC001656903012 1102251122 /nfs/dbraw/zinc/25/11/22/1102251122.db2.gz BMYOVNUWAQXDHQ-QZTJIDSGSA-N 1 3 341.515 2.970 10 0 EFAEHO Cc1cccc([C@@H](C)N(C)CCNC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001480876261 1102251325 /nfs/dbraw/zinc/25/13/25/1102251325.db2.gz RZJUZENLXGLXKN-MJGOQNOKSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1cccc([C@@H](C)N(C)CCNC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001480876261 1102251340 /nfs/dbraw/zinc/25/13/40/1102251340.db2.gz RZJUZENLXGLXKN-MJGOQNOKSA-N 1 3 331.504 2.978 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]CCCC(C)(C)C)C1 ZINC001271700871 1102259121 /nfs/dbraw/zinc/25/91/21/1102259121.db2.gz UPSHUYJXRTZRFO-IRXDYDNUSA-N 1 3 325.541 2.839 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H](C[NH2+]CCCC3CCC3)C2)C1 ZINC001266807493 1102292242 /nfs/dbraw/zinc/29/22/42/1102292242.db2.gz MFZDQLHDRLBJAR-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO CC/C=C\CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCC[NH+]1CCCC1 ZINC001266501918 1102306343 /nfs/dbraw/zinc/30/63/43/1102306343.db2.gz OMIOWBBQFXVOJE-FANKGXDISA-N 1 3 333.520 2.894 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]CCCc2ccccc2)C1 ZINC001271721172 1102310978 /nfs/dbraw/zinc/31/09/78/1102310978.db2.gz KNVHZKCSMDVFJR-ICSRJNTNSA-N 1 3 345.531 2.644 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC[C@@H](C[NH2+]C/C=C/Cl)C2)c1 ZINC001266823316 1102355196 /nfs/dbraw/zinc/35/51/96/1102355196.db2.gz OTDVQHVSIFGHOO-MPNRVQBSSA-N 1 3 349.906 2.943 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)C12CCC[NH+](CCC1)C2 ZINC001480879412 1102357004 /nfs/dbraw/zinc/35/70/04/1102357004.db2.gz LRVOXLJQLPYOIM-UHFFFAOYSA-N 1 3 343.515 2.673 10 0 EFAEHO C[N@@H+]1CC[C@H](NCc2ccc(C(=O)N3CCCC3)cc2)[C@@H]2CCC[C@@H]21 ZINC000796715433 1102432535 /nfs/dbraw/zinc/43/25/35/1102432535.db2.gz HWWNFILUFFNUBN-UFYCRDLUSA-N 1 3 341.499 2.885 10 0 EFAEHO C[N@H+]1CC[C@H](NCc2ccc(C(=O)N3CCCC3)cc2)[C@@H]2CCC[C@@H]21 ZINC000796715433 1102432541 /nfs/dbraw/zinc/43/25/41/1102432541.db2.gz HWWNFILUFFNUBN-UFYCRDLUSA-N 1 3 341.499 2.885 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccc(C(=O)N3CCCC3)cc2)[C@@H]2CCC[C@@H]21 ZINC000796715433 1102432547 /nfs/dbraw/zinc/43/25/47/1102432547.db2.gz HWWNFILUFFNUBN-UFYCRDLUSA-N 1 3 341.499 2.885 10 0 EFAEHO Cc1ccc(CN(C)CCCNC(=O)C(C)(C)[NH+]2CCCC2)c(C)n1 ZINC001660254830 1102657392 /nfs/dbraw/zinc/65/73/92/1102657392.db2.gz ZCRMHTFFOXHSQG-UHFFFAOYSA-N 1 3 346.519 2.511 10 0 EFAEHO CC(C)[C@H](C(=O)NCCCN(C)[C@@H](C)c1ccccc1F)[NH+](C)C ZINC001660295791 1102675703 /nfs/dbraw/zinc/67/57/03/1102675703.db2.gz YXQFKZNCSGSSJP-MAUKXSAKSA-N 1 3 337.483 2.911 10 0 EFAEHO CC1CC(C[N@H+](C)CCCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001660304372 1102679736 /nfs/dbraw/zinc/67/97/36/1102679736.db2.gz ZFLNGBOGMGDJFV-RJYAGPCLSA-N 1 3 341.515 2.683 10 0 EFAEHO CC1CC(C[N@@H+](C)CCCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001660304372 1102679739 /nfs/dbraw/zinc/67/97/39/1102679739.db2.gz ZFLNGBOGMGDJFV-RJYAGPCLSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NC2CCC([NH2+]CCCF)CC2)C1 ZINC001266913623 1102679909 /nfs/dbraw/zinc/67/99/09/1102679909.db2.gz MRJHHNDIIPYRCC-JTTJXQCZSA-N 1 3 345.478 2.576 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1cc(C)cc(C)c1 ZINC001660590009 1102870238 /nfs/dbraw/zinc/87/02/38/1102870238.db2.gz UJUQTLLMGJFGIK-KRWDZBQOSA-N 1 3 345.531 2.973 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1cc(C)cc(C)c1 ZINC001660590009 1102870259 /nfs/dbraw/zinc/87/02/59/1102870259.db2.gz UJUQTLLMGJFGIK-KRWDZBQOSA-N 1 3 345.531 2.973 10 0 EFAEHO CCC/C=C\CC[N@H+]1C[C@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@H]2C1 ZINC001271861715 1102942998 /nfs/dbraw/zinc/94/29/98/1102942998.db2.gz ZDHGCJXTJIMQBL-QHHIFSJYSA-N 1 3 333.520 2.607 10 0 EFAEHO CCC/C=C\CC[N@@H+]1C[C@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@H]2C1 ZINC001271861715 1102943006 /nfs/dbraw/zinc/94/30/06/1102943006.db2.gz ZDHGCJXTJIMQBL-QHHIFSJYSA-N 1 3 333.520 2.607 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC001660749452 1102958663 /nfs/dbraw/zinc/95/86/63/1102958663.db2.gz NTXKLERBTWSRHB-MRXNPFEDSA-N 1 3 340.471 2.993 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+]([C@H](C)c1ccccc1)C1CC1 ZINC001660749452 1102958671 /nfs/dbraw/zinc/95/86/71/1102958671.db2.gz NTXKLERBTWSRHB-MRXNPFEDSA-N 1 3 340.471 2.993 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(C[C@@H]2NC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001661073143 1103114632 /nfs/dbraw/zinc/11/46/32/1103114632.db2.gz MAJNVMCSGDPCJF-KKSLTYSGSA-N 1 3 333.520 2.655 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]CCc1ccc2ccccc2c1)N(C)C ZINC001483241053 1103129296 /nfs/dbraw/zinc/12/92/96/1103129296.db2.gz XNPUVZPMGOLTLQ-OXJNMPFZSA-N 1 3 341.499 2.817 10 0 EFAEHO C[C@@H](C[NH2+]CCC1CCCC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001483266051 1103192383 /nfs/dbraw/zinc/19/23/83/1103192383.db2.gz CJQUOKDWQZIYFO-HNAYVOBHSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H]([NH2+]CCCc2ccc(C)cc2)C1)N(C)C ZINC001661473616 1103276806 /nfs/dbraw/zinc/27/68/06/1103276806.db2.gz MSIUSZCAPFGFDM-FHWLQOOXSA-N 1 3 331.504 2.505 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1C[C@H]([NH2+]CCCCc2ccccc2)C1 ZINC001661497323 1103282359 /nfs/dbraw/zinc/28/23/59/1103282359.db2.gz ANDNYSFDGHZNPJ-IYARVYRRSA-N 1 3 340.471 2.520 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc(F)cc1C ZINC001483297189 1103282629 /nfs/dbraw/zinc/28/26/29/1103282629.db2.gz ZXALLIHTCWVHSO-MAUKXSAKSA-N 1 3 335.467 2.603 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc(C)c(F)c1 ZINC001483296319 1103292799 /nfs/dbraw/zinc/29/27/99/1103292799.db2.gz DCTLYMLQMNGILD-MAUKXSAKSA-N 1 3 335.467 2.603 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001661554529 1103310732 /nfs/dbraw/zinc/31/07/32/1103310732.db2.gz CHVMFHZXGYYOEL-MUURBNQUSA-N 1 3 330.476 2.621 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001661554529 1103310749 /nfs/dbraw/zinc/31/07/49/1103310749.db2.gz CHVMFHZXGYYOEL-MUURBNQUSA-N 1 3 330.476 2.621 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@@H]2CN(C/C=C/Cl)CC[C@H]21 ZINC001661554881 1103316877 /nfs/dbraw/zinc/31/68/77/1103316877.db2.gz HPTOJIARLQYYDD-DTIZEGCPSA-N 1 3 341.927 2.784 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H]1C[C@@H]([NH2+]CCCCCF)C1 ZINC001661661286 1103352183 /nfs/dbraw/zinc/35/21/83/1103352183.db2.gz 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/nfs/dbraw/zinc/37/77/48/1104377748.db2.gz RYVBBYJPXPVDPX-DLENHJPASA-N 1 3 329.488 2.622 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]Cc1ccc(C)c(F)c1 ZINC001664395237 1104378347 /nfs/dbraw/zinc/37/83/47/1104378347.db2.gz NGWFCPJCGIVYQK-SFHVURJKSA-N 1 3 335.467 2.557 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H](C)[N@H+](C)Cc1c(C)cc(C)cc1C)N(C)C ZINC001409612081 1104503775 /nfs/dbraw/zinc/50/37/75/1104503775.db2.gz BTAUIZKYRAXHDQ-HKUYNNGSSA-N 1 3 333.520 2.889 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H](C)[N@@H+](C)Cc1c(C)cc(C)cc1C)N(C)C ZINC001409612081 1104503782 /nfs/dbraw/zinc/50/37/82/1104503782.db2.gz BTAUIZKYRAXHDQ-HKUYNNGSSA-N 1 3 333.520 2.889 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2CC[N@H+](CC3=CCCCC3)C2)C1 ZINC001664740032 1104531134 /nfs/dbraw/zinc/53/11/34/1104531134.db2.gz DQVQEIADWDDOAU-MJGOQNOKSA-N 1 3 333.520 2.657 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2CC[N@@H+](CC3=CCCCC3)C2)C1 ZINC001664740032 1104531142 /nfs/dbraw/zinc/53/11/42/1104531142.db2.gz DQVQEIADWDDOAU-MJGOQNOKSA-N 1 3 333.520 2.657 10 0 EFAEHO C[N@H+](CCC1=CCCCC1)C[C@@H]1CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001664842851 1104572732 /nfs/dbraw/zinc/57/27/32/1104572732.db2.gz WWMYVFBGAKOPNU-KRWDZBQOSA-N 1 3 330.476 2.623 10 0 EFAEHO C[N@@H+](CCC1=CCCCC1)C[C@@H]1CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001664842851 1104572736 /nfs/dbraw/zinc/57/27/36/1104572736.db2.gz WWMYVFBGAKOPNU-KRWDZBQOSA-N 1 3 330.476 2.623 10 0 EFAEHO CC/C=C\CC[N@H+](C)C[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001664848602 1104575120 /nfs/dbraw/zinc/57/51/20/1104575120.db2.gz HBSQBGSJECWXPH-VOFKWLDRSA-N 1 3 335.536 2.855 10 0 EFAEHO CC/C=C\CC[N@@H+](C)C[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001664848602 1104575124 /nfs/dbraw/zinc/57/51/24/1104575124.db2.gz HBSQBGSJECWXPH-VOFKWLDRSA-N 1 3 335.536 2.855 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)N(C)Cc1ccc(C2CCC2)cc1 ZINC001409678955 1104641616 /nfs/dbraw/zinc/64/16/16/1104641616.db2.gz JYBQMQDDUSSWAG-OXJNMPFZSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(C2CCC2)cc1 ZINC001409678955 1104641624 /nfs/dbraw/zinc/64/16/24/1104641624.db2.gz JYBQMQDDUSSWAG-OXJNMPFZSA-N 1 3 343.515 2.842 10 0 EFAEHO O=C(NCC1CN(CCCCCF)C1)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001665292945 1104661811 /nfs/dbraw/zinc/66/18/11/1104661811.db2.gz FWHRXWFLJYNXNV-GOSISDBHSA-N 1 3 339.499 2.581 10 0 EFAEHO O=C(NCC1CN(CCCCCF)C1)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001665292945 1104661815 /nfs/dbraw/zinc/66/18/15/1104661815.db2.gz FWHRXWFLJYNXNV-GOSISDBHSA-N 1 3 339.499 2.581 10 0 EFAEHO CCCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccccc1CC[NH+](C)C ZINC001665405505 1104686013 /nfs/dbraw/zinc/68/60/13/1104686013.db2.gz IPIUYAFPYBOTRH-OALUTQOASA-N 1 3 343.515 2.880 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](CC[NH2+]Cc2ccsc2)C1)N(C)C ZINC001666119898 1104873241 /nfs/dbraw/zinc/87/32/41/1104873241.db2.gz JCAQTDAEDFGORC-DOTOQJQBSA-N 1 3 337.533 2.807 10 0 EFAEHO C[C@@H](F)CC[NH2+]CCC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001666252834 1104912642 /nfs/dbraw/zinc/91/26/42/1104912642.db2.gz NBAWQBRBZDDDTP-QGZVFWFLSA-N 1 3 341.515 2.685 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CCC[C@H]1C[NH2+]CCC(F)(F)F)N1CCCC1 ZINC001482684057 1104922530 /nfs/dbraw/zinc/92/25/30/1104922530.db2.gz KVAQBRVOKXDNLY-KBPBESRZSA-N 1 3 349.441 2.688 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CCC[C@H]1C[NH2+]CCC(F)(F)F)N1CCCC1 ZINC001482684073 1104922801 /nfs/dbraw/zinc/92/28/01/1104922801.db2.gz KVAQBRVOKXDNLY-UONOGXRCSA-N 1 3 349.441 2.688 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@@H]1C[NH2+]CC/C=C/c1ccccc1 ZINC001666462751 1104946479 /nfs/dbraw/zinc/94/64/79/1104946479.db2.gz RJPHNZGIMJTNOH-ROSSNEFBSA-N 1 3 338.455 2.636 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@@H]1CCC[C@H]1NC(=O)CN(C)C(C)C ZINC001482698765 1104956222 /nfs/dbraw/zinc/95/62/22/1104956222.db2.gz MYOANPSCXYBANB-PKOBYXMFSA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C[NH2+]CCC(C)(C)C ZINC001666619581 1104970886 /nfs/dbraw/zinc/97/08/86/1104970886.db2.gz GMZLWLLHCZRTID-BEFAXECRSA-N 1 3 343.531 2.977 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(C[NH+](CC3=CCCCC3)C2)CC1 ZINC001666839018 1105005332 /nfs/dbraw/zinc/00/53/32/1105005332.db2.gz XWTXDUOLOOKKQX-UHFFFAOYSA-N 1 3 333.520 2.751 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H](C)N(C)C(=O)CN2CCC(C)CC2)cc1 ZINC001667017737 1105036578 /nfs/dbraw/zinc/03/65/78/1105036578.db2.gz FQQSIIVVQLKHNH-LJQANCHMSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@H](CCNCc1c(Cl)cccc1Cl)NC(=O)CC[NH+](C)C ZINC001482868882 1105119653 /nfs/dbraw/zinc/11/96/53/1105119653.db2.gz YLENAUIPPXJOLC-GFCCVEGCSA-N 1 3 346.302 2.930 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001482870818 1105120893 /nfs/dbraw/zinc/12/08/93/1105120893.db2.gz HFNXEWBVLVECFL-DLBZAZTESA-N 1 3 331.504 2.575 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+]Cc1cccc(Cl)c1 ZINC001482901712 1105146030 /nfs/dbraw/zinc/14/60/30/1105146030.db2.gz LNUBEBUVTUPPBX-AWEZNQCLSA-N 1 3 325.884 2.665 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CC[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001482889257 1105147535 /nfs/dbraw/zinc/14/75/35/1105147535.db2.gz PJHYLUOIBSRZRR-GDBMZVCRSA-N 1 3 347.494 2.883 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@@H]2C[NH2+]CCCC2CCC2)CCC1 ZINC001667726115 1105188480 /nfs/dbraw/zinc/18/84/80/1105188480.db2.gz DKLLCKNJHVMTES-QZTJIDSGSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@H]2C[NH2+]CCCC2CCC2)CCC1 ZINC001667726116 1105188720 /nfs/dbraw/zinc/18/87/20/1105188720.db2.gz DKLLCKNJHVMTES-ROUUACIJSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccccc1)NC(=O)C(C)(C)N1CCCCC1 ZINC001668059423 1105227893 /nfs/dbraw/zinc/22/78/93/1105227893.db2.gz GHZSJSVHQTVKOC-KRWDZBQOSA-N 1 3 331.504 2.936 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001668087849 1105233600 /nfs/dbraw/zinc/23/36/00/1105233600.db2.gz SDKDWIQDKJWJKF-INIZCTEOSA-N 1 3 331.504 2.718 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]CCc1ccccc1 ZINC001668234277 1105263257 /nfs/dbraw/zinc/26/32/57/1105263257.db2.gz HJPWYLFEJIURKE-AZUAARDMSA-N 1 3 345.531 2.976 10 0 EFAEHO CCN(CC[NH2+]Cc1csc(C)c1)C(=O)CN(C)CC(C)(C)C ZINC001668555114 1105319736 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Cc1cc(CNC/C=C/CNC(=O)C23CCC[NH+](CCC2)C3)cs1 ZINC001483021888 1105572986 /nfs/dbraw/zinc/57/29/86/1105572986.db2.gz DZWPQUDKDLPFPO-NSCUHMNNSA-N 1 3 347.528 2.695 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[NH2+]C[C@H]2CCCC(F)(F)C2)CCC1 ZINC001670123687 1105583253 /nfs/dbraw/zinc/58/32/53/1105583253.db2.gz AZIJEZZFAJFBHQ-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CCCN(C)C(=O)CN1CCC(C)CC1 ZINC001670291244 1105611155 /nfs/dbraw/zinc/61/11/55/1105611155.db2.gz FIFJIBNMHUTHQS-UHFFFAOYSA-N 1 3 345.531 2.973 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC1(C)CC[NH+](CC=C(C)C)CC1 ZINC001671415642 1105633833 /nfs/dbraw/zinc/63/38/33/1105633833.db2.gz PJHQJDBSRBZRNX-MRXNPFEDSA-N 1 3 327.488 2.603 10 0 EFAEHO CCC/C=C/CC[NH+]1CCC(C)(NC(=O)Cc2nc[nH]c2C)CC1 ZINC001671437332 1105636897 /nfs/dbraw/zinc/63/68/97/1105636897.db2.gz RSPLBXRIYBDLBS-VOTSOKGWSA-N 1 3 332.492 2.978 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C[NH2+]C/C=C/Cl)C1CCCC1 ZINC001671530545 1105652155 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1106200242 /nfs/dbraw/zinc/20/02/42/1106200242.db2.gz SBMWAODXTSMGDA-MGBKSAOESA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@H+](C)C[C@@H]1CCCN1C(=O)CN1CC[C@H](C)C1 ZINC001674481299 1106200666 /nfs/dbraw/zinc/20/06/66/1106200666.db2.gz SBMWAODXTSMGDA-RJCMGOLDSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@@H+](C)C[C@@H]1CCCN1C(=O)CN1CC[C@H](C)C1 ZINC001674481299 1106200670 /nfs/dbraw/zinc/20/06/70/1106200670.db2.gz SBMWAODXTSMGDA-RJCMGOLDSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC2CC(C[NH2+]CCCc3ccsc3)C2)C1 ZINC001674579247 1106218599 /nfs/dbraw/zinc/21/85/99/1106218599.db2.gz UWKWEMNDIYSLMV-FAEJEUNOSA-N 1 3 349.544 2.507 10 0 EFAEHO C[C@@H]1CCCC[C@H]1[NH+]1CCC(NCCc2cccc(C(N)=O)c2)CC1 ZINC000089545547 1106302290 /nfs/dbraw/zinc/30/22/90/1106302290.db2.gz FBLOGIUKGAYUMZ-OXQOHEQNSA-N 1 3 343.515 2.961 10 0 EFAEHO CN(CC(=O)NC1(C[NH2+]CCCF)CCCCC1)CC(C)(C)C ZINC001675201974 1106315730 /nfs/dbraw/zinc/31/57/30/1106315730.db2.gz SLETVMJXIXRVGW-UHFFFAOYSA-N 1 3 329.504 2.733 10 0 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2.799 10 0 EFAEHO CN(C)C1(C(=O)NCC2=CC[N@@H+](CC3CC4(CCC4)C3)CC2)CCC1 ZINC001677570416 1106747382 /nfs/dbraw/zinc/74/73/82/1106747382.db2.gz HKINFEHAMOJMKP-UHFFFAOYSA-N 1 3 345.531 2.799 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1=CCN([C@H]2CCc3c2cccc3F)CC1 ZINC001677599289 1106767549 /nfs/dbraw/zinc/76/75/49/1106767549.db2.gz XPNLSGSOQSNKOF-IBGZPJMESA-N 1 3 345.462 2.513 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1=CCN([C@@H]2CCc3c2cccc3F)CC1 ZINC001677599290 1106767786 /nfs/dbraw/zinc/76/77/86/1106767786.db2.gz XPNLSGSOQSNKOF-LJQANCHMSA-N 1 3 345.462 2.513 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+](Cc2ccc(CF)cc2)CC1)N(C)C ZINC001677624883 1106788582 /nfs/dbraw/zinc/78/85/82/1106788582.db2.gz WYBUFRSVMCHYFJ-LJQANCHMSA-N 1 3 347.478 2.745 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+](Cc2ccc(CF)cc2)CC1)N(C)C ZINC001677624883 1106788593 /nfs/dbraw/zinc/78/85/93/1106788593.db2.gz WYBUFRSVMCHYFJ-LJQANCHMSA-N 1 3 347.478 2.745 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1=CC[N@H+](CC2CCCC2)CC1 ZINC001677632205 1106794230 /nfs/dbraw/zinc/79/42/30/1106794230.db2.gz IGZANQQCVZLBOT-IRXDYDNUSA-N 1 3 333.520 2.798 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1=CC[N@@H+](CC2CCCC2)CC1 ZINC001677632205 1106794244 /nfs/dbraw/zinc/79/42/44/1106794244.db2.gz IGZANQQCVZLBOT-IRXDYDNUSA-N 1 3 333.520 2.798 10 0 EFAEHO CC(C)CCCN1CC[C@H]1CNC(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001483682007 1107537210 /nfs/dbraw/zinc/53/72/10/1107537210.db2.gz QJEWTGFNYSAUHT-LPHOPBHVSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CCCN1CC[C@H]1CNC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001483682007 1107537217 /nfs/dbraw/zinc/53/72/17/1107537217.db2.gz QJEWTGFNYSAUHT-LPHOPBHVSA-N 1 3 341.515 2.826 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]C/C=C\Cl)CC(C)(C)C ZINC001272308546 1107728438 /nfs/dbraw/zinc/72/84/38/1107728438.db2.gz BSOWURXKDICKAJ-XDHNQJSPSA-N 1 3 329.916 2.591 10 0 EFAEHO C[C@@H]([NH2+]C/C=C\CNC(=O)CN(C)CC(C)(C)C)c1ccccc1 ZINC001483060712 1107894393 /nfs/dbraw/zinc/89/43/93/1107894393.db2.gz OVKGANIULLZMIJ-DOOKAGJSSA-N 1 3 331.504 2.988 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001409363626 1107915618 /nfs/dbraw/zinc/91/56/18/1107915618.db2.gz KKIZFIIBKCEZGJ-JKSUJKDBSA-N 1 3 331.504 2.716 10 0 EFAEHO c1[nH]nc2cc(CN[C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)ccc12 ZINC000904476566 1107964273 /nfs/dbraw/zinc/96/42/73/1107964273.db2.gz UELIOFMDYQWXOK-UYAOXDASSA-N 1 3 334.423 2.908 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCN1CC1CC(C)(C)C1)[NH+]1CCCC1 ZINC001483704935 1108052488 /nfs/dbraw/zinc/05/24/88/1108052488.db2.gz FGEIIBNNFINGQF-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC/C=C/CN[C@H]1CCCc2ccc(F)cc21 ZINC001483078720 1108421825 /nfs/dbraw/zinc/42/18/25/1108421825.db2.gz FTEOWUSPMBATPX-PXPVJAHISA-N 1 3 347.478 2.807 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC/C=C/CN[C@H]1CCCc2ccc(F)cc21 ZINC001483078720 1108421833 /nfs/dbraw/zinc/42/18/33/1108421833.db2.gz FTEOWUSPMBATPX-PXPVJAHISA-N 1 3 347.478 2.807 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)NC/C=C\CNCc2ccc(F)cc2)C1 ZINC001483082658 1108453837 /nfs/dbraw/zinc/45/38/37/1108453837.db2.gz UBYAASCWAVPYOZ-VOSNQSNISA-N 1 3 347.478 2.708 10 0 EFAEHO O=C(CN1CCCC1)NC/C=C\C[NH2+]C/C=C\c1ccc(Cl)cc1 ZINC001483093504 1108575372 /nfs/dbraw/zinc/57/53/72/1108575372.db2.gz RJGQOHYAMFOUKF-YMPRJYOMSA-N 1 3 347.890 2.711 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]CCCCC(F)(F)F)C1 ZINC001272524871 1108616325 /nfs/dbraw/zinc/61/63/25/1108616325.db2.gz VXEPYNHYVGHEGT-HUUCEWRRSA-N 1 3 349.441 2.641 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001272564570 1108671798 /nfs/dbraw/zinc/67/17/98/1108671798.db2.gz HYPFIRCPSWJIFC-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2cc(C)ccc2F)C1)N(C)C ZINC001272565634 1108673445 /nfs/dbraw/zinc/67/34/45/1108673445.db2.gz NVYWSCXZJNZFED-APWZRJJASA-N 1 3 349.494 2.803 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@@H]3C[C@@H]3[C@H]3C[C@@H]3C)CC2)CC1 ZINC000899398791 1109311326 /nfs/dbraw/zinc/31/13/26/1109311326.db2.gz BUJLZGPGQTYVSZ-UHMOLFJZSA-N 1 3 347.547 2.591 10 0 EFAEHO CCc1ccccc1C[NH2+]CC1CC(NC(=O)[C@H](CC)N(C)C)C1 ZINC001409296176 1109424015 /nfs/dbraw/zinc/42/40/15/1109424015.db2.gz JDWCWNWSUROWMA-PPSBMQLTSA-N 1 3 331.504 2.574 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1ccccc1F ZINC001483142859 1109667476 /nfs/dbraw/zinc/66/74/76/1109667476.db2.gz AERYRIDBQQLAJR-QAPCUYQASA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1ccccc1F ZINC001483142859 1109667479 /nfs/dbraw/zinc/66/74/79/1109667479.db2.gz AERYRIDBQQLAJR-QAPCUYQASA-N 1 3 335.467 2.540 10 0 EFAEHO C[C@H](CNCc1ccccc1F)NC(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC001483172112 1109931717 /nfs/dbraw/zinc/93/17/17/1109931717.db2.gz ISMHFASGKWHYQK-HZPDHXFCSA-N 1 3 335.467 2.685 10 0 EFAEHO C[C@H](CN[C@H](C)c1ccccc1Cl)NC(=O)C12CC[NH+](CC1)C2 ZINC001483184985 1109967223 /nfs/dbraw/zinc/96/72/23/1109967223.db2.gz ZMFSHGLVDLTGNA-ZIAGYGMSSA-N 1 3 335.879 2.591 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2c(C)cccc2C)C1)N(C)C ZINC001272615671 1111746616 /nfs/dbraw/zinc/74/66/16/1111746616.db2.gz GCLMXKXOWBAFLJ-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](CC[NH2+]CCCC(C)(C)C)C1 ZINC001272652205 1111884969 /nfs/dbraw/zinc/88/49/69/1111884969.db2.gz JZYMAMONENOGQE-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@@H](C(=O)NCC2(NCc3ccc(F)cc3)CC2)C1 ZINC001483784836 1112447865 /nfs/dbraw/zinc/44/78/65/1112447865.db2.gz VDXYDUFNHJYTND-AEFFLSMTSA-N 1 3 347.478 2.685 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@@H]3CCC[C@@H]([NH+](C)C)C3)CC2)cs1 ZINC001483783013 1112457295 /nfs/dbraw/zinc/45/72/95/1112457295.db2.gz IINFXHCDSCCTCX-IAGOWNOFSA-N 1 3 349.544 2.915 10 0 EFAEHO Cc1ccc(CNC2(CNC(=O)[C@@H]3CCC[C@@H]([NH+](C)C)C3)CC2)cc1 ZINC001483783308 1112457420 /nfs/dbraw/zinc/45/74/20/1112457420.db2.gz LFOXCUQZBGQKIQ-RTBURBONSA-N 1 3 343.515 2.854 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(CC[N@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001483845649 1112505169 /nfs/dbraw/zinc/50/51/69/1112505169.db2.gz AFRQRFYWXHLOMI-OAQYLSRUSA-N 1 3 347.547 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@]2(CC[N@@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001483845649 1112505172 /nfs/dbraw/zinc/50/51/72/1112505172.db2.gz AFRQRFYWXHLOMI-OAQYLSRUSA-N 1 3 347.547 2.831 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)c1 ZINC001483913334 1112555566 /nfs/dbraw/zinc/55/55/66/1112555566.db2.gz GZNKIPLNYLEDAS-MJGOQNOKSA-N 1 3 331.504 2.804 10 0 EFAEHO CC[C@H](C)C[NH+]1CCC(C)(NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001483971788 1112603440 /nfs/dbraw/zinc/60/34/40/1112603440.db2.gz WFSQUFZZALHBQC-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1(C)CC[NH+](CC[C@H](C)F)CC1 ZINC001484136361 1112808005 /nfs/dbraw/zinc/80/80/05/1112808005.db2.gz DKPMATGSRAKOQF-DLBZAZTESA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NCC1(C)CCN(C/C=C/Cl)CC1 ZINC001484147085 1112825636 /nfs/dbraw/zinc/82/56/36/1112825636.db2.gz MQPUGJRKOWPGND-CQTVFXNMSA-N 1 3 341.927 2.830 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCC1(C)CCN(C/C=C/Cl)CC1 ZINC001484147085 1112825642 /nfs/dbraw/zinc/82/56/42/1112825642.db2.gz MQPUGJRKOWPGND-CQTVFXNMSA-N 1 3 341.927 2.830 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1C[N@H+](CC2CCCC2)CCC1(F)F ZINC001484195709 1112912950 /nfs/dbraw/zinc/91/29/50/1112912950.db2.gz KDKLNYPRMUEKDN-INIZCTEOSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1C[N@@H+](CC2CCCC2)CCC1(F)F ZINC001484195709 1112912954 /nfs/dbraw/zinc/91/29/54/1112912954.db2.gz KDKLNYPRMUEKDN-INIZCTEOSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[C@H](C)C[N@@H+]1CCC(F)(F)[C@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001484196746 1112915570 /nfs/dbraw/zinc/91/55/70/1112915570.db2.gz WCGHEMSSHKZVND-LSDHHAIUSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C)C[N@H+]1CCC(F)(F)[C@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001484196746 1112915579 /nfs/dbraw/zinc/91/55/79/1112915579.db2.gz WCGHEMSSHKZVND-LSDHHAIUSA-N 1 3 345.478 2.590 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]Cc2ccccc2Cl)C1 ZINC001484531433 1112985918 /nfs/dbraw/zinc/98/59/18/1112985918.db2.gz GQKFAFTXHLPLRU-MAUKXSAKSA-N 1 3 349.906 2.762 10 0 EFAEHO CCC(CC)C[NH2+]CC[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001484543612 1112990385 /nfs/dbraw/zinc/99/03/85/1112990385.db2.gz OACXZBXHWBDWNR-IBGZPJMESA-N 1 3 337.552 2.983 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](CC[NH2+]Cc2cc(C)ccc2C)C1)N(C)C ZINC001484548134 1112996191 /nfs/dbraw/zinc/99/61/91/1112996191.db2.gz WBHHAAPBYOCBMW-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2cc(C)ccc2C)C1)N(C)C ZINC001484548137 1112996610 /nfs/dbraw/zinc/99/66/10/1112996610.db2.gz WBHHAAPBYOCBMW-QUCCMNQESA-N 1 3 345.531 2.972 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@@H](CC[NH2+]Cc2ccsc2)C1 ZINC001484551235 1113003181 /nfs/dbraw/zinc/00/31/81/1113003181.db2.gz FAHUCLAAJCXUAO-AEFFLSMTSA-N 1 3 349.544 2.951 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@H]2CC[C@H](C[NH2+]CCC(F)(F)F)CC2)C1 ZINC001484571989 1113032458 /nfs/dbraw/zinc/03/24/58/1113032458.db2.gz PUJJRJGMKUQQCD-KKUMJFAQSA-N 1 3 349.441 2.545 10 0 EFAEHO CN(CC(=O)NCc1cccc2c1CC[N@H+](CC1CC1)C2)C1CCC1 ZINC001484612827 1113055872 /nfs/dbraw/zinc/05/58/72/1113055872.db2.gz QKNCMTCZERIKEM-UHFFFAOYSA-N 1 3 341.499 2.555 10 0 EFAEHO CN(CC(=O)NCc1cccc2c1CC[N@@H+](CC1CC1)C2)C1CCC1 ZINC001484612827 1113055876 /nfs/dbraw/zinc/05/58/76/1113055876.db2.gz QKNCMTCZERIKEM-UHFFFAOYSA-N 1 3 341.499 2.555 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@@H]([NH2+]C/C=C/Cl)C1 ZINC001484876728 1117792613 /nfs/dbraw/zinc/79/26/13/1117792613.db2.gz KGCQRGULWYJEDW-GRLYAWNKSA-N 1 3 327.900 2.582 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1[NH2+]CCCC1CCC1 ZINC001484900703 1117805078 /nfs/dbraw/zinc/80/50/78/1117805078.db2.gz UINDNRUXKNGZAK-WMZOPIPTSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H]1CN(C(=O)C(C)(C)[NH+]2CCCC2)C[C@@H]1NCC=C(Cl)Cl ZINC001484894848 1117809717 /nfs/dbraw/zinc/80/97/17/1117809717.db2.gz MJUOFGGBDAVCPQ-STQMWFEESA-N 1 3 348.318 2.616 10 0 EFAEHO Cc1ccc(CN2CC[C@H](NC(=O)CC[NH+](C)C)C[C@@H]2C)cc1F ZINC001484982559 1117906339 /nfs/dbraw/zinc/90/63/39/1117906339.db2.gz MUFDWGYKHRPPMZ-RDJZCZTQSA-N 1 3 335.467 2.555 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001484987659 1117913927 /nfs/dbraw/zinc/91/39/27/1117913927.db2.gz FAROVTVHAMFWOR-HKUYNNGSSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001484987659 1117913931 /nfs/dbraw/zinc/91/39/31/1117913931.db2.gz FAROVTVHAMFWOR-HKUYNNGSSA-N 1 3 331.504 2.804 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CC[C@H](C)F)N(C)C ZINC001485044204 1117962757 /nfs/dbraw/zinc/96/27/57/1117962757.db2.gz NQQMIPPMNBJTSG-JEDBISTDSA-N 1 3 349.494 2.693 10 0 EFAEHO CC[N@H+](CC[C@H](C)F)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001485033050 1117966210 /nfs/dbraw/zinc/96/62/10/1117966210.db2.gz UDKPXUDLPGYWJR-IRXDYDNUSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[N@@H+](CC[C@H](C)F)CC1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001485033050 1117966213 /nfs/dbraw/zinc/96/62/13/1117966213.db2.gz UDKPXUDLPGYWJR-IRXDYDNUSA-N 1 3 341.515 2.637 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@H]1C[NH2+]CCC1=CCCCC1 ZINC001485040206 1117972141 /nfs/dbraw/zinc/97/21/41/1117972141.db2.gz LIDIXHXHCWLAPH-SFHVURJKSA-N 1 3 330.476 2.813 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H]1C[N@H+](C)Cc1ccccc1 ZINC001485057553 1117994986 /nfs/dbraw/zinc/99/49/86/1117994986.db2.gz FZIPCGVJJHRELZ-OALUTQOASA-N 1 3 349.494 2.789 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H]1C[N@@H+](C)Cc1ccccc1 ZINC001485057553 1117994991 /nfs/dbraw/zinc/99/49/91/1117994991.db2.gz FZIPCGVJJHRELZ-OALUTQOASA-N 1 3 349.494 2.789 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+](C)C[C@@H]1CCCN1C(=O)CN(C)C(C)C ZINC001485078440 1118021763 /nfs/dbraw/zinc/02/17/63/1118021763.db2.gz GCHVKBVRELXOFS-IBGZPJMESA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+](C)C[C@@H]1CCCN1C(=O)CN(C)C(C)C ZINC001485078440 1118021768 /nfs/dbraw/zinc/02/17/68/1118021768.db2.gz GCHVKBVRELXOFS-IBGZPJMESA-N 1 3 349.494 2.897 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]C/C=C\c2ccccc2)C1 ZINC001485110869 1118057118 /nfs/dbraw/zinc/05/71/18/1118057118.db2.gz YQQOXBGQZBTIPT-YFHOEESVSA-N 1 3 329.488 2.524 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001485158923 1118101194 /nfs/dbraw/zinc/10/11/94/1118101194.db2.gz TUPSUGZLVRGXST-IAGOWNOFSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001485158922 1118101277 /nfs/dbraw/zinc/10/12/77/1118101277.db2.gz TUPSUGZLVRGXST-DLBZAZTESA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@@H](NCc1ccns1)[C@H](C)NC(=O)c1ccc(C[NH+](C)C)cc1 ZINC001485201257 1118125747 /nfs/dbraw/zinc/12/57/47/1118125747.db2.gz XCRSRGGFUNEKPQ-KGLIPLIRSA-N 1 3 346.500 2.501 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)cc1C ZINC001485218598 1118138007 /nfs/dbraw/zinc/13/80/07/1118138007.db2.gz XACSQVYROZPISJ-CABCVRRESA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)[C@H](C)NC(=O)CC[NH+]2CCCCC2)c1 ZINC001485228000 1118154506 /nfs/dbraw/zinc/15/45/06/1118154506.db2.gz BCLLDSINCHHCNE-IRXDYDNUSA-N 1 3 349.494 2.993 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@@H](C)CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001485298640 1118215946 /nfs/dbraw/zinc/21/59/46/1118215946.db2.gz BINGVHGQWVPFKE-PKOBYXMFSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@@H](C)CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001485298640 1118215950 /nfs/dbraw/zinc/21/59/50/1118215950.db2.gz BINGVHGQWVPFKE-PKOBYXMFSA-N 1 3 331.504 2.804 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1 ZINC001485308231 1118221141 /nfs/dbraw/zinc/22/11/41/1118221141.db2.gz DQUWNHNWIPYECL-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1ccc(F)cc1 ZINC001485308231 1118221146 /nfs/dbraw/zinc/22/11/46/1118221146.db2.gz DQUWNHNWIPYECL-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1cccc(F)c1 ZINC001485311166 1118223601 /nfs/dbraw/zinc/22/36/01/1118223601.db2.gz YEWHGAVCLJSROY-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1cccc(F)c1 ZINC001485311166 1118223606 /nfs/dbraw/zinc/22/36/06/1118223606.db2.gz YEWHGAVCLJSROY-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]CCC(C)(C)C ZINC001485428463 1118358001 /nfs/dbraw/zinc/35/80/01/1118358001.db2.gz JNKBGWZYBBQKPX-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)=CCN1CC([C@@H](C)NC(=O)[C@@]2(F)CC[N@@H+](C(C)(C)C)C2)C1 ZINC001485526328 1118437182 /nfs/dbraw/zinc/43/71/82/1118437182.db2.gz NBAJWFMMHQOZQY-DNVCBOLYSA-N 1 3 339.499 2.602 10 0 EFAEHO CC(C)=CCN1CC([C@@H](C)NC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)C1 ZINC001485526328 1118437183 /nfs/dbraw/zinc/43/71/83/1118437183.db2.gz NBAJWFMMHQOZQY-DNVCBOLYSA-N 1 3 339.499 2.602 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1C[NH+]([C@H]2CCCc3ccccc32)C1 ZINC001485540714 1118440671 /nfs/dbraw/zinc/44/06/71/1118440671.db2.gz UETNCGAGVHZVPL-UZLBHIALSA-N 1 3 343.515 2.841 10 0 EFAEHO C[C@@H](NC(=O)CCCC[NH+](C)C)C1CN([C@@H](C)c2ccccc2)C1 ZINC001485533951 1118444943 /nfs/dbraw/zinc/44/49/43/1118444943.db2.gz WYNHZZHZEANFHW-SJORKVTESA-N 1 3 331.504 2.916 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3=CCCCC3)C[C@H]21)N(C)C ZINC001485616157 1118488558 /nfs/dbraw/zinc/48/85/58/1118488558.db2.gz NCGWFENAJKPGFY-OKYOBFRVSA-N 1 3 333.520 2.511 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3=CCCCC3)C[C@H]21)N(C)C ZINC001485616157 1118488560 /nfs/dbraw/zinc/48/85/60/1118488560.db2.gz NCGWFENAJKPGFY-OKYOBFRVSA-N 1 3 333.520 2.511 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](CC3CC(C)(C)C3)C[C@@H]2C1 ZINC001485657059 1118520205 /nfs/dbraw/zinc/52/02/05/1118520205.db2.gz HYSXYSIJZGWRRD-CEXWTWQISA-N 1 3 349.563 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](CC3CC(C)(C)C3)C[C@@H]2C1 ZINC001485657059 1118520207 /nfs/dbraw/zinc/52/02/07/1118520207.db2.gz HYSXYSIJZGWRRD-CEXWTWQISA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CCc2cccs2)C1 ZINC001485682927 1118525805 /nfs/dbraw/zinc/52/58/05/1118525805.db2.gz AIOVWFVSKXVUKZ-JFIYKMOQSA-N 1 3 349.544 2.648 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H](C[NH2+]Cc3ccccc3Cl)C2)CCC1 ZINC001485686316 1118527355 /nfs/dbraw/zinc/52/73/55/1118527355.db2.gz PLGVGRHPZZMVRJ-KOMQPUFPSA-N 1 3 349.906 2.809 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@H](C[NH2+]CCC2CCCC2)C1 ZINC001485705152 1118529679 /nfs/dbraw/zinc/52/96/79/1118529679.db2.gz NLRYGNARVCBPNV-YOQCTACHSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@H](CCC[NH2+]Cc1ccc(F)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001485739261 1118551605 /nfs/dbraw/zinc/55/16/05/1118551605.db2.gz OTXDBIMRNKMJAL-JKSUJKDBSA-N 1 3 335.467 2.542 10 0 EFAEHO CN(C)C1(C(=O)N2CCC([N@H+](C)CCCCCF)CC2)CCC1 ZINC001485758472 1118563404 /nfs/dbraw/zinc/56/34/04/1118563404.db2.gz MABQNUWTVOANBE-UHFFFAOYSA-N 1 3 327.488 2.533 10 0 EFAEHO CN(C)C1(C(=O)N2CCC([N@@H+](C)CCCCCF)CC2)CCC1 ZINC001485758472 1118563405 /nfs/dbraw/zinc/56/34/05/1118563405.db2.gz MABQNUWTVOANBE-UHFFFAOYSA-N 1 3 327.488 2.533 10 0 EFAEHO C[C@@H]([NH2+]CCCF)c1ccc(CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001272702143 1118669484 /nfs/dbraw/zinc/66/94/84/1118669484.db2.gz ZPEYIGJDSDADAS-HZPDHXFCSA-N 1 3 335.467 2.655 10 0 EFAEHO C[C@H]([NH2+]CCCF)c1ccc(CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001272702140 1118669641 /nfs/dbraw/zinc/66/96/41/1118669641.db2.gz ZPEYIGJDSDADAS-CVEARBPZSA-N 1 3 335.467 2.655 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1([NH2+]CC/C=C\c2ccccc2)CC1 ZINC001670891925 1120665525 /nfs/dbraw/zinc/66/55/25/1120665525.db2.gz RNXQETXLXMPNPP-UITAMQMPSA-N 1 3 338.455 2.603 10 0 EFAEHO CN(C)Cc1ccc(C(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)cc1 ZINC000107525184 282145770 /nfs/dbraw/zinc/14/57/70/282145770.db2.gz LVSTWKOQFPVXCW-LJQANCHMSA-N 1 3 329.488 2.839 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)[C@H]2CCC[C@@H]21 ZINC000353611510 283139212 /nfs/dbraw/zinc/13/92/12/283139212.db2.gz YSOUJNUZDTZODQ-SLHNCBLASA-N 1 3 332.463 2.754 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)[C@H]2CCC[C@@H]21 ZINC000353611510 283139213 /nfs/dbraw/zinc/13/92/13/283139213.db2.gz YSOUJNUZDTZODQ-SLHNCBLASA-N 1 3 332.463 2.754 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2CCC([NH+](C)C)CC2)CC1 ZINC000091670270 283350238 /nfs/dbraw/zinc/35/02/38/283350238.db2.gz VVADRYORGUPKLQ-UHFFFAOYSA-N 1 3 344.547 2.745 10 0 EFAEHO C[C@@H](NC[C@@H]1CC[N@H+](C)C1)c1ccc(I)cc1 ZINC000037646833 202349456 /nfs/dbraw/zinc/34/94/56/202349456.db2.gz MRTPJLWNQUUFAC-NEPJUHHUSA-N 1 3 344.240 2.894 10 0 EFAEHO C[C@@H](NC[C@@H]1CC[N@@H+](C)C1)c1ccc(I)cc1 ZINC000037646833 202349460 /nfs/dbraw/zinc/34/94/60/202349460.db2.gz MRTPJLWNQUUFAC-NEPJUHHUSA-N 1 3 344.240 2.894 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3[NH2+]2)CN1Cc1ccccc1 ZINC000237491054 201148898 /nfs/dbraw/zinc/14/88/98/201148898.db2.gz CNMFJCYHGQBFJL-HTDHLNIYSA-N 1 3 341.499 2.686 10 0 EFAEHO CCCN1CCN([C@H](C[NH3+])c2ccc(F)c(Br)c2)CC1 ZINC000022166434 212280388 /nfs/dbraw/zinc/28/03/88/212280388.db2.gz ARXHCORJVPWRTH-OAHLLOKOSA-N 1 3 344.272 2.616 10 0 EFAEHO Cc1cc(NC[C@@](C)(O)C[NH+](C)C)c2cc(OC(F)F)ccc2n1 ZINC000133022574 223382061 /nfs/dbraw/zinc/38/20/61/223382061.db2.gz OCSQQLPXXJTXPF-QGZVFWFLSA-N 1 3 339.386 2.869 10 0 EFAEHO O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@@H]1C[C@@H]2CCCC[C@H]2[NH2+]1 ZINC000261709976 283988759 /nfs/dbraw/zinc/98/87/59/283988759.db2.gz PNNZJDUPZZDWEG-ZGXWSNOMSA-N 1 3 341.499 2.860 10 0 EFAEHO Cc1noc(C)c1CNCC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000069455215 203003393 /nfs/dbraw/zinc/00/33/93/203003393.db2.gz YZWHQCPMXGTFND-HXUWFJFHSA-N 1 3 343.471 2.827 10 0 EFAEHO CC[NH+](CC)CC1CCN(CCc2nc3ccccc3c(=O)[nH]2)CC1 ZINC000069770816 203047921 /nfs/dbraw/zinc/04/79/21/203047921.db2.gz CDSVHGDLJCPBIE-UHFFFAOYSA-N 1 3 342.487 2.519 10 0 EFAEHO COc1cccc(CNC2CC[NH+](CCc3ccncc3)CC2)c1 ZINC000071792605 203112515 /nfs/dbraw/zinc/11/25/15/203112515.db2.gz QVJKQHCWAHKCIB-UHFFFAOYSA-N 1 3 325.456 2.887 10 0 EFAEHO CC(C)C[C@@H](C)[NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1 ZINC000414325634 244089199 /nfs/dbraw/zinc/08/91/99/244089199.db2.gz MMXXPGMRVFVSPV-MRXNPFEDSA-N 1 3 331.504 2.908 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1)[C@@H]1CC1(C)C ZINC000414334038 244094298 /nfs/dbraw/zinc/09/42/98/244094298.db2.gz FXWRKLKOSDLKAF-BEFAXECRSA-N 1 3 343.515 2.908 10 0 EFAEHO Cc1ccc([C@H]2CCC[N@@H+]2C[C@H]2CCCN(C(=O)CN)C2)cc1C ZINC000414698707 244295901 /nfs/dbraw/zinc/29/59/01/244295901.db2.gz XUAJQNAMXWWOIT-IEBWSBKVSA-N 1 3 329.488 2.638 10 0 EFAEHO Cc1ccc([C@H]2CCC[N@H+]2C[C@H]2CCCN(C(=O)CN)C2)cc1C ZINC000414698707 244295913 /nfs/dbraw/zinc/29/59/13/244295913.db2.gz XUAJQNAMXWWOIT-IEBWSBKVSA-N 1 3 329.488 2.638 10 0 EFAEHO CCCc1ccc([C@H](C)N(CC(N)=O)C[C@H]2CC[NH2+][C@H](C)C2)cc1 ZINC000414737842 244315938 /nfs/dbraw/zinc/31/59/38/244315938.db2.gz DPTKKKPSDLFSMA-RYRKJORJSA-N 1 3 331.504 2.876 10 0 EFAEHO Cc1cc2c(ncnc2N2CCN(C[C@@H]3CC[NH2+][C@@H](C)C3)CC2)s1 ZINC000414752480 244325991 /nfs/dbraw/zinc/32/59/91/244325991.db2.gz KUHSECUXYADUAY-DZGCQCFKSA-N 1 3 345.516 2.510 10 0 EFAEHO COC(=O)COc1ccc(CNCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000414812727 244364515 /nfs/dbraw/zinc/36/45/15/244364515.db2.gz ROXZLNSUJAHRDS-AWEZNQCLSA-N 1 3 328.412 2.548 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNCc2ccc3c(c2)sc(=O)n3C)cc1 ZINC000414817886 244367140 /nfs/dbraw/zinc/36/71/40/244367140.db2.gz UEFCVNXFMVHEDQ-LBPRGKRZSA-N 1 3 327.453 2.910 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNCc2ccc3c(c2)sc(=O)n3C)cc1 ZINC000414817885 244367387 /nfs/dbraw/zinc/36/73/87/244367387.db2.gz UEFCVNXFMVHEDQ-GFCCVEGCSA-N 1 3 327.453 2.910 10 0 EFAEHO Fc1ccccc1-c1n[nH]cc1CNCCC[NH2+]Cc1cccnc1 ZINC000414878082 244381576 /nfs/dbraw/zinc/38/15/76/244381576.db2.gz NHDSKJRFZTUCOJ-UHFFFAOYSA-N 1 3 339.418 2.880 10 0 EFAEHO c1ccc(CN2CCC([NH2+]CCCNCc3cccnc3)CC2)cc1 ZINC000414875735 244381932 /nfs/dbraw/zinc/38/19/32/244381932.db2.gz JKIXCUCUUJKOEO-UHFFFAOYSA-N 1 3 338.499 2.816 10 0 EFAEHO CN(C)[C@@H](CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC000075314870 203311898 /nfs/dbraw/zinc/31/18/98/203311898.db2.gz NTQBYRKCSWUXFV-IPQPSQTFSA-N 1 3 344.503 2.604 10 0 EFAEHO CN(C)[C@@H](CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000075314870 203311902 /nfs/dbraw/zinc/31/19/02/203311902.db2.gz NTQBYRKCSWUXFV-IPQPSQTFSA-N 1 3 344.503 2.604 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000417783608 245093157 /nfs/dbraw/zinc/09/31/57/245093157.db2.gz HUCGSVPBWQOMCA-RGPMPMONSA-N 1 3 344.503 2.563 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000417783608 245093162 /nfs/dbraw/zinc/09/31/62/245093162.db2.gz HUCGSVPBWQOMCA-RGPMPMONSA-N 1 3 344.503 2.563 10 0 EFAEHO CCn1nncc1CNCC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000417960339 245107108 /nfs/dbraw/zinc/10/71/08/245107108.db2.gz XHNKSLWNDKQGSU-AEFFLSMTSA-N 1 3 327.476 2.688 10 0 EFAEHO CCn1nncc1CNCC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000417960339 245107113 /nfs/dbraw/zinc/10/71/13/245107113.db2.gz XHNKSLWNDKQGSU-AEFFLSMTSA-N 1 3 327.476 2.688 10 0 EFAEHO C[C@H](C1CCN(C)CC1)N(C)C(=O)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000418490862 245172520 /nfs/dbraw/zinc/17/25/20/245172520.db2.gz NLJDBSMECGQSAW-LSDHHAIUSA-N 1 3 332.492 2.578 10 0 EFAEHO CC[NH+]1CCC(N(C)c2cc(Br)ccc2CN)CC1 ZINC000042681053 204123657 /nfs/dbraw/zinc/12/36/57/204123657.db2.gz VHKVCFDTZXOHIU-UHFFFAOYSA-N 1 3 326.282 2.828 10 0 EFAEHO C[C@@H]1CC[C@H](C[NH3+])CN1CCOc1cccc(Br)c1 ZINC000042427533 204097186 /nfs/dbraw/zinc/09/71/86/204097186.db2.gz COYZVGUJSYIONJ-CHWSQXEVSA-N 1 3 327.266 2.887 10 0 EFAEHO C[C@H](CNC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)N(C)C1CC1 ZINC000105091417 204132004 /nfs/dbraw/zinc/13/20/04/204132004.db2.gz DURXXLZJLLJEGJ-MRXNPFEDSA-N 1 3 344.503 2.564 10 0 EFAEHO C[N@H+](CC(=O)NC1CCN(C2CC2)CC1)[C@H]1CCC[C@@H]1C(C)(C)C ZINC000419330878 245382929 /nfs/dbraw/zinc/38/29/29/245382929.db2.gz RADYFFBHNXKUNJ-ROUUACIJSA-N 1 3 335.536 2.876 10 0 EFAEHO C[N@@H+](CC(=O)NC1CCN(C2CC2)CC1)[C@H]1CCC[C@@H]1C(C)(C)C ZINC000419330878 245382938 /nfs/dbraw/zinc/38/29/38/245382938.db2.gz RADYFFBHNXKUNJ-ROUUACIJSA-N 1 3 335.536 2.876 10 0 EFAEHO CN(CCCNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2[NH2+]1)Cc1ccccc1 ZINC000237070640 204354564 /nfs/dbraw/zinc/35/45/64/204354564.db2.gz IDNGRAIPVCRKDU-FHWLQOOXSA-N 1 3 329.488 2.545 10 0 EFAEHO C[N@@H+]1CCC[C@@H]2CN(C(=O)c3cccc(CN4CCCC4)c3)CC[C@@H]21 ZINC000155825473 206038716 /nfs/dbraw/zinc/03/87/16/206038716.db2.gz LQKJRXYTXRBPOG-UXHICEINSA-N 1 3 341.499 2.839 10 0 EFAEHO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cccc(CN4CCCC4)c3)CC[C@@H]21 ZINC000155825473 206038719 /nfs/dbraw/zinc/03/87/19/206038719.db2.gz LQKJRXYTXRBPOG-UXHICEINSA-N 1 3 341.499 2.839 10 0 EFAEHO CCC[C@H](C(=O)NCC1CC[NH+](Cc2cccs2)CC1)N(C)C ZINC000161840490 206373427 /nfs/dbraw/zinc/37/34/27/206373427.db2.gz CZKIDDXCNDHOBL-QGZVFWFLSA-N 1 3 337.533 2.807 10 0 EFAEHO CN1CCN(CC[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)CC1(C)C ZINC000442878699 250134145 /nfs/dbraw/zinc/13/41/45/250134145.db2.gz ULOXWCLVBAXNBM-QUCCMNQESA-N 1 3 345.531 2.770 10 0 EFAEHO CN(C[C@H](O)Cc1ccccc1C(F)(F)F)C[C@H]1CCC[N@H+](C)C1 ZINC000443604806 250210769 /nfs/dbraw/zinc/21/07/69/250210769.db2.gz LYBOPKKGIWSSBM-GOEBONIOSA-N 1 3 344.421 2.882 10 0 EFAEHO CN(C[C@H](O)Cc1ccccc1C(F)(F)F)C[C@H]1CCC[N@@H+](C)C1 ZINC000443604806 250210773 /nfs/dbraw/zinc/21/07/73/250210773.db2.gz LYBOPKKGIWSSBM-GOEBONIOSA-N 1 3 344.421 2.882 10 0 EFAEHO COC[C@](C)(O)CC[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000449383721 251007122 /nfs/dbraw/zinc/00/71/22/251007122.db2.gz JNGDTPLMQSEXBT-PLACYPQZSA-N 1 3 346.515 2.664 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@H](CO)[C@H]2CC)CC1 ZINC000449431919 251023834 /nfs/dbraw/zinc/02/38/34/251023834.db2.gz ZPXXAHVGWZEUMD-WOJBJXKFSA-N 1 3 345.531 2.811 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@H](CO)[C@H]2CC)CC1 ZINC000449431919 251023839 /nfs/dbraw/zinc/02/38/39/251023839.db2.gz ZPXXAHVGWZEUMD-WOJBJXKFSA-N 1 3 345.531 2.811 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCCNC(=O)c1ccco1 ZINC000268765411 252214419 /nfs/dbraw/zinc/21/44/19/252214419.db2.gz PQXQYUBHSYTJSJ-FUHWJXTLSA-N 1 3 341.455 2.510 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCCNC(=O)c1ccco1 ZINC000268765411 252214424 /nfs/dbraw/zinc/21/44/24/252214424.db2.gz PQXQYUBHSYTJSJ-FUHWJXTLSA-N 1 3 341.455 2.510 10 0 EFAEHO CCN(Cc1ccc(C[N@H+](CC)[C@@H]2CCOC2)cc1)[C@@H]1CCOC1 ZINC000361591521 285099201 /nfs/dbraw/zinc/09/92/01/285099201.db2.gz NVVDDTTZMAEPJE-WOJBJXKFSA-N 1 3 332.488 2.908 10 0 EFAEHO CCN(Cc1ccc(C[N@@H+](CC)[C@@H]2CCOC2)cc1)[C@@H]1CCOC1 ZINC000361591521 285099203 /nfs/dbraw/zinc/09/92/03/285099203.db2.gz NVVDDTTZMAEPJE-WOJBJXKFSA-N 1 3 332.488 2.908 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000177504518 285235342 /nfs/dbraw/zinc/23/53/42/285235342.db2.gz XISJXBILCNWBPS-IEBWSBKVSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000177504518 285235343 /nfs/dbraw/zinc/23/53/43/285235343.db2.gz XISJXBILCNWBPS-IEBWSBKVSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)[C@H](C)Cc1ccccc1 ZINC000352825139 285247847 /nfs/dbraw/zinc/24/78/47/285247847.db2.gz CBZDSTKTMBKLBL-UYAOXDASSA-N 1 3 345.531 2.740 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)[C@H](C)Cc1ccccc1 ZINC000352825139 285247849 /nfs/dbraw/zinc/24/78/49/285247849.db2.gz CBZDSTKTMBKLBL-UYAOXDASSA-N 1 3 345.531 2.740 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)Cc1cc(OC)ccc1OC ZINC000349048692 285281827 /nfs/dbraw/zinc/28/18/27/285281827.db2.gz ZWVRGVRVKUKKOJ-SFHVURJKSA-N 1 3 349.519 2.552 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)Cc1cc(OC)ccc1OC ZINC000349048692 285281829 /nfs/dbraw/zinc/28/18/29/285281829.db2.gz ZWVRGVRVKUKKOJ-SFHVURJKSA-N 1 3 349.519 2.552 10 0 EFAEHO CC(C)n1ncc2c1C[C@H]([NH2+]C1CCN(c3ccncc3)CC1)CC2 ZINC000459533478 255893435 /nfs/dbraw/zinc/89/34/35/255893435.db2.gz VUAJWYZRWPXFAR-GOSISDBHSA-N 1 3 339.487 2.975 10 0 EFAEHO C[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)C(C)(C)C[NH+](C)C ZINC000173045001 533295801 /nfs/dbraw/zinc/29/58/01/533295801.db2.gz VELOTKMUZSUPQM-MRXNPFEDSA-N 1 3 331.504 2.989 10 0 EFAEHO C[C@@H](CCc1cccc(F)c1)[NH+]1CCC(C(=O)NCCN(C)C)CC1 ZINC000183209663 533667796 /nfs/dbraw/zinc/66/77/96/533667796.db2.gz DUSVGUJDTPFSEM-INIZCTEOSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000349904248 142376348 /nfs/dbraw/zinc/37/63/48/142376348.db2.gz CIPWAESMHIETOU-LMMKCTJWSA-N 1 3 346.519 2.536 10 0 EFAEHO COC1(C[C@@H](C)[NH2+]CC2(N3CCCCC3)CCN(C)CC2)CCC1 ZINC000369363573 292123866 /nfs/dbraw/zinc/12/38/66/292123866.db2.gz REAZZDUTDOAKAN-GOSISDBHSA-N 1 3 337.552 2.874 10 0 EFAEHO CC(C)c1ccccc1OC[C@@H](O)CN1CCC(C[NH+](C)C)CC1 ZINC000341184284 145007701 /nfs/dbraw/zinc/00/77/01/145007701.db2.gz ITORQMSELVXQGN-SFHVURJKSA-N 1 3 334.504 2.823 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000341308641 145030974 /nfs/dbraw/zinc/03/09/74/145030974.db2.gz AIEIWHLRPRCHFE-LMMKCTJWSA-N 1 3 346.519 2.679 10 0 EFAEHO C[C@H](CNC(=O)NCC[NH+]1[C@H](C)CCC[C@H]1C)N1CCC(C)CC1 ZINC000341429657 145050471 /nfs/dbraw/zinc/05/04/71/145050471.db2.gz HYJXGICRYLOQNB-KZNAEPCWSA-N 1 3 338.540 2.669 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NCCN2[C@H](C)CCC[C@H]2C)CC1 ZINC000341430488 145050836 /nfs/dbraw/zinc/05/08/36/145050836.db2.gz IMGIRWXKUYMYRE-IAGOWNOFSA-N 1 3 338.540 2.671 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)NCCN1CCCC[C@@H]1C)C(C)C ZINC000343879701 145315573 /nfs/dbraw/zinc/31/55/73/145315573.db2.gz OMCZBCRCXOAIJA-KRWDZBQOSA-N 1 3 326.529 2.669 10 0 EFAEHO C[C@H]1CN(CCCC[NH2+]Cc2cc(-n3ccnc3)cs2)C[C@H](C)O1 ZINC000344112288 145370865 /nfs/dbraw/zinc/37/08/65/145370865.db2.gz LGTFFIMXYGQGGU-HOTGVXAUSA-N 1 3 348.516 2.913 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H](CNC(=O)CCN2CCc3ccccc3C2)C1 ZINC000348914549 146023871 /nfs/dbraw/zinc/02/38/71/146023871.db2.gz UUHGEXMWRUEJKV-SFHVURJKSA-N 1 3 343.515 2.671 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H](CNC(=O)CCN2CCc3ccccc3C2)C1 ZINC000348914549 146023872 /nfs/dbraw/zinc/02/38/72/146023872.db2.gz UUHGEXMWRUEJKV-SFHVURJKSA-N 1 3 343.515 2.671 10 0 EFAEHO CN(CCN(C)C1CC[NH+](C)CC1)Cc1cc(-c2ccccc2)n[nH]1 ZINC000349065472 146046577 /nfs/dbraw/zinc/04/65/77/146046577.db2.gz ZVTVSINRGPPWEZ-UHFFFAOYSA-N 1 3 341.503 2.535 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000349080945 146048793 /nfs/dbraw/zinc/04/87/93/146048793.db2.gz MJHRWZKABZXNRG-IBGZPJMESA-N 1 3 329.488 2.773 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000355581811 147003597 /nfs/dbraw/zinc/00/35/97/147003597.db2.gz KVWFADINUWOBIV-ZHALLVOQSA-N 1 3 329.488 2.592 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CNCC(C)(C)C[NH+]1CCCC1 ZINC000360182257 148293188 /nfs/dbraw/zinc/29/31/88/148293188.db2.gz VQNUVDFNECFQAQ-UHFFFAOYSA-N 1 3 327.476 2.787 10 0 EFAEHO CN(C)C[C@H](NC(=O)CC[C@H]1CCCC[N@@H+]1C)c1ccc(F)cc1 ZINC000360214012 148301311 /nfs/dbraw/zinc/30/13/11/148301311.db2.gz SLAZLEBSSJILRD-MSOLQXFVSA-N 1 3 335.467 2.809 10 0 EFAEHO CN(C)C[C@H](NC(=O)CC[C@H]1CCCC[N@H+]1C)c1ccc(F)cc1 ZINC000360214012 148301313 /nfs/dbraw/zinc/30/13/13/148301313.db2.gz SLAZLEBSSJILRD-MSOLQXFVSA-N 1 3 335.467 2.809 10 0 EFAEHO Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C ZINC000372904438 151078627 /nfs/dbraw/zinc/07/86/27/151078627.db2.gz SLBVGLRTCJIEHH-RIFZZMRRSA-N 1 3 345.487 2.528 10 0 EFAEHO Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C ZINC000372904437 151078914 /nfs/dbraw/zinc/07/89/14/151078914.db2.gz SLBVGLRTCJIEHH-OXFYSEKESA-N 1 3 345.487 2.528 10 0 EFAEHO CC[NH+](CC)Cc1cccc(CNC(=O)N2CCN3CCC2CC3)c1 ZINC000375207581 151491558 /nfs/dbraw/zinc/49/15/58/151491558.db2.gz KYGICGSPYMMHBU-UHFFFAOYSA-N 1 3 344.503 2.518 10 0 EFAEHO COc1ccc([C@H](N[C@@H]2CN(C3CC3)C[C@@H]2C)[C@H]2CCC[NH2+]2)cc1 ZINC000422879123 286376309 /nfs/dbraw/zinc/37/63/09/286376309.db2.gz UOLMYDGYGIMZTG-PSAKCFHXSA-N 1 3 329.488 2.561 10 0 EFAEHO C[C@@H]1CCCCN1CCN[C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422862907 287271494 /nfs/dbraw/zinc/27/14/94/287271494.db2.gz OEAYKFYYSYNVJX-IMFGXOCKSA-N 1 3 329.488 2.706 10 0 EFAEHO c1ccc(C[NH+]2CCC(OCCCNCc3cncnc3)CC2)cc1 ZINC000176984486 544889853 /nfs/dbraw/zinc/88/98/53/544889853.db2.gz JQMASOSTDMGFFK-UHFFFAOYSA-N 1 3 340.471 2.638 10 0 EFAEHO CCCN(CCC[NH+](C)C)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000190061515 265208797 /nfs/dbraw/zinc/20/87/97/265208797.db2.gz NEHTZUZRRXIGOY-RTBURBONSA-N 1 3 346.519 2.805 10 0 EFAEHO C[NH+](C)[C@H]1CCCN(C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000277301676 267150590 /nfs/dbraw/zinc/15/05/90/267150590.db2.gz PDFKURCILUYDAP-IBGZPJMESA-N 1 3 329.488 2.839 10 0 EFAEHO CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000173325610 273024569 /nfs/dbraw/zinc/02/45/69/273024569.db2.gz LXHRYEUWWMRSBE-QRVBRYPASA-N 1 3 344.503 2.558 10 0 EFAEHO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000173325610 273024571 /nfs/dbraw/zinc/02/45/71/273024571.db2.gz LXHRYEUWWMRSBE-QRVBRYPASA-N 1 3 344.503 2.558 10 0 EFAEHO COC1(C[C@@H](C)[NH2+]Cc2ccc(CN3CCN(C)CC3)cc2)CCC1 ZINC000277147603 273148507 /nfs/dbraw/zinc/14/85/07/273148507.db2.gz PXWHOMQJZSGXOS-GOSISDBHSA-N 1 3 345.531 2.871 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)CC[N@@H+]1C ZINC000279517077 273223813 /nfs/dbraw/zinc/22/38/13/273223813.db2.gz UVBXPHLGQUTMFS-BJLQDIEVSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)CC[N@H+]1C ZINC000279517077 273223815 /nfs/dbraw/zinc/22/38/15/273223815.db2.gz UVBXPHLGQUTMFS-BJLQDIEVSA-N 1 3 343.515 2.840 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@@H](c2ccccc2)[C@H]2CCOC2)CC1 ZINC000367045078 273532460 /nfs/dbraw/zinc/53/24/60/273532460.db2.gz ZCRYEUGJRTXJMV-SFTDATJTSA-N 1 3 345.531 2.770 10 0 EFAEHO C[C@@H](Cc1ccccc1)C[N@H+](C)[C@@H]1CCN(C2CCN(C)CC2)C1 ZINC000377633062 274230587 /nfs/dbraw/zinc/23/05/87/274230587.db2.gz UOKLQMSVJMDGRM-GHTZIAJQSA-N 1 3 329.532 2.966 10 0 EFAEHO C[C@@H](Cc1ccccc1)C[N@@H+](C)[C@@H]1CCN(C2CCN(C)CC2)C1 ZINC000377633062 274230591 /nfs/dbraw/zinc/23/05/91/274230591.db2.gz UOKLQMSVJMDGRM-GHTZIAJQSA-N 1 3 329.532 2.966 10 0 EFAEHO CC(C)[C@](C)(O)C[NH+]1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000248591810 276037635 /nfs/dbraw/zinc/03/76/35/276037635.db2.gz ZUCOQKYFSFPLMS-ZIFCJYIRSA-N 1 3 326.525 2.605 10 0 EFAEHO CCN(C(=O)NC[C@H]([NH3+])C(C)C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418389844 276062300 /nfs/dbraw/zinc/06/23/00/276062300.db2.gz RZTJTKKPCMAEES-NEWSRXKRSA-N 1 3 346.519 2.837 10 0 EFAEHO CCN(C(=O)NCCCC[NH3+])[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418517011 276062448 /nfs/dbraw/zinc/06/24/48/276062448.db2.gz YKZXVGSWLDNTQO-SJLPKXTDSA-N 1 3 332.492 2.592 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCC[C@H](C)[N@H+](C)Cc2ccccc2)C1 ZINC000245437231 276177339 /nfs/dbraw/zinc/17/73/39/276177339.db2.gz WIRXHSXAQRDBPK-HKUYNNGSSA-N 1 3 346.519 2.681 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCC[C@H](C)[N@@H+](C)Cc2ccccc2)C1 ZINC000245437231 276177340 /nfs/dbraw/zinc/17/73/40/276177340.db2.gz WIRXHSXAQRDBPK-HKUYNNGSSA-N 1 3 346.519 2.681 10 0 EFAEHO CCOC(=O)[C@@H]1CC[C@H](N[C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423097856 276437137 /nfs/dbraw/zinc/43/71/37/276437137.db2.gz RHSCWSAFJIUVSN-DOHHPOSVSA-N 1 3 344.455 2.564 10 0 EFAEHO CCN(C(=O)N[C@H](C)CC[NH3+])[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418546302 279003714 /nfs/dbraw/zinc/00/37/14/279003714.db2.gz JKEWLFYHUGYODW-NUJGCVRESA-N 1 3 332.492 2.591 10 0 EFAEHO CC[NH+](CC)CCO[C@H]1CCN(Cc2c(C)cc(OC)nc2C)C1 ZINC000359222681 279110525 /nfs/dbraw/zinc/11/05/25/279110525.db2.gz IFBSRZJCKVHTJS-KRWDZBQOSA-N 1 3 335.492 2.640 10 0 EFAEHO CCN1CCCC[C@@H]1CN[C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422903952 279274881 /nfs/dbraw/zinc/27/48/81/279274881.db2.gz GDAGLKMCFAOVOJ-POAQFYNOSA-N 1 3 329.488 2.706 10 0 EFAEHO CC[C@H]1CCCCN1CCNC(=O)N1CCC([NH+]2CCCC2)CC1 ZINC000077644851 288196484 /nfs/dbraw/zinc/19/64/84/288196484.db2.gz YMUOMDAGBGBFAN-KRWDZBQOSA-N 1 3 336.524 2.521 10 0 EFAEHO CN(c1ccccc1CN1CCC([NH+](C)C)CC1)C1CCN(C)CC1 ZINC000091670769 289069951 /nfs/dbraw/zinc/06/99/51/289069951.db2.gz XBCMOCOORKVHNF-UHFFFAOYSA-N 1 3 344.547 2.743 10 0 EFAEHO CN(C)C[C@H](NC(=O)N[C@H](CC[NH+](C)C)C(C)(C)C)c1ccccc1 ZINC000116524659 289179682 /nfs/dbraw/zinc/17/96/82/289179682.db2.gz HJCXDGHAAIKQTI-ZWKOTPCHSA-N 1 3 348.535 2.955 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCC[C@H]3C[N@H+](C)CC[C@@H]32)c1 ZINC000245891541 289226009 /nfs/dbraw/zinc/22/60/09/289226009.db2.gz JSMKAHVCKKGNNN-WMZOPIPTSA-N 1 3 330.476 2.696 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)c1 ZINC000245891541 289226010 /nfs/dbraw/zinc/22/60/10/289226010.db2.gz JSMKAHVCKKGNNN-WMZOPIPTSA-N 1 3 330.476 2.696 10 0 EFAEHO CN1CCC(C[NH2+][C@@H]2CCCC23CCOCC3)(N2CCCCC2)CC1 ZINC000367078551 289878869 /nfs/dbraw/zinc/87/88/69/289878869.db2.gz QUVWWUDZXYATOD-LJQANCHMSA-N 1 3 349.563 2.876 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H](C)C[C@H](C)O)CC1 ZINC000088728114 292830647 /nfs/dbraw/zinc/83/06/47/292830647.db2.gz JJTGEMDJUOBYFS-MSOLQXFVSA-N 1 3 333.520 2.715 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H](CCO)C(C)C)CC1 ZINC000088735786 292830673 /nfs/dbraw/zinc/83/06/73/292830673.db2.gz WQHWOEGJFODDLC-LJQANCHMSA-N 1 3 333.520 2.715 10 0 EFAEHO CN(C)[C@@H](CNC(=O)NC1CCC(C[NH+](C)C)CC1)c1ccccc1 ZINC000125062046 293005254 /nfs/dbraw/zinc/00/52/54/293005254.db2.gz CPTRCQWGVDNSAW-KVZIAJEVSA-N 1 3 346.519 2.709 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NCC(C)(C)N2CCCCC2)[C@H](C)C1 ZINC000127910662 293085081 /nfs/dbraw/zinc/08/50/81/293085081.db2.gz QRKXPCIGCGSRLY-SJORKVTESA-N 1 3 338.540 2.623 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NCC(C)(C)N2CCCCC2)[C@H](C)C1 ZINC000127910662 293085084 /nfs/dbraw/zinc/08/50/84/293085084.db2.gz QRKXPCIGCGSRLY-SJORKVTESA-N 1 3 338.540 2.623 10 0 EFAEHO CCCN1CC[C@@H](C[NH2+]C[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000130026659 293151573 /nfs/dbraw/zinc/15/15/73/293151573.db2.gz YQTLAYHZGHFZBZ-IRXDYDNUSA-N 1 3 339.524 2.955 10 0 EFAEHO CCc1ccc(CC)c(NC(=O)N(CCN(C)C)CC[NH+](C)C)c1 ZINC000132569801 293230980 /nfs/dbraw/zinc/23/09/80/293230980.db2.gz PUSKJUPFWGPUPK-UHFFFAOYSA-N 1 3 334.508 2.769 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H](O)[C@@H](C)CC)CC1 ZINC000152118314 293318240 /nfs/dbraw/zinc/31/82/40/293318240.db2.gz OGZMOXFECABOSU-PXNSSMCTSA-N 1 3 333.520 2.715 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H](O)[C@H](C)CC)CC1 ZINC000152118490 293318457 /nfs/dbraw/zinc/31/84/57/293318457.db2.gz OGZMOXFECABOSU-XLIONFOSSA-N 1 3 333.520 2.715 10 0 EFAEHO CN(C)C[C@H](NC(=O)NC1CCC(C[NH+](C)C)CC1)c1ccccc1 ZINC000157207638 293536687 /nfs/dbraw/zinc/53/66/87/293536687.db2.gz YUBVNTAIDGDBBK-KVZIAJEVSA-N 1 3 346.519 2.709 10 0 EFAEHO NC(=O)C[C@@H]1CCCC[N@@H+]1Cc1cccc(CN2CCCCC2)c1 ZINC000411223504 295053786 /nfs/dbraw/zinc/05/37/86/295053786.db2.gz KFSHPMOIXRPUBF-IBGZPJMESA-N 1 3 329.488 2.902 10 0 EFAEHO NC(=O)C[C@@H]1CCCC[N@H+]1Cc1cccc(CN2CCCCC2)c1 ZINC000411223504 295053791 /nfs/dbraw/zinc/05/37/91/295053791.db2.gz KFSHPMOIXRPUBF-IBGZPJMESA-N 1 3 329.488 2.902 10 0 EFAEHO CC[C@H](N[C@H](C)c1ccc(OCC[NH+](C)C)cc1)[C@H](O)C(F)F ZINC000295865369 295388476 /nfs/dbraw/zinc/38/84/76/295388476.db2.gz BUAZPEZPSBRVOF-KCXAZCMYSA-N 1 3 330.419 2.682 10 0 EFAEHO NCC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2)C1 ZINC000414741893 303365506 /nfs/dbraw/zinc/36/55/06/303365506.db2.gz LFIYZKWJAQXPFX-MAUKXSAKSA-N 1 3 333.451 2.550 10 0 EFAEHO NCC(=O)N1CCC[C@@H](C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2)C1 ZINC000414741893 303365508 /nfs/dbraw/zinc/36/55/08/303365508.db2.gz LFIYZKWJAQXPFX-MAUKXSAKSA-N 1 3 333.451 2.550 10 0 EFAEHO CCN1CCN(c2ccccc2NC2CC[NH+](C3CC3)CC2)CC1 ZINC000297861038 310935710 /nfs/dbraw/zinc/93/57/10/310935710.db2.gz PGMLMKOQHPOFAW-UHFFFAOYSA-N 1 3 328.504 2.867 10 0 EFAEHO CCN1CCC(NC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000298588321 311005802 /nfs/dbraw/zinc/00/58/02/311005802.db2.gz RGYKRERGUVNSES-UHFFFAOYSA-N 1 3 344.503 2.566 10 0 EFAEHO Cc1nc2ccccc2nc1CN1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000333827102 311664341 /nfs/dbraw/zinc/66/43/41/311664341.db2.gz IRQLNCHOVULCTM-OXQOHEQNSA-N 1 3 340.471 2.657 10 0 EFAEHO CC(C)[C@@H]1C[C@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCO1 ZINC000397576652 311960496 /nfs/dbraw/zinc/96/04/96/311960496.db2.gz CRJFHSDEXCNTSK-UXHICEINSA-N 1 3 346.515 2.807 10 0 EFAEHO COc1cccc(C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)c1 ZINC000397646247 311961086 /nfs/dbraw/zinc/96/10/86/311961086.db2.gz VIZOWWXPODPXKE-UHFFFAOYSA-N 1 3 340.467 2.812 10 0 EFAEHO C[C@H]1CC[NH2+]C[C@@H]1NC1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000414922349 312063435 /nfs/dbraw/zinc/06/34/35/312063435.db2.gz FZBHDRIOOLISBF-GUYCJALGSA-N 1 3 335.879 2.532 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1ccccc1Cl)N[C@@H]1CC[NH2+]C[C@H]1C ZINC000414940417 312068012 /nfs/dbraw/zinc/06/80/12/312068012.db2.gz KJEXTTSNEPZISI-CKEIUWERSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+][C@@H]1CCNC[C@H]1C ZINC000414940417 312068014 /nfs/dbraw/zinc/06/80/14/312068014.db2.gz KJEXTTSNEPZISI-CKEIUWERSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)(C)c1ccc(CNC[C@@H](N2CC[NH2+]CC2)C(F)(F)F)s1 ZINC000414972529 312069080 /nfs/dbraw/zinc/06/90/80/312069080.db2.gz JRBKYFBJBYBMDN-CYBMUJFWSA-N 1 3 349.466 2.971 10 0 EFAEHO CNCc1ccccc1NC(=O)N[C@H]1CC[N@H+](CC2CCCC2)C1 ZINC000415909062 312180395 /nfs/dbraw/zinc/18/03/95/312180395.db2.gz FMDBMNNAMBQWKE-KRWDZBQOSA-N 1 3 330.476 2.792 10 0 EFAEHO CNCc1ccccc1NC(=O)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000415909062 312180398 /nfs/dbraw/zinc/18/03/98/312180398.db2.gz FMDBMNNAMBQWKE-KRWDZBQOSA-N 1 3 330.476 2.792 10 0 EFAEHO CC[NH2+]Cc1ccccc1NC(=O)N(CCN(C)C)Cc1ccco1 ZINC000415952633 312184097 /nfs/dbraw/zinc/18/40/97/312184097.db2.gz JXPYNHRPMSNFET-UHFFFAOYSA-N 1 3 344.459 2.985 10 0 EFAEHO CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccc2c(c1F)CC[NH2+]C2 ZINC000415952077 312184256 /nfs/dbraw/zinc/18/42/56/312184256.db2.gz GXVINTZLUCSTCL-CABCVRRESA-N 1 3 346.450 2.562 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N(CCC[NH3+])Cc1ccccc1 ZINC000417530104 312235054 /nfs/dbraw/zinc/23/50/54/312235054.db2.gz HKZGSXHIBFKINB-QZTJIDSGSA-N 1 3 346.519 2.810 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)N(CCC[NH3+])Cc1ccccc1 ZINC000417530101 312235063 /nfs/dbraw/zinc/23/50/63/312235063.db2.gz HKZGSXHIBFKINB-HDICACEKSA-N 1 3 346.519 2.810 10 0 EFAEHO C[C@H](CCC[NH3+])NC(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000417728047 312262541 /nfs/dbraw/zinc/26/25/41/312262541.db2.gz AHMDJWOEJVTQRF-FMKPAKJESA-N 1 3 338.521 2.558 10 0 EFAEHO CCn1nncc1C[NH2+]CC1CCN(Cc2ccccc2Cl)CC1 ZINC000417915103 312294885 /nfs/dbraw/zinc/29/48/85/312294885.db2.gz SISPJUBSOHFEKB-UHFFFAOYSA-N 1 3 347.894 2.953 10 0 EFAEHO Cc1ccccc1[C@H]([C@H](C)NC(=O)N(C1CC1)[C@@H]1CC[NH2+]C1)N(C)C ZINC000418181178 312341323 /nfs/dbraw/zinc/34/13/23/312341323.db2.gz KWLFZSKVHBPVDZ-WDYCEAGBSA-N 1 3 344.503 2.522 10 0 EFAEHO CC(C)Cc1ccc([C@@H](CNC(=O)N2CC[C@H]([NH3+])[C@@H]2C)N(C)C)cc1 ZINC000418191714 312343769 /nfs/dbraw/zinc/34/37/69/312343769.db2.gz LEPVYPZEQUHEPD-ZYSHUDEJSA-N 1 3 346.519 2.619 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)N2CC[C@H]([NH3+])[C@@H]2C)N(CC)CC)cc1 ZINC000418213218 312348040 /nfs/dbraw/zinc/34/80/40/312348040.db2.gz KMXGTDGMPZFWMZ-SNRMKQJTSA-N 1 3 346.519 2.763 10 0 EFAEHO CCc1ccccc1[C@@H](N)CNC(=O)NCCCCC[NH+]1CCCC1 ZINC000418217761 312348853 /nfs/dbraw/zinc/34/88/53/312348853.db2.gz NMCOMLYCJIKYGZ-IBGZPJMESA-N 1 3 346.519 2.814 10 0 EFAEHO C[NH+](C)CC1CCC(NC(=O)C(C)(C)[C@@H](N)c2ccccc2)CC1 ZINC000423743312 312447388 /nfs/dbraw/zinc/44/73/88/312447388.db2.gz JZEKHHNTTZQZRS-VJFUWPCTSA-N 1 3 331.504 2.949 10 0 EFAEHO O[C@@H](CN1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)C1CCCCC1 ZINC000471024650 313138865 /nfs/dbraw/zinc/13/88/65/313138865.db2.gz CBPNOUYNPUCJKU-HBMCJLEFSA-N 1 3 328.500 2.991 10 0 EFAEHO O[C@@H](CN1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)C1CCCCC1 ZINC000471024650 313138867 /nfs/dbraw/zinc/13/88/67/313138867.db2.gz CBPNOUYNPUCJKU-HBMCJLEFSA-N 1 3 328.500 2.991 10 0 EFAEHO CN(C(=O)NCC1([NH+](C)C)CCCCCC1)[C@@H]1CCN(C2CC2)C1 ZINC000476382898 313232895 /nfs/dbraw/zinc/23/28/95/313232895.db2.gz YBOQRGJGAMNCLQ-QGZVFWFLSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]Cc2ccc(C(=O)NCCN3CCCC3)cc2)[C@@H]1C ZINC000495056714 314663829 /nfs/dbraw/zinc/66/38/29/314663829.db2.gz CXHLMIOQMYKUEZ-MDZRGWNJSA-N 1 3 329.488 2.646 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)[NH+]1CCCC1 ZINC000524188937 316149915 /nfs/dbraw/zinc/14/99/15/316149915.db2.gz OERJUPQWNCHNSQ-WMZOPIPTSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(C(=O)NCCN(C)C)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000527663273 316426242 /nfs/dbraw/zinc/42/62/42/316426242.db2.gz XWMQXSSSQNBPLW-CCKFTAQKSA-N 1 3 329.488 2.502 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(C(=O)NCCN(C)C)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000527663274 316426569 /nfs/dbraw/zinc/42/65/69/316426569.db2.gz XWMQXSSSQNBPLW-JVPBZIDWSA-N 1 3 329.488 2.502 10 0 EFAEHO O=C(NCCN1CCC2(CCCCC2)CC1)N[C@@H]1CC[NH2+]C12CCC2 ZINC000529331427 316857800 /nfs/dbraw/zinc/85/78/00/316857800.db2.gz RJYDYCBRHPUDEN-QGZVFWFLSA-N 1 3 348.535 2.617 10 0 EFAEHO CCc1cccc(OCCN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)c1 ZINC000530238096 317088408 /nfs/dbraw/zinc/08/84/08/317088408.db2.gz JQFGAWBUHREFND-HXUWFJFHSA-N 1 3 332.488 2.718 10 0 EFAEHO FC(F)Oc1cccc(CN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)c1 ZINC000530241458 317089202 /nfs/dbraw/zinc/08/92/02/317089202.db2.gz PYRBBSKYWVMYLE-QGZVFWFLSA-N 1 3 340.414 2.879 10 0 EFAEHO CC(C)c1ccc(NC(=O)C[C@H](C)[NH2+]CC2(O)CCN(C)CC2)cc1 ZINC000531978922 317338434 /nfs/dbraw/zinc/33/84/34/317338434.db2.gz HKBXJDIASAYONT-INIZCTEOSA-N 1 3 347.503 2.573 10 0 EFAEHO C[C@H](C(=O)N(C)CCC[NH+](C)C)N1CCC(Cc2ccccc2)CC1 ZINC000540516202 317746064 /nfs/dbraw/zinc/74/60/64/317746064.db2.gz SAKJKNPKNYGBQF-GOSISDBHSA-N 1 3 345.531 2.740 10 0 EFAEHO C[C@@H]([NH2+]CCCCN1C[C@@H](C)O[C@H](C)C1)c1cn2ccccc2n1 ZINC000551308599 318205698 /nfs/dbraw/zinc/20/56/98/318205698.db2.gz HWDGIVKHMYKPKK-BRWVUGGUSA-N 1 3 330.476 2.874 10 0 EFAEHO CN(C)[C@H](CNC(=O)[C@@H]1CCCCCC[C@H]1[NH3+])Cc1ccccc1 ZINC000564889483 318906699 /nfs/dbraw/zinc/90/66/99/318906699.db2.gz DMXDWDMIXSZNMR-IPMKNSEASA-N 1 3 331.504 2.573 10 0 EFAEHO CC(C)N1CCCN(C(=O)c2ccccc2CC2CC[NH2+]CC2)CC1 ZINC000566294869 319059043 /nfs/dbraw/zinc/05/90/43/319059043.db2.gz LBLSBJKZDWXLRV-UHFFFAOYSA-N 1 3 343.515 2.785 10 0 EFAEHO C[C@@H](C[NH+]1CCC(C)CC1)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000566505390 319084945 /nfs/dbraw/zinc/08/49/45/319084945.db2.gz VKOZBEUVHWXWCK-AWEZNQCLSA-N 1 3 348.466 2.713 10 0 EFAEHO C[C@@]1(C[NH3+])CCN(C(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000567146983 319142921 /nfs/dbraw/zinc/14/29/21/319142921.db2.gz FQUQVRGNIYNYBF-FQEVSTJZSA-N 1 3 344.503 2.553 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)NCc2ccccc2CN2CCCCC2)CC[NH2+]1 ZINC000575898487 319964196 /nfs/dbraw/zinc/96/41/96/319964196.db2.gz BCAUVPULJWLKNW-QFBILLFUSA-N 1 3 344.503 2.612 10 0 EFAEHO CN(CCC[NH+](C)C)C(=O)NCCN1CCC2(CCCCC2)CC1 ZINC000576337746 320006668 /nfs/dbraw/zinc/00/66/68/320006668.db2.gz KVTPRJUZYIXAQP-UHFFFAOYSA-N 1 3 338.540 2.626 10 0 EFAEHO C[NH+](C)CC[C@H](NC(=O)N1CCc2ccccc2[C@@H]1CN)C(C)(C)C ZINC000577847608 320150355 /nfs/dbraw/zinc/15/03/55/320150355.db2.gz YLIDETAHCBWGLC-ROUUACIJSA-N 1 3 346.519 2.621 10 0 EFAEHO CC(C)(C)[N@@H+]1CCCN(C(=O)Nc2ccc3c(c2F)CCNC3)CC1 ZINC000577941326 320158298 /nfs/dbraw/zinc/15/82/98/320158298.db2.gz XEFVHLHXZNGXCL-UHFFFAOYSA-N 1 3 348.466 2.810 10 0 EFAEHO CC(C)(C)[N@H+]1CCCN(C(=O)Nc2ccc3c(c2F)CCNC3)CC1 ZINC000577941326 320158300 /nfs/dbraw/zinc/15/83/00/320158300.db2.gz XEFVHLHXZNGXCL-UHFFFAOYSA-N 1 3 348.466 2.810 10 0 EFAEHO [NH3+][C@H]1C[C@H](N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)c2ccccc21 ZINC000578617097 320222093 /nfs/dbraw/zinc/22/20/93/320222093.db2.gz VPDSFJILXJUJTJ-PDWMJMLSSA-N 1 3 327.472 2.902 10 0 EFAEHO CC(C)N1C[C@H](N[C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1=O ZINC000578768446 320238383 /nfs/dbraw/zinc/23/83/83/320238383.db2.gz BTDQUZNHSSQIOB-RBUKOAKNSA-N 1 3 341.499 2.783 10 0 EFAEHO CC(C)N1C[C@H](N[C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1=O ZINC000578768446 320238385 /nfs/dbraw/zinc/23/83/85/320238385.db2.gz BTDQUZNHSSQIOB-RBUKOAKNSA-N 1 3 341.499 2.783 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)N(C)CCC[NH+](C)C)N2CCCC2)cc1 ZINC000185804360 323398499 /nfs/dbraw/zinc/39/84/99/323398499.db2.gz IAVJXKLBHYRXGC-LJQANCHMSA-N 1 3 346.519 2.725 10 0 EFAEHO COC[C@H](C)C[NH2+]CCCCN1CCN(c2cccc(C)c2)CC1 ZINC000187645667 323424838 /nfs/dbraw/zinc/42/48/38/323424838.db2.gz PDSXJVXCDSQSLR-LJQANCHMSA-N 1 3 333.520 2.769 10 0 EFAEHO C[C@H]([NH3+])C[C@H](C)NC(=O)NCc1ccccc1CN1CCCCC1 ZINC000580548817 324185897 /nfs/dbraw/zinc/18/58/97/324185897.db2.gz LCMAAKDDVWBRKQ-HOTGVXAUSA-N 1 3 332.492 2.598 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@H]3CC4CCC3CC4)CC2)CC1 ZINC000580655796 324207606 /nfs/dbraw/zinc/20/76/06/324207606.db2.gz DYMKHQUHNMKORL-UHYCVJNDSA-N 1 3 347.547 2.878 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@@H]3CC4CCC3CC4)CC2)CC1 ZINC000580655795 324207885 /nfs/dbraw/zinc/20/78/85/324207885.db2.gz DYMKHQUHNMKORL-LBXVMSDZSA-N 1 3 347.547 2.878 10 0 EFAEHO C[C@H]1[C@@H]([NH3+])CCN1C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000581180550 324321459 /nfs/dbraw/zinc/32/14/59/324321459.db2.gz RYCKSGSQQJJYCH-WDSOQIARSA-N 1 3 344.503 2.591 10 0 EFAEHO C[C@H]1[C@@H]([NH3+])CCN1C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000581180554 324321714 /nfs/dbraw/zinc/32/17/14/324321714.db2.gz RYCKSGSQQJJYCH-YTQUADARSA-N 1 3 344.503 2.591 10 0 EFAEHO CC[NH+](CC)[C@@H](C)CNC(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000111816734 473229537 /nfs/dbraw/zinc/22/95/37/473229537.db2.gz YEGULEHGXNRTRA-SJORKVTESA-N 1 3 334.508 2.536 10 0 EFAEHO CCC[C@H](C(=O)NC[C@H](c1ccsc1)N(CC)CC)N(C)C ZINC000161566134 473244564 /nfs/dbraw/zinc/24/45/64/473244564.db2.gz ZIEXJMQOFUZFPW-HZPDHXFCSA-N 1 3 325.522 2.978 10 0 EFAEHO CCC[C@H](C(=O)NC[C@H](c1ccsc1)N(CC)CC)[NH+](C)C ZINC000161566134 473244566 /nfs/dbraw/zinc/24/45/66/473244566.db2.gz ZIEXJMQOFUZFPW-HZPDHXFCSA-N 1 3 325.522 2.978 10 0 EFAEHO Nc1ccc(F)c(NC(=O)CCN2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000171138831 473298842 /nfs/dbraw/zinc/29/88/42/473298842.db2.gz PUVSYQYWXCYKSF-UHFFFAOYSA-N 1 3 348.466 2.544 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NCCN(C)Cc2ccccc2)CC1 ZINC000171169950 473308383 /nfs/dbraw/zinc/30/83/83/473308383.db2.gz LMQLXMMEFJBRRF-UHFFFAOYSA-N 1 3 346.519 2.540 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N(C[C@H]1CCC[NH2+]1)C1CC1 ZINC000190744022 473381316 /nfs/dbraw/zinc/38/13/16/473381316.db2.gz MKOQDJDWJZLETP-GOSISDBHSA-N 1 3 327.472 2.639 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]Cc2cncc(OC)c2C)[C@H](C)C1 ZINC000631074246 479878621 /nfs/dbraw/zinc/87/86/21/479878621.db2.gz WIXPSHGUQREQNZ-QAPCUYQASA-N 1 3 335.492 2.625 10 0 EFAEHO C[C@@H]1OCC[C@H]1N(CCO)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000411658599 477314544 /nfs/dbraw/zinc/31/45/44/477314544.db2.gz CQPANGNYPFXANP-FXAWDEMLSA-N 1 3 332.488 2.644 10 0 EFAEHO CN(c1ccccc1CN1CC2(C1)CCOCC2)C1CC[NH+](C)CC1 ZINC000459624561 478014800 /nfs/dbraw/zinc/01/48/00/478014800.db2.gz TVIYECRQIFVBJG-UHFFFAOYSA-N 1 3 343.515 2.829 10 0 EFAEHO Cc1ccc(COc2cccc(C[NH2+]CCCNCCO)c2)cc1 ZINC000013733224 471840676 /nfs/dbraw/zinc/84/06/76/471840676.db2.gz FPOWXZPTZFCTFC-UHFFFAOYSA-N 1 3 328.456 2.636 10 0 EFAEHO C[N@H+](CC1CCN(C[C@H](O)c2ccccc2)CC1)C[C@@H]1CCCCO1 ZINC000069490233 472354473 /nfs/dbraw/zinc/35/44/73/472354473.db2.gz WUWBDSDDWDHEQZ-SFTDATJTSA-N 1 3 346.515 2.933 10 0 EFAEHO C[N@@H+](CC1CCN(C[C@H](O)c2ccccc2)CC1)C[C@@H]1CCCCO1 ZINC000069490233 472354478 /nfs/dbraw/zinc/35/44/78/472354478.db2.gz WUWBDSDDWDHEQZ-SFTDATJTSA-N 1 3 346.515 2.933 10 0 EFAEHO C[NH+](C)CCOc1ccc(CNCc2cccc3c2CCOC3)cc1 ZINC000631244885 479982640 /nfs/dbraw/zinc/98/26/40/479982640.db2.gz GVCKHBTVHFRMEL-UHFFFAOYSA-N 1 3 340.467 2.990 10 0 EFAEHO C[C@@H](CNC(=O)N[C@H](CN(C)C)c1ccccc1)C[NH+]1CCCCC1 ZINC000057042582 472377554 /nfs/dbraw/zinc/37/75/54/472377554.db2.gz ZOXPOYDDZKBFPY-PKOBYXMFSA-N 1 3 346.519 2.711 10 0 EFAEHO CCN1CCN(c2ccccc2C[NH2+]CCc2csc(C)n2)CC1 ZINC000088678184 472380402 /nfs/dbraw/zinc/38/04/02/472380402.db2.gz XDGDRWYSCYNOIK-UHFFFAOYSA-N 1 3 344.528 2.926 10 0 EFAEHO CC(C)[N@H+]1C[C@H](Nc2cccc(CN3CCC(O)CC3)c2)[C@@H](C)C1 ZINC000088726231 472381604 /nfs/dbraw/zinc/38/16/04/472381604.db2.gz PEYFKWGZBTZVPI-JXFKEZNVSA-N 1 3 331.504 2.784 10 0 EFAEHO CC(C)[N@@H+]1C[C@H](Nc2cccc(CN3CCC(O)CC3)c2)[C@@H](C)C1 ZINC000088726231 472381607 /nfs/dbraw/zinc/38/16/07/472381607.db2.gz PEYFKWGZBTZVPI-JXFKEZNVSA-N 1 3 331.504 2.784 10 0 EFAEHO C[NH+](C)C[C@H]1CCCCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000069950874 472473523 /nfs/dbraw/zinc/47/35/23/472473523.db2.gz NZRMOCKRDLSWAS-LJQANCHMSA-N 1 3 329.488 2.839 10 0 EFAEHO CC[NH+](CC)[C@@H](C)CNC(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000046280351 472539409 /nfs/dbraw/zinc/53/94/09/472539409.db2.gz REYTUNBKOOPSLJ-SFHVURJKSA-N 1 3 346.519 2.634 10 0 EFAEHO CCC[C@H](C(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)N(C)C ZINC000119314072 472546247 /nfs/dbraw/zinc/54/62/47/472546247.db2.gz WMYWWYPUYAPJIR-INMHGKMJSA-N 1 3 337.533 2.978 10 0 EFAEHO CCC[C@H](C(=O)NC[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)N(C)C ZINC000119314072 472546251 /nfs/dbraw/zinc/54/62/51/472546251.db2.gz WMYWWYPUYAPJIR-INMHGKMJSA-N 1 3 337.533 2.978 10 0 EFAEHO C[C@@H](CN[C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000631269184 479996216 /nfs/dbraw/zinc/99/62/16/479996216.db2.gz IGVHDCXCVKEBLJ-HOCLYGCPSA-N 1 3 338.517 2.656 10 0 EFAEHO C[C@@H](CN[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000631269184 479996222 /nfs/dbraw/zinc/99/62/22/479996222.db2.gz IGVHDCXCVKEBLJ-HOCLYGCPSA-N 1 3 338.517 2.656 10 0 EFAEHO C[C@@H](NC(=O)N(CCN(C)C)CC[NH+](C)C)c1cccc(Cl)c1 ZINC000077753086 472602096 /nfs/dbraw/zinc/60/20/96/472602096.db2.gz AYUHXOCXDWQSBE-CQSZACIVSA-N 1 3 340.899 2.536 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000077793527 472615562 /nfs/dbraw/zinc/61/55/62/472615562.db2.gz JXKLSFICCORXOB-MJGOQNOKSA-N 1 3 346.519 2.853 10 0 EFAEHO CCCN1CCCN(C(=O)C2CCN(c3cc[nH+]cc3C)CC2)CC1 ZINC000072307124 472660477 /nfs/dbraw/zinc/66/04/77/472660477.db2.gz LYDQTXLJTGQDRW-UHFFFAOYSA-N 1 3 344.503 2.551 10 0 EFAEHO COc1cc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)N3C)cc(OC)c1OC ZINC000131820550 472696135 /nfs/dbraw/zinc/69/61/35/472696135.db2.gz YIMUNOJRWUGBRE-MQVJKMGUSA-N 1 3 334.460 2.817 10 0 EFAEHO O=C(CCN1CCC(C[NH+]2CCCC2)CC1)Nc1ccc(F)cc1 ZINC000047973079 472790287 /nfs/dbraw/zinc/79/02/87/472790287.db2.gz RNEZCEKNWZDOGA-UHFFFAOYSA-N 1 3 333.451 2.962 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@H](OC)C2)CC1 ZINC000091772518 472805200 /nfs/dbraw/zinc/80/52/00/472805200.db2.gz ZNZWBOJANSISKY-IBGZPJMESA-N 1 3 331.504 2.829 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@H](OC)C2)CC1 ZINC000091772518 472805206 /nfs/dbraw/zinc/80/52/06/472805206.db2.gz ZNZWBOJANSISKY-IBGZPJMESA-N 1 3 331.504 2.829 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)N(CCN(C)C)CC(C)C)CC1 ZINC000073427032 472809367 /nfs/dbraw/zinc/80/93/67/472809367.db2.gz BSZCMJKXSGZREX-UHFFFAOYSA-N 1 3 346.519 2.653 10 0 EFAEHO Cc1[nH]c2c(cccc2C[N@@H+]2C[C@H](CO)[C@H](CN3CCCC3)C2)c1C ZINC000091973695 472834913 /nfs/dbraw/zinc/83/49/13/472834913.db2.gz PBNRLVQOPVSLEV-RTBURBONSA-N 1 3 341.499 2.921 10 0 EFAEHO Cc1[nH]c2c(cccc2C[N@H+]2C[C@H](CO)[C@H](CN3CCCC3)C2)c1C ZINC000091973695 472834918 /nfs/dbraw/zinc/83/49/18/472834918.db2.gz PBNRLVQOPVSLEV-RTBURBONSA-N 1 3 341.499 2.921 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N1CC[C@@H](N(C)Cc2ccccc2)C1 ZINC000073654312 472848001 /nfs/dbraw/zinc/84/80/01/472848001.db2.gz FOKYVNAEOSLJAY-IEBWSBKVSA-N 1 3 346.519 2.633 10 0 EFAEHO c1ncn(-c2ccc(CN3CC[C@H]4[C@H](CCC[N@@H+]4C4CC4)C3)cc2)n1 ZINC000092066922 472849957 /nfs/dbraw/zinc/84/99/57/472849957.db2.gz AXCZFVWQTNRFRI-XLIONFOSSA-N 1 3 337.471 2.716 10 0 EFAEHO c1ncn(-c2ccc(CN3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)cc2)n1 ZINC000092066922 472849962 /nfs/dbraw/zinc/84/99/62/472849962.db2.gz AXCZFVWQTNRFRI-XLIONFOSSA-N 1 3 337.471 2.716 10 0 EFAEHO C[C@H](CNC(=O)NC1CCC(C[NH+](C)C)CC1)N1CCC(C)CC1 ZINC000121928371 472946908 /nfs/dbraw/zinc/94/69/08/472946908.db2.gz BDCMUXWATNUPKV-WWDZGPRUSA-N 1 3 338.540 2.526 10 0 EFAEHO CN(CCC1CCN(c2cc[nH+]cc2)CC1)CC(=O)NC(C)(C)C ZINC000092821128 472989945 /nfs/dbraw/zinc/98/99/45/472989945.db2.gz JEAYBBUXCJKJLB-UHFFFAOYSA-N 1 3 332.492 2.535 10 0 EFAEHO CCC(C)(C)NC(=O)CN(C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000092821531 472990055 /nfs/dbraw/zinc/99/00/55/472990055.db2.gz CLZDQBCSGYSWRZ-UHFFFAOYSA-N 1 3 346.519 2.925 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000620192733 480023067 /nfs/dbraw/zinc/02/30/67/480023067.db2.gz SIEVDJOQBNWVHS-LJQANCHMSA-N 1 3 343.515 2.747 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000620192733 480023073 /nfs/dbraw/zinc/02/30/73/480023073.db2.gz SIEVDJOQBNWVHS-LJQANCHMSA-N 1 3 343.515 2.747 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000620192495 480023120 /nfs/dbraw/zinc/02/31/20/480023120.db2.gz NLSNHRLMENNRMF-LJQANCHMSA-N 1 3 343.515 2.745 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000620192495 480023125 /nfs/dbraw/zinc/02/31/25/480023125.db2.gz NLSNHRLMENNRMF-LJQANCHMSA-N 1 3 343.515 2.745 10 0 EFAEHO CN(C(=O)CCN1CCC(C[NH+]2CCCC2)CC1)c1ccccc1 ZINC000134990551 473003993 /nfs/dbraw/zinc/00/39/93/473003993.db2.gz MIGMCDQQCPTMCN-UHFFFAOYSA-N 1 3 329.488 2.847 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2CCCN2Cc2ccccc2)CC[N@@H+]1C ZINC000122720727 473050118 /nfs/dbraw/zinc/05/01/18/473050118.db2.gz AZNQTAUBCWVQBJ-NEWSRXKRSA-N 1 3 329.488 2.592 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2CCCN2Cc2ccccc2)CC[N@H+]1C ZINC000122720727 473050123 /nfs/dbraw/zinc/05/01/23/473050123.db2.gz AZNQTAUBCWVQBJ-NEWSRXKRSA-N 1 3 329.488 2.592 10 0 EFAEHO CCC[NH+]1CCC(CN[C@H](C)c2ccc(S(C)(=O)=O)cc2)CC1 ZINC000122806328 473060219 /nfs/dbraw/zinc/06/02/19/473060219.db2.gz OWQHXQMOUDHAJC-OAHLLOKOSA-N 1 3 338.517 2.863 10 0 EFAEHO CN1CCC[C@H](NC(=O)NCC2([NH+]3CCCCC3)CCCCC2)C1 ZINC000052498623 473113351 /nfs/dbraw/zinc/11/33/51/473113351.db2.gz SBKLZMVHEASPBQ-KRWDZBQOSA-N 1 3 336.524 2.569 10 0 EFAEHO CN1CCC[C@@H](NC(=O)NCC2([NH+]3CCCCC3)CCCCC2)C1 ZINC000052498624 473114144 /nfs/dbraw/zinc/11/41/44/473114144.db2.gz SBKLZMVHEASPBQ-QGZVFWFLSA-N 1 3 336.524 2.569 10 0 EFAEHO CN1CCC[C@@H](NC(=O)NCc2ccccc2C[NH+]2CCCCC2)C1 ZINC000052518959 473116539 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CC[C@@H]([NH2+]C[C@@H]1CCN(CC)C1)c1ccccc1OCC(=O)N(C)C ZINC000163283118 473429540 /nfs/dbraw/zinc/42/95/40/473429540.db2.gz DBQKFHYTUPHCBM-FUHWJXTLSA-N 1 3 347.503 2.536 10 0 EFAEHO CC(C)[NH+]1CCC(NC(=O)CN2CCC[C@]3(CC=CCC3)C2)CC1 ZINC000114494626 473476191 /nfs/dbraw/zinc/47/61/91/473476191.db2.gz HRZKOGLYKJPDAD-HXUWFJFHSA-N 1 3 333.520 2.798 10 0 EFAEHO C[C@H]([NH2+][C@H]1Cc2ccccc2[C@@H]1O)c1cccc(OCCN(C)C)c1 ZINC000178356143 473497659 /nfs/dbraw/zinc/49/76/59/473497659.db2.gz KVBWEYIUTCUTDL-JHVJFLLYSA-N 1 3 340.467 2.936 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000166145995 473521466 /nfs/dbraw/zinc/52/14/66/473521466.db2.gz XVFYJZFXQREUTO-CTNGQTDRSA-N 1 3 345.531 2.772 10 0 EFAEHO CN1CCCN(CCC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000166510090 473527897 /nfs/dbraw/zinc/52/78/97/473527897.db2.gz VOPWMZYGFAVIMZ-FPOVZHCZSA-N 1 3 345.531 2.772 10 0 EFAEHO COc1ccccc1CC[N@H+](C)CCCN1CCN(C(C)C)CC1 ZINC000191481553 473544809 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EFAEHO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)Nc1cccc(CN(C)C)c1 ZINC000179234620 473660056 /nfs/dbraw/zinc/66/00/56/473660056.db2.gz BHSRFXGVHJRGSZ-GOSISDBHSA-N 1 3 332.492 2.990 10 0 EFAEHO CC(C)[NH2+]C1CCN(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CC1 ZINC000179474879 473689590 /nfs/dbraw/zinc/68/95/90/473689590.db2.gz ZCQHCDBVCOUQIA-RBUKOAKNSA-N 1 3 344.503 2.604 10 0 EFAEHO CN(C)Cc1cccc(CNC(=O)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC000172826227 473689599 /nfs/dbraw/zinc/68/95/99/473689599.db2.gz KQSPPBBIBFYMLG-YQQQUEKLSA-N 1 3 344.503 2.563 10 0 EFAEHO CN(C)Cc1cccc(CNC(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC000172826227 473689601 /nfs/dbraw/zinc/68/96/01/473689601.db2.gz KQSPPBBIBFYMLG-YQQQUEKLSA-N 1 3 344.503 2.563 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]3CCCC[C@H]3[NH2+]2)CN1Cc1ccccc1 ZINC000262655649 473707054 /nfs/dbraw/zinc/70/70/54/473707054.db2.gz CNMFJCYHGQBFJL-PKOFMYQESA-N 1 3 341.499 2.686 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3[NH2+]2)N(C)C)cc1 ZINC000262667377 473707429 /nfs/dbraw/zinc/70/74/29/473707429.db2.gz PYWCESXFKCNVOT-XWSJACJDSA-N 1 3 329.488 2.635 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000245606127 473724892 /nfs/dbraw/zinc/72/48/92/473724892.db2.gz AEMAXYULAUDHDM-CEXWTWQISA-N 1 3 344.503 2.558 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000245606127 473724899 /nfs/dbraw/zinc/72/48/99/473724899.db2.gz AEMAXYULAUDHDM-CEXWTWQISA-N 1 3 344.503 2.558 10 0 EFAEHO CC[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NCC(C)(C)N1CCCCC1 ZINC000246193499 473796465 /nfs/dbraw/zinc/79/64/65/473796465.db2.gz MNHWWXRBWSYUQF-IRXDYDNUSA-N 1 3 336.524 2.519 10 0 EFAEHO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCC(C)(C)N1CCCCC1 ZINC000246193499 473796474 /nfs/dbraw/zinc/79/64/74/473796474.db2.gz MNHWWXRBWSYUQF-IRXDYDNUSA-N 1 3 336.524 2.519 10 0 EFAEHO CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000173333396 473809159 /nfs/dbraw/zinc/80/91/59/473809159.db2.gz HFLSGIBHASETPX-QZTJIDSGSA-N 1 3 330.476 2.839 10 0 EFAEHO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000173333396 473809168 /nfs/dbraw/zinc/80/91/68/473809168.db2.gz HFLSGIBHASETPX-QZTJIDSGSA-N 1 3 330.476 2.839 10 0 EFAEHO C[C@@H](CO[C@H]1CCOC1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180160255 473815354 /nfs/dbraw/zinc/81/53/54/473815354.db2.gz VOOBCLHCFGHEHL-XCDJFROHSA-N 1 3 344.499 2.966 10 0 EFAEHO C[C@@H](CO[C@H]1CCOC1)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180160255 473815361 /nfs/dbraw/zinc/81/53/61/473815361.db2.gz VOOBCLHCFGHEHL-XCDJFROHSA-N 1 3 344.499 2.966 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1 ZINC000246365175 473841087 /nfs/dbraw/zinc/84/10/87/473841087.db2.gz PYTLTTVXIKWKTN-QFBILLFUSA-N 1 3 346.519 2.762 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1 ZINC000246365175 473841094 /nfs/dbraw/zinc/84/10/94/473841094.db2.gz PYTLTTVXIKWKTN-QFBILLFUSA-N 1 3 346.519 2.762 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)NCCC[N@H+](C)Cc2ccccc2)CCN1C ZINC000173535788 473870592 /nfs/dbraw/zinc/87/05/92/473870592.db2.gz QELUYDOBNHGCRP-MJGOQNOKSA-N 1 3 346.519 2.633 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)NCCC[N@@H+](C)Cc2ccccc2)CCN1C ZINC000173535788 473870596 /nfs/dbraw/zinc/87/05/96/473870596.db2.gz QELUYDOBNHGCRP-MJGOQNOKSA-N 1 3 346.519 2.633 10 0 EFAEHO CN1CCO[C@H]([C@H](NCCCC[NH+](C)C)c2ccc(Cl)cc2)C1 ZINC000274553106 473873690 /nfs/dbraw/zinc/87/36/90/473873690.db2.gz DXDNEMQAKJEVOR-ZWKOTPCHSA-N 1 3 339.911 2.643 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NCC(C)(C)N2CCCCC2)[C@@H](C)C1 ZINC000246479293 473876625 /nfs/dbraw/zinc/87/66/25/473876625.db2.gz QRKXPCIGCGSRLY-IRXDYDNUSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NCC(C)(C)N2CCCCC2)[C@@H](C)C1 ZINC000246479293 473876630 /nfs/dbraw/zinc/87/66/30/473876630.db2.gz QRKXPCIGCGSRLY-IRXDYDNUSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)N[C@H](CN(C)C)c2ccccc2)CC1 ZINC000173561641 473877608 /nfs/dbraw/zinc/87/76/08/473877608.db2.gz UHAMXGGXMAGAJJ-LJQANCHMSA-N 1 3 346.519 2.711 10 0 EFAEHO CN(C)C(=O)c1cccc(C[N@@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)c1 ZINC000246535267 473891905 /nfs/dbraw/zinc/89/19/05/473891905.db2.gz JOBFQUHMZNCGNL-AZUAARDMSA-N 1 3 341.499 2.837 10 0 EFAEHO CN(C)C(=O)c1cccc(C[N@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)c1 ZINC000246535267 473891908 /nfs/dbraw/zinc/89/19/08/473891908.db2.gz JOBFQUHMZNCGNL-AZUAARDMSA-N 1 3 341.499 2.837 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)NC[C@H](C2CCCCC2)[NH+](C)C)CCN1C ZINC000246544115 473896701 /nfs/dbraw/zinc/89/67/01/473896701.db2.gz YIFOBPALXGTNSD-KBAYOESNSA-N 1 3 338.540 2.621 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)CC(C)C ZINC000173688450 473913893 /nfs/dbraw/zinc/91/38/93/473913893.db2.gz ZPULGLVZUMTQGN-KURKYZTESA-N 1 3 340.556 2.867 10 0 EFAEHO CC(C)[N@@H+]1C[C@H](C)[C@H](NC(=O)c2oc3ccccc3c2CN(C)C)C1 ZINC000246720814 473942093 /nfs/dbraw/zinc/94/20/93/473942093.db2.gz ACYHDDMRBSFLKL-WMLDXEAASA-N 1 3 343.471 2.953 10 0 EFAEHO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2oc3ccccc3c2CN(C)C)C1 ZINC000246720814 473942097 /nfs/dbraw/zinc/94/20/97/473942097.db2.gz ACYHDDMRBSFLKL-WMLDXEAASA-N 1 3 343.471 2.953 10 0 EFAEHO CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)NC[C@H](C)N(C)Cc2ccccc2)C1 ZINC000246732590 473945533 /nfs/dbraw/zinc/94/55/33/473945533.db2.gz APZDHLBOFBYGPN-AOIWGVFYSA-N 1 3 346.519 2.535 10 0 EFAEHO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NC[C@H](C)N(C)Cc2ccccc2)C1 ZINC000246732590 473945542 /nfs/dbraw/zinc/94/55/42/473945542.db2.gz APZDHLBOFBYGPN-AOIWGVFYSA-N 1 3 346.519 2.535 10 0 EFAEHO CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000246905001 474000331 /nfs/dbraw/zinc/00/03/31/474000331.db2.gz HTBVNPZPUIPZAN-UXHICEINSA-N 1 3 341.499 2.981 10 0 EFAEHO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000246905001 474000332 /nfs/dbraw/zinc/00/03/32/474000332.db2.gz HTBVNPZPUIPZAN-UXHICEINSA-N 1 3 341.499 2.981 10 0 EFAEHO CC[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000246904983 474000492 /nfs/dbraw/zinc/00/04/92/474000492.db2.gz HTBVNPZPUIPZAN-PMACEKPBSA-N 1 3 341.499 2.981 10 0 EFAEHO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000246904983 474000497 /nfs/dbraw/zinc/00/04/97/474000497.db2.gz HTBVNPZPUIPZAN-PMACEKPBSA-N 1 3 341.499 2.981 10 0 EFAEHO CCN1CC[C@H](C[NH2+][C@H](C)c2ccc(OCCOC)c(OC)c2)C1 ZINC000246989236 474026677 /nfs/dbraw/zinc/02/66/77/474026677.db2.gz KDBRPCMQMGYNPU-HZPDHXFCSA-N 1 3 336.476 2.713 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1)C(C)C ZINC000174352714 474027365 /nfs/dbraw/zinc/02/73/65/474027365.db2.gz JCSHUBFVLJHGCW-IRXDYDNUSA-N 1 3 326.529 2.619 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CC[C@@H]([NH+]2CCCCC2)C1 ZINC000264592058 474051904 /nfs/dbraw/zinc/05/19/04/474051904.db2.gz LSDLOUXTCPHNEK-HXUWFJFHSA-N 1 3 341.499 2.983 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N[C@H]2C[N@H+](C(C)C)C[C@H]2C)N(C)C)cc1 ZINC000247282796 474108841 /nfs/dbraw/zinc/10/88/41/474108841.db2.gz KKCBVBIHNAJJLU-NEWSRXKRSA-N 1 3 346.519 2.626 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N[C@H]2C[N@@H+](C(C)C)C[C@H]2C)N(C)C)cc1 ZINC000247282796 474108848 /nfs/dbraw/zinc/10/88/48/474108848.db2.gz KKCBVBIHNAJJLU-NEWSRXKRSA-N 1 3 346.519 2.626 10 0 EFAEHO CC[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000247359699 474128549 /nfs/dbraw/zinc/12/85/49/474128549.db2.gz HFLSGIBHASETPX-ROUUACIJSA-N 1 3 330.476 2.839 10 0 EFAEHO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000247359699 474128553 /nfs/dbraw/zinc/12/85/53/474128553.db2.gz HFLSGIBHASETPX-ROUUACIJSA-N 1 3 330.476 2.839 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)NCCCCC[NH+]2CCCCC2)CCN1C ZINC000175136699 474148536 /nfs/dbraw/zinc/14/85/36/474148536.db2.gz OVHIXDPNCRACBI-MSOLQXFVSA-N 1 3 338.540 2.767 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000175188953 474156129 /nfs/dbraw/zinc/15/61/29/474156129.db2.gz ATVHYVJNKXKBDI-UHFFFAOYSA-N 1 3 329.488 2.696 10 0 EFAEHO Cc1cc(CNC2CC[NH+](C3CCN(C)CC3)CC2)cc(C)c1O ZINC000289195429 474179312 /nfs/dbraw/zinc/17/93/12/474179312.db2.gz HFMXUZUTUYUBNC-UHFFFAOYSA-N 1 3 331.504 2.657 10 0 EFAEHO CCN(CC)CCC[NH2+]C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000227657404 474245166 /nfs/dbraw/zinc/24/51/66/474245166.db2.gz IEHRMRVRKDNNBE-INIZCTEOSA-N 1 3 327.513 2.955 10 0 EFAEHO CCN(CC)CCC[NH2+]C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000227657408 474245294 /nfs/dbraw/zinc/24/52/94/474245294.db2.gz IEHRMRVRKDNNBE-MRXNPFEDSA-N 1 3 327.513 2.955 10 0 EFAEHO C[C@@H]1CN(c2ccccc2C[NH2+]C[C@H]2CCN(C3CC3)C2)C[C@@H](C)O1 ZINC000229873024 474256061 /nfs/dbraw/zinc/25/60/61/474256061.db2.gz WAZKSGNLJWEUBU-KZNAEPCWSA-N 1 3 343.515 2.874 10 0 EFAEHO C[C@H]([NH2+][C@H]1Cc2ccccc2[C@H]1O)c1ccc(OCCN(C)C)cc1 ZINC000248216342 474283653 /nfs/dbraw/zinc/28/36/53/474283653.db2.gz ZSJHYYVLRBOTEN-ONGXBYRLSA-N 1 3 340.467 2.936 10 0 EFAEHO CC(C)NC(=O)CC[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000248400099 474306591 /nfs/dbraw/zinc/30/65/91/474306591.db2.gz KNBSNWBGUFIMLD-VAMGGRTRSA-N 1 3 343.515 2.791 10 0 EFAEHO CC(C)NC(=O)CCN[C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248400099 474306598 /nfs/dbraw/zinc/30/65/98/474306598.db2.gz KNBSNWBGUFIMLD-VAMGGRTRSA-N 1 3 343.515 2.791 10 0 EFAEHO CC(C)NC(=O)CCN[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248400099 474306603 /nfs/dbraw/zinc/30/66/03/474306603.db2.gz KNBSNWBGUFIMLD-VAMGGRTRSA-N 1 3 343.515 2.791 10 0 EFAEHO CN(C)C[C@H](Cc1ccccc1)NC(=O)CC[C@@H]([NH3+])c1ccccc1 ZINC000237026005 474324131 /nfs/dbraw/zinc/32/41/31/474324131.db2.gz LQKVSIFJFFKFRY-VQTJNVASSA-N 1 3 339.483 2.756 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)C2CCN(Cc3ccccc3)CC2)CC[N@@H+]1C ZINC000265915175 474383619 /nfs/dbraw/zinc/38/36/19/474383619.db2.gz AJQSERUCNZSYIB-PXNSSMCTSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)C2CCN(Cc3ccccc3)CC2)CC[N@H+]1C ZINC000265915175 474383624 /nfs/dbraw/zinc/38/36/24/474383624.db2.gz AJQSERUCNZSYIB-PXNSSMCTSA-N 1 3 343.515 2.840 10 0 EFAEHO CCN(C)C(=O)[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000248747229 474423763 /nfs/dbraw/zinc/42/37/63/474423763.db2.gz BFJJARNFFBUCGE-OWYHZJEWSA-N 1 3 329.488 2.638 10 0 EFAEHO COCCN1CC[C@H]([NH2+]C[C@H]2CCCCN(Cc3ccccc3)C2)C1 ZINC000289784343 474425271 /nfs/dbraw/zinc/42/52/71/474425271.db2.gz KUIHOUOREBRPLX-RTWAWAEBSA-N 1 3 345.531 2.599 10 0 EFAEHO COCCN1CC[C@H](NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)C1 ZINC000289784343 474425276 /nfs/dbraw/zinc/42/52/76/474425276.db2.gz KUIHOUOREBRPLX-RTWAWAEBSA-N 1 3 345.531 2.599 10 0 EFAEHO COCCN1CC[C@H](NC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000289784343 474425282 /nfs/dbraw/zinc/42/52/82/474425282.db2.gz KUIHOUOREBRPLX-RTWAWAEBSA-N 1 3 345.531 2.599 10 0 EFAEHO C[N@H+](C[C@@H]1CCN(Cc2ccccc2)C1)C[C@H]1CC2(CCC2)C(=O)O1 ZINC000248846906 474455645 /nfs/dbraw/zinc/45/56/45/474455645.db2.gz NKSMJROAWQKVJM-RBUKOAKNSA-N 1 3 342.483 2.926 10 0 EFAEHO C[N@@H+](C[C@@H]1CCN(Cc2ccccc2)C1)C[C@H]1CC2(CCC2)C(=O)O1 ZINC000248846906 474455651 /nfs/dbraw/zinc/45/56/51/474455651.db2.gz NKSMJROAWQKVJM-RBUKOAKNSA-N 1 3 342.483 2.926 10 0 EFAEHO C[C@@H](C(=O)N1CCC(C[NH+]2CCCC2)CC1)[C@H](N)c1ccccc1 ZINC000237694019 474459998 /nfs/dbraw/zinc/45/99/98/474459998.db2.gz IEFCODUVRIFGCB-APWZRJJASA-N 1 3 329.488 2.657 10 0 EFAEHO C[C@@H](CN1CCCC1=O)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000248876164 474466794 /nfs/dbraw/zinc/46/67/94/474466794.db2.gz JNTJTNPPPKPJNV-FFGOWVMKSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H](CN1CCCC1=O)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000248876164 474466802 /nfs/dbraw/zinc/46/68/02/474466802.db2.gz JNTJTNPPPKPJNV-FFGOWVMKSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H](CN1CCCC1=O)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000248876168 474467198 /nfs/dbraw/zinc/46/71/98/474467198.db2.gz JNTJTNPPPKPJNV-FRYIKTPZSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H](CN1CCCC1=O)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000248876168 474467203 /nfs/dbraw/zinc/46/72/03/474467203.db2.gz JNTJTNPPPKPJNV-FRYIKTPZSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1N[C@H]1CC(=O)N(C(C)(C)C)C1 ZINC000271430588 474542257 /nfs/dbraw/zinc/54/22/57/474542257.db2.gz BVDBUTLPELHLMY-NZSAHSFTSA-N 1 3 343.515 2.886 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1N[C@H]1CC(=O)N(C(C)(C)C)C1 ZINC000271430588 474542262 /nfs/dbraw/zinc/54/22/62/474542262.db2.gz BVDBUTLPELHLMY-NZSAHSFTSA-N 1 3 343.515 2.886 10 0 EFAEHO C[NH+](C)C1CCN(C(=O)C2(C)CCN(Cc3ccccc3)CC2)CC1 ZINC000184766371 474603078 /nfs/dbraw/zinc/60/30/78/474603078.db2.gz IFDYTWLHBRJHBH-UHFFFAOYSA-N 1 3 343.515 2.841 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCCCC[NH+]2C[C@H](C)C[C@@H](C)C2)C1 ZINC000249763543 474613376 /nfs/dbraw/zinc/61/33/76/474613376.db2.gz NETAYNTVQSKSCI-KURKYZTESA-N 1 3 338.540 2.528 10 0 EFAEHO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCCN2CCCN(C)CC2)cc1 ZINC000284345563 474624378 /nfs/dbraw/zinc/62/43/78/474624378.db2.gz MZSHRJPCNVZCQC-IOMROCGXSA-N 1 3 345.531 2.804 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)CC1CC[NH+](C)CC1 ZINC000273160627 474750112 /nfs/dbraw/zinc/75/01/12/474750112.db2.gz BXCZWYAEMKQQDZ-SFHVURJKSA-N 1 3 343.515 2.841 10 0 EFAEHO CC[NH+]1CCC(CCNCc2cnnn2Cc2ccccc2)CC1 ZINC000291935547 474759745 /nfs/dbraw/zinc/75/97/45/474759745.db2.gz MMLOYFOJTZIAQR-UHFFFAOYSA-N 1 3 327.476 2.538 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)c1 ZINC000623053303 480125013 /nfs/dbraw/zinc/12/50/13/480125013.db2.gz AMLVIVLCEOORSZ-WMZOPIPTSA-N 1 3 330.476 2.744 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)c1 ZINC000623053300 480125063 /nfs/dbraw/zinc/12/50/63/480125063.db2.gz AMLVIVLCEOORSZ-AEFFLSMTSA-N 1 3 330.476 2.744 10 0 EFAEHO CN(C)C[C@H]1CCCN1C(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000268087107 474790011 /nfs/dbraw/zinc/79/00/11/474790011.db2.gz FPRDJPJHDJXIKR-LJQANCHMSA-N 1 3 329.488 2.839 10 0 EFAEHO CC(C)[N@H+](C)Cc1cccc(CNC(=O)CC2CCN(C)CC2)c1 ZINC000292032378 474810017 /nfs/dbraw/zinc/81/00/17/474810017.db2.gz WWFMFIDBNFPKNA-UHFFFAOYSA-N 1 3 331.504 2.875 10 0 EFAEHO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)CC2CCN(C)CC2)c1 ZINC000292032378 474810026 /nfs/dbraw/zinc/81/00/26/474810026.db2.gz WWFMFIDBNFPKNA-UHFFFAOYSA-N 1 3 331.504 2.875 10 0 EFAEHO C[NH+]1CCC(CC(=O)NCC(C)(C)N2CCc3ccccc3C2)CC1 ZINC000273281668 474821979 /nfs/dbraw/zinc/82/19/79/474821979.db2.gz WUTYRMKSMJVPEY-UHFFFAOYSA-N 1 3 343.515 2.671 10 0 EFAEHO CCCCOC[C@H](O)C[NH2+][C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000310940883 474831341 /nfs/dbraw/zinc/83/13/41/474831341.db2.gz JQOZRFSJNZEFPO-DOIPELPJSA-N 1 3 346.515 2.664 10 0 EFAEHO CCCCOC[C@H](O)CN[C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000310940883 474831347 /nfs/dbraw/zinc/83/13/47/474831347.db2.gz JQOZRFSJNZEFPO-DOIPELPJSA-N 1 3 346.515 2.664 10 0 EFAEHO CCCCOC[C@H](O)CN[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000310940883 474831354 /nfs/dbraw/zinc/83/13/54/474831354.db2.gz JQOZRFSJNZEFPO-DOIPELPJSA-N 1 3 346.515 2.664 10 0 EFAEHO CN1CCCN(CCC[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000339069761 474898661 /nfs/dbraw/zinc/89/86/61/474898661.db2.gz VOPWMZYGFAVIMZ-CTNGQTDRSA-N 1 3 345.531 2.772 10 0 EFAEHO CC[C@@H](NCC(=O)NC1CC[NH+](C2CC2)CC1)c1ccc(C)cc1 ZINC000341037287 474903728 /nfs/dbraw/zinc/90/37/28/474903728.db2.gz KJQVTMSOKZIVJW-LJQANCHMSA-N 1 3 329.488 2.779 10 0 EFAEHO CN(C(=O)C1CC[NH+](C2CC2)CC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000278952947 474938345 /nfs/dbraw/zinc/93/83/45/474938345.db2.gz HJVGBQHCKDSICW-FQEVSTJZSA-N 1 3 341.499 2.594 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)NCCC[N@H+](C)C1CCCCC1 ZINC000337368021 474945673 /nfs/dbraw/zinc/94/56/73/474945673.db2.gz NFOPJTDEMVATGV-KRWDZBQOSA-N 1 3 338.540 2.815 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)NCCC[N@@H+](C)C1CCCCC1 ZINC000337368021 474945681 /nfs/dbraw/zinc/94/56/81/474945681.db2.gz NFOPJTDEMVATGV-KRWDZBQOSA-N 1 3 338.540 2.815 10 0 EFAEHO CC[NH+](CC)[C@@H](CNC(=O)NCCN1CCCC[C@@H]1C)CC(C)C ZINC000337391759 474971721 /nfs/dbraw/zinc/97/17/21/474971721.db2.gz ZWAMPJSLHFGFQS-ZWKOTPCHSA-N 1 3 340.556 2.917 10 0 EFAEHO O=C(NC1CCN(Cc2ccccc2)CC1)[C@@H]1C[C@H]2CCCC[C@H]2[NH2+]1 ZINC000261566609 474984786 /nfs/dbraw/zinc/98/47/86/474984786.db2.gz ZFUAZXVBMFIOJS-RLLQIKCJSA-N 1 3 341.499 2.688 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NCCN2[C@H](C)CCC[C@@H]2C)CC1 ZINC000341123697 474999386 /nfs/dbraw/zinc/99/93/86/474999386.db2.gz NTJZWUFAMJAOAA-CALCHBBNSA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CCCCN2CCOCC2)CCN1Cc1ccccc1 ZINC000268782074 475041437 /nfs/dbraw/zinc/04/14/37/475041437.db2.gz QEBTXGLZXISHMY-TZIWHRDSSA-N 1 3 345.531 2.742 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CCN(C2CC2)C1 ZINC000268798732 475041868 /nfs/dbraw/zinc/04/18/68/475041868.db2.gz GXNFOJNIIPBCQI-QFUCXCTJSA-N 1 3 327.516 2.971 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000341351829 475043626 /nfs/dbraw/zinc/04/36/26/475043626.db2.gz CMENELSPIOTOPK-SCTDSRPQSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000341351829 475043633 /nfs/dbraw/zinc/04/36/33/475043633.db2.gz CMENELSPIOTOPK-SCTDSRPQSA-N 1 3 346.519 2.851 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)CCN2CCc3ccccc3C2)CC1 ZINC000634123794 480140575 /nfs/dbraw/zinc/14/05/75/480140575.db2.gz WPIGXFFFOZWWFB-UHFFFAOYSA-N 1 3 343.515 2.768 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CC1(N(C)C)CCOCC1 ZINC000268885944 475051395 /nfs/dbraw/zinc/05/13/95/475051395.db2.gz MRZTUPGGHJYKST-AZUAARDMSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@@H](CN1CCCCC1)NC(=O)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000341454615 475053812 /nfs/dbraw/zinc/05/38/12/475053812.db2.gz CEEACSTUVVUEBT-ROUUACIJSA-N 1 3 336.524 2.521 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000341554303 475139518 /nfs/dbraw/zinc/13/95/18/475139518.db2.gz IRSDXRUCAPWQMY-FGTMMUONSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N1CCC(CC[NH+](C)C)CC1 ZINC000341561493 475145509 /nfs/dbraw/zinc/14/55/09/475145509.db2.gz SXFVBRICFBUZAT-IAGOWNOFSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@H]2CCC[C@H]([NH3+])C2)CCN1Cc1ccccc1 ZINC000262267221 475210447 /nfs/dbraw/zinc/21/04/47/475210447.db2.gz HOQLTVMFRANLTJ-XGXHKWSGSA-N 1 3 329.488 2.673 10 0 EFAEHO [NH3+][C@@H]1CCC[C@H](C(=O)NC[C@H]2CCCCN2Cc2ccccc2)C1 ZINC000262285864 475214456 /nfs/dbraw/zinc/21/44/56/475214456.db2.gz MIRFJCPRGBMAER-IPMKNSEASA-N 1 3 329.488 2.675 10 0 EFAEHO C[C@@H](C[NH3+])C(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000262333859 475221906 /nfs/dbraw/zinc/22/19/06/475221906.db2.gz HBJBWCFYLJZWLD-SFHVURJKSA-N 1 3 339.483 2.742 10 0 EFAEHO C[C@@H]1CCC[C@@](CNC(=O)NCCN2CCCC[C@@H]2C)([NH+](C)C)C1 ZINC000339449791 475222887 /nfs/dbraw/zinc/22/28/87/475222887.db2.gz UATOCKOTGIILGU-ZIFCJYIRSA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@@H]1CCC[C@](CNC(=O)NCCN2CCCC[C@@H]2C)([NH+](C)C)C1 ZINC000339449787 475222997 /nfs/dbraw/zinc/22/29/97/475222997.db2.gz UATOCKOTGIILGU-AOIWGVFYSA-N 1 3 338.540 2.671 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)CCN1CCc2ccccc2C1 ZINC000620622503 480155644 /nfs/dbraw/zinc/15/56/44/480155644.db2.gz UGUIVNQHJIEUAG-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)CCN1CCc2ccccc2C1 ZINC000620622503 480155650 /nfs/dbraw/zinc/15/56/50/480155650.db2.gz UGUIVNQHJIEUAG-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO O[C@H](CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)COCC1CC1 ZINC000347357024 475263130 /nfs/dbraw/zinc/26/31/30/475263130.db2.gz DWJRLELQCASLEY-OTYNDTSQSA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@H](CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)COCC1CC1 ZINC000347357024 475263136 /nfs/dbraw/zinc/26/31/36/475263136.db2.gz DWJRLELQCASLEY-OTYNDTSQSA-N 1 3 344.499 2.559 10 0 EFAEHO C[C@H](CCNC(=O)NCCN1[C@@H](C)CCC[C@@H]1C)[NH+]1CCCCC1 ZINC000345559042 475265080 /nfs/dbraw/zinc/26/50/80/475265080.db2.gz IQHDGLROVWZAPY-SQNIBIBYSA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@@H](CCNC(=O)NCCN1[C@H](C)CCC[C@@H]1C)[NH+]1CCCCC1 ZINC000345559041 475265549 /nfs/dbraw/zinc/26/55/49/475265549.db2.gz IQHDGLROVWZAPY-OKZBNKHCSA-N 1 3 338.540 2.813 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](N[C@H]2CCN(c3ccccc3)C2)[C@@H](C)C1 ZINC000361216946 475277698 /nfs/dbraw/zinc/27/76/98/475277698.db2.gz OXSQIMAOJQNNJS-ZJOUEHCJSA-N 1 3 345.531 2.992 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](N[C@H]2CCN(c3ccccc3)C2)[C@@H](C)C1 ZINC000361216946 475277706 /nfs/dbraw/zinc/27/77/06/475277706.db2.gz OXSQIMAOJQNNJS-ZJOUEHCJSA-N 1 3 345.531 2.992 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@H](O)CC2)CC1 ZINC000354746708 475377365 /nfs/dbraw/zinc/37/73/65/475377365.db2.gz MFSQPMFIPDVQKG-IBGZPJMESA-N 1 3 331.504 2.565 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@H](O)CC2)CC1 ZINC000354746708 475377375 /nfs/dbraw/zinc/37/73/75/475377375.db2.gz MFSQPMFIPDVQKG-IBGZPJMESA-N 1 3 331.504 2.565 10 0 EFAEHO CN(C(=O)CC[C@@H]1CCCC[N@@H+]1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000354930743 475530584 /nfs/dbraw/zinc/53/05/84/475530584.db2.gz NORAOGYURPCGKA-VQTJNVASSA-N 1 3 343.515 2.984 10 0 EFAEHO CN(C(=O)CC[C@@H]1CCCC[N@H+]1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000354930743 475530595 /nfs/dbraw/zinc/53/05/95/475530595.db2.gz NORAOGYURPCGKA-VQTJNVASSA-N 1 3 343.515 2.984 10 0 EFAEHO CCC[N@H+](CC)Cc1ccc(C(=O)NCCNc2ccncc2)cc1 ZINC000338052312 475547837 /nfs/dbraw/zinc/54/78/37/475547837.db2.gz HXDIHKFWEPLHSD-UHFFFAOYSA-N 1 3 340.471 2.577 10 0 EFAEHO CCC[N@@H+](CC)Cc1ccc(C(=O)NCCNc2ccncc2)cc1 ZINC000338052312 475547846 /nfs/dbraw/zinc/54/78/46/475547846.db2.gz HXDIHKFWEPLHSD-UHFFFAOYSA-N 1 3 340.471 2.577 10 0 EFAEHO C[C@H]1C[C@H](C[NH+]2CCN(CCN(C)Cc3ccccc3)CC2)CCO1 ZINC000352711334 475552982 /nfs/dbraw/zinc/55/29/82/475552982.db2.gz AWIPAGUEIPXEIM-PZJWPPBQSA-N 1 3 345.531 2.551 10 0 EFAEHO CCN(Cc1cccc(C[N@H+](CC)[C@H]2CCOC2)c1)[C@@H]1CCOC1 ZINC000361584934 475569933 /nfs/dbraw/zinc/56/99/33/475569933.db2.gz ARZKTJTYEUSOMI-BGYRXZFFSA-N 1 3 332.488 2.908 10 0 EFAEHO CCN(Cc1cccc(C[N@@H+](CC)[C@H]2CCOC2)c1)[C@@H]1CCOC1 ZINC000361584934 475569939 /nfs/dbraw/zinc/56/99/39/475569939.db2.gz ARZKTJTYEUSOMI-BGYRXZFFSA-N 1 3 332.488 2.908 10 0 EFAEHO CCN(Cc1cccc(C[N@H+](CC)[C@@H]2CCOC2)c1)[C@H]1CCOC1 ZINC000361584934 475569944 /nfs/dbraw/zinc/56/99/44/475569944.db2.gz ARZKTJTYEUSOMI-BGYRXZFFSA-N 1 3 332.488 2.908 10 0 EFAEHO CCN(Cc1cccc(C[N@@H+](CC)[C@@H]2CCOC2)c1)[C@H]1CCOC1 ZINC000361584934 475569951 /nfs/dbraw/zinc/56/99/51/475569951.db2.gz ARZKTJTYEUSOMI-BGYRXZFFSA-N 1 3 332.488 2.908 10 0 EFAEHO COc1cc([C@H](C)[NH2+]C2CCN([C@@H]3CCC[C@H]3O)CC2)ccc1F ZINC000358301343 475571952 /nfs/dbraw/zinc/57/19/52/475571952.db2.gz PGQSLUMAQRDWEG-MORSLUCNSA-N 1 3 336.451 2.863 10 0 EFAEHO CC[C@@H](C)[N@H+](C)CCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000355039706 475617087 /nfs/dbraw/zinc/61/70/87/475617087.db2.gz OYPPAXGHHKRHGB-IEBWSBKVSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[C@@H](C)[N@@H+](C)CCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000355039706 475617092 /nfs/dbraw/zinc/61/70/92/475617092.db2.gz OYPPAXGHHKRHGB-IEBWSBKVSA-N 1 3 346.519 2.633 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]Cc2ccc(CO)c(F)c2)[C@H](C)C1 ZINC000358367627 475622862 /nfs/dbraw/zinc/62/28/62/475622862.db2.gz NDVLMFJXLNNGOA-DNVCBOLYSA-N 1 3 338.467 2.545 10 0 EFAEHO CN1CCC(Cc2nc(-c3cccc(OCC[NH+](C)C)c3)no2)CC1 ZINC000346544177 475644233 /nfs/dbraw/zinc/64/42/33/475644233.db2.gz PUFVHXQSCZLLDZ-UHFFFAOYSA-N 1 3 344.459 2.561 10 0 EFAEHO CC[C@@H](C)[NH2+][C@@H](CNC(=O)NCCN1CC=C(C)CC1)c1ccco1 ZINC000355104477 475669733 /nfs/dbraw/zinc/66/97/33/475669733.db2.gz XVHZYQZFWQYUJL-SJORKVTESA-N 1 3 348.491 2.660 10 0 EFAEHO C[C@H](CN(C)C)NC(=O)N1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000358488810 475717888 /nfs/dbraw/zinc/71/78/88/475717888.db2.gz AVMRXSJPIVKMTN-SJORKVTESA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@H](CN(C)C)NC(=O)N1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000358488810 475717895 /nfs/dbraw/zinc/71/78/95/475717895.db2.gz AVMRXSJPIVKMTN-SJORKVTESA-N 1 3 338.540 2.623 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@@H]2C)C[C@@H]1C ZINC000361775909 475741270 /nfs/dbraw/zinc/74/12/70/475741270.db2.gz YIMOWXHLLNCEPZ-MHORFTMASA-N 1 3 338.540 2.764 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@@H]2C)C[C@@H]1C ZINC000361775909 475741279 /nfs/dbraw/zinc/74/12/79/475741279.db2.gz YIMOWXHLLNCEPZ-MHORFTMASA-N 1 3 338.540 2.764 10 0 EFAEHO CCC[N@H+](CC)CCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000355213527 475749044 /nfs/dbraw/zinc/74/90/44/475749044.db2.gz FEGQRSXWBIKJSU-IBGZPJMESA-N 1 3 346.519 2.634 10 0 EFAEHO CCC[N@@H+](CC)CCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000355213527 475749050 /nfs/dbraw/zinc/74/90/50/475749050.db2.gz FEGQRSXWBIKJSU-IBGZPJMESA-N 1 3 346.519 2.634 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000338292905 475754845 /nfs/dbraw/zinc/75/48/45/475754845.db2.gz CIYDSSDIGPCPQW-LMMKCTJWSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCCN1CCCC[C@H]1C ZINC000338300245 475760729 /nfs/dbraw/zinc/76/07/29/475760729.db2.gz ZCEXDMUWNNUVCN-XMTFNYHQSA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCCN1CCCC[C@H]1C ZINC000338300245 475760732 /nfs/dbraw/zinc/76/07/32/475760732.db2.gz ZCEXDMUWNNUVCN-XMTFNYHQSA-N 1 3 338.540 2.526 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NC[C@H](C)N2CCCC[C@@H]2C)CC1 ZINC000338301836 475761562 /nfs/dbraw/zinc/76/15/62/475761562.db2.gz IIURRZSIHJMZRR-IRXDYDNUSA-N 1 3 338.540 2.671 10 0 EFAEHO CN(C)Cc1ccc(CNC(=O)NC2CC([NH+]3CCCCC3)C2)cc1 ZINC000353206172 475768926 /nfs/dbraw/zinc/76/89/26/475768926.db2.gz LFTLCCAQMWPWJR-UHFFFAOYSA-N 1 3 344.503 2.564 10 0 EFAEHO CN1CCC(N2CCC([NH2+][C@@H]3CCC[C@H]([C@@H]4CCOC4)C3)CC2)CC1 ZINC000361895473 475851031 /nfs/dbraw/zinc/85/10/31/475851031.db2.gz XXRRJFHCDIYBDD-NLWGTHIKSA-N 1 3 349.563 2.730 10 0 EFAEHO CN1CC[C@H]([NH2+][C@@H]2CC(=O)N(c3c(F)cccc3F)C2)[C@H]2CCC[C@H]21 ZINC000353410348 475946466 /nfs/dbraw/zinc/94/64/66/475946466.db2.gz WQDIPLRCGMNFMZ-UTJXIGIESA-N 1 3 349.425 2.533 10 0 EFAEHO C[C@H](CNC(=O)NCC[N@H+](C)C1CCCCC1)N1CCC(C)CC1 ZINC000338499354 475958267 /nfs/dbraw/zinc/95/82/67/475958267.db2.gz LSSSOHSHTSXKGA-QGZVFWFLSA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@H](CNC(=O)NCC[N@@H+](C)C1CCCCC1)N1CCC(C)CC1 ZINC000338499354 475958275 /nfs/dbraw/zinc/95/82/75/475958275.db2.gz LSSSOHSHTSXKGA-QGZVFWFLSA-N 1 3 338.540 2.671 10 0 EFAEHO CN(C(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[C@H]1CCN(C2CC2)C1 ZINC000347007662 476027208 /nfs/dbraw/zinc/02/72/08/476027208.db2.gz HHQCODMAAHGUTJ-QUCCMNQESA-N 1 3 341.499 2.594 10 0 EFAEHO CN(C(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@H]1CCN(C2CC2)C1 ZINC000347007662 476027213 /nfs/dbraw/zinc/02/72/13/476027213.db2.gz HHQCODMAAHGUTJ-QUCCMNQESA-N 1 3 341.499 2.594 10 0 EFAEHO CS[C@@H]1CN([C@@H]2CCN(Cc3ccccc3)C2)C[C@@H]1[NH+]1CCCC1 ZINC000298295596 476048454 /nfs/dbraw/zinc/04/84/54/476048454.db2.gz HJJQQMNUWJUAJZ-HSALFYBXSA-N 1 3 345.556 2.773 10 0 EFAEHO CCOC[C@@H](C)[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340463937 476050564 /nfs/dbraw/zinc/05/05/64/476050564.db2.gz REMCSRVXLMZAMF-QUCCMNQESA-N 1 3 346.515 2.930 10 0 EFAEHO CCOC[C@@H](C)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000340463937 476050570 /nfs/dbraw/zinc/05/05/70/476050570.db2.gz REMCSRVXLMZAMF-QUCCMNQESA-N 1 3 346.515 2.930 10 0 EFAEHO CCOC[C@@H](C)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000340463937 476050578 /nfs/dbraw/zinc/05/05/78/476050578.db2.gz REMCSRVXLMZAMF-QUCCMNQESA-N 1 3 346.515 2.930 10 0 EFAEHO CC[C@@H](Cn1cncn1)[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000340463114 476050924 /nfs/dbraw/zinc/05/09/24/476050924.db2.gz NRROPRHUHNBKCN-INIZCTEOSA-N 1 3 333.505 2.620 10 0 EFAEHO COC1CCN(C2(C[NH2+][C@@H]3CCN(C)[C@@H]4CCC[C@H]43)CCCC2)CC1 ZINC000353531838 476053244 /nfs/dbraw/zinc/05/32/44/476053244.db2.gz PMXFBNLGVSVINR-XUVXKRRUSA-N 1 3 349.563 2.872 10 0 EFAEHO C[NH+](C)CCOC1CCN(Cc2cnc(-c3ccccc3)[nH]2)CC1 ZINC000353546583 476065839 /nfs/dbraw/zinc/06/58/39/476065839.db2.gz WNWCHNVNBQPPME-UHFFFAOYSA-N 1 3 328.460 2.619 10 0 EFAEHO COc1cc(Br)ccc1CNCC1=CC[N@H+](C)CC1 ZINC000358999277 476101376 /nfs/dbraw/zinc/10/13/76/476101376.db2.gz YRUWOEKAGRWNOC-UHFFFAOYSA-N 1 3 325.250 2.809 10 0 EFAEHO COc1cc(Br)ccc1CNCC1=CC[N@@H+](C)CC1 ZINC000358999277 476101381 /nfs/dbraw/zinc/10/13/81/476101381.db2.gz YRUWOEKAGRWNOC-UHFFFAOYSA-N 1 3 325.250 2.809 10 0 EFAEHO CN1CC[C@H]([NH2+]CCOc2ncccc2C(F)(F)F)[C@H]2CCC[C@@H]21 ZINC000353635556 476141900 /nfs/dbraw/zinc/14/19/00/476141900.db2.gz ADVPRIKISDDCIO-SNPRPXQTSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCOc2ncccc2C(F)(F)F)[C@H]2CCC[C@@H]21 ZINC000353635556 476141909 /nfs/dbraw/zinc/14/19/09/476141909.db2.gz ADVPRIKISDDCIO-SNPRPXQTSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@H+]1CC[C@H](NCCOc2ncccc2C(F)(F)F)[C@H]2CCC[C@@H]21 ZINC000353635556 476141916 /nfs/dbraw/zinc/14/19/16/476141916.db2.gz ADVPRIKISDDCIO-SNPRPXQTSA-N 1 3 343.393 2.942 10 0 EFAEHO CN1CC[C@H]([NH2+]CCOc2ccc(C(F)(F)F)cn2)[C@@H]2CCC[C@H]21 ZINC000353647714 476154817 /nfs/dbraw/zinc/15/48/17/476154817.db2.gz SEMIXBAXCWZRQS-SOUVJXGZSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCOc2ccc(C(F)(F)F)cn2)[C@@H]2CCC[C@H]21 ZINC000353647714 476154821 /nfs/dbraw/zinc/15/48/21/476154821.db2.gz SEMIXBAXCWZRQS-SOUVJXGZSA-N 1 3 343.393 2.942 10 0 EFAEHO C[N@H+]1CC[C@H](NCCOc2ccc(C(F)(F)F)cn2)[C@@H]2CCC[C@H]21 ZINC000353647714 476154824 /nfs/dbraw/zinc/15/48/24/476154824.db2.gz SEMIXBAXCWZRQS-SOUVJXGZSA-N 1 3 343.393 2.942 10 0 EFAEHO O=C(CNC1CC(c2ccccc2F)C1)NCC[NH+]1CCCCCC1 ZINC000353673105 476176824 /nfs/dbraw/zinc/17/68/24/476176824.db2.gz OWQCRSKSPFWVGV-UHFFFAOYSA-N 1 3 347.478 2.654 10 0 EFAEHO CN1CCC[C@H]1CC[NH+]1CCC2(C[C@@H]2C(=O)N2CCCCC2)CC1 ZINC000357082842 476217230 /nfs/dbraw/zinc/21/72/30/476217230.db2.gz JQTUXFVXYSJXCM-ZWKOTPCHSA-N 1 3 333.520 2.585 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@H](CNC(=O)NCCN2[C@H](C)CCC[C@@H]2C)C1 ZINC000362508375 476289812 /nfs/dbraw/zinc/28/98/12/476289812.db2.gz GHJJMULFBRCABQ-FGTMMUONSA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)C[N@H+]1CC[C@H](CNC(=O)NCCN2[C@H](C)CCC[C@@H]2C)C1 ZINC000362508375 476289815 /nfs/dbraw/zinc/28/98/15/476289815.db2.gz GHJJMULFBRCABQ-FGTMMUONSA-N 1 3 338.540 2.526 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C1CC1)[N@H+](C)Cc1ccccc1 ZINC000357266985 476309228 /nfs/dbraw/zinc/30/92/28/476309228.db2.gz SIUOXLWEVLYZMC-WOJBJXKFSA-N 1 3 343.515 2.888 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000357266985 476309233 /nfs/dbraw/zinc/30/92/33/476309233.db2.gz SIUOXLWEVLYZMC-WOJBJXKFSA-N 1 3 343.515 2.888 10 0 EFAEHO c1ncn(-c2ccc(CN3CC[C@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)cc2)n1 ZINC000360808678 476402082 /nfs/dbraw/zinc/40/20/82/476402082.db2.gz AXCZFVWQTNRFRI-PXNSSMCTSA-N 1 3 337.471 2.716 10 0 EFAEHO c1ncn(-c2ccc(CN3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)cc2)n1 ZINC000360808678 476402087 /nfs/dbraw/zinc/40/20/87/476402087.db2.gz AXCZFVWQTNRFRI-PXNSSMCTSA-N 1 3 337.471 2.716 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)N(C)[C@H]1CC[N@@H+](C2CC2)C1)c1ccco1 ZINC000357551187 476449533 /nfs/dbraw/zinc/44/95/33/476449533.db2.gz WVTYDLVLUDFTPC-BHYGNILZSA-N 1 3 348.491 2.587 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1)c1ccco1 ZINC000357551187 476449541 /nfs/dbraw/zinc/44/95/41/476449541.db2.gz WVTYDLVLUDFTPC-BHYGNILZSA-N 1 3 348.491 2.587 10 0 EFAEHO C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)CCN1CCc2ccccc2C1 ZINC000354336592 476595257 /nfs/dbraw/zinc/59/52/57/476595257.db2.gz XTBVIMXORUEJKF-MSOLQXFVSA-N 1 3 343.515 2.671 10 0 EFAEHO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)CCN1CCc2ccccc2C1 ZINC000354336592 476595264 /nfs/dbraw/zinc/59/52/64/476595264.db2.gz XTBVIMXORUEJKF-MSOLQXFVSA-N 1 3 343.515 2.671 10 0 EFAEHO CSC1(C[NH2+]CC2(N3CCCCC3)CCN(C)CC2)CCC1 ZINC000378136150 476684485 /nfs/dbraw/zinc/68/44/85/476684485.db2.gz LVCWHCYUWWUHJH-UHFFFAOYSA-N 1 3 325.566 2.812 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)C2CCC([NH3+])CC2)CCN1Cc1ccccc1 ZINC000379680713 476731804 /nfs/dbraw/zinc/73/18/04/476731804.db2.gz NSVJEKWFPYEJNL-JYPHPWERSA-N 1 3 329.488 2.673 10 0 EFAEHO COc1ccccc1-c1ncc(CN2CCC(C[NH+](C)C)CC2)cn1 ZINC000430014246 476736023 /nfs/dbraw/zinc/73/60/23/476736023.db2.gz UKEVGIYEFYSCIH-UHFFFAOYSA-N 1 3 340.471 2.926 10 0 EFAEHO CCOC(=O)C1([C@@H](C)NCc2ccc3ccccc3n2)CC[NH2+]CC1 ZINC000422707693 476736881 /nfs/dbraw/zinc/73/68/81/476736881.db2.gz WYKIAZHYZQJVDY-OAHLLOKOSA-N 1 3 341.455 2.646 10 0 EFAEHO N[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000422725164 476745606 /nfs/dbraw/zinc/74/56/06/476745606.db2.gz ARFJXLYOTWPZHE-BZUAXINKSA-N 1 3 327.394 2.749 10 0 EFAEHO [NH3+][C@@H]1CCC[C@H]1N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000422725164 476745617 /nfs/dbraw/zinc/74/56/17/476745617.db2.gz ARFJXLYOTWPZHE-BZUAXINKSA-N 1 3 327.394 2.749 10 0 EFAEHO CC(C)OC[C@@H](O)C[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000383658766 476752269 /nfs/dbraw/zinc/75/22/69/476752269.db2.gz FVZBLZWIGIEDQA-UXHICEINSA-N 1 3 334.504 2.664 10 0 EFAEHO CC(C)OC[C@@H](O)CNC[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000383658766 476752277 /nfs/dbraw/zinc/75/22/77/476752277.db2.gz FVZBLZWIGIEDQA-UXHICEINSA-N 1 3 334.504 2.664 10 0 EFAEHO CC(C)OC[C@@H](O)CNC[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000383658766 476752285 /nfs/dbraw/zinc/75/22/85/476752285.db2.gz FVZBLZWIGIEDQA-UXHICEINSA-N 1 3 334.504 2.664 10 0 EFAEHO c1cc(CN2CCOCC2)ccc1CN[C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000422774277 476771757 /nfs/dbraw/zinc/77/17/57/476771757.db2.gz WKMWYPSPSBPNNY-QHAWAJNXSA-N 1 3 343.515 2.529 10 0 EFAEHO COc1cccc(O[C@H](C)C[NH2+][C@@H](C)c2ccc(CN)nc2C)c1 ZINC000422779154 476773299 /nfs/dbraw/zinc/77/32/99/476773299.db2.gz BPYAIMJCMJQVEE-KGLIPLIRSA-N 1 3 329.444 2.975 10 0 EFAEHO CN(C(=O)C1CCC([NH3+])CC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388489016 476778829 /nfs/dbraw/zinc/77/88/29/476778829.db2.gz LVYPPTFJEQCPMI-ACBHZAAOSA-N 1 3 329.488 2.627 10 0 EFAEHO COc1ccccc1-c1ncc(CN(C)CC2CC[NH+](C)CC2)cn1 ZINC000430228878 476786271 /nfs/dbraw/zinc/78/62/71/476786271.db2.gz WCOPZHQSJFTUBD-UHFFFAOYSA-N 1 3 340.471 2.926 10 0 EFAEHO CN1CCC(CC(=O)NC[C@]2(C)CCC[N@@H+]2Cc2ccccc2)CC1 ZINC000365978422 476793101 /nfs/dbraw/zinc/79/31/01/476793101.db2.gz AKPHJXQRVMJYFA-NRFANRHFSA-N 1 3 343.515 2.889 10 0 EFAEHO CN1CCC(CC(=O)NC[C@]2(C)CCC[N@H+]2Cc2ccccc2)CC1 ZINC000365978422 476793106 /nfs/dbraw/zinc/79/31/06/476793106.db2.gz AKPHJXQRVMJYFA-NRFANRHFSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)CN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC[NH+](C)CC1 ZINC000365991991 476801317 /nfs/dbraw/zinc/80/13/17/476801317.db2.gz JNMIVDQJNJZQFU-LJQANCHMSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)NC(=O)[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000390895918 476808516 /nfs/dbraw/zinc/80/85/16/476808516.db2.gz RLRYPNKSTYRDKM-UXDRXVOSSA-N 1 3 329.488 2.685 10 0 EFAEHO COc1ccc([C@H](NCCN2CCC[C@H](C)C2)[C@@H]2CCC[NH2+]2)cc1 ZINC000422859705 476814600 /nfs/dbraw/zinc/81/46/00/476814600.db2.gz KTBCIKYJPHKSEA-VDGAXYAQSA-N 1 3 331.504 2.810 10 0 EFAEHO COc1ccc([C@H](N[C@@H]2C[C@H](C)N(C3CC3)C2)[C@@H]2CCC[NH2+]2)cc1 ZINC000422861053 476815618 /nfs/dbraw/zinc/81/56/18/476815618.db2.gz IWBFPHMJLVWQBT-ZXUOCUECSA-N 1 3 329.488 2.703 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1ccc(Oc2ccc(F)cc2)nc1 ZINC000422896248 476832580 /nfs/dbraw/zinc/83/25/80/476832580.db2.gz HWOQPPOYFPJNOZ-INIZCTEOSA-N 1 3 333.407 2.857 10 0 EFAEHO COCCOc1cccc(CN[C@@H](C)c2ccc(C[NH3+])nc2C)c1 ZINC000422897655 476833689 /nfs/dbraw/zinc/83/36/89/476833689.db2.gz JZGOFPYUKOXWIT-AWEZNQCLSA-N 1 3 329.444 2.725 10 0 EFAEHO CCN1CCCC[C@@H]1CN[C@@H](c1ccc(OC)cc1)[C@H]1CCC[NH2+]1 ZINC000422908467 476842035 /nfs/dbraw/zinc/84/20/35/476842035.db2.gz MQJHAGVVTLTTHR-RLLQIKCJSA-N 1 3 331.504 2.952 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CCCc1ccc2c(c1)OCCO2 ZINC000422926950 476848727 /nfs/dbraw/zinc/84/87/27/476848727.db2.gz FGVKUEDOJMQZNN-CQSZACIVSA-N 1 3 341.455 2.903 10 0 EFAEHO CCO[C@H]1C[C@@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)C1(C)C ZINC000397600860 476857521 /nfs/dbraw/zinc/85/75/21/476857521.db2.gz UCEDPIAHYWWOEP-MOPGFXCFSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@@H](NCC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccccn1 ZINC000397611467 476858848 /nfs/dbraw/zinc/85/88/48/476858848.db2.gz RPRGBQFDAHEBLW-QGZVFWFLSA-N 1 3 325.456 2.759 10 0 EFAEHO Cn1cnc(CCN[C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)c1 ZINC000414121267 476873647 /nfs/dbraw/zinc/87/36/47/476873647.db2.gz GFEOPJDGEJVYMA-NJYVYQBISA-N 1 3 338.499 2.995 10 0 EFAEHO Cn1cnc(CCN[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)c1 ZINC000414121267 476873653 /nfs/dbraw/zinc/87/36/53/476873653.db2.gz GFEOPJDGEJVYMA-NJYVYQBISA-N 1 3 338.499 2.995 10 0 EFAEHO OCC[NH+]1CCC(NCc2cccc(OCc3ccccc3)c2)CC1 ZINC000398957889 476878777 /nfs/dbraw/zinc/87/87/77/476878777.db2.gz JVIZAJXRDWWUPM-UHFFFAOYSA-N 1 3 340.467 2.812 10 0 EFAEHO C[C@@H]1CC[NH2+]CC[C@H]1NC[C@@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422986646 476879115 /nfs/dbraw/zinc/87/91/15/476879115.db2.gz DAJNPXIVJYNHRE-UKPHBRMFSA-N 1 3 344.421 2.834 10 0 EFAEHO C[C@@H]1CCNCC[C@H]1[NH2+]C[C@@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000422986646 476879119 /nfs/dbraw/zinc/87/91/19/476879119.db2.gz DAJNPXIVJYNHRE-UKPHBRMFSA-N 1 3 344.421 2.834 10 0 EFAEHO Cc1ccc([C@@H]2CCC[N@@H+]2C[C@H]2CCCN(C(=O)CN)C2)cc1C ZINC000414698709 476887781 /nfs/dbraw/zinc/88/77/81/476887781.db2.gz XUAJQNAMXWWOIT-MJGOQNOKSA-N 1 3 329.488 2.638 10 0 EFAEHO Cc1ccc([C@@H]2CCC[N@H+]2C[C@H]2CCCN(C(=O)CN)C2)cc1C ZINC000414698709 476887796 /nfs/dbraw/zinc/88/77/96/476887796.db2.gz XUAJQNAMXWWOIT-MJGOQNOKSA-N 1 3 329.488 2.638 10 0 EFAEHO C[C@@H]1CNCC[C@@H]1[NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000414946661 476895047 /nfs/dbraw/zinc/89/50/47/476895047.db2.gz UQCDMSJTKPJZLD-DYVFJYSZSA-N 1 3 335.879 2.532 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@]1(O)CCC[C@@H](C(F)(F)F)C1 ZINC000423058022 476908760 /nfs/dbraw/zinc/90/87/60/476908760.db2.gz BIGZLIGXJGJRLE-NORZTCDRSA-N 1 3 345.409 2.983 10 0 EFAEHO FC(F)C(F)(F)COCCN[C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000423072984 476916110 /nfs/dbraw/zinc/91/61/10/476916110.db2.gz HZWLMIPGKIZITR-RWMBFGLXSA-N 1 3 326.378 2.804 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1ccnc(Oc2ccccc2F)c1 ZINC000423081257 476921136 /nfs/dbraw/zinc/92/11/36/476921136.db2.gz CKQNXBMKJNGXPP-OAHLLOKOSA-N 1 3 333.407 2.857 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2CNCC[C@H]2C)ccc1I ZINC000423092088 476925746 /nfs/dbraw/zinc/92/57/46/476925746.db2.gz ANSSHJFLMQVCAW-QMTHXVAHSA-N 1 3 344.240 2.687 10 0 EFAEHO Cc1nc(C[NH3+])ccc1[C@H](C)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000423102217 476929635 /nfs/dbraw/zinc/92/96/35/476929635.db2.gz DQADNHMURGRZIE-LIRRHRJNSA-N 1 3 330.451 2.941 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)[C@@H]1CC[C@@H](C2CC2)[NH2+]1)c1ccccc1 ZINC000407341344 476932783 /nfs/dbraw/zinc/93/27/83/476932783.db2.gz WDKCHPKDPCAFIH-GBESFXJTSA-N 1 3 329.488 2.716 10 0 EFAEHO c1ccc([C@@H]2CC[C@H](CN[C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)O2)cc1 ZINC000423127415 476936997 /nfs/dbraw/zinc/93/69/97/476936997.db2.gz SZERQGNEPROSLS-OBKDMQGPSA-N 1 3 330.472 2.653 10 0 EFAEHO COc1ccc([C@H](CO)CN[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000423168962 476952217 /nfs/dbraw/zinc/95/22/17/476952217.db2.gz IEUOLTYDRYOSRE-MTFMMBMASA-N 1 3 332.488 2.672 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCN(c2ccc(F)cc2)C1 ZINC000423173970 476953567 /nfs/dbraw/zinc/95/35/67/476953567.db2.gz ASCDDBQEUXMWQN-YOEHRIQHSA-N 1 3 328.435 2.917 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1cc(Cl)cc(Br)c1 ZINC000423184186 476956801 /nfs/dbraw/zinc/95/68/01/476956801.db2.gz NEKPIDUESDQELL-ZDUSSCGKSA-N 1 3 335.673 2.946 10 0 EFAEHO C[C@@H](NCCC[NH2+]Cc1cccnc1)c1ccc(C(=O)N(C)C)cc1 ZINC000423179829 476956247 /nfs/dbraw/zinc/95/62/47/476956247.db2.gz AIOLDCXYWBWGTG-MRXNPFEDSA-N 1 3 340.471 2.614 10 0 EFAEHO C[C@H](NCC[C@H]1CC[NH2+]C1)c1ccccc1I ZINC000423243990 476974209 /nfs/dbraw/zinc/97/42/09/476974209.db2.gz HDIOAMNSTIAQQW-NWDGAFQWSA-N 1 3 344.240 2.941 10 0 EFAEHO COc1ccc([C@H](NC[C@H](N)c2ccccc2)[C@@H]2CCC[NH2+]2)cc1 ZINC000423249240 476975286 /nfs/dbraw/zinc/97/52/86/476975286.db2.gz OHLJVSOAATVTSC-UFYCRDLUSA-N 1 3 325.456 2.778 10 0 EFAEHO CCO[C@@H]1COCC[C@H]1N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447590404 477018372 /nfs/dbraw/zinc/01/83/72/477018372.db2.gz CKLBVDRYRZCQRP-FDKIHUSFSA-N 1 3 344.499 2.966 10 0 EFAEHO CCO[C@@H]1COCC[C@H]1N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447590404 477018378 /nfs/dbraw/zinc/01/83/78/477018378.db2.gz CKLBVDRYRZCQRP-FDKIHUSFSA-N 1 3 344.499 2.966 10 0 EFAEHO O=C(CCN1CCc2ccccc2C1)N1CCC[C@H]1C[NH+]1CCCC1 ZINC000416143603 477037142 /nfs/dbraw/zinc/03/71/42/477037142.db2.gz KMWFUZHUEZTIMW-FQEVSTJZSA-N 1 3 341.499 2.522 10 0 EFAEHO CC(C)Oc1ccc([C@H](O)CN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)cc1 ZINC000375840479 477038882 /nfs/dbraw/zinc/03/88/82/477038882.db2.gz PNCPLPYCQHSSBK-MTQWCTHYSA-N 1 3 332.488 2.970 10 0 EFAEHO CC(C)Oc1ccc([C@H](O)CN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@H]32)cc1 ZINC000375840479 477038890 /nfs/dbraw/zinc/03/88/90/477038890.db2.gz PNCPLPYCQHSSBK-MTQWCTHYSA-N 1 3 332.488 2.970 10 0 EFAEHO COC(=O)C[C@@H]1CC[C@@H]([NH2+]CC2(N)C3CC4CC(C3)CC2C4)[C@H]1C ZINC000423530300 477065938 /nfs/dbraw/zinc/06/59/38/477065938.db2.gz QZKMTEQAZODVMA-CMFXRTGTSA-N 1 3 334.504 2.707 10 0 EFAEHO C[N@@H+]1CCCC[C@H]1CCC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000431656851 477069006 /nfs/dbraw/zinc/06/90/06/477069006.db2.gz DBOBISGNLLNAPE-MOPGFXCFSA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@H+]1CCCC[C@H]1CCC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000431656851 477069015 /nfs/dbraw/zinc/06/90/15/477069015.db2.gz DBOBISGNLLNAPE-MOPGFXCFSA-N 1 3 329.488 2.642 10 0 EFAEHO CC[C@@H](CC(F)F)C(=O)N(CCN(C)C)C[C@@H]1CCC[N@@H+]1CC ZINC000457536343 477074714 /nfs/dbraw/zinc/07/47/14/477074714.db2.gz PCBJOVRDWUAXQS-GJZGRUSLSA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@@H](CC(F)F)C(=O)N(CCN(C)C)C[C@@H]1CCC[N@H+]1CC ZINC000457536343 477074719 /nfs/dbraw/zinc/07/47/19/477074719.db2.gz PCBJOVRDWUAXQS-GJZGRUSLSA-N 1 3 333.467 2.542 10 0 EFAEHO CCC[N@H+](CC)C[C@@H](C)NC(=O)CCN1CCc2ccccc2C1 ZINC000416231962 477082318 /nfs/dbraw/zinc/08/23/18/477082318.db2.gz DHINDQMMOCRNKQ-QGZVFWFLSA-N 1 3 331.504 2.671 10 0 EFAEHO CCC[N@@H+](CC)C[C@@H](C)NC(=O)CCN1CCc2ccccc2C1 ZINC000416231962 477082325 /nfs/dbraw/zinc/08/23/25/477082325.db2.gz DHINDQMMOCRNKQ-QGZVFWFLSA-N 1 3 331.504 2.671 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)CC[C@@H]2CCCC[N@@H+]2C)N(C)C)cc1 ZINC000431773331 477092993 /nfs/dbraw/zinc/09/29/93/477092993.db2.gz OGOINEJKWVTQQO-RBUKOAKNSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)CC[C@@H]2CCCC[N@H+]2C)N(C)C)cc1 ZINC000431773331 477092998 /nfs/dbraw/zinc/09/29/98/477092998.db2.gz OGOINEJKWVTQQO-RBUKOAKNSA-N 1 3 331.504 2.978 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NC[C@H]2N(C)CCCC2(C)C)CC1 ZINC000447951933 477100056 /nfs/dbraw/zinc/10/00/56/477100056.db2.gz NUELDOQTJOPXMG-QGZVFWFLSA-N 1 3 338.540 2.528 10 0 EFAEHO CC1(C)CCCN[C@H]1C(=O)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000423785750 477143005 /nfs/dbraw/zinc/14/30/05/477143005.db2.gz ABUSQSYVYNEKDM-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO CCC[NH+]1CCC(CN[C@H](c2c[nH]nn2)c2ccc(F)cc2)CC1 ZINC000453102732 477168008 /nfs/dbraw/zinc/16/80/08/477168008.db2.gz BCNHRGOUVFAWGZ-SFHVURJKSA-N 1 3 331.439 2.745 10 0 EFAEHO COC1([C@@H](C)[NH2+]C[C@H]2CCN(CCc3ccccc3)C2)CCOCC1 ZINC000453114513 477172502 /nfs/dbraw/zinc/17/25/02/477172502.db2.gz VTELHSKRKKVPSD-UYAOXDASSA-N 1 3 346.515 2.725 10 0 EFAEHO C[C@@]1(CNCc2ccc(C(N)=O)cc2)CCC[N@@H+]1Cc1ccccc1 ZINC000376341843 477291452 /nfs/dbraw/zinc/29/14/52/477291452.db2.gz RVHXBOLFRIWERK-NRFANRHFSA-N 1 3 337.467 2.930 10 0 EFAEHO C[C@@]1(CNCc2ccc(C(N)=O)cc2)CCC[N@H+]1Cc1ccccc1 ZINC000376341843 477291463 /nfs/dbraw/zinc/29/14/63/477291463.db2.gz RVHXBOLFRIWERK-NRFANRHFSA-N 1 3 337.467 2.930 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)NC[C@H](c2ccccc2)N(C)C)cc1 ZINC000416808992 477316982 /nfs/dbraw/zinc/31/69/82/477316982.db2.gz PLVJKZZFPWQEIR-DNVCBOLYSA-N 1 3 340.471 2.808 10 0 EFAEHO CN(C)[C@H](CNC(=O)NCC1([NH3+])CCCCCC1)c1ccccc1 ZINC000416808456 477317684 /nfs/dbraw/zinc/31/76/84/477317684.db2.gz OYBZZBKQDAOBMB-QGZVFWFLSA-N 1 3 332.492 2.640 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)C[C@@H](c2ccccc2)N(C)C)[C@H](C)C1 ZINC000433471979 477324677 /nfs/dbraw/zinc/32/46/77/477324677.db2.gz QROOGPHYUDXNJB-NEWSRXKRSA-N 1 3 331.504 2.868 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)C[C@@H](c2ccccc2)N(C)C)[C@H](C)C1 ZINC000433471979 477324683 /nfs/dbraw/zinc/32/46/83/477324683.db2.gz QROOGPHYUDXNJB-NEWSRXKRSA-N 1 3 331.504 2.868 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)NC[C@H]1CCCCN1C1CC1 ZINC000433918019 477328994 /nfs/dbraw/zinc/32/89/94/477328994.db2.gz HQOBTPKHDXYDHF-JFIYKMOQSA-N 1 3 336.524 2.565 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)N(C1CC1)[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000416847926 477335106 /nfs/dbraw/zinc/33/51/06/477335106.db2.gz WCBQYEAVIRCQAO-OALUTQOASA-N 1 3 344.503 2.605 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@H]([NH2+]Cc3ccccc3CN3CC[C@H](O)C3)C[C@H]2C1 ZINC000424281479 477355102 /nfs/dbraw/zinc/35/51/02/477355102.db2.gz NMVRNIKVQBQRQE-XIYVOTBMSA-N 1 3 344.499 2.546 10 0 EFAEHO CN(CC(C)(C)C[NH3+])C(=O)NCc1ccccc1CN1CCCCC1 ZINC000416900239 477360091 /nfs/dbraw/zinc/36/00/91/477360091.db2.gz IBUIOTNUJUAPGZ-UHFFFAOYSA-N 1 3 346.519 2.799 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)NC(C)(C)CCC[NH+](C)C ZINC000458347638 477362316 /nfs/dbraw/zinc/36/23/16/477362316.db2.gz UGNIETMHIMJRCF-HOTGVXAUSA-N 1 3 326.529 2.669 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)[C@H]1C[C@@H]1c1ccccc1 ZINC000411825129 477382249 /nfs/dbraw/zinc/38/22/49/477382249.db2.gz REZACVCXBIOIQZ-ZCNNSNEGSA-N 1 3 343.515 2.665 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)[C@H]1C[C@@H]1c1ccccc1 ZINC000411825129 477382254 /nfs/dbraw/zinc/38/22/54/477382254.db2.gz REZACVCXBIOIQZ-ZCNNSNEGSA-N 1 3 343.515 2.665 10 0 EFAEHO CC(C)(CCc1ccccc1)[NH2+]CC(=O)NC1CCN(C2CC2)CC1 ZINC000436063537 477413857 /nfs/dbraw/zinc/41/38/57/477413857.db2.gz TZUIKQFXUVNRGD-UHFFFAOYSA-N 1 3 343.515 2.730 10 0 EFAEHO C[N@H+](CCCNC(=O)NC[C@@H](N)c1ccccc1)C1CCCCC1 ZINC000417030173 477432336 /nfs/dbraw/zinc/43/23/36/477432336.db2.gz PMSJJMOBKBNUTC-GOSISDBHSA-N 1 3 332.492 2.640 10 0 EFAEHO C[N@@H+](CCCNC(=O)NC[C@@H](N)c1ccccc1)C1CCCCC1 ZINC000417030173 477432340 /nfs/dbraw/zinc/43/23/40/477432340.db2.gz PMSJJMOBKBNUTC-GOSISDBHSA-N 1 3 332.492 2.640 10 0 EFAEHO C[C@@H](Cc1ccccc1)N1CCC([NH2+][C@H]2CCN(C3CC3)C2)CC1 ZINC000449130728 477451663 /nfs/dbraw/zinc/45/16/63/477451663.db2.gz HOFIVPYGFCPZOJ-PXNSSMCTSA-N 1 3 327.516 2.908 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(N[C@H]2CCN(C3CC3)C2)CC1 ZINC000449130728 477451671 /nfs/dbraw/zinc/45/16/71/477451671.db2.gz HOFIVPYGFCPZOJ-PXNSSMCTSA-N 1 3 327.516 2.908 10 0 EFAEHO CSC[C@H](CCO)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449159739 477463892 /nfs/dbraw/zinc/46/38/92/477463892.db2.gz ILRIZPSFTSAVFQ-LPHOPBHVSA-N 1 3 336.545 2.786 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)N(C)[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000418351442 477469760 /nfs/dbraw/zinc/46/97/60/477469760.db2.gz LTYQIYHTGFPYRQ-ATZDWAIDSA-N 1 3 346.519 2.934 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000418351442 477469767 /nfs/dbraw/zinc/46/97/67/477469767.db2.gz LTYQIYHTGFPYRQ-ATZDWAIDSA-N 1 3 346.519 2.934 10 0 EFAEHO CCCN(C(=O)N[C@H](C)[C@@H](C)[NH3+])[C@H]1CCCN(Cc2ccccc2)C1 ZINC000418711210 477484127 /nfs/dbraw/zinc/48/41/27/477484127.db2.gz WEJARSTZEFFNIA-LMMKCTJWSA-N 1 3 346.519 2.808 10 0 EFAEHO CSCC1CCC([NH2+][C@@H](CC(C)C)C(=O)NCCN(C)C)CC1 ZINC000449209604 477487715 /nfs/dbraw/zinc/48/77/15/477487715.db2.gz VCLJLPLHEKIELG-JCYILVPMSA-N 1 3 343.581 2.590 10 0 EFAEHO C[C@H]1C[C@@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)C[N@@H+]1C1CC1 ZINC000371801595 477500825 /nfs/dbraw/zinc/50/08/25/477500825.db2.gz HJZRKWMIZAURCO-DOTOQJQBSA-N 1 3 343.515 2.853 10 0 EFAEHO C[C@H]1C[C@@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)C[N@H+]1C1CC1 ZINC000371801595 477500828 /nfs/dbraw/zinc/50/08/28/477500828.db2.gz HJZRKWMIZAURCO-DOTOQJQBSA-N 1 3 343.515 2.853 10 0 EFAEHO CCN(CCO)CCNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449251373 477507599 /nfs/dbraw/zinc/50/75/99/477507599.db2.gz RKGCJIUGXBZFGQ-UHFFFAOYSA-N 1 3 327.557 2.569 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)Cc1cc2cccnc2o1 ZINC000449325635 477546510 /nfs/dbraw/zinc/54/65/10/477546510.db2.gz OHDZBNQANOHHOA-QGZVFWFLSA-N 1 3 330.476 2.676 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)Cc1cc2cccnc2o1 ZINC000449325635 477546518 /nfs/dbraw/zinc/54/65/18/477546518.db2.gz OHDZBNQANOHHOA-QGZVFWFLSA-N 1 3 330.476 2.676 10 0 EFAEHO CC(C)Oc1cccc([C@H](O)C[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@@H]32)c1 ZINC000367618836 477604205 /nfs/dbraw/zinc/60/42/05/477604205.db2.gz OIEROMJYGWWGKW-UAFMIMERSA-N 1 3 332.488 2.970 10 0 EFAEHO CC(C)Oc1cccc([C@H](O)CN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)c1 ZINC000367618836 477604216 /nfs/dbraw/zinc/60/42/16/477604216.db2.gz OIEROMJYGWWGKW-UAFMIMERSA-N 1 3 332.488 2.970 10 0 EFAEHO CC(C)Oc1cccc([C@H](O)CN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@@H]32)c1 ZINC000367618836 477604223 /nfs/dbraw/zinc/60/42/23/477604223.db2.gz OIEROMJYGWWGKW-UAFMIMERSA-N 1 3 332.488 2.970 10 0 EFAEHO Cn1c2cccc(F)c2nc1CCN[C@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000367618994 477604283 /nfs/dbraw/zinc/60/42/83/477604283.db2.gz UXKBZWZKYNUNII-CWRNSKLLSA-N 1 3 330.451 2.717 10 0 EFAEHO Cn1c2cccc(F)c2nc1CCN[C@H]1CC[N@@H+](C)[C@@H]2CCC[C@H]21 ZINC000367618994 477604290 /nfs/dbraw/zinc/60/42/90/477604290.db2.gz UXKBZWZKYNUNII-CWRNSKLLSA-N 1 3 330.451 2.717 10 0 EFAEHO CC(C)Oc1cccc([C@H](O)C[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@H]32)c1 ZINC000367618835 477605061 /nfs/dbraw/zinc/60/50/61/477605061.db2.gz OIEROMJYGWWGKW-MTQWCTHYSA-N 1 3 332.488 2.970 10 0 EFAEHO CC(C)Oc1cccc([C@H](O)CN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)c1 ZINC000367618835 477605065 /nfs/dbraw/zinc/60/50/65/477605065.db2.gz OIEROMJYGWWGKW-MTQWCTHYSA-N 1 3 332.488 2.970 10 0 EFAEHO CC(C)Oc1cccc([C@H](O)CN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@H]32)c1 ZINC000367618835 477605069 /nfs/dbraw/zinc/60/50/69/477605069.db2.gz OIEROMJYGWWGKW-MTQWCTHYSA-N 1 3 332.488 2.970 10 0 EFAEHO OC1CC[NH+](Cc2ccc(CN[C@@H]3CCCc4n[nH]cc43)cc2)CC1 ZINC000367621550 477606955 /nfs/dbraw/zinc/60/69/55/477606955.db2.gz FBELVLJXOUVRRG-LJQANCHMSA-N 1 3 340.471 2.534 10 0 EFAEHO OC[C@@H]1CCC[N@@H+]1Cc1ccccc1CN[C@H]1CCCc2n[nH]cc21 ZINC000367640284 477616165 /nfs/dbraw/zinc/61/61/65/477616165.db2.gz ZODVSZCGNDSLPW-HKUYNNGSSA-N 1 3 340.471 2.534 10 0 EFAEHO OC[C@@H]1CCC[N@H+]1Cc1ccccc1CN[C@H]1CCCc2n[nH]cc21 ZINC000367640284 477616170 /nfs/dbraw/zinc/61/61/70/477616170.db2.gz ZODVSZCGNDSLPW-HKUYNNGSSA-N 1 3 340.471 2.534 10 0 EFAEHO Cc1cc(C)n2c(CN3CC[C@@H](C4CC[NH+](C)CC4)C3)cnc2n1 ZINC000367690657 477638380 /nfs/dbraw/zinc/63/83/80/477638380.db2.gz VCFYKAYKZQABQE-QGZVFWFLSA-N 1 3 327.476 2.510 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccnc(OCC(F)(F)F)c2)[C@@H]2CCC[C@H]21 ZINC000367753355 477673753 /nfs/dbraw/zinc/67/37/53/477673753.db2.gz JVBNIEFVRFRYKP-SOUVJXGZSA-N 1 3 343.393 2.985 10 0 EFAEHO COc1ccc([C@H](CN)C[NH2+][C@]2(CO)C[C@H](C)CC(C)(C)C2)cc1 ZINC000420304828 477677922 /nfs/dbraw/zinc/67/79/22/477677922.db2.gz ORZIDQMOJQVQAX-WRWLIDTKSA-N 1 3 334.504 2.904 10 0 EFAEHO C[NH+](C)CCCC1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC000377323928 477739560 /nfs/dbraw/zinc/73/95/60/477739560.db2.gz SEIYUJJGMXCVAQ-LJQANCHMSA-N 1 3 341.515 2.779 10 0 EFAEHO C[N@H+](CC1CC1)C[C@@H]1CCN([C@H]2CCN(Cc3ccccc3)C2)C1 ZINC000459358748 477864102 /nfs/dbraw/zinc/86/41/02/477864102.db2.gz NDKCWVMOTFFIGM-SFTDATJTSA-N 1 3 327.516 2.925 10 0 EFAEHO C[N@@H+](CC1CC1)C[C@@H]1CCN([C@H]2CCN(Cc3ccccc3)C2)C1 ZINC000459358748 477864109 /nfs/dbraw/zinc/86/41/09/477864109.db2.gz NDKCWVMOTFFIGM-SFTDATJTSA-N 1 3 327.516 2.925 10 0 EFAEHO c1ccc(COC2CC(NC3CC[NH+](C[C@@H]4CCOC4)CC3)C2)cc1 ZINC000493900500 477873069 /nfs/dbraw/zinc/87/30/69/477873069.db2.gz MJMJYKPFRXKRGZ-PELRDEGISA-N 1 3 344.499 2.825 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)CCN(C(=O)CC2CC[NH+](C)CC2)C1 ZINC000456353579 477880436 /nfs/dbraw/zinc/88/04/36/477880436.db2.gz ZLVSREFLYFJRJP-SFHVURJKSA-N 1 3 343.515 2.699 10 0 EFAEHO C[C@H](NCCC[NH2+]Cc1cccnc1)c1ccc2c(c1)CCC(=O)N2 ZINC000516759562 477982467 /nfs/dbraw/zinc/98/24/67/477982467.db2.gz HUGGAITZFLSEHF-HNNXBMFYSA-N 1 3 338.455 2.797 10 0 EFAEHO CCC[NH+]1CCN(c2ccccc2CN2CC3(C2)CCCOC3)CC1 ZINC000459611945 478008238 /nfs/dbraw/zinc/00/82/38/478008238.db2.gz VCMUFMOQUFTNGE-UHFFFAOYSA-N 1 3 343.515 2.831 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2C[C@@H](OCC)C2)CC1 ZINC000459649454 478022763 /nfs/dbraw/zinc/02/27/63/478022763.db2.gz QXUURTSBATYDLN-KDURUIRLSA-N 1 3 331.504 2.876 10 0 EFAEHO Cn1cnc(CC[NH2+][C@@H]2CCC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1 ZINC000459654405 478024044 /nfs/dbraw/zinc/02/40/44/478024044.db2.gz FMKJNSQZGDUAHR-HLAWJBBLSA-N 1 3 338.499 2.853 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439747334 478024991 /nfs/dbraw/zinc/02/49/91/478024991.db2.gz RTJFUMZPONDCEM-VQIMIIECSA-N 1 3 344.503 2.598 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439747334 478024997 /nfs/dbraw/zinc/02/49/97/478024997.db2.gz RTJFUMZPONDCEM-VQIMIIECSA-N 1 3 344.503 2.598 10 0 EFAEHO O=C([C@H]1CCCN1C1CCCC1)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000439845210 478036804 /nfs/dbraw/zinc/03/68/04/478036804.db2.gz YDABXQHJAXVOFD-RBUKOAKNSA-N 1 3 333.520 2.870 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2C[C@H](C)C[C@@H](CO)C2)CC1 ZINC000421357896 478051105 /nfs/dbraw/zinc/05/11/05/478051105.db2.gz AGZVEYSRVHJVLI-RTBURBONSA-N 1 3 345.531 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2C[C@H](C)C[C@@H](CO)C2)CC1 ZINC000421357896 478051110 /nfs/dbraw/zinc/05/11/10/478051110.db2.gz AGZVEYSRVHJVLI-RTBURBONSA-N 1 3 345.531 2.669 10 0 EFAEHO COc1ccccc1-c1ncc(CNCC[C@H]2CCC[N@H+](C)C2)cn1 ZINC000459793868 478095939 /nfs/dbraw/zinc/09/59/39/478095939.db2.gz UBIZRWSROUOULU-MRXNPFEDSA-N 1 3 340.471 2.974 10 0 EFAEHO COc1ccccc1-c1ncc(CNCC[C@H]2CCC[N@@H+](C)C2)cn1 ZINC000459793868 478095949 /nfs/dbraw/zinc/09/59/49/478095949.db2.gz UBIZRWSROUOULU-MRXNPFEDSA-N 1 3 340.471 2.974 10 0 EFAEHO CCN(C(=O)CC[NH2+]C1CC1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000517755993 478122475 /nfs/dbraw/zinc/12/24/75/478122475.db2.gz CCFRDRHVEVLXFS-VQIMIIECSA-N 1 3 329.488 2.813 10 0 EFAEHO CCN(Cc1ccc2c(c1)C[NH2+]CC2)C[C@@H]1COc2ccccc2O1 ZINC000518989300 478203192 /nfs/dbraw/zinc/20/31/92/478203192.db2.gz KXRJGIKHJGFFLC-LJQANCHMSA-N 1 3 338.451 2.994 10 0 EFAEHO C[C@@H]1C[C@H](C[NH3+])CN1C(=O)NCc1ccccc1CN1CCCCC1 ZINC000570146887 478293134 /nfs/dbraw/zinc/29/31/34/478293134.db2.gz ZJAGEFLZSFQCKR-IAGOWNOFSA-N 1 3 344.503 2.551 10 0 EFAEHO O=C(NC[C@H]1CCC[N@@H+]1CC1CCCCC1)N1CCN2CCC1CC2 ZINC000570230979 478315231 /nfs/dbraw/zinc/31/52/31/478315231.db2.gz HXDXMBFLNFTDMW-LJQANCHMSA-N 1 3 348.535 2.521 10 0 EFAEHO O=C(NC[C@H]1CCC[N@H+]1CC1CCCCC1)N1CCN2CCC1CC2 ZINC000570230979 478315236 /nfs/dbraw/zinc/31/52/36/478315236.db2.gz HXDXMBFLNFTDMW-LJQANCHMSA-N 1 3 348.535 2.521 10 0 EFAEHO O=C(NCCN[C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)c1ccccc1Cl ZINC000570320817 478335142 /nfs/dbraw/zinc/33/51/42/478335142.db2.gz ACMKCPMVKSDPFE-BPQIPLTHSA-N 1 3 349.906 2.970 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN2CCC(C[N@@H+](C)C(C)C)CC2)cc1 ZINC000590786597 478340445 /nfs/dbraw/zinc/34/04/45/478340445.db2.gz GWSQCEHINUPHTA-LJQANCHMSA-N 1 3 334.504 2.787 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN2CCC(C[N@H+](C)C(C)C)CC2)cc1 ZINC000590786597 478340447 /nfs/dbraw/zinc/34/04/47/478340447.db2.gz GWSQCEHINUPHTA-LJQANCHMSA-N 1 3 334.504 2.787 10 0 EFAEHO CC(C)[NH2+][C@H]1CCCN(C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000590812984 478351498 /nfs/dbraw/zinc/35/14/98/478351498.db2.gz ZKRBWZQMSQGXNV-IBGZPJMESA-N 1 3 329.488 2.885 10 0 EFAEHO CC[NH2+]CCCNC(=O)N(CC)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000562814270 478358925 /nfs/dbraw/zinc/35/89/25/478358925.db2.gz OLHMBBRTJGNJIN-PKOBYXMFSA-N 1 3 346.519 2.853 10 0 EFAEHO CCN1CC[C@@H]([N@H+](C)Cc2ccc(-n3cncn3)c(F)c2)[C@@H](C)C1 ZINC000539818237 478443402 /nfs/dbraw/zinc/44/34/02/478443402.db2.gz LLYVFRUEQMGIHG-WMLDXEAASA-N 1 3 331.439 2.569 10 0 EFAEHO CCN1CC[C@@H]([N@@H+](C)Cc2ccc(-n3cncn3)c(F)c2)[C@@H](C)C1 ZINC000539818237 478443404 /nfs/dbraw/zinc/44/34/04/478443404.db2.gz LLYVFRUEQMGIHG-WMLDXEAASA-N 1 3 331.439 2.569 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)N1CCc2ccccc2[C@@H]1CN ZINC000563091828 478446026 /nfs/dbraw/zinc/44/60/26/478446026.db2.gz FKXWLCBBHZTENI-MDZRGWNJSA-N 1 3 344.503 2.517 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)N1CCc2ccccc2[C@H]1CN ZINC000563091826 478446351 /nfs/dbraw/zinc/44/63/51/478446351.db2.gz FKXWLCBBHZTENI-GPMSIDNRSA-N 1 3 344.503 2.517 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)N2CCCN(C(C)(C)C)CC2)cc1 ZINC000581874487 478455915 /nfs/dbraw/zinc/45/59/15/478455915.db2.gz XBAGFUYCIIRMSE-HNNXBMFYSA-N 1 3 332.492 2.722 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(CN2CCN(C)CC2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000527641224 478459547 /nfs/dbraw/zinc/45/95/47/478459547.db2.gz MIYDLJBIQWUDHQ-NDXORKPFSA-N 1 3 327.516 2.958 10 0 EFAEHO C[C@@H]([NH2+]Cc1cccc(C(=O)NCCN(C)C)c1)[C@@H]1C[C@H]1C1CC1 ZINC000527653583 478462094 /nfs/dbraw/zinc/46/20/94/478462094.db2.gz MRYWYVSXNNGFKM-CCKFTAQKSA-N 1 3 329.488 2.502 10 0 EFAEHO CN1CCC(CNCc2ccncc2Cl)([NH+]2CCCCC2)CC1 ZINC000527668577 478468620 /nfs/dbraw/zinc/46/86/20/478468620.db2.gz RFYQMEHKOQHQSC-UHFFFAOYSA-N 1 3 336.911 2.775 10 0 EFAEHO CCc1noc(C)c1NC(=O)C1CCN(C2CC[NH+](CC)CC2)CC1 ZINC000582011679 478491104 /nfs/dbraw/zinc/49/11/04/478491104.db2.gz KDIBVVOXDFNJPS-UHFFFAOYSA-N 1 3 348.491 2.680 10 0 EFAEHO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)CCN(C)c2ccncc2)C1 ZINC000540926944 478512370 /nfs/dbraw/zinc/51/23/70/478512370.db2.gz NTYVRSDIMZFWRA-KRWDZBQOSA-N 1 3 346.519 2.925 10 0 EFAEHO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)CCN(C)c2ccncc2)C1 ZINC000540926944 478512375 /nfs/dbraw/zinc/51/23/75/478512375.db2.gz NTYVRSDIMZFWRA-KRWDZBQOSA-N 1 3 346.519 2.925 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)c2ccccc2CC[NH3+])N(C)C)cc1 ZINC000563336113 478521258 /nfs/dbraw/zinc/52/12/58/478521258.db2.gz DFIKICJXYCROJW-FQEVSTJZSA-N 1 3 339.483 2.783 10 0 EFAEHO CN1[C@@H]2CC[C@H]1CC([N@H+](C)Cc1cc3ccccc3n(C)c1=O)C2 ZINC000571104818 478521987 /nfs/dbraw/zinc/52/19/87/478521987.db2.gz UIAPFHOQOOHCNC-JWTNVVGKSA-N 1 3 325.456 2.596 10 0 EFAEHO CN1[C@@H]2CC[C@H]1CC([N@@H+](C)Cc1cc3ccccc3n(C)c1=O)C2 ZINC000571104818 478521993 /nfs/dbraw/zinc/52/19/93/478521993.db2.gz UIAPFHOQOOHCNC-JWTNVVGKSA-N 1 3 325.456 2.596 10 0 EFAEHO C[C@@H](c1ccccc1)N1CCC(NC(=O)N[C@@H]2CC[NH2+]C[C@H]2C)CC1 ZINC000571303978 478567981 /nfs/dbraw/zinc/56/79/81/478567981.db2.gz OCQIVRYCBCGHDW-JTDSTZFVSA-N 1 3 344.503 2.509 10 0 EFAEHO CC[N@@H+]1CC[C@H](NC[C@@H]2CCN2Cc2ccc(OC)cc2)[C@H](C)C1 ZINC000527963712 478590861 /nfs/dbraw/zinc/59/08/61/478590861.db2.gz BONWBGDFYJOOKM-KPFFTGBYSA-N 1 3 331.504 2.589 10 0 EFAEHO CC[N@H+]1CC[C@H](NC[C@@H]2CCN2Cc2ccc(OC)cc2)[C@H](C)C1 ZINC000527963712 478590869 /nfs/dbraw/zinc/59/08/69/478590869.db2.gz BONWBGDFYJOOKM-KPFFTGBYSA-N 1 3 331.504 2.589 10 0 EFAEHO C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)CCN(C)c2ccncc2)C1 ZINC000541855659 478597628 /nfs/dbraw/zinc/59/76/28/478597628.db2.gz QFKDBBGELILMBU-MRXNPFEDSA-N 1 3 332.492 2.535 10 0 EFAEHO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)CCN(C)c2ccncc2)C1 ZINC000541855659 478597632 /nfs/dbraw/zinc/59/76/32/478597632.db2.gz QFKDBBGELILMBU-MRXNPFEDSA-N 1 3 332.492 2.535 10 0 EFAEHO CCN(C(=O)NCC1([NH3+])CCC1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000563601443 478598369 /nfs/dbraw/zinc/59/83/69/478598369.db2.gz HOPHHWVHNBXLNS-AEFFLSMTSA-N 1 3 344.503 2.735 10 0 EFAEHO COc1ccc(CC[NH2+][C@H](C)c2cccc(OCCN(C)C)c2)cn1 ZINC000527989430 478600345 /nfs/dbraw/zinc/60/03/45/478600345.db2.gz XJBQCWFBKKCQIM-MRXNPFEDSA-N 1 3 343.471 2.924 10 0 EFAEHO C[C@@H](CSCCF)[NH2+]Cc1ccccc1CN1CCC(O)CC1 ZINC000595011869 478627613 /nfs/dbraw/zinc/62/76/13/478627613.db2.gz JYWDZGLXKLTGGC-HNNXBMFYSA-N 1 3 340.508 2.824 10 0 EFAEHO C[C@H](CSCCF)[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000595025743 478633306 /nfs/dbraw/zinc/63/33/06/478633306.db2.gz MDBRKNYDRQAUAH-MRXNPFEDSA-N 1 3 331.545 2.618 10 0 EFAEHO C[C@H](CSCCF)[NH2+]CC1CCN(Cc2ccncc2)CC1 ZINC000595069949 478650997 /nfs/dbraw/zinc/65/09/97/478650997.db2.gz TZXNUHXSCRRDJP-OAHLLOKOSA-N 1 3 325.497 2.974 10 0 EFAEHO CN1CCC[C@H](CNC(=O)CCCC[NH+](C)C)[C@@H]1c1cccs1 ZINC000571848316 478688322 /nfs/dbraw/zinc/68/83/22/478688322.db2.gz QCYFLXIAKKZGKD-CRAIPNDOSA-N 1 3 337.533 2.979 10 0 EFAEHO CCCC[NH+]1CCC(NC(=O)NC[C@H]2CCN2C2CCCC2)CC1 ZINC000528289059 478710403 /nfs/dbraw/zinc/71/04/03/478710403.db2.gz PNDBXHLCNISLMH-GOSISDBHSA-N 1 3 336.524 2.567 10 0 EFAEHO Cc1cccc(C(=O)NCCN[C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000564824531 478822451 /nfs/dbraw/zinc/82/24/51/478822451.db2.gz HBPDZIPDIOTHBG-GBESFXJTSA-N 1 3 329.488 2.625 10 0 EFAEHO CCC[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(=O)NC[C@H]1CCCN1C ZINC000528560719 478833738 /nfs/dbraw/zinc/83/37/38/478833738.db2.gz ACJDDJBUOQVRIS-VAMGGRTRSA-N 1 3 343.515 2.745 10 0 EFAEHO CCC[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)NC[C@H]1CCCN1C ZINC000528560719 478833744 /nfs/dbraw/zinc/83/37/44/478833744.db2.gz ACJDDJBUOQVRIS-VAMGGRTRSA-N 1 3 343.515 2.745 10 0 EFAEHO CN(C)[C@H](CNC(=O)[C@H]1CCCCCC[C@H]1[NH3+])Cc1ccccc1 ZINC000564889482 478848753 /nfs/dbraw/zinc/84/87/53/478848753.db2.gz DMXDWDMIXSZNMR-GBESFXJTSA-N 1 3 331.504 2.573 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@@H](c2ccccn2)C2CCC2)CC1 ZINC000528659208 478874599 /nfs/dbraw/zinc/87/45/99/478874599.db2.gz OJWMCHUTXKVEEW-HXUWFJFHSA-N 1 3 330.520 2.929 10 0 EFAEHO Cn1cncc1[C@H]1[C@H](CNc2cc[nH+]c3ccccc23)CCCN1C ZINC000583618211 478895795 /nfs/dbraw/zinc/89/57/95/478895795.db2.gz OTEZOEXITZHLBU-MGPUTAFESA-N 1 3 335.455 2.885 10 0 EFAEHO C[C@H]1CCC[C@H](C)[NH+]1CCNC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000583741410 478929501 /nfs/dbraw/zinc/92/95/01/478929501.db2.gz YNDLOPSOQZOEIB-KBPBESRZSA-N 1 3 348.466 2.856 10 0 EFAEHO CCC[C@@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc3c(c2)C[NH2+]CC3)C1 ZINC000572888540 478944974 /nfs/dbraw/zinc/94/49/74/478944974.db2.gz VQZADHMGMPPSGQ-VQIMIIECSA-N 1 3 343.515 2.849 10 0 EFAEHO N[C@H]1CCCCC[C@@H]1[NH2+]Cc1ccc(Cn2ccccc2=O)cc1 ZINC000583806464 478945731 /nfs/dbraw/zinc/94/57/31/478945731.db2.gz IZBUEPIXTHNBQD-OALUTQOASA-N 1 3 325.456 2.646 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3CCC[C@](C)(F)C3)CC2)CC1 ZINC000565198881 478948209 /nfs/dbraw/zinc/94/82/09/478948209.db2.gz HTAASIUJNDNERZ-IBGZPJMESA-N 1 3 339.499 2.533 10 0 EFAEHO O=C(CCNCc1ccc(C[NH+]2CCCC2)cc1)Nc1cccnc1 ZINC000573299960 479033770 /nfs/dbraw/zinc/03/37/70/479033770.db2.gz RUAMGZCCMAZYMN-UHFFFAOYSA-N 1 3 338.455 2.796 10 0 EFAEHO C[C@H]([NH3+])C[C@H](C)NC(=O)N1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000565595146 479042393 /nfs/dbraw/zinc/04/23/93/479042393.db2.gz AYRVAZHTBQSDPH-GJZGRUSLSA-N 1 3 326.529 2.654 10 0 EFAEHO C[NH+](C)CCc1ccccc1NC(=O)NC[C@H]1CCN1C1CCCC1 ZINC000529076953 479042713 /nfs/dbraw/zinc/04/27/13/479042713.db2.gz FNPBRTYONKGCRA-GOSISDBHSA-N 1 3 344.503 2.929 10 0 EFAEHO COc1cccc([C@@H]2[C@H](N[C@@H]3CCC[C@@H]([NH3+])C3)CCN2C2CC2)c1 ZINC000569867965 479197461 /nfs/dbraw/zinc/19/74/61/479197461.db2.gz QMLGKHAOBRBNDD-XNFNUYLZSA-N 1 3 329.488 2.833 10 0 EFAEHO C[C@@H]([NH2+]Cc1cccc(C(=O)NCCN(C)C)c1)C1CC(F)(F)C1 ZINC000529539748 479198867 /nfs/dbraw/zinc/19/88/67/479198867.db2.gz XCCZWVVLPQGBSX-CYBMUJFWSA-N 1 3 339.430 2.501 10 0 EFAEHO C[C@@H]([NH2+]CC1(N2CCCCC2)CCN(C)CC1)C1CC(F)(F)C1 ZINC000529546811 479201793 /nfs/dbraw/zinc/20/17/93/479201793.db2.gz FKVSFCMHGYSBSL-OAHLLOKOSA-N 1 3 329.479 2.960 10 0 EFAEHO C[C@@H]([NH2+]C(C)(C)CNC(=O)N[C@H]1CCCN(C)C1)c1ccccc1 ZINC000603593565 479409935 /nfs/dbraw/zinc/40/99/35/479409935.db2.gz MLBUGBAQQULUOJ-WBVHZDCISA-N 1 3 332.492 2.509 10 0 EFAEHO CCOC(=O)c1cccc(CNCCCC[NH+]2CCC(C)CC2)n1 ZINC000600123000 479529042 /nfs/dbraw/zinc/52/90/42/479529042.db2.gz GXUXUPQYPBOKSI-UHFFFAOYSA-N 1 3 333.476 2.860 10 0 EFAEHO CC[C@](CN[C@@H]1CC[N@H+](C)C(C)(C)C1)(C(=O)OC)c1ccccc1 ZINC000600165026 479555121 /nfs/dbraw/zinc/55/51/21/479555121.db2.gz OOUUPLKLHPQBHE-YLJYHZDGSA-N 1 3 332.488 2.970 10 0 EFAEHO CC[C@](CN[C@@H]1CC[N@@H+](C)C(C)(C)C1)(C(=O)OC)c1ccccc1 ZINC000600165026 479555128 /nfs/dbraw/zinc/55/51/28/479555128.db2.gz OOUUPLKLHPQBHE-YLJYHZDGSA-N 1 3 332.488 2.970 10 0 EFAEHO C[C@@H](C[NH+]1CCC(C)CC1)NC(=O)CCN1CCc2ccccc2C1 ZINC000618985302 479659947 /nfs/dbraw/zinc/65/99/47/479659947.db2.gz GPDYQUCROANNMW-SFHVURJKSA-N 1 3 343.515 2.671 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NC[C@@H]2CCCCN2C2CC2)CC1 ZINC000633190031 479709720 /nfs/dbraw/zinc/70/97/20/479709720.db2.gz IMAQLASBRDKICH-KRWDZBQOSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@H]1CC[C@H]1c1ccc(F)cc1 ZINC000628050362 479746505 /nfs/dbraw/zinc/74/65/05/479746505.db2.gz BHXFZMHALVNOPH-SNRMKQJTSA-N 1 3 349.494 2.708 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@H]1CC[C@H]1c1ccc(F)cc1 ZINC000628050362 479746511 /nfs/dbraw/zinc/74/65/11/479746511.db2.gz BHXFZMHALVNOPH-SNRMKQJTSA-N 1 3 349.494 2.708 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C1(C)CCC(F)(F)CC1 ZINC000628051217 479747907 /nfs/dbraw/zinc/74/79/07/479747907.db2.gz YZBNDFOJXGGEPE-AWEZNQCLSA-N 1 3 333.467 2.590 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C1(C)CCC(F)(F)CC1 ZINC000628051217 479747910 /nfs/dbraw/zinc/74/79/10/479747910.db2.gz YZBNDFOJXGGEPE-AWEZNQCLSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCN(Cc3ccccc3)C[C@H](C)C2)CC[N@@H+]1C ZINC000633328088 479771200 /nfs/dbraw/zinc/77/12/00/479771200.db2.gz HHECIJKBAVVHJX-YSIASYRMSA-N 1 3 343.515 2.697 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCN(Cc3ccccc3)C[C@H](C)C2)CC[N@H+]1C ZINC000633328088 479771207 /nfs/dbraw/zinc/77/12/07/479771207.db2.gz HHECIJKBAVVHJX-YSIASYRMSA-N 1 3 343.515 2.697 10 0 EFAEHO Cc1ncc(CNCCc2ccc(OCC[NH+]3CCCC3)cc2)o1 ZINC000628232109 479821601 /nfs/dbraw/zinc/82/16/01/479821601.db2.gz MZWXSIGNSPWKDQ-UHFFFAOYSA-N 1 3 329.444 2.790 10 0 EFAEHO COc1ccc([C@@H](CN[C@@H]2CC[N@H+](C)C(C)(C)C2)N(C)C)cc1OC ZINC000623338384 480239567 /nfs/dbraw/zinc/23/95/67/480239567.db2.gz XYLBZHKNSPUAOQ-IAGOWNOFSA-N 1 3 349.519 2.769 10 0 EFAEHO COc1ccc([C@@H](CN[C@@H]2CC[N@@H+](C)C(C)(C)C2)N(C)C)cc1OC ZINC000623338384 480239573 /nfs/dbraw/zinc/23/95/73/480239573.db2.gz XYLBZHKNSPUAOQ-IAGOWNOFSA-N 1 3 349.519 2.769 10 0 EFAEHO COc1ccc([C@@H](C[NH2+][C@@H]2CCN(C)C(C)(C)C2)N(C)C)cc1OC ZINC000623338384 480239579 /nfs/dbraw/zinc/23/95/79/480239579.db2.gz XYLBZHKNSPUAOQ-IAGOWNOFSA-N 1 3 349.519 2.769 10 0 EFAEHO CN1CC[C@H]([NH2+]CCCN2CCN(c3ccccc3)CC2)CC1(C)C ZINC000623348514 480244555 /nfs/dbraw/zinc/24/45/55/480244555.db2.gz AVZVOSATHTUFEO-IBGZPJMESA-N 1 3 344.547 2.661 10 0 EFAEHO Cc1cccc2c(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)coc21 ZINC000617502409 480245047 /nfs/dbraw/zinc/24/50/47/480245047.db2.gz OHGNIXJNFGGAAY-HNNXBMFYSA-N 1 3 331.460 2.743 10 0 EFAEHO Cc1cccc2c(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)coc21 ZINC000617502409 480245051 /nfs/dbraw/zinc/24/50/51/480245051.db2.gz OHGNIXJNFGGAAY-HNNXBMFYSA-N 1 3 331.460 2.743 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C[C@]12CCCC[C@H]1C2(F)F ZINC000617502419 480245227 /nfs/dbraw/zinc/24/52/27/480245227.db2.gz ONNXGNTXFKOKPW-ZMSDIMECSA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C[C@]12CCCC[C@H]1C2(F)F ZINC000617502419 480245232 /nfs/dbraw/zinc/24/52/32/480245232.db2.gz ONNXGNTXFKOKPW-ZMSDIMECSA-N 1 3 345.478 2.590 10 0 EFAEHO C[C@@H](C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccc(Cl)cc1 ZINC000617502513 480245375 /nfs/dbraw/zinc/24/53/75/480245375.db2.gz RVVGKXAHTCNIBX-LSDHHAIUSA-N 1 3 339.911 2.832 10 0 EFAEHO C[C@@H](C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccc(Cl)cc1 ZINC000617502513 480245381 /nfs/dbraw/zinc/24/53/81/480245381.db2.gz RVVGKXAHTCNIBX-LSDHHAIUSA-N 1 3 339.911 2.832 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(C(F)F)cc1F ZINC000617502529 480245579 /nfs/dbraw/zinc/24/55/79/480245579.db2.gz SNFOKHHYZGAFBW-LBPRGKRZSA-N 1 3 345.409 2.765 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(C(F)F)cc1F ZINC000617502529 480245587 /nfs/dbraw/zinc/24/55/87/480245587.db2.gz SNFOKHHYZGAFBW-LBPRGKRZSA-N 1 3 345.409 2.765 10 0 EFAEHO CCC(CC)[C@@H](CN[C@H]1CC[N@H+](C)C(C)(C)C1)N1CCOCC1 ZINC000623353432 480245714 /nfs/dbraw/zinc/24/57/14/480245714.db2.gz LGSXYWUMSRPFBH-ZWKOTPCHSA-N 1 3 325.541 2.586 10 0 EFAEHO CCC(CC)[C@@H](CN[C@H]1CC[N@@H+](C)C(C)(C)C1)N1CCOCC1 ZINC000623353432 480245717 /nfs/dbraw/zinc/24/57/17/480245717.db2.gz LGSXYWUMSRPFBH-ZWKOTPCHSA-N 1 3 325.541 2.586 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1csc2ccccc12 ZINC000617504464 480246217 /nfs/dbraw/zinc/24/62/17/480246217.db2.gz XFTWQSDZMCUIGZ-AWEZNQCLSA-N 1 3 333.501 2.903 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1csc2ccccc12 ZINC000617504464 480246222 /nfs/dbraw/zinc/24/62/22/480246222.db2.gz XFTWQSDZMCUIGZ-AWEZNQCLSA-N 1 3 333.501 2.903 10 0 EFAEHO Cc1c2cc(F)ccc2oc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617504279 480246632 /nfs/dbraw/zinc/24/66/32/480246632.db2.gz NUDBSMWBNVLGTM-ZDUSSCGKSA-N 1 3 349.450 2.882 10 0 EFAEHO Cc1c2cc(F)ccc2oc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617504279 480246638 /nfs/dbraw/zinc/24/66/38/480246638.db2.gz NUDBSMWBNVLGTM-ZDUSSCGKSA-N 1 3 349.450 2.882 10 0 EFAEHO Cc1cc(F)cc2[nH]c(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc21 ZINC000617505504 480246798 /nfs/dbraw/zinc/24/67/98/480246798.db2.gz FJGOWKQFKYQPIW-AWEZNQCLSA-N 1 3 348.466 2.617 10 0 EFAEHO Cc1cc(F)cc2[nH]c(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc21 ZINC000617505504 480246803 /nfs/dbraw/zinc/24/68/03/480246803.db2.gz FJGOWKQFKYQPIW-AWEZNQCLSA-N 1 3 348.466 2.617 10 0 EFAEHO C[C@H](CN[C@H]1CC[N@H+](C)C(C)(C)C1)N1CCN(c2ccccc2)CC1 ZINC000623357585 480247640 /nfs/dbraw/zinc/24/76/40/480247640.db2.gz WWDZYFCGYKLGND-MOPGFXCFSA-N 1 3 344.547 2.660 10 0 EFAEHO C[C@H](CN[C@H]1CC[N@@H+](C)C(C)(C)C1)N1CCN(c2ccccc2)CC1 ZINC000623357585 480247648 /nfs/dbraw/zinc/24/76/48/480247648.db2.gz WWDZYFCGYKLGND-MOPGFXCFSA-N 1 3 344.547 2.660 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cc2ccccc2s1 ZINC000617503521 480247943 /nfs/dbraw/zinc/24/79/43/480247943.db2.gz MZIBWGPGCYRIMX-AWEZNQCLSA-N 1 3 333.501 2.903 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cc2ccccc2s1 ZINC000617503521 480247951 /nfs/dbraw/zinc/24/79/51/480247951.db2.gz MZIBWGPGCYRIMX-AWEZNQCLSA-N 1 3 333.501 2.903 10 0 EFAEHO Cc1[nH]c2c(cccc2C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1C ZINC000617504026 480248050 /nfs/dbraw/zinc/24/80/50/480248050.db2.gz FQUWLSBEUDMBJK-AWEZNQCLSA-N 1 3 344.503 2.787 10 0 EFAEHO Cc1[nH]c2c(cccc2C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1C ZINC000617504026 480248054 /nfs/dbraw/zinc/24/80/54/480248054.db2.gz FQUWLSBEUDMBJK-AWEZNQCLSA-N 1 3 344.503 2.787 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C[C@H](C)c1ccccc1F ZINC000617504770 480248204 /nfs/dbraw/zinc/24/82/04/480248204.db2.gz JUFVDAXVHREPMO-HOTGVXAUSA-N 1 3 337.483 2.708 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C[C@H](C)c1ccccc1F ZINC000617504770 480248208 /nfs/dbraw/zinc/24/82/08/480248208.db2.gz JUFVDAXVHREPMO-HOTGVXAUSA-N 1 3 337.483 2.708 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cccc(C(F)(F)F)c1 ZINC000617503367 480248303 /nfs/dbraw/zinc/24/83/03/480248303.db2.gz GLTIJDCGARXROY-ZDUSSCGKSA-N 1 3 345.409 2.707 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cccc(C(F)(F)F)c1 ZINC000617503367 480248305 /nfs/dbraw/zinc/24/83/05/480248305.db2.gz GLTIJDCGARXROY-ZDUSSCGKSA-N 1 3 345.409 2.707 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C1(Cc2ccc(F)cc2)CC1 ZINC000617506854 480250097 /nfs/dbraw/zinc/25/00/97/480250097.db2.gz AGNVPJXRUSOFNT-INIZCTEOSA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C1(Cc2ccc(F)cc2)CC1 ZINC000617506854 480250103 /nfs/dbraw/zinc/25/01/03/480250103.db2.gz AGNVPJXRUSOFNT-INIZCTEOSA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(C(C)(F)F)cc1 ZINC000617507738 480250772 /nfs/dbraw/zinc/25/07/72/480250772.db2.gz HWNWPEXDEJAOSI-AWEZNQCLSA-N 1 3 341.446 2.800 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(C(C)(F)F)cc1 ZINC000617507738 480250780 /nfs/dbraw/zinc/25/07/80/480250780.db2.gz HWNWPEXDEJAOSI-AWEZNQCLSA-N 1 3 341.446 2.800 10 0 EFAEHO CSc1c(F)cccc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617506870 480250804 /nfs/dbraw/zinc/25/08/04/480250804.db2.gz AWEQYISCKWQYRK-ZDUSSCGKSA-N 1 3 341.496 2.549 10 0 EFAEHO CSc1c(F)cccc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617506870 480250809 /nfs/dbraw/zinc/25/08/09/480250809.db2.gz AWEQYISCKWQYRK-ZDUSSCGKSA-N 1 3 341.496 2.549 10 0 EFAEHO Cc1cc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c(C)cc1Cl ZINC000617507177 480251224 /nfs/dbraw/zinc/25/12/24/480251224.db2.gz LPTDEKFRFXETMQ-HNNXBMFYSA-N 1 3 339.911 2.959 10 0 EFAEHO Cc1cc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c(C)cc1Cl ZINC000617507177 480251230 /nfs/dbraw/zinc/25/12/30/480251230.db2.gz LPTDEKFRFXETMQ-HNNXBMFYSA-N 1 3 339.911 2.959 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)CC1CC(c2ccccc2)C1 ZINC000617506901 480251327 /nfs/dbraw/zinc/25/13/27/480251327.db2.gz BVBPSEZYQSCNMZ-ZJRDLVKKSA-N 1 3 345.531 2.959 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)CC1CC(c2ccccc2)C1 ZINC000617506901 480251334 /nfs/dbraw/zinc/25/13/34/480251334.db2.gz BVBPSEZYQSCNMZ-ZJRDLVKKSA-N 1 3 345.531 2.959 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccc(CN3CCCC3=O)cc2)CC1(C)C ZINC000623370367 480254137 /nfs/dbraw/zinc/25/41/37/480254137.db2.gz HTRRNHNZAWTNCY-SFHVURJKSA-N 1 3 329.488 2.771 10 0 EFAEHO C[C@@H](CN1CCN(c2ccccc2)CC1)N[C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623428836 480278556 /nfs/dbraw/zinc/27/85/56/480278556.db2.gz AKNKTMABUKUKBA-OALUTQOASA-N 1 3 344.547 2.660 10 0 EFAEHO C[C@@H](CN1CCN(c2ccccc2)CC1)N[C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623428836 480278559 /nfs/dbraw/zinc/27/85/59/480278559.db2.gz AKNKTMABUKUKBA-OALUTQOASA-N 1 3 344.547 2.660 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C)C(C)(C)C2)c(N2CCOCC2)c1 ZINC000623443016 480286102 /nfs/dbraw/zinc/28/61/02/480286102.db2.gz LXCUGUPYICQZDN-SFHVURJKSA-N 1 3 331.504 2.794 10 0 EFAEHO COc1ccc([C@@H](C)[NH2+]CC2(N)CCOCC2)cc1Br ZINC000629521849 480292828 /nfs/dbraw/zinc/29/28/28/480292828.db2.gz SLQKYGWULOLUJX-LLVKDONJSA-N 1 3 343.265 2.616 10 0 EFAEHO C[C@@H]([NH2+]CC1(N)CCOCC1)c1ccc(OCC(F)(F)F)cc1 ZINC000629521629 480293343 /nfs/dbraw/zinc/29/33/43/480293343.db2.gz PGWLBSGPWUVIHT-GFCCVEGCSA-N 1 3 332.366 2.786 10 0 EFAEHO CC[C@@H]([NH2+]CC1(N)CCOCC1)c1cccc(Br)c1 ZINC000629523142 480295104 /nfs/dbraw/zinc/29/51/04/480295104.db2.gz ADUKCXOFTMOGMX-CQSZACIVSA-N 1 3 327.266 2.998 10 0 EFAEHO C[NH2+]CCOCCN[C@@H](C)c1cnn(-c2cccc(Cl)c2)c1C ZINC000629529182 480295698 /nfs/dbraw/zinc/29/56/98/480295698.db2.gz UQDUZLFNCVTPRK-ZDUSSCGKSA-N 1 3 336.867 2.721 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1ccc(Br)c(F)c1F ZINC000629531999 480297028 /nfs/dbraw/zinc/29/70/28/480297028.db2.gz IAFKOZPNVNHANR-SNVBAGLBSA-N 1 3 337.208 2.571 10 0 EFAEHO [NH3+]CCCOCCN[C@@H]1CCCc2c(Br)cccc21 ZINC000629536061 480297487 /nfs/dbraw/zinc/29/74/87/480297487.db2.gz FBQPFIVHQMBFRZ-OAHLLOKOSA-N 1 3 327.266 2.782 10 0 EFAEHO [NH3+]CCCOCCN[C@H]1CCCc2cc(Br)ccc21 ZINC000629535275 480297575 /nfs/dbraw/zinc/29/75/75/480297575.db2.gz BXISFOHBTOUXLZ-HNNXBMFYSA-N 1 3 327.266 2.782 10 0 EFAEHO Cc1c([C@H](C)NCCOCCC[NH3+])cnn1-c1cc(C)ccc1C ZINC000629535654 480298106 /nfs/dbraw/zinc/29/81/06/480298106.db2.gz DWLBMQJXFZZEBU-INIZCTEOSA-N 1 3 330.476 2.814 10 0 EFAEHO Fc1cccc(F)c1CCCN1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000629591971 480321510 /nfs/dbraw/zinc/32/15/10/480321510.db2.gz WTBLEBWQQRYSMP-MRXNPFEDSA-N 1 3 338.442 2.988 10 0 EFAEHO C[C@@](O)(C[C@@H](O)CNCc1ccc(C[NH+]2CCCCC2)cc1)C1CC1 ZINC000634639800 480390411 /nfs/dbraw/zinc/39/04/11/480390411.db2.gz PHOXMWIGOMOKHX-NHCUHLMSSA-N 1 3 346.515 2.674 10 0 EFAEHO C[C@H](CN1CCCCC1)NC(=O)NC[C@H]1CC[N@@H+]1C1CCCCC1 ZINC000623707768 480411447 /nfs/dbraw/zinc/41/14/47/480411447.db2.gz JXLMZAQVQWCBGL-SJLPKXTDSA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@H](CN1CCCCC1)NC(=O)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000623707768 480411455 /nfs/dbraw/zinc/41/14/55/480411455.db2.gz JXLMZAQVQWCBGL-SJLPKXTDSA-N 1 3 336.524 2.567 10 0 EFAEHO CC(C)OC[C@@H](O)CNCc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000644522253 480412073 /nfs/dbraw/zinc/41/20/73/480412073.db2.gz GVFAQNPWMIAACZ-PXNSSMCTSA-N 1 3 334.504 2.937 10 0 EFAEHO CC(C)OC[C@@H](O)CNCc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000644522253 480412078 /nfs/dbraw/zinc/41/20/78/480412078.db2.gz GVFAQNPWMIAACZ-PXNSSMCTSA-N 1 3 334.504 2.937 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]Cc2cncc(Cl)c2)[C@H](C)C1 ZINC000621280010 480427609 /nfs/dbraw/zinc/42/76/09/480427609.db2.gz JJWUFRDWHWAJMP-RHSMWYFYSA-N 1 3 325.884 2.962 10 0 EFAEHO CN(c1ccccc1CN[C@H]1CO[C@@H](C2CC2)C1)C1CC[NH+](C)CC1 ZINC000623752787 480438025 /nfs/dbraw/zinc/43/80/25/480438025.db2.gz LDWDJTPJZZVMIL-WIYYLYMNSA-N 1 3 343.515 2.874 10 0 EFAEHO C[C@](O)(C[C@H](O)CNCc1ccccc1C[NH+]1CCCCC1)C1CC1 ZINC000634698805 480439309 /nfs/dbraw/zinc/43/93/09/480439309.db2.gz YORGRYPIOYEOCV-SFTDATJTSA-N 1 3 346.515 2.674 10 0 EFAEHO CC(C)OC[C@H](O)C[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000644619406 480476835 /nfs/dbraw/zinc/47/68/35/480476835.db2.gz GVHAQAGZKPNTGJ-JSXRDJHFSA-N 1 3 346.515 2.663 10 0 EFAEHO CC(C)OC[C@H](O)CN[C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000644619406 480476841 /nfs/dbraw/zinc/47/68/41/480476841.db2.gz GVHAQAGZKPNTGJ-JSXRDJHFSA-N 1 3 346.515 2.663 10 0 EFAEHO CC(C)OC[C@H](O)CN[C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000644619406 480476845 /nfs/dbraw/zinc/47/68/45/480476845.db2.gz GVHAQAGZKPNTGJ-JSXRDJHFSA-N 1 3 346.515 2.663 10 0 EFAEHO CCC(=O)c1ccc(NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000626726161 480495272 /nfs/dbraw/zinc/49/52/72/480495272.db2.gz AVKSVHUYYJVSHH-HNNXBMFYSA-N 1 3 348.491 2.673 10 0 EFAEHO CCC(=O)c1ccc(NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000626726161 480495276 /nfs/dbraw/zinc/49/52/76/480495276.db2.gz AVKSVHUYYJVSHH-HNNXBMFYSA-N 1 3 348.491 2.673 10 0 EFAEHO C[NH+](C)C[C@H](O)CN[C@@H]1CCCC[C@H]1Sc1ccc(F)cc1 ZINC000623889085 480505586 /nfs/dbraw/zinc/50/55/86/480505586.db2.gz CJYLAOYNAHMOPY-DJIMGWMZSA-N 1 3 326.481 2.741 10 0 EFAEHO Cc1ccc(Br)cc1[C@H](C)[NH2+]CC1(O)CCN(C)CC1 ZINC000623898076 480512342 /nfs/dbraw/zinc/51/23/42/480512342.db2.gz YTVBFQKEVRCTDU-ZDUSSCGKSA-N 1 3 341.293 2.865 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N[C@H]2CC[C@@H](C)[NH2+]C2)N2CCCC2)cc1 ZINC000626956547 480597695 /nfs/dbraw/zinc/59/76/95/480597695.db2.gz DUQSNUOWXABOHX-NEWSRXKRSA-N 1 3 344.503 2.572 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N[C@@H]2CC[C@H](C)[NH2+]C2)N2CCCC2)cc1 ZINC000626956551 480597775 /nfs/dbraw/zinc/59/77/75/480597775.db2.gz DUQSNUOWXABOHX-UHOSZYNNSA-N 1 3 344.503 2.572 10 0 EFAEHO CC(C)(C)[NH+]1CCC(NCC2(OCCO)CCC(F)(F)CC2)CC1 ZINC000624102461 480609644 /nfs/dbraw/zinc/60/96/44/480609644.db2.gz XJXPNKYENHIBPP-UHFFFAOYSA-N 1 3 348.478 2.796 10 0 EFAEHO CCN(C(=O)N[C@@H]1CC[NH2+][C@H]1C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000627240875 480708968 /nfs/dbraw/zinc/70/89/68/480708968.db2.gz BSASKYANNMKUMA-QFHJOOASSA-N 1 3 344.503 2.604 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCC1)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000624374750 480735469 /nfs/dbraw/zinc/73/54/69/480735469.db2.gz ZGTFTLUKMQZGDE-APWZRJJASA-N 1 3 348.535 2.710 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCC1)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000624374750 480735475 /nfs/dbraw/zinc/73/54/75/480735475.db2.gz ZGTFTLUKMQZGDE-APWZRJJASA-N 1 3 348.535 2.710 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCC1)NC[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC000624544561 480810130 /nfs/dbraw/zinc/81/01/30/480810130.db2.gz XCAMZOZRBBFVNX-OALUTQOASA-N 1 3 348.535 2.710 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCC1)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000624544561 480810134 /nfs/dbraw/zinc/81/01/34/480810134.db2.gz XCAMZOZRBBFVNX-OALUTQOASA-N 1 3 348.535 2.710 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCC1)NC[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC000624544562 480810200 /nfs/dbraw/zinc/81/02/00/480810200.db2.gz XCAMZOZRBBFVNX-RBUKOAKNSA-N 1 3 348.535 2.710 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCC1)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000624544562 480810202 /nfs/dbraw/zinc/81/02/02/480810202.db2.gz XCAMZOZRBBFVNX-RBUKOAKNSA-N 1 3 348.535 2.710 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)Nc2cccc3c2CCNC3)CC1 ZINC000632948032 480816729 /nfs/dbraw/zinc/81/67/29/480816729.db2.gz CSSYUUZDUMIVBU-UHFFFAOYSA-N 1 3 330.476 2.670 10 0 EFAEHO CCN(CCNC(=O)N1CCC(CC)([NH+]2CCCC2)CC1)C1CC1 ZINC000632984733 480833868 /nfs/dbraw/zinc/83/38/68/480833868.db2.gz DKAFRLPDDYKVRT-UHFFFAOYSA-N 1 3 336.524 2.521 10 0 EFAEHO O=C(CC1CC[NH2+]CC1)N[C@@H]1CCCCCN(Cc2ccccc2)C1 ZINC000638850843 480896549 /nfs/dbraw/zinc/89/65/49/480896549.db2.gz HLKZFVKOOYCLHU-HXUWFJFHSA-N 1 3 343.515 2.937 10 0 EFAEHO COc1cncc(/C=C\CCN2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)c1 ZINC000645837913 480940926 /nfs/dbraw/zinc/94/09/26/480940926.db2.gz PPQJRTSRCHWGBT-JFYBOWFUSA-N 1 3 345.487 2.677 10 0 EFAEHO CN(C)CCOc1ccc(CN2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)cc1 ZINC000647480222 480958590 /nfs/dbraw/zinc/95/85/90/480958590.db2.gz HESWIQJEFHFXOH-UYAOXDASSA-N 1 3 331.504 2.591 10 0 EFAEHO CN(C)CCOc1ccc(CN2CCC[C@H]([C@H]3CCC[NH2+]3)C2)cc1 ZINC000647480219 480959022 /nfs/dbraw/zinc/95/90/22/480959022.db2.gz HESWIQJEFHFXOH-AZUAARDMSA-N 1 3 331.504 2.591 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)NC[C@@H]2CCN2C(C)(C)C)c1 ZINC000661397109 480983348 /nfs/dbraw/zinc/98/33/48/480983348.db2.gz BVGXUKFMMOZPMP-SFHVURJKSA-N 1 3 346.519 2.810 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)NC[C@@H]2CCN2C(C)(C)C)c1 ZINC000661397109 480983353 /nfs/dbraw/zinc/98/33/53/480983353.db2.gz BVGXUKFMMOZPMP-SFHVURJKSA-N 1 3 346.519 2.810 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647542703 480990512 /nfs/dbraw/zinc/99/05/12/480990512.db2.gz ACWKTCJGSDHVGJ-ROUUACIJSA-N 1 3 339.487 2.787 10 0 EFAEHO COc1cc(CN2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)cc2c1OCCO2 ZINC000647543240 480992645 /nfs/dbraw/zinc/99/26/45/480992645.db2.gz JWDIKOQWORYMKN-SJORKVTESA-N 1 3 346.471 2.678 10 0 EFAEHO CCN(Cc1ccc(CN(C)C)cc1)C(=O)[C@@H]1CC[C@@H](C2CC2)[NH2+]1 ZINC000653148939 481111539 /nfs/dbraw/zinc/11/15/39/481111539.db2.gz QNPNSAHBJHQVET-OALUTQOASA-N 1 3 329.488 2.627 10 0 EFAEHO CCN(Cc1ccc(CN(C)C)cc1)C(=O)[C@H]1CC[C@H](C2CC2)[NH2+]1 ZINC000653148941 481112087 /nfs/dbraw/zinc/11/20/87/481112087.db2.gz QNPNSAHBJHQVET-RTBURBONSA-N 1 3 329.488 2.627 10 0 EFAEHO C[C@@H]1CC[NH2+]C[C@@H]1NC(=O)N[C@@H](CN1CCCCC1)c1ccccc1 ZINC000669483616 481151219 /nfs/dbraw/zinc/15/12/19/481151219.db2.gz DPSKSWCJRXGCRT-NEWSRXKRSA-N 1 3 344.503 2.511 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccccc1Cl ZINC000664315540 481171799 /nfs/dbraw/zinc/17/17/99/481171799.db2.gz SGDVVRBBWFXXSM-ZDUSSCGKSA-N 1 3 326.872 2.734 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccccc1Cl ZINC000664315540 481171806 /nfs/dbraw/zinc/17/18/06/481171806.db2.gz SGDVVRBBWFXXSM-ZDUSSCGKSA-N 1 3 326.872 2.734 10 0 EFAEHO O=C(NCc1ccc2c(c1)CNC2)c1ccccc1CC1CC[NH2+]CC1 ZINC000669514562 481175028 /nfs/dbraw/zinc/17/50/28/481175028.db2.gz NRUQWCOZMWQEIC-UHFFFAOYSA-N 1 3 349.478 2.762 10 0 EFAEHO CCCC[N@H+](C)C[C@H](C)NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659040385 481181989 /nfs/dbraw/zinc/18/19/89/481181989.db2.gz DVMNAYBUXZLJJY-YJBOKZPZSA-N 1 3 348.491 2.589 10 0 EFAEHO CCCC[N@@H+](C)C[C@H](C)NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659040385 481181997 /nfs/dbraw/zinc/18/19/97/481181997.db2.gz DVMNAYBUXZLJJY-YJBOKZPZSA-N 1 3 348.491 2.589 10 0 EFAEHO CCCN(C)[C@@H](CNC(=O)NC/C=C\C[NH3+])c1ccc(Cl)cc1 ZINC000669583649 481225330 /nfs/dbraw/zinc/22/53/30/481225330.db2.gz PWMMQCWDPFKESQ-AWFCHZOYSA-N 1 3 338.883 2.537 10 0 EFAEHO CCCN(C)[C@H](CNC(=O)NC/C=C\C[NH3+])c1ccc(Cl)cc1 ZINC000669583651 481225816 /nfs/dbraw/zinc/22/58/16/481225816.db2.gz PWMMQCWDPFKESQ-YIEVGGLXSA-N 1 3 338.883 2.537 10 0 EFAEHO CC(C)N1CCN(CCC[NH+]2CCC(c3cccnc3)CC2)CC1 ZINC000669691782 481268974 /nfs/dbraw/zinc/26/89/74/481268974.db2.gz IJZTUJCPFDLWTO-UHFFFAOYSA-N 1 3 330.520 2.677 10 0 EFAEHO CCOc1ccc(CN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)cc1OC ZINC000650722044 481288641 /nfs/dbraw/zinc/28/86/41/481288641.db2.gz JILDBCPKVPKGPR-SCTDSRPQSA-N 1 3 348.487 2.955 10 0 EFAEHO COc1cccc(CN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)c1OC ZINC000650722551 481288892 /nfs/dbraw/zinc/28/88/92/481288892.db2.gz WIWMQBVCORZBFP-JZXOWHBKSA-N 1 3 334.460 2.565 10 0 EFAEHO c1ccc2c(c1)CC[C@H](CCN[C@@H]1CCOC[C@H]1[C@H]1CCC[NH2+]1)N2 ZINC000650759024 481321050 /nfs/dbraw/zinc/32/10/50/481321050.db2.gz BJYKTRRLILWGTI-PIKOESSRSA-N 1 3 329.488 2.550 10 0 EFAEHO CN(CCCc1c(F)cccc1F)CC[N@H+](C)C1CCN(C)CC1 ZINC000653592997 481351608 /nfs/dbraw/zinc/35/16/08/481351608.db2.gz BEELBBPABCUUAS-UHFFFAOYSA-N 1 3 339.474 2.855 10 0 EFAEHO CN(CCCc1c(F)cccc1F)CC[N@@H+](C)C1CCN(C)CC1 ZINC000653592997 481351616 /nfs/dbraw/zinc/35/16/16/481351616.db2.gz BEELBBPABCUUAS-UHFFFAOYSA-N 1 3 339.474 2.855 10 0 EFAEHO [NH3+][C@H](CCC(=O)Nc1ccc([C@H]2CNCCO2)cc1)c1ccccc1 ZINC000659370824 481390220 /nfs/dbraw/zinc/39/02/20/481390220.db2.gz WWBZXUNQCVSTBC-RTBURBONSA-N 1 3 339.439 2.766 10 0 EFAEHO Cc1cccc2c1CCC[C@@H]2NC(=O)N(CCN(C)C)CC[NH+](C)C ZINC000667275110 481448755 /nfs/dbraw/zinc/44/87/55/481448755.db2.gz AWVDEENZFFGMMO-IBGZPJMESA-N 1 3 346.519 2.507 10 0 EFAEHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 ZINC000643479529 481485866 /nfs/dbraw/zinc/48/58/66/481485866.db2.gz NCVXVPUDFBGKOI-XIRDDKMYSA-N 1 3 343.450 2.506 10 0 EFAEHO CN(CC[NH+]1CCCCC1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000650996077 481490007 /nfs/dbraw/zinc/49/00/07/481490007.db2.gz WUAHWYYHABXEGX-OALUTQOASA-N 1 3 344.503 2.559 10 0 EFAEHO OC1(CN2CCC[C@H](C[NH+]3CCCCCC3)C2)CCSCC1 ZINC000659876430 481615003 /nfs/dbraw/zinc/61/50/03/481615003.db2.gz BAKDVFAFFCGIBD-QGZVFWFLSA-N 1 3 326.550 2.833 10 0 EFAEHO COc1ccc(OCCN(C)Cc2cccc3c2CC[NH2+]C3)cc1 ZINC000662248499 481664405 /nfs/dbraw/zinc/66/44/05/481664405.db2.gz DGUGWWZGKSFLDI-UHFFFAOYSA-N 1 3 326.440 2.852 10 0 EFAEHO CC(C)C[N@H+](C[C@H]1CCC2(CNC2)O1)[C@@H]1CCCc2cccnc21 ZINC000662281412 481689128 /nfs/dbraw/zinc/68/91/28/481689128.db2.gz WRNFHWZTOLRVGC-QZTJIDSGSA-N 1 3 329.488 2.938 10 0 EFAEHO CC(C)C[N@@H+](C[C@H]1CCC2(CNC2)O1)[C@@H]1CCCc2cccnc21 ZINC000662281412 481689133 /nfs/dbraw/zinc/68/91/33/481689133.db2.gz WRNFHWZTOLRVGC-QZTJIDSGSA-N 1 3 329.488 2.938 10 0 EFAEHO CC[C@H](NC[C@@H]1CCC2(C[NH2+]C2)O1)c1ccccc1OC(F)F ZINC000662280450 481689619 /nfs/dbraw/zinc/68/96/19/481689619.db2.gz DRSYUFIXYOGRCV-JSGCOSHPSA-N 1 3 326.387 2.850 10 0 EFAEHO c1ccc([C@@H]2C[C@H]3[C@H](CCCN3C[C@@H]3CCC4(C[NH2+]C4)O3)O2)cc1 ZINC000662283691 481690917 /nfs/dbraw/zinc/69/09/17/481690917.db2.gz JOOGQIJKCPFTLU-VJANTYMQSA-N 1 3 328.456 2.502 10 0 EFAEHO CSc1ccccc1NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000665164471 481696466 /nfs/dbraw/zinc/69/64/66/481696466.db2.gz NRLLFHDYWPLNAX-AWEZNQCLSA-N 1 3 338.521 2.802 10 0 EFAEHO CSc1ccccc1NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000665164471 481696471 /nfs/dbraw/zinc/69/64/71/481696471.db2.gz NRLLFHDYWPLNAX-AWEZNQCLSA-N 1 3 338.521 2.802 10 0 EFAEHO C[C@@H]1CCC[C@H](NC(=O)CN2CCC[C@H](C3CC[NH2+]CC3)C2)[C@H]1C ZINC000662294310 481699728 /nfs/dbraw/zinc/69/97/28/481699728.db2.gz LGRQGWIQGQTHQH-NEPXVJNWSA-N 1 3 335.536 2.639 10 0 EFAEHO Cc1ccc(NC(=O)CN2CCC[C@@H](C3CC[NH2+]CC3)C2)cc1C ZINC000662294799 481699786 /nfs/dbraw/zinc/69/97/86/481699786.db2.gz NRRIEWHHZJMDOE-GOSISDBHSA-N 1 3 329.488 2.954 10 0 EFAEHO O=C(CN1CCC[C@H](C2CC[NH2+]CC2)C1)N1CCC[C@@H]2CCCC[C@H]21 ZINC000662295846 481702455 /nfs/dbraw/zinc/70/24/55/481702455.db2.gz HZYZPQPPYXRNCB-SLFFLAALSA-N 1 3 347.547 2.879 10 0 EFAEHO CC(=O)c1ccccc1OCCN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662297479 481703019 /nfs/dbraw/zinc/70/30/19/481703019.db2.gz QLZLHLPJYTXJGQ-GOSISDBHSA-N 1 3 330.472 2.980 10 0 EFAEHO C[C@@H](C(=O)N[C@H]1CCCC[C@H]1C)N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662297185 481703565 /nfs/dbraw/zinc/70/35/65/481703565.db2.gz OGLHNVFPPBDEEW-NEPXVJNWSA-N 1 3 335.536 2.781 10 0 EFAEHO CC1CCC(N(C)C(=O)CN2CCC[C@@H](C3CC[NH2+]CC3)C2)CC1 ZINC000662295944 481703981 /nfs/dbraw/zinc/70/39/81/481703981.db2.gz JEDLXCHWUPGXFF-CUYAVPTFSA-N 1 3 335.536 2.735 10 0 EFAEHO CN(CC1CCCCC1)C(=O)CN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662297520 481705085 /nfs/dbraw/zinc/70/50/85/481705085.db2.gz RAOHEBRMBXWOPQ-LJQANCHMSA-N 1 3 335.536 2.737 10 0 EFAEHO COc1ccc([C@H](NC[C@@H]2CCC3(C[NH2+]C3)O2)c2ccccc2)cc1 ZINC000662299627 481706283 /nfs/dbraw/zinc/70/62/83/481706283.db2.gz SPVBKNQCIHQQOP-VQTJNVASSA-N 1 3 338.451 2.895 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccc2c(c1)CCC2 ZINC000665193042 481712406 /nfs/dbraw/zinc/71/24/06/481712406.db2.gz LKOFHOMEARYMMJ-HNNXBMFYSA-N 1 3 332.492 2.569 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccc2c(c1)CCC2 ZINC000665193042 481712410 /nfs/dbraw/zinc/71/24/10/481712410.db2.gz LKOFHOMEARYMMJ-HNNXBMFYSA-N 1 3 332.492 2.569 10 0 EFAEHO C[C@@H](NC(=O)CN1CCC[C@@H](C)[C@H]1CCC[NH3+])c1ccc(F)cc1 ZINC000662313202 481717816 /nfs/dbraw/zinc/71/78/16/481717816.db2.gz GHMHJESZWNQMDN-IIDMSEBBSA-N 1 3 335.467 2.842 10 0 EFAEHO C[N@@H+]1C[C@@H](CNCc2ccc(-n3cncn3)cc2)[C@H](c2ccccc2)C1 ZINC000647248590 481727780 /nfs/dbraw/zinc/72/77/80/481727780.db2.gz KLCIRKGNZPJPFJ-CTNGQTDRSA-N 1 3 347.466 2.702 10 0 EFAEHO C[N@H+]1C[C@@H](CNCc2ccc(-n3cncn3)cc2)[C@H](c2ccccc2)C1 ZINC000647248590 481727785 /nfs/dbraw/zinc/72/77/85/481727785.db2.gz KLCIRKGNZPJPFJ-CTNGQTDRSA-N 1 3 347.466 2.702 10 0 EFAEHO CN(C)CCNC(=O)C1CC[NH+](Cc2cccc(C(C)(C)C)c2)CC1 ZINC000660057495 481731124 /nfs/dbraw/zinc/73/11/24/481731124.db2.gz XORJJEAJQOONIE-UHFFFAOYSA-N 1 3 345.531 2.874 10 0 EFAEHO CC(C)(C)CCC[N@@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662336249 481735507 /nfs/dbraw/zinc/73/55/07/481735507.db2.gz BXYFKGQWXUXMNI-INIZCTEOSA-N 1 3 333.524 2.825 10 0 EFAEHO CC(C)(C)CCC[N@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662336249 481735512 /nfs/dbraw/zinc/73/55/12/481735512.db2.gz BXYFKGQWXUXMNI-INIZCTEOSA-N 1 3 333.524 2.825 10 0 EFAEHO CCOc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@@H]2C[C@@H](C)N(C3CC3)C2)cc1 ZINC000665254908 481748811 /nfs/dbraw/zinc/74/88/11/481748811.db2.gz CAGQZCTWUKZHNN-SLWXAUBPSA-N 1 3 343.515 2.746 10 0 EFAEHO CCOc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@@H]2CN(C3CC3)C[C@H]2C)cc1 ZINC000665255196 481751602 /nfs/dbraw/zinc/75/16/02/481751602.db2.gz LHVBUGYUTKDJPQ-PSOYPTMXSA-N 1 3 343.515 2.603 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](N[C@H]2CCc3cc(N)ccc32)[C@@H](C)C1 ZINC000665269263 481760841 /nfs/dbraw/zinc/76/08/41/481760841.db2.gz CKOHZBXHNYXLTO-YSSFQJQWSA-N 1 3 331.504 2.983 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](N[C@H]2CCc3cc(N)ccc32)[C@@H](C)C1 ZINC000665269263 481760847 /nfs/dbraw/zinc/76/08/47/481760847.db2.gz CKOHZBXHNYXLTO-YSSFQJQWSA-N 1 3 331.504 2.983 10 0 EFAEHO CN1C[C@@H](C[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@@H]32)[C@H](c2ccccc2)C1 ZINC000647344253 481772603 /nfs/dbraw/zinc/77/26/03/481772603.db2.gz MPQZKBJCDYFTHP-YMQHIKHWSA-N 1 3 327.516 2.794 10 0 EFAEHO CC[C@@H](CC(F)F)CN1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000660127420 481774232 /nfs/dbraw/zinc/77/42/32/481774232.db2.gz NCQRLUVOXDNJJP-PMRDEQMMSA-N 1 3 329.479 2.911 10 0 EFAEHO CC[C@@H](CC(F)F)CN1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000660127420 481774240 /nfs/dbraw/zinc/77/42/40/481774240.db2.gz NCQRLUVOXDNJJP-PMRDEQMMSA-N 1 3 329.479 2.911 10 0 EFAEHO CC[C@H](CC(F)F)CN1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000660127421 481774857 /nfs/dbraw/zinc/77/48/57/481774857.db2.gz NCQRLUVOXDNJJP-VPSFDDGASA-N 1 3 329.479 2.911 10 0 EFAEHO CC[C@H](CC(F)F)CN1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000660127421 481774865 /nfs/dbraw/zinc/77/48/65/481774865.db2.gz NCQRLUVOXDNJJP-VPSFDDGASA-N 1 3 329.479 2.911 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)C1(NC2CC2)CCC1)c1ccccc1 ZINC000662392102 481780560 /nfs/dbraw/zinc/78/05/60/481780560.db2.gz NNRQGKVVRKRZNP-GOSISDBHSA-N 1 3 329.488 2.860 10 0 EFAEHO C[NH+](C)CCOc1ccc(NC(=O)C[C@@H]2NCc3ccccc32)cc1 ZINC000662399409 481784733 /nfs/dbraw/zinc/78/47/33/481784733.db2.gz STEQOXOOSQEDRJ-IBGZPJMESA-N 1 3 339.439 2.800 10 0 EFAEHO C[C@H](CNC(=O)c1ccc2c(c1)[C@@H](C[NH3+])CCC2)N1CCC(C)CC1 ZINC000662417115 481795021 /nfs/dbraw/zinc/79/50/21/481795021.db2.gz HXHWJOLZDKFDAK-VQIMIIECSA-N 1 3 343.515 2.915 10 0 EFAEHO c1ccc(N2CCN(CCCC[NH2+][C@H]3CO[C@H](C4CC4)C3)CC2)cc1 ZINC000667793019 481807800 /nfs/dbraw/zinc/80/78/00/481807800.db2.gz PEEGBZXGLTUDTA-CTNGQTDRSA-N 1 3 343.515 2.746 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000665363777 481822736 /nfs/dbraw/zinc/82/27/36/481822736.db2.gz BXJXWXDVHHDNBG-QGZVFWFLSA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CCC[N@H+](C2CCCC2)CC1 ZINC000665363777 481822740 /nfs/dbraw/zinc/82/27/40/481822740.db2.gz BXJXWXDVHHDNBG-QGZVFWFLSA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000665365821 481823015 /nfs/dbraw/zinc/82/30/15/481823015.db2.gz LSEDPWGBKGKZHI-SJORKVTESA-N 1 3 336.524 2.519 10 0 EFAEHO C[N@H+](CCNC(=O)N[C@@H]1CCCN2CCCC[C@H]12)C1CCCCC1 ZINC000654414882 481859956 /nfs/dbraw/zinc/85/99/56/481859956.db2.gz ZFHQMWSUVIFLAJ-QZTJIDSGSA-N 1 3 336.524 2.567 10 0 EFAEHO C[N@@H+](CCNC(=O)N[C@@H]1CCCN2CCCC[C@H]12)C1CCCCC1 ZINC000654414882 481859961 /nfs/dbraw/zinc/85/99/61/481859961.db2.gz ZFHQMWSUVIFLAJ-QZTJIDSGSA-N 1 3 336.524 2.567 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)N[C@@H]1CCCC12CCCCC2 ZINC000665454010 481878006 /nfs/dbraw/zinc/87/80/06/481878006.db2.gz ZOJWSWDOXGIHRY-QGZVFWFLSA-N 1 3 338.540 2.624 10 0 EFAEHO Cc1cccc(O[C@@H]2CCCC[C@H]2[NH2+]C[C@@H](O)CN(C)C(C)C)c1 ZINC000660321340 481894861 /nfs/dbraw/zinc/89/48/61/481894861.db2.gz OFDQDKMCCLMFAM-MISYRCLQSA-N 1 3 334.504 2.976 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)C2([NH2+]C3CC3)CCC2)N(C)C)cc1 ZINC000662663140 481921837 /nfs/dbraw/zinc/92/18/37/481921837.db2.gz LRFWGNJLIPANBQ-SFHVURJKSA-N 1 3 329.488 2.643 10 0 EFAEHO Cc1ccccc1C[NH+]1CCC(NC(=O)C2(NC3CC3)CCC2)CC1 ZINC000662672847 481925994 /nfs/dbraw/zinc/92/59/94/481925994.db2.gz FMKNZUNKWLKRGF-UHFFFAOYSA-N 1 3 341.499 2.750 10 0 EFAEHO C[C@@H](C(=O)Nc1ccc([C@H]2C[NH2+]CCO2)cc1)N1CCCCCC1 ZINC000662687184 481932882 /nfs/dbraw/zinc/93/28/82/481932882.db2.gz VLNCXGYYRGBSQI-MAUKXSAKSA-N 1 3 331.460 2.551 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](CCCNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000660396864 481935233 /nfs/dbraw/zinc/93/52/33/481935233.db2.gz PFFCQRAODSVJBD-IXDOHACOSA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000660396864 481935238 /nfs/dbraw/zinc/93/52/38/481935238.db2.gz PFFCQRAODSVJBD-IXDOHACOSA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)C[C@@H](N)C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662712964 481945668 /nfs/dbraw/zinc/94/56/68/481945668.db2.gz WIETWDFHXNJZLW-RBUKOAKNSA-N 1 3 343.515 2.778 10 0 EFAEHO CC(C)C[C@@H](N)C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662712964 481945671 /nfs/dbraw/zinc/94/56/71/481945671.db2.gz WIETWDFHXNJZLW-RBUKOAKNSA-N 1 3 343.515 2.778 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)C2(NC3CC3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000662717968 481946667 /nfs/dbraw/zinc/94/66/67/481946667.db2.gz FYPFFYIYWDWVPZ-APWZRJJASA-N 1 3 341.499 2.830 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)C2(NC3CC3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000662717968 481946671 /nfs/dbraw/zinc/94/66/71/481946671.db2.gz FYPFFYIYWDWVPZ-APWZRJJASA-N 1 3 341.499 2.830 10 0 EFAEHO C[NH+](C)CCCOc1ccc(NC(=O)C2(NC3CC3)CCC2)cc1 ZINC000662726401 481949344 /nfs/dbraw/zinc/94/93/44/481949344.db2.gz OAZRLGUEOZGJML-UHFFFAOYSA-N 1 3 331.460 2.630 10 0 EFAEHO Cc1nc2cc(NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)ccc2o1 ZINC000665637864 481975107 /nfs/dbraw/zinc/97/51/07/481975107.db2.gz RJDZLNNAIWTWJM-ZDUSSCGKSA-N 1 3 347.463 2.530 10 0 EFAEHO Cc1nc2cc(NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)ccc2o1 ZINC000665637864 481975111 /nfs/dbraw/zinc/97/51/11/481975111.db2.gz RJDZLNNAIWTWJM-ZDUSSCGKSA-N 1 3 347.463 2.530 10 0 EFAEHO CC[C@@H](C)[C@H](N)C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662918520 482011368 /nfs/dbraw/zinc/01/13/68/482011368.db2.gz DTZMFUHXANWWBN-NEWSRXKRSA-N 1 3 343.515 2.778 10 0 EFAEHO CC[C@@H](C)[C@H](N)C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662918520 482011374 /nfs/dbraw/zinc/01/13/74/482011374.db2.gz DTZMFUHXANWWBN-NEWSRXKRSA-N 1 3 343.515 2.778 10 0 EFAEHO CCN(C(=O)[C@@H]1[NH2+]CC1(C)C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000649306012 482021576 /nfs/dbraw/zinc/02/15/76/482021576.db2.gz UBYRZFROXVSJLS-JQHSSLGASA-N 1 3 329.488 2.668 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1[C@H](C)C[C@H]2CCCC[C@@H]21 ZINC000665760015 482038363 /nfs/dbraw/zinc/03/83/63/482038363.db2.gz WMSUATLHEZUIHZ-MLHJIOFPSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1[C@H](C)C[C@H]2CCCC[C@@H]21 ZINC000665760015 482038367 /nfs/dbraw/zinc/03/83/67/482038367.db2.gz WMSUATLHEZUIHZ-MLHJIOFPSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1[C@H](C)C[C@@H]2CCCC[C@@H]21 ZINC000665760014 482039096 /nfs/dbraw/zinc/03/90/96/482039096.db2.gz WMSUATLHEZUIHZ-MHORFTMASA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1[C@H](C)C[C@@H]2CCCC[C@@H]21 ZINC000665760014 482039098 /nfs/dbraw/zinc/03/90/98/482039098.db2.gz WMSUATLHEZUIHZ-MHORFTMASA-N 1 3 338.540 2.621 10 0 EFAEHO CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NCCC1(C[NH3+])CC1 ZINC000652179084 482115599 /nfs/dbraw/zinc/11/55/99/482115599.db2.gz DSIPPLFJYHTPRY-SFHVURJKSA-N 1 3 346.519 2.571 10 0 EFAEHO O[C@H]1CCN(Cc2ccc(C[NH2+]CC3Cc4ccccc4C3)cc2)C1 ZINC000668489827 482142327 /nfs/dbraw/zinc/14/23/27/482142327.db2.gz NLEYVPIBOBEURD-QFIPXVFZSA-N 1 3 336.479 2.758 10 0 EFAEHO CN(c1ccccc1C[N@@H+]1C[C@H]2COC[C@]2(C)C1)C1CCN(C)CC1 ZINC000668596074 482183075 /nfs/dbraw/zinc/18/30/75/482183075.db2.gz CUNLHBCSRTVGOG-RXVVDRJESA-N 1 3 343.515 2.685 10 0 EFAEHO CN(c1ccccc1C[N@H+]1C[C@H]2COC[C@]2(C)C1)C1CCN(C)CC1 ZINC000668596074 482183078 /nfs/dbraw/zinc/18/30/78/482183078.db2.gz CUNLHBCSRTVGOG-RXVVDRJESA-N 1 3 343.515 2.685 10 0 EFAEHO CN(C(=O)[C@H](C[NH+]1CCCC1)c1ccccc1)[C@H]1CCN(C2CC2)C1 ZINC000668599668 482183568 /nfs/dbraw/zinc/18/35/68/482183568.db2.gz XMTSJTRSSLBDTJ-VQTJNVASSA-N 1 3 341.499 2.561 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)NC[C@H]1CCN1C(C)(C)C)C(C)C ZINC000660864132 482185747 /nfs/dbraw/zinc/18/57/47/482185747.db2.gz NZVBRTZMIQZBPD-MRXNPFEDSA-N 1 3 326.529 2.667 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@@H](C)CC(F)F)CC2)CC1 ZINC000655157128 482186076 /nfs/dbraw/zinc/18/60/76/482186076.db2.gz WMXDBCCCHPUBHQ-AWEZNQCLSA-N 1 3 345.478 2.590 10 0 EFAEHO CCN(C(=O)NC[C@H](c1ccccc1)[NH+](CC)CC)[C@H]1CCN(C)C1 ZINC000663450415 482244104 /nfs/dbraw/zinc/24/41/04/482244104.db2.gz IUHSDTSANZIADY-RBUKOAKNSA-N 1 3 346.519 2.805 10 0 EFAEHO CN1CC[C@H](NC(=O)N[C@@H]2CC[N@@H+](C(C)(C)C)C2)[C@H]1c1ccccc1 ZINC000660960985 482245221 /nfs/dbraw/zinc/24/52/21/482245221.db2.gz YBZCNVUTOBBSHB-FGTMMUONSA-N 1 3 344.503 2.604 10 0 EFAEHO CN1CC[C@H](NC(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)[C@H]1c1ccccc1 ZINC000660960985 482245227 /nfs/dbraw/zinc/24/52/27/482245227.db2.gz YBZCNVUTOBBSHB-FGTMMUONSA-N 1 3 344.503 2.604 10 0 EFAEHO C[C@@H]1CCC[C@H](C[N@@H+]2CCC[C@@H](c3cc(N4CCNCC4)n[nH]3)C2)C1 ZINC000663513652 482273754 /nfs/dbraw/zinc/27/37/54/482273754.db2.gz TUXULSRFYZDDRR-FGTMMUONSA-N 1 3 345.535 2.825 10 0 EFAEHO C[C@@H]1CCC[C@H](C[N@H+]2CCC[C@@H](c3cc(N4CCNCC4)n[nH]3)C2)C1 ZINC000663513652 482273756 /nfs/dbraw/zinc/27/37/56/482273756.db2.gz TUXULSRFYZDDRR-FGTMMUONSA-N 1 3 345.535 2.825 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N[C@@H](c1ccccc1)C1CC1 ZINC000663535918 482287115 /nfs/dbraw/zinc/28/71/15/482287115.db2.gz CSUROULHZSBXIP-LPHOPBHVSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N[C@@H](c1ccccc1)C1CC1 ZINC000663535918 482287120 /nfs/dbraw/zinc/28/71/20/482287120.db2.gz CSUROULHZSBXIP-LPHOPBHVSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@@H]([NH3+])[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000668860279 482299001 /nfs/dbraw/zinc/29/90/01/482299001.db2.gz HOZVKNOMXSCFNY-SJLPKXTDSA-N 1 3 344.503 2.551 10 0 EFAEHO C[NH2+]Cc1ccccc1CNC(=O)Nc1ccccc1CCN(C)C ZINC000652598016 482309701 /nfs/dbraw/zinc/30/97/01/482309701.db2.gz SIFSIIYOXYHIQI-UHFFFAOYSA-N 1 3 340.471 2.832 10 0 EFAEHO CCN(C(=O)NCCC[N@H+](C)C1CCCCC1)[C@@H]1CCN(CC)C1 ZINC000663631833 482326793 /nfs/dbraw/zinc/32/67/93/482326793.db2.gz BTGYLMJCKKIFQY-GOSISDBHSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN(C(=O)NCCC[N@@H+](C)C1CCCCC1)[C@@H]1CCN(CC)C1 ZINC000663631833 482326797 /nfs/dbraw/zinc/32/67/97/482326797.db2.gz BTGYLMJCKKIFQY-GOSISDBHSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[N@@H+]1CCC[C@H](C)C1)[C@H]1CCN(CC)C1 ZINC000663787017 482389355 /nfs/dbraw/zinc/38/93/55/482389355.db2.gz FIYLRMWPEUBEKL-IRXDYDNUSA-N 1 3 338.540 2.623 10 0 EFAEHO CCN(C(=O)NCC(C)(C)[N@H+]1CCC[C@H](C)C1)[C@H]1CCN(CC)C1 ZINC000663787017 482389358 /nfs/dbraw/zinc/38/93/58/482389358.db2.gz FIYLRMWPEUBEKL-IRXDYDNUSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[C@H](NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccccc1 ZINC000663856299 482408584 /nfs/dbraw/zinc/40/85/84/482408584.db2.gz QGIIRAHXYILQBJ-WMZOPIPTSA-N 1 3 334.508 2.709 10 0 EFAEHO CC[C@H](NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccccc1 ZINC000663856299 482408589 /nfs/dbraw/zinc/40/85/89/482408589.db2.gz QGIIRAHXYILQBJ-WMZOPIPTSA-N 1 3 334.508 2.709 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NC1(c2ccccc2)CCC1 ZINC000663929232 482424029 /nfs/dbraw/zinc/42/40/29/482424029.db2.gz SPTSFVLXWHLBOX-KRWDZBQOSA-N 1 3 346.519 2.637 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NC1(c2ccccc2)CCC1 ZINC000663929232 482424031 /nfs/dbraw/zinc/42/40/31/482424031.db2.gz SPTSFVLXWHLBOX-KRWDZBQOSA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)[NH2+]C1CCN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CC1 ZINC000179474869 519718862 /nfs/dbraw/zinc/71/88/62/519718862.db2.gz ZCQHCDBVCOUQIA-RTBURBONSA-N 1 3 344.503 2.604 10 0 EFAEHO CC(C)COC[C@@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180113423 519756802 /nfs/dbraw/zinc/75/68/02/519756802.db2.gz OYMZLAGZXWFHON-VTHDOGFWSA-N 1 3 346.515 2.805 10 0 EFAEHO CC(C)COC[C@@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180113423 519756803 /nfs/dbraw/zinc/75/68/03/519756803.db2.gz OYMZLAGZXWFHON-VTHDOGFWSA-N 1 3 346.515 2.805 10 0 EFAEHO CCCN1CCC(C[NH2+][C@@H](C)CS(=O)(=O)c2ccccc2)CC1 ZINC000120068401 519843095 /nfs/dbraw/zinc/84/30/95/519843095.db2.gz VPPJGXCBSRSNHR-INIZCTEOSA-N 1 3 338.517 2.560 10 0 EFAEHO CC1CC[NH+](C2CCC(NC(=O)N3CCN4CCC[C@H]4C3)CC2)CC1 ZINC000179179965 520992352 /nfs/dbraw/zinc/99/23/52/520992352.db2.gz SDTKWWGCTLPWQG-ACBHZAAOSA-N 1 3 348.535 2.519 10 0 EFAEHO CCC(=O)N1CC[C@H](N[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000245781329 521153043 /nfs/dbraw/zinc/15/30/43/521153043.db2.gz YWUIVIFAAYUIOL-HAGHYFMRSA-N 1 3 341.499 2.783 10 0 EFAEHO CCC(=O)N1CC[C@H](N[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000245781329 521153046 /nfs/dbraw/zinc/15/30/46/521153046.db2.gz YWUIVIFAAYUIOL-HAGHYFMRSA-N 1 3 341.499 2.783 10 0 EFAEHO CCN1CCC[C@@H]1CN(C)C(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000245426094 521628744 /nfs/dbraw/zinc/62/87/44/521628744.db2.gz UNBLXUMLOWWCEW-QZTJIDSGSA-N 1 3 338.540 2.624 10 0 EFAEHO CCN1CCC[C@@H]1CN(C)C(=O)NCCCC[N@H+]1CCC[C@@H](C)C1 ZINC000245426094 521628749 /nfs/dbraw/zinc/62/87/49/521628749.db2.gz UNBLXUMLOWWCEW-QZTJIDSGSA-N 1 3 338.540 2.624 10 0 EFAEHO CCN1CCC[C@H]1CN(C)C(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000245426092 521651453 /nfs/dbraw/zinc/65/14/53/521651453.db2.gz UNBLXUMLOWWCEW-MSOLQXFVSA-N 1 3 338.540 2.624 10 0 EFAEHO CCN1CCC[C@H]1CN(C)C(=O)NCCCC[N@H+]1CCC[C@@H](C)C1 ZINC000245426092 521651457 /nfs/dbraw/zinc/65/14/57/521651457.db2.gz UNBLXUMLOWWCEW-MSOLQXFVSA-N 1 3 338.540 2.624 10 0 EFAEHO CN(Cc1ccccc1N(C)C1CC[NH+](C)CC1)C[C@H]1CCCO1 ZINC000245502234 523373724 /nfs/dbraw/zinc/37/37/24/523373724.db2.gz FITBLVXATJOUQA-LJQANCHMSA-N 1 3 331.504 2.828 10 0 EFAEHO CN1CCC(C[NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)(N2CCCCC2)CC1 ZINC000181827255 523765621 /nfs/dbraw/zinc/76/56/21/523765621.db2.gz FXIYPHQLOSHPEJ-QRVBRYPASA-N 1 3 349.563 2.730 10 0 EFAEHO CN1C[C@@H]2C[N@@H+](Cc3c(-c4ccccc4)nc4ccccn43)C[C@@H]2C1 ZINC000193655774 524015942 /nfs/dbraw/zinc/01/59/42/524015942.db2.gz VJZDAUIQQCWOLB-HDICACEKSA-N 1 3 332.451 2.995 10 0 EFAEHO CN1C[C@@H]2C[N@H+](Cc3c(-c4ccccc4)nc4ccccn43)C[C@@H]2C1 ZINC000193655774 524015946 /nfs/dbraw/zinc/01/59/46/524015946.db2.gz VJZDAUIQQCWOLB-HDICACEKSA-N 1 3 332.451 2.995 10 0 EFAEHO C[C@H](NC(=O)N1CCCN(C2CC2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182877888 525019946 /nfs/dbraw/zinc/01/99/46/525019946.db2.gz AWKBPBMKDNLKBN-IRXDYDNUSA-N 1 3 348.535 2.519 10 0 EFAEHO C[C@H](NC(=O)N1CCCN(C2CC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182877888 525019954 /nfs/dbraw/zinc/01/99/54/525019954.db2.gz AWKBPBMKDNLKBN-IRXDYDNUSA-N 1 3 348.535 2.519 10 0 EFAEHO Cc1ccc(NC(=O)C2CC[NH+](CCCN3CCCC3)CC2)nc1 ZINC000193477586 525027691 /nfs/dbraw/zinc/02/76/91/525027691.db2.gz HIPZJOWOSOQMHX-UHFFFAOYSA-N 1 3 330.476 2.526 10 0 EFAEHO C[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1oc2ccccc2c1CN(C)C ZINC000245454384 525089358 /nfs/dbraw/zinc/08/93/58/525089358.db2.gz HEVCCZDIFUYLNP-CABCVRRESA-N 1 3 341.455 2.803 10 0 EFAEHO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1oc2ccccc2c1CN(C)C ZINC000245454384 525089369 /nfs/dbraw/zinc/08/93/69/525089369.db2.gz HEVCCZDIFUYLNP-CABCVRRESA-N 1 3 341.455 2.803 10 0 EFAEHO C[C@H](O)C[NH+]1CCC(CN(C)Cc2cnc(C(C)(C)C)s2)CC1 ZINC000179517273 525749077 /nfs/dbraw/zinc/74/90/77/525749077.db2.gz VGXNQGLTHHTSNQ-AWEZNQCLSA-N 1 3 339.549 2.965 10 0 EFAEHO Cc1ccc(-c2noc(CCC[N@@H+]3C[C@H]4CN(C)C[C@H]4C3)n2)cc1F ZINC000193611035 525875987 /nfs/dbraw/zinc/87/59/87/525875987.db2.gz UUPSUYOYVMATEH-IYBDPMFKSA-N 1 3 344.434 2.610 10 0 EFAEHO Cc1ccc(-c2noc(CCC[N@H+]3C[C@H]4CN(C)C[C@H]4C3)n2)cc1F ZINC000193611035 525875995 /nfs/dbraw/zinc/87/59/95/525875995.db2.gz UUPSUYOYVMATEH-IYBDPMFKSA-N 1 3 344.434 2.610 10 0 EFAEHO C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NC[C@@H]2CCCN2C)CC1 ZINC000116537812 526097070 /nfs/dbraw/zinc/09/70/70/526097070.db2.gz MISVDZGFWBPQPP-APWZRJJASA-N 1 3 344.503 2.605 10 0 EFAEHO c1cn(-c2ccc(CN3CCC(C[NH+]4CCCC4)CC3)cn2)cn1 ZINC000177115950 526524256 /nfs/dbraw/zinc/52/42/56/526524256.db2.gz YPENFKUZUDDITL-UHFFFAOYSA-N 1 3 325.460 2.575 10 0 EFAEHO C[NH2+]Cc1ccccc1NC(=O)NCc1ccc(CN(C)C)cc1 ZINC000415896693 536470298 /nfs/dbraw/zinc/47/02/98/536470298.db2.gz DVOVRLJBDKLDDF-UHFFFAOYSA-N 1 3 326.444 2.789 10 0 EFAEHO CCC[C@H](C(=O)NC1CC[NH+](CCc2ccccc2)CC1)N(C)C ZINC000179496487 527978162 /nfs/dbraw/zinc/97/81/62/527978162.db2.gz KNAYJJNZIRZTKA-LJQANCHMSA-N 1 3 331.504 2.540 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2CCC[C@H](CO)C2)CC1 ZINC000414565018 534937475 /nfs/dbraw/zinc/93/74/75/534937475.db2.gz DQKXYSGKHVSJOX-AZUAARDMSA-N 1 3 345.531 2.859 10 0 EFAEHO CC(C)NC(=O)[C@H](C)[NH2+]C1CCN([C@H](C)Cc2ccccc2)CC1 ZINC000414344877 535286098 /nfs/dbraw/zinc/28/60/98/535286098.db2.gz OJPPQUKILAVKTN-SJORKVTESA-N 1 3 331.504 2.585 10 0 EFAEHO CC(C)NC(=O)[C@H](C)[NH2+]C1CCN([C@@H](C)Cc2ccccc2)CC1 ZINC000414344874 535286424 /nfs/dbraw/zinc/28/64/24/535286424.db2.gz OJPPQUKILAVKTN-IRXDYDNUSA-N 1 3 331.504 2.585 10 0 EFAEHO CCN(CCOC)c1cccc(CN2CCC(CC[NH+](C)C)CC2)n1 ZINC000351477579 535751291 /nfs/dbraw/zinc/75/12/91/535751291.db2.gz NTVIYACPMLAMPZ-UHFFFAOYSA-N 1 3 348.535 2.718 10 0 EFAEHO CN(C)Cc1cccc(CNC(=O)NCC2([NH3+])CCCCCC2)c1 ZINC000417068766 536032219 /nfs/dbraw/zinc/03/22/19/536032219.db2.gz ODKCYIVKWYJREE-UHFFFAOYSA-N 1 3 332.492 2.599 10 0 EFAEHO COC[C@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)C1CCCC1 ZINC000414302981 536873788 /nfs/dbraw/zinc/87/37/88/536873788.db2.gz LCWSIETZDQSSSL-FQEVSTJZSA-N 1 3 346.515 2.808 10 0 EFAEHO [NH3+][C@@H]1CCC[C@H]1CC(=O)NCc1ccccc1CN1CCCCC1 ZINC000261882403 545621836 /nfs/dbraw/zinc/62/18/36/545621836.db2.gz ZGXWZGPFDAMCRT-QFBILLFUSA-N 1 3 329.488 2.806 10 0 EFAEHO COc1cccc(N2CC[C@H](CN[C@@H]3CC[N@@H+]4CCC[C@H]4C3)C2)c1 ZINC000339069080 545922582 /nfs/dbraw/zinc/92/25/82/545922582.db2.gz QROORKGZJYOVNS-KURKYZTESA-N 1 3 329.488 2.738 10 0 EFAEHO COc1cccc(N2CC[C@H](CN[C@@H]3CC[N@H+]4CCC[C@H]4C3)C2)c1 ZINC000339069080 545922585 /nfs/dbraw/zinc/92/25/85/545922585.db2.gz QROORKGZJYOVNS-KURKYZTESA-N 1 3 329.488 2.738 10 0 EFAEHO COc1cccc(N2CC[C@H](C[NH2+][C@@H]3CCN4CCC[C@H]4C3)C2)c1 ZINC000339069080 545922586 /nfs/dbraw/zinc/92/25/86/545922586.db2.gz QROORKGZJYOVNS-KURKYZTESA-N 1 3 329.488 2.738 10 0 EFAEHO OCC[C@@H]1CCCCCN1CCC[N@@H+]1CCCCC[C@H]1CCO ZINC000342039957 545945122 /nfs/dbraw/zinc/94/51/22/545945122.db2.gz AHEWWEHOOOXPLU-OALUTQOASA-N 1 3 326.525 2.631 10 0 EFAEHO OCC[C@@H]1CCCCCN1CCC[N@H+]1CCCCC[C@H]1CCO ZINC000342039957 545945124 /nfs/dbraw/zinc/94/51/24/545945124.db2.gz AHEWWEHOOOXPLU-OALUTQOASA-N 1 3 326.525 2.631 10 0 EFAEHO CC[C@H]1C[C@@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCO1 ZINC000397562089 546170480 /nfs/dbraw/zinc/17/04/80/546170480.db2.gz SJGDBPLMUXIKQE-OALUTQOASA-N 1 3 332.488 2.561 10 0 EFAEHO CO[C@H]1CCC[C@@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)C1 ZINC000397533435 546170595 /nfs/dbraw/zinc/17/05/95/546170595.db2.gz GDDHDASPFJZYIL-MOPGFXCFSA-N 1 3 332.488 2.561 10 0 EFAEHO CO[C@@H]1CCC[C@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)C1 ZINC000397533440 546170618 /nfs/dbraw/zinc/17/06/18/546170618.db2.gz GDDHDASPFJZYIL-RBUKOAKNSA-N 1 3 332.488 2.561 10 0 EFAEHO CC(C)[C@H]1CC[C@@H]1[NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1 ZINC000414347418 546189558 /nfs/dbraw/zinc/18/95/58/546189558.db2.gz WGZZMZYOBHYWHP-UXHICEINSA-N 1 3 343.515 2.908 10 0 EFAEHO C[C@@H](C[NH2+]C1CCN(C2CCCCC2)CC1)N1C[C@@H](C)O[C@@H](C)C1 ZINC000655802576 546590667 /nfs/dbraw/zinc/59/06/67/546590667.db2.gz MFXAWAKQBHIIRS-OKZBNKHCSA-N 1 3 337.552 2.871 10 0 EFAEHO [NH3+]CCCN(c1ccccc1F)C1CCN(C[C@@H]2CCCO2)CC1 ZINC000656254584 546747968 /nfs/dbraw/zinc/74/79/68/546747968.db2.gz CEQSRRRDJFGJBK-KRWDZBQOSA-N 1 3 335.467 2.624 10 0 EFAEHO c1c(CNC2CCCC2)nnn1C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000656467461 546810065 /nfs/dbraw/zinc/81/00/65/546810065.db2.gz CRYHBJFDMPCOBX-SFHVURJKSA-N 1 3 339.487 2.832 10 0 EFAEHO c1c(CNC2CCCC2)nnn1C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000656467461 546810067 /nfs/dbraw/zinc/81/00/67/546810067.db2.gz CRYHBJFDMPCOBX-SFHVURJKSA-N 1 3 339.487 2.832 10 0 EFAEHO c1cc(OCC[NH+]2CCCC2)ccc1CN1CC2(C1)CCOCC2 ZINC000656691605 546889580 /nfs/dbraw/zinc/88/95/80/546889580.db2.gz LLGKCPGMTZTWAN-UHFFFAOYSA-N 1 3 330.472 2.774 10 0 EFAEHO COc1cc(CN2CCC[C@@H](C3CC[NH2+]CC3)C2)cc2c1OCCO2 ZINC000656786511 546923817 /nfs/dbraw/zinc/92/38/17/546923817.db2.gz TZGZNPPRSNNDKO-QGZVFWFLSA-N 1 3 346.471 2.678 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000656786100 546924028 /nfs/dbraw/zinc/92/40/28/546924028.db2.gz KMLCQWFOGJFHFK-SFHVURJKSA-N 1 3 339.487 2.787 10 0 EFAEHO CCCN1CCN(c2ccccc2CNCC2([NH3+])CCCC2)CC1 ZINC000656789481 546925880 /nfs/dbraw/zinc/92/58/80/546925880.db2.gz OOLRJVRGJOPZHY-UHFFFAOYSA-N 1 3 330.520 2.580 10 0 EFAEHO c1cc(CNCCC[N@@H+]2CCc3ccccc3C2)n(-c2ccncc2)n1 ZINC000657297040 547092961 /nfs/dbraw/zinc/09/29/61/547092961.db2.gz HEJQMGDPPOIMJF-UHFFFAOYSA-N 1 3 347.466 2.805 10 0 EFAEHO c1cc(CNCCC[N@H+]2CCc3ccccc3C2)n(-c2ccncc2)n1 ZINC000657297040 547092965 /nfs/dbraw/zinc/09/29/65/547092965.db2.gz HEJQMGDPPOIMJF-UHFFFAOYSA-N 1 3 347.466 2.805 10 0 EFAEHO c1cc(C[NH2+]CCCN2CCc3ccccc3C2)n(-c2ccncc2)n1 ZINC000657297040 547092970 /nfs/dbraw/zinc/09/29/70/547092970.db2.gz HEJQMGDPPOIMJF-UHFFFAOYSA-N 1 3 347.466 2.805 10 0 EFAEHO CCN1CCN(CCCC[NH2+]Cc2cc3ccc(C)cc3[nH]2)CC1 ZINC000657308241 547101464 /nfs/dbraw/zinc/10/14/64/547101464.db2.gz PIKDEPNXTNBLLG-UHFFFAOYSA-N 1 3 328.504 2.984 10 0 EFAEHO C[C@H]1CCC[N@H+](CCCCNCc2ccnn2-c2ccncc2)C1 ZINC000657311913 547103292 /nfs/dbraw/zinc/10/32/92/547103292.db2.gz ZCPQRJQBWKHGDS-KRWDZBQOSA-N 1 3 327.476 2.869 10 0 EFAEHO C[C@H]1CCC[N@@H+](CCCCNCc2ccnn2-c2ccncc2)C1 ZINC000657311913 547103297 /nfs/dbraw/zinc/10/32/97/547103297.db2.gz ZCPQRJQBWKHGDS-KRWDZBQOSA-N 1 3 327.476 2.869 10 0 EFAEHO CC[C@@H]1C[C@@H]([NH2+]CCCCN2CCN(Cc3ccccc3)CC2)CO1 ZINC000657314896 547105960 /nfs/dbraw/zinc/10/59/60/547105960.db2.gz GBSAHDTVVIMYSH-NHCUHLMSSA-N 1 3 345.531 2.742 10 0 EFAEHO CC[C@H]1C[C@@H]([NH2+]CCCCN2CCN(c3ccccc3)CC2)CO1 ZINC000657315162 547106804 /nfs/dbraw/zinc/10/68/04/547106804.db2.gz NCTANZQEIVVLCP-QUCCMNQESA-N 1 3 331.504 2.746 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+]Cc2c(C3CCC3)cnn2C)C[C@@H](C)O1 ZINC000657366312 547133576 /nfs/dbraw/zinc/13/35/76/547133576.db2.gz FNTVPBGXWAEBRO-HZPDHXFCSA-N 1 3 334.508 2.667 10 0 EFAEHO Cc1ccc2cc(C[NH2+]C3CCN([C@H]4CCC[C@@H]4O)CC3)[nH]c2c1 ZINC000657398838 547146273 /nfs/dbraw/zinc/14/62/73/547146273.db2.gz CVZTUNVYMJUNDJ-PMACEKPBSA-N 1 3 327.472 2.944 10 0 EFAEHO CCc1nn(C)c(CC)c1CNCC1CC[NH+](C2CCOCC2)CC1 ZINC000657535304 547195297 /nfs/dbraw/zinc/19/52/97/547195297.db2.gz JAVNWHWFFAWTJI-UHFFFAOYSA-N 1 3 348.535 2.526 10 0 EFAEHO COc1ccc(F)c(CNCC2CC[NH+](C3CCOCC3)CC2)c1 ZINC000657537603 547196602 /nfs/dbraw/zinc/19/66/02/547196602.db2.gz QJYXBTUKEWWIJN-UHFFFAOYSA-N 1 3 336.451 2.815 10 0 EFAEHO Cn1c(CNCC2CC[NH+](C3CCOCC3)CC2)nc2ccccc21 ZINC000657536210 547196650 /nfs/dbraw/zinc/19/66/50/547196650.db2.gz XXRDSOQNQQANSV-UHFFFAOYSA-N 1 3 342.487 2.554 10 0 EFAEHO COc1ccc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1F ZINC000657593672 547220346 /nfs/dbraw/zinc/22/03/46/547220346.db2.gz BFRNYNOFRRGAMM-GOSISDBHSA-N 1 3 344.430 2.691 10 0 EFAEHO COc1ccc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)cc1F ZINC000657593672 547220350 /nfs/dbraw/zinc/22/03/50/547220350.db2.gz BFRNYNOFRRGAMM-GOSISDBHSA-N 1 3 344.430 2.691 10 0 EFAEHO c1cc(OCC[NH+]2CCCC2)ccc1CN[C@H]1COC2(CCC2)C1 ZINC000657630364 547234287 /nfs/dbraw/zinc/23/42/87/547234287.db2.gz DFAXFEAYZOIEKM-GOSISDBHSA-N 1 3 330.472 2.962 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@@H](C)c2cc3cnccc3o2)CC1 ZINC000657836565 547298093 /nfs/dbraw/zinc/29/80/93/547298093.db2.gz TZJPFHCHPLKBTE-INIZCTEOSA-N 1 3 330.476 2.896 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(C(=O)NCCN(C)C)cc1)C(C)(C)C(F)F ZINC000657919022 547316853 /nfs/dbraw/zinc/31/68/53/547316853.db2.gz JJFRCFUYLJVMOL-CYBMUJFWSA-N 1 3 341.446 2.747 10 0 EFAEHO COc1ccc([C@H](C)N[C@@H](C)CN(C)CCC[NH+](C)C)c(F)c1 ZINC000658106340 547357378 /nfs/dbraw/zinc/35/73/78/547357378.db2.gz BRAZWHTYJKUNJO-GJZGRUSLSA-N 1 3 325.472 2.757 10 0 EFAEHO COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000658134300 547366342 /nfs/dbraw/zinc/36/63/42/547366342.db2.gz ACIZERCZXRWYIN-XUVXKRRUSA-N 1 3 332.488 2.548 10 0 EFAEHO Cc1cncc([C@@H](C)NCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000658138798 547367432 /nfs/dbraw/zinc/36/74/32/547367432.db2.gz OFPTXTNOGWSNEQ-OXQOHEQNSA-N 1 3 325.456 2.807 10 0 EFAEHO Cc1cncc([C@@H](C)NCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000658138798 547367436 /nfs/dbraw/zinc/36/74/36/547367436.db2.gz OFPTXTNOGWSNEQ-OXQOHEQNSA-N 1 3 325.456 2.807 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@H]([NH2+]Cc3ccc(CN4CC[C@H](O)C4)cc3)C[C@H]2C1 ZINC000658137388 547367582 /nfs/dbraw/zinc/36/75/82/547367582.db2.gz KPSFULLYXJAUFS-XIYVOTBMSA-N 1 3 344.499 2.546 10 0 EFAEHO C[C@@H](CC1CCOCC1)[NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000658138162 547367669 /nfs/dbraw/zinc/36/76/69/547367669.db2.gz IWHKVRGPWCNBDN-OXJNMPFZSA-N 1 3 332.488 2.548 10 0 EFAEHO C[C@H](NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cccc(CO)c1 ZINC000658136388 547367984 /nfs/dbraw/zinc/36/79/84/547367984.db2.gz HAVNGOBURQDYMM-HRAATJIYSA-N 1 3 340.467 2.596 10 0 EFAEHO C[C@H](NCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1)c1cccc(CO)c1 ZINC000658136388 547367987 /nfs/dbraw/zinc/36/79/87/547367987.db2.gz HAVNGOBURQDYMM-HRAATJIYSA-N 1 3 340.467 2.596 10 0 EFAEHO C[C@H](NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cccc(O)c1 ZINC000658139579 547368719 /nfs/dbraw/zinc/36/87/19/547368719.db2.gz QFQCUROEHVQBTQ-YWZLYKJASA-N 1 3 326.440 2.810 10 0 EFAEHO C[C@H](NCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1)c1cccc(O)c1 ZINC000658139579 547368723 /nfs/dbraw/zinc/36/87/23/547368723.db2.gz QFQCUROEHVQBTQ-YWZLYKJASA-N 1 3 326.440 2.810 10 0 EFAEHO C[C@H](NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cccc(O)c1 ZINC000658139576 547369131 /nfs/dbraw/zinc/36/91/31/547369131.db2.gz QFQCUROEHVQBTQ-MGPUTAFESA-N 1 3 326.440 2.810 10 0 EFAEHO C[C@H](NCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1)c1cccc(O)c1 ZINC000658139576 547369134 /nfs/dbraw/zinc/36/91/34/547369134.db2.gz QFQCUROEHVQBTQ-MGPUTAFESA-N 1 3 326.440 2.810 10 0 EFAEHO Cc1ccncc1[C@@H](C)NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000658142641 547370392 /nfs/dbraw/zinc/37/03/92/547370392.db2.gz ZHNFCWLMUSXCDV-APWZRJJASA-N 1 3 325.456 2.807 10 0 EFAEHO Cc1ccncc1[C@@H](C)NCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1 ZINC000658142641 547370396 /nfs/dbraw/zinc/37/03/96/547370396.db2.gz ZHNFCWLMUSXCDV-APWZRJJASA-N 1 3 325.456 2.807 10 0 EFAEHO C[C@@H](Cn1cncn1)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658317033 547418116 /nfs/dbraw/zinc/41/81/16/547418116.db2.gz IPXJOVZUYSRGKP-HKUYNNGSSA-N 1 3 339.487 2.559 10 0 EFAEHO C[C@@H](Cn1cncn1)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000658317033 547418118 /nfs/dbraw/zinc/41/81/18/547418118.db2.gz IPXJOVZUYSRGKP-HKUYNNGSSA-N 1 3 339.487 2.559 10 0 EFAEHO CN(Cc1ccccc1)[C@@H]1CCN(C(=O)CC[C@@H]2CCCC[N@@H+]2C)C1 ZINC000672937576 547831835 /nfs/dbraw/zinc/83/18/35/547831835.db2.gz RCEVZSMSIVHABP-VQTJNVASSA-N 1 3 343.515 2.984 10 0 EFAEHO CN(Cc1ccccc1)[C@@H]1CCN(C(=O)CC[C@@H]2CCCC[N@H+]2C)C1 ZINC000672937576 547831836 /nfs/dbraw/zinc/83/18/36/547831836.db2.gz RCEVZSMSIVHABP-VQTJNVASSA-N 1 3 343.515 2.984 10 0 EFAEHO CC[C@@H](CN1CCCC1)NC(=O)N1CCC(C[NH+](CC)CC)CC1 ZINC000675196334 548227061 /nfs/dbraw/zinc/22/70/61/548227061.db2.gz DMXLFUBSMIMVPX-SFHVURJKSA-N 1 3 338.540 2.624 10 0 EFAEHO CC[C@H](C[NH+]1CCCC1)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000677577218 548728629 /nfs/dbraw/zinc/72/86/29/548728629.db2.gz LLZLLZJQQLVEPQ-QRVBRYPASA-N 1 3 344.503 2.605 10 0 EFAEHO CC(C)[NH2+][C@@H]1CCCN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)C1 ZINC000677584360 548728848 /nfs/dbraw/zinc/72/88/48/548728848.db2.gz SCTSPZXRUDPUPA-QYZOEREBSA-N 1 3 344.503 2.604 10 0 EFAEHO CN1CCC(N2CC[C@@H]([NH2+]CCCCOc3ccccc3)C2)CC1 ZINC000682158917 549706436 /nfs/dbraw/zinc/70/64/36/549706436.db2.gz UDTZQUNCGCSBLR-GOSISDBHSA-N 1 3 331.504 2.604 10 0 EFAEHO CCN1CCN(Cc2ccc(C[NH2+][C@H]3CCC[C@@H](OC)C3)cc2)CC1 ZINC000684370212 550031151 /nfs/dbraw/zinc/03/11/51/550031151.db2.gz PYLXBGPLXQWRAX-LEWJYISDSA-N 1 3 345.531 2.871 10 0 EFAEHO CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2CN2CCC(O)CC2)C1 ZINC000684383347 550033153 /nfs/dbraw/zinc/03/31/53/550033153.db2.gz MQPLSZFNPDUTLJ-UYAOXDASSA-N 1 3 332.488 2.691 10 0 EFAEHO c1cc(OCC[NH+]2CCCC2)ccc1CN1CC([C@@H]2CCOC2)C1 ZINC000684414396 550036927 /nfs/dbraw/zinc/03/69/27/550036927.db2.gz IFORQNYNZYARGU-GOSISDBHSA-N 1 3 330.472 2.630 10 0 EFAEHO C/C(=C/c1ccc(Cl)cc1)C(=O)N(CCN(C)C)CC[NH+](C)C ZINC000759014822 575882799 /nfs/dbraw/zinc/88/27/99/575882799.db2.gz STODAZYWUDEHPM-PFONDFGASA-N 1 3 337.895 2.695 10 0 EFAEHO Cc1cc(CNCCN(C)C(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)cs1 ZINC001691359734 1248694000 /nfs/dbraw/zinc/69/40/00/1248694000.db2.gz CYXWUWPPAUZOCM-IAGOWNOFSA-N 1 3 335.517 2.621 10 0 EFAEHO Cc1cc(CNCCN(C)C(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)cs1 ZINC001691359734 1248694009 /nfs/dbraw/zinc/69/40/09/1248694009.db2.gz CYXWUWPPAUZOCM-IAGOWNOFSA-N 1 3 335.517 2.621 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN1CC[C@H](C)C1 ZINC001691370451 1248705847 /nfs/dbraw/zinc/70/58/47/1248705847.db2.gz QUCXJAWHEXJJQV-PEHGNSNYSA-N 1 3 335.536 2.901 10 0 EFAEHO Cc1ccc(C[NH2+]CCN(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC001691476584 1249200891 /nfs/dbraw/zinc/20/08/91/1249200891.db2.gz MXABQPOQFHFDKM-HXUWFJFHSA-N 1 3 349.494 2.756 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2C[C@H]([NH2+]CCCCC(F)(F)F)C2)CCC1 ZINC001691790713 1249605647 /nfs/dbraw/zinc/60/56/47/1249605647.db2.gz VQIMBENYXGEIBY-HDJSIYSDSA-N 1 3 349.441 2.688 10 0 EFAEHO CCCCC[NH+]1CC2(C1)CCN(C(=O)[C@H]1CCCCN1CC)CC2 ZINC001268049416 1249667809 /nfs/dbraw/zinc/66/78/09/1249667809.db2.gz ZGDZBFWTWPUQHE-GOSISDBHSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCC[NH2+][C@H]1C[C@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001691167092 1248498213 /nfs/dbraw/zinc/49/82/13/1248498213.db2.gz LCIWMHOCCKOQEE-GPMSIDNRSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1CN(CC=C(C)C)C[C@H]1c1ccccc1 ZINC001691199949 1248527556 /nfs/dbraw/zinc/52/75/56/1248527556.db2.gz LQXCTEWWZPAYQC-VQTJNVASSA-N 1 3 343.515 2.879 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1CN(CC=C(C)C)C[C@H]1c1ccccc1 ZINC001691199949 1248527564 /nfs/dbraw/zinc/52/75/64/1248527564.db2.gz LQXCTEWWZPAYQC-VQTJNVASSA-N 1 3 343.515 2.879 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN[C@@H]2C[C@H](O)c3ccccc32)cc1 ZINC000850372736 1250453385 /nfs/dbraw/zinc/45/33/85/1250453385.db2.gz YDJSZMVPHBJXPQ-UXHICEINSA-N 1 3 326.440 2.895 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN[C@H]2C[C@@H](O)c3ccccc32)cc1 ZINC000850372737 1250453539 /nfs/dbraw/zinc/45/35/39/1250453539.db2.gz YDJSZMVPHBJXPQ-VQTJNVASSA-N 1 3 326.440 2.895 10 0 EFAEHO COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC(=O)N2)cc1CN1CCCCC1 ZINC000850546974 1250530230 /nfs/dbraw/zinc/53/02/30/1250530230.db2.gz PSOCCUTVGLDDGW-YJBOKZPZSA-N 1 3 345.487 2.610 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@H](O)c2cc(F)c(F)c(F)c2)[C@H]2CCC[C@H]21 ZINC000850581392 1250546477 /nfs/dbraw/zinc/54/64/77/1250546477.db2.gz VVKYYLBTJDBOCA-CAPXZKIUSA-N 1 3 328.378 2.600 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@H](O)c2cc(F)c(F)c(F)c2)[C@H]2CCC[C@H]21 ZINC000850581392 1250546483 /nfs/dbraw/zinc/54/64/83/1250546483.db2.gz VVKYYLBTJDBOCA-CAPXZKIUSA-N 1 3 328.378 2.600 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@H](O)c2cc(F)c(F)c(F)c2)[C@H]2CCC[C@H]21 ZINC000850581392 1250546490 /nfs/dbraw/zinc/54/64/90/1250546490.db2.gz VVKYYLBTJDBOCA-CAPXZKIUSA-N 1 3 328.378 2.600 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCCCC[C@@H](NCc2ccccn2)C1 ZINC001691637137 1251974189 /nfs/dbraw/zinc/97/41/89/1251974189.db2.gz UBUAECXFSVBQJZ-LJQANCHMSA-N 1 3 346.519 2.674 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@]1(C)CC[N@H+](CC2=CCCCC2)C1 ZINC001484049184 1252117874 /nfs/dbraw/zinc/11/78/74/1252117874.db2.gz OIZFXPVPBJYQPG-IEBWSBKVSA-N 1 3 339.499 2.747 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@]1(C)CC[N@@H+](CC2=CCCCC2)C1 ZINC001484049184 1252117875 /nfs/dbraw/zinc/11/78/75/1252117875.db2.gz OIZFXPVPBJYQPG-IEBWSBKVSA-N 1 3 339.499 2.747 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@](C)(C[NH2+]CCCCCF)C2)CC1 ZINC001484120548 1252293807 /nfs/dbraw/zinc/29/38/07/1252293807.db2.gz UQDDSOLIGINRHW-LJQANCHMSA-N 1 3 341.515 2.686 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](C)[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001484355978 1252449488 /nfs/dbraw/zinc/44/94/88/1252449488.db2.gz AICDVEYOPWHYIY-MJGOQNOKSA-N 1 3 331.504 2.662 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001484359818 1252455264 /nfs/dbraw/zinc/45/52/64/1252455264.db2.gz YOUNMUSAHLCQKZ-YLJYHZDGSA-N 1 3 345.531 2.916 10 0 EFAEHO CC[N@@H+]1C[C@H](NC(=O)c2cccc(CN3CCCC3)c2)C(C)(C)C1 ZINC001434386675 1252656277 /nfs/dbraw/zinc/65/62/77/1252656277.db2.gz HCPVKIOEVVXRFR-SFHVURJKSA-N 1 3 329.488 2.743 10 0 EFAEHO CC[N@H+]1C[C@H](NC(=O)c2cccc(CN3CCCC3)c2)C(C)(C)C1 ZINC001434386675 1252656303 /nfs/dbraw/zinc/65/63/03/1252656303.db2.gz HCPVKIOEVVXRFR-SFHVURJKSA-N 1 3 329.488 2.743 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCCN(Cc2cccc(Cl)c2)CC1 ZINC001484724747 1252810768 /nfs/dbraw/zinc/81/07/68/1252810768.db2.gz XORNJNHHYNEFFW-QGZVFWFLSA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@H+](CCCc2ccccc2)CC1 ZINC001484728062 1252816971 /nfs/dbraw/zinc/81/69/71/1252816971.db2.gz JITBDHMCYXBYFC-HXUWFJFHSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC001484728062 1252816982 /nfs/dbraw/zinc/81/69/82/1252816982.db2.gz JITBDHMCYXBYFC-HXUWFJFHSA-N 1 3 345.531 2.930 10 0 EFAEHO Cc1cc(C[N@H+]2CCC[C@H](NC(=O)CN(C)C(C)C)CC2)cs1 ZINC001484727847 1252817550 /nfs/dbraw/zinc/81/75/50/1252817550.db2.gz HBHLHJZRSKMLFH-KRWDZBQOSA-N 1 3 337.533 2.867 10 0 EFAEHO Cc1cc(C[N@@H+]2CCC[C@H](NC(=O)CN(C)C(C)C)CC2)cs1 ZINC001484727847 1252817560 /nfs/dbraw/zinc/81/75/60/1252817560.db2.gz HBHLHJZRSKMLFH-KRWDZBQOSA-N 1 3 337.533 2.867 10 0 EFAEHO CN(CCCN(C)C(=O)CC[NH+](C)C)Cc1ccc(Cl)c(F)c1 ZINC001484756740 1252924530 /nfs/dbraw/zinc/92/45/30/1252924530.db2.gz DWDLZDWKVWBPQT-UHFFFAOYSA-N 1 3 343.874 2.711 10 0 EFAEHO CCN(CC[NH2+]Cc1cc2ccccc2s1)C(=O)[C@@H]1CCCN1C ZINC001273298732 1265846940 /nfs/dbraw/zinc/84/69/40/1265846940.db2.gz VYVYHIACHYUTDE-KRWDZBQOSA-N 1 3 345.512 2.934 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CCNC/C(Cl)=C\Cl ZINC001272824134 1260829253 /nfs/dbraw/zinc/82/92/53/1260829253.db2.gz VQXGTDRPKMODNP-AOSXOHOOSA-N 1 3 336.307 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CCNC/C(Cl)=C\Cl ZINC001272824134 1260829255 /nfs/dbraw/zinc/82/92/55/1260829255.db2.gz VQXGTDRPKMODNP-AOSXOHOOSA-N 1 3 336.307 2.664 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1cc2ccccc2o1)NC(=O)CN(C)C1CCC1 ZINC001272829864 1261098495 /nfs/dbraw/zinc/09/84/95/1261098495.db2.gz MLWBPVPYTMTUBL-HNNXBMFYSA-N 1 3 343.471 2.902 10 0 EFAEHO Cc1ccc(C)c(OC[C@H](O)CN2CCCC[C@@H]2[C@H]2CC[NH2+]C2)c1 ZINC000923364502 1261557575 /nfs/dbraw/zinc/55/75/75/1261557575.db2.gz NGDHEGSYPBCERX-IPMKNSEASA-N 1 3 332.488 2.507 10 0 EFAEHO Cc1cc(C)cc(OC[C@H](O)CN2CCCC[C@H]2[C@H]2CC[NH2+]C2)c1 ZINC000923365825 1261559562 /nfs/dbraw/zinc/55/95/62/1261559562.db2.gz ZPQRYUBRIZYROX-NSHGMRRFSA-N 1 3 332.488 2.507 10 0 EFAEHO Cc1cc(C)cc(OC[C@H](O)CN2CCCC[C@@H]2[C@H]2CC[NH2+]C2)c1 ZINC000923365824 1261559886 /nfs/dbraw/zinc/55/98/86/1261559886.db2.gz ZPQRYUBRIZYROX-NLWGTHIKSA-N 1 3 332.488 2.507 10 0 EFAEHO COc1ccc([C@H](NC[C@@H]2CC3(C[NH2+]C3)CO2)c2ccccc2)cc1 ZINC000923387661 1261596550 /nfs/dbraw/zinc/59/65/50/1261596550.db2.gz YLJBYIKBHKVRHG-VQTJNVASSA-N 1 3 338.451 2.753 10 0 EFAEHO COc1ccc([C@@H](NC[C@H]2CC3(C[NH2+]C3)CO2)c2ccccc2)cc1 ZINC000923387659 1261597100 /nfs/dbraw/zinc/59/71/00/1261597100.db2.gz YLJBYIKBHKVRHG-UXHICEINSA-N 1 3 338.451 2.753 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)cnn1C ZINC000903954331 1261598123 /nfs/dbraw/zinc/59/81/23/1261598123.db2.gz QRQOZJPFPMUFLE-KBMXLJTQSA-N 1 3 344.425 2.510 10 0 EFAEHO C[C@@H]1CN(C[C@H](O)COc2ccc(-c3ccccc3)cc2)C[C@H]1C[NH3+] ZINC000923409928 1261624353 /nfs/dbraw/zinc/62/43/53/1261624353.db2.gz CPPKMIBWVAJPSS-AHRSYUTCSA-N 1 3 340.467 2.620 10 0 EFAEHO Cc1ccc(C)c(OC[C@H](O)CN2CC[C@@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000923414530 1261628455 /nfs/dbraw/zinc/62/84/55/1261628455.db2.gz LQKLHXWGDPFVMA-XLIONFOSSA-N 1 3 334.504 2.740 10 0 EFAEHO CC(C)(C)[C@@]1(C[NH3+])CCN(C[C@H](O)COc2ccccc2Cl)C1 ZINC000923414972 1261628561 /nfs/dbraw/zinc/62/85/61/1261628561.db2.gz NZZGCTGDARBALT-KBXCAEBGSA-N 1 3 340.895 2.777 10 0 EFAEHO COC(=O)c1cncc(CN2CCC[C@@H](C[C@@H]([NH3+])C3CCCC3)C2)c1 ZINC000923422422 1261630204 /nfs/dbraw/zinc/63/02/04/1261630204.db2.gz RRJXJTRAENJONN-HNAYVOBHSA-N 1 3 345.487 2.988 10 0 EFAEHO CC1(C)[C@H]([NH3+])C[C@@H]1NC[C@@H]1Cc2ccccc2O[C@H]1C(F)(F)F ZINC000923423812 1261631878 /nfs/dbraw/zinc/63/18/78/1261631878.db2.gz ZORHPCUMFBYNIU-PMOUVXMZSA-N 1 3 328.378 2.884 10 0 EFAEHO Cc1ccc2ncc(CN3CCC4(CO[C@@H](C[NH3+])C4)CC3)cc2c1 ZINC000923443607 1261661730 /nfs/dbraw/zinc/66/17/30/1261661730.db2.gz GGQHXGWFWPBNKG-GOSISDBHSA-N 1 3 325.456 2.873 10 0 EFAEHO CC[C@@H](C(=O)Nc1ccc(C)cc1)N1CCC2(CO[C@@H](C[NH3+])C2)CC1 ZINC000923446307 1261665956 /nfs/dbraw/zinc/66/59/56/1261665956.db2.gz MTSSUYIQWKLDQL-MSOLQXFVSA-N 1 3 345.487 2.542 10 0 EFAEHO Cc1cc(F)ccc1N1CCC[C@H](N2CC[C@@H](C[NH3+])[C@@H](C)C2)C1=O ZINC000923496396 1261765028 /nfs/dbraw/zinc/76/50/28/1261765028.db2.gz HRRCPVQWRCQKDZ-MPGHIAIKSA-N 1 3 333.451 2.546 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C[NH3+])[C@@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000923502432 1261782892 /nfs/dbraw/zinc/78/28/92/1261782892.db2.gz ZAHZMMRZVSCVKL-TWOQFEAHSA-N 1 3 343.515 2.659 10 0 EFAEHO C[C@H](NC(=O)[C@H](C)N1CC[C@@H](C[NH3+])[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000923497137 1261786969 /nfs/dbraw/zinc/78/69/69/1261786969.db2.gz FNJFEIVAWMHRIP-YXWQFLTLSA-N 1 3 337.895 2.822 10 0 EFAEHO C[C@@H]1CN(CC(=O)NCC2(c3ccccc3)CCCC2)CC[C@@H]1C[NH3+] ZINC000923498234 1261790355 /nfs/dbraw/zinc/79/03/55/1261790355.db2.gz KDTQEKARLGMXTC-QZTJIDSGSA-N 1 3 343.515 2.531 10 0 EFAEHO C[C@@H]1CN(CC(=O)N[C@H](c2ccccc2)C2CCCC2)CC[C@@H]1C[NH3+] ZINC000923498438 1261792711 /nfs/dbraw/zinc/79/27/11/1261792711.db2.gz PNUGMGWBKGCHNE-OZOXKJRCSA-N 1 3 343.515 2.951 10 0 EFAEHO C[C@@H]1CN([C@H](C(=O)N2CCCCC2)c2ccccc2)CC[C@@H]1C[NH3+] ZINC000923499640 1261796050 /nfs/dbraw/zinc/79/60/50/1261796050.db2.gz MJYXUHCAPSVRNT-QRQLOZEOSA-N 1 3 329.488 2.657 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C[NH3+])[C@H](C)C1)c1cccc2ccccc21 ZINC000923500073 1261797040 /nfs/dbraw/zinc/79/70/40/1261797040.db2.gz NVNDUEZHNBNOMJ-SOLBZPMBSA-N 1 3 339.483 2.934 10 0 EFAEHO c1ccc2c(c1)[C@H](C[C@@H]1COCCN1)CN2CCC[NH+]1CCCCC1 ZINC000923541761 1261890006 /nfs/dbraw/zinc/89/00/06/1261890006.db2.gz VPHOLOUILKLWFW-RTBURBONSA-N 1 3 343.515 2.845 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001485929925 1262529350 /nfs/dbraw/zinc/52/93/50/1262529350.db2.gz IDYMYDUVIDEGJD-HOCLYGCPSA-N 1 3 345.478 2.731 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@@H](C)CN(C)C(=O)CN(C)C(C)C ZINC001485960381 1262559546 /nfs/dbraw/zinc/55/95/46/1262559546.db2.gz FTPFSSJPDCLMHY-HNNXBMFYSA-N 1 3 339.911 2.925 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CC2CC(C)(C)C2)CN1C(=O)CN(C)CC(C)(C)C ZINC001486124351 1262660790 /nfs/dbraw/zinc/66/07/90/1262660790.db2.gz OKYZVZIRQQMBJL-NVXWUHKLSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]CCCc2cccc(F)c2)C[C@H]1C ZINC001486139147 1262676079 /nfs/dbraw/zinc/67/60/79/1262676079.db2.gz ZMOHKJXOYRQMSP-APWZRJJASA-N 1 3 349.494 2.678 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]CCCc2cccc(F)c2)C[C@@H]1C ZINC001486139148 1262676470 /nfs/dbraw/zinc/67/64/70/1262676470.db2.gz ZMOHKJXOYRQMSP-LPHOPBHVSA-N 1 3 349.494 2.678 10 0 EFAEHO Cc1ccc(F)c(CN2CC[C@@]3(NC(=O)CC[NH+](C)C)CCC[C@@H]23)c1 ZINC001486148844 1262698371 /nfs/dbraw/zinc/69/83/71/1262698371.db2.gz VCRCZSRXJSUREU-QUCCMNQESA-N 1 3 347.478 2.699 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCCC(F)(F)F)C[C@@H]1C ZINC001486126696 1262704294 /nfs/dbraw/zinc/70/42/94/1262704294.db2.gz CSXWVWKGMSBKHS-UONOGXRCSA-N 1 3 337.430 2.640 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@]12CCC[C@@H]1N(Cc1ccc(F)cc1)CC2 ZINC001486162058 1262722628 /nfs/dbraw/zinc/72/26/28/1262722628.db2.gz ZBXVNRNCWHSKLS-AZUAARDMSA-N 1 3 347.478 2.781 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@]12CCC[C@@H]1N(Cc1ccc(F)cc1)CC2 ZINC001486162058 1262722632 /nfs/dbraw/zinc/72/26/32/1262722632.db2.gz ZBXVNRNCWHSKLS-AZUAARDMSA-N 1 3 347.478 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]Cc2ccccc2F)C1 ZINC001486220998 1262824917 /nfs/dbraw/zinc/82/49/17/1262824917.db2.gz PUNTZFXEWJVWMH-RDJZCZTQSA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@@H](NCc2cccnc2)C(C)(C)C1)[NH+](CC)CC ZINC001486243046 1262844971 /nfs/dbraw/zinc/84/49/71/1262844971.db2.gz PSNZWABKJLHDPQ-ZWKOTPCHSA-N 1 3 346.519 2.529 10 0 EFAEHO CCCC[NH2+][C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)CC1(C)C ZINC001486249882 1262854925 /nfs/dbraw/zinc/85/49/25/1262854925.db2.gz LKHXTTFRRSLGBU-GOSISDBHSA-N 1 3 331.504 2.989 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCN(C(=O)CC[NH+](C)C)C(C)C ZINC001486374782 1262976010 /nfs/dbraw/zinc/97/60/10/1262976010.db2.gz IZOROKQVXMZSTM-UHFFFAOYSA-N 1 3 333.520 2.924 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1ccsc1)C(C)(C)C)N(C)C ZINC001486402594 1263049639 /nfs/dbraw/zinc/04/96/39/1263049639.db2.gz HGQIQJKLLGHLIR-HUUCEWRRSA-N 1 3 325.522 2.709 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC([NH2+]CCCc2cccc(F)c2)C1)N(C)C ZINC001486477036 1263205169 /nfs/dbraw/zinc/20/51/69/1263205169.db2.gz YOUOULSNVNJCHJ-ACBHZAAOSA-N 1 3 349.494 2.678 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@@H+]([C@@H]2CCc3ccccc32)CC1)N(C)C ZINC001486515626 1263301228 /nfs/dbraw/zinc/30/12/28/1263301228.db2.gz LPGGHERYEBDDNG-VQTJNVASSA-N 1 3 341.499 2.762 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@H+]([C@@H]2CCc3ccccc32)CC1)N(C)C ZINC001486515626 1263301236 /nfs/dbraw/zinc/30/12/36/1263301236.db2.gz LPGGHERYEBDDNG-VQTJNVASSA-N 1 3 341.499 2.762 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(Cl)cc2)C1)N(C)C ZINC001410227670 1264385681 /nfs/dbraw/zinc/38/56/81/1264385681.db2.gz QHPUKVQLZZDZPR-XIRDDKMYSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC(N(C)C/C=C/Cl)CC1)[NH+]1CCCC1 ZINC001410254733 1264545391 /nfs/dbraw/zinc/54/53/91/1264545391.db2.gz CGAZCRDTEYRKDD-RCMYXZNBSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C[NH2+]CC1CCC(C)CC1)C1CC1 ZINC001410319205 1264775501 /nfs/dbraw/zinc/77/55/01/1264775501.db2.gz BANHPTVFCQPTLH-FAFZWHIHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N(C)C[C@@H](C)NCc1ccccc1F ZINC001410385212 1264971357 /nfs/dbraw/zinc/97/13/57/1264971357.db2.gz MNSKKMHLPJSQDF-QAPCUYQASA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N(C)C[C@@H](C)NCc1ccccc1F ZINC001410385212 1264971364 /nfs/dbraw/zinc/97/13/64/1264971364.db2.gz MNSKKMHLPJSQDF-QAPCUYQASA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N(C)C[C@H](C)NCc1ccccc1F ZINC001410385242 1264971560 /nfs/dbraw/zinc/97/15/60/1264971560.db2.gz MNSKKMHLPJSQDF-YJBOKZPZSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N(C)C[C@H](C)NCc1ccccc1F ZINC001410385242 1264971567 /nfs/dbraw/zinc/97/15/67/1264971567.db2.gz MNSKKMHLPJSQDF-YJBOKZPZSA-N 1 3 335.467 2.635 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001410428586 1265145360 /nfs/dbraw/zinc/14/53/60/1265145360.db2.gz CEZNZXUALVLJGN-CRAIPNDOSA-N 1 3 331.504 2.582 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN(C)CC(C)(C)C)[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001410439169 1265289339 /nfs/dbraw/zinc/28/93/39/1265289339.db2.gz QWODUAWHARXRRM-LSDHHAIUSA-N 1 3 347.494 2.836 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@](C)(C[NH2+]CCCC3CCC3)C2)CCC1 ZINC001671747617 1266886961 /nfs/dbraw/zinc/88/69/61/1266886961.db2.gz KALUPHAKXYYEQX-LJQANCHMSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)CN(C)C(=O)[C@H]1CC[N@H+](C)C1 ZINC001410494536 1266914017 /nfs/dbraw/zinc/91/40/17/1266914017.db2.gz LXXNDMXXQAYQMB-CABCVRRESA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)CN(C)C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001410494536 1266914020 /nfs/dbraw/zinc/91/40/20/1266914020.db2.gz LXXNDMXXQAYQMB-CABCVRRESA-N 1 3 337.895 2.537 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001410506556 1266986110 /nfs/dbraw/zinc/98/61/10/1266986110.db2.gz KYJKGIWDLJKDNH-HNAYVOBHSA-N 1 3 349.494 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(C)cc1Cl)N(C)C ZINC001273123328 1268579028 /nfs/dbraw/zinc/57/90/28/1268579028.db2.gz ROIQIVAVDDVXLK-YOEHRIQHSA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)cc1F ZINC001410847875 1269795338 /nfs/dbraw/zinc/79/53/38/1269795338.db2.gz JXGUCYOGYCNZNV-RDJZCZTQSA-N 1 3 335.467 2.553 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CC3CC3)[C@@H]2C1)CC(C)(C)C ZINC001410909795 1270222267 /nfs/dbraw/zinc/22/22/67/1270222267.db2.gz DFMZPFIKVCHVMP-KSZLIROESA-N 1 3 335.536 2.591 10 0 EFAEHO CC[NH2+][C@H](CCNC(=O)[C@@H]1CCCCN1C(C)C)Cc1ccccc1 ZINC001410924762 1270280814 /nfs/dbraw/zinc/28/08/14/1270280814.db2.gz FUAMLGWTXAULDT-UXHICEINSA-N 1 3 345.531 2.976 10 0 EFAEHO Cc1ccc(CCC[NH+]2CC([C@H](C)NC(=O)CN(C)C(C)C)C2)cc1 ZINC001409973014 1271107936 /nfs/dbraw/zinc/10/79/36/1271107936.db2.gz OMHALGORULQUDR-SFHVURJKSA-N 1 3 345.531 2.704 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)C1CC[NH+](CC2CCC2)CC1 ZINC001411230218 1272081282 /nfs/dbraw/zinc/08/12/82/1272081282.db2.gz CCKCDWBLPIYPJN-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[NH+](CC)CCCCNC(=O)C[C@@H](N)c1cc(C)nc(Cl)c1 ZINC000844170901 1278778477 /nfs/dbraw/zinc/77/84/77/1278778477.db2.gz UCZYMTIMEAGJMD-OAHLLOKOSA-N 1 3 340.899 2.672 10 0 EFAEHO CC[NH+](CC)CCO[C@@H]1CCN(C[C@@H](O)c2ccc(F)cc2C)C1 ZINC000746674830 1275750459 /nfs/dbraw/zinc/75/04/59/1275750459.db2.gz KDCRSRBZPPGMKG-IEBWSBKVSA-N 1 3 338.467 2.600 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@]1(O)CCCc2ccccc21 ZINC000817913138 1276374433 /nfs/dbraw/zinc/37/44/33/1276374433.db2.gz FOMUIJGZZZMUCU-VBKZILBWSA-N 1 3 325.456 2.723 10 0 EFAEHO N[C@@H]1CCC[C@H]1[NH2+]C[C@@H](C(=O)OCc1ccccc1)c1ccccc1 ZINC000817923023 1276379743 /nfs/dbraw/zinc/37/97/43/1276379743.db2.gz CLQYSMOUFVMMAJ-VAMGGRTRSA-N 1 3 338.451 2.983 10 0 EFAEHO CC[NH+](CC)Cc1ccccc1CNC[C@@H](O)c1ccc(F)cn1 ZINC000818942502 1276553864 /nfs/dbraw/zinc/55/38/64/1276553864.db2.gz FFIRDDGEOMGMTH-LJQANCHMSA-N 1 3 331.435 2.886 10 0 EFAEHO CCN1CCN(Cc2ccc(C[NH2+]CC3(O)CCCCC3)cc2)CC1 ZINC000818957833 1276558896 /nfs/dbraw/zinc/55/88/96/1276558896.db2.gz VAQCFTJHGZNVAM-UHFFFAOYSA-N 1 3 345.531 2.609 10 0 EFAEHO O[C@H](CNC[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(F)cn1 ZINC000818988466 1276564177 /nfs/dbraw/zinc/56/41/77/1276564177.db2.gz QJVLMHZECPFYQY-RDTXWAMCSA-N 1 3 349.475 2.817 10 0 EFAEHO O[C@H](CNC[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(F)cn1 ZINC000818988466 1276564179 /nfs/dbraw/zinc/56/41/79/1276564179.db2.gz QJVLMHZECPFYQY-RDTXWAMCSA-N 1 3 349.475 2.817 10 0 EFAEHO C[N@@H+]1CCC[C@H](CNC[C@H](O)c2ccc(F)cn2)[C@@H]1c1cccs1 ZINC000819101447 1276607449 /nfs/dbraw/zinc/60/74/49/1276607449.db2.gz UODKAIOFHYFVOV-RPVQJOFSSA-N 1 3 349.475 2.988 10 0 EFAEHO C[N@H+]1CCC[C@H](CNC[C@H](O)c2ccc(F)cn2)[C@@H]1c1cccs1 ZINC000819101447 1276607459 /nfs/dbraw/zinc/60/74/59/1276607459.db2.gz UODKAIOFHYFVOV-RPVQJOFSSA-N 1 3 349.475 2.988 10 0 EFAEHO CN(CCON=C(N)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)Cc1ccc(F)cc1 ZINC000871785834 1287288433 /nfs/dbraw/zinc/28/84/33/1287288433.db2.gz XUCDNMSDEFJPHG-ZNXRZULTSA-N 1 3 348.466 2.629 10 0 EFAEHO CN(CCON=C(N)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)Cc1ccc(F)cc1 ZINC000871785834 1287288436 /nfs/dbraw/zinc/28/84/36/1287288436.db2.gz XUCDNMSDEFJPHG-ZNXRZULTSA-N 1 3 348.466 2.629 10 0 EFAEHO CCN1C[C@H](CN2CCC(C[N@H+](C)Cc3ccccc3)CC2)OC1=O ZINC000846795491 1280502068 /nfs/dbraw/zinc/50/20/68/1280502068.db2.gz PYCQFSWQMJERPW-IBGZPJMESA-N 1 3 345.487 2.671 10 0 EFAEHO CCN1C[C@H](CN2CCC(C[N@@H+](C)Cc3ccccc3)CC2)OC1=O ZINC000846795491 1280502075 /nfs/dbraw/zinc/50/20/75/1280502075.db2.gz PYCQFSWQMJERPW-IBGZPJMESA-N 1 3 345.487 2.671 10 0 EFAEHO C[C@H](C(=O)NC12CC3CC(CC(C3)C1)C2)N(C)CCCCCC[NH3+] ZINC000872154899 1287449968 /nfs/dbraw/zinc/44/99/68/1287449968.db2.gz DQXRJQCWRDMADV-HWWITLHISA-N 1 3 335.536 2.911 10 0 EFAEHO [NH3+][C@@H](C[C@@H]1CCCN(CC(=O)NCc2ccccc2)C1)C1CCCC1 ZINC000872157612 1287453622 /nfs/dbraw/zinc/45/36/22/1287453622.db2.gz NUKUULWZVLUDCM-ICSRJNTNSA-N 1 3 343.515 2.922 10 0 EFAEHO C[C@@H]1CCC[N@H+](Cc2ccccc2CNC[C@@H](O)CC(C)(C)O)C1 ZINC000872200856 1287473114 /nfs/dbraw/zinc/47/31/14/1287473114.db2.gz LQGCQJIIDVZKGG-APWZRJJASA-N 1 3 334.504 2.530 10 0 EFAEHO C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC[C@@H](O)CC(C)(C)O)C1 ZINC000872200856 1287473119 /nfs/dbraw/zinc/47/31/19/1287473119.db2.gz LQGCQJIIDVZKGG-APWZRJJASA-N 1 3 334.504 2.530 10 0 EFAEHO CC1CC[NH+](Cc2ccccc2CNC[C@@H](O)CC(C)(C)O)CC1 ZINC000872200904 1287473199 /nfs/dbraw/zinc/47/31/99/1287473199.db2.gz MIBVEQUUVXCUDD-IBGZPJMESA-N 1 3 334.504 2.530 10 0 EFAEHO C[C@H]1CCC[N@H+](Cc2ccccc2CNC[C@@H](O)CC(C)(C)O)C1 ZINC000872200857 1287473374 /nfs/dbraw/zinc/47/33/74/1287473374.db2.gz LQGCQJIIDVZKGG-LPHOPBHVSA-N 1 3 334.504 2.530 10 0 EFAEHO C[C@H]1CCC[N@@H+](Cc2ccccc2CNC[C@@H](O)CC(C)(C)O)C1 ZINC000872200857 1287473377 /nfs/dbraw/zinc/47/33/77/1287473377.db2.gz LQGCQJIIDVZKGG-LPHOPBHVSA-N 1 3 334.504 2.530 10 0 EFAEHO C[C@H]1CCC[N@H+](Cc2ccccc2CNC[C@H](O)CC(C)(C)O)C1 ZINC000872200858 1287473696 /nfs/dbraw/zinc/47/36/96/1287473696.db2.gz LQGCQJIIDVZKGG-QFBILLFUSA-N 1 3 334.504 2.530 10 0 EFAEHO C[C@H]1CCC[N@@H+](Cc2ccccc2CNC[C@H](O)CC(C)(C)O)C1 ZINC000872200858 1287473702 /nfs/dbraw/zinc/47/37/02/1287473702.db2.gz LQGCQJIIDVZKGG-QFBILLFUSA-N 1 3 334.504 2.530 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@H+](CCCCCF)CC1)N(C)C ZINC001273446194 1281853399 /nfs/dbraw/zinc/85/33/99/1281853399.db2.gz QDAAEUXCSAOOOF-IAGOWNOFSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@@H+](CCCCCF)CC1)N(C)C ZINC001273446194 1281853402 /nfs/dbraw/zinc/85/34/02/1281853402.db2.gz QDAAEUXCSAOOOF-IAGOWNOFSA-N 1 3 329.504 2.683 10 0 EFAEHO C[NH+](C)C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CCCCC1 ZINC000809938139 1282623497 /nfs/dbraw/zinc/62/34/97/1282623497.db2.gz RVPYHWQCJADFNA-GOSISDBHSA-N 1 3 327.488 2.580 10 0 EFAEHO Cc1cc(F)ccc1[C@H](C)NC1CC[NH+](CCC(=O)N(C)C)CC1 ZINC000815578079 1287610998 /nfs/dbraw/zinc/61/09/98/1287610998.db2.gz HCJHMTGSYMHDRG-HNNXBMFYSA-N 1 3 335.467 2.727 10 0 EFAEHO CN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810284071 1283123577 /nfs/dbraw/zinc/12/35/77/1283123577.db2.gz ITJGUBSRKNKLPV-HXUWFJFHSA-N 1 3 349.494 2.919 10 0 EFAEHO CN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810284070 1283123821 /nfs/dbraw/zinc/12/38/21/1283123821.db2.gz ITJGUBSRKNKLPV-FQEVSTJZSA-N 1 3 349.494 2.919 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC[N@@H+](C3CCCC3)CC2)C1 ZINC000810426245 1283221920 /nfs/dbraw/zinc/22/19/20/1283221920.db2.gz PAEVLXQWNVHYQZ-LJQANCHMSA-N 1 3 339.499 2.676 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC[N@H+](C3CCCC3)CC2)C1 ZINC000810426245 1283221928 /nfs/dbraw/zinc/22/19/28/1283221928.db2.gz PAEVLXQWNVHYQZ-LJQANCHMSA-N 1 3 339.499 2.676 10 0 EFAEHO CN(CC[C@H]1CCCC[N@@H+]1C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810444877 1283247122 /nfs/dbraw/zinc/24/71/22/1283247122.db2.gz AACAFWPQAOGDQZ-CRAIPNDOSA-N 1 3 327.488 2.532 10 0 EFAEHO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810444877 1283247125 /nfs/dbraw/zinc/24/71/25/1283247125.db2.gz AACAFWPQAOGDQZ-CRAIPNDOSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC2CC[NH+](C3CCCC3)CC2)C1 ZINC000810478902 1283274640 /nfs/dbraw/zinc/27/46/40/1283274640.db2.gz CVIPMRXPYNMJSI-IBGZPJMESA-N 1 3 339.499 2.722 10 0 EFAEHO C[C@@H](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH+]1CCCCC1 ZINC000811031569 1283966920 /nfs/dbraw/zinc/96/69/20/1283966920.db2.gz SXVBGFUJGDXLER-YJBOKZPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[N@H+](CCCN1CCN(C(C)C)CC1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812849992 1285476687 /nfs/dbraw/zinc/47/66/87/1285476687.db2.gz SKXIFBDQCIITJI-TZIWHRDSSA-N 1 3 347.547 2.847 10 0 EFAEHO CC[N@@H+](CCCN1CCN(C(C)C)CC1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812849992 1285476698 /nfs/dbraw/zinc/47/66/98/1285476698.db2.gz SKXIFBDQCIITJI-TZIWHRDSSA-N 1 3 347.547 2.847 10 0 EFAEHO Cn1cc(CN2CCC3(CC[N@H+](Cc4cccs4)C3)CC2)cn1 ZINC000096046526 1285958673 /nfs/dbraw/zinc/95/86/73/1285958673.db2.gz RGLRPXGBUCOZTQ-UHFFFAOYSA-N 1 3 330.501 2.970 10 0 EFAEHO Cn1cc(CN2CCC3(CC[N@@H+](Cc4cccs4)C3)CC2)cn1 ZINC000096046526 1285958682 /nfs/dbraw/zinc/95/86/82/1285958682.db2.gz RGLRPXGBUCOZTQ-UHFFFAOYSA-N 1 3 330.501 2.970 10 0 EFAEHO [NH3+][C@@H]1CC[C@H](CN2CCN(Cc3nc4ccccc4s3)CC2)C1 ZINC000903441304 1312686535 /nfs/dbraw/zinc/68/65/35/1312686535.db2.gz MLPZGTYHLRURPN-LSDHHAIUSA-N 1 3 330.501 2.541 10 0 EFAEHO CCCCCCN(C)CC(=O)N1C[C@]23C[N@H+](C)C[C@@]2(C1)CCCC3 ZINC001181504383 1289816600 /nfs/dbraw/zinc/81/66/00/1289816600.db2.gz BNXDGHNSKAXBOC-BGYRXZFFSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCCCN(C)CC(=O)N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001181504383 1289816619 /nfs/dbraw/zinc/81/66/19/1289816619.db2.gz BNXDGHNSKAXBOC-BGYRXZFFSA-N 1 3 335.536 2.833 10 0 EFAEHO Nc1cc(CCCCNC(=O)c2ccc(C[NH+]3CCCC3)o2)ccn1 ZINC001181968409 1290042034 /nfs/dbraw/zinc/04/20/34/1290042034.db2.gz IYXVTGUGHYNIMN-UHFFFAOYSA-N 1 3 342.443 2.605 10 0 EFAEHO C[C@@H]1CN(CC(=O)Nc2ccc(N3CCCCC3)cc2)C[C@H]1CC[NH3+] ZINC000903496815 1312772663 /nfs/dbraw/zinc/77/26/63/1312772663.db2.gz FTYXPKNDZZZSFU-IAGOWNOFSA-N 1 3 344.503 2.532 10 0 EFAEHO C[C@@H]1CN(Cc2nn(-c3ccc(F)cc3)c3c2CCC3)C[C@H]1CC[NH3+] ZINC000903497240 1312773243 /nfs/dbraw/zinc/77/32/43/1312773243.db2.gz QWNGMHTXRFRINJ-HUUCEWRRSA-N 1 3 342.462 2.917 10 0 EFAEHO CC(C)C[NH+]1CCC(N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C)CC1 ZINC000721903418 1312797244 /nfs/dbraw/zinc/79/72/44/1312797244.db2.gz NLESKGDWCNBNLQ-DOTOQJQBSA-N 1 3 339.524 2.952 10 0 EFAEHO C([C@H]1CC2(CO1)CCOCC2)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000878286492 1291600316 /nfs/dbraw/zinc/60/03/16/1291600316.db2.gz PFFNQJLJMIBITD-QRQLOZEOSA-N 1 3 334.504 2.521 10 0 EFAEHO C([C@H]1CC2(CO1)CCOCC2)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000878286492 1291600320 /nfs/dbraw/zinc/60/03/20/1291600320.db2.gz PFFNQJLJMIBITD-QRQLOZEOSA-N 1 3 334.504 2.521 10 0 EFAEHO C[C@H]1COCCN(C[C@H](C[N@@H+]2CCOC[C@@H](C)C2)C2CCCC2)C1 ZINC000878298031 1291610747 /nfs/dbraw/zinc/61/07/47/1291610747.db2.gz DYIXYGQOUKQZDQ-OPVJXMOQSA-N 1 3 338.536 2.729 10 0 EFAEHO C[C@H]1COCCN(C[C@H](C[N@H+]2CCOC[C@@H](C)C2)C2CCCC2)C1 ZINC000878298031 1291610750 /nfs/dbraw/zinc/61/07/50/1291610750.db2.gz DYIXYGQOUKQZDQ-OPVJXMOQSA-N 1 3 338.536 2.729 10 0 EFAEHO C[C@H]1COCC[N@@H+](C[C@H](CN2CCOC[C@@H](C)C2)C2CCCC2)C1 ZINC000878298031 1291610756 /nfs/dbraw/zinc/61/07/56/1291610756.db2.gz DYIXYGQOUKQZDQ-OPVJXMOQSA-N 1 3 338.536 2.729 10 0 EFAEHO C[C@H]1COCC[N@H+](C[C@H](CN2CCOC[C@@H](C)C2)C2CCCC2)C1 ZINC000878298031 1291610761 /nfs/dbraw/zinc/61/07/61/1291610761.db2.gz DYIXYGQOUKQZDQ-OPVJXMOQSA-N 1 3 338.536 2.729 10 0 EFAEHO C[N@@H+](Cc1ccccc1)C[C@H](O)CN[C@@H]1CC=CC[C@H]1C(F)(F)F ZINC000879668633 1292225767 /nfs/dbraw/zinc/22/57/67/1292225767.db2.gz UOBASEJHPVTBPA-BRWVUGGUSA-N 1 3 342.405 2.966 10 0 EFAEHO C[N@H+](Cc1ccccc1)C[C@H](O)CN[C@@H]1CC=CC[C@H]1C(F)(F)F ZINC000879668633 1292225773 /nfs/dbraw/zinc/22/57/73/1292225773.db2.gz UOBASEJHPVTBPA-BRWVUGGUSA-N 1 3 342.405 2.966 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]Cc1cc(F)ccc1Cl)N(C)C ZINC001276332249 1292824899 /nfs/dbraw/zinc/82/48/99/1292824899.db2.gz DBVUQJLBUZFDSO-MRXNPFEDSA-N 1 3 343.874 2.757 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+][C@H]1CCc2ccccc21)N(C)C ZINC001276339635 1292949217 /nfs/dbraw/zinc/94/92/17/1292949217.db2.gz IHIIUANEWQDNRS-RBUKOAKNSA-N 1 3 331.504 2.698 10 0 EFAEHO C[C@H]([NH2+]C[C@H](O)CN1CCCC1)c1ccc(-c2cccnc2)cc1 ZINC000775540803 1292964053 /nfs/dbraw/zinc/96/40/53/1292964053.db2.gz XZDVCYBAJOERPF-JXFKEZNVSA-N 1 3 325.456 2.856 10 0 EFAEHO CCc1cccc(C[NH2+]CCN(CC)C(=O)CN2CCC(C)CC2)c1 ZINC001273674618 1293581790 /nfs/dbraw/zinc/58/17/90/1293581790.db2.gz ZUEGTSFNUNJESE-UHFFFAOYSA-N 1 3 345.531 2.919 10 0 EFAEHO CCCCC[NH+]1CC([C@@H](C)NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001276432493 1313058702 /nfs/dbraw/zinc/05/87/02/1313058702.db2.gz NLYWYJLCQBAKPS-BEFAXECRSA-N 1 3 341.515 2.826 10 0 EFAEHO NC(=O)C1(C[NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)CCCC1 ZINC000886528058 1295003633 /nfs/dbraw/zinc/00/36/33/1295003633.db2.gz GFXAHCBFGWFQFY-FHWLQOOXSA-N 1 3 341.499 2.675 10 0 EFAEHO NC(=O)C1(C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)CCCC1 ZINC000886528059 1295004432 /nfs/dbraw/zinc/00/44/32/1295004432.db2.gz GFXAHCBFGWFQFY-OTWHNJEPSA-N 1 3 341.499 2.675 10 0 EFAEHO CO[C@H](C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)[C@@H]1CCOC1 ZINC000886634583 1295073066 /nfs/dbraw/zinc/07/30/66/1295073066.db2.gz HLOIMZHCOQQKBM-XIYVOTBMSA-N 1 3 344.499 2.681 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/C[NH2+][C@H](C)c1ccc(F)cc1)N(C)C ZINC001274104296 1295456863 /nfs/dbraw/zinc/45/68/63/1295456863.db2.gz BJHBPADZPFLHDD-FVQGUVRESA-N 1 3 335.467 2.735 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C/CNC(=O)[C@@H](C(C)C)N(C)C)c(C)c1 ZINC001274337632 1296068348 /nfs/dbraw/zinc/06/83/48/1296068348.db2.gz AEZNPZKCZBBLHG-IHHMQQGQSA-N 1 3 331.504 2.652 10 0 EFAEHO C[C@H](C[NH2+]C/C=C\c1ccc(Cl)cc1)NC(=O)C1(N(C)C)CCC1 ZINC001274787939 1296173025 /nfs/dbraw/zinc/17/30/25/1296173025.db2.gz YOSLUKYYAJAVLU-ZDTYVGOBSA-N 1 3 349.906 2.932 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001275150160 1296239444 /nfs/dbraw/zinc/23/94/44/1296239444.db2.gz XOKQQSCEZJWEGB-HKUYNNGSSA-N 1 3 331.504 2.505 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C[NH2+]C/C=C/c1ccc(Cl)cc1)N(C)C ZINC001275410494 1296271416 /nfs/dbraw/zinc/27/14/16/1296271416.db2.gz HGHXIVWBIQFKNV-MFTLYIETSA-N 1 3 337.895 2.788 10 0 EFAEHO CN(C(=O)NC1CCC(C)([NH+]2CCCC2)CC1)[C@@H]1CCN(C2CC2)C1 ZINC000925043394 1296794202 /nfs/dbraw/zinc/79/42/02/1296794202.db2.gz XRMNUFIASZGYAE-KGXSXCIVSA-N 1 3 348.535 2.662 10 0 EFAEHO Cc1ccc(C(=O)NCCN[C@H]2CC[NH2+]C[C@@H]2C2CCCC2)cc1F ZINC000925535365 1296849562 /nfs/dbraw/zinc/84/95/62/1296849562.db2.gz FLGZKYGJTXKNRR-MJGOQNOKSA-N 1 3 347.478 2.622 10 0 EFAEHO C(C[NH2+][C@H]1CCNC[C@@H]1C1CCCC1)Cc1nnc2n1CCCCC2 ZINC000925574627 1296858002 /nfs/dbraw/zinc/85/80/02/1296858002.db2.gz WGYKUNZZWVNGMH-MSOLQXFVSA-N 1 3 345.535 2.695 10 0 EFAEHO CC[C@H]([NH2+][C@@H]1C[C@H](N)C12CCC2)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000925627388 1296864498 /nfs/dbraw/zinc/86/44/98/1296864498.db2.gz XTMYHCXQSKHYKY-INDMIFKZSA-N 1 3 339.487 2.814 10 0 EFAEHO Cn1cc(CC[NH2+][C@@H]2CCNC[C@H]2C2CCCC2)c2cccnc21 ZINC000925725859 1296873348 /nfs/dbraw/zinc/87/33/48/1296873348.db2.gz CORFFZBYHNHDML-RBUKOAKNSA-N 1 3 326.488 2.874 10 0 EFAEHO C[C@@H](NC[C@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1ccc(Cl)s1 ZINC000925850966 1296882273 /nfs/dbraw/zinc/88/22/73/1296882273.db2.gz AUPNTROULMPIPW-GHMZBOCLSA-N 1 3 328.865 2.737 10 0 EFAEHO C[C@H]([NH2+]CC[S@](=O)CC(F)(F)F)c1cccc(CN(C)C)c1 ZINC000926684092 1296948485 /nfs/dbraw/zinc/94/84/85/1296948485.db2.gz RNPIASDASHRJJY-YTEVENLXSA-N 1 3 336.423 2.710 10 0 EFAEHO COc1ccc([C@H](C)N(C)C[C@H](C[NH3+])Cc2cnn(C)c2C)cc1 ZINC000903877969 1313334218 /nfs/dbraw/zinc/33/42/18/1313334218.db2.gz DHWJIFJVVGIFCC-HOCLYGCPSA-N 1 3 330.476 2.548 10 0 EFAEHO COc1ccc([C@H](C)N(C)C[C@@H](C[NH3+])Cc2cnn(C)c2C)cc1 ZINC000903877968 1313334443 /nfs/dbraw/zinc/33/44/43/1313334443.db2.gz DHWJIFJVVGIFCC-GOEBONIOSA-N 1 3 330.476 2.548 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+](C)CCCCc2ccccc2)cnn1C ZINC000903885300 1313347532 /nfs/dbraw/zinc/34/75/32/1313347532.db2.gz KRAHCLHHTNNNQS-IBGZPJMESA-N 1 3 328.504 2.801 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+](C)CCCCc2ccccc2)cnn1C ZINC000903885300 1313347535 /nfs/dbraw/zinc/34/75/35/1313347535.db2.gz KRAHCLHHTNNNQS-IBGZPJMESA-N 1 3 328.504 2.801 10 0 EFAEHO CN1CCCC[C@H]1CC[N@H+](C)C[C@H](O)CC[C@@H](O)c1ccccc1 ZINC000929720225 1297201573 /nfs/dbraw/zinc/20/15/73/1297201573.db2.gz BVFPKJFAVQSFQN-XUVXKRRUSA-N 1 3 334.504 2.667 10 0 EFAEHO CN1CCCC[C@H]1CC[N@@H+](C)C[C@H](O)CC[C@@H](O)c1ccccc1 ZINC000929720225 1297201586 /nfs/dbraw/zinc/20/15/86/1297201586.db2.gz BVFPKJFAVQSFQN-XUVXKRRUSA-N 1 3 334.504 2.667 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CC[C@@H](c3ccccc3)[C@H](C)C2)cnn1C ZINC000903896725 1313372037 /nfs/dbraw/zinc/37/20/37/1313372037.db2.gz DPUMKQNDYNEUTB-HGHGUNKESA-N 1 3 340.515 2.972 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CC[C@@H](c3ccccc3)[C@H](C)C2)cnn1C ZINC000903896725 1313372040 /nfs/dbraw/zinc/37/20/40/1313372040.db2.gz DPUMKQNDYNEUTB-HGHGUNKESA-N 1 3 340.515 2.972 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)cnn1C ZINC000903897260 1313372829 /nfs/dbraw/zinc/37/28/29/1313372829.db2.gz GLNQCSDKGDGIQS-SQGPQFPESA-N 1 3 326.488 2.724 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)cnn1C ZINC000903897260 1313372832 /nfs/dbraw/zinc/37/28/32/1313372832.db2.gz GLNQCSDKGDGIQS-SQGPQFPESA-N 1 3 326.488 2.724 10 0 EFAEHO Cc1c(C[C@@H](CN)C[NH2+]C(C)(C)CCc2ccccc2)cnn1C ZINC000903897501 1313374394 /nfs/dbraw/zinc/37/43/94/1313374394.db2.gz FCNRIPKSDBKZLQ-SFHVURJKSA-N 1 3 328.504 2.847 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CNC2(c3ccc(F)cc3)CCC2)cnn1C ZINC000903899455 1313377411 /nfs/dbraw/zinc/37/74/11/1313377411.db2.gz RNXJPMQXORKOEU-HNNXBMFYSA-N 1 3 330.451 2.654 10 0 EFAEHO Cc1c(C[C@@H](CN)C[NH2+][C@H](C)C(C)(C)c2ccccc2)cnn1C ZINC000903922996 1313424746 /nfs/dbraw/zinc/42/47/46/1313424746.db2.gz JBLHQZJHMRXVRX-SJORKVTESA-N 1 3 328.504 2.802 10 0 EFAEHO COc1cccc(C2(NC[C@@H](C[NH3+])Cc3cnn(C)c3C)CCC2)c1 ZINC000903933334 1313441667 /nfs/dbraw/zinc/44/16/67/1313441667.db2.gz PAQQYPRVGUWTLV-MRXNPFEDSA-N 1 3 342.487 2.524 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN[C@H]2CCc3ccc(Cl)cc32)cnn1C ZINC000903933975 1313443246 /nfs/dbraw/zinc/44/32/46/1313443246.db2.gz CJQAWKIVDMKBIM-UGSOOPFHSA-N 1 3 332.879 2.776 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]CCC(C)(C)C)N(C)C ZINC001489053661 1298025006 /nfs/dbraw/zinc/02/50/06/1298025006.db2.gz UPNSOYBNWVIOBC-IXDOHACOSA-N 1 3 325.541 2.980 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CC[N@H+](Cc2cccc(C)c2)[C@@H]1C ZINC001489267340 1298135945 /nfs/dbraw/zinc/13/59/45/1298135945.db2.gz ILGPGHAHEHXQLS-NEWSRXKRSA-N 1 3 349.494 2.754 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CC[N@@H+](Cc2cccc(C)c2)[C@@H]1C ZINC001489267340 1298135947 /nfs/dbraw/zinc/13/59/47/1298135947.db2.gz ILGPGHAHEHXQLS-NEWSRXKRSA-N 1 3 349.494 2.754 10 0 EFAEHO FC1(F)CCNC[C@H]1C[NH2+]Cc1cccc(OCc2ccccn2)c1 ZINC000903955130 1313481324 /nfs/dbraw/zinc/48/13/24/1313481324.db2.gz KZHRAXRBEYDPGJ-INIZCTEOSA-N 1 3 347.409 2.995 10 0 EFAEHO COc1ccc(C[NH2+]C[C@@H]2CNCCC2(F)F)cc1Br ZINC000903953494 1313477469 /nfs/dbraw/zinc/47/74/69/1313477469.db2.gz GRJMVPXOTWODTL-NSHDSACASA-N 1 3 349.219 2.792 10 0 EFAEHO CCOc1ccc(C[NH2+]C[C@@H]2CNCCC2(F)F)cc1OCC ZINC000903955228 1313481965 /nfs/dbraw/zinc/48/19/65/1313481965.db2.gz NJSNXMKUBNUFEL-AWEZNQCLSA-N 1 3 328.403 2.818 10 0 EFAEHO FC1(F)CCNC[C@@H]1C[NH2+]Cc1ccc(OCc2ccncc2)cc1 ZINC000903955545 1313483486 /nfs/dbraw/zinc/48/34/86/1313483486.db2.gz VFBYMHKODUXDTG-QGZVFWFLSA-N 1 3 347.409 2.995 10 0 EFAEHO COCC[C@@H](Cc1cccc(F)c1)NC[C@@H]1C[NH2+]CCC1(F)F ZINC000903956148 1313484801 /nfs/dbraw/zinc/48/48/01/1313484801.db2.gz HZMKFUIODBLVSQ-HOCLYGCPSA-N 1 3 330.394 2.608 10 0 EFAEHO COCC[C@H](Cc1cccc(F)c1)NC[C@H]1C[NH2+]CCC1(F)F ZINC000903956146 1313484928 /nfs/dbraw/zinc/48/49/28/1313484928.db2.gz HZMKFUIODBLVSQ-GDBMZVCRSA-N 1 3 330.394 2.608 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)NC[C@@H]1C[NH2+]C[C@H]1C ZINC000903967714 1313510182 /nfs/dbraw/zinc/51/01/82/1313510182.db2.gz LSJBZUIVSKLFTE-FMKPAKJESA-N 1 3 337.895 2.522 10 0 EFAEHO Cc1ccc(CCC[NH2+]C[C@@H]2CCCN2C(=O)CN2CCCC2)cc1 ZINC001277997663 1313510342 /nfs/dbraw/zinc/51/03/42/1313510342.db2.gz PXPCWPTVPWYZMO-FQEVSTJZSA-N 1 3 343.515 2.604 10 0 EFAEHO CN(CC(=O)NCCC[N@H+](C)Cc1ccc2c(c1)CCC2)C1CCC1 ZINC001490207565 1298599827 /nfs/dbraw/zinc/59/98/27/1298599827.db2.gz KSHUXDQQCYECSD-UHFFFAOYSA-N 1 3 343.515 2.598 10 0 EFAEHO CN(CC(=O)NCCC[N@@H+](C)Cc1ccc2c(c1)CCC2)C1CCC1 ZINC001490207565 1298599830 /nfs/dbraw/zinc/59/98/30/1298599830.db2.gz KSHUXDQQCYECSD-UHFFFAOYSA-N 1 3 343.515 2.598 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001490250202 1298675868 /nfs/dbraw/zinc/67/58/68/1298675868.db2.gz GCXMSCUZYLFHJI-INIZCTEOSA-N 1 3 331.504 2.583 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001490250202 1298675871 /nfs/dbraw/zinc/67/58/71/1298675871.db2.gz GCXMSCUZYLFHJI-INIZCTEOSA-N 1 3 331.504 2.583 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](C)[C@H]2CCc3c2cccc3F)C1 ZINC001490250473 1298678303 /nfs/dbraw/zinc/67/83/03/1298678303.db2.gz LFKGRWPCLPSQFS-KXBFYZLASA-N 1 3 347.478 2.593 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](C)[C@H]2CCc3c2cccc3F)C1 ZINC001490250473 1298678310 /nfs/dbraw/zinc/67/83/10/1298678310.db2.gz LFKGRWPCLPSQFS-KXBFYZLASA-N 1 3 347.478 2.593 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](C)[C@H]2CCc3c2cccc3F)C1 ZINC001490250466 1298679230 /nfs/dbraw/zinc/67/92/30/1298679230.db2.gz LFKGRWPCLPSQFS-BEFAXECRSA-N 1 3 347.478 2.593 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](C)[C@H]2CCc3c2cccc3F)C1 ZINC001490250466 1298679235 /nfs/dbraw/zinc/67/92/35/1298679235.db2.gz LFKGRWPCLPSQFS-BEFAXECRSA-N 1 3 347.478 2.593 10 0 EFAEHO Cc1cncc(CN(C)CCCNC(=O)[C@@H](C)[NH+]2CCCCCC2)c1 ZINC001490255945 1298687585 /nfs/dbraw/zinc/68/75/85/1298687585.db2.gz KJTHIXRJAJPREW-GOSISDBHSA-N 1 3 346.519 2.593 10 0 EFAEHO Cc1ccc(CN(C)CCCNC(=O)C[NH+]2[C@H](C)CC[C@H]2C)c(C)n1 ZINC001490280963 1298705775 /nfs/dbraw/zinc/70/57/75/1298705775.db2.gz CKLMXQVBKSCMGC-IAGOWNOFSA-N 1 3 346.519 2.509 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@@H](C)[NH2+]CCC(F)(F)F ZINC001490313371 1298760952 /nfs/dbraw/zinc/76/09/52/1298760952.db2.gz YRRLBIAAUXZNKM-KGLIPLIRSA-N 1 3 337.430 2.638 10 0 EFAEHO CN(C(=O)[C@@H]1CCCN1C)C1CC[NH+](CCCCC(F)(F)F)CC1 ZINC001490401676 1298826105 /nfs/dbraw/zinc/82/61/05/1298826105.db2.gz COZZTXHVYAHVLZ-HNNXBMFYSA-N 1 3 349.441 2.736 10 0 EFAEHO Cc1cccc(C[NH+]2CCC3(C[C@@H]3NC(=O)CN(C)C(C)C)CC2)c1 ZINC001490611668 1299037963 /nfs/dbraw/zinc/03/79/63/1299037963.db2.gz YVQOYXPYYPZDEM-IBGZPJMESA-N 1 3 343.515 2.806 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C[NH2+]C/C=C/Cl)C1CCCC1)N(C)C ZINC001324499218 1329633703 /nfs/dbraw/zinc/63/37/03/1329633703.db2.gz ZQIJGAVSYMXDEI-UIOUNXJESA-N 1 3 329.916 2.590 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1ccc(F)cc1)C1CC1 ZINC001490660282 1299100990 /nfs/dbraw/zinc/10/09/90/1299100990.db2.gz FXTWZGRTHPXJKO-OALUTQOASA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CC1CC(C)(C)C1)C1CC1 ZINC001490661403 1299103761 /nfs/dbraw/zinc/10/37/61/1299103761.db2.gz MRHQITAUJLGLNI-MSOLQXFVSA-N 1 3 335.536 2.780 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]([NH2+]CC2CCC3(CC3)CC2)C2CC2)C1 ZINC001490711707 1299121798 /nfs/dbraw/zinc/12/17/98/1299121798.db2.gz ZWQSCOCIFKQJSE-APWZRJJASA-N 1 3 347.547 2.783 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]([NH2+]Cc1ccc(F)cc1)C1CC1)N1CCCC1 ZINC001490695502 1299149476 /nfs/dbraw/zinc/14/94/76/1299149476.db2.gz XLLMGJSTQIHPCX-GOSISDBHSA-N 1 3 347.478 2.685 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC[C@@H](CN(C)C/C=C\Cl)C2)CC[N@@H+]1C ZINC001490769020 1299220797 /nfs/dbraw/zinc/22/07/97/1299220797.db2.gz YTXZMJYPQMTEJI-HEGGERCZSA-N 1 3 341.927 2.640 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC[C@@H](CN(C)C/C=C\Cl)C2)CC[N@H+]1C ZINC001490769020 1299220805 /nfs/dbraw/zinc/22/08/05/1299220805.db2.gz YTXZMJYPQMTEJI-HEGGERCZSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@H+](C)Cc2ccccc2)C1 ZINC001490776347 1299240076 /nfs/dbraw/zinc/24/00/76/1299240076.db2.gz IVCRRCZRLCZIMB-LJQANCHMSA-N 1 3 331.504 2.697 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@@H+](C)Cc2ccccc2)C1 ZINC001490776347 1299240081 /nfs/dbraw/zinc/24/00/81/1299240081.db2.gz IVCRRCZRLCZIMB-LJQANCHMSA-N 1 3 331.504 2.697 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H](C[N@H+](C)C/C=C/Cl)C1 ZINC001490785259 1299255299 /nfs/dbraw/zinc/25/52/99/1299255299.db2.gz YQIIVNJDVFCSTD-NGXUEJOTSA-N 1 3 341.927 2.784 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H](C[N@@H+](C)C/C=C/Cl)C1 ZINC001490785259 1299255307 /nfs/dbraw/zinc/25/53/07/1299255307.db2.gz YQIIVNJDVFCSTD-NGXUEJOTSA-N 1 3 341.927 2.784 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000852909296 1299935083 /nfs/dbraw/zinc/93/50/83/1299935083.db2.gz QLTRKPMHFHIEGO-GOSISDBHSA-N 1 3 331.460 2.552 10 0 EFAEHO O[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)c1ccccn1 ZINC000853098257 1300005746 /nfs/dbraw/zinc/00/57/46/1300005746.db2.gz HWLZEBIIFFCSGI-QYYYHEGRSA-N 1 3 337.467 2.900 10 0 EFAEHO CN1CC[C@]2(CC[N@H+](C[C@@H](O)COc3ccc4ccccc4c3)C2)C1 ZINC000795333450 1300787863 /nfs/dbraw/zinc/78/78/63/1300787863.db2.gz KXGXICZMBSVEMO-CTNGQTDRSA-N 1 3 340.467 2.607 10 0 EFAEHO CN1CC[C@]2(CC[N@@H+](C[C@@H](O)COc3ccc4ccccc4c3)C2)C1 ZINC000795333450 1300787869 /nfs/dbraw/zinc/78/78/69/1300787869.db2.gz KXGXICZMBSVEMO-CTNGQTDRSA-N 1 3 340.467 2.607 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000855347125 1300923740 /nfs/dbraw/zinc/92/37/40/1300923740.db2.gz UMOOVBZQTIQWEP-YSIASYRMSA-N 1 3 345.531 2.959 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000855347125 1300923746 /nfs/dbraw/zinc/92/37/46/1300923746.db2.gz UMOOVBZQTIQWEP-YSIASYRMSA-N 1 3 345.531 2.959 10 0 EFAEHO CN(C)C1CC[NH+](C[C@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1 ZINC000113500074 1301035625 /nfs/dbraw/zinc/03/56/25/1301035625.db2.gz LECVBMXBCAHOJW-OAHLLOKOSA-N 1 3 325.497 2.660 10 0 EFAEHO CO[C@H]1CN(C)[C@@](C)(COC(=O)c2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000861350940 1302095376 /nfs/dbraw/zinc/09/53/76/1302095376.db2.gz GEIMFJIAIHCHSL-UYAOXDASSA-N 1 3 346.471 2.548 10 0 EFAEHO CCOC(=O)C(F)(F)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCNC23CCC3)C1 ZINC000863482486 1302627674 /nfs/dbraw/zinc/62/76/74/1302627674.db2.gz IPMVXKMJBPTGEH-MCIONIFRSA-N 1 3 330.419 2.618 10 0 EFAEHO C[C@@H](CCCCCN1C(=O)c2ccccc2C1=O)[NH2+][C@@H]1CCN[C@H]1C ZINC000863548641 1302646990 /nfs/dbraw/zinc/64/69/90/1302646990.db2.gz QUYZWUUCRNLKIC-RLFYNMQTSA-N 1 3 343.471 2.572 10 0 EFAEHO C[C@H](CCCCCN1C(=O)c2ccccc2C1=O)[NH2+][C@@H]1CCN[C@H]1C ZINC000863548643 1302647117 /nfs/dbraw/zinc/64/71/17/1302647117.db2.gz QUYZWUUCRNLKIC-RVKKMQEKSA-N 1 3 343.471 2.572 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N1CCC(N2C(=O)O[C@H]3C[NH2+]C[C@H]32)CC1 ZINC000863549405 1302647321 /nfs/dbraw/zinc/64/73/21/1302647321.db2.gz IWRFXTAIKTVTDH-KSZLIROESA-N 1 3 347.434 2.534 10 0 EFAEHO C[C@H]1CC[C@H](NCC2CCN(C(=O)OCc3ccccc3)CC2)C[NH2+]1 ZINC000863649264 1302668992 /nfs/dbraw/zinc/66/89/92/1302668992.db2.gz BFIVRNFFPRPWEO-LPHOPBHVSA-N 1 3 345.487 2.765 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CC[C@@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000864620794 1303001766 /nfs/dbraw/zinc/00/17/66/1303001766.db2.gz PHZKPHRKHFECQC-IBGZPJMESA-N 1 3 332.492 2.977 10 0 EFAEHO Cn1ncc(Cl)c1CNCC1(c2ccccc2)CC[NH+](C)CC1 ZINC000865774588 1303394427 /nfs/dbraw/zinc/39/44/27/1303394427.db2.gz XXZAHLZUXPCDDO-UHFFFAOYSA-N 1 3 332.879 2.827 10 0 EFAEHO C[C@@H]1C[C@@H](N[C@@H]2COc3cccc(Br)c3C2)CC[N@@H+]1C ZINC000866594574 1303702729 /nfs/dbraw/zinc/70/27/29/1303702729.db2.gz IAUBFUIZMAIJKW-AGIUHOORSA-N 1 3 339.277 2.825 10 0 EFAEHO C[C@@H]1C[C@@H](N[C@@H]2COc3cccc(Br)c3C2)CC[N@H+]1C ZINC000866594574 1303702735 /nfs/dbraw/zinc/70/27/35/1303702735.db2.gz IAUBFUIZMAIJKW-AGIUHOORSA-N 1 3 339.277 2.825 10 0 EFAEHO C[C@@H]1C[C@H](N[C@@H]2COc3cccc(Br)c3C2)CC[N@@H+]1C ZINC000866594577 1303702781 /nfs/dbraw/zinc/70/27/81/1303702781.db2.gz IAUBFUIZMAIJKW-UPJWGTAASA-N 1 3 339.277 2.825 10 0 EFAEHO C[C@@H]1C[C@H](N[C@@H]2COc3cccc(Br)c3C2)CC[N@H+]1C ZINC000866594577 1303702787 /nfs/dbraw/zinc/70/27/87/1303702787.db2.gz IAUBFUIZMAIJKW-UPJWGTAASA-N 1 3 339.277 2.825 10 0 EFAEHO CC(C)c1ccc([C@@H](C)N2CC[C@H](N3C(=O)O[C@H]4C[NH2+]C[C@H]43)C2)cc1 ZINC000866712173 1303761789 /nfs/dbraw/zinc/76/17/89/1303761789.db2.gz RIHPXTLAHNESFX-FDPIWHGQSA-N 1 3 343.471 2.738 10 0 EFAEHO CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc([C@@H]2C[C@H]2[NH3+])cc1 ZINC000868183396 1304174733 /nfs/dbraw/zinc/17/47/33/1304174733.db2.gz HPRUWHSROMDYPT-ZWKOTPCHSA-N 1 3 342.443 2.690 10 0 EFAEHO CCN(C(=O)[C@]12C[C@H]1C[C@H]([NH3+])C2)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000870908258 1305672992 /nfs/dbraw/zinc/67/29/92/1305672992.db2.gz YLXABROSEDQFDY-DBCWFSNCSA-N 1 3 341.499 2.798 10 0 EFAEHO CC(C)[N@@H+]1CC[C@H](CNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900409884 1308137781 /nfs/dbraw/zinc/13/77/81/1308137781.db2.gz LWSLNFAHVALNHJ-OAHLLOKOSA-N 1 3 328.460 2.751 10 0 EFAEHO CC(C)[N@H+]1CC[C@H](CNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900409884 1308137784 /nfs/dbraw/zinc/13/77/84/1308137784.db2.gz LWSLNFAHVALNHJ-OAHLLOKOSA-N 1 3 328.460 2.751 10 0 EFAEHO C[NH+](C)C[C@H]1CCCCN1C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000900560666 1308315742 /nfs/dbraw/zinc/31/57/42/1308315742.db2.gz ADCJGTZMHOMBQD-QGZVFWFLSA-N 1 3 328.460 2.847 10 0 EFAEHO O=C(c1ccc(NC2=NCCC2)cc1)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000900619387 1308419827 /nfs/dbraw/zinc/41/98/27/1308419827.db2.gz SAUBIXMOSCJSRF-SFHVURJKSA-N 1 3 340.471 2.991 10 0 EFAEHO CC[NH+](CC)[C@@H]1CCN(C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900884345 1308821748 /nfs/dbraw/zinc/82/17/48/1308821748.db2.gz AGROAQUSUJTOGR-QGZVFWFLSA-N 1 3 328.460 2.847 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900958931 1309040802 /nfs/dbraw/zinc/04/08/02/1309040802.db2.gz NBJPOVIWYMEGNY-DLBZAZTESA-N 1 3 328.460 2.893 10 0 EFAEHO C[C@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)NCc1ccc(Cl)s1 ZINC001491487085 1311192473 /nfs/dbraw/zinc/19/24/73/1311192473.db2.gz UHTQLRYARMEMQJ-OLZOCXBDSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)NCc1ccc(Cl)s1 ZINC001491487085 1311192476 /nfs/dbraw/zinc/19/24/76/1311192476.db2.gz UHTQLRYARMEMQJ-OLZOCXBDSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@H]2C[C@H](C[NH2+]CCCCC(F)(F)F)C2)C1 ZINC001277046166 1311527491 /nfs/dbraw/zinc/52/74/91/1311527491.db2.gz IBJOPWQNUFJANV-KKUMJFAQSA-N 1 3 349.441 2.545 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1C[C@H](C[NH2+]CCC2=CCCCC2)C1 ZINC001277081745 1311588544 /nfs/dbraw/zinc/58/85/44/1311588544.db2.gz KKTIBMLUDZFMBU-QAQDUYKDSA-N 1 3 330.476 2.636 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CCC[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001277209205 1311806873 /nfs/dbraw/zinc/80/68/73/1311806873.db2.gz DRUBUEQQVOUGPN-INIZCTEOSA-N 1 3 349.494 2.993 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[N@H+](C)CCC2=CCCCC2)C1 ZINC001280857432 1311848930 /nfs/dbraw/zinc/84/89/30/1311848930.db2.gz RHKNPFIARYINQN-SFHVURJKSA-N 1 3 335.536 2.999 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[N@@H+](C)CCC2=CCCCC2)C1 ZINC001280857432 1311848932 /nfs/dbraw/zinc/84/89/32/1311848932.db2.gz RHKNPFIARYINQN-SFHVURJKSA-N 1 3 335.536 2.999 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CCCc2ccsc2)CC1 ZINC001277258819 1311884150 /nfs/dbraw/zinc/88/41/50/1311884150.db2.gz BNOAUSSOXFDJJW-IYBDPMFKSA-N 1 3 349.544 2.792 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@H](C2CCN(C(=O)[C@H]3CCCN3C)CC2)C1 ZINC001277276424 1311912330 /nfs/dbraw/zinc/91/23/30/1311912330.db2.gz ZVBQFDCNCNKMDU-INPAECQJSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@H](C2CCN(C(=O)[C@H]3CCCN3C)CC2)C1 ZINC001277276424 1311912332 /nfs/dbraw/zinc/91/23/32/1311912332.db2.gz ZVBQFDCNCNKMDU-INPAECQJSA-N 1 3 347.547 2.997 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)CN1CC[C@@H](C)C1 ZINC001277352091 1312042379 /nfs/dbraw/zinc/04/23/79/1312042379.db2.gz QSMKMGFOWVKITO-QRVBRYPASA-N 1 3 335.536 2.974 10 0 EFAEHO CCCCCC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)CN1CC[C@@H](C)C1 ZINC001277352091 1312042381 /nfs/dbraw/zinc/04/23/81/1312042381.db2.gz QSMKMGFOWVKITO-QRVBRYPASA-N 1 3 335.536 2.974 10 0 EFAEHO O[C@H](C[NH2+][C@H](CCc1cccnc1)c1ccccc1)CN1CCCC1 ZINC000902763777 1312085696 /nfs/dbraw/zinc/08/56/96/1312085696.db2.gz YWXJMGVNMJAAMK-NHCUHLMSSA-N 1 3 339.483 2.802 10 0 EFAEHO CCCn1cc([C@@H](C)NCC2CCN(c3cc[nH+]cc3)CC2)nn1 ZINC000902850055 1312155003 /nfs/dbraw/zinc/15/50/03/1312155003.db2.gz HPUGRASBBCARHQ-OAHLLOKOSA-N 1 3 328.464 2.650 10 0 EFAEHO C[C@@H]([NH2+]CCN1CCN(C)C(C)(C)C1)c1cccc(-n2ccnc2)c1 ZINC000902981405 1312258826 /nfs/dbraw/zinc/25/88/26/1312258826.db2.gz NNWQTVOBXCTVNU-QGZVFWFLSA-N 1 3 341.503 2.549 10 0 EFAEHO CCCn1cc([C@H](C)NCC2CC[NH+](Cc3ccncc3)CC2)nn1 ZINC000903050063 1312310771 /nfs/dbraw/zinc/31/07/71/1312310771.db2.gz OXOWFQUJMFOUBA-INIZCTEOSA-N 1 3 342.491 2.646 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NC[C@@H]1CCC=CCCC1 ZINC001230863622 1312373024 /nfs/dbraw/zinc/37/30/24/1312373024.db2.gz NLZBOBMZLRXFAN-ZWKOTPCHSA-N 1 3 338.540 2.694 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NC[C@@H]1CCC=CCCC1 ZINC001230863622 1312373026 /nfs/dbraw/zinc/37/30/26/1312373026.db2.gz NLZBOBMZLRXFAN-ZWKOTPCHSA-N 1 3 338.540 2.694 10 0 EFAEHO c1cc2c(cc1C1([NH2+]C3CCN(CC4CC4)CC3)CC1)OCCO2 ZINC000903295251 1312545238 /nfs/dbraw/zinc/54/52/38/1312545238.db2.gz QJPLBUXRKQQHRA-UHFFFAOYSA-N 1 3 328.456 2.911 10 0 EFAEHO CCOC(=O)C1CCC(N[C@H](CC[NH+](C)C)c2cccnc2)CC1 ZINC000903380754 1312616669 /nfs/dbraw/zinc/61/66/69/1312616669.db2.gz OTWJMMWLFXYVBL-VMWRSERWSA-N 1 3 333.476 2.786 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN3CCC(C)CC3)C[C@H]21 ZINC001278487261 1314790949 /nfs/dbraw/zinc/79/09/49/1314790949.db2.gz NBBNVYQHNIISPY-XUVXKRRUSA-N 1 3 347.547 2.901 10 0 EFAEHO CCCC[NH2+][C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1CC ZINC001276751313 1315033647 /nfs/dbraw/zinc/03/36/47/1315033647.db2.gz PBPBYAZFNSZBNL-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO CN(C(=O)C(C)(C)N1CCCCC1)[C@H]1CC[N@H+](CCCCCF)C1 ZINC001318402957 1328575573 /nfs/dbraw/zinc/57/55/73/1328575573.db2.gz OLPMTOJXYGPACG-KRWDZBQOSA-N 1 3 341.515 2.923 10 0 EFAEHO CN(C(=O)C(C)(C)N1CCCCC1)[C@H]1CC[N@@H+](CCCCCF)C1 ZINC001318402957 1328575579 /nfs/dbraw/zinc/57/55/79/1328575579.db2.gz OLPMTOJXYGPACG-KRWDZBQOSA-N 1 3 341.515 2.923 10 0 EFAEHO CC1(C)CN(C(=O)Cc2c[nH]cn2)C[C@@H]1[NH2+]CCCCC(F)(F)F ZINC001278672165 1315468652 /nfs/dbraw/zinc/46/86/52/1315468652.db2.gz GFXWSWXRWLRSOP-ZDUSSCGKSA-N 1 3 346.397 2.511 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@H](CC)N(C)C)C1 ZINC001278748213 1315651627 /nfs/dbraw/zinc/65/16/27/1315651627.db2.gz YCRVBHLDIVPSDJ-GJZGRUSLSA-N 1 3 333.467 2.590 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@H](CC)N(C)C)C1 ZINC001278748213 1315651624 /nfs/dbraw/zinc/65/16/24/1315651624.db2.gz YCRVBHLDIVPSDJ-GJZGRUSLSA-N 1 3 333.467 2.590 10 0 EFAEHO CC(C)CCC[NH2+][C@@H](C)[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001279032218 1316081392 /nfs/dbraw/zinc/08/13/92/1316081392.db2.gz UYNMHGPJMZFPBB-RBUKOAKNSA-N 1 3 337.552 2.981 10 0 EFAEHO OC1(CN[C@@H]2CCc3cccnc32)CC[NH+](Cc2ccccc2)CC1 ZINC000397649610 1316405422 /nfs/dbraw/zinc/40/54/22/1316405422.db2.gz WGMKTHOYBUISHD-LJQANCHMSA-N 1 3 337.467 2.686 10 0 EFAEHO CC/C=C\CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCC[N@@H+](CCC)C1 ZINC001264368512 1316606661 /nfs/dbraw/zinc/60/66/61/1316606661.db2.gz GSYCODHNCDKHEV-PWBPZBFBSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCC[N@H+](CCC)C1 ZINC001264368512 1316606662 /nfs/dbraw/zinc/60/66/62/1316606662.db2.gz GSYCODHNCDKHEV-PWBPZBFBSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CC2=CCCCC2)C1)N(C)C ZINC001264487300 1316619841 /nfs/dbraw/zinc/61/98/41/1316619841.db2.gz YWEZYGGRIXXHDE-OTWHNJEPSA-N 1 3 335.536 2.948 10 0 EFAEHO C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@H]1CC[NH2+]CCC(C)(C)C ZINC001264517630 1316626730 /nfs/dbraw/zinc/62/67/30/1316626730.db2.gz IRUKXVWWCFGGQG-WBVHZDCISA-N 1 3 334.508 2.995 10 0 EFAEHO C[C@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@H]1CC[NH2+]CCC(C)(C)C ZINC001264517629 1316626894 /nfs/dbraw/zinc/62/68/94/1316626894.db2.gz IRUKXVWWCFGGQG-RDJZCZTQSA-N 1 3 334.508 2.995 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]CCc1ccccc1)N(C)C ZINC001264559791 1316631838 /nfs/dbraw/zinc/63/18/38/1316631838.db2.gz QUERGROJPKICSL-HOJAQTOUSA-N 1 3 345.531 2.786 10 0 EFAEHO CC[C@@]1(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CCC[NH2+]C1 ZINC000390767830 1316673855 /nfs/dbraw/zinc/67/38/55/1316673855.db2.gz GOEXHRMPKDJGID-AZUAARDMSA-N 1 3 329.488 2.547 10 0 EFAEHO Cc1cc(C[N@@H+](C)CCCNC(=O)CN2CC[C@@H](C)C2)c(C)s1 ZINC001265037280 1316696937 /nfs/dbraw/zinc/69/69/37/1316696937.db2.gz UASBXPLRVSVLTH-CQSZACIVSA-N 1 3 337.533 2.645 10 0 EFAEHO Cc1cc(C[N@H+](C)CCCNC(=O)CN2CC[C@@H](C)C2)c(C)s1 ZINC001265037280 1316696939 /nfs/dbraw/zinc/69/69/39/1316696939.db2.gz UASBXPLRVSVLTH-CQSZACIVSA-N 1 3 337.533 2.645 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@H+](C)Cc1cccc2cccnc21 ZINC001265073381 1316711825 /nfs/dbraw/zinc/71/18/25/1316711825.db2.gz ZFXZSIKKZBAZJP-UHFFFAOYSA-N 1 3 342.487 2.513 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@@H+](C)Cc1cccc2cccnc21 ZINC001265073381 1316711828 /nfs/dbraw/zinc/71/18/28/1316711828.db2.gz ZFXZSIKKZBAZJP-UHFFFAOYSA-N 1 3 342.487 2.513 10 0 EFAEHO C[C@H]([NH2+]CCCC1CCC1)[C@@H]1CCCCN1C(=O)Cc1c[nH]cn1 ZINC001265088211 1316716984 /nfs/dbraw/zinc/71/69/84/1316716984.db2.gz AUFHOSKDJCNJGQ-YJBOKZPZSA-N 1 3 332.492 2.892 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)C1CC[NH+](C(C)C)CC1 ZINC001265141304 1316735210 /nfs/dbraw/zinc/73/52/10/1316735210.db2.gz QKRCYRKQGORIQH-UITAMQMPSA-N 1 3 329.916 2.688 10 0 EFAEHO CCN(CCCNC(=O)[C@@H]1CC[N@H+](C)C1)[C@H](C)c1ccccc1F ZINC001265146425 1316737879 /nfs/dbraw/zinc/73/78/79/1316737879.db2.gz XUUGRMQMFWQYBR-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCCNC(=O)[C@@H]1CC[N@@H+](C)C1)[C@H](C)c1ccccc1F ZINC001265146425 1316737883 /nfs/dbraw/zinc/73/78/83/1316737883.db2.gz XUUGRMQMFWQYBR-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](CC)Cc1cnccc1C ZINC001265147534 1316738157 /nfs/dbraw/zinc/73/81/57/1316738157.db2.gz ANTUABYIVHDDPS-IBGZPJMESA-N 1 3 346.519 2.593 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](CC)Cc1cnccc1C ZINC001265147534 1316738159 /nfs/dbraw/zinc/73/81/59/1316738159.db2.gz ANTUABYIVHDDPS-IBGZPJMESA-N 1 3 346.519 2.593 10 0 EFAEHO C[C@H](c1ccccc1F)[N@H+](CCCNC(=O)[C@H]1CCCN1C)C1CC1 ZINC001265155800 1316741759 /nfs/dbraw/zinc/74/17/59/1316741759.db2.gz DZJDHISIUIGSNP-DNVCBOLYSA-N 1 3 347.478 2.952 10 0 EFAEHO C[C@H](c1ccccc1F)[N@@H+](CCCNC(=O)[C@H]1CCCN1C)C1CC1 ZINC001265155800 1316741760 /nfs/dbraw/zinc/74/17/60/1316741760.db2.gz DZJDHISIUIGSNP-DNVCBOLYSA-N 1 3 347.478 2.952 10 0 EFAEHO CCCCC[N@@H+]1CCC[C@@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001265224771 1316759144 /nfs/dbraw/zinc/75/91/44/1316759144.db2.gz KCBSOHSOMLXZAU-APWZRJJASA-N 1 3 341.515 2.970 10 0 EFAEHO CCCCC[N@H+]1CCC[C@@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001265224771 1316759146 /nfs/dbraw/zinc/75/91/46/1316759146.db2.gz KCBSOHSOMLXZAU-APWZRJJASA-N 1 3 341.515 2.970 10 0 EFAEHO CCCCC[N@@H+]1CCC[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001265224772 1316759363 /nfs/dbraw/zinc/75/93/63/1316759363.db2.gz KCBSOHSOMLXZAU-LPHOPBHVSA-N 1 3 341.515 2.970 10 0 EFAEHO CCCCC[N@H+]1CCC[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001265224772 1316759366 /nfs/dbraw/zinc/75/93/66/1316759366.db2.gz KCBSOHSOMLXZAU-LPHOPBHVSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCN(CCCCCF)C1)[NH+]1CCCCC1 ZINC001265320090 1316780866 /nfs/dbraw/zinc/78/08/66/1316780866.db2.gz XSGZVWOHXGYESI-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@H+](CCCCCF)C1)N1CCCCC1 ZINC001265320090 1316780868 /nfs/dbraw/zinc/78/08/68/1316780868.db2.gz XSGZVWOHXGYESI-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC[N@@H+](CCCCCF)C1)N1CCCCC1 ZINC001265320090 1316780870 /nfs/dbraw/zinc/78/08/70/1316780870.db2.gz XSGZVWOHXGYESI-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCCC[NH2+][C@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001265447087 1316807394 /nfs/dbraw/zinc/80/73/94/1316807394.db2.gz YJLCEBROYJQHRW-MAUKXSAKSA-N 1 3 327.488 2.580 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N1CC[C@H](NCc2ccccc2F)C1 ZINC001265461263 1316808818 /nfs/dbraw/zinc/80/88/18/1316808818.db2.gz MLKYKDKLPMCLDK-SFHVURJKSA-N 1 3 347.478 2.782 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CCCCCF)N(C)C ZINC001265515976 1316816599 /nfs/dbraw/zinc/81/65/99/1316816599.db2.gz PAUVDDBULDHVDY-NPYXIHBLSA-N 1 3 327.488 2.578 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCCCF)N(C)C ZINC001265515976 1316816602 /nfs/dbraw/zinc/81/66/02/1316816602.db2.gz PAUVDDBULDHVDY-NPYXIHBLSA-N 1 3 327.488 2.578 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1C[C@@H]([NH2+]CCCc2ccsc2)C1 ZINC001265539133 1316822750 /nfs/dbraw/zinc/82/27/50/1316822750.db2.gz YMJAHZZDMAABJN-KSZLIROESA-N 1 3 349.544 2.790 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H](C[NH2+]CCCC(C)(C)C)C2)C1 ZINC001265623785 1316837254 /nfs/dbraw/zinc/83/72/54/1316837254.db2.gz DTUWOTAYRFNFPZ-QZTJIDSGSA-N 1 3 337.552 2.983 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)NC[C@H]2CCCCN2CCCCC(F)(F)F)C1 ZINC001265657449 1316846382 /nfs/dbraw/zinc/84/63/82/1316846382.db2.gz CYAOIFMNMRITIK-HUUCEWRRSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)NC[C@H]2CCCCN2CCCCC(F)(F)F)C1 ZINC001265657449 1316846384 /nfs/dbraw/zinc/84/63/84/1316846384.db2.gz CYAOIFMNMRITIK-HUUCEWRRSA-N 1 3 349.441 2.641 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@H]1C[NH2+]CCc1ccccc1F)N(C)C ZINC001265681436 1316852756 /nfs/dbraw/zinc/85/27/56/1316852756.db2.gz ADILGVXAVQXSOD-HKUYNNGSSA-N 1 3 349.494 2.679 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@H]1C[NH2+]CCc1cccs1)N(C)C ZINC001265682620 1316853244 /nfs/dbraw/zinc/85/32/44/1316853244.db2.gz VKMKMIHDUYMCOP-RDJZCZTQSA-N 1 3 337.533 2.602 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]CCCc1cccc(F)c1 ZINC001265774828 1316875757 /nfs/dbraw/zinc/87/57/57/1316875757.db2.gz JZIORPOMFOYHRQ-LPHOPBHVSA-N 1 3 349.494 2.725 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCCc1ccsc1 ZINC001265808944 1316880964 /nfs/dbraw/zinc/88/09/64/1316880964.db2.gz OHBGANHRANOGQR-OAHLLOKOSA-N 1 3 337.533 2.649 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001265923827 1316915611 /nfs/dbraw/zinc/91/56/11/1316915611.db2.gz WYNZXCHHFVTZJP-IRXDYDNUSA-N 1 3 347.503 2.536 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)CCCNC(=O)CN2CC[C@H](C)C2)c1 ZINC001265923827 1316915613 /nfs/dbraw/zinc/91/56/13/1316915613.db2.gz WYNZXCHHFVTZJP-IRXDYDNUSA-N 1 3 347.503 2.536 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCCC[N@H+](C)CCc1ccccc1 ZINC001265933365 1316919447 /nfs/dbraw/zinc/91/94/47/1316919447.db2.gz KPOYBOWLLLRJEK-HXUWFJFHSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCCC[N@@H+](C)CCc1ccccc1 ZINC001265933365 1316919449 /nfs/dbraw/zinc/91/94/49/1316919449.db2.gz KPOYBOWLLLRJEK-HXUWFJFHSA-N 1 3 345.531 2.930 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](C)Cc1ccc(F)cc1 ZINC001265978569 1316936573 /nfs/dbraw/zinc/93/65/73/1316936573.db2.gz QYEVYHPPDWZQHD-GOSISDBHSA-N 1 3 335.467 2.638 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](C)Cc1ccc(F)cc1 ZINC001265978569 1316936575 /nfs/dbraw/zinc/93/65/75/1316936575.db2.gz QYEVYHPPDWZQHD-GOSISDBHSA-N 1 3 335.467 2.638 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](C[NH2+]CC2=CCCCC2)C1)CC(C)(C)C ZINC001266016147 1316954476 /nfs/dbraw/zinc/95/44/76/1316954476.db2.gz STDUASPOXYWACW-SFHVURJKSA-N 1 3 335.536 2.903 10 0 EFAEHO CC[N@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CCC1CC1 ZINC001266082692 1317007288 /nfs/dbraw/zinc/00/72/88/1317007288.db2.gz MUVPHBCRJNDZOV-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[N@@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CCC1CC1 ZINC001266082692 1317007295 /nfs/dbraw/zinc/00/72/95/1317007295.db2.gz MUVPHBCRJNDZOV-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](C(=O)N[C@]1(C)CCN(Cc2ccccc2)C1)[NH+](CC)CC ZINC001368171899 1339234235 /nfs/dbraw/zinc/23/42/35/1339234235.db2.gz HSPITLOLDZJANY-UYAOXDASSA-N 1 3 331.504 2.888 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](CC)[C@@H]1CCc2c1cccc2F)N(C)C ZINC001266100869 1317036192 /nfs/dbraw/zinc/03/61/92/1317036192.db2.gz LJAFXUUUBJXFQB-RBUKOAKNSA-N 1 3 349.494 2.981 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](CC)[C@@H]1CCc2c1cccc2F)N(C)C ZINC001266100869 1317036202 /nfs/dbraw/zinc/03/62/02/1317036202.db2.gz LJAFXUUUBJXFQB-RBUKOAKNSA-N 1 3 349.494 2.981 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@H+](CC2CC(C)(C)C2)C2CC2)CCC1 ZINC001266141789 1317091923 /nfs/dbraw/zinc/09/19/23/1317091923.db2.gz UTMYCNQUBSHSEV-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(C)C1(C(=O)NCCC[N@@H+](CC2CC(C)(C)C2)C2CC2)CCC1 ZINC001266141789 1317091931 /nfs/dbraw/zinc/09/19/31/1317091931.db2.gz UTMYCNQUBSHSEV-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)C2CCC2)C[C@@H]1C[NH2+]CCCC(C)(C)C ZINC001279115978 1317193358 /nfs/dbraw/zinc/19/33/58/1317193358.db2.gz XXXHNQDUBCKPAR-SJORKVTESA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[C@H](C[NH2+]CCF)CC1)N1CCCCC1 ZINC001279253956 1317218886 /nfs/dbraw/zinc/21/88/86/1317218886.db2.gz KQHMUFOGTNGUMX-QAQDUYKDSA-N 1 3 341.515 2.733 10 0 EFAEHO C[C@@H](c1ccccc1)[N@H+]1CC=C(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001279573806 1317306617 /nfs/dbraw/zinc/30/66/17/1317306617.db2.gz HTCFSQHSTFUGES-KRWDZBQOSA-N 1 3 341.499 2.980 10 0 EFAEHO C[C@@H](c1ccccc1)[N@@H+]1CC=C(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001279573806 1317306625 /nfs/dbraw/zinc/30/66/25/1317306625.db2.gz HTCFSQHSTFUGES-KRWDZBQOSA-N 1 3 341.499 2.980 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](Cc2ccc(CF)cc2)CC1 ZINC001279676028 1317356964 /nfs/dbraw/zinc/35/69/64/1317356964.db2.gz TYGQCZPONLIRQZ-UHFFFAOYSA-N 1 3 347.478 2.746 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](Cc2ccc(CF)cc2)CC1 ZINC001279676028 1317356973 /nfs/dbraw/zinc/35/69/73/1317356973.db2.gz TYGQCZPONLIRQZ-UHFFFAOYSA-N 1 3 347.478 2.746 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1=CC[N@H+](Cc2ccccc2)CC1)N(C)C ZINC001279676196 1317357396 /nfs/dbraw/zinc/35/73/96/1317357396.db2.gz XNZVWUYSXMIIQG-LJQANCHMSA-N 1 3 329.488 2.521 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1=CC[N@@H+](Cc2ccccc2)CC1)N(C)C ZINC001279676196 1317357405 /nfs/dbraw/zinc/35/74/05/1317357405.db2.gz XNZVWUYSXMIIQG-LJQANCHMSA-N 1 3 329.488 2.521 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](C[C@H]2CCC(F)(F)C2)CC1 ZINC001279676293 1317357806 /nfs/dbraw/zinc/35/78/06/1317357806.db2.gz YXQKXILQHACTMH-INIZCTEOSA-N 1 3 343.462 2.512 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](C[C@H]2CCC(F)(F)C2)CC1 ZINC001279676293 1317357815 /nfs/dbraw/zinc/35/78/15/1317357815.db2.gz YXQKXILQHACTMH-INIZCTEOSA-N 1 3 343.462 2.512 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]C/C=C/c2ccccc2)C1 ZINC001280152272 1317465313 /nfs/dbraw/zinc/46/53/13/1317465313.db2.gz KMDFBKLFVSPJST-PEABSYDSSA-N 1 3 341.499 2.622 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2cc(F)ccc2C)C1)N(C)C ZINC001280263468 1317490938 /nfs/dbraw/zinc/49/09/38/1317490938.db2.gz HOAWZMSRJORJOE-VQIMIIECSA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@@H](F)CC[NH2+]CC[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001280307569 1317503091 /nfs/dbraw/zinc/50/30/91/1317503091.db2.gz MUHSUESGSMMLAX-SJORKVTESA-N 1 3 349.494 2.938 10 0 EFAEHO CC(C)CCC[NH2+]CC[C@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001318830467 1328714065 /nfs/dbraw/zinc/71/40/65/1328714065.db2.gz GMFZYMKVOFDQGX-RBUKOAKNSA-N 1 3 337.552 2.983 10 0 EFAEHO CCC/C=C/CCN1CC[C@@H]1CN(C)C(=O)CC1CC[NH+](C)CC1 ZINC001316605465 1317714451 /nfs/dbraw/zinc/71/44/51/1317714451.db2.gz XRXCZVJAMIIXMT-OVKVCFKUSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001316606239 1317803550 /nfs/dbraw/zinc/80/35/50/1317803550.db2.gz NFSIJSDJZXPFRF-YBXURTSQSA-N 1 3 335.536 2.996 10 0 EFAEHO CCC/C=C\CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001316606239 1317803562 /nfs/dbraw/zinc/80/35/62/1317803562.db2.gz NFSIJSDJZXPFRF-YBXURTSQSA-N 1 3 335.536 2.996 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC(CC[NH2+]CCc2cccs2)CC1 ZINC001318875052 1328729572 /nfs/dbraw/zinc/72/95/72/1328729572.db2.gz PCAYWMAKZKWKLM-GOSISDBHSA-N 1 3 349.544 2.603 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@@]2(CCN(C/C=C/Cl)C2)C1 ZINC001281098261 1318012427 /nfs/dbraw/zinc/01/24/27/1318012427.db2.gz CQUPCWSSUOHAAE-OPUMOTSWSA-N 1 3 341.927 2.785 10 0 EFAEHO CC[C@H](C)C[NH2+]CCC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001318929954 1328743882 /nfs/dbraw/zinc/74/38/82/1328743882.db2.gz VFRXYDHAVZJCPJ-WMZOPIPTSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccc(C[NH2+]CCC3CC3)cc2)C1 ZINC001319000676 1328760446 /nfs/dbraw/zinc/76/04/46/1328760446.db2.gz UDQGUOIDDHPTPH-MRXNPFEDSA-N 1 3 329.488 2.534 10 0 EFAEHO Cc1cccc(CCC[NH2+]C[C@H]2CCCN2C(=O)[C@@H]2CCCN2C)c1 ZINC001319057883 1328771445 /nfs/dbraw/zinc/77/14/45/1328771445.db2.gz NVSQMJGZANYSJI-UXHICEINSA-N 1 3 343.515 2.602 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1CCCCCF ZINC001281666367 1318533448 /nfs/dbraw/zinc/53/34/48/1318533448.db2.gz XKFKVRPBLIBKOE-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)CC[N@H+]1CCCCCF ZINC001281666367 1318533454 /nfs/dbraw/zinc/53/34/54/1318533454.db2.gz XKFKVRPBLIBKOE-HOTGVXAUSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@H]1C[NH2+]CCCc1ccccc1)N(C)C ZINC001281890630 1318616447 /nfs/dbraw/zinc/61/64/47/1318616447.db2.gz VZQGTSURCXMTCT-PMACEKPBSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)=CC[N@H+]1C[C@@H]2CC[C@@H](NC(=O)C3(N(C)C)CCC3)C[C@H]2C1 ZINC001282947255 1319213927 /nfs/dbraw/zinc/21/39/27/1319213927.db2.gz JYVSQDBBYIYAAJ-OKZBNKHCSA-N 1 3 333.520 2.654 10 0 EFAEHO CC(C)=CC[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)C3(N(C)C)CCC3)C[C@H]2C1 ZINC001282947255 1319213934 /nfs/dbraw/zinc/21/39/34/1319213934.db2.gz JYVSQDBBYIYAAJ-OKZBNKHCSA-N 1 3 333.520 2.654 10 0 EFAEHO CCCCC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3nc[nH]c3C)C[C@@H]2C1 ZINC001282959562 1319218812 /nfs/dbraw/zinc/21/88/12/1319218812.db2.gz VFQPWNUGGPZAOP-BBWFWOEESA-N 1 3 332.492 2.668 10 0 EFAEHO CCCCC[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3nc[nH]c3C)C[C@@H]2C1 ZINC001282959562 1319218820 /nfs/dbraw/zinc/21/88/20/1319218820.db2.gz VFQPWNUGGPZAOP-BBWFWOEESA-N 1 3 332.492 2.668 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CCCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001282973326 1319230047 /nfs/dbraw/zinc/23/00/47/1319230047.db2.gz SYACRKJKTHHRJF-ZMBJWTFHSA-N 1 3 347.547 2.999 10 0 EFAEHO CCC/C=C/CC[N@H+]1CCCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001282973326 1319230058 /nfs/dbraw/zinc/23/00/58/1319230058.db2.gz SYACRKJKTHHRJF-ZMBJWTFHSA-N 1 3 347.547 2.999 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CC2(C1)CCCN(Cc1ccsc1)C2 ZINC001282976959 1319232983 /nfs/dbraw/zinc/23/29/83/1319232983.db2.gz AINIYSPQIPESIU-UHFFFAOYSA-N 1 3 349.544 2.904 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@H](C[NH2+]CCc2cccs2)C1 ZINC001283110822 1319335784 /nfs/dbraw/zinc/33/57/84/1319335784.db2.gz IZSIMKCGQVTMJK-QAETUUGQSA-N 1 3 349.544 2.648 10 0 EFAEHO CC1CCN(CC(=O)N2CCC([N@H+](C)CCCCCF)CC2)CC1 ZINC001283334815 1319568084 /nfs/dbraw/zinc/56/80/84/1319568084.db2.gz NPPNYSUDHJBVLJ-UHFFFAOYSA-N 1 3 341.515 2.781 10 0 EFAEHO CC1CCN(CC(=O)N2CCC([N@@H+](C)CCCCCF)CC2)CC1 ZINC001283334815 1319568090 /nfs/dbraw/zinc/56/80/90/1319568090.db2.gz NPPNYSUDHJBVLJ-UHFFFAOYSA-N 1 3 341.515 2.781 10 0 EFAEHO C[C@@H](CN(C)C(=O)Cc1c[nH]cn1)[NH2+]Cc1cc2ccccc2s1 ZINC001283680966 1319954442 /nfs/dbraw/zinc/95/44/42/1319954442.db2.gz RDGZNNIUKPIBPM-ZDUSSCGKSA-N 1 3 342.468 2.804 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCCCCF ZINC001283681139 1319954988 /nfs/dbraw/zinc/95/49/88/1319954988.db2.gz WIOMNDPFOYZQRJ-YJBOKZPZSA-N 1 3 347.494 2.775 10 0 EFAEHO C[C@@H]1[C@@H](NCC=C(Cl)Cl)CCN1C(=O)CCCC[NH+](C)C ZINC001283925093 1320095579 /nfs/dbraw/zinc/09/55/79/1320095579.db2.gz BTINUYNGXHHDGF-OLZOCXBDSA-N 1 3 336.307 2.616 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CCCCc2ccccc2)CN1C(=O)Cc1c[nH]cn1 ZINC001284015399 1320147873 /nfs/dbraw/zinc/14/78/73/1320147873.db2.gz RSNFBWUUKGIDSW-VQIMIIECSA-N 1 3 340.471 2.554 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H]1C[C@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001284033085 1320158291 /nfs/dbraw/zinc/15/82/91/1320158291.db2.gz NPSDYIPPNYCTPS-AZUAARDMSA-N 1 3 345.531 2.847 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H](C[NH2+]CC=C(Cl)Cl)C1 ZINC001284241939 1320282155 /nfs/dbraw/zinc/28/21/55/1320282155.db2.gz LULCATUVYSXUBL-CHWSQXEVSA-N 1 3 336.307 2.522 10 0 EFAEHO CC(C)(C)[C@@H](CNCC=C(Cl)Cl)NC(=O)C12CC[NH+](CC1)C2 ZINC001284642245 1320454042 /nfs/dbraw/zinc/45/40/42/1320454042.db2.gz MTCPKKRMOPWLJQ-GFCCVEGCSA-N 1 3 348.318 2.522 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1CC=C(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001284920268 1320596489 /nfs/dbraw/zinc/59/64/89/1320596489.db2.gz DKXVOPJJZHHZMR-KRWDZBQOSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1CC=C(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001284920268 1320596497 /nfs/dbraw/zinc/59/64/97/1320596497.db2.gz DKXVOPJJZHHZMR-KRWDZBQOSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)=CC[NH2+][C@H]1C[C@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001316636914 1320653094 /nfs/dbraw/zinc/65/30/94/1320653094.db2.gz SHNZMRXNLBMIMK-BXWFABGCSA-N 1 3 339.499 2.650 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H](C)C[NH2+]C/C=C\c1ccccc1)N(C)C ZINC001319563703 1328919071 /nfs/dbraw/zinc/91/90/71/1328919071.db2.gz WTJXDXVRTWGUEC-FHMCCYLLSA-N 1 3 331.504 2.723 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]CCc1ccc(C)cc1 ZINC001319594049 1328924084 /nfs/dbraw/zinc/92/40/84/1328924084.db2.gz RCJWNUIBGNDYDM-AZUAARDMSA-N 1 3 345.531 2.848 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@H]1CC[NH2+]Cc1cccnc1C)N(C)C ZINC001319766984 1328981739 /nfs/dbraw/zinc/98/17/39/1328981739.db2.gz OCZAMTPSLPJQFJ-RBUKOAKNSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@@H]1CC[NH2+]Cc1ccsc1)N(C)C ZINC001319788756 1328990098 /nfs/dbraw/zinc/99/00/98/1328990098.db2.gz SFTKTHXWFCPJEY-IAGOWNOFSA-N 1 3 337.533 2.949 10 0 EFAEHO CC(C)=CCN(C)CCN(C)C(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001319999407 1329053698 /nfs/dbraw/zinc/05/36/98/1329053698.db2.gz FUZRPSHHDFLGJX-SFHVURJKSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)=CCN(C)CCN(C)C(=O)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001319999407 1329053700 /nfs/dbraw/zinc/05/37/00/1329053700.db2.gz FUZRPSHHDFLGJX-SFHVURJKSA-N 1 3 335.536 2.997 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21)CC1=CCCCC1 ZINC001320058300 1329067228 /nfs/dbraw/zinc/06/72/28/1329067228.db2.gz LWLSPPPLFVWSLC-OALUTQOASA-N 1 3 333.520 2.894 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21)CC1=CCCCC1 ZINC001320058300 1329067234 /nfs/dbraw/zinc/06/72/34/1329067234.db2.gz LWLSPPPLFVWSLC-OALUTQOASA-N 1 3 333.520 2.894 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)[C@H](C)[NH+]2CCCCCC2)c1 ZINC001491599585 1323739175 /nfs/dbraw/zinc/73/91/75/1323739175.db2.gz ADPICZOGGFZSES-IRXDYDNUSA-N 1 3 349.494 2.993 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]Cc1ccc(C2CCC2)cc1 ZINC001491681992 1323786650 /nfs/dbraw/zinc/78/66/50/1323786650.db2.gz HTNFPWRUHBMIQM-MRXNPFEDSA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+][C@@H](C)c1cccc(Cl)c1 ZINC001491685107 1323789737 /nfs/dbraw/zinc/78/97/37/1323789737.db2.gz XRONUPZHKFJBEV-KBPBESRZSA-N 1 3 325.884 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+][C@H](C)c1cccc(Cl)c1 ZINC001491685109 1323790158 /nfs/dbraw/zinc/79/01/58/1323790158.db2.gz XRONUPZHKFJBEV-UONOGXRCSA-N 1 3 325.884 2.836 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)[C@H]1CCCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001491924393 1324039463 /nfs/dbraw/zinc/03/94/63/1324039463.db2.gz BXZMOCRZQOIAEV-SJORKVTESA-N 1 3 341.515 2.922 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)[C@H]1CCCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001491924393 1324039469 /nfs/dbraw/zinc/03/94/69/1324039469.db2.gz BXZMOCRZQOIAEV-SJORKVTESA-N 1 3 341.515 2.922 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@H+](C)CC2CC3(CCC3)C2)C1 ZINC001491964911 1324085338 /nfs/dbraw/zinc/08/53/38/1324085338.db2.gz DHCNTAGIIHZBED-GOSISDBHSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@@H+](C)CC2CC3(CCC3)C2)C1 ZINC001491964911 1324085343 /nfs/dbraw/zinc/08/53/43/1324085343.db2.gz DHCNTAGIIHZBED-GOSISDBHSA-N 1 3 335.536 2.830 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCCC[C@@H]2CCC[N@@H+]2CCF)c1 ZINC001492177096 1324316180 /nfs/dbraw/zinc/31/61/80/1324316180.db2.gz CHARJLONRBVXDX-GOSISDBHSA-N 1 3 335.467 2.692 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCCC[C@@H]2CCC[N@H+]2CCF)c1 ZINC001492177096 1324316189 /nfs/dbraw/zinc/31/61/89/1324316189.db2.gz CHARJLONRBVXDX-GOSISDBHSA-N 1 3 335.467 2.692 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)c1 ZINC001492303293 1324405898 /nfs/dbraw/zinc/40/58/98/1324405898.db2.gz JRGCRAITEPLSMU-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)c1 ZINC001492303293 1324405901 /nfs/dbraw/zinc/40/59/01/1324405901.db2.gz JRGCRAITEPLSMU-PMACEKPBSA-N 1 3 343.515 2.814 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(C)CCNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001492370149 1324459259 /nfs/dbraw/zinc/45/92/59/1324459259.db2.gz PCZWMLYUGVUTKL-OAHLLOKOSA-N 1 3 335.467 2.809 10 0 EFAEHO CN(CCNC(=O)C1(C[NH+](C)C)CC1)Cc1ccc(C2CCC2)cc1 ZINC001492389324 1324470850 /nfs/dbraw/zinc/47/08/50/1324470850.db2.gz OOIWEFDCEANPFH-UHFFFAOYSA-N 1 3 343.515 2.844 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1cccc(Cl)c1)NC(=O)CN1CC[C@@H](C)C1 ZINC001320551018 1329160634 /nfs/dbraw/zinc/16/06/34/1329160634.db2.gz ZFOZVZIKGZEDSD-CABCVRRESA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1c(C)cccc1Cl)N(C)C ZINC001320608597 1329176148 /nfs/dbraw/zinc/17/61/48/1329176148.db2.gz PFKIARHJCPSZMB-PBHICJAKSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1cc(F)ccc1Cl)N(C)C ZINC001320607034 1329176160 /nfs/dbraw/zinc/17/61/60/1329176160.db2.gz IGLFOHAXPRXHDB-WBMJQRKESA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1sccc1Cl)N(C)C ZINC001320605720 1329176318 /nfs/dbraw/zinc/17/63/18/1329176318.db2.gz DLOXWSCDFAKIOF-YPMHNXCESA-N 1 3 331.913 2.726 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1c(C)cccc1Cl)N(C)C ZINC001320608598 1329176444 /nfs/dbraw/zinc/17/64/44/1329176444.db2.gz PFKIARHJCPSZMB-RHSMWYFYSA-N 1 3 339.911 2.973 10 0 EFAEHO OC1(CCN2CCC[N@H+](Cc3ccccc3)CCOCC2)CCC1 ZINC001308107425 1324794358 /nfs/dbraw/zinc/79/43/58/1324794358.db2.gz QEYHISLAHXHZOS-UHFFFAOYSA-N 1 3 332.488 2.516 10 0 EFAEHO OC1(CCN2CCC[N@@H+](Cc3ccccc3)CCOCC2)CCC1 ZINC001308107425 1324794365 /nfs/dbraw/zinc/79/43/65/1324794365.db2.gz QEYHISLAHXHZOS-UHFFFAOYSA-N 1 3 332.488 2.516 10 0 EFAEHO C[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)[C@H](C[NH2+]C/C=C/Cl)C1 ZINC001316704927 1325050061 /nfs/dbraw/zinc/05/00/61/1325050061.db2.gz RTQBVTVLDALVNE-DODUIYEKSA-N 1 3 343.943 2.934 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)[C@H](CC)N(C)C)C[C@@H]2C1 ZINC001316757246 1325111522 /nfs/dbraw/zinc/11/15/22/1325111522.db2.gz QLYLUOZBFZDYNG-ZNGIMCQPSA-N 1 3 335.536 2.853 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)[C@H](CC)N(C)C)C[C@@H]2C1 ZINC001316757246 1325111530 /nfs/dbraw/zinc/11/15/30/1325111530.db2.gz QLYLUOZBFZDYNG-ZNGIMCQPSA-N 1 3 335.536 2.853 10 0 EFAEHO CCc1ccccc1C[N@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001316829259 1325186966 /nfs/dbraw/zinc/18/69/66/1325186966.db2.gz DJMPXTRTJIYYOB-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO CCc1ccccc1C[N@@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001316829259 1325186972 /nfs/dbraw/zinc/18/69/72/1325186972.db2.gz DJMPXTRTJIYYOB-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CCCC[C@H]1C[NH2+]CCCF)N1CCCCC1 ZINC001322328563 1329447372 /nfs/dbraw/zinc/44/73/72/1329447372.db2.gz CVPCRBZIUOPCFC-DLBZAZTESA-N 1 3 341.515 2.875 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1c(C)cccc1C ZINC001316902195 1325304655 /nfs/dbraw/zinc/30/46/55/1325304655.db2.gz GSLGPFKMCBETTB-QGZVFWFLSA-N 1 3 345.531 2.973 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1c(C)cccc1C ZINC001316902195 1325304663 /nfs/dbraw/zinc/30/46/63/1325304663.db2.gz GSLGPFKMCBETTB-QGZVFWFLSA-N 1 3 345.531 2.973 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC23CC[NH+](CCCCCF)CC3)CCC1 ZINC001316998545 1325466732 /nfs/dbraw/zinc/46/67/32/1325466732.db2.gz OHZLEYHMVRORMT-MRXNPFEDSA-N 1 3 339.499 2.581 10 0 EFAEHO CCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC1CC[NH+](C)CC1 ZINC001317050987 1325522711 /nfs/dbraw/zinc/52/27/11/1325522711.db2.gz YBGMBTRRAFSWME-KDURUIRLSA-N 1 3 335.536 2.974 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CC[C@H](NCc2cc3ccccc3o2)C1 ZINC001317067475 1325538306 /nfs/dbraw/zinc/53/83/06/1325538306.db2.gz ZWKNAPZAFYXTFX-KRWDZBQOSA-N 1 3 343.471 2.855 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NC/C=C\C[NH2+]Cc1ccc2ccccc2c1 ZINC001320996827 1329329091 /nfs/dbraw/zinc/32/90/91/1329329091.db2.gz GEGGTUNHOZKBSW-BBIZLLLXSA-N 1 3 337.467 2.696 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C/C=C\CNC(=O)CN(C)C1CCC1 ZINC001321095466 1329342162 /nfs/dbraw/zinc/34/21/62/1329342162.db2.gz IUEZMWCOMUBCAO-TUYSUELWSA-N 1 3 329.488 2.802 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]C/C=C/CNC(=O)CN(C)C1CCC1 ZINC001321095460 1329342171 /nfs/dbraw/zinc/34/21/71/1329342171.db2.gz IUEZMWCOMUBCAO-DKRLNXSXSA-N 1 3 329.488 2.802 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)CC[C@@H]2CCC[N@H+]2C)cs1 ZINC001321096495 1329342626 /nfs/dbraw/zinc/34/26/26/1329342626.db2.gz IKLDQWQAXWDFDY-LIMHQNJXSA-N 1 3 335.517 2.693 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)CC[C@@H]2CCC[N@@H+]2C)cs1 ZINC001321096495 1329342629 /nfs/dbraw/zinc/34/26/29/1329342629.db2.gz IKLDQWQAXWDFDY-LIMHQNJXSA-N 1 3 335.517 2.693 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NC/C=C\C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC001321189457 1329354275 /nfs/dbraw/zinc/35/42/75/1329354275.db2.gz MXPBEZDONUZCNL-TUFZTROESA-N 1 3 345.462 2.559 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H](C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001317157358 1327652769 /nfs/dbraw/zinc/65/27/69/1327652769.db2.gz IICUETTWHQDUGO-IDVICZFGSA-N 1 3 343.515 2.868 10 0 EFAEHO CCC/C=C\CC[NH2+]C[C@@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001317157962 1327653012 /nfs/dbraw/zinc/65/30/12/1327653012.db2.gz NWNJHFJBMWYPLY-DSQZMVHQSA-N 1 3 335.536 2.903 10 0 EFAEHO C[C@@H](NC/C=C/CNC(=O)CC1CC[NH+](C)CC1)c1ccc(F)cc1 ZINC001321279320 1329367183 /nfs/dbraw/zinc/36/71/83/1329367183.db2.gz IRGWFIDNKNLNOO-QDLOVBKTSA-N 1 3 347.478 2.881 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H]1CCC[N@H+](CC2=CCCCC2)C1 ZINC001317205531 1327740264 /nfs/dbraw/zinc/74/02/64/1327740264.db2.gz PRRGPACFARKGIO-YJBOKZPZSA-N 1 3 344.503 2.978 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](CC2=CCCCC2)C1 ZINC001317205531 1327740271 /nfs/dbraw/zinc/74/02/71/1327740271.db2.gz PRRGPACFARKGIO-YJBOKZPZSA-N 1 3 344.503 2.978 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CCC([NH2+]CCCc2ccccc2)CC1 ZINC001317221309 1327766633 /nfs/dbraw/zinc/76/66/33/1327766633.db2.gz FDGHOAURMODUIF-UHFFFAOYSA-N 1 3 345.531 2.976 10 0 EFAEHO CN(CC(=O)N1CC[C@H]([NH2+]CCCC(C)(C)C)C1)CC(C)(C)C ZINC001317305831 1327838496 /nfs/dbraw/zinc/83/84/96/1327838496.db2.gz NITLIIRWLPQMNU-INIZCTEOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](C[NH2+]CCCc2cccc(C)c2)C1)N(C)C ZINC001317337252 1327866448 /nfs/dbraw/zinc/86/64/48/1327866448.db2.gz KJXRZSKZFBQVBX-PMACEKPBSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001317346450 1327876546 /nfs/dbraw/zinc/87/65/46/1327876546.db2.gz VALCSZVPSHGZSE-GOSISDBHSA-N 1 3 329.488 2.766 10 0 EFAEHO CC[C@@H]([NH2+]C/C=C\CNC(=O)CN1CCCC1)c1ccc(F)cc1 ZINC001321401096 1329382817 /nfs/dbraw/zinc/38/28/17/1329382817.db2.gz GDKFHYTVJQAGCJ-DDKKJVIOSA-N 1 3 333.451 2.635 10 0 EFAEHO CCC[NH2+]CCc1ccc(CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001317367100 1327907691 /nfs/dbraw/zinc/90/76/91/1327907691.db2.gz UQEODIPXQQBNLX-LJQANCHMSA-N 1 3 331.504 2.718 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[NH2+]Cc2cccc(C(F)F)c2)C1 ZINC001317625733 1328206349 /nfs/dbraw/zinc/20/63/49/1328206349.db2.gz IISLSIGGAZXKAV-AWEZNQCLSA-N 1 3 339.430 2.514 10 0 EFAEHO CC(C)=CC[NH2+][C@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001317684702 1328286926 /nfs/dbraw/zinc/28/69/26/1328286926.db2.gz YYWXCAMRBWAGLI-GOSISDBHSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)=CCN[C@@H](CNC(=O)[C@H]1C[NH+]2CCC1CC2)c1ccccc1 ZINC001317718345 1328328058 /nfs/dbraw/zinc/32/80/58/1328328058.db2.gz NDMOCGVFXAGSAA-PMACEKPBSA-N 1 3 341.499 2.742 10 0 EFAEHO CC(C)=CCN[C@H](CNC(=O)[C@@H](C(C)C)[NH+](C)C)c1ccccc1 ZINC001317724415 1328333453 /nfs/dbraw/zinc/33/34/53/1328333453.db2.gz LWPBPKRFWAMILM-RTBURBONSA-N 1 3 331.504 2.986 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+]CC1CCCCCC1)N(C)C ZINC001322683736 1329479424 /nfs/dbraw/zinc/47/94/24/1329479424.db2.gz USZXNYDKDIAPQC-GOSISDBHSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1C[NH+](CCC2=CCCCC2)C1 ZINC001318176076 1328513629 /nfs/dbraw/zinc/51/36/29/1328513629.db2.gz HXWPFKRMLOCSSN-CALCHBBNSA-N 1 3 333.520 2.798 10 0 EFAEHO CC(C)=CCN(C)C[C@@H](C)NC(=O)c1ccccc1CC[NH+](C)C ZINC001322210918 1329438173 /nfs/dbraw/zinc/43/81/73/1329438173.db2.gz QJLVMZKYOGSFQY-QGZVFWFLSA-N 1 3 331.504 2.807 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+]Cc1cccc(F)c1Cl ZINC001322843509 1329493462 /nfs/dbraw/zinc/49/34/62/1329493462.db2.gz CECWJLLHVXPIOO-UHFFFAOYSA-N 1 3 343.874 2.757 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CC2CC(F)(F)C2)CC1(C)C ZINC001381141874 1348105560 /nfs/dbraw/zinc/10/55/60/1348105560.db2.gz IPUFOLCKFUBDOQ-OAHLLOKOSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CC2CC(F)(F)C2)CC1(C)C ZINC001381141874 1348105561 /nfs/dbraw/zinc/10/55/61/1348105561.db2.gz IPUFOLCKFUBDOQ-OAHLLOKOSA-N 1 3 345.478 2.589 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001323857460 1329579298 /nfs/dbraw/zinc/57/92/98/1329579298.db2.gz IKUFVYKARZYSES-IBGZPJMESA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCCC[N@H+]1CC[C@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001323857460 1329579300 /nfs/dbraw/zinc/57/93/00/1329579300.db2.gz IKUFVYKARZYSES-IBGZPJMESA-N 1 3 335.536 2.975 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CCCc2ccccc2)C[C@H]1C ZINC001324096595 1329599410 /nfs/dbraw/zinc/59/94/10/1329599410.db2.gz CWSHSPMYHIPZLI-QUCCMNQESA-N 1 3 345.531 2.929 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001324261840 1329612079 /nfs/dbraw/zinc/61/20/79/1329612079.db2.gz SGSFHXGSXFXTFP-CYBMUJFWSA-N 1 3 336.307 2.618 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C[NH2+]C/C=C\Cl)C1CCCC1)N(C)C ZINC001324499211 1329633636 /nfs/dbraw/zinc/63/36/36/1329633636.db2.gz ZQIJGAVSYMXDEI-LWALAHDXSA-N 1 3 329.916 2.590 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2CCCCCF)N(C)C ZINC001324533950 1329637074 /nfs/dbraw/zinc/63/70/74/1329637074.db2.gz XHAOLDOOYYRYLD-SQNIBIBYSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2CCCCCF)N(C)C ZINC001324533950 1329637076 /nfs/dbraw/zinc/63/70/76/1329637076.db2.gz XHAOLDOOYYRYLD-SQNIBIBYSA-N 1 3 341.515 2.778 10 0 EFAEHO CCCC[NH2+]C[C@]1(C)CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001324790811 1329658228 /nfs/dbraw/zinc/65/82/28/1329658228.db2.gz SRQMPWHSHPZDAA-RBUKOAKNSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN3CC[C@H](C)C3)C2)cc1 ZINC001326366167 1329750443 /nfs/dbraw/zinc/75/04/43/1329750443.db2.gz ZGHIGUWUOPRPKN-AZUAARDMSA-N 1 3 343.515 2.665 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](CC[NH2+]CC3=CCCCC3)C2)C1 ZINC001326365338 1329750515 /nfs/dbraw/zinc/75/05/15/1329750515.db2.gz OZGVXHZIHUCJEQ-HKUYNNGSSA-N 1 3 333.520 2.657 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CC[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001326436878 1329756461 /nfs/dbraw/zinc/75/64/61/1329756461.db2.gz GPSNNIZCKWAHQB-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cs1 ZINC001326437260 1329756692 /nfs/dbraw/zinc/75/66/92/1329756692.db2.gz JWEBRIYLFBDQKS-INIZCTEOSA-N 1 3 337.533 2.725 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H](C)CN(C)C(=O)CN1CC[C@@H](C)C1 ZINC001382112355 1348732750 /nfs/dbraw/zinc/73/27/50/1348732750.db2.gz AKJITKVBGWLBKA-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCCCCC[NH+]1CCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)CC1 ZINC001326599303 1330325240 /nfs/dbraw/zinc/32/52/40/1330325240.db2.gz RJFQZKOEYSCDOK-SFHVURJKSA-N 1 3 335.536 2.833 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)N2CCCC[C@@H]2CNCC=C(Cl)Cl)C1 ZINC001326760068 1330360760 /nfs/dbraw/zinc/36/07/60/1330360760.db2.gz DMIBJHFGTMRISD-UONOGXRCSA-N 1 3 348.318 2.618 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)N2CCCC[C@@H]2CNCC=C(Cl)Cl)C1 ZINC001326760068 1330360763 /nfs/dbraw/zinc/36/07/63/1330360763.db2.gz DMIBJHFGTMRISD-UONOGXRCSA-N 1 3 348.318 2.618 10 0 EFAEHO CC(C)=CCN(C)C[C@H]1CCCN1C(=O)[C@@H]1CCC[N@H+]1CC(C)C ZINC001328732524 1330622625 /nfs/dbraw/zinc/62/26/25/1330622625.db2.gz GZMSYIHLGQWABV-MOPGFXCFSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)=CCN(C)C[C@H]1CCCN1C(=O)[C@@H]1CCC[N@@H+]1CC(C)C ZINC001328732524 1330622626 /nfs/dbraw/zinc/62/26/26/1330622626.db2.gz GZMSYIHLGQWABV-MOPGFXCFSA-N 1 3 335.536 2.996 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]CCCCC(F)(F)F ZINC001329053120 1330661225 /nfs/dbraw/zinc/66/12/25/1330661225.db2.gz HGEXCONNOLNTKZ-QWHCGFSZSA-N 1 3 337.430 2.686 10 0 EFAEHO C[C@@H]([NH2+]CCCc1ccsc1)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001329057419 1330661630 /nfs/dbraw/zinc/66/16/30/1330661630.db2.gz QXTPHIZGOYVSTJ-CABCVRRESA-N 1 3 337.533 2.648 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCCC2(CN(C(=O)[C@@H](C(C)C)N(C)C)C2)C1 ZINC001330512229 1330764089 /nfs/dbraw/zinc/76/40/89/1330764089.db2.gz NWEPVWHNGZFEEV-LKGOPFMKSA-N 1 3 335.536 2.853 10 0 EFAEHO CC/C=C/CC[N@H+]1CCCC2(CN(C(=O)[C@@H](C(C)C)N(C)C)C2)C1 ZINC001330512229 1330764092 /nfs/dbraw/zinc/76/40/92/1330764092.db2.gz NWEPVWHNGZFEEV-LKGOPFMKSA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)CCC[NH2+]Cc1ccccn1 ZINC001330934673 1330772479 /nfs/dbraw/zinc/77/24/79/1330772479.db2.gz XTLDPRRQBHRPAA-MJGOQNOKSA-N 1 3 346.519 2.719 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)CCC[NH2+]Cc1ccccn1 ZINC001330934670 1330772645 /nfs/dbraw/zinc/77/26/45/1330772645.db2.gz XTLDPRRQBHRPAA-IEBWSBKVSA-N 1 3 346.519 2.719 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](CCC[NH2+]C(C)C)c1ccccc1 ZINC001331175926 1330802112 /nfs/dbraw/zinc/80/21/12/1330802112.db2.gz FPSUEPQQPVBERO-KRWDZBQOSA-N 1 3 328.460 2.896 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C1CC[NH+](CC2=CCCCC2)CC1 ZINC001332972289 1331056651 /nfs/dbraw/zinc/05/66/51/1331056651.db2.gz JMGXWOORZPZCFC-OAHLLOKOSA-N 1 3 344.503 2.978 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@H+](Cc2ccc(C)c(C)c2)CC1 ZINC001333432818 1331143056 /nfs/dbraw/zinc/14/30/56/1331143056.db2.gz FGQWMRWDUWCRHM-UHFFFAOYSA-N 1 3 343.515 2.894 10 0 EFAEHO CCCN(C)CC(=O)NCC1=CC[N@@H+](Cc2ccc(C)c(C)c2)CC1 ZINC001333432818 1331143059 /nfs/dbraw/zinc/14/30/59/1331143059.db2.gz FGQWMRWDUWCRHM-UHFFFAOYSA-N 1 3 343.515 2.894 10 0 EFAEHO CCCN(C)CC(=O)NCCC[N@H+](C)[C@H]1CCCc2ccccc21 ZINC001479810369 1332449250 /nfs/dbraw/zinc/44/92/50/1332449250.db2.gz SSYYANCRMJGGPZ-IBGZPJMESA-N 1 3 331.504 2.844 10 0 EFAEHO CCCN(C)CC(=O)NCCC[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC001479810369 1332449252 /nfs/dbraw/zinc/44/92/52/1332449252.db2.gz SSYYANCRMJGGPZ-IBGZPJMESA-N 1 3 331.504 2.844 10 0 EFAEHO O=C(OC[C@H]1CC[N@@H+]1C1CCCCCC1)C1CCCN(C2CC2)C1=O ZINC001345531091 1332546343 /nfs/dbraw/zinc/54/63/43/1332546343.db2.gz NBBJGQFNWQTEGO-QZTJIDSGSA-N 1 3 348.487 2.728 10 0 EFAEHO O=C(OC[C@H]1CC[N@H+]1C1CCCCCC1)C1CCCN(C2CC2)C1=O ZINC001345531091 1332546347 /nfs/dbraw/zinc/54/63/47/1332546347.db2.gz NBBJGQFNWQTEGO-QZTJIDSGSA-N 1 3 348.487 2.728 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CC=CC12CCCCC2 ZINC001347660074 1332764341 /nfs/dbraw/zinc/76/43/41/1332764341.db2.gz HNGJOVSQLKJPCY-KRWDZBQOSA-N 1 3 336.524 2.543 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CC=CC12CCCCC2 ZINC001347660074 1332764344 /nfs/dbraw/zinc/76/43/44/1332764344.db2.gz HNGJOVSQLKJPCY-KRWDZBQOSA-N 1 3 336.524 2.543 10 0 EFAEHO CCCN(C(=O)CN(C)C(C)C)C1CC[NH+](CC[C@@H](C)F)CC1 ZINC001479996411 1333019708 /nfs/dbraw/zinc/01/97/08/1333019708.db2.gz HTJRBJWWFSTEIZ-MRXNPFEDSA-N 1 3 329.504 2.778 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]CCCCC(F)(F)F ZINC001480459919 1334059918 /nfs/dbraw/zinc/05/99/18/1334059918.db2.gz PTCYPSSCRFQPHC-KBPBESRZSA-N 1 3 337.430 2.686 10 0 EFAEHO CN(CCCNC(=[NH2+])NCCc1cccs1)Cc1ccccc1 ZINC000849053955 1335058756 /nfs/dbraw/zinc/05/87/56/1335058756.db2.gz PRBBVEVOJGGCBV-UHFFFAOYSA-N 1 3 330.501 2.927 10 0 EFAEHO CC(C)(C)OCCNC(=[NH2+])NC1CCN(Cc2ccccc2)CC1 ZINC000849068535 1335068051 /nfs/dbraw/zinc/06/80/51/1335068051.db2.gz ODPFTYKXZGSCMP-UHFFFAOYSA-N 1 3 332.492 2.580 10 0 EFAEHO CCc1ncc(CNC(=[NH2+])NC2CCN(Cc3ccccc3)CC2)o1 ZINC000849117242 1335555886 /nfs/dbraw/zinc/55/58/86/1335555886.db2.gz WSKCHXVXYLUYAI-UHFFFAOYSA-N 1 3 341.459 2.516 10 0 EFAEHO Cc1cc(C)cc(NC(=S)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000849275103 1335585585 /nfs/dbraw/zinc/58/55/85/1335585585.db2.gz HKQDSPREOIRGLD-INIZCTEOSA-N 1 3 336.549 2.862 10 0 EFAEHO Cc1cc(C)cc(NC(=S)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000849275103 1335585586 /nfs/dbraw/zinc/58/55/86/1335585586.db2.gz HKQDSPREOIRGLD-INIZCTEOSA-N 1 3 336.549 2.862 10 0 EFAEHO CO[C@H](Cc1ccccc1)CN1CCC(O)(C[NH+]2CCCCC2)CC1 ZINC001414061823 1335605418 /nfs/dbraw/zinc/60/54/18/1335605418.db2.gz DOJAJINNFRHCSV-HXUWFJFHSA-N 1 3 346.515 2.557 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)N(C)C)cc1 ZINC001361728647 1336299772 /nfs/dbraw/zinc/29/97/72/1336299772.db2.gz ZVBPNIUMOKBXMS-AQNXPRMDSA-N 1 3 343.515 2.985 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)N(C)C)cc1 ZINC001361728647 1336299775 /nfs/dbraw/zinc/29/97/75/1336299775.db2.gz ZVBPNIUMOKBXMS-AQNXPRMDSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H]1CCC[C@H](CC[NH+](C)C)N1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001361813081 1336351881 /nfs/dbraw/zinc/35/18/81/1336351881.db2.gz RHGTWGVWNKHZAQ-MDZRGWNJSA-N 1 3 341.515 2.920 10 0 EFAEHO CN(C)CCN(CC1CCCCC1)C(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001361856075 1336378277 /nfs/dbraw/zinc/37/82/77/1336378277.db2.gz MSGSBUDLEKLLPH-MOPGFXCFSA-N 1 3 335.536 2.974 10 0 EFAEHO CN(C)CCN(CC1CCCCC1)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001361856075 1336378281 /nfs/dbraw/zinc/37/82/81/1336378281.db2.gz MSGSBUDLEKLLPH-MOPGFXCFSA-N 1 3 335.536 2.974 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)N2CCN(CCC(C)(C)C)CC2)CC1 ZINC001361892783 1336401428 /nfs/dbraw/zinc/40/14/28/1336401428.db2.gz YBUGJWXGGBCVAK-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001361979890 1336450047 /nfs/dbraw/zinc/45/00/47/1336450047.db2.gz VWIQPZRLNNMPEC-PKOBYXMFSA-N 1 3 349.494 2.836 10 0 EFAEHO C[C@@H](CC[NH+](C)C)C(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC001362007193 1336461200 /nfs/dbraw/zinc/46/12/00/1336461200.db2.gz FXKUQXQOSLHBDW-HNNXBMFYSA-N 1 3 339.911 2.818 10 0 EFAEHO CN(C)CCN(Cc1ccccc1F)C(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001362077905 1336493126 /nfs/dbraw/zinc/49/31/26/1336493126.db2.gz MBQSSAMZIVRMPR-SJLPKXTDSA-N 1 3 349.494 2.836 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N(CCN2CCCC2)c2ccccc2)CC[N@@H+]1C ZINC001362165337 1336533948 /nfs/dbraw/zinc/53/39/48/1336533948.db2.gz PANAQXZORZZALO-ROUUACIJSA-N 1 3 329.488 2.846 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N(CCN2CCCC2)c2ccccc2)CC[N@H+]1C ZINC001362165337 1336533952 /nfs/dbraw/zinc/53/39/52/1336533952.db2.gz PANAQXZORZZALO-ROUUACIJSA-N 1 3 329.488 2.846 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CCC[C@H]([NH+](C)C)C1)N(C)Cc1ccccc1 ZINC001362170611 1336536739 /nfs/dbraw/zinc/53/67/39/1336536739.db2.gz ATZMPKPDWHYEIR-NEWSRXKRSA-N 1 3 331.504 2.744 10 0 EFAEHO C[C@@H](CC[NH+](C)C)C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC001362230902 1336564927 /nfs/dbraw/zinc/56/49/27/1336564927.db2.gz UDVZDOYKURHLME-ZWKOTPCHSA-N 1 3 331.504 2.697 10 0 EFAEHO C[C@H](C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC001362235169 1336566813 /nfs/dbraw/zinc/56/68/13/1336566813.db2.gz WLQRQJXDOWLKOU-AJYBTWMASA-N 1 3 343.515 2.981 10 0 EFAEHO C[C@H](C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001362235169 1336566817 /nfs/dbraw/zinc/56/68/17/1336566817.db2.gz WLQRQJXDOWLKOU-AJYBTWMASA-N 1 3 343.515 2.981 10 0 EFAEHO CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@H](C)CC[NH+](C)C ZINC001362541336 1336650138 /nfs/dbraw/zinc/65/01/38/1336650138.db2.gz LNDXZBQRAHZWSN-IEBWSBKVSA-N 1 3 333.520 2.847 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001363189165 1336823581 /nfs/dbraw/zinc/82/35/81/1336823581.db2.gz BPIXHWLESUQLIU-LJQANCHMSA-N 1 3 341.515 2.923 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001363189165 1336823584 /nfs/dbraw/zinc/82/35/84/1336823584.db2.gz BPIXHWLESUQLIU-LJQANCHMSA-N 1 3 341.515 2.923 10 0 EFAEHO COc1cc(CN(C)C)ccc1NC(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001363217508 1336838838 /nfs/dbraw/zinc/83/88/38/1336838838.db2.gz LIGPXVQHSLFDIB-JKSUJKDBSA-N 1 3 333.476 2.816 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CCN1CCN(CC2(O)CCCCCC2)CC1 ZINC001363771747 1337035106 /nfs/dbraw/zinc/03/51/06/1337035106.db2.gz QIYIYRMCPFOIOJ-RTBURBONSA-N 1 3 337.552 2.562 10 0 EFAEHO CCC1([NH+]2CCCCC2)CCN(C[C@@H](C)CN2CCOCC2)CC1 ZINC001363821944 1337068012 /nfs/dbraw/zinc/06/80/12/1337068012.db2.gz ZQEGARUSMPEFSI-LJQANCHMSA-N 1 3 337.552 2.685 10 0 EFAEHO OC1(C[NH+]2CCCCC2)CCN(C[C@H]2CCC3(CCCC3)O2)CC1 ZINC001363850951 1337080810 /nfs/dbraw/zinc/08/08/10/1337080810.db2.gz MHJHJQDHCKQJSF-GOSISDBHSA-N 1 3 336.520 2.791 10 0 EFAEHO OC1(C[NH+]2CCCCC2)CCN(C[C@H]2CCCC3(CCC3)O2)CC1 ZINC001363852506 1337082305 /nfs/dbraw/zinc/08/23/05/1337082305.db2.gz OWXNJBDVNGJBEW-GOSISDBHSA-N 1 3 336.520 2.791 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CCC3(CC3)CC2)C1 ZINC001365823974 1337253427 /nfs/dbraw/zinc/25/34/27/1337253427.db2.gz AMDCQJZGUAWCLM-CALCHBBNSA-N 1 3 344.503 2.715 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC12CC[NH+](CC1CC(C)(C)C1)CC2)N(C)C ZINC001366013727 1337323138 /nfs/dbraw/zinc/32/31/38/1337323138.db2.gz GIOIYQZRUABQIK-DLBZAZTESA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC12CC[NH+](CC1CC(C)(C)C1)CC2 ZINC001366019018 1337327503 /nfs/dbraw/zinc/32/75/03/1337327503.db2.gz QAPDAHJEPDXSDH-KRWDZBQOSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC12CC[NH+](Cc1cccc(F)c1)CC2)N(C)C ZINC001366024175 1337331327 /nfs/dbraw/zinc/33/13/27/1337331327.db2.gz ZHPONHIBHBRRQM-MSOLQXFVSA-N 1 3 347.478 2.637 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@H](NCc2ccccc2Cl)C2CC2)CC[N@@H+]1C ZINC001366034818 1337337592 /nfs/dbraw/zinc/33/75/92/1337337592.db2.gz QLJXQKWZNLQCHE-QBIMZIAESA-N 1 3 349.906 2.665 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@H](NCc2ccccc2Cl)C2CC2)CC[N@H+]1C ZINC001366034818 1337337596 /nfs/dbraw/zinc/33/75/96/1337337596.db2.gz QLJXQKWZNLQCHE-QBIMZIAESA-N 1 3 349.906 2.665 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1cc(C)sc1C)C1CC1)N(C)C ZINC001366062095 1337355584 /nfs/dbraw/zinc/35/55/84/1337355584.db2.gz MBFLFJYWPQAGSP-DLBZAZTESA-N 1 3 337.533 2.690 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1cc2ccccc2o1)C1CC1)N(C)C ZINC001366062297 1337355893 /nfs/dbraw/zinc/35/58/93/1337355893.db2.gz MMKNLSWTZNPIEE-ZWKOTPCHSA-N 1 3 343.471 2.757 10 0 EFAEHO C[C@H](C(=O)NC[C@H]([NH2+]Cc1ccccc1)C1CC1)N1CCCCCC1 ZINC001366071259 1337363256 /nfs/dbraw/zinc/36/32/56/1337363256.db2.gz YPMFRBJGSVHVLX-XLIONFOSSA-N 1 3 343.515 2.936 10 0 EFAEHO CC(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[NH+]1[C@@H](C)CC[C@@H]1C ZINC001366084262 1337373737 /nfs/dbraw/zinc/37/37/37/1337373737.db2.gz UZFSAGYZHNGSMX-CADBVGFASA-N 1 3 335.536 2.971 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC(C)(C)C1)N(C)C ZINC001366134045 1337394789 /nfs/dbraw/zinc/39/47/89/1337394789.db2.gz GLCIRPDAUBNNAA-FBVQUNGASA-N 1 3 335.536 2.874 10 0 EFAEHO CC[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC(C)(C)C1)N(C)C ZINC001366134045 1337394790 /nfs/dbraw/zinc/39/47/90/1337394790.db2.gz GLCIRPDAUBNNAA-FBVQUNGASA-N 1 3 335.536 2.874 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[NH+](CC)CC ZINC001366156703 1337406210 /nfs/dbraw/zinc/40/62/10/1337406210.db2.gz QPCJHVXXSLISBB-XQQFMLRXSA-N 1 3 336.307 2.663 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCc3c2cccc3Cl)C1)N(C)C ZINC001366158158 1337406792 /nfs/dbraw/zinc/40/67/92/1337406792.db2.gz GFYGGQQZHBDUPU-OBQMCUGOSA-N 1 3 349.906 2.904 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2c(C)cc(C)cc2C)C1 ZINC001366164746 1337409488 /nfs/dbraw/zinc/40/94/88/1337409488.db2.gz CQXIEAWSUVIBEJ-HDICACEKSA-N 1 3 331.504 2.690 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2cc(F)ccc2F)C1)N(C)C ZINC001366169980 1337413093 /nfs/dbraw/zinc/41/30/93/1337413093.db2.gz MPCDDTUHHUGLQA-DPYKFYPSSA-N 1 3 339.430 2.603 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CCC[N@H+](CC2CCCC2)C1)CC(C)(C)C ZINC001366176241 1337417502 /nfs/dbraw/zinc/41/75/02/1337417502.db2.gz CERIKOOQWNMBCU-SFHVURJKSA-N 1 3 337.552 2.983 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CCC[N@@H+](CC2CCCC2)C1)CC(C)(C)C ZINC001366176241 1337417503 /nfs/dbraw/zinc/41/75/03/1337417503.db2.gz CERIKOOQWNMBCU-SFHVURJKSA-N 1 3 337.552 2.983 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001366203119 1337440027 /nfs/dbraw/zinc/44/00/27/1337440027.db2.gz IZSZYFMVKBVYLJ-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO C[C@H](CNC(=O)CC[NH+](C)C)NCc1ccc(Cl)c(Cl)c1 ZINC001366318764 1337509313 /nfs/dbraw/zinc/50/93/13/1337509313.db2.gz BFQJFEJVSKTAQY-LLVKDONJSA-N 1 3 332.275 2.539 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NCc1cc(Cl)cc(Cl)c1 ZINC001366358477 1337533977 /nfs/dbraw/zinc/53/39/77/1337533977.db2.gz OXLVMCGJMJSAHC-AAEUAGOBSA-N 1 3 344.286 2.539 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NCc1cc(Cl)cc(Cl)c1 ZINC001366358477 1337533978 /nfs/dbraw/zinc/53/39/78/1337533978.db2.gz OXLVMCGJMJSAHC-AAEUAGOBSA-N 1 3 344.286 2.539 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(C(C)C)cc2)C1 ZINC001366387243 1337552855 /nfs/dbraw/zinc/55/28/55/1337552855.db2.gz GDJFNVXYQWAHPW-IBGZPJMESA-N 1 3 331.504 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+][C@@H]2CCc3ccc(F)cc32)C1 ZINC001366407641 1337563123 /nfs/dbraw/zinc/56/31/23/1337563123.db2.gz JDVNLZRYOOJVJO-HNAYVOBHSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@H+](C)Cc2cccc(F)c2)C1 ZINC001366424025 1337573746 /nfs/dbraw/zinc/57/37/46/1337573746.db2.gz ALPVTIMTQNZASE-SFHVURJKSA-N 1 3 335.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@@H+](C)Cc2cccc(F)c2)C1 ZINC001366424025 1337573750 /nfs/dbraw/zinc/57/37/50/1337573750.db2.gz ALPVTIMTQNZASE-SFHVURJKSA-N 1 3 335.467 2.589 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001366510211 1337651049 /nfs/dbraw/zinc/65/10/49/1337651049.db2.gz NQXZQTUSFBDCBP-XJKSGUPXSA-N 1 3 325.884 2.665 10 0 EFAEHO Cc1cccc(CN(C)CCNC(=O)[C@H]2CCC[C@H]([NH+](C)C)C2)c1 ZINC001366584970 1337722522 /nfs/dbraw/zinc/72/25/22/1337722522.db2.gz NYAUBZLYLLJZES-OALUTQOASA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CCC[C@H]([NH+](C)C)C2)cc1C ZINC001366585255 1337722652 /nfs/dbraw/zinc/72/26/52/1337722652.db2.gz OKSJYFIVNDKJCF-PMACEKPBSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1cccc(CN(C)CCNC(=O)[C@H]2CCC[C@@H]([NH+](C)C)C2)c1 ZINC001366584972 1337722688 /nfs/dbraw/zinc/72/26/88/1337722688.db2.gz NYAUBZLYLLJZES-RBUKOAKNSA-N 1 3 331.504 2.663 10 0 EFAEHO CC(C)c1ccccc1CN(C)CCNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001366586560 1337723504 /nfs/dbraw/zinc/72/35/04/1337723504.db2.gz SUJVFWPOKCMGSN-KRWDZBQOSA-N 1 3 331.504 2.700 10 0 EFAEHO CC(C)c1ccccc1CN(C)CCNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001366586560 1337723512 /nfs/dbraw/zinc/72/35/12/1337723512.db2.gz SUJVFWPOKCMGSN-KRWDZBQOSA-N 1 3 331.504 2.700 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C)[C@H](C)c1ccc(Cl)cc1 ZINC001366596392 1337733441 /nfs/dbraw/zinc/73/34/41/1337733441.db2.gz NRAOUWSFLYFOKZ-CQSZACIVSA-N 1 3 325.884 2.789 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C)[C@H](C)c1ccc(Cl)cc1 ZINC001366596392 1337733444 /nfs/dbraw/zinc/73/34/44/1337733444.db2.gz NRAOUWSFLYFOKZ-CQSZACIVSA-N 1 3 325.884 2.789 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)Cc1cccc(Cl)c1 ZINC001366639841 1337786174 /nfs/dbraw/zinc/78/61/74/1337786174.db2.gz UOGAMPSQONRDQJ-INIZCTEOSA-N 1 3 337.895 2.620 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)Cc1cccc(Cl)c1 ZINC001366639841 1337786177 /nfs/dbraw/zinc/78/61/77/1337786177.db2.gz UOGAMPSQONRDQJ-INIZCTEOSA-N 1 3 337.895 2.620 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCC[N@@H+]1CCc1ccccc1)N1CCCC1 ZINC001366656100 1337805366 /nfs/dbraw/zinc/80/53/66/1337805366.db2.gz FCHHOTBDEIJREO-LJQANCHMSA-N 1 3 343.515 2.684 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCC[N@H+]1CCc1ccccc1)N1CCCC1 ZINC001366656100 1337805376 /nfs/dbraw/zinc/80/53/76/1337805376.db2.gz FCHHOTBDEIJREO-LJQANCHMSA-N 1 3 343.515 2.684 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@H+](Cc2c(C)cccc2C)C1)N(C)C ZINC001366698155 1337885094 /nfs/dbraw/zinc/88/50/94/1337885094.db2.gz PVAYITRBCJASJG-PKOBYXMFSA-N 1 3 331.504 2.582 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@@H+](Cc2c(C)cccc2C)C1)N(C)C ZINC001366698155 1337885097 /nfs/dbraw/zinc/88/50/97/1337885097.db2.gz PVAYITRBCJASJG-PKOBYXMFSA-N 1 3 331.504 2.582 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCN(Cc2ccccc2F)C1 ZINC001366703565 1337894907 /nfs/dbraw/zinc/89/49/07/1337894907.db2.gz OXCBPMDJJODWHV-FUHWJXTLSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCN(Cc2ccccc2F)C1 ZINC001366703565 1337894910 /nfs/dbraw/zinc/89/49/10/1337894910.db2.gz OXCBPMDJJODWHV-FUHWJXTLSA-N 1 3 347.478 2.638 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1 ZINC001366712094 1337906645 /nfs/dbraw/zinc/90/66/45/1337906645.db2.gz WFECIFLYCGYILA-SFHVURJKSA-N 1 3 335.536 2.737 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1CC[N@@H+](CC2CCC3(CC3)CC2)C1 ZINC001366712094 1337906649 /nfs/dbraw/zinc/90/66/49/1337906649.db2.gz WFECIFLYCGYILA-SFHVURJKSA-N 1 3 335.536 2.737 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001366714109 1337909693 /nfs/dbraw/zinc/90/96/93/1337909693.db2.gz ZNTWUYFCPCVQEC-CVEARBPZSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001366714109 1337909696 /nfs/dbraw/zinc/90/96/96/1337909696.db2.gz ZNTWUYFCPCVQEC-CVEARBPZSA-N 1 3 349.906 2.620 10 0 EFAEHO Cc1cccc(CN(CCNC(=O)CC[C@@H]2CCC[N@H+]2C)C2CC2)c1 ZINC001366741077 1337949705 /nfs/dbraw/zinc/94/97/05/1337949705.db2.gz UKEGAMPSXZVVQY-IBGZPJMESA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1cccc(CN(CCNC(=O)CC[C@@H]2CCC[N@@H+]2C)C2CC2)c1 ZINC001366741077 1337949707 /nfs/dbraw/zinc/94/97/07/1337949707.db2.gz UKEGAMPSXZVVQY-IBGZPJMESA-N 1 3 343.515 2.950 10 0 EFAEHO C[NH+](C)CCC(=O)NCCN(C1CC1)[C@H]1CCCc2ccc(F)cc21 ZINC001366751863 1337967317 /nfs/dbraw/zinc/96/73/17/1337967317.db2.gz OWFWCVIJKXMGGJ-IBGZPJMESA-N 1 3 347.478 2.735 10 0 EFAEHO CC(C)CC[NH2+][C@H](CNC(=O)CN1CC[C@@H](C)C1)c1ccccc1 ZINC001366786802 1338004998 /nfs/dbraw/zinc/00/49/98/1338004998.db2.gz KKRXHUWJJMSSCX-IEBWSBKVSA-N 1 3 331.504 2.821 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N1C[C@H]2CC[C@@H](C1)[N@H+]2CCCC(C)C ZINC001366792680 1338012130 /nfs/dbraw/zinc/01/21/30/1338012130.db2.gz PAYAYTUNLRUKHL-OTWHNJEPSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCC(C)C ZINC001366792680 1338012133 /nfs/dbraw/zinc/01/21/33/1338012133.db2.gz PAYAYTUNLRUKHL-OTWHNJEPSA-N 1 3 335.536 2.972 10 0 EFAEHO CCc1cccc(C[N@H+]2CC[C@H](CCNC(=O)[C@@H](CC)N(C)C)C2)c1 ZINC001366847598 1338112433 /nfs/dbraw/zinc/11/24/33/1338112433.db2.gz ARTNNFWYJWKQTB-AZUAARDMSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1cccc(C[N@@H+]2CC[C@H](CCNC(=O)[C@@H](CC)N(C)C)C2)c1 ZINC001366847598 1338112434 /nfs/dbraw/zinc/11/24/34/1338112434.db2.gz ARTNNFWYJWKQTB-AZUAARDMSA-N 1 3 345.531 2.917 10 0 EFAEHO Cc1ccc(C)c(C[N@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001366849339 1338116204 /nfs/dbraw/zinc/11/62/04/1338116204.db2.gz GJGFRLPZGJIYRB-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001366849339 1338116209 /nfs/dbraw/zinc/11/62/09/1338116209.db2.gz GJGFRLPZGJIYRB-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H]1CC[N@@H+](CC2CCC(C)CC2)C1 ZINC001366853036 1338120388 /nfs/dbraw/zinc/12/03/88/1338120388.db2.gz DLZSSUYDCCONOJ-VMWRSERWSA-N 1 3 346.519 2.915 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H]1CC[N@H+](CC2CCC(C)CC2)C1 ZINC001366853036 1338120392 /nfs/dbraw/zinc/12/03/92/1338120392.db2.gz DLZSSUYDCCONOJ-VMWRSERWSA-N 1 3 346.519 2.915 10 0 EFAEHO CC(C)CC[N@H+](C)C[C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001366864361 1338133056 /nfs/dbraw/zinc/13/30/56/1338133056.db2.gz INTZNRKMPALNCM-QGZVFWFLSA-N 1 3 325.541 2.791 10 0 EFAEHO CC(C)CC[N@@H+](C)C[C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001366864361 1338133059 /nfs/dbraw/zinc/13/30/59/1338133059.db2.gz INTZNRKMPALNCM-QGZVFWFLSA-N 1 3 325.541 2.791 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@@H](CN(C)Cc2cc(C)ccc2F)C1 ZINC001366879915 1338155756 /nfs/dbraw/zinc/15/57/56/1338155756.db2.gz PBMCFHOUJVGAJW-KRWDZBQOSA-N 1 3 349.494 2.756 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@@H](CN(C)Cc2cc(C)ccc2F)C1 ZINC001366879915 1338155757 /nfs/dbraw/zinc/15/57/57/1338155757.db2.gz PBMCFHOUJVGAJW-KRWDZBQOSA-N 1 3 349.494 2.756 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001367017652 1338275401 /nfs/dbraw/zinc/27/54/01/1338275401.db2.gz YKWSZRQJZCGZPQ-OWCLPIDISA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001367017652 1338275404 /nfs/dbraw/zinc/27/54/04/1338275404.db2.gz YKWSZRQJZCGZPQ-OWCLPIDISA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CC2CCCCC2)C1)N1CCCC1 ZINC001367025487 1338283216 /nfs/dbraw/zinc/28/32/16/1338283216.db2.gz QQNUHDZOXOHZIH-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CC2CCCCC2)C1)N1CCCC1 ZINC001367025487 1338283219 /nfs/dbraw/zinc/28/32/19/1338283219.db2.gz QQNUHDZOXOHZIH-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@H]1CCN(Cc2ccc(CF)cc2)C1 ZINC001367078465 1338361884 /nfs/dbraw/zinc/36/18/84/1338361884.db2.gz TWAQQPCCXLYDBM-SFHVURJKSA-N 1 3 335.467 2.531 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C1CCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001367105962 1338392543 /nfs/dbraw/zinc/39/25/43/1338392543.db2.gz YDVUHIQMINMMRM-APWZRJJASA-N 1 3 329.488 2.643 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001367124773 1338412846 /nfs/dbraw/zinc/41/28/46/1338412846.db2.gz FSQFYCDWMWHGNY-PKOBYXMFSA-N 1 3 344.503 2.739 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]CC1CC(F)(F)C1 ZINC001367125415 1338414077 /nfs/dbraw/zinc/41/40/77/1338414077.db2.gz DVXJQDRGLGLJAE-HOCLYGCPSA-N 1 3 345.478 2.781 10 0 EFAEHO CC[C@H](CNC(=O)[C@H](CC)N(C)C)[NH2+]Cc1ccc(C)cc1Cl ZINC001367129829 1338419294 /nfs/dbraw/zinc/41/92/94/1338419294.db2.gz CTPOAVVPPDQFLJ-WBVHZDCISA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1ccc(F)c(CNCC2(NC(=O)CCC[NH+](C)C)CCCC2)c1 ZINC001367158775 1338456471 /nfs/dbraw/zinc/45/64/71/1338456471.db2.gz SHWCHKMTCJWCSE-UHFFFAOYSA-N 1 3 349.494 2.995 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@](C)(NC(=O)CN2CC[C@@H](C)C2)C2CC2)cs1 ZINC001367175958 1338477231 /nfs/dbraw/zinc/47/72/31/1338477231.db2.gz JWAIGJPFYFKXIL-AUUYWEPGSA-N 1 3 349.544 2.773 10 0 EFAEHO Cc1cc(C[NH2+]C[C@](C)(NC(=O)CN2CC[C@@H](C)C2)C2CC2)cs1 ZINC001367175962 1338477265 /nfs/dbraw/zinc/47/72/65/1338477265.db2.gz JWAIGJPFYFKXIL-KUHUBIRLSA-N 1 3 349.544 2.773 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H]([NH2+]CC3CC(C)(C)C3)CC2)CCC1 ZINC001367191551 1338495805 /nfs/dbraw/zinc/49/58/05/1338495805.db2.gz URVUPAKOXBYHAD-QAQDUYKDSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@H](C)c1ccccc1F ZINC001367229583 1338537005 /nfs/dbraw/zinc/53/70/05/1338537005.db2.gz YXVVOWRKSURJNL-HZPDHXFCSA-N 1 3 335.467 2.808 10 0 EFAEHO C[C@H](CNC(=O)c1cccc(CN(C)C)c1)C[NH2+]CC1CCCC1 ZINC001367282371 1338582608 /nfs/dbraw/zinc/58/26/08/1338582608.db2.gz AUNVQTZXKXPARR-INIZCTEOSA-N 1 3 331.504 2.894 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@H](C)CNC(=O)CN(C)C(C)C)c(C)c1 ZINC001367287641 1338587249 /nfs/dbraw/zinc/58/72/49/1338587249.db2.gz LZGQPWYDKRQTSX-INIZCTEOSA-N 1 3 333.520 2.794 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]C/C=C/Cl)CCCC1 ZINC001367327743 1338627030 /nfs/dbraw/zinc/62/70/30/1338627030.db2.gz BUOKRYKXTBDXRT-JXSYMDBTSA-N 1 3 327.900 2.630 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(C)cc1 ZINC001367413437 1338711465 /nfs/dbraw/zinc/71/14/65/1338711465.db2.gz LJKSVYSOHIOCIQ-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(C)cc1 ZINC001367413428 1338711564 /nfs/dbraw/zinc/71/15/64/1338711564.db2.gz LJKSVYSOHIOCIQ-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]Cc1cc2ccccc2o1 ZINC001367416132 1338714620 /nfs/dbraw/zinc/71/46/20/1338714620.db2.gz QUFBEZIUKAMXEE-OAHLLOKOSA-N 1 3 331.460 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H](C)[NH2+]CC2CC(C)(C)C2)C1 ZINC001367438405 1338740541 /nfs/dbraw/zinc/74/05/41/1338740541.db2.gz DHNPZWZDMJSQFT-AEFFLSMTSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H](C)[NH2+]CC2CC(C)(C)C2)C1 ZINC001367438417 1338740803 /nfs/dbraw/zinc/74/08/03/1338740803.db2.gz DHNPZWZDMJSQFT-FUHWJXTLSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H](C)[NH2+]Cc2ccccc2F)C1 ZINC001367450152 1338753384 /nfs/dbraw/zinc/75/33/84/1338753384.db2.gz NNLCMXPNNWHCTA-WMZOPIPTSA-N 1 3 349.494 2.883 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)c1 ZINC001367486421 1338786228 /nfs/dbraw/zinc/78/62/28/1338786228.db2.gz NIHLHJQWIOSHFK-PXNSSMCTSA-N 1 3 345.531 2.876 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)[C@@H](C(C)C)N(C)C)C(C)C)c(C)n1 ZINC001367486322 1338786233 /nfs/dbraw/zinc/78/62/33/1338786233.db2.gz BBNMJGFRGMRODH-RTBURBONSA-N 1 3 348.535 2.515 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)c1 ZINC001367486423 1338786280 /nfs/dbraw/zinc/78/62/80/1338786280.db2.gz NIHLHJQWIOSHFK-YLJYHZDGSA-N 1 3 345.531 2.876 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C(C)C)c(C)n1 ZINC001367486321 1338786517 /nfs/dbraw/zinc/78/65/17/1338786517.db2.gz BBNMJGFRGMRODH-RBUKOAKNSA-N 1 3 348.535 2.515 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1cccc(F)c1 ZINC001367493880 1338792857 /nfs/dbraw/zinc/79/28/57/1338792857.db2.gz ZJLXVHFYOOVPTN-GOSISDBHSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1cccc(Cl)c1)C(C)C)N(C)C ZINC001367496901 1338795431 /nfs/dbraw/zinc/79/54/31/1338795431.db2.gz XSINXZJHMNSWTE-IAGOWNOFSA-N 1 3 339.911 2.911 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCN(C)C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001367537312 1338840909 /nfs/dbraw/zinc/84/09/09/1338840909.db2.gz XPNFFLMREFDQTN-OALUTQOASA-N 1 3 345.531 2.924 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCN(C)C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001367537312 1338840910 /nfs/dbraw/zinc/84/09/10/1338840910.db2.gz XPNFFLMREFDQTN-OALUTQOASA-N 1 3 345.531 2.924 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@H+](C/C=C/Cl)CC(C)(C)C1 ZINC001388843793 1353084169 /nfs/dbraw/zinc/08/41/69/1353084169.db2.gz VZYDKWCJVPBZFN-VFADXPBXSA-N 1 3 329.916 2.688 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@@H+](C/C=C/Cl)CC(C)(C)C1 ZINC001388843793 1353084172 /nfs/dbraw/zinc/08/41/72/1353084172.db2.gz VZYDKWCJVPBZFN-VFADXPBXSA-N 1 3 329.916 2.688 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCCc2ccccc21)C(=O)CN(C)C(C)C ZINC001367656746 1338908439 /nfs/dbraw/zinc/90/84/39/1338908439.db2.gz MOKHVQBJLUIETI-LJQANCHMSA-N 1 3 331.504 2.842 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCCc2ccc(F)cc21)C(=O)CN(C)C(C)C ZINC001367657999 1338909392 /nfs/dbraw/zinc/90/93/92/1338909392.db2.gz PFMFXDNEVXEGAD-LJQANCHMSA-N 1 3 349.494 2.981 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@@H](C)NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)c1 ZINC001367695279 1338935298 /nfs/dbraw/zinc/93/52/98/1338935298.db2.gz OYHOPHZDCHTINA-OXQOHEQNSA-N 1 3 349.494 2.802 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)CNCc1ccc(C)cc1Cl ZINC001367705402 1338944458 /nfs/dbraw/zinc/94/44/58/1338944458.db2.gz CCBSYXKBLQEJNQ-CQSZACIVSA-N 1 3 325.884 2.585 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)CNCc1ccc(C)cc1Cl ZINC001367705402 1338944461 /nfs/dbraw/zinc/94/44/61/1338944461.db2.gz CCBSYXKBLQEJNQ-CQSZACIVSA-N 1 3 325.884 2.585 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]Cc1ccc2ccccc2c1)N(C)C ZINC001367740142 1338970016 /nfs/dbraw/zinc/97/00/16/1338970016.db2.gz IZCMLFWVGPUSGG-HNAYVOBHSA-N 1 3 327.472 2.774 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]Cc1ccc(Cl)c(Cl)c1)N(C)C ZINC001367742313 1338971219 /nfs/dbraw/zinc/97/12/19/1338971219.db2.gz WMFQSMYXBSLBEB-XHDPSFHLSA-N 1 3 346.302 2.928 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@H](C)NC(=O)[C@H](C(C)C)N(C)C)cc1 ZINC001367765933 1338991647 /nfs/dbraw/zinc/99/16/47/1338991647.db2.gz IZPOXJOWAAIHLF-LPHOPBHVSA-N 1 3 333.520 2.991 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(Cl)c1)NC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001367802579 1339022938 /nfs/dbraw/zinc/02/29/38/1339022938.db2.gz FGJZOXKVTPWPIR-RDTXWAMCSA-N 1 3 349.906 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001367858922 1339073789 /nfs/dbraw/zinc/07/37/89/1339073789.db2.gz FXHMICIWCDMGEF-HUUCEWRRSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001367858922 1339073790 /nfs/dbraw/zinc/07/37/90/1339073790.db2.gz FXHMICIWCDMGEF-HUUCEWRRSA-N 1 3 333.467 2.589 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)C[C@@H](C)NC(=O)CN(C)C(C)C)c(C)c1 ZINC001367862339 1339076302 /nfs/dbraw/zinc/07/63/02/1339076302.db2.gz OBUNGGJFKNDKEB-GOSISDBHSA-N 1 3 333.520 2.889 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)C[C@@H](C)NC(=O)CN(C)C(C)C)c(C)c1 ZINC001367862339 1339076304 /nfs/dbraw/zinc/07/63/04/1339076304.db2.gz OBUNGGJFKNDKEB-GOSISDBHSA-N 1 3 333.520 2.889 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+][C@@H]1CCc2ccccc21)C1CC1)C1CCC1 ZINC001367909324 1339100692 /nfs/dbraw/zinc/10/06/92/1339100692.db2.gz ZBPWMLGAHFCSBH-WOJBJXKFSA-N 1 3 341.499 2.643 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]CCC(C)(C)C ZINC001367924484 1339111382 /nfs/dbraw/zinc/11/13/82/1339111382.db2.gz ABJVNGSQQOKAPV-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]Cc1ccc(F)cc1 ZINC001367926385 1339112210 /nfs/dbraw/zinc/11/22/10/1339112210.db2.gz GMVPYACIJOAUPU-MJGOQNOKSA-N 1 3 349.494 2.883 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCN1CC1CC2(CCC2)C1 ZINC001367943618 1339120277 /nfs/dbraw/zinc/12/02/77/1339120277.db2.gz KHVGBIRZJNFZFZ-ROUUACIJSA-N 1 3 333.520 2.632 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCN1CC1CC2(CCC2)C1 ZINC001367943618 1339120278 /nfs/dbraw/zinc/12/02/78/1339120278.db2.gz KHVGBIRZJNFZFZ-ROUUACIJSA-N 1 3 333.520 2.632 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3ccc(F)cc3C)CC2)CC[N@@H+]1C ZINC001368001332 1339151481 /nfs/dbraw/zinc/15/14/81/1339151481.db2.gz KXOYSGRPTGWPAM-ZWKOTPCHSA-N 1 3 347.478 2.603 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3ccc(F)cc3C)CC2)CC[N@H+]1C ZINC001368001332 1339151485 /nfs/dbraw/zinc/15/14/85/1339151485.db2.gz KXOYSGRPTGWPAM-ZWKOTPCHSA-N 1 3 347.478 2.603 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]C[C@@H]2CCC(F)(F)C2)CC1)N1CCCC1 ZINC001368011182 1339156368 /nfs/dbraw/zinc/15/63/68/1339156368.db2.gz BZAYQJILCWHIBA-CQSZACIVSA-N 1 3 343.462 2.535 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H]3CC[N@H+](C)[C@@H](C)C3)CC2)c(C)s1 ZINC001368016792 1339159404 /nfs/dbraw/zinc/15/94/04/1339159404.db2.gz WCKYRYZMLOKQQJ-BBRMVZONSA-N 1 3 349.544 2.834 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H]3CC[N@@H+](C)[C@@H](C)C3)CC2)c(C)s1 ZINC001368016792 1339159405 /nfs/dbraw/zinc/15/94/05/1339159405.db2.gz WCKYRYZMLOKQQJ-BBRMVZONSA-N 1 3 349.544 2.834 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NCC2(N[C@H]3CCc4ccc(Cl)cc43)CC2)C1 ZINC001368034675 1339167889 /nfs/dbraw/zinc/16/78/89/1339167889.db2.gz JMFUNPWLDJHTOM-YOEHRIQHSA-N 1 3 347.890 2.517 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NCC2(N[C@H]3CCc4ccc(Cl)cc43)CC2)C1 ZINC001368034675 1339167890 /nfs/dbraw/zinc/16/78/90/1339167890.db2.gz JMFUNPWLDJHTOM-YOEHRIQHSA-N 1 3 347.890 2.517 10 0 EFAEHO CC[C@@H](F)C[N@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001368051909 1339177744 /nfs/dbraw/zinc/17/77/44/1339177744.db2.gz SBMHLKDBISUORC-SJLPKXTDSA-N 1 3 339.499 2.532 10 0 EFAEHO CC[C@@H](F)C[N@@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001368051909 1339177745 /nfs/dbraw/zinc/17/77/45/1339177745.db2.gz SBMHLKDBISUORC-SJLPKXTDSA-N 1 3 339.499 2.532 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)[C@H](C)C1 ZINC001368102403 1339195453 /nfs/dbraw/zinc/19/54/53/1339195453.db2.gz GSARUXPKXDHNRT-IEBWSBKVSA-N 1 3 331.504 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+][C@H]1CCc2c1cccc2F ZINC001368124316 1339204329 /nfs/dbraw/zinc/20/43/29/1339204329.db2.gz VADBJVJGGWOXSO-KXBFYZLASA-N 1 3 347.478 2.734 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@]2(CC[N@H+](CC[C@H](C)F)C2)C1 ZINC001368142903 1339215791 /nfs/dbraw/zinc/21/57/91/1339215791.db2.gz FQLUQCNMVWFLGT-PKOBYXMFSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@]2(CC[N@@H+](CC[C@H](C)F)C2)C1 ZINC001368142903 1339215793 /nfs/dbraw/zinc/21/57/93/1339215793.db2.gz FQLUQCNMVWFLGT-PKOBYXMFSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[C@H](C(=O)N[C@@]1(C)CC[N@H+](CC2CC(F)(F)C2)C1)N(CC)CC ZINC001368168882 1339232554 /nfs/dbraw/zinc/23/25/54/1339232554.db2.gz FCLOHMQLTPKVCP-WBVHZDCISA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](C(=O)N[C@@]1(C)CC[N@@H+](CC2CC(F)(F)C2)C1)N(CC)CC ZINC001368168882 1339232555 /nfs/dbraw/zinc/23/25/55/1339232555.db2.gz FCLOHMQLTPKVCP-WBVHZDCISA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCCC1CCC1)C2 ZINC001368325128 1339298618 /nfs/dbraw/zinc/29/86/18/1339298618.db2.gz FXJXXPQIAAGMSL-OTWHNJEPSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCCC1CCC1)C2 ZINC001368325128 1339298620 /nfs/dbraw/zinc/29/86/20/1339298620.db2.gz FXJXXPQIAAGMSL-OTWHNJEPSA-N 1 3 335.536 2.876 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)N[C@H]1C[C@H]2C[C@@H](C1)N(C/C=C\Cl)C2 ZINC001368328041 1339300253 /nfs/dbraw/zinc/30/02/53/1339300253.db2.gz TYBWBWWSDPNORT-ZVPCSVBDSA-N 1 3 339.911 2.584 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([C@@H](C)[NH2+]Cc2cc(C)ccc2F)C1 ZINC001368348021 1339309944 /nfs/dbraw/zinc/30/99/44/1339309944.db2.gz ULKGXVKLQSFWJW-SJORKVTESA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@H](F)CC[N@H+](C)Cc1ccccc1CNC(=O)C1(N(C)C)CCC1 ZINC001368412518 1339342138 /nfs/dbraw/zinc/34/21/38/1339342138.db2.gz QPPIODYGAUMZIQ-INIZCTEOSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)Cc1ccccc1CNC(=O)C1(N(C)C)CCC1 ZINC001368412518 1339342144 /nfs/dbraw/zinc/34/21/44/1339342144.db2.gz QPPIODYGAUMZIQ-INIZCTEOSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@@H](NCCF)c1ccc(CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC001368412739 1339344481 /nfs/dbraw/zinc/34/44/81/1339344481.db2.gz LXYBPARXDQIBEB-DAYGRLMNSA-N 1 3 335.467 2.653 10 0 EFAEHO C[C@@H](NCCF)c1ccc(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC001368412739 1339344487 /nfs/dbraw/zinc/34/44/87/1339344487.db2.gz LXYBPARXDQIBEB-DAYGRLMNSA-N 1 3 335.467 2.653 10 0 EFAEHO C[C@H](F)CC[NH+]1CCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)CC1 ZINC001368420259 1339354594 /nfs/dbraw/zinc/35/45/94/1339354594.db2.gz BVUZRFWWNDEXPR-INIZCTEOSA-N 1 3 341.515 2.637 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCc1ccccc1C[N@H+](C)CCCF ZINC001368426644 1339362820 /nfs/dbraw/zinc/36/28/20/1339362820.db2.gz MOTOZYNHADSLCS-IBGZPJMESA-N 1 3 349.494 2.969 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCc1ccccc1C[N@@H+](C)CCCF ZINC001368426644 1339362822 /nfs/dbraw/zinc/36/28/22/1339362822.db2.gz MOTOZYNHADSLCS-IBGZPJMESA-N 1 3 349.494 2.969 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@@H]([NH2+]CC2CCCCC2)C1)N1CCCC1 ZINC001368499810 1339438147 /nfs/dbraw/zinc/43/81/47/1339438147.db2.gz VNCSTQIGEVVXRT-HDICACEKSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CCC[N@H+](Cc2cc(C)ccc2F)CC1)N(C)C ZINC001368512336 1339446834 /nfs/dbraw/zinc/44/68/34/1339446834.db2.gz KMPBUAVQFQURCU-MJGOQNOKSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(C)ccc2F)CC1)N(C)C ZINC001368512336 1339446838 /nfs/dbraw/zinc/44/68/38/1339446838.db2.gz KMPBUAVQFQURCU-MJGOQNOKSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC001368517052 1339452364 /nfs/dbraw/zinc/45/23/64/1339452364.db2.gz CSBFVLUEGFEKDB-SFHVURJKSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC001368517052 1339452365 /nfs/dbraw/zinc/45/23/65/1339452365.db2.gz CSBFVLUEGFEKDB-SFHVURJKSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CCCN(Cc2ccccn2)CC1)[NH+](CC)CC ZINC001368518600 1339454766 /nfs/dbraw/zinc/45/47/66/1339454766.db2.gz XEYOMXDFLWIEDW-MJGOQNOKSA-N 1 3 346.519 2.673 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](Cc2ccc(C)c(F)c2)CC1)N(C)C ZINC001368535617 1339474746 /nfs/dbraw/zinc/47/47/46/1339474746.db2.gz SXRFVCDKJRAEQD-PKOBYXMFSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](Cc2ccc(C)c(F)c2)CC1)N(C)C ZINC001368535617 1339474749 /nfs/dbraw/zinc/47/47/49/1339474749.db2.gz SXRFVCDKJRAEQD-PKOBYXMFSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@H+](Cc2ccc(C)c(F)c2)CC1)N(C)C ZINC001368535602 1339474884 /nfs/dbraw/zinc/47/48/84/1339474884.db2.gz SXRFVCDKJRAEQD-IEBWSBKVSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2ccc(C)c(F)c2)CC1)N(C)C ZINC001368535602 1339474888 /nfs/dbraw/zinc/47/48/88/1339474888.db2.gz SXRFVCDKJRAEQD-IEBWSBKVSA-N 1 3 349.494 2.945 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C\Cl)C1)CC(C)(C)C ZINC001368639749 1339560580 /nfs/dbraw/zinc/56/05/80/1339560580.db2.gz AYYJDBKFKHYLLA-DNWYELSFSA-N 1 3 329.916 2.591 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C[C@H]1C)CC[NH+](CC[C@H](C)F)CC2 ZINC001368650364 1339565961 /nfs/dbraw/zinc/56/59/61/1339565961.db2.gz HBNKBRNVFSAUEA-DLBZAZTESA-N 1 3 341.515 2.779 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H]([NH2+]CC2CCC3(CC3)CC2)C1 ZINC001368671663 1339584651 /nfs/dbraw/zinc/58/46/51/1339584651.db2.gz VHSAUJCXXKFWFX-FUHWJXTLSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]1C ZINC001368695750 1339610538 /nfs/dbraw/zinc/61/05/38/1339610538.db2.gz KDALSRMNUBSUMS-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]1C ZINC001368695750 1339610540 /nfs/dbraw/zinc/61/05/40/1339610540.db2.gz KDALSRMNUBSUMS-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1CN1CC[C@H](NC(=O)CC[NH+](C)C)C[C@@H]1C ZINC001368698531 1339614184 /nfs/dbraw/zinc/61/41/84/1339614184.db2.gz UQNPKZWBNZCCTG-YJBOKZPZSA-N 1 3 335.467 2.555 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N2CCCC2)CC[N@@H+]1CCC1CC1 ZINC001368701147 1339618665 /nfs/dbraw/zinc/61/86/65/1339618665.db2.gz BSQKHKXHXURCOM-OTWHNJEPSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](C(C)C)N2CCCC2)CC[N@H+]1CCC1CC1 ZINC001368701147 1339618670 /nfs/dbraw/zinc/61/86/70/1339618670.db2.gz BSQKHKXHXURCOM-OTWHNJEPSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]C/C=C\c1ccccc1 ZINC001368737127 1339658916 /nfs/dbraw/zinc/65/89/16/1339658916.db2.gz PIRKJBAFZQJGRS-KELXMEGNSA-N 1 3 329.488 2.526 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CCC2(CC2)CC1 ZINC001368738558 1339661157 /nfs/dbraw/zinc/66/11/57/1339661157.db2.gz ZVEGAQUBFHBGTL-SJORKVTESA-N 1 3 335.536 2.783 10 0 EFAEHO O=C(CCC[NH+]1CCCCC1)N1CCCCC[C@H](NCCF)C1 ZINC001368747083 1339669903 /nfs/dbraw/zinc/66/99/03/1339669903.db2.gz FFJWZEOCBHQCRQ-KRWDZBQOSA-N 1 3 327.488 2.583 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)C1(N(C)C)CCC1 ZINC001368781299 1339707479 /nfs/dbraw/zinc/70/74/79/1339707479.db2.gz RZQLYMYLBAOLDI-RTBURBONSA-N 1 3 343.515 2.889 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@H]1C[N@H+](C)CCc1ccccc1)N(C)C ZINC001368821448 1339761017 /nfs/dbraw/zinc/76/10/17/1339761017.db2.gz LYUWTLVMPFYTEN-PMACEKPBSA-N 1 3 345.531 2.882 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@H]1C[N@@H+](C)CCc1ccccc1)N(C)C ZINC001368821448 1339761022 /nfs/dbraw/zinc/76/10/22/1339761022.db2.gz LYUWTLVMPFYTEN-PMACEKPBSA-N 1 3 345.531 2.882 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCN(C/C=C/Cl)CC(C)(C)C1)[NH+](C)C ZINC001368828922 1339769019 /nfs/dbraw/zinc/76/90/19/1339769019.db2.gz VACRVDILJNFOSJ-FEPMCFLQSA-N 1 3 343.943 2.932 10 0 EFAEHO C[C@@H](NC(=O)C12CCC[NH+]1CCC2)[C@H](C)NCc1ccccc1Cl ZINC001368865086 1339799318 /nfs/dbraw/zinc/79/93/18/1339799318.db2.gz KYVBXIMSANAMJB-LSDHHAIUSA-N 1 3 349.906 2.951 10 0 EFAEHO C[C@@H](NCc1ccccc1Cl)[C@H](C)NC(=O)C12CCC[NH+]1CCC2 ZINC001368865063 1339799769 /nfs/dbraw/zinc/79/97/69/1339799769.db2.gz KYVBXIMSANAMJB-CABCVRRESA-N 1 3 349.906 2.951 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001368902744 1339843650 /nfs/dbraw/zinc/84/36/50/1339843650.db2.gz VEJVBGXOMHHQFJ-NWDGAFQWSA-N 1 3 331.913 2.725 10 0 EFAEHO CN(CC(C)(C)C[NH2+]CC1CC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001368918821 1339864134 /nfs/dbraw/zinc/86/41/34/1339864134.db2.gz KXJPDUIKLQYFRF-IBGZPJMESA-N 1 3 341.515 2.683 10 0 EFAEHO COc1ccc(CN(C)[C@@H](C)CNC(=O)[C@H]2CCC[N@@H+]2C(C)C)cc1 ZINC001368940483 1339886391 /nfs/dbraw/zinc/88/63/91/1339886391.db2.gz JFBFUBGGVHVKCK-QFBILLFUSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(CN(C)[C@@H](C)CNC(=O)[C@H]2CCC[N@H+]2C(C)C)cc1 ZINC001368940483 1339886395 /nfs/dbraw/zinc/88/63/95/1339886395.db2.gz JFBFUBGGVHVKCK-QFBILLFUSA-N 1 3 347.503 2.505 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)C3(N(C)C)CCC3)C2)cc1F ZINC001369169336 1339949293 /nfs/dbraw/zinc/94/92/93/1339949293.db2.gz OZBYXDWPKGCRHS-QAQDUYKDSA-N 1 3 347.478 2.603 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccc(C)cc1C)C1CC1)N(C)C ZINC001370262647 1339993322 /nfs/dbraw/zinc/99/33/22/1339993322.db2.gz GPNJEQRBMJYYPP-RTBURBONSA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccsc1)N(C)C ZINC001370581225 1340146003 /nfs/dbraw/zinc/14/60/03/1340146003.db2.gz ABHCYZFMVYGJST-NPYXIHBLSA-N 1 3 335.517 2.700 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccsc1)N(C)C ZINC001370581225 1340146004 /nfs/dbraw/zinc/14/60/04/1340146004.db2.gz ABHCYZFMVYGJST-NPYXIHBLSA-N 1 3 335.517 2.700 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@H]2[C@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001370591151 1340152114 /nfs/dbraw/zinc/15/21/14/1340152114.db2.gz LNEPSRMHPXIZBJ-AEFFLSMTSA-N 1 3 332.492 2.701 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001370591151 1340152116 /nfs/dbraw/zinc/15/21/16/1340152116.db2.gz LNEPSRMHPXIZBJ-AEFFLSMTSA-N 1 3 332.492 2.701 10 0 EFAEHO CCCc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001370711793 1340187846 /nfs/dbraw/zinc/18/78/46/1340187846.db2.gz KSOLWVJWVIXYDN-CEXWTWQISA-N 1 3 331.504 2.716 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2Cl)C1)N(C)C ZINC001370717094 1340188982 /nfs/dbraw/zinc/18/89/82/1340188982.db2.gz ZSDBQCTXWASISW-WVZRYYJFSA-N 1 3 337.895 2.978 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@@H]([NH2+]C/C=C\c2ccccc2)C1 ZINC001370738612 1340194013 /nfs/dbraw/zinc/19/40/13/1340194013.db2.gz XWDOOCLATZBQPI-DMZCGPQESA-N 1 3 341.499 2.809 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@H+](Cc2ccc(F)cc2)C1 ZINC001370971098 1340316185 /nfs/dbraw/zinc/31/61/85/1340316185.db2.gz PFSIGDGGSUSLGC-SJLPKXTDSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2)C1 ZINC001370971098 1340316187 /nfs/dbraw/zinc/31/61/87/1340316187.db2.gz PFSIGDGGSUSLGC-SJLPKXTDSA-N 1 3 349.494 2.883 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N[C@@H](C)C1CCCCC1 ZINC001371293199 1340478644 /nfs/dbraw/zinc/47/86/44/1340478644.db2.gz XSWDLRCUYKRSGE-HOTGVXAUSA-N 1 3 326.529 2.526 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N[C@@H](C)C1CCCCC1 ZINC001371293199 1340478647 /nfs/dbraw/zinc/47/86/47/1340478647.db2.gz XSWDLRCUYKRSGE-HOTGVXAUSA-N 1 3 326.529 2.526 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001371305061 1340486773 /nfs/dbraw/zinc/48/67/73/1340486773.db2.gz HCAWYFRHZCNZAT-GJZGRUSLSA-N 1 3 345.478 2.781 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@@H](C)CNC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001371366119 1340532485 /nfs/dbraw/zinc/53/24/85/1340532485.db2.gz UXDBBSRGZUNGSB-KSSFIOAISA-N 1 3 331.504 2.548 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001371835153 1340712045 /nfs/dbraw/zinc/71/20/45/1340712045.db2.gz JGEYBTALJXADMU-GDBMZVCRSA-N 1 3 345.478 2.779 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]Cc1ccccc1C ZINC001371884837 1340739264 /nfs/dbraw/zinc/73/92/64/1340739264.db2.gz DYFVWUABPOVFNC-HKUYNNGSSA-N 1 3 331.504 2.854 10 0 EFAEHO CCC[N@H+](CCNC(=O)Cc1nc[nH]c1C)CC1CC2(CCC2)C1 ZINC001372738198 1340781518 /nfs/dbraw/zinc/78/15/18/1340781518.db2.gz LEIKAVHPTCYPPP-UHFFFAOYSA-N 1 3 332.492 2.669 10 0 EFAEHO CCC[N@@H+](CCNC(=O)Cc1nc[nH]c1C)CC1CC2(CCC2)C1 ZINC001372738198 1340781520 /nfs/dbraw/zinc/78/15/20/1340781520.db2.gz LEIKAVHPTCYPPP-UHFFFAOYSA-N 1 3 332.492 2.669 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@H](CNC(=O)C1(N(C)C)CCC1)c1ccccc1 ZINC001373070116 1340891144 /nfs/dbraw/zinc/89/11/44/1340891144.db2.gz ZAUXPFKJPQKKEA-SJLPKXTDSA-N 1 3 331.504 2.964 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@H+](C)C1)[C@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001373127371 1340917533 /nfs/dbraw/zinc/91/75/33/1340917533.db2.gz JWNIFQQIRXIGEA-PMACEKPBSA-N 1 3 343.515 2.760 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@@H+](C)C1)[C@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001373127371 1340917534 /nfs/dbraw/zinc/91/75/34/1340917534.db2.gz JWNIFQQIRXIGEA-PMACEKPBSA-N 1 3 343.515 2.760 10 0 EFAEHO Cc1ccc(F)c(C[N@H+]2CC[C@H](CCNC(=O)[C@H]3CCCN3C)C2)c1 ZINC001373162145 1340930812 /nfs/dbraw/zinc/93/08/12/1340930812.db2.gz UPGFWCPLZDULRU-QFBILLFUSA-N 1 3 347.478 2.557 10 0 EFAEHO Cc1ccc(F)c(C[N@@H+]2CC[C@H](CCNC(=O)[C@H]3CCCN3C)C2)c1 ZINC001373162145 1340930813 /nfs/dbraw/zinc/93/08/13/1340930813.db2.gz UPGFWCPLZDULRU-QFBILLFUSA-N 1 3 347.478 2.557 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@H+](C/C=C/c2ccccc2)C1 ZINC001373245648 1340966061 /nfs/dbraw/zinc/96/60/61/1340966061.db2.gz KLPRWARQEAIZHD-OSICKASQSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@@H+](C/C=C/c2ccccc2)C1 ZINC001373245648 1340966062 /nfs/dbraw/zinc/96/60/62/1340966062.db2.gz KLPRWARQEAIZHD-OSICKASQSA-N 1 3 343.515 2.868 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N2CC[C@H](CN(C)C/C=C\Cl)C2)C1 ZINC001373295715 1340980532 /nfs/dbraw/zinc/98/05/32/1340980532.db2.gz XKBYSOKHRYQHGG-KZKKIBMZSA-N 1 3 341.927 2.641 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N2CC[C@H](CN(C)C/C=C\Cl)C2)C1 ZINC001373295715 1340980533 /nfs/dbraw/zinc/98/05/33/1340980533.db2.gz XKBYSOKHRYQHGG-KZKKIBMZSA-N 1 3 341.927 2.641 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@H+](CC2CCC(C)CC2)C1)N(C)C ZINC001373381392 1341005819 /nfs/dbraw/zinc/00/58/19/1341005819.db2.gz IDYHNCSSXCGGLE-CSODTCANSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@@H+](CC2CCC(C)CC2)C1)N(C)C ZINC001373381392 1341005820 /nfs/dbraw/zinc/00/58/20/1341005820.db2.gz IDYHNCSSXCGGLE-CSODTCANSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)C1)N(C)C ZINC001373396384 1341011338 /nfs/dbraw/zinc/01/13/38/1341011338.db2.gz SAQAKWLUHDEBDJ-SXLOBPIMSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)C1)N(C)C ZINC001373396384 1341011340 /nfs/dbraw/zinc/01/13/40/1341011340.db2.gz SAQAKWLUHDEBDJ-SXLOBPIMSA-N 1 3 343.515 2.841 10 0 EFAEHO CCc1ccccc1CN1CC(CNC(=O)C(C)(C)[NH+]2CCCC2)C1 ZINC001373528741 1341045123 /nfs/dbraw/zinc/04/51/23/1341045123.db2.gz LTSFLZSJAIICJA-UHFFFAOYSA-N 1 3 343.515 2.671 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1C[NH+](CC2CCC3(CC3)CC2)C1 ZINC001373558828 1341053826 /nfs/dbraw/zinc/05/38/26/1341053826.db2.gz APLJZNNNMQEVQG-CALCHBBNSA-N 1 3 347.547 2.878 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N(C)[C@@H]1CC[N@H+](Cc2ccccc2C)C1 ZINC001373674541 1341094043 /nfs/dbraw/zinc/09/40/43/1341094043.db2.gz VSHKOXQFRHAQCV-RTBURBONSA-N 1 3 349.494 2.708 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2C)C1 ZINC001373674541 1341094044 /nfs/dbraw/zinc/09/40/44/1341094044.db2.gz VSHKOXQFRHAQCV-RTBURBONSA-N 1 3 349.494 2.708 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)[C@@H]1CCN(Cc2ccc(C3CCC3)cc2)C1 ZINC001373680428 1341097225 /nfs/dbraw/zinc/09/72/25/1341097225.db2.gz NKPGNPLIYZCNHW-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccccc1C ZINC001373754966 1341135380 /nfs/dbraw/zinc/13/53/80/1341135380.db2.gz QTAFTKGYMIZRJT-RTBURBONSA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)NCc1cc(C)ccc1F ZINC001373791311 1341148623 /nfs/dbraw/zinc/14/86/23/1341148623.db2.gz ONBDGXFAOQEDME-BQFCYCMXSA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)NCc1cc(C)ccc1F ZINC001373791311 1341148625 /nfs/dbraw/zinc/14/86/25/1341148625.db2.gz ONBDGXFAOQEDME-BQFCYCMXSA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccccc1C1CC1 ZINC001373797872 1341152029 /nfs/dbraw/zinc/15/20/29/1341152029.db2.gz NIIRJOMVAAQEPK-APWZRJJASA-N 1 3 343.515 2.890 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CCC(F)(F)CC1 ZINC001373800480 1341152754 /nfs/dbraw/zinc/15/27/54/1341152754.db2.gz YBERTTVOVCUNAA-GDBMZVCRSA-N 1 3 345.478 2.638 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@H]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001373920208 1341203738 /nfs/dbraw/zinc/20/37/38/1341203738.db2.gz KIQSBLPEUBWQAL-BZUAXINKSA-N 1 3 329.504 2.729 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[C@H]([NH2+]CC2CC3(CCC3)C2)CC1)N(C)C ZINC001373921119 1341204064 /nfs/dbraw/zinc/20/40/64/1341204064.db2.gz OLRUGJRSUMODEL-BZSNNMDCSA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1ccc(CN2CCC(CCNC(=O)CC[NH+](C)C)CC2)cc1F ZINC001373947271 1341236287 /nfs/dbraw/zinc/23/62/87/1341236287.db2.gz UXVRAESYDHGPPN-UHFFFAOYSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[C@H](C(=O)NCCC1CC[NH+](CCC(C)(C)C)CC1)N(C)C ZINC001373950359 1341241832 /nfs/dbraw/zinc/24/18/32/1341241832.db2.gz RYMOOHMBNCZXSF-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H](CNC/C(Cl)=C/Cl)CNC(=O)C(C)(C)[NH+]1CCCC1 ZINC001374047010 1341334494 /nfs/dbraw/zinc/33/44/94/1341334494.db2.gz HDCQUIWVZXNKRP-OEMOTLHWSA-N 1 3 336.307 2.522 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+][C@H](C)c1ccccc1 ZINC001374053026 1341340749 /nfs/dbraw/zinc/34/07/49/1341340749.db2.gz OMMZGGUXCTYLKE-DLBZAZTESA-N 1 3 331.504 2.964 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+][C@@H](C)c1ccccc1 ZINC001374053033 1341340844 /nfs/dbraw/zinc/34/08/44/1341340844.db2.gz OMMZGGUXCTYLKE-IRXDYDNUSA-N 1 3 331.504 2.964 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001374112071 1341422108 /nfs/dbraw/zinc/42/21/08/1341422108.db2.gz IMNLJFYBXZTDFJ-ZDUSSCGKSA-N 1 3 343.874 2.661 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+]C[C@@H]2CCC(F)(F)C2)CCCC1)N(C)C ZINC001374164528 1341489588 /nfs/dbraw/zinc/48/95/88/1341489588.db2.gz ZONQOJKAVSWHGR-HUUCEWRRSA-N 1 3 345.478 2.781 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H](C)CNC(=O)[C@H](C(C)C)N(C)C)c1 ZINC001391896546 1355631789 /nfs/dbraw/zinc/63/17/89/1355631789.db2.gz HGUKPXJWEJXTMM-YJBOKZPZSA-N 1 3 337.483 2.562 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)N(C)C(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001374227474 1341579427 /nfs/dbraw/zinc/57/94/27/1341579427.db2.gz YUGRLYFZPZSAHM-WMLDXEAASA-N 1 3 349.906 2.618 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001374249904 1341607925 /nfs/dbraw/zinc/60/79/25/1341607925.db2.gz KMLKVIZWBVOKEM-WMLDXEAASA-N 1 3 339.911 2.925 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccccc1C1CC1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001374280180 1341651642 /nfs/dbraw/zinc/65/16/42/1341651642.db2.gz LPYNLHCGVAKCCH-DLBZAZTESA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccccc1)N(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001392103525 1355768060 /nfs/dbraw/zinc/76/80/60/1355768060.db2.gz VTSMJSKUZLVYFZ-OXQOHEQNSA-N 1 3 349.494 2.836 10 0 EFAEHO C[C@H](C[NH2+][C@@H]1CCCc2ccccc21)N(C)C(=O)CN1CCCC1 ZINC001374326497 1341729177 /nfs/dbraw/zinc/72/91/77/1341729177.db2.gz MPBQMUZNFCAYMY-VQIMIIECSA-N 1 3 329.488 2.596 10 0 EFAEHO C[C@H]([NH2+]C/C(Cl)=C/Cl)[C@@H]1CCCN(C(=O)CN2CCCC2)C1 ZINC001374386305 1341837330 /nfs/dbraw/zinc/83/73/30/1341837330.db2.gz CDPPBBUUUNHHIT-AVWIDUKFSA-N 1 3 348.318 2.618 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]CCC(F)(F)F ZINC001374419792 1341898639 /nfs/dbraw/zinc/89/86/39/1341898639.db2.gz PSWFGHXMILSBRH-KGLIPLIRSA-N 1 3 337.430 2.542 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]CC1CC2(CCC2)C1 ZINC001374434131 1341917773 /nfs/dbraw/zinc/91/77/73/1341917773.db2.gz PSGMZSJSDGHFKI-WMZOPIPTSA-N 1 3 335.536 2.639 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NCc1sccc1Cl ZINC001374444541 1341929351 /nfs/dbraw/zinc/92/93/51/1341929351.db2.gz AFUNGMCPHACVLW-GXTWGEPZSA-N 1 3 343.924 2.584 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NCc1sccc1Cl ZINC001374444541 1341929352 /nfs/dbraw/zinc/92/93/52/1341929352.db2.gz AFUNGMCPHACVLW-GXTWGEPZSA-N 1 3 343.924 2.584 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001374505714 1341995001 /nfs/dbraw/zinc/99/50/01/1341995001.db2.gz FETINHAZVDDYPQ-WMZOPIPTSA-N 1 3 349.544 2.698 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001374505714 1341995003 /nfs/dbraw/zinc/99/50/03/1341995003.db2.gz FETINHAZVDDYPQ-WMZOPIPTSA-N 1 3 349.544 2.698 10 0 EFAEHO COc1ccc(CN(C)C[C@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)cc1 ZINC001392663126 1356210295 /nfs/dbraw/zinc/21/02/95/1356210295.db2.gz NFRSDQHZQXLPRS-WMZOPIPTSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1ccc(CN(C)C[C@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)cc1 ZINC001392663126 1356210296 /nfs/dbraw/zinc/21/02/96/1356210296.db2.gz NFRSDQHZQXLPRS-WMZOPIPTSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@H](C[N@H+](C)Cc1ccc2cc[nH]c2c1)NC(=O)CN(C)C1CCC1 ZINC001392662886 1356210395 /nfs/dbraw/zinc/21/03/95/1356210395.db2.gz UYRKTYQMDQDPQB-OAHLLOKOSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@H](C[N@@H+](C)Cc1ccc2cc[nH]c2c1)NC(=O)CN(C)C1CCC1 ZINC001392662886 1356210398 /nfs/dbraw/zinc/21/03/98/1356210398.db2.gz UYRKTYQMDQDPQB-OAHLLOKOSA-N 1 3 342.487 2.589 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1)Cc1ccccc1 ZINC001374551812 1342060798 /nfs/dbraw/zinc/06/07/98/1342060798.db2.gz TYPSVLONLLASMD-RTBURBONSA-N 1 3 331.504 2.697 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)CC1CCC(F)(F)CC1 ZINC001392733710 1356293003 /nfs/dbraw/zinc/29/30/03/1356293003.db2.gz ZBNLZYXIWWVAMG-CQSZACIVSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)CC1CCC(F)(F)CC1 ZINC001392733710 1356293006 /nfs/dbraw/zinc/29/30/06/1356293006.db2.gz ZBNLZYXIWWVAMG-CQSZACIVSA-N 1 3 333.467 2.589 10 0 EFAEHO C[C@@H](CC[NH2+][C@H]1CCc2ccccc21)NC(=O)C1(N(C)C)CCC1 ZINC001374691688 1342111828 /nfs/dbraw/zinc/11/18/28/1342111828.db2.gz FVLCUVPXEONPKK-YJBOKZPZSA-N 1 3 329.488 2.643 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@@H]2CCC[N@H+]2CC(C)C)c1 ZINC001374780130 1342167324 /nfs/dbraw/zinc/16/73/24/1342167324.db2.gz VOGHVIQHWDJAEF-APWZRJJASA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@@H]2CCC[N@@H+]2CC(C)C)c1 ZINC001374780130 1342167328 /nfs/dbraw/zinc/16/73/28/1342167328.db2.gz VOGHVIQHWDJAEF-APWZRJJASA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CNCc1ccccc1F)[NH+]1CCCC1 ZINC001374981237 1342285109 /nfs/dbraw/zinc/28/51/09/1342285109.db2.gz JTIAYCBFLAJLGS-YJBOKZPZSA-N 1 3 335.467 2.540 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(F)c1)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001375064296 1342368317 /nfs/dbraw/zinc/36/83/17/1342368317.db2.gz ZAFCQLVHXSXQOT-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(F)c1)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001375064296 1342368323 /nfs/dbraw/zinc/36/83/23/1342368323.db2.gz ZAFCQLVHXSXQOT-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC[C@](C)(CNC(=O)CN(C)C(C)C)C1 ZINC001393210909 1356727356 /nfs/dbraw/zinc/72/73/56/1356727356.db2.gz XUJRKOCESHAKGX-LJQANCHMSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)CCC[N@H+]1CCC[C@](C)(CNC(=O)CN(C)C(C)C)C1 ZINC001393210909 1356727361 /nfs/dbraw/zinc/72/73/61/1356727361.db2.gz XUJRKOCESHAKGX-LJQANCHMSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@H](C[N@H+](C)CCCc1cccc(F)c1)NC(=O)CN1CC[C@H](C)C1 ZINC001375105946 1342415254 /nfs/dbraw/zinc/41/52/54/1342415254.db2.gz UYPVJIYKXUMXSU-DLBZAZTESA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@H](C[N@@H+](C)CCCc1cccc(F)c1)NC(=O)CN1CC[C@H](C)C1 ZINC001375105946 1342415256 /nfs/dbraw/zinc/41/52/56/1342415256.db2.gz UYPVJIYKXUMXSU-DLBZAZTESA-N 1 3 349.494 2.537 10 0 EFAEHO CC(C)c1ccccc1CN(C)C[C@H](C)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001375156401 1342472946 /nfs/dbraw/zinc/47/29/46/1342472946.db2.gz WWBZNDICEGYEKT-FUHWJXTLSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)c1ccccc1CN(C)C[C@H](C)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001375156401 1342472947 /nfs/dbraw/zinc/47/29/47/1342472947.db2.gz WWBZNDICEGYEKT-FUHWJXTLSA-N 1 3 331.504 2.698 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001393494815 1356896829 /nfs/dbraw/zinc/89/68/29/1356896829.db2.gz VCSSCKCYHJQVAE-LUKYLMHMSA-N 1 3 329.504 2.585 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[N@@H+]1CC1CCC2(CC2)CC1)N(C)C ZINC001375318570 1342624688 /nfs/dbraw/zinc/62/46/88/1342624688.db2.gz OGSXTGXNZVMFPU-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[N@H+]1CC1CCC2(CC2)CC1)N(C)C ZINC001375318570 1342624694 /nfs/dbraw/zinc/62/46/94/1342624694.db2.gz OGSXTGXNZVMFPU-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CC[N@@H+]1CC1CCC2(CC2)CC1)N(C)C ZINC001375340955 1342647221 /nfs/dbraw/zinc/64/72/21/1342647221.db2.gz OGSXTGXNZVMFPU-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CC[N@H+]1CC1CCC2(CC2)CC1)N(C)C ZINC001375340955 1342647224 /nfs/dbraw/zinc/64/72/24/1342647224.db2.gz OGSXTGXNZVMFPU-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCC1(NCc2ccsc2)CCC1 ZINC001393545459 1356936730 /nfs/dbraw/zinc/93/67/30/1356936730.db2.gz NJXBCZIVAHLTAX-MRXNPFEDSA-N 1 3 335.517 2.751 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCC1(NCc2ccsc2)CCC1 ZINC001393545459 1356936733 /nfs/dbraw/zinc/93/67/33/1356936733.db2.gz NJXBCZIVAHLTAX-MRXNPFEDSA-N 1 3 335.517 2.751 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@@H]1CCN1Cc1c(C)cc(C)cc1C ZINC001375356490 1342661853 /nfs/dbraw/zinc/66/18/53/1342661853.db2.gz LSGIYQZSKDZUJM-SFHVURJKSA-N 1 3 331.504 2.644 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@@H]1CCN1Cc1c(C)cc(C)cc1C ZINC001375356490 1342661858 /nfs/dbraw/zinc/66/18/58/1342661858.db2.gz LSGIYQZSKDZUJM-SFHVURJKSA-N 1 3 331.504 2.644 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]C[C@H]3CCCC(F)(F)C3)CC2)CCC1 ZINC001375429149 1342732551 /nfs/dbraw/zinc/73/25/51/1342732551.db2.gz LEOPARWHKPSTKE-AWEZNQCLSA-N 1 3 343.462 2.535 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C2(CNC(=O)C3(N(C)C)CCC3)CC2)c(C)c1 ZINC001375428887 1342732780 /nfs/dbraw/zinc/73/27/80/1342732780.db2.gz IJUDKKJNPIALDY-UHFFFAOYSA-N 1 3 343.515 2.835 10 0 EFAEHO Cc1cc(F)ccc1CNC1(CNC(=O)CC[C@@H]2CCC[N@H+]2C)CC1 ZINC001375433573 1342737917 /nfs/dbraw/zinc/73/79/17/1342737917.db2.gz UPHYSDDMJZQFJT-SFHVURJKSA-N 1 3 347.478 2.747 10 0 EFAEHO Cc1cc(F)ccc1CNC1(CNC(=O)CC[C@@H]2CCC[N@@H+]2C)CC1 ZINC001375433573 1342737920 /nfs/dbraw/zinc/73/79/20/1342737920.db2.gz UPHYSDDMJZQFJT-SFHVURJKSA-N 1 3 347.478 2.747 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+][C@@H](C)c2ccc3c(c2)CCC3)CC1)N(C)C ZINC001375436174 1342740159 /nfs/dbraw/zinc/74/01/59/1342740159.db2.gz LANMAJKNQIGMHA-HNAYVOBHSA-N 1 3 343.515 2.815 10 0 EFAEHO CCCCN1CC[C@@H]1CN(C)C(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001375461652 1342766422 /nfs/dbraw/zinc/76/64/22/1342766422.db2.gz BZQDLAXCNGDINB-CRAIPNDOSA-N 1 3 327.488 2.532 10 0 EFAEHO CCCCN1CC[C@@H]1CN(C)C(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001375461652 1342766424 /nfs/dbraw/zinc/76/64/24/1342766424.db2.gz BZQDLAXCNGDINB-CRAIPNDOSA-N 1 3 327.488 2.532 10 0 EFAEHO C[C@@H](NC1(CNC(=O)C[C@H]2CC[N@H+](C)C2)CC1)c1cccc(Cl)c1 ZINC001375523801 1342833192 /nfs/dbraw/zinc/83/31/92/1342833192.db2.gz XKPHYIHORJROSK-HUUCEWRRSA-N 1 3 349.906 2.981 10 0 EFAEHO C[C@@H](NC1(CNC(=O)C[C@H]2CC[N@@H+](C)C2)CC1)c1cccc(Cl)c1 ZINC001375523801 1342833196 /nfs/dbraw/zinc/83/31/96/1342833196.db2.gz XKPHYIHORJROSK-HUUCEWRRSA-N 1 3 349.906 2.981 10 0 EFAEHO C[C@H](NC1(CNC(=O)C[C@@H]2CC[N@H+](C)C2)CC1)c1cccc(Cl)c1 ZINC001375523797 1342833934 /nfs/dbraw/zinc/83/39/34/1342833934.db2.gz XKPHYIHORJROSK-GJZGRUSLSA-N 1 3 349.906 2.981 10 0 EFAEHO C[C@H](NC1(CNC(=O)C[C@@H]2CC[N@@H+](C)C2)CC1)c1cccc(Cl)c1 ZINC001375523797 1342833944 /nfs/dbraw/zinc/83/39/44/1342833944.db2.gz XKPHYIHORJROSK-GJZGRUSLSA-N 1 3 349.906 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@H+](CCC3CC3)[C@H]2C1(C)C ZINC001375596908 1342914491 /nfs/dbraw/zinc/91/44/91/1342914491.db2.gz GAEJFTIUELMWMG-QXAKKESOSA-N 1 3 335.536 2.732 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@@H+](CCC3CC3)[C@H]2C1(C)C ZINC001375596908 1342914497 /nfs/dbraw/zinc/91/44/97/1342914497.db2.gz GAEJFTIUELMWMG-QXAKKESOSA-N 1 3 335.536 2.732 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN1CCC(C)CC1 ZINC001375596319 1342914697 /nfs/dbraw/zinc/91/46/97/1342914697.db2.gz LIVDUVWWTJCXJF-KURKYZTESA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2CCC[N@H+](CCC3CC3)[C@H]2C1(C)C ZINC001375596881 1342914879 /nfs/dbraw/zinc/91/48/79/1342914879.db2.gz GAEJFTIUELMWMG-BHIYHBOVSA-N 1 3 335.536 2.732 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2CCC[N@@H+](CCC3CC3)[C@H]2C1(C)C ZINC001375596881 1342914880 /nfs/dbraw/zinc/91/48/80/1342914880.db2.gz GAEJFTIUELMWMG-BHIYHBOVSA-N 1 3 335.536 2.732 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCN(C/C=C\Cl)CC(C)(C)C1)[NH+](C)C ZINC001375690784 1342932070 /nfs/dbraw/zinc/93/20/70/1342932070.db2.gz VACRVDILJNFOSJ-LRDXNBAQSA-N 1 3 343.943 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+][C@@H]1CCCc2ccccc21 ZINC001375768035 1342989239 /nfs/dbraw/zinc/98/92/39/1342989239.db2.gz JAFFYELPYOYYEX-AZUAARDMSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C)CC[NH+](CCc2ccccc2F)CC1 ZINC001375781401 1343004236 /nfs/dbraw/zinc/00/42/36/1343004236.db2.gz SRPFCYQTMQRTJB-UHFFFAOYSA-N 1 3 349.494 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]Cc1ccc(F)cc1)C1CCCC1 ZINC001375794430 1343022106 /nfs/dbraw/zinc/02/21/06/1343022106.db2.gz XGZAWZXQWAFWGR-IBGZPJMESA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCC1)N(CC)CC ZINC001375800522 1343027905 /nfs/dbraw/zinc/02/79/05/1343027905.db2.gz DETCLRNRGDXKEB-CEXWTWQISA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2CC1CCC1)N(CC)CC ZINC001375800522 1343027906 /nfs/dbraw/zinc/02/79/06/1343027906.db2.gz DETCLRNRGDXKEB-CEXWTWQISA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@](C)(C[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001375875466 1343121477 /nfs/dbraw/zinc/12/14/77/1343121477.db2.gz PYWCKERZACGPHO-AZUAARDMSA-N 1 3 349.563 2.981 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2cccc(C)c2)C1)N(C)C ZINC001375895100 1343142237 /nfs/dbraw/zinc/14/22/37/1343142237.db2.gz GPEIRBLAAAGZOS-QUCCMNQESA-N 1 3 331.504 2.663 10 0 EFAEHO C[C@H](F)CC[NH+]1CCC(C)(CNC(=O)C(C)(C)N2CCCC2)CC1 ZINC001375921268 1343169461 /nfs/dbraw/zinc/16/94/61/1343169461.db2.gz FSWQEJVQQYYFPE-INIZCTEOSA-N 1 3 341.515 2.827 10 0 EFAEHO CN(C)C1(C(=O)N2CCC(C)([NH2+]CCc3cccs3)CC2)CCC1 ZINC001393735000 1357112720 /nfs/dbraw/zinc/11/27/20/1357112720.db2.gz JTLIJFONPKGUJU-UHFFFAOYSA-N 1 3 349.544 2.746 10 0 EFAEHO Cc1ncccc1C[NH2+][C@H](C)[C@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001376007532 1343254957 /nfs/dbraw/zinc/25/49/57/1343254957.db2.gz CDZIACIWKJAYNR-IEBWSBKVSA-N 1 3 346.519 2.589 10 0 EFAEHO CC(C)CCC[NH+]1CCC2(C[C@@H]2NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001376174803 1343374672 /nfs/dbraw/zinc/37/46/72/1343374672.db2.gz BZYZGXGPXCVMLR-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC12CC[NH+](CCC(C)(C)C)CC2)N(C)C ZINC001376175746 1343376647 /nfs/dbraw/zinc/37/66/47/1343376647.db2.gz SOUVVVDLWHYOSC-DLBZAZTESA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](NCC=C(Cl)Cl)C1CC1 ZINC001376210966 1343401499 /nfs/dbraw/zinc/40/14/99/1343401499.db2.gz BEUAXPLAIGTASX-ZIAGYGMSSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](NCC=C(Cl)Cl)C1CC1 ZINC001376210966 1343401500 /nfs/dbraw/zinc/40/15/00/1343401500.db2.gz BEUAXPLAIGTASX-ZIAGYGMSSA-N 1 3 348.318 2.663 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccc(C)c(C)c1)C1CC1)N(C)C ZINC001376211585 1343401829 /nfs/dbraw/zinc/40/18/29/1343401829.db2.gz CPXVHWKCJFYMBX-RTBURBONSA-N 1 3 331.504 2.628 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]([NH2+]CCC2CCCCC2)C2CC2)CCC1 ZINC001376219180 1343406655 /nfs/dbraw/zinc/40/66/55/1343406655.db2.gz RUQRDHFZAZXKHP-SFHVURJKSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)(C(=O)NC[C@H]([NH2+]CC1CCCC1)C1CC1)N1CCCCC1 ZINC001376219846 1343407410 /nfs/dbraw/zinc/40/74/10/1343407410.db2.gz NUJYUZCVHVJAFY-SFHVURJKSA-N 1 3 335.536 2.926 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCC1CCCC1)C2 ZINC001376312478 1343475522 /nfs/dbraw/zinc/47/55/22/1343475522.db2.gz JDSIOCAMPRGNFO-FHWLQOOXSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCC1CCCC1)C2 ZINC001376312478 1343475523 /nfs/dbraw/zinc/47/55/23/1343475523.db2.gz JDSIOCAMPRGNFO-FHWLQOOXSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CC[C@H]2CCc3ccccc32)C1 ZINC001376353066 1343506603 /nfs/dbraw/zinc/50/66/03/1343506603.db2.gz NPXGATKNUWFPOD-MOPGFXCFSA-N 1 3 343.515 2.637 10 0 EFAEHO CC[C@H](F)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C2 ZINC001376376506 1343529168 /nfs/dbraw/zinc/52/91/68/1343529168.db2.gz IOVPDTWASYUSTK-IECFSIQFSA-N 1 3 341.515 2.680 10 0 EFAEHO CC[C@H](F)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C2 ZINC001376376506 1343529170 /nfs/dbraw/zinc/52/91/70/1343529170.db2.gz IOVPDTWASYUSTK-IECFSIQFSA-N 1 3 341.515 2.680 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cc3ccccc3s2)C1)N(C)C ZINC001376468832 1343614150 /nfs/dbraw/zinc/61/41/50/1343614150.db2.gz GDIHNXSWCRQXHE-HLLBOEOZSA-N 1 3 345.512 2.978 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]CC[C@@H]2CCc3ccccc32)C1 ZINC001376493582 1343625239 /nfs/dbraw/zinc/62/52/39/1343625239.db2.gz JSRHQZJVDFXACP-GBESFXJTSA-N 1 3 343.515 2.685 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001376492312 1343625415 /nfs/dbraw/zinc/62/54/15/1343625415.db2.gz UZWQTYQMPCZPGO-GDAAHCPNSA-N 1 3 331.504 2.879 10 0 EFAEHO CCc1ccc(C[N@H+]2CCC[C@@H](CNC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001376511352 1343637841 /nfs/dbraw/zinc/63/78/41/1343637841.db2.gz QPVIKBBPPJSZIF-VQTJNVASSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccc(C[N@@H+]2CCC[C@@H](CNC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001376511352 1343637843 /nfs/dbraw/zinc/63/78/43/1343637843.db2.gz QPVIKBBPPJSZIF-VQTJNVASSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccc(C[N@H+]2CCC[C@H](CNC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001376511353 1343637903 /nfs/dbraw/zinc/63/79/03/1343637903.db2.gz QPVIKBBPPJSZIF-WOJBJXKFSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccc(C[N@@H+]2CCC[C@H](CNC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001376511353 1343637905 /nfs/dbraw/zinc/63/79/05/1343637905.db2.gz QPVIKBBPPJSZIF-WOJBJXKFSA-N 1 3 345.531 2.917 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(F)cc1 ZINC001376521357 1343646548 /nfs/dbraw/zinc/64/65/48/1343646548.db2.gz WRSKPELIWXUCMC-OALUTQOASA-N 1 3 347.478 2.733 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N1C[C@@H]2CCCN(C(=O)CC[NH+](C)C)[C@@H]2C1 ZINC001376530008 1343655093 /nfs/dbraw/zinc/65/50/93/1343655093.db2.gz JSPBBGQSIUHYNA-HHXXYDBFSA-N 1 3 347.478 2.761 10 0 EFAEHO CN(C)C1(C(=O)NCc2ccccc2C[N@H+](C)CCCF)CCC1 ZINC001376558961 1343674959 /nfs/dbraw/zinc/67/49/59/1343674959.db2.gz DCCMEWCECTZJAY-UHFFFAOYSA-N 1 3 335.467 2.579 10 0 EFAEHO CN(C)C1(C(=O)NCc2ccccc2C[N@@H+](C)CCCF)CCC1 ZINC001376558961 1343674960 /nfs/dbraw/zinc/67/49/60/1343674960.db2.gz DCCMEWCECTZJAY-UHFFFAOYSA-N 1 3 335.467 2.579 10 0 EFAEHO CC(C)C[N@H+](C)Cc1ccccc1CNC(=O)CN1CC[C@H](C)C1 ZINC001376560648 1343677321 /nfs/dbraw/zinc/67/73/21/1343677321.db2.gz JTEFKXRTTXWKEV-KRWDZBQOSA-N 1 3 331.504 2.732 10 0 EFAEHO CC(C)C[N@@H+](C)Cc1ccccc1CNC(=O)CN1CC[C@H](C)C1 ZINC001376560648 1343677322 /nfs/dbraw/zinc/67/73/22/1343677322.db2.gz JTEFKXRTTXWKEV-KRWDZBQOSA-N 1 3 331.504 2.732 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCC[N@@H+]1CCC1CC1)N1CCCC1 ZINC001376589244 1343706992 /nfs/dbraw/zinc/70/69/92/1343706992.db2.gz FZKUXXADJWKHFT-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCC[N@H+]1CCC1CC1)N1CCCC1 ZINC001376589244 1343706995 /nfs/dbraw/zinc/70/69/95/1343706995.db2.gz FZKUXXADJWKHFT-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001376598591 1343712680 /nfs/dbraw/zinc/71/26/80/1343712680.db2.gz GDGCQRFPUMWISZ-XLAORIBOSA-N 1 3 325.541 2.883 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1cc(C)sc1C ZINC001376731365 1343788945 /nfs/dbraw/zinc/78/89/45/1343788945.db2.gz NPQJDAFYTMJDNR-GUYCJALGSA-N 1 3 337.533 2.834 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[N@H+](Cc2ccc(C)nc2C)CC1 ZINC001376906570 1343945610 /nfs/dbraw/zinc/94/56/10/1343945610.db2.gz BYXUCIHFRRAISF-LJQANCHMSA-N 1 3 346.519 2.511 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[N@@H+](Cc2ccc(C)nc2C)CC1 ZINC001376906570 1343945615 /nfs/dbraw/zinc/94/56/15/1343945615.db2.gz BYXUCIHFRRAISF-LJQANCHMSA-N 1 3 346.519 2.511 10 0 EFAEHO CC(C)(C(=O)N1CC[C@@H](CNC/C(Cl)=C/Cl)C1)[NH+]1CCCC1 ZINC001376941696 1343972339 /nfs/dbraw/zinc/97/23/39/1343972339.db2.gz OHKOMGOZTAYFFF-GFAPJHNFSA-N 1 3 348.318 2.618 10 0 EFAEHO CC(C)CCC[N@H+](C)[C@H]1CCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001376975360 1344005548 /nfs/dbraw/zinc/00/55/48/1344005548.db2.gz CGBNAXQTQQLCCM-ROUUACIJSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)CCC[N@@H+](C)[C@H]1CCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001376975360 1344005552 /nfs/dbraw/zinc/00/55/52/1344005552.db2.gz CGBNAXQTQQLCCM-ROUUACIJSA-N 1 3 325.541 2.932 10 0 EFAEHO CN(CCC[N@H+](C)Cc1ccc(C2CC2)cc1)C(=O)CN1CCCC1 ZINC001377019014 1344065877 /nfs/dbraw/zinc/06/58/77/1344065877.db2.gz LYEHEGQSYSCNEG-UHFFFAOYSA-N 1 3 343.515 2.940 10 0 EFAEHO CN(CCC[N@@H+](C)Cc1ccc(C2CC2)cc1)C(=O)CN1CCCC1 ZINC001377019014 1344065880 /nfs/dbraw/zinc/06/58/80/1344065880.db2.gz LYEHEGQSYSCNEG-UHFFFAOYSA-N 1 3 343.515 2.940 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1cc2ccccc2o1)N(C)C ZINC001377051374 1344096657 /nfs/dbraw/zinc/09/66/57/1344096657.db2.gz PHJFGLFEIRIFFP-RHSMWYFYSA-N 1 3 331.460 2.757 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(Cl)s1 ZINC001377070846 1344115163 /nfs/dbraw/zinc/11/51/63/1344115163.db2.gz WNLOGNAIHUFMRB-QWHCGFSZSA-N 1 3 343.924 2.728 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@@H+]1CCC1CC1)N1CCCCC1 ZINC001377419551 1344161816 /nfs/dbraw/zinc/16/18/16/1344161816.db2.gz UEHBOOVXDQXVEV-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@H+]1CCC1CC1)N1CCCCC1 ZINC001377419551 1344161820 /nfs/dbraw/zinc/16/18/20/1344161820.db2.gz UEHBOOVXDQXVEV-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)C[NH2+][C@H](CNC(=O)[C@@H]1CCCN1C(C)C)c1ccccc1 ZINC001377618724 1344227015 /nfs/dbraw/zinc/22/70/15/1344227015.db2.gz GNAVCWCYROPXJU-MOPGFXCFSA-N 1 3 331.504 2.962 10 0 EFAEHO CC(C)C[N@H+](C)C[C@@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001377664236 1344289529 /nfs/dbraw/zinc/28/95/29/1344289529.db2.gz RCERXZXPPWXSKL-QFBILLFUSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)C[N@@H+](C)C[C@@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001377664236 1344289533 /nfs/dbraw/zinc/28/95/33/1344289533.db2.gz RCERXZXPPWXSKL-QFBILLFUSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H]1CC[N@H+](CCC(C)(C)C)C1)N(C)C ZINC001377705791 1344349342 /nfs/dbraw/zinc/34/93/42/1344349342.db2.gz HIVBJJVBSRGBGO-DLBZAZTESA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H]1CC[N@@H+](CCC(C)(C)C)C1)N(C)C ZINC001377705791 1344349348 /nfs/dbraw/zinc/34/93/48/1344349348.db2.gz HIVBJJVBSRGBGO-DLBZAZTESA-N 1 3 325.541 2.837 10 0 EFAEHO Cc1cccc(C[NH2+]CC2CC(NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001377712625 1344358495 /nfs/dbraw/zinc/35/84/95/1344358495.db2.gz GVSONTYBEKXRGM-ACBHZAAOSA-N 1 3 331.504 2.566 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]Cc2sccc2Cl)C1)N(C)C ZINC001377725247 1344375101 /nfs/dbraw/zinc/37/51/01/1344375101.db2.gz HGWHKADKASITCE-YIZWMMSDSA-N 1 3 343.924 2.726 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]Cc2ccc(Cl)s2)C1 ZINC001377735195 1344383728 /nfs/dbraw/zinc/38/37/28/1344383728.db2.gz XQBJVOQEHQCTCQ-UHFFFAOYSA-N 1 3 343.924 2.726 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1CC(C[NH2+]Cc2ccc(CF)cc2)C1)N(C)C ZINC001377735844 1344384401 /nfs/dbraw/zinc/38/44/01/1344384401.db2.gz LNHBFOVZKDBJIN-ACBHZAAOSA-N 1 3 349.494 2.727 10 0 EFAEHO CC[C@H](C)C[N@H+](C)CC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001377786744 1344438384 /nfs/dbraw/zinc/43/83/84/1344438384.db2.gz BZECQYANOFESNX-WMZOPIPTSA-N 1 3 325.541 2.789 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)CC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001377786744 1344438386 /nfs/dbraw/zinc/43/83/86/1344438386.db2.gz BZECQYANOFESNX-WMZOPIPTSA-N 1 3 325.541 2.789 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)cc1 ZINC001377808951 1344459941 /nfs/dbraw/zinc/45/99/41/1344459941.db2.gz QCEYOPMNOJHHFW-CVEARBPZSA-N 1 3 331.504 2.716 10 0 EFAEHO C[C@@H]([NH2+]CCc1ccccc1)[C@H](C)NC(=O)CN(C)CC(C)(C)C ZINC001377849318 1344506590 /nfs/dbraw/zinc/50/65/90/1344506590.db2.gz HIKAKKDXUOASMT-SJORKVTESA-N 1 3 333.520 2.690 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)[C@H](C)NC(=O)C12CC[NH+](CC1)C2 ZINC001377888404 1344549209 /nfs/dbraw/zinc/54/92/09/1344549209.db2.gz YNLJSPSIFYYIJZ-GJZGRUSLSA-N 1 3 349.906 2.727 10 0 EFAEHO CC(C)C[NH2+]CC(C)(C)CN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001377963252 1344620134 /nfs/dbraw/zinc/62/01/34/1344620134.db2.gz QZCBGMVVJZRQBO-LJQANCHMSA-N 1 3 343.531 2.929 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1CN([C@H](C)c2ccccc2)C1)[NH+]1CCCC1 ZINC001378020198 1344671104 /nfs/dbraw/zinc/67/11/04/1344671104.db2.gz JNNFQDZOLUCSTR-YLJYHZDGSA-N 1 3 343.515 2.916 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[N@H+](C)Cc1ccc(C2CC2)cc1 ZINC001378064171 1344716955 /nfs/dbraw/zinc/71/69/55/1344716955.db2.gz MEQBVASNHSSXED-MRXNPFEDSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)[N@@H+](C)Cc1ccc(C2CC2)cc1 ZINC001378064171 1344716958 /nfs/dbraw/zinc/71/69/58/1344716958.db2.gz MEQBVASNHSSXED-MRXNPFEDSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H](F)CCN1CC[C@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001378064919 1344719061 /nfs/dbraw/zinc/71/90/61/1344719061.db2.gz UAKVVFKGHQWTAI-CABCVRRESA-N 1 3 327.488 2.578 10 0 EFAEHO C[C@@H](F)CCN1CC[C@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001378064919 1344719062 /nfs/dbraw/zinc/71/90/62/1344719062.db2.gz UAKVVFKGHQWTAI-CABCVRRESA-N 1 3 327.488 2.578 10 0 EFAEHO CCc1ccc(C[N@H+](C)[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001378148551 1344812884 /nfs/dbraw/zinc/81/28/84/1344812884.db2.gz VSHDGVLRSAXYRH-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(C[N@@H+](C)[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001378148551 1344812888 /nfs/dbraw/zinc/81/28/88/1344812888.db2.gz VSHDGVLRSAXYRH-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO CC[C@@H](C(=O)N(C)[C@H]1CCN(CC2CC(F)(F)C2)C1)[NH+](CC)CC ZINC001378167567 1344836998 /nfs/dbraw/zinc/83/69/98/1344836998.db2.gz HWCKGANAQWOCOJ-HOTGVXAUSA-N 1 3 345.478 2.685 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H](C(C)C)[NH+](C)C)NCc1ccc(F)cc1F ZINC001378254058 1344933672 /nfs/dbraw/zinc/93/36/72/1344933672.db2.gz FDEQNYSRLTYKLV-RDJZCZTQSA-N 1 3 341.446 2.535 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H]1CC[C@H]([NH2+]C[C@H](F)CC)CC1 ZINC001378435974 1345074169 /nfs/dbraw/zinc/07/41/69/1345074169.db2.gz BMHVQDUNYFJFLH-VQHPVUNQSA-N 1 3 327.488 2.626 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1ccc(C[NH2+]CC2CCCC2)cc1 ZINC001378458761 1345094490 /nfs/dbraw/zinc/09/44/90/1345094490.db2.gz DTCZNJUKXIZQGJ-UHFFFAOYSA-N 1 3 331.504 2.923 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCCCCC1)C1C[NH+](CC2CCCC2)C1 ZINC001378555009 1345159813 /nfs/dbraw/zinc/15/98/13/1345159813.db2.gz IWPGKTUIDGYEIG-IAGOWNOFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1C[NH+](CC2CCC3(CC3)CC2)C1 ZINC001378587835 1345183020 /nfs/dbraw/zinc/18/30/20/1345183020.db2.gz PGRWFPVBPNVOMY-MRXNPFEDSA-N 1 3 335.536 2.734 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@@H](C)C[NH2+]Cc1cc(C)ccc1F ZINC001378632909 1345212038 /nfs/dbraw/zinc/21/20/38/1345212038.db2.gz KOSZXALZFVEIMF-LPHOPBHVSA-N 1 3 349.494 2.850 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1(NCc2sccc2Cl)CCCC1 ZINC001378713812 1345268979 /nfs/dbraw/zinc/26/89/79/1345268979.db2.gz DMXIGAMNRFAKEC-UHFFFAOYSA-N 1 3 343.924 2.872 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001378786720 1345316204 /nfs/dbraw/zinc/31/62/04/1345316204.db2.gz QGPNPVWJMFQWRG-FHWLQOOXSA-N 1 3 337.552 2.980 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C1 ZINC001378786720 1345316207 /nfs/dbraw/zinc/31/62/07/1345316207.db2.gz QGPNPVWJMFQWRG-FHWLQOOXSA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)N(C)C(=O)CC[NH+](C)C)c(Cl)c1 ZINC001378806656 1345328643 /nfs/dbraw/zinc/32/86/43/1345328643.db2.gz FURXEEBVBSJDSF-CQSZACIVSA-N 1 3 325.884 2.537 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001378824164 1345342232 /nfs/dbraw/zinc/34/22/32/1345342232.db2.gz DCBAJTZVWIRASM-SJLPKXTDSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)cc1C ZINC001378826917 1345344562 /nfs/dbraw/zinc/34/45/62/1345344562.db2.gz HBSSGWUSGVYFTH-QAPCUYQASA-N 1 3 331.504 2.582 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cccc(Cl)c1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001378837729 1345351017 /nfs/dbraw/zinc/35/10/17/1345351017.db2.gz XJKDTHLTGHXICX-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C3CCC3)C2)cc1C ZINC001378844009 1345355390 /nfs/dbraw/zinc/35/53/90/1345355390.db2.gz IRYNQHKZJYITOV-WGSAOQKQSA-N 1 3 343.515 2.772 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2ccccc2F)C1)N(C)C ZINC001378853282 1345365220 /nfs/dbraw/zinc/36/52/20/1345365220.db2.gz OQHUSIHFFOMQSR-YKTARERQSA-N 1 3 349.494 2.957 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccccc1C ZINC001378855909 1345367598 /nfs/dbraw/zinc/36/75/98/1345367598.db2.gz IHJLZZPTBCGBNU-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(Cl)cc2)C1 ZINC001378867027 1345376884 /nfs/dbraw/zinc/37/68/84/1345376884.db2.gz KZXJRLZFFZDPEN-JCNLHEQBSA-N 1 3 337.895 2.666 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H](CC(C)C)NC(=O)CN1CC[C@@H](C)C1 ZINC001378882225 1345391749 /nfs/dbraw/zinc/39/17/49/1345391749.db2.gz NNGGWQDPRVWCJU-XLIONFOSSA-N 1 3 345.531 2.957 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C[NH2+]CC1CC1)C1CCCCC1 ZINC001378888237 1345398677 /nfs/dbraw/zinc/39/86/77/1345398677.db2.gz UFWPCOZOWHFNKM-MOPGFXCFSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)C[NH2+]C[C@@H](C1CC1)N(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001379034529 1345516916 /nfs/dbraw/zinc/51/69/16/1345516916.db2.gz SGRJVCUSKYIJEI-QFBILLFUSA-N 1 3 341.515 2.682 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[N@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001393884110 1357250926 /nfs/dbraw/zinc/25/09/26/1357250926.db2.gz PWDNUTXIDWEBLY-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001393884110 1357250929 /nfs/dbraw/zinc/25/09/29/1357250929.db2.gz PWDNUTXIDWEBLY-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)[N@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001379132457 1345610663 /nfs/dbraw/zinc/61/06/63/1345610663.db2.gz OQNSVKAKUKCVPR-OAHLLOKOSA-N 1 3 337.895 2.887 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)[N@@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001379132457 1345610666 /nfs/dbraw/zinc/61/06/66/1345610666.db2.gz OQNSVKAKUKCVPR-OAHLLOKOSA-N 1 3 337.895 2.887 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)c(C)s1 ZINC001379211352 1345661420 /nfs/dbraw/zinc/66/14/20/1345661420.db2.gz BXHBBOODPMWDEW-KGLIPLIRSA-N 1 3 337.533 2.643 10 0 EFAEHO C[C@H](CN(C)C(=O)C[N@@H+]1CC[C@@H](C)C1)NCc1ccccc1Cl ZINC001379227095 1345669402 /nfs/dbraw/zinc/66/94/02/1345669402.db2.gz UYCIXHPZSKJHCN-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CN(C)C(=O)C[N@H+]1CC[C@@H](C)C1)NCc1ccccc1Cl ZINC001379227095 1345669404 /nfs/dbraw/zinc/66/94/04/1345669404.db2.gz UYCIXHPZSKJHCN-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]CCC(F)(F)F ZINC001379252246 1345682389 /nfs/dbraw/zinc/68/23/89/1345682389.db2.gz YJBONABXAUPDID-ZIAGYGMSSA-N 1 3 337.430 2.638 10 0 EFAEHO C[C@H](CC[NH2+][C@@H]1CCc2ccccc21)NC(=O)CN(C)C1CCC1 ZINC001379297744 1345707478 /nfs/dbraw/zinc/70/74/78/1345707478.db2.gz NPMRTRMASSGYKN-DNVCBOLYSA-N 1 3 329.488 2.643 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]CCc1cccs1 ZINC001379326376 1345729335 /nfs/dbraw/zinc/72/93/35/1345729335.db2.gz IJNHXMYQNFIERZ-RDJZCZTQSA-N 1 3 337.533 2.602 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]CCc1cccs1 ZINC001379326377 1345729958 /nfs/dbraw/zinc/72/99/58/1345729958.db2.gz IJNHXMYQNFIERZ-WBVHZDCISA-N 1 3 337.533 2.602 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(C)nc1C ZINC001379330209 1345733115 /nfs/dbraw/zinc/73/31/15/1345733115.db2.gz OVCCBAGJYHLMIS-LPHOPBHVSA-N 1 3 346.519 2.509 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1sccc1Cl ZINC001379353758 1345744200 /nfs/dbraw/zinc/74/42/00/1345744200.db2.gz HOODQKXALFZLBY-TZMCWYRMSA-N 1 3 343.924 2.869 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1sccc1Cl ZINC001379353758 1345744206 /nfs/dbraw/zinc/74/42/06/1345744206.db2.gz HOODQKXALFZLBY-TZMCWYRMSA-N 1 3 343.924 2.869 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)n1 ZINC001379384483 1345757929 /nfs/dbraw/zinc/75/79/29/1345757929.db2.gz RMYYHBVHPSREOE-SJLPKXTDSA-N 1 3 346.519 2.674 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)n1 ZINC001379384483 1345757932 /nfs/dbraw/zinc/75/79/32/1345757932.db2.gz RMYYHBVHPSREOE-SJLPKXTDSA-N 1 3 346.519 2.674 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C[C@@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001379415011 1345771454 /nfs/dbraw/zinc/77/14/54/1345771454.db2.gz HZWNABVRGAMQLN-IAGOWNOFSA-N 1 3 331.504 2.746 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)CN[C@@H](C)c1cccc(Cl)c1F ZINC001379445542 1345787824 /nfs/dbraw/zinc/78/78/24/1345787824.db2.gz IAPFELWYGLFMAS-OLZOCXBDSA-N 1 3 343.874 2.976 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)CN[C@@H](C)c1cccc(Cl)c1F ZINC001379445542 1345787827 /nfs/dbraw/zinc/78/78/27/1345787827.db2.gz IAPFELWYGLFMAS-OLZOCXBDSA-N 1 3 343.874 2.976 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)C2CC[NH+](C(C)C)CC2)c1 ZINC001379451381 1345791336 /nfs/dbraw/zinc/79/13/36/1345791336.db2.gz QLXRKFSAJPMPAH-MRXNPFEDSA-N 1 3 349.494 2.849 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]CC1CCC(F)(F)CC1 ZINC001379466787 1345801929 /nfs/dbraw/zinc/80/19/29/1345801929.db2.gz MINRKCLDGDDINC-ZBFHGGJFSA-N 1 3 345.478 2.781 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@H]2CCCCN2C(C)C)cc1F ZINC001379563951 1345868435 /nfs/dbraw/zinc/86/84/35/1345868435.db2.gz QCJRRJXIFYYLEJ-QFBILLFUSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@@H](CN[C@@H](C)c1ccccc1Cl)NC(=O)C12CC[NH+](CC1)C2 ZINC001379583970 1345890501 /nfs/dbraw/zinc/89/05/01/1345890501.db2.gz ZMFSHGLVDLTGNA-KBPBESRZSA-N 1 3 335.879 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc3c(c2)CCC3)C[C@H]1C ZINC001379589740 1345897731 /nfs/dbraw/zinc/89/77/31/1345897731.db2.gz UACCQBJMPRPEQE-OXQOHEQNSA-N 1 3 343.515 2.595 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CC2CC(NC(=O)CN(C)C3CCC3)C2)c1 ZINC001393901498 1357271348 /nfs/dbraw/zinc/27/13/48/1357271348.db2.gz YUFPVDFEFPRIOU-UHFFFAOYSA-N 1 3 347.478 2.603 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]CCC(F)(F)F ZINC001419237568 1374983752 /nfs/dbraw/zinc/98/37/52/1374983752.db2.gz QXIKGQQMLADUGU-ZIAGYGMSSA-N 1 3 337.430 2.688 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@@H](NCC=C(Cl)Cl)C1CC1 ZINC001419258849 1375005277 /nfs/dbraw/zinc/00/52/77/1375005277.db2.gz BCLGCPKDSNOYLH-ZIAGYGMSSA-N 1 3 348.318 2.664 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)cc1F ZINC001393953541 1357318700 /nfs/dbraw/zinc/31/87/00/1357318700.db2.gz DYOZDWUQRGXMNN-HOTGVXAUSA-N 1 3 349.494 2.991 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H](C)[C@@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001393966959 1357332557 /nfs/dbraw/zinc/33/25/57/1357332557.db2.gz WSOBMNULCRQDHN-JKSUJKDBSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(F)cc1)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001379693318 1347263784 /nfs/dbraw/zinc/26/37/84/1347263784.db2.gz ROOVCMDHPMWWMY-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(F)cc1)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001379693318 1347263787 /nfs/dbraw/zinc/26/37/87/1347263787.db2.gz ROOVCMDHPMWWMY-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)cc1 ZINC001379728923 1347291416 /nfs/dbraw/zinc/29/14/16/1347291416.db2.gz QUFHQAXFTLHFHD-LJQANCHMSA-N 1 3 345.531 2.704 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+][C@@H]2CCc3ccccc32)C(C)(C)C1 ZINC001379730139 1347292194 /nfs/dbraw/zinc/29/21/94/1347292194.db2.gz MFIDTCYAIOWPOJ-MOPGFXCFSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)CC1CCC(F)(F)CC1)N(C)C ZINC001379770996 1347322509 /nfs/dbraw/zinc/32/25/09/1347322509.db2.gz YGVPBJFKPUSLLQ-DZGCQCFKSA-N 1 3 333.467 2.589 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)CC1CCC(F)(F)CC1)N(C)C ZINC001379770996 1347322514 /nfs/dbraw/zinc/32/25/14/1347322514.db2.gz YGVPBJFKPUSLLQ-DZGCQCFKSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CN(C)Cc1ccc(F)cc1)[NH+]1CCCC1 ZINC001379797705 1347346395 /nfs/dbraw/zinc/34/63/95/1347346395.db2.gz LTNVRLDVXYUQML-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C[NH2+]CC1CC(C)(C)C1)C1CC1 ZINC001379880530 1347384640 /nfs/dbraw/zinc/38/46/40/1347384640.db2.gz SQWCSYZUJUTTLM-ROUUACIJSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001379911317 1347401571 /nfs/dbraw/zinc/40/15/71/1347401571.db2.gz YARPEOZQWKFNKV-PMACEKPBSA-N 1 3 343.515 2.934 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)[C@H](C)NCc1cccc(Cl)c1F ZINC001393984907 1357351832 /nfs/dbraw/zinc/35/18/32/1357351832.db2.gz FMZHPNUXACNCDC-QWHCGFSZSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)[C@H](C)NCc1cccc(Cl)c1F ZINC001393984907 1357351836 /nfs/dbraw/zinc/35/18/36/1357351836.db2.gz FMZHPNUXACNCDC-QWHCGFSZSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1CC[NH+](CCc2ccccc2)CC1)N(C)C ZINC001380129022 1347524326 /nfs/dbraw/zinc/52/43/26/1347524326.db2.gz FKYTXPDUEUTTQQ-YLJYHZDGSA-N 1 3 345.531 2.786 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1(NC/C=C\c2ccc(Cl)cc2)CC1 ZINC001380132530 1347526191 /nfs/dbraw/zinc/52/61/91/1347526191.db2.gz DMKDWPPLFQERHY-ARJAWSKDSA-N 1 3 335.879 2.543 10 0 EFAEHO CN(C(=O)CC[C@@H]1CCC[N@@H+]1C)C1CC(NCc2ccccc2F)C1 ZINC001380155509 1347538605 /nfs/dbraw/zinc/53/86/05/1347538605.db2.gz BQPWFNKUOIFLJE-ADKAHSJRSA-N 1 3 347.478 2.779 10 0 EFAEHO CN(C(=O)CC[C@@H]1CCC[N@H+]1C)C1CC(NCc2ccccc2F)C1 ZINC001380155509 1347538608 /nfs/dbraw/zinc/53/86/08/1347538608.db2.gz BQPWFNKUOIFLJE-ADKAHSJRSA-N 1 3 347.478 2.779 10 0 EFAEHO Cc1ccc(C[NH2+]C2CC(N(C)C(=O)CN(C)C(C)C)C2)cc1F ZINC001380175564 1347549406 /nfs/dbraw/zinc/54/94/06/1347549406.db2.gz NDEZCSLOIODCKR-UHFFFAOYSA-N 1 3 335.467 2.553 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)CN(C)C1CCC1 ZINC001380179917 1347553176 /nfs/dbraw/zinc/55/31/76/1347553176.db2.gz JHYUFHIDNRTUIT-DUZACMNTSA-N 1 3 339.499 2.721 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)CC(C)(C)C)c(C)n1 ZINC001393993141 1357362218 /nfs/dbraw/zinc/36/22/18/1357362218.db2.gz XWBGFDOTQQMBJX-JKSUJKDBSA-N 1 3 348.535 2.659 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)[C@H](C)C1 ZINC001380272198 1347563786 /nfs/dbraw/zinc/56/37/86/1347563786.db2.gz SUEWBUHDSKIDDU-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+]Cc1ccc(Cl)cc1 ZINC001380287542 1347570265 /nfs/dbraw/zinc/57/02/65/1347570265.db2.gz ASZNXEWHAUYYHA-KRWDZBQOSA-N 1 3 337.895 2.761 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@@H]1CCCN1C(=O)CN(C)C(C)C ZINC001380292745 1347572484 /nfs/dbraw/zinc/57/24/84/1347572484.db2.gz VLICNVMRSAPPTL-SFHVURJKSA-N 1 3 335.467 2.555 10 0 EFAEHO C[NH+](C)CCC(=O)NC1(C)CCN(C/C=C/c2ccccc2)CC1 ZINC001380304737 1347579553 /nfs/dbraw/zinc/57/95/53/1347579553.db2.gz GQLHWBFLHQYUQR-JXMROGBWSA-N 1 3 329.488 2.622 10 0 EFAEHO CC[C@H](C(=O)N[C@@]1(C)CC[N@H+](CCc2ccccc2)C1)N(CC)CC ZINC001380359510 1347618002 /nfs/dbraw/zinc/61/80/02/1347618002.db2.gz QBPVIYJLZXYTPA-CTNGQTDRSA-N 1 3 345.531 2.930 10 0 EFAEHO CC[C@H](C(=O)N[C@@]1(C)CC[N@@H+](CCc2ccccc2)C1)N(CC)CC ZINC001380359510 1347618005 /nfs/dbraw/zinc/61/80/05/1347618005.db2.gz QBPVIYJLZXYTPA-CTNGQTDRSA-N 1 3 345.531 2.930 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C(C)C ZINC001393994708 1357364843 /nfs/dbraw/zinc/36/48/43/1357364843.db2.gz HENBCMMSBKIJMG-HOTGVXAUSA-N 1 3 348.535 2.836 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@](C)(C[NH2+]CC3CC(C)(C)C3)C2)C1 ZINC001380427080 1347664284 /nfs/dbraw/zinc/66/42/84/1347664284.db2.gz XTOKOSGHEPFFBX-OXJNMPFZSA-N 1 3 335.536 2.593 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1(C)CC[NH+](C[C@H](F)CC)CC1 ZINC001380437670 1347671356 /nfs/dbraw/zinc/67/13/56/1347671356.db2.gz CWHSFKQSQOIUPE-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](F)CN1CCC(C)(CNC(=O)CC2CC[NH+](C)CC2)CC1 ZINC001380447451 1347677973 /nfs/dbraw/zinc/67/79/73/1347677973.db2.gz GZZYYCKXTCLXMU-QGZVFWFLSA-N 1 3 341.515 2.685 10 0 EFAEHO CC(C)(C(=O)NCC1(C)CCN(C/C=C\Cl)CC1)[NH+]1CCCC1 ZINC001380452676 1347682638 /nfs/dbraw/zinc/68/26/38/1347682638.db2.gz YWSNEMJUNPNFPI-TWGQIWQCSA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@]1(C)CCC[N@H+](CC2CCC2)C1 ZINC001380472097 1347700457 /nfs/dbraw/zinc/70/04/57/1347700457.db2.gz OYIIRMSUWDIFAE-UYAOXDASSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@]1(C)CCC[N@@H+](CC2CCC2)C1 ZINC001380472097 1347700462 /nfs/dbraw/zinc/70/04/62/1347700462.db2.gz OYIIRMSUWDIFAE-UYAOXDASSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@]2(C)CCC[N@H+](Cc3ccsc3)C2)CCC1 ZINC001380475147 1347704879 /nfs/dbraw/zinc/70/48/79/1347704879.db2.gz XMXVNLISEQTWCA-GOSISDBHSA-N 1 3 349.544 2.951 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@]2(C)CCC[N@@H+](Cc3ccsc3)C2)CCC1 ZINC001380475147 1347704883 /nfs/dbraw/zinc/70/48/83/1347704883.db2.gz XMXVNLISEQTWCA-GOSISDBHSA-N 1 3 349.544 2.951 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]CCc1ccccc1Cl ZINC001394001584 1357372420 /nfs/dbraw/zinc/37/24/20/1357372420.db2.gz MGXDKHJEOQWGRB-GJZGRUSLSA-N 1 3 339.911 2.706 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCCC(C)C)C2 ZINC001380655796 1347792629 /nfs/dbraw/zinc/79/26/29/1347792629.db2.gz CFIREIMBPXHOMP-BBWFWOEESA-N 1 3 332.492 2.666 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCCC(C)C)C2 ZINC001380655796 1347792631 /nfs/dbraw/zinc/79/26/31/1347792631.db2.gz CFIREIMBPXHOMP-BBWFWOEESA-N 1 3 332.492 2.666 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](CCCC1CCC1)C2 ZINC001380661262 1347796940 /nfs/dbraw/zinc/79/69/40/1347796940.db2.gz SCUOHVNUGTVZNK-FHWLQOOXSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCCC1CCC1)C2 ZINC001380661262 1347796944 /nfs/dbraw/zinc/79/69/44/1347796944.db2.gz SCUOHVNUGTVZNK-FHWLQOOXSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001380676376 1347806149 /nfs/dbraw/zinc/80/61/49/1347806149.db2.gz KVSDFBRNXOUOOR-ICSRJNTNSA-N 1 3 345.531 2.970 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001394002911 1357374737 /nfs/dbraw/zinc/37/47/37/1357374737.db2.gz RJNHOFAEWMBGDY-UONOGXRCSA-N 1 3 325.884 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](CC[NH2+][C@@H](C)c2ccccc2)C1 ZINC001380783921 1347875387 /nfs/dbraw/zinc/87/53/87/1347875387.db2.gz RLVDYFNITLGTJR-ROUUACIJSA-N 1 3 331.504 2.916 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CC2(C1)CCN(Cc1cccc(F)c1)CC2 ZINC001380795608 1347884727 /nfs/dbraw/zinc/88/47/27/1347884727.db2.gz LIJMZWLHXVYRAK-UHFFFAOYSA-N 1 3 347.478 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CC[NH+](Cc1ccc(F)cc1)CC2 ZINC001380803537 1347888416 /nfs/dbraw/zinc/88/84/16/1347888416.db2.gz YENXLACCKVDZLQ-UHFFFAOYSA-N 1 3 347.478 2.590 10 0 EFAEHO Cc1ccc(C[NH+]2CCC3(CN(C(=O)CN(C)C(C)C)C3)CC2)cc1 ZINC001380802468 1347888491 /nfs/dbraw/zinc/88/84/91/1347888491.db2.gz PSWBGIUJKYEWRS-UHFFFAOYSA-N 1 3 343.515 2.760 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]CC3CC4(CCC4)C3)CCC2)CCC1 ZINC001380863730 1347922400 /nfs/dbraw/zinc/92/24/00/1347922400.db2.gz YGIJTIHDEPCZMM-UHFFFAOYSA-N 1 3 333.520 2.680 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+]CC2CC3(CCC3)C2)CCC1)N(C)C ZINC001380880135 1347932525 /nfs/dbraw/zinc/93/25/25/1347932525.db2.gz VNVDNPFELWRUMQ-QGZVFWFLSA-N 1 3 335.536 2.781 10 0 EFAEHO CN(CCC[N@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)[C@@H]1CCCN1C ZINC001380945175 1347975356 /nfs/dbraw/zinc/97/53/56/1347975356.db2.gz AZHUTRYHRCQCFJ-IBGZPJMESA-N 1 3 342.487 2.542 10 0 EFAEHO CN(CCC[N@@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)[C@@H]1CCCN1C ZINC001380945175 1347975359 /nfs/dbraw/zinc/97/53/59/1347975359.db2.gz AZHUTRYHRCQCFJ-IBGZPJMESA-N 1 3 342.487 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@H+](CCc2ccccc2F)CC1 ZINC001380953199 1347982173 /nfs/dbraw/zinc/98/21/73/1347982173.db2.gz YXDHJFXNEULWLX-SFHVURJKSA-N 1 3 349.494 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@@H+](CCc2ccccc2F)CC1 ZINC001380953199 1347982177 /nfs/dbraw/zinc/98/21/77/1347982177.db2.gz YXDHJFXNEULWLX-SFHVURJKSA-N 1 3 349.494 2.679 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]CC=C(Cl)Cl ZINC001381237586 1348159588 /nfs/dbraw/zinc/15/95/88/1348159588.db2.gz GROUQHJMIDCJAE-QWHCGFSZSA-N 1 3 336.307 2.664 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H]2CC[N@H+](CCC3CC3)C2)C1 ZINC001381310677 1348205311 /nfs/dbraw/zinc/20/53/11/1348205311.db2.gz DRPPVZHBGOMCAQ-RTBURBONSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H]2CC[N@@H+](CCC3CC3)C2)C1 ZINC001381310677 1348205312 /nfs/dbraw/zinc/20/53/12/1348205312.db2.gz DRPPVZHBGOMCAQ-RTBURBONSA-N 1 3 335.536 2.687 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001381380864 1348233501 /nfs/dbraw/zinc/23/35/01/1348233501.db2.gz CCIKDPUCLLRIHU-ZIAGYGMSSA-N 1 3 345.478 2.779 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(CF)cc1)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001381389889 1348237302 /nfs/dbraw/zinc/23/73/02/1348237302.db2.gz MCAPSJAHIFSVCM-CABCVRRESA-N 1 3 335.467 2.623 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C1CCC1 ZINC001381390307 1348237361 /nfs/dbraw/zinc/23/73/61/1348237361.db2.gz MDCWQNREZQFZRX-LSDHHAIUSA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)CCC[NH+](C)C)c(Cl)c1 ZINC001381413970 1348255977 /nfs/dbraw/zinc/25/59/77/1348255977.db2.gz IYWUQJCCVAOXER-LSDHHAIUSA-N 1 3 339.911 2.973 10 0 EFAEHO C[C@@H](NCc1cc2ccccc2o1)[C@@H](C)NC(=O)C1CC[NH+](C)CC1 ZINC001381427270 1348265915 /nfs/dbraw/zinc/26/59/15/1348265915.db2.gz ZKNDOPNVFHDNNM-HUUCEWRRSA-N 1 3 343.471 2.757 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]CCc1ccc(Cl)cc1 ZINC001381440924 1348276879 /nfs/dbraw/zinc/27/68/79/1348276879.db2.gz CIBVDRMVSIKDMZ-GJZGRUSLSA-N 1 3 339.911 2.706 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[N@H+](C)Cc1ccc(C)cc1 ZINC001381535633 1348337659 /nfs/dbraw/zinc/33/76/59/1348337659.db2.gz SYYKJUZPKPXADG-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[N@@H+](C)Cc1ccc(C)cc1 ZINC001381535633 1348337662 /nfs/dbraw/zinc/33/76/62/1348337662.db2.gz SYYKJUZPKPXADG-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)CC[N@H+](C)[C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001381582732 1348377791 /nfs/dbraw/zinc/37/77/91/1348377791.db2.gz MHHHWNUSVUWDID-QAPCUYQASA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)CC[N@@H+](C)[C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001381582732 1348377794 /nfs/dbraw/zinc/37/77/94/1348377794.db2.gz MHHHWNUSVUWDID-QAPCUYQASA-N 1 3 329.504 2.682 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[N@H+](C)CC1CC2(CCC2)C1 ZINC001381582550 1348377934 /nfs/dbraw/zinc/37/79/34/1348377934.db2.gz KOAYPJMBJZXTRF-MRXNPFEDSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[N@@H+](C)CC1CC2(CCC2)C1 ZINC001381582550 1348377937 /nfs/dbraw/zinc/37/79/37/1348377937.db2.gz KOAYPJMBJZXTRF-MRXNPFEDSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+](C)[C@@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001381582745 1348377983 /nfs/dbraw/zinc/37/79/83/1348377983.db2.gz MLTYIUHHEAIZCL-YJBOKZPZSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cccc(C)c1C[N@H+](C)[C@@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001381582745 1348377985 /nfs/dbraw/zinc/37/79/85/1348377985.db2.gz MLTYIUHHEAIZCL-YJBOKZPZSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001381583022 1348378248 /nfs/dbraw/zinc/37/82/48/1348378248.db2.gz NMQYOJGOKDJTPO-SJLPKXTDSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001381583022 1348378251 /nfs/dbraw/zinc/37/82/51/1348378251.db2.gz NMQYOJGOKDJTPO-SJLPKXTDSA-N 1 3 331.504 2.582 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)CC[C@@H]1CCCC1(F)F ZINC001381639335 1348423943 /nfs/dbraw/zinc/42/39/43/1348423943.db2.gz BBMFHVAGSPXOSI-GJZGRUSLSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC001381639335 1348423945 /nfs/dbraw/zinc/42/39/45/1348423945.db2.gz BBMFHVAGSPXOSI-GJZGRUSLSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)CC[C@H]1CCCC1(F)F ZINC001381639339 1348424177 /nfs/dbraw/zinc/42/41/77/1348424177.db2.gz BBMFHVAGSPXOSI-LSDHHAIUSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC001381639339 1348424178 /nfs/dbraw/zinc/42/41/78/1348424178.db2.gz BBMFHVAGSPXOSI-LSDHHAIUSA-N 1 3 333.467 2.589 10 0 EFAEHO CCCC[C@H](C[NH2+]CC1CC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001381745884 1348495475 /nfs/dbraw/zinc/49/54/75/1348495475.db2.gz IZQKHXCDVKKBIK-APWZRJJASA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCCCCC3)C[C@H]21)N(C)C ZINC001381900873 1348597077 /nfs/dbraw/zinc/59/70/77/1348597077.db2.gz XWNNFBPXLYBTOW-AKHDSKFASA-N 1 3 335.536 2.591 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCCCCC3)C[C@H]21)N(C)C ZINC001381900873 1348597082 /nfs/dbraw/zinc/59/70/82/1348597082.db2.gz XWNNFBPXLYBTOW-AKHDSKFASA-N 1 3 335.536 2.591 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001381965781 1348628513 /nfs/dbraw/zinc/62/85/13/1348628513.db2.gz HEBCLBBDGPHZPJ-GUDVDZBRSA-N 1 3 331.504 2.566 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]CC2CCC(F)(F)CC2)C1 ZINC001381967703 1348629440 /nfs/dbraw/zinc/62/94/40/1348629440.db2.gz MPPIRECBTUFIQT-WKILWMFISA-N 1 3 345.478 2.638 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C[C@H](C)NCc1ccccc1F ZINC001382089349 1348710765 /nfs/dbraw/zinc/71/07/65/1348710765.db2.gz YTIHTSQSWQSHKF-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N(C)C[C@H](C)NCc1ccccc1F ZINC001382089349 1348710768 /nfs/dbraw/zinc/71/07/68/1348710768.db2.gz YTIHTSQSWQSHKF-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001382165858 1348788077 /nfs/dbraw/zinc/78/80/77/1348788077.db2.gz MUBYDTCAQBXDJM-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC001382170528 1348791754 /nfs/dbraw/zinc/79/17/54/1348791754.db2.gz XXWWPNZLROBDBZ-KGLIPLIRSA-N 1 3 341.446 2.803 10 0 EFAEHO C[C@@H]1[C@@H]([NH2+]CCC(C)(C)C)CCN1C(=O)CN(C)CC(C)(C)C ZINC001382283137 1348844775 /nfs/dbraw/zinc/84/47/75/1348844775.db2.gz HDHXLNMWCYVFTF-CVEARBPZSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001382319295 1348866502 /nfs/dbraw/zinc/86/65/02/1348866502.db2.gz XGEAGPVSPWEJDB-MJGOQNOKSA-N 1 3 331.504 2.723 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)[C@H](C)CNC(=O)[C@@H]1CCCN1C(C)C ZINC001394061198 1357430624 /nfs/dbraw/zinc/43/06/24/1357430624.db2.gz VRGXXPHSJXBUCP-MJGOQNOKSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccccc1C[N@H+](C)[C@H](C)CNC(=O)[C@@H]1CCCN1C(C)C ZINC001394061198 1357430627 /nfs/dbraw/zinc/43/06/27/1357430627.db2.gz VRGXXPHSJXBUCP-MJGOQNOKSA-N 1 3 331.504 2.804 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@H](NCc2ccc(C)nc2C)C[C@@H]1C ZINC001382321663 1348870315 /nfs/dbraw/zinc/87/03/15/1348870315.db2.gz ZPMPBJQUERZRLG-QFBILLFUSA-N 1 3 346.519 2.509 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@H](NCc2ccc(C)nc2C)C[C@@H]1C ZINC001382321663 1348870319 /nfs/dbraw/zinc/87/03/19/1348870319.db2.gz ZPMPBJQUERZRLG-QFBILLFUSA-N 1 3 346.519 2.509 10 0 EFAEHO Cc1cccc(C[N@@H+](C)[C@@H](C)CNC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001394062228 1357431666 /nfs/dbraw/zinc/43/16/66/1357431666.db2.gz YXOFRVLYCNVZGN-PKOBYXMFSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1cccc(C[N@H+](C)[C@@H](C)CNC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001394062228 1357431668 /nfs/dbraw/zinc/43/16/68/1357431668.db2.gz YXOFRVLYCNVZGN-PKOBYXMFSA-N 1 3 331.504 2.804 10 0 EFAEHO CC(C)C[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]21 ZINC001382336147 1348888777 /nfs/dbraw/zinc/88/87/77/1348888777.db2.gz PNFRBXPEQCSPGQ-FGTMMUONSA-N 1 3 337.552 2.837 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@H](NCc2cc3ccccc3o2)C(C)(C)C1 ZINC001382369961 1348920278 /nfs/dbraw/zinc/92/02/78/1348920278.db2.gz PRXRKZIRKLRJSI-SFHVURJKSA-N 1 3 343.471 2.711 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@@H](NCc2sccc2Cl)C(C)(C)C1 ZINC001382369959 1348920479 /nfs/dbraw/zinc/92/04/79/1348920479.db2.gz PRPRBVXKLYRTCP-CQSZACIVSA-N 1 3 343.924 2.680 10 0 EFAEHO CC(C)CC[NH+]1CCC([C@@H](C)NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001382550225 1349012007 /nfs/dbraw/zinc/01/20/07/1349012007.db2.gz CYDDRUADMKQWQP-AEFFLSMTSA-N 1 3 325.541 2.835 10 0 EFAEHO CC[C@@H](F)CN1CCC([C@@H](C)NC(=O)CCC[NH+]2CCCC2)CC1 ZINC001382551511 1349012592 /nfs/dbraw/zinc/01/25/92/1349012592.db2.gz MISYNGUNBUJVCI-SJLPKXTDSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)Cc1ccccc1C1CC1 ZINC001394137347 1357520008 /nfs/dbraw/zinc/52/00/08/1357520008.db2.gz CLACVNJXQBGKJI-MRXNPFEDSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)Cc1ccccc1C1CC1 ZINC001394137347 1357520012 /nfs/dbraw/zinc/52/00/12/1357520012.db2.gz CLACVNJXQBGKJI-MRXNPFEDSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]C/C=C\Cl ZINC001394194768 1357576547 /nfs/dbraw/zinc/57/65/47/1357576547.db2.gz XDYRCYTYNLSXKW-BJYXUANLSA-N 1 3 329.916 2.543 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)C1C[NH+]([C@H]2CCc3ccccc32)C1 ZINC001394226277 1357617279 /nfs/dbraw/zinc/61/72/79/1357617279.db2.gz KQILYIZWQKMBKD-QRWLVFNGSA-N 1 3 341.499 2.595 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@@H](C)C1)C1C[NH+](CC2CCC3(CC3)CC2)C1 ZINC001394253156 1357640651 /nfs/dbraw/zinc/64/06/51/1357640651.db2.gz UGZYRRHSZSQMQU-IAGOWNOFSA-N 1 3 347.547 2.735 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C)C1)C1C[NH+](CC2CCC3(CC3)CC2)C1 ZINC001394253162 1357641200 /nfs/dbraw/zinc/64/12/00/1357641200.db2.gz UGZYRRHSZSQMQU-SJORKVTESA-N 1 3 347.547 2.735 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001388704060 1352934187 /nfs/dbraw/zinc/93/41/87/1352934187.db2.gz QPCPYSYBDOFZIA-XYJFISCASA-N 1 3 347.503 2.581 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+][C@H]2CCc3ccccc32)C1)N(C)C ZINC001388724114 1352951730 /nfs/dbraw/zinc/95/17/30/1352951730.db2.gz ZQNXGRVYKOLTOS-UHMOLFJZSA-N 1 3 343.515 2.745 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]CCc2ccccc2F)C1 ZINC001388758001 1352984372 /nfs/dbraw/zinc/98/43/72/1352984372.db2.gz NDQNIEDOEOUMAI-FUHWJXTLSA-N 1 3 349.494 2.583 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CN(Cc2ccccc2)CC1(C)C)[NH+](C)C ZINC001394298535 1357684252 /nfs/dbraw/zinc/68/42/52/1357684252.db2.gz DRWWZKGIDYUMBW-QZTJIDSGSA-N 1 3 331.504 2.599 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1CCCN(Cc2ccc(C3CC3)cc2)C1 ZINC001389389727 1353358550 /nfs/dbraw/zinc/35/85/50/1353358550.db2.gz MIGICWIVBYYYIG-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC12CC[NH+](CCc1ccccc1)CC2)N(C)C ZINC001389519644 1353447167 /nfs/dbraw/zinc/44/71/67/1353447167.db2.gz JSVDXHIFAKASIS-MOPGFXCFSA-N 1 3 343.515 2.540 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC12CC[NH+](Cc1ccc(C)cc1)CC2)N(C)C ZINC001389518517 1353447396 /nfs/dbraw/zinc/44/73/96/1353447396.db2.gz JATYZNXRBRPFML-MOPGFXCFSA-N 1 3 343.515 2.806 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CC12CCN(C/C=C/Cl)CC2 ZINC001389527620 1353454898 /nfs/dbraw/zinc/45/48/98/1353454898.db2.gz SZXAKNBXPZEBHG-RGOXZVDPSA-N 1 3 339.911 2.584 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CC12CCN(C/C=C/Cl)CC2 ZINC001389527620 1353454900 /nfs/dbraw/zinc/45/49/00/1353454900.db2.gz SZXAKNBXPZEBHG-RGOXZVDPSA-N 1 3 339.911 2.584 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC12CC[NH+](Cc1ccc(F)cc1)CC2)N(C)C ZINC001389528445 1353455878 /nfs/dbraw/zinc/45/58/78/1353455878.db2.gz UQQIYAGKSBRTPF-QZTJIDSGSA-N 1 3 347.478 2.637 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1csc(C)c1)C1CC1 ZINC001389604572 1353504177 /nfs/dbraw/zinc/50/41/77/1353504177.db2.gz ISQRARCQJYAVSV-MSOLQXFVSA-N 1 3 349.544 2.915 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001389615485 1353512438 /nfs/dbraw/zinc/51/24/38/1353512438.db2.gz WUXHPGWXAKAGBB-RBUKOAKNSA-N 1 3 347.547 2.926 10 0 EFAEHO CN(CC(=O)NC[C@H]([NH2+]CCC(C)(C)C)C1CC1)CC(C)(C)C ZINC001389669310 1353541988 /nfs/dbraw/zinc/54/19/88/1353541988.db2.gz PVADQBPZIJRLLY-INIZCTEOSA-N 1 3 325.541 2.885 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]([NH2+]Cc2ccccc2Cl)C2CC2)C1 ZINC001389673461 1353544905 /nfs/dbraw/zinc/54/49/05/1353544905.db2.gz WLWFTWZNWQMMJX-KBXCAEBGSA-N 1 3 349.906 2.666 10 0 EFAEHO CC(C)CC[N@H+](C)C[C@H]1CCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001389710437 1353571486 /nfs/dbraw/zinc/57/14/86/1353571486.db2.gz DFKKKAQOACDSEF-MSOLQXFVSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)CC[N@@H+](C)C[C@H]1CCCN(C(=O)[C@H](C(C)C)N(C)C)C1 ZINC001389710437 1353571490 /nfs/dbraw/zinc/57/14/90/1353571490.db2.gz DFKKKAQOACDSEF-MSOLQXFVSA-N 1 3 325.541 2.789 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@H](CC)c3ccccc3)C[C@H]21 ZINC001394326833 1357704131 /nfs/dbraw/zinc/70/41/31/1357704131.db2.gz UKNOGBAHVXJGIB-YSTOQKLRSA-N 1 3 343.515 2.774 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@H](CC)c3ccccc3)C[C@H]21 ZINC001394326833 1357704133 /nfs/dbraw/zinc/70/41/33/1357704133.db2.gz UKNOGBAHVXJGIB-YSTOQKLRSA-N 1 3 343.515 2.774 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001389901481 1353676874 /nfs/dbraw/zinc/67/68/74/1353676874.db2.gz RWHYYFKIYRTQFA-MYZZLAAOSA-N 1 3 347.503 2.579 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc(Cl)c2F)C1)N(C)C ZINC001390000510 1353734162 /nfs/dbraw/zinc/73/41/62/1353734162.db2.gz PSIJRSDHVLLXQG-GUTXKFCHSA-N 1 3 341.858 2.556 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2Cl)C1 ZINC001390041254 1353760662 /nfs/dbraw/zinc/76/06/62/1353760662.db2.gz VOOREAUPQLENDR-KFWWJZLASA-N 1 3 337.895 2.978 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[NH2+]C[C@@H]2CCC(F)(F)C2)C1 ZINC001390099834 1353804696 /nfs/dbraw/zinc/80/46/96/1353804696.db2.gz BHTOKGWKGCUJIY-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[NH2+]Cc1ccc(C)nc1C ZINC001390166702 1353883816 /nfs/dbraw/zinc/88/38/16/1353883816.db2.gz ZLNCMXYJSCWUKT-IBGZPJMESA-N 1 3 346.519 2.511 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@@H]1CC[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001394699152 1358024805 /nfs/dbraw/zinc/02/48/05/1358024805.db2.gz CKHKHOCXYFWODD-APWZRJJASA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc(CF)cc1 ZINC001390452126 1354089204 /nfs/dbraw/zinc/08/92/04/1354089204.db2.gz HEAYHAXGBMDOMF-HNNXBMFYSA-N 1 3 335.467 2.625 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC[C@@H](C)NCc2cccc(F)c2)C1 ZINC001390455207 1354091110 /nfs/dbraw/zinc/09/11/10/1354091110.db2.gz GRSAUFGBTYVTSE-NVXWUHKLSA-N 1 3 335.467 2.542 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC[C@@H](C)NCc2cccc(F)c2)C1 ZINC001390455207 1354091120 /nfs/dbraw/zinc/09/11/20/1354091120.db2.gz GRSAUFGBTYVTSE-NVXWUHKLSA-N 1 3 335.467 2.542 10 0 EFAEHO C[C@H](CNC(=O)CC[NH+](C)C)NCc1cc(Cl)cc(Cl)c1 ZINC001390463308 1354098756 /nfs/dbraw/zinc/09/87/56/1354098756.db2.gz AHSXMBSEWCQOFO-LLVKDONJSA-N 1 3 332.275 2.539 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+][C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001390478525 1354111801 /nfs/dbraw/zinc/11/18/01/1354111801.db2.gz JDLZOLPICZVOJM-MSOLQXFVSA-N 1 3 345.531 2.821 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001390488103 1354120079 /nfs/dbraw/zinc/12/00/79/1354120079.db2.gz ZQHJUGIZKSTIFQ-OXJNMPFZSA-N 1 3 349.494 2.802 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+][C@H]2CCCc3ccccc32)C1 ZINC001390596813 1354194207 /nfs/dbraw/zinc/19/42/07/1354194207.db2.gz NNHQYAIQPZBOIO-PXNSSMCTSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1ccc(F)c(Cl)c1)N(C)C ZINC001390670307 1354262792 /nfs/dbraw/zinc/26/27/92/1354262792.db2.gz HCGQIBUMNNLPOD-BLLLJJGKSA-N 1 3 343.874 2.804 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccccc1C1CC1 ZINC001390699325 1354291495 /nfs/dbraw/zinc/29/14/95/1354291495.db2.gz AJGWDVCKPIPZCD-SJORKVTESA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccccc1C1CC1 ZINC001390699285 1354291624 /nfs/dbraw/zinc/29/16/24/1354291624.db2.gz AJGWDVCKPIPZCD-IAGOWNOFSA-N 1 3 343.515 2.890 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]Cc1cc(C)ccc1F ZINC001390733531 1354324168 /nfs/dbraw/zinc/32/41/68/1354324168.db2.gz QDNFXDCHHMQSET-QFBILLFUSA-N 1 3 349.494 2.993 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@@H+]1C)[C@H]1CCc2c1cccc2F ZINC001390770692 1354358751 /nfs/dbraw/zinc/35/87/51/1354358751.db2.gz HPXORPKJJSJGAX-KXBFYZLASA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@H+]1C)[C@H]1CCc2c1cccc2F ZINC001390770692 1354358755 /nfs/dbraw/zinc/35/87/55/1354358755.db2.gz HPXORPKJJSJGAX-KXBFYZLASA-N 1 3 347.478 2.735 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)Cc1ccc(Cl)cc1 ZINC001390982886 1354634170 /nfs/dbraw/zinc/63/41/70/1354634170.db2.gz AUQMTKLXGKEZKX-INIZCTEOSA-N 1 3 337.895 2.620 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)Cc1ccc(Cl)cc1 ZINC001390982886 1354634174 /nfs/dbraw/zinc/63/41/74/1354634174.db2.gz AUQMTKLXGKEZKX-INIZCTEOSA-N 1 3 337.895 2.620 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1CC[N@H+](CC2CCCC2)C1)N1CCCCCC1 ZINC001391096476 1354789001 /nfs/dbraw/zinc/78/90/01/1354789001.db2.gz MEMCDDSTXSSUJN-HKUYNNGSSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1CC[N@@H+](CC2CCCC2)C1)N1CCCCCC1 ZINC001391096476 1354789005 /nfs/dbraw/zinc/78/90/05/1354789005.db2.gz MEMCDDSTXSSUJN-HKUYNNGSSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c(C)s1 ZINC001391097577 1354790314 /nfs/dbraw/zinc/79/03/14/1354790314.db2.gz BHCMDPZRAYAZCS-RHSMWYFYSA-N 1 3 349.544 2.645 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c(C)s1 ZINC001391097577 1354790320 /nfs/dbraw/zinc/79/03/20/1354790320.db2.gz BHCMDPZRAYAZCS-RHSMWYFYSA-N 1 3 349.544 2.645 10 0 EFAEHO Cc1cccc([C@H](C)[N@@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001391116063 1354818726 /nfs/dbraw/zinc/81/87/26/1354818726.db2.gz KGYZSHKRUKELTI-ROUUACIJSA-N 1 3 331.504 2.834 10 0 EFAEHO Cc1cccc([C@H](C)[N@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001391116063 1354818729 /nfs/dbraw/zinc/81/87/29/1354818729.db2.gz KGYZSHKRUKELTI-ROUUACIJSA-N 1 3 331.504 2.834 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+]([C@@H]2CCCc3ccccc32)C1 ZINC001391120818 1354825849 /nfs/dbraw/zinc/82/58/49/1354825849.db2.gz WNVGPSVYLNMTPG-YLJYHZDGSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+]([C@@H]2CCCc3ccccc32)C1 ZINC001391120818 1354825853 /nfs/dbraw/zinc/82/58/53/1354825853.db2.gz WNVGPSVYLNMTPG-YLJYHZDGSA-N 1 3 343.515 2.842 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@@H+](CC[C@@H](C)F)CC(C)(C)C1 ZINC001397818995 1360171399 /nfs/dbraw/zinc/17/13/99/1360171399.db2.gz URTOLWYUNUPSSD-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[N@H+](C)Cc1ccccc1 ZINC001397805410 1360156653 /nfs/dbraw/zinc/15/66/53/1360156653.db2.gz MUNMORPJLLPHPA-IBGZPJMESA-N 1 3 331.504 2.840 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[N@@H+](C)Cc1ccccc1 ZINC001397805410 1360156656 /nfs/dbraw/zinc/15/66/56/1360156656.db2.gz MUNMORPJLLPHPA-IBGZPJMESA-N 1 3 331.504 2.840 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N(CCNC(=O)CC[NH+](C)C)C1CC1 ZINC001391175782 1354902198 /nfs/dbraw/zinc/90/21/98/1354902198.db2.gz PHXKPNDENVIOTN-CQSZACIVSA-N 1 3 337.895 2.933 10 0 EFAEHO C[C@@H]([NH2+]CCc1cccs1)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001391230344 1354952228 /nfs/dbraw/zinc/95/22/28/1354952228.db2.gz DUHXPHIHBIBMKB-QAPCUYQASA-N 1 3 349.544 2.602 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCCN1C(C)C)[C@@H]1CC[N@H+](CCC2CC2)C1 ZINC001391279647 1355011369 /nfs/dbraw/zinc/01/13/69/1355011369.db2.gz LXVAWRSJZDGHQT-MOPGFXCFSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCCN1C(C)C)[C@@H]1CC[N@@H+](CCC2CC2)C1 ZINC001391279647 1355011371 /nfs/dbraw/zinc/01/13/71/1355011371.db2.gz LXVAWRSJZDGHQT-MOPGFXCFSA-N 1 3 335.536 2.972 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CCNC(=O)CN3CC[C@H](C)C3)C2)cc1 ZINC001391323878 1355075726 /nfs/dbraw/zinc/07/57/26/1355075726.db2.gz LLPIRASUGNLMCX-AZUAARDMSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CCNC(=O)CN3CC[C@H](C)C3)C2)cc1 ZINC001391323878 1355075731 /nfs/dbraw/zinc/07/57/31/1355075731.db2.gz LLPIRASUGNLMCX-AZUAARDMSA-N 1 3 343.515 2.665 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H]1CC[N@H+](CC2CCCC2)C1 ZINC001391335526 1355089680 /nfs/dbraw/zinc/08/96/80/1355089680.db2.gz KFYYIZDPQCNARO-RTBURBONSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC001391335526 1355089682 /nfs/dbraw/zinc/08/96/82/1355089682.db2.gz KFYYIZDPQCNARO-RTBURBONSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CC[C@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001391335657 1355091145 /nfs/dbraw/zinc/09/11/45/1355091145.db2.gz KPPJJUVNBFCJPS-SJORKVTESA-N 1 3 349.494 2.938 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CC[C@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001391335657 1355091149 /nfs/dbraw/zinc/09/11/49/1355091149.db2.gz KPPJJUVNBFCJPS-SJORKVTESA-N 1 3 349.494 2.938 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](C[N@H+](C)CCCC2CCCC2)C1 ZINC001391345138 1355102398 /nfs/dbraw/zinc/10/23/98/1355102398.db2.gz VTOXOBILMZTPRC-MOPGFXCFSA-N 1 3 335.536 2.831 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](C[N@@H+](C)CCCC2CCCC2)C1 ZINC001391345138 1355102400 /nfs/dbraw/zinc/10/24/00/1355102400.db2.gz VTOXOBILMZTPRC-MOPGFXCFSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(C[N@H+](C)CC[C@H](C)F)CC1 ZINC001391365936 1355133258 /nfs/dbraw/zinc/13/32/58/1355133258.db2.gz QITHKBGHSCWIJC-WMZOPIPTSA-N 1 3 341.515 2.779 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(C[N@@H+](C)CC[C@H](C)F)CC1 ZINC001391365936 1355133262 /nfs/dbraw/zinc/13/32/62/1355133262.db2.gz QITHKBGHSCWIJC-WMZOPIPTSA-N 1 3 341.515 2.779 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(C[N@H+](C)CC[C@@H](C)F)CC1 ZINC001391365931 1355133799 /nfs/dbraw/zinc/13/37/99/1355133799.db2.gz QITHKBGHSCWIJC-SJLPKXTDSA-N 1 3 341.515 2.779 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(C[N@@H+](C)CC[C@@H](C)F)CC1 ZINC001391365931 1355133801 /nfs/dbraw/zinc/13/38/01/1355133801.db2.gz QITHKBGHSCWIJC-SJLPKXTDSA-N 1 3 341.515 2.779 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CNC(=O)C(C)(C)N2CCCC2)c(C)c1 ZINC001399036538 1360949947 /nfs/dbraw/zinc/94/99/47/1360949947.db2.gz TXXSKSOWFFBKMX-QGZVFWFLSA-N 1 3 331.504 2.772 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(CC)CC ZINC001391562121 1355306718 /nfs/dbraw/zinc/30/67/18/1355306718.db2.gz JOARHNRUHDWKPM-ROUUACIJSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(CC)CC ZINC001391562121 1355306720 /nfs/dbraw/zinc/30/67/20/1355306720.db2.gz JOARHNRUHDWKPM-ROUUACIJSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCN(CCc2cccs2)C1)[NH+]1CCCC1 ZINC001391568113 1355312814 /nfs/dbraw/zinc/31/28/14/1355312814.db2.gz OKBKRVHDVCFYFM-FUHWJXTLSA-N 1 3 349.544 2.602 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CCN(CCCc2ccsc2)C1 ZINC001391580933 1355323045 /nfs/dbraw/zinc/32/30/45/1355323045.db2.gz XMTUMPRTDYOROB-QZTJIDSGSA-N 1 3 349.544 2.746 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CCN(CCCc2ccsc2)C1 ZINC001391580933 1355323047 /nfs/dbraw/zinc/32/30/47/1355323047.db2.gz XMTUMPRTDYOROB-QZTJIDSGSA-N 1 3 349.544 2.746 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)[C@H]1CCN([C@H]2CCCc3ccc(F)cc32)C1 ZINC001391617593 1355360042 /nfs/dbraw/zinc/36/00/42/1355360042.db2.gz FSWDSPPLPATJSP-HKUYNNGSSA-N 1 3 347.478 2.688 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCC[N@@H+]1CC(C)C)NCc1ccccc1F ZINC001391694324 1355441067 /nfs/dbraw/zinc/44/10/67/1355441067.db2.gz BZKQRDZTLJKQBB-PKOBYXMFSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCC[N@H+]1CC(C)C)NCc1ccccc1F ZINC001391694324 1355441071 /nfs/dbraw/zinc/44/10/71/1355441071.db2.gz BZKQRDZTLJKQBB-PKOBYXMFSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1cccc(C)c1 ZINC001391696094 1355442618 /nfs/dbraw/zinc/44/26/18/1355442618.db2.gz SOOSZPAJCWJAOV-RBUKOAKNSA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001391721389 1355465185 /nfs/dbraw/zinc/46/51/85/1355465185.db2.gz VTBBVOXXCHJLJU-GJZGRUSLSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@](C)(C[NH2+]Cc2ccccc2F)C2CC2)C1 ZINC001391821758 1355565338 /nfs/dbraw/zinc/56/53/38/1355565338.db2.gz WFBZLNJQKHRZKG-FOIQADDNSA-N 1 3 347.478 2.542 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[C@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001391830372 1355572497 /nfs/dbraw/zinc/57/24/97/1355572497.db2.gz DGHAULBLIHSOLN-VGWMRTNUSA-N 1 3 345.478 2.779 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)N(C)C(=O)[C@H](C(C)C)[NH+](C)C)n1 ZINC001392071914 1355749148 /nfs/dbraw/zinc/74/91/48/1355749148.db2.gz DOHSFJNUUGRPPC-APWZRJJASA-N 1 3 348.535 2.728 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001392136305 1355793878 /nfs/dbraw/zinc/79/38/78/1355793878.db2.gz DGMPZLWFMCIUOZ-CABCVRRESA-N 1 3 333.467 2.589 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(Cl)c(F)c1)N(C)C(=O)CN1CCCC1 ZINC001392136050 1355793966 /nfs/dbraw/zinc/79/39/66/1355793966.db2.gz UCPOYTBDTKCSIL-CYBMUJFWSA-N 1 3 341.858 2.511 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)CC[NH+]2CCCCC2)c1 ZINC001392138662 1355796397 /nfs/dbraw/zinc/79/63/97/1355796397.db2.gz OYZLROFNHYXOGW-QGZVFWFLSA-N 1 3 349.494 2.947 10 0 EFAEHO CC(C)C[C@H](C[NH2+]Cc1ccc(F)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001392159174 1355813323 /nfs/dbraw/zinc/81/33/23/1355813323.db2.gz FKYBZHCNLWKUNF-QFBILLFUSA-N 1 3 349.494 2.788 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H](C)[NH2+]Cc2ccc(F)cc2)C1 ZINC001392188608 1355843130 /nfs/dbraw/zinc/84/31/30/1355843130.db2.gz JREBYAZUWYZMMY-AEFFLSMTSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H]1CCc2ccccc21 ZINC001392248143 1355905145 /nfs/dbraw/zinc/90/51/45/1355905145.db2.gz GCOSECXEMGOJOS-RTBURBONSA-N 1 3 331.504 2.745 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCN(C)C(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001392277036 1355932277 /nfs/dbraw/zinc/93/22/77/1355932277.db2.gz MQHVTBYWDXVIJT-HXUWFJFHSA-N 1 3 343.515 2.535 10 0 EFAEHO CN(CCc1ccccc1F)CCN(C)C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001392286455 1355943262 /nfs/dbraw/zinc/94/32/62/1355943262.db2.gz XWTLZXDAPRGFNE-GOSISDBHSA-N 1 3 349.494 2.633 10 0 EFAEHO CN(CCc1ccccc1F)CCN(C)C(=O)CC[C@H]1CCC[N@H+]1C ZINC001392286455 1355943266 /nfs/dbraw/zinc/94/32/66/1355943266.db2.gz XWTLZXDAPRGFNE-GOSISDBHSA-N 1 3 349.494 2.633 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001392300173 1355956899 /nfs/dbraw/zinc/95/68/99/1355956899.db2.gz IWCHMESHAJUXFL-UHFFFAOYSA-N 1 3 331.504 2.760 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@@H]21 ZINC001392344888 1356010753 /nfs/dbraw/zinc/01/07/53/1356010753.db2.gz WPYODRIHHILWNA-ROUUACIJSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@@H]21 ZINC001392344888 1356010758 /nfs/dbraw/zinc/01/07/58/1356010758.db2.gz WPYODRIHHILWNA-ROUUACIJSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@H]21 ZINC001392344894 1356010997 /nfs/dbraw/zinc/01/09/97/1356010997.db2.gz WPYODRIHHILWNA-ZWKOTPCHSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@H]21 ZINC001392344894 1356011003 /nfs/dbraw/zinc/01/10/03/1356011003.db2.gz WPYODRIHHILWNA-ZWKOTPCHSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2cc3ccccc3o2)C1)N(C)C ZINC001394375777 1357748421 /nfs/dbraw/zinc/74/84/21/1357748421.db2.gz MXBYYDOFPSXRPD-ZVZYQTTQSA-N 1 3 343.471 2.757 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCCc2ccc(F)cc21)C(=O)CN1CCCC1 ZINC001392462874 1356055289 /nfs/dbraw/zinc/05/52/89/1356055289.db2.gz XIWLJTXXAITNIE-IBGZPJMESA-N 1 3 347.478 2.737 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CC1CCC2(CC2)CC1 ZINC001392488299 1356069954 /nfs/dbraw/zinc/06/99/54/1356069954.db2.gz SBXFVSIIZCAZSS-SJLPKXTDSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@@H](C)[NH+]2CCCCCC2)c1 ZINC001392512701 1356088718 /nfs/dbraw/zinc/08/87/18/1356088718.db2.gz OXZLPKRFOSNVBP-IAGOWNOFSA-N 1 3 349.494 2.993 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)NC(=O)[C@@H](C(C)C)[NH+]2CCCC2)c1 ZINC001392537186 1356108653 /nfs/dbraw/zinc/10/86/53/1356108653.db2.gz OELNIKNYBZFLEC-VQIMIIECSA-N 1 3 349.494 2.849 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(F)cc1C ZINC001392539005 1356110199 /nfs/dbraw/zinc/11/01/99/1356110199.db2.gz ZXALLIHTCWVHSO-CRAIPNDOSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C(C)C)cs1 ZINC001401355654 1362704910 /nfs/dbraw/zinc/70/49/10/1362704910.db2.gz OMVRYXOZQMGBRN-INIZCTEOSA-N 1 3 325.522 2.627 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+]Cc1cccc2ccccc21 ZINC001392615611 1356162915 /nfs/dbraw/zinc/16/29/15/1356162915.db2.gz BZIZEQCXHDPSGS-INIZCTEOSA-N 1 3 327.472 2.774 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccsc1)NC(=O)c1cccc(CN(C)C)c1 ZINC001392620195 1356167978 /nfs/dbraw/zinc/16/79/78/1356167978.db2.gz RYXCBHPTMQIFHO-AWEZNQCLSA-N 1 3 331.485 2.718 10 0 EFAEHO CCc1cccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001401390966 1362744987 /nfs/dbraw/zinc/74/49/87/1362744987.db2.gz QSUKADLQRGTGGZ-PXNSSMCTSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1cccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001401390966 1362744990 /nfs/dbraw/zinc/74/49/90/1362744990.db2.gz QSUKADLQRGTGGZ-PXNSSMCTSA-N 1 3 345.531 2.870 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1 ZINC001392678308 1356227317 /nfs/dbraw/zinc/22/73/17/1356227317.db2.gz JURRRCQMJGAONZ-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1 ZINC001392678308 1356227321 /nfs/dbraw/zinc/22/73/21/1356227321.db2.gz JURRRCQMJGAONZ-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)CC[N@H+](C)C[C@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001392688146 1356238444 /nfs/dbraw/zinc/23/84/44/1356238444.db2.gz RHBCHEVFHPNBTR-MAUKXSAKSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)CC[N@@H+](C)C[C@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001392688146 1356238446 /nfs/dbraw/zinc/23/84/46/1356238446.db2.gz RHBCHEVFHPNBTR-MAUKXSAKSA-N 1 3 329.504 2.682 10 0 EFAEHO CCc1ccccc1C[N@H+](C)C[C@@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001392690142 1356240648 /nfs/dbraw/zinc/24/06/48/1356240648.db2.gz WUHWQFJLGKMZFH-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccccc1C[N@@H+](C)C[C@@H](C)NC(=O)CN1CC[C@@H](C)C1 ZINC001392690142 1356240652 /nfs/dbraw/zinc/24/06/52/1356240652.db2.gz WUHWQFJLGKMZFH-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@H+](C)Cc1cccc(OC)c1 ZINC001392725100 1356283626 /nfs/dbraw/zinc/28/36/26/1356283626.db2.gz IEYCGJMSYJAJML-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)Cc1cccc(OC)c1 ZINC001392725100 1356283631 /nfs/dbraw/zinc/28/36/31/1356283631.db2.gz IEYCGJMSYJAJML-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)C[C@@H](C)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001392731604 1356289837 /nfs/dbraw/zinc/28/98/37/1356289837.db2.gz WUTPJBKSLLAUFR-GDBMZVCRSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)C[C@@H](C)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001392731604 1356289838 /nfs/dbraw/zinc/28/98/38/1356289838.db2.gz WUTPJBKSLLAUFR-GDBMZVCRSA-N 1 3 337.895 2.537 10 0 EFAEHO CC[C@H]1CN(C(=O)CN2CCC(C)CC2)CC[C@@H]1[NH2+]CCC(C)C ZINC001392805376 1356341858 /nfs/dbraw/zinc/34/18/58/1356341858.db2.gz FQZZMPKOFMCIBY-OALUTQOASA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)C/C=C/c2ccccc2)CC[N@@H+]1C ZINC001401745702 1363079072 /nfs/dbraw/zinc/07/90/72/1363079072.db2.gz CCKLFELOYBSPAQ-SWAXFOCASA-N 1 3 343.515 2.867 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)C/C=C/c2ccccc2)CC[N@H+]1C ZINC001401745702 1363079077 /nfs/dbraw/zinc/07/90/77/1363079077.db2.gz CCKLFELOYBSPAQ-SWAXFOCASA-N 1 3 343.515 2.867 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@H]1CCN1CCc1ccc2ccccc2c1 ZINC001392853645 1356378168 /nfs/dbraw/zinc/37/81/68/1356378168.db2.gz LGEZWCNYNCDKMJ-FQEVSTJZSA-N 1 3 339.483 2.525 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+][C@@H]2CCc3ccc(Cl)cc32)CC1)N(C)C ZINC001392951871 1356460541 /nfs/dbraw/zinc/46/05/41/1356460541.db2.gz VQCRAKMFMFTECR-SJORKVTESA-N 1 3 349.906 2.906 10 0 EFAEHO Cc1cc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)CC[NH+](C)C)c(C)s1 ZINC001392966661 1356473152 /nfs/dbraw/zinc/47/31/52/1356473152.db2.gz KOONRVMXSQRTGK-MSOLQXFVSA-N 1 3 349.544 2.882 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCCC(C)(C)C)C1 ZINC001392983008 1356488686 /nfs/dbraw/zinc/48/86/86/1356488686.db2.gz ZQDCUAMYILCDCD-OKZBNKHCSA-N 1 3 335.536 2.830 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCCC(C)(C)C)C1 ZINC001392983008 1356488690 /nfs/dbraw/zinc/48/86/90/1356488690.db2.gz ZQDCUAMYILCDCD-OKZBNKHCSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CCc2ccccc2F)C[C@H]1C ZINC001393033379 1356525769 /nfs/dbraw/zinc/52/57/69/1356525769.db2.gz SPOZLNKDPJILPA-AEFFLSMTSA-N 1 3 349.494 2.678 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]1CNCc1ccc(Cl)cc1F ZINC001393047725 1356536723 /nfs/dbraw/zinc/53/67/23/1356536723.db2.gz ASCXLBFXFPOMHM-HNNXBMFYSA-N 1 3 341.858 2.511 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C[NH2+]CC1CCCC1)C1CCCC1 ZINC001393082681 1356574922 /nfs/dbraw/zinc/57/49/22/1356574922.db2.gz IIJOIDMTHGGRKT-SFHVURJKSA-N 1 3 332.492 2.715 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@]1(C)CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001393107145 1356601260 /nfs/dbraw/zinc/60/12/60/1356601260.db2.gz KUVDSKCIVTUKHA-HXUWFJFHSA-N 1 3 342.487 2.590 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@]1(C)CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001393107138 1356601440 /nfs/dbraw/zinc/60/14/40/1356601440.db2.gz KUVDSKCIVTUKHA-FQEVSTJZSA-N 1 3 342.487 2.590 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@@H]3C[N@H+](CC4CCCC4)C[C@H]3C2)CCC1 ZINC001394351187 1357725574 /nfs/dbraw/zinc/72/55/74/1357725574.db2.gz MDAVPOZQZOSQHZ-GUDVDZBRSA-N 1 3 347.547 2.878 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@@H]3C[N@@H+](CC4CCCC4)C[C@H]3C2)CCC1 ZINC001394351187 1357725578 /nfs/dbraw/zinc/72/55/78/1357725578.db2.gz MDAVPOZQZOSQHZ-GUDVDZBRSA-N 1 3 347.547 2.878 10 0 EFAEHO CCc1ccccc1[C@@H](CNC(=O)CN(C)C1CCC1)[NH2+]C(C)C ZINC001393385532 1356805616 /nfs/dbraw/zinc/80/56/16/1356805616.db2.gz WBGDKSMBLVUICC-LJQANCHMSA-N 1 3 331.504 2.889 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001393394629 1356814148 /nfs/dbraw/zinc/81/41/48/1356814148.db2.gz JFNWPGFQMHRENT-WMZOPIPTSA-N 1 3 349.494 2.658 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2C[N@@H+](CC3CC(C)(C)C3)C[C@@H]2C1)CC(C)(C)C ZINC001393421095 1356835154 /nfs/dbraw/zinc/83/51/54/1356835154.db2.gz UGCJRVLPFVRXSQ-HDICACEKSA-N 1 3 349.563 2.791 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2C[N@H+](CC3CC(C)(C)C3)C[C@@H]2C1)CC(C)(C)C ZINC001393421095 1356835159 /nfs/dbraw/zinc/83/51/59/1356835159.db2.gz UGCJRVLPFVRXSQ-HDICACEKSA-N 1 3 349.563 2.791 10 0 EFAEHO Cc1cc(F)ccc1CN1CC[C@H]2[C@@H]1CCCN2C(=O)CC[NH+](C)C ZINC001393460812 1356861985 /nfs/dbraw/zinc/86/19/85/1356861985.db2.gz JTFOCSOWIVKSBC-OALUTQOASA-N 1 3 347.478 2.651 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+]Cc2ccsc2)CCC1 ZINC001393544686 1356935796 /nfs/dbraw/zinc/93/57/96/1356935796.db2.gz JBVAULMGDRBJHI-MRXNPFEDSA-N 1 3 335.517 2.751 10 0 EFAEHO Cc1cccc(C[NH2+]C2(CNC(=O)C(C)(C)N3CCCC3)CCC2)c1 ZINC001393552665 1356944240 /nfs/dbraw/zinc/94/42/40/1356944240.db2.gz WGMBHZVGQLDUBY-UHFFFAOYSA-N 1 3 343.515 2.998 10 0 EFAEHO Cc1cccc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@@H]3C)CCC2)c1 ZINC001393567909 1356957758 /nfs/dbraw/zinc/95/77/58/1356957758.db2.gz IAKRHXWVQMHURQ-HDICACEKSA-N 1 3 343.515 2.996 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CCCN(Cc2cccnc2)CC1)[NH+](CC)CC ZINC001393598723 1356982573 /nfs/dbraw/zinc/98/25/73/1356982573.db2.gz VOFVXBLUNJDHAL-OALUTQOASA-N 1 3 346.519 2.673 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](CCc2ccccc2)CC1)N(C)C ZINC001393601372 1356987190 /nfs/dbraw/zinc/98/71/90/1356987190.db2.gz LSCLRPBSFMRZLD-RBUKOAKNSA-N 1 3 331.504 2.540 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](CCc2ccccc2)CC1)N(C)C ZINC001393601372 1356987193 /nfs/dbraw/zinc/98/71/93/1356987193.db2.gz LSCLRPBSFMRZLD-RBUKOAKNSA-N 1 3 331.504 2.540 10 0 EFAEHO CN(CCC[N@H+](C)CC1CCC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001393634574 1357031086 /nfs/dbraw/zinc/03/10/86/1357031086.db2.gz MIYDJYPKSRDNPU-LJQANCHMSA-N 1 3 341.515 2.779 10 0 EFAEHO CN(CCC[N@@H+](C)CC1CCC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001393634574 1357031088 /nfs/dbraw/zinc/03/10/88/1357031088.db2.gz MIYDJYPKSRDNPU-LJQANCHMSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[N@H+](C)CC2CCC(C)CC2)C1 ZINC001393636397 1357033068 /nfs/dbraw/zinc/03/30/68/1357033068.db2.gz QPPOJAWBHQPQJE-JLAWEPINSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[N@@H+](C)CC2CCC(C)CC2)C1 ZINC001393636397 1357033072 /nfs/dbraw/zinc/03/30/72/1357033072.db2.gz QPPOJAWBHQPQJE-JLAWEPINSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C)CC(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CC2CC2)CC1 ZINC001393653200 1357052636 /nfs/dbraw/zinc/05/26/36/1357052636.db2.gz XALVDQNNEKNCFU-AHRSYUTCSA-N 1 3 347.547 2.972 10 0 EFAEHO CCC1([NH2+]C/C=C/Cl)CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001393681541 1357076054 /nfs/dbraw/zinc/07/60/54/1357076054.db2.gz YNKLSCIDKRRBHL-RUDMXATFSA-N 1 3 341.927 2.832 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+](C)C1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001394395031 1357768494 /nfs/dbraw/zinc/76/84/94/1357768494.db2.gz CMORXAKTUBPOLT-UHFFFAOYSA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+](C)C1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001394395031 1357768504 /nfs/dbraw/zinc/76/85/04/1357768504.db2.gz CMORXAKTUBPOLT-UHFFFAOYSA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1ccc(C[N@@H+](C)C2CCN(C(=O)CN(C)C(C)C)CC2)cc1 ZINC001394400100 1357775926 /nfs/dbraw/zinc/77/59/26/1357775926.db2.gz UJSBBPPNKDBLGZ-UHFFFAOYSA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1ccc(C[N@H+](C)C2CCN(C(=O)CN(C)C(C)C)CC2)cc1 ZINC001394400100 1357775930 /nfs/dbraw/zinc/77/59/30/1357775930.db2.gz UJSBBPPNKDBLGZ-UHFFFAOYSA-N 1 3 331.504 2.758 10 0 EFAEHO C[N@H+](CCCC1CCCC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001394401668 1357778639 /nfs/dbraw/zinc/77/86/39/1357778639.db2.gz WUETWVHLTJUBGG-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO C[N@@H+](CCCC1CCCC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001394401668 1357778643 /nfs/dbraw/zinc/77/86/43/1357778643.db2.gz WUETWVHLTJUBGG-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H](C2CC2)N(C)C(=O)CN(C)C(C)C)cs1 ZINC001394436870 1357816335 /nfs/dbraw/zinc/81/63/35/1357816335.db2.gz BKQXUQUDRZNMQB-QGZVFWFLSA-N 1 3 337.533 2.723 10 0 EFAEHO CC(C)CC[NH2+][C@@H](C)CN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001394530539 1357915125 /nfs/dbraw/zinc/91/51/25/1357915125.db2.gz SECDXFOLJMLXGB-YJBOKZPZSA-N 1 3 329.504 2.682 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(Cl)c(F)c1)N(C)C ZINC001394534191 1357919384 /nfs/dbraw/zinc/91/93/84/1357919384.db2.gz DFBLUFZWXKZHTH-MLGOLLRUSA-N 1 3 343.874 2.756 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(CF)cc1 ZINC001394570443 1357962795 /nfs/dbraw/zinc/96/27/95/1357962795.db2.gz ZAIMHHGBGXIFSE-QFBILLFUSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@@H]1C[C@@H](NCc2ccc(Cl)c(F)c2)CN1C(=O)CC[NH+](C)C ZINC001394669245 1357986339 /nfs/dbraw/zinc/98/63/39/1357986339.db2.gz LTNDHOMMCORCFP-TZMCWYRMSA-N 1 3 341.858 2.510 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(Cl)s2)[C@H]1C ZINC001394670167 1357987897 /nfs/dbraw/zinc/98/78/97/1357987897.db2.gz BQHZLXZCVOQSLI-TZMCWYRMSA-N 1 3 343.924 2.821 10 0 EFAEHO C[C@H](F)CC[NH2+][C@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001394706790 1358032914 /nfs/dbraw/zinc/03/29/14/1358032914.db2.gz CTEAIQVXFALLJY-GJZGRUSLSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)CCN(C(=O)[C@H]1CCCN1C)C(C)C ZINC001394800783 1358085353 /nfs/dbraw/zinc/08/53/53/1358085353.db2.gz GSWVMWXVZXSPAZ-ZWKOTPCHSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)CCN(C(=O)[C@H]1CCCN1C)C(C)C ZINC001394800783 1358085357 /nfs/dbraw/zinc/08/53/57/1358085357.db2.gz GSWVMWXVZXSPAZ-ZWKOTPCHSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)N(CC[N@H+](C)CC1CC(C)(C)C1)C(=O)CN1CC[C@H](C)C1 ZINC001394810343 1358101303 /nfs/dbraw/zinc/10/13/03/1358101303.db2.gz WUOBDUKMZXLPIZ-KRWDZBQOSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CC1CC(C)(C)C1)C(=O)CN1CC[C@H](C)C1 ZINC001394810343 1358101306 /nfs/dbraw/zinc/10/13/06/1358101306.db2.gz WUOBDUKMZXLPIZ-KRWDZBQOSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)N(CC[N@H+](C)CCc1cccs1)C(=O)CN1CCCC1 ZINC001394811573 1358102791 /nfs/dbraw/zinc/10/27/91/1358102791.db2.gz GELUQKLCUCICAB-UHFFFAOYSA-N 1 3 337.533 2.555 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CCc1cccs1)C(=O)CN1CCCC1 ZINC001394811573 1358102795 /nfs/dbraw/zinc/10/27/95/1358102795.db2.gz GELUQKLCUCICAB-UHFFFAOYSA-N 1 3 337.533 2.555 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+]Cc1ccsc1)C(C)(C)C)C1CCC1 ZINC001394825051 1358122948 /nfs/dbraw/zinc/12/29/48/1358122948.db2.gz YALLNMXBYUYZNK-INIZCTEOSA-N 1 3 337.533 2.853 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C1CC[NH+](CCCC(C)C)CC1)N(C)C ZINC001394841565 1358144500 /nfs/dbraw/zinc/14/45/00/1358144500.db2.gz XRVPVWJCDJVERI-AEFFLSMTSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](F)CN1CCC([C@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)CC1 ZINC001394845485 1358149815 /nfs/dbraw/zinc/14/98/15/1358149815.db2.gz MZPQSWDUWRIGTP-DOTOQJQBSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2ccc3c(c2)CCC3)C1)N(C)C ZINC001394852243 1358157842 /nfs/dbraw/zinc/15/78/42/1358157842.db2.gz BFRUTRKRUOGCCL-SOAGJPPSSA-N 1 3 343.515 2.595 10 0 EFAEHO CCc1ccccc1C[NH2+]C1CC(N(C)C(=O)CN(C)C(C)C)C1 ZINC001394857724 1358163681 /nfs/dbraw/zinc/16/36/81/1358163681.db2.gz BCNMJILQPJBYFO-UHFFFAOYSA-N 1 3 331.504 2.668 10 0 EFAEHO CC[N@H+](C/C=C/Cl)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001440707575 1389830158 /nfs/dbraw/zinc/83/01/58/1389830158.db2.gz SZRBFUQSRFMYRS-RMKNXTFCSA-N 1 3 329.916 2.640 10 0 EFAEHO CC[N@@H+](C/C=C/Cl)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001440707575 1389830163 /nfs/dbraw/zinc/83/01/63/1389830163.db2.gz SZRBFUQSRFMYRS-RMKNXTFCSA-N 1 3 329.916 2.640 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@H]([NH2+]C/C=C\c2ccccc2)C1 ZINC001436883698 1387336885 /nfs/dbraw/zinc/33/68/85/1387336885.db2.gz QURRDNJNELOPIV-WLTZFMEZSA-N 1 3 341.499 2.765 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@@H]([NH2+]C[C@@H](C)CC(C)C)C1 ZINC001397164863 1359717409 /nfs/dbraw/zinc/71/74/09/1359717409.db2.gz AXADLESLUXJDDQ-BHYGNILZSA-N 1 3 334.508 2.817 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)cc1 ZINC001397165838 1359718395 /nfs/dbraw/zinc/71/83/95/1359718395.db2.gz HIJMDTHCMWXGSP-YSIASYRMSA-N 1 3 343.515 2.711 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CCc2ccccc2F)C1)N(C)C ZINC001397171878 1359722580 /nfs/dbraw/zinc/72/25/80/1359722580.db2.gz LWVLRNYUFOCYNC-KVSKMBFKSA-N 1 3 349.494 2.583 10 0 EFAEHO CC1CC(C[NH2+][C@@H]2CC[C@H](CNC(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001397175399 1359725494 /nfs/dbraw/zinc/72/54/94/1359725494.db2.gz TUNNVRVFZVTCCL-JYSRZZCRSA-N 1 3 337.552 2.885 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(C)c(F)c2)C1 ZINC001397178716 1359728306 /nfs/dbraw/zinc/72/83/06/1359728306.db2.gz YXUAPQZNEAMLLS-FUHWJXTLSA-N 1 3 349.494 2.850 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCCCC[C@H](NCc2ncccc2C)C1 ZINC001397228825 1359768086 /nfs/dbraw/zinc/76/80/86/1359768086.db2.gz RWJINLISDHKKDN-SFHVURJKSA-N 1 3 346.519 2.593 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCCCC[C@H](NCc2ncccc2C)C1 ZINC001397228825 1359768091 /nfs/dbraw/zinc/76/80/91/1359768091.db2.gz RWJINLISDHKKDN-SFHVURJKSA-N 1 3 346.519 2.593 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]2C)c1 ZINC001397239969 1359777346 /nfs/dbraw/zinc/77/73/46/1359777346.db2.gz HAWBQCRSOLWUPY-NEWSRXKRSA-N 1 3 331.504 2.660 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)[C@H]2C)c1 ZINC001397239969 1359777350 /nfs/dbraw/zinc/77/73/50/1359777350.db2.gz HAWBQCRSOLWUPY-NEWSRXKRSA-N 1 3 331.504 2.660 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@H+](CCc2ccccc2)[C@@H]1C)N(CC)CC ZINC001397277318 1359809733 /nfs/dbraw/zinc/80/97/33/1359809733.db2.gz ULQGQDUESQHTLJ-YZGWKJHDSA-N 1 3 345.531 2.929 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@@H+](CCc2ccccc2)[C@@H]1C)N(CC)CC ZINC001397277318 1359809737 /nfs/dbraw/zinc/80/97/37/1359809737.db2.gz ULQGQDUESQHTLJ-YZGWKJHDSA-N 1 3 345.531 2.929 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1)NCc1ccccc1F ZINC001437149539 1387422649 /nfs/dbraw/zinc/42/26/49/1387422649.db2.gz RWNDGGDLNNIXEM-KXBFYZLASA-N 1 3 347.478 2.827 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CCC[N@H+]1C1CCCC1)NCc1ccccc1F ZINC001437149539 1387422651 /nfs/dbraw/zinc/42/26/51/1387422651.db2.gz RWNDGGDLNNIXEM-KXBFYZLASA-N 1 3 347.478 2.827 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccccc1CC ZINC001437158725 1387427925 /nfs/dbraw/zinc/42/79/25/1387427925.db2.gz UJWORTKRNHCDHM-LPHOPBHVSA-N 1 3 331.504 2.718 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CCCCC2)C1 ZINC001397620218 1360008310 /nfs/dbraw/zinc/00/83/10/1360008310.db2.gz ZRBCYKPKYDWNTC-PBWTXFEYSA-N 1 3 335.536 2.924 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CC[C@@H]([NH2+]CC3CCCCC3)C2)CCC1 ZINC001397671525 1360039472 /nfs/dbraw/zinc/03/94/72/1360039472.db2.gz CHOPAZIAQZFSSW-ZWKOTPCHSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@H](C(=O)N1C[C@@H]2C[N@@H+](CCCC(C)(C)C)CC[C@@H]2C1)N(C)C ZINC001397768674 1360120278 /nfs/dbraw/zinc/12/02/78/1360120278.db2.gz NSIIQWNTPJDVJV-FGTMMUONSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@H](C(=O)N1C[C@@H]2C[N@H+](CCCC(C)(C)C)CC[C@@H]2C1)N(C)C ZINC001397768674 1360120281 /nfs/dbraw/zinc/12/02/81/1360120281.db2.gz NSIIQWNTPJDVJV-FGTMMUONSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]Cc1ccccc1C(F)(F)F)N(C)C ZINC001437167213 1387436412 /nfs/dbraw/zinc/43/64/12/1387436412.db2.gz IKPRAVLSYZLSGA-SWLSCSKDSA-N 1 3 345.409 2.640 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@H+](CC[C@@H](C)F)CC(C)(C)C1 ZINC001397818995 1360171394 /nfs/dbraw/zinc/17/13/94/1360171394.db2.gz URTOLWYUNUPSSD-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO Cc1ccc(CC[NH2+][C@@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001437183372 1387446324 /nfs/dbraw/zinc/44/63/24/1387446324.db2.gz DNCXOIBUVMMSBV-KRWDZBQOSA-N 1 3 331.504 2.506 10 0 EFAEHO CN(CC(=O)N(C)C1CC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1)C1CCC1 ZINC001398180686 1360359351 /nfs/dbraw/zinc/35/93/51/1360359351.db2.gz BKSKJEYMXZMMKU-KURKYZTESA-N 1 3 347.547 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC12CC[NH+](CCCC1CCC1)CC2 ZINC001398356135 1360480310 /nfs/dbraw/zinc/48/03/10/1360480310.db2.gz FDUJVXRNOGBMEH-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC12CC[NH+](CCC(C)(C)C)CC2)N(C)C ZINC001398367063 1360489074 /nfs/dbraw/zinc/48/90/74/1360489074.db2.gz SOUVVVDLWHYOSC-SJORKVTESA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC001437197531 1387457556 /nfs/dbraw/zinc/45/75/56/1387457556.db2.gz AATFMFVTCZSSKZ-JXFKEZNVSA-N 1 3 349.494 2.802 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+]CC1CCC(F)(F)CC1)C1CC1 ZINC001398445042 1360562833 /nfs/dbraw/zinc/56/28/33/1360562833.db2.gz ARGSHUZDWPBJJH-MRXNPFEDSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+][C@H]1CCc2c1cccc2F)C1CC1 ZINC001398447392 1360564921 /nfs/dbraw/zinc/56/49/21/1360564921.db2.gz GLTZYIURWSNZSA-RBUKOAKNSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc2ccccc2c1 ZINC001437201127 1387461060 /nfs/dbraw/zinc/46/10/60/1387461060.db2.gz GDBDSQAYAZKOFY-DLBZAZTESA-N 1 3 339.483 2.776 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc2ccccc2c1 ZINC001437201142 1387461102 /nfs/dbraw/zinc/46/11/02/1387461102.db2.gz GDBDSQAYAZKOFY-SJORKVTESA-N 1 3 339.483 2.776 10 0 EFAEHO O=C([C@H]1CCCC[N@@H+]1C1CCCC1)N1CC[C@H](NC/C=C\Cl)C1 ZINC001398523553 1360623703 /nfs/dbraw/zinc/62/37/03/1360623703.db2.gz CNWICCRMMFKUGV-SRFSPHLKSA-N 1 3 339.911 2.727 10 0 EFAEHO O=C([C@H]1CCCC[N@H+]1C1CCCC1)N1CC[C@H](NC/C=C\Cl)C1 ZINC001398523553 1360623707 /nfs/dbraw/zinc/62/37/07/1360623707.db2.gz CNWICCRMMFKUGV-SRFSPHLKSA-N 1 3 339.911 2.727 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H]([NH2+]C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001398552629 1360641693 /nfs/dbraw/zinc/64/16/93/1360641693.db2.gz HGNQYGDOPGELQK-YHUYYLMFSA-N 1 3 345.478 2.635 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@@H](C)CNC(=O)CN1CC[C@H](C)C1 ZINC001437204942 1387465411 /nfs/dbraw/zinc/46/54/11/1387465411.db2.gz KOVGTPBBBOTTMK-ZFWWWQNUSA-N 1 3 337.895 2.585 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C\Cl ZINC001398589115 1360660216 /nfs/dbraw/zinc/66/02/16/1360660216.db2.gz ILIGACPAAOBHRB-GAGOSHNASA-N 1 3 339.911 2.725 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C\Cl ZINC001398589115 1360660218 /nfs/dbraw/zinc/66/02/18/1360660218.db2.gz ILIGACPAAOBHRB-GAGOSHNASA-N 1 3 339.911 2.725 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1CCC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001398666812 1360698488 /nfs/dbraw/zinc/69/84/88/1360698488.db2.gz IIXVGVCBWGECGE-INIZCTEOSA-N 1 3 344.503 2.669 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1CCC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001398666812 1360698492 /nfs/dbraw/zinc/69/84/92/1360698492.db2.gz IIXVGVCBWGECGE-INIZCTEOSA-N 1 3 344.503 2.669 10 0 EFAEHO CCc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001398673130 1360703202 /nfs/dbraw/zinc/70/32/02/1360703202.db2.gz RWELUMZEQDZLTM-CEXWTWQISA-N 1 3 331.504 2.572 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+]C[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001398738912 1360754891 /nfs/dbraw/zinc/75/48/91/1360754891.db2.gz RXUPHRQYESVAMQ-MSOLQXFVSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]CCc1cccs1 ZINC001437212877 1387473807 /nfs/dbraw/zinc/47/38/07/1387473807.db2.gz HHBUPHIHBIESHW-NVXWUHKLSA-N 1 3 337.533 2.648 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H]1CCC[N@H+](CCc2ccccc2)C1 ZINC001398787117 1360790181 /nfs/dbraw/zinc/79/01/81/1360790181.db2.gz DGUPOQKPGVUJDW-QUCCMNQESA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H]1CCC[N@@H+](CCc2ccccc2)C1 ZINC001398787117 1360790183 /nfs/dbraw/zinc/79/01/83/1360790183.db2.gz DGUPOQKPGVUJDW-QUCCMNQESA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC001398788052 1360791141 /nfs/dbraw/zinc/79/11/41/1360791141.db2.gz FJAZPTHVOGDGFH-FUHWJXTLSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC001398788052 1360791142 /nfs/dbraw/zinc/79/11/42/1360791142.db2.gz FJAZPTHVOGDGFH-FUHWJXTLSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](Cc2ccccc2F)C1 ZINC001398799243 1360801133 /nfs/dbraw/zinc/80/11/33/1360801133.db2.gz UMSOYZOPBCYVNN-DLBZAZTESA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1 ZINC001398799243 1360801137 /nfs/dbraw/zinc/80/11/37/1360801137.db2.gz UMSOYZOPBCYVNN-DLBZAZTESA-N 1 3 349.494 2.883 10 0 EFAEHO C[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]CCc1ccccc1F ZINC001437215386 1387476302 /nfs/dbraw/zinc/47/63/02/1387476302.db2.gz MUTGWIVZZDEFCR-IRXDYDNUSA-N 1 3 349.494 2.727 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@H](C)CNC(=O)[C@H]1CCCN1C(C)C ZINC001398929675 1360877683 /nfs/dbraw/zinc/87/76/83/1360877683.db2.gz UFHHULVWGIQOGD-YLJYHZDGSA-N 1 3 345.531 2.759 10 0 EFAEHO C[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]CC1CC2(CCC2)C1 ZINC001399106151 1360997950 /nfs/dbraw/zinc/99/79/50/1360997950.db2.gz PVRKIPYRXHZBSP-IRXDYDNUSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(CN[C@@H](C)CNC(=O)[C@@H](C(C)C)[NH+](C)C)c(Cl)c1 ZINC001399114904 1361004514 /nfs/dbraw/zinc/00/45/14/1361004514.db2.gz SUCHKUBQSLZZMW-WMLDXEAASA-N 1 3 339.911 2.829 10 0 EFAEHO Cc1ccc(CN[C@H](C)CNC(=O)[C@@H](C(C)C)[NH+](C)C)c(Cl)c1 ZINC001399114896 1361004775 /nfs/dbraw/zinc/00/47/75/1361004775.db2.gz SUCHKUBQSLZZMW-RHSMWYFYSA-N 1 3 339.911 2.829 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+][C@@H](C)c1ccc(F)c(Cl)c1 ZINC001399177211 1361049806 /nfs/dbraw/zinc/04/98/06/1361049806.db2.gz WCAFLOSFNKZYHL-OLZOCXBDSA-N 1 3 343.874 2.975 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)[C@H](C(C)C)[NH+]1CCCC1 ZINC001492879758 1361081169 /nfs/dbraw/zinc/08/11/69/1361081169.db2.gz VWTGRNXATWNNDU-FQEVSTJZSA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC001399225747 1361083334 /nfs/dbraw/zinc/08/33/34/1361083334.db2.gz SCKOKNJIBIGEMM-INIZCTEOSA-N 1 3 339.430 2.655 10 0 EFAEHO CC(C)Oc1cccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001399227205 1361084707 /nfs/dbraw/zinc/08/47/07/1361084707.db2.gz XWLGBMONIMVFQL-SFHVURJKSA-N 1 3 347.503 2.505 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001437262033 1387514827 /nfs/dbraw/zinc/51/48/27/1387514827.db2.gz NWNOAKDYPIRLFX-OCCSQVGLSA-N 1 3 343.924 2.870 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@H+](C)C1)[C@@H](C)c1cccc(OC)c1 ZINC001399813251 1361513194 /nfs/dbraw/zinc/51/31/94/1361513194.db2.gz XXVZPZFGCAEJBS-DLBZAZTESA-N 1 3 347.503 2.536 10 0 EFAEHO CCN(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)[C@@H](C)c1cccc(OC)c1 ZINC001399813251 1361513198 /nfs/dbraw/zinc/51/31/98/1361513198.db2.gz XXVZPZFGCAEJBS-DLBZAZTESA-N 1 3 347.503 2.536 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1CCN(CCC(F)(F)F)C1)[NH+]1CCCCCC1 ZINC001399920061 1361576735 /nfs/dbraw/zinc/57/67/35/1361576735.db2.gz BEONEJHHWKXLOL-GJZGRUSLSA-N 1 3 349.441 2.641 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1CCN(Cc2ccc(F)cc2)C1)[NH+](CC)CC ZINC001399925831 1361581434 /nfs/dbraw/zinc/58/14/34/1361581434.db2.gz BWMLJUAFACPGQE-HKUYNNGSSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+]([C@@H]2CCc3c2cccc3F)C1 ZINC001399930815 1361585936 /nfs/dbraw/zinc/58/59/36/1361585936.db2.gz ICPGIATYXILNLY-HNAYVOBHSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+]([C@@H]2CCc3c2cccc3F)C1 ZINC001399930815 1361585939 /nfs/dbraw/zinc/58/59/39/1361585939.db2.gz ICPGIATYXILNLY-HNAYVOBHSA-N 1 3 347.478 2.591 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H](C)[NH2+]Cc2ccsc2)CC1 ZINC001400088121 1361726456 /nfs/dbraw/zinc/72/64/56/1361726456.db2.gz VFXVKLZMTWRGRZ-OAHLLOKOSA-N 1 3 337.533 2.807 10 0 EFAEHO O=C(CN1CCCC1)NCC[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC001400192553 1361833400 /nfs/dbraw/zinc/83/34/00/1361833400.db2.gz XYYVTJMRBGSQCD-QGZVFWFLSA-N 1 3 349.906 2.764 10 0 EFAEHO O=C(CN1CCCC1)NCC[C@@H]1CC[N@H+](Cc2ccc(Cl)cc2)C1 ZINC001400192553 1361833401 /nfs/dbraw/zinc/83/34/01/1361833401.db2.gz XYYVTJMRBGSQCD-QGZVFWFLSA-N 1 3 349.906 2.764 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[N@H+](C)Cc2cc(C)ccc2F)C1 ZINC001400233038 1361868330 /nfs/dbraw/zinc/86/83/30/1361868330.db2.gz SDDOMRVYYDIUMA-KRWDZBQOSA-N 1 3 349.494 2.756 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cc(C)ccc2F)C1 ZINC001400233038 1361868331 /nfs/dbraw/zinc/86/83/31/1361868331.db2.gz SDDOMRVYYDIUMA-KRWDZBQOSA-N 1 3 349.494 2.756 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@H+](C)CCCc2ccccc2)C1 ZINC001400247121 1361881862 /nfs/dbraw/zinc/88/18/62/1361881862.db2.gz ILIITEJHBOFCSR-FQEVSTJZSA-N 1 3 345.531 2.740 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@@H+](C)CCCc2ccccc2)C1 ZINC001400247121 1361881864 /nfs/dbraw/zinc/88/18/64/1361881864.db2.gz ILIITEJHBOFCSR-FQEVSTJZSA-N 1 3 345.531 2.740 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H]2CCC[C@@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001437320103 1387539514 /nfs/dbraw/zinc/53/95/14/1387539514.db2.gz HUJMPLGADBKTJQ-QZTJIDSGSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@H](C)CN1C[C@@H]2C[C@H]1CN2C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001400573008 1362030849 /nfs/dbraw/zinc/03/08/49/1362030849.db2.gz CCJCVGUEHIOOPV-BZSNNMDCSA-N 1 3 335.536 2.830 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001400657938 1362074215 /nfs/dbraw/zinc/07/42/15/1362074215.db2.gz KAYNDQZIWGCCEW-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C)c(CN2CC[C@@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001400657938 1362074218 /nfs/dbraw/zinc/07/42/18/1362074218.db2.gz KAYNDQZIWGCCEW-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO CCN(C(=O)C[C@H]1CC[N@H+](C)C1)[C@@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001400756490 1362144172 /nfs/dbraw/zinc/14/41/72/1362144172.db2.gz BKSFZJQYBWDVNL-WOJBJXKFSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)C[C@H]1CC[N@@H+](C)C1)[C@@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001400756490 1362144175 /nfs/dbraw/zinc/14/41/75/1362144175.db2.gz BKSFZJQYBWDVNL-WOJBJXKFSA-N 1 3 343.515 2.760 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccc(C)cc1 ZINC001400799521 1362171369 /nfs/dbraw/zinc/17/13/69/1362171369.db2.gz HSELBXMHAXSQNU-OALUTQOASA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]CCc1cccs1 ZINC001400800702 1362171929 /nfs/dbraw/zinc/17/19/29/1362171929.db2.gz IKFVIAITPZMOTM-RDJZCZTQSA-N 1 3 337.533 2.648 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)[NH2+]Cc1ccc(F)c(F)c1 ZINC001400842936 1362204309 /nfs/dbraw/zinc/20/43/09/1362204309.db2.gz DQQKYWCZGMUQJP-WMLDXEAASA-N 1 3 341.446 2.535 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]Cc1ccsc1 ZINC001400852412 1362211212 /nfs/dbraw/zinc/21/12/12/1362211212.db2.gz KEDHPDROPZTDEK-HNNXBMFYSA-N 1 3 325.522 2.710 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](CC)[NH2+]Cc1cccc2cccnc21)N(C)C ZINC001400912047 1362250859 /nfs/dbraw/zinc/25/08/59/1362250859.db2.gz RJAFFBGDQFOIPA-ZWKOTPCHSA-N 1 3 342.487 2.559 10 0 EFAEHO Cc1ccc(C[NH2+]CC2(NC(=O)CN(C)C(C)C)CCCC2)cc1F ZINC001400968260 1362306501 /nfs/dbraw/zinc/30/65/01/1362306501.db2.gz HZKIAPUAZIKPSF-UHFFFAOYSA-N 1 3 349.494 2.993 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)C[NH2+]CC1CC(C)(C)C1 ZINC001401124929 1362461937 /nfs/dbraw/zinc/46/19/37/1362461937.db2.gz FIPOEEYWVZRLJQ-HNNXBMFYSA-N 1 3 325.541 2.742 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001401127248 1362463915 /nfs/dbraw/zinc/46/39/15/1362463915.db2.gz XDLCXCBMJOGUMG-HUUCEWRRSA-N 1 3 345.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+]Cc1ccccc1Cl ZINC001401159446 1362493764 /nfs/dbraw/zinc/49/37/64/1362493764.db2.gz WKKIIHBSTBWCIT-CQSZACIVSA-N 1 3 325.884 2.522 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CCCC1 ZINC001401189638 1362528926 /nfs/dbraw/zinc/52/89/26/1362528926.db2.gz ZJDMZIRSUOUBQD-ZACQAIPSSA-N 1 3 344.503 2.715 10 0 EFAEHO CC(C)CCC[NH+]1CC2(C1)CCN(C(=O)[C@H](C(C)C)N(C)C)CC2 ZINC001401191758 1362531360 /nfs/dbraw/zinc/53/13/60/1362531360.db2.gz BOJYYFHYGIDDOJ-SFHVURJKSA-N 1 3 337.552 2.933 10 0 EFAEHO CN(CC(=O)N1CCC2(C[NH+](CCC3CC3)C2)CC1)CC(C)(C)C ZINC001401192325 1362532458 /nfs/dbraw/zinc/53/24/58/1362532458.db2.gz DGSJTIIWIUQALF-UHFFFAOYSA-N 1 3 335.536 2.689 10 0 EFAEHO CC[C@H](F)CNC[C@H](C)N(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001401224162 1362562862 /nfs/dbraw/zinc/56/28/62/1362562862.db2.gz MCTMVSOITQQHGD-GJZGRUSLSA-N 1 3 329.504 2.824 10 0 EFAEHO CC[C@H](F)CNC[C@H](C)N(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001401224162 1362562867 /nfs/dbraw/zinc/56/28/67/1362562867.db2.gz MCTMVSOITQQHGD-GJZGRUSLSA-N 1 3 329.504 2.824 10 0 EFAEHO C[C@H](C[NH2+]Cc1cc2ccccc2s1)N(C)C(=O)[C@H]1CCCN1C ZINC001401247041 1362585674 /nfs/dbraw/zinc/58/56/74/1362585674.db2.gz YLNHOIWJRCKNEQ-RHSMWYFYSA-N 1 3 345.512 2.932 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)cs1 ZINC001401299575 1362645840 /nfs/dbraw/zinc/64/58/40/1362645840.db2.gz NNSVMZJRYZFISP-RHSMWYFYSA-N 1 3 337.533 2.723 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1ccc(F)cc1)C(C)C ZINC001401335774 1362681626 /nfs/dbraw/zinc/68/16/26/1362681626.db2.gz QUSWOEOKIKYJHQ-MOPGFXCFSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC1CC1 ZINC001401339631 1362686469 /nfs/dbraw/zinc/68/64/69/1362686469.db2.gz BYJWPNOWYZLRAW-APWZRJJASA-N 1 3 341.515 2.729 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C(C)C ZINC001401351594 1362701860 /nfs/dbraw/zinc/70/18/60/1362701860.db2.gz IBWHCRQMUAPNNB-GOSISDBHSA-N 1 3 337.483 2.705 10 0 EFAEHO CN(CC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)C(=O)CN(C)C1CCC1 ZINC001401368892 1362719285 /nfs/dbraw/zinc/71/92/85/1362719285.db2.gz LSUKQIBCKIYHPA-OAHLLOKOSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)C(=O)CN(C)C1CCC1 ZINC001401368892 1362719289 /nfs/dbraw/zinc/71/92/89/1362719289.db2.gz LSUKQIBCKIYHPA-OAHLLOKOSA-N 1 3 345.478 2.686 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C12CC[NH+](CC1)C2)N[C@H](C)c1ccccc1F ZINC001401380111 1362732682 /nfs/dbraw/zinc/73/26/82/1362732682.db2.gz KUFYGJDCHXWYGC-CRAIPNDOSA-N 1 3 347.478 2.713 10 0 EFAEHO CC(C)[C@H](CNC(=O)C12CC[NH+](CC1)C2)N[C@H](C)c1ccccc1F ZINC001401380113 1362732848 /nfs/dbraw/zinc/73/28/48/1362732848.db2.gz KUFYGJDCHXWYGC-QAPCUYQASA-N 1 3 347.478 2.713 10 0 EFAEHO CN(CCc1ccccc1)CCN(C)C(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001401433517 1362800180 /nfs/dbraw/zinc/80/01/80/1362800180.db2.gz CQUVZJRKJQBUQV-UXHICEINSA-N 1 3 345.531 2.740 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(C)CCN(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001401437768 1362806464 /nfs/dbraw/zinc/80/64/64/1362806464.db2.gz HKPLHURAOGMXKW-CVEARBPZSA-N 1 3 335.467 2.619 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(C)CCN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001401437768 1362806467 /nfs/dbraw/zinc/80/64/67/1362806467.db2.gz HKPLHURAOGMXKW-CVEARBPZSA-N 1 3 335.467 2.619 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@@H]21 ZINC001401509840 1362898110 /nfs/dbraw/zinc/89/81/10/1362898110.db2.gz XBSOJBQEQGNCGM-ROUUACIJSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@@H]21 ZINC001401509840 1362898112 /nfs/dbraw/zinc/89/81/12/1362898112.db2.gz XBSOJBQEQGNCGM-ROUUACIJSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CNCc2cccc(C(C)C)n2)CC[N@@H+]1C ZINC001401619645 1362976713 /nfs/dbraw/zinc/97/67/13/1362976713.db2.gz QLZKQXPHUYJMMR-HHXXYDBFSA-N 1 3 346.519 2.530 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CNCc2cccc(C(C)C)n2)CC[N@H+]1C ZINC001401619645 1362976716 /nfs/dbraw/zinc/97/67/16/1362976716.db2.gz QLZKQXPHUYJMMR-HHXXYDBFSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]CC1CC2(CCC2)C1 ZINC001401651489 1363000994 /nfs/dbraw/zinc/00/09/94/1363000994.db2.gz JWYBTMXKHSPRMB-AEFFLSMTSA-N 1 3 335.536 2.924 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1cc2ccccc2o1 ZINC001401722714 1363054908 /nfs/dbraw/zinc/05/49/08/1363054908.db2.gz IEULJHLSOXKCCL-YJBOKZPZSA-N 1 3 343.471 2.902 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+]1C(C)C ZINC001401754390 1363088418 /nfs/dbraw/zinc/08/84/18/1363088418.db2.gz JZCFKBRWUUWLKQ-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@@H](C)NC(=O)[C@@H]1CCC[N@H+]1C(C)C ZINC001401754390 1363088419 /nfs/dbraw/zinc/08/84/19/1363088419.db2.gz JZCFKBRWUUWLKQ-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO CCc1ccc(CC[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001401782833 1363124015 /nfs/dbraw/zinc/12/40/15/1363124015.db2.gz SSDXNKFOXWFBOH-QZTJIDSGSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccc(CC[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001401782833 1363124019 /nfs/dbraw/zinc/12/40/19/1363124019.db2.gz SSDXNKFOXWFBOH-QZTJIDSGSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccc(CC[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001401782849 1363124463 /nfs/dbraw/zinc/12/44/63/1363124463.db2.gz SSDXNKFOXWFBOH-ZWKOTPCHSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccc(CC[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001401782849 1363124465 /nfs/dbraw/zinc/12/44/65/1363124465.db2.gz SSDXNKFOXWFBOH-ZWKOTPCHSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccc(CN(C)C[C@H](C)NC(=O)C[C@H]2CC[N@H+](C)C2)cc1 ZINC001401797051 1363143263 /nfs/dbraw/zinc/14/32/63/1363143263.db2.gz HTTJDXGLMYMTMK-QFBILLFUSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(CN(C)C[C@H](C)NC(=O)C[C@H]2CC[N@@H+](C)C2)cc1 ZINC001401797051 1363143264 /nfs/dbraw/zinc/14/32/64/1363143264.db2.gz HTTJDXGLMYMTMK-QFBILLFUSA-N 1 3 331.504 2.527 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]C2(CNC(=O)[C@H](C(C)C)N(C)C)CC2)c1 ZINC001401947341 1363267204 /nfs/dbraw/zinc/26/72/04/1363267204.db2.gz OLVVBXCVFUVXIA-WMZOPIPTSA-N 1 3 331.504 2.881 10 0 EFAEHO CN(CC(=O)NCC1([NH2+]CC[C@H]2CCCC2(F)F)CC1)C1CCC1 ZINC001401947229 1363267216 /nfs/dbraw/zinc/26/72/16/1363267216.db2.gz BOCOYQOZUPDSKC-CQSZACIVSA-N 1 3 343.462 2.535 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+][C@@H]3CCc4ccc(F)cc43)CC2)CCC1 ZINC001401950682 1363269737 /nfs/dbraw/zinc/26/97/37/1363269737.db2.gz UQKSUBZTGXUBTE-QGZVFWFLSA-N 1 3 345.462 2.536 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+]Cc2ccc(C(C)C)cc2)CC1)N(C)C ZINC001401959189 1363276755 /nfs/dbraw/zinc/27/67/55/1363276755.db2.gz VQMFBZIBPSFTDI-GOSISDBHSA-N 1 3 331.504 2.889 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001401965831 1363282789 /nfs/dbraw/zinc/28/27/89/1363282789.db2.gz BOWNWXNLFBNDGC-ZWKOTPCHSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@H]1CCC[C@H]2CCC[N@H+]21 ZINC001401965831 1363282791 /nfs/dbraw/zinc/28/27/91/1363282791.db2.gz BOWNWXNLFBNDGC-ZWKOTPCHSA-N 1 3 345.462 2.581 10 0 EFAEHO CC(C)(C)CC[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001401965515 1363282808 /nfs/dbraw/zinc/28/28/08/1363282808.db2.gz ODZLAABNICLKLN-IBGZPJMESA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@H]([NH2+]C1(CNC(=O)C(C)(C)N2CCCC2)CC1)c1ccccc1 ZINC001401969910 1363286508 /nfs/dbraw/zinc/28/65/08/1363286508.db2.gz UTGOOGLIZVTZLP-INIZCTEOSA-N 1 3 329.488 2.860 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1(N[C@@H]2CCc3ccc(F)cc32)CC1)[NH+](C)C ZINC001401976498 1363293061 /nfs/dbraw/zinc/29/30/61/1363293061.db2.gz DWXNWPXCFZIBIE-QZTJIDSGSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1(NCc2cccc(F)c2)CC1)[NH+]1CCCC1 ZINC001401987919 1363304739 /nfs/dbraw/zinc/30/47/39/1363304739.db2.gz SUNBVTPWSBMNQL-GOSISDBHSA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CC[N@@H+](CC[C@@H](C)F)C2)CC1 ZINC001401990982 1363308746 /nfs/dbraw/zinc/30/87/46/1363308746.db2.gz UQYAAHYLNVXGGB-AEFFLSMTSA-N 1 3 341.515 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CC[N@H+](CC[C@@H](C)F)C2)CC1 ZINC001401990982 1363308750 /nfs/dbraw/zinc/30/87/50/1363308750.db2.gz UQYAAHYLNVXGGB-AEFFLSMTSA-N 1 3 341.515 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+]CC1CCC2(CC2)CC1 ZINC001402068806 1363374688 /nfs/dbraw/zinc/37/46/88/1363374688.db2.gz BRBIFSMLWDHIEG-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]CC1CCC2(CC2)CC1 ZINC001402068783 1363374849 /nfs/dbraw/zinc/37/48/49/1363374849.db2.gz BRBIFSMLWDHIEG-GOSISDBHSA-N 1 3 335.536 2.878 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@H]2CCCN([C@@H]3CCc4ccccc43)C2)CC1 ZINC001402086267 1363390428 /nfs/dbraw/zinc/39/04/28/1363390428.db2.gz LETCRCCPEHPOFZ-PKOBYXMFSA-N 1 3 341.499 2.596 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2CCCF)N(CC)CC ZINC001402106360 1363413527 /nfs/dbraw/zinc/41/35/27/1363413527.db2.gz KRLPCYHVASARGQ-IXDOHACOSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2CCCF)N(CC)CC ZINC001402106360 1363413531 /nfs/dbraw/zinc/41/35/31/1363413531.db2.gz KRLPCYHVASARGQ-IXDOHACOSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]Cc1cccc(F)c1)C1CCCC1 ZINC001402109040 1363415624 /nfs/dbraw/zinc/41/56/24/1363415624.db2.gz SJRNUXLUQSHATN-IBGZPJMESA-N 1 3 349.494 2.931 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CC[C@H]2CC[C@@H](C1)N2C[C@H](F)CC ZINC001402127444 1363433645 /nfs/dbraw/zinc/43/36/45/1363433645.db2.gz XICCSHQJCHIJQC-ZACQAIPSSA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CC[C@H]2CC[C@@H](C1)N2C[C@H](F)CC ZINC001402127444 1363433650 /nfs/dbraw/zinc/43/36/50/1363433650.db2.gz XICCSHQJCHIJQC-ZACQAIPSSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@H](F)CN1CCC(C)(CNC(=O)CC[C@@H]2CCC[N@@H+]2C)CC1 ZINC001402193282 1363501131 /nfs/dbraw/zinc/50/11/31/1363501131.db2.gz WVJAUAIUNPFOGW-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](F)CN1CCC(C)(CNC(=O)CC[C@@H]2CCC[N@H+]2C)CC1 ZINC001402193282 1363501132 /nfs/dbraw/zinc/50/11/32/1363501132.db2.gz WVJAUAIUNPFOGW-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](C(=O)NCC1(C)CC[NH+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001402193409 1363501273 /nfs/dbraw/zinc/50/12/73/1363501273.db2.gz YACQOWVNUJNAGA-QGZVFWFLSA-N 1 3 337.552 2.981 10 0 EFAEHO CCC(CC)C[N@@H+]1CCC[C@@](C)(CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001402201466 1363511002 /nfs/dbraw/zinc/51/10/02/1363511002.db2.gz FLNOVZMAWWKYMC-MJGOQNOKSA-N 1 3 325.541 2.981 10 0 EFAEHO CCC(CC)C[N@H+]1CCC[C@@](C)(CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001402201466 1363511005 /nfs/dbraw/zinc/51/10/05/1363511005.db2.gz FLNOVZMAWWKYMC-MJGOQNOKSA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@]1(C)CCC[N@H+](CCC(C)(C)C)C1 ZINC001402219150 1363539285 /nfs/dbraw/zinc/53/92/85/1363539285.db2.gz DHQZYVGRCIANRQ-LJQANCHMSA-N 1 3 334.508 2.915 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@]1(C)CCC[N@@H+](CCC(C)(C)C)C1 ZINC001402219150 1363539288 /nfs/dbraw/zinc/53/92/88/1363539288.db2.gz DHQZYVGRCIANRQ-LJQANCHMSA-N 1 3 334.508 2.915 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](NCC=C(Cl)Cl)C2CC2)CC[N@@H+]1C ZINC001402302715 1363594622 /nfs/dbraw/zinc/59/46/22/1363594622.db2.gz NFNAQOJLYTVEAU-BFHYXJOUSA-N 1 3 348.318 2.520 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](NCC=C(Cl)Cl)C2CC2)CC[N@H+]1C ZINC001402302715 1363594624 /nfs/dbraw/zinc/59/46/24/1363594624.db2.gz NFNAQOJLYTVEAU-BFHYXJOUSA-N 1 3 348.318 2.520 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]([NH2+]CCC(F)(F)F)C1CC1)N1CCCCCC1 ZINC001402346604 1363617889 /nfs/dbraw/zinc/61/78/89/1363617889.db2.gz RFTZBHVWAZWTOC-ZFWWWQNUSA-N 1 3 349.441 2.688 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001402401378 1363660306 /nfs/dbraw/zinc/66/03/06/1363660306.db2.gz CCCNICXNZMEULT-AEFFLSMTSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001402401383 1363660383 /nfs/dbraw/zinc/66/03/83/1363660383.db2.gz CCCNICXNZMEULT-FUHWJXTLSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001402403531 1363663148 /nfs/dbraw/zinc/66/31/48/1363663148.db2.gz IVMZNZKRFUIWLY-GBESFXJTSA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001402403531 1363663149 /nfs/dbraw/zinc/66/31/49/1363663149.db2.gz IVMZNZKRFUIWLY-GBESFXJTSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2ccc(C)cc2)C1 ZINC001402411650 1363671829 /nfs/dbraw/zinc/67/18/29/1363671829.db2.gz DTCJNXGRBBWJRB-MJGOQNOKSA-N 1 3 331.504 2.521 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2[C@@H]1CC[N@@H+]2CCCF)N(CC)CC ZINC001402479466 1363722891 /nfs/dbraw/zinc/72/28/91/1363722891.db2.gz QTUMVBUNMAGXSS-IKGGRYGDSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2[C@@H]1CC[N@H+]2CCCF)N(CC)CC ZINC001402479466 1363722895 /nfs/dbraw/zinc/72/28/95/1363722895.db2.gz QTUMVBUNMAGXSS-IKGGRYGDSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]2[C@@H]1CC[N@@H+]2CCCF)N(CC)CC ZINC001402479476 1363723364 /nfs/dbraw/zinc/72/33/64/1363723364.db2.gz QTUMVBUNMAGXSS-ZACQAIPSSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]2[C@@H]1CC[N@H+]2CCCF)N(CC)CC ZINC001402479476 1363723367 /nfs/dbraw/zinc/72/33/67/1363723367.db2.gz QTUMVBUNMAGXSS-ZACQAIPSSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+][C@@H](C)c1ccc(F)cc1F ZINC001437429398 1387640709 /nfs/dbraw/zinc/64/07/09/1387640709.db2.gz UOUUJJJJVKIHPL-KGLIPLIRSA-N 1 3 341.446 2.850 10 0 EFAEHO CC[C@H](C(=O)NCc1cccc2c1CC[N@H+](CC1CCC1)C2)N(C)C ZINC001402528373 1363762801 /nfs/dbraw/zinc/76/28/01/1363762801.db2.gz PFIXAHLSJIMLJO-HXUWFJFHSA-N 1 3 343.515 2.801 10 0 EFAEHO CC[C@H](C(=O)NCc1cccc2c1CC[N@@H+](CC1CCC1)C2)N(C)C ZINC001402528373 1363762804 /nfs/dbraw/zinc/76/28/04/1363762804.db2.gz PFIXAHLSJIMLJO-HXUWFJFHSA-N 1 3 343.515 2.801 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2cc(C)ccc2C)C1)N(C)C ZINC001402587294 1363814981 /nfs/dbraw/zinc/81/49/81/1363814981.db2.gz JNCLSVRQOSNZMF-IMBTUZDBSA-N 1 3 331.504 2.941 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2cc(C)ccc2C)C1)N(C)C ZINC001402587298 1363815003 /nfs/dbraw/zinc/81/50/03/1363815003.db2.gz JNCLSVRQOSNZMF-VXIBKDFQSA-N 1 3 331.504 2.941 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCc3c2cccc3F)C1)C1CCC1 ZINC001402588481 1363815941 /nfs/dbraw/zinc/81/59/41/1363815941.db2.gz BZESBHIXQXWPSZ-KSMMKXTCSA-N 1 3 345.462 2.534 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2cccc(Cl)c2)C1)N(C)C ZINC001402591856 1363817886 /nfs/dbraw/zinc/81/78/86/1363817886.db2.gz MYOGZPDARMELAO-VDNDLQMASA-N 1 3 337.895 2.978 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+]CC[C@H]3CCCC3(F)F)C2)CCC1 ZINC001402601473 1363824954 /nfs/dbraw/zinc/82/49/54/1363824954.db2.gz RILGXYUHTKSFEL-KFWWJZLASA-N 1 3 343.462 2.533 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)cc1C ZINC001402607293 1363830813 /nfs/dbraw/zinc/83/08/13/1363830813.db2.gz ZZCJLIWJPNMVDB-HDICACEKSA-N 1 3 329.488 2.525 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]CC=C(Cl)Cl)C1)CC(C)(C)C ZINC001402612575 1363834210 /nfs/dbraw/zinc/83/42/10/1363834210.db2.gz RQPPPZJFFMVDKI-TXEJJXNPSA-N 1 3 336.307 2.520 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@H]1C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001402624621 1363850779 /nfs/dbraw/zinc/85/07/79/1363850779.db2.gz DPHLAHRPASZMJE-HSALFYBXSA-N 1 3 345.531 2.615 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CCCN(Cc2cccnc2)C1)[NH+](CC)CC ZINC001402670099 1363918674 /nfs/dbraw/zinc/91/86/74/1363918674.db2.gz WUVKFZBGKGHCII-MOPGFXCFSA-N 1 3 346.519 2.530 10 0 EFAEHO CC[C@@H](C)[C@@H](C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CC)CC1 ZINC001402683708 1363932605 /nfs/dbraw/zinc/93/26/05/1363932605.db2.gz QPIHPILVUAOIDG-RWQQGDIJSA-N 1 3 335.536 2.828 10 0 EFAEHO CN(CCCN(C)C(=O)CC[NH+]1CCCCC1)Cc1ccsc1 ZINC001402683133 1363932943 /nfs/dbraw/zinc/93/29/43/1363932943.db2.gz SCGDWZAKECAKQY-UHFFFAOYSA-N 1 3 337.533 2.904 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1C[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001402759630 1364006585 /nfs/dbraw/zinc/00/65/85/1364006585.db2.gz TWQIZRCDVFVHMO-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C)([NH2+]C[C@@H](C)CC(C)C)CC1)N(C)C ZINC001402768530 1364017190 /nfs/dbraw/zinc/01/71/90/1364017190.db2.gz FAUDRJHAKQXMTN-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccc(C[NH2+]C2(C)CCN(C(=O)CN(C)C(C)C)CC2)c(C)n1 ZINC001402781118 1364029106 /nfs/dbraw/zinc/02/91/06/1364029106.db2.gz JKIDCXYERVEBTI-UHFFFAOYSA-N 1 3 346.519 2.509 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@H](C)[C@H](NCc2cc(C)ccc2F)C1 ZINC001402786743 1364033444 /nfs/dbraw/zinc/03/34/44/1364033444.db2.gz NPPRYWNEOHTSST-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@H](C)[C@H](NCc2cc(C)ccc2F)C1 ZINC001402786743 1364033447 /nfs/dbraw/zinc/03/34/47/1364033447.db2.gz NPPRYWNEOHTSST-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H]1CCCCN1C(C)C ZINC001402797575 1364044145 /nfs/dbraw/zinc/04/41/45/1364044145.db2.gz YHEKNZQKSYHCOR-OBKDMQGPSA-N 1 3 349.563 2.978 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H]1CCCCN1C(C)C ZINC001402797575 1364044151 /nfs/dbraw/zinc/04/41/51/1364044151.db2.gz YHEKNZQKSYHCOR-OBKDMQGPSA-N 1 3 349.563 2.978 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]Cc2ccccc2F)CC1)N(C)C ZINC001402832054 1364078457 /nfs/dbraw/zinc/07/84/57/1364078457.db2.gz ZCWDIAWPUAGOBF-LEOMRAHMSA-N 1 3 335.467 2.683 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]Cc1ccc(C)c(F)c1 ZINC001402860209 1364098100 /nfs/dbraw/zinc/09/81/00/1364098100.db2.gz SHHYDSWDPURCMY-QFBILLFUSA-N 1 3 349.494 2.993 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CCCCN2C(=O)CN(C)C(C)C)cc1 ZINC001402894132 1364115586 /nfs/dbraw/zinc/11/55/86/1364115586.db2.gz IIHNBNODXGYYAV-IBGZPJMESA-N 1 3 331.504 2.806 10 0 EFAEHO CN(C)C1(C(=O)NC2CC(C[NH2+]Cc3ccc(CF)cc3)C2)CCC1 ZINC001402927329 1364142046 /nfs/dbraw/zinc/14/20/46/1364142046.db2.gz RXWBYWWMPBKPNR-UHFFFAOYSA-N 1 3 347.478 2.625 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)CC(C)(C)C ZINC001403015068 1364215062 /nfs/dbraw/zinc/21/50/62/1364215062.db2.gz OOLLFOGFDBRQTD-IRXDYDNUSA-N 1 3 333.520 2.956 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CCC([NH2+]Cc2ccsc2)CC1 ZINC001403037770 1364241694 /nfs/dbraw/zinc/24/16/94/1364241694.db2.gz HFZSHPSQLSHWKD-UHFFFAOYSA-N 1 3 337.533 2.948 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)c1 ZINC001403039112 1364243249 /nfs/dbraw/zinc/24/32/49/1364243249.db2.gz VSMHGWWBYGVBFN-SJORKVTESA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)CNC(=O)[C@H]2CCCCN2C(C)C)cc1 ZINC001403050112 1364254520 /nfs/dbraw/zinc/25/45/20/1364254520.db2.gz OUKWXTSVYYXOQM-UYAOXDASSA-N 1 3 345.531 2.895 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C(C)C)c(Cl)c1 ZINC001403057016 1364261884 /nfs/dbraw/zinc/26/18/84/1364261884.db2.gz XZRHPWAEXJETRE-HUUCEWRRSA-N 1 3 339.911 2.971 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](C)[C@@H](C)NC(=O)CC[NH+](C)C ZINC001403066394 1364270412 /nfs/dbraw/zinc/27/04/12/1364270412.db2.gz WEMLYBHQBURBIJ-ZIAGYGMSSA-N 1 3 325.884 2.583 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001403144639 1364362148 /nfs/dbraw/zinc/36/21/48/1364362148.db2.gz ONYLDSHZGJFKID-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001403144639 1364362151 /nfs/dbraw/zinc/36/21/51/1364362151.db2.gz ONYLDSHZGJFKID-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[N@H+](C)CC1CCCC1 ZINC001403164519 1364384964 /nfs/dbraw/zinc/38/49/64/1364384964.db2.gz BTHJYIVUOZMNQH-DNVCBOLYSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[N@@H+](C)CC1CCCC1 ZINC001403164519 1364384966 /nfs/dbraw/zinc/38/49/66/1364384966.db2.gz BTHJYIVUOZMNQH-DNVCBOLYSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]([NH2+]CCc2ccccc2F)C1 ZINC001403265914 1364478551 /nfs/dbraw/zinc/47/85/51/1364478551.db2.gz BODJBWLFIKQEJL-ZWKOTPCHSA-N 1 3 349.494 2.725 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]([NH2+]CCc2ccccc2F)C1 ZINC001403265903 1364478564 /nfs/dbraw/zinc/47/85/64/1364478564.db2.gz BODJBWLFIKQEJL-QZTJIDSGSA-N 1 3 349.494 2.725 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]([NH2+]CCc2ccccc2)C1 ZINC001403274670 1364487699 /nfs/dbraw/zinc/48/76/99/1364487699.db2.gz IFSQSNREQJNIAI-MOPGFXCFSA-N 1 3 331.504 2.586 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCCC[N@@H+]1CCCF)N1CCCC1 ZINC001403297682 1364513308 /nfs/dbraw/zinc/51/33/08/1364513308.db2.gz YXEDLCPJAROWLP-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCCCC[N@H+]1CCCF)N1CCCC1 ZINC001403297682 1364513312 /nfs/dbraw/zinc/51/33/12/1364513312.db2.gz YXEDLCPJAROWLP-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C1C[NH+](CCC2CCCCC2)C1)N(C)C ZINC001403314569 1364531262 /nfs/dbraw/zinc/53/12/62/1364531262.db2.gz AYMANTBYWXQMLL-QFBILLFUSA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1ccc(CN2CC([C@@H](C)NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)cc1 ZINC001403331684 1364549191 /nfs/dbraw/zinc/54/91/91/1364549191.db2.gz ULTJXEWPKOZNJQ-XLIONFOSSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1ccc(CN2CC([C@@H](C)NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)cc1 ZINC001403331684 1364549195 /nfs/dbraw/zinc/54/91/95/1364549195.db2.gz ULTJXEWPKOZNJQ-XLIONFOSSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1cc(C)cc(C[NH+]2CC([C@H](C)NC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001403332060 1364549247 /nfs/dbraw/zinc/54/92/47/1364549247.db2.gz RKRYROKFLRUYIC-YJBOKZPZSA-N 1 3 343.515 2.582 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](CC2CCC(C)(C)CC2)C1)N(C)C ZINC001403360256 1364571201 /nfs/dbraw/zinc/57/12/01/1364571201.db2.gz VZVATSYSIWDEIY-CRAIPNDOSA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001437482108 1387684393 /nfs/dbraw/zinc/68/43/93/1387684393.db2.gz OHDAVOCEUZISQV-LJQANCHMSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001437482108 1387684403 /nfs/dbraw/zinc/68/44/03/1387684403.db2.gz OHDAVOCEUZISQV-LJQANCHMSA-N 1 3 331.504 2.726 10 0 EFAEHO COc1cccc([C@H](C)N2C[C@@H](NC(=O)CC[NH+](C)C)C(C)(C)C2)c1 ZINC001403373922 1364584285 /nfs/dbraw/zinc/58/42/85/1364584285.db2.gz DFEQYYQSGHOKSQ-MAUKXSAKSA-N 1 3 347.503 2.535 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001403421701 1364625971 /nfs/dbraw/zinc/62/59/71/1364625971.db2.gz SKRFAIGXPJYAGZ-SLFFLAALSA-N 1 3 343.515 2.745 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001403421701 1364625974 /nfs/dbraw/zinc/62/59/74/1364625974.db2.gz SKRFAIGXPJYAGZ-SLFFLAALSA-N 1 3 343.515 2.745 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001403453663 1364654912 /nfs/dbraw/zinc/65/49/12/1364654912.db2.gz BCXSUUKRTNKYIY-UFYCRDLUSA-N 1 3 345.531 2.874 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1F ZINC001403476370 1364680337 /nfs/dbraw/zinc/68/03/37/1364680337.db2.gz DFCAFLCNXXEEGN-KBPBESRZSA-N 1 3 341.446 2.850 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1F ZINC001403476384 1364680795 /nfs/dbraw/zinc/68/07/95/1364680795.db2.gz DFCAFLCNXXEEGN-KGLIPLIRSA-N 1 3 341.446 2.850 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C[NH2+]Cc1ccc(F)cc1C)C1CC1)N(C)C ZINC001403533560 1364737161 /nfs/dbraw/zinc/73/71/61/1364737161.db2.gz RXPQYUFEDQHATM-RTBURBONSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)cc1 ZINC001403591766 1364794432 /nfs/dbraw/zinc/79/44/32/1364794432.db2.gz PPPYKMMAAZHCSR-RBUKOAKNSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)cc1 ZINC001403591766 1364794434 /nfs/dbraw/zinc/79/44/34/1364794434.db2.gz PPPYKMMAAZHCSR-RBUKOAKNSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)C(C)(C)[NH+]2CCCC2)c(C)c1 ZINC001437500206 1387701015 /nfs/dbraw/zinc/70/10/15/1387701015.db2.gz XMOIXLMOSRCEEQ-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO C[C@H](CN(C)C(=O)C[C@@H]1CC[N@H+](C)C1)NCc1ccccc1Cl ZINC001403615914 1364819481 /nfs/dbraw/zinc/81/94/81/1364819481.db2.gz QIQJNBUDVNPMNU-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1)NCc1ccccc1Cl ZINC001403615914 1364819486 /nfs/dbraw/zinc/81/94/86/1364819486.db2.gz QIQJNBUDVNPMNU-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO CN(CCNC(=O)CC1CC[NH+](C)CC1)Cc1ccc(C2CC2)cc1 ZINC001403700297 1364873397 /nfs/dbraw/zinc/87/33/97/1364873397.db2.gz IVWPNYXWIKKINM-UHFFFAOYSA-N 1 3 343.515 2.844 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@@H+](C)CCNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001403752990 1364902394 /nfs/dbraw/zinc/90/23/94/1364902394.db2.gz SPHUECBNAZPKLC-PKOBYXMFSA-N 1 3 333.520 2.999 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[N@H+](C)CCNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001403752990 1364902399 /nfs/dbraw/zinc/90/23/99/1364902399.db2.gz SPHUECBNAZPKLC-PKOBYXMFSA-N 1 3 333.520 2.999 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]C[C@@H]2CCC(F)(F)C2)C(C)(C)C1 ZINC001403828401 1364981531 /nfs/dbraw/zinc/98/15/31/1364981531.db2.gz GKCHYFZPWQMDFT-HUUCEWRRSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+][C@@H](C)c2ccccc2)C(C)(C)C1 ZINC001403834922 1364985341 /nfs/dbraw/zinc/98/53/41/1364985341.db2.gz NBPJAECPTBHCMZ-WMZOPIPTSA-N 1 3 331.504 2.914 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]Cc2cccc(CC)c2)C(C)(C)C1 ZINC001403835158 1364986698 /nfs/dbraw/zinc/98/66/98/1364986698.db2.gz XXIQLLOFYZBDTJ-LJQANCHMSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)N(CC[N@H+](C)CC1CC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001403932326 1365060862 /nfs/dbraw/zinc/06/08/62/1365060862.db2.gz IGEFFUFSQLDSQE-LJQANCHMSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CC1CC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001403932326 1365060866 /nfs/dbraw/zinc/06/08/66/1365060866.db2.gz IGEFFUFSQLDSQE-LJQANCHMSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)CCC[NH+]1CCC([C@H](C)NC(=O)CN(C)C(C)C)CC1 ZINC001404002346 1365155719 /nfs/dbraw/zinc/15/57/19/1365155719.db2.gz GRMDKCWNFNFEOA-KRWDZBQOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@@H+]1CC1CC2(CCC2)C1)N(C)C ZINC001404007851 1365162495 /nfs/dbraw/zinc/16/24/95/1365162495.db2.gz ALFWHHOGXYHDQC-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@H+]1CC1CC2(CCC2)C1)N(C)C ZINC001404007851 1365162497 /nfs/dbraw/zinc/16/24/97/1365162497.db2.gz ALFWHHOGXYHDQC-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCCN1Cc1ccccc1)[NH+]1CCCC1 ZINC001404009001 1365163379 /nfs/dbraw/zinc/16/33/79/1365163379.db2.gz WSLRTHJBAIVAIQ-SFHVURJKSA-N 1 3 329.488 2.642 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CC[N@H+](CCC2CCCCC2)C1)N(C)C ZINC001404094022 1365254765 /nfs/dbraw/zinc/25/47/65/1365254765.db2.gz SIGPAQRLGVIREY-OALUTQOASA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CC[N@@H+](CCC2CCCCC2)C1)N(C)C ZINC001404094022 1365254771 /nfs/dbraw/zinc/25/47/71/1365254771.db2.gz SIGPAQRLGVIREY-OALUTQOASA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@H+](CC2CCC3(CC3)CC2)C2CC2)C1 ZINC001404267704 1365414749 /nfs/dbraw/zinc/41/47/49/1365414749.db2.gz HFUWZLYTPDJPPN-QGZVFWFLSA-N 1 3 347.547 2.879 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[N@@H+](CC2CCC3(CC3)CC2)C2CC2)C1 ZINC001404267704 1365414753 /nfs/dbraw/zinc/41/47/53/1365414753.db2.gz HFUWZLYTPDJPPN-QGZVFWFLSA-N 1 3 347.547 2.879 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[NH2+][C@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001404318601 1365447417 /nfs/dbraw/zinc/44/74/17/1365447417.db2.gz MRTIVSYWKPSPIT-DLBZAZTESA-N 1 3 337.895 2.716 10 0 EFAEHO C[C@@H]([NH2+]CC=C(Cl)Cl)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001404342280 1365462410 /nfs/dbraw/zinc/46/24/10/1365462410.db2.gz LHRVFMROBVCUCW-OCCSQVGLSA-N 1 3 348.318 2.616 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]CC(C)C)c1ccccc1 ZINC001404386202 1365490617 /nfs/dbraw/zinc/49/06/17/1365490617.db2.gz PJLBVHUVFIKJEV-OALUTQOASA-N 1 3 331.504 2.964 10 0 EFAEHO CCCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@@H+](C(C)C)C1 ZINC001404435399 1365538800 /nfs/dbraw/zinc/53/88/00/1365538800.db2.gz YJELIWUXIMQNDA-LPHOPBHVSA-N 1 3 341.515 2.920 10 0 EFAEHO CCCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@H+](C(C)C)C1 ZINC001404435399 1365538804 /nfs/dbraw/zinc/53/88/04/1365538804.db2.gz YJELIWUXIMQNDA-LPHOPBHVSA-N 1 3 341.515 2.920 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](CCCC(C)(C)C)C1)N(C)C ZINC001404538438 1365636699 /nfs/dbraw/zinc/63/66/99/1365636699.db2.gz UILPGTCYAJOCGZ-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](CCCC(C)(C)C)C1)N(C)C ZINC001404538438 1365636704 /nfs/dbraw/zinc/63/67/04/1365636704.db2.gz UILPGTCYAJOCGZ-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H](C[N@H+](C)CCC(C)(C)C)C2)CC1 ZINC001404609698 1365710983 /nfs/dbraw/zinc/71/09/83/1365710983.db2.gz JBQZCRPNOVNMQI-GOSISDBHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@H](C[N@@H+](C)CCC(C)(C)C)C2)CC1 ZINC001404609698 1365710986 /nfs/dbraw/zinc/71/09/86/1365710986.db2.gz JBQZCRPNOVNMQI-GOSISDBHSA-N 1 3 337.552 2.935 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCC[N@H+](C)CC2CC3(CCC3)C2)c1 ZINC001437566943 1387776254 /nfs/dbraw/zinc/77/62/54/1387776254.db2.gz VMPSFJSXURPRMM-UHFFFAOYSA-N 1 3 343.515 2.990 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NCC[N@@H+](C)CC2CC3(CCC3)C2)c1 ZINC001437566943 1387776257 /nfs/dbraw/zinc/77/62/57/1387776257.db2.gz VMPSFJSXURPRMM-UHFFFAOYSA-N 1 3 343.515 2.990 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001405304403 1366140903 /nfs/dbraw/zinc/14/09/03/1366140903.db2.gz MTVNGGZLXWKLOC-OXJNMPFZSA-N 1 3 343.515 2.502 10 0 EFAEHO CC[C@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)NCc1cccc(C(C)C)n1 ZINC001405332497 1366149396 /nfs/dbraw/zinc/14/93/96/1366149396.db2.gz IADJSUYBUNNWMJ-DLBZAZTESA-N 1 3 346.519 2.531 10 0 EFAEHO CC[C@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)NCc1cccc(C(C)C)n1 ZINC001405332497 1366149398 /nfs/dbraw/zinc/14/93/98/1366149398.db2.gz IADJSUYBUNNWMJ-DLBZAZTESA-N 1 3 346.519 2.531 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H](C(C)C)[NH+](C)C)NCc1ccc(F)cc1F ZINC001405343395 1366154230 /nfs/dbraw/zinc/15/42/30/1366154230.db2.gz FDEQNYSRLTYKLV-DOTOQJQBSA-N 1 3 341.446 2.535 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C1CCC1)[NH2+]Cc1cc(C)ccc1F ZINC001405358157 1366162338 /nfs/dbraw/zinc/16/23/38/1366162338.db2.gz FZDCKBYIBOSZBH-MRXNPFEDSA-N 1 3 335.467 2.603 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCCC1CCN(C/C=C\Cl)CC1 ZINC001405557435 1366293630 /nfs/dbraw/zinc/29/36/30/1366293630.db2.gz HXKIFOWQYXUTIY-TYIWRNDTSA-N 1 3 341.927 2.832 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCCC1CCN(C/C=C\Cl)CC1 ZINC001405557435 1366293635 /nfs/dbraw/zinc/29/36/35/1366293635.db2.gz HXKIFOWQYXUTIY-TYIWRNDTSA-N 1 3 341.927 2.832 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@H](C)c1cccc(OC)c1 ZINC001405591632 1366309313 /nfs/dbraw/zinc/30/93/13/1366309313.db2.gz HKYAMXKSRLUEEC-SJLPKXTDSA-N 1 3 347.503 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+][C@@H]1CCCc2ccccc21 ZINC001405724886 1366366128 /nfs/dbraw/zinc/36/61/28/1366366128.db2.gz XTAKSFHRQPAOAC-VQIMIIECSA-N 1 3 331.504 2.746 10 0 EFAEHO CC(C)Oc1ccccc1C[NH2+]C[C@H](C)N(C)C(=O)[C@@H]1CCCN1C ZINC001405787997 1366415585 /nfs/dbraw/zinc/41/55/85/1366415585.db2.gz AATARCBZGBRPBL-WMZOPIPTSA-N 1 3 347.503 2.505 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc2ccccc2c1)N(C)C(=O)[C@@H]1CCCN1C ZINC001405802075 1366425644 /nfs/dbraw/zinc/42/56/44/1366425644.db2.gz XXZMJXUOGPIFBS-JXFKEZNVSA-N 1 3 339.483 2.871 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)N(C)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001405821164 1366439577 /nfs/dbraw/zinc/43/95/77/1366439577.db2.gz YIVNIUKDASVBFE-IIAWOOMASA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)N(C)C(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001405821164 1366439579 /nfs/dbraw/zinc/43/95/79/1366439579.db2.gz YIVNIUKDASVBFE-IIAWOOMASA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@H](CNCc1ccc(Cl)cc1Cl)N(C)C(=O)CC[NH+](C)C ZINC001405858421 1366468645 /nfs/dbraw/zinc/46/86/45/1366468645.db2.gz XCBDUFJSIMVKCO-GFCCVEGCSA-N 1 3 346.302 2.882 10 0 EFAEHO C[C@H](C[NH2+]CC1CCC(C)(C)CC1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001405873098 1366481559 /nfs/dbraw/zinc/48/15/59/1366481559.db2.gz SRNUSMHASAZGOM-IAGOWNOFSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[N@H+](CCNC(=O)CN1CC[C@H](C)C1)CC[C@H]1CCCC1(F)F ZINC001437624804 1387849139 /nfs/dbraw/zinc/84/91/39/1387849139.db2.gz CELHDDJXHRBBLO-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN1CC[C@H](C)C1)CC[C@H]1CCCC1(F)F ZINC001437624804 1387849144 /nfs/dbraw/zinc/84/91/44/1387849144.db2.gz CELHDDJXHRBBLO-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[N@H+](CCNC(=O)CN1CC[C@@H](C)C1)Cc1ccc(C2CC2)cc1 ZINC001437625577 1387851353 /nfs/dbraw/zinc/85/13/53/1387851353.db2.gz JYJOPOFEGBVLOG-QGZVFWFLSA-N 1 3 343.515 2.844 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN1CC[C@@H](C)C1)Cc1ccc(C2CC2)cc1 ZINC001437625577 1387851361 /nfs/dbraw/zinc/85/13/61/1387851361.db2.gz JYJOPOFEGBVLOG-QGZVFWFLSA-N 1 3 343.515 2.844 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1cc(C)ccc1F)C(C)C)N(C)C ZINC001406031777 1367117566 /nfs/dbraw/zinc/11/75/66/1367117566.db2.gz GUNWLTRSFPLDDB-ZWKOTPCHSA-N 1 3 337.483 2.705 10 0 EFAEHO CN(CC[N@H+](C)[C@H]1CCCc2ccc(F)cc21)C(=O)CN1CCCC1 ZINC001406163559 1367348007 /nfs/dbraw/zinc/34/80/07/1367348007.db2.gz JSLMOTDQTOPAOK-IBGZPJMESA-N 1 3 347.478 2.689 10 0 EFAEHO CN(CC[N@@H+](C)[C@H]1CCCc2ccc(F)cc21)C(=O)CN1CCCC1 ZINC001406163559 1367348009 /nfs/dbraw/zinc/34/80/09/1367348009.db2.gz JSLMOTDQTOPAOK-IBGZPJMESA-N 1 3 347.478 2.689 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CCC[C@@H]2NC(=O)CN(C)C(C)C)cc1 ZINC001406194412 1367392648 /nfs/dbraw/zinc/39/26/48/1367392648.db2.gz LPRBGXYNLXYNCJ-OALUTQOASA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2CCC2CCCC2)C1 ZINC001406203036 1367399626 /nfs/dbraw/zinc/39/96/26/1367399626.db2.gz YYBJEKRDIOXZSJ-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2CCC2CCCC2)C1 ZINC001406203036 1367399634 /nfs/dbraw/zinc/39/96/34/1367399634.db2.gz YYBJEKRDIOXZSJ-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+][C@H]1CCc2c1cccc2F ZINC001406307705 1367461723 /nfs/dbraw/zinc/46/17/23/1367461723.db2.gz KNNLFGXWFFGOSM-KDOFPFPSSA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1ccccc1Cl ZINC001406349873 1367513830 /nfs/dbraw/zinc/51/38/30/1367513830.db2.gz DBZHEQWSMKKDCW-PBHICJAKSA-N 1 3 337.895 2.807 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1ccccc1Cl ZINC001406349873 1367513840 /nfs/dbraw/zinc/51/38/40/1367513840.db2.gz DBZHEQWSMKKDCW-PBHICJAKSA-N 1 3 337.895 2.807 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1C[NH+]2CCC1CC2)Cc1cccc(Cl)c1 ZINC001492951747 1367570852 /nfs/dbraw/zinc/57/08/52/1367570852.db2.gz FTZVJYOGRAFNOJ-GOSISDBHSA-N 1 3 349.906 2.620 10 0 EFAEHO C[C@@H](C[NH2+][C@H]1CCc2ccc(Cl)cc21)NC(=O)C1(N(C)C)CCC1 ZINC001406482040 1367634393 /nfs/dbraw/zinc/63/43/93/1367634393.db2.gz PLLQMKLKYZHYLH-GUYCJALGSA-N 1 3 349.906 2.906 10 0 EFAEHO C[C@@H](C[NH2+][C@@H]1CCc2ccc(Cl)cc21)NC(=O)C1(N(C)C)CCC1 ZINC001406482042 1367634574 /nfs/dbraw/zinc/63/45/74/1367634574.db2.gz PLLQMKLKYZHYLH-SUMWQHHRSA-N 1 3 349.906 2.906 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CC1CCC2(CC2)CC1 ZINC001406553333 1367718323 /nfs/dbraw/zinc/71/83/23/1367718323.db2.gz BEQJAYJHZMVMTR-FUHWJXTLSA-N 1 3 335.536 2.926 10 0 EFAEHO CCN(CCNC(=O)[C@H]1C[NH+]2CCC1CC2)[C@@H](C)c1ccc(F)cc1 ZINC001492954032 1367863119 /nfs/dbraw/zinc/86/31/19/1367863119.db2.gz OSIXHUIBPWMLRO-KXBFYZLASA-N 1 3 347.478 2.667 10 0 EFAEHO C[C@@H](C[N@H+](C)C[C@H]1CCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001406667679 1367892960 /nfs/dbraw/zinc/89/29/60/1367892960.db2.gz LCRJYGFKOSTYLK-GJZGRUSLSA-N 1 3 347.494 2.836 10 0 EFAEHO C[C@@H](C[N@@H+](C)C[C@H]1CCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001406667679 1367892968 /nfs/dbraw/zinc/89/29/68/1367892968.db2.gz LCRJYGFKOSTYLK-GJZGRUSLSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)c1ccc(CN(C)C[C@H](C)NC(=O)[C@H]2CC[N@H+](C)C2)cc1 ZINC001406690647 1367928892 /nfs/dbraw/zinc/92/88/92/1367928892.db2.gz AATKPQQMMPDEJV-LPHOPBHVSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)c1ccc(CN(C)C[C@H](C)NC(=O)[C@H]2CC[N@@H+](C)C2)cc1 ZINC001406690647 1367928893 /nfs/dbraw/zinc/92/88/93/1367928893.db2.gz AATKPQQMMPDEJV-LPHOPBHVSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)c1ccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CC[N@H+](C)C2)cc1 ZINC001406690587 1367929257 /nfs/dbraw/zinc/92/92/57/1367929257.db2.gz AATKPQQMMPDEJV-APWZRJJASA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)c1ccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CC[N@@H+](C)C2)cc1 ZINC001406690587 1367929263 /nfs/dbraw/zinc/92/92/63/1367929263.db2.gz AATKPQQMMPDEJV-APWZRJJASA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)[C@H]1CCc2c1cccc2F ZINC001406726643 1367973653 /nfs/dbraw/zinc/97/36/53/1367973653.db2.gz RBSPMJIRQNRCRM-KDOFPFPSSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)[C@H]1CCc2c1cccc2F ZINC001406726643 1367973657 /nfs/dbraw/zinc/97/36/57/1367973657.db2.gz RBSPMJIRQNRCRM-KDOFPFPSSA-N 1 3 335.467 2.590 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1ccc(Cl)cc1)C1CC1)N(C)C ZINC001406774996 1368033465 /nfs/dbraw/zinc/03/34/65/1368033465.db2.gz BNTNISOMQNTSDI-DLBZAZTESA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@H](C(=O)N[C@H](C[NH2+]Cc1ccsc1)C1CC1)N1CCCCCC1 ZINC001406793698 1368060899 /nfs/dbraw/zinc/06/08/99/1368060899.db2.gz UGAMAKRTJJQNBP-CRAIPNDOSA-N 1 3 349.544 2.997 10 0 EFAEHO CCC(CC)C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)C[C@@H]1CC ZINC001406803804 1368075378 /nfs/dbraw/zinc/07/53/78/1368075378.db2.gz HOAPYLRIGOZUNL-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](C(=O)NCC1(NCc2ccsc2)CC1)[NH+]1CCCCCC1 ZINC001406982820 1368277660 /nfs/dbraw/zinc/27/76/60/1368277660.db2.gz WQWJUTDEGSMPEJ-HNNXBMFYSA-N 1 3 335.517 2.751 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@@H](C(=O)NCC2(NCc3ccccc3)CC2)C1 ZINC001406992833 1368290457 /nfs/dbraw/zinc/29/04/57/1368290457.db2.gz YANJHLJZMIAQHL-MSOLQXFVSA-N 1 3 329.488 2.545 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]Cc2ccc(Cl)cc2)CC1 ZINC001406999891 1368302446 /nfs/dbraw/zinc/30/24/46/1368302446.db2.gz BNTLVNUHKGLOGF-HUUCEWRRSA-N 1 3 349.906 2.951 10 0 EFAEHO CCCc1ccc(CN2CCC[C@@H]2CNC(=O)CC[NH+](C)C)cc1 ZINC001437681120 1387934034 /nfs/dbraw/zinc/93/40/34/1387934034.db2.gz OQELCLVKFVYDCI-LJQANCHMSA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+]Cc1ccc(CF)cc1 ZINC001407115382 1368442546 /nfs/dbraw/zinc/44/25/46/1368442546.db2.gz ZRWCIGNRNOFPOK-SFHVURJKSA-N 1 3 335.467 2.577 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC2(C)CC[NH+](CC3CC4(CCC4)C3)CC2)C1 ZINC001407129280 1368462213 /nfs/dbraw/zinc/46/22/13/1368462213.db2.gz LOXSUPIDBNYDCH-KRWDZBQOSA-N 1 3 347.547 2.879 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C[NH2+]CC1CCC1)C1CCCC1 ZINC001407149595 1368498298 /nfs/dbraw/zinc/49/82/98/1368498298.db2.gz QXYOCZGYOKSAHL-RTBURBONSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@@H]1CCCN1[C@H](C)c1cccc(OC)c1 ZINC001437688117 1387943124 /nfs/dbraw/zinc/94/31/24/1387943124.db2.gz RJBKMGKAQSDAOW-AEFFLSMTSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@@H]1CCCN1[C@H](C)c1cccc(OC)c1 ZINC001437688117 1387943127 /nfs/dbraw/zinc/94/31/27/1387943127.db2.gz RJBKMGKAQSDAOW-AEFFLSMTSA-N 1 3 347.503 2.679 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1 ZINC001407170173 1368535760 /nfs/dbraw/zinc/53/57/60/1368535760.db2.gz CBLURTJZSAYPKV-ICSRJNTNSA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1 ZINC001407170173 1368535769 /nfs/dbraw/zinc/53/57/69/1368535769.db2.gz CBLURTJZSAYPKV-ICSRJNTNSA-N 1 3 329.488 2.642 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@H]1CCCN1[C@H](C)c1cccc(OC)c1 ZINC001437688124 1387943921 /nfs/dbraw/zinc/94/39/21/1387943921.db2.gz RJBKMGKAQSDAOW-SJLPKXTDSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@H]1CCCN1[C@H](C)c1cccc(OC)c1 ZINC001437688124 1387943924 /nfs/dbraw/zinc/94/39/24/1387943924.db2.gz RJBKMGKAQSDAOW-SJLPKXTDSA-N 1 3 347.503 2.679 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)[NH+]1CCCC1 ZINC001437704360 1387952121 /nfs/dbraw/zinc/95/21/21/1387952121.db2.gz XCQVFDBUPHWYKQ-VQTJNVASSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)(C(=O)NCC1(C)CC[NH+](CC2CCC2)CC1)N1CCCC1 ZINC001407270783 1368682270 /nfs/dbraw/zinc/68/22/70/1368682270.db2.gz CNCGDNBCJOJBQT-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1cc(F)ccc1CN1CCC[C@](C)(CNC(=O)CC[NH+](C)C)C1 ZINC001407285370 1368705704 /nfs/dbraw/zinc/70/57/04/1368705704.db2.gz BQHNAAAANJCTFG-HXUWFJFHSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1C[N@H+](CCC(C)(C)C)CCC1(F)F)N(C)C ZINC001407337865 1368790458 /nfs/dbraw/zinc/79/04/58/1368790458.db2.gz ZVRFSIWYAHQEEP-HUUCEWRRSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1C[N@@H+](CCC(C)(C)C)CCC1(F)F)N(C)C ZINC001407337865 1368790461 /nfs/dbraw/zinc/79/04/61/1368790461.db2.gz ZVRFSIWYAHQEEP-HUUCEWRRSA-N 1 3 347.494 2.836 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCN(Cc2cccc(F)c2)C1 ZINC001437721535 1387968700 /nfs/dbraw/zinc/96/87/00/1387968700.db2.gz YTBHSKNGUJGRJV-IEBWSBKVSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCN(Cc2cccc(F)c2)C1 ZINC001437721535 1387968706 /nfs/dbraw/zinc/96/87/06/1387968706.db2.gz YTBHSKNGUJGRJV-IEBWSBKVSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@H]1CC[C@H](CNC(=O)Cc2nc[nH]c2C)CC1 ZINC001407562906 1368991032 /nfs/dbraw/zinc/99/10/32/1368991032.db2.gz OAYROYVNVSZJFE-XIRDDKMYSA-N 1 3 334.508 2.819 10 0 EFAEHO CC[C@@H](C(=O)NCc1cccc2c1CC[N@H+](CC(C)C)C2)N(C)C ZINC001407747451 1369186841 /nfs/dbraw/zinc/18/68/41/1369186841.db2.gz PCQHAUYXMMIMJF-IBGZPJMESA-N 1 3 331.504 2.657 10 0 EFAEHO CC[C@@H](C(=O)NCc1cccc2c1CC[N@@H+](CC(C)C)C2)N(C)C ZINC001407747451 1369186845 /nfs/dbraw/zinc/18/68/45/1369186845.db2.gz PCQHAUYXMMIMJF-IBGZPJMESA-N 1 3 331.504 2.657 10 0 EFAEHO Cc1ccc(F)c(CN2CCC[C@@H](NC(=O)CCC[NH+](C)C)CC2)c1 ZINC001407854753 1369312965 /nfs/dbraw/zinc/31/29/65/1369312965.db2.gz SEZSTDGLMAPKCE-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)CC1 ZINC001407899420 1369366596 /nfs/dbraw/zinc/36/65/96/1369366596.db2.gz ZOQGKCXQPHSLMU-UYAOXDASSA-N 1 3 343.515 2.986 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)CC1 ZINC001407899420 1369366601 /nfs/dbraw/zinc/36/66/01/1369366601.db2.gz ZOQGKCXQPHSLMU-UYAOXDASSA-N 1 3 343.515 2.986 10 0 EFAEHO CCC1(NC/C(Cl)=C\Cl)CCN(C(=O)CC[NH+](C)C)CC1 ZINC001408005094 1369510873 /nfs/dbraw/zinc/51/08/73/1369510873.db2.gz HUHWYIOIYHOBJA-ACCUITESSA-N 1 3 336.307 2.618 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001408004443 1369517923 /nfs/dbraw/zinc/51/79/23/1369517923.db2.gz DSRAVYIYLJHAKM-OAQYLSRUSA-N 1 3 343.515 2.843 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001408004443 1369517930 /nfs/dbraw/zinc/51/79/30/1369517930.db2.gz DSRAVYIYLJHAKM-OAQYLSRUSA-N 1 3 343.515 2.843 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@H]1Cc2ccccc2CN1CC[C@H](C)F ZINC001408006531 1369521296 /nfs/dbraw/zinc/52/12/96/1369521296.db2.gz LHMCIXFLOFAAEU-QFBILLFUSA-N 1 3 349.494 2.619 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@H]1Cc2ccccc2CN1CC[C@H](C)F ZINC001408006531 1369521299 /nfs/dbraw/zinc/52/12/99/1369521299.db2.gz LHMCIXFLOFAAEU-QFBILLFUSA-N 1 3 349.494 2.619 10 0 EFAEHO CCC1([NH2+]Cc2ccc(F)cc2)CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001408012743 1369527616 /nfs/dbraw/zinc/52/76/16/1369527616.db2.gz XFAOXLUYKZPDAJ-GOSISDBHSA-N 1 3 347.478 2.781 10 0 EFAEHO CCCCN1Cc2ccc(CNC(=O)C[C@H]3CC[N@H+](C)C3)cc2C1 ZINC001408061730 1369575069 /nfs/dbraw/zinc/57/50/69/1369575069.db2.gz XWCRODWQTCLSMG-QGZVFWFLSA-N 1 3 329.488 2.760 10 0 EFAEHO CCCCN1Cc2ccc(CNC(=O)C[C@H]3CC[N@@H+](C)C3)cc2C1 ZINC001408061730 1369575072 /nfs/dbraw/zinc/57/50/72/1369575072.db2.gz XWCRODWQTCLSMG-QGZVFWFLSA-N 1 3 329.488 2.760 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C)([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001408086291 1369591794 /nfs/dbraw/zinc/59/17/94/1369591794.db2.gz IRSJGVJWSOIHLQ-FGTMMUONSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C)([NH2+]C[C@H](C)CC(C)C)CC1)N(C)C ZINC001408091418 1369598608 /nfs/dbraw/zinc/59/86/08/1369598608.db2.gz FAUDRJHAKQXMTN-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]CCc2ccc(C)cc2)CC1 ZINC001408097191 1369603559 /nfs/dbraw/zinc/60/35/59/1369603559.db2.gz MXSGWQLQTUONKL-UHFFFAOYSA-N 1 3 345.531 2.850 10 0 EFAEHO CCC[NH2+]C1(C)CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001408112731 1369618492 /nfs/dbraw/zinc/61/84/92/1369618492.db2.gz FJRLKOIJVKGUEK-SFHVURJKSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@H+](CCC(C)(C)C)CC1(C)C)N(C)C ZINC001408116192 1369619893 /nfs/dbraw/zinc/61/98/93/1369619893.db2.gz GPCUAKCKSJHAQO-JKSUJKDBSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@@H+](CCC(C)(C)C)CC1(C)C)N(C)C ZINC001408116192 1369619899 /nfs/dbraw/zinc/61/98/99/1369619899.db2.gz GPCUAKCKSJHAQO-JKSUJKDBSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1cc(F)ccc1Cl)N(C)C ZINC001408234257 1369735913 /nfs/dbraw/zinc/73/59/13/1369735913.db2.gz XZAOCTCYYQEQKC-BLLLJJGKSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@H]1c2ccccc2CCN1CC[C@H](C)F ZINC001408269638 1369766883 /nfs/dbraw/zinc/76/68/83/1369766883.db2.gz XANSGKPZKLVOOF-LPHOPBHVSA-N 1 3 349.494 2.792 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@H]1c2ccccc2CCN1CC[C@H](C)F ZINC001408269638 1369766886 /nfs/dbraw/zinc/76/68/86/1369766886.db2.gz XANSGKPZKLVOOF-LPHOPBHVSA-N 1 3 349.494 2.792 10 0 EFAEHO Cc1ncsc1CCCN1CCC(O)(C[NH+]2CCCCC2)CC1 ZINC001414070734 1370036002 /nfs/dbraw/zinc/03/60/02/1370036002.db2.gz WSWYVRRWVLDJEN-UHFFFAOYSA-N 1 3 337.533 2.697 10 0 EFAEHO c1cn(-c2csc(CNC3CC[NH+](C[C@@H]4CCOC4)CC3)c2)cn1 ZINC001414094132 1370042095 /nfs/dbraw/zinc/04/20/95/1370042095.db2.gz ZAXDILLRMIEMFK-HNNXBMFYSA-N 1 3 346.500 2.524 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NCC[N@H+](CCC2CC2)C2CC2)C1 ZINC001437808129 1388097490 /nfs/dbraw/zinc/09/74/90/1388097490.db2.gz OVONONKIOQABOS-LJQANCHMSA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NCC[N@@H+](CCC2CC2)C2CC2)C1 ZINC001437808129 1388097497 /nfs/dbraw/zinc/09/74/97/1388097497.db2.gz OVONONKIOQABOS-LJQANCHMSA-N 1 3 339.499 2.580 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001417625302 1373103729 /nfs/dbraw/zinc/10/37/29/1373103729.db2.gz MODNCYSLLXRZQX-RTBURBONSA-N 1 3 329.488 2.594 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001417625302 1373103731 /nfs/dbraw/zinc/10/37/31/1373103731.db2.gz MODNCYSLLXRZQX-RTBURBONSA-N 1 3 329.488 2.594 10 0 EFAEHO C[C@@H](NC(=O)c1ccc(NC2=NCCC2)cc1)C(C)(C)C[NH+](C)C ZINC001417647690 1373121322 /nfs/dbraw/zinc/12/13/22/1373121322.db2.gz ULEROJWAJYEXAV-CQSZACIVSA-N 1 3 330.476 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001417777660 1373243287 /nfs/dbraw/zinc/24/32/87/1373243287.db2.gz JUVNXZNUJVOWND-MSEWRSJXSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CCc2cccs2)C1 ZINC001417777859 1373243679 /nfs/dbraw/zinc/24/36/79/1373243679.db2.gz MXNRRZSEUWNADB-LUKYLMHMSA-N 1 3 349.544 2.648 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN3[C@H](C)CC[C@@H]3C)C2)cs1 ZINC001417778942 1373245569 /nfs/dbraw/zinc/24/55/69/1373245569.db2.gz XSTGOUXVAWGDBZ-MQSRZLSVSA-N 1 3 349.544 2.914 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccccc2F)C1)N(C)C ZINC001417808137 1373278058 /nfs/dbraw/zinc/27/80/58/1373278058.db2.gz DPNMCANPPLRNHK-WDYCEAGBSA-N 1 3 349.494 2.786 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CCC(C)C ZINC001417819696 1373291692 /nfs/dbraw/zinc/29/16/92/1373291692.db2.gz ATVHZTHSPSYLKW-OKYOBFRVSA-N 1 3 335.536 2.543 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CCC(C)C ZINC001417819696 1373291696 /nfs/dbraw/zinc/29/16/96/1373291696.db2.gz ATVHZTHSPSYLKW-OKYOBFRVSA-N 1 3 335.536 2.543 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2C[C@@H]3C[N@@H+](CCCC(C)(C)C)CC[C@@H]3C2)C1 ZINC001417831928 1373310630 /nfs/dbraw/zinc/31/06/30/1373310630.db2.gz MEKPUPPHVLYPMV-OTWHNJEPSA-N 1 3 349.563 2.935 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2C[C@@H]3C[N@H+](CCCC(C)(C)C)CC[C@@H]3C2)C1 ZINC001417831928 1373310634 /nfs/dbraw/zinc/31/06/34/1373310634.db2.gz MEKPUPPHVLYPMV-OTWHNJEPSA-N 1 3 349.563 2.935 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CCC[NH+](C)C)CCN1Cc1ccc(C2CC2)cc1 ZINC001417850847 1373335852 /nfs/dbraw/zinc/33/58/52/1373335852.db2.gz WYHVECYAASAEKM-UZLBHIALSA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@H+](CCC(C)C)CC(C)(C)C1)N(C)C ZINC001417862615 1373353801 /nfs/dbraw/zinc/35/38/01/1373353801.db2.gz JJIPZVMBUIDISU-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CC[N@@H+](CCC(C)C)CC(C)(C)C1)N(C)C ZINC001417862615 1373353805 /nfs/dbraw/zinc/35/38/05/1373353805.db2.gz JJIPZVMBUIDISU-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1ccccc1)C1CC1 ZINC001417981579 1373482383 /nfs/dbraw/zinc/48/23/83/1373482383.db2.gz YOGKYWWDGZXAHX-MOPGFXCFSA-N 1 3 329.488 2.544 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]([NH2+]Cc1ccccc1)C1CC1)N1CCCC1 ZINC001417991146 1373495573 /nfs/dbraw/zinc/49/55/73/1373495573.db2.gz JWKFBFPNBBGARM-GOSISDBHSA-N 1 3 329.488 2.545 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]([NH2+]C/C=C\c2ccccc2)C2CC2)C1 ZINC001417997735 1373503291 /nfs/dbraw/zinc/50/32/91/1373503291.db2.gz SQNCGOXUHYSCPU-REAYAIGQSA-N 1 3 341.499 2.526 10 0 EFAEHO CC[C@@H](F)CN(C)C[C@H]1CCCN(C(=O)CCC[NH+]2CCCC2)C1 ZINC001418018270 1373529023 /nfs/dbraw/zinc/52/90/23/1373529023.db2.gz CSYIJYHEAIHOTK-QZTJIDSGSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCC[C@@H](CN(C)C/C=C/Cl)C2)CC[N@@H+]1C ZINC001418021627 1373534204 /nfs/dbraw/zinc/53/42/04/1373534204.db2.gz QDRVZLZBWMCWBP-UCMYZZLCSA-N 1 3 341.927 2.640 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCC[C@@H](CN(C)C/C=C/Cl)C2)CC[N@H+]1C ZINC001418021627 1373534208 /nfs/dbraw/zinc/53/42/08/1373534208.db2.gz QDRVZLZBWMCWBP-UCMYZZLCSA-N 1 3 341.927 2.640 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCC[C@H](CN(C)C/C=C\Cl)C2)CC[N@@H+]1C ZINC001418021624 1373534614 /nfs/dbraw/zinc/53/46/14/1373534614.db2.gz QDRVZLZBWMCWBP-LDNOHTSOSA-N 1 3 341.927 2.640 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCC[C@H](CN(C)C/C=C\Cl)C2)CC[N@H+]1C ZINC001418021624 1373534618 /nfs/dbraw/zinc/53/46/18/1373534618.db2.gz QDRVZLZBWMCWBP-LDNOHTSOSA-N 1 3 341.927 2.640 10 0 EFAEHO CCC(CC)C[NH2+][C@H]1C[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001418066537 1373571202 /nfs/dbraw/zinc/57/12/02/1373571202.db2.gz ZYAQJEYIGVYEQP-GPMSIDNRSA-N 1 3 341.515 2.872 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@@H](C)c2ccc(F)c(F)c2)C1 ZINC001418078165 1373583153 /nfs/dbraw/zinc/58/31/53/1373583153.db2.gz RVJCZNGVQZDZSW-QEJZJMRPSA-N 1 3 339.430 2.603 10 0 EFAEHO CN(CC(=O)N1CCC[C@H]2C[N@H+](CC3CC3)CC[C@@H]21)CC(C)(C)C ZINC001418080525 1373585872 /nfs/dbraw/zinc/58/58/72/1373585872.db2.gz CPUFIIRPWMBUEF-ROUUACIJSA-N 1 3 335.536 2.687 10 0 EFAEHO CN(CC(=O)N1CCC[C@H]2C[N@@H+](CC3CC3)CC[C@@H]21)CC(C)(C)C ZINC001418080525 1373585874 /nfs/dbraw/zinc/58/58/74/1373585874.db2.gz CPUFIIRPWMBUEF-ROUUACIJSA-N 1 3 335.536 2.687 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc(C(F)F)c2)C1)N(C)C ZINC001418105641 1373608728 /nfs/dbraw/zinc/60/87/28/1373608728.db2.gz ZWVKJMVAMNIKBN-XHSDSOJGSA-N 1 3 339.430 2.701 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2ccc(Cl)cc2F)C1 ZINC001418106779 1373609943 /nfs/dbraw/zinc/60/99/43/1373609943.db2.gz NGPAFPZRTPCHNO-GASCZTMLSA-N 1 3 341.858 2.558 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2ccc(Cl)cc2F)C1 ZINC001418106779 1373609949 /nfs/dbraw/zinc/60/99/49/1373609949.db2.gz NGPAFPZRTPCHNO-GASCZTMLSA-N 1 3 341.858 2.558 10 0 EFAEHO CC[C@H](F)CN1CCC[C@@H](CNC(=O)C(C)(C)[NH+]2CCCCC2)C1 ZINC001418117561 1373623494 /nfs/dbraw/zinc/62/34/94/1373623494.db2.gz BMNRDLJEUWBBJG-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)C3CCC3)C2)c(C)c1 ZINC001418136110 1373660400 /nfs/dbraw/zinc/66/04/00/1373660400.db2.gz ZNRZDSZDHAVHMI-HDICACEKSA-N 1 3 343.515 2.833 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001418146500 1373673751 /nfs/dbraw/zinc/67/37/51/1373673751.db2.gz MAJSZGPCTQOCPE-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@H+](CCCC(C)(C)C)C1 ZINC001437963076 1388276782 /nfs/dbraw/zinc/27/67/82/1388276782.db2.gz WSBOPWXGLXQEED-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@@H+](CCCC(C)(C)C)C1 ZINC001437963076 1388276786 /nfs/dbraw/zinc/27/67/86/1388276786.db2.gz WSBOPWXGLXQEED-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC1CCC([NH2+]C/C=C/Cl)CC1 ZINC001418188074 1373751710 /nfs/dbraw/zinc/75/17/10/1373751710.db2.gz UNWJZNMIVGEANK-VUQPMBRBSA-N 1 3 327.900 2.630 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)NCc1cccc(C(C)C)n1 ZINC001418228157 1373783559 /nfs/dbraw/zinc/78/35/59/1373783559.db2.gz FLYYZDUOIUDEJA-VQIMIIECSA-N 1 3 346.519 2.674 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)NCc1cccc(C(C)C)n1 ZINC001418228157 1373783562 /nfs/dbraw/zinc/78/35/62/1373783562.db2.gz FLYYZDUOIUDEJA-VQIMIIECSA-N 1 3 346.519 2.674 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC[C@H](C)NCc2cc(C)ccc2F)C1 ZINC001418275742 1373847403 /nfs/dbraw/zinc/84/74/03/1373847403.db2.gz YOUMJTSNMTYPKB-DLBZAZTESA-N 1 3 349.494 2.850 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC[C@H](C)NCc2cc(C)ccc2F)C1 ZINC001418275742 1373847410 /nfs/dbraw/zinc/84/74/10/1373847410.db2.gz YOUMJTSNMTYPKB-DLBZAZTESA-N 1 3 349.494 2.850 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]CC[C@H]1CCCC1(F)F ZINC001418277626 1373850309 /nfs/dbraw/zinc/85/03/09/1373850309.db2.gz YAAHQLMZLVHDMB-HUUCEWRRSA-N 1 3 347.494 2.884 10 0 EFAEHO C[C@H](CCNC(=O)CN(C)C1CCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001418402874 1373983959 /nfs/dbraw/zinc/98/39/59/1373983959.db2.gz PCMGPWVDJJFNPG-BEFAXECRSA-N 1 3 329.488 2.643 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CCC2(CC2)CC1 ZINC001418419317 1374002428 /nfs/dbraw/zinc/00/24/28/1374002428.db2.gz ZVEGAQUBFHBGTL-IAGOWNOFSA-N 1 3 335.536 2.783 10 0 EFAEHO CC(C)[C@H]1CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)CC1 ZINC001418427695 1374012501 /nfs/dbraw/zinc/01/25/01/1374012501.db2.gz VKQKKBGDBJAPKL-BZSNNMDCSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)[C@H]1CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)CC1 ZINC001418427695 1374012513 /nfs/dbraw/zinc/01/25/13/1374012513.db2.gz VKQKKBGDBJAPKL-BZSNNMDCSA-N 1 3 325.541 2.837 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)cc1 ZINC001418476611 1374069040 /nfs/dbraw/zinc/06/90/40/1374069040.db2.gz QCTWESNLDXXMFO-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)cc1 ZINC001418476611 1374069041 /nfs/dbraw/zinc/06/90/41/1374069041.db2.gz QCTWESNLDXXMFO-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO CCN(CCNC(=O)C12CCC[NH+](CCC1)C2)Cc1cccc(C)c1 ZINC001418550610 1374164082 /nfs/dbraw/zinc/16/40/82/1374164082.db2.gz AXDQWOGGJUFUSF-UHFFFAOYSA-N 1 3 343.515 2.809 10 0 EFAEHO CN(C[C@@H]1CCN1[C@@H]1CCc2ccccc21)C(=O)C1(C[NH+](C)C)CC1 ZINC001418586704 1374229584 /nfs/dbraw/zinc/22/95/84/1374229584.db2.gz FZPZPMBZWNNLDE-PKOBYXMFSA-N 1 3 341.499 2.548 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[NH+]1CCCC1 ZINC001418648309 1374318716 /nfs/dbraw/zinc/31/87/16/1374318716.db2.gz MDLSKTPHIXZKCP-BETUJISGSA-N 1 3 348.318 2.664 10 0 EFAEHO CCc1ccccc1CC[N@H+]1CC[C@@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001418666538 1374343031 /nfs/dbraw/zinc/34/30/31/1374343031.db2.gz CHUKKNCAVVOMAR-FXAWDEMLSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[N@@H+]1CC[C@@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001418666538 1374343035 /nfs/dbraw/zinc/34/30/35/1374343035.db2.gz CHUKKNCAVVOMAR-FXAWDEMLSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccc(C[N@@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001418700043 1374385551 /nfs/dbraw/zinc/38/55/51/1374385551.db2.gz QKDFGWLWQTZOGY-IBGZPJMESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(C[N@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001418700043 1374385553 /nfs/dbraw/zinc/38/55/53/1374385553.db2.gz QKDFGWLWQTZOGY-IBGZPJMESA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@H]([NH2+]CC2CCCCC2)C1)N1CCCC1 ZINC001418701461 1374386902 /nfs/dbraw/zinc/38/69/02/1374386902.db2.gz VNCSTQIGEVVXRT-IYARVYRRSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+]Cc2ccccc2Cl)C1 ZINC001418706326 1374392327 /nfs/dbraw/zinc/39/23/27/1374392327.db2.gz JGQUAJAKMWFZCS-KOMQPUFPSA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CCc2ccccc2)C1)N(C)C ZINC001418715482 1374406253 /nfs/dbraw/zinc/40/62/53/1374406253.db2.gz PGBWAVCLPWNGGE-ZCNNSNEGSA-N 1 3 345.531 2.690 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(C)cc2)C1 ZINC001418725644 1374421179 /nfs/dbraw/zinc/42/11/79/1374421179.db2.gz OMXBAEKBZRXWLF-ZWKOTPCHSA-N 1 3 340.471 2.644 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C)C[C@H]1C[NH2+]Cc1ccc(F)cc1 ZINC001418742475 1374445749 /nfs/dbraw/zinc/44/57/49/1374445749.db2.gz PVMIXIGYOCQCCR-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001418840362 1374563406 /nfs/dbraw/zinc/56/34/06/1374563406.db2.gz NHKPSHCEEWXDOM-QGZVFWFLSA-N 1 3 337.895 2.717 10 0 EFAEHO Cc1cccc(C)c1C[N@H+]1CC[C@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001418903576 1374661519 /nfs/dbraw/zinc/66/15/19/1374661519.db2.gz AECRXMVZHBEHDU-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+]1CC[C@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001418903576 1374661523 /nfs/dbraw/zinc/66/15/23/1374661523.db2.gz AECRXMVZHBEHDU-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(F)c(C[N@@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001418945516 1374718071 /nfs/dbraw/zinc/71/80/71/1374718071.db2.gz XXYLSTXOCIUTIQ-QGZVFWFLSA-N 1 3 349.494 2.755 10 0 EFAEHO Cc1ccc(F)c(C[N@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001418945516 1374718080 /nfs/dbraw/zinc/71/80/80/1374718080.db2.gz XXYLSTXOCIUTIQ-QGZVFWFLSA-N 1 3 349.494 2.755 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2C[C@@H]3C[C@H]2CN3CCCC(C)(C)C)CC[N@@H+]1C ZINC001419055971 1374796582 /nfs/dbraw/zinc/79/65/82/1374796582.db2.gz XJHGMDJRINWTEA-XSLAGTTESA-N 1 3 335.536 2.828 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2C[C@@H]3C[C@H]2CN3CCCC(C)(C)C)CC[N@H+]1C ZINC001419055971 1374796589 /nfs/dbraw/zinc/79/65/89/1374796589.db2.gz XJHGMDJRINWTEA-XSLAGTTESA-N 1 3 335.536 2.828 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001419079228 1374818956 /nfs/dbraw/zinc/81/89/56/1374818956.db2.gz YKLHQPDRPYMVPE-ZBFHGGJFSA-N 1 3 345.478 2.685 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@H+](CCC2CCCC2)C1 ZINC001419165251 1374914020 /nfs/dbraw/zinc/91/40/20/1374914020.db2.gz YVXLKQOZCDQSPV-HKUYNNGSSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@H]1CC[N@@H+](CCC2CCCC2)C1 ZINC001419165251 1374914024 /nfs/dbraw/zinc/91/40/24/1374914024.db2.gz YVXLKQOZCDQSPV-HKUYNNGSSA-N 1 3 335.536 2.831 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@H](CC)NCC=C(Cl)Cl ZINC001419201281 1374946664 /nfs/dbraw/zinc/94/66/64/1374946664.db2.gz QFCHOVNZQBUHNM-OLZOCXBDSA-N 1 3 336.307 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@@H](CC)NCC=C(Cl)Cl ZINC001419201281 1374946668 /nfs/dbraw/zinc/94/66/68/1374946668.db2.gz QFCHOVNZQBUHNM-OLZOCXBDSA-N 1 3 336.307 2.664 10 0 EFAEHO C[C@H](F)CC[NH+]1CCC2(C[C@@H]2NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001419201897 1374947695 /nfs/dbraw/zinc/94/76/95/1374947695.db2.gz AHXXDUJTCPZULN-HOTGVXAUSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]Cc1cccnc1C ZINC001419235086 1374981794 /nfs/dbraw/zinc/98/17/94/1374981794.db2.gz GDEQDOKAHDQTCK-MOPGFXCFSA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1c(C)cc(C)cc1C ZINC001419246036 1374993246 /nfs/dbraw/zinc/99/32/46/1374993246.db2.gz PNHZKBBSOSOLOL-BEFAXECRSA-N 1 3 345.531 2.938 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@@H](NCC=C(Cl)Cl)C1CC1 ZINC001419258849 1375005272 /nfs/dbraw/zinc/00/52/72/1375005272.db2.gz BCLGCPKDSNOYLH-ZIAGYGMSSA-N 1 3 348.318 2.664 10 0 EFAEHO CC(C)CC[NH2+][C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001419298059 1375057256 /nfs/dbraw/zinc/05/72/56/1375057256.db2.gz PIWVYSTVQPUEEV-LPHOPBHVSA-N 1 3 341.515 2.729 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]([NH2+]CCC2CCCCC2)C2CC2)C1 ZINC001419300470 1375061684 /nfs/dbraw/zinc/06/16/84/1375061684.db2.gz RTRAPRJJPBLPPF-LPHOPBHVSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C2CC2)c(C)c1 ZINC001419326716 1375106360 /nfs/dbraw/zinc/10/63/60/1375106360.db2.gz PWFXYVZUOOASDV-LJQANCHMSA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001419328773 1375110441 /nfs/dbraw/zinc/11/04/41/1375110441.db2.gz BZCOCBCSFDZUGB-DLBZAZTESA-N 1 3 343.531 2.883 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001419328773 1375110446 /nfs/dbraw/zinc/11/04/46/1375110446.db2.gz BZCOCBCSFDZUGB-DLBZAZTESA-N 1 3 343.531 2.883 10 0 EFAEHO CC(C)CC[N@H+](C)C[C@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001419336512 1375124007 /nfs/dbraw/zinc/12/40/07/1375124007.db2.gz DFKKKAQOACDSEF-QZTJIDSGSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)CC[N@@H+](C)C[C@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001419336512 1375124013 /nfs/dbraw/zinc/12/40/13/1375124013.db2.gz DFKKKAQOACDSEF-QZTJIDSGSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)C[NH2+]C[C@@](C)(NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001419338789 1375127361 /nfs/dbraw/zinc/12/73/61/1375127361.db2.gz CFSIQOFTRSMWHM-MOPGFXCFSA-N 1 3 341.515 2.729 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)N[C@](C)(CNCc2ccccc2Cl)C2CC2)C1 ZINC001419362035 1375167022 /nfs/dbraw/zinc/16/70/22/1375167022.db2.gz VWOBLDJQUOUWDW-HNAYVOBHSA-N 1 3 349.906 2.666 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)N[C@](C)(CNCc2ccccc2Cl)C2CC2)C1 ZINC001419362035 1375167030 /nfs/dbraw/zinc/16/70/30/1375167030.db2.gz VWOBLDJQUOUWDW-HNAYVOBHSA-N 1 3 349.906 2.666 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)N[C@@](C)(CNCc2ccccc2Cl)C2CC2)C1 ZINC001419362042 1375167050 /nfs/dbraw/zinc/16/70/50/1375167050.db2.gz VWOBLDJQUOUWDW-KXBFYZLASA-N 1 3 349.906 2.666 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)N[C@@](C)(CNCc2ccccc2Cl)C2CC2)C1 ZINC001419362042 1375167056 /nfs/dbraw/zinc/16/70/56/1375167056.db2.gz VWOBLDJQUOUWDW-KXBFYZLASA-N 1 3 349.906 2.666 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CC[C@H]([NH2+]Cc2cc(C)cc(C)c2)C1 ZINC001419365579 1375172622 /nfs/dbraw/zinc/17/26/22/1375172622.db2.gz LNHMVKBUNJAVMJ-RBUKOAKNSA-N 1 3 349.494 2.674 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+][C@@H](C)c2cccc(Cl)c2)C1 ZINC001419386826 1375204780 /nfs/dbraw/zinc/20/47/80/1375204780.db2.gz UMXKNQFWSRSJIU-YOEHRIQHSA-N 1 3 337.895 2.932 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2CC[C@H](NC(=O)CN(C)C(C)C)CC2)c1 ZINC001419389136 1375208135 /nfs/dbraw/zinc/20/81/35/1375208135.db2.gz DSFYTKQHXSMRNE-WGSAOQKQSA-N 1 3 331.504 2.852 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC1CC[NH+](CC2CCCC2)CC1)N(C)C ZINC001419414253 1375241852 /nfs/dbraw/zinc/24/18/52/1375241852.db2.gz GIPWAYUFIWALGM-LJQANCHMSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H](N[C@H]1C[C@H](NC(=O)CC[NH+](C)C)C1)c1ccc(F)cc1F ZINC001419415851 1375243885 /nfs/dbraw/zinc/24/38/85/1375243885.db2.gz FQLNMKTZXFMDMI-CKEIUWERSA-N 1 3 339.430 2.604 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]2CN(Cc3ccc(F)cc3)CC[C@@H]21 ZINC001419450672 1375290727 /nfs/dbraw/zinc/29/07/27/1375290727.db2.gz QDHHHHOEIINYAK-MJGOQNOKSA-N 1 3 347.478 2.590 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccsc1)N(C)C ZINC001419460838 1375303287 /nfs/dbraw/zinc/30/32/87/1375303287.db2.gz LGXCZWPHJMUDTO-FBVQUNGASA-N 1 3 349.544 2.946 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccsc1)N(C)C ZINC001419460838 1375303298 /nfs/dbraw/zinc/30/32/98/1375303298.db2.gz LGXCZWPHJMUDTO-FBVQUNGASA-N 1 3 349.544 2.946 10 0 EFAEHO CC[C@@H](N[C@H]1C[C@@H](NC(=O)CC[NH+](C)C)C1)c1ccc(F)cc1F ZINC001419488214 1375336261 /nfs/dbraw/zinc/33/62/61/1375336261.db2.gz FQLNMKTZXFMDMI-JKIFEVAISA-N 1 3 339.430 2.604 10 0 EFAEHO CCC(CC)C[NH2+]C[C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001419519772 1375379365 /nfs/dbraw/zinc/37/93/65/1375379365.db2.gz ZXCBYGLVRPYJMT-KXBFYZLASA-N 1 3 343.531 2.977 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001419555963 1375445176 /nfs/dbraw/zinc/44/51/76/1375445176.db2.gz LAXORZLVUWQVOJ-WOJBJXKFSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001419555963 1375445179 /nfs/dbraw/zinc/44/51/79/1375445179.db2.gz LAXORZLVUWQVOJ-WOJBJXKFSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)CC[NH+](C)C)CCCC2)c1 ZINC001419620789 1375559680 /nfs/dbraw/zinc/55/96/80/1375559680.db2.gz WFDBNIHQUXTGAM-UHFFFAOYSA-N 1 3 335.467 2.604 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001419669214 1375674266 /nfs/dbraw/zinc/67/42/66/1375674266.db2.gz AOPYLWFDIAJGQF-KXBFYZLASA-N 1 3 344.503 2.691 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001419674691 1375687888 /nfs/dbraw/zinc/68/78/88/1375687888.db2.gz RDLCKVLYTYCFAI-WMZOPIPTSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001419674691 1375687894 /nfs/dbraw/zinc/68/78/94/1375687894.db2.gz RDLCKVLYTYCFAI-WMZOPIPTSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(Cl)cc1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001419722209 1375769397 /nfs/dbraw/zinc/76/93/97/1375769397.db2.gz PYNUNQFXHCPNRY-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C(=O)CN1CCCC1 ZINC001419750792 1375813525 /nfs/dbraw/zinc/81/35/25/1375813525.db2.gz WHVODWWXIJMVLT-INIZCTEOSA-N 1 3 329.488 2.596 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001419768781 1375844527 /nfs/dbraw/zinc/84/45/27/1375844527.db2.gz MXXQNJDWEXJQRY-KXBFYZLASA-N 1 3 342.487 2.637 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001419768776 1375845390 /nfs/dbraw/zinc/84/53/90/1375845390.db2.gz MXXQNJDWEXJQRY-HNAYVOBHSA-N 1 3 342.487 2.637 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001419770172 1375846398 /nfs/dbraw/zinc/84/63/98/1375846398.db2.gz IASDBHJIUCSSHC-GUYCJALGSA-N 1 3 349.906 2.906 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001419774810 1375854977 /nfs/dbraw/zinc/85/49/77/1375854977.db2.gz YYFZEJWQZOAQJR-HNAYVOBHSA-N 1 3 349.494 2.980 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001419831668 1375952779 /nfs/dbraw/zinc/95/27/79/1375952779.db2.gz VUCUJXFYFAVHAW-PXNSSMCTSA-N 1 3 345.531 2.916 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001419840535 1375971652 /nfs/dbraw/zinc/97/16/52/1375971652.db2.gz PDLURRVLAWJNSJ-QGZVFWFLSA-N 1 3 331.504 2.772 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)CC1 ZINC001419844210 1375982581 /nfs/dbraw/zinc/98/25/81/1375982581.db2.gz CMLIFUITPIOLOZ-ZWKOTPCHSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)CC1 ZINC001419844210 1375982587 /nfs/dbraw/zinc/98/25/87/1375982587.db2.gz CMLIFUITPIOLOZ-ZWKOTPCHSA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NCc1ccc(Cl)c(Cl)c1 ZINC001419915563 1376121860 /nfs/dbraw/zinc/12/18/60/1376121860.db2.gz ALQMQPHQZDXZRE-AAEUAGOBSA-N 1 3 344.286 2.539 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NCc1ccc(Cl)c(Cl)c1 ZINC001419915563 1376121864 /nfs/dbraw/zinc/12/18/64/1376121864.db2.gz ALQMQPHQZDXZRE-AAEUAGOBSA-N 1 3 344.286 2.539 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+][C@@H](C)c1ccc2c(c1)CCC2 ZINC001419930298 1376146286 /nfs/dbraw/zinc/14/62/86/1376146286.db2.gz CIKZKGDJIJHFMQ-HOTGVXAUSA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H](C)c1ccccc1F ZINC001419940136 1376161712 /nfs/dbraw/zinc/16/17/12/1376161712.db2.gz XOVNABCKJXYHFI-YJBOKZPZSA-N 1 3 337.483 2.957 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+][C@@H]1CCc2c1cccc2Cl ZINC001419942521 1376167549 /nfs/dbraw/zinc/16/75/49/1376167549.db2.gz XLSMEBDOJBKLLO-SUMWQHHRSA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]Cc2cccc(Cl)c2)C1 ZINC001420016416 1376287756 /nfs/dbraw/zinc/28/77/56/1376287756.db2.gz OLAUPAFYVYBAPQ-INIZCTEOSA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2)C1 ZINC001420022950 1376302662 /nfs/dbraw/zinc/30/26/62/1376302662.db2.gz YLKFYOZUSGDZGQ-HOTGVXAUSA-N 1 3 335.467 2.665 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]([N@H+](C)C/C=C/c2ccccc2)C1 ZINC001420030970 1376321867 /nfs/dbraw/zinc/32/18/67/1376321867.db2.gz LPBIMPXLLYYIGO-IDTFUJSHSA-N 1 3 341.499 2.717 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]([N@@H+](C)C/C=C/c2ccccc2)C1 ZINC001420030970 1376321873 /nfs/dbraw/zinc/32/18/73/1376321873.db2.gz LPBIMPXLLYYIGO-IDTFUJSHSA-N 1 3 341.499 2.717 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@H+](C)CCC1CCCCC1)N(C)C ZINC001420034870 1376336187 /nfs/dbraw/zinc/33/61/87/1376336187.db2.gz DZLLFYYTCSJGSU-GOSISDBHSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@@H+](C)CCC1CCCCC1)N(C)C ZINC001420034870 1376336194 /nfs/dbraw/zinc/33/61/94/1376336194.db2.gz DZLLFYYTCSJGSU-GOSISDBHSA-N 1 3 325.541 2.933 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)[C@@H]1CCN(Cc2cc3ccccc3s2)C1 ZINC001438241374 1388438374 /nfs/dbraw/zinc/43/83/74/1388438374.db2.gz LPBKIHBTVATWTN-MRXNPFEDSA-N 1 3 345.512 2.886 10 0 EFAEHO CCN1C[C@H](NC(=O)c2oc3ccccc3c2C[NH+](C)C)C(C)(C)C1 ZINC001420050204 1376381685 /nfs/dbraw/zinc/38/16/85/1376381685.db2.gz BVRJEUMNHKUHQF-KRWDZBQOSA-N 1 3 343.471 2.955 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@@H]2CCC[C@@H]3CCC[N@@H+]32)cc1 ZINC001420306873 1376703111 /nfs/dbraw/zinc/70/31/11/1376703111.db2.gz BPFHJWCKGAMWRQ-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@@H]2CCC[C@@H]3CCC[N@H+]32)cc1 ZINC001420306873 1376703114 /nfs/dbraw/zinc/70/31/14/1376703114.db2.gz BPFHJWCKGAMWRQ-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO Cc1cc(C)c(CN(C)CCNC(=O)C[C@H]2CC[N@H+](C)C2)c(C)c1 ZINC001420334957 1376753593 /nfs/dbraw/zinc/75/35/93/1376753593.db2.gz SJBCZMVJBMDVKC-GOSISDBHSA-N 1 3 331.504 2.502 10 0 EFAEHO Cc1cc(C)c(CN(C)CCNC(=O)C[C@H]2CC[N@@H+](C)C2)c(C)c1 ZINC001420334957 1376753604 /nfs/dbraw/zinc/75/36/04/1376753604.db2.gz SJBCZMVJBMDVKC-GOSISDBHSA-N 1 3 331.504 2.502 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)C[NH+]1[C@H](C)CC[C@H]1C ZINC001420348056 1376778685 /nfs/dbraw/zinc/77/86/85/1376778685.db2.gz CGSMKEJEDMBGIG-IAGOWNOFSA-N 1 3 331.504 2.670 10 0 EFAEHO COc1cccc(C[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCCN2C(C)C)c1 ZINC001420352123 1376787163 /nfs/dbraw/zinc/78/71/63/1376787163.db2.gz GXBQOKLKDSIQJC-VQIMIIECSA-N 1 3 347.503 2.552 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001420375596 1376835241 /nfs/dbraw/zinc/83/52/41/1376835241.db2.gz FXRWMYWKHQXIQY-DYVFJYSZSA-N 1 3 337.895 2.762 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21)Cc1cccc(C)c1 ZINC001420394884 1376875503 /nfs/dbraw/zinc/87/55/03/1376875503.db2.gz GOSOJWWVHCGZDD-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21)Cc1cccc(C)c1 ZINC001420394884 1376875508 /nfs/dbraw/zinc/87/55/08/1376875508.db2.gz GOSOJWWVHCGZDD-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)CCC[NH+](C)C)c(Cl)c1 ZINC001420457091 1377008842 /nfs/dbraw/zinc/00/88/42/1377008842.db2.gz KRWDMYULTPJHFI-AWEZNQCLSA-N 1 3 325.884 2.585 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C ZINC001420509700 1377105893 /nfs/dbraw/zinc/10/58/93/1377105893.db2.gz WXCRENMEJUOBLP-KXBFYZLASA-N 1 3 331.504 2.889 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1c(C)cccc1C ZINC001420515248 1377114746 /nfs/dbraw/zinc/11/47/46/1377114746.db2.gz GCQAGHHSDQOAGQ-HKUYNNGSSA-N 1 3 331.504 2.772 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[N@@H+]1CC[C@@H](C)C1 ZINC001420622861 1377352173 /nfs/dbraw/zinc/35/21/73/1377352173.db2.gz JZWUREXRJPOPGG-CVEARBPZSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[N@H+]1CC[C@@H](C)C1 ZINC001420622861 1377352178 /nfs/dbraw/zinc/35/21/78/1377352178.db2.gz JZWUREXRJPOPGG-CVEARBPZSA-N 1 3 343.471 2.711 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)C[C@@H](C)NC(=O)C12CC[NH+](CC1)C2 ZINC001420658605 1377437445 /nfs/dbraw/zinc/43/74/45/1377437445.db2.gz DXLKLQHJBSBYJD-OAHLLOKOSA-N 1 3 349.906 2.681 10 0 EFAEHO CC[C@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)NCC=C(Cl)Cl ZINC001438308865 1388498712 /nfs/dbraw/zinc/49/87/12/1388498712.db2.gz GBAMHUPIBJOTLK-CHWSQXEVSA-N 1 3 336.307 2.664 10 0 EFAEHO CC[C@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)NCC=C(Cl)Cl ZINC001438308865 1388498716 /nfs/dbraw/zinc/49/87/16/1388498716.db2.gz GBAMHUPIBJOTLK-CHWSQXEVSA-N 1 3 336.307 2.664 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@H+](C)Cc1ccc(C)cc1 ZINC001420673016 1377479073 /nfs/dbraw/zinc/47/90/73/1377479073.db2.gz GKPPKOBBOUGJHF-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@@H+](C)Cc1ccc(C)cc1 ZINC001420673016 1377479076 /nfs/dbraw/zinc/47/90/76/1377479076.db2.gz GKPPKOBBOUGJHF-MJGOQNOKSA-N 1 3 331.504 2.806 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NCCN(C/C=C/c2ccccc2)C2CC2)C1 ZINC001420702027 1377532582 /nfs/dbraw/zinc/53/25/82/1377532582.db2.gz WTIXOMNOTMETPV-MEQKGCOVSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NCCN(C/C=C/c2ccccc2)C2CC2)C1 ZINC001420702027 1377532586 /nfs/dbraw/zinc/53/25/86/1377532586.db2.gz WTIXOMNOTMETPV-MEQKGCOVSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NCCN(C/C=C/c2ccccc2)C2CC2)C1 ZINC001420702029 1377532613 /nfs/dbraw/zinc/53/26/13/1377532613.db2.gz WTIXOMNOTMETPV-MTCRFPMVSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NCCN(C/C=C/c2ccccc2)C2CC2)C1 ZINC001420702029 1377532617 /nfs/dbraw/zinc/53/26/17/1377532617.db2.gz WTIXOMNOTMETPV-MTCRFPMVSA-N 1 3 341.499 2.622 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](CNCc1ccccc1F)C1CC1 ZINC001420738182 1377586187 /nfs/dbraw/zinc/58/61/87/1377586187.db2.gz NFVHFKWMGFLYJN-RBUKOAKNSA-N 1 3 347.478 2.685 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](CNCc1ccccc1F)C1CC1 ZINC001420738182 1377586189 /nfs/dbraw/zinc/58/61/89/1377586189.db2.gz NFVHFKWMGFLYJN-RBUKOAKNSA-N 1 3 347.478 2.685 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2ccc(CF)cc2)C1)N(C)C ZINC001420895155 1377852608 /nfs/dbraw/zinc/85/26/08/1377852608.db2.gz SGAJSPXEONQKCX-RBUKOAKNSA-N 1 3 349.494 2.825 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2ccc(CF)cc2)C1)N(C)C ZINC001420895155 1377852611 /nfs/dbraw/zinc/85/26/11/1377852611.db2.gz SGAJSPXEONQKCX-RBUKOAKNSA-N 1 3 349.494 2.825 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](C[N@H+](C)CCCC(C)(C)C)C2)C1 ZINC001420948727 1377926014 /nfs/dbraw/zinc/92/60/14/1377926014.db2.gz RFGAVBXXURVBQH-QZTJIDSGSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](C[N@@H+](C)CCCC(C)(C)C)C2)C1 ZINC001420948727 1377926019 /nfs/dbraw/zinc/92/60/19/1377926019.db2.gz RFGAVBXXURVBQH-QZTJIDSGSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+][C@H]2CCc3c2cccc3Cl)CC1)N(C)C ZINC001420958044 1377940204 /nfs/dbraw/zinc/94/02/04/1377940204.db2.gz ZTYHBRMPRMGBQK-DLBZAZTESA-N 1 3 349.906 2.906 10 0 EFAEHO C[C@H]([NH2+]C1(CNC(=O)CN(C)CC(C)(C)C)CC1)c1ccccc1 ZINC001420975320 1377962485 /nfs/dbraw/zinc/96/24/85/1377962485.db2.gz HIWQICYJDBVPID-INIZCTEOSA-N 1 3 331.504 2.964 10 0 EFAEHO C[C@@H]([NH2+]C1(CNC(=O)CN(C)CC(C)(C)C)CC1)c1ccccc1 ZINC001420975325 1377962737 /nfs/dbraw/zinc/96/27/37/1377962737.db2.gz HIWQICYJDBVPID-MRXNPFEDSA-N 1 3 331.504 2.964 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@@H](C(=O)NCC2(NCc3cccc(F)c3)CC2)C1 ZINC001420995007 1377993443 /nfs/dbraw/zinc/99/34/43/1377993443.db2.gz NDPJVRXQVLDAEM-AEFFLSMTSA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(CC[N@H+](Cc3ccc(F)cc3)C2)C1 ZINC001421037557 1378054746 /nfs/dbraw/zinc/05/47/46/1378054746.db2.gz IYPGMLMSKNMTPN-FQEVSTJZSA-N 1 3 347.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(CC[N@@H+](Cc3ccc(F)cc3)C2)C1 ZINC001421037557 1378054747 /nfs/dbraw/zinc/05/47/47/1378054747.db2.gz IYPGMLMSKNMTPN-FQEVSTJZSA-N 1 3 347.478 2.590 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@]3(CCN(C(=O)CN(C)C(C)C)C3)C2)cc1 ZINC001421040747 1378058143 /nfs/dbraw/zinc/05/81/43/1378058143.db2.gz STJJHKGYJCBSJX-OAQYLSRUSA-N 1 3 343.515 2.760 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@]3(CCN(C(=O)CN(C)C(C)C)C3)C2)cc1 ZINC001421040747 1378058147 /nfs/dbraw/zinc/05/81/47/1378058147.db2.gz STJJHKGYJCBSJX-OAQYLSRUSA-N 1 3 343.515 2.760 10 0 EFAEHO C[C@H](c1ccccc1F)N1CC[C@@]2(CCN(C(=O)CC[NH+](C)C)C2)C1 ZINC001421041246 1378059520 /nfs/dbraw/zinc/05/95/20/1378059520.db2.gz UTTNRHQDJYOWKJ-OXQOHEQNSA-N 1 3 347.478 2.763 10 0 EFAEHO Cc1cccc([C@@H](C)N2CC(CNC(=O)C(C)(C)[NH+]3CCCC3)C2)c1 ZINC001421152986 1378194688 /nfs/dbraw/zinc/19/46/88/1378194688.db2.gz QEASBOFMOHDTCD-QGZVFWFLSA-N 1 3 343.515 2.978 10 0 EFAEHO CC(C)(C)CC[NH+]1CC(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001421159378 1378204283 /nfs/dbraw/zinc/20/42/83/1378204283.db2.gz UQUOHCMPHXUDJD-IBGZPJMESA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1C[NH+](CCCc2ccccc2)C1 ZINC001421202610 1378269227 /nfs/dbraw/zinc/26/92/27/1378269227.db2.gz PNNHDFGVTSXHRN-ROUUACIJSA-N 1 3 343.515 2.540 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1(C)CC[NH+](CC[C@H](C)F)CC1 ZINC001421265714 1378376658 /nfs/dbraw/zinc/37/66/58/1378376658.db2.gz ISVCDBCZHVKZQT-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)CC[NH+]1CCC(C)(CNC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001421273028 1378390883 /nfs/dbraw/zinc/39/08/83/1378390883.db2.gz AVAZKKMXPYLMJX-KRWDZBQOSA-N 1 3 325.541 2.837 10 0 EFAEHO C[NH+](C)CCCC(=O)NC[C@]1(C)CCCN(Cc2ccsc2)C1 ZINC001421281778 1378418882 /nfs/dbraw/zinc/41/88/82/1378418882.db2.gz OFQVEJMALRQIMB-SFHVURJKSA-N 1 3 337.533 2.808 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001421318145 1378487470 /nfs/dbraw/zinc/48/74/70/1378487470.db2.gz IXZANGLGBJSXDD-MRXNPFEDSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)CCC[N@H+]1CCC(F)(F)[C@H](CNC(=O)CN(C)C(C)C)C1 ZINC001421318145 1378487473 /nfs/dbraw/zinc/48/74/73/1378487473.db2.gz IXZANGLGBJSXDD-MRXNPFEDSA-N 1 3 347.494 2.836 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@@H]1CC[N@H+](CC2CC(C)(C)C2)C1 ZINC001421355991 1378537462 /nfs/dbraw/zinc/53/74/62/1378537462.db2.gz UPLVIIWPDKNTKS-FUHWJXTLSA-N 1 3 335.536 2.687 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C)C1)[C@@H]1CC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001421355991 1378537471 /nfs/dbraw/zinc/53/74/71/1378537471.db2.gz UPLVIIWPDKNTKS-FUHWJXTLSA-N 1 3 335.536 2.687 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1cc(F)ccc1C ZINC001421423319 1378600596 /nfs/dbraw/zinc/60/05/96/1378600596.db2.gz PQNMWNYJUJHWET-OALUTQOASA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@H](CNC(=O)Cc1nc[nH]c1C)[NH2+]CC[C@H]1CCCC1(F)F ZINC001421471312 1378661321 /nfs/dbraw/zinc/66/13/21/1378661321.db2.gz ARWIRSWSDREJBF-ZIAGYGMSSA-N 1 3 342.434 2.571 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccsc1)C2)C1CCC1 ZINC001421516784 1378731625 /nfs/dbraw/zinc/73/16/25/1378731625.db2.gz UWOQCSXRWDGJEO-BQFCYCMXSA-N 1 3 347.528 2.702 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccsc1)C2)C1CCC1 ZINC001421516784 1378731631 /nfs/dbraw/zinc/73/16/31/1378731631.db2.gz UWOQCSXRWDGJEO-BQFCYCMXSA-N 1 3 347.528 2.702 10 0 EFAEHO C[C@H](c1ccc(Cl)cc1)N1C[C@@H]2CN(C(=O)CC[NH+](C)C)C[C@@H]2C1 ZINC001421569170 1378826214 /nfs/dbraw/zinc/82/62/14/1378826214.db2.gz AJVJORWIEFKAOZ-OIISXLGYSA-N 1 3 349.906 2.743 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2CC[C@H](NC(=O)CN(C)C(C)C)CC2)cs1 ZINC001421607377 1378876075 /nfs/dbraw/zinc/87/60/75/1378876075.db2.gz MNZMEWYCVUTNOS-QAQDUYKDSA-N 1 3 337.533 2.914 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2C[C@H](F)CC ZINC001421632985 1378917322 /nfs/dbraw/zinc/91/73/22/1378917322.db2.gz JDEVYRXCRXIULT-ZACQAIPSSA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2C[C@H](F)CC ZINC001421632985 1378917324 /nfs/dbraw/zinc/91/73/24/1378917324.db2.gz JDEVYRXCRXIULT-ZACQAIPSSA-N 1 3 327.488 2.532 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001421652534 1378949771 /nfs/dbraw/zinc/94/97/71/1378949771.db2.gz ZQHJPEPJWKKDSA-IEBWSBKVSA-N 1 3 331.504 2.977 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001421652540 1378949789 /nfs/dbraw/zinc/94/97/89/1378949789.db2.gz ZQHJPEPJWKKDSA-PKOBYXMFSA-N 1 3 331.504 2.977 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NCC2(NCc3ccsc3)CCC2)C1 ZINC001421767417 1379105873 /nfs/dbraw/zinc/10/58/73/1379105873.db2.gz SJYDRLSAJMKAEJ-QGZVFWFLSA-N 1 3 349.544 2.999 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NCC2(NCc3ccsc3)CCC2)C1 ZINC001421767417 1379105875 /nfs/dbraw/zinc/10/58/75/1379105875.db2.gz SJYDRLSAJMKAEJ-QGZVFWFLSA-N 1 3 349.544 2.999 10 0 EFAEHO CC[C@H](C)C[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CCC1 ZINC001421768965 1379108093 /nfs/dbraw/zinc/10/80/93/1379108093.db2.gz YGDNIZSMZXLKPC-HNAYVOBHSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+]C[C@@H]2CCC(F)(F)C2)CCC1)N(C)C ZINC001421779906 1379128649 /nfs/dbraw/zinc/12/86/49/1379128649.db2.gz UOVWZYQVTNGBML-CABCVRRESA-N 1 3 345.478 2.637 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[N@H+](C)CC2CC(C)(C)C2)CC1 ZINC001421894545 1379316193 /nfs/dbraw/zinc/31/61/93/1379316193.db2.gz ZVCJTBSPZALLFG-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[N@@H+](C)CC2CC(C)(C)C2)CC1 ZINC001421894545 1379316199 /nfs/dbraw/zinc/31/61/99/1379316199.db2.gz ZVCJTBSPZALLFG-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001421923418 1379355064 /nfs/dbraw/zinc/35/50/64/1379355064.db2.gz AOPYLWFDIAJGQF-DNVCBOLYSA-N 1 3 344.503 2.691 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001421942902 1379385882 /nfs/dbraw/zinc/38/58/82/1379385882.db2.gz YMWGCLUPRIMODQ-MRXNPFEDSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@H](C)N(C)C(=O)CN(C)C(C)C)c(C)c1 ZINC001421984359 1379440010 /nfs/dbraw/zinc/44/00/10/1379440010.db2.gz NILIEQWNNFTGPY-SFHVURJKSA-N 1 3 333.520 2.889 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1cccc(OC)c1 ZINC001421988486 1379444104 /nfs/dbraw/zinc/44/41/04/1379444104.db2.gz RMBJJGZTBFQUFP-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO CCCN(C)CC(=O)N(C)[C@H](C)C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001421994810 1379453608 /nfs/dbraw/zinc/45/36/08/1379453608.db2.gz RCGCIVYTJDHJCZ-CABCVRRESA-N 1 3 333.467 2.590 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1[NH2+]CC1CC2(CCC2)C1 ZINC001422056556 1379551302 /nfs/dbraw/zinc/55/13/02/1379551302.db2.gz GQQDGXBIOCLYDD-AEFFLSMTSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H](C)[NH2+]Cc2ccsc2)C1 ZINC001422059472 1379556967 /nfs/dbraw/zinc/55/69/67/1379556967.db2.gz OMESVZPUQIGDAX-DOTOQJQBSA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H]([NH2+]Cc2cc3ccccc3o2)C1 ZINC001422063219 1379562547 /nfs/dbraw/zinc/56/25/47/1379562547.db2.gz NXJGICOBBIHNEJ-QAPCUYQASA-N 1 3 343.471 2.710 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H]2[C@@H](C)CCCN2C(=O)CC[NH+](C)C)c1 ZINC001422070269 1379571476 /nfs/dbraw/zinc/57/14/76/1379571476.db2.gz WWBBNWZCPGBEMW-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H](CNC(=O)CN1CC[C@@H](C)C1)C(C)C ZINC001422105925 1379618104 /nfs/dbraw/zinc/61/81/04/1379618104.db2.gz CDYDAAAKQGAFHZ-BEFAXECRSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1cc(F)ccc1CN1CC[C@H](NC(=O)CC[NH+](C)C)C[C@@H]1C ZINC001422117323 1379635356 /nfs/dbraw/zinc/63/53/56/1379635356.db2.gz BWJJFEBEAVLFOC-YJBOKZPZSA-N 1 3 335.467 2.555 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1CC1CC(C)(C)C1 ZINC001422125373 1379650641 /nfs/dbraw/zinc/65/06/41/1379650641.db2.gz TUYWZAOXACJKRS-NVXWUHKLSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@H+]1CC1CC(C)(C)C1 ZINC001422125373 1379650645 /nfs/dbraw/zinc/65/06/45/1379650645.db2.gz TUYWZAOXACJKRS-NVXWUHKLSA-N 1 3 335.536 2.876 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C(C)C)c1 ZINC001422135805 1379668418 /nfs/dbraw/zinc/66/84/18/1379668418.db2.gz NPVVLPNHYQVDNE-IBGZPJMESA-N 1 3 333.520 2.874 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CC[C@H](C)F)N(C)C ZINC001422233002 1379824274 /nfs/dbraw/zinc/82/42/74/1379824274.db2.gz NQQMIPPMNBJTSG-PIKADFDJSA-N 1 3 349.494 2.693 10 0 EFAEHO CN(CC[N@H+](C)Cc1ccc(C(C)(C)C)cc1)C(=O)CN1CCCC1 ZINC001422238436 1379834776 /nfs/dbraw/zinc/83/47/76/1379834776.db2.gz QZSHDTCNCMDHMZ-UHFFFAOYSA-N 1 3 345.531 2.970 10 0 EFAEHO CN(CC[N@@H+](C)Cc1ccc(C(C)(C)C)cc1)C(=O)CN1CCCC1 ZINC001422238436 1379834783 /nfs/dbraw/zinc/83/47/83/1379834783.db2.gz QZSHDTCNCMDHMZ-UHFFFAOYSA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2CCc2cccs2)C1 ZINC001422248562 1379856263 /nfs/dbraw/zinc/85/62/63/1379856263.db2.gz OUJNMFPRJKQPMB-WMZOPIPTSA-N 1 3 349.544 2.554 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2CCc2cccs2)C1 ZINC001422248562 1379856270 /nfs/dbraw/zinc/85/62/70/1379856270.db2.gz OUJNMFPRJKQPMB-WMZOPIPTSA-N 1 3 349.544 2.554 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001422421467 1380069447 /nfs/dbraw/zinc/06/94/47/1380069447.db2.gz ALFUMFLQFSYNPA-KDOFPFPSSA-N 1 3 335.467 2.638 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[N@H+](C)CCc1ccccc1 ZINC001422518915 1380242515 /nfs/dbraw/zinc/24/25/15/1380242515.db2.gz NZDMCRCCIWPNHD-PKOBYXMFSA-N 1 3 331.504 2.540 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[N@@H+](C)CCc1ccccc1 ZINC001422518915 1380242519 /nfs/dbraw/zinc/24/25/19/1380242519.db2.gz NZDMCRCCIWPNHD-PKOBYXMFSA-N 1 3 331.504 2.540 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[N@H+](C)Cc1ccc(Cl)cc1 ZINC001422559891 1380322040 /nfs/dbraw/zinc/32/20/40/1380322040.db2.gz JEGFYKNUJJMUBW-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001422559891 1380322044 /nfs/dbraw/zinc/32/20/44/1380322044.db2.gz JEGFYKNUJJMUBW-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)CC1CCC(F)(F)CC1 ZINC001422602632 1380405281 /nfs/dbraw/zinc/40/52/81/1380405281.db2.gz LAHKJTFIMXTHAQ-AWEZNQCLSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)CC1CCC(F)(F)CC1 ZINC001422602632 1380405282 /nfs/dbraw/zinc/40/52/82/1380405282.db2.gz LAHKJTFIMXTHAQ-AWEZNQCLSA-N 1 3 333.467 2.589 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(C)c(F)c1 ZINC001422615196 1380439574 /nfs/dbraw/zinc/43/95/74/1380439574.db2.gz DCTLYMLQMNGILD-CRAIPNDOSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)CNC(=O)CN(C)C(C)C)c(Cl)c1 ZINC001438549668 1388668500 /nfs/dbraw/zinc/66/85/00/1388668500.db2.gz JLBOBMXVPMNJSU-OAHLLOKOSA-N 1 3 339.911 2.831 10 0 EFAEHO COc1ccc(CN2CCCCC[C@H]2CNC(=O)CC[NH+](C)C)cc1 ZINC001422700749 1380632911 /nfs/dbraw/zinc/63/29/11/1380632911.db2.gz LRWHNDHSKXTWRX-SFHVURJKSA-N 1 3 347.503 2.508 10 0 EFAEHO Cc1ccc(CN2CC([C@@H](C)NC(=O)C(C)(C)[NH+]3CCCC3)C2)cc1 ZINC001422743714 1380745000 /nfs/dbraw/zinc/74/50/00/1380745000.db2.gz RIYBIQBTIGBQOB-QGZVFWFLSA-N 1 3 343.515 2.806 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C1CN(Cc2ccccc2)C1)[NH+](CC)CC ZINC001422752251 1380757646 /nfs/dbraw/zinc/75/76/46/1380757646.db2.gz OFSGGXRIVNAHAN-LPHOPBHVSA-N 1 3 331.504 2.744 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1cc(C)sc1C ZINC001422759698 1380767781 /nfs/dbraw/zinc/76/77/81/1380767781.db2.gz IXIAHMWWZIRAQR-SUMWQHHRSA-N 1 3 337.533 2.834 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1C[NH+](CC[C@H]2CCCC2(F)F)C1 ZINC001422760829 1380768774 /nfs/dbraw/zinc/76/87/74/1380768774.db2.gz JVLXNIGTOLSJPP-GDBMZVCRSA-N 1 3 345.478 2.589 10 0 EFAEHO C[C@H](C[N@H+](C)Cc1ccccc1C1CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001422876764 1380985836 /nfs/dbraw/zinc/98/58/36/1380985836.db2.gz MNPOLEZTJHKSAO-DLBZAZTESA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](C[N@@H+](C)Cc1ccccc1C1CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001422876764 1380985840 /nfs/dbraw/zinc/98/58/40/1380985840.db2.gz MNPOLEZTJHKSAO-DLBZAZTESA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C(F)F)cc1)NC(=O)CC[NH+](C)C ZINC001422881692 1380997110 /nfs/dbraw/zinc/99/71/10/1380997110.db2.gz CTMHNGYSEYHHPT-ZDUSSCGKSA-N 1 3 327.419 2.512 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2s1)NC(=O)CC[NH+](C)C ZINC001422883287 1380999898 /nfs/dbraw/zinc/99/98/98/1380999898.db2.gz HIHVRKYCNNRNNK-CQSZACIVSA-N 1 3 333.501 2.790 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001422906502 1381034230 /nfs/dbraw/zinc/03/42/30/1381034230.db2.gz BWNYJFHTPKVUAT-GUDVDZBRSA-N 1 3 331.504 2.574 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H]2CCc3ccc(F)cc32)C1)N(C)C ZINC001422912375 1381042369 /nfs/dbraw/zinc/04/23/69/1381042369.db2.gz NTCDYNYEBMLCPU-ZAUBIYILSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)CC[C@@H]1CCc2ccccc21 ZINC001422915246 1381048318 /nfs/dbraw/zinc/04/83/18/1381048318.db2.gz GGDNPVYLWGNGEB-HKUYNNGSSA-N 1 3 345.531 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)CC[C@@H]1CCc2ccccc21 ZINC001422915246 1381048320 /nfs/dbraw/zinc/04/83/20/1381048320.db2.gz GGDNPVYLWGNGEB-HKUYNNGSSA-N 1 3 345.531 2.883 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2)C1)N(C)C ZINC001422920699 1381059829 /nfs/dbraw/zinc/05/98/29/1381059829.db2.gz YQSRHVNWIZKIAD-STEAMIEHSA-N 1 3 349.494 2.957 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H](NC(=O)C2(N(C)C)CCC2)C2CC2)c1 ZINC001422997241 1381180286 /nfs/dbraw/zinc/18/02/86/1381180286.db2.gz CPJYQAIRTFISNP-GOSISDBHSA-N 1 3 347.478 2.603 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H](C1CC1)N(C)C(=O)CN(C)C(C)C ZINC001422999176 1381183739 /nfs/dbraw/zinc/18/37/39/1381183739.db2.gz VYWKAQGCKHURIN-LJQANCHMSA-N 1 3 331.504 2.662 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C[NH2+][C@H]1CCc2ccccc21)C1CC1 ZINC001423001490 1381187790 /nfs/dbraw/zinc/18/77/90/1381187790.db2.gz ZFJQRQFMRMPOIW-VQTJNVASSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]Cc1csc(C)c1)C1CC1 ZINC001423004364 1381192219 /nfs/dbraw/zinc/19/22/19/1381192219.db2.gz PHBOMURFNVUWNJ-ZWKOTPCHSA-N 1 3 349.544 2.915 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]Cc1ccc(C)cc1)C1CC1 ZINC001423004491 1381192701 /nfs/dbraw/zinc/19/27/01/1381192701.db2.gz PVKBVSOSGMBCPE-WOJBJXKFSA-N 1 3 343.515 2.854 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+][C@H]1CCCc2ccccc21)C1CC1 ZINC001423059458 1381283898 /nfs/dbraw/zinc/28/38/98/1381283898.db2.gz MCEKJEJTEYBYBJ-PMACEKPBSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CC2CC3(CCC3)C2)CC1 ZINC001423304242 1381761373 /nfs/dbraw/zinc/76/13/73/1381761373.db2.gz CSPAWXAIKWJPKE-IYBDPMFKSA-N 1 3 333.520 2.678 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@H+](CCC2CC2)C1 ZINC001423320033 1381779457 /nfs/dbraw/zinc/77/94/57/1381779457.db2.gz IRMBNCXBMZNHKK-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@@H+](CCC2CC2)C1 ZINC001423320033 1381779464 /nfs/dbraw/zinc/77/94/64/1381779464.db2.gz IRMBNCXBMZNHKK-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H]2C)c(C)c1 ZINC001423319974 1381779725 /nfs/dbraw/zinc/77/97/25/1381779725.db2.gz BEMWCDKJZLOEOX-PKOBYXMFSA-N 1 3 331.504 2.723 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CC[C@@H](NCc2cc(C)ccc2F)[C@@H]1C ZINC001423333357 1381797588 /nfs/dbraw/zinc/79/75/88/1381797588.db2.gz XGGPAPBNFOAZJM-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CC[C@@H](NCc2cc(C)ccc2F)[C@@H]1C ZINC001423333357 1381797590 /nfs/dbraw/zinc/79/75/90/1381797590.db2.gz XGGPAPBNFOAZJM-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001423362963 1381849259 /nfs/dbraw/zinc/84/92/59/1381849259.db2.gz JDYBHWIMAKSGFE-UYAOXDASSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001423362963 1381849270 /nfs/dbraw/zinc/84/92/70/1381849270.db2.gz JDYBHWIMAKSGFE-UYAOXDASSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc2c(c1)CCC2 ZINC001423368913 1381860466 /nfs/dbraw/zinc/86/04/66/1381860466.db2.gz GXZWLKYZVXHQAG-OXQOHEQNSA-N 1 3 343.515 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(CC[N@H+](CC3CC(C)(C)C3)C2)C1 ZINC001423376585 1381875832 /nfs/dbraw/zinc/87/58/32/1381875832.db2.gz LVEWCPQGFAYPQK-FQEVSTJZSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(CC[N@@H+](CC3CC(C)(C)C3)C2)C1 ZINC001423376585 1381875837 /nfs/dbraw/zinc/87/58/37/1381875837.db2.gz LVEWCPQGFAYPQK-FQEVSTJZSA-N 1 3 335.536 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc(CC)cc2)C(C)(C)C1 ZINC001423400089 1381906824 /nfs/dbraw/zinc/90/68/24/1381906824.db2.gz GVUIMDMZYSXBHM-IBGZPJMESA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001423421792 1381930721 /nfs/dbraw/zinc/93/07/21/1381930721.db2.gz QALFRFKASQHHLR-VQTJNVASSA-N 1 3 345.531 2.964 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001423421796 1381931077 /nfs/dbraw/zinc/93/10/77/1381931077.db2.gz QALFRFKASQHHLR-WOJBJXKFSA-N 1 3 345.531 2.964 10 0 EFAEHO CCCN(C)CC(=O)NC1(C)CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001423524752 1382015166 /nfs/dbraw/zinc/01/51/66/1382015166.db2.gz OIBONEXKOUWZNU-FGTMMUONSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001438715090 1388758177 /nfs/dbraw/zinc/75/81/77/1388758177.db2.gz OTEPENFUSHDBHK-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1C(=O)N(C)[C@H](C)CNCc1ccccc1F ZINC001438715090 1388758182 /nfs/dbraw/zinc/75/81/82/1388758182.db2.gz OTEPENFUSHDBHK-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N(CC[N@H+](C)C[C@H]1CCC(F)(F)C1)C(C)C ZINC001423577192 1382103660 /nfs/dbraw/zinc/10/36/60/1382103660.db2.gz KOXSEERFOWDWDC-INIZCTEOSA-N 1 3 347.494 2.931 10 0 EFAEHO CC(C)N(C)CC(=O)N(CC[N@@H+](C)C[C@H]1CCC(F)(F)C1)C(C)C ZINC001423577192 1382103663 /nfs/dbraw/zinc/10/36/63/1382103663.db2.gz KOXSEERFOWDWDC-INIZCTEOSA-N 1 3 347.494 2.931 10 0 EFAEHO CC(C)N(CCN(C)[C@@H](C)c1ccccc1)C(=O)[C@H]1CC[N@H+](C)C1 ZINC001423584161 1382116363 /nfs/dbraw/zinc/11/63/63/1382116363.db2.gz XYOLYVFKEDXIFH-HKUYNNGSSA-N 1 3 331.504 2.868 10 0 EFAEHO CC(C)N(CCN(C)[C@@H](C)c1ccccc1)C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001423584161 1382116369 /nfs/dbraw/zinc/11/63/69/1382116369.db2.gz XYOLYVFKEDXIFH-HKUYNNGSSA-N 1 3 331.504 2.868 10 0 EFAEHO CC(C)N(CCN(C)[C@H](C)c1ccccc1)C(=O)[C@@H]1CC[N@H+](C)C1 ZINC001423584163 1382117052 /nfs/dbraw/zinc/11/70/52/1382117052.db2.gz XYOLYVFKEDXIFH-IEBWSBKVSA-N 1 3 331.504 2.868 10 0 EFAEHO CC(C)N(CCN(C)[C@H](C)c1ccccc1)C(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001423584163 1382117057 /nfs/dbraw/zinc/11/70/57/1382117057.db2.gz XYOLYVFKEDXIFH-IEBWSBKVSA-N 1 3 331.504 2.868 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@]1(C)CC[N@H+](Cc2ccccc2C)C1 ZINC001423590195 1382127159 /nfs/dbraw/zinc/12/71/59/1382127159.db2.gz ZDNMSUDUPQYWGG-QUCCMNQESA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@]1(C)CC[N@@H+](Cc2ccccc2C)C1 ZINC001423590195 1382127161 /nfs/dbraw/zinc/12/71/61/1382127161.db2.gz ZDNMSUDUPQYWGG-QUCCMNQESA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@]1(C)CC[N@H+](Cc2ccccc2C)C1 ZINC001423590191 1382127710 /nfs/dbraw/zinc/12/77/10/1382127710.db2.gz ZDNMSUDUPQYWGG-AZUAARDMSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@]1(C)CC[N@@H+](Cc2ccccc2C)C1 ZINC001423590191 1382127711 /nfs/dbraw/zinc/12/77/11/1382127711.db2.gz ZDNMSUDUPQYWGG-AZUAARDMSA-N 1 3 349.494 2.756 10 0 EFAEHO CC(C)(C)[C@H](C[NH2+]CC1CC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001423606694 1382155748 /nfs/dbraw/zinc/15/57/48/1382155748.db2.gz NNAPFVUMSHMIJO-KXBFYZLASA-N 1 3 341.515 2.729 10 0 EFAEHO CC[C@H](F)CN1CCC([C@@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)CC1 ZINC001423656683 1382236317 /nfs/dbraw/zinc/23/63/17/1382236317.db2.gz MZPQSWDUWRIGTP-WBVHZDCISA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001423709938 1382334924 /nfs/dbraw/zinc/33/49/24/1382334924.db2.gz YDTVSQFUTCSCIG-UHFFFAOYSA-N 1 3 343.515 2.888 10 0 EFAEHO CN(CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CCC1CC1)C2)CC(C)(C)C ZINC001423928972 1382510135 /nfs/dbraw/zinc/51/01/35/1382510135.db2.gz YOSPOAMBLUOYTI-KSZLIROESA-N 1 3 335.536 2.734 10 0 EFAEHO CN(CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CCC1CC1)C2)CC(C)(C)C ZINC001423928972 1382510138 /nfs/dbraw/zinc/51/01/38/1382510138.db2.gz YOSPOAMBLUOYTI-KSZLIROESA-N 1 3 335.536 2.734 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001423952903 1382541260 /nfs/dbraw/zinc/54/12/60/1382541260.db2.gz YFYPHWKYJTVMNF-ICSRJNTNSA-N 1 3 345.531 2.828 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](C)[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001423954592 1382543411 /nfs/dbraw/zinc/54/34/11/1382543411.db2.gz NETNTKJSIYWQQJ-MOPGFXCFSA-N 1 3 345.531 2.970 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[N@H+](C)CC[C@@H](C)F)CC1)N(C)C ZINC001438763992 1388793578 /nfs/dbraw/zinc/79/35/78/1388793578.db2.gz KXGYXNIBAOUBIS-NVXWUHKLSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[N@@H+](C)CC[C@@H](C)F)CC1)N(C)C ZINC001438763992 1388793580 /nfs/dbraw/zinc/79/35/80/1388793580.db2.gz KXGYXNIBAOUBIS-NVXWUHKLSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[N@H+](C)CC[C@H](C)F)CC1)N(C)C ZINC001438763989 1388793596 /nfs/dbraw/zinc/79/35/96/1388793596.db2.gz KXGYXNIBAOUBIS-DOTOQJQBSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[N@@H+](C)CC[C@H](C)F)CC1)N(C)C ZINC001438763989 1388793600 /nfs/dbraw/zinc/79/36/00/1388793600.db2.gz KXGYXNIBAOUBIS-DOTOQJQBSA-N 1 3 329.504 2.635 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001438775994 1388805834 /nfs/dbraw/zinc/80/58/34/1388805834.db2.gz XAXLCKLETBIQRY-APWZRJJASA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001438776001 1388806278 /nfs/dbraw/zinc/80/62/78/1388806278.db2.gz XAXLCKLETBIQRY-LPHOPBHVSA-N 1 3 349.494 2.801 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC(CC[N@H+](C)CC[C@@H](C)F)CC1)N(C)C ZINC001438779152 1388808581 /nfs/dbraw/zinc/80/85/81/1388808581.db2.gz PYRZSUMWKSHHMX-SJLPKXTDSA-N 1 3 343.531 2.881 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC(CC[N@@H+](C)CC[C@@H](C)F)CC1)N(C)C ZINC001438779152 1388808586 /nfs/dbraw/zinc/80/85/86/1388808586.db2.gz PYRZSUMWKSHHMX-SJLPKXTDSA-N 1 3 343.531 2.881 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]CC2CCC(F)(F)CC2)CCC1 ZINC001424210522 1382868053 /nfs/dbraw/zinc/86/80/53/1382868053.db2.gz HWWVIWNMFDOMDL-UHFFFAOYSA-N 1 3 345.478 2.781 10 0 EFAEHO CN(CCC[N@H+](C)[C@@H]1CCc2ccccc21)C(=O)[C@H]1CCCN1C ZINC001424272581 1382915026 /nfs/dbraw/zinc/91/50/26/1382915026.db2.gz GVHHXHJPLMUQOI-RTBURBONSA-N 1 3 329.488 2.548 10 0 EFAEHO CN(CCC[N@@H+](C)[C@@H]1CCc2ccccc21)C(=O)[C@H]1CCCN1C ZINC001424272581 1382915029 /nfs/dbraw/zinc/91/50/29/1382915029.db2.gz GVHHXHJPLMUQOI-RTBURBONSA-N 1 3 329.488 2.548 10 0 EFAEHO CCCN1Cc2ccccc2C[C@@H]1CNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001424395258 1382983650 /nfs/dbraw/zinc/98/36/50/1382983650.db2.gz PALOCVFHXQUTKH-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO CCCN1Cc2ccccc2C[C@@H]1CNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001424395258 1382983655 /nfs/dbraw/zinc/98/36/55/1382983655.db2.gz PALOCVFHXQUTKH-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@H](CNC(=O)C(C)(C)N1CCCCC1)C(C)C ZINC001438812644 1388836444 /nfs/dbraw/zinc/83/64/44/1388836444.db2.gz OCEVIXIRYUOILM-HZPDHXFCSA-N 1 3 329.504 2.729 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)C[C@H]2CCCN2C(=O)CN2CCCC2)cc1 ZINC001424701949 1383273664 /nfs/dbraw/zinc/27/36/64/1383273664.db2.gz SKCUAIIODVRTNZ-HXUWFJFHSA-N 1 3 343.515 2.556 10 0 EFAEHO Cc1ccc(CC[N@H+](C)C[C@H]2CCCN2C(=O)CN2CCCC2)cc1 ZINC001424701949 1383273669 /nfs/dbraw/zinc/27/36/69/1383273669.db2.gz SKCUAIIODVRTNZ-HXUWFJFHSA-N 1 3 343.515 2.556 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]CC1CCCC1 ZINC001438829406 1388845908 /nfs/dbraw/zinc/84/59/08/1388845908.db2.gz OYABZSVOXRHKPR-KRWDZBQOSA-N 1 3 325.541 2.885 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2ccc(C)cc2C)C1)N(C)C ZINC001424748472 1383316740 /nfs/dbraw/zinc/31/67/40/1383316740.db2.gz HZFDTCFMXOUTRL-NKELODKYSA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)[C@H](CNC(=O)CC[NH+](C)C)NCc1cccc(Cl)c1F ZINC001438830178 1388846772 /nfs/dbraw/zinc/84/67/72/1388846772.db2.gz NQPRRNIQUMPPET-HNNXBMFYSA-N 1 3 343.874 2.661 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)[C@H](C)NC(=O)CCC[NH+]2CCCC2)c1 ZINC001424845052 1383407906 /nfs/dbraw/zinc/40/79/06/1383407906.db2.gz BMQLWMNEDDRSLL-IRXDYDNUSA-N 1 3 349.494 2.993 10 0 EFAEHO C[C@@H](NCc1ccccc1F)[C@H](C)NC(=O)CC[NH+]1CCCCC1 ZINC001424852404 1383419194 /nfs/dbraw/zinc/41/91/94/1383419194.db2.gz JCHTWSRXSQMXJX-CVEARBPZSA-N 1 3 335.467 2.685 10 0 EFAEHO C[C@@H](NC(=O)CC[NH+]1CCCCC1)[C@H](C)NCc1ccccc1F ZINC001424852431 1383419374 /nfs/dbraw/zinc/41/93/74/1383419374.db2.gz JCHTWSRXSQMXJX-JKSUJKDBSA-N 1 3 335.467 2.685 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C2CCC([NH2+]CCC(F)(F)F)CC2)C1 ZINC001424854833 1383424300 /nfs/dbraw/zinc/42/43/00/1383424300.db2.gz PYDLINQQMCIQHN-NFOMZHRRSA-N 1 3 349.441 2.640 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[N@H+](C)CCCc1ccccc1 ZINC001424937298 1383492742 /nfs/dbraw/zinc/49/27/42/1383492742.db2.gz JBQJNXRWAWEFDD-AZUAARDMSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[N@@H+](C)CCCc1ccccc1 ZINC001424937298 1383492747 /nfs/dbraw/zinc/49/27/47/1383492747.db2.gz JBQJNXRWAWEFDD-AZUAARDMSA-N 1 3 345.531 2.929 10 0 EFAEHO Cc1ccc(CN2CCCCC[C@@H]2CNC(=O)CC[NH+](C)C)cc1F ZINC001425192024 1383535644 /nfs/dbraw/zinc/53/56/44/1383535644.db2.gz IKEDZBIJQIFKAO-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CCCc1ccc(CN2CC([C@H](C)NC(=O)CC[NH+](C)C)C2)cc1 ZINC001425265111 1383580221 /nfs/dbraw/zinc/58/02/21/1383580221.db2.gz ZCQXVPNQJBINRQ-INIZCTEOSA-N 1 3 331.504 2.527 10 0 EFAEHO Cc1cccc(CCC[NH+]2CC([C@@H](C)NC(=O)CN(C)C(C)C)C2)c1 ZINC001425265741 1383581317 /nfs/dbraw/zinc/58/13/17/1383581317.db2.gz PNYIHCPCEGGXEB-GOSISDBHSA-N 1 3 345.531 2.704 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@@H]2CN(CCCF)CC2(C)C)CCCCC1 ZINC001425289525 1383593711 /nfs/dbraw/zinc/59/37/11/1383593711.db2.gz KQHUBBOTUJARIP-MRXNPFEDSA-N 1 3 341.515 2.685 10 0 EFAEHO CC[C@H](C(=O)N1C[C@]2(C)C[N@H+](CCCC(C)C)C[C@]2(C)C1)N(C)C ZINC001425376541 1383637220 /nfs/dbraw/zinc/63/72/20/1383637220.db2.gz JFSXLBMVKDHWAN-RLLQIKCJSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@H](C(=O)N1C[C@]2(C)C[N@@H+](CCCC(C)C)C[C@]2(C)C1)N(C)C ZINC001425376541 1383637222 /nfs/dbraw/zinc/63/72/22/1383637222.db2.gz JFSXLBMVKDHWAN-RLLQIKCJSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H]2CCc3c2cccc3F)C1)N(C)C ZINC001425415452 1383651638 /nfs/dbraw/zinc/65/16/38/1383651638.db2.gz BBKQOHYBJXFEBG-OHHBCXFOSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H]2CCc3c2cccc3F)C1)N(C)C ZINC001425415450 1383651995 /nfs/dbraw/zinc/65/19/95/1383651995.db2.gz BBKQOHYBJXFEBG-LSOMNZGLSA-N 1 3 347.478 2.638 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2cc(C)ccc2C)C1 ZINC001425424709 1383655634 /nfs/dbraw/zinc/65/56/34/1383655634.db2.gz RGXFVHKCXSLUAP-UAPYVXQJSA-N 1 3 331.504 2.630 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C[C@@H](C)NCc1cc(C)ccc1F ZINC001425557934 1383690962 /nfs/dbraw/zinc/69/09/62/1383690962.db2.gz LIKXMTBWYDWZNC-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N(C)C[C@@H](C)NCc1cc(C)ccc1F ZINC001425557934 1383690964 /nfs/dbraw/zinc/69/09/64/1383690964.db2.gz LIKXMTBWYDWZNC-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]CC1CCC(C)(C)CC1 ZINC001425690608 1383767919 /nfs/dbraw/zinc/76/79/19/1383767919.db2.gz DKEUKMMXSMYPQX-MRXNPFEDSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@H](C)N(C(=O)CCC[NH+](C)C)C2)c1 ZINC001425886967 1383828995 /nfs/dbraw/zinc/82/89/95/1383828995.db2.gz CRQRXXPIEPVFPV-RDJZCZTQSA-N 1 3 335.467 2.555 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]C/C=C\c2ccccc2)[C@H]1C ZINC001425897799 1383836923 /nfs/dbraw/zinc/83/69/23/1383836923.db2.gz PBQFJWSMJBJMRM-RWERQFNSSA-N 1 3 329.488 2.619 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@]23CCC[C@@H]2N(Cc2ccsc2)CC3)CC1 ZINC001425904485 1383842250 /nfs/dbraw/zinc/84/22/50/1383842250.db2.gz JPOSXGCKVCTXSZ-LPHOPBHVSA-N 1 3 347.528 2.703 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2c(C)cccc2C)CC[N@@H+]1C ZINC001438874447 1388883183 /nfs/dbraw/zinc/88/31/83/1388883183.db2.gz QSTBNPPTAMCOQT-AZUAARDMSA-N 1 3 345.531 2.924 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2c(C)cccc2C)CC[N@H+]1C ZINC001438874447 1388883188 /nfs/dbraw/zinc/88/31/88/1388883188.db2.gz QSTBNPPTAMCOQT-AZUAARDMSA-N 1 3 345.531 2.924 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc(C2CC2)cc1 ZINC001425921795 1383857451 /nfs/dbraw/zinc/85/74/51/1383857451.db2.gz DZDFAWDAPIDOFT-UZLBHIALSA-N 1 3 343.515 2.985 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CC([NH2+]C[C@H]2CCCC(F)(F)C2)C1 ZINC001426241437 1384090546 /nfs/dbraw/zinc/09/05/46/1384090546.db2.gz XXLDHRLZKXNEIK-FHERZECASA-N 1 3 345.478 2.733 10 0 EFAEHO CN(CCN(C)[C@@H]1CCCc2ccc(F)cc21)C(=O)CC[NH+](C)C ZINC001438903166 1388905733 /nfs/dbraw/zinc/90/57/33/1388905733.db2.gz FKOATSWMRPSCDG-GOSISDBHSA-N 1 3 335.467 2.545 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@@H]1CCC[C@H]1NC(=O)CN(C)C(C)C ZINC001438961391 1388954561 /nfs/dbraw/zinc/95/45/61/1388954561.db2.gz LUOHXXIKXJNHES-VQTJNVASSA-N 1 3 345.531 2.964 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H]2CCC[C@H]2NC(=O)CN(C)C(C)C)c1 ZINC001438966177 1388956040 /nfs/dbraw/zinc/95/60/40/1388956040.db2.gz REQAAPPGECDLSM-VQIMIIECSA-N 1 3 349.494 2.849 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CN(Cc2ccc(CF)cc2)CC1(C)C ZINC001506753897 1406259126 /nfs/dbraw/zinc/25/91/26/1406259126.db2.gz WXVNJCPIVUXYTJ-SFHVURJKSA-N 1 3 349.494 2.825 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CN(Cc2ccc(CF)cc2)CC1(C)C ZINC001506753897 1406259130 /nfs/dbraw/zinc/25/91/30/1406259130.db2.gz WXVNJCPIVUXYTJ-SFHVURJKSA-N 1 3 349.494 2.825 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)N3CCN(C)C4(CCCCC4)C3)C[N@@H+]2C1 ZINC001434006508 1387053775 /nfs/dbraw/zinc/05/37/75/1387053775.db2.gz JLZNPMTYIPWUAZ-KURKYZTESA-N 1 3 333.520 2.584 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)N3CCN(C)C4(CCCCC4)C3)C[N@H+]2C1 ZINC001434006508 1387053784 /nfs/dbraw/zinc/05/37/84/1387053784.db2.gz JLZNPMTYIPWUAZ-KURKYZTESA-N 1 3 333.520 2.584 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccsc1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001439152252 1389017158 /nfs/dbraw/zinc/01/71/58/1389017158.db2.gz HLHOCRXMPUJWQN-CXAGYDPISA-N 1 3 341.496 2.555 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C[NH2+]Cc1cc2ccccc2s1 ZINC001439173138 1389030623 /nfs/dbraw/zinc/03/06/23/1389030623.db2.gz FQUGYARNLYIKQZ-CQSZACIVSA-N 1 3 333.501 2.837 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001439251422 1389074122 /nfs/dbraw/zinc/07/41/22/1389074122.db2.gz FPVNQWCFGSYOSN-JXFKEZNVSA-N 1 3 349.494 2.802 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC001439256776 1389077279 /nfs/dbraw/zinc/07/72/79/1389077279.db2.gz VYYINUXHFCLAKP-OXJNMPFZSA-N 1 3 349.494 2.802 10 0 EFAEHO C[C@@H](C[N@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)CN(C)C1CCC1 ZINC001439335386 1389156941 /nfs/dbraw/zinc/15/69/41/1389156941.db2.gz ZONBMIGAXWRTDJ-INIZCTEOSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H](C[N@@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)CN(C)C1CCC1 ZINC001439335386 1389156950 /nfs/dbraw/zinc/15/69/50/1389156950.db2.gz ZONBMIGAXWRTDJ-INIZCTEOSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001439403121 1389248963 /nfs/dbraw/zinc/24/89/63/1389248963.db2.gz SCNFRGXPDZEQQX-WMZOPIPTSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001439403121 1389248966 /nfs/dbraw/zinc/24/89/66/1389248966.db2.gz SCNFRGXPDZEQQX-WMZOPIPTSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC001439403321 1389249845 /nfs/dbraw/zinc/24/98/45/1389249845.db2.gz GKWWNHOWSGALTJ-KSSFIOAISA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC001439403321 1389249848 /nfs/dbraw/zinc/24/98/48/1389249848.db2.gz GKWWNHOWSGALTJ-KSSFIOAISA-N 1 3 335.467 2.590 10 0 EFAEHO CCCCC[N@@H+]1C[C@@]2(C)CN(C(=O)[C@H](C(C)C)N(C)C)C[C@@]2(C)C1 ZINC001506863656 1406367019 /nfs/dbraw/zinc/36/70/19/1406367019.db2.gz JJAGDLLLIMXVBK-YSIASYRMSA-N 1 3 337.552 2.933 10 0 EFAEHO CCCCC[N@H+]1C[C@@]2(C)CN(C(=O)[C@H](C(C)C)N(C)C)C[C@@]2(C)C1 ZINC001506863656 1406367027 /nfs/dbraw/zinc/36/70/27/1406367027.db2.gz JJAGDLLLIMXVBK-YSIASYRMSA-N 1 3 337.552 2.933 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)NC[C@H]1CCN1[C@H]1CCc2ccccc21 ZINC001439576732 1389324410 /nfs/dbraw/zinc/32/44/10/1389324410.db2.gz YWKTZAJTRFOQSH-QUCCMNQESA-N 1 3 341.499 2.740 10 0 EFAEHO Cc1cc(F)ccc1CN1CCC(C)(NC(=O)CC[NH+](C)C)CC1 ZINC001439802649 1389332337 /nfs/dbraw/zinc/33/23/37/1389332337.db2.gz GABYLEUNSXIKQN-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]CC[C@H]2CCN(C(=O)CN3CCCC3)C2)c1 ZINC001440224323 1389454032 /nfs/dbraw/zinc/45/40/32/1389454032.db2.gz YGOZKGKJZSIROS-MOPGFXCFSA-N 1 3 343.515 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CC[NH+](Cc1ccsc1)CC2 ZINC001440245391 1389471617 /nfs/dbraw/zinc/47/16/17/1389471617.db2.gz WTPIGJNYXNLYIF-UHFFFAOYSA-N 1 3 335.517 2.513 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]Cc2ccccc2)CCC1 ZINC001440350482 1389556283 /nfs/dbraw/zinc/55/62/83/1389556283.db2.gz DIMYPQVDAGTFKG-CALCHBBNSA-N 1 3 329.488 2.688 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)CC1 ZINC001440402830 1389601071 /nfs/dbraw/zinc/60/10/71/1389601071.db2.gz LOKGJKITZRSEQC-ICSRJNTNSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@H+]([C@H]2CCc3ccccc32)CC1 ZINC001440402830 1389601074 /nfs/dbraw/zinc/60/10/74/1389601074.db2.gz LOKGJKITZRSEQC-ICSRJNTNSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[N@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001440463457 1389664511 /nfs/dbraw/zinc/66/45/11/1389664511.db2.gz HEQKCMLBNVVCHV-CVEARBPZSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[N@@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001440463457 1389664514 /nfs/dbraw/zinc/66/45/14/1389664514.db2.gz HEQKCMLBNVVCHV-CVEARBPZSA-N 1 3 345.478 2.544 10 0 EFAEHO CN(CC(=O)N1CCCCC[C@H]([NH2+]C/C=C\Cl)C1)C1CCC1 ZINC001440465640 1389668364 /nfs/dbraw/zinc/66/83/64/1389668364.db2.gz UVVKGRJDNWNJKK-MLBQELRYSA-N 1 3 327.900 2.584 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CCC[NH+](C)C)CCN1C/C=C/c1ccccc1 ZINC001440499184 1389701606 /nfs/dbraw/zinc/70/16/06/1389701606.db2.gz QHAUFYJGTLNKIJ-QWRNQZPISA-N 1 3 329.488 2.621 10 0 EFAEHO CCC1([NH2+]CCC(F)(F)F)CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001440519940 1389722604 /nfs/dbraw/zinc/72/26/04/1389722604.db2.gz ZQZCTUZWSCWBGY-UHFFFAOYSA-N 1 3 349.441 2.784 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CC2CC(C)C2)CC(C)(C)C1 ZINC001440526575 1389728992 /nfs/dbraw/zinc/72/89/92/1389728992.db2.gz FUSUHQWIPKOXEX-DAWZGUTISA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CC2CC(C)C2)CC(C)(C)C1 ZINC001440526575 1389728997 /nfs/dbraw/zinc/72/89/97/1389728997.db2.gz FUSUHQWIPKOXEX-DAWZGUTISA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N1CCc2ccccc2[C@@H]1CNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001440688923 1389818644 /nfs/dbraw/zinc/81/86/44/1389818644.db2.gz LBUYRWWGOWPGHL-ICSRJNTNSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N1CCc2ccccc2[C@@H]1CNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001440688923 1389818650 /nfs/dbraw/zinc/81/86/50/1389818650.db2.gz LBUYRWWGOWPGHL-ICSRJNTNSA-N 1 3 343.515 2.985 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@H]2CCCc3ccccc32)C1 ZINC001440758950 1389873783 /nfs/dbraw/zinc/87/37/83/1389873783.db2.gz CSTUCKLGUUXXRF-NLPFYKDJSA-N 1 3 343.515 2.890 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)C1 ZINC001506886634 1406404822 /nfs/dbraw/zinc/40/48/22/1406404822.db2.gz NXYBQLADSXFZNK-RZDIXWSQSA-N 1 3 347.478 2.603 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC2CC(CNC/C(Cl)=C\Cl)C2)CC1 ZINC001440760747 1389875774 /nfs/dbraw/zinc/87/57/74/1389875774.db2.gz SVXIMUCVLSQYAA-NTEUORMPSA-N 1 3 348.318 2.522 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001440763294 1389876644 /nfs/dbraw/zinc/87/66/44/1389876644.db2.gz ODCIPDKUQODPES-UHFFFAOYSA-N 1 3 343.515 2.889 10 0 EFAEHO CN(CC(=O)NC1CC(C[NH2+]CC2CC(C)(C)C2)C1)CC(C)(C)C ZINC001440763972 1389877542 /nfs/dbraw/zinc/87/75/42/1389877542.db2.gz IUBDRBHIGSLFML-UHFFFAOYSA-N 1 3 337.552 2.885 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H](C)[NH2+]CC1CCC(C)(C)CC1 ZINC001440831724 1389932394 /nfs/dbraw/zinc/93/23/94/1389932394.db2.gz ACMOMNIIMVSPPE-KBPBESRZSA-N 1 3 334.508 2.960 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1cccc2cccnc21 ZINC001440846627 1389946605 /nfs/dbraw/zinc/94/66/05/1389946605.db2.gz GOQZWKXBJINQEA-CVEARBPZSA-N 1 3 342.487 2.559 10 0 EFAEHO CC[C@@H]([NH2+]C[C@H]1C[C@H](NC(=O)CN2CC[C@@H](C)C2)C1)c1ccccc1 ZINC001506897062 1406414586 /nfs/dbraw/zinc/41/45/86/1406414586.db2.gz IMTYIMSZJAIXHK-HNBVOPMISA-N 1 3 343.515 2.964 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H](C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1)CC(C)(C)C ZINC001506897347 1406414975 /nfs/dbraw/zinc/41/49/75/1406414975.db2.gz MMVUAABGWAMNSI-IEWDOMPSSA-N 1 3 349.563 2.885 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@H](C)[N@H+](C)CC1CC(F)(F)C1 ZINC001440973015 1390065186 /nfs/dbraw/zinc/06/51/86/1390065186.db2.gz HHNPNIULFYFODB-GDBMZVCRSA-N 1 3 345.478 2.731 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@H](C)[N@@H+](C)CC1CC(F)(F)C1 ZINC001440973015 1390065193 /nfs/dbraw/zinc/06/51/93/1390065193.db2.gz HHNPNIULFYFODB-GDBMZVCRSA-N 1 3 345.478 2.731 10 0 EFAEHO Cc1cc(C)cc(C[N@H+](C)[C@H](C)CNC(=O)CN2CC[C@H](C)C2)c1 ZINC001440974232 1390066424 /nfs/dbraw/zinc/06/64/24/1390066424.db2.gz SXSRWFFPEYJJKS-MAUKXSAKSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+](C)[C@H](C)CNC(=O)CN2CC[C@H](C)C2)c1 ZINC001440974232 1390066418 /nfs/dbraw/zinc/06/64/18/1390066418.db2.gz SXSRWFFPEYJJKS-MAUKXSAKSA-N 1 3 331.504 2.582 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC[NH+]([C@@H]2CCc3ccccc32)CC1 ZINC001441008581 1391029285 /nfs/dbraw/zinc/02/92/85/1391029285.db2.gz GHNQDAPSGQTERJ-HXUWFJFHSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccccc1 ZINC001441078966 1391073470 /nfs/dbraw/zinc/07/34/70/1391073470.db2.gz HLEIZZWGIYQMOU-QUCCMNQESA-N 1 3 345.531 2.991 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@H]2CCCCCN2CCC(F)(F)F)C1 ZINC001441143642 1391140935 /nfs/dbraw/zinc/14/09/35/1391140935.db2.gz ZLTSFYDICSEMGB-HUUCEWRRSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@H]2CCCCCN2CCC(F)(F)F)C1 ZINC001441143642 1391140939 /nfs/dbraw/zinc/14/09/39/1391140939.db2.gz ZLTSFYDICSEMGB-HUUCEWRRSA-N 1 3 349.441 2.641 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+][C@@H]1CCc2ccccc21 ZINC001506947441 1406484104 /nfs/dbraw/zinc/48/41/04/1406484104.db2.gz YPAABMTYNWPOMA-RDTXWAMCSA-N 1 3 340.471 2.823 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C1CN(Cc2ccccc2)C1)[NH+]1CCCC1 ZINC001441215311 1391187788 /nfs/dbraw/zinc/18/77/88/1391187788.db2.gz UAOBCOZPBHFYSX-YLJYHZDGSA-N 1 3 343.515 2.744 10 0 EFAEHO CCc1cccc(CN2C[C@@H](NC(=O)CC[NH+](C)C)C(C)(C)C2)c1 ZINC001441249373 1391209100 /nfs/dbraw/zinc/20/91/00/1391209100.db2.gz GQTRNDJVKZWZKV-GOSISDBHSA-N 1 3 331.504 2.527 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001441262920 1391217588 /nfs/dbraw/zinc/21/75/88/1391217588.db2.gz CZBWJXVGJPCNKC-LDLYASANSA-N 1 3 349.563 2.981 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001441262920 1391217592 /nfs/dbraw/zinc/21/75/92/1391217592.db2.gz CZBWJXVGJPCNKC-LDLYASANSA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@@H](c1ccccc1Cl)N1C[C@@H]2[C@@H](CNC(=O)CC[NH+](C)C)[C@@H]2C1 ZINC001441281962 1391230932 /nfs/dbraw/zinc/23/09/32/1391230932.db2.gz NRDXIAXQOVFMEU-QSPRXWTASA-N 1 3 349.906 2.647 10 0 EFAEHO CN(CCF)C[C@H]1CCCN(C(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001441296991 1391240060 /nfs/dbraw/zinc/24/00/60/1391240060.db2.gz VNYMIJULUXWIFE-MRXNPFEDSA-N 1 3 341.515 2.779 10 0 EFAEHO CN(CCF)C[C@H]1CCCN(C(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001441296991 1391240062 /nfs/dbraw/zinc/24/00/62/1391240062.db2.gz VNYMIJULUXWIFE-MRXNPFEDSA-N 1 3 341.515 2.779 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C[NH2+]Cc1ccsc1)C1CC1 ZINC001441456743 1391321749 /nfs/dbraw/zinc/32/17/49/1391321749.db2.gz BATAJBVUUPMCNU-QZTJIDSGSA-N 1 3 349.544 2.949 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C)cc2Cl)C1 ZINC001441522945 1391350887 /nfs/dbraw/zinc/35/08/87/1391350887.db2.gz UCEZICWUFLFBBW-IYBDPMFKSA-N 1 3 337.895 2.727 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001441537460 1391353932 /nfs/dbraw/zinc/35/39/32/1391353932.db2.gz LXKBAGVFXDIKOH-WMZOPIPTSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001441537460 1391353937 /nfs/dbraw/zinc/35/39/37/1391353937.db2.gz LXKBAGVFXDIKOH-WMZOPIPTSA-N 1 3 349.494 2.945 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001441849372 1391423857 /nfs/dbraw/zinc/42/38/57/1391423857.db2.gz LTTXEINDTOEINS-LPHOPBHVSA-N 1 3 331.504 2.716 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)C1CCN(Cc2cccc(F)c2)CC1 ZINC001442204583 1391444271 /nfs/dbraw/zinc/44/42/71/1391444271.db2.gz OLPSYIGWPOMLCY-MRXNPFEDSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)C1CCN(Cc2cccc(F)c2)CC1 ZINC001442204583 1391444273 /nfs/dbraw/zinc/44/42/73/1391444273.db2.gz OLPSYIGWPOMLCY-MRXNPFEDSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(Cl)s1 ZINC001443980590 1391455507 /nfs/dbraw/zinc/45/55/07/1391455507.db2.gz JPTKULKVOKPNCX-CHWSQXEVSA-N 1 3 343.924 2.728 10 0 EFAEHO C[C@@H](C[NH2+][C@@H]1CCc2ccccc21)N(C)C(=O)C1(N(C)C)CCC1 ZINC001444619619 1391508800 /nfs/dbraw/zinc/50/88/00/1391508800.db2.gz BDZLUFQTHVOTIE-MAUKXSAKSA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001446943594 1391643082 /nfs/dbraw/zinc/64/30/82/1391643082.db2.gz UAEHDHPXVWCAHE-ICSRJNTNSA-N 1 3 345.531 2.828 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccsc1 ZINC001447045251 1391672693 /nfs/dbraw/zinc/67/26/93/1391672693.db2.gz SKHPYCBXNDMGKR-IAGOWNOFSA-N 1 3 335.517 2.655 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccsc1 ZINC001447045251 1391672696 /nfs/dbraw/zinc/67/26/96/1391672696.db2.gz SKHPYCBXNDMGKR-IAGOWNOFSA-N 1 3 335.517 2.655 10 0 EFAEHO CN(C/C=C\c1ccccc1)C[C@H]1CCCN1C(=O)[C@H]1CC[N@H+](C)C1 ZINC001447771913 1391757901 /nfs/dbraw/zinc/75/79/01/1391757901.db2.gz RKFUEYGRBNLDLE-ZHJYEMEWSA-N 1 3 341.499 2.574 10 0 EFAEHO CN(C/C=C\c1ccccc1)C[C@H]1CCCN1C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001447771913 1391757906 /nfs/dbraw/zinc/75/79/06/1391757906.db2.gz RKFUEYGRBNLDLE-ZHJYEMEWSA-N 1 3 341.499 2.574 10 0 EFAEHO C[C@H](NCc1cncs1)[C@H](C)NC(=O)c1ccc(C[NH+](C)C)cc1 ZINC001447888813 1391791200 /nfs/dbraw/zinc/79/12/00/1391791200.db2.gz BXZRAZOXCCYNTO-KBPBESRZSA-N 1 3 346.500 2.501 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C(C)C)c(C)c1 ZINC001447926093 1391818826 /nfs/dbraw/zinc/81/88/26/1391818826.db2.gz AWRZHGPHKYWFOV-QZTJIDSGSA-N 1 3 333.520 2.935 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H](C)[NH2+]CCc1ccccc1Cl ZINC001447927604 1391823251 /nfs/dbraw/zinc/82/32/51/1391823251.db2.gz VSDWMFFSPTUQIO-QWHCGFSZSA-N 1 3 348.878 2.640 10 0 EFAEHO CN(CC(C)(C)C[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1)C(=O)CN(C)C1CCC1 ZINC001447968770 1391864751 /nfs/dbraw/zinc/86/47/51/1391864751.db2.gz DEXOTZSPEWMHDJ-FGTMMUONSA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001448036544 1391907477 /nfs/dbraw/zinc/90/74/77/1391907477.db2.gz FIYWPEOHRZHPMD-MAUKXSAKSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001448036544 1391907482 /nfs/dbraw/zinc/90/74/82/1391907482.db2.gz FIYWPEOHRZHPMD-MAUKXSAKSA-N 1 3 329.488 2.595 10 0 EFAEHO COc1cccc(CN(C)[C@H](C)CNC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001448036976 1391908276 /nfs/dbraw/zinc/90/82/76/1391908276.db2.gz HWVPPJLXRGKVQF-AEFFLSMTSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1cccc(CN(C)[C@H](C)CNC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001448036976 1391908279 /nfs/dbraw/zinc/90/82/79/1391908279.db2.gz HWVPPJLXRGKVQF-AEFFLSMTSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[N@H+](C)[C@H]1CCc2ccccc21 ZINC001448069009 1391929496 /nfs/dbraw/zinc/92/94/96/1391929496.db2.gz JBLBZDHQLXWFDJ-LPHOPBHVSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001448069009 1391929498 /nfs/dbraw/zinc/92/94/98/1391929498.db2.gz JBLBZDHQLXWFDJ-LPHOPBHVSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C)C/C=C/c2ccccc2)CC1 ZINC001506977744 1406538080 /nfs/dbraw/zinc/53/80/80/1406538080.db2.gz LSRSRWIHTMYXQJ-DHZHZOJOSA-N 1 3 343.515 2.963 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C)C/C=C/c2ccccc2)CC1 ZINC001506977744 1406538085 /nfs/dbraw/zinc/53/80/85/1406538085.db2.gz LSRSRWIHTMYXQJ-DHZHZOJOSA-N 1 3 343.515 2.963 10 0 EFAEHO CCCC[C@H](CNCc1ccccc1F)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001448260687 1392057375 /nfs/dbraw/zinc/05/73/75/1392057375.db2.gz FGVJMPNQVQZLMN-KBAYOESNSA-N 1 3 349.494 2.931 10 0 EFAEHO CCCC[C@H](CNCc1ccccc1F)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001448260687 1392057383 /nfs/dbraw/zinc/05/73/83/1392057383.db2.gz FGVJMPNQVQZLMN-KBAYOESNSA-N 1 3 349.494 2.931 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001448437088 1392083831 /nfs/dbraw/zinc/08/38/31/1392083831.db2.gz LCGXTFVPBVKVGR-NNZMDNLPSA-N 1 3 335.536 2.591 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001448437088 1392083840 /nfs/dbraw/zinc/08/38/40/1392083840.db2.gz LCGXTFVPBVKVGR-NNZMDNLPSA-N 1 3 335.536 2.591 10 0 EFAEHO C[C@H]1C[C@H](NCc2ccsc2)CN1C(=O)CCC[NH+]1CCCC1 ZINC001449016926 1392208225 /nfs/dbraw/zinc/20/82/25/1392208225.db2.gz NLBVDIOKJIJOGC-RDJZCZTQSA-N 1 3 335.517 2.703 10 0 EFAEHO C[C@@H]1C[C@@H](NCc2ccsc2)CN1C(=O)CCC[NH+]1CCCC1 ZINC001449016925 1392208834 /nfs/dbraw/zinc/20/88/34/1392208834.db2.gz NLBVDIOKJIJOGC-NVXWUHKLSA-N 1 3 335.517 2.703 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H]1C[C@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001449022769 1392213575 /nfs/dbraw/zinc/21/35/75/1392213575.db2.gz RWTSRSCUJPMDMW-ROUUACIJSA-N 1 3 331.504 2.723 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@@H]1CN(C(=O)C(C)(C)N2CCCCC2)CC1(C)C ZINC001449065635 1392247641 /nfs/dbraw/zinc/24/76/41/1392247641.db2.gz XQVSIDPYBCLODZ-HZPDHXFCSA-N 1 3 341.515 2.826 10 0 EFAEHO CN(C)C[C@H](NC(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(F)cc1 ZINC001450711722 1392710978 /nfs/dbraw/zinc/71/09/78/1392710978.db2.gz WOFVRIKOANEYNL-NXHRZFHOSA-N 1 3 335.467 2.665 10 0 EFAEHO C[C@@H](CN(C)C(=O)CC[C@H]1CCC[N@@H+]1C)NCc1ccccc1F ZINC001507085839 1406683435 /nfs/dbraw/zinc/68/34/35/1406683435.db2.gz PJNNVDKMMYVEII-DOTOQJQBSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CN(C)C(=O)CC[C@H]1CCC[N@H+]1C)NCc1ccccc1F ZINC001507085839 1406683440 /nfs/dbraw/zinc/68/34/40/1406683440.db2.gz PJNNVDKMMYVEII-DOTOQJQBSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccccc1C1CC1 ZINC001507128946 1406742281 /nfs/dbraw/zinc/74/22/81/1406742281.db2.gz WGWGUKPPJPJGOY-DLBZAZTESA-N 1 3 343.515 2.842 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]CCc1ccc(C)cc1 ZINC001507163769 1406794449 /nfs/dbraw/zinc/79/44/49/1406794449.db2.gz VWPGZUIJHQOWIC-AZUAARDMSA-N 1 3 345.531 2.848 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]CCc1ccc(C)cc1 ZINC001507163772 1406794901 /nfs/dbraw/zinc/79/49/01/1406794901.db2.gz VWPGZUIJHQOWIC-ICSRJNTNSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)[C@](O)(CN1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC001459769489 1395981459 /nfs/dbraw/zinc/98/14/59/1395981459.db2.gz MUSWNQNTVJAFSV-HXUWFJFHSA-N 1 3 325.456 2.747 10 0 EFAEHO C[C@@H]1C[N@H+](C[Si](C)(C)c2ccccc2)CCN1c1ccncc1 ZINC001460709443 1396245350 /nfs/dbraw/zinc/24/53/50/1396245350.db2.gz NOHFAVJPRJJDNQ-QGZVFWFLSA-N 1 3 325.532 2.747 10 0 EFAEHO C[C@@H]1C[N@@H+](C[Si](C)(C)c2ccccc2)CCN1c1ccncc1 ZINC001460709443 1396245354 /nfs/dbraw/zinc/24/53/54/1396245354.db2.gz NOHFAVJPRJJDNQ-QGZVFWFLSA-N 1 3 325.532 2.747 10 0 EFAEHO C[N@@H+]1C[C@@]23CN(C[C@@H](O)CCc4ccccc4)C[C@]2(C1)CCCC3 ZINC001460978055 1396277839 /nfs/dbraw/zinc/27/78/39/1396277839.db2.gz SIBPXIYNJZKFSA-PCCBWWKXSA-N 1 3 328.500 2.788 10 0 EFAEHO C[N@H+]1C[C@@]23CN(C[C@@H](O)CCc4ccccc4)C[C@]2(C1)CCCC3 ZINC001460978055 1396277844 /nfs/dbraw/zinc/27/78/44/1396277844.db2.gz SIBPXIYNJZKFSA-PCCBWWKXSA-N 1 3 328.500 2.788 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1 ZINC001463809282 1396523056 /nfs/dbraw/zinc/52/30/56/1396523056.db2.gz JFAFGZPJVGVNOH-HXUWFJFHSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@H]1[C@H]([NH2+]Cc2ccsc2)CCN1C(=O)CN(C)CC(C)(C)C ZINC001507290378 1406855371 /nfs/dbraw/zinc/85/53/71/1406855371.db2.gz XXGSZVKZTNUKNJ-GOEBONIOSA-N 1 3 337.533 2.805 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)CCN1Cc1ccccc1 ZINC001468705926 1396980980 /nfs/dbraw/zinc/98/09/80/1396980980.db2.gz ZFXOBQQIONMYKB-VBSBHUPXSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)CCN1Cc1ccccc1 ZINC001468705926 1396980982 /nfs/dbraw/zinc/98/09/82/1396980982.db2.gz ZFXOBQQIONMYKB-VBSBHUPXSA-N 1 3 341.499 2.783 10 0 EFAEHO CCC1(CC)CCCN(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)C1 ZINC001470773900 1397120445 /nfs/dbraw/zinc/12/04/45/1397120445.db2.gz ZJHZNEVZQLHLTD-KRWDZBQOSA-N 1 3 340.556 2.870 10 0 EFAEHO CCC1(CC)CCCN(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)C1 ZINC001470773900 1397120451 /nfs/dbraw/zinc/12/04/51/1397120451.db2.gz ZJHZNEVZQLHLTD-KRWDZBQOSA-N 1 3 340.556 2.870 10 0 EFAEHO CC[NH+](CC)CC[C@H](NC(=O)N(C)CCN(C)C)c1ccccc1 ZINC001471586367 1397186302 /nfs/dbraw/zinc/18/63/02/1397186302.db2.gz HOATVMZFSUFNQO-SFHVURJKSA-N 1 3 334.508 2.663 10 0 EFAEHO C[C@@H](CN1CCOCC1)C[N@@H+]1CCC[C@H]1CCN1CCC(C)CC1 ZINC001473716713 1397324044 /nfs/dbraw/zinc/32/40/44/1397324044.db2.gz JSWUTNJOUDANPW-PMACEKPBSA-N 1 3 337.552 2.541 10 0 EFAEHO C[C@@H](CN1CCOCC1)C[N@H+]1CCC[C@H]1CCN1CCC(C)CC1 ZINC001473716713 1397324048 /nfs/dbraw/zinc/32/40/48/1397324048.db2.gz JSWUTNJOUDANPW-PMACEKPBSA-N 1 3 337.552 2.541 10 0 EFAEHO C[C@H]1CN(c2ccncc2)CC[N@@H+]1C[Si](C)(C)c1ccccc1 ZINC001473808906 1397335376 /nfs/dbraw/zinc/33/53/76/1397335376.db2.gz JCQXSYPRQJUTPV-KRWDZBQOSA-N 1 3 325.532 2.747 10 0 EFAEHO C[C@H]1CN(c2ccncc2)CC[N@H+]1C[Si](C)(C)c1ccccc1 ZINC001473808906 1397335380 /nfs/dbraw/zinc/33/53/80/1397335380.db2.gz JCQXSYPRQJUTPV-KRWDZBQOSA-N 1 3 325.532 2.747 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CC/C=C\c2ccccc2)CN1C(=O)CN1CCCC1 ZINC001507331119 1406895690 /nfs/dbraw/zinc/89/56/90/1406895690.db2.gz MOFBKMDGRIGGSI-KVKGCXCTSA-N 1 3 341.499 2.765 10 0 EFAEHO CN(C[C@H]1CC[N@@H+]1CCC1CCCC1)C(=O)C(C)(C)N1CCCC1 ZINC001479237058 1397631983 /nfs/dbraw/zinc/63/19/83/1397631983.db2.gz DGCMXMWDHNOLMW-GOSISDBHSA-N 1 3 335.536 2.974 10 0 EFAEHO CN(C[C@H]1CC[N@H+]1CCC1CCCC1)C(=O)C(C)(C)N1CCCC1 ZINC001479237058 1397631988 /nfs/dbraw/zinc/63/19/88/1397631988.db2.gz DGCMXMWDHNOLMW-GOSISDBHSA-N 1 3 335.536 2.974 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2C[C@@H](CNC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001479300748 1397672514 /nfs/dbraw/zinc/67/25/14/1397672514.db2.gz RFPQPCYBBXEQFA-WOVMCDHWSA-N 1 3 347.478 2.603 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2C[C@@H](CNC(=O)C(C)(C)N3CCCC3)C2)c1 ZINC001479316833 1397680831 /nfs/dbraw/zinc/68/08/31/1397680831.db2.gz WZMDEYRWVINCBE-KDURUIRLSA-N 1 3 343.515 2.854 10 0 EFAEHO CCN1C[C@@H](c2ccccc2)[C@H](NC(=O)CCCC[NH+]2CCCC2)C1 ZINC001479426893 1397723515 /nfs/dbraw/zinc/72/35/15/1397723515.db2.gz DJBGDFNQIJFHPH-VQTJNVASSA-N 1 3 343.515 2.857 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@@H]1CC[C@H](CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001479494598 1397736649 /nfs/dbraw/zinc/73/66/49/1397736649.db2.gz IUHTXCINWODITF-JTDSTZFVSA-N 1 3 349.494 2.984 10 0 EFAEHO C[C@H](c1ccc(F)cc1)[N@H+](C)CCCNC(=O)CN(C)C1CCC1 ZINC001479775587 1397841760 /nfs/dbraw/zinc/84/17/60/1397841760.db2.gz BLOWCTILPULNIW-OAHLLOKOSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@H](c1ccc(F)cc1)[N@@H+](C)CCCNC(=O)CN(C)C1CCC1 ZINC001479775587 1397841764 /nfs/dbraw/zinc/84/17/64/1397841764.db2.gz BLOWCTILPULNIW-OAHLLOKOSA-N 1 3 335.467 2.809 10 0 EFAEHO Cc1cccc([C@@H](C)[N@H+](C)CCCNC(=O)CN(C)C2CCC2)c1 ZINC001479775427 1397842643 /nfs/dbraw/zinc/84/26/43/1397842643.db2.gz AASQMUKQAYMFKB-QGZVFWFLSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1cccc([C@@H](C)[N@@H+](C)CCCNC(=O)CN(C)C2CCC2)c1 ZINC001479775427 1397842646 /nfs/dbraw/zinc/84/26/46/1397842646.db2.gz AASQMUKQAYMFKB-QGZVFWFLSA-N 1 3 331.504 2.978 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](C)Cc1ccc(C)cc1 ZINC001479816281 1397911900 /nfs/dbraw/zinc/91/19/00/1397911900.db2.gz SEGHFCIPKIRIJL-LJQANCHMSA-N 1 3 331.504 2.808 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](C)Cc1ccc(C)cc1 ZINC001479816281 1397911903 /nfs/dbraw/zinc/91/19/03/1397911903.db2.gz SEGHFCIPKIRIJL-LJQANCHMSA-N 1 3 331.504 2.808 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@H+](C)Cc1cc2ccccc2o1 ZINC001479816408 1397912069 /nfs/dbraw/zinc/91/20/69/1397912069.db2.gz UIOIKEKWTPTIBC-UHFFFAOYSA-N 1 3 331.460 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@@H+](C)Cc1cc2ccccc2o1 ZINC001479816408 1397912077 /nfs/dbraw/zinc/91/20/77/1397912077.db2.gz UIOIKEKWTPTIBC-UHFFFAOYSA-N 1 3 331.460 2.711 10 0 EFAEHO CC[N@H+](CCCNC(=O)C1(N(C)C)CCC1)Cc1ccc(C)c(F)c1 ZINC001479845900 1397944473 /nfs/dbraw/zinc/94/44/73/1397944473.db2.gz ZMULHFOXWFKCSF-UHFFFAOYSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[N@@H+](CCCNC(=O)C1(N(C)C)CCC1)Cc1ccc(C)c(F)c1 ZINC001479845900 1397944476 /nfs/dbraw/zinc/94/44/76/1397944476.db2.gz ZMULHFOXWFKCSF-UHFFFAOYSA-N 1 3 349.494 2.947 10 0 EFAEHO CCC[N@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001479876785 1397989830 /nfs/dbraw/zinc/98/98/30/1397989830.db2.gz VNSOOTPCIYWGPN-GOSISDBHSA-N 1 3 327.488 2.580 10 0 EFAEHO CCC[N@@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001479876785 1397989836 /nfs/dbraw/zinc/98/98/36/1397989836.db2.gz VNSOOTPCIYWGPN-GOSISDBHSA-N 1 3 327.488 2.580 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001480160602 1398133697 /nfs/dbraw/zinc/13/36/97/1398133697.db2.gz DLZIFYMUVSBKRB-XUXIUFHCSA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@H](NCC=C(Cl)Cl)C1)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001480160602 1398133700 /nfs/dbraw/zinc/13/37/00/1398133700.db2.gz DLZIFYMUVSBKRB-XUXIUFHCSA-N 1 3 346.302 2.559 10 0 EFAEHO C[C@@H](CNC(=O)[C@H](C)[NH+]1CCCCCC1)NCc1ccccc1F ZINC001480548823 1398202198 /nfs/dbraw/zinc/20/21/98/1398202198.db2.gz OOLSRTNJLGUOAY-HOTGVXAUSA-N 1 3 335.467 2.685 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001480548323 1398202593 /nfs/dbraw/zinc/20/25/93/1398202593.db2.gz JRXGPHTZZFWQSP-YJBOKZPZSA-N 1 3 335.467 2.683 10 0 EFAEHO CCC/C=C\CC[NH2+]C[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001480669422 1398273765 /nfs/dbraw/zinc/27/37/65/1398273765.db2.gz TZZWAEBJHYWSQL-SFFCAUCYSA-N 1 3 335.536 2.903 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001480679970 1398279003 /nfs/dbraw/zinc/27/90/03/1398279003.db2.gz FLMNOMOVSBCSSM-FUHWJXTLSA-N 1 3 331.504 2.846 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCC[C@@H](NC(=O)CN(C)C(C)C)C2)c(C)n1 ZINC001480710866 1398303492 /nfs/dbraw/zinc/30/34/92/1398303492.db2.gz UCVCGAMWWJMWHH-RBUKOAKNSA-N 1 3 346.519 2.556 10 0 EFAEHO CN(CC(=O)NCCC[C@@H]1CCC[N@@H+]1C/C=C\Cl)C1CCC1 ZINC001480826769 1398335457 /nfs/dbraw/zinc/33/54/57/1398335457.db2.gz SQEZXBKLEDVUDF-MGDKSHQASA-N 1 3 327.900 2.584 10 0 EFAEHO CN(CC(=O)NCCC[C@@H]1CCC[N@H+]1C/C=C\Cl)C1CCC1 ZINC001480826769 1398335465 /nfs/dbraw/zinc/33/54/65/1398335465.db2.gz SQEZXBKLEDVUDF-MGDKSHQASA-N 1 3 327.900 2.584 10 0 EFAEHO CC/C=C/CC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)CCC)C[C@H]21 ZINC001507361836 1406953419 /nfs/dbraw/zinc/95/34/19/1406953419.db2.gz DDJYSKAJBVPMFT-IOIJZZRGSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC[C@@H]2CCC[N@@H+]2CCC2CC2)C1 ZINC001493137960 1398474062 /nfs/dbraw/zinc/47/40/62/1398474062.db2.gz NHWDPHWWFNTUTC-LPHOPBHVSA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC[C@@H]2CCC[N@H+]2CCC2CC2)C1 ZINC001493137960 1398474066 /nfs/dbraw/zinc/47/40/66/1398474066.db2.gz NHWDPHWWFNTUTC-LPHOPBHVSA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC[C@H]2CCC[N@@H+]2CCC2CC2)C1 ZINC001493137959 1398474212 /nfs/dbraw/zinc/47/42/12/1398474212.db2.gz NHWDPHWWFNTUTC-APWZRJJASA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC[C@H]2CCC[N@H+]2CCC2CC2)C1 ZINC001493137959 1398474216 /nfs/dbraw/zinc/47/42/16/1398474216.db2.gz NHWDPHWWFNTUTC-APWZRJJASA-N 1 3 339.499 2.580 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[N@H+](CC3CCC(C)(C)CC3)C2)C1 ZINC001493240999 1398557063 /nfs/dbraw/zinc/55/70/63/1398557063.db2.gz YEWOLLLIQNKARR-PKOBYXMFSA-N 1 3 349.563 2.983 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[N@@H+](CC3CCC(C)(C)CC3)C2)C1 ZINC001493240999 1398557068 /nfs/dbraw/zinc/55/70/68/1398557068.db2.gz YEWOLLLIQNKARR-PKOBYXMFSA-N 1 3 349.563 2.983 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H]1CC[N@H+](CCCCCF)C1 ZINC001493242275 1398559134 /nfs/dbraw/zinc/55/91/34/1398559134.db2.gz ZKUODLBPKVRSMH-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H]1CC[N@@H+](CCCCCF)C1 ZINC001493242275 1398559137 /nfs/dbraw/zinc/55/91/37/1398559137.db2.gz ZKUODLBPKVRSMH-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1CC[C@@H](C)C1)[C@@H]1CCc2ccccc21 ZINC001493317820 1398609769 /nfs/dbraw/zinc/60/97/69/1398609769.db2.gz GZAWIRQURYAPIL-YLJYHZDGSA-N 1 3 343.515 2.844 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1CC[C@@H](C)C1)[C@@H]1CCc2ccccc21 ZINC001493317820 1398609774 /nfs/dbraw/zinc/60/97/74/1398609774.db2.gz GZAWIRQURYAPIL-YLJYHZDGSA-N 1 3 343.515 2.844 10 0 EFAEHO C[C@H](NCCN(C)C(=O)CC[C@H]1CCC[N@@H+]1C)c1ccccc1F ZINC001493583244 1398762435 /nfs/dbraw/zinc/76/24/35/1398762435.db2.gz GMUZQIVCJOFVKX-JKSUJKDBSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@H](NCCN(C)C(=O)CC[C@H]1CCC[N@H+]1C)c1ccccc1F ZINC001493583244 1398762439 /nfs/dbraw/zinc/76/24/39/1398762439.db2.gz GMUZQIVCJOFVKX-JKSUJKDBSA-N 1 3 335.467 2.809 10 0 EFAEHO CN(CCNC/C=C\Cl)C(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001493670508 1398797273 /nfs/dbraw/zinc/79/72/73/1398797273.db2.gz PUSCZJDKZRWTRE-CXSQMQJXSA-N 1 3 327.900 2.584 10 0 EFAEHO CN(CCNC/C=C\Cl)C(=O)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001493670508 1398797276 /nfs/dbraw/zinc/79/72/76/1398797276.db2.gz PUSCZJDKZRWTRE-CXSQMQJXSA-N 1 3 327.900 2.584 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]CCN(C)C(=O)CN(C)CC(C)(C)C ZINC001493695921 1398815014 /nfs/dbraw/zinc/81/50/14/1398815014.db2.gz NCAUITVHPYNCJV-UHFFFAOYSA-N 1 3 337.483 2.660 10 0 EFAEHO Cc1cccc(C[NH2+]CCN(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)c1 ZINC001493696035 1398815243 /nfs/dbraw/zinc/81/52/43/1398815243.db2.gz OEKZLORGEIYDEE-HXUWFJFHSA-N 1 3 349.494 2.756 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)[C@@H](C(C)C)[NH+]2CCCC2)c1 ZINC001493806839 1398896455 /nfs/dbraw/zinc/89/64/55/1398896455.db2.gz PXSXXSQOPPCRPQ-LJQANCHMSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](F)C[NH2+][C@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001493845412 1398918339 /nfs/dbraw/zinc/91/83/39/1398918339.db2.gz XOVXAZPNFYMVTM-AEFFLSMTSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CCCF)c1ccccc1 ZINC001493889657 1398956901 /nfs/dbraw/zinc/95/69/01/1398956901.db2.gz UXVMBXSSVOYYQF-MSOLQXFVSA-N 1 3 335.467 2.666 10 0 EFAEHO CCCN(C(=O)[C@@H](C)[NH+]1CCCCCC1)[C@H]1CCN(CCCF)C1 ZINC001493968556 1399019459 /nfs/dbraw/zinc/01/94/59/1399019459.db2.gz IYJZOVFAVLHBGI-MSOLQXFVSA-N 1 3 341.515 2.923 10 0 EFAEHO CCCN(C(=O)[C@@H](C)N1CCCCCC1)[C@H]1CC[N@H+](CCCF)C1 ZINC001493968556 1399019462 /nfs/dbraw/zinc/01/94/62/1399019462.db2.gz IYJZOVFAVLHBGI-MSOLQXFVSA-N 1 3 341.515 2.923 10 0 EFAEHO CCCN(C(=O)[C@@H](C)N1CCCCCC1)[C@H]1CC[N@@H+](CCCF)C1 ZINC001493968556 1399019465 /nfs/dbraw/zinc/01/94/65/1399019465.db2.gz IYJZOVFAVLHBGI-MSOLQXFVSA-N 1 3 341.515 2.923 10 0 EFAEHO O=C(NCC[C@H]1CCN(CCF)C1)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001494044326 1399085770 /nfs/dbraw/zinc/08/57/70/1399085770.db2.gz XRPFFFNKYCQIBS-FUHWJXTLSA-N 1 3 339.499 2.581 10 0 EFAEHO O=C(NCC[C@H]1CCN(CCF)C1)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001494044326 1399085774 /nfs/dbraw/zinc/08/57/74/1399085774.db2.gz XRPFFFNKYCQIBS-FUHWJXTLSA-N 1 3 339.499 2.581 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@@H](CCNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001494056833 1399097235 /nfs/dbraw/zinc/09/72/35/1399097235.db2.gz XZNZIWBUUDIBLY-RTBURBONSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@@H](CCNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001494056833 1399097237 /nfs/dbraw/zinc/09/72/37/1399097237.db2.gz XZNZIWBUUDIBLY-RTBURBONSA-N 1 3 343.515 2.665 10 0 EFAEHO C[N@H+](CCC1=CCCCC1)C[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001494180497 1399193175 /nfs/dbraw/zinc/19/31/75/1399193175.db2.gz LXIBZMUCGDXIIP-IBGZPJMESA-N 1 3 333.520 2.753 10 0 EFAEHO C[N@@H+](CCC1=CCCCC1)C[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001494180497 1399193181 /nfs/dbraw/zinc/19/31/81/1399193181.db2.gz LXIBZMUCGDXIIP-IBGZPJMESA-N 1 3 333.520 2.753 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@@H](C[NH2+]Cc2ccsc2)C1)C1CCC1 ZINC001507402254 1407014081 /nfs/dbraw/zinc/01/40/81/1407014081.db2.gz XCLSRDRGOGAEQW-GDBMZVCRSA-N 1 3 335.517 2.607 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[C@@H](C[NH2+]Cc2ccsc2)C1)C1CCC1 ZINC001507402261 1407014738 /nfs/dbraw/zinc/01/47/38/1407014738.db2.gz XCLSRDRGOGAEQW-ZBFHGGJFSA-N 1 3 335.517 2.607 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1C[NH+](CC2CCCCCC2)C1 ZINC001494633478 1399408145 /nfs/dbraw/zinc/40/81/45/1399408145.db2.gz QIDXRHBUPQRMKT-IAGOWNOFSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)NC1(C[NH2+]Cc2cc(C)ccc2F)CCCC1 ZINC001495205060 1399735517 /nfs/dbraw/zinc/73/55/17/1399735517.db2.gz RIAVTEKTMMDRQP-UHFFFAOYSA-N 1 3 349.494 2.995 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@](C)(NC(=O)CN2CC[C@@H](C)C2)C2CC2)c1 ZINC001495277851 1399787352 /nfs/dbraw/zinc/78/73/52/1399787352.db2.gz RIUFHDVHOOMBGF-UTKZUKDTSA-N 1 3 343.515 2.711 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@@](C)(C[NH2+]CCc2cccs2)C2CC2)C1 ZINC001495278825 1399788268 /nfs/dbraw/zinc/78/82/68/1399788268.db2.gz XPTKNWVKPDOQQY-KXBFYZLASA-N 1 3 349.544 2.507 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H](CC[NH2+]C/C=C\Cl)C1)N(C)C ZINC001495381057 1399927164 /nfs/dbraw/zinc/92/71/64/1399927164.db2.gz RLPHDDGEGIARQK-PDTSHOSPSA-N 1 3 329.916 2.543 10 0 EFAEHO CCC(CC)C[NH2+]CC[C@H]1CCCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001495389666 1399935078 /nfs/dbraw/zinc/93/50/78/1399935078.db2.gz YQXXRQPZRIKKCS-IEBWSBKVSA-N 1 3 337.552 2.983 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2CC[C@H](NC(=O)CN(C)C(C)C)CC2)c1 ZINC001495481624 1400016063 /nfs/dbraw/zinc/01/60/63/1400016063.db2.gz JZBONJQAYPPDID-IYARVYRRSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@H](C[NH2+]CCc1ccccc1)N(C)C(=O)CN(C)CC(C)(C)C ZINC001496154044 1400506865 /nfs/dbraw/zinc/50/68/65/1400506865.db2.gz LYVPJJIBHOPOKV-QGZVFWFLSA-N 1 3 333.520 2.644 10 0 EFAEHO C[C@@H](C[NH2+][C@@H](C)c1ccc(F)c(F)c1)N(C)C(=O)CN1CCCC1 ZINC001496230162 1400557323 /nfs/dbraw/zinc/55/73/23/1400557323.db2.gz RIYJQJUOIXNVIT-KBPBESRZSA-N 1 3 339.430 2.558 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N[C@@H](CNCCF)C2CCCCC2)CC1 ZINC001496325203 1400640765 /nfs/dbraw/zinc/64/07/65/1400640765.db2.gz RXXZOLQFAQETLE-SFHVURJKSA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]C/C=C\Cl)C1CCCCC1 ZINC001496328708 1400644463 /nfs/dbraw/zinc/64/44/63/1400644463.db2.gz ZTGWNJLFHWVYJC-BSDKJSHOSA-N 1 3 329.916 2.734 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@H]1CC[NH2+]Cc1ccc(F)cc1 ZINC001496390084 1400697501 /nfs/dbraw/zinc/69/75/01/1400697501.db2.gz SZIMEEFIPNZJIE-OALUTQOASA-N 1 3 347.478 2.781 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CC[NH+](C)C)N[C@H](C)c1cc(F)ccc1F ZINC001496598993 1400860253 /nfs/dbraw/zinc/86/02/53/1400860253.db2.gz VMTVKCXXJHHCBV-CXAGYDPISA-N 1 3 341.446 2.708 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[N@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001496809267 1400998646 /nfs/dbraw/zinc/99/86/46/1400998646.db2.gz VOQJVRHOXHZRIA-CEXWTWQISA-N 1 3 335.536 2.545 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[N@@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001496809267 1400998649 /nfs/dbraw/zinc/99/86/49/1400998649.db2.gz VOQJVRHOXHZRIA-CEXWTWQISA-N 1 3 335.536 2.545 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)CC[C@@H]32)cc1 ZINC001496866769 1401062383 /nfs/dbraw/zinc/06/23/83/1401062383.db2.gz IRDGPOQLDIORLG-UXHICEINSA-N 1 3 343.515 2.758 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)CC[C@@H]32)cc1 ZINC001496866769 1401062392 /nfs/dbraw/zinc/06/23/92/1401062392.db2.gz IRDGPOQLDIORLG-UXHICEINSA-N 1 3 343.515 2.758 10 0 EFAEHO CCN(CCNCc1csc(C)c1)C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001497403312 1401350388 /nfs/dbraw/zinc/35/03/88/1401350388.db2.gz ITXUNVWNEZDKJL-KRWDZBQOSA-N 1 3 337.533 2.869 10 0 EFAEHO CCN(CCNCc1csc(C)c1)C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001497403312 1401350393 /nfs/dbraw/zinc/35/03/93/1401350393.db2.gz ITXUNVWNEZDKJL-KRWDZBQOSA-N 1 3 337.533 2.869 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(C)cc(C)c1)C(=O)CN1CC[C@H](C)C1 ZINC001497454697 1401387694 /nfs/dbraw/zinc/38/76/94/1401387694.db2.gz LZDUQPFMLQKYDF-INIZCTEOSA-N 1 3 331.504 2.583 10 0 EFAEHO CC[C@@H](C(=O)N(CC)CC[NH2+]C[C@H]1CCc2ccccc2C1)N(C)C ZINC001497487269 1401412445 /nfs/dbraw/zinc/41/24/45/1401412445.db2.gz WQXLMPSWCPQDMQ-PXNSSMCTSA-N 1 3 345.531 2.570 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC/C=C/CNCc1cc(F)ccc1C ZINC001497600110 1401485124 /nfs/dbraw/zinc/48/51/24/1401485124.db2.gz PJOWFFOBKQEISZ-VZSQWMKGSA-N 1 3 347.478 2.771 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC/C=C/CNCc1cc(F)ccc1C ZINC001497600110 1401485128 /nfs/dbraw/zinc/48/51/28/1401485128.db2.gz PJOWFFOBKQEISZ-VZSQWMKGSA-N 1 3 347.478 2.771 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC/C=C\CNCc1cc(F)ccc1C ZINC001497600092 1401485293 /nfs/dbraw/zinc/48/52/93/1401485293.db2.gz PJOWFFOBKQEISZ-HMECNJMJSA-N 1 3 347.478 2.771 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC/C=C\CNCc1cc(F)ccc1C ZINC001497600092 1401485296 /nfs/dbraw/zinc/48/52/96/1401485296.db2.gz PJOWFFOBKQEISZ-HMECNJMJSA-N 1 3 347.478 2.771 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccc(CF)cc1)C(=O)[C@@H]1CC[N@H+](C)C1 ZINC001507862719 1407187619 /nfs/dbraw/zinc/18/76/19/1407187619.db2.gz IVLMWPXSHDYOME-LJQANCHMSA-N 1 3 349.494 2.777 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccc(CF)cc1)C(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001507862719 1407187625 /nfs/dbraw/zinc/18/76/25/1407187625.db2.gz IVLMWPXSHDYOME-LJQANCHMSA-N 1 3 349.494 2.777 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/C[NH2+]Cc1ccc2c(c1)CCC2)N(C)C ZINC001497671332 1401537950 /nfs/dbraw/zinc/53/79/50/1401537950.db2.gz IKVSPWVMLOEOPL-RRFGBZISSA-N 1 3 343.515 2.524 10 0 EFAEHO Cc1cccc(C[NH2+]C/C=C/CNC(=O)CN(C)CC(C)(C)C)c1 ZINC001497679368 1401545001 /nfs/dbraw/zinc/54/50/01/1401545001.db2.gz HVYVXVFOXMLJOZ-VOTSOKGWSA-N 1 3 331.504 2.735 10 0 EFAEHO Cc1cccc(C[NH2+]C/C=C\CNC(=O)CN(C)CC(C)(C)C)c1 ZINC001497679365 1401545194 /nfs/dbraw/zinc/54/51/94/1401545194.db2.gz HVYVXVFOXMLJOZ-SREVYHEPSA-N 1 3 331.504 2.735 10 0 EFAEHO Cc1ccc(CC[NH2+]C/C=C/CNC(=O)CN2CCC(C)CC2)cc1 ZINC001497716013 1401577263 /nfs/dbraw/zinc/57/72/63/1401577263.db2.gz XTNLKFIKOCULJS-ONEGZZNKSA-N 1 3 343.515 2.531 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@@H](C)NC(=O)[C@@H]1CCCN1C(C)C ZINC001497816431 1401671995 /nfs/dbraw/zinc/67/19/95/1401671995.db2.gz QVCKQACXDSYFHB-XLIONFOSSA-N 1 3 345.531 2.759 10 0 EFAEHO CCc1ccc(CC[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001497816099 1401672077 /nfs/dbraw/zinc/67/20/77/1401672077.db2.gz KOXLVHMIAJTEAW-XLIONFOSSA-N 1 3 345.531 2.759 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+][C@@H](C)c1cccc(Cl)c1)N(C)C ZINC001497835714 1401685540 /nfs/dbraw/zinc/68/55/40/1401685540.db2.gz JOLQFTOPTVIFMR-DVOMOZLQSA-N 1 3 325.884 2.836 10 0 EFAEHO C[C@H](C[NH2+][C@H]1CCc2ccccc21)NC(=O)CN(C)CC(C)(C)C ZINC001497910177 1401735198 /nfs/dbraw/zinc/73/51/98/1401735198.db2.gz HHGDRDKZAFOHGK-QAPCUYQASA-N 1 3 331.504 2.746 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CCCCC(F)(F)F ZINC001497993260 1401798389 /nfs/dbraw/zinc/79/83/89/1401798389.db2.gz NTLGHVIBVGWJJS-ZIAGYGMSSA-N 1 3 337.430 2.688 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1cccc(F)c1 ZINC001498133354 1401871672 /nfs/dbraw/zinc/87/16/72/1401871672.db2.gz UZXJYVICWVLIGD-YJBOKZPZSA-N 1 3 335.467 2.683 10 0 EFAEHO COc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCCN2C(C)C)cc1 ZINC001498133794 1401871876 /nfs/dbraw/zinc/87/18/76/1401871876.db2.gz ZJGTZMLVNLLKKE-LPHOPBHVSA-N 1 3 347.503 2.552 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1cccc(F)c1 ZINC001498133346 1401872157 /nfs/dbraw/zinc/87/21/57/1401872157.db2.gz UZXJYVICWVLIGD-MAUKXSAKSA-N 1 3 335.467 2.683 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]Cc1cc(C)ccc1C ZINC001498196888 1401903786 /nfs/dbraw/zinc/90/37/86/1401903786.db2.gz AJLALCCMZYQJER-PKOBYXMFSA-N 1 3 331.504 2.772 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001498286633 1401977360 /nfs/dbraw/zinc/97/73/60/1401977360.db2.gz BIVYSPYXWNOFEJ-JXXFODFXSA-N 1 3 343.515 2.841 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001498286633 1401977368 /nfs/dbraw/zinc/97/73/68/1401977368.db2.gz BIVYSPYXWNOFEJ-JXXFODFXSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCc1ccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)cc1 ZINC001498288695 1401979679 /nfs/dbraw/zinc/97/96/79/1401979679.db2.gz NDOMWBQKYSZIMX-SQGPQFPESA-N 1 3 345.531 2.916 10 0 EFAEHO CCCc1ccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1 ZINC001498288695 1401979683 /nfs/dbraw/zinc/97/96/83/1401979683.db2.gz NDOMWBQKYSZIMX-SQGPQFPESA-N 1 3 345.531 2.916 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(CF)cc1)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001498303846 1401992021 /nfs/dbraw/zinc/99/20/21/1401992021.db2.gz AFQJKFYGOJFTOX-LPHOPBHVSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(CF)cc1)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001498303846 1401992025 /nfs/dbraw/zinc/99/20/25/1401992025.db2.gz AFQJKFYGOJFTOX-LPHOPBHVSA-N 1 3 349.494 2.967 10 0 EFAEHO CC(C)CN1CCC[C@H]1C(=O)N[C@H](C[NH2+]CCCF)C(C)(C)C ZINC001507969085 1407226546 /nfs/dbraw/zinc/22/65/46/1407226546.db2.gz AUMDAILHPYHHKP-JKSUJKDBSA-N 1 3 329.504 2.587 10 0 EFAEHO C[C@@H](C[N@@H+](C)Cc1ccc(Cl)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001498381315 1402055141 /nfs/dbraw/zinc/05/51/41/1402055141.db2.gz OKHGRSCDEOLTOQ-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](C[N@H+](C)Cc1ccc(Cl)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001498381315 1402055138 /nfs/dbraw/zinc/05/51/38/1402055138.db2.gz OKHGRSCDEOLTOQ-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO CCCc1ccc(C[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001498381506 1402056396 /nfs/dbraw/zinc/05/63/96/1402056396.db2.gz PWMSSMXUGVMPRE-MSOLQXFVSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(C[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001498381506 1402056401 /nfs/dbraw/zinc/05/64/01/1402056401.db2.gz PWMSSMXUGVMPRE-MSOLQXFVSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001498424458 1402089265 /nfs/dbraw/zinc/08/92/65/1402089265.db2.gz FUABUOIXPHKWAT-GOEBONIOSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001498424458 1402089272 /nfs/dbraw/zinc/08/92/72/1402089272.db2.gz FUABUOIXPHKWAT-GOEBONIOSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CN(C)[C@H]1CCc2ccc(F)cc21)NC(=O)CCCC[NH+](C)C ZINC001498426795 1402092842 /nfs/dbraw/zinc/09/28/42/1402092842.db2.gz DQMHMBMSQFYNOX-KXBFYZLASA-N 1 3 349.494 2.981 10 0 EFAEHO C[C@H](CN(C)C/C=C/c1ccc(Cl)cc1)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001498450470 1402114013 /nfs/dbraw/zinc/11/40/13/1402114013.db2.gz PQWHMHGJIXGLNZ-GWOVIKRFSA-N 1 3 349.906 2.741 10 0 EFAEHO C[C@H](CN(C)C/C=C/c1ccc(Cl)cc1)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001498450470 1402114017 /nfs/dbraw/zinc/11/40/17/1402114017.db2.gz PQWHMHGJIXGLNZ-GWOVIKRFSA-N 1 3 349.906 2.741 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCCC[C@H]1C[NH2+]Cc1ccsc1 ZINC001498504677 1402150307 /nfs/dbraw/zinc/15/03/07/1402150307.db2.gz PDEHYAJJEJLGHF-IRXDYDNUSA-N 1 3 337.533 2.853 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+][C@H](C)c1cccc(F)c1)N(C)C ZINC001498562402 1402176938 /nfs/dbraw/zinc/17/69/38/1402176938.db2.gz VPXKKLKKRKGCPI-QAPCUYQASA-N 1 3 337.483 2.911 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001498584064 1402186012 /nfs/dbraw/zinc/18/60/12/1402186012.db2.gz JEPSGKPRSHNXCH-HUUCEWRRSA-N 1 3 333.467 2.590 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(C2CCC2)cc1)C(=O)[C@H]1CCCN1C ZINC001498592344 1402190287 /nfs/dbraw/zinc/19/02/87/1402190287.db2.gz PYPPRFHIFYLLRO-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001498611222 1402200374 /nfs/dbraw/zinc/20/03/74/1402200374.db2.gz VFLSBWKTPHDQOC-HZPDHXFCSA-N 1 3 347.494 2.836 10 0 EFAEHO CN(CCC[NH2+]CC1CCCC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001498612049 1402201737 /nfs/dbraw/zinc/20/17/37/1402201737.db2.gz DPDXJPVINFQLQO-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CCCN(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001498612970 1402201970 /nfs/dbraw/zinc/20/19/70/1402201970.db2.gz NVCYNWLWUVLYSF-INIZCTEOSA-N 1 3 331.504 2.583 10 0 EFAEHO CN(CC(=O)N(C)CCC[NH2+]Cc1ccsc1)CC(C)(C)C ZINC001498614421 1402202881 /nfs/dbraw/zinc/20/28/81/1402202881.db2.gz YSPUSWHJKKFIKZ-UHFFFAOYSA-N 1 3 325.522 2.664 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(C(F)F)cc1)C(=O)Cc1c[nH]cn1 ZINC001498618992 1402205369 /nfs/dbraw/zinc/20/53/69/1402205369.db2.gz MLTPIHRRNQZPSZ-UHFFFAOYSA-N 1 3 336.386 2.528 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+][C@H]1CCc2ccc(F)cc21)N(C)C ZINC001498643628 1402221589 /nfs/dbraw/zinc/22/15/89/1402221589.db2.gz DWSPYBCOCADLLO-RBUKOAKNSA-N 1 3 349.494 2.837 10 0 EFAEHO CN(CCC[NH2+]Cc1cccc(C(F)F)c1)C(=O)CN1CCCC1 ZINC001498654554 1402229093 /nfs/dbraw/zinc/22/90/93/1402229093.db2.gz AZMKXVBMTYGWKK-UHFFFAOYSA-N 1 3 339.430 2.658 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C[NH2+][C@@H]1CCc2ccccc21)C1CC1 ZINC001498861710 1402341768 /nfs/dbraw/zinc/34/17/68/1402341768.db2.gz MUTJKGWHXYQAFJ-MOPGFXCFSA-N 1 3 329.488 2.500 10 0 EFAEHO Cc1ccc2ccccc2c1CN1CC[C@@H]1CNC(=O)CC[NH+](C)C ZINC001499050424 1402445279 /nfs/dbraw/zinc/44/52/79/1402445279.db2.gz OFMXUTDAXYIYDR-GOSISDBHSA-N 1 3 339.483 2.790 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]CC2=CCCCC2)CC1)N1CCCCC1 ZINC001499225952 1402527568 /nfs/dbraw/zinc/52/75/68/1402527568.db2.gz JTAUXOQLKKSDPG-UHFFFAOYSA-N 1 3 333.520 2.990 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+]CCCc2ccccc2)CC1 ZINC001499226228 1402528429 /nfs/dbraw/zinc/52/84/29/1402528429.db2.gz ONWSGMATWFFJRR-IBGZPJMESA-N 1 3 343.515 2.730 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@H]3C)CC2)c1 ZINC001499461427 1402624703 /nfs/dbraw/zinc/62/47/03/1402624703.db2.gz IITSVSLZLLFNIV-QZTJIDSGSA-N 1 3 343.515 2.915 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C2(CNC(=O)CN3[C@@H](C)CC[C@@H]3C)CC2)c1 ZINC001499461428 1402624905 /nfs/dbraw/zinc/62/49/05/1402624905.db2.gz IITSVSLZLLFNIV-ROUUACIJSA-N 1 3 343.515 2.915 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@H+](C/C=C\Cl)C1 ZINC001499480466 1402635501 /nfs/dbraw/zinc/63/55/01/1402635501.db2.gz HCLFVIIHWNFFAX-HYHHROLSSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@@H+](C/C=C\Cl)C1 ZINC001499480466 1402635506 /nfs/dbraw/zinc/63/55/06/1402635506.db2.gz HCLFVIIHWNFFAX-HYHHROLSSA-N 1 3 341.927 2.782 10 0 EFAEHO CCCC[NH+]1CCC([C@@H](C)NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001508064440 1407275082 /nfs/dbraw/zinc/27/50/82/1407275082.db2.gz MGOKECGTNYKOIU-MRXNPFEDSA-N 1 3 325.541 2.981 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CC2CC2)CCCCC1 ZINC001499555954 1402681123 /nfs/dbraw/zinc/68/11/23/1402681123.db2.gz VVIPRUWOXFCKNM-KDURUIRLSA-N 1 3 347.547 2.974 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC[C@@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001499577365 1402696357 /nfs/dbraw/zinc/69/63/57/1402696357.db2.gz UGCUOZPCBPOFJX-ROUKRRSUSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC[C@@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001499577365 1402696361 /nfs/dbraw/zinc/69/63/61/1402696361.db2.gz UGCUOZPCBPOFJX-ROUKRRSUSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001499616787 1402721850 /nfs/dbraw/zinc/72/18/50/1402721850.db2.gz UAGNFZSMAAMLHK-AQWUKCDYSA-N 1 3 335.536 2.999 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001499616787 1402721852 /nfs/dbraw/zinc/72/18/52/1402721852.db2.gz UAGNFZSMAAMLHK-AQWUKCDYSA-N 1 3 335.536 2.999 10 0 EFAEHO CC[C@@H](F)CN1CC[C@@]2(CCN(C(=O)CCC[NH+]3CCCC3)C2)C1 ZINC001499618624 1402723376 /nfs/dbraw/zinc/72/33/76/1402723376.db2.gz DZGJWPIMRWOQGU-IEBWSBKVSA-N 1 3 339.499 2.535 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CCCc2ccccc2)CCN1C(=O)Cc1c[nH]cn1 ZINC001499849664 1402817079 /nfs/dbraw/zinc/81/70/79/1402817079.db2.gz VIMHZLJFHVJLRZ-AEFFLSMTSA-N 1 3 340.471 2.554 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CCCc2ccccc2)CCN1C(=O)Cc1c[nH]cn1 ZINC001499849668 1402817212 /nfs/dbraw/zinc/81/72/12/1402817212.db2.gz VIMHZLJFHVJLRZ-SJLPKXTDSA-N 1 3 340.471 2.554 10 0 EFAEHO Cc1ccc(F)c(CN2CCC([C@H](C)NC(=O)CC[NH+](C)C)CC2)c1 ZINC001508082432 1407287251 /nfs/dbraw/zinc/28/72/51/1407287251.db2.gz HPIJZGMWHOCOHF-INIZCTEOSA-N 1 3 349.494 2.803 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H](CNCc1ccccc1F)C1CCCC1 ZINC001500107414 1402940609 /nfs/dbraw/zinc/94/06/09/1402940609.db2.gz RJJHETSQSNOCAH-GOSISDBHSA-N 1 3 335.467 2.542 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CC[C@](C)(C[NH2+]C/C=C/Cl)C1 ZINC001500382054 1403086897 /nfs/dbraw/zinc/08/68/97/1403086897.db2.gz JVGAKBRXQGHNGI-KESHDOJXSA-N 1 3 341.927 2.830 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@]1(C)CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001500405573 1403102108 /nfs/dbraw/zinc/10/21/08/1403102108.db2.gz ZEMHJQZQBOYPKN-OXQOHEQNSA-N 1 3 349.494 2.938 10 0 EFAEHO CCCCC[NH+]1CCC(C)(CNC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001500431510 1403117932 /nfs/dbraw/zinc/11/79/32/1403117932.db2.gz YLUVQWZHYXIWLJ-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](F)CN1CCC(C)(CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)CC1 ZINC001500444301 1403127632 /nfs/dbraw/zinc/12/76/32/1403127632.db2.gz IUTDXUWKUSJCKJ-ULQDDVLXSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[C@H](F)CN1CCC(C)(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)CC1 ZINC001500444301 1403127636 /nfs/dbraw/zinc/12/76/36/1403127636.db2.gz IUTDXUWKUSJCKJ-ULQDDVLXSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1(C)CC[NH+](Cc2ccccc2F)CC1 ZINC001500466186 1403141785 /nfs/dbraw/zinc/14/17/85/1403141785.db2.gz ULDAUIRGQUKIKV-UHFFFAOYSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C2CC([NH2+]CCCc3ccsc3)C2)C1 ZINC001508137771 1407311536 /nfs/dbraw/zinc/31/15/36/1407311536.db2.gz VENVFIFEGAOULI-ZLPCBKJTSA-N 1 3 349.544 2.602 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@]1(C)CCC[N@H+](Cc2ccsc2)C1 ZINC001500546861 1403212245 /nfs/dbraw/zinc/21/22/45/1403212245.db2.gz JGQYBSSCJZVANI-GOSISDBHSA-N 1 3 337.533 2.808 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@]1(C)CCC[N@@H+](Cc2ccsc2)C1 ZINC001500546861 1403212250 /nfs/dbraw/zinc/21/22/50/1403212250.db2.gz JGQYBSSCJZVANI-GOSISDBHSA-N 1 3 337.533 2.808 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1C[N@H+](CCC(C)(C)C)CCC1(F)F ZINC001500617021 1403251756 /nfs/dbraw/zinc/25/17/56/1403251756.db2.gz OJNRRSOPPQVUEF-HNNXBMFYSA-N 1 3 347.494 2.838 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1C[N@@H+](CCC(C)(C)C)CCC1(F)F ZINC001500617021 1403251762 /nfs/dbraw/zinc/25/17/62/1403251762.db2.gz OJNRRSOPPQVUEF-HNNXBMFYSA-N 1 3 347.494 2.838 10 0 EFAEHO CCCN1CCC(F)(F)[C@H](CNC(=O)CCCC[NH+]2CCCC2)C1 ZINC001500619997 1403254133 /nfs/dbraw/zinc/25/41/33/1403254133.db2.gz GANGTDZTSQCYQY-MRXNPFEDSA-N 1 3 345.478 2.736 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC001508155261 1407317726 /nfs/dbraw/zinc/31/77/26/1407317726.db2.gz OKEYRYYENWMUEF-JFIBYHEFSA-N 1 3 347.478 2.732 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001501152817 1403462357 /nfs/dbraw/zinc/46/23/57/1403462357.db2.gz FFXVRCKSYBPSIT-PKOBYXMFSA-N 1 3 331.504 2.519 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2C[N@@H+](CC3CCCC3)C[C@@H]2C1)CC(C)(C)C ZINC001501232968 1403505151 /nfs/dbraw/zinc/50/51/51/1403505151.db2.gz PSLAWMVQFBVXME-HDICACEKSA-N 1 3 335.536 2.545 10 0 EFAEHO CN(CC(=O)N1C[C@@H]2C[N@H+](CC3CCCC3)C[C@@H]2C1)CC(C)(C)C ZINC001501232968 1403505157 /nfs/dbraw/zinc/50/51/57/1403505157.db2.gz PSLAWMVQFBVXME-HDICACEKSA-N 1 3 335.536 2.545 10 0 EFAEHO Cc1ccc(C[N@H+]2CC=C(CNC(=O)C3(N(C)C)CCC3)CC2)cc1 ZINC001508206947 1407345691 /nfs/dbraw/zinc/34/56/91/1407345691.db2.gz SESUTTSEPVHVPS-UHFFFAOYSA-N 1 3 341.499 2.728 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC=C(CNC(=O)C3(N(C)C)CCC3)CC2)cc1 ZINC001508206947 1407345697 /nfs/dbraw/zinc/34/56/97/1407345697.db2.gz SESUTTSEPVHVPS-UHFFFAOYSA-N 1 3 341.499 2.728 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](CC[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001501637498 1403659202 /nfs/dbraw/zinc/65/92/02/1403659202.db2.gz KIOTZLPHODBCJB-SJLPKXTDSA-N 1 3 335.536 2.735 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)N1CC2(C1)CCN(C/C=C/Cl)CC2 ZINC001501749516 1403764161 /nfs/dbraw/zinc/76/41/61/1403764161.db2.gz XHEAJGNRAFXRMA-XBXARRHUSA-N 1 3 339.911 2.539 10 0 EFAEHO CN(CC(=O)N[C@H]1CCC[N@H+](Cc2ccsc2)CC1)C1CCC1 ZINC001502125673 1404017897 /nfs/dbraw/zinc/01/78/97/1404017897.db2.gz IAARCTHPZZWCLH-INIZCTEOSA-N 1 3 335.517 2.703 10 0 EFAEHO CN(CC(=O)N[C@H]1CCC[N@@H+](Cc2ccsc2)CC1)C1CCC1 ZINC001502125673 1404017903 /nfs/dbraw/zinc/01/79/03/1404017903.db2.gz IAARCTHPZZWCLH-INIZCTEOSA-N 1 3 335.517 2.703 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1CCC[C@@H](NC(=O)CN(C)C(C)C)CC1 ZINC001502147462 1404046830 /nfs/dbraw/zinc/04/68/30/1404046830.db2.gz JRDYFDWXIUCIMT-ZWKOTPCHSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1CCC[C@@H](NC(=O)CN(C)C(C)C)CC1 ZINC001502147462 1404046825 /nfs/dbraw/zinc/04/68/25/1404046825.db2.gz JRDYFDWXIUCIMT-ZWKOTPCHSA-N 1 3 325.541 2.980 10 0 EFAEHO CCC1([NH2+]C/C(Cl)=C\Cl)CCN(C(=O)CN2CCCC2)CC1 ZINC001502516085 1404213805 /nfs/dbraw/zinc/21/38/05/1404213805.db2.gz ZQLTUUNBTOZWLS-SDNWHVSQSA-N 1 3 348.318 2.762 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H](C)[C@H]([NH2+]Cc2ccc(Cl)cc2)C1 ZINC001502761530 1404329984 /nfs/dbraw/zinc/32/99/84/1404329984.db2.gz BHOPAMCOAWNHHI-WMLDXEAASA-N 1 3 337.895 2.617 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H]([NH2+]Cc2ccc(Cl)cc2)C1 ZINC001502761529 1404330057 /nfs/dbraw/zinc/33/00/57/1404330057.db2.gz BHOPAMCOAWNHHI-PBHICJAKSA-N 1 3 337.895 2.617 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H]1CN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001502762061 1404330775 /nfs/dbraw/zinc/33/07/75/1404330775.db2.gz KBUUDRUGTQSGMV-APWZRJJASA-N 1 3 331.504 2.526 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc(Cl)cc2)[C@@H](C)C1 ZINC001502761531 1404330846 /nfs/dbraw/zinc/33/08/46/1404330846.db2.gz BHOPAMCOAWNHHI-YOEHRIQHSA-N 1 3 337.895 2.617 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(C)([NH2+]CCCCC(F)(F)F)CC1 ZINC001502772241 1404336281 /nfs/dbraw/zinc/33/62/81/1404336281.db2.gz KTKHNZQTKUIMDA-AWEZNQCLSA-N 1 3 349.441 2.784 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C)([NH2+]CCCc2ccccc2)CC1 ZINC001502811430 1404357268 /nfs/dbraw/zinc/35/72/68/1404357268.db2.gz UISOZORPDWZBHT-UHFFFAOYSA-N 1 3 345.531 2.930 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@H+](CCCC(C)C)CC1(C)C ZINC001502837156 1404395816 /nfs/dbraw/zinc/39/58/16/1404395816.db2.gz YFQUTNHBUORLGA-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@@H+](CCCC(C)C)CC1(C)C ZINC001502837156 1404395821 /nfs/dbraw/zinc/39/58/21/1404395821.db2.gz YFQUTNHBUORLGA-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1Cc1ccsc1 ZINC001502933943 1404436363 /nfs/dbraw/zinc/43/63/63/1404436363.db2.gz NLCKPWWHKGOCNQ-GDBMZVCRSA-N 1 3 335.517 2.702 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@H+]1Cc1ccsc1 ZINC001502933943 1404436366 /nfs/dbraw/zinc/43/63/66/1404436366.db2.gz NLCKPWWHKGOCNQ-GDBMZVCRSA-N 1 3 335.517 2.702 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)C(C)(C)N2CCCC2)CC[N@@H+]1CCCCCF ZINC001502971493 1404447990 /nfs/dbraw/zinc/44/79/90/1404447990.db2.gz VMPSUEJWBNFCRP-SJORKVTESA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)C(C)(C)N2CCCC2)CC[N@H+]1CCCCCF ZINC001502971493 1404447997 /nfs/dbraw/zinc/44/79/97/1404447997.db2.gz VMPSUEJWBNFCRP-SJORKVTESA-N 1 3 341.515 2.970 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C)c(C)n1 ZINC001503022821 1404463860 /nfs/dbraw/zinc/46/38/60/1404463860.db2.gz GIXYCCVRRBWXRG-APWZRJJASA-N 1 3 346.519 2.508 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@H]2C)c(C)n1 ZINC001503022821 1404463864 /nfs/dbraw/zinc/46/38/64/1404463864.db2.gz GIXYCCVRRBWXRG-APWZRJJASA-N 1 3 346.519 2.508 10 0 EFAEHO CC[C@H](F)C[N@H+](CC)CC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001505398619 1404551938 /nfs/dbraw/zinc/55/19/38/1404551938.db2.gz PAFLQRCTLZDGDP-ZWKOTPCHSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[C@H](F)C[N@@H+](CC)CC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001505398619 1404551946 /nfs/dbraw/zinc/55/19/46/1404551946.db2.gz PAFLQRCTLZDGDP-ZWKOTPCHSA-N 1 3 343.531 2.881 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)C[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C)cc1 ZINC001505424156 1404586234 /nfs/dbraw/zinc/58/62/34/1404586234.db2.gz JHWGHVTUEWBYMH-PMACEKPBSA-N 1 3 343.515 2.555 10 0 EFAEHO Cc1ccc(CC[N@H+](C)C[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C)cc1 ZINC001505424156 1404586235 /nfs/dbraw/zinc/58/62/35/1404586235.db2.gz JHWGHVTUEWBYMH-PMACEKPBSA-N 1 3 343.515 2.555 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)C[C@@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001505447003 1404642040 /nfs/dbraw/zinc/64/20/40/1404642040.db2.gz XFPVKDJIDGPHOC-SJORKVTESA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)C[C@@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001505447003 1404642052 /nfs/dbraw/zinc/64/20/52/1404642052.db2.gz XFPVKDJIDGPHOC-SJORKVTESA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](CNCCF)C(C)(C)C)[NH+]1CCCCC1 ZINC001725755731 1425823003 /nfs/dbraw/zinc/82/30/03/1425823003.db2.gz GOJJEFSPQPGOPA-CVEARBPZSA-N 1 3 329.504 2.587 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@@H](C)[C@@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001505621376 1404864099 /nfs/dbraw/zinc/86/40/99/1404864099.db2.gz GPRDGKQNHXZZSP-DLBZAZTESA-N 1 3 345.531 2.759 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001505624900 1404866939 /nfs/dbraw/zinc/86/69/39/1404866939.db2.gz CBRIGXVGHIIPQU-DLBZAZTESA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@@H](NCC=C(Cl)Cl)[C@@H](C)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001505667370 1404914829 /nfs/dbraw/zinc/91/48/29/1404914829.db2.gz LOKJYFUURUNALI-VXGBXAGGSA-N 1 3 336.307 2.663 10 0 EFAEHO C[C@@H]([NH2+]Cc1cccc(F)c1)[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001505667275 1404914961 /nfs/dbraw/zinc/91/49/61/1404914961.db2.gz KKAZYJWSWHQSLR-CABCVRRESA-N 1 3 335.467 2.683 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H](C)[C@@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001505668369 1404916220 /nfs/dbraw/zinc/91/62/20/1404916220.db2.gz XJQCLJMMROXKQA-HZPDHXFCSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@H](NCc1ccc(Cl)cc1F)[C@H](C)NC(=O)CCC[NH+](C)C ZINC001505677082 1404927521 /nfs/dbraw/zinc/92/75/21/1404927521.db2.gz CWTLYDMWFRBOFZ-STQMWFEESA-N 1 3 343.874 2.804 10 0 EFAEHO COc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)CC(C)(C)C)cc1 ZINC001505694242 1404947870 /nfs/dbraw/zinc/94/78/70/1404947870.db2.gz LSNIHPDAZGFZIF-JKSUJKDBSA-N 1 3 349.519 2.656 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC001505736049 1405002197 /nfs/dbraw/zinc/00/21/97/1405002197.db2.gz QDODXWNMXTWVKZ-JKSUJKDBSA-N 1 3 342.487 2.559 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(C(F)F)cc1 ZINC001505761787 1405037061 /nfs/dbraw/zinc/03/70/61/1405037061.db2.gz VUQATEBQJKJTJT-KGLIPLIRSA-N 1 3 341.446 2.947 10 0 EFAEHO CN(C)C1(C(=O)N(C)C2CCC([NH2+]CCCCCF)CC2)CCC1 ZINC001505780597 1405060808 /nfs/dbraw/zinc/06/08/08/1405060808.db2.gz JIGAVTPJXONNPA-UHFFFAOYSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@@H](F)CC[NH2+]CC(C)(C)CN(C)C(=O)C(C)(C)N1CCCC1 ZINC001505828526 1405116337 /nfs/dbraw/zinc/11/63/37/1405116337.db2.gz VWRLPDJMVRMBAQ-OAHLLOKOSA-N 1 3 329.504 2.683 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)[C@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001505918530 1405223230 /nfs/dbraw/zinc/22/32/30/1405223230.db2.gz MVRUTODEMUFAMG-QUCCMNQESA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1ccc(CC[N@H+](C)[C@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001505918530 1405223235 /nfs/dbraw/zinc/22/32/35/1405223235.db2.gz MVRUTODEMUFAMG-QUCCMNQESA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1cc(CN(C)[C@H](C)CNC(=O)[C@@H]2C[NH+]3CCC2CC3)c(C)s1 ZINC001505920506 1405225625 /nfs/dbraw/zinc/22/56/25/1405225625.db2.gz NQULHYBXYIYVFB-FZKQIMNGSA-N 1 3 349.544 2.643 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)N(C)Cc1cc2ccccc2o1 ZINC001505922273 1405227606 /nfs/dbraw/zinc/22/76/06/1405227606.db2.gz KXTPETZJJJYZBV-HDMKZQKVSA-N 1 3 343.471 2.710 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)N(C)Cc1cc2ccccc2o1 ZINC001505922273 1405227615 /nfs/dbraw/zinc/22/76/15/1405227615.db2.gz KXTPETZJJJYZBV-HDMKZQKVSA-N 1 3 343.471 2.710 10 0 EFAEHO C[C@@H](CNC(=O)CC[NH+](C)C)N(C)[C@@H](C)c1ccc(F)c(Cl)c1 ZINC001505995233 1405321148 /nfs/dbraw/zinc/32/11/48/1405321148.db2.gz UIVSUSSXWMDBPK-STQMWFEESA-N 1 3 343.874 2.928 10 0 EFAEHO CCc1cccc(C[N@H+](C)[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001506001702 1405330378 /nfs/dbraw/zinc/33/03/78/1405330378.db2.gz GYZXTNWZMNFVFS-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(C[N@@H+](C)[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001506001702 1405330386 /nfs/dbraw/zinc/33/03/86/1405330386.db2.gz GYZXTNWZMNFVFS-IAGOWNOFSA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)[C@@H]1CCc2c1cccc2F ZINC001506065583 1405425615 /nfs/dbraw/zinc/42/56/15/1405425615.db2.gz RNXIHFCLQOHLFK-KBXCAEBGSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)[C@@H]1CCc2c1cccc2F ZINC001506065583 1405425617 /nfs/dbraw/zinc/42/56/17/1405425617.db2.gz RNXIHFCLQOHLFK-KBXCAEBGSA-N 1 3 335.467 2.590 10 0 EFAEHO C[C@H](NC(=O)CC[C@H]1CCC[N@@H+]1C)C1CN(CCc2cccs2)C1 ZINC001506630405 1406066487 /nfs/dbraw/zinc/06/64/87/1406066487.db2.gz MTKMXXUGBYXWSG-DOTOQJQBSA-N 1 3 349.544 2.602 10 0 EFAEHO C[C@H](NC(=O)CC[C@H]1CCC[N@H+]1C)C1CN(CCc2cccs2)C1 ZINC001506630405 1406066500 /nfs/dbraw/zinc/06/65/00/1406066500.db2.gz MTKMXXUGBYXWSG-DOTOQJQBSA-N 1 3 349.544 2.602 10 0 EFAEHO C[C@H](NC(=O)CC[C@@H]1CCC[N@@H+]1C)C1CN(CCc2cccs2)C1 ZINC001506630411 1406066728 /nfs/dbraw/zinc/06/67/28/1406066728.db2.gz MTKMXXUGBYXWSG-RDJZCZTQSA-N 1 3 349.544 2.602 10 0 EFAEHO C[C@H](NC(=O)CC[C@@H]1CCC[N@H+]1C)C1CN(CCc2cccs2)C1 ZINC001506630411 1406066732 /nfs/dbraw/zinc/06/67/32/1406066732.db2.gz MTKMXXUGBYXWSG-RDJZCZTQSA-N 1 3 349.544 2.602 10 0 EFAEHO CC(C)Cc1ccc(CN2CC([C@@H](C)NC(=O)CC[NH+](C)C)C2)cc1 ZINC001506647582 1406095293 /nfs/dbraw/zinc/09/52/93/1406095293.db2.gz BBYVIVJVUAMJAN-QGZVFWFLSA-N 1 3 345.531 2.773 10 0 EFAEHO CC(C)CC[NH+]1CC([C@@H](C)NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001506657430 1406110744 /nfs/dbraw/zinc/11/07/44/1406110744.db2.gz XMMHYQBMCRFBBP-BEFAXECRSA-N 1 3 341.515 2.682 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C1C[NH+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC001506671616 1406129885 /nfs/dbraw/zinc/12/98/85/1406129885.db2.gz PEYLVKPAEXHGEJ-HUUCEWRRSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1C[NH+](CC/C=C\c2ccccc2)C1 ZINC001506676465 1406136253 /nfs/dbraw/zinc/13/62/53/1406136253.db2.gz AUCOWSQVVBNQCR-XSZJWBAASA-N 1 3 343.515 2.867 10 0 EFAEHO CN(C)Cc1ccsc1C(=O)NCCCCc1cc[nH+]c(N)c1 ZINC001558884018 1415208367 /nfs/dbraw/zinc/20/83/67/1415208367.db2.gz KISRPPKJWPIYKW-UHFFFAOYSA-N 1 3 332.473 2.540 10 0 EFAEHO CCC(CC)C[NH2+]CC[C@H]1[C@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001565939108 1415457365 /nfs/dbraw/zinc/45/73/65/1415457365.db2.gz OESDHKAOMLIZCR-QAPCUYQASA-N 1 3 334.508 2.995 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]2C1 ZINC001566045296 1415492496 /nfs/dbraw/zinc/49/24/96/1415492496.db2.gz WWWPQHLZCSRYHX-WYNBNGFRSA-N 1 3 347.547 2.997 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]2C1 ZINC001566045296 1415492498 /nfs/dbraw/zinc/49/24/98/1415492498.db2.gz WWWPQHLZCSRYHX-WYNBNGFRSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)[C@H]3CCCCN3CC)C[C@@H]2C1 ZINC001566055287 1415494206 /nfs/dbraw/zinc/49/42/06/1415494206.db2.gz RHZOODSXFGDCAC-UEIMZRGPSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)[C@H]3CCCCN3CC)C[C@@H]2C1 ZINC001566055287 1415494208 /nfs/dbraw/zinc/49/42/08/1415494208.db2.gz RHZOODSXFGDCAC-UEIMZRGPSA-N 1 3 347.547 2.997 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N1CCCCC[C@@H]([NH2+]CCCF)C1 ZINC001566068953 1415501443 /nfs/dbraw/zinc/50/14/43/1415501443.db2.gz NVKXTBMNTZDGTD-SJORKVTESA-N 1 3 327.488 2.580 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1ccc(C)c(F)c1 ZINC001566564956 1415646918 /nfs/dbraw/zinc/64/69/18/1415646918.db2.gz JUIBTHGNUYSODM-MRXNPFEDSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1ccc(C)c(F)c1 ZINC001566564956 1415646923 /nfs/dbraw/zinc/64/69/23/1415646923.db2.gz JUIBTHGNUYSODM-MRXNPFEDSA-N 1 3 349.494 2.804 10 0 EFAEHO C[C@@H](c1ccccc1F)N(CCCNC(=O)[C@H]1CC[N@H+](C)C1)C1CC1 ZINC001566602894 1415687922 /nfs/dbraw/zinc/68/79/22/1415687922.db2.gz SCJCUVBUTFCDTK-HOTGVXAUSA-N 1 3 347.478 2.809 10 0 EFAEHO C[C@@H](c1ccccc1F)N(CCCNC(=O)[C@H]1CC[N@@H+](C)C1)C1CC1 ZINC001566602894 1415687926 /nfs/dbraw/zinc/68/79/26/1415687926.db2.gz SCJCUVBUTFCDTK-HOTGVXAUSA-N 1 3 347.478 2.809 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(C[C@@H]2NC(=O)C2(N(C)C)CCC2)CC1 ZINC001566689541 1415732709 /nfs/dbraw/zinc/73/27/09/1415732709.db2.gz PHDCPODZGIDACT-OSJSJHBBSA-N 1 3 333.520 2.798 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CC[C@H]([NH2+]CCCCCF)C1 ZINC001566775024 1415771361 /nfs/dbraw/zinc/77/13/61/1415771361.db2.gz VBFCWEBYHFGXOD-IRXDYDNUSA-N 1 3 327.488 2.580 10 0 EFAEHO CC/C=C/CC[NH2+][C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001566779400 1415772480 /nfs/dbraw/zinc/77/24/80/1415772480.db2.gz YVROFBXHINLVQW-UEKDZROGSA-N 1 3 329.488 2.909 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@H]1CCCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001566893918 1415828316 /nfs/dbraw/zinc/82/83/16/1415828316.db2.gz RGGQNNJSYMKDPF-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@H]1CCCCN1C(=O)C(C)(C)N1CCCCC1 ZINC001566938694 1415858664 /nfs/dbraw/zinc/85/86/64/1415858664.db2.gz XVLDGSFJPKUMKV-SJORKVTESA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCCC1)[NH2+]CCCc1ccccc1 ZINC001567015648 1415900254 /nfs/dbraw/zinc/90/02/54/1415900254.db2.gz AHJJJTZWYGICIZ-GOSISDBHSA-N 1 3 345.531 2.978 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCCC1)[NH2+]CCCc1ccccc1 ZINC001567015650 1415900555 /nfs/dbraw/zinc/90/05/55/1415900555.db2.gz AHJJJTZWYGICIZ-SFHVURJKSA-N 1 3 345.531 2.978 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001567041661 1415910883 /nfs/dbraw/zinc/91/08/83/1415910883.db2.gz BCPYAINMRSFSQX-GOSISDBHSA-N 1 3 345.531 2.896 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](C[NH2+]CCCC3CCCC3)C2)C1 ZINC001567141189 1415949762 /nfs/dbraw/zinc/94/97/62/1415949762.db2.gz WTRWNZBVJOEYHJ-MJGOQNOKSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]CC/C=C\c2ccccc2)C1 ZINC001567154173 1415955399 /nfs/dbraw/zinc/95/53/99/1415955399.db2.gz BRGZHTGZMKATJG-QRGKHIHXSA-N 1 3 343.515 2.868 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](C[NH2+]CC/C=C\c2ccccc2)C1 ZINC001567153950 1415955499 /nfs/dbraw/zinc/95/54/99/1415955499.db2.gz YJAFQMSBZALPOG-GFXXNKMTSA-N 1 3 341.499 2.624 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@H](C[NH2+]CCc2cccs2)C1 ZINC001567154534 1415956086 /nfs/dbraw/zinc/95/60/86/1415956086.db2.gz GHGYIGYTXSGZIX-AEFFLSMTSA-N 1 3 349.544 2.603 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001567155534 1415956159 /nfs/dbraw/zinc/95/61/59/1415956159.db2.gz REQFJFHWWUULTC-WBVHZDCISA-N 1 3 335.467 2.548 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[NH2+]CC2CCC(F)(F)CC2)CC1 ZINC001567580191 1416195477 /nfs/dbraw/zinc/19/54/77/1416195477.db2.gz PGMKSGFXFIYAEK-UHFFFAOYSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)[C@H]1CCN(CC=C(C)C)C1 ZINC001567685172 1416247287 /nfs/dbraw/zinc/24/72/87/1416247287.db2.gz AXEFUWCPCQVBJH-FHWLQOOXSA-N 1 3 335.536 2.996 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)[C@H]1CCN(CC=C(C)C)C1 ZINC001567685172 1416247290 /nfs/dbraw/zinc/24/72/90/1416247290.db2.gz AXEFUWCPCQVBJH-FHWLQOOXSA-N 1 3 335.536 2.996 10 0 EFAEHO CC/C=C/CC[NH+]1CC(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001567841229 1416295020 /nfs/dbraw/zinc/29/50/20/1416295020.db2.gz UKWUZIAWPFFRCL-GHOSXJJBSA-N 1 3 339.499 2.603 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@@](F)(C(=O)N[C@H]2CCN(CCCCCF)C2)C1 ZINC001567880182 1416308101 /nfs/dbraw/zinc/30/81/01/1416308101.db2.gz WNSHFBVXXSMRMD-YJBOKZPZSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)N[C@H]2CCN(CCCCCF)C2)C1 ZINC001567880182 1416308105 /nfs/dbraw/zinc/30/81/05/1416308105.db2.gz WNSHFBVXXSMRMD-YJBOKZPZSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N[C@H]2CC[N@H+](CCCCCF)C2)C1 ZINC001567880182 1416308110 /nfs/dbraw/zinc/30/81/10/1416308110.db2.gz WNSHFBVXXSMRMD-YJBOKZPZSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N[C@H]2CC[N@@H+](CCCCCF)C2)C1 ZINC001567880182 1416308113 /nfs/dbraw/zinc/30/81/13/1416308113.db2.gz WNSHFBVXXSMRMD-YJBOKZPZSA-N 1 3 345.478 2.529 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[N@H+](C)C1)[C@@H]1CCN(CCCCC(F)(F)F)C1 ZINC001567944961 1416339319 /nfs/dbraw/zinc/33/93/19/1416339319.db2.gz FFNVBHKCPVRKAQ-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[N@@H+](C)C1)[C@@H]1CCN(CCCCC(F)(F)F)C1 ZINC001567944961 1416339323 /nfs/dbraw/zinc/33/93/23/1416339323.db2.gz FFNVBHKCPVRKAQ-HUUCEWRRSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(C(=O)[C@H]1CC[N@H+](C)C1)[C@H]1CCN(CCCCC(F)(F)F)C1 ZINC001567944960 1416339806 /nfs/dbraw/zinc/33/98/06/1416339806.db2.gz FFNVBHKCPVRKAQ-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO CCN(C(=O)[C@H]1CC[N@@H+](C)C1)[C@H]1CCN(CCCCC(F)(F)F)C1 ZINC001567944960 1416339809 /nfs/dbraw/zinc/33/98/09/1416339809.db2.gz FFNVBHKCPVRKAQ-GJZGRUSLSA-N 1 3 349.441 2.594 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1(C[NH2+]CC2=CCCCC2)CCCC1 ZINC001568007834 1416357861 /nfs/dbraw/zinc/35/78/61/1416357861.db2.gz FRIQZMIOXYIMIV-UHFFFAOYSA-N 1 3 330.476 2.780 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC[C@H](CC[NH2+]Cc2ccc(F)cc2)C1 ZINC001568064068 1416388670 /nfs/dbraw/zinc/38/86/70/1416388670.db2.gz FXPFOAVIVVSXDX-IEBWSBKVSA-N 1 3 347.478 2.638 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](CC[NH2+]Cc2ccccc2F)C1 ZINC001568073850 1416396606 /nfs/dbraw/zinc/39/66/06/1416396606.db2.gz VRELAGYIFFOLDV-QGZVFWFLSA-N 1 3 349.494 2.886 10 0 EFAEHO CC(C)[C@H](C(=O)NCc1ccc(CNC/C=C/Cl)cc1)[NH+](C)C ZINC001568121942 1416418557 /nfs/dbraw/zinc/41/85/57/1416418557.db2.gz TZBMDCYYSVBEJG-JSNVTFDYSA-N 1 3 337.895 2.731 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H](C)C[NH2+]CCc1ccccc1 ZINC001568197420 1416439047 /nfs/dbraw/zinc/43/90/47/1416439047.db2.gz UNIMUJGRANLOHW-QUCCMNQESA-N 1 3 345.531 2.834 10 0 EFAEHO C[C@@H](C[NH2+]CC[C@H]1CCCC1(F)F)N(C)C(=O)CN(C)C1CCC1 ZINC001568277779 1416463650 /nfs/dbraw/zinc/46/36/50/1416463650.db2.gz FUVYMBPWOVUFMM-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc(OC)n1)C(=O)C1CCCC(F)C1 ZINC001568742474 1416545698 /nfs/dbraw/zinc/54/56/98/1416545698.db2.gz UHELFYSGAVQOMB-GJZGRUSLSA-N 1 3 337.439 2.557 10 0 EFAEHO Cc1ccccc1CN1CCCN(C(=O)[C@H]2CCCC[C@@H]2[NH3+])CC1 ZINC001645892267 1416580796 /nfs/dbraw/zinc/58/07/96/1416580796.db2.gz BNAOXBPQYJHBJT-OALUTQOASA-N 1 3 329.488 2.547 10 0 EFAEHO CN(C(=O)[C@H]1CC[N@H+](C)C1)C1CCN(CCCCC(F)(F)F)CC1 ZINC001690029935 1417139148 /nfs/dbraw/zinc/13/91/48/1417139148.db2.gz OBWSPFJOGODJNT-AWEZNQCLSA-N 1 3 349.441 2.594 10 0 EFAEHO CN(C(=O)[C@H]1CC[N@@H+](C)C1)C1CCN(CCCCC(F)(F)F)CC1 ZINC001690029935 1417139152 /nfs/dbraw/zinc/13/91/52/1417139152.db2.gz OBWSPFJOGODJNT-AWEZNQCLSA-N 1 3 349.441 2.594 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC12CC[NH+](CCCCCF)CC2)N(C)C ZINC001690127021 1417160243 /nfs/dbraw/zinc/16/02/43/1417160243.db2.gz ZFRORVPXKNQALR-IAGOWNOFSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC/C=C\c2ccccc2)C1)N(C)C ZINC001690343381 1417193591 /nfs/dbraw/zinc/19/35/91/1417193591.db2.gz QBOHDSUPMNCUJE-MKWTZARHSA-N 1 3 343.515 2.913 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CCC[C@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001690388208 1417206171 /nfs/dbraw/zinc/20/61/71/1417206171.db2.gz FEGRXPQQIHKRFT-ASIGSXEYSA-N 1 3 335.536 2.903 10 0 EFAEHO CCC/C=C/CC[N@H+]1CCC[C@H](CNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001690388208 1417206175 /nfs/dbraw/zinc/20/61/75/1417206175.db2.gz FEGRXPQQIHKRFT-ASIGSXEYSA-N 1 3 335.536 2.903 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H]1CCC[N@H+](CCCCCF)C1 ZINC001690498362 1417218372 /nfs/dbraw/zinc/21/83/72/1417218372.db2.gz HDGYSHAFZUFEEJ-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H]1CCC[N@@H+](CCCCCF)C1 ZINC001690498362 1417218376 /nfs/dbraw/zinc/21/83/76/1417218376.db2.gz HDGYSHAFZUFEEJ-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](NC(=O)CCCC[NH+](C)C)[C@H]1CCCN(Cc2cccnc2)C1 ZINC001690504710 1417219209 /nfs/dbraw/zinc/21/92/09/1417219209.db2.gz HOHBUHCKYYSUEU-MJGOQNOKSA-N 1 3 346.519 2.530 10 0 EFAEHO CCCCC[NH2+]C[C@@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001690739521 1417234572 /nfs/dbraw/zinc/23/45/72/1417234572.db2.gz SFUOIUWFPSAJBK-LPHOPBHVSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCCC[C@H]2CN(C)CC=C(C)C)CC[N@@H+]1C ZINC001692251754 1417267295 /nfs/dbraw/zinc/26/72/95/1417267295.db2.gz ANKYBIHRQPYTLP-GBESFXJTSA-N 1 3 335.536 2.996 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCCC[C@H]2CN(C)CC=C(C)C)CC[N@H+]1C ZINC001692251754 1417267300 /nfs/dbraw/zinc/26/73/00/1417267300.db2.gz ANKYBIHRQPYTLP-GBESFXJTSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H]1CC[C@H]([NH2+]CCCF)CC1 ZINC001698712480 1417316948 /nfs/dbraw/zinc/31/69/48/1417316948.db2.gz VPLOEMGONZVPBS-ULQDDVLXSA-N 1 3 327.488 2.626 10 0 EFAEHO CN(C)C1(C(=O)N2CCC3(C[NH+](CCCCCF)C3)CC2)CCC1 ZINC001698804269 1417337865 /nfs/dbraw/zinc/33/78/65/1417337865.db2.gz MGRUMZXLFSUUGP-UHFFFAOYSA-N 1 3 339.499 2.535 10 0 EFAEHO C[C@H](C[NH2+]CC/C=C/c1ccccc1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001698845771 1417339372 /nfs/dbraw/zinc/33/93/72/1417339372.db2.gz OLKCIWYNMIMLJF-BLRGSVSVSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@H](C[NH2+]CCCc1cccc(F)c1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001698846229 1417339901 /nfs/dbraw/zinc/33/99/01/1417339901.db2.gz YMWHVCWBJQRAHT-DLBZAZTESA-N 1 3 349.494 2.537 10 0 EFAEHO CN(CC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2CCCCCF)C1)C1CCC1 ZINC001699007880 1417366575 /nfs/dbraw/zinc/36/65/75/1417366575.db2.gz GPFSCDQBZCAKBP-FUHWJXTLSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2CCCCCF)C1)C1CCC1 ZINC001699007880 1417366577 /nfs/dbraw/zinc/36/65/77/1417366577.db2.gz GPFSCDQBZCAKBP-FUHWJXTLSA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@@H](CC[NH2+]C/C=C/c1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001699133615 1417398860 /nfs/dbraw/zinc/39/88/60/1417398860.db2.gz FKZKJPXITKCBRR-LJFWHQRKSA-N 1 3 329.488 2.526 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]Cc1csc(C)c1 ZINC001699158350 1417407917 /nfs/dbraw/zinc/40/79/17/1417407917.db2.gz DOISVRJHXOIMLU-RHSMWYFYSA-N 1 3 337.533 2.915 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C/C=C/CNC(=O)CN1CC[C@@H](C)C1 ZINC001699308735 1417418850 /nfs/dbraw/zinc/41/88/50/1417418850.db2.gz OGLIVRRBWLRKJV-IPLHWJFFSA-N 1 3 343.515 2.914 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C\C[NH2+][C@@H]2CCc3ccccc32)CC1 ZINC001699323874 1417419172 /nfs/dbraw/zinc/41/91/72/1417419172.db2.gz HCXCILAWAGHGPF-BBIZLLLXSA-N 1 3 341.499 2.668 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H](C)NC(=O)CN(C)CC(C)(C)C)cc1 ZINC001699380140 1417424435 /nfs/dbraw/zinc/42/44/35/1417424435.db2.gz ABQVEODJBHZHEQ-QGZVFWFLSA-N 1 3 333.520 2.610 10 0 EFAEHO CN(CCC[NH2+]Cc1cc2ccccc2s1)C(=O)[C@@H]1CCCN1C ZINC001699500335 1417426605 /nfs/dbraw/zinc/42/66/05/1417426605.db2.gz SWYYAFKCMAAVOX-KRWDZBQOSA-N 1 3 345.512 2.934 10 0 EFAEHO Cc1ccccc1C[NH2+]CCCN(C)C(=O)CN(C)CC(C)(C)C ZINC001699533193 1417428480 /nfs/dbraw/zinc/42/84/80/1417428480.db2.gz FJMIHRKOZKXLHR-UHFFFAOYSA-N 1 3 333.520 2.911 10 0 EFAEHO CC(C)(C(=O)N[C@H](C[NH2+]CCC1CCCC1)C1CC1)N1CCCC1 ZINC001699584803 1417432869 /nfs/dbraw/zinc/43/28/69/1417432869.db2.gz CHTRQQNZTXYGKZ-GOSISDBHSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)(C(=O)N[C@@H](C[NH2+]CCC1CCCC1)C1CC1)N1CCCC1 ZINC001699584806 1417433016 /nfs/dbraw/zinc/43/30/16/1417433016.db2.gz CHTRQQNZTXYGKZ-SFHVURJKSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NCC2([NH2+]CCCCCF)CC2)C1 ZINC001699662661 1417443616 /nfs/dbraw/zinc/44/36/16/1417443616.db2.gz ZVSTVYFDTMADBV-SFHVURJKSA-N 1 3 345.478 2.577 10 0 EFAEHO C[NH+](C)CCCCC(=O)NCC1(C)CCN(C/C=C/Cl)CC1 ZINC001699866324 1417485365 /nfs/dbraw/zinc/48/53/65/1417485365.db2.gz WLSABTUYDRIXDC-UXBLZVDNSA-N 1 3 329.916 2.689 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)C2CCC2)C[C@H]1C[NH2+]CCC1CCCC1 ZINC001699961563 1417526021 /nfs/dbraw/zinc/52/60/21/1417526021.db2.gz XTVXAYLIGUTTAF-FUHWJXTLSA-N 1 3 335.536 2.735 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C(C)C)N(C)C ZINC001700016622 1417540557 /nfs/dbraw/zinc/54/05/57/1417540557.db2.gz KNKCLSMDXWVIRZ-WMYYGJRPSA-N 1 3 335.536 2.994 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C(C)C)N(C)C ZINC001700016622 1417540560 /nfs/dbraw/zinc/54/05/60/1417540560.db2.gz KNKCLSMDXWVIRZ-WMYYGJRPSA-N 1 3 335.536 2.994 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H](CC[NH2+]CCC3CCCC3)C2)CCC1 ZINC001700064513 1417547605 /nfs/dbraw/zinc/54/76/05/1417547605.db2.gz CZEUUGFHCKLGMF-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001700094343 1417565189 /nfs/dbraw/zinc/56/51/89/1417565189.db2.gz SOWVMJYUXHGJPA-SFHVURJKSA-N 1 3 331.504 2.663 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001713209261 1418376390 /nfs/dbraw/zinc/37/63/90/1418376390.db2.gz OCNDWJMZZVIGKM-OKILXGFUSA-N 1 3 348.318 2.808 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@H](C[NH2+]CCCC2CCC2)C1)N(C)C ZINC001713238660 1418408063 /nfs/dbraw/zinc/40/80/63/1418408063.db2.gz KJGKBVSJPWWPDP-RTBURBONSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)CCC[NH2+]C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001713242923 1418411264 /nfs/dbraw/zinc/41/12/64/1418411264.db2.gz MYAYHUCENKCEPR-IBGZPJMESA-N 1 3 337.552 2.983 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@H]([N@H+](C)CCCCCF)C1 ZINC001713400941 1418507632 /nfs/dbraw/zinc/50/76/32/1418507632.db2.gz MEIFORPQJIYUHG-ROUUACIJSA-N 1 3 341.515 2.923 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@H]([N@@H+](C)CCCCCF)C1 ZINC001713400941 1418507635 /nfs/dbraw/zinc/50/76/35/1418507635.db2.gz MEIFORPQJIYUHG-ROUUACIJSA-N 1 3 341.515 2.923 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[C@H]1CCC[N@@H+]1CCCF ZINC001713442163 1418538699 /nfs/dbraw/zinc/53/86/99/1418538699.db2.gz HYDISLIQFQICPN-DLBZAZTESA-N 1 3 327.488 2.581 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[C@H]1CCC[N@H+]1CCCF ZINC001713442163 1418538704 /nfs/dbraw/zinc/53/87/04/1418538704.db2.gz HYDISLIQFQICPN-DLBZAZTESA-N 1 3 327.488 2.581 10 0 EFAEHO Cc1ccc2ccccc2c1C[NH2+]CCN(C)C(=O)[C@@H]1CCCN1C ZINC001713577556 1418559678 /nfs/dbraw/zinc/55/96/78/1418559678.db2.gz AIHPEJVJXUNEBN-FQEVSTJZSA-N 1 3 339.483 2.790 10 0 EFAEHO CCc1ccc(CC[NH2+]CCN(C)C(=O)CN2CCC(C)CC2)cc1 ZINC001714774029 1418632569 /nfs/dbraw/zinc/63/25/69/1418632569.db2.gz UKFISTTUKKITLE-UHFFFAOYSA-N 1 3 345.531 2.571 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)cs1 ZINC001715833112 1418686357 /nfs/dbraw/zinc/68/63/57/1418686357.db2.gz LEAWBRGNQZDRKB-ZGQVYYGYSA-N 1 3 347.528 2.835 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)cs1 ZINC001715833112 1418686360 /nfs/dbraw/zinc/68/63/60/1418686360.db2.gz LEAWBRGNQZDRKB-ZGQVYYGYSA-N 1 3 347.528 2.835 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC[C@H](C)NC(=O)[C@@H](C(C)C)N(C)C ZINC001716172757 1418711925 /nfs/dbraw/zinc/71/19/25/1418711925.db2.gz UPTGQLVDXCUQFW-PKOBYXMFSA-N 1 3 333.520 2.874 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c1 ZINC001716174366 1418713918 /nfs/dbraw/zinc/71/39/18/1418713918.db2.gz QLRYHWMFZWQQTR-SJLPKXTDSA-N 1 3 331.504 2.630 10 0 EFAEHO CCN(CC[NH2+]CC1CCC2(CC2)CC1)C(=O)CN1CC[C@H](C)C1 ZINC001716240049 1418733229 /nfs/dbraw/zinc/73/32/29/1418733229.db2.gz WEARJFJCZVRQFI-KRWDZBQOSA-N 1 3 335.536 2.737 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)nc1C)C(=O)CN(C)CC(C)(C)C ZINC001716240217 1418733599 /nfs/dbraw/zinc/73/35/99/1418733599.db2.gz YSDCWKMOPVTXNK-UHFFFAOYSA-N 1 3 348.535 2.614 10 0 EFAEHO CCN(CCNCc1cncc(C)c1)C(=O)[C@@H]1CCCC[N@@H+]1C(C)C ZINC001716243749 1418735963 /nfs/dbraw/zinc/73/59/63/1418735963.db2.gz MHYFRIFKODRDOY-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO CCN(CCNCc1cncc(C)c1)C(=O)[C@@H]1CCCC[N@H+]1C(C)C ZINC001716243749 1418735965 /nfs/dbraw/zinc/73/59/65/1418735965.db2.gz MHYFRIFKODRDOY-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@@H](NC/C=C/CNC(=O)CC[NH+](C)C)c1ccc(F)c(Cl)c1 ZINC001716339872 1418785080 /nfs/dbraw/zinc/78/50/80/1418785080.db2.gz OKOVGMHQGOFGFC-MUBLQREKSA-N 1 3 341.858 2.754 10 0 EFAEHO CC(C)(C)CC[NH2+]C/C=C\CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001716343550 1418788203 /nfs/dbraw/zinc/78/82/03/1418788203.db2.gz FONGKPQDHSSVCD-FQQSSWHASA-N 1 3 341.515 2.897 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)cs1 ZINC001716378585 1418860872 /nfs/dbraw/zinc/86/08/72/1418860872.db2.gz JSBHBOVEQBXKHE-OQPBWIOBSA-N 1 3 335.517 2.691 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)cs1 ZINC001716378585 1418860876 /nfs/dbraw/zinc/86/08/76/1418860876.db2.gz JSBHBOVEQBXKHE-OQPBWIOBSA-N 1 3 335.517 2.691 10 0 EFAEHO CCc1ccc(C[NH2+]C/C=C/CNC(=O)[C@H]2CCCCN2CC)cc1 ZINC001716379394 1418861259 /nfs/dbraw/zinc/86/12/59/1418861259.db2.gz QEROWNSSSHFHJK-ROUKRRSUSA-N 1 3 343.515 2.885 10 0 EFAEHO CCc1ccc(C[NH2+]C/C=C\CNC(=O)[C@@H]2CCCCN2CC)cc1 ZINC001716379392 1418861340 /nfs/dbraw/zinc/86/13/40/1418861340.db2.gz QEROWNSSSHFHJK-HCZHMGAMSA-N 1 3 343.515 2.885 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C\C[NH2+]Cc1cc(C)cc(C)c1 ZINC001716380269 1418862482 /nfs/dbraw/zinc/86/24/82/1418862482.db2.gz ZMNRLTVQADKLLQ-PXDRNWIDSA-N 1 3 343.515 2.940 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCCC[C@H]1C[NH2+]C/C=C\Cl)CC(C)(C)C ZINC001716518700 1418904600 /nfs/dbraw/zinc/90/46/00/1418904600.db2.gz RROWHYXCFKIQQZ-QUAUAXPMSA-N 1 3 343.943 2.981 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCCC[C@@H]1C[NH2+]C/C=C\Cl)CC(C)(C)C ZINC001716518699 1418904689 /nfs/dbraw/zinc/90/46/89/1418904689.db2.gz RROWHYXCFKIQQZ-LWALAHDXSA-N 1 3 343.943 2.981 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[NH2+]CC[C@@H]2CCCC2(F)F)CCC1 ZINC001716546487 1418910434 /nfs/dbraw/zinc/91/04/34/1418910434.db2.gz UQABDHPGMIMXQC-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCN1CCC1=CCCCC1 ZINC001716654080 1418942108 /nfs/dbraw/zinc/94/21/08/1418942108.db2.gz VDPZOSIOGBKLPY-RTBURBONSA-N 1 3 333.520 2.942 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCN1CCC1=CCCCC1 ZINC001716654080 1418942114 /nfs/dbraw/zinc/94/21/14/1418942114.db2.gz VDPZOSIOGBKLPY-RTBURBONSA-N 1 3 333.520 2.942 10 0 EFAEHO CC/C=C/CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)[C@@H]1CCCN1C ZINC001716705357 1418964060 /nfs/dbraw/zinc/96/40/60/1418964060.db2.gz XCWZSNUBAZTKTB-GEYRTDADSA-N 1 3 333.520 2.939 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC[C@@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001716724303 1418975299 /nfs/dbraw/zinc/97/52/99/1418975299.db2.gz ZFXUVWDXZNYTNA-ROUKRRSUSA-N 1 3 335.536 2.999 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC[C@@]2(CCN(C(=O)CN(C)CCC)C2)C1 ZINC001716724303 1418975301 /nfs/dbraw/zinc/97/53/01/1418975301.db2.gz ZFXUVWDXZNYTNA-ROUKRRSUSA-N 1 3 335.536 2.999 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(C1)CC[NH+](CCCCCF)CC2 ZINC001716728668 1418978694 /nfs/dbraw/zinc/97/86/94/1418978694.db2.gz WINUVAJZSLYNCR-UHFFFAOYSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CCCc2ccccc2)C[C@H]1C ZINC001716770964 1419001125 /nfs/dbraw/zinc/00/11/25/1419001125.db2.gz PPODWFVBJKTGEI-QUCCMNQESA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001716777891 1419004297 /nfs/dbraw/zinc/00/42/97/1419004297.db2.gz ZRZNNUDMELUNAL-UONOGXRCSA-N 1 3 348.318 2.759 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001716777891 1419004300 /nfs/dbraw/zinc/00/43/00/1419004300.db2.gz ZRZNNUDMELUNAL-UONOGXRCSA-N 1 3 348.318 2.759 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)N(CCNCCF)Cc2ccccc2)C1 ZINC001717006253 1419142576 /nfs/dbraw/zinc/14/25/76/1419142576.db2.gz HJEKDCPSFZEPHE-RTBURBONSA-N 1 3 349.494 2.695 10 0 EFAEHO CCC[NH2+]CCN(Cc1ccccc1)C(=O)CN1[C@H](C)CC[C@@H]1C ZINC001717006572 1419143003 /nfs/dbraw/zinc/14/30/03/1419143003.db2.gz UDYROFBTVWOINE-HDICACEKSA-N 1 3 331.504 2.888 10 0 EFAEHO CCC/C=C/CC[N@H+]1C[C@H]2CN(C(=O)[C@@H]3CCCCN3CC)C[C@H]2C1 ZINC001717014909 1419150750 /nfs/dbraw/zinc/15/07/50/1419150750.db2.gz KCDYECBCFJOSQW-RGOVZJGCSA-N 1 3 347.547 2.997 10 0 EFAEHO CCC/C=C/CC[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3CCCCN3CC)C[C@H]2C1 ZINC001717014909 1419150754 /nfs/dbraw/zinc/15/07/54/1419150754.db2.gz KCDYECBCFJOSQW-RGOVZJGCSA-N 1 3 347.547 2.997 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](CC[NH2+]CCC2CCCCC2)C1 ZINC001717076949 1419190097 /nfs/dbraw/zinc/19/00/97/1419190097.db2.gz RPCCVBJDQFBRNW-OALUTQOASA-N 1 3 335.536 2.879 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CC[C@@H](CC[NH2+]CCCCC(F)(F)F)C1 ZINC001717099840 1419207433 /nfs/dbraw/zinc/20/74/33/1419207433.db2.gz FSPLFBITFJFSIC-CYBMUJFWSA-N 1 3 346.397 2.513 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+]Cc2cccc(C)c2)C1 ZINC001717107592 1419213064 /nfs/dbraw/zinc/21/30/64/1419213064.db2.gz NPNQMUIAMCUZQV-GOSISDBHSA-N 1 3 331.504 2.665 10 0 EFAEHO C[C@H](C(=O)N[C@H]1CC[C@H](C[NH2+]CCCF)CC1)N1CCCCCC1 ZINC001717123884 1419224939 /nfs/dbraw/zinc/22/49/39/1419224939.db2.gz ZOKHWIIFONZDRA-KZNAEPCWSA-N 1 3 341.515 2.875 10 0 EFAEHO CCCCCC[NH+]1CCC2(CN(C(=O)C3(N(C)C)CCC3)C2)CC1 ZINC001717128425 1419227971 /nfs/dbraw/zinc/22/79/71/1419227971.db2.gz ZMFPHPQAIRMACP-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO CC/C=C/CCN1Cc2ccccc2C[C@H]1CNC(=O)CC[NH+](C)C ZINC001717243816 1419285657 /nfs/dbraw/zinc/28/56/57/1419285657.db2.gz LVEYBIWNUXZMFG-XJDXJNMNSA-N 1 3 343.515 2.838 10 0 EFAEHO CC(C)CN1Cc2ccccc2C[C@H]1CNC(=O)CCCC[NH+](C)C ZINC001717245243 1419288405 /nfs/dbraw/zinc/28/84/05/1419288405.db2.gz PLZCSFYEOIEOFY-FQEVSTJZSA-N 1 3 345.531 2.917 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@@H]1C[N@H+](C)CC=C(C)C ZINC001717365449 1419358252 /nfs/dbraw/zinc/35/82/52/1419358252.db2.gz NDQGUVKZXUHVTQ-IAGOWNOFSA-N 1 3 327.488 2.555 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@@H]1C[N@@H+](C)CC=C(C)C ZINC001717365449 1419358256 /nfs/dbraw/zinc/35/82/56/1419358256.db2.gz NDQGUVKZXUHVTQ-IAGOWNOFSA-N 1 3 327.488 2.555 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC(C)(C)C[NH2+]CCc2ccccc2)CCC1 ZINC001717454375 1419401161 /nfs/dbraw/zinc/40/11/61/1419401161.db2.gz ZAKNENBUJLVRIE-UHFFFAOYSA-N 1 3 345.531 2.788 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@@H](NC(=O)C23CCCN2CCC3)C(C)(C)C1 ZINC001717582891 1419455242 /nfs/dbraw/zinc/45/52/42/1419455242.db2.gz RSBSAGXBXBJILM-KEGWNNHHSA-N 1 3 333.520 2.798 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@@H](NC(=O)C23CCCN2CCC3)C(C)(C)C1 ZINC001717582891 1419455245 /nfs/dbraw/zinc/45/52/45/1419455245.db2.gz RSBSAGXBXBJILM-KEGWNNHHSA-N 1 3 333.520 2.798 10 0 EFAEHO C[C@H](CCC[NH2+]CC1CC2(CCC2)C1)NC(=O)CN1CC[C@@H](C)C1 ZINC001717685858 1419505950 /nfs/dbraw/zinc/50/59/50/1419505950.db2.gz ZLYRAWLQXYALCF-IAGOWNOFSA-N 1 3 335.536 2.783 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCCC(F)(F)F)[C@@H]1C ZINC001717803080 1419548858 /nfs/dbraw/zinc/54/88/58/1419548858.db2.gz SAYKMYOBWIVVAN-UONOGXRCSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)CCC[NH2+][C@@H]1C[C@H](C)N(C(=O)CN(C)CC(C)(C)C)C1 ZINC001717821109 1419557301 /nfs/dbraw/zinc/55/73/01/1419557301.db2.gz AMNYQFFWWGCBOS-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[NH2+][C@H]2CCc3ccccc32)CCC1 ZINC001723040964 1424409014 /nfs/dbraw/zinc/40/90/14/1424409014.db2.gz ZFFLPUWHJAZYFH-SFHVURJKSA-N 1 3 329.488 2.596 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[NH2+]Cc1cccc(F)c1 ZINC001723202330 1424450759 /nfs/dbraw/zinc/45/07/59/1424450759.db2.gz BTJGRRZLTKQHGA-SFHVURJKSA-N 1 3 335.467 2.638 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[NH2+]CCc1ccccc1 ZINC001723203485 1424451839 /nfs/dbraw/zinc/45/18/39/1424451839.db2.gz JWOXVXWAZXGVIR-IBGZPJMESA-N 1 3 331.504 2.542 10 0 EFAEHO CCC/C=C\CC[NH2+][C@@H]1CCN(C(=O)Cc2c[nH]cn2)C[C@@H]1CC ZINC001723380411 1424481009 /nfs/dbraw/zinc/48/10/09/1424481009.db2.gz YOWAMRIVTVULAD-PRVDXRAFSA-N 1 3 332.492 2.915 10 0 EFAEHO CC(C)CCC[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001723558253 1424522272 /nfs/dbraw/zinc/52/22/72/1424522272.db2.gz GSPNWYLAUMVSMH-LJQANCHMSA-N 1 3 341.515 2.874 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001723718961 1424566239 /nfs/dbraw/zinc/56/62/39/1424566239.db2.gz NCCUGZLTCGTLPC-ZMBJWTFHSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001723718961 1424566245 /nfs/dbraw/zinc/56/62/45/1424566245.db2.gz NCCUGZLTCGTLPC-ZMBJWTFHSA-N 1 3 333.520 2.751 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CCCCC(F)(F)F)CCN1C(=O)Cc1c[nH]cn1 ZINC001723865005 1424598861 /nfs/dbraw/zinc/59/88/61/1424598861.db2.gz ZULSGSTZDABLRX-QWHCGFSZSA-N 1 3 346.397 2.654 10 0 EFAEHO CC[N@@H+]1CCCC[C@H]1C(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001723981652 1424616573 /nfs/dbraw/zinc/61/65/73/1424616573.db2.gz JRQMPDNWQMUZIR-KBPBESRZSA-N 1 3 348.318 2.760 10 0 EFAEHO CC[N@H+]1CCCC[C@H]1C(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001723981652 1424616574 /nfs/dbraw/zinc/61/65/74/1424616574.db2.gz JRQMPDNWQMUZIR-KBPBESRZSA-N 1 3 348.318 2.760 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2CC=C(C)C ZINC001724115605 1424663804 /nfs/dbraw/zinc/66/38/04/1424663804.db2.gz XKQNUGBOXOKZPL-FGTMMUONSA-N 1 3 339.499 2.698 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2CC=C(C)C ZINC001724115605 1424663808 /nfs/dbraw/zinc/66/38/08/1424663808.db2.gz XKQNUGBOXOKZPL-FGTMMUONSA-N 1 3 339.499 2.698 10 0 EFAEHO CCCCC[NH2+]C[C@@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001724247854 1424712157 /nfs/dbraw/zinc/71/21/57/1424712157.db2.gz ARTAGYXSHXFRSH-LJQANCHMSA-N 1 3 325.541 2.983 10 0 EFAEHO CCCCC[NH2+]C[C@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001724247853 1424712341 /nfs/dbraw/zinc/71/23/41/1424712341.db2.gz ARTAGYXSHXFRSH-IBGZPJMESA-N 1 3 325.541 2.983 10 0 EFAEHO CC(C)CCC[NH2+]C[C@]1(C)CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001724255685 1424715270 /nfs/dbraw/zinc/71/52/70/1424715270.db2.gz XQVNJQYYIGUASI-FQEVSTJZSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](CC[NH2+]Cc2ccccc2)C1)N(C)C ZINC001724710346 1424929264 /nfs/dbraw/zinc/92/92/64/1424929264.db2.gz GXPSOBPEYGFOTL-OALUTQOASA-N 1 3 331.504 2.601 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](CC[NH2+]CCC3CCCC3)C2)C1 ZINC001724719083 1424938503 /nfs/dbraw/zinc/93/85/03/1424938503.db2.gz GVEIBRWXEXJXTK-PKOBYXMFSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)C[NH2+]CC[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001724745113 1424974350 /nfs/dbraw/zinc/97/43/50/1424974350.db2.gz FDSRAVHTAZBWQH-KRWDZBQOSA-N 1 3 331.504 2.846 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@H](CC[NH2+]CCCF)C2)c1 ZINC001724746025 1424975525 /nfs/dbraw/zinc/97/55/25/1424975525.db2.gz GYFZESMCZCXQAV-INIZCTEOSA-N 1 3 335.467 2.550 10 0 EFAEHO CCC[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001724749981 1424979138 /nfs/dbraw/zinc/97/91/38/1424979138.db2.gz AAIVZEGOJPYADU-GPMSIDNRSA-N 1 3 341.515 2.874 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2CC[C@H](C[NH2+]CCF)CC2)c1 ZINC001724755068 1424984868 /nfs/dbraw/zinc/98/48/68/1424984868.db2.gz MPUFNOUOPRTXIZ-RZDIXWSQSA-N 1 3 335.467 2.596 10 0 EFAEHO CCCCC[NH+]1CCC2(CCN(C(=O)[C@@H]3CCCN3C)CC2)CC1 ZINC001725013506 1425227239 /nfs/dbraw/zinc/22/72/39/1425227239.db2.gz ATXQRDBNOJEKRK-SFHVURJKSA-N 1 3 335.536 2.975 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001725091062 1425294372 /nfs/dbraw/zinc/29/43/72/1425294372.db2.gz LUBDLGHKNJKTOS-MSOLQXFVSA-N 1 3 345.531 2.895 10 0 EFAEHO CCC/C=C/CC[N@H+]1C[C@@H]2C(CNC(=O)C3(N(C)C)CCC3)[C@@H]2C1 ZINC001725309423 1425458429 /nfs/dbraw/zinc/45/84/29/1425458429.db2.gz MTOGSFAQNBSLIA-AOAKWHLMSA-N 1 3 333.520 2.511 10 0 EFAEHO CCC/C=C/CC[N@@H+]1C[C@@H]2C(CNC(=O)C3(N(C)C)CCC3)[C@@H]2C1 ZINC001725309423 1425458432 /nfs/dbraw/zinc/45/84/32/1425458432.db2.gz MTOGSFAQNBSLIA-AOAKWHLMSA-N 1 3 333.520 2.511 10 0 EFAEHO Cc1cc(C[NH2+]CCC[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cs1 ZINC001725416405 1425560862 /nfs/dbraw/zinc/56/08/62/1425560862.db2.gz LAOBYFLQVQEUGO-HUUCEWRRSA-N 1 3 337.533 2.773 10 0 EFAEHO C[C@@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]CCCc1ccsc1 ZINC001725489493 1425615314 /nfs/dbraw/zinc/61/53/14/1425615314.db2.gz LUUIHZPRGTWENN-HNNXBMFYSA-N 1 3 337.533 2.602 10 0 EFAEHO CC(C)=CC[NH2+][C@H](C)CN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001725508177 1425627076 /nfs/dbraw/zinc/62/70/76/1425627076.db2.gz WSYOFTBBFODTIM-CRAIPNDOSA-N 1 3 327.488 2.602 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]CCCCc2ccccc2)CN1C(=O)CN1CCCC1 ZINC001725598237 1425684230 /nfs/dbraw/zinc/68/42/30/1425684230.db2.gz UFWYDJGODSUSHN-AZUAARDMSA-N 1 3 343.515 2.684 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CCCCc2ccccc2)CN1C(=O)CN1CCCC1 ZINC001725598252 1425684644 /nfs/dbraw/zinc/68/46/44/1425684644.db2.gz UFWYDJGODSUSHN-UYAOXDASSA-N 1 3 343.515 2.684 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2cccc(F)c2)[C@H]1C ZINC001725602770 1425690107 /nfs/dbraw/zinc/69/01/07/1425690107.db2.gz GHRIJOJYCKQARJ-VQIMIIECSA-N 1 3 349.494 2.678 10 0 EFAEHO CC(C)=CC[NH2+][C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)[C@@H]1C ZINC001725607566 1425697401 /nfs/dbraw/zinc/69/74/01/1425697401.db2.gz POKMEUIIJCXNHT-APWZRJJASA-N 1 3 329.488 2.907 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)[C@H]1C ZINC001725607568 1425698025 /nfs/dbraw/zinc/69/80/25/1425698025.db2.gz POKMEUIIJCXNHT-QFBILLFUSA-N 1 3 329.488 2.907 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@]12CCC[C@@H]1[N@H+](CC=C(C)C)CC2 ZINC001725608688 1425698402 /nfs/dbraw/zinc/69/84/02/1425698402.db2.gz MMBNRBJYZDTDHK-JENIJYKNSA-N 1 3 339.499 2.746 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@]12CCC[C@@H]1[N@@H+](CC=C(C)C)CC2 ZINC001725608688 1425698407 /nfs/dbraw/zinc/69/84/07/1425698407.db2.gz MMBNRBJYZDTDHK-JENIJYKNSA-N 1 3 339.499 2.746 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NCC1=CCN(Cc2ccc(C)cc2)CC1 ZINC001725825762 1425887828 /nfs/dbraw/zinc/88/78/28/1425887828.db2.gz BDWOLFMRNDRUSA-UHFFFAOYSA-N 1 3 343.515 2.975 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NCC1=CCN(Cc2ccc(C)cc2)CC1 ZINC001725825762 1425887836 /nfs/dbraw/zinc/88/78/36/1425887836.db2.gz BDWOLFMRNDRUSA-UHFFFAOYSA-N 1 3 343.515 2.975 10 0 EFAEHO CCC[NH2+]Cc1ccc(CNC(=O)CN2[C@@H](C)CC[C@@H]2C)c(F)c1 ZINC001725833895 1425901819 /nfs/dbraw/zinc/90/18/19/1425901819.db2.gz OTQBXXVLZXMGHM-GJZGRUSLSA-N 1 3 335.467 2.814 10 0 EFAEHO CC[C@@H]([NH2+]C[C@@H]1CNCCC1(F)F)c1ccc(C(=O)OC)cc1 ZINC000925779607 717686590 /nfs/dbraw/zinc/68/65/90/717686590.db2.gz YMMDJDYLHOWOSQ-LSDHHAIUSA-N 1 3 326.387 2.759 10 0 EFAEHO CCOC(=O)C1([C@H](C)NCc2cscc2Cl)CC[NH2+]CC1 ZINC000925769862 717888575 /nfs/dbraw/zinc/88/85/75/717888575.db2.gz GJWQUXBWZUHVSH-NSHDSACASA-N 1 3 330.881 2.813 10 0 EFAEHO [NH3+]C1CCN(CCN[C@@H]2CCc3cc(Cl)cc(Cl)c32)CC1 ZINC000925814129 718844598 /nfs/dbraw/zinc/84/45/98/718844598.db2.gz GOVYFXFSGGFRPK-OAHLLOKOSA-N 1 3 328.287 2.993 10 0 EFAEHO CCS(=O)(=O)c1ccccc1CC[NH2+][C@H]1C[C@@H](N)CC(C)(C)C1 ZINC000925832036 719455337 /nfs/dbraw/zinc/45/53/37/719455337.db2.gz FOMZLTDOZBZCKQ-CVEARBPZSA-N 1 3 338.517 2.518 10 0 EFAEHO CCS(=O)(=O)c1ccccc1CCN[C@H]1C[C@@H]([NH3+])CC(C)(C)C1 ZINC000925832036 719455340 /nfs/dbraw/zinc/45/53/40/719455340.db2.gz FOMZLTDOZBZCKQ-CVEARBPZSA-N 1 3 338.517 2.518 10 0 EFAEHO CCOC(=O)C1([C@@H](C)NCc2c(F)cc(C)cc2F)CC[NH2+]CC1 ZINC000925873812 719932003 /nfs/dbraw/zinc/93/20/03/719932003.db2.gz DLLYLTNVDUWALJ-CYBMUJFWSA-N 1 3 340.414 2.684 10 0 EFAEHO CCN1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2cnn(C3CCC3)c2)CC1 ZINC000924953663 721864020 /nfs/dbraw/zinc/86/40/20/721864020.db2.gz RZXQSMIMADNVGG-IRXDYDNUSA-N 1 3 333.524 2.532 10 0 EFAEHO C[C@@H](N[C@@H](C)c1ccnnc1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000924962848 721906763 /nfs/dbraw/zinc/90/67/63/721906763.db2.gz GVLSHJZZFQWOPW-LSDHHAIUSA-N 1 3 343.450 2.779 10 0 EFAEHO COC(=O)[C@@H]1[C@H](C[NH2+]CC[C@H](C)N(C)Cc2ccccc2)C1(F)F ZINC000894323930 722092596 /nfs/dbraw/zinc/09/25/96/722092596.db2.gz SJSKCTCBKHRTNI-BPUTZDHNSA-N 1 3 340.414 2.541 10 0 EFAEHO COC(=O)[C@@H]1[C@@H](CNCc2ccccc2C[N@H+](C)C(C)C)C1(F)F ZINC000894385081 722676688 /nfs/dbraw/zinc/67/66/88/722676688.db2.gz PTOFYSLVDRBJGK-CVEARBPZSA-N 1 3 340.414 2.671 10 0 EFAEHO COC(=O)[C@@H]1[C@@H](CNCc2ccccc2C[N@@H+](C)C(C)C)C1(F)F ZINC000894385081 722676690 /nfs/dbraw/zinc/67/66/90/722676690.db2.gz PTOFYSLVDRBJGK-CVEARBPZSA-N 1 3 340.414 2.671 10 0 EFAEHO CCO[C@@H]1C[C@H](N[C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)[C@H]1OC ZINC000894467186 722747292 /nfs/dbraw/zinc/74/72/92/722747292.db2.gz XKLPJODYKKDNOX-HQZQWKOLSA-N 1 3 344.499 2.822 10 0 EFAEHO CCO[C@@H]1C[C@H](N[C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)[C@H]1OC ZINC000894467186 722747294 /nfs/dbraw/zinc/74/72/94/722747294.db2.gz XKLPJODYKKDNOX-HQZQWKOLSA-N 1 3 344.499 2.822 10 0 EFAEHO CCOC(=O)C1(C[NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)CC1 ZINC000894481281 722752788 /nfs/dbraw/zinc/75/27/88/722752788.db2.gz VFZXKYOEFZDSFO-FHWLQOOXSA-N 1 3 342.483 2.972 10 0 EFAEHO CC(C)[N@@H+]1CC[C@@H](N(C)C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000909436898 723196279 /nfs/dbraw/zinc/19/62/79/723196279.db2.gz WLLYLDKZVFONFZ-QGZVFWFLSA-N 1 3 328.460 2.846 10 0 EFAEHO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000909436898 723196280 /nfs/dbraw/zinc/19/62/80/723196280.db2.gz WLLYLDKZVFONFZ-QGZVFWFLSA-N 1 3 328.460 2.846 10 0 EFAEHO COc1ccc([C@H](NC(C)C)C(=O)N(C)[C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000896621873 723410527 /nfs/dbraw/zinc/41/05/27/723410527.db2.gz BVDXNZOURJKIET-AYBZRNKSSA-N 1 3 347.503 2.675 10 0 EFAEHO COc1ccc([C@H](NC(C)C)C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000896621873 723410532 /nfs/dbraw/zinc/41/05/32/723410532.db2.gz BVDXNZOURJKIET-AYBZRNKSSA-N 1 3 347.503 2.675 10 0 EFAEHO CC[C@H](C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C(=O)OC ZINC000895138065 723431024 /nfs/dbraw/zinc/43/10/24/723431024.db2.gz BRGUNSXKLBQHPD-MANSERQUSA-N 1 3 330.472 2.828 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)CC1(C)C ZINC000895508520 724174112 /nfs/dbraw/zinc/17/41/12/724174112.db2.gz SORIJIDQMBIICS-IRXDYDNUSA-N 1 3 343.471 2.577 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC[N@@H+]1C ZINC000918861060 728936050 /nfs/dbraw/zinc/93/60/50/728936050.db2.gz IBOGFWRANDLTSZ-NZSAHSFTSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC[N@H+]1C ZINC000918861060 728936051 /nfs/dbraw/zinc/93/60/51/728936051.db2.gz IBOGFWRANDLTSZ-NZSAHSFTSA-N 1 3 344.503 2.605 10 0 EFAEHO CC[N@@H+]1CCCN(C(=O)c2ccc(NC3=NCCC3)cc2)[C@@H](C)C1 ZINC000910267560 727425309 /nfs/dbraw/zinc/42/53/09/727425309.db2.gz RWKRPSUTGAVXAI-HNNXBMFYSA-N 1 3 328.460 2.847 10 0 EFAEHO CC[N@H+]1CCCN(C(=O)c2ccc(NC3=NCCC3)cc2)[C@@H](C)C1 ZINC000910267560 727425310 /nfs/dbraw/zinc/42/53/10/727425310.db2.gz RWKRPSUTGAVXAI-HNNXBMFYSA-N 1 3 328.460 2.847 10 0 EFAEHO CC[C@H](C)[C@@H](N)C(=O)Nc1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000183039266 727933163 /nfs/dbraw/zinc/93/31/63/727933163.db2.gz GDWVYAKMNXVSBU-KBXCAEBGSA-N 1 3 332.492 2.529 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]CCCc2ccsc2)CC1)N1CCCC1 ZINC001569412107 1085188440 /nfs/dbraw/zinc/18/84/40/1085188440.db2.gz XDPFMIRQNJAJOX-UHFFFAOYSA-N 1 3 349.544 2.794 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@H](NC(=O)C(C)(C)N1CCCC1)C1CCCC1 ZINC001569606359 1085431780 /nfs/dbraw/zinc/43/17/80/1085431780.db2.gz FFOLVONHLLDBFD-DOTOQJQBSA-N 1 3 341.515 2.874 10 0 EFAEHO CN(CC(=O)N1CC[C@](C)(C[NH2+]C/C=C/Cl)C1)CC(C)(C)C ZINC001569683932 1085515349 /nfs/dbraw/zinc/51/53/49/1085515349.db2.gz UCUGLYIJXCRKNX-DBWMJRBXSA-N 1 3 329.916 2.545 10 0 EFAEHO C[C@@H]1CN(C(=O)CN2CCC(C)CC2)C[C@@H]1C[NH2+]CCC(C)(C)C ZINC001569850518 1085673853 /nfs/dbraw/zinc/67/38/53/1085673853.db2.gz FXCHWMSZPWVBOJ-MSOLQXFVSA-N 1 3 337.552 2.839 10 0 EFAEHO C[C@H]1CN(C(=O)CN2CCC(C)CC2)C[C@H]1C[NH2+]CCC(C)(C)C ZINC001569850520 1085674323 /nfs/dbraw/zinc/67/43/23/1085674323.db2.gz FXCHWMSZPWVBOJ-ZWKOTPCHSA-N 1 3 337.552 2.839 10 0 EFAEHO CCCC[NH2+]CC[C@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001570001985 1085843003 /nfs/dbraw/zinc/84/30/03/1085843003.db2.gz JMCDCWYIFFRUQG-QFBILLFUSA-N 1 3 341.515 2.827 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CC[C@H](CC[NH2+]CC2CCCCCC2)C1 ZINC001570004235 1085846046 /nfs/dbraw/zinc/84/60/46/1085846046.db2.gz BSEWGAQUTREREU-KRWDZBQOSA-N 1 3 332.492 2.751 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](CC[NH2+]C/C=C/c2ccccc2)C1 ZINC001570018638 1085867109 /nfs/dbraw/zinc/86/71/09/1085867109.db2.gz HEMTXLJXQJDUAY-AQDCRGGLSA-N 1 3 341.499 2.624 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](CC[NH2+]C[C@H]2CCC(F)(F)C2)C1 ZINC001570021608 1085868409 /nfs/dbraw/zinc/86/84/09/1085868409.db2.gz HWBZPGAUBPCDLX-CVEARBPZSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](CC[NH2+]C[C@H]2CCC(F)(F)C2)C1 ZINC001570021610 1085868653 /nfs/dbraw/zinc/86/86/53/1085868653.db2.gz HWBZPGAUBPCDLX-HOTGVXAUSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)=CCN1CCc2c(CNC(=O)CCC[NH+](C)C)cccc2C1 ZINC001570078113 1085934769 /nfs/dbraw/zinc/93/47/69/1085934769.db2.gz MOIHAZNHYKVGLW-UHFFFAOYSA-N 1 3 343.515 2.969 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)CN(C)C(C)C)C2 ZINC001570274594 1086116760 /nfs/dbraw/zinc/11/67/60/1086116760.db2.gz HBYDHVLAVZUKRX-PXDRNWIDSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@]2(C1)CCCN(C(=O)CN(C)C(C)C)C2 ZINC001570274594 1086116768 /nfs/dbraw/zinc/11/67/68/1086116768.db2.gz HBYDHVLAVZUKRX-PXDRNWIDSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCCC[C@H]2C[NH2+]CCCF)C1 ZINC001570514393 1086299835 /nfs/dbraw/zinc/29/98/35/1086299835.db2.gz XBLSIKVIBDKANE-MAUKXSAKSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)=CCN(C)C[C@@H]1CCCN1C(=O)C12CCC[NH+](CCC1)C2 ZINC001570535132 1086327127 /nfs/dbraw/zinc/32/71/27/1086327127.db2.gz XLOIWJJCEWAQIK-SFHVURJKSA-N 1 3 333.520 2.751 10 0 EFAEHO C[N@H+](CCCCC(F)(F)F)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001570545624 1086345316 /nfs/dbraw/zinc/34/53/16/1086345316.db2.gz WKBPBUCISPCFER-OAHLLOKOSA-N 1 3 349.441 2.738 10 0 EFAEHO C[N@@H+](CCCCC(F)(F)F)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001570545624 1086345330 /nfs/dbraw/zinc/34/53/30/1086345330.db2.gz WKBPBUCISPCFER-OAHLLOKOSA-N 1 3 349.441 2.738 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@@H]1CCCCC[N@@H+]1CC=C(C)C ZINC001570822867 1086542642 /nfs/dbraw/zinc/54/26/42/1086542642.db2.gz MVVLWCLVSYGJSL-ZWKOTPCHSA-N 1 3 341.515 2.993 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NC[C@@H]1CCCCC[N@H+]1CC=C(C)C ZINC001570822867 1086542649 /nfs/dbraw/zinc/54/26/49/1086542649.db2.gz MVVLWCLVSYGJSL-ZWKOTPCHSA-N 1 3 341.515 2.993 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@H+](CCCCCF)CC1(C)C)N(C)C ZINC001570907669 1086606002 /nfs/dbraw/zinc/60/60/02/1086606002.db2.gz LWPDYVCXEOLYKK-JKSUJKDBSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@@H+](CCCCCF)CC1(C)C)N(C)C ZINC001570907669 1086606006 /nfs/dbraw/zinc/60/60/06/1086606006.db2.gz LWPDYVCXEOLYKK-JKSUJKDBSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)=CC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)[C@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001570955842 1086622531 /nfs/dbraw/zinc/62/25/31/1086622531.db2.gz SZSTWBOYDVYACO-CADBVGFASA-N 1 3 333.520 2.511 10 0 EFAEHO CC(C)=CC[N@H+]1C[C@@H]2[C@@H](CNC(=O)[C@H](C)N3CCCCCC3)[C@@H]2C1 ZINC001570955842 1086622533 /nfs/dbraw/zinc/62/25/33/1086622533.db2.gz SZSTWBOYDVYACO-CADBVGFASA-N 1 3 333.520 2.511 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CC2(C1)CCC[N@H+](CC1CC1)C2 ZINC001571049035 1086655213 /nfs/dbraw/zinc/65/52/13/1086655213.db2.gz ORHLHOJXASDGDM-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CC2(C1)CCC[N@@H+](CC1CC1)C2 ZINC001571049035 1086655215 /nfs/dbraw/zinc/65/52/15/1086655215.db2.gz ORHLHOJXASDGDM-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CCCC2(CN(C(=O)CN(C)CCC)C2)C1 ZINC001571049202 1086655430 /nfs/dbraw/zinc/65/54/30/1086655430.db2.gz RAJKGKNZGWLHDN-BQYQJAHWSA-N 1 3 335.536 2.999 10 0 EFAEHO CCC/C=C/CC[N@H+]1CCCC2(CN(C(=O)CN(C)CCC)C2)C1 ZINC001571049202 1086655431 /nfs/dbraw/zinc/65/54/31/1086655431.db2.gz RAJKGKNZGWLHDN-BQYQJAHWSA-N 1 3 335.536 2.999 10 0 EFAEHO CN(C)C1(C(=O)N(C)[C@H](C[NH2+]CCc2ccccc2)C2CC2)CCC1 ZINC001571361230 1086756201 /nfs/dbraw/zinc/75/62/01/1086756201.db2.gz JXVVGTZKKLIUSJ-LJQANCHMSA-N 1 3 343.515 2.540 10 0 EFAEHO CN(C)C1(C(=O)N(C)[C@@H](C[NH2+]CCc2cccs2)C2CC2)CCC1 ZINC001571361147 1086756384 /nfs/dbraw/zinc/75/63/84/1086756384.db2.gz HUUQUSHHWLDAMM-KRWDZBQOSA-N 1 3 349.544 2.602 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H]2CC[C@H](C[NH2+]C/C=C\Cl)C2)c1 ZINC001571550938 1086954471 /nfs/dbraw/zinc/95/44/71/1086954471.db2.gz WBUDXRCXCZOTKR-MOPUDMPASA-N 1 3 349.906 2.989 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H]2CC[C@@H](C[NH2+]C/C=C/Cl)C2)c1 ZINC001571550939 1086954559 /nfs/dbraw/zinc/95/45/59/1086954559.db2.gz WBUDXRCXCZOTKR-ZRPGBGELSA-N 1 3 349.906 2.989 10 0 EFAEHO CCCC[NH2+][C@H]1CN(C(=O)CN(C)C2CCC2)CC[C@@H]1C(F)(F)F ZINC001571652090 1087022636 /nfs/dbraw/zinc/02/26/36/1087022636.db2.gz HYAQEOQREBJORP-GJZGRUSLSA-N 1 3 349.441 2.640 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1)C1CCC1 ZINC001571689044 1087052145 /nfs/dbraw/zinc/05/21/45/1087052145.db2.gz JBGAVTWVEFRDAA-QRVBRYPASA-N 1 3 345.531 2.655 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1)C1CCC1 ZINC001571689044 1087052148 /nfs/dbraw/zinc/05/21/48/1087052148.db2.gz JBGAVTWVEFRDAA-QRVBRYPASA-N 1 3 345.531 2.655 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1=CC[N@H+](CCc2ccccc2)CC1)N(C)C ZINC001571698715 1087068673 /nfs/dbraw/zinc/06/86/73/1087068673.db2.gz OUENJAHSWKKCKN-FQEVSTJZSA-N 1 3 343.515 2.564 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1=CC[N@@H+](CCc2ccccc2)CC1)N(C)C ZINC001571698715 1087068677 /nfs/dbraw/zinc/06/86/77/1087068677.db2.gz OUENJAHSWKKCKN-FQEVSTJZSA-N 1 3 343.515 2.564 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001571700871 1087072668 /nfs/dbraw/zinc/07/26/68/1087072668.db2.gz QTWHEDIWXYZXMU-QRVBRYPASA-N 1 3 333.520 2.511 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1=CC[N@@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001571700871 1087072673 /nfs/dbraw/zinc/07/26/73/1087072673.db2.gz QTWHEDIWXYZXMU-QRVBRYPASA-N 1 3 333.520 2.511 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1[nH]ccc1-c1ccccc1 ZINC001647309280 1089235837 /nfs/dbraw/zinc/23/58/37/1089235837.db2.gz SENYGCRQVKHUBR-INIZCTEOSA-N 1 3 342.487 2.684 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1[nH]ccc1-c1ccccc1 ZINC001647309280 1089235846 /nfs/dbraw/zinc/23/58/46/1089235846.db2.gz SENYGCRQVKHUBR-INIZCTEOSA-N 1 3 342.487 2.684 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2CCN(C(=O)C3(N(C)C)CCC3)C2)cc1 ZINC001267011962 1092324163 /nfs/dbraw/zinc/32/41/63/1092324163.db2.gz OREFTYXNVPKPCN-IBGZPJMESA-N 1 3 343.515 2.602 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21 ZINC001649357467 1092428275 /nfs/dbraw/zinc/42/82/75/1092428275.db2.gz QGHQWUGXGRCEJF-YSVLISHTSA-N 1 3 341.455 2.564 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@H]21 ZINC001649357467 1092428288 /nfs/dbraw/zinc/42/82/88/1092428288.db2.gz QGHQWUGXGRCEJF-YSVLISHTSA-N 1 3 341.455 2.564 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CCC[NH2+]Cc1cnccc1C ZINC001649471891 1092516369 /nfs/dbraw/zinc/51/63/69/1092516369.db2.gz LZDYYNITACJILQ-PKOBYXMFSA-N 1 3 346.519 2.639 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@H]1CCN(C(=O)[C@@H](CC)N(C)C)C1 ZINC001267068099 1092528637 /nfs/dbraw/zinc/52/86/37/1092528637.db2.gz VTGFJPWKHAQJIP-YLJYHZDGSA-N 1 3 345.531 2.570 10 0 EFAEHO C[NH+](C)[C@@H]1CCCC[C@@H]1NC(=O)c1cccc(CN2CCCC2)c1 ZINC001649698497 1092595262 /nfs/dbraw/zinc/59/52/62/1092595262.db2.gz AOFHYVTVDMRZMX-RBUKOAKNSA-N 1 3 329.488 2.885 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCCC[C@H]1CCC[N@@H+]1CCCF ZINC001267178453 1093088403 /nfs/dbraw/zinc/08/84/03/1093088403.db2.gz XKMUVGLKKLCQPG-ZWKOTPCHSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCCC[C@H]1CCC[N@H+]1CCCF ZINC001267178453 1093088408 /nfs/dbraw/zinc/08/84/08/1093088408.db2.gz XKMUVGLKKLCQPG-ZWKOTPCHSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@@H](C[NH2+]CCC(C)(C)C)C1CC1)N(C)C ZINC001283552669 1093627912 /nfs/dbraw/zinc/62/79/12/1093627912.db2.gz JJLASHZHADSZGA-DLBZAZTESA-N 1 3 325.541 2.835 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@H](NCC1=CCCCC1)c1ccccc1 ZINC001267371324 1094342929 /nfs/dbraw/zinc/34/29/29/1094342929.db2.gz XWHQBDINQNKPEZ-IBGZPJMESA-N 1 3 329.488 2.886 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]CCN(C)C(=O)C1(N(C)C)CCC1 ZINC001267384583 1094442062 /nfs/dbraw/zinc/44/20/62/1094442062.db2.gz XZFJAERVXUMHFD-UHFFFAOYSA-N 1 3 337.895 2.681 10 0 EFAEHO CCC[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC[C@H](C)F ZINC001493318262 1094448513 /nfs/dbraw/zinc/44/85/13/1094448513.db2.gz ORTHZNKWLLULPN-MAUKXSAKSA-N 1 3 347.494 2.775 10 0 EFAEHO CCC[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC[C@H](C)F ZINC001493318262 1094448520 /nfs/dbraw/zinc/44/85/20/1094448520.db2.gz ORTHZNKWLLULPN-MAUKXSAKSA-N 1 3 347.494 2.775 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@H+](CCCCC(F)(F)F)C1)C1CCC1 ZINC001481095345 1094459158 /nfs/dbraw/zinc/45/91/58/1094459158.db2.gz IFUPPTIZUVFJOF-AWEZNQCLSA-N 1 3 349.441 2.641 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@@H+](CCCCC(F)(F)F)C1)C1CCC1 ZINC001481095345 1094459163 /nfs/dbraw/zinc/45/91/63/1094459163.db2.gz IFUPPTIZUVFJOF-AWEZNQCLSA-N 1 3 349.441 2.641 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+]CCN(C)C(=O)[C@@H]1CCCCN1C ZINC001267391266 1094469981 /nfs/dbraw/zinc/46/99/81/1094469981.db2.gz DTPONBIRFDAMBO-IBGZPJMESA-N 1 3 346.519 2.546 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NCCCN2CCc3ccccc3C2)C1 ZINC001595655325 1094481324 /nfs/dbraw/zinc/48/13/24/1094481324.db2.gz JRNFAEMOCLDDQZ-HXUWFJFHSA-N 1 3 343.515 2.673 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NCCCN2CCc3ccccc3C2)C1 ZINC001595655325 1094481330 /nfs/dbraw/zinc/48/13/30/1094481330.db2.gz JRNFAEMOCLDDQZ-HXUWFJFHSA-N 1 3 343.515 2.673 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[NH2+]CC1CCC(C)(C)CC1)N(C)C ZINC001267424828 1094512257 /nfs/dbraw/zinc/51/22/57/1094512257.db2.gz DWKHLAKENTZKRR-QGZVFWFLSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[NH2+]Cc2ccc(C(C)(C)C)cc2)C1 ZINC001267429362 1094515792 /nfs/dbraw/zinc/51/57/92/1094515792.db2.gz YYDGNYLRGJNFQR-QGZVFWFLSA-N 1 3 345.531 2.874 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[N@H+](CCC3CCCCC3)C2)C1 ZINC001481112941 1094618465 /nfs/dbraw/zinc/61/84/65/1094618465.db2.gz UQJIWMCYUKVJCL-PKOBYXMFSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[N@@H+](CCC3CCCCC3)C2)C1 ZINC001481112941 1094618469 /nfs/dbraw/zinc/61/84/69/1094618469.db2.gz UQJIWMCYUKVJCL-PKOBYXMFSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1CC[C@@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001481462997 1094715442 /nfs/dbraw/zinc/71/54/42/1094715442.db2.gz WTYKMFVGIOFVAP-VQIMIIECSA-N 1 3 349.494 2.938 10 0 EFAEHO CC[C@@H](F)C[N@H+]1CC[C@@H](CCNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001481462997 1094715454 /nfs/dbraw/zinc/71/54/54/1094715454.db2.gz WTYKMFVGIOFVAP-VQIMIIECSA-N 1 3 349.494 2.938 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]Cc1cc(C)ccc1C ZINC001267473581 1094761802 /nfs/dbraw/zinc/76/18/02/1094761802.db2.gz HDKOKCBLMDOBSB-IBGZPJMESA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1CC[N@H+](CCC2=CCCCC2)C1 ZINC001481120973 1094783836 /nfs/dbraw/zinc/78/38/36/1094783836.db2.gz QGMWWLIMZJWSQI-KRWDZBQOSA-N 1 3 330.476 2.589 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]1CC[N@@H+](CCC2=CCCCC2)C1 ZINC001481120973 1094783849 /nfs/dbraw/zinc/78/38/49/1094783849.db2.gz QGMWWLIMZJWSQI-KRWDZBQOSA-N 1 3 330.476 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+](CC/C=C\c2ccccc2)C1 ZINC001481125250 1094833910 /nfs/dbraw/zinc/83/39/10/1094833910.db2.gz BSNGRFFOXZSBKX-QRGKHIHXSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+](CC/C=C\c2ccccc2)C1 ZINC001481125250 1094833927 /nfs/dbraw/zinc/83/39/27/1094833927.db2.gz BSNGRFFOXZSBKX-QRGKHIHXSA-N 1 3 343.515 2.868 10 0 EFAEHO CCC[N@H+](CCNC(=O)C1(N(C)C)CCC1)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001481137619 1094921770 /nfs/dbraw/zinc/92/17/70/1094921770.db2.gz TYIXKFJPNAEFGR-KURKYZTESA-N 1 3 335.536 2.735 10 0 EFAEHO CCC[N@@H+](CCNC(=O)C1(N(C)C)CCC1)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001481137619 1094921779 /nfs/dbraw/zinc/92/17/79/1094921779.db2.gz TYIXKFJPNAEFGR-KURKYZTESA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1ccc(C[N@@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001481509574 1095004574 /nfs/dbraw/zinc/00/45/74/1095004574.db2.gz PSQWAICRKGZKFB-IBGZPJMESA-N 1 3 331.504 2.616 10 0 EFAEHO Cc1ccc(C[N@H+](C)C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001481509574 1095004586 /nfs/dbraw/zinc/00/45/86/1095004586.db2.gz PSQWAICRKGZKFB-IBGZPJMESA-N 1 3 331.504 2.616 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H]1CCC[N@H+](CCCCCF)C1 ZINC001481537393 1095188015 /nfs/dbraw/zinc/18/80/15/1095188015.db2.gz CLFAGUQBAMWSHE-ROUUACIJSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H]1CCC[N@@H+](CCCCCF)C1 ZINC001481537393 1095188027 /nfs/dbraw/zinc/18/80/27/1095188027.db2.gz CLFAGUQBAMWSHE-ROUUACIJSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)C1CC1 ZINC001481194217 1095239421 /nfs/dbraw/zinc/23/94/21/1095239421.db2.gz DGKAEKQGGRHOJH-HOTGVXAUSA-N 1 3 347.478 2.809 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)C1CC1 ZINC001481194217 1095239434 /nfs/dbraw/zinc/23/94/34/1095239434.db2.gz DGKAEKQGGRHOJH-HOTGVXAUSA-N 1 3 347.478 2.809 10 0 EFAEHO O=C(CN1CCCC1)N1CCCC[C@@H]1CC[NH2+]Cc1ccccc1F ZINC001268166949 1095778824 /nfs/dbraw/zinc/77/88/24/1095778824.db2.gz WEHJBSXLKMTSLP-GOSISDBHSA-N 1 3 347.478 2.782 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[N@H+](C)C1)Cc1cc2ccccc2s1 ZINC001481016454 1095858980 /nfs/dbraw/zinc/85/89/80/1095858980.db2.gz LJJGAKQXVRPBNJ-MRXNPFEDSA-N 1 3 345.512 2.791 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[N@@H+](C)C1)Cc1cc2ccccc2s1 ZINC001481016454 1095858997 /nfs/dbraw/zinc/85/89/97/1095858997.db2.gz LJJGAKQXVRPBNJ-MRXNPFEDSA-N 1 3 345.512 2.791 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCC[N@@H+]1CC1=CCCCC1)N1CCCC1 ZINC001481052880 1096179444 /nfs/dbraw/zinc/17/94/44/1096179444.db2.gz PFLWGHSJMLNNLP-GOSISDBHSA-N 1 3 333.520 2.942 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CCC[N@H+]1CC1=CCCCC1)N1CCCC1 ZINC001481052880 1096179448 /nfs/dbraw/zinc/17/94/48/1096179448.db2.gz PFLWGHSJMLNNLP-GOSISDBHSA-N 1 3 333.520 2.942 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)NCC1CN([C@@H]2CCc3ccccc32)C1 ZINC001481660913 1096259148 /nfs/dbraw/zinc/25/91/48/1096259148.db2.gz PJGHGFULTGBWOZ-HXUWFJFHSA-N 1 3 341.499 2.598 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1CCC[C@H]1C[NH2+]CCCC1CCC1 ZINC001268291746 1096272207 /nfs/dbraw/zinc/27/22/07/1096272207.db2.gz NLIZADYGLOVLSD-IRXDYDNUSA-N 1 3 332.492 2.715 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccccc1Cl)NC(=O)CN(C)C1CCC1 ZINC001268372834 1096414042 /nfs/dbraw/zinc/41/40/42/1096414042.db2.gz LRDZUCAFJQHFKP-AWEZNQCLSA-N 1 3 337.895 2.809 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1CCCN1C ZINC001268438134 1096596374 /nfs/dbraw/zinc/59/63/74/1096596374.db2.gz DABZVTNXBWDNBL-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](CC)[NH2+]Cc1ccc(F)cc1C ZINC001481816758 1096732139 /nfs/dbraw/zinc/73/21/39/1096732139.db2.gz OWVNGIXXZWBECN-RBUKOAKNSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]CCc1ccccc1F ZINC001481811465 1096736558 /nfs/dbraw/zinc/73/65/58/1096736558.db2.gz SKAIBCLTLHFQON-PKOBYXMFSA-N 1 3 349.494 2.725 10 0 EFAEHO CC[C@H](CNC(=O)CC[NH+](C)C)N[C@H](C)c1cccc(Cl)c1F ZINC001481848500 1096779640 /nfs/dbraw/zinc/77/96/40/1096779640.db2.gz ORTYSCORXCOVIN-CHWSQXEVSA-N 1 3 343.874 2.976 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)NCc1ccc(C)cc1Cl ZINC001481876606 1096841905 /nfs/dbraw/zinc/84/19/05/1096841905.db2.gz WHAHVWNKXJMUGP-JKSUJKDBSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)NCc1ccc(C)cc1Cl ZINC001481876606 1096841911 /nfs/dbraw/zinc/84/19/11/1096841911.db2.gz WHAHVWNKXJMUGP-JKSUJKDBSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@H](CNC(=O)C12CC[NH+](CC1)C2)NCc1ccc(C)cc1Cl ZINC001481872537 1096845712 /nfs/dbraw/zinc/84/57/12/1096845712.db2.gz UIKKMRAAAURLCL-MRXNPFEDSA-N 1 3 349.906 2.729 10 0 EFAEHO CC[C@@H](C(=O)NC1(C[NH2+]CCc2ccccc2)CCCC1)N(C)C ZINC001481904904 1096899650 /nfs/dbraw/zinc/89/96/50/1096899650.db2.gz UWXGLCNJKNYHHD-SFHVURJKSA-N 1 3 331.504 2.588 10 0 EFAEHO CCCCC[NH2+]CCN(CC)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001268479264 1096901167 /nfs/dbraw/zinc/90/11/67/1096901167.db2.gz HAWGUXPRTBKDJT-SFHVURJKSA-N 1 3 329.504 2.827 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](CC[NH2+]C/C=C\Cl)C1 ZINC001481990433 1097054789 /nfs/dbraw/zinc/05/47/89/1097054789.db2.gz AAVYMKHWEROZHF-HJMWAZGYSA-N 1 3 341.927 2.832 10 0 EFAEHO CC[C@@H](F)C[NH2+]CCC1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001482004167 1097078020 /nfs/dbraw/zinc/07/80/20/1097078020.db2.gz ONEPJKOXBCGGLS-QGZVFWFLSA-N 1 3 343.531 2.931 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(CC[NH2+]CCC(C)(C)C)CC1 ZINC001482007636 1097086361 /nfs/dbraw/zinc/08/63/61/1097086361.db2.gz YJANCXCLWRZQTD-UHFFFAOYSA-N 1 3 325.541 2.983 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C/C=C\CNC(=O)[C@H](C(C)C)N(C)C ZINC001268552651 1097178031 /nfs/dbraw/zinc/17/80/31/1097178031.db2.gz RRDONWOQSCMKQQ-WRAQBFHGSA-N 1 3 331.504 2.904 10 0 EFAEHO C[C@@H](NC/C=C/CNC(=O)C12CCC[NH+]1CCC2)c1ccc(F)cc1 ZINC001268562248 1097196473 /nfs/dbraw/zinc/19/64/73/1097196473.db2.gz FIILPKMISITWCC-WOMSROEHSA-N 1 3 345.462 2.777 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C/C=C/CNC(=O)[C@H]1CCCN1C ZINC001268574933 1097246147 /nfs/dbraw/zinc/24/61/47/1097246147.db2.gz NPLHFUINKDGSRC-REMYHPOOSA-N 1 3 335.879 2.505 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]Cc1ccc(C2CC2)cc1 ZINC001482106876 1097267932 /nfs/dbraw/zinc/26/79/32/1097267932.db2.gz CXEXWAUZTGGUHS-MRXNPFEDSA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC/C=C\CNCc2ccc(CF)cc2)CC[N@@H+]1C ZINC001268582251 1097283543 /nfs/dbraw/zinc/28/35/43/1097283543.db2.gz NLOVEDRHUFUHTB-PDNKVIRKSA-N 1 3 347.478 2.648 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC/C=C\CNCc2ccc(CF)cc2)CC[N@H+]1C ZINC001268582251 1097283546 /nfs/dbraw/zinc/28/35/46/1097283546.db2.gz NLOVEDRHUFUHTB-PDNKVIRKSA-N 1 3 347.478 2.648 10 0 EFAEHO C[NH+](C)CCCC(=O)NC/C=C\CN[C@@H]1CCc2ccc(Cl)cc21 ZINC001268583534 1097288658 /nfs/dbraw/zinc/28/86/58/1097288658.db2.gz FTAGINPHBCXIRZ-DDKKJVIOSA-N 1 3 349.906 2.931 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+]Cc1cc2ccccc2o1 ZINC001482173410 1097442635 /nfs/dbraw/zinc/44/26/35/1097442635.db2.gz LGYMHXFNSJAPBE-HNNXBMFYSA-N 1 3 331.460 2.615 10 0 EFAEHO O=C(NC/C=C\CNCc1ccsc1)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001268602589 1097450251 /nfs/dbraw/zinc/45/02/51/1097450251.db2.gz MDRZNXODFZVRRY-YKIWHUSVSA-N 1 3 333.501 2.527 10 0 EFAEHO O=C(NC/C=C\CNCc1ccsc1)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001268602589 1097450253 /nfs/dbraw/zinc/45/02/53/1097450253.db2.gz MDRZNXODFZVRRY-YKIWHUSVSA-N 1 3 333.501 2.527 10 0 EFAEHO Cc1cc(Cl)ccc1CNC/C=C/CNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001268612620 1097461315 /nfs/dbraw/zinc/46/13/15/1097461315.db2.gz GXCXXANCAJGHMU-QDLOVBKTSA-N 1 3 349.906 2.752 10 0 EFAEHO Cc1cc(Cl)ccc1CNC/C=C/CNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001268612620 1097461320 /nfs/dbraw/zinc/46/13/20/1097461320.db2.gz GXCXXANCAJGHMU-QDLOVBKTSA-N 1 3 349.906 2.752 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)NC/C=C/CNCc2ccsc2)C1 ZINC001268612144 1097461696 /nfs/dbraw/zinc/46/16/96/1097461696.db2.gz DQXCWNRISZACHO-MULDZMIYSA-N 1 3 335.517 2.631 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\C[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001268619349 1097470387 /nfs/dbraw/zinc/47/03/87/1097470387.db2.gz ZTNCRYWAJFSEKY-SFFCAUCYSA-N 1 3 342.487 2.516 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/C[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001268619356 1097470400 /nfs/dbraw/zinc/47/04/00/1097470400.db2.gz ZTNCRYWAJFSEKY-ZMBJWTFHSA-N 1 3 342.487 2.516 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]C/C=C/CNC(=O)CN2CCCC2)c1 ZINC001268625002 1097477929 /nfs/dbraw/zinc/47/79/29/1097477929.db2.gz JTHCZADPMSDVIW-SHCNBLLESA-N 1 3 329.488 2.722 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C/C=C/CNC(=O)CN2CCCC2)c1 ZINC001268625003 1097478242 /nfs/dbraw/zinc/47/82/42/1097478242.db2.gz JTHCZADPMSDVIW-WRFKIARRSA-N 1 3 329.488 2.722 10 0 EFAEHO C[C@@H](C[NH2+]CCCc1ccsc1)NC(=O)C(C)(C)N1CCCC1 ZINC001268697685 1097548855 /nfs/dbraw/zinc/54/88/55/1097548855.db2.gz IAZPJCVPMFMBAN-HNNXBMFYSA-N 1 3 337.533 2.649 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CCCc1ccsc1 ZINC001268717372 1097567143 /nfs/dbraw/zinc/56/71/43/1097567143.db2.gz XQHSRUKUYUJRDO-DOTOQJQBSA-N 1 3 337.533 2.649 10 0 EFAEHO CN(CCC[NH2+][C@H]1CCCc2ccc(F)cc21)C(=O)[C@H]1CCCN1C ZINC001268784654 1097633141 /nfs/dbraw/zinc/63/31/41/1097633141.db2.gz ZVHFNQDZKLMUGQ-RBUKOAKNSA-N 1 3 347.478 2.735 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)CN(C)C1CCC1)c1cccc(F)c1 ZINC001268797827 1097645026 /nfs/dbraw/zinc/64/50/26/1097645026.db2.gz YXLQHDFKMBFZSW-HNNXBMFYSA-N 1 3 335.467 2.809 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(Cl)s1)C(=O)[C@@H]1CCCCN1C ZINC001268802628 1097651294 /nfs/dbraw/zinc/65/12/94/1097651294.db2.gz SJOQQVKTMDHDDW-AWEZNQCLSA-N 1 3 343.924 2.824 10 0 EFAEHO CN(CCC[NH2+]C/C=C/c1ccc(Cl)cc1)C(=O)[C@H]1CCCN1C ZINC001268811706 1097660401 /nfs/dbraw/zinc/66/04/01/1097660401.db2.gz QYCBRQYYEOHCKL-HNSSHINMSA-N 1 3 349.906 2.886 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]CC1CCC(C)(C)CC1)N(C)C ZINC001268852166 1097684678 /nfs/dbraw/zinc/68/46/78/1097684678.db2.gz DOSSDETXPCNBOS-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N(C)CCC[NH2+][C@@H]1CCCc2ccccc21 ZINC001268920366 1097719548 /nfs/dbraw/zinc/71/95/48/1097719548.db2.gz NMQIGCHWHKMWBG-LJQANCHMSA-N 1 3 331.504 2.844 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[NH2+]Cc1ccc(OC)cc1 ZINC001268962970 1097755007 /nfs/dbraw/zinc/75/50/07/1097755007.db2.gz YJIPHFDKDXHCLW-IBGZPJMESA-N 1 3 347.503 2.508 10 0 EFAEHO CCC/C=C/CCN1C[C@@H]2C[C@H]1CN2C(=O)CCC[NH+]1CCCC1 ZINC001268987605 1097773872 /nfs/dbraw/zinc/77/38/72/1097773872.db2.gz ANCHLKOTFKNVPK-OJBOGMDESA-N 1 3 333.520 2.894 10 0 EFAEHO CCC/C=C/CCN1C[C@@H]2C[C@H]1CN2C(=O)CC[NH+]1CCCCC1 ZINC001268989089 1097775335 /nfs/dbraw/zinc/77/53/35/1097775335.db2.gz ZDNAGNXFAIANIO-OJBOGMDESA-N 1 3 333.520 2.894 10 0 EFAEHO C[C@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@H]1C[NH2+]CCC1CCCC1 ZINC001279114567 1097779709 /nfs/dbraw/zinc/77/97/09/1097779709.db2.gz SJLJPVISWBIZJY-FUHWJXTLSA-N 1 3 335.536 2.735 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([N@H+](CC=C(C)C)CC2CC2)CC1 ZINC001269633006 1098311553 /nfs/dbraw/zinc/31/15/53/1098311553.db2.gz RKIHBCURYPPAJN-UHFFFAOYSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([N@@H+](CC=C(C)C)CC2CC2)CC1 ZINC001269633006 1098311560 /nfs/dbraw/zinc/31/15/60/1098311560.db2.gz RKIHBCURYPPAJN-UHFFFAOYSA-N 1 3 335.536 2.997 10 0 EFAEHO CN(C)C1(C(=O)N2CCC(CC[NH2+]CCC(F)(F)F)CC2)CCC1 ZINC001269870885 1098491255 /nfs/dbraw/zinc/49/12/55/1098491255.db2.gz FGFNSGIWGKTGCX-UHFFFAOYSA-N 1 3 349.441 2.641 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(CC[NH2+]Cc2cccc(F)c2)CC1)N(C)C ZINC001269935868 1098532152 /nfs/dbraw/zinc/53/21/52/1098532152.db2.gz ZJKOFECAHAQBKF-IBGZPJMESA-N 1 3 349.494 2.884 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H]([NH2+]CCCCCF)CC2)CCC1 ZINC001269991898 1098575871 /nfs/dbraw/zinc/57/58/71/1098575871.db2.gz UAZOVRAGYRRCHW-WKILWMFISA-N 1 3 327.488 2.628 10 0 EFAEHO CC(C)=CC[NH2+]Cc1ccc(CNC(=O)[C@H](C(C)C)N(C)C)cc1 ZINC001270081369 1098669289 /nfs/dbraw/zinc/66/92/89/1098669289.db2.gz BIWPHOMPGWCAJG-IBGZPJMESA-N 1 3 331.504 2.945 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C(=O)[C@@H]1CCCN1C ZINC001482265472 1098699546 /nfs/dbraw/zinc/69/95/46/1098699546.db2.gz HHKKPZCXDDXLNU-UZLBHIALSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+]CCCc1ccccc1 ZINC001270193790 1098783997 /nfs/dbraw/zinc/78/39/97/1098783997.db2.gz MQMNUFOVUINZFV-IBGZPJMESA-N 1 3 331.504 2.540 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H]1C[NH2+]C/C=C/c1ccccc1)N(C)C ZINC001267964160 1098946820 /nfs/dbraw/zinc/94/68/20/1098946820.db2.gz HXSCBCLNJGIDSN-AJAZOWGGSA-N 1 3 343.515 2.867 10 0 EFAEHO CCCCC[N@@H+]1CCC2(C1)CCN(C(=O)CN(C)C1CCC1)CC2 ZINC001270328722 1098966042 /nfs/dbraw/zinc/96/60/42/1098966042.db2.gz JPEDQFVZIPOIKG-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCC[N@H+]1CCC2(C1)CCN(C(=O)CN(C)C1CCC1)CC2 ZINC001270328722 1098966049 /nfs/dbraw/zinc/96/60/49/1098966049.db2.gz JPEDQFVZIPOIKG-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCCC[N@@H+]1CCC2(C1)CCN(C(=O)[C@H]1CCCN1C)CC2 ZINC001270335415 1098975460 /nfs/dbraw/zinc/97/54/60/1098975460.db2.gz GOPLKVBYUJXPQC-GOSISDBHSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCCC[N@H+]1CCC2(C1)CCN(C(=O)[C@H]1CCCN1C)CC2 ZINC001270335415 1098975470 /nfs/dbraw/zinc/97/54/70/1098975470.db2.gz GOPLKVBYUJXPQC-GOSISDBHSA-N 1 3 335.536 2.975 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC2(C1)CCN(C(=O)[C@@H](CC)N(C)C)CC2 ZINC001270339179 1098981382 /nfs/dbraw/zinc/98/13/82/1098981382.db2.gz CBGMHTMWFNWICV-JTHGQSKGSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC2(C1)CCN(C(=O)[C@@H](CC)N(C)C)CC2 ZINC001270339179 1098981389 /nfs/dbraw/zinc/98/13/89/1098981389.db2.gz CBGMHTMWFNWICV-JTHGQSKGSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001267969971 1098983576 /nfs/dbraw/zinc/98/35/76/1098983576.db2.gz ONSQHILJBQLQSI-LJQANCHMSA-N 1 3 331.504 2.989 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)[C@@H]2CCC[N@H+]2C(C)C)c1 ZINC001482284453 1099030909 /nfs/dbraw/zinc/03/09/09/1099030909.db2.gz NUUYKCCIIRVIMD-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)[C@@H]2CCC[N@@H+]2C(C)C)c1 ZINC001482284453 1099030920 /nfs/dbraw/zinc/03/09/20/1099030920.db2.gz NUUYKCCIIRVIMD-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C[NH2+]CCCF)C1CCCC1 ZINC001270442371 1099093176 /nfs/dbraw/zinc/09/31/76/1099093176.db2.gz LUFPLZVHNRAGBG-ROUUACIJSA-N 1 3 341.515 2.874 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[NH2+]CCCc2cccc(F)c2)CC1 ZINC001481294695 1099099766 /nfs/dbraw/zinc/09/97/66/1099099766.db2.gz DPVCDYYEWGWXPF-UHFFFAOYSA-N 1 3 349.494 2.538 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)[C@H]1CCN(CCCCC(F)(F)F)C1 ZINC001267774869 1099109681 /nfs/dbraw/zinc/10/96/81/1099109681.db2.gz KYXNLKSAQHGAQN-AWEZNQCLSA-N 1 3 337.430 2.594 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)[C@H]1CCN(CCCCC(F)(F)F)C1 ZINC001267774869 1099109684 /nfs/dbraw/zinc/10/96/84/1099109684.db2.gz KYXNLKSAQHGAQN-AWEZNQCLSA-N 1 3 337.430 2.594 10 0 EFAEHO Cc1ncccc1CNCCN(C)C(=O)CC[N@H+](C)C1CCCCC1 ZINC001481261536 1099135648 /nfs/dbraw/zinc/13/56/48/1099135648.db2.gz HRRJXGOXYWZPHI-UHFFFAOYSA-N 1 3 346.519 2.593 10 0 EFAEHO Cc1ncccc1CNCCN(C)C(=O)CC[N@@H+](C)C1CCCCC1 ZINC001481261536 1099135658 /nfs/dbraw/zinc/13/56/58/1099135658.db2.gz HRRJXGOXYWZPHI-UHFFFAOYSA-N 1 3 346.519 2.593 10 0 EFAEHO CC[C@@H](C(=O)N1CCC([C@H](C)[NH2+]CCCC(C)C)CC1)N(C)C ZINC001481340411 1099372130 /nfs/dbraw/zinc/37/21/30/1099372130.db2.gz QXNORBWQMCMAGZ-WMZOPIPTSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](CC[NH2+]CCC2CCCC2)C1)N(C)C ZINC001280264579 1099382999 /nfs/dbraw/zinc/38/29/99/1099382999.db2.gz YOZFGAWNLZPXJO-RBUKOAKNSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]CCC3CCCC3)C2)C1 ZINC001270795841 1099567750 /nfs/dbraw/zinc/56/77/50/1099567750.db2.gz BATNLYZZJVGDOY-XLIONFOSSA-N 1 3 335.536 2.737 10 0 EFAEHO CCCN(C(=O)[C@H](C)N1CCCCCC1)[C@H]1CC[N@H+](CC2CC2)C1 ZINC001481407119 1099653281 /nfs/dbraw/zinc/65/32/81/1099653281.db2.gz PGMVQJRCLWRKDR-HKUYNNGSSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN(C(=O)[C@H](C)N1CCCCCC1)[C@H]1CC[N@@H+](CC2CC2)C1 ZINC001481407119 1099653286 /nfs/dbraw/zinc/65/32/86/1099653286.db2.gz PGMVQJRCLWRKDR-HKUYNNGSSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@@H](C[NH2+]CCCc1ccccc1)N(C)C(=O)CN1CCC(C)CC1 ZINC001482343179 1099703743 /nfs/dbraw/zinc/70/37/43/1099703743.db2.gz GHPXDEVRUDMZMX-IBGZPJMESA-N 1 3 345.531 2.788 10 0 EFAEHO C[C@H]1CCCC[C@@]1(C[NH2+]CCF)NC(=O)c1cccc(CN(C)C)c1 ZINC001267873589 1099787011 /nfs/dbraw/zinc/78/70/11/1099787011.db2.gz ZESGGEJJFCFIHO-JXFKEZNVSA-N 1 3 349.494 2.986 10 0 EFAEHO CC(C)=CC[NH2+]C[C@]1(NC(=O)Cc2nc[nH]c2C)CCCC[C@@H]1C ZINC001267874570 1099794883 /nfs/dbraw/zinc/79/48/83/1099794883.db2.gz WNOUOQZHOXXFAC-HNAYVOBHSA-N 1 3 332.492 2.882 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)NCCCN2CCc3ccccc3C2)C1 ZINC001625490105 1099817031 /nfs/dbraw/zinc/81/70/31/1099817031.db2.gz YJSHWAJXKZMRGY-AZUAARDMSA-N 1 3 343.515 2.671 10 0 EFAEHO C[C@@H](C[NH2+][C@@H](C)c1ccccc1Cl)N(C)C(=O)CN1CCCC1 ZINC001482364238 1099844388 /nfs/dbraw/zinc/84/43/88/1099844388.db2.gz FHBMUUHDAIQPMZ-GJZGRUSLSA-N 1 3 337.895 2.933 10 0 EFAEHO CC(C)C[C@H](CNCc1ccccn1)NC(=O)[C@H]1CCC[N@@H+]1C(C)C ZINC001482384546 1099960605 /nfs/dbraw/zinc/96/06/05/1099960605.db2.gz SLXRZFMZIFDYET-RTBURBONSA-N 1 3 346.519 2.575 10 0 EFAEHO CC(C)C[C@H](CNCc1ccccn1)NC(=O)[C@H]1CCC[N@H+]1C(C)C ZINC001482384546 1099960617 /nfs/dbraw/zinc/96/06/17/1099960617.db2.gz SLXRZFMZIFDYET-RTBURBONSA-N 1 3 346.519 2.575 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](CNCCF)C1CCCCC1)[NH+]1CCCC1 ZINC001482413183 1100081590 /nfs/dbraw/zinc/08/15/90/1100081590.db2.gz MEJWVJJDAFRUOW-ROUUACIJSA-N 1 3 341.515 2.731 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]Cc1cccc(F)c1 ZINC001482454775 1100455721 /nfs/dbraw/zinc/45/57/21/1100455721.db2.gz HUDRYTXYIATBRP-RTBURBONSA-N 1 3 347.478 2.781 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C[NH2+]C/C=C/Cl)C1CCCCC1)N(C)C ZINC001271355614 1101432491 /nfs/dbraw/zinc/43/24/91/1101432491.db2.gz YFHDVFRSCLDKHM-VESHTZQJSA-N 1 3 343.943 2.980 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)C2CCC2)CC[C@H]1[NH2+]CCCC1CCC1 ZINC001271405115 1101507760 /nfs/dbraw/zinc/50/77/60/1101507760.db2.gz STWCYSVQNORSKK-VQIMIIECSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CC[N@H+](CCC2=CCCCC2)C1 ZINC001266322366 1101547501 /nfs/dbraw/zinc/54/75/01/1101547501.db2.gz GFKGFWWVFNYMHL-ROUUACIJSA-N 1 3 339.499 2.747 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CC[N@@H+](CCC2=CCCCC2)C1 ZINC001266322366 1101547509 /nfs/dbraw/zinc/54/75/09/1101547509.db2.gz GFKGFWWVFNYMHL-ROUUACIJSA-N 1 3 339.499 2.747 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H]1C[C@H]([NH2+]CC/C=C/c2ccccc2)C1 ZINC001266635226 1101598406 /nfs/dbraw/zinc/59/84/06/1101598406.db2.gz XTPCPZUFFDFTTQ-MZJPSXEPSA-N 1 3 338.455 2.601 10 0 EFAEHO CCCCC[N@@H+]1CC[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001266341633 1101608671 /nfs/dbraw/zinc/60/86/71/1101608671.db2.gz LBGMDUDJBMDZHR-YJBOKZPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCCC[N@H+]1CC[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001266341633 1101608674 /nfs/dbraw/zinc/60/86/74/1101608674.db2.gz LBGMDUDJBMDZHR-YJBOKZPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]CCCC(C)(C)C)C1 ZINC001672339440 1101622400 /nfs/dbraw/zinc/62/24/00/1101622400.db2.gz WTKBTUUFVMWFOU-SJORKVTESA-N 1 3 325.541 2.837 10 0 EFAEHO CN(CC[NH2+]Cc1ccc(C(C)(C)C)cc1)C(=O)[C@H]1CCCN1C ZINC001266660990 1101705048 /nfs/dbraw/zinc/70/50/48/1101705048.db2.gz ZEVNAKVVZQUOPF-GOSISDBHSA-N 1 3 331.504 2.626 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([C@@H](C)[NH2+]CCCC(C)(C)C)C1 ZINC001271550551 1102113414 /nfs/dbraw/zinc/11/34/14/1102113414.db2.gz OSSPRBSQVCRWPY-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H](F)CC[NH2+]CCC[C@@H]1[C@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001656628057 1102141886 /nfs/dbraw/zinc/14/18/86/1102141886.db2.gz RATWCQUBGHCMRF-BFYDXBDKSA-N 1 3 338.471 2.697 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@@H](C[N@H+](C)CC=C(C)C)C1 ZINC001266472137 1102213688 /nfs/dbraw/zinc/21/36/88/1102213688.db2.gz DAQXIVXFJTUSTE-OALUTQOASA-N 1 3 335.536 2.997 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@@H](C[N@@H+](C)CC=C(C)C)C1 ZINC001266472137 1102213698 /nfs/dbraw/zinc/21/36/98/1102213698.db2.gz DAQXIVXFJTUSTE-OALUTQOASA-N 1 3 335.536 2.997 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](C[N@H+](C)CC=C(C)C)C1 ZINC001266472139 1102214567 /nfs/dbraw/zinc/21/45/67/1102214567.db2.gz DAQXIVXFJTUSTE-RTBURBONSA-N 1 3 335.536 2.997 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](C[N@@H+](C)CC=C(C)C)C1 ZINC001266472139 1102214574 /nfs/dbraw/zinc/21/45/74/1102214574.db2.gz DAQXIVXFJTUSTE-RTBURBONSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001266793153 1102246914 /nfs/dbraw/zinc/24/69/14/1102246914.db2.gz IICUETTWHQDUGO-IJQANDGASA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cccc([C@H](C)N(C)CCNC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001480876263 1102251552 /nfs/dbraw/zinc/25/15/52/1102251552.db2.gz RZJUZENLXGLXKN-PKOBYXMFSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1cccc([C@H](C)N(C)CCNC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001480876263 1102251560 /nfs/dbraw/zinc/25/15/60/1102251560.db2.gz RZJUZENLXGLXKN-PKOBYXMFSA-N 1 3 331.504 2.978 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CCCCC[C@H]([NH2+]CCCF)C1 ZINC001656903014 1102252923 /nfs/dbraw/zinc/25/29/23/1102252923.db2.gz BMYOVNUWAQXDHQ-ZWKOTPCHSA-N 1 3 341.515 2.970 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]CCCC(C)(C)C)C1 ZINC001271700870 1102258766 /nfs/dbraw/zinc/25/87/66/1102258766.db2.gz UPSHUYJXRTZRFO-DLBZAZTESA-N 1 3 325.541 2.839 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CN(C)C2CCC2)[C@@H]1C[NH2+]CCC(F)(F)F ZINC001271714226 1102287161 /nfs/dbraw/zinc/28/71/61/1102287161.db2.gz HSSXKCADWOLZET-UKRRQHHQSA-N 1 3 349.441 2.640 10 0 EFAEHO CC(C)=CCN(C)C[C@@H]1CCCCN1C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001657070714 1102309981 /nfs/dbraw/zinc/30/99/81/1102309981.db2.gz BEQAOILEEYQPJC-FHWLQOOXSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)=CCN(C)C[C@@H]1CCCCN1C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001657070714 1102309990 /nfs/dbraw/zinc/30/99/90/1102309990.db2.gz BEQAOILEEYQPJC-FHWLQOOXSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@H]1C[NH2+]CC1CC(C)(C)C1 ZINC001482500479 1102419578 /nfs/dbraw/zinc/41/95/78/1102419578.db2.gz IMYZFAJDHYQQNQ-SJLPKXTDSA-N 1 3 337.552 2.980 10 0 EFAEHO CCOC(=O)/C=C\C[NH2+]C1[C@H](C)CN(Cc2ccccc2)C[C@H]1C ZINC001658142149 1102439054 /nfs/dbraw/zinc/43/90/54/1102439054.db2.gz DYGOYFQQWFNVLF-RIDHJDLKSA-N 1 3 330.472 2.852 10 0 EFAEHO C[C@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@@H]1C[NH2+]CCCC(C)(C)C ZINC001271739388 1102555214 /nfs/dbraw/zinc/55/52/14/1102555214.db2.gz MZAFEFIMJYZGIC-DOTOQJQBSA-N 1 3 334.508 2.995 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCCC[C@H]1C[NH2+]CCCF ZINC001266877746 1102569107 /nfs/dbraw/zinc/56/91/07/1102569107.db2.gz LTCDYPRZHOGDPK-IRXDYDNUSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CC[N@H+](CCC3=CCCCC3)C2)C1 ZINC001266533733 1102583449 /nfs/dbraw/zinc/58/34/49/1102583449.db2.gz PHYJSISRSZOGMN-HKUYNNGSSA-N 1 3 333.520 2.657 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CC[N@@H+](CCC3=CCCCC3)C2)C1 ZINC001266533733 1102583463 /nfs/dbraw/zinc/58/34/63/1102583463.db2.gz PHYJSISRSZOGMN-HKUYNNGSSA-N 1 3 333.520 2.657 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001480898118 1102610604 /nfs/dbraw/zinc/61/06/04/1102610604.db2.gz FUPAGTXWLBTCGZ-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO CN(CCCNC(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21)Cc1ccsc1 ZINC001660190147 1102630259 /nfs/dbraw/zinc/63/02/59/1102630259.db2.gz IXOKHQKSLWJGFS-SJORKVTESA-N 1 3 335.517 2.703 10 0 EFAEHO CN(CCCNC(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21)Cc1ccsc1 ZINC001660190147 1102630266 /nfs/dbraw/zinc/63/02/66/1102630266.db2.gz IXOKHQKSLWJGFS-SJORKVTESA-N 1 3 335.517 2.703 10 0 EFAEHO CC/C=C/CC[N@H+](C)CCC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001271778044 1102661344 /nfs/dbraw/zinc/66/13/44/1102661344.db2.gz AWOVHBOIPTXFKD-ZMBJWTFHSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](C)CCC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001271778044 1102661350 /nfs/dbraw/zinc/66/13/50/1102661350.db2.gz AWOVHBOIPTXFKD-ZMBJWTFHSA-N 1 3 335.536 2.997 10 0 EFAEHO CN(CCCNC(=O)c1ccc(C[NH+](C)C)cc1)CCC(F)(F)F ZINC001660333684 1102694131 /nfs/dbraw/zinc/69/41/31/1102694131.db2.gz IMDFPXVVLSAIPM-UHFFFAOYSA-N 1 3 345.409 2.752 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C)cc1F ZINC001660372912 1102718444 /nfs/dbraw/zinc/71/84/44/1102718444.db2.gz WHFOPIDYFZTELB-GOSISDBHSA-N 1 3 337.483 2.658 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C)cc1F ZINC001660372912 1102718458 /nfs/dbraw/zinc/71/84/58/1102718458.db2.gz WHFOPIDYFZTELB-GOSISDBHSA-N 1 3 337.483 2.658 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H]([NH2+]CC/C=C\c2ccccc2)C1)N(C)C ZINC001266559627 1102745956 /nfs/dbraw/zinc/74/59/56/1102745956.db2.gz HHXPGNOHQMIENT-BTPOVWIBSA-N 1 3 329.488 2.621 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H]([NH2+]CC/C=C\c2ccccc2)C1)N(C)C ZINC001266559629 1102746404 /nfs/dbraw/zinc/74/64/04/1102746404.db2.gz HHXPGNOHQMIENT-WETGWRSWSA-N 1 3 329.488 2.621 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C(C)(C)N1CCCCC1)[NH2+]CC[C@H](C)F ZINC001482530948 1102809850 /nfs/dbraw/zinc/80/98/50/1102809850.db2.gz IGUMRVNIRKPNSL-JKSUJKDBSA-N 1 3 329.504 2.729 10 0 EFAEHO C[C@@H](CN[C@@H](C)c1cccc(Cl)c1F)NC(=O)CCC[NH+](C)C ZINC001483260321 1103176238 /nfs/dbraw/zinc/17/62/38/1103176238.db2.gz ACWHTADVZUPNKV-STQMWFEESA-N 1 3 343.874 2.976 10 0 EFAEHO CCCC[NH2+][C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001482555092 1103268224 /nfs/dbraw/zinc/26/82/24/1103268224.db2.gz ZLUVTSIAKWFCIM-YJBOKZPZSA-N 1 3 329.504 2.729 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001661554531 1103312991 /nfs/dbraw/zinc/31/29/91/1103312991.db2.gz CHVMFHZXGYYOEL-OIWWRSOPSA-N 1 3 330.476 2.621 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001661554531 1103313005 /nfs/dbraw/zinc/31/30/05/1103313005.db2.gz CHVMFHZXGYYOEL-OIWWRSOPSA-N 1 3 330.476 2.621 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(Cl)c1)NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001483338888 1103424198 /nfs/dbraw/zinc/42/41/98/1103424198.db2.gz AIOJVTBTKRJSKH-JJRVBVJISA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(Cl)c1)NC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001483338888 1103424204 /nfs/dbraw/zinc/42/42/04/1103424204.db2.gz AIOJVTBTKRJSKH-JJRVBVJISA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@H](NCc1ccccc1F)[C@H](C)NC(=O)CCC[NH+]1CCCC1 ZINC001409480284 1103442175 /nfs/dbraw/zinc/44/21/75/1103442175.db2.gz VQLJUUXIYKBLHT-HOTGVXAUSA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1cc(C)cc(C)c1)C(C)C)N(C)C ZINC001482566099 1103561171 /nfs/dbraw/zinc/56/11/71/1103561171.db2.gz SVDOKJWOCVNLTP-RTBURBONSA-N 1 3 333.520 2.874 10 0 EFAEHO CC/C=C\CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H]1CCCCN1C(C)C ZINC001662070817 1103575338 /nfs/dbraw/zinc/57/53/38/1103575338.db2.gz FWVPSRKDHZXLMP-GRHFYHCSSA-N 1 3 333.520 2.652 10 0 EFAEHO CC/C=C\CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H]1CCCCN1C(C)C ZINC001662070817 1103575349 /nfs/dbraw/zinc/57/53/49/1103575349.db2.gz FWVPSRKDHZXLMP-GRHFYHCSSA-N 1 3 333.520 2.652 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C2CCC2)cc1)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001483418321 1103662300 /nfs/dbraw/zinc/66/23/00/1103662300.db2.gz XARWHYNYHLIQNQ-OXJNMPFZSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C2CCC2)cc1)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001483418321 1103662311 /nfs/dbraw/zinc/66/23/11/1103662311.db2.gz XARWHYNYHLIQNQ-OXJNMPFZSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)Cc1ccc2ncccc2c1 ZINC001483422706 1103677790 /nfs/dbraw/zinc/67/77/90/1103677790.db2.gz YHNRKWHRMMUSQQ-MRXNPFEDSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)Cc1ccc2ncccc2c1 ZINC001483422706 1103677796 /nfs/dbraw/zinc/67/77/96/1103677796.db2.gz YHNRKWHRMMUSQQ-MRXNPFEDSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCCC[C@@H]1C[NH2+]Cc1ccccc1F ZINC001483446930 1103733360 /nfs/dbraw/zinc/73/33/60/1103733360.db2.gz DZAYEZCORYULCP-IEBWSBKVSA-N 1 3 349.494 2.931 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H](C[NH2+]C/C=C\c3ccccc3)C2)CCC1 ZINC001662639677 1103739825 /nfs/dbraw/zinc/73/98/25/1103739825.db2.gz CLVSHNVSVHFQRY-FUKWUPMWSA-N 1 3 341.499 2.622 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H]2CCN(C(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001662680764 1103755217 /nfs/dbraw/zinc/75/52/17/1103755217.db2.gz SVSZZSPRZCXZPJ-VQTJNVASSA-N 1 3 345.531 2.562 10 0 EFAEHO CC(C)CCC[NH2+]C[C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001662685123 1103757267 /nfs/dbraw/zinc/75/72/67/1103757267.db2.gz BYHNVTDCTCPICL-QGZVFWFLSA-N 1 3 325.541 2.839 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+][C@@H](C)c1ccccc1F)N(C)C ZINC001483471695 1103776074 /nfs/dbraw/zinc/77/60/74/1103776074.db2.gz SDPARHBPGGRJBI-YJBOKZPZSA-N 1 3 337.483 2.911 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)[C@H]1CCCCN1C)c1ccccc1F ZINC001483474688 1103782613 /nfs/dbraw/zinc/78/26/13/1103782613.db2.gz MNPRVCJYUHSTBI-MAUKXSAKSA-N 1 3 335.467 2.809 10 0 EFAEHO CN(CCC[NH2+]Cc1cc2ccccc2s1)C(=O)[C@H]1CCCN1C ZINC001483484780 1103802984 /nfs/dbraw/zinc/80/29/84/1103802984.db2.gz SWYYAFKCMAAVOX-QGZVFWFLSA-N 1 3 345.512 2.934 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+]Cc1ccc2c(c1)CCC2)N(C)C ZINC001483490376 1103806335 /nfs/dbraw/zinc/80/63/35/1103806335.db2.gz HUGHATGGCZHKJZ-HXUWFJFHSA-N 1 3 345.531 2.700 10 0 EFAEHO CCCCC[NH2+][C@H](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001662975048 1103913517 /nfs/dbraw/zinc/91/35/17/1103913517.db2.gz SPWKJYKRYZPUPO-QAPCUYQASA-N 1 3 329.504 2.874 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](CNCC=C(Cl)Cl)C1CC1 ZINC001483564088 1103957204 /nfs/dbraw/zinc/95/72/04/1103957204.db2.gz LVYOTVQCAOCQHZ-UONOGXRCSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](CNCC=C(Cl)Cl)C1CC1 ZINC001483564088 1103957212 /nfs/dbraw/zinc/95/72/12/1103957212.db2.gz LVYOTVQCAOCQHZ-UONOGXRCSA-N 1 3 348.318 2.664 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@H]1CCC[N@@H+]1C/C=C\Cl)N(C)C ZINC001663071763 1103960597 /nfs/dbraw/zinc/96/05/97/1103960597.db2.gz IPGGRZHDAYUVJG-WDSKNZHCSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@H]1CCC[N@H+]1C/C=C\Cl)N(C)C ZINC001663071763 1103960604 /nfs/dbraw/zinc/96/06/04/1103960604.db2.gz IPGGRZHDAYUVJG-WDSKNZHCSA-N 1 3 329.916 2.686 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@@H]2C[NH2+]CCc2cccs2)CCC1 ZINC001272269690 1104157382 /nfs/dbraw/zinc/15/73/82/1104157382.db2.gz FWTQRBTZFPTMHR-WBVHZDCISA-N 1 3 349.544 2.649 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)[C@@H](C)CNC(=O)CN(C)C2CCC2)c1 ZINC001409557881 1104224820 /nfs/dbraw/zinc/22/48/20/1104224820.db2.gz AZBYKNMCEZAIJH-JKSUJKDBSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)[C@@H](C)CNC(=O)CN(C)C2CCC2)c1 ZINC001409557881 1104224826 /nfs/dbraw/zinc/22/48/26/1104224826.db2.gz AZBYKNMCEZAIJH-JKSUJKDBSA-N 1 3 347.503 2.677 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[NH2+]Cc1cccc2ccccc21)N(C)C ZINC001663996455 1104259025 /nfs/dbraw/zinc/25/90/25/1104259025.db2.gz VAPCXQCTAWWQSF-FQEVSTJZSA-N 1 3 341.499 2.974 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)N(C)Cc1ccc(CF)cc1 ZINC001409567746 1104284489 /nfs/dbraw/zinc/28/44/89/1104284489.db2.gz PLGYVYXREWZKQE-QFBILLFUSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)N(C)Cc1ccc(CF)cc1 ZINC001409567746 1104284496 /nfs/dbraw/zinc/28/44/96/1104284496.db2.gz PLGYVYXREWZKQE-QFBILLFUSA-N 1 3 349.494 2.967 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)[C@H](C)CNC(=O)c1sccc1CN(C)C ZINC001409568310 1104285736 /nfs/dbraw/zinc/28/57/36/1104285736.db2.gz JQGXSRSPTPRPMA-TZMCWYRMSA-N 1 3 329.485 2.608 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)[C@H](C)CNC(=O)c1sccc1CN(C)C ZINC001409568310 1104285743 /nfs/dbraw/zinc/28/57/43/1104285743.db2.gz JQGXSRSPTPRPMA-TZMCWYRMSA-N 1 3 329.485 2.608 10 0 EFAEHO CC[C@H](F)CNCCN(C)C(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001664138095 1104297519 /nfs/dbraw/zinc/29/75/19/1104297519.db2.gz HQDJSPDNSFAEHG-RDJZCZTQSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H](F)CNCCN(C)C(=O)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001664138095 1104297524 /nfs/dbraw/zinc/29/75/24/1104297524.db2.gz HQDJSPDNSFAEHG-RDJZCZTQSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[NH2+]CCc1ccccc1Cl)N(C)C ZINC001664169979 1104306614 /nfs/dbraw/zinc/30/66/14/1104306614.db2.gz VTHDOVRBMKOGKH-QGZVFWFLSA-N 1 3 339.911 2.517 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC001664395120 1104376853 /nfs/dbraw/zinc/37/68/53/1104376853.db2.gz MBJDPXZELSOYRC-UHFFFAOYSA-N 1 3 346.302 2.882 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)[C@H](C)CNC(=O)C2(N(C)C)CCC2)c1 ZINC001409599885 1104453177 /nfs/dbraw/zinc/45/31/77/1104453177.db2.gz YZHMISPTOUZWBU-HZPDHXFCSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)[C@H](C)CNC(=O)C2(N(C)C)CCC2)c1 ZINC001409599885 1104453181 /nfs/dbraw/zinc/45/31/81/1104453181.db2.gz YZHMISPTOUZWBU-HZPDHXFCSA-N 1 3 347.503 2.677 10 0 EFAEHO CC(C)=CCN[C@@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)c1ccccc1 ZINC001664599414 1104467015 /nfs/dbraw/zinc/46/70/15/1104467015.db2.gz RFLNARIEIHIRPT-HKUYNNGSSA-N 1 3 329.488 2.742 10 0 EFAEHO CC(C)=CCN[C@@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)c1ccccc1 ZINC001664599414 1104467022 /nfs/dbraw/zinc/46/70/22/1104467022.db2.gz RFLNARIEIHIRPT-HKUYNNGSSA-N 1 3 329.488 2.742 10 0 EFAEHO CC(C)=CCN[C@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)c1ccccc1 ZINC001664599416 1104467606 /nfs/dbraw/zinc/46/76/06/1104467606.db2.gz RFLNARIEIHIRPT-IEBWSBKVSA-N 1 3 329.488 2.742 10 0 EFAEHO CC(C)=CCN[C@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)c1ccccc1 ZINC001664599416 1104467613 /nfs/dbraw/zinc/46/76/13/1104467613.db2.gz RFLNARIEIHIRPT-IEBWSBKVSA-N 1 3 329.488 2.742 10 0 EFAEHO C[C@@H](CNCc1cc2ccccc2o1)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001483236597 1104491830 /nfs/dbraw/zinc/49/18/30/1104491830.db2.gz LYOPIHKFVGFACC-DOTOQJQBSA-N 1 3 343.471 2.902 10 0 EFAEHO C[C@@H](CNCc1cc2ccccc2o1)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001483236597 1104491835 /nfs/dbraw/zinc/49/18/35/1104491835.db2.gz LYOPIHKFVGFACC-DOTOQJQBSA-N 1 3 343.471 2.902 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@H](C)CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001409622566 1104539996 /nfs/dbraw/zinc/53/99/96/1104539996.db2.gz YXAANVCUVLSQEU-BBWFWOEESA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@H](C)CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001409622566 1104540008 /nfs/dbraw/zinc/54/00/08/1104540008.db2.gz YXAANVCUVLSQEU-BBWFWOEESA-N 1 3 349.494 2.801 10 0 EFAEHO COc1cccc([C@H](C)N(C)[C@@H](C)CNC(=O)C2(C[NH+](C)C)CC2)c1 ZINC001409630676 1104557675 /nfs/dbraw/zinc/55/76/75/1104557675.db2.gz PYMDJQGJMPMANF-HOTGVXAUSA-N 1 3 347.503 2.535 10 0 EFAEHO CC/C=C/CC[N@H+](C)C[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001664848603 1104574740 /nfs/dbraw/zinc/57/47/40/1104574740.db2.gz HBSQBGSJECWXPH-ZMBJWTFHSA-N 1 3 335.536 2.855 10 0 EFAEHO CC/C=C/CC[N@@H+](C)C[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001664848603 1104574751 /nfs/dbraw/zinc/57/47/51/1104574751.db2.gz HBSQBGSJECWXPH-ZMBJWTFHSA-N 1 3 335.536 2.855 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N(C)CCN(C)C(=O)CC[NH+](C)C ZINC001482625280 1104683037 /nfs/dbraw/zinc/68/30/37/1104683037.db2.gz PSIKIFSRLQKTHS-CQSZACIVSA-N 1 3 325.884 2.743 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2CC2CC3(CCC3)C2)C1 ZINC001482663753 1104766278 /nfs/dbraw/zinc/76/62/78/1104766278.db2.gz BVPQNILMTHQKKG-OALUTQOASA-N 1 3 347.547 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2CC2CC3(CCC3)C2)C1 ZINC001482663753 1104766284 /nfs/dbraw/zinc/76/62/84/1104766284.db2.gz BVPQNILMTHQKKG-OALUTQOASA-N 1 3 347.547 2.831 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC1(C[NH2+]CCC(F)(F)F)CCCC1 ZINC001665968320 1104818413 /nfs/dbraw/zinc/81/84/13/1104818413.db2.gz FFGJUFWYFLDTQO-ZIAGYGMSSA-N 1 3 349.441 2.830 10 0 EFAEHO CCCC[NH2+]C[C@@](C)(NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001666021731 1104831672 /nfs/dbraw/zinc/83/16/72/1104831672.db2.gz KJHCKENUWAVKIB-MOPGFXCFSA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@H](F)CC[NH2+]CC[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001666157067 1104886137 /nfs/dbraw/zinc/88/61/37/1104886137.db2.gz JKZCAAIANYKMTK-ROUUACIJSA-N 1 3 341.515 2.685 10 0 EFAEHO CCCCCC[N@@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CCCN1C)CC2 ZINC001666494895 1104950039 /nfs/dbraw/zinc/95/00/39/1104950039.db2.gz GOPLKVBYUJXPQC-SFHVURJKSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCCC[N@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CCCN1C)CC2 ZINC001666494895 1104950043 /nfs/dbraw/zinc/95/00/43/1104950043.db2.gz GOPLKVBYUJXPQC-SFHVURJKSA-N 1 3 335.536 2.975 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]Cc1ccc(F)cc1 ZINC001482696586 1104952780 /nfs/dbraw/zinc/95/27/80/1104952780.db2.gz CUUHFOIRMRFBCX-FUHWJXTLSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]CC1CC2(CCC2)C1 ZINC001482697722 1104953760 /nfs/dbraw/zinc/95/37/60/1104953760.db2.gz HEMYRYRDFFADEV-ZWKOTPCHSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]CCCF)CCCC1)N1CCCCC1 ZINC001666759914 1104994460 /nfs/dbraw/zinc/99/44/60/1104994460.db2.gz ONWHJIFVNLEQIJ-UHFFFAOYSA-N 1 3 327.488 2.629 10 0 EFAEHO CCCCC[NH2+][C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C[C@H]1C ZINC001667196850 1105076568 /nfs/dbraw/zinc/07/65/68/1105076568.db2.gz DSLHLUKFYOJGSY-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@H](CC[NH2+]Cc1cc2ccccc2o1)NC(=O)C1(N(C)C)CCC1 ZINC001482840137 1105079545 /nfs/dbraw/zinc/07/95/45/1105079545.db2.gz RKXMRNODLKFGFJ-OAHLLOKOSA-N 1 3 343.471 2.902 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001482888911 1105147275 /nfs/dbraw/zinc/14/72/75/1105147275.db2.gz NJNPALDOACURGE-PBHICJAKSA-N 1 3 339.911 2.911 10 0 EFAEHO CC[C@H](F)CNCCN(CC)C(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001482945588 1105232455 /nfs/dbraw/zinc/23/24/55/1105232455.db2.gz OWNYNURGYRPTNB-WMZOPIPTSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@H](F)CNCCN(CC)C(=O)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001482945588 1105232458 /nfs/dbraw/zinc/23/24/58/1105232458.db2.gz OWNYNURGYRPTNB-WMZOPIPTSA-N 1 3 341.515 2.970 10 0 EFAEHO CCN(CCNC/C=C\Cl)C(=O)[C@H]1C[N@H+](C)C[C@@H]1c1ccccc1 ZINC001482951932 1105235252 /nfs/dbraw/zinc/23/52/52/1105235252.db2.gz SNEJWWGSUIGCBZ-JWJFLKPDSA-N 1 3 349.906 2.522 10 0 EFAEHO CCN(CCNC/C=C\Cl)C(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1 ZINC001482951932 1105235255 /nfs/dbraw/zinc/23/52/55/1105235255.db2.gz SNEJWWGSUIGCBZ-JWJFLKPDSA-N 1 3 349.906 2.522 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)cc1)C(=O)CN1CCC(C)CC1 ZINC001482957794 1105242362 /nfs/dbraw/zinc/24/23/62/1105242362.db2.gz GJIKYJJPMRUCKD-UHFFFAOYSA-N 1 3 331.504 2.665 10 0 EFAEHO CCc1ccc(C[NH2+]CC[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001668215154 1105258963 /nfs/dbraw/zinc/25/89/63/1105258963.db2.gz XFDUGVJEFWILPS-IRXDYDNUSA-N 1 3 331.504 2.575 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]CCc1ccccc1 ZINC001668234280 1105263133 /nfs/dbraw/zinc/26/31/33/1105263133.db2.gz HJPWYLFEJIURKE-UYAOXDASSA-N 1 3 345.531 2.976 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)CC[NH2+]Cc1ccccc1 ZINC001668234631 1105263264 /nfs/dbraw/zinc/26/32/64/1105263264.db2.gz NKAKXMAYADKNKQ-MJGOQNOKSA-N 1 3 331.504 2.934 10 0 EFAEHO CCN(CC[NH2+]CCc1cccs1)C(=O)[C@H]1CCCCN1CC ZINC001482969370 1105266439 /nfs/dbraw/zinc/26/64/39/1105266439.db2.gz FARSXVGSTWZZRY-QGZVFWFLSA-N 1 3 337.533 2.603 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1cc2ccccc2o1)N(C)C ZINC001668279264 1105272072 /nfs/dbraw/zinc/27/20/72/1105272072.db2.gz QWVUUWCFBQFKOC-RHSMWYFYSA-N 1 3 331.460 2.757 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1ccccc1F ZINC001668319553 1105281329 /nfs/dbraw/zinc/28/13/29/1105281329.db2.gz IHYKAAHDXQCCGU-YJBOKZPZSA-N 1 3 335.467 2.685 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(C)c(F)c1 ZINC001668325679 1105282220 /nfs/dbraw/zinc/28/22/20/1105282220.db2.gz KPFYPFHIOHNXTC-LPHOPBHVSA-N 1 3 349.494 2.993 10 0 EFAEHO CCN(CC[NH2+]CC[C@@H]1CCc2ccccc21)C(=O)[C@@H]1CCCN1C ZINC001668382151 1105290629 /nfs/dbraw/zinc/29/06/29/1105290629.db2.gz UXAOQISLWPUZLA-ICSRJNTNSA-N 1 3 343.515 2.639 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001668464046 1105301844 /nfs/dbraw/zinc/30/18/44/1105301844.db2.gz BWXTZRJVTPUOGL-OALUTQOASA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNCc1cccc(F)c1)C(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001668464046 1105301850 /nfs/dbraw/zinc/30/18/50/1105301850.db2.gz BWXTZRJVTPUOGL-OALUTQOASA-N 1 3 347.478 2.781 10 0 EFAEHO CN(C)C1(C(=O)NC/C=C\C[NH2+][C@H]2CCc3ccc(F)cc32)CCC1 ZINC001668864549 1105388679 /nfs/dbraw/zinc/38/86/79/1105388679.db2.gz HSMAAAZUFCHWHE-JXCVUKRWSA-N 1 3 345.462 2.559 10 0 EFAEHO O=C(NC/C=C/CNCc1cccc(F)c1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001668884279 1105393640 /nfs/dbraw/zinc/39/36/40/1105393640.db2.gz ZXRKJJQVAOAIRX-XVXNLHAJSA-N 1 3 345.462 2.605 10 0 EFAEHO O=C(NC/C=C/CNCc1cccc(F)c1)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001668884279 1105393646 /nfs/dbraw/zinc/39/36/46/1105393646.db2.gz ZXRKJJQVAOAIRX-XVXNLHAJSA-N 1 3 345.462 2.605 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C/C[NH2+]CCC2CCCCC2)CC1 ZINC001669107843 1105436490 /nfs/dbraw/zinc/43/64/90/1105436490.db2.gz PFYHSAXZAQNLLH-AATRIKPKSA-N 1 3 335.536 2.951 10 0 EFAEHO Cc1cc(CNC/C=C/CNC(=O)[C@@H]2CCC[C@H]([NH+](C)C)C2)cs1 ZINC001669138373 1105441341 /nfs/dbraw/zinc/44/13/41/1105441341.db2.gz HJVQPCJMXWVLID-ZLKFPQNLSA-N 1 3 349.544 2.939 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/C[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001669151407 1105444772 /nfs/dbraw/zinc/44/47/72/1105444772.db2.gz SEKRULPKJGPQGG-JFDDCEBESA-N 1 3 345.478 2.660 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/CNC/C=C/Cl)[NH+]1CCCCC1 ZINC001669207872 1105458201 /nfs/dbraw/zinc/45/82/01/1105458201.db2.gz PSJJUEAJBJSOIN-DMYJOVEFSA-N 1 3 327.900 2.511 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C[NH2+]CC[C@H]1CCc2ccccc21)N(C)C ZINC001669320888 1105471552 /nfs/dbraw/zinc/47/15/52/1105471552.db2.gz TVLOCOQEMBJHLX-POAQFYNOSA-N 1 3 345.531 2.787 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@@H]1CCCC[C@H]1NC(=O)Cc1nc[nH]c1C ZINC001669979243 1105561855 /nfs/dbraw/zinc/56/18/55/1105561855.db2.gz ATFOMKIZZHVWKJ-XPQDNOAISA-N 1 3 332.492 2.882 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CCCN(C)C(=O)C1(N(C)C)CCC1 ZINC001670124603 1105584419 /nfs/dbraw/zinc/58/44/19/1105584419.db2.gz WEKUKCKRMPKQNO-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)Cc1c[nH]cn1)c1cccc(Cl)c1 ZINC001670261819 1105606854 /nfs/dbraw/zinc/60/68/54/1105606854.db2.gz WNBXPIGILQWTKK-CYBMUJFWSA-N 1 3 334.851 2.805 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)Cc1c[nH]cn1)c1cccc(Cl)c1 ZINC001670261821 1105607377 /nfs/dbraw/zinc/60/73/77/1105607377.db2.gz WNBXPIGILQWTKK-ZDUSSCGKSA-N 1 3 334.851 2.805 10 0 EFAEHO CN(CCC[NH2+]Cc1cc(F)ccc1Cl)C(=O)CN1CCCC1 ZINC001670344370 1105622025 /nfs/dbraw/zinc/62/20/25/1105622025.db2.gz GPEBIZGOEZNJQY-UHFFFAOYSA-N 1 3 341.858 2.513 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[NH2+]Cc1cccc(C)c1 ZINC001670357872 1105624254 /nfs/dbraw/zinc/62/42/54/1105624254.db2.gz VCQOZQIBTYNRQJ-LJQANCHMSA-N 1 3 331.504 2.808 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H]2C[NH2+]CCC2=CCCCC2)C1 ZINC001671347695 1105628351 /nfs/dbraw/zinc/62/83/51/1105628351.db2.gz ZVZHWFFELXCMII-HKUYNNGSSA-N 1 3 333.520 2.799 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)NC/C=C\CNCc1cccc(F)c1 ZINC001483028852 1105661854 /nfs/dbraw/zinc/66/18/54/1105661854.db2.gz RUXFTPYICFTIIW-LLHWWHOWSA-N 1 3 347.478 2.708 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)NC/C=C\CNCc1cccc(F)c1 ZINC001483028852 1105661858 /nfs/dbraw/zinc/66/18/58/1105661858.db2.gz RUXFTPYICFTIIW-LLHWWHOWSA-N 1 3 347.478 2.708 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)[C@H](CC)N(C)C)C1 ZINC001671972120 1105741881 /nfs/dbraw/zinc/74/18/81/1105741881.db2.gz MLYJAHSUBYSPFA-KTYGHDLGSA-N 1 3 345.478 2.756 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC(F)(F)[C@H](CNC(=O)[C@H](CC)N(C)C)C1 ZINC001671972120 1105741884 /nfs/dbraw/zinc/74/18/84/1105741884.db2.gz MLYJAHSUBYSPFA-KTYGHDLGSA-N 1 3 345.478 2.756 10 0 EFAEHO C[C@@H]([NH2+]CCCc1ccsc1)[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001672247472 1105785984 /nfs/dbraw/zinc/78/59/84/1105785984.db2.gz WLNQXJXIHBOFMY-AEFFLSMTSA-N 1 3 349.544 2.603 10 0 EFAEHO C[C@H]([NH2+]CCCc1ccsc1)[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001672247475 1105786140 /nfs/dbraw/zinc/78/61/40/1105786140.db2.gz WLNQXJXIHBOFMY-WMZOPIPTSA-N 1 3 349.544 2.603 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[C@H](C[NH2+]C/C=C/Cl)CC2)C1 ZINC001672376879 1105816969 /nfs/dbraw/zinc/81/69/69/1105816969.db2.gz MHEUJDAFUWVADP-VXVSHAALSA-N 1 3 341.927 2.593 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@H]2[C@H]1CCN2CCC(F)(F)F ZINC001672538453 1105864382 /nfs/dbraw/zinc/86/43/82/1105864382.db2.gz QYNRZTPKTXUERV-LSDHHAIUSA-N 1 3 349.441 2.736 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](CC[NH2+]CCCc2ccsc2)C1 ZINC001672761197 1105896341 /nfs/dbraw/zinc/89/63/41/1105896341.db2.gz DUHLIJCVOZELMP-WMZOPIPTSA-N 1 3 349.544 2.603 10 0 EFAEHO CC/C=C/CC[NH2+]CC[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001672884779 1105927686 /nfs/dbraw/zinc/92/76/86/1105927686.db2.gz DJKMYNAHHAVGPD-PXPVJAHISA-N 1 3 335.536 2.903 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H]2CCN(C(=O)CN3CCCC3)C2)c(C)s1 ZINC001672909975 1105935182 /nfs/dbraw/zinc/93/51/82/1105935182.db2.gz JQSFJWSDTQZOMC-QGZVFWFLSA-N 1 3 349.544 2.789 10 0 EFAEHO CN(CC(=O)N[C@H]1CCC[N@H+](CC2=CCCCC2)CC1)C1CCC1 ZINC001673379727 1106011173 /nfs/dbraw/zinc/01/11/73/1106011173.db2.gz ARBHEXDRXDZFCW-SFHVURJKSA-N 1 3 333.520 2.942 10 0 EFAEHO CN(CC(=O)N[C@H]1CCC[N@@H+](CC2=CCCCC2)CC1)C1CCC1 ZINC001673379727 1106011179 /nfs/dbraw/zinc/01/11/79/1106011179.db2.gz ARBHEXDRXDZFCW-SFHVURJKSA-N 1 3 333.520 2.942 10 0 EFAEHO CC(C)CCC[NH2+][C@@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1C ZINC001673904752 1106100841 /nfs/dbraw/zinc/10/08/41/1106100841.db2.gz NSUVREVEXUMNDL-DLBZAZTESA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H]([NH2+]CCCCc2ccccc2)C1 ZINC001673929679 1106104820 /nfs/dbraw/zinc/10/48/20/1106104820.db2.gz VEJYOUYSZFXSLL-QUCCMNQESA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]CCCCc2ccccc2)[C@@H](C)C1 ZINC001673929678 1106104988 /nfs/dbraw/zinc/10/49/88/1106104988.db2.gz VEJYOUYSZFXSLL-ICSRJNTNSA-N 1 3 345.531 2.786 10 0 EFAEHO CCCC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN1CC[C@@H](C)C1 ZINC001674429454 1106187113 /nfs/dbraw/zinc/18/71/13/1106187113.db2.gz JKHNXXZUYMYTMJ-XFQXTVEOSA-N 1 3 329.488 2.500 10 0 EFAEHO CCC/C=C/CC[N@H+](C)C[C@@H]1CCCN1C(=O)CN1CC[C@H](C)C1 ZINC001674481296 1106200126 /nfs/dbraw/zinc/20/01/26/1106200126.db2.gz SBMWAODXTSMGDA-FNYRVFDFSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[N@@H+](C)C[C@@H]1CCCN1C(=O)CN1CC[C@H](C)C1 ZINC001674481296 1106200131 /nfs/dbraw/zinc/20/01/31/1106200131.db2.gz SBMWAODXTSMGDA-FNYRVFDFSA-N 1 3 335.536 2.997 10 0 EFAEHO C[N@H+](CCC1=CCCCC1)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001674495487 1106204505 /nfs/dbraw/zinc/20/45/05/1106204505.db2.gz JYRGPRRNFYMKBN-IBGZPJMESA-N 1 3 333.520 2.896 10 0 EFAEHO C[N@@H+](CCC1=CCCCC1)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001674495487 1106204511 /nfs/dbraw/zinc/20/45/11/1106204511.db2.gz JYRGPRRNFYMKBN-IBGZPJMESA-N 1 3 333.520 2.896 10 0 EFAEHO CCCCC[NH2+]CC1CC(NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001674583477 1106218763 /nfs/dbraw/zinc/21/87/63/1106218763.db2.gz QEKDYKQVVPNWNA-LADRWXRNSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H](C)[NH2+]CCCc1cccc(F)c1 ZINC001674759613 1106252653 /nfs/dbraw/zinc/25/26/53/1106252653.db2.gz FPMVONSPOFCTNO-KBPBESRZSA-N 1 3 346.450 2.515 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC(C)(C)C[NH2+]CC=C(Cl)Cl ZINC001674876914 1106268232 /nfs/dbraw/zinc/26/82/32/1106268232.db2.gz KXLIFDJSKQCLAN-UHFFFAOYSA-N 1 3 338.323 2.720 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C)C1)C1C[NH+](CCC2=CCCCC2)C1 ZINC001675343904 1106344846 /nfs/dbraw/zinc/34/48/46/1106344846.db2.gz XPWDMQZNPJCKPO-IRXDYDNUSA-N 1 3 333.520 2.655 10 0 EFAEHO CCCCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001675517810 1106378186 /nfs/dbraw/zinc/37/81/86/1106378186.db2.gz NPVFJCRBOBLNEE-NNZMDNLPSA-N 1 3 335.536 2.735 10 0 EFAEHO CCCCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCCC3)[C@@H]2C1 ZINC001675517810 1106378192 /nfs/dbraw/zinc/37/81/92/1106378192.db2.gz NPVFJCRBOBLNEE-NNZMDNLPSA-N 1 3 335.536 2.735 10 0 EFAEHO CCCCCC[N@@H+]1CCCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001675673576 1106408454 /nfs/dbraw/zinc/40/84/54/1106408454.db2.gz UETMZQWGGPAUDK-GOSISDBHSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCCC[N@H+]1CCCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001675673576 1106408456 /nfs/dbraw/zinc/40/84/56/1106408456.db2.gz UETMZQWGGPAUDK-GOSISDBHSA-N 1 3 335.536 2.833 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CCc2ccccc2)C1 ZINC001675739602 1106417886 /nfs/dbraw/zinc/41/78/86/1106417886.db2.gz HTOVAWQJFJJSDW-VAMGGRTRSA-N 1 3 343.515 2.586 10 0 EFAEHO Cc1ccccc1C[NH2+]CCC[C@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001675973222 1106457508 /nfs/dbraw/zinc/45/75/08/1106457508.db2.gz HVTMHGYPSAFXEI-WMZOPIPTSA-N 1 3 331.504 2.711 10 0 EFAEHO Cc1ccccc1C[NH2+]CCC[C@@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001675973220 1106457879 /nfs/dbraw/zinc/45/78/79/1106457879.db2.gz HVTMHGYPSAFXEI-FUHWJXTLSA-N 1 3 331.504 2.711 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CCC[NH2+]Cc1ccccc1 ZINC001676024567 1106471501 /nfs/dbraw/zinc/47/15/01/1106471501.db2.gz WBDOSRLGCAUQHI-PKOBYXMFSA-N 1 3 331.504 2.936 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)[C@@H](C[NH2+]CCC2CCCC2)C2CC2)C1 ZINC001676249294 1106505788 /nfs/dbraw/zinc/50/57/88/1106505788.db2.gz KFNZBIJAFNBCCC-LPHOPBHVSA-N 1 3 335.536 2.735 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@H](C[NH2+]CCc3cccs3)C2)CCC1 ZINC001676933560 1106630237 /nfs/dbraw/zinc/63/02/37/1106630237.db2.gz YEOWTWLDSLJPAI-JKSUJKDBSA-N 1 3 349.544 2.649 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CC[C@@H](C[NH2+]CCC2CCCC2)C1 ZINC001676970232 1106639632 /nfs/dbraw/zinc/63/96/32/1106639632.db2.gz MYMRWGUWWZTPQM-IAGOWNOFSA-N 1 3 332.492 2.715 10 0 EFAEHO CCCC[NH2+][C@H]1CN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1(C)C ZINC001677023834 1106651478 /nfs/dbraw/zinc/65/14/78/1106651478.db2.gz PWJAZKPUAGJNSX-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@@H]([NH2+]CCCC(C)(C)C)C(C)(C)C1)N(C)C ZINC001677033054 1106653565 /nfs/dbraw/zinc/65/35/65/1106653565.db2.gz RDOHHMICOMMOBT-JKSUJKDBSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)(C)[C@H](C[NH2+]CCCF)NC(=O)C(C)(C)N1CCCCC1 ZINC001677248193 1106683078 /nfs/dbraw/zinc/68/30/78/1106683078.db2.gz WNQJONUGHXQUAU-HNNXBMFYSA-N 1 3 329.504 2.731 10 0 EFAEHO CC(C)(C)[C@@H](C[NH2+]CCCF)NC(=O)C(C)(C)N1CCCCC1 ZINC001677248194 1106683581 /nfs/dbraw/zinc/68/35/81/1106683581.db2.gz WNQJONUGHXQUAU-OAHLLOKOSA-N 1 3 329.504 2.731 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C(F)(F)F)[C@@H]([NH2+]CC=C(C)C)C1 ZINC001677376078 1106708905 /nfs/dbraw/zinc/70/89/05/1106708905.db2.gz MZCLTJFLPQERMB-GJZGRUSLSA-N 1 3 349.441 2.663 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C(F)(F)F)[C@H]([NH2+]CC=C(C)C)C1 ZINC001677376079 1106709422 /nfs/dbraw/zinc/70/94/22/1106709422.db2.gz MZCLTJFLPQERMB-HUUCEWRRSA-N 1 3 349.441 2.663 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@H+](C[C@@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001677602909 1106770289 /nfs/dbraw/zinc/77/02/89/1106770289.db2.gz AXPDFKICCIGXEH-CVEARBPZSA-N 1 3 343.462 2.510 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@@H+](C[C@@H]2CCC(F)(F)C2)CC1)N(C)C ZINC001677602909 1106770302 /nfs/dbraw/zinc/77/03/02/1106770302.db2.gz AXPDFKICCIGXEH-CVEARBPZSA-N 1 3 343.462 2.510 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/C[NH2+][C@@H](C)c1ccc(F)cc1)N(C)C ZINC001483055703 1107692598 /nfs/dbraw/zinc/69/25/98/1107692598.db2.gz BJHBPADZPFLHDD-XDWWLABZSA-N 1 3 335.467 2.735 10 0 EFAEHO CC/C=C\CCN1CC[C@H]1CNC(=O)C1CC[NH+](CC2CC2)CC1 ZINC001483691271 1107837461 /nfs/dbraw/zinc/83/74/61/1107837461.db2.gz DWYLZCSAZUHTPG-LLHWWHOWSA-N 1 3 333.520 2.655 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]CCCC(C)(C)C ZINC001272331309 1107850852 /nfs/dbraw/zinc/85/08/52/1107850852.db2.gz FODSLBWEHIYQRN-JKSUJKDBSA-N 1 3 334.508 2.961 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)c(C)c1 ZINC001409364376 1107909025 /nfs/dbraw/zinc/90/90/25/1107909025.db2.gz LCFSTGKYQRCEQS-IAGOWNOFSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)c(C)c1 ZINC001409364401 1107909793 /nfs/dbraw/zinc/90/97/93/1107909793.db2.gz LCFSTGKYQRCEQS-SJORKVTESA-N 1 3 331.504 2.771 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C\C[NH2+][C@@H]1CCCc2ccc(F)cc21)N(C)C ZINC001483061058 1107911053 /nfs/dbraw/zinc/91/10/53/1107911053.db2.gz RQNLTBNUITUXHI-WYNBNGFRSA-N 1 3 347.478 2.805 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@@H]21 ZINC001272216713 1107920763 /nfs/dbraw/zinc/92/07/63/1107920763.db2.gz WUJWBHKLYALZCG-NIAAJLDISA-N 1 3 333.520 2.750 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@@H]21 ZINC001272216713 1107920778 /nfs/dbraw/zinc/92/07/78/1107920778.db2.gz WUJWBHKLYALZCG-NIAAJLDISA-N 1 3 333.520 2.750 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC[C@H]1CCN1C[C@H]1CCCC(F)(F)C1 ZINC001483693286 1107936859 /nfs/dbraw/zinc/93/68/59/1107936859.db2.gz LVSBLCMFHPEFLQ-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC[C@H]1CCN1C[C@H]1CCCC(F)(F)C1 ZINC001483693286 1107936864 /nfs/dbraw/zinc/93/68/64/1107936864.db2.gz LVSBLCMFHPEFLQ-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO C[C@@H](NCc1cccc(Cl)c1F)[C@@H](C)NC(=O)CCC[NH+](C)C ZINC001409369733 1107962956 /nfs/dbraw/zinc/96/29/56/1107962956.db2.gz BYHCOHLRXGCJIC-CHWSQXEVSA-N 1 3 343.874 2.804 10 0 EFAEHO C[C@H](NCc1cccc(Cl)c1F)[C@H](C)NC(=O)CCC[NH+](C)C ZINC001409369906 1107965194 /nfs/dbraw/zinc/96/51/94/1107965194.db2.gz BYHCOHLRXGCJIC-STQMWFEESA-N 1 3 343.874 2.804 10 0 EFAEHO C[C@@H](NC(=O)CC[N@H+](C)C1CCCCC1)[C@H](C)NCc1ccccn1 ZINC001409380505 1108072173 /nfs/dbraw/zinc/07/21/73/1108072173.db2.gz QTAXZJQTSVDBDW-DLBZAZTESA-N 1 3 346.519 2.719 10 0 EFAEHO C[C@@H](NC(=O)CC[N@@H+](C)C1CCCCC1)[C@H](C)NCc1ccccn1 ZINC001409380505 1108072181 /nfs/dbraw/zinc/07/21/81/1108072181.db2.gz QTAXZJQTSVDBDW-DLBZAZTESA-N 1 3 346.519 2.719 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC/C=C\CNCc2ccc(Cl)cc2)CC1 ZINC001483070714 1108303344 /nfs/dbraw/zinc/30/33/44/1108303344.db2.gz RTGMFGLFDDFXAI-IHWYPQMZSA-N 1 3 349.906 2.834 10 0 EFAEHO C[C@@H](C(=O)NC/C=C\CNCc1ccsc1)[NH+]1CCCCCC1 ZINC001483071299 1108332625 /nfs/dbraw/zinc/33/26/25/1108332625.db2.gz VDMHQZWJGVSCCE-AWFCHZOYSA-N 1 3 335.517 2.775 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H]2CCN(C(=O)C3(N(C)C)CCC3)C2)cs1 ZINC001272458463 1108388618 /nfs/dbraw/zinc/38/86/18/1108388618.db2.gz ZAQNGLYTBNVTAH-MRXNPFEDSA-N 1 3 349.544 2.869 10 0 EFAEHO C[C@@H]([NH2+]C/C=C/CNC(=O)CN1CCC(C)CC1)c1ccccc1 ZINC001483078557 1108419725 /nfs/dbraw/zinc/41/97/25/1108419725.db2.gz RBQNUKLIULWYDM-IPLHWJFFSA-N 1 3 329.488 2.742 10 0 EFAEHO CCCN(C)CC(=O)NC/C=C/C[NH2+][C@@H]1CCc2c1cccc2Cl ZINC001483087553 1108486073 /nfs/dbraw/zinc/48/60/73/1108486073.db2.gz QOLXTZCJMRATAH-SHCNBLLESA-N 1 3 349.906 2.931 10 0 EFAEHO O=C(CN1CCCC1)NC/C=C\C[NH2+]Cc1cccc2ccccc21 ZINC001483093604 1108577383 /nfs/dbraw/zinc/57/73/83/1108577383.db2.gz RYXGLDQSLVTPFP-ARJAWSKDSA-N 1 3 337.467 2.698 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]Cc2ccc(Cl)cc2)C1 ZINC001272524473 1108617018 /nfs/dbraw/zinc/61/70/18/1108617018.db2.gz RYRCOGWZPSEHPU-FUHWJXTLSA-N 1 3 349.906 2.762 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CC1)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001483740655 1108718233 /nfs/dbraw/zinc/71/82/33/1108718233.db2.gz NMRWEANGLPGTGK-KRWDZBQOSA-N 1 3 347.528 2.894 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CC1)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001483740655 1108718242 /nfs/dbraw/zinc/71/82/42/1108718242.db2.gz NMRWEANGLPGTGK-KRWDZBQOSA-N 1 3 347.528 2.894 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@@H]3C[C@@H]3[C@@H]3C[C@H]3C)CC2)CC1 ZINC000899398793 1109311241 /nfs/dbraw/zinc/31/12/41/1109311241.db2.gz BUJLZGPGQTYVSZ-VUBSUSDNSA-N 1 3 347.547 2.591 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC1CC(NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001409290762 1109392339 /nfs/dbraw/zinc/39/23/39/1109392339.db2.gz OSKAIJNQZMMKBC-IIIMJFFVSA-N 1 3 335.467 2.594 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001409299867 1109458146 /nfs/dbraw/zinc/45/81/46/1109458146.db2.gz WIRRTGWEZWTYJY-CTWPCTMYSA-N 1 3 331.504 2.628 10 0 EFAEHO C[C@H](C[NH2+]CC1=CCCCC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001483166126 1109920815 /nfs/dbraw/zinc/92/08/15/1109920815.db2.gz AESZNXHPMQJWNE-BEFAXECRSA-N 1 3 339.499 2.794 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCCN2C(C)C)cc1F ZINC001483172441 1109942028 /nfs/dbraw/zinc/94/20/28/1109942028.db2.gz QCJRRJXIFYYLEJ-APWZRJJASA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+][C@H](C)c2cccc(Cl)c2)CC1)N(C)C ZINC001483745925 1111154586 /nfs/dbraw/zinc/15/45/86/1111154586.db2.gz ILYVHOFTSJVIMS-CZUORRHYSA-N 1 3 337.895 2.980 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2csc(C)c2)C1)N(C)C ZINC001272617590 1111751331 /nfs/dbraw/zinc/75/13/31/1111751331.db2.gz XOEWNDWDXPHXIF-WBVHZDCISA-N 1 3 337.533 2.725 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](CC[NH2+]Cc2ccccc2C)C1 ZINC001272625575 1111765154 /nfs/dbraw/zinc/76/51/54/1111765154.db2.gz WAJFWZHMRPXTQS-SFHVURJKSA-N 1 3 331.504 2.665 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[NH2+]CCc1ccccc1Cl ZINC001671281019 1111841162 /nfs/dbraw/zinc/84/11/62/1111841162.db2.gz NDCPAWYZHARBEH-WMZOPIPTSA-N 1 3 349.906 2.557 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)C1C[NH+](CCCC2CCC2)C1 ZINC001409902940 1112016467 /nfs/dbraw/zinc/01/64/67/1112016467.db2.gz GIKTVSHJRZLDSI-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1(NCc2cc(Cl)cc(Cl)c2)CC1 ZINC001483763364 1112156697 /nfs/dbraw/zinc/15/66/97/1112156697.db2.gz CBXGGQDKUSZSCC-UHFFFAOYSA-N 1 3 344.286 2.684 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)NCC2(NCc3ccsc3)CC2)CC1 ZINC001483781757 1112445858 /nfs/dbraw/zinc/44/58/58/1112445858.db2.gz VKVUTEDNKZZECH-UHFFFAOYSA-N 1 3 335.517 2.607 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]C/C=C\c2ccc(Cl)cc2)CC1 ZINC001483795329 1112455341 /nfs/dbraw/zinc/45/53/41/1112455341.db2.gz QYBUJVANYKLWLR-PLNGDYQASA-N 1 3 349.906 2.932 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(F)c1)C2 ZINC001483832325 1112492621 /nfs/dbraw/zinc/49/26/21/1112492621.db2.gz BONGLZYSUXURIP-HXUWFJFHSA-N 1 3 347.478 2.592 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@]2(CCN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001483842158 1112500325 /nfs/dbraw/zinc/50/03/25/1112500325.db2.gz MTYSAZRDLGAWGH-FQEVSTJZSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@]2(CCN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001483842158 1112500329 /nfs/dbraw/zinc/50/03/29/1112500329.db2.gz MTYSAZRDLGAWGH-FQEVSTJZSA-N 1 3 335.536 2.831 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)cs1 ZINC001483913866 1112556365 /nfs/dbraw/zinc/55/63/65/1112556365.db2.gz KJUOICTXZIKSJN-WMLDXEAASA-N 1 3 337.533 2.866 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CCCCCF)CCN1C(=O)CN(C)C1CCC1 ZINC001483905492 1112566141 /nfs/dbraw/zinc/56/61/41/1112566141.db2.gz NRGMAIZEZKFRNO-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@H]1CCCN1C(=O)C(C)(C)N1CCCCC1 ZINC001483929245 1112571339 /nfs/dbraw/zinc/57/13/39/1112571339.db2.gz ISTIRBUFTCWJNX-CVEARBPZSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H](C(=O)N[C@@H](C[NH2+]CCCF)C1CCCC1)N1CCCCCC1 ZINC001484008609 1112657085 /nfs/dbraw/zinc/65/70/85/1112657085.db2.gz SRRLQYYGHFCAMT-AEFFLSMTSA-N 1 3 341.515 2.875 10 0 EFAEHO CCCCC[NH+]1CCC(C)(CNC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001484142336 1112830211 /nfs/dbraw/zinc/83/02/11/1112830211.db2.gz YLUVQWZHYXIWLJ-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCc1ccc([C@@H](C)[NH2+]CC[C@@H](C)F)cc1 ZINC001484563262 1113018954 /nfs/dbraw/zinc/01/89/54/1113018954.db2.gz LYULLVWUESIEMT-ZIAGYGMSSA-N 1 3 346.450 2.976 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]CC[C@@H]2CCCC2(F)F)CCC1 ZINC001484663086 1113103607 /nfs/dbraw/zinc/10/36/07/1113103607.db2.gz GWYZUXIDZFWVKW-HNNXBMFYSA-N 1 3 345.478 2.781 10 0 EFAEHO CCCCC[N@@H+]1CC[C@]2(C1)CCCN(C(=O)CN1CC[C@@H](C)C1)C2 ZINC001484828810 1117746980 /nfs/dbraw/zinc/74/69/80/1117746980.db2.gz DCKQWONQPJRGAG-QUCCMNQESA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCC[N@H+]1CC[C@]2(C1)CCCN(C(=O)CN1CC[C@@H](C)C1)C2 ZINC001484828810 1117746987 /nfs/dbraw/zinc/74/69/87/1117746987.db2.gz DCKQWONQPJRGAG-QUCCMNQESA-N 1 3 335.536 2.833 10 0 EFAEHO CC[NH2+]C1(CC)CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001484816681 1117749579 /nfs/dbraw/zinc/74/95/79/1117749579.db2.gz OQJAGHIOVWKCDX-GOSISDBHSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@H]1[NH2+]CC1=CCCCC1 ZINC001484899149 1117814557 /nfs/dbraw/zinc/81/45/57/1117814557.db2.gz FKFVCRGEVQWKAU-FUHWJXTLSA-N 1 3 335.536 2.901 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H]1CN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001484910975 1117824846 /nfs/dbraw/zinc/82/48/46/1117824846.db2.gz ZAVFJPIAGZFGGF-AZUAARDMSA-N 1 3 345.531 2.704 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](NC(=O)CC[NH+](C)C)C[C@@H]2C)cc1F ZINC001484982553 1117905934 /nfs/dbraw/zinc/90/59/34/1117905934.db2.gz MUFDWGYKHRPPMZ-DOTOQJQBSA-N 1 3 335.467 2.555 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](NC(=O)CC[NH+](C)C)C[C@H]2C)cc1F ZINC001484982556 1117905984 /nfs/dbraw/zinc/90/59/84/1117905984.db2.gz MUFDWGYKHRPPMZ-NVXWUHKLSA-N 1 3 335.467 2.555 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@H](NC(=O)Cc2nc[nH]c2C)C[C@@H]1C ZINC001484986442 1117913012 /nfs/dbraw/zinc/91/30/12/1117913012.db2.gz RLAULFAXNCPQEL-PDZIMXBZSA-N 1 3 332.492 2.976 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@H](NC(=O)Cc2nc[nH]c2C)C[C@@H]1C ZINC001484986442 1117913017 /nfs/dbraw/zinc/91/30/17/1117913017.db2.gz RLAULFAXNCPQEL-PDZIMXBZSA-N 1 3 332.492 2.976 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]1C ZINC001484987894 1117915038 /nfs/dbraw/zinc/91/50/38/1117915038.db2.gz LGHGXSFOFFEGEO-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]1C ZINC001484987894 1117915041 /nfs/dbraw/zinc/91/50/41/1117915041.db2.gz LGHGXSFOFFEGEO-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO CN(CC(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CCCF)CC(C)(C)C ZINC001485043642 1117961749 /nfs/dbraw/zinc/96/17/49/1117961749.db2.gz DTSYUZMRDXWVRS-IEBWSBKVSA-N 1 3 349.494 2.696 10 0 EFAEHO CN(CC(=O)NC1CC(C[NH2+]Cc2cccc(F)c2)C1)CC(C)(C)C ZINC001485102684 1118038793 /nfs/dbraw/zinc/03/87/93/1118038793.db2.gz OFRNPVPUKFVMCI-UHFFFAOYSA-N 1 3 349.494 2.788 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC2CC(C[NH2+]CCCCC(F)(F)F)C2)C1 ZINC001485102516 1118038852 /nfs/dbraw/zinc/03/88/52/1118038852.db2.gz IBJOPWQNUFJANV-WLYUNCDWSA-N 1 3 349.441 2.545 10 0 EFAEHO CN(C)C1(C(=O)NC2CC(C[NH2+]CCCC3CCCC3)C2)CCC1 ZINC001485093963 1118041499 /nfs/dbraw/zinc/04/14/99/1118041499.db2.gz NKBICMBSEACOSF-UHFFFAOYSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC1CC(C[NH2+]CCC(F)(F)F)C1 ZINC001485104930 1118053018 /nfs/dbraw/zinc/05/30/18/1118053018.db2.gz DCVDSWSBFDYRNI-NRXISQOPSA-N 1 3 349.441 2.686 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N(C)CC(C)(C)C[NH2+]Cc1cccnc1 ZINC001485265521 1118184199 /nfs/dbraw/zinc/18/41/99/1118184199.db2.gz CXFFBLBQRGXLAD-CALCHBBNSA-N 1 3 346.519 2.529 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1C[NH+]2CCC1CC2)N(C)Cc1ccc(Cl)cc1 ZINC001485300373 1118218296 /nfs/dbraw/zinc/21/82/96/1118218296.db2.gz DGPGYVYRHJIMTL-KBXCAEBGSA-N 1 3 349.906 2.618 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1 ZINC001485308238 1118220987 /nfs/dbraw/zinc/22/09/87/1118220987.db2.gz DQUWNHNWIPYECL-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(F)cc1 ZINC001485308238 1118220990 /nfs/dbraw/zinc/22/09/90/1118220990.db2.gz DQUWNHNWIPYECL-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)N(C)Cc1ccc(F)cc1 ZINC001485314347 1118226951 /nfs/dbraw/zinc/22/69/51/1118226951.db2.gz UEUKUZHBNKEKJY-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)N(C)Cc1ccc(F)cc1 ZINC001485314347 1118226952 /nfs/dbraw/zinc/22/69/52/1118226952.db2.gz UEUKUZHBNKEKJY-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO COc1cccc(CN(C)[C@@H](C)CNC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001485335379 1118249467 /nfs/dbraw/zinc/24/94/67/1118249467.db2.gz BYUWSRBXNPFTKX-INIZCTEOSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)[NH+]1CCCC1)N(C)Cc1ccc(F)cc1 ZINC001485334992 1118249649 /nfs/dbraw/zinc/24/96/49/1118249649.db2.gz AJFQTDUMQRKINN-OAHLLOKOSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)CN1CCCC1)[NH2+]Cc1ccccc1F ZINC001485441560 1118353886 /nfs/dbraw/zinc/35/38/86/1118353886.db2.gz PKSSBRHIONWKEV-IBGZPJMESA-N 1 3 349.494 2.884 10 0 EFAEHO CCCC[C@H](CNCc1cccnc1)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001485467450 1118376702 /nfs/dbraw/zinc/37/67/02/1118376702.db2.gz CSNRFECMVGXQDX-YTQUADARSA-N 1 3 346.519 2.577 10 0 EFAEHO CCCC[C@H](CNCc1cccnc1)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001485467450 1118376706 /nfs/dbraw/zinc/37/67/06/1118376706.db2.gz CSNRFECMVGXQDX-YTQUADARSA-N 1 3 346.519 2.577 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)C1C[NH+](CC2CCC(C)CC2)C1 ZINC001485508313 1118427074 /nfs/dbraw/zinc/42/70/74/1118427074.db2.gz BUKXXSGRQYDDLI-CGZBRXJRSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)=CCN1CC([C@H](C)NC(=O)[C@]2(F)CC[N@@H+](C(C)(C)C)C2)C1 ZINC001485526332 1118437323 /nfs/dbraw/zinc/43/73/23/1118437323.db2.gz NBAJWFMMHQOZQY-KXBFYZLASA-N 1 3 339.499 2.602 10 0 EFAEHO CC(C)=CCN1CC([C@H](C)NC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)C1 ZINC001485526332 1118437326 /nfs/dbraw/zinc/43/73/26/1118437326.db2.gz NBAJWFMMHQOZQY-KXBFYZLASA-N 1 3 339.499 2.602 10 0 EFAEHO C[C@H](c1ccccc1)N1CC([C@H](C)NC(=O)CCCC[NH+](C)C)C1 ZINC001485533944 1118444644 /nfs/dbraw/zinc/44/46/44/1118444644.db2.gz WYNHZZHZEANFHW-DLBZAZTESA-N 1 3 331.504 2.916 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@H](C)C3)C[C@@]2(C)C1 ZINC001485668750 1118517213 /nfs/dbraw/zinc/51/72/13/1118517213.db2.gz DXRPOROWZGESIQ-GJOJXOHASA-N 1 3 347.547 2.855 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@H](C)C3)C[C@@]2(C)C1 ZINC001485668750 1118517215 /nfs/dbraw/zinc/51/72/15/1118517215.db2.gz DXRPOROWZGESIQ-GJOJXOHASA-N 1 3 347.547 2.855 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@@H](C)C3)C[C@@]2(C)C1 ZINC001485668752 1118517780 /nfs/dbraw/zinc/51/77/80/1118517780.db2.gz DXRPOROWZGESIQ-PCQBFWAFSA-N 1 3 347.547 2.855 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@@H](C)C3)C[C@@]2(C)C1 ZINC001485668752 1118517783 /nfs/dbraw/zinc/51/77/83/1118517783.db2.gz DXRPOROWZGESIQ-PCQBFWAFSA-N 1 3 347.547 2.855 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@]2(C)C[N@H+](CCCCCF)C[C@]2(C)C1 ZINC001485669599 1118518133 /nfs/dbraw/zinc/51/81/33/1118518133.db2.gz GVBJOGNYQXTQLF-KDURUIRLSA-N 1 3 341.515 2.638 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@]2(C)C[N@@H+](CCCCCF)C[C@]2(C)C1 ZINC001485669599 1118518136 /nfs/dbraw/zinc/51/81/36/1118518136.db2.gz GVBJOGNYQXTQLF-KDURUIRLSA-N 1 3 341.515 2.638 10 0 EFAEHO CN(CC(=O)N1C[C@]2(C)C[N@H+](CCC3CC3)C[C@]2(C)C1)CC(C)(C)C ZINC001485669301 1118518155 /nfs/dbraw/zinc/51/81/55/1118518155.db2.gz UAJUYKDCIKSPNA-OYRHEFFESA-N 1 3 349.563 2.935 10 0 EFAEHO CN(CC(=O)N1C[C@]2(C)C[N@@H+](CCC3CC3)C[C@]2(C)C1)CC(C)(C)C ZINC001485669301 1118518159 /nfs/dbraw/zinc/51/81/59/1118518159.db2.gz UAJUYKDCIKSPNA-OYRHEFFESA-N 1 3 349.563 2.935 10 0 EFAEHO CCCCC[N@@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@H](C)C3)C[C@@]2(C)C1 ZINC001485669196 1118518535 /nfs/dbraw/zinc/51/85/35/1118518535.db2.gz QMWVRUHYLNCDOJ-YSIASYRMSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCCC[N@H+]1C[C@@]2(C)CN(C(=O)CN3CC[C@H](C)C3)C[C@@]2(C)C1 ZINC001485669196 1118518537 /nfs/dbraw/zinc/51/85/37/1118518537.db2.gz QMWVRUHYLNCDOJ-YSIASYRMSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@H]([NH2+]C[C@H]1C[C@H](NC(=O)CN(C)C2CCC2)C1)c1ccccc1 ZINC001485686054 1118527453 /nfs/dbraw/zinc/52/74/53/1118527453.db2.gz GKIMNKRIUPLYQY-BQFCYCMXSA-N 1 3 329.488 2.716 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@H]2C[C@H](C[NH2+]CCCc3ccsc3)C2)C1 ZINC001485696556 1118534746 /nfs/dbraw/zinc/53/47/46/1118534746.db2.gz UWKWEMNDIYSLMV-KBAYOESNSA-N 1 3 349.544 2.507 10 0 EFAEHO COc1cc(C[NH2+]C2CCC([NH3+])CC2)cc(Br)c1[O-] ZINC000051693005 214100414 /nfs/dbraw/zinc/10/04/14/214100414.db2.gz OQYAPGPXTYEEEB-UHFFFAOYSA-N 1 3 329.238 2.523 10 0 EFAEHO CCCN1CCN(CC[NH2+]Cc2cc(Br)cs2)CC1 ZINC000053344753 214178051 /nfs/dbraw/zinc/17/80/51/214178051.db2.gz VBQOYIJIIMKZLS-UHFFFAOYSA-N 1 3 346.338 2.628 10 0 EFAEHO COCC[N@H+](CC[C@H](N)c1ccccc1Br)C1CC1 ZINC000054020528 214211241 /nfs/dbraw/zinc/21/12/41/214211241.db2.gz VOYKEUFCRGGJBT-HNNXBMFYSA-N 1 3 327.266 2.950 10 0 EFAEHO COCC[N@@H+](CC[C@H](N)c1ccccc1Br)C1CC1 ZINC000054020528 214211244 /nfs/dbraw/zinc/21/12/44/214211244.db2.gz VOYKEUFCRGGJBT-HNNXBMFYSA-N 1 3 327.266 2.950 10 0 EFAEHO CN(C)[C@@H](CC(=O)N1CCC[C@@H]1C[NH+]1CCCC1)c1ccccc1 ZINC000416142071 282168627 /nfs/dbraw/zinc/16/86/27/282168627.db2.gz FNCZUFZMLFGMCY-MOPGFXCFSA-N 1 3 329.488 2.766 10 0 EFAEHO CN(C)[C@@H](CNC(=O)NCC[N@H+](C)C1CCCCC1)c1ccccc1 ZINC000338313047 282175514 /nfs/dbraw/zinc/17/55/14/282175514.db2.gz HDSHVCSTMGUVOY-IBGZPJMESA-N 1 3 346.519 2.853 10 0 EFAEHO CN(C)[C@@H](CNC(=O)NCC[N@@H+](C)C1CCCCC1)c1ccccc1 ZINC000338313047 282175515 /nfs/dbraw/zinc/17/55/15/282175515.db2.gz HDSHVCSTMGUVOY-IBGZPJMESA-N 1 3 346.519 2.853 10 0 EFAEHO CN(Cc1cccc(C[N@H+](C)C[C@@H]2CCCO2)c1)C[C@@H]1CCCO1 ZINC000103480561 219304907 /nfs/dbraw/zinc/30/49/07/219304907.db2.gz QFHSAGVTHDBCIW-PMACEKPBSA-N 1 3 332.488 2.908 10 0 EFAEHO CN(Cc1cccc(C[N@@H+](C)C[C@@H]2CCCO2)c1)C[C@@H]1CCCO1 ZINC000103480561 219304909 /nfs/dbraw/zinc/30/49/09/219304909.db2.gz QFHSAGVTHDBCIW-PMACEKPBSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@@H](O)C[NH+]1CCC(CNCc2nc(-c3ccccc3)cs2)CC1 ZINC000069347387 215380593 /nfs/dbraw/zinc/38/05/93/215380593.db2.gz AUAKLTSRXAPIQS-OAHLLOKOSA-N 1 3 345.512 2.993 10 0 EFAEHO C[C@H](O)C[NH+]1CCC(CNCc2cnc(C(C)(C)C)s2)CC1 ZINC000069347381 215381175 /nfs/dbraw/zinc/38/11/75/215381175.db2.gz QCTFQVLPZZYHJR-ZDUSSCGKSA-N 1 3 325.522 2.623 10 0 EFAEHO C[C@H](O)C[NH+]1CCC(CNCc2ccccc2Br)CC1 ZINC000069349798 215383908 /nfs/dbraw/zinc/38/39/08/215383908.db2.gz SGHDBTWJWYGLGF-ZDUSSCGKSA-N 1 3 341.293 2.632 10 0 EFAEHO C[C@@H](CNC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)N(C)C1CC1 ZINC000105091415 219455980 /nfs/dbraw/zinc/45/59/80/219455980.db2.gz DURXXLZJLLJEGJ-INIZCTEOSA-N 1 3 344.503 2.564 10 0 EFAEHO c1ccc(CN2CC[C@H](Nc3cc([C@@H]4CCC[NH2+]C4)ncn3)C2)cc1 ZINC000039420474 213235524 /nfs/dbraw/zinc/23/55/24/213235524.db2.gz CURDRLRSJUJNIG-MSOLQXFVSA-N 1 3 337.471 2.630 10 0 EFAEHO CCCN(CCC[NH+](C)C)C(=O)NCCN1[C@@H](C)CCC[C@@H]1C ZINC000344403136 283219466 /nfs/dbraw/zinc/21/94/66/283219466.db2.gz WFXWNJLCLJJRRO-IRXDYDNUSA-N 1 3 326.529 2.623 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)NC1CC([NH+]2CCCCC2)C1 ZINC000376961273 283237612 /nfs/dbraw/zinc/23/76/12/283237612.db2.gz BHYZSYFMGBEFGM-UHFFFAOYSA-N 1 3 336.524 2.521 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000356384675 283332741 /nfs/dbraw/zinc/33/27/41/283332741.db2.gz CRLJZCZZJXZSKV-CEXWTWQISA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000356384675 283332746 /nfs/dbraw/zinc/33/27/46/283332746.db2.gz CRLJZCZZJXZSKV-CEXWTWQISA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN1CCN(c2ccccc2CN(C)CC[N@H+](C)C2CC2)CC1 ZINC000349353662 283349397 /nfs/dbraw/zinc/34/93/97/283349397.db2.gz SCOQTIHOCYXQPH-UHFFFAOYSA-N 1 3 344.547 2.745 10 0 EFAEHO CCCN1CCN(c2ccccc2CN(C)CC[N@@H+](C)C2CC2)CC1 ZINC000349353662 283349398 /nfs/dbraw/zinc/34/93/98/283349398.db2.gz SCOQTIHOCYXQPH-UHFFFAOYSA-N 1 3 344.547 2.745 10 0 EFAEHO C[C@H]([NH3+])Cc1cc(Br)ccc1OCCN1CCCC1 ZINC000037725258 213163145 /nfs/dbraw/zinc/16/31/45/213163145.db2.gz NNPPIADDYHAFEN-LBPRGKRZSA-N 1 3 327.266 2.813 10 0 EFAEHO CCC[C@](C)([NH3+])C(=O)N[C@H]1CC2(CCN(C)CC2)Oc2ccccc21 ZINC000262172536 284006108 /nfs/dbraw/zinc/00/61/08/284006108.db2.gz XQOFXHDJUMVGQB-LPHOPBHVSA-N 1 3 345.487 2.608 10 0 EFAEHO C[C@@H](CCC1CCCC1)[NH2+]CC1(N2CCOCC2)CCN(C)CC1 ZINC000414185111 244034981 /nfs/dbraw/zinc/03/49/81/244034981.db2.gz GIZWTPUBTJIPLF-SFHVURJKSA-N 1 3 337.552 2.732 10 0 EFAEHO C[C@H]([NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1)[C@H]1CC1(C)C ZINC000414334043 244093271 /nfs/dbraw/zinc/09/32/71/244093271.db2.gz FXWRKLKOSDLKAF-HNAYVOBHSA-N 1 3 343.515 2.908 10 0 EFAEHO CCCc1ccc([C@H](C)N(CC(N)=O)C[C@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000414737839 244316038 /nfs/dbraw/zinc/31/60/38/244316038.db2.gz DPTKKKPSDLFSMA-BQFCYCMXSA-N 1 3 331.504 2.876 10 0 EFAEHO COC(=O)COc1ccc(CNCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000414812729 244363434 /nfs/dbraw/zinc/36/34/34/244363434.db2.gz ROXZLNSUJAHRDS-CQSZACIVSA-N 1 3 328.412 2.548 10 0 EFAEHO Cn1cc(-c2ccc(CNCCC[NH2+]Cc3cccnc3)s2)cn1 ZINC000414858484 244374312 /nfs/dbraw/zinc/37/43/12/244374312.db2.gz JQESRHNWILSRLB-UHFFFAOYSA-N 1 3 341.484 2.813 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCN(C(=O)NC[C@H]2CCC[NH2+]C2)CC1 ZINC000418325101 245121749 /nfs/dbraw/zinc/12/17/49/245121749.db2.gz WNIDEGWJBFHKCQ-INIZCTEOSA-N 1 3 338.540 2.528 10 0 EFAEHO CC(C)[NH2+]C1CCN(C(=O)NC[C@H](N)c2ccc(C(C)C)cc2)CC1 ZINC000418340198 245128216 /nfs/dbraw/zinc/12/82/16/245128216.db2.gz CDRHDSBRBLJKBS-IBGZPJMESA-N 1 3 346.519 2.982 10 0 EFAEHO CCN(C(=O)NC[C@H](C)C[NH2+]C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418369010 245138907 /nfs/dbraw/zinc/13/89/07/245138907.db2.gz STNYVWAMNUEZOZ-AOIWGVFYSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@H]1C[NH2+]CC[C@H]1NC(=O)N1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000418602049 245209263 /nfs/dbraw/zinc/20/92/63/245209263.db2.gz UZZHVRHWIPNSRI-JKSUJKDBSA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@@H]1C[NH2+]CC[C@H]1NC(=O)N1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000418602047 245209608 /nfs/dbraw/zinc/20/96/08/245209608.db2.gz UZZHVRHWIPNSRI-HZPDHXFCSA-N 1 3 338.540 2.526 10 0 EFAEHO CC[NH2+][C@H](C)CNC(=O)N(CC)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418607384 245211219 /nfs/dbraw/zinc/21/12/19/245211219.db2.gz QWMTXWKJIOBSEU-LMMKCTJWSA-N 1 3 346.519 2.851 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCN(C(=O)N[C@H]2CC[C@@H](C[NH3+])C2)CC1 ZINC000418789982 245293381 /nfs/dbraw/zinc/29/33/81/245293381.db2.gz MKFDCRIEQGOUIK-CVEARBPZSA-N 1 3 338.540 2.656 10 0 EFAEHO C[C@@H]1CN(Cc2cccc(C[NH+]3CCCCC3)c2)[C@H](C)CN1CCO ZINC000419325414 245379262 /nfs/dbraw/zinc/37/92/62/245379262.db2.gz BEYIGNJJRTVAOQ-RTBURBONSA-N 1 3 345.531 2.559 10 0 EFAEHO CCN1CCN(Cc2ccc(C[NH2+][C@@H]3CC[C@H]3SC)cc2)CC1 ZINC000425358557 247057780 /nfs/dbraw/zinc/05/77/80/247057780.db2.gz OTPFRNOSGMIZJZ-RTBURBONSA-N 1 3 333.545 2.808 10 0 EFAEHO Cc1nc2ccc(C[NH2+]CCN3CCN(C)C(C)(C)C3)cc2s1 ZINC000441374310 250027269 /nfs/dbraw/zinc/02/72/69/250027269.db2.gz VNBANWOCHBYRET-UHFFFAOYSA-N 1 3 332.517 2.720 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)Cc2ccc(-n3cncn3)c(C)c2)[C@H](C)C1 ZINC000093638700 218235902 /nfs/dbraw/zinc/23/59/02/218235902.db2.gz UWYFLEHXVYESBT-AEFFLSMTSA-N 1 3 327.476 2.738 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)Cc2ccc(-n3cncn3)c(C)c2)[C@H](C)C1 ZINC000093638700 218235903 /nfs/dbraw/zinc/23/59/03/218235903.db2.gz UWYFLEHXVYESBT-AEFFLSMTSA-N 1 3 327.476 2.738 10 0 EFAEHO CN(C[C@H](O)Cc1ccccc1C(F)(F)F)C[C@@H]1CCC[N@H+](C)C1 ZINC000443604805 250211344 /nfs/dbraw/zinc/21/13/44/250211344.db2.gz LYBOPKKGIWSSBM-GDBMZVCRSA-N 1 3 344.421 2.882 10 0 EFAEHO CN(C[C@H](O)Cc1ccccc1C(F)(F)F)C[C@@H]1CCC[N@@H+](C)C1 ZINC000443604805 250211347 /nfs/dbraw/zinc/21/13/47/250211347.db2.gz LYBOPKKGIWSSBM-GDBMZVCRSA-N 1 3 344.421 2.882 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)[C@H]1CC[NH2+][C@@H](C)C1)c1cccc(OC)c1 ZINC000262409754 284772414 /nfs/dbraw/zinc/77/24/14/284772414.db2.gz PCSXQZKPAVHRQW-IEZWGBDMSA-N 1 3 347.503 2.582 10 0 EFAEHO CC(=O)NC1CCC([NH2+][C@@H](C)c2cccc(OCCN(C)C)c2)CC1 ZINC000268832314 252282301 /nfs/dbraw/zinc/28/23/01/252282301.db2.gz KLRPFYLJPNZMRM-MNNVXMFVSA-N 1 3 347.503 2.725 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)NCCCCC[NH+]1CCCC1 ZINC000454492290 252282687 /nfs/dbraw/zinc/28/26/87/252282687.db2.gz YBIYYGUFOYJBMA-ROUUACIJSA-N 1 3 338.540 2.815 10 0 EFAEHO CC(C)C[C@@H](C[NH+]1CCCC1)NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000458934355 255796900 /nfs/dbraw/zinc/79/69/00/255796900.db2.gz JZNVUVRJIIDCRD-OKZBNKHCSA-N 1 3 338.540 2.621 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)Cc1cc(OC)ccc1F ZINC000353502478 285250486 /nfs/dbraw/zinc/25/04/86/285250486.db2.gz LNUHHIDFIKGEIP-QGZVFWFLSA-N 1 3 337.483 2.682 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)Cc1cc(OC)ccc1F ZINC000353502478 285250487 /nfs/dbraw/zinc/25/04/87/285250487.db2.gz LNUHHIDFIKGEIP-QGZVFWFLSA-N 1 3 337.483 2.682 10 0 EFAEHO C[C@H]1CN(C)C[C@H]1[NH2+]CCCOC1CCN(Cc2ccccc2)CC1 ZINC000344728815 142068393 /nfs/dbraw/zinc/06/83/93/142068393.db2.gz WZJZOYUJFVXRMN-GHTZIAJQSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@H](N[C@H](CO)C[C@@H](O)C(C)(C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000342813103 145198999 /nfs/dbraw/zinc/19/89/99/145198999.db2.gz GAMKBBFRBBEZJR-FRYIKTPZSA-N 1 3 348.531 2.645 10 0 EFAEHO C[C@H](N[C@H](CO)C[C@@H](O)C(C)(C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000342813103 145199002 /nfs/dbraw/zinc/19/90/02/145199002.db2.gz GAMKBBFRBBEZJR-FRYIKTPZSA-N 1 3 348.531 2.645 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)NCCN1CCCC[C@@H]1C ZINC000342964387 145231445 /nfs/dbraw/zinc/23/14/45/145231445.db2.gz FNSGXZKCWBRMJF-ZWKOTPCHSA-N 1 3 338.540 2.815 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)NCCN1CCCC[C@@H]1C ZINC000342964387 145231449 /nfs/dbraw/zinc/23/14/49/145231449.db2.gz FNSGXZKCWBRMJF-ZWKOTPCHSA-N 1 3 338.540 2.815 10 0 EFAEHO COc1cccc(OC)c1OCCCC[NH+]1CCC(N(C)C)CC1 ZINC000343976071 145336901 /nfs/dbraw/zinc/33/69/01/145336901.db2.gz SPYORASOBGPBMZ-UHFFFAOYSA-N 1 3 336.476 2.889 10 0 EFAEHO C[C@@]1(NCC(=O)NC2CC[NH+](C3CC3)CC2)CCCc2ccccc21 ZINC000351724537 146188209 /nfs/dbraw/zinc/18/82/09/146188209.db2.gz YUDKBUFVABQWPK-OAQYLSRUSA-N 1 3 341.499 2.571 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000352995492 146369929 /nfs/dbraw/zinc/36/99/29/146369929.db2.gz BTQPZZCVAKUOMY-FVGDGBDSSA-N 1 3 336.524 2.516 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000352995492 146369931 /nfs/dbraw/zinc/36/99/31/146369931.db2.gz BTQPZZCVAKUOMY-FVGDGBDSSA-N 1 3 336.524 2.516 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000355581812 147003084 /nfs/dbraw/zinc/00/30/84/147003084.db2.gz KVWFADINUWOBIV-ZIFCJYIRSA-N 1 3 329.488 2.592 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000355581812 147003086 /nfs/dbraw/zinc/00/30/86/147003086.db2.gz KVWFADINUWOBIV-ZIFCJYIRSA-N 1 3 329.488 2.592 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000355604847 147010121 /nfs/dbraw/zinc/01/01/21/147010121.db2.gz UHNZSRWNZNJEFA-RYRKJORJSA-N 1 3 334.508 2.707 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000359144787 148007673 /nfs/dbraw/zinc/00/76/73/148007673.db2.gz TYYIVKYEYHJWLJ-MJGOQNOKSA-N 1 3 346.519 2.681 10 0 EFAEHO CCN(C(=O)C[NH2+]CC1CC1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000368454965 150121265 /nfs/dbraw/zinc/12/12/65/150121265.db2.gz WYCIZQIBQQBFBA-QFBILLFUSA-N 1 3 329.488 2.670 10 0 EFAEHO CC(C)NC(=O)CCN1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000374070774 151278707 /nfs/dbraw/zinc/27/87/07/151278707.db2.gz VDAQXERVNUDZRY-NRFANRHFSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)NC(=O)CCN1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000374070774 151278709 /nfs/dbraw/zinc/27/87/09/151278709.db2.gz VDAQXERVNUDZRY-NRFANRHFSA-N 1 3 343.515 2.889 10 0 EFAEHO COc1ccc([C@@H](NCCN2CCCCCC2)[C@H]2CCC[NH2+]2)cc1 ZINC000422804950 286359233 /nfs/dbraw/zinc/35/92/33/286359233.db2.gz INBRLWFJOLUNCG-WOJBJXKFSA-N 1 3 331.504 2.954 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]C[C@H]2CCCN(CC(C)C)C2)C12CCOCC2 ZINC000248994538 286390789 /nfs/dbraw/zinc/39/07/89/286390789.db2.gz LTEHKLOXUJKWBU-CEXWTWQISA-N 1 3 338.536 2.918 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)NCCN(C)Cc1ccccc1 ZINC000341102093 287390496 /nfs/dbraw/zinc/39/04/96/287390496.db2.gz QBKUXCRJINAQMK-QZTJIDSGSA-N 1 3 346.519 2.681 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@H](O)COCc2ccc(Cl)cc2)CC[N@@H+]1C ZINC000123611224 222305467 /nfs/dbraw/zinc/30/54/67/222305467.db2.gz LVOVZJWJNHVRLS-OLMNPRSZSA-N 1 3 340.895 2.632 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@H](O)COCc2ccc(Cl)cc2)CC[N@H+]1C ZINC000123611224 222305472 /nfs/dbraw/zinc/30/54/72/222305472.db2.gz LVOVZJWJNHVRLS-OLMNPRSZSA-N 1 3 340.895 2.632 10 0 EFAEHO C[N@@H+]1CCCN(CCCNCc2ncc(-c3ccccc3)s2)CC1 ZINC000092389654 544544889 /nfs/dbraw/zinc/54/48/89/544544889.db2.gz UUJUGUSIUIUVHO-UHFFFAOYSA-N 1 3 344.528 2.927 10 0 EFAEHO C[N@H+]1CCCN(CCCNCc2ncc(-c3ccccc3)s2)CC1 ZINC000092389654 544544895 /nfs/dbraw/zinc/54/48/95/544544895.db2.gz UUJUGUSIUIUVHO-UHFFFAOYSA-N 1 3 344.528 2.927 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]C2CCN(C3CCCC3)CC2)C12CCOCC2 ZINC000186374487 265064262 /nfs/dbraw/zinc/06/42/62/265064262.db2.gz YQBMPMKRXZZIDT-RBUKOAKNSA-N 1 3 336.520 2.957 10 0 EFAEHO CCO[C@@H]1C[C@H](NC2CC[NH+](C3CCCC3)CC2)C12CCOCC2 ZINC000186374487 265064264 /nfs/dbraw/zinc/06/42/64/265064264.db2.gz YQBMPMKRXZZIDT-RBUKOAKNSA-N 1 3 336.520 2.957 10 0 EFAEHO C[NH2+]C(C)(C)CNC(=O)Nc1ccc(OCCN2CCCCC2)cc1 ZINC000271970446 266110748 /nfs/dbraw/zinc/11/07/48/266110748.db2.gz CELIUSUSNNFSTK-UHFFFAOYSA-N 1 3 348.491 2.671 10 0 EFAEHO COC1(C[C@@H](C)[NH2+]Cc2ccccc2CN2CC[C@@H](O)C2)CCC1 ZINC000277240523 267135812 /nfs/dbraw/zinc/13/58/12/267135812.db2.gz ZSZISDSCSMJCBF-VQIMIIECSA-N 1 3 332.488 2.691 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+]Cc2ccnn2-c2ccccc2)C[C@@H](C)O1 ZINC000279169768 273184300 /nfs/dbraw/zinc/18/43/00/273184300.db2.gz QPXLBSBGWFZIFD-QZTJIDSGSA-N 1 3 342.487 2.851 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)CC[N@@H+]1C ZINC000279517084 273223767 /nfs/dbraw/zinc/22/37/67/273223767.db2.gz UVBXPHLGQUTMFS-HBFSDRIKSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)CC[N@H+]1C ZINC000279517084 273223769 /nfs/dbraw/zinc/22/37/69/273223769.db2.gz UVBXPHLGQUTMFS-HBFSDRIKSA-N 1 3 343.515 2.840 10 0 EFAEHO Cc1ccncc1CNCc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000280021230 273281800 /nfs/dbraw/zinc/28/18/00/273281800.db2.gz UABQLBGLBJWWKE-UHFFFAOYSA-N 1 3 325.456 2.637 10 0 EFAEHO C(=C\C[N@@H+]1CCC[C@@H]2COCC[C@@H]21)\CN1CCC[C@@H]2COCC[C@@H]21 ZINC000340195671 275389090 /nfs/dbraw/zinc/38/90/90/275389090.db2.gz CAKBODPLQYRFIH-ZXWXGPFHSA-N 1 3 334.504 2.544 10 0 EFAEHO C(=C\C[N@H+]1CCC[C@@H]2COCC[C@@H]21)\CN1CCC[C@@H]2COCC[C@@H]21 ZINC000340195671 275389091 /nfs/dbraw/zinc/38/90/91/275389091.db2.gz CAKBODPLQYRFIH-ZXWXGPFHSA-N 1 3 334.504 2.544 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000245903694 276152760 /nfs/dbraw/zinc/15/27/60/276152760.db2.gz LRYWWVGGRIEBEZ-RBUKOAKNSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@H]2C[C@@H](C)O)CC1 ZINC000093482626 276262918 /nfs/dbraw/zinc/26/29/18/276262918.db2.gz XZAAIMSXEGYBPT-QUCCMNQESA-N 1 3 345.531 2.954 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@H]2C[C@@H](C)O)CC1 ZINC000093482626 276262919 /nfs/dbraw/zinc/26/29/19/276262919.db2.gz XZAAIMSXEGYBPT-QUCCMNQESA-N 1 3 345.531 2.954 10 0 EFAEHO CCN(C(=O)N[C@H]1CCC[NH2+]C1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418491949 276299821 /nfs/dbraw/zinc/29/98/21/276299821.db2.gz TXZRAELCTZQWIZ-WDSOQIARSA-N 1 3 344.503 2.605 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000355592958 276339372 /nfs/dbraw/zinc/33/93/72/276339372.db2.gz BQGCQZBWKLNXPW-AOIWGVFYSA-N 1 3 346.519 2.679 10 0 EFAEHO C[NH+](C)CCOCCN[C@H]1CCCc2ncc(C(F)(F)F)cc21 ZINC000447603837 276792231 /nfs/dbraw/zinc/79/22/31/276792231.db2.gz XZGZPBCATBTCQI-AWEZNQCLSA-N 1 3 331.382 2.646 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cc3ccccc3n(C)c2=O)[C@@H]2CCC[C@H]21 ZINC000426287195 277172400 /nfs/dbraw/zinc/17/24/00/277172400.db2.gz WSDKVAWKDAJSJR-JENIJYKNSA-N 1 3 325.456 2.501 10 0 EFAEHO COc1cc(C)c(C[NH2+]CCCCN2C[C@H](C)O[C@@H](C)C2)c(C)n1 ZINC000358969051 277372541 /nfs/dbraw/zinc/37/25/41/277372541.db2.gz BBPUCIXUJPFAFC-HOTGVXAUSA-N 1 3 335.492 2.686 10 0 EFAEHO COc1cc2nccc(N3CCC[C@H]4C[N@H+](C)C[C@H]43)c2cc1OC ZINC000425281371 277396247 /nfs/dbraw/zinc/39/62/47/277396247.db2.gz JAHFENURHHJSAU-SUMWQHHRSA-N 1 3 327.428 2.782 10 0 EFAEHO COc1cc2nccc(N3CCC[C@H]4C[N@@H+](C)C[C@H]43)c2cc1OC ZINC000425281371 277396249 /nfs/dbraw/zinc/39/62/49/277396249.db2.gz JAHFENURHHJSAU-SUMWQHHRSA-N 1 3 327.428 2.782 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000341351832 277704496 /nfs/dbraw/zinc/70/44/96/277704496.db2.gz CMENELSPIOTOPK-ZHALLVOQSA-N 1 3 346.519 2.851 10 0 EFAEHO CC1(C)COC[C@@H]1NCc1ccccc1C[NH2+][C@H]1COCC1(C)C ZINC000451812774 278355634 /nfs/dbraw/zinc/35/56/34/278355634.db2.gz PPMYPPXHEWPFGO-ROUUACIJSA-N 1 3 332.488 2.716 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H](OC)C2CC2)CC1 ZINC000339528012 278825717 /nfs/dbraw/zinc/82/57/17/278825717.db2.gz LWECIKOQXDTXHZ-HXUWFJFHSA-N 1 3 331.504 2.733 10 0 EFAEHO CCN1CCCC[C@@H]1CN[C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422903953 279275243 /nfs/dbraw/zinc/27/52/43/279275243.db2.gz GDAGLKMCFAOVOJ-YVWKXTFCSA-N 1 3 329.488 2.706 10 0 EFAEHO c1ccc([C@H]2CC[C@H](CN[C@@H]3CCOC[C@@H]3[C@H]3CCC[NH2+]3)O2)cc1 ZINC000423127413 280486005 /nfs/dbraw/zinc/48/60/05/280486005.db2.gz SZERQGNEPROSLS-LASHMREHSA-N 1 3 330.472 2.653 10 0 EFAEHO CC[C@H]1[C@@H](CO)CC[N@@H+]1Cc1ccccc1N(C)C1CCN(C)CC1 ZINC000449427080 281271950 /nfs/dbraw/zinc/27/19/50/281271950.db2.gz RUNZITDGWPXEAX-QUCCMNQESA-N 1 3 345.531 2.810 10 0 EFAEHO CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1ccccc1N(C)C1CCN(C)CC1 ZINC000449427080 281271956 /nfs/dbraw/zinc/27/19/56/281271956.db2.gz RUNZITDGWPXEAX-QUCCMNQESA-N 1 3 345.531 2.810 10 0 EFAEHO CC1CCN([C@H](CNC(=O)[C@H]2CC[C@@H]([NH3+])C2)c2ccccc2)CC1 ZINC000246498804 281837525 /nfs/dbraw/zinc/83/75/25/281837525.db2.gz PSUBIAHOBXGUIY-IPMKNSEASA-N 1 3 329.488 2.703 10 0 EFAEHO C[C@@H]1[C@H]([NH+]2CCCC2)CCN1C(=O)NCCN1[C@@H](C)CCC[C@@H]1C ZINC000352997129 289041892 /nfs/dbraw/zinc/04/18/92/289041892.db2.gz KLWBGTIMPBXUER-WNRNVDISSA-N 1 3 336.524 2.518 10 0 EFAEHO CN1CC[C@H](NC(=O)NC(C)(C)CCC[NH+](C)C)[C@@H]1c1ccccc1 ZINC000458575414 289108964 /nfs/dbraw/zinc/10/89/64/289108964.db2.gz IUKQAMNSIDDCOT-ROUUACIJSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@@]1(CNC(=O)N[C@@H]2CCCC[C@H]2[NH3+])CCCN1Cc1ccccc1 ZINC000424458528 289169802 /nfs/dbraw/zinc/16/98/02/289169802.db2.gz CLKCMZDEGPARPF-GGPKGHCWSA-N 1 3 344.503 2.610 10 0 EFAEHO CN1CCC(C[NH2+][C@H]2CCOC3(CCC3)C2)(N2CCCCC2)CC1 ZINC000449166739 289879967 /nfs/dbraw/zinc/87/99/67/289879967.db2.gz FXVXTGSWKPGSPO-SFHVURJKSA-N 1 3 335.536 2.628 10 0 EFAEHO C[C@H]([NH2+][C@@H]1CCN2CCC[C@H]2C1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000373292419 290019596 /nfs/dbraw/zinc/01/95/96/290019596.db2.gz JFOAGEMSYDNPLZ-NXOAAHMSSA-N 1 3 337.508 2.848 10 0 EFAEHO C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000373292419 290019597 /nfs/dbraw/zinc/01/95/97/290019597.db2.gz JFOAGEMSYDNPLZ-NXOAAHMSSA-N 1 3 337.508 2.848 10 0 EFAEHO C[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000373292419 290019599 /nfs/dbraw/zinc/01/95/99/290019599.db2.gz JFOAGEMSYDNPLZ-NXOAAHMSSA-N 1 3 337.508 2.848 10 0 EFAEHO CN1CCN(C[C@@H]2CCC[C@@H]3C[N@H+](CCC(F)(F)F)C[C@@H]32)CC1 ZINC000096090770 290045507 /nfs/dbraw/zinc/04/55/07/290045507.db2.gz FTFRFDJKOKZYAL-ARFHVFGLSA-N 1 3 333.442 2.534 10 0 EFAEHO CN1CCN(C[C@@H]2CCC[C@@H]3C[N@@H+](CCC(F)(F)F)C[C@@H]32)CC1 ZINC000096090770 290045508 /nfs/dbraw/zinc/04/55/08/290045508.db2.gz FTFRFDJKOKZYAL-ARFHVFGLSA-N 1 3 333.442 2.534 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)[C@@H]2CCC[C@H]21 ZINC000353611514 290221163 /nfs/dbraw/zinc/22/11/63/290221163.db2.gz YSOUJNUZDTZODQ-YHDCXSKOSA-N 1 3 332.463 2.754 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)[C@@H]2CCC[C@H]21 ZINC000353611514 290221165 /nfs/dbraw/zinc/22/11/65/290221165.db2.gz YSOUJNUZDTZODQ-YHDCXSKOSA-N 1 3 332.463 2.754 10 0 EFAEHO C[C@H](NC(=O)N[C@H](CN(C)C)c1ccccc1)C(C)(C)C[NH+](C)C ZINC000120162902 292921021 /nfs/dbraw/zinc/92/10/21/292921021.db2.gz ITHFLMHCQYGLMU-DOTOQJQBSA-N 1 3 334.508 2.565 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000127060495 293057426 /nfs/dbraw/zinc/05/74/26/293057426.db2.gz AMYUXLJLPOEGCV-ROUUACIJSA-N 1 3 338.540 2.815 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)NCCCC[N@H+]1CCCC[C@@H]1C ZINC000127060495 293057429 /nfs/dbraw/zinc/05/74/29/293057429.db2.gz AMYUXLJLPOEGCV-ROUUACIJSA-N 1 3 338.540 2.815 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@@H](C)c1ccc(Br)cc1OC ZINC000423074509 293097117 /nfs/dbraw/zinc/09/71/17/293097117.db2.gz UXQDQCBHVUNKFP-AAEUAGOBSA-N 1 3 345.281 2.862 10 0 EFAEHO C[C@H](CNC(=O)N[C@H](CN(C)C)c1ccccc1)[NH+]1CCC(C)CC1 ZINC000128974863 293120879 /nfs/dbraw/zinc/12/08/79/293120879.db2.gz XZRIESNESOSMGQ-IEBWSBKVSA-N 1 3 346.519 2.709 10 0 EFAEHO CCCN1CC[C@H](C[NH2+]C[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000130026457 293151301 /nfs/dbraw/zinc/15/13/01/293151301.db2.gz YQTLAYHZGHFZBZ-DLBZAZTESA-N 1 3 339.524 2.955 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@H](C)N1CCc2ccccc2C1 ZINC000422710236 293260896 /nfs/dbraw/zinc/26/08/96/293260896.db2.gz FJTDLBPOOKPKAT-JKSUJKDBSA-N 1 3 338.499 2.946 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H](O)[C@@H](C)CC)CC1 ZINC000152118401 293318296 /nfs/dbraw/zinc/31/82/96/293318296.db2.gz OGZMOXFECABOSU-FXAWDEMLSA-N 1 3 333.520 2.715 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H](CC)CCO)CC1 ZINC000152635302 293343115 /nfs/dbraw/zinc/34/31/15/293343115.db2.gz BHZOCYNTMOASKP-SFHVURJKSA-N 1 3 333.520 2.717 10 0 EFAEHO COc1ccc(C)cc1C1(C[NH2+][C@@H]2CCC[C@H]2CN)CCOCC1 ZINC000422897685 295104602 /nfs/dbraw/zinc/10/46/02/295104602.db2.gz KDCVUTXEUSAGIX-FUHWJXTLSA-N 1 3 332.488 2.769 10 0 EFAEHO CSc1ccc([C@H](CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)N(C)C)cc1 ZINC000294325936 295147683 /nfs/dbraw/zinc/14/76/83/295147683.db2.gz IZVXDODWKVQRGD-ZVZYQTTQSA-N 1 3 349.544 2.858 10 0 EFAEHO CSc1ccc([C@H](CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)N(C)C)cc1 ZINC000294325936 295147687 /nfs/dbraw/zinc/14/76/87/295147687.db2.gz IZVXDODWKVQRGD-ZVZYQTTQSA-N 1 3 349.544 2.858 10 0 EFAEHO COc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)cc1NC(C)=O ZINC000295074476 295264912 /nfs/dbraw/zinc/26/49/12/295264912.db2.gz RIHKQSVHINNOAC-RJCAOGMDSA-N 1 3 331.460 2.929 10 0 EFAEHO COc1cc(OC)c(C[C@H](C)N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)c(OC)c1 ZINC000295080295 295265732 /nfs/dbraw/zinc/26/57/32/295265732.db2.gz RYIDPVBSBTXTEU-XHSDSOJGSA-N 1 3 348.487 2.860 10 0 EFAEHO COc1cc(OC)c(C[C@H](C)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c(OC)c1 ZINC000295080295 295265734 /nfs/dbraw/zinc/26/57/34/295265734.db2.gz RYIDPVBSBTXTEU-XHSDSOJGSA-N 1 3 348.487 2.860 10 0 EFAEHO COC(=O)C1(CN2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)CC1 ZINC000295337711 295302954 /nfs/dbraw/zinc/30/29/54/295302954.db2.gz PNLQRBWXRSZTRU-LJQANCHMSA-N 1 3 328.456 2.538 10 0 EFAEHO COC(=O)C1(CN2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)CC1 ZINC000295337711 295302955 /nfs/dbraw/zinc/30/29/55/295302955.db2.gz PNLQRBWXRSZTRU-LJQANCHMSA-N 1 3 328.456 2.538 10 0 EFAEHO C[C@@H]1C[C@@H]([NH+]2CCCC2)CN1C(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000344785939 297261345 /nfs/dbraw/zinc/26/13/45/297261345.db2.gz BZCKBRFTXXTFRW-XMTFNYHQSA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](CCCNC(=O)NCCN2CCCC[C@H]2C)C1 ZINC000337361956 297358165 /nfs/dbraw/zinc/35/81/65/297358165.db2.gz IQRDFZDHEBBGLZ-FGTMMUONSA-N 1 3 338.540 2.528 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NCCN2CCCC[C@H]2C)C1 ZINC000337361956 297358166 /nfs/dbraw/zinc/35/81/66/297358166.db2.gz IQRDFZDHEBBGLZ-FGTMMUONSA-N 1 3 338.540 2.528 10 0 EFAEHO Cc1cncc([C@@H](C)[NH2+]CC2(N3CCCCC3)CCN(C)CC2)c1 ZINC000184369994 302382331 /nfs/dbraw/zinc/38/23/31/302382331.db2.gz PDIVLWJMSDOQFS-GOSISDBHSA-N 1 3 330.520 2.991 10 0 EFAEHO O=C(NCc1ccccc1CN1CCCCC1)[C@H]1CC12CC[NH2+]CC2 ZINC000238029859 303812299 /nfs/dbraw/zinc/81/22/99/303812299.db2.gz MNKCCZMEOKMDAI-LJQANCHMSA-N 1 3 341.499 2.678 10 0 EFAEHO CN(C)C[C@H](Cc1ccccc1)[NH2+]C1CCN(c2ccncc2)CC1 ZINC000298610852 311007876 /nfs/dbraw/zinc/00/78/76/311007876.db2.gz ZYEXYGCPLAKCDX-FQEVSTJZSA-N 1 3 338.499 2.813 10 0 EFAEHO CON1CCC([NH2+][C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)CC1 ZINC000323410640 311240250 /nfs/dbraw/zinc/24/02/50/311240250.db2.gz WDQDISGHKQNPPP-DFQSSKMNSA-N 1 3 329.488 2.512 10 0 EFAEHO Cc1cccc(C)c1OC[C@@H](O)CNC1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000324877815 311242335 /nfs/dbraw/zinc/24/23/35/311242335.db2.gz JSLFDZHDLDZQOD-IPQPSQTFSA-N 1 3 332.488 2.648 10 0 EFAEHO Cc1cccc(C)c1OC[C@@H](O)CNC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000324877815 311242336 /nfs/dbraw/zinc/24/23/36/311242336.db2.gz JSLFDZHDLDZQOD-IPQPSQTFSA-N 1 3 332.488 2.648 10 0 EFAEHO O=C(c1ccccc1Cl)N1CCC(NCC[C@H]2CCC[NH2+]2)CC1 ZINC000414906243 312061039 /nfs/dbraw/zinc/06/10/39/312061039.db2.gz PEAIBAWLHQNVGE-CQSZACIVSA-N 1 3 335.879 2.676 10 0 EFAEHO O=C(NCCC[NH+]1CCCCCC1)Nc1ccc2c(c1F)CCNC2 ZINC000415963665 312186204 /nfs/dbraw/zinc/18/62/04/312186204.db2.gz WADAJPPOVWHCGU-UHFFFAOYSA-N 1 3 348.466 2.859 10 0 EFAEHO CC1CC[NH+](CCCNC(=O)Nc2ccc3c(c2F)CCNC3)CC1 ZINC000415965159 312186845 /nfs/dbraw/zinc/18/68/45/312186845.db2.gz ZFJBIVHDRHJONZ-UHFFFAOYSA-N 1 3 348.466 2.715 10 0 EFAEHO C[NH+](C)C1CCN(C(=O)Nc2cc(CN)cc(C(F)(F)F)c2)CC1 ZINC000415967401 312187259 /nfs/dbraw/zinc/18/72/59/312187259.db2.gz HWTXKPMNZBSXKL-UHFFFAOYSA-N 1 3 344.381 2.722 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)NC[C@H]([NH3+])c2ccccc2)N(C)C)cc1 ZINC000417313099 312207763 /nfs/dbraw/zinc/20/77/63/312207763.db2.gz OSAUSWHJSHYNEU-RBUKOAKNSA-N 1 3 340.471 2.597 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)NC[C@H](C)N2CCC(C)CC2)cc1 ZINC000417317344 312208574 /nfs/dbraw/zinc/20/85/74/312208574.db2.gz WJDDVIIJKKYPCU-JKSUJKDBSA-N 1 3 332.492 2.626 10 0 EFAEHO FC(F)CN1CC[C@H](NC2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000417378424 312216615 /nfs/dbraw/zinc/21/66/15/312216615.db2.gz FHSMOTYNQPFEHX-SFHVURJKSA-N 1 3 337.458 2.623 10 0 EFAEHO CC[C@H](C)[N@H+](C)CCNC(=O)NC[C@H](N)c1ccc(C(C)C)cc1 ZINC000417441148 312224095 /nfs/dbraw/zinc/22/40/95/312224095.db2.gz AKBTZZOJSYCNHG-YJBOKZPZSA-N 1 3 334.508 2.839 10 0 EFAEHO CC[C@H](C)[N@@H+](C)CCNC(=O)NC[C@H](N)c1ccc(C(C)C)cc1 ZINC000417441148 312224098 /nfs/dbraw/zinc/22/40/98/312224098.db2.gz AKBTZZOJSYCNHG-YJBOKZPZSA-N 1 3 334.508 2.839 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)NCCN2[C@H](C)CCC[C@H]2C)cc1 ZINC000417529361 312235110 /nfs/dbraw/zinc/23/51/10/312235110.db2.gz GIUXMLHNRNCIKY-OAGGEKHMSA-N 1 3 332.492 2.768 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)NCCN2[C@H](C)CCC[C@@H]2C)cc1 ZINC000417529363 312235118 /nfs/dbraw/zinc/23/51/18/312235118.db2.gz GIUXMLHNRNCIKY-XHSDSOJGSA-N 1 3 332.492 2.768 10 0 EFAEHO CC1=CCN(CCNC(=O)NC[C@@H]([NH3+])c2ccc(C(C)C)cc2)CC1 ZINC000418035177 312313602 /nfs/dbraw/zinc/31/36/02/312313602.db2.gz XQTMVHAVEPJQNA-LJQANCHMSA-N 1 3 344.503 2.761 10 0 EFAEHO C[C@@H](NC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@H](c1ccccc1)N(C)C ZINC000418163463 312337743 /nfs/dbraw/zinc/33/77/43/312337743.db2.gz DKYJIANRNZXPBJ-ZLMZNLFFSA-N 1 3 344.503 2.602 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)N[C@@H](C)[C@@H](C)[NH3+])N(CC)CC)cc1 ZINC000418221899 312349437 /nfs/dbraw/zinc/34/94/37/312349437.db2.gz WIBLSTNAQVDZST-VKJFTORMSA-N 1 3 334.508 2.667 10 0 EFAEHO CCOC(=O)C1CCC([NH2+]CC2(N)C3CC4CC(C3)CC2C4)CC1 ZINC000423520265 312428730 /nfs/dbraw/zinc/42/87/30/312428730.db2.gz DZOQFPYSEWXAOD-UHFFFAOYSA-N 1 3 334.504 2.852 10 0 EFAEHO CC[C@H](N[C@@H](CC(C)C)C(=O)NCC[NH+](C)C)c1ccsc1 ZINC000453177323 312875067 /nfs/dbraw/zinc/87/50/67/312875067.db2.gz GMAOFJIOVLDOKL-HOTGVXAUSA-N 1 3 325.522 2.881 10 0 EFAEHO Cc1cc([C@@H](C)N[C@@H](CC(C)C)C(=O)NCC[NH+](C)C)cs1 ZINC000453187499 312876724 /nfs/dbraw/zinc/87/67/24/312876724.db2.gz VPXKKQLGPGLZBE-ZBFHGGJFSA-N 1 3 325.522 2.800 10 0 EFAEHO Cc1cc(NC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)ccc1OCCN(C)C ZINC000458195474 313082040 /nfs/dbraw/zinc/08/20/40/313082040.db2.gz FLBLJSVSACAYRK-HOTGVXAUSA-N 1 3 333.476 2.604 10 0 EFAEHO Cc1cc(NC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1OCCN(C)C ZINC000458195474 313082045 /nfs/dbraw/zinc/08/20/45/313082045.db2.gz FLBLJSVSACAYRK-HOTGVXAUSA-N 1 3 333.476 2.604 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)Nc1ccc(OCC[NH+](C)C)c(C)c1 ZINC000458195098 313082265 /nfs/dbraw/zinc/08/22/65/313082265.db2.gz LDHYWQCAGSBPDN-KRWDZBQOSA-N 1 3 333.476 2.748 10 0 EFAEHO C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](CC(=O)NC[C@@H](c2ccccc2)N(C)C)C1 ZINC000475740577 313226283 /nfs/dbraw/zinc/22/62/83/313226283.db2.gz CITAOJFKMZPEKV-NTDBWNAOSA-N 1 3 331.504 2.772 10 0 EFAEHO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](CC(=O)NC[C@@H](c2ccccc2)N(C)C)C1 ZINC000475740577 313226287 /nfs/dbraw/zinc/22/62/87/313226287.db2.gz CITAOJFKMZPEKV-NTDBWNAOSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)C[C@@H](C[NH+](C)C)NC(=O)N1CCN(C2CCCCC2)CC1 ZINC000485568618 313328818 /nfs/dbraw/zinc/32/88/18/313328818.db2.gz LDHOYBDKAWMNAD-KRWDZBQOSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)CC[C@H]1CCC[C@@H]1[NH2+]CC(=O)NC1CCN(C2CC2)CC1 ZINC000493637585 314427942 /nfs/dbraw/zinc/42/79/42/314427942.db2.gz YXTVXKAPUUFHLE-APWZRJJASA-N 1 3 335.536 2.924 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2CCC[C@@H]2CCO)CC1 ZINC000495168265 314676181 /nfs/dbraw/zinc/67/61/81/314676181.db2.gz ATXJDMMCRPJXNV-UYAOXDASSA-N 1 3 345.531 2.859 10 0 EFAEHO COc1ccc([C@H](C)NCc2ccc(C[NH3+])cc2)cc1NC(C)=O ZINC000515301021 315606642 /nfs/dbraw/zinc/60/66/42/315606642.db2.gz DWBOPKOEINDYDB-ZDUSSCGKSA-N 1 3 327.428 2.963 10 0 EFAEHO CCOc1ccc(C(=O)N2CCC([NH2+][C@@H]3CCC[C@H](N)C3)CC2)cc1 ZINC000516785856 315705373 /nfs/dbraw/zinc/70/53/73/315705373.db2.gz YFUSWQFHAKSJDL-FUHWJXTLSA-N 1 3 345.487 2.549 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@@]1(C)COc2ccccc2O1 ZINC000530211048 317081129 /nfs/dbraw/zinc/08/11/29/317081129.db2.gz LYDJBXUQBSADDP-YJYMSZOUSA-N 1 3 327.428 2.729 10 0 EFAEHO CCc1cccc(OCCN2CCC(CO[C@H]3CC[NH2+]C3)CC2)c1 ZINC000530238095 317088243 /nfs/dbraw/zinc/08/82/43/317088243.db2.gz JQFGAWBUHREFND-FQEVSTJZSA-N 1 3 332.488 2.718 10 0 EFAEHO FC(F)Oc1cccc(CN2CCC(CO[C@H]3CC[NH2+]C3)CC2)c1 ZINC000530241457 317088808 /nfs/dbraw/zinc/08/88/08/317088808.db2.gz PYRBBSKYWVMYLE-KRWDZBQOSA-N 1 3 340.414 2.879 10 0 EFAEHO CCOc1ccc(OCCN2CCC(CO[C@H]3CC[NH2+]C3)CC2)cc1 ZINC000530238294 317089032 /nfs/dbraw/zinc/08/90/32/317089032.db2.gz MGDPWHKZKNNYNT-FQEVSTJZSA-N 1 3 348.487 2.555 10 0 EFAEHO CCOc1ccc(OCCN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)cc1 ZINC000530238296 317089095 /nfs/dbraw/zinc/08/90/95/317089095.db2.gz MGDPWHKZKNNYNT-HXUWFJFHSA-N 1 3 348.487 2.555 10 0 EFAEHO Cc1cccc(C)c1OCCN1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530238674 317089146 /nfs/dbraw/zinc/08/91/46/317089146.db2.gz AKYODCRNUBKRHQ-IBGZPJMESA-N 1 3 332.488 2.773 10 0 EFAEHO CC(C)N(C)c1ccc(CN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)cn1 ZINC000530249281 317090961 /nfs/dbraw/zinc/09/09/61/317090961.db2.gz UPUQYWIIPWRHLP-LJQANCHMSA-N 1 3 346.519 2.517 10 0 EFAEHO COc1ccccc1/C=C\CN1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530248863 317091043 /nfs/dbraw/zinc/09/10/43/317091043.db2.gz QYMCZAIFVSCRBA-GJEJWFRCSA-N 1 3 330.472 2.799 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000554597691 318327940 /nfs/dbraw/zinc/32/79/40/318327940.db2.gz UGFMMSRNVZOKPO-MSOLQXFVSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000554597691 318327943 /nfs/dbraw/zinc/32/79/43/318327943.db2.gz UGFMMSRNVZOKPO-MSOLQXFVSA-N 1 3 343.515 2.877 10 0 EFAEHO CCc1ccc(C(C)(C)NCC(=O)NC2CC[NH+](C3CC3)CC2)cc1 ZINC000557547459 318441031 /nfs/dbraw/zinc/44/10/31/318441031.db2.gz OQYHDQYWBVTANJ-UHFFFAOYSA-N 1 3 343.515 2.817 10 0 EFAEHO C[C@@H]([NH3+])C[C@@H](C)NC(=O)N1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000565595147 318985365 /nfs/dbraw/zinc/98/53/65/318985365.db2.gz AYRVAZHTBQSDPH-HUUCEWRRSA-N 1 3 326.529 2.654 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](NCCc2ncc(C)cc2C)[C@H](C)C1 ZINC000566971331 319127246 /nfs/dbraw/zinc/12/72/46/319127246.db2.gz JAKHQAUJNBFCCJ-UYAOXDASSA-N 1 3 333.520 2.968 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](NCCc2ncc(C)cc2C)[C@H](C)C1 ZINC000566971331 319127248 /nfs/dbraw/zinc/12/72/48/319127248.db2.gz JAKHQAUJNBFCCJ-UYAOXDASSA-N 1 3 333.520 2.968 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)C1 ZINC000568412589 319282329 /nfs/dbraw/zinc/28/23/29/319282329.db2.gz ZQPAQSUVNJSKQL-GOSISDBHSA-N 1 3 343.515 2.877 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+][C@@H]1CCCCNC1 ZINC000568486468 319288176 /nfs/dbraw/zinc/28/81/76/319288176.db2.gz AAVXAVJVWYLWSB-TZMCWYRMSA-N 1 3 339.867 2.797 10 0 EFAEHO O=C1C[C@H](N[C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CN1C1CC1 ZINC000568984236 319337050 /nfs/dbraw/zinc/33/70/50/319337050.db2.gz SMVMOFYZWVEOPV-MSOLQXFVSA-N 1 3 339.483 2.537 10 0 EFAEHO O=C1C[C@H](N[C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CN1C1CC1 ZINC000568984236 319337052 /nfs/dbraw/zinc/33/70/52/319337052.db2.gz SMVMOFYZWVEOPV-MSOLQXFVSA-N 1 3 339.483 2.537 10 0 EFAEHO O=C(c1ccccc1CC1CC[NH2+]CC1)N1CC[C@@H](N2CCCC2)C1 ZINC000568985632 319337385 /nfs/dbraw/zinc/33/73/85/319337385.db2.gz BSMCEBGWOYOHDA-LJQANCHMSA-N 1 3 341.499 2.539 10 0 EFAEHO CC(C)OC[C@@H](O)CNCc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000569449079 319381135 /nfs/dbraw/zinc/38/11/35/319381135.db2.gz IHWPWIBGGQCXTO-PXNSSMCTSA-N 1 3 334.504 2.794 10 0 EFAEHO CC(C)OC[C@@H](O)CNCc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000569449079 319381137 /nfs/dbraw/zinc/38/11/37/319381137.db2.gz IHWPWIBGGQCXTO-PXNSSMCTSA-N 1 3 334.504 2.794 10 0 EFAEHO O=C(NCCN[C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)c1ccccc1Cl ZINC000570320819 319465160 /nfs/dbraw/zinc/46/51/60/319465160.db2.gz ACMKCPMVKSDPFE-KBAYOESNSA-N 1 3 349.906 2.970 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)N[C@@H]2CC[NH2+]C[C@H]2C)CC1 ZINC000571303977 319562137 /nfs/dbraw/zinc/56/21/37/319562137.db2.gz OCQIVRYCBCGHDW-GPMSIDNRSA-N 1 3 344.503 2.509 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1cc(Cl)ccc1Br ZINC000575046885 319919785 /nfs/dbraw/zinc/91/97/85/319919785.db2.gz RCUOTHFOMYLYGK-LBPRGKRZSA-N 1 3 335.673 2.946 10 0 EFAEHO C[C@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@@H+]1CCCC[C@@H]1C ZINC000576610232 320032328 /nfs/dbraw/zinc/03/23/28/320032328.db2.gz MYOHRGWQKDCOEA-UONOGXRCSA-N 1 3 348.466 2.856 10 0 EFAEHO C[C@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@H+]1CCCC[C@@H]1C ZINC000576610232 320032329 /nfs/dbraw/zinc/03/23/29/320032329.db2.gz MYOHRGWQKDCOEA-UONOGXRCSA-N 1 3 348.466 2.856 10 0 EFAEHO C[C@@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@@H+]1CCCC[C@@H]1C ZINC000576610230 320032648 /nfs/dbraw/zinc/03/26/48/320032648.db2.gz MYOHRGWQKDCOEA-KBPBESRZSA-N 1 3 348.466 2.856 10 0 EFAEHO C[C@@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@H+]1CCCC[C@@H]1C ZINC000576610230 320032650 /nfs/dbraw/zinc/03/26/50/320032650.db2.gz MYOHRGWQKDCOEA-KBPBESRZSA-N 1 3 348.466 2.856 10 0 EFAEHO C[C@H](O)[C@H](NC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1F ZINC000576759694 320046645 /nfs/dbraw/zinc/04/66/45/320046645.db2.gz BUMARBXRKOAKKC-LIRRHRJNSA-N 1 3 329.419 2.901 10 0 EFAEHO C[NH+](C)CC[C@H](NC(=O)N1CCc2ccccc2[C@H]1CN)C(C)(C)C ZINC000577847606 320150397 /nfs/dbraw/zinc/15/03/97/320150397.db2.gz YLIDETAHCBWGLC-MSOLQXFVSA-N 1 3 346.519 2.621 10 0 EFAEHO [NH3+][C@@H]1C[C@H](N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)c2ccccc21 ZINC000578617096 320222248 /nfs/dbraw/zinc/22/22/48/320222248.db2.gz VPDSFJILXJUJTJ-OHQAAIJDSA-N 1 3 327.472 2.902 10 0 EFAEHO CC(C)(C(=O)NC1CC([NH+]2CCCCC2)C1)[C@@H](N)c1ccccc1 ZINC000579825463 324039191 /nfs/dbraw/zinc/03/91/91/324039191.db2.gz AAFXOZAUMBOYQL-ABHNRTSZSA-N 1 3 329.488 2.846 10 0 EFAEHO CNCc1ccccc1NC(=O)N1CCC(C[N@H+](C)C(C)C)CC1 ZINC000580410401 324157594 /nfs/dbraw/zinc/15/75/94/324157594.db2.gz HCBZXJZOZPHWCF-UHFFFAOYSA-N 1 3 332.492 2.990 10 0 EFAEHO CNCc1ccccc1NC(=O)N1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000580410401 324157598 /nfs/dbraw/zinc/15/75/98/324157598.db2.gz HCBZXJZOZPHWCF-UHFFFAOYSA-N 1 3 332.492 2.990 10 0 EFAEHO C[C@@H]([NH3+])C[C@H](C)NC(=O)NCc1ccccc1CN1CCCCC1 ZINC000580548816 324185498 /nfs/dbraw/zinc/18/54/98/324185498.db2.gz LCMAAKDDVWBRKQ-CVEARBPZSA-N 1 3 332.492 2.598 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1nc2ccccc2n2cncc12 ZINC000624386645 450824242 /nfs/dbraw/zinc/82/42/42/450824242.db2.gz RRCXKCAZUIXPGY-HNNXBMFYSA-N 1 3 340.475 2.566 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1nc2ccccc2n2cncc12 ZINC000624386645 450824246 /nfs/dbraw/zinc/82/42/46/450824246.db2.gz RRCXKCAZUIXPGY-HNNXBMFYSA-N 1 3 340.475 2.566 10 0 EFAEHO CN1CCC[C@H]1CNC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000139436439 473232301 /nfs/dbraw/zinc/23/23/01/473232301.db2.gz BDQYCUDAWBNRBA-IBGZPJMESA-N 1 3 344.503 2.566 10 0 EFAEHO Cc1ccc(CCC(=O)NC2CCN(C3CC[NH+](C)CC3)CC2)cc1 ZINC000124395382 473241013 /nfs/dbraw/zinc/24/10/13/473241013.db2.gz BBZIYGUTLAFHMA-UHFFFAOYSA-N 1 3 343.515 2.602 10 0 EFAEHO CCC[C@H](C(=O)NC[C@@H](c1ccsc1)N(CC)CC)N(C)C ZINC000161565867 473244855 /nfs/dbraw/zinc/24/48/55/473244855.db2.gz ZIEXJMQOFUZFPW-CVEARBPZSA-N 1 3 325.522 2.978 10 0 EFAEHO CCC[C@H](C(=O)NC[C@@H](c1ccsc1)N(CC)CC)[NH+](C)C ZINC000161565867 473244859 /nfs/dbraw/zinc/24/48/59/473244859.db2.gz ZIEXJMQOFUZFPW-CVEARBPZSA-N 1 3 325.522 2.978 10 0 EFAEHO CC[NH+](CC)CCOc1ccccc1NC(=O)N1CC[C@@H](N(C)C)C1 ZINC000171074538 473273710 /nfs/dbraw/zinc/27/37/10/473273710.db2.gz FHTZFIWZGSMCMI-MRXNPFEDSA-N 1 3 348.491 2.575 10 0 EFAEHO CCCC[C@@H](COC)[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000124720459 473291615 /nfs/dbraw/zinc/29/16/15/473291615.db2.gz ILDTXKGOBXOJRN-SFHVURJKSA-N 1 3 325.541 2.732 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](NC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000177468019 473383164 /nfs/dbraw/zinc/38/31/64/473383164.db2.gz BFNKGIGREKEIOY-RBUKOAKNSA-N 1 3 329.488 2.885 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]Cc2cncc(OC)c2C)[C@H](C)C1 ZINC000631074244 479878537 /nfs/dbraw/zinc/87/85/37/479878537.db2.gz WIXPSHGUQREQNZ-CRAIPNDOSA-N 1 3 335.492 2.625 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]Cc2cncc(OC)c2C)[C@@H](C)C1 ZINC000631074245 479879207 /nfs/dbraw/zinc/87/92/07/479879207.db2.gz WIXPSHGUQREQNZ-MAUKXSAKSA-N 1 3 335.492 2.625 10 0 EFAEHO Cn1ncc(C(F)(F)F)c1CNC1CCN(c2cc[nH+]cc2)CC1 ZINC000628382628 479885207 /nfs/dbraw/zinc/88/52/07/479885207.db2.gz BRVVVEWNCQKCQH-UHFFFAOYSA-N 1 3 339.365 2.593 10 0 EFAEHO Cc1cc(Br)cc(C)c1CN[C@@H]1CCOC[C@H]1[C@H](C)[NH3+] ZINC000422833146 476800872 /nfs/dbraw/zinc/80/08/72/476800872.db2.gz YPTQHQWCZIDDBO-VBNZEHGJSA-N 1 3 341.293 2.908 10 0 EFAEHO CN1CCN(CC[NH2+]Cc2ccc(CC(F)(F)F)cc2)CC1(C)C ZINC000631128633 479911883 /nfs/dbraw/zinc/91/18/83/479911883.db2.gz ZYHHGKQWCQPZAJ-UHFFFAOYSA-N 1 3 343.437 2.907 10 0 EFAEHO O=C(CN1CCCCCC1)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000007339708 471607025 /nfs/dbraw/zinc/60/70/25/471607025.db2.gz NMZRDDXRYMZFEX-UHFFFAOYSA-N 1 3 329.488 2.643 10 0 EFAEHO C[C@@H]1CN(c2ccccc2C[NH2+]C[C@@H]2CCN(C3CC3)C2)C[C@H](C)O1 ZINC000088679992 472380328 /nfs/dbraw/zinc/38/03/28/472380328.db2.gz WAZKSGNLJWEUBU-KSZLIROESA-N 1 3 343.515 2.874 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC(C)(C)CCO)CC1 ZINC000088737839 472382371 /nfs/dbraw/zinc/38/23/71/472382371.db2.gz OWGZRDXWDDLNJD-UHFFFAOYSA-N 1 3 333.520 2.717 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H](CCO)C(C)C)CC1 ZINC000088735784 472382523 /nfs/dbraw/zinc/38/25/23/472382523.db2.gz WQHWOEGJFODDLC-IBGZPJMESA-N 1 3 333.520 2.715 10 0 EFAEHO CN1CCC(Oc2ccc(N[C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cn2)CC1 ZINC000097038830 472419671 /nfs/dbraw/zinc/41/96/71/472419671.db2.gz YHKHCHOJABMSLR-NVXWUHKLSA-N 1 3 330.476 2.593 10 0 EFAEHO CN1CCC(Oc2ccc(N[C@@H]3CC[N@H+]4CCC[C@@H]4C3)cn2)CC1 ZINC000097038830 472419677 /nfs/dbraw/zinc/41/96/77/472419677.db2.gz YHKHCHOJABMSLR-NVXWUHKLSA-N 1 3 330.476 2.593 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000155273702 472527509 /nfs/dbraw/zinc/52/75/09/472527509.db2.gz RTJFUMZPONDCEM-LPHOPBHVSA-N 1 3 344.503 2.598 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000155273702 472527515 /nfs/dbraw/zinc/52/75/15/472527515.db2.gz RTJFUMZPONDCEM-LPHOPBHVSA-N 1 3 344.503 2.598 10 0 EFAEHO C[C@@H](NC(=O)N[C@H](CN(C)C)c1ccccc1)C(C)(C)C[NH+](C)C ZINC000120163059 472641687 /nfs/dbraw/zinc/64/16/87/472641687.db2.gz ITHFLMHCQYGLMU-NVXWUHKLSA-N 1 3 334.508 2.565 10 0 EFAEHO CN(C)C[C@@H](NC(=O)NCC(C)(C)[NH+]1CCCCC1)c1ccccc1 ZINC000047910416 472779919 /nfs/dbraw/zinc/77/99/19/472779919.db2.gz AHAYRACJQRYBQQ-GOSISDBHSA-N 1 3 346.519 2.853 10 0 EFAEHO O=C(CCN1CCC(C[NH+]2CCCC2)CC1)Nc1ccccc1F ZINC000047972973 472790131 /nfs/dbraw/zinc/79/01/31/472790131.db2.gz CVASQKILUWERLY-UHFFFAOYSA-N 1 3 333.451 2.962 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@@H](OC)C2)CC1 ZINC000091772519 472805589 /nfs/dbraw/zinc/80/55/89/472805589.db2.gz ZNZWBOJANSISKY-LJQANCHMSA-N 1 3 331.504 2.829 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@@H](OC)C2)CC1 ZINC000091772519 472805594 /nfs/dbraw/zinc/80/55/94/472805594.db2.gz ZNZWBOJANSISKY-LJQANCHMSA-N 1 3 331.504 2.829 10 0 EFAEHO CC1CC[NH+](CCCNC(=O)N[C@H](CN(C)C)c2ccccc2)CC1 ZINC000048190240 472828116 /nfs/dbraw/zinc/82/81/16/472828116.db2.gz BJWQVKCDOKXMEL-LJQANCHMSA-N 1 3 346.519 2.711 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NC[C@@H](C)N2CCCC[C@@H]2C)CC1 ZINC000073657585 472847697 /nfs/dbraw/zinc/84/76/97/472847697.db2.gz RTOVKAPUAVPCSE-DLBZAZTESA-N 1 3 338.540 2.671 10 0 EFAEHO OC[C@@H](Cc1ccccc1)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000158206663 472907579 /nfs/dbraw/zinc/90/75/79/472907579.db2.gz GPKOFTRVMPETGS-JOCHJYFZSA-N 1 3 338.495 2.887 10 0 EFAEHO CN(CCC1CCN(c2cc[nH+]cc2)CC1)C[C@H](O)C(F)(F)F ZINC000121891471 472937680 /nfs/dbraw/zinc/93/76/80/472937680.db2.gz RQUGOXLKUSBWPH-HNNXBMFYSA-N 1 3 331.382 2.543 10 0 EFAEHO CN(C)Cc1ccc(C(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)cc1 ZINC000107525182 472961664 /nfs/dbraw/zinc/96/16/64/472961664.db2.gz LVSTWKOQFPVXCW-IBGZPJMESA-N 1 3 329.488 2.839 10 0 EFAEHO C[NH+](C)C1CCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC1 ZINC000066395639 473089192 /nfs/dbraw/zinc/08/91/92/473089192.db2.gz KTCRYRFSNDEIOC-QGZVFWFLSA-N 1 3 347.478 2.590 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCc2ccc(C[NH+](CC)CC)cc2)C1 ZINC000052519246 473116247 /nfs/dbraw/zinc/11/62/47/473116247.db2.gz UARMKUXFAXGMBJ-LJQANCHMSA-N 1 3 346.519 2.812 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@H]([C@@H](C)O)C2)CC1 ZINC000136846070 473179559 /nfs/dbraw/zinc/17/95/59/473179559.db2.gz AHWCJPASTAAWIQ-MOPGFXCFSA-N 1 3 345.531 2.811 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@H]([C@@H](C)O)C2)CC1 ZINC000136846070 473179567 /nfs/dbraw/zinc/17/95/67/473179567.db2.gz AHWCJPASTAAWIQ-MOPGFXCFSA-N 1 3 345.531 2.811 10 0 EFAEHO Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H](O)CN1CCCCC1 ZINC000190849337 473407943 /nfs/dbraw/zinc/40/79/43/473407943.db2.gz CHPYCPUSUDRMSI-MRXNPFEDSA-N 1 3 330.394 2.950 10 0 EFAEHO CCCN1CCN(c2ccccc2CN2CC[C@@H](C[NH+](C)C)C2)CC1 ZINC000125501026 473419279 /nfs/dbraw/zinc/41/92/79/473419279.db2.gz KXBFGFATHLJFAQ-IBGZPJMESA-N 1 3 344.547 2.602 10 0 EFAEHO CC[C@H]([NH2+]C[C@H]1CCN(CC)C1)c1ccccc1OCC(=O)N(C)C ZINC000163283247 473429722 /nfs/dbraw/zinc/42/97/22/473429722.db2.gz DBQKFHYTUPHCBM-AEFFLSMTSA-N 1 3 347.503 2.536 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)N1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000171898040 473478434 /nfs/dbraw/zinc/47/84/34/473478434.db2.gz KGXHFJBSFNWPFC-MOPGFXCFSA-N 1 3 344.503 2.559 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000171898040 473478437 /nfs/dbraw/zinc/47/84/37/473478437.db2.gz KGXHFJBSFNWPFC-MOPGFXCFSA-N 1 3 344.503 2.559 10 0 EFAEHO C[C@H](NC[C@H](O)COCc1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185711304 473494476 /nfs/dbraw/zinc/49/44/76/473494476.db2.gz JQCCHJOHGSHFHG-DSKINZAPSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@H](NC[C@H](O)COCc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185711304 473494482 /nfs/dbraw/zinc/49/44/82/473494482.db2.gz JQCCHJOHGSHFHG-DSKINZAPSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@H]([NH2+]C[C@H](O)COCc1ccccc1)[C@@H]1CCCN(C2CCC2)C1 ZINC000185711304 473494487 /nfs/dbraw/zinc/49/44/87/473494487.db2.gz JQCCHJOHGSHFHG-DSKINZAPSA-N 1 3 346.515 2.807 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+](C[C@H]2CCCO2)C2CCCC2)CC1 ZINC000191512544 473549641 /nfs/dbraw/zinc/54/96/41/473549641.db2.gz PVINSGFTJVOKCJ-HXUWFJFHSA-N 1 3 337.552 2.826 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+](C[C@H]2CCCO2)C2CCCC2)CC1 ZINC000191512544 473549646 /nfs/dbraw/zinc/54/96/46/473549646.db2.gz PVINSGFTJVOKCJ-HXUWFJFHSA-N 1 3 337.552 2.826 10 0 EFAEHO C[C@@H]1C[C@H](c2ccccc2)CN1CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000115553434 473580323 /nfs/dbraw/zinc/58/03/23/473580323.db2.gz JZBAPQGKYQZAMD-AEFFLSMTSA-N 1 3 341.499 2.607 10 0 EFAEHO CCO[C@H]1C[C@@H]([NH2+]Cc2cccc(CN(C)C)c2)C12CCOCC2 ZINC000186226262 473622154 /nfs/dbraw/zinc/62/21/54/473622154.db2.gz NPKXGJQFRSSFAF-MOPGFXCFSA-N 1 3 332.488 2.812 10 0 EFAEHO C[C@@H](c1ccccc1)N1CCC(NC(=O)N(C)CCC[NH+](C)C)CC1 ZINC000186225916 473622635 /nfs/dbraw/zinc/62/26/35/473622635.db2.gz MMMGPQFSOCHEAJ-KRWDZBQOSA-N 1 3 346.519 2.805 10 0 EFAEHO CN1CC[C@H](NC(=O)NCC[N@H+](C)C2CCCC2)[C@@H]1c1ccccc1 ZINC000179152811 473640643 /nfs/dbraw/zinc/64/06/43/473640643.db2.gz FZZQGZRNPVTVEP-OALUTQOASA-N 1 3 344.503 2.605 10 0 EFAEHO CN1CC[C@H](NC(=O)NCC[N@@H+](C)C2CCCC2)[C@@H]1c1ccccc1 ZINC000179152811 473640649 /nfs/dbraw/zinc/64/06/49/473640649.db2.gz FZZQGZRNPVTVEP-OALUTQOASA-N 1 3 344.503 2.605 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1CNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000179157695 473641998 /nfs/dbraw/zinc/64/19/98/473641998.db2.gz CYDXNYIVWOHVQS-GUDVDZBRSA-N 1 3 344.503 2.605 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1CNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000179157695 473642001 /nfs/dbraw/zinc/64/20/01/473642001.db2.gz CYDXNYIVWOHVQS-GUDVDZBRSA-N 1 3 344.503 2.605 10 0 EFAEHO CC(C)C[C@H](C[NH+](C)C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000179190211 473649903 /nfs/dbraw/zinc/64/99/03/473649903.db2.gz ZYJCHSAYEGGPRL-CEXWTWQISA-N 1 3 346.519 2.707 10 0 EFAEHO C[C@H](C[NH+]1CCCCC1)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000179189431 473650333 /nfs/dbraw/zinc/65/03/33/473650333.db2.gz ZOAGBYJFUZVSEM-NZSAHSFTSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)N(C)CCC[NH+](C)C)CCN1Cc1ccccc1 ZINC000186406605 473669648 /nfs/dbraw/zinc/66/96/48/473669648.db2.gz HLPRVMSDSCZJJX-HKUYNNGSSA-N 1 3 346.519 2.633 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)N(C)CCC[NH+](C)C)CCN1Cc1ccccc1 ZINC000186406546 473669764 /nfs/dbraw/zinc/66/97/64/473669764.db2.gz HLPRVMSDSCZJJX-IEBWSBKVSA-N 1 3 346.519 2.633 10 0 EFAEHO COc1cc2c(cc1F)nccc2N[C@@H](C)CC[NH+]1CCN(C)CC1 ZINC000281410150 473712309 /nfs/dbraw/zinc/71/23/09/473712309.db2.gz HVDOIAGBHNGQJN-AWEZNQCLSA-N 1 3 346.450 2.820 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000245606131 473725481 /nfs/dbraw/zinc/72/54/81/473725481.db2.gz AEMAXYULAUDHDM-QRVBRYPASA-N 1 3 344.503 2.558 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000245606131 473725488 /nfs/dbraw/zinc/72/54/88/473725488.db2.gz AEMAXYULAUDHDM-QRVBRYPASA-N 1 3 344.503 2.558 10 0 EFAEHO CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000246183302 473793902 /nfs/dbraw/zinc/79/39/02/473793902.db2.gz LXHRYEUWWMRSBE-GUDVDZBRSA-N 1 3 344.503 2.558 10 0 EFAEHO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000246183302 473793910 /nfs/dbraw/zinc/79/39/10/473793910.db2.gz LXHRYEUWWMRSBE-GUDVDZBRSA-N 1 3 344.503 2.558 10 0 EFAEHO COCCN(C)CCC[NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000180107605 473799753 /nfs/dbraw/zinc/79/97/53/473799753.db2.gz NFOVJORMCHXSOL-SEJPIABJSA-N 1 3 345.531 2.740 10 0 EFAEHO CCC(=O)N1CC[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000180159299 473814798 /nfs/dbraw/zinc/81/47/98/473814798.db2.gz YWUIVIFAAYUIOL-XUBOLADHSA-N 1 3 341.499 2.783 10 0 EFAEHO CCC(=O)N1CC[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000180159299 473814803 /nfs/dbraw/zinc/81/48/03/473814803.db2.gz YWUIVIFAAYUIOL-XUBOLADHSA-N 1 3 341.499 2.783 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H](CNC(=O)NCCN2CCCC[C@H]2C)C1 ZINC000246286714 473816695 /nfs/dbraw/zinc/81/66/95/473816695.db2.gz IDOUPNXFSQVHIS-QZTJIDSGSA-N 1 3 338.540 2.528 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H](CNC(=O)NCCN2CCCC[C@H]2C)C1 ZINC000246286714 473816701 /nfs/dbraw/zinc/81/67/01/473816701.db2.gz IDOUPNXFSQVHIS-QZTJIDSGSA-N 1 3 338.540 2.528 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](c2ccccc2)N(C)C)[C@@H](C)C1 ZINC000246298421 473819762 /nfs/dbraw/zinc/81/97/62/473819762.db2.gz AGTIGYIWTBRGPV-YTQUADARSA-N 1 3 346.519 2.661 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NC[C@H](c2ccccc2)N(C)C)[C@@H](C)C1 ZINC000246298421 473819771 /nfs/dbraw/zinc/81/97/71/473819771.db2.gz AGTIGYIWTBRGPV-YTQUADARSA-N 1 3 346.519 2.661 10 0 EFAEHO CC[C@@H]1CCCCN1CCNC(=O)N(C)[C@@H]1CC[N@H+](CC)C[C@H]1C ZINC000246309893 473823218 /nfs/dbraw/zinc/82/32/18/473823218.db2.gz BDJUPJCUGKRVMP-KZNAEPCWSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[C@@H]1CCCCN1CCNC(=O)N(C)[C@@H]1CC[N@@H+](CC)C[C@H]1C ZINC000246309893 473823225 /nfs/dbraw/zinc/82/32/25/473823225.db2.gz BDJUPJCUGKRVMP-KZNAEPCWSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@@H](O)COCc2ccccc2Cl)CC[N@@H+]1C ZINC000246328753 473829519 /nfs/dbraw/zinc/82/95/19/473829519.db2.gz BBPRCBADUCMAKJ-DJIMGWMZSA-N 1 3 340.895 2.632 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@@H](O)COCc2ccccc2Cl)CC[N@H+]1C ZINC000246328753 473829526 /nfs/dbraw/zinc/82/95/26/473829526.db2.gz BBPRCBADUCMAKJ-DJIMGWMZSA-N 1 3 340.895 2.632 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)NCCC[N@H+](C)Cc2ccccc2)CCN1C ZINC000173535804 473870323 /nfs/dbraw/zinc/87/03/23/473870323.db2.gz QELUYDOBNHGCRP-HKUYNNGSSA-N 1 3 346.519 2.633 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)NCCC[N@@H+](C)Cc2ccccc2)CCN1C ZINC000173535804 473870325 /nfs/dbraw/zinc/87/03/25/473870325.db2.gz QELUYDOBNHGCRP-HKUYNNGSSA-N 1 3 346.519 2.633 10 0 EFAEHO Cc1ccc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c(F)c1Cl ZINC000617507112 480250193 /nfs/dbraw/zinc/25/01/93/480250193.db2.gz IQUJKXVPOLSWLH-ZDUSSCGKSA-N 1 3 343.874 2.789 10 0 EFAEHO C[N@H+](CCCNC(=O)N1CCCN(C2CC2)CC1)C1CCCCC1 ZINC000194660971 473934058 /nfs/dbraw/zinc/93/40/58/473934058.db2.gz FNMYHFXBSHRZBP-UHFFFAOYSA-N 1 3 336.524 2.521 10 0 EFAEHO C[N@@H+](CCCNC(=O)N1CCCN(C2CC2)CC1)C1CCCCC1 ZINC000194660971 473934063 /nfs/dbraw/zinc/93/40/63/473934063.db2.gz FNMYHFXBSHRZBP-UHFFFAOYSA-N 1 3 336.524 2.521 10 0 EFAEHO Cc1ccc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c(F)c1Cl ZINC000617507112 480250197 /nfs/dbraw/zinc/25/01/97/480250197.db2.gz IQUJKXVPOLSWLH-ZDUSSCGKSA-N 1 3 343.874 2.789 10 0 EFAEHO CN(C)CCNC(=O)c1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)cc1 ZINC000282185932 473974841 /nfs/dbraw/zinc/97/48/41/473974841.db2.gz NBXDTWCLPFQMIZ-GGPKGHCWSA-N 1 3 329.488 2.646 10 0 EFAEHO Cc1oncc1CN(C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000181689919 474056211 /nfs/dbraw/zinc/05/62/11/474056211.db2.gz YEKJFWPLJDIDFC-HXUWFJFHSA-N 1 3 343.471 2.860 10 0 EFAEHO CC(C)[N@@H+]1C[C@H](C)[C@H](NC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000247080958 474059889 /nfs/dbraw/zinc/05/98/89/474059889.db2.gz JFCVLGGPFUKMLK-QFBILLFUSA-N 1 3 329.488 2.741 10 0 EFAEHO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000247080958 474059896 /nfs/dbraw/zinc/05/98/96/474059896.db2.gz JFCVLGGPFUKMLK-QFBILLFUSA-N 1 3 329.488 2.741 10 0 EFAEHO CCCN1CC[C@H](C[NH2+]C[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000247238207 474096783 /nfs/dbraw/zinc/09/67/83/474096783.db2.gz YQTLAYHZGHFZBZ-IAGOWNOFSA-N 1 3 339.524 2.955 10 0 EFAEHO CN(CCC[NH+]1CCCC1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000282587439 474120316 /nfs/dbraw/zinc/12/03/16/474120316.db2.gz LNCXITSYUTYTIX-RTBURBONSA-N 1 3 344.503 2.559 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC000188532733 474121606 /nfs/dbraw/zinc/12/16/06/474121606.db2.gz VNJBCUMCPHRPJG-LJQANCHMSA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CCC[N@H+](Cc3ccccc3)C2)CCN1C ZINC000247392176 474136503 /nfs/dbraw/zinc/13/65/03/474136503.db2.gz MBGBYOKQQJHKLJ-HOJAQTOUSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CCN1C ZINC000247392176 474136510 /nfs/dbraw/zinc/13/65/10/474136510.db2.gz MBGBYOKQQJHKLJ-HOJAQTOUSA-N 1 3 343.515 2.840 10 0 EFAEHO CC(C)[N@@H+]1CCCN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CC1 ZINC000270561094 474170835 /nfs/dbraw/zinc/17/08/35/474170835.db2.gz SZOQNGJOUMCEEY-MOPGFXCFSA-N 1 3 344.503 2.558 10 0 EFAEHO CC(C)[N@H+]1CCCN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CC1 ZINC000270561094 474170839 /nfs/dbraw/zinc/17/08/39/474170839.db2.gz SZOQNGJOUMCEEY-MOPGFXCFSA-N 1 3 344.503 2.558 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCCC[NH+]2CCCCC2)[C@H]1c1ccccc1 ZINC000247917181 474226001 /nfs/dbraw/zinc/22/60/01/474226001.db2.gz BGRDCZJHUQTQIS-RTBURBONSA-N 1 3 344.503 2.607 10 0 EFAEHO O=C1OCC[C@@H]1CC[N@@H+]1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1 ZINC000248161053 474271612 /nfs/dbraw/zinc/27/16/12/474271612.db2.gz SCQSEXHVRHZNMB-ZCNNSNEGSA-N 1 3 342.483 2.926 10 0 EFAEHO O=C1OCC[C@@H]1CC[N@H+]1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1 ZINC000248161053 474271618 /nfs/dbraw/zinc/27/16/18/474271618.db2.gz SCQSEXHVRHZNMB-ZCNNSNEGSA-N 1 3 342.483 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000248186664 474280262 /nfs/dbraw/zinc/28/02/62/474280262.db2.gz XLMSFYPVYILFJH-PMACEKPBSA-N 1 3 343.515 2.840 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000248186664 474280266 /nfs/dbraw/zinc/28/02/66/474280266.db2.gz XLMSFYPVYILFJH-PMACEKPBSA-N 1 3 343.515 2.840 10 0 EFAEHO CCN1CC[C@@H](C[NH2+][C@@H](CCn2cncn2)c2ccc(C)cc2)C1 ZINC000275867091 474346253 /nfs/dbraw/zinc/34/62/53/474346253.db2.gz NVENOWYERSREEA-HKUYNNGSSA-N 1 3 327.476 2.649 10 0 EFAEHO CC[N@@H+]1CC[C@@H](CN[C@@H](CCn2cncn2)c2ccc(C)cc2)C1 ZINC000275867091 474346258 /nfs/dbraw/zinc/34/62/58/474346258.db2.gz NVENOWYERSREEA-HKUYNNGSSA-N 1 3 327.476 2.649 10 0 EFAEHO CC[N@H+]1CC[C@@H](CN[C@@H](CCn2cncn2)c2ccc(C)cc2)C1 ZINC000275867091 474346262 /nfs/dbraw/zinc/34/62/62/474346262.db2.gz NVENOWYERSREEA-HKUYNNGSSA-N 1 3 327.476 2.649 10 0 EFAEHO C[C@H](CCc1cccc(F)c1)[NH+]1CCC(C(=O)NCCN(C)C)CC1 ZINC000183209681 474350599 /nfs/dbraw/zinc/35/05/99/474350599.db2.gz DUSVGUJDTPFSEM-MRXNPFEDSA-N 1 3 349.494 2.537 10 0 EFAEHO C[C@@H]1CCN(C(=O)c2ccc(C[NH3+])cc2)CCN1Cc1ccccc1 ZINC000237375731 474393041 /nfs/dbraw/zinc/39/30/41/474393041.db2.gz IHIWCBHBMORPST-QGZVFWFLSA-N 1 3 337.467 2.882 10 0 EFAEHO [NH3+][C@@H]1CCC[C@@H](C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)C1 ZINC000237870142 474490887 /nfs/dbraw/zinc/49/08/87/474490887.db2.gz MIRFJCPRGBMAER-QRVBRYPASA-N 1 3 329.488 2.675 10 0 EFAEHO CC[C@](C)(O)C[N@H+](C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000249122357 474531743 /nfs/dbraw/zinc/53/17/43/474531743.db2.gz QABFQPLOHPIOLT-UXHICEINSA-N 1 3 334.504 2.525 10 0 EFAEHO CC[C@](C)(O)C[N@@H+](C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000249122357 474531749 /nfs/dbraw/zinc/53/17/49/474531749.db2.gz QABFQPLOHPIOLT-UXHICEINSA-N 1 3 334.504 2.525 10 0 EFAEHO O[C@@H](CN1CCC2(C1)CC[NH+](Cc1ccccc1)CC2)C(F)(F)F ZINC000291454799 474604671 /nfs/dbraw/zinc/60/46/71/474604671.db2.gz MMHUARLDRUZLQK-INIZCTEOSA-N 1 3 342.405 2.898 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)CC1 ZINC000249730087 474608138 /nfs/dbraw/zinc/60/81/38/474608138.db2.gz ZHMFXHDUEBVWLG-IAGOWNOFSA-N 1 3 338.540 2.528 10 0 EFAEHO O=C(NCCC[NH+]1CCCCCC1)Nc1ccc2c(c1)OCCNC2 ZINC000625944481 480115115 /nfs/dbraw/zinc/11/51/15/480115115.db2.gz PAZOQKYIPRWJNJ-UHFFFAOYSA-N 1 3 346.475 2.556 10 0 EFAEHO C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)N[C@@H](CN(C)C)c1ccccc1 ZINC000249774120 474614179 /nfs/dbraw/zinc/61/41/79/474614179.db2.gz MHDGFIBWJVWQAT-AOIWGVFYSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N[C@@H](CN(C)C)c1ccccc1 ZINC000249774120 474614183 /nfs/dbraw/zinc/61/41/83/474614183.db2.gz MHDGFIBWJVWQAT-AOIWGVFYSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@@H](NC(=O)CC1CCN(C)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000291623215 474634776 /nfs/dbraw/zinc/63/47/76/474634776.db2.gz HBUSCFQYXBFKAD-YLJYHZDGSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@@H](NC(=O)CC1CCN(C)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000291623215 474634778 /nfs/dbraw/zinc/63/47/78/474634778.db2.gz HBUSCFQYXBFKAD-YLJYHZDGSA-N 1 3 343.515 2.745 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)CC1 ZINC000273171433 474756652 /nfs/dbraw/zinc/75/66/52/474756652.db2.gz FAVJCJOHNGPHDL-KRWDZBQOSA-N 1 3 349.544 2.808 10 0 EFAEHO C[C@H]1CCC[N@H+](CCCCNCc2cnnn2Cc2ccccc2)C1 ZINC000291937325 474760652 /nfs/dbraw/zinc/76/06/52/474760652.db2.gz MTTDQRDUHNUNQE-SFHVURJKSA-N 1 3 341.503 2.928 10 0 EFAEHO C[C@H]1CCC[N@@H+](CCCCNCc2cnnn2Cc2ccccc2)C1 ZINC000291937325 474760662 /nfs/dbraw/zinc/76/06/62/474760662.db2.gz MTTDQRDUHNUNQE-SFHVURJKSA-N 1 3 341.503 2.928 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC[C@H](c2ccccc2)N2CCCC2)CC1 ZINC000273191669 474768878 /nfs/dbraw/zinc/76/88/78/474768878.db2.gz GZLIQRIJMIPVIF-LJQANCHMSA-N 1 3 329.488 2.672 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+][C@H]2CCN(C)C(C)(C)C2)[C@@H](C)C1 ZINC000623420598 480275963 /nfs/dbraw/zinc/27/59/63/480275963.db2.gz IIYOWLCKNDWCSQ-BZSNNMDCSA-N 1 3 325.541 2.586 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NC[C@@H](C)N2CCCC[C@H]2C)CC1 ZINC000340940474 474800836 /nfs/dbraw/zinc/80/08/36/474800836.db2.gz RTOVKAPUAVPCSE-IAGOWNOFSA-N 1 3 338.540 2.671 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)CC2CC[NH+](C)CC2)N2CCCC2)cc1 ZINC000273291786 474826012 /nfs/dbraw/zinc/82/60/12/474826012.db2.gz YFRRUOPSOQBPDF-HXUWFJFHSA-N 1 3 343.515 2.980 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N(CC[NH3+])CCc2ccccc2)c1 ZINC000623069466 480128227 /nfs/dbraw/zinc/12/82/27/480128227.db2.gz GHFMBBIZIPUAJB-UHFFFAOYSA-N 1 3 340.471 2.784 10 0 EFAEHO CC[NH+](CC)CCC[C@@H](C)NCc1c(Br)cnn1C ZINC000311785572 474842903 /nfs/dbraw/zinc/84/29/03/474842903.db2.gz JMWWBMDCHPEFTC-GFCCVEGCSA-N 1 3 331.302 2.783 10 0 EFAEHO COc1cc(CNCCCCC[NH+]2CCCC2)cc2c1OCCO2 ZINC000293155403 474843036 /nfs/dbraw/zinc/84/30/36/474843036.db2.gz VHQZADMBFNSUFU-UHFFFAOYSA-N 1 3 334.460 2.822 10 0 EFAEHO CC[NH+](CC)CCOc1ccc(C(=O)N2CCC[C@H]2CN(C)C)cc1 ZINC000268236824 474878381 /nfs/dbraw/zinc/87/83/81/474878381.db2.gz YXZMBEUOYXFSDF-SFHVURJKSA-N 1 3 347.503 2.573 10 0 EFAEHO C[C@H]([NH2+]C[C@H]1CCc2nccn2C1)c1ccc(OCCN(C)C)cc1 ZINC000278874912 474886942 /nfs/dbraw/zinc/88/69/42/474886942.db2.gz CBTZGTXLNBINOW-DLBZAZTESA-N 1 3 342.487 2.737 10 0 EFAEHO CN1CCCN(CCC[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000339069764 474897188 /nfs/dbraw/zinc/89/71/88/474897188.db2.gz VOPWMZYGFAVIMZ-TZIWHRDSSA-N 1 3 345.531 2.772 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@@H](C)[C@H]2Oc3ccccc3[C@@H]2C)CC1 ZINC000337325371 474899473 /nfs/dbraw/zinc/89/94/73/474899473.db2.gz VDVKYPBWLSDXTM-WFXMLNOXSA-N 1 3 345.531 2.945 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@@]2(CO)C[C@@H](C)CC(C)(C)C2)CC1 ZINC000337329247 474901528 /nfs/dbraw/zinc/90/15/28/474901528.db2.gz ZKYRPYUVKOKUFG-ICSRJNTNSA-N 1 3 339.568 2.569 10 0 EFAEHO CN1CC[C@@]2(CC[N@H+](C[C@@H](O)COc3ccc(C(C)(C)C)cc3)C2)C1 ZINC000292272668 474935002 /nfs/dbraw/zinc/93/50/02/474935002.db2.gz ZVLWPBVKJFYUCU-WIYYLYMNSA-N 1 3 346.515 2.751 10 0 EFAEHO CN1CC[C@@]2(CC[N@@H+](C[C@@H](O)COc3ccc(C(C)(C)C)cc3)C2)C1 ZINC000292272668 474935009 /nfs/dbraw/zinc/93/50/09/474935009.db2.gz ZVLWPBVKJFYUCU-WIYYLYMNSA-N 1 3 346.515 2.751 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)NCCN1CCCC[C@H]1C)CC(C)C ZINC000337391756 474970656 /nfs/dbraw/zinc/97/06/56/474970656.db2.gz ZWAMPJSLHFGFQS-MSOLQXFVSA-N 1 3 340.556 2.917 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)N(C)CC[C@@H]1CCCC[N@@H+]1C ZINC000341117016 474991513 /nfs/dbraw/zinc/99/15/13/474991513.db2.gz HBCLTICZSWHMDC-KSZLIROESA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000341117016 474991518 /nfs/dbraw/zinc/99/15/18/474991518.db2.gz HBCLTICZSWHMDC-KSZLIROESA-N 1 3 338.540 2.765 10 0 EFAEHO CCN1CCCC[C@H]1CNC(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C(C)C ZINC000341118265 474993748 /nfs/dbraw/zinc/99/37/48/474993748.db2.gz GMQKIUZISCARTO-SQNIBIBYSA-N 1 3 336.524 2.518 10 0 EFAEHO CCN1CCCC[C@H]1CNC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000341118265 474993756 /nfs/dbraw/zinc/99/37/56/474993756.db2.gz GMQKIUZISCARTO-SQNIBIBYSA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCCN1CCOC(C)(C)C1 ZINC000268917420 475069804 /nfs/dbraw/zinc/06/98/04/475069804.db2.gz VNOFDGBXWIACQS-QUCCMNQESA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCCN1CCOC(C)(C)C1 ZINC000268917420 475069809 /nfs/dbraw/zinc/06/98/09/475069809.db2.gz VNOFDGBXWIACQS-QUCCMNQESA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCCN1CCOC(C)(C)C1 ZINC000268917416 475070636 /nfs/dbraw/zinc/07/06/36/475070636.db2.gz VNOFDGBXWIACQS-AZUAARDMSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCCN1CCOC(C)(C)C1 ZINC000268917416 475070647 /nfs/dbraw/zinc/07/06/47/475070647.db2.gz VNOFDGBXWIACQS-AZUAARDMSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@H](CNC(=O)NCCN1[C@H](C)CCC[C@H]1C)C[NH+]1CCCCC1 ZINC000341471301 475071060 /nfs/dbraw/zinc/07/10/60/475071060.db2.gz ZCNBPNQUGFBXPK-KZNAEPCWSA-N 1 3 338.540 2.671 10 0 EFAEHO CCN1CCN(C[C@H](C)C[NH2+][C@@H](C)c2cnn(C3CCCC3)c2)CC1 ZINC000337504688 475077345 /nfs/dbraw/zinc/07/73/45/475077345.db2.gz DPHXEODUJDYDCB-MSOLQXFVSA-N 1 3 347.551 2.922 10 0 EFAEHO CC(C)COc1ccccc1CN[C@@H]1CCC[C@@H]1[C@@H]1COCC[NH2+]1 ZINC000261888045 475101434 /nfs/dbraw/zinc/10/14/34/475101434.db2.gz GDGCLBWJVYPBCH-OTWHNJEPSA-N 1 3 332.488 2.968 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)NCCC[NH2+]C1CCCCC1 ZINC000341551083 475135755 /nfs/dbraw/zinc/13/57/55/475135755.db2.gz BRQOMDJBURHBAE-IAGOWNOFSA-N 1 3 338.540 2.861 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)N1CCC[C@@H]1C[NH+]1CCCC1 ZINC000341564692 475148489 /nfs/dbraw/zinc/14/84/89/475148489.db2.gz YMZOSXBDDWQXJE-FGTMMUONSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N1CCC[C@@H]1C[NH+]1CCCC1 ZINC000341564695 475148667 /nfs/dbraw/zinc/14/86/67/475148667.db2.gz YMZOSXBDDWQXJE-KZNAEPCWSA-N 1 3 336.524 2.519 10 0 EFAEHO C([NH2+][C@@H]1CCC[C@@H]1[C@@H]1COCCN1)[C@H]1CCCN1CC1CCCCC1 ZINC000262037267 475152784 /nfs/dbraw/zinc/15/27/84/475152784.db2.gz YDYIARJRGKAEGR-MHTWAQMVSA-N 1 3 349.563 2.778 10 0 EFAEHO C([NH2+][C@@H]1CCC[C@H]1[C@H]1COCCN1)[C@H]1CCCN1CC1CCCCC1 ZINC000262037270 475155091 /nfs/dbraw/zinc/15/50/91/475155091.db2.gz YDYIARJRGKAEGR-XRXFAXGQSA-N 1 3 349.563 2.778 10 0 EFAEHO CN(C)C(=O)CC[NH+]1CCC(N[C@H]2CCCc3cc(F)ccc32)CC1 ZINC000341692171 475225521 /nfs/dbraw/zinc/22/55/21/475225521.db2.gz CHHHEXQFKHFZFE-IBGZPJMESA-N 1 3 347.478 2.735 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)CC[N@@H+]1C ZINC000631562156 480155416 /nfs/dbraw/zinc/15/54/16/480155416.db2.gz NCBHKQVDTKQJEV-YZGWKJHDSA-N 1 3 343.515 2.840 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)CC[N@H+]1C ZINC000631562156 480155422 /nfs/dbraw/zinc/15/54/22/480155422.db2.gz NCBHKQVDTKQJEV-YZGWKJHDSA-N 1 3 343.515 2.840 10 0 EFAEHO Cc1ccccc1CN1CCC(NC(=O)C[NH2+]C2(C(C)C)CC2)CC1 ZINC000339507195 475263477 /nfs/dbraw/zinc/26/34/77/475263477.db2.gz MXHMQFAZLZQZIS-UHFFFAOYSA-N 1 3 343.515 2.854 10 0 EFAEHO Cc1cc([C@@H](C)NC2CC[NH+](CCC(=O)N(C)C)CC2)c(C)s1 ZINC000361350019 475375522 /nfs/dbraw/zinc/37/55/22/475375522.db2.gz AZFMOERVWKCUCT-CQSZACIVSA-N 1 3 337.533 2.958 10 0 EFAEHO Cc1cccc([C@H](C)NC2CC[NH+](CCC(=O)N(C)C)CC2)c1C ZINC000361350394 475375701 /nfs/dbraw/zinc/37/57/01/475375701.db2.gz FOJFBHWBWXHGMP-KRWDZBQOSA-N 1 3 331.504 2.897 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@H]1CCN(C2CC2)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000358105945 475404300 /nfs/dbraw/zinc/40/43/00/475404300.db2.gz WVHUJIVCXJUTBP-BXWFABGCSA-N 1 3 348.535 2.518 10 0 EFAEHO C[C@H](NC(=O)N(C)[C@H]1CCN(C2CC2)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000358105945 475404306 /nfs/dbraw/zinc/40/43/06/475404306.db2.gz WVHUJIVCXJUTBP-BXWFABGCSA-N 1 3 348.535 2.518 10 0 EFAEHO CC[NH+](CC)CCCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000354788278 475410174 /nfs/dbraw/zinc/41/01/74/475410174.db2.gz QEAAMOJWFNNUDS-LJQANCHMSA-N 1 3 346.519 2.634 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000352571112 475422649 /nfs/dbraw/zinc/42/26/49/475422649.db2.gz QHGZLGDWMNOKQE-QUCCMNQESA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000352571112 475422656 /nfs/dbraw/zinc/42/26/56/475422656.db2.gz QHGZLGDWMNOKQE-QUCCMNQESA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000345809826 475471690 /nfs/dbraw/zinc/47/16/90/475471690.db2.gz KOZMYQPIWXPZNV-QRVBRYPASA-N 1 3 335.536 2.974 10 0 EFAEHO CN(C)CCNC(=O)c1ccc(C[NH2+][C@H]2CC[C@H]2C2CCC2)cc1 ZINC000337986102 475484715 /nfs/dbraw/zinc/48/47/15/475484715.db2.gz HLFVWSVJNVMBEZ-OALUTQOASA-N 1 3 329.488 2.646 10 0 EFAEHO CC1=CCN(CC[NH2+][C@@H](C)c2cccc(OCCN(C)C)c2)CC1 ZINC000358230898 475511659 /nfs/dbraw/zinc/51/16/59/475511659.db2.gz SLINAYSAMBJONQ-SFHVURJKSA-N 1 3 331.504 2.930 10 0 EFAEHO CC[N@H+](Cc1ccc(C(=O)NCCNc2ccncc2)cc1)C(C)C ZINC000338063448 475557691 /nfs/dbraw/zinc/55/76/91/475557691.db2.gz YWSBETBADRAXRX-UHFFFAOYSA-N 1 3 340.471 2.576 10 0 EFAEHO CC[N@@H+](Cc1ccc(C(=O)NCCNc2ccncc2)cc1)C(C)C ZINC000338063448 475557695 /nfs/dbraw/zinc/55/76/95/475557695.db2.gz YWSBETBADRAXRX-UHFFFAOYSA-N 1 3 340.471 2.576 10 0 EFAEHO CN(C)CCN(Cc1ccccc1F)C(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000355018041 475600962 /nfs/dbraw/zinc/60/09/62/475600962.db2.gz OKNOPUNXFRPWPN-SFHVURJKSA-N 1 3 349.494 2.980 10 0 EFAEHO CN(C)CCN(Cc1ccccc1F)C(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000355018041 475600969 /nfs/dbraw/zinc/60/09/69/475600969.db2.gz OKNOPUNXFRPWPN-SFHVURJKSA-N 1 3 349.494 2.980 10 0 EFAEHO CN(C)CCNC(=O)c1ccc(C[NH2+][C@H]2CC[C@@H]2C(C)(C)C)cc1 ZINC000348396028 475637969 /nfs/dbraw/zinc/63/79/69/475637969.db2.gz MGQFDEYOOKXVNG-ROUUACIJSA-N 1 3 331.504 2.892 10 0 EFAEHO CN(C)[C@H](CNC(=O)C[N@@H+](C)C[C@H]1CC=CCC1)c1ccccc1 ZINC000355069926 475642422 /nfs/dbraw/zinc/64/24/22/475642422.db2.gz YUSHUCLQIGFLQM-PKOBYXMFSA-N 1 3 329.488 2.694 10 0 EFAEHO COc1ccc([C@H](CN(C)C)NC(=O)CC[C@H]2CCCC[N@@H+]2C)cc1 ZINC000358423951 475666694 /nfs/dbraw/zinc/66/66/94/475666694.db2.gz HLEWEYFJDSPCDR-MJGOQNOKSA-N 1 3 347.503 2.679 10 0 EFAEHO COc1ccc([C@H](CN(C)C)NC(=O)CC[C@H]2CCCC[N@H+]2C)cc1 ZINC000358423951 475666700 /nfs/dbraw/zinc/66/67/00/475666700.db2.gz HLEWEYFJDSPCDR-MJGOQNOKSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@H]2C)C[C@H]1C ZINC000361775910 475741163 /nfs/dbraw/zinc/74/11/63/475741163.db2.gz YIMOWXHLLNCEPZ-TVFCKZIOSA-N 1 3 338.540 2.764 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@H]2C)C[C@H]1C ZINC000361775910 475741168 /nfs/dbraw/zinc/74/11/68/475741168.db2.gz YIMOWXHLLNCEPZ-TVFCKZIOSA-N 1 3 338.540 2.764 10 0 EFAEHO CSC1(CNCc2c[nH]c(-c3ccccc3)n2)CC[NH+](C)CC1 ZINC000353183865 475751792 /nfs/dbraw/zinc/75/17/92/475751792.db2.gz AZRYAHQTUNVFTL-UHFFFAOYSA-N 1 3 330.501 2.994 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NC[C@H](C)N2CCCC[C@H]2C)CC1 ZINC000338301844 475761375 /nfs/dbraw/zinc/76/13/75/475761375.db2.gz IIURRZSIHJMZRR-SJORKVTESA-N 1 3 338.540 2.671 10 0 EFAEHO COc1cccc(CC[NH2+][C@H](C)c2cccc(OCCN(C)C)c2)n1 ZINC000361925257 475871468 /nfs/dbraw/zinc/87/14/68/475871468.db2.gz ICVUOORLJMZOKQ-MRXNPFEDSA-N 1 3 343.471 2.924 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)CC1CC[NH+](C)CC1)c1ccsc1 ZINC000346810776 475877676 /nfs/dbraw/zinc/87/76/76/475877676.db2.gz AVHKZNAQHGVNKT-KRWDZBQOSA-N 1 3 337.533 2.979 10 0 EFAEHO C[C@H](CNC(=O)CCN1CCc2ccccc2C1)[NH+]1CCC(C)CC1 ZINC000348901933 475881681 /nfs/dbraw/zinc/88/16/81/475881681.db2.gz RTAFARNIOIZSFE-GOSISDBHSA-N 1 3 343.515 2.671 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cccc(C(=O)NC3CC3)c2)[C@@H]2CCC[C@H]21 ZINC000353389762 475930216 /nfs/dbraw/zinc/93/02/16/475930216.db2.gz WOYLMZUPYYCWAM-GBESFXJTSA-N 1 3 327.472 2.541 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCN2CC=CCC2)CC1 ZINC000355495803 475985084 /nfs/dbraw/zinc/98/50/84/475985084.db2.gz LYPNTBBBDGDZRQ-UHFFFAOYSA-N 1 3 342.531 2.570 10 0 EFAEHO COc1ccc(CN2CCC(C[NH2+]Cc3cnc(C)nc3)CC2)cc1 ZINC000340421142 476025567 /nfs/dbraw/zinc/02/55/67/476025567.db2.gz UVFXTBAWTCAPAI-UHFFFAOYSA-N 1 3 340.471 2.795 10 0 EFAEHO CS[C@@H]1CN([C@H]2CCN(Cc3ccccc3)C2)C[C@H]1[NH+]1CCCC1 ZINC000298295609 476047429 /nfs/dbraw/zinc/04/74/29/476047429.db2.gz HJJQQMNUWJUAJZ-XUVXKRRUSA-N 1 3 345.556 2.773 10 0 EFAEHO COCC[C@H](C)[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340465923 476052016 /nfs/dbraw/zinc/05/20/16/476052016.db2.gz JUZFCTXJAGDXMK-ICSRJNTNSA-N 1 3 346.515 2.930 10 0 EFAEHO CC[C@@H](Cn1cncn1)[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000353576203 476093128 /nfs/dbraw/zinc/09/31/28/476093128.db2.gz MXWOPFXRQVWRKJ-UXHICEINSA-N 1 3 341.503 2.949 10 0 EFAEHO CC[C@@H](Cn1cncn1)NC[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000353576203 476093135 /nfs/dbraw/zinc/09/31/35/476093135.db2.gz MXWOPFXRQVWRKJ-UXHICEINSA-N 1 3 341.503 2.949 10 0 EFAEHO CC[C@@H](Cn1cncn1)NC[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000353576203 476093143 /nfs/dbraw/zinc/09/31/43/476093143.db2.gz MXWOPFXRQVWRKJ-UXHICEINSA-N 1 3 341.503 2.949 10 0 EFAEHO CC[C@H](Cn1cncn1)[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000353576208 476094169 /nfs/dbraw/zinc/09/41/69/476094169.db2.gz MXWOPFXRQVWRKJ-WOJBJXKFSA-N 1 3 341.503 2.949 10 0 EFAEHO CC[C@H](Cn1cncn1)NC[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000353576208 476094174 /nfs/dbraw/zinc/09/41/74/476094174.db2.gz MXWOPFXRQVWRKJ-WOJBJXKFSA-N 1 3 341.503 2.949 10 0 EFAEHO CC[C@H](Cn1cncn1)NC[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000353576208 476094179 /nfs/dbraw/zinc/09/41/79/476094179.db2.gz MXWOPFXRQVWRKJ-WOJBJXKFSA-N 1 3 341.503 2.949 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000356384685 476101406 /nfs/dbraw/zinc/10/14/06/476101406.db2.gz CRLJZCZZJXZSKV-IPMKNSEASA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000356384685 476101417 /nfs/dbraw/zinc/10/14/17/476101417.db2.gz CRLJZCZZJXZSKV-IPMKNSEASA-N 1 3 335.536 2.974 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)[C@H]2CCC[C@@H]21 ZINC000353604546 476118530 /nfs/dbraw/zinc/11/85/30/476118530.db2.gz JFUIWJPEQFJYHP-WOZUAGRISA-N 1 3 327.516 2.971 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]C2CC(N3CCCCC3)C2)[C@H](C)C1 ZINC000359038930 476136082 /nfs/dbraw/zinc/13/60/82/476136082.db2.gz VKRLKVPQGRROKZ-YNIZLOQISA-N 1 3 337.552 2.730 10 0 EFAEHO c1cnc(N2CCC[C@@H]([NH2+]C3CCN(C4CCCCC4)CC3)C2)nc1 ZINC000359101775 476188778 /nfs/dbraw/zinc/18/87/78/476188778.db2.gz DOYXPGGQOVDIHB-GOSISDBHSA-N 1 3 343.519 2.832 10 0 EFAEHO O=C(N[C@H]1CCN(C2CC2)C1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000359245187 476217326 /nfs/dbraw/zinc/21/73/26/476217326.db2.gz ZDOUCFZSFAFYOG-ROUUACIJSA-N 1 3 348.535 2.521 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000362532664 476299549 /nfs/dbraw/zinc/29/95/49/476299549.db2.gz YCKCYKPRSBNWNI-UXHICEINSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000362532664 476299552 /nfs/dbraw/zinc/29/95/52/476299552.db2.gz YCKCYKPRSBNWNI-UXHICEINSA-N 1 3 343.515 2.841 10 0 EFAEHO COc1cc(CN2CCCC3(CC[NH+](C)CC3)C2)cc2c1OCCO2 ZINC000369705040 476486025 /nfs/dbraw/zinc/48/60/25/476486025.db2.gz UMFYXNVJVSHTGD-UHFFFAOYSA-N 1 3 346.471 2.774 10 0 EFAEHO COCCOC[C@@H](C)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000354209867 476506577 /nfs/dbraw/zinc/50/65/77/476506577.db2.gz ZCMPNZCQNJEBAR-VOBGVNJCSA-N 1 3 332.488 2.823 10 0 EFAEHO COCCOC[C@@H](C)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000354209867 476506582 /nfs/dbraw/zinc/50/65/82/476506582.db2.gz ZCMPNZCQNJEBAR-VOBGVNJCSA-N 1 3 332.488 2.823 10 0 EFAEHO CC1CC[NH+](CCCCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC000377773156 476572735 /nfs/dbraw/zinc/57/27/35/476572735.db2.gz GAIXDRQYXFXFMX-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO CC1CC[NH+](CCCNC(=O)CCN2CCc3ccccc3C2)CC1 ZINC000354312908 476578542 /nfs/dbraw/zinc/57/85/42/476578542.db2.gz QQUWVCHQDNFOQF-UHFFFAOYSA-N 1 3 343.515 2.673 10 0 EFAEHO CCC[N@H+](CC)C[C@H](C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000357874065 476664863 /nfs/dbraw/zinc/66/48/63/476664863.db2.gz SDDRJBYOPMVAQD-WDSOQIARSA-N 1 3 346.519 2.851 10 0 EFAEHO CCC[N@@H+](CC)C[C@H](C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000357874065 476664866 /nfs/dbraw/zinc/66/48/66/476664866.db2.gz SDDRJBYOPMVAQD-WDSOQIARSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@H]1CCOCCN1Cc1cccc(C[N@@H+]2CCOCC[C@@H]2C)c1 ZINC000378456125 476712178 /nfs/dbraw/zinc/71/21/78/476712178.db2.gz AYWGKOMGHDKYIC-ROUUACIJSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@H]1CCOCCN1Cc1cccc(C[N@H+]2CCOCC[C@@H]2C)c1 ZINC000378456125 476712193 /nfs/dbraw/zinc/71/21/93/476712193.db2.gz AYWGKOMGHDKYIC-ROUUACIJSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@H](CCN1CCC[C@@]2(CCOC2)C1)[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000451904859 476714058 /nfs/dbraw/zinc/71/40/58/476714058.db2.gz RGJYXYLMMGLRFP-VAMGGRTRSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CCN1CCC[C@@]2(CCOC2)C1)[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000451904859 476714063 /nfs/dbraw/zinc/71/40/63/476714063.db2.gz RGJYXYLMMGLRFP-VAMGGRTRSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@@H+]1CCC[C@@]2(CCOC2)C1)N1CCC[C@@]2(CCOC2)C1 ZINC000451904859 476714069 /nfs/dbraw/zinc/71/40/69/476714069.db2.gz RGJYXYLMMGLRFP-VAMGGRTRSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@H+]1CCC[C@@]2(CCOC2)C1)N1CCC[C@@]2(CCOC2)C1 ZINC000451904859 476714075 /nfs/dbraw/zinc/71/40/75/476714075.db2.gz RGJYXYLMMGLRFP-VAMGGRTRSA-N 1 3 336.520 2.770 10 0 EFAEHO CN1CCC[C@H](CNC(=O)NC(C)(C)CC[NH3+])[C@H]1c1cccs1 ZINC000422605636 476717194 /nfs/dbraw/zinc/71/71/94/476717194.db2.gz QKNNIJYVCCAZLB-HIFRSBDPSA-N 1 3 338.521 2.558 10 0 EFAEHO [NH3+]C1CCC(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)CC1 ZINC000379661242 476731364 /nfs/dbraw/zinc/73/13/64/476731364.db2.gz DVGFDALGLYDJMA-ACBHZAAOSA-N 1 3 329.488 2.675 10 0 EFAEHO C[C@H]1CCN(Cc2ccccc2)CCN1C(=O)CC1CC[NH+](C)CC1 ZINC000365887138 476751756 /nfs/dbraw/zinc/75/17/56/476751756.db2.gz JLMVJJPWVGCCJF-SFHVURJKSA-N 1 3 343.515 2.841 10 0 EFAEHO COc1ccc(CC[NH2+][C@@H](C)c2ccc(CN)nc2C)c(OC)c1 ZINC000422778259 476772374 /nfs/dbraw/zinc/77/23/74/476772374.db2.gz HBWJTHBWBLUTHJ-ZDUSSCGKSA-N 1 3 329.444 2.759 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CCc1ccc(-n2cccn2)cc1 ZINC000422822451 476796055 /nfs/dbraw/zinc/79/60/55/476796055.db2.gz KBAHELRNERFYNQ-OAHLLOKOSA-N 1 3 335.455 2.928 10 0 EFAEHO C[C@H]([NH3+])[C@@H](Cc1ccccc1)NCc1ccc(Cn2ccnc2)cc1 ZINC000422836704 476803029 /nfs/dbraw/zinc/80/30/29/476803029.db2.gz RTNOTPAKTHFEIU-LAUBAEHRSA-N 1 3 334.467 2.980 10 0 EFAEHO C[C@H](N)[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(Cn2ccnc2)cc1 ZINC000422836704 476803038 /nfs/dbraw/zinc/80/30/38/476803038.db2.gz RTNOTPAKTHFEIU-LAUBAEHRSA-N 1 3 334.467 2.980 10 0 EFAEHO C[C@H]([NH3+])[C@H](Cc1ccccc1)NCc1ccc(Cn2ccnc2)cc1 ZINC000422836706 476803094 /nfs/dbraw/zinc/80/30/94/476803094.db2.gz RTNOTPAKTHFEIU-UWJYYQICSA-N 1 3 334.467 2.980 10 0 EFAEHO C[C@H](N)[C@H](Cc1ccccc1)[NH2+]Cc1ccc(Cn2ccnc2)cc1 ZINC000422836706 476803099 /nfs/dbraw/zinc/80/30/99/476803099.db2.gz RTNOTPAKTHFEIU-UWJYYQICSA-N 1 3 334.467 2.980 10 0 EFAEHO COCCOc1ccc(CN[C@H](C)c2ccc(C[NH3+])nc2C)cc1 ZINC000422854057 476812621 /nfs/dbraw/zinc/81/26/21/476812621.db2.gz CLKMWRBQOUBSME-CQSZACIVSA-N 1 3 329.444 2.725 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@H](C[NH2+][C@@H]3CCCC[C@H]3CN)C2)c1 ZINC000422870193 476819622 /nfs/dbraw/zinc/81/96/22/476819622.db2.gz BKQWVWNPVLOXTG-GQIGUUNPSA-N 1 3 347.503 2.637 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@@H](CN[C@@H](C)[C@@H]3CCCC[NH2+]3)C2)c1 ZINC000422874620 476822232 /nfs/dbraw/zinc/82/22/32/476822232.db2.gz NXTUMWHODXEUMK-FTRWYGJKSA-N 1 3 347.503 2.650 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1ccc(Oc2ccc(F)cc2)nc1 ZINC000422896249 476832134 /nfs/dbraw/zinc/83/21/34/476832134.db2.gz HWOQPPOYFPJNOZ-MRXNPFEDSA-N 1 3 333.407 2.857 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCc2cn(C(C)C)nc2C1 ZINC000422933831 476852522 /nfs/dbraw/zinc/85/25/22/476852522.db2.gz DXWCNGJWCUIARO-BBRMVZONSA-N 1 3 327.476 2.834 10 0 EFAEHO CCO[C@@H]1C[C@@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)C1(C)C ZINC000397600865 476857682 /nfs/dbraw/zinc/85/76/82/476857682.db2.gz UCEDPIAHYWWOEP-RTBURBONSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@@H](NCC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cn1 ZINC000397608617 476858042 /nfs/dbraw/zinc/85/80/42/476858042.db2.gz YLCFFABDVUGOQD-MRXNPFEDSA-N 1 3 343.446 2.898 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CCCN(C(=O)C1CCC1)C1CC1 ZINC000422951975 476862258 /nfs/dbraw/zinc/86/22/58/476862258.db2.gz BCQYAOWNFSRIQV-AWEZNQCLSA-N 1 3 344.503 2.681 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)[C@@H](C)[NH3+] ZINC000399383122 476883040 /nfs/dbraw/zinc/88/30/40/476883040.db2.gz OVKIKALIBKXAED-LMMKCTJWSA-N 1 3 331.504 2.729 10 0 EFAEHO [NH3+][C@H]1CCC[C@H]1NCCCOc1ncc(C(F)(F)F)cc1Cl ZINC000423008372 476890198 /nfs/dbraw/zinc/89/01/98/476890198.db2.gz AAQDKZWRAZMCCB-NWDGAFQWSA-N 1 3 337.773 2.992 10 0 EFAEHO COc1ccc2c(c1)OC[C@H](N[C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)C2 ZINC000423020839 476894308 /nfs/dbraw/zinc/89/43/08/476894308.db2.gz CWUNVYRUVPVYCO-QXCFHYIPSA-N 1 3 330.472 2.899 10 0 EFAEHO Cc1ccc2c(CCN[C@@H]3CCOC[C@H]3[C@H]3CCC[NH2+]3)cn(C)c2c1 ZINC000423057058 476908855 /nfs/dbraw/zinc/90/88/55/476908855.db2.gz GRTXOUWFDQCZHC-XUVXKRRUSA-N 1 3 341.499 2.776 10 0 EFAEHO Cc1cc(N2CCC[C@H](N[C@@H](C)C[C@@H]3CCCCC[NH2+]3)C2)n(C)n1 ZINC000423074381 476916332 /nfs/dbraw/zinc/91/63/32/476916332.db2.gz LLEBWNKQTYDJGI-SZMVWBNQSA-N 1 3 333.524 2.598 10 0 EFAEHO OC[C@H](CN[C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1)Cc1ccc(F)c(F)c1 ZINC000423082173 476921331 /nfs/dbraw/zinc/92/13/31/476921331.db2.gz WGSHQDWGKHTIMR-QGWWYQLQSA-N 1 3 338.442 2.626 10 0 EFAEHO CC1(C)[C@H](Oc2ccccc2)C[C@@H]1N[C@@H]1CCOC[C@H]1[C@H]1CCC[NH2+]1 ZINC000423125225 476938009 /nfs/dbraw/zinc/93/80/09/476938009.db2.gz NLRJROPFMNCDGC-MFKWGIFDSA-N 1 3 344.499 2.979 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000423173969 476953945 /nfs/dbraw/zinc/95/39/45/476953945.db2.gz ASCDDBQEUXMWQN-WMLDXEAASA-N 1 3 328.435 2.917 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1cc(Cl)cc(Br)c1 ZINC000423184185 476957991 /nfs/dbraw/zinc/95/79/91/476957991.db2.gz NEKPIDUESDQELL-CYBMUJFWSA-N 1 3 335.673 2.946 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2ccc3c(c2)CNCC3)[C@H](C)C1 ZINC000415896736 476961421 /nfs/dbraw/zinc/96/14/21/476961421.db2.gz OVMJRWFFCJNJJK-RDTXWAMCSA-N 1 3 330.476 2.526 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc3c(c2)CNCC3)[C@H](C)C1 ZINC000415896736 476961428 /nfs/dbraw/zinc/96/14/28/476961428.db2.gz OVMJRWFFCJNJJK-RDTXWAMCSA-N 1 3 330.476 2.526 10 0 EFAEHO C[NH2+]Cc1ccccc1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000415919317 476969952 /nfs/dbraw/zinc/96/99/52/476969952.db2.gz HJIDVUVRFGHCJS-RTBURBONSA-N 1 3 338.455 2.973 10 0 EFAEHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000423295994 476985445 /nfs/dbraw/zinc/98/54/45/476985445.db2.gz YDIUIECBYXLJEO-UONOGXRCSA-N 1 3 347.484 2.929 10 0 EFAEHO C[C@H]([NH2+][C@@H]1CCNC[C@@H]1C)c1ccc(I)cc1 ZINC000423385723 477012839 /nfs/dbraw/zinc/01/28/39/477012839.db2.gz GYUSBGJUZCTHOX-COPLHBTASA-N 1 3 344.240 2.940 10 0 EFAEHO CC[C@H](NC[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1cccc(OC)c1 ZINC000423378386 477010537 /nfs/dbraw/zinc/01/05/37/477010537.db2.gz FUVLWGUOFBKQDY-HOTGVXAUSA-N 1 3 345.409 2.572 10 0 EFAEHO C[N@@H+]1CCCC[C@H]1CCC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000431656852 477068218 /nfs/dbraw/zinc/06/82/18/477068218.db2.gz DBOBISGNLLNAPE-OALUTQOASA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@H+]1CCCC[C@H]1CCC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000431656852 477068221 /nfs/dbraw/zinc/06/82/21/477068221.db2.gz DBOBISGNLLNAPE-OALUTQOASA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@@H+]1CCCC[C@@H]1CCC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000431656853 477069153 /nfs/dbraw/zinc/06/91/53/477069153.db2.gz DBOBISGNLLNAPE-RBUKOAKNSA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@H+]1CCCC[C@@H]1CCC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000431656853 477069156 /nfs/dbraw/zinc/06/91/56/477069156.db2.gz DBOBISGNLLNAPE-RBUKOAKNSA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCNC(=O)c2ccc(Cl)cc2)[C@@H]2CCC[C@@H]21 ZINC000375898499 477069507 /nfs/dbraw/zinc/06/95/07/477069507.db2.gz UBKAZVVQUKDPKM-ULQDDVLXSA-N 1 3 335.879 2.532 10 0 EFAEHO C[N@H+]1CC[C@H](NCCNC(=O)c2ccc(Cl)cc2)[C@@H]2CCC[C@@H]21 ZINC000375898499 477069510 /nfs/dbraw/zinc/06/95/10/477069510.db2.gz UBKAZVVQUKDPKM-ULQDDVLXSA-N 1 3 335.879 2.532 10 0 EFAEHO CN1CCN(c2ccc(N[C@@H]3CC[N@H+](C)[C@@H]4CCC[C@H]43)cc2)CC1 ZINC000375898267 477069767 /nfs/dbraw/zinc/06/97/67/477069767.db2.gz QSBNEGBXQYBFJO-XUVXKRRUSA-N 1 3 328.504 2.723 10 0 EFAEHO CN1CCN(c2ccc(N[C@@H]3CC[N@@H+](C)[C@@H]4CCC[C@H]43)cc2)CC1 ZINC000375898267 477069773 /nfs/dbraw/zinc/06/97/73/477069773.db2.gz QSBNEGBXQYBFJO-XUVXKRRUSA-N 1 3 328.504 2.723 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)CC[C@H]2CCCC[N@@H+]2C)N(C)C)cc1 ZINC000431773332 477093146 /nfs/dbraw/zinc/09/31/46/477093146.db2.gz OGOINEJKWVTQQO-RTBURBONSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)CC[C@H]2CCCC[N@H+]2C)N(C)C)cc1 ZINC000431773332 477093153 /nfs/dbraw/zinc/09/31/53/477093153.db2.gz OGOINEJKWVTQQO-RTBURBONSA-N 1 3 331.504 2.978 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2c(F)cccc2-n2cccn2)[C@H]2CCC[C@H]21 ZINC000453349184 477211332 /nfs/dbraw/zinc/21/13/32/477211332.db2.gz JGVGEWYKLSSGJW-FHLIZLRMSA-N 1 3 328.435 2.974 10 0 EFAEHO CC[NH+](CC)Cc1ccc(CNC(=O)N2CCN3CCC2CC3)cc1 ZINC000367054375 477319381 /nfs/dbraw/zinc/31/93/81/477319381.db2.gz JNIALEHGGIYBIX-UHFFFAOYSA-N 1 3 344.503 2.518 10 0 EFAEHO CC[NH+](CC)[C@@H](CNC(=O)N1CCN2CCC1CC2)c1ccccc1 ZINC000367062913 477323634 /nfs/dbraw/zinc/32/36/34/477323634.db2.gz QYJNDORDYPROTL-IBGZPJMESA-N 1 3 344.503 2.559 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCCCC[N@H+](C)C2CC2)[C@H]1c1ccccc1 ZINC000454720979 477344251 /nfs/dbraw/zinc/34/42/51/477344251.db2.gz KLDVSDQYCJAGMN-RTBURBONSA-N 1 3 344.503 2.605 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCCCC[N@@H+](C)C2CC2)[C@H]1c1ccccc1 ZINC000454720979 477344252 /nfs/dbraw/zinc/34/42/52/477344252.db2.gz KLDVSDQYCJAGMN-RTBURBONSA-N 1 3 344.503 2.605 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@H](NCc3ccncc3OCCC[NH+](C)C)C[C@H]2C1 ZINC000424352526 477378612 /nfs/dbraw/zinc/37/86/12/477378612.db2.gz QCXYOJFYASZEOD-MKQMEDFFSA-N 1 3 347.503 2.705 10 0 EFAEHO Cc1cc(C[NH3+])cc(NC(=O)N[C@H](Cc2ccccc2)CN(C)C)c1 ZINC000424432143 477405180 /nfs/dbraw/zinc/40/51/80/477405180.db2.gz BLKIHJZBIZACPO-LJQANCHMSA-N 1 3 340.471 2.748 10 0 EFAEHO CC(C)(C)CC(C)(C)[NH+]1CCC(NC[C@H]2CCS(=O)(=O)C2)CC1 ZINC000449076699 477425904 /nfs/dbraw/zinc/42/59/04/477425904.db2.gz XKJTVIPQAHVKPJ-OAHLLOKOSA-N 1 3 344.565 2.690 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(NCCc2cnn(C)c2)CC1 ZINC000449083568 477429927 /nfs/dbraw/zinc/42/99/27/477429927.db2.gz CIFRVSOXFZTFEF-QGZVFWFLSA-N 1 3 326.488 2.648 10 0 EFAEHO Cc1nccn1CC[NH2+]C1CCN([C@H](C)Cc2ccccc2)CC1 ZINC000449108529 477442133 /nfs/dbraw/zinc/44/21/33/477442133.db2.gz RNVHDHYBFXFKOJ-QGZVFWFLSA-N 1 3 326.488 2.877 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NCCSCCCO)CC1 ZINC000449122899 477448249 /nfs/dbraw/zinc/44/82/49/477448249.db2.gz ATIDFHYEPZJOLN-KRWDZBQOSA-N 1 3 336.545 2.787 10 0 EFAEHO CN1CCN(C)[C@H](CNC2CC[NH+](C(C)(C)CC(C)(C)C)CC2)C1 ZINC000449144171 477457824 /nfs/dbraw/zinc/45/78/24/477457824.db2.gz YWWDRNVOXPBJFA-GOSISDBHSA-N 1 3 338.584 2.501 10 0 EFAEHO CS[C@H](CO)[C@H](C)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449158990 477463747 /nfs/dbraw/zinc/46/37/47/477463747.db2.gz WQPAEKKCBUMPIB-TXPKVOOTSA-N 1 3 336.545 2.784 10 0 EFAEHO C[C@H](Cc1ccccc1)N1CCC([NH2+]C[C@@](C)(O)C(F)(F)F)CC1 ZINC000449217184 477491470 /nfs/dbraw/zinc/49/14/70/477491470.db2.gz XOXFPPVZEUWETP-RHSMWYFYSA-N 1 3 344.421 2.985 10 0 EFAEHO C[C@H]1CN(Cc2ccc(C[NH+]3CCCCC3)cc2)[C@@H](C)CN1CCO ZINC000419337825 477496992 /nfs/dbraw/zinc/49/69/92/477496992.db2.gz LGSOPPOCKHNNCG-OALUTQOASA-N 1 3 345.531 2.559 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)CC1 ZINC000371819781 477511571 /nfs/dbraw/zinc/51/15/71/477511571.db2.gz ZCHXWHHGCJNWCQ-AEFFLSMTSA-N 1 3 344.503 2.548 10 0 EFAEHO CC(C)(C)CC(C)(C)[NH+]1CCC(NC[C@H](CO)[C@H]2CCOC2)CC1 ZINC000449301751 477533890 /nfs/dbraw/zinc/53/38/90/477533890.db2.gz SLEAULCBXSZIFH-DLBZAZTESA-N 1 3 340.552 2.900 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)C3(C4CCC4)CCC3)CC2)CC1 ZINC000455220443 477550952 /nfs/dbraw/zinc/55/09/52/477550952.db2.gz YNTSPOVRUZPLBQ-UHFFFAOYSA-N 1 3 333.520 2.632 10 0 EFAEHO CC[C@@H]1[C@@H](CO)CC[N@@H+]1Cc1ccccc1N(C)C1CCN(C)CC1 ZINC000449427082 477562753 /nfs/dbraw/zinc/56/27/53/477562753.db2.gz RUNZITDGWPXEAX-UYAOXDASSA-N 1 3 345.531 2.810 10 0 EFAEHO CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1ccccc1N(C)C1CCN(C)CC1 ZINC000449427082 477562758 /nfs/dbraw/zinc/56/27/58/477562758.db2.gz RUNZITDGWPXEAX-UYAOXDASSA-N 1 3 345.531 2.810 10 0 EFAEHO CCCNC(=O)c1cccc(C[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@H]32)c1 ZINC000367639251 477614087 /nfs/dbraw/zinc/61/40/87/477614087.db2.gz UNPFCWCTZNJEST-IPMKNSEASA-N 1 3 329.488 2.789 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCNC(=O)c2ccccc2Cl)[C@H]2CCC[C@H]21 ZINC000367750647 477672358 /nfs/dbraw/zinc/67/23/58/477672358.db2.gz BARAAAPENIOXHK-HYVNUMGLSA-N 1 3 335.879 2.532 10 0 EFAEHO C[N@H+]1CC[C@H](NCCNC(=O)c2ccccc2Cl)[C@H]2CCC[C@H]21 ZINC000367750647 477672362 /nfs/dbraw/zinc/67/23/62/477672362.db2.gz BARAAAPENIOXHK-HYVNUMGLSA-N 1 3 335.879 2.532 10 0 EFAEHO COc1ccc([C@H](CN)C[NH2+][C@]2(CO)C[C@@H](C)CC(C)(C)C2)cc1 ZINC000420304831 477678273 /nfs/dbraw/zinc/67/82/73/477678273.db2.gz ORZIDQMOJQVQAX-XAUMDUMWSA-N 1 3 334.504 2.904 10 0 EFAEHO CC(C)C[C@H]([NH2+]C[C@@H](C)c1ccc(F)cc1)C(=O)NCCN(C)C ZINC000437787892 477755591 /nfs/dbraw/zinc/75/55/91/477755591.db2.gz RYMQYBXOLSURMB-QAPCUYQASA-N 1 3 337.483 2.611 10 0 EFAEHO CC(C)[C@H]1CCN(CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000438501414 477853309 /nfs/dbraw/zinc/85/33/09/477853309.db2.gz MEZNEPMRAZBETK-FQEVSTJZSA-N 1 3 343.515 2.877 10 0 EFAEHO C[N@H+](CC1CC1)C[C@@H]1CCN([C@@H]2CCN(Cc3ccccc3)C2)C1 ZINC000459358742 477864024 /nfs/dbraw/zinc/86/40/24/477864024.db2.gz NDKCWVMOTFFIGM-LEWJYISDSA-N 1 3 327.516 2.925 10 0 EFAEHO C[N@@H+](CC1CC1)C[C@@H]1CCN([C@@H]2CCN(Cc3ccccc3)C2)C1 ZINC000459358742 477864032 /nfs/dbraw/zinc/86/40/32/477864032.db2.gz NDKCWVMOTFFIGM-LEWJYISDSA-N 1 3 327.516 2.925 10 0 EFAEHO Cc1nc2ccc(C[NH2+]CCCCN3CCN(C)CC3)cc2s1 ZINC000559083026 477956045 /nfs/dbraw/zinc/95/60/45/477956045.db2.gz GSTJHFSEULFIBD-UHFFFAOYSA-N 1 3 332.517 2.722 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)NCC1CCCCC1 ZINC000465445034 477977130 /nfs/dbraw/zinc/97/71/30/477977130.db2.gz SRMKONLEBPHTQB-GOSISDBHSA-N 1 3 338.540 2.624 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)NCC1CCCCC1 ZINC000465445034 477977134 /nfs/dbraw/zinc/97/71/34/477977134.db2.gz SRMKONLEBPHTQB-GOSISDBHSA-N 1 3 338.540 2.624 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)NCC2([NH+](C)C)CCCCCC2)CCN1C ZINC000465620608 477983077 /nfs/dbraw/zinc/98/30/77/477983077.db2.gz AGVDODCELQRBLG-SJORKVTESA-N 1 3 338.540 2.765 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000465873007 477991631 /nfs/dbraw/zinc/99/16/31/477991631.db2.gz KTKQMOUZYVGVQB-FGTMMUONSA-N 1 3 338.540 2.765 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000465873007 477991638 /nfs/dbraw/zinc/99/16/38/477991638.db2.gz KTKQMOUZYVGVQB-FGTMMUONSA-N 1 3 338.540 2.765 10 0 EFAEHO CC(C)C[C@H](NCc1cccc(C2CC2)c1)C(=O)NCC[NH+](C)C ZINC000421324747 478037240 /nfs/dbraw/zinc/03/72/40/478037240.db2.gz CHJBBDXRWIKJDT-IBGZPJMESA-N 1 3 331.504 2.746 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2C[C@@H](C)C[C@H](CO)C2)CC1 ZINC000421357894 478050133 /nfs/dbraw/zinc/05/01/33/478050133.db2.gz AGZVEYSRVHJVLI-OALUTQOASA-N 1 3 345.531 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2C[C@@H](C)C[C@H](CO)C2)CC1 ZINC000421357894 478050139 /nfs/dbraw/zinc/05/01/39/478050139.db2.gz AGZVEYSRVHJVLI-OALUTQOASA-N 1 3 345.531 2.669 10 0 EFAEHO COC[C@H](C)C[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000560598566 478116679 /nfs/dbraw/zinc/11/66/79/478116679.db2.gz VQDFVHSNAJXZLR-QUCCMNQESA-N 1 3 346.515 2.787 10 0 EFAEHO CCN(C(=O)CC[NH2+]C1CC1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000517755990 478120872 /nfs/dbraw/zinc/12/08/72/478120872.db2.gz CCFRDRHVEVLXFS-LPHOPBHVSA-N 1 3 329.488 2.813 10 0 EFAEHO CC(CN(C)[C@]1(CO)CC[C@H](C)C1)C[N@H+](C)[C@]1(CO)CC[C@H](C)C1 ZINC000495194389 478138802 /nfs/dbraw/zinc/13/88/02/478138802.db2.gz LVIDPVCTNHMVNC-RAUXBKROSA-N 1 3 340.552 2.588 10 0 EFAEHO CC(CN(C)[C@]1(CO)CC[C@H](C)C1)C[N@@H+](C)[C@]1(CO)CC[C@H](C)C1 ZINC000495194389 478138807 /nfs/dbraw/zinc/13/88/07/478138807.db2.gz LVIDPVCTNHMVNC-RAUXBKROSA-N 1 3 340.552 2.588 10 0 EFAEHO Clc1cccc(-n2cc(CNCC[C@H]3CC[NH2+]C3)nn2)c1Cl ZINC000560944289 478142145 /nfs/dbraw/zinc/14/21/45/478142145.db2.gz HUNYIRHSCCSDHE-LLVKDONJSA-N 1 3 340.258 2.663 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000561291367 478174733 /nfs/dbraw/zinc/17/47/33/478174733.db2.gz ADJXGXTXAVNZQL-MOPGFXCFSA-N 1 3 331.504 2.601 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000561291367 478174740 /nfs/dbraw/zinc/17/47/40/478174740.db2.gz ADJXGXTXAVNZQL-MOPGFXCFSA-N 1 3 331.504 2.601 10 0 EFAEHO O=C(NCC[NH+]1CCC2(CCCCC2)CC1)N[C@@H]1CCN(C2CC2)C1 ZINC000441000973 478186265 /nfs/dbraw/zinc/18/62/65/478186265.db2.gz BWSHURZYMQADEB-QGZVFWFLSA-N 1 3 348.535 2.569 10 0 EFAEHO CC(C)[N@H+](C)CCNC(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000488916109 478200268 /nfs/dbraw/zinc/20/02/68/478200268.db2.gz VAKMZYPKXUHTAT-FQEVSTJZSA-N 1 3 346.519 2.681 10 0 EFAEHO CC(C)[N@@H+](C)CCNC(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000488916109 478200270 /nfs/dbraw/zinc/20/02/70/478200270.db2.gz VAKMZYPKXUHTAT-FQEVSTJZSA-N 1 3 346.519 2.681 10 0 EFAEHO C[C@H]1C[C@H](C[NH3+])CN1C(=O)NCc1ccccc1CN1CCCCC1 ZINC000570146886 478293070 /nfs/dbraw/zinc/29/30/70/478293070.db2.gz ZJAGEFLZSFQCKR-DLBZAZTESA-N 1 3 344.503 2.551 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)N1CCC[N@@H+](C(C)(C)C)CC1 ZINC000594310440 478327954 /nfs/dbraw/zinc/32/79/54/478327954.db2.gz FKRGPGVMJPHRTK-CALCHBBNSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)N1CCC[N@H+](C(C)(C)C)CC1 ZINC000594310440 478327962 /nfs/dbraw/zinc/32/79/62/478327962.db2.gz FKRGPGVMJPHRTK-CALCHBBNSA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1CN(C(=O)NCC2([NH3+])CCCCCC2)CCN(C2CCC2)C1 ZINC000579572539 478329803 /nfs/dbraw/zinc/32/98/03/478329803.db2.gz XJAMXZHKFXUZBJ-INIZCTEOSA-N 1 3 336.524 2.554 10 0 EFAEHO CC[NH2+]CCCNC(=O)N(CC)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000562814269 478358986 /nfs/dbraw/zinc/35/89/86/478358986.db2.gz OLHMBBRTJGNJIN-MJGOQNOKSA-N 1 3 346.519 2.853 10 0 EFAEHO COC(=O)c1ccc2c(c1)[C@H](NC[C@@H]1CC[N@@H+](C3CC3)C1)CCC2 ZINC000594495457 478410451 /nfs/dbraw/zinc/41/04/51/478410451.db2.gz YFBXJQOGBFNWMW-IFXJQAMLSA-N 1 3 328.456 2.925 10 0 EFAEHO COC(=O)c1ccc2c(c1)[C@H](NC[C@@H]1CC[N@H+](C3CC3)C1)CCC2 ZINC000594495457 478410457 /nfs/dbraw/zinc/41/04/57/478410457.db2.gz YFBXJQOGBFNWMW-IFXJQAMLSA-N 1 3 328.456 2.925 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@@H](C)C3CCCC3)CC2)CC1 ZINC000581676552 478419095 /nfs/dbraw/zinc/41/90/95/478419095.db2.gz AMXDEKPONPMBSF-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN1CC[C@H]([N@H+](C)Cc2ccc(-n3cncn3)c(F)c2)[C@H](C)C1 ZINC000539818235 478443630 /nfs/dbraw/zinc/44/36/30/478443630.db2.gz LLYVFRUEQMGIHG-PBHICJAKSA-N 1 3 331.439 2.569 10 0 EFAEHO CCN1CC[C@H]([N@@H+](C)Cc2ccc(-n3cncn3)c(F)c2)[C@H](C)C1 ZINC000539818235 478443634 /nfs/dbraw/zinc/44/36/34/478443634.db2.gz LLYVFRUEQMGIHG-PBHICJAKSA-N 1 3 331.439 2.569 10 0 EFAEHO C[C@H]1CN(Cc2ccnc3ccccc23)CC[C@H]1[NH+]1CCN(C)CC1 ZINC000539823371 478443712 /nfs/dbraw/zinc/44/37/12/478443712.db2.gz FCFJLFDGGAJTNJ-LAUBAEHRSA-N 1 3 338.499 2.693 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCCC1)NCC1CC[NH+](C2CC2)CC1 ZINC000527881993 478559204 /nfs/dbraw/zinc/55/92/04/478559204.db2.gz PQWYLDVXRWZHEI-IBGZPJMESA-N 1 3 348.535 2.567 10 0 EFAEHO [NH3+]C1(CNC(=O)N2CCC[C@H]2CN2CCCCC2)CCCCCC1 ZINC000563595166 478595085 /nfs/dbraw/zinc/59/50/85/478595085.db2.gz OEWHISZLTDFFRJ-KRWDZBQOSA-N 1 3 336.524 2.698 10 0 EFAEHO CCCN1CCN(c2ccccc2CNC[C@H](C)C[NH+](C)C)CC1 ZINC000491588306 478596502 /nfs/dbraw/zinc/59/65/02/478596502.db2.gz GWYRRZBAUGGIEC-SFHVURJKSA-N 1 3 332.536 2.506 10 0 EFAEHO CCCN1CC[C@@H](C[NH2+]C[C@H](O)COc2ccccc2C(C)C)C1 ZINC000563618608 478603311 /nfs/dbraw/zinc/60/33/11/478603311.db2.gz YLOXWIGCGQBOGL-ROUUACIJSA-N 1 3 334.504 2.871 10 0 EFAEHO C[C@H](CSCCF)[NH2+]Cc1ccc(CN2CCC(O)CC2)cc1 ZINC000595010386 478627738 /nfs/dbraw/zinc/62/77/38/478627738.db2.gz HNPKOADHJIBQMF-OAHLLOKOSA-N 1 3 340.508 2.824 10 0 EFAEHO C[C@H](CSCCF)[NH2+]Cc1ccccc1CN1CCC(O)CC1 ZINC000595011870 478628072 /nfs/dbraw/zinc/62/80/72/478628072.db2.gz JYWDZGLXKLTGGC-OAHLLOKOSA-N 1 3 340.508 2.824 10 0 EFAEHO C[C@@H](CSCCF)[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000595051208 478641903 /nfs/dbraw/zinc/64/19/03/478641903.db2.gz LQJCTJXZQNFXMC-INIZCTEOSA-N 1 3 340.508 2.694 10 0 EFAEHO CC[NH+](CC)[C@@H]1CCN(C(=O)NC[C@H]2CCN2C2CCCCC2)C1 ZINC000528146443 478655922 /nfs/dbraw/zinc/65/59/22/478655922.db2.gz ADRXITJMERDQEL-QZTJIDSGSA-N 1 3 336.524 2.519 10 0 EFAEHO C[N@@H+]1CCCC[C@H]1CN1CCN(C[C@H]2CCc3ccccc3C2)CC1 ZINC000542916119 478707931 /nfs/dbraw/zinc/70/79/31/478707931.db2.gz WSFHYISJJNMQKK-UGKGYDQZSA-N 1 3 341.543 2.893 10 0 EFAEHO C[N@H+]1CCCC[C@H]1CN1CCN(C[C@H]2CCc3ccccc3C2)CC1 ZINC000542916119 478707937 /nfs/dbraw/zinc/70/79/37/478707937.db2.gz WSFHYISJJNMQKK-UGKGYDQZSA-N 1 3 341.543 2.893 10 0 EFAEHO CC1CCC(N2CCN(C(=O)c3ccccc3CC[NH3+])CC2)CC1 ZINC000572053140 478739115 /nfs/dbraw/zinc/73/91/15/478739115.db2.gz IXTFPJXMKMYTJG-UHFFFAOYSA-N 1 3 329.488 2.524 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@H](O)CC2(O)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000528399739 478752131 /nfs/dbraw/zinc/75/21/31/478752131.db2.gz XJESIPCIYBMHNQ-MISYRCLQSA-N 1 3 346.515 2.637 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C[C@H](O)CC2(O)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000528399739 478752138 /nfs/dbraw/zinc/75/21/38/478752138.db2.gz XJESIPCIYBMHNQ-MISYRCLQSA-N 1 3 346.515 2.637 10 0 EFAEHO CCC[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(=O)N[C@H]1CCCN(C)C1 ZINC000528439433 478777485 /nfs/dbraw/zinc/77/74/85/478777485.db2.gz VTRGGXVDPNFJBN-HSALFYBXSA-N 1 3 343.515 2.745 10 0 EFAEHO CCC[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)N[C@H]1CCCN(C)C1 ZINC000528439433 478777491 /nfs/dbraw/zinc/77/74/91/478777491.db2.gz VTRGGXVDPNFJBN-HSALFYBXSA-N 1 3 343.515 2.745 10 0 EFAEHO CN(C)[C@H](CNC(=O)[C@H]1CCCCCC[C@@H]1[NH3+])Cc1ccccc1 ZINC000564889481 478849672 /nfs/dbraw/zinc/84/96/72/478849672.db2.gz DMXDWDMIXSZNMR-FHWLQOOXSA-N 1 3 331.504 2.573 10 0 EFAEHO CC(C)[N@H+](C)CC1CCN(Cc2cc(-c3cnn(C)c3)no2)CC1 ZINC000545268046 478912226 /nfs/dbraw/zinc/91/22/26/478912226.db2.gz GFWXFZMXUDYUKC-UHFFFAOYSA-N 1 3 331.464 2.627 10 0 EFAEHO CC(C)[N@@H+](C)CC1CCN(Cc2cc(-c3cnn(C)c3)no2)CC1 ZINC000545268046 478912232 /nfs/dbraw/zinc/91/22/32/478912232.db2.gz GFWXFZMXUDYUKC-UHFFFAOYSA-N 1 3 331.464 2.627 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@H]1CCc2cnn(C(C)C)c2C1 ZINC000572951483 478957016 /nfs/dbraw/zinc/95/70/16/478957016.db2.gz ZOORGOVHWHMXQC-CJNGLKHVSA-N 1 3 327.476 2.834 10 0 EFAEHO CCN(C(=O)N[C@@H](C)C[NH+](C)C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000512427029 478997943 /nfs/dbraw/zinc/99/79/43/478997943.db2.gz PMIBJIXSMOGOAC-JENIJYKNSA-N 1 3 346.519 2.804 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H]2CCOC[C@H]2C)CC1 ZINC000512884631 479006020 /nfs/dbraw/zinc/00/60/20/479006020.db2.gz GJHRPQLBXOZBBM-RTBURBONSA-N 1 3 345.531 2.981 10 0 EFAEHO COC(=O)[C@H](C)[C@H](NCc1cccc2c1CC[NH2+]C2)c1ccccc1 ZINC000595889959 479055071 /nfs/dbraw/zinc/05/50/71/479055071.db2.gz ANANTRLTRSEITN-QRWLVFNGSA-N 1 3 338.451 2.972 10 0 EFAEHO CC(C)CC[C@@H]1CCC[C@@H]1[NH2+]CC(=O)NC1CCN(C2CC2)CC1 ZINC000493637586 479093212 /nfs/dbraw/zinc/09/32/12/479093212.db2.gz YXTVXKAPUUFHLE-LPHOPBHVSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)(CNC(=O)N1CCc2ccccc2[C@@H]1CN)[NH+]1CCCCC1 ZINC000514935876 479093541 /nfs/dbraw/zinc/09/35/41/479093541.db2.gz GKKVXQDVAWLHPB-SFHVURJKSA-N 1 3 344.503 2.519 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)N1CC2CCC1(C[NH3+])CC2 ZINC000573574478 479097103 /nfs/dbraw/zinc/09/71/03/479097103.db2.gz JTOZUNFDJCRMSA-UHFFFAOYSA-N 1 3 341.455 2.838 10 0 EFAEHO OCC1(NCC2CC2)CC[NH+](C[C@@H]2CCc3ccccc3C2)CC1 ZINC000573614445 479104519 /nfs/dbraw/zinc/10/45/19/479104519.db2.gz IQWWESOHVBOKGO-GOSISDBHSA-N 1 3 328.500 2.618 10 0 EFAEHO CCCN(CCN1CCCCCC1)C(=O)N[C@H]1CC[NH2+]C12CCC2 ZINC000529350879 479133148 /nfs/dbraw/zinc/13/31/48/479133148.db2.gz LSBLBNQRMHXFCO-KRWDZBQOSA-N 1 3 336.524 2.569 10 0 EFAEHO C[C@H]([NH2+]CCCN1CCN(c2ccncc2)CC1)C1CC(F)(F)C1 ZINC000529537277 479199283 /nfs/dbraw/zinc/19/92/83/479199283.db2.gz CZBQGLJRIGQNCA-HNNXBMFYSA-N 1 3 338.446 2.617 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@@H]3CC[C@H]4C[C@H]4C3)CC2)CC1 ZINC000529575030 479210951 /nfs/dbraw/zinc/21/09/51/479210951.db2.gz HNUDNWLWVUXQSB-NZSAHSFTSA-N 1 3 347.547 2.735 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@@H]3CC[C@@H]4C[C@@H]4C3)CC2)CC1 ZINC000529575032 479210978 /nfs/dbraw/zinc/21/09/78/479210978.db2.gz HNUDNWLWVUXQSB-QRQLOZEOSA-N 1 3 347.547 2.735 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCCC1)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC000529722079 479270388 /nfs/dbraw/zinc/27/03/88/479270388.db2.gz GFZXZAWFJCKLBZ-MOPGFXCFSA-N 1 3 333.520 2.917 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCCC1)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC000529722079 479270394 /nfs/dbraw/zinc/27/03/94/479270394.db2.gz GFZXZAWFJCKLBZ-MOPGFXCFSA-N 1 3 333.520 2.917 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCCC1)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC000529722081 479270521 /nfs/dbraw/zinc/27/05/21/479270521.db2.gz GFZXZAWFJCKLBZ-RBUKOAKNSA-N 1 3 333.520 2.917 10 0 EFAEHO O=C(NC[C@@H]1CCN1C1CCCCC1)[C@H]1CCC[N@H+]1C1CCCC1 ZINC000529722081 479270527 /nfs/dbraw/zinc/27/05/27/479270527.db2.gz GFZXZAWFJCKLBZ-RBUKOAKNSA-N 1 3 333.520 2.917 10 0 EFAEHO N[C@@H]1CCC[C@H]([NH2+]CCc2ccc(I)cc2)C1 ZINC000596653482 479373842 /nfs/dbraw/zinc/37/38/42/479373842.db2.gz KYRFOAFJXIMDTM-KGLIPLIRSA-N 1 3 344.240 2.693 10 0 EFAEHO [NH3+][C@@H]1CCC[C@H](NCCc2ccc(I)cc2)C1 ZINC000596653482 479373846 /nfs/dbraw/zinc/37/38/46/479373846.db2.gz KYRFOAFJXIMDTM-KGLIPLIRSA-N 1 3 344.240 2.693 10 0 EFAEHO N[C@H]1CCC[C@@H]([NH2+]CCc2ccc(I)cc2)C1 ZINC000596653483 479373783 /nfs/dbraw/zinc/37/37/83/479373783.db2.gz KYRFOAFJXIMDTM-UONOGXRCSA-N 1 3 344.240 2.693 10 0 EFAEHO [NH3+][C@H]1CCC[C@@H](NCCc2ccc(I)cc2)C1 ZINC000596653483 479373790 /nfs/dbraw/zinc/37/37/90/479373790.db2.gz KYRFOAFJXIMDTM-UONOGXRCSA-N 1 3 344.240 2.693 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC[C@@H]3CCC[C@H]4C[C@H]43)CC2)CC1 ZINC000618499694 479470861 /nfs/dbraw/zinc/47/08/61/479470861.db2.gz PXXGHEKTIXAPKY-CMKODMSKSA-N 1 3 347.547 2.735 10 0 EFAEHO CC[C@@H](C[NH+]1CCCC1)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000605374367 479638477 /nfs/dbraw/zinc/63/84/77/479638477.db2.gz XXVVARMCXDMHBU-IBGZPJMESA-N 1 3 329.488 2.887 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(CC)Cc2ccc(CN(C)C)cc2)CC[N@@H+]1C ZINC000630905345 479771154 /nfs/dbraw/zinc/77/11/54/479771154.db2.gz RWAPNZJVMMJCDB-RBUKOAKNSA-N 1 3 331.504 2.827 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(CC)Cc2ccc(CN(C)C)cc2)CC[N@H+]1C ZINC000630905345 479771161 /nfs/dbraw/zinc/77/11/61/479771161.db2.gz RWAPNZJVMMJCDB-RBUKOAKNSA-N 1 3 331.504 2.827 10 0 EFAEHO CC[NH+]1CCN(Cc2ccccc2CNCc2oc(C)nc2C)CC1 ZINC000628203748 479811808 /nfs/dbraw/zinc/81/18/08/479811808.db2.gz VCRNTHHFXOIDOQ-UHFFFAOYSA-N 1 3 342.487 2.719 10 0 EFAEHO Cc1cc(CNCCCC[NH+]2CCN(c3cccc(C)c3)CC2)on1 ZINC000631038463 479849676 /nfs/dbraw/zinc/84/96/76/479849676.db2.gz XYOAQWIGOLKSNQ-UHFFFAOYSA-N 1 3 342.487 2.983 10 0 EFAEHO CN1CCN(CCCC[NH2+]Cc2ccc(CC(F)(F)F)cc2)CC1 ZINC000631041104 479852935 /nfs/dbraw/zinc/85/29/35/479852935.db2.gz NOMONTRRRANNCN-UHFFFAOYSA-N 1 3 343.437 2.909 10 0 EFAEHO c1ccc2nc(CNCC3CC[NH+](C4CCOCC4)CC3)cnc2c1 ZINC000628336488 479864111 /nfs/dbraw/zinc/86/41/11/479864111.db2.gz INRKFBWZUJCCBT-UHFFFAOYSA-N 1 3 340.471 2.610 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCN(Cc3ccccc3)CC[C@H]2C)CC[N@@H+]1C ZINC000631597351 480174056 /nfs/dbraw/zinc/17/40/56/480174056.db2.gz SIWNLLFJPHGNKI-YZGWKJHDSA-N 1 3 343.515 2.840 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCN(Cc3ccccc3)CC[C@H]2C)CC[N@H+]1C ZINC000631597351 480174062 /nfs/dbraw/zinc/17/40/62/480174062.db2.gz SIWNLLFJPHGNKI-YZGWKJHDSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@H](N[C@@H](C)[C@@H](O)C(F)(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000631716741 480235537 /nfs/dbraw/zinc/23/55/37/480235537.db2.gz BXENEBYLTJLDPJ-SLEUVZQESA-N 1 3 334.382 2.589 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@@H](c2ccccc2)N2CCOCC2)CC1(C)C ZINC000623346324 480243211 /nfs/dbraw/zinc/24/32/11/480243211.db2.gz MQRDBNPIOZKJNV-OALUTQOASA-N 1 3 331.504 2.522 10 0 EFAEHO Cc1cc(C[NH2+]CC2(N)CCOCC2)ccc1Oc1cccnc1 ZINC000629387108 480243381 /nfs/dbraw/zinc/24/33/81/480243381.db2.gz BTNPJYUPWNCURJ-UHFFFAOYSA-N 1 3 327.428 2.780 10 0 EFAEHO CN1CC[C@@H]([NH2+]CCCN2CCN(c3ccccc3)CC2)CC1(C)C ZINC000623348515 480244691 /nfs/dbraw/zinc/24/46/91/480244691.db2.gz AVZVOSATHTUFEO-LJQANCHMSA-N 1 3 344.547 2.661 10 0 EFAEHO CCC1(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)CCC(F)(F)CC1 ZINC000617502621 480245542 /nfs/dbraw/zinc/24/55/42/480245542.db2.gz WHWCILRSFAKDCV-HNNXBMFYSA-N 1 3 347.494 2.980 10 0 EFAEHO CCC1(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)CCC(F)(F)CC1 ZINC000617502621 480245547 /nfs/dbraw/zinc/24/55/47/480245547.db2.gz WHWCILRSFAKDCV-HNNXBMFYSA-N 1 3 347.494 2.980 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C(C)(C)Cc1ccccc1 ZINC000617505869 480246326 /nfs/dbraw/zinc/24/63/26/480246326.db2.gz SUTIJOKGRCZRLX-KRWDZBQOSA-N 1 3 333.520 2.644 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C(C)(C)Cc1ccccc1 ZINC000617505869 480246337 /nfs/dbraw/zinc/24/63/37/480246337.db2.gz SUTIJOKGRCZRLX-KRWDZBQOSA-N 1 3 333.520 2.644 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C1(c2ccccc2)CCCC1 ZINC000617504117 480246695 /nfs/dbraw/zinc/24/66/95/480246695.db2.gz HPRMSSIETMSVCL-SFHVURJKSA-N 1 3 345.531 2.887 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C1(c2ccccc2)CCCC1 ZINC000617504117 480246700 /nfs/dbraw/zinc/24/67/00/480246700.db2.gz HPRMSSIETMSVCL-SFHVURJKSA-N 1 3 345.531 2.887 10 0 EFAEHO CCc1ccc([C@@H](C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000617505663 480246826 /nfs/dbraw/zinc/24/68/26/480246826.db2.gz LXWYCABHOCEVRE-DLBZAZTESA-N 1 3 333.520 2.741 10 0 EFAEHO CCc1ccc([C@@H](C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000617505663 480246829 /nfs/dbraw/zinc/24/68/29/480246829.db2.gz LXWYCABHOCEVRE-DLBZAZTESA-N 1 3 333.520 2.741 10 0 EFAEHO Cc1[nH]c2ccc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc2c1C ZINC000617503339 480246938 /nfs/dbraw/zinc/24/69/38/480246938.db2.gz FIJBSVXOWPCBFY-AWEZNQCLSA-N 1 3 344.503 2.787 10 0 EFAEHO Cc1[nH]c2ccc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc2c1C ZINC000617503339 480246942 /nfs/dbraw/zinc/24/69/42/480246942.db2.gz FIJBSVXOWPCBFY-AWEZNQCLSA-N 1 3 344.503 2.787 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C1(c2ccc(F)cc2)CCC1 ZINC000617504133 480247855 /nfs/dbraw/zinc/24/78/55/480247855.db2.gz IBCRIJPYMBBJSK-INIZCTEOSA-N 1 3 349.494 2.636 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C1(c2ccc(F)cc2)CCC1 ZINC000617504133 480247860 /nfs/dbraw/zinc/24/78/60/480247860.db2.gz IBCRIJPYMBBJSK-INIZCTEOSA-N 1 3 349.494 2.636 10 0 EFAEHO Cc1cccc([C@H](C[NH2+][C@H]2CCN(C)C(C)(C)C2)N2CCOCC2)c1 ZINC000623356718 480248763 /nfs/dbraw/zinc/24/87/63/480248763.db2.gz BVGYQSPTLJKQJS-PMACEKPBSA-N 1 3 345.531 2.831 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccc(F)cc1 ZINC000617506923 480249181 /nfs/dbraw/zinc/24/91/81/480249181.db2.gz CKAIZMAFLJZQLX-MAUKXSAKSA-N 1 3 337.483 2.708 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccc(F)cc1 ZINC000617506923 480249183 /nfs/dbraw/zinc/24/91/83/480249183.db2.gz CKAIZMAFLJZQLX-MAUKXSAKSA-N 1 3 337.483 2.708 10 0 EFAEHO C[C@@H]1CN(c2ccc(C[NH2+][C@H]3CCN(C)C(C)(C)C3)cn2)C[C@@H](C)O1 ZINC000623358129 480249242 /nfs/dbraw/zinc/24/92/42/480249242.db2.gz PASWMDSQTOKUHM-NUJGCVRESA-N 1 3 346.519 2.658 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cc(F)c(Cl)cc1F ZINC000617506491 480249675 /nfs/dbraw/zinc/24/96/75/480249675.db2.gz PHUSVFDTFARACK-NSHDSACASA-N 1 3 347.837 2.620 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cc(F)c(Cl)cc1F ZINC000617506491 480249678 /nfs/dbraw/zinc/24/96/78/480249678.db2.gz PHUSVFDTFARACK-NSHDSACASA-N 1 3 347.837 2.620 10 0 EFAEHO Cc1oc2ccccc2c1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617507017 480250514 /nfs/dbraw/zinc/25/05/14/480250514.db2.gz FNQRYAIVEPOYCI-AWEZNQCLSA-N 1 3 331.460 2.743 10 0 EFAEHO Cc1oc2ccccc2c1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617507017 480250523 /nfs/dbraw/zinc/25/05/23/480250523.db2.gz FNQRYAIVEPOYCI-AWEZNQCLSA-N 1 3 331.460 2.743 10 0 EFAEHO Cc1oc2ccccc2c1CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617507328 480250545 /nfs/dbraw/zinc/25/05/45/480250545.db2.gz RSJHGGYYLWOSDF-HNNXBMFYSA-N 1 3 345.487 2.672 10 0 EFAEHO Cc1oc2ccccc2c1CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617507328 480250551 /nfs/dbraw/zinc/25/05/51/480250551.db2.gz RSJHGGYYLWOSDF-HNNXBMFYSA-N 1 3 345.487 2.672 10 0 EFAEHO Cc1ccc([C@H](C[NH2+][C@@H]2CCN(C)C(C)(C)C2)N2CCOCC2)cc1 ZINC000623364149 480250924 /nfs/dbraw/zinc/25/09/24/480250924.db2.gz VPNHQCVEAIXIFQ-UXHICEINSA-N 1 3 345.531 2.831 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(C2CCC2)cc1 ZINC000617507387 480251404 /nfs/dbraw/zinc/25/14/04/480251404.db2.gz UQTMQZGQWMWNRU-INIZCTEOSA-N 1 3 331.504 2.956 10 0 EFAEHO Cc1ccc([C@@H](C[NH2+][C@@H]2CCN(C)C(C)(C)C2)N2CCOCC2)cc1 ZINC000623364151 480251355 /nfs/dbraw/zinc/25/13/55/480251355.db2.gz VPNHQCVEAIXIFQ-WOJBJXKFSA-N 1 3 345.531 2.831 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(C2CCC2)cc1 ZINC000617507387 480251409 /nfs/dbraw/zinc/25/14/09/480251409.db2.gz UQTMQZGQWMWNRU-INIZCTEOSA-N 1 3 331.504 2.956 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C1(Cc2ccccc2)CCC1 ZINC000617506711 480251707 /nfs/dbraw/zinc/25/17/07/480251707.db2.gz WVHLPZZPUSTDBH-SFHVURJKSA-N 1 3 345.531 2.788 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C1(Cc2ccccc2)CCC1 ZINC000617506711 480251713 /nfs/dbraw/zinc/25/17/13/480251713.db2.gz WVHLPZZPUSTDBH-SFHVURJKSA-N 1 3 345.531 2.788 10 0 EFAEHO Cc1ccc(C[C@@H](C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000617506604 480251846 /nfs/dbraw/zinc/25/18/46/480251846.db2.gz SRDXTYMRHXMOOS-MSOLQXFVSA-N 1 3 333.520 2.562 10 0 EFAEHO Cc1ccc(C[C@@H](C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000617506604 480251851 /nfs/dbraw/zinc/25/18/51/480251851.db2.gz SRDXTYMRHXMOOS-MSOLQXFVSA-N 1 3 333.520 2.562 10 0 EFAEHO COc1ccc(CCN[C@@H]2CC[N@H+](C)C(C)(C)C2)c(OC)c1OC ZINC000623398594 480264355 /nfs/dbraw/zinc/26/43/55/480264355.db2.gz KFNYMMRRZQILBH-OAHLLOKOSA-N 1 3 336.476 2.717 10 0 EFAEHO COc1ccc(CCN[C@@H]2CC[N@@H+](C)C(C)(C)C2)c(OC)c1OC ZINC000623398594 480264357 /nfs/dbraw/zinc/26/43/57/480264357.db2.gz KFNYMMRRZQILBH-OAHLLOKOSA-N 1 3 336.476 2.717 10 0 EFAEHO CCN(C(=O)c1ccc(OCC[NH+](CC)CC)cc1)[C@H]1CCN(C)C1 ZINC000617558047 480279035 /nfs/dbraw/zinc/27/90/35/480279035.db2.gz YYUZVKNNPACEPZ-SFHVURJKSA-N 1 3 347.503 2.573 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCC([C@@H]2CCC[NH2+]2)CC1)c1ccccc1 ZINC000631827386 480288788 /nfs/dbraw/zinc/28/87/88/480288788.db2.gz NHBMXYQGVSWQKU-MDZRGWNJSA-N 1 3 329.488 2.716 10 0 EFAEHO C[C@@H](NC(=O)[C@H](C)N1CCC[C@@H](C2CC[NH2+]CC2)C1)c1ccccc1 ZINC000631829603 480288904 /nfs/dbraw/zinc/28/89/04/480288904.db2.gz VUSWCIDTXRLSFZ-FUHIMQAGSA-N 1 3 343.515 2.964 10 0 EFAEHO C[C@H](Cc1ccc(F)cc1Br)NCC1([NH3+])CCOCC1 ZINC000629518663 480291868 /nfs/dbraw/zinc/29/18/68/480291868.db2.gz AOFYXXQLGJDIFK-LLVKDONJSA-N 1 3 345.256 2.617 10 0 EFAEHO Cc1cc(Br)cc2c1[C@H]([NH2+]CC1(N)CCOCC1)CC2 ZINC000629522289 480293688 /nfs/dbraw/zinc/29/36/88/480293688.db2.gz ZEVLDFGJWXHIMI-CQSZACIVSA-N 1 3 339.277 2.842 10 0 EFAEHO NC1(C[NH2+][C@@H](c2ccc(Br)cc2)C2CC2)CCOCC1 ZINC000629524055 480294699 /nfs/dbraw/zinc/29/46/99/480294699.db2.gz KFWHVUWDUJJRIX-OAHLLOKOSA-N 1 3 339.277 2.998 10 0 EFAEHO C[NH2+]CCOCCN[C@H](c1ccc(Br)s1)C1CC1 ZINC000629530656 480296184 /nfs/dbraw/zinc/29/61/84/480296184.db2.gz MXFMKACCRBZNLZ-ZDUSSCGKSA-N 1 3 333.295 2.787 10 0 EFAEHO C[NH2+]CCOCCN[C@H]1CCc2cc(Br)cc(C)c21 ZINC000629530868 480296396 /nfs/dbraw/zinc/29/63/96/480296396.db2.gz TXEDVZMFCBNLOB-AWEZNQCLSA-N 1 3 327.266 2.570 10 0 EFAEHO [NH3+]C[C@@H](Cc1ccccc1)[C@@H]1CCCCN1CCOC1CCOCC1 ZINC000629527651 480296607 /nfs/dbraw/zinc/29/66/07/480296607.db2.gz BMCRQYHUPIDMBD-CTNGQTDRSA-N 1 3 346.515 2.854 10 0 EFAEHO NC[C@@H](Cc1ccccc1)[C@@H]1CCCC[N@@H+]1CCOC1CCOCC1 ZINC000629527651 480296610 /nfs/dbraw/zinc/29/66/10/480296610.db2.gz BMCRQYHUPIDMBD-CTNGQTDRSA-N 1 3 346.515 2.854 10 0 EFAEHO NC[C@@H](Cc1ccccc1)[C@@H]1CCCC[N@H+]1CCOC1CCOCC1 ZINC000629527651 480296613 /nfs/dbraw/zinc/29/66/13/480296613.db2.gz BMCRQYHUPIDMBD-CTNGQTDRSA-N 1 3 346.515 2.854 10 0 EFAEHO [NH3+]C[C@H](Cc1ccccc1)[C@H]1CCCCN1CCOC1CCOCC1 ZINC000629527653 480296839 /nfs/dbraw/zinc/29/68/39/480296839.db2.gz BMCRQYHUPIDMBD-PZJWPPBQSA-N 1 3 346.515 2.854 10 0 EFAEHO NC[C@H](Cc1ccccc1)[C@H]1CCCC[N@@H+]1CCOC1CCOCC1 ZINC000629527653 480296843 /nfs/dbraw/zinc/29/68/43/480296843.db2.gz BMCRQYHUPIDMBD-PZJWPPBQSA-N 1 3 346.515 2.854 10 0 EFAEHO NC[C@H](Cc1ccccc1)[C@H]1CCCC[N@H+]1CCOC1CCOCC1 ZINC000629527653 480296848 /nfs/dbraw/zinc/29/68/48/480296848.db2.gz BMCRQYHUPIDMBD-PZJWPPBQSA-N 1 3 346.515 2.854 10 0 EFAEHO C[NH2+]CCOCCN[C@H]1CCSc2ccc(Br)cc21 ZINC000629529044 480296988 /nfs/dbraw/zinc/29/69/88/480296988.db2.gz QHDYUDFWRLVMEV-ZDUSSCGKSA-N 1 3 345.306 2.812 10 0 EFAEHO C[C@H]1C[C@@H](NCCOCCC[NH3+])c2cccc(Br)c21 ZINC000629538668 480297831 /nfs/dbraw/zinc/29/78/31/480297831.db2.gz MTMFJPFSEJRZBI-SMDDNHRTSA-N 1 3 327.266 2.952 10 0 EFAEHO CC[C@@H](NCCOCCC[NH3+])c1cc(F)cc(Br)c1 ZINC000629536024 480298712 /nfs/dbraw/zinc/29/87/12/480298712.db2.gz DZEMPNOQMSSOBI-CQSZACIVSA-N 1 3 333.245 2.994 10 0 EFAEHO O[C@H](C[NH2+]C1CC(F)(c2cccc(Cl)c2)C1)CN1CCCC1 ZINC000629579615 480314591 /nfs/dbraw/zinc/31/45/91/480314591.db2.gz VEIRKOQOMVRWER-AQFXKWCLSA-N 1 3 326.843 2.714 10 0 EFAEHO CN1CC[C@@H]([NH2+]C[C@@H]2CN(Cc3ccccc3)CCCO2)CC1(C)C ZINC000623507257 480318946 /nfs/dbraw/zinc/31/89/46/480318946.db2.gz AQQAWNYDMSFDEJ-WOJBJXKFSA-N 1 3 345.531 2.740 10 0 EFAEHO C[NH2+]CCOCCN(C)Cc1ccc(Cl)c(Br)c1 ZINC000629653598 480345327 /nfs/dbraw/zinc/34/53/27/480345327.db2.gz KMIJRRZFLYEZQH-UHFFFAOYSA-N 1 3 335.673 2.770 10 0 EFAEHO NCC(=O)N1CCC[C@@H](C[NH2+][C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000629663754 480349625 /nfs/dbraw/zinc/34/96/25/480349625.db2.gz IWTFHMIEVCSKNK-GUYCJALGSA-N 1 3 335.879 2.504 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)NC[C@H]1CCN1C1CCCC1 ZINC000623584514 480350033 /nfs/dbraw/zinc/35/00/33/480350033.db2.gz IMIBVWAQLYJZAQ-SOLBZPMBSA-N 1 3 336.524 2.565 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NC[C@H]1CCN1C1CCCC1 ZINC000623584514 480350039 /nfs/dbraw/zinc/35/00/39/480350039.db2.gz IMIBVWAQLYJZAQ-SOLBZPMBSA-N 1 3 336.524 2.565 10 0 EFAEHO c1cc(C[NH2+]C[C@@H]2CCN2C2CCCCC2)n(-c2ccncc2)n1 ZINC000623614892 480363163 /nfs/dbraw/zinc/36/31/63/480363163.db2.gz FEMOWEGBCDOHIK-SFHVURJKSA-N 1 3 325.460 2.764 10 0 EFAEHO c1cc(CNC[C@@H]2CC[N@@H+]2C2CCCCC2)n(-c2ccncc2)n1 ZINC000623614892 480363168 /nfs/dbraw/zinc/36/31/68/480363168.db2.gz FEMOWEGBCDOHIK-SFHVURJKSA-N 1 3 325.460 2.764 10 0 EFAEHO c1cc(CNC[C@@H]2CC[N@H+]2C2CCCCC2)n(-c2ccncc2)n1 ZINC000623614892 480363172 /nfs/dbraw/zinc/36/31/72/480363172.db2.gz FEMOWEGBCDOHIK-SFHVURJKSA-N 1 3 325.460 2.764 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)N2CCCN(C(C)(C)C)CC2)CC1 ZINC000623689742 480402185 /nfs/dbraw/zinc/40/21/85/480402185.db2.gz VMQNRLRRMOSOBB-UHFFFAOYSA-N 1 3 338.540 2.624 10 0 EFAEHO C[NH+](C)C1(CNC(=O)NC[C@@H]2CCN2C2CCCCC2)CCCC1 ZINC000623704962 480410099 /nfs/dbraw/zinc/41/00/99/480410099.db2.gz WQVWMJGRIXTWDR-KRWDZBQOSA-N 1 3 336.524 2.567 10 0 EFAEHO CC(C)OC[C@H](O)CNCc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000644522255 480411833 /nfs/dbraw/zinc/41/18/33/480411833.db2.gz GVFAQNPWMIAACZ-YLJYHZDGSA-N 1 3 334.504 2.937 10 0 EFAEHO CC(C)OC[C@H](O)CNCc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000644522255 480411835 /nfs/dbraw/zinc/41/18/35/480411835.db2.gz GVFAQNPWMIAACZ-YLJYHZDGSA-N 1 3 334.504 2.937 10 0 EFAEHO CC(C)OC[C@@H](O)CNCc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000644522254 480412558 /nfs/dbraw/zinc/41/25/58/480412558.db2.gz GVFAQNPWMIAACZ-XLIONFOSSA-N 1 3 334.504 2.937 10 0 EFAEHO CC(C)OC[C@@H](O)CNCc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000644522254 480412564 /nfs/dbraw/zinc/41/25/64/480412564.db2.gz GVFAQNPWMIAACZ-XLIONFOSSA-N 1 3 334.504 2.937 10 0 EFAEHO CCN(C(=O)C1CC[NH+](Cc2ccccc2)CC1)[C@H]1CCN(CC)C1 ZINC000617929796 480426835 /nfs/dbraw/zinc/42/68/35/480426835.db2.gz QLZWLWARYCOCIL-FQEVSTJZSA-N 1 3 343.515 2.841 10 0 EFAEHO CCN(C(=O)C1CCN(c2cc[nH+]cc2C)CC1)[C@H]1CCN(CC)C1 ZINC000617928670 480426977 /nfs/dbraw/zinc/42/69/77/480426977.db2.gz TYJHMZOQZYTVER-SFHVURJKSA-N 1 3 344.503 2.549 10 0 EFAEHO C[C@H](NC(=O)NC[C@H]1CCN1C1CCCCC1)C(C)(C)C[NH+](C)C ZINC000623736991 480429428 /nfs/dbraw/zinc/42/94/28/480429428.db2.gz NIJNQKMNOPFKHX-DOTOQJQBSA-N 1 3 338.540 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2CO[C@H](C3CC3)C2)CC1 ZINC000623752419 480436930 /nfs/dbraw/zinc/43/69/30/480436930.db2.gz GDEUMVIXXQOUHD-CTNGQTDRSA-N 1 3 343.515 2.876 10 0 EFAEHO O[C@@]1(CNCC2(C(F)(F)F)CC2)CC[N@H+](Cc2ccccc2)C1 ZINC000634713870 480456671 /nfs/dbraw/zinc/45/66/71/480456671.db2.gz BWWQOLGBPPIOCQ-MRXNPFEDSA-N 1 3 328.378 2.556 10 0 EFAEHO O[C@@]1(CNCC2(C(F)(F)F)CC2)CC[N@@H+](Cc2ccccc2)C1 ZINC000634713870 480456679 /nfs/dbraw/zinc/45/66/79/480456679.db2.gz BWWQOLGBPPIOCQ-MRXNPFEDSA-N 1 3 328.378 2.556 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@]23CCC[C@H]2C[NH2+]C3)CCN1Cc1ccccc1 ZINC000634767884 480509193 /nfs/dbraw/zinc/50/91/93/480509193.db2.gz ODPIDODMKBDMRU-LYSIVYOWSA-N 1 3 341.499 2.545 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)[C@]23CCC[C@H]2C[NH2+]C3)CCN1Cc1ccccc1 ZINC000634767886 480509705 /nfs/dbraw/zinc/50/97/05/480509705.db2.gz ODPIDODMKBDMRU-SAJDGTNDSA-N 1 3 341.499 2.545 10 0 EFAEHO CN1CCN(Cc2cccc(N[C@@H]3CC[N@H+](C)C(C)(C)C3)c2)CC1 ZINC000623933039 480527378 /nfs/dbraw/zinc/52/73/78/480527378.db2.gz NWBSHPODOAQJHS-LJQANCHMSA-N 1 3 330.520 2.719 10 0 EFAEHO CN1CCN(Cc2cccc(N[C@@H]3CC[N@@H+](C)C(C)(C)C3)c2)CC1 ZINC000623933039 480527387 /nfs/dbraw/zinc/52/73/87/480527387.db2.gz NWBSHPODOAQJHS-LJQANCHMSA-N 1 3 330.520 2.719 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NC[C@@H]2Cc3ccccc3CO2)[C@@H](C)C1 ZINC000624054667 480586081 /nfs/dbraw/zinc/58/60/81/480586081.db2.gz JYQHUAUVZZHMRW-YYWHXJBOSA-N 1 3 346.515 2.855 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NC[C@@H]2Cc3ccccc3CO2)[C@@H](C)C1 ZINC000624054667 480586088 /nfs/dbraw/zinc/58/60/88/480586088.db2.gz JYQHUAUVZZHMRW-YYWHXJBOSA-N 1 3 346.515 2.855 10 0 EFAEHO C[C@@H](NC(C)(C)CNC(=O)N[C@@H]1CC[C@@H](C)[NH2+]C1)c1ccccc1 ZINC000626977859 480607337 /nfs/dbraw/zinc/60/73/37/480607337.db2.gz FIROCSXILTULGT-BFYDXBDKSA-N 1 3 332.492 2.556 10 0 EFAEHO Clc1ccc(N2CCO[C@H](CNC3CC[NH+](C4CC4)CC3)C2)cc1 ZINC000624120043 480619629 /nfs/dbraw/zinc/61/96/29/480619629.db2.gz QGZUQSSWFQFXSK-LJQANCHMSA-N 1 3 349.906 2.762 10 0 EFAEHO COc1cc2nccc(N3CCC[C@@H]4C[NH2+]CC[C@@H]43)c2cc1OC ZINC000630386134 480694095 /nfs/dbraw/zinc/69/40/95/480694095.db2.gz WLPCTGXXXBZGCG-CJNGLKHVSA-N 1 3 327.428 2.830 10 0 EFAEHO CCN(C(=O)N[C@@H]1CC[NH2+][C@H]1C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000627240876 480708848 /nfs/dbraw/zinc/70/88/48/480708848.db2.gz BSASKYANNMKUMA-RNIPGJKVSA-N 1 3 344.503 2.604 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@@H](NC(=O)NC[C@@H]2CCN2C2CCCCC2)C1 ZINC000624336287 480714037 /nfs/dbraw/zinc/71/40/37/480714037.db2.gz NERWTAMVEVCIND-WBVHZDCISA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)NC[C@@H]2CCN2C2CCCCC2)C1 ZINC000624336287 480714042 /nfs/dbraw/zinc/71/40/42/480714042.db2.gz NERWTAMVEVCIND-WBVHZDCISA-N 1 3 336.524 2.565 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](c2ccccc2)N2CCCC2)CC[N@@H+]1C ZINC000630579873 480791290 /nfs/dbraw/zinc/79/12/90/480791290.db2.gz VEZTUMNWXXNZTL-OTWHNJEPSA-N 1 3 329.488 2.670 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](c2ccccc2)N2CCCC2)CC[N@H+]1C ZINC000630579873 480791294 /nfs/dbraw/zinc/79/12/94/480791294.db2.gz VEZTUMNWXXNZTL-OTWHNJEPSA-N 1 3 329.488 2.670 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCN(C(=O)N[C@H]2CCC[NH2+]CC2)CC1 ZINC000641078154 480797852 /nfs/dbraw/zinc/79/78/52/480797852.db2.gz YHNWGCVJNKVYOH-INIZCTEOSA-N 1 3 338.540 2.671 10 0 EFAEHO CCN(C(=O)C1CCN(c2cc[nH+]cc2C)CC1)C1CCN(C)CC1 ZINC000627618104 480802088 /nfs/dbraw/zinc/80/20/88/480802088.db2.gz HFYLJNSUFDXQDV-UHFFFAOYSA-N 1 3 344.503 2.549 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000661405005 480992071 /nfs/dbraw/zinc/99/20/71/480992071.db2.gz BOBVBLZZRKYRTE-RDJZCZTQSA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000661405005 480992078 /nfs/dbraw/zinc/99/20/78/480992078.db2.gz BOBVBLZZRKYRTE-RDJZCZTQSA-N 1 3 336.524 2.565 10 0 EFAEHO COc1cc(CN2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)cc2c1OCCO2 ZINC000647543238 480993791 /nfs/dbraw/zinc/99/37/91/480993791.db2.gz JWDIKOQWORYMKN-IAGOWNOFSA-N 1 3 346.471 2.678 10 0 EFAEHO CN(C)CCOc1ccc(CN2CCc3ccccc3[C@H]2C[NH3+])cc1 ZINC000647552661 480997624 /nfs/dbraw/zinc/99/76/24/480997624.db2.gz PZVHQSBFJQKBNY-OAQYLSRUSA-N 1 3 339.483 2.685 10 0 EFAEHO CN(C)CCOc1ccc(CN2CCc3ccccc3[C@@H]2C[NH3+])cc1 ZINC000647552660 480998061 /nfs/dbraw/zinc/99/80/61/480998061.db2.gz PZVHQSBFJQKBNY-NRFANRHFSA-N 1 3 339.483 2.685 10 0 EFAEHO NCC(=O)N1CCC[C@@H](C[NH2+]C2(c3cccc(Cl)c3)CCC2)C1 ZINC000647553387 480999127 /nfs/dbraw/zinc/99/91/27/480999127.db2.gz YYSBGRKVVPZJSW-AWEZNQCLSA-N 1 3 335.879 2.506 10 0 EFAEHO CC[NH+]1CCC(NC(=O)CNC2(c3cccc(C)c3)CCC2)CC1 ZINC000646021429 481026438 /nfs/dbraw/zinc/02/64/38/481026438.db2.gz ZQLVMPLDAZCDNR-UHFFFAOYSA-N 1 3 329.488 2.564 10 0 EFAEHO CC[NH+]1CCC(NC(=O)CN2CC[C@@H]([C@H]3CCCC3(C)C)C2)CC1 ZINC000646049587 481041436 /nfs/dbraw/zinc/04/14/36/481041436.db2.gz OBQRAVQIWGXBQE-SJLPKXTDSA-N 1 3 335.536 2.735 10 0 EFAEHO O=C([C@H]1CC[C@@H](C2CC2)[NH2+]1)N1CCCN(CC2CCCCC2)CC1 ZINC000653112048 481086705 /nfs/dbraw/zinc/08/67/05/481086705.db2.gz KDVBLLXJMTYHTL-RBUKOAKNSA-N 1 3 333.520 2.632 10 0 EFAEHO C[C@H](NC(C)(C)CNC(=O)[C@H]1CC[C@H](C2CC2)[NH2+]1)c1ccccc1 ZINC000653117175 481090386 /nfs/dbraw/zinc/09/03/86/481090386.db2.gz CDUMKYKZBGUYQD-BMGDILEWSA-N 1 3 329.488 2.763 10 0 EFAEHO CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccccc2CC[NH3+])C1 ZINC000653122468 481093126 /nfs/dbraw/zinc/09/31/26/481093126.db2.gz XGDLSDQHEKLQIM-LJQANCHMSA-N 1 3 337.467 2.534 10 0 EFAEHO CCN1CCN(c2ccccc2N[C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000647789309 481106879 /nfs/dbraw/zinc/10/68/79/481106879.db2.gz ANUFZLUAIFFITF-RCCFBDPRSA-N 1 3 328.504 2.629 10 0 EFAEHO O[C@@H]1CC[N@H+](Cc2ccc(CNc3ccnc4ccccc43)cc2)C1 ZINC000664238264 481121214 /nfs/dbraw/zinc/12/12/14/481121214.db2.gz FSPFUHLVQIUOGW-GOSISDBHSA-N 1 3 333.435 2.835 10 0 EFAEHO O[C@@H]1CC[N@@H+](Cc2ccc(CNc3ccnc4ccccc43)cc2)C1 ZINC000664238264 481121219 /nfs/dbraw/zinc/12/12/19/481121219.db2.gz FSPFUHLVQIUOGW-GOSISDBHSA-N 1 3 333.435 2.835 10 0 EFAEHO CO[C@]1(C[NH2+]C[C@H]2CN(Cc3ccccc3)CC23CCC3)CCOC1 ZINC000639328300 481130817 /nfs/dbraw/zinc/13/08/17/481130817.db2.gz GPWMJYWNQDGRTN-FPOVZHCZSA-N 1 3 344.499 2.684 10 0 EFAEHO C[C@@H]1CC[NH2+]C[C@H]1NC(=O)N[C@@H](CN1CCCCC1)c1ccccc1 ZINC000669483618 481150848 /nfs/dbraw/zinc/15/08/48/481150848.db2.gz DPSKSWCJRXGCRT-QRQLOZEOSA-N 1 3 344.503 2.511 10 0 EFAEHO CCN(C(=O)NC1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCN(C)C1 ZINC000664299726 481161606 /nfs/dbraw/zinc/16/16/06/481161606.db2.gz VBUAKWQQYINBEX-GOSISDBHSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN(C(=O)NC1CC[NH+](C2CCCCC2)CC1)[C@H]1CCN(C)C1 ZINC000664299727 481161691 /nfs/dbraw/zinc/16/16/91/481161691.db2.gz VBUAKWQQYINBEX-SFHVURJKSA-N 1 3 336.524 2.519 10 0 EFAEHO O=C(CCN1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1)NCc1ccccc1Cl ZINC000647901635 481168161 /nfs/dbraw/zinc/16/81/61/481168161.db2.gz SCERZAWDNNTQIE-AEFFLSMTSA-N 1 3 349.906 2.810 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@H](CNC(=O)Nc2ccc3c(c2F)CCNC3)C1 ZINC000659022041 481168924 /nfs/dbraw/zinc/16/89/24/481168924.db2.gz KZFJGLGWQKLWHK-CYBMUJFWSA-N 1 3 348.466 2.713 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)Nc2ccc3c(c2F)CCNC3)C1 ZINC000659022041 481168930 /nfs/dbraw/zinc/16/89/30/481168930.db2.gz KZFJGLGWQKLWHK-CYBMUJFWSA-N 1 3 348.466 2.713 10 0 EFAEHO CCCC[N@H+](C)C[C@@H](C)NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659040384 481182286 /nfs/dbraw/zinc/18/22/86/481182286.db2.gz DVMNAYBUXZLJJY-QAPCUYQASA-N 1 3 348.491 2.589 10 0 EFAEHO CCCC[N@@H+](C)C[C@@H](C)NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659040384 481182290 /nfs/dbraw/zinc/18/22/90/481182290.db2.gz DVMNAYBUXZLJJY-QAPCUYQASA-N 1 3 348.491 2.589 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000650567610 481187204 /nfs/dbraw/zinc/18/72/04/481187204.db2.gz DFWIQFZPZFVZCV-LJQANCHMSA-N 1 3 346.519 2.538 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000650567610 481187207 /nfs/dbraw/zinc/18/72/07/481187207.db2.gz DFWIQFZPZFVZCV-LJQANCHMSA-N 1 3 346.519 2.538 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@@H](C)CC(=O)Nc1cccc(OC)c1 ZINC000650719357 481286992 /nfs/dbraw/zinc/28/69/92/481286992.db2.gz NHRQXENIGHELRL-HNNXBMFYSA-N 1 3 341.455 2.922 10 0 EFAEHO COc1ccc(OC)c(CN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)c1 ZINC000650722112 481288865 /nfs/dbraw/zinc/28/88/65/481288865.db2.gz LAZIKDJGFMJHDO-SZVBFZGTSA-N 1 3 334.460 2.565 10 0 EFAEHO CCOc1ccc(CN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)cc1OC ZINC000650722045 481289079 /nfs/dbraw/zinc/28/90/79/481289079.db2.gz JILDBCPKVPKGPR-YQVWRLOYSA-N 1 3 348.487 2.955 10 0 EFAEHO COc1ccc(CN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)c(OC)c1 ZINC000650721956 481290344 /nfs/dbraw/zinc/29/03/44/481290344.db2.gz HEZBABRFFDUJSF-SZVBFZGTSA-N 1 3 334.460 2.565 10 0 EFAEHO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCCN2Cc2cc(-c3ccccc3)n[nH]2)C1 ZINC000650723124 481291637 /nfs/dbraw/zinc/29/16/37/481291637.db2.gz HRJFLFXEHHBVGZ-NSISKUIASA-N 1 3 340.471 2.938 10 0 EFAEHO COc1cc(C)c(CN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)cc1OC ZINC000650723888 481291800 /nfs/dbraw/zinc/29/18/00/481291800.db2.gz VJGNOBKSQVZOCB-RCCFBDPRSA-N 1 3 348.487 2.873 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1cccc(Oc2ccc(F)cc2)n1 ZINC000650742183 481309576 /nfs/dbraw/zinc/30/95/76/481309576.db2.gz SKNZPCSRNNHJKK-MRXNPFEDSA-N 1 3 333.407 2.857 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@H](C)c1ccc(C(=O)N(C)C)cc1 ZINC000650755717 481320005 /nfs/dbraw/zinc/32/00/05/481320005.db2.gz LDNFPHNOWCHVAD-OAHLLOKOSA-N 1 3 325.456 2.959 10 0 EFAEHO C[NH2+]Cc1ccccc1CN[C@H]1CCN(C(C)=O)Cc2ccccc21 ZINC000650757309 481320273 /nfs/dbraw/zinc/32/02/73/481320273.db2.gz UJCRHNYRVBCNRG-NRFANRHFSA-N 1 3 337.467 2.989 10 0 EFAEHO c1ccc2c(c1)CC[C@H](CCN[C@@H]1CCOC[C@@H]1[C@H]1CCC[NH2+]1)N2 ZINC000650759021 481322217 /nfs/dbraw/zinc/32/22/17/481322217.db2.gz BJYKTRRLILWGTI-HNBVOPMISA-N 1 3 329.488 2.550 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccc(C2CCC2)cn1 ZINC000667155848 481356264 /nfs/dbraw/zinc/35/62/64/481356264.db2.gz VYUYACNKIPTRRM-HNNXBMFYSA-N 1 3 347.507 2.743 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccc(C2CCC2)cn1 ZINC000667155848 481356268 /nfs/dbraw/zinc/35/62/68/481356268.db2.gz VYUYACNKIPTRRM-HNNXBMFYSA-N 1 3 347.507 2.743 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)NCC[C@@H]([NH3+])C(C)C)c1ccccc1 ZINC000659427072 481429631 /nfs/dbraw/zinc/42/96/31/481429631.db2.gz KEJCEKYZKUYANK-QZTJIDSGSA-N 1 3 334.508 2.742 10 0 EFAEHO C[C@H](CCNC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1)[NH+](C)C ZINC000664715549 481433880 /nfs/dbraw/zinc/43/38/80/481433880.db2.gz QAHLJTFYMAHQBM-YLJYHZDGSA-N 1 3 346.519 2.681 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000659445142 481440326 /nfs/dbraw/zinc/44/03/26/481440326.db2.gz DCPGZZZBCJKPJE-RBUKOAKNSA-N 1 3 346.519 2.571 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C ZINC000659466028 481453914 /nfs/dbraw/zinc/45/39/14/481453914.db2.gz OGSJQSVVISVSMB-BHIYHBOVSA-N 1 3 346.519 2.570 10 0 EFAEHO [NH3+]C[C@H]1CCC[C@@H]1NCc1ccc(N2CCc3ccccc3C2)nc1 ZINC000643472043 481484316 /nfs/dbraw/zinc/48/43/16/481484316.db2.gz LDIAPYGPFLLAGL-QUCCMNQESA-N 1 3 336.483 2.861 10 0 EFAEHO CCN(C(=O)NC[C@@H]1CCC[N@@H+]1C1CCCCC1)[C@H]1CCN(C)C1 ZINC000664813535 481494888 /nfs/dbraw/zinc/49/48/88/481494888.db2.gz XWGSRPIIFNJJIN-ROUUACIJSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN(C(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1)[C@H]1CCN(C)C1 ZINC000664813535 481494895 /nfs/dbraw/zinc/49/48/95/481494895.db2.gz XWGSRPIIFNJJIN-ROUUACIJSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H](N[C@@H]1CC12CC[NH2+]CC2)c1ccc(-n2cncn2)cc1Cl ZINC000643534823 481496970 /nfs/dbraw/zinc/49/69/70/481496970.db2.gz DFYUIPSQTYFANJ-MLGOLLRUSA-N 1 3 331.851 2.713 10 0 EFAEHO CNC(=O)CC[N@@H+]1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000664839175 481510142 /nfs/dbraw/zinc/51/01/42/481510142.db2.gz ZYUYENQWEZPPFB-HXUWFJFHSA-N 1 3 343.515 2.745 10 0 EFAEHO CNC(=O)CC[N@H+]1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000664839175 481510148 /nfs/dbraw/zinc/51/01/48/481510148.db2.gz ZYUYENQWEZPPFB-HXUWFJFHSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@@H](CC[NH+]1CCC(N2CC[C@H](O)C2)CC1)OCc1ccccc1 ZINC000662151791 481594825 /nfs/dbraw/zinc/59/48/25/481594825.db2.gz LIOLYGWYZVSJGC-PXNSSMCTSA-N 1 3 332.488 2.513 10 0 EFAEHO CC(C)[NH+]1CCN(c2ccc(-c3nc([C@@H]4CCCN4)no3)cc2)CC1 ZINC000647147984 481664507 /nfs/dbraw/zinc/66/45/07/481664507.db2.gz CSYFFCLQOKORMA-KRWDZBQOSA-N 1 3 341.459 2.692 10 0 EFAEHO c1ccc(CCN2CCN(Cc3cccc4c3CC[NH2+]C4)CC2)cc1 ZINC000662260216 481673991 /nfs/dbraw/zinc/67/39/91/481673991.db2.gz IBUGQYRNRVXGLB-UHFFFAOYSA-N 1 3 335.495 2.693 10 0 EFAEHO CC1CC[NH+](CCCCNCc2ccnn2-c2ccccn2)CC1 ZINC000647171827 481681260 /nfs/dbraw/zinc/68/12/60/481681260.db2.gz XWYGJNPKGQBBKE-UHFFFAOYSA-N 1 3 327.476 2.869 10 0 EFAEHO CN(C)CCNC(=O)Nc1nc2ccc(C[N@H+](C)C3CC3)cc2s1 ZINC000667609528 481684206 /nfs/dbraw/zinc/68/42/06/481684206.db2.gz HMBLMVQWVZKZBP-UHFFFAOYSA-N 1 3 347.488 2.574 10 0 EFAEHO CN(C)CCNC(=O)Nc1nc2ccc(C[N@@H+](C)C3CC3)cc2s1 ZINC000667609528 481684216 /nfs/dbraw/zinc/68/42/16/481684216.db2.gz HMBLMVQWVZKZBP-UHFFFAOYSA-N 1 3 347.488 2.574 10 0 EFAEHO CCN(Cc1ccccc1)C(=O)CN1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000662290365 481693798 /nfs/dbraw/zinc/69/37/98/481693798.db2.gz RGCCNCKLIJKZCI-FQEVSTJZSA-N 1 3 343.515 2.747 10 0 EFAEHO CCN(Cc1ccccc1)C(=O)CN1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662290366 481693970 /nfs/dbraw/zinc/69/39/70/481693970.db2.gz RGCCNCKLIJKZCI-HXUWFJFHSA-N 1 3 343.515 2.747 10 0 EFAEHO C[C@@H](C(=O)N(C)C1CCCCC1)N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662293452 481697431 /nfs/dbraw/zinc/69/74/31/481697431.db2.gz LDMQTSQPKZPIKQ-WMZOPIPTSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1cc(C)cc(NC(=O)CN2CCC[C@H](C3CC[NH2+]CC3)C2)c1 ZINC000662293658 481697909 /nfs/dbraw/zinc/69/79/09/481697909.db2.gz HMYLVTVZLJLKLL-SFHVURJKSA-N 1 3 329.488 2.954 10 0 EFAEHO O=C(CN1CCC[C@@H](C2CC[NH2+]CC2)C1)N1CCCc2ccccc21 ZINC000662292983 481698827 /nfs/dbraw/zinc/69/88/27/481698827.db2.gz DDFDCWNDBXAYBN-LJQANCHMSA-N 1 3 341.499 2.677 10 0 EFAEHO COC[C@H](C[N@@H+]1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1)OC ZINC000660010157 481698861 /nfs/dbraw/zinc/69/88/61/481698861.db2.gz GJJDVDNTLCMXCH-AABGKKOBSA-N 1 3 332.488 2.634 10 0 EFAEHO COC[C@H](C[N@H+]1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1)OC ZINC000660010157 481698869 /nfs/dbraw/zinc/69/88/69/481698869.db2.gz GJJDVDNTLCMXCH-AABGKKOBSA-N 1 3 332.488 2.634 10 0 EFAEHO C[C@H](C(=O)N[C@H]1CCCC[C@H]1C)N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662297182 481702739 /nfs/dbraw/zinc/70/27/39/481702739.db2.gz OGLHNVFPPBDEEW-FPAYPSAMSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(=O)c1ccccc1OCCN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662297481 481705010 /nfs/dbraw/zinc/70/50/10/481705010.db2.gz QLZLHLPJYTXJGQ-SFHVURJKSA-N 1 3 330.472 2.980 10 0 EFAEHO C[C@H](C(=O)NC1CCC(C)CC1)N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662298990 481705442 /nfs/dbraw/zinc/70/54/42/481705442.db2.gz YZJFQGCWDZIRRA-YDXUJSMASA-N 1 3 335.536 2.781 10 0 EFAEHO c1c(N2CCNCC2)n[nH]c1[C@H]1CCC[N@@H+](CCCC2CCCC2)C1 ZINC000662338494 481736873 /nfs/dbraw/zinc/73/68/73/481736873.db2.gz SFBVQOOYJVFMTC-SFHVURJKSA-N 1 3 345.535 2.969 10 0 EFAEHO c1c(N2CCNCC2)n[nH]c1[C@H]1CCC[N@H+](CCCC2CCCC2)C1 ZINC000662338494 481736884 /nfs/dbraw/zinc/73/68/84/481736884.db2.gz SFBVQOOYJVFMTC-SFHVURJKSA-N 1 3 345.535 2.969 10 0 EFAEHO CCC(C)(C)CC[N@@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662338302 481737223 /nfs/dbraw/zinc/73/72/23/481737223.db2.gz QDKICRJYVYUEGZ-INIZCTEOSA-N 1 3 333.524 2.825 10 0 EFAEHO CCC(C)(C)CC[N@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662338302 481737235 /nfs/dbraw/zinc/73/72/35/481737235.db2.gz QDKICRJYVYUEGZ-INIZCTEOSA-N 1 3 333.524 2.825 10 0 EFAEHO C[C@@H]1CCCC[C@@H]1C[N@@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662338922 481737350 /nfs/dbraw/zinc/73/73/50/481737350.db2.gz WXCAOPDHIOQWGJ-KZNAEPCWSA-N 1 3 345.535 2.825 10 0 EFAEHO C[C@@H]1CCCC[C@@H]1C[N@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662338922 481737357 /nfs/dbraw/zinc/73/73/57/481737357.db2.gz WXCAOPDHIOQWGJ-KZNAEPCWSA-N 1 3 345.535 2.825 10 0 EFAEHO CC(C)C[C@H]([NH2+][C@@H]1CCN(C2CCN(C)CC2)C1)c1ccncc1 ZINC000647288684 481747542 /nfs/dbraw/zinc/74/75/42/481747542.db2.gz KWRAZDWWYYSCNX-QUCCMNQESA-N 1 3 330.520 2.927 10 0 EFAEHO CC[C@H](N[C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21)C(=O)NCc1cccs1 ZINC000647333896 481763907 /nfs/dbraw/zinc/76/39/07/481763907.db2.gz BIFTZZQUJDEFKT-MWDXBVQZSA-N 1 3 335.517 2.605 10 0 EFAEHO CC[C@H](N[C@@H]1CC[N@@H+](C)[C@@H]2CCC[C@H]21)C(=O)NCc1cccs1 ZINC000647333896 481763919 /nfs/dbraw/zinc/76/39/19/481763919.db2.gz BIFTZZQUJDEFKT-MWDXBVQZSA-N 1 3 335.517 2.605 10 0 EFAEHO CC[C@H]([NH2+][C@@H]1CCN(C)[C@@H]2CCC[C@H]21)C(=O)NCc1cccs1 ZINC000647333896 481763928 /nfs/dbraw/zinc/76/39/28/481763928.db2.gz BIFTZZQUJDEFKT-MWDXBVQZSA-N 1 3 335.517 2.605 10 0 EFAEHO C[C@@H]1CCCC[C@@H]1[NH+]1CCC(NCC(C)(C)[C@]2(O)CCOC2)CC1 ZINC000647340099 481767749 /nfs/dbraw/zinc/76/77/49/481767749.db2.gz DYNFNWKKWGUBNI-KPFFTGBYSA-N 1 3 338.536 2.797 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(N[C@H](C)c2cc(F)ccc2F)CC1 ZINC000665285395 481769784 /nfs/dbraw/zinc/76/97/84/481769784.db2.gz LODIPFKFNQMOKH-CYBMUJFWSA-N 1 3 339.430 2.606 10 0 EFAEHO C[C@@H](CNC(=O)c1ccc2c(c1)[C@@H](C[NH3+])CCC2)N1CCC(C)CC1 ZINC000662417109 481795887 /nfs/dbraw/zinc/79/58/87/481795887.db2.gz HXHWJOLZDKFDAK-QFBILLFUSA-N 1 3 343.515 2.915 10 0 EFAEHO CO[C@@H](C[N@H+](C)CCC1CCN(c2ccncc2)CC1)[C@H]1CCOC1 ZINC000660165012 481796321 /nfs/dbraw/zinc/79/63/21/481796321.db2.gz BFNOKJYADFQKEG-ICSRJNTNSA-N 1 3 347.503 2.671 10 0 EFAEHO CO[C@@H](C[N@@H+](C)CCC1CCN(c2ccncc2)CC1)[C@H]1CCOC1 ZINC000660165012 481796326 /nfs/dbraw/zinc/79/63/26/481796326.db2.gz BFNOKJYADFQKEG-ICSRJNTNSA-N 1 3 347.503 2.671 10 0 EFAEHO C[N@H+](CCC1CCN(c2ccncc2)CC1)CC1(O)CCSCC1 ZINC000660165758 481799233 /nfs/dbraw/zinc/79/92/33/481799233.db2.gz GMGWWLCFHDPHAP-UHFFFAOYSA-N 1 3 349.544 2.878 10 0 EFAEHO C[N@@H+](CCC1CCN(c2ccncc2)CC1)CC1(O)CCSCC1 ZINC000660165758 481799235 /nfs/dbraw/zinc/79/92/35/481799235.db2.gz GMGWWLCFHDPHAP-UHFFFAOYSA-N 1 3 349.544 2.878 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)C[C@@H]1NCc2ccccc21 ZINC000662429557 481801938 /nfs/dbraw/zinc/80/19/38/481801938.db2.gz OQWDQNKZYBNHNZ-HKUYNNGSSA-N 1 3 329.488 2.992 10 0 EFAEHO CCCC[N@H+]1CCCC[C@H]1CNC(=O)C[C@@H]1NCc2ccccc21 ZINC000662429557 481801943 /nfs/dbraw/zinc/80/19/43/481801943.db2.gz OQWDQNKZYBNHNZ-HKUYNNGSSA-N 1 3 329.488 2.992 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CCC([NH+]2CCCCC2)CC1 ZINC000665367228 481824983 /nfs/dbraw/zinc/82/49/83/481824983.db2.gz SNAXMFAHHLUYNL-QGZVFWFLSA-N 1 3 336.524 2.519 10 0 EFAEHO C[NH+](C)CCOc1cccc(NC(=O)NC[C@@H]2CCN2C(C)(C)C)c1 ZINC000665366689 481825833 /nfs/dbraw/zinc/82/58/33/481825833.db2.gz FVJZMAUPNVOVED-INIZCTEOSA-N 1 3 348.491 2.621 10 0 EFAEHO c1cc(OCC[NH+]2CCCC2)ccc1CN[C@@H]1CO[C@H](C2CC2)C1 ZINC000667866446 481859220 /nfs/dbraw/zinc/85/92/20/481859220.db2.gz AXBDGKKYBPWGMT-ICSRJNTNSA-N 1 3 330.472 2.818 10 0 EFAEHO C[N@H+](CCCNC(=O)C[C@@H]1NCc2ccccc21)C1CCCCC1 ZINC000662526152 481861032 /nfs/dbraw/zinc/86/10/32/481861032.db2.gz SSOYXTJMSUXIJR-IBGZPJMESA-N 1 3 329.488 2.992 10 0 EFAEHO C[N@@H+](CCCNC(=O)C[C@@H]1NCc2ccccc21)C1CCCCC1 ZINC000662526152 481861033 /nfs/dbraw/zinc/86/10/33/481861033.db2.gz SSOYXTJMSUXIJR-IBGZPJMESA-N 1 3 329.488 2.992 10 0 EFAEHO CC[NH+](CC)Cc1cccc(CNC(=O)C2(NC3CC3)CCC2)c1 ZINC000662674494 481928161 /nfs/dbraw/zinc/92/81/61/481928161.db2.gz DKPIAKHUWTUHJJ-UHFFFAOYSA-N 1 3 329.488 2.819 10 0 EFAEHO C[C@H](C(=O)Nc1ccc([C@H]2C[NH2+]CCO2)cc1)N1CCCCCC1 ZINC000662687183 481933161 /nfs/dbraw/zinc/93/31/61/481933161.db2.gz VLNCXGYYRGBSQI-CRAIPNDOSA-N 1 3 331.460 2.551 10 0 EFAEHO C[C@H](C(=O)Nc1ccc([C@H]2CNCCO2)cc1)[C@H]([NH3+])c1ccccc1 ZINC000662685903 481933503 /nfs/dbraw/zinc/93/35/03/481933503.db2.gz IFMCJIBNPIWYPQ-KYNGSXCRSA-N 1 3 339.439 2.622 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000660396863 481934210 /nfs/dbraw/zinc/93/42/10/481934210.db2.gz PFFCQRAODSVJBD-BRWVUGGUSA-N 1 3 338.540 2.526 10 0 EFAEHO C[C@H](c1ccccc1)N1CC[C@H](NC(=O)C2([NH2+]C3CC3)CCC2)C1 ZINC000662696058 481938058 /nfs/dbraw/zinc/93/80/58/481938058.db2.gz HLBREOBYRCDHTC-QAPCUYQASA-N 1 3 327.472 2.613 10 0 EFAEHO C[C@@H](CN1CCC(C)CC1)NC(=O)c1ccc2c(c1)[C@@H](C[NH3+])CCC2 ZINC000662695213 481938188 /nfs/dbraw/zinc/93/81/88/481938188.db2.gz XMLSQLLXQOMJPN-QFBILLFUSA-N 1 3 343.515 2.915 10 0 EFAEHO CC1CC[NH+](C[C@H]2CCCN(C(=O)C3(NC4CC4)CCC3)C2)CC1 ZINC000662699111 481940079 /nfs/dbraw/zinc/94/00/79/481940079.db2.gz WKGLYODVMLGWEX-QGZVFWFLSA-N 1 3 333.520 2.632 10 0 EFAEHO CCN(C(=O)Nc1cccc(OCC[NH+](C)C)c1)[C@@H]1CCN(CC)C1 ZINC000665601599 481957461 /nfs/dbraw/zinc/95/74/61/481957461.db2.gz BEQZCMNGRJWGAB-QGZVFWFLSA-N 1 3 348.491 2.575 10 0 EFAEHO C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000660450656 481966216 /nfs/dbraw/zinc/96/62/16/481966216.db2.gz JGUWLSGDZFOUKT-HOTGVXAUSA-N 1 3 338.540 2.669 10 0 EFAEHO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000660450656 481966222 /nfs/dbraw/zinc/96/62/22/481966222.db2.gz JGUWLSGDZFOUKT-HOTGVXAUSA-N 1 3 338.540 2.669 10 0 EFAEHO CCc1ccc(CN(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000665637178 481972719 /nfs/dbraw/zinc/97/27/19/481972719.db2.gz WPSLUPBIXQAFPV-KRWDZBQOSA-N 1 3 348.535 2.662 10 0 EFAEHO CCc1ccc(CN(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000665637178 481972723 /nfs/dbraw/zinc/97/27/23/481972723.db2.gz WPSLUPBIXQAFPV-KRWDZBQOSA-N 1 3 348.535 2.662 10 0 EFAEHO O=C(N1CCC(CCC[NH+]2CCCC2)CC1)C1(NC2CC2)CCC1 ZINC000662796595 481972763 /nfs/dbraw/zinc/97/27/63/481972763.db2.gz OHMSXKNJKXMEJS-UHFFFAOYSA-N 1 3 333.520 2.776 10 0 EFAEHO CN(CCc1ccccc1)[C@@H]1CCN(C(=O)[C@H]2[NH2+]CCCC2(C)C)C1 ZINC000662873324 482000103 /nfs/dbraw/zinc/00/01/03/482000103.db2.gz WGBZXTRPUBUBJR-RTBURBONSA-N 1 3 343.515 2.540 10 0 EFAEHO CC(C)[C@H](C(=O)Nc1ccc([C@H]2CNCCO2)cc1)[NH+]1CCCCC1 ZINC000662884843 482004983 /nfs/dbraw/zinc/00/49/83/482004983.db2.gz PRLOEPKPQFFDMC-RTBURBONSA-N 1 3 345.487 2.797 10 0 EFAEHO O=C(N[C@@H]1CCCN2CCCC[C@H]12)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000654729642 482019020 /nfs/dbraw/zinc/01/90/20/482019020.db2.gz UQHZZPREFYXHRD-GUDVDZBRSA-N 1 3 348.535 2.663 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1C[C@@H](C)[C@H]1c1ccccc1 ZINC000665759267 482038711 /nfs/dbraw/zinc/03/87/11/482038711.db2.gz BFLLVZVPTQWTLN-AOIWGVFYSA-N 1 3 346.519 2.661 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1C[C@@H](C)[C@H]1c1ccccc1 ZINC000665759267 482038716 /nfs/dbraw/zinc/03/87/16/482038716.db2.gz BFLLVZVPTQWTLN-AOIWGVFYSA-N 1 3 346.519 2.661 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CC=C(C(C)(C)C)CC1 ZINC000665760394 482038808 /nfs/dbraw/zinc/03/88/08/482038808.db2.gz IIAZQEFFGOHXKY-INIZCTEOSA-N 1 3 338.540 2.646 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CC=C(C(C)(C)C)CC1 ZINC000665760394 482038810 /nfs/dbraw/zinc/03/88/10/482038810.db2.gz IIAZQEFFGOHXKY-INIZCTEOSA-N 1 3 338.540 2.646 10 0 EFAEHO Cc1ccccc1C1(NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)CC1 ZINC000665763488 482039727 /nfs/dbraw/zinc/03/97/27/482039727.db2.gz CAEOYQDEBKZAFV-KRWDZBQOSA-N 1 3 346.519 2.555 10 0 EFAEHO Cc1ccccc1C1(NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)CC1 ZINC000665763488 482039730 /nfs/dbraw/zinc/03/97/30/482039730.db2.gz CAEOYQDEBKZAFV-KRWDZBQOSA-N 1 3 346.519 2.555 10 0 EFAEHO C[C@@H](NC(C)(C)CNC(=O)NCCC1(C[NH3+])CC1)c1ccccc1 ZINC000652151211 482099074 /nfs/dbraw/zinc/09/90/74/482099074.db2.gz MGIQJMHNVSMXBW-OAHLLOKOSA-N 1 3 332.492 2.544 10 0 EFAEHO COCCC1CN(Cc2ccccc2N(C)C2CC[NH+](C)CC2)C1 ZINC000668472948 482136245 /nfs/dbraw/zinc/13/62/45/482136245.db2.gz KMVRAVUYSDKFOP-UHFFFAOYSA-N 1 3 331.504 2.685 10 0 EFAEHO CCN(C(=O)Nc1ccc(OCCC[NH+](C)C)cc1)[C@H]1CCN(C)C1 ZINC000666029121 482155451 /nfs/dbraw/zinc/15/54/51/482155451.db2.gz IVSFQQPJRUMCBH-KRWDZBQOSA-N 1 3 348.491 2.575 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)NCc1ccccc1C[NH2+]C ZINC000652290738 482159203 /nfs/dbraw/zinc/15/92/03/482159203.db2.gz OXBYQLDVDTVYPS-UHFFFAOYSA-N 1 3 346.519 2.814 10 0 EFAEHO C[C@@H]1C[NH+](Cc2ccccc2N(C)C2CCN(C)CC2)C[C@@H](C)C1O ZINC000668555243 482166821 /nfs/dbraw/zinc/16/68/21/482166821.db2.gz VNJREVIOPZZSEC-IAGOWNOFSA-N 1 3 345.531 2.666 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2C[C@@H]3COC[C@]3(C)C2)CC1 ZINC000668595809 482181962 /nfs/dbraw/zinc/18/19/62/482181962.db2.gz AMSDXNIVCWSQHH-CTNGQTDRSA-N 1 3 343.515 2.687 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2C[C@@H]3COC[C@]3(C)C2)CC1 ZINC000668595809 482181967 /nfs/dbraw/zinc/18/19/67/482181967.db2.gz AMSDXNIVCWSQHH-CTNGQTDRSA-N 1 3 343.515 2.687 10 0 EFAEHO CN(C(=O)[C@@H](C[NH+]1CCCC1)c1ccccc1)[C@H]1CCN(C2CC2)C1 ZINC000668599666 482183446 /nfs/dbraw/zinc/18/34/46/482183446.db2.gz XMTSJTRSSLBDTJ-PMACEKPBSA-N 1 3 341.499 2.561 10 0 EFAEHO O[C@H](C[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCC2)C(F)(F)F ZINC000663369016 482186066 /nfs/dbraw/zinc/18/60/66/482186066.db2.gz UZRAMESJLOZIQX-JKSUJKDBSA-N 1 3 342.405 2.802 10 0 EFAEHO O[C@@H](C[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCC2)C(F)(F)F ZINC000663369014 482186247 /nfs/dbraw/zinc/18/62/47/482186247.db2.gz UZRAMESJLOZIQX-HOTGVXAUSA-N 1 3 342.405 2.802 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000663419996 482222040 /nfs/dbraw/zinc/22/20/40/482222040.db2.gz KKHJODFVILZRRX-QGZVFWFLSA-N 1 3 334.508 2.709 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000663419996 482222043 /nfs/dbraw/zinc/22/20/43/482222043.db2.gz KKHJODFVILZRRX-QGZVFWFLSA-N 1 3 334.508 2.709 10 0 EFAEHO C[NH2+]CCCC(=O)N1CCC(NCc2ccc(F)cc2Cl)CC1 ZINC000663503425 482268090 /nfs/dbraw/zinc/26/80/90/482268090.db2.gz HPVZMZJWKCHSRZ-UHFFFAOYSA-N 1 3 341.858 2.559 10 0 EFAEHO C[C@@H](C[N@@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1)C(C)(C)C ZINC000663510218 482271878 /nfs/dbraw/zinc/27/18/78/482271878.db2.gz DUYWKXPMVXOSRG-HOTGVXAUSA-N 1 3 333.524 2.681 10 0 EFAEHO C[C@@H](C[N@H+]1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1)C(C)(C)C ZINC000663510218 482271884 /nfs/dbraw/zinc/27/18/84/482271884.db2.gz DUYWKXPMVXOSRG-HOTGVXAUSA-N 1 3 333.524 2.681 10 0 EFAEHO C[C@H]([NH3+])[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000668860278 482298624 /nfs/dbraw/zinc/29/86/24/482298624.db2.gz HOZVKNOMXSCFNY-FUHWJXTLSA-N 1 3 344.503 2.551 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1cc(F)cc(Cl)c1 ZINC000666355261 482300551 /nfs/dbraw/zinc/30/05/51/482300551.db2.gz XTFXKLZDLBDFAZ-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1cc(F)cc(Cl)c1 ZINC000666355261 482300556 /nfs/dbraw/zinc/30/05/56/482300556.db2.gz XTFXKLZDLBDFAZ-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO CCC(CC)[C@H](CNC(=O)N(CC)[C@H]1CCN(C)C1)[NH+]1CCCC1 ZINC000663560559 482301139 /nfs/dbraw/zinc/30/11/39/482301139.db2.gz WOYOFOAXLIOWNN-ROUUACIJSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[NH+]1CCC(NC(=O)CN[C@@H](CC2CC2)c2ccccc2)CC1 ZINC000663597386 482315314 /nfs/dbraw/zinc/31/53/14/482315314.db2.gz QEKGFLXRGORNAF-IBGZPJMESA-N 1 3 329.488 2.718 10 0 EFAEHO CCN(C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[C@@H]1CCN(C)C1 ZINC000663598734 482315924 /nfs/dbraw/zinc/31/59/24/482315924.db2.gz OJWDGXZXWOEWJJ-LJQANCHMSA-N 1 3 344.503 2.518 10 0 EFAEHO CCN(C(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1)[C@H]1CCN(CC)C1 ZINC000663654113 482332757 /nfs/dbraw/zinc/33/27/57/482332757.db2.gz DKVVVTBFWBJLKF-MSOLQXFVSA-N 1 3 338.540 2.624 10 0 EFAEHO CCN(C(=O)NCCCC[N@H+]1CCC[C@@H](C)C1)[C@H]1CCN(CC)C1 ZINC000663654113 482332762 /nfs/dbraw/zinc/33/27/62/482332762.db2.gz DKVVVTBFWBJLKF-MSOLQXFVSA-N 1 3 338.540 2.624 10 0 EFAEHO CCN(C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C)[C@H]1CC[N@H+](CC)C1 ZINC000663844498 482404731 /nfs/dbraw/zinc/40/47/31/482404731.db2.gz WSUTWZHMDUOPSC-OALUTQOASA-N 1 3 346.519 2.723 10 0 EFAEHO CCN(C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C)[C@H]1CC[N@@H+](CC)C1 ZINC000663844498 482404735 /nfs/dbraw/zinc/40/47/35/482404735.db2.gz WSUTWZHMDUOPSC-OALUTQOASA-N 1 3 346.519 2.723 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NCCC[NH2+]C1CCCCC1 ZINC000079116324 519336952 /nfs/dbraw/zinc/33/69/52/519336952.db2.gz VVBGMKJPCLHDGJ-QGZVFWFLSA-N 1 3 326.529 2.574 10 0 EFAEHO CC(C)C[C@H](C[NH+](C)C)NC(=O)N[C@@H](CN(C)C)c1ccccc1 ZINC000121441924 519338244 /nfs/dbraw/zinc/33/82/44/519338244.db2.gz GMUZJZBQVYZGKB-MSOLQXFVSA-N 1 3 334.508 2.565 10 0 EFAEHO CC(C)C[C@H](C[NH+](C)C)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000068224395 519340696 /nfs/dbraw/zinc/34/06/96/519340696.db2.gz SDKZEPOZENXRFZ-LJQANCHMSA-N 1 3 331.504 2.989 10 0 EFAEHO CC(C)[NH+](CCNC(=O)N[C@@H](CN(C)C)c1ccccc1)C(C)C ZINC000047683805 519647395 /nfs/dbraw/zinc/64/73/95/519647395.db2.gz NZWVXFGFLFRKHY-SFHVURJKSA-N 1 3 334.508 2.707 10 0 EFAEHO CC(C)[NH+]1CCC(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CC1 ZINC000179084758 519672050 /nfs/dbraw/zinc/67/20/50/519672050.db2.gz ZCVJSSBBZUOLCS-RBUKOAKNSA-N 1 3 344.503 2.604 10 0 EFAEHO CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)N[C@H](C)CN1CCCCC1)CC2 ZINC000246142009 519698859 /nfs/dbraw/zinc/69/88/59/519698859.db2.gz JOTCPPJJCKEDGJ-KURKYZTESA-N 1 3 336.524 2.518 10 0 EFAEHO CC(C)[N@H+]1[C@@H]2CC[C@H]1CN(C(=O)N[C@H](C)CN1CCCCC1)CC2 ZINC000246142009 519698862 /nfs/dbraw/zinc/69/88/62/519698862.db2.gz JOTCPPJJCKEDGJ-KURKYZTESA-N 1 3 336.524 2.518 10 0 EFAEHO CC(C)COC[C@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180113405 519758889 /nfs/dbraw/zinc/75/88/89/519758889.db2.gz OYMZLAGZXWFHON-OTYNDTSQSA-N 1 3 346.515 2.805 10 0 EFAEHO CC(C)COC[C@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180113405 519758891 /nfs/dbraw/zinc/75/88/91/519758891.db2.gz OYMZLAGZXWFHON-OTYNDTSQSA-N 1 3 346.515 2.805 10 0 EFAEHO CC(C)C[C@@H](C[NH+](C)C)NC(=O)N[C@@H](CN(C)C)c1ccccc1 ZINC000121441780 519775484 /nfs/dbraw/zinc/77/54/84/519775484.db2.gz GMUZJZBQVYZGKB-ROUUACIJSA-N 1 3 334.508 2.565 10 0 EFAEHO CC[N@H+](Cc1ccc(-c2nc([C@@H]3CNCCN3C)no2)cc1)C(C)C ZINC000263218357 521294766 /nfs/dbraw/zinc/29/47/66/521294766.db2.gz LJVGAOKHZIXDFN-KRWDZBQOSA-N 1 3 343.475 2.543 10 0 EFAEHO CC[N@@H+](Cc1ccc(-c2nc([C@@H]3CNCCN3C)no2)cc1)C(C)C ZINC000263218357 521294775 /nfs/dbraw/zinc/29/47/75/521294775.db2.gz LJVGAOKHZIXDFN-KRWDZBQOSA-N 1 3 343.475 2.543 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000177481159 521628098 /nfs/dbraw/zinc/62/80/98/521628098.db2.gz LOIQMJKKQMICPQ-MOPGFXCFSA-N 1 3 346.519 2.723 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000177481159 521628103 /nfs/dbraw/zinc/62/81/03/521628103.db2.gz LOIQMJKKQMICPQ-MOPGFXCFSA-N 1 3 346.519 2.723 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@@H](C)c1ccc(OC)c(Br)c1 ZINC000234802548 522669314 /nfs/dbraw/zinc/66/93/14/522669314.db2.gz YDXNYUOEPCAKEQ-AAEUAGOBSA-N 1 3 345.281 2.862 10 0 EFAEHO COc1cc([C@@H](C)[NH2+]C2CCN(C[C@@H]3CCOC3)CC2)ccc1F ZINC000153877522 522906056 /nfs/dbraw/zinc/90/60/56/522906056.db2.gz RBUZYDPXCIEQND-CABCVRRESA-N 1 3 336.451 2.986 10 0 EFAEHO COc1cc([C@H](C)[NH2+]C2CCN(C[C@H]3CCOC3)CC2)ccc1F ZINC000153877630 522942131 /nfs/dbraw/zinc/94/21/31/522942131.db2.gz RBUZYDPXCIEQND-LSDHHAIUSA-N 1 3 336.451 2.986 10 0 EFAEHO CN1CCC[C@H](CNC(=O)C2CC[NH+](C)CC2)[C@@H]1c1cccs1 ZINC000245445275 523750754 /nfs/dbraw/zinc/75/07/54/523750754.db2.gz YSKAJASMALQHDQ-NVXWUHKLSA-N 1 3 335.517 2.589 10 0 EFAEHO COC(=O)[C@@H]1C[C@@H](c2ccccc2)C[N@H+](CC[C@H]2CCCN2C)C1 ZINC000245575180 523771189 /nfs/dbraw/zinc/77/11/89/523771189.db2.gz HOGFMKNYUDXDHH-GUDVDZBRSA-N 1 3 330.472 2.749 10 0 EFAEHO COC(=O)[C@@H]1C[C@@H](c2ccccc2)C[N@@H+](CC[C@H]2CCCN2C)C1 ZINC000245575180 523771195 /nfs/dbraw/zinc/77/11/95/523771195.db2.gz HOGFMKNYUDXDHH-GUDVDZBRSA-N 1 3 330.472 2.749 10 0 EFAEHO COC(=O)[C@@H]1C[C@H](c2ccccc2)C[N@H+](CC[C@H]2CCCN2C)C1 ZINC000245575185 523794585 /nfs/dbraw/zinc/79/45/85/523794585.db2.gz HOGFMKNYUDXDHH-IPMKNSEASA-N 1 3 330.472 2.749 10 0 EFAEHO COC(=O)[C@@H]1C[C@H](c2ccccc2)C[N@@H+](CC[C@H]2CCCN2C)C1 ZINC000245575185 523794587 /nfs/dbraw/zinc/79/45/87/523794587.db2.gz HOGFMKNYUDXDHH-IPMKNSEASA-N 1 3 330.472 2.749 10 0 EFAEHO Cc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)c(-n2cc(Cl)cn2)n1 ZINC000193337979 524572510 /nfs/dbraw/zinc/57/25/10/524572510.db2.gz ADSOBWJOSZCOJJ-ALOPSCKCSA-N 1 3 345.878 2.944 10 0 EFAEHO Cc1cccc(NC(=O)[C@@H]2CCC[N@H+](CCCN3CCCCC3)C2)n1 ZINC000193474154 524647157 /nfs/dbraw/zinc/64/71/57/524647157.db2.gz AAWBITROMWLQDF-GOSISDBHSA-N 1 3 344.503 2.917 10 0 EFAEHO Cc1cccc(NC(=O)[C@@H]2CCC[N@@H+](CCCN3CCCCC3)C2)n1 ZINC000193474154 524647161 /nfs/dbraw/zinc/64/71/61/524647161.db2.gz AAWBITROMWLQDF-GOSISDBHSA-N 1 3 344.503 2.917 10 0 EFAEHO Cc1cccc(NC(=O)[C@H]2CCC[N@@H+](CC[C@H]3CCCN3C)C2)n1 ZINC000245698256 524656214 /nfs/dbraw/zinc/65/62/14/524656214.db2.gz RELFHCJMDNUIAO-DLBZAZTESA-N 1 3 330.476 2.525 10 0 EFAEHO Cc1cccc(NC(=O)[C@H]2CCC[N@H+](CC[C@H]3CCCN3C)C2)n1 ZINC000245698256 524656220 /nfs/dbraw/zinc/65/62/20/524656220.db2.gz RELFHCJMDNUIAO-DLBZAZTESA-N 1 3 330.476 2.525 10 0 EFAEHO C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1Nc1ccc(OC2CCN(C)CC2)nc1 ZINC000179744199 524911632 /nfs/dbraw/zinc/91/16/32/524911632.db2.gz VZQMNBGJBBBMLQ-VKJFTORMSA-N 1 3 332.492 2.695 10 0 EFAEHO C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1Nc1ccc(OC2CCN(C)CC2)nc1 ZINC000179744199 524911638 /nfs/dbraw/zinc/91/16/38/524911638.db2.gz VZQMNBGJBBBMLQ-VKJFTORMSA-N 1 3 332.492 2.695 10 0 EFAEHO CSC[C@H](CCO)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245704912 525702070 /nfs/dbraw/zinc/70/20/70/525702070.db2.gz MHHBTBXORAUYAA-OKYOBFRVSA-N 1 3 334.529 2.886 10 0 EFAEHO CSC[C@H](CCO)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245704912 525702076 /nfs/dbraw/zinc/70/20/76/525702076.db2.gz MHHBTBXORAUYAA-OKYOBFRVSA-N 1 3 334.529 2.886 10 0 EFAEHO Cc1ccc([C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)N2CCOCC2)s1 ZINC000192984980 525762832 /nfs/dbraw/zinc/76/28/32/525762832.db2.gz NCBYBLSQZMTUIU-HQSKLWIPSA-N 1 3 349.544 2.645 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)N2CC[C@H]([NH+](C)C)C2)CC1 ZINC000116561425 526097340 /nfs/dbraw/zinc/09/73/40/526097340.db2.gz TWWUPBWKNASMOW-APWZRJJASA-N 1 3 344.503 2.558 10 0 EFAEHO Cc1nn(C)c(C)c1CC[NH2+][C@H](C)c1cccc(OCCN(C)C)c1 ZINC000177745178 527625977 /nfs/dbraw/zinc/62/59/77/527625977.db2.gz TWSUINPQPRGJRK-OAHLLOKOSA-N 1 3 344.503 2.871 10 0 EFAEHO CCCc1ccc([C@H](C)N(CC(N)=O)C[C@@H]2CC[NH2+][C@@H](C)C2)cc1 ZINC000414737848 535426189 /nfs/dbraw/zinc/42/61/89/535426189.db2.gz DPTKKKPSDLFSMA-XYJFISCASA-N 1 3 331.504 2.876 10 0 EFAEHO CC[NH+](CC)CCCC1CCN(C(=O)NC[C@@H]2CCCN2C)CC1 ZINC000360244316 535498462 /nfs/dbraw/zinc/49/84/62/535498462.db2.gz ZVNOGEIYARIOJG-SFHVURJKSA-N 1 3 338.540 2.624 10 0 EFAEHO C[NH+](C)C[C@@H]1CCCN1C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000427726889 535941932 /nfs/dbraw/zinc/94/19/32/535941932.db2.gz OGNPBOGGMZPQTC-MJGOQNOKSA-N 1 3 347.478 2.590 10 0 EFAEHO CCc1ccccc1[C@@H](N)CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000417783607 535979552 /nfs/dbraw/zinc/97/95/52/535979552.db2.gz HUCGSVPBWQOMCA-PHSGOXPASA-N 1 3 344.503 2.563 10 0 EFAEHO CCc1ccccc1[C@@H](N)CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000417783607 535979555 /nfs/dbraw/zinc/97/95/55/535979555.db2.gz HUCGSVPBWQOMCA-PHSGOXPASA-N 1 3 344.503 2.563 10 0 EFAEHO COC1(CNCc2ccncc2OCCC[NH+](C)C)CCCCC1 ZINC000342420520 536681224 /nfs/dbraw/zinc/68/12/24/536681224.db2.gz BQGOOCZSJDBPSJ-UHFFFAOYSA-N 1 3 335.492 2.851 10 0 EFAEHO [NH3+]C[C@H]1CCC[C@H]1C(=O)NCc1ccccc1CN1CCCCC1 ZINC000261700082 545620446 /nfs/dbraw/zinc/62/04/46/545620446.db2.gz IHOSIJZQWHSSHE-VQIMIIECSA-N 1 3 329.488 2.664 10 0 EFAEHO Cn1cc(CCC[NH2+][C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]23)cn1 ZINC000313990614 545810359 /nfs/dbraw/zinc/81/03/59/545810359.db2.gz NWLYDBULEMKORP-NJDAHSKKSA-N 1 3 338.499 2.853 10 0 EFAEHO C[C@@H](CN1CCCCC[C@@H]1CCO)C[N@@H+]1CCCCC[C@H]1CCO ZINC000342042279 545944671 /nfs/dbraw/zinc/94/46/71/545944671.db2.gz FVDVBLWXQCGNIO-ACDBMABISA-N 1 3 340.552 2.877 10 0 EFAEHO C[C@@H](CN1CCCCC[C@@H]1CCO)C[N@H+]1CCCCC[C@H]1CCO ZINC000342042279 545944673 /nfs/dbraw/zinc/94/46/73/545944673.db2.gz FVDVBLWXQCGNIO-ACDBMABISA-N 1 3 340.552 2.877 10 0 EFAEHO C[C@H](CN1CCCCC[C@H]1CCO)C[N@@H+]1CCCCC[C@@H]1CCO ZINC000342042279 545944677 /nfs/dbraw/zinc/94/46/77/545944677.db2.gz FVDVBLWXQCGNIO-ACDBMABISA-N 1 3 340.552 2.877 10 0 EFAEHO C[C@H](CN1CCCCC[C@H]1CCO)C[N@H+]1CCCCC[C@@H]1CCO ZINC000342042279 545944680 /nfs/dbraw/zinc/94/46/80/545944680.db2.gz FVDVBLWXQCGNIO-ACDBMABISA-N 1 3 340.552 2.877 10 0 EFAEHO CC[NH+](CC)CC1CCN(Cc2cnn(CC(F)(F)F)c2)CC1 ZINC000350216040 546016915 /nfs/dbraw/zinc/01/69/15/546016915.db2.gz GDNOWSMLBPASJY-UHFFFAOYSA-N 1 3 332.414 2.999 10 0 EFAEHO Cc1ccc(C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)cn1 ZINC000397609350 546170537 /nfs/dbraw/zinc/17/05/37/546170537.db2.gz QTYYDORCFDVRRR-UHFFFAOYSA-N 1 3 325.456 2.507 10 0 EFAEHO CCCN1CCN(c2ccccc2CN[C@@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000414926942 546194330 /nfs/dbraw/zinc/19/43/30/546194330.db2.gz OHYNDYHBGNDVDO-RTBURBONSA-N 1 3 330.520 2.578 10 0 EFAEHO C[C@H]1CC[C@H]([NH2+]Cc2ccc(CN3CCN(C)CC3)cc2)CS1 ZINC000655697230 546537661 /nfs/dbraw/zinc/53/76/61/546537661.db2.gz OTHOWOHDDCEFTH-LPHOPBHVSA-N 1 3 333.545 2.808 10 0 EFAEHO C[C@@H]1CC[C@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CS1 ZINC000655777780 546577214 /nfs/dbraw/zinc/57/72/14/546577214.db2.gz ZEGYRLPPECBECA-AEFFLSMTSA-N 1 3 334.529 2.887 10 0 EFAEHO Cc1c([C@@H](C)NC[C@H]2C[C@@H]([NH+](C)C)C2)nnn1-c1ccc(C)cc1 ZINC000655805098 546591806 /nfs/dbraw/zinc/59/18/06/546591806.db2.gz BSFRVXIGNANKDP-KYJSFNMBSA-N 1 3 327.476 2.875 10 0 EFAEHO c1c(CNC2CCCC2)nnn1[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000656455517 546805740 /nfs/dbraw/zinc/80/57/40/546805740.db2.gz KJPPXNAUDXMWMZ-IBGZPJMESA-N 1 3 325.460 2.757 10 0 EFAEHO c1c(CNC2CCCC2)nnn1[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000656455518 546806318 /nfs/dbraw/zinc/80/63/18/546806318.db2.gz KJPPXNAUDXMWMZ-LJQANCHMSA-N 1 3 325.460 2.757 10 0 EFAEHO [NH3+]Cc1ccc(-c2cn([C@@H]3CCN(Cc4ccccc4)C3)nn2)cc1 ZINC000656455976 546806586 /nfs/dbraw/zinc/80/65/86/546806586.db2.gz QVQCKMZYANXTIJ-LJQANCHMSA-N 1 3 333.439 2.851 10 0 EFAEHO CC[C@@H]1C[C@@H]([NH2+]CCCCN2CCN(c3ccccc3)CC2)CO1 ZINC000657315163 547105983 /nfs/dbraw/zinc/10/59/83/547105983.db2.gz NCTANZQEIVVLCP-UYAOXDASSA-N 1 3 331.504 2.746 10 0 EFAEHO CC[C@@H]1C[C@H]([NH2+]CCCCN2CCN(Cc3ccccc3)CC2)CO1 ZINC000657314895 547106137 /nfs/dbraw/zinc/10/61/37/547106137.db2.gz GBSAHDTVVIMYSH-LEWJYISDSA-N 1 3 345.531 2.742 10 0 EFAEHO C[NH+](C)C1CCC(NCc2c(F)cncc2Br)CC1 ZINC000657494045 547183914 /nfs/dbraw/zinc/18/39/14/547183914.db2.gz LPXKGTAPVFAVJE-UHFFFAOYSA-N 1 3 330.245 2.946 10 0 EFAEHO Cn1nc(CNCC2CC[NH+](C3CCOCC3)CC2)c2ccccc21 ZINC000657534509 547195204 /nfs/dbraw/zinc/19/52/04/547195204.db2.gz ACWDCMBNRUJHPW-UHFFFAOYSA-N 1 3 342.487 2.554 10 0 EFAEHO c1cc(-c2ccc(CNCC3CC[NH+](C4CCOCC4)CC3)o2)n[nH]1 ZINC000657537307 547196619 /nfs/dbraw/zinc/19/66/19/547196619.db2.gz HGVQHVBZCXTTNK-UHFFFAOYSA-N 1 3 344.459 2.650 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)NCc1nc2ccc(F)cc2s1 ZINC000657573417 547211882 /nfs/dbraw/zinc/21/18/82/547211882.db2.gz MWACVHIBSGHHKC-ZDUSSCGKSA-N 1 3 338.496 2.797 10 0 EFAEHO CCOc1ccc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000657593567 547220704 /nfs/dbraw/zinc/22/07/04/547220704.db2.gz AMRMCZZROYOIPO-HXUWFJFHSA-N 1 3 340.467 2.942 10 0 EFAEHO CCOc1ccc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000657593567 547220707 /nfs/dbraw/zinc/22/07/07/547220707.db2.gz AMRMCZZROYOIPO-HXUWFJFHSA-N 1 3 340.467 2.942 10 0 EFAEHO COc1cccc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000657593732 547220815 /nfs/dbraw/zinc/22/08/15/547220815.db2.gz JXRKYKGRJKMQBJ-LJQANCHMSA-N 1 3 326.440 2.552 10 0 EFAEHO COc1cccc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000657593732 547220817 /nfs/dbraw/zinc/22/08/17/547220817.db2.gz JXRKYKGRJKMQBJ-LJQANCHMSA-N 1 3 326.440 2.552 10 0 EFAEHO COc1cccc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1 ZINC000657593731 547221014 /nfs/dbraw/zinc/22/10/14/547221014.db2.gz JXRKYKGRJKMQBJ-IBGZPJMESA-N 1 3 326.440 2.552 10 0 EFAEHO COc1cccc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1 ZINC000657593731 547221019 /nfs/dbraw/zinc/22/10/19/547221019.db2.gz JXRKYKGRJKMQBJ-IBGZPJMESA-N 1 3 326.440 2.552 10 0 EFAEHO COCc1cccc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000657595713 547221616 /nfs/dbraw/zinc/22/16/16/547221616.db2.gz RTLRCTIQGGEERM-OAQYLSRUSA-N 1 3 340.467 2.689 10 0 EFAEHO COCc1cccc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000657595713 547221621 /nfs/dbraw/zinc/22/16/21/547221621.db2.gz RTLRCTIQGGEERM-OAQYLSRUSA-N 1 3 340.467 2.689 10 0 EFAEHO COc1cc(F)cc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000657597639 547224379 /nfs/dbraw/zinc/22/43/79/547224379.db2.gz VYHXCSVLFOGMRJ-LJQANCHMSA-N 1 3 344.430 2.691 10 0 EFAEHO COc1cc(F)cc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000657597639 547224382 /nfs/dbraw/zinc/22/43/82/547224382.db2.gz VYHXCSVLFOGMRJ-LJQANCHMSA-N 1 3 344.430 2.691 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H](CO)CC2CC2)CC1 ZINC000657701434 547257509 /nfs/dbraw/zinc/25/75/09/547257509.db2.gz XYAWEWAQHWNEAF-IBGZPJMESA-N 1 3 345.531 2.717 10 0 EFAEHO C[C@@H](O)[C@H](NCc1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000657820394 547294605 /nfs/dbraw/zinc/29/46/05/547294605.db2.gz VUOLBYBAGBJQCG-UZLBHIALSA-N 1 3 328.456 2.839 10 0 EFAEHO COC[C@@H](CC1CCOCC1)NCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000657839419 547298525 /nfs/dbraw/zinc/29/85/25/547298525.db2.gz UXGJSMLYZJBGEL-ZIFCJYIRSA-N 1 3 326.525 2.776 10 0 EFAEHO COC[C@@H](CC1CCOCC1)NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000657839419 547298532 /nfs/dbraw/zinc/29/85/32/547298532.db2.gz UXGJSMLYZJBGEL-ZIFCJYIRSA-N 1 3 326.525 2.776 10 0 EFAEHO COC[C@@H](CC1CCOCC1)[NH2+]CCCN1C[C@H](C)C[C@H](C)C1 ZINC000657839419 547298535 /nfs/dbraw/zinc/29/85/35/547298535.db2.gz UXGJSMLYZJBGEL-ZIFCJYIRSA-N 1 3 326.525 2.776 10 0 EFAEHO CN1CCN(Cc2ccc(C[NH2+][C@@H]3CCCSCC3)cc2)CC1 ZINC000657842927 547299669 /nfs/dbraw/zinc/29/96/69/547299669.db2.gz LLAGUKLKGVUBBY-LJQANCHMSA-N 1 3 333.545 2.809 10 0 EFAEHO c1ccc(N2CCN(CCCC[NH2+][C@H]3COC4(CCC4)C3)CC2)cc1 ZINC000657849287 547301748 /nfs/dbraw/zinc/30/17/48/547301748.db2.gz FYQUETZIFMDVPD-LJQANCHMSA-N 1 3 343.515 2.890 10 0 EFAEHO COC1([C@@H](C)[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCC1 ZINC000658034328 547339780 /nfs/dbraw/zinc/33/97/80/547339780.db2.gz HUEJNTGVYRCSTF-QGZVFWFLSA-N 1 3 332.488 2.561 10 0 EFAEHO OC1(C[NH2+][C@@H]2CCCSCC2)CCN(Cc2ccccc2)CC1 ZINC000658037828 547340195 /nfs/dbraw/zinc/34/01/95/547340195.db2.gz YULUNZCWCXTUOT-GOSISDBHSA-N 1 3 334.529 2.889 10 0 EFAEHO COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000658134294 547366451 /nfs/dbraw/zinc/36/64/51/547366451.db2.gz ACIZERCZXRWYIN-SLFFLAALSA-N 1 3 332.488 2.548 10 0 EFAEHO C[C@@H](CC1CCOCC1)[NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000658138159 547367992 /nfs/dbraw/zinc/36/79/92/547367992.db2.gz IWHKVRGPWCNBDN-JXFKEZNVSA-N 1 3 332.488 2.548 10 0 EFAEHO CC[C@@H]([NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1)C1CCOCC1 ZINC000658137557 547368208 /nfs/dbraw/zinc/36/82/08/547368208.db2.gz HKTRYRWQBXQJCS-VQTJNVASSA-N 1 3 332.488 2.548 10 0 EFAEHO C[C@@H](NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cccc(O)c1 ZINC000658139578 547369189 /nfs/dbraw/zinc/36/91/89/547369189.db2.gz QFQCUROEHVQBTQ-QRWLVFNGSA-N 1 3 326.440 2.810 10 0 EFAEHO C[C@@H](NCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1)c1cccc(O)c1 ZINC000658139578 547369195 /nfs/dbraw/zinc/36/91/95/547369195.db2.gz QFQCUROEHVQBTQ-QRWLVFNGSA-N 1 3 326.440 2.810 10 0 EFAEHO C[C@@H](Cn1cncn1)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658317041 547418086 /nfs/dbraw/zinc/41/80/86/547418086.db2.gz IPXJOVZUYSRGKP-PKOBYXMFSA-N 1 3 339.487 2.559 10 0 EFAEHO C[C@@H](Cn1cncn1)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000658317041 547418090 /nfs/dbraw/zinc/41/80/90/547418090.db2.gz IPXJOVZUYSRGKP-PKOBYXMFSA-N 1 3 339.487 2.559 10 0 EFAEHO C(=C\C[N@@H+]1CC[C@@]2(C1)CCCOC2)\CN1CC[C@]2(C1)CCCOC2 ZINC000671253909 547551005 /nfs/dbraw/zinc/55/10/05/547551005.db2.gz OJURGGIHSNYSIN-DZNLNZEASA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C\C[N@H+]1CC[C@@]2(C1)CCCOC2)\CN1CC[C@]2(C1)CCCOC2 ZINC000671253909 547551008 /nfs/dbraw/zinc/55/10/08/547551008.db2.gz OJURGGIHSNYSIN-DZNLNZEASA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C\C[N@@H+]1CC[C@]2(C1)CCCOC2)\CN1CC[C@@]2(C1)CCCOC2 ZINC000671253909 547551010 /nfs/dbraw/zinc/55/10/10/547551010.db2.gz OJURGGIHSNYSIN-DZNLNZEASA-N 1 3 334.504 2.548 10 0 EFAEHO C(=C\C[N@H+]1CC[C@]2(C1)CCCOC2)\CN1CC[C@@]2(C1)CCCOC2 ZINC000671253909 547551012 /nfs/dbraw/zinc/55/10/12/547551012.db2.gz OJURGGIHSNYSIN-DZNLNZEASA-N 1 3 334.504 2.548 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@@H]32)c(N2CCCC2)n1 ZINC000671759974 547667918 /nfs/dbraw/zinc/66/79/18/547667918.db2.gz FPQXMRYGJLGLRT-QRVBRYPASA-N 1 3 328.504 2.953 10 0 EFAEHO C[C@@H]1CN(CCCC[NH2+][C@@H]2CCN(c3ccccc3)C2)C[C@H](C)O1 ZINC000674880613 548170561 /nfs/dbraw/zinc/17/05/61/548170561.db2.gz RIHNFBUDIYNAJF-CEXWTWQISA-N 1 3 331.504 2.744 10 0 EFAEHO CC[C@@H]([NH2+][C@@H]1CCN(C2CCN(C)CC2)C1)c1cccc(OC)c1 ZINC000675875879 548366394 /nfs/dbraw/zinc/36/63/94/548366394.db2.gz UHQNCJZZQDUWAJ-YLJYHZDGSA-N 1 3 331.504 2.904 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN2CCC[C@@H](n3ccnc3)C2)cc1 ZINC000678234278 548871849 /nfs/dbraw/zinc/87/18/49/548871849.db2.gz CQXNMLOZOUMSLN-GOSISDBHSA-N 1 3 328.460 2.661 10 0 EFAEHO c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](NCCOC[C@H]2CCCO2)C3)cc1 ZINC000679394215 549119450 /nfs/dbraw/zinc/11/94/50/549119450.db2.gz IJMDPZDOEMZLSW-PLACYPQZSA-N 1 3 344.499 2.967 10 0 EFAEHO c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](NCCOC[C@H]2CCCO2)C3)cc1 ZINC000679394215 549119453 /nfs/dbraw/zinc/11/94/53/549119453.db2.gz IJMDPZDOEMZLSW-PLACYPQZSA-N 1 3 344.499 2.967 10 0 EFAEHO CC(C)[C@H](C[N@H+](C)Cc1ccccc1)NC(=O)N[C@H]1CCCN(C)C1 ZINC000681095209 549461004 /nfs/dbraw/zinc/46/10/04/549461004.db2.gz NUIIQSHIWKMNPV-OALUTQOASA-N 1 3 346.519 2.536 10 0 EFAEHO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)N[C@H]1CCCN(C)C1 ZINC000681095209 549461007 /nfs/dbraw/zinc/46/10/07/549461007.db2.gz NUIIQSHIWKMNPV-OALUTQOASA-N 1 3 346.519 2.536 10 0 EFAEHO C[C@@H]1CN(Cc2ccc3cnccc3c2)CC[C@@H]1[NH+]1CCN(C)CC1 ZINC000683833114 549952592 /nfs/dbraw/zinc/95/25/92/549952592.db2.gz UBAQVLHBQAYGFQ-UTKZUKDTSA-N 1 3 338.499 2.693 10 0 EFAEHO CO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(CN3CCC(O)CC3)cc2)C1 ZINC000684366956 550030800 /nfs/dbraw/zinc/03/08/00/550030800.db2.gz XOQGJEPNKXPPJZ-AZUAARDMSA-N 1 3 332.488 2.691 10 0 EFAEHO c1cc(OCC[NH+]2CCCC2)ccc1CN1CC([C@H]2CCOC2)C1 ZINC000684414400 550036911 /nfs/dbraw/zinc/03/69/11/550036911.db2.gz IFORQNYNZYARGU-SFHVURJKSA-N 1 3 330.472 2.630 10 0 EFAEHO CN1CC[C@H](NC(=O)CCCC[NH+]2CCCC2)[C@@H]1c1ccccc1 ZINC000759953500 575961501 /nfs/dbraw/zinc/96/15/01/575961501.db2.gz IBLHMLJXUNRXGY-ICSRJNTNSA-N 1 3 329.488 2.814 10 0 EFAEHO CN1CC[C@@H](NC(=O)CCCC[NH+]2CCCC2)[C@H]1c1ccccc1 ZINC000759953506 575961590 /nfs/dbraw/zinc/96/15/90/575961590.db2.gz IBLHMLJXUNRXGY-UYAOXDASSA-N 1 3 329.488 2.814 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](NCCSC(F)(F)F)[C@H](C)C1 ZINC000765240909 577022184 /nfs/dbraw/zinc/02/21/84/577022184.db2.gz ZVPXQHYBDDAFRJ-CHWSQXEVSA-N 1 3 328.444 2.966 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](NCCSC(F)(F)F)[C@H](C)C1 ZINC000765240909 577022186 /nfs/dbraw/zinc/02/21/86/577022186.db2.gz ZVPXQHYBDDAFRJ-CHWSQXEVSA-N 1 3 328.444 2.966 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](NCCSC(F)(F)F)[C@@H](C)C1 ZINC000765240911 577022302 /nfs/dbraw/zinc/02/23/02/577022302.db2.gz ZVPXQHYBDDAFRJ-QWHCGFSZSA-N 1 3 328.444 2.966 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](NCCSC(F)(F)F)[C@@H](C)C1 ZINC000765240911 577022304 /nfs/dbraw/zinc/02/23/04/577022304.db2.gz ZVPXQHYBDDAFRJ-QWHCGFSZSA-N 1 3 328.444 2.966 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCCOc1cccnc1 ZINC000765998169 577097030 /nfs/dbraw/zinc/09/70/30/577097030.db2.gz QWSIHJIBLKMOQM-XLIONFOSSA-N 1 3 325.456 2.961 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCCOc1cccnc1 ZINC000765998169 577097032 /nfs/dbraw/zinc/09/70/32/577097032.db2.gz QWSIHJIBLKMOQM-XLIONFOSSA-N 1 3 325.456 2.961 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCCOc1cccnc1 ZINC000765998168 577097063 /nfs/dbraw/zinc/09/70/63/577097063.db2.gz QWSIHJIBLKMOQM-PXNSSMCTSA-N 1 3 325.456 2.961 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCCOc1cccnc1 ZINC000765998168 577097064 /nfs/dbraw/zinc/09/70/64/577097064.db2.gz QWSIHJIBLKMOQM-PXNSSMCTSA-N 1 3 325.456 2.961 10 0 EFAEHO CC1(C)OCC([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)CO1 ZINC000774350467 581490021 /nfs/dbraw/zinc/49/00/21/581490021.db2.gz YQQHYBONNDXIQD-LUPIEILUSA-N 1 3 330.472 2.923 10 0 EFAEHO CN(CC[NH2+]Cc1ccc(C2CCC2)cc1)C(=O)CN(C)C1CCC1 ZINC001691347597 1248680227 /nfs/dbraw/zinc/68/02/27/1248680227.db2.gz HKRAXCUUEOUFEU-UHFFFAOYSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)CCC[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN(C)C(C)C ZINC001691384274 1248717676 /nfs/dbraw/zinc/71/76/76/1248717676.db2.gz KGBLTBDLJVLGOX-MSOLQXFVSA-N 1 3 325.541 2.980 10 0 EFAEHO c1nc2c([nH]1)C[C@@H]([NH2+]C1[C@@H]3CC[C@H]1CN(Cc1ccccc1)C3)CC2 ZINC001772526783 1248030066 /nfs/dbraw/zinc/03/00/66/1248030066.db2.gz RRZJIWHAMYSABJ-YQMJFVBQSA-N 1 3 336.483 2.767 10 0 EFAEHO c1nc2c([nH]1)CC[C@H]([NH2+]C1[C@@H]3CC[C@H]1CN(Cc1ccccc1)C3)C2 ZINC001772526783 1248030075 /nfs/dbraw/zinc/03/00/75/1248030075.db2.gz RRZJIWHAMYSABJ-YQMJFVBQSA-N 1 3 336.483 2.767 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001691159982 1248488263 /nfs/dbraw/zinc/48/82/63/1248488263.db2.gz PIYWPZKRINQQDQ-QFBILLFUSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCCC[N@H+]1CC[C@@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001691159982 1248488267 /nfs/dbraw/zinc/48/82/67/1248488267.db2.gz PIYWPZKRINQQDQ-QFBILLFUSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccc(CN2CC[C@H](CNC(=O)CCCC[NH+](C)C)C2)cc1F ZINC001691166404 1248498151 /nfs/dbraw/zinc/49/81/51/1248498151.db2.gz RWICEIJNFSSEAN-GOSISDBHSA-N 1 3 349.494 2.804 10 0 EFAEHO C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@@H]1CC[NH2+]CC1CC(C)(C)C1 ZINC001691306617 1248639224 /nfs/dbraw/zinc/63/92/24/1248639224.db2.gz VXQYQDRIEHFJII-CRAIPNDOSA-N 1 3 346.519 2.995 10 0 EFAEHO CC(C)(C(=O)N1CCCCC[C@H]([NH2+]CCCF)C1)N1CCCC1 ZINC001691625235 1251847129 /nfs/dbraw/zinc/84/71/29/1251847129.db2.gz DVYXMPMAUSHKJU-INIZCTEOSA-N 1 3 327.488 2.581 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@]1(C)CCN(Cc2ccc(C3CCC3)cc2)C1 ZINC001484058775 1252120948 /nfs/dbraw/zinc/12/09/48/1252120948.db2.gz UQOTWRFNVRSCGI-NRFANRHFSA-N 1 3 343.515 2.986 10 0 EFAEHO C[C@@]1(C[NH2+]CCCCC(F)(F)F)CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001484114455 1252266248 /nfs/dbraw/zinc/26/62/48/1252266248.db2.gz NEYMKEWPUIKQRJ-HNNXBMFYSA-N 1 3 346.397 2.513 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@](C)(C[NH2+]CCCC(C)(C)C)C1 ZINC001484122940 1252298870 /nfs/dbraw/zinc/29/88/70/1252298870.db2.gz MQXIRSQLVKDQKZ-LJQANCHMSA-N 1 3 325.541 2.983 10 0 EFAEHO C[C@@H]([NH2+]CCCC1CCC1)[C@@H]1CCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001484338530 1252423757 /nfs/dbraw/zinc/42/37/57/1252423757.db2.gz LDYAUTQCWZCIIS-SJLPKXTDSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H]([NH2+]CCCC1CCC1)[C@@H]1CCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001484338529 1252424247 /nfs/dbraw/zinc/42/42/47/1252424247.db2.gz LDYAUTQCWZCIIS-FUHWJXTLSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([C@@H](C)[NH2+]CC2CC3(CCC3)C2)C1 ZINC001484358594 1252443220 /nfs/dbraw/zinc/44/32/20/1252443220.db2.gz OEIZCBPOLLUXEJ-SJLPKXTDSA-N 1 3 335.536 2.734 10 0 EFAEHO CC/C=C/CC[NH2+][C@H](C)[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001484353759 1252445700 /nfs/dbraw/zinc/44/57/00/1252445700.db2.gz HDWYJERXBOMQNJ-YSKLNCTFSA-N 1 3 335.536 2.901 10 0 EFAEHO CC/C=C\CC[NH2+][C@H](C)[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001484353757 1252445749 /nfs/dbraw/zinc/44/57/49/1252445749.db2.gz HDWYJERXBOMQNJ-WYNBNGFRSA-N 1 3 335.536 2.901 10 0 EFAEHO CC/C=C/CC[NH2+][C@H](C)[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001484353752 1252446019 /nfs/dbraw/zinc/44/60/19/1252446019.db2.gz HDWYJERXBOMQNJ-ASIGSXEYSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2ccc(CF)cc2)C1 ZINC001484383849 1252487570 /nfs/dbraw/zinc/48/75/70/1252487570.db2.gz DJWGANHHHFIGDH-APWZRJJASA-N 1 3 349.494 2.680 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2ccc(C)cc2C)C1 ZINC001484381851 1252495444 /nfs/dbraw/zinc/49/54/44/1252495444.db2.gz BHRSZAOSXOETEG-QUCCMNQESA-N 1 3 345.531 2.829 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)CCCN(C)Cc1ccsc1 ZINC001484743626 1252855068 /nfs/dbraw/zinc/85/50/68/1252855068.db2.gz DWDDZEFACWBHQY-QGZVFWFLSA-N 1 3 337.533 2.903 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N(C)CCCN(C)Cc1ccsc1 ZINC001484743626 1252855078 /nfs/dbraw/zinc/85/50/78/1252855078.db2.gz DWDDZEFACWBHQY-QGZVFWFLSA-N 1 3 337.533 2.903 10 0 EFAEHO CN(CCCN(C)C(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12)CCC(F)(F)F ZINC001484747235 1252904762 /nfs/dbraw/zinc/90/47/62/1252904762.db2.gz NOHTVYHUHOQLLX-LSDHHAIUSA-N 1 3 349.441 2.736 10 0 EFAEHO CN(CCCN(C)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12)CCC(F)(F)F ZINC001484747235 1252904768 /nfs/dbraw/zinc/90/47/68/1252904768.db2.gz NOHTVYHUHOQLLX-LSDHHAIUSA-N 1 3 349.441 2.736 10 0 EFAEHO Cc1ccc(CCC[NH2+]C[C@H]2CCCN2C(=O)[C@@H]2CCCN2C)cc1 ZINC001671280415 1260069290 /nfs/dbraw/zinc/06/92/90/1260069290.db2.gz BYPGANMPHJLFQQ-UXHICEINSA-N 1 3 343.515 2.602 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccc(Cl)cc1)NC(=O)CN(C)C1CCC1 ZINC001272829554 1261095200 /nfs/dbraw/zinc/09/52/00/1261095200.db2.gz LFWADSXRLWEZJU-CQSZACIVSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@H](CC[NH2+]Cc1cc2ccccc2o1)NC(=O)CN(C)C1CCC1 ZINC001272829868 1261098280 /nfs/dbraw/zinc/09/82/80/1261098280.db2.gz MLWBPVPYTMTUBL-OAHLLOKOSA-N 1 3 343.471 2.902 10 0 EFAEHO CN(CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H]1CCN(c2ccccc2)C1=O ZINC000923310801 1261460284 /nfs/dbraw/zinc/46/02/84/1261460284.db2.gz AXKDRJGBUSDOFY-RGPMPMONSA-N 1 3 327.472 2.644 10 0 EFAEHO Clc1ccc(N2CCN(CCC3C[C@H]4CC[C@@H](C3)[NH2+]4)CC2)nc1 ZINC000923320910 1261469609 /nfs/dbraw/zinc/46/96/09/1261469609.db2.gz IJZZSEVRJIOOCE-ZXFUBFMLSA-N 1 3 334.895 2.778 10 0 EFAEHO COc1ccc([C@H](NC[C@H]2CC3(C[NH2+]C3)CO2)c2ccccc2)cc1 ZINC000923387663 1261596505 /nfs/dbraw/zinc/59/65/05/1261596505.db2.gz YLJBYIKBHKVRHG-WOJBJXKFSA-N 1 3 338.451 2.753 10 0 EFAEHO CC(C)(C)[C@]1(C[NH3+])CCN(C[C@H](O)COc2ccc(Cl)cc2)C1 ZINC000923413130 1261627505 /nfs/dbraw/zinc/62/75/05/1261627505.db2.gz DOFKNJMYBZCLJA-YJBOKZPZSA-N 1 3 340.895 2.777 10 0 EFAEHO COC(=O)c1cncc(CN2CCC[C@@H](C[C@H]([NH3+])C3CCCC3)C2)c1 ZINC000923422423 1261630183 /nfs/dbraw/zinc/63/01/83/1261630183.db2.gz RRJXJTRAENJONN-KXBFYZLASA-N 1 3 345.487 2.988 10 0 EFAEHO C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923496331 1261765309 /nfs/dbraw/zinc/76/53/09/1261765309.db2.gz BEMWAICCAJMVQH-LVQVYYBASA-N 1 3 335.517 2.717 10 0 EFAEHO CC[C@@H]1c2ccsc2CCN1C(=O)CN1CC[C@H](C[NH3+])[C@@H](C)C1 ZINC000923498642 1261793607 /nfs/dbraw/zinc/79/36/07/1261793607.db2.gz IQPRZLHUJFYEHR-SQWLQELKSA-N 1 3 335.517 2.501 10 0 EFAEHO C[C@H](NC(=O)[C@H](C)N1CC[C@H](C[NH3+])[C@@H](C)C1)c1cc2ccccc2o1 ZINC000923499949 1261795631 /nfs/dbraw/zinc/79/56/31/1261795631.db2.gz OUSIKIWRBCTQCY-QBYUYEEZSA-N 1 3 343.471 2.915 10 0 EFAEHO CCC[C@H](NC(=O)[C@H](C)N1CC[C@@H](C[NH3+])[C@@H](C)C1)c1ccccc1 ZINC000923500191 1261797005 /nfs/dbraw/zinc/79/70/05/1261797005.db2.gz PCNKXIFMWUOPND-CAMMJAKZSA-N 1 3 331.504 2.949 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@@H](C2CC2)N(C)C(=O)CN(C)C(C)C)c1 ZINC001485839535 1262072298 /nfs/dbraw/zinc/07/22/98/1262072298.db2.gz ZLYCLHSONZZBNS-FQEVSTJZSA-N 1 3 345.531 2.970 10 0 EFAEHO C[C@H](CN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CCC(F)(F)CC1 ZINC001485922303 1262502661 /nfs/dbraw/zinc/50/26/61/1262502661.db2.gz IWIOBBFUXYSOOO-HUUCEWRRSA-N 1 3 345.478 2.590 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@H](C)CN(C)C(=O)CN(C)C(C)C ZINC001485960382 1262559370 /nfs/dbraw/zinc/55/93/70/1262559370.db2.gz FTPFSSJPDCLMHY-OAHLLOKOSA-N 1 3 339.911 2.925 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+][C@@H]1CCc2c1cccc2F ZINC001485960996 1262560425 /nfs/dbraw/zinc/56/04/25/1262560425.db2.gz OTHKKOSRPYLROK-RDTXWAMCSA-N 1 3 335.467 2.590 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(C)cc1 ZINC001485962190 1262562270 /nfs/dbraw/zinc/56/22/70/1262562270.db2.gz WNAYYRVJAMBEGO-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO C[C@H]1C[C@@H](NCc2ccccc2F)CN1C(=O)CCCC[NH+](C)C ZINC001486130370 1262663511 /nfs/dbraw/zinc/66/35/11/1262663511.db2.gz RBSRROGHHUTDPX-DOTOQJQBSA-N 1 3 335.467 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCCC(F)(F)F)C[C@H]1C ZINC001486126694 1262704500 /nfs/dbraw/zinc/70/45/00/1262704500.db2.gz CSXWVWKGMSBKHS-KGLIPLIRSA-N 1 3 337.430 2.640 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@]12CCC[C@@H]1N(Cc1ccc(F)cc1)CC2 ZINC001486162059 1262722569 /nfs/dbraw/zinc/72/25/69/1262722569.db2.gz ZBXVNRNCWHSKLS-ICSRJNTNSA-N 1 3 347.478 2.781 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@]12CCC[C@@H]1N(Cc1ccc(F)cc1)CC2 ZINC001486162059 1262722574 /nfs/dbraw/zinc/72/25/74/1262722574.db2.gz ZBXVNRNCWHSKLS-ICSRJNTNSA-N 1 3 347.478 2.781 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H](C[NH2+]C/C=C\Cl)C1)CC(C)(C)C ZINC001486211052 1262807565 /nfs/dbraw/zinc/80/75/65/1262807565.db2.gz AKUKDSQGPFQYLK-DNWYELSFSA-N 1 3 329.916 2.591 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N2C[C@H](NC/C=C\Cl)C(C)(C)C2)C1 ZINC001486241507 1262842896 /nfs/dbraw/zinc/84/28/96/1262842896.db2.gz VAHFTGLHRPKGJX-KXVKIKSLSA-N 1 3 341.927 2.688 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N2C[C@H](NC/C=C\Cl)C(C)(C)C2)C1 ZINC001486241507 1262842903 /nfs/dbraw/zinc/84/29/03/1262842903.db2.gz VAHFTGLHRPKGJX-KXVKIKSLSA-N 1 3 341.927 2.688 10 0 EFAEHO CC1CC(C[NH2+][C@H]2CN(C(=O)CN(C)CC(C)(C)C)CC2(C)C)C1 ZINC001486244840 1262848160 /nfs/dbraw/zinc/84/81/60/1262848160.db2.gz ZXRZISUTEQBHON-JCYILVPMSA-N 1 3 337.552 2.837 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCc2ccc(C)cc2)C(C)(C)C1 ZINC001486246432 1262850038 /nfs/dbraw/zinc/85/00/38/1262850038.db2.gz KRXJVSFPLKHFPE-IBGZPJMESA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)CCN(C(=O)[C@@H]2CCCN2C)C(C)C)cc1 ZINC001486365177 1262954866 /nfs/dbraw/zinc/95/48/66/1262954866.db2.gz QLZSJRAQZJBPSL-FQEVSTJZSA-N 1 3 345.531 2.801 10 0 EFAEHO Cc1ccc(CC[N@H+](C)CCN(C(=O)[C@@H]2CCCN2C)C(C)C)cc1 ZINC001486365177 1262954869 /nfs/dbraw/zinc/95/48/69/1262954869.db2.gz QLZSJRAQZJBPSL-FQEVSTJZSA-N 1 3 345.531 2.801 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C[NH2+]CC1CC(C)(C)C1)C(C)(C)C ZINC001486420775 1263068750 /nfs/dbraw/zinc/06/87/50/1263068750.db2.gz HEKAGCURPMXDPY-INIZCTEOSA-N 1 3 334.508 2.817 10 0 EFAEHO C[C@H](NC(=O)NC1CCC(C)([NH+]2CCCC2)CC1)C1=CCN(C)CC1 ZINC000921880476 1263110583 /nfs/dbraw/zinc/11/05/83/1263110583.db2.gz JPALIODFVXDJJA-VQSBYGRUSA-N 1 3 348.535 2.733 10 0 EFAEHO C[C@H](NC(=O)C1(C[NH+](C)C)CC1)C1CCN(Cc2ccsc2)CC1 ZINC001486448499 1263138933 /nfs/dbraw/zinc/13/89/33/1263138933.db2.gz PUVCFVZCZYIUKW-HNNXBMFYSA-N 1 3 349.544 2.807 10 0 EFAEHO CCC[NH+]1CCC([C@H](C)NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001486449404 1263141858 /nfs/dbraw/zinc/14/18/58/1263141858.db2.gz WDTJNSGMFWJLRL-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+]Cc1cccc(Cl)c1F ZINC001273205356 1263216128 /nfs/dbraw/zinc/21/61/28/1263216128.db2.gz ZMOHFCHLMCJPCZ-CYBMUJFWSA-N 1 3 343.874 2.804 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCc1ccc(C[NH2+]CCC2CC2)cc1F ZINC001486525064 1263329870 /nfs/dbraw/zinc/32/98/70/1263329870.db2.gz BIISSMNRWMKCKQ-UHFFFAOYSA-N 1 3 344.434 2.606 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)CC(C)(C)C)[C@@H]2C1 ZINC001410119725 1263528229 /nfs/dbraw/zinc/52/82/29/1263528229.db2.gz UOVVBQBTKMGKMZ-NNZMDNLPSA-N 1 3 337.552 2.695 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)CC(C)(C)C)[C@@H]2C1 ZINC001410119725 1263528233 /nfs/dbraw/zinc/52/82/33/1263528233.db2.gz UOVVBQBTKMGKMZ-NNZMDNLPSA-N 1 3 337.552 2.695 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)C(C)C)[C@@H]2C1 ZINC001410143912 1264134814 /nfs/dbraw/zinc/13/48/14/1264134814.db2.gz CZUWOZLSQICEAF-FRYIKTPZSA-N 1 3 343.515 2.690 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@@H+]1C[C@@H]2[C@@H](CNC(=O)CN(C)C(C)C)[C@@H]2C1 ZINC001410143912 1264134817 /nfs/dbraw/zinc/13/48/17/1264134817.db2.gz CZUWOZLSQICEAF-FRYIKTPZSA-N 1 3 343.515 2.690 10 0 EFAEHO CCCC[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C[C@@H]2C1 ZINC001410190716 1264258572 /nfs/dbraw/zinc/25/85/72/1264258572.db2.gz QBSKPYKTJGORFW-RCCFBDPRSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCC[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C[C@@H]2C1 ZINC001410190716 1264258578 /nfs/dbraw/zinc/25/85/78/1264258578.db2.gz QBSKPYKTJGORFW-RCCFBDPRSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2ccc(F)cc2)C1 ZINC001410215292 1264331325 /nfs/dbraw/zinc/33/13/25/1264331325.db2.gz BZVGQJFJGNPFOZ-IIDMSEBBSA-N 1 3 335.467 2.713 10 0 EFAEHO Cn1nc2c(c1C[NH2+]C[C@]1(C)CCN(Cc3ccccc3)C1)CCC2 ZINC000922094424 1264354501 /nfs/dbraw/zinc/35/45/01/1264354501.db2.gz MNPQXZMHIHJJGS-NRFANRHFSA-N 1 3 338.499 2.911 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001410224585 1264369429 /nfs/dbraw/zinc/36/94/29/1264369429.db2.gz PYNYXYJDUKUSCM-VAMGGRTRSA-N 1 3 345.531 2.820 10 0 EFAEHO CN(C/C=C\Cl)C1CCN(C(=O)[C@@H]2CCC[C@H]3CCC[N@@H+]32)CC1 ZINC001410251286 1264513920 /nfs/dbraw/zinc/51/39/20/1264513920.db2.gz KISMWVDUQTYMPV-JPCJYUSCSA-N 1 3 339.911 2.679 10 0 EFAEHO CN(C/C=C\Cl)C1CCN(C(=O)[C@@H]2CCC[C@H]3CCC[N@H+]32)CC1 ZINC001410251286 1264513926 /nfs/dbraw/zinc/51/39/26/1264513926.db2.gz KISMWVDUQTYMPV-JPCJYUSCSA-N 1 3 339.911 2.679 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001410428597 1265146218 /nfs/dbraw/zinc/14/62/18/1265146218.db2.gz CEZNZXUALVLJGN-QAPCUYQASA-N 1 3 331.504 2.582 10 0 EFAEHO CCO[C@H](C[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1)CN(C)C ZINC000922754670 1266739362 /nfs/dbraw/zinc/73/93/62/1266739362.db2.gz RGFLVDFFGBWMOD-WOJBJXKFSA-N 1 3 345.531 2.740 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1cccc(Cl)c1)N(C)C ZINC001273121396 1268523325 /nfs/dbraw/zinc/52/33/25/1268523325.db2.gz BKUQETBDSGZADN-CJNGLKHVSA-N 1 3 325.884 2.665 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2C[C@H](C)N(C(=O)CN(C)C(C)C)C2)c(C)s1 ZINC001410857620 1269881737 /nfs/dbraw/zinc/88/17/37/1269881737.db2.gz RATACKMCSTUHDX-GUYCJALGSA-N 1 3 337.533 2.784 10 0 EFAEHO C[C@@H]1CCC[N@@H+]1CCNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000742241599 1269951515 /nfs/dbraw/zinc/95/15/15/1269951515.db2.gz PYMVBNSSPNFPMH-SJLPKXTDSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@@H]1CCC[N@H+]1CCNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000742241599 1269951523 /nfs/dbraw/zinc/95/15/23/1269951523.db2.gz PYMVBNSSPNFPMH-SJLPKXTDSA-N 1 3 347.478 2.638 10 0 EFAEHO Cc1cc(F)ccc1CN1CC[C@@]2(NC(=O)CC[NH+](C)C)CCC[C@@H]12 ZINC001410917569 1270234911 /nfs/dbraw/zinc/23/49/11/1270234911.db2.gz WSQAIXVFYHHPFR-QUCCMNQESA-N 1 3 347.478 2.699 10 0 EFAEHO CC[NH2+][C@H](CCNC(=O)[C@H]1CCCCN1C(C)C)Cc1ccccc1 ZINC001410924775 1270281577 /nfs/dbraw/zinc/28/15/77/1270281577.db2.gz FUAMLGWTXAULDT-WOJBJXKFSA-N 1 3 345.531 2.976 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]21 ZINC001410927389 1270290017 /nfs/dbraw/zinc/29/00/17/1270290017.db2.gz PBDHVTJVZPTXNK-YTQUADARSA-N 1 3 335.536 2.734 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001410946019 1270355805 /nfs/dbraw/zinc/35/58/05/1270355805.db2.gz ADTOZLKYEWPFEG-VQTJNVASSA-N 1 3 345.531 2.964 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2C[C@H]([NH2+]C/C=C/Cl)C(C)(C)C2)c1 ZINC001411032324 1270732333 /nfs/dbraw/zinc/73/23/33/1270732333.db2.gz YYTASIZKVGJSHD-NADMHLTPSA-N 1 3 349.906 2.941 10 0 EFAEHO CC[C@H](C)C[NH+]1CCC([C@@H](C)NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001411240634 1272109867 /nfs/dbraw/zinc/10/98/67/1272109867.db2.gz WIRPOPAHDAAKDP-JZXOWHBKSA-N 1 3 325.541 2.835 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1CC(N(C)C(=O)c2cccc(CN(C)C)c2)C1 ZINC001411255871 1272157924 /nfs/dbraw/zinc/15/79/24/1272157924.db2.gz VZCPQEVTGZBEKQ-WWDZGPRUSA-N 1 3 335.467 2.689 10 0 EFAEHO O=C(O[C@@H]1CCN(Cc2ccccc2)C1)C1CC[NH+](C2CC2)CC1 ZINC000788189143 1276102295 /nfs/dbraw/zinc/10/22/95/1276102295.db2.gz RKQRKPVOEIREDZ-LJQANCHMSA-N 1 3 328.456 2.679 10 0 EFAEHO O[C@H](CN[C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(F)c1 ZINC000817888536 1276347800 /nfs/dbraw/zinc/34/78/00/1276347800.db2.gz HNLXQXDLDUKBQU-NLWGTHIKSA-N 1 3 342.414 2.705 10 0 EFAEHO C[C@H]([NH2+][C@H]1C[C@H](N)c2ccccc21)[C@H](O)c1ccc2c(c1)OCO2 ZINC000817927139 1276360700 /nfs/dbraw/zinc/36/07/00/1276360700.db2.gz GWEVBFYISPJNAY-FANORHJISA-N 1 3 326.396 2.572 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NCCCCC[NH+]2CCCC2)C1 ZINC000818343238 1276509909 /nfs/dbraw/zinc/50/99/09/1276509909.db2.gz NIOSVFAQAZPQGB-GOSISDBHSA-N 1 3 327.488 2.581 10 0 EFAEHO CN(C)c1ccc(NC(=O)CCNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC000819115338 1276637910 /nfs/dbraw/zinc/63/79/10/1276637910.db2.gz ITDMQWIWLBLSSH-JLYLLQBASA-N 1 3 344.503 2.686 10 0 EFAEHO CN(C)c1ccc(NC(=O)CCNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC000819115338 1276637912 /nfs/dbraw/zinc/63/79/12/1276637912.db2.gz ITDMQWIWLBLSSH-JLYLLQBASA-N 1 3 344.503 2.686 10 0 EFAEHO Cc1cc(C)cc([C@H](O)C[NH2+]C2CCN([C@H]3CCCC[C@@H]3O)CC2)c1 ZINC000819175509 1276657760 /nfs/dbraw/zinc/65/77/60/1276657760.db2.gz ZDIHTFQCPVYBIV-PCCBWWKXSA-N 1 3 346.515 2.694 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@H+](CC2CCCCC2)CC1(C)C)N(C)C ZINC001410014668 1276985025 /nfs/dbraw/zinc/98/50/25/1276985025.db2.gz GZBKQRRNRIGZOC-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[N@@H+](CC2CCCCC2)CC1(C)C)N(C)C ZINC001410014668 1276985027 /nfs/dbraw/zinc/98/50/27/1276985027.db2.gz GZBKQRRNRIGZOC-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@@H](CN(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1ccccc1 ZINC000820074085 1277033525 /nfs/dbraw/zinc/03/35/25/1277033525.db2.gz GGTHNXAPWHPCRK-ROUUACIJSA-N 1 3 348.535 2.704 10 0 EFAEHO C[C@@H](CN(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1ccccc1 ZINC000820074085 1277033527 /nfs/dbraw/zinc/03/35/27/1277033527.db2.gz GGTHNXAPWHPCRK-ROUUACIJSA-N 1 3 348.535 2.704 10 0 EFAEHO CCN1C[C@@H](CN2CCC(CC[N@H+](CC)CC(C)C)CC2)OC1=O ZINC000846839649 1280567756 /nfs/dbraw/zinc/56/77/56/1280567756.db2.gz HJSDAGTXUDWVFY-GOSISDBHSA-N 1 3 339.524 2.907 10 0 EFAEHO CCN1C[C@@H](CN2CCC(CC[N@@H+](CC)CC(C)C)CC2)OC1=O ZINC000846839649 1280567761 /nfs/dbraw/zinc/56/77/61/1280567761.db2.gz HJSDAGTXUDWVFY-GOSISDBHSA-N 1 3 339.524 2.907 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]Cc2ccc3oc(=O)[nH]c3c2)[C@@H](C)C1 ZINC000872122260 1287436162 /nfs/dbraw/zinc/43/61/62/1287436162.db2.gz DGHYJWAWYXJBFO-GOEBONIOSA-N 1 3 347.459 2.760 10 0 EFAEHO N[C@@H](Cc1ccccc1)[C@@H](O)C[N@@H+]1CC[C@]2(CCc3ccccc32)C1 ZINC000872146409 1287442923 /nfs/dbraw/zinc/44/29/23/1287442923.db2.gz NAVKAKDIXFJWDL-FDFHNCONSA-N 1 3 336.479 2.507 10 0 EFAEHO N[C@@H](Cc1ccccc1)[C@@H](O)C[N@H+]1CC[C@]2(CCc3ccccc32)C1 ZINC000872146409 1287442931 /nfs/dbraw/zinc/44/29/31/1287442931.db2.gz NAVKAKDIXFJWDL-FDFHNCONSA-N 1 3 336.479 2.507 10 0 EFAEHO C[C@H](NC(=O)CN(C)CCCCCC[NH3+])c1ccccc1Cl ZINC000872154833 1287450025 /nfs/dbraw/zinc/45/00/25/1287450025.db2.gz BWNWVGBTUNJATI-AWEZNQCLSA-N 1 3 325.884 2.968 10 0 EFAEHO C[C@@H](C(=O)Nc1ccc2c(c1)OCCCO2)N(C)CCCCCC[NH3+] ZINC000872154846 1287450040 /nfs/dbraw/zinc/45/00/40/1287450040.db2.gz BZIZGGUGZXBNFI-HNNXBMFYSA-N 1 3 349.475 2.626 10 0 EFAEHO [NH3+][C@H](C[C@@H]1CCCN([C@@H]2CCN(C3CCC3)C2=O)C1)C1CCCC1 ZINC000872158232 1287454051 /nfs/dbraw/zinc/45/40/51/1287454051.db2.gz UFCYAYGCXJKAPG-KFKAGJAMSA-N 1 3 333.520 2.759 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC[C@H](O)CC(C)(C)O)C1 ZINC000872199753 1287471956 /nfs/dbraw/zinc/47/19/56/1287471956.db2.gz AZCJFLKSBCCCCI-MBOZVWFJSA-N 1 3 348.531 2.776 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC[C@H](O)CC(C)(C)O ZINC000872201238 1287472908 /nfs/dbraw/zinc/47/29/08/1287472908.db2.gz UDHYWYUBKUMHHA-QFBILLFUSA-N 1 3 334.504 2.673 10 0 EFAEHO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC[C@H](O)CC(C)(C)O ZINC000872201238 1287472913 /nfs/dbraw/zinc/47/29/13/1287472913.db2.gz UDHYWYUBKUMHHA-QFBILLFUSA-N 1 3 334.504 2.673 10 0 EFAEHO CC(C)OC[C@@H](O)C[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000872205740 1287475740 /nfs/dbraw/zinc/47/57/40/1287475740.db2.gz GVHAQAGZKPNTGJ-IVAOSVALSA-N 1 3 346.515 2.663 10 0 EFAEHO O[C@@H](C[NH2+][C@@H]1CCCO[C@H]1c1ccc(Cl)cc1)CN1CCCC1 ZINC000872237455 1287492307 /nfs/dbraw/zinc/49/23/07/1287492307.db2.gz JCKJTJXUDVJJGX-KSZLIROESA-N 1 3 338.879 2.606 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000809967600 1282660321 /nfs/dbraw/zinc/66/03/21/1282660321.db2.gz CSSHAAQBQZFKLG-QAPCUYQASA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000809967600 1282660340 /nfs/dbraw/zinc/66/03/40/1282660340.db2.gz CSSHAAQBQZFKLG-QAPCUYQASA-N 1 3 327.488 2.580 10 0 EFAEHO C[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CCCCC1 ZINC000810146273 1282968969 /nfs/dbraw/zinc/96/89/69/1282968969.db2.gz OOVDOZGTZZOTGP-SFHVURJKSA-N 1 3 327.488 2.580 10 0 EFAEHO C[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CCCCC1 ZINC000810146273 1282968985 /nfs/dbraw/zinc/96/89/85/1282968985.db2.gz OOVDOZGTZZOTGP-SFHVURJKSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000810192223 1283026909 /nfs/dbraw/zinc/02/69/09/1283026909.db2.gz DYOAIVHOPRAATN-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000810192223 1283026917 /nfs/dbraw/zinc/02/69/17/1283026917.db2.gz DYOAIVHOPRAATN-KXBFYZLASA-N 1 3 341.515 2.826 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@]2(F)CC[N@@H+](C(C)(C)C)C2)N(C)C)cc1 ZINC000810243692 1283098334 /nfs/dbraw/zinc/09/83/34/1283098334.db2.gz JQIXIELNBOHPCN-PXNSSMCTSA-N 1 3 349.494 2.926 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)N(C)C)cc1 ZINC000810243692 1283098345 /nfs/dbraw/zinc/09/83/45/1283098345.db2.gz JQIXIELNBOHPCN-PXNSSMCTSA-N 1 3 349.494 2.926 10 0 EFAEHO CCC[NH+](CCC)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810340774 1283160590 /nfs/dbraw/zinc/16/05/90/1283160590.db2.gz SLNGAJWYBLLNKE-GOSISDBHSA-N 1 3 329.504 2.827 10 0 EFAEHO C[C@H](C[N@H+](C)Cc1ccccc1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810664360 1283470190 /nfs/dbraw/zinc/47/01/90/1283470190.db2.gz DMGSKOIDICPGAR-UZLBHIALSA-N 1 3 349.494 2.836 10 0 EFAEHO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810664360 1283470196 /nfs/dbraw/zinc/47/01/96/1283470196.db2.gz DMGSKOIDICPGAR-UZLBHIALSA-N 1 3 349.494 2.836 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)[C@H](N)C(C)(C)C)CC[N@@H+]1Cc1ccccc1 ZINC000952845091 1284862078 /nfs/dbraw/zinc/86/20/78/1284862078.db2.gz AHZCIDWNXUHTGL-NJAFHUGGSA-N 1 3 331.504 2.871 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)[C@H](N)C(C)(C)C)CC[N@H+]1Cc1ccccc1 ZINC000952845091 1284862087 /nfs/dbraw/zinc/86/20/87/1284862087.db2.gz AHZCIDWNXUHTGL-NJAFHUGGSA-N 1 3 331.504 2.871 10 0 EFAEHO CC[N@H+](CCCN1CCN(C(C)C)CC1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812849991 1285476555 /nfs/dbraw/zinc/47/65/55/1285476555.db2.gz SKXIFBDQCIITJI-PZJWPPBQSA-N 1 3 347.547 2.847 10 0 EFAEHO CC[N@@H+](CCCN1CCN(C(C)C)CC1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812849991 1285476558 /nfs/dbraw/zinc/47/65/58/1285476558.db2.gz SKXIFBDQCIITJI-PZJWPPBQSA-N 1 3 347.547 2.847 10 0 EFAEHO C[C@@H]1C[NH2+]C[C@H]1CN1CCC[C@H](c2nc(-c3ccccc3)n[nH]2)C1 ZINC000903457719 1312711742 /nfs/dbraw/zinc/71/17/42/1312711742.db2.gz ZLAVNQDLYSOAKW-PVAVHDDUSA-N 1 3 325.460 2.507 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CCC[C@H](NC(=O)Cc2nc[nH]c2C)CC1 ZINC001273465827 1289595092 /nfs/dbraw/zinc/59/50/92/1289595092.db2.gz MIYJFWMNFAIXRJ-RTRPANQVSA-N 1 3 332.492 2.978 10 0 EFAEHO CCC/C=C/CC[N@H+]1CCC[C@H](NC(=O)Cc2nc[nH]c2C)CC1 ZINC001273465827 1289595099 /nfs/dbraw/zinc/59/50/99/1289595099.db2.gz MIYJFWMNFAIXRJ-RTRPANQVSA-N 1 3 332.492 2.978 10 0 EFAEHO C[C@@H]1CN(Cc2csc(-c3ccc4c(c3)OCO4)n2)C[C@H]1CC[NH3+] ZINC000903499122 1312777311 /nfs/dbraw/zinc/77/73/11/1312777311.db2.gz GXNHQGYXIYPPIS-TZMCWYRMSA-N 1 3 345.468 2.956 10 0 EFAEHO CN(C)C[C@@H]1CC[N@H+](C[C@@H]2CCCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000876731455 1290994184 /nfs/dbraw/zinc/99/41/84/1290994184.db2.gz RCFBPXUYFKOQEN-IRXDYDNUSA-N 1 3 339.524 2.907 10 0 EFAEHO CN(C)C[C@@H]1CC[N@@H+](C[C@@H]2CCCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000876731455 1290994194 /nfs/dbraw/zinc/99/41/94/1290994194.db2.gz RCFBPXUYFKOQEN-IRXDYDNUSA-N 1 3 339.524 2.907 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N(CC)CCNCc2ccsc2)C1 ZINC001273569148 1291469942 /nfs/dbraw/zinc/46/99/42/1291469942.db2.gz KJTDJXCNOUSYEW-KRWDZBQOSA-N 1 3 337.533 2.808 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N(CC)CCNCc2ccsc2)C1 ZINC001273569148 1291469947 /nfs/dbraw/zinc/46/99/47/1291469947.db2.gz KJTDJXCNOUSYEW-KRWDZBQOSA-N 1 3 337.533 2.808 10 0 EFAEHO C([C@H]1CCC2(CCOCC2)O1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000878286923 1291600444 /nfs/dbraw/zinc/60/04/44/1291600444.db2.gz VJDFSZWSBDKZDW-BHIYHBOVSA-N 1 3 334.504 2.663 10 0 EFAEHO C([C@H]1CCC2(CCOCC2)O1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000878286923 1291600453 /nfs/dbraw/zinc/60/04/53/1291600453.db2.gz VJDFSZWSBDKZDW-BHIYHBOVSA-N 1 3 334.504 2.663 10 0 EFAEHO C([C@@H]1CCC2(CCOCC2)CO1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000878287373 1291602779 /nfs/dbraw/zinc/60/27/79/1291602779.db2.gz ZSHMBLNGNVIFRP-YZGWKJHDSA-N 1 3 348.531 2.911 10 0 EFAEHO C([C@@H]1CCC2(CCOCC2)CO1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000878287373 1291602781 /nfs/dbraw/zinc/60/27/81/1291602781.db2.gz ZSHMBLNGNVIFRP-YZGWKJHDSA-N 1 3 348.531 2.911 10 0 EFAEHO CCN(CC[NH2+]CC[C@@H]1CCc2ccccc21)C(=O)Cc1c[nH]cn1 ZINC001273628690 1292723024 /nfs/dbraw/zinc/72/30/24/1292723024.db2.gz NCJJZOLACXCHKW-KRWDZBQOSA-N 1 3 340.471 2.510 10 0 EFAEHO CC[C@@H](C(=O)N(CC)CC[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001273710066 1294085845 /nfs/dbraw/zinc/08/58/45/1294085845.db2.gz HUROCHQXJPETQE-HNNXBMFYSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@H](C(=O)N(CC)CC[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001273710067 1294086249 /nfs/dbraw/zinc/08/62/49/1294086249.db2.gz HUROCHQXJPETQE-OAHLLOKOSA-N 1 3 333.467 2.590 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)cc1C)C(=O)[C@H](C(C)C)N(C)C ZINC001273715993 1294166311 /nfs/dbraw/zinc/16/63/11/1294166311.db2.gz BVKMZBSQFZWBLS-IBGZPJMESA-N 1 3 333.520 2.828 10 0 EFAEHO Brc1cnn(C2CCN(C[C@H]3CCCC[NH2+]C3)CC2)c1 ZINC000903729414 1313129586 /nfs/dbraw/zinc/12/95/86/1313129586.db2.gz MMGGPTMQXNJLNU-ZDUSSCGKSA-N 1 3 341.297 2.672 10 0 EFAEHO CC[C@H](C(=O)NC/C=C\C[NH2+][C@H](C)c1cc(C)ccc1C)N(C)C ZINC001274125943 1295483155 /nfs/dbraw/zinc/48/31/55/1295483155.db2.gz VXWDJRBKBKSGJU-MQCDJQTNSA-N 1 3 331.504 2.967 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C/C=C/CNC(=O)[C@H]1CCCN1C ZINC001274263514 1296047160 /nfs/dbraw/zinc/04/71/60/1296047160.db2.gz RLXOJAPGWPDUTJ-OVKVCFKUSA-N 1 3 329.488 2.666 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H](C)NC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001275150162 1296240188 /nfs/dbraw/zinc/24/01/88/1296240188.db2.gz XOKQQSCEZJWEGB-PKOBYXMFSA-N 1 3 331.504 2.505 10 0 EFAEHO CN(C[C@@H](O)C(F)(F)F)CC1CC[NH+](Cc2ccccc2)CC1 ZINC000720035776 1296691524 /nfs/dbraw/zinc/69/15/24/1296691524.db2.gz DRAKXXSALVLGMH-MRXNPFEDSA-N 1 3 330.394 2.754 10 0 EFAEHO C[C@H]([NH2+]CCCCN1C[C@@H](C)O[C@H](C)C1)c1cn2c(n1)CCCC2 ZINC000925435887 1296836602 /nfs/dbraw/zinc/83/66/02/1296836602.db2.gz CAQAVUPTJZBVDR-ZACQAIPSSA-N 1 3 334.508 2.759 10 0 EFAEHO COc1cccc(N2CC[C@H](C[NH2+][C@@H]3[C@@H]4CCCN[C@@H]4C3(C)C)C2)c1 ZINC000925565481 1296856108 /nfs/dbraw/zinc/85/61/08/1296856108.db2.gz RZRCBXBNBLTZHP-GEALJGNFSA-N 1 3 343.515 2.888 10 0 EFAEHO Cc1cccc2nc(CC[NH2+][C@H]3CCNC[C@@H]3C3CCCC3)cn21 ZINC000925713409 1296869742 /nfs/dbraw/zinc/86/97/42/1296869742.db2.gz RYXRVUSPEGLWCJ-MOPGFXCFSA-N 1 3 326.488 2.943 10 0 EFAEHO Cc1cccc2nc(CCN[C@H]3CC[NH2+]C[C@@H]3C3CCCC3)cn21 ZINC000925713409 1296869762 /nfs/dbraw/zinc/86/97/62/1296869762.db2.gz RYXRVUSPEGLWCJ-MOPGFXCFSA-N 1 3 326.488 2.943 10 0 EFAEHO Cc1cccc2nc(CC[NH2+][C@@H]3CCNC[C@@H]3C3CCCC3)cn21 ZINC000925713413 1296869895 /nfs/dbraw/zinc/86/98/95/1296869895.db2.gz RYXRVUSPEGLWCJ-RTBURBONSA-N 1 3 326.488 2.943 10 0 EFAEHO Cc1cccc2nc(CCN[C@@H]3CC[NH2+]C[C@@H]3C3CCCC3)cn21 ZINC000925713413 1296869913 /nfs/dbraw/zinc/86/99/13/1296869913.db2.gz RYXRVUSPEGLWCJ-RTBURBONSA-N 1 3 326.488 2.943 10 0 EFAEHO CCOC(=O)C1([C@H](C)N[C@@H]2c3ccccc3CC[C@H]2F)CC[NH2+]CC1 ZINC000925773020 1296880139 /nfs/dbraw/zinc/88/01/39/1296880139.db2.gz WFCPOSLHSCDIOZ-BMGDILEWSA-N 1 3 348.462 2.923 10 0 EFAEHO CCOC(=O)C1([C@H](C)N[C@@H]2c3ccccc3CC[C@@H]2F)CC[NH2+]CC1 ZINC000925773022 1296880292 /nfs/dbraw/zinc/88/02/92/1296880292.db2.gz WFCPOSLHSCDIOZ-JCGIZDLHSA-N 1 3 348.462 2.923 10 0 EFAEHO C[C@H](NCc1ccc(-c2nncnn2)cc1)c1cccc(C[NH+](C)C)c1 ZINC000926656001 1296944205 /nfs/dbraw/zinc/94/42/05/1296944205.db2.gz DXQVAONRGGTIBH-HNNXBMFYSA-N 1 3 348.454 2.846 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@@H]1C[NH2+][C@@H]1CCOC12CCOCC2 ZINC000926776438 1296959821 /nfs/dbraw/zinc/95/98/21/1296959821.db2.gz AONYWCVWMMMGCV-YZGWKJHDSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@H](CN(C)C(=O)Cc1c[nH]cn1)[NH2+]CCCc1ccccc1Cl ZINC001277946417 1313325066 /nfs/dbraw/zinc/32/50/66/1313325066.db2.gz VLZJFVGBTJETHA-CQSZACIVSA-N 1 3 348.878 2.675 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN2CCCCC[C@H]2c2ccncc2)cnn1C ZINC000903872861 1313326091 /nfs/dbraw/zinc/32/60/91/1313326091.db2.gz KIDBFKZCTVCLGS-XLIONFOSSA-N 1 3 341.503 2.858 10 0 EFAEHO CN1CCC[C@H]1C(=O)NC/C=C\C[NH2+]Cc1cc2ccccc2s1 ZINC001273910999 1297119842 /nfs/dbraw/zinc/11/98/42/1297119842.db2.gz RLSXZNNCZHPBGL-CHYADLBTSA-N 1 3 343.496 2.758 10 0 EFAEHO CN1CCCC[C@H]1CC[N@H+](C)C[C@@H](O)CC[C@H](O)c1ccccc1 ZINC000929720223 1297200912 /nfs/dbraw/zinc/20/09/12/1297200912.db2.gz BVFPKJFAVQSFQN-UFYCRDLUSA-N 1 3 334.504 2.667 10 0 EFAEHO CN1CCCC[C@H]1CC[N@@H+](C)C[C@@H](O)CC[C@H](O)c1ccccc1 ZINC000929720223 1297200921 /nfs/dbraw/zinc/20/09/21/1297200921.db2.gz BVFPKJFAVQSFQN-UFYCRDLUSA-N 1 3 334.504 2.667 10 0 EFAEHO COc1ccccc1[C@H]1CCCN1C[C@@H](C[NH3+])Cc1cnn(C)c1C ZINC000903892069 1313362932 /nfs/dbraw/zinc/36/29/32/1313362932.db2.gz PHGKSMYGMIDQLX-VQIMIIECSA-N 1 3 342.487 2.692 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CCC[C@@H]2Cc2ccccc2C)cnn1C ZINC000903892672 1313363484 /nfs/dbraw/zinc/36/34/84/1313363484.db2.gz VSIIFRMJBMBTRX-WIYYLYMNSA-N 1 3 340.515 2.861 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CCC[C@@H]2Cc2ccccc2C)cnn1C ZINC000903892672 1313363488 /nfs/dbraw/zinc/36/34/88/1313363488.db2.gz VSIIFRMJBMBTRX-WIYYLYMNSA-N 1 3 340.515 2.861 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+](CCc2ccc(F)cc2)C2CC2)cnn1C ZINC000903892681 1313363707 /nfs/dbraw/zinc/36/37/07/1313363707.db2.gz LFDLTAKVXCDIEY-KRWDZBQOSA-N 1 3 344.478 2.692 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+](CCc2ccc(F)cc2)C2CC2)cnn1C ZINC000903892681 1313363711 /nfs/dbraw/zinc/36/37/11/1313363711.db2.gz LFDLTAKVXCDIEY-KRWDZBQOSA-N 1 3 344.478 2.692 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+]2CCC[C@H]2Cc2ccccc2C)cnn1C ZINC000903892661 1313363932 /nfs/dbraw/zinc/36/39/32/1313363932.db2.gz VSIIFRMJBMBTRX-RXVVDRJESA-N 1 3 340.515 2.861 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+]2CCC[C@H]2Cc2ccccc2C)cnn1C ZINC000903892661 1313363936 /nfs/dbraw/zinc/36/39/36/1313363936.db2.gz VSIIFRMJBMBTRX-RXVVDRJESA-N 1 3 340.515 2.861 10 0 EFAEHO CC[C@@H]1c2ccccc2CCN1C[C@@H](C[NH3+])Cc1cnn(C)c1C ZINC000903893240 1313364340 /nfs/dbraw/zinc/36/43/40/1313364340.db2.gz SUNMDKOCYKWKFQ-OXQOHEQNSA-N 1 3 326.488 2.855 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN2CCC[C@](C)(c3ccccc3)C2)cnn1C ZINC000903893274 1313364668 /nfs/dbraw/zinc/36/46/68/1313364668.db2.gz UHFWIZWFUAEAHW-RXVVDRJESA-N 1 3 340.515 2.900 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)cnn1C ZINC000903895653 1313369660 /nfs/dbraw/zinc/36/96/60/1313369660.db2.gz POAZDESIXXIWAI-VPWXQRGCSA-N 1 3 326.488 2.724 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)cnn1C ZINC000903895653 1313369664 /nfs/dbraw/zinc/36/96/64/1313369664.db2.gz POAZDESIXXIWAI-VPWXQRGCSA-N 1 3 326.488 2.724 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CCC[C@@H]2Cc2ccc(C)cc2)cnn1C ZINC000903891305 1313361458 /nfs/dbraw/zinc/36/14/58/1313361458.db2.gz LJMXJSMQGHCODN-TZIWHRDSSA-N 1 3 340.515 2.861 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CCC[C@@H]2Cc2ccc(C)cc2)cnn1C ZINC000903891305 1313361461 /nfs/dbraw/zinc/36/14/61/1313361461.db2.gz LJMXJSMQGHCODN-TZIWHRDSSA-N 1 3 340.515 2.861 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@H]2C[NH2+]CCC2CCCC2)CC1 ZINC001277966732 1313389427 /nfs/dbraw/zinc/38/94/27/1313389427.db2.gz WYAPAQGLOFGVJR-IBGZPJMESA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN2CCC(c3ccsc3)CC2)cnn1C ZINC000903910201 1313396550 /nfs/dbraw/zinc/39/65/50/1313396550.db2.gz KJTSKAZQYNRJJP-OAHLLOKOSA-N 1 3 332.517 2.787 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN[C@H]2CCc3cc(Cl)ccc32)cnn1C ZINC000903934237 1313443008 /nfs/dbraw/zinc/44/30/08/1313443008.db2.gz FFMNTFVHONDEKN-ACJLOTCBSA-N 1 3 332.879 2.776 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@H+](CC2CC(C)C2)CC(C)(C)C1 ZINC001489349137 1298206108 /nfs/dbraw/zinc/20/61/08/1298206108.db2.gz DCGYKOXKKVWTDB-DAWZGUTISA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[N@@H+](CC2CC(C)C2)CC(C)(C)C1 ZINC001489349137 1298206117 /nfs/dbraw/zinc/20/61/17/1298206117.db2.gz DCGYKOXKKVWTDB-DAWZGUTISA-N 1 3 337.552 2.981 10 0 EFAEHO CCOc1ccc(C[NH2+]C[C@H]2CNCCC2(F)F)cc1OCC ZINC000903955229 1313481676 /nfs/dbraw/zinc/48/16/76/1313481676.db2.gz NJSNXMKUBNUFEL-CQSZACIVSA-N 1 3 328.403 2.818 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@@H](C)NC[C@@H]1C[NH2+]C[C@H]1C ZINC000903967767 1313510738 /nfs/dbraw/zinc/51/07/38/1313510738.db2.gz NRQKAMRTUFTFKS-UPJWGTAASA-N 1 3 339.867 2.511 10 0 EFAEHO COc1c(Br)cccc1CN1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903977869 1313527101 /nfs/dbraw/zinc/52/71/01/1313527101.db2.gz CAOFYFHVANPFOZ-VXGBXAGGSA-N 1 3 327.266 2.874 10 0 EFAEHO COc1ccccc1/C=C\CN1C[C@H]2CC[C@@H](C1)[N@H+]2C1CCNCC1 ZINC000903980299 1313530679 /nfs/dbraw/zinc/53/06/79/1313530679.db2.gz NXNQLDDMRITWHE-ZINYKFBCSA-N 1 3 341.499 2.609 10 0 EFAEHO COc1ccccc1/C=C\CN1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CCNCC1 ZINC000903980299 1313530682 /nfs/dbraw/zinc/53/06/82/1313530682.db2.gz NXNQLDDMRITWHE-ZINYKFBCSA-N 1 3 341.499 2.609 10 0 EFAEHO Fc1ccc(/C=C\CN2C[C@H]3CC[C@@H](C2)[N@H+]3C2CCNCC2)cc1 ZINC000903980703 1313531145 /nfs/dbraw/zinc/53/11/45/1313531145.db2.gz YBMCDCXBMPZSDM-DZNLNZEASA-N 1 3 329.463 2.740 10 0 EFAEHO Fc1ccc(/C=C\CN2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CCNCC2)cc1 ZINC000903980703 1313531151 /nfs/dbraw/zinc/53/11/51/1313531151.db2.gz YBMCDCXBMPZSDM-DZNLNZEASA-N 1 3 329.463 2.740 10 0 EFAEHO C[C@H](C(=O)NCCCN(C)Cc1ccsc1)[NH+]1CCCCCC1 ZINC001490255764 1298686428 /nfs/dbraw/zinc/68/64/28/1298686428.db2.gz HZUSDKBEBXXJDM-MRXNPFEDSA-N 1 3 337.533 2.951 10 0 EFAEHO CN(CCCNC(=O)[C@H]1CCC[C@@H]2CCC[N@@H+]21)Cc1ccsc1 ZINC001490258004 1298691301 /nfs/dbraw/zinc/69/13/01/1298691301.db2.gz QOQQPVXKKFLGQB-IAGOWNOFSA-N 1 3 335.517 2.703 10 0 EFAEHO CN(CCCNC(=O)[C@H]1CCC[C@@H]2CCC[N@H+]21)Cc1ccsc1 ZINC001490258004 1298691308 /nfs/dbraw/zinc/69/13/08/1298691308.db2.gz QOQQPVXKKFLGQB-IAGOWNOFSA-N 1 3 335.517 2.703 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCCN(C)Cc1ccc(Cl)s1)[NH+](C)C ZINC001490270798 1298694897 /nfs/dbraw/zinc/69/48/97/1298694897.db2.gz ISDHBZSWLZEXQM-HNNXBMFYSA-N 1 3 345.940 2.926 10 0 EFAEHO C[C@@H](c1ccccc1F)[N@H+](CCCNC(=O)CN1CCCC1)C1CC1 ZINC001490393000 1298818274 /nfs/dbraw/zinc/81/82/74/1298818274.db2.gz CNEMXYDOMVHPGW-INIZCTEOSA-N 1 3 347.478 2.953 10 0 EFAEHO C[C@@H](c1ccccc1F)[N@@H+](CCCNC(=O)CN1CCCC1)C1CC1 ZINC001490393000 1298818282 /nfs/dbraw/zinc/81/82/82/1298818282.db2.gz CNEMXYDOMVHPGW-INIZCTEOSA-N 1 3 347.478 2.953 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN(C)C(C)C)[C@@H]1CCc2ccccc21 ZINC001490360289 1298843999 /nfs/dbraw/zinc/84/39/99/1298843999.db2.gz AQGHFYPBHVTRIE-LJQANCHMSA-N 1 3 331.504 2.842 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN(C)C(C)C)[C@@H]1CCc2ccccc21 ZINC001490360289 1298844018 /nfs/dbraw/zinc/84/40/18/1298844018.db2.gz AQGHFYPBHVTRIE-LJQANCHMSA-N 1 3 331.504 2.842 10 0 EFAEHO O=C(CCC[NH+]1CCCCC1)N[C@H]1CCN(CC2=CCCCC2)C1 ZINC001490576491 1298995809 /nfs/dbraw/zinc/99/58/09/1298995809.db2.gz JPRLBCYCZKCYDM-IBGZPJMESA-N 1 3 333.520 2.943 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](CNC(=O)[C@H]2CCCN2C(C)C)C2CC2)c1 ZINC001490661529 1299102959 /nfs/dbraw/zinc/10/29/59/1299102959.db2.gz OENMNPAOPFNHHO-VQTJNVASSA-N 1 3 343.515 2.852 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](CNC(=O)[C@H]2CCCN2C(C)C)C2CC2)c1 ZINC001490661530 1299102995 /nfs/dbraw/zinc/10/29/95/1299102995.db2.gz OENMNPAOPFNHHO-WOJBJXKFSA-N 1 3 343.515 2.852 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]([NH2+]CC2CCCCCC2)C2CC2)C1 ZINC001490710930 1299119596 /nfs/dbraw/zinc/11/95/96/1299119596.db2.gz VXINBSUCBGVFCF-VQIMIIECSA-N 1 3 335.536 2.783 10 0 EFAEHO CN(CC(=O)N1CCC(CC[NH2+]CCC(F)(F)F)CC1)C1CCC1 ZINC001495415819 1299163747 /nfs/dbraw/zinc/16/37/47/1299163747.db2.gz MDLBHEVFZIBNJB-UHFFFAOYSA-N 1 3 349.441 2.641 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+][C@H](CNC(=O)CN(C)C(C)C)C1CC1 ZINC001490740533 1299177894 /nfs/dbraw/zinc/17/78/94/1299177894.db2.gz DDAAITXMJBSGHZ-VQIMIIECSA-N 1 3 331.504 2.881 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)C1CC1 ZINC001490740007 1299177916 /nfs/dbraw/zinc/17/79/16/1299177916.db2.gz ADLOAZMNUHVQOR-HOCLYGCPSA-N 1 3 345.478 2.637 10 0 EFAEHO CC[C@H](F)C[N@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001490773081 1299225993 /nfs/dbraw/zinc/22/59/93/1299225993.db2.gz BKANVMCHKBJIGQ-ROUUACIJSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001490773081 1299225999 /nfs/dbraw/zinc/22/59/99/1299225999.db2.gz BKANVMCHKBJIGQ-ROUUACIJSA-N 1 3 341.515 2.637 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](C[N@H+](C)C/C=C\Cl)C1 ZINC001490785257 1299255145 /nfs/dbraw/zinc/25/51/45/1299255145.db2.gz YQIIVNJDVFCSTD-GJWDQICYSA-N 1 3 341.927 2.784 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](C[N@@H+](C)C/C=C\Cl)C1 ZINC001490785257 1299255165 /nfs/dbraw/zinc/25/51/65/1299255165.db2.gz YQIIVNJDVFCSTD-GJWDQICYSA-N 1 3 341.927 2.784 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)[C@H]1CCCN1C)Cc1ccccc1F ZINC001691744292 1313707435 /nfs/dbraw/zinc/70/74/35/1313707435.db2.gz MECVGZVKLDXCHB-GOSISDBHSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)[C@H]1CCCN1C)Cc1ccccc1F ZINC001691744292 1313707439 /nfs/dbraw/zinc/70/74/39/1313707439.db2.gz MECVGZVKLDXCHB-GOSISDBHSA-N 1 3 335.467 2.637 10 0 EFAEHO C/C(=C\c1ccc(F)cc1)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000855345547 1300924243 /nfs/dbraw/zinc/92/42/43/1300924243.db2.gz CRCDYHMAYJJFQW-MDJJKAFGSA-N 1 3 335.467 2.617 10 0 EFAEHO C/C(=C\c1ccc(F)cc1)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000855345547 1300924249 /nfs/dbraw/zinc/92/42/49/1300924249.db2.gz CRCDYHMAYJJFQW-MDJJKAFGSA-N 1 3 335.467 2.617 10 0 EFAEHO CC(C)c1cccc(CN2CCC(N3C(=O)O[C@H]4C[NH2+]C[C@H]43)CC2)c1 ZINC000863547170 1302644584 /nfs/dbraw/zinc/64/45/84/1302644584.db2.gz JOGHRSQGEFRMFD-MOPGFXCFSA-N 1 3 343.471 2.567 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CC[C@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000864620795 1303001798 /nfs/dbraw/zinc/00/17/98/1303001798.db2.gz PHZKPHRKHFECQC-LJQANCHMSA-N 1 3 332.492 2.977 10 0 EFAEHO CCN1CCC[C@@H](C[NH2+]C[C@H]2CCCN2C(=O)OC(C)(C)C)C1 ZINC000865437460 1303256201 /nfs/dbraw/zinc/25/62/01/1303256201.db2.gz NCSJKEICSBGGSX-JKSUJKDBSA-N 1 3 325.497 2.707 10 0 EFAEHO CN1CCC(O)(C[NH2+][C@@H](CCc2ccccc2)c2ccccn2)CC1 ZINC000866270980 1303587717 /nfs/dbraw/zinc/58/77/17/1303587717.db2.gz ANCZSSHUYICEPT-FQEVSTJZSA-N 1 3 339.483 2.802 10 0 EFAEHO C[NH+]1CCC(O)(CN[C@@H](CCc2ccccc2)c2ccccn2)CC1 ZINC000866270980 1303587720 /nfs/dbraw/zinc/58/77/20/1303587720.db2.gz ANCZSSHUYICEPT-FQEVSTJZSA-N 1 3 339.483 2.802 10 0 EFAEHO CC1(C)[C@H](N)c2ccccc2N1C(=O)[C@@H](C[NH3+])c1ccc(F)cc1 ZINC000867988601 1304061919 /nfs/dbraw/zinc/06/19/19/1304061919.db2.gz PPMRIYVNHHAZJY-DOTOQJQBSA-N 1 3 327.403 2.693 10 0 EFAEHO CN(C)CCN(C(=O)Nc1ccc([C@@H]2C[C@H]2[NH3+])cc1)C1CCCC1 ZINC000868183716 1304175215 /nfs/dbraw/zinc/17/52/15/1304175215.db2.gz RDAHMODGZQDOLL-ZWKOTPCHSA-N 1 3 330.476 2.839 10 0 EFAEHO CN(C)[C@@H](CNC(=O)Nc1ccc([C@@H]2C[C@H]2[NH3+])cc1)c1ccccc1 ZINC000868188610 1304178491 /nfs/dbraw/zinc/17/84/91/1304178491.db2.gz GAPXPVHKXFEWMY-OTWHNJEPSA-N 1 3 338.455 2.926 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H]2C)c1 ZINC001278325998 1314100854 /nfs/dbraw/zinc/10/08/54/1314100854.db2.gz MEXHQKIZSPJYPO-AZUAARDMSA-N 1 3 345.531 2.847 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+]CC1=CCCCC1)C1CC1)CC(C)(C)C ZINC001276656697 1314198472 /nfs/dbraw/zinc/19/84/72/1314198472.db2.gz RLAGATXLTJYSER-SFHVURJKSA-N 1 3 335.536 2.949 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H](C(=O)N(CCN(C)C)Cc2ccsc2)C1 ZINC001413088036 1307707820 /nfs/dbraw/zinc/70/78/20/1307707820.db2.gz YMCWWCZFBVFCPO-KRWDZBQOSA-N 1 3 337.533 2.759 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H](C(=O)N(CCN(C)C)Cc2ccsc2)C1 ZINC001413088036 1307707823 /nfs/dbraw/zinc/70/78/23/1307707823.db2.gz YMCWWCZFBVFCPO-KRWDZBQOSA-N 1 3 337.533 2.759 10 0 EFAEHO Cc1cc(C)c(CC(=O)NC2CCN(C3CC[NH+](C)CC3)CC2)s1 ZINC000900445324 1308168594 /nfs/dbraw/zinc/16/85/94/1308168594.db2.gz GWKICPZOXQJVEX-UHFFFAOYSA-N 1 3 349.544 2.582 10 0 EFAEHO CN(C[C@H]1CCC[N@H+](C)C1)C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000900725709 1308586389 /nfs/dbraw/zinc/58/63/89/1308586389.db2.gz NEXNOXDQBZPFSV-HNNXBMFYSA-N 1 3 328.460 2.705 10 0 EFAEHO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000900725709 1308586391 /nfs/dbraw/zinc/58/63/91/1308586391.db2.gz NEXNOXDQBZPFSV-HNNXBMFYSA-N 1 3 328.460 2.705 10 0 EFAEHO C[C@H]1C[N@@H+](C2CC2)C[C@@H]1NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC000901028436 1309231474 /nfs/dbraw/zinc/23/14/74/1309231474.db2.gz ZWVUYNQULLJUGM-GUYCJALGSA-N 1 3 326.444 2.503 10 0 EFAEHO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC000901028436 1309231487 /nfs/dbraw/zinc/23/14/87/1309231487.db2.gz ZWVUYNQULLJUGM-GUYCJALGSA-N 1 3 326.444 2.503 10 0 EFAEHO C[N@@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000901135341 1309576248 /nfs/dbraw/zinc/57/62/48/1309576248.db2.gz LTWZEUGAUBGYEI-SJLPKXTDSA-N 1 3 340.471 2.847 10 0 EFAEHO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000901135341 1309576260 /nfs/dbraw/zinc/57/62/60/1309576260.db2.gz LTWZEUGAUBGYEI-SJLPKXTDSA-N 1 3 340.471 2.847 10 0 EFAEHO CCc1ccc(CN2CCCC[C@@H]2CNC(=O)CC[NH+](C)C)cc1 ZINC001491226232 1311177205 /nfs/dbraw/zinc/17/72/05/1311177205.db2.gz UERNCGUDWXJMBI-LJQANCHMSA-N 1 3 331.504 2.671 10 0 EFAEHO C[C@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)NCc1ccc(Cl)s1 ZINC001491487084 1311192547 /nfs/dbraw/zinc/19/25/47/1311192547.db2.gz UHTQLRYARMEMQJ-CHWSQXEVSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)NCc1ccc(Cl)s1 ZINC001491487084 1311192550 /nfs/dbraw/zinc/19/25/50/1311192550.db2.gz UHTQLRYARMEMQJ-CHWSQXEVSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@@H](CCC[NH2+]C/C=C/Cl)NC(=O)C(C)(C)N1CCCCC1 ZINC001277186210 1311771619 /nfs/dbraw/zinc/77/16/19/1311771619.db2.gz DESNXQMUNPFQJB-HQPKTYMTSA-N 1 3 329.916 2.878 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CCC[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001277210909 1311808707 /nfs/dbraw/zinc/80/87/07/1311808707.db2.gz RPTIVEKMRHRZOX-INIZCTEOSA-N 1 3 349.494 2.993 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@H](C2CCN(C(=O)[C@@H]3CCCN3C)CC2)C1 ZINC001277276426 1311912302 /nfs/dbraw/zinc/91/23/02/1311912302.db2.gz ZVBQFDCNCNKMDU-UVEXCMSLSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@H](C2CCN(C(=O)[C@@H]3CCCN3C)CC2)C1 ZINC001277276426 1311912304 /nfs/dbraw/zinc/91/23/04/1311912304.db2.gz ZVBQFDCNCNKMDU-UVEXCMSLSA-N 1 3 347.547 2.997 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001277286064 1311931720 /nfs/dbraw/zinc/93/17/20/1311931720.db2.gz UMZFJWDZRAVKNR-LJQANCHMSA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001277286064 1311931723 /nfs/dbraw/zinc/93/17/23/1311931723.db2.gz UMZFJWDZRAVKNR-LJQANCHMSA-N 1 3 335.536 2.853 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@H]2C[C@H](C)Cc3cc(OC)ccc32)CC1 ZINC000902745214 1312070897 /nfs/dbraw/zinc/07/08/97/1312070897.db2.gz LWLHOZJKEUPNSC-UTKZUKDTSA-N 1 3 345.531 2.936 10 0 EFAEHO CCN1CCN([C@H](C)C[NH2+][C@@H](C)c2cccc(-n3ccnc3)c2)CC1 ZINC000902747429 1312072963 /nfs/dbraw/zinc/07/29/63/1312072963.db2.gz UKQOSBPGEIWMCC-MSOLQXFVSA-N 1 3 341.503 2.549 10 0 EFAEHO C[C@@H](CN[C@@H](C)C1(NC(=O)OC(C)(C)C)CC1)C[NH+]1CCCC1 ZINC000903071731 1312325777 /nfs/dbraw/zinc/32/57/77/1312325777.db2.gz AQXPFTUOZDHGHW-GJZGRUSLSA-N 1 3 325.497 2.754 10 0 EFAEHO C[C@@H](C[NH2+][C@@H](C)C1(NC(=O)OC(C)(C)C)CC1)CN1CCCC1 ZINC000903071731 1312325780 /nfs/dbraw/zinc/32/57/80/1312325780.db2.gz AQXPFTUOZDHGHW-GJZGRUSLSA-N 1 3 325.497 2.754 10 0 EFAEHO NC(=O)CC1CC([NH2+][C@@H]2CCC[C@H]3CN(Cc4ccccc4)C[C@H]32)C1 ZINC000903258927 1312514037 /nfs/dbraw/zinc/51/40/37/1312514037.db2.gz DJFXFDOEQFYBAA-KMMPOOCJSA-N 1 3 341.499 2.531 10 0 EFAEHO C1CCC([NH+]2CCC(N[C@@H]3CCCN4CCSC[C@H]34)CC2)CC1 ZINC000903272577 1312527742 /nfs/dbraw/zinc/52/77/42/1312527742.db2.gz WMLNLEDOMITZQK-RTBURBONSA-N 1 3 337.577 2.953 10 0 EFAEHO C[C@H]1C[C@H]([NH2+]CCCC2CCC2)CN1C(=O)CN1CCC(C)CC1 ZINC001278411926 1314512013 /nfs/dbraw/zinc/51/20/13/1314512013.db2.gz VRQYLIKWGQFXHN-HKUYNNGSSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CCCC2CCC2)CN1C(=O)CN1CCC(C)CC1 ZINC001278411927 1314512273 /nfs/dbraw/zinc/51/22/73/1314512273.db2.gz VRQYLIKWGQFXHN-IEBWSBKVSA-N 1 3 335.536 2.878 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1C[C@@H]2C[C@H]1CN2CCC1=CCCCC1 ZINC001318224278 1328532543 /nfs/dbraw/zinc/53/25/43/1328532543.db2.gz QGDFPUWNGKGODV-OALUTQOASA-N 1 3 333.520 2.894 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H]1C[C@@H](C)N(C(=O)CN2CCCC2)C1 ZINC001278424391 1314562678 /nfs/dbraw/zinc/56/26/78/1314562678.db2.gz QNZWXINKBSXFBL-UYAOXDASSA-N 1 3 343.515 2.602 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H](NC(=O)[C@H](C(C)C)N1CCCCC1)C1CC1 ZINC001276711245 1314689727 /nfs/dbraw/zinc/68/97/27/1314689727.db2.gz GWOPLUWGLFDEFJ-OALUTQOASA-N 1 3 335.536 2.948 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H](NC(=O)[C@@H](C(C)C)N1CCCCC1)C1CC1 ZINC001276711246 1314690069 /nfs/dbraw/zinc/69/00/69/1314690069.db2.gz GWOPLUWGLFDEFJ-RBUKOAKNSA-N 1 3 335.536 2.948 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CCCc1ccccc1 ZINC001322089323 1329427896 /nfs/dbraw/zinc/42/78/96/1329427896.db2.gz PMWDKDDYUFYRQM-HKUYNNGSSA-N 1 3 331.504 2.588 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001318374266 1328567648 /nfs/dbraw/zinc/56/76/48/1328567648.db2.gz OCNHKSROQVPIRN-ZMBJWTFHSA-N 1 3 329.488 2.909 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001318374266 1328567655 /nfs/dbraw/zinc/56/76/55/1328567655.db2.gz OCNHKSROQVPIRN-ZMBJWTFHSA-N 1 3 329.488 2.909 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@](C)(C[NH2+]CCc2ccccc2F)C1 ZINC001278571382 1315212899 /nfs/dbraw/zinc/21/28/99/1315212899.db2.gz FZRCYPVYSLQYCL-FQEVSTJZSA-N 1 3 349.494 2.538 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H](C[NH2+]CCc2cccs2)C1 ZINC001278613406 1315293596 /nfs/dbraw/zinc/29/35/96/1315293596.db2.gz LBKOXLFQZNVPJT-JKSUJKDBSA-N 1 3 337.533 2.505 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)N1CCN(CCC(C)(C)C)CC1 ZINC001252647055 1315481165 /nfs/dbraw/zinc/48/11/65/1315481165.db2.gz WIJCKUKBDAQXED-UHFFFAOYSA-N 1 3 340.556 2.728 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)N1CCN(CCC(C)(C)C)CC1 ZINC001252647055 1315481168 /nfs/dbraw/zinc/48/11/68/1315481168.db2.gz WIJCKUKBDAQXED-UHFFFAOYSA-N 1 3 340.556 2.728 10 0 EFAEHO CC(C)CCC[NH2+][C@@H](C)[C@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001279032216 1316081148 /nfs/dbraw/zinc/08/11/48/1316081148.db2.gz UYNMHGPJMZFPBB-OALUTQOASA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)CCC[NH2+][C@H](C)[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001279032220 1316081349 /nfs/dbraw/zinc/08/13/49/1316081349.db2.gz UYNMHGPJMZFPBB-RTBURBONSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([C@@H](C)[NH2+]CCCc2ccccc2)C1 ZINC001279047607 1316094360 /nfs/dbraw/zinc/09/43/60/1316094360.db2.gz XHXLVAKDIXMHOL-QUCCMNQESA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)CCC[NH2+]CC[C@@H]1[C@@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001263954743 1316574594 /nfs/dbraw/zinc/57/45/94/1316574594.db2.gz BORJIXVZWVVKRE-FUHWJXTLSA-N 1 3 334.508 2.995 10 0 EFAEHO Cc1cc(CN2CC[C@H](NC(=O)CCCC[NH+](C)C)[C@H]2C)cs1 ZINC001264169773 1316594432 /nfs/dbraw/zinc/59/44/32/1316594432.db2.gz VNKYZGHRFSHRDC-WBVHZDCISA-N 1 3 337.533 2.867 10 0 EFAEHO CC/C=C\CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCC[N@@H+](CCC)C1 ZINC001264368511 1316606683 /nfs/dbraw/zinc/60/66/83/1316606683.db2.gz GSYCODHNCDKHEV-OXUXSNCKSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCC[N@H+](CCC)C1 ZINC001264368511 1316606684 /nfs/dbraw/zinc/60/66/84/1316606684.db2.gz GSYCODHNCDKHEV-OXUXSNCKSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@@H]1CC[NH2+]CCC(C)(C)C ZINC001264517627 1316626925 /nfs/dbraw/zinc/62/69/25/1316626925.db2.gz IRUKXVWWCFGGQG-DOTOQJQBSA-N 1 3 334.508 2.995 10 0 EFAEHO C[C@@H](c1cccc(F)c1)[N@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001264994599 1316682919 /nfs/dbraw/zinc/68/29/19/1316682919.db2.gz CVTFVAQKQVCQLY-HNNXBMFYSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H](c1cccc(F)c1)[N@@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001264994599 1316682921 /nfs/dbraw/zinc/68/29/21/1316682921.db2.gz CVTFVAQKQVCQLY-HNNXBMFYSA-N 1 3 335.467 2.809 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)Cc1cccc(Cl)c1)N(C)C ZINC001265036529 1316696993 /nfs/dbraw/zinc/69/69/93/1316696993.db2.gz GLBKOWPVEGVFEI-INIZCTEOSA-N 1 3 325.884 2.618 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)Cc1cccc(Cl)c1)N(C)C ZINC001265036529 1316696996 /nfs/dbraw/zinc/69/69/96/1316696996.db2.gz GLBKOWPVEGVFEI-INIZCTEOSA-N 1 3 325.884 2.618 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)[C@@H]1CCc2c1cccc2F)N(C)C ZINC001265037278 1316697313 /nfs/dbraw/zinc/69/73/13/1316697313.db2.gz UANCKWYREQZVCW-ZWKOTPCHSA-N 1 3 335.467 2.591 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)[C@@H]1CCc2c1cccc2F)N(C)C ZINC001265037278 1316697315 /nfs/dbraw/zinc/69/73/15/1316697315.db2.gz UANCKWYREQZVCW-ZWKOTPCHSA-N 1 3 335.467 2.591 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[N@H+](C)CCCNC(=O)CN1CCCC1 ZINC001265068637 1316709842 /nfs/dbraw/zinc/70/98/42/1316709842.db2.gz PUMWENVYZXJBSM-UHFFFAOYSA-N 1 3 346.519 2.547 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[N@@H+](C)CCCNC(=O)CN1CCCC1 ZINC001265068637 1316709844 /nfs/dbraw/zinc/70/98/44/1316709844.db2.gz PUMWENVYZXJBSM-UHFFFAOYSA-N 1 3 346.519 2.547 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](C)CCc1cccs1 ZINC001265073109 1316711712 /nfs/dbraw/zinc/71/17/12/1316711712.db2.gz QHPFKLRIQZGNKY-KRWDZBQOSA-N 1 3 337.533 2.603 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](C)CCc1cccs1 ZINC001265073109 1316711713 /nfs/dbraw/zinc/71/17/13/1316711713.db2.gz QHPFKLRIQZGNKY-KRWDZBQOSA-N 1 3 337.533 2.603 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](C)CCc1cccs1 ZINC001265073110 1316712067 /nfs/dbraw/zinc/71/20/67/1316712067.db2.gz QHPFKLRIQZGNKY-QGZVFWFLSA-N 1 3 337.533 2.603 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](C)CCc1cccs1 ZINC001265073110 1316712069 /nfs/dbraw/zinc/71/20/69/1316712069.db2.gz QHPFKLRIQZGNKY-QGZVFWFLSA-N 1 3 337.533 2.603 10 0 EFAEHO C[C@@H](NCc1ccccn1)[C@H]1CCCCN1C(=O)CCCC[NH+](C)C ZINC001265092920 1316718836 /nfs/dbraw/zinc/71/88/36/1316718836.db2.gz WPTJYXBRSIBREV-IEBWSBKVSA-N 1 3 346.519 2.673 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](CC)[C@H]1CCc2ccc(F)cc21)N(C)C ZINC001265143085 1316736171 /nfs/dbraw/zinc/73/61/71/1316736171.db2.gz WUDSUNDWOYJWLQ-OALUTQOASA-N 1 3 349.494 2.981 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](CC)[C@H]1CCc2ccc(F)cc21)N(C)C ZINC001265143085 1316736173 /nfs/dbraw/zinc/73/61/73/1316736173.db2.gz WUDSUNDWOYJWLQ-OALUTQOASA-N 1 3 349.494 2.981 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N[C@@H]1CCCN(CCCCCF)C1 ZINC001265218990 1316756403 /nfs/dbraw/zinc/75/64/03/1316756403.db2.gz QGZOSXGMSYBHGQ-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N[C@@H]1CCCN(CCCCCF)C1 ZINC001265218990 1316756406 /nfs/dbraw/zinc/75/64/06/1316756406.db2.gz QGZOSXGMSYBHGQ-MSOLQXFVSA-N 1 3 341.515 2.827 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)N[C@H]1CCCN(CC2=CCCCC2)C1 ZINC001265235984 1316763378 /nfs/dbraw/zinc/76/33/78/1316763378.db2.gz ZUUZREDURDCEEV-IBGZPJMESA-N 1 3 333.520 2.943 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CCC[N@H+](CC3=CCCCC3)C2)CCC1 ZINC001265583862 1316828871 /nfs/dbraw/zinc/82/88/71/1316828871.db2.gz AISRQKOCKANNLB-GOSISDBHSA-N 1 3 333.520 2.799 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CCC[N@@H+](CC3=CCCCC3)C2)CCC1 ZINC001265583862 1316828872 /nfs/dbraw/zinc/82/88/72/1316828872.db2.gz AISRQKOCKANNLB-GOSISDBHSA-N 1 3 333.520 2.799 10 0 EFAEHO CC(C)CCC[NH2+]C[C@H]1CCCCN1C(=O)[C@@H](C(C)C)N(C)C ZINC001265688039 1316854473 /nfs/dbraw/zinc/85/44/73/1316854473.db2.gz LGLZTPDQHOZRBK-QZTJIDSGSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H](C)CNC(=O)C2(N(C)C)CCC2)c1 ZINC001265783014 1316876717 /nfs/dbraw/zinc/87/67/17/1316876717.db2.gz FZFXGFJEGHOZSQ-QGZVFWFLSA-N 1 3 331.504 2.506 10 0 EFAEHO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)CCCNC(=O)[C@H]1CCCN1C ZINC001265815228 1316882007 /nfs/dbraw/zinc/88/20/07/1316882007.db2.gz SLPSFBOLLGBOIB-SUMWQHHRSA-N 1 3 339.430 2.558 10 0 EFAEHO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)CCCNC(=O)[C@H]1CCCN1C ZINC001265815228 1316882010 /nfs/dbraw/zinc/88/20/10/1316882010.db2.gz SLPSFBOLLGBOIB-SUMWQHHRSA-N 1 3 339.430 2.558 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+](C)CCCNC(=O)CN(C)C1CCC1 ZINC001265862824 1316896379 /nfs/dbraw/zinc/89/63/79/1316896379.db2.gz JBFJJNVDYFBNBI-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+](C)CCCNC(=O)CN(C)C1CCC1 ZINC001265862824 1316896382 /nfs/dbraw/zinc/89/63/82/1316896382.db2.gz JBFJJNVDYFBNBI-UHFFFAOYSA-N 1 3 335.467 2.557 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@@H](C[NH2+]CCC3CC3)C2)c1 ZINC001266040217 1316968968 /nfs/dbraw/zinc/96/89/68/1316968968.db2.gz JFNOVQGPHNVVIJ-SFHVURJKSA-N 1 3 329.488 2.600 10 0 EFAEHO O[C@]1(CNCCc2c(F)cccc2F)CC[N@H+](Cc2ccccc2)C1 ZINC000702563669 1316976508 /nfs/dbraw/zinc/97/65/08/1316976508.db2.gz RFKZIHZGQRNEMV-FQEVSTJZSA-N 1 3 346.421 2.734 10 0 EFAEHO O[C@]1(CNCCc2c(F)cccc2F)CC[N@@H+](Cc2ccccc2)C1 ZINC000702563669 1316976514 /nfs/dbraw/zinc/97/65/14/1316976514.db2.gz RFKZIHZGQRNEMV-FQEVSTJZSA-N 1 3 346.421 2.734 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1cccc(C)c1 ZINC001266082576 1317008477 /nfs/dbraw/zinc/00/84/77/1317008477.db2.gz KGRNUXNLJFOPEU-GOSISDBHSA-N 1 3 331.504 2.665 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1cccc(C)c1 ZINC001266082576 1317008485 /nfs/dbraw/zinc/00/84/85/1317008485.db2.gz KGRNUXNLJFOPEU-GOSISDBHSA-N 1 3 331.504 2.665 10 0 EFAEHO Cc1cccc(CCC[NH2+]C2CC(N(C)C(=O)CN3CCCC3)C2)c1 ZINC001279322754 1317236192 /nfs/dbraw/zinc/23/61/92/1317236192.db2.gz UYGPMPYDKRAQHV-UHFFFAOYSA-N 1 3 343.515 2.602 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1=CC[N@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001279676301 1317358186 /nfs/dbraw/zinc/35/81/86/1317358186.db2.gz ZCSNDPNJDWAMSB-LJQANCHMSA-N 1 3 347.547 2.901 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1=CC[N@@H+](CC2CC3(CCC3)C2)CC1)N(C)C ZINC001279676301 1317358195 /nfs/dbraw/zinc/35/81/95/1317358195.db2.gz ZCSNDPNJDWAMSB-LJQANCHMSA-N 1 3 347.547 2.901 10 0 EFAEHO CCC/C=C/CC[NH+]1CCC2(CN(C(=O)[C@H](CC)N(C)C)C2)CC1 ZINC001280394783 1317541128 /nfs/dbraw/zinc/54/11/28/1317541128.db2.gz YSPKFTOSUMQULX-BLGFXRMMSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@@H]1C[NH2+]CCc1cccs1)N(C)C ZINC001280458238 1317571786 /nfs/dbraw/zinc/57/17/86/1317571786.db2.gz VKMKMIHDUYMCOP-NVXWUHKLSA-N 1 3 337.533 2.602 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC(CC[NH2+]CCCC2CCC2)CC1 ZINC001318875531 1328730293 /nfs/dbraw/zinc/73/02/93/1328730293.db2.gz VXLZZTKSYLYVKH-LJQANCHMSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@@H]1CC[N@@H+]1CCC1=CCCCC1)N(C)C ZINC001316607737 1317920927 /nfs/dbraw/zinc/92/09/27/1317920927.db2.gz UURZDWIRSFYALI-RBUKOAKNSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@@H]1CC[N@H+]1CCC1=CCCCC1)N(C)C ZINC001316607737 1317920930 /nfs/dbraw/zinc/92/09/30/1317920930.db2.gz UURZDWIRSFYALI-RBUKOAKNSA-N 1 3 335.536 2.996 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@]2(CCN(C/C=C/Cl)C2)C1 ZINC001281098483 1318013016 /nfs/dbraw/zinc/01/30/16/1318013016.db2.gz CQUPCWSSUOHAAE-WGLAMXGCSA-N 1 3 341.927 2.785 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[N@H+](CCCCCF)CC2(C)C)CCC1 ZINC001281557896 1318451974 /nfs/dbraw/zinc/45/19/74/1318451974.db2.gz QUWVWSYCQOQLFR-INIZCTEOSA-N 1 3 341.515 2.827 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[N@@H+](CCCCCF)CC2(C)C)CCC1 ZINC001281557896 1318451978 /nfs/dbraw/zinc/45/19/78/1318451978.db2.gz QUWVWSYCQOQLFR-INIZCTEOSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1CCCCCF ZINC001281666368 1318532273 /nfs/dbraw/zinc/53/22/73/1318532273.db2.gz XKFKVRPBLIBKOE-HZPDHXFCSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@H+]1CCCCCF ZINC001281666368 1318532279 /nfs/dbraw/zinc/53/22/79/1318532279.db2.gz XKFKVRPBLIBKOE-HZPDHXFCSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001282057345 1318689970 /nfs/dbraw/zinc/68/99/70/1318689970.db2.gz IYTCZAVQTBJFGA-IIVFGPHZSA-N 1 3 329.488 2.524 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CCCN1C)CC2 ZINC001319140275 1328787733 /nfs/dbraw/zinc/78/77/33/1328787733.db2.gz UINIRDMQONFDTP-WRFKIARRSA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CCCN1C)CC2 ZINC001319140275 1328787740 /nfs/dbraw/zinc/78/77/40/1328787740.db2.gz UINIRDMQONFDTP-WRFKIARRSA-N 1 3 333.520 2.751 10 0 EFAEHO C[C@@H](CCC[NH2+]CC1CCC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001283239771 1319454483 /nfs/dbraw/zinc/45/44/83/1319454483.db2.gz OPHRRPNIDFMTDK-KXBFYZLASA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@@H]1C[C@@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001284033095 1320158173 /nfs/dbraw/zinc/15/81/73/1320158173.db2.gz NPSDYIPPNYCTPS-UYAOXDASSA-N 1 3 345.531 2.847 10 0 EFAEHO CCCC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN3CCC(C)CC3)C[C@@H]21 ZINC001284095289 1320190164 /nfs/dbraw/zinc/19/01/64/1320190164.db2.gz FSRYIDGJSDGGMD-CEXWTWQISA-N 1 3 335.536 2.735 10 0 EFAEHO CCCCC[NH+]1CC2(C1)CCN(C(=O)CN1CCC(C)CC1)CC2 ZINC001319408802 1328876100 /nfs/dbraw/zinc/87/61/00/1328876100.db2.gz ZRTKIIGXDNYPBR-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO CN(C)C1(C(=O)N2C[C@@H]([NH2+]CCCC3CCC3)C(C)(C)C2)CCC1 ZINC001284292188 1320306161 /nfs/dbraw/zinc/30/61/61/1320306161.db2.gz QADUIIIHYYFFOJ-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C2CC([NH2+]CCCC3CCCC3)C2)C1 ZINC001284790860 1320528710 /nfs/dbraw/zinc/52/87/10/1320528710.db2.gz XJRMESDVFYDWSV-IVMQYODDSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(CCC[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001319533927 1328911051 /nfs/dbraw/zinc/91/10/51/1328911051.db2.gz LJWJOPYMIDRUEC-RTBURBONSA-N 1 3 345.531 2.706 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@H]1CC[NH2+]Cc1ccc(F)cc1 ZINC001319770522 1328984019 /nfs/dbraw/zinc/98/40/19/1328984019.db2.gz SZIMEEFIPNZJIE-RBUKOAKNSA-N 1 3 347.478 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1CC[NH2+]Cc1ccccc1 ZINC001319788419 1328989391 /nfs/dbraw/zinc/98/93/91/1328989391.db2.gz NNCFHSDIVFABKH-IBGZPJMESA-N 1 3 331.504 2.889 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@H+](C)CCCCC(F)(F)F)CCC1 ZINC001320009293 1329056282 /nfs/dbraw/zinc/05/62/82/1329056282.db2.gz QEGSHJGFFLSCPL-UHFFFAOYSA-N 1 3 337.430 2.594 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[N@@H+](C)CCCCC(F)(F)F)CCC1 ZINC001320009293 1329056287 /nfs/dbraw/zinc/05/62/87/1329056287.db2.gz QEGSHJGFFLSCPL-UHFFFAOYSA-N 1 3 337.430 2.594 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](C[NH2+]Cc2ccsc2)C1)CC(C)(C)C ZINC001491835004 1323929118 /nfs/dbraw/zinc/92/91/18/1323929118.db2.gz RSVIBOXEIBHUDQ-HNNXBMFYSA-N 1 3 337.533 2.664 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](C[NH2+]CCCc2ccccc2)C1)N(C)C ZINC001491849819 1323945969 /nfs/dbraw/zinc/94/59/69/1323945969.db2.gz MVHZFGODUQJRLF-PMACEKPBSA-N 1 3 345.531 2.644 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CCNC/C(Cl)=C/Cl ZINC001320416399 1329127088 /nfs/dbraw/zinc/12/70/88/1329127088.db2.gz TXVDQMGIKDQKOX-HSWBZUAGSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CCNC/C(Cl)=C/Cl ZINC001320416399 1329127093 /nfs/dbraw/zinc/12/70/93/1329127093.db2.gz TXVDQMGIKDQKOX-HSWBZUAGSA-N 1 3 336.307 2.663 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)N1CCCC[C@@H]1CNCCF ZINC001317187186 1324121256 /nfs/dbraw/zinc/12/12/56/1324121256.db2.gz DIWDIDARWMDCQA-MRXNPFEDSA-N 1 3 327.488 2.580 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)N1CCCC[C@@H]1CNCCF ZINC001317187186 1324121262 /nfs/dbraw/zinc/12/12/62/1324121262.db2.gz DIWDIDARWMDCQA-MRXNPFEDSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)(C(=O)NCCC[C@@H]1CCC[N@@H+]1CCCF)N1CCCCC1 ZINC001492153937 1324278644 /nfs/dbraw/zinc/27/86/44/1324278644.db2.gz BOSNWUURQUJSIR-QGZVFWFLSA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)(C(=O)NCCC[C@@H]1CCC[N@H+]1CCCF)N1CCCCC1 ZINC001492153937 1324278652 /nfs/dbraw/zinc/27/86/52/1324278652.db2.gz BOSNWUURQUJSIR-QGZVFWFLSA-N 1 3 341.515 2.971 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)c1 ZINC001492303296 1324406045 /nfs/dbraw/zinc/40/60/45/1324406045.db2.gz JRGCRAITEPLSMU-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)c1 ZINC001492303296 1324406048 /nfs/dbraw/zinc/40/60/48/1324406048.db2.gz JRGCRAITEPLSMU-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001492293906 1324435849 /nfs/dbraw/zinc/43/58/49/1324435849.db2.gz QGNQPBDGODQXPX-GOSISDBHSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001492293906 1324435855 /nfs/dbraw/zinc/43/58/55/1324435855.db2.gz QGNQPBDGODQXPX-GOSISDBHSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1cccc([C@@H](C)N(C)CCNC(=O)C23CCC[NH+](CCC2)C3)c1 ZINC001492299396 1324439297 /nfs/dbraw/zinc/43/92/97/1324439297.db2.gz VQFOMSCFQFFSQD-GOSISDBHSA-N 1 3 343.515 2.980 10 0 EFAEHO C[C@@H](c1ccccc1)N(C)CCNC(=O)C12CCC[NH+](CCC1)C2 ZINC001492298288 1324439510 /nfs/dbraw/zinc/43/95/10/1324439510.db2.gz BHCQIWFGDRWDES-KRWDZBQOSA-N 1 3 329.488 2.672 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001492420975 1324498627 /nfs/dbraw/zinc/49/86/27/1324498627.db2.gz FLKNCJMWKAEVQY-LPHOPBHVSA-N 1 3 343.531 2.929 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001492420975 1324498624 /nfs/dbraw/zinc/49/86/24/1324498624.db2.gz FLKNCJMWKAEVQY-LPHOPBHVSA-N 1 3 343.531 2.929 10 0 EFAEHO CCc1cccc(C[NH2+]CC[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001320548488 1329160490 /nfs/dbraw/zinc/16/04/90/1329160490.db2.gz LJUGMOHNJBYNHR-DLBZAZTESA-N 1 3 331.504 2.575 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001320553602 1329161066 /nfs/dbraw/zinc/16/10/66/1329161066.db2.gz UZEGSGORQLEXST-YOEHRIQHSA-N 1 3 339.911 2.973 10 0 EFAEHO C[C@@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)[C@@H]1CC[NH2+]CCF ZINC001316683445 1324569297 /nfs/dbraw/zinc/56/92/97/1324569297.db2.gz DNAOEPIMQDYXMX-VQIMIIECSA-N 1 3 349.494 2.938 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]CCC(F)(F)F ZINC001320564797 1329166525 /nfs/dbraw/zinc/16/65/25/1329166525.db2.gz UMNQKTWOVTVHCZ-UONOGXRCSA-N 1 3 337.430 2.686 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1c(C)cccc1Cl)N(C)C ZINC001320608599 1329176011 /nfs/dbraw/zinc/17/60/11/1329176011.db2.gz PFKIARHJCPSZMB-WMLDXEAASA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1sccc1Cl)N(C)C ZINC001320605717 1329176471 /nfs/dbraw/zinc/17/64/71/1329176471.db2.gz DLOXWSCDFAKIOF-DGCLKSJQSA-N 1 3 331.913 2.726 10 0 EFAEHO CC[NH2+]CCC[C@@H]1[C@H](C)CCCN1C(=O)CN(C)CC(C)(C)C ZINC001316715103 1325091616 /nfs/dbraw/zinc/09/16/16/1325091616.db2.gz SNLUVVIGARMPOK-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001316861921 1325232769 /nfs/dbraw/zinc/23/27/69/1325232769.db2.gz JFBMTYMDHQZEOV-CQSZACIVSA-N 1 3 342.434 2.524 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001316861921 1325232779 /nfs/dbraw/zinc/23/27/79/1325232779.db2.gz JFBMTYMDHQZEOV-CQSZACIVSA-N 1 3 342.434 2.524 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](CC2CC(C)(C)C2)C2CC2)C1 ZINC001316922652 1325358790 /nfs/dbraw/zinc/35/87/90/1325358790.db2.gz CSCQYMGQUYSAJN-MRXNPFEDSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](CC2CC(C)(C)C2)C2CC2)C1 ZINC001316922652 1325358797 /nfs/dbraw/zinc/35/87/97/1325358797.db2.gz CSCQYMGQUYSAJN-MRXNPFEDSA-N 1 3 335.536 2.735 10 0 EFAEHO CCC/C=C/CC[NH+]1CCC(N(C)C(=O)CN2CC[C@H](C)C2)CC1 ZINC001316933312 1325381346 /nfs/dbraw/zinc/38/13/46/1325381346.db2.gz IPUQZLFSWDUYQN-DKFQHHCZSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[NH+]1CCC(N(C)C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001316933314 1325381532 /nfs/dbraw/zinc/38/15/32/1325381532.db2.gz IPUQZLFSWDUYQN-IPLHWJFFSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCN(C(=O)C1(C[NH+](C)C)CC1)C1CCN(CC=C(C)C)CC1 ZINC001317007001 1325477235 /nfs/dbraw/zinc/47/72/35/1325477235.db2.gz VKOPBEUVSJEPRV-UHFFFAOYSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)=CC[NH2+][C@@H](CNC(=O)c1cccc(CN(C)C)c1)C1CC1 ZINC001317032923 1325498055 /nfs/dbraw/zinc/49/80/55/1325498055.db2.gz DBJSFAACAHAFCI-IBGZPJMESA-N 1 3 329.488 2.812 10 0 EFAEHO CC/C=C/CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001317047208 1325516762 /nfs/dbraw/zinc/51/67/62/1325516762.db2.gz LFBWAAUICPJKKD-IBMHEYTHSA-N 1 3 333.520 2.892 10 0 EFAEHO CC/C=C/CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[C@H]1CCC[N@H+]1C ZINC001317047208 1325516768 /nfs/dbraw/zinc/51/67/68/1325516768.db2.gz LFBWAAUICPJKKD-IBMHEYTHSA-N 1 3 333.520 2.892 10 0 EFAEHO CC[C@@H](F)CNC[C@H](C)N(C)C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001374259721 1341623223 /nfs/dbraw/zinc/62/32/23/1341623223.db2.gz KWWAKGOEYZTRPK-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO CCN(CCNCc1cc2ccccc2o1)C(=O)C[N@@H+]1CC[C@H](C)C1 ZINC001320841420 1329309098 /nfs/dbraw/zinc/30/90/98/1329309098.db2.gz WPGJPHYQNYRSIY-INIZCTEOSA-N 1 3 343.471 2.713 10 0 EFAEHO CCN(CCNCc1cc2ccccc2o1)C(=O)C[N@H+]1CC[C@H](C)C1 ZINC001320841420 1329309101 /nfs/dbraw/zinc/30/91/01/1329309101.db2.gz WPGJPHYQNYRSIY-INIZCTEOSA-N 1 3 343.471 2.713 10 0 EFAEHO CN1CCC[C@H]1C(=O)NC/C=C/C[NH2+]Cc1ccc2ccccc2c1 ZINC001320996830 1329329038 /nfs/dbraw/zinc/32/90/38/1329329038.db2.gz GEGGTUNHOZKBSW-SGSXCFNPSA-N 1 3 337.467 2.696 10 0 EFAEHO C[C@@H]1CCC[C@H](CC[NH2+]C/C=C/CNC(=O)C2(N(C)C)CCC2)C1 ZINC001321091253 1329341641 /nfs/dbraw/zinc/34/16/41/1329341641.db2.gz HLZDJDTZUBIZMP-UBZMYNMCSA-N 1 3 335.536 2.949 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C/C=C/CNC(=O)C1(N(C)C)CCC1 ZINC001321092499 1329341655 /nfs/dbraw/zinc/34/16/55/1329341655.db2.gz ROULJJSKULOZDR-OZSKJFCKSA-N 1 3 329.488 2.802 10 0 EFAEHO CC[C@@H](C)C[N@H+]1CCC[C@@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001376537328 1343663534 /nfs/dbraw/zinc/66/35/34/1343663534.db2.gz FVASSAFWSXKFLT-SJORKVTESA-N 1 3 325.541 2.839 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NC/C=C\C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001321189456 1329354503 /nfs/dbraw/zinc/35/45/03/1329354503.db2.gz MXPBEZDONUZCNL-JUOQMLADSA-N 1 3 345.462 2.559 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/C[NH2+][C@H]1CCc2ccc(F)cc21)N(C)C ZINC001321350519 1329375878 /nfs/dbraw/zinc/37/58/78/1329375878.db2.gz NKSAAXGWKJZHDY-OBNUAKFSSA-N 1 3 347.478 2.661 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](C[NH2+]CCC2CCCCCC2)C1 ZINC001317332320 1327863346 /nfs/dbraw/zinc/86/33/46/1327863346.db2.gz YJAZSQWGSLBNSU-RBUKOAKNSA-N 1 3 335.536 2.879 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@H](C[NH2+]CCCC3CCC3)C2)CC1 ZINC001317336561 1327865854 /nfs/dbraw/zinc/86/58/54/1327865854.db2.gz JSYUASBEAUPFPO-IBGZPJMESA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[NH2+]CCCc2ccc(C)cc2)C1)N(C)C ZINC001317344424 1327874432 /nfs/dbraw/zinc/87/44/32/1327874432.db2.gz RPOGOWFFVCPTSS-WOJBJXKFSA-N 1 3 345.531 2.706 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@@H]([NH2+]CCCCCF)C2)CCC1 ZINC001317352533 1327884402 /nfs/dbraw/zinc/88/44/02/1327884402.db2.gz RENUORMDELNCPI-CVEARBPZSA-N 1 3 327.488 2.628 10 0 EFAEHO CC[C@@H]([NH2+]C/C=C/CNC(=O)CN1CCCC1)c1ccc(F)cc1 ZINC001321401098 1329382679 /nfs/dbraw/zinc/38/26/79/1329382679.db2.gz GDKFHYTVJQAGCJ-OAJJDEHYSA-N 1 3 333.451 2.635 10 0 EFAEHO CC[C@H]([NH2+]C/C=C/CNC(=O)CN1CCCC1)c1ccc(F)cc1 ZINC001321401099 1329382722 /nfs/dbraw/zinc/38/27/22/1329382722.db2.gz GDKFHYTVJQAGCJ-WHLIDYPQSA-N 1 3 333.451 2.635 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C/C[NH2+]Cc1cc(F)ccc1C ZINC001321421194 1329384722 /nfs/dbraw/zinc/38/47/22/1329384722.db2.gz VUGXLMKELUYIHE-ZMBJWTFHSA-N 1 3 347.478 2.771 10 0 EFAEHO C[NH+]1CCC(C(=O)NC[C@H]2CCCN2CCCCC(F)(F)F)CC1 ZINC001317508101 1328091816 /nfs/dbraw/zinc/09/18/16/1328091816.db2.gz MJNOYAAVIHRGJW-OAHLLOKOSA-N 1 3 349.441 2.641 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[NH2+]Cc1cc2ccccc2s1)N(C)C ZINC001317654448 1328240024 /nfs/dbraw/zinc/24/00/24/1328240024.db2.gz KQVAORDPZGZUHI-MRXNPFEDSA-N 1 3 333.501 2.790 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]CC[C@@H]1CCCC1(F)F ZINC001317662846 1328253011 /nfs/dbraw/zinc/25/30/11/1328253011.db2.gz ABNXPXVNWUNTGM-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]C/C=C/c1ccccc1 ZINC001321755733 1329407050 /nfs/dbraw/zinc/40/70/50/1329407050.db2.gz DYIZRRYGBLYCFW-VHYZBGKTSA-N 1 3 329.488 2.669 10 0 EFAEHO CC(C)[N@H+](CCCF)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001317701575 1328308325 /nfs/dbraw/zinc/30/83/25/1328308325.db2.gz DDMSNBFCRGMBKS-GOSISDBHSA-N 1 3 347.494 2.775 10 0 EFAEHO CC(C)[N@@H+](CCCF)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001317701575 1328308333 /nfs/dbraw/zinc/30/83/33/1328308333.db2.gz DDMSNBFCRGMBKS-GOSISDBHSA-N 1 3 347.494 2.775 10 0 EFAEHO CC(C)N(C/C=C\Cl)CCCNC(=O)CC1CC[NH+](C)CC1 ZINC001317706066 1328311905 /nfs/dbraw/zinc/31/19/05/1328311905.db2.gz ZXFUGDBLZIMONA-YWEYNIOJSA-N 1 3 329.916 2.688 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](C[N@H+](C)CCC3=CCCCC3)C2)C1 ZINC001317852865 1328417664 /nfs/dbraw/zinc/41/76/64/1328417664.db2.gz IVULDWPMJZQDDJ-ICSRJNTNSA-N 1 3 347.547 2.999 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](C[N@@H+](C)CCC3=CCCCC3)C2)C1 ZINC001317852865 1328417668 /nfs/dbraw/zinc/41/76/68/1328417668.db2.gz IVULDWPMJZQDDJ-ICSRJNTNSA-N 1 3 347.547 2.999 10 0 EFAEHO C[C@@H](C[NH2+]CCc1cccs1)NC(=O)c1cccc(CN(C)C)c1 ZINC001322087347 1329427309 /nfs/dbraw/zinc/42/73/09/1329427309.db2.gz HHFOVRRTFNZTKJ-HNNXBMFYSA-N 1 3 345.512 2.760 10 0 EFAEHO CC[C@@H](C)C[NH2+]CCCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001322695109 1329480555 /nfs/dbraw/zinc/48/05/55/1329480555.db2.gz WPLGXJRQMNWREV-QAPCUYQASA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@H](C)C[NH2+]CCCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001322695111 1329480584 /nfs/dbraw/zinc/48/05/84/1329480584.db2.gz WPLGXJRQMNWREV-YJBOKZPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc(C(C)(C)C)cc1)C(=O)Cc1c[nH]cn1 ZINC001322709323 1329481659 /nfs/dbraw/zinc/48/16/59/1329481659.db2.gz BNYCEKLJGPBSRS-UHFFFAOYSA-N 1 3 342.487 2.888 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[NH2+]Cc1ccc(F)cc1C ZINC001322851773 1329494567 /nfs/dbraw/zinc/49/45/67/1329494567.db2.gz CUULKTOODCHSQP-IBGZPJMESA-N 1 3 349.494 2.947 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+]C/C=C/c2ccccc2)C2CC2)CCC1 ZINC001323013559 1329504994 /nfs/dbraw/zinc/50/49/94/1329504994.db2.gz CSFDLICBLBHKAN-IUYMFKLXSA-N 1 3 341.499 2.669 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@]2(CCN(C(=O)CCCC[NH+](C)C)C2)C1 ZINC001323817235 1329574738 /nfs/dbraw/zinc/57/47/38/1329574738.db2.gz ZGDXSWGMLVFDQC-MJGOQNOKSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCCC[NH+]1CCC2(CCN(C(=O)C3(N(C)C)CCC3)C2)CC1 ZINC001323832226 1329575724 /nfs/dbraw/zinc/57/57/24/1329575724.db2.gz LVCPBEZRHIQLQL-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO CC[N@H+](CCC(F)(F)F)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001381260092 1348169752 /nfs/dbraw/zinc/16/97/52/1348169752.db2.gz ZBFDYBSKQAYSPR-UHFFFAOYSA-N 1 3 349.441 2.595 10 0 EFAEHO CC[N@@H+](CCC(F)(F)F)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001381260092 1348169756 /nfs/dbraw/zinc/16/97/56/1348169756.db2.gz ZBFDYBSKQAYSPR-UHFFFAOYSA-N 1 3 349.441 2.595 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC[C@H]2CNCC=C(Cl)Cl)CC[N@@H+]1C ZINC001324214373 1329608614 /nfs/dbraw/zinc/60/86/14/1329608614.db2.gz XDIPUBUYUCHSID-IHRRRGAJSA-N 1 3 348.318 2.616 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC[C@H]2CNCC=C(Cl)Cl)CC[N@H+]1C ZINC001324214373 1329608615 /nfs/dbraw/zinc/60/86/15/1329608615.db2.gz XDIPUBUYUCHSID-IHRRRGAJSA-N 1 3 348.318 2.616 10 0 EFAEHO CC(C)CC[NH2+]C[C@@H]1CCCN1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001324226769 1329609534 /nfs/dbraw/zinc/60/95/34/1329609534.db2.gz VHKBQDKAJQQCNP-QFBILLFUSA-N 1 3 341.515 2.826 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001324261841 1329612211 /nfs/dbraw/zinc/61/22/11/1329612211.db2.gz SGSFHXGSXFXTFP-ZDUSSCGKSA-N 1 3 336.307 2.618 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@@]1(C)CCN(CCc2ccccc2F)C1 ZINC001324669794 1329650217 /nfs/dbraw/zinc/65/02/17/1329650217.db2.gz RECMRTXHODSTEF-FQEVSTJZSA-N 1 3 349.494 2.681 10 0 EFAEHO CCCC[NH2+]C[C@@]1(C)CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001324790815 1329658152 /nfs/dbraw/zinc/65/81/52/1329658152.db2.gz SRQMPWHSHPZDAA-RTBURBONSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCCC[N@@H+]1CCC[C@](C)(CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001324977659 1329664754 /nfs/dbraw/zinc/66/47/54/1329664754.db2.gz RJLRFDDUDULAJO-PKOBYXMFSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCCC[N@H+]1CCC[C@](C)(CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001324977659 1329664755 /nfs/dbraw/zinc/66/47/55/1329664755.db2.gz RJLRFDDUDULAJO-PKOBYXMFSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@H]1C(=O)N(CCNCCF)Cc1ccccc1 ZINC001325700754 1329707359 /nfs/dbraw/zinc/70/73/59/1329707359.db2.gz GIYIKAGQESTQGH-IBGZPJMESA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@H]1C(=O)N(CCNCCF)Cc1ccccc1 ZINC001325700754 1329707360 /nfs/dbraw/zinc/70/73/60/1329707360.db2.gz GIYIKAGQESTQGH-IBGZPJMESA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)N(CCNCCF)Cc1ccccc1 ZINC001325700756 1329707453 /nfs/dbraw/zinc/70/74/53/1329707453.db2.gz GIYIKAGQESTQGH-LJQANCHMSA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)N(CCNCCF)Cc1ccccc1 ZINC001325700756 1329707455 /nfs/dbraw/zinc/70/74/55/1329707455.db2.gz GIYIKAGQESTQGH-LJQANCHMSA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@@H]2[C@H]1CC[N@@H+]2CCCCCF)N(C)C ZINC001325897321 1329721217 /nfs/dbraw/zinc/72/12/17/1329721217.db2.gz GARLRKBJJBZBLT-KURKYZTESA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@@H]2[C@H]1CC[N@H+]2CCCCCF)N(C)C ZINC001325897321 1329721218 /nfs/dbraw/zinc/72/12/18/1329721218.db2.gz GARLRKBJJBZBLT-KURKYZTESA-N 1 3 341.515 2.778 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001381583016 1348378557 /nfs/dbraw/zinc/37/85/57/1348378557.db2.gz NMQYOJGOKDJTPO-AEFFLSMTSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001381583016 1348378561 /nfs/dbraw/zinc/37/85/61/1348378561.db2.gz NMQYOJGOKDJTPO-AEFFLSMTSA-N 1 3 331.504 2.582 10 0 EFAEHO CC[C@H](C)C[NH2+]CC[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001326363968 1329750303 /nfs/dbraw/zinc/75/03/03/1329750303.db2.gz IXDBXKSRKDYEAT-DLBZAZTESA-N 1 3 325.541 2.839 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](CC[NH2+]Cc2ccc(F)cc2C)C1)N(C)C ZINC001326362193 1329750348 /nfs/dbraw/zinc/75/03/48/1329750348.db2.gz AWLQYPNRBUFBGL-LPHOPBHVSA-N 1 3 349.494 2.803 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](CC[NH2+]Cc2ccccc2Cl)C1 ZINC001326430224 1329755942 /nfs/dbraw/zinc/75/59/42/1329755942.db2.gz JAQZTNIDROFCMW-MRXNPFEDSA-N 1 3 349.906 2.764 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1C[C@@H]([NH2+]C/C=C/Cl)C(C)(C)C1 ZINC001382368674 1348919549 /nfs/dbraw/zinc/91/95/49/1348919549.db2.gz LOIORKWJVHJBAB-JDFMTEHDSA-N 1 3 341.927 2.828 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@H]1CC[C@H](NC(=O)CN2CC[C@H](C)C2)CC1 ZINC001326542776 1330314438 /nfs/dbraw/zinc/31/44/38/1330314438.db2.gz ZNVXSQNJFNQISJ-PXYFQHJDSA-N 1 3 335.536 2.949 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[C@H](C[NH2+]CC[C@@H](C)F)CC1)N(C)C ZINC001326555057 1330316542 /nfs/dbraw/zinc/31/65/42/1330316542.db2.gz KKORIIARWMHPJS-VQHPVUNQSA-N 1 3 329.504 2.585 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@@H]1C[NH2+]CCc1ccc(C)cc1)N(C)C ZINC001326735988 1330355963 /nfs/dbraw/zinc/35/59/63/1330355963.db2.gz BVHVKOLANOVGJN-UXHICEINSA-N 1 3 345.531 2.848 10 0 EFAEHO Cc1ccncc1CN1CC[C@H](NC(=O)CCCC[NH+](C)C)C[C@@H]1C ZINC001328282268 1330581164 /nfs/dbraw/zinc/58/11/64/1330581164.db2.gz GJYDHYIBAMLIMN-HKUYNNGSSA-N 1 3 346.519 2.591 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCCC2(CN(C(=O)[C@@H](C(C)C)N(C)C)C2)C1 ZINC001330512228 1330763571 /nfs/dbraw/zinc/76/35/71/1330763571.db2.gz NWEPVWHNGZFEEV-JTHGQSKGSA-N 1 3 335.536 2.853 10 0 EFAEHO CC/C=C\CC[N@H+]1CCCC2(CN(C(=O)[C@@H](C(C)C)N(C)C)C2)C1 ZINC001330512228 1330763574 /nfs/dbraw/zinc/76/35/74/1330763574.db2.gz NWEPVWHNGZFEEV-JTHGQSKGSA-N 1 3 335.536 2.853 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCCC2(CN(C(=O)[C@H](C(C)C)N(C)C)C2)C1 ZINC001330512230 1330764042 /nfs/dbraw/zinc/76/40/42/1330764042.db2.gz NWEPVWHNGZFEEV-ZEVQVBBLSA-N 1 3 335.536 2.853 10 0 EFAEHO CC/C=C\CC[N@H+]1CCCC2(CN(C(=O)[C@H](C(C)C)N(C)C)C2)C1 ZINC001330512230 1330764045 /nfs/dbraw/zinc/76/40/45/1330764045.db2.gz NWEPVWHNGZFEEV-ZEVQVBBLSA-N 1 3 335.536 2.853 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2C[C@H](C[NH2+]C/C=C/Cl)C2)c1 ZINC001330708489 1330765425 /nfs/dbraw/zinc/76/54/25/1330765425.db2.gz NLGPZBPXQZRJQZ-URJBQBQPSA-N 1 3 335.879 2.599 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)[C@H](C[NH2+]CCC(F)(F)F)C1CC1 ZINC001331289937 1330816914 /nfs/dbraw/zinc/81/69/14/1330816914.db2.gz OJFOFZMYSXUBIK-HUUCEWRRSA-N 1 3 349.441 2.640 10 0 EFAEHO C[C@H]1[C@H]([NH2+]CCCc2ccsc2)CCN1C(=O)CN(C)C1CCC1 ZINC001331896063 1330886858 /nfs/dbraw/zinc/88/68/58/1330886858.db2.gz KFESCOCGEFUBBF-MAUKXSAKSA-N 1 3 349.544 2.744 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CCCC[NH+](C)C)CCCN1Cc1ccccc1 ZINC001332215833 1330942411 /nfs/dbraw/zinc/94/24/11/1330942411.db2.gz BIXOFKIDIYZLPV-MJGOQNOKSA-N 1 3 331.504 2.888 10 0 EFAEHO C[C@H]1[C@@H](NC(=O)CCCC[NH+](C)C)CCCN1Cc1ccccc1 ZINC001332215829 1330942433 /nfs/dbraw/zinc/94/24/33/1330942433.db2.gz BIXOFKIDIYZLPV-HKUYNNGSSA-N 1 3 331.504 2.888 10 0 EFAEHO CCC/C=C/CC[NH2+][C@@H]1CN(C(=O)CN2CC[C@@H](C)C2)CC1(C)C ZINC001332422095 1330970003 /nfs/dbraw/zinc/97/00/03/1330970003.db2.gz GHLCLJWJEKPNQU-HNGSOEQISA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)N(CCN(C)CC1=CCCCC1)C(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001332708293 1331006810 /nfs/dbraw/zinc/00/68/10/1331006810.db2.gz XJKVABZXTKIBCY-FQEVSTJZSA-N 1 3 347.547 2.997 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+]CCc2ccccc2)C(C)(C)C)CCC1 ZINC001332807435 1331028863 /nfs/dbraw/zinc/02/88/63/1331028863.db2.gz PHBHOWXLEPGFIR-GOSISDBHSA-N 1 3 345.531 2.834 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NCCSc2ccncc2)[C@@H](C)C1 ZINC001335813722 1331405627 /nfs/dbraw/zinc/40/56/27/1331405627.db2.gz KEOGIEMAPBWMHA-WMZOPIPTSA-N 1 3 337.533 2.900 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NCCSc2ccncc2)[C@@H](C)C1 ZINC001335813722 1331405630 /nfs/dbraw/zinc/40/56/30/1331405630.db2.gz KEOGIEMAPBWMHA-WMZOPIPTSA-N 1 3 337.533 2.900 10 0 EFAEHO c1[nH]nc2c1cccc2CN[C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC001352789575 1333730082 /nfs/dbraw/zinc/73/00/82/1333730082.db2.gz KPXPCMLDYDXYDK-PXNSSMCTSA-N 1 3 334.423 2.908 10 0 EFAEHO Cc1nc2sc3c(c2c(NCC[N@@H+](C)CCCN(C)C)n1)CCC3 ZINC001472828911 1334494425 /nfs/dbraw/zinc/49/44/25/1334494425.db2.gz RWKNEVFRRJWKCF-UHFFFAOYSA-N 1 3 347.532 2.784 10 0 EFAEHO Cc1nc2sc3c(c2c(NCC[N@H+](C)CCCN(C)C)n1)CCC3 ZINC001472828911 1334494426 /nfs/dbraw/zinc/49/44/26/1334494426.db2.gz RWKNEVFRRJWKCF-UHFFFAOYSA-N 1 3 347.532 2.784 10 0 EFAEHO CCN1CCC[C@H]1CNC(=[NH2+])NCc1ccc2[nH]c(C)c(C)c2c1 ZINC000849067241 1335067585 /nfs/dbraw/zinc/06/75/85/1335067585.db2.gz QDCPYEDMLYMTTJ-INIZCTEOSA-N 1 3 327.476 2.883 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N(C)CCC1CCCCC1 ZINC001413895335 1335348845 /nfs/dbraw/zinc/34/88/45/1335348845.db2.gz VLPKZDBUUNFSHF-KRWDZBQOSA-N 1 3 340.556 2.870 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N(C)CCC1CCCCC1 ZINC001413895335 1335348847 /nfs/dbraw/zinc/34/88/47/1335348847.db2.gz VLPKZDBUUNFSHF-KRWDZBQOSA-N 1 3 340.556 2.870 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=S)Nc1cccc(Cl)c1 ZINC000849274984 1335585626 /nfs/dbraw/zinc/58/56/26/1335585626.db2.gz FYOAYBDTTSDYDA-ZDUSSCGKSA-N 1 3 342.940 2.898 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=S)Nc1cccc(Cl)c1 ZINC000849274984 1335585628 /nfs/dbraw/zinc/58/56/28/1335585628.db2.gz FYOAYBDTTSDYDA-ZDUSSCGKSA-N 1 3 342.940 2.898 10 0 EFAEHO CC(C)[C@H]1CN(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)[C@H]1C(C)C ZINC001413893842 1335951930 /nfs/dbraw/zinc/95/19/30/1335951930.db2.gz OXDXGUOUQKRKKA-KSZLIROESA-N 1 3 340.556 2.580 10 0 EFAEHO CC(C)[C@H]1CN(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)[C@H]1C(C)C ZINC001413893842 1335951932 /nfs/dbraw/zinc/95/19/32/1335951932.db2.gz OXDXGUOUQKRKKA-KSZLIROESA-N 1 3 340.556 2.580 10 0 EFAEHO CC(C)[C@@H]1CN(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)[C@@H]1C(C)C ZINC001413893844 1335952202 /nfs/dbraw/zinc/95/22/02/1335952202.db2.gz OXDXGUOUQKRKKA-OKZBNKHCSA-N 1 3 340.556 2.580 10 0 EFAEHO CC(C)[C@@H]1CN(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)[C@@H]1C(C)C ZINC001413893844 1335952210 /nfs/dbraw/zinc/95/22/10/1335952210.db2.gz OXDXGUOUQKRKKA-OKZBNKHCSA-N 1 3 340.556 2.580 10 0 EFAEHO COc1ccc(CN(C)C)cc1NC(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001361610800 1336219702 /nfs/dbraw/zinc/21/97/02/1336219702.db2.gz LBPWAUJHFWXYHI-JKSUJKDBSA-N 1 3 333.476 2.816 10 0 EFAEHO COc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC001361610921 1336220208 /nfs/dbraw/zinc/22/02/08/1336220208.db2.gz NBUSMLVCQOZXTJ-MRXNPFEDSA-N 1 3 333.476 2.816 10 0 EFAEHO COc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CCC[N@H+](C(C)C)C1 ZINC001361610921 1336220210 /nfs/dbraw/zinc/22/02/10/1336220210.db2.gz NBUSMLVCQOZXTJ-MRXNPFEDSA-N 1 3 333.476 2.816 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)N(C)C)cc1 ZINC001361728649 1336299932 /nfs/dbraw/zinc/29/99/32/1336299932.db2.gz ZVBPNIUMOKBXMS-ZCNNSNEGSA-N 1 3 343.515 2.985 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)N(C)C)cc1 ZINC001361728649 1336299937 /nfs/dbraw/zinc/29/99/37/1336299937.db2.gz ZVBPNIUMOKBXMS-ZCNNSNEGSA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC)N1CCc2ccccc2C1 ZINC001361812864 1336352071 /nfs/dbraw/zinc/35/20/71/1336352071.db2.gz JDHGAOAJNNSKPT-HSALFYBXSA-N 1 3 343.515 2.670 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC)N1CCc2ccccc2C1 ZINC001361812864 1336352076 /nfs/dbraw/zinc/35/20/76/1336352076.db2.gz JDHGAOAJNNSKPT-HSALFYBXSA-N 1 3 343.515 2.670 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2CC[C@H]3C[C@H](C)C[N@H+]3C2)N(C)C)cc1 ZINC001361975586 1336447509 /nfs/dbraw/zinc/44/75/09/1336447509.db2.gz BJEQJTSELBUTBR-RNQOJCNYSA-N 1 3 343.515 2.834 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2CC[C@H]3C[C@H](C)C[N@@H+]3C2)N(C)C)cc1 ZINC001361975586 1336447512 /nfs/dbraw/zinc/44/75/12/1336447512.db2.gz BJEQJTSELBUTBR-RNQOJCNYSA-N 1 3 343.515 2.834 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2CCC[C@@H]([NH+](C)C)C2)N(C)C)cc1 ZINC001361978112 1336448758 /nfs/dbraw/zinc/44/87/58/1336448758.db2.gz MSXGEQVJSCXNBB-QRVBRYPASA-N 1 3 331.504 2.834 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2CCC[C@H]([NH+](C)C)C2)N(C)C)cc1 ZINC001361978115 1336448951 /nfs/dbraw/zinc/44/89/51/1336448951.db2.gz MSXGEQVJSCXNBB-QYZOEREBSA-N 1 3 331.504 2.834 10 0 EFAEHO CN(C)CCN(Cc1cccs1)C(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001362056188 1336483539 /nfs/dbraw/zinc/48/35/39/1336483539.db2.gz CAZSASUYQWVSTQ-HOTGVXAUSA-N 1 3 337.533 2.759 10 0 EFAEHO CN(C)CCN(Cc1ccccc1F)C(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001362077882 1336492454 /nfs/dbraw/zinc/49/24/54/1336492454.db2.gz MBQSSAMZIVRMPR-AEFFLSMTSA-N 1 3 349.494 2.836 10 0 EFAEHO CN(C)CCN(Cc1ccccc1F)C(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001362077915 1336492969 /nfs/dbraw/zinc/49/29/69/1336492969.db2.gz MBQSSAMZIVRMPR-WMZOPIPTSA-N 1 3 349.494 2.836 10 0 EFAEHO CN1CCC(N(Cc2ccco2)C(=O)[C@@H]2CCC[C@@H]([NH+](C)C)C2)CC1 ZINC001362119744 1336511783 /nfs/dbraw/zinc/51/17/83/1336511783.db2.gz SKALGHIKGVWXDF-SJLPKXTDSA-N 1 3 347.503 2.823 10 0 EFAEHO CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](C)CC[NH+](C)C ZINC001362541346 1336649928 /nfs/dbraw/zinc/64/99/28/1336649928.db2.gz LNDXZBQRAHZWSN-PKOBYXMFSA-N 1 3 333.520 2.847 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)CC[C@H]1CCc2ccccc21 ZINC001362657299 1336693646 /nfs/dbraw/zinc/69/36/46/1336693646.db2.gz OCYGEYQROJNRLO-PKOBYXMFSA-N 1 3 345.531 2.885 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)CC[C@H]1CCc2ccccc21 ZINC001362657299 1336693648 /nfs/dbraw/zinc/69/36/48/1336693648.db2.gz OCYGEYQROJNRLO-PKOBYXMFSA-N 1 3 345.531 2.885 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)[C@@H]1CC[C@@H]2C[C@@H](C)C[N@@H+]2C1 ZINC001363192299 1336824674 /nfs/dbraw/zinc/82/46/74/1336824674.db2.gz RIXGDQIRDXNVGI-GUDVDZBRSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(CCN1CCCCC1)C(=O)[C@@H]1CC[C@@H]2C[C@@H](C)C[N@H+]2C1 ZINC001363192299 1336824675 /nfs/dbraw/zinc/82/46/75/1336824675.db2.gz RIXGDQIRDXNVGI-GUDVDZBRSA-N 1 3 335.536 2.831 10 0 EFAEHO CN(CC[N@H+](C)C1CCN(C)CC1)C[C@@H]1CC2(CO1)CCCCC2 ZINC001363215751 1336837514 /nfs/dbraw/zinc/83/75/14/1336837514.db2.gz KJMYPPKIJFJPRJ-IBGZPJMESA-N 1 3 337.552 2.684 10 0 EFAEHO CN(CC[N@@H+](C)C1CCN(C)CC1)C[C@@H]1CC2(CO1)CCCCC2 ZINC001363215751 1336837518 /nfs/dbraw/zinc/83/75/18/1336837518.db2.gz KJMYPPKIJFJPRJ-IBGZPJMESA-N 1 3 337.552 2.684 10 0 EFAEHO COc1cc(CN(C)C)ccc1NC(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001363217505 1336839072 /nfs/dbraw/zinc/83/90/72/1336839072.db2.gz LIGPXVQHSLFDIB-HZPDHXFCSA-N 1 3 333.476 2.816 10 0 EFAEHO CN1C[C@@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C(C)(C)C1 ZINC001363625066 1336959579 /nfs/dbraw/zinc/95/95/79/1336959579.db2.gz ZFFUHXVDYRMISU-GOSISDBHSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@H](CN1CCOCC1)CN1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001364344452 1337184497 /nfs/dbraw/zinc/18/44/97/1337184497.db2.gz JJVDBODKTCLTNA-HSALFYBXSA-N 1 3 337.552 2.541 10 0 EFAEHO C[C@H](CN1CCOCC1)CN1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC001364344452 1337184500 /nfs/dbraw/zinc/18/45/00/1337184500.db2.gz JJVDBODKTCLTNA-HSALFYBXSA-N 1 3 337.552 2.541 10 0 EFAEHO C[C@H](CN1CCOCC1)CN1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC001364344447 1337184789 /nfs/dbraw/zinc/18/47/89/1337184789.db2.gz JJVDBODKTCLTNA-AQNXPRMDSA-N 1 3 337.552 2.541 10 0 EFAEHO C[C@H](CN1CCOCC1)CN1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC001364344447 1337184790 /nfs/dbraw/zinc/18/47/90/1337184790.db2.gz JJVDBODKTCLTNA-AQNXPRMDSA-N 1 3 337.552 2.541 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1C[C@H]([NH2+]CC2CCC(C)CC2)C1)N(C)C ZINC001365824031 1337253769 /nfs/dbraw/zinc/25/37/69/1337253769.db2.gz BHJAUBKUDARTLZ-DUBPFDJUSA-N 1 3 337.552 2.883 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CCCN(CC2CC(F)(F)C2)C1)[NH+](CC)CC ZINC001365942202 1337273750 /nfs/dbraw/zinc/27/37/50/1337273750.db2.gz KQPMQHDDYCPBNX-CVEARBPZSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC12CC[NH+](CCCC1CCC1)CC2)N(C)C ZINC001366010668 1337320323 /nfs/dbraw/zinc/32/03/23/1337320323.db2.gz XMWJHPFNDROWGF-MSOLQXFVSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](CNC(=O)CN(C)C2CCC2)C2CC2)c1 ZINC001366037081 1337338483 /nfs/dbraw/zinc/33/84/83/1337338483.db2.gz PHXZULMFCRDCDK-IBGZPJMESA-N 1 3 347.478 2.603 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001366055075 1337350463 /nfs/dbraw/zinc/35/04/63/1337350463.db2.gz BOKOAKSBSVEIRE-IBGZPJMESA-N 1 3 331.504 2.628 10 0 EFAEHO CCC(CC)C[N@H+](C)C[C@@H]1CCCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001366076609 1337368939 /nfs/dbraw/zinc/36/89/39/1337368939.db2.gz UJNKHEGXNNXQNB-MJGOQNOKSA-N 1 3 337.552 2.935 10 0 EFAEHO CCC(CC)C[N@@H+](C)C[C@@H]1CCCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001366076609 1337368942 /nfs/dbraw/zinc/36/89/42/1337368942.db2.gz UJNKHEGXNNXQNB-MJGOQNOKSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@H](F)CC[N@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366077928 1337369646 /nfs/dbraw/zinc/36/96/46/1337369646.db2.gz XRJFSCHAUZBLJN-ROUUACIJSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)C[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001366077928 1337369649 /nfs/dbraw/zinc/36/96/49/1337369649.db2.gz XRJFSCHAUZBLJN-ROUUACIJSA-N 1 3 341.515 2.637 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+]C[C@H]3CCCC(F)(F)C3)C2)CCC1 ZINC001366147541 1337402705 /nfs/dbraw/zinc/40/27/05/1337402705.db2.gz FFERPQVFMHXCNS-SOUVJXGZSA-N 1 3 343.462 2.533 10 0 EFAEHO C[C@H]1CCC[C@H](CC[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)C1 ZINC001366151850 1337404006 /nfs/dbraw/zinc/40/40/06/1337404006.db2.gz WFLJVZVELMUTHR-XWTMOSNGSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2cccc(F)c2)C1)N(C)C ZINC001366156735 1337406458 /nfs/dbraw/zinc/40/64/58/1337406458.db2.gz QVIJNILZOYXSBS-NKGKWGDASA-N 1 3 335.467 2.710 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C(C)C)nc2C)C1)N(C)C ZINC001366164675 1337409588 /nfs/dbraw/zinc/40/95/88/1337409588.db2.gz YITFJTXCBPGOQO-ZIFCJYIRSA-N 1 3 346.519 2.590 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2cc(F)ccc2F)C1)N(C)C ZINC001366169986 1337412985 /nfs/dbraw/zinc/41/29/85/1337412985.db2.gz MPCDDTUHHUGLQA-MBMVNNNZSA-N 1 3 339.430 2.603 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC2CCC(F)(F)CC2)C1)N(C)C ZINC001366173604 1337414962 /nfs/dbraw/zinc/41/49/62/1337414962.db2.gz UFFGJELKKFZUDM-XHSDSOJGSA-N 1 3 345.478 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@H+](C/C=C/c2ccccc2)C1 ZINC001366188195 1337427523 /nfs/dbraw/zinc/42/75/23/1337427523.db2.gz UUSNWYYLLGIFRE-WUTDNEBXSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@@H+](C/C=C/c2ccccc2)C1 ZINC001366188195 1337427527 /nfs/dbraw/zinc/42/75/27/1337427527.db2.gz UUSNWYYLLGIFRE-WUTDNEBXSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@H+](CC2CC3(CCC3)C2)C1 ZINC001366189358 1337429165 /nfs/dbraw/zinc/42/91/65/1337429165.db2.gz YEJGYILTCOWHFK-KRWDZBQOSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@@H+](CC2CC3(CCC3)C2)C1 ZINC001366189358 1337429166 /nfs/dbraw/zinc/42/91/66/1337429166.db2.gz YEJGYILTCOWHFK-KRWDZBQOSA-N 1 3 335.536 2.735 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC[C@H]1CCCN(Cc2ccsc2)C1 ZINC001366190586 1337429885 /nfs/dbraw/zinc/42/98/85/1337429885.db2.gz VLFWTXKDBVZNTK-MRXNPFEDSA-N 1 3 337.533 2.808 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC[C@H]1CCCN(Cc2ccsc2)C1 ZINC001366190586 1337429888 /nfs/dbraw/zinc/42/98/88/1337429888.db2.gz VLFWTXKDBVZNTK-MRXNPFEDSA-N 1 3 337.533 2.808 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](Cc2csc(C)c2)C1)N(C)C ZINC001366191374 1337430564 /nfs/dbraw/zinc/43/05/64/1337430564.db2.gz ZBRJRXSNBZNTIZ-DOTOQJQBSA-N 1 3 337.533 2.725 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](Cc2csc(C)c2)C1)N(C)C ZINC001366191374 1337430566 /nfs/dbraw/zinc/43/05/66/1337430566.db2.gz ZBRJRXSNBZNTIZ-DOTOQJQBSA-N 1 3 337.533 2.725 10 0 EFAEHO CC(C)CCC[N@@H+]1CCCC[C@H]1CNC(=O)[C@H](C(C)C)N(C)C ZINC001366208597 1337444420 /nfs/dbraw/zinc/44/44/20/1337444420.db2.gz HANLLGBMFJKHQP-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CCC[N@H+]1CCCC[C@H]1CNC(=O)[C@H](C(C)C)N(C)C ZINC001366208597 1337444422 /nfs/dbraw/zinc/44/44/22/1337444422.db2.gz HANLLGBMFJKHQP-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001366209060 1337445031 /nfs/dbraw/zinc/44/50/31/1337445031.db2.gz VURWZVVYYGXKJB-HZPDHXFCSA-N 1 3 329.504 2.541 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[NH2+][C@@H]2CCc3ccccc32)C1 ZINC001366208859 1337445061 /nfs/dbraw/zinc/44/50/61/1337445061.db2.gz RJURVXXPKCDGOV-FXAWDEMLSA-N 1 3 343.515 2.844 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001366209057 1337445235 /nfs/dbraw/zinc/44/52/35/1337445235.db2.gz VURWZVVYYGXKJB-CVEARBPZSA-N 1 3 329.504 2.541 10 0 EFAEHO C[C@@H](NC[C@H]1CCCCN1C(=O)CC[NH+](C)C)c1ccccc1F ZINC001366215097 1337450061 /nfs/dbraw/zinc/45/00/61/1337450061.db2.gz FVSRRDYTZVHSLP-HZPDHXFCSA-N 1 3 335.467 2.809 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[NH2+]Cc1cc(C)ccc1F ZINC001366218623 1337452793 /nfs/dbraw/zinc/45/27/93/1337452793.db2.gz IWPCYZRSANMDSD-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO CCc1ccc(CC[NH2+][C@@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001366313420 1337505459 /nfs/dbraw/zinc/50/54/59/1337505459.db2.gz UYJSVOHQMSACNX-KRWDZBQOSA-N 1 3 345.531 2.760 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001366314228 1337506056 /nfs/dbraw/zinc/50/60/56/1337506056.db2.gz YFTVFKSBPAVAJQ-INIZCTEOSA-N 1 3 331.504 2.718 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]Cc1ccc(C(C)(C)C)cc1)N(C)C ZINC001366357228 1337532427 /nfs/dbraw/zinc/53/24/27/1337532427.db2.gz XAGXESLUHYFPOU-MAUKXSAKSA-N 1 3 333.520 2.919 10 0 EFAEHO CC[C@@H]([NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)C1)c1ccc(F)cc1 ZINC001366388644 1337553635 /nfs/dbraw/zinc/55/36/35/1337553635.db2.gz KGQQSBYPMKMSKT-ZWKOTPCHSA-N 1 3 335.467 2.808 10 0 EFAEHO CC[C@H]([NH2+]C[C@H]1CCN(C(=O)CN2CCCC2)C1)c1ccc(F)cc1 ZINC001366411477 1337564280 /nfs/dbraw/zinc/56/42/80/1337564280.db2.gz PMXWCYOXNRGLHQ-APWZRJJASA-N 1 3 347.478 2.811 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@H+](C)CCc2ccccc2F)C1 ZINC001366439233 1337587873 /nfs/dbraw/zinc/58/78/73/1337587873.db2.gz XUUHCMOBZNBUIU-GOSISDBHSA-N 1 3 349.494 2.631 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([N@@H+](C)CCc2ccccc2F)C1 ZINC001366439233 1337587874 /nfs/dbraw/zinc/58/78/74/1337587874.db2.gz XUUHCMOBZNBUIU-GOSISDBHSA-N 1 3 349.494 2.631 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)C23CCC[NH+](CCC2)C3)cc1C ZINC001366537958 1337674101 /nfs/dbraw/zinc/67/41/01/1337674101.db2.gz DLPCKSBDIPXOHE-UHFFFAOYSA-N 1 3 343.515 2.727 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001366539314 1337675064 /nfs/dbraw/zinc/67/50/64/1337675064.db2.gz HGPWLYJAIXOGKZ-RTBURBONSA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001366539314 1337675065 /nfs/dbraw/zinc/67/50/65/1337675065.db2.gz HGPWLYJAIXOGKZ-RTBURBONSA-N 1 3 329.488 2.560 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21)Cc1ccccc1 ZINC001366633023 1337776304 /nfs/dbraw/zinc/77/63/04/1337776304.db2.gz GXWGHONFWZWODD-OALUTQOASA-N 1 3 329.488 2.642 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21)Cc1ccccc1 ZINC001366633023 1337776307 /nfs/dbraw/zinc/77/63/07/1337776307.db2.gz GXWGHONFWZWODD-OALUTQOASA-N 1 3 329.488 2.642 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+](CCCc2cccc(F)c2)C1 ZINC001366710548 1337905314 /nfs/dbraw/zinc/90/53/14/1337905314.db2.gz JQOAAOFTMUILMK-GOSISDBHSA-N 1 3 349.494 2.537 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+](CCCc2cccc(F)c2)C1 ZINC001366710548 1337905315 /nfs/dbraw/zinc/90/53/15/1337905315.db2.gz JQOAAOFTMUILMK-GOSISDBHSA-N 1 3 349.494 2.537 10 0 EFAEHO CCC[N@H+](CCNC(=O)C1(N(C)C)CCC1)[C@H]1CCc2ccccc21 ZINC001366716544 1337912920 /nfs/dbraw/zinc/91/29/20/1337912920.db2.gz KHOVUOBGHLRTCR-IBGZPJMESA-N 1 3 343.515 2.986 10 0 EFAEHO CCC[N@@H+](CCNC(=O)C1(N(C)C)CCC1)[C@H]1CCc2ccccc21 ZINC001366716544 1337912926 /nfs/dbraw/zinc/91/29/26/1337912926.db2.gz KHOVUOBGHLRTCR-IBGZPJMESA-N 1 3 343.515 2.986 10 0 EFAEHO CCC[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC1CCC1 ZINC001366721077 1337921279 /nfs/dbraw/zinc/92/12/79/1337921279.db2.gz LWOBGEMCCLSOLN-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO CCC[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC1CCC1 ZINC001366721077 1337921284 /nfs/dbraw/zinc/92/12/84/1337921284.db2.gz LWOBGEMCCLSOLN-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]CCN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001366767286 1337986999 /nfs/dbraw/zinc/98/69/99/1337986999.db2.gz JSQQLWSUAGWRKU-QGZVFWFLSA-N 1 3 331.504 2.897 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001366782553 1338000890 /nfs/dbraw/zinc/00/08/90/1338000890.db2.gz MAXHFHVLOPDNSW-SJORKVTESA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@@H]1CC[N@H+](CCC2CC2)C1 ZINC001366842060 1338103708 /nfs/dbraw/zinc/10/37/08/1338103708.db2.gz MSKABMSHJKZVIE-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@@H]1CC[N@@H+](CCC2CC2)C1 ZINC001366842060 1338103709 /nfs/dbraw/zinc/10/37/09/1338103709.db2.gz MSKABMSHJKZVIE-RTBURBONSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCC[N@H+](C)C[C@@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001366865932 1338134689 /nfs/dbraw/zinc/13/46/89/1338134689.db2.gz MMTVNSFUYODMLI-QFBILLFUSA-N 1 3 341.515 2.779 10 0 EFAEHO CCCC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001366865932 1338134695 /nfs/dbraw/zinc/13/46/95/1338134695.db2.gz MMTVNSFUYODMLI-QFBILLFUSA-N 1 3 341.515 2.779 10 0 EFAEHO CN(CCF)C[C@@H]1CCN(C(=O)[C@H]2CCCC[N@@H+]2C2CCCC2)C1 ZINC001366865383 1338134923 /nfs/dbraw/zinc/13/49/23/1338134923.db2.gz KKBIVJOWXLKSDY-FUHWJXTLSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)C[C@@H]1CCN(C(=O)[C@H]2CCCC[N@H+]2C2CCCC2)C1 ZINC001366865383 1338134926 /nfs/dbraw/zinc/13/49/26/1338134926.db2.gz KKBIVJOWXLKSDY-FUHWJXTLSA-N 1 3 339.499 2.533 10 0 EFAEHO Cc1ccc(C[N@@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001366868467 1338139187 /nfs/dbraw/zinc/13/91/87/1338139187.db2.gz IADUKZZNZSZJCH-GOSISDBHSA-N 1 3 349.494 2.755 10 0 EFAEHO Cc1ccc(C[N@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001366868467 1338139190 /nfs/dbraw/zinc/13/91/90/1338139190.db2.gz IADUKZZNZSZJCH-GOSISDBHSA-N 1 3 349.494 2.755 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH+]2CC(CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001366988768 1338246242 /nfs/dbraw/zinc/24/62/42/1338246242.db2.gz VKRTYLKQFPAAEZ-WMZOPIPTSA-N 1 3 343.515 2.754 10 0 EFAEHO CC[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001367095801 1338381839 /nfs/dbraw/zinc/38/18/39/1338381839.db2.gz GHBKGYSQWLKQCP-AEFFLSMTSA-N 1 3 329.488 2.643 10 0 EFAEHO CC[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]CC1CC(F)(F)C1 ZINC001367125412 1338413537 /nfs/dbraw/zinc/41/35/37/1338413537.db2.gz DVXJQDRGLGLJAE-GOEBONIOSA-N 1 3 345.478 2.781 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H](C)N1CCCCCC1)[NH2+]CC1CC(F)(F)C1 ZINC001367125418 1338413741 /nfs/dbraw/zinc/41/37/41/1338413741.db2.gz DVXJQDRGLGLJAE-ZBFHGGJFSA-N 1 3 345.478 2.781 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cccc(Cl)c1 ZINC001367131271 1338421166 /nfs/dbraw/zinc/42/11/66/1338421166.db2.gz ZCNVRBXHOXADMK-PBHICJAKSA-N 1 3 337.895 2.666 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](CC)CNC(=O)CN2CC[C@H](C)C2)c1 ZINC001367131132 1338421195 /nfs/dbraw/zinc/42/11/95/1338421195.db2.gz XTSOBTQYZPSAQY-LPHOPBHVSA-N 1 3 331.504 2.575 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1cccc(Cl)c1 ZINC001367150137 1338445409 /nfs/dbraw/zinc/44/54/09/1338445409.db2.gz OZQWXKQSDNSIMY-MRXNPFEDSA-N 1 3 325.884 2.665 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001367227194 1338535410 /nfs/dbraw/zinc/53/54/10/1338535410.db2.gz HEYNJJCZINCXQB-SJLPKXTDSA-N 1 3 347.503 2.677 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001367268003 1338567566 /nfs/dbraw/zinc/56/75/66/1338567566.db2.gz QYYQDAMJLBCETA-KRWDZBQOSA-N 1 3 331.504 2.711 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]C/C=C\Cl)CCCC1 ZINC001367327746 1338626919 /nfs/dbraw/zinc/62/69/19/1338626919.db2.gz BUOKRYKXTBDXRT-VXQJABLNSA-N 1 3 327.900 2.630 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+]C[C@@H](C)N(C)C(=O)[C@@H]1CCCN1C ZINC001367353232 1338650342 /nfs/dbraw/zinc/65/03/42/1338650342.db2.gz GQVBQGRIVNUTFP-PBHICJAKSA-N 1 3 337.895 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H](C)[NH2+]CC2CC(C)(C)C2)C1 ZINC001367438429 1338740657 /nfs/dbraw/zinc/74/06/57/1338740657.db2.gz DHNPZWZDMJSQFT-SJLPKXTDSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H](C)[NH2+]Cc2ccccc2F)C1 ZINC001367450149 1338753051 /nfs/dbraw/zinc/75/30/51/1338753051.db2.gz NNLCMXPNNWHCTA-SJLPKXTDSA-N 1 3 349.494 2.883 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)cc1 ZINC001367494401 1338793904 /nfs/dbraw/zinc/79/39/04/1338793904.db2.gz YTILIOGPERJXKA-PXNSSMCTSA-N 1 3 345.531 2.821 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001367520749 1338820725 /nfs/dbraw/zinc/82/07/25/1338820725.db2.gz FENQDKQFAGDSFE-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001367520749 1338820729 /nfs/dbraw/zinc/82/07/29/1338820729.db2.gz FENQDKQFAGDSFE-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[N@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001367524647 1338825483 /nfs/dbraw/zinc/82/54/83/1338825483.db2.gz RCFHIPBBZJCOEJ-LSDHHAIUSA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@H](C(=O)N(C)CC[N@@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001367524647 1338825488 /nfs/dbraw/zinc/82/54/88/1338825488.db2.gz RCFHIPBBZJCOEJ-LSDHHAIUSA-N 1 3 333.467 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2CCCC2CCC2)C1 ZINC001367555134 1338866551 /nfs/dbraw/zinc/86/65/51/1338866551.db2.gz LJLPSISAPMNXCT-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2CCCC2CCC2)C1 ZINC001367555134 1338866554 /nfs/dbraw/zinc/86/65/54/1338866554.db2.gz LJLPSISAPMNXCT-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCCc2ccc(F)cc21)C(=O)CN(C)C(C)C ZINC001367657998 1338909665 /nfs/dbraw/zinc/90/96/65/1338909665.db2.gz PFMFXDNEVXEGAD-IBGZPJMESA-N 1 3 349.494 2.981 10 0 EFAEHO CCN(CCN[C@@H](C)c1ccccc1Cl)C(=O)C12CC[NH+](CC1)C2 ZINC001367688970 1338929928 /nfs/dbraw/zinc/92/99/28/1338929928.db2.gz MWGPRGJBDCUCOT-HNNXBMFYSA-N 1 3 349.906 2.935 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1cc(C)ccc1C ZINC001367731810 1338963882 /nfs/dbraw/zinc/96/38/82/1338963882.db2.gz AJLALCCMZYQJER-MJGOQNOKSA-N 1 3 331.504 2.772 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+][C@@H](C)c1ccc2c(c1)CCC2)N(C)C ZINC001367742682 1338972215 /nfs/dbraw/zinc/97/22/15/1338972215.db2.gz ZGFLLYYWKFIARN-YZVOILCLSA-N 1 3 331.504 2.671 10 0 EFAEHO CCCc1ccc(C[NH2+]C[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001367758665 1338985850 /nfs/dbraw/zinc/98/58/50/1338985850.db2.gz APWURHNEJLZJSF-IRXDYDNUSA-N 1 3 331.504 2.575 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(F)c1 ZINC001367816216 1339033712 /nfs/dbraw/zinc/03/37/12/1339033712.db2.gz SUSXZBWKRBCYJW-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(F)c1 ZINC001367816216 1339033714 /nfs/dbraw/zinc/03/37/14/1339033714.db2.gz SUSXZBWKRBCYJW-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CCc1ccccc1CC[N@H+](C)C[C@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001367836049 1339052382 /nfs/dbraw/zinc/05/23/82/1339052382.db2.gz OMPZBTRLOVFCBG-ROUUACIJSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[N@@H+](C)C[C@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001367836049 1339052385 /nfs/dbraw/zinc/05/23/85/1339052385.db2.gz OMPZBTRLOVFCBG-ROUUACIJSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001367858921 1339073845 /nfs/dbraw/zinc/07/38/45/1339073845.db2.gz FXHMICIWCDMGEF-GJZGRUSLSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001367858921 1339073847 /nfs/dbraw/zinc/07/38/47/1339073847.db2.gz FXHMICIWCDMGEF-GJZGRUSLSA-N 1 3 333.467 2.589 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(C(F)F)c1)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001367854567 1339070074 /nfs/dbraw/zinc/07/00/74/1339070074.db2.gz JIHGGTFUTSIFFF-XJKSGUPXSA-N 1 3 339.430 2.512 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(C(F)F)c1)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001367854567 1339070075 /nfs/dbraw/zinc/07/00/75/1339070075.db2.gz JIHGGTFUTSIFFF-XJKSGUPXSA-N 1 3 339.430 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+][C@H]1CCc2c1cccc2F)C1CC1 ZINC001367919608 1339107662 /nfs/dbraw/zinc/10/76/62/1339107662.db2.gz LMUSPVVHJJPSLN-RBUKOAKNSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]CCC(C)(C)C ZINC001367924481 1339111242 /nfs/dbraw/zinc/11/12/42/1339111242.db2.gz ABJVNGSQQOKAPV-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCN1CC1CC2(CCC2)C1 ZINC001367943636 1339120286 /nfs/dbraw/zinc/12/02/86/1339120286.db2.gz KHVGBIRZJNFZFZ-ZWKOTPCHSA-N 1 3 333.520 2.632 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@H]1CCN1CC1CC2(CCC2)C1 ZINC001367943636 1339120287 /nfs/dbraw/zinc/12/02/87/1339120287.db2.gz KHVGBIRZJNFZFZ-ZWKOTPCHSA-N 1 3 333.520 2.632 10 0 EFAEHO CC1CC(CN2CC[C@@H]2CNC(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001367960095 1339129244 /nfs/dbraw/zinc/12/92/44/1339129244.db2.gz MVNJKUWIQURSEO-LEOMRAHMSA-N 1 3 335.536 2.876 10 0 EFAEHO CC1CC(CN2CC[C@@H]2CNC(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001367960095 1339129246 /nfs/dbraw/zinc/12/92/46/1339129246.db2.gz MVNJKUWIQURSEO-LEOMRAHMSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCN1CC1CC2(CCC2)C1)[NH+]1CCCC1 ZINC001367980429 1339141927 /nfs/dbraw/zinc/14/19/27/1339141927.db2.gz STBXOMVYXBOYBT-OALUTQOASA-N 1 3 347.547 2.878 10 0 EFAEHO CN(CC(=O)NCC1([NH2+][C@H]2CCc3c2cccc3F)CC1)C1CCC1 ZINC001368003973 1339153428 /nfs/dbraw/zinc/15/34/28/1339153428.db2.gz SIKPRTNSIGZJCK-SFHVURJKSA-N 1 3 345.462 2.536 10 0 EFAEHO CC[N@H+](C)CCC(=O)NCC1(N[C@H]2CCc3c2cccc3Cl)CC1 ZINC001368031976 1339166654 /nfs/dbraw/zinc/16/66/54/1339166654.db2.gz RHRGRZMRRRNQLM-KRWDZBQOSA-N 1 3 349.906 2.908 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NCC1(N[C@H]2CCc3c2cccc3Cl)CC1 ZINC001368031976 1339166657 /nfs/dbraw/zinc/16/66/57/1339166657.db2.gz RHRGRZMRRRNQLM-KRWDZBQOSA-N 1 3 349.906 2.908 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccsc1)C2 ZINC001368059667 1339182188 /nfs/dbraw/zinc/18/21/88/1339182188.db2.gz AGXBAICKOVIGEV-IBGZPJMESA-N 1 3 349.544 2.904 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001368063820 1339183627 /nfs/dbraw/zinc/18/36/27/1339183627.db2.gz MRXNZVZWSPTNKV-FQEVSTJZSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001368063820 1339183630 /nfs/dbraw/zinc/18/36/30/1339183630.db2.gz MRXNZVZWSPTNKV-FQEVSTJZSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CCc2cccs2)C[C@@H]1C ZINC001368109496 1339197658 /nfs/dbraw/zinc/19/76/58/1339197658.db2.gz SCMNYNCDWZCUEQ-HOTGVXAUSA-N 1 3 337.533 2.600 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@]2(CC[N@H+](CC3CCC3)C2)C1 ZINC001368149709 1339220413 /nfs/dbraw/zinc/22/04/13/1339220413.db2.gz WSAUZDAKANOMCI-FQEVSTJZSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@]2(CC[N@@H+](CC3CCC3)C2)C1 ZINC001368149709 1339220414 /nfs/dbraw/zinc/22/04/14/1339220414.db2.gz WSAUZDAKANOMCI-FQEVSTJZSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCc1ccc(CN2CC[C@@](C)(NC(=O)CC[NH+](C)C)C2)cc1 ZINC001368155775 1339223988 /nfs/dbraw/zinc/22/39/88/1339223988.db2.gz AIAVVXRRAWCUEK-HXUWFJFHSA-N 1 3 331.504 2.671 10 0 EFAEHO CCC[NH+]1CCC(C)(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001368213257 1339259433 /nfs/dbraw/zinc/25/94/33/1339259433.db2.gz NYLNDCDERKJPTF-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(Cl)cc1)C2 ZINC001368325624 1339298261 /nfs/dbraw/zinc/29/82/61/1339298261.db2.gz IIWAQJDBQGYTMQ-SZMVWBNQSA-N 1 3 349.906 2.761 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccsc1)N(C)C ZINC001368342727 1339307560 /nfs/dbraw/zinc/30/75/60/1339307560.db2.gz ARSWTGNPOUFXGG-MHORFTMASA-N 1 3 349.544 2.948 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccsc1)N(C)C ZINC001368342727 1339307563 /nfs/dbraw/zinc/30/75/63/1339307563.db2.gz ARSWTGNPOUFXGG-MHORFTMASA-N 1 3 349.544 2.948 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H]1CN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001368351658 1339312058 /nfs/dbraw/zinc/31/20/58/1339312058.db2.gz MOFYGOKCYNCJEH-MOPGFXCFSA-N 1 3 345.531 2.828 10 0 EFAEHO CN(C[C@H]1CCN1CC[C@H]1CCCC1(F)F)C(=O)CCC[NH+](C)C ZINC001368399799 1339334194 /nfs/dbraw/zinc/33/41/94/1339334194.db2.gz KZFVJEVYENJRNM-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]CC[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001368418511 1339352342 /nfs/dbraw/zinc/35/23/42/1339352342.db2.gz LJAZRLOJIXYLFE-OALUTQOASA-N 1 3 343.515 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1C[NH2+]Cc1cccc(F)c1 ZINC001368452200 1339389120 /nfs/dbraw/zinc/38/91/20/1339389120.db2.gz SOMDULKBCHGZGI-GOSISDBHSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@H+](CCC(C)(C)C)CC1)N(C)C ZINC001368532916 1339470980 /nfs/dbraw/zinc/47/09/80/1339470980.db2.gz MEPYUYHMEPFZMC-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@@H+](CCC(C)(C)C)CC1)N(C)C ZINC001368532916 1339470983 /nfs/dbraw/zinc/47/09/83/1339470983.db2.gz MEPYUYHMEPFZMC-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]([NH2+]CC2CCC3(CC3)CC2)C1)N(C)C ZINC001368608248 1339547549 /nfs/dbraw/zinc/54/75/49/1339547549.db2.gz ORJFRGOCLWVSRD-KZNAEPCWSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(C)CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001368650848 1339566157 /nfs/dbraw/zinc/56/61/57/1339566157.db2.gz CWHWSQIMQLWPPB-OAHLLOKOSA-N 1 3 329.504 2.683 10 0 EFAEHO CN(CC(=O)N1CCC(C)([NH2+]CCc2ccccc2)CC1)C1CCC1 ZINC001368655969 1339569260 /nfs/dbraw/zinc/56/92/60/1339569260.db2.gz ZXIYQDIUNYEUJF-UHFFFAOYSA-N 1 3 343.515 2.684 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H]1CN(C(=O)CC[NH+](C)C)C[C@@H]1C ZINC001368661068 1339573480 /nfs/dbraw/zinc/57/34/80/1339573480.db2.gz ULPINHNUQHXTNM-YOEHRIQHSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c(C)s1 ZINC001368670643 1339583828 /nfs/dbraw/zinc/58/38/28/1339583828.db2.gz TYHNQYTXJOZMHP-GUYCJALGSA-N 1 3 337.533 2.642 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCCCC[C@H](NCc2ccccn2)C1 ZINC001368749084 1339673502 /nfs/dbraw/zinc/67/35/02/1339673502.db2.gz MLVATKXRQVXFNT-IBGZPJMESA-N 1 3 346.519 2.674 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCCCC[C@H](NCc2ccccn2)C1 ZINC001368749084 1339673504 /nfs/dbraw/zinc/67/35/04/1339673504.db2.gz MLVATKXRQVXFNT-IBGZPJMESA-N 1 3 346.519 2.674 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCCCC[C@@H]([NH2+]C/C=C\Cl)C1)N(C)C ZINC001368752242 1339677088 /nfs/dbraw/zinc/67/70/88/1339677088.db2.gz BTBLDSOPHCDZDE-JBILIXEDSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]Cc1cccc(Cl)c1F ZINC001368752318 1339677327 /nfs/dbraw/zinc/67/73/27/1339677327.db2.gz BJZSOYJTVKDNSK-ZDUSSCGKSA-N 1 3 343.874 2.804 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001368756919 1339683153 /nfs/dbraw/zinc/68/31/53/1339683153.db2.gz XCCPWHRFOAFMRA-MAUKXSAKSA-N 1 3 335.467 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]C[C@H]1CCc2ccccc2C1 ZINC001368756730 1339683508 /nfs/dbraw/zinc/68/35/08/1339683508.db2.gz WBQBONDMDTXFJY-ROUUACIJSA-N 1 3 345.531 2.616 10 0 EFAEHO CC[N@H+](CC[C@@H](C)F)CC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001368780528 1339707214 /nfs/dbraw/zinc/70/72/14/1339707214.db2.gz WHXZXVQYHNSIQA-AEFFLSMTSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[N@@H+](CC[C@@H](C)F)CC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001368780528 1339707218 /nfs/dbraw/zinc/70/72/18/1339707218.db2.gz WHXZXVQYHNSIQA-AEFFLSMTSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCN(C/C=C\c2ccccc2)[C@@H]1C ZINC001368791974 1339720766 /nfs/dbraw/zinc/72/07/66/1339720766.db2.gz DKVILIPAZGMLQB-RWERQFNSSA-N 1 3 329.488 2.621 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCN(C/C=C\c2ccccc2)[C@@H]1C ZINC001368791974 1339720770 /nfs/dbraw/zinc/72/07/70/1339720770.db2.gz DKVILIPAZGMLQB-RWERQFNSSA-N 1 3 329.488 2.621 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCN(C/C=C\Cl)CC(C)(C)C1)[NH+](C)C ZINC001368828940 1339769692 /nfs/dbraw/zinc/76/96/92/1339769692.db2.gz VACRVDILJNFOSJ-RDIIQDETSA-N 1 3 343.943 2.932 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCN(C/C=C/Cl)CC(C)(C)C1)[NH+](C)C ZINC001368828930 1339769764 /nfs/dbraw/zinc/76/97/64/1339769764.db2.gz VACRVDILJNFOSJ-GFXFGIRVSA-N 1 3 343.943 2.932 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCN(Cc2ccccc2F)CC(C)(C)C1 ZINC001368830070 1339771321 /nfs/dbraw/zinc/77/13/21/1339771321.db2.gz YMKIWSLGWKXKEZ-QGZVFWFLSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001368840841 1339780541 /nfs/dbraw/zinc/78/05/41/1339780541.db2.gz LUJHEWZFPQOZME-ZIAGYGMSSA-N 1 3 337.895 2.807 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)[C@@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001368879106 1339814728 /nfs/dbraw/zinc/81/47/28/1339814728.db2.gz UEZQAXARDXWTCQ-HZPDHXFCSA-N 1 3 349.494 2.991 10 0 EFAEHO C[C@H](NCC=C(Cl)Cl)[C@H](C)NC(=O)CCC[NH+]1CCCC1 ZINC001368890425 1339828482 /nfs/dbraw/zinc/82/84/82/1339828482.db2.gz GJQJPUGMOUTABN-STQMWFEESA-N 1 3 336.307 2.664 10 0 EFAEHO CC[C@H](C(=O)N(C)CC(C)(C)C[NH2+]C[C@@H]1CCC(F)(F)C1)N(C)C ZINC001368910812 1339854490 /nfs/dbraw/zinc/85/44/90/1339854490.db2.gz ZSSPKMRBCGALHZ-HUUCEWRRSA-N 1 3 347.494 2.836 10 0 EFAEHO Cc1ccccc1C[N@H+]1C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001369112666 1339924413 /nfs/dbraw/zinc/92/44/13/1339924413.db2.gz GCWBCJIZZHKEOG-RTBURBONSA-N 1 3 345.531 2.908 10 0 EFAEHO Cc1ccccc1C[N@@H+]1C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001369112666 1339924416 /nfs/dbraw/zinc/92/44/16/1339924416.db2.gz GCWBCJIZZHKEOG-RTBURBONSA-N 1 3 345.531 2.908 10 0 EFAEHO Cc1ccc(CN2C[C@H](NC(=O)CCC[NH+](C)C)C(C)(C)C2)cc1 ZINC001369115445 1339928022 /nfs/dbraw/zinc/92/80/22/1339928022.db2.gz MCVATLIOZYTUGX-SFHVURJKSA-N 1 3 331.504 2.663 10 0 EFAEHO CN(CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3CCCC3)C[C@H]21)CC(C)(C)C ZINC001369147233 1339941785 /nfs/dbraw/zinc/94/17/85/1339941785.db2.gz XHJINGMSFDMLED-LDLYASANSA-N 1 3 349.563 2.839 10 0 EFAEHO CN(CC(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3CCCC3)C[C@H]21)CC(C)(C)C ZINC001369147233 1339941787 /nfs/dbraw/zinc/94/17/87/1339941787.db2.gz XHJINGMSFDMLED-LDLYASANSA-N 1 3 349.563 2.839 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H]1C[C@H](NC(=O)CN(C)C2CCC2)C1 ZINC001369170551 1339949575 /nfs/dbraw/zinc/94/95/75/1339949575.db2.gz SPTXOXWXAMWBFJ-IYARVYRRSA-N 1 3 343.515 2.772 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2ccccc2)C1)N(C)C ZINC001369179353 1339956083 /nfs/dbraw/zinc/95/60/83/1339956083.db2.gz ZHGUCPUTHBEZDC-PSBWJHGTSA-N 1 3 331.504 2.818 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001370563692 1340135481 /nfs/dbraw/zinc/13/54/81/1340135481.db2.gz LCJCKELALIHNSO-WGSAOQKQSA-N 1 3 329.488 2.641 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccccc2C2CC2)C1 ZINC001370716682 1340189142 /nfs/dbraw/zinc/18/91/42/1340189142.db2.gz ZQEULNWYACZPMH-HDICACEKSA-N 1 3 329.488 2.643 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)c(F)c2)C1 ZINC001370734528 1340193371 /nfs/dbraw/zinc/19/33/71/1340193371.db2.gz RVJCZNGVQZDZSW-YUELXQCFSA-N 1 3 339.430 2.603 10 0 EFAEHO Cc1cccc(CN2CCCC[C@H]2CNC(=O)C[C@@H]2CC[N@@H+](C)C2)c1 ZINC001370913203 1340280101 /nfs/dbraw/zinc/28/01/01/1340280101.db2.gz QTMSIOKLFSJXDT-PMACEKPBSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1cccc(CN2CCCC[C@H]2CNC(=O)C[C@@H]2CC[N@H+](C)C2)c1 ZINC001370913203 1340280104 /nfs/dbraw/zinc/28/01/04/1340280104.db2.gz QTMSIOKLFSJXDT-PMACEKPBSA-N 1 3 343.515 2.808 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001370972866 1340317056 /nfs/dbraw/zinc/31/70/56/1340317056.db2.gz VREKODATHKJDMI-HKUYNNGSSA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001370972866 1340317059 /nfs/dbraw/zinc/31/70/59/1340317059.db2.gz VREKODATHKJDMI-HKUYNNGSSA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001370972869 1340317368 /nfs/dbraw/zinc/31/73/68/1340317368.db2.gz VREKODATHKJDMI-IEBWSBKVSA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001370972869 1340317371 /nfs/dbraw/zinc/31/73/71/1340317371.db2.gz VREKODATHKJDMI-IEBWSBKVSA-N 1 3 331.504 2.744 10 0 EFAEHO CC[C@@H](C(=O)NC1CCC([NH2+]Cc2ccc(C)nc2C)CC1)N(C)C ZINC001371068724 1340342249 /nfs/dbraw/zinc/34/22/49/1340342249.db2.gz CXMCSPZXNMLHLN-ACBHZAAOSA-N 1 3 346.519 2.556 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001371183271 1340399686 /nfs/dbraw/zinc/39/96/86/1340399686.db2.gz YHMMNZHYJLULPR-OXQOHEQNSA-N 1 3 343.515 2.642 10 0 EFAEHO C[C@@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC(C)(C)C ZINC001371364632 1340531286 /nfs/dbraw/zinc/53/12/86/1340531286.db2.gz OUNALXMAVKDNAT-KSSFIOAISA-N 1 3 329.504 2.729 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001371610735 1340674643 /nfs/dbraw/zinc/67/46/43/1340674643.db2.gz DDHKIRBUKZARQH-IBGZPJMESA-N 1 3 331.504 2.527 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001371621589 1340680248 /nfs/dbraw/zinc/68/02/48/1340680248.db2.gz RSJNMZZMDWTZHF-GOSISDBHSA-N 1 3 335.536 2.737 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1ccccc1C ZINC001371884839 1340739215 /nfs/dbraw/zinc/73/92/15/1340739215.db2.gz DYFVWUABPOVFNC-IEBWSBKVSA-N 1 3 331.504 2.854 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)C(C)(C)[NH+]2CCCC2)C2CC2)cc1 ZINC001372840908 1340832680 /nfs/dbraw/zinc/83/26/80/1340832680.db2.gz KVJQAIQWYRQRRW-UHFFFAOYSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccccc1CN(CCNC(=O)C(C)(C)[NH+]1CCCC1)C1CC1 ZINC001372842375 1340833250 /nfs/dbraw/zinc/83/32/50/1340833250.db2.gz OLSCZPNOHSPMMG-UHFFFAOYSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)C2CC2)cc1 ZINC001372863746 1340852062 /nfs/dbraw/zinc/85/20/62/1340852062.db2.gz RSDQOMNSYPSGPN-HKUYNNGSSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)C2CC2)cc1 ZINC001372863746 1340852065 /nfs/dbraw/zinc/85/20/65/1340852065.db2.gz RSDQOMNSYPSGPN-HKUYNNGSSA-N 1 3 343.515 2.806 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CC[C@H](CCNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001373190694 1340940624 /nfs/dbraw/zinc/94/06/24/1340940624.db2.gz LCAKATOIPNBMJV-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](F)CC[N@H+]1CC[C@H](CCNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001373190694 1340940625 /nfs/dbraw/zinc/94/06/25/1340940625.db2.gz LCAKATOIPNBMJV-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@H+](C)CC2CC(F)(F)C2)CC1 ZINC001373333583 1340994928 /nfs/dbraw/zinc/99/49/28/1340994928.db2.gz UOVBSJCTJAIHLY-UHFFFAOYSA-N 1 3 345.478 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@@H+](C)CC2CC(F)(F)C2)CC1 ZINC001373333583 1340994929 /nfs/dbraw/zinc/99/49/29/1340994929.db2.gz UOVBSJCTJAIHLY-UHFFFAOYSA-N 1 3 345.478 2.542 10 0 EFAEHO CC[C@H](C(=O)N1C[C@@H]2C[C@H]1CN2CCC1CCCC1)[NH+](CC)CC ZINC001373572822 1341057706 /nfs/dbraw/zinc/05/77/06/1341057706.db2.gz AHMVLLITZFUMJF-GBESFXJTSA-N 1 3 335.536 2.972 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1C[C@@H]2C[C@H]1CN2[C@H](C)c1cc(C)ccc1C ZINC001373579399 1341059496 /nfs/dbraw/zinc/05/94/96/1341059496.db2.gz VZQFBBJRZZUVBK-QYZOEREBSA-N 1 3 343.515 2.991 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1C[C@@H]2C[C@H]1CN2[C@H](C)c1cc(C)ccc1C ZINC001373579399 1341059498 /nfs/dbraw/zinc/05/94/98/1341059498.db2.gz VZQFBBJRZZUVBK-QYZOEREBSA-N 1 3 343.515 2.991 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N(C)[C@H]1CC[N@H+](Cc2ccccc2C)C1 ZINC001373674535 1341094054 /nfs/dbraw/zinc/09/40/54/1341094054.db2.gz VSHKOXQFRHAQCV-RBUKOAKNSA-N 1 3 349.494 2.708 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2C)C1 ZINC001373674535 1341094055 /nfs/dbraw/zinc/09/40/55/1341094055.db2.gz VSHKOXQFRHAQCV-RBUKOAKNSA-N 1 3 349.494 2.708 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001373678668 1341096069 /nfs/dbraw/zinc/09/60/69/1341096069.db2.gz FFACXTYZZUJEPU-ZWKOTPCHSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001373678668 1341096070 /nfs/dbraw/zinc/09/60/70/1341096070.db2.gz FFACXTYZZUJEPU-ZWKOTPCHSA-N 1 3 335.536 2.686 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](CC)[NH2+]Cc1ccc(C)c(F)c1 ZINC001373759171 1341137213 /nfs/dbraw/zinc/13/72/13/1341137213.db2.gz JNFQCFTYLGPPGI-PKOBYXMFSA-N 1 3 349.494 2.993 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1ccc(C)cc1 ZINC001373764145 1341138879 /nfs/dbraw/zinc/13/88/79/1341138879.db2.gz YZZOCJWEHNZWDH-RTBURBONSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCc1ccc(C)cc1 ZINC001373784428 1341145558 /nfs/dbraw/zinc/14/55/58/1341145558.db2.gz NHJVMTGRZJKQTL-LJQANCHMSA-N 1 3 345.531 2.896 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCc1ccc(C)cc1 ZINC001373784427 1341145596 /nfs/dbraw/zinc/14/55/96/1341145596.db2.gz NHJVMTGRZJKQTL-IBGZPJMESA-N 1 3 345.531 2.896 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001373834420 1341167507 /nfs/dbraw/zinc/16/75/07/1341167507.db2.gz IQOGUEXVAATMRY-WMZOPIPTSA-N 1 3 335.467 2.638 10 0 EFAEHO CN(CC(=O)NC1(C[NH2+]Cc2ccsc2)CCCC1)C1CCC1 ZINC001373850819 1341174079 /nfs/dbraw/zinc/17/40/79/1341174079.db2.gz YMPNONHKFUBKSJ-UHFFFAOYSA-N 1 3 335.517 2.751 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CCCC(C)(C)C ZINC001391530880 1355280433 /nfs/dbraw/zinc/28/04/33/1355280433.db2.gz FIYZQMMXKAMSDT-BZSNNMDCSA-N 1 3 335.536 2.972 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CCCC(C)(C)C ZINC001391530880 1355280438 /nfs/dbraw/zinc/28/04/38/1355280438.db2.gz FIYZQMMXKAMSDT-BZSNNMDCSA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+]Cc1cccc(Cl)c1 ZINC001374111379 1341420660 /nfs/dbraw/zinc/42/06/60/1341420660.db2.gz CTCDGUOBGBDLOK-CQSZACIVSA-N 1 3 325.884 2.522 10 0 EFAEHO Cc1ccccc1C[NH+]1CC2(C1)CCN(C(=O)CN(C)C(C)C)CC2 ZINC001374191071 1341536329 /nfs/dbraw/zinc/53/63/29/1341536329.db2.gz PMPWLJVPFLMHKK-UHFFFAOYSA-N 1 3 343.515 2.760 10 0 EFAEHO C[C@@H](CNCc1ccccn1)N(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001374246901 1341603439 /nfs/dbraw/zinc/60/34/39/1341603439.db2.gz IZJATMLQQOUKLE-INIZCTEOSA-N 1 3 346.519 2.671 10 0 EFAEHO C[C@@H](CNCc1ccccn1)N(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001374246901 1341603440 /nfs/dbraw/zinc/60/34/40/1341603440.db2.gz IZJATMLQQOUKLE-INIZCTEOSA-N 1 3 346.519 2.671 10 0 EFAEHO CC[C@H](F)CNC[C@H](C)N(C)C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001374259717 1341623101 /nfs/dbraw/zinc/62/31/01/1341623101.db2.gz KWWAKGOEYZTRPK-HOTGVXAUSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccccc1C1CC1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001374280186 1341651682 /nfs/dbraw/zinc/65/16/82/1341651682.db2.gz LPYNLHCGVAKCCH-IRXDYDNUSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001374284339 1341657298 /nfs/dbraw/zinc/65/72/98/1341657298.db2.gz USUNYZDEZHCIRC-HKUYNNGSSA-N 1 3 333.520 2.889 10 0 EFAEHO C[C@@H](C[NH2+][C@@H]1CCCc2ccccc21)N(C)C(=O)CN1CCCC1 ZINC001374326494 1341728838 /nfs/dbraw/zinc/72/88/38/1341728838.db2.gz MPBQMUZNFCAYMY-QFBILLFUSA-N 1 3 329.488 2.596 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CC2(CCC2)C1 ZINC001374434128 1341917554 /nfs/dbraw/zinc/91/75/54/1341917554.db2.gz PSGMZSJSDGHFKI-AEFFLSMTSA-N 1 3 335.536 2.639 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H](C)c1ccc(F)cc1 ZINC001374448147 1341930857 /nfs/dbraw/zinc/93/08/57/1341930857.db2.gz BPKIXSYMIWAGDQ-CRAIPNDOSA-N 1 3 337.483 2.957 10 0 EFAEHO CN(CC(=O)N(C)CC[N@H+](C)C[C@@H]1CCC(F)(F)C1)CC(C)(C)C ZINC001374536658 1342037795 /nfs/dbraw/zinc/03/77/95/1342037795.db2.gz MLHFQSGSJDTSII-OAHLLOKOSA-N 1 3 347.494 2.790 10 0 EFAEHO CN(CC(=O)N(C)CC[N@@H+](C)C[C@@H]1CCC(F)(F)C1)CC(C)(C)C ZINC001374536658 1342037798 /nfs/dbraw/zinc/03/77/98/1342037798.db2.gz MLHFQSGSJDTSII-OAHLLOKOSA-N 1 3 347.494 2.790 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001374551646 1342061010 /nfs/dbraw/zinc/06/10/10/1342061010.db2.gz ZNVUMZPLKXIRKI-HOTGVXAUSA-N 1 3 347.494 2.788 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CC[N@@H+](C)C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001374551646 1342061013 /nfs/dbraw/zinc/06/10/13/1342061013.db2.gz ZNVUMZPLKXIRKI-HOTGVXAUSA-N 1 3 347.494 2.788 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[N@H+](C)CC[C@@H]1CCCC1(F)F)N(C)C ZINC001374552569 1342061308 /nfs/dbraw/zinc/06/13/08/1342061308.db2.gz QEUHKXOZERGHSY-GJZGRUSLSA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[N@@H+](C)CC[C@@H]1CCCC1(F)F)N(C)C ZINC001374552569 1342061311 /nfs/dbraw/zinc/06/13/11/1342061311.db2.gz QEUHKXOZERGHSY-GJZGRUSLSA-N 1 3 333.467 2.542 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@@H](C)NC(=O)[C@@H]1CCCN1C(C)C ZINC001374755182 1342153736 /nfs/dbraw/zinc/15/37/36/1342153736.db2.gz MRSZTBNSAJWICZ-MJGOQNOKSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]C[C@@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001374770045 1342160963 /nfs/dbraw/zinc/16/09/63/1342160963.db2.gz GOLYBQICIJPXCT-IAGOWNOFSA-N 1 3 331.504 2.943 10 0 EFAEHO C[C@H](CNCc1cc2ccccc2o1)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001374802879 1342179628 /nfs/dbraw/zinc/17/96/28/1342179628.db2.gz GSWDNCPQXNRKNI-VYDXJSESSA-N 1 3 343.471 2.757 10 0 EFAEHO C[C@H](CNCc1cc2ccccc2o1)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001374802879 1342179630 /nfs/dbraw/zinc/17/96/30/1342179630.db2.gz GSWDNCPQXNRKNI-VYDXJSESSA-N 1 3 343.471 2.757 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(F)c1)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001375064292 1342368467 /nfs/dbraw/zinc/36/84/67/1342368467.db2.gz ZAFCQLVHXSXQOT-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(F)c1)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001375064292 1342368474 /nfs/dbraw/zinc/36/84/74/1342368474.db2.gz ZAFCQLVHXSXQOT-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001375228775 1342532034 /nfs/dbraw/zinc/53/20/34/1342532034.db2.gz LEGQQRPIRAEBOT-MOPGFXCFSA-N 1 3 329.488 2.545 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccsc1 ZINC001393468097 1356868067 /nfs/dbraw/zinc/86/80/67/1356868067.db2.gz UJJGCIYZUKVSTG-IRXDYDNUSA-N 1 3 335.517 2.655 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]Cc1ccccc1F ZINC001375280997 1342588260 /nfs/dbraw/zinc/58/82/60/1342588260.db2.gz GAHXOGSRDNJNAU-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC001375425824 1342729054 /nfs/dbraw/zinc/72/90/54/1342729054.db2.gz SSTKFJHQMAUVKE-HUUCEWRRSA-N 1 3 343.462 2.535 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NCC1(N[C@H](C)c2cccc(F)c2)CC1 ZINC001375426226 1342730091 /nfs/dbraw/zinc/73/00/91/1342730091.db2.gz YWRVUZNLJHBFNB-CRAIPNDOSA-N 1 3 347.478 3.000 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NCC1(N[C@H](C)c2cccc(F)c2)CC1 ZINC001375426226 1342730096 /nfs/dbraw/zinc/73/00/96/1342730096.db2.gz YWRVUZNLJHBFNB-CRAIPNDOSA-N 1 3 347.478 3.000 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+][C@H](C)c2cccc(F)c2)CC1 ZINC001375426226 1342730099 /nfs/dbraw/zinc/73/00/99/1342730099.db2.gz YWRVUZNLJHBFNB-CRAIPNDOSA-N 1 3 347.478 3.000 10 0 EFAEHO CC[C@H](C(=O)NCC1([NH2+][C@H](C)c2ccc3c(c2)CCC3)CC1)N(C)C ZINC001375436168 1342740049 /nfs/dbraw/zinc/74/00/49/1342740049.db2.gz LANMAJKNQIGMHA-DNVCBOLYSA-N 1 3 343.515 2.815 10 0 EFAEHO CCc1cccc(C[NH2+]C2(CNC(=O)C(C)(C)N3CCCC3)CC2)c1 ZINC001375450545 1342754857 /nfs/dbraw/zinc/75/48/57/1342754857.db2.gz CQTINCWAYUABPI-UHFFFAOYSA-N 1 3 343.515 2.862 10 0 EFAEHO CN(CC(=O)N1CCC[C@@]2(CC[N@H+](CCCF)C2)C1)CC(C)(C)C ZINC001393696690 1357087516 /nfs/dbraw/zinc/08/75/16/1357087516.db2.gz PPVZQXBAHMMXII-IBGZPJMESA-N 1 3 341.515 2.638 10 0 EFAEHO CN(CC(=O)N1CCC[C@@]2(CC[N@@H+](CCCF)C2)C1)CC(C)(C)C ZINC001393696690 1357087520 /nfs/dbraw/zinc/08/75/20/1357087520.db2.gz PPVZQXBAHMMXII-IBGZPJMESA-N 1 3 341.515 2.638 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@@H+]2CCCC2CCCC2)C1 ZINC001375464093 1342769828 /nfs/dbraw/zinc/76/98/28/1342769828.db2.gz GMZJDMREXQDMEZ-HKUYNNGSSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)C[C@@H]2CC[N@H+]2CCCC2CCCC2)C1 ZINC001375464093 1342769829 /nfs/dbraw/zinc/76/98/29/1342769829.db2.gz GMZJDMREXQDMEZ-HKUYNNGSSA-N 1 3 335.536 2.831 10 0 EFAEHO CN(CC(=O)NCC1([NH2+]C[C@@H]2CCC(F)(F)C2)CC1)CC(C)(C)C ZINC001375491363 1342797714 /nfs/dbraw/zinc/79/77/14/1342797714.db2.gz OPAITFVGWXWKTE-CQSZACIVSA-N 1 3 345.478 2.638 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@@H]([NH2+]Cc2cccc(C(C)C)n2)C1)N(C)C ZINC001375496919 1342803988 /nfs/dbraw/zinc/80/39/88/1342803988.db2.gz FXMJOJXJOWYGIV-HHXXYDBFSA-N 1 3 346.519 2.530 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@@H]3CCC[C@H]4CCC[N@@H+]43)CC2)cs1 ZINC001375504004 1342809580 /nfs/dbraw/zinc/80/95/80/1342809580.db2.gz FGLISCJBBYWFHV-IRXDYDNUSA-N 1 3 347.528 2.812 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@@H]3CCC[C@H]4CCC[N@H+]43)CC2)cs1 ZINC001375504004 1342809584 /nfs/dbraw/zinc/80/95/84/1342809584.db2.gz FGLISCJBBYWFHV-IRXDYDNUSA-N 1 3 347.528 2.812 10 0 EFAEHO CC(C)CC[NH2+][C@H]1C[C@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001375551107 1342864589 /nfs/dbraw/zinc/86/45/89/1342864589.db2.gz UDCVYLJLXNELGD-BXWFABGCSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+]CC2CCCC2)CC1)N1CCCCC1 ZINC001375552934 1342867218 /nfs/dbraw/zinc/86/72/18/1342867218.db2.gz AXKUZNOBEYPJAT-GOSISDBHSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(CF)cc2)C1)N(C)C ZINC001375575526 1342894281 /nfs/dbraw/zinc/89/42/81/1342894281.db2.gz FQCBRTPERDIYAO-IPMKNSEASA-N 1 3 349.494 2.871 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H]1CC[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001375581698 1342901043 /nfs/dbraw/zinc/90/10/43/1342901043.db2.gz YXRXVLWVQLZKPM-DFQSSKMNSA-N 1 3 345.531 2.956 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN1CCC(C)CC1 ZINC001375596327 1342914762 /nfs/dbraw/zinc/91/47/62/1342914762.db2.gz LIVDUVWWTJCXJF-SQNIBIBYSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CC[C@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001375688888 1342929859 /nfs/dbraw/zinc/92/98/59/1342929859.db2.gz FMTBHRZFSYJJSP-CVEARBPZSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CC[C@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001375688888 1342929860 /nfs/dbraw/zinc/92/98/60/1342929860.db2.gz FMTBHRZFSYJJSP-CVEARBPZSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@@H](F)CN1CC[C@@H](NC(=O)C2(C[NH+](C)C)CC2)CC(C)(C)C1 ZINC001375691741 1342933048 /nfs/dbraw/zinc/93/30/48/1342933048.db2.gz YCDPBYYCRADSJP-HZPDHXFCSA-N 1 3 341.515 2.683 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CC2CC3(CCC3)C2)C[C@H]1C ZINC001375741053 1342968152 /nfs/dbraw/zinc/96/81/52/1342968152.db2.gz OZDIQTUXOVZPQI-AEFFLSMTSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)c(C)n1 ZINC001375741391 1342968306 /nfs/dbraw/zinc/96/83/06/1342968306.db2.gz PZLJOWHBPXLFLQ-VQIMIIECSA-N 1 3 346.519 2.508 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@]1(C)CC[N@H+](Cc2cccc(C)c2)C1 ZINC001375828521 1343062254 /nfs/dbraw/zinc/06/22/54/1343062254.db2.gz JGRDTNNIHSSJCX-ICSRJNTNSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@]1(C)CC[N@@H+](Cc2cccc(C)c2)C1 ZINC001375828521 1343062258 /nfs/dbraw/zinc/06/22/58/1343062258.db2.gz JGRDTNNIHSSJCX-ICSRJNTNSA-N 1 3 349.494 2.756 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1(C)CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001375929395 1343177222 /nfs/dbraw/zinc/17/72/22/1343177222.db2.gz BFNYFOQESLHBPL-CEXWTWQISA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@]1(C)CCC[N@H+](CC2CCCC2)C1)N(C)C ZINC001375954661 1343209674 /nfs/dbraw/zinc/20/96/74/1343209674.db2.gz DTPMAMZOBOWKIV-QUCCMNQESA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@]1(C)CCC[N@@H+](CC2CCCC2)C1)N(C)C ZINC001375954661 1343209676 /nfs/dbraw/zinc/20/96/76/1343209676.db2.gz DTPMAMZOBOWKIV-QUCCMNQESA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c(C)c1 ZINC001393738125 1357115540 /nfs/dbraw/zinc/11/55/40/1357115540.db2.gz FWKDXQDERYPBHQ-HKUYNNGSSA-N 1 3 331.504 2.580 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C1CCN(Cc2ccsc2)CC1)[NH+](C)C ZINC001376029174 1343271530 /nfs/dbraw/zinc/27/15/30/1343271530.db2.gz JPJKQLSENBTKTH-QGZVFWFLSA-N 1 3 337.533 2.757 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCCN(CCc2ccccc2)C1)[NH+](CC)CC ZINC001376066483 1343299610 /nfs/dbraw/zinc/29/96/10/1343299610.db2.gz BXHGOBFSEYRDHD-VQTJNVASSA-N 1 3 345.531 2.930 10 0 EFAEHO CCc1ccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001393746319 1357121074 /nfs/dbraw/zinc/12/10/74/1357121074.db2.gz SWRJZNBCSPMRIG-LPHOPBHVSA-N 1 3 331.504 2.526 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001376146573 1343353957 /nfs/dbraw/zinc/35/39/57/1343353957.db2.gz UEYNJODLFHACOG-LPHOPBHVSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001376146573 1343353960 /nfs/dbraw/zinc/35/39/60/1343353960.db2.gz UEYNJODLFHACOG-LPHOPBHVSA-N 1 3 341.515 2.826 10 0 EFAEHO Cc1ccc(F)c(CN(C)C[C@@H]2CCCN(C(=O)CC[NH+](C)C)C2)c1 ZINC001376287382 1343457246 /nfs/dbraw/zinc/45/72/46/1343457246.db2.gz XWCBUELBANLGLI-KRWDZBQOSA-N 1 3 349.494 2.756 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)[N@H+](CC2CCCC2)C3)CCC1 ZINC001376302095 1343468356 /nfs/dbraw/zinc/46/83/56/1343468356.db2.gz IWNRTRCDIYTLKB-KSZLIROESA-N 1 3 333.520 2.630 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](CC2CCCC2)C3)CCC1 ZINC001376302095 1343468357 /nfs/dbraw/zinc/46/83/57/1343468357.db2.gz IWNRTRCDIYTLKB-KSZLIROESA-N 1 3 333.520 2.630 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1cccc(F)c1)C2 ZINC001376311975 1343475248 /nfs/dbraw/zinc/47/52/48/1343475248.db2.gz HEFSBBYZKQEJPW-UHOSZYNNSA-N 1 3 347.478 2.637 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1cccc(F)c1)C2 ZINC001376311975 1343475256 /nfs/dbraw/zinc/47/52/56/1343475256.db2.gz HEFSBBYZKQEJPW-UHOSZYNNSA-N 1 3 347.478 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CC[C@@H]2CCc3ccccc32)C1 ZINC001376353070 1343506546 /nfs/dbraw/zinc/50/65/46/1343506546.db2.gz NPXGATKNUWFPOD-OALUTQOASA-N 1 3 343.515 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2cc(C)ccc2F)C1 ZINC001376360725 1343513356 /nfs/dbraw/zinc/51/33/56/1343513356.db2.gz JGUWUKXNQNGXKX-AEFFLSMTSA-N 1 3 349.494 2.660 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001376364649 1343517784 /nfs/dbraw/zinc/51/77/84/1343517784.db2.gz QMMIVZHTABLPOO-XLIONFOSSA-N 1 3 345.531 2.773 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H]([NH2+][C@H](C)c2cc(C)ccc2C)C1)N(C)C ZINC001376396325 1343551550 /nfs/dbraw/zinc/55/15/50/1343551550.db2.gz JNCLSVRQOSNZMF-MTNOOBJLSA-N 1 3 331.504 2.941 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001376410376 1343565107 /nfs/dbraw/zinc/56/51/07/1343565107.db2.gz UEOUNBLFHCILJT-IYARVYRRSA-N 1 3 331.504 2.689 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(C)c1)N(C)C ZINC001376425997 1343581128 /nfs/dbraw/zinc/58/11/28/1343581128.db2.gz FKRASIGRUYGLNJ-RAFMOHDBSA-N 1 3 343.515 2.947 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(C)c1)N(C)C ZINC001376425997 1343581129 /nfs/dbraw/zinc/58/11/29/1343581129.db2.gz FKRASIGRUYGLNJ-RAFMOHDBSA-N 1 3 343.515 2.947 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)CC[C@H]21 ZINC001376451088 1343604059 /nfs/dbraw/zinc/60/40/59/1343604059.db2.gz KOXALVNJBIXSEI-DLBZAZTESA-N 1 3 335.517 2.513 10 0 EFAEHO CC[C@@H]([NH2+][C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)C1)c1ccc(F)cc1 ZINC001376459127 1343607989 /nfs/dbraw/zinc/60/79/89/1343607989.db2.gz CMSFHVNCCAJJQX-FGTMMUONSA-N 1 3 347.478 2.998 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1C[C@H]([NH2+][C@@H](CC)c2ccc(F)cc2)C1)N(C)C ZINC001376469075 1343613952 /nfs/dbraw/zinc/61/39/52/1343613952.db2.gz HDGLVIYFIAJIMY-XWTMOSNGSA-N 1 3 335.467 2.854 10 0 EFAEHO C[C@@H](N[C@H]1C[C@@H](NC(=O)CCC[NH+](C)C)C1)c1cc(F)ccc1F ZINC001376478394 1343618209 /nfs/dbraw/zinc/61/82/09/1343618209.db2.gz NMFFRNGYGWKKMO-YUELXQCFSA-N 1 3 339.430 2.604 10 0 EFAEHO CC[C@H]([NH2+][C@H]1C[C@@H](NC(=O)[C@H](CC)N(C)C)C1)c1ccc(F)cc1 ZINC001376486745 1343622388 /nfs/dbraw/zinc/62/23/88/1343622388.db2.gz HDGLVIYFIAJIMY-MHORFTMASA-N 1 3 335.467 2.854 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2c(C)cccc2Cl)C1 ZINC001376493575 1343625089 /nfs/dbraw/zinc/62/50/89/1343625089.db2.gz JJXVHUQGHJVMPL-GASCZTMLSA-N 1 3 337.895 2.727 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCc3c2cccc3Cl)C1 ZINC001376511609 1343638166 /nfs/dbraw/zinc/63/81/66/1343638166.db2.gz JOZLGESOASOXMS-QWQRMKEZSA-N 1 3 349.906 2.904 10 0 EFAEHO C[C@H](c1ccccc1F)N1CCC[C@@H](CNC(=O)CC[NH+](C)C)C1 ZINC001376536424 1343662039 /nfs/dbraw/zinc/66/20/39/1343662039.db2.gz DILMEMAKXZYQAC-CVEARBPZSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@H](c1ccccc1F)N1CCC[C@H](CNC(=O)CC[NH+](C)C)C1 ZINC001376536426 1343662330 /nfs/dbraw/zinc/66/23/30/1343662330.db2.gz DILMEMAKXZYQAC-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1CCC[C@@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001376537328 1343663533 /nfs/dbraw/zinc/66/35/33/1343663533.db2.gz FVASSAFWSXKFLT-SJORKVTESA-N 1 3 325.541 2.839 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@H]1CCCCN1Cc1ccc2cc[nH]c2c1 ZINC001376572886 1343690903 /nfs/dbraw/zinc/69/09/03/1343690903.db2.gz FERUBDNXHVEMMO-GOSISDBHSA-N 1 3 342.487 2.590 10 0 EFAEHO C[C@@H]([NH2+]CC1CC1)c1ccc(CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001376577849 1343696017 /nfs/dbraw/zinc/69/60/17/1343696017.db2.gz SCYXENJNACZITB-JKSUJKDBSA-N 1 3 329.488 2.705 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCC[C@H]1CNCc1sccc1Cl ZINC001376608033 1343718014 /nfs/dbraw/zinc/71/80/14/1343718014.db2.gz XLBPLPJMDCRLCE-ZDUSSCGKSA-N 1 3 343.924 2.824 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001376615206 1343723086 /nfs/dbraw/zinc/72/30/86/1343723086.db2.gz WBJGZEBPRSYVMJ-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H]1CCC[N@H+](CC2CCCC2)C1 ZINC001376622603 1343728991 /nfs/dbraw/zinc/72/89/91/1343728991.db2.gz HTFMJFSRMIXRGC-WMZOPIPTSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H]1CCC[N@@H+](CC2CCCC2)C1 ZINC001376622603 1343728994 /nfs/dbraw/zinc/72/89/94/1343728994.db2.gz HTFMJFSRMIXRGC-WMZOPIPTSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](Cc1ccc(F)cc1)CC2 ZINC001376623478 1343730343 /nfs/dbraw/zinc/73/03/43/1343730343.db2.gz KJJLWFRXZJODNR-UHFFFAOYSA-N 1 3 347.478 2.592 10 0 EFAEHO CCCC[N@@H+]1CCc2c(CNC(=O)CN(C)C(C)C)cccc2C1 ZINC001376670598 1343754283 /nfs/dbraw/zinc/75/42/83/1343754283.db2.gz DDCWVWQTLCKZJI-UHFFFAOYSA-N 1 3 331.504 2.801 10 0 EFAEHO CCCC[N@H+]1CCc2c(CNC(=O)CN(C)C(C)C)cccc2C1 ZINC001376670598 1343754285 /nfs/dbraw/zinc/75/42/85/1343754285.db2.gz DDCWVWQTLCKZJI-UHFFFAOYSA-N 1 3 331.504 2.801 10 0 EFAEHO CCCN(C)CC(=O)NCc1cccc2c1CC[N@H+](CC[C@@H](C)F)C2 ZINC001376671390 1343755585 /nfs/dbraw/zinc/75/55/85/1343755585.db2.gz HDKFDEOBDPXADT-MRXNPFEDSA-N 1 3 349.494 2.751 10 0 EFAEHO CCCN(C)CC(=O)NCc1cccc2c1CC[N@@H+](CC[C@@H](C)F)C2 ZINC001376671390 1343755589 /nfs/dbraw/zinc/75/55/89/1343755589.db2.gz HDKFDEOBDPXADT-MRXNPFEDSA-N 1 3 349.494 2.751 10 0 EFAEHO CC(C)[N@@H+]1CCc2c(CNC(=O)CN3[C@H](C)CC[C@@H]3C)cccc2C1 ZINC001376673462 1343757074 /nfs/dbraw/zinc/75/70/74/1343757074.db2.gz NCWXXQGGWLGNPP-CALCHBBNSA-N 1 3 343.515 2.942 10 0 EFAEHO CC(C)[N@H+]1CCc2c(CNC(=O)CN3[C@H](C)CC[C@@H]3C)cccc2C1 ZINC001376673462 1343757075 /nfs/dbraw/zinc/75/70/75/1343757075.db2.gz NCWXXQGGWLGNPP-CALCHBBNSA-N 1 3 343.515 2.942 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)NCc1cc(C)ccc1F ZINC001376731244 1343788680 /nfs/dbraw/zinc/78/86/80/1343788680.db2.gz NFQZLWODBDFICV-YJBOKZPZSA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)NCc1cc(C)ccc1F ZINC001376731244 1343788683 /nfs/dbraw/zinc/78/86/83/1343788683.db2.gz NFQZLWODBDFICV-YJBOKZPZSA-N 1 3 335.467 2.603 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]CCc1ccc(C)cc1 ZINC001376733309 1343790427 /nfs/dbraw/zinc/79/04/27/1343790427.db2.gz XGGBKQCLILAOPX-IEBWSBKVSA-N 1 3 331.504 2.506 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)C3CC[NH+](C)CC3)CCC2)c1 ZINC001376778951 1343831937 /nfs/dbraw/zinc/83/19/37/1343831937.db2.gz ZRNLKLFHFHDQTQ-UHFFFAOYSA-N 1 3 347.478 2.604 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]Cc2ccsc2)CCC1 ZINC001376814809 1343866810 /nfs/dbraw/zinc/86/68/10/1343866810.db2.gz BOGZLVADQZMMTN-GJZGRUSLSA-N 1 3 335.517 2.749 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@H+](Cc2ccc(F)cc2C)CC1)N(C)C ZINC001376883140 1343918614 /nfs/dbraw/zinc/91/86/14/1343918614.db2.gz NSYDYJLUGNZKDJ-RBUKOAKNSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCC[N@@H+](Cc2ccc(F)cc2C)CC1)N(C)C ZINC001376883140 1343918615 /nfs/dbraw/zinc/91/86/15/1343918615.db2.gz NSYDYJLUGNZKDJ-RBUKOAKNSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1 ZINC001376883768 1343919359 /nfs/dbraw/zinc/91/93/59/1343919359.db2.gz SZDSBGSYIOZGQY-UONOGXRCSA-N 1 3 325.884 2.836 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[N@H+](Cc2cc(C)ccc2F)CC1 ZINC001376911454 1343949830 /nfs/dbraw/zinc/94/98/30/1343949830.db2.gz KGNITUHILBAVEY-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[N@@H+](Cc2cc(C)ccc2F)CC1 ZINC001376911454 1343949834 /nfs/dbraw/zinc/94/98/34/1343949834.db2.gz KGNITUHILBAVEY-GOSISDBHSA-N 1 3 349.494 2.947 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@H+](CCc2ccccc2)CC1 ZINC001376914642 1343953443 /nfs/dbraw/zinc/95/34/43/1343953443.db2.gz SXEDWJTZHVPJEW-LJQANCHMSA-N 1 3 331.504 2.540 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@@H+](CCc2ccccc2)CC1 ZINC001376914642 1343953445 /nfs/dbraw/zinc/95/34/45/1343953445.db2.gz SXEDWJTZHVPJEW-LJQANCHMSA-N 1 3 331.504 2.540 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001376958338 1343988845 /nfs/dbraw/zinc/98/88/45/1343988845.db2.gz PXCMLEPVOCVFEY-QZTJIDSGSA-N 1 3 331.504 2.834 10 0 EFAEHO COc1cccc(C[N@@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001393791611 1357162023 /nfs/dbraw/zinc/16/20/23/1357162023.db2.gz RILQJGIJWFLOGH-SJLPKXTDSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc(C[N@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001393791611 1357162027 /nfs/dbraw/zinc/16/20/27/1357162027.db2.gz RILQJGIJWFLOGH-SJLPKXTDSA-N 1 3 347.503 2.505 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001377067599 1344112189 /nfs/dbraw/zinc/11/21/89/1344112189.db2.gz ORLRTJAMUXEAGZ-IRXDYDNUSA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1sccc1Cl ZINC001377067526 1344112201 /nfs/dbraw/zinc/11/22/01/1344112201.db2.gz OLKWQOYMUMSKNX-STQMWFEESA-N 1 3 343.924 2.728 10 0 EFAEHO Cc1cccc(CN(CCNC(=O)C[NH+]2[C@H](C)CC[C@H]2C)C2CC2)c1 ZINC001377572867 1344183544 /nfs/dbraw/zinc/18/35/44/1344183544.db2.gz YUIVTWKGRPNXTB-QZTJIDSGSA-N 1 3 343.515 2.948 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]CCN(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001377590614 1344197127 /nfs/dbraw/zinc/19/71/27/1344197127.db2.gz JMZOYCANDYEWRU-AEFFLSMTSA-N 1 3 331.504 2.754 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]CCN(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001377590619 1344197217 /nfs/dbraw/zinc/19/72/17/1344197217.db2.gz JMZOYCANDYEWRU-FUHWJXTLSA-N 1 3 331.504 2.754 10 0 EFAEHO CC(C)C[NH2+][C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)c1ccccc1 ZINC001377618726 1344227204 /nfs/dbraw/zinc/22/72/04/1344227204.db2.gz GNAVCWCYROPXJU-OALUTQOASA-N 1 3 331.504 2.962 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H]2C[N@H+](C)CCCC2CCC2)C1 ZINC001377659937 1344280736 /nfs/dbraw/zinc/28/07/36/1344280736.db2.gz HFWKSTONFXAXEJ-HKUYNNGSSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H]2C[N@@H+](C)CCCC2CCC2)C1 ZINC001377659937 1344280743 /nfs/dbraw/zinc/28/07/43/1344280743.db2.gz HFWKSTONFXAXEJ-HKUYNNGSSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)C[N@H+](C)C[C@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001377664223 1344287787 /nfs/dbraw/zinc/28/77/87/1344287787.db2.gz RCERXZXPPWXSKL-APWZRJJASA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)C[N@@H+](C)C[C@H]1CCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001377664223 1344287791 /nfs/dbraw/zinc/28/77/91/1344287791.db2.gz RCERXZXPPWXSKL-APWZRJJASA-N 1 3 341.515 2.778 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@H](C)c2ccccc2F)C1 ZINC001377737785 1344386214 /nfs/dbraw/zinc/38/62/14/1344386214.db2.gz XLFFOOBWZZSGND-QQFBHYJXSA-N 1 3 335.467 2.713 10 0 EFAEHO CCc1cccc(C[N@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001377778223 1344428054 /nfs/dbraw/zinc/42/80/54/1344428054.db2.gz CIOISKANMABNPU-HXUWFJFHSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1cccc(C[N@@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001377778223 1344428056 /nfs/dbraw/zinc/42/80/56/1344428056.db2.gz CIOISKANMABNPU-HXUWFJFHSA-N 1 3 345.531 2.870 10 0 EFAEHO C[C@@H]([NH2+]Cc1cccc(Cl)c1)[C@H](C)NC(=O)CN(C)C1CCC1 ZINC001377805399 1344456418 /nfs/dbraw/zinc/45/64/18/1344456418.db2.gz ISFDXXCZNKWOAK-KGLIPLIRSA-N 1 3 337.895 2.807 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)cc1 ZINC001377808958 1344460325 /nfs/dbraw/zinc/46/03/25/1344460325.db2.gz QCEYOPMNOJHHFW-HZPDHXFCSA-N 1 3 331.504 2.716 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001377809996 1344461256 /nfs/dbraw/zinc/46/12/56/1344461256.db2.gz RJSHYBNNSBDSOX-NWDGAFQWSA-N 1 3 343.924 2.869 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001377824762 1344481385 /nfs/dbraw/zinc/48/13/85/1344481385.db2.gz MRRIOSCWISEQDK-HOTGVXAUSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[C@@H](C)C[NH2+]CC(C)(C)CN(C)C(=O)C(C)(C)N1CCCC1 ZINC001377952662 1344611067 /nfs/dbraw/zinc/61/10/67/1344611067.db2.gz AIMQFGPZQHFTMT-MRXNPFEDSA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1cccc(CN2CC(CNC(=O)[C@@H](C(C)C)[NH+]3CCCC3)C2)c1 ZINC001378021593 1344672172 /nfs/dbraw/zinc/67/21/72/1344672172.db2.gz MGPHHHZJQHPOQZ-HXUWFJFHSA-N 1 3 343.515 2.663 10 0 EFAEHO CC(C)C[C@@H](C)CN1C[C@@H]2C[C@H]1CN2C(=O)C12CCC[NH+](CCC1)C2 ZINC001378030519 1344680894 /nfs/dbraw/zinc/68/08/94/1344680894.db2.gz BMTJJLDQZNDNKA-QYZOEREBSA-N 1 3 347.547 2.830 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[N@H+](C)CCc1ccccc1 ZINC001378046541 1344698206 /nfs/dbraw/zinc/69/82/06/1344698206.db2.gz IYDUQFMWVCYDAN-PKOBYXMFSA-N 1 3 331.504 2.538 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[N@@H+](C)CCc1ccccc1 ZINC001378046541 1344698209 /nfs/dbraw/zinc/69/82/09/1344698209.db2.gz IYDUQFMWVCYDAN-PKOBYXMFSA-N 1 3 331.504 2.538 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1cccc(F)c1 ZINC001378048257 1344700184 /nfs/dbraw/zinc/70/01/84/1344700184.db2.gz LWQMUWHNCPZYNG-MAUKXSAKSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1cccc(F)c1 ZINC001378048257 1344700187 /nfs/dbraw/zinc/70/01/87/1344700187.db2.gz LWQMUWHNCPZYNG-MAUKXSAKSA-N 1 3 335.467 2.635 10 0 EFAEHO CCN(C(=O)[C@@H](C)N1CCCCCC1)[C@@H]1CC[N@H+](CCC2CC2)C1 ZINC001378205270 1344886734 /nfs/dbraw/zinc/88/67/34/1344886734.db2.gz YWWFFLMXSWMGJZ-IEBWSBKVSA-N 1 3 335.536 2.974 10 0 EFAEHO CCN(C(=O)[C@@H](C)N1CCCCCC1)[C@@H]1CC[N@@H+](CCC2CC2)C1 ZINC001378205270 1344886739 /nfs/dbraw/zinc/88/67/39/1344886739.db2.gz YWWFFLMXSWMGJZ-IEBWSBKVSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](CC)[NH2+]Cc1cc(F)ccc1C ZINC001378260645 1344939639 /nfs/dbraw/zinc/93/96/39/1344939639.db2.gz YMLKLKVVCJAOFR-OALUTQOASA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](CC)N(C)C)[NH2+]Cc1cc2ccccc2o1 ZINC001378261923 1344940771 /nfs/dbraw/zinc/94/07/71/1344940771.db2.gz KFQFUBQVZFLZEJ-NVXWUHKLSA-N 1 3 331.460 2.757 10 0 EFAEHO CC[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]CCc1ccccc1 ZINC001378301871 1344968714 /nfs/dbraw/zinc/96/87/14/1344968714.db2.gz XSGYXQZFKISNDA-AZUAARDMSA-N 1 3 345.531 2.978 10 0 EFAEHO C[C@H](NC[C@](C)(NC(=O)CC[NH+](C)C)C1CC1)c1ccccc1F ZINC001378416436 1345058957 /nfs/dbraw/zinc/05/89/57/1345058957.db2.gz TYHLQZNXCUNRMQ-LIRRHRJNSA-N 1 3 335.467 2.713 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[NH2+]CC1CC2(CCC2)C1 ZINC001393862003 1357220980 /nfs/dbraw/zinc/22/09/80/1357220980.db2.gz XVXZMLBQUBYAFH-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H]1CCCC[C@@]1(CNCc1ccccc1F)NC(=O)CC[NH+](C)C ZINC001378441391 1345078881 /nfs/dbraw/zinc/07/88/81/1345078881.db2.gz YSNMNVGJUZQXDS-JXFKEZNVSA-N 1 3 349.494 2.932 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)N[C@H]2CC[C@H](NC/C(Cl)=C\Cl)CC2)C1 ZINC001378455846 1345092111 /nfs/dbraw/zinc/09/21/11/1345092111.db2.gz SWCOHEXDKWYWLK-HIRUMQFNSA-N 1 3 348.318 2.664 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)N[C@H]2CC[C@H](NC/C(Cl)=C\Cl)CC2)C1 ZINC001378455846 1345092113 /nfs/dbraw/zinc/09/21/13/1345092113.db2.gz SWCOHEXDKWYWLK-HIRUMQFNSA-N 1 3 348.318 2.664 10 0 EFAEHO CC(C)C[NH2+][C@@H]1CCCCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001417842398 1373324026 /nfs/dbraw/zinc/32/40/26/1373324026.db2.gz YBCLQRPTGIQLBK-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](Cc2c(C)cccc2C)C1)N(C)C ZINC001378587868 1345182931 /nfs/dbraw/zinc/18/29/31/1345182931.db2.gz VEOGBYGRCKQGDT-VQIMIIECSA-N 1 3 331.504 2.580 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]CC2CC3(CCC3)C2)CCCC1 ZINC001378721119 1345274266 /nfs/dbraw/zinc/27/42/66/1345274266.db2.gz WSNCURYJDYRIPN-UHFFFAOYSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCCC2)c1 ZINC001378721553 1345274619 /nfs/dbraw/zinc/27/46/19/1345274619.db2.gz YOAINNYTNZVHJW-UHFFFAOYSA-N 1 3 349.494 2.993 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@@H](C)c3cccc(C)c3)C[C@H]21 ZINC001378749281 1345291506 /nfs/dbraw/zinc/29/15/06/1345291506.db2.gz ITQKYSMLTRRAIT-FRYIKTPZSA-N 1 3 343.515 2.692 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@@H](C)c3cccc(C)c3)C[C@H]21 ZINC001378749281 1345291509 /nfs/dbraw/zinc/29/15/09/1345291509.db2.gz ITQKYSMLTRRAIT-FRYIKTPZSA-N 1 3 343.515 2.692 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3CCCCCC3)C[C@H]21)N(C)C ZINC001378769172 1345302205 /nfs/dbraw/zinc/30/22/05/1345302205.db2.gz WKRVEPFLIUYDPQ-YSTOQKLRSA-N 1 3 349.563 2.981 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3CCCCCC3)C[C@H]21)N(C)C ZINC001378769172 1345302207 /nfs/dbraw/zinc/30/22/07/1345302207.db2.gz WKRVEPFLIUYDPQ-YSTOQKLRSA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N1CCCC2(CN(C(=O)CC[NH+](C)C)C2)C1 ZINC001378793919 1345318198 /nfs/dbraw/zinc/31/81/98/1345318198.db2.gz ANQFLHBZMMRIOI-INIZCTEOSA-N 1 3 347.478 2.763 10 0 EFAEHO CC(C)CCC[N@@H+]1CCCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001378797178 1345320353 /nfs/dbraw/zinc/32/03/53/1345320353.db2.gz IVGWFQMYSFJIDG-GOSISDBHSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)CCC[N@H+]1CCCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001378797178 1345320357 /nfs/dbraw/zinc/32/03/57/1345320357.db2.gz IVGWFQMYSFJIDG-GOSISDBHSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H](C)C[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001378797849 1345321273 /nfs/dbraw/zinc/32/12/73/1345321273.db2.gz YTMCEOCHDHHBON-AEFFLSMTSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@H](c1cccc(F)c1)N1CCCC2(CN(C(=O)CC[NH+](C)C)C2)C1 ZINC001378798799 1345322318 /nfs/dbraw/zinc/32/23/18/1345322318.db2.gz OYSYVIBDGFDKRC-MRXNPFEDSA-N 1 3 347.478 2.763 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@H+](CC1CCCCC1)C2 ZINC001378799121 1345322499 /nfs/dbraw/zinc/32/24/99/1345322499.db2.gz ZNIPOWXKWWNUFS-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@@H+](CC1CCCCC1)C2 ZINC001378799121 1345322503 /nfs/dbraw/zinc/32/25/03/1345322503.db2.gz ZNIPOWXKWWNUFS-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H](C[NH2+]Cc1cccc(Cl)c1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001378837731 1345351257 /nfs/dbraw/zinc/35/12/57/1345351257.db2.gz XJKDTHLTGHXICX-HUUCEWRRSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](C[NH2+][C@H]1CCc2ccc(Cl)cc21)N(C)C(=O)CN1CCCC1 ZINC001378847972 1345360655 /nfs/dbraw/zinc/36/06/55/1345360655.db2.gz DNXPHGSXWRHCQS-KDOFPFPSSA-N 1 3 349.906 2.860 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001378871975 1345381035 /nfs/dbraw/zinc/38/10/35/1345381035.db2.gz ZKBBWZAVDWORNM-NSISKUIASA-N 1 3 345.531 2.820 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1C[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001378892038 1345401511 /nfs/dbraw/zinc/40/15/11/1345401511.db2.gz OSKAIJNQZMMKBC-KBAYOESNSA-N 1 3 335.467 2.594 10 0 EFAEHO CCc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001378899761 1345408504 /nfs/dbraw/zinc/40/85/04/1345408504.db2.gz PKDYQTMXTCFZET-FXAWDEMLSA-N 1 3 345.531 2.916 10 0 EFAEHO CCC(CC)C[NH2+]C[C@@H]1[C@H](C)CCCN1C(=O)CN(C)C(C)C ZINC001378929606 1345435382 /nfs/dbraw/zinc/43/53/82/1345435382.db2.gz UUTAISFNFVWHHJ-SJLPKXTDSA-N 1 3 325.541 2.980 10 0 EFAEHO C[N@H+](C/C=C/c1ccccc1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001378933086 1345438691 /nfs/dbraw/zinc/43/86/91/1345438691.db2.gz UBOFQYKUCPDCMZ-JXMROGBWSA-N 1 3 341.499 2.718 10 0 EFAEHO C[N@@H+](C/C=C/c1ccccc1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001378933086 1345438692 /nfs/dbraw/zinc/43/86/92/1345438692.db2.gz UBOFQYKUCPDCMZ-JXMROGBWSA-N 1 3 341.499 2.718 10 0 EFAEHO CC(C)C[NH2+]C[C@@H](C1CC1)N(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001379034528 1345516264 /nfs/dbraw/zinc/51/62/64/1345516264.db2.gz SGRJVCUSKYIJEI-LPHOPBHVSA-N 1 3 341.515 2.682 10 0 EFAEHO CC(C)C[NH2+]C[C@H](C1CC1)N(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001379034530 1345516693 /nfs/dbraw/zinc/51/66/93/1345516693.db2.gz SGRJVCUSKYIJEI-VQIMIIECSA-N 1 3 341.515 2.682 10 0 EFAEHO CN(CC(=O)N(C)[C@@H](C[NH2+]CC1CCCC1)C1CC1)CC(C)(C)C ZINC001379039291 1345521542 /nfs/dbraw/zinc/52/15/42/1345521542.db2.gz XVMYEUJIYVLUQN-SFHVURJKSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1cccc(CN(C)CCN(C)C(=O)C23CCC[NH+](CCC2)C3)c1 ZINC001379079373 1345556527 /nfs/dbraw/zinc/55/65/27/1345556527.db2.gz SWDKBIKLSNELFF-UHFFFAOYSA-N 1 3 343.515 2.761 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[N@H+](C)C[C@H]2CCC(F)(F)C2)CC1 ZINC001379115569 1345592801 /nfs/dbraw/zinc/59/28/01/1345592801.db2.gz XRGYKJNEYPNJFZ-INIZCTEOSA-N 1 3 345.478 2.544 10 0 EFAEHO CC1CCN(CC(=O)N(C)CC[N@@H+](C)C[C@H]2CCC(F)(F)C2)CC1 ZINC001379115569 1345592806 /nfs/dbraw/zinc/59/28/06/1345592806.db2.gz XRGYKJNEYPNJFZ-INIZCTEOSA-N 1 3 345.478 2.544 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@H](C)CN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001379152467 1345628600 /nfs/dbraw/zinc/62/86/00/1345628600.db2.gz WKGZAWDXNOCMDP-CVEARBPZSA-N 1 3 347.503 2.677 10 0 EFAEHO C[C@H](CN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]CC1CCC(C)(C)CC1 ZINC001379215904 1345663405 /nfs/dbraw/zinc/66/34/05/1345663405.db2.gz HUTFZXXYHBIOQX-DLBZAZTESA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](CN(C)C(=O)C[N@@H+]1CC[C@H](C)C1)NCc1ccccc1Cl ZINC001379227082 1345669479 /nfs/dbraw/zinc/66/94/79/1345669479.db2.gz UYCIXHPZSKJHCN-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CN(C)C(=O)C[N@H+]1CC[C@H](C)C1)NCc1ccccc1Cl ZINC001379227082 1345669483 /nfs/dbraw/zinc/66/94/83/1345669483.db2.gz UYCIXHPZSKJHCN-GJZGRUSLSA-N 1 3 337.895 2.618 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@@H](C)CN(C)C(=O)CN(C)C(C)C)c1 ZINC001379323255 1345726285 /nfs/dbraw/zinc/72/62/85/1345726285.db2.gz CGPBBTNTCRKCPT-JKSUJKDBSA-N 1 3 335.492 2.533 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)C2CC[NH+](C)CC2)c(Cl)c1 ZINC001379419657 1345775528 /nfs/dbraw/zinc/77/55/28/1345775528.db2.gz ORRHQJKRYBNDRN-CQSZACIVSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C[C@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001379514692 1345820796 /nfs/dbraw/zinc/82/07/96/1345820796.db2.gz GOLYBQICIJPXCT-IRXDYDNUSA-N 1 3 331.504 2.943 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](C)NC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001379583887 1345890323 /nfs/dbraw/zinc/89/03/23/1345890323.db2.gz WDQCQLHEUSIOFK-LSDHHAIUSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@H](C)NC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001379583887 1345890325 /nfs/dbraw/zinc/89/03/25/1345890325.db2.gz WDQCQLHEUSIOFK-LSDHHAIUSA-N 1 3 337.895 2.585 10 0 EFAEHO C[C@@H](CNC1c2ccccc2-c2ccccc21)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001379596525 1345907915 /nfs/dbraw/zinc/90/79/15/1345907915.db2.gz HHIMFEVHRCAABV-JKSUJKDBSA-N 1 3 349.478 2.802 10 0 EFAEHO C[C@@H](CNC1c2ccccc2-c2ccccc21)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001379596525 1345907916 /nfs/dbraw/zinc/90/79/16/1345907916.db2.gz HHIMFEVHRCAABV-JKSUJKDBSA-N 1 3 349.478 2.802 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]CC1CC(NC(=O)CN(C)C(C)C)C1 ZINC001393909062 1357277515 /nfs/dbraw/zinc/27/75/15/1357277515.db2.gz UMRADBQPZAIBKJ-AOCRQIFASA-N 1 3 331.504 2.881 10 0 EFAEHO C[C@@H]([NH2+]CCc1cccs1)[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001393954709 1357318946 /nfs/dbraw/zinc/31/89/46/1357318946.db2.gz GIJFSYYFEJMTDO-CABCVRRESA-N 1 3 337.533 2.648 10 0 EFAEHO Cc1ccc(CN2CCC[C@H](NC(=O)CC[NH+](C)C)[C@@H]2C)cc1C ZINC001379647399 1347224272 /nfs/dbraw/zinc/22/42/72/1347224272.db2.gz CYTYCLPCJODAHJ-HKUYNNGSSA-N 1 3 331.504 2.724 10 0 EFAEHO Cc1cc(CN2CCC[C@H](NC(=O)CC[NH+](C)C)[C@@H]2C)c(C)s1 ZINC001379671009 1347246487 /nfs/dbraw/zinc/24/64/87/1347246487.db2.gz VBHDQLQBOOUNIX-YOEHRIQHSA-N 1 3 337.533 2.786 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@H+](C)Cc1ccc(Cl)cc1C)N(C)C ZINC001379697374 1347266426 /nfs/dbraw/zinc/26/64/26/1347266426.db2.gz OAGVSZPSJAQTSF-RHSMWYFYSA-N 1 3 339.911 2.925 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@@H+](C)Cc1ccc(Cl)cc1C)N(C)C ZINC001379697374 1347266431 /nfs/dbraw/zinc/26/64/31/1347266431.db2.gz OAGVSZPSJAQTSF-RHSMWYFYSA-N 1 3 339.911 2.925 10 0 EFAEHO C[C@H](C[N@H+](C)CC1CCC2(CC2)CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001379734226 1347294520 /nfs/dbraw/zinc/29/45/20/1347294520.db2.gz BFBUPIGLVPOVLR-DLBZAZTESA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@H](C[N@@H+](C)CC1CCC2(CC2)CC1)NC(=O)CN1CC[C@H](C)C1 ZINC001379734226 1347294523 /nfs/dbraw/zinc/29/45/23/1347294523.db2.gz BFBUPIGLVPOVLR-DLBZAZTESA-N 1 3 335.536 2.735 10 0 EFAEHO CCc1cccc(CN(C)C[C@@H](C)NC(=O)C[C@H]2CC[N@H+](C)C2)c1 ZINC001379765112 1347317728 /nfs/dbraw/zinc/31/77/28/1347317728.db2.gz MPOONZHLTIUCOZ-VQIMIIECSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(CN(C)C[C@@H](C)NC(=O)C[C@H]2CC[N@@H+](C)C2)c1 ZINC001379765112 1347317733 /nfs/dbraw/zinc/31/77/33/1347317733.db2.gz MPOONZHLTIUCOZ-VQIMIIECSA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)[C@H]1CCCc2ccccc21 ZINC001379792778 1347342483 /nfs/dbraw/zinc/34/24/83/1347342483.db2.gz BQRUKKZOHOZDFV-APWZRJJASA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC001379792778 1347342487 /nfs/dbraw/zinc/34/24/87/1347342487.db2.gz BQRUKKZOHOZDFV-APWZRJJASA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CN(C)Cc1cccc(F)c1)[NH+]1CCCC1 ZINC001379799496 1347347694 /nfs/dbraw/zinc/34/76/94/1347347694.db2.gz OYGSXZDUNHTPGU-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001379857473 1347374075 /nfs/dbraw/zinc/37/40/75/1347374075.db2.gz LRPRQWXQAUGSNH-MOPGFXCFSA-N 1 3 347.547 2.924 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1ccccc1Cl)C1CC1)N(C)C ZINC001379910749 1347400955 /nfs/dbraw/zinc/40/09/55/1347400955.db2.gz AMNNNSAAEIDFFY-DLBZAZTESA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+][C@H](C)c1ccccc1F)C1CC1 ZINC001379911935 1347402254 /nfs/dbraw/zinc/40/22/54/1347402254.db2.gz DNGHYMRCSJHTNB-KDOFPFPSSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC001380085251 1347508855 /nfs/dbraw/zinc/50/88/55/1347508855.db2.gz QCHQUEKRMYYZBC-HUUCEWRRSA-N 1 3 343.462 2.533 10 0 EFAEHO CC[C@H](F)CN1CCC([C@H](C)NC(=O)CC[NH+]2CCCCC2)CC1 ZINC001380145809 1347533440 /nfs/dbraw/zinc/53/34/40/1347533440.db2.gz JSMQPICWSACXMF-WMZOPIPTSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H](NC1(CNC(=O)C23CC[NH+](CC2)C3)CC1)c1ccc(Cl)cc1 ZINC001380156542 1347539190 /nfs/dbraw/zinc/53/91/90/1347539190.db2.gz DIRJTIRTAFXFKP-AWEZNQCLSA-N 1 3 347.890 2.735 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)CC(C)(C)C)c(C)n1 ZINC001393993139 1357362000 /nfs/dbraw/zinc/36/20/00/1357362000.db2.gz XWBGFDOTQQMBJX-HZPDHXFCSA-N 1 3 348.535 2.659 10 0 EFAEHO COc1cccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)c1 ZINC001380272115 1347563793 /nfs/dbraw/zinc/56/37/93/1347563793.db2.gz SKHCHRXPGZPRPO-SJLPKXTDSA-N 1 3 347.503 2.505 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@@H](C)C2)cc1F ZINC001380275347 1347564734 /nfs/dbraw/zinc/56/47/34/1347564734.db2.gz XNYMEMMIEDTRAL-WMZOPIPTSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)[NH+]1CCC(C)(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001380306107 1347580836 /nfs/dbraw/zinc/58/08/36/1347580836.db2.gz LQGXPBQIURASTL-SFHVURJKSA-N 1 3 327.488 2.578 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]CC1CCC1)C1CCCC1 ZINC001380319967 1347591042 /nfs/dbraw/zinc/59/10/42/1347591042.db2.gz VHQCYQAYQHWKTB-RTBURBONSA-N 1 3 335.536 2.926 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@](C)(C[NH2+]C[C@@H]2CCC(F)(F)C2)C1 ZINC001380422420 1347660582 /nfs/dbraw/zinc/66/05/82/1347660582.db2.gz KDOMZUGQQCBFCR-NVXWUHKLSA-N 1 3 345.478 2.592 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@](C)(C[NH2+]Cc3ccsc3)C2)CC1 ZINC001380427573 1347664377 /nfs/dbraw/zinc/66/43/77/1347664377.db2.gz VGJNSXXVBWRTOL-LJQANCHMSA-N 1 3 349.544 2.808 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]Cc3ccsc3)C2)CC1 ZINC001380427566 1347664404 /nfs/dbraw/zinc/66/44/04/1347664404.db2.gz VGJNSXXVBWRTOL-IBGZPJMESA-N 1 3 349.544 2.808 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@@]2(C)CCCN(Cc3ccsc3)C2)CC[N@@H+]1C ZINC001380475542 1347704949 /nfs/dbraw/zinc/70/49/49/1347704949.db2.gz YKWAIRBZWFZAFE-SZVBFZGTSA-N 1 3 349.544 2.807 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@@]2(C)CCCN(Cc3ccsc3)C2)CC[N@H+]1C ZINC001380475542 1347704951 /nfs/dbraw/zinc/70/49/51/1347704951.db2.gz YKWAIRBZWFZAFE-SZVBFZGTSA-N 1 3 349.544 2.807 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@]2(C)CCCN(Cc3ccsc3)C2)CC[N@@H+]1C ZINC001380475533 1347705107 /nfs/dbraw/zinc/70/51/07/1347705107.db2.gz YKWAIRBZWFZAFE-SUMDDJOVSA-N 1 3 349.544 2.807 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@]2(C)CCCN(Cc3ccsc3)C2)CC[N@H+]1C ZINC001380475533 1347705110 /nfs/dbraw/zinc/70/51/10/1347705110.db2.gz YKWAIRBZWFZAFE-SUMDDJOVSA-N 1 3 349.544 2.807 10 0 EFAEHO CC[C@H](C(=O)NC[C@]1(C)CCC[N@H+](CC2CC(F)(F)C2)C1)N(C)C ZINC001380488739 1347716829 /nfs/dbraw/zinc/71/68/29/1347716829.db2.gz XHXCGEMFQXFWFM-WBVHZDCISA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C(=O)NC[C@]1(C)CCC[N@@H+](CC2CC(F)(F)C2)C1)N(C)C ZINC001380488739 1347716835 /nfs/dbraw/zinc/71/68/35/1347716835.db2.gz XHXCGEMFQXFWFM-WBVHZDCISA-N 1 3 345.478 2.590 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001394002893 1357374176 /nfs/dbraw/zinc/37/41/76/1357374176.db2.gz RJNHOFAEWMBGDY-KBPBESRZSA-N 1 3 325.884 2.665 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1CC[C@H](C[NH2+]CC2CC2)CC1 ZINC001380707897 1347827567 /nfs/dbraw/zinc/82/75/67/1347827567.db2.gz QRAJAMQIFVTMFC-PSBWJHGTSA-N 1 3 335.536 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CC[NH+](CC1CC3(CCC3)C1)CC2 ZINC001380802563 1347888547 /nfs/dbraw/zinc/88/85/47/1347888547.db2.gz HSEJDJQFHLCDNI-UHFFFAOYSA-N 1 3 347.547 2.833 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1(CNC(=O)C(C)(C)N2CCCCC2)CCC1 ZINC001380856473 1347917778 /nfs/dbraw/zinc/91/77/78/1347917778.db2.gz JRINHFJINIRLEZ-OAHLLOKOSA-N 1 3 327.488 2.628 10 0 EFAEHO C[C@H](F)CC[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CCC1 ZINC001380882393 1347934320 /nfs/dbraw/zinc/93/43/20/1347934320.db2.gz SDSXDUVDBKCNEZ-KSSFIOAISA-N 1 3 345.478 2.576 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+]C[C@@H]2CCCC(F)(F)C2)CCC1)N(C)C ZINC001380896680 1347943212 /nfs/dbraw/zinc/94/32/12/1347943212.db2.gz SITMSGCCPXEEFB-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2cccc(Cl)c2)CCC1 ZINC001380904364 1347947310 /nfs/dbraw/zinc/94/73/10/1347947310.db2.gz ZWJZODDJTSBOIP-UHFFFAOYSA-N 1 3 337.895 2.809 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CCCN(C/C=C/Cl)CC1 ZINC001380933344 1347965802 /nfs/dbraw/zinc/96/58/02/1347965802.db2.gz WBLZLHTYILQTCW-ZRCGRWLBSA-N 1 3 327.900 2.584 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CCCN(C/C=C/Cl)CC1 ZINC001380933344 1347965805 /nfs/dbraw/zinc/96/58/05/1347965805.db2.gz WBLZLHTYILQTCW-ZRCGRWLBSA-N 1 3 327.900 2.584 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1CCC(N(C)C(=O)CN(C)C2CCC2)CC1 ZINC001394009988 1357382647 /nfs/dbraw/zinc/38/26/47/1357382647.db2.gz QDPPIEQAJQNQQD-HPUBIQBYSA-N 1 3 327.488 2.578 10 0 EFAEHO Cc1ccncc1CN(C)CCCN(C)C(=O)C(C)(C)[NH+]1CCCC1 ZINC001380969544 1347992969 /nfs/dbraw/zinc/99/29/69/1347992969.db2.gz GWQRKZCFGAXBES-UHFFFAOYSA-N 1 3 346.519 2.545 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@H+](C)C[C@@H]1CCC(F)(F)C1)N(C)C ZINC001380983574 1348004919 /nfs/dbraw/zinc/00/49/19/1348004919.db2.gz WWPPWZRBTXJLKV-CABCVRRESA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@@H+](C)C[C@@H]1CCC(F)(F)C1)N(C)C ZINC001380983574 1348004922 /nfs/dbraw/zinc/00/49/22/1348004922.db2.gz WWPPWZRBTXJLKV-CABCVRRESA-N 1 3 333.467 2.542 10 0 EFAEHO Cc1ccncc1CN(C)CCCN(C)C(=O)C[N@H+]1[C@H](C)CC[C@@H]1C ZINC001380990948 1348009739 /nfs/dbraw/zinc/00/97/39/1348009739.db2.gz WDUGCPZIOKBHNN-HDICACEKSA-N 1 3 346.519 2.543 10 0 EFAEHO Cc1ccncc1CN(C)CCCN(C)C(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001380990948 1348009743 /nfs/dbraw/zinc/00/97/43/1348009743.db2.gz WDUGCPZIOKBHNN-HDICACEKSA-N 1 3 346.519 2.543 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(CC)([NH2+]CC[C@H](C)F)CC1 ZINC001381023531 1348024961 /nfs/dbraw/zinc/02/49/61/1348024961.db2.gz SSDRZZSNEABFHV-DLBZAZTESA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@H](C)C[NH2+]C1(CC)CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001381027206 1348029150 /nfs/dbraw/zinc/02/91/50/1348029150.db2.gz YBFVDDZLKDKFKB-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO C[NH+]1CCC(C(=O)N2CCC(C)(NC/C(Cl)=C/Cl)CC2)CC1 ZINC001381128283 1348095480 /nfs/dbraw/zinc/09/54/80/1348095480.db2.gz QOMPBMQVXSFVEH-KAMYIIQDSA-N 1 3 348.318 2.618 10 0 EFAEHO CC(C)CC[NH2+]C1(C)CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001381128272 1348095543 /nfs/dbraw/zinc/09/55/43/1348095543.db2.gz QDROEWHMHWQBAN-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)C[NH2+]C1(C)CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001381128248 1348095852 /nfs/dbraw/zinc/09/58/52/1348095852.db2.gz PFTROKXXYPIXLS-LJQANCHMSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381135334 1348101533 /nfs/dbraw/zinc/10/15/33/1348101533.db2.gz QGACPZSXQOMKES-IRXDYDNUSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381135334 1348101532 /nfs/dbraw/zinc/10/15/32/1348101532.db2.gz QGACPZSXQOMKES-IRXDYDNUSA-N 1 3 325.541 2.835 10 0 EFAEHO Cc1ccc(CN2CC[C@H](NC(=O)CCC[NH+](C)C)C[C@H]2C)c(C)n1 ZINC001381169418 1348117911 /nfs/dbraw/zinc/11/79/11/1348117911.db2.gz HKARFNGSHCDBAZ-APWZRJJASA-N 1 3 346.519 2.509 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@H](C)CC ZINC001381280454 1348183947 /nfs/dbraw/zinc/18/39/47/1348183947.db2.gz YAISZYUVIKVRTE-XFQXTVEOSA-N 1 3 331.504 2.746 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)C[C@@H]1CCCN1C(=O)CN(C)C(C)C ZINC001381311771 1348205029 /nfs/dbraw/zinc/20/50/29/1348205029.db2.gz HWRBCIRFEOTPJY-MSOLQXFVSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)C[C@@H]1CCCN1C(=O)CN(C)C(C)C ZINC001381311771 1348205032 /nfs/dbraw/zinc/20/50/32/1348205032.db2.gz HWRBCIRFEOTPJY-MSOLQXFVSA-N 1 3 325.541 2.932 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]Cc2ccc(Cl)s2)C1 ZINC001381338038 1348214848 /nfs/dbraw/zinc/21/48/48/1348214848.db2.gz JXOTUUWVRSGITN-UHFFFAOYSA-N 1 3 343.924 2.728 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]CC2CC(NC(=O)CN(C)C(C)C)C2)c1 ZINC001381343898 1348217354 /nfs/dbraw/zinc/21/73/54/1348217354.db2.gz VFLZSHSUMUMVSU-LRYGQEGESA-N 1 3 331.504 2.881 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]Cc1ccc(CF)cc1 ZINC001381389892 1348237220 /nfs/dbraw/zinc/23/72/20/1348237220.db2.gz MCAPSJAHIFSVCM-LSDHHAIUSA-N 1 3 335.467 2.623 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)cc1C ZINC001381397424 1348241508 /nfs/dbraw/zinc/24/15/08/1348241508.db2.gz UDWJLDBGKSRCBY-DLBZAZTESA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(CN[C@@H](C)[C@H](C)NC(=O)CCC[NH+](C)C)c(Cl)c1 ZINC001381413958 1348255940 /nfs/dbraw/zinc/25/59/40/1348255940.db2.gz IYWUQJCCVAOXER-GJZGRUSLSA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)C(C)C ZINC001381459032 1348289616 /nfs/dbraw/zinc/28/96/16/1348289616.db2.gz WZEJSLOHDYBJPY-GJZGRUSLSA-N 1 3 339.911 2.971 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@@H](C)CNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001381527890 1348332137 /nfs/dbraw/zinc/33/21/37/1348332137.db2.gz FWBVBDSQBYARJK-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@@H](C)CNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001381527890 1348332140 /nfs/dbraw/zinc/33/21/40/1348332140.db2.gz FWBVBDSQBYARJK-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(C)c(F)c1 ZINC001381528209 1348332403 /nfs/dbraw/zinc/33/24/03/1348332403.db2.gz DTCIFKFYCWTSSF-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(C)c(F)c1 ZINC001381528209 1348332407 /nfs/dbraw/zinc/33/24/07/1348332407.db2.gz DTCIFKFYCWTSSF-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[N@H+](C)CC[C@@H]1CCCC1(F)F ZINC001381529235 1348332870 /nfs/dbraw/zinc/33/28/70/1348332870.db2.gz CFGDHLGLYNVHFY-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)C1CCC1)[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC001381529235 1348332873 /nfs/dbraw/zinc/33/28/73/1348332873.db2.gz CFGDHLGLYNVHFY-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@H+](C)Cc1cccc2cccnc21)N(C)C ZINC001381533408 1348335783 /nfs/dbraw/zinc/33/57/83/1348335783.db2.gz KVPJSHJMLDPICT-MAUKXSAKSA-N 1 3 342.487 2.512 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@@H+](C)Cc1cccc2cccnc21)N(C)C ZINC001381533408 1348335786 /nfs/dbraw/zinc/33/57/86/1348335786.db2.gz KVPJSHJMLDPICT-MAUKXSAKSA-N 1 3 342.487 2.512 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[N@H+](C)CC1CC2(CCC2)C1 ZINC001381582547 1348377817 /nfs/dbraw/zinc/37/78/17/1348377817.db2.gz KOAYPJMBJZXTRF-INIZCTEOSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[N@@H+](C)CC1CC2(CCC2)C1 ZINC001381582547 1348377819 /nfs/dbraw/zinc/37/78/19/1348377819.db2.gz KOAYPJMBJZXTRF-INIZCTEOSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)[C@@H]1CCCCN1C)[NH2+]Cc1ccccn1 ZINC001381717959 1348474658 /nfs/dbraw/zinc/47/46/58/1348474658.db2.gz ZSUMOMQMMBKCSS-OALUTQOASA-N 1 3 346.519 2.529 10 0 EFAEHO CC[C@@H](C(=O)NC1(C[NH2+]Cc2ncccc2C)CCCCC1)N(C)C ZINC001381736028 1348488597 /nfs/dbraw/zinc/48/85/97/1348488597.db2.gz OCOPPAHIJFMBEK-SFHVURJKSA-N 1 3 346.519 2.639 10 0 EFAEHO CN(C/C=C\Cl)C1CCN(C(=O)C(C)(C)[NH+]2CCCC2)CC1 ZINC001381980614 1348636893 /nfs/dbraw/zinc/63/68/93/1348636893.db2.gz FBSQZDJYOUAJGG-TWGQIWQCSA-N 1 3 327.900 2.536 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001382030323 1348672800 /nfs/dbraw/zinc/67/28/00/1348672800.db2.gz BKWCRUCANDHQSU-WOJBJXKFSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001382131516 1348752095 /nfs/dbraw/zinc/75/20/95/1348752095.db2.gz ZIPBRENCOXVCSF-IRXDYDNUSA-N 1 3 343.515 2.842 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1cccc(OC)c1 ZINC001382160475 1348782381 /nfs/dbraw/zinc/78/23/81/1348782381.db2.gz BKEHNUOTOKOYLI-QFBILLFUSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@@H](NCc2ccc(C)nc2C)C[C@H]1C ZINC001382321659 1348869780 /nfs/dbraw/zinc/86/97/80/1348869780.db2.gz ZPMPBJQUERZRLG-APWZRJJASA-N 1 3 346.519 2.509 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@@H](NCc2ccc(C)nc2C)C[C@H]1C ZINC001382321659 1348869785 /nfs/dbraw/zinc/86/97/85/1348869785.db2.gz ZPMPBJQUERZRLG-APWZRJJASA-N 1 3 346.519 2.509 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]Cc2sccc2Cl)C1 ZINC001420006104 1376267566 /nfs/dbraw/zinc/26/75/66/1376267566.db2.gz AOALPZRVWRJJPN-ZDUSSCGKSA-N 1 3 343.924 2.680 10 0 EFAEHO CC(C)N(CC[N@H+](C)CCc1ccccc1)C(=O)CN1CC[C@@H](C)C1 ZINC001382505924 1348972601 /nfs/dbraw/zinc/97/26/01/1348972601.db2.gz KZFYOSCHGNIQGG-LJQANCHMSA-N 1 3 345.531 2.740 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CCc1ccccc1)C(=O)CN1CC[C@@H](C)C1 ZINC001382505924 1348972602 /nfs/dbraw/zinc/97/26/02/1348972602.db2.gz KZFYOSCHGNIQGG-LJQANCHMSA-N 1 3 345.531 2.740 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@H](CNCc1ccccn1)C(C)(C)C ZINC001382538962 1349005488 /nfs/dbraw/zinc/00/54/88/1349005488.db2.gz YEPQPDQZYKPJCX-QZTJIDSGSA-N 1 3 346.519 2.577 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@H](CNCc1ccccn1)C(C)(C)C ZINC001382538962 1349005492 /nfs/dbraw/zinc/00/54/92/1349005492.db2.gz YEPQPDQZYKPJCX-QZTJIDSGSA-N 1 3 346.519 2.577 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C1CC[NH+](CCCC(C)C)CC1 ZINC001382550422 1349012376 /nfs/dbraw/zinc/01/23/76/1349012376.db2.gz FPOBRXOVSBOSLN-OAHLLOKOSA-N 1 3 334.508 2.914 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+][C@@H](C)c2cccc(F)c2)C1 ZINC001382589534 1349036655 /nfs/dbraw/zinc/03/66/55/1349036655.db2.gz MDWYLJJYNRHGAU-NNGSBXSVSA-N 1 3 335.467 2.806 10 0 EFAEHO CC(C)CC[N@@H+]1CCCCC[C@H]1CNC(=O)[C@H](C(C)C)N(C)C ZINC001394212801 1357602597 /nfs/dbraw/zinc/60/25/97/1357602597.db2.gz RUSRZQXLBOKCMR-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[N@H+]1CCCCC[C@H]1CNC(=O)[C@H](C(C)C)N(C)C ZINC001394212801 1357602601 /nfs/dbraw/zinc/60/26/01/1357602601.db2.gz RUSRZQXLBOKCMR-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO CN(C[C@H]1CCN1[C@@H]1CCc2ccccc21)C(=O)CCC[NH+](C)C ZINC001388650187 1352889415 /nfs/dbraw/zinc/88/94/15/1352889415.db2.gz URKUZANSDRBSNJ-IEBWSBKVSA-N 1 3 329.488 2.548 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@H]([NH2+][C@H]2CCc3ccccc32)C1)N(C)C ZINC001388728268 1352955437 /nfs/dbraw/zinc/95/54/37/1352955437.db2.gz ZQNXGRVYKOLTOS-LWCVALJOSA-N 1 3 343.515 2.745 10 0 EFAEHO CCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@H](C(C)C)[NH+]2CCCC2)C1 ZINC001388746491 1352973373 /nfs/dbraw/zinc/97/33/73/1352973373.db2.gz JEHSYPVZTIPIQT-ZCNNSNEGSA-N 1 3 343.515 2.711 10 0 EFAEHO Cc1cncc(C[NH2+][C@H]2CCCCCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001388786358 1353014321 /nfs/dbraw/zinc/01/43/21/1353014321.db2.gz BLPNJDYUFOCHNX-IBGZPJMESA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@@H](C(=O)N1C[C@H]2CCN(C/C=C\Cl)C[C@H]2C1)[NH+](CC)CC ZINC001388792620 1353022396 /nfs/dbraw/zinc/02/23/96/1353022396.db2.gz IHZOOPGQHHVLFW-JSNXIEERSA-N 1 3 341.927 2.640 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCCC[C@@H](NCc2ccccc2F)C1 ZINC001388807398 1353037091 /nfs/dbraw/zinc/03/70/91/1353037091.db2.gz PAIOILTYTUPJBA-QGZVFWFLSA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CCCc2ccccc2)[C@@H]1C)N(C)C ZINC001388823196 1353055744 /nfs/dbraw/zinc/05/57/44/1353055744.db2.gz QCHMUVVCHFJMDQ-HOJAQTOUSA-N 1 3 345.531 2.784 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CCCc2ccccc2)[C@@H]1C)N(C)C ZINC001388823196 1353055752 /nfs/dbraw/zinc/05/57/52/1353055752.db2.gz QCHMUVVCHFJMDQ-HOJAQTOUSA-N 1 3 345.531 2.784 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@H+](C/C=C\Cl)CC(C)(C)C1)N(C)C ZINC001388834695 1353072356 /nfs/dbraw/zinc/07/23/56/1353072356.db2.gz FVVTZLNXXICENK-UEDYQVLESA-N 1 3 329.916 2.686 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@@H+](C/C=C\Cl)CC(C)(C)C1)N(C)C ZINC001388834695 1353072358 /nfs/dbraw/zinc/07/23/58/1353072358.db2.gz FVVTZLNXXICENK-UEDYQVLESA-N 1 3 329.916 2.686 10 0 EFAEHO Cc1cc(CN(C)C[C@@H]2CCCCN2C(=O)CC[NH+](C)C)cs1 ZINC001388836705 1353075760 /nfs/dbraw/zinc/07/57/60/1353075760.db2.gz OCBBYCCZICLLHO-KRWDZBQOSA-N 1 3 337.533 2.821 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c(C)c1 ZINC001389462988 1353408614 /nfs/dbraw/zinc/40/86/14/1353408614.db2.gz QVMRNAOIFOYACW-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c(C)c1 ZINC001389462988 1353408617 /nfs/dbraw/zinc/40/86/17/1353408617.db2.gz QVMRNAOIFOYACW-WOJBJXKFSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC12CC[NH+](Cc1ccc(F)cc1)CC2)N(C)C ZINC001389528434 1353456079 /nfs/dbraw/zinc/45/60/79/1353456079.db2.gz UQQIYAGKSBRTPF-MSOLQXFVSA-N 1 3 347.478 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC12CC[NH+](Cc1cccc(F)c1)CC2 ZINC001389530156 1353457133 /nfs/dbraw/zinc/45/71/33/1353457133.db2.gz PFRIKIQICUKLBH-SFHVURJKSA-N 1 3 347.478 2.637 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@@H](NCc2ccccc2F)C2CC2)CC[N@@H+]1C ZINC001389665474 1353539685 /nfs/dbraw/zinc/53/96/85/1353539685.db2.gz UKWNYTAXXZDMEP-URLQWDBASA-N 1 3 347.478 2.540 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NC[C@@H](NCc2ccccc2F)C2CC2)CC[N@H+]1C ZINC001389665474 1353539694 /nfs/dbraw/zinc/53/96/94/1353539694.db2.gz UKWNYTAXXZDMEP-URLQWDBASA-N 1 3 347.478 2.540 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]([NH2+]CC1CCC2(CC2)CC1)C1CC1)N(C)C ZINC001389686936 1353554735 /nfs/dbraw/zinc/55/47/35/1353554735.db2.gz GFMPMPUWIRAACP-MSOLQXFVSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]CC1CCC2(CC2)CC1)C1CC1)N(C)C ZINC001389686957 1353554882 /nfs/dbraw/zinc/55/48/82/1353554882.db2.gz GFMPMPUWIRAACP-ZWKOTPCHSA-N 1 3 335.536 2.781 10 0 EFAEHO CCC(CC)C[NH2+][C@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001389806546 1353628225 /nfs/dbraw/zinc/62/82/25/1353628225.db2.gz YJEXWDLSWNROPV-LPHOPBHVSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC(C)(C)C)C[C@H]21)N1CCCCCC1 ZINC001394334028 1357709044 /nfs/dbraw/zinc/70/90/44/1357709044.db2.gz MUDNGRSDZQSECJ-CADBVGFASA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCC(C)(C)C)C[C@H]21)N1CCCCCC1 ZINC001394334028 1357709048 /nfs/dbraw/zinc/70/90/48/1357709048.db2.gz MUDNGRSDZQSECJ-CADBVGFASA-N 1 3 349.563 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@H]2CCc3ccc(Cl)cc32)C1 ZINC001389900902 1353676777 /nfs/dbraw/zinc/67/67/77/1353676777.db2.gz PHAXOKUHFCEKRS-BQFCYCMXSA-N 1 3 349.906 2.906 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2cccc(Cl)c2F)C1 ZINC001389908956 1353682688 /nfs/dbraw/zinc/68/26/88/1353682688.db2.gz QZPWNGGOVPNVRU-HDJSIYSDSA-N 1 3 341.858 2.556 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)cc2F)C1 ZINC001390001753 1353734624 /nfs/dbraw/zinc/73/46/24/1353734624.db2.gz BYCALNGSRUCPIZ-YUELXQCFSA-N 1 3 339.430 2.604 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+][C@H]1C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001390008516 1353739260 /nfs/dbraw/zinc/73/92/60/1353739260.db2.gz IEAOZJWBEORQFT-VXIBKDFQSA-N 1 3 331.504 2.879 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]CC[C@@H]2CCc3ccccc32)C1 ZINC001390040001 1353759775 /nfs/dbraw/zinc/75/97/75/1353759775.db2.gz VEBSVWUTWPJZHH-GBESFXJTSA-N 1 3 343.515 2.684 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001390063571 1353776943 /nfs/dbraw/zinc/77/69/43/1353776943.db2.gz NSDHHPSNSMMFEA-QZTJIDSGSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)CCC[N@H+]1CCC[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001390063571 1353776945 /nfs/dbraw/zinc/77/69/45/1353776945.db2.gz NSDHHPSNSMMFEA-QZTJIDSGSA-N 1 3 325.541 2.837 10 0 EFAEHO CCc1cccc(C[N@H+]2CCC[C@H](CNC(=O)[C@@H](CC)N(C)C)C2)c1 ZINC001390067049 1353780851 /nfs/dbraw/zinc/78/08/51/1353780851.db2.gz RFHLNSTVDDRBOH-WOJBJXKFSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1cccc(C[N@@H+]2CCC[C@H](CNC(=O)[C@@H](CC)N(C)C)C2)c1 ZINC001390067049 1353780855 /nfs/dbraw/zinc/78/08/55/1353780855.db2.gz RFHLNSTVDDRBOH-WOJBJXKFSA-N 1 3 345.531 2.917 10 0 EFAEHO CN(C)C1(C(=O)NC2CCC([NH2+]CC3CC(C)(C)C3)CC2)CCC1 ZINC001390275578 1353972120 /nfs/dbraw/zinc/97/21/20/1353972120.db2.gz URVUPAKOXBYHAD-UHFFFAOYSA-N 1 3 335.536 2.924 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001390396003 1354061901 /nfs/dbraw/zinc/06/19/01/1354061901.db2.gz CVHYNUPZGPXMFF-WMLDXEAASA-N 1 3 337.895 2.809 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001390395992 1354062082 /nfs/dbraw/zinc/06/20/82/1354062082.db2.gz CVHYNUPZGPXMFF-PBHICJAKSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+][C@@H](C)c1ccc(F)cc1 ZINC001390453396 1354090074 /nfs/dbraw/zinc/09/00/74/1354090074.db2.gz AITAEHXIOAPIBQ-CABCVRRESA-N 1 3 335.467 2.855 10 0 EFAEHO C[C@@H]([NH2+][C@@H](C)CNC(=O)C(C)(C)N1CCCC1)c1ccc(F)cc1 ZINC001390453403 1354090522 /nfs/dbraw/zinc/09/05/22/1354090522.db2.gz AITAEHXIOAPIBQ-LSDHHAIUSA-N 1 3 335.467 2.855 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2cccc(C(C)C)n2)C1)N(C)C ZINC001394855301 1358161609 /nfs/dbraw/zinc/16/16/09/1358161609.db2.gz UFTBYPLMCKVARI-FAFZWHIHSA-N 1 3 346.519 2.624 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C ZINC001390502492 1354130680 /nfs/dbraw/zinc/13/06/80/1354130680.db2.gz CWMQSMHDBHUBID-DNVCBOLYSA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N1CC[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001390584568 1354188013 /nfs/dbraw/zinc/18/80/13/1354188013.db2.gz RKMATGITEITSRG-QNOFEFNMSA-N 1 3 348.318 2.616 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N1CC[C@H](CNC/C(Cl)=C\Cl)C1 ZINC001390584568 1354188015 /nfs/dbraw/zinc/18/80/15/1354188015.db2.gz RKMATGITEITSRG-QNOFEFNMSA-N 1 3 348.318 2.616 10 0 EFAEHO COc1cccc(C[NH2+][C@@H]2CCC[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001390613721 1354208969 /nfs/dbraw/zinc/20/89/69/1354208969.db2.gz TVLYJRUBRLTACU-MSOLQXFVSA-N 1 3 347.503 2.552 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](C)CCNC(=O)[C@H](C(C)C)N(C)C)c1 ZINC001390676833 1354269272 /nfs/dbraw/zinc/26/92/72/1354269272.db2.gz MMDWEFSETIKRBH-QAPCUYQASA-N 1 3 337.483 2.705 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccccc1Cl ZINC001390699646 1354291243 /nfs/dbraw/zinc/29/12/43/1354291243.db2.gz BODHVSZYXRNLDO-CABCVRRESA-N 1 3 337.895 2.666 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccccc1C1CC1 ZINC001390699258 1354291614 /nfs/dbraw/zinc/29/16/14/1354291614.db2.gz AJGWDVCKPIPZCD-DLBZAZTESA-N 1 3 343.515 2.890 10 0 EFAEHO Cc1cccnc1C[NH2+][C@@H](C)CCNC(=O)[C@H]1CCCCN1C(C)C ZINC001390708493 1354299622 /nfs/dbraw/zinc/29/96/22/1354299622.db2.gz ZPFODYXTBOBJHT-PKOBYXMFSA-N 1 3 346.519 2.637 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]CC1CCC(F)(F)CC1 ZINC001390711233 1354302380 /nfs/dbraw/zinc/30/23/80/1354302380.db2.gz ZHMASZRASVUBJP-GJZGRUSLSA-N 1 3 345.478 2.638 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]Cc1cccc(C)c1 ZINC001390739269 1354329169 /nfs/dbraw/zinc/32/91/69/1354329169.db2.gz ZYTHJEIPRBFRKD-HKUYNNGSSA-N 1 3 331.504 2.854 10 0 EFAEHO CN(CCNC(=O)C12CC[NH+](CC1)C2)Cc1ccc(C(C)(C)C)cc1 ZINC001390844456 1354428171 /nfs/dbraw/zinc/42/81/71/1354428171.db2.gz KQLGPCBHOPEEGQ-UHFFFAOYSA-N 1 3 343.515 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[N@H+](C)Cc1ccc(F)cc1 ZINC001397805424 1360157449 /nfs/dbraw/zinc/15/74/49/1360157449.db2.gz MXQPFSOSCNCCCI-IBGZPJMESA-N 1 3 349.494 2.979 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1C[N@@H+](C)Cc1ccc(F)cc1 ZINC001397805424 1360157452 /nfs/dbraw/zinc/15/74/52/1360157452.db2.gz MXQPFSOSCNCCCI-IBGZPJMESA-N 1 3 349.494 2.979 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C1CC1)[C@@H]1CCc2c1cccc2F ZINC001391202588 1354930849 /nfs/dbraw/zinc/93/08/49/1354930849.db2.gz ZZLPDFGKBVCUIP-LJQANCHMSA-N 1 3 347.478 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C1CC1)[C@@H]1CCc2c1cccc2F ZINC001391202588 1354930850 /nfs/dbraw/zinc/93/08/50/1354930850.db2.gz ZZLPDFGKBVCUIP-LJQANCHMSA-N 1 3 347.478 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+]CC1CCCC1)c1ccccc1 ZINC001391243263 1354966390 /nfs/dbraw/zinc/96/63/90/1354966390.db2.gz KDIUTMUAWIUSSF-LJQANCHMSA-N 1 3 331.504 2.964 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001391299106 1355039721 /nfs/dbraw/zinc/03/97/21/1355039721.db2.gz NJADGMXPJZCXFQ-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001391299106 1355039722 /nfs/dbraw/zinc/03/97/22/1355039722.db2.gz NJADGMXPJZCXFQ-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CCc1ccc(C[N@@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)cc1 ZINC001391340529 1355097202 /nfs/dbraw/zinc/09/72/02/1355097202.db2.gz VAFDJMIUKNKMDL-FQEVSTJZSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccc(C[N@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)cc1 ZINC001391340529 1355097208 /nfs/dbraw/zinc/09/72/08/1355097208.db2.gz VAFDJMIUKNKMDL-FQEVSTJZSA-N 1 3 345.531 2.917 10 0 EFAEHO CC[C@@H](F)CN(C)C[C@@H]1CCN(C(=O)C2CC[NH+](C(C)C)CC2)C1 ZINC001391348636 1355106265 /nfs/dbraw/zinc/10/62/65/1355106265.db2.gz CNTXUJWXFPLVGB-FUHWJXTLSA-N 1 3 341.515 2.635 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[N@H+](C)CC2CCC(C)CC2)C1 ZINC001391350294 1355108881 /nfs/dbraw/zinc/10/88/81/1355108881.db2.gz CUWIMPGDNIEXSA-CTWPCTMYSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[N@@H+](C)CC2CCC(C)CC2)C1 ZINC001391350294 1355108883 /nfs/dbraw/zinc/10/88/83/1355108883.db2.gz CUWIMPGDNIEXSA-CTWPCTMYSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)N1CC[C@@H](CN(C)C/C=C/Cl)C1 ZINC001391354582 1355116583 /nfs/dbraw/zinc/11/65/83/1355116583.db2.gz IMQCMNMOLXCSSX-RUZMYDRRSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)N1CC[C@@H](CN(C)C/C=C/Cl)C1 ZINC001391354582 1355116585 /nfs/dbraw/zinc/11/65/85/1355116585.db2.gz IMQCMNMOLXCSSX-RUZMYDRRSA-N 1 3 341.927 2.782 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)CC[C@H]3CCC[N@H+]3C)C2)cc1C ZINC001391485840 1355238017 /nfs/dbraw/zinc/23/80/17/1355238017.db2.gz GTQVPLDZJLYQEG-HXUWFJFHSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1ccc(CN2CC(CNC(=O)CC[C@H]3CCC[N@@H+]3C)C2)cc1C ZINC001391485840 1355238021 /nfs/dbraw/zinc/23/80/21/1355238021.db2.gz GTQVPLDZJLYQEG-HXUWFJFHSA-N 1 3 343.515 2.726 10 0 EFAEHO CCN(C(=O)[C@H](C)N1CCCCCC1)[C@@H]1CC[N@H+](CC2CCC2)C1 ZINC001391657678 1355410072 /nfs/dbraw/zinc/41/00/72/1355410072.db2.gz TZADEJOCCNWALS-PKOBYXMFSA-N 1 3 335.536 2.974 10 0 EFAEHO CCN(C(=O)[C@H](C)N1CCCCCC1)[C@@H]1CC[N@@H+](CC2CCC2)C1 ZINC001391657678 1355410074 /nfs/dbraw/zinc/41/00/74/1355410074.db2.gz TZADEJOCCNWALS-PKOBYXMFSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](CC)[NH2+]Cc1cccc(C)c1 ZINC001391695899 1355441640 /nfs/dbraw/zinc/44/16/40/1355441640.db2.gz VVNLKGHJRJKKIW-RBUKOAKNSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@@H](CNC(=O)C12CCC[NH+]1CCC2)NCc1cc(C)ccc1F ZINC001391705081 1355450352 /nfs/dbraw/zinc/45/03/52/1355450352.db2.gz VBCKUZGTYVDNGA-KRWDZBQOSA-N 1 3 347.478 2.747 10 0 EFAEHO CC[C@@H](CNC(=O)CC[NH+](C)C)NCc1ccc(Cl)cc1Cl ZINC001391716710 1355460158 /nfs/dbraw/zinc/46/01/58/1355460158.db2.gz CJLVIWMDLPMUAB-AWEZNQCLSA-N 1 3 346.302 2.930 10 0 EFAEHO CC[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCC1 ZINC001391721701 1355465352 /nfs/dbraw/zinc/46/53/52/1355465352.db2.gz QQQFRZOJIJZKRP-VQIMIIECSA-N 1 3 341.515 2.874 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(Cl)s1 ZINC001391754410 1355499212 /nfs/dbraw/zinc/49/92/12/1355499212.db2.gz RTJAJLMUKBSMTN-LBPRGKRZSA-N 1 3 331.913 2.726 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC2(C[NH2+]CC3CC3)CCCC2)C1 ZINC001391767620 1355511953 /nfs/dbraw/zinc/51/19/53/1355511953.db2.gz CQJVMEDEUNZDRX-IBGZPJMESA-N 1 3 339.499 2.628 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@](C)(NC(=O)CN2CC[C@H](C)C2)C2CC2)cc1 ZINC001391809658 1355552859 /nfs/dbraw/zinc/55/28/59/1355552859.db2.gz GUEIFNOFKGZFLV-UWJYYQICSA-N 1 3 343.515 2.711 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@@](C)(C[NH2+]Cc2ccccc2F)C2CC2)C1 ZINC001391821784 1355565649 /nfs/dbraw/zinc/56/56/49/1355565649.db2.gz WFBZLNJQKHRZKG-YWZLYKJASA-N 1 3 347.478 2.542 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H]1CNCc1ncccc1C)[NH+](CC)CC ZINC001391864081 1355603346 /nfs/dbraw/zinc/60/33/46/1355603346.db2.gz HGUSQWOKGSQHKB-MJGOQNOKSA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)CNC(=O)CN(C)CC(C)(C)C)c(C)n1 ZINC001391941786 1355667271 /nfs/dbraw/zinc/66/72/71/1355667271.db2.gz WJFQSQFLQPLWOB-HNNXBMFYSA-N 1 3 348.535 2.518 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(Cl)c(F)c1)N(C)C ZINC001392081534 1355755143 /nfs/dbraw/zinc/75/51/43/1355755143.db2.gz XPEQKYBTCFQSBS-BLLLJJGKSA-N 1 3 343.874 2.756 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](CC(C)C)NC(=O)[C@H]2CC[N@H+](C)C2)c1 ZINC001392158157 1355812507 /nfs/dbraw/zinc/81/25/07/1355812507.db2.gz HXPQIECFOLBCQZ-FUHWJXTLSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](CC(C)C)NC(=O)[C@H]2CC[N@@H+](C)C2)c1 ZINC001392158157 1355812511 /nfs/dbraw/zinc/81/25/11/1355812511.db2.gz HXPQIECFOLBCQZ-FUHWJXTLSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C[NH2+]CC1CC(C)(C)C1)CC(C)C ZINC001392171898 1355825922 /nfs/dbraw/zinc/82/59/22/1355825922.db2.gz VMHBBZVIXYLFHE-MRXNPFEDSA-N 1 3 334.508 2.817 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H](C)[NH2+]Cc2ccc(F)cc2)C1 ZINC001392188617 1355843113 /nfs/dbraw/zinc/84/31/13/1355843113.db2.gz JREBYAZUWYZMMY-WMZOPIPTSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H](C(C)C)N(C)C)[NH2+]CC1CC2(CCC2)C1 ZINC001392221424 1355875829 /nfs/dbraw/zinc/87/58/29/1355875829.db2.gz CQLFENKCPINEKQ-ROUUACIJSA-N 1 3 337.552 2.883 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccc(F)cc1 ZINC001392225679 1355879286 /nfs/dbraw/zinc/87/92/86/1355879286.db2.gz XZCHAFQDTHKAGE-MOPGFXCFSA-N 1 3 349.494 2.929 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2cccc(C)c2)CC[N@@H+]1C ZINC001392278264 1355933342 /nfs/dbraw/zinc/93/33/42/1355933342.db2.gz FDHDWESWFUTXCQ-RBUKOAKNSA-N 1 3 331.504 2.616 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2cccc(C)c2)CC[N@H+]1C ZINC001392278264 1355933344 /nfs/dbraw/zinc/93/33/44/1355933344.db2.gz FDHDWESWFUTXCQ-RBUKOAKNSA-N 1 3 331.504 2.616 10 0 EFAEHO CN(CCc1ccccc1F)CCN(C)C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001392286458 1355942976 /nfs/dbraw/zinc/94/29/76/1355942976.db2.gz XWTLZXDAPRGFNE-SFHVURJKSA-N 1 3 349.494 2.633 10 0 EFAEHO CN(CCc1ccccc1F)CCN(C)C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001392286458 1355942977 /nfs/dbraw/zinc/94/29/77/1355942977.db2.gz XWTLZXDAPRGFNE-SFHVURJKSA-N 1 3 349.494 2.633 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[N@H+](C)CC[C@H]2CCCC2(F)F)C1 ZINC001392316335 1355976486 /nfs/dbraw/zinc/97/64/86/1355976486.db2.gz VXQXZVWRMVUYPT-JKSUJKDBSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[N@@H+](C)CC[C@H]2CCCC2(F)F)C1 ZINC001392316335 1355976487 /nfs/dbraw/zinc/97/64/87/1355976487.db2.gz VXQXZVWRMVUYPT-JKSUJKDBSA-N 1 3 345.478 2.544 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]C[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001392591715 1356143069 /nfs/dbraw/zinc/14/30/69/1356143069.db2.gz LHEAOPKLFAXQDV-ROUUACIJSA-N 1 3 345.531 2.821 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C[C@H](C)NC(=O)CN(C)C(C)C ZINC001392614596 1356161818 /nfs/dbraw/zinc/16/18/18/1356161818.db2.gz AGKPRYQOSMDQPI-AWEZNQCLSA-N 1 3 325.884 2.583 10 0 EFAEHO COc1ccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CCC[N@@H+]2C(C)C)cc1 ZINC001392652552 1356199111 /nfs/dbraw/zinc/19/91/11/1356199111.db2.gz FUPRPKNJQNRGLZ-VQIMIIECSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(CN(C)C[C@@H](C)NC(=O)[C@H]2CCC[N@H+]2C(C)C)cc1 ZINC001392652552 1356199113 /nfs/dbraw/zinc/19/91/13/1356199113.db2.gz FUPRPKNJQNRGLZ-VQIMIIECSA-N 1 3 347.503 2.505 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001392683059 1356231537 /nfs/dbraw/zinc/23/15/37/1356231537.db2.gz HMSQZPRIZORVRF-KXBFYZLASA-N 1 3 345.531 2.890 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001392683059 1356231540 /nfs/dbraw/zinc/23/15/40/1356231540.db2.gz HMSQZPRIZORVRF-KXBFYZLASA-N 1 3 345.531 2.890 10 0 EFAEHO C[C@H](C[N@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001392691406 1356242895 /nfs/dbraw/zinc/24/28/95/1356242895.db2.gz ZQHMVKTYIGOERP-IAGOWNOFSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](C[N@@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001392691406 1356242898 /nfs/dbraw/zinc/24/28/98/1356242898.db2.gz ZQHMVKTYIGOERP-IAGOWNOFSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)Cc1ccc2ncccc2c1)N(C)C ZINC001392726710 1356285283 /nfs/dbraw/zinc/28/52/83/1356285283.db2.gz YYYYAFQJPDEXRX-HNAYVOBHSA-N 1 3 342.487 2.512 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc2ncccc2c1)N(C)C ZINC001392726710 1356285287 /nfs/dbraw/zinc/28/52/87/1356285287.db2.gz YYYYAFQJPDEXRX-HNAYVOBHSA-N 1 3 342.487 2.512 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@H+](C)Cc1ccc2ncccc2c1)N(C)C ZINC001392726706 1356285557 /nfs/dbraw/zinc/28/55/57/1356285557.db2.gz YYYYAFQJPDEXRX-DNVCBOLYSA-N 1 3 342.487 2.512 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@@H+](C)Cc1ccc2ncccc2c1)N(C)C ZINC001392726706 1356285560 /nfs/dbraw/zinc/28/55/60/1356285560.db2.gz YYYYAFQJPDEXRX-DNVCBOLYSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)(C(=O)N[C@H](C[NH2+]CC1CCCCC1)C1CC1)N1CCCC1 ZINC001392782830 1356323209 /nfs/dbraw/zinc/32/32/09/1356323209.db2.gz HHRVHXKWEGWBNK-GOSISDBHSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)C/C=C/c2ccccc2)CC[N@@H+]1C ZINC001401745696 1363079468 /nfs/dbraw/zinc/07/94/68/1363079468.db2.gz CCKLFELOYBSPAQ-BUHLVJSKSA-N 1 3 343.515 2.867 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)C/C=C/c2ccccc2)CC[N@H+]1C ZINC001401745696 1363079470 /nfs/dbraw/zinc/07/94/70/1363079470.db2.gz CCKLFELOYBSPAQ-BUHLVJSKSA-N 1 3 343.515 2.867 10 0 EFAEHO CN(CC(=O)NCC1([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1)CC(C)(C)C ZINC001392933810 1356443922 /nfs/dbraw/zinc/44/39/22/1356443922.db2.gz ZPSHKFJTDVPRIG-ZACQAIPSSA-N 1 3 335.536 2.639 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001392942152 1356451768 /nfs/dbraw/zinc/45/17/68/1356451768.db2.gz ZUPJUTWJESSBMJ-ROUUACIJSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001392942152 1356451771 /nfs/dbraw/zinc/45/17/71/1356451771.db2.gz ZUPJUTWJESSBMJ-ROUUACIJSA-N 1 3 345.462 2.581 10 0 EFAEHO CCCN(C)CC(=O)NCC1([NH2+][C@@H](C)c2cccc(Cl)c2)CC1 ZINC001392949315 1356457814 /nfs/dbraw/zinc/45/78/14/1356457814.db2.gz LHGCOECBFQIZLD-AWEZNQCLSA-N 1 3 337.895 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H]2CC[N@H+](C[C@@H](F)CC)C2)CC1 ZINC001392971740 1356478660 /nfs/dbraw/zinc/47/86/60/1356478660.db2.gz RSUPAJBLDXHEPJ-ROUUACIJSA-N 1 3 341.515 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H]2CC[N@@H+](C[C@@H](F)CC)C2)CC1 ZINC001392971740 1356478663 /nfs/dbraw/zinc/47/86/63/1356478663.db2.gz RSUPAJBLDXHEPJ-ROUUACIJSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N(C)CCNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001492816918 1356479721 /nfs/dbraw/zinc/47/97/21/1356479721.db2.gz MPCWNSIYOXQSTE-YJBOKZPZSA-N 1 3 335.467 2.667 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N(C)CCNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001492816918 1356479728 /nfs/dbraw/zinc/47/97/28/1356479728.db2.gz MPCWNSIYOXQSTE-YJBOKZPZSA-N 1 3 335.467 2.667 10 0 EFAEHO CC[C@H](C(=O)N1CCC([N@H+](CC[C@@H](C)F)CC2CC2)CC1)N(C)C ZINC001392976391 1356483740 /nfs/dbraw/zinc/48/37/40/1356483740.db2.gz VBEWQBMWJNUQNC-CRAIPNDOSA-N 1 3 341.515 2.778 10 0 EFAEHO CC[C@H](C(=O)N1CCC([N@@H+](CC[C@@H](C)F)CC2CC2)CC1)N(C)C ZINC001392976391 1356483743 /nfs/dbraw/zinc/48/37/43/1356483743.db2.gz VBEWQBMWJNUQNC-CRAIPNDOSA-N 1 3 341.515 2.778 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCCC(C)(C)C)C1 ZINC001392982998 1356488794 /nfs/dbraw/zinc/48/87/94/1356488794.db2.gz ZQDCUAMYILCDCD-KURKYZTESA-N 1 3 335.536 2.830 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCCC(C)(C)C)C1 ZINC001392982998 1356488799 /nfs/dbraw/zinc/48/87/99/1356488799.db2.gz ZQDCUAMYILCDCD-KURKYZTESA-N 1 3 335.536 2.830 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC1(C)CC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001393071497 1356558983 /nfs/dbraw/zinc/55/89/83/1356558983.db2.gz WOUSGAGXBAAZNY-IXDOHACOSA-N 1 3 344.503 2.668 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@]1(C)CCN([C@@H]2CCCc3ccc(F)cc32)C1 ZINC001393107336 1356602580 /nfs/dbraw/zinc/60/25/80/1356602580.db2.gz LPHXZCXMAVYSAA-QUCCMNQESA-N 1 3 347.478 2.735 10 0 EFAEHO CC[C@@H](F)C[NH+]1CCC(C)(CNC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001402197696 1363505825 /nfs/dbraw/zinc/50/58/25/1363505825.db2.gz BLRCWFQLPIZQFF-CVEARBPZSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)(C(=O)NC[C@]1(C)CCC[N@H+](CCC2CC2)C1)N1CCCC1 ZINC001393192443 1356702078 /nfs/dbraw/zinc/70/20/78/1356702078.db2.gz IHRGOPPMPXYVLG-FQEVSTJZSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)(C(=O)NC[C@]1(C)CCC[N@@H+](CCC2CC2)C1)N1CCCC1 ZINC001393192443 1356702081 /nfs/dbraw/zinc/70/20/81/1356702081.db2.gz IHRGOPPMPXYVLG-FQEVSTJZSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@]1(C)CCC[N@H+](CCC2CC2)C1 ZINC001393201845 1356712576 /nfs/dbraw/zinc/71/25/76/1356712576.db2.gz GHULVTLATNIRFI-ICSRJNTNSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@]1(C)CCC[N@@H+](CCC2CC2)C1 ZINC001393201845 1356712580 /nfs/dbraw/zinc/71/25/80/1356712580.db2.gz GHULVTLATNIRFI-ICSRJNTNSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@@](C)(CNC(=O)C23CCC[NH+]2CCC3)C1 ZINC001393205898 1356718885 /nfs/dbraw/zinc/71/88/85/1356718885.db2.gz PVJAKARATPYLQD-AEFFLSMTSA-N 1 3 339.499 2.581 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@](C)(CNC(=O)C23CCC[NH+]2CCC3)C1 ZINC001393205934 1356718952 /nfs/dbraw/zinc/71/89/52/1356718952.db2.gz PVJAKARATPYLQD-SJLPKXTDSA-N 1 3 339.499 2.581 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H](C)[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001393385321 1356805598 /nfs/dbraw/zinc/80/55/98/1356805598.db2.gz GKCYIUJFVVCDHY-FUHWJXTLSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1C[NH2+]Cc1ccccc1 ZINC001393392738 1356812858 /nfs/dbraw/zinc/81/28/58/1356812858.db2.gz FKRHFCQLGVIZPG-HKUYNNGSSA-N 1 3 345.531 2.849 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]([NH2+]Cc2cccc(Cl)c2)C2CC2)C1 ZINC001402326949 1363607443 /nfs/dbraw/zinc/60/74/43/1363607443.db2.gz PLEADTBKBUUTDX-RDTXWAMCSA-N 1 3 349.906 2.666 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001393403380 1356822267 /nfs/dbraw/zinc/82/22/67/1356822267.db2.gz ZBJOSPFNMVTRKF-WMZOPIPTSA-N 1 3 349.494 2.658 10 0 EFAEHO Cc1cc(C[N@@H+]2C[C@H]3CN(C(=O)CN(C)C(C)C)C[C@H]3C2)c(C)s1 ZINC001393416148 1356831360 /nfs/dbraw/zinc/83/13/60/1356831360.db2.gz IWHWTXRPVKBIJT-HDICACEKSA-N 1 3 349.544 2.595 10 0 EFAEHO Cc1cc(C[N@H+]2C[C@H]3CN(C(=O)CN(C)C(C)C)C[C@H]3C2)c(C)s1 ZINC001393416148 1356831363 /nfs/dbraw/zinc/83/13/63/1356831363.db2.gz IWHWTXRPVKBIJT-HDICACEKSA-N 1 3 349.544 2.595 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@H]2CN(C(=O)CN3[C@H](C)CC[C@H]3C)C[C@H]2C1 ZINC001393419031 1356833800 /nfs/dbraw/zinc/83/38/00/1356833800.db2.gz RHTIMELYKZHUNL-MKXGPGLRSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@H]2CN(C(=O)CN3[C@H](C)CC[C@H]3C)C[C@H]2C1 ZINC001393419031 1356833804 /nfs/dbraw/zinc/83/38/04/1356833804.db2.gz RHTIMELYKZHUNL-MKXGPGLRSA-N 1 3 335.536 2.686 10 0 EFAEHO Cc1cc(F)ccc1CN1CC[C@H]2[C@H]1CCCN2C(=O)CC[NH+](C)C ZINC001393460808 1356861389 /nfs/dbraw/zinc/86/13/89/1356861389.db2.gz JTFOCSOWIVKSBC-MOPGFXCFSA-N 1 3 347.478 2.651 10 0 EFAEHO C[C@H](NC/C=C/Cl)c1ccc(CNC(=O)[C@H]2CC[N@H+](C)C2)cc1 ZINC001393484495 1356886900 /nfs/dbraw/zinc/88/69/00/1356886900.db2.gz CRRHBDNGMAIGJY-MHMWAKODSA-N 1 3 335.879 2.658 10 0 EFAEHO C[C@H](NC/C=C/Cl)c1ccc(CNC(=O)[C@H]2CC[N@@H+](C)C2)cc1 ZINC001393484495 1356886904 /nfs/dbraw/zinc/88/69/04/1356886904.db2.gz CRRHBDNGMAIGJY-MHMWAKODSA-N 1 3 335.879 2.658 10 0 EFAEHO C[C@H](NC/C=C\Cl)c1ccc(CNC(=O)[C@H]2CC[N@H+](C)C2)cc1 ZINC001393484500 1356886944 /nfs/dbraw/zinc/88/69/44/1356886944.db2.gz CRRHBDNGMAIGJY-YIOWFDGKSA-N 1 3 335.879 2.658 10 0 EFAEHO C[C@H](NC/C=C\Cl)c1ccc(CNC(=O)[C@H]2CC[N@@H+](C)C2)cc1 ZINC001393484500 1356886948 /nfs/dbraw/zinc/88/69/48/1356886948.db2.gz CRRHBDNGMAIGJY-YIOWFDGKSA-N 1 3 335.879 2.658 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCCCN2C(=O)CN(C)C(C)C)cc1 ZINC001393522960 1356917923 /nfs/dbraw/zinc/91/79/23/1356917923.db2.gz IIHNBNODXGYYAV-LJQANCHMSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccccc2C2CC2)C1 ZINC001394379293 1357751059 /nfs/dbraw/zinc/75/10/59/1357751059.db2.gz BODUWXGFFMPYOP-RUCARUNLSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+]CC2CCC(F)(F)CC2)C1 ZINC001394379300 1357751363 /nfs/dbraw/zinc/75/13/63/1357751363.db2.gz BPVSTOREIBHYHN-WKILWMFISA-N 1 3 345.478 2.637 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2cccc(C)c2)C1)N(C)C ZINC001394377985 1357749587 /nfs/dbraw/zinc/74/95/87/1357749587.db2.gz ZSFHNDMBVLIHKW-PSBWJHGTSA-N 1 3 331.504 2.881 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2cccc(Cl)c2)C1 ZINC001394397384 1357772064 /nfs/dbraw/zinc/77/20/64/1357772064.db2.gz YHJNMXYYWNATCN-JCNLHEQBSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2cccc(OC)c2)C1)N(C)C ZINC001394397799 1357772706 /nfs/dbraw/zinc/77/27/06/1357772706.db2.gz ZANBJKLMLKJYOS-RIVXBTQJSA-N 1 3 347.503 2.581 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)[C@@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001394425274 1357802643 /nfs/dbraw/zinc/80/26/43/1357802643.db2.gz DNWMNVIFHOVLCS-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](CN(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1)NC/C=C/Cl ZINC001394514819 1357897342 /nfs/dbraw/zinc/89/73/42/1357897342.db2.gz UINHEHQMPDAPGQ-ZHZWZMEUSA-N 1 3 329.916 2.828 10 0 EFAEHO C[C@@H](CN(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1)NC/C=C/Cl ZINC001394514819 1357897346 /nfs/dbraw/zinc/89/73/46/1357897346.db2.gz UINHEHQMPDAPGQ-ZHZWZMEUSA-N 1 3 329.916 2.828 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)[C@@H](C(C)C)[NH+](C)C)c1 ZINC001394522252 1357905379 /nfs/dbraw/zinc/90/53/79/1357905379.db2.gz SIPBFIQXTGZLIA-MAUKXSAKSA-N 1 3 337.483 2.657 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001394563434 1357957657 /nfs/dbraw/zinc/95/76/57/1357957657.db2.gz ATFDUARHJDEKCE-CQSZACIVSA-N 1 3 325.884 2.617 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(CF)cc1 ZINC001394570446 1357961977 /nfs/dbraw/zinc/96/19/77/1357961977.db2.gz ZAIMHHGBGXIFSE-VQIMIIECSA-N 1 3 349.494 2.967 10 0 EFAEHO C[C@H]1C[C@@H](NCc2ccc(Cl)c(F)c2)CN1C(=O)CC[NH+](C)C ZINC001394669239 1357986345 /nfs/dbraw/zinc/98/63/45/1357986345.db2.gz LTNDHOMMCORCFP-GXTWGEPZSA-N 1 3 341.858 2.510 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc3cc[nH]c3c2)[C@H]1C ZINC001394671615 1357988504 /nfs/dbraw/zinc/98/85/04/1357988504.db2.gz DIWFIJHIIPCDAP-QAPCUYQASA-N 1 3 342.487 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]CC3CCCC3)[C@H]2C1 ZINC001394684153 1358003093 /nfs/dbraw/zinc/00/30/93/1358003093.db2.gz GTDGOYNPPNLQKU-GBESFXJTSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]CC2CCC3(CC3)CC2)C[C@@H]1C ZINC001394690369 1358013369 /nfs/dbraw/zinc/01/33/69/1358013369.db2.gz ZOKSIUNLTSONIN-WMZOPIPTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)[NH2+][C@H](CCNC(=O)C1(N(C)C)CCC1)Cc1ccccc1 ZINC001394696189 1358020068 /nfs/dbraw/zinc/02/00/68/1358020068.db2.gz MGMVIFWYTLGNSM-GOSISDBHSA-N 1 3 331.504 2.586 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]Cc3ccccc3)[C@@H]2C1 ZINC001394697014 1358021896 /nfs/dbraw/zinc/02/18/96/1358021896.db2.gz ZAZNOGADQFWEDD-XUVXKRRUSA-N 1 3 343.515 2.745 10 0 EFAEHO CC[C@@H](F)CN[C@H]1CN(C(=O)C2CC[NH+](C(C)C)CC2)CC1(C)C ZINC001394716701 1358043747 /nfs/dbraw/zinc/04/37/47/1358043747.db2.gz XTCZGNGXJDSQOB-SJORKVTESA-N 1 3 341.515 2.682 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001394814827 1358107299 /nfs/dbraw/zinc/10/72/99/1358107299.db2.gz KDAPGHAIZDACQF-IRXDYDNUSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)(C)[C@@H](CNC/C(Cl)=C/Cl)NC(=O)C[NH+]1CCCC1 ZINC001394831395 1358131718 /nfs/dbraw/zinc/13/17/18/1358131718.db2.gz XELPQHOXFDSAKQ-LLBKUYECSA-N 1 3 336.307 2.522 10 0 EFAEHO CC(C)(C)[C@@H](C[NH2+]C/C(Cl)=C/Cl)NC(=O)CN1CCCC1 ZINC001394831395 1358131721 /nfs/dbraw/zinc/13/17/21/1358131721.db2.gz XELPQHOXFDSAKQ-LLBKUYECSA-N 1 3 336.307 2.522 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1ccc(F)cc1)C(C)(C)C)N(C)C ZINC001394837768 1358139436 /nfs/dbraw/zinc/13/94/36/1358139436.db2.gz UTPDEMBKKNACEZ-IAGOWNOFSA-N 1 3 337.483 2.786 10 0 EFAEHO CC(C)CCC[NH+]1CCC([C@@H](C)NC(=O)CN2CC[C@H](C)C2)CC1 ZINC001394841025 1358143121 /nfs/dbraw/zinc/14/31/21/1358143121.db2.gz PKYRXYHHXULZLQ-ZWKOTPCHSA-N 1 3 337.552 2.981 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CC[C@H]([NH2+]C/C=C/c2ccccc2)C1 ZINC001436883688 1387336924 /nfs/dbraw/zinc/33/69/24/1387336924.db2.gz QURRDNJNELOPIV-BNLMJFGMSA-N 1 3 341.499 2.765 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1C[C@@H](NCc2cc(Cl)ccc2Cl)C1 ZINC001436964627 1387346722 /nfs/dbraw/zinc/34/67/22/1387346722.db2.gz MEIQJXCTCCTDQK-OKILXGFUSA-N 1 3 344.286 2.682 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@H+](CC2CCC(C)CC2)C1 ZINC001437002869 1387356068 /nfs/dbraw/zinc/35/60/68/1387356068.db2.gz LYJZITRMOMHQHB-ACBHZAAOSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@@H+](CC2CCC(C)CC2)C1 ZINC001437002869 1387356076 /nfs/dbraw/zinc/35/60/76/1387356076.db2.gz LYJZITRMOMHQHB-ACBHZAAOSA-N 1 3 337.552 2.981 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001437036797 1387380858 /nfs/dbraw/zinc/38/08/58/1387380858.db2.gz SGLPBSOVOZHNOH-HXUWFJFHSA-N 1 3 345.531 2.917 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCCCC[C@@H]([NH2+]C/C=C/Cl)C1 ZINC001397229354 1359768811 /nfs/dbraw/zinc/76/88/11/1359768811.db2.gz YCURPZYZMYGAHC-VQVOLHRSSA-N 1 3 347.906 2.780 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CC2CCC2)CC(C)(C)C1)N(C)C ZINC001397265927 1359799070 /nfs/dbraw/zinc/79/90/70/1359799070.db2.gz ACHRSMAPWAOBLJ-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CC2CCC2)CC(C)(C)C1)N(C)C ZINC001397265927 1359799072 /nfs/dbraw/zinc/79/90/72/1359799072.db2.gz ACHRSMAPWAOBLJ-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[N@H+](C/C=C/Cl)CC(C)(C)C1)C1CCC1 ZINC001397265963 1359799084 /nfs/dbraw/zinc/79/90/84/1359799084.db2.gz AFEHSHXCDOZERB-FUVBFXSKSA-N 1 3 341.927 2.830 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[N@@H+](C/C=C/Cl)CC(C)(C)C1)C1CCC1 ZINC001397265963 1359799086 /nfs/dbraw/zinc/79/90/86/1359799086.db2.gz AFEHSHXCDOZERB-FUVBFXSKSA-N 1 3 341.927 2.830 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@H+](CC2CC(F)(F)C2)[C@@H]1C)N(CC)CC ZINC001397271669 1359805115 /nfs/dbraw/zinc/80/51/15/1359805115.db2.gz JMRXWEGJXPJQFP-VNQPRFMTSA-N 1 3 345.478 2.731 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@@H+](CC2CC(F)(F)C2)[C@@H]1C)N(CC)CC ZINC001397271669 1359805117 /nfs/dbraw/zinc/80/51/17/1359805117.db2.gz JMRXWEGJXPJQFP-VNQPRFMTSA-N 1 3 345.478 2.731 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CCC[N@@H+]1C1CCCC1)NCc1ccccc1F ZINC001437149538 1387422398 /nfs/dbraw/zinc/42/23/98/1387422398.db2.gz RWNDGGDLNNIXEM-HNAYVOBHSA-N 1 3 347.478 2.827 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CCC[N@H+]1C1CCCC1)NCc1ccccc1F ZINC001437149538 1387422414 /nfs/dbraw/zinc/42/24/14/1387422414.db2.gz RWNDGGDLNNIXEM-HNAYVOBHSA-N 1 3 347.478 2.827 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[NH+]1CCCC1 ZINC001441548621 1391357656 /nfs/dbraw/zinc/35/76/56/1391357656.db2.gz KPVPTBDOSUEDBY-GUTXKFCHSA-N 1 3 348.318 2.663 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]Cc2ccsc2)C1 ZINC001397681147 1360046455 /nfs/dbraw/zinc/04/64/55/1360046455.db2.gz SASKGOWMGCGGTH-OTRWWLKZSA-N 1 3 335.517 2.605 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C[C@@H]1C)CC[NH+](CC[C@@H](C)F)CC2 ZINC001397727550 1360082649 /nfs/dbraw/zinc/08/26/49/1360082649.db2.gz OIQLASGZEXAPKZ-SJORKVTESA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C[C@H]1C)CC[NH+](CC[C@@H](C)F)CC2 ZINC001397727544 1360082667 /nfs/dbraw/zinc/08/26/67/1360082667.db2.gz OIQLASGZEXAPKZ-IAGOWNOFSA-N 1 3 341.515 2.778 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001437167210 1387436522 /nfs/dbraw/zinc/43/65/22/1387436522.db2.gz IIQOTWSJFLPLTI-CZUORRHYSA-N 1 3 325.884 2.583 10 0 EFAEHO CC(C)CC[NH+]1CCC(N(C)C(=O)CN(C)CC(C)(C)C)CC1 ZINC001398190095 1360366255 /nfs/dbraw/zinc/36/62/55/1360366255.db2.gz OBKHMDLWBOMIEK-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](NCC=C(Cl)Cl)C1CC1 ZINC001398413918 1360532232 /nfs/dbraw/zinc/53/22/32/1360532232.db2.gz SWHOQRLGBMNGMH-UONOGXRCSA-N 1 3 348.318 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@H](NCC=C(Cl)Cl)C1CC1 ZINC001398413918 1360532236 /nfs/dbraw/zinc/53/22/36/1360532236.db2.gz SWHOQRLGBMNGMH-UONOGXRCSA-N 1 3 348.318 2.664 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+][C@@H]1CCc2c1cccc2F)C1CC1 ZINC001398447374 1360565143 /nfs/dbraw/zinc/56/51/43/1360565143.db2.gz GLTZYIURWSNZSA-MOPGFXCFSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(C2CCC2)cc1 ZINC001437203706 1387463964 /nfs/dbraw/zinc/46/39/64/1387463964.db2.gz JXHBKXVOIONJRP-SJORKVTESA-N 1 3 343.515 2.890 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]([NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)C1)CC(C)(C)C ZINC001398551032 1360639943 /nfs/dbraw/zinc/63/99/43/1360639943.db2.gz DIKSEQGRLXWHMD-CWQOZTLDSA-N 1 3 335.536 2.637 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@H]2CN(Cc3ccsc3)CC[C@@H]21 ZINC001398587411 1360659169 /nfs/dbraw/zinc/65/91/69/1360659169.db2.gz QVRZGKRWQREYNN-MSOLQXFVSA-N 1 3 349.544 2.903 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@H]2CN(Cc3ccsc3)CC[C@@H]21 ZINC001398587411 1360659174 /nfs/dbraw/zinc/65/91/74/1360659174.db2.gz QVRZGKRWQREYNN-MSOLQXFVSA-N 1 3 349.544 2.903 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCCc3ccccc32)C1)N(C)C ZINC001398609047 1360667979 /nfs/dbraw/zinc/66/79/79/1360667979.db2.gz HEVYBNYYRKPHFV-OGWHTMIXSA-N 1 3 329.488 2.641 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@@H](C(=O)N[C@H]2C[C@@H](NCC=C(Cl)Cl)C2)C1 ZINC001398659585 1360693653 /nfs/dbraw/zinc/69/36/53/1360693653.db2.gz HDJYFNNUTSMSEZ-MQYQWHSLSA-N 1 3 348.318 2.663 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)N[C@H]2C[C@@H](NCC=C(Cl)Cl)C2)C1 ZINC001398659578 1360693322 /nfs/dbraw/zinc/69/33/22/1360693322.db2.gz HDJYFNNUTSMSEZ-IGQOVBAYSA-N 1 3 348.318 2.663 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H]1C[C@@H]([NH2+]C/C=C\c2ccccc2)C1 ZINC001398664196 1360696175 /nfs/dbraw/zinc/69/61/75/1360696175.db2.gz IGOPDNCDKXAKAS-YFSAEIHFSA-N 1 3 341.499 2.811 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCCN(CCC(F)(F)F)C1)[NH+]1CCCC1 ZINC001398701360 1360728142 /nfs/dbraw/zinc/72/81/42/1360728142.db2.gz VNLSCNSKNOOQBO-AWEZNQCLSA-N 1 3 349.441 2.641 10 0 EFAEHO Cc1ccc(CN2CCCC[C@@H]2CNC(=O)C[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001398751767 1360763078 /nfs/dbraw/zinc/76/30/78/1360763078.db2.gz BGWPBJFRBZVMME-VQTJNVASSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1ccc(CN2CCCC[C@@H]2CNC(=O)C[C@@H]2CC[N@H+](C)C2)cc1 ZINC001398751767 1360763081 /nfs/dbraw/zinc/76/30/81/1360763081.db2.gz BGWPBJFRBZVMME-VQTJNVASSA-N 1 3 343.515 2.808 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H]1CCC[N@H+](CC2CCCC2)C1 ZINC001398792185 1360795926 /nfs/dbraw/zinc/79/59/26/1360795926.db2.gz LZFGFNNTBBJEQP-RHSMWYFYSA-N 1 3 332.492 2.668 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](CC2CCCC2)C1 ZINC001398792185 1360795929 /nfs/dbraw/zinc/79/59/29/1360795929.db2.gz LZFGFNNTBBJEQP-RHSMWYFYSA-N 1 3 332.492 2.668 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1CCC(NC(=O)C(C)(C)N2CCCC2)CC1 ZINC001398833099 1360821592 /nfs/dbraw/zinc/82/15/92/1360821592.db2.gz QQEJHTDZNAOBHC-QQFBHYJXSA-N 1 3 327.488 2.626 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](C)[C@H](C)c1cccc(OC)c1 ZINC001492877747 1360860743 /nfs/dbraw/zinc/86/07/43/1360860743.db2.gz CUWGLYQXHRLYGL-APWZRJJASA-N 1 3 347.503 2.679 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](C)[C@H](C)c1cccc(OC)c1 ZINC001492877747 1360860745 /nfs/dbraw/zinc/86/07/45/1360860745.db2.gz CUWGLYQXHRLYGL-APWZRJJASA-N 1 3 347.503 2.679 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H](C)[NH2+]CC1CC2(CCC2)C1 ZINC001399081944 1360978312 /nfs/dbraw/zinc/97/83/12/1360978312.db2.gz AZSGDUYWSXCCEJ-WMZOPIPTSA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@@H](C)N2CCCCCC2)cc1 ZINC001399091770 1360986768 /nfs/dbraw/zinc/98/67/68/1360986768.db2.gz IWAAPFZSRNVWHT-ZWKOTPCHSA-N 1 3 331.504 2.854 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CNC(=O)[C@H](C)N2CCCCCC2)cc1 ZINC001399091728 1360986941 /nfs/dbraw/zinc/98/69/41/1360986941.db2.gz IWAAPFZSRNVWHT-MSOLQXFVSA-N 1 3 331.504 2.854 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@H](C)N2CCCCCC2)cc1 ZINC001399091748 1360987069 /nfs/dbraw/zinc/98/70/69/1360987069.db2.gz IWAAPFZSRNVWHT-ROUUACIJSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[N@H+](C)[C@@H](C(=O)N1CCC[C@@H](N(C)CCF)C1)c1ccccc1 ZINC001399278462 1361120293 /nfs/dbraw/zinc/12/02/93/1361120293.db2.gz IAVQDLINKZEWJS-QZTJIDSGSA-N 1 3 335.467 2.572 10 0 EFAEHO CC[N@@H+](C)[C@@H](C(=O)N1CCC[C@@H](N(C)CCF)C1)c1ccccc1 ZINC001399278462 1361120296 /nfs/dbraw/zinc/12/02/96/1361120296.db2.gz IAVQDLINKZEWJS-QZTJIDSGSA-N 1 3 335.467 2.572 10 0 EFAEHO CCN(C)[C@@H](C(=O)N1CCC[C@@H]([N@H+](C)CCF)C1)c1ccccc1 ZINC001399278462 1361120297 /nfs/dbraw/zinc/12/02/97/1361120297.db2.gz IAVQDLINKZEWJS-QZTJIDSGSA-N 1 3 335.467 2.572 10 0 EFAEHO CCN(C)[C@@H](C(=O)N1CCC[C@@H]([N@@H+](C)CCF)C1)c1ccccc1 ZINC001399278462 1361120300 /nfs/dbraw/zinc/12/03/00/1361120300.db2.gz IAVQDLINKZEWJS-QZTJIDSGSA-N 1 3 335.467 2.572 10 0 EFAEHO CC[N@H+](C)[C@@H](C(=O)N1CCC[C@H](N(C)CCF)C1)c1ccccc1 ZINC001399278469 1361120346 /nfs/dbraw/zinc/12/03/46/1361120346.db2.gz IAVQDLINKZEWJS-ZWKOTPCHSA-N 1 3 335.467 2.572 10 0 EFAEHO CC[N@@H+](C)[C@@H](C(=O)N1CCC[C@H](N(C)CCF)C1)c1ccccc1 ZINC001399278469 1361120349 /nfs/dbraw/zinc/12/03/49/1361120349.db2.gz IAVQDLINKZEWJS-ZWKOTPCHSA-N 1 3 335.467 2.572 10 0 EFAEHO CCN(C)[C@@H](C(=O)N1CCC[C@H]([N@H+](C)CCF)C1)c1ccccc1 ZINC001399278469 1361120350 /nfs/dbraw/zinc/12/03/50/1361120350.db2.gz IAVQDLINKZEWJS-ZWKOTPCHSA-N 1 3 335.467 2.572 10 0 EFAEHO CCN(C)[C@@H](C(=O)N1CCC[C@H]([N@@H+](C)CCF)C1)c1ccccc1 ZINC001399278469 1361120354 /nfs/dbraw/zinc/12/03/54/1361120354.db2.gz IAVQDLINKZEWJS-ZWKOTPCHSA-N 1 3 335.467 2.572 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H](C)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001399420205 1361210775 /nfs/dbraw/zinc/21/07/75/1361210775.db2.gz PXDUGDRTQAAOGD-TZMCWYRMSA-N 1 3 342.434 2.571 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@@H+]1C)[C@@H]1CCc2ccc(F)cc21 ZINC001399499558 1361281879 /nfs/dbraw/zinc/28/18/79/1361281879.db2.gz BCYHMEAFROXBKI-PKOBYXMFSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@H+]1C)[C@@H]1CCc2ccc(F)cc21 ZINC001399499558 1361281885 /nfs/dbraw/zinc/28/18/85/1361281885.db2.gz BCYHMEAFROXBKI-PKOBYXMFSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@@H+]1C)Cc1ccc(C2CC2)cc1 ZINC001399507807 1361290390 /nfs/dbraw/zinc/29/03/90/1361290390.db2.gz XOSSECLDXPOZNV-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@H+]1C)Cc1ccc(C2CC2)cc1 ZINC001399507807 1361290392 /nfs/dbraw/zinc/29/03/92/1361290392.db2.gz XOSSECLDXPOZNV-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CN(CCNC(=O)CC[NH+](C)C)Cc1ccc(-c2ccccc2)cc1 ZINC001399567400 1361338144 /nfs/dbraw/zinc/33/81/44/1361338144.db2.gz FYYJTFMIBLUHTB-UHFFFAOYSA-N 1 3 339.483 2.853 10 0 EFAEHO CN(CC(=O)NCC[N@H+](C)CCC1CCCCC1)CC(C)(C)C ZINC001399573544 1361342494 /nfs/dbraw/zinc/34/24/94/1361342494.db2.gz FSZPURNKFDQCLZ-UHFFFAOYSA-N 1 3 325.541 2.983 10 0 EFAEHO CN(CC(=O)NCC[N@@H+](C)CCC1CCCCC1)CC(C)(C)C ZINC001399573544 1361342502 /nfs/dbraw/zinc/34/25/02/1361342502.db2.gz FSZPURNKFDQCLZ-UHFFFAOYSA-N 1 3 325.541 2.983 10 0 EFAEHO CC1CCC(C[N@H+](C)CCNC(=O)CN(C)CC(C)(C)C)CC1 ZINC001399573105 1361343102 /nfs/dbraw/zinc/34/31/02/1361343102.db2.gz DQOGNRKFIINOSY-UHFFFAOYSA-N 1 3 325.541 2.839 10 0 EFAEHO CC1CCC(C[N@@H+](C)CCNC(=O)CN(C)CC(C)(C)C)CC1 ZINC001399573105 1361343105 /nfs/dbraw/zinc/34/31/05/1361343105.db2.gz DQOGNRKFIINOSY-UHFFFAOYSA-N 1 3 325.541 2.839 10 0 EFAEHO CN(CCNC(=O)C12CC[NH+](CC1)C2)Cc1cc2ccccc2s1 ZINC001399646335 1361399340 /nfs/dbraw/zinc/39/93/40/1361399340.db2.gz SYHCJAWLQSXQIV-UHFFFAOYSA-N 1 3 343.496 2.545 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]CC[C@H]1CCc2ccccc21 ZINC001437262327 1387514940 /nfs/dbraw/zinc/51/49/40/1387514940.db2.gz OCDHHLZJGGQEJT-SJLPKXTDSA-N 1 3 331.504 2.541 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@H](C)CNC(=O)CN(C)C(C)C ZINC001437261925 1387515296 /nfs/dbraw/zinc/51/52/96/1387515296.db2.gz MQDUTHFNVKQOCB-CQSZACIVSA-N 1 3 325.884 2.583 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)[C@@H](C(C)C)[NH+]2CCCC2)c1 ZINC001437263962 1387516245 /nfs/dbraw/zinc/51/62/45/1387516245.db2.gz JYODWDALNNYJRE-VQIMIIECSA-N 1 3 349.494 2.849 10 0 EFAEHO CCN(CCNC(=O)CC[NH+](C)C)[C@@H](C)c1cccc(Cl)c1 ZINC001399763654 1361485364 /nfs/dbraw/zinc/48/53/64/1361485364.db2.gz XVKNNWKORQLYSC-AWEZNQCLSA-N 1 3 325.884 2.791 10 0 EFAEHO CCN(CCNC(=O)CC[NH+](C)C)[C@H](C)c1cccc(Cl)c1 ZINC001399763656 1361485387 /nfs/dbraw/zinc/48/53/87/1361485387.db2.gz XVKNNWKORQLYSC-CQSZACIVSA-N 1 3 325.884 2.791 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCC[N@@H+]1CC1CC(C)(C)C1)N1CCCC1 ZINC001399863413 1361536545 /nfs/dbraw/zinc/53/65/45/1361536545.db2.gz DCJDDHBUBROZIN-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCC[N@H+]1CC1CC(C)(C)C1)N1CCCC1 ZINC001399863413 1361536548 /nfs/dbraw/zinc/53/65/48/1361536548.db2.gz DCJDDHBUBROZIN-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+]([C@H]2CCc3c2cccc3F)C1 ZINC001399930820 1361585903 /nfs/dbraw/zinc/58/59/03/1361585903.db2.gz ICPGIATYXILNLY-KXBFYZLASA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+]([C@H]2CCc3c2cccc3F)C1 ZINC001399930820 1361585904 /nfs/dbraw/zinc/58/59/04/1361585904.db2.gz ICPGIATYXILNLY-KXBFYZLASA-N 1 3 347.478 2.591 10 0 EFAEHO Cc1cccc(C)c1C[N@H+]1CC[C@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001399930423 1361586266 /nfs/dbraw/zinc/58/62/66/1361586266.db2.gz IXUHONNBCYBHFE-QFBILLFUSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+]1CC[C@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001399930423 1361586271 /nfs/dbraw/zinc/58/62/71/1361586271.db2.gz IXUHONNBCYBHFE-QFBILLFUSA-N 1 3 343.515 2.583 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+]([C@@H]2CCc3c2cccc3F)C1 ZINC001399930810 1361586294 /nfs/dbraw/zinc/58/62/94/1361586294.db2.gz ICPGIATYXILNLY-DNVCBOLYSA-N 1 3 347.478 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+]([C@@H]2CCc3c2cccc3F)C1 ZINC001399930810 1361586299 /nfs/dbraw/zinc/58/62/99/1361586299.db2.gz ICPGIATYXILNLY-DNVCBOLYSA-N 1 3 347.478 2.591 10 0 EFAEHO CC[C@H](C(=O)N1CCC([C@H](C)[NH2+]CCC(C)(C)C)CC1)N(C)C ZINC001400085912 1361724825 /nfs/dbraw/zinc/72/48/25/1361724825.db2.gz IGUYNCZZKIKWSN-DOTOQJQBSA-N 1 3 325.541 2.980 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H]1CC[N@H+](CCC(F)(F)F)C1 ZINC001400193204 1361834267 /nfs/dbraw/zinc/83/42/67/1361834267.db2.gz GAFAFQSZSWZQKX-HUUCEWRRSA-N 1 3 349.441 2.641 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@@H]1CC[N@@H+](CCC(F)(F)F)C1 ZINC001400193204 1361834269 /nfs/dbraw/zinc/83/42/69/1361834269.db2.gz GAFAFQSZSWZQKX-HUUCEWRRSA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001400204304 1361842742 /nfs/dbraw/zinc/84/27/42/1361842742.db2.gz MXHTUPVLKZYIMR-HKUYNNGSSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001400204304 1361842745 /nfs/dbraw/zinc/84/27/45/1361842745.db2.gz MXHTUPVLKZYIMR-HKUYNNGSSA-N 1 3 349.563 2.981 10 0 EFAEHO C[NH+](C)CCC(=O)N(Cc1ccccc1)[C@H]1CCCN(CCCF)C1 ZINC001400242870 1361877944 /nfs/dbraw/zinc/87/79/44/1361877944.db2.gz CSUVHQPCCATQFZ-IBGZPJMESA-N 1 3 349.494 2.791 10 0 EFAEHO CC[C@H](C)C[N@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001400246056 1361880484 /nfs/dbraw/zinc/88/04/84/1361880484.db2.gz VWDBABSDIZCSSV-KRWDZBQOSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001400246056 1361880497 /nfs/dbraw/zinc/88/04/97/1361880497.db2.gz VWDBABSDIZCSSV-KRWDZBQOSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@@H](c1ccccc1)N1CC(CNC(=O)C(C)(C)[NH+]2CCCC2)C1 ZINC001400514136 1362006019 /nfs/dbraw/zinc/00/60/19/1362006019.db2.gz CDMRYKMNRNROOO-INIZCTEOSA-N 1 3 329.488 2.670 10 0 EFAEHO C[C@H](c1ccc2ccccc2c1)N1CC(CNC(=O)CC[NH+](C)C)C1 ZINC001400531415 1362014934 /nfs/dbraw/zinc/01/49/34/1362014934.db2.gz XSDWFQKUDZYIGV-MRXNPFEDSA-N 1 3 339.483 2.901 10 0 EFAEHO C[C@@H](c1ccc2ccccc2c1)N1CC(CNC(=O)CC[NH+](C)C)C1 ZINC001400531413 1362014950 /nfs/dbraw/zinc/01/49/50/1362014950.db2.gz XSDWFQKUDZYIGV-INIZCTEOSA-N 1 3 339.483 2.901 10 0 EFAEHO CC[C@@H](C)CN1C[C@@H]2C[C@H]1CN2C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001400573016 1362030726 /nfs/dbraw/zinc/03/07/26/1362030726.db2.gz CCJCVGUEHIOOPV-SQNIBIBYSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)CCCN1C[C@@H]2C[C@H]1CN2C(=O)C1CC[NH+](C(C)C)CC1 ZINC001400582025 1362035679 /nfs/dbraw/zinc/03/56/79/1362035679.db2.gz QWZZHHBEIZELES-OALUTQOASA-N 1 3 335.536 2.828 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[C@H]([NH2+]CC2CC3(CCC3)C2)C1 ZINC001437327775 1387547580 /nfs/dbraw/zinc/54/75/80/1387547580.db2.gz KYFAPUKJAWQQBD-ZWKOTPCHSA-N 1 3 335.536 2.926 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@H+](CCCC2CCC2)C1 ZINC001400773426 1362156678 /nfs/dbraw/zinc/15/66/78/1362156678.db2.gz ZINAAWGZFXLQOW-MJGOQNOKSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@H]1CC[N@@H+](CCCC2CCC2)C1 ZINC001400773426 1362156679 /nfs/dbraw/zinc/15/66/79/1362156679.db2.gz ZINAAWGZFXLQOW-MJGOQNOKSA-N 1 3 335.536 2.831 10 0 EFAEHO CCc1ccc(CN2CC[C@@H](N(CC)C(=O)CC[NH+](C)C)C2)cc1 ZINC001400774025 1362156756 /nfs/dbraw/zinc/15/67/56/1362156756.db2.gz ZSIKZMISYSHYRU-LJQANCHMSA-N 1 3 331.504 2.624 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](CC)N(C)C)[NH2+]CC1CCC(F)(F)CC1 ZINC001400825600 1362189198 /nfs/dbraw/zinc/18/91/98/1362189198.db2.gz JTPLEUITDKUWOZ-HUUCEWRRSA-N 1 3 333.467 2.637 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NC[C@@H](CC)NCc2ccccc2F)C1 ZINC001400881129 1362231889 /nfs/dbraw/zinc/23/18/89/1362231889.db2.gz ZEVXJJNPYHFEGL-QZTJIDSGSA-N 1 3 349.494 2.932 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NC[C@@H](CC)NCc2ccccc2F)C1 ZINC001400881129 1362231892 /nfs/dbraw/zinc/23/18/92/1362231892.db2.gz ZEVXJJNPYHFEGL-QZTJIDSGSA-N 1 3 349.494 2.932 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC1(NC(=O)CN(C)CC(C)(C)C)CCCC1 ZINC001400953231 1362293258 /nfs/dbraw/zinc/29/32/58/1362293258.db2.gz IQHFWJBYOLJGJB-OAHLLOKOSA-N 1 3 329.504 2.731 10 0 EFAEHO CC[C@H](C(=O)N[C@@](C)(C[NH2+]Cc1cc(C)ccc1F)C1CC1)N(C)C ZINC001401018135 1362364242 /nfs/dbraw/zinc/36/42/42/1362364242.db2.gz ZTIWJVNAARROLG-QUCCMNQESA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)C[NH2+]CC1CC(C)(C)C1 ZINC001401124937 1362462280 /nfs/dbraw/zinc/46/22/80/1362462280.db2.gz FIPOEEYWVZRLJQ-OAHLLOKOSA-N 1 3 325.541 2.742 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(Cl)s1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001401247508 1362585760 /nfs/dbraw/zinc/58/57/60/1362585760.db2.gz PLOHSUVPLUYKCA-QWHCGFSZSA-N 1 3 343.924 2.680 10 0 EFAEHO Cc1ccc(CNC[C@H](C)N(C)C(=O)C23CC[NH+](CC2)C3)c(Cl)c1 ZINC001401253859 1362592996 /nfs/dbraw/zinc/59/29/96/1362592996.db2.gz MHIOJODQHAULIL-HNNXBMFYSA-N 1 3 349.906 2.681 10 0 EFAEHO CC(C)C[NH2+]C[C@H](CC(C)C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001401269310 1362611135 /nfs/dbraw/zinc/61/11/35/1362611135.db2.gz BQJOOAHONQCTAN-QFBILLFUSA-N 1 3 343.531 2.975 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]CC1CC2(CCC2)C1 ZINC001401336644 1362682561 /nfs/dbraw/zinc/68/25/61/1362682561.db2.gz SYGZOQAFHDZVEL-QGZVFWFLSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC1CC1 ZINC001401339640 1362687441 /nfs/dbraw/zinc/68/74/41/1362687441.db2.gz BYJWPNOWYZLRAW-VQIMIIECSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1cccc(Cl)c1 ZINC001401354425 1362704159 /nfs/dbraw/zinc/70/41/59/1362704159.db2.gz LVCJMPLTZJMIKZ-QGZVFWFLSA-N 1 3 339.911 2.911 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](CNC(=O)C[C@H]2CC[N@H+](C)C2)C(C)C)c1 ZINC001401380180 1362732572 /nfs/dbraw/zinc/73/25/72/1362732572.db2.gz LLXNNRFPUDVUHJ-APWZRJJASA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](CNC(=O)C[C@H]2CC[N@@H+](C)C2)C(C)C)c1 ZINC001401380180 1362732575 /nfs/dbraw/zinc/73/25/75/1362732575.db2.gz LLXNNRFPUDVUHJ-APWZRJJASA-N 1 3 349.494 2.706 10 0 EFAEHO CC1CC(C[N@H+](C)CCN(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001401388076 1362741631 /nfs/dbraw/zinc/74/16/31/1362741631.db2.gz XTNZCHSXDRCMCW-LADRWXRNSA-N 1 3 341.515 2.635 10 0 EFAEHO CC1CC(C[N@@H+](C)CCN(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001401388076 1362741633 /nfs/dbraw/zinc/74/16/33/1362741633.db2.gz XTNZCHSXDRCMCW-LADRWXRNSA-N 1 3 341.515 2.635 10 0 EFAEHO C[C@H](CCNC(=O)[C@@H]1CCCN1C)[NH2+]Cc1ccc(F)cc1Cl ZINC001437375821 1387591831 /nfs/dbraw/zinc/59/18/31/1387591831.db2.gz OXJUOSOVJGLBSQ-WBMJQRKESA-N 1 3 341.858 2.558 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(C)CCN(C)C(=O)C[C@H]1CC[N@H+](C)C1 ZINC001401437775 1362806542 /nfs/dbraw/zinc/80/65/42/1362806542.db2.gz HKPLHURAOGMXKW-HZPDHXFCSA-N 1 3 335.467 2.619 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(C)CCN(C)C(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001401437775 1362806544 /nfs/dbraw/zinc/80/65/44/1362806544.db2.gz HKPLHURAOGMXKW-HZPDHXFCSA-N 1 3 335.467 2.619 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccccc2Cl)C1 ZINC001401493355 1362884961 /nfs/dbraw/zinc/88/49/61/1362884961.db2.gz ODKGPXNTFHXARX-AEFFLSMTSA-N 1 3 349.906 2.715 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@@H](C)NC(=O)[C@@H]2CCCCN2CC)c1 ZINC001401676871 1363020459 /nfs/dbraw/zinc/02/04/59/1363020459.db2.gz YJYLIRXGZQXRDD-APWZRJJASA-N 1 3 331.504 2.718 10 0 EFAEHO C[C@@H](CN[C@@H](C)c1cccc(Cl)c1F)NC(=O)CC[NH+](C)C ZINC001401700267 1363036076 /nfs/dbraw/zinc/03/60/76/1363036076.db2.gz PBYPXELCJDTDSN-RYUDHWBXSA-N 1 3 329.847 2.586 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)N[C@@H](C)CNCc1ccccc1F ZINC001401704272 1363037981 /nfs/dbraw/zinc/03/79/81/1363037981.db2.gz FMGLDISFMVPMQI-MAUKXSAKSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)N[C@@H](C)CNCc1ccccc1F ZINC001401704272 1363037985 /nfs/dbraw/zinc/03/79/85/1363037985.db2.gz FMGLDISFMVPMQI-MAUKXSAKSA-N 1 3 335.467 2.683 10 0 EFAEHO CCc1ccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)cc1 ZINC001401754102 1363088448 /nfs/dbraw/zinc/08/84/48/1363088448.db2.gz OYEXEORKEIPJPA-GPMSIDNRSA-N 1 3 331.504 2.526 10 0 EFAEHO CCc1ccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1 ZINC001401754102 1363088450 /nfs/dbraw/zinc/08/84/50/1363088450.db2.gz OYEXEORKEIPJPA-GPMSIDNRSA-N 1 3 331.504 2.526 10 0 EFAEHO C[C@@H](C[N@H+](C)CC1CC(C)(C)C1)NC(=O)CN(C)CC(C)(C)C ZINC001401783643 1363124880 /nfs/dbraw/zinc/12/48/80/1363124880.db2.gz VQIRIPDYHOLDGP-HNNXBMFYSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC1CC(C)(C)C1)NC(=O)CN(C)CC(C)(C)C ZINC001401783643 1363124884 /nfs/dbraw/zinc/12/48/84/1363124884.db2.gz VQIRIPDYHOLDGP-HNNXBMFYSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@@H](C[N@H+](C)[C@@H]1CCc2ccccc21)NC(=O)CN(C)C1CCC1 ZINC001401787258 1363129038 /nfs/dbraw/zinc/12/90/38/1363129038.db2.gz VTSWGWHGNAEQMX-HNAYVOBHSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@@H](C[N@@H+](C)[C@@H]1CCc2ccccc21)NC(=O)CN(C)C1CCC1 ZINC001401787258 1363129045 /nfs/dbraw/zinc/12/90/45/1363129045.db2.gz VTSWGWHGNAEQMX-HNAYVOBHSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@H](C[N@H+](C)[C@H]1CCc2ccccc21)NC(=O)CN(C)C1CCC1 ZINC001401787248 1363129366 /nfs/dbraw/zinc/12/93/66/1363129366.db2.gz VTSWGWHGNAEQMX-BEFAXECRSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@H](C[N@@H+](C)[C@H]1CCc2ccccc21)NC(=O)CN(C)C1CCC1 ZINC001401787248 1363129369 /nfs/dbraw/zinc/12/93/69/1363129369.db2.gz VTSWGWHGNAEQMX-BEFAXECRSA-N 1 3 329.488 2.595 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)Cc1ccc(Cl)cc1)N(C)C ZINC001401803427 1363152079 /nfs/dbraw/zinc/15/20/79/1363152079.db2.gz PLJULOOIAAZEQO-XJKSGUPXSA-N 1 3 325.884 2.617 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc(Cl)cc1)N(C)C ZINC001401803427 1363152081 /nfs/dbraw/zinc/15/20/81/1363152081.db2.gz PLJULOOIAAZEQO-XJKSGUPXSA-N 1 3 325.884 2.617 10 0 EFAEHO C[C@@H](CN(C)Cc1ccccc1C1CC1)NC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001401808997 1363159691 /nfs/dbraw/zinc/15/96/91/1363159691.db2.gz XCLXAEFVRLADEZ-DLBZAZTESA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](CN(C)Cc1ccccc1C1CC1)NC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001401808997 1363159694 /nfs/dbraw/zinc/15/96/94/1363159694.db2.gz XCLXAEFVRLADEZ-DLBZAZTESA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+][C@@H]1CCc2ccc(F)cc21)C1CC1 ZINC001401874711 1363206183 /nfs/dbraw/zinc/20/61/83/1363206183.db2.gz QPEAMKFLFWOATB-RTBURBONSA-N 1 3 347.478 2.638 10 0 EFAEHO Cc1cc(F)ccc1CNC1(CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)CC1 ZINC001401957620 1363275351 /nfs/dbraw/zinc/27/53/51/1363275351.db2.gz KOQVXCKNBJXCJT-HOTGVXAUSA-N 1 3 347.478 2.603 10 0 EFAEHO Cc1cc(F)ccc1CNC1(CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)CC1 ZINC001401957620 1363275354 /nfs/dbraw/zinc/27/53/54/1363275354.db2.gz KOQVXCKNBJXCJT-HOTGVXAUSA-N 1 3 347.478 2.603 10 0 EFAEHO Cc1ccncc1C[NH2+][C@H](C)CCNC(=O)[C@H]1CCCCN1C(C)C ZINC001437410027 1387620895 /nfs/dbraw/zinc/62/08/95/1387620895.db2.gz NQAUVLQUZCMHMU-IEBWSBKVSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@@]3(CCN(C(=O)CN(C)C(C)C)C3)C2)cs1 ZINC001402014208 1363330898 /nfs/dbraw/zinc/33/08/98/1363330898.db2.gz NGIPHETYQWURQS-LJQANCHMSA-N 1 3 349.544 2.821 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@@]3(CCN(C(=O)CN(C)C(C)C)C3)C2)cs1 ZINC001402014208 1363330904 /nfs/dbraw/zinc/33/09/04/1363330904.db2.gz NGIPHETYQWURQS-LJQANCHMSA-N 1 3 349.544 2.821 10 0 EFAEHO Cc1ccc(CN2CCC[C@@H](NC(=O)CC[C@@H]3CCC[N@H+]3C)C2)cc1 ZINC001402075991 1363380586 /nfs/dbraw/zinc/38/05/86/1363380586.db2.gz GLNLMMNXUQICNT-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(CN2CCC[C@@H](NC(=O)CC[C@@H]3CCC[N@@H+]3C)C2)cc1 ZINC001402075991 1363380588 /nfs/dbraw/zinc/38/05/88/1363380588.db2.gz GLNLMMNXUQICNT-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO C[NH+](C)CCC(=O)NC1(C)CCN([C@H]2CCc3ccc(F)cc32)CC1 ZINC001402081025 1363385586 /nfs/dbraw/zinc/38/55/86/1363385586.db2.gz OEPDBWTZXCOZHX-SFHVURJKSA-N 1 3 347.478 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+]Cc1ccccc1F)C1CCCC1 ZINC001402096556 1363402590 /nfs/dbraw/zinc/40/25/90/1363402590.db2.gz BZWYKHJIJFPDCO-IBGZPJMESA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)[NH2+]C[C@@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CCCC1 ZINC001402102845 1363409757 /nfs/dbraw/zinc/40/97/57/1363409757.db2.gz RZMXLWZHABYXSG-APWZRJJASA-N 1 3 341.515 2.872 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2c(C)cccc2C)C1)N(C)C ZINC001402155084 1363463648 /nfs/dbraw/zinc/46/36/48/1363463648.db2.gz AENHPARRQCJNRP-TZIWHRDSSA-N 1 3 345.531 2.972 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CC[N@H+](Cc2cc(C)ccc2C)C1 ZINC001402162693 1363470403 /nfs/dbraw/zinc/47/04/03/1363470403.db2.gz HQDIMZSIBBOAAQ-OALUTQOASA-N 1 3 349.494 2.674 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CC[N@@H+](Cc2cc(C)ccc2C)C1 ZINC001402162693 1363470405 /nfs/dbraw/zinc/47/04/05/1363470405.db2.gz HQDIMZSIBBOAAQ-OALUTQOASA-N 1 3 349.494 2.674 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(CC)CC ZINC001402184234 1363490416 /nfs/dbraw/zinc/49/04/16/1363490416.db2.gz JOARHNRUHDWKPM-QZTJIDSGSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(CC)CC ZINC001402184234 1363490417 /nfs/dbraw/zinc/49/04/17/1363490417.db2.gz JOARHNRUHDWKPM-QZTJIDSGSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]([NH2+]CCC(F)(F)F)C1CC1)N1CCCCCC1 ZINC001402346598 1363617964 /nfs/dbraw/zinc/61/79/64/1363617964.db2.gz RFTZBHVWAZWTOC-UKRRQHHQSA-N 1 3 349.441 2.688 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H](C[N@H+](C)CCC(C)(C)C)C2)C1 ZINC001402393489 1363652764 /nfs/dbraw/zinc/65/27/64/1363652764.db2.gz RGDZOVFGQSPPRP-QZTJIDSGSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H](C[N@@H+](C)CCC(C)(C)C)C2)C1 ZINC001402393489 1363652767 /nfs/dbraw/zinc/65/27/67/1363652767.db2.gz RGDZOVFGQSPPRP-QZTJIDSGSA-N 1 3 337.552 2.935 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)[N@H+](CCC(C)(C)C)C3)CCC1 ZINC001402403100 1363662225 /nfs/dbraw/zinc/66/22/25/1363662225.db2.gz KDTRHOIBMWEUJA-ULQDDVLXSA-N 1 3 335.536 2.876 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)[N@@H+](CCC(C)(C)C)C3)CCC1 ZINC001402403100 1363662228 /nfs/dbraw/zinc/66/22/28/1363662228.db2.gz KDTRHOIBMWEUJA-ULQDDVLXSA-N 1 3 335.536 2.876 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2ccc(CC)cc2)C1 ZINC001402411813 1363671445 /nfs/dbraw/zinc/67/14/45/1363671445.db2.gz OGOPIUUHUMJEOZ-FXAWDEMLSA-N 1 3 345.531 2.775 10 0 EFAEHO CC[C@@H](C)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)Cc1nc[nH]c1C)C2 ZINC001402444255 1363697119 /nfs/dbraw/zinc/69/71/19/1363697119.db2.gz YLKHXHIRQSAANN-MXASKKJJSA-N 1 3 332.492 2.666 10 0 EFAEHO CC[C@@H](C)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)Cc1nc[nH]c1C)C2 ZINC001402444255 1363697125 /nfs/dbraw/zinc/69/71/25/1363697125.db2.gz YLKHXHIRQSAANN-MXASKKJJSA-N 1 3 332.492 2.666 10 0 EFAEHO CC[C@H](F)CN1CCC2(CN(C(=O)CCC[NH+]3CCCC3)C2)CC1 ZINC001402495376 1363739248 /nfs/dbraw/zinc/73/92/48/1363739248.db2.gz MROWOTVOHFWPSP-KRWDZBQOSA-N 1 3 339.499 2.535 10 0 EFAEHO CCCC[N@@H+]1CCc2c(CNC(=O)[C@H](CC)N(C)C)cccc2C1 ZINC001402526924 1363760902 /nfs/dbraw/zinc/76/09/02/1363760902.db2.gz MNXSQXPHFQUHPY-IBGZPJMESA-N 1 3 331.504 2.801 10 0 EFAEHO CCCC[N@H+]1CCc2c(CNC(=O)[C@H](CC)N(C)C)cccc2C1 ZINC001402526924 1363760907 /nfs/dbraw/zinc/76/09/07/1363760907.db2.gz MNXSQXPHFQUHPY-IBGZPJMESA-N 1 3 331.504 2.801 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCC[C@@H]1CNCc1cc2ccccc2o1 ZINC001402529506 1363763678 /nfs/dbraw/zinc/76/36/78/1363763678.db2.gz QPLZZIFAKBEWRA-QGZVFWFLSA-N 1 3 343.471 2.855 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)C2(C[NH+](C)C)CCCCC2)CCC1 ZINC001402564679 1363792400 /nfs/dbraw/zinc/79/24/00/1363792400.db2.gz YMCMGQMBZXDYGW-INIZCTEOSA-N 1 3 341.515 2.875 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)c2ccc(C[NH+](C)C)cc2)CCC1 ZINC001402580499 1363809327 /nfs/dbraw/zinc/80/93/27/1363809327.db2.gz QLKQIDQPXIOCFR-QGZVFWFLSA-N 1 3 335.467 2.738 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2)C1)CC(C)(C)C ZINC001402603663 1363828464 /nfs/dbraw/zinc/82/84/64/1363828464.db2.gz IDLBBTDPZWOVLA-CALCHBBNSA-N 1 3 335.467 2.540 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CCC[N@H+](CCCC3CCC3)C2)C1 ZINC001402663087 1363906654 /nfs/dbraw/zinc/90/66/54/1363906654.db2.gz JWNZSCLWACOKFD-PKOBYXMFSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CCC[N@@H+](CCCC3CCC3)C2)C1 ZINC001402663087 1363906658 /nfs/dbraw/zinc/90/66/58/1363906658.db2.gz JWNZSCLWACOKFD-PKOBYXMFSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@H]1CCC[N@H+](CC2CC2)C1 ZINC001402672607 1363921786 /nfs/dbraw/zinc/92/17/86/1363921786.db2.gz GDYHENIVXSEQBY-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001402672607 1363921791 /nfs/dbraw/zinc/92/17/91/1363921791.db2.gz GDYHENIVXSEQBY-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@@H](C)[C@H](C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CC)CC1 ZINC001402683381 1363932836 /nfs/dbraw/zinc/93/28/36/1363932836.db2.gz QPIHPILVUAOIDG-JFRXWTBNSA-N 1 3 335.536 2.828 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001402719826 1363965381 /nfs/dbraw/zinc/96/53/81/1363965381.db2.gz OCRBLTXKQWUSOS-GOSISDBHSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)C[NH2+]C[C@@H]1CCCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001402754568 1364001697 /nfs/dbraw/zinc/00/16/97/1364001697.db2.gz CFLJFEHQAQJJHR-LPHOPBHVSA-N 1 3 341.515 2.826 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C1(C)CCN(C(=O)CN(C)C(C)C)CC1 ZINC001402780267 1364028715 /nfs/dbraw/zinc/02/87/15/1364028715.db2.gz GOYIFHDXGSFUNV-UHFFFAOYSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@H](NCc2cc(C)ccc2F)[C@@H](C)C1 ZINC001402786738 1364033535 /nfs/dbraw/zinc/03/35/35/1364033535.db2.gz NPPRYWNEOHTSST-LPHOPBHVSA-N 1 3 349.494 2.803 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@H](NCc2cc(C)ccc2F)[C@@H](C)C1 ZINC001402786738 1364033540 /nfs/dbraw/zinc/03/35/40/1364033540.db2.gz NPPRYWNEOHTSST-LPHOPBHVSA-N 1 3 349.494 2.803 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@@H](C)CCNC(=O)C2(N(C)C)CCC2)c1 ZINC001402821172 1364068413 /nfs/dbraw/zinc/06/84/13/1364068413.db2.gz ABKHYDKJEIEXIY-JKSUJKDBSA-N 1 3 347.503 2.725 10 0 EFAEHO C[C@@H](CCNC(=O)CN(C)C1CCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001402823892 1364071401 /nfs/dbraw/zinc/07/14/01/1364071401.db2.gz PCMGPWVDJJFNPG-KXBFYZLASA-N 1 3 329.488 2.643 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@H](C)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001402854155 1364093806 /nfs/dbraw/zinc/09/38/06/1364093806.db2.gz UEZYJMBIDFMIFJ-AWEZNQCLSA-N 1 3 340.471 2.823 10 0 EFAEHO C[N@@H+]1CCCC[C@@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1NC/C=C/Cl ZINC001402897590 1364117564 /nfs/dbraw/zinc/11/75/64/1364117564.db2.gz KYYUQKPEANHRGW-OSPAOGCGSA-N 1 3 347.890 2.595 10 0 EFAEHO C[N@H+]1CCCC[C@@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1NC/C=C/Cl ZINC001402897590 1364117569 /nfs/dbraw/zinc/11/75/69/1364117569.db2.gz KYYUQKPEANHRGW-OSPAOGCGSA-N 1 3 347.890 2.595 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)C[C@@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001402911611 1364127572 /nfs/dbraw/zinc/12/75/72/1364127572.db2.gz AZFMRSHAIFXEEW-CVEARBPZSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)C[C@@H]1CCCN1C(=O)CN(C)CC(C)(C)C ZINC001402911611 1364127576 /nfs/dbraw/zinc/12/75/76/1364127576.db2.gz AZFMRSHAIFXEEW-CVEARBPZSA-N 1 3 329.504 2.635 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@@H]1CCCN1C(=O)CC[NH+](C)C ZINC001402932855 1364145587 /nfs/dbraw/zinc/14/55/87/1364145587.db2.gz NCNRKAZFKJFQLV-SFHVURJKSA-N 1 3 335.467 2.509 10 0 EFAEHO C[C@@H](NCc1cccnc1)[C@H](C)NC(=O)C1(C[NH+](C)C)CCCCC1 ZINC001402988371 1364185546 /nfs/dbraw/zinc/18/55/46/1364185546.db2.gz DKMYVWPSIMJJPC-SJORKVTESA-N 1 3 346.519 2.577 10 0 EFAEHO C[C@H](NCc1cccnc1)[C@H](C)NC(=O)C1(C[NH+](C)C)CCCCC1 ZINC001402988368 1364185904 /nfs/dbraw/zinc/18/59/04/1364185904.db2.gz DKMYVWPSIMJJPC-IRXDYDNUSA-N 1 3 346.519 2.577 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H](C)[NH2+]CCc1ccc(Cl)cc1 ZINC001403003546 1364202011 /nfs/dbraw/zinc/20/20/11/1364202011.db2.gz IZPVGHLFOHSCRO-CHWSQXEVSA-N 1 3 348.878 2.640 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)CC(C)(C)C)c1 ZINC001403003627 1364202016 /nfs/dbraw/zinc/20/20/16/1364202016.db2.gz JVZUHPDPRDMKPR-SJORKVTESA-N 1 3 333.520 2.956 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)c1 ZINC001403039104 1364243544 /nfs/dbraw/zinc/24/35/44/1364243544.db2.gz VSMHGWWBYGVBFN-IRXDYDNUSA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC(C)(C)C[NH2+]C[C@H]1CCC(F)(F)C1)N(C)C ZINC001403086330 1364292016 /nfs/dbraw/zinc/29/20/16/1364292016.db2.gz ZSSPKMRBCGALHZ-GJZGRUSLSA-N 1 3 347.494 2.836 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[N@H+](C)CC1CCC2(CC2)CC1 ZINC001403138672 1364354491 /nfs/dbraw/zinc/35/44/91/1364354491.db2.gz PBGGUVPGGVYYHM-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001403138672 1364354497 /nfs/dbraw/zinc/35/44/97/1364354497.db2.gz PBGGUVPGGVYYHM-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@H+](C)CC1CCC(C)(C)CC1)N(C)C ZINC001403152242 1364371951 /nfs/dbraw/zinc/37/19/51/1364371951.db2.gz RDSFZWSYFCETDP-NVXWUHKLSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@@H+](C)CC1CCC(C)(C)CC1)N(C)C ZINC001403152242 1364371956 /nfs/dbraw/zinc/37/19/56/1364371956.db2.gz RDSFZWSYFCETDP-NVXWUHKLSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccc(CN(C)[C@H](C)CNC(=O)C(C)(C)[NH+]2CCCC2)cc1F ZINC001403155232 1364374090 /nfs/dbraw/zinc/37/40/90/1364374090.db2.gz DFGMWPUNWFOHAU-MRXNPFEDSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC001403155447 1364374654 /nfs/dbraw/zinc/37/46/54/1364374654.db2.gz CSKZMCNBCHTGGY-CYBMUJFWSA-N 1 3 345.409 2.640 10 0 EFAEHO C[C@H](CNC(=O)CC[NH+](C)C)N(C)[C@H](C)c1cccc(Cl)c1 ZINC001403168018 1364388917 /nfs/dbraw/zinc/38/89/17/1364388917.db2.gz LUKQZRYMERNKPP-ZIAGYGMSSA-N 1 3 325.884 2.789 10 0 EFAEHO C[C@H](CNC(=O)CC[NH+](C)C)N(C)[C@@H](C)c1cccc(Cl)c1 ZINC001403168014 1364389152 /nfs/dbraw/zinc/38/91/52/1364389152.db2.gz LUKQZRYMERNKPP-KGLIPLIRSA-N 1 3 325.884 2.789 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[NH2+]CC2CCC(F)(F)CC2)C1 ZINC001403271856 1364485653 /nfs/dbraw/zinc/48/56/53/1364485653.db2.gz WSIFSCPWYIPOSH-INIZCTEOSA-N 1 3 345.478 2.590 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1C ZINC001403272821 1364486039 /nfs/dbraw/zinc/48/60/39/1364486039.db2.gz XDTWXWOCLNJRFC-LJQANCHMSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1C ZINC001403272756 1364486050 /nfs/dbraw/zinc/48/60/50/1364486050.db2.gz XDTWXWOCLNJRFC-IBGZPJMESA-N 1 3 331.504 2.582 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+][C@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001439132979 1389007679 /nfs/dbraw/zinc/00/76/79/1389007679.db2.gz QPNNJRMGDSNQND-OAUYIBNBSA-N 1 3 337.895 2.762 10 0 EFAEHO CCc1cccc(CN2CC([C@@H](C)NC(=O)C[C@H]3CC[N@H+](C)C3)C2)c1 ZINC001403321567 1364538994 /nfs/dbraw/zinc/53/89/94/1364538994.db2.gz GTECKDQXFOTWPT-VQIMIIECSA-N 1 3 343.515 2.527 10 0 EFAEHO CCc1cccc(CN2CC([C@@H](C)NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)c1 ZINC001403321567 1364538999 /nfs/dbraw/zinc/53/89/99/1364538999.db2.gz GTECKDQXFOTWPT-VQIMIIECSA-N 1 3 343.515 2.527 10 0 EFAEHO CC(C)CC[N@H+](C)[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001403345462 1364558433 /nfs/dbraw/zinc/55/84/33/1364558433.db2.gz WWZRSPKIYSAHNT-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)CC[N@@H+](C)[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001403345462 1364558437 /nfs/dbraw/zinc/55/84/37/1364558437.db2.gz WWZRSPKIYSAHNT-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C1C[NH+](CCC2CCCCC2)C1)N(C)C ZINC001403341037 1364555627 /nfs/dbraw/zinc/55/56/27/1364555627.db2.gz AYMANTBYWXQMLL-LPHOPBHVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@H+](CCCF)CC1(C)C)N1CCCCC1 ZINC001403392990 1364597967 /nfs/dbraw/zinc/59/79/67/1364597967.db2.gz UNINODOJWCKIDD-IAGOWNOFSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@@H+](CCCF)CC1(C)C)N1CCCCC1 ZINC001403392990 1364597971 /nfs/dbraw/zinc/59/79/71/1364597971.db2.gz UNINODOJWCKIDD-IAGOWNOFSA-N 1 3 341.515 2.683 10 0 EFAEHO CN(CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC(C)(C)C)C[C@H]21)CC(C)(C)C ZINC001403395426 1364600411 /nfs/dbraw/zinc/60/04/11/1364600411.db2.gz ASFPMWVUZOSWTJ-OSYLJGHBSA-N 1 3 337.552 2.695 10 0 EFAEHO CN(CC(=O)NC[C@@H]1[C@H]2C[N@H+](CCC(C)(C)C)C[C@H]21)CC(C)(C)C ZINC001403395426 1364600416 /nfs/dbraw/zinc/60/04/16/1364600416.db2.gz ASFPMWVUZOSWTJ-OSYLJGHBSA-N 1 3 337.552 2.695 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@]2(C)C[N@H+](CCC(C)(C)C)C[C@]2(C)C1 ZINC001403399602 1364604922 /nfs/dbraw/zinc/60/49/22/1364604922.db2.gz HNAGQEPJMDARIF-BGYRXZFFSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@]2(C)C[N@@H+](CCC(C)(C)C)C[C@]2(C)C1 ZINC001403399602 1364604927 /nfs/dbraw/zinc/60/49/27/1364604927.db2.gz HNAGQEPJMDARIF-BGYRXZFFSA-N 1 3 337.552 2.935 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC2(C1)CCCN(C/C=C\c1ccccc1)C2 ZINC001403410641 1364612936 /nfs/dbraw/zinc/61/29/36/1364612936.db2.gz NNHSIYDEJWVSTR-POHAHGRESA-N 1 3 341.499 2.576 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001403412821 1364616502 /nfs/dbraw/zinc/61/65/02/1364616502.db2.gz KATQQAWKVFKQOL-IPMKNSEASA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001403412821 1364616505 /nfs/dbraw/zinc/61/65/05/1364616505.db2.gz KATQQAWKVFKQOL-IPMKNSEASA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C3CCC3)C2)c(C)c1 ZINC001403418144 1364622579 /nfs/dbraw/zinc/62/25/79/1364622579.db2.gz POEXGTYVPDAMLE-UAPYVXQJSA-N 1 3 343.515 2.772 10 0 EFAEHO Cc1cccc([C@H](C)[N@H+]2C[C@@H]3[C@@H](CNC(=O)CN(C)C(C)C)[C@@H]3C2)c1 ZINC001403428301 1364632011 /nfs/dbraw/zinc/63/20/11/1364632011.db2.gz VYFGLIPWEDCWOX-FRYIKTPZSA-N 1 3 343.515 2.690 10 0 EFAEHO Cc1cccc([C@H](C)[N@@H+]2C[C@@H]3[C@@H](CNC(=O)CN(C)C(C)C)[C@@H]3C2)c1 ZINC001403428301 1364632017 /nfs/dbraw/zinc/63/20/17/1364632017.db2.gz VYFGLIPWEDCWOX-FRYIKTPZSA-N 1 3 343.515 2.690 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CCCC3CCCC3)C[C@H]21 ZINC001403428221 1364632442 /nfs/dbraw/zinc/63/24/42/1364632442.db2.gz VRCXEDKTLGWJOZ-LDLYASANSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+](CCCC3CCCC3)C[C@H]21 ZINC001403428221 1364632446 /nfs/dbraw/zinc/63/24/46/1364632446.db2.gz VRCXEDKTLGWJOZ-LDLYASANSA-N 1 3 335.536 2.591 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[C@@H](C[NH2+]CC2CCC(C)CC2)C1)N(C)C ZINC001403429077 1364633215 /nfs/dbraw/zinc/63/32/15/1364633215.db2.gz UQMNXEIBBLGHLI-LKIAZTKLSA-N 1 3 337.552 2.883 10 0 EFAEHO C[C@H](CCNC(=O)CN(C)CC(C)(C)C)[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001403450300 1364652123 /nfs/dbraw/zinc/65/21/23/1364652123.db2.gz WDFRCHPHRKGBOF-CABCVRRESA-N 1 3 347.494 2.884 10 0 EFAEHO C[C@H](CCNC(=O)CN(C)CC(C)(C)C)[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001403450303 1364652428 /nfs/dbraw/zinc/65/24/28/1364652428.db2.gz WDFRCHPHRKGBOF-HUUCEWRRSA-N 1 3 347.494 2.884 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+][C@H](C)c1cc(F)ccc1F ZINC001403476398 1364681079 /nfs/dbraw/zinc/68/10/79/1364681079.db2.gz DFCAFLCNXXEEGN-UONOGXRCSA-N 1 3 341.446 2.850 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1F ZINC001403476412 1364681257 /nfs/dbraw/zinc/68/12/57/1364681257.db2.gz DFCAFLCNXXEEGN-ZIAGYGMSSA-N 1 3 341.446 2.850 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C[NH2+]Cc1ccc(C)c(F)c1)C1CC1)N(C)C ZINC001403508323 1364714057 /nfs/dbraw/zinc/71/40/57/1364714057.db2.gz MLBURNKCCQXMAV-MOPGFXCFSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C[NH2+]Cc1ccc(C)cc1)C1CC1)N(C)C ZINC001403511973 1364717008 /nfs/dbraw/zinc/71/70/08/1364717008.db2.gz SPVIUXUIBSBVJU-RTBURBONSA-N 1 3 331.504 2.662 10 0 EFAEHO COc1cccc([C@@H](C)N(C)CCNC(=O)[C@@H]2CCC[N@@H+]2C(C)C)c1 ZINC001403555405 1364757480 /nfs/dbraw/zinc/75/74/80/1364757480.db2.gz GFUFPLCIGCSNAC-APWZRJJASA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@@H](C)N(C)CCNC(=O)[C@@H]2CCC[N@H+]2C(C)C)c1 ZINC001403555405 1364757481 /nfs/dbraw/zinc/75/74/81/1364757481.db2.gz GFUFPLCIGCSNAC-APWZRJJASA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@H](C)N(C)CCNC(=O)[C@H]2CCC[N@@H+]2C(C)C)c1 ZINC001403555414 1364757647 /nfs/dbraw/zinc/75/76/47/1364757647.db2.gz GFUFPLCIGCSNAC-QFBILLFUSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@H](C)N(C)CCNC(=O)[C@H]2CCC[N@H+]2C(C)C)c1 ZINC001403555414 1364757653 /nfs/dbraw/zinc/75/76/53/1364757653.db2.gz GFUFPLCIGCSNAC-QFBILLFUSA-N 1 3 347.503 2.677 10 0 EFAEHO C[C@H](CN(C)C(=O)CC[NH+](C)C)NCc1cc(Cl)cc(Cl)c1 ZINC001403590969 1364793793 /nfs/dbraw/zinc/79/37/93/1364793793.db2.gz BEHNJDORWUIWIV-GFCCVEGCSA-N 1 3 346.302 2.882 10 0 EFAEHO C[C@@H](CN(C)C(=O)CC[NH+](C)C)NCc1cc(Cl)cc(Cl)c1 ZINC001403590977 1364793991 /nfs/dbraw/zinc/79/39/91/1364793991.db2.gz BEHNJDORWUIWIV-LBPRGKRZSA-N 1 3 346.302 2.882 10 0 EFAEHO C[C@H](CN(C)C(=O)C[C@@H]1CC[N@H+](C)C1)NCc1cc2ccccc2o1 ZINC001403605052 1364808902 /nfs/dbraw/zinc/80/89/02/1364808902.db2.gz CJDBBOKMELVHQY-CVEARBPZSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@H](CN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1)NCc1cc2ccccc2o1 ZINC001403605052 1364808905 /nfs/dbraw/zinc/80/89/05/1364808905.db2.gz CJDBBOKMELVHQY-CVEARBPZSA-N 1 3 343.471 2.711 10 0 EFAEHO CN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1ccccc1C1CC1 ZINC001437500369 1387702360 /nfs/dbraw/zinc/70/23/60/1387702360.db2.gz ZKOYTMWJFIGLQO-UHFFFAOYSA-N 1 3 343.515 2.986 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC001403665070 1364855154 /nfs/dbraw/zinc/85/51/54/1364855154.db2.gz KWQMFFAVJVWXEH-LPHOPBHVSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC001403665070 1364855156 /nfs/dbraw/zinc/85/51/56/1364855156.db2.gz KWQMFFAVJVWXEH-LPHOPBHVSA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@H]1C[C@@H]([NH2+]Cc2ccsc2)CN1C(=O)CN(C)CC(C)(C)C ZINC001403730987 1364890261 /nfs/dbraw/zinc/89/02/61/1364890261.db2.gz DAZVGACSVXQIRL-GOEBONIOSA-N 1 3 337.533 2.805 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)cc1C ZINC001403761159 1364909798 /nfs/dbraw/zinc/90/97/98/1364909798.db2.gz BHXYVOSAZZPSOO-MJGOQNOKSA-N 1 3 331.504 2.723 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)cc1C ZINC001403761155 1364910344 /nfs/dbraw/zinc/91/03/44/1364910344.db2.gz BHXYVOSAZZPSOO-IEBWSBKVSA-N 1 3 331.504 2.723 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@]12CCC[C@H]1N(Cc1cccc(F)c1)CC2 ZINC001403778137 1364928676 /nfs/dbraw/zinc/92/86/76/1364928676.db2.gz RBPHNJKRSQWFRB-QUCCMNQESA-N 1 3 347.478 2.781 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@]12CCC[C@H]1N(Cc1cccc(F)c1)CC2 ZINC001403778137 1364928679 /nfs/dbraw/zinc/92/86/79/1364928679.db2.gz RBPHNJKRSQWFRB-QUCCMNQESA-N 1 3 347.478 2.781 10 0 EFAEHO Cc1cccc(CN(C)CCNC(=O)[C@H](C(C)C)[NH+]2CCCC2)c1 ZINC001403791169 1364943603 /nfs/dbraw/zinc/94/36/03/1364943603.db2.gz QLMWFOBPTUJLOP-IBGZPJMESA-N 1 3 331.504 2.663 10 0 EFAEHO CCc1cccc(CN2CCC[C@@H](NC(=O)CC[NH+](C)C)[C@@H]2C)c1 ZINC001403801350 1364955045 /nfs/dbraw/zinc/95/50/45/1364955045.db2.gz SBQNUBLUEFDDET-QFBILLFUSA-N 1 3 331.504 2.670 10 0 EFAEHO CCc1cccc(CN2CCC[C@@H](NC(=O)CC[NH+](C)C)[C@H]2C)c1 ZINC001403801360 1364955361 /nfs/dbraw/zinc/95/53/61/1364955361.db2.gz SBQNUBLUEFDDET-VQIMIIECSA-N 1 3 331.504 2.670 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@H](C[NH2+]CC3CC4(CCC4)C3)C2)CCC1 ZINC001403811959 1364967407 /nfs/dbraw/zinc/96/74/07/1364967407.db2.gz XWWNWTPWALNKEC-FUHWJXTLSA-N 1 3 347.547 2.926 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@]12CCC[C@@H]1N(Cc1ccc(F)cc1)CC2 ZINC001403823198 1364976715 /nfs/dbraw/zinc/97/67/15/1364976715.db2.gz PPZPADRMTVERAD-ICSRJNTNSA-N 1 3 347.478 2.781 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@]12CCC[C@@H]1N(Cc1ccc(F)cc1)CC2 ZINC001403823189 1364977250 /nfs/dbraw/zinc/97/72/50/1364977250.db2.gz PPZPADRMTVERAD-AZUAARDMSA-N 1 3 347.478 2.781 10 0 EFAEHO CC[N@H+](CCNC(=O)[C@H](C(C)C)N(C)C)CC1CCC(C)CC1 ZINC001403862881 1365004645 /nfs/dbraw/zinc/00/46/45/1365004645.db2.gz VNQVEVKHLCDDGM-ABHNRTSZSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[N@@H+](CCNC(=O)[C@H](C(C)C)N(C)C)CC1CCC(C)CC1 ZINC001403862881 1365004646 /nfs/dbraw/zinc/00/46/46/1365004646.db2.gz VNQVEVKHLCDDGM-ABHNRTSZSA-N 1 3 325.541 2.837 10 0 EFAEHO CC[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC1CC(C)C1 ZINC001403910817 1365033605 /nfs/dbraw/zinc/03/36/05/1365033605.db2.gz HFFXXNDINMOPDB-LADRWXRNSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC1CC(C)C1 ZINC001403910817 1365033607 /nfs/dbraw/zinc/03/36/07/1365033607.db2.gz HFFXXNDINMOPDB-LADRWXRNSA-N 1 3 341.515 2.683 10 0 EFAEHO CCN(CCNC(=O)C[NH+]1[C@@H](C)CC[C@@H]1C)Cc1ccc(OC)cc1 ZINC001403948785 1365090847 /nfs/dbraw/zinc/09/08/47/1365090847.db2.gz JWXTUCVJKPVGKQ-IRXDYDNUSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1CC[NH+](CCCC(C)C)CC1)N(C)C ZINC001403979611 1365127562 /nfs/dbraw/zinc/12/75/62/1365127562.db2.gz XRVPVWJCDJVERI-SJLPKXTDSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)C1CCN(C/C=C\Cl)CC1)[NH+](C)C ZINC001403981462 1365129260 /nfs/dbraw/zinc/12/92/60/1365129260.db2.gz DXJKBDXQOBFABC-PWZFOLRSSA-N 1 3 329.916 2.542 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@H]1CCCN1Cc1ccc(C2CC2)cc1 ZINC001404013854 1365168123 /nfs/dbraw/zinc/16/81/23/1365168123.db2.gz FOFGOVNOLNAKGZ-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@H]1CCCN1Cc1ccc(C2CC2)cc1 ZINC001404013854 1365168127 /nfs/dbraw/zinc/16/81/27/1365168127.db2.gz FOFGOVNOLNAKGZ-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001404097921 1365257566 /nfs/dbraw/zinc/25/75/66/1365257566.db2.gz SEUZVYCGBKNJFK-LPHOPBHVSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001404097921 1365257569 /nfs/dbraw/zinc/25/75/69/1365257569.db2.gz SEUZVYCGBKNJFK-LPHOPBHVSA-N 1 3 341.515 2.683 10 0 EFAEHO CN(CCNC(=O)[C@H]1CCC[C@@H]2CCC[N@@H+]21)Cc1ccc(CF)cc1 ZINC001437528547 1387733060 /nfs/dbraw/zinc/73/30/60/1387733060.db2.gz BFMIWECZABLFJY-RTBURBONSA-N 1 3 347.478 2.721 10 0 EFAEHO CN(CCNC(=O)[C@H]1CCC[C@@H]2CCC[N@H+]21)Cc1ccc(CF)cc1 ZINC001437528547 1387733063 /nfs/dbraw/zinc/73/30/63/1387733063.db2.gz BFMIWECZABLFJY-RTBURBONSA-N 1 3 347.478 2.721 10 0 EFAEHO CC[C@H](C(=O)NCC[N@H+](C[C@@H]1CCCC(F)(F)C1)C1CC1)N(C)C ZINC001404234528 1365378160 /nfs/dbraw/zinc/37/81/60/1365378160.db2.gz KZZMUVTWUOXTPP-GDBMZVCRSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](C(=O)NCC[N@@H+](C[C@@H]1CCCC(F)(F)C1)C1CC1)N(C)C ZINC001404234528 1365378162 /nfs/dbraw/zinc/37/81/62/1365378162.db2.gz KZZMUVTWUOXTPP-GDBMZVCRSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+][C@H](C)c1ccc(Cl)cc1 ZINC001404338645 1365460722 /nfs/dbraw/zinc/46/07/22/1365460722.db2.gz ZMDKUDFGVOMHLT-CQSZACIVSA-N 1 3 325.884 2.789 10 0 EFAEHO C[C@@H]([NH2+]CCC1CCCC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001404405355 1365508269 /nfs/dbraw/zinc/50/82/69/1365508269.db2.gz OKGFEJNZTFKZJP-QGZVFWFLSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CCC[N@@H+](CCC2CCCC2)C1 ZINC001404753117 1365802529 /nfs/dbraw/zinc/80/25/29/1365802529.db2.gz GZHLZOYVGXZTON-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CCC[N@H+](CCC2CCCC2)C1 ZINC001404753117 1365802524 /nfs/dbraw/zinc/80/25/24/1365802524.db2.gz GZHLZOYVGXZTON-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1cc(C)cc(CN2CC(CNC(=O)C[NH+]3[C@@H](C)CC[C@@H]3C)C2)c1 ZINC001404926664 1365913765 /nfs/dbraw/zinc/91/37/65/1365913765.db2.gz GDZAICNPMFILGG-ROUUACIJSA-N 1 3 343.515 2.724 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)C[NH+]2[C@@H](C)CC[C@@H]2C)c1 ZINC001437566075 1387775009 /nfs/dbraw/zinc/77/50/09/1387775009.db2.gz QGBPZSPZGVEWNE-ROUUACIJSA-N 1 3 331.504 2.724 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)[C@@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001405163502 1366071696 /nfs/dbraw/zinc/07/16/96/1366071696.db2.gz ZMFJSDJLOXYUER-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)[C@@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001405163502 1366071701 /nfs/dbraw/zinc/07/17/01/1366071701.db2.gz ZMFJSDJLOXYUER-HXUWFJFHSA-N 1 3 343.515 2.939 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](CC)[NH2+]CC1CC2(CCC2)C1 ZINC001405260346 1366122269 /nfs/dbraw/zinc/12/22/69/1366122269.db2.gz TXEPIELCBBBQBH-ROUUACIJSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccc(C)nc1C ZINC001405262210 1366122834 /nfs/dbraw/zinc/12/28/34/1366122834.db2.gz UIGCJGIPBQQODV-OALUTQOASA-N 1 3 346.519 2.556 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)[N@H+](C)C1CCCC1)NCc1ccccn1 ZINC001405273567 1366127959 /nfs/dbraw/zinc/12/79/59/1366127959.db2.gz UMUGUMAYJUENDT-INIZCTEOSA-N 1 3 346.519 2.719 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)[N@@H+](C)C1CCCC1)NCc1ccccn1 ZINC001405273567 1366127963 /nfs/dbraw/zinc/12/79/63/1366127963.db2.gz UMUGUMAYJUENDT-INIZCTEOSA-N 1 3 346.519 2.719 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)NCc1cc2ccccc2o1 ZINC001405348103 1366156470 /nfs/dbraw/zinc/15/64/70/1366156470.db2.gz WKGXKGPGIRNWDH-WBVHZDCISA-N 1 3 343.471 2.759 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)NCc1cc2ccccc2o1 ZINC001405348103 1366156472 /nfs/dbraw/zinc/15/64/72/1366156472.db2.gz WKGXKGPGIRNWDH-WBVHZDCISA-N 1 3 343.471 2.759 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H]1CCCc2ccccc21 ZINC001405358841 1366162178 /nfs/dbraw/zinc/16/21/78/1366162178.db2.gz CVRVTSDKZZWAEK-PKOBYXMFSA-N 1 3 331.504 2.889 10 0 EFAEHO C[NH+](C)CCC(=O)NC1(CNCc2sccc2Cl)CCCC1 ZINC001405410046 1366181209 /nfs/dbraw/zinc/18/12/09/1366181209.db2.gz RGEBRYZRDCZOCC-UHFFFAOYSA-N 1 3 343.924 2.872 10 0 EFAEHO Cc1ccc(F)c(CNCC2(NC(=O)CC[NH+](C)C)CCCC2)c1 ZINC001405411373 1366181603 /nfs/dbraw/zinc/18/16/03/1366181603.db2.gz UJJFQQGAAWWIQG-UHFFFAOYSA-N 1 3 335.467 2.604 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@](C)(C[NH2+]Cc1ccccc1)C1CC1 ZINC001405428644 1366194239 /nfs/dbraw/zinc/19/42/39/1366194239.db2.gz HAGGMYUXSQPBJU-TZIWHRDSSA-N 1 3 343.515 2.934 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N[C@](C)(CNCc2ccccc2F)C2CC2)CC[N@@H+]1C ZINC001405438038 1366200078 /nfs/dbraw/zinc/20/00/78/1366200078.db2.gz QEXGJQIHPCPGJP-WIBUTAKZSA-N 1 3 347.478 2.540 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N[C@](C)(CNCc2ccccc2F)C2CC2)CC[N@H+]1C ZINC001405438038 1366200079 /nfs/dbraw/zinc/20/00/79/1366200079.db2.gz QEXGJQIHPCPGJP-WIBUTAKZSA-N 1 3 347.478 2.540 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1CC[C@H]([NH2+]C/C=C/Cl)CC1 ZINC001405518192 1366262420 /nfs/dbraw/zinc/26/24/20/1366262420.db2.gz AEUNYEHIXSAYBD-WCDLWBILSA-N 1 3 327.900 2.629 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H]([NH2+]C[C@@H]3CC[C@H]4C[C@H]4C3)CC2)CCC1 ZINC001405520999 1366265749 /nfs/dbraw/zinc/26/57/49/1366265749.db2.gz PNZFAQYGSIDFJF-RHQZKXFESA-N 1 3 347.547 2.924 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[C@H]([NH2+]Cc2ccsc2)CC1)N(C)C ZINC001405528570 1366272612 /nfs/dbraw/zinc/27/26/12/1366272612.db2.gz YRUZYQIITZFFML-ULQDDVLXSA-N 1 3 337.533 2.851 10 0 EFAEHO CC[C@@H](C(=O)NCc1ccc(C[NH2+]Cc2ccsc2)cc1)N(C)C ZINC001405554689 1366290646 /nfs/dbraw/zinc/29/06/46/1366290646.db2.gz AOLOFXOLAPLVGG-SFHVURJKSA-N 1 3 345.512 2.994 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@@H](C)c1cccc(OC)c1 ZINC001405591617 1366309326 /nfs/dbraw/zinc/30/93/26/1366309326.db2.gz HKYAMXKSRLUEEC-FUHWJXTLSA-N 1 3 347.503 2.679 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CCCN1C)CC2 ZINC001405612688 1366313703 /nfs/dbraw/zinc/31/37/03/1366313703.db2.gz XVIQODYCTFBJTQ-SFHVURJKSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)CCC[N@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CCCN1C)CC2 ZINC001405612688 1366313705 /nfs/dbraw/zinc/31/37/05/1366313705.db2.gz XVIQODYCTFBJTQ-SFHVURJKSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)CCC[NH+]1CC2(C1)CCN(C(=O)C1(N(C)C)CCC1)CC2 ZINC001405782696 1366411433 /nfs/dbraw/zinc/41/14/33/1366411433.db2.gz USWFGNFNSYGSPH-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C[C@@H](C)N(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001405833461 1366448626 /nfs/dbraw/zinc/44/86/26/1366448626.db2.gz QLDIBRRDQHNVPP-CVEARBPZSA-N 1 3 347.503 2.677 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C[C@@H](C)N(C)C(=O)Cc2c[nH]cn2)c1 ZINC001405866409 1366475366 /nfs/dbraw/zinc/47/53/66/1366475366.db2.gz GHRWHLFFJDFYMB-CVEARBPZSA-N 1 3 328.460 2.767 10 0 EFAEHO C[C@@H](C[NH2+]CC1CCC(C)(C)CC1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001405873107 1366481302 /nfs/dbraw/zinc/48/13/02/1366481302.db2.gz SRNUSMHASAZGOM-SJORKVTESA-N 1 3 337.552 2.981 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(C)nc1C ZINC001405901722 1366506353 /nfs/dbraw/zinc/50/63/53/1366506353.db2.gz FEVMLGFXWXHCDV-LPHOPBHVSA-N 1 3 346.519 2.509 10 0 EFAEHO CC(C)C[C@H](C[NH2+]Cc1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001405925301 1366526479 /nfs/dbraw/zinc/52/64/79/1366526479.db2.gz DEOYZNQTKWVAJW-IEBWSBKVSA-N 1 3 331.504 2.649 10 0 EFAEHO CC[N@H+](CCNC(=O)CN1CC[C@@H](C)C1)CC[C@@H]1CCCC1(F)F ZINC001437624798 1387848596 /nfs/dbraw/zinc/84/85/96/1387848596.db2.gz CELHDDJXHRBBLO-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN1CC[C@@H](C)C1)CC[C@@H]1CCCC1(F)F ZINC001437624798 1387848599 /nfs/dbraw/zinc/84/85/99/1387848599.db2.gz CELHDDJXHRBBLO-CVEARBPZSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1ccc2c(c1)CCC2)C(C)C)N(C)C ZINC001406074772 1367186029 /nfs/dbraw/zinc/18/60/29/1367186029.db2.gz XPGPXPKDVVUEKK-VQTJNVASSA-N 1 3 345.531 2.746 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccc2c(c1)CCC2)C(C)C)N(C)C ZINC001406074776 1367186588 /nfs/dbraw/zinc/18/65/88/1367186588.db2.gz XPGPXPKDVVUEKK-WOJBJXKFSA-N 1 3 345.531 2.746 10 0 EFAEHO C[C@H](c1ccccc1)N(C)CCN(C)C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001406120970 1367266073 /nfs/dbraw/zinc/26/60/73/1367266073.db2.gz CUZIFWZEQKVONJ-SCTDSRPQSA-N 1 3 331.504 2.868 10 0 EFAEHO C[C@H](c1ccccc1)N(C)CCN(C)C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001406120970 1367266078 /nfs/dbraw/zinc/26/60/78/1367266078.db2.gz CUZIFWZEQKVONJ-SCTDSRPQSA-N 1 3 331.504 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+][C@@H]1CCc2c1cccc2F ZINC001406307711 1367461515 /nfs/dbraw/zinc/46/15/15/1367461515.db2.gz KNNLFGXWFFGOSM-RDTXWAMCSA-N 1 3 335.467 2.638 10 0 EFAEHO C[C@H](CN[C@H](C)c1ccccc1F)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001406395066 1367545884 /nfs/dbraw/zinc/54/58/84/1367545884.db2.gz XFOUCLNBWHHYQT-QXSJWSMHSA-N 1 3 335.467 2.711 10 0 EFAEHO C[C@H](CN[C@H](C)c1ccccc1F)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001406395066 1367545888 /nfs/dbraw/zinc/54/58/88/1367545888.db2.gz XFOUCLNBWHHYQT-QXSJWSMHSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]Cc1cccc(F)c1 ZINC001406413955 1367562157 /nfs/dbraw/zinc/56/21/57/1367562157.db2.gz UZXJYVICWVLIGD-CRAIPNDOSA-N 1 3 335.467 2.683 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](CC)C[C@H]1CCC(F)(F)C1 ZINC001437647433 1387887327 /nfs/dbraw/zinc/88/73/27/1387887327.db2.gz CSWYFTNLQISCOX-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](CC)C[C@H]1CCC(F)(F)C1 ZINC001437647433 1387887335 /nfs/dbraw/zinc/88/73/35/1387887335.db2.gz CSWYFTNLQISCOX-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CCN(CCNC(=O)C[NH+]1[C@@H](C)CC[C@@H]1C)Cc1cc(F)ccc1C ZINC001437648785 1387889387 /nfs/dbraw/zinc/88/93/87/1387889387.db2.gz IJMURNJAEKEICS-IRXDYDNUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN(CCNC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C)Cc1cc(F)ccc1C ZINC001437648772 1387889521 /nfs/dbraw/zinc/88/95/21/1387889521.db2.gz IJMURNJAEKEICS-CALCHBBNSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN(CCNC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C)Cc1cc(F)ccc1C ZINC001437648772 1387889530 /nfs/dbraw/zinc/88/95/30/1387889530.db2.gz IJMURNJAEKEICS-CALCHBBNSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](C[NH2+]C[C@H]1CCCC(F)(F)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001406513260 1367669617 /nfs/dbraw/zinc/66/96/17/1367669617.db2.gz CEMLNCPWTVAKTJ-GJZGRUSLSA-N 1 3 345.478 2.781 10 0 EFAEHO C[C@@H](C[N@H+](C)CC[C@@H]1CCCC1(F)F)NC(=O)C1(N(C)C)CCC1 ZINC001406599589 1367781369 /nfs/dbraw/zinc/78/13/69/1367781369.db2.gz FXBITKRVIPVJGU-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC[C@@H]1CCCC1(F)F)NC(=O)C1(N(C)C)CCC1 ZINC001406599589 1367781378 /nfs/dbraw/zinc/78/13/78/1367781378.db2.gz FXBITKRVIPVJGU-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)Cc2ccc(C)c(F)c2)CC[N@@H+]1C ZINC001406610979 1367802468 /nfs/dbraw/zinc/80/24/68/1367802468.db2.gz MYFDFRULRPXGSY-HHXXYDBFSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)Cc2ccc(C)c(F)c2)CC[N@H+]1C ZINC001406610979 1367802472 /nfs/dbraw/zinc/80/24/72/1367802472.db2.gz MYFDFRULRPXGSY-HHXXYDBFSA-N 1 3 349.494 2.801 10 0 EFAEHO CCN(CCNC(=O)[C@H]1C[NH+]2CCC1CC2)[C@H](C)c1ccc(F)cc1 ZINC001492954026 1367862434 /nfs/dbraw/zinc/86/24/34/1367862434.db2.gz OSIXHUIBPWMLRO-BEFAXECRSA-N 1 3 347.478 2.667 10 0 EFAEHO C[C@H](C[N@H+](C)C[C@H]1CCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001406667666 1367893109 /nfs/dbraw/zinc/89/31/09/1367893109.db2.gz LCRJYGFKOSTYLK-CABCVRRESA-N 1 3 347.494 2.836 10 0 EFAEHO C[C@H](C[N@@H+](C)C[C@H]1CCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001406667666 1367893113 /nfs/dbraw/zinc/89/31/13/1367893113.db2.gz LCRJYGFKOSTYLK-CABCVRRESA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@H+](C)Cc1ccc(C(F)F)cc1)N(C)C ZINC001406698976 1367942426 /nfs/dbraw/zinc/94/24/26/1367942426.db2.gz RUEYYZABWHIYKF-CZUORRHYSA-N 1 3 341.446 2.901 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@@H+](C)Cc1ccc(C(F)F)cc1)N(C)C ZINC001406698976 1367942428 /nfs/dbraw/zinc/94/24/28/1367942428.db2.gz RUEYYZABWHIYKF-CZUORRHYSA-N 1 3 341.446 2.901 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)Cc1ccc(C(F)F)cc1)N(C)C ZINC001406698978 1367943239 /nfs/dbraw/zinc/94/32/39/1367943239.db2.gz RUEYYZABWHIYKF-XJKSGUPXSA-N 1 3 341.446 2.901 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc(C(F)F)cc1)N(C)C ZINC001406698978 1367943241 /nfs/dbraw/zinc/94/32/41/1367943241.db2.gz RUEYYZABWHIYKF-XJKSGUPXSA-N 1 3 341.446 2.901 10 0 EFAEHO Cc1ccc(CNC[C@H](NC(=O)CC[NH+](C)C)C2CC2)c(Cl)c1 ZINC001406775471 1368033001 /nfs/dbraw/zinc/03/30/01/1368033001.db2.gz JSXRLMZMJKFOMV-KRWDZBQOSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@@H]1CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001406837475 1368111094 /nfs/dbraw/zinc/11/10/94/1368111094.db2.gz GKNCWFZHYONBGE-RTBURBONSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@@H]1CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001406837475 1368111101 /nfs/dbraw/zinc/11/11/01/1368111101.db2.gz GKNCWFZHYONBGE-RTBURBONSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCN1CC1CC2(CCC2)C1)[NH+](CC)CC ZINC001406845202 1368119759 /nfs/dbraw/zinc/11/97/59/1368119759.db2.gz FQBTWPVTAMHRDH-QZTJIDSGSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)[C@H](C)c1cccc(OC)c1 ZINC001492956707 1368169511 /nfs/dbraw/zinc/16/95/11/1368169511.db2.gz MGCXSOZVLVZPDE-GPMSIDNRSA-N 1 3 347.503 2.535 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)[C@H](C)c1cccc(OC)c1 ZINC001492956707 1368169520 /nfs/dbraw/zinc/16/95/20/1368169520.db2.gz MGCXSOZVLVZPDE-GPMSIDNRSA-N 1 3 347.503 2.535 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)[C@H]2CCCC[N@@H+]2C2CCCC2)CC1 ZINC001406958622 1368249202 /nfs/dbraw/zinc/24/92/02/1368249202.db2.gz QEVQRECETYMMLG-DOTOQJQBSA-N 1 3 339.499 2.770 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)[C@H]2CCCC[N@H+]2C2CCCC2)CC1 ZINC001406958622 1368249210 /nfs/dbraw/zinc/24/92/10/1368249210.db2.gz QEVQRECETYMMLG-DOTOQJQBSA-N 1 3 339.499 2.770 10 0 EFAEHO CCC(CC)C[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001406961198 1368251242 /nfs/dbraw/zinc/25/12/42/1368251242.db2.gz RIOGZIHLLHIRIA-IBGZPJMESA-N 1 3 341.515 2.874 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)NCC2(NCc3ccccc3)CC2)C1 ZINC001406992837 1368290483 /nfs/dbraw/zinc/29/04/83/1368290483.db2.gz YANJHLJZMIAQHL-ZWKOTPCHSA-N 1 3 329.488 2.545 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)C1(N(C)C)CCC1 ZINC001407009794 1368318242 /nfs/dbraw/zinc/31/82/42/1368318242.db2.gz UHNZXZUPIHQKSZ-MGNMYUMUSA-N 1 3 339.499 2.721 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]Cc1ccccc1)C1CCCC1 ZINC001407160366 1368517948 /nfs/dbraw/zinc/51/79/48/1368517948.db2.gz DFMGINZBJJRACQ-LJQANCHMSA-N 1 3 331.504 2.791 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1 ZINC001407170194 1368535588 /nfs/dbraw/zinc/53/55/88/1368535588.db2.gz CBLURTJZSAYPKV-QUCCMNQESA-N 1 3 329.488 2.642 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1 ZINC001407170194 1368535593 /nfs/dbraw/zinc/53/55/93/1368535593.db2.gz CBLURTJZSAYPKV-QUCCMNQESA-N 1 3 329.488 2.642 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCCC[C@@]2(CCN(C/C=C\Cl)C2)C1 ZINC001407174113 1368540911 /nfs/dbraw/zinc/54/09/11/1368540911.db2.gz RREZGKAQEIYYCO-TWVNLXSWSA-N 1 3 341.927 2.785 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCCC[C@]2(CCN(C/C=C\Cl)C2)C1 ZINC001407174091 1368541464 /nfs/dbraw/zinc/54/14/64/1368541464.db2.gz RREZGKAQEIYYCO-OEPRFQHASA-N 1 3 341.927 2.785 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2cc(F)ccc2C)C1)N(C)C ZINC001407219140 1368603465 /nfs/dbraw/zinc/60/34/65/1368603465.db2.gz DQNRWEVSHMYLKO-QUCCMNQESA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)[NH+]1CCCC1 ZINC001437704357 1387952515 /nfs/dbraw/zinc/95/25/15/1387952515.db2.gz XCQVFDBUPHWYKQ-PMACEKPBSA-N 1 3 343.515 2.888 10 0 EFAEHO Cc1cc(F)ccc1CN1CCC[C@@](C)(CNC(=O)CC[NH+](C)C)C1 ZINC001407285364 1368705748 /nfs/dbraw/zinc/70/57/48/1368705748.db2.gz BQHNAAAANJCTFG-FQEVSTJZSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[C@H](C(=O)NC[C@]1(C)CCC[N@H+](CCC(C)(C)C)C1)N(C)C ZINC001407290081 1368713205 /nfs/dbraw/zinc/71/32/05/1368713205.db2.gz CMFUPAJPZHEFNV-APWZRJJASA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)NC[C@]1(C)CCC[N@@H+](CCC(C)(C)C)C1)N(C)C ZINC001407290081 1368713208 /nfs/dbraw/zinc/71/32/08/1368713208.db2.gz CMFUPAJPZHEFNV-APWZRJJASA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@H]([NH2+]CCC1CCCCC1)[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001407535434 1368953475 /nfs/dbraw/zinc/95/34/75/1368953475.db2.gz GLGJLVRGDJBGAM-PKOBYXMFSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1CC[C@H](CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001407540765 1368960701 /nfs/dbraw/zinc/96/07/01/1368960701.db2.gz SBYJMFHGUJPNKF-BRWVUGGUSA-N 1 3 341.515 2.731 10 0 EFAEHO C[C@@H](c1ccccc1Cl)N1CC[C@H](CNC(=O)CC[NH+](C)C)C1 ZINC001437722919 1387972417 /nfs/dbraw/zinc/97/24/17/1387972417.db2.gz NSWFITVZHMVGOQ-LSDHHAIUSA-N 1 3 337.895 2.791 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)CC(C)(C)C ZINC001437728828 1387978363 /nfs/dbraw/zinc/97/83/63/1387978363.db2.gz QIESDNRMVZRBJC-KRWDZBQOSA-N 1 3 349.563 2.983 10 0 EFAEHO CN(CC(=O)NC[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)CC(C)(C)C ZINC001437728828 1387978366 /nfs/dbraw/zinc/97/83/66/1387978366.db2.gz QIESDNRMVZRBJC-KRWDZBQOSA-N 1 3 349.563 2.983 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NC[C@H]1CCN(Cc2cc(C)ccc2F)C1 ZINC001437732178 1387980779 /nfs/dbraw/zinc/98/07/79/1387980779.db2.gz CKPWJKLTBURWMY-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NC[C@H]1CCN(Cc2cc(C)ccc2F)C1 ZINC001437732178 1387980790 /nfs/dbraw/zinc/98/07/90/1387980790.db2.gz CKPWJKLTBURWMY-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO CCCC[N@@H+]1CCc2c(CNC(=O)CN3CC[C@@H](C)C3)cccc2C1 ZINC001407747564 1369187058 /nfs/dbraw/zinc/18/70/58/1369187058.db2.gz PGZXXAJYSUJNIM-QGZVFWFLSA-N 1 3 343.515 2.803 10 0 EFAEHO CCCC[N@H+]1CCc2c(CNC(=O)CN3CC[C@@H](C)C3)cccc2C1 ZINC001407747564 1369187060 /nfs/dbraw/zinc/18/70/60/1369187060.db2.gz PGZXXAJYSUJNIM-QGZVFWFLSA-N 1 3 343.515 2.803 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001407789339 1369234263 /nfs/dbraw/zinc/23/42/63/1369234263.db2.gz ZUXUMMNLWARQTH-DLBZAZTESA-N 1 3 347.528 2.894 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001407789339 1369234267 /nfs/dbraw/zinc/23/42/67/1369234267.db2.gz ZUXUMMNLWARQTH-DLBZAZTESA-N 1 3 347.528 2.894 10 0 EFAEHO Cc1ccc(F)c(CN2CCC[C@H](NC(=O)CCC[NH+](C)C)CC2)c1 ZINC001407854764 1369313058 /nfs/dbraw/zinc/31/30/58/1369313058.db2.gz SEZSTDGLMAPKCE-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@H+](Cc2ccc(CF)cc2)CC1 ZINC001407884954 1369349241 /nfs/dbraw/zinc/34/92/41/1369349241.db2.gz JXYFORXRLMRMRP-IBGZPJMESA-N 1 3 349.494 2.967 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@@H+](Cc2ccc(CF)cc2)CC1 ZINC001407884954 1369349247 /nfs/dbraw/zinc/34/92/47/1369349247.db2.gz JXYFORXRLMRMRP-IBGZPJMESA-N 1 3 349.494 2.967 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]([C@@H]2CCCN(C/C=C\Cl)C2)C1 ZINC001407968538 1369476319 /nfs/dbraw/zinc/47/63/19/1369476319.db2.gz XWMAMGAVIXROPD-BRLJPEOMSA-N 1 3 341.927 2.641 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@@]2(CCN(CCC(F)(F)F)C2)C1 ZINC001408010134 1369524544 /nfs/dbraw/zinc/52/45/44/1369524544.db2.gz KNNLDRUSQACBCQ-INIZCTEOSA-N 1 3 349.441 2.595 10 0 EFAEHO CCCCN1Cc2ccc(CNC(=O)C[C@@H]3CC[N@H+](C)C3)cc2C1 ZINC001408061727 1369574320 /nfs/dbraw/zinc/57/43/20/1369574320.db2.gz XWCRODWQTCLSMG-KRWDZBQOSA-N 1 3 329.488 2.760 10 0 EFAEHO CCCCN1Cc2ccc(CNC(=O)C[C@@H]3CC[N@@H+](C)C3)cc2C1 ZINC001408061727 1369574327 /nfs/dbraw/zinc/57/43/27/1369574327.db2.gz XWCRODWQTCLSMG-KRWDZBQOSA-N 1 3 329.488 2.760 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H]([NH2+]C/C=C/c3ccccc3)C2)C1 ZINC001408071388 1369581069 /nfs/dbraw/zinc/58/10/69/1369581069.db2.gz ZQAYGYRITJYBGR-KCKZCELBSA-N 1 3 341.499 2.622 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C1(C)CCN(C(=O)CN(C)C(C)C)CC1 ZINC001408085772 1369590646 /nfs/dbraw/zinc/59/06/46/1369590646.db2.gz FHCICDULKZHLJR-UHFFFAOYSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[NH2+]C1(C)CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001408112729 1369618268 /nfs/dbraw/zinc/61/82/68/1369618268.db2.gz FJRLKOIJVKGUEK-GOSISDBHSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC(C)([NH2+]CCc3cccs3)CC2)C1 ZINC001408122506 1369626484 /nfs/dbraw/zinc/62/64/84/1369626484.db2.gz PMJWBXAPXPADLG-INIZCTEOSA-N 1 3 349.544 2.603 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@H+](CC2CC(F)(F)C2)CC1(C)C)N(C)C ZINC001408139628 1369640286 /nfs/dbraw/zinc/64/02/86/1369640286.db2.gz LICPJBAYPHEZKB-CABCVRRESA-N 1 3 345.478 2.589 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@@H+](CC2CC(F)(F)C2)CC1(C)C)N(C)C ZINC001408139628 1369640290 /nfs/dbraw/zinc/64/02/90/1369640290.db2.gz LICPJBAYPHEZKB-CABCVRRESA-N 1 3 345.478 2.589 10 0 EFAEHO CCCCN1CCc2ccccc2[C@@H]1CNC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001408251047 1369751841 /nfs/dbraw/zinc/75/18/41/1369751841.db2.gz HSESMXZUOHTRQX-PXNSSMCTSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCCN1CCc2ccccc2[C@@H]1CNC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001408251047 1369751846 /nfs/dbraw/zinc/75/18/46/1369751846.db2.gz HSESMXZUOHTRQX-PXNSSMCTSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[N@H+](C)CC1CC2(CCC2)C1 ZINC001408333854 1369836638 /nfs/dbraw/zinc/83/66/38/1369836638.db2.gz KXKPEIVIXHPUFR-SFHVURJKSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[N@@H+](C)CC1CC2(CCC2)C1 ZINC001408333854 1369836641 /nfs/dbraw/zinc/83/66/41/1369836641.db2.gz KXKPEIVIXHPUFR-SFHVURJKSA-N 1 3 335.536 2.831 10 0 EFAEHO c1ccc2c(c1)cncc2C[NH2+]C1CCN(C[C@H]2CCOC2)CC1 ZINC001414087544 1370041101 /nfs/dbraw/zinc/04/11/01/1370041101.db2.gz FEBSCPOEJVKZBI-MRXNPFEDSA-N 1 3 325.456 2.825 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@H+](CCC2CCCCC2)C2CC2)C1 ZINC001437808864 1388102843 /nfs/dbraw/zinc/10/28/43/1388102843.db2.gz RZULCNSVRYBHIQ-KRWDZBQOSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[N@@H+](CCC2CCCCC2)C2CC2)C1 ZINC001437808864 1388102844 /nfs/dbraw/zinc/10/28/44/1388102844.db2.gz RZULCNSVRYBHIQ-KRWDZBQOSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+][C@@H](C)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001437850647 1388140961 /nfs/dbraw/zinc/14/09/61/1388140961.db2.gz DHEJATFXJWMDRS-ROUUACIJSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C(=O)[C@H]1CCCN1C(C)C)[C@@H]1CC[N@H+](CCCF)C1 ZINC001437896415 1388190827 /nfs/dbraw/zinc/19/08/27/1388190827.db2.gz SDBYCRBGKIIWDM-IAGOWNOFSA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(C(=O)[C@H]1CCCN1C(C)C)[C@@H]1CC[N@@H+](CCCF)C1 ZINC001437896415 1388190831 /nfs/dbraw/zinc/19/08/31/1388190831.db2.gz SDBYCRBGKIIWDM-IAGOWNOFSA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(C(=O)[C@H]1CCC[N@@H+]1C(C)C)[C@@H]1CCN(CCCF)C1 ZINC001437896415 1388190834 /nfs/dbraw/zinc/19/08/34/1388190834.db2.gz SDBYCRBGKIIWDM-IAGOWNOFSA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(C(=O)[C@H]1CCC[N@H+]1C(C)C)[C@@H]1CCN(CCCF)C1 ZINC001437896415 1388190838 /nfs/dbraw/zinc/19/08/38/1388190838.db2.gz SDBYCRBGKIIWDM-IAGOWNOFSA-N 1 3 327.488 2.532 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)CN1Cc1ccccc1 ZINC001417670677 1373142038 /nfs/dbraw/zinc/14/20/38/1373142038.db2.gz CAMFTHYUXISDJW-MDNKFWRPSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)CN1Cc1ccccc1 ZINC001417670677 1373142041 /nfs/dbraw/zinc/14/20/41/1373142041.db2.gz CAMFTHYUXISDJW-MDNKFWRPSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2CC[N@H+](CC3CC(C)(C)C3)C2)C1 ZINC001437935781 1388246147 /nfs/dbraw/zinc/24/61/47/1388246147.db2.gz CTYLBXOFLVODTC-IAGOWNOFSA-N 1 3 335.536 2.593 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@@H]2CC[N@@H+](CC3CC(C)(C)C3)C2)C1 ZINC001437935781 1388246153 /nfs/dbraw/zinc/24/61/53/1388246153.db2.gz CTYLBXOFLVODTC-IAGOWNOFSA-N 1 3 335.536 2.593 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CC(C)(C)C2)C1 ZINC001417777845 1373243773 /nfs/dbraw/zinc/24/37/73/1373243773.db2.gz MPELTXOXXJICMX-NBOOPKSLSA-N 1 3 335.536 2.780 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H]1C[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001417777718 1373243810 /nfs/dbraw/zinc/24/38/10/1373243810.db2.gz KPDWCMRLXHWJKN-UWUNEBHHSA-N 1 3 331.504 2.574 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN3[C@H](C)CC[C@H]3C)C2)cs1 ZINC001417778943 1373246074 /nfs/dbraw/zinc/24/60/74/1373246074.db2.gz XSTGOUXVAWGDBZ-SZXPJGKVSA-N 1 3 349.544 2.914 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@H](CNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001417801271 1373269717 /nfs/dbraw/zinc/26/97/17/1373269717.db2.gz DVMDLYADUJKNFH-UAPYVXQJSA-N 1 3 331.504 2.628 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+]CC2CCC3(CC3)CC2)C1 ZINC001417801975 1373270999 /nfs/dbraw/zinc/27/09/99/1373270999.db2.gz KVJMVPVQRKAYMF-IYARVYRRSA-N 1 3 335.536 2.781 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@@H](CCNC(=O)CN3CC[C@H](C)C3)C2)cs1 ZINC001437941084 1388252712 /nfs/dbraw/zinc/25/27/12/1388252712.db2.gz OHFRCMBRKRAXRU-DOTOQJQBSA-N 1 3 349.544 2.727 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@@H](CCNC(=O)CN3CC[C@H](C)C3)C2)cs1 ZINC001437941084 1388252721 /nfs/dbraw/zinc/25/27/21/1388252721.db2.gz OHFRCMBRKRAXRU-DOTOQJQBSA-N 1 3 349.544 2.727 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@@H](CCNC(=O)CN3CC[C@@H](C)C3)C2)cs1 ZINC001437941086 1388253093 /nfs/dbraw/zinc/25/30/93/1388253093.db2.gz OHFRCMBRKRAXRU-NVXWUHKLSA-N 1 3 349.544 2.727 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@@H](CCNC(=O)CN3CC[C@@H](C)C3)C2)cs1 ZINC001437941086 1388253097 /nfs/dbraw/zinc/25/30/97/1388253097.db2.gz OHFRCMBRKRAXRU-NVXWUHKLSA-N 1 3 349.544 2.727 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001417812405 1373283159 /nfs/dbraw/zinc/28/31/59/1373283159.db2.gz IDYSBEXKGSUFLO-XUVXKRRUSA-N 1 3 345.531 2.956 10 0 EFAEHO CC(C)N1CC[C@H](c2ccccc2)[C@H](NC(=O)C2(C[NH+](C)C)CC2)C1 ZINC001417822195 1373295870 /nfs/dbraw/zinc/29/58/70/1373295870.db2.gz LEMMCEVORBNHCE-RTBURBONSA-N 1 3 343.515 2.711 10 0 EFAEHO CCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@H](C(C)C)[NH+](C)C)C1 ZINC001417824579 1373301263 /nfs/dbraw/zinc/30/12/63/1373301263.db2.gz VQVOSEDPNJYAJR-QRVBRYPASA-N 1 3 331.504 2.567 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[N@H+](C)CC)CCN1Cc1cccc(OC)c1 ZINC001417826716 1373305626 /nfs/dbraw/zinc/30/56/26/1373305626.db2.gz LZQWKBYDLALMNU-RBUKOAKNSA-N 1 3 347.503 2.506 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[N@@H+](C)CC)CCN1Cc1cccc(OC)c1 ZINC001417826716 1373305632 /nfs/dbraw/zinc/30/56/32/1373305632.db2.gz LZQWKBYDLALMNU-RBUKOAKNSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)CC(C)(C)C1 ZINC001417863446 1373357117 /nfs/dbraw/zinc/35/71/17/1373357117.db2.gz JMTCDQNGTMFUPB-IRXDYDNUSA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)C[N@H+]1CC[C@H](NC(=O)[C@H](C(C)C)N(C)C)CC(C)(C)C1 ZINC001417863446 1373357124 /nfs/dbraw/zinc/35/71/24/1373357124.db2.gz JMTCDQNGTMFUPB-IRXDYDNUSA-N 1 3 325.541 2.835 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CC[C@@H]2C[C@@H](C)C[N@@H+]2C1 ZINC001417886051 1373374870 /nfs/dbraw/zinc/37/48/70/1373374870.db2.gz IMPAUCVGRZXWJZ-IZBJGVDFSA-N 1 3 343.515 2.744 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CC[C@@H]2C[C@@H](C)C[N@H+]2C1 ZINC001417886051 1373374877 /nfs/dbraw/zinc/37/48/77/1373374877.db2.gz IMPAUCVGRZXWJZ-IZBJGVDFSA-N 1 3 343.515 2.744 10 0 EFAEHO Cc1cc(C[NH+]2CCC(N(C)C(=O)CN(C)C(C)C)CC2)cs1 ZINC001417900683 1373390803 /nfs/dbraw/zinc/39/08/03/1373390803.db2.gz MEDLYLCIUCBFNS-UHFFFAOYSA-N 1 3 337.533 2.820 10 0 EFAEHO Cc1ccccc1CN1CCC[C@H](NC(=O)CC[C@@H]2CCC[N@H+]2C)C1 ZINC001417907318 1373401353 /nfs/dbraw/zinc/40/13/53/1373401353.db2.gz DRGNPZANTWGJMH-PMACEKPBSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccccc1CN1CCC[C@H](NC(=O)CC[C@@H]2CCC[N@@H+]2C)C1 ZINC001417907318 1373401355 /nfs/dbraw/zinc/40/13/55/1373401355.db2.gz DRGNPZANTWGJMH-PMACEKPBSA-N 1 3 343.515 2.950 10 0 EFAEHO CC[C@@H](C)C[NH+]1CCC2(C[C@H]2NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001417966656 1373466192 /nfs/dbraw/zinc/46/61/92/1373466192.db2.gz VNQBAWIIGDLRAC-IAGOWNOFSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1ccc(C)cc1)C1CC1 ZINC001417991287 1373495676 /nfs/dbraw/zinc/49/56/76/1373495676.db2.gz OANFUVYDOHSLMH-PMACEKPBSA-N 1 3 343.515 2.854 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+][C@H](C)c1ccccc1F)C1CC1 ZINC001418009537 1373517863 /nfs/dbraw/zinc/51/78/63/1373517863.db2.gz FFZMNTIPFBUCMK-KDOFPFPSSA-N 1 3 335.467 2.711 10 0 EFAEHO CC[C@H](F)CN(C)C[C@@H]1CCCN(C(=O)CCC[NH+]2CCCC2)C1 ZINC001418018271 1373528026 /nfs/dbraw/zinc/52/80/26/1373528026.db2.gz CSYIJYHEAIHOTK-ROUUACIJSA-N 1 3 341.515 2.781 10 0 EFAEHO C[C@H]1CCC[C@@H](CCN2C[C@H]3CC[C@@H](C2)N3C(=O)CC[NH+](C)C)C1 ZINC001418033586 1373548316 /nfs/dbraw/zinc/54/83/16/1373548316.db2.gz GMVTXWNIXGIIKN-CADBVGFASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@H]1CC[N@H+](CC2CCC2)C1 ZINC001437951827 1388269090 /nfs/dbraw/zinc/26/90/90/1388269090.db2.gz WSVLKCIWOBVPNE-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@H]1CC[N@@H+](CC2CCC2)C1 ZINC001437951827 1388269097 /nfs/dbraw/zinc/26/90/97/1388269097.db2.gz WSVLKCIWOBVPNE-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]([NH2+]CC[C@H]3CCCC3(F)F)C2)CCC1 ZINC001418063398 1373569165 /nfs/dbraw/zinc/56/91/65/1373569165.db2.gz RILGXYUHTKSFEL-RBSFLKMASA-N 1 3 343.462 2.533 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1C[C@H](NCc2cc(C)ccc2F)C1 ZINC001418075442 1373580190 /nfs/dbraw/zinc/58/01/90/1373580190.db2.gz POCPAVCCWAHSFK-QAQDUYKDSA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1C[C@H](NCc2cc(C)ccc2F)C1 ZINC001418075442 1373580196 /nfs/dbraw/zinc/58/01/96/1373580196.db2.gz POCPAVCCWAHSFK-QAQDUYKDSA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@H]2CN(C/C=C/Cl)CC[C@@H]21 ZINC001418082938 1373590821 /nfs/dbraw/zinc/59/08/21/1373590821.db2.gz PYWJAEOWTWMVOZ-CAXWLTTCSA-N 1 3 341.927 2.784 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@H]2CN(C/C=C/Cl)CC[C@@H]21 ZINC001418082938 1373590822 /nfs/dbraw/zinc/59/08/22/1373590822.db2.gz PYWJAEOWTWMVOZ-CAXWLTTCSA-N 1 3 341.927 2.784 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)N[C@H]1C[C@@H](NCc2ccccc2Cl)C1 ZINC001418114045 1373618351 /nfs/dbraw/zinc/61/83/51/1373618351.db2.gz OUEHBKUTRPXQND-CALCHBBNSA-N 1 3 349.906 2.953 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC001437956918 1388274233 /nfs/dbraw/zinc/27/42/33/1388274233.db2.gz IJWHSXVTXLXKHW-JKSUJKDBSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC001437956918 1388274237 /nfs/dbraw/zinc/27/42/37/1388274237.db2.gz IJWHSXVTXLXKHW-JKSUJKDBSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@H+](CCCC(C)(C)C)C1 ZINC001418136177 1373660965 /nfs/dbraw/zinc/66/09/65/1373660965.db2.gz HYTVFWKTFCUZEX-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@@H+](CCCC(C)(C)C)C1 ZINC001418136177 1373660972 /nfs/dbraw/zinc/66/09/72/1373660972.db2.gz HYTVFWKTFCUZEX-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)[C@@H]1CCC[N@H+](CC2CCC2)C1 ZINC001418173462 1373727524 /nfs/dbraw/zinc/72/75/24/1373727524.db2.gz MGNYQDBZXZXRJA-FUHWJXTLSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)[C@@H]1CCC[N@@H+](CC2CCC2)C1 ZINC001418173462 1373727527 /nfs/dbraw/zinc/72/75/27/1373727527.db2.gz MGNYQDBZXZXRJA-FUHWJXTLSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](F)CC[NH2+]C1CCC(NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001418190702 1373754854 /nfs/dbraw/zinc/75/48/54/1373754854.db2.gz KIQSBLPEUBWQAL-FHERZECASA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001418222404 1373777452 /nfs/dbraw/zinc/77/74/52/1373777452.db2.gz PRWMNGXKDWGXHC-DNVCBOLYSA-N 1 3 342.487 2.635 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1)NCc1ccsc1 ZINC001418227958 1373783268 /nfs/dbraw/zinc/78/32/68/1373783268.db2.gz PZWUYDYKAAKWJK-WBVHZDCISA-N 1 3 349.544 2.997 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@H+](C2CCCCC2)C1)NCc1ccsc1 ZINC001418227958 1373783274 /nfs/dbraw/zinc/78/32/74/1373783274.db2.gz PZWUYDYKAAKWJK-WBVHZDCISA-N 1 3 349.544 2.997 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001418228939 1373784460 /nfs/dbraw/zinc/78/44/60/1373784460.db2.gz IPCVWJXDVAZZSD-AEFFLSMTSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@H](CNC(=O)C12CCC[NH+](CCC1)C2)N[C@H](C)c1ccccc1F ZINC001418235813 1373791436 /nfs/dbraw/zinc/79/14/36/1373791436.db2.gz LYQKQOQTFVVXMH-HZPDHXFCSA-N 1 3 347.478 2.857 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC[C@@H](C)NCc2cc(C)ccc2F)C1 ZINC001418275745 1373846881 /nfs/dbraw/zinc/84/68/81/1373846881.db2.gz YOUMJTSNMTYPKB-SJORKVTESA-N 1 3 349.494 2.850 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC[C@@H](C)NCc2cc(C)ccc2F)C1 ZINC001418275745 1373846892 /nfs/dbraw/zinc/84/68/92/1373846892.db2.gz YOUMJTSNMTYPKB-SJORKVTESA-N 1 3 349.494 2.850 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]Cc1cccc2ccccc21 ZINC001418315303 1373894829 /nfs/dbraw/zinc/89/48/29/1373894829.db2.gz WWHKPDMIAIJIFP-INIZCTEOSA-N 1 3 327.472 2.774 10 0 EFAEHO C[C@]1(NC(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)CCN(Cc2ccccc2)C1 ZINC001418345604 1373920953 /nfs/dbraw/zinc/92/09/53/1373920953.db2.gz DLKCMTQLGHWVCQ-ZJOUEHCJSA-N 1 3 341.499 2.784 10 0 EFAEHO C[C@]1(NC(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)CCN(Cc2ccccc2)C1 ZINC001418345604 1373920956 /nfs/dbraw/zinc/92/09/56/1373920956.db2.gz DLKCMTQLGHWVCQ-ZJOUEHCJSA-N 1 3 341.499 2.784 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001418373736 1373950906 /nfs/dbraw/zinc/95/09/06/1373950906.db2.gz IDQVZYLAFJSBPH-CVEARBPZSA-N 1 3 345.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC001418373736 1373950908 /nfs/dbraw/zinc/95/09/08/1373950908.db2.gz IDQVZYLAFJSBPH-CVEARBPZSA-N 1 3 345.478 2.685 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]Cc1cccc(F)c1 ZINC001418440544 1374029661 /nfs/dbraw/zinc/02/96/61/1374029661.db2.gz HGAABOYBSCVAEG-YJBOKZPZSA-N 1 3 335.467 2.685 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@@H](C)[NH2+]Cc1csc(C)c1 ZINC001418442152 1374031932 /nfs/dbraw/zinc/03/19/32/1374031932.db2.gz MJEKSIMRZGTJNL-PBHICJAKSA-N 1 3 337.533 2.915 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@H+](C)CCNC(=O)CN(C)C2CCC2)c1 ZINC001418465902 1374056420 /nfs/dbraw/zinc/05/64/20/1374056420.db2.gz WBTHRQOBMSFCBB-QGZVFWFLSA-N 1 3 331.504 2.897 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@@H+](C)CCNC(=O)CN(C)C2CCC2)c1 ZINC001418465902 1374056425 /nfs/dbraw/zinc/05/64/25/1374056425.db2.gz WBTHRQOBMSFCBB-QGZVFWFLSA-N 1 3 331.504 2.897 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(C)CCNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001418471283 1374062685 /nfs/dbraw/zinc/06/26/85/1374062685.db2.gz SAQCZLBTNCBOHM-YJBOKZPZSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(C)CCNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001418471283 1374062688 /nfs/dbraw/zinc/06/26/88/1374062688.db2.gz SAQCZLBTNCBOHM-YJBOKZPZSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(C)CCNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001418471273 1374062796 /nfs/dbraw/zinc/06/27/96/1374062796.db2.gz SAQCZLBTNCBOHM-CRAIPNDOSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(C)CCNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001418471273 1374062801 /nfs/dbraw/zinc/06/28/01/1374062801.db2.gz SAQCZLBTNCBOHM-CRAIPNDOSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(C)CCNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001418471280 1374063131 /nfs/dbraw/zinc/06/31/31/1374063131.db2.gz SAQCZLBTNCBOHM-QAPCUYQASA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(C)CCNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001418471280 1374063138 /nfs/dbraw/zinc/06/31/38/1374063138.db2.gz SAQCZLBTNCBOHM-QAPCUYQASA-N 1 3 335.467 2.809 10 0 EFAEHO C[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC1CCCCC1 ZINC001418493297 1374089613 /nfs/dbraw/zinc/08/96/13/1374089613.db2.gz HBHNQLMBSRRMQI-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO C[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC1CCCCC1 ZINC001418493297 1374089617 /nfs/dbraw/zinc/08/96/17/1374089617.db2.gz HBHNQLMBSRRMQI-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO CN(Cc1ccccc1Cl)C[C@@H]1CCN(C(=O)CC[NH+](C)C)C1 ZINC001437989125 1388299911 /nfs/dbraw/zinc/29/99/11/1388299911.db2.gz HMPNQQQKJZXJJZ-HNNXBMFYSA-N 1 3 337.895 2.572 10 0 EFAEHO CCN(CCNC(=O)CC[C@@H]1CCC[N@@H+]1C)Cc1ccc(C)c(F)c1 ZINC001418549383 1374163393 /nfs/dbraw/zinc/16/33/93/1374163393.db2.gz CUPLNORRPWFITK-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO CCN(CCNC(=O)CC[C@@H]1CCC[N@H+]1C)Cc1ccc(C)c(F)c1 ZINC001418549383 1374163397 /nfs/dbraw/zinc/16/33/97/1374163397.db2.gz CUPLNORRPWFITK-SFHVURJKSA-N 1 3 349.494 2.947 10 0 EFAEHO CCN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1ccc(CF)cc1 ZINC001418556412 1374174736 /nfs/dbraw/zinc/17/47/36/1374174736.db2.gz SVAXOVYOVLFDNE-UHFFFAOYSA-N 1 3 349.494 2.969 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@H]1CN(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001418598108 1374248920 /nfs/dbraw/zinc/24/89/20/1374248920.db2.gz VSGDGWAFQVOTHD-OALUTQOASA-N 1 3 343.515 2.678 10 0 EFAEHO Cc1cccc(C)c1CN1CC[C@H]1CN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001418598108 1374248928 /nfs/dbraw/zinc/24/89/28/1374248928.db2.gz VSGDGWAFQVOTHD-OALUTQOASA-N 1 3 343.515 2.678 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001418637441 1374306033 /nfs/dbraw/zinc/30/60/33/1374306033.db2.gz XXVFEQRWROBRJK-MJBXVCDLSA-N 1 3 348.318 2.664 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001418637441 1374306039 /nfs/dbraw/zinc/30/60/39/1374306039.db2.gz XXVFEQRWROBRJK-MJBXVCDLSA-N 1 3 348.318 2.664 10 0 EFAEHO Cc1ccc(C)c(C[N@H+]2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001418674993 1374353863 /nfs/dbraw/zinc/35/38/63/1374353863.db2.gz RNNXSCYYJPNXHX-PKOBYXMFSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+]2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001418674993 1374353868 /nfs/dbraw/zinc/35/38/68/1374353868.db2.gz RNNXSCYYJPNXHX-PKOBYXMFSA-N 1 3 343.515 2.583 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2cccc(F)c2)C1)N(C)C ZINC001418716995 1374408291 /nfs/dbraw/zinc/40/82/91/1374408291.db2.gz ZAUNBQGZDFFSEG-UHOSZYNNSA-N 1 3 349.494 2.786 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(C)cc2)C1 ZINC001418725714 1374421015 /nfs/dbraw/zinc/42/10/15/1374421015.db2.gz POXASEHNAAMDGR-RBUKOAKNSA-N 1 3 331.504 2.711 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]Cc3cccc(F)c3)C2)C1 ZINC001418730558 1374431408 /nfs/dbraw/zinc/43/14/08/1374431408.db2.gz ATAKFZCICVKMQH-VDZJLULYSA-N 1 3 347.478 2.542 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)cs1 ZINC001418735002 1374436693 /nfs/dbraw/zinc/43/66/93/1374436693.db2.gz XZYVTCQDFZIERN-QILLFSRXSA-N 1 3 349.544 2.773 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CCC(C)(C)C ZINC001418739065 1374442979 /nfs/dbraw/zinc/44/29/79/1374442979.db2.gz LKFZTZDBWXVYBC-OKYOBFRVSA-N 1 3 349.563 2.933 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CCC(C)(C)C ZINC001418739065 1374442982 /nfs/dbraw/zinc/44/29/82/1374442982.db2.gz LKFZTZDBWXVYBC-OKYOBFRVSA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@@H+]1CCC(C)(C)C ZINC001418741182 1374444480 /nfs/dbraw/zinc/44/44/80/1374444480.db2.gz RQASINRJPAJPTE-MANSERQUSA-N 1 3 349.563 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2C[N@H+]1CCC(C)(C)C ZINC001418741182 1374444481 /nfs/dbraw/zinc/44/44/81/1374444481.db2.gz RQASINRJPAJPTE-MANSERQUSA-N 1 3 349.563 2.932 10 0 EFAEHO CN(CC(=O)NCC[N@H+](CC1CC2(CCC2)C1)C1CC1)C1CCC1 ZINC001418759243 1374468080 /nfs/dbraw/zinc/46/80/80/1374468080.db2.gz GCGNYUZMWYHNOT-UHFFFAOYSA-N 1 3 333.520 2.632 10 0 EFAEHO CN(CC(=O)NCC[N@@H+](CC1CC2(CCC2)C1)C1CC1)C1CCC1 ZINC001418759243 1374468084 /nfs/dbraw/zinc/46/80/84/1374468084.db2.gz GCGNYUZMWYHNOT-UHFFFAOYSA-N 1 3 333.520 2.632 10 0 EFAEHO CN(CC(=O)NCC[N@H+](CCC(C)(C)C)C1CC1)CC(C)(C)C ZINC001418783370 1374495805 /nfs/dbraw/zinc/49/58/05/1374495805.db2.gz AJYIIVKTGBOOTJ-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO CN(CC(=O)NCC[N@@H+](CCC(C)(C)C)C1CC1)CC(C)(C)C ZINC001418783370 1374495809 /nfs/dbraw/zinc/49/58/09/1374495809.db2.gz AJYIIVKTGBOOTJ-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@H]2CC[N@H+](Cc3ccsc3)C2)CCC1 ZINC001418895620 1374648633 /nfs/dbraw/zinc/64/86/33/1374648633.db2.gz ZZLDUTULYFJGMC-HNNXBMFYSA-N 1 3 335.517 2.561 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@H]2CC[N@@H+](Cc3ccsc3)C2)CCC1 ZINC001418895620 1374648638 /nfs/dbraw/zinc/64/86/38/1374648638.db2.gz ZZLDUTULYFJGMC-HNNXBMFYSA-N 1 3 335.517 2.561 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CC[C@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001418905328 1374665326 /nfs/dbraw/zinc/66/53/26/1374665326.db2.gz HPABNCZBGOGBPL-SFHVURJKSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccccc1C[N@H+]1CC[C@H](CCNC(=O)CN(C)C(C)C)C1 ZINC001418905328 1374665328 /nfs/dbraw/zinc/66/53/28/1374665328.db2.gz HPABNCZBGOGBPL-SFHVURJKSA-N 1 3 345.531 2.917 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001418909747 1374675545 /nfs/dbraw/zinc/67/55/45/1374675545.db2.gz AHXDVIUYLDQGPW-SJLPKXTDSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001418909747 1374675547 /nfs/dbraw/zinc/67/55/47/1374675547.db2.gz AHXDVIUYLDQGPW-SJLPKXTDSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2ccc(F)cc2C)C1)N(C)C ZINC001418913050 1374679063 /nfs/dbraw/zinc/67/90/63/1374679063.db2.gz KLNLKFNCNTVFSD-VQIMIIECSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2ccc(F)cc2C)C1)N(C)C ZINC001418913050 1374679068 /nfs/dbraw/zinc/67/90/68/1374679068.db2.gz KLNLKFNCNTVFSD-VQIMIIECSA-N 1 3 349.494 2.803 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCC1CN([C@H]2CCc3ccccc32)C1 ZINC001419020653 1374768811 /nfs/dbraw/zinc/76/88/11/1374768811.db2.gz FKYMGTLBBHOLQS-ICSRJNTNSA-N 1 3 341.499 2.596 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCC1CN([C@H]2CCc3ccccc32)C1 ZINC001419020653 1374768814 /nfs/dbraw/zinc/76/88/14/1374768814.db2.gz FKYMGTLBBHOLQS-ICSRJNTNSA-N 1 3 341.499 2.596 10 0 EFAEHO Cc1cccc(CN2CCC[C@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001419095423 1374837887 /nfs/dbraw/zinc/83/78/87/1374837887.db2.gz RQIRHOOAGVRICX-VQTJNVASSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1cccc(CN2CCC[C@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001419095423 1374837891 /nfs/dbraw/zinc/83/78/91/1374837891.db2.gz RQIRHOOAGVRICX-VQTJNVASSA-N 1 3 343.515 2.950 10 0 EFAEHO CC[N@H+](C)CCC(=O)N(C)[C@@H]1CCN([C@H](C)c2cccc(OC)c2)C1 ZINC001419138741 1374886316 /nfs/dbraw/zinc/88/63/16/1374886316.db2.gz KQCKISUNAGEQIA-SJLPKXTDSA-N 1 3 347.503 2.631 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N(C)[C@@H]1CCN([C@H](C)c2cccc(OC)c2)C1 ZINC001419138741 1374886321 /nfs/dbraw/zinc/88/63/21/1374886321.db2.gz KQCKISUNAGEQIA-SJLPKXTDSA-N 1 3 347.503 2.631 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@H]1CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001419147796 1374896391 /nfs/dbraw/zinc/89/63/91/1374896391.db2.gz NEYCTDNQCXEMOU-SFHVURJKSA-N 1 3 342.487 2.542 10 0 EFAEHO CC[C@@H](CNC(=O)CC[C@H]1CCC[N@@H+]1C)NCc1ccccc1F ZINC001419193781 1374939815 /nfs/dbraw/zinc/93/98/15/1374939815.db2.gz KWEABIFPRMMFHN-DLBZAZTESA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@@H](CNC(=O)CC[C@H]1CCC[N@H+]1C)NCc1ccccc1F ZINC001419193781 1374939821 /nfs/dbraw/zinc/93/98/21/1374939821.db2.gz KWEABIFPRMMFHN-DLBZAZTESA-N 1 3 335.467 2.685 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]Cc1cccnc1C ZINC001419235087 1374982387 /nfs/dbraw/zinc/98/23/87/1374982387.db2.gz GDEQDOKAHDQTCK-OALUTQOASA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cc(C)sc1C ZINC001419238374 1374984188 /nfs/dbraw/zinc/98/41/88/1374984188.db2.gz FDLVBPJBFSXQMX-SUMWQHHRSA-N 1 3 337.533 2.691 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1c(C)cc(C)cc1C ZINC001419246051 1374993360 /nfs/dbraw/zinc/99/33/60/1374993360.db2.gz PNHZKBBSOSOLOL-HNAYVOBHSA-N 1 3 345.531 2.938 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]([NH2+]CC2CC3(CCC3)C2)C2CC2)CCC1 ZINC001419255761 1375002661 /nfs/dbraw/zinc/00/26/61/1375002661.db2.gz FPMUBNZYCITFMI-QGZVFWFLSA-N 1 3 333.520 2.535 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1cccc(Cl)c1)C1CC1)N(C)C ZINC001419281513 1375028720 /nfs/dbraw/zinc/02/87/20/1375028720.db2.gz TUVWVPOUFOUBPS-DLBZAZTESA-N 1 3 337.895 2.665 10 0 EFAEHO CC(C)CC[NH2+][C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001419298062 1375057779 /nfs/dbraw/zinc/05/77/79/1375057779.db2.gz PIWVYSTVQPUEEV-QFBILLFUSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1ccccc1)C1CC1 ZINC001419302213 1375063552 /nfs/dbraw/zinc/06/35/52/1375063552.db2.gz YIAGWRVVUNLRJC-WOJBJXKFSA-N 1 3 343.515 2.934 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](CNC(=O)CN2CC[C@H](C)C2)C2CC2)c(C)c1 ZINC001419302708 1375063885 /nfs/dbraw/zinc/06/38/85/1375063885.db2.gz ZNADKNCQXQIXJH-JXFKEZNVSA-N 1 3 343.515 2.630 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)CN2CC[C@H](C)C2)C2CC2)c(C)c1 ZINC001419302709 1375063916 /nfs/dbraw/zinc/06/39/16/1375063916.db2.gz ZNADKNCQXQIXJH-OXJNMPFZSA-N 1 3 343.515 2.630 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+][C@H](C)c1cccc(F)c1)C1CC1 ZINC001419328984 1375110169 /nfs/dbraw/zinc/11/01/69/1375110169.db2.gz UMYASDWGOMVTLZ-RDTXWAMCSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@H](CN(C)CCF)C1)[NH+]1CCCCC1 ZINC001419334666 1375119957 /nfs/dbraw/zinc/11/99/57/1375119957.db2.gz KEPVTWNYRXEKHI-MSOLQXFVSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[NH+]1CCCCC1 ZINC001419337031 1375123751 /nfs/dbraw/zinc/12/37/51/1375123751.db2.gz ISYNTQZPXCBVOF-KDURUIRLSA-N 1 3 335.536 2.974 10 0 EFAEHO CC[C@H](C(=O)N[C@@](C)(C[NH2+]Cc1cccc(F)c1)C1CC1)N(C)C ZINC001419342072 1375132363 /nfs/dbraw/zinc/13/23/63/1375132363.db2.gz QDFVHTKSHJEWDY-MJGOQNOKSA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@@H](F)CN(C)C[C@H]1CCCN(C(=O)C23CCC[NH+]2CCC3)C1 ZINC001419342640 1375134054 /nfs/dbraw/zinc/13/40/54/1375134054.db2.gz KTOCEIZZLHAYRA-IAGOWNOFSA-N 1 3 339.499 2.533 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H]1CC[C@H]([NH2+]CC[C@@H](C)F)CC1 ZINC001419377808 1375192881 /nfs/dbraw/zinc/19/28/81/1375192881.db2.gz NCGJNHNTZINAFS-QBPKDAKJSA-N 1 3 327.488 2.626 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]1C[NH2+]Cc1ccsc1)CC(C)(C)C ZINC001419422076 1375251886 /nfs/dbraw/zinc/25/18/86/1375251886.db2.gz CYMXGYBSFRJIFH-MRXNPFEDSA-N 1 3 337.533 2.807 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+]C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001419424416 1375255432 /nfs/dbraw/zinc/25/54/32/1375255432.db2.gz UIQSDQZVIXGJEL-ZWKOTPCHSA-N 1 3 331.504 2.977 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]2C[N@H+](CCCF)CC[C@H]21)CC(C)(C)C ZINC001419452101 1375292371 /nfs/dbraw/zinc/29/23/71/1375292371.db2.gz SYCGTEPGLUZHTB-IAGOWNOFSA-N 1 3 341.515 2.637 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]2C[N@@H+](CCCF)CC[C@H]21)CC(C)(C)C ZINC001419452101 1375292377 /nfs/dbraw/zinc/29/23/77/1375292377.db2.gz SYCGTEPGLUZHTB-IAGOWNOFSA-N 1 3 341.515 2.637 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)CC[C@@H]21 ZINC001419453938 1375294328 /nfs/dbraw/zinc/29/43/28/1375294328.db2.gz YTIKGPQXGCIFOE-ROUUACIJSA-N 1 3 349.544 2.903 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1C[C@@H](NCc2ccc(Cl)cc2F)C1 ZINC001419492174 1375340168 /nfs/dbraw/zinc/34/01/68/1375340168.db2.gz SNXOPPYULNNMRU-GASCZTMLSA-N 1 3 341.858 2.558 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC001419509873 1375360788 /nfs/dbraw/zinc/36/07/88/1375360788.db2.gz ACSPHIXEJJHXJR-IYBDPMFKSA-N 1 3 339.430 2.703 10 0 EFAEHO CCC(CC)C[NH2+]C[C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001419519769 1375378917 /nfs/dbraw/zinc/37/89/17/1375378917.db2.gz ZXCBYGLVRPYJMT-HNAYVOBHSA-N 1 3 343.531 2.977 10 0 EFAEHO C[C@@H](C(=O)NCC1C[NH+](CC2CC(C)(C)C2)C1)N1CCCCCC1 ZINC001438139717 1388377217 /nfs/dbraw/zinc/37/72/17/1388377217.db2.gz BGCNARHCCUWNCJ-INIZCTEOSA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1ccc(C[N@H+]2CCC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cc1 ZINC001419557023 1375444618 /nfs/dbraw/zinc/44/46/18/1375444618.db2.gz NDDJUOWCQURGIN-QUCCMNQESA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccc(C[N@@H+]2CCC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cc1 ZINC001419557023 1375444624 /nfs/dbraw/zinc/44/46/24/1375444624.db2.gz NDDJUOWCQURGIN-QUCCMNQESA-N 1 3 343.515 2.665 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N1CCC[C@@H](CNC(=O)CC[NH+](C)C)C1 ZINC001419555758 1375445852 /nfs/dbraw/zinc/44/58/52/1375445852.db2.gz MKGRXLUQDCLKTK-HOTGVXAUSA-N 1 3 335.467 2.667 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)CCC[NH+](C)C)CCCC2)c1 ZINC001419612501 1375539513 /nfs/dbraw/zinc/53/95/13/1375539513.db2.gz QAHCMJVBSHIDIX-UHFFFAOYSA-N 1 3 349.494 2.995 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCCC2)c(C)n1 ZINC001419636312 1375603187 /nfs/dbraw/zinc/60/31/87/1375603187.db2.gz WYZZLXVMWUEHNG-UHFFFAOYSA-N 1 3 346.519 2.557 10 0 EFAEHO CC(C)Oc1cccc(C[NH2+]C[C@H](C)N(C)C(=O)[C@@H]2CCCN2C)c1 ZINC001419652166 1375639241 /nfs/dbraw/zinc/63/92/41/1375639241.db2.gz PLCXZZVPHXDROV-LPHOPBHVSA-N 1 3 347.503 2.505 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cc2ccccc2o1)N(C)C(=O)[C@H]1CCCCN1C ZINC001419681779 1375704342 /nfs/dbraw/zinc/70/43/42/1375704342.db2.gz IFBNBQAVKRPJAI-MAUKXSAKSA-N 1 3 343.471 2.854 10 0 EFAEHO C[C@H](NC[C@H](C)N(C)C(=O)CC[NH+](C)C)c1cccc(Cl)c1F ZINC001419717484 1375763899 /nfs/dbraw/zinc/76/38/99/1375763899.db2.gz VOVLFFMYCFOYAP-STQMWFEESA-N 1 3 343.874 2.928 10 0 EFAEHO C[C@@H](NC[C@@H](C)N(C)C(=O)CC[NH+](C)C)c1cccc(Cl)c1F ZINC001419717478 1375764064 /nfs/dbraw/zinc/76/40/64/1375764064.db2.gz VOVLFFMYCFOYAP-CHWSQXEVSA-N 1 3 343.874 2.928 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@@H]2C[C@H]1CN2CCC1CCCCC1 ZINC001438182744 1388404592 /nfs/dbraw/zinc/40/45/92/1388404592.db2.gz VGBBCUXGZQVIMU-OALUTQOASA-N 1 3 335.536 2.974 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@@H]2C[C@H]1CN2CCC1CCCCC1 ZINC001438182744 1388404594 /nfs/dbraw/zinc/40/45/94/1388404594.db2.gz VGBBCUXGZQVIMU-OALUTQOASA-N 1 3 335.536 2.974 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)[C@H]2CCC[N@H+]2CC(C)C)c1 ZINC001419793394 1375887402 /nfs/dbraw/zinc/88/74/02/1375887402.db2.gz UZVYSYDYTHEHAE-VQIMIIECSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CNC(=O)[C@H]2CCC[N@@H+]2CC(C)C)c1 ZINC001419793394 1375887409 /nfs/dbraw/zinc/88/74/09/1375887409.db2.gz UZVYSYDYTHEHAE-VQIMIIECSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)[C@@H]2CCC[N@H+]2CC(C)C)c1 ZINC001419793376 1375888205 /nfs/dbraw/zinc/88/82/05/1375888205.db2.gz UZVYSYDYTHEHAE-LPHOPBHVSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)[C@@H]2CCC[N@@H+]2CC(C)C)c1 ZINC001419793376 1375888209 /nfs/dbraw/zinc/88/82/09/1375888209.db2.gz UZVYSYDYTHEHAE-LPHOPBHVSA-N 1 3 349.494 2.849 10 0 EFAEHO CC(C)C[C@H](C[NH2+]CC1CC(C)(C)C1)NC(=O)CN1CC[C@@H](C)C1 ZINC001419793985 1375889720 /nfs/dbraw/zinc/88/97/20/1375889720.db2.gz PLEBSBPTELLKOA-SJLPKXTDSA-N 1 3 337.552 2.885 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]C/C=C/c2ccccc2)[C@H](C)C1 ZINC001419820280 1375932793 /nfs/dbraw/zinc/93/27/93/1375932793.db2.gz KKESAFGRSWIUHT-YGQKLEOUSA-N 1 3 343.515 2.867 10 0 EFAEHO CC[C@@H](C)C[NH2+]C[C@H](NC(=O)Cc1nc[nH]c1C)C1CCCCC1 ZINC001419822369 1375938411 /nfs/dbraw/zinc/93/84/11/1375938411.db2.gz QCQNFHVAIKUMAW-KDOFPFPSSA-N 1 3 334.508 2.961 10 0 EFAEHO CC[C@H](F)C[N@H+](C)CCC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001419840331 1375971742 /nfs/dbraw/zinc/97/17/42/1375971742.db2.gz OQBFMTCKQVALJZ-ZWKOTPCHSA-N 1 3 343.531 2.881 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)CCC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001419840331 1375971752 /nfs/dbraw/zinc/97/17/52/1375971752.db2.gz OQBFMTCKQVALJZ-ZWKOTPCHSA-N 1 3 343.531 2.881 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]C/C=C/Cl ZINC001419906828 1376108416 /nfs/dbraw/zinc/10/84/16/1376108416.db2.gz MSPJJRBWJRSGDL-FHQWLQQXSA-N 1 3 329.916 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+][C@H](C)c1ccc2c(c1)CCC2 ZINC001419930311 1376146562 /nfs/dbraw/zinc/14/65/62/1376146562.db2.gz CIKZKGDJIJHFMQ-JKSUJKDBSA-N 1 3 331.504 2.671 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H]([NH2+][C@@H]1CCc2ccccc21)C(C)C ZINC001419933038 1376149840 /nfs/dbraw/zinc/14/98/40/1376149840.db2.gz ZAUJZYINBIMNCS-IEBWSBKVSA-N 1 3 340.471 2.679 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001419939475 1376160780 /nfs/dbraw/zinc/16/07/80/1376160780.db2.gz WLYHYVHHERMIJD-LJQANCHMSA-N 1 3 344.503 2.739 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@H]2CN(C(=O)CN(C)C3CCC3)CC[C@H]21 ZINC001420071998 1376418526 /nfs/dbraw/zinc/41/85/26/1376418526.db2.gz FTTABMJSLKRLIU-PKOBYXMFSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@H]2CN(C(=O)CN(C)C3CCC3)CC[C@H]21 ZINC001420071998 1376418531 /nfs/dbraw/zinc/41/85/31/1376418531.db2.gz FTTABMJSLKRLIU-PKOBYXMFSA-N 1 3 335.536 2.830 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](C)CCNC(=O)CN1CC[C@@H](C)C1 ZINC001420129706 1376487032 /nfs/dbraw/zinc/48/70/32/1376487032.db2.gz HIKYTVXHLJWDLO-IAGOWNOFSA-N 1 3 331.504 2.575 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NCCN(C)Cc1ccc2cc[nH]c2c1 ZINC001420238671 1376598196 /nfs/dbraw/zinc/59/81/96/1376598196.db2.gz OOVCJBQIQPDUGI-LJQANCHMSA-N 1 3 342.487 2.590 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NCCN(C)Cc1ccc2cc[nH]c2c1 ZINC001420238671 1376598205 /nfs/dbraw/zinc/59/82/05/1376598205.db2.gz OOVCJBQIQPDUGI-LJQANCHMSA-N 1 3 342.487 2.590 10 0 EFAEHO CN(CCNC(=O)C12CCC[NH+](CCC1)C2)Cc1ccc(CF)cc1 ZINC001420251001 1376616251 /nfs/dbraw/zinc/61/62/51/1376616251.db2.gz IJKKCVMTHXSIBS-UHFFFAOYSA-N 1 3 347.478 2.580 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001420289065 1376672083 /nfs/dbraw/zinc/67/20/83/1376672083.db2.gz SKCFSVIYEMGWCQ-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CC1CCC(F)(F)CC1 ZINC001420296290 1376684143 /nfs/dbraw/zinc/68/41/43/1376684143.db2.gz DYLHYLNCYQMJHS-GDBMZVCRSA-N 1 3 345.478 2.781 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001420304664 1376698510 /nfs/dbraw/zinc/69/85/10/1376698510.db2.gz AYHPFBQZURPZIL-CZUORRHYSA-N 1 3 325.884 2.583 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)C[N@@H+]2CC[C@H](C)C2)c(Cl)c1 ZINC001420336917 1376757432 /nfs/dbraw/zinc/75/74/32/1376757432.db2.gz FICMRTPWGATEKB-LSDHHAIUSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)C[N@H+]2CC[C@H](C)C2)c(Cl)c1 ZINC001420336917 1376757436 /nfs/dbraw/zinc/75/74/36/1376757436.db2.gz FICMRTPWGATEKB-LSDHHAIUSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001420341968 1376767481 /nfs/dbraw/zinc/76/74/81/1376767481.db2.gz YHLIQFKYQYBSLO-RDTXWAMCSA-N 1 3 331.504 2.548 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@H](C(C)C)[NH+]2CCCC2)c1 ZINC001420359534 1376801671 /nfs/dbraw/zinc/80/16/71/1376801671.db2.gz SXQGOWWRKQLNMT-FQEVSTJZSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[N@H+](CCNC(=O)C1(N(C)C)CCC1)CC1CCC2(CC2)CC1 ZINC001420391643 1376868746 /nfs/dbraw/zinc/86/87/46/1376868746.db2.gz GRTGBSJGJAPQHB-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[N@@H+](CCNC(=O)C1(N(C)C)CCC1)CC1CCC2(CC2)CC1 ZINC001420391643 1376868748 /nfs/dbraw/zinc/86/87/48/1376868748.db2.gz GRTGBSJGJAPQHB-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21)Cc1cccc(C)c1 ZINC001420394879 1376874766 /nfs/dbraw/zinc/87/47/66/1376874766.db2.gz GOSOJWWVHCGZDD-PMACEKPBSA-N 1 3 343.515 2.950 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21)Cc1cccc(C)c1 ZINC001420394879 1376874772 /nfs/dbraw/zinc/87/47/72/1376874772.db2.gz GOSOJWWVHCGZDD-PMACEKPBSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@@H]2CCC[N@H+]2CC(C)C)c1 ZINC001420449782 1376997769 /nfs/dbraw/zinc/99/77/69/1376997769.db2.gz VOGHVIQHWDJAEF-LPHOPBHVSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@@H]2CCC[N@@H+]2CC(C)C)c1 ZINC001420449782 1376997773 /nfs/dbraw/zinc/99/77/73/1376997773.db2.gz VOGHVIQHWDJAEF-LPHOPBHVSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(CN2CCC[C@@H]2CNC(=O)CC[C@H]2CCC[N@H+]2C)cc1 ZINC001420466645 1377027463 /nfs/dbraw/zinc/02/74/63/1377027463.db2.gz DUSAKSQKARIQMT-WOJBJXKFSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccc(CN2CCC[C@@H]2CNC(=O)CC[C@H]2CCC[N@@H+]2C)cc1 ZINC001420466645 1377027465 /nfs/dbraw/zinc/02/74/65/1377027465.db2.gz DUSAKSQKARIQMT-WOJBJXKFSA-N 1 3 343.515 2.950 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C ZINC001420509697 1377105452 /nfs/dbraw/zinc/10/54/52/1377105452.db2.gz WXCRENMEJUOBLP-HNAYVOBHSA-N 1 3 331.504 2.889 10 0 EFAEHO Cc1ccc(F)c(CN2CC[C@@H](CNC(=O)[C@H](C(C)C)[NH+](C)C)C2)c1 ZINC001420560389 1377200173 /nfs/dbraw/zinc/20/01/73/1377200173.db2.gz MKKCJCNBMSNTOW-LPHOPBHVSA-N 1 3 349.494 2.658 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(Cl)cc1)NC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001420574674 1377230437 /nfs/dbraw/zinc/23/04/37/1377230437.db2.gz FDMWCUZYWBLWBF-KDOFPFPSSA-N 1 3 349.906 2.618 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C[N@H+](C)CC[C@@H]1CCCC1(F)F ZINC001420661849 1377445264 /nfs/dbraw/zinc/44/52/64/1377445264.db2.gz KVAXVRMUQJRDSJ-OCCSQVGLSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC001420661849 1377445273 /nfs/dbraw/zinc/44/52/73/1377445273.db2.gz KVAXVRMUQJRDSJ-OCCSQVGLSA-N 1 3 342.434 2.523 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)Cc1ccccc1C1CC1 ZINC001420668673 1377466760 /nfs/dbraw/zinc/46/67/60/1377466760.db2.gz BMEOOCYSHFMNRO-MRXNPFEDSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)Cc1ccccc1C1CC1 ZINC001420668673 1377466762 /nfs/dbraw/zinc/46/67/62/1377466762.db2.gz BMEOOCYSHFMNRO-MRXNPFEDSA-N 1 3 331.504 2.841 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@H+](C)Cc1ccc(C)cc1 ZINC001420673007 1377479094 /nfs/dbraw/zinc/47/90/94/1377479094.db2.gz GKPPKOBBOUGJHF-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)C[N@@H+](C)Cc1ccc(C)cc1 ZINC001420673007 1377479097 /nfs/dbraw/zinc/47/90/97/1377479097.db2.gz GKPPKOBBOUGJHF-IEBWSBKVSA-N 1 3 331.504 2.806 10 0 EFAEHO C[N@@H+]1CC[C@H](C(=O)NCCN(Cc2ccc(C3CC3)cc2)C2CC2)C1 ZINC001420705190 1377538203 /nfs/dbraw/zinc/53/82/03/1377538203.db2.gz KHWGUKJIYRTMJW-IBGZPJMESA-N 1 3 341.499 2.596 10 0 EFAEHO C[N@H+]1CC[C@H](C(=O)NCCN(Cc2ccc(C3CC3)cc2)C2CC2)C1 ZINC001420705190 1377538210 /nfs/dbraw/zinc/53/82/10/1377538210.db2.gz KHWGUKJIYRTMJW-IBGZPJMESA-N 1 3 341.499 2.596 10 0 EFAEHO CC[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]CC[C@H]1CCCC1(F)F ZINC001438314705 1388502938 /nfs/dbraw/zinc/50/29/38/1388502938.db2.gz WRURTFIFOZTVPN-HUUCEWRRSA-N 1 3 345.478 2.781 10 0 EFAEHO CCCN1CCCC[C@@H]1C(=O)N1C[C@]23C[N@H+](C)C[C@@]2(C1)CCCC3 ZINC001420713078 1377552262 /nfs/dbraw/zinc/55/22/62/1377552262.db2.gz WPWAPETZGSBMAQ-RLLQIKCJSA-N 1 3 333.520 2.585 10 0 EFAEHO CCCN1CCCC[C@@H]1C(=O)N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001420713078 1377552266 /nfs/dbraw/zinc/55/22/66/1377552266.db2.gz WPWAPETZGSBMAQ-RLLQIKCJSA-N 1 3 333.520 2.585 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]Cc1cc2ccccc2o1)C1CC1 ZINC001420803036 1377691251 /nfs/dbraw/zinc/69/12/51/1377691251.db2.gz XFKUSSIYTVUTOX-GOSISDBHSA-N 1 3 343.471 2.757 10 0 EFAEHO CCCN(C(=O)[C@H]1CCCN1C(C)C)[C@H]1CC[N@H+](CC2CCC2)C1 ZINC001420808107 1377698267 /nfs/dbraw/zinc/69/82/67/1377698267.db2.gz VDVNNJHDBOVIOJ-RBUKOAKNSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C(=O)[C@H]1CCCN1C(C)C)[C@H]1CC[N@@H+](CC2CCC2)C1 ZINC001420808107 1377698269 /nfs/dbraw/zinc/69/82/69/1377698269.db2.gz VDVNNJHDBOVIOJ-RBUKOAKNSA-N 1 3 335.536 2.972 10 0 EFAEHO C[N@H+](CCC1CCCCC1)C[C@H]1CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001420932346 1377901112 /nfs/dbraw/zinc/90/11/12/1377901112.db2.gz OKWGNWQPKPGNFW-QGZVFWFLSA-N 1 3 332.492 2.703 10 0 EFAEHO C[N@@H+](CCC1CCCCC1)C[C@H]1CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001420932346 1377901115 /nfs/dbraw/zinc/90/11/15/1377901115.db2.gz OKWGNWQPKPGNFW-QGZVFWFLSA-N 1 3 332.492 2.703 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](C[N@H+](C)CCC3CCCC3)C2)C1 ZINC001420943165 1377917455 /nfs/dbraw/zinc/91/74/55/1377917455.db2.gz LGGWRMACFYUCRU-MJGOQNOKSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](C[N@@H+](C)CCC3CCCC3)C2)C1 ZINC001420943165 1377917458 /nfs/dbraw/zinc/91/74/58/1377917458.db2.gz LGGWRMACFYUCRU-MJGOQNOKSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](C[N@H+](C)CCC3CCCC3)C2)C1 ZINC001420943161 1377917720 /nfs/dbraw/zinc/91/77/20/1377917720.db2.gz LGGWRMACFYUCRU-IEBWSBKVSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](C[N@@H+](C)CCC3CCCC3)C2)C1 ZINC001420943161 1377917722 /nfs/dbraw/zinc/91/77/22/1377917722.db2.gz LGGWRMACFYUCRU-IEBWSBKVSA-N 1 3 335.536 2.689 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NCC1([NH2+][C@H]2CCc3ccccc32)CC1 ZINC001420955408 1377935331 /nfs/dbraw/zinc/93/53/31/1377935331.db2.gz SCXNRXSPELWATB-ROUUACIJSA-N 1 3 347.478 2.592 10 0 EFAEHO Cc1cc(Cl)ccc1CNC1(CNC(=O)C[C@@H]2CC[N@@H+](C)C2)CC1 ZINC001420991810 1377987413 /nfs/dbraw/zinc/98/74/13/1377987413.db2.gz BQDHSYHYCZBLGZ-HNNXBMFYSA-N 1 3 349.906 2.729 10 0 EFAEHO Cc1cc(Cl)ccc1CNC1(CNC(=O)C[C@@H]2CC[N@H+](C)C2)CC1 ZINC001420991810 1377987419 /nfs/dbraw/zinc/98/74/19/1377987419.db2.gz BQDHSYHYCZBLGZ-HNNXBMFYSA-N 1 3 349.906 2.729 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CC2)c(C)c1 ZINC001421003405 1378006261 /nfs/dbraw/zinc/00/62/61/1378006261.db2.gz CHEMTMHDERADSL-UHFFFAOYSA-N 1 3 331.504 2.690 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+][C@@H](C)c2ccc(Cl)cc2)CC1 ZINC001421007591 1378012964 /nfs/dbraw/zinc/01/29/64/1378012964.db2.gz XRBHNYBEENKPAO-AWEZNQCLSA-N 1 3 337.895 2.980 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@@]2(CCN(Cc3ccsc3)C2)C1 ZINC001421042823 1378061360 /nfs/dbraw/zinc/06/13/60/1378061360.db2.gz ZBMYEVOHZPBTKC-GOSISDBHSA-N 1 3 335.517 2.514 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@@]2(CCN(Cc3ccsc3)C2)C1 ZINC001421042823 1378061361 /nfs/dbraw/zinc/06/13/61/1378061361.db2.gz ZBMYEVOHZPBTKC-GOSISDBHSA-N 1 3 335.517 2.514 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC2(C1)CCN(Cc1ccccc1F)CC2 ZINC001421043740 1378061544 /nfs/dbraw/zinc/06/15/44/1378061544.db2.gz YFTFTAFTTHQJEU-UHFFFAOYSA-N 1 3 347.478 2.592 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCc2ccccc2)C[C@@H]1C ZINC001421103750 1378131692 /nfs/dbraw/zinc/13/16/92/1378131692.db2.gz LGSSQMAIAUCRRU-PKOBYXMFSA-N 1 3 331.504 2.538 10 0 EFAEHO CC[C@H](CNC(=O)Cc1nc[nH]c1C)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001438359240 1388532230 /nfs/dbraw/zinc/53/22/30/1388532230.db2.gz PBLUHEOOUXKUNW-ZIAGYGMSSA-N 1 3 342.434 2.571 10 0 EFAEHO CC[C@H](CNC(=O)Cc1nc[nH]c1C)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001438359231 1388532417 /nfs/dbraw/zinc/53/24/17/1388532417.db2.gz PBLUHEOOUXKUNW-UONOGXRCSA-N 1 3 342.434 2.571 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH+]2CC(CNC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001421148243 1378186724 /nfs/dbraw/zinc/18/67/24/1378186724.db2.gz MTVAXJBJGPPDMN-KRWDZBQOSA-N 1 3 343.515 2.897 10 0 EFAEHO CC[C@@H](C(=O)NCC1C[NH+]([C@H](C)c2cc(C)ccc2C)C1)N(C)C ZINC001421178946 1378237129 /nfs/dbraw/zinc/23/71/29/1378237129.db2.gz GWYLTDIBIJCUFN-APWZRJJASA-N 1 3 331.504 2.753 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1C[NH+](CCCc2ccccc2)C1 ZINC001421201029 1378269654 /nfs/dbraw/zinc/26/96/54/1378269654.db2.gz PNNHDFGVTSXHRN-HDICACEKSA-N 1 3 343.515 2.540 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CCCC(C)(C)C ZINC001421209731 1378281297 /nfs/dbraw/zinc/28/12/97/1378281297.db2.gz ZZZQCZOVFICJKL-OKZBNKHCSA-N 1 3 335.536 2.971 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CCCC(C)(C)C ZINC001421209731 1378281299 /nfs/dbraw/zinc/28/12/99/1378281299.db2.gz ZZZQCZOVFICJKL-OKZBNKHCSA-N 1 3 335.536 2.971 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1(C)CC[NH+](CCC2CC2)CC1 ZINC001421282293 1378421432 /nfs/dbraw/zinc/42/14/32/1378421432.db2.gz MXXHFGXOXURJGU-IAGOWNOFSA-N 1 3 335.536 2.878 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@]1(C)CCCN(C/C=C/c2ccccc2)C1 ZINC001421283466 1378423627 /nfs/dbraw/zinc/42/36/27/1378423627.db2.gz JHLOODRVZLEQPM-AKERNLMBSA-N 1 3 343.515 2.870 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@H+](CC2CC(C)(C)C2)C1 ZINC001421355994 1378537539 /nfs/dbraw/zinc/53/75/39/1378537539.db2.gz UPLVIIWPDKNTKS-SJLPKXTDSA-N 1 3 335.536 2.687 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001421355994 1378537546 /nfs/dbraw/zinc/53/75/46/1378537546.db2.gz UPLVIIWPDKNTKS-SJLPKXTDSA-N 1 3 335.536 2.687 10 0 EFAEHO CC[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@H](C)c1cccc(OC)c1 ZINC001421425839 1378601683 /nfs/dbraw/zinc/60/16/83/1378601683.db2.gz QHZLTSYVQSZXTF-WBVHZDCISA-N 1 3 347.503 2.725 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1cccc(OC)c1 ZINC001421444209 1378623612 /nfs/dbraw/zinc/62/36/12/1378623612.db2.gz XBSIDPWDRDEEJR-QGZVFWFLSA-N 1 3 347.503 2.554 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H](C(C)C)[NH+](C)C)NCc1cc(C)ccc1F ZINC001421470510 1378659909 /nfs/dbraw/zinc/65/99/09/1378659909.db2.gz KFSDNGYMFWAVJS-FUHWJXTLSA-N 1 3 337.483 2.705 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(CCF)C2 ZINC001421512188 1378721000 /nfs/dbraw/zinc/72/10/00/1378721000.db2.gz IWIPXFHVUXZELZ-ZOBUZTSGSA-N 1 3 339.499 2.578 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(CCF)C2 ZINC001421512188 1378721009 /nfs/dbraw/zinc/72/10/09/1378721009.db2.gz IWIPXFHVUXZELZ-ZOBUZTSGSA-N 1 3 339.499 2.578 10 0 EFAEHO CN(CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccsc1)C2)C1CCC1 ZINC001421516787 1378731402 /nfs/dbraw/zinc/73/14/02/1378731402.db2.gz UWOQCSXRWDGJEO-JZXOWHBKSA-N 1 3 347.528 2.702 10 0 EFAEHO CN(CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccsc1)C2)C1CCC1 ZINC001421516787 1378731403 /nfs/dbraw/zinc/73/14/03/1378731403.db2.gz UWOQCSXRWDGJEO-JZXOWHBKSA-N 1 3 347.528 2.702 10 0 EFAEHO C[C@H]([NH2+]CC1CCCC1)[C@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001421518730 1378734429 /nfs/dbraw/zinc/73/44/29/1378734429.db2.gz CMVBNADZIZSMRF-WMZOPIPTSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1F ZINC001421547375 1378791330 /nfs/dbraw/zinc/79/13/30/1378791330.db2.gz RXGGKQRASMCXIF-SJLPKXTDSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@](C)(C[NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001421581540 1378843876 /nfs/dbraw/zinc/84/38/76/1378843876.db2.gz FITMITKTNZRWJH-LJQANCHMSA-N 1 3 344.503 2.715 10 0 EFAEHO CC[C@@H](C(=O)N[C@@](C)(C[NH2+]Cc1cc(C)ccc1F)C1CC1)N(C)C ZINC001438423548 1388583115 /nfs/dbraw/zinc/58/31/15/1388583115.db2.gz ZTIWJVNAARROLG-ICSRJNTNSA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@H](CNC(=O)[C@H](C)N1CCCCCC1)C[NH2+]Cc1ccsc1 ZINC001421740537 1379063683 /nfs/dbraw/zinc/06/36/83/1379063683.db2.gz QSYXDHWSJNCYPG-HOTGVXAUSA-N 1 3 337.533 2.855 10 0 EFAEHO Cc1ccncc1CN(C)CCCN(C)C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001421866670 1379265332 /nfs/dbraw/zinc/26/53/32/1379265332.db2.gz LEWJVLYTWXMVHP-LJQANCHMSA-N 1 3 346.519 2.545 10 0 EFAEHO Cc1ccncc1CN(C)CCCN(C)C(=O)CC[C@H]1CCC[N@H+]1C ZINC001421866670 1379265338 /nfs/dbraw/zinc/26/53/38/1379265338.db2.gz LEWJVLYTWXMVHP-LJQANCHMSA-N 1 3 346.519 2.545 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@H+](C)[C@H]1CCc2c1cccc2F ZINC001421900809 1379327110 /nfs/dbraw/zinc/32/71/10/1379327110.db2.gz HERIOYZBDRFYAN-IBGZPJMESA-N 1 3 349.494 2.934 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)[C@H]1CCc2c1cccc2F ZINC001421900809 1379327119 /nfs/dbraw/zinc/32/71/19/1379327119.db2.gz HERIOYZBDRFYAN-IBGZPJMESA-N 1 3 349.494 2.934 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1cccc(OC)c1 ZINC001421988460 1379444192 /nfs/dbraw/zinc/44/41/92/1379444192.db2.gz RMBJJGZTBFQUFP-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CCCC2)cc1 ZINC001421993842 1379452768 /nfs/dbraw/zinc/45/27/68/1379452768.db2.gz NYZNYKMIYWRATA-QGZVFWFLSA-N 1 3 331.504 2.842 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001422028672 1379511844 /nfs/dbraw/zinc/51/18/44/1379511844.db2.gz LWOQACALXDGMDX-APWZRJJASA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)C[C@@H]1C ZINC001422028679 1379512052 /nfs/dbraw/zinc/51/20/52/1379512052.db2.gz LWOQACALXDGMDX-QFBILLFUSA-N 1 3 349.494 2.801 10 0 EFAEHO CC(C)[NH2+]CC[C@@H]1CCCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001422034466 1379520185 /nfs/dbraw/zinc/52/01/85/1379520185.db2.gz UGPNGGHZBGIQMG-LPHOPBHVSA-N 1 3 341.515 2.968 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCCC1CC[NH+](Cc2ccsc2)CC1 ZINC001438450514 1388613823 /nfs/dbraw/zinc/61/38/23/1388613823.db2.gz JVBUYGULNIFFAP-KRWDZBQOSA-N 1 3 335.517 2.561 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(CC[N@H+](C)Cc2ccsc2)CC1 ZINC001422049344 1379541435 /nfs/dbraw/zinc/54/14/35/1379541435.db2.gz LRJNZBKCYQUBQN-SFHVURJKSA-N 1 3 349.544 2.903 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(CC[N@@H+](C)Cc2ccsc2)CC1 ZINC001422049344 1379541438 /nfs/dbraw/zinc/54/14/38/1379541438.db2.gz LRJNZBKCYQUBQN-SFHVURJKSA-N 1 3 349.544 2.903 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H]2[C@H](C)CCCN2C(=O)CC[NH+](C)C)c1 ZINC001422070263 1379571818 /nfs/dbraw/zinc/57/18/18/1379571818.db2.gz WWBBNWZCPGBEMW-APWZRJJASA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H](C)[NH+]1CCCCCC1)NCc1ccccn1 ZINC001422108319 1379620971 /nfs/dbraw/zinc/62/09/71/1379620971.db2.gz BPXGPCIPWHWSNY-PKOBYXMFSA-N 1 3 346.519 2.577 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H](C)[NH+]1CCCCCC1)NCc1ccccn1 ZINC001422108312 1379621030 /nfs/dbraw/zinc/62/10/30/1379621030.db2.gz BPXGPCIPWHWSNY-MJGOQNOKSA-N 1 3 346.519 2.577 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1CC1CC(C)(C)C1 ZINC001422125354 1379650426 /nfs/dbraw/zinc/65/04/26/1379650426.db2.gz TUYWZAOXACJKRS-DOTOQJQBSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@H+]1CC1CC(C)(C)C1 ZINC001422125354 1379650428 /nfs/dbraw/zinc/65/04/28/1379650428.db2.gz TUYWZAOXACJKRS-DOTOQJQBSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC[C@H](C)[NH2+][C@H]1CCc2ccccc21)N(C)C ZINC001422146727 1379684354 /nfs/dbraw/zinc/68/43/54/1379684354.db2.gz GRPRIQZAQDFRCF-SNRMKQJTSA-N 1 3 331.504 2.745 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2ccc(C)cc2)CC[N@@H+]1C ZINC001422163754 1379709560 /nfs/dbraw/zinc/70/95/60/1379709560.db2.gz FLZLXOORSXFMON-RBUKOAKNSA-N 1 3 331.504 2.616 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2ccc(C)cc2)CC[N@H+]1C ZINC001422163754 1379709562 /nfs/dbraw/zinc/70/95/62/1379709562.db2.gz FLZLXOORSXFMON-RBUKOAKNSA-N 1 3 331.504 2.616 10 0 EFAEHO CN(C)C1(C(=O)NCCC2CC[NH+](CC3CCCC3)CC2)CCC1 ZINC001438459689 1388624626 /nfs/dbraw/zinc/62/46/26/1388624626.db2.gz WYQJZQDCIQVWMX-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccccc1CN(C)CCN(C)C(=O)C12CCC[NH+](CCC1)C2 ZINC001422169164 1379716977 /nfs/dbraw/zinc/71/69/77/1379716977.db2.gz GNXMHEKLMLOULL-UHFFFAOYSA-N 1 3 343.515 2.761 10 0 EFAEHO COc1cccc([C@@H](C)N(C)CCN(C)C(=O)[C@H](C(C)C)[NH+](C)C)c1 ZINC001422174699 1379727134 /nfs/dbraw/zinc/72/71/34/1379727134.db2.gz QCFQBQURDYHWFR-APWZRJJASA-N 1 3 349.519 2.733 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@H+](C)CC[C@@H]1CCCC1(F)F)N(C)C ZINC001422232444 1379822706 /nfs/dbraw/zinc/82/27/06/1379822706.db2.gz VNPABGULLFUASI-JKSUJKDBSA-N 1 3 347.494 2.788 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@@H+](C)CC[C@@H]1CCCC1(F)F)N(C)C ZINC001422232444 1379822710 /nfs/dbraw/zinc/82/27/10/1379822710.db2.gz VNPABGULLFUASI-JKSUJKDBSA-N 1 3 347.494 2.788 10 0 EFAEHO C[N@H+](C/C=C\c1ccccc1)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001422242288 1379842658 /nfs/dbraw/zinc/84/26/58/1379842658.db2.gz HQTNYURCIKOXGR-QRGKHIHXSA-N 1 3 341.499 2.718 10 0 EFAEHO C[N@@H+](C/C=C\c1ccccc1)C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001422242288 1379842661 /nfs/dbraw/zinc/84/26/61/1379842661.db2.gz HQTNYURCIKOXGR-QRGKHIHXSA-N 1 3 341.499 2.718 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2CC2CC(C)(C)C2)C1 ZINC001422243256 1379846116 /nfs/dbraw/zinc/84/61/16/1379846116.db2.gz GEIKXTAUAXTNHG-MSOLQXFVSA-N 1 3 335.536 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2CC2CC(C)(C)C2)C1 ZINC001422243256 1379846121 /nfs/dbraw/zinc/84/61/21/1379846121.db2.gz GEIKXTAUAXTNHG-MSOLQXFVSA-N 1 3 335.536 2.687 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[N@H+](C)CCc1cccs1)N(C)C ZINC001422252015 1379863769 /nfs/dbraw/zinc/86/37/69/1379863769.db2.gz KOEALHUNNIAHKJ-DOTOQJQBSA-N 1 3 337.533 2.554 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[N@@H+](C)CCc1cccs1)N(C)C ZINC001422252015 1379863776 /nfs/dbraw/zinc/86/37/76/1379863776.db2.gz KOEALHUNNIAHKJ-DOTOQJQBSA-N 1 3 337.533 2.554 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[C@H]1C[NH2+]Cc1cc(C)ccc1F ZINC001422288988 1379900540 /nfs/dbraw/zinc/90/05/40/1379900540.db2.gz XKPHKUIKZNJWAI-LPHOPBHVSA-N 1 3 349.494 2.850 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[C@@H]1C[NH2+]Cc1cc(C)ccc1F ZINC001422288986 1379900601 /nfs/dbraw/zinc/90/06/01/1379900601.db2.gz XKPHKUIKZNJWAI-APWZRJJASA-N 1 3 349.494 2.850 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]Cc2ccccc2C2CC2)C1)N(C)C ZINC001422298662 1379907157 /nfs/dbraw/zinc/90/71/57/1379907157.db2.gz XUXACLHQCSEUJT-UPQHMETBSA-N 1 3 343.515 2.889 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)cc1 ZINC001422384011 1380016129 /nfs/dbraw/zinc/01/61/29/1380016129.db2.gz VONASIJLLOMTFV-SJORKVTESA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)cc1 ZINC001422384007 1380016266 /nfs/dbraw/zinc/01/62/66/1380016266.db2.gz VONASIJLLOMTFV-IRXDYDNUSA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)cc1 ZINC001422383993 1380016529 /nfs/dbraw/zinc/01/65/29/1380016529.db2.gz VONASIJLLOMTFV-DLBZAZTESA-N 1 3 331.504 2.852 10 0 EFAEHO CC(C)c1cccc(CN[C@H](C)[C@@H](C)NC(=O)C2CC[NH+](C)CC2)n1 ZINC001422397884 1380036842 /nfs/dbraw/zinc/03/68/42/1380036842.db2.gz YPNGIVQETRBXNX-HZPDHXFCSA-N 1 3 346.519 2.530 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(C)cc1Cl ZINC001422410463 1380052942 /nfs/dbraw/zinc/05/29/42/1380052942.db2.gz HITCJUJRRDKQGQ-CABCVRRESA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@H](F)C[NH2+]C1CCC(N(C)C(=O)CN2CCC(C)CC2)CC1 ZINC001422420359 1380065642 /nfs/dbraw/zinc/06/56/42/1380065642.db2.gz JFHJIYROTPNBAP-AOCRQIFASA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1cccc2cccnc21 ZINC001422432348 1380089127 /nfs/dbraw/zinc/08/91/27/1380089127.db2.gz DJJWUHMAKJPUQY-HZPDHXFCSA-N 1 3 342.487 2.558 10 0 EFAEHO CCN(CCN[C@H](C)c1ccccc1Cl)C(=O)CC[NH+](C)C ZINC001422457844 1380135432 /nfs/dbraw/zinc/13/54/32/1380135432.db2.gz GPRYKUXCKKICEM-CQSZACIVSA-N 1 3 325.884 2.791 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)n1 ZINC001422542479 1380286834 /nfs/dbraw/zinc/28/68/34/1380286834.db2.gz YXASNLMDXOMURD-MRXNPFEDSA-N 1 3 346.519 2.674 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C(F)F)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001422551382 1380304255 /nfs/dbraw/zinc/30/42/55/1380304255.db2.gz VOFMRBJNCPCDRG-ZIAGYGMSSA-N 1 3 339.430 2.560 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)N[C@H](C)CNCc1ccccc1F ZINC001422569681 1380340997 /nfs/dbraw/zinc/34/09/97/1380340997.db2.gz FMGLDISFMVPMQI-CRAIPNDOSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)N[C@H](C)CNCc1ccccc1F ZINC001422569681 1380340998 /nfs/dbraw/zinc/34/09/98/1380340998.db2.gz FMGLDISFMVPMQI-CRAIPNDOSA-N 1 3 335.467 2.683 10 0 EFAEHO C[C@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)N(C)Cc1ccc(Cl)cc1 ZINC001422581313 1380362916 /nfs/dbraw/zinc/36/29/16/1380362916.db2.gz SWGNQALIOXXZLK-ZBFHGGJFSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(Cl)cc1 ZINC001422581313 1380362919 /nfs/dbraw/zinc/36/29/19/1380362919.db2.gz SWGNQALIOXXZLK-ZBFHGGJFSA-N 1 3 337.895 2.618 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(C)c(F)c1 ZINC001422615199 1380439647 /nfs/dbraw/zinc/43/96/47/1380439647.db2.gz DCTLYMLQMNGILD-QAPCUYQASA-N 1 3 335.467 2.603 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CC1CCC2(CC2)CC1 ZINC001422651506 1380490382 /nfs/dbraw/zinc/49/03/82/1380490382.db2.gz SBXFVSIIZCAZSS-FUHWJXTLSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)[C@H]1CCCN1C)[NH2+]CC1CC(C)(C)C1 ZINC001422674972 1380560832 /nfs/dbraw/zinc/56/08/32/1380560832.db2.gz ZSDZGSBUZBXQKO-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC2(C[NH2+]Cc3ccsc3)CCCCC2)C1 ZINC001422686042 1380591845 /nfs/dbraw/zinc/59/18/45/1380591845.db2.gz XWHPSBLSQHNAIY-INIZCTEOSA-N 1 3 349.544 2.999 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)CNC(=O)CN(C)C(C)C)c(Cl)c1 ZINC001438549653 1388668417 /nfs/dbraw/zinc/66/84/17/1388668417.db2.gz JLBOBMXVPMNJSU-HNNXBMFYSA-N 1 3 339.911 2.831 10 0 EFAEHO CCCC[C@@H](CNCc1ccccc1F)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001422690721 1380607549 /nfs/dbraw/zinc/60/75/49/1380607549.db2.gz PQRVZMRGWUDAKO-SJORKVTESA-N 1 3 335.467 2.542 10 0 EFAEHO CCCC[C@@H](CNCc1ccccc1F)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001422690721 1380607554 /nfs/dbraw/zinc/60/75/54/1380607554.db2.gz PQRVZMRGWUDAKO-SJORKVTESA-N 1 3 335.467 2.542 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C1CN(Cc2ccccc2)C1)[NH+](CC)CC ZINC001422752247 1380758252 /nfs/dbraw/zinc/75/82/52/1380758252.db2.gz OFSGGXRIVNAHAN-APWZRJJASA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCCC3CCCC3)C[C@H]21)N(C)C ZINC001422817644 1380852434 /nfs/dbraw/zinc/85/24/34/1380852434.db2.gz COFLHWWOSZACPO-YSTOQKLRSA-N 1 3 349.563 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCCC3CCCC3)C[C@H]21)N(C)C ZINC001422817644 1380852439 /nfs/dbraw/zinc/85/24/39/1380852439.db2.gz COFLHWWOSZACPO-YSTOQKLRSA-N 1 3 349.563 2.837 10 0 EFAEHO C[C@H](C[N@H+](C)Cc1ccc2cc[nH]c2c1)NC(=O)C1(N(C)C)CCC1 ZINC001422817673 1380852574 /nfs/dbraw/zinc/85/25/74/1380852574.db2.gz DGGZHTJDRDUXMQ-OAHLLOKOSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@H](C[N@@H+](C)Cc1ccc2cc[nH]c2c1)NC(=O)C1(N(C)C)CCC1 ZINC001422817673 1380852585 /nfs/dbraw/zinc/85/25/85/1380852585.db2.gz DGGZHTJDRDUXMQ-OAHLLOKOSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@H](C[N@H+](C)Cc1ccccc1C1CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001422876771 1380986505 /nfs/dbraw/zinc/98/65/05/1380986505.db2.gz MNPOLEZTJHKSAO-IAGOWNOFSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](C[N@@H+](C)Cc1ccccc1C1CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001422876771 1380986506 /nfs/dbraw/zinc/98/65/06/1380986506.db2.gz MNPOLEZTJHKSAO-IAGOWNOFSA-N 1 3 343.515 2.842 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001422912722 1381042168 /nfs/dbraw/zinc/04/21/68/1381042168.db2.gz WLIXFMKDRVNHFT-LSDHHAIUSA-N 1 3 333.467 2.590 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001422912722 1381042169 /nfs/dbraw/zinc/04/21/69/1381042169.db2.gz WLIXFMKDRVNHFT-LSDHHAIUSA-N 1 3 333.467 2.590 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@H+](C)CCCc1ccccc1 ZINC001422913740 1381044853 /nfs/dbraw/zinc/04/48/53/1381044853.db2.gz CFXWNZQHBCZPRL-ICSRJNTNSA-N 1 3 345.531 2.930 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCCc1ccccc1 ZINC001422913740 1381044859 /nfs/dbraw/zinc/04/48/59/1381044859.db2.gz CFXWNZQHBCZPRL-ICSRJNTNSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)CC[C@H]1CCc2ccccc21 ZINC001422915249 1381048052 /nfs/dbraw/zinc/04/80/52/1381048052.db2.gz GGDNPVYLWGNGEB-PKOBYXMFSA-N 1 3 345.531 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)CC[C@H]1CCc2ccccc21 ZINC001422915249 1381048057 /nfs/dbraw/zinc/04/80/57/1381048057.db2.gz GGDNPVYLWGNGEB-PKOBYXMFSA-N 1 3 345.531 2.883 10 0 EFAEHO C[C@@H](C[N@H+](C)CC1CCCC1)NC(=O)c1cccc(CN(C)C)c1 ZINC001422921601 1381061823 /nfs/dbraw/zinc/06/18/23/1381061823.db2.gz WXDUFGGSMLUAHV-INIZCTEOSA-N 1 3 331.504 2.989 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC1CCCC1)NC(=O)c1cccc(CN(C)C)c1 ZINC001422921601 1381061828 /nfs/dbraw/zinc/06/18/28/1381061828.db2.gz WXDUFGGSMLUAHV-INIZCTEOSA-N 1 3 331.504 2.989 10 0 EFAEHO CC(C)[C@@H](CCNC(=O)[C@H]1CCCN1C)[NH2+]C/C(Cl)=C\Cl ZINC001422953176 1381113641 /nfs/dbraw/zinc/11/36/41/1381113641.db2.gz UWGOVTHQINLPPQ-DBLGQFABSA-N 1 3 336.307 2.520 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C2CC2)N(C)C(=O)CN(C)C(C)C)cc1 ZINC001422993674 1381175124 /nfs/dbraw/zinc/17/51/24/1381175124.db2.gz MZDDWEXGBRFMQI-IBGZPJMESA-N 1 3 331.504 2.662 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001422994592 1381176463 /nfs/dbraw/zinc/17/64/63/1381176463.db2.gz NMKRDYLJQMVAEQ-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C[NH2+][C@@H]1CCc2ccccc21)C1CC1 ZINC001423001499 1381187558 /nfs/dbraw/zinc/18/75/58/1381187558.db2.gz ZFJQRQFMRMPOIW-WOJBJXKFSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C[NH2+]Cc1ccc(C)cc1)C1CC1 ZINC001423004476 1381192258 /nfs/dbraw/zinc/19/22/58/1381192258.db2.gz PVKBVSOSGMBCPE-UXHICEINSA-N 1 3 343.515 2.854 10 0 EFAEHO C[C@@H](CNCc1cc2ccccc2o1)N(C)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001438638336 1388711848 /nfs/dbraw/zinc/71/18/48/1388711848.db2.gz DRZLNWBZHOVZJI-HDMKZQKVSA-N 1 3 343.471 2.710 10 0 EFAEHO C[C@@H](CNCc1cc2ccccc2o1)N(C)C(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001438638336 1388711854 /nfs/dbraw/zinc/71/18/54/1388711854.db2.gz DRZLNWBZHOVZJI-HDMKZQKVSA-N 1 3 343.471 2.710 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(C(F)F)cc1)N(C)C ZINC001423080298 1381314592 /nfs/dbraw/zinc/31/45/92/1381314592.db2.gz SKVRSWJDNBHIPH-CZUORRHYSA-N 1 3 341.446 2.901 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N(C)C[C@@H](C)NCc2ccsc2)C1 ZINC001423128953 1381402838 /nfs/dbraw/zinc/40/28/38/1381402838.db2.gz VCRSCSLDVMNQMK-WBVHZDCISA-N 1 3 337.533 2.807 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N(C)C[C@@H](C)NCc2ccsc2)C1 ZINC001423128953 1381402842 /nfs/dbraw/zinc/40/28/42/1381402842.db2.gz VCRSCSLDVMNQMK-WBVHZDCISA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)c1cccc(CN[C@H](C)CN(C)C(=O)[C@H](C(C)C)[NH+](C)C)n1 ZINC001423157243 1381464107 /nfs/dbraw/zinc/46/41/07/1381464107.db2.gz KBQAXBBPCSKDCX-APWZRJJASA-N 1 3 348.535 2.728 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001423169689 1381494224 /nfs/dbraw/zinc/49/42/24/1381494224.db2.gz IOBXZEFISZDMKG-MRXNPFEDSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001423169688 1381494490 /nfs/dbraw/zinc/49/44/90/1381494490.db2.gz IOBXZEFISZDMKG-INIZCTEOSA-N 1 3 331.504 2.841 10 0 EFAEHO C[C@@H](NC1(CNC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)CC1)c1cccc(Cl)c1 ZINC001423221454 1381612283 /nfs/dbraw/zinc/61/22/83/1381612283.db2.gz MBIFPRVJQHHWHF-CKEIUWERSA-N 1 3 349.906 2.980 10 0 EFAEHO C[C@@H](NC1(CNC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)CC1)c1cccc(Cl)c1 ZINC001423221454 1381612293 /nfs/dbraw/zinc/61/22/93/1381612293.db2.gz MBIFPRVJQHHWHF-CKEIUWERSA-N 1 3 349.906 2.980 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+][C@H](C)c2ccc(F)cc2)CC1 ZINC001423232547 1381639368 /nfs/dbraw/zinc/63/93/68/1381639368.db2.gz TZIJVKNGRSNHGN-QAPCUYQASA-N 1 3 347.478 3.000 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001438680058 1388735488 /nfs/dbraw/zinc/73/54/88/1388735488.db2.gz HXSDBAYRSLPJOG-MAUKXSAKSA-N 1 3 331.504 2.582 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001423245695 1381670688 /nfs/dbraw/zinc/67/06/88/1381670688.db2.gz PEFODGZOBHGFTP-QZTJIDSGSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001423245695 1381670718 /nfs/dbraw/zinc/67/07/18/1381670718.db2.gz PEFODGZOBHGFTP-QZTJIDSGSA-N 1 3 345.462 2.581 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]C/C=C\c2ccccc2)CC1 ZINC001423308263 1381763802 /nfs/dbraw/zinc/76/38/02/1381763802.db2.gz PNZRSSIUERXEJB-VTUQDJEPSA-N 1 3 341.499 2.811 10 0 EFAEHO C[C@H]1[C@H]([NH2+]CC2CC(C)(C)C2)CCN1C(=O)CN(C)CC(C)(C)C ZINC001423317448 1381775369 /nfs/dbraw/zinc/77/53/69/1381775369.db2.gz FLMKUPJSPBTSAM-DOTOQJQBSA-N 1 3 337.552 2.980 10 0 EFAEHO C[C@@H]1[C@H]([NH2+]CC2CC(C)(C)C2)CCN1C(=O)CN(C)CC(C)(C)C ZINC001423317453 1381776125 /nfs/dbraw/zinc/77/61/25/1381776125.db2.gz FLMKUPJSPBTSAM-NVXWUHKLSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@H]21 ZINC001423351657 1381828357 /nfs/dbraw/zinc/82/83/57/1381828357.db2.gz CLUNIFCAPHCEDK-KZNAEPCWSA-N 1 3 335.536 2.734 10 0 EFAEHO Cc1ccc(CN[C@H]2C[C@@H](C)N(C(=O)CC[NH+](C)C)C2)c(Cl)c1 ZINC001423357729 1381839657 /nfs/dbraw/zinc/83/96/57/1381839657.db2.gz QDQVWCBWBJWIJE-ZBFHGGJFSA-N 1 3 337.895 2.679 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CC2CC(C)(C)C2)CC1 ZINC001423358577 1381841189 /nfs/dbraw/zinc/84/11/89/1381841189.db2.gz WPMQUSRVZILTQL-HDICACEKSA-N 1 3 347.547 2.830 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CC[NH+](C)C)CCCN1Cc1ccc2c(c1)CCC2 ZINC001423368917 1381859875 /nfs/dbraw/zinc/85/98/75/1381859875.db2.gz GXZWLKYZVXHQAG-UZLBHIALSA-N 1 3 343.515 2.596 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@@]12CCC[C@H]1N(CCC(F)(F)F)CC2 ZINC001423374409 1381871170 /nfs/dbraw/zinc/87/11/70/1381871170.db2.gz YBJQZRKNMABVNM-GDBMZVCRSA-N 1 3 349.441 2.784 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@@]12CCC[C@H]1N(CCC(F)(F)F)CC2 ZINC001423374409 1381871173 /nfs/dbraw/zinc/87/11/73/1381871173.db2.gz YBJQZRKNMABVNM-GDBMZVCRSA-N 1 3 349.441 2.784 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H](C[NH2+]CC2CC3(CCC3)C2)C1 ZINC001423424372 1381933811 /nfs/dbraw/zinc/93/38/11/1381933811.db2.gz VPLCPVKZDSXEGH-SJLPKXTDSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(F)cc2)C[C@@H]1C ZINC001423447737 1381952629 /nfs/dbraw/zinc/95/26/29/1381952629.db2.gz FXSKZUZYVIQHFB-MAUKXSAKSA-N 1 3 335.467 2.635 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N1CCC(C)(NC(=O)CC[NH+](C)C)CC1 ZINC001423512646 1382001458 /nfs/dbraw/zinc/00/14/58/1382001458.db2.gz TYXVQVBEKODNTJ-HNNXBMFYSA-N 1 3 335.467 2.809 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]Cc1ccccc1C1CC1 ZINC001438715071 1388758128 /nfs/dbraw/zinc/75/81/28/1388758128.db2.gz ONNXDGDKLDDYBF-INIZCTEOSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1C(=O)N(C)[C@@H](C)CNCc1cc(C)ccc1F ZINC001438717193 1388760495 /nfs/dbraw/zinc/76/04/95/1388760495.db2.gz VKBOOTIIQGRXHX-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1C(=O)N(C)[C@@H](C)CNCc1cc(C)ccc1F ZINC001438717193 1388760496 /nfs/dbraw/zinc/76/04/96/1388760496.db2.gz VKBOOTIIQGRXHX-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001423570329 1382088532 /nfs/dbraw/zinc/08/85/32/1382088532.db2.gz GCMZUEAUXBGEGN-IRXDYDNUSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001423570329 1382088534 /nfs/dbraw/zinc/08/85/34/1382088534.db2.gz GCMZUEAUXBGEGN-IRXDYDNUSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001423570324 1382088767 /nfs/dbraw/zinc/08/87/67/1382088767.db2.gz GCMZUEAUXBGEGN-DLBZAZTESA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@H]1CCC[C@H]2CCC[N@H+]21 ZINC001423570324 1382088772 /nfs/dbraw/zinc/08/87/72/1382088772.db2.gz GCMZUEAUXBGEGN-DLBZAZTESA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N(C)CC(=O)N(CC[N@H+](C)C[C@@H]1CCC(F)(F)C1)C(C)C ZINC001423577195 1382104597 /nfs/dbraw/zinc/10/45/97/1382104597.db2.gz KOXSEERFOWDWDC-MRXNPFEDSA-N 1 3 347.494 2.931 10 0 EFAEHO CC(C)N(C)CC(=O)N(CC[N@@H+](C)C[C@@H]1CCC(F)(F)C1)C(C)C ZINC001423577195 1382104600 /nfs/dbraw/zinc/10/46/00/1382104600.db2.gz KOXSEERFOWDWDC-MRXNPFEDSA-N 1 3 347.494 2.931 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H](CNCc1ccc(F)cc1F)C(C)(C)C ZINC001423618938 1382176112 /nfs/dbraw/zinc/17/61/12/1382176112.db2.gz IZTBAJIAGZEIHE-MRXNPFEDSA-N 1 3 341.446 2.537 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C1CC[NH+](Cc2ccc(F)cc2)CC1)N(C)C ZINC001423660972 1382242503 /nfs/dbraw/zinc/24/25/03/1382242503.db2.gz AXLORWKOKAUBOO-HNAYVOBHSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]Cc2ccccc2Cl)C1 ZINC001423696767 1382308318 /nfs/dbraw/zinc/30/83/18/1382308318.db2.gz QQZFUBFDFXHMGR-UHFFFAOYSA-N 1 3 337.895 2.759 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CCC[C@](C)(CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001423708421 1382332306 /nfs/dbraw/zinc/33/23/06/1382332306.db2.gz UVGVZVPHNRVQOM-VQIMIIECSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CCC[C@](C)(CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001423708421 1382332311 /nfs/dbraw/zinc/33/23/11/1382332311.db2.gz UVGVZVPHNRVQOM-VQIMIIECSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1C ZINC001423952719 1382540959 /nfs/dbraw/zinc/54/09/59/1382540959.db2.gz XQBIHBBVHGAISP-QUCCMNQESA-N 1 3 345.531 2.828 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)N1C[C@@H]2CN(C(=O)CC[NH+](C)C)C[C@@H]2C1 ZINC001423978152 1382585901 /nfs/dbraw/zinc/58/59/01/1382585901.db2.gz ADSYJPYWYBRYJP-BHYGNILZSA-N 1 3 349.906 2.743 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N1C[C@@H]2CN(C(=O)CC[NH+](C)C)C[C@@H]2C1 ZINC001423978153 1382586067 /nfs/dbraw/zinc/58/60/67/1382586067.db2.gz ADSYJPYWYBRYJP-OIISXLGYSA-N 1 3 349.906 2.743 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2C[N@@H+](CC3CCC(C)CC3)C[C@@H]2C1 ZINC001423992587 1382603657 /nfs/dbraw/zinc/60/36/57/1382603657.db2.gz ZVTXFFKBYBRZQE-YHFFBGSDSA-N 1 3 335.536 2.545 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2C[N@H+](CC3CCC(C)CC3)C[C@@H]2C1 ZINC001423992587 1382603662 /nfs/dbraw/zinc/60/36/62/1382603662.db2.gz ZVTXFFKBYBRZQE-YHFFBGSDSA-N 1 3 335.536 2.545 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@H]1C[NH2+]Cc1ccc(F)cc1 ZINC001438770937 1388799733 /nfs/dbraw/zinc/79/97/33/1388799733.db2.gz VTHFJCCGWAWFDY-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2[C@@H]1CC[N@@H+]2CCC1CC1)N(CC)CC ZINC001424043482 1382658429 /nfs/dbraw/zinc/65/84/29/1382658429.db2.gz JUBYHQQJYZVXJI-QYZOEREBSA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2[C@@H]1CC[N@H+]2CCC1CC1)N(CC)CC ZINC001424043482 1382658433 /nfs/dbraw/zinc/65/84/33/1382658433.db2.gz JUBYHQQJYZVXJI-QYZOEREBSA-N 1 3 335.536 2.972 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([C@@H](C)[NH2+]CCC(C)(C)C)C1 ZINC001438771977 1388800479 /nfs/dbraw/zinc/80/04/79/1388800479.db2.gz PWACRVZDPLCTHQ-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([C@@H](C)[NH2+]CCC(C)(C)C)C1 ZINC001438771984 1388800991 /nfs/dbraw/zinc/80/09/91/1388800991.db2.gz PWACRVZDPLCTHQ-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]([C@H](C)[NH2+]CCC(C)(C)C)C1 ZINC001438771980 1388801185 /nfs/dbraw/zinc/80/11/85/1388801185.db2.gz PWACRVZDPLCTHQ-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([C@H](C)[NH2+]CC2CC(C)(C)C2)C1 ZINC001438773479 1388803053 /nfs/dbraw/zinc/80/30/53/1388803053.db2.gz RRQFVWXLJQDZKI-FUHWJXTLSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@@H](C(=O)NCc1ccccc1C[N@H+](C)CC1CC1)N(C)C ZINC001424076538 1382735479 /nfs/dbraw/zinc/73/54/79/1382735479.db2.gz FGOTWXSCUWEJJR-IBGZPJMESA-N 1 3 331.504 2.731 10 0 EFAEHO CC(C)[C@@H](C(=O)NCc1ccccc1C[N@@H+](C)CC1CC1)N(C)C ZINC001424076538 1382735482 /nfs/dbraw/zinc/73/54/82/1382735482.db2.gz FGOTWXSCUWEJJR-IBGZPJMESA-N 1 3 331.504 2.731 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001438776009 1388805659 /nfs/dbraw/zinc/80/56/59/1388805659.db2.gz XAXLCKLETBIQRY-QFBILLFUSA-N 1 3 349.494 2.801 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+]CC2CC(C)(C)C2)CCC1 ZINC001424171540 1382822594 /nfs/dbraw/zinc/82/25/94/1382822594.db2.gz IDQQSOOWMZGMHI-KRWDZBQOSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2ccc(Cl)s2)CCC1 ZINC001424210073 1382868251 /nfs/dbraw/zinc/86/82/51/1382868251.db2.gz GOSBXWXHXSMWQT-UHFFFAOYSA-N 1 3 343.924 2.870 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+]CC2CCC3(CC3)CC2)CCC1)N(C)C ZINC001424222996 1382881906 /nfs/dbraw/zinc/88/19/06/1382881906.db2.gz LRILYUWSMXYZIN-KRWDZBQOSA-N 1 3 335.536 2.926 10 0 EFAEHO CCCN1Cc2ccccc2C[C@H]1CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001424395257 1382983854 /nfs/dbraw/zinc/98/38/54/1382983854.db2.gz PALOCVFHXQUTKH-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO CCCN1Cc2ccccc2C[C@H]1CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001424395257 1382983857 /nfs/dbraw/zinc/98/38/57/1382983857.db2.gz PALOCVFHXQUTKH-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO CC(C)N1Cc2ccc(CNC(=O)C[N@H+]3[C@H](C)CC[C@@H]3C)cc2C1 ZINC001424440747 1383021141 /nfs/dbraw/zinc/02/11/41/1383021141.db2.gz XUBRRAVFCIZFRG-IYBDPMFKSA-N 1 3 329.488 2.900 10 0 EFAEHO CC(C)N1Cc2ccc(CNC(=O)C[N@@H+]3[C@H](C)CC[C@@H]3C)cc2C1 ZINC001424440747 1383021149 /nfs/dbraw/zinc/02/11/49/1383021149.db2.gz XUBRRAVFCIZFRG-IYBDPMFKSA-N 1 3 329.488 2.900 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N2CCC(C)(NC/C(Cl)=C/Cl)CC2)CC[N@@H+]1C ZINC001424484720 1383044373 /nfs/dbraw/zinc/04/43/73/1383044373.db2.gz BYIYLDDFEMGVLT-NKMUALHBSA-N 1 3 348.318 2.616 10 0 EFAEHO C[C@@H]1[C@H](C(=O)N2CCC(C)(NC/C(Cl)=C/Cl)CC2)CC[N@H+]1C ZINC001424484720 1383044377 /nfs/dbraw/zinc/04/43/77/1383044377.db2.gz BYIYLDDFEMGVLT-NKMUALHBSA-N 1 3 348.318 2.616 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[N@H+](Cc2ccsc2)CC1(C)C)C1CCC1 ZINC001424516873 1383069184 /nfs/dbraw/zinc/06/91/84/1383069184.db2.gz LEFHNEBBMHYPFT-KRWDZBQOSA-N 1 3 349.544 2.949 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[N@@H+](Cc2ccsc2)CC1(C)C)C1CCC1 ZINC001424516873 1383069187 /nfs/dbraw/zinc/06/91/87/1383069187.db2.gz LEFHNEBBMHYPFT-KRWDZBQOSA-N 1 3 349.544 2.949 10 0 EFAEHO Cc1ccc(CC[N@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001424556404 1383103756 /nfs/dbraw/zinc/10/37/56/1383103756.db2.gz DZKOXMQAODYVBA-ICSRJNTNSA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1ccc(CC[N@@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001424556404 1383103759 /nfs/dbraw/zinc/10/37/59/1383103759.db2.gz DZKOXMQAODYVBA-ICSRJNTNSA-N 1 3 345.531 2.847 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)NCc1ccccc1F ZINC001438811403 1388834717 /nfs/dbraw/zinc/83/47/17/1388834717.db2.gz ORLZJMHDSONHFX-TXPKVOOTSA-N 1 3 349.494 2.786 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)NCc1ccccc1F ZINC001438811403 1388834721 /nfs/dbraw/zinc/83/47/21/1388834721.db2.gz ORLZJMHDSONHFX-TXPKVOOTSA-N 1 3 349.494 2.786 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@@H](CNC(=O)C(C)(C)N1CCCCC1)C(C)C ZINC001438812637 1388836395 /nfs/dbraw/zinc/83/63/95/1388836395.db2.gz OCEVIXIRYUOILM-CVEARBPZSA-N 1 3 329.504 2.729 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@H+](C)C/C=C\c1ccccc1 ZINC001424688286 1383259171 /nfs/dbraw/zinc/25/91/71/1383259171.db2.gz RPKOBLAIUUDBER-XZXCKGAHSA-N 1 3 341.499 2.717 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@@H+](C)C/C=C\c1ccccc1 ZINC001424688286 1383259175 /nfs/dbraw/zinc/25/91/75/1383259175.db2.gz RPKOBLAIUUDBER-XZXCKGAHSA-N 1 3 341.499 2.717 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H]2CC[N@H+](C/C=C/Cl)C2)C1 ZINC001424699436 1383271446 /nfs/dbraw/zinc/27/14/46/1383271446.db2.gz MRSCVKPFBZWXSL-QBUOGWAXSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H]2CC[N@@H+](C/C=C/Cl)C2)C1 ZINC001424699436 1383271448 /nfs/dbraw/zinc/27/14/48/1383271448.db2.gz MRSCVKPFBZWXSL-QBUOGWAXSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)[C@H](CNC(=O)CC[NH+](C)C)NCc1ccccc1Cl ZINC001438825601 1388842992 /nfs/dbraw/zinc/84/29/92/1388842992.db2.gz DUMPFNAXPJWYJX-INIZCTEOSA-N 1 3 325.884 2.522 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+][C@H](C)c2ccc(F)cc2)C1 ZINC001424733299 1383305074 /nfs/dbraw/zinc/30/50/74/1383305074.db2.gz HCOBYHHGVNHKRI-KSTDHSDQSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC001424734186 1383305565 /nfs/dbraw/zinc/30/55/65/1383305565.db2.gz KZCNSEUNTSTAAG-JFIBYHEFSA-N 1 3 347.478 2.638 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001424796313 1383353239 /nfs/dbraw/zinc/35/32/39/1383353239.db2.gz LCYKSWDIZRMZDB-IAGOWNOFSA-N 1 3 331.504 2.505 10 0 EFAEHO C[C@@H](NCc1sccc1Cl)[C@@H](C)NC(=O)C1CC[NH+](C)CC1 ZINC001424803316 1383362735 /nfs/dbraw/zinc/36/27/35/1383362735.db2.gz JGGJSHJPCJPPJC-VXGBXAGGSA-N 1 3 343.924 2.726 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)cs1 ZINC001424820226 1383379205 /nfs/dbraw/zinc/37/92/05/1383379205.db2.gz NFMPVRUDPHIZOI-GJZGRUSLSA-N 1 3 337.533 2.914 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)[C@H](C)NC(=O)CCC[NH+]2CCCC2)c1 ZINC001424845057 1383408760 /nfs/dbraw/zinc/40/87/60/1383408760.db2.gz BMQLWMNEDDRSLL-SJORKVTESA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC(C)(C)CN(C)C(=O)[C@H]1CCCN1C(C)C ZINC001424869177 1383443070 /nfs/dbraw/zinc/44/30/70/1383443070.db2.gz KRXNAHHZLCCWRN-HZPDHXFCSA-N 1 3 329.504 2.682 10 0 EFAEHO Cc1cc(CN(C)[C@@H](C)CNC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)c(C)s1 ZINC001424940129 1383493814 /nfs/dbraw/zinc/49/38/14/1383493814.db2.gz PHVDGJSCOWKVJG-DXCKQFNASA-N 1 3 337.533 2.642 10 0 EFAEHO Cc1cc(CN(C)[C@@H](C)CNC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)c(C)s1 ZINC001424940129 1383493818 /nfs/dbraw/zinc/49/38/18/1383493818.db2.gz PHVDGJSCOWKVJG-DXCKQFNASA-N 1 3 337.533 2.642 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@H](C)c3ccccc3C)C[C@H]21 ZINC001425383748 1383643187 /nfs/dbraw/zinc/64/31/87/1383643187.db2.gz SXAJENPISNLNSA-AFYVEPGGSA-N 1 3 343.515 2.692 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@H](C)c3ccccc3C)C[C@H]21 ZINC001425383748 1383643193 /nfs/dbraw/zinc/64/31/93/1383643193.db2.gz SXAJENPISNLNSA-AFYVEPGGSA-N 1 3 343.515 2.692 10 0 EFAEHO C[C@H](CN(C)C(=O)CC[NH+](C)C)N[C@@H](C)c1ccccc1Cl ZINC001425643725 1383732725 /nfs/dbraw/zinc/73/27/25/1383732725.db2.gz VSTXMUWPSVKZJD-KGLIPLIRSA-N 1 3 325.884 2.789 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@@H]1C[C@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001425882589 1383824319 /nfs/dbraw/zinc/82/43/19/1383824319.db2.gz DWDOKEVHACTGFX-FXAWDEMLSA-N 1 3 345.531 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc(Cl)cc2)C[C@@H]1C ZINC001425887482 1383830380 /nfs/dbraw/zinc/83/03/80/1383830380.db2.gz JXTMLRMGZSAPLX-WMLDXEAASA-N 1 3 337.895 2.759 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)C1CC[NH+](CCC2CC2)CC1 ZINC001426193717 1384061375 /nfs/dbraw/zinc/06/13/75/1384061375.db2.gz PMHCECIMWTUKCI-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2ccc3cc[nH]c3c2)C1)N(C)C ZINC001426222586 1384081419 /nfs/dbraw/zinc/08/14/19/1384081419.db2.gz IFYWYYZAJOEPDT-FAFZWHIHSA-N 1 3 342.487 2.587 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccccc1)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001426222736 1384081692 /nfs/dbraw/zinc/08/16/92/1384081692.db2.gz YCWXQHAMGCFWLJ-IBGZPJMESA-N 1 3 331.504 2.697 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccccc1)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001426222736 1384081698 /nfs/dbraw/zinc/08/16/98/1384081698.db2.gz YCWXQHAMGCFWLJ-IBGZPJMESA-N 1 3 331.504 2.697 10 0 EFAEHO CC[C@H](C(=O)NC1(C2CC[NH+](Cc3ccccc3)CC2)CC1)N(C)C ZINC001426261903 1384113494 /nfs/dbraw/zinc/11/34/94/1384113494.db2.gz LYGWYNFWOPURTI-LJQANCHMSA-N 1 3 343.515 2.888 10 0 EFAEHO CN(CCN(C)[C@H]1CCCc2ccc(F)cc21)C(=O)CC[NH+](C)C ZINC001438903170 1388904704 /nfs/dbraw/zinc/90/47/04/1388904704.db2.gz FKOATSWMRPSCDG-SFHVURJKSA-N 1 3 335.467 2.545 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[N@H+](C)CC2CCC3(CC3)CC2)C1 ZINC001438914984 1388913494 /nfs/dbraw/zinc/91/34/94/1388913494.db2.gz DEXLXNPEOSWQTE-KRWDZBQOSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[N@@H+](C)CC2CCC3(CC3)CC2)C1 ZINC001438914984 1388913499 /nfs/dbraw/zinc/91/34/99/1388913499.db2.gz DEXLXNPEOSWQTE-KRWDZBQOSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2CC2CC3(CCC3)C2)C1 ZINC001438951780 1388948575 /nfs/dbraw/zinc/94/85/75/1388948575.db2.gz OQUGJBPLRFHVJQ-RBUKOAKNSA-N 1 3 347.547 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2CC2CC3(CCC3)C2)C1 ZINC001438951780 1388948583 /nfs/dbraw/zinc/94/85/83/1388948583.db2.gz OQUGJBPLRFHVJQ-RBUKOAKNSA-N 1 3 347.547 2.830 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001439121183 1389001012 /nfs/dbraw/zinc/00/10/12/1389001012.db2.gz VPUSJTYBESEOLQ-SJORKVTESA-N 1 3 331.504 2.943 10 0 EFAEHO Cc1cccc(CN2C[C@H](NC(=O)C3(C[NH+](C)C)CC3)C(C)(C)C2)c1 ZINC001506749110 1406249102 /nfs/dbraw/zinc/24/91/02/1406249102.db2.gz NZDSDYJLEWWMLR-SFHVURJKSA-N 1 3 343.515 2.663 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](NC(=O)c2cccc(CN3CCCC3)c2)C1(C)C ZINC001434121574 1387098859 /nfs/dbraw/zinc/09/88/59/1387098859.db2.gz WUGZMSAKWPLGSH-MSOLQXFVSA-N 1 3 329.488 2.741 10 0 EFAEHO CC[N@H+](C)[C@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)C1 ZINC001434425132 1387146086 /nfs/dbraw/zinc/14/60/86/1387146086.db2.gz YUWJZHPKTRJNJC-MJGOQNOKSA-N 1 3 347.478 2.590 10 0 EFAEHO CC[N@@H+](C)[C@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)C1 ZINC001434425132 1387146090 /nfs/dbraw/zinc/14/60/90/1387146090.db2.gz YUWJZHPKTRJNJC-MJGOQNOKSA-N 1 3 347.478 2.590 10 0 EFAEHO C[C@@H](CN1CCOCC1)CN1CC[C@@H](C)[N@H+](Cc2ccccc2)CC1 ZINC001434460032 1387162503 /nfs/dbraw/zinc/16/25/03/1387162503.db2.gz YMGOUSNAFMHFBF-WOJBJXKFSA-N 1 3 345.531 2.551 10 0 EFAEHO C[C@@H](CN1CCOCC1)CN1CC[C@@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC001434460032 1387162505 /nfs/dbraw/zinc/16/25/05/1387162505.db2.gz YMGOUSNAFMHFBF-WOJBJXKFSA-N 1 3 345.531 2.551 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001439151883 1389016900 /nfs/dbraw/zinc/01/69/00/1389016900.db2.gz FPVNQWCFGSYOSN-OXQOHEQNSA-N 1 3 349.494 2.802 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccsc1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001439251894 1389074280 /nfs/dbraw/zinc/07/42/80/1389074280.db2.gz HLHOCRXMPUJWQN-SUMWQHHRSA-N 1 3 341.496 2.555 10 0 EFAEHO Cc1cccc(CN(C)C[C@H](C)NC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001439329529 1389147802 /nfs/dbraw/zinc/14/78/02/1389147802.db2.gz BHQJTMRHVUYOHV-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1cccc(CN(C)C[C@H](C)NC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001439329529 1389147807 /nfs/dbraw/zinc/14/78/07/1389147807.db2.gz BHQJTMRHVUYOHV-PKOBYXMFSA-N 1 3 331.504 2.806 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001440219689 1389449935 /nfs/dbraw/zinc/44/99/35/1389449935.db2.gz LAXTVDBRCDBFLS-ULQDDVLXSA-N 1 3 343.531 2.977 10 0 EFAEHO C[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+]CC2CCCC2)C1)N1CCCCCC1 ZINC001440355509 1389560047 /nfs/dbraw/zinc/56/00/47/1389560047.db2.gz DDZRQIGHDDERHN-WDSOQIARSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@H+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC001440395477 1389590843 /nfs/dbraw/zinc/59/08/43/1389590843.db2.gz IKDDGRVVGGMYBA-HZPDHXFCSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[N@@H+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC001440395477 1389590844 /nfs/dbraw/zinc/59/08/44/1389590844.db2.gz IKDDGRVVGGMYBA-HZPDHXFCSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CC[C@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001440400834 1389598266 /nfs/dbraw/zinc/59/82/66/1389598266.db2.gz JXMFVWOWWSGDBW-DLBZAZTESA-N 1 3 325.541 2.885 10 0 EFAEHO CN(CC(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2cccc(F)c2)C1)C1CCC1 ZINC001440405450 1389604220 /nfs/dbraw/zinc/60/42/20/1389604220.db2.gz QAHJZDBUANOZIQ-FUHWJXTLSA-N 1 3 347.478 2.685 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C\Cl)C1)N1CCCCCC1 ZINC001440406454 1389606452 /nfs/dbraw/zinc/60/64/52/1389606452.db2.gz ONPTWTIRELWTED-LDNOHTSOSA-N 1 3 341.927 2.878 10 0 EFAEHO CCCN(C)CC(=O)N1CCCCC[C@H]([NH2+]Cc2ccsc2)C1 ZINC001440462378 1389662641 /nfs/dbraw/zinc/66/26/41/1389662641.db2.gz FCUYTOFVVJGBLY-KRWDZBQOSA-N 1 3 337.533 2.951 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[N@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001440463458 1389664406 /nfs/dbraw/zinc/66/44/06/1389664406.db2.gz HEQKCMLBNVVCHV-HOTGVXAUSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CCC[N@@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001440463458 1389664408 /nfs/dbraw/zinc/66/44/08/1389664408.db2.gz HEQKCMLBNVVCHV-HOTGVXAUSA-N 1 3 345.478 2.544 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CCCC3CCC3)CC[C@@H]2C1 ZINC001440467407 1389669806 /nfs/dbraw/zinc/66/98/06/1389669806.db2.gz GLEZXXCQONVVCI-MOPGFXCFSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CCCC3CCC3)CC[C@@H]2C1 ZINC001440467407 1389669809 /nfs/dbraw/zinc/66/98/09/1389669809.db2.gz GLEZXXCQONVVCI-MOPGFXCFSA-N 1 3 335.536 2.687 10 0 EFAEHO CCC1([NH2+]CC2CC(C)(C)C2)CCN(C(=O)CN2CCCC2)CC1 ZINC001440541585 1389744108 /nfs/dbraw/zinc/74/41/08/1389744108.db2.gz ZFUFCPWIACZNFQ-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@]2(CC[N@H+](Cc3ccsc3)C2)C1 ZINC001440541380 1389744460 /nfs/dbraw/zinc/74/44/60/1389744460.db2.gz YWUKUKCFAZVOQD-LJQANCHMSA-N 1 3 349.544 2.904 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@]2(CC[N@@H+](Cc3ccsc3)C2)C1 ZINC001440541380 1389744464 /nfs/dbraw/zinc/74/44/64/1389744464.db2.gz YWUKUKCFAZVOQD-LJQANCHMSA-N 1 3 349.544 2.904 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C\Cl ZINC001440657371 1389805157 /nfs/dbraw/zinc/80/51/57/1389805157.db2.gz OSRUXMPAURZZIW-UJWMVZFISA-N 1 3 336.307 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C\Cl ZINC001440657371 1389805161 /nfs/dbraw/zinc/80/51/61/1389805161.db2.gz OSRUXMPAURZZIW-UJWMVZFISA-N 1 3 336.307 2.664 10 0 EFAEHO C[C@@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001440665048 1389807101 /nfs/dbraw/zinc/80/71/01/1389807101.db2.gz MUBJFBCNODDPTC-YJBOKZPZSA-N 1 3 329.488 2.643 10 0 EFAEHO CC(C)N1CCc2ccccc2[C@@H]1CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001440688924 1389818534 /nfs/dbraw/zinc/81/85/34/1389818534.db2.gz LBUYRWWGOWPGHL-QUCCMNQESA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N1CCc2ccccc2[C@@H]1CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001440688924 1389818542 /nfs/dbraw/zinc/81/85/42/1389818542.db2.gz LBUYRWWGOWPGHL-QUCCMNQESA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@@H](F)C[N@H+](CC)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001440706784 1389829707 /nfs/dbraw/zinc/82/97/07/1389829707.db2.gz NOILPBDBXJKDAR-SJLPKXTDSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](F)C[N@@H+](CC)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001440706784 1389829710 /nfs/dbraw/zinc/82/97/10/1389829710.db2.gz NOILPBDBXJKDAR-SJLPKXTDSA-N 1 3 341.515 2.637 10 0 EFAEHO CN(Cc1cc2ccccc2o1)C[C@@H]1CCCN1C(=O)CC[NH+](C)C ZINC001440739030 1389860089 /nfs/dbraw/zinc/86/00/89/1389860089.db2.gz QKLSSIBDHPECOM-KRWDZBQOSA-N 1 3 343.471 2.807 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001440739231 1389860144 /nfs/dbraw/zinc/86/01/44/1389860144.db2.gz JLSGGKWSBWELLA-LJQANCHMSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001440739231 1389860148 /nfs/dbraw/zinc/86/01/48/1389860148.db2.gz JLSGGKWSBWELLA-LJQANCHMSA-N 1 3 337.552 2.933 10 0 EFAEHO C[C@@H]([NH2+]CC1CC(NC(=O)C2(N(C)C)CCC2)C1)c1cccc(F)c1 ZINC001440759707 1389874822 /nfs/dbraw/zinc/87/48/22/1389874822.db2.gz SQTUMWXYMURCDA-KSTDHSDQSA-N 1 3 347.478 2.855 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(CF)cc2)C1)N(C)C ZINC001506888476 1406406114 /nfs/dbraw/zinc/40/61/14/1406406114.db2.gz LNHBFOVZKDBJIN-FHWLQOOXSA-N 1 3 349.494 2.727 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCCC1)[C@H](C)[NH2+]CCC(F)(F)F ZINC001440794649 1389902911 /nfs/dbraw/zinc/90/29/11/1389902911.db2.gz UHZGGFNPEWVBRS-QWHCGFSZSA-N 1 3 337.430 2.686 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)c(C)s1 ZINC001440795950 1389903809 /nfs/dbraw/zinc/90/38/09/1389903809.db2.gz JRSMVOSUVDWKBM-UONOGXRCSA-N 1 3 337.533 2.832 10 0 EFAEHO C[C@@H](NC(=O)C1CC[NH+](C)CC1)[C@H](C)NCc1ccccc1Cl ZINC001440834558 1389934998 /nfs/dbraw/zinc/93/49/98/1389934998.db2.gz LMOPLBKNSMMTRD-UONOGXRCSA-N 1 3 337.895 2.665 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H](C)[NH2+]CC1CCC(F)(F)CC1 ZINC001440853633 1389954813 /nfs/dbraw/zinc/95/48/13/1389954813.db2.gz XIBCKPIJGOQELL-VXGBXAGGSA-N 1 3 342.434 2.569 10 0 EFAEHO CC[C@H]([NH2+]C[C@H]1C[C@H](NC(=O)CN2CC[C@H](C)C2)C1)c1ccccc1 ZINC001506897065 1406414787 /nfs/dbraw/zinc/41/47/87/1406414787.db2.gz IMTYIMSZJAIXHK-ZULIPRJHSA-N 1 3 343.515 2.964 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001506896663 1406414420 /nfs/dbraw/zinc/41/44/20/1406414420.db2.gz SGQCLNFCPUONDS-BRWVUGGUSA-N 1 3 325.541 2.883 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccsc2)C1)CC(C)(C)C ZINC001506896847 1406414687 /nfs/dbraw/zinc/41/46/87/1406414687.db2.gz AEMFHMJNSJTSGS-WKILWMFISA-N 1 3 337.533 2.710 10 0 EFAEHO C[C@@H](CNC(=O)CC[NH+](C)C)N(C)Cc1cccc(C(F)F)c1 ZINC001440962219 1390052507 /nfs/dbraw/zinc/05/25/07/1390052507.db2.gz IUZDQSZXDVRMCY-ZDUSSCGKSA-N 1 3 327.419 2.512 10 0 EFAEHO C[C@@H](CNC(=O)CC[NH+](C)C)N(C)Cc1ccc(C(F)(F)F)cc1 ZINC001440964925 1390055789 /nfs/dbraw/zinc/05/57/89/1390055789.db2.gz VQJOPSXRJHNMDY-ZDUSSCGKSA-N 1 3 345.409 2.594 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(Cl)s2)C1 ZINC001506907786 1406425725 /nfs/dbraw/zinc/42/57/25/1406425725.db2.gz XQBJVOQEHQCTCQ-JOCQHMNTSA-N 1 3 343.924 2.726 10 0 EFAEHO CN(C)C1(C(=O)N(C)C2CC[NH+](CC3CC4(CCC4)C3)CC2)CCC1 ZINC001440985818 1391005059 /nfs/dbraw/zinc/00/50/59/1391005059.db2.gz PDKCEHRFCIQVOM-UHFFFAOYSA-N 1 3 347.547 2.974 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)N(C)Cc1cccc(C(F)F)c1 ZINC001441009179 1391029681 /nfs/dbraw/zinc/02/96/81/1391029681.db2.gz IKFGVNSSUKDPSH-XJKSGUPXSA-N 1 3 339.430 2.512 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)N(C)Cc1cccc(C(F)F)c1 ZINC001441009179 1391029688 /nfs/dbraw/zinc/02/96/88/1391029688.db2.gz IKFGVNSSUKDPSH-XJKSGUPXSA-N 1 3 339.430 2.512 10 0 EFAEHO C[C@H](c1cccc(F)c1)N1CCC(N(C)C(=O)CC[NH+](C)C)CC1 ZINC001441011945 1391032020 /nfs/dbraw/zinc/03/20/20/1391032020.db2.gz DRZPNBKVFMUIAN-OAHLLOKOSA-N 1 3 335.467 2.761 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)Cc1cccc2cccnc21 ZINC001441038868 1391053932 /nfs/dbraw/zinc/05/39/32/1391053932.db2.gz ROCFGVXDAZHXCK-MRXNPFEDSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)Cc1cccc2cccnc21 ZINC001441038868 1391053941 /nfs/dbraw/zinc/05/39/41/1391053941.db2.gz ROCFGVXDAZHXCK-MRXNPFEDSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)CN1CCCC1)[NH2+]CC1CC(C)(C)C1 ZINC001441090960 1391083597 /nfs/dbraw/zinc/08/35/97/1391083597.db2.gz KXJZTKAFCAVAQS-GOSISDBHSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)CN1CCCC1)[NH2+]Cc1ccc(F)cc1 ZINC001441094303 1391086658 /nfs/dbraw/zinc/08/66/58/1391086658.db2.gz WKYZGQVZGXNKLJ-LJQANCHMSA-N 1 3 349.494 2.884 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]CC1CC(C)(C)C1)C1CC1 ZINC001441201215 1391177705 /nfs/dbraw/zinc/17/77/05/1391177705.db2.gz LTBQJOBRJFIEQN-ROUUACIJSA-N 1 3 335.536 2.781 10 0 EFAEHO CCc1cccc(CN2C[C@H](NC(=O)CC[NH+](C)C)C(C)(C)C2)c1 ZINC001441249376 1391209261 /nfs/dbraw/zinc/20/92/61/1391209261.db2.gz GQTRNDJVKZWZKV-SFHVURJKSA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]([NH2+][C@@H]1CCCc2ccccc21)C1CC1 ZINC001441291888 1391236526 /nfs/dbraw/zinc/23/65/26/1391236526.db2.gz FLTOICINNIFYPS-UXHICEINSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+][C@H]1CCCc2ccccc21)C1CC1 ZINC001441291902 1391237003 /nfs/dbraw/zinc/23/70/03/1391237003.db2.gz FLTOICINNIFYPS-VQTJNVASSA-N 1 3 343.515 2.889 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@H](CC)N(C)C)C2)cc1 ZINC001441375998 1391271496 /nfs/dbraw/zinc/27/14/96/1391271496.db2.gz BWNYJFHTPKVUAT-FHWLQOOXSA-N 1 3 331.504 2.574 10 0 EFAEHO CN(C)C1(C(=O)N(C)[C@@H](C[NH2+]CC2CC(C)(C)C2)C2CC2)CCC1 ZINC001441433083 1391300823 /nfs/dbraw/zinc/30/08/23/1391300823.db2.gz NHZQLPPLRYLUQT-KRWDZBQOSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc(Cl)c2F)C1 ZINC001441523651 1391350667 /nfs/dbraw/zinc/35/06/67/1391350667.db2.gz KMWHLIRBMVNKOS-OKILXGFUSA-N 1 3 341.858 2.558 10 0 EFAEHO CC[C@H](F)CN1CCC[C@@H](CNC(=O)CCC[NH+]2CCCCC2)C1 ZINC001441577245 1391370533 /nfs/dbraw/zinc/37/05/33/1391370533.db2.gz VRBRDNOZCCQDJB-ROUUACIJSA-N 1 3 341.515 2.829 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@@H](CNC(=O)CCC[NH+]2CCCCC2)C1 ZINC001441577249 1391371661 /nfs/dbraw/zinc/37/16/61/1391371661.db2.gz VRBRDNOZCCQDJB-ZWKOTPCHSA-N 1 3 341.515 2.829 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCCN1CCCF)[NH+]1CCCCC1 ZINC001441633110 1391398903 /nfs/dbraw/zinc/39/89/03/1391398903.db2.gz CAGGVPITBHQJMM-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCC[N@@H+]1CCCF)N1CCCCC1 ZINC001441633110 1391398909 /nfs/dbraw/zinc/39/89/09/1391398909.db2.gz CAGGVPITBHQJMM-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCCC[N@H+]1CCCF)N1CCCCC1 ZINC001441633110 1391398916 /nfs/dbraw/zinc/39/89/16/1391398916.db2.gz CAGGVPITBHQJMM-ROUUACIJSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](F)CNCc1ccc(CNC(=O)CC2CC[NH+](C)CC2)cc1 ZINC001444197550 1391461423 /nfs/dbraw/zinc/46/14/23/1391461423.db2.gz ILSFBTHHSAVNFG-IBGZPJMESA-N 1 3 349.494 2.872 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(C1)CCC[N@H+](Cc1ccsc1)C2 ZINC001446324039 1391552797 /nfs/dbraw/zinc/55/27/97/1391552797.db2.gz BCLQAMLUKSRFAT-LJQANCHMSA-N 1 3 349.544 2.903 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(C1)CCC[N@@H+](Cc1ccsc1)C2 ZINC001446324039 1391552801 /nfs/dbraw/zinc/55/28/01/1391552801.db2.gz BCLQAMLUKSRFAT-LJQANCHMSA-N 1 3 349.544 2.903 10 0 EFAEHO CC[C@H](C)C[N@H+](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001506962843 1406511075 /nfs/dbraw/zinc/51/10/75/1406511075.db2.gz GFJBSOGGEYMBRA-INIZCTEOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001506962843 1406511078 /nfs/dbraw/zinc/51/10/78/1406511078.db2.gz GFJBSOGGEYMBRA-INIZCTEOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)C[N@@H+]1CCC(F)(F)[C@H](CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001446730265 1391593289 /nfs/dbraw/zinc/59/32/89/1391593289.db2.gz WLDHLWLHUOTGTE-OAHLLOKOSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)C[N@H+]1CCC(F)(F)[C@H](CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001446730265 1391593292 /nfs/dbraw/zinc/59/32/92/1391593292.db2.gz WLDHLWLHUOTGTE-OAHLLOKOSA-N 1 3 345.478 2.590 10 0 EFAEHO CCC(CC)C[NH2+]C[C@H]1CN(C(=O)CN2CCC(C)CC2)C[C@@H]1C ZINC001446973135 1391649475 /nfs/dbraw/zinc/64/94/75/1391649475.db2.gz NQTCLABRWIHQPP-HKUYNNGSSA-N 1 3 337.552 2.839 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[N@H+](C)[C@@H]2CCc3ccccc32)C1 ZINC001447358278 1391709759 /nfs/dbraw/zinc/70/97/59/1391709759.db2.gz ZROFUJNYBDJKMY-YLJYHZDGSA-N 1 3 343.515 2.796 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[N@@H+](C)[C@@H]2CCc3ccccc32)C1 ZINC001447358278 1391709767 /nfs/dbraw/zinc/70/97/67/1391709767.db2.gz ZROFUJNYBDJKMY-YLJYHZDGSA-N 1 3 343.515 2.796 10 0 EFAEHO CCC1([NH2+]Cc2cccnc2)CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001447422386 1391713671 /nfs/dbraw/zinc/71/36/71/1391713671.db2.gz ABGXRXDOWKPSKD-GOSISDBHSA-N 1 3 346.519 2.529 10 0 EFAEHO CN(C/C=C/c1ccccc1)C[C@H]1CCCN1C(=O)[C@H]1CC[N@H+](C)C1 ZINC001447771876 1391758161 /nfs/dbraw/zinc/75/81/61/1391758161.db2.gz RKFUEYGRBNLDLE-HZQWVYJSSA-N 1 3 341.499 2.574 10 0 EFAEHO CN(C/C=C/c1ccccc1)C[C@H]1CCCN1C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001447771876 1391758168 /nfs/dbraw/zinc/75/81/68/1391758168.db2.gz RKFUEYGRBNLDLE-HZQWVYJSSA-N 1 3 341.499 2.574 10 0 EFAEHO C[C@@H]([NH2+]CC1CC(NC(=O)CN(C)C2CCC2)C1)c1ccc(F)cc1 ZINC001447798671 1391770723 /nfs/dbraw/zinc/77/07/23/1391770723.db2.gz RGPRXFKSCRKFFJ-KSTDHSDQSA-N 1 3 347.478 2.855 10 0 EFAEHO COc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)cc1 ZINC001447894275 1391793933 /nfs/dbraw/zinc/79/39/33/1391793933.db2.gz XLQRXEWXJMSYDX-HOTGVXAUSA-N 1 3 347.503 2.552 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@H+](C)Cc1ccc(C(F)F)cc1)N(C)C ZINC001448056631 1391922882 /nfs/dbraw/zinc/92/28/82/1391922882.db2.gz CTWFWRZEMLICQO-XJKSGUPXSA-N 1 3 341.446 2.901 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[N@@H+](C)Cc1ccc(C(F)F)cc1)N(C)C ZINC001448056631 1391922892 /nfs/dbraw/zinc/92/28/92/1391922892.db2.gz CTWFWRZEMLICQO-XJKSGUPXSA-N 1 3 341.446 2.901 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@H+](C)Cc1ccc(C(F)F)cc1)N(C)C ZINC001448056625 1391923226 /nfs/dbraw/zinc/92/32/26/1391923226.db2.gz CTWFWRZEMLICQO-CZUORRHYSA-N 1 3 341.446 2.901 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc(C(F)F)cc1)N(C)C ZINC001448056625 1391923230 /nfs/dbraw/zinc/92/32/30/1391923230.db2.gz CTWFWRZEMLICQO-CZUORRHYSA-N 1 3 341.446 2.901 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[N@H+](C)CCc1cccs1 ZINC001448067630 1391929179 /nfs/dbraw/zinc/92/91/79/1391929179.db2.gz PEKJYLCJDALORT-HNNXBMFYSA-N 1 3 337.533 2.602 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[N@@H+](C)CCc1cccs1 ZINC001448067630 1391929184 /nfs/dbraw/zinc/92/91/84/1391929184.db2.gz PEKJYLCJDALORT-HNNXBMFYSA-N 1 3 337.533 2.602 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@H+](C)CC1CCC(F)(F)CC1)N(C)C ZINC001448069615 1391930817 /nfs/dbraw/zinc/93/08/17/1391930817.db2.gz SIGSKTCTSOFEKW-UKRRQHHQSA-N 1 3 333.467 2.589 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@@H+](C)CC1CCC(F)(F)CC1)N(C)C ZINC001448069615 1391930820 /nfs/dbraw/zinc/93/08/20/1391930820.db2.gz SIGSKTCTSOFEKW-UKRRQHHQSA-N 1 3 333.467 2.589 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[N@H+](C)CC/C=C\c1ccccc1 ZINC001448103995 1391964569 /nfs/dbraw/zinc/96/45/69/1391964569.db2.gz ZEMCHQOTBOVVJE-FEEJDJEGSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[N@@H+](C)CC/C=C\c1ccccc1 ZINC001448103995 1391964574 /nfs/dbraw/zinc/96/45/74/1391964574.db2.gz ZEMCHQOTBOVVJE-FEEJDJEGSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]CCc1ccccc1 ZINC001448210584 1392016393 /nfs/dbraw/zinc/01/63/93/1392016393.db2.gz JOXNLDGLHGSYRU-UXHICEINSA-N 1 3 345.531 2.786 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@H]1CCCCCN1Cc1ccc(F)cc1 ZINC001448267245 1392067424 /nfs/dbraw/zinc/06/74/24/1392067424.db2.gz PBRJSRUOCMJEFS-GOSISDBHSA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001448551505 1392087006 /nfs/dbraw/zinc/08/70/06/1392087006.db2.gz KQIOYJSNACLVAQ-FGTMMUONSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001448551505 1392087012 /nfs/dbraw/zinc/08/70/12/1392087012.db2.gz KQIOYJSNACLVAQ-FGTMMUONSA-N 1 3 335.536 2.686 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H]1C[C@@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001449019286 1392211019 /nfs/dbraw/zinc/21/10/19/1392211019.db2.gz PURBBXZWRGSMFE-VQIMIIECSA-N 1 3 331.504 2.668 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H]1C[C@@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001449019269 1392211122 /nfs/dbraw/zinc/21/11/22/1392211122.db2.gz PURBBXZWRGSMFE-APWZRJJASA-N 1 3 331.504 2.668 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]Cc3ccsc3)[C@@H]2C1 ZINC001449029125 1392218845 /nfs/dbraw/zinc/21/88/45/1392218845.db2.gz DCLTZILZVUXEOB-RCCFBDPRSA-N 1 3 349.544 2.807 10 0 EFAEHO CN(C(=O)C(C)(C)N1CCCCC1)[C@H](C[NH2+]C/C=C\Cl)C1CC1 ZINC001507014183 1406590133 /nfs/dbraw/zinc/59/01/33/1406590133.db2.gz WRACJVVQLMQJNX-BSDKJSHOSA-N 1 3 341.927 2.830 10 0 EFAEHO CC(C)CCC[NH2+][C@H](C)[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001568417264 1416524096 /nfs/dbraw/zinc/52/40/96/1416524096.db2.gz UUNVLYDXNVTROC-QZTJIDSGSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@H]1C[NH+]2CCC1CC2)NCc1ccccc1Cl ZINC001507072451 1406665088 /nfs/dbraw/zinc/66/50/88/1406665088.db2.gz HBJUSHFRMCDCGN-PBHICJAKSA-N 1 3 349.906 2.618 10 0 EFAEHO C[C@H](CN(C)C(=O)CC[C@@H]1CCC[N@@H+]1C)NCc1ccccc1F ZINC001507085845 1406683283 /nfs/dbraw/zinc/68/32/83/1406683283.db2.gz PJNNVDKMMYVEII-WBVHZDCISA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CN(C)C(=O)CC[C@@H]1CCC[N@H+]1C)NCc1ccccc1F ZINC001507085845 1406683288 /nfs/dbraw/zinc/68/32/88/1406683288.db2.gz PJNNVDKMMYVEII-WBVHZDCISA-N 1 3 335.467 2.637 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@H](C)CN(C)C(=O)CN(C)C2CCC2)c1 ZINC001507092526 1406691290 /nfs/dbraw/zinc/69/12/90/1406691290.db2.gz YUQBGDLGMRWGRS-CVEARBPZSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@@H](C)CN(C)C(=O)CN(C)C2CCC2)c1 ZINC001507092528 1406691581 /nfs/dbraw/zinc/69/15/81/1406691581.db2.gz YUQBGDLGMRWGRS-HOTGVXAUSA-N 1 3 347.503 2.677 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001507119543 1406728173 /nfs/dbraw/zinc/72/81/73/1406728173.db2.gz VKURDTNXFCDEFO-IKGGRYGDSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001507119543 1406728177 /nfs/dbraw/zinc/72/81/77/1406728177.db2.gz VKURDTNXFCDEFO-IKGGRYGDSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001507127537 1406740576 /nfs/dbraw/zinc/74/05/76/1406740576.db2.gz QWWCUKPATQQHTQ-RBUKOAKNSA-N 1 3 345.531 2.706 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]CCCc1ccccc1 ZINC001507161013 1406789897 /nfs/dbraw/zinc/78/98/97/1406789897.db2.gz HOWXXGAYJWZSGI-AZUAARDMSA-N 1 3 345.531 2.930 10 0 EFAEHO CN(Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1CCC[C@@]2(CCOC2)O1 ZINC001459880611 1395988596 /nfs/dbraw/zinc/98/85/96/1395988596.db2.gz XQYIJDZAHRUDCC-PMACEKPBSA-N 1 3 332.488 2.908 10 0 EFAEHO CCCCN(CCOCC(=O)OCC)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001460539485 1396199218 /nfs/dbraw/zinc/19/92/18/1396199218.db2.gz DFLPNIZUMFUXRZ-UHFFFAOYSA-N 1 3 342.524 2.977 10 0 EFAEHO Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)[C@@H](C)CC[NH+](C)C ZINC001468657121 1396976868 /nfs/dbraw/zinc/97/68/68/1396976868.db2.gz NOEDPOSBEFDPPA-KVSKMBFKSA-N 1 3 329.488 2.717 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)[C@@H]1C ZINC001507296234 1406861203 /nfs/dbraw/zinc/86/12/03/1406861203.db2.gz HLZGKHNQFKLOJJ-OXJNMPFZSA-N 1 3 343.515 2.983 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2ccc(C3CC3)cc2)[C@H]1C ZINC001507296236 1406861255 /nfs/dbraw/zinc/86/12/55/1406861255.db2.gz HLZGKHNQFKLOJJ-UZLBHIALSA-N 1 3 343.515 2.983 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@]1(c2ccccc2)CC1(C)C ZINC001470025103 1397067323 /nfs/dbraw/zinc/06/73/23/1397067323.db2.gz BSQLKOHNVMAQSB-LAUBAEHRSA-N 1 3 345.531 2.743 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@]1(c2ccccc2)CC1(C)C ZINC001470025103 1397067327 /nfs/dbraw/zinc/06/73/27/1397067327.db2.gz BSQLKOHNVMAQSB-LAUBAEHRSA-N 1 3 345.531 2.743 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)N[C@H]1CN(Cc2ccccc2)CC[C@@H]1C ZINC001470775483 1397120318 /nfs/dbraw/zinc/12/03/18/1397120318.db2.gz DFXVNAJSEFIDEN-SCTDSRPQSA-N 1 3 331.504 2.601 10 0 EFAEHO O=C(NC[C@@H]1CC[N@@H+]1C1CCCCC1)N1CCN(C2CCCC2)CC1 ZINC001470824131 1397125289 /nfs/dbraw/zinc/12/52/89/1397125289.db2.gz PSXVYUBPQJZPAA-IBGZPJMESA-N 1 3 348.535 2.663 10 0 EFAEHO O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)N1CCN(C2CCCC2)CC1 ZINC001470824131 1397125298 /nfs/dbraw/zinc/12/52/98/1397125298.db2.gz PSXVYUBPQJZPAA-IBGZPJMESA-N 1 3 348.535 2.663 10 0 EFAEHO CN(C)[C@@H](CNC(=O)C[N@@H+]1CCC[C@H](C2CCC2)C1)c1ccccc1 ZINC001473656888 1397318875 /nfs/dbraw/zinc/31/88/75/1397318875.db2.gz ALQHTERCFGSDNB-PMACEKPBSA-N 1 3 343.515 2.918 10 0 EFAEHO CN(C)[C@@H](CNC(=O)C[N@H+]1CCC[C@H](C2CCC2)C1)c1ccccc1 ZINC001473656888 1397318879 /nfs/dbraw/zinc/31/88/79/1397318879.db2.gz ALQHTERCFGSDNB-PMACEKPBSA-N 1 3 343.515 2.918 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CC/C=C/c2ccccc2)CN1C(=O)Cc1c[nH]cn1 ZINC001507329261 1406893624 /nfs/dbraw/zinc/89/36/24/1406893624.db2.gz ZUWUWVNJFXILMV-DTDSVVEQSA-N 1 3 338.455 2.635 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CC/C=C/c2ccccc2)CN1C(=O)CN1CCCC1 ZINC001507331120 1406896076 /nfs/dbraw/zinc/89/60/76/1406896076.db2.gz MOFBKMDGRIGGSI-MFVQGQBESA-N 1 3 341.499 2.765 10 0 EFAEHO CC(C)[C@@H]1CCCCCN1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001478958109 1397597020 /nfs/dbraw/zinc/59/70/20/1397597020.db2.gz ZPTYPTUKMLLSGR-ROUUACIJSA-N 1 3 340.556 2.869 10 0 EFAEHO CC(C)[C@@H]1CCCCCN1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001478958109 1397597024 /nfs/dbraw/zinc/59/70/24/1397597024.db2.gz ZPTYPTUKMLLSGR-ROUUACIJSA-N 1 3 340.556 2.869 10 0 EFAEHO CN(C(=O)NC[C@H]1CC[N@@H+]1C1CCCCCC1)[C@H]1CCCN(C)C1 ZINC001479142363 1397613163 /nfs/dbraw/zinc/61/31/63/1397613163.db2.gz JDUVFAFMSKZETM-MSOLQXFVSA-N 1 3 336.524 2.519 10 0 EFAEHO CN(C(=O)NC[C@H]1CC[N@H+]1C1CCCCCC1)[C@H]1CCCN(C)C1 ZINC001479142363 1397613165 /nfs/dbraw/zinc/61/31/65/1397613165.db2.gz JDUVFAFMSKZETM-MSOLQXFVSA-N 1 3 336.524 2.519 10 0 EFAEHO CN(C(=O)NC[C@@H]1CC[N@@H+]1C1CCCCCC1)[C@H]1CCCN(C)C1 ZINC001479142365 1397613377 /nfs/dbraw/zinc/61/33/77/1397613377.db2.gz JDUVFAFMSKZETM-ROUUACIJSA-N 1 3 336.524 2.519 10 0 EFAEHO CN(C(=O)NC[C@@H]1CC[N@H+]1C1CCCCCC1)[C@H]1CCCN(C)C1 ZINC001479142365 1397613381 /nfs/dbraw/zinc/61/33/81/1397613381.db2.gz JDUVFAFMSKZETM-ROUUACIJSA-N 1 3 336.524 2.519 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@@H]([NH2+]CCc2ccccc2)C1)N1CCCC1 ZINC001479313935 1397680069 /nfs/dbraw/zinc/68/00/69/1397680069.db2.gz FGXHLIDQZUIYII-KDURUIRLSA-N 1 3 343.515 2.588 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@H]([NH2+]CC2CC(C)(C)C2)C1 ZINC001479416765 1397720486 /nfs/dbraw/zinc/72/04/86/1397720486.db2.gz MPELTXOXXJICMX-YFHUEUNASA-N 1 3 335.536 2.780 10 0 EFAEHO C[C@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@H]1CC[NH2+]Cc1ccsc1 ZINC001479522646 1397749508 /nfs/dbraw/zinc/74/95/08/1397749508.db2.gz LPKQHOJTGSFCHS-YOEHRIQHSA-N 1 3 346.500 2.821 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2ncccc2C)[C@@H]1CC ZINC001479645636 1397759051 /nfs/dbraw/zinc/75/90/51/1397759051.db2.gz SOWVRWSMSBRJQV-PKOBYXMFSA-N 1 3 346.519 2.591 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2ncccc2C)[C@@H]1CC ZINC001479645636 1397759052 /nfs/dbraw/zinc/75/90/52/1397759052.db2.gz SOWVRWSMSBRJQV-PKOBYXMFSA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)C[C@@H]1CCCCN1C(=O)CN(C)C1CCC1 ZINC001479735584 1397789158 /nfs/dbraw/zinc/78/91/58/1397789158.db2.gz VEIAHRWKWYKRHR-WBVHZDCISA-N 1 3 327.488 2.532 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)C[C@@H]1CCCCN1C(=O)CN(C)C1CCC1 ZINC001479735584 1397789160 /nfs/dbraw/zinc/78/91/60/1397789160.db2.gz VEIAHRWKWYKRHR-WBVHZDCISA-N 1 3 327.488 2.532 10 0 EFAEHO C[C@H](F)CC[N@H+](C)C[C@@H]1CCCCN1C(=O)CN(C)C1CCC1 ZINC001479735583 1397790029 /nfs/dbraw/zinc/79/00/29/1397790029.db2.gz VEIAHRWKWYKRHR-RDJZCZTQSA-N 1 3 327.488 2.532 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)C[C@@H]1CCCCN1C(=O)CN(C)C1CCC1 ZINC001479735583 1397790031 /nfs/dbraw/zinc/79/00/31/1397790031.db2.gz VEIAHRWKWYKRHR-RDJZCZTQSA-N 1 3 327.488 2.532 10 0 EFAEHO CN(Cc1ccc(F)cc1)C[C@@H]1CCCCN1C(=O)CCC[NH+](C)C ZINC001479739235 1397793035 /nfs/dbraw/zinc/79/30/35/1397793035.db2.gz VLRZCNKPYHYXSC-IBGZPJMESA-N 1 3 349.494 2.980 10 0 EFAEHO Cc1cccc([C@@H](C)[N@H+](C)CCCNC(=O)C2(N(C)C)CCC2)c1 ZINC001479774777 1397839707 /nfs/dbraw/zinc/83/97/07/1397839707.db2.gz KXOMWTJPPONNMZ-QGZVFWFLSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1cccc([C@@H](C)[N@@H+](C)CCCNC(=O)C2(N(C)C)CCC2)c1 ZINC001479774777 1397839712 /nfs/dbraw/zinc/83/97/12/1397839712.db2.gz KXOMWTJPPONNMZ-QGZVFWFLSA-N 1 3 331.504 2.978 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)[N@H+](C)CCCNC(=O)CN(C)C1CCC1 ZINC001479775586 1397842309 /nfs/dbraw/zinc/84/23/09/1397842309.db2.gz BLOWCTILPULNIW-HNNXBMFYSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CCCNC(=O)CN(C)C1CCC1 ZINC001479775586 1397842316 /nfs/dbraw/zinc/84/23/16/1397842316.db2.gz BLOWCTILPULNIW-HNNXBMFYSA-N 1 3 335.467 2.809 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@H+](C)Cc1cc2ccccc2o1)N(C)C ZINC001479777607 1397846012 /nfs/dbraw/zinc/84/60/12/1397846012.db2.gz WHCYXTCUPISJHX-IBGZPJMESA-N 1 3 345.487 2.957 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@@H+](C)Cc1cc2ccccc2o1)N(C)C ZINC001479777607 1397846018 /nfs/dbraw/zinc/84/60/18/1397846018.db2.gz WHCYXTCUPISJHX-IBGZPJMESA-N 1 3 345.487 2.957 10 0 EFAEHO Cc1cccnc1CN(C)CCCNC(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC001479800738 1397886418 /nfs/dbraw/zinc/88/64/18/1397886418.db2.gz UCHCLTBNXOFFJS-GOSISDBHSA-N 1 3 346.519 2.593 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](C)CC1CC2(CCC2)C1 ZINC001479815219 1397911017 /nfs/dbraw/zinc/91/10/17/1397911017.db2.gz BTGNZCLKJQQVNY-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](C)CC1CC2(CCC2)C1 ZINC001479815219 1397911019 /nfs/dbraw/zinc/91/10/19/1397911019.db2.gz BTGNZCLKJQQVNY-GOSISDBHSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1cccnc1C[NH2+][C@H](C)[C@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001479835860 1397931097 /nfs/dbraw/zinc/93/10/97/1397931097.db2.gz YFQNQRZHDHKWAZ-IEBWSBKVSA-N 1 3 346.519 2.589 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1ccc(F)cc1C ZINC001479854841 1397956000 /nfs/dbraw/zinc/95/60/00/1397956000.db2.gz OPRLNBQPKJLZLP-INIZCTEOSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1ccc(F)cc1C ZINC001479854841 1397956006 /nfs/dbraw/zinc/95/60/06/1397956006.db2.gz OPRLNBQPKJLZLP-INIZCTEOSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[N@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC1CCC1 ZINC001479854654 1397956753 /nfs/dbraw/zinc/95/67/53/1397956753.db2.gz LKMZHJKIUXZING-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[N@@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC1CCC1 ZINC001479854654 1397956756 /nfs/dbraw/zinc/95/67/56/1397956756.db2.gz LKMZHJKIUXZING-LJQANCHMSA-N 1 3 341.515 2.827 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](CC)CCC(F)(F)F ZINC001479861081 1397965019 /nfs/dbraw/zinc/96/50/19/1397965019.db2.gz FSJYMVZMFQRMKM-CQSZACIVSA-N 1 3 337.430 2.641 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](CC)CCC(F)(F)F ZINC001479861081 1397965022 /nfs/dbraw/zinc/96/50/22/1397965022.db2.gz FSJYMVZMFQRMKM-CQSZACIVSA-N 1 3 337.430 2.641 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[N@H+](C/C=C\c1ccccc1)C1CC1 ZINC001479873805 1397984682 /nfs/dbraw/zinc/98/46/82/1397984682.db2.gz GPSUSIYLYUMMST-CSBXVMIQSA-N 1 3 341.499 2.765 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[N@@H+](C/C=C\c1ccccc1)C1CC1 ZINC001479873805 1397984684 /nfs/dbraw/zinc/98/46/84/1397984684.db2.gz GPSUSIYLYUMMST-CSBXVMIQSA-N 1 3 341.499 2.765 10 0 EFAEHO C[C@H](C(=O)N[C@H]1CC[N@H+](CCCCCF)C1)N1CCCCCC1 ZINC001479965369 1398051588 /nfs/dbraw/zinc/05/15/88/1398051588.db2.gz UKZIHDVHYBHJPK-SJORKVTESA-N 1 3 327.488 2.581 10 0 EFAEHO C[C@H](C(=O)N[C@H]1CC[N@@H+](CCCCCF)C1)N1CCCCCC1 ZINC001479965369 1398051593 /nfs/dbraw/zinc/05/15/93/1398051593.db2.gz UKZIHDVHYBHJPK-SJORKVTESA-N 1 3 327.488 2.581 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)N[C@H]1CCN(CC2=CCCCC2)C1 ZINC001479971615 1398057350 /nfs/dbraw/zinc/05/73/50/1398057350.db2.gz BCZDRFNEPHGMAS-IBGZPJMESA-N 1 3 333.520 2.943 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CCN(CC2=CCCCC2)C1)[NH+]1CCCC1 ZINC001479973141 1398059295 /nfs/dbraw/zinc/05/92/95/1398059295.db2.gz XMPDVSBNYGZFOI-OALUTQOASA-N 1 3 333.520 2.798 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@H]([NH2+]CCCCC(F)(F)F)C1 ZINC001480172247 1398141932 /nfs/dbraw/zinc/14/19/32/1398141932.db2.gz PERZBXHRYJCETK-AJNGGQMLSA-N 1 3 349.441 2.829 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H](C)CNC(=O)[C@H]1CCCCN1C(C)C ZINC001480547715 1398201314 /nfs/dbraw/zinc/20/13/14/1398201314.db2.gz DIOXJAFMGPQLKJ-VQIMIIECSA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc(F)cc1 ZINC001480548317 1398202554 /nfs/dbraw/zinc/20/25/54/1398202554.db2.gz JRXGPHTZZFWQSP-MAUKXSAKSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](C[NH2+]CCCC2CCCC2)C1)N(C)C ZINC001480649644 1398262796 /nfs/dbraw/zinc/26/27/96/1398262796.db2.gz XKBYNRQEJAPWHY-OALUTQOASA-N 1 3 337.552 2.981 10 0 EFAEHO CCc1ccc(CC[NH2+]C[C@H]2CCN(C(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001480654649 1398265894 /nfs/dbraw/zinc/26/58/94/1398265894.db2.gz WZHOLSSUVBLHTR-WOJBJXKFSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@H](C[NH2+]CCCC2CCCC2)C1)N(C)C ZINC001480664284 1398270994 /nfs/dbraw/zinc/27/09/94/1398270994.db2.gz XKBYNRQEJAPWHY-RTBURBONSA-N 1 3 337.552 2.981 10 0 EFAEHO CN(CC(=O)N1CC[C@H](C[NH2+]CCC(C)(C)C)C1)CC(C)(C)C ZINC001480664650 1398271249 /nfs/dbraw/zinc/27/12/49/1398271249.db2.gz CGFZYJGDYLEMGH-MRXNPFEDSA-N 1 3 325.541 2.839 10 0 EFAEHO CC/C=C\CC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)CCC)C[C@@H]21 ZINC001507361839 1406953150 /nfs/dbraw/zinc/95/31/50/1406953150.db2.gz DDJYSKAJBVPMFT-QRTFGMIHSA-N 1 3 335.536 2.901 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@H]2CCCN2C/C=C\c2ccccc2)C1 ZINC001493153278 1398484157 /nfs/dbraw/zinc/48/41/57/1398484157.db2.gz ZQGDBSDDRYKPDY-GCDVTEQJSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@H]2CCCN2C/C=C\c2ccccc2)C1 ZINC001493153278 1398484163 /nfs/dbraw/zinc/48/41/63/1398484163.db2.gz ZQGDBSDDRYKPDY-GCDVTEQJSA-N 1 3 341.499 2.622 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CC[N@H+](CCC2=CCCCC2)C1)N(C)C ZINC001493235201 1398552287 /nfs/dbraw/zinc/55/22/87/1398552287.db2.gz DXRAPMUFHZHFRK-RBUKOAKNSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CC[N@@H+](CCC2=CCCCC2)C1)N(C)C ZINC001493235201 1398552291 /nfs/dbraw/zinc/55/22/91/1398552291.db2.gz DXRAPMUFHZHFRK-RBUKOAKNSA-N 1 3 335.536 2.901 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CCN(Cc2cccc(F)c2)C1)[NH+](CC)CC ZINC001493237762 1398554360 /nfs/dbraw/zinc/55/43/60/1398554360.db2.gz SOJHOXIDVMZKRY-MJGOQNOKSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[N@H+](CC3CCC(C)(C)CC3)C2)C1 ZINC001493240997 1398556913 /nfs/dbraw/zinc/55/69/13/1398556913.db2.gz YEWOLLLIQNKARR-IEBWSBKVSA-N 1 3 349.563 2.983 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[N@@H+](CC3CCC(C)(C)CC3)C2)C1 ZINC001493240997 1398556917 /nfs/dbraw/zinc/55/69/17/1398556917.db2.gz YEWOLLLIQNKARR-IEBWSBKVSA-N 1 3 349.563 2.983 10 0 EFAEHO CCC[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC(C)C ZINC001493317708 1398610251 /nfs/dbraw/zinc/61/02/51/1398610251.db2.gz GQHZMQYRWVEFLM-GOSISDBHSA-N 1 3 329.504 2.683 10 0 EFAEHO CCC[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)CC(C)C ZINC001493317708 1398610255 /nfs/dbraw/zinc/61/02/55/1398610255.db2.gz GQHZMQYRWVEFLM-GOSISDBHSA-N 1 3 329.504 2.683 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1CC[C@H](C)C1)[C@@H]1CCc2ccccc21 ZINC001493317817 1398609597 /nfs/dbraw/zinc/60/95/97/1398609597.db2.gz GZAWIRQURYAPIL-FXAWDEMLSA-N 1 3 343.515 2.844 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1CC[C@H](C)C1)[C@@H]1CCc2ccccc21 ZINC001493317817 1398609599 /nfs/dbraw/zinc/60/95/99/1398609599.db2.gz GZAWIRQURYAPIL-FXAWDEMLSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(CCNC(=O)C12CC[NH+](CC1)C2)Cc1cc(C)sc1C ZINC001493324784 1398616363 /nfs/dbraw/zinc/61/63/63/1398616363.db2.gz HNRFWBVYTHQDQW-UHFFFAOYSA-N 1 3 349.544 2.789 10 0 EFAEHO CN(CCNC/C=C/Cl)C(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001493670515 1398797413 /nfs/dbraw/zinc/79/74/13/1398797413.db2.gz PUSCZJDKZRWTRE-VGZDNEPHSA-N 1 3 327.900 2.584 10 0 EFAEHO CN(CCNC/C=C/Cl)C(=O)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001493670515 1398797416 /nfs/dbraw/zinc/79/74/16/1398797416.db2.gz PUSCZJDKZRWTRE-VGZDNEPHSA-N 1 3 327.900 2.584 10 0 EFAEHO CN(CC[NH2+]CC1=CCCCC1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001493696733 1398815496 /nfs/dbraw/zinc/81/54/96/1398815496.db2.gz ZSXXUYBGENDZPQ-LJQANCHMSA-N 1 3 339.499 2.747 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]Cc1ccc(CF)cc1 ZINC001493806107 1398895680 /nfs/dbraw/zinc/89/56/80/1398895680.db2.gz FVQQPKHZANBIQP-SFHVURJKSA-N 1 3 335.467 2.579 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](CC1=CCCCC1)C(C)C ZINC001493875815 1398943709 /nfs/dbraw/zinc/94/37/09/1398943709.db2.gz XFHLDZMCHBXSFW-UHFFFAOYSA-N 1 3 332.492 2.978 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](CC1=CCCCC1)C(C)C ZINC001493875815 1398943711 /nfs/dbraw/zinc/94/37/11/1398943711.db2.gz XFHLDZMCHBXSFW-UHFFFAOYSA-N 1 3 332.492 2.978 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CCCF)c1ccccc1 ZINC001493889659 1398956920 /nfs/dbraw/zinc/95/69/20/1398956920.db2.gz UXVMBXSSVOYYQF-QZTJIDSGSA-N 1 3 335.467 2.666 10 0 EFAEHO C[N@H+](CCCc1ccsc1)C[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001494179486 1399192371 /nfs/dbraw/zinc/19/23/71/1399192371.db2.gz DUWIVXVHBGKACQ-SFHVURJKSA-N 1 3 349.544 2.557 10 0 EFAEHO C[N@@H+](CCCc1ccsc1)C[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001494179486 1399192374 /nfs/dbraw/zinc/19/23/74/1399192374.db2.gz DUWIVXVHBGKACQ-SFHVURJKSA-N 1 3 349.544 2.557 10 0 EFAEHO C[N@H+](CCCC1CCC1)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001494213503 1399217645 /nfs/dbraw/zinc/21/76/45/1399217645.db2.gz JHKFWHLZAKEFTF-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO C[N@@H+](CCCC1CCC1)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001494213503 1399217647 /nfs/dbraw/zinc/21/76/47/1399217647.db2.gz JHKFWHLZAKEFTF-UHFFFAOYSA-N 1 3 335.536 2.833 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N2C[C@@H]3C[C@H]2CN3CCCC(C)C)C1 ZINC001494666375 1399422373 /nfs/dbraw/zinc/42/23/73/1399422373.db2.gz GVIUFVAFGKFGJA-FHWLQOOXSA-N 1 3 335.536 2.830 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N2C[C@@H]3C[C@H]2CN3CCCC(C)C)C1 ZINC001494666375 1399422375 /nfs/dbraw/zinc/42/23/75/1399422375.db2.gz GVIUFVAFGKFGJA-FHWLQOOXSA-N 1 3 335.536 2.830 10 0 EFAEHO Cc1ccc(CN2CC[C@H](NC(=O)CCCC[NH+](C)C)C2)cc1C ZINC001494732745 1399447460 /nfs/dbraw/zinc/44/74/60/1399447460.db2.gz LCOQUECCTPBTQI-IBGZPJMESA-N 1 3 331.504 2.726 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H](C[NH2+]Cc2cc(C)ccc2F)C1 ZINC001507418490 1407032336 /nfs/dbraw/zinc/03/23/36/1407032336.db2.gz GFYMXKHLQXSGSA-FUHWJXTLSA-N 1 3 349.494 2.850 10 0 EFAEHO C[C@@H](C(=O)N(C)[C@H]1CC[N@H+](CCCCCF)C1)N1CCCCCC1 ZINC001494851069 1399505739 /nfs/dbraw/zinc/50/57/39/1399505739.db2.gz AYCNGMUGPWAMMV-ROUUACIJSA-N 1 3 341.515 2.923 10 0 EFAEHO C[C@@H](C(=O)N(C)[C@H]1CC[N@@H+](CCCCCF)C1)N1CCCCCC1 ZINC001494851069 1399505747 /nfs/dbraw/zinc/50/57/47/1399505747.db2.gz AYCNGMUGPWAMMV-ROUUACIJSA-N 1 3 341.515 2.923 10 0 EFAEHO C[C@H](C(=O)N(C)[C@H]1CC[N@H+](CCCCCF)C1)N1CCCCCC1 ZINC001494851067 1399506028 /nfs/dbraw/zinc/50/60/28/1399506028.db2.gz AYCNGMUGPWAMMV-MSOLQXFVSA-N 1 3 341.515 2.923 10 0 EFAEHO C[C@H](C(=O)N(C)[C@H]1CC[N@@H+](CCCCCF)C1)N1CCCCCC1 ZINC001494851067 1399506033 /nfs/dbraw/zinc/50/60/33/1399506033.db2.gz AYCNGMUGPWAMMV-MSOLQXFVSA-N 1 3 341.515 2.923 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]CCc1ccc(C)cc1 ZINC001494985619 1399590342 /nfs/dbraw/zinc/59/03/42/1399590342.db2.gz QKNBPSITGKVXFI-VQTJNVASSA-N 1 3 345.531 2.895 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](CC)[NH2+]Cc1c(C)cccc1Cl)N(C)C ZINC001495005072 1399598796 /nfs/dbraw/zinc/59/87/96/1399598796.db2.gz WVFMSUFKCOQAAT-WMLDXEAASA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](CC)N(C)C)[NH2+]Cc1c(C)cccc1Cl ZINC001495005071 1399598841 /nfs/dbraw/zinc/59/88/41/1399598841.db2.gz WVFMSUFKCOQAAT-RHSMWYFYSA-N 1 3 339.911 2.973 10 0 EFAEHO CCCCC[NH2+][C@H](CC)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001495057259 1399632977 /nfs/dbraw/zinc/63/29/77/1399632977.db2.gz FDOUFOGDZGJYMV-CRAIPNDOSA-N 1 3 329.504 2.874 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](CC)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001495058692 1399633518 /nfs/dbraw/zinc/63/35/18/1399633518.db2.gz QPKFQFKTOMIOLJ-QFBILLFUSA-N 1 3 331.504 2.575 10 0 EFAEHO Cc1conc1C[NH2+]CC1(NC(=O)C2CC3CCC2C3)CCCC1 ZINC001495129786 1399686229 /nfs/dbraw/zinc/68/62/29/1399686229.db2.gz JCWXPHUNIWTULG-HRCADAONSA-N 1 3 331.460 2.938 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C[NH2+]CC2CC3(CCC3)C2)CCCC1 ZINC001495212161 1399740238 /nfs/dbraw/zinc/74/02/38/1399740238.db2.gz SFVLSQWGHYJWKI-UHFFFAOYSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@](C)(C[NH2+]CCc2cccs2)C2CC2)C1 ZINC001495278820 1399788195 /nfs/dbraw/zinc/78/81/95/1399788195.db2.gz XPTKNWVKPDOQQY-DNVCBOLYSA-N 1 3 349.544 2.507 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@](C)(C[NH2+]C/C=C\Cl)C2CC2)c1 ZINC001495304861 1399817458 /nfs/dbraw/zinc/81/74/58/1399817458.db2.gz YHBPKGSHVHIBJX-HIZXUYSRSA-N 1 3 349.906 2.989 10 0 EFAEHO CN(CC(=O)N1C[C@H]([NH2+]CCCCCF)C(C)(C)C1)CC(C)(C)C ZINC001507445821 1407061983 /nfs/dbraw/zinc/06/19/83/1407061983.db2.gz JZFIWUZWGBQMDF-INIZCTEOSA-N 1 3 343.531 2.931 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H](CC[NH2+]Cc2cccc(F)c2)C1)N(C)C ZINC001495359488 1399903817 /nfs/dbraw/zinc/90/38/17/1399903817.db2.gz KUBJMKXFRNRARN-VQIMIIECSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H]1C[NH2+]C/C=C\c1ccccc1)N(C)C ZINC001495588318 1400100092 /nfs/dbraw/zinc/10/00/92/1400100092.db2.gz RIAZBNUUPWMNLS-BWSGSBQUSA-N 1 3 329.488 2.621 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC2(C1)CCN(C(=O)CN(C)C(C)C)CC2 ZINC001495604980 1400114122 /nfs/dbraw/zinc/11/41/22/1400114122.db2.gz CKVLCPPDOSXRLQ-SREVYHEPSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC2(C1)CCN(C(=O)CN(C)C(C)C)CC2 ZINC001495604980 1400114131 /nfs/dbraw/zinc/11/41/31/1400114131.db2.gz CKVLCPPDOSXRLQ-SREVYHEPSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C[NH2+]CC1CCCC1 ZINC001495744585 1400220263 /nfs/dbraw/zinc/22/02/63/1400220263.db2.gz XMYAEAJDZMYOIE-HNAYVOBHSA-N 1 3 341.515 2.731 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NCC2(NCc3ccccc3F)CCCC2)C1 ZINC001495953772 1400378888 /nfs/dbraw/zinc/37/88/88/1400378888.db2.gz PBRAHYULWURTOE-INIZCTEOSA-N 1 3 347.478 2.686 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NCC2(NCc3ccccc3F)CCCC2)C1 ZINC001495953772 1400378890 /nfs/dbraw/zinc/37/88/90/1400378890.db2.gz PBRAHYULWURTOE-INIZCTEOSA-N 1 3 347.478 2.686 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NCC2(NCc3ccccc3F)CCCC2)C1 ZINC001495953773 1400379072 /nfs/dbraw/zinc/37/90/72/1400379072.db2.gz PBRAHYULWURTOE-MRXNPFEDSA-N 1 3 347.478 2.686 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NCC2(NCc3ccccc3F)CCCC2)C1 ZINC001495953773 1400379077 /nfs/dbraw/zinc/37/90/77/1400379077.db2.gz PBRAHYULWURTOE-MRXNPFEDSA-N 1 3 347.478 2.686 10 0 EFAEHO C[C@H](C[NH2+]C/C=C/c1ccc(Cl)cc1)N(C)C(=O)[C@@H]1CCCN1C ZINC001496027332 1400423459 /nfs/dbraw/zinc/42/34/59/1400423459.db2.gz HUBHSZYAYXYZIP-VVEVLUTRSA-N 1 3 349.906 2.884 10 0 EFAEHO CC(C)C[C@@H](CNCCF)NC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001496284328 1400598983 /nfs/dbraw/zinc/59/89/83/1400598983.db2.gz HAVODCMQUFGZFO-WMZOPIPTSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)C[C@@H](CNCCF)NC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001496284328 1400598985 /nfs/dbraw/zinc/59/89/85/1400598985.db2.gz HAVODCMQUFGZFO-WMZOPIPTSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C[C@H]1C ZINC001496355684 1400666832 /nfs/dbraw/zinc/66/68/32/1400666832.db2.gz HPAVIPIUDWINAG-IAGOWNOFSA-N 1 3 325.541 2.837 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CC2CC3(CCC3)C2)[C@@H](C)C1 ZINC001496366765 1400676206 /nfs/dbraw/zinc/67/62/06/1400676206.db2.gz FUQIYTFCCVYSAB-FUHWJXTLSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H](C)[NH2+]CC2CC(F)(F)C2)C1 ZINC001496459013 1400744296 /nfs/dbraw/zinc/74/42/96/1400744296.db2.gz HBZKKFIHLRUONT-HOCLYGCPSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)CC[N@H+](C)CCC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001496514158 1400789691 /nfs/dbraw/zinc/78/96/91/1400789691.db2.gz YNWWYWKMYBGXGF-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)CC[N@@H+](C)CCC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001496514158 1400789695 /nfs/dbraw/zinc/78/96/95/1400789695.db2.gz YNWWYWKMYBGXGF-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001496562884 1400830120 /nfs/dbraw/zinc/83/01/20/1400830120.db2.gz VDDLJQHESCRIFN-OALUTQOASA-N 1 3 343.515 2.889 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]([NH2+][C@@H]1CCc2ccccc21)C(C)C ZINC001496626230 1400879910 /nfs/dbraw/zinc/87/99/10/1400879910.db2.gz FOONQJOIEDWLFR-RTBURBONSA-N 1 3 331.504 2.746 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]([NH2+][C@@H]1CCc2ccccc21)C(C)C ZINC001496626216 1400880371 /nfs/dbraw/zinc/88/03/71/1400880371.db2.gz FOONQJOIEDWLFR-MOPGFXCFSA-N 1 3 331.504 2.746 10 0 EFAEHO CN(CC[N@H+](C)[C@H]1CCc2ccc(Cl)cc21)C(=O)[C@@H]1CCCN1C ZINC001496679331 1400915771 /nfs/dbraw/zinc/91/57/71/1400915771.db2.gz JXLXJFMHNIIOLR-ROUUACIJSA-N 1 3 349.906 2.812 10 0 EFAEHO CN(CC[N@@H+](C)[C@H]1CCc2ccc(Cl)cc21)C(=O)[C@@H]1CCCN1C ZINC001496679331 1400915774 /nfs/dbraw/zinc/91/57/74/1400915774.db2.gz JXLXJFMHNIIOLR-ROUUACIJSA-N 1 3 349.906 2.812 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[C@H]3CCCC[N@@H+]32)cc1 ZINC001496730675 1400946374 /nfs/dbraw/zinc/94/63/74/1400946374.db2.gz HFPNZFMGUVRBCK-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)cc1 ZINC001496730675 1400946375 /nfs/dbraw/zinc/94/63/75/1400946375.db2.gz HFPNZFMGUVRBCK-WOJBJXKFSA-N 1 3 343.515 2.902 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[N@H+](C)C[C@@H]2CCCC(F)(F)C2)C1 ZINC001496780891 1400978726 /nfs/dbraw/zinc/97/87/26/1400978726.db2.gz IYALEHLTTMFLCG-JKSUJKDBSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[N@@H+](C)C[C@@H]2CCCC(F)(F)C2)C1 ZINC001496780891 1400978728 /nfs/dbraw/zinc/97/87/28/1400978728.db2.gz IYALEHLTTMFLCG-JKSUJKDBSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[N@H+](C)C[C@@H]2CCCC(F)(F)C2)C1 ZINC001496780889 1400978741 /nfs/dbraw/zinc/97/87/41/1400978741.db2.gz IYALEHLTTMFLCG-HZPDHXFCSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[N@@H+](C)C[C@@H]2CCCC(F)(F)C2)C1 ZINC001496780889 1400978744 /nfs/dbraw/zinc/97/87/44/1400978744.db2.gz IYALEHLTTMFLCG-HZPDHXFCSA-N 1 3 345.478 2.544 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2CC2=CCCCC2)C1 ZINC001496864698 1401060393 /nfs/dbraw/zinc/06/03/93/1401060393.db2.gz AGMBSWQPDNCKBO-OALUTQOASA-N 1 3 333.520 2.750 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2CC2=CCCCC2)C1 ZINC001496864698 1401060401 /nfs/dbraw/zinc/06/04/01/1401060401.db2.gz AGMBSWQPDNCKBO-OALUTQOASA-N 1 3 333.520 2.750 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2CCC[C@@H]2NC(=O)CN(C)C(C)C)c1 ZINC001496925934 1401106133 /nfs/dbraw/zinc/10/61/33/1401106133.db2.gz XKBDCWUOXRRVGG-UXHICEINSA-N 1 3 345.531 2.964 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C)CC[NH2+]CCc1ccccc1F ZINC001497186266 1401206412 /nfs/dbraw/zinc/20/64/12/1401206412.db2.gz LICJSXBPDPCCNK-APWZRJJASA-N 1 3 349.494 2.725 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1sccc1Cl)N(C)C ZINC001497263878 1401255787 /nfs/dbraw/zinc/25/57/87/1401255787.db2.gz OGCICEBCRNTFFC-IUODEOHRSA-N 1 3 345.940 2.972 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(F)cc1 ZINC001497329823 1401307290 /nfs/dbraw/zinc/30/72/90/1401307290.db2.gz DUTNFQWGJSYTRE-MAUKXSAKSA-N 1 3 335.467 2.685 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)cc1C)C(=O)C1(N(C)C)CCC1 ZINC001497401284 1401349149 /nfs/dbraw/zinc/34/91/49/1401349149.db2.gz SGLRLGCYXZINCZ-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO CCN(CC[NH2+]Cc1cc(F)ccc1C)C(=O)[C@@H](C(C)C)N(C)C ZINC001497486104 1401410444 /nfs/dbraw/zinc/41/04/44/1401410444.db2.gz LHLNOQADNJAZCU-GOSISDBHSA-N 1 3 337.483 2.658 10 0 EFAEHO CCN(CC[NH2+][C@@H](C)c1ccc(F)c(F)c1)C(=O)CN(C)C(C)C ZINC001497500113 1401422613 /nfs/dbraw/zinc/42/26/13/1401422613.db2.gz BDFKPCIDIJWROJ-AWEZNQCLSA-N 1 3 341.446 2.804 10 0 EFAEHO CCN(CC[NH2+]C[C@@H]1CCC(F)(F)C1)C(=O)[C@H]1CCCCN1CC ZINC001497501266 1401423543 /nfs/dbraw/zinc/42/35/43/1401423543.db2.gz QKTPXYJKCOFUAH-HZPDHXFCSA-N 1 3 345.478 2.734 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C/C=C\CNC(=O)CN(C)C2CCC2)c(C)c1 ZINC001497595370 1401482578 /nfs/dbraw/zinc/48/25/78/1401482578.db2.gz CKQBEENGYAQYQU-WAYWQWQTSA-N 1 3 343.515 2.858 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C/C=C/CNC(=O)CN(C)C2CCC2)c(C)c1 ZINC001497595369 1401482586 /nfs/dbraw/zinc/48/25/86/1401482586.db2.gz CKQBEENGYAQYQU-AATRIKPKSA-N 1 3 343.515 2.858 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccc(CF)cc1)C(=O)[C@H]1CC[N@H+](C)C1 ZINC001507862717 1407187003 /nfs/dbraw/zinc/18/70/03/1407187003.db2.gz IVLMWPXSHDYOME-IBGZPJMESA-N 1 3 349.494 2.777 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccc(CF)cc1)C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001507862717 1407187012 /nfs/dbraw/zinc/18/70/12/1407187012.db2.gz IVLMWPXSHDYOME-IBGZPJMESA-N 1 3 349.494 2.777 10 0 EFAEHO CCCN(C)CC(=O)NC/C=C/C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC001497726690 1401587715 /nfs/dbraw/zinc/58/77/15/1401587715.db2.gz SZHQYXYODXDZBX-PXPVJAHISA-N 1 3 347.478 2.807 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C/C=C\CNC(=O)CN1CCCC1 ZINC001497750133 1401615915 /nfs/dbraw/zinc/61/59/15/1401615915.db2.gz PPCPAEDARHHGLB-IHWYPQMZSA-N 1 3 335.879 2.506 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/CNCc1ccsc1)[NH+]1CCCC1 ZINC001497762557 1401632219 /nfs/dbraw/zinc/63/22/19/1401632219.db2.gz ISKGLDJBOXVRQF-IDOMTICXSA-N 1 3 335.517 2.631 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@@H](C)NC(=O)[C@H]1CCCN1C(C)C ZINC001497816432 1401671890 /nfs/dbraw/zinc/67/18/90/1401671890.db2.gz QVCKQACXDSYFHB-YLJYHZDGSA-N 1 3 345.531 2.759 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+][C@H](C)c1ccc2c(c1)CCC2)N(C)C ZINC001497836497 1401686456 /nfs/dbraw/zinc/68/64/56/1401686456.db2.gz ZGFLLYYWKFIARN-SPYBWZPUSA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+]Cc1ccc(C2CCC2)cc1 ZINC001497992260 1401798351 /nfs/dbraw/zinc/79/83/51/1401798351.db2.gz DEJGDHBAFNSVPG-MRXNPFEDSA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC001497992982 1401798457 /nfs/dbraw/zinc/79/84/57/1401798457.db2.gz LEPGRASBXFRZLR-CYBMUJFWSA-N 1 3 345.409 2.640 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CC2)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001498118260 1401864359 /nfs/dbraw/zinc/86/43/59/1401864359.db2.gz QCUVYPSRLZDSDQ-HOTGVXAUSA-N 1 3 329.488 2.500 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CCCc1ccccc1 ZINC001498131920 1401870442 /nfs/dbraw/zinc/87/04/42/1401870442.db2.gz FKRSNUFYQHGTCO-ICSRJNTNSA-N 1 3 345.531 2.976 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)CCc2ccccc2F)CC[N@@H+]1C ZINC001498289747 1401980797 /nfs/dbraw/zinc/98/07/97/1401980797.db2.gz VVBSVIWMQSEJDR-VDZJLULYSA-N 1 3 349.494 2.535 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)CCc2ccccc2F)CC[N@H+]1C ZINC001498289747 1401980804 /nfs/dbraw/zinc/98/08/04/1401980804.db2.gz VVBSVIWMQSEJDR-VDZJLULYSA-N 1 3 349.494 2.535 10 0 EFAEHO CCCc1ccc(CN(C)C[C@@H](C)NC(=O)C[C@H]2CC[N@H+](C)C2)cc1 ZINC001498424986 1402090130 /nfs/dbraw/zinc/09/01/30/1402090130.db2.gz KTTLQGUKHRHPTA-YLJYHZDGSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(CN(C)C[C@@H](C)NC(=O)C[C@H]2CC[N@@H+](C)C2)cc1 ZINC001498424986 1402090138 /nfs/dbraw/zinc/09/01/38/1402090138.db2.gz KTTLQGUKHRHPTA-YLJYHZDGSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@H](CN(C)C/C=C\c1ccc(Cl)cc1)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001498450472 1402113917 /nfs/dbraw/zinc/11/39/17/1402113917.db2.gz PQWHMHGJIXGLNZ-XQJUWPJRSA-N 1 3 349.906 2.741 10 0 EFAEHO C[C@H](CN(C)C/C=C\c1ccc(Cl)cc1)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001498450472 1402113920 /nfs/dbraw/zinc/11/39/20/1402113920.db2.gz PQWHMHGJIXGLNZ-XQJUWPJRSA-N 1 3 349.906 2.741 10 0 EFAEHO CCc1ccccc1C[NH2+]CCCN(C)C(=O)C1(N(C)C)CCC1 ZINC001498559620 1402175495 /nfs/dbraw/zinc/17/54/95/1402175495.db2.gz LBNXNWIVDXIOSP-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO CN(CCC[NH2+]CC1CCCC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001498612048 1402201130 /nfs/dbraw/zinc/20/11/30/1402201130.db2.gz DPDXJPVINFQLQO-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]CC1CC(C)(C)C1 ZINC001498906617 1402372898 /nfs/dbraw/zinc/37/28/98/1402372898.db2.gz HOFKOOJZDRQAED-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@H+](C/C=C/Cl)C1 ZINC001499480469 1402635538 /nfs/dbraw/zinc/63/55/38/1402635538.db2.gz HCLFVIIHWNFFAX-RUZMYDRRSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H]1CC[N@@H+](C/C=C/Cl)C1 ZINC001499480469 1402635543 /nfs/dbraw/zinc/63/55/43/1402635543.db2.gz HCLFVIIHWNFFAX-RUZMYDRRSA-N 1 3 341.927 2.782 10 0 EFAEHO CCC(CC)C[NH+]1CCC([C@@H](C)NC(=O)CN2CC[C@H](C)C2)CC1 ZINC001508065076 1407275651 /nfs/dbraw/zinc/27/56/51/1407275651.db2.gz WLCAJEYECAKRDU-DLBZAZTESA-N 1 3 337.552 2.981 10 0 EFAEHO CCC(CC)C[NH+]1CCC([C@@H](C)NC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001508065078 1407275924 /nfs/dbraw/zinc/27/59/24/1407275924.db2.gz WLCAJEYECAKRDU-IAGOWNOFSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@]2(CC[N@H+](CCCCCF)C2)C1)N(C)C ZINC001499609267 1402714783 /nfs/dbraw/zinc/71/47/83/1402714783.db2.gz CSRCQDDEVQEGIJ-MJGOQNOKSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@]2(CC[N@@H+](CCCCCF)C2)C1)N(C)C ZINC001499609267 1402714787 /nfs/dbraw/zinc/71/47/87/1402714787.db2.gz CSRCQDDEVQEGIJ-MJGOQNOKSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@H](NC(=O)CN(C)CC(C)(C)C)C1CC[NH+](CCCF)CC1 ZINC001508081071 1407285762 /nfs/dbraw/zinc/28/57/62/1407285762.db2.gz KSNVICVWNONGAI-HNNXBMFYSA-N 1 3 329.504 2.541 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+]Cc1ccc(Cl)s1 ZINC001499954953 1402868716 /nfs/dbraw/zinc/86/87/16/1402868716.db2.gz KUKJATXFTGXLAB-ZDUSSCGKSA-N 1 3 343.924 2.822 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N[C@@]2(C)CCN(C/C=C\c3ccccc3)C2)C1 ZINC001500281215 1403028584 /nfs/dbraw/zinc/02/85/84/1403028584.db2.gz SICNBDJBTKVCIU-XCGYYHPWSA-N 1 3 341.499 2.622 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N[C@@]2(C)CCN(C/C=C\c3ccccc3)C2)C1 ZINC001500281215 1403028588 /nfs/dbraw/zinc/02/85/88/1403028588.db2.gz SICNBDJBTKVCIU-XCGYYHPWSA-N 1 3 341.499 2.622 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@](C)(C[NH2+]CCc2ccccc2)C1)N(C)C ZINC001500356440 1403072029 /nfs/dbraw/zinc/07/20/29/1403072029.db2.gz ROFKXGIYJFZWLM-PZJWPPBQSA-N 1 3 345.531 2.644 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1CN(C(C)C)CCC1(F)F)[NH+](CC)CC ZINC001500617924 1403253861 /nfs/dbraw/zinc/25/38/61/1403253861.db2.gz YZAGCHJLICIXSE-CABCVRRESA-N 1 3 333.467 2.589 10 0 EFAEHO CN(CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](C/C=C\Cl)C2)CC(C)(C)C ZINC001501010475 1403403225 /nfs/dbraw/zinc/40/32/25/1403403225.db2.gz HTWWCVVOEYFYOL-KKSLWYRISA-N 1 3 341.927 2.686 10 0 EFAEHO CN(CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](C/C=C\Cl)C2)CC(C)(C)C ZINC001501010475 1403403227 /nfs/dbraw/zinc/40/32/27/1403403227.db2.gz HTWWCVVOEYFYOL-KKSLWYRISA-N 1 3 341.927 2.686 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2ccc(C)c(C)c2)C1 ZINC001501150417 1403460727 /nfs/dbraw/zinc/46/07/27/1403460727.db2.gz RBLBRBVBUNBNFA-AZUAARDMSA-N 1 3 345.531 2.829 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@H](C[NH2+]CCC(C)C)CC1 ZINC001501189919 1403483772 /nfs/dbraw/zinc/48/37/72/1403483772.db2.gz HQTIQVOBNKGLFF-QAQDUYKDSA-N 1 3 334.508 2.819 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@H](CC[NH2+]Cc3ccccc3F)C2)CCC1 ZINC001501574479 1403632808 /nfs/dbraw/zinc/63/28/08/1403632808.db2.gz NMTBSIUDTYHUPU-MRXNPFEDSA-N 1 3 347.478 2.638 10 0 EFAEHO C[C@@H]([NH2+]CC[C@@H]1CCN(C(=O)CN2CCCC2)C1)c1ccccc1 ZINC001501647088 1403665073 /nfs/dbraw/zinc/66/50/73/1403665073.db2.gz BMKFAKVPKQBWFE-QZTJIDSGSA-N 1 3 329.488 2.672 10 0 EFAEHO C[C@H](c1ccccc1F)N1CCC2(CN(C(=O)CC[NH+](C)C)C2)CC1 ZINC001501742312 1403758491 /nfs/dbraw/zinc/75/84/91/1403758491.db2.gz WMUCCHGGJFPGMD-MRXNPFEDSA-N 1 3 347.478 2.763 10 0 EFAEHO CC[C@@H](F)C[NH+]1CCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)CC1 ZINC001501745444 1403761075 /nfs/dbraw/zinc/76/10/75/1403761075.db2.gz YYPBYGJZUZMNLB-MRXNPFEDSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)[C@H]2CCC[N@@H+]2C2CCCC2)CCC1 ZINC001501961442 1403907373 /nfs/dbraw/zinc/90/73/73/1403907373.db2.gz AEYVVGIULCYJPV-NVXWUHKLSA-N 1 3 339.499 2.770 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)[C@H]2CCC[N@H+]2C2CCCC2)CCC1 ZINC001501961442 1403907375 /nfs/dbraw/zinc/90/73/75/1403907375.db2.gz AEYVVGIULCYJPV-NVXWUHKLSA-N 1 3 339.499 2.770 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)[C@@H]2CCC[N@@H+]2C2CCCC2)CCC1 ZINC001501961444 1403907407 /nfs/dbraw/zinc/90/74/07/1403907407.db2.gz AEYVVGIULCYJPV-WBVHZDCISA-N 1 3 339.499 2.770 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)[C@@H]2CCC[N@H+]2C2CCCC2)CCC1 ZINC001501961444 1403907411 /nfs/dbraw/zinc/90/74/11/1403907411.db2.gz AEYVVGIULCYJPV-WBVHZDCISA-N 1 3 339.499 2.770 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)[C@@H](C(C)C)[NH+]2CCCCC2)CCC1 ZINC001502028883 1403959465 /nfs/dbraw/zinc/95/94/65/1403959465.db2.gz DNRUIAAFEVSHLD-DLBZAZTESA-N 1 3 341.515 2.874 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCCN(Cc2ccccc2Cl)CC1 ZINC001502135832 1404034814 /nfs/dbraw/zinc/03/48/14/1404034814.db2.gz SAJGRWOMMQWQSK-MRXNPFEDSA-N 1 3 337.895 2.762 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[N@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001502385358 1404123779 /nfs/dbraw/zinc/12/37/79/1404123779.db2.gz QWOCVNFPMHDKNT-HSALFYBXSA-N 1 3 349.563 2.935 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[N@@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001502385358 1404123786 /nfs/dbraw/zinc/12/37/86/1404123786.db2.gz QWOCVNFPMHDKNT-HSALFYBXSA-N 1 3 349.563 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H]2CCC[N@H+](CC3CC3)C2)C1 ZINC001502404905 1404145965 /nfs/dbraw/zinc/14/59/65/1404145965.db2.gz OUOMNXGIBCRNLB-OALUTQOASA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H]2CCC[N@@H+](CC3CC3)C2)C1 ZINC001502404905 1404145974 /nfs/dbraw/zinc/14/59/74/1404145974.db2.gz OUOMNXGIBCRNLB-OALUTQOASA-N 1 3 335.536 2.687 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(CC)([NH2+]Cc2ccsc2)CC1 ZINC001502513431 1404212776 /nfs/dbraw/zinc/21/27/76/1404212776.db2.gz LXVACXDKKDEBPU-UHFFFAOYSA-N 1 3 337.533 2.951 10 0 EFAEHO CCC1([NH2+]C/C(Cl)=C/Cl)CCN(C(=O)CN2CCCC2)CC1 ZINC001502516084 1404213653 /nfs/dbraw/zinc/21/36/53/1404213653.db2.gz ZQLTUUNBTOZWLS-KAMYIIQDSA-N 1 3 348.318 2.762 10 0 EFAEHO CCCN1Cc2ccc(CNC(=O)CC[C@@H]3CCC[N@@H+]3C)cc2C1 ZINC001502650902 1404285830 /nfs/dbraw/zinc/28/58/30/1404285830.db2.gz RHXWTCACTUFTRH-IBGZPJMESA-N 1 3 329.488 2.903 10 0 EFAEHO CCCN1Cc2ccc(CNC(=O)CC[C@@H]3CCC[N@H+]3C)cc2C1 ZINC001502650902 1404285832 /nfs/dbraw/zinc/28/58/32/1404285832.db2.gz RHXWTCACTUFTRH-IBGZPJMESA-N 1 3 329.488 2.903 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@H+](CCCC(C)C)CC1(C)C ZINC001502837155 1404395861 /nfs/dbraw/zinc/39/58/61/1404395861.db2.gz YFQUTNHBUORLGA-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@@H+](CCCC(C)C)CC1(C)C ZINC001502837155 1404395865 /nfs/dbraw/zinc/39/58/65/1404395865.db2.gz YFQUTNHBUORLGA-KRWDZBQOSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@H+](CCCCCF)CC1(C)C)N(C)C ZINC001502835993 1404392570 /nfs/dbraw/zinc/39/25/70/1404392570.db2.gz GDBGHFMBBGUXCO-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@@H+](CCCCCF)CC1(C)C)N(C)C ZINC001502835993 1404392578 /nfs/dbraw/zinc/39/25/78/1404392578.db2.gz GDBGHFMBBGUXCO-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@H+](CCCCCF)CC1(C)C)N(C)C ZINC001502835996 1404394302 /nfs/dbraw/zinc/39/43/02/1404394302.db2.gz GDBGHFMBBGUXCO-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@@H+](CCCCCF)CC1(C)C)N(C)C ZINC001502835996 1404394312 /nfs/dbraw/zinc/39/43/12/1404394312.db2.gz GDBGHFMBBGUXCO-JKSUJKDBSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1Cc1ccsc1 ZINC001502933944 1404436285 /nfs/dbraw/zinc/43/62/85/1404436285.db2.gz NLCKPWWHKGOCNQ-GOEBONIOSA-N 1 3 335.517 2.702 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)CC[N@H+]1Cc1ccsc1 ZINC001502933944 1404436287 /nfs/dbraw/zinc/43/62/87/1404436287.db2.gz NLCKPWWHKGOCNQ-GOEBONIOSA-N 1 3 335.517 2.702 10 0 EFAEHO C[C@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1Cc1ccsc1 ZINC001502933945 1404436393 /nfs/dbraw/zinc/43/63/93/1404436393.db2.gz NLCKPWWHKGOCNQ-HOCLYGCPSA-N 1 3 335.517 2.702 10 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1404748679 /nfs/dbraw/zinc/74/86/79/1404748679.db2.gz PGADJEUYORHLPA-KLHKWILBSA-N 1 3 347.503 2.581 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001505621812 1404863972 /nfs/dbraw/zinc/86/39/72/1404863972.db2.gz LXDSKCKIFFFSKR-KBPBESRZSA-N 1 3 337.895 2.807 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)[C@H](C)[NH2+]Cc1cccc(F)c1 ZINC001505667276 1404915172 /nfs/dbraw/zinc/91/51/72/1404915172.db2.gz KKAZYJWSWHQSLR-GJZGRUSLSA-N 1 3 335.467 2.683 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)[NH+]1CCCC1)[C@H](C)NCC=C(Cl)Cl ZINC001505667368 1404915391 /nfs/dbraw/zinc/91/53/91/1404915391.db2.gz LOKJYFUURUNALI-NWDGAFQWSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)[C@@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001505976619 1405296863 /nfs/dbraw/zinc/29/68/63/1405296863.db2.gz PNHIIPVKTDEYQM-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)[C@@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001505976619 1405296874 /nfs/dbraw/zinc/29/68/74/1405296874.db2.gz PNHIIPVKTDEYQM-IRXDYDNUSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H](CNC(=O)CC[NH+](C)C)N(C)[C@H](C)c1ccc(F)c(Cl)c1 ZINC001505995230 1405321261 /nfs/dbraw/zinc/32/12/61/1405321261.db2.gz UIVSUSSXWMDBPK-CHWSQXEVSA-N 1 3 343.874 2.928 10 0 EFAEHO CCCN(C)CC(=O)NC1(C[NH2+]Cc2cccnc2C)CCCCC1 ZINC001506521201 1405900852 /nfs/dbraw/zinc/90/08/52/1405900852.db2.gz CQNNZPZFOZQIGW-UHFFFAOYSA-N 1 3 346.519 2.641 10 0 EFAEHO Cc1ccc(CN2CC([C@H](C)NC(=O)C[C@H]3CC[N@H+](C)C3)C2)c(C)c1 ZINC001506660837 1406115247 /nfs/dbraw/zinc/11/52/47/1406115247.db2.gz AGGGIELCIYKLFM-ZWKOTPCHSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(CN2CC([C@H](C)NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)c(C)c1 ZINC001506660837 1406115251 /nfs/dbraw/zinc/11/52/51/1406115251.db2.gz AGGGIELCIYKLFM-ZWKOTPCHSA-N 1 3 343.515 2.582 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)C1CN(Cc2ccc(C3CC3)cc2)C1 ZINC001506667247 1406123566 /nfs/dbraw/zinc/12/35/66/1406123566.db2.gz QVNMISKEEJTOKA-MRXNPFEDSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)C1CN(Cc2ccc(C3CC3)cc2)C1 ZINC001506667247 1406123575 /nfs/dbraw/zinc/12/35/75/1406123575.db2.gz QVNMISKEEJTOKA-MRXNPFEDSA-N 1 3 343.515 2.842 10 0 EFAEHO C/C=C/C[C@@H]1CCCN(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)C1 ZINC001565055610 1415388312 /nfs/dbraw/zinc/38/83/12/1415388312.db2.gz GXPGIGVBOSSGQD-ZGKJDNBHSA-N 1 3 338.540 2.646 10 0 EFAEHO C/C=C/C[C@@H]1CCCN(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)C1 ZINC001565055610 1415388314 /nfs/dbraw/zinc/38/83/14/1415388314.db2.gz GXPGIGVBOSSGQD-ZGKJDNBHSA-N 1 3 338.540 2.646 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2C[C@@H]([NH2+]CCC3=CCCCC3)C2)C1 ZINC001565852004 1415434171 /nfs/dbraw/zinc/43/41/71/1415434171.db2.gz VUBNDSVGQQTWOI-YTQUADARSA-N 1 3 333.520 2.703 10 0 EFAEHO CCC(CC)C[NH2+]CC[C@@H]1[C@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001565939106 1415456957 /nfs/dbraw/zinc/45/69/57/1415456957.db2.gz OESDHKAOMLIZCR-CRAIPNDOSA-N 1 3 334.508 2.995 10 0 EFAEHO CC/C=C/CC[NH2+]CC[C@@H]1[C@@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001565939691 1415457621 /nfs/dbraw/zinc/45/76/21/1415457621.db2.gz SWNPDLNBJNPNRC-HRMTXBTBSA-N 1 3 332.492 2.915 10 0 EFAEHO Cc1ccc(C[N@@H+](C)CCCNC(=O)C2(N(C)C)CCC2)cc1C ZINC001566461097 1415559840 /nfs/dbraw/zinc/55/98/40/1415559840.db2.gz NHZJLHGXWYSQKR-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1ccc(C[N@H+](C)CCCNC(=O)C2(N(C)C)CCC2)cc1C ZINC001566461097 1415559843 /nfs/dbraw/zinc/55/98/43/1415559843.db2.gz NHZJLHGXWYSQKR-UHFFFAOYSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1ccc(CN(C)CCCNC(=O)CC[C@H]2CCC[N@@H+]2C)c(C)n1 ZINC001566463097 1415563060 /nfs/dbraw/zinc/56/30/60/1415563060.db2.gz KQQWAFPRWOWXIO-LJQANCHMSA-N 1 3 346.519 2.511 10 0 EFAEHO Cc1ccc(CN(C)CCCNC(=O)CC[C@H]2CCC[N@H+]2C)c(C)n1 ZINC001566463097 1415563062 /nfs/dbraw/zinc/56/30/62/1415563062.db2.gz KQQWAFPRWOWXIO-LJQANCHMSA-N 1 3 346.519 2.511 10 0 EFAEHO CCN(CCCNC(=O)CC1CC[NH+](C)CC1)Cc1ccccc1F ZINC001566566789 1415650297 /nfs/dbraw/zinc/65/02/97/1415650297.db2.gz MRSVXWBSCNRACV-UHFFFAOYSA-N 1 3 349.494 2.886 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](CC2=CCCCC2)C2CC2)C1 ZINC001566596710 1415682073 /nfs/dbraw/zinc/68/20/73/1415682073.db2.gz PQXRDCHMWWKIDJ-KRWDZBQOSA-N 1 3 333.520 2.799 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](CC2=CCCCC2)C2CC2)C1 ZINC001566596710 1415682076 /nfs/dbraw/zinc/68/20/76/1415682076.db2.gz PQXRDCHMWWKIDJ-KRWDZBQOSA-N 1 3 333.520 2.799 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H]1CCN(C(=O)C2(N(C)C)CCC2)C1 ZINC001566766724 1415768664 /nfs/dbraw/zinc/76/86/64/1415768664.db2.gz LKNVTSKFFBRAHK-IBGZPJMESA-N 1 3 343.515 2.602 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2C[C@H](NC(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001566803510 1415779872 /nfs/dbraw/zinc/77/98/72/1415779872.db2.gz CCNPMDQOVTVBBR-IHPCNDPISA-N 1 3 343.515 2.506 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1 ZINC001566802660 1415780266 /nfs/dbraw/zinc/78/02/66/1415780266.db2.gz ANOFWURTCXVORF-VAMGGRTRSA-N 1 3 345.531 2.751 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H]([NH2+]CCCc2ccsc2)C1)N(C)C ZINC001566811701 1415782891 /nfs/dbraw/zinc/78/28/91/1415782891.db2.gz XHEPWDJNJADZDK-BRWVUGGUSA-N 1 3 337.533 2.504 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001566828033 1415791527 /nfs/dbraw/zinc/79/15/27/1415791527.db2.gz XPZZSKMPRHMOIV-SJLPKXTDSA-N 1 3 332.492 2.845 10 0 EFAEHO CCCCCC[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c[nH]cn2)C1 ZINC001566828033 1415791529 /nfs/dbraw/zinc/79/15/29/1415791529.db2.gz XPZZSKMPRHMOIV-SJLPKXTDSA-N 1 3 332.492 2.845 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@H+](CC2=CCCCC2)C1)N(C)C ZINC001566879522 1415821145 /nfs/dbraw/zinc/82/11/45/1415821145.db2.gz OEQCFSIROLGUGS-RBUKOAKNSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCC[N@@H+](CC2=CCCCC2)C1)N(C)C ZINC001566879522 1415821146 /nfs/dbraw/zinc/82/11/46/1415821146.db2.gz OEQCFSIROLGUGS-RBUKOAKNSA-N 1 3 335.536 2.901 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@@H](C[NH2+]CCCCCF)C2)CC1 ZINC001566908298 1415836593 /nfs/dbraw/zinc/83/65/93/1415836593.db2.gz KJCBOBWDQNITLU-SFHVURJKSA-N 1 3 341.515 2.686 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCCC[C@@H]1C[NH2+]CCCCCF ZINC001566954094 1415866821 /nfs/dbraw/zinc/86/68/21/1415866821.db2.gz RKCZSRKHZDNJDL-MSOLQXFVSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCCc1cccc(F)c1 ZINC001567041913 1415910928 /nfs/dbraw/zinc/91/09/28/1415910928.db2.gz HPAXDDBFUXTEEK-MRXNPFEDSA-N 1 3 349.494 2.727 10 0 EFAEHO CN(CC(=O)N1CC[C@@H](C[NH2+]C/C=C\c2ccccc2)C1)C1CCC1 ZINC001567128954 1415944101 /nfs/dbraw/zinc/94/41/01/1415944101.db2.gz YCKUISKPZWPMPJ-QBUQCISBSA-N 1 3 341.499 2.622 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1Cc1cncc(C)c1)N(C)C ZINC001567265309 1416041906 /nfs/dbraw/zinc/04/19/06/1416041906.db2.gz VCUSLZNLENGXDD-MOPGFXCFSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@@H]1CCC[N@H+]1Cc1cncc(C)c1)N(C)C ZINC001567265309 1416041915 /nfs/dbraw/zinc/04/19/15/1416041915.db2.gz VCUSLZNLENGXDD-MOPGFXCFSA-N 1 3 346.519 2.591 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+]Cc2ccc(C(F)F)cc2)CCC1 ZINC001567507740 1416165987 /nfs/dbraw/zinc/16/59/87/1416165987.db2.gz JGPDMDLAZNAONR-UHFFFAOYSA-N 1 3 339.430 2.657 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001567516166 1416169554 /nfs/dbraw/zinc/16/95/54/1416169554.db2.gz KLLZLIPHSKVJPQ-OALUTQOASA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(F)cc1CNCCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001567516166 1416169558 /nfs/dbraw/zinc/16/95/58/1416169558.db2.gz KLLZLIPHSKVJPQ-OALUTQOASA-N 1 3 347.478 2.699 10 0 EFAEHO CCCCCC[NH2+]CCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001567561651 1416187683 /nfs/dbraw/zinc/18/76/83/1416187683.db2.gz XSWVOGNJGLXMAH-SFHVURJKSA-N 1 3 329.504 2.827 10 0 EFAEHO CCCN(C)CC(=O)N(C)CC[NH2+]Cc1cccc2ccccc21 ZINC001567593486 1416201686 /nfs/dbraw/zinc/20/16/86/1416201686.db2.gz FZJANIMCAUGVIB-UHFFFAOYSA-N 1 3 327.472 2.730 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H]1CC[N@H+](CCC2=CCCCC2)C1)N(C)C ZINC001567925925 1416326817 /nfs/dbraw/zinc/32/68/17/1416326817.db2.gz VYAOYCQPOQALHA-RBUKOAKNSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H]1CC[N@@H+](CCC2=CCCCC2)C1)N(C)C ZINC001567925925 1416326822 /nfs/dbraw/zinc/32/68/22/1416326822.db2.gz VYAOYCQPOQALHA-RBUKOAKNSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC1(C[NH2+]CCC(F)(F)F)CCCC1 ZINC001567998452 1416354623 /nfs/dbraw/zinc/35/46/23/1416354623.db2.gz MLXNYLWUSNTZHH-CQSZACIVSA-N 1 3 349.441 2.830 10 0 EFAEHO C[C@H](C(=O)N[C@](C)(C[NH2+]C/C=C\Cl)C1CC1)N1CCCCCC1 ZINC001568029508 1416366281 /nfs/dbraw/zinc/36/62/81/1416366281.db2.gz UIEAOZARTHITHT-XHPGIKPDSA-N 1 3 341.927 2.878 10 0 EFAEHO CC(C)CC[NH2+]CC[C@@H]1CCCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001568067779 1416391403 /nfs/dbraw/zinc/39/14/03/1416391403.db2.gz IWZQRLSSGAQYLV-ZWKOTPCHSA-N 1 3 325.541 2.837 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](CC[NH2+]CC2CC(F)(F)C2)C1 ZINC001568073837 1416396247 /nfs/dbraw/zinc/39/62/47/1416396247.db2.gz VPCIXHGCOGXCPB-HNNXBMFYSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[C@H](F)C[NH2+]CCC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001568092778 1416406778 /nfs/dbraw/zinc/40/67/78/1416406778.db2.gz ZPXBXDQYWLVADC-DLBZAZTESA-N 1 3 329.504 2.539 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC(CC[NH2+]CC3CC(C)(C)C3)CC2)C1 ZINC001568094275 1416407323 /nfs/dbraw/zinc/40/73/23/1416407323.db2.gz XKFDVLDKFAQCJO-KRWDZBQOSA-N 1 3 349.563 2.983 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(CC[NH2+]C/C=C\Cl)CC1 ZINC001568097459 1416408699 /nfs/dbraw/zinc/40/86/99/1416408699.db2.gz BGOZDDLROLIPTM-VTGFLYEISA-N 1 3 341.927 2.832 10 0 EFAEHO CC(C)[C@@H](C(=O)NCc1ccc(CNC/C=C\Cl)cc1)[NH+](C)C ZINC001568121944 1416418553 /nfs/dbraw/zinc/41/85/53/1416418553.db2.gz TZBMDCYYSVBEJG-VTGFLYEISA-N 1 3 337.895 2.731 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H](C)C[NH2+]C/C=C/c1ccccc1)N(C)C ZINC001568280079 1416464328 /nfs/dbraw/zinc/46/43/28/1416464328.db2.gz WTJXDXVRTWGUEC-MFXDBKITSA-N 1 3 331.504 2.723 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)CC(C)(C)C)CC[C@H]1[NH2+]CCCCCF ZINC001568364782 1416493973 /nfs/dbraw/zinc/49/39/73/1416493973.db2.gz IGOOPRDFQUTNRM-IAGOWNOFSA-N 1 3 343.531 2.931 10 0 EFAEHO CCN(CC[NH2+]Cc1ncc(C)s1)C(=O)C1CCCC(F)C1 ZINC001568742316 1416545540 /nfs/dbraw/zinc/54/55/40/1416545540.db2.gz QCMJVYCYMHLYCR-ZIAGYGMSSA-N 1 3 327.469 2.918 10 0 EFAEHO C[NH+]1CCC(CCNC(=O)c2ccc(NC3=NCCC3)cc2)CC1 ZINC001646223927 1416635770 /nfs/dbraw/zinc/63/57/70/1416635770.db2.gz NEQIKFMXQMOSIY-UHFFFAOYSA-N 1 3 328.460 2.753 10 0 EFAEHO CN1CCN(CC2(C)CC[NH+](CCc3cccc(F)c3)CC2)CC1 ZINC001646314878 1416646578 /nfs/dbraw/zinc/64/65/78/1416646578.db2.gz QXAMXEMKRQMRSP-UHFFFAOYSA-N 1 3 333.495 2.718 10 0 EFAEHO CC(C)CN1CCC([NH2+]CCCN(C)C(=O)OC(C)(C)C)CC1 ZINC000120245321 1416666191 /nfs/dbraw/zinc/66/61/91/1416666191.db2.gz DRWRMRZTHOMEBI-UHFFFAOYSA-N 1 3 327.513 2.953 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)[C@H]1CCCc2ccccc21)N(C)C ZINC001689841125 1417085440 /nfs/dbraw/zinc/08/54/40/1417085440.db2.gz YXRWXWXKZYAYJW-OALUTQOASA-N 1 3 331.504 2.842 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)[C@H]1CCCc2ccccc21)N(C)C ZINC001689841125 1417085442 /nfs/dbraw/zinc/08/54/42/1417085442.db2.gz YXRWXWXKZYAYJW-OALUTQOASA-N 1 3 331.504 2.842 10 0 EFAEHO C[C@@H](NC(=O)CCCC[NH+](C)C)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC001690504709 1417219605 /nfs/dbraw/zinc/21/96/05/1417219605.db2.gz HOHBUHCKYYSUEU-IEBWSBKVSA-N 1 3 346.519 2.530 10 0 EFAEHO Cc1cccc(CCC[NH2+]C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001690758050 1417239427 /nfs/dbraw/zinc/23/94/27/1417239427.db2.gz UGRHQFLOBJGZOM-HXUWFJFHSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC(CC[NH2+]CC2CC(C)C2)CC1)N(C)C ZINC001698702582 1417313271 /nfs/dbraw/zinc/31/32/71/1417313271.db2.gz GDQKQBHZGOANDG-NKELODKYSA-N 1 3 337.552 2.837 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2c1cccc2F)C(=O)CCCC[NH+](C)C ZINC001699002409 1417364416 /nfs/dbraw/zinc/36/44/16/1417364416.db2.gz QQNACBIJIMXXHF-LJQANCHMSA-N 1 3 349.494 2.935 10 0 EFAEHO CCN(CCNCc1c(C)cccc1Cl)C(=O)[C@@H]1CC[N@H+](C)C1 ZINC001699216661 1417413785 /nfs/dbraw/zinc/41/37/85/1417413785.db2.gz MHQDZAXGXDKVAT-OAHLLOKOSA-N 1 3 337.895 2.538 10 0 EFAEHO CCN(CCNCc1c(C)cccc1Cl)C(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001699216661 1417413787 /nfs/dbraw/zinc/41/37/87/1417413787.db2.gz MHQDZAXGXDKVAT-OAHLLOKOSA-N 1 3 337.895 2.538 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C/C[NH2+][C@@H]2CCc3ccccc32)CC1 ZINC001699323876 1417419198 /nfs/dbraw/zinc/41/91/98/1417419198.db2.gz HCXCILAWAGHGPF-DPZZJQGRSA-N 1 3 341.499 2.668 10 0 EFAEHO C[C@@H]([NH2+]CCCN(C)C(=O)CN1CC[C@@H](C)C1)c1cccc(F)c1 ZINC001699533064 1417428770 /nfs/dbraw/zinc/42/87/70/1417428770.db2.gz ARUOBCMVTXWGIT-HZPDHXFCSA-N 1 3 335.467 2.667 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NCC2([NH2+]CCCCCF)CC2)C1 ZINC001699662660 1417443469 /nfs/dbraw/zinc/44/34/69/1417443469.db2.gz ZVSTVYFDTMADBV-GOSISDBHSA-N 1 3 345.478 2.577 10 0 EFAEHO C[C@@H]([NH2+]CCCCC(F)(F)F)[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001699950605 1417520278 /nfs/dbraw/zinc/52/02/78/1417520278.db2.gz DYLYDGYDAQJCOK-HUUCEWRRSA-N 1 3 349.441 2.641 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@H](C[NH2+]C/C=C\Cl)CC1 ZINC001699981596 1417536606 /nfs/dbraw/zinc/53/66/06/1417536606.db2.gz KHGWTRYQDCJWDL-YXPPHGIZSA-N 1 3 338.883 2.525 10 0 EFAEHO CC1CCC(C[NH2+]CC[C@@H]2CCN(C(=O)Cc3c[nH]cn3)C2)CC1 ZINC001700079913 1417556478 /nfs/dbraw/zinc/55/64/78/1417556478.db2.gz UMLYSTMGZLUXFC-OFLPRAFFSA-N 1 3 332.492 2.607 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](CC[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001700087654 1417560473 /nfs/dbraw/zinc/56/04/73/1417560473.db2.gz KYDLFEJJMQZRPX-LJQANCHMSA-N 1 3 347.547 2.881 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](CC[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001700087652 1417560588 /nfs/dbraw/zinc/56/05/88/1417560588.db2.gz KYDLFEJJMQZRPX-IBGZPJMESA-N 1 3 347.547 2.881 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2cc(C)ccc2F)C1)N(C)C ZINC001700087180 1417560602 /nfs/dbraw/zinc/56/06/02/1417560602.db2.gz NVYWSCXZJNZFED-VQIMIIECSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)CCC[NH2+]C[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1 ZINC001713242924 1418411388 /nfs/dbraw/zinc/41/13/88/1418411388.db2.gz MYAYHUCENKCEPR-LJQANCHMSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@@H](F)CC[NH2+]C[C@@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001713266235 1418432989 /nfs/dbraw/zinc/43/29/89/1418432989.db2.gz NPVODXMSEUITLU-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H]([N@H+](C)CCCCCF)C1 ZINC001713400940 1418507839 /nfs/dbraw/zinc/50/78/39/1418507839.db2.gz MEIFORPQJIYUHG-QZTJIDSGSA-N 1 3 341.515 2.923 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H]([N@@H+](C)CCCCCF)C1 ZINC001713400940 1418507844 /nfs/dbraw/zinc/50/78/44/1418507844.db2.gz MEIFORPQJIYUHG-QZTJIDSGSA-N 1 3 341.515 2.923 10 0 EFAEHO CN(C)C1(C(=O)NCCC[C@@H]2CCC[N@@H+]2CCC(F)(F)F)CCC1 ZINC001713432354 1418526021 /nfs/dbraw/zinc/52/60/21/1418526021.db2.gz AWKFZIVLOBGXLB-CQSZACIVSA-N 1 3 349.441 2.784 10 0 EFAEHO CN(C)C1(C(=O)NCCC[C@@H]2CCC[N@H+]2CCC(F)(F)F)CCC1 ZINC001713432354 1418526024 /nfs/dbraw/zinc/52/60/24/1418526024.db2.gz AWKFZIVLOBGXLB-CQSZACIVSA-N 1 3 349.441 2.784 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C/CNC(=O)CN2CCC(C)CC2)c(C)c1 ZINC001715883138 1418694771 /nfs/dbraw/zinc/69/47/71/1418694771.db2.gz AWMAHTMFGGFVQR-SNAWJCMRSA-N 1 3 343.515 2.797 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@@H]21 ZINC001716049110 1418704366 /nfs/dbraw/zinc/70/43/66/1418704366.db2.gz JQNJHIKTVBPPMI-ROUUACIJSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCCCC[N@H+]1CC[C@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@@H]21 ZINC001716049110 1418704370 /nfs/dbraw/zinc/70/43/70/1418704370.db2.gz JQNJHIKTVBPPMI-ROUUACIJSA-N 1 3 335.536 2.974 10 0 EFAEHO CC(C)c1cccc(C[NH2+]CC[C@H](C)NC(=O)CN2CC[C@@H](C)C2)n1 ZINC001716174591 1418713733 /nfs/dbraw/zinc/71/37/33/1418713733.db2.gz VCVYQSSEPMEQQD-SJORKVTESA-N 1 3 346.519 2.531 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)C[NH2+]CCc1cccs1 ZINC001716414356 1418875774 /nfs/dbraw/zinc/87/57/74/1418875774.db2.gz BFTSKCZMDBUWCV-NVXWUHKLSA-N 1 3 337.533 2.648 10 0 EFAEHO C[C@@H](C[NH2+]CCCc1ccccc1)NC(=O)C(C)(C)N1CCCC1 ZINC001716447701 1418886827 /nfs/dbraw/zinc/88/68/27/1418886827.db2.gz KYORNXZTTHBBDH-KRWDZBQOSA-N 1 3 331.504 2.588 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]Cc1ccccc1Cl)N(C)C ZINC001716550123 1418912291 /nfs/dbraw/zinc/91/22/91/1418912291.db2.gz RZCLBEQSPBNYFA-MRXNPFEDSA-N 1 3 325.884 2.618 10 0 EFAEHO CC[C@H]1CN(C(=O)C(C)(C)N2CCCCC2)CC[C@@H]1[NH2+]CCCF ZINC001716635673 1418932447 /nfs/dbraw/zinc/93/24/47/1418932447.db2.gz MRLLRWZYPSSVKN-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@]2(CCN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001716732425 1418982307 /nfs/dbraw/zinc/98/23/07/1418982307.db2.gz WMULBTPEKGJRBV-FQEVSTJZSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCCC[N@H+]1CC[C@]2(CCN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001716732425 1418982309 /nfs/dbraw/zinc/98/23/09/1418982309.db2.gz WMULBTPEKGJRBV-FQEVSTJZSA-N 1 3 335.536 2.975 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H]2C[NH2+]CCCCC(F)(F)F)C1 ZINC001716784195 1419006994 /nfs/dbraw/zinc/00/69/94/1419006994.db2.gz NDSPOVVUQCRFRL-GJZGRUSLSA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)=CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)C2 ZINC001716999823 1419136221 /nfs/dbraw/zinc/13/62/21/1419136221.db2.gz TVIIAGQLMZPYQO-AKHDSKFASA-N 1 3 333.520 2.654 10 0 EFAEHO CC(C)=CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)C2 ZINC001716999823 1419136226 /nfs/dbraw/zinc/13/62/26/1419136226.db2.gz TVIIAGQLMZPYQO-AKHDSKFASA-N 1 3 333.520 2.654 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001717086453 1419197605 /nfs/dbraw/zinc/19/76/05/1419197605.db2.gz GNRREEVDPUVFDE-QUCCMNQESA-N 1 3 345.531 2.909 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]CCC(F)(F)F)C1 ZINC001717110533 1419215535 /nfs/dbraw/zinc/21/55/35/1419215535.db2.gz FPRLWLBJYDMKBO-LSDHHAIUSA-N 1 3 349.441 2.641 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1CC[C@H](C[NH2+]CCC2CC2)CC1 ZINC001717121230 1419223323 /nfs/dbraw/zinc/22/33/23/1419223323.db2.gz SBLURSZSGCTAPM-FHWLQOOXSA-N 1 3 335.536 2.924 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[C@H](C[NH2+]C/C=C/Cl)CC1)CC(C)(C)C ZINC001717123014 1419224474 /nfs/dbraw/zinc/22/44/74/1419224474.db2.gz OIVSLMRXLVLPMT-VKULFDBSSA-N 1 3 343.943 2.981 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H]1CCC[N@H+](CCCCCF)CC1 ZINC001717195726 1419257328 /nfs/dbraw/zinc/25/73/28/1419257328.db2.gz OXNCHGVZFLRVJF-QZTJIDSGSA-N 1 3 341.515 2.971 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H]1CCC[N@@H+](CCCCCF)CC1 ZINC001717195726 1419257331 /nfs/dbraw/zinc/25/73/31/1419257331.db2.gz OXNCHGVZFLRVJF-QZTJIDSGSA-N 1 3 341.515 2.971 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H]1CCC[N@H+](CCCCCF)CC1 ZINC001717195727 1419257758 /nfs/dbraw/zinc/25/77/58/1419257758.db2.gz OXNCHGVZFLRVJF-ROUUACIJSA-N 1 3 341.515 2.971 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H]1CCC[N@@H+](CCCCCF)CC1 ZINC001717195727 1419257759 /nfs/dbraw/zinc/25/77/59/1419257759.db2.gz OXNCHGVZFLRVJF-ROUUACIJSA-N 1 3 341.515 2.971 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[N@H+](CCCCCF)CC2)CCC1 ZINC001717195282 1419257778 /nfs/dbraw/zinc/25/77/78/1419257778.db2.gz GPMWIJZDYSDAEO-MRXNPFEDSA-N 1 3 327.488 2.581 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[N@@H+](CCCCCF)CC2)CCC1 ZINC001717195282 1419257781 /nfs/dbraw/zinc/25/77/81/1419257781.db2.gz GPMWIJZDYSDAEO-MRXNPFEDSA-N 1 3 327.488 2.581 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001717292877 1419311354 /nfs/dbraw/zinc/31/13/54/1419311354.db2.gz CDZJYAPUTPNCOF-AZUAARDMSA-N 1 3 345.531 2.704 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@@H]1C[N@H+](C)CC=C(C)C ZINC001717365451 1419357910 /nfs/dbraw/zinc/35/79/10/1419357910.db2.gz NDQGUVKZXUHVTQ-SJORKVTESA-N 1 3 327.488 2.555 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@@H]1C[N@@H+](C)CC=C(C)C ZINC001717365451 1419357913 /nfs/dbraw/zinc/35/79/13/1419357913.db2.gz NDQGUVKZXUHVTQ-SJORKVTESA-N 1 3 327.488 2.555 10 0 EFAEHO Cc1ccccc1CCC[NH2+][C@H](C)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001717412787 1419383965 /nfs/dbraw/zinc/38/39/65/1419383965.db2.gz KTCFSENTWMABJE-MSOLQXFVSA-N 1 3 345.531 2.895 10 0 EFAEHO C[C@@H](NC(=O)CC1CC[NH+](C)CC1)C1CN(CC2=CCCCC2)C1 ZINC001717559320 1419443781 /nfs/dbraw/zinc/44/37/81/1419443781.db2.gz QKUHARMSJIFOMB-MRXNPFEDSA-N 1 3 333.520 2.655 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+]Cc1c(C)cccc1C ZINC001717693681 1419510256 /nfs/dbraw/zinc/51/02/56/1419510256.db2.gz WJMGFYZCXYBZTL-INIZCTEOSA-N 1 3 342.487 2.952 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+]Cc1ccc(C)cc1 ZINC001717693386 1419510395 /nfs/dbraw/zinc/51/03/95/1419510395.db2.gz QBEVOOVANBWKHU-OAHLLOKOSA-N 1 3 328.460 2.644 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]CCCc2ccsc2)C1 ZINC001718000476 1419650471 /nfs/dbraw/zinc/65/04/71/1419650471.db2.gz MSDZMAAFMNBDAR-UHFFFAOYSA-N 1 3 337.533 2.600 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC=C(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001718022394 1419662294 /nfs/dbraw/zinc/66/22/94/1419662294.db2.gz SSFYRJROVXOXFK-SREVYHEPSA-N 1 3 333.520 2.965 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC=C(CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001718022394 1419662295 /nfs/dbraw/zinc/66/22/95/1419662295.db2.gz SSFYRJROVXOXFK-SREVYHEPSA-N 1 3 333.520 2.965 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CCCC[C@@H]1C[NH2+]CCC(C)(C)C ZINC001722953868 1424382023 /nfs/dbraw/zinc/38/20/23/1424382023.db2.gz LIWCIJCYISVWSW-HZPDHXFCSA-N 1 3 334.508 2.961 10 0 EFAEHO CN(CCC[NH2+][C@H]1CCCc2ccccc21)C(=O)CN(C)C1CCC1 ZINC001723038207 1424407800 /nfs/dbraw/zinc/40/78/00/1424407800.db2.gz DLNSLFWPUZTXJG-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+][C@@H](C)c1cc(F)ccc1F ZINC001723205581 1424451448 /nfs/dbraw/zinc/45/14/48/1424451448.db2.gz YLEIRWOGGDAWKS-AWEZNQCLSA-N 1 3 341.446 2.804 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[NH2+]CCc1ccccc1 ZINC001723203486 1424451695 /nfs/dbraw/zinc/45/16/95/1424451695.db2.gz JWOXVXWAZXGVIR-LJQANCHMSA-N 1 3 331.504 2.542 10 0 EFAEHO C[C@@H](C(=O)N[C@@H](C[NH2+]CCC(F)(F)F)C1CC1)N1CCCCCC1 ZINC001723334664 1424470146 /nfs/dbraw/zinc/47/01/46/1424470146.db2.gz RSQKOWHGSKIJFC-ZFWWWQNUSA-N 1 3 349.441 2.688 10 0 EFAEHO CCCCC[N@@H+]1CCC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001723678079 1424553484 /nfs/dbraw/zinc/55/34/84/1424553484.db2.gz BUPGBKCQFNPUGJ-ICSRJNTNSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCC[N@H+]1CCC[C@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001723678079 1424553489 /nfs/dbraw/zinc/55/34/89/1424553489.db2.gz BUPGBKCQFNPUGJ-ICSRJNTNSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCC[N@@H+]1CCC[C@@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001723678078 1424554047 /nfs/dbraw/zinc/55/40/47/1424554047.db2.gz BUPGBKCQFNPUGJ-AZUAARDMSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCCC[N@H+]1CCC[C@@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001723678078 1424554052 /nfs/dbraw/zinc/55/40/52/1424554052.db2.gz BUPGBKCQFNPUGJ-AZUAARDMSA-N 1 3 335.536 2.833 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N(CC[NH2+]CC1CC1)Cc1ccccc1 ZINC001724619796 1424845884 /nfs/dbraw/zinc/84/58/84/1424845884.db2.gz JOHRUFSXTQYPKC-FQEVSTJZSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](CC[NH2+]CCC3CCCC3)C2)C1 ZINC001724719078 1424938055 /nfs/dbraw/zinc/93/80/55/1424938055.db2.gz GVEIBRWXEXJXTK-HKUYNNGSSA-N 1 3 335.536 2.737 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@H](CC[NH2+]CC3CCCC3)C2)CC1 ZINC001724728746 1424950016 /nfs/dbraw/zinc/95/00/16/1424950016.db2.gz NZMAPSYGXQKQAT-LJQANCHMSA-N 1 3 335.536 2.737 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001724749519 1424978835 /nfs/dbraw/zinc/97/88/35/1424978835.db2.gz NLHYFGVFDRQMTC-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO CCCCC[NH+]1CCC2(CCN(C(=O)[C@H]3CCCN3C)CC2)CC1 ZINC001725013505 1425227049 /nfs/dbraw/zinc/22/70/49/1425227049.db2.gz ATXQRDBNOJEKRK-GOSISDBHSA-N 1 3 335.536 2.975 10 0 EFAEHO CC/C=C\CC[N@H+](CC)CC1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001725023230 1425234137 /nfs/dbraw/zinc/23/41/37/1425234137.db2.gz FNKNBHXTDCWNAM-RURPWVQCSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](CC)CC1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001725023230 1425234142 /nfs/dbraw/zinc/23/41/42/1425234142.db2.gz FNKNBHXTDCWNAM-RURPWVQCSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)CCC[NH+](C)C ZINC001725032528 1425242770 /nfs/dbraw/zinc/24/27/70/1425242770.db2.gz ISOCBGOPWGPPKE-UYAOXDASSA-N 1 3 329.488 2.666 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([C@@H]2CC[N@H+](CC=C(C)C)C2)C1 ZINC001725054976 1425264764 /nfs/dbraw/zinc/26/47/64/1425264764.db2.gz CKEDZWYYFWFPGB-RTBURBONSA-N 1 3 335.536 2.855 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]([C@@H]2CC[N@@H+](CC=C(C)C)C2)C1 ZINC001725054976 1425264772 /nfs/dbraw/zinc/26/47/72/1425264772.db2.gz CKEDZWYYFWFPGB-RTBURBONSA-N 1 3 335.536 2.855 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NC2CC(C[NH2+]C/C=C\Cl)C2)c1 ZINC001725076151 1425284589 /nfs/dbraw/zinc/28/45/89/1425284589.db2.gz NLGPZBPXQZRJQZ-DAXSKMNVSA-N 1 3 335.879 2.599 10 0 EFAEHO CC(C)=CCN(C)[C@H](C)CNC(=O)c1ccc(CC[NH+](C)C)cc1 ZINC001725183997 1425362833 /nfs/dbraw/zinc/36/28/33/1425362833.db2.gz XLFKZMCZESWOSO-QGZVFWFLSA-N 1 3 331.504 2.807 10 0 EFAEHO CCCC[C@@H](CNCC=C(Cl)Cl)NC(=O)C12CC[NH+](CC1)C2 ZINC001725232476 1425396538 /nfs/dbraw/zinc/39/65/38/1425396538.db2.gz AURLSMGMIXVUQV-ZDUSSCGKSA-N 1 3 348.318 2.666 10 0 EFAEHO Cc1cc(C[NH2+]CCC[C@H](C)NC(=O)CN2CC[C@H](C)C2)cs1 ZINC001725416404 1425560587 /nfs/dbraw/zinc/56/05/87/1425560587.db2.gz LAOBYFLQVQEUGO-GJZGRUSLSA-N 1 3 337.533 2.773 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)[C@@H]1C ZINC001725607570 1425697347 /nfs/dbraw/zinc/69/73/47/1425697347.db2.gz POKMEUIIJCXNHT-VQIMIIECSA-N 1 3 329.488 2.907 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@H]21 ZINC001725632352 1425731440 /nfs/dbraw/zinc/73/14/40/1425731440.db2.gz RKXBLHZIXGPSRE-BHIYHBOVSA-N 1 3 333.520 2.654 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H](C[NH2+]C/C=C\c2ccccc2)C1 ZINC001725653504 1425755569 /nfs/dbraw/zinc/75/55/69/1425755569.db2.gz JBYIHSKWDQLWTK-MCFDBRLESA-N 1 3 343.515 2.915 10 0 EFAEHO CC(C)CC[NH+]1CCC(NC[C@@H](C)N2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000926660260 717945953 /nfs/dbraw/zinc/94/59/53/717945953.db2.gz IOCWMCIGNZVUEJ-KURKYZTESA-N 1 3 325.541 2.584 10 0 EFAEHO FC(F)(F)c1ccn(CCN[C@@H]2CC[NH2+]C[C@@H]2C2CCCC2)n1 ZINC000925727943 715979012 /nfs/dbraw/zinc/97/90/12/715979012.db2.gz CCJWEHOELLVUER-ZIAGYGMSSA-N 1 3 330.398 2.660 10 0 EFAEHO FC(F)(F)c1ccn(CC[NH2+][C@@H]2CCNC[C@@H]2C2CCCC2)n1 ZINC000925727943 715979015 /nfs/dbraw/zinc/97/90/15/715979015.db2.gz CCJWEHOELLVUER-ZIAGYGMSSA-N 1 3 330.398 2.660 10 0 EFAEHO FC(F)(F)c1ccn(CCN[C@H]2CC[NH2+]C[C@@H]2C2CCCC2)n1 ZINC000925727941 715998167 /nfs/dbraw/zinc/99/81/67/715998167.db2.gz CCJWEHOELLVUER-KGLIPLIRSA-N 1 3 330.398 2.660 10 0 EFAEHO FC(F)(F)c1ccn(CC[NH2+][C@H]2CCNC[C@@H]2C2CCCC2)n1 ZINC000925727941 715998172 /nfs/dbraw/zinc/99/81/72/715998172.db2.gz CCJWEHOELLVUER-KGLIPLIRSA-N 1 3 330.398 2.660 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@H]1CCC[C@H](C(F)(F)F)O1 ZINC000925835236 719520004 /nfs/dbraw/zinc/52/00/04/719520004.db2.gz QYMUQCKULGMKOG-VZJVUDMVSA-N 1 3 331.382 2.999 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2[NH2+]1 ZINC000261547900 719615631 /nfs/dbraw/zinc/61/56/31/719615631.db2.gz IXLXMLUPFZXXKH-BVBHFADKSA-N 1 3 329.488 2.544 10 0 EFAEHO CC1(C)C[C@@H]([NH3+])C[C@@H](N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)C1 ZINC000925675613 720866296 /nfs/dbraw/zinc/86/62/96/720866296.db2.gz XAEUXIXTMKACGV-BFHYXJOUSA-N 1 3 349.441 2.816 10 0 EFAEHO CC[NH+](CC)Cc1ccccc1CNC[C@H]1[C@@H](C(=O)OC)C1(F)F ZINC000894158528 720971612 /nfs/dbraw/zinc/97/16/12/720971612.db2.gz SVSVRIWILPDTCU-HOTGVXAUSA-N 1 3 340.414 2.672 10 0 EFAEHO Cc1ccc(C[C@H](CO)N[C@H]2CC[NH2+]C[C@H]2C2CCCC2)cc1C ZINC000925689980 721006290 /nfs/dbraw/zinc/00/62/90/721006290.db2.gz FFCKKPNPAQFAGY-HKBOAZHASA-N 1 3 330.516 2.965 10 0 EFAEHO CC[NH+](CC)Cc1cccc(CNC[C@H]2[C@@H](C(=O)OC)C2(F)F)c1 ZINC000894191772 721190048 /nfs/dbraw/zinc/19/00/48/721190048.db2.gz PGHSVDGFYYTIPZ-HOTGVXAUSA-N 1 3 340.414 2.672 10 0 EFAEHO Cn1c2ccc(CN3CCC([C@H]4CCC[NH2+]4)CC3)cc2sc1=O ZINC000261794419 721323134 /nfs/dbraw/zinc/32/31/34/721323134.db2.gz GLANDEIZSKVUCH-OAHLLOKOSA-N 1 3 331.485 2.564 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]Cc2cnc3onc(C)c3c2)[C@@H](C)C1 ZINC000894257018 721764526 /nfs/dbraw/zinc/76/45/26/721764526.db2.gz XWQWEISTFGEARW-KBXCAEBGSA-N 1 3 346.475 2.758 10 0 EFAEHO CCN1CCN(C[C@H](C)C[NH2+][C@H](C)c2ccnn2CC2CCC2)CC1 ZINC000924953594 721864988 /nfs/dbraw/zinc/86/49/88/721864988.db2.gz RFJAMAYPIOXTFU-QZTJIDSGSA-N 1 3 347.551 2.607 10 0 EFAEHO COC(=O)[C@H]1[C@H](CNCc2ccccc2C[N@H+](C)C(C)C)C1(F)F ZINC000894385087 722676774 /nfs/dbraw/zinc/67/67/74/722676774.db2.gz PTOFYSLVDRBJGK-JKSUJKDBSA-N 1 3 340.414 2.671 10 0 EFAEHO COC(=O)[C@H]1[C@H](CNCc2ccccc2C[N@@H+](C)C(C)C)C1(F)F ZINC000894385087 722676776 /nfs/dbraw/zinc/67/67/76/722676776.db2.gz PTOFYSLVDRBJGK-JKSUJKDBSA-N 1 3 340.414 2.671 10 0 EFAEHO C[C@@H](CC[NH2+]CC1CN(C(=O)OC(C)(C)C)C1)N1CCCCC1 ZINC000894444188 722738517 /nfs/dbraw/zinc/73/85/17/722738517.db2.gz FXILIEGZIVEOTI-HNNXBMFYSA-N 1 3 325.497 2.707 10 0 EFAEHO CCN(Cc1ccc(C[NH+](C)C)cc1)C[C@H]1[C@H](C(=O)OC)C1(F)F ZINC000894764254 722841554 /nfs/dbraw/zinc/84/15/54/722841554.db2.gz GCTWBJPJYMDMIW-JKSUJKDBSA-N 1 3 340.414 2.624 10 0 EFAEHO CC(C)(C)OC(=O)N1CC(C[NH2+]C[C@@H]2CCCN(CC3CC3)C2)C1 ZINC000895360071 724072545 /nfs/dbraw/zinc/07/25/45/724072545.db2.gz MENDXIVURRPACH-INIZCTEOSA-N 1 3 337.508 2.565 10 0 EFAEHO C[C@@H](CN(C)C)[C@@H]1CCCC[N@@H+]1CC1CN(C(=O)OC(C)(C)C)C1 ZINC000895377578 724088078 /nfs/dbraw/zinc/08/80/78/724088078.db2.gz MMWZBYFAHUTASX-RDJZCZTQSA-N 1 3 339.524 2.906 10 0 EFAEHO C[C@@H](CN(C)C)[C@@H]1CCCC[N@H+]1CC1CN(C(=O)OC(C)(C)C)C1 ZINC000895377578 724088082 /nfs/dbraw/zinc/08/80/82/724088082.db2.gz MMWZBYFAHUTASX-RDJZCZTQSA-N 1 3 339.524 2.906 10 0 EFAEHO CC(C)N1CCN(C2CC[NH+](C3CC(OC(C)(C)C)C3)CC2)CC1 ZINC000341634079 724212989 /nfs/dbraw/zinc/21/29/89/724212989.db2.gz AZQDLFCANRITIC-UHFFFAOYSA-N 1 3 337.552 2.823 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC[N@@H+]1C ZINC000918861059 728936442 /nfs/dbraw/zinc/93/64/42/728936442.db2.gz IBOGFWRANDLTSZ-NEWSRXKRSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC[N@H+]1C ZINC000918861059 728936443 /nfs/dbraw/zinc/93/64/43/728936443.db2.gz IBOGFWRANDLTSZ-NEWSRXKRSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)CCN1C ZINC000913949139 725964412 /nfs/dbraw/zinc/96/44/12/725964412.db2.gz DFCRNKSHPSIOAU-APWZRJJASA-N 1 3 344.503 2.564 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@@H]1CC[N@H+](C)[C@H]1C)c1ccsc1 ZINC000914065814 725996329 /nfs/dbraw/zinc/99/63/29/725996329.db2.gz GHLOBOCRYDMLPZ-NUEKZKHPSA-N 1 3 338.521 2.523 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@@H]1CC[N@@H+](C)[C@H]1C)c1ccsc1 ZINC000914065814 725996330 /nfs/dbraw/zinc/99/63/30/725996330.db2.gz GHLOBOCRYDMLPZ-NUEKZKHPSA-N 1 3 338.521 2.523 10 0 EFAEHO C[C@@H](NC(=O)c1ccc(NC2=NCCC2)cc1)C1=CC[N@H+](C)CC1 ZINC000907284541 726907525 /nfs/dbraw/zinc/90/75/25/726907525.db2.gz MQRZUNGVOIGJAM-CQSZACIVSA-N 1 3 326.444 2.671 10 0 EFAEHO C[C@@H](NC(=O)c1ccc(NC2=NCCC2)cc1)C1=CC[N@@H+](C)CC1 ZINC000907284541 726907527 /nfs/dbraw/zinc/90/75/27/726907527.db2.gz MQRZUNGVOIGJAM-CQSZACIVSA-N 1 3 326.444 2.671 10 0 EFAEHO CN(CC1([NH+](C)C)CCC1)C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000907614556 726982792 /nfs/dbraw/zinc/98/27/92/726982792.db2.gz OZPCCMDTUOGMIK-UHFFFAOYSA-N 1 3 328.460 2.847 10 0 EFAEHO CCN(C(=O)c1ccc(NC2=NCCC2)cc1)[C@@H]1CC[N@H+](CC)C1 ZINC000912402145 727706123 /nfs/dbraw/zinc/70/61/23/727706123.db2.gz ZMZHROKAHJPJFI-QGZVFWFLSA-N 1 3 328.460 2.847 10 0 EFAEHO CCN(C(=O)c1ccc(NC2=NCCC2)cc1)[C@@H]1CC[N@@H+](CC)C1 ZINC000912402145 727706125 /nfs/dbraw/zinc/70/61/25/727706125.db2.gz ZMZHROKAHJPJFI-QGZVFWFLSA-N 1 3 328.460 2.847 10 0 EFAEHO C[NH+]1C[C@@]2(C)CN(C(=O)c3ccc(NC4=NCCC4)cc3)C[C@]2(C)C1 ZINC000913273677 727811686 /nfs/dbraw/zinc/81/16/86/727811686.db2.gz GNCNPARAFDASGM-PMACEKPBSA-N 1 3 340.471 2.705 10 0 EFAEHO C[NH+](C)C1(C)CCN(C(=O)[C@@H]2CCCN2Cc2ccccc2)CC1 ZINC000913398741 727832195 /nfs/dbraw/zinc/83/21/95/727832195.db2.gz ONBMGNCMNYVBRG-SFHVURJKSA-N 1 3 329.488 2.594 10 0 EFAEHO COC[C@H]1CN(Cc2ccc(Cl)c(F)c2)CC12CC[NH2+]CC2 ZINC000169789802 728404058 /nfs/dbraw/zinc/40/40/58/728404058.db2.gz LHRRYIXXRXFCHE-CQSZACIVSA-N 1 3 326.843 2.927 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CCC2=CCCCC2)CC1 ZINC001569431879 1085200679 /nfs/dbraw/zinc/20/06/79/1085200679.db2.gz GRLOXRSADSRCCL-IRXDYDNUSA-N 1 3 333.520 2.988 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CCC2(C1)CCN(C/C=C\Cl)CC2 ZINC001569471046 1085269860 /nfs/dbraw/zinc/26/98/60/1085269860.db2.gz QJXSKOIUTJTQRT-YHYXMXQVSA-N 1 3 341.927 2.785 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H]2C[NH2+]CCCc2ccccc2)C1 ZINC001569554908 1085370782 /nfs/dbraw/zinc/37/07/82/1085370782.db2.gz CVCGINIALNCXDX-ICSRJNTNSA-N 1 3 343.515 2.542 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC[C@@H]2C[NH2+]CCC2CC2)C1 ZINC001569556279 1085372643 /nfs/dbraw/zinc/37/26/43/1085372643.db2.gz ZNDPBYJMDVWBTF-VQIMIIECSA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCC[C@H]2C[NH2+]CCC2CC2)C1 ZINC001569556274 1085373017 /nfs/dbraw/zinc/37/30/17/1085373017.db2.gz ZNDPBYJMDVWBTF-LPHOPBHVSA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)(C(=O)N[C@@H](C[NH2+]C/C=C/Cl)C1CCCC1)N1CCCC1 ZINC001569607980 1085434913 /nfs/dbraw/zinc/43/49/13/1085434913.db2.gz YIWASCYTNDICQW-JCVNQNCUSA-N 1 3 341.927 2.878 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@]2(C1)CCCCN(C(=O)CN(C)C(C)C)C2 ZINC001569623849 1085452138 /nfs/dbraw/zinc/45/21/38/1085452138.db2.gz BPOAXIDYHKLAMB-FQEVSTJZSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@]2(C1)CCCCN(C(=O)CN(C)C(C)C)C2 ZINC001569623849 1085452145 /nfs/dbraw/zinc/45/21/45/1085452145.db2.gz BPOAXIDYHKLAMB-FQEVSTJZSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@@H]([NH2+]CCCC1CCCC1)[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001569824782 1085644850 /nfs/dbraw/zinc/64/48/50/1085644850.db2.gz UCPFULJCBRERDD-MJGOQNOKSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H]1CN(C(=O)Cc2c[nH]cn2)C[C@H]1C[NH2+]CCCC1CCCC1 ZINC001569849015 1085672360 /nfs/dbraw/zinc/67/23/60/1085672360.db2.gz RYYKJTISYZBYSX-DOTOQJQBSA-N 1 3 332.492 2.607 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@H]2CN(C(=O)C(C)(C)N3CCCCC3)C[C@H]2C1 ZINC001569875376 1085705477 /nfs/dbraw/zinc/70/54/77/1085705477.db2.gz BJJRQMPXHNNDMP-QCUQMOABSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@H]2CN(C(=O)C(C)(C)N3CCCCC3)C[C@H]2C1 ZINC001569875376 1085705489 /nfs/dbraw/zinc/70/54/89/1085705489.db2.gz BJJRQMPXHNNDMP-QCUQMOABSA-N 1 3 347.547 2.997 10 0 EFAEHO CCCCCC[N@H+]1C[C@H]2CN(C(=O)CN(C)CC(C)(C)C)C[C@H]2C1 ZINC001569880687 1085714276 /nfs/dbraw/zinc/71/42/76/1085714276.db2.gz YKACCBKUFOJQGW-HDICACEKSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCCCC[N@@H+]1C[C@H]2CN(C(=O)CN(C)CC(C)(C)C)C[C@H]2C1 ZINC001569880687 1085714280 /nfs/dbraw/zinc/71/42/80/1085714280.db2.gz YKACCBKUFOJQGW-HDICACEKSA-N 1 3 337.552 2.935 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H](CC[NH2+]CCCC3CCC3)C2)CCC1 ZINC001569983847 1085817686 /nfs/dbraw/zinc/81/76/86/1085817686.db2.gz KHUKTDSGPOSNBF-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001570005826 1085848491 /nfs/dbraw/zinc/84/84/91/1085848491.db2.gz NZGGJEQTHGVRJD-RTBURBONSA-N 1 3 343.515 2.665 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CC[C@H](CC[NH2+]CCC2CCCCC2)C1 ZINC001570006574 1085850193 /nfs/dbraw/zinc/85/01/93/1085850193.db2.gz ZRHPQTSNKPTXDF-KRWDZBQOSA-N 1 3 332.492 2.751 10 0 EFAEHO CN(CC(=O)N[C@H]1CCC[N@H+](CCCCCF)CC1)C1CCC1 ZINC001570177949 1086016924 /nfs/dbraw/zinc/01/69/24/1086016924.db2.gz WASWTWHIGSABIZ-INIZCTEOSA-N 1 3 327.488 2.581 10 0 EFAEHO CN(CC(=O)N[C@H]1CCC[N@@H+](CCCCCF)CC1)C1CCC1 ZINC001570177949 1086016938 /nfs/dbraw/zinc/01/69/38/1086016938.db2.gz WASWTWHIGSABIZ-INIZCTEOSA-N 1 3 327.488 2.581 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC(C)([NH2+]CCCc2ccsc2)CC1 ZINC001570377656 1086180403 /nfs/dbraw/zinc/18/04/03/1086180403.db2.gz BTCQPHCNXFKZBV-QGZVFWFLSA-N 1 3 349.544 2.746 10 0 EFAEHO CC[C@@H](C(=O)N1CCC(C)([NH2+]CCCc2ccccc2)CC1)N(C)C ZINC001570381074 1086183765 /nfs/dbraw/zinc/18/37/65/1086183765.db2.gz UYYILWMSAOHSFW-IBGZPJMESA-N 1 3 345.531 2.930 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC1CC(C[NH2+]CC=C(Cl)Cl)C1 ZINC001570582528 1086380321 /nfs/dbraw/zinc/38/03/21/1086380321.db2.gz MBEJDIPNBDVAND-JXQTWKCFSA-N 1 3 348.318 2.664 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N(C)CC(C)(C)C[NH2+]C/C=C/Cl ZINC001570674248 1086453280 /nfs/dbraw/zinc/45/32/80/1086453280.db2.gz VYDGAYODNGCHNT-LOWQCSRCSA-N 1 3 329.916 2.686 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)C1C[NH+](CCC2=CCCCC2)C1 ZINC001570843280 1086561742 /nfs/dbraw/zinc/56/17/42/1086561742.db2.gz FQIXSDLBFUBFGG-MRXNPFEDSA-N 1 3 333.520 2.798 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@H]2CN(CC3=CCCCC3)CC2(C)C)CC1 ZINC001570901875 1086602636 /nfs/dbraw/zinc/60/26/36/1086602636.db2.gz IHEXEURXDZCCAP-KRWDZBQOSA-N 1 3 333.520 2.655 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1C[C@H](C[NH2+]CCCC2CCC2)C1 ZINC001571197504 1086675173 /nfs/dbraw/zinc/67/51/73/1086675173.db2.gz BXJIPGJSWSAKLN-PSBWJHGTSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@H](C[NH2+]CCCC2CCC2)C1 ZINC001571197505 1086675337 /nfs/dbraw/zinc/67/53/37/1086675337.db2.gz BXJIPGJSWSAKLN-YOQCTACHSA-N 1 3 335.536 2.924 10 0 EFAEHO CN(C)C1(C(=O)N(C)[C@@H](C[NH2+]CCc2ccccc2)C2CC2)CCC1 ZINC001571361229 1086756255 /nfs/dbraw/zinc/75/62/55/1086756255.db2.gz JXVVGTZKKLIUSJ-IBGZPJMESA-N 1 3 343.515 2.540 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CCCCCF)CN1C(=O)CN(C)CC(C)(C)C ZINC001571487590 1086875483 /nfs/dbraw/zinc/87/54/83/1086875483.db2.gz UPXCXLQILFELGB-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C[NH2+]CCCF)C(C)(C)C)N1CCCC1 ZINC001571639305 1087009905 /nfs/dbraw/zinc/00/99/05/1087009905.db2.gz LKOQZESPHZXFPK-CVEARBPZSA-N 1 3 329.504 2.587 10 0 EFAEHO Cc1cccc(CN2CC=C(CNC(=O)C3(C[NH+](C)C)CC3)CC2)c1 ZINC001571694133 1087061517 /nfs/dbraw/zinc/06/15/17/1087061517.db2.gz YSXFJBLKIDYLCL-UHFFFAOYSA-N 1 3 341.499 2.585 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@H+](CC2CCC(C)CC2)CC1)N(C)C ZINC001571698421 1087067457 /nfs/dbraw/zinc/06/74/57/1087067457.db2.gz GHYHFHASGGFAMW-KVZIAJEVSA-N 1 3 335.536 2.901 10 0 EFAEHO CC[C@@H](C(=O)NCC1=CC[N@@H+](CC2CCC(C)CC2)CC1)N(C)C ZINC001571698421 1087067464 /nfs/dbraw/zinc/06/74/64/1087067464.db2.gz GHYHFHASGGFAMW-KVZIAJEVSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1=CC[N@H+](CCc2ccccc2)CC1)N(C)C ZINC001571698716 1087069998 /nfs/dbraw/zinc/06/99/98/1087069998.db2.gz OUENJAHSWKKCKN-HXUWFJFHSA-N 1 3 343.515 2.564 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1=CC[N@@H+](CCc2ccccc2)CC1)N(C)C ZINC001571698716 1087070003 /nfs/dbraw/zinc/07/00/03/1087070003.db2.gz OUENJAHSWKKCKN-HXUWFJFHSA-N 1 3 343.515 2.564 10 0 EFAEHO C[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1=CCCCC1 ZINC001266971673 1092220968 /nfs/dbraw/zinc/22/09/68/1092220968.db2.gz NYTSWSFSOMXOOJ-BEFAXECRSA-N 1 3 339.499 2.794 10 0 EFAEHO CC[N@H+](CCCNC(=O)C1(N(C)C)CCC1)Cc1cccc(F)c1 ZINC001649437021 1092460460 /nfs/dbraw/zinc/46/04/60/1092460460.db2.gz KUCQNFAYNOIJEF-UHFFFAOYSA-N 1 3 335.467 2.638 10 0 EFAEHO CC[N@@H+](CCCNC(=O)C1(N(C)C)CCC1)Cc1cccc(F)c1 ZINC001649437021 1092460465 /nfs/dbraw/zinc/46/04/65/1092460465.db2.gz KUCQNFAYNOIJEF-UHFFFAOYSA-N 1 3 335.467 2.638 10 0 EFAEHO C[C@H](CCNC/C(Cl)=C/Cl)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001649450926 1092478836 /nfs/dbraw/zinc/47/88/36/1092478836.db2.gz PONALZOCRJNLLG-YGYTWAPGSA-N 1 3 336.307 2.664 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[NH2+]CC/C=C/c2ccccc2)C1)N(C)C ZINC001267067093 1092522894 /nfs/dbraw/zinc/52/28/94/1092522894.db2.gz NHCQFPPYFIEMRB-AJAZOWGGSA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](C[NH2+]CC/C=C\c2ccccc2)C1)N(C)C ZINC001267067095 1092523760 /nfs/dbraw/zinc/52/37/60/1092523760.db2.gz NHCQFPPYFIEMRB-JDBYYAOJSA-N 1 3 343.515 2.868 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@H]1CCN(C(=O)[C@H](CC)N(C)C)C1 ZINC001267068097 1092528079 /nfs/dbraw/zinc/52/80/79/1092528079.db2.gz VTGFJPWKHAQJIP-XLIONFOSSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[NH2+]C[C@@H]1CCCN1C(=O)[C@@H](CC)N(C)C ZINC001671367899 1092820793 /nfs/dbraw/zinc/82/07/93/1092820793.db2.gz AIULIVOOKVLNLX-VQTJNVASSA-N 1 3 345.531 2.712 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1CCC(F)(F)F)N(C)C ZINC001267175305 1093070065 /nfs/dbraw/zinc/07/00/65/1093070065.db2.gz RTGBRDRELAZAAZ-KGLIPLIRSA-N 1 3 337.430 2.640 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@@H]1CCC[N@H+]1CCC(F)(F)F)N(C)C ZINC001267175305 1093070074 /nfs/dbraw/zinc/07/00/74/1093070074.db2.gz RTGBRDRELAZAAZ-KGLIPLIRSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCCC[C@@H]1CCC[N@@H+]1CCCF ZINC001267178451 1093088326 /nfs/dbraw/zinc/08/83/26/1093088326.db2.gz XKMUVGLKKLCQPG-QZTJIDSGSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCCC[C@@H]1CCC[N@H+]1CCCF ZINC001267178451 1093088333 /nfs/dbraw/zinc/08/83/33/1093088333.db2.gz XKMUVGLKKLCQPG-QZTJIDSGSA-N 1 3 341.515 2.970 10 0 EFAEHO CCCCC[NH2+][C@@H](C)C1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001267201381 1093177337 /nfs/dbraw/zinc/17/73/37/1093177337.db2.gz NHUGYXJDGGXMCZ-FUHWJXTLSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[N@H+]1CC=C(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001279635926 1093490962 /nfs/dbraw/zinc/49/09/62/1093490962.db2.gz FEIFKRXUFMBZSF-LJQANCHMSA-N 1 3 339.499 2.603 10 0 EFAEHO CC(C)C[N@@H+]1CC=C(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001279635926 1093490966 /nfs/dbraw/zinc/49/09/66/1093490966.db2.gz FEIFKRXUFMBZSF-LJQANCHMSA-N 1 3 339.499 2.603 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+]CCN(C)C(=O)CN(C)C1CCC1 ZINC001267384555 1094442295 /nfs/dbraw/zinc/44/22/95/1094442295.db2.gz XBJKOZYISYURHQ-UHFFFAOYSA-N 1 3 346.519 2.546 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C[N@H+](C)CC2CC(C)(C)C2)CC1 ZINC001481520072 1095087111 /nfs/dbraw/zinc/08/71/11/1095087111.db2.gz BHCFINUKZGCWDY-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C[N@@H+](C)CC2CC(C)(C)C2)CC1 ZINC001481520072 1095087124 /nfs/dbraw/zinc/08/71/24/1095087124.db2.gz BHCFINUKZGCWDY-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(CCNC(=O)C[C@H]1CC[N@H+](C)C1)C1CC1 ZINC001481194227 1095240094 /nfs/dbraw/zinc/24/00/94/1095240094.db2.gz DGKAEKQGGRHOJH-JKSUJKDBSA-N 1 3 347.478 2.809 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(CCNC(=O)C[C@H]1CC[N@@H+](C)C1)C1CC1 ZINC001481194227 1095240110 /nfs/dbraw/zinc/24/01/10/1095240110.db2.gz DGKAEKQGGRHOJH-JKSUJKDBSA-N 1 3 347.478 2.809 10 0 EFAEHO CCN1CC[C@H](C[NH2+]CCC2CCN(C(=O)OC(C)(C)C)CC2)C1 ZINC000695194387 1095267998 /nfs/dbraw/zinc/26/79/98/1095267998.db2.gz XJULXHQAZVVGJC-QGZVFWFLSA-N 1 3 339.524 2.955 10 0 EFAEHO C[C@@H](C[NH2+]CC[C@@H]1CCc2ccccc21)N(C)C(=O)CN1CCCC1 ZINC001268099023 1095350694 /nfs/dbraw/zinc/35/06/94/1095350694.db2.gz BEZIBUVWFBOFPU-HKUYNNGSSA-N 1 3 343.515 2.639 10 0 EFAEHO CCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)C1CC[NH+](C(C)C)CC1 ZINC001267713937 1095598699 /nfs/dbraw/zinc/59/86/99/1095598699.db2.gz SXBRVCYSCWFJSO-OALUTQOASA-N 1 3 335.536 2.972 10 0 EFAEHO CCN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1cccc(OC)c1 ZINC001480991909 1095684025 /nfs/dbraw/zinc/68/40/25/1095684025.db2.gz IDYCKJMYHCJLFI-UHFFFAOYSA-N 1 3 347.503 2.508 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[N@H+](C)C1)Cc1ccc(C(C)C)cc1 ZINC001481016742 1095865472 /nfs/dbraw/zinc/86/54/72/1095865472.db2.gz RJIDDWPRUBQQCW-LJQANCHMSA-N 1 3 331.504 2.700 10 0 EFAEHO CCN(CCNC(=O)[C@@H]1CC[N@@H+](C)C1)Cc1ccc(C(C)C)cc1 ZINC001481016742 1095865491 /nfs/dbraw/zinc/86/54/91/1095865491.db2.gz RJIDDWPRUBQQCW-LJQANCHMSA-N 1 3 331.504 2.700 10 0 EFAEHO Cc1cc(C)cc(CN2CC(CNC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001481630645 1096012631 /nfs/dbraw/zinc/01/26/31/1096012631.db2.gz MOYHITSUBMXYMC-HXUWFJFHSA-N 1 3 343.515 2.726 10 0 EFAEHO Cc1cc(C)cc(CN2CC(CNC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001481630645 1096012643 /nfs/dbraw/zinc/01/26/43/1096012643.db2.gz MOYHITSUBMXYMC-HXUWFJFHSA-N 1 3 343.515 2.726 10 0 EFAEHO CC(C)=CC[NH2+]C1CC(N(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001279288798 1096105892 /nfs/dbraw/zinc/10/58/92/1096105892.db2.gz ZLPVSWKNHVDQFK-RJYAGPCLSA-N 1 3 339.499 2.744 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1CCC[N@@H+]1CCCCCF ZINC001481041171 1096123755 /nfs/dbraw/zinc/12/37/55/1096123755.db2.gz ZPBPEAIXVKSPQN-IRXDYDNUSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1CCC[N@H+]1CCCCCF ZINC001481041171 1096123756 /nfs/dbraw/zinc/12/37/56/1096123756.db2.gz ZPBPEAIXVKSPQN-IRXDYDNUSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]CCc1ccccc1 ZINC001268368649 1096402872 /nfs/dbraw/zinc/40/28/72/1096402872.db2.gz ZWDUQQUDJOVANN-IEBWSBKVSA-N 1 3 331.504 2.586 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H](C)NC(=O)CN(C)C2CCC2)c(C)c1 ZINC001268371866 1096411661 /nfs/dbraw/zinc/41/16/61/1096411661.db2.gz FRXRGLJEFQCDBK-KRWDZBQOSA-N 1 3 331.504 2.772 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001268375147 1096423754 /nfs/dbraw/zinc/42/37/54/1096423754.db2.gz NFDPBIPCFRPGFY-XJKSGUPXSA-N 1 3 325.884 2.665 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cc(F)ccc1F)N(C)C ZINC001268398541 1096489119 /nfs/dbraw/zinc/48/91/19/1096489119.db2.gz LMKAULANJFKVBF-SUMWQHHRSA-N 1 3 341.446 2.535 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccccc1Cl)NC(=O)CN1CC[C@@H](C)C1 ZINC001268399710 1096492787 /nfs/dbraw/zinc/49/27/87/1096492787.db2.gz KBHIIHFRRQFKSS-HUUCEWRRSA-N 1 3 337.895 2.666 10 0 EFAEHO CCCCC[NH2+]CC[C@@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001268399772 1096492828 /nfs/dbraw/zinc/49/28/28/1096492828.db2.gz LKAWQFLSYOJFFZ-QAPCUYQASA-N 1 3 329.504 2.874 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+]1CC[C@@H](N(C)C(=O)C(C)(C)c2c[nH]cn2)C1 ZINC001481746208 1096502687 /nfs/dbraw/zinc/50/26/87/1096502687.db2.gz BPYDOIPXZHFJLI-HZPDHXFCSA-N 1 3 334.508 2.902 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+]1CC[C@@H](N(C)C(=O)C(C)(C)c2c[nH]cn2)C1 ZINC001481746208 1096502696 /nfs/dbraw/zinc/50/26/96/1096502696.db2.gz BPYDOIPXZHFJLI-HZPDHXFCSA-N 1 3 334.508 2.902 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001268426082 1096579837 /nfs/dbraw/zinc/57/98/37/1096579837.db2.gz JSTLEZYLHZLDSA-CYBMUJFWSA-N 1 3 343.874 2.804 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CC[NH2+]Cc1cccc(C)c1 ZINC001268425142 1096583119 /nfs/dbraw/zinc/58/31/19/1096583119.db2.gz CNCRFQZUNPLUPE-MJGOQNOKSA-N 1 3 331.504 2.854 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]Cc1cc(C)ccc1F ZINC001268425185 1096583593 /nfs/dbraw/zinc/58/35/93/1096583593.db2.gz DAKXDBYWDFCGRK-VQIMIIECSA-N 1 3 349.494 2.993 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC(C)(C)C[NH2+]CC[C@@H](C)F ZINC001282334781 1096590216 /nfs/dbraw/zinc/59/02/16/1096590216.db2.gz ILSFTMZBRGKYFW-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCC[N@@H+]1C(C)C)NCC=C(Cl)Cl ZINC001481810358 1096723067 /nfs/dbraw/zinc/72/30/67/1096723067.db2.gz GACVEWMAFTWKHU-CHWSQXEVSA-N 1 3 336.307 2.663 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCC[N@H+]1C(C)C)NCC=C(Cl)Cl ZINC001481810358 1096723076 /nfs/dbraw/zinc/72/30/76/1096723076.db2.gz GACVEWMAFTWKHU-CHWSQXEVSA-N 1 3 336.307 2.663 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cc(C)ccc1C ZINC001481850675 1096794047 /nfs/dbraw/zinc/79/40/47/1096794047.db2.gz NTODSHSHNKIYRD-VQIMIIECSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cc(C)ccc1C ZINC001481850673 1096794094 /nfs/dbraw/zinc/79/40/94/1096794094.db2.gz NTODSHSHNKIYRD-LPHOPBHVSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H](C(C)C)[NH+]1CCCC1)NCc1ccccc1F ZINC001481882205 1096853395 /nfs/dbraw/zinc/85/33/95/1096853395.db2.gz PQKCPQHGEODEQQ-HKUYNNGSSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](C(C)C)[NH+]1CCCC1)NCc1ccccc1F ZINC001481882206 1096853649 /nfs/dbraw/zinc/85/36/49/1096853649.db2.gz PQKCPQHGEODEQQ-IEBWSBKVSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@H](C(=O)NC1(C[NH2+]CCc2ccccc2)CCCC1)N(C)C ZINC001481900326 1096893885 /nfs/dbraw/zinc/89/38/85/1096893885.db2.gz UWXGLCNJKNYHHD-GOSISDBHSA-N 1 3 331.504 2.588 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)NC2(CNCc3ccccc3F)CCCC2)C1 ZINC001481910639 1096911250 /nfs/dbraw/zinc/91/12/50/1096911250.db2.gz ULZRJQFPTOOCII-INIZCTEOSA-N 1 3 347.478 2.686 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)NC2(CNCc3ccccc3F)CCCC2)C1 ZINC001481910639 1096911255 /nfs/dbraw/zinc/91/12/55/1096911255.db2.gz ULZRJQFPTOOCII-INIZCTEOSA-N 1 3 347.478 2.686 10 0 EFAEHO CCN(CCNCc1ccsc1)C(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001268491163 1096959111 /nfs/dbraw/zinc/95/91/11/1096959111.db2.gz LIQOVKARJSRXLW-IRXDYDNUSA-N 1 3 337.533 2.807 10 0 EFAEHO CCN(CC[NH2+]Cc1c(C)cccc1C)C(=O)[C@@H](C(C)C)N(C)C ZINC001268493759 1096966794 /nfs/dbraw/zinc/96/67/94/1096966794.db2.gz SUVNMKZCADDEDB-LJQANCHMSA-N 1 3 333.520 2.828 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@](C)(CNCc1ccccc1Cl)C1CC1 ZINC001481939599 1096970025 /nfs/dbraw/zinc/97/00/25/1096970025.db2.gz ABQPYOTXLRSTTJ-SFHVURJKSA-N 1 3 337.895 2.666 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)cc1)C(=O)[C@H]1CCCCN1CC ZINC001268499886 1097008860 /nfs/dbraw/zinc/00/88/60/1097008860.db2.gz RTFJUFIDCLJYLQ-LJQANCHMSA-N 1 3 331.504 2.808 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@@H](CC[NH2+]CCc2ccccc2)C1)N(C)C ZINC001481987638 1097044203 /nfs/dbraw/zinc/04/42/03/1097044203.db2.gz JYIFQLXMPMYDEO-PMACEKPBSA-N 1 3 345.531 2.788 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@H](CC[NH2+]CC2CCCCC2)C1 ZINC001481986381 1097049071 /nfs/dbraw/zinc/04/90/71/1097049071.db2.gz NLTLUXWTGKBMBX-QGZVFWFLSA-N 1 3 332.492 2.751 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@@H](CC[NH2+]CC2CCCCC2)C1 ZINC001481986380 1097049715 /nfs/dbraw/zinc/04/97/15/1097049715.db2.gz NLTLUXWTGKBMBX-KRWDZBQOSA-N 1 3 332.492 2.751 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@H](CC[NH2+]C/C=C/Cl)C2)CC1 ZINC001481989647 1097053958 /nfs/dbraw/zinc/05/39/58/1097053958.db2.gz QKLRUSTUUPUQKX-DLGAGEGBSA-N 1 3 341.927 2.689 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001482056691 1097194207 /nfs/dbraw/zinc/19/42/07/1097194207.db2.gz ZRZNNUDMELUNAL-ZIAGYGMSSA-N 1 3 348.318 2.759 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N1CCC[C@@H]1CNCC=C(Cl)Cl ZINC001482056691 1097194210 /nfs/dbraw/zinc/19/42/10/1097194210.db2.gz ZRZNNUDMELUNAL-ZIAGYGMSSA-N 1 3 348.318 2.759 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)C[NH2+]CC1CC2(CCC2)C1 ZINC001482101712 1097262300 /nfs/dbraw/zinc/26/23/00/1097262300.db2.gz PCTWQZUCWHMRSQ-WMZOPIPTSA-N 1 3 335.536 2.781 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]Cc1ccc(C2CC2)cc1 ZINC001482106873 1097267625 /nfs/dbraw/zinc/26/76/25/1097267625.db2.gz CXEXWAUZTGGUHS-INIZCTEOSA-N 1 3 343.515 2.890 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]CC[C@@H]1CCCC1(F)F ZINC001482107160 1097268879 /nfs/dbraw/zinc/26/88/79/1097268879.db2.gz FYBZEZNZTFHSEE-CABCVRRESA-N 1 3 345.478 2.638 10 0 EFAEHO C[NH+](C)CCCC(=O)NC/C=C/CN[C@H]1CCc2ccc(Cl)cc21 ZINC001268583537 1097288145 /nfs/dbraw/zinc/28/81/45/1097288145.db2.gz FTAGINPHBCXIRZ-WHLIDYPQSA-N 1 3 349.906 2.931 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C/C[NH2+][C@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001268593291 1097329307 /nfs/dbraw/zinc/32/93/07/1097329307.db2.gz UBTPSUDKXLDZTK-ZBKUBXTQSA-N 1 3 349.906 2.930 10 0 EFAEHO CCCCC[NH2+]C[C@@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001482141449 1097396245 /nfs/dbraw/zinc/39/62/45/1097396245.db2.gz DDPNJDUMVBKXKC-QAPCUYQASA-N 1 3 329.504 2.731 10 0 EFAEHO CCCCC[NH2+]C[C@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001482141452 1097396431 /nfs/dbraw/zinc/39/64/31/1097396431.db2.gz DDPNJDUMVBKXKC-YJBOKZPZSA-N 1 3 329.504 2.731 10 0 EFAEHO O=C(NC/C=C\CNCc1ccsc1)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001268602588 1097450385 /nfs/dbraw/zinc/45/03/85/1097450385.db2.gz MDRZNXODFZVRRY-XFKNGNQWSA-N 1 3 333.501 2.527 10 0 EFAEHO O=C(NC/C=C\CNCc1ccsc1)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001268602588 1097450388 /nfs/dbraw/zinc/45/03/88/1097450388.db2.gz MDRZNXODFZVRRY-XFKNGNQWSA-N 1 3 333.501 2.527 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/CNCc1ccc(Cl)s1)[NH+](C)C ZINC001268618465 1097469140 /nfs/dbraw/zinc/46/91/40/1097469140.db2.gz WGRMUBLIIWJQPW-LLYBFZRZSA-N 1 3 343.924 2.750 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C/C=C/CNC(=O)CN(C)C(C)C)c1 ZINC001268630888 1097485087 /nfs/dbraw/zinc/48/50/87/1097485087.db2.gz RYXHDQHWKBKVLZ-DVBCCOPCSA-N 1 3 331.504 2.967 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC/C=C\C[NH2+]CC1CCC(C)CC1 ZINC001268630867 1097485338 /nfs/dbraw/zinc/48/53/38/1097485338.db2.gz RGQWBCSXOZRMMJ-MZCYRKOTSA-N 1 3 335.536 2.949 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)N[C@@H](C)CNCC=C(Cl)Cl ZINC001268706354 1097557260 /nfs/dbraw/zinc/55/72/60/1097557260.db2.gz FTJSCUBRTITESN-QWHCGFSZSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)N[C@@H](C)CNCC=C(Cl)Cl ZINC001268706354 1097557265 /nfs/dbraw/zinc/55/72/65/1097557265.db2.gz FTJSCUBRTITESN-QWHCGFSZSA-N 1 3 336.307 2.663 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]CCCN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001268797152 1097646511 /nfs/dbraw/zinc/64/65/11/1097646511.db2.gz GWEBEUAGVDAVHW-KRWDZBQOSA-N 1 3 331.504 2.978 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001268801144 1097648224 /nfs/dbraw/zinc/64/82/24/1097648224.db2.gz XMMPNTSQSURTSS-MRXNPFEDSA-N 1 3 325.884 2.618 10 0 EFAEHO CN(CC(=O)N(C)CCC[NH2+]CC1CC(C)(C)C1)CC(C)(C)C ZINC001268848029 1097682669 /nfs/dbraw/zinc/68/26/69/1097682669.db2.gz QKTSQTDOTWRAOC-UHFFFAOYSA-N 1 3 325.541 2.839 10 0 EFAEHO CN(CCC[NH2+][C@@H]1CCCc2ccc(F)cc21)C(=O)Cc1c[nH]cn1 ZINC001268861619 1097690881 /nfs/dbraw/zinc/69/08/81/1097690881.db2.gz YYCGFHNFJXJMJC-GOSISDBHSA-N 1 3 344.434 2.607 10 0 EFAEHO CC1CCC(C[NH2+]CCCN(C)C(=O)CN2CCC(C)CC2)CC1 ZINC001268894349 1097706419 /nfs/dbraw/zinc/70/64/19/1097706419.db2.gz WULJDXVXIVPPHO-UHFFFAOYSA-N 1 3 337.552 2.983 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+][C@H]1CCc2ccc(F)cc21)N(C)C ZINC001268915007 1097723334 /nfs/dbraw/zinc/72/33/34/1097723334.db2.gz HHSABMBFVCBBOW-ZWKOTPCHSA-N 1 3 335.467 2.591 10 0 EFAEHO CN(C(=O)C1(C[NH+](C)C)CC1)[C@@H]1CCN(CCCCC(F)(F)F)C1 ZINC001269268565 1098001608 /nfs/dbraw/zinc/00/16/08/1098001608.db2.gz NLEOEAIEPWBEIE-CQSZACIVSA-N 1 3 349.441 2.594 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)NCC2([NH2+]CCCF)CCCC2)C1 ZINC001482230299 1098234666 /nfs/dbraw/zinc/23/46/66/1098234666.db2.gz PGEVRXQQBDAZJA-GOSISDBHSA-N 1 3 345.478 2.577 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CCC(F)(F)F)CCCC1 ZINC001482238604 1098378346 /nfs/dbraw/zinc/37/83/46/1098378346.db2.gz USVNZYFCDBGTKL-KBPBESRZSA-N 1 3 349.441 2.830 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CCC(F)(F)F)CCCC1 ZINC001482238605 1098378479 /nfs/dbraw/zinc/37/84/79/1098378479.db2.gz USVNZYFCDBGTKL-OKILXGFUSA-N 1 3 349.441 2.830 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC2(C[NH+](CCCCCF)C2)CC1)N(C)C ZINC001482245248 1098467067 /nfs/dbraw/zinc/46/70/67/1098467067.db2.gz UNYNRAWZXZVPCA-QGZVFWFLSA-N 1 3 341.515 2.637 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCC(CC[NH2+]Cc2ccccc2F)CC1 ZINC001269838751 1098471496 /nfs/dbraw/zinc/47/14/96/1098471496.db2.gz PNLZEGPZDSVSLZ-LJQANCHMSA-N 1 3 347.478 2.638 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC(CC[NH2+]CCC2CC2)CC1 ZINC001269950394 1098544263 /nfs/dbraw/zinc/54/42/63/1098544263.db2.gz DJTUCXDMUKOXNY-LJQANCHMSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC(CC[NH2+]CC[C@H](C)F)CC1)N(C)C ZINC001267914351 1098614387 /nfs/dbraw/zinc/61/43/87/1098614387.db2.gz HAEFCSWKOZAPRB-DOTOQJQBSA-N 1 3 329.504 2.539 10 0 EFAEHO CN(CC[NH2+]CC1CCCCC1)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001481280367 1098667839 /nfs/dbraw/zinc/66/78/39/1098667839.db2.gz YKEXJKSFNGIIQB-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H]2CCCN2C(=O)[C@H](C(C)C)N(C)C)cc1 ZINC001270173240 1098762625 /nfs/dbraw/zinc/76/26/25/1098762625.db2.gz AJYGAJYYAKKWGH-UXHICEINSA-N 1 3 345.531 2.704 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@@H]2C[NH2+]CCC2=CCCCC2)CCC1 ZINC001267957704 1098894668 /nfs/dbraw/zinc/89/46/68/1098894668.db2.gz JJBBRTNBOPETBW-GOSISDBHSA-N 1 3 333.520 2.942 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H]1C[NH2+]CCc1cccs1 ZINC001267969223 1098984888 /nfs/dbraw/zinc/98/48/88/1098984888.db2.gz IJLVQGBWZSMAAG-SJLPKXTDSA-N 1 3 349.544 2.746 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)[C@H]2CCC[N@H+]2C(C)C)c1 ZINC001482284455 1099030809 /nfs/dbraw/zinc/03/08/09/1099030809.db2.gz NUUYKCCIIRVIMD-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H](C)N(C)C(=O)[C@H]2CCC[N@@H+]2C(C)C)c1 ZINC001482284455 1099030815 /nfs/dbraw/zinc/03/08/15/1099030815.db2.gz NUUYKCCIIRVIMD-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO CN(CCNCc1ccsc1)C(=O)c1ccccc1CC[NH+](C)C ZINC001481260545 1099119897 /nfs/dbraw/zinc/11/98/97/1099119897.db2.gz VHXRYDRCPNLKNP-UHFFFAOYSA-N 1 3 345.512 2.714 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]Cc1cc(C)cc(C)c1 ZINC001481319845 1099277651 /nfs/dbraw/zinc/27/76/51/1099277651.db2.gz PPTSOLFEJICYEJ-IBGZPJMESA-N 1 3 331.504 2.726 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC([C@H](C)[NH2+]C/C=C\Cl)CC1 ZINC001481344184 1099392044 /nfs/dbraw/zinc/39/20/44/1099392044.db2.gz VROPBJHBUOKIOC-BJNDTKKQSA-N 1 3 341.927 2.830 10 0 EFAEHO Cc1cccnc1CNC[C@@H](C)N(C)C(=O)[C@H](C)[NH+]1CCCCCC1 ZINC001482336380 1099666784 /nfs/dbraw/zinc/66/67/84/1099666784.db2.gz HYAPBPMKIHWPAM-MSOLQXFVSA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@H](C[NH2+][C@@H](C)c1ccccc1Cl)N(C)C(=O)CN1CCCC1 ZINC001482364237 1099843635 /nfs/dbraw/zinc/84/36/35/1099843635.db2.gz FHBMUUHDAIQPMZ-CABCVRRESA-N 1 3 337.895 2.933 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccccc1C1CC1)N(C)C(=O)CN1CCCC1 ZINC001482364556 1099845801 /nfs/dbraw/zinc/84/58/01/1099845801.db2.gz LPJWFBZQLWFWNC-MRXNPFEDSA-N 1 3 329.488 2.596 10 0 EFAEHO CC(C)C[C@@H](CNCc1ccccn1)NC(=O)[C@H]1CCC[N@@H+]1C(C)C ZINC001482384545 1099960352 /nfs/dbraw/zinc/96/03/52/1099960352.db2.gz SLXRZFMZIFDYET-RBUKOAKNSA-N 1 3 346.519 2.575 10 0 EFAEHO CC(C)C[C@@H](CNCc1ccccn1)NC(=O)[C@H]1CCC[N@H+]1C(C)C ZINC001482384545 1099960359 /nfs/dbraw/zinc/96/03/59/1099960359.db2.gz SLXRZFMZIFDYET-RBUKOAKNSA-N 1 3 346.519 2.575 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001482439856 1100233116 /nfs/dbraw/zinc/23/31/16/1100233116.db2.gz WKYSYVGNGRWYHA-IEBWSBKVSA-N 1 3 331.504 2.662 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H](C(=O)NCCCN2CCc3ccccc3C2)C1 ZINC001629877654 1100255392 /nfs/dbraw/zinc/25/53/92/1100255392.db2.gz FDDOMHQAVGXMBC-HXUWFJFHSA-N 1 3 343.515 2.671 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H](C(=O)NCCCN2CCc3ccccc3C2)C1 ZINC001629877654 1100255399 /nfs/dbraw/zinc/25/53/99/1100255399.db2.gz FDDOMHQAVGXMBC-HXUWFJFHSA-N 1 3 343.515 2.671 10 0 EFAEHO C[C@H](CNCC=C(Cl)Cl)N(C)C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001270994438 1100346859 /nfs/dbraw/zinc/34/68/59/1100346859.db2.gz FKJBZHPIYPISMW-OLZOCXBDSA-N 1 3 336.307 2.616 10 0 EFAEHO C[C@H](CNCC=C(Cl)Cl)N(C)C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001270994438 1100346864 /nfs/dbraw/zinc/34/68/64/1100346864.db2.gz FKJBZHPIYPISMW-OLZOCXBDSA-N 1 3 336.307 2.616 10 0 EFAEHO CC(C)CC[NH2+]C[C@H](C)N(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001271102039 1100480548 /nfs/dbraw/zinc/48/05/48/1100480548.db2.gz PJIMFELLHYSJAJ-YJBOKZPZSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC[C@@H]2C[NH2+]C/C=C\Cl)C1 ZINC001671346942 1101386503 /nfs/dbraw/zinc/38/65/03/1101386503.db2.gz MHJMTENOSJBCPZ-GXYHLBQZSA-N 1 3 345.890 2.532 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC[C@@H]2C[NH2+]C/C=C/Cl)C1 ZINC001671346953 1101386734 /nfs/dbraw/zinc/38/67/34/1101386734.db2.gz MHJMTENOSJBCPZ-TXDDUOMGSA-N 1 3 345.890 2.532 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001266341630 1101608724 /nfs/dbraw/zinc/60/87/24/1101608724.db2.gz LBGMDUDJBMDZHR-CRAIPNDOSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCCC[N@H+]1CC[C@@H](NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001266341630 1101608727 /nfs/dbraw/zinc/60/87/27/1101608727.db2.gz LBGMDUDJBMDZHR-CRAIPNDOSA-N 1 3 327.488 2.580 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H]1C[C@H]([NH2+]CCCc2ccccc2)C1 ZINC001266640367 1101629868 /nfs/dbraw/zinc/62/98/68/1101629868.db2.gz TZYBKOKANYWKMS-UFYCRDLUSA-N 1 3 343.515 2.730 10 0 EFAEHO CC(C)N(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1=CCCCC1 ZINC001266655722 1101684788 /nfs/dbraw/zinc/68/47/88/1101684788.db2.gz FTOAICNXZLUNPK-YQQQUEKLSA-N 1 3 333.520 2.939 10 0 EFAEHO CC(C)N(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1=CCCCC1 ZINC001266655722 1101684792 /nfs/dbraw/zinc/68/47/92/1101684792.db2.gz FTOAICNXZLUNPK-YQQQUEKLSA-N 1 3 333.520 2.939 10 0 EFAEHO CN(CCNCc1ccsc1)C(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001266702184 1101945816 /nfs/dbraw/zinc/94/58/16/1101945816.db2.gz RVLQEBAWBWSERY-QGZVFWFLSA-N 1 3 349.544 2.951 10 0 EFAEHO CN(CCNCc1ccsc1)C(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001266702184 1101945824 /nfs/dbraw/zinc/94/58/24/1101945824.db2.gz RVLQEBAWBWSERY-QGZVFWFLSA-N 1 3 349.544 2.951 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2C[C@@H]([NH2+]CCCc3ccsc3)C2)CCC1 ZINC001656138482 1101972527 /nfs/dbraw/zinc/97/25/27/1101972527.db2.gz XCLOITCLVDWEAH-CALCHBBNSA-N 1 3 349.544 2.649 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]CC3=CCCCC3)C2)C1 ZINC001656346321 1102038601 /nfs/dbraw/zinc/03/86/01/1102038601.db2.gz TWJZUXYLMCQCCL-YTQUADARSA-N 1 3 333.520 2.703 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1C[C@@H]([NH2+]CCCCC(F)(F)F)C1 ZINC001266733205 1102049693 /nfs/dbraw/zinc/04/96/93/1102049693.db2.gz PERZBXHRYJCETK-TUVASFSCSA-N 1 3 349.441 2.829 10 0 EFAEHO CC(C)c1ccc(C[N@H+](C)CCNC(=O)C2(N(C)C)CCC2)cc1 ZINC001480874066 1102064892 /nfs/dbraw/zinc/06/48/92/1102064892.db2.gz YGHKXVBGJCQILF-UHFFFAOYSA-N 1 3 331.504 2.842 10 0 EFAEHO CC(C)c1ccc(C[N@@H+](C)CCNC(=O)C2(N(C)C)CCC2)cc1 ZINC001480874066 1102064905 /nfs/dbraw/zinc/06/49/05/1102064905.db2.gz YGHKXVBGJCQILF-UHFFFAOYSA-N 1 3 331.504 2.842 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001480874620 1102106532 /nfs/dbraw/zinc/10/65/32/1102106532.db2.gz IQYLQTSAHDIWOX-IBGZPJMESA-N 1 3 331.504 2.671 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001480874620 1102106540 /nfs/dbraw/zinc/10/65/40/1102106540.db2.gz IQYLQTSAHDIWOX-IBGZPJMESA-N 1 3 331.504 2.671 10 0 EFAEHO CCCC[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN(C)CC(C)(C)C ZINC001656571137 1102124787 /nfs/dbraw/zinc/12/47/87/1102124787.db2.gz LYYLBTMWOQGXIE-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@H]1CCCCN1C(=O)Cc1c[nH]cn1 ZINC001271585822 1102148784 /nfs/dbraw/zinc/14/87/84/1102148784.db2.gz WBSSRPZDCYWIHJ-LJQANCHMSA-N 1 3 340.471 2.822 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@@H]1CC[NH2+]CCC(F)(F)F)N(C)C ZINC001271598670 1102149342 /nfs/dbraw/zinc/14/93/42/1102149342.db2.gz BTUXRXUWOIECLM-ZIAGYGMSSA-N 1 3 337.430 2.640 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)CN3CC[C@@H](C)C3)C[C@@H]2C1 ZINC001656833474 1102216455 /nfs/dbraw/zinc/21/64/55/1102216455.db2.gz RQYNDAXEPHJOFL-BNLAEDIXSA-N 1 3 347.547 2.855 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)CN3CC[C@@H](C)C3)C[C@@H]2C1 ZINC001656833474 1102216462 /nfs/dbraw/zinc/21/64/62/1102216462.db2.gz RQYNDAXEPHJOFL-BNLAEDIXSA-N 1 3 347.547 2.855 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1CCC[N@@H+]1CCCCCF)N1CCCCCC1 ZINC001266485447 1102242505 /nfs/dbraw/zinc/24/25/05/1102242505.db2.gz CCWINNIBDPSTKW-MSOLQXFVSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]1CCC[N@H+]1CCCCCF)N1CCCCCC1 ZINC001266485447 1102242517 /nfs/dbraw/zinc/24/25/17/1102242517.db2.gz CCWINNIBDPSTKW-MSOLQXFVSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H](C[NH2+]CCCC3CCC3)C2)C1 ZINC001266807495 1102292213 /nfs/dbraw/zinc/29/22/13/1102292213.db2.gz MFZDQLHDRLBJAR-PKOBYXMFSA-N 1 3 335.536 2.737 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[NH2+]CCCC(C)(C)C)C1 ZINC001266819464 1102334819 /nfs/dbraw/zinc/33/48/19/1102334819.db2.gz AOFDIZGDGCLSTH-KRWDZBQOSA-N 1 3 325.541 2.983 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C[NH2+]CCCC(C)(C)C)C1 ZINC001266819465 1102335833 /nfs/dbraw/zinc/33/58/33/1102335833.db2.gz AOFDIZGDGCLSTH-QGZVFWFLSA-N 1 3 325.541 2.983 10 0 EFAEHO CN(CCCNC(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21)Cc1ccsc1 ZINC001660190145 1102629941 /nfs/dbraw/zinc/62/99/41/1102629941.db2.gz IXOKHQKSLWJGFS-IAGOWNOFSA-N 1 3 335.517 2.703 10 0 EFAEHO CN(CCCNC(=O)[C@H]1CC[C@H]2CCCC[N@H+]21)Cc1ccsc1 ZINC001660190145 1102629948 /nfs/dbraw/zinc/62/99/48/1102629948.db2.gz IXOKHQKSLWJGFS-IAGOWNOFSA-N 1 3 335.517 2.703 10 0 EFAEHO CCc1ccc(C[NH2+]CCN(C)C(=O)CN2CCC(C)CC2)cc1 ZINC001266911156 1102675452 /nfs/dbraw/zinc/67/54/52/1102675452.db2.gz GQIWRMGXMTYSAX-UHFFFAOYSA-N 1 3 331.504 2.529 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](C)[C@H]2CCCc3ccccc32)C1 ZINC001660303992 1102678052 /nfs/dbraw/zinc/67/80/52/1102678052.db2.gz MIEZCRAHJWXVJW-XLIONFOSSA-N 1 3 343.515 2.844 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](C)[C@H]2CCCc3ccccc32)C1 ZINC001660303992 1102678055 /nfs/dbraw/zinc/67/80/55/1102678055.db2.gz MIEZCRAHJWXVJW-XLIONFOSSA-N 1 3 343.515 2.844 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](CNCC=C(Cl)Cl)C2CC2)CC[N@@H+]1C ZINC001670475254 1102703087 /nfs/dbraw/zinc/70/30/87/1102703087.db2.gz NLFYUIQOSQYSET-BFHYXJOUSA-N 1 3 348.318 2.520 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](CNCC=C(Cl)Cl)C2CC2)CC[N@H+]1C ZINC001670475254 1102703099 /nfs/dbraw/zinc/70/30/99/1102703099.db2.gz NLFYUIQOSQYSET-BFHYXJOUSA-N 1 3 348.318 2.520 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](C)CCc1ccc(Cl)cc1 ZINC001660380326 1102725474 /nfs/dbraw/zinc/72/54/74/1102725474.db2.gz UWMUNKIXCRRIFX-UHFFFAOYSA-N 1 3 348.878 2.595 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](C)CCc1ccc(Cl)cc1 ZINC001660380326 1102725485 /nfs/dbraw/zinc/72/54/85/1102725485.db2.gz UWMUNKIXCRRIFX-UHFFFAOYSA-N 1 3 348.878 2.595 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2CCN(C(=O)CCCC[NH+](C)C)C2)c1 ZINC001266562361 1102762298 /nfs/dbraw/zinc/76/22/98/1102762298.db2.gz XQBVDZXONAVTGZ-KRWDZBQOSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C[NH2+]CCC1=CCCCC1)C1CC1 ZINC001670543604 1102830253 /nfs/dbraw/zinc/83/02/53/1102830253.db2.gz CWSQYIIUQKNAEO-SFHVURJKSA-N 1 3 330.476 2.636 10 0 EFAEHO CC[N@H+](CCCNC(=O)C1(N(C)C)CCC1)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001660537656 1102834158 /nfs/dbraw/zinc/83/41/58/1102834158.db2.gz YTOPWOOKICTKJJ-KURKYZTESA-N 1 3 335.536 2.735 10 0 EFAEHO CC[N@@H+](CCCNC(=O)C1(N(C)C)CCC1)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001660537656 1102834172 /nfs/dbraw/zinc/83/41/72/1102834172.db2.gz YTOPWOOKICTKJJ-KURKYZTESA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC12CC[NH+](CCCCCF)CC2)N(C)C ZINC001661067264 1103108008 /nfs/dbraw/zinc/10/80/08/1103108008.db2.gz ZFRORVPXKNQALR-SJORKVTESA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@@H](NC[C@H](C)NC(=O)CCC[NH+](C)C)c1cccc(Cl)c1F ZINC001483260320 1103177118 /nfs/dbraw/zinc/17/71/18/1103177118.db2.gz ACWHTADVZUPNKV-QWHCGFSZSA-N 1 3 343.874 2.976 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cc2ccccc2s1)NC(=O)CN1CC[C@H](C)C1 ZINC001483266428 1103192296 /nfs/dbraw/zinc/19/22/96/1103192296.db2.gz MCFRWNJFFXBKBX-GJZGRUSLSA-N 1 3 345.512 2.837 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CCc1ccccc1 ZINC001483272065 1103207760 /nfs/dbraw/zinc/20/77/60/1103207760.db2.gz IWVMWRYJJUCFCF-HKUYNNGSSA-N 1 3 331.504 2.586 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N[C@H]2C[C@H]([NH2+]CCCCCF)C2)C1 ZINC001661473653 1103276864 /nfs/dbraw/zinc/27/68/64/1103276864.db2.gz OBRMGOJZCZQUBT-IIDMSEBBSA-N 1 3 345.478 2.576 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1cc(F)ccc1C ZINC001483297047 1103283053 /nfs/dbraw/zinc/28/30/53/1103283053.db2.gz VPKXEQPAIGKLQD-YJBOKZPZSA-N 1 3 335.467 2.603 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@@H](C[NH2+]CCCC3CCC3)C2)CCC1 ZINC001661787585 1103424963 /nfs/dbraw/zinc/42/49/63/1103424963.db2.gz BUZHEGJJSUENIS-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(OC)cc1 ZINC001483345433 1103429598 /nfs/dbraw/zinc/42/95/98/1103429598.db2.gz MFBOTGYUNNHWNG-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(OC)cc1 ZINC001483345433 1103429607 /nfs/dbraw/zinc/42/96/07/1103429607.db2.gz MFBOTGYUNNHWNG-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO CN(CC(C)(C)C[NH2+][C@@H]1CCc2ccccc21)C(=O)Cc1c[nH]cn1 ZINC001409481836 1103453552 /nfs/dbraw/zinc/45/35/52/1103453552.db2.gz BNURENRTPQFIAI-GOSISDBHSA-N 1 3 340.471 2.714 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H](C[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001661832923 1103453693 /nfs/dbraw/zinc/45/36/93/1103453693.db2.gz RPSNGFFYCPATNA-SJORKVTESA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1cccc(CN(C)C[C@H](C)NC(=O)C23CCC[NH+](CCC2)C3)c1 ZINC001483352908 1103463531 /nfs/dbraw/zinc/46/35/31/1103463531.db2.gz OYMBPFQQPFPSTR-SFHVURJKSA-N 1 3 343.515 2.808 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCCC[N@@H+]1CCCCCF)N1CCCC1 ZINC001661875746 1103481761 /nfs/dbraw/zinc/48/17/61/1103481761.db2.gz JCGZJVXVSUVUFV-KRWDZBQOSA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCCC[N@H+]1CCCCCF)N1CCCC1 ZINC001661875746 1103481764 /nfs/dbraw/zinc/48/17/64/1103481764.db2.gz JCGZJVXVSUVUFV-KRWDZBQOSA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)(C(=O)N1CCCC[C@@H]1C[NH2+]CCCF)N1CCCCC1 ZINC001661921440 1103504575 /nfs/dbraw/zinc/50/45/75/1103504575.db2.gz ANDWQQWFVYEXMB-MRXNPFEDSA-N 1 3 327.488 2.581 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1cc(F)cc(F)c1)C(C)C)N(C)C ZINC001482564886 1103537479 /nfs/dbraw/zinc/53/74/79/1103537479.db2.gz HNQMDUBZKVSDAC-IAGOWNOFSA-N 1 3 341.446 2.535 10 0 EFAEHO C[C@@H](CN(C)[C@H]1CCc2c1cccc2F)NC(=O)CCCC[NH+](C)C ZINC001483407364 1103627954 /nfs/dbraw/zinc/62/79/54/1103627954.db2.gz BLTWFAWPKCZMAX-KXBFYZLASA-N 1 3 349.494 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)Cc1cccc2cccnc21 ZINC001483421601 1103672821 /nfs/dbraw/zinc/67/28/21/1103672821.db2.gz RKUQYULCJBVTAT-INIZCTEOSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)Cc1cccc2cccnc21 ZINC001483421601 1103672826 /nfs/dbraw/zinc/67/28/26/1103672826.db2.gz RKUQYULCJBVTAT-INIZCTEOSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)Cc1cccc2cccnc21 ZINC001483421605 1103674603 /nfs/dbraw/zinc/67/46/03/1103674603.db2.gz RKUQYULCJBVTAT-MRXNPFEDSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)Cc1cccc2cccnc21 ZINC001483421605 1103674607 /nfs/dbraw/zinc/67/46/07/1103674607.db2.gz RKUQYULCJBVTAT-MRXNPFEDSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)Cc1ccc2ncccc2c1 ZINC001483422705 1103678631 /nfs/dbraw/zinc/67/86/31/1103678631.db2.gz YHNRKWHRMMUSQQ-INIZCTEOSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)Cc1ccc2ncccc2c1 ZINC001483422705 1103678634 /nfs/dbraw/zinc/67/86/34/1103678634.db2.gz YHNRKWHRMMUSQQ-INIZCTEOSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)CC[C@H]1CCCC1(F)F ZINC001483422003 1103680390 /nfs/dbraw/zinc/68/03/90/1103680390.db2.gz TZWCWUHWSMQGNI-LSDHHAIUSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC001483422003 1103680397 /nfs/dbraw/zinc/68/03/97/1103680397.db2.gz TZWCWUHWSMQGNI-LSDHHAIUSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCCC[C@H]1C[NH2+]Cc1cccc(F)c1 ZINC001483446895 1103733478 /nfs/dbraw/zinc/73/34/78/1103733478.db2.gz DGYVTUBEOALMGU-HKUYNNGSSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCCC[C@H]1C[NH2+]Cc1cccc(F)c1 ZINC001483446898 1103733944 /nfs/dbraw/zinc/73/39/44/1103733944.db2.gz DGYVTUBEOALMGU-PKOBYXMFSA-N 1 3 349.494 2.931 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CCC[NH2+][C@H]2CCc3c2cccc3F)C1 ZINC001483492820 1103826514 /nfs/dbraw/zinc/82/65/14/1103826514.db2.gz KXFVFNURHUSJPT-BEFAXECRSA-N 1 3 347.478 2.593 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1C/C=C/Cl)N(C)C ZINC001663071764 1103961521 /nfs/dbraw/zinc/96/15/21/1103961521.db2.gz IPGGRZHDAYUVJG-ZHANPKHBSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[C@@H]1CCC[N@H+]1C/C=C/Cl)N(C)C ZINC001663071764 1103961523 /nfs/dbraw/zinc/96/15/23/1103961523.db2.gz IPGGRZHDAYUVJG-ZHANPKHBSA-N 1 3 329.916 2.686 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)[C@@H](C)CNC(=O)CN(C)C2CCC2)c1 ZINC001409557873 1104225095 /nfs/dbraw/zinc/22/50/95/1104225095.db2.gz AZBYKNMCEZAIJH-HOTGVXAUSA-N 1 3 347.503 2.677 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)[C@@H](C)CNC(=O)CN(C)C2CCC2)c1 ZINC001409557873 1104225101 /nfs/dbraw/zinc/22/51/01/1104225101.db2.gz AZBYKNMCEZAIJH-HOTGVXAUSA-N 1 3 347.503 2.677 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)CCNCc1cc(C)ccc1F ZINC001663967908 1104252268 /nfs/dbraw/zinc/25/22/68/1104252268.db2.gz KRGPWOJTZKTWAD-GOSISDBHSA-N 1 3 335.467 2.557 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N(C)CCNCc1cc(C)ccc1F ZINC001663967908 1104252280 /nfs/dbraw/zinc/25/22/80/1104252280.db2.gz KRGPWOJTZKTWAD-GOSISDBHSA-N 1 3 335.467 2.557 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC001664395811 1104376468 /nfs/dbraw/zinc/37/64/68/1104376468.db2.gz WWKYNHVLQKVZJG-UHFFFAOYSA-N 1 3 346.302 2.882 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)N(C)Cc1ccccc1C1CC1 ZINC001409587684 1104377703 /nfs/dbraw/zinc/37/77/03/1104377703.db2.gz XRFAXLGFFMGYOP-GPMSIDNRSA-N 1 3 343.515 2.841 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)N(C)Cc1ccccc1C1CC1 ZINC001409587684 1104377716 /nfs/dbraw/zinc/37/77/16/1104377716.db2.gz XRFAXLGFFMGYOP-GPMSIDNRSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+]Cc1cccc2ccccc21 ZINC001664395426 1104377653 /nfs/dbraw/zinc/37/76/53/1104377653.db2.gz QNNRFRRCSAIWEL-UHFFFAOYSA-N 1 3 327.472 2.728 10 0 EFAEHO Cc1ccc(F)c(CNCC2(NC(=O)CC[NH+](C)C)CCCCC2)c1 ZINC001409787317 1104384677 /nfs/dbraw/zinc/38/46/77/1104384677.db2.gz SCUMRCUDVSXAMU-UHFFFAOYSA-N 1 3 349.494 2.995 10 0 EFAEHO CCCN(C)CC(=O)NC1(C[NH2+]Cc2ncccc2C)CCCCC1 ZINC001409798113 1104421828 /nfs/dbraw/zinc/42/18/28/1104421828.db2.gz JHBQSOKQIAZBIT-UHFFFAOYSA-N 1 3 346.519 2.641 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC[C@H](C)N(C)Cc2cccc(F)c2)C1 ZINC001409607685 1104466172 /nfs/dbraw/zinc/46/61/72/1104466172.db2.gz AUGHYBZTYQAPFU-WMZOPIPTSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC[C@H](C)N(C)Cc2cccc(F)c2)C1 ZINC001409607685 1104466175 /nfs/dbraw/zinc/46/61/75/1104466175.db2.gz AUGHYBZTYQAPFU-WMZOPIPTSA-N 1 3 349.494 2.884 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@H+](C)[C@@H]1CC)[C@@H]1CCN(CC=C(C)C)C1 ZINC001664667213 1104490097 /nfs/dbraw/zinc/49/00/97/1104490097.db2.gz FSDZFQUYYNWRMJ-CEXWTWQISA-N 1 3 335.536 2.996 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC)[C@@H]1CCN(CC=C(C)C)C1 ZINC001664667213 1104490103 /nfs/dbraw/zinc/49/01/03/1104490103.db2.gz FSDZFQUYYNWRMJ-CEXWTWQISA-N 1 3 335.536 2.996 10 0 EFAEHO C[C@@H](CNC(=O)CC[NH+](C)C)N(C)Cc1ccc(C(F)F)cc1 ZINC001409633049 1104568010 /nfs/dbraw/zinc/56/80/10/1104568010.db2.gz SEFPHBQWWPILRH-ZDUSSCGKSA-N 1 3 327.419 2.512 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@H](C[N@H+](C)CCCCCF)C2)CC1 ZINC001664849065 1104577489 /nfs/dbraw/zinc/57/74/89/1104577489.db2.gz NFMASUIXVRCDGP-SFHVURJKSA-N 1 3 341.515 2.638 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@H](C[N@@H+](C)CCCCCF)C2)CC1 ZINC001664849065 1104577493 /nfs/dbraw/zinc/57/74/93/1104577493.db2.gz NFMASUIXVRCDGP-SFHVURJKSA-N 1 3 341.515 2.638 10 0 EFAEHO CC/C=C/CC[N@H+](C)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001664891042 1104594026 /nfs/dbraw/zinc/59/40/26/1104594026.db2.gz OQPITAJRKBWSAH-DUMMIQTOSA-N 1 3 335.536 2.855 10 0 EFAEHO CC/C=C/CC[N@@H+](C)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001664891042 1104594027 /nfs/dbraw/zinc/59/40/27/1104594027.db2.gz OQPITAJRKBWSAH-DUMMIQTOSA-N 1 3 335.536 2.855 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)N(C)CCN(C)C(=O)CC[NH+](C)C ZINC001482625279 1104682692 /nfs/dbraw/zinc/68/26/92/1104682692.db2.gz PSIKIFSRLQKTHS-AWEZNQCLSA-N 1 3 325.884 2.743 10 0 EFAEHO Cc1cc(C)c(CN(C)CCN(C)C(=O)C[C@@H]2CC[N@H+](C)C2)c(C)c1 ZINC001482642275 1104721158 /nfs/dbraw/zinc/72/11/58/1104721158.db2.gz BTZIXGYIOUMSLP-IBGZPJMESA-N 1 3 345.531 2.844 10 0 EFAEHO Cc1cc(C)c(CN(C)CCN(C)C(=O)C[C@@H]2CC[N@@H+](C)C2)c(C)c1 ZINC001482642275 1104721164 /nfs/dbraw/zinc/72/11/64/1104721164.db2.gz BTZIXGYIOUMSLP-IBGZPJMESA-N 1 3 345.531 2.844 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[N@H+](C)[C@H]1CCc2ccccc21 ZINC001482652463 1104744861 /nfs/dbraw/zinc/74/48/61/1104744861.db2.gz XYELRLBBIATINB-PMACEKPBSA-N 1 3 343.515 2.939 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001482652463 1104744866 /nfs/dbraw/zinc/74/48/66/1104744866.db2.gz XYELRLBBIATINB-PMACEKPBSA-N 1 3 343.515 2.939 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@@H]21 ZINC001482660605 1104754194 /nfs/dbraw/zinc/75/41/94/1104754194.db2.gz ZKZBMORLZFZFLW-WIJVFFIESA-N 1 3 333.520 2.750 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@@H]21 ZINC001482660605 1104754199 /nfs/dbraw/zinc/75/41/99/1104754199.db2.gz ZKZBMORLZFZFLW-WIJVFFIESA-N 1 3 333.520 2.750 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@H]21 ZINC001482660603 1104755024 /nfs/dbraw/zinc/75/50/24/1104755024.db2.gz ZKZBMORLZFZFLW-PJHKVULZSA-N 1 3 333.520 2.750 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@H]21 ZINC001482660603 1104755028 /nfs/dbraw/zinc/75/50/28/1104755028.db2.gz ZKZBMORLZFZFLW-PJHKVULZSA-N 1 3 333.520 2.750 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2CC2CC3(CCC3)C2)C1 ZINC001482663759 1104766646 /nfs/dbraw/zinc/76/66/46/1104766646.db2.gz BVPQNILMTHQKKG-RTBURBONSA-N 1 3 347.547 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2CC2CC3(CCC3)C2)C1 ZINC001482663759 1104766652 /nfs/dbraw/zinc/76/66/52/1104766652.db2.gz BVPQNILMTHQKKG-RTBURBONSA-N 1 3 347.547 2.831 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)CC[C@@H]32)c1 ZINC001482667257 1104805319 /nfs/dbraw/zinc/80/53/19/1104805319.db2.gz SBFHEGNXCWFVNZ-UXHICEINSA-N 1 3 343.515 2.758 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)CC[C@@H]32)c1 ZINC001482667257 1104805327 /nfs/dbraw/zinc/80/53/27/1104805327.db2.gz SBFHEGNXCWFVNZ-UXHICEINSA-N 1 3 343.515 2.758 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H](CC[NH2+]CC3CCCC3)C2)C1 ZINC001666146946 1104882679 /nfs/dbraw/zinc/88/26/79/1104882679.db2.gz VFNADXJHLKPORJ-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@H](F)C[NH2+]CCC1CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001666219788 1104905483 /nfs/dbraw/zinc/90/54/83/1104905483.db2.gz ZPXBXDQYWLVADC-IRXDYDNUSA-N 1 3 329.504 2.539 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@H]2CC[C@H]([NH2+]CCCC3CCC3)CC2)C1 ZINC001666306693 1104922413 /nfs/dbraw/zinc/92/24/13/1104922413.db2.gz UIXHVDODGPSPSY-BHIYHBOVSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H]2C[NH2+]CCCC2CCCC2)C1 ZINC001666458560 1104946113 /nfs/dbraw/zinc/94/61/13/1104946113.db2.gz GZXMOMHUBYGGCX-IEBWSBKVSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1 ZINC001666600048 1104968337 /nfs/dbraw/zinc/96/83/37/1104968337.db2.gz NAHOEHHCNYYSKP-SFHVURJKSA-N 1 3 345.531 2.754 10 0 EFAEHO CCc1ccccc1C[NH2+]CC[C@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001482870820 1105120807 /nfs/dbraw/zinc/12/08/07/1105120807.db2.gz HFNXEWBVLVECFL-IRXDYDNUSA-N 1 3 331.504 2.575 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001482887647 1105137831 /nfs/dbraw/zinc/13/78/31/1105137831.db2.gz BSYUFMKKNGCRGN-KXBFYZLASA-N 1 3 344.503 2.739 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001482887645 1105137966 /nfs/dbraw/zinc/13/79/66/1105137966.db2.gz BSYUFMKKNGCRGN-HNAYVOBHSA-N 1 3 344.503 2.739 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CC[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001482889264 1105147483 /nfs/dbraw/zinc/14/74/83/1105147483.db2.gz PJHYLUOIBSRZRR-HOCLYGCPSA-N 1 3 347.494 2.883 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1cc(F)ccc1C ZINC001482902525 1105159694 /nfs/dbraw/zinc/15/96/94/1105159694.db2.gz RPEILGQQNNVDQA-QFBILLFUSA-N 1 3 349.494 2.993 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)CC[NH2+]Cc1cc(F)ccc1C ZINC001482902527 1105160089 /nfs/dbraw/zinc/16/00/89/1105160089.db2.gz RPEILGQQNNVDQA-VQIMIIECSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cc(Cl)ccc1F)N(C)C ZINC001668214405 1105258081 /nfs/dbraw/zinc/25/80/81/1105258081.db2.gz KOWJZRKBSRJALD-LRDDRELGSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1cc(Cl)ccc1F)N(C)C ZINC001668214406 1105258413 /nfs/dbraw/zinc/25/84/13/1105258413.db2.gz KOWJZRKBSRJALD-WBMJQRKESA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1cc2ccccc2o1)N(C)C ZINC001668279263 1105272036 /nfs/dbraw/zinc/27/20/36/1105272036.db2.gz QWVUUWCFBQFKOC-PBHICJAKSA-N 1 3 331.460 2.757 10 0 EFAEHO C[C@@H](CCNCc1nccs1)NC(=O)c1cccc(C[NH+](C)C)c1 ZINC001668321123 1105282144 /nfs/dbraw/zinc/28/21/44/1105282144.db2.gz WWPBXTATNFHKNT-AWEZNQCLSA-N 1 3 346.500 2.503 10 0 EFAEHO CC[C@H](F)CNC/C=C/CNC(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001668828932 1105380183 /nfs/dbraw/zinc/38/01/83/1105380183.db2.gz UKSCPOKONSRBAB-NGHLMZTLSA-N 1 3 339.499 2.651 10 0 EFAEHO CC[C@H](F)CNC/C=C/CNC(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001668828932 1105380189 /nfs/dbraw/zinc/38/01/89/1105380189.db2.gz UKSCPOKONSRBAB-NGHLMZTLSA-N 1 3 339.499 2.651 10 0 EFAEHO CC[C@H](F)CNC/C=C\CNC(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001668828933 1105380410 /nfs/dbraw/zinc/38/04/10/1105380410.db2.gz UKSCPOKONSRBAB-SEDCNLEPSA-N 1 3 339.499 2.651 10 0 EFAEHO CC[C@H](F)CNC/C=C\CNC(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001668828933 1105380417 /nfs/dbraw/zinc/38/04/17/1105380417.db2.gz UKSCPOKONSRBAB-SEDCNLEPSA-N 1 3 339.499 2.651 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/C[NH2+][C@H]1CCc2ccccc21)N(C)C ZINC001668873610 1105390347 /nfs/dbraw/zinc/39/03/47/1105390347.db2.gz VFFVXHVCIZLHCY-PXEQJPNCSA-N 1 3 329.488 2.522 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\C[NH2+][C@@H]1CCc2ccccc21)N(C)C ZINC001668873612 1105390809 /nfs/dbraw/zinc/39/08/09/1105390809.db2.gz VFFVXHVCIZLHCY-YMHTTXFNSA-N 1 3 329.488 2.522 10 0 EFAEHO C[NH+](C)CCCC(=O)NC/C=C/CN[C@@H]1CCc2c1cccc2Cl ZINC001669008759 1105415976 /nfs/dbraw/zinc/41/59/76/1105415976.db2.gz LZBJZZDJJQTEPJ-OAJJDEHYSA-N 1 3 349.906 2.931 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@@H]1C(=O)NC/C=C\CNCc1ccsc1 ZINC001669074808 1105429951 /nfs/dbraw/zinc/42/99/51/1105429951.db2.gz DZNFDSGCGLTMEV-VGOKWCNXSA-N 1 3 335.517 2.773 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@@H]1C(=O)NC/C=C\CNCc1ccsc1 ZINC001669074808 1105429953 /nfs/dbraw/zinc/42/99/53/1105429953.db2.gz DZNFDSGCGLTMEV-VGOKWCNXSA-N 1 3 335.517 2.773 10 0 EFAEHO O=C(CN1CCCC1)NC/C=C\C[NH2+][C@H]1CCc2c1cccc2Cl ZINC001669189449 1105453319 /nfs/dbraw/zinc/45/33/19/1105453319.db2.gz NKPOUBFDHKRCHG-LPQSXRFUSA-N 1 3 347.890 2.685 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC/C=C/C[NH2+][C@H]1CCc2ccccc21 ZINC001669206383 1105457086 /nfs/dbraw/zinc/45/70/86/1105457086.db2.gz COWDDHOSWUIBOS-RLWBPELLSA-N 1 3 341.499 2.810 10 0 EFAEHO C[C@H](C[NH2+]CC/C=C\c1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001669399743 1105480011 /nfs/dbraw/zinc/48/00/11/1105480011.db2.gz MBEJDRCWEOZPJB-JEUJKCLLSA-N 1 3 329.488 2.526 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCCC[C@H]2C[NH2+]CCC(F)(F)F)CCC1 ZINC001669956772 1105554336 /nfs/dbraw/zinc/55/43/36/1105554336.db2.gz XISXNSDQYUADIY-UONOGXRCSA-N 1 3 349.441 2.688 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C/C=C\CNC(=O)C1(N(C)C)CCC1 ZINC001483019526 1105563074 /nfs/dbraw/zinc/56/30/74/1105563074.db2.gz YVLATYXVCDWAJF-WAYWQWQTSA-N 1 3 329.488 2.550 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001670237702 1105602064 /nfs/dbraw/zinc/60/20/64/1105602064.db2.gz VWVKVTPGRZVTKC-OAHLLOKOSA-N 1 3 345.940 2.926 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H]2C[NH2+]CCC2=CCCCC2)C1 ZINC001671347696 1105628546 /nfs/dbraw/zinc/62/85/46/1105628546.db2.gz ZVZHWFFELXCMII-MJGOQNOKSA-N 1 3 333.520 2.799 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC1(C)CC[NH+](CC=C(C)C)CC1 ZINC001671415640 1105634008 /nfs/dbraw/zinc/63/40/08/1105634008.db2.gz PJHQJDBSRBZRNX-INIZCTEOSA-N 1 3 327.488 2.603 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)N[C@@H](CNCCF)C1CCCC1 ZINC001671542817 1105655781 /nfs/dbraw/zinc/65/57/81/1105655781.db2.gz YBBANYOHKXKULK-KRWDZBQOSA-N 1 3 341.515 2.874 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)N[C@@H](CNCCF)C1CCCC1 ZINC001671542817 1105655784 /nfs/dbraw/zinc/65/57/84/1105655784.db2.gz YBBANYOHKXKULK-KRWDZBQOSA-N 1 3 341.515 2.874 10 0 EFAEHO CN(CC(=O)N1CC[C@@](C)(C[NH2+]CC=C(Cl)Cl)C1)C1CCC1 ZINC001671746795 1105695086 /nfs/dbraw/zinc/69/50/86/1105695086.db2.gz CIPGIUQJPQUOMO-INIZCTEOSA-N 1 3 348.318 2.618 10 0 EFAEHO CN(C)C1(C(=O)N(CC[NH2+]C/C=C/Cl)Cc2ccccc2)CCC1 ZINC001672391952 1105821965 /nfs/dbraw/zinc/82/19/65/1105821965.db2.gz DPCHNTPBOXIJMX-KPKJPENVSA-N 1 3 349.906 2.842 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]CCCc2ccsc2)C1 ZINC001672761196 1105896426 /nfs/dbraw/zinc/89/64/26/1105896426.db2.gz DUHLIJCVOZELMP-SJLPKXTDSA-N 1 3 349.544 2.603 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC[C@@H]1CCN(C(=O)[C@H]2CCCN2C)C1 ZINC001672840794 1105918304 /nfs/dbraw/zinc/91/83/04/1105918304.db2.gz YKFJVOXSZLIIOH-UYAOXDASSA-N 1 3 343.515 2.726 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](CC[NH2+]CCc2ccccc2)C1)N(C)C ZINC001672859576 1105922909 /nfs/dbraw/zinc/92/29/09/1105922909.db2.gz UXKQXWUEBPJFSV-WOJBJXKFSA-N 1 3 345.531 2.644 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N[C@H]1CC[C@H](C[NH2+]CCC2CC2)CC1 ZINC001672995054 1105956411 /nfs/dbraw/zinc/95/64/11/1105956411.db2.gz RSJMRRJDNKGTCB-CAMMJAKZSA-N 1 3 335.536 2.924 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCC[N@H+](CC2=CCCCC2)CC1)C1CCC1 ZINC001673379726 1106011749 /nfs/dbraw/zinc/01/17/49/1106011749.db2.gz ARBHEXDRXDZFCW-GOSISDBHSA-N 1 3 333.520 2.942 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCC[N@@H+](CC2=CCCCC2)CC1)C1CCC1 ZINC001673379726 1106011754 /nfs/dbraw/zinc/01/17/54/1106011754.db2.gz ARBHEXDRXDZFCW-GOSISDBHSA-N 1 3 333.520 2.942 10 0 EFAEHO C[NH+](C)CCCCC(=O)N[C@H]1CCCN(CCC(F)(F)F)CC1 ZINC001673402338 1106019872 /nfs/dbraw/zinc/01/98/72/1106019872.db2.gz RHMWCKLJLDHNFL-AWEZNQCLSA-N 1 3 337.430 2.641 10 0 EFAEHO CC[C@@H](F)CN1CC[C@]2(C1)CCCN(C(=O)CCCC[NH+](C)C)C2 ZINC001673651759 1106068315 /nfs/dbraw/zinc/06/83/15/1106068315.db2.gz ZUTVJRTUOVHPMU-MJGOQNOKSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)CCC[NH2+][C@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@H]1C ZINC001673904754 1106100520 /nfs/dbraw/zinc/10/05/20/1106100520.db2.gz NSUVREVEXUMNDL-SJORKVTESA-N 1 3 325.541 2.837 10 0 EFAEHO Cc1ncccc1CN1CC[C@H](NC(=O)CCCC[NH+](C)C)C[C@H]1C ZINC001674153496 1106151522 /nfs/dbraw/zinc/15/15/22/1106151522.db2.gz HBQTVYINBWAEKZ-APWZRJJASA-N 1 3 346.519 2.591 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]1C[N@H+](C)CCC1=CCCCC1 ZINC001674440912 1106190736 /nfs/dbraw/zinc/19/07/36/1106190736.db2.gz OOWFPQQDMGTXCQ-MOPGFXCFSA-N 1 3 333.520 2.894 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]1C[N@@H+](C)CCC1=CCCCC1 ZINC001674440912 1106190740 /nfs/dbraw/zinc/19/07/40/1106190740.db2.gz OOWFPQQDMGTXCQ-MOPGFXCFSA-N 1 3 333.520 2.894 10 0 EFAEHO CCCCC[NH2+]CC1CC(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001674583478 1106218630 /nfs/dbraw/zinc/21/86/30/1106218630.db2.gz QEKDYKQVVPNWNA-RJYAGPCLSA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC2CC(C[NH2+]CCCc3ccsc3)C2)C1 ZINC001674579248 1106218826 /nfs/dbraw/zinc/21/88/26/1106218826.db2.gz UWKWEMNDIYSLMV-ZLPCBKJTSA-N 1 3 349.544 2.507 10 0 EFAEHO C[C@H]1CCCC[C@@H]1[NH+]1CCC(NCCc2cccc(C(N)=O)c2)CC1 ZINC000089545546 1106302409 /nfs/dbraw/zinc/30/24/09/1106302409.db2.gz FBLOGIUKGAYUMZ-JXFKEZNVSA-N 1 3 343.515 2.961 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC1(C[NH2+]CCCF)CCCCC1 ZINC001675179547 1106312660 /nfs/dbraw/zinc/31/26/60/1106312660.db2.gz LPDJAWCUVCHFBC-INIZCTEOSA-N 1 3 327.488 2.628 10 0 EFAEHO CCCC[C@H](C[NH2+]CCC)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001675234364 1106320048 /nfs/dbraw/zinc/32/00/48/1106320048.db2.gz SOIGYRLPIZRPBF-QAPCUYQASA-N 1 3 329.504 2.874 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+][C@H](C)c1ccccc1 ZINC001676014127 1106469154 /nfs/dbraw/zinc/46/91/54/1106469154.db2.gz ZOZFGMBIJFRLCF-LSDHHAIUSA-N 1 3 328.460 2.896 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2cccc(F)c2)C[C@@H]1C ZINC001676774147 1106577841 /nfs/dbraw/zinc/57/78/41/1106577841.db2.gz KGXWOXNDQXVIBP-QFBILLFUSA-N 1 3 349.494 2.679 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC/C=C/CNCc2cccc(F)c2)C1 ZINC001483049648 1106603016 /nfs/dbraw/zinc/60/30/16/1106603016.db2.gz OSKPSMSNIFPSDU-WHLIDYPQSA-N 1 3 347.478 2.710 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC/C=C/CNCc2cccc(F)c2)C1 ZINC001483049648 1106603020 /nfs/dbraw/zinc/60/30/20/1106603020.db2.gz OSKPSMSNIFPSDU-WHLIDYPQSA-N 1 3 347.478 2.710 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1CC[C@H](NC(=O)CN(C)CC(C)(C)C)C1 ZINC001676959158 1106636851 /nfs/dbraw/zinc/63/68/51/1106636851.db2.gz RVKMSQNTCMROGE-IRXDYDNUSA-N 1 3 325.541 2.885 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C1 ZINC001676959156 1106636871 /nfs/dbraw/zinc/63/68/71/1106636871.db2.gz RVKMSQNTCMROGE-DLBZAZTESA-N 1 3 325.541 2.885 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@H](CNCCF)C(C)(C)C)CCCCC1 ZINC001677271640 1106688174 /nfs/dbraw/zinc/68/81/74/1106688174.db2.gz GYHACHJAPOTFQE-OAHLLOKOSA-N 1 3 329.504 2.589 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C1CC([NH2+]CCCCCF)C1 ZINC001677448790 1106719698 /nfs/dbraw/zinc/71/96/98/1106719698.db2.gz WWJKDUVSJMROIE-OFLPRAFFSA-N 1 3 327.488 2.580 10 0 EFAEHO CN(CC(=O)NC1CC(C[NH2+]Cc2cccc(Cl)c2)C1)C1CCC1 ZINC001409265398 1106800264 /nfs/dbraw/zinc/80/02/64/1106800264.db2.gz PUWMUBKYUJFPSY-UHFFFAOYSA-N 1 3 349.906 2.809 10 0 EFAEHO CC(C)CCCN1CC[C@@H]1CNC(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001483682006 1107536992 /nfs/dbraw/zinc/53/69/92/1107536992.db2.gz QJEWTGFNYSAUHT-APWZRJJASA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CCCN1CC[C@@H]1CNC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001483682006 1107537005 /nfs/dbraw/zinc/53/70/05/1107537005.db2.gz QJEWTGFNYSAUHT-APWZRJJASA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H]([NH2+]CC1CC2(CCC2)C1)[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001409344389 1107587146 /nfs/dbraw/zinc/58/71/46/1107587146.db2.gz BFIKAUSSSHUDEO-CVEARBPZSA-N 1 3 335.536 2.924 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]C/C=C/Cl)CC(C)(C)C ZINC001272308545 1107726419 /nfs/dbraw/zinc/72/64/19/1107726419.db2.gz BSOWURXKDICKAJ-VOTDVEDPSA-N 1 3 329.916 2.591 10 0 EFAEHO CC[C@@H](C(=O)NC/C=C/C[NH2+][C@H]1CCCc2ccc(F)cc21)N(C)C ZINC001483061057 1107910816 /nfs/dbraw/zinc/91/08/16/1107910816.db2.gz RQNLTBNUITUXHI-WLMAVBAVSA-N 1 3 347.478 2.805 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC/C=C/C[NH2+]CC2CCCC2)C1 ZINC001483061964 1107949683 /nfs/dbraw/zinc/94/96/83/1107949683.db2.gz YCDJFGQCYNCYMG-GHOSXJJBSA-N 1 3 339.499 2.651 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]C/C=C\c1ccccc1 ZINC001409369549 1107960965 /nfs/dbraw/zinc/96/09/65/1107960965.db2.gz MLDFCUCYHYWNKB-VHDZQUKYSA-N 1 3 329.488 2.667 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]C/C=C/c1ccccc1 ZINC001272344066 1108012465 /nfs/dbraw/zinc/01/24/65/1108012465.db2.gz PVYXBNMPTNKMEZ-IEJDHCNXSA-N 1 3 343.515 2.915 10 0 EFAEHO CC(C)[NH+]1CCC(C(=O)N[C@H](C)[C@H](C)NCc2ccccc2F)CC1 ZINC001409420821 1108261983 /nfs/dbraw/zinc/26/19/83/1108261983.db2.gz DZTKVIQXNOTWOF-JKSUJKDBSA-N 1 3 349.494 2.929 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2CC2CC2)C1 ZINC001272226169 1108298120 /nfs/dbraw/zinc/29/81/20/1108298120.db2.gz RCPZEMXFVCUYLV-OALUTQOASA-N 1 3 335.536 2.831 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2CC2CC2)C1 ZINC001272226169 1108298128 /nfs/dbraw/zinc/29/81/28/1108298128.db2.gz RCPZEMXFVCUYLV-OALUTQOASA-N 1 3 335.536 2.831 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2CC2CC2)C1 ZINC001272226171 1108298702 /nfs/dbraw/zinc/29/87/02/1108298702.db2.gz RCPZEMXFVCUYLV-RBUKOAKNSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCCCCN(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2CC2CC2)C1 ZINC001272226171 1108298709 /nfs/dbraw/zinc/29/87/09/1108298709.db2.gz RCPZEMXFVCUYLV-RBUKOAKNSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H](C(=O)NC/C=C/CNCc1ccsc1)[NH+]1CCCCCC1 ZINC001483071298 1108332435 /nfs/dbraw/zinc/33/24/35/1108332435.db2.gz VDMHQZWJGVSCCE-APHBUQMISA-N 1 3 335.517 2.775 10 0 EFAEHO C[C@H]([NH2+]C/C=C/CNC(=O)CN1CCC(C)CC1)c1ccccc1 ZINC001483078551 1108419615 /nfs/dbraw/zinc/41/96/15/1108419615.db2.gz RBQNUKLIULWYDM-DKFQHHCZSA-N 1 3 329.488 2.742 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NC/C=C\C[NH2+]CCC(F)(F)F)c1 ZINC001483097134 1108622735 /nfs/dbraw/zinc/62/27/35/1108622735.db2.gz IGELVXNJDFRUBM-ARJAWSKDSA-N 1 3 343.393 2.576 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+][C@H]2CCc3ccccc32)CC1 ZINC001483738665 1108699523 /nfs/dbraw/zinc/69/95/23/1108699523.db2.gz SGXGHKSYVIWNEK-RBUKOAKNSA-N 1 3 341.499 2.787 10 0 EFAEHO CCc1cccc(C[NH2+]CC2CC(NC(=O)CN(C)C(C)C)C2)c1 ZINC001409302142 1109466472 /nfs/dbraw/zinc/46/64/72/1109466472.db2.gz VWGHYTVHUHFJDR-UHFFFAOYSA-N 1 3 331.504 2.574 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1cc(C)ccc1F ZINC001483133162 1109549276 /nfs/dbraw/zinc/54/92/76/1109549276.db2.gz RKSDKEYYWAUFGZ-QAPCUYQASA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CNCc1cc(C)ccc1F ZINC001483133162 1109549279 /nfs/dbraw/zinc/54/92/79/1109549279.db2.gz RKSDKEYYWAUFGZ-QAPCUYQASA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1cc(C)ccc1F ZINC001483133161 1109549385 /nfs/dbraw/zinc/54/93/85/1109549385.db2.gz RKSDKEYYWAUFGZ-CRAIPNDOSA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CNCc1cc(C)ccc1F ZINC001483133161 1109549388 /nfs/dbraw/zinc/54/93/88/1109549388.db2.gz RKSDKEYYWAUFGZ-CRAIPNDOSA-N 1 3 335.467 2.603 10 0 EFAEHO CC1CCN([C@H](CNC(=O)C23CC[NH+](CC2)C3)c2cccs2)CC1 ZINC000899964548 1109566120 /nfs/dbraw/zinc/56/61/20/1109566120.db2.gz NGPOTRCYAODKBY-MRXNPFEDSA-N 1 3 347.528 2.733 10 0 EFAEHO C[C@H](C[NH2+]CCC1CCCC1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001483166206 1109920582 /nfs/dbraw/zinc/92/05/82/1109920582.db2.gz CJQUOKDWQZIYFO-BEFAXECRSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCCN2C(C)C)cc1F ZINC001483172449 1109942059 /nfs/dbraw/zinc/94/20/59/1109942059.db2.gz QCJRRJXIFYYLEJ-VQIMIIECSA-N 1 3 349.494 2.991 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1ccc(Cl)cc1 ZINC001483197612 1109996653 /nfs/dbraw/zinc/99/66/53/1109996653.db2.gz NGOZDINSAXGJIE-PBHICJAKSA-N 1 3 337.895 2.809 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H]3CC[N@H+](C)[C@@H](C)C3)CC2)cs1 ZINC001483762175 1112088036 /nfs/dbraw/zinc/08/80/36/1112088036.db2.gz NOUDDQZOCXQZKL-BBRMVZONSA-N 1 3 335.517 2.525 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@H]3CC[N@@H+](C)[C@@H](C)C3)CC2)cs1 ZINC001483762175 1112088041 /nfs/dbraw/zinc/08/80/41/1112088041.db2.gz NOUDDQZOCXQZKL-BBRMVZONSA-N 1 3 335.517 2.525 10 0 EFAEHO C[C@@H](NC1(CNC(=O)C2(C[NH+](C)C)CC2)CC1)c1ccc(Cl)cc1 ZINC001483763250 1112150846 /nfs/dbraw/zinc/15/08/46/1112150846.db2.gz YYUSFHHKNRRJMM-CQSZACIVSA-N 1 3 349.906 2.981 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC2(C1)CCN(C[C@@H](F)CC)CC2 ZINC001483836500 1112512693 /nfs/dbraw/zinc/51/26/93/1112512693.db2.gz BEPDPJMZSQWSPA-KRWDZBQOSA-N 1 3 341.515 2.781 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC2(C1)CCN(C[C@@H](F)CC)CC2 ZINC001483836500 1112512695 /nfs/dbraw/zinc/51/26/95/1112512695.db2.gz BEPDPJMZSQWSPA-KRWDZBQOSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[NH2+][C@@H](C)c1cccc(OC)c1 ZINC001483951542 1112595025 /nfs/dbraw/zinc/59/50/25/1112595025.db2.gz HKYAMXKSRLUEEC-WMZOPIPTSA-N 1 3 347.503 2.679 10 0 EFAEHO Cc1cc(CN2CCC(C)(NC(=O)C[C@H]3CC[N@@H+](C)C3)CC2)cs1 ZINC001483973830 1112615241 /nfs/dbraw/zinc/61/52/41/1112615241.db2.gz INFLWKUGJVRTSB-MRXNPFEDSA-N 1 3 349.544 2.869 10 0 EFAEHO Cc1cc(CN2CCC(C)(NC(=O)C[C@H]3CC[N@H+](C)C3)CC2)cs1 ZINC001483973830 1112615242 /nfs/dbraw/zinc/61/52/42/1112615242.db2.gz INFLWKUGJVRTSB-MRXNPFEDSA-N 1 3 349.544 2.869 10 0 EFAEHO Cc1cc(CN2CCC(C)(NC(=O)C[C@@H]3CC[N@@H+](C)C3)CC2)cs1 ZINC001483973829 1112615412 /nfs/dbraw/zinc/61/54/12/1112615412.db2.gz INFLWKUGJVRTSB-INIZCTEOSA-N 1 3 349.544 2.869 10 0 EFAEHO Cc1cc(CN2CCC(C)(NC(=O)C[C@@H]3CC[N@H+](C)C3)CC2)cs1 ZINC001483973829 1112615415 /nfs/dbraw/zinc/61/54/15/1112615415.db2.gz INFLWKUGJVRTSB-INIZCTEOSA-N 1 3 349.544 2.869 10 0 EFAEHO C[C@@H](C(=O)N[C@H](C[NH2+]CCCF)C1CCCC1)N1CCCCCC1 ZINC001484008610 1112657152 /nfs/dbraw/zinc/65/71/52/1112657152.db2.gz SRRLQYYGHFCAMT-FUHWJXTLSA-N 1 3 341.515 2.875 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](CNCCF)C1CCCC1)[NH+]1CCCCC1 ZINC001484014021 1112664093 /nfs/dbraw/zinc/66/40/93/1112664093.db2.gz HIEMHGXTQKQUMN-ZWKOTPCHSA-N 1 3 341.515 2.731 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)C3(N(C)C)CCC3)C2)cc1 ZINC001484523020 1112979207 /nfs/dbraw/zinc/97/92/07/1112979207.db2.gz OJJKDLDSBZOUHP-LJQANCHMSA-N 1 3 343.515 2.808 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](CC[NH2+]CCCCC(F)(F)F)C1 ZINC001484550006 1113002342 /nfs/dbraw/zinc/00/23/42/1113002342.db2.gz PEMQEYJXEOSWTH-OAHLLOKOSA-N 1 3 349.441 2.643 10 0 EFAEHO CC(C)CCC[NH+]1CCC2(CN(C(=O)C3(N(C)C)CCC3)C2)CC1 ZINC001484578696 1113043519 /nfs/dbraw/zinc/04/35/19/1113043519.db2.gz NFDXNJHVDBWAFZ-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(CNC(=O)[C@H]2CCCCN2C(C)C)CCC1 ZINC001484655042 1113094387 /nfs/dbraw/zinc/09/43/87/1113094387.db2.gz JEAMGFNHXULEMH-HZPDHXFCSA-N 1 3 327.488 2.626 10 0 EFAEHO CC/C=C/CCN1Cc2ccc(CNC(=O)CC[NH+](C)C)cc2C1 ZINC001484875561 1117790860 /nfs/dbraw/zinc/79/08/60/1117790860.db2.gz JSCODEKKBRWTQU-AATRIKPKSA-N 1 3 329.488 2.926 10 0 EFAEHO Cc1ccc(CN[C@H]2CN(C(=O)CC[NH+](C)C)C[C@H]2C)c(Cl)c1 ZINC001484900989 1117805151 /nfs/dbraw/zinc/80/51/51/1117805151.db2.gz WOOZPHZCMWFEBT-PBHICJAKSA-N 1 3 337.895 2.537 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1[NH2+]CC1=CCCCC1 ZINC001484899148 1117814899 /nfs/dbraw/zinc/81/48/99/1117814899.db2.gz FKFVCRGEVQWKAU-AEFFLSMTSA-N 1 3 335.536 2.901 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]Cc2cccc(C)c2)CC1 ZINC001484926588 1117829834 /nfs/dbraw/zinc/82/98/34/1117829834.db2.gz FLNJYBGYVPGDSG-UHFFFAOYSA-N 1 3 331.504 2.808 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@H](NC(=O)Cc2nc[nH]c2C)C[C@@H]1C ZINC001484986450 1117912353 /nfs/dbraw/zinc/91/23/53/1117912353.db2.gz RLAULFAXNCPQEL-UFOWUTGFSA-N 1 3 332.492 2.976 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@H](NC(=O)Cc2nc[nH]c2C)C[C@@H]1C ZINC001484986450 1117912356 /nfs/dbraw/zinc/91/23/56/1117912356.db2.gz RLAULFAXNCPQEL-UFOWUTGFSA-N 1 3 332.492 2.976 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)C1(N(C)C)CCC1)CCC(F)(F)F ZINC001493860778 1117932153 /nfs/dbraw/zinc/93/21/53/1117932153.db2.gz ROZCLMDUAKZGGB-UHFFFAOYSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)C1(N(C)C)CCC1)CCC(F)(F)F ZINC001493860778 1117932155 /nfs/dbraw/zinc/93/21/55/1117932155.db2.gz ROZCLMDUAKZGGB-UHFFFAOYSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@H]([C@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001485081514 1118031689 /nfs/dbraw/zinc/03/16/89/1118031689.db2.gz FBGFMNNFVRLAAU-OALUTQOASA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@H]([C@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001485081514 1118031694 /nfs/dbraw/zinc/03/16/94/1118031694.db2.gz FBGFMNNFVRLAAU-OALUTQOASA-N 1 3 335.536 2.853 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC2CC(NC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001485095201 1118042887 /nfs/dbraw/zinc/04/28/87/1118042887.db2.gz ZZNCKGURSWLYCN-UHFFFAOYSA-N 1 3 343.515 2.772 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]Cc2sccc2Cl)C1 ZINC001485110383 1118057263 /nfs/dbraw/zinc/05/72/63/1118057263.db2.gz HJMXKSMWMBDQDH-UHFFFAOYSA-N 1 3 343.924 2.726 10 0 EFAEHO C[C@@H](NCc1ccccc1F)[C@@H](C)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001485165075 1118107932 /nfs/dbraw/zinc/10/79/32/1118107932.db2.gz UMOFFKWRSPJKBL-HZPDHXFCSA-N 1 3 347.478 2.685 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)c(C)n1 ZINC001485180610 1118115110 /nfs/dbraw/zinc/11/51/10/1118115110.db2.gz NREVKTVLELSYEX-CVEARBPZSA-N 1 3 346.519 2.556 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)cc1C ZINC001485218601 1118138889 /nfs/dbraw/zinc/13/88/89/1118138889.db2.gz XACSQVYROZPISJ-LSDHHAIUSA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001485219560 1118139637 /nfs/dbraw/zinc/13/96/37/1118139637.db2.gz YDLFPOFOSCQOSJ-UONOGXRCSA-N 1 3 332.492 2.714 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1C[NH+]2CCC1CC2)N(C)Cc1ccc(Cl)cc1 ZINC001485300374 1118218400 /nfs/dbraw/zinc/21/84/00/1118218400.db2.gz DGPGYVYRHJIMTL-KDOFPFPSSA-N 1 3 349.906 2.618 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)N(C)Cc1ccc(F)cc1 ZINC001485314362 1118227030 /nfs/dbraw/zinc/22/70/30/1118227030.db2.gz UEUKUZHBNKEKJY-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)N(C)Cc1ccc(F)cc1 ZINC001485314362 1118227032 /nfs/dbraw/zinc/22/70/32/1118227032.db2.gz UEUKUZHBNKEKJY-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CNC(=O)c1cccc(CN(C)C)c1)[N@H+](C)CC1CCCC1 ZINC001485390535 1118316722 /nfs/dbraw/zinc/31/67/22/1118316722.db2.gz USYOIBDVKXMJQO-MRXNPFEDSA-N 1 3 331.504 2.989 10 0 EFAEHO C[C@H](CNC(=O)c1cccc(CN(C)C)c1)[N@@H+](C)CC1CCCC1 ZINC001485390535 1118316725 /nfs/dbraw/zinc/31/67/25/1118316725.db2.gz USYOIBDVKXMJQO-MRXNPFEDSA-N 1 3 331.504 2.989 10 0 EFAEHO CCCC[C@@H](C[NH2+]C(C)C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001485468572 1118378533 /nfs/dbraw/zinc/37/85/33/1118378533.db2.gz NUZNUBUFXVVWNA-YJBOKZPZSA-N 1 3 329.504 2.872 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)C1C[NH+](CC2CCC(C)CC2)C1 ZINC001485510772 1118428211 /nfs/dbraw/zinc/42/82/11/1118428211.db2.gz SXUWROYCRFCQHE-CGZBRXJRSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@H](NC(=O)CC[NH+](C)C)C1CN(Cc2ccc(C(C)(C)C)cc2)C1 ZINC001485521629 1118434408 /nfs/dbraw/zinc/43/44/08/1118434408.db2.gz GJOQJXUDURYNGB-INIZCTEOSA-N 1 3 345.531 2.872 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC2(C1)CCCN(Cc1ccc(CF)cc1)C2 ZINC001485664734 1118513747 /nfs/dbraw/zinc/51/37/47/1118513747.db2.gz MCSJRMYPXVOZLR-UHFFFAOYSA-N 1 3 347.478 2.532 10 0 EFAEHO C[C@@H]([NH2+]C[C@H]1C[C@H](NC(=O)CN(C)C2CCC2)C1)c1ccccc1 ZINC001485686055 1118527750 /nfs/dbraw/zinc/52/77/50/1118527750.db2.gz GKIMNKRIUPLYQY-JFIYKMOQSA-N 1 3 329.488 2.716 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]CC2CCC(F)(F)CC2)C1)N(C)C ZINC001485688217 1118527959 /nfs/dbraw/zinc/52/79/59/1118527959.db2.gz CUZHOBBJBDRIAI-BZUAXINKSA-N 1 3 345.478 2.637 10 0 EFAEHO C[C@@H](CCC[NH2+]Cc1ccc(F)cc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001485739258 1118551937 /nfs/dbraw/zinc/55/19/37/1118551937.db2.gz OTXDBIMRNKMJAL-CVEARBPZSA-N 1 3 335.467 2.542 10 0 EFAEHO CC(C)CC[N@H+](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001485764148 1118576637 /nfs/dbraw/zinc/57/66/37/1118576637.db2.gz XDXYEBGUAWAQOY-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)CC[N@@H+](C)C1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001485764148 1118576641 /nfs/dbraw/zinc/57/66/41/1118576641.db2.gz XDXYEBGUAWAQOY-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO C[C@@H]([NH2+]CCCF)c1ccc(CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001272702145 1118669516 /nfs/dbraw/zinc/66/95/16/1118669516.db2.gz ZPEYIGJDSDADAS-JKSUJKDBSA-N 1 3 335.467 2.655 10 0 EFAEHO CN(C)C[C@@H](NC(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C)c1ccccc1 ZINC000116524666 282114058 /nfs/dbraw/zinc/11/40/58/282114058.db2.gz HJCXDGHAAIKQTI-MSOLQXFVSA-N 1 3 348.535 2.955 10 0 EFAEHO CCCN[C@@H](CC[N@H+](C)CCO)c1cccc(Br)c1 ZINC000053940396 214205577 /nfs/dbraw/zinc/20/55/77/214205577.db2.gz FSDKXUOVFZEGPO-HNNXBMFYSA-N 1 3 329.282 2.804 10 0 EFAEHO CCCN[C@@H](CC[N@@H+](C)CCO)c1cccc(Br)c1 ZINC000053940396 214205579 /nfs/dbraw/zinc/20/55/79/214205579.db2.gz FSDKXUOVFZEGPO-HNNXBMFYSA-N 1 3 329.282 2.804 10 0 EFAEHO CCCN(CCO)CC[C@H]([NH2+]C)c1ccc(Br)cc1 ZINC000053941086 214206724 /nfs/dbraw/zinc/20/67/24/214206724.db2.gz RXXRAFCWUBFUFL-HNNXBMFYSA-N 1 3 329.282 2.804 10 0 EFAEHO COCC[N@H+](CC[C@@H](N)c1ccccc1Br)C1CC1 ZINC000054020532 214211151 /nfs/dbraw/zinc/21/11/51/214211151.db2.gz VOYKEUFCRGGJBT-OAHLLOKOSA-N 1 3 327.266 2.950 10 0 EFAEHO COCC[N@@H+](CC[C@@H](N)c1ccccc1Br)C1CC1 ZINC000054020532 214211153 /nfs/dbraw/zinc/21/11/53/214211153.db2.gz VOYKEUFCRGGJBT-OAHLLOKOSA-N 1 3 327.266 2.950 10 0 EFAEHO CN(C)C[C@H](NC(=O)c1cccc(C[NH+](C)C)c1)c1ccccc1 ZINC000155540979 282149161 /nfs/dbraw/zinc/14/91/61/282149161.db2.gz YMSGCOUFWZWAFE-IBGZPJMESA-N 1 3 325.456 2.781 10 0 EFAEHO C[N@@H+](Cc1ccccc1)CC1CCN(C[C@@H](O)C(F)(F)F)CC1 ZINC000181676743 529999659 /nfs/dbraw/zinc/99/96/59/529999659.db2.gz GGZIFCXDTJYWEJ-MRXNPFEDSA-N 1 3 330.394 2.754 10 0 EFAEHO C[N@H+](Cc1ccccc1)CC1CCN(C[C@@H](O)C(F)(F)F)CC1 ZINC000181676743 529999661 /nfs/dbraw/zinc/99/96/61/529999661.db2.gz GGZIFCXDTJYWEJ-MRXNPFEDSA-N 1 3 330.394 2.754 10 0 EFAEHO C[N@@H+](Cc1ccccc1)CC1CCN(C[C@H](O)C(F)(F)F)CC1 ZINC000181676727 529999762 /nfs/dbraw/zinc/99/97/62/529999762.db2.gz GGZIFCXDTJYWEJ-INIZCTEOSA-N 1 3 330.394 2.754 10 0 EFAEHO C[N@H+](Cc1ccccc1)CC1CCN(C[C@H](O)C(F)(F)F)CC1 ZINC000181676727 529999764 /nfs/dbraw/zinc/99/97/64/529999764.db2.gz GGZIFCXDTJYWEJ-INIZCTEOSA-N 1 3 330.394 2.754 10 0 EFAEHO C[NH+]1CCC(CCNC(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000102640147 219217789 /nfs/dbraw/zinc/21/77/89/219217789.db2.gz DIINVGPPOUHYTN-UHFFFAOYSA-N 1 3 329.488 2.744 10 0 EFAEHO Cc1ccc(C[N@@H+]2CCC[C@@H](CCNC(=O)C3(N)CCC3)C2)cc1 ZINC000067856207 215233765 /nfs/dbraw/zinc/23/37/65/215233765.db2.gz KXYOQUDIUTYOBK-KRWDZBQOSA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1ccc(C[N@H+]2CCC[C@@H](CCNC(=O)C3(N)CCC3)C2)cc1 ZINC000067856207 215233767 /nfs/dbraw/zinc/23/37/67/215233767.db2.gz KXYOQUDIUTYOBK-KRWDZBQOSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@@H](O)C[NH+]1CCC(CNCc2cnc(C(C)(C)C)s2)CC1 ZINC000069347382 215380383 /nfs/dbraw/zinc/38/03/83/215380383.db2.gz QCTFQVLPZZYHJR-CYBMUJFWSA-N 1 3 325.522 2.623 10 0 EFAEHO C[C@H]1C[C@H](N(C)C(=O)NC2CC[NH+](C3CCCC3)CC2)CCN1C ZINC000176021001 291124892 /nfs/dbraw/zinc/12/48/92/291124892.db2.gz WWUYCTAYIQHWAM-MAUKXSAKSA-N 1 3 336.524 2.518 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000356384683 283332387 /nfs/dbraw/zinc/33/23/87/283332387.db2.gz CRLJZCZZJXZSKV-GBESFXJTSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000356384683 283332388 /nfs/dbraw/zinc/33/23/88/283332388.db2.gz CRLJZCZZJXZSKV-GBESFXJTSA-N 1 3 335.536 2.974 10 0 EFAEHO O[C@H](C[NH+]1CCC(CNCc2ccccn2)CC1)c1ccccc1 ZINC000072254118 216084791 /nfs/dbraw/zinc/08/47/91/216084791.db2.gz VANVLKSMTNSDCZ-HXUWFJFHSA-N 1 3 325.456 2.617 10 0 EFAEHO O[C@H](CN1CCC(C[NH2+]Cc2ccccn2)CC1)c1ccccc1 ZINC000072254118 216084795 /nfs/dbraw/zinc/08/47/95/216084795.db2.gz VANVLKSMTNSDCZ-HXUWFJFHSA-N 1 3 325.456 2.617 10 0 EFAEHO Cc1ccncc1CNCc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000354655548 242009537 /nfs/dbraw/zinc/00/95/37/242009537.db2.gz GOROIMVMRAWDME-FQEVSTJZSA-N 1 3 325.456 2.637 10 0 EFAEHO Cc1ccncc1CNCc1ccccc1C[N@H+]1CCC[C@H]1CO ZINC000354655548 242009542 /nfs/dbraw/zinc/00/95/42/242009542.db2.gz GOROIMVMRAWDME-FQEVSTJZSA-N 1 3 325.456 2.637 10 0 EFAEHO CCC[C@@H](N)C(=O)N(C)[C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000246183143 243204797 /nfs/dbraw/zinc/20/47/97/243204797.db2.gz CIJXXOMZUFTTKH-JFRXWTBNSA-N 1 3 331.504 2.729 10 0 EFAEHO CCC[C@@H](N)C(=O)N(C)[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000246183143 243204804 /nfs/dbraw/zinc/20/48/04/243204804.db2.gz CIJXXOMZUFTTKH-JFRXWTBNSA-N 1 3 331.504 2.729 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1)[C@@H]1C[C@H]1C ZINC000414336597 244094597 /nfs/dbraw/zinc/09/45/97/244094597.db2.gz IKQWLFAHMFSQJE-SPYBWZPUSA-N 1 3 329.488 2.518 10 0 EFAEHO CN(C)c1ncc(C[NH2+]C[C@H]2CCCN(C)[C@H]2c2cccs2)n1C ZINC000414360546 244106725 /nfs/dbraw/zinc/10/67/25/244106725.db2.gz RDBOQALPGMPPLP-RHSMWYFYSA-N 1 3 347.532 2.720 10 0 EFAEHO CC(C)[C@@H](Cc1ccc(F)cc1)[N@H+](C)C[C@H]1CCCN(C(=O)CN)C1 ZINC000414738926 244319683 /nfs/dbraw/zinc/31/96/83/244319683.db2.gz IJTLWVFDWWJZGL-IEBWSBKVSA-N 1 3 349.494 2.522 10 0 EFAEHO CC(C)[C@@H](Cc1ccc(F)cc1)[N@@H+](C)C[C@H]1CCCN(C(=O)CN)C1 ZINC000414738926 244319688 /nfs/dbraw/zinc/31/96/88/244319688.db2.gz IJTLWVFDWWJZGL-IEBWSBKVSA-N 1 3 349.494 2.522 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)CC(=O)NCCc2ccccc2)cc1 ZINC000414808373 244361143 /nfs/dbraw/zinc/36/11/43/244361143.db2.gz FGBVVYPKHVBIHB-DLBZAZTESA-N 1 3 339.483 2.933 10 0 EFAEHO C[C@H](CCN1C(=O)c2ccccc2C1=O)NCC1([NH3+])CCCCCC1 ZINC000414858785 244374606 /nfs/dbraw/zinc/37/46/06/244374606.db2.gz LJOMTKZTJKDWOP-OAHLLOKOSA-N 1 3 343.471 2.703 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@H](C)N[C@H]1CC[NH2+]C[C@H]1C ZINC000414944907 244398050 /nfs/dbraw/zinc/39/80/50/244398050.db2.gz QRTYTCQCLAFTLK-DYEKYZERSA-N 1 3 339.867 2.653 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+][C@H]1CCNC[C@H]1C ZINC000414944907 244398053 /nfs/dbraw/zinc/39/80/53/244398053.db2.gz QRTYTCQCLAFTLK-DYEKYZERSA-N 1 3 339.867 2.653 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@H](C)N[C@@H]1CC[NH2+]C[C@@H]1C ZINC000414944914 244398126 /nfs/dbraw/zinc/39/81/26/244398126.db2.gz QRTYTCQCLAFTLK-SGMGOOAPSA-N 1 3 339.867 2.653 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+][C@@H]1CCNC[C@@H]1C ZINC000414944914 244398129 /nfs/dbraw/zinc/39/81/29/244398129.db2.gz QRTYTCQCLAFTLK-SGMGOOAPSA-N 1 3 339.867 2.653 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)N[C@H]1CC[NH2+]C[C@@H]1C ZINC000414945146 244399108 /nfs/dbraw/zinc/39/91/08/244399108.db2.gz RAMZMYFBTXXQRC-VBQJREDUSA-N 1 3 337.895 2.665 10 0 EFAEHO C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+][C@H]1CCNC[C@@H]1C ZINC000414945146 244399113 /nfs/dbraw/zinc/39/91/13/244399113.db2.gz RAMZMYFBTXXQRC-VBQJREDUSA-N 1 3 337.895 2.665 10 0 EFAEHO CCN(C(=O)N[C@H](C)CC[NH3+])[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418546304 284188089 /nfs/dbraw/zinc/18/80/89/284188089.db2.gz JKEWLFYHUGYODW-SOLBZPMBSA-N 1 3 332.492 2.591 10 0 EFAEHO [NH3+]C1CCC(NC(=O)NCc2ccccc2CN2CCCCC2)CC1 ZINC000416902780 244904310 /nfs/dbraw/zinc/90/43/10/244904310.db2.gz MBEUUHLWUAEZFY-UHFFFAOYSA-N 1 3 344.503 2.742 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)NCc2cccc(CN(C)C)c2)cc1 ZINC000417061623 245000539 /nfs/dbraw/zinc/00/05/39/245000539.db2.gz FXWPAKVHGQRWIA-HNNXBMFYSA-N 1 3 340.471 2.767 10 0 EFAEHO CCN(C(=O)NC[C@H]([NH3+])C1CC1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418495855 245176107 /nfs/dbraw/zinc/17/61/07/245176107.db2.gz GRMRCGUCEGFWGF-MNEFBYGVSA-N 1 3 344.503 2.591 10 0 EFAEHO CCN(C(=O)NCCCC[NH3+])[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418517012 245182119 /nfs/dbraw/zinc/18/21/19/245182119.db2.gz YKZXVGSWLDNTQO-WMZOPIPTSA-N 1 3 332.492 2.592 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)N2CCC[C@@H]2CN2CCCCC2)cc1 ZINC000418464769 245167630 /nfs/dbraw/zinc/16/76/30/245167630.db2.gz QANZVSIOFHUNCW-VQIMIIECSA-N 1 3 344.503 2.866 10 0 EFAEHO CC[NH2+][C@H](C)CNC(=O)N(CC)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418607386 245211570 /nfs/dbraw/zinc/21/15/70/245211570.db2.gz QWMTXWKJIOBSEU-ZIFCJYIRSA-N 1 3 346.519 2.851 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCN(C(=O)N[C@@H]2CC[C@@H](C[NH3+])C2)CC1 ZINC000418789986 245293478 /nfs/dbraw/zinc/29/34/78/245293478.db2.gz MKFDCRIEQGOUIK-HZPDHXFCSA-N 1 3 338.540 2.656 10 0 EFAEHO CCN(CC)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000110978514 220086420 /nfs/dbraw/zinc/08/64/20/220086420.db2.gz SAOGLJBLRGDJNS-YQQQUEKLSA-N 1 3 329.488 2.640 10 0 EFAEHO CCN(CC)CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000110978514 220086422 /nfs/dbraw/zinc/08/64/22/220086422.db2.gz SAOGLJBLRGDJNS-YQQQUEKLSA-N 1 3 329.488 2.640 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)C[C@H](c2ccccc2)N(C)C)[C@@H](C)C1 ZINC000433471982 248063969 /nfs/dbraw/zinc/06/39/69/248063969.db2.gz QROOGPHYUDXNJB-YTQUADARSA-N 1 3 331.504 2.868 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)C[C@H](c2ccccc2)N(C)C)[C@@H](C)C1 ZINC000433471982 248063972 /nfs/dbraw/zinc/06/39/72/248063972.db2.gz QROOGPHYUDXNJB-YTQUADARSA-N 1 3 331.504 2.868 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)NCCC[N@@H+]1CCCC[C@H]1C ZINC000341450760 296310970 /nfs/dbraw/zinc/31/09/70/296310970.db2.gz JJRCTSMEWOMCTK-KZNAEPCWSA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)NCCC[N@H+]1CCCC[C@H]1C ZINC000341450760 296310972 /nfs/dbraw/zinc/31/09/72/296310972.db2.gz JJRCTSMEWOMCTK-KZNAEPCWSA-N 1 3 338.540 2.813 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCC(C)(C)CO)CC1 ZINC000449408766 251017569 /nfs/dbraw/zinc/01/75/69/251017569.db2.gz PKQROPINZDGIGM-UHFFFAOYSA-N 1 3 333.520 2.717 10 0 EFAEHO CC(C)(C)CC(C)(C)[NH+]1CCC(NCCN2CCC(O)CC2)CC1 ZINC000449647225 251092855 /nfs/dbraw/zinc/09/28/55/251092855.db2.gz DCNHTZMLKYKVMD-UHFFFAOYSA-N 1 3 339.568 2.712 10 0 EFAEHO CCN(CCC[NH+]1CCCC1)C(=O)NCCN1[C@@H](C)CCC[C@@H]1C ZINC000349777020 284891640 /nfs/dbraw/zinc/89/16/40/284891640.db2.gz USQHPKQDLALWKZ-ROUUACIJSA-N 1 3 338.540 2.767 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N(CCN(C)C)Cc1cccs1 ZINC000267740139 251302314 /nfs/dbraw/zinc/30/23/14/251302314.db2.gz BAUVDPRZEDGRRT-OAHLLOKOSA-N 1 3 340.537 2.552 10 0 EFAEHO COC[C@H](O)C[N@@H+]1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000453026483 252020843 /nfs/dbraw/zinc/02/08/43/252020843.db2.gz UTLZODZUBSXREQ-UXHICEINSA-N 1 3 346.515 2.616 10 0 EFAEHO COC[C@H](O)C[N@H+]1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000453026483 252020846 /nfs/dbraw/zinc/02/08/46/252020846.db2.gz UTLZODZUBSXREQ-UXHICEINSA-N 1 3 346.515 2.616 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCCNC(=O)c1ccco1 ZINC000268765413 252214682 /nfs/dbraw/zinc/21/46/82/252214682.db2.gz PQXQYUBHSYTJSJ-SJLPKXTDSA-N 1 3 341.455 2.510 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCCNC(=O)c1ccco1 ZINC000268765413 252214686 /nfs/dbraw/zinc/21/46/86/252214686.db2.gz PQXQYUBHSYTJSJ-SJLPKXTDSA-N 1 3 341.455 2.510 10 0 EFAEHO CC(=O)NC1CCC([NH2+][C@H](C)c2ccc(OCCN(C)C)cc2)CC1 ZINC000268863957 252313514 /nfs/dbraw/zinc/31/35/14/252313514.db2.gz SLKUBNZFFYBNCL-VNCLNFNDSA-N 1 3 347.503 2.725 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)C1CCC(F)(F)CC1 ZINC000340135494 285242714 /nfs/dbraw/zinc/24/27/14/285242714.db2.gz USGKPCGQPZQXOM-MRXNPFEDSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)C1CCC(F)(F)CC1 ZINC000340135494 285242718 /nfs/dbraw/zinc/24/27/18/285242718.db2.gz USGKPCGQPZQXOM-MRXNPFEDSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)N[C@@H](C)C1CCCC1 ZINC000341140063 285278245 /nfs/dbraw/zinc/27/82/45/285278245.db2.gz KCCYYUVUOBPFQN-WMZOPIPTSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)N[C@@H](C)C1CCCC1 ZINC000341140063 285278246 /nfs/dbraw/zinc/27/82/46/285278246.db2.gz KCCYYUVUOBPFQN-WMZOPIPTSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)Cc1ncc(CNCC2(O)CC[NH+](C(C)C)CC2)s1 ZINC000344665160 142057857 /nfs/dbraw/zinc/05/78/57/142057857.db2.gz BQVCGUPPHYVNID-UHFFFAOYSA-N 1 3 325.522 2.667 10 0 EFAEHO C[C@H]1CN(C)C[C@@H]1[NH2+]CCCOC1CCN(Cc2ccccc2)CC1 ZINC000344728820 142068114 /nfs/dbraw/zinc/06/81/14/142068114.db2.gz WZJZOYUJFVXRMN-RXVVDRJESA-N 1 3 345.531 2.597 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCC(C[NH+]2CCCC2)CC1 ZINC000346139902 142153756 /nfs/dbraw/zinc/15/37/56/142153756.db2.gz LXPPACBTGFAGEV-UHFFFAOYSA-N 1 3 339.487 2.884 10 0 EFAEHO O=C(CN[C@H](c1cccs1)C1CC1)NC1CC[NH+](C2CC2)CC1 ZINC000347540588 142232621 /nfs/dbraw/zinc/23/26/21/142232621.db2.gz XDKUSRXZJXSAOA-SFHVURJKSA-N 1 3 333.501 2.532 10 0 EFAEHO COCCN1CCC[C@@H]1C[NH2+][C@H](C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000348047517 142313688 /nfs/dbraw/zinc/31/36/88/142313688.db2.gz STISDUKCNDULBK-HLAWJBBLSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000349660294 142344256 /nfs/dbraw/zinc/34/42/56/142344256.db2.gz BENDOWNLBRWXHY-SJLPKXTDSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000349660294 142344258 /nfs/dbraw/zinc/34/42/58/142344258.db2.gz BENDOWNLBRWXHY-SJLPKXTDSA-N 1 3 336.524 2.519 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000349904605 142376426 /nfs/dbraw/zinc/37/64/26/142376426.db2.gz CIPWAESMHIETOU-YQVWRLOYSA-N 1 3 346.519 2.536 10 0 EFAEHO CC(C)c1ccccc1OC[C@H](O)CN1CCC(C[NH+](C)C)CC1 ZINC000341184283 145007875 /nfs/dbraw/zinc/00/78/75/145007875.db2.gz ITORQMSELVXQGN-GOSISDBHSA-N 1 3 334.504 2.823 10 0 EFAEHO C[C@H](CNC(=O)NCC[NH+]1[C@@H](C)CCC[C@@H]1C)N1CCC(C)CC1 ZINC000341429659 145050351 /nfs/dbraw/zinc/05/03/51/145050351.db2.gz HYJXGICRYLOQNB-OKZBNKHCSA-N 1 3 338.540 2.669 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NCCN2[C@H](C)CCC[C@@H]2C)CC1 ZINC000341430487 145050785 /nfs/dbraw/zinc/05/07/85/145050785.db2.gz IMGIRWXKUYMYRE-CALCHBBNSA-N 1 3 338.540 2.671 10 0 EFAEHO C[NH+](C)CC[C@@H](NC(=O)CCN1CCc2ccccc2C1)C(C)(C)C ZINC000348908534 146023133 /nfs/dbraw/zinc/02/31/33/146023133.db2.gz GPIDXEXYOKDGBK-LJQANCHMSA-N 1 3 345.531 2.917 10 0 EFAEHO CN(CCN(C)C1CC[NH+](C)CC1)Cc1ccccc1OCC1CC1 ZINC000349080152 146049101 /nfs/dbraw/zinc/04/91/01/146049101.db2.gz SLHROJGHASFGGH-UHFFFAOYSA-N 1 3 345.531 2.933 10 0 EFAEHO CN(C)C[C@@H](Cc1ccccc1)NC(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000351917264 146234757 /nfs/dbraw/zinc/23/47/57/146234757.db2.gz OFGJCAACQOQFAP-MOPGFXCFSA-N 1 3 331.504 2.540 10 0 EFAEHO CN(C)C[C@@H](Cc1ccccc1)NC(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000351917264 146234759 /nfs/dbraw/zinc/23/47/59/146234759.db2.gz OFGJCAACQOQFAP-MOPGFXCFSA-N 1 3 331.504 2.540 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000352995497 146369375 /nfs/dbraw/zinc/36/93/75/146369375.db2.gz BTQPZZCVAKUOMY-VQVIJEGRSA-N 1 3 336.524 2.516 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000352995497 146369377 /nfs/dbraw/zinc/36/93/77/146369377.db2.gz BTQPZZCVAKUOMY-VQVIJEGRSA-N 1 3 336.524 2.516 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000355581809 147003640 /nfs/dbraw/zinc/00/36/40/147003640.db2.gz KVWFADINUWOBIV-LMMKCTJWSA-N 1 3 329.488 2.592 10 0 EFAEHO CC[C@H]1C[C@@H](C[NH+]2CCC(N3CCN(C(C)C)CC3)CC2)CCO1 ZINC000356994388 147394650 /nfs/dbraw/zinc/39/46/50/147394650.db2.gz OJKLYROKWFETOG-ICSRJNTNSA-N 1 3 337.552 2.682 10 0 EFAEHO OC1(C[NH2+]C2CCN(C3CCCCC3)CC2)Cc2ccccc2C1 ZINC000363788655 149012532 /nfs/dbraw/zinc/01/25/32/149012532.db2.gz MCQXIKPTYORGES-UHFFFAOYSA-N 1 3 328.500 2.903 10 0 EFAEHO c1ccc2nc(CCN[C@@H]3CCOC[C@H]3[C@H]3CCC[NH2+]3)ccc2c1 ZINC000422779009 296627914 /nfs/dbraw/zinc/62/79/14/296627914.db2.gz IBTZPXOHJPRHRM-DFQSSKMNSA-N 1 3 325.456 2.524 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000368094051 150034004 /nfs/dbraw/zinc/03/40/04/150034004.db2.gz VTJSJPNPWOWOMN-APWZRJJASA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000368094051 150034010 /nfs/dbraw/zinc/03/40/10/150034010.db2.gz VTJSJPNPWOWOMN-APWZRJJASA-N 1 3 341.515 2.970 10 0 EFAEHO CN1CCN(CC2(C)CC[NH+]([C@@H]3C[C@@H]3c3ccccc3)CC2)CC1 ZINC000368241746 150074506 /nfs/dbraw/zinc/07/45/06/150074506.db2.gz LXPOWNBKBMMEFJ-WOJBJXKFSA-N 1 3 327.516 2.892 10 0 EFAEHO C[C@H]1C[C@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)CC[N@@H+]1C ZINC000368317203 150092657 /nfs/dbraw/zinc/09/26/57/150092657.db2.gz WHCBXQBZAUEOGS-DOTOQJQBSA-N 1 3 331.504 2.710 10 0 EFAEHO C[C@H]1C[C@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)CC[N@H+]1C ZINC000368317203 150092659 /nfs/dbraw/zinc/09/26/59/150092659.db2.gz WHCBXQBZAUEOGS-DOTOQJQBSA-N 1 3 331.504 2.710 10 0 EFAEHO C[C@@H]1C[C@@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)CC[N@@H+]1C ZINC000368317206 150092754 /nfs/dbraw/zinc/09/27/54/150092754.db2.gz WHCBXQBZAUEOGS-WBVHZDCISA-N 1 3 331.504 2.710 10 0 EFAEHO C[C@@H]1C[C@@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)CC[N@H+]1C ZINC000368317206 150092756 /nfs/dbraw/zinc/09/27/56/150092756.db2.gz WHCBXQBZAUEOGS-WBVHZDCISA-N 1 3 331.504 2.710 10 0 EFAEHO C[C@@H]([NH2+][C@@H]1CCN(C2CCN(C)CC2)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000374703731 151398494 /nfs/dbraw/zinc/39/84/94/151398494.db2.gz SJJTVJSUFXHOMM-LMQGHGSNSA-N 1 3 327.516 2.937 10 0 EFAEHO COc1cc2c(cc1OC)CC[NH+](CC[C@@H]1CCCCN1C)CC2 ZINC000370496164 286258330 /nfs/dbraw/zinc/25/83/30/286258330.db2.gz KXDPAFAHGYWDBC-SFHVURJKSA-N 1 3 332.488 2.979 10 0 EFAEHO CC[C@@H]1C[C@H](C[N@H+](CCN(C)C)C[C@@H]2CCCN2CC)CCO1 ZINC000349039055 287302791 /nfs/dbraw/zinc/30/27/91/287302791.db2.gz WUHRPQJRYKDUOX-CEXWTWQISA-N 1 3 325.541 2.540 10 0 EFAEHO CC[C@@H]1C[C@H](C[N@@H+](CCN(C)C)C[C@@H]2CCCN2CC)CCO1 ZINC000349039055 287302792 /nfs/dbraw/zinc/30/27/92/287302792.db2.gz WUHRPQJRYKDUOX-CEXWTWQISA-N 1 3 325.541 2.540 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@H](CCO)C2)CC1 ZINC000093106432 544551225 /nfs/dbraw/zinc/55/12/25/544551225.db2.gz VFZZWICUZWGHEZ-LJQANCHMSA-N 1 3 345.531 2.813 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@H](CCO)C2)CC1 ZINC000093106432 544551227 /nfs/dbraw/zinc/55/12/27/544551227.db2.gz VFZZWICUZWGHEZ-LJQANCHMSA-N 1 3 345.531 2.813 10 0 EFAEHO O=C(c1ccccc1)N1CCC(CN[C@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000166660964 544851361 /nfs/dbraw/zinc/85/13/61/544851361.db2.gz SIXTZXNCQDXYPX-VQTJNVASSA-N 1 3 341.499 2.755 10 0 EFAEHO O=C(c1ccccc1)N1CCC(CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)CC1 ZINC000166660964 544851366 /nfs/dbraw/zinc/85/13/66/544851366.db2.gz SIXTZXNCQDXYPX-VQTJNVASSA-N 1 3 341.499 2.755 10 0 EFAEHO O=C(c1ccccc1)N1CCC(C[NH2+][C@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000166660964 544851368 /nfs/dbraw/zinc/85/13/68/544851368.db2.gz SIXTZXNCQDXYPX-VQTJNVASSA-N 1 3 341.499 2.755 10 0 EFAEHO COc1cccc(N2CC[C@H](CN[C@@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)c1 ZINC000166455439 544852347 /nfs/dbraw/zinc/85/23/47/544852347.db2.gz QROORKGZJYOVNS-KZNAEPCWSA-N 1 3 329.488 2.738 10 0 EFAEHO COc1cccc(N2CC[C@H](CN[C@@H]3CC[N@H+]4CCC[C@@H]4C3)C2)c1 ZINC000166455439 544852351 /nfs/dbraw/zinc/85/23/51/544852351.db2.gz QROORKGZJYOVNS-KZNAEPCWSA-N 1 3 329.488 2.738 10 0 EFAEHO COc1cccc(N2CC[C@H](C[NH2+][C@@H]3CCN4CCC[C@@H]4C3)C2)c1 ZINC000166455439 544852355 /nfs/dbraw/zinc/85/23/55/544852355.db2.gz QROORKGZJYOVNS-KZNAEPCWSA-N 1 3 329.488 2.738 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)CCOCC(F)(F)C(F)(F)F)[C@H](C)C1 ZINC000189688519 265197388 /nfs/dbraw/zinc/19/73/88/265197388.db2.gz IDVHUSSEFAISON-NEPJUHHUSA-N 1 3 332.357 2.863 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)CCOCC(F)(F)C(F)(F)F)[C@H](C)C1 ZINC000189688519 265197391 /nfs/dbraw/zinc/19/73/91/265197391.db2.gz IDVHUSSEFAISON-NEPJUHHUSA-N 1 3 332.357 2.863 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+](C)[C@H](C)Cc2ccc(O)cc2)CC1 ZINC000192761155 265307120 /nfs/dbraw/zinc/30/71/20/265307120.db2.gz BGCFKYWSUZJKNJ-GOSISDBHSA-N 1 3 333.520 2.671 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+](C)[C@H](C)Cc2ccc(O)cc2)CC1 ZINC000192761155 265307121 /nfs/dbraw/zinc/30/71/21/265307121.db2.gz BGCFKYWSUZJKNJ-GOSISDBHSA-N 1 3 333.520 2.671 10 0 EFAEHO CCC[N@H+](CCCN1CCN(C(C)C)CC1)C[C@H]1CCCCO1 ZINC000192767284 265307174 /nfs/dbraw/zinc/30/71/74/265307174.db2.gz VIDHIJITAGBFMJ-LJQANCHMSA-N 1 3 325.541 2.684 10 0 EFAEHO CCC[N@@H+](CCCN1CCN(C(C)C)CC1)C[C@H]1CCCCO1 ZINC000192767284 265307177 /nfs/dbraw/zinc/30/71/77/265307177.db2.gz VIDHIJITAGBFMJ-LJQANCHMSA-N 1 3 325.541 2.684 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCCCC[N@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000194148583 265364191 /nfs/dbraw/zinc/36/41/91/265364191.db2.gz NETAYNTVQSKSCI-KSZLIROESA-N 1 3 338.540 2.528 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000194148583 265364197 /nfs/dbraw/zinc/36/41/97/265364197.db2.gz NETAYNTVQSKSCI-KSZLIROESA-N 1 3 338.540 2.528 10 0 EFAEHO COC1(C[C@H](C)[NH2+]CCCN2CCN(c3ccncc3)CC2)CCC1 ZINC000277048918 267106965 /nfs/dbraw/zinc/10/69/65/267106965.db2.gz GXGLOBBCRUDLQR-SFHVURJKSA-N 1 3 346.519 2.531 10 0 EFAEHO COC1(C[C@H](C)[NH2+]Cc2ccccc2CN2CC[C@@H](O)C2)CCC1 ZINC000277240519 267135898 /nfs/dbraw/zinc/13/58/98/267135898.db2.gz ZSZISDSCSMJCBF-QFBILLFUSA-N 1 3 332.488 2.691 10 0 EFAEHO C[N@H+](Cc1ccccc1)CC(C)(C)CN1CC[C@@H](N2CCOCC2)C1 ZINC000121038788 273017579 /nfs/dbraw/zinc/01/75/79/273017579.db2.gz USFHBBOOQHHCBW-HXUWFJFHSA-N 1 3 345.531 2.551 10 0 EFAEHO C[N@@H+](Cc1ccccc1)CC(C)(C)CN1CC[C@@H](N2CCOCC2)C1 ZINC000121038788 273017580 /nfs/dbraw/zinc/01/75/80/273017580.db2.gz USFHBBOOQHHCBW-HXUWFJFHSA-N 1 3 345.531 2.551 10 0 EFAEHO CN(CCC[NH+]1CCCC1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000281760966 273466925 /nfs/dbraw/zinc/46/69/25/273466925.db2.gz QCKWZPXNQFCMQF-UHFFFAOYSA-N 1 3 329.488 2.840 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@H]1CCOc2ccc(Br)cc21 ZINC000422764768 274042670 /nfs/dbraw/zinc/04/26/70/274042670.db2.gz QHHSTGIFTVRTNM-OCCSQVGLSA-N 1 3 343.265 2.616 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]C[C@]1(N(C)C)CCSC1 ZINC000269004635 274355151 /nfs/dbraw/zinc/35/51/51/274355151.db2.gz VTTMHGYDBPITOT-YZGWKJHDSA-N 1 3 347.572 2.924 10 0 EFAEHO CC(C)C[NH+]1CCC(NC(=O)N[C@@H](CN(C)C)c2ccccc2)CC1 ZINC000045185154 275570198 /nfs/dbraw/zinc/57/01/98/275570198.db2.gz PEGKPYKBRVTVKK-IBGZPJMESA-N 1 3 346.519 2.709 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@@H](O)CC2)CC1 ZINC000354746711 276013130 /nfs/dbraw/zinc/01/31/30/276013130.db2.gz MFSQPMFIPDVQKG-LJQANCHMSA-N 1 3 331.504 2.565 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@@H](O)CC2)CC1 ZINC000354746711 276013131 /nfs/dbraw/zinc/01/31/31/276013131.db2.gz MFSQPMFIPDVQKG-LJQANCHMSA-N 1 3 331.504 2.565 10 0 EFAEHO CCN(C(=O)N[C@H]1CCC[NH2+]C1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418491948 276062660 /nfs/dbraw/zinc/06/26/60/276062660.db2.gz TXZRAELCTZQWIZ-NZSAHSFTSA-N 1 3 344.503 2.605 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)CC1 ZINC000136205722 276195484 /nfs/dbraw/zinc/19/54/84/276195484.db2.gz AKVPEUULAXBIQS-IBGZPJMESA-N 1 3 335.536 2.833 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000104410224 276364753 /nfs/dbraw/zinc/36/47/53/276364753.db2.gz LRYWWVGGRIEBEZ-MOPGFXCFSA-N 1 3 335.536 2.975 10 0 EFAEHO CN(c1ccccc1C[NH2+][C@H]1CCC[C@@H](CO)C1)C1CCN(C)CC1 ZINC000414574094 277003179 /nfs/dbraw/zinc/00/31/79/277003179.db2.gz MHGGUHGJRNEZEF-MJGOQNOKSA-N 1 3 345.531 2.858 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)[C@@H]2CCC[C@H]21 ZINC000353598517 277173126 /nfs/dbraw/zinc/17/31/26/277173126.db2.gz VZNYOWXJOXWTTJ-YDZRNGNQSA-N 1 3 342.487 2.755 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)[C@@H]2CCC[C@H]21 ZINC000353598517 277173127 /nfs/dbraw/zinc/17/31/27/277173127.db2.gz VZNYOWXJOXWTTJ-YDZRNGNQSA-N 1 3 342.487 2.755 10 0 EFAEHO CC(C)(CN1CCCC1)[NH2+]C[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000452091059 277298872 /nfs/dbraw/zinc/29/88/72/277298872.db2.gz ASOTXGNDAWJDLA-FQEVSTJZSA-N 1 3 345.531 2.742 10 0 EFAEHO COc1cc(C)c(C[NH2+]CCCCN2C[C@@H](C)O[C@H](C)C2)c(C)n1 ZINC000358969057 277372557 /nfs/dbraw/zinc/37/25/57/277372557.db2.gz BBPUCIXUJPFAFC-HZPDHXFCSA-N 1 3 335.492 2.686 10 0 EFAEHO COc1ccccc1N1CC[C@H](N[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)C1 ZINC000422878117 278055726 /nfs/dbraw/zinc/05/57/26/278055726.db2.gz SKWDAINIFWMHII-WNRNVDISSA-N 1 3 329.488 2.784 10 0 EFAEHO CC1(C)CCC[NH2+][C@@H]1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000261786881 278221066 /nfs/dbraw/zinc/22/10/66/278221066.db2.gz YODZOOVDBOHIKB-QZTJIDSGSA-N 1 3 329.488 2.718 10 0 EFAEHO C[C@H](c1ccccc1)N1CCC(NC(=O)[C@@H]2CCC[C@@H]2C[NH3+])CC1 ZINC000261797606 278311197 /nfs/dbraw/zinc/31/11/97/278311197.db2.gz QRWNRTBFCCLJTH-SZVBFZGTSA-N 1 3 329.488 2.703 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000355604846 279159280 /nfs/dbraw/zinc/15/92/80/279159280.db2.gz UHNZSRWNZNJEFA-NUJGCVRESA-N 1 3 334.508 2.707 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)NCCN1CCCC[C@@H]1C)CC(C)C ZINC000337391758 279162550 /nfs/dbraw/zinc/16/25/50/279162550.db2.gz ZWAMPJSLHFGFQS-ROUUACIJSA-N 1 3 340.556 2.917 10 0 EFAEHO CCN(Cc1ccc(C(=O)N2CC[C@@H]([NH3+])C(C)(C)C2)cc1)C1CC1 ZINC000261772334 279234972 /nfs/dbraw/zinc/23/49/72/279234972.db2.gz FTXLMEOXAPMOHY-GOSISDBHSA-N 1 3 329.488 2.870 10 0 EFAEHO C[C@H](CNC(=O)N[C@@H](CN(C)C)c1ccccc1)[N@@H+]1CCC[C@@H](C)C1 ZINC000248753001 279335282 /nfs/dbraw/zinc/33/52/82/279335282.db2.gz HLUZNGHECJLDER-LMMKCTJWSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@H](CNC(=O)N[C@@H](CN(C)C)c1ccccc1)[N@H+]1CCC[C@@H](C)C1 ZINC000248753001 279335285 /nfs/dbraw/zinc/33/52/85/279335285.db2.gz HLUZNGHECJLDER-LMMKCTJWSA-N 1 3 346.519 2.709 10 0 EFAEHO CCS(=O)(=O)c1c(Cl)cccc1CNCCCC[NH+](C)C ZINC000359069368 280029670 /nfs/dbraw/zinc/02/96/70/280029670.db2.gz MXLAIHOAEIUJSQ-UHFFFAOYSA-N 1 3 332.897 2.565 10 0 EFAEHO C[C@H](NC(=O)N[C@@H](CN(C)C)c1ccccc1)C(C)(C)C[NH+](C)C ZINC000120162577 292921163 /nfs/dbraw/zinc/92/11/63/292921163.db2.gz ITHFLMHCQYGLMU-RDJZCZTQSA-N 1 3 334.508 2.565 10 0 EFAEHO CCCN1CCN(c2ccccc2CNC[C@@H]2CC[N@H+](CC)C2)CC1 ZINC000151571821 293294103 /nfs/dbraw/zinc/29/41/03/293294103.db2.gz MAXKQKNRGMWYAQ-IBGZPJMESA-N 1 3 344.547 2.650 10 0 EFAEHO CCCN1CCN(c2ccccc2CNC[C@@H]2CC[N@@H+](CC)C2)CC1 ZINC000151571821 293294104 /nfs/dbraw/zinc/29/41/04/293294104.db2.gz MAXKQKNRGMWYAQ-IBGZPJMESA-N 1 3 344.547 2.650 10 0 EFAEHO COc1cc(CN2CC[C@@H](C3CC[NH+](C)CC3)C2)cc2c1OCCO2 ZINC000290588709 294127895 /nfs/dbraw/zinc/12/78/95/294127895.db2.gz VCVBXPMMDXRTIL-QGZVFWFLSA-N 1 3 346.471 2.630 10 0 EFAEHO CC[C@H](N[C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H](O)C(F)F ZINC000294970439 295252445 /nfs/dbraw/zinc/25/24/45/295252445.db2.gz FRNBEQATJMDVFP-BSWAZPDLSA-N 1 3 326.431 2.891 10 0 EFAEHO CC[C@H](N[C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H](O)C(F)F ZINC000294970439 295252446 /nfs/dbraw/zinc/25/24/46/295252446.db2.gz FRNBEQATJMDVFP-BSWAZPDLSA-N 1 3 326.431 2.891 10 0 EFAEHO Cc1cc(C[NH2+]CCCN2CCN(c3ccncc3)CC2)cs1 ZINC000295246553 295287389 /nfs/dbraw/zinc/28/73/89/295287389.db2.gz TWGACWGTXNLAKB-UHFFFAOYSA-N 1 3 330.501 2.753 10 0 EFAEHO Cc1ccc2c(CCN[C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)cn(C)c2c1 ZINC000423057055 301874683 /nfs/dbraw/zinc/87/46/83/301874683.db2.gz GRTXOUWFDQCZHC-HSALFYBXSA-N 1 3 341.499 2.776 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@H](Cc1ccccc1)CN(C)C ZINC000422709144 302588375 /nfs/dbraw/zinc/58/83/75/302588375.db2.gz CWOTVVCRQFIEDH-VQIMIIECSA-N 1 3 326.488 2.672 10 0 EFAEHO COC(=O)[C@@H]1CCCCC[C@@H]1[NH2+]C1CCN(c2ccncc2)CC1 ZINC000297435434 310894719 /nfs/dbraw/zinc/89/47/19/310894719.db2.gz NRKUJCLCQQNGMF-MSOLQXFVSA-N 1 3 331.460 2.762 10 0 EFAEHO COc1cc(C[NH2+]C2CCN(C3CCC3)CC2)cc(OC)c1OC ZINC000299313829 311071905 /nfs/dbraw/zinc/07/19/05/311071905.db2.gz GDFKFTHRYKMFJZ-UHFFFAOYSA-N 1 3 334.460 2.819 10 0 EFAEHO CCc1c(C)[nH+]c2ccccc2c1N1CCN([C@H](CC)CO)CC1 ZINC000302075509 311176698 /nfs/dbraw/zinc/17/66/98/311176698.db2.gz XSDZYFZSEXHYMX-MRXNPFEDSA-N 1 3 327.472 2.999 10 0 EFAEHO CCc1c(C)[nH+]c2ccccc2c1N1CCN([C@@H](CC)CO)CC1 ZINC000302075508 311176744 /nfs/dbraw/zinc/17/67/44/311176744.db2.gz XSDZYFZSEXHYMX-INIZCTEOSA-N 1 3 327.472 2.999 10 0 EFAEHO Cc1nc2ccccc2nc1CN1CCC([C@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000333827101 311664377 /nfs/dbraw/zinc/66/43/77/311664377.db2.gz IRQLNCHOVULCTM-OXJNMPFZSA-N 1 3 340.471 2.657 10 0 EFAEHO Cc1ncccc1C[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000397511087 311960759 /nfs/dbraw/zinc/96/07/59/311960759.db2.gz NTEGJBSLOIMORW-UHFFFAOYSA-N 1 3 325.456 2.507 10 0 EFAEHO C[C@@H]([NH2+]CCCN1CCCC1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000400730090 311970799 /nfs/dbraw/zinc/97/07/99/311970799.db2.gz QJWMMZDDSHNBFQ-CVEARBPZSA-N 1 3 325.497 2.707 10 0 EFAEHO C[C@@H](N)[C@@H](C)[NH2+]C1CCN(Cc2ccccc2Br)CC1 ZINC000415023326 312078798 /nfs/dbraw/zinc/07/87/98/312078798.db2.gz WTGYLMNPYGDSTM-CHWSQXEVSA-N 1 3 340.309 2.739 10 0 EFAEHO C[C@@H]([NH3+])[C@@H](C)NC1CCN(Cc2ccccc2Br)CC1 ZINC000415023326 312078801 /nfs/dbraw/zinc/07/88/01/312078801.db2.gz WTGYLMNPYGDSTM-CHWSQXEVSA-N 1 3 340.309 2.739 10 0 EFAEHO [NH3+]C[C@H]1CC[C@@H](NCc2cn(-c3ccc(Cl)cc3Cl)nn2)C1 ZINC000415027623 312079357 /nfs/dbraw/zinc/07/93/57/312079357.db2.gz BJPCJTJUGJPNBP-CMPLNLGQSA-N 1 3 340.258 2.791 10 0 EFAEHO C[C@@H](CCc1ccc(OC(F)F)cc1)[NH2+]C[C@@H]1CNCCCO1 ZINC000415038440 312081382 /nfs/dbraw/zinc/08/13/82/312081382.db2.gz LZKPUGASULQKAI-BBRMVZONSA-N 1 3 328.403 2.577 10 0 EFAEHO C[C@@H](CCc1ccc(OC(F)F)cc1)NC[C@@H]1C[NH2+]CCCO1 ZINC000415038440 312081384 /nfs/dbraw/zinc/08/13/84/312081384.db2.gz LZKPUGASULQKAI-BBRMVZONSA-N 1 3 328.403 2.577 10 0 EFAEHO C[C@@H](CCCCN1C(=O)c2ccccc2C1=O)N[C@@H]1CCCC[NH2+]C1 ZINC000415079228 312089266 /nfs/dbraw/zinc/08/92/66/312089266.db2.gz WPKQXKJOLRBOKJ-JKSUJKDBSA-N 1 3 343.471 2.573 10 0 EFAEHO O=C1N[C@@H]2CN(CCCC3CCCCC3)CC[C@H]2N1C1CC[NH2+]CC1 ZINC000415134383 312100459 /nfs/dbraw/zinc/10/04/59/312100459.db2.gz DRCMZWASVWZWCS-RTBURBONSA-N 1 3 348.535 2.567 10 0 EFAEHO C[NH+](C)CCc1ccccc1NC(=O)NC[C@@H](N)c1ccccc1 ZINC000415559085 312152180 /nfs/dbraw/zinc/15/21/80/312152180.db2.gz FBTVAZIJYKIRAK-QGZVFWFLSA-N 1 3 326.444 2.612 10 0 EFAEHO CNCc1cccc(NC(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C(C)C)c1 ZINC000415947245 312183078 /nfs/dbraw/zinc/18/30/78/312183078.db2.gz WFGUQKWHOGFRAP-MSOLQXFVSA-N 1 3 330.476 2.885 10 0 EFAEHO CNCc1cccc(NC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1 ZINC000415947245 312183079 /nfs/dbraw/zinc/18/30/79/312183079.db2.gz WFGUQKWHOGFRAP-MSOLQXFVSA-N 1 3 330.476 2.885 10 0 EFAEHO C[C@@H](NC(=O)Nc1ccc2c(c1F)CCNC2)C(C)(C)C[NH+](C)C ZINC000415948834 312183823 /nfs/dbraw/zinc/18/38/23/312183823.db2.gz ATLXSQHQJDFILZ-GFCCVEGCSA-N 1 3 336.455 2.569 10 0 EFAEHO CN(C)CCN(C(=O)Nc1ccc2c(c1F)CC[NH2+]C2)C1CCCC1 ZINC000415954598 312184651 /nfs/dbraw/zinc/18/46/51/312184651.db2.gz KTZHHAQSCIUVRZ-UHFFFAOYSA-N 1 3 348.466 2.810 10 0 EFAEHO CN1CCC2(CCCN2C(=O)Nc2ccc3c(c2F)CC[NH2+]C3)CC1 ZINC000415963335 312186485 /nfs/dbraw/zinc/18/64/85/312186485.db2.gz VGZXWCDZQJDXSQ-UHFFFAOYSA-N 1 3 346.450 2.564 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)NC[C@@H](N)c1ccccc1 ZINC000417556759 312239470 /nfs/dbraw/zinc/23/94/70/312239470.db2.gz PXLSWLOIVSAUCL-ZWKOTPCHSA-N 1 3 332.492 2.640 10 0 EFAEHO CCCC[N@H+]1CCCC[C@H]1CNC(=O)NC[C@@H](N)c1ccccc1 ZINC000417556759 312239473 /nfs/dbraw/zinc/23/94/73/312239473.db2.gz PXLSWLOIVSAUCL-ZWKOTPCHSA-N 1 3 332.492 2.640 10 0 EFAEHO CN(C)C(=O)c1ccccc1CN1CCC(C[NH+]2CCCC2)CC1 ZINC000417712642 312259941 /nfs/dbraw/zinc/25/99/41/312259941.db2.gz QSYFXYRPIYCDQP-UHFFFAOYSA-N 1 3 329.488 2.696 10 0 EFAEHO CC[NH+](CC)CC1CCN(Cc2ccccc2C(=O)N(C)C)CC1 ZINC000417719190 312261088 /nfs/dbraw/zinc/26/10/88/312261088.db2.gz WNBCDKBZGLOZPY-UHFFFAOYSA-N 1 3 331.504 2.942 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)NC[C@H]2N(C)CCCC2(C)C)cc1 ZINC000418096444 312324864 /nfs/dbraw/zinc/32/48/64/312324864.db2.gz IQOQJTARANFBBS-RHSMWYFYSA-N 1 3 332.492 2.626 10 0 EFAEHO C[C@H](NC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@H](c1ccccc1)N(C)C ZINC000418163456 312337988 /nfs/dbraw/zinc/33/79/88/312337988.db2.gz DKYJIANRNZXPBJ-KEVQOFRZSA-N 1 3 344.503 2.602 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)NC[C@@H]([NH3+])c1ccccc1)c1ccco1 ZINC000418168368 312338658 /nfs/dbraw/zinc/33/86/58/312338658.db2.gz OBUFADFEVYCMLT-USXIJHARSA-N 1 3 344.459 2.708 10 0 EFAEHO CCCN(C)[C@H](CNC(=O)N[C@H](C)[C@H](C)[NH3+])c1ccc(Cl)cc1 ZINC000418191678 312344027 /nfs/dbraw/zinc/34/40/27/312344027.db2.gz XRSNIXWSGWAQQE-WOSRLPQWSA-N 1 3 340.899 2.758 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)N[C@H](C)[C@@H](C)[NH3+])N(CC)CC)cc1 ZINC000418221898 312349468 /nfs/dbraw/zinc/34/94/68/312349468.db2.gz WIBLSTNAQVDZST-RKVPGOIHSA-N 1 3 334.508 2.667 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2CC[C@H](OC)C2)CC1 ZINC000471814653 313161991 /nfs/dbraw/zinc/16/19/91/313161991.db2.gz DWKPTYPVJUIXPA-MOPGFXCFSA-N 1 3 331.504 2.876 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2CC[C@H](OC)C2)CC1 ZINC000471814654 313162216 /nfs/dbraw/zinc/16/22/16/313162216.db2.gz DWKPTYPVJUIXPA-OALUTQOASA-N 1 3 331.504 2.876 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]Cc2ccc(C(=O)NCCN3CCCC3)cc2)[C@H]1C ZINC000495056711 314663650 /nfs/dbraw/zinc/66/36/50/314663650.db2.gz CXHLMIOQMYKUEZ-GJYPPUQNSA-N 1 3 329.488 2.646 10 0 EFAEHO CCC[C@@H](NC(=O)N(CCN(C)C)CC[NH+](C)C)C1CCCCC1 ZINC000524920524 316181371 /nfs/dbraw/zinc/18/13/71/316181371.db2.gz GATDPUVBABPOOQ-GOSISDBHSA-N 1 3 340.556 2.870 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@]1(C)COc2ccccc2O1 ZINC000530211046 317081390 /nfs/dbraw/zinc/08/13/90/317081390.db2.gz LYDJBXUQBSADDP-DJJJIMSYSA-N 1 3 327.428 2.729 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@]1(C)COc2ccccc2O1 ZINC000530211047 317081664 /nfs/dbraw/zinc/08/16/64/317081664.db2.gz LYDJBXUQBSADDP-ORAYPTAESA-N 1 3 327.428 2.729 10 0 EFAEHO Cc1ccc(C)c(OCCN2CCC(CO[C@@H]3CC[NH2+]C3)CC2)c1 ZINC000530238957 317088829 /nfs/dbraw/zinc/08/88/29/317088829.db2.gz QVINEDSHLBLLQC-LJQANCHMSA-N 1 3 332.488 2.773 10 0 EFAEHO CCOc1ccccc1OCCN1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530244200 317089602 /nfs/dbraw/zinc/08/96/02/317089602.db2.gz ZJFIMIRFJRQQQX-SFHVURJKSA-N 1 3 348.487 2.555 10 0 EFAEHO COc1c(C)cc(CN2CCC(CO[C@H]3CC[NH2+]C3)CC2)cc1C ZINC000530248574 317091198 /nfs/dbraw/zinc/09/11/98/317091198.db2.gz MTSQYAUTQKHDBG-IBGZPJMESA-N 1 3 332.488 2.903 10 0 EFAEHO c1[nH]nc(-c2ccccc2)c1CN1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530249078 317091278 /nfs/dbraw/zinc/09/12/78/317091278.db2.gz TYJQGIVSYCBECI-LJQANCHMSA-N 1 3 340.471 2.667 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@](C)(O)CCC)CC1 ZINC000532041010 317346312 /nfs/dbraw/zinc/34/63/12/317346312.db2.gz TXYBJEDSEUPUCS-FQEVSTJZSA-N 1 3 333.520 2.859 10 0 EFAEHO C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)CCN(C)c2ccncc2)C1 ZINC000541856169 317792814 /nfs/dbraw/zinc/79/28/14/317792814.db2.gz JMXCTEFZVUGISF-ROUUACIJSA-N 1 3 346.519 2.782 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1[C@@H]1CCCN(C(=O)CCN(C)c2ccncc2)C1 ZINC000541857507 317793601 /nfs/dbraw/zinc/79/36/01/317793601.db2.gz KXYDUDMUUROVCL-ZHALLVOQSA-N 1 3 344.503 2.772 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)NCC(C)(C)C1=CCCCC1 ZINC000547859001 318049499 /nfs/dbraw/zinc/04/94/99/318049499.db2.gz SCQFFJCUBVRCQY-UHFFFAOYSA-N 1 3 338.540 2.648 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccc(OCC(F)(F)F)nc2)[C@@H]2CCC[C@@H]21 ZINC000552033333 318238884 /nfs/dbraw/zinc/23/88/84/318238884.db2.gz ZBVFBDSLLWOBQV-KKUMJFAQSA-N 1 3 343.393 2.985 10 0 EFAEHO C[C@H]([NH2+]CC(=O)NC1CCN(C2CC2)CC1)C(C)(C)c1ccccc1 ZINC000553284921 318278084 /nfs/dbraw/zinc/27/80/84/318278084.db2.gz KHRKOZXCIKNDOW-INIZCTEOSA-N 1 3 343.515 2.685 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3[NH2+]2)N(C)C)cc1 ZINC000554302506 318306707 /nfs/dbraw/zinc/30/67/07/318306707.db2.gz NYPYJJZKOUFGNV-FYQPLNBISA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000554597692 318327710 /nfs/dbraw/zinc/32/77/10/318327710.db2.gz UGFMMSRNVZOKPO-QZTJIDSGSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000554597692 318327713 /nfs/dbraw/zinc/32/77/13/318327713.db2.gz UGFMMSRNVZOKPO-QZTJIDSGSA-N 1 3 343.515 2.877 10 0 EFAEHO Cc1ccc(OC[C@@H](O)CNCc2ccc(CC[NH+](C)C)cc2)cc1 ZINC000564863995 318902445 /nfs/dbraw/zinc/90/24/45/318902445.db2.gz LBZXFHBCJNHFNB-FQEVSTJZSA-N 1 3 342.483 2.629 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NCCC3=CCCC3)CC2)CC1 ZINC000565844636 319008699 /nfs/dbraw/zinc/00/86/99/319008699.db2.gz YGCUPKGQXYZMNI-UHFFFAOYSA-N 1 3 333.520 2.799 10 0 EFAEHO C[C@H]1CN(C(=O)NCc2ccccc2CN2CCCCC2)CC[C@H]1[NH3+] ZINC000567454209 319172619 /nfs/dbraw/zinc/17/26/19/319172619.db2.gz NRJBRMYBFINDSE-QFBILLFUSA-N 1 3 344.503 2.551 10 0 EFAEHO C[C@H]1CN(C(=O)NCc2ccccc2CN2CCCCC2)CC[C@@H]1[NH3+] ZINC000567454208 319172644 /nfs/dbraw/zinc/17/26/44/319172644.db2.gz NRJBRMYBFINDSE-LPHOPBHVSA-N 1 3 344.503 2.551 10 0 EFAEHO O=C1C[C@@H](N[C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CN1C1CC1 ZINC000568984243 319336864 /nfs/dbraw/zinc/33/68/64/319336864.db2.gz SMVMOFYZWVEOPV-ZWKOTPCHSA-N 1 3 339.483 2.537 10 0 EFAEHO O=C1C[C@@H](N[C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CN1C1CC1 ZINC000568984243 319336867 /nfs/dbraw/zinc/33/68/67/319336867.db2.gz SMVMOFYZWVEOPV-ZWKOTPCHSA-N 1 3 339.483 2.537 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN[C@@H](C)C[NH+]1CCC(C)CC1 ZINC000569259514 319364476 /nfs/dbraw/zinc/36/44/76/319364476.db2.gz CHMDSIRLXVYAAB-INIZCTEOSA-N 1 3 327.476 2.786 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1C[NH2+][C@@H](C)CN1CCC(C)CC1 ZINC000569259514 319364478 /nfs/dbraw/zinc/36/44/78/319364478.db2.gz CHMDSIRLXVYAAB-INIZCTEOSA-N 1 3 327.476 2.786 10 0 EFAEHO CCO[C@@H]1C[C@H](N[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)[C@H]1n1cccn1 ZINC000569330374 319370355 /nfs/dbraw/zinc/37/03/55/319370355.db2.gz VGTYYAOMEVRINN-JWXAEQQXSA-N 1 3 332.492 2.502 10 0 EFAEHO O[C@H](C[NH2+]Cc1ccc(CN2CCC(O)CC2)cc1)CC1CCCC1 ZINC000569352475 319372930 /nfs/dbraw/zinc/37/29/30/319372930.db2.gz PLRGTVYXWXSMPS-NRFANRHFSA-N 1 3 346.515 2.674 10 0 EFAEHO CC(C)(CNC(=O)Nc1ccc2c(c1F)CCNC2)C[NH+]1CCCC1 ZINC000574739838 319889653 /nfs/dbraw/zinc/88/96/53/319889653.db2.gz NHPDJZVYICMWKL-UHFFFAOYSA-N 1 3 348.466 2.715 10 0 EFAEHO C[C@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@@H+]1CCCC[C@H]1C ZINC000576610233 320032655 /nfs/dbraw/zinc/03/26/55/320032655.db2.gz MYOHRGWQKDCOEA-ZIAGYGMSSA-N 1 3 348.466 2.856 10 0 EFAEHO C[C@H](CNC(=O)Nc1ccc2c(c1F)CCNC2)[N@H+]1CCCC[C@H]1C ZINC000576610233 320032656 /nfs/dbraw/zinc/03/26/56/320032656.db2.gz MYOHRGWQKDCOEA-ZIAGYGMSSA-N 1 3 348.466 2.856 10 0 EFAEHO CC(C)Oc1ccc([C@H](CNC(=O)C[N@@H+]2CC[C@@H](C)C2)N(C)C)cc1 ZINC000576956097 320064869 /nfs/dbraw/zinc/06/48/69/320064869.db2.gz XBYJAYZBIDXCGO-APWZRJJASA-N 1 3 347.503 2.535 10 0 EFAEHO CC(C)Oc1ccc([C@H](CNC(=O)C[N@H+]2CC[C@@H](C)C2)N(C)C)cc1 ZINC000576956097 320064871 /nfs/dbraw/zinc/06/48/71/320064871.db2.gz XBYJAYZBIDXCGO-APWZRJJASA-N 1 3 347.503 2.535 10 0 EFAEHO CC[N@H+](CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1)CC(C)C ZINC000577624940 320129311 /nfs/dbraw/zinc/12/93/11/320129311.db2.gz ZDGHCWHSPBIXMI-GOSISDBHSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[N@@H+](CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1)CC(C)C ZINC000577624940 320129313 /nfs/dbraw/zinc/12/93/13/320129313.db2.gz ZDGHCWHSPBIXMI-GOSISDBHSA-N 1 3 337.552 2.935 10 0 EFAEHO N[C@@H]1CCC[C@H]1[NH2+][C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000579944639 324063167 /nfs/dbraw/zinc/06/31/67/324063167.db2.gz LMJZZAKBOMERCC-CYZMBNFOSA-N 1 3 348.800 2.802 10 0 EFAEHO C[C@H](NCCC1=CC[NH2+]CC1)c1ccc(-n2cncn2)cc1Cl ZINC000580062582 324088188 /nfs/dbraw/zinc/08/81/88/324088188.db2.gz BRCWEFZMUBRBHI-ZDUSSCGKSA-N 1 3 331.851 2.881 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CNC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000580626302 324200247 /nfs/dbraw/zinc/20/02/47/324200247.db2.gz OUGQCDFOPPNLAT-UHFFFAOYSA-N 1 3 327.476 2.975 10 0 EFAEHO COCCN(C)CCC[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000580714395 324219034 /nfs/dbraw/zinc/21/90/34/324219034.db2.gz ZQMPNHDGBPJYLY-FQEVSTJZSA-N 1 3 345.531 2.742 10 0 EFAEHO C[C@H](CCNC(=O)N1CCc2ccccc2[C@@H]1CN)[NH+]1CCCCC1 ZINC000580713038 324219620 /nfs/dbraw/zinc/21/96/20/324219620.db2.gz PDRVZOCVDISCCD-APWZRJJASA-N 1 3 344.503 2.519 10 0 EFAEHO NC(=O)C1CCN(Cc2ccc(C[NH2+][C@@H]3CCCC34CC4)cc2)CC1 ZINC000583824229 324878787 /nfs/dbraw/zinc/87/87/87/324878787.db2.gz WZMWGWFCPGKURA-LJQANCHMSA-N 1 3 341.499 2.806 10 0 EFAEHO CN1CCC[C@@H]1CNC(=O)NCc1ccccc1C[NH+]1CCCCC1 ZINC000139440237 473231770 /nfs/dbraw/zinc/23/17/70/473231770.db2.gz GPWNLSWZJYANAM-LJQANCHMSA-N 1 3 344.503 2.566 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCC[C@@H]3C[N@H+](C)CC[C@H]32)c1 ZINC000124590785 473270730 /nfs/dbraw/zinc/27/07/30/473270730.db2.gz JSMKAHVCKKGNNN-SJLPKXTDSA-N 1 3 330.476 2.696 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c1 ZINC000124590785 473270739 /nfs/dbraw/zinc/27/07/39/473270739.db2.gz JSMKAHVCKKGNNN-SJLPKXTDSA-N 1 3 330.476 2.696 10 0 EFAEHO CCC[C@@H](C(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)N(C)C ZINC000161846397 473270838 /nfs/dbraw/zinc/27/08/38/473270838.db2.gz KKPMYXKNZFQCPI-RDJZCZTQSA-N 1 3 337.533 2.807 10 0 EFAEHO CCC[C@@H](C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)N(C)C ZINC000161846397 473270845 /nfs/dbraw/zinc/27/08/45/473270845.db2.gz KKPMYXKNZFQCPI-RDJZCZTQSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[NH+](CC)CCOc1ccccc1NC(=O)N1CC[C@H](N(C)C)C1 ZINC000171074536 473273868 /nfs/dbraw/zinc/27/38/68/473273868.db2.gz FHTZFIWZGSMCMI-INIZCTEOSA-N 1 3 348.491 2.575 10 0 EFAEHO CCC[C@@H](C(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1)N(C)C ZINC000161846637 473270718 /nfs/dbraw/zinc/27/07/18/473270718.db2.gz KKPMYXKNZFQCPI-WBVHZDCISA-N 1 3 337.533 2.807 10 0 EFAEHO CCC[C@@H](C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)N(C)C ZINC000161846637 473270724 /nfs/dbraw/zinc/27/07/24/473270724.db2.gz KKPMYXKNZFQCPI-WBVHZDCISA-N 1 3 337.533 2.807 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](NC(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000177468043 473384221 /nfs/dbraw/zinc/38/42/21/473384221.db2.gz BFNKGIGREKEIOY-RTBURBONSA-N 1 3 329.488 2.885 10 0 EFAEHO Cc1ccc2c(c1)[C@@H]([NH2+]C1CCN(CCN(C)C)CC1)CCCO2 ZINC000150976653 473391094 /nfs/dbraw/zinc/39/10/94/473391094.db2.gz ZAZRJJUABVZWPD-IBGZPJMESA-N 1 3 331.504 2.824 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC000625361036 479885876 /nfs/dbraw/zinc/88/58/76/479885876.db2.gz DCRPEMJJVBOPLE-KVPLUYHFSA-N 1 3 343.515 2.711 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000625361036 479885881 /nfs/dbraw/zinc/88/58/81/479885881.db2.gz DCRPEMJJVBOPLE-KVPLUYHFSA-N 1 3 343.515 2.711 10 0 EFAEHO COc1ccc([C@@H](NC2CCN(C3CC3)CC2)[C@@H]2CCC[NH2+]2)cc1 ZINC000422798347 476780975 /nfs/dbraw/zinc/78/09/75/476780975.db2.gz QSLVLXGEHAMZFO-VQTJNVASSA-N 1 3 329.488 2.705 10 0 EFAEHO C[C@H]1OCC[C@H]1N(CCO)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000411658602 477314461 /nfs/dbraw/zinc/31/44/61/477314461.db2.gz CQPANGNYPFXANP-YLJYHZDGSA-N 1 3 332.488 2.644 10 0 EFAEHO OCCNCCC[NH2+]Cc1ccc(OCc2ccc(Cl)cc2)cc1 ZINC000013732771 471841163 /nfs/dbraw/zinc/84/11/63/471841163.db2.gz NCEXQGDBOYDWSW-UHFFFAOYSA-N 1 3 348.874 2.981 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000067705086 472075776 /nfs/dbraw/zinc/07/57/76/472075776.db2.gz CWVPJNFTOYUDMP-AEFFLSMTSA-N 1 3 334.508 2.627 10 0 EFAEHO Cc1ccccc1[C@@H]1CCCN1CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000068299280 472165364 /nfs/dbraw/zinc/16/53/64/472165364.db2.gz UDWPUQNEANAADI-FQEVSTJZSA-N 1 3 341.499 2.875 10 0 EFAEHO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)N[C@@H](CN(C)C)c1ccccc1 ZINC000056786252 472351547 /nfs/dbraw/zinc/35/15/47/472351547.db2.gz MHDGFIBWJVWQAT-LMMKCTJWSA-N 1 3 346.519 2.709 10 0 EFAEHO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N[C@@H](CN(C)C)c1ccccc1 ZINC000056786252 472351553 /nfs/dbraw/zinc/35/15/53/472351553.db2.gz MHDGFIBWJVWQAT-LMMKCTJWSA-N 1 3 346.519 2.709 10 0 EFAEHO CC(C)[N@@H+]1C[C@@H](C)[C@@H](Nc2cccc(CN3CCC(O)CC3)c2)C1 ZINC000088726230 472381129 /nfs/dbraw/zinc/38/11/29/472381129.db2.gz PEYFKWGZBTZVPI-UZLBHIALSA-N 1 3 331.504 2.784 10 0 EFAEHO CC(C)[N@H+]1C[C@@H](C)[C@@H](Nc2cccc(CN3CCC(O)CC3)c2)C1 ZINC000088726230 472381132 /nfs/dbraw/zinc/38/11/32/472381132.db2.gz PEYFKWGZBTZVPI-UZLBHIALSA-N 1 3 331.504 2.784 10 0 EFAEHO CN(Cc1ccc(Br)s1)CC1CC[NH+](CCO)CC1 ZINC000069894322 472460378 /nfs/dbraw/zinc/46/03/78/472460378.db2.gz YTZAGOKSIPWWLE-UHFFFAOYSA-N 1 3 347.322 2.647 10 0 EFAEHO CN(C)C[C@@H](NC(=O)c1cccc(C[NH+](C)C)c1)c1ccccc1 ZINC000155541070 472564808 /nfs/dbraw/zinc/56/48/08/472564808.db2.gz YMSGCOUFWZWAFE-LJQANCHMSA-N 1 3 325.456 2.781 10 0 EFAEHO C[C@@H](CNC(=O)NC1CCC(C[NH+](C)C)CC1)N1CCC[C@H](C)C1 ZINC000119723922 472579092 /nfs/dbraw/zinc/57/90/92/472579092.db2.gz UHAHAGQZKZRYJN-VYMRPNJYSA-N 1 3 338.540 2.526 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NCCc2ncc(CC)s2)[C@@H](C)C1 ZINC000130255090 472593645 /nfs/dbraw/zinc/59/36/45/472593645.db2.gz OVPINKOOKLJXAT-RDJZCZTQSA-N 1 3 339.549 2.975 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NCCc2ncc(CC)s2)[C@@H](C)C1 ZINC000130255090 472593649 /nfs/dbraw/zinc/59/36/49/472593649.db2.gz OVPINKOOKLJXAT-RDJZCZTQSA-N 1 3 339.549 2.975 10 0 EFAEHO CN(C)[C@@H]1CCCN(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000105091410 472720969 /nfs/dbraw/zinc/72/09/69/472720969.db2.gz BXECUSVPWOWDPR-LJQANCHMSA-N 1 3 344.503 2.518 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000105148815 472727305 /nfs/dbraw/zinc/72/73/05/472727305.db2.gz KHMZDFLJMHJZLR-QZTJIDSGSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[N@@H+]1CC[C@H](Nc2ccc(OC3CCN(C)CC3)nc2)[C@H](C)C1 ZINC000132739019 472752026 /nfs/dbraw/zinc/75/20/26/472752026.db2.gz ADNPNMKNJNLMFU-QAPCUYQASA-N 1 3 332.492 2.697 10 0 EFAEHO CC[N@H+]1CC[C@H](Nc2ccc(OC3CCN(C)CC3)nc2)[C@H](C)C1 ZINC000132739019 472752030 /nfs/dbraw/zinc/75/20/30/472752030.db2.gz ADNPNMKNJNLMFU-QAPCUYQASA-N 1 3 332.492 2.697 10 0 EFAEHO Cc1cccc(OC[C@H](O)CN2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000047972286 472790723 /nfs/dbraw/zinc/79/07/23/472790723.db2.gz KROZJARTZZGRGS-LJQANCHMSA-N 1 3 332.488 2.543 10 0 EFAEHO C[N@@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000157304357 472805570 /nfs/dbraw/zinc/80/55/70/472805570.db2.gz DNIFOMYMLOATLK-UXHICEINSA-N 1 3 341.499 2.839 10 0 EFAEHO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000157304357 472805579 /nfs/dbraw/zinc/80/55/79/472805579.db2.gz DNIFOMYMLOATLK-UXHICEINSA-N 1 3 341.499 2.839 10 0 EFAEHO CC(C)[C@@H](C(=O)NCc1ccccc1C[NH+]1CCCCC1)N(C)C ZINC000106427649 472851066 /nfs/dbraw/zinc/85/10/66/472851066.db2.gz VIRRXWCJETUXLN-IBGZPJMESA-N 1 3 331.504 2.875 10 0 EFAEHO c1ncn(-c2ccc(CN3CC[C@@H]4[C@H](CCC[N@@H+]4C4CC4)C3)cc2)n1 ZINC000092066920 472851695 /nfs/dbraw/zinc/85/16/95/472851695.db2.gz AXCZFVWQTNRFRI-YLJYHZDGSA-N 1 3 337.471 2.716 10 0 EFAEHO c1ncn(-c2ccc(CN3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)cc2)n1 ZINC000092066920 472851700 /nfs/dbraw/zinc/85/17/00/472851700.db2.gz AXCZFVWQTNRFRI-YLJYHZDGSA-N 1 3 337.471 2.716 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NCCCC[NH+]1CCC(C)CC1 ZINC000079389684 472856288 /nfs/dbraw/zinc/85/62/88/472856288.db2.gz UVRZZQSCKJOIIP-SFHVURJKSA-N 1 3 340.556 2.774 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](CC)CCC(=O)OC)CC1 ZINC000092380104 472904046 /nfs/dbraw/zinc/90/40/46/472904046.db2.gz HDDMSBSVYOPZFF-UHFFFAOYSA-N 1 3 347.503 2.604 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](CC)CCC(=O)OC)CC1 ZINC000092380104 472904049 /nfs/dbraw/zinc/90/40/49/472904049.db2.gz HDDMSBSVYOPZFF-UHFFFAOYSA-N 1 3 347.503 2.604 10 0 EFAEHO c1nc2sc3c(c2c(NCCCC[NH+]2CCCC2)n1)CCNC3 ZINC000065386634 472930744 /nfs/dbraw/zinc/93/07/44/472930744.db2.gz LYTFGEBHVYLNPZ-UHFFFAOYSA-N 1 3 331.489 2.625 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)N(C)C ZINC000620191718 480021606 /nfs/dbraw/zinc/02/16/06/480021606.db2.gz BYCSDRQRQBFHAP-MOPGFXCFSA-N 1 3 343.515 2.745 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)N(C)C ZINC000620191718 480021608 /nfs/dbraw/zinc/02/16/08/480021608.db2.gz BYCSDRQRQBFHAP-MOPGFXCFSA-N 1 3 343.515 2.745 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)CC1 ZINC000136205686 473143202 /nfs/dbraw/zinc/14/32/02/473143202.db2.gz AKVPEUULAXBIQS-LJQANCHMSA-N 1 3 335.536 2.833 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C)C[C@H]2CCOC2)CC1 ZINC000093839956 473149877 /nfs/dbraw/zinc/14/98/77/473149877.db2.gz GQDTXQBBBQOTPA-GOSISDBHSA-N 1 3 331.504 2.687 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C)C[C@H]2CCOC2)CC1 ZINC000093839956 473149887 /nfs/dbraw/zinc/14/98/87/473149887.db2.gz GQDTXQBBBQOTPA-GOSISDBHSA-N 1 3 331.504 2.687 10 0 EFAEHO CCN(C)c1ccc(CNCc2ccc(OCC[NH+](C)C)cc2)cn1 ZINC000190785369 473393338 /nfs/dbraw/zinc/39/33/38/473393338.db2.gz BVXVGVDMMSDUQX-UHFFFAOYSA-N 1 3 342.487 2.768 10 0 EFAEHO CC[C@H]([NH2+]C[C@@H]1CCN(CC)C1)c1ccccc1OCC(=O)N(C)C ZINC000163282988 473429486 /nfs/dbraw/zinc/42/94/86/473429486.db2.gz DBQKFHYTUPHCBM-WMZOPIPTSA-N 1 3 347.503 2.536 10 0 EFAEHO CN(C)CCN1CCC([NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000166117579 473521703 /nfs/dbraw/zinc/52/17/03/473521703.db2.gz FQYOCBHPNSKZTE-GHTZIAJQSA-N 1 3 345.531 2.770 10 0 EFAEHO CC(C)N1CCN(CCC[N@H+](C[C@@H]2CCCO2)C2CCCC2)CC1 ZINC000191512529 473548863 /nfs/dbraw/zinc/54/88/63/473548863.db2.gz PVINSGFTJVOKCJ-FQEVSTJZSA-N 1 3 337.552 2.826 10 0 EFAEHO CC(C)N1CCN(CCC[N@@H+](C[C@@H]2CCCO2)C2CCCC2)CC1 ZINC000191512529 473548868 /nfs/dbraw/zinc/54/88/68/473548868.db2.gz PVINSGFTJVOKCJ-FQEVSTJZSA-N 1 3 337.552 2.826 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)C1 ZINC000172253480 473561849 /nfs/dbraw/zinc/56/18/49/473561849.db2.gz LTNCNBDHDAXZDY-FUHWJXTLSA-N 1 3 346.519 2.899 10 0 EFAEHO COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCN(C3CC3)C2)cc1NC(C)=O ZINC000152454711 473564486 /nfs/dbraw/zinc/56/44/86/473564486.db2.gz SLUXFFVOGXOOEW-HIFRSBDPSA-N 1 3 331.460 2.789 10 0 EFAEHO CN1CC[C@@H](NC(=O)NCCC[NH+]2CCCCC2)[C@@H]1c1ccccc1 ZINC000178998887 473607592 /nfs/dbraw/zinc/60/75/92/473607592.db2.gz BGRDCZJHUQTQIS-MOPGFXCFSA-N 1 3 344.503 2.607 10 0 EFAEHO CN1CC[C@H](NC(=O)NCCC[NH+]2CCCCC2)[C@@H]1c1ccccc1 ZINC000178998874 473608274 /nfs/dbraw/zinc/60/82/74/473608274.db2.gz BGRDCZJHUQTQIS-OALUTQOASA-N 1 3 344.503 2.607 10 0 EFAEHO CN(C)[C@H]1CCN(C(=O)NCC2([NH+]3CCCCC3)CCCCC2)C1 ZINC000170862297 473632039 /nfs/dbraw/zinc/63/20/39/473632039.db2.gz KBJNGQSSPTYHLF-KRWDZBQOSA-N 1 3 336.524 2.521 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000172549477 473640321 /nfs/dbraw/zinc/64/03/21/473640321.db2.gz VYBMSMHUJUDVIV-KRWDZBQOSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172549477 473640325 /nfs/dbraw/zinc/64/03/25/473640325.db2.gz VYBMSMHUJUDVIV-KRWDZBQOSA-N 1 3 338.540 2.623 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000170899954 473643135 /nfs/dbraw/zinc/64/31/35/473643135.db2.gz NJPDSWIHOUAQLR-LJQANCHMSA-N 1 3 329.488 2.773 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000170899958 473643249 /nfs/dbraw/zinc/64/32/49/473643249.db2.gz NJPDSWIHOUAQLR-IBGZPJMESA-N 1 3 329.488 2.773 10 0 EFAEHO O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1C[C@H]2CCCC[C@@H]2[NH2+]1 ZINC000262666683 473708332 /nfs/dbraw/zinc/70/83/32/473708332.db2.gz KIYKNAYZWNKQMD-FYQPLNBISA-N 1 3 341.499 2.688 10 0 EFAEHO COc1ccc([C@H](C)[NH2+]CCCN2CCN(C(C)C)CC2)cc1OC ZINC000192787305 473725012 /nfs/dbraw/zinc/72/50/12/473725012.db2.gz BFMYLNKRSSOQMN-KRWDZBQOSA-N 1 3 349.519 2.771 10 0 EFAEHO C[C@H](NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)C(C)(C)C[NH+](C)C ZINC000245633364 473730964 /nfs/dbraw/zinc/73/09/64/473730964.db2.gz ITJPEKASUGVVHM-SZMVWBNQSA-N 1 3 346.519 2.707 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)NCCCC[N@@H+]2CCCC[C@@H]2C)CCN1C ZINC000246181275 473793996 /nfs/dbraw/zinc/79/39/96/473793996.db2.gz LVHYPADKPMVYEG-KSZLIROESA-N 1 3 338.540 2.765 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)CCN1C ZINC000246181275 473794006 /nfs/dbraw/zinc/79/40/06/473794006.db2.gz LVHYPADKPMVYEG-KSZLIROESA-N 1 3 338.540 2.765 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000617014834 480065403 /nfs/dbraw/zinc/06/54/03/480065403.db2.gz QOOBNKLEUCDZEB-RBUKOAKNSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000617014834 480065409 /nfs/dbraw/zinc/06/54/09/480065409.db2.gz QOOBNKLEUCDZEB-RBUKOAKNSA-N 1 3 343.515 2.888 10 0 EFAEHO CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000173333412 473808429 /nfs/dbraw/zinc/80/84/29/473808429.db2.gz HFLSGIBHASETPX-ZWKOTPCHSA-N 1 3 330.476 2.839 10 0 EFAEHO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000173333412 473808437 /nfs/dbraw/zinc/80/84/37/473808437.db2.gz HFLSGIBHASETPX-ZWKOTPCHSA-N 1 3 330.476 2.839 10 0 EFAEHO CC(C)N1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)C1=O ZINC000180145112 473810273 /nfs/dbraw/zinc/81/02/73/473810273.db2.gz SGAXLRBLQGNQRG-RAFMOHDBSA-N 1 3 341.499 2.781 10 0 EFAEHO C[C@H]([NH2+]C1CCN(C2CCN(C)CC2)CC1)C1CCSCC1 ZINC000187123312 473822148 /nfs/dbraw/zinc/82/21/48/473822148.db2.gz BHLRSNDGQPKCAC-HNNXBMFYSA-N 1 3 325.566 2.666 10 0 EFAEHO CC[C@@H]1CCCCN1CCNC(=O)N(C)[C@H]1CC[N@H+](CC)C[C@@H]1C ZINC000246309857 473823577 /nfs/dbraw/zinc/82/35/77/473823577.db2.gz BDJUPJCUGKRVMP-KSZLIROESA-N 1 3 338.540 2.623 10 0 EFAEHO CC[C@@H]1CCCCN1CCNC(=O)N(C)[C@H]1CC[N@@H+](CC)C[C@@H]1C ZINC000246309857 473823583 /nfs/dbraw/zinc/82/35/83/473823583.db2.gz BDJUPJCUGKRVMP-KSZLIROESA-N 1 3 338.540 2.623 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)CC1 ZINC000246320165 473828523 /nfs/dbraw/zinc/82/85/23/473828523.db2.gz NZAYZPMAIYJJAX-IAGOWNOFSA-N 1 3 338.540 2.528 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)NCCC[N@H+](C)Cc2ccccc2)CCN1C ZINC000173535767 473869666 /nfs/dbraw/zinc/86/96/66/473869666.db2.gz QELUYDOBNHGCRP-IEBWSBKVSA-N 1 3 346.519 2.633 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)NCCC[N@@H+](C)Cc2ccccc2)CCN1C ZINC000173535767 473869674 /nfs/dbraw/zinc/86/96/74/473869674.db2.gz QELUYDOBNHGCRP-IEBWSBKVSA-N 1 3 346.519 2.633 10 0 EFAEHO C[C@H](C(=O)NCC1CCN(c2cc[nH+]cc2)CC1)N1[C@H](C)CC[C@@H]1C ZINC000246457601 473869906 /nfs/dbraw/zinc/86/99/06/473869906.db2.gz PPENAOWOZDUXGL-IXDOHACOSA-N 1 3 344.503 2.676 10 0 EFAEHO CCN1CCCC[C@@H]1CNC(=O)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000246699094 473936697 /nfs/dbraw/zinc/93/66/97/473936697.db2.gz XZWJYZNGPLZOLF-QZTJIDSGSA-N 1 3 336.524 2.521 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)NC[C@@H](C2CCCCC2)[NH+](C)C)CCN1C ZINC000173841132 473942014 /nfs/dbraw/zinc/94/20/14/473942014.db2.gz YIFOBPALXGTNSD-NJAFHUGGSA-N 1 3 338.540 2.621 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@@H](CNC(=O)N[C@H](CN(C)C)c2ccccc2)C1 ZINC000246793367 473963930 /nfs/dbraw/zinc/96/39/30/473963930.db2.gz CUFLXLGKSWFXFO-PKOBYXMFSA-N 1 3 346.519 2.566 10 0 EFAEHO CC(C)C[N@H+]1CC[C@@H](CNC(=O)N[C@H](CN(C)C)c2ccccc2)C1 ZINC000246793367 473963938 /nfs/dbraw/zinc/96/39/38/473963938.db2.gz CUFLXLGKSWFXFO-PKOBYXMFSA-N 1 3 346.519 2.566 10 0 EFAEHO c1cc2c(cc1CN1CCC(OCC[NH+]3CCCC3)CC1)OCCO2 ZINC000174241430 474012001 /nfs/dbraw/zinc/01/20/01/474012001.db2.gz KRXDLDKUBLKPOK-UHFFFAOYSA-N 1 3 346.471 2.535 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1)C(C)C ZINC000174352685 474026520 /nfs/dbraw/zinc/02/65/20/474026520.db2.gz JCSHUBFVLJHGCW-DLBZAZTESA-N 1 3 326.529 2.619 10 0 EFAEHO CCN1CC[C@@H](C[NH2+][C@H](C)c2ccc(OCc3nccn3C)cc2)C1 ZINC000247011418 474034594 /nfs/dbraw/zinc/03/45/94/474034594.db2.gz LFWNDVSKEYQUPP-SJORKVTESA-N 1 3 342.487 2.992 10 0 EFAEHO CN(Cc1cccnc1)C[C@H]1CC[N@H+](CCCN2CCCCC2)C1 ZINC000195278755 474046341 /nfs/dbraw/zinc/04/63/41/474046341.db2.gz PVAARYOUDRBDCF-HXUWFJFHSA-N 1 3 330.520 2.711 10 0 EFAEHO CN(Cc1cccnc1)C[C@H]1CC[N@@H+](CCCN2CCCCC2)C1 ZINC000195278755 474046347 /nfs/dbraw/zinc/04/63/47/474046347.db2.gz PVAARYOUDRBDCF-HXUWFJFHSA-N 1 3 330.520 2.711 10 0 EFAEHO C[C@@H]1CN(C)[C@H](C)C[C@@H]1[NH2+]C[C@H]1CCN(CCc2ccccc2)C1 ZINC000247182755 474081427 /nfs/dbraw/zinc/08/14/27/474081427.db2.gz ZGTMXMXIGMNZKQ-UKAVVXHISA-N 1 3 329.532 2.869 10 0 EFAEHO CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000247359677 474128786 /nfs/dbraw/zinc/12/87/86/474128786.db2.gz HFLSGIBHASETPX-MSOLQXFVSA-N 1 3 330.476 2.839 10 0 EFAEHO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000247359677 474128792 /nfs/dbraw/zinc/12/87/92/474128792.db2.gz HFLSGIBHASETPX-MSOLQXFVSA-N 1 3 330.476 2.839 10 0 EFAEHO CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N1CCN2CCC[C@H]2C1 ZINC000247660036 474197038 /nfs/dbraw/zinc/19/70/38/474197038.db2.gz ZROVYVFRJVWOSB-IBGZPJMESA-N 1 3 344.503 2.516 10 0 EFAEHO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)N1CCN2CCC[C@H]2C1 ZINC000247660036 474197044 /nfs/dbraw/zinc/19/70/44/474197044.db2.gz ZROVYVFRJVWOSB-IBGZPJMESA-N 1 3 344.503 2.516 10 0 EFAEHO CC(C)[N@@H+]1C[C@@H](C)[C@H](Nc2cccc(CN3CCC(O)CC3)c2)C1 ZINC000230165734 474259588 /nfs/dbraw/zinc/25/95/88/474259588.db2.gz PEYFKWGZBTZVPI-OXQOHEQNSA-N 1 3 331.504 2.784 10 0 EFAEHO CC(C)[N@H+]1C[C@@H](C)[C@H](Nc2cccc(CN3CCC(O)CC3)c2)C1 ZINC000230165734 474259595 /nfs/dbraw/zinc/25/95/95/474259595.db2.gz PEYFKWGZBTZVPI-OXQOHEQNSA-N 1 3 331.504 2.784 10 0 EFAEHO C[N@H+](CC[C@@H]1CCCO1)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000189181381 474317239 /nfs/dbraw/zinc/31/72/39/474317239.db2.gz XPPXYSVKBJGLKH-SFTDATJTSA-N 1 3 346.515 2.933 10 0 EFAEHO C[N@@H+](CC[C@@H]1CCCO1)CC1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000189181381 474317246 /nfs/dbraw/zinc/31/72/46/474317246.db2.gz XPPXYSVKBJGLKH-SFTDATJTSA-N 1 3 346.515 2.933 10 0 EFAEHO C[C@H](NC[C@@H](O)COCc1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248561836 474358914 /nfs/dbraw/zinc/35/89/14/474358914.db2.gz JQCCHJOHGSHFHG-FBBABVLZSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@H](NC[C@@H](O)COCc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248561836 474358921 /nfs/dbraw/zinc/35/89/21/474358921.db2.gz JQCCHJOHGSHFHG-FBBABVLZSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@H]([NH2+]C[C@@H](O)COCc1ccccc1)[C@@H]1CCCN(C2CCC2)C1 ZINC000248561836 474358928 /nfs/dbraw/zinc/35/89/28/474358928.db2.gz JQCCHJOHGSHFHG-FBBABVLZSA-N 1 3 346.515 2.807 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCCN2Cc2ccccc2)CC[N@@H+]1C ZINC000265917571 474385577 /nfs/dbraw/zinc/38/55/77/474385577.db2.gz AZNQTAUBCWVQBJ-BHIYHBOVSA-N 1 3 329.488 2.592 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCCN2Cc2ccccc2)CC[N@H+]1C ZINC000265917571 474385590 /nfs/dbraw/zinc/38/55/90/474385590.db2.gz AZNQTAUBCWVQBJ-BHIYHBOVSA-N 1 3 329.488 2.592 10 0 EFAEHO NC1(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCCC1 ZINC000237894529 474495659 /nfs/dbraw/zinc/49/56/59/474495659.db2.gz PEKYIRUUEOUFKA-YQQQUEKLSA-N 1 3 341.499 2.960 10 0 EFAEHO NC1(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCCC1 ZINC000237894529 474495665 /nfs/dbraw/zinc/49/56/65/474495665.db2.gz PEKYIRUUEOUFKA-YQQQUEKLSA-N 1 3 341.499 2.960 10 0 EFAEHO C[NH+](C)CC[C@H](NC(=O)Nc1ccc2c(c1)OCCNC2)C(C)(C)C ZINC000625943067 480115170 /nfs/dbraw/zinc/11/51/70/480115170.db2.gz DEZWXMIAVNPSMI-KRWDZBQOSA-N 1 3 348.491 2.657 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1N[C@@H]1CC(=O)N(C(C)(C)C)C1 ZINC000271430581 474542162 /nfs/dbraw/zinc/54/21/62/474542162.db2.gz BVDBUTLPELHLMY-BHIYHBOVSA-N 1 3 343.515 2.886 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1N[C@@H]1CC(=O)N(C(C)(C)C)C1 ZINC000271430581 474542167 /nfs/dbraw/zinc/54/21/67/474542167.db2.gz BVDBUTLPELHLMY-BHIYHBOVSA-N 1 3 343.515 2.886 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1N[C@@H]1CC(=O)N(C(C)(C)C)C1 ZINC000271430591 474542429 /nfs/dbraw/zinc/54/24/29/474542429.db2.gz BVDBUTLPELHLMY-QRQLOZEOSA-N 1 3 343.515 2.886 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1N[C@@H]1CC(=O)N(C(C)(C)C)C1 ZINC000271430591 474542434 /nfs/dbraw/zinc/54/24/34/474542434.db2.gz BVDBUTLPELHLMY-QRQLOZEOSA-N 1 3 343.515 2.886 10 0 EFAEHO C[C@H](CCNC(=O)Nc1ccc2c(c1)OCCNC2)[NH+]1CCCCC1 ZINC000625942190 480113265 /nfs/dbraw/zinc/11/32/65/480113265.db2.gz SAOMLBXDDIPXBE-OAHLLOKOSA-N 1 3 346.475 2.555 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NCCCC[N@@H+]1CCC[C@H](C)C1 ZINC000249514924 474584240 /nfs/dbraw/zinc/58/42/40/474584240.db2.gz BKEGQWQDPVUUNW-ZWKOTPCHSA-N 1 3 340.556 2.774 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NCCCC[N@H+]1CCC[C@H](C)C1 ZINC000249514924 474584246 /nfs/dbraw/zinc/58/42/46/474584246.db2.gz BKEGQWQDPVUUNW-ZWKOTPCHSA-N 1 3 340.556 2.774 10 0 EFAEHO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCN2CCN(C)C(C)(C)C2)cc1 ZINC000284251900 474602998 /nfs/dbraw/zinc/60/29/98/474602998.db2.gz INNQLRISSDRCOF-PWIZWCRZSA-N 1 3 345.531 2.803 10 0 EFAEHO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCN2CCN(C)C(C)(C)C2)cc1 ZINC000284251895 474603127 /nfs/dbraw/zinc/60/31/27/474603127.db2.gz INNQLRISSDRCOF-NSISKUIASA-N 1 3 345.531 2.803 10 0 EFAEHO CN1CCC[C@H](CNC2=[NH+]CCN2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000253426483 474751622 /nfs/dbraw/zinc/75/16/22/474751622.db2.gz IYXPIOIHCCAWPR-UKRRQHHQSA-N 1 3 340.393 2.637 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)CC1CCN(C)CC1)Cc1ccccc1 ZINC000273204416 474776238 /nfs/dbraw/zinc/77/62/38/474776238.db2.gz KIQOVPUQHNYOEK-FQEVSTJZSA-N 1 3 345.531 2.788 10 0 EFAEHO CCCCOC[C@H](O)C[NH2+][C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12 ZINC000310940886 474832601 /nfs/dbraw/zinc/83/26/01/474832601.db2.gz JQOZRFSJNZEFPO-MXEMCNAFSA-N 1 3 346.515 2.664 10 0 EFAEHO CCCCOC[C@H](O)CN[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC000310940886 474832607 /nfs/dbraw/zinc/83/26/07/474832607.db2.gz JQOZRFSJNZEFPO-MXEMCNAFSA-N 1 3 346.515 2.664 10 0 EFAEHO CCCCOC[C@H](O)CN[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC000310940886 474832614 /nfs/dbraw/zinc/83/26/14/474832614.db2.gz JQOZRFSJNZEFPO-MXEMCNAFSA-N 1 3 346.515 2.664 10 0 EFAEHO CN1CC[C@@]2(CC[N@H+](CCCc3nc(-c4ccccc4)no3)C2)C1 ZINC000292069470 474832775 /nfs/dbraw/zinc/83/27/75/474832775.db2.gz DLHLNKYXCFBMEI-LJQANCHMSA-N 1 3 326.444 2.697 10 0 EFAEHO CN1CC[C@@]2(CC[N@@H+](CCCc3nc(-c4ccccc4)no3)C2)C1 ZINC000292069470 474832787 /nfs/dbraw/zinc/83/27/87/474832787.db2.gz DLHLNKYXCFBMEI-LJQANCHMSA-N 1 3 326.444 2.697 10 0 EFAEHO Cc1cc(=O)oc2cc(OCC[N@H+]3CC[C@]4(CCN(C)C4)C3)ccc12 ZINC000292119539 474860030 /nfs/dbraw/zinc/86/00/30/474860030.db2.gz KBIFRNUYRGZYLP-FQEVSTJZSA-N 1 3 342.439 2.508 10 0 EFAEHO Cc1cc(=O)oc2cc(OCC[N@@H+]3CC[C@]4(CCN(C)C4)C3)ccc12 ZINC000292119539 474860034 /nfs/dbraw/zinc/86/00/34/474860034.db2.gz KBIFRNUYRGZYLP-FQEVSTJZSA-N 1 3 342.439 2.508 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000337305731 474879771 /nfs/dbraw/zinc/87/97/71/474879771.db2.gz UIUGOCSIEKBZML-IBGZPJMESA-N 1 3 335.536 2.975 10 0 EFAEHO C[C@@H]([NH2+]C[C@@H]1CCc2nccn2C1)c1ccc(OCCN(C)C)cc1 ZINC000278874920 474887218 /nfs/dbraw/zinc/88/72/18/474887218.db2.gz CBTZGTXLNBINOW-SJORKVTESA-N 1 3 342.487 2.737 10 0 EFAEHO CN(CCCNCc1csc(-c2ccccc2)n1)CC[NH+](C)C ZINC000623088565 480134803 /nfs/dbraw/zinc/13/48/03/480134803.db2.gz SQOBPNAHTXJZRD-UHFFFAOYSA-N 1 3 332.517 2.783 10 0 EFAEHO CN1CC[C@]2(CC[N@H+](C[C@H](O)COc3ccc(C(C)(C)C)cc3)C2)C1 ZINC000292272663 474936061 /nfs/dbraw/zinc/93/60/61/474936061.db2.gz ZVLWPBVKJFYUCU-RXVVDRJESA-N 1 3 346.515 2.751 10 0 EFAEHO CN1CC[C@]2(CC[N@@H+](C[C@H](O)COc3ccc(C(C)(C)C)cc3)C2)C1 ZINC000292272663 474936074 /nfs/dbraw/zinc/93/60/74/474936074.db2.gz ZVLWPBVKJFYUCU-RXVVDRJESA-N 1 3 346.515 2.751 10 0 EFAEHO [NH3+]C[C@]12CCC[C@H]1CN(CCCc1nc(-c3cccs3)no1)C2 ZINC000324059911 474960207 /nfs/dbraw/zinc/96/02/07/474960207.db2.gz XEOQQQHGAZKCMD-GUYCJALGSA-N 1 3 332.473 2.792 10 0 EFAEHO NC[C@]12CCC[C@H]1C[N@H+](CCCc1nc(-c3cccs3)no1)C2 ZINC000324059911 474960215 /nfs/dbraw/zinc/96/02/15/474960215.db2.gz XEOQQQHGAZKCMD-GUYCJALGSA-N 1 3 332.473 2.792 10 0 EFAEHO NC[C@]12CCC[C@H]1C[N@@H+](CCCc1nc(-c3cccs3)no1)C2 ZINC000324059911 474960222 /nfs/dbraw/zinc/96/02/22/474960222.db2.gz XEOQQQHGAZKCMD-GUYCJALGSA-N 1 3 332.473 2.792 10 0 EFAEHO C[C@H]([NH2+]CCN1CCN(C)C(C)(C)C1)c1cnn(C2CCCC2)c1 ZINC000337436889 475017177 /nfs/dbraw/zinc/01/71/77/475017177.db2.gz WYWHDAKQAMSZCW-INIZCTEOSA-N 1 3 333.524 2.675 10 0 EFAEHO [NH3+]CCc1ccccc1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000327245672 475017392 /nfs/dbraw/zinc/01/73/92/475017392.db2.gz NPLXMTMCNBJOJG-HXUWFJFHSA-N 1 3 337.467 2.755 10 0 EFAEHO c1ccc(N2CCC([NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCCN3)CC2)nc1 ZINC000261795074 475064992 /nfs/dbraw/zinc/06/49/92/475064992.db2.gz ZGAQMIIRQVOCIY-GBESFXJTSA-N 1 3 328.504 2.951 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCCN1CCOC(C)(C)C1 ZINC000268917423 475070512 /nfs/dbraw/zinc/07/05/12/475070512.db2.gz VNOFDGBXWIACQS-UYAOXDASSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCCN1CCOC(C)(C)C1 ZINC000268917423 475070525 /nfs/dbraw/zinc/07/05/25/475070525.db2.gz VNOFDGBXWIACQS-UYAOXDASSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCCN1CCOCC1(C)C ZINC000268949020 475088471 /nfs/dbraw/zinc/08/84/71/475088471.db2.gz XEZXKTCVWDRGNU-UYAOXDASSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCCN1CCOCC1(C)C ZINC000268949020 475088479 /nfs/dbraw/zinc/08/84/79/475088479.db2.gz XEZXKTCVWDRGNU-UYAOXDASSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCCN1CCOCC1(C)C ZINC000268949019 475089260 /nfs/dbraw/zinc/08/92/60/475089260.db2.gz XEZXKTCVWDRGNU-QUCCMNQESA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCCN1CCOCC1(C)C ZINC000268949019 475089270 /nfs/dbraw/zinc/08/92/70/475089270.db2.gz XEZXKTCVWDRGNU-QUCCMNQESA-N 1 3 345.531 2.597 10 0 EFAEHO COc1cc2c(cc1F)CC[C@@H]2[NH2+]C1CCN(C[C@@H]2CCOC2)CC1 ZINC000281145924 475089459 /nfs/dbraw/zinc/08/94/59/475089459.db2.gz APXXKPLHGLGMSM-LIRRHRJNSA-N 1 3 348.462 2.912 10 0 EFAEHO CC[C@H](C)[C@H]1CN(Cc2ccc(C)nc2)CCN1C[C@H]1CCC[NH2+]C1 ZINC000261921774 475114478 /nfs/dbraw/zinc/11/44/78/475114478.db2.gz KOEQILQCCNJADT-HFSMHLIXSA-N 1 3 344.547 2.922 10 0 EFAEHO CC[C@H](C)[C@H]1CN(Cc2ccc(C)nc2)CCN1C[C@@H]1CCC[NH2+]C1 ZINC000261921770 475114583 /nfs/dbraw/zinc/11/45/83/475114583.db2.gz KOEQILQCCNJADT-FBBABVLZSA-N 1 3 344.547 2.922 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NCCC[N@@H+]1CCCC[C@@H]1C ZINC000337577498 475147206 /nfs/dbraw/zinc/14/72/06/475147206.db2.gz XSRFFCCFLORQSR-IRXDYDNUSA-N 1 3 326.529 2.526 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NCCC[N@H+]1CCCC[C@@H]1C ZINC000337577498 475147216 /nfs/dbraw/zinc/14/72/16/475147216.db2.gz XSRFFCCFLORQSR-IRXDYDNUSA-N 1 3 326.529 2.526 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)NCCN2CCCC[C@H]2C)c1 ZINC000339445102 475221317 /nfs/dbraw/zinc/22/13/17/475221317.db2.gz CIWSFSBYKKEJHG-QGZVFWFLSA-N 1 3 346.519 2.812 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)NCCN2CCCC[C@H]2C)c1 ZINC000339445102 475221322 /nfs/dbraw/zinc/22/13/22/475221322.db2.gz CIWSFSBYKKEJHG-QGZVFWFLSA-N 1 3 346.519 2.812 10 0 EFAEHO Cc1ccccc1C(C)(C)NCC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000339497669 475255863 /nfs/dbraw/zinc/25/58/63/475255863.db2.gz XJNRLCRZJNCELE-UHFFFAOYSA-N 1 3 329.488 2.563 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000352410076 475267017 /nfs/dbraw/zinc/26/70/17/475267017.db2.gz NIORZKPPWNAAHY-AEFFLSMTSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@H](NC1CC[NH+](CCC(=O)N(C)C)CC1)c1ccc2c(c1)CCC2 ZINC000361350249 475376683 /nfs/dbraw/zinc/37/66/83/475376683.db2.gz DEPWYSPYJNKSFL-INIZCTEOSA-N 1 3 343.515 2.769 10 0 EFAEHO c1cc(N2CCN(CCC[NH2+][C@@H]3CC[C@@H]3C3CCC3)CC2)ccn1 ZINC000338004978 475499316 /nfs/dbraw/zinc/49/93/16/475499316.db2.gz YZZWFYMGIHHZPB-WOJBJXKFSA-N 1 3 328.504 2.762 10 0 EFAEHO c1cc(N2CCN(CCC[NH2+][C@H]3CC[C@@H]3C3CCC3)CC2)ccn1 ZINC000338004976 475499404 /nfs/dbraw/zinc/49/94/04/475499404.db2.gz YZZWFYMGIHHZPB-UXHICEINSA-N 1 3 328.504 2.762 10 0 EFAEHO CN(C)CCOc1ccccc1CNC(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000352682836 475526066 /nfs/dbraw/zinc/52/60/66/475526066.db2.gz HSNXTFLCWUVIJK-SFHVURJKSA-N 1 3 347.503 2.508 10 0 EFAEHO CN(C)CCOc1ccccc1CNC(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000352682836 475526073 /nfs/dbraw/zinc/52/60/73/475526073.db2.gz HSNXTFLCWUVIJK-SFHVURJKSA-N 1 3 347.503 2.508 10 0 EFAEHO CC1=CCN(CCNC(=O)N[C@H](C)[C@H](c2ccccc2)[NH+](C)C)CC1 ZINC000355079835 475649935 /nfs/dbraw/zinc/64/99/35/475649935.db2.gz QNQPUKHXJFOHCR-IEBWSBKVSA-N 1 3 344.503 2.629 10 0 EFAEHO COc1ccc([C@@H](CN(C)C)NC(=O)CC[C@@H]2CCCC[N@@H+]2C)cc1 ZINC000358423952 475666909 /nfs/dbraw/zinc/66/69/09/475666909.db2.gz HLEWEYFJDSPCDR-PKOBYXMFSA-N 1 3 347.503 2.679 10 0 EFAEHO COc1ccc([C@@H](CN(C)C)NC(=O)CC[C@@H]2CCCC[N@H+]2C)cc1 ZINC000358423952 475666918 /nfs/dbraw/zinc/66/69/18/475666918.db2.gz HLEWEYFJDSPCDR-PKOBYXMFSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[C@@H](C)[NH2+][C@H](CNC(=O)NCCN1CC=C(C)CC1)c1ccco1 ZINC000355104471 475670292 /nfs/dbraw/zinc/67/02/92/475670292.db2.gz XVHZYQZFWQYUJL-IAGOWNOFSA-N 1 3 348.491 2.660 10 0 EFAEHO C[C@@H](CN(C)C)NC(=O)N1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000358488807 475718338 /nfs/dbraw/zinc/71/83/38/475718338.db2.gz AVMRXSJPIVKMTN-DLBZAZTESA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H](CN(C)C)NC(=O)N1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000358488807 475718348 /nfs/dbraw/zinc/71/83/48/475718348.db2.gz AVMRXSJPIVKMTN-DLBZAZTESA-N 1 3 338.540 2.623 10 0 EFAEHO CCC[N@H+](CC)CCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000355213528 475749991 /nfs/dbraw/zinc/74/99/91/475749991.db2.gz FEGQRSXWBIKJSU-LJQANCHMSA-N 1 3 346.519 2.634 10 0 EFAEHO CCC[N@@H+](CC)CCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000355213528 475750002 /nfs/dbraw/zinc/75/00/02/475750002.db2.gz FEGQRSXWBIKJSU-LJQANCHMSA-N 1 3 346.519 2.634 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)NCC[N@H+]2CCCC[C@H]2C)N(C)C)cc1 ZINC000338295721 475758251 /nfs/dbraw/zinc/75/82/51/475758251.db2.gz KBAZVLBUALTOMX-MJGOQNOKSA-N 1 3 346.519 2.771 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)NCC[N@@H+]2CCCC[C@H]2C)N(C)C)cc1 ZINC000338295721 475758256 /nfs/dbraw/zinc/75/82/56/475758256.db2.gz KBAZVLBUALTOMX-MJGOQNOKSA-N 1 3 346.519 2.771 10 0 EFAEHO CCC[NH+]1CCC(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CC1 ZINC000340112604 475767990 /nfs/dbraw/zinc/76/79/90/475767990.db2.gz NJDVSILPEHTKNQ-OALUTQOASA-N 1 3 344.503 2.605 10 0 EFAEHO CSC1(CNCc2ccnn2-c2ccccc2)CC[NH+](C)CC1 ZINC000353220673 475780475 /nfs/dbraw/zinc/78/04/75/475780475.db2.gz OHLVTBRFVBRBAG-UHFFFAOYSA-N 1 3 330.501 2.789 10 0 EFAEHO Fc1ccc2c(c1)C[C@@H]([NH2+]C1CCN(c3ccncc3)CC1)CO2 ZINC000297540358 475799671 /nfs/dbraw/zinc/79/96/71/475799671.db2.gz YMHJYUGJNYZCTO-QGZVFWFLSA-N 1 3 327.403 2.783 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@](C)(O)CC2)CC1 ZINC000355291053 475802353 /nfs/dbraw/zinc/80/23/53/475802353.db2.gz MDDRMDGAUHIZCU-NRFANRHFSA-N 1 3 345.531 2.956 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@](C)(O)CC2)CC1 ZINC000355291053 475802358 /nfs/dbraw/zinc/80/23/58/475802358.db2.gz MDDRMDGAUHIZCU-NRFANRHFSA-N 1 3 345.531 2.956 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)CC1CC[NH+](C)CC1)c1ccsc1 ZINC000346810777 475877026 /nfs/dbraw/zinc/87/70/26/475877026.db2.gz AVHKZNAQHGVNKT-QGZVFWFLSA-N 1 3 337.533 2.979 10 0 EFAEHO CN(CCNC(=O)NCC[N@H+](C)C1CCCCC1)Cc1ccccc1 ZINC000338463789 475928996 /nfs/dbraw/zinc/92/89/96/475928996.db2.gz YCIQWZGJIHMHEA-UHFFFAOYSA-N 1 3 346.519 2.682 10 0 EFAEHO CN(CCNC(=O)NCC[N@@H+](C)C1CCCCC1)Cc1ccccc1 ZINC000338463789 475929000 /nfs/dbraw/zinc/92/90/00/475929000.db2.gz YCIQWZGJIHMHEA-UHFFFAOYSA-N 1 3 346.519 2.682 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2cccc(C(=O)NC3CC3)c2)[C@H]2CCC[C@@H]21 ZINC000353389763 475930327 /nfs/dbraw/zinc/93/03/27/475930327.db2.gz WOYLMZUPYYCWAM-QYZOEREBSA-N 1 3 327.472 2.541 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21)N1CCc2sccc2C1 ZINC000353396657 475934629 /nfs/dbraw/zinc/93/46/29/475934629.db2.gz UKFBDHJKOJZGGT-VDHUWJSZSA-N 1 3 333.545 2.957 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@@H+](C)[C@@H]2CCC[C@@H]21)N1CCc2sccc2C1 ZINC000353396657 475934637 /nfs/dbraw/zinc/93/46/37/475934637.db2.gz UKFBDHJKOJZGGT-VDHUWJSZSA-N 1 3 333.545 2.957 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21)N1CCc2sccc2C1 ZINC000353396655 475935836 /nfs/dbraw/zinc/93/58/36/475935836.db2.gz UKFBDHJKOJZGGT-SPUZQDLCSA-N 1 3 333.545 2.957 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@@H+](C)[C@H]2CCC[C@H]21)N1CCc2sccc2C1 ZINC000353396655 475935844 /nfs/dbraw/zinc/93/58/44/475935844.db2.gz UKFBDHJKOJZGGT-SPUZQDLCSA-N 1 3 333.545 2.957 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000338579915 476025492 /nfs/dbraw/zinc/02/54/92/476025492.db2.gz ISBUJOCYQGNGAV-IBGZPJMESA-N 1 3 331.504 2.989 10 0 EFAEHO CO[C@H](C)[C@H](C)[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000340469975 476053573 /nfs/dbraw/zinc/05/35/73/476053573.db2.gz YBILXYXFDJJVEW-NLWGTHIKSA-N 1 3 346.515 2.928 10 0 EFAEHO CC[C@@H](Cn1cncn1)NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000340473711 476055785 /nfs/dbraw/zinc/05/57/85/476055785.db2.gz KXYYALQAXCVFFG-IBGZPJMESA-N 1 3 327.476 2.832 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)[C@H]2CCC[C@H]21 ZINC000353598513 476112517 /nfs/dbraw/zinc/11/25/17/476112517.db2.gz VZNYOWXJOXWTTJ-AKHDSKFASA-N 1 3 342.487 2.755 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)[C@H]2CCC[C@H]21 ZINC000353598513 476112523 /nfs/dbraw/zinc/11/25/23/476112523.db2.gz VZNYOWXJOXWTTJ-AKHDSKFASA-N 1 3 342.487 2.755 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)[C@H]2CCC[C@H]21 ZINC000353604542 476117492 /nfs/dbraw/zinc/11/74/92/476117492.db2.gz JFUIWJPEQFJYHP-JSXRDJHFSA-N 1 3 327.516 2.971 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]Cc2ccc3cc[nH]c3n2)[C@H](C)C1 ZINC000353620138 476129520 /nfs/dbraw/zinc/12/95/20/476129520.db2.gz IFLDOERROKSPOU-CRAIPNDOSA-N 1 3 330.476 2.790 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000350313403 476130540 /nfs/dbraw/zinc/13/05/40/476130540.db2.gz ZWOKLYUWKSLIDL-IBGZPJMESA-N 1 3 331.504 2.841 10 0 EFAEHO CN(C)CCN(Cc1ccccc1)C(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000350313403 476130546 /nfs/dbraw/zinc/13/05/46/476130546.db2.gz ZWOKLYUWKSLIDL-IBGZPJMESA-N 1 3 331.504 2.841 10 0 EFAEHO CCOCCCN1CC[C@@H]([NH2+]C2CC(N3CCCCC3)C2)[C@@H](C)C1 ZINC000359038927 476135706 /nfs/dbraw/zinc/13/57/06/476135706.db2.gz VKRLKVPQGRROKZ-DCCYDQLOSA-N 1 3 337.552 2.730 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC[C@H]2CCOC2)CC1 ZINC000344259052 476192971 /nfs/dbraw/zinc/19/29/71/476192971.db2.gz CUPGWBCGAGEPQU-SFHVURJKSA-N 1 3 331.504 2.735 10 0 EFAEHO CCN1CC[C@@H]([N@H+](C)Cc2cc(OC)c3c(c2)OCCO3)C[C@H]1C ZINC000353754886 476250021 /nfs/dbraw/zinc/25/00/21/476250021.db2.gz RFTXNBBLULTMBI-GDBMZVCRSA-N 1 3 334.460 2.771 10 0 EFAEHO CCN1CC[C@@H]([N@@H+](C)Cc2cc(OC)c3c(c2)OCCO3)C[C@H]1C ZINC000353754886 476250025 /nfs/dbraw/zinc/25/00/25/476250025.db2.gz RFTXNBBLULTMBI-GDBMZVCRSA-N 1 3 334.460 2.771 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@H](CNC(=O)NCCN2[C@@H](C)CCC[C@@H]2C)C1 ZINC000362508378 476289991 /nfs/dbraw/zinc/28/99/91/476289991.db2.gz GHJJMULFBRCABQ-OKZBNKHCSA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)C[N@H+]1CC[C@H](CNC(=O)NCCN2[C@@H](C)CCC[C@@H]2C)C1 ZINC000362508378 476289995 /nfs/dbraw/zinc/28/99/95/476289995.db2.gz GHJJMULFBRCABQ-OKZBNKHCSA-N 1 3 338.540 2.526 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C1CC1)[N@H+](C)Cc1ccccc1 ZINC000357266975 476309561 /nfs/dbraw/zinc/30/95/61/476309561.db2.gz SIUOXLWEVLYZMC-UXHICEINSA-N 1 3 343.515 2.888 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000357266975 476309563 /nfs/dbraw/zinc/30/95/63/476309563.db2.gz SIUOXLWEVLYZMC-UXHICEINSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)N1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)CC1=O ZINC000354175146 476480598 /nfs/dbraw/zinc/48/05/98/476480598.db2.gz AHLFKUKAYALYPH-SEBOWIOWSA-N 1 3 341.499 2.781 10 0 EFAEHO CC1CC[NH+](C[C@@H]2CCCN(C(=O)CC3CCN(C)CC3)C2)CC1 ZINC000364512059 476532021 /nfs/dbraw/zinc/53/20/21/476532021.db2.gz ASVBMSNGPKQPSB-IBGZPJMESA-N 1 3 335.536 2.689 10 0 EFAEHO Cc1ccncc1[C@@H](C)[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000357793411 476608532 /nfs/dbraw/zinc/60/85/32/476608532.db2.gz KTZVAMDIBRTXSE-GOSISDBHSA-N 1 3 330.520 2.991 10 0 EFAEHO CCCC[N@H+](C)C[C@H](C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000357871110 476662184 /nfs/dbraw/zinc/66/21/84/476662184.db2.gz NELRGZWITHODIA-WDSOQIARSA-N 1 3 346.519 2.851 10 0 EFAEHO CCCC[N@@H+](C)C[C@H](C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000357871110 476662188 /nfs/dbraw/zinc/66/21/88/476662188.db2.gz NELRGZWITHODIA-WDSOQIARSA-N 1 3 346.519 2.851 10 0 EFAEHO CCC[N@H+](CC)C[C@H](C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000357874066 476664285 /nfs/dbraw/zinc/66/42/85/476664285.db2.gz SDDRJBYOPMVAQD-YTQUADARSA-N 1 3 346.519 2.851 10 0 EFAEHO CCC[N@@H+](CC)C[C@H](C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000357874066 476664289 /nfs/dbraw/zinc/66/42/89/476664289.db2.gz SDDRJBYOPMVAQD-YTQUADARSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@H](CCN1CCC[C@]2(CCOC2)C1)[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000451904858 476713602 /nfs/dbraw/zinc/71/36/02/476713602.db2.gz RGJYXYLMMGLRFP-HSALFYBXSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CCN1CCC[C@]2(CCOC2)C1)[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000451904858 476713607 /nfs/dbraw/zinc/71/36/07/476713607.db2.gz RGJYXYLMMGLRFP-HSALFYBXSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@@H+]1CCC[C@]2(CCOC2)C1)N1CCC[C@@]2(CCOC2)C1 ZINC000451904858 476713612 /nfs/dbraw/zinc/71/36/12/476713612.db2.gz RGJYXYLMMGLRFP-HSALFYBXSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@H+]1CCC[C@]2(CCOC2)C1)N1CCC[C@@]2(CCOC2)C1 ZINC000451904858 476713615 /nfs/dbraw/zinc/71/36/15/476713615.db2.gz RGJYXYLMMGLRFP-HSALFYBXSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@H]2CCC[C@@H]2C[NH3+])CCN1Cc1ccccc1 ZINC000379675891 476730367 /nfs/dbraw/zinc/73/03/67/476730367.db2.gz YDIBHCGJARPJCG-OWYHZJEWSA-N 1 3 329.488 2.531 10 0 EFAEHO O=C(CC[C@H]1CCC[NH2+]C1)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000379665545 476731040 /nfs/dbraw/zinc/73/10/40/476731040.db2.gz TUGVLKVULGKIGW-QUCCMNQESA-N 1 3 343.515 2.937 10 0 EFAEHO O=C(C[C@@H]1CCC[NH2+]C1)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000379663851 476731125 /nfs/dbraw/zinc/73/11/25/476731125.db2.gz MTBPIQWWAQAKDK-RBUKOAKNSA-N 1 3 329.488 2.547 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@H](C)N1CCc2ccccc2C1 ZINC000422710234 476739838 /nfs/dbraw/zinc/73/98/38/476739838.db2.gz FJTDLBPOOKPKAT-HOTGVXAUSA-N 1 3 338.499 2.946 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1ccc(Br)cc1Cl ZINC000422716074 476741385 /nfs/dbraw/zinc/74/13/85/476741385.db2.gz MWLBEQFMMNGZBC-LBPRGKRZSA-N 1 3 335.673 2.946 10 0 EFAEHO Fc1ccc2[nH]cc(CCN[C@@H]3CCOC[C@@H]3[C@@H]3CCC[NH2+]3)c2c1 ZINC000422761951 476765228 /nfs/dbraw/zinc/76/52/28/476765228.db2.gz NEKDBSQXGWPITL-ZIFCJYIRSA-N 1 3 331.435 2.596 10 0 EFAEHO NC[C@@H]1CCCC[C@H]1[NH2+]CC1CCN(C(=O)c2ccccc2)CC1 ZINC000422770281 476769395 /nfs/dbraw/zinc/76/93/95/476769395.db2.gz UUDKWLOJPXWUDO-RBUKOAKNSA-N 1 3 329.488 2.646 10 0 EFAEHO C[C@H](NCC1CCN(C(=O)c2ccccc2)CC1)[C@@H]1CCCC[NH2+]1 ZINC000422771503 476770080 /nfs/dbraw/zinc/77/00/80/476770080.db2.gz VRKQXBLWRQTLAB-LPHOPBHVSA-N 1 3 329.488 2.659 10 0 EFAEHO COCCOc1ccc(CN[C@@H](C)c2ccc(C[NH3+])nc2C)cc1 ZINC000422854056 476811670 /nfs/dbraw/zinc/81/16/70/476811670.db2.gz CLKMWRBQOUBSME-AWEZNQCLSA-N 1 3 329.444 2.725 10 0 EFAEHO Cc1cc(C)cc(OC[C@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC000391725536 476816128 /nfs/dbraw/zinc/81/61/28/476816128.db2.gz RFKPAMFMUCLIBC-XVLXNVKGSA-N 1 3 332.488 2.648 10 0 EFAEHO Cc1cc(C)cc(OC[C@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC000391725536 476816135 /nfs/dbraw/zinc/81/61/35/476816135.db2.gz RFKPAMFMUCLIBC-XVLXNVKGSA-N 1 3 332.488 2.648 10 0 EFAEHO C[C@@H]1CCCCN1CCN[C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422862910 476817029 /nfs/dbraw/zinc/81/70/29/476817029.db2.gz OEAYKFYYSYNVJX-YVWKXTFCSA-N 1 3 329.488 2.706 10 0 EFAEHO C[C@@H](N)C[C@@H](C)[NH2+]C1CCN(c2ccc(C(F)(F)F)cn2)CC1 ZINC000422863430 476817311 /nfs/dbraw/zinc/81/73/11/476817311.db2.gz OZKDZMDRRCVRER-VXGBXAGGSA-N 1 3 330.398 2.785 10 0 EFAEHO CCc1cccc(OC[C@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC000392218666 476824156 /nfs/dbraw/zinc/82/41/56/476824156.db2.gz QPIPMNXVZJWYFM-XVLXNVKGSA-N 1 3 332.488 2.594 10 0 EFAEHO CCc1cccc(OC[C@H](O)CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC000392218666 476824161 /nfs/dbraw/zinc/82/41/61/476824161.db2.gz QPIPMNXVZJWYFM-XVLXNVKGSA-N 1 3 332.488 2.594 10 0 EFAEHO COc1ccc([C@H](N[C@@H]2CN(C3CC3)C[C@H]2C)[C@@H]2CCC[NH2+]2)cc1 ZINC000422879124 476825360 /nfs/dbraw/zinc/82/53/60/476825360.db2.gz UOLMYDGYGIMZTG-YGBSJELFSA-N 1 3 329.488 2.561 10 0 EFAEHO COc1ccc(C)cc1C1(C[NH2+][C@H]2CCC[C@H]2CN)CCOCC1 ZINC000422897687 476833481 /nfs/dbraw/zinc/83/34/81/476833481.db2.gz KDCVUTXEUSAGIX-WMZOPIPTSA-N 1 3 332.488 2.769 10 0 EFAEHO CCN1CCCC[C@@H]1CN[C@@H](c1ccc(OC)cc1)[C@@H]1CCC[NH2+]1 ZINC000422908465 476840619 /nfs/dbraw/zinc/84/06/19/476840619.db2.gz MQJHAGVVTLTTHR-HOJAQTOUSA-N 1 3 331.504 2.952 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CCCc1ccc2c(c1)OCCO2 ZINC000422926949 476848187 /nfs/dbraw/zinc/84/81/87/476848187.db2.gz FGVKUEDOJMQZNN-AWEZNQCLSA-N 1 3 341.455 2.903 10 0 EFAEHO CCOc1ccc([C@H](C)NC(=O)CCCN[C@@H]2C[NH2+]CC[C@@H]2C)cc1 ZINC000422925670 476848922 /nfs/dbraw/zinc/84/89/22/476848922.db2.gz CAGUBGHYUPORSG-TXPKVOOTSA-N 1 3 347.503 2.630 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCc2cn(C(C)C)nc2C1 ZINC000422933834 476852338 /nfs/dbraw/zinc/85/23/38/476852338.db2.gz DXWCNGJWCUIARO-XJKSGUPXSA-N 1 3 327.476 2.834 10 0 EFAEHO CC1(C)CCC[N@@H+]1CCNC(=O)c1cccc(CN2CCCC2)c1 ZINC000457067885 476857000 /nfs/dbraw/zinc/85/70/00/476857000.db2.gz CVMHMBFEDMZQFI-UHFFFAOYSA-N 1 3 329.488 2.887 10 0 EFAEHO CC1(C)CCC[N@H+]1CCNC(=O)c1cccc(CN2CCCC2)c1 ZINC000457067885 476857007 /nfs/dbraw/zinc/85/70/07/476857007.db2.gz CVMHMBFEDMZQFI-UHFFFAOYSA-N 1 3 329.488 2.887 10 0 EFAEHO COC1CCC([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CC1 ZINC000397572222 476858479 /nfs/dbraw/zinc/85/84/79/476858479.db2.gz ZAZXUZKGLRLYDX-UHFFFAOYSA-N 1 3 332.488 2.561 10 0 EFAEHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CCCN(C(=O)C1CCC1)C1CC1 ZINC000422951976 476862293 /nfs/dbraw/zinc/86/22/93/476862293.db2.gz BCQYAOWNFSRIQV-CQSZACIVSA-N 1 3 344.503 2.681 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)[C@H]1[NH2+]CCCC1(C)C ZINC000398148545 476867673 /nfs/dbraw/zinc/86/76/73/476867673.db2.gz ORDMRAPDUAXRGU-BHIYHBOVSA-N 1 3 343.515 2.791 10 0 EFAEHO CC[C@H](CN[C@H](c1ccc(OC)cc1)[C@H]1CCC[NH2+]1)N1CCCC1 ZINC000422963393 476868231 /nfs/dbraw/zinc/86/82/31/476868231.db2.gz IKDHANTXZBFXFB-MISYRCLQSA-N 1 3 331.504 2.952 10 0 EFAEHO OCC[NH+]1CCC(NCc2ccc(OCc3ccccc3)cc2)CC1 ZINC000398972529 476879227 /nfs/dbraw/zinc/87/92/27/476879227.db2.gz XATCQVZVZPANNA-UHFFFAOYSA-N 1 3 340.467 2.812 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@]1(O)CCC[C@H](C(F)(F)F)C1 ZINC000423058020 476908682 /nfs/dbraw/zinc/90/86/82/476908682.db2.gz BIGZLIGXJGJRLE-DETPVDSQSA-N 1 3 345.409 2.983 10 0 EFAEHO Cc1nc(C[NH3+])ccc1[C@H](C)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000423102215 476929371 /nfs/dbraw/zinc/92/93/71/476929371.db2.gz DQADNHMURGRZIE-IFXJQAMLSA-N 1 3 330.451 2.941 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@H](c1cncc(Br)c1)C1CC1 ZINC000423109648 476931926 /nfs/dbraw/zinc/93/19/26/476931926.db2.gz STZRZALXSZZMMG-GJZGRUSLSA-N 1 3 342.281 2.639 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)[C@H]1CC[C@@H](C2CC2)[NH2+]1)c1ccccc1 ZINC000407341349 476933437 /nfs/dbraw/zinc/93/34/37/476933437.db2.gz WDKCHPKDPCAFIH-IPMKNSEASA-N 1 3 329.488 2.716 10 0 EFAEHO C[C@H]([NH3+])[C@H](Cc1ccccc1)N[C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000423187463 476957910 /nfs/dbraw/zinc/95/79/10/476957910.db2.gz POWQHAZTRPFDQE-CVAIRZPRSA-N 1 3 327.447 2.953 10 0 EFAEHO C[C@H]([NH2+]CC1(N)CCCCCC1)c1ccc(NS(C)(=O)=O)cc1 ZINC000423198131 476961130 /nfs/dbraw/zinc/96/11/30/476961130.db2.gz DIYQIAAPEHAVRT-AWEZNQCLSA-N 1 3 339.505 2.760 10 0 EFAEHO C[C@@H]([NH2+]CC1(N)CCCCCC1)c1ccc(NS(C)(=O)=O)cc1 ZINC000423198132 476961256 /nfs/dbraw/zinc/96/12/56/476961256.db2.gz DIYQIAAPEHAVRT-CQSZACIVSA-N 1 3 339.505 2.760 10 0 EFAEHO C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]CC1(N)CCCCCC1 ZINC000423206977 476963616 /nfs/dbraw/zinc/96/36/16/476963616.db2.gz XLIBIBHINUUAME-MJGOQNOKSA-N 1 3 330.520 2.933 10 0 EFAEHO C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NCC1([NH3+])CCCCCC1 ZINC000423206977 476963623 /nfs/dbraw/zinc/96/36/23/476963623.db2.gz XLIBIBHINUUAME-MJGOQNOKSA-N 1 3 330.520 2.933 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2ccc3c(c2)OCC(=O)N3)cc1 ZINC000423296816 476985628 /nfs/dbraw/zinc/98/56/28/476985628.db2.gz ZXATWUVJGZFEBI-CHWSQXEVSA-N 1 3 325.412 2.888 10 0 EFAEHO C[NH2+]Cc1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000416003584 476987531 /nfs/dbraw/zinc/98/75/31/476987531.db2.gz FMQTXYTWOFZZQU-OALUTQOASA-N 1 3 338.455 2.973 10 0 EFAEHO C[NH2+]Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000416003586 476987653 /nfs/dbraw/zinc/98/76/53/476987653.db2.gz FMQTXYTWOFZZQU-RTBURBONSA-N 1 3 338.455 2.973 10 0 EFAEHO COCCOc1cc(C)ccc1C[NH2+][C@@H]1CCN(C)[C@@H]2CCC[C@@H]21 ZINC000375783004 477001992 /nfs/dbraw/zinc/00/19/92/477001992.db2.gz BCECKIHFMNYQEO-GUDVDZBRSA-N 1 3 332.488 2.983 10 0 EFAEHO COCCOc1cc(C)ccc1C[NH2+][C@@H]1CCN(C)[C@@H]2CCC[C@H]21 ZINC000375783005 477003312 /nfs/dbraw/zinc/00/33/12/477003312.db2.gz BCECKIHFMNYQEO-IPMKNSEASA-N 1 3 332.488 2.983 10 0 EFAEHO C[C@H]([NH2+][C@@H]1CCNC[C@H]1C)c1ccc(OCc2nccn2C)cc1 ZINC000423362567 477006309 /nfs/dbraw/zinc/00/63/09/477006309.db2.gz BGBPKQPUWFIPIS-RVKKMQEKSA-N 1 3 328.460 2.648 10 0 EFAEHO C[C@H]([NH2+][C@@H]1CCNC[C@H]1C)c1ccc(I)cc1 ZINC000423385729 477011944 /nfs/dbraw/zinc/01/19/44/477011944.db2.gz GYUSBGJUZCTHOX-UHIISALHSA-N 1 3 344.240 2.940 10 0 EFAEHO CCO[C@@H]1COCC[C@@H]1N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447590405 477018167 /nfs/dbraw/zinc/01/81/67/477018167.db2.gz CKLBVDRYRZCQRP-HGJUEJDCSA-N 1 3 344.499 2.966 10 0 EFAEHO CCO[C@@H]1COCC[C@@H]1N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447590405 477018173 /nfs/dbraw/zinc/01/81/73/477018173.db2.gz CKLBVDRYRZCQRP-HGJUEJDCSA-N 1 3 344.499 2.966 10 0 EFAEHO CO[C@]1(CN[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCOC1 ZINC000447598413 477020038 /nfs/dbraw/zinc/02/00/38/477020038.db2.gz HFAAABYKYMEDDE-YRPNKDGESA-N 1 3 330.472 2.577 10 0 EFAEHO CO[C@]1(CN[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCOC1 ZINC000447598413 477020043 /nfs/dbraw/zinc/02/00/43/477020043.db2.gz HFAAABYKYMEDDE-YRPNKDGESA-N 1 3 330.472 2.577 10 0 EFAEHO C[C@@H](CNC(=O)CCN1CCc2ccccc2C1)[N@@H+]1CCCC[C@H]1C ZINC000416132306 477031784 /nfs/dbraw/zinc/03/17/84/477031784.db2.gz KSACXBREMKBVMG-MSOLQXFVSA-N 1 3 343.515 2.814 10 0 EFAEHO C[C@@H](CNC(=O)CCN1CCc2ccccc2C1)[N@H+]1CCCC[C@H]1C ZINC000416132306 477031790 /nfs/dbraw/zinc/03/17/90/477031790.db2.gz KSACXBREMKBVMG-MSOLQXFVSA-N 1 3 343.515 2.814 10 0 EFAEHO CN1CC[C@@]2(CC[N@H+](CCc3nc(-c4ccc(Cl)cc4)no3)C2)C1 ZINC000366493281 477038313 /nfs/dbraw/zinc/03/83/13/477038313.db2.gz YADIXRRKNQTXSB-GOSISDBHSA-N 1 3 346.862 2.960 10 0 EFAEHO CN1CC[C@@]2(CC[N@@H+](CCc3nc(-c4ccc(Cl)cc4)no3)C2)C1 ZINC000366493281 477038319 /nfs/dbraw/zinc/03/83/19/477038319.db2.gz YADIXRRKNQTXSB-GOSISDBHSA-N 1 3 346.862 2.960 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)CCN2CCc3ccccc3C2)C[C@H]1C ZINC000416153005 477042259 /nfs/dbraw/zinc/04/22/59/477042259.db2.gz ACGHABJZIDEVPF-XLIONFOSSA-N 1 3 343.515 2.766 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)CCN2CCc3ccccc3C2)C[C@H]1C ZINC000416153005 477042265 /nfs/dbraw/zinc/04/22/65/477042265.db2.gz ACGHABJZIDEVPF-XLIONFOSSA-N 1 3 343.515 2.766 10 0 EFAEHO C[C@@H](NC(=O)CCN1CCc2ccccc2C1)C(C)(C)C[NH+](C)C ZINC000416155548 477043460 /nfs/dbraw/zinc/04/34/60/477043460.db2.gz MRPKDBDVZMLBIU-MRXNPFEDSA-N 1 3 331.504 2.527 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)CCN2CCc3ccccc3C2)[C@@H](C)C1 ZINC000416157312 477045959 /nfs/dbraw/zinc/04/59/59/477045959.db2.gz QPSCUVALXFJLGF-PXNSSMCTSA-N 1 3 343.515 2.624 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)CCN2CCc3ccccc3C2)[C@@H](C)C1 ZINC000416157312 477045964 /nfs/dbraw/zinc/04/59/64/477045964.db2.gz QPSCUVALXFJLGF-PXNSSMCTSA-N 1 3 343.515 2.624 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCc2nnc(-c3ccccc3)o2)[C@H]2CCC[C@H]21 ZINC000375855651 477050683 /nfs/dbraw/zinc/05/06/83/477050683.db2.gz BMUQIMLHEXYGIR-IXDOHACOSA-N 1 3 326.444 2.742 10 0 EFAEHO C[N@H+]1CC[C@H](NCCc2nnc(-c3ccccc3)o2)[C@H]2CCC[C@H]21 ZINC000375855651 477050687 /nfs/dbraw/zinc/05/06/87/477050687.db2.gz BMUQIMLHEXYGIR-IXDOHACOSA-N 1 3 326.444 2.742 10 0 EFAEHO O=C(CCN1CCc2ccccc2C1)NC1CC([NH+]2CCCCC2)C1 ZINC000416227349 477079379 /nfs/dbraw/zinc/07/93/79/477079379.db2.gz PKFOUZUPWJXPBX-UHFFFAOYSA-N 1 3 341.499 2.568 10 0 EFAEHO CN1CCCC(C)(C)[C@@H]1CNC(=O)NC1CCC(C[NH+](C)C)CC1 ZINC000447959582 477101988 /nfs/dbraw/zinc/10/19/88/477101988.db2.gz QOXCEBPJPCGJNC-JCYILVPMSA-N 1 3 338.540 2.526 10 0 EFAEHO CN1C[C@H](N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)CCC1=O ZINC000453105057 477170594 /nfs/dbraw/zinc/17/05/94/477170594.db2.gz BBHTYPFHYUZOPP-IYWMVGAKSA-N 1 3 341.499 2.640 10 0 EFAEHO CN1C[C@H](N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)CCC1=O ZINC000453105057 477170596 /nfs/dbraw/zinc/17/05/96/477170596.db2.gz BBHTYPFHYUZOPP-IYWMVGAKSA-N 1 3 341.499 2.640 10 0 EFAEHO CCn1ccnc1[C@@H](C)NCC1([NH+]2CCCCC2)CCN(C)CC1 ZINC000453123837 477173355 /nfs/dbraw/zinc/17/33/55/477173355.db2.gz SJZUZJZUPHEYQE-QGZVFWFLSA-N 1 3 333.524 2.504 10 0 EFAEHO CCn1ccnc1[C@@H](C)NCC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000453123837 477173364 /nfs/dbraw/zinc/17/33/64/477173364.db2.gz SJZUZJZUPHEYQE-QGZVFWFLSA-N 1 3 333.524 2.504 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)[C@@H]2CCC[C@H]21 ZINC000453392309 477220200 /nfs/dbraw/zinc/22/02/00/477220200.db2.gz YUWSWXKODWOVGM-DTXAGUPXSA-N 1 3 346.519 2.843 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)[C@@H]2CCC[C@H]21 ZINC000453392309 477220207 /nfs/dbraw/zinc/22/02/07/477220207.db2.gz YUWSWXKODWOVGM-DTXAGUPXSA-N 1 3 346.519 2.843 10 0 EFAEHO COCC[C@@H]1CCC[C@@H]1[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000367078853 477331306 /nfs/dbraw/zinc/33/13/06/477331306.db2.gz SFYWQFVHMLNCHA-OALUTQOASA-N 1 3 337.552 2.732 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@@H]([NH2+]Cc3cccc(OCCN(C)C)c3)C[C@H]2C1 ZINC000424271823 477351617 /nfs/dbraw/zinc/35/16/17/477351617.db2.gz SMLGFKVGERTBOI-LAGDQHSMSA-N 1 3 332.488 2.920 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)N1CCNC(=O)NC(C)(C)CCC[NH+](C)C ZINC000458347639 477361569 /nfs/dbraw/zinc/36/15/69/477361569.db2.gz UGNIETMHIMJRCF-HZPDHXFCSA-N 1 3 326.529 2.669 10 0 EFAEHO CC[NH+](CC)[C@H](CNC(=O)NC[C@@H](N)c1ccccc1)CC(C)C ZINC000416943096 477380552 /nfs/dbraw/zinc/38/05/52/477380552.db2.gz CBDJJWAOTBHHKI-ZWKOTPCHSA-N 1 3 334.508 2.742 10 0 EFAEHO CCC(CC)[C@@H](CNC(=O)NC[C@@H](N)c1ccccc1)[NH+]1CCCC1 ZINC000416967550 477392777 /nfs/dbraw/zinc/39/27/77/477392777.db2.gz ZNFBBKYSNNHCOK-RTBURBONSA-N 1 3 346.519 2.886 10 0 EFAEHO CCC(CC)[C@H](CNC(=O)NC[C@@H](N)c1ccccc1)[NH+]1CCCC1 ZINC000416967547 477393604 /nfs/dbraw/zinc/39/36/04/477393604.db2.gz ZNFBBKYSNNHCOK-MOPGFXCFSA-N 1 3 346.519 2.886 10 0 EFAEHO c1c2cccnc2oc1CN1CCC(OCC[NH+]2CCCC2)CC1 ZINC000449029445 477399358 /nfs/dbraw/zinc/39/93/58/477399358.db2.gz OVIUMUDSUHNMSG-UHFFFAOYSA-N 1 3 329.444 2.905 10 0 EFAEHO Cc1cc(C[NH3+])cc(NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)c1 ZINC000424432142 477405929 /nfs/dbraw/zinc/40/59/29/477405929.db2.gz BLKIHJZBIZACPO-IBGZPJMESA-N 1 3 340.471 2.748 10 0 EFAEHO C[C@H](Cn1cccn1)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449078350 477425285 /nfs/dbraw/zinc/42/52/85/477425285.db2.gz ULTJIQXAYRKVIA-MSOLQXFVSA-N 1 3 326.488 2.957 10 0 EFAEHO CCCNC(=O)CCNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449084889 477431200 /nfs/dbraw/zinc/43/12/00/477431200.db2.gz JGIMUMPMWJBMEY-KRWDZBQOSA-N 1 3 331.504 2.588 10 0 EFAEHO CC(C)(C)CC(C)(C)[NH+]1CCC(NCC2(O)CCOCC2)CC1 ZINC000449129560 477451255 /nfs/dbraw/zinc/45/12/55/477451255.db2.gz VSBPAENDSCNBSB-UHFFFAOYSA-N 1 3 326.525 2.797 10 0 EFAEHO COCCN1CC[C@@H](NC2CC[NH+](C(C)(C)CC(C)(C)C)CC2)C1 ZINC000449157162 477462086 /nfs/dbraw/zinc/46/20/86/477462086.db2.gz UQDUOVUSHSBPFE-GOSISDBHSA-N 1 3 339.568 2.976 10 0 EFAEHO CSC[C@@H](CCO)NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449159741 477463005 /nfs/dbraw/zinc/46/30/05/477463005.db2.gz ILRIZPSFTSAVFQ-VQIMIIECSA-N 1 3 336.545 2.786 10 0 EFAEHO CS[C@H](CO)[C@@H](C)NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449158988 477464039 /nfs/dbraw/zinc/46/40/39/477464039.db2.gz WQPAEKKCBUMPIB-GPMSIDNRSA-N 1 3 336.545 2.784 10 0 EFAEHO COCCOC[C@@H](C)NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449175560 477471510 /nfs/dbraw/zinc/47/15/10/477471510.db2.gz OMXWOPAIHKNICU-QZTJIDSGSA-N 1 3 334.504 2.723 10 0 EFAEHO C[C@H](CO[C@H]1CCOC1)NC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449183443 477474632 /nfs/dbraw/zinc/47/46/32/477474632.db2.gz FTOHEEJBVZFMDQ-OPYAIIAOSA-N 1 3 346.515 2.866 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NC[C@@]2(O)CCSC2)CC1 ZINC000449182305 477475031 /nfs/dbraw/zinc/47/50/31/477475031.db2.gz JMPKVZZJASPUBC-LPHOPBHVSA-N 1 3 334.529 2.540 10 0 EFAEHO CC(C)[N@@H+]1CC[C@H](N(C)C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)C1 ZINC000458581798 477493120 /nfs/dbraw/zinc/49/31/20/477493120.db2.gz MHYUSPPMIGCSSC-OTWHNJEPSA-N 1 3 344.503 2.556 10 0 EFAEHO CC(C)[N@H+]1CC[C@H](N(C)C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)C1 ZINC000458581798 477493126 /nfs/dbraw/zinc/49/31/26/477493126.db2.gz MHYUSPPMIGCSSC-OTWHNJEPSA-N 1 3 344.503 2.556 10 0 EFAEHO C[C@@H]1C[C@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)C[N@@H+]1C1CC1 ZINC000371801599 477501172 /nfs/dbraw/zinc/50/11/72/477501172.db2.gz HJZRKWMIZAURCO-WBVHZDCISA-N 1 3 343.515 2.853 10 0 EFAEHO C[C@@H]1C[C@H](Nc2cccc3c2CCN(CC(C)(C)O)C3)C[N@H+]1C1CC1 ZINC000371801599 477501178 /nfs/dbraw/zinc/50/11/78/477501178.db2.gz HJZRKWMIZAURCO-WBVHZDCISA-N 1 3 343.515 2.853 10 0 EFAEHO C[C@H]1OCC[C@]1(O)CNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449291277 477529629 /nfs/dbraw/zinc/52/96/29/477529629.db2.gz KENHDKBOYRJMDM-BEFAXECRSA-N 1 3 326.525 2.795 10 0 EFAEHO C[C@H](Cc1ccccc1)N1CCC([NH2+][C@H]2CCc3nc[nH]c3C2)CC1 ZINC000449341137 477557092 /nfs/dbraw/zinc/55/70/92/477557092.db2.gz YAFMEPRNGIPVDM-APWZRJJASA-N 1 3 338.499 2.952 10 0 EFAEHO C[C@H](Cc1ccccc1)N1CCC([NH2+][C@H]2CCc3[nH]cnc3C2)CC1 ZINC000449341137 477557098 /nfs/dbraw/zinc/55/70/98/477557098.db2.gz YAFMEPRNGIPVDM-APWZRJJASA-N 1 3 338.499 2.952 10 0 EFAEHO CC(C)Oc1cccc([C@H](O)C[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@@H]32)c1 ZINC000367618837 477604655 /nfs/dbraw/zinc/60/46/55/477604655.db2.gz OIEROMJYGWWGKW-YSTOQKLRSA-N 1 3 332.488 2.970 10 0 EFAEHO CC(C)Oc1cccc([C@H](O)CN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)c1 ZINC000367618837 477604665 /nfs/dbraw/zinc/60/46/65/477604665.db2.gz OIEROMJYGWWGKW-YSTOQKLRSA-N 1 3 332.488 2.970 10 0 EFAEHO CC(C)Oc1cccc([C@H](O)CN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@@H]32)c1 ZINC000367618837 477604671 /nfs/dbraw/zinc/60/46/71/477604671.db2.gz OIEROMJYGWWGKW-YSTOQKLRSA-N 1 3 332.488 2.970 10 0 EFAEHO C[NH2+]C1CCN(C(=O)[C@@H]2CCCCN2Cc2cccc(C)c2)CC1 ZINC000377128570 477656563 /nfs/dbraw/zinc/65/65/63/477656563.db2.gz QTGHJOZRJIIGSB-IBGZPJMESA-N 1 3 329.488 2.560 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)N(C)C ZINC000459034436 477708879 /nfs/dbraw/zinc/70/88/79/477708879.db2.gz DFGDVGSAZKOWFU-AOIWGVFYSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)N(C)C ZINC000459034436 477708888 /nfs/dbraw/zinc/70/88/88/477708888.db2.gz DFGDVGSAZKOWFU-AOIWGVFYSA-N 1 3 346.519 2.631 10 0 EFAEHO C[C@@H](CNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1)[NH+](C)C ZINC000459034436 477708894 /nfs/dbraw/zinc/70/88/94/477708894.db2.gz DFGDVGSAZKOWFU-AOIWGVFYSA-N 1 3 346.519 2.631 10 0 EFAEHO CCN(C(=O)NC[C@H](C)[NH+](C)C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000459033580 477709415 /nfs/dbraw/zinc/70/94/15/477709415.db2.gz CBBOGRNFMROJEO-JENIJYKNSA-N 1 3 346.519 2.804 10 0 EFAEHO Cc1cc2c(ncnc2N2CCN(CC[C@H]3CCC[NH2+]C3)CC2)s1 ZINC000420376259 477733237 /nfs/dbraw/zinc/73/32/37/477733237.db2.gz QFIBKAAPUKGGDI-OAHLLOKOSA-N 1 3 345.516 2.511 10 0 EFAEHO C[NH+](C)CCCC1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC000377323927 477740100 /nfs/dbraw/zinc/74/01/00/477740100.db2.gz SEIYUJJGMXCVAQ-IBGZPJMESA-N 1 3 341.515 2.779 10 0 EFAEHO CCOc1ccccc1NC(=O)CCN1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000420390923 477741681 /nfs/dbraw/zinc/74/16/81/477741681.db2.gz HYXFLAXLDZNDNW-WMZOPIPTSA-N 1 3 345.487 2.878 10 0 EFAEHO CCOc1ccccc1NC(=O)CCN1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000420390921 477742879 /nfs/dbraw/zinc/74/28/79/477742879.db2.gz HYXFLAXLDZNDNW-SJLPKXTDSA-N 1 3 345.487 2.878 10 0 EFAEHO C[C@H](NCC(=O)NC1CC[NH+](C2CC2)CC1)c1cccc(C2CC2)c1 ZINC000451111340 477828904 /nfs/dbraw/zinc/82/89/04/477828904.db2.gz GJJUIUWQRHWRGM-HNNXBMFYSA-N 1 3 341.499 2.958 10 0 EFAEHO COCC[N@H+](C)CCCC1CCN([C@@H](C)c2cnc(C)cn2)CC1 ZINC000428290611 477861639 /nfs/dbraw/zinc/86/16/39/477861639.db2.gz YUVCLYCSKHQAHO-KRWDZBQOSA-N 1 3 334.508 2.916 10 0 EFAEHO COCC[N@@H+](C)CCCC1CCN([C@@H](C)c2cnc(C)cn2)CC1 ZINC000428290611 477861645 /nfs/dbraw/zinc/86/16/45/477861645.db2.gz YUVCLYCSKHQAHO-KRWDZBQOSA-N 1 3 334.508 2.916 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@]1(C)CCC[N@@H+]1Cc1ccccc1)N(C)C ZINC000428325214 477870270 /nfs/dbraw/zinc/87/02/70/477870270.db2.gz KXHKUEYJJRRIRY-AZUAARDMSA-N 1 3 331.504 2.744 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@]1(C)CCC[N@H+]1Cc1ccccc1)N(C)C ZINC000428325214 477870274 /nfs/dbraw/zinc/87/02/74/477870274.db2.gz KXHKUEYJJRRIRY-AZUAARDMSA-N 1 3 331.504 2.744 10 0 EFAEHO CCN1CCN(CCCC[NH2+]C2CC(OCc3ccccc3)C2)CC1 ZINC000493884091 477871348 /nfs/dbraw/zinc/87/13/48/477871348.db2.gz VSVRKRIZNQMZEN-UHFFFAOYSA-N 1 3 345.531 2.742 10 0 EFAEHO Clc1cccc2c1CCN(CCNC1CC[NH+](C3CC3)CC1)C2 ZINC000459514292 477948099 /nfs/dbraw/zinc/94/80/99/477948099.db2.gz SSWHTBKTDLBPFA-UHFFFAOYSA-N 1 3 333.907 2.915 10 0 EFAEHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NCCOC[C@H]2CCCO2)CC1 ZINC000560112394 478021882 /nfs/dbraw/zinc/02/18/82/478021882.db2.gz DOGLEMZXYBJOJX-GHTZIAJQSA-N 1 3 346.515 2.867 10 0 EFAEHO Cn1cnc(CC[NH2+][C@@H]2CCC[C@H]3CN(Cc4ccccc4)C[C@H]32)c1 ZINC000459654404 478024899 /nfs/dbraw/zinc/02/48/99/478024899.db2.gz FMKJNSQZGDUAHR-CEWLAPEOSA-N 1 3 338.499 2.853 10 0 EFAEHO COc1ccccc1-c1ncc(CNCC[C@@H]2CCC[N@H+](C)C2)cn1 ZINC000459793867 478095765 /nfs/dbraw/zinc/09/57/65/478095765.db2.gz UBIZRWSROUOULU-INIZCTEOSA-N 1 3 340.471 2.974 10 0 EFAEHO COc1ccccc1-c1ncc(CNCC[C@@H]2CCC[N@@H+](C)C2)cn1 ZINC000459793867 478095772 /nfs/dbraw/zinc/09/57/72/478095772.db2.gz UBIZRWSROUOULU-INIZCTEOSA-N 1 3 340.471 2.974 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C(=O)NCCN3CCCC3)cc2)[C@H]1C ZINC000495056713 478114665 /nfs/dbraw/zinc/11/46/65/478114665.db2.gz CXHLMIOQMYKUEZ-JTDSTZFVSA-N 1 3 329.488 2.646 10 0 EFAEHO C[C@H](CN(C)[C@@]1(CO)CC[C@@H](C)C1)C[N@H+](C)[C@]1(CO)CC[C@H](C)C1 ZINC000495194387 478139131 /nfs/dbraw/zinc/13/91/31/478139131.db2.gz LVIDPVCTNHMVNC-KJFMYELZSA-N 1 3 340.552 2.588 10 0 EFAEHO C[C@H](CN(C)[C@@]1(CO)CC[C@@H](C)C1)C[N@@H+](C)[C@]1(CO)CC[C@H](C)C1 ZINC000495194387 478139145 /nfs/dbraw/zinc/13/91/45/478139145.db2.gz LVIDPVCTNHMVNC-KJFMYELZSA-N 1 3 340.552 2.588 10 0 EFAEHO C[C@@H](CN(C)[C@]1(CO)CC[C@H](C)C1)C[N@H+](C)[C@@]1(CO)CC[C@@H](C)C1 ZINC000495194387 478139149 /nfs/dbraw/zinc/13/91/49/478139149.db2.gz LVIDPVCTNHMVNC-KJFMYELZSA-N 1 3 340.552 2.588 10 0 EFAEHO C[C@@H](CN(C)[C@]1(CO)CC[C@H](C)C1)C[N@@H+](C)[C@@]1(CO)CC[C@@H](C)C1 ZINC000495194387 478139153 /nfs/dbraw/zinc/13/91/53/478139153.db2.gz LVIDPVCTNHMVNC-KJFMYELZSA-N 1 3 340.552 2.588 10 0 EFAEHO CN(c1ccccc1C[N@H+](C)C1CCOCC1)C1CCN(C)CC1 ZINC000534344418 478149366 /nfs/dbraw/zinc/14/93/66/478149366.db2.gz FGUDFJYIUQEIOF-UHFFFAOYSA-N 1 3 331.504 2.828 10 0 EFAEHO CN(c1ccccc1C[N@@H+](C)C1CCOCC1)C1CCN(C)CC1 ZINC000534344418 478149374 /nfs/dbraw/zinc/14/93/74/478149374.db2.gz FGUDFJYIUQEIOF-UHFFFAOYSA-N 1 3 331.504 2.828 10 0 EFAEHO CCc1ccccc1[C@H](N)CNC(=O)C1C[C@H]2CCC[C@@H](C1)C2[NH3+] ZINC000561193532 478164293 /nfs/dbraw/zinc/16/42/93/478164293.db2.gz GHZWCVFZHHTAIB-DRGBWMFJSA-N 1 3 329.488 2.519 10 0 EFAEHO C[C@@H](CNC(=O)NC1CCC(C[NH+](C)C)CC1)N1CCCC[C@@H]1C ZINC000440823894 478167305 /nfs/dbraw/zinc/16/73/05/478167305.db2.gz GXNZUOLNTOBMMW-VYMRPNJYSA-N 1 3 338.540 2.669 10 0 EFAEHO C[C@@H](CNC(=O)NC1CCC(C[NH+](C)C)CC1)N1CCCC[C@H]1C ZINC000440823893 478167808 /nfs/dbraw/zinc/16/78/08/478167808.db2.gz GXNZUOLNTOBMMW-VEZWFGLTSA-N 1 3 338.540 2.669 10 0 EFAEHO CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)CN1CC[C@H](C)C1 ZINC000561269961 478173763 /nfs/dbraw/zinc/17/37/63/478173763.db2.gz JGFVEBFFXSCFQD-ICSRJNTNSA-N 1 3 343.515 2.699 10 0 EFAEHO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)CN1CC[C@H](C)C1 ZINC000561269961 478173767 /nfs/dbraw/zinc/17/37/67/478173767.db2.gz JGFVEBFFXSCFQD-ICSRJNTNSA-N 1 3 343.515 2.699 10 0 EFAEHO C[N@@H+]1CCCC[C@H]1CN1CCN(CC2Cc3ccccc3C2)CC1 ZINC000562376177 478240462 /nfs/dbraw/zinc/24/04/62/478240462.db2.gz AWUDBOPFMXBJFV-NRFANRHFSA-N 1 3 327.516 2.503 10 0 EFAEHO C[N@H+]1CCCC[C@H]1CN1CCN(CC2Cc3ccccc3C2)CC1 ZINC000562376177 478240467 /nfs/dbraw/zinc/24/04/67/478240467.db2.gz AWUDBOPFMXBJFV-NRFANRHFSA-N 1 3 327.516 2.503 10 0 EFAEHO COC(=O)[C@@H]1CCCCC[C@@H]1[NH2+]Cc1ccc(OCCN(C)C)cc1 ZINC000590655149 478277558 /nfs/dbraw/zinc/27/75/58/478277558.db2.gz RAJDFIDKCKOLAV-MOPGFXCFSA-N 1 3 348.487 2.839 10 0 EFAEHO C[C@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000579569030 478328108 /nfs/dbraw/zinc/32/81/08/478328108.db2.gz CJGYDAVKBZNMDD-UONOGXRCSA-N 1 3 348.466 2.713 10 0 EFAEHO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000579569030 478328117 /nfs/dbraw/zinc/32/81/17/478328117.db2.gz CJGYDAVKBZNMDD-UONOGXRCSA-N 1 3 348.466 2.713 10 0 EFAEHO C[C@@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000579569028 478328333 /nfs/dbraw/zinc/32/83/33/478328333.db2.gz CJGYDAVKBZNMDD-KBPBESRZSA-N 1 3 348.466 2.713 10 0 EFAEHO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000579569028 478328342 /nfs/dbraw/zinc/32/83/42/478328342.db2.gz CJGYDAVKBZNMDD-KBPBESRZSA-N 1 3 348.466 2.713 10 0 EFAEHO CCN1CCC([NH2+]Cc2cnc(-c3ccccc3OC)nc2)CC1 ZINC000490645303 478364814 /nfs/dbraw/zinc/36/48/14/478364814.db2.gz POLALMNFIBPPAI-UHFFFAOYSA-N 1 3 326.444 2.726 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)N1CCc2ccccc2[C@H]1CN ZINC000563091827 478446112 /nfs/dbraw/zinc/44/61/12/478446112.db2.gz FKXWLCBBHZTENI-JTDSTZFVSA-N 1 3 344.503 2.517 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N1CCc2ccccc2[C@H]1CN ZINC000563091827 478446117 /nfs/dbraw/zinc/44/61/17/478446117.db2.gz FKXWLCBBHZTENI-JTDSTZFVSA-N 1 3 344.503 2.517 10 0 EFAEHO COC(=O)c1cc(C[NH2+]CC2CCN(c3ccncc3)CC2)c(C)o1 ZINC000594608741 478467106 /nfs/dbraw/zinc/46/71/06/478467106.db2.gz ZZUACHFSGFZQSH-UHFFFAOYSA-N 1 3 343.427 2.776 10 0 EFAEHO CN(CCC(=O)NCCC[N@H+](C)Cc1ccccc1)c1ccncc1 ZINC000540929338 478511760 /nfs/dbraw/zinc/51/17/60/478511760.db2.gz JUVQLBDEIQMNOY-UHFFFAOYSA-N 1 3 340.471 2.546 10 0 EFAEHO CN(CCC(=O)NCCC[N@@H+](C)Cc1ccccc1)c1ccncc1 ZINC000540929338 478511763 /nfs/dbraw/zinc/51/17/63/478511763.db2.gz JUVQLBDEIQMNOY-UHFFFAOYSA-N 1 3 340.471 2.546 10 0 EFAEHO CN1CC[C@H](NC(=O)N[C@H](C[NH3+])C2CCCCC2)[C@@H]1c1ccccc1 ZINC000582171176 478530399 /nfs/dbraw/zinc/53/03/99/478530399.db2.gz RDWORXYJZZTLAA-OTWHNJEPSA-N 1 3 344.503 2.639 10 0 EFAEHO CCn1ncc(CNC2CCC([N@H+](C)Cc3ccccc3)CC2)n1 ZINC000527921948 478572634 /nfs/dbraw/zinc/57/26/34/478572634.db2.gz APVXQSHPDLEXGH-UHFFFAOYSA-N 1 3 327.476 2.831 10 0 EFAEHO CCn1ncc(CNC2CCC([N@@H+](C)Cc3ccccc3)CC2)n1 ZINC000527921948 478572644 /nfs/dbraw/zinc/57/26/44/478572644.db2.gz APVXQSHPDLEXGH-UHFFFAOYSA-N 1 3 327.476 2.831 10 0 EFAEHO C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)CCN(C)c2ccncc2)C1 ZINC000541855658 478597654 /nfs/dbraw/zinc/59/76/54/478597654.db2.gz QFKDBBGELILMBU-INIZCTEOSA-N 1 3 332.492 2.535 10 0 EFAEHO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)CCN(C)c2ccncc2)C1 ZINC000541855658 478597659 /nfs/dbraw/zinc/59/76/59/478597659.db2.gz QFKDBBGELILMBU-INIZCTEOSA-N 1 3 332.492 2.535 10 0 EFAEHO C[C@H](CSCCF)[NH2+]CC1(O)CCN(Cc2ccccc2)CC1 ZINC000595051209 478642025 /nfs/dbraw/zinc/64/20/25/478642025.db2.gz LQJCTJXZQNFXMC-MRXNPFEDSA-N 1 3 340.508 2.694 10 0 EFAEHO NC[C@H]1c2ccccc2CCN1C(=O)NCC[NH2+]C1CCCCCC1 ZINC000571760321 478671322 /nfs/dbraw/zinc/67/13/22/478671322.db2.gz UQODVHJFWKAQSA-IBGZPJMESA-N 1 3 344.503 2.567 10 0 EFAEHO COC(=O)[C@@H]1C[C@@H]1[C@H](C)[NH2+]C[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000601137647 478681750 /nfs/dbraw/zinc/68/17/50/478681750.db2.gz FSCPQNIESKSGIK-UWAKZDDMSA-N 1 3 330.472 2.542 10 0 EFAEHO CN(CCC(=O)Nc1ccc(CC[NH+](C)C)cc1)c1ccncc1 ZINC000542784974 478686458 /nfs/dbraw/zinc/68/64/58/478686458.db2.gz IUMBPSQCHZOGRR-UHFFFAOYSA-N 1 3 326.444 2.651 10 0 EFAEHO C[N@@H+]1CCCC[C@@H]1CN1CCN(C[C@@H]2CCc3ccccc3C2)CC1 ZINC000542916114 478707343 /nfs/dbraw/zinc/70/73/43/478707343.db2.gz WSFHYISJJNMQKK-DENIHFKCSA-N 1 3 341.543 2.893 10 0 EFAEHO C[N@H+]1CCCC[C@@H]1CN1CCN(C[C@@H]2CCc3ccccc3C2)CC1 ZINC000542916114 478707354 /nfs/dbraw/zinc/70/73/54/478707354.db2.gz WSFHYISJJNMQKK-DENIHFKCSA-N 1 3 341.543 2.893 10 0 EFAEHO CCN(C(=O)N[C@H](C)C[C@H](C)[NH3+])[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000582903662 478715109 /nfs/dbraw/zinc/71/51/09/478715109.db2.gz LVCSOCFGDKDXRX-ZMMAXQRCSA-N 1 3 346.519 2.979 10 0 EFAEHO CCN(C(=O)N[C@H](C)C[C@H](C)[NH3+])[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000582903660 478715399 /nfs/dbraw/zinc/71/53/99/478715399.db2.gz LVCSOCFGDKDXRX-FAJBIJEISA-N 1 3 346.519 2.979 10 0 EFAEHO CC[NH+](CC)CCO[C@@H]1CCN(C[C@@H](OC)c2ccc(F)cc2)C1 ZINC000528400929 478755808 /nfs/dbraw/zinc/75/58/08/478755808.db2.gz TUXBTTPODWDDLP-RTBURBONSA-N 1 3 338.467 2.946 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)NCC1([NH+](C)C)CCCCCC1 ZINC000501544486 478807838 /nfs/dbraw/zinc/80/78/38/478807838.db2.gz DOPWTLDPLODORI-QGZVFWFLSA-N 1 3 338.540 2.815 10 0 EFAEHO Cc1cccc(C(=O)NCCN[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000564824532 478822577 /nfs/dbraw/zinc/82/25/77/478822577.db2.gz HBPDZIPDIOTHBG-GUDVDZBRSA-N 1 3 329.488 2.625 10 0 EFAEHO [NH3+]C1CCC(OCC(=O)Nc2cccc(CN3CCCCC3)c2)CC1 ZINC000564909598 478857062 /nfs/dbraw/zinc/85/70/62/478857062.db2.gz OTXKSYJIUUDSJG-UHFFFAOYSA-N 1 3 345.487 2.898 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](N[C@@H]2C[C@@H](OCC)[C@H]2SC)[C@H](C)C1 ZINC000592393821 478881430 /nfs/dbraw/zinc/88/14/30/478881430.db2.gz DCPOPYIJJIHYDT-ILOCAZANSA-N 1 3 344.565 2.622 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](N[C@@H]2C[C@@H](OCC)[C@H]2SC)[C@H](C)C1 ZINC000592393821 478881435 /nfs/dbraw/zinc/88/14/35/478881435.db2.gz DCPOPYIJJIHYDT-ILOCAZANSA-N 1 3 344.565 2.622 10 0 EFAEHO CC(C)[NH2+]CCCNC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000583614564 478890683 /nfs/dbraw/zinc/89/06/83/478890683.db2.gz RNDOUNKASCYFDR-HXUWFJFHSA-N 1 3 346.519 2.728 10 0 EFAEHO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000583741412 478929857 /nfs/dbraw/zinc/92/98/57/478929857.db2.gz YNDLOPSOQZOEIB-ZIAGYGMSSA-N 1 3 348.466 2.856 10 0 EFAEHO CCO[C@@H]1C[C@@H](NC[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)[C@@H]1SC ZINC000592523956 478930093 /nfs/dbraw/zinc/93/00/93/478930093.db2.gz AWLUZHNXVWVSHL-ZRSRNVLSSA-N 1 3 334.529 2.830 10 0 EFAEHO CCO[C@@H]1C[C@@H](NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)[C@@H]1SC ZINC000592523956 478930103 /nfs/dbraw/zinc/93/01/03/478930103.db2.gz AWLUZHNXVWVSHL-ZRSRNVLSSA-N 1 3 334.529 2.830 10 0 EFAEHO C[NH+](C)CC1CCC(NC(=O)Nc2cccc3c2CCNC3)CC1 ZINC000583919869 478971765 /nfs/dbraw/zinc/97/17/65/478971765.db2.gz LMOKESHCXSERHE-UHFFFAOYSA-N 1 3 330.476 2.574 10 0 EFAEHO C[C@@H]1C[C@@H](CCNC[C@H](O)C(F)(F)F)C[N@@H+]1Cc1ccccc1 ZINC000514668401 479044526 /nfs/dbraw/zinc/04/45/26/479044526.db2.gz GTFLCZCNTZUFFS-BMFZPTHFSA-N 1 3 330.394 2.800 10 0 EFAEHO C[C@@H]1C[C@@H](CCNC[C@H](O)C(F)(F)F)C[N@H+]1Cc1ccccc1 ZINC000514668401 479044537 /nfs/dbraw/zinc/04/45/37/479044537.db2.gz GTFLCZCNTZUFFS-BMFZPTHFSA-N 1 3 330.394 2.800 10 0 EFAEHO COC(=O)[C@H](C)[C@@H](NCc1cccc2c1CC[NH2+]C2)c1ccccc1 ZINC000595889955 479054468 /nfs/dbraw/zinc/05/44/68/479054468.db2.gz ANANTRLTRSEITN-FOIQADDNSA-N 1 3 338.451 2.972 10 0 EFAEHO CC(C)(CNC(=O)N1CCc2ccccc2[C@H]1CN)[NH+]1CCCCC1 ZINC000514935874 479094366 /nfs/dbraw/zinc/09/43/66/479094366.db2.gz GKKVXQDVAWLHPB-GOSISDBHSA-N 1 3 344.503 2.519 10 0 EFAEHO CC(C)OCC[C@@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000573954959 479183991 /nfs/dbraw/zinc/18/39/91/479183991.db2.gz WETAZSHTDNMGDG-OTYNDTSQSA-N 1 3 346.515 2.948 10 0 EFAEHO CC(C)OCC[C@@H](O)CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000573954959 479184000 /nfs/dbraw/zinc/18/40/00/479184000.db2.gz WETAZSHTDNMGDG-OTYNDTSQSA-N 1 3 346.515 2.948 10 0 EFAEHO c1ncn2cc(CN[C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)ccc12 ZINC000584714360 479214690 /nfs/dbraw/zinc/21/46/90/479214690.db2.gz KQHDZOJJUFDJQH-ICSRJNTNSA-N 1 3 334.423 2.680 10 0 EFAEHO c1cc2c(cc1CN1CCC(OC[C@H]3CCCCO3)CC1)C[NH2+]CC2 ZINC000584783726 479242675 /nfs/dbraw/zinc/24/26/75/479242675.db2.gz KIWQYUJVEUPVAT-OAQYLSRUSA-N 1 3 344.499 2.882 10 0 EFAEHO [NH3+]C1(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCCC1 ZINC000557137546 479258708 /nfs/dbraw/zinc/25/87/08/479258708.db2.gz XOFHRTNAYOEJEU-GOSISDBHSA-N 1 3 344.503 2.612 10 0 EFAEHO C[NH+](C)CCc1ccc(C(=O)NC[C@@H]2CCN2C2CCCCC2)cc1 ZINC000529716502 479261910 /nfs/dbraw/zinc/26/19/10/479261910.db2.gz MSNCOLIKXVRNIQ-FQEVSTJZSA-N 1 3 343.515 2.928 10 0 EFAEHO CCC[N@H+](CC)C[C@@H](C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000575633547 479460556 /nfs/dbraw/zinc/46/05/56/479460556.db2.gz SDDRJBYOPMVAQD-NZSAHSFTSA-N 1 3 346.519 2.851 10 0 EFAEHO CCC[N@@H+](CC)C[C@@H](C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000575633547 479460563 /nfs/dbraw/zinc/46/05/63/479460563.db2.gz SDDRJBYOPMVAQD-NZSAHSFTSA-N 1 3 346.519 2.851 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)NC[C@H]2CCCCN2C2CC2)cc1 ZINC000575853606 479487847 /nfs/dbraw/zinc/48/78/47/479487847.db2.gz FQKZIYFEPBAZHQ-KBXCAEBGSA-N 1 3 330.476 2.522 10 0 EFAEHO CC(C)C[NH+]1CCC(NC(=O)Nc2ccc3c(c2F)CCNC3)CC1 ZINC000578847841 479617814 /nfs/dbraw/zinc/61/78/14/479617814.db2.gz SUPQGOJFFBJILL-UHFFFAOYSA-N 1 3 348.466 2.713 10 0 EFAEHO C[C@H](C[NH+]1CCC(C)CC1)NC(=O)CCN1CCc2ccccc2C1 ZINC000618985301 479659817 /nfs/dbraw/zinc/65/98/17/479659817.db2.gz GPDYQUCROANNMW-GOSISDBHSA-N 1 3 343.515 2.671 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](C[N@@H+](C)CCc3cncn3C)C2)s1 ZINC000579115982 479663719 /nfs/dbraw/zinc/66/37/19/479663719.db2.gz ZYFXAVCQEKMBGF-INIZCTEOSA-N 1 3 332.517 2.786 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](C[N@H+](C)CCc3cncn3C)C2)s1 ZINC000579115982 479663722 /nfs/dbraw/zinc/66/37/22/479663722.db2.gz ZYFXAVCQEKMBGF-INIZCTEOSA-N 1 3 332.517 2.786 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](CN(C)CCc3cncn3C)C2)s1 ZINC000579115982 479663723 /nfs/dbraw/zinc/66/37/23/479663723.db2.gz ZYFXAVCQEKMBGF-INIZCTEOSA-N 1 3 332.517 2.786 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)CCc3cncn3C)C2)s1 ZINC000579115982 479663728 /nfs/dbraw/zinc/66/37/28/479663728.db2.gz ZYFXAVCQEKMBGF-INIZCTEOSA-N 1 3 332.517 2.786 10 0 EFAEHO Cc1ccc(CN2CC[C@H](C[N@@H+](C)CCc3cncn3C)C2)s1 ZINC000579115983 479663882 /nfs/dbraw/zinc/66/38/82/479663882.db2.gz ZYFXAVCQEKMBGF-MRXNPFEDSA-N 1 3 332.517 2.786 10 0 EFAEHO Cc1ccc(CN2CC[C@H](C[N@H+](C)CCc3cncn3C)C2)s1 ZINC000579115983 479663886 /nfs/dbraw/zinc/66/38/86/479663886.db2.gz ZYFXAVCQEKMBGF-MRXNPFEDSA-N 1 3 332.517 2.786 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CN(C)CCc3cncn3C)C2)s1 ZINC000579115983 479663888 /nfs/dbraw/zinc/66/38/88/479663888.db2.gz ZYFXAVCQEKMBGF-MRXNPFEDSA-N 1 3 332.517 2.786 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CN(C)CCc3cncn3C)C2)s1 ZINC000579115983 479663893 /nfs/dbraw/zinc/66/38/93/479663893.db2.gz ZYFXAVCQEKMBGF-MRXNPFEDSA-N 1 3 332.517 2.786 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@H]1CC[C@@H]1c1ccc(F)cc1 ZINC000628050360 479746476 /nfs/dbraw/zinc/74/64/76/479746476.db2.gz BHXFZMHALVNOPH-IPELMVKDSA-N 1 3 349.494 2.708 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@H]1CC[C@@H]1c1ccc(F)cc1 ZINC000628050360 479746480 /nfs/dbraw/zinc/74/64/80/479746480.db2.gz BHXFZMHALVNOPH-IPELMVKDSA-N 1 3 349.494 2.708 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)N[C@@H](C)CN2CCC(C)CC2)CC1 ZINC000633355774 479785840 /nfs/dbraw/zinc/78/58/40/479785840.db2.gz ZYVQDERGXZEOLI-KRWDZBQOSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)N1CCN(C2CC[NH+](C[C@]3(C)CCCS3)CC2)CC1 ZINC000628188095 479803696 /nfs/dbraw/zinc/80/36/96/479803696.db2.gz NLNTVPVGCYNFCF-SFHVURJKSA-N 1 3 325.566 2.763 10 0 EFAEHO CC[C@@H]1CCCC[C@@H]1C[NH2+]CC1(N2CCOCC2)CCN(C)CC1 ZINC000628309955 479851945 /nfs/dbraw/zinc/85/19/45/479851945.db2.gz DKMRVJVZYFDFFI-RTBURBONSA-N 1 3 337.552 2.589 10 0 EFAEHO CCC1(N2CCOCC2)CC[NH+](CCN(C)Cc2ccccc2)CC1 ZINC000626089131 480196093 /nfs/dbraw/zinc/19/60/93/480196093.db2.gz BOAWOQXNRWPOOS-UHFFFAOYSA-N 1 3 345.531 2.695 10 0 EFAEHO C[NH+](C)[C@H](CNC(=O)CN1C[C@@H]2CCCC[C@@]21C)c1ccccc1 ZINC000626103860 480201711 /nfs/dbraw/zinc/20/17/11/480201711.db2.gz TXUMWURYGRTLBI-NSHGMRRFSA-N 1 3 329.488 2.670 10 0 EFAEHO C[C@@H](Cc1ccccc1)N1CCC([NH2+][C@@H](C)[C@H](O)C(F)(F)F)CC1 ZINC000631716101 480234695 /nfs/dbraw/zinc/23/46/95/480234695.db2.gz HONGLZQYNSSRSK-ZQIUZPCESA-N 1 3 344.421 2.983 10 0 EFAEHO C[C@@H](CNCC1([NH3+])CCOCC1)c1cccc(Br)c1 ZINC000629387429 480242550 /nfs/dbraw/zinc/24/25/50/480242550.db2.gz GTGYVERRJBQZHR-LBPRGKRZSA-N 1 3 327.266 2.650 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@H](c2ccccc2)N2CCOCC2)CC1(C)C ZINC000623346325 480243072 /nfs/dbraw/zinc/24/30/72/480243072.db2.gz MQRDBNPIOZKJNV-RBUKOAKNSA-N 1 3 331.504 2.522 10 0 EFAEHO Cc1ccc(C2(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)CCC2)cc1 ZINC000617502127 480245681 /nfs/dbraw/zinc/24/56/81/480245681.db2.gz CYWVUSPOQZSQPA-SFHVURJKSA-N 1 3 345.531 2.805 10 0 EFAEHO Cc1ccc(C2(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)CCC2)cc1 ZINC000617502127 480245687 /nfs/dbraw/zinc/24/56/87/480245687.db2.gz CYWVUSPOQZSQPA-SFHVURJKSA-N 1 3 345.531 2.805 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Cc1ccc2ccccc2c1 ZINC000617503536 480246589 /nfs/dbraw/zinc/24/65/89/480246589.db2.gz NSUCRHUXKQJLQL-KRWDZBQOSA-N 1 3 341.499 2.771 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Cc1ccc2ccccc2c1 ZINC000617503536 480246598 /nfs/dbraw/zinc/24/65/98/480246598.db2.gz NSUCRHUXKQJLQL-KRWDZBQOSA-N 1 3 341.499 2.771 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cc2sccc2s1 ZINC000617504936 480247043 /nfs/dbraw/zinc/24/70/43/480247043.db2.gz PXYSZPNNXYSDPW-LBPRGKRZSA-N 1 3 339.530 2.965 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cc2sccc2s1 ZINC000617504936 480247048 /nfs/dbraw/zinc/24/70/48/480247048.db2.gz PXYSZPNNXYSDPW-LBPRGKRZSA-N 1 3 339.530 2.965 10 0 EFAEHO Cc1c2ccccc2oc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617504530 480248122 /nfs/dbraw/zinc/24/81/22/480248122.db2.gz ZWGQWNFGYRFNTI-AWEZNQCLSA-N 1 3 331.460 2.743 10 0 EFAEHO Cc1c2ccccc2oc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617504530 480248129 /nfs/dbraw/zinc/24/81/29/480248129.db2.gz ZWGQWNFGYRFNTI-AWEZNQCLSA-N 1 3 331.460 2.743 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)CCc1ccccc1Cl ZINC000617503720 480248167 /nfs/dbraw/zinc/24/81/67/480248167.db2.gz WEFWMWPDDWPUNW-HNNXBMFYSA-N 1 3 339.911 2.661 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)CCc1ccccc1Cl ZINC000617503720 480248172 /nfs/dbraw/zinc/24/81/72/480248172.db2.gz WEFWMWPDDWPUNW-HNNXBMFYSA-N 1 3 339.911 2.661 10 0 EFAEHO Cc1ccccc1[C@@H](C)CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617505996 480249592 /nfs/dbraw/zinc/24/95/92/480249592.db2.gz XJUJFCQTHWPKEV-ROUUACIJSA-N 1 3 333.520 2.877 10 0 EFAEHO Cc1ccccc1[C@@H](C)CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617505996 480249596 /nfs/dbraw/zinc/24/95/96/480249596.db2.gz XJUJFCQTHWPKEV-ROUUACIJSA-N 1 3 333.520 2.877 10 0 EFAEHO Cc1cc(C)c(CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c(C)c1 ZINC000617506463 480249894 /nfs/dbraw/zinc/24/98/94/480249894.db2.gz OGHXZTUWYGXVTC-SFHVURJKSA-N 1 3 333.520 2.543 10 0 EFAEHO Cc1cc(C)c(CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c(C)c1 ZINC000617506463 480249898 /nfs/dbraw/zinc/24/98/98/480249898.db2.gz OGHXZTUWYGXVTC-SFHVURJKSA-N 1 3 333.520 2.543 10 0 EFAEHO Cc1ccsc1[C@H]1C[C@@H]1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000617506507 480250612 /nfs/dbraw/zinc/25/06/12/480250612.db2.gz QBNJETOTJNSJNC-JYJNAYRXSA-N 1 3 337.533 2.548 10 0 EFAEHO Cc1ccsc1[C@H]1C[C@@H]1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000617506507 480250619 /nfs/dbraw/zinc/25/06/19/480250619.db2.gz QBNJETOTJNSJNC-JYJNAYRXSA-N 1 3 337.533 2.548 10 0 EFAEHO Cc1ccc([C@@H](C[NH2+][C@H]2CCN(C)C(C)(C)C2)N2CCOCC2)cc1 ZINC000623364150 480251674 /nfs/dbraw/zinc/25/16/74/480251674.db2.gz VPNHQCVEAIXIFQ-VQTJNVASSA-N 1 3 345.531 2.831 10 0 EFAEHO C[C@H]1CN(Cc2cccc(CN[C@H]3CC[N@H+](C)C(C)(C)C3)c2)CCO1 ZINC000623375962 480255975 /nfs/dbraw/zinc/25/59/75/480255975.db2.gz AOCJBOJSBZAMOE-PXNSSMCTSA-N 1 3 345.531 2.870 10 0 EFAEHO C[C@H]1CN(Cc2cccc(CN[C@H]3CC[N@@H+](C)C(C)(C)C3)c2)CCO1 ZINC000623375962 480255981 /nfs/dbraw/zinc/25/59/81/480255981.db2.gz AOCJBOJSBZAMOE-PXNSSMCTSA-N 1 3 345.531 2.870 10 0 EFAEHO C[C@H]1CN(Cc2cccc(C[NH2+][C@H]3CCN(C)C(C)(C)C3)c2)CCO1 ZINC000623375962 480255984 /nfs/dbraw/zinc/25/59/84/480255984.db2.gz AOCJBOJSBZAMOE-PXNSSMCTSA-N 1 3 345.531 2.870 10 0 EFAEHO Cc1nc(CN2CCC(C[NH2+][C@@H]3CCN(C)C(C)(C)C3)CC2)oc1C ZINC000623414617 480271638 /nfs/dbraw/zinc/27/16/38/480271638.db2.gz KCPGLWBEHNASNE-GOSISDBHSA-N 1 3 348.535 2.966 10 0 EFAEHO C[C@H](CN1CCN(c2ccccc2)CC1)N[C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623428835 480279300 /nfs/dbraw/zinc/27/93/00/480279300.db2.gz AKNKTMABUKUKBA-MOPGFXCFSA-N 1 3 344.547 2.660 10 0 EFAEHO C[C@H](CN1CCN(c2ccccc2)CC1)N[C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623428835 480279307 /nfs/dbraw/zinc/27/93/07/480279307.db2.gz AKNKTMABUKUKBA-MOPGFXCFSA-N 1 3 344.547 2.660 10 0 EFAEHO CCN(C(=O)c1ccc(OCC[NH+](CC)CC)cc1)[C@@H]1CCN(C)C1 ZINC000617558046 480280002 /nfs/dbraw/zinc/28/00/02/480280002.db2.gz YYUZVKNNPACEPZ-GOSISDBHSA-N 1 3 347.503 2.573 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1)c1ccccc1 ZINC000631826877 480287826 /nfs/dbraw/zinc/28/78/26/480287826.db2.gz YYSCYCWSYXDUHF-HNBVOPMISA-N 1 3 343.515 2.964 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCC([C@H]2CCC[NH2+]2)CC1)c1ccccc1 ZINC000631827384 480287944 /nfs/dbraw/zinc/28/79/44/480287944.db2.gz NHBMXYQGVSWQKU-GPMSIDNRSA-N 1 3 329.488 2.716 10 0 EFAEHO C[C@@H](NC(=O)[C@H](C)N1CCC([C@@H]2CCC[NH2+]2)CC1)c1ccccc1 ZINC000631827383 480287965 /nfs/dbraw/zinc/28/79/65/480287965.db2.gz NHBMXYQGVSWQKU-GJYPPUQNSA-N 1 3 329.488 2.716 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCC[C@H]([C@H]2CCC[NH2+]C2)C1)c1ccccc1 ZINC000631826879 480288518 /nfs/dbraw/zinc/28/85/18/480288518.db2.gz YYSCYCWSYXDUHF-JYBIWHBTSA-N 1 3 343.515 2.964 10 0 EFAEHO C[C@@H](NC(=O)[C@H](C)N1CCC[C@H](C2CC[NH2+]CC2)C1)c1ccccc1 ZINC000631829606 480288858 /nfs/dbraw/zinc/28/88/58/480288858.db2.gz VUSWCIDTXRLSFZ-UWVAXJGDSA-N 1 3 343.515 2.964 10 0 EFAEHO CN1CC[C@H]([NH2+][C@@H](CO)c2cccc(Br)c2)CC1(C)C ZINC000623452886 480290330 /nfs/dbraw/zinc/29/03/30/480290330.db2.gz SQSJCJZQCBEDOO-GJZGRUSLSA-N 1 3 341.293 2.945 10 0 EFAEHO C[C@H](N)[C@H](Cc1ccccc1)[NH2+]C[C@@H](n1cccn1)C(F)(F)F ZINC000629514084 480290622 /nfs/dbraw/zinc/29/06/22/480290622.db2.gz JAWHWEQJZWYBMX-AEGPPILISA-N 1 3 326.366 2.535 10 0 EFAEHO Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]CC1(N)CCOCC1 ZINC000629522118 480292682 /nfs/dbraw/zinc/29/26/82/480292682.db2.gz VKOKJJJUDHWFCU-LBPRGKRZSA-N 1 3 332.473 2.672 10 0 EFAEHO COCc1cccc(OCC2(C[N@H+]3C[C@@H](CN)[C@H](C)C3)CCC2)c1 ZINC000631838341 480293307 /nfs/dbraw/zinc/29/33/07/480293307.db2.gz MRQMLZADYJHFMG-SJLPKXTDSA-N 1 3 332.488 2.909 10 0 EFAEHO COCc1cccc(OCC2(C[N@@H+]3C[C@@H](CN)[C@H](C)C3)CCC2)c1 ZINC000631838341 480293313 /nfs/dbraw/zinc/29/33/13/480293313.db2.gz MRQMLZADYJHFMG-SJLPKXTDSA-N 1 3 332.488 2.909 10 0 EFAEHO COCc1cccc(OCC2(CN3C[C@@H](C[NH3+])[C@H](C)C3)CCC2)c1 ZINC000631838341 480293318 /nfs/dbraw/zinc/29/33/18/480293318.db2.gz MRQMLZADYJHFMG-SJLPKXTDSA-N 1 3 332.488 2.909 10 0 EFAEHO Cc1c([C@@H](C)NCCOCCC[NH3+])cnn1-c1cccc(Cl)c1 ZINC000629534691 480296119 /nfs/dbraw/zinc/29/61/19/480296119.db2.gz BHAWQBDUBUFXOY-CYBMUJFWSA-N 1 3 336.867 2.850 10 0 EFAEHO COC[C@@H](CCC[NH3+])NCc1cc(F)c(Br)cc1F ZINC000629531427 480296485 /nfs/dbraw/zinc/29/64/85/480296485.db2.gz KUGUKAROLMBKRQ-SNVBAGLBSA-N 1 3 337.208 2.571 10 0 EFAEHO C[NH2+]CCOCCN[C@H](c1ccc(Br)cc1F)C1CC1 ZINC000629530596 480297057 /nfs/dbraw/zinc/29/70/57/480297057.db2.gz KXYMJJBVDZXUIP-HNNXBMFYSA-N 1 3 345.256 2.865 10 0 EFAEHO [NH3+]CCCOCCN[C@H]1CCCOc2ccc(Br)cc21 ZINC000629537106 480297783 /nfs/dbraw/zinc/29/77/83/480297783.db2.gz ITPPYRBRWJUQBE-AWEZNQCLSA-N 1 3 343.265 2.618 10 0 EFAEHO C[NH2+]CCOCCN(C)Cc1ccc(C(=O)Nc2ccccc2)cc1 ZINC000629569639 480314372 /nfs/dbraw/zinc/31/43/72/480314372.db2.gz QNRCAUXLQZDZJR-UHFFFAOYSA-N 1 3 341.455 2.607 10 0 EFAEHO CN1CC[C@@H]([NH2+]C[C@H]2CN(Cc3ccccc3)CCCO2)CC1(C)C ZINC000623507255 480319010 /nfs/dbraw/zinc/31/90/10/480319010.db2.gz AQQAWNYDMSFDEJ-UXHICEINSA-N 1 3 345.531 2.740 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2C[C@H](OC(C)(C)C)[C@H]2n2cccn2)CC1(C)C ZINC000623542415 480333122 /nfs/dbraw/zinc/33/31/22/480333122.db2.gz ZOELVBSWHPDESU-YVSFHVDLSA-N 1 3 334.508 2.843 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2C[C@H](OC(C)(C)C)[C@H]2n2cccn2)CC1(C)C ZINC000623542415 480333124 /nfs/dbraw/zinc/33/31/24/480333124.db2.gz ZOELVBSWHPDESU-YVSFHVDLSA-N 1 3 334.508 2.843 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3C[C@@H]4CCCC[C@@]43C)CC2)CC1 ZINC000629618877 480333886 /nfs/dbraw/zinc/33/38/86/480333886.db2.gz GVMGAUZMWOFFGL-RXVVDRJESA-N 1 3 347.547 2.974 10 0 EFAEHO C[NH2+]CCOCCN(C)Cc1cn(C)nc1-c1cc2ccccc2o1 ZINC000629652159 480343362 /nfs/dbraw/zinc/34/33/62/480343362.db2.gz BQYRHRCUTGIUSY-UHFFFAOYSA-N 1 3 342.443 2.501 10 0 EFAEHO CN(C)CCOc1ccc(C[NH2+]C[C@@H]2Cc3ccccc3CO2)cc1 ZINC000623601951 480356777 /nfs/dbraw/zinc/35/67/77/480356777.db2.gz XFDLYUHNEIMPQH-NRFANRHFSA-N 1 3 340.467 2.858 10 0 EFAEHO CC[C@H]1CCCC[N@@H+]1CCNC(=O)NC[C@H]1CCN1C1CCCC1 ZINC000623610548 480360771 /nfs/dbraw/zinc/36/07/71/480360771.db2.gz XQARPKNBTGZQQX-FUHWJXTLSA-N 1 3 336.524 2.567 10 0 EFAEHO CC[C@H]1CCCC[N@H+]1CCNC(=O)NC[C@H]1CCN1C1CCCC1 ZINC000623610548 480360776 /nfs/dbraw/zinc/36/07/76/480360776.db2.gz XQARPKNBTGZQQX-FUHWJXTLSA-N 1 3 336.524 2.567 10 0 EFAEHO CC1(C)OC[C@H]2C[C@]21NCc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000623622642 480367061 /nfs/dbraw/zinc/36/70/61/480367061.db2.gz XYKMPWYOFJRWBW-XLIONFOSSA-N 1 3 330.472 2.818 10 0 EFAEHO CCN(C(=O)C1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCN(CC)C1 ZINC000617929797 480425807 /nfs/dbraw/zinc/42/58/07/480425807.db2.gz QLZWLWARYCOCIL-HXUWFJFHSA-N 1 3 343.515 2.841 10 0 EFAEHO CCN(C(=O)C1CCN(c2cc[nH+]cc2C)CC1)[C@@H]1CCN(CC)C1 ZINC000617928669 480427010 /nfs/dbraw/zinc/42/70/10/480427010.db2.gz TYJHMZOQZYTVER-GOSISDBHSA-N 1 3 344.503 2.549 10 0 EFAEHO C[C@H](c1ccccc1)[NH+]1CCC(NC[C@H](O)C[C@](C)(O)C2CC2)CC1 ZINC000634704504 480443723 /nfs/dbraw/zinc/44/37/23/480443723.db2.gz LPNHGIYPWCCVJE-HBGVWJBISA-N 1 3 346.515 2.714 10 0 EFAEHO C[NH+](C)C[C@H](O)CN[C@H]1CCCC[C@H]1Sc1ccc(F)cc1 ZINC000623889086 480505774 /nfs/dbraw/zinc/50/57/74/480505774.db2.gz CJYLAOYNAHMOPY-HYVNUMGLSA-N 1 3 326.481 2.741 10 0 EFAEHO C[N@@H+]1CC[C@@H](Nc2ccccc2CN2CCC(O)CC2)CC1(C)C ZINC000623938579 480530669 /nfs/dbraw/zinc/53/06/69/480530669.db2.gz VMUOQZBYXBUSDD-QGZVFWFLSA-N 1 3 331.504 2.928 10 0 EFAEHO C[N@H+]1CC[C@@H](Nc2ccccc2CN2CCC(O)CC2)CC1(C)C ZINC000623938579 480530677 /nfs/dbraw/zinc/53/06/77/480530677.db2.gz VMUOQZBYXBUSDD-QGZVFWFLSA-N 1 3 331.504 2.928 10 0 EFAEHO C[C@@H]1CCC[N@@H+]1Cc1ccc(-c2cnc(N3CCNCC3)nc2)cc1 ZINC000630051267 480531642 /nfs/dbraw/zinc/53/16/42/480531642.db2.gz OQULXKHYOXDXKU-MRXNPFEDSA-N 1 3 337.471 2.538 10 0 EFAEHO C[C@@H]1CCC[N@H+]1Cc1ccc(-c2cnc(N3CCNCC3)nc2)cc1 ZINC000630051267 480531647 /nfs/dbraw/zinc/53/16/47/480531647.db2.gz OQULXKHYOXDXKU-MRXNPFEDSA-N 1 3 337.471 2.538 10 0 EFAEHO C[C@@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)[C@H]1CCCCO1 ZINC000624000611 480559635 /nfs/dbraw/zinc/55/96/35/480559635.db2.gz HIPCJNLLIFIIHN-IEBWSBKVSA-N 1 3 332.488 2.561 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccc2occc2c1 ZINC000626913728 480578144 /nfs/dbraw/zinc/57/81/44/480578144.db2.gz VRGSTOYBESMJRU-AWEZNQCLSA-N 1 3 332.448 2.826 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccc2occc2c1 ZINC000626913728 480578154 /nfs/dbraw/zinc/57/81/54/480578154.db2.gz VRGSTOYBESMJRU-AWEZNQCLSA-N 1 3 332.448 2.826 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)N[C@H]1CC[NH2+]C12CCC2)c1ccccc1 ZINC000626921841 480581467 /nfs/dbraw/zinc/58/14/67/480581467.db2.gz KHGQNZLNKYRIMJ-ROUUACIJSA-N 1 3 344.503 2.653 10 0 EFAEHO C[C@@H]1CC[C@@H](NC(=O)N[C@H](CN2CCCCC2)c2ccccc2)C[NH2+]1 ZINC000626978674 480607507 /nfs/dbraw/zinc/60/75/07/480607507.db2.gz HYSJIDJBARCFFB-BHIYHBOVSA-N 1 3 344.503 2.653 10 0 EFAEHO C[C@H](NC(C)(C)CNC(=O)N[C@H]1CC[C@@H](C)[NH2+]C1)c1ccccc1 ZINC000626977862 480607648 /nfs/dbraw/zinc/60/76/48/480607648.db2.gz FIROCSXILTULGT-VYDXJSESSA-N 1 3 332.492 2.556 10 0 EFAEHO CC(C)(C(=O)N1CCC[C@H]([C@@H]2CCC[NH2+]2)C1)[C@@H](N)c1ccccc1 ZINC000645108321 480696914 /nfs/dbraw/zinc/69/69/14/480696914.db2.gz WUSDBFJYNSXSAC-BZSNNMDCSA-N 1 3 329.488 2.703 10 0 EFAEHO c1ccc(N2CCN(CCCC[NH2+]CCC[C@@H]3CCO3)CC2)cc1 ZINC000638387151 480700136 /nfs/dbraw/zinc/70/01/36/480700136.db2.gz UBQPFXLPCGZYEA-HXUWFJFHSA-N 1 3 331.504 2.748 10 0 EFAEHO C[NH+](C)[C@H]1C[C@H](NC(=O)C2CCN(Cc3ccccc3)CC2)C1(C)C ZINC000636088802 480788853 /nfs/dbraw/zinc/78/88/53/480788853.db2.gz IOCYBDMGCITVCD-OALUTQOASA-N 1 3 343.515 2.744 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](c2ccccc2)N2CCCC2)CC[N@@H+]1C ZINC000630579871 480791378 /nfs/dbraw/zinc/79/13/78/480791378.db2.gz VEZTUMNWXXNZTL-IPMKNSEASA-N 1 3 329.488 2.670 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](c2ccccc2)N2CCCC2)CC[N@H+]1C ZINC000630579871 480791384 /nfs/dbraw/zinc/79/13/84/480791384.db2.gz VEZTUMNWXXNZTL-IPMKNSEASA-N 1 3 329.488 2.670 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCC1)NC[C@H]1CC[N@@H+]1C1CCCCC1 ZINC000624544563 480809841 /nfs/dbraw/zinc/80/98/41/480809841.db2.gz XCAMZOZRBBFVNX-RTBURBONSA-N 1 3 348.535 2.710 10 0 EFAEHO O=C(NC[C@H]1CCN1C1CCCC1)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000624544563 480809849 /nfs/dbraw/zinc/80/98/49/480809849.db2.gz XCAMZOZRBBFVNX-RTBURBONSA-N 1 3 348.535 2.710 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)Nc2ccc3c(c2)CNCC3)CC1 ZINC000632949070 480816239 /nfs/dbraw/zinc/81/62/39/480816239.db2.gz OITDYVOEUWYKOC-UHFFFAOYSA-N 1 3 330.476 2.670 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NC[C@@H](C)N2CCC[C@H](C)C2)CC1 ZINC000632995878 480841085 /nfs/dbraw/zinc/84/10/85/480841085.db2.gz HWSYFKWHBCSYMJ-DLBZAZTESA-N 1 3 338.540 2.623 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)CC1 ZINC000633080879 480874453 /nfs/dbraw/zinc/87/44/53/480874453.db2.gz ACNHHPOALOBHKD-SJORKVTESA-N 1 3 338.540 2.623 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NC[C@H](C)N2CCC(C)CC2)CC1 ZINC000633085978 480877412 /nfs/dbraw/zinc/87/74/12/480877412.db2.gz INEUFIWQCFLOKW-KRWDZBQOSA-N 1 3 338.540 2.623 10 0 EFAEHO O=C(CCC1C[NH2+]C1)N[C@@H]1CCCCCN(Cc2ccccc2)C1 ZINC000638851464 480895837 /nfs/dbraw/zinc/89/58/37/480895837.db2.gz LQPGFIJSKXPQFJ-LJQANCHMSA-N 1 3 329.488 2.547 10 0 EFAEHO O=C(N[C@H]1CCCCCN(Cc2ccccc2)C1)C1CC[NH2+]CC1 ZINC000638850741 480896382 /nfs/dbraw/zinc/89/63/82/480896382.db2.gz GUHTVIDFEQBPPD-IBGZPJMESA-N 1 3 329.488 2.547 10 0 EFAEHO CCC1([NH+]2CCCC2)CCN(C(=O)N[C@@H](C)C2=CCN(C)CC2)CC1 ZINC000633157903 480902256 /nfs/dbraw/zinc/90/22/56/480902256.db2.gz FCQZAIPFHGCJOM-KRWDZBQOSA-N 1 3 348.535 2.687 10 0 EFAEHO CN(C)CCc1ccccc1NC(=O)N[C@@H]1CC[NH2+]C12CCCC2 ZINC000647476055 480957207 /nfs/dbraw/zinc/95/72/07/480957207.db2.gz NBNBFDPBVYGPQE-QGZVFWFLSA-N 1 3 330.476 2.587 10 0 EFAEHO C[C@H](NC(C)(C)CNC(=O)COC1CCC([NH3+])CC1)c1ccccc1 ZINC000645927569 480972476 /nfs/dbraw/zinc/97/24/76/480972476.db2.gz TUBITCUAIGXPOK-ZLPCBKJTSA-N 1 3 347.503 2.519 10 0 EFAEHO Cc1ccc2c(c1)[C@@H](NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)CC2 ZINC000664022635 480975407 /nfs/dbraw/zinc/97/54/07/480975407.db2.gz IBGMJHKTPHKPDR-LPHOPBHVSA-N 1 3 346.519 2.554 10 0 EFAEHO Cc1ccc2c(c1)[C@@H](NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)CC2 ZINC000664022635 480975416 /nfs/dbraw/zinc/97/54/16/480975416.db2.gz IBGMJHKTPHKPDR-LPHOPBHVSA-N 1 3 346.519 2.554 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000661401139 480988281 /nfs/dbraw/zinc/98/82/81/480988281.db2.gz ABCYKCFLLKONTI-CGTJXYLNSA-N 1 3 348.535 2.518 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000661401139 480988289 /nfs/dbraw/zinc/98/82/89/480988289.db2.gz ABCYKCFLLKONTI-CGTJXYLNSA-N 1 3 348.535 2.518 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000661405004 480993406 /nfs/dbraw/zinc/99/34/06/480993406.db2.gz BOBVBLZZRKYRTE-NVXWUHKLSA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000661405004 480993415 /nfs/dbraw/zinc/99/34/15/480993415.db2.gz BOBVBLZZRKYRTE-NVXWUHKLSA-N 1 3 336.524 2.565 10 0 EFAEHO CC[C@H](C(=O)N1CCC(N[C@@H]2C[NH2+]C[C@H](C)C2)CC1)c1ccccc1 ZINC000647550895 480997524 /nfs/dbraw/zinc/99/75/24/480997524.db2.gz NCQDBJBGKMGNME-UXPWSPDFSA-N 1 3 343.515 2.759 10 0 EFAEHO CC[C@H](C(=O)N1CCC(N[C@H]2C[NH2+]C[C@@H](C)C2)CC1)c1ccccc1 ZINC000647550894 480997770 /nfs/dbraw/zinc/99/77/70/480997770.db2.gz NCQDBJBGKMGNME-DBVUQKKJSA-N 1 3 343.515 2.759 10 0 EFAEHO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(CC)[C@H]2CCN(C)C2)C1 ZINC000664073131 481005020 /nfs/dbraw/zinc/00/50/20/481005020.db2.gz NNBSJOJVMRNDBE-SJORKVTESA-N 1 3 338.540 2.623 10 0 EFAEHO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N(CC)[C@H]2CCN(C)C2)C1 ZINC000664073131 481005027 /nfs/dbraw/zinc/00/50/27/481005027.db2.gz NNBSJOJVMRNDBE-SJORKVTESA-N 1 3 338.540 2.623 10 0 EFAEHO CCN(C(=O)N[C@@H]1CC[N@@H+](C2CCCCC2)C1)[C@H]1CCN(CC)C1 ZINC000666659770 481015916 /nfs/dbraw/zinc/01/59/16/481015916.db2.gz ZVNFYXSGYIYLIT-AEFFLSMTSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN(C(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1)[C@H]1CCN(CC)C1 ZINC000666659770 481015923 /nfs/dbraw/zinc/01/59/23/481015923.db2.gz ZVNFYXSGYIYLIT-AEFFLSMTSA-N 1 3 336.524 2.519 10 0 EFAEHO O=C([C@@H]1CC[C@@H](C2CC2)[NH2+]1)N1CCCN(CC2CCCCC2)CC1 ZINC000653112047 481086452 /nfs/dbraw/zinc/08/64/52/481086452.db2.gz KDVBLLXJMTYHTL-OALUTQOASA-N 1 3 333.520 2.632 10 0 EFAEHO COc1nsc(CNC2CCC([NH+](C)C)CC2)c1Br ZINC000639276643 481088512 /nfs/dbraw/zinc/08/85/12/481088512.db2.gz OFVZQRZMVMABTA-UHFFFAOYSA-N 1 3 348.310 2.877 10 0 EFAEHO c1ccc2c(c1)O[C@H](CCN[C@@H]1CCOC[C@H]1[C@@H]1CCC[NH2+]1)CS2 ZINC000647800382 481114455 /nfs/dbraw/zinc/11/44/55/481114455.db2.gz AFBUPQOWYNVKRC-LTIDMASMSA-N 1 3 348.512 2.677 10 0 EFAEHO CO[C@]1(C[NH2+]C[C@@H]2CN(Cc3ccccc3)CC23CCC3)CCOC1 ZINC000639328299 481130140 /nfs/dbraw/zinc/13/01/40/481130140.db2.gz GPWMJYWNQDGRTN-CTNGQTDRSA-N 1 3 344.499 2.684 10 0 EFAEHO CN(C)CCC[N@H+](C)CCNc1nc(C(F)F)nc2ccccc21 ZINC000664247413 481130961 /nfs/dbraw/zinc/13/09/61/481130961.db2.gz MIFAQKDVTMCJKM-UHFFFAOYSA-N 1 3 337.418 2.863 10 0 EFAEHO CN(C)CCC[N@@H+](C)CCNc1nc(C(F)F)nc2ccccc21 ZINC000664247413 481130968 /nfs/dbraw/zinc/13/09/68/481130968.db2.gz MIFAQKDVTMCJKM-UHFFFAOYSA-N 1 3 337.418 2.863 10 0 EFAEHO O=C(CN1CC[C@@H](C2CCCCC2)C1)NC1CC[NH+](C2CC2)CC1 ZINC000661587252 481149634 /nfs/dbraw/zinc/14/96/34/481149634.db2.gz YTKKBNWKLBYBBB-QGZVFWFLSA-N 1 3 333.520 2.632 10 0 EFAEHO C[C@@H]1CC[NH2+]C[C@H]1NC(=O)N[C@H](CN1CCCCC1)c1ccccc1 ZINC000669483615 481150210 /nfs/dbraw/zinc/15/02/10/481150210.db2.gz DPSKSWCJRXGCRT-BHIYHBOVSA-N 1 3 344.503 2.511 10 0 EFAEHO C[C@H](c1ccccc1)[C@H](C)NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000664298742 481159790 /nfs/dbraw/zinc/15/97/90/481159790.db2.gz KHUYEGCAWSIHRM-BZSNNMDCSA-N 1 3 348.535 2.750 10 0 EFAEHO C[C@H](c1ccccc1)[C@H](C)NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000664298742 481159797 /nfs/dbraw/zinc/15/97/97/481159797.db2.gz KHUYEGCAWSIHRM-BZSNNMDCSA-N 1 3 348.535 2.750 10 0 EFAEHO C[C@@H](NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)[C@@H](C)c1ccccc1 ZINC000664298746 481161518 /nfs/dbraw/zinc/16/15/18/481161518.db2.gz KHUYEGCAWSIHRM-RCCFBDPRSA-N 1 3 348.535 2.750 10 0 EFAEHO C[C@@H](NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)[C@@H](C)c1ccccc1 ZINC000664298746 481161526 /nfs/dbraw/zinc/16/15/26/481161526.db2.gz KHUYEGCAWSIHRM-RCCFBDPRSA-N 1 3 348.535 2.750 10 0 EFAEHO CCC[N@H+](CC)C[C@H](C)NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659047216 481189312 /nfs/dbraw/zinc/18/93/12/481189312.db2.gz QNOGEHRBBORFRN-YJBOKZPZSA-N 1 3 348.491 2.589 10 0 EFAEHO CCC[N@@H+](CC)C[C@H](C)NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659047216 481189320 /nfs/dbraw/zinc/18/93/20/481189320.db2.gz QNOGEHRBBORFRN-YJBOKZPZSA-N 1 3 348.491 2.589 10 0 EFAEHO CN(C)CCOc1ccc(CN2CCCC[C@H]2[C@@H]2CC[NH2+]C2)cc1 ZINC000666968824 481227900 /nfs/dbraw/zinc/22/79/00/481227900.db2.gz KRZMGZBXRNBIBJ-QUCCMNQESA-N 1 3 331.504 2.591 10 0 EFAEHO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCN(Cc3ccnn3-c3ccccc3)C2)C1 ZINC000650707722 481278486 /nfs/dbraw/zinc/27/84/86/481278486.db2.gz LVBMIQDRCWWKQY-MBOZVWFJSA-N 1 3 340.471 2.591 10 0 EFAEHO [NH3+][C@@H]1CCO[C@H]([C@H]2CCCCN2Cc2cccc3c2OCCCO3)C1 ZINC000650722224 481290178 /nfs/dbraw/zinc/29/01/78/481290178.db2.gz NJUPAWIOCCBPME-LMMKCTJWSA-N 1 3 346.471 2.709 10 0 EFAEHO Cc1ccc(NC(=O)N(CCN(C)C)CC[NH+](C)C)c(Cl)c1C ZINC000646431278 481292450 /nfs/dbraw/zinc/29/24/50/481292450.db2.gz IWIOUHZLLLINPH-UHFFFAOYSA-N 1 3 340.899 2.914 10 0 EFAEHO [NH3+][C@@H](CCC(=O)Nc1ccc([C@@H]2CNCCO2)cc1)c1ccccc1 ZINC000659370821 481391668 /nfs/dbraw/zinc/39/16/68/481391668.db2.gz WWBZXUNQCVSTBC-OALUTQOASA-N 1 3 339.439 2.766 10 0 EFAEHO Cc1ccccc1[C@H]([C@@H](C)NC(=O)NCC[C@@H]([NH3+])C(C)C)N(C)C ZINC000659491910 481468652 /nfs/dbraw/zinc/46/86/52/481468652.db2.gz FTAQCTAEATXIJM-NXHRZFHOSA-N 1 3 334.508 2.659 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CN[C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000643463867 481478880 /nfs/dbraw/zinc/47/88/80/481478880.db2.gz FAGBBSSOKNKNSU-UAFMIMERSA-N 1 3 346.515 2.944 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N[C@@H](CN)c1ccc2ccccc2c1 ZINC000659527020 481482318 /nfs/dbraw/zinc/48/23/18/481482318.db2.gz HPERDQMRUMGGGL-MSOLQXFVSA-N 1 3 328.460 2.512 10 0 EFAEHO [NH3+]C[C@H]1CCC[C@H]1NCc1ccc(N2CCc3ccccc3C2)nc1 ZINC000643472044 481484434 /nfs/dbraw/zinc/48/44/34/481484434.db2.gz LDIAPYGPFLLAGL-UYAOXDASSA-N 1 3 336.483 2.861 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000650995278 481490758 /nfs/dbraw/zinc/49/07/58/481490758.db2.gz CKYDHFUYPNYJMG-MOPGFXCFSA-N 1 3 346.519 2.709 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000650995278 481490761 /nfs/dbraw/zinc/49/07/61/481490761.db2.gz CKYDHFUYPNYJMG-MOPGFXCFSA-N 1 3 346.519 2.709 10 0 EFAEHO CCN(C(=O)NC[C@@H]1CCC[N@@H+]1C1CCCCC1)[C@@H]1CCN(C)C1 ZINC000664813536 481495036 /nfs/dbraw/zinc/49/50/36/481495036.db2.gz XWGSRPIIFNJJIN-ZWKOTPCHSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN(C(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1)[C@@H]1CCN(C)C1 ZINC000664813536 481495049 /nfs/dbraw/zinc/49/50/49/481495049.db2.gz XWGSRPIIFNJJIN-ZWKOTPCHSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@H](N[C@H]1CC12CC[NH2+]CC2)c1ccc(-n2cncn2)cc1Cl ZINC000643534822 481496862 /nfs/dbraw/zinc/49/68/62/481496862.db2.gz DFYUIPSQTYFANJ-LRDDRELGSA-N 1 3 331.851 2.713 10 0 EFAEHO C[C@H](N[C@@H]1CC12CC[NH2+]CC2)c1ccc(-n2cncn2)cc1Cl ZINC000643534821 481497083 /nfs/dbraw/zinc/49/70/83/481497083.db2.gz DFYUIPSQTYFANJ-BLLLJJGKSA-N 1 3 331.851 2.713 10 0 EFAEHO CC[C@@H](C(N)=O)N1CC(C)(C)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664837718 481507573 /nfs/dbraw/zinc/50/75/73/481507573.db2.gz XLELTIPOAMINMZ-RBUKOAKNSA-N 1 3 343.515 2.873 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000659620320 481519003 /nfs/dbraw/zinc/51/90/03/481519003.db2.gz KOBUGLSDEPCBTL-HZPDHXFCSA-N 1 3 340.899 2.615 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)NC(C)(C)CN(C)Cc1ccccc1 ZINC000659622194 481519091 /nfs/dbraw/zinc/51/90/91/481519091.db2.gz NVCHAUMOGMZXIK-QGZVFWFLSA-N 1 3 334.508 2.570 10 0 EFAEHO CN1CCC(N2CC[C@H]([NH2+][C@H]3CCCc4ccccc4C3)C2)CC1 ZINC000648450590 481554920 /nfs/dbraw/zinc/55/49/20/481554920.db2.gz VCENGKXKJCUQSX-PMACEKPBSA-N 1 3 327.516 2.692 10 0 EFAEHO C[C@H]1[C@@H]([NH3+])CCN1C(=O)c1ccccc1OCCN1CCCC[C@@H]1C ZINC000647086007 481629449 /nfs/dbraw/zinc/62/94/49/481629449.db2.gz QKCKDEZFGBNAJA-BQFCYCMXSA-N 1 3 345.487 2.502 10 0 EFAEHO C[C@@H](C(=O)N1CC[C@H](c2ccc(F)cc2)[C@@H]([NH3+])C1)N1CCCCCC1 ZINC000647093580 481632689 /nfs/dbraw/zinc/63/26/89/481632689.db2.gz OTDCZXUOLUTDMG-IPELMVKDSA-N 1 3 347.478 2.733 10 0 EFAEHO COc1ccc([C@H](CO)N(C)Cc2cccc3c2CC[NH2+]C3)cc1 ZINC000662256420 481668931 /nfs/dbraw/zinc/66/89/31/481668931.db2.gz VZCTXYMYBQNERQ-FQEVSTJZSA-N 1 3 326.440 2.506 10 0 EFAEHO Cc1ccc(CCN(C[C@@H]2CCCO2)C[C@@H]2CCC3(C[NH2+]C3)O2)cc1 ZINC000662258659 481672128 /nfs/dbraw/zinc/67/21/28/481672128.db2.gz YTMNMCMPTGDLMI-PMACEKPBSA-N 1 3 344.499 2.540 10 0 EFAEHO CN(Cc1cccc(OC(F)(F)F)c1)C[C@@H]1CCC2(C[NH2+]C2)O1 ZINC000662259130 481672815 /nfs/dbraw/zinc/67/28/15/481672815.db2.gz QPBYHGQZJQGAOG-AWEZNQCLSA-N 1 3 330.350 2.538 10 0 EFAEHO FCC1(NCc2ccc(OCC[NH+]3CCCC3)cc2)CCOCC1 ZINC000648712394 481686342 /nfs/dbraw/zinc/68/63/42/481686342.db2.gz DGLDZVDUPONMNN-UHFFFAOYSA-N 1 3 336.451 2.770 10 0 EFAEHO C[C@H]([NH2+]C[C@@H]1CCC2(CNC2)O1)c1ccc(OC(F)(F)F)cc1 ZINC000662279672 481686972 /nfs/dbraw/zinc/68/69/72/481686972.db2.gz AUXKLCFJBPUMQN-FZMZJTMJSA-N 1 3 330.350 2.757 10 0 EFAEHO Fc1ccc([C@H](CC(F)(F)F)NC[C@H]2CCC3(C[NH2+]C3)O2)cc1 ZINC000662281125 481688638 /nfs/dbraw/zinc/68/86/38/481688638.db2.gz IOTXSMNBFKYGMM-KGLIPLIRSA-N 1 3 332.341 2.930 10 0 EFAEHO Fc1ccc([C@@H](CC(F)(F)F)NC[C@H]2CCC3(C[NH2+]C3)O2)cc1 ZINC000662281129 481689338 /nfs/dbraw/zinc/68/93/38/481689338.db2.gz IOTXSMNBFKYGMM-ZIAGYGMSSA-N 1 3 332.341 2.930 10 0 EFAEHO c1ccc2c(c1)CCC1(CC[NH+](C[C@H]3CCC4(CNC4)O3)CC1)C2 ZINC000662287430 481691171 /nfs/dbraw/zinc/69/11/71/481691171.db2.gz ZVMKIKYRZSDBGH-LJQANCHMSA-N 1 3 326.484 2.779 10 0 EFAEHO COC[C@H](C[N@@H+]1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1)OC ZINC000660010159 481698050 /nfs/dbraw/zinc/69/80/50/481698050.db2.gz GJJDVDNTLCMXCH-HSALFYBXSA-N 1 3 332.488 2.634 10 0 EFAEHO COC[C@H](C[N@H+]1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1)OC ZINC000660010159 481698055 /nfs/dbraw/zinc/69/80/55/481698055.db2.gz GJJDVDNTLCMXCH-HSALFYBXSA-N 1 3 332.488 2.634 10 0 EFAEHO C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662295396 481699532 /nfs/dbraw/zinc/69/95/32/481699532.db2.gz QZKGRMNYBRHVTL-APWZRJJASA-N 1 3 341.499 2.676 10 0 EFAEHO Cc1ccc(NC(=O)CN2CCC[C@H](C3CC[NH2+]CC3)C2)cc1C ZINC000662294800 481699755 /nfs/dbraw/zinc/69/97/55/481699755.db2.gz NRRIEWHHZJMDOE-SFHVURJKSA-N 1 3 329.488 2.954 10 0 EFAEHO CCN(C(=O)CN1CCC[C@H](C2CC[NH2+]CC2)C1)C1CCCCC1 ZINC000662295326 481701088 /nfs/dbraw/zinc/70/10/88/481701088.db2.gz QCWVPYLDOMYGHX-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H]1CCC[C@H](NC(=O)CN2CCC[C@@H](C3CC[NH2+]CC3)C2)[C@H]1C ZINC000662294309 481701102 /nfs/dbraw/zinc/70/11/02/481701102.db2.gz LGRQGWIQGQTHQH-JFRXWTBNSA-N 1 3 335.536 2.639 10 0 EFAEHO C[C@H]1Cc2ccccc2N1C(=O)CN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662295401 481701536 /nfs/dbraw/zinc/70/15/36/481701536.db2.gz QZKGRMNYBRHVTL-LPHOPBHVSA-N 1 3 341.499 2.676 10 0 EFAEHO c1cc(C[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)n(-c2ccccn2)n1 ZINC000647207799 481702963 /nfs/dbraw/zinc/70/29/63/481702963.db2.gz LRFAWWVKPCLDHW-LJQANCHMSA-N 1 3 347.466 2.879 10 0 EFAEHO C[C@@H]1CCCN(CC(=O)NC23CC4CC(CC(C4)C2)C3)[C@@H]1CCC[NH3+] ZINC000662313479 481717384 /nfs/dbraw/zinc/71/73/84/481717384.db2.gz RLSQIUGDWPABIC-AGWGEYTISA-N 1 3 347.547 2.911 10 0 EFAEHO Cc1cc(C)n2c(C[NH2+]C[C@@H]3CN(C)C[C@H]3c3ccccc3)cnc2n1 ZINC000647248951 481727041 /nfs/dbraw/zinc/72/70/41/481727041.db2.gz SMLMNUCZIHKHIW-QUCCMNQESA-N 1 3 349.482 2.781 10 0 EFAEHO c1c(N2CCNCC2)n[nH]c1[C@H]1CCC[N@@H+](CCC2CCCCC2)C1 ZINC000662337595 481734573 /nfs/dbraw/zinc/73/45/73/481734573.db2.gz LTACWCWYERXEND-SFHVURJKSA-N 1 3 345.535 2.969 10 0 EFAEHO c1c(N2CCNCC2)n[nH]c1[C@H]1CCC[N@H+](CCC2CCCCC2)C1 ZINC000662337595 481734581 /nfs/dbraw/zinc/73/45/81/481734581.db2.gz LTACWCWYERXEND-SFHVURJKSA-N 1 3 345.535 2.969 10 0 EFAEHO CCC(C)(C)CC[N@@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662338304 481736708 /nfs/dbraw/zinc/73/67/08/481736708.db2.gz QDKICRJYVYUEGZ-MRXNPFEDSA-N 1 3 333.524 2.825 10 0 EFAEHO CCC(C)(C)CC[N@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662338304 481736716 /nfs/dbraw/zinc/73/67/16/481736716.db2.gz QDKICRJYVYUEGZ-MRXNPFEDSA-N 1 3 333.524 2.825 10 0 EFAEHO CCOc1ccc([C@@H]2CCNC[C@@H]2[NH2+][C@H]2CCN(C)[C@H](C)C2)cc1 ZINC000665255124 481751064 /nfs/dbraw/zinc/75/10/64/481751064.db2.gz JPTWWOGLPVXTGP-LQJIQPLVSA-N 1 3 331.504 2.603 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1cnn(C)c1 ZINC000665272253 481762054 /nfs/dbraw/zinc/76/20/54/481762054.db2.gz AQMNLANPARVTMX-ZSZQSSIHSA-N 1 3 327.476 2.644 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCC[C@H]1Cc1cnn(C)c1 ZINC000665272251 481762613 /nfs/dbraw/zinc/76/26/13/481762613.db2.gz AQMNLANPARVTMX-QOKNQOGYSA-N 1 3 327.476 2.644 10 0 EFAEHO C[C@H]1CCCCN1CCNC(=O)c1ccc2c(c1)[C@H](C[NH3+])CCC2 ZINC000662387946 481778153 /nfs/dbraw/zinc/77/81/53/481778153.db2.gz NJBSESSTOXTAQX-YJBOKZPZSA-N 1 3 329.488 2.669 10 0 EFAEHO CC1CC[NH+](CCCCNC(=O)C[C@@H]2NCc3ccccc32)CC1 ZINC000662388900 481778531 /nfs/dbraw/zinc/77/85/31/481778531.db2.gz PLZSSHIDBQAMJW-IBGZPJMESA-N 1 3 329.488 2.849 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)C[C@@H]1NCc2ccccc21 ZINC000662390201 481780060 /nfs/dbraw/zinc/78/00/60/481780060.db2.gz YGASMRMVTARHAH-APWZRJJASA-N 1 3 329.488 2.992 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)C[C@@H]1NCc2ccccc21 ZINC000662390201 481780070 /nfs/dbraw/zinc/78/00/70/481780070.db2.gz YGASMRMVTARHAH-APWZRJJASA-N 1 3 329.488 2.992 10 0 EFAEHO CSc1cccc(C[N@@H+]2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)c1 ZINC000660156918 481791498 /nfs/dbraw/zinc/79/14/98/481791498.db2.gz SKIKHJUYYXGOPF-QFBILLFUSA-N 1 3 333.545 2.866 10 0 EFAEHO CSc1cccc(C[N@H+]2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)c1 ZINC000660156918 481791503 /nfs/dbraw/zinc/79/15/03/481791503.db2.gz SKIKHJUYYXGOPF-QFBILLFUSA-N 1 3 333.545 2.866 10 0 EFAEHO CC[NH2+]Cc1ccccc1NC(=O)N1CCN(c2ccncc2)CC1 ZINC000667781058 481801395 /nfs/dbraw/zinc/80/13/95/481801395.db2.gz SESKEJXJBWOOHQ-UHFFFAOYSA-N 1 3 339.443 2.545 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)C[C@H]1NCc2ccccc21 ZINC000662429558 481801648 /nfs/dbraw/zinc/80/16/48/481801648.db2.gz OQWDQNKZYBNHNZ-IEBWSBKVSA-N 1 3 329.488 2.992 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)C[C@H]1NCc2ccccc21 ZINC000662429558 481801658 /nfs/dbraw/zinc/80/16/58/481801658.db2.gz OQWDQNKZYBNHNZ-IEBWSBKVSA-N 1 3 329.488 2.992 10 0 EFAEHO CC[NH+](CC)CC1CCN(C(=O)NC[C@@H]2CCN2C(C)(C)C)CC1 ZINC000665366907 481825109 /nfs/dbraw/zinc/82/51/09/481825109.db2.gz LADNDTPTTHBTAK-KRWDZBQOSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[NH+](CC)CC1CCN(C(=O)NC[C@H]2CCN2C(C)(C)C)CC1 ZINC000665366908 481826447 /nfs/dbraw/zinc/82/64/47/481826447.db2.gz LADNDTPTTHBTAK-QGZVFWFLSA-N 1 3 338.540 2.623 10 0 EFAEHO C[N@H+](CCNC(=O)Nc1ccc2c(c1)CNCCO2)C1CCCCC1 ZINC000667841359 481843569 /nfs/dbraw/zinc/84/35/69/481843569.db2.gz MJZRBINYRYNBLF-UHFFFAOYSA-N 1 3 346.475 2.555 10 0 EFAEHO C[N@@H+](CCNC(=O)Nc1ccc2c(c1)CNCCO2)C1CCCCC1 ZINC000667841359 481843573 /nfs/dbraw/zinc/84/35/73/481843573.db2.gz MJZRBINYRYNBLF-UHFFFAOYSA-N 1 3 346.475 2.555 10 0 EFAEHO O=C(C[C@@H]1NCc2ccccc21)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000662505929 481848258 /nfs/dbraw/zinc/84/82/58/481848258.db2.gz VSQHDMSTBCXMKY-UXPWSPDFSA-N 1 3 339.483 2.696 10 0 EFAEHO O=C(C[C@@H]1NCc2ccccc21)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000662505929 481848269 /nfs/dbraw/zinc/84/82/69/481848269.db2.gz VSQHDMSTBCXMKY-UXPWSPDFSA-N 1 3 339.483 2.696 10 0 EFAEHO COc1ccccc1-c1ncc(C[NH2+]C[C@H]2CCCN(C)C2)cn1 ZINC000644383727 481849295 /nfs/dbraw/zinc/84/92/95/481849295.db2.gz OXHFRQWNARADJQ-OAHLLOKOSA-N 1 3 326.444 2.584 10 0 EFAEHO C[C@@H](C[N@H+](C)Cc1ccccc1)NC(=O)c1cc2c(s1)CCNC2 ZINC000662511946 481851577 /nfs/dbraw/zinc/85/15/77/481851577.db2.gz NALPLWZRRFNGHV-AWEZNQCLSA-N 1 3 343.496 2.644 10 0 EFAEHO C[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1cc2c(s1)CCNC2 ZINC000662511946 481851586 /nfs/dbraw/zinc/85/15/86/481851586.db2.gz NALPLWZRRFNGHV-AWEZNQCLSA-N 1 3 343.496 2.644 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)Nc1ccc2c(c1)C=CCCC2 ZINC000667859837 481854834 /nfs/dbraw/zinc/85/48/34/481854834.db2.gz ZXPYQXQZGDZXPC-UHFFFAOYSA-N 1 3 344.503 2.993 10 0 EFAEHO C[N@H+](CCCNC(=O)C[C@H]1NCc2ccccc21)C1CCCCC1 ZINC000662526153 481860894 /nfs/dbraw/zinc/86/08/94/481860894.db2.gz SSOYXTJMSUXIJR-LJQANCHMSA-N 1 3 329.488 2.992 10 0 EFAEHO C[N@@H+](CCCNC(=O)C[C@H]1NCc2ccccc21)C1CCCCC1 ZINC000662526153 481860898 /nfs/dbraw/zinc/86/08/98/481860898.db2.gz SSOYXTJMSUXIJR-LJQANCHMSA-N 1 3 329.488 2.992 10 0 EFAEHO CC(C)CN(CCN(C)C)C(=O)c1ccc2c(c1)[C@H](C[NH3+])CCC2 ZINC000662525413 481861042 /nfs/dbraw/zinc/86/10/42/481861042.db2.gz SZGMJOQTIHDEFD-SFHVURJKSA-N 1 3 331.504 2.725 10 0 EFAEHO CN(CCc1ccccc1)[C@H]1CCN(C(=O)c2ccc(C[NH3+])cc2)C1 ZINC000662659039 481920667 /nfs/dbraw/zinc/92/06/67/481920667.db2.gz MVJCLFGEINZRGV-FQEVSTJZSA-N 1 3 337.467 2.534 10 0 EFAEHO O=C(NCc1ccc(C[NH+]2CCCCC2)cc1)C1(NC2CC2)CCC1 ZINC000662670799 481925684 /nfs/dbraw/zinc/92/56/84/481925684.db2.gz ZWOWVEYZOVQMJD-UHFFFAOYSA-N 1 3 341.499 2.963 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)C1([NH3+])CC2(CCC2)C1)c1ccsc1 ZINC000662679379 481930312 /nfs/dbraw/zinc/93/03/12/481930312.db2.gz NKQIXJAMSCOSHG-OAHLLOKOSA-N 1 3 335.517 2.909 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)C1([NH2+]C2CC2)CCC1)c1ccsc1 ZINC000662680648 481930415 /nfs/dbraw/zinc/93/04/15/481930415.db2.gz XQJSJIOOGUOKQA-INIZCTEOSA-N 1 3 335.517 2.922 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)N(CC)CC ZINC000649102047 481931076 /nfs/dbraw/zinc/93/10/76/481931076.db2.gz RYLWDHYAXVMVNM-QYZOEREBSA-N 1 3 331.504 2.568 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)N(CC)CC ZINC000649102047 481931080 /nfs/dbraw/zinc/93/10/80/481931080.db2.gz RYLWDHYAXVMVNM-QYZOEREBSA-N 1 3 331.504 2.568 10 0 EFAEHO CCC(C)(C)N1CCN(C(=O)NC2CC([NH+]3CCCCC3)C2)CC1 ZINC000654551738 481931597 /nfs/dbraw/zinc/93/15/97/481931597.db2.gz YXKNKDQZAMSDCU-UHFFFAOYSA-N 1 3 336.524 2.519 10 0 EFAEHO CCCN(C(=O)CC1([NH3+])CC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000662686603 481933485 /nfs/dbraw/zinc/93/34/85/481933485.db2.gz HPRYXVCCYGQZOV-GOSISDBHSA-N 1 3 329.488 2.771 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@H]1CCN1C(C)(C)C ZINC000660403086 481938142 /nfs/dbraw/zinc/93/81/42/481938142.db2.gz NMJJPHHQRURNIL-DLBZAZTESA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@H]1CCN1C(C)(C)C ZINC000660403086 481938146 /nfs/dbraw/zinc/93/81/46/481938146.db2.gz NMJJPHHQRURNIL-DLBZAZTESA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)C2(NC3CC3)CCC2)C1 ZINC000662699002 481939409 /nfs/dbraw/zinc/93/94/09/481939409.db2.gz UZYOOJBRMGGYHD-IRXDYDNUSA-N 1 3 333.520 2.774 10 0 EFAEHO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)C2(NC3CC3)CCC2)C1 ZINC000662699002 481939414 /nfs/dbraw/zinc/93/94/14/481939414.db2.gz UZYOOJBRMGGYHD-IRXDYDNUSA-N 1 3 333.520 2.774 10 0 EFAEHO CCC[C@@H](N)C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000662710634 481944193 /nfs/dbraw/zinc/94/41/93/481944193.db2.gz IYGAGJWEVCLTIK-QZTJIDSGSA-N 1 3 329.488 2.532 10 0 EFAEHO CCC[C@@H](N)C(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000662710634 481944196 /nfs/dbraw/zinc/94/41/96/481944196.db2.gz IYGAGJWEVCLTIK-QZTJIDSGSA-N 1 3 329.488 2.532 10 0 EFAEHO CN(C(=O)C1([NH2+]C2CC2)CCC1)C1CCN(Cc2ccccc2)CC1 ZINC000662719576 481948322 /nfs/dbraw/zinc/94/83/22/481948322.db2.gz GCOAYEZUOBCYNG-UHFFFAOYSA-N 1 3 341.499 2.784 10 0 EFAEHO CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)C1(NC2CC2)CCC1 ZINC000662729352 481951878 /nfs/dbraw/zinc/95/18/78/481951878.db2.gz OOKJQAVYBLCEJL-SFHVURJKSA-N 1 3 341.499 2.642 10 0 EFAEHO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)C1(NC2CC2)CCC1 ZINC000662729352 481951882 /nfs/dbraw/zinc/95/18/82/481951882.db2.gz OOKJQAVYBLCEJL-SFHVURJKSA-N 1 3 341.499 2.642 10 0 EFAEHO C[NH2+][C@@H](C)C(=O)N1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000662755169 481959810 /nfs/dbraw/zinc/95/98/10/481959810.db2.gz CICDLKIDWKEFMU-LPHOPBHVSA-N 1 3 343.515 2.744 10 0 EFAEHO C[NH2+]CCC(=O)N1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1 ZINC000662756177 481960004 /nfs/dbraw/zinc/96/00/04/481960004.db2.gz HRIFNTPXVXCXBU-HXUWFJFHSA-N 1 3 343.515 2.745 10 0 EFAEHO C[NH2+]CCC(=O)N1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000662756175 481960411 /nfs/dbraw/zinc/96/04/11/481960411.db2.gz HRIFNTPXVXCXBU-FQEVSTJZSA-N 1 3 343.515 2.745 10 0 EFAEHO Cc1cc2cc(NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)ccc2[nH]1 ZINC000665637379 481973149 /nfs/dbraw/zinc/97/31/49/481973149.db2.gz AYQLOFKYPGSBIU-HNNXBMFYSA-N 1 3 345.491 2.870 10 0 EFAEHO Cc1cc2cc(NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)ccc2[nH]1 ZINC000665637379 481973153 /nfs/dbraw/zinc/97/31/53/481973153.db2.gz AYQLOFKYPGSBIU-HNNXBMFYSA-N 1 3 345.491 2.870 10 0 EFAEHO C[C@H](c1cccs1)N(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000665639303 481974220 /nfs/dbraw/zinc/97/42/20/481974220.db2.gz UKVPUXXTXOSSBM-LSDHHAIUSA-N 1 3 340.537 2.723 10 0 EFAEHO C[C@H](c1cccs1)N(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000665639303 481974225 /nfs/dbraw/zinc/97/42/25/481974225.db2.gz UKVPUXXTXOSSBM-LSDHHAIUSA-N 1 3 340.537 2.723 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N(C)[C@@H]1CCc2ccccc21 ZINC000665637897 481974589 /nfs/dbraw/zinc/97/45/89/481974589.db2.gz SHBDFRFOBSQJKX-QFBILLFUSA-N 1 3 346.519 2.587 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N(C)[C@@H]1CCc2ccccc21 ZINC000665637897 481974596 /nfs/dbraw/zinc/97/45/96/481974596.db2.gz SHBDFRFOBSQJKX-QFBILLFUSA-N 1 3 346.519 2.587 10 0 EFAEHO CCN(Cc1ccccc1C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000665637985 481974810 /nfs/dbraw/zinc/97/48/10/481974810.db2.gz VLXQIGBARXBIGF-SFHVURJKSA-N 1 3 348.535 2.799 10 0 EFAEHO CCN(Cc1ccccc1C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000665637985 481974816 /nfs/dbraw/zinc/97/48/16/481974816.db2.gz VLXQIGBARXBIGF-SFHVURJKSA-N 1 3 348.535 2.799 10 0 EFAEHO CN(CCc1ccccc1)[C@H]1CCN(C(=O)[C@@H]2[NH2+]CCCC2(C)C)C1 ZINC000662873321 482000474 /nfs/dbraw/zinc/00/04/74/482000474.db2.gz WGBZXTRPUBUBJR-OALUTQOASA-N 1 3 343.515 2.540 10 0 EFAEHO Cc1ccc2cc(CN(C)CCN(C)C3CC[NH+](C)CC3)[nH]c2c1 ZINC000668157915 482005098 /nfs/dbraw/zinc/00/50/98/482005098.db2.gz FPMPRAKVDMBQPD-UHFFFAOYSA-N 1 3 328.504 2.934 10 0 EFAEHO CC(C)[C@H](C(=O)Nc1ccc([C@@H]2CNCCO2)cc1)[NH+]1CCCCC1 ZINC000662884840 482005900 /nfs/dbraw/zinc/00/59/00/482005900.db2.gz PRLOEPKPQFFDMC-RBUKOAKNSA-N 1 3 345.487 2.797 10 0 EFAEHO O=C(NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)[C@@H]1CCCCN1 ZINC000662919553 482012743 /nfs/dbraw/zinc/01/27/43/482012743.db2.gz NQWNCFCUEKVTOP-MOPGFXCFSA-N 1 3 341.499 2.547 10 0 EFAEHO O=C(NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)[C@@H]1CCCCN1 ZINC000662919553 482012747 /nfs/dbraw/zinc/01/27/47/482012747.db2.gz NQWNCFCUEKVTOP-MOPGFXCFSA-N 1 3 341.499 2.547 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)C1(c2ccccc2)CC[NH2+]CC1 ZINC000649318712 482026637 /nfs/dbraw/zinc/02/66/37/482026637.db2.gz DZVISQFXDAZEBG-ROUUACIJSA-N 1 3 343.515 2.687 10 0 EFAEHO CN(Cc1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3[NH2+]2)C1 ZINC000649342808 482033678 /nfs/dbraw/zinc/03/36/78/482033678.db2.gz QBEFTSJZDANISB-YRPNKDGESA-N 1 3 341.499 2.640 10 0 EFAEHO CCC(C)(C)[C@@H](C)NC(=O)NC1CCN(C2CC[NH+](C)CC2)CC1 ZINC000660573572 482034483 /nfs/dbraw/zinc/03/44/83/482034483.db2.gz IPLGKECTZZLTEY-OAHLLOKOSA-N 1 3 338.540 2.669 10 0 EFAEHO CC[C@@H]1CCCCCN1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000665759097 482038392 /nfs/dbraw/zinc/03/83/92/482038392.db2.gz ZQGQXJFOTLQZMF-DLBZAZTESA-N 1 3 326.529 2.623 10 0 EFAEHO CC[C@@H]1CCCCCN1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000665759097 482038397 /nfs/dbraw/zinc/03/83/97/482038397.db2.gz ZQGQXJFOTLQZMF-DLBZAZTESA-N 1 3 326.529 2.623 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N(C)[C@@H](C)C1CCCCC1 ZINC000665762306 482040255 /nfs/dbraw/zinc/04/02/55/482040255.db2.gz ACEGQEPMASLQHE-IRXDYDNUSA-N 1 3 340.556 2.869 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N(C)[C@@H](C)C1CCCCC1 ZINC000665762306 482040264 /nfs/dbraw/zinc/04/02/64/482040264.db2.gz ACEGQEPMASLQHE-IRXDYDNUSA-N 1 3 340.556 2.869 10 0 EFAEHO Cc1ccc(CN(C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1C ZINC000665764192 482040551 /nfs/dbraw/zinc/04/05/51/482040551.db2.gz XSUFJNNXCIWWFO-SFHVURJKSA-N 1 3 348.535 2.717 10 0 EFAEHO Cc1ccc(CN(C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1C ZINC000665764192 482040557 /nfs/dbraw/zinc/04/05/57/482040557.db2.gz XSUFJNNXCIWWFO-SFHVURJKSA-N 1 3 348.535 2.717 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1CCCC[C@H]1C1CCC1 ZINC000665763632 482040603 /nfs/dbraw/zinc/04/06/03/482040603.db2.gz HOMTVXFMDOJVHE-WMZOPIPTSA-N 1 3 338.540 2.623 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1CCCC[C@H]1C1CCC1 ZINC000665763632 482040610 /nfs/dbraw/zinc/04/06/10/482040610.db2.gz HOMTVXFMDOJVHE-WMZOPIPTSA-N 1 3 338.540 2.623 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)NCCCCC[NH+]1CCCCC1 ZINC000660637070 482062580 /nfs/dbraw/zinc/06/25/80/482062580.db2.gz XVSOXVDCDSYIMV-KRWDZBQOSA-N 1 3 338.540 2.815 10 0 EFAEHO [NH3+]CC1(CCNC(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC1 ZINC000652152907 482100613 /nfs/dbraw/zinc/10/06/13/482100613.db2.gz YFCQKZXORWVLRE-SFHVURJKSA-N 1 3 344.503 2.642 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccc2scnc2c1 ZINC000665926349 482112659 /nfs/dbraw/zinc/11/26/59/482112659.db2.gz NFXMBZSAOYJGGB-ZDUSSCGKSA-N 1 3 349.504 2.690 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccc2scnc2c1 ZINC000665926349 482112662 /nfs/dbraw/zinc/11/26/62/482112662.db2.gz NFXMBZSAOYJGGB-ZDUSSCGKSA-N 1 3 349.504 2.690 10 0 EFAEHO COc1cc2nccc(N3CC[C@H]4C[NH2+]C[C@H]4CC3)c2cc1OC ZINC000663238848 482133295 /nfs/dbraw/zinc/13/32/95/482133295.db2.gz IJWAARQARFFJBS-OKILXGFUSA-N 1 3 327.428 2.688 10 0 EFAEHO Cc1ccccc1C1(NCC(=O)NC2CC[NH+](C3CC3)CC2)CCC1 ZINC000649645229 482167623 /nfs/dbraw/zinc/16/76/23/482167623.db2.gz KKTDMDAOYYAQPN-UHFFFAOYSA-N 1 3 341.499 2.707 10 0 EFAEHO C[C@]1(c2cccc(F)c2)CC[N@H+](C[C@H](O)[C@@H](N)Cc2ccccc2)C1 ZINC000652350410 482184036 /nfs/dbraw/zinc/18/40/36/482184036.db2.gz XJSIROLDEMEKIG-ACRUOGEOSA-N 1 3 342.458 2.720 10 0 EFAEHO C[C@]1(c2cccc(F)c2)CC[N@@H+](C[C@H](O)[C@@H](N)Cc2ccccc2)C1 ZINC000652350410 482184041 /nfs/dbraw/zinc/18/40/41/482184041.db2.gz XJSIROLDEMEKIG-ACRUOGEOSA-N 1 3 342.458 2.720 10 0 EFAEHO CN(C(=O)[C@@H](C[NH+]1CCCC1)c1ccccc1)[C@@H]1CCN(C2CC2)C1 ZINC000668599667 482184150 /nfs/dbraw/zinc/18/41/50/482184150.db2.gz XMTSJTRSSLBDTJ-UXHICEINSA-N 1 3 341.499 2.561 10 0 EFAEHO CC(C)[NH+](CCCNC(=O)NC[C@@H]1CCN1C(C)(C)C)C(C)C ZINC000660864129 482184916 /nfs/dbraw/zinc/18/49/16/482184916.db2.gz NZVBRTZMIQZBPD-INIZCTEOSA-N 1 3 326.529 2.667 10 0 EFAEHO Cn1cc(C[C@H]2CCC[C@@H]2[NH2+]C2CCN(c3ccncc3)CC2)cn1 ZINC000668609873 482187933 /nfs/dbraw/zinc/18/79/33/482187933.db2.gz IQXLNKOCIQDSBE-XLIONFOSSA-N 1 3 339.487 2.785 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3CCC34CCCC4)CC2)CC1 ZINC000655162227 482188489 /nfs/dbraw/zinc/18/84/89/482188489.db2.gz KRQFDTCTVKEMQL-UHFFFAOYSA-N 1 3 333.520 2.728 10 0 EFAEHO CC(=O)c1ccccc1OCCN1CCCC[C@@H]1[C@H]1C[C@H]([NH3+])CCO1 ZINC000652360370 482193707 /nfs/dbraw/zinc/19/37/07/482193707.db2.gz GEJHFIJKXKLRNZ-YVWKXTFCSA-N 1 3 346.471 2.629 10 0 EFAEHO CCCCN(C[C@@H](O)C[N@H+](C)C(C)C)[C@H]1CCc2ncsc2C1 ZINC000660907958 482211629 /nfs/dbraw/zinc/21/16/29/482211629.db2.gz XAEFIDXTAGOKRX-HOTGVXAUSA-N 1 3 339.549 2.804 10 0 EFAEHO CCCCN(C[C@@H](O)C[N@@H+](C)C(C)C)[C@H]1CCc2ncsc2C1 ZINC000660907958 482211635 /nfs/dbraw/zinc/21/16/35/482211635.db2.gz XAEFIDXTAGOKRX-HOTGVXAUSA-N 1 3 339.549 2.804 10 0 EFAEHO C[C@H](CN1CCC(C)CC1)NC(=O)NC1CCC(C[NH+](C)C)CC1 ZINC000660939155 482231157 /nfs/dbraw/zinc/23/11/57/482231157.db2.gz IZNCPTAXDAKQGY-WWDZGPRUSA-N 1 3 338.540 2.526 10 0 EFAEHO CN1CC[C@H](NC(=O)N[C@@H]2CC[N@@H+](C(C)(C)C)C2)[C@@H]1c1ccccc1 ZINC000660960989 482244926 /nfs/dbraw/zinc/24/49/26/482244926.db2.gz YBZCNVUTOBBSHB-SQNIBIBYSA-N 1 3 344.503 2.604 10 0 EFAEHO CN1CC[C@H](NC(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)[C@@H]1c1ccccc1 ZINC000660960989 482244931 /nfs/dbraw/zinc/24/49/31/482244931.db2.gz YBZCNVUTOBBSHB-SQNIBIBYSA-N 1 3 344.503 2.604 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000663452161 482245265 /nfs/dbraw/zinc/24/52/65/482245265.db2.gz JHQBNVWNRGRPKF-GOSISDBHSA-N 1 3 346.519 2.681 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000663452161 482245273 /nfs/dbraw/zinc/24/52/73/482245273.db2.gz JHQBNVWNRGRPKF-GOSISDBHSA-N 1 3 346.519 2.681 10 0 EFAEHO CC(C)c1ccc([C@H]([NH3+])CNCc2nc3c(s2)CNCC3)cc1 ZINC000663492913 482263893 /nfs/dbraw/zinc/26/38/93/482263893.db2.gz DVNOMCLFPQMRSM-OAHLLOKOSA-N 1 3 330.501 2.702 10 0 EFAEHO CCN(C(=O)NCc1ccc(C[NH+](CC)CC)cc1)[C@@H]1CCN(C)C1 ZINC000663517499 482276748 /nfs/dbraw/zinc/27/67/48/482276748.db2.gz XMZAMJMRTMFJIU-LJQANCHMSA-N 1 3 346.519 2.764 10 0 EFAEHO CCN(C(=O)NCc1ccccc1C[NH+]1CCCC1)[C@@H]1CCN(C)C1 ZINC000663518008 482277180 /nfs/dbraw/zinc/27/71/80/482277180.db2.gz OCBIIRRCYHKTIW-LJQANCHMSA-N 1 3 344.503 2.518 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000652611556 482316137 /nfs/dbraw/zinc/31/61/37/482316137.db2.gz NHRSYWYFKBQJCH-UHFFFAOYSA-N 1 3 336.455 2.571 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000652611556 482316144 /nfs/dbraw/zinc/31/61/44/482316144.db2.gz NHRSYWYFKBQJCH-UHFFFAOYSA-N 1 3 336.455 2.571 10 0 EFAEHO CCN(C(=O)NC[C@H](C1CCCCC1)[NH+](C)C)[C@H]1CCN(CC)C1 ZINC000663629646 482325793 /nfs/dbraw/zinc/32/57/93/482325793.db2.gz PSNXKPLJNSFXTC-ZWKOTPCHSA-N 1 3 338.540 2.623 10 0 EFAEHO CCN(C(=O)NCCCC[N@@H+]1CCC[C@H](C)C1)[C@H]1CCN(CC)C1 ZINC000663654118 482332322 /nfs/dbraw/zinc/33/23/22/482332322.db2.gz DKVVVTBFWBJLKF-ROUUACIJSA-N 1 3 338.540 2.624 10 0 EFAEHO CCN(C(=O)NCCCC[N@H+]1CCC[C@H](C)C1)[C@H]1CCN(CC)C1 ZINC000663654118 482332326 /nfs/dbraw/zinc/33/23/26/482332326.db2.gz DKVVVTBFWBJLKF-ROUUACIJSA-N 1 3 338.540 2.624 10 0 EFAEHO CCN(C(=O)NCc1cccc(C[N@H+](C)CC)c1)[C@H]1CCN(CC)C1 ZINC000663865404 482412301 /nfs/dbraw/zinc/41/23/01/482412301.db2.gz ARZFLFGOAXNAAM-IBGZPJMESA-N 1 3 346.519 2.764 10 0 EFAEHO CCN(C(=O)NCc1cccc(C[N@@H+](C)CC)c1)[C@H]1CCN(CC)C1 ZINC000663865404 482412303 /nfs/dbraw/zinc/41/23/03/482412303.db2.gz ARZFLFGOAXNAAM-IBGZPJMESA-N 1 3 346.519 2.764 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NC1CC(c2ccccc2)C1 ZINC000663968919 482428917 /nfs/dbraw/zinc/42/89/17/482428917.db2.gz KMPOQJRPJVKGFJ-IVMQYODDSA-N 1 3 346.519 2.504 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NC1CC(c2ccccc2)C1 ZINC000663968919 482428918 /nfs/dbraw/zinc/42/89/18/482428918.db2.gz KMPOQJRPJVKGFJ-IVMQYODDSA-N 1 3 346.519 2.504 10 0 EFAEHO Cc1ccc(NC(=O)NC2CCN(C3CC[NH+](C)CC3)CC2)s1 ZINC000175825299 534184728 /nfs/dbraw/zinc/18/47/28/534184728.db2.gz RBVZZTHVOFRJMW-UHFFFAOYSA-N 1 3 336.505 2.737 10 0 EFAEHO C/C(=C/c1ccc(Cl)cc1)C[NH2+]CCCN1CCC[C@H](C(N)=O)C1 ZINC000119094043 518411474 /nfs/dbraw/zinc/41/14/74/518411474.db2.gz OLBHIWUFWLBFOH-KSVUCXBSSA-N 1 3 349.906 2.920 10 0 EFAEHO CC(C)[N@@H+]1C[C@H](NC(=O)N[C@H](C)CN(C)Cc2ccccc2)[C@@H](C)C1 ZINC000245650390 519696839 /nfs/dbraw/zinc/69/68/39/519696839.db2.gz HEDODMVUCZFQPH-SCTDSRPQSA-N 1 3 346.519 2.535 10 0 EFAEHO CC(C)[N@H+]1C[C@H](NC(=O)N[C@H](C)CN(C)Cc2ccccc2)[C@@H](C)C1 ZINC000245650390 519696840 /nfs/dbraw/zinc/69/68/40/519696840.db2.gz HEDODMVUCZFQPH-SCTDSRPQSA-N 1 3 346.519 2.535 10 0 EFAEHO CCCN1CCC([N@H+](C)Cc2ccc3c(c2)sc(=O)n3C)CC1 ZINC000194993725 519843927 /nfs/dbraw/zinc/84/39/27/519843927.db2.gz FFIQQSKUGLIDRL-UHFFFAOYSA-N 1 3 333.501 2.906 10 0 EFAEHO CCCN1CCC([N@@H+](C)Cc2ccc3c(c2)sc(=O)n3C)CC1 ZINC000194993725 519843929 /nfs/dbraw/zinc/84/39/29/519843929.db2.gz FFIQQSKUGLIDRL-UHFFFAOYSA-N 1 3 333.501 2.906 10 0 EFAEHO CC[NH+](CC)[C@@H](C)CNC(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000181329753 520827689 /nfs/dbraw/zinc/82/76/89/520827689.db2.gz IMONZYCIMTYXOS-SJORKVTESA-N 1 3 334.508 2.536 10 0 EFAEHO CCC[C@H](C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)N(C)C ZINC000245931881 520985150 /nfs/dbraw/zinc/98/51/50/520985150.db2.gz YQNZQZWEBUTDHH-QXAKKESOSA-N 1 3 331.504 2.886 10 0 EFAEHO CCC[C@H](C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)N(C)C ZINC000245931881 520985158 /nfs/dbraw/zinc/98/51/58/520985158.db2.gz YQNZQZWEBUTDHH-QXAKKESOSA-N 1 3 331.504 2.886 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(C)C(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000245419283 521652198 /nfs/dbraw/zinc/65/21/98/521652198.db2.gz LOIQMJKKQMICPQ-RBUKOAKNSA-N 1 3 346.519 2.723 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(C)C(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000245419283 521652202 /nfs/dbraw/zinc/65/22/02/521652202.db2.gz LOIQMJKKQMICPQ-RBUKOAKNSA-N 1 3 346.519 2.723 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@@H]2CCCOc3ccc(C)cc32)CC1 ZINC000154276308 521682266 /nfs/dbraw/zinc/68/22/66/521682266.db2.gz GSRREUJJMJZTPO-LJQANCHMSA-N 1 3 331.504 2.826 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)c1 ZINC000156311150 521912491 /nfs/dbraw/zinc/91/24/91/521912491.db2.gz UPHHIKOWXXAAHK-IBGZPJMESA-N 1 3 329.488 2.839 10 0 EFAEHO COc1cc(C[NH2+]CC2CCN(c3ccncc3)CC2)ccc1O ZINC000180172036 522445165 /nfs/dbraw/zinc/44/51/65/522445165.db2.gz KPTCQTCNELSLIA-UHFFFAOYSA-N 1 3 327.428 2.802 10 0 EFAEHO CN(Cc1ccc(C[N@H+](C)C[C@H]2CCCO2)cc1)C[C@H]1CCCO1 ZINC000246095490 523220746 /nfs/dbraw/zinc/22/07/46/523220746.db2.gz GZBNGQUORQSYLD-WOJBJXKFSA-N 1 3 332.488 2.908 10 0 EFAEHO CN(Cc1ccc(C[N@@H+](C)C[C@H]2CCCO2)cc1)C[C@H]1CCCO1 ZINC000246095490 523220756 /nfs/dbraw/zinc/22/07/56/523220756.db2.gz GZBNGQUORQSYLD-WOJBJXKFSA-N 1 3 332.488 2.908 10 0 EFAEHO COC(=O)[C@@H]1C[C@H](c2ccccc2)C[N@H+](CC[C@@H]2CCCN2C)C1 ZINC000245575188 523794046 /nfs/dbraw/zinc/79/40/46/523794046.db2.gz HOGFMKNYUDXDHH-OTWHNJEPSA-N 1 3 330.472 2.749 10 0 EFAEHO COC(=O)[C@@H]1C[C@H](c2ccccc2)C[N@@H+](CC[C@@H]2CCCN2C)C1 ZINC000245575188 523794053 /nfs/dbraw/zinc/79/40/53/523794053.db2.gz HOGFMKNYUDXDHH-OTWHNJEPSA-N 1 3 330.472 2.749 10 0 EFAEHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1Nc1ccc(OC2CCN(C)CC2)nc1 ZINC000179744214 524915399 /nfs/dbraw/zinc/91/53/99/524915399.db2.gz VZQMNBGJBBBMLQ-IIDMSEBBSA-N 1 3 332.492 2.695 10 0 EFAEHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1Nc1ccc(OC2CCN(C)CC2)nc1 ZINC000179744214 524915412 /nfs/dbraw/zinc/91/54/12/524915412.db2.gz VZQMNBGJBBBMLQ-IIDMSEBBSA-N 1 3 332.492 2.695 10 0 EFAEHO C[C@@H](O)C[NH+]1CCC(CN(C)Cc2cnc(C(C)(C)C)s2)CC1 ZINC000179517283 525789585 /nfs/dbraw/zinc/78/95/85/525789585.db2.gz VGXNQGLTHHTSNQ-CQSZACIVSA-N 1 3 339.549 2.965 10 0 EFAEHO Cn1cc(CN2CCC(C[NH+]3CCCC3)CC2)c(-c2ccncc2)n1 ZINC000152687413 527196801 /nfs/dbraw/zinc/19/68/01/527196801.db2.gz QNKHNIOGZYAYQI-UHFFFAOYSA-N 1 3 339.487 2.790 10 0 EFAEHO CC[N@H+](C)Cc1cccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1 ZINC000174450398 527840841 /nfs/dbraw/zinc/84/08/41/527840841.db2.gz PYTLTTVXIKWKTN-VQIMIIECSA-N 1 3 346.519 2.762 10 0 EFAEHO CC[N@@H+](C)Cc1cccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1 ZINC000174450398 527840845 /nfs/dbraw/zinc/84/08/45/527840845.db2.gz PYTLTTVXIKWKTN-VQIMIIECSA-N 1 3 346.519 2.762 10 0 EFAEHO CC(C)n1ccc(C[C@@H](C)[NH2+]CCCCN2C[C@@H](C)O[C@H](C)C2)n1 ZINC000341178171 535092154 /nfs/dbraw/zinc/09/21/54/535092154.db2.gz BRLVTKMKSFMXTJ-KZNAEPCWSA-N 1 3 336.524 2.874 10 0 EFAEHO CC(C)N1CCC([NH2+]Cc2ccc(Cn3ccccc3=O)cc2)CC1 ZINC000236602304 535160993 /nfs/dbraw/zinc/16/09/93/535160993.db2.gz FKTAQAZCGGUMME-UHFFFAOYSA-N 1 3 339.483 2.859 10 0 EFAEHO CCN1CCN(CCCC[NH2+][C@@H]2CCCC[C@@H]2[C@@H]2CCOC2)CC1 ZINC000365067047 535693580 /nfs/dbraw/zinc/69/35/80/535693580.db2.gz UQCPXVNTCBTFHZ-VAMGGRTRSA-N 1 3 337.552 2.589 10 0 EFAEHO CC[C@@H]1C[C@H](C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCO1 ZINC000414528536 535899970 /nfs/dbraw/zinc/89/99/70/535899970.db2.gz UHRJIKNFSHYJBB-WOJBJXKFSA-N 1 3 346.515 2.808 10 0 EFAEHO CCc1ccccc1[C@@H](N)CNC(=O)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000418656865 535978158 /nfs/dbraw/zinc/97/81/58/535978158.db2.gz SYEHRQNUGHDMHC-HKUYNNGSSA-N 1 3 344.503 2.519 10 0 EFAEHO C[N@H+](CCNC(=O)NC[C@@H]1CCCCN1C1CC1)C1CCCCC1 ZINC000434352566 536380283 /nfs/dbraw/zinc/38/02/83/536380283.db2.gz OUWPORAVHJWLKQ-SFHVURJKSA-N 1 3 336.524 2.567 10 0 EFAEHO C[N@@H+](CCNC(=O)NC[C@@H]1CCCCN1C1CC1)C1CCCCC1 ZINC000434352566 536380286 /nfs/dbraw/zinc/38/02/86/536380286.db2.gz OUWPORAVHJWLKQ-SFHVURJKSA-N 1 3 336.524 2.567 10 0 EFAEHO CC1(C)CCC[NH2+][C@@H]1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000261544720 545619555 /nfs/dbraw/zinc/61/95/55/545619555.db2.gz ZHRADMNXMJQHJD-GOSISDBHSA-N 1 3 329.488 2.545 10 0 EFAEHO CC1(C)CCC[NH2+][C@H]1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000261544721 545619644 /nfs/dbraw/zinc/61/96/44/545619644.db2.gz ZHRADMNXMJQHJD-SFHVURJKSA-N 1 3 329.488 2.545 10 0 EFAEHO CC(C)[C@@H]1CC[C@H]1[NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1 ZINC000414347419 546190135 /nfs/dbraw/zinc/19/01/35/546190135.db2.gz WGZZMZYOBHYWHP-VQTJNVASSA-N 1 3 343.515 2.908 10 0 EFAEHO CCCN1CCN(c2ccccc2CN[C@H]2CCC[C@@H]([NH3+])C2)CC1 ZINC000414926935 546194771 /nfs/dbraw/zinc/19/47/71/546194771.db2.gz OHYNDYHBGNDVDO-MOPGFXCFSA-N 1 3 330.520 2.578 10 0 EFAEHO C[C@H]1CC[C@H]([NH2+]CC2(N3CCCCC3)CCN(C)CC2)CS1 ZINC000655719195 546548783 /nfs/dbraw/zinc/54/87/83/546548783.db2.gz HUQCYFIKWSXXET-IRXDYDNUSA-N 1 3 325.566 2.810 10 0 EFAEHO COc1ccc(CNC[C@H]2C[C@@H]([NH+](C)C)C2)c(Br)c1 ZINC000655825189 546601500 /nfs/dbraw/zinc/60/15/00/546601500.db2.gz ZYBJHMQMXXBGPU-BJHJDKERSA-N 1 3 327.266 2.888 10 0 EFAEHO c1c(CNC2CCCC2)nnn1C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000656467460 546809953 /nfs/dbraw/zinc/80/99/53/546809953.db2.gz CRYHBJFDMPCOBX-GOSISDBHSA-N 1 3 339.487 2.832 10 0 EFAEHO c1c(CNC2CCCC2)nnn1C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000656467460 546809957 /nfs/dbraw/zinc/80/99/57/546809957.db2.gz CRYHBJFDMPCOBX-GOSISDBHSA-N 1 3 339.487 2.832 10 0 EFAEHO COc1cc2c(cc1CN1CCC[C@@H](C3CC[NH2+]CC3)C1)OCO2 ZINC000656782323 546922463 /nfs/dbraw/zinc/92/24/63/546922463.db2.gz FCPCUOSZWRRBPI-OAHLLOKOSA-N 1 3 332.444 2.636 10 0 EFAEHO Cc1nn(-c2ccncc2)cc1CN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656782983 546922495 /nfs/dbraw/zinc/92/24/95/546922495.db2.gz KREHWMFOCBGZDH-SFHVURJKSA-N 1 3 339.487 2.787 10 0 EFAEHO COc1cc(OC)c(CN2CCC[C@@H](C3CC[NH2+]CC3)C2)c(OC)c1 ZINC000656785993 546924534 /nfs/dbraw/zinc/92/45/34/546924534.db2.gz PDWREKDXEZJYDC-MRXNPFEDSA-N 1 3 348.487 2.924 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN[C@@H]2CCc3cc(N)ccc32)cc1 ZINC000656790594 546925641 /nfs/dbraw/zinc/92/56/41/546925641.db2.gz CJZMYZUZUXOJQU-HXUWFJFHSA-N 1 3 325.456 2.986 10 0 EFAEHO C[NH+](C)[C@@H](CNCc1ccnn1-c1ccncc1)C1CCCCC1 ZINC000657312471 547105134 /nfs/dbraw/zinc/10/51/34/547105134.db2.gz KEEJGRHXBBXNLJ-IBGZPJMESA-N 1 3 327.476 2.867 10 0 EFAEHO CN(C)[C@@H](C[NH2+]Cc1ccnn1-c1ccncc1)C1CCCCC1 ZINC000657312471 547105136 /nfs/dbraw/zinc/10/51/36/547105136.db2.gz KEEJGRHXBBXNLJ-IBGZPJMESA-N 1 3 327.476 2.867 10 0 EFAEHO CC[C@@H]1C[C@H]([NH2+]CCCCN2CCN(c3ccccc3)CC2)CO1 ZINC000657315160 547106147 /nfs/dbraw/zinc/10/61/47/547106147.db2.gz NCTANZQEIVVLCP-AZUAARDMSA-N 1 3 331.504 2.746 10 0 EFAEHO C[C@@H]1CCC[N@@H+](C(C)(C)CNCc2ccnn2-c2ccncc2)C1 ZINC000657324613 547110583 /nfs/dbraw/zinc/11/05/83/547110583.db2.gz FIJUEGYWWYXWLI-MRXNPFEDSA-N 1 3 327.476 2.867 10 0 EFAEHO C[C@@H]1CCC[N@H+](C(C)(C)CNCc2ccnn2-c2ccncc2)C1 ZINC000657324613 547110588 /nfs/dbraw/zinc/11/05/88/547110588.db2.gz FIJUEGYWWYXWLI-MRXNPFEDSA-N 1 3 327.476 2.867 10 0 EFAEHO C[C@@H]1CCCN(C(C)(C)C[NH2+]Cc2ccnn2-c2ccncc2)C1 ZINC000657324613 547110592 /nfs/dbraw/zinc/11/05/92/547110592.db2.gz FIJUEGYWWYXWLI-MRXNPFEDSA-N 1 3 327.476 2.867 10 0 EFAEHO C[C@@H]1CCC[C@](C[NH2+]Cc2ccnn2-c2ccncc2)(N(C)C)C1 ZINC000657327803 547111954 /nfs/dbraw/zinc/11/19/54/547111954.db2.gz YNLJHPNSBHBRBM-APWZRJJASA-N 1 3 327.476 2.867 10 0 EFAEHO CC[C@H]1CCC[C@H]([NH2+]CC2(N3CCOCC3)CCN(C)CC2)CC1 ZINC000657490262 547183630 /nfs/dbraw/zinc/18/36/30/547183630.db2.gz HSGYAGBPHJTHNZ-OALUTQOASA-N 1 3 337.552 2.732 10 0 EFAEHO CCOc1cccc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1 ZINC000657594228 547220547 /nfs/dbraw/zinc/22/05/47/547220547.db2.gz HAXWRZPUTNHWMI-FQEVSTJZSA-N 1 3 340.467 2.942 10 0 EFAEHO CCOc1cccc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1 ZINC000657594228 547220550 /nfs/dbraw/zinc/22/05/50/547220550.db2.gz HAXWRZPUTNHWMI-FQEVSTJZSA-N 1 3 340.467 2.942 10 0 EFAEHO COCc1cccc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1 ZINC000657595708 547222937 /nfs/dbraw/zinc/22/29/37/547222937.db2.gz RTLRCTIQGGEERM-NRFANRHFSA-N 1 3 340.467 2.689 10 0 EFAEHO COCc1cccc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1 ZINC000657595708 547222940 /nfs/dbraw/zinc/22/29/40/547222940.db2.gz RTLRCTIQGGEERM-NRFANRHFSA-N 1 3 340.467 2.689 10 0 EFAEHO CCO[C@H]1C[C@H]([NH2+]Cc2ccccc2N(C)C2CCN(C)CC2)C1 ZINC000657610214 547228020 /nfs/dbraw/zinc/22/80/20/547228020.db2.gz RZDAIWBTJMMOEN-UAPYVXQJSA-N 1 3 331.504 2.874 10 0 EFAEHO CCCn1cc(C[NH2+]CC2CCN(Cc3ccncc3)CC2)cn1 ZINC000657613131 547229931 /nfs/dbraw/zinc/22/99/31/547229931.db2.gz WKIVFYKWCKXAEC-UHFFFAOYSA-N 1 3 327.476 2.690 10 0 EFAEHO C[C@@H]1CN(C)C[C@@H]1[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000657773053 547280953 /nfs/dbraw/zinc/28/09/53/547280953.db2.gz PVUPLTKGZNNTPK-HOJAQTOUSA-N 1 3 327.516 2.828 10 0 EFAEHO CN1CCN(Cc2ccc(C[NH2+][C@H]3CCCSCC3)cc2)CC1 ZINC000657842926 547300080 /nfs/dbraw/zinc/30/00/80/547300080.db2.gz LLAGUKLKGVUBBY-IBGZPJMESA-N 1 3 333.545 2.809 10 0 EFAEHO C[C@@H]([NH2+]CCCN1CCN(c2ccncc2)CC1)C(C)(C)C(F)F ZINC000657863581 547304906 /nfs/dbraw/zinc/30/49/06/547304906.db2.gz LASLOFRVWSHHDA-OAHLLOKOSA-N 1 3 340.462 2.863 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]C[C@H]2CCN2C(C)(C)C)[C@@H](C)C1 ZINC000658053460 547342822 /nfs/dbraw/zinc/34/28/22/547342822.db2.gz BEEITFWUKYRFHS-KSZLIROESA-N 1 3 325.541 2.586 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NC[C@H]2CCN2C(C)(C)C)[C@@H](C)C1 ZINC000658053460 547342827 /nfs/dbraw/zinc/34/28/27/547342827.db2.gz BEEITFWUKYRFHS-KSZLIROESA-N 1 3 325.541 2.586 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NC[C@H]2CCN2C(C)(C)C)[C@@H](C)C1 ZINC000658053460 547342831 /nfs/dbraw/zinc/34/28/31/547342831.db2.gz BEEITFWUKYRFHS-KSZLIROESA-N 1 3 325.541 2.586 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]C[C@@H]2CCN2C(C)(C)C)[C@H](C)C1 ZINC000658053462 547343048 /nfs/dbraw/zinc/34/30/48/547343048.db2.gz BEEITFWUKYRFHS-SQNIBIBYSA-N 1 3 325.541 2.586 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@H](NC[C@@H]2CCN2C(C)(C)C)[C@H](C)C1 ZINC000658053462 547343051 /nfs/dbraw/zinc/34/30/51/547343051.db2.gz BEEITFWUKYRFHS-SQNIBIBYSA-N 1 3 325.541 2.586 10 0 EFAEHO CCOCCC[N@H+]1CC[C@H](NC[C@@H]2CCN2C(C)(C)C)[C@H](C)C1 ZINC000658053462 547343056 /nfs/dbraw/zinc/34/30/56/547343056.db2.gz BEEITFWUKYRFHS-SQNIBIBYSA-N 1 3 325.541 2.586 10 0 EFAEHO CO[C@H](CNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1)[C@@H]1CCOC1 ZINC000658070258 547347274 /nfs/dbraw/zinc/34/72/74/547347274.db2.gz AVJKVMNGHUREFO-YFVAEKQCSA-N 1 3 346.515 2.723 10 0 EFAEHO CO[C@H](CNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)[C@@H]1CCOC1 ZINC000658070251 547347564 /nfs/dbraw/zinc/34/75/64/547347564.db2.gz AVJKVMNGHUREFO-FBBABVLZSA-N 1 3 346.515 2.723 10 0 EFAEHO COc1ccc([C@@H](C)NCC2CC[NH+](C3CCOCC3)CC2)cc1O ZINC000658070174 547347729 /nfs/dbraw/zinc/34/77/29/547347729.db2.gz NFZIFJZSUITYMR-OAHLLOKOSA-N 1 3 348.487 2.942 10 0 EFAEHO C[C@@H](NCC1CC[NH+](C2CCOCC2)CC1)c1cc2n(n1)CCCC2 ZINC000658071232 547347758 /nfs/dbraw/zinc/34/77/58/547347758.db2.gz WBCIANAZRAYUAQ-MRXNPFEDSA-N 1 3 346.519 2.761 10 0 EFAEHO COC[C@H](CC[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)OC ZINC000658082235 547352259 /nfs/dbraw/zinc/35/22/59/547352259.db2.gz KNHWYTYOBFZPPC-IVAOSVALSA-N 1 3 346.515 2.928 10 0 EFAEHO C[C@@H](N[C@@H](C)CN(C)CCC[NH+](C)C)c1nc2c(s1)CCCC2 ZINC000658107746 547358464 /nfs/dbraw/zinc/35/84/64/547358464.db2.gz OEVRGQMFXBNQOS-LSDHHAIUSA-N 1 3 338.565 2.945 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)N[C@@H](C)c1cnn(C2CCCC2)c1 ZINC000658107737 547358692 /nfs/dbraw/zinc/35/86/92/547358692.db2.gz NWTKLBJTKXEJPF-IRXDYDNUSA-N 1 3 335.540 2.921 10 0 EFAEHO O[C@H]1CCN(Cc2ccc(C[NH2+][C@@H]3CCCC34CCOCC4)cc2)C1 ZINC000658138038 547367382 /nfs/dbraw/zinc/36/73/82/547367382.db2.gz MCNGJXFZRUKBQG-VQTJNVASSA-N 1 3 344.499 2.692 10 0 EFAEHO C[C@H](CCc1ccco1)[NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000658137798 547368259 /nfs/dbraw/zinc/36/82/59/547368259.db2.gz IKXPLEYVVVHCCN-APWZRJJASA-N 1 3 328.456 2.957 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(CN2CC[C@@H](O)C2)cc1)C1CCSCC1 ZINC000658142564 547369971 /nfs/dbraw/zinc/36/99/71/547369971.db2.gz YOPVAKCFTLEALS-DNVCBOLYSA-N 1 3 334.529 2.875 10 0 EFAEHO Fc1ccc([C@@H](NCC2CC[NH+](CC3CC3)CC2)c2c[nH]nn2)cc1 ZINC000658354022 547425179 /nfs/dbraw/zinc/42/51/79/547425179.db2.gz VOHXBNPVKJEQHB-LJQANCHMSA-N 1 3 343.450 2.745 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C)[C@@H]3CCC[C@@H]32)c(N2CCCC2)n1 ZINC000671759971 547668425 /nfs/dbraw/zinc/66/84/25/547668425.db2.gz FPQXMRYGJLGLRT-GUDVDZBRSA-N 1 3 328.504 2.953 10 0 EFAEHO C[C@H]1CCN(Cc2ccccc2)CCN1C(=O)CCCC[NH+](C)C ZINC000673750720 547950499 /nfs/dbraw/zinc/95/04/99/547950499.db2.gz FBKZCKCTJTXULD-SFHVURJKSA-N 1 3 331.504 2.841 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCN(CC2CC2)C1 ZINC000675834768 548362800 /nfs/dbraw/zinc/36/28/00/548362800.db2.gz ZSBPRONMJLPTOL-DUXKGJEZSA-N 1 3 327.516 2.971 10 0 EFAEHO COC1CCN(CC[NH2+][C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)CC1 ZINC000675929451 548377406 /nfs/dbraw/zinc/37/74/06/548377406.db2.gz FAONKHRMDJFZFI-GHTZIAJQSA-N 1 3 345.531 2.597 10 0 EFAEHO CC[C@H](C[NH+]1CCCC1)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000677577219 548728429 /nfs/dbraw/zinc/72/84/29/548728429.db2.gz LLZLLZJQQLVEPQ-QYZOEREBSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@H]1CN(Cc2ccc3cnccc3c2)CC[C@@H]1[NH+]1CCN(C)CC1 ZINC000683833115 549952919 /nfs/dbraw/zinc/95/29/19/549952919.db2.gz UBAQVLHBQAYGFQ-UWJYYQICSA-N 1 3 338.499 2.693 10 0 EFAEHO CN(CC[N@H+](C)C1CCN(C)CC1)Cc1cccc2cnccc21 ZINC000685454780 550153864 /nfs/dbraw/zinc/15/38/64/550153864.db2.gz NNWUVUWLSXWHPL-UHFFFAOYSA-N 1 3 326.488 2.693 10 0 EFAEHO CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1cccc2cnccc21 ZINC000685454780 550153866 /nfs/dbraw/zinc/15/38/66/550153866.db2.gz NNWUVUWLSXWHPL-UHFFFAOYSA-N 1 3 326.488 2.693 10 0 EFAEHO CCOCCOCc1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)c1 ZINC000774121223 581484443 /nfs/dbraw/zinc/48/44/43/581484443.db2.gz FJRSDTUOKZVNJV-IHWFROFDSA-N 1 3 332.488 2.955 10 0 EFAEHO C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@H]1CC[NH2+]CC1CC(C)(C)C1 ZINC001691306619 1248640491 /nfs/dbraw/zinc/64/04/91/1248640491.db2.gz VXQYQDRIEHFJII-QAPCUYQASA-N 1 3 346.519 2.995 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN1CC[C@@H](C)C1 ZINC001691370449 1248705988 /nfs/dbraw/zinc/70/59/88/1248705988.db2.gz QUCXJAWHEXJJQV-GJGSYKPXSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[NH2+]Cc1cccc2ccccc21)N(C)C ZINC001691465446 1249184309 /nfs/dbraw/zinc/18/43/09/1249184309.db2.gz VAPCXQCTAWWQSF-HXUWFJFHSA-N 1 3 341.499 2.974 10 0 EFAEHO CN(CC(=O)N(C)CC[NH2+]CC1CCC(F)(F)CC1)CC(C)(C)C ZINC001691476839 1249200589 /nfs/dbraw/zinc/20/05/89/1249200589.db2.gz SBLAQIXHWKOKDC-UHFFFAOYSA-N 1 3 347.494 2.838 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/C[NH2+]C[C@H]1CCCC(F)(F)C1)N(C)C ZINC001268551682 1250102777 /nfs/dbraw/zinc/10/27/77/1250102777.db2.gz IKTDYBQRGOVREA-DKLOGILVSA-N 1 3 345.478 2.660 10 0 EFAEHO C[N@@H+]1CC[C@H](NC[C@H](O)c2cc(F)c(F)c(F)c2)[C@@H]2CCC[C@H]21 ZINC000850581394 1250547098 /nfs/dbraw/zinc/54/70/98/1250547098.db2.gz VVKYYLBTJDBOCA-KSYCFECVSA-N 1 3 328.378 2.600 10 0 EFAEHO C[N@H+]1CC[C@H](NC[C@H](O)c2cc(F)c(F)c(F)c2)[C@@H]2CCC[C@H]21 ZINC000850581394 1250547106 /nfs/dbraw/zinc/54/71/06/1250547106.db2.gz VVKYYLBTJDBOCA-KSYCFECVSA-N 1 3 328.378 2.600 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@H](O)c2cc(F)c(F)c(F)c2)[C@@H]2CCC[C@H]21 ZINC000850581394 1250547113 /nfs/dbraw/zinc/54/71/13/1250547113.db2.gz VVKYYLBTJDBOCA-KSYCFECVSA-N 1 3 328.378 2.600 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)CC[NH+]2CCCCC2)cc1F ZINC001691623059 1251840871 /nfs/dbraw/zinc/84/08/71/1251840871.db2.gz KDTVJQQNSFIQPK-UHFFFAOYSA-N 1 3 335.467 2.558 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1)N1CC[C@](C)(NC(=O)CC[NH+](C)C)C1 ZINC001484058429 1252120568 /nfs/dbraw/zinc/12/05/68/1252120568.db2.gz RNOVTUSCSWXSLH-HKUYNNGSSA-N 1 3 335.467 2.809 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@]1(C)CCN(Cc2ccc(C3CCC3)cc2)C1 ZINC001484058776 1252121860 /nfs/dbraw/zinc/12/18/60/1252121860.db2.gz UQOTWRFNVRSCGI-OAQYLSRUSA-N 1 3 343.515 2.986 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@@]2(C)CCN(CCCCC(F)(F)F)C2)CC1 ZINC001484059751 1252122971 /nfs/dbraw/zinc/12/29/71/1252122971.db2.gz YLEIYZOSHJYWIR-HNNXBMFYSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)N[C@]2(C)CCN(CCCCC(F)(F)F)C2)C1 ZINC001484069084 1252179868 /nfs/dbraw/zinc/17/98/68/1252179868.db2.gz WXNBCFXOWSDJKH-GOEBONIOSA-N 1 3 349.441 2.641 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)N[C@]2(C)CCN(CCCCC(F)(F)F)C2)C1 ZINC001484069084 1252179872 /nfs/dbraw/zinc/17/98/72/1252179872.db2.gz WXNBCFXOWSDJKH-GOEBONIOSA-N 1 3 349.441 2.641 10 0 EFAEHO C[C@]1(C[NH2+]CCCCC(F)(F)F)CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001484114459 1252266657 /nfs/dbraw/zinc/26/66/57/1252266657.db2.gz NEYMKEWPUIKQRJ-OAHLLOKOSA-N 1 3 346.397 2.513 10 0 EFAEHO CCc1ccccc1[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]CC(C)C ZINC001484322030 1252389739 /nfs/dbraw/zinc/38/97/39/1252389739.db2.gz AAJAURPYWZVYQJ-FXAWDEMLSA-N 1 3 345.531 2.994 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([C@H](C)[NH2+]CC2CC3(CCC3)C2)C1 ZINC001484358593 1252443706 /nfs/dbraw/zinc/44/37/06/1252443706.db2.gz OEIZCBPOLLUXEJ-FUHWJXTLSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([C@@H](C)[NH2+]CCCC(C)(C)C)C1 ZINC001484356277 1252449283 /nfs/dbraw/zinc/44/92/83/1252449283.db2.gz BSIRASLSUGQORW-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCCC[NH2+]C[C@@H]1CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1C ZINC001484376089 1252483818 /nfs/dbraw/zinc/48/38/18/1252483818.db2.gz BSACYYPVUSKCKZ-DLBZAZTESA-N 1 3 325.541 2.839 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1F ZINC001484384435 1252488704 /nfs/dbraw/zinc/48/87/04/1252488704.db2.gz OGKREJYYCDWLFM-AEFFLSMTSA-N 1 3 349.494 2.658 10 0 EFAEHO C[C@@H]1CN(C(=O)CN2CCC(C)CC2)C[C@@H]1C[NH2+]CCCC1CCC1 ZINC001484381427 1252493957 /nfs/dbraw/zinc/49/39/57/1252493957.db2.gz WAGAJFMDLUBQIX-QUCCMNQESA-N 1 3 349.563 2.983 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001484396093 1252518953 /nfs/dbraw/zinc/51/89/53/1252518953.db2.gz QAQNDPCJIAOCBI-BRSBDYLESA-N 1 3 341.515 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CC3CCC(C)(C)CC3)C[C@@H]2C1 ZINC001484415057 1252570710 /nfs/dbraw/zinc/57/07/10/1252570710.db2.gz MRWFWPRSEJLTIC-KDURUIRLSA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CC3CCC(C)(C)CC3)C[C@@H]2C1 ZINC001484415057 1252570716 /nfs/dbraw/zinc/57/07/16/1252570716.db2.gz MRWFWPRSEJLTIC-KDURUIRLSA-N 1 3 349.563 2.933 10 0 EFAEHO C[NH+](C)CC1(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2ccsc2)CC1 ZINC001484460510 1252652855 /nfs/dbraw/zinc/65/28/55/1252652855.db2.gz BYZFHOYPERLIDA-IRXDYDNUSA-N 1 3 347.528 2.655 10 0 EFAEHO C[C@H](c1ccccc1F)N1C[C@@H]2CCCN(C(=O)CC[NH+](C)C)[C@@H]2C1 ZINC001484473147 1252700200 /nfs/dbraw/zinc/70/02/00/1252700200.db2.gz NNUGMCFLNLHUSE-JTDSTZFVSA-N 1 3 347.478 2.761 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N(C)CCCN(C)Cc1ccsc1 ZINC001484743625 1252856054 /nfs/dbraw/zinc/85/60/54/1252856054.db2.gz DWDDZEFACWBHQY-KRWDZBQOSA-N 1 3 337.533 2.903 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N(C)CCCN(C)Cc1ccsc1 ZINC001484743625 1252856074 /nfs/dbraw/zinc/85/60/74/1252856074.db2.gz DWDDZEFACWBHQY-KRWDZBQOSA-N 1 3 337.533 2.903 10 0 EFAEHO Cc1cc(C)c(C[NH2+]CC[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001273017930 1265797711 /nfs/dbraw/zinc/79/77/11/1265797711.db2.gz FBLSGBJFJAGBTL-HNAYVOBHSA-N 1 3 345.531 2.938 10 0 EFAEHO C[C@@H](CC[NH2+]CC1CCCC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001273018943 1265839271 /nfs/dbraw/zinc/83/92/71/1265839271.db2.gz QHLOFFRLRIMNRP-HNAYVOBHSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@@H]([C@H]2CCCCN2C(=O)CN(C)C(C)C)C1 ZINC001670924039 1258689287 /nfs/dbraw/zinc/68/92/87/1258689287.db2.gz RVTYNYHRMZYMKB-RTBURBONSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@@H]([C@H]2CCCCN2C(=O)CN(C)C(C)C)C1 ZINC001670924039 1258689294 /nfs/dbraw/zinc/68/92/94/1258689294.db2.gz RVTYNYHRMZYMKB-RTBURBONSA-N 1 3 335.536 2.996 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CCNC/C(Cl)=C\Cl ZINC001272824137 1260829708 /nfs/dbraw/zinc/82/97/08/1260829708.db2.gz VQXGTDRPKMODNP-BILBVFMZSA-N 1 3 336.307 2.664 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CCNC/C(Cl)=C\Cl ZINC001272824137 1260829713 /nfs/dbraw/zinc/82/97/13/1260829713.db2.gz VQXGTDRPKMODNP-BILBVFMZSA-N 1 3 336.307 2.664 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN2CCCC[C@H]2[C@H]2CC[NH2+]C2)c(C)c1 ZINC000923365071 1261558386 /nfs/dbraw/zinc/55/83/86/1261558386.db2.gz RWEXPKOCJFVWIJ-OTWHNJEPSA-N 1 3 332.488 2.507 10 0 EFAEHO Fc1ccc([C@@H](CC(F)(F)F)NC[C@H]2CC3(C[NH2+]C3)CO2)cc1 ZINC000923377462 1261577713 /nfs/dbraw/zinc/57/77/13/1261577713.db2.gz UQSHIYIGQJVUBA-ZIAGYGMSSA-N 1 3 332.341 2.787 10 0 EFAEHO C[C@@H]1CN(C[C@@H]2Cc3ccccc3O[C@H]2C(F)(F)F)C[C@H]1C[NH3+] ZINC000923409759 1261624519 /nfs/dbraw/zinc/62/45/19/1261624519.db2.gz FGOMNOARBOVRIH-UZMCECQYSA-N 1 3 328.378 2.695 10 0 EFAEHO Cc1ccc(OC[C@H](O)CN2CC[C@](C[NH3+])(C(C)(C)C)C2)c(C)c1 ZINC000923413218 1261627254 /nfs/dbraw/zinc/62/72/54/1261627254.db2.gz FAMPAIWEAIONDS-YLJYHZDGSA-N 1 3 334.504 2.740 10 0 EFAEHO [NH3+]C[C@H]1CC2(CO1)CCN(Cc1cc(Cl)nc(Cl)c1)CC2 ZINC000923448934 1261669741 /nfs/dbraw/zinc/66/97/41/1261669741.db2.gz IMUVXDGPDKUBCP-GFCCVEGCSA-N 1 3 330.259 2.718 10 0 EFAEHO C[C@H](C(=O)N1CCC[C@H]1c1cccs1)N1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923496327 1261763739 /nfs/dbraw/zinc/76/37/39/1261763739.db2.gz BEMWAICCAJMVQH-FPCVCCKLSA-N 1 3 335.517 2.717 10 0 EFAEHO C[C@H]1CN(CC(=O)N(Cc2cccc(F)c2)C(C)(C)C)CC[C@@H]1C[NH3+] ZINC000923499196 1261794944 /nfs/dbraw/zinc/79/49/44/1261794944.db2.gz RDIVDNNUGNAOFW-DOTOQJQBSA-N 1 3 349.494 2.870 10 0 EFAEHO C[C@H](NC(=O)[C@H](C)N1CC[C@@H](C[NH3+])[C@H](C)C1)c1cc2ccccc2o1 ZINC000923499947 1261795562 /nfs/dbraw/zinc/79/55/62/1261795562.db2.gz OUSIKIWRBCTQCY-AESZEHBQSA-N 1 3 343.471 2.915 10 0 EFAEHO C[C@@H]1CN([C@@H](C(=O)N2CCCCC2)c2ccccc2)CC[C@@H]1C[NH3+] ZINC000923499637 1261796108 /nfs/dbraw/zinc/79/61/08/1261796108.db2.gz MJYXUHCAPSVRNT-BHIYHBOVSA-N 1 3 329.488 2.657 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C[NH3+])[C@@H](C)C1)c1ccc2ccccc2c1 ZINC000923504649 1261801556 /nfs/dbraw/zinc/80/15/56/1261801556.db2.gz SCLQRCMMLWUNDE-TWOQFEAHSA-N 1 3 339.483 2.934 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C[NH3+])[C@H](C)C1)c1ccc2ccccc2c1 ZINC000923504442 1261801674 /nfs/dbraw/zinc/80/16/74/1261801674.db2.gz SCLQRCMMLWUNDE-GQIGUUNPSA-N 1 3 339.483 2.934 10 0 EFAEHO Brc1ccc(OC[C@@H]2CCCN2C[C@H]2CC[NH2+]C2)cc1 ZINC000923525395 1261841688 /nfs/dbraw/zinc/84/16/88/1261841688.db2.gz HFUXTOIVFZOLBD-ZFWWWQNUSA-N 1 3 339.277 2.902 10 0 EFAEHO c1ccc2c(c1)[C@@H](C[C@H]1COCCN1)CN2CCC[NH+]1CCCCC1 ZINC000923541757 1261887876 /nfs/dbraw/zinc/88/78/76/1261887876.db2.gz VPHOLOUILKLWFW-OALUTQOASA-N 1 3 343.515 2.845 10 0 EFAEHO CCCCCN1CC[C@@H]1CN(C)C(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001691661515 1262209640 /nfs/dbraw/zinc/20/96/40/1262209640.db2.gz UWHDBOROBSCKNH-APWZRJJASA-N 1 3 341.515 2.922 10 0 EFAEHO CCCCCN1CC[C@@H]1CN(C)C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001691661515 1262209646 /nfs/dbraw/zinc/20/96/46/1262209646.db2.gz UWHDBOROBSCKNH-APWZRJJASA-N 1 3 341.515 2.922 10 0 EFAEHO C[C@H](CN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cc2ccccc2o1 ZINC001485922667 1262502493 /nfs/dbraw/zinc/50/24/93/1262502493.db2.gz PGQUYWZPJAJQNE-HZPDHXFCSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@H](CN(C)C(=O)c1cccc(CN(C)C)c1)[NH2+]CC1CCCC1 ZINC001485960168 1262559708 /nfs/dbraw/zinc/55/97/08/1262559708.db2.gz ALJYJJTYWJSBBB-MRXNPFEDSA-N 1 3 331.504 2.989 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2cccc(C)c2)C[C@H]1C ZINC001486129980 1262663247 /nfs/dbraw/zinc/66/32/47/1262663247.db2.gz PJYLXOHMSMDWLI-UYAOXDASSA-N 1 3 345.531 2.848 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]CCCc2cccc(F)c2)C[C@H]1C ZINC001486139151 1262675750 /nfs/dbraw/zinc/67/57/50/1262675750.db2.gz ZMOHKJXOYRQMSP-VQIMIIECSA-N 1 3 349.494 2.678 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H](C[NH2+]CC3=CCCCC3)C2)CCC1 ZINC001486203402 1262788619 /nfs/dbraw/zinc/78/86/19/1262788619.db2.gz XGUSMCZHRBJMLQ-ROUUACIJSA-N 1 3 333.520 2.846 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H](C[NH2+]C/C=C/Cl)C1)CC(C)(C)C ZINC001486211055 1262806867 /nfs/dbraw/zinc/80/68/67/1262806867.db2.gz AKUKDSQGPFQYLK-YKHJJTLOSA-N 1 3 329.916 2.591 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)Nc3cnc(C)c(C)c3)CC2)CC1 ZINC000921873182 1263051050 /nfs/dbraw/zinc/05/10/50/1263051050.db2.gz PGJIDDJQQSXKIR-UHFFFAOYSA-N 1 3 344.503 2.833 10 0 EFAEHO C[C@H](C(=O)N[C@@H](C)C1CC[NH+](CC2CC2)CC1)N1CCCCCC1 ZINC001486449218 1263139684 /nfs/dbraw/zinc/13/96/84/1263139684.db2.gz RHXBJZIRFSWNCR-DLBZAZTESA-N 1 3 335.536 2.878 10 0 EFAEHO CC1CC(C[NH+]2CCC(C3(NC(=O)CN4CC[C@H](C)C4)CC3)CC2)C1 ZINC001486490885 1263235715 /nfs/dbraw/zinc/23/57/15/1263235715.db2.gz JZIWFJNLGALRIJ-AOCRQIFASA-N 1 3 347.547 2.735 10 0 EFAEHO CC(C)(C(=O)NCC1=CC[N@H+](CC2CCC2)CC1)N1CCCCC1 ZINC001486507598 1263263207 /nfs/dbraw/zinc/26/32/07/1263263207.db2.gz WNACBOIYPUZXQC-UHFFFAOYSA-N 1 3 333.520 2.799 10 0 EFAEHO CC(C)(C(=O)NCC1=CC[N@@H+](CC2CCC2)CC1)N1CCCCC1 ZINC001486507598 1263263213 /nfs/dbraw/zinc/26/32/13/1263263213.db2.gz WNACBOIYPUZXQC-UHFFFAOYSA-N 1 3 333.520 2.799 10 0 EFAEHO CN(C)C1(C(=O)NCC2=CC[N@H+](CCCC3CCC3)CC2)CCC1 ZINC001486509863 1263283216 /nfs/dbraw/zinc/28/32/16/1263283216.db2.gz DRZOQVHPQFQSQD-UHFFFAOYSA-N 1 3 333.520 2.799 10 0 EFAEHO CN(C)C1(C(=O)NCC2=CC[N@@H+](CCCC3CCC3)CC2)CCC1 ZINC001486509863 1263283223 /nfs/dbraw/zinc/28/32/23/1263283223.db2.gz DRZOQVHPQFQSQD-UHFFFAOYSA-N 1 3 333.520 2.799 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CCC[N@H+](CC1CC(C)(C)C1)C2 ZINC001410175829 1264185833 /nfs/dbraw/zinc/18/58/33/1264185833.db2.gz ZMPODGDKLLECCD-UHFFFAOYSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C1)CCC[N@@H+](CC1CC(C)(C)C1)C2 ZINC001410175829 1264185835 /nfs/dbraw/zinc/18/58/35/1264185835.db2.gz ZMPODGDKLLECCD-UHFFFAOYSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2ccc(F)cc2)C1)N(C)C ZINC001410212876 1264325347 /nfs/dbraw/zinc/32/53/47/1264325347.db2.gz YQSRHVNWIZKIAD-RGCFKVTRSA-N 1 3 349.494 2.957 10 0 EFAEHO Cn1nc2c(c1C[NH2+]C[C@@]1(C)CCN(Cc3ccccc3)C1)CCC2 ZINC000922094426 1264353947 /nfs/dbraw/zinc/35/39/47/1264353947.db2.gz MNPQXZMHIHJJGS-OAQYLSRUSA-N 1 3 338.499 2.911 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2cccc(C)c2)C1)N(C)C ZINC001410232503 1264433795 /nfs/dbraw/zinc/43/37/95/1264433795.db2.gz ZSFHNDMBVLIHKW-RWQQGDIJSA-N 1 3 331.504 2.881 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@H]1C[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001410234766 1264439692 /nfs/dbraw/zinc/43/96/92/1264439692.db2.gz VFLSMAPUBQUAJO-IEZWGBDMSA-N 1 3 331.504 2.892 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2cccc(Cl)c2)C1)C1CCC1 ZINC001410241040 1264466311 /nfs/dbraw/zinc/46/63/11/1264466311.db2.gz PUWMUBKYUJFPSY-JCNLHEQBSA-N 1 3 349.906 2.809 10 0 EFAEHO C[C@H]([NH2+]C[C@H]1C[C@H](NC(=O)CN(C)C2CCC2)C1)c1ccccc1F ZINC001410246465 1264487395 /nfs/dbraw/zinc/48/73/95/1264487395.db2.gz XTWNOKPRDQCZFD-JYJNAYRXSA-N 1 3 347.478 2.855 10 0 EFAEHO CC[C@@H](C(=O)N(C)[C@H](C[NH2+]Cc1cc(C)ccc1F)C1CC1)N(C)C ZINC001410307195 1264720953 /nfs/dbraw/zinc/72/09/53/1264720953.db2.gz HKSKRBNOBDWCJF-RBUKOAKNSA-N 1 3 349.494 2.801 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N(C)C[C@H](C)NCc2ccccc2F)C1 ZINC001410429727 1265157614 /nfs/dbraw/zinc/15/76/14/1265157614.db2.gz TXNWSQPFTLPVNR-FUHWJXTLSA-N 1 3 349.494 2.884 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N(C)C[C@H](C)NCc2ccccc2F)C1 ZINC001410429727 1265157618 /nfs/dbraw/zinc/15/76/18/1265157618.db2.gz TXNWSQPFTLPVNR-FUHWJXTLSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN(C)CC(C)(C)C)[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001410439154 1265294158 /nfs/dbraw/zinc/29/41/58/1265294158.db2.gz QWODUAWHARXRRM-GJZGRUSLSA-N 1 3 347.494 2.836 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)CN(C)C(=O)[C@H]1CC[N@H+](C)C1 ZINC001410494575 1266914041 /nfs/dbraw/zinc/91/40/41/1266914041.db2.gz LXXNDMXXQAYQMB-GJZGRUSLSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)CN(C)C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001410494575 1266914045 /nfs/dbraw/zinc/91/40/45/1266914045.db2.gz LXXNDMXXQAYQMB-GJZGRUSLSA-N 1 3 337.895 2.537 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001410506546 1266986196 /nfs/dbraw/zinc/98/61/96/1266986196.db2.gz KYJKGIWDLJKDNH-DNVCBOLYSA-N 1 3 349.494 2.980 10 0 EFAEHO O[C@@H](C[C@@H]1CCC[N@@H+]1Cc1ccnn1-c1ccncc1)c1ccco1 ZINC000824927625 1278359019 /nfs/dbraw/zinc/35/90/19/1278359019.db2.gz PPVPLSJEGLOYLA-WMZOPIPTSA-N 1 3 338.411 2.948 10 0 EFAEHO O[C@@H](C[C@@H]1CCC[N@H+]1Cc1ccnn1-c1ccncc1)c1ccco1 ZINC000824927625 1278359033 /nfs/dbraw/zinc/35/90/33/1278359033.db2.gz PPVPLSJEGLOYLA-WMZOPIPTSA-N 1 3 338.411 2.948 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]Cc2cc(C)ccc2F)[C@H]1C ZINC001410861012 1269903817 /nfs/dbraw/zinc/90/38/17/1269903817.db2.gz OTMKEGXFUGIJQT-CRAIPNDOSA-N 1 3 335.467 2.555 10 0 EFAEHO Cc1ccc(CN2CC[C@]3(NC(=O)CC[NH+](C)C)CCC[C@H]23)cc1F ZINC001410883710 1270034273 /nfs/dbraw/zinc/03/42/73/1270034273.db2.gz AKHITBLSISWSMH-AZUAARDMSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1cc(F)ccc1CN1CC[C@]2(NC(=O)CC[NH+](C)C)CCC[C@@H]12 ZINC001410917581 1270237480 /nfs/dbraw/zinc/23/74/80/1270237480.db2.gz WSQAIXVFYHHPFR-UYAOXDASSA-N 1 3 347.478 2.699 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@H](C[NH2+]Cc3ccsc3)C2)CCC1 ZINC001410948903 1270380080 /nfs/dbraw/zinc/38/00/80/1270380080.db2.gz HPNWLDYXXAXPJG-GOEBONIOSA-N 1 3 335.517 2.607 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc(C)c(F)c2)C(C)(C)C1 ZINC001411082499 1270938133 /nfs/dbraw/zinc/93/81/33/1270938133.db2.gz DJEODRDPLWBMMB-GOSISDBHSA-N 1 3 349.494 2.803 10 0 EFAEHO CCC[N@H+](C)CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001411195183 1271858072 /nfs/dbraw/zinc/85/80/72/1271858072.db2.gz PSNRXHJXMFSXBV-SFHVURJKSA-N 1 3 329.504 2.778 10 0 EFAEHO CCC[N@@H+](C)CCN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001411195183 1271858079 /nfs/dbraw/zinc/85/80/79/1271858079.db2.gz PSNRXHJXMFSXBV-SFHVURJKSA-N 1 3 329.504 2.778 10 0 EFAEHO CC[C@H](F)C[NH+]1CCC([C@@H](C)NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001411234738 1272093787 /nfs/dbraw/zinc/09/37/87/1272093787.db2.gz LINITZAYWJRVDT-WBVHZDCISA-N 1 3 343.531 2.929 10 0 EFAEHO C[NH+](C)CCCC(=O)NC1(C2CCN(CCC(F)(F)F)CC2)CC1 ZINC001411251851 1272142461 /nfs/dbraw/zinc/14/24/61/1272142461.db2.gz NSJAXAOMANBAJA-UHFFFAOYSA-N 1 3 349.441 2.641 10 0 EFAEHO CCN1CCN(c2ccc(NC(=O)[C@@H]3[NH2+]CCCC3(C)C)cc2)CC1 ZINC000844191356 1278786303 /nfs/dbraw/zinc/78/63/03/1278786303.db2.gz MVBQNTSAYDWWOB-SFHVURJKSA-N 1 3 344.503 2.545 10 0 EFAEHO O[C@H](CN[C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(F)c1 ZINC000817888538 1276348259 /nfs/dbraw/zinc/34/82/59/1276348259.db2.gz HNLXQXDLDUKBQU-QWFCFKBJSA-N 1 3 342.414 2.705 10 0 EFAEHO Cc1cc([C@H](N)CC(=O)N[C@H](C)C(C)(C)C[NH+](C)C)cc(Cl)n1 ZINC000830413722 1276630663 /nfs/dbraw/zinc/63/06/63/1276630663.db2.gz CYHCQWUISVBTLF-TZMCWYRMSA-N 1 3 340.899 2.526 10 0 EFAEHO C[C@@H](C(=O)NCc1ccc(Cl)cc1)N(C)CCCCCC[NH3+] ZINC000872155162 1287449671 /nfs/dbraw/zinc/44/96/71/1287449671.db2.gz NBDZIPJPURDFJI-AWEZNQCLSA-N 1 3 325.884 2.796 10 0 EFAEHO C[C@H](NC(=O)CN(C)CCCCCC[NH3+])c1ccc(Cl)cc1 ZINC000872155138 1287450393 /nfs/dbraw/zinc/45/03/93/1287450393.db2.gz MFSPSJRJWNMIEH-AWEZNQCLSA-N 1 3 325.884 2.968 10 0 EFAEHO COc1ccccc1[C@@H]1CSCCCN1C[C@H]1CCC2(C[NH2+]C2)O1 ZINC000872157054 1287452046 /nfs/dbraw/zinc/45/20/46/1287452046.db2.gz HKFDDWZRMDTZOH-WBVHZDCISA-N 1 3 348.512 2.696 10 0 EFAEHO [NH3+][C@H](C[C@H]1CCCN([C@@H]2CCN(C3CCC3)C2=O)C1)C1CCCC1 ZINC000872158230 1287454070 /nfs/dbraw/zinc/45/40/70/1287454070.db2.gz UFCYAYGCXJKAPG-ATZDWAIDSA-N 1 3 333.520 2.759 10 0 EFAEHO [NH3+][C@H](C[C@@H]1CCCN([C@H]2CCN(C3CCC3)C2=O)C1)C1CCCC1 ZINC000872158231 1287454121 /nfs/dbraw/zinc/45/41/21/1287454121.db2.gz UFCYAYGCXJKAPG-IPELMVKDSA-N 1 3 333.520 2.759 10 0 EFAEHO C[C@@H]1CCC[N@H+](Cc2ccccc2CNC[C@H](O)CC(C)(C)O)C1 ZINC000872200859 1287473195 /nfs/dbraw/zinc/47/31/95/1287473195.db2.gz LQGCQJIIDVZKGG-VQIMIIECSA-N 1 3 334.504 2.530 10 0 EFAEHO C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC[C@H](O)CC(C)(C)O)C1 ZINC000872200859 1287473196 /nfs/dbraw/zinc/47/31/96/1287473196.db2.gz LQGCQJIIDVZKGG-VQIMIIECSA-N 1 3 334.504 2.530 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001671084516 1281347576 /nfs/dbraw/zinc/34/75/76/1281347576.db2.gz BYEQVCFREAKBBV-NGQOVYEWSA-N 1 3 347.547 2.999 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001671084516 1281347586 /nfs/dbraw/zinc/34/75/86/1281347586.db2.gz BYEQVCFREAKBBV-NGQOVYEWSA-N 1 3 347.547 2.999 10 0 EFAEHO C[N@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CCCCC1 ZINC000810056259 1282788682 /nfs/dbraw/zinc/78/86/82/1282788682.db2.gz KEBWXDJUSBJSKU-IBGZPJMESA-N 1 3 341.515 2.970 10 0 EFAEHO C[N@@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CCCCC1 ZINC000810056259 1282788694 /nfs/dbraw/zinc/78/86/94/1282788694.db2.gz KEBWXDJUSBJSKU-IBGZPJMESA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000810147784 1282970676 /nfs/dbraw/zinc/97/06/76/1282970676.db2.gz RYIUUBBVGHUXQI-MDZRGWNJSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000810147782 1282971186 /nfs/dbraw/zinc/97/11/86/1282971186.db2.gz RYIUUBBVGHUXQI-GPMSIDNRSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCC[C@H]2C[NH+]2CCCCC2)C1 ZINC000810334429 1283141697 /nfs/dbraw/zinc/14/16/97/1283141697.db2.gz FDHJTWKZCVFAJP-LPHOPBHVSA-N 1 3 339.499 2.676 10 0 EFAEHO CC[C@H]1CCCC[N@@H+]1CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810400539 1283191035 /nfs/dbraw/zinc/19/10/35/1283191035.db2.gz IEQDTYSZHZXAGZ-YJBOKZPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H]1CCCC[N@H+]1CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000810400539 1283191040 /nfs/dbraw/zinc/19/10/40/1283191040.db2.gz IEQDTYSZHZXAGZ-YJBOKZPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CCC[C@@H]([NH+]3CCCC3)CC2)C1 ZINC000810425233 1283220279 /nfs/dbraw/zinc/22/02/79/1283220279.db2.gz HLRLLHXKPKFKLP-VQIMIIECSA-N 1 3 339.499 2.676 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC000811525424 1284372372 /nfs/dbraw/zinc/37/23/72/1284372372.db2.gz UTMRZZNMXSJGFD-GOSISDBHSA-N 1 3 327.488 2.533 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC000811525424 1284372384 /nfs/dbraw/zinc/37/23/84/1284372384.db2.gz UTMRZZNMXSJGFD-GOSISDBHSA-N 1 3 327.488 2.533 10 0 EFAEHO CC[N@H+](CCCN1CCN(C(C)C)CC1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812849990 1285476378 /nfs/dbraw/zinc/47/63/78/1285476378.db2.gz SKXIFBDQCIITJI-FPOVZHCZSA-N 1 3 347.547 2.847 10 0 EFAEHO CC[N@@H+](CCCN1CCN(C(C)C)CC1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812849990 1285476388 /nfs/dbraw/zinc/47/63/88/1285476388.db2.gz SKXIFBDQCIITJI-FPOVZHCZSA-N 1 3 347.547 2.847 10 0 EFAEHO CC[NH+](CC)Cc1cc([C@@H](C)NC2COCCOC2)ccc1OC ZINC000813879276 1286166374 /nfs/dbraw/zinc/16/63/74/1286166374.db2.gz KGAKZSMPSWXFBF-OAHLLOKOSA-N 1 3 336.476 2.603 10 0 EFAEHO CCN1CCN(c2ccc(NC(=O)C3([NH+](C)C)CCCC3)cc2)CC1 ZINC001135776869 1288357553 /nfs/dbraw/zinc/35/75/53/1288357553.db2.gz CLTSCOUOKQRLCO-UHFFFAOYSA-N 1 3 344.503 2.641 10 0 EFAEHO [NH3+][C@@H]1CC[C@H](CN2CCCC[C@H]2C(=O)Nc2ccc3c(c2)CCO3)C1 ZINC000903439523 1312682493 /nfs/dbraw/zinc/68/24/93/1312682493.db2.gz JKVHJMIJSCJIAP-LESCRADOSA-N 1 3 343.471 2.542 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CCC[C@@H](NC(=O)Cc2nc[nH]c2C)CC1 ZINC001273465824 1289595314 /nfs/dbraw/zinc/59/53/14/1289595314.db2.gz MIYJFWMNFAIXRJ-FUTAKVPZSA-N 1 3 332.492 2.978 10 0 EFAEHO CCC/C=C/CC[N@H+]1CCC[C@@H](NC(=O)Cc2nc[nH]c2C)CC1 ZINC001273465824 1289595323 /nfs/dbraw/zinc/59/53/23/1289595323.db2.gz MIYJFWMNFAIXRJ-FUTAKVPZSA-N 1 3 332.492 2.978 10 0 EFAEHO C[C@@H]1C[NH2+]C[C@H]1CN1CCC(Cc2nc(C3CCCC3)no2)CC1 ZINC000903464480 1312722575 /nfs/dbraw/zinc/72/25/75/1312722575.db2.gz PARRPDRXJMCTHE-PBHICJAKSA-N 1 3 332.492 2.837 10 0 EFAEHO C[C@H](c1cc2ccccc2o1)N(C)C(=O)CN1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903497313 1312773369 /nfs/dbraw/zinc/77/33/69/1312773369.db2.gz VKZWPMCVXGKCNF-BFYDXBDKSA-N 1 3 343.471 2.869 10 0 EFAEHO C[C@@H](c1cc2ccccc2o1)N(C)C(=O)CN1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903497314 1312773868 /nfs/dbraw/zinc/77/38/68/1312773868.db2.gz VKZWPMCVXGKCNF-HLLBOEOZSA-N 1 3 343.471 2.869 10 0 EFAEHO Fc1ccc(SCCN2C[C@H]3CC[C@@H](C2)N3C2CC[NH2+]CC2)cc1 ZINC000903506468 1312786545 /nfs/dbraw/zinc/78/65/45/1312786545.db2.gz VNUKKFMXCZDXPX-HDICACEKSA-N 1 3 349.519 2.818 10 0 EFAEHO CCC[NH+]1CCC(N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C)CC1 ZINC000721920184 1312800924 /nfs/dbraw/zinc/80/09/24/1312800924.db2.gz NTVIYWINAKOHAR-GOEBONIOSA-N 1 3 325.497 2.706 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+][C@@H]1CCc2ccccc21)N(C)C ZINC001276339636 1292949503 /nfs/dbraw/zinc/94/95/03/1292949503.db2.gz IHIIUANEWQDNRS-RTBURBONSA-N 1 3 331.504 2.698 10 0 EFAEHO CCCCC[NH+]1CC([C@H](C)NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001276432499 1313058636 /nfs/dbraw/zinc/05/86/36/1313058636.db2.gz NLYWYJLCQBAKPS-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H](CO[C@@H]1CCOC1)[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000886539029 1295005452 /nfs/dbraw/zinc/00/54/52/1295005452.db2.gz RSWSGBFSVUNNQQ-KPACCLEDSA-N 1 3 344.499 2.823 10 0 EFAEHO C[C@H](CO[C@@H]1CCOC1)[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000886539030 1295005970 /nfs/dbraw/zinc/00/59/70/1295005970.db2.gz RSWSGBFSVUNNQQ-SDZDHKAXSA-N 1 3 344.499 2.823 10 0 EFAEHO Brc1cnn(C2CCN(C[C@@H]3CCCC[NH2+]C3)CC2)c1 ZINC000903729413 1313129575 /nfs/dbraw/zinc/12/95/75/1313129575.db2.gz MMGGPTMQXNJLNU-CYBMUJFWSA-N 1 3 341.297 2.672 10 0 EFAEHO C[C@@H]([NH2+]C/C=C\CNC(=O)C1(N(C)C)CCC1)c1cccc(F)c1 ZINC001274089847 1295450871 /nfs/dbraw/zinc/45/08/71/1295450871.db2.gz SRISPKZAHQHNQR-FOSCPCJNSA-N 1 3 333.451 2.633 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C/C=C\CNC(=O)[C@H](C(C)C)N(C)C)c(C)c1 ZINC001274104708 1295456821 /nfs/dbraw/zinc/45/68/21/1295456821.db2.gz CGGJJCYWZWWKJL-GWQNQTGSSA-N 1 3 345.531 2.960 10 0 EFAEHO CN(CC(=O)N1CCC[C@H]1C[NH2+]CCCc1ccccc1)C1CCC1 ZINC001277866453 1313162002 /nfs/dbraw/zinc/16/20/02/1313162002.db2.gz UHWOFTHYXRVJOK-FQEVSTJZSA-N 1 3 343.515 2.684 10 0 EFAEHO O=C(NCCN1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1)C1CC1 ZINC001412960225 1296001329 /nfs/dbraw/zinc/00/13/29/1296001329.db2.gz DZEZMCUFMSGBBL-UHFFFAOYSA-N 1 3 341.499 2.501 10 0 EFAEHO O=C(NCCN1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1)C1CC1 ZINC001412960225 1296001342 /nfs/dbraw/zinc/00/13/42/1296001342.db2.gz DZEZMCUFMSGBBL-UHFFFAOYSA-N 1 3 341.499 2.501 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]C/C=C/CNC(=O)[C@H]2CCCN2C)cc1 ZINC001274262202 1296047567 /nfs/dbraw/zinc/04/75/67/1296047567.db2.gz BGFAELDQBCIOAX-DPZZJQGRSA-N 1 3 343.515 2.741 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[NH2+]CCc1ccc(C)cc1 ZINC001275048378 1296223705 /nfs/dbraw/zinc/22/37/05/1296223705.db2.gz NBYJCCINDXWGJG-FQEVSTJZSA-N 1 3 345.531 2.850 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]CCCc1ccccc1 ZINC001275415316 1296275755 /nfs/dbraw/zinc/27/57/55/1296275755.db2.gz OOQSZTDSESMYQZ-IRXDYDNUSA-N 1 3 331.504 2.586 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@]2(CC[N@H+](CCCCCF)C2)C1 ZINC001273847768 1296288185 /nfs/dbraw/zinc/28/81/85/1296288185.db2.gz CVOSJGYQNOPHJN-IBGZPJMESA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@]2(CC[N@@H+](CCCCCF)C2)C1 ZINC001273847768 1296288193 /nfs/dbraw/zinc/28/81/93/1296288193.db2.gz CVOSJGYQNOPHJN-IBGZPJMESA-N 1 3 341.515 2.781 10 0 EFAEHO COc1cc([C@@H](C)[NH2+]CC2(O)CCN(C)CC2)cc2ccccc21 ZINC000925117240 1296799533 /nfs/dbraw/zinc/79/95/33/1296799533.db2.gz OBJQQRARNVQORJ-OAHLLOKOSA-N 1 3 328.456 2.956 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H]2C[NH2+]CCC2CCCCC2)C1 ZINC001277941529 1313307210 /nfs/dbraw/zinc/30/72/10/1313307210.db2.gz PITRQHOBEWHCBN-MJGOQNOKSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccc(C(=O)NCCN[C@@H]2CC[NH2+]C[C@@H]2C2CCCC2)cc1F ZINC000925535364 1296849929 /nfs/dbraw/zinc/84/99/29/1296849929.db2.gz FLGZKYGJTXKNRR-IEBWSBKVSA-N 1 3 347.478 2.622 10 0 EFAEHO C(C[NH2+][C@@H]1CCNC[C@H]1C1CCCC1)Cc1nnc2n1CCCCC2 ZINC000925574633 1296858177 /nfs/dbraw/zinc/85/81/77/1296858177.db2.gz WGYKUNZZWVNGMH-ZWKOTPCHSA-N 1 3 345.535 2.695 10 0 EFAEHO CC1(C)C[C@@H](NCc2ccc(Cn3ccccc3=O)cc2)C[C@@H]([NH3+])C1 ZINC000925582990 1296860969 /nfs/dbraw/zinc/86/09/69/1296860969.db2.gz BTWOPDJFQWENMN-MOPGFXCFSA-N 1 3 339.483 2.892 10 0 EFAEHO c1nn(-c2ccccc2)nc1CNCC1CCN(c2cc[nH+]cc2)CC1 ZINC001201664249 1297008879 /nfs/dbraw/zinc/00/88/79/1297008879.db2.gz LQNQJLPPVKNPIS-UHFFFAOYSA-N 1 3 348.454 2.669 10 0 EFAEHO CN1CCC[C@H]1C(=O)NC/C=C/C[NH2+]CCCc1ccc(Cl)cc1 ZINC001273909506 1297114351 /nfs/dbraw/zinc/11/43/51/1297114351.db2.gz GVDNXSSOFFEVFW-DCKQQPRJSA-N 1 3 349.906 2.629 10 0 EFAEHO COCCN(C[C@@H](C[NH3+])Cc1cnn(C)c1C)[C@@H](C)c1ccccc1 ZINC000903885555 1313348333 /nfs/dbraw/zinc/34/83/33/1313348333.db2.gz LMBHLSWCBCBPED-ZWKOTPCHSA-N 1 3 344.503 2.556 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CCCC[C@@H]2Cc2ccccc2)cnn1C ZINC000903890189 1313359222 /nfs/dbraw/zinc/35/92/22/1313359222.db2.gz ZCHPJLBVULUDHP-TZIWHRDSSA-N 1 3 340.515 2.943 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CCCC[C@@H]2Cc2ccccc2)cnn1C ZINC000903890189 1313359225 /nfs/dbraw/zinc/35/92/25/1313359225.db2.gz ZCHPJLBVULUDHP-TZIWHRDSSA-N 1 3 340.515 2.943 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+]2CCCC[C@@H]2Cc2ccccc2)cnn1C ZINC000903890188 1313359755 /nfs/dbraw/zinc/35/97/55/1313359755.db2.gz ZCHPJLBVULUDHP-PZJWPPBQSA-N 1 3 340.515 2.943 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+]2CCCC[C@@H]2Cc2ccccc2)cnn1C ZINC000903890188 1313359759 /nfs/dbraw/zinc/35/97/59/1313359759.db2.gz ZCHPJLBVULUDHP-PZJWPPBQSA-N 1 3 340.515 2.943 10 0 EFAEHO CN(CCC1CCN(c2cc[nH+]cc2)CC1)Cc1cnn(CCF)c1 ZINC000930170323 1297245501 /nfs/dbraw/zinc/24/55/01/1297245501.db2.gz YYKPXNWRTGEWJC-UHFFFAOYSA-N 1 3 345.466 2.986 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CNC(C)(C)c2ccc(F)c(F)c2)cnn1C ZINC000903903627 1313384369 /nfs/dbraw/zinc/38/43/69/1313384369.db2.gz WIPXRWLKJCVZOP-ZDUSSCGKSA-N 1 3 336.430 2.649 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+]2CCC[C@]2(C)Cc2ccccc2)cnn1C ZINC000903914607 1313406265 /nfs/dbraw/zinc/40/62/65/1313406265.db2.gz JRTJNUNSOCVRNS-PZJWPPBQSA-N 1 3 340.515 2.943 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+]2CCC[C@]2(C)Cc2ccccc2)cnn1C ZINC000903914607 1313406268 /nfs/dbraw/zinc/40/62/68/1313406268.db2.gz JRTJNUNSOCVRNS-PZJWPPBQSA-N 1 3 340.515 2.943 10 0 EFAEHO Cc1c(C[C@@H](CN)C[NH2+]CC(C)(C)c2ccccc2C)cnn1C ZINC000903920213 1313418869 /nfs/dbraw/zinc/41/88/69/1313418869.db2.gz HFHIGZBRRLMVQV-KRWDZBQOSA-N 1 3 328.504 2.722 10 0 EFAEHO CC[C@H](C)C[NH2+][C@H]1C[C@@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001488774544 1297740823 /nfs/dbraw/zinc/74/08/23/1297740823.db2.gz VPSPFURCZJTJDR-YIOZNXECSA-N 1 3 341.515 2.729 10 0 EFAEHO Cc1c(C[C@@H](CN)C[NH2+]CC(C)(C)Cc2ccccc2)cnn1C ZINC000903927038 1313428977 /nfs/dbraw/zinc/42/89/77/1313428977.db2.gz WXEQQWAZNFDFRT-SFHVURJKSA-N 1 3 328.504 2.704 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN[C@H]2CCSc3ccccc32)cnn1C ZINC000903927600 1313429913 /nfs/dbraw/zinc/42/99/13/1313429913.db2.gz ZWXGMDBKARVKCN-YOEHRIQHSA-N 1 3 330.501 2.673 10 0 EFAEHO CCc1ccc(C(C)(C)C[NH2+]C[C@@H](CN)Cc2cnn(C)c2C)cc1 ZINC000903927485 1313429946 /nfs/dbraw/zinc/42/99/46/1313429946.db2.gz YSPSBPNCGFLZPK-GOSISDBHSA-N 1 3 342.531 2.976 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+](C)[C@H](C)Cc2cccc(F)c2)cnn1C ZINC000903929976 1313435061 /nfs/dbraw/zinc/43/50/61/1313435061.db2.gz PAILZJQKPVBEOM-PBHICJAKSA-N 1 3 332.467 2.548 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+](C)[C@H](C)Cc2cccc(F)c2)cnn1C ZINC000903929976 1313435064 /nfs/dbraw/zinc/43/50/64/1313435064.db2.gz PAILZJQKPVBEOM-PBHICJAKSA-N 1 3 332.467 2.548 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN(C)[C@H](C)Cc2cccc(F)c2)cnn1C ZINC000903929976 1313435068 /nfs/dbraw/zinc/43/50/68/1313435068.db2.gz PAILZJQKPVBEOM-PBHICJAKSA-N 1 3 332.467 2.548 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN2CCc3ccc(F)cc3[C@@H](C)C2)cnn1C ZINC000903931629 1313437424 /nfs/dbraw/zinc/43/74/24/1313437424.db2.gz GOIJUWQTPCYMIK-HOCLYGCPSA-N 1 3 344.478 2.647 10 0 EFAEHO CC[C@H](F)C[NH2+][C@@H]1CC[C@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001488955722 1297905273 /nfs/dbraw/zinc/90/52/73/1297905273.db2.gz TZCOGGTUESLIOU-HRCADAONSA-N 1 3 329.504 2.587 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[NH2+]CCCCC(F)(F)F)N(C)C ZINC001277979786 1313452630 /nfs/dbraw/zinc/45/26/30/1313452630.db2.gz BNEUVOXWMIQUFZ-UONOGXRCSA-N 1 3 337.430 2.640 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@H]2CCN(Cc3ccc(Cl)cc3)C[C@H]2C1 ZINC001489202396 1298116718 /nfs/dbraw/zinc/11/67/18/1298116718.db2.gz HTEAQDPIEPVZCT-SJORKVTESA-N 1 3 349.906 2.572 10 0 EFAEHO FC(F)(F)COc1ccc(C[NH2+]C[C@H]2CNCCC2(F)F)cc1 ZINC000903955059 1313480854 /nfs/dbraw/zinc/48/08/54/1313480854.db2.gz JTUDJCYBYUQDCU-GFCCVEGCSA-N 1 3 338.320 2.962 10 0 EFAEHO CCCOc1ccc(C[NH2+]C[C@H]2CNCCC2(F)F)cc1OC ZINC000903955621 1313483398 /nfs/dbraw/zinc/48/33/98/1313483398.db2.gz XRTMOXIEBKRSID-CQSZACIVSA-N 1 3 328.403 2.818 10 0 EFAEHO C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)NC[C@@H]1C[NH2+]C[C@H]1C ZINC000903968352 1313512375 /nfs/dbraw/zinc/51/23/75/1313512375.db2.gz UEAHOUWJRCVAGP-UPJWGTAASA-N 1 3 343.393 2.868 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@H](C)NC[C@@H]1C[NH2+]C[C@H]1C ZINC000903967766 1313510713 /nfs/dbraw/zinc/51/07/13/1313510713.db2.gz NRQKAMRTUFTFKS-AGIUHOORSA-N 1 3 339.867 2.511 10 0 EFAEHO CN(CC(=O)NCCC[N@H+](C)[C@@H]1CCc2c1cccc2F)C1CCC1 ZINC001490207216 1298600144 /nfs/dbraw/zinc/60/01/44/1298600144.db2.gz BGIOACJMJGEXTQ-LJQANCHMSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CC(=O)NCCC[N@@H+](C)[C@@H]1CCc2c1cccc2F)C1CCC1 ZINC001490207216 1298600155 /nfs/dbraw/zinc/60/01/55/1298600155.db2.gz BGIOACJMJGEXTQ-LJQANCHMSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CCCNC(=O)[C@@H]1CCC[C@H]2CCC[N@@H+]21)Cc1ccsc1 ZINC001490258005 1298689534 /nfs/dbraw/zinc/68/95/34/1298689534.db2.gz QOQQPVXKKFLGQB-IRXDYDNUSA-N 1 3 335.517 2.703 10 0 EFAEHO CN(CCCNC(=O)[C@@H]1CCC[C@H]2CCC[N@H+]21)Cc1ccsc1 ZINC001490258005 1298689538 /nfs/dbraw/zinc/68/95/38/1298689538.db2.gz QOQQPVXKKFLGQB-IRXDYDNUSA-N 1 3 335.517 2.703 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C ZINC001490271260 1298696571 /nfs/dbraw/zinc/69/65/71/1298696571.db2.gz RRRCBVBGAMBTSR-GOSISDBHSA-N 1 3 337.483 2.658 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+](C)CCCNC(=O)[C@@H](C(C)C)N(C)C ZINC001490271260 1298696578 /nfs/dbraw/zinc/69/65/78/1298696578.db2.gz RRRCBVBGAMBTSR-GOSISDBHSA-N 1 3 337.483 2.658 10 0 EFAEHO CN(C(=O)[C@H]1CCCN1C)C1CC[NH+](CCCCC(F)(F)F)CC1 ZINC001490401678 1298827414 /nfs/dbraw/zinc/82/74/14/1298827414.db2.gz COZZTXHVYAHVLZ-OAHLLOKOSA-N 1 3 349.441 2.736 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C1CC[NH+](CCCCCF)CC1)N(C)C ZINC001490420704 1298898128 /nfs/dbraw/zinc/89/81/28/1298898128.db2.gz CSRHGFYATBSFMC-KRWDZBQOSA-N 1 3 329.504 2.635 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CC[NH+]([C@H]2CCc3ccccc32)CC1 ZINC001490421218 1298898239 /nfs/dbraw/zinc/89/82/39/1298898239.db2.gz IEGDUZYNGDUXQQ-FQEVSTJZSA-N 1 3 343.515 2.939 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1ccccc1C)C1CC1 ZINC001490670685 1299069935 /nfs/dbraw/zinc/06/99/35/1299069935.db2.gz FLDZGKQVMBNBHR-WOJBJXKFSA-N 1 3 343.515 2.854 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](CNC(=O)[C@@H]2CCCN2C(C)C)C2CC2)c1 ZINC001490661528 1299103835 /nfs/dbraw/zinc/10/38/35/1299103835.db2.gz OENMNPAOPFNHHO-UXHICEINSA-N 1 3 343.515 2.852 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)CN2CC[C@@H](C)C2)C2CC2)cc1C ZINC001490708232 1299116904 /nfs/dbraw/zinc/11/69/04/1299116904.db2.gz AQJIXTOHLWFZPQ-FOIQADDNSA-N 1 3 343.515 2.630 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]([NH2+]CC2CCCCCC2)C2CC2)C1 ZINC001490710928 1299120115 /nfs/dbraw/zinc/12/01/15/1299120115.db2.gz VXINBSUCBGVFCF-LPHOPBHVSA-N 1 3 335.536 2.783 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]([NH2+]CC2CCC3(CC3)CC2)C2CC2)C1 ZINC001490711711 1299121104 /nfs/dbraw/zinc/12/11/04/1299121104.db2.gz ZWQSCOCIFKQJSE-QFBILLFUSA-N 1 3 347.547 2.783 10 0 EFAEHO Cc1ccc(CN[C@H](CNC(=O)[C@H]2CC[N@@H+](C)C2)C2CC2)c(Cl)c1 ZINC001490739728 1299175002 /nfs/dbraw/zinc/17/50/02/1299175002.db2.gz LAOVRKOTPOJFHX-FUHWJXTLSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1ccc(CN[C@H](CNC(=O)[C@H]2CC[N@H+](C)C2)C2CC2)c(Cl)c1 ZINC001490739728 1299175009 /nfs/dbraw/zinc/17/50/09/1299175009.db2.gz LAOVRKOTPOJFHX-FUHWJXTLSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C1CC1 ZINC001490740529 1299177669 /nfs/dbraw/zinc/17/76/69/1299177669.db2.gz DDAAITXMJBSGHZ-LPHOPBHVSA-N 1 3 331.504 2.881 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+]CC1CCC2(CC2)CC1)C1CC1 ZINC001490741171 1299179537 /nfs/dbraw/zinc/17/95/37/1299179537.db2.gz HTXROOJMEBSEMX-GOSISDBHSA-N 1 3 335.536 2.781 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H](C[N@H+](C)CCC2CC2)C1 ZINC001490781853 1299250909 /nfs/dbraw/zinc/25/09/09/1299250909.db2.gz ATSAEAQZZKFQJH-RBUKOAKNSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H](C[N@@H+](C)CCC2CC2)C1 ZINC001490781853 1299250913 /nfs/dbraw/zinc/25/09/13/1299250913.db2.gz ATSAEAQZZKFQJH-RBUKOAKNSA-N 1 3 335.536 2.831 10 0 EFAEHO CCOP(=O)(OCC)[C@@H](O)CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000851777789 1299387521 /nfs/dbraw/zinc/38/75/21/1299387521.db2.gz BVWOQUZEOHOCRB-JKSUJKDBSA-N 1 3 348.424 2.521 10 0 EFAEHO O=C(CN1CCC[C@@H](C2CC[NH2+]CC2)C1)NC1CCCCCCC1 ZINC000852753640 1299864334 /nfs/dbraw/zinc/86/43/34/1299864334.db2.gz FKTNQEMZJKHMSG-GOSISDBHSA-N 1 3 335.536 2.927 10 0 EFAEHO COc1ccc([C@@H]2CCNC[C@@H]2[NH2+][C@@H]2CCCc3n[nH]cc32)cc1 ZINC000854222981 1300476110 /nfs/dbraw/zinc/47/61/10/1300476110.db2.gz PXSYIZHAUWMPJH-WDYCEAGBSA-N 1 3 326.444 2.531 10 0 EFAEHO COc1ccc([C@@H]2CCNC[C@@H]2[NH2+][C@H]2CCCc3n[nH]cc32)cc1 ZINC000854222980 1300476307 /nfs/dbraw/zinc/47/63/07/1300476307.db2.gz PXSYIZHAUWMPJH-IEZWGBDMSA-N 1 3 326.444 2.531 10 0 EFAEHO Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)CC1CC[NH+](C)CC1 ZINC000854513308 1300602084 /nfs/dbraw/zinc/60/20/84/1300602084.db2.gz MOCGOONYZCQPFZ-UYAOXDASSA-N 1 3 341.499 2.861 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000855347122 1300924890 /nfs/dbraw/zinc/92/48/90/1300924890.db2.gz UMOOVBZQTIQWEP-DFQSSKMNSA-N 1 3 345.531 2.959 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000855347122 1300924894 /nfs/dbraw/zinc/92/48/94/1300924894.db2.gz UMOOVBZQTIQWEP-DFQSSKMNSA-N 1 3 345.531 2.959 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000855347124 1300925301 /nfs/dbraw/zinc/92/53/01/1300925301.db2.gz UMOOVBZQTIQWEP-SXLOBPIMSA-N 1 3 345.531 2.959 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000855347124 1300925309 /nfs/dbraw/zinc/92/53/09/1300925309.db2.gz UMOOVBZQTIQWEP-SXLOBPIMSA-N 1 3 345.531 2.959 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N[C@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC000855814801 1301130423 /nfs/dbraw/zinc/13/04/23/1301130423.db2.gz LBHCNWQOQVGSTD-KXBFYZLASA-N 1 3 339.499 2.722 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N[C@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC000855814801 1301130427 /nfs/dbraw/zinc/13/04/27/1301130427.db2.gz LBHCNWQOQVGSTD-KXBFYZLASA-N 1 3 339.499 2.722 10 0 EFAEHO CO[C@H]1CN(C)[C@](C)(COC(=O)c2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000861350938 1302097423 /nfs/dbraw/zinc/09/74/23/1302097423.db2.gz GEIMFJIAIHCHSL-QUCCMNQESA-N 1 3 346.471 2.548 10 0 EFAEHO CC(C)(C(=O)N[C@@H](C[NH2+]CCCF)C1CCCC1)N1CCCCC1 ZINC001278241837 1313832535 /nfs/dbraw/zinc/83/25/35/1313832535.db2.gz SAZWMHOUNJRFCN-KRWDZBQOSA-N 1 3 341.515 2.875 10 0 EFAEHO CCOC(=O)c1cccc(CN2CCCC3(CC[NH+](C)CC3)C2)n1 ZINC000862352748 1302342405 /nfs/dbraw/zinc/34/24/05/1302342405.db2.gz MAUARUKUXCSGBQ-UHFFFAOYSA-N 1 3 331.460 2.566 10 0 EFAEHO Cc1c(C[NH2+]CC2(O)CCN(Cc3ccccc3)CC2)ccnc1F ZINC000862395111 1302365564 /nfs/dbraw/zinc/36/55/64/1302365564.db2.gz VXIBLSHMBNPOEG-UHFFFAOYSA-N 1 3 343.446 2.646 10 0 EFAEHO C[C@@H](CCCCN1C(=O)c2ccccc2C1=O)N[C@H]1CC[C@@H](C)[NH2+]C1 ZINC000863548288 1302645777 /nfs/dbraw/zinc/64/57/77/1302645777.db2.gz WSUMXUHXZFGWPY-PMPSAXMXSA-N 1 3 343.471 2.572 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+]C/C=C\Cl)C1CCCC1)CC(C)(C)C ZINC001278275385 1313863414 /nfs/dbraw/zinc/86/34/14/1313863414.db2.gz PDZNMDALCPUBDD-BSDKJSHOSA-N 1 3 343.943 2.981 10 0 EFAEHO CCC[NH2+]C[C@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CCCC1 ZINC001278276900 1313864855 /nfs/dbraw/zinc/86/48/55/1313864855.db2.gz ZCYPFQGHDVXVEN-QFBILLFUSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)(C)OC(=O)N1CCC[C@@H]1CNC1CC[NH+](C2CCC2)CC1 ZINC000865434631 1303255500 /nfs/dbraw/zinc/25/55/00/1303255500.db2.gz NPYGIVXSMHJNGG-QGZVFWFLSA-N 1 3 337.508 2.992 10 0 EFAEHO CN1CCCC[C@@H](C[NH2+]CC23CC(C2)CN3C(=O)OC(C)(C)C)C1 ZINC000865640141 1303344489 /nfs/dbraw/zinc/34/44/89/1303344489.db2.gz DLMKJIKTGQYEJJ-LYGPFTKASA-N 1 3 337.508 2.707 10 0 EFAEHO CC(=O)c1ccc(NC(=O)CCN2CC[C@@](C[NH3+])(C(C)(C)C)C2)cc1 ZINC000866703816 1303757407 /nfs/dbraw/zinc/75/74/07/1303757407.db2.gz KSONYWQRXXZENV-FQEVSTJZSA-N 1 3 345.487 2.915 10 0 EFAEHO COc1cccc(NC(=O)CC[N@@H+]2CC[C@@](CN)(C(C)(C)C)C2)c1 ZINC000866705537 1303760813 /nfs/dbraw/zinc/76/08/13/1303760813.db2.gz BYCBGMWDWRWBCC-IBGZPJMESA-N 1 3 333.476 2.721 10 0 EFAEHO COc1cccc(NC(=O)CC[N@H+]2CC[C@@](CN)(C(C)(C)C)C2)c1 ZINC000866705537 1303760816 /nfs/dbraw/zinc/76/08/16/1303760816.db2.gz BYCBGMWDWRWBCC-IBGZPJMESA-N 1 3 333.476 2.721 10 0 EFAEHO CN(C)C[C@@H](NC(=O)CCC12CC(C1)C[NH2+]2)c1ccc(Cl)cc1 ZINC000870924920 1305687939 /nfs/dbraw/zinc/68/79/39/1305687939.db2.gz CWOZPSWWSXFNCF-CRPOECCBSA-N 1 3 335.879 2.591 10 0 EFAEHO C[NH+](C)C1(C)CCC(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC000871360348 1306020968 /nfs/dbraw/zinc/02/09/68/1306020968.db2.gz AZZBUQQSVSDCSE-UYJHFMRCSA-N 1 3 327.488 2.578 10 0 EFAEHO CCCCCC[N@@H+]1C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001276624656 1314118070 /nfs/dbraw/zinc/11/80/70/1314118070.db2.gz LPZZKDFYNNPNBS-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CCCCCC[N@H+]1C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001276624656 1314118074 /nfs/dbraw/zinc/11/80/74/1314118074.db2.gz LPZZKDFYNNPNBS-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1cc(C)cc([C@H](O)CN2CCC(O)(C[NH+]3CCCCC3)CC2)c1 ZINC001413080165 1307618827 /nfs/dbraw/zinc/61/88/27/1307618827.db2.gz RNCAHRCDOJVVDD-HXUWFJFHSA-N 1 3 346.515 2.650 10 0 EFAEHO CN(CC(=O)NCCC[N@@H+](C)CC1CC(C)(C)C1)CC(C)(C)C ZINC001265037237 1316697026 /nfs/dbraw/zinc/69/70/26/1316697026.db2.gz SDAPGRULDVNTSU-UHFFFAOYSA-N 1 3 325.541 2.839 10 0 EFAEHO O=C(NCCCN1CCc2ccccc2C1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC000900160288 1307727782 /nfs/dbraw/zinc/72/77/82/1307727782.db2.gz UACXJEPQHCDHSE-PMACEKPBSA-N 1 3 341.499 2.568 10 0 EFAEHO O=C(NCCCN1CCc2ccccc2C1)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC000900160288 1307727785 /nfs/dbraw/zinc/72/77/85/1307727785.db2.gz UACXJEPQHCDHSE-PMACEKPBSA-N 1 3 341.499 2.568 10 0 EFAEHO O=C(NCCCN1CCc2ccccc2C1)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC000900160292 1307728039 /nfs/dbraw/zinc/72/80/39/1307728039.db2.gz UACXJEPQHCDHSE-VQTJNVASSA-N 1 3 341.499 2.568 10 0 EFAEHO O=C(NCCCN1CCc2ccccc2C1)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC000900160292 1307728042 /nfs/dbraw/zinc/72/80/42/1307728042.db2.gz UACXJEPQHCDHSE-VQTJNVASSA-N 1 3 341.499 2.568 10 0 EFAEHO O=C(c1ccc(NC2=NCCC2)cc1)N1CCC[C@@H]1C[NH+]1CCCC1 ZINC000900443353 1308166583 /nfs/dbraw/zinc/16/65/83/1308166583.db2.gz VVLQSAHJDDNWJI-GOSISDBHSA-N 1 3 340.471 2.991 10 0 EFAEHO CC(C)[N@@H+]1CCCN(C(=O)c2ccc(NC3=NCCC3)cc2)CC1 ZINC000900539239 1308280604 /nfs/dbraw/zinc/28/06/04/1308280604.db2.gz AFYDAECMDFQUNK-UHFFFAOYSA-N 1 3 328.460 2.847 10 0 EFAEHO CC(C)[N@H+]1CCCN(C(=O)c2ccc(NC3=NCCC3)cc2)CC1 ZINC000900539239 1308280606 /nfs/dbraw/zinc/28/06/06/1308280606.db2.gz AFYDAECMDFQUNK-UHFFFAOYSA-N 1 3 328.460 2.847 10 0 EFAEHO O=C(c1ccc(NC2=NCCC2)cc1)N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000900619386 1308420101 /nfs/dbraw/zinc/42/01/01/1308420101.db2.gz SAUBIXMOSCJSRF-GOSISDBHSA-N 1 3 340.471 2.991 10 0 EFAEHO CN(C[C@@H]1CCC[N@H+](C)C1)C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000900725710 1308587198 /nfs/dbraw/zinc/58/71/98/1308587198.db2.gz NEXNOXDQBZPFSV-OAHLLOKOSA-N 1 3 328.460 2.705 10 0 EFAEHO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000900725710 1308587200 /nfs/dbraw/zinc/58/72/00/1308587200.db2.gz NEXNOXDQBZPFSV-OAHLLOKOSA-N 1 3 328.460 2.705 10 0 EFAEHO Nc1ccc(CN2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cn1 ZINC000380986080 1310084323 /nfs/dbraw/zinc/08/43/23/1310084323.db2.gz ZWFZUKRVHJPTFN-UHFFFAOYSA-N 1 3 336.483 2.982 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]CC/C=C\c2ccccc2)C1 ZINC001491079434 1311158582 /nfs/dbraw/zinc/15/85/82/1311158582.db2.gz BGEPTOUPKKZKJR-DVYMXEPTSA-N 1 3 329.488 2.667 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]C/C=C/c2ccccc2)C1)N(C)C ZINC001277075008 1311578773 /nfs/dbraw/zinc/57/87/73/1311578773.db2.gz QTPYTAIZOKXZIH-RWDIZSIFSA-N 1 3 343.515 2.770 10 0 EFAEHO CCN1CCN([C@@H](C)C[NH2+][C@H](C)c2cccc(-n3ccnc3)c2)CC1 ZINC000902747432 1312073206 /nfs/dbraw/zinc/07/32/06/1312073206.db2.gz UKQOSBPGEIWMCC-ZWKOTPCHSA-N 1 3 341.503 2.549 10 0 EFAEHO CN1CCC(O)(C[NH2+][C@@H](CCc2cccnc2)c2ccccc2)CC1 ZINC000902814068 1312128146 /nfs/dbraw/zinc/12/81/46/1312128146.db2.gz MCXNIGRISPLMSZ-FQEVSTJZSA-N 1 3 339.483 2.802 10 0 EFAEHO CC/C=C/CC[NH+]1CCC2(CCN(C(=O)[C@@H](CC)N(C)C)C2)CC1 ZINC001277495918 1312453284 /nfs/dbraw/zinc/45/32/84/1312453284.db2.gz KWSHXYNNFGISBL-LKGOPFMKSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CCCC2CCC2)CN1C(=O)CN1CCC(C)CC1 ZINC001278411929 1314512000 /nfs/dbraw/zinc/51/20/00/1314512000.db2.gz VRQYLIKWGQFXHN-MJGOQNOKSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@](C)(C[NH2+]CCc2ccc(C)cc2)C1 ZINC001278571631 1315213620 /nfs/dbraw/zinc/21/36/20/1315213620.db2.gz HZEPZHTVUIPKAE-NRFANRHFSA-N 1 3 345.531 2.708 10 0 EFAEHO CC(C)=CC[NH2+]C[C@H]1CN(C(=O)CN(C)C(C)C)C[C@H]1C(F)(F)F ZINC001278703351 1315580467 /nfs/dbraw/zinc/58/04/67/1315580467.db2.gz GZAGDKGQRVHJRP-LSDHHAIUSA-N 1 3 349.441 2.519 10 0 EFAEHO CC(C)CCC[NH2+]CC[C@@H]1[C@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001263954744 1316574678 /nfs/dbraw/zinc/57/46/78/1316574678.db2.gz BORJIXVZWVVKRE-SJLPKXTDSA-N 1 3 334.508 2.995 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001264100788 1316589304 /nfs/dbraw/zinc/58/93/04/1316589304.db2.gz HRKZGYBDPVAAKZ-ZSQQTYLHSA-N 1 3 335.536 2.853 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001264100788 1316589306 /nfs/dbraw/zinc/58/93/06/1316589306.db2.gz HRKZGYBDPVAAKZ-ZSQQTYLHSA-N 1 3 335.536 2.853 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@@H+]2CCC2=CCCCC2)C1 ZINC001264373636 1316608384 /nfs/dbraw/zinc/60/83/84/1316608384.db2.gz XTQRXPBHWKVNJE-IEBWSBKVSA-N 1 3 333.520 2.751 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@H+]2CCC2=CCCCC2)C1 ZINC001264373636 1316608386 /nfs/dbraw/zinc/60/83/86/1316608386.db2.gz XTQRXPBHWKVNJE-IEBWSBKVSA-N 1 3 333.520 2.751 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[N@H+](C)Cc1ccc(Cl)c(F)c1 ZINC001265020992 1316691662 /nfs/dbraw/zinc/69/16/62/1316691662.db2.gz BMTMRUVIFXZFGH-MRXNPFEDSA-N 1 3 341.858 2.511 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC001265020992 1316691663 /nfs/dbraw/zinc/69/16/63/1316691663.db2.gz BMTMRUVIFXZFGH-MRXNPFEDSA-N 1 3 341.858 2.511 10 0 EFAEHO CN(CC(=O)NCCC[N@H+](C)CC1CC(C)(C)C1)CC(C)(C)C ZINC001265037237 1316697024 /nfs/dbraw/zinc/69/70/24/1316697024.db2.gz SDAPGRULDVNTSU-UHFFFAOYSA-N 1 3 325.541 2.839 10 0 EFAEHO C[C@@H]([NH2+]CCCC1CCC1)[C@H]1CCCCN1C(=O)Cc1c[nH]cn1 ZINC001265088208 1316716887 /nfs/dbraw/zinc/71/68/87/1316716887.db2.gz AUFHOSKDJCNJGQ-CRAIPNDOSA-N 1 3 332.492 2.892 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](CC)[C@H]1CCc2ccc(F)cc21)N(C)C ZINC001265143084 1316736003 /nfs/dbraw/zinc/73/60/03/1316736003.db2.gz WUDSUNDWOYJWLQ-MOPGFXCFSA-N 1 3 349.494 2.981 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](CC)[C@H]1CCc2ccc(F)cc21)N(C)C ZINC001265143084 1316736006 /nfs/dbraw/zinc/73/60/06/1316736006.db2.gz WUDSUNDWOYJWLQ-MOPGFXCFSA-N 1 3 349.494 2.981 10 0 EFAEHO CCN(CCCNC(=O)[C@H]1CC[N@H+](C)C1)[C@@H](C)c1ccccc1F ZINC001265146424 1316738045 /nfs/dbraw/zinc/73/80/45/1316738045.db2.gz XUUGRMQMFWQYBR-HOTGVXAUSA-N 1 3 335.467 2.667 10 0 EFAEHO CCN(CCCNC(=O)[C@H]1CC[N@@H+](C)C1)[C@@H](C)c1ccccc1F ZINC001265146424 1316738048 /nfs/dbraw/zinc/73/80/48/1316738048.db2.gz XUUGRMQMFWQYBR-HOTGVXAUSA-N 1 3 335.467 2.667 10 0 EFAEHO O=C(N[C@@H]1CCCN(CCCCCF)C1)C12CCC[NH+](CCC1)C2 ZINC001265215958 1316755167 /nfs/dbraw/zinc/75/51/67/1316755167.db2.gz FJZGFOLRKQUWIA-QGZVFWFLSA-N 1 3 339.499 2.583 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CC/C=C\c2ccccc2)C1 ZINC001265459708 1316808664 /nfs/dbraw/zinc/80/86/64/1316808664.db2.gz KGAALTMMLREAJZ-ABMFHFBKSA-N 1 3 329.488 2.621 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N[C@H]2C[C@@H]([NH2+]CCCCCF)C2)C1 ZINC001265558141 1316825588 /nfs/dbraw/zinc/82/55/88/1316825588.db2.gz OBRMGOJZCZQUBT-DAYGRLMNSA-N 1 3 345.478 2.576 10 0 EFAEHO CC(C)CCC[NH2+]C[C@@H]1CCCCN1C(=O)[C@H](C(C)C)N(C)C ZINC001265688040 1316854618 /nfs/dbraw/zinc/85/46/18/1316854618.db2.gz LGLZTPDQHOZRBK-ROUUACIJSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CCC[NH2+]C[C@@H]1CCCCN1C(=O)[C@@H](C(C)C)N(C)C ZINC001265688041 1316854697 /nfs/dbraw/zinc/85/46/97/1316854697.db2.gz LGLZTPDQHOZRBK-ZWKOTPCHSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCCCC(F)(F)F ZINC001265808311 1316880602 /nfs/dbraw/zinc/88/06/02/1316880602.db2.gz AYJAUZFUIKTTJC-ZDUSSCGKSA-N 1 3 337.430 2.688 10 0 EFAEHO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)CCCNC(=O)[C@@H]1CCCN1C ZINC001265815227 1316881827 /nfs/dbraw/zinc/88/18/27/1316881827.db2.gz SLPSFBOLLGBOIB-GUYCJALGSA-N 1 3 339.430 2.558 10 0 EFAEHO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)CCCNC(=O)[C@@H]1CCCN1C ZINC001265815227 1316881830 /nfs/dbraw/zinc/88/18/30/1316881830.db2.gz SLPSFBOLLGBOIB-GUYCJALGSA-N 1 3 339.430 2.558 10 0 EFAEHO CN(CCCNC(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1)Cc1ccsc1 ZINC001265954792 1316927373 /nfs/dbraw/zinc/92/73/73/1316927373.db2.gz WLBIRHRTTBHXHZ-DLBZAZTESA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001265978086 1316935797 /nfs/dbraw/zinc/93/57/97/1316935797.db2.gz AFARVXJESFCXPG-SFHVURJKSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001265978086 1316935800 /nfs/dbraw/zinc/93/58/00/1316935800.db2.gz AFARVXJESFCXPG-SFHVURJKSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](C[NH2+]CCC2=CCCCC2)C1)N(C)C ZINC001265986992 1316939815 /nfs/dbraw/zinc/93/98/15/1316939815.db2.gz QWCZVXAPOUQOQB-OALUTQOASA-N 1 3 335.536 2.901 10 0 EFAEHO CC[C@H](C(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1)[NH+](CC)CC ZINC001368171894 1339234247 /nfs/dbraw/zinc/23/42/47/1339234247.db2.gz HSPITLOLDZJANY-QUCCMNQESA-N 1 3 331.504 2.888 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](CC)[C@H]1CCc2c1cccc2F)N(C)C ZINC001266100867 1317035207 /nfs/dbraw/zinc/03/52/07/1317035207.db2.gz LJAFXUUUBJXFQB-MOPGFXCFSA-N 1 3 349.494 2.981 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](CC)[C@H]1CCc2c1cccc2F)N(C)C ZINC001266100867 1317035214 /nfs/dbraw/zinc/03/52/14/1317035214.db2.gz LJAFXUUUBJXFQB-MOPGFXCFSA-N 1 3 349.494 2.981 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](CC)[C@@H]1CCc2c1cccc2F)N(C)C ZINC001266100870 1317036333 /nfs/dbraw/zinc/03/63/33/1317036333.db2.gz LJAFXUUUBJXFQB-RTBURBONSA-N 1 3 349.494 2.981 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](CC)[C@@H]1CCc2c1cccc2F)N(C)C ZINC001266100870 1317036342 /nfs/dbraw/zinc/03/63/42/1317036342.db2.gz LJAFXUUUBJXFQB-RTBURBONSA-N 1 3 349.494 2.981 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1CC1CC(F)(F)C1)N(C)C ZINC001266242157 1317191888 /nfs/dbraw/zinc/19/18/88/1317191888.db2.gz ZVCDRIIIACAIRT-HZPDHXFCSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@@H]1CCC[N@H+]1CC1CC(F)(F)C1)N(C)C ZINC001266242157 1317191892 /nfs/dbraw/zinc/19/18/92/1317191892.db2.gz ZVCDRIIIACAIRT-HZPDHXFCSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(CC[NH2+]CC2CCC2)Cc2ccccc2)C1 ZINC001279318851 1317235985 /nfs/dbraw/zinc/23/59/85/1317235985.db2.gz RILTZVCJNYPLAC-SFHVURJKSA-N 1 3 343.515 2.747 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+](Cc2c(C)cccc2C)CC1)N(C)C ZINC001279675284 1317354379 /nfs/dbraw/zinc/35/43/79/1317354379.db2.gz CRSNPOWUANNEQW-HXUWFJFHSA-N 1 3 343.515 2.892 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+](Cc2c(C)cccc2C)CC1)N(C)C ZINC001279675284 1317354389 /nfs/dbraw/zinc/35/43/89/1317354389.db2.gz CRSNPOWUANNEQW-HXUWFJFHSA-N 1 3 343.515 2.892 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)cc1C ZINC001279999379 1317433499 /nfs/dbraw/zinc/43/34/99/1317433499.db2.gz JSONPDDCGWOKLM-ICSRJNTNSA-N 1 3 343.515 2.726 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CC[C@@H](CC[NH2+]Cc2cccc(Cl)c2)C1 ZINC001280207283 1317476468 /nfs/dbraw/zinc/47/64/68/1317476468.db2.gz IEHOPTGYTLTKNB-CQSZACIVSA-N 1 3 346.862 2.634 10 0 EFAEHO CN(C[C@H]1CCN1C[C@@H]1CCC(F)(F)C1)C(=O)CCCC[NH+](C)C ZINC001316602579 1317497926 /nfs/dbraw/zinc/49/79/26/1317497926.db2.gz ANDTXBPMFPHZCA-HZPDHXFCSA-N 1 3 345.478 2.686 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CC[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001280297172 1317499945 /nfs/dbraw/zinc/49/99/45/1317499945.db2.gz RXDCOGUQBQPFAG-KRWDZBQOSA-N 1 3 347.478 2.558 10 0 EFAEHO CN(CC(=O)N1CCC[C@H](CC[NH2+]CCC2CC2)C1)CC(C)(C)C ZINC001318834426 1328716500 /nfs/dbraw/zinc/71/65/00/1328716500.db2.gz DCVMMSSASXFFRA-GOSISDBHSA-N 1 3 337.552 2.983 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(CC[NH2+]CCC2CCCC2)CC1 ZINC001318875038 1328729132 /nfs/dbraw/zinc/72/91/32/1328729132.db2.gz PAMJSNUKMIBWEP-IBGZPJMESA-N 1 3 335.536 2.879 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(CC[NH2+]CCc2cccs2)CC1 ZINC001318875054 1328729791 /nfs/dbraw/zinc/72/97/91/1328729791.db2.gz PCAYWMAKZKWKLM-SFHVURJKSA-N 1 3 349.544 2.603 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001281088439 1318011746 /nfs/dbraw/zinc/01/17/46/1318011746.db2.gz RTRJOQLQKLNWBV-LLHWWHOWSA-N 1 3 330.476 2.623 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1c[nH]cn1)C2 ZINC001281088439 1318011753 /nfs/dbraw/zinc/01/17/53/1318011753.db2.gz RTRJOQLQKLNWBV-LLHWWHOWSA-N 1 3 330.476 2.623 10 0 EFAEHO CN(CC(=O)N1CCC(CC[NH2+]CC2CCC2)CC1)CC(C)(C)C ZINC001318914553 1328739606 /nfs/dbraw/zinc/73/96/06/1328739606.db2.gz GEEMWXLVIPGSKO-UHFFFAOYSA-N 1 3 337.552 2.983 10 0 EFAEHO CC1CCN(CC(=O)N2CCC(CC[NH2+]C/C=C\Cl)CC2)CC1 ZINC001318926022 1328742833 /nfs/dbraw/zinc/74/28/33/1328742833.db2.gz GTNKBOODRFFICG-WAPJZHGLSA-N 1 3 341.927 2.689 10 0 EFAEHO C[C@H](F)CC[NH2+]Cc1ccc(CNC(=O)C2(N(C)C)CCC2)cc1 ZINC001318995866 1328758879 /nfs/dbraw/zinc/75/88/79/1328758879.db2.gz JLWUXILQYDRUJA-HNNXBMFYSA-N 1 3 335.467 2.625 10 0 EFAEHO CC(C)=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H](C(C)C)[NH+](C)C ZINC001281912211 1318620421 /nfs/dbraw/zinc/62/04/21/1318620421.db2.gz HFQYMECRIGKTBN-AQNXPRMDSA-N 1 3 343.515 2.911 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001282057346 1318689152 /nfs/dbraw/zinc/68/91/52/1318689152.db2.gz IYTCZAVQTBJFGA-SOOZIIFRSA-N 1 3 329.488 2.524 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[NH2+]CCCc1cccc(C)c1)N(C)C ZINC001319124774 1328784584 /nfs/dbraw/zinc/78/45/84/1328784584.db2.gz RSAYMHMCOOLGBB-WOJBJXKFSA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@@H]([NH2+]CCCc1cccc(F)c1)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001282139275 1318746643 /nfs/dbraw/zinc/74/66/43/1318746643.db2.gz BCXPWEHDYHUYQJ-CVEARBPZSA-N 1 3 349.494 2.725 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]CCc1cccs1 ZINC001319225180 1328813539 /nfs/dbraw/zinc/81/35/39/1328813539.db2.gz MWASIXXBSRVZKD-HNNXBMFYSA-N 1 3 337.533 2.507 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H]1C[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001283110242 1319334503 /nfs/dbraw/zinc/33/45/03/1319334503.db2.gz BFHVCGMPMLNHDU-ZVZYQTTQSA-N 1 3 335.467 2.594 10 0 EFAEHO C[C@@H](CN(C)C(=O)Cc1c[nH]cn1)[NH2+]CCCc1ccc(Cl)cc1 ZINC001283679184 1319951575 /nfs/dbraw/zinc/95/15/75/1319951575.db2.gz KHNYSAHSELZYKX-AWEZNQCLSA-N 1 3 348.878 2.675 10 0 EFAEHO CCC/C=C/CC[NH+]1CC2(C1)CCN(C(=O)[C@H](CC)N(C)C)CC2 ZINC001319405768 1328874856 /nfs/dbraw/zinc/87/48/56/1328874856.db2.gz ZPRXHYOQPBQTJE-BLGFXRMMSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN3CCC(C)CC3)C[C@H]21 ZINC001284095291 1320190183 /nfs/dbraw/zinc/19/01/83/1320190183.db2.gz FSRYIDGJSDGGMD-GUDVDZBRSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001316633689 1320439594 /nfs/dbraw/zinc/43/95/94/1320439594.db2.gz PHMMQWNJZSKAOF-ULQDDVLXSA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C[NH2+]CCCF)C(C)(C)C)N1CCCCC1 ZINC001284652262 1320457979 /nfs/dbraw/zinc/45/79/79/1320457979.db2.gz HCFSMINMKUDZBP-IAGOWNOFSA-N 1 3 343.531 2.977 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C[NH2+]CCCF)C(C)(C)C)N1CCCCC1 ZINC001284652263 1320458060 /nfs/dbraw/zinc/45/80/60/1320458060.db2.gz HCFSMINMKUDZBP-IRXDYDNUSA-N 1 3 343.531 2.977 10 0 EFAEHO CC/C=C\CC[NH+]1CCC([C@@H](C)NC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001284699936 1320481441 /nfs/dbraw/zinc/48/14/41/1320481441.db2.gz LXVKRTLOVNEXEQ-OSFIAYCASA-N 1 3 335.536 2.901 10 0 EFAEHO CCC[N@H+](C)CCC(=O)NCC1=CCN(Cc2cccc(C)c2)CC1 ZINC001284976349 1320626530 /nfs/dbraw/zinc/62/65/30/1320626530.db2.gz DYFRILWXCRSHPU-UHFFFAOYSA-N 1 3 343.515 2.975 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)NCC1=CCN(Cc2cccc(C)c2)CC1 ZINC001284976349 1320626532 /nfs/dbraw/zinc/62/65/32/1320626532.db2.gz DYFRILWXCRSHPU-UHFFFAOYSA-N 1 3 343.515 2.975 10 0 EFAEHO CCc1ccc(C[N@H+]2CC=C(CNC(=O)[C@@H](CC)N(C)C)CC2)cc1 ZINC001284976977 1320626586 /nfs/dbraw/zinc/62/65/86/1320626586.db2.gz PIDFRKRSZNKLEI-HXUWFJFHSA-N 1 3 343.515 2.838 10 0 EFAEHO CCc1ccc(C[N@@H+]2CC=C(CNC(=O)[C@@H](CC)N(C)C)CC2)cc1 ZINC001284976977 1320626592 /nfs/dbraw/zinc/62/65/92/1320626592.db2.gz PIDFRKRSZNKLEI-HXUWFJFHSA-N 1 3 343.515 2.838 10 0 EFAEHO CC(C)=CC[NH2+][C@H]1C[C@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001316636938 1320652916 /nfs/dbraw/zinc/65/29/16/1320652916.db2.gz SHNZMRXNLBMIMK-GPMSIDNRSA-N 1 3 339.499 2.650 10 0 EFAEHO Cc1ccc(CCC[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001319533925 1328910972 /nfs/dbraw/zinc/91/09/72/1328910972.db2.gz LJWJOPYMIDRUEC-OALUTQOASA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)C[C@H](CNCCF)NC(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001319609465 1328929286 /nfs/dbraw/zinc/92/92/86/1328929286.db2.gz MVQJSWAREJTNAH-IAGOWNOFSA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)C[C@H](CNCCF)NC(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001319609465 1328929290 /nfs/dbraw/zinc/92/92/90/1328929290.db2.gz MVQJSWAREJTNAH-IAGOWNOFSA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C[NH2+]C/C=C\Cl)C1CCCCC1)N(C)C ZINC001319658329 1328941287 /nfs/dbraw/zinc/94/12/87/1328941287.db2.gz YFHDVFRSCLDKHM-GJGKEFFFSA-N 1 3 343.943 2.980 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+]CCF)C1CCCCC1)CC(C)(C)C ZINC001319659147 1328941312 /nfs/dbraw/zinc/94/13/12/1328941312.db2.gz HOOKVQNXEBHXDX-INIZCTEOSA-N 1 3 329.504 2.589 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCCC[C@H]1CC[NH2+]CC1CC(C)(C)C1 ZINC001319735965 1328968660 /nfs/dbraw/zinc/96/86/60/1328968660.db2.gz LGVGDYWSVPGYHY-ROUUACIJSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@H]1CC[NH2+]CCc1ccccc1)N(C)C ZINC001319787633 1328989040 /nfs/dbraw/zinc/98/90/40/1328989040.db2.gz HDPZMHUGTWOJAF-VQTJNVASSA-N 1 3 345.531 2.930 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@@H]1CC[NH2+]Cc1cnccc1C)N(C)C ZINC001319789010 1328989785 /nfs/dbraw/zinc/98/97/85/1328989785.db2.gz VYDHPTIGJUYCFG-RTBURBONSA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@H]1CCCN(C(=O)CC[N@H+](C)C2CCCCC2)[C@H]1CNCCF ZINC001319854199 1329016115 /nfs/dbraw/zinc/01/61/15/1329016115.db2.gz PVJVQYSMDZENOP-WMZOPIPTSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H]1CCCN(C(=O)CC[N@@H+](C)C2CCCCC2)[C@H]1CNCCF ZINC001319854199 1329016120 /nfs/dbraw/zinc/01/61/20/1329016120.db2.gz PVJVQYSMDZENOP-WMZOPIPTSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCC[NH2+]C[C@@H]1[C@@H](C)CCCN1C(=O)CN(C)CC(C)(C)C ZINC001319862286 1329018690 /nfs/dbraw/zinc/01/86/90/1329018690.db2.gz UYTQVSZGZCHSMC-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H]1CCCN(C(=O)CCCC[NH+](C)C)[C@H]1CNCc1ccccn1 ZINC001319862560 1329018815 /nfs/dbraw/zinc/01/88/15/1329018815.db2.gz GVWKFEABRRRCMR-MJGOQNOKSA-N 1 3 346.519 2.530 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@@H]21 ZINC001320105261 1329080994 /nfs/dbraw/zinc/08/09/94/1329080994.db2.gz XSNQHLWKFRXFIL-MJGOQNOKSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCCCC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)C3CCC3)CC[C@@H]21 ZINC001320105261 1329080999 /nfs/dbraw/zinc/08/09/99/1329080999.db2.gz XSNQHLWKFRXFIL-MJGOQNOKSA-N 1 3 335.536 2.974 10 0 EFAEHO CC[C@@H]([NH2+]C[C@H]1CCN(C(=O)CN(C)C(C)C)C1)c1ccccc1 ZINC001491855986 1323950347 /nfs/dbraw/zinc/95/03/47/1323950347.db2.gz MYSJLJOXQLJKFG-IEBWSBKVSA-N 1 3 331.504 2.916 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001491856957 1323951672 /nfs/dbraw/zinc/95/16/72/1323951672.db2.gz WFXHHLFNDWPCCV-FUHWJXTLSA-N 1 3 335.467 2.548 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](C[NH2+]CCC2CCCCCC2)C1 ZINC001491857531 1323952930 /nfs/dbraw/zinc/95/29/30/1323952930.db2.gz UMEUVUFCIMXHOW-LJQANCHMSA-N 1 3 335.536 2.881 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]([NH2+]Cc2cccc(F)c2)C1 ZINC001491895180 1324004746 /nfs/dbraw/zinc/00/47/46/1324004746.db2.gz FBRWMVQUUOTLMJ-QZTJIDSGSA-N 1 3 335.467 2.683 10 0 EFAEHO CN(C/C=C\c1ccccc1)[C@@H]1CCCN(C(=O)CC[NH+](C)C)C1 ZINC001491946162 1324061739 /nfs/dbraw/zinc/06/17/39/1324061739.db2.gz APEVLEDRYWEJOA-KOTDBNOLSA-N 1 3 329.488 2.574 10 0 EFAEHO C[C@H](c1cccc(Cl)c1)N(C)CCNC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001492257318 1324383467 /nfs/dbraw/zinc/38/34/67/1324383467.db2.gz NOYPIRWYBRCFKA-RDTXWAMCSA-N 1 3 349.906 2.791 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1ccccc1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001320547251 1329159548 /nfs/dbraw/zinc/15/95/48/1329159548.db2.gz DEJLZJDAPZFFCI-JXFKEZNVSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)NCCCN(C)Cc1ccsc1 ZINC001316832337 1324607182 /nfs/dbraw/zinc/60/71/82/1324607182.db2.gz CBLPWYITICWOLT-KRWDZBQOSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)NCCCN(C)Cc1ccsc1 ZINC001316832337 1324607188 /nfs/dbraw/zinc/60/71/88/1324607188.db2.gz CBLPWYITICWOLT-KRWDZBQOSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)CC[NH2+]CCC(F)(F)F ZINC001320564795 1329166501 /nfs/dbraw/zinc/16/65/01/1329166501.db2.gz UMNQKTWOVTVHCZ-KBPBESRZSA-N 1 3 337.430 2.686 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CCCC[NH+](C)C)CCN1Cc1ccsc1 ZINC001316742305 1324725102 /nfs/dbraw/zinc/72/51/02/1324725102.db2.gz PLQKEJIEHLHFQN-DLBZAZTESA-N 1 3 337.533 2.949 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc2c(c1)CCC2)N(C)C ZINC001320614599 1329178449 /nfs/dbraw/zinc/17/84/49/1329178449.db2.gz NCDKMYRGXNDDSC-JXFKEZNVSA-N 1 3 345.531 2.746 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cc(F)ccc1Cl)N(C)C ZINC001320607030 1329176401 /nfs/dbraw/zinc/17/64/01/1329176401.db2.gz IGLFOHAXPRXHDB-LRDDRELGSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc2c(c1)CCC2)N(C)C ZINC001320614600 1329178471 /nfs/dbraw/zinc/17/84/71/1329178471.db2.gz NCDKMYRGXNDDSC-OXJNMPFZSA-N 1 3 345.531 2.746 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@H+](C)CCCCC(F)(F)F ZINC001317471673 1324771484 /nfs/dbraw/zinc/77/14/84/1324771484.db2.gz NPANTBAJMGBDKW-CQSZACIVSA-N 1 3 337.430 2.641 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[N@@H+](C)CCCCC(F)(F)F ZINC001317471673 1324771489 /nfs/dbraw/zinc/77/14/89/1324771489.db2.gz NPANTBAJMGBDKW-CQSZACIVSA-N 1 3 337.430 2.641 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CC[NH2+]Cc1ccccc1C1CC1 ZINC001320623532 1329179840 /nfs/dbraw/zinc/17/98/40/1329179840.db2.gz VBXATLVSRWVTBD-AWEZNQCLSA-N 1 3 340.471 2.823 10 0 EFAEHO CC[C@H](C)C[NH2+]CCC[C@@H]1[C@H](C)CCCN1C(=O)Cc1c[nH]cn1 ZINC001316715981 1325034782 /nfs/dbraw/zinc/03/47/82/1325034782.db2.gz ZOSBJOQJPNRQFG-LZLYRXPVSA-N 1 3 334.508 2.995 10 0 EFAEHO C[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)[C@H](C[NH2+]C/C=C\Cl)C1 ZINC001316704928 1325050206 /nfs/dbraw/zinc/05/02/06/1325050206.db2.gz RTQBVTVLDALVNE-ICFKLAHKSA-N 1 3 343.943 2.934 10 0 EFAEHO CC/C=C/CC[N@H+](C)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001316850635 1325218573 /nfs/dbraw/zinc/21/85/73/1325218573.db2.gz GRQVOEJMTITIFM-IHHMQQGQSA-N 1 3 341.515 2.993 10 0 EFAEHO CC/C=C/CC[N@@H+](C)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001316850635 1325218585 /nfs/dbraw/zinc/21/85/85/1325218585.db2.gz GRQVOEJMTITIFM-IHHMQQGQSA-N 1 3 341.515 2.993 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](C)Cc1c(C)cc(C)cc1C ZINC001316865523 1325234474 /nfs/dbraw/zinc/23/44/74/1325234474.db2.gz VNIWDKXDHPGNIU-UHFFFAOYSA-N 1 3 342.487 2.824 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](C)Cc1c(C)cc(C)cc1C ZINC001316865523 1325234481 /nfs/dbraw/zinc/23/44/81/1325234481.db2.gz VNIWDKXDHPGNIU-UHFFFAOYSA-N 1 3 342.487 2.824 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC001316869812 1325235652 /nfs/dbraw/zinc/23/56/52/1325235652.db2.gz KSRZVDRKOFWNRR-IBGZPJMESA-N 1 3 349.494 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC001316869812 1325235662 /nfs/dbraw/zinc/23/56/62/1325235662.db2.gz KSRZVDRKOFWNRR-IBGZPJMESA-N 1 3 349.494 2.981 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](C)CCc1ccc(C)cc1 ZINC001316871357 1325241241 /nfs/dbraw/zinc/24/12/41/1325241241.db2.gz WUDZWKWLSSQDOA-FQEVSTJZSA-N 1 3 345.531 2.850 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](C)CCc1ccc(C)cc1 ZINC001316871357 1325241248 /nfs/dbraw/zinc/24/12/48/1325241248.db2.gz WUDZWKWLSSQDOA-FQEVSTJZSA-N 1 3 345.531 2.850 10 0 EFAEHO CCN(CCCNC(=O)C[NH+]1[C@@H](C)CC[C@@H]1C)CCC(F)(F)F ZINC001316911676 1325330239 /nfs/dbraw/zinc/33/02/39/1325330239.db2.gz TWLXCDCMLPWVFI-KBPBESRZSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)=CC[NH2+][C@H](CNC(=O)c1cccc(CN(C)C)c1)C1CC1 ZINC001317032924 1325497623 /nfs/dbraw/zinc/49/76/23/1325497623.db2.gz DBJSFAACAHAFCI-LJQANCHMSA-N 1 3 329.488 2.812 10 0 EFAEHO CC/C=C\CC[NH2+][C@H]1C[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001317093259 1325556212 /nfs/dbraw/zinc/55/62/12/1325556212.db2.gz OPVAXHGXXUUROL-QOPIIRDPSA-N 1 3 329.488 2.955 10 0 EFAEHO CCN(CC[NH2+]CCC(C)C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001320839427 1329308672 /nfs/dbraw/zinc/30/86/72/1329308672.db2.gz CVTIVKKJDFJDLN-GOSISDBHSA-N 1 3 329.504 2.683 10 0 EFAEHO CCN(CC[NH2+]CCC(C)C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001320839428 1329308746 /nfs/dbraw/zinc/30/87/46/1329308746.db2.gz CVTIVKKJDFJDLN-SFHVURJKSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@@H]1CCC[C@@H](CC[NH2+]C/C=C\CNC(=O)C2(N(C)C)CCC2)C1 ZINC001321091252 1329341728 /nfs/dbraw/zinc/34/17/28/1329341728.db2.gz HLZDJDTZUBIZMP-KKSLTYSGSA-N 1 3 335.536 2.949 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C/C=C/CNC(=O)CN(C)C2CCC2)c1 ZINC001321096444 1329342784 /nfs/dbraw/zinc/34/27/84/1329342784.db2.gz PGBBLGZAVTVQIE-SNAWJCMRSA-N 1 3 329.488 2.550 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)NC/C=C\CNCCC(F)(F)F ZINC001321123179 1329345608 /nfs/dbraw/zinc/34/56/08/1329345608.db2.gz AEENLMNKWNNVLG-SREVYHEPSA-N 1 3 349.441 2.854 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)NC/C=C\CNCCC(F)(F)F ZINC001321123179 1329345611 /nfs/dbraw/zinc/34/56/11/1329345611.db2.gz AEENLMNKWNNVLG-SREVYHEPSA-N 1 3 349.441 2.854 10 0 EFAEHO CC[C@H](F)C[NH2+]C1CCC(NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001376674416 1343757210 /nfs/dbraw/zinc/75/72/10/1343757210.db2.gz WTGMMENAHAKJTJ-FHERZECASA-N 1 3 329.504 2.729 10 0 EFAEHO O=C(NC/C=C/CNCc1ccc(CF)cc1)C12CCC[NH+]1CCC2 ZINC001321138098 1329347670 /nfs/dbraw/zinc/34/76/70/1329347670.db2.gz YEFGXFRXTQLHRU-OWOJBTEDSA-N 1 3 345.462 2.547 10 0 EFAEHO O=C(NC/C=C/CNC/C=C/Cl)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001321208990 1329356886 /nfs/dbraw/zinc/35/68/86/1329356886.db2.gz MYYIAYGAXRFWQN-LGDFARKGSA-N 1 3 339.911 2.798 10 0 EFAEHO O=C(NC/C=C/CNC/C=C/Cl)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001321208990 1329356889 /nfs/dbraw/zinc/35/68/89/1329356889.db2.gz MYYIAYGAXRFWQN-LGDFARKGSA-N 1 3 339.911 2.798 10 0 EFAEHO O=C(NC/C=C\CNC/C=C\Cl)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001321208989 1329356938 /nfs/dbraw/zinc/35/69/38/1329356938.db2.gz MYYIAYGAXRFWQN-IRCIQBNVSA-N 1 3 339.911 2.798 10 0 EFAEHO O=C(NC/C=C\CNC/C=C\Cl)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001321208989 1329356940 /nfs/dbraw/zinc/35/69/40/1329356940.db2.gz MYYIAYGAXRFWQN-IRCIQBNVSA-N 1 3 339.911 2.798 10 0 EFAEHO C[NH+](C)CC1(C(=O)NC/C=C\CNCCC(F)(F)F)CCCCC1 ZINC001321172716 1329352543 /nfs/dbraw/zinc/35/25/43/1329352543.db2.gz CESISTQCHBLZIF-SREVYHEPSA-N 1 3 349.441 2.713 10 0 EFAEHO C[NH+](C)CC1(C(=O)NC/C=C/CNCc2ccc(Cl)s2)CC1 ZINC001321210477 1329357243 /nfs/dbraw/zinc/35/72/43/1329357243.db2.gz IYCUFMPCXJSYDM-ONEGZZNKSA-N 1 3 341.908 2.505 10 0 EFAEHO CCCCC[NH2+]C/C=C\CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001321252167 1329363798 /nfs/dbraw/zinc/36/37/98/1329363798.db2.gz UWDNRDRDAMWYJU-CNZFZVQHSA-N 1 3 327.488 2.651 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)N1CCCC[C@H]1CNCCF ZINC001317187185 1327706005 /nfs/dbraw/zinc/70/60/05/1327706005.db2.gz DIWDIDARWMDCQA-INIZCTEOSA-N 1 3 327.488 2.580 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)N1CCCC[C@H]1CNCCF ZINC001317187185 1327706010 /nfs/dbraw/zinc/70/60/10/1327706010.db2.gz DIWDIDARWMDCQA-INIZCTEOSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H](C(=O)NC/C=C\C[NH2+]Cc1cccc2ccccc21)N(C)C ZINC001321339410 1329375009 /nfs/dbraw/zinc/37/50/09/1329375009.db2.gz UXVNCZONLTUIMP-WHXUGTBJSA-N 1 3 339.483 2.942 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001317240851 1327781424 /nfs/dbraw/zinc/78/14/24/1327781424.db2.gz JAIZBJVYAGLFPM-ICSRJNTNSA-N 1 3 345.531 2.895 10 0 EFAEHO CC(C)C[NH2+]CCc1ccc(CNC(=O)CN2[C@@H](C)CC[C@@H]2C)cc1 ZINC001317373441 1327918598 /nfs/dbraw/zinc/91/85/98/1327918598.db2.gz DAEGFWQRAGCKFT-ROUUACIJSA-N 1 3 345.531 2.964 10 0 EFAEHO CC(C)N(C)CC(=O)NC/C=C/C[NH2+][C@@H]1CCCc2ccccc21 ZINC001321419370 1329384953 /nfs/dbraw/zinc/38/49/53/1329384953.db2.gz PHJUDIPUDICJPE-OVKVCFKUSA-N 1 3 329.488 2.666 10 0 EFAEHO C[NH+]1CCC(C(=O)NC[C@@H]2CCCN2CCCCC(F)(F)F)CC1 ZINC001317508099 1328091580 /nfs/dbraw/zinc/09/15/80/1328091580.db2.gz MJNOYAAVIHRGJW-HNNXBMFYSA-N 1 3 349.441 2.641 10 0 EFAEHO O=C(CCCC[NH+]1CCCC1)NC[C@H]1CCN(Cc2ccsc2)C1 ZINC001317535021 1328120818 /nfs/dbraw/zinc/12/08/18/1328120818.db2.gz HKCUEJJTDBUJKO-QGZVFWFLSA-N 1 3 349.544 2.952 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+]Cc2cccc3ccccc32)CCC1 ZINC001317597149 1328177395 /nfs/dbraw/zinc/17/73/95/1328177395.db2.gz ZRIMZGQPBONLFS-UHFFFAOYSA-N 1 3 339.483 2.872 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N(C)CCNCc2ccc(Cl)s2)CC[N@@H+]1C ZINC001317624161 1328205305 /nfs/dbraw/zinc/20/53/05/1328205305.db2.gz ZFMFRVQFOVCGMA-STQMWFEESA-N 1 3 343.924 2.680 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N(C)CCNCc2ccc(Cl)s2)CC[N@H+]1C ZINC001317624161 1328205313 /nfs/dbraw/zinc/20/53/13/1328205313.db2.gz ZFMFRVQFOVCGMA-STQMWFEESA-N 1 3 343.924 2.680 10 0 EFAEHO CN(CC[NH2+]CC1CC(C)(C)C1)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001317626187 1328208324 /nfs/dbraw/zinc/20/83/24/1328208324.db2.gz NAQZOANMPJTEKP-LJQANCHMSA-N 1 3 341.515 2.683 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[NH2+]Cc1cc2ccccc2s1)N(C)C ZINC001317654447 1328240401 /nfs/dbraw/zinc/24/04/01/1328240401.db2.gz KQVAORDPZGZUHI-INIZCTEOSA-N 1 3 333.501 2.790 10 0 EFAEHO CCC/C=C\CCN1CCC[C@@H](NC(=O)C23CCC[NH+]2CCC3)C1 ZINC001317935621 1328446382 /nfs/dbraw/zinc/44/63/82/1328446382.db2.gz ILHYRPATFPMHFP-PYTPGESOSA-N 1 3 333.520 2.942 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CCc1cccs1 ZINC001322003755 1329421956 /nfs/dbraw/zinc/42/19/56/1329421956.db2.gz BFTSKCZMDBUWCV-DOTOQJQBSA-N 1 3 337.533 2.648 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CCc1ccc(C)cc1 ZINC001322088823 1329427920 /nfs/dbraw/zinc/42/79/20/1329427920.db2.gz OZOMRLOPVPFXSR-PKOBYXMFSA-N 1 3 331.504 2.506 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[NH2+]Cc1cc(C)sc1C)N(C)C ZINC001322701414 1329481038 /nfs/dbraw/zinc/48/10/38/1329481038.db2.gz YBAJTCGVABOZJC-INIZCTEOSA-N 1 3 325.522 2.643 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+]Cc1ccc(Cl)cc1 ZINC001322845827 1329493613 /nfs/dbraw/zinc/49/36/13/1329493613.db2.gz YCHFLLDTRXLZTN-UHFFFAOYSA-N 1 3 325.884 2.618 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[NH2+]Cc1ccc(CF)cc1 ZINC001322852349 1329494308 /nfs/dbraw/zinc/49/43/08/1329494308.db2.gz MSGDOEPBDLZTCU-LJQANCHMSA-N 1 3 349.494 2.969 10 0 EFAEHO CCC(CC)C[N@H+]1CC[C@H](NC(=O)CN(C)C(C)C)C(C)(C)C1 ZINC001381140428 1348105059 /nfs/dbraw/zinc/10/50/59/1348105059.db2.gz DDSBWYHYOCILHY-KRWDZBQOSA-N 1 3 325.541 2.980 10 0 EFAEHO CCCCCC[N@@H+]1CC[C@@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001323857461 1329579404 /nfs/dbraw/zinc/57/94/04/1329579404.db2.gz IKUFVYKARZYSES-LJQANCHMSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCCCC[N@H+]1CC[C@@]2(CCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001323857461 1329579405 /nfs/dbraw/zinc/57/94/05/1329579405.db2.gz IKUFVYKARZYSES-LJQANCHMSA-N 1 3 335.536 2.975 10 0 EFAEHO CCCC[NH2+]C[C@@]1(C)CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001324790803 1329658250 /nfs/dbraw/zinc/65/82/50/1329658250.db2.gz SRQMPWHSHPZDAA-MOPGFXCFSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001325050009 1329667299 /nfs/dbraw/zinc/66/72/99/1329667299.db2.gz HABQWQGHRJGUHN-HOTGVXAUSA-N 1 3 347.494 2.836 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001325050009 1329667301 /nfs/dbraw/zinc/66/73/01/1329667301.db2.gz HABQWQGHRJGUHN-HOTGVXAUSA-N 1 3 347.494 2.836 10 0 EFAEHO CCC/C=C/CC[NH2+]C[C@@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@@H]1C ZINC001325528156 1329694434 /nfs/dbraw/zinc/69/44/34/1329694434.db2.gz ZCRIRRSTNXYUNX-KBSZCIAZSA-N 1 3 335.536 2.901 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]C/C=C\c2ccccc2)C1 ZINC001325582818 1329698902 /nfs/dbraw/zinc/69/89/02/1329698902.db2.gz SDPNLAWHOUAEDM-QQXWZLKESA-N 1 3 343.515 2.726 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@H]2[C@@H]1CC[N@@H+]2CCCCCF)N(C)C ZINC001325897316 1329721098 /nfs/dbraw/zinc/72/10/98/1329721098.db2.gz GARLRKBJJBZBLT-BZSNNMDCSA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@H]2[C@@H]1CC[N@H+]2CCCCCF)N(C)C ZINC001325897316 1329721100 /nfs/dbraw/zinc/72/11/00/1329721100.db2.gz GARLRKBJJBZBLT-BZSNNMDCSA-N 1 3 341.515 2.778 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](CC[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001326223515 1329740132 /nfs/dbraw/zinc/74/01/32/1329740132.db2.gz IGBFAXTVJNWBEI-OALUTQOASA-N 1 3 347.547 2.879 10 0 EFAEHO CCc1ccccc1C[NH2+][C@H](C)CN(C)C(=O)CN1CC[C@H](C)C1 ZINC001382112349 1348732447 /nfs/dbraw/zinc/73/24/47/1348732447.db2.gz AKJITKVBGWLBKA-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1C[C@@H]([NH2+]C/C=C\Cl)C(C)(C)C1 ZINC001382368677 1348919604 /nfs/dbraw/zinc/91/96/04/1348919604.db2.gz LOIORKWJVHJBAB-LRDXNBAQSA-N 1 3 341.927 2.828 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@H]1CC[C@H](NC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001326542775 1330314338 /nfs/dbraw/zinc/31/43/38/1330314338.db2.gz ZNVXSQNJFNQISJ-IOEMXKATSA-N 1 3 335.536 2.949 10 0 EFAEHO C[NH+](C)CCCCC(=O)N1CC2(C1)CCN(CCC(F)(F)F)CC2 ZINC001326603689 1330326474 /nfs/dbraw/zinc/32/64/74/1330326474.db2.gz NOKRTFBIFCDOML-UHFFFAOYSA-N 1 3 349.441 2.595 10 0 EFAEHO CN(C)C1(C(=O)NCC2([NH2+]CCC3=CCCCC3)CCC2)CCC1 ZINC001326834447 1330371095 /nfs/dbraw/zinc/37/10/95/1330371095.db2.gz LOPRTNGIVVZSBM-UHFFFAOYSA-N 1 3 333.520 2.990 10 0 EFAEHO CCCCCN1Cc2ccccc2C[C@@H]1CNC(=O)[C@H]1CC[N@H+](C)C1 ZINC001327510993 1330491823 /nfs/dbraw/zinc/49/18/23/1330491823.db2.gz ALYMJBJYZOTCOI-VQTJNVASSA-N 1 3 343.515 2.671 10 0 EFAEHO CCCCCN1Cc2ccccc2C[C@@H]1CNC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001327510993 1330491832 /nfs/dbraw/zinc/49/18/32/1330491832.db2.gz ALYMJBJYZOTCOI-VQTJNVASSA-N 1 3 343.515 2.671 10 0 EFAEHO CC(C)=CCN(C)C[C@@H]1CCCN1C(=O)[C@H]1CCC[N@H+]1CC(C)C ZINC001328732526 1330622932 /nfs/dbraw/zinc/62/29/32/1330622932.db2.gz GZMSYIHLGQWABV-RBUKOAKNSA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)=CCN(C)C[C@@H]1CCCN1C(=O)[C@H]1CCC[N@@H+]1CC(C)C ZINC001328732526 1330622937 /nfs/dbraw/zinc/62/29/37/1330622937.db2.gz GZMSYIHLGQWABV-RBUKOAKNSA-N 1 3 335.536 2.996 10 0 EFAEHO CN(Cc1cccc(F)c1)C[C@@H]1CCCN1C(=O)CCCC[NH+](C)C ZINC001328787211 1330632222 /nfs/dbraw/zinc/63/22/22/1330632222.db2.gz UDALMYROEPRPIC-IBGZPJMESA-N 1 3 349.494 2.980 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC2CC(C[NH2+]CCCC3CCCC3)C2)C1 ZINC001328915862 1330646133 /nfs/dbraw/zinc/64/61/33/1330646133.db2.gz QRJVHJQMCKCOBH-IPJUCJBFSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001329051027 1330661077 /nfs/dbraw/zinc/66/10/77/1330661077.db2.gz AGFSVALCDAQRHQ-ROUUACIJSA-N 1 3 345.531 2.895 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]CCCc1ccsc1 ZINC001329057420 1330661580 /nfs/dbraw/zinc/66/15/80/1330661580.db2.gz QXTPHIZGOYVSTJ-GJZGRUSLSA-N 1 3 337.533 2.648 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H](C)[NH2+]CC/C=C/c1ccccc1 ZINC001329173110 1330676541 /nfs/dbraw/zinc/67/65/41/1330676541.db2.gz PJUQXFGISYKJIT-KNFPLBEISA-N 1 3 340.471 2.847 10 0 EFAEHO CN(CC(C)(C)C[NH2+]CCCF)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001329336133 1330695490 /nfs/dbraw/zinc/69/54/90/1330695490.db2.gz WOWWRHFYRUWSMY-SFHVURJKSA-N 1 3 347.494 2.633 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)CCC[NH2+]Cc1ccccn1 ZINC001330934667 1330772814 /nfs/dbraw/zinc/77/28/14/1330772814.db2.gz XTLDPRRQBHRPAA-HKUYNNGSSA-N 1 3 346.519 2.719 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCCCC(F)(F)F)[C@@H]1C ZINC001331945151 1330895338 /nfs/dbraw/zinc/89/53/38/1330895338.db2.gz YYIKWORYAZDRIW-UONOGXRCSA-N 1 3 337.430 2.638 10 0 EFAEHO CN(CC(=O)N[C@H]1CC[C@@H](C[NH2+]CC=C(Cl)Cl)C1)C1CCC1 ZINC001332271307 1330950863 /nfs/dbraw/zinc/95/08/63/1330950863.db2.gz IOMZOIOPVZMFTN-OLZOCXBDSA-N 1 3 348.318 2.664 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C1CC(N(C)C(=O)CN2CCCC2)C1 ZINC001333153119 1331085139 /nfs/dbraw/zinc/08/51/39/1331085139.db2.gz IXTNAJSYONGLEP-UHFFFAOYSA-N 1 3 343.515 2.602 10 0 EFAEHO Cc1cccc(CCC[NH2+]C2CC(N(C)C(=O)CN(C)C(C)C)C2)c1 ZINC001333154354 1331085688 /nfs/dbraw/zinc/08/56/88/1331085688.db2.gz RDRAZOLQTJNEBM-UHFFFAOYSA-N 1 3 345.531 2.847 10 0 EFAEHO Cc1ccc(CN2CC=C(CNC(=O)CCC[NH+](C)C)CC2)cc1C ZINC001333391520 1331131695 /nfs/dbraw/zinc/13/16/95/1331131695.db2.gz QBKUZGOJUHNSRZ-UHFFFAOYSA-N 1 3 343.515 2.894 10 0 EFAEHO CC(C)=CC[NH2+]Cc1ccc(CNC(=O)C2(N(C)C)CCC2)c(F)c1 ZINC001333473334 1331151602 /nfs/dbraw/zinc/15/16/02/1331151602.db2.gz NPMHPJHGIJJASJ-UHFFFAOYSA-N 1 3 347.478 2.982 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[N@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC001479866715 1332662280 /nfs/dbraw/zinc/66/22/80/1332662280.db2.gz RBMGUYSLBKHZBA-GOSISDBHSA-N 1 3 349.906 2.905 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[N@@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC001479866715 1332662286 /nfs/dbraw/zinc/66/22/86/1332662286.db2.gz RBMGUYSLBKHZBA-GOSISDBHSA-N 1 3 349.906 2.905 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]CCCCC(F)(F)F ZINC001480459922 1334060714 /nfs/dbraw/zinc/06/07/14/1334060714.db2.gz PTCYPSSCRFQPHC-ZIAGYGMSSA-N 1 3 337.430 2.686 10 0 EFAEHO CSCCCCNC(=[NH2+])NC1CCN(Cc2ccccc2)CC1 ZINC000849091416 1335073727 /nfs/dbraw/zinc/07/37/27/1335073727.db2.gz FGPYGXWQGBLDRM-UHFFFAOYSA-N 1 3 334.533 2.908 10 0 EFAEHO CCN1CCC[C@@H]1CNC(=[NH2+])NCc1cc(F)c(Cl)cc1F ZINC000849104141 1335552757 /nfs/dbraw/zinc/55/27/57/1335552757.db2.gz FEZXTXDLZWSPMF-LLVKDONJSA-N 1 3 330.810 2.716 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=S)Nc1ccc(Cl)cc1 ZINC000849274924 1335585548 /nfs/dbraw/zinc/58/55/48/1335585548.db2.gz DOEXJRQDOUQMPE-ZDUSSCGKSA-N 1 3 342.940 2.898 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=S)Nc1ccc(Cl)cc1 ZINC000849274924 1335585550 /nfs/dbraw/zinc/58/55/50/1335585550.db2.gz DOEXJRQDOUQMPE-ZDUSSCGKSA-N 1 3 342.940 2.898 10 0 EFAEHO Cc1ccc(F)c(NC(=S)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000849276776 1335585918 /nfs/dbraw/zinc/58/59/18/1335585918.db2.gz OQODDLMHMYWBJV-AWEZNQCLSA-N 1 3 340.512 2.693 10 0 EFAEHO Cc1ccc(F)c(NC(=S)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000849276776 1335585920 /nfs/dbraw/zinc/58/59/20/1335585920.db2.gz OQODDLMHMYWBJV-AWEZNQCLSA-N 1 3 340.512 2.693 10 0 EFAEHO CC(C)[C@@H]1CN(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)[C@H]1C(C)C ZINC001413893838 1335951947 /nfs/dbraw/zinc/95/19/47/1335951947.db2.gz OXDXGUOUQKRKKA-BZSNNMDCSA-N 1 3 340.556 2.580 10 0 EFAEHO CC(C)[C@@H]1CN(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)[C@H]1C(C)C ZINC001413893838 1335951949 /nfs/dbraw/zinc/95/19/49/1335951949.db2.gz OXDXGUOUQKRKKA-BZSNNMDCSA-N 1 3 340.556 2.580 10 0 EFAEHO CC[N@@H+]1CC[C@H]1CNC(=O)[C@@H]1CCCCN1Cc1cccc(C)c1 ZINC001361493501 1336121667 /nfs/dbraw/zinc/12/16/67/1336121667.db2.gz FENMRWWVJFLWFF-OALUTQOASA-N 1 3 329.488 2.560 10 0 EFAEHO CC[N@H+]1CC[C@H]1CNC(=O)[C@@H]1CCCCN1Cc1cccc(C)c1 ZINC001361493501 1336121670 /nfs/dbraw/zinc/12/16/70/1336121670.db2.gz FENMRWWVJFLWFF-OALUTQOASA-N 1 3 329.488 2.560 10 0 EFAEHO CCN1CC[C@H]1CNC(=O)[C@@H]1CCCC[N@@H+]1Cc1cccc(C)c1 ZINC001361493501 1336121673 /nfs/dbraw/zinc/12/16/73/1336121673.db2.gz FENMRWWVJFLWFF-OALUTQOASA-N 1 3 329.488 2.560 10 0 EFAEHO CCN1CC[C@H]1CNC(=O)[C@@H]1CCCC[N@H+]1Cc1cccc(C)c1 ZINC001361493501 1336121675 /nfs/dbraw/zinc/12/16/75/1336121675.db2.gz FENMRWWVJFLWFF-OALUTQOASA-N 1 3 329.488 2.560 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)N(C)C)cc1 ZINC001361728646 1336299796 /nfs/dbraw/zinc/29/97/96/1336299796.db2.gz ZVBPNIUMOKBXMS-AABGKKOBSA-N 1 3 343.515 2.985 10 0 EFAEHO CCc1ccc([C@H](CNC(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)N(C)C)cc1 ZINC001361728646 1336299800 /nfs/dbraw/zinc/29/98/00/1336299800.db2.gz ZVBPNIUMOKBXMS-AABGKKOBSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H]1CCC[C@@H](CC[NH+](C)C)N1C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001361813080 1336352425 /nfs/dbraw/zinc/35/24/25/1336352425.db2.gz RHGTWGVWNKHZAQ-JTDSTZFVSA-N 1 3 341.515 2.920 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@H](C(=O)N(CCN(C)C)c3ccccc3)C[N@@H+]2C1 ZINC001361951565 1336434373 /nfs/dbraw/zinc/43/43/73/1336434373.db2.gz HBSNMUGYHPPUIH-ZIFCJYIRSA-N 1 3 329.488 2.702 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@H](C(=O)N(CCN(C)C)c3ccccc3)C[N@H+]2C1 ZINC001361951565 1336434374 /nfs/dbraw/zinc/43/43/74/1336434374.db2.gz HBSNMUGYHPPUIH-ZIFCJYIRSA-N 1 3 329.488 2.702 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@H](C(=O)N3CCN(CCC(C)(C)C)CC3)C[N@@H+]2C1 ZINC001361954373 1336435828 /nfs/dbraw/zinc/43/58/28/1336435828.db2.gz WMPCOFJPDQBJSH-FGTMMUONSA-N 1 3 335.536 2.687 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@H](C(=O)N3CCN(CCC(C)(C)C)CC3)C[N@H+]2C1 ZINC001361954373 1336435830 /nfs/dbraw/zinc/43/58/30/1336435830.db2.gz WMPCOFJPDQBJSH-FGTMMUONSA-N 1 3 335.536 2.687 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001361979878 1336449701 /nfs/dbraw/zinc/44/97/01/1336449701.db2.gz VWIQPZRLNNMPEC-IEBWSBKVSA-N 1 3 349.494 2.836 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC001362007213 1336461211 /nfs/dbraw/zinc/46/12/11/1336461211.db2.gz FXKUQXQOSLHBDW-OAHLLOKOSA-N 1 3 339.911 2.818 10 0 EFAEHO CN(CCNC(=O)c1cccc(CC[NH+](C)C)c1)Cc1ccccc1 ZINC001362077536 1336492613 /nfs/dbraw/zinc/49/26/13/1336492613.db2.gz PBRYSHYEXVEWLA-UHFFFAOYSA-N 1 3 339.483 2.653 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC001362157876 1336530155 /nfs/dbraw/zinc/53/01/55/1336530155.db2.gz KKNFGZURINAULU-MSOLQXFVSA-N 1 3 331.504 2.697 10 0 EFAEHO C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)C2([NH+](C)C)CCCC2)C1 ZINC001362162599 1336532605 /nfs/dbraw/zinc/53/26/05/1336532605.db2.gz YWHVHXGSINEQFF-WMZOPIPTSA-N 1 3 329.488 2.813 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1)N(C)Cc1ccccc1 ZINC001362170615 1336536408 /nfs/dbraw/zinc/53/64/08/1336536408.db2.gz ATZMPKPDWHYEIR-QRQLOZEOSA-N 1 3 331.504 2.744 10 0 EFAEHO CN1CCN(C(=O)c2ccc(C[NH+]3CCCC3)o2)C2(CCCCC2)C1 ZINC001362182812 1336542975 /nfs/dbraw/zinc/54/29/75/1336542975.db2.gz WLTLZNQOJMJLRD-UHFFFAOYSA-N 1 3 345.487 2.966 10 0 EFAEHO CC(C)C[C@H](CNC(=O)c1ccc(NC2=NCCC2)cc1)[NH+](C)C ZINC001362249862 1336572354 /nfs/dbraw/zinc/57/23/54/1336572354.db2.gz RWCYUTAOTNZGKH-QGZVFWFLSA-N 1 3 330.476 2.997 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001362503484 1336636466 /nfs/dbraw/zinc/63/64/66/1336636466.db2.gz KYCPNUJRCJXTCL-BHIYHBOVSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1cc2ccccc2nc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001362655089 1336692609 /nfs/dbraw/zinc/69/26/09/1336692609.db2.gz BRXJUIAZDWTAKH-INIZCTEOSA-N 1 3 342.487 2.545 10 0 EFAEHO Cc1cc2ccccc2nc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001362655089 1336692610 /nfs/dbraw/zinc/69/26/10/1336692610.db2.gz BRXJUIAZDWTAKH-INIZCTEOSA-N 1 3 342.487 2.545 10 0 EFAEHO COc1ccc([C@H](NC(C)C)C(=O)N[C@@H](CC(C)C)C[NH+](C)C)cc1 ZINC001363725690 1337012852 /nfs/dbraw/zinc/01/28/52/1337012852.db2.gz BJQXOOFIBGYLNE-HKUYNNGSSA-N 1 3 349.519 2.827 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)N[C@@]2(C)CCN(Cc3ccccc3)C2)C1 ZINC001363771084 1337033943 /nfs/dbraw/zinc/03/39/43/1337033943.db2.gz HSUZCEVAHNLILW-ZVDOUQERSA-N 1 3 343.515 2.888 10 0 EFAEHO CN1CCC[C@H]1CC[NH2+][C@H]1CCN(C(=O)OC(C)(C)C)C12CCC2 ZINC001363812976 1337064126 /nfs/dbraw/zinc/06/41/26/1337064126.db2.gz XJCXJDZXAJEQAY-HOTGVXAUSA-N 1 3 337.508 2.992 10 0 EFAEHO COc1cccc(CN2CCC(O)(C[NH+]3CCCCC3)CC2)c1C ZINC001363854455 1337083340 /nfs/dbraw/zinc/08/33/40/1337083340.db2.gz VNEMRQODJLBQNU-UHFFFAOYSA-N 1 3 332.488 2.816 10 0 EFAEHO CC(C)CC[NH2+][C@H]1C[C@@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001365822795 1337252945 /nfs/dbraw/zinc/25/29/45/1337252945.db2.gz UDCVYLJLXNELGD-FCEWJHQRSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1C[C@H]([NH2+]CC2CCC(C)CC2)C1)N(C)C ZINC001365824032 1337253395 /nfs/dbraw/zinc/25/33/95/1337253395.db2.gz BHJAUBKUDARTLZ-QCRHNUIXSA-N 1 3 337.552 2.883 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)[C@@H]2CCCCN2C(=O)CC[NH+](C)C)c1 ZINC001365932264 1337264205 /nfs/dbraw/zinc/26/42/05/1337264205.db2.gz XUJQNZOJTFYXBQ-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CCCN(CCc2ccccc2)C1 ZINC001365936436 1337268568 /nfs/dbraw/zinc/26/85/68/1337268568.db2.gz GKLJNSKLDPDUTD-WOJBJXKFSA-N 1 3 343.515 2.684 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@@H]1CCCN(CCc2ccccc2)C1 ZINC001365936436 1337268572 /nfs/dbraw/zinc/26/85/72/1337268572.db2.gz GKLJNSKLDPDUTD-WOJBJXKFSA-N 1 3 343.515 2.684 10 0 EFAEHO Cc1cc(C)c(CN2CC[C@@H](NC(=O)C3(C[NH+](C)C)CC3)C2)c(C)c1 ZINC001365983262 1337299116 /nfs/dbraw/zinc/29/91/16/1337299116.db2.gz LPJNDLDZTBXULA-GOSISDBHSA-N 1 3 343.515 2.644 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCN(CCc2ccccc2)C1)[NH+]1CCCC1 ZINC001366006764 1337317232 /nfs/dbraw/zinc/31/72/32/1337317232.db2.gz WCNBFFLCHMHWLV-UXHICEINSA-N 1 3 343.515 2.540 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](CNC(=O)[C@H](C(C)C)[NH+](C)C)C2CC2)c1 ZINC001366035116 1337337611 /nfs/dbraw/zinc/33/76/11/1337337611.db2.gz RJFLUYXQKGKPPC-MOPGFXCFSA-N 1 3 349.494 2.705 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@@H](NCc2ccccc2Cl)C2CC2)CC[N@@H+]1C ZINC001366034815 1337337732 /nfs/dbraw/zinc/33/77/32/1337337732.db2.gz QLJXQKWZNLQCHE-MZMPZRCHSA-N 1 3 349.906 2.665 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@@H](NCc2ccccc2Cl)C2CC2)CC[N@H+]1C ZINC001366034815 1337337733 /nfs/dbraw/zinc/33/77/33/1337337733.db2.gz QLJXQKWZNLQCHE-MZMPZRCHSA-N 1 3 349.906 2.665 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1c(C)cc(C)cc1C)C1CC1)N(C)C ZINC001366036751 1337338593 /nfs/dbraw/zinc/33/85/93/1337338593.db2.gz AACGCYGJUZBYJQ-VQTJNVASSA-N 1 3 345.531 2.936 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]([NH2+]CC2CCC3(CC3)CC2)C2CC2)CCC1 ZINC001366041420 1337341758 /nfs/dbraw/zinc/34/17/58/1337341758.db2.gz XHQSZRKNNUBLQH-GOSISDBHSA-N 1 3 347.547 2.926 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+][C@H]2CCc3ccc(Cl)cc32)C1 ZINC001366103819 1337381229 /nfs/dbraw/zinc/38/12/29/1337381229.db2.gz VZLKGYQAYLGOQL-WMZOPIPTSA-N 1 3 349.906 2.860 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H]([NH2+]Cc2cc3ccccc3s2)C1)N(C)C ZINC001366124719 1337389804 /nfs/dbraw/zinc/38/98/04/1337389804.db2.gz GDIHNXSWCRQXHE-ZOBUZTSGSA-N 1 3 345.512 2.978 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001366146805 1337402006 /nfs/dbraw/zinc/40/20/06/1337402006.db2.gz CMBILUFKOSKAFR-HDICACEKSA-N 1 3 329.488 2.525 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+]CC3CCC4(CC4)CC3)C2)CCC1 ZINC001366149596 1337403098 /nfs/dbraw/zinc/40/30/98/1337403098.db2.gz KRNVYTKWSPQVEG-CALCHBBNSA-N 1 3 333.520 2.678 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[NH+](CC)CC ZINC001366156702 1337406478 /nfs/dbraw/zinc/40/64/78/1337406478.db2.gz QPCJHVXXSLISBB-FRRDWIJNSA-N 1 3 336.307 2.663 10 0 EFAEHO C[C@@H]([NH2+][C@H]1C[C@@H](NC(=O)CN(C)CC(C)(C)C)C1)c1ccccc1 ZINC001366158940 1337407361 /nfs/dbraw/zinc/40/73/61/1337407361.db2.gz IDZSLQGOMFBHNN-NXHRZFHOSA-N 1 3 331.504 2.962 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2cc(F)ccc2F)C1)N(C)C ZINC001366169983 1337413001 /nfs/dbraw/zinc/41/30/01/1337413001.db2.gz MPCDDTUHHUGLQA-HVOFVXBASA-N 1 3 339.430 2.603 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](CCCC(C)(C)C)C1)N(C)C ZINC001366181079 1337422104 /nfs/dbraw/zinc/42/21/04/1337422104.db2.gz SGUPRKUIZGWQIR-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](CCCC(C)(C)C)C1)N(C)C ZINC001366181079 1337422107 /nfs/dbraw/zinc/42/21/07/1337422107.db2.gz SGUPRKUIZGWQIR-DLBZAZTESA-N 1 3 325.541 2.981 10 0 EFAEHO Cc1cc(F)ccc1C[N@H+]1CCC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001366182314 1337423699 /nfs/dbraw/zinc/42/36/99/1337423699.db2.gz ATTSIJVGYUKMBM-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1cc(F)ccc1C[N@@H+]1CCC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001366182314 1337423701 /nfs/dbraw/zinc/42/37/01/1337423701.db2.gz ATTSIJVGYUKMBM-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2CCC[N@H+](Cc3ccsc3)C2)CCC1 ZINC001366183370 1337424572 /nfs/dbraw/zinc/42/45/72/1337424572.db2.gz YRTJTDFEORQVPD-HNNXBMFYSA-N 1 3 335.517 2.561 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccsc3)C2)CCC1 ZINC001366183370 1337424573 /nfs/dbraw/zinc/42/45/73/1337424573.db2.gz YRTJTDFEORQVPD-HNNXBMFYSA-N 1 3 335.517 2.561 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@H+](C/C=C/c2ccccc2)C1 ZINC001366188187 1337427762 /nfs/dbraw/zinc/42/77/62/1337427762.db2.gz UUSNWYYLLGIFRE-OEMHODTASA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2)C1 ZINC001366188187 1337427764 /nfs/dbraw/zinc/42/77/64/1337427764.db2.gz UUSNWYYLLGIFRE-OEMHODTASA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CCCC[C@@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001366214445 1337450351 /nfs/dbraw/zinc/45/03/51/1337450351.db2.gz SXZWAUDUDWDVSC-HZPDHXFCSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CCCC[C@@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001366214445 1337450353 /nfs/dbraw/zinc/45/03/53/1337450353.db2.gz SXZWAUDUDWDVSC-HZPDHXFCSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@@H](C(=O)N1CCCC[C@@H]1CNCc1ccccn1)[NH+](CC)CC ZINC001366221906 1337454482 /nfs/dbraw/zinc/45/44/82/1337454482.db2.gz ZZLMRYSSNFOTLG-MOPGFXCFSA-N 1 3 346.519 2.673 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2C[N@H+](CC[C@H]3CCC[C@@H](C)C3)C[C@H]21 ZINC001366237120 1337470241 /nfs/dbraw/zinc/47/02/41/1337470241.db2.gz RQHFSLWJFIQTMU-KLBVCGFUSA-N 1 3 335.536 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@H]2C[N@@H+](CC[C@H]3CCC[C@@H](C)C3)C[C@H]21 ZINC001366237120 1337470244 /nfs/dbraw/zinc/47/02/44/1337470244.db2.gz RQHFSLWJFIQTMU-KLBVCGFUSA-N 1 3 335.536 2.589 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]C/C=C\c1ccccc1 ZINC001366271040 1337484318 /nfs/dbraw/zinc/48/43/18/1337484318.db2.gz AJGDPYDPIUJNLG-DKVQLLHESA-N 1 3 329.488 2.667 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)NCc1ccccc1Cl ZINC001366291379 1337495486 /nfs/dbraw/zinc/49/54/86/1337495486.db2.gz ZPFXHWCOFCRRLX-RHSMWYFYSA-N 1 3 337.895 2.809 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)NCc1ccccc1Cl ZINC001366291379 1337495488 /nfs/dbraw/zinc/49/54/88/1337495488.db2.gz ZPFXHWCOFCRRLX-RHSMWYFYSA-N 1 3 337.895 2.809 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]Cc1cccc(C(F)F)c1)N(C)C ZINC001366300862 1337499980 /nfs/dbraw/zinc/49/99/80/1337499980.db2.gz SHGDCUYBMNVWCQ-SWLSCSKDSA-N 1 3 327.419 2.559 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H](C)[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C ZINC001366321129 1337510356 /nfs/dbraw/zinc/51/03/56/1337510356.db2.gz CWMQSMHDBHUBID-KXBFYZLASA-N 1 3 331.504 2.889 10 0 EFAEHO C[C@H](CNC(=O)C12CC[NH+](CC1)C2)N[C@@H](C)c1ccccc1Cl ZINC001366342981 1337523217 /nfs/dbraw/zinc/52/32/17/1337523217.db2.gz HSSJLKSVALDHJB-KGLIPLIRSA-N 1 3 335.879 2.591 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001366428428 1337578078 /nfs/dbraw/zinc/57/80/78/1337578078.db2.gz JGMUUHAPNZPBHT-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1ccccc1C[N@H+](C)[C@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001366428428 1337578082 /nfs/dbraw/zinc/57/80/82/1337578082.db2.gz JGMUUHAPNZPBHT-IBGZPJMESA-N 1 3 331.504 2.758 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001366510131 1337650873 /nfs/dbraw/zinc/65/08/73/1337650873.db2.gz HCXYCACCCJOVRL-LSDHHAIUSA-N 1 3 333.467 2.637 10 0 EFAEHO C[N@H+](CCNC(=O)C(C)(C)N1CCCCC1)C[C@@H]1CCC(F)(F)C1 ZINC001366526506 1337663775 /nfs/dbraw/zinc/66/37/75/1337663775.db2.gz AWBVJWXTPRVUPI-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO C[N@@H+](CCNC(=O)C(C)(C)N1CCCCC1)C[C@@H]1CCC(F)(F)C1 ZINC001366526506 1337663778 /nfs/dbraw/zinc/66/37/78/1337663778.db2.gz AWBVJWXTPRVUPI-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)c1 ZINC001366539232 1337674601 /nfs/dbraw/zinc/67/46/01/1337674601.db2.gz GYNINOGHNLRFJX-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)c1 ZINC001366539232 1337674608 /nfs/dbraw/zinc/67/46/08/1337674608.db2.gz GYNINOGHNLRFJX-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001366539305 1337675187 /nfs/dbraw/zinc/67/51/87/1337675187.db2.gz HGPWLYJAIXOGKZ-OALUTQOASA-N 1 3 329.488 2.560 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001366539305 1337675193 /nfs/dbraw/zinc/67/51/93/1337675193.db2.gz HGPWLYJAIXOGKZ-OALUTQOASA-N 1 3 329.488 2.560 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@@H+]1C)Cc1ccc(CF)cc1 ZINC001366542315 1337678933 /nfs/dbraw/zinc/67/89/33/1337678933.db2.gz WFGYVKXMBRJSSX-GOSISDBHSA-N 1 3 335.467 2.579 10 0 EFAEHO CN(CCNC(=O)CC[C@H]1CCC[N@H+]1C)Cc1ccc(CF)cc1 ZINC001366542315 1337678936 /nfs/dbraw/zinc/67/89/36/1337678936.db2.gz WFGYVKXMBRJSSX-GOSISDBHSA-N 1 3 335.467 2.579 10 0 EFAEHO CN(CCNC(=O)C1(C[NH+](C)C)CC1)[C@@H]1CCc2ccc(Cl)cc21 ZINC001366561790 1337696149 /nfs/dbraw/zinc/69/61/49/1337696149.db2.gz KPECAGPEPKWZJB-QGZVFWFLSA-N 1 3 349.906 2.717 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[N@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001366569832 1337705145 /nfs/dbraw/zinc/70/51/45/1337705145.db2.gz HLXOJZZOEVQJFE-HOTGVXAUSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001366569832 1337705149 /nfs/dbraw/zinc/70/51/49/1337705149.db2.gz HLXOJZZOEVQJFE-HOTGVXAUSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1cccc(CN(C)CCNC(=O)[C@@H]2CCC[C@@H]([NH+](C)C)C2)c1 ZINC001366584974 1337723033 /nfs/dbraw/zinc/72/30/33/1337723033.db2.gz NYAUBZLYLLJZES-RTBURBONSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[N@H+](CCNC(=O)[C@@H](C(C)C)N(C)C)[C@@H]1CCc2ccccc21 ZINC001366640408 1337786974 /nfs/dbraw/zinc/78/69/74/1337786974.db2.gz LBTJZZLWLSHCQE-RTBURBONSA-N 1 3 331.504 2.698 10 0 EFAEHO CC[N@@H+](CCNC(=O)[C@@H](C(C)C)N(C)C)[C@@H]1CCc2ccccc21 ZINC001366640408 1337786977 /nfs/dbraw/zinc/78/69/77/1337786977.db2.gz LBTJZZLWLSHCQE-RTBURBONSA-N 1 3 331.504 2.698 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCN(Cc2ccccc2F)C1 ZINC001366703574 1337895877 /nfs/dbraw/zinc/89/58/77/1337895877.db2.gz OXCBPMDJJODWHV-WMZOPIPTSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCN(Cc2ccccc2F)C1 ZINC001366703574 1337895882 /nfs/dbraw/zinc/89/58/82/1337895882.db2.gz OXCBPMDJJODWHV-WMZOPIPTSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001366714128 1337909561 /nfs/dbraw/zinc/90/95/61/1337909561.db2.gz ZNTWUYFCPCVQEC-HZPDHXFCSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@H]2CCN(Cc3ccccc3Cl)C2)C1 ZINC001366714128 1337909564 /nfs/dbraw/zinc/90/95/64/1337909564.db2.gz ZNTWUYFCPCVQEC-HZPDHXFCSA-N 1 3 349.906 2.620 10 0 EFAEHO CN(CC(=O)NCC[N@H+](CC1CC(C)(C)C1)C1CC1)CC(C)(C)C ZINC001366752300 1337968267 /nfs/dbraw/zinc/96/82/67/1337968267.db2.gz QMIXQLWBSDMBEF-UHFFFAOYSA-N 1 3 337.552 2.981 10 0 EFAEHO CN(CC(=O)NCC[N@@H+](CC1CC(C)(C)C1)C1CC1)CC(C)(C)C ZINC001366752300 1337968278 /nfs/dbraw/zinc/96/82/78/1337968278.db2.gz QMIXQLWBSDMBEF-UHFFFAOYSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@H+](CC1CCC2(CC2)CC1)C1CC1)N(C)C ZINC001366752326 1337968334 /nfs/dbraw/zinc/96/83/34/1337968334.db2.gz QWGRTKWFBICBHA-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](C(=O)NCC[N@@H+](CC1CCC2(CC2)CC1)C1CC1)N(C)C ZINC001366752326 1337968335 /nfs/dbraw/zinc/96/83/35/1337968335.db2.gz QWGRTKWFBICBHA-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)NCCN(Cc2ccccc2)C2CC2)C1 ZINC001366755359 1337972660 /nfs/dbraw/zinc/97/26/60/1337972660.db2.gz CZIOGSDQASHNRX-UYAOXDASSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)CC[NH2+][C@H](CNC(=O)CN1CC[C@H](C)C1)c1ccccc1 ZINC001366786816 1338005672 /nfs/dbraw/zinc/00/56/72/1338005672.db2.gz KKRXHUWJJMSSCX-PKOBYXMFSA-N 1 3 331.504 2.821 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@@H]1CC[N@H+](CCC2CC2)C1 ZINC001366842043 1338103544 /nfs/dbraw/zinc/10/35/44/1338103544.db2.gz MSKABMSHJKZVIE-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@@H]1CC[N@@H+](CCC2CC2)C1 ZINC001366842043 1338103550 /nfs/dbraw/zinc/10/35/50/1338103550.db2.gz MSKABMSHJKZVIE-MOPGFXCFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001366848508 1338113243 /nfs/dbraw/zinc/11/32/43/1338113243.db2.gz BVTHGUYRVLHOGT-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001366848508 1338113247 /nfs/dbraw/zinc/11/32/47/1338113247.db2.gz BVTHGUYRVLHOGT-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO CCCC[N@H+](C)C[C@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001366865882 1338134122 /nfs/dbraw/zinc/13/41/22/1338134122.db2.gz MMTVNSFUYODMLI-APWZRJJASA-N 1 3 341.515 2.779 10 0 EFAEHO CCCC[N@@H+](C)C[C@H]1CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001366865882 1338134126 /nfs/dbraw/zinc/13/41/26/1338134126.db2.gz MMTVNSFUYODMLI-APWZRJJASA-N 1 3 341.515 2.779 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[N@H+](C)CC2CC3(CCC3)C2)C1 ZINC001366884880 1338164180 /nfs/dbraw/zinc/16/41/80/1338164180.db2.gz SLQGCDOLYWOTQX-KRWDZBQOSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[N@@H+](C)CC2CC3(CCC3)C2)C1 ZINC001366884880 1338164183 /nfs/dbraw/zinc/16/41/83/1338164183.db2.gz SLQGCDOLYWOTQX-KRWDZBQOSA-N 1 3 335.536 2.689 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH+]2CC(CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001366988739 1338245957 /nfs/dbraw/zinc/24/59/57/1338245957.db2.gz VKRTYLKQFPAAEZ-AEFFLSMTSA-N 1 3 343.515 2.754 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)N2C[C@@H]3C[C@H]2CN3C(=O)CC[NH+](C)C)c1 ZINC001366997294 1338254617 /nfs/dbraw/zinc/25/46/17/1338254617.db2.gz SCGCWNQELXGTQM-SQNIBIBYSA-N 1 3 329.488 2.601 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CC2CCCCC2)C1)N1CCCC1 ZINC001367025496 1338283955 /nfs/dbraw/zinc/28/39/55/1338283955.db2.gz QQNUHDZOXOHZIH-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CC2CCCCC2)C1)N1CCCC1 ZINC001367025496 1338283956 /nfs/dbraw/zinc/28/39/56/1338283956.db2.gz QQNUHDZOXOHZIH-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1C[NH+]2CCC1CC2)NCc1ccccc1Cl ZINC001367089972 1338375290 /nfs/dbraw/zinc/37/52/90/1338375290.db2.gz ASFGQUVDQISMLN-IRXDYDNUSA-N 1 3 349.906 2.666 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](CC)[NH2+]Cc1ccc2ncccc2c1)N(C)C ZINC001367097654 1338384207 /nfs/dbraw/zinc/38/42/07/1338384207.db2.gz DCVKNZNFLCAYIJ-PKOBYXMFSA-N 1 3 342.487 2.559 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]Cc1cncc(C)c1 ZINC001367125395 1338413463 /nfs/dbraw/zinc/41/34/63/1338413463.db2.gz DVRWOSCYMXPMRP-MOPGFXCFSA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1c(C)cccc1C ZINC001367128133 1338416757 /nfs/dbraw/zinc/41/67/57/1338416757.db2.gz QPSHPKOEFYCXDK-CRAIPNDOSA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H](CC)N(C)C)[NH2+]Cc1ccc(C)cc1Cl ZINC001367129825 1338419103 /nfs/dbraw/zinc/41/91/03/1338419103.db2.gz CTPOAVVPPDQFLJ-RDJZCZTQSA-N 1 3 339.911 2.973 10 0 EFAEHO CC[C@H](C(=O)N[C@@](C)(C[NH2+]Cc1ccc(F)cc1C)C1CC1)N(C)C ZINC001367173324 1338474607 /nfs/dbraw/zinc/47/46/07/1338474607.db2.gz XVXSFICRGVIWDK-QUCCMNQESA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@H](C(=O)N[C@](C)(C[NH2+]Cc1ccc(F)cc1)C1CC1)N(C)C ZINC001367202438 1338509623 /nfs/dbraw/zinc/50/96/23/1338509623.db2.gz XNPZUHNKERIFOW-IEBWSBKVSA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@H](C)C[NH+]1CCC(CCNC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001367213144 1338523566 /nfs/dbraw/zinc/52/35/66/1338523566.db2.gz UOTRDDVUVUJKAF-FUHWJXTLSA-N 1 3 325.541 2.837 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@H]1CCCN1C(=O)CN(C)C(C)C ZINC001367229022 1338536721 /nfs/dbraw/zinc/53/67/21/1338536721.db2.gz VLICNVMRSAPPTL-GOSISDBHSA-N 1 3 335.467 2.555 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]Cc1ccc(CF)cc1 ZINC001367266275 1338566204 /nfs/dbraw/zinc/56/62/04/1338566204.db2.gz MOILBUDGRQEXFA-MRXNPFEDSA-N 1 3 349.494 2.872 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H](C)C[NH2+]Cc1cccc(F)c1Cl)N(C)C ZINC001367295290 1338595368 /nfs/dbraw/zinc/59/53/68/1338595368.db2.gz VRMQPBVFHLIBCO-DOMZBBRYSA-N 1 3 343.874 2.661 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+]C[C@H](C)N(C)C(=O)[C@@H]1CCCN1C ZINC001367353240 1338650316 /nfs/dbraw/zinc/65/03/16/1338650316.db2.gz GQVBQGRIVNUTFP-YOEHRIQHSA-N 1 3 337.895 2.679 10 0 EFAEHO C[C@H](CNCc1cccnc1)N(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001367367818 1338663398 /nfs/dbraw/zinc/66/33/98/1338663398.db2.gz HFTLOSOWSPHQKV-MRXNPFEDSA-N 1 3 346.519 2.671 10 0 EFAEHO C[C@H](CNCc1cccnc1)N(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001367367818 1338663403 /nfs/dbraw/zinc/66/34/03/1338663403.db2.gz HFTLOSOWSPHQKV-MRXNPFEDSA-N 1 3 346.519 2.671 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1cc(C)sc1C)N(C)C ZINC001367399726 1338696782 /nfs/dbraw/zinc/69/67/82/1338696782.db2.gz UAODGNHITFFUNX-MLGOLLRUSA-N 1 3 325.522 2.642 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(C)cc1 ZINC001367413417 1338711755 /nfs/dbraw/zinc/71/17/55/1338711755.db2.gz LJKSVYSOHIOCIQ-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]([NH2+]CC1CC2(CCC2)C1)C(C)C)N(C)C ZINC001367478911 1338778395 /nfs/dbraw/zinc/77/83/95/1338778395.db2.gz CQLFENKCPINEKQ-QZTJIDSGSA-N 1 3 337.552 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2CCCC2CCC2)C1 ZINC001367555137 1338866280 /nfs/dbraw/zinc/86/62/80/1338866280.db2.gz LJLPSISAPMNXCT-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2CCCC2CCC2)C1 ZINC001367555137 1338866283 /nfs/dbraw/zinc/86/62/83/1338866283.db2.gz LJLPSISAPMNXCT-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2CCCC2CCC2)C1 ZINC001367555135 1338866395 /nfs/dbraw/zinc/86/63/95/1338866395.db2.gz LJLPSISAPMNXCT-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H](CC[N@H+]2CCCC2CCC2)C1 ZINC001367555135 1338866400 /nfs/dbraw/zinc/86/64/00/1338866400.db2.gz LJLPSISAPMNXCT-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)CCC[NH+](C)C)c(Cl)c1 ZINC001367691228 1338932013 /nfs/dbraw/zinc/93/20/13/1338932013.db2.gz KRWDMYULTPJHFI-CQSZACIVSA-N 1 3 325.884 2.585 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(C)c(F)c1 ZINC001367802230 1339021744 /nfs/dbraw/zinc/02/17/44/1339021744.db2.gz IYLYYFAQDCYUGL-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(C)c(F)c1 ZINC001367802230 1339021747 /nfs/dbraw/zinc/02/17/47/1339021747.db2.gz IYLYYFAQDCYUGL-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(C)c(F)c1 ZINC001367802241 1339022018 /nfs/dbraw/zinc/02/20/18/1339022018.db2.gz IYLYYFAQDCYUGL-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(C)c(F)c1 ZINC001367802241 1339022022 /nfs/dbraw/zinc/02/20/22/1339022022.db2.gz IYLYYFAQDCYUGL-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(Cl)c1)NC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001367802567 1339022518 /nfs/dbraw/zinc/02/25/18/1339022518.db2.gz FGJZOXKVTPWPIR-KDOFPFPSSA-N 1 3 349.906 2.618 10 0 EFAEHO Cc1ccccc1CCC[N@@H+](C)C[C@@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001367834564 1339050885 /nfs/dbraw/zinc/05/08/85/1339050885.db2.gz NEFHDKOJFNIPGW-PKOBYXMFSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccccc1CCC[N@H+](C)C[C@@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001367834564 1339050888 /nfs/dbraw/zinc/05/08/88/1339050888.db2.gz NEFHDKOJFNIPGW-PKOBYXMFSA-N 1 3 345.531 2.706 10 0 EFAEHO CCc1ccccc1CC[N@H+](C)C[C@@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001367836057 1339052730 /nfs/dbraw/zinc/05/27/30/1339052730.db2.gz OMPZBTRLOVFCBG-ZWKOTPCHSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[N@@H+](C)C[C@@H](C)NC(=O)CN1CC[C@H](C)C1 ZINC001367836057 1339052733 /nfs/dbraw/zinc/05/27/33/1339052733.db2.gz OMPZBTRLOVFCBG-ZWKOTPCHSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C[N@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001367847634 1339064544 /nfs/dbraw/zinc/06/45/44/1339064544.db2.gz PGOLWALZKWKQCQ-SJLPKXTDSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C[N@@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001367847634 1339064545 /nfs/dbraw/zinc/06/45/45/1339064545.db2.gz PGOLWALZKWKQCQ-SJLPKXTDSA-N 1 3 337.552 2.980 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+][C@@H]1CCc2ccccc21)C1CC1)C1CCC1 ZINC001367909316 1339100463 /nfs/dbraw/zinc/10/04/63/1339100463.db2.gz ZBPWMLGAHFCSBH-UXHICEINSA-N 1 3 341.499 2.643 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@@H]1[NH2+]Cc1ccccc1 ZINC001367924559 1339111066 /nfs/dbraw/zinc/11/10/66/1339111066.db2.gz ASRXTMUNFZCFBH-OALUTQOASA-N 1 3 331.504 2.744 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC[C@@H]2CCN2[C@@H]2CCc3ccccc32)CC1 ZINC001367960007 1339129205 /nfs/dbraw/zinc/12/92/05/1339129205.db2.gz HZXIARZXNPMLBV-AZUAARDMSA-N 1 3 341.499 2.596 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CCN1CC1CC2(CCC2)C1)[NH+]1CCCC1 ZINC001367980434 1339141903 /nfs/dbraw/zinc/14/19/03/1339141903.db2.gz STBXOMVYXBOYBT-RBUKOAKNSA-N 1 3 347.547 2.878 10 0 EFAEHO CCc1ccc(CNC2(CNC(=O)[C@H]3CC[N@H+](C)[C@@H]3CC)CC2)cc1 ZINC001367999435 1339150889 /nfs/dbraw/zinc/15/08/89/1339150889.db2.gz ABJHFBSYVHLOLA-RBUKOAKNSA-N 1 3 343.515 2.718 10 0 EFAEHO CCc1ccc(CNC2(CNC(=O)[C@H]3CC[N@@H+](C)[C@@H]3CC)CC2)cc1 ZINC001367999435 1339150891 /nfs/dbraw/zinc/15/08/91/1339150891.db2.gz ABJHFBSYVHLOLA-RBUKOAKNSA-N 1 3 343.515 2.718 10 0 EFAEHO COc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)cc1 ZINC001368102379 1339195540 /nfs/dbraw/zinc/19/55/40/1339195540.db2.gz GLDUWTMBZUJGCR-SJLPKXTDSA-N 1 3 347.503 2.505 10 0 EFAEHO CCCc1ccc(CN2CC[C@](C)(NC(=O)CC[NH+](C)C)C2)cc1 ZINC001368155760 1339224206 /nfs/dbraw/zinc/22/42/06/1339224206.db2.gz AIAVVXRRAWCUEK-FQEVSTJZSA-N 1 3 331.504 2.671 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2ccc(CF)cc2)C1)N(C)C ZINC001368192588 1339246748 /nfs/dbraw/zinc/24/67/48/1339246748.db2.gz WNJRJNYDUHCBGU-UYAOXDASSA-N 1 3 349.494 2.825 10 0 EFAEHO CC[C@@H](F)CN1CCC(C)(CNC(=O)CC[NH+]2CCCCC2)CC1 ZINC001368209550 1339257262 /nfs/dbraw/zinc/25/72/62/1339257262.db2.gz JYCDILRNXLCRDF-QGZVFWFLSA-N 1 3 341.515 2.829 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1(C)CC[NH+](CC2CCC2)CC1 ZINC001368211135 1339258238 /nfs/dbraw/zinc/25/82/38/1339258238.db2.gz PURBCMJMPLWQRM-IRXDYDNUSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCC(F)(F)[C@H](CNC(=O)CCC[NH+]2CCCCC2)C1 ZINC001368253819 1339284404 /nfs/dbraw/zinc/28/44/04/1339284404.db2.gz UKGONMNHLVCMCE-MRXNPFEDSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC[C@@H](C)F)N(C)C ZINC001368345566 1339308932 /nfs/dbraw/zinc/30/89/32/1339308932.db2.gz HWFRYNMEHBRFEZ-SFFUCWETSA-N 1 3 341.515 2.680 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC[C@@H](C)F)N(C)C ZINC001368345566 1339308934 /nfs/dbraw/zinc/30/89/34/1339308934.db2.gz HWFRYNMEHBRFEZ-SFFUCWETSA-N 1 3 341.515 2.680 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([C@@H](C)[NH2+]Cc2cc(C)ccc2F)C1 ZINC001368348005 1339309891 /nfs/dbraw/zinc/30/98/91/1339309891.db2.gz ULKGXVKLQSFWJW-IAGOWNOFSA-N 1 3 349.494 2.803 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([C@H](C)[NH2+]Cc2cc(C)ccc2F)C1 ZINC001368347993 1339310091 /nfs/dbraw/zinc/31/00/91/1339310091.db2.gz ULKGXVKLQSFWJW-DLBZAZTESA-N 1 3 349.494 2.803 10 0 EFAEHO CN(C[C@@H]1CCN1CC1CCC1)C(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001368403164 1339340961 /nfs/dbraw/zinc/34/09/61/1339340961.db2.gz PTIYGRSIIBSXQW-QFBILLFUSA-N 1 3 339.499 2.532 10 0 EFAEHO CN(C[C@@H]1CCN1CC1CCC1)C(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001368403164 1339340969 /nfs/dbraw/zinc/34/09/69/1339340969.db2.gz PTIYGRSIIBSXQW-QFBILLFUSA-N 1 3 339.499 2.532 10 0 EFAEHO CC[C@H](C(=O)N1CC2(C1)CC[NH+](C[C@H](C)CC(C)C)CC2)N(C)C ZINC001368417943 1339351336 /nfs/dbraw/zinc/35/13/36/1339351336.db2.gz BSPODLNSYGKLMQ-QZTJIDSGSA-N 1 3 337.552 2.933 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCc1ccccc1C[N@H+](C)CCCF ZINC001368426646 1339362403 /nfs/dbraw/zinc/36/24/03/1339362403.db2.gz MOTOZYNHADSLCS-LJQANCHMSA-N 1 3 349.494 2.969 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCc1ccccc1C[N@@H+](C)CCCF ZINC001368426646 1339362409 /nfs/dbraw/zinc/36/24/09/1339362409.db2.gz MOTOZYNHADSLCS-LJQANCHMSA-N 1 3 349.494 2.969 10 0 EFAEHO CC(C)[C@H](C(=O)NCc1cccc2c1CC[N@@H+](C(C)C)C2)N(C)C ZINC001368449482 1339385124 /nfs/dbraw/zinc/38/51/24/1339385124.db2.gz OTZIUQBUUKOURH-LJQANCHMSA-N 1 3 331.504 2.656 10 0 EFAEHO CC(C)[C@H](C(=O)NCc1cccc2c1CC[N@H+](C(C)C)C2)N(C)C ZINC001368449482 1339385128 /nfs/dbraw/zinc/38/51/28/1339385128.db2.gz OTZIUQBUUKOURH-LJQANCHMSA-N 1 3 331.504 2.656 10 0 EFAEHO CC[C@@H](C(=O)NCc1cccc2c1CC[N@H+](CC[C@@H](C)F)C2)N(C)C ZINC001368449527 1339385438 /nfs/dbraw/zinc/38/54/38/1339385438.db2.gz OWPWNEBYYKIKTC-BEFAXECRSA-N 1 3 349.494 2.749 10 0 EFAEHO CC[C@@H](C(=O)NCc1cccc2c1CC[N@@H+](CC[C@@H](C)F)C2)N(C)C ZINC001368449527 1339385443 /nfs/dbraw/zinc/38/54/43/1339385443.db2.gz OWPWNEBYYKIKTC-BEFAXECRSA-N 1 3 349.494 2.749 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001368450994 1339386509 /nfs/dbraw/zinc/38/65/09/1339386509.db2.gz NKEGRCNTSADKMQ-LJQANCHMSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001368479331 1339415580 /nfs/dbraw/zinc/41/55/80/1339415580.db2.gz FEIXOTDSIJAJST-WDYCEAGBSA-N 1 3 349.494 2.705 10 0 EFAEHO Cc1nc(C(C)C)ccc1CNC1(CNC(=O)CC[NH+](C)C)CCC1 ZINC001368484401 1339420681 /nfs/dbraw/zinc/42/06/81/1339420681.db2.gz HBMKZTSKOGBGRQ-UHFFFAOYSA-N 1 3 346.519 2.594 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]Cc2cccc(F)c2)CCC1)N1CCCC1 ZINC001368488576 1339425924 /nfs/dbraw/zinc/42/59/24/1339425924.db2.gz RCSLYKDCJORVGW-UHFFFAOYSA-N 1 3 347.478 2.829 10 0 EFAEHO Cc1cccc(Cl)c1CNC1(CNC(=O)CC[NH+](C)C)CCC1 ZINC001368491833 1339429674 /nfs/dbraw/zinc/42/96/74/1339429674.db2.gz YEMNQTFKLNNHCY-UHFFFAOYSA-N 1 3 337.895 2.729 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@H]1C[C@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001368594325 1339540096 /nfs/dbraw/zinc/54/00/96/1339540096.db2.gz VPSPFURCZJTJDR-NNFUDEMPSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+]CC2CCC(F)(F)CC2)C1 ZINC001368607782 1339547984 /nfs/dbraw/zinc/54/79/84/1339547984.db2.gz KHKRHYLTEVACKX-WKILWMFISA-N 1 3 345.478 2.637 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@@H]1CC[C@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001368639670 1339560128 /nfs/dbraw/zinc/56/01/28/1339560128.db2.gz AEMHZRLIVTWWML-OWCLPIDISA-N 1 3 329.504 2.587 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)[C@H](C)C1 ZINC001368693900 1339607668 /nfs/dbraw/zinc/60/76/68/1339607668.db2.gz DGXAVDMPAZALRK-SJLPKXTDSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)[C@H](C)C1 ZINC001368693900 1339607673 /nfs/dbraw/zinc/60/76/73/1339607673.db2.gz DGXAVDMPAZALRK-SJLPKXTDSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H](C)NCc1c(F)cccc1F)[NH+](C)C ZINC001368751823 1339676628 /nfs/dbraw/zinc/67/66/28/1339676628.db2.gz XANGWNZVJUUHCL-SUMWQHHRSA-N 1 3 341.446 2.535 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H](C)[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC001368756738 1339682611 /nfs/dbraw/zinc/68/26/11/1339682611.db2.gz WBQBONDMDTXFJY-ZWKOTPCHSA-N 1 3 345.531 2.616 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N1CCCCC[C@@H]([NH2+]C/C=C/Cl)C1 ZINC001368761780 1339687921 /nfs/dbraw/zinc/68/79/21/1339687921.db2.gz QTDSUZXFKQQVRA-JSMQFAGNSA-N 1 3 341.927 2.973 10 0 EFAEHO COc1ccc(C[NH2+]C[C@@H]2CCCCN2C(=O)CN(C)C(C)C)cc1 ZINC001368786778 1339714725 /nfs/dbraw/zinc/71/47/25/1339714725.db2.gz QFZJOODXIKFWQP-SFHVURJKSA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@H]1C ZINC001368788518 1339717524 /nfs/dbraw/zinc/71/75/24/1339717524.db2.gz CNKUTQNOKQBILF-NZSAHSFTSA-N 1 3 331.504 2.660 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@H]1C ZINC001368788518 1339717525 /nfs/dbraw/zinc/71/75/25/1339717525.db2.gz CNKUTQNOKQBILF-NZSAHSFTSA-N 1 3 331.504 2.660 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]1C[N@H+](C)CCC1CCCCC1 ZINC001368788830 1339717563 /nfs/dbraw/zinc/71/75/63/1339717563.db2.gz LWVHUAAJHBVPGT-MOPGFXCFSA-N 1 3 335.536 2.974 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]1C[N@@H+](C)CCC1CCCCC1 ZINC001368788830 1339717566 /nfs/dbraw/zinc/71/75/66/1339717566.db2.gz LWVHUAAJHBVPGT-MOPGFXCFSA-N 1 3 335.536 2.974 10 0 EFAEHO CN(C)C1(C(=O)NC2CC(C[NH2+]Cc3cccc(Cl)c3)C2)CCC1 ZINC001368813308 1339752182 /nfs/dbraw/zinc/75/21/82/1339752182.db2.gz YPHVEUVIANRSCZ-UHFFFAOYSA-N 1 3 349.906 2.809 10 0 EFAEHO CCc1ccc(C[NH2+]CC2CC(NC(=O)[C@H](C(C)C)N(C)C)C2)cc1 ZINC001368813366 1339752863 /nfs/dbraw/zinc/75/28/63/1339752863.db2.gz ZRBUDTLUYMOYKG-MHJFOBGBSA-N 1 3 345.531 2.820 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]Cc2ccc(Cl)cc2)C1 ZINC001368822401 1339761758 /nfs/dbraw/zinc/76/17/58/1339761758.db2.gz KZXJRLZFFZDPEN-UHFFFAOYSA-N 1 3 337.895 2.666 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2cc(C)sc2C)C1)N(C)C ZINC001368822729 1339762291 /nfs/dbraw/zinc/76/22/91/1339762291.db2.gz NZPUHMSJCZITFV-BDVYOWHSSA-N 1 3 337.533 2.690 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@H+](Cc2ccccn2)CC(C)(C)C1)N(C)C ZINC001368823428 1339763004 /nfs/dbraw/zinc/76/30/04/1339763004.db2.gz CCCRKDVHUOVZGF-FUHWJXTLSA-N 1 3 346.519 2.529 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@@H+](Cc2ccccn2)CC(C)(C)C1)N(C)C ZINC001368823428 1339763012 /nfs/dbraw/zinc/76/30/12/1339763012.db2.gz CCCRKDVHUOVZGF-FUHWJXTLSA-N 1 3 346.519 2.529 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1CC[C@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001368826916 1339767321 /nfs/dbraw/zinc/76/73/21/1339767321.db2.gz MYPZNAYHFAOTDS-CVEARBPZSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@@H](F)C[N@H+]1CC[C@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001368826916 1339767324 /nfs/dbraw/zinc/76/73/24/1339767324.db2.gz MYPZNAYHFAOTDS-CVEARBPZSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@H](F)C[N@@H+]1CC[C@@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001368826919 1339767379 /nfs/dbraw/zinc/76/73/79/1339767379.db2.gz MYPZNAYHFAOTDS-JKSUJKDBSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@H](F)C[N@H+]1CC[C@@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001368826919 1339767384 /nfs/dbraw/zinc/76/73/84/1339767384.db2.gz MYPZNAYHFAOTDS-JKSUJKDBSA-N 1 3 341.515 2.826 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[N@H+](CCCF)CC(C)(C)C1)CC(C)(C)C ZINC001368830021 1339771271 /nfs/dbraw/zinc/77/12/71/1339771271.db2.gz XYDTVMUSVOLZBF-MRXNPFEDSA-N 1 3 343.531 2.931 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[N@@H+](CCCF)CC(C)(C)C1)CC(C)(C)C ZINC001368830021 1339771272 /nfs/dbraw/zinc/77/12/72/1339771272.db2.gz XYDTVMUSVOLZBF-MRXNPFEDSA-N 1 3 343.531 2.931 10 0 EFAEHO Cc1ncccc1C[NH2+][C@H](C)[C@@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001368845948 1339784514 /nfs/dbraw/zinc/78/45/14/1339784514.db2.gz BZXXDTCAUDFMQL-HZPDHXFCSA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001368902751 1339844137 /nfs/dbraw/zinc/84/41/37/1339844137.db2.gz VEJVBGXOMHHQFJ-RYUDHWBXSA-N 1 3 331.913 2.725 10 0 EFAEHO C[C@@H](NCC=C(Cl)Cl)[C@@H](C)NC(=O)CCC[NH+]1CCCC1 ZINC001368890415 1339828743 /nfs/dbraw/zinc/82/87/43/1339828743.db2.gz GJQJPUGMOUTABN-CHWSQXEVSA-N 1 3 336.307 2.664 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC(C)(C)C[NH2+]Cc1cccc(F)c1 ZINC001368925236 1339870924 /nfs/dbraw/zinc/87/09/24/1339870924.db2.gz QGRXXROMIQCLHD-UHFFFAOYSA-N 1 3 337.483 2.740 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)C1C[NH+](CCC2CCCCC2)C1 ZINC001369085984 1339905238 /nfs/dbraw/zinc/90/52/38/1339905238.db2.gz XETXUNLBRNYKHD-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(C)c(CN2CC([C@H](C)NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)c1 ZINC001369089974 1339908751 /nfs/dbraw/zinc/90/87/51/1339908751.db2.gz FROAKSFNIIOMPU-ROUUACIJSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(C)c(CN2CC([C@H](C)NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)c1 ZINC001369089974 1339908752 /nfs/dbraw/zinc/90/87/52/1339908752.db2.gz FROAKSFNIIOMPU-ROUUACIJSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(C)c(CN2CC([C@H](C)NC(=O)C[C@H]3CC[N@H+](C)C3)C2)c1 ZINC001369089982 1339909142 /nfs/dbraw/zinc/90/91/42/1339909142.db2.gz FROAKSFNIIOMPU-ZWKOTPCHSA-N 1 3 343.515 2.582 10 0 EFAEHO Cc1ccc(C)c(CN2CC([C@H](C)NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)c1 ZINC001369089982 1339909149 /nfs/dbraw/zinc/90/91/49/1339909149.db2.gz FROAKSFNIIOMPU-ZWKOTPCHSA-N 1 3 343.515 2.582 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@@H](C)C1)C1C[NH+](CCCC2CCCC2)C1 ZINC001369094785 1339911875 /nfs/dbraw/zinc/91/18/75/1339911875.db2.gz PUKNSFBDVUATQN-SJORKVTESA-N 1 3 335.536 2.735 10 0 EFAEHO Cc1cc(CN2CC([C@H](C)NC(=O)C[C@H]3CC[N@H+](C)C3)C2)c(C)s1 ZINC001369097206 1339913486 /nfs/dbraw/zinc/91/34/86/1339913486.db2.gz PNPTUQDKBZCAFG-GOEBONIOSA-N 1 3 349.544 2.643 10 0 EFAEHO Cc1cc(CN2CC([C@H](C)NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)c(C)s1 ZINC001369097206 1339913491 /nfs/dbraw/zinc/91/34/91/1339913491.db2.gz PNPTUQDKBZCAFG-GOEBONIOSA-N 1 3 349.544 2.643 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCCC3CCCC3)C[C@H]21)N(C)C ZINC001369140358 1339938926 /nfs/dbraw/zinc/93/89/26/1339938926.db2.gz LDNAORYPNROKPB-OKYOBFRVSA-N 1 3 335.536 2.591 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCCC3CCCC3)C[C@H]21)N(C)C ZINC001369140358 1339938928 /nfs/dbraw/zinc/93/89/28/1339938928.db2.gz LDNAORYPNROKPB-OKYOBFRVSA-N 1 3 335.536 2.591 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+][C@H](CNC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001370275600 1340003198 /nfs/dbraw/zinc/00/31/98/1340003198.db2.gz ODKIRZNLAGGLKS-QFBILLFUSA-N 1 3 331.504 2.881 10 0 EFAEHO CN(C/C=C\Cl)C[C@@H]1CCCN(C(=O)CC[C@H]2CCC[N@@H+]2C)C1 ZINC001370292339 1340013539 /nfs/dbraw/zinc/01/35/39/1340013539.db2.gz AZIJCWSUIRCLEP-UOHAWKTFSA-N 1 3 341.927 2.784 10 0 EFAEHO CN(C/C=C\Cl)C[C@@H]1CCCN(C(=O)CC[C@H]2CCC[N@H+]2C)C1 ZINC001370292339 1340013543 /nfs/dbraw/zinc/01/35/43/1340013543.db2.gz AZIJCWSUIRCLEP-UOHAWKTFSA-N 1 3 341.927 2.784 10 0 EFAEHO CCC(CC)C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](F)CN(CC)CC ZINC001370331357 1340039161 /nfs/dbraw/zinc/03/91/61/1340039161.db2.gz NSBRLJNRKRPNIR-KSZLIROESA-N 1 3 341.515 2.778 10 0 EFAEHO CCC(CC)C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](F)CN(CC)CC ZINC001370331357 1340039165 /nfs/dbraw/zinc/03/91/65/1340039165.db2.gz NSBRLJNRKRPNIR-KSZLIROESA-N 1 3 341.515 2.778 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]([NH2+]C[C@@H]3CCCC(F)(F)C3)C2)CCC1 ZINC001370481629 1340095385 /nfs/dbraw/zinc/09/53/85/1340095385.db2.gz FFERPQVFMHXCNS-RBSFLKMASA-N 1 3 343.462 2.533 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@@H](C(=O)N[C@H]2C[C@H](NCC=C(Cl)Cl)C2)C1 ZINC001370531971 1340119351 /nfs/dbraw/zinc/11/93/51/1340119351.db2.gz HDJYFNNUTSMSEZ-SYQHCUMBSA-N 1 3 348.318 2.663 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)N[C@H]2C[C@H](NCC=C(Cl)Cl)C2)C1 ZINC001370531973 1340119580 /nfs/dbraw/zinc/11/95/80/1340119580.db2.gz HDJYFNNUTSMSEZ-XDQVBPFNSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H]([NH2+]CC2CCC3(CC3)CC2)C1)N(C)C ZINC001370547178 1340127691 /nfs/dbraw/zinc/12/76/91/1340127691.db2.gz LKFULJAEFXUWAM-KZNAEPCWSA-N 1 3 335.536 2.780 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H](NC(=O)CC[C@@H]2CCC[N@@H+]2C)C1)c1ccccc1F ZINC001370640926 1340178871 /nfs/dbraw/zinc/17/88/71/1340178871.db2.gz UJFLXUBAIREJPD-NXOAAHMSSA-N 1 3 347.478 2.998 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H](NC(=O)CC[C@@H]2CCC[N@H+]2C)C1)c1ccccc1F ZINC001370640926 1340178875 /nfs/dbraw/zinc/17/88/75/1340178875.db2.gz UJFLXUBAIREJPD-NXOAAHMSSA-N 1 3 347.478 2.998 10 0 EFAEHO C[C@@H](N[C@H]1C[C@@H](NC(=O)CC[C@@H]2CCC[N@@H+]2C)C1)c1ccccc1F ZINC001370640914 1340179046 /nfs/dbraw/zinc/17/90/46/1340179046.db2.gz UJFLXUBAIREJPD-NCOADZHNSA-N 1 3 347.478 2.998 10 0 EFAEHO C[C@@H](N[C@H]1C[C@@H](NC(=O)CC[C@@H]2CCC[N@H+]2C)C1)c1ccccc1F ZINC001370640914 1340179049 /nfs/dbraw/zinc/17/90/49/1340179049.db2.gz UJFLXUBAIREJPD-NCOADZHNSA-N 1 3 347.478 2.998 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCc3c2cccc3F)C1)N(C)C ZINC001370647134 1340179472 /nfs/dbraw/zinc/17/94/72/1340179472.db2.gz FDSYLRHVHVAXGY-FTUNRGFVSA-N 1 3 347.478 2.636 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCc3c2cccc3F)C1)N(C)C ZINC001370647127 1340179539 /nfs/dbraw/zinc/17/95/39/1340179539.db2.gz FDSYLRHVHVAXGY-CFGMGRTJSA-N 1 3 347.478 2.636 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)CC(C)(C)C)C2)c1 ZINC001370675332 1340183862 /nfs/dbraw/zinc/18/38/62/1340183862.db2.gz HHUQESSBTWTHSC-CALCHBBNSA-N 1 3 349.494 2.849 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(Cl)cc32)C1 ZINC001370713883 1340187990 /nfs/dbraw/zinc/18/79/90/1340187990.db2.gz PHAXOKUHFCEKRS-JZXOWHBKSA-N 1 3 349.906 2.906 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)CCC[NH+]3CCCC3)C2)c1 ZINC001370729100 1340191415 /nfs/dbraw/zinc/19/14/15/1340191415.db2.gz IDWQOEWFLVJNIL-HDICACEKSA-N 1 3 347.478 2.747 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(F)c(F)c2)C1 ZINC001370734527 1340192916 /nfs/dbraw/zinc/19/29/16/1340192916.db2.gz RVJCZNGVQZDZSW-AEGPPILISA-N 1 3 339.430 2.603 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)C1 ZINC001370738617 1340194182 /nfs/dbraw/zinc/19/41/82/1340194182.db2.gz XWDOOCLATZBQPI-NCAZDIKSSA-N 1 3 341.499 2.809 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@H+](CCC(C)(C)C)C1)N(C)C ZINC001370747929 1340195847 /nfs/dbraw/zinc/19/58/47/1340195847.db2.gz CUWCZOPRHSUHHN-SJORKVTESA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@@H+](CCC(C)(C)C)C1)N(C)C ZINC001370747929 1340195850 /nfs/dbraw/zinc/19/58/50/1340195850.db2.gz CUWCZOPRHSUHHN-SJORKVTESA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[NH2+]Cc2ccc(CF)cc2)C1 ZINC001370828797 1340223009 /nfs/dbraw/zinc/22/30/09/1340223009.db2.gz JMWPJMQZLRSBDY-LJQANCHMSA-N 1 3 349.494 2.825 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@H]1CCCCN1Cc1ccc(CF)cc1 ZINC001370891154 1340262754 /nfs/dbraw/zinc/26/27/54/1340262754.db2.gz YOOBERBMPNVRFM-GOSISDBHSA-N 1 3 335.467 2.579 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001371183267 1340399871 /nfs/dbraw/zinc/39/98/71/1340399871.db2.gz YHMMNZHYJLULPR-JXFKEZNVSA-N 1 3 343.515 2.642 10 0 EFAEHO C[C@H](CNC(=O)CC[N@H+](C)C1CCCCC1)NCc1ccsc1 ZINC001371319410 1340494797 /nfs/dbraw/zinc/49/47/97/1340494797.db2.gz WUYJAOPZYYPHJH-OAHLLOKOSA-N 1 3 337.533 2.997 10 0 EFAEHO C[C@H](CNC(=O)CC[N@@H+](C)C1CCCCC1)NCc1ccsc1 ZINC001371319410 1340494801 /nfs/dbraw/zinc/49/48/01/1340494801.db2.gz WUYJAOPZYYPHJH-OAHLLOKOSA-N 1 3 337.533 2.997 10 0 EFAEHO C[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC(C)(C)C ZINC001371364627 1340531415 /nfs/dbraw/zinc/53/14/15/1340531415.db2.gz OUNALXMAVKDNAT-KBXCAEBGSA-N 1 3 329.504 2.729 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001371621604 1340680335 /nfs/dbraw/zinc/68/03/35/1340680335.db2.gz RSJNMZZMDWTZHF-SFHVURJKSA-N 1 3 335.536 2.737 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001371870416 1340732152 /nfs/dbraw/zinc/73/21/52/1340732152.db2.gz SEBSBDDOOJJARY-WCQYABFASA-N 1 3 331.913 2.726 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@H](C)CCNC(=O)Cc2nc[nH]c2C)c1 ZINC001371880377 1340736016 /nfs/dbraw/zinc/73/60/16/1340736016.db2.gz JCPHHOFNNWKXKH-ZIAGYGMSSA-N 1 3 344.459 2.515 10 0 EFAEHO C[C@@H](F)CC[N@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001372860169 1340847833 /nfs/dbraw/zinc/84/78/33/1340847833.db2.gz QDKHNZICPUZISV-KDOFPFPSSA-N 1 3 345.478 2.528 10 0 EFAEHO C[C@@H](F)CC[N@@H+](CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001372860169 1340847839 /nfs/dbraw/zinc/84/78/39/1340847839.db2.gz QDKHNZICPUZISV-KDOFPFPSSA-N 1 3 345.478 2.528 10 0 EFAEHO C[C@H](F)CC[N@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001372860163 1340848058 /nfs/dbraw/zinc/84/80/58/1340848058.db2.gz QDKHNZICPUZISV-KBXCAEBGSA-N 1 3 345.478 2.528 10 0 EFAEHO C[C@H](F)CC[N@@H+](CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001372860163 1340848061 /nfs/dbraw/zinc/84/80/61/1340848061.db2.gz QDKHNZICPUZISV-KBXCAEBGSA-N 1 3 345.478 2.528 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@H](CNC(=O)C1(N(C)C)CCC1)c1ccccc1 ZINC001373055628 1340886987 /nfs/dbraw/zinc/88/69/87/1340886987.db2.gz FCZSTFGIEWXKRK-NVXWUHKLSA-N 1 3 335.467 2.666 10 0 EFAEHO Cc1ccccc1C[N@H+]1CC[C@@H](CCNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001373220738 1340954300 /nfs/dbraw/zinc/95/43/00/1340954300.db2.gz CFRNRYSPRZMWRO-IEBWSBKVSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CC[C@@H](CCNC(=O)CN2CC[C@@H](C)C2)C1 ZINC001373220738 1340954301 /nfs/dbraw/zinc/95/43/01/1340954301.db2.gz CFRNRYSPRZMWRO-IEBWSBKVSA-N 1 3 343.515 2.665 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](CCc2ccccc2F)C1)N(C)C ZINC001373242049 1340964388 /nfs/dbraw/zinc/96/43/88/1340964388.db2.gz YGVWNNXHJLWOEG-QFBILLFUSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](CCc2ccccc2F)C1)N(C)C ZINC001373242049 1340964389 /nfs/dbraw/zinc/96/43/89/1340964389.db2.gz YGVWNNXHJLWOEG-QFBILLFUSA-N 1 3 349.494 2.537 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)N2CC[C@@H](CN(C)C/C=C/Cl)C2)C1 ZINC001373295714 1340980750 /nfs/dbraw/zinc/98/07/50/1340980750.db2.gz XKBYSOKHRYQHGG-DIYXLRBJSA-N 1 3 341.927 2.641 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)N2CC[C@@H](CN(C)C/C=C/Cl)C2)C1 ZINC001373295714 1340980751 /nfs/dbraw/zinc/98/07/51/1340980751.db2.gz XKBYSOKHRYQHGG-DIYXLRBJSA-N 1 3 341.927 2.641 10 0 EFAEHO C[N@H+](C/C=C/c1ccccc1)C[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001373318331 1340989208 /nfs/dbraw/zinc/98/92/08/1340989208.db2.gz WBGIVEFQVXIABX-OSICKASQSA-N 1 3 341.499 2.576 10 0 EFAEHO C[N@@H+](C/C=C/c1ccccc1)C[C@@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001373318331 1340989209 /nfs/dbraw/zinc/98/92/09/1340989209.db2.gz WBGIVEFQVXIABX-OSICKASQSA-N 1 3 341.499 2.576 10 0 EFAEHO CC(C)C[C@@H](C)CN1C[C@@H]2C[C@H]1CN2C(=O)C(C)(C)[NH+]1CCCC1 ZINC001373572629 1341057661 /nfs/dbraw/zinc/05/76/61/1341057661.db2.gz MBSLFYJQVNLHSJ-SQNIBIBYSA-N 1 3 335.536 2.828 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)N1CCCCC1)[NH2+]Cc1ccsc1 ZINC001373753197 1341134452 /nfs/dbraw/zinc/13/44/52/1341134452.db2.gz MAOKOWDRLDZLGY-INIZCTEOSA-N 1 3 337.533 2.997 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]CC1CC2(CCC2)C1 ZINC001373753284 1341134514 /nfs/dbraw/zinc/13/45/14/1341134514.db2.gz MFYWNMVYSISCTD-QZTJIDSGSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]CCc1ccccc1 ZINC001373754003 1341134948 /nfs/dbraw/zinc/13/49/48/1341134948.db2.gz OAJOFDYMTDRFKE-OALUTQOASA-N 1 3 331.504 2.586 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccccc1C ZINC001373754964 1341135188 /nfs/dbraw/zinc/13/51/88/1341135188.db2.gz QTAFTKGYMIZRJT-RBUKOAKNSA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccc(F)cc1C ZINC001373754952 1341135441 /nfs/dbraw/zinc/13/54/41/1341135441.db2.gz QRGFGOJHGFZBRL-RBUKOAKNSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)NCc1cc(C)ccc1F ZINC001373791314 1341148663 /nfs/dbraw/zinc/14/86/63/1341148663.db2.gz ONBDGXFAOQEDME-XYJFISCASA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)NCc1cc(C)ccc1F ZINC001373791314 1341148665 /nfs/dbraw/zinc/14/86/65/1341148665.db2.gz ONBDGXFAOQEDME-XYJFISCASA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1c(C)cccc1Cl ZINC001373834981 1341167771 /nfs/dbraw/zinc/16/77/71/1341167771.db2.gz KRNCFNXSMWURFW-HNNXBMFYSA-N 1 3 339.911 2.973 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)C[NH2+]Cc1ccc(C2CC2)cc1 ZINC001374069709 1341360671 /nfs/dbraw/zinc/36/06/71/1341360671.db2.gz CFEDOKRVZRTICF-IAGOWNOFSA-N 1 3 343.515 2.748 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001374079820 1341373692 /nfs/dbraw/zinc/37/36/92/1341373692.db2.gz QESFNWICJBOLAD-ZWKOTPCHSA-N 1 3 345.531 2.994 10 0 EFAEHO CC[C@@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]Cc1ccc(C)nc1C ZINC001391715697 1355458351 /nfs/dbraw/zinc/45/83/51/1355458351.db2.gz BEXLUIDKVKWZPX-SFHVURJKSA-N 1 3 348.535 2.661 10 0 EFAEHO CCc1ccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001374276897 1341647979 /nfs/dbraw/zinc/64/79/79/1341647979.db2.gz BOGATCMQUTVRRP-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC001374327432 1341730518 /nfs/dbraw/zinc/73/05/18/1341730518.db2.gz JGZRNAOOYUWDKW-QZTJIDSGSA-N 1 3 345.531 2.568 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1C ZINC001374383387 1341832927 /nfs/dbraw/zinc/83/29/27/1341832927.db2.gz JNTMJNQVJSKSDP-QUCCMNQESA-N 1 3 345.531 2.970 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)CCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001392316615 1355976712 /nfs/dbraw/zinc/97/67/12/1355976712.db2.gz XETHUZVPIQACLA-MAUKXSAKSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)CCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001392316613 1355976970 /nfs/dbraw/zinc/97/69/70/1355976970.db2.gz XETHUZVPIQACLA-CRAIPNDOSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)CCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001392316613 1355976975 /nfs/dbraw/zinc/97/69/75/1355976975.db2.gz XETHUZVPIQACLA-CRAIPNDOSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](C)C[N@H+](C)CCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001392316647 1355977462 /nfs/dbraw/zinc/97/74/62/1355977462.db2.gz XETHUZVPIQACLA-YJBOKZPZSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)CCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001392316647 1355977466 /nfs/dbraw/zinc/97/74/66/1355977466.db2.gz XETHUZVPIQACLA-YJBOKZPZSA-N 1 3 329.504 2.635 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2c1cccc2F)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001392319961 1355982685 /nfs/dbraw/zinc/98/26/85/1355982685.db2.gz QVUPMFCMGXTQCS-KXBFYZLASA-N 1 3 347.478 2.545 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2c1cccc2F)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001392319961 1355982687 /nfs/dbraw/zinc/98/26/87/1355982687.db2.gz QVUPMFCMGXTQCS-KXBFYZLASA-N 1 3 347.478 2.545 10 0 EFAEHO CC(C)[C@H](CNC(=O)CC[NH+](C)C)N[C@H](C)c1ccc(F)cc1F ZINC001374432581 1341914764 /nfs/dbraw/zinc/91/47/64/1341914764.db2.gz VOUUJTKVHJOQLV-DYVFJYSZSA-N 1 3 341.446 2.708 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CC[NH+](C)C)N[C@@H](C)c1ccc(F)cc1F ZINC001374432583 1341914997 /nfs/dbraw/zinc/91/49/97/1341914997.db2.gz VOUUJTKVHJOQLV-SUMWQHHRSA-N 1 3 341.446 2.708 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]C/C=C/c1ccccc1 ZINC001374433974 1341916876 /nfs/dbraw/zinc/91/68/76/1341916876.db2.gz NENABWQKIUCPTE-MRRRUUNJSA-N 1 3 343.515 2.772 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CC2(CCC2)C1 ZINC001374434130 1341917608 /nfs/dbraw/zinc/91/76/08/1341917608.db2.gz PSGMZSJSDGHFKI-SJLPKXTDSA-N 1 3 335.536 2.639 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]C/C=C\Cl ZINC001374438639 1341922039 /nfs/dbraw/zinc/92/20/39/1341922039.db2.gz HRVFMSUMFANKAV-RDIIQDETSA-N 1 3 329.916 2.732 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccccc1Cl)C(C)C)N(C)C ZINC001374443491 1341927797 /nfs/dbraw/zinc/92/77/97/1341927797.db2.gz KPGAFCPDDHPHJF-IAGOWNOFSA-N 1 3 339.911 2.911 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@@H]2CCC[C@@H]3CCC[N@@H+]32)cc1 ZINC001374544420 1342048424 /nfs/dbraw/zinc/04/84/24/1342048424.db2.gz HGQPBSYRWSIICM-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)[C@@H]2CCC[C@@H]3CCC[N@H+]32)cc1 ZINC001374544420 1342048425 /nfs/dbraw/zinc/04/84/25/1342048425.db2.gz HGQPBSYRWSIICM-UXHICEINSA-N 1 3 343.515 2.902 10 0 EFAEHO CN(CCN(C)C(=O)[C@H]1CCC[C@H]([NH+](C)C)C1)Cc1ccccc1 ZINC001374551810 1342060632 /nfs/dbraw/zinc/06/06/32/1342060632.db2.gz TYPSVLONLLASMD-OALUTQOASA-N 1 3 331.504 2.697 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCN(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001374552305 1342062416 /nfs/dbraw/zinc/06/24/16/1342062416.db2.gz IJUPIYCCAODYPW-SFHVURJKSA-N 1 3 331.504 2.535 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001374552305 1342062419 /nfs/dbraw/zinc/06/24/19/1342062419.db2.gz IJUPIYCCAODYPW-SFHVURJKSA-N 1 3 331.504 2.535 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H]2CCC[C@@H]2NC(=O)CN(C)C(C)C)c1 ZINC001374569000 1342081009 /nfs/dbraw/zinc/08/10/09/1342081009.db2.gz KYFOKXGEQZFTTL-MOPGFXCFSA-N 1 3 331.504 2.710 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+]CC[C@H](C)NC(=O)Cc2nc[nH]c2C)c1 ZINC001374702954 1342121040 /nfs/dbraw/zinc/12/10/40/1342121040.db2.gz AWHQABUJKJKGHE-UONOGXRCSA-N 1 3 344.459 2.515 10 0 EFAEHO C[C@H](C[NH2+]CC1CC2(CCC2)C1)NC(=O)C(C)(C)N1CCCCC1 ZINC001374756183 1342154514 /nfs/dbraw/zinc/15/45/14/1342154514.db2.gz NIQGEFMTFWWVLO-MRXNPFEDSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc2ccccc2c1)NC(=O)CN1CC[C@@H](C)C1 ZINC001374814300 1342185599 /nfs/dbraw/zinc/18/55/99/1342185599.db2.gz LYDJJLDPRFKEAI-IAGOWNOFSA-N 1 3 339.483 2.776 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@H](C)NC(=O)[C@H]1CCC[N@@H+]1C(C)C ZINC001375042045 1342340029 /nfs/dbraw/zinc/34/00/29/1342340029.db2.gz ZFFNFANYZBCXPW-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@H](C)NC(=O)[C@H]1CCC[N@H+]1C(C)C ZINC001375042045 1342340034 /nfs/dbraw/zinc/34/00/34/1342340034.db2.gz ZFFNFANYZBCXPW-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(F)c1 ZINC001375041256 1342340442 /nfs/dbraw/zinc/34/04/42/1342340442.db2.gz XREAFDFMFWBENJ-CRAIPNDOSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(F)c1 ZINC001375041256 1342340450 /nfs/dbraw/zinc/34/04/50/1342340450.db2.gz XREAFDFMFWBENJ-CRAIPNDOSA-N 1 3 335.467 2.635 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@@H](C)NC(=O)[C@H]1CCC[N@@H+]1C(C)C ZINC001375042046 1342340584 /nfs/dbraw/zinc/34/05/84/1342340584.db2.gz ZFFNFANYZBCXPW-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@@H](C)NC(=O)[C@H]1CCC[N@H+]1C(C)C ZINC001375042046 1342340590 /nfs/dbraw/zinc/34/05/90/1342340590.db2.gz ZFFNFANYZBCXPW-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC[C@@](C)(CNC(=O)CN(C)C(C)C)C1 ZINC001393210906 1356727434 /nfs/dbraw/zinc/72/74/34/1356727434.db2.gz XUJRKOCESHAKGX-IBGZPJMESA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)CCC[N@H+]1CCC[C@@](C)(CNC(=O)CN(C)C(C)C)C1 ZINC001393210906 1356727438 /nfs/dbraw/zinc/72/74/38/1356727438.db2.gz XUJRKOCESHAKGX-IBGZPJMESA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(C(F)(F)F)c1)NC(=O)CC[NH+](C)C ZINC001375092322 1342400289 /nfs/dbraw/zinc/40/02/89/1342400289.db2.gz BXNHIPHHZMUHSI-CYBMUJFWSA-N 1 3 345.409 2.594 10 0 EFAEHO Cc1ccc(C)c(C[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001375101093 1342410472 /nfs/dbraw/zinc/41/04/72/1342410472.db2.gz HCKIKEJUQAOOEL-WMZOPIPTSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1ccc(C)c(C[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001375101093 1342410473 /nfs/dbraw/zinc/41/04/73/1342410473.db2.gz HCKIKEJUQAOOEL-WMZOPIPTSA-N 1 3 331.504 2.582 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C[NH2+]CC1CCC(C)CC1)C1CC1 ZINC001375266045 1342570852 /nfs/dbraw/zinc/57/08/52/1342570852.db2.gz BUDHFMJPMARVQK-RWKZGTHUSA-N 1 3 332.492 2.571 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C[NH2+]CC1CCC(C)CC1)C1CC1 ZINC001375266042 1342570962 /nfs/dbraw/zinc/57/09/62/1342570962.db2.gz BUDHFMJPMARVQK-LEHRNKBSSA-N 1 3 332.492 2.571 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC2(C1)CCN(Cc1ccc(Cl)cc1)CC2 ZINC001393495552 1356896737 /nfs/dbraw/zinc/89/67/37/1356896737.db2.gz LBDVPKZXGUNMAL-UHFFFAOYSA-N 1 3 349.906 2.716 10 0 EFAEHO Cc1ccc(CNC[C@@H](NC(=O)[C@H]2CC[N@@H+](C)C2)C2CC2)c(Cl)c1 ZINC001375275299 1342582553 /nfs/dbraw/zinc/58/25/53/1342582553.db2.gz WMUOPIAGTPQOCX-FUHWJXTLSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1ccc(CNC[C@@H](NC(=O)[C@H]2CC[N@H+](C)C2)C2CC2)c(Cl)c1 ZINC001375275299 1342582554 /nfs/dbraw/zinc/58/25/54/1342582554.db2.gz WMUOPIAGTPQOCX-FUHWJXTLSA-N 1 3 349.906 2.585 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CC2CC(C)(C)C2)[C@@H](CC)C1 ZINC001375285232 1342592827 /nfs/dbraw/zinc/59/28/27/1342592827.db2.gz KXJUSJUDWIECDR-ROUUACIJSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]Cc1cccc(F)c1 ZINC001375290343 1342597561 /nfs/dbraw/zinc/59/75/61/1342597561.db2.gz UGRFYQDBDXDLNS-IEBWSBKVSA-N 1 3 349.494 2.883 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+]Cc2ccsc2)CCC1 ZINC001393544681 1356936027 /nfs/dbraw/zinc/93/60/27/1356936027.db2.gz JBVAULMGDRBJHI-INIZCTEOSA-N 1 3 335.517 2.751 10 0 EFAEHO CC(C)CCCN1CC[C@@H]1CNC(=O)c1ccc(C[NH+](C)C)cc1 ZINC001375354914 1342660889 /nfs/dbraw/zinc/66/08/89/1342660889.db2.gz VGDAWMYNGPFVSM-LJQANCHMSA-N 1 3 331.504 2.989 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]CC2CC(C)(C)C2)CC1)N1CCCCC1 ZINC001375421155 1342724867 /nfs/dbraw/zinc/72/48/67/1342724867.db2.gz LSYZUAOTUJJQBD-UHFFFAOYSA-N 1 3 335.536 2.926 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC001375425825 1342728864 /nfs/dbraw/zinc/72/88/64/1342728864.db2.gz SSTKFJHQMAUVKE-LSDHHAIUSA-N 1 3 343.462 2.535 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@@H+]2CCCC2CCCC2)C1 ZINC001375464097 1342770373 /nfs/dbraw/zinc/77/03/73/1342770373.db2.gz GMZJDMREXQDMEZ-IEBWSBKVSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C[C@H]2CC[N@H+]2CCCC2CCCC2)C1 ZINC001375464097 1342770379 /nfs/dbraw/zinc/77/03/79/1342770379.db2.gz GMZJDMREXQDMEZ-IEBWSBKVSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H](NC1(CNC(=O)CCC[NH+](C)C)CC1)c1cccc(Cl)c1 ZINC001375469616 1342776375 /nfs/dbraw/zinc/77/63/75/1342776375.db2.gz JJWWDUZUYGNQFI-AWEZNQCLSA-N 1 3 337.895 2.981 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2C[C@@H]([NH2+][C@@H]3CCc4ccccc43)C2)CCC1 ZINC001375495199 1342801303 /nfs/dbraw/zinc/80/13/03/1342801303.db2.gz MUYDAAAUMPPDEQ-HHXXYDBFSA-N 1 3 341.499 2.643 10 0 EFAEHO CN(CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CC(C)(C)C2)C1)CC(C)(C)C ZINC001375509778 1342816500 /nfs/dbraw/zinc/81/65/00/1342816500.db2.gz HVQMSLAWKONYAS-WOVMCDHWSA-N 1 3 337.552 2.885 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@H]([NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001375543387 1342855463 /nfs/dbraw/zinc/85/54/63/1342855463.db2.gz RABVHJKBRXYRHH-KBAYOESNSA-N 1 3 335.536 2.637 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+][C@@H](C)c2cccc(OC)c2)C1)N(C)C ZINC001375553454 1342868144 /nfs/dbraw/zinc/86/81/44/1342868144.db2.gz HGEFAKZIWHCAPP-MRHSLFKSSA-N 1 3 347.503 2.581 10 0 EFAEHO CC[C@H](C)C[N@@H+]1CC[C@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001375571806 1342889390 /nfs/dbraw/zinc/88/93/90/1342889390.db2.gz IZAADKDQLGXBEG-HKUYNNGSSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@H](C)C[N@H+]1CC[C@H](C2CCN(C(=O)CN(C)C(C)C)CC2)C1 ZINC001375571806 1342889399 /nfs/dbraw/zinc/88/93/99/1342889399.db2.gz IZAADKDQLGXBEG-HKUYNNGSSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)CN1CC[C@H](C)C1 ZINC001375572504 1342890362 /nfs/dbraw/zinc/89/03/62/1342890362.db2.gz JRUDBAVBHQSNJT-QBUWPKIASA-N 1 3 335.536 2.876 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CC[C@@H]([NH2+]Cc3ccsc3)C2)CCC1 ZINC001375575082 1342893382 /nfs/dbraw/zinc/89/33/82/1342893382.db2.gz JITLKXBCERGCPV-GOEBONIOSA-N 1 3 335.517 2.607 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccccc2)C1)N(C)C ZINC001375577201 1342896539 /nfs/dbraw/zinc/89/65/39/1342896539.db2.gz IVBOTYDMJYEYOJ-IPMKNSEASA-N 1 3 331.504 2.647 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@H+](CCC3CC3)[C@@H]2C1(C)C ZINC001375596923 1342914821 /nfs/dbraw/zinc/91/48/21/1342914821.db2.gz GAEJFTIUELMWMG-UHOSZYNNSA-N 1 3 335.536 2.732 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1[C@@H]2CCC[N@@H+](CCC3CC3)[C@@H]2C1(C)C ZINC001375596923 1342914826 /nfs/dbraw/zinc/91/48/26/1342914826.db2.gz GAEJFTIUELMWMG-UHOSZYNNSA-N 1 3 335.536 2.732 10 0 EFAEHO C[C@H](F)CC[N@@H+]1CC[C@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001375688894 1342929786 /nfs/dbraw/zinc/92/97/86/1342929786.db2.gz FMTBHRZFSYJJSP-HOTGVXAUSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@H](F)CC[N@H+]1CC[C@H](NC(=O)C2(N(C)C)CCC2)CC(C)(C)C1 ZINC001375688894 1342929791 /nfs/dbraw/zinc/92/97/91/1342929791.db2.gz FMTBHRZFSYJJSP-HOTGVXAUSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H]2CN(C(=O)[C@H](C(C)C)N(C)C)C[C@@H]2C1 ZINC001375713015 1342948180 /nfs/dbraw/zinc/94/81/80/1342948180.db2.gz ZTBOWXCZDRSYOI-QYZOEREBSA-N 1 3 337.552 2.789 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H]2CN(C(=O)[C@H](C(C)C)N(C)C)C[C@@H]2C1 ZINC001375713015 1342948182 /nfs/dbraw/zinc/94/81/82/1342948182.db2.gz ZTBOWXCZDRSYOI-QYZOEREBSA-N 1 3 337.552 2.789 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CC2CC3(CCC3)C2)C[C@@H]1C ZINC001375741067 1342967903 /nfs/dbraw/zinc/96/79/03/1342967903.db2.gz OZDIQTUXOVZPQI-WMZOPIPTSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1ccsc1)C1CCCC1)N(C)C ZINC001375798346 1343026187 /nfs/dbraw/zinc/02/61/87/1343026187.db2.gz WCYKKXCDTYJROE-IAGOWNOFSA-N 1 3 337.533 2.853 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@]1(C)CC[N@H+](Cc2cccc(C)c2)C1 ZINC001375828525 1343062333 /nfs/dbraw/zinc/06/23/33/1343062333.db2.gz JGRDTNNIHSSJCX-UYAOXDASSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@]1(C)CC[N@@H+](Cc2cccc(C)c2)C1 ZINC001375828525 1343062336 /nfs/dbraw/zinc/06/23/36/1343062336.db2.gz JGRDTNNIHSSJCX-UYAOXDASSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@]1(C)CC[N@H+](Cc2cccc(C)c2)C1 ZINC001375828523 1343062730 /nfs/dbraw/zinc/06/27/30/1343062730.db2.gz JGRDTNNIHSSJCX-QUCCMNQESA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@@]1(C)CC[N@@H+](Cc2cccc(C)c2)C1 ZINC001375828523 1343062738 /nfs/dbraw/zinc/06/27/38/1343062738.db2.gz JGRDTNNIHSSJCX-QUCCMNQESA-N 1 3 349.494 2.756 10 0 EFAEHO COc1cccc([C@@H](C)N2CC[C@@](C)(NC(=O)CCC[NH+](C)C)C2)c1 ZINC001375834742 1343070619 /nfs/dbraw/zinc/07/06/19/1343070619.db2.gz GVJAYRMFNBLYJV-OXQOHEQNSA-N 1 3 347.503 2.679 10 0 EFAEHO COc1cccc([C@H](C)N2CC[C@](C)(NC(=O)CCC[NH+](C)C)C2)c1 ZINC001375834739 1343070650 /nfs/dbraw/zinc/07/06/50/1343070650.db2.gz GVJAYRMFNBLYJV-JXFKEZNVSA-N 1 3 347.503 2.679 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@]1(C)CCC[N@H+](CC2CCCC2)C1)N(C)C ZINC001375954662 1343209633 /nfs/dbraw/zinc/20/96/33/1343209633.db2.gz DTPMAMZOBOWKIV-UYAOXDASSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CC2CCCC2)C1)N(C)C ZINC001375954662 1343209636 /nfs/dbraw/zinc/20/96/36/1343209636.db2.gz DTPMAMZOBOWKIV-UYAOXDASSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@]1(C)CCC[N@H+](CC2CCCC2)C1 ZINC001375955863 1343212206 /nfs/dbraw/zinc/21/22/06/1343212206.db2.gz DTRNKMKYYGOELC-IBGZPJMESA-N 1 3 332.492 2.669 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@]1(C)CCC[N@@H+](CC2CCCC2)C1 ZINC001375955863 1343212207 /nfs/dbraw/zinc/21/22/07/1343212207.db2.gz DTRNKMKYYGOELC-IBGZPJMESA-N 1 3 332.492 2.669 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C)([NH2+]CC=C(Cl)Cl)CC1 ZINC001393752715 1357125922 /nfs/dbraw/zinc/12/59/22/1357125922.db2.gz ZPIBMVVDFPVCMD-UHFFFAOYSA-N 1 3 336.307 2.616 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1ccsc1)C1CC1 ZINC001376212025 1343401795 /nfs/dbraw/zinc/40/17/95/1343401795.db2.gz BUYHYQVEWHNVKO-DLBZAZTESA-N 1 3 335.517 2.605 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CCC1CCCC1)C1CC1 ZINC001376223424 1343409112 /nfs/dbraw/zinc/40/91/12/1343409112.db2.gz RVYBUTQZLYYHNY-RTBURBONSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1ccc(Cl)s1)C1CC1)N(C)C ZINC001376265144 1343438170 /nfs/dbraw/zinc/43/81/70/1343438170.db2.gz VMMJRGITCNCUMP-UONOGXRCSA-N 1 3 343.924 2.726 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1cccc(F)c1)C2 ZINC001376311976 1343475107 /nfs/dbraw/zinc/47/51/07/1343475107.db2.gz HEFSBBYZKQEJPW-WDSOQIARSA-N 1 3 347.478 2.637 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1cccc(F)c1)C2 ZINC001376311976 1343475110 /nfs/dbraw/zinc/47/51/10/1343475110.db2.gz HEFSBBYZKQEJPW-WDSOQIARSA-N 1 3 347.478 2.637 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001376351439 1343505743 /nfs/dbraw/zinc/50/57/43/1343505743.db2.gz GVLWRIUAGGIXMS-FQEVSTJZSA-N 1 3 345.531 2.916 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001376352449 1343506671 /nfs/dbraw/zinc/50/66/71/1343506671.db2.gz YCWWRSARAYCTII-RBUKOAKNSA-N 1 3 345.531 2.970 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2cc(C)ccc2F)C1 ZINC001376360733 1343513289 /nfs/dbraw/zinc/51/32/89/1343513289.db2.gz JGUWUKXNQNGXKX-FUHWJXTLSA-N 1 3 349.494 2.660 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001376477121 1343618198 /nfs/dbraw/zinc/61/81/98/1343618198.db2.gz RWHYYFKIYRTQFA-VYCZESIESA-N 1 3 347.503 2.579 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccc(F)cc32)C1)N(C)C ZINC001376488233 1343623373 /nfs/dbraw/zinc/62/33/73/1343623373.db2.gz KDMVSBMZTZVVPE-UKBAYJJMSA-N 1 3 347.478 2.780 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC[C@@H]2CCCC2(F)F)C1)N(C)C ZINC001376491743 1343624356 /nfs/dbraw/zinc/62/43/56/1343624356.db2.gz RUPFRDZJFYOOHF-JONQDZQNSA-N 1 3 345.478 2.635 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001376492316 1343625067 /nfs/dbraw/zinc/62/50/67/1343625067.db2.gz UZWQTYQMPCZPGO-OQIJWPOYSA-N 1 3 331.504 2.879 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](Cc2ccc(CF)cc2)C1)N(C)C ZINC001376508365 1343635873 /nfs/dbraw/zinc/63/58/73/1343635873.db2.gz HRCZVILXZDVJAM-RTBURBONSA-N 1 3 349.494 2.825 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](Cc2ccc(CF)cc2)C1)N(C)C ZINC001376508365 1343635875 /nfs/dbraw/zinc/63/58/75/1343635875.db2.gz HRCZVILXZDVJAM-RTBURBONSA-N 1 3 349.494 2.825 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@H+](CCCc2ccccc2)C1 ZINC001376525116 1343650440 /nfs/dbraw/zinc/65/04/40/1343650440.db2.gz DNZFPMNNKIDBCC-HXUWFJFHSA-N 1 3 345.531 2.788 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CCC[N@@H+](CCCc2ccccc2)C1 ZINC001376525116 1343650442 /nfs/dbraw/zinc/65/04/42/1343650442.db2.gz DNZFPMNNKIDBCC-HXUWFJFHSA-N 1 3 345.531 2.788 10 0 EFAEHO Cc1ccc(CN2C[C@@H]3CCCN(C(=O)CC[NH+](C)C)[C@@H]3C2)cc1F ZINC001376529866 1343655136 /nfs/dbraw/zinc/65/51/36/1343655136.db2.gz IXCCIYMLONOKQJ-PKOBYXMFSA-N 1 3 347.478 2.509 10 0 EFAEHO Cc1ccc(C[N@H+]2CCC[C@H](CNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001376531173 1343656381 /nfs/dbraw/zinc/65/63/81/1343656381.db2.gz NBPACXWXDXMECE-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(C[N@@H+]2CCC[C@H](CNC(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001376531173 1343656383 /nfs/dbraw/zinc/65/63/83/1343656383.db2.gz NBPACXWXDXMECE-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N1C[C@@H]2CCCN(C(=O)CC[NH+](C)C)[C@@H]2C1 ZINC001376531806 1343657622 /nfs/dbraw/zinc/65/76/22/1343657622.db2.gz PENSTGVYZUUKTJ-VDZJLULYSA-N 1 3 347.478 2.761 10 0 EFAEHO C[C@@H](c1ccccc1F)N1CCC[C@@H](CNC(=O)CC[NH+](C)C)C1 ZINC001376536425 1343662356 /nfs/dbraw/zinc/66/23/56/1343662356.db2.gz DILMEMAKXZYQAC-HOTGVXAUSA-N 1 3 335.467 2.667 10 0 EFAEHO CC(C)C[N@H+](C)Cc1ccccc1CNC(=O)CN1CC[C@@H](C)C1 ZINC001376560651 1343677297 /nfs/dbraw/zinc/67/72/97/1343677297.db2.gz JTEFKXRTTXWKEV-QGZVFWFLSA-N 1 3 331.504 2.732 10 0 EFAEHO CC(C)C[N@@H+](C)Cc1ccccc1CNC(=O)CN1CC[C@@H](C)C1 ZINC001376560651 1343677298 /nfs/dbraw/zinc/67/72/98/1343677298.db2.gz JTEFKXRTTXWKEV-QGZVFWFLSA-N 1 3 331.504 2.732 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H](C)N1CCCCCC1 ZINC001376656512 1343746835 /nfs/dbraw/zinc/74/68/35/1343746835.db2.gz BPAHAVCWBJOTFG-PXTPFGJHSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H](C)N1CCCCCC1 ZINC001376656512 1343746838 /nfs/dbraw/zinc/74/68/38/1343746838.db2.gz BPAHAVCWBJOTFG-PXTPFGJHSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)C[N@@H+]1CCc2c(CNC(=O)CN(C)C(C)C)cccc2C1 ZINC001376677385 1343759899 /nfs/dbraw/zinc/75/98/99/1343759899.db2.gz WEOPWXFKLCYCET-UHFFFAOYSA-N 1 3 331.504 2.657 10 0 EFAEHO CC(C)C[N@H+]1CCc2c(CNC(=O)CN(C)C(C)C)cccc2C1 ZINC001376677385 1343759902 /nfs/dbraw/zinc/75/99/02/1343759902.db2.gz WEOPWXFKLCYCET-UHFFFAOYSA-N 1 3 331.504 2.657 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1cc(C)sc1C ZINC001376731361 1343788551 /nfs/dbraw/zinc/78/85/51/1343788551.db2.gz NPQJDAFYTMJDNR-DYVFJYSZSA-N 1 3 337.533 2.834 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C)[NH2+]CCc1ccc(C)cc1 ZINC001376733308 1343790401 /nfs/dbraw/zinc/79/04/01/1343790401.db2.gz XGGBKQCLILAOPX-HKUYNNGSSA-N 1 3 331.504 2.506 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(CNC(=O)C(C)(C)N2CCCCC2)CCC1 ZINC001376734841 1343791239 /nfs/dbraw/zinc/79/12/39/1343791239.db2.gz HVAPLHOGKPKDQE-OAHLLOKOSA-N 1 3 327.488 2.628 10 0 EFAEHO C[C@H](CNC(=O)c1cccc(CN(C)C)c1)[NH2+]CC1CC(C)(C)C1 ZINC001376879908 1343914725 /nfs/dbraw/zinc/91/47/25/1343914725.db2.gz NSTAQGFMARYFPJ-OAHLLOKOSA-N 1 3 331.504 2.892 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001376909311 1343947358 /nfs/dbraw/zinc/94/73/58/1343947358.db2.gz GYENABWJYXFDTM-ZWKOTPCHSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CCC[N@H+]1CCC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001376909311 1343947360 /nfs/dbraw/zinc/94/73/60/1343947360.db2.gz GYENABWJYXFDTM-ZWKOTPCHSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@H+](CCc2ccccc2)CC1 ZINC001376914640 1343953326 /nfs/dbraw/zinc/95/33/26/1343953326.db2.gz SXEDWJTZHVPJEW-IBGZPJMESA-N 1 3 331.504 2.540 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@@H+](CCc2ccccc2)CC1 ZINC001376914640 1343953331 /nfs/dbraw/zinc/95/33/31/1343953331.db2.gz SXEDWJTZHVPJEW-IBGZPJMESA-N 1 3 331.504 2.540 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H]([N@H+](C)CCCC3CCC3)C2)C1 ZINC001376983592 1344016547 /nfs/dbraw/zinc/01/65/47/1344016547.db2.gz VJQCSTHJOPCVMM-HKUYNNGSSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H]([N@@H+](C)CCCC3CCC3)C2)C1 ZINC001376983592 1344016551 /nfs/dbraw/zinc/01/65/51/1344016551.db2.gz VJQCSTHJOPCVMM-HKUYNNGSSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1sccc1Cl ZINC001377067525 1344112287 /nfs/dbraw/zinc/11/22/87/1344112287.db2.gz OLKWQOYMUMSKNX-QWHCGFSZSA-N 1 3 343.924 2.728 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(Cl)s1 ZINC001377070844 1344114808 /nfs/dbraw/zinc/11/48/08/1344114808.db2.gz WNLOGNAIHUFMRB-OLZOCXBDSA-N 1 3 343.924 2.728 10 0 EFAEHO CCC1([NH2+]CCC(C)C)CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001377112942 1344137496 /nfs/dbraw/zinc/13/74/96/1344137496.db2.gz BWRJTVUWZBKCJC-KRWDZBQOSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC[N@H+](CC1CC(C)(C)C1)C1CC1 ZINC001377566326 1344176624 /nfs/dbraw/zinc/17/66/24/1344176624.db2.gz GNNNVKPXYXEVFP-IYBDPMFKSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC[N@@H+](CC1CC(C)(C)C1)C1CC1 ZINC001377566326 1344176626 /nfs/dbraw/zinc/17/66/26/1344176626.db2.gz GNNNVKPXYXEVFP-IYBDPMFKSA-N 1 3 335.536 2.876 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]CCN(C)C(=O)CN(C)C2CCC2)c1 ZINC001377572596 1344183051 /nfs/dbraw/zinc/18/30/51/1344183051.db2.gz HORDORGPGFYILY-KRWDZBQOSA-N 1 3 331.504 2.897 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[N@H+](C)[C@H]1CCc2ccccc21 ZINC001377675722 1344305606 /nfs/dbraw/zinc/30/56/06/1344305606.db2.gz WTCFFQNNAYQRRF-ICSRJNTNSA-N 1 3 343.515 2.939 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]1C[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001377675722 1344305609 /nfs/dbraw/zinc/30/56/09/1344305609.db2.gz WTCFFQNNAYQRRF-ICSRJNTNSA-N 1 3 343.515 2.939 10 0 EFAEHO CC(C)c1cccc(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@@H](C)C2)n1 ZINC001393814338 1357178827 /nfs/dbraw/zinc/17/88/27/1357178827.db2.gz GFXBFRNPFGGVOX-SJORKVTESA-N 1 3 346.519 2.531 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]Cc2ccc(C)cc2C)C1)N(C)C ZINC001377725367 1344375201 /nfs/dbraw/zinc/37/52/01/1344375201.db2.gz HZFDTCFMXOUTRL-KVZIAJEVSA-N 1 3 331.504 2.628 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@H]1CC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC001377726762 1344377012 /nfs/dbraw/zinc/37/70/12/1344377012.db2.gz XGVHHIDAGOFMQO-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@H]1CC[N@@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC001377726762 1344377016 /nfs/dbraw/zinc/37/70/16/1344377016.db2.gz XGVHHIDAGOFMQO-JKSUJKDBSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@@H]1CC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC001377726758 1344377154 /nfs/dbraw/zinc/37/71/54/1344377154.db2.gz XGVHHIDAGOFMQO-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@@H]1CC[N@@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC001377726758 1344377155 /nfs/dbraw/zinc/37/71/55/1344377155.db2.gz XGVHHIDAGOFMQO-HZPDHXFCSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[C@H]([NH2+]CC1CC(NC(=O)Cc2nc[nH]c2C)C1)c1ccccc1 ZINC001377729475 1344378643 /nfs/dbraw/zinc/37/86/43/1344378643.db2.gz FNRDXAOKNOLNQY-VJFUWPCTSA-N 1 3 340.471 2.896 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]CC2CCC3(CC3)CC2)C1)N(C)C ZINC001377737758 1344386236 /nfs/dbraw/zinc/38/62/36/1344386236.db2.gz WXURBSKAACVSNY-ABHNRTSZSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001377776731 1344425998 /nfs/dbraw/zinc/42/59/98/1344425998.db2.gz AYPYACNPCJHGCR-JKSUJKDBSA-N 1 3 345.478 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC001377776731 1344426001 /nfs/dbraw/zinc/42/60/01/1344426001.db2.gz AYPYACNPCJHGCR-JKSUJKDBSA-N 1 3 345.478 2.542 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H]([NH2+]C/C=C\c3ccccc3)C2)C1 ZINC001377798414 1344449832 /nfs/dbraw/zinc/44/98/32/1344449832.db2.gz ZQAYGYRITJYBGR-VRBJBPJOSA-N 1 3 341.499 2.622 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001377830666 1344487802 /nfs/dbraw/zinc/48/78/02/1344487802.db2.gz UCUGUYSIAQSSNB-LSDHHAIUSA-N 1 3 342.487 2.635 10 0 EFAEHO C[C@H](NC(=O)CN(C)CC(C)(C)C)[C@H](C)[NH2+]CCc1ccccc1 ZINC001377849317 1344506692 /nfs/dbraw/zinc/50/66/92/1344506692.db2.gz HIKAKKDXUOASMT-IRXDYDNUSA-N 1 3 333.520 2.690 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001377885567 1344547427 /nfs/dbraw/zinc/54/74/27/1344547427.db2.gz SRLNGGIJWDJFHB-CABCVRRESA-N 1 3 331.460 2.757 10 0 EFAEHO C[C@H](F)CC[NH2+]C1CCC(N(C)C(=O)CN(C)C2CCC2)CC1 ZINC001377913663 1344576370 /nfs/dbraw/zinc/57/63/70/1344576370.db2.gz MJEARIGGEZWLNN-UQPPLGOBSA-N 1 3 327.488 2.578 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1C[C@@H]2C[C@H]1C[N@@H+]2CCC1CCCC1 ZINC001378028392 1344677954 /nfs/dbraw/zinc/67/79/54/1344677954.db2.gz SPBHFBJPGPEMGC-BZSNNMDCSA-N 1 3 339.499 2.532 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1C[C@@H]2C[C@H]1C[N@H+]2CCC1CCCC1 ZINC001378028392 1344677960 /nfs/dbraw/zinc/67/79/60/1344677960.db2.gz SPBHFBJPGPEMGC-BZSNNMDCSA-N 1 3 339.499 2.532 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[N@H+](C)CCc1ccccc1 ZINC001378046532 1344697780 /nfs/dbraw/zinc/69/77/80/1344697780.db2.gz IYDUQFMWVCYDAN-HKUYNNGSSA-N 1 3 331.504 2.538 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[N@@H+](C)CCc1ccccc1 ZINC001378046532 1344697787 /nfs/dbraw/zinc/69/77/87/1344697787.db2.gz IYDUQFMWVCYDAN-HKUYNNGSSA-N 1 3 331.504 2.538 10 0 EFAEHO Cc1cccc(CN(C)[C@@H](C)CNC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001378066044 1344720079 /nfs/dbraw/zinc/72/00/79/1344720079.db2.gz DSZCMNRCUUKQKI-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO Cc1cccc(CN(C)[C@@H](C)CNC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001378066044 1344720080 /nfs/dbraw/zinc/72/00/80/1344720080.db2.gz DSZCMNRCUUKQKI-HKUYNNGSSA-N 1 3 331.504 2.806 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CCN(CCc2ccc(C)cc2)C1)[NH+](CC)CC ZINC001378123761 1344785908 /nfs/dbraw/zinc/78/59/08/1344785908.db2.gz ZFBZISVOCSTZKE-UXHICEINSA-N 1 3 345.531 2.848 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@H+](Cc2cccc(C)c2)C1 ZINC001378185438 1344859684 /nfs/dbraw/zinc/85/96/84/1344859684.db2.gz BFIQPXNRQWLAPY-UYAOXDASSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)CN1CC[C@@H](C)C1)[C@@H]1CC[N@@H+](Cc2cccc(C)c2)C1 ZINC001378185438 1344859686 /nfs/dbraw/zinc/85/96/86/1344859686.db2.gz BFIQPXNRQWLAPY-UYAOXDASSA-N 1 3 343.515 2.760 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H](C)N(C)Cc1cccc(F)c1)[NH+]1CCCC1 ZINC001378227161 1344911447 /nfs/dbraw/zinc/91/14/47/1344911447.db2.gz FWRXWVYDZKMKMT-APWZRJJASA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC001378236439 1344919555 /nfs/dbraw/zinc/91/95/55/1344919555.db2.gz RGISKWKMAYTIRB-KSSFIOAISA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC001378236439 1344919558 /nfs/dbraw/zinc/91/95/58/1344919558.db2.gz RGISKWKMAYTIRB-KSSFIOAISA-N 1 3 335.467 2.590 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1C[NH2+][C@@H]1CCc2ccccc21 ZINC001393861343 1357219689 /nfs/dbraw/zinc/21/96/89/1357219689.db2.gz QUGXLRAEZVZFJZ-AZUAARDMSA-N 1 3 343.515 2.986 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@](C)(NC(=O)CN(C)C(C)C)C2CC2)cc1 ZINC001378411373 1345054758 /nfs/dbraw/zinc/05/47/58/1345054758.db2.gz COMJTEZGHAHDNP-HXUWFJFHSA-N 1 3 331.504 2.710 10 0 EFAEHO C[N@@H+]1CC[C@@H](CC(=O)N[C@H]2CC[C@H](NC/C(Cl)=C/Cl)CC2)C1 ZINC001378455844 1345091724 /nfs/dbraw/zinc/09/17/24/1345091724.db2.gz SWCOHEXDKWYWLK-AUQWCNHSSA-N 1 3 348.318 2.664 10 0 EFAEHO C[N@H+]1CC[C@@H](CC(=O)N[C@H]2CC[C@H](NC/C(Cl)=C/Cl)CC2)C1 ZINC001378455844 1345091726 /nfs/dbraw/zinc/09/17/26/1345091726.db2.gz SWCOHEXDKWYWLK-AUQWCNHSSA-N 1 3 348.318 2.664 10 0 EFAEHO C[N@H+](C1CCCC1)C(C)(C)C(=O)NCCC1CCN(CCF)CC1 ZINC001378476260 1345110580 /nfs/dbraw/zinc/11/05/80/1345110580.db2.gz OFDQGJAXCFLZCO-UHFFFAOYSA-N 1 3 341.515 2.827 10 0 EFAEHO C[N@@H+](C1CCCC1)C(C)(C)C(=O)NCCC1CCN(CCF)CC1 ZINC001378476260 1345110582 /nfs/dbraw/zinc/11/05/82/1345110582.db2.gz OFDQGJAXCFLZCO-UHFFFAOYSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]Cc1ccc2c(c1)CCC2 ZINC001378518887 1345136918 /nfs/dbraw/zinc/13/69/18/1345136918.db2.gz QRMBDJZDRGZYMU-HXUWFJFHSA-N 1 3 343.515 2.596 10 0 EFAEHO C[C@H](C(=O)N[C@@H](C)C1C[NH+](CC2CCCC2)C1)N1CCCCCC1 ZINC001378554987 1345159597 /nfs/dbraw/zinc/15/95/97/1345159597.db2.gz IWPGKTUIDGYEIG-DLBZAZTESA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)c1ccc(CN2CC([C@H](C)NC(=O)CC[NH+](C)C)C2)cc1 ZINC001378559923 1345162888 /nfs/dbraw/zinc/16/28/88/1345162888.db2.gz OHHMUWDWQJPGMR-INIZCTEOSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)c1ccc(CN2CC([C@@H](C)NC(=O)CC[NH+](C)C)C2)cc1 ZINC001378559924 1345163267 /nfs/dbraw/zinc/16/32/67/1345163267.db2.gz OHHMUWDWQJPGMR-MRXNPFEDSA-N 1 3 331.504 2.698 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH+]1CC([C@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001378582327 1345177931 /nfs/dbraw/zinc/17/79/31/1345177931.db2.gz DPPQQEUDCORTBJ-DLBZAZTESA-N 1 3 331.504 2.833 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@H](C)C[NH2+]Cc1cc(C)ccc1F ZINC001378632907 1345211711 /nfs/dbraw/zinc/21/17/11/1345211711.db2.gz KOSZXALZFVEIMF-APWZRJJASA-N 1 3 349.494 2.850 10 0 EFAEHO CC[C@H](C)C[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN(C)C(C)C ZINC001393869716 1357231173 /nfs/dbraw/zinc/23/11/73/1357231173.db2.gz KWDIWCDNHZZNLD-QKYXUNIQSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@H+](CC2CC2)CC1(C)C)N1CCCCC1 ZINC001378678450 1345243871 /nfs/dbraw/zinc/24/38/71/1345243871.db2.gz LOMRRXUHZWOMLY-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@@H+](CC2CC2)CC1(C)C)N1CCCCC1 ZINC001378678450 1345243876 /nfs/dbraw/zinc/24/38/76/1345243876.db2.gz LOMRRXUHZWOMLY-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@@H](C)CC)N(C)C ZINC001393871423 1357233432 /nfs/dbraw/zinc/23/34/32/1357233432.db2.gz QMQJONZQWDRWSV-JEDBISTDSA-N 1 3 331.504 2.745 10 0 EFAEHO C[C@H](F)CC[NH2+]C1(CNC(=O)C(C)(C)N2CCCC2)CCCC1 ZINC001378705992 1345261731 /nfs/dbraw/zinc/26/17/31/1345261731.db2.gz GRRHYAFLQQHOII-HNNXBMFYSA-N 1 3 327.488 2.628 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+]CC[C@H](C)F)CCCC1 ZINC001378735582 1345283193 /nfs/dbraw/zinc/28/31/93/1345283193.db2.gz LURBVCQWVFLVGM-JKSUJKDBSA-N 1 3 327.488 2.628 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+]CC[C@@H](C)F)CCCC1 ZINC001378735579 1345283318 /nfs/dbraw/zinc/28/33/18/1345283318.db2.gz LURBVCQWVFLVGM-HZPDHXFCSA-N 1 3 327.488 2.628 10 0 EFAEHO CC(C)CCC[N@@H+]1CCCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001378797182 1345320986 /nfs/dbraw/zinc/32/09/86/1345320986.db2.gz IVGWFQMYSFJIDG-SFHVURJKSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)CCC[N@H+]1CCCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001378797182 1345320987 /nfs/dbraw/zinc/32/09/87/1345320987.db2.gz IVGWFQMYSFJIDG-SFHVURJKSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)CC[N@@H+]1CCCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001378799540 1345323531 /nfs/dbraw/zinc/32/35/31/1345323531.db2.gz SCWNHGYNHSQSCR-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO CC(C)CC[N@H+]1CCCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001378799540 1345323532 /nfs/dbraw/zinc/32/35/32/1345323532.db2.gz SCWNHGYNHSQSCR-UHFFFAOYSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccccc2C)C1)N(C)C ZINC001378865573 1345374973 /nfs/dbraw/zinc/37/49/73/1345374973.db2.gz GTYAXWOGUOUBTJ-DWRORGKVSA-N 1 3 331.504 2.881 10 0 EFAEHO CC[C@H]([NH2+]C[C@H]1C[C@H](NC(=O)[C@H](CC)N(C)C)C1)c1ccccc1 ZINC001378868935 1345378194 /nfs/dbraw/zinc/37/81/94/1345378194.db2.gz IZCCNLLSFJCENL-WNHJNPCNSA-N 1 3 331.504 2.962 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@H](C[NH2+]CC1CC1)C1CCCCC1 ZINC001378884837 1345394336 /nfs/dbraw/zinc/39/43/36/1345394336.db2.gz LMPXCLGMCBSEMD-RTBURBONSA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](CC(C)C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001378886514 1345396337 /nfs/dbraw/zinc/39/63/37/1345396337.db2.gz XMRCWFQNKXGHEX-ICSRJNTNSA-N 1 3 345.531 2.957 10 0 EFAEHO CCC(CC)C[NH2+]C[C@@H]1[C@@H](C)CCCN1C(=O)CN(C)C(C)C ZINC001378929604 1345435434 /nfs/dbraw/zinc/43/54/34/1345435434.db2.gz UUTAISFNFVWHHJ-FUHWJXTLSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@H](C[NH2+]CC2CCCCC2)C2CC2)C1 ZINC001379032024 1345513137 /nfs/dbraw/zinc/51/31/37/1345513137.db2.gz OMYLFRCROMXSKA-VQIMIIECSA-N 1 3 335.536 2.735 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H](C[NH2+]Cc1ccsc1)C1CC1)N(C)C ZINC001379064281 1345544578 /nfs/dbraw/zinc/54/45/78/1345544578.db2.gz XCLVQAQLJYGKGO-IRXDYDNUSA-N 1 3 337.533 2.661 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)[C@H](C[NH2+]Cc1ccsc1)C1CC1)N(C)C ZINC001379064277 1345544697 /nfs/dbraw/zinc/54/46/97/1345544697.db2.gz XCLVQAQLJYGKGO-IAGOWNOFSA-N 1 3 337.533 2.661 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H](C[NH2+]Cc1ccsc1)C1CC1)N(C)C ZINC001379064287 1345544958 /nfs/dbraw/zinc/54/49/58/1345544958.db2.gz XCLVQAQLJYGKGO-SJORKVTESA-N 1 3 337.533 2.661 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@H]2C[NH2+]CC2CC(C)(C)C2)CCC1 ZINC001379156681 1345632084 /nfs/dbraw/zinc/63/20/84/1345632084.db2.gz QQTFQHRQMGQVGP-DLBZAZTESA-N 1 3 335.536 2.781 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@@H]2C[NH2+]CC2CC(C)(C)C2)CCC1 ZINC001379156682 1345632161 /nfs/dbraw/zinc/63/21/61/1345632161.db2.gz QQTFQHRQMGQVGP-IAGOWNOFSA-N 1 3 335.536 2.781 10 0 EFAEHO C[C@@H](CN(C)C(=O)C[N@@H+]1CC[C@@H](C)C1)NCc1ccccc1Cl ZINC001379227069 1345669623 /nfs/dbraw/zinc/66/96/23/1345669623.db2.gz UYCIXHPZSKJHCN-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@@H](CN(C)C(=O)C[N@H+]1CC[C@@H](C)C1)NCc1ccccc1Cl ZINC001379227069 1345669625 /nfs/dbraw/zinc/66/96/25/1345669625.db2.gz UYCIXHPZSKJHCN-CABCVRRESA-N 1 3 337.895 2.618 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCc2ccccc21)C(=O)CN1CCC(C)CC1 ZINC001379311276 1345716286 /nfs/dbraw/zinc/71/62/86/1345716286.db2.gz BGGWPXZCYOXNBU-HXUWFJFHSA-N 1 3 343.515 2.844 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCc2ccccc21)C(=O)CN1CCC(C)CC1 ZINC001379311272 1345716417 /nfs/dbraw/zinc/71/64/17/1345716417.db2.gz BGGWPXZCYOXNBU-FQEVSTJZSA-N 1 3 343.515 2.844 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(C)nc1C ZINC001379330214 1345733380 /nfs/dbraw/zinc/73/33/80/1345733380.db2.gz OVCCBAGJYHLMIS-QFBILLFUSA-N 1 3 346.519 2.509 10 0 EFAEHO C[C@H](CN(C)C(=O)CCC[NH+]1CCCCC1)NCc1ccsc1 ZINC001379332601 1345734034 /nfs/dbraw/zinc/73/40/34/1345734034.db2.gz ZMCLFMPHGHZOIU-MRXNPFEDSA-N 1 3 337.533 2.951 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)NC(=O)CC[C@@H]2CCC[N@@H+]2C)n1 ZINC001379384476 1345758337 /nfs/dbraw/zinc/75/83/37/1345758337.db2.gz RMYYHBVHPSREOE-AEFFLSMTSA-N 1 3 346.519 2.674 10 0 EFAEHO CC(C)c1cccc(CNC[C@@H](C)NC(=O)CC[C@@H]2CCC[N@H+]2C)n1 ZINC001379384476 1345758342 /nfs/dbraw/zinc/75/83/42/1345758342.db2.gz RMYYHBVHPSREOE-AEFFLSMTSA-N 1 3 346.519 2.674 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2ccccc2C2CC2)C[C@@H]1C ZINC001379584043 1345890125 /nfs/dbraw/zinc/89/01/25/1345890125.db2.gz IBCGWJZKOBSJCD-QFBILLFUSA-N 1 3 343.515 2.983 10 0 EFAEHO CC(C)CC[NH2+][C@H]1C[C@@H](C)N(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001379589710 1345897898 /nfs/dbraw/zinc/89/78/98/1345897898.db2.gz TVNRHJWJIOZMIM-APWZRJJASA-N 1 3 331.504 2.987 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@@H]([C@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001393899935 1357269796 /nfs/dbraw/zinc/26/97/96/1357269796.db2.gz VOVLCXITHRNXMG-RBUKOAKNSA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@@H]([C@H]2CCCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001393899935 1357269799 /nfs/dbraw/zinc/26/97/99/1357269799.db2.gz VOVLCXITHRNXMG-RBUKOAKNSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2sccc2Cl)C1)N(C)C ZINC001393901329 1357271553 /nfs/dbraw/zinc/27/15/53/1357271553.db2.gz HGWHKADKASITCE-ORHYLEIMSA-N 1 3 343.924 2.726 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+]CC1CC(NC(=O)CN(C)C(C)C)C1 ZINC001393909065 1357277643 /nfs/dbraw/zinc/27/76/43/1357277643.db2.gz UMRADBQPZAIBKJ-WWDZGPRUSA-N 1 3 331.504 2.881 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](CC)NCC=C(Cl)Cl ZINC001419201291 1374946464 /nfs/dbraw/zinc/94/64/64/1374946464.db2.gz QFCHOVNZQBUHNM-STQMWFEESA-N 1 3 336.307 2.664 10 0 EFAEHO C[C@H](C[N@H+](C)C[C@H]1CCCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001379676267 1347250040 /nfs/dbraw/zinc/25/00/40/1347250040.db2.gz FIKZMZIJTIGTNZ-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C[N@@H+](C)C[C@H]1CCCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001379676267 1347250041 /nfs/dbraw/zinc/25/00/41/1347250041.db2.gz FIKZMZIJTIGTNZ-CABCVRRESA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(F)cc1)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001379693325 1347263831 /nfs/dbraw/zinc/26/38/31/1347263831.db2.gz ROOVCMDHPMWWMY-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(F)cc1)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001379693325 1347263832 /nfs/dbraw/zinc/26/38/32/1347263832.db2.gz ROOVCMDHPMWWMY-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(OC)c1 ZINC001379695397 1347265706 /nfs/dbraw/zinc/26/57/06/1347265706.db2.gz ZYNBBWYZWLXGGX-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(OC)c1 ZINC001379695397 1347265709 /nfs/dbraw/zinc/26/57/09/1347265709.db2.gz ZYNBBWYZWLXGGX-APWZRJJASA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H]1CN(C(=O)CN(C)C(C)C)CC1(C)C ZINC001379731549 1347292491 /nfs/dbraw/zinc/29/24/91/1347292491.db2.gz XGCBHFIOTCJJBB-GOSISDBHSA-N 1 3 349.494 2.801 10 0 EFAEHO CCc1cccc(CN(C)C[C@@H](C)NC(=O)C[C@@H]2CC[N@H+](C)C2)c1 ZINC001379765085 1347317468 /nfs/dbraw/zinc/31/74/68/1347317468.db2.gz MPOONZHLTIUCOZ-APWZRJJASA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(CN(C)C[C@@H](C)NC(=O)C[C@@H]2CC[N@@H+](C)C2)c1 ZINC001379765085 1347317471 /nfs/dbraw/zinc/31/74/71/1347317471.db2.gz MPOONZHLTIUCOZ-APWZRJJASA-N 1 3 331.504 2.527 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1)[NH+]1CCCC1 ZINC001379797725 1347347549 /nfs/dbraw/zinc/34/75/49/1347347549.db2.gz LTNVRLDVXYUQML-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@@H](C[NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001379857480 1347373784 /nfs/dbraw/zinc/37/37/84/1347373784.db2.gz LRPRQWXQAUGSNH-OALUTQOASA-N 1 3 347.547 2.924 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1cccc(Cl)c1)C1CC1)N(C)C ZINC001379867982 1347378391 /nfs/dbraw/zinc/37/83/91/1347378391.db2.gz FGEJQZYMUJGUGE-DLBZAZTESA-N 1 3 337.895 2.665 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+]Cc1ccsc1)C1CC1)CC(C)(C)C ZINC001379895111 1347392876 /nfs/dbraw/zinc/39/28/76/1347392876.db2.gz FFISXOAGPUGGIK-INIZCTEOSA-N 1 3 337.533 2.710 10 0 EFAEHO CC(C)(C(=O)N[C@H](C[NH2+]Cc1cccc(F)c1)C1CC1)N1CCCC1 ZINC001379898656 1347394499 /nfs/dbraw/zinc/39/44/99/1347394499.db2.gz RHPPKTGXUXRBJQ-GOSISDBHSA-N 1 3 347.478 2.685 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]CC1CCC2(CC2)CC1)C1CC1)N(C)C ZINC001379924215 1347406727 /nfs/dbraw/zinc/40/67/27/1347406727.db2.gz PWVUVJOCVBSTJT-ZWKOTPCHSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]CC1CCC2(CC2)CC1)C1CC1)N(C)C ZINC001379924210 1347407058 /nfs/dbraw/zinc/40/70/58/1347407058.db2.gz PWVUVJOCVBSTJT-QZTJIDSGSA-N 1 3 335.536 2.781 10 0 EFAEHO O=C(C[NH+]1CCCC1)NC[C@H]1CCN1Cc1ccc2ccccc2c1 ZINC001380036328 1347475620 /nfs/dbraw/zinc/47/56/20/1347475620.db2.gz QYLOEGJRBTXQIU-HXUWFJFHSA-N 1 3 337.467 2.626 10 0 EFAEHO CC(C)N(CC[N@H+](C)C[C@@H]1CCC(F)(F)C1)C(=O)Cc1c[nH]cn1 ZINC001380040525 1347479436 /nfs/dbraw/zinc/47/94/36/1347479436.db2.gz FRAJZTKLFCUNJA-CQSZACIVSA-N 1 3 342.434 2.556 10 0 EFAEHO CC(C)N(CC[N@@H+](C)C[C@@H]1CCC(F)(F)C1)C(=O)Cc1c[nH]cn1 ZINC001380040525 1347479437 /nfs/dbraw/zinc/47/94/37/1347479437.db2.gz FRAJZTKLFCUNJA-CQSZACIVSA-N 1 3 342.434 2.556 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C[NH2+]CC1CCCC1)C(C)(C)C)N(C)C ZINC001380083503 1347507854 /nfs/dbraw/zinc/50/78/54/1347507854.db2.gz CBCZBWYGJBJFQJ-SJORKVTESA-N 1 3 325.541 2.883 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C[NH2+]C[C@H]1CCC(F)(F)C1)C(C)(C)C ZINC001380092177 1347512012 /nfs/dbraw/zinc/51/20/12/1347512012.db2.gz YHYRWRIAALBATN-GJZGRUSLSA-N 1 3 347.494 2.884 10 0 EFAEHO C[C@H](NC1(CNC(=O)CC[C@@H]2CCC[N@@H+]2C)CC1)c1ccc(F)cc1 ZINC001380100151 1347514784 /nfs/dbraw/zinc/51/47/84/1347514784.db2.gz DYBCTDTXAUOSEW-YJBOKZPZSA-N 1 3 347.478 3.000 10 0 EFAEHO C[C@H](NC1(CNC(=O)CC[C@@H]2CCC[N@H+]2C)CC1)c1ccc(F)cc1 ZINC001380100151 1347514787 /nfs/dbraw/zinc/51/47/87/1347514787.db2.gz DYBCTDTXAUOSEW-YJBOKZPZSA-N 1 3 347.478 3.000 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1(NC/C=C/c2ccc(Cl)cc2)CC1 ZINC001380132537 1347526242 /nfs/dbraw/zinc/52/62/42/1347526242.db2.gz DMKDWPPLFQERHY-ONEGZZNKSA-N 1 3 335.879 2.543 10 0 EFAEHO CC[C@@H](C)C[NH+]1CCC([C@@H](C)NC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001380134553 1347527409 /nfs/dbraw/zinc/52/74/09/1347527409.db2.gz WIRPOPAHDAAKDP-JFIYKMOQSA-N 1 3 325.541 2.835 10 0 EFAEHO C[C@H]([NH2+]C1(CNC(=O)C(C)(C)N2CCCC2)CC1)c1ccc(F)cc1 ZINC001380143667 1347531879 /nfs/dbraw/zinc/53/18/79/1347531879.db2.gz PIBVZWLLNDIUTB-HNNXBMFYSA-N 1 3 347.478 3.000 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+][C@@H](C)c2ccc(Cl)cc2)CC1)N(C)C ZINC001380159650 1347540387 /nfs/dbraw/zinc/54/03/87/1347540387.db2.gz GSFXDXVJTSZETM-BBRMVZONSA-N 1 3 337.895 2.980 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2cc(F)ccc2C)C1)N(C)C ZINC001380164472 1347543190 /nfs/dbraw/zinc/54/31/90/1347543190.db2.gz VPUSBQDSLOXXBX-DAWZGUTISA-N 1 3 335.467 2.553 10 0 EFAEHO Cc1cc(C[NH2+]C2(CNC(=O)CN3[C@@H](C)CC[C@@H]3C)CC2)c(C)s1 ZINC001380169407 1347545860 /nfs/dbraw/zinc/54/58/60/1347545860.db2.gz DYDMYDODJPCLCL-KBPBESRZSA-N 1 3 349.544 2.976 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+][C@H]2CCCc3ccc(F)cc32)CC1 ZINC001380169950 1347546208 /nfs/dbraw/zinc/54/62/08/1347546208.db2.gz JABVIYWYBGGTGJ-SFHVURJKSA-N 1 3 347.478 2.782 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC([NH2+]Cc2cccc(C(C)C)n2)C1)N(C)C ZINC001380172970 1347547783 /nfs/dbraw/zinc/54/77/83/1347547783.db2.gz UFTBYPLMCKVARI-TVPLGVNVSA-N 1 3 346.519 2.624 10 0 EFAEHO COc1cccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)[C@H](C)C2)c1 ZINC001380272110 1347563984 /nfs/dbraw/zinc/56/39/84/1347563984.db2.gz SKHCHRXPGZPRPO-AEFFLSMTSA-N 1 3 347.503 2.505 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C[NH2+]CC1CCC1)C1CCCC1 ZINC001380319964 1347591009 /nfs/dbraw/zinc/59/10/09/1347591009.db2.gz VHQCYQAYQHWKTB-OALUTQOASA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C(C)C ZINC001393994695 1357365069 /nfs/dbraw/zinc/36/50/69/1357365069.db2.gz HENBCMMSBKIJMG-CVEARBPZSA-N 1 3 348.535 2.836 10 0 EFAEHO CC[C@H](F)CN1CCC(C)(CNC(=O)CC2CC[NH+](C)CC2)CC1 ZINC001380447448 1347677981 /nfs/dbraw/zinc/67/79/81/1347677981.db2.gz GZZYYCKXTCLXMU-KRWDZBQOSA-N 1 3 341.515 2.685 10 0 EFAEHO CC[C@H](C(=O)NC[C@@]1(C)CCC[N@H+](CC2CC(F)(F)C2)C1)N(C)C ZINC001380488729 1347716848 /nfs/dbraw/zinc/71/68/48/1347716848.db2.gz XHXCGEMFQXFWFM-NVXWUHKLSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CC2CC(F)(F)C2)C1)N(C)C ZINC001380488729 1347716851 /nfs/dbraw/zinc/71/68/51/1347716851.db2.gz XHXCGEMFQXFWFM-NVXWUHKLSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)[N@@H+]1CCC(F)(F)[C@H](CNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001380520051 1347738818 /nfs/dbraw/zinc/73/88/18/1347738818.db2.gz QGLFOVYJXXLLRO-OAHLLOKOSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)[N@H+]1CCC(F)(F)[C@H](CNC(=O)C(C)(C)N2CCCCC2)C1 ZINC001380520051 1347738823 /nfs/dbraw/zinc/73/88/23/1347738823.db2.gz QGLFOVYJXXLLRO-OAHLLOKOSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]CCc1ccccc1Cl ZINC001394001600 1357372312 /nfs/dbraw/zinc/37/23/12/1357372312.db2.gz MGXDKHJEOQWGRB-LSDHHAIUSA-N 1 3 339.911 2.706 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]CCc1ccccc1Cl ZINC001394001592 1357372465 /nfs/dbraw/zinc/37/24/65/1357372465.db2.gz MGXDKHJEOQWGRB-HUUCEWRRSA-N 1 3 339.911 2.706 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]CC)c1ccccc1CC ZINC001380658895 1347795154 /nfs/dbraw/zinc/79/51/54/1347795154.db2.gz ULTFLJGGVRMNBW-RBUKOAKNSA-N 1 3 331.504 2.890 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1ccccc1C1CC1 ZINC001394001625 1357372782 /nfs/dbraw/zinc/37/27/82/1357372782.db2.gz MHFFIDZVTSSEDE-HZPDHXFCSA-N 1 3 331.504 2.887 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1ccccc1C1CC1 ZINC001394001608 1357372844 /nfs/dbraw/zinc/37/28/44/1357372844.db2.gz MHFFIDZVTSSEDE-CVEARBPZSA-N 1 3 331.504 2.887 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001380683771 1347811439 /nfs/dbraw/zinc/81/14/39/1347811439.db2.gz VHWCAHGPKRGOMV-PKOBYXMFSA-N 1 3 331.504 2.662 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001394002921 1357374706 /nfs/dbraw/zinc/37/47/06/1357374706.db2.gz RJNHOFAEWMBGDY-ZIAGYGMSSA-N 1 3 325.884 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](CC[NH2+][C@@H](C)c2ccccc2)C1 ZINC001380783926 1347875347 /nfs/dbraw/zinc/87/53/47/1347875347.db2.gz RLVDYFNITLGTJR-ZWKOTPCHSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](CC[NH2+][C@H](C)c2ccccc2)C1 ZINC001380783913 1347875431 /nfs/dbraw/zinc/87/54/31/1347875431.db2.gz RLVDYFNITLGTJR-MSOLQXFVSA-N 1 3 331.504 2.916 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)CCC[NH+](C)C)CCC2)c1 ZINC001380878703 1347931148 /nfs/dbraw/zinc/93/11/48/1347931148.db2.gz PXWZOSRVOVXBNH-UHFFFAOYSA-N 1 3 335.467 2.604 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+]C[C@H]2CCCC(F)(F)C2)CCC1)N(C)C ZINC001380897531 1347943171 /nfs/dbraw/zinc/94/31/71/1347943171.db2.gz SITMSGCCPXEEFB-GJZGRUSLSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]Cc2ccc(Cl)cc2)CCC1 ZINC001380904263 1347947400 /nfs/dbraw/zinc/94/74/00/1347947400.db2.gz ZGGSXHPMVYWZOI-UHFFFAOYSA-N 1 3 337.895 2.809 10 0 EFAEHO CN(CCC[N@H+](C)CC[C@@H]1CCCC1(F)F)C(=O)CN1CCCC1 ZINC001380979355 1348000334 /nfs/dbraw/zinc/00/03/34/1348000334.db2.gz INHRVNWASLTGCK-INIZCTEOSA-N 1 3 345.478 2.688 10 0 EFAEHO CN(CCC[N@@H+](C)CC[C@@H]1CCCC1(F)F)C(=O)CN1CCCC1 ZINC001380979355 1348000337 /nfs/dbraw/zinc/00/03/37/1348000337.db2.gz INHRVNWASLTGCK-INIZCTEOSA-N 1 3 345.478 2.688 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001380980728 1348001836 /nfs/dbraw/zinc/00/18/36/1348001836.db2.gz ICNQBUIPWUJHHD-CVEARBPZSA-N 1 3 347.494 2.932 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001380980728 1348001839 /nfs/dbraw/zinc/00/18/39/1348001839.db2.gz ICNQBUIPWUJHHD-CVEARBPZSA-N 1 3 347.494 2.932 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(CC)([NH2+]CC[C@H](C)F)CC1 ZINC001381023540 1348025180 /nfs/dbraw/zinc/02/51/80/1348025180.db2.gz SSDRZZSNEABFHV-IRXDYDNUSA-N 1 3 341.515 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C)([NH2+]Cc2cccc(F)c2)CC1 ZINC001381129592 1348097033 /nfs/dbraw/zinc/09/70/33/1348097033.db2.gz PBIHPLKCAKVCPS-UHFFFAOYSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC(CC)C[N@@H+]1CC[C@H](NC(=O)CN(C)C(C)C)C(C)(C)C1 ZINC001381140428 1348105058 /nfs/dbraw/zinc/10/50/58/1348105058.db2.gz DDSBWYHYOCILHY-KRWDZBQOSA-N 1 3 325.541 2.980 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC(C)(C)C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CCC1 ZINC001394019153 1357390815 /nfs/dbraw/zinc/39/08/15/1357390815.db2.gz FWQOWCCBPVKLGA-KURKYZTESA-N 1 3 349.563 2.981 10 0 EFAEHO CCCN(C)CC(=O)N1CCC2(CC1)CC[NH+](CC[C@@H](C)F)CC2 ZINC001381242424 1348161331 /nfs/dbraw/zinc/16/13/31/1348161331.db2.gz RSFCTLUQUQBPED-QGZVFWFLSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@H]1C[NH2+]C[C@H](C)CC(C)C)N(C)C ZINC001381270481 1348175938 /nfs/dbraw/zinc/17/59/38/1348175938.db2.gz YUOJUGDZJWGNDD-FGTMMUONSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)C[C@@H]1CCCN1C(=O)CN(C)C(C)C ZINC001381311774 1348205280 /nfs/dbraw/zinc/20/52/80/1348205280.db2.gz HWRBCIRFEOTPJY-ROUUACIJSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)C[C@@H]1CCCN1C(=O)CN(C)C(C)C ZINC001381311774 1348205284 /nfs/dbraw/zinc/20/52/84/1348205284.db2.gz HWRBCIRFEOTPJY-ROUUACIJSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H]2CC[N@H+](CCC3CC3)C2)C1 ZINC001381310666 1348205300 /nfs/dbraw/zinc/20/53/00/1348205300.db2.gz DRPPVZHBGOMCAQ-MOPGFXCFSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H]2CC[N@@H+](CCC3CC3)C2)C1 ZINC001381310666 1348205303 /nfs/dbraw/zinc/20/53/03/1348205303.db2.gz DRPPVZHBGOMCAQ-MOPGFXCFSA-N 1 3 335.536 2.687 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+][C@H](C)c2ccccc2C)C1 ZINC001381343228 1348217459 /nfs/dbraw/zinc/21/74/59/1348217459.db2.gz XUNOFDBHTCFDQW-WWDZGPRUSA-N 1 3 331.504 2.882 10 0 EFAEHO C[C@@H](NC(=O)C1CC[NH+](C)CC1)[C@H](C)NCc1cc2ccccc2o1 ZINC001381427274 1348265996 /nfs/dbraw/zinc/26/59/96/1348265996.db2.gz ZKNDOPNVFHDNNM-LSDHHAIUSA-N 1 3 343.471 2.757 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]CCc1ccc(Cl)cc1 ZINC001381440920 1348276711 /nfs/dbraw/zinc/27/67/11/1348276711.db2.gz CIBVDRMVSIKDMZ-CABCVRRESA-N 1 3 339.911 2.706 10 0 EFAEHO C[C@H](NCC=C(Cl)Cl)[C@H](C)NC(=O)CC1CC[NH+](C)CC1 ZINC001381446299 1348280769 /nfs/dbraw/zinc/28/07/69/1348280769.db2.gz WQTYBPXVJLIGEN-RYUDHWBXSA-N 1 3 336.307 2.520 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@@H](C)CNC(=O)[C@@H]1CCC[N@H+]1C(C)C ZINC001381513723 1348323466 /nfs/dbraw/zinc/32/34/66/1348323466.db2.gz FDKBAFJQZXATFM-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@@H](C)CNC(=O)[C@@H]1CCC[N@@H+]1C(C)C ZINC001381513723 1348323469 /nfs/dbraw/zinc/32/34/69/1348323469.db2.gz FDKBAFJQZXATFM-LPHOPBHVSA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)CC[N@@H+](C)[C@@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001381582731 1348377749 /nfs/dbraw/zinc/37/77/49/1348377749.db2.gz MHHHWNUSVUWDID-MAUKXSAKSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)CC[N@H+](C)[C@@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001381582731 1348377746 /nfs/dbraw/zinc/37/77/46/1348377746.db2.gz MHHHWNUSVUWDID-MAUKXSAKSA-N 1 3 329.504 2.682 10 0 EFAEHO C[C@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)N(C)Cc1cccc(Cl)c1 ZINC001381613918 1348404714 /nfs/dbraw/zinc/40/47/14/1348404714.db2.gz ZQEGVYHPQCMFNB-ZBFHGGJFSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)N(C)Cc1cccc(Cl)c1 ZINC001381613918 1348404716 /nfs/dbraw/zinc/40/47/16/1348404716.db2.gz ZQEGVYHPQCMFNB-ZBFHGGJFSA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC001381639301 1348423819 /nfs/dbraw/zinc/42/38/19/1348423819.db2.gz AVRRHTSEFKSKJV-BEFAXECRSA-N 1 3 349.494 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC001381639301 1348423822 /nfs/dbraw/zinc/42/38/22/1348423822.db2.gz AVRRHTSEFKSKJV-BEFAXECRSA-N 1 3 349.494 2.980 10 0 EFAEHO Cc1cc(F)ccc1CN1CCCCC[C@@H]1CNC(=O)CC[NH+](C)C ZINC001381759779 1348507631 /nfs/dbraw/zinc/50/76/31/1348507631.db2.gz RIXTXABBWBVYKT-LJQANCHMSA-N 1 3 349.494 2.947 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1C[NH+](CC/C=C/c2ccccc2)C1)N(C)C ZINC001381798388 1348533431 /nfs/dbraw/zinc/53/34/31/1348533431.db2.gz WKKCKYBZQSADQP-ZXXPXJJKSA-N 1 3 343.515 2.867 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@]2(C)C[N@H+](Cc3ccsc3)C[C@]2(C)C1 ZINC001381948883 1348622328 /nfs/dbraw/zinc/62/23/28/1348622328.db2.gz OUXOMROGZDRKDY-KDURUIRLSA-N 1 3 349.544 2.760 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@]2(C)C[N@@H+](Cc3ccsc3)C[C@]2(C)C1 ZINC001381948883 1348622330 /nfs/dbraw/zinc/62/23/30/1348622330.db2.gz OUXOMROGZDRKDY-KDURUIRLSA-N 1 3 349.544 2.760 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H](C[NH2+]CC3CCC4(CC4)CC3)C2)CCC1 ZINC001381963935 1348627779 /nfs/dbraw/zinc/62/77/79/1348627779.db2.gz UZXBZMSKUWXCKJ-IYARVYRRSA-N 1 3 347.547 2.926 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(Cl)cc2)C1)N(C)C ZINC001381974546 1348632922 /nfs/dbraw/zinc/63/29/22/1348632922.db2.gz QHPUKVQLZZDZPR-DJIMGWMZSA-N 1 3 337.895 2.665 10 0 EFAEHO CN(C/C=C\Cl)C1CCN(C(=O)C23CCC[NH+](CCC2)C3)CC1 ZINC001381981407 1348637285 /nfs/dbraw/zinc/63/72/85/1348637285.db2.gz NSFQWLPQRMPAAP-WTKPLQERSA-N 1 3 339.911 2.538 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2cccc(F)c2)C1 ZINC001382014258 1348661803 /nfs/dbraw/zinc/66/18/03/1348661803.db2.gz QSXKMUUDXJCQHY-IIDMSEBBSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC001382170532 1348791642 /nfs/dbraw/zinc/79/16/42/1348791642.db2.gz XXWWPNZLROBDBZ-ZIAGYGMSSA-N 1 3 341.446 2.803 10 0 EFAEHO C[C@@H]1[C@H]([NH2+]CCC(C)(C)C)CCN1C(=O)CN(C)CC(C)(C)C ZINC001382283143 1348845247 /nfs/dbraw/zinc/84/52/47/1348845247.db2.gz HDHXLNMWCYVFTF-HZPDHXFCSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)[C@@H](C)CNC(=O)[C@H]1CCCN1C(C)C ZINC001394061201 1357430171 /nfs/dbraw/zinc/43/01/71/1357430171.db2.gz VRGXXPHSJXBUCP-PKOBYXMFSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccccc1C[N@H+](C)[C@@H](C)CNC(=O)[C@H]1CCCN1C(C)C ZINC001394061201 1357430173 /nfs/dbraw/zinc/43/01/73/1357430173.db2.gz VRGXXPHSJXBUCP-PKOBYXMFSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@@H]1CC[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001382351063 1348903649 /nfs/dbraw/zinc/90/36/49/1348903649.db2.gz QDBVRIFHJLSPRN-VQIMIIECSA-N 1 3 349.494 2.849 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]C[C@@H](C)CC(C)C)C(C)(C)C1 ZINC001382382111 1348924575 /nfs/dbraw/zinc/92/45/75/1348924575.db2.gz XQMYBAUSYQTZLD-IRXDYDNUSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]Cc1ccsc1)C(C)(C)C ZINC001382536715 1349003192 /nfs/dbraw/zinc/00/31/92/1349003192.db2.gz AEHYDQNGANRKDC-OAHLLOKOSA-N 1 3 325.522 2.709 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+][C@H](C)c2cccc(F)c2)C1 ZINC001382589536 1349037013 /nfs/dbraw/zinc/03/70/13/1349037013.db2.gz MDWYLJJYNRHGAU-RWBZWWBESA-N 1 3 335.467 2.806 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)CC[C@@H]1CCC[C@H](C)C1 ZINC001420055701 1376393444 /nfs/dbraw/zinc/39/34/44/1376393444.db2.gz BBPAZIJUQYGKGM-ROUUACIJSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)CC[C@@H]1CCC[C@H](C)C1 ZINC001420055701 1376393449 /nfs/dbraw/zinc/39/34/49/1376393449.db2.gz BBPAZIJUQYGKGM-ROUUACIJSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@H+](C)Cc1ccc(Cl)cc1 ZINC001394139838 1357523589 /nfs/dbraw/zinc/52/35/89/1357523589.db2.gz RKIILHJDCGDUNE-CQSZACIVSA-N 1 3 325.884 2.617 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001394139838 1357523593 /nfs/dbraw/zinc/52/35/93/1357523593.db2.gz RKIILHJDCGDUNE-CQSZACIVSA-N 1 3 325.884 2.617 10 0 EFAEHO CCCC[C@H](CNCc1cc(C)ccc1F)NC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001394205636 1357591324 /nfs/dbraw/zinc/59/13/24/1357591324.db2.gz RBEBTERROQRWBO-SJLPKXTDSA-N 1 3 349.494 2.850 10 0 EFAEHO CCCC[C@H](CNCc1cc(C)ccc1F)NC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001394205636 1357591327 /nfs/dbraw/zinc/59/13/27/1357591327.db2.gz RBEBTERROQRWBO-SJLPKXTDSA-N 1 3 349.494 2.850 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@H](C)C1)C1C[NH+](CC2CCC3(CC3)CC2)C1 ZINC001394253151 1357640812 /nfs/dbraw/zinc/64/08/12/1357640812.db2.gz UGZYRRHSZSQMQU-DLBZAZTESA-N 1 3 347.547 2.735 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2C[C@@H]([NH2+][C@@H]3CCc4ccccc43)C2)C1 ZINC001388688135 1352921966 /nfs/dbraw/zinc/92/19/66/1352921966.db2.gz POVHQFOTEJZRNX-ZTRFORPCSA-N 1 3 341.499 2.500 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@@H]([NH2+]C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001388689077 1352922603 /nfs/dbraw/zinc/92/26/03/1352922603.db2.gz UBRNHXPKOOOQIW-JONQDZQNSA-N 1 3 345.478 2.637 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)c(C)s1 ZINC001388701641 1352932014 /nfs/dbraw/zinc/93/20/14/1352932014.db2.gz DFXGAPKCQQTVQP-WOVMCDHWSA-N 1 3 337.533 2.690 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2csc(C)c2)C1)N(C)C ZINC001388759241 1352984787 /nfs/dbraw/zinc/98/47/87/1352984787.db2.gz OPJSRFRYUVFLOH-USXIJHARSA-N 1 3 337.533 2.771 10 0 EFAEHO CCCN(C)CC(=O)N1CC2(C[C@H]1C)CC[NH+](C[C@H](F)CC)CC2 ZINC001388764149 1352988756 /nfs/dbraw/zinc/98/87/56/1352988756.db2.gz USLSBFAQDMXUSO-IAGOWNOFSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@@H](F)CCN1CCC[C@@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001389375982 1353344773 /nfs/dbraw/zinc/34/47/73/1353344773.db2.gz OEDFEWNABLHLRD-HZPDHXFCSA-N 1 3 341.515 2.968 10 0 EFAEHO C[C@@H](F)CCN1CCC[C@@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001389375982 1353344779 /nfs/dbraw/zinc/34/47/79/1353344779.db2.gz OEDFEWNABLHLRD-HZPDHXFCSA-N 1 3 341.515 2.968 10 0 EFAEHO Cc1cc(CN2CC[C@@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c(C)s1 ZINC001389458844 1353405835 /nfs/dbraw/zinc/40/58/35/1353405835.db2.gz JPTGXUMOZMAZSF-QZTJIDSGSA-N 1 3 349.544 2.930 10 0 EFAEHO Cc1cc(CN2CC[C@@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c(C)s1 ZINC001389458844 1353405838 /nfs/dbraw/zinc/40/58/38/1353405838.db2.gz JPTGXUMOZMAZSF-QZTJIDSGSA-N 1 3 349.544 2.930 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCN(Cc2ccc(C(C)(C)C)cc2)C1 ZINC001389478225 1353417314 /nfs/dbraw/zinc/41/73/14/1353417314.db2.gz INZOXVBQCXDGNH-SFHVURJKSA-N 1 3 331.504 2.626 10 0 EFAEHO CC(C)CC[NH+]1CCC2(C[C@@H]2NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001389529660 1353456805 /nfs/dbraw/zinc/45/68/05/1353456805.db2.gz VBBNMGQLDJSNNN-KRWDZBQOSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)C1CC1 ZINC001389612325 1353510432 /nfs/dbraw/zinc/51/04/32/1353510432.db2.gz PSRDUXCTTUKUJH-PMACEKPBSA-N 1 3 343.515 2.852 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]([NH2+]Cc2ccccc2Cl)C2CC2)C1 ZINC001389673466 1353544770 /nfs/dbraw/zinc/54/47/70/1353544770.db2.gz WLWFTWZNWQMMJX-KDOFPFPSSA-N 1 3 349.906 2.666 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@@H](CC)c3ccccc3)C[C@H]21 ZINC001394326828 1357703919 /nfs/dbraw/zinc/70/39/19/1357703919.db2.gz UKNOGBAHVXJGIB-HAGHYFMRSA-N 1 3 343.515 2.774 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@@H](CC)c3ccccc3)C[C@H]21 ZINC001394326828 1357703924 /nfs/dbraw/zinc/70/39/24/1357703924.db2.gz UKNOGBAHVXJGIB-HAGHYFMRSA-N 1 3 343.515 2.774 10 0 EFAEHO CCC(CC)C[N@H+](C)C[C@@H]1CCCN(C(=O)[C@@H](CC)N(C)C)C1 ZINC001389768802 1353609870 /nfs/dbraw/zinc/60/98/70/1353609870.db2.gz WCNJJEPJNZPESC-ZWKOTPCHSA-N 1 3 325.541 2.933 10 0 EFAEHO CCC(CC)C[N@@H+](C)C[C@@H]1CCCN(C(=O)[C@@H](CC)N(C)C)C1 ZINC001389768802 1353609873 /nfs/dbraw/zinc/60/98/73/1353609873.db2.gz WCNJJEPJNZPESC-ZWKOTPCHSA-N 1 3 325.541 2.933 10 0 EFAEHO O=C([C@@H]1CC[N@@H+](C2CCCCC2)C1)N1CC[C@H](NC/C=C/Cl)C1 ZINC001389781435 1353617112 /nfs/dbraw/zinc/61/71/12/1353617112.db2.gz LCPASIBPDLTCJV-VVXZVVLWSA-N 1 3 339.911 2.584 10 0 EFAEHO O=C([C@@H]1CC[N@H+](C2CCCCC2)C1)N1CC[C@H](NC/C=C/Cl)C1 ZINC001389781435 1353617119 /nfs/dbraw/zinc/61/71/19/1353617119.db2.gz LCPASIBPDLTCJV-VVXZVVLWSA-N 1 3 339.911 2.584 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+]([C@@H](C)c3ccc(F)cc3)C[C@H]21 ZINC001394334269 1357709167 /nfs/dbraw/zinc/70/91/67/1357709167.db2.gz DXESPLGLFRCATJ-UDTPNQRGSA-N 1 3 347.478 2.521 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@@H](C)c3ccc(F)cc3)C[C@H]21 ZINC001394334269 1357709170 /nfs/dbraw/zinc/70/91/70/1357709170.db2.gz DXESPLGLFRCATJ-UDTPNQRGSA-N 1 3 347.478 2.521 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@H]2CCc3ccc(Cl)cc32)C1 ZINC001389907846 1353681929 /nfs/dbraw/zinc/68/19/29/1353681929.db2.gz OUYVPIIOLWEUOS-BQFCYCMXSA-N 1 3 349.906 2.904 10 0 EFAEHO CC(C)[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CCCC1)N(C)C ZINC001389942160 1353701082 /nfs/dbraw/zinc/70/10/82/1353701082.db2.gz QIOFTNJVGRZVGF-XVLXNVKGSA-N 1 3 335.536 2.874 10 0 EFAEHO CC(C)[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCCC1)N(C)C ZINC001389942160 1353701084 /nfs/dbraw/zinc/70/10/84/1353701084.db2.gz QIOFTNJVGRZVGF-XVLXNVKGSA-N 1 3 335.536 2.874 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)c(Cl)c1 ZINC001389958452 1353710046 /nfs/dbraw/zinc/71/00/46/1353710046.db2.gz KVFSJSVSMZFABJ-IYBDPMFKSA-N 1 3 349.906 2.870 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCc3c2cccc3Cl)C1)N(C)C ZINC001390007050 1353738426 /nfs/dbraw/zinc/73/84/26/1353738426.db2.gz GFYGGQQZHBDUPU-JGTCGTHISA-N 1 3 349.906 2.904 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+][C@H]1C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C1 ZINC001390008519 1353739285 /nfs/dbraw/zinc/73/92/85/1353739285.db2.gz IEAOZJWBEORQFT-VXNCWWDNSA-N 1 3 331.504 2.879 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]CC2CCC3(CC3)CC2)C1)N(C)C ZINC001390009945 1353740455 /nfs/dbraw/zinc/74/04/55/1353740455.db2.gz LKFULJAEFXUWAM-FGTMMUONSA-N 1 3 335.536 2.780 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001390043957 1353762066 /nfs/dbraw/zinc/76/20/66/1353762066.db2.gz QSHUXAWMLQSOAT-WMZOPIPTSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001390043957 1353762071 /nfs/dbraw/zinc/76/20/71/1353762071.db2.gz QSHUXAWMLQSOAT-WMZOPIPTSA-N 1 3 337.552 2.837 10 0 EFAEHO CCc1ccc(C[N@@H+]2CCC[C@@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001390054678 1353770689 /nfs/dbraw/zinc/77/06/89/1353770689.db2.gz FAXDSDPLENMYLI-FQEVSTJZSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccc(C[N@H+]2CCC[C@@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001390054678 1353770693 /nfs/dbraw/zinc/77/06/93/1353770693.db2.gz FAXDSDPLENMYLI-FQEVSTJZSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001390063590 1353777462 /nfs/dbraw/zinc/77/74/62/1353777462.db2.gz NSDHHPSNSMMFEA-ZWKOTPCHSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)CCC[N@H+]1CCC[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001390063590 1353777464 /nfs/dbraw/zinc/77/74/64/1353777464.db2.gz NSDHHPSNSMMFEA-ZWKOTPCHSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@](F)(C(=O)NC[C@H]2CCCCN2CCCF)C1 ZINC001390138313 1353849019 /nfs/dbraw/zinc/84/90/19/1353849019.db2.gz IEUOTQBJMBBFHK-CRAIPNDOSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)NC[C@H]2CCCCN2CCCF)C1 ZINC001390138313 1353849024 /nfs/dbraw/zinc/84/90/24/1353849024.db2.gz IEUOTQBJMBBFHK-CRAIPNDOSA-N 1 3 345.478 2.529 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](Cc3ccsc3)C[C@@H]2C1 ZINC001394350707 1357724270 /nfs/dbraw/zinc/72/42/70/1357724270.db2.gz PEIAGOIDBLFAPI-OKZBNKHCSA-N 1 3 349.544 2.807 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccsc3)C[C@@H]2C1 ZINC001394350707 1357724275 /nfs/dbraw/zinc/72/42/75/1357724275.db2.gz PEIAGOIDBLFAPI-OKZBNKHCSA-N 1 3 349.544 2.807 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]Cc2cccc(F)c2)CC1)N(C)C ZINC001390272266 1353969556 /nfs/dbraw/zinc/96/95/56/1353969556.db2.gz LSXRGXQBZZIVHV-DAWZGUTISA-N 1 3 335.467 2.683 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H](C)CNC(=O)[C@H]2CCCN2C(C)C)c1 ZINC001390359499 1354027291 /nfs/dbraw/zinc/02/72/91/1354027291.db2.gz JAIWTPVGNUWANB-IEBWSBKVSA-N 1 3 331.504 2.771 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1ccc(C)c(F)c1 ZINC001390394150 1354060118 /nfs/dbraw/zinc/06/01/18/1354060118.db2.gz AAWUPBOLXLIPLT-MAUKXSAKSA-N 1 3 335.467 2.603 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]CCc1ccc2ccccc2c1)N(C)C ZINC001390414948 1354072719 /nfs/dbraw/zinc/07/27/19/1354072719.db2.gz OYYSMGAHTMZWKJ-OXJNMPFZSA-N 1 3 341.499 2.817 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H](C)CNC(=O)C(C)(C)N2CCCC2)c1 ZINC001390451684 1354088682 /nfs/dbraw/zinc/08/86/82/1354088682.db2.gz FWUHVLHRUBEYTI-KRWDZBQOSA-N 1 3 331.504 2.772 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@@H](C)CNC(=O)C(C)(C)N2CCCC2)c1 ZINC001390460098 1354096041 /nfs/dbraw/zinc/09/60/41/1354096041.db2.gz MUPZTOHBVLLPRZ-JKSUJKDBSA-N 1 3 347.503 2.725 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2cc3ccccc3o2)C1)N(C)C ZINC001394855556 1358161844 /nfs/dbraw/zinc/16/18/44/1358161844.db2.gz XOQVXZRVBNLRHM-LEOMRAHMSA-N 1 3 343.471 2.852 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](C)[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C ZINC001390502494 1354130557 /nfs/dbraw/zinc/13/05/57/1354130557.db2.gz CWMQSMHDBHUBID-HNAYVOBHSA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001390530841 1354152737 /nfs/dbraw/zinc/15/27/37/1354152737.db2.gz DNZBFQLGJPESDJ-RDTXWAMCSA-N 1 3 335.467 2.638 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CC[C@H]([NH2+]C/C=C/c2ccccc2)C1 ZINC001390555578 1354169250 /nfs/dbraw/zinc/16/92/50/1354169250.db2.gz BYAGLXCCWLCWNZ-GWDHXLPESA-N 1 3 347.478 2.570 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+][C@@H]2CCCc3ccccc32)C1 ZINC001390573882 1354181821 /nfs/dbraw/zinc/18/18/21/1354181821.db2.gz GBTSATDTUNPMKF-PKOBYXMFSA-N 1 3 329.488 2.595 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+][C@@H]2CCCc3ccccc32)C1 ZINC001390596822 1354193919 /nfs/dbraw/zinc/19/39/19/1354193919.db2.gz NNHQYAIQPZBOIO-YLJYHZDGSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]([NH2+]Cc2ccc(F)cc2)C1 ZINC001390607520 1354201693 /nfs/dbraw/zinc/20/16/93/1354201693.db2.gz IQKUCQSWYMIUAU-ROUUACIJSA-N 1 3 335.467 2.683 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccccc1Cl ZINC001390699648 1354291059 /nfs/dbraw/zinc/29/10/59/1354291059.db2.gz BODHVSZYXRNLDO-GJZGRUSLSA-N 1 3 337.895 2.666 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001390699623 1354291558 /nfs/dbraw/zinc/29/15/58/1354291558.db2.gz BGYLKSQDNLHQDQ-SJORKVTESA-N 1 3 343.515 2.502 10 0 EFAEHO C[C@@H](c1ccc(Cl)cc1)N(C)CCNC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001390754045 1354342216 /nfs/dbraw/zinc/34/22/16/1354342216.db2.gz FPYYRJVEVMEFTO-KBXCAEBGSA-N 1 3 349.906 2.791 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCN(C)Cc2ccc(C3CC3)cc2)CC[N@@H+]1C ZINC001390812933 1354399567 /nfs/dbraw/zinc/39/95/67/1354399567.db2.gz KDARTBDMRDFSCL-JXFKEZNVSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCN(C)Cc2ccc(C3CC3)cc2)CC[N@H+]1C ZINC001390812933 1354399572 /nfs/dbraw/zinc/39/95/72/1354399572.db2.gz KDARTBDMRDFSCL-JXFKEZNVSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)N(C)CCNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001390846619 1354430999 /nfs/dbraw/zinc/43/09/99/1354430999.db2.gz RLSVNYYHSCTDQC-LSDHHAIUSA-N 1 3 337.895 2.791 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)N(C)CCNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001390846619 1354431001 /nfs/dbraw/zinc/43/10/01/1354431001.db2.gz RLSVNYYHSCTDQC-LSDHHAIUSA-N 1 3 337.895 2.791 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@]2(C)C[N@H+](CC3CCCC3)C[C@]2(C)C1 ZINC001394361807 1357736234 /nfs/dbraw/zinc/73/62/34/1357736234.db2.gz UDMAULPVRLAGSE-BGYRXZFFSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@]2(C)C[N@@H+](CC3CCCC3)C[C@]2(C)C1 ZINC001394361807 1357736237 /nfs/dbraw/zinc/73/62/37/1357736237.db2.gz UDMAULPVRLAGSE-BGYRXZFFSA-N 1 3 335.536 2.687 10 0 EFAEHO CC[C@@H](F)CN1CC[C@H](CNC(=O)CC[N@H+](C)C2CCCCC2)C1 ZINC001391096220 1354789489 /nfs/dbraw/zinc/78/94/89/1354789489.db2.gz INTQRXOOALHFPX-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@@H](F)CN1CC[C@H](CNC(=O)CC[N@@H+](C)C2CCCCC2)C1 ZINC001391096220 1354789493 /nfs/dbraw/zinc/78/94/93/1354789493.db2.gz INTQRXOOALHFPX-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)c(C)s1 ZINC001391097589 1354790832 /nfs/dbraw/zinc/79/08/32/1354790832.db2.gz BHCMDPZRAYAZCS-YOEHRIQHSA-N 1 3 349.544 2.645 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)c(C)s1 ZINC001391097589 1354790836 /nfs/dbraw/zinc/79/08/36/1354790836.db2.gz BHCMDPZRAYAZCS-YOEHRIQHSA-N 1 3 349.544 2.645 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCN(Cc2ccc(F)cc2)C1 ZINC001391108274 1354804906 /nfs/dbraw/zinc/80/49/06/1354804906.db2.gz WEIZXZWBCQNADO-PKOBYXMFSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCN(Cc2ccc(F)cc2)C1 ZINC001391108274 1354804911 /nfs/dbraw/zinc/80/49/11/1354804911.db2.gz WEIZXZWBCQNADO-PKOBYXMFSA-N 1 3 347.478 2.638 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@H+](Cc2cc3ccccc3o2)C1)N(C)C ZINC001391109396 1354807725 /nfs/dbraw/zinc/80/77/25/1354807725.db2.gz KEQWBSACUBPOIF-MAUKXSAKSA-N 1 3 343.471 2.711 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CC[N@@H+](Cc2cc3ccccc3o2)C1)N(C)C ZINC001391109396 1354807728 /nfs/dbraw/zinc/80/77/28/1354807728.db2.gz KEQWBSACUBPOIF-MAUKXSAKSA-N 1 3 343.471 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](Cc2ccccn2)CC(C)(C)C1 ZINC001397811787 1360164109 /nfs/dbraw/zinc/16/41/09/1360164109.db2.gz KRZBRMSQLCYVCI-KRWDZBQOSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](Cc2ccccn2)CC(C)(C)C1 ZINC001397811787 1360164112 /nfs/dbraw/zinc/16/41/12/1360164112.db2.gz KRZBRMSQLCYVCI-KRWDZBQOSA-N 1 3 346.519 2.529 10 0 EFAEHO CC1CCC(C[N@H+](CCNC(=O)CN(C)C2CCC2)C2CC2)CC1 ZINC001391168965 1354892739 /nfs/dbraw/zinc/89/27/39/1354892739.db2.gz PIDCZIJNLKBLFX-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO CC1CCC(C[N@@H+](CCNC(=O)CN(C)C2CCC2)C2CC2)CC1 ZINC001391168965 1354892744 /nfs/dbraw/zinc/89/27/44/1354892744.db2.gz PIDCZIJNLKBLFX-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+][C@H](C)c1cccc(OC)c1 ZINC001391226258 1354948408 /nfs/dbraw/zinc/94/84/08/1354948408.db2.gz MTVUMQVUMLWWGY-APWZRJJASA-N 1 3 347.503 2.679 10 0 EFAEHO C[C@@H]([NH2+]CCC(C)(C)C)C1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001391235391 1354958059 /nfs/dbraw/zinc/95/80/59/1354958059.db2.gz DKJWOXUDBRWJGL-DLBZAZTESA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H]1CC[N@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001391320368 1355069799 /nfs/dbraw/zinc/06/97/99/1355069799.db2.gz AAXQYINZUNSTMA-FUHWJXTLSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H]1CC[N@@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001391320368 1355069803 /nfs/dbraw/zinc/06/98/03/1355069803.db2.gz AAXQYINZUNSTMA-FUHWJXTLSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@@H]1CC[N@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001391320373 1355069814 /nfs/dbraw/zinc/06/98/14/1355069814.db2.gz AAXQYINZUNSTMA-SJLPKXTDSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@@H]1CC[N@@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001391320373 1355069815 /nfs/dbraw/zinc/06/98/15/1355069815.db2.gz AAXQYINZUNSTMA-SJLPKXTDSA-N 1 3 337.552 2.837 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001391333208 1355088193 /nfs/dbraw/zinc/08/81/93/1355088193.db2.gz HNTFPKACCWFOTH-SFHVURJKSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001391333208 1355088196 /nfs/dbraw/zinc/08/81/96/1355088196.db2.gz HNTFPKACCWFOTH-SFHVURJKSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001391354070 1355115223 /nfs/dbraw/zinc/11/52/23/1355115223.db2.gz IEXKJFHXMXPTPC-SFHVURJKSA-N 1 3 331.504 2.616 10 0 EFAEHO Cc1ccccc1C[N@H+](C)C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001391354070 1355115227 /nfs/dbraw/zinc/11/52/27/1355115227.db2.gz IEXKJFHXMXPTPC-SFHVURJKSA-N 1 3 331.504 2.616 10 0 EFAEHO CCC[N@@H+]1CC[C@@H](N(CC)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001391655238 1355407440 /nfs/dbraw/zinc/40/74/40/1355407440.db2.gz MEYNVWNVFMHYGA-QAPCUYQASA-N 1 3 327.488 2.532 10 0 EFAEHO CCC[N@H+]1CC[C@@H](N(CC)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001391655238 1355407446 /nfs/dbraw/zinc/40/74/46/1355407446.db2.gz MEYNVWNVFMHYGA-QAPCUYQASA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H](C(C)C)[NH+](C)C)NCc1cc(C)ccc1F ZINC001391693503 1355440179 /nfs/dbraw/zinc/44/01/79/1355440179.db2.gz KFSDNGYMFWAVJS-WMZOPIPTSA-N 1 3 337.483 2.705 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)NCc1ccccc1F ZINC001391722581 1355465595 /nfs/dbraw/zinc/46/55/95/1355465595.db2.gz YJFBESBPRJSBGS-YQQAZPJKSA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)NCc1ccccc1F ZINC001391722581 1355465597 /nfs/dbraw/zinc/46/55/97/1355465597.db2.gz YJFBESBPRJSBGS-YQQAZPJKSA-N 1 3 335.467 2.540 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H]1CCc2c1cccc2F ZINC001391757610 1355502605 /nfs/dbraw/zinc/50/26/05/1355502605.db2.gz ZXUZJGZDDKPJIS-KDOFPFPSSA-N 1 3 335.467 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@](C)(C[NH2+][C@@H]1CCc2ccccc21)C1CC1 ZINC001391801708 1355544955 /nfs/dbraw/zinc/54/49/55/1355544955.db2.gz HQKTYNYCIBZYIQ-CTNGQTDRSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@](C)(C[NH2+][C@H]1CCc2ccccc21)C1CC1 ZINC001391801732 1355545003 /nfs/dbraw/zinc/54/50/03/1355545003.db2.gz HQKTYNYCIBZYIQ-PZJWPPBQSA-N 1 3 343.515 2.889 10 0 EFAEHO CC[C@H]([NH2+]C[C@H]1CCCN1C(=O)CN1CCCC1)c1ccccc1 ZINC001391862113 1355601691 /nfs/dbraw/zinc/60/16/91/1355601691.db2.gz RLBGWWGGEFGTLZ-MOPGFXCFSA-N 1 3 329.488 2.814 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H](C)CNC(=O)[C@H](C(C)C)N(C)C)c1 ZINC001391896545 1355631321 /nfs/dbraw/zinc/63/13/21/1355631321.db2.gz HGUKPXJWEJXTMM-QAPCUYQASA-N 1 3 337.483 2.562 10 0 EFAEHO CC(C)c1cccc(C[NH2+]C[C@H](C)CNC(=O)C2(N(C)C)CCC2)n1 ZINC001391919024 1355647971 /nfs/dbraw/zinc/64/79/71/1355647971.db2.gz MCRYFJUTZQRNJC-INIZCTEOSA-N 1 3 346.519 2.531 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1F ZINC001391942238 1355667243 /nfs/dbraw/zinc/66/72/43/1355667243.db2.gz TXBQNLDEDZVTSO-OAHLLOKOSA-N 1 3 349.494 2.850 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)CNC(=O)C(C)(C)N2CCCC2)cc1F ZINC001391942237 1355667381 /nfs/dbraw/zinc/66/73/81/1355667381.db2.gz TXBQNLDEDZVTSO-HNNXBMFYSA-N 1 3 349.494 2.850 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H](C)C[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001391951833 1355675144 /nfs/dbraw/zinc/67/51/44/1355675144.db2.gz QZWZUTIWWLMMDL-DNVCBOLYSA-N 1 3 344.503 2.596 10 0 EFAEHO CC(C)(C(=O)NCC1([NH2+]CCC(F)(F)F)CCCC1)N1CCCC1 ZINC001392014875 1355716680 /nfs/dbraw/zinc/71/66/80/1355716680.db2.gz CJMZSQLJBCNVHH-UHFFFAOYSA-N 1 3 349.441 2.832 10 0 EFAEHO Cc1cc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCCC2)cs1 ZINC001392025772 1355724484 /nfs/dbraw/zinc/72/44/84/1355724484.db2.gz RXDUUKYFZAUOGN-UHFFFAOYSA-N 1 3 337.533 2.915 10 0 EFAEHO Cc1cc(CN2CC3(C2)CCN(C(=O)CC[NH+](C)C)CC3)c(C)s1 ZINC001392027511 1355725244 /nfs/dbraw/zinc/72/52/44/1355725244.db2.gz RJHGWRVYLGFIHW-UHFFFAOYSA-N 1 3 349.544 2.741 10 0 EFAEHO C[C@H](CNCc1ccccc1F)N(C)C(=O)CC[C@H]1CCC[N@@H+]1C ZINC001392072598 1355749548 /nfs/dbraw/zinc/74/95/48/1355749548.db2.gz FXZYFKSDAJGNNB-NVXWUHKLSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@H](CNCc1ccccc1F)N(C)C(=O)CC[C@H]1CCC[N@H+]1C ZINC001392072598 1355749549 /nfs/dbraw/zinc/74/95/49/1355749549.db2.gz FXZYFKSDAJGNNB-NVXWUHKLSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001392137958 1355795760 /nfs/dbraw/zinc/79/57/60/1355795760.db2.gz LMZVUCQWIBVLDF-CYBMUJFWSA-N 1 3 343.874 2.756 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H](NC(=O)C1(N(C)C)CCC1)C1CCCCC1 ZINC001392163851 1355817255 /nfs/dbraw/zinc/81/72/55/1355817255.db2.gz KKVVFYYFVVLHLC-SJORKVTESA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1F ZINC001392176547 1355831125 /nfs/dbraw/zinc/83/11/25/1355831125.db2.gz FHHGAIKWDKRJKW-APWZRJJASA-N 1 3 349.494 2.801 10 0 EFAEHO CN(C/C=C\Cl)CCC1CCN(C(=O)C[C@@H]2CC[N@H+](C)C2)CC1 ZINC001392191911 1355846742 /nfs/dbraw/zinc/84/67/42/1355846742.db2.gz CPAIORZJJZIURQ-VCKUIECUSA-N 1 3 341.927 2.641 10 0 EFAEHO CN(C/C=C\Cl)CCC1CCN(C(=O)C[C@@H]2CC[N@@H+](C)C2)CC1 ZINC001392191911 1355846747 /nfs/dbraw/zinc/84/67/47/1355846747.db2.gz CPAIORZJJZIURQ-VCKUIECUSA-N 1 3 341.927 2.641 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001392195244 1355851030 /nfs/dbraw/zinc/85/10/30/1355851030.db2.gz RMGRRVOKSRVEDI-IAGOWNOFSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)CCC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001392195244 1355851035 /nfs/dbraw/zinc/85/10/35/1355851035.db2.gz RMGRRVOKSRVEDI-IAGOWNOFSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc(F)cc1 ZINC001392230319 1355885244 /nfs/dbraw/zinc/88/52/44/1355885244.db2.gz WPTLHPVVESNIHT-GOSISDBHSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H]1CCc2ccccc21 ZINC001392248140 1355905153 /nfs/dbraw/zinc/90/51/53/1355905153.db2.gz GCOSECXEMGOJOS-MOPGFXCFSA-N 1 3 331.504 2.745 10 0 EFAEHO CC[C@H](C)C[N@H+](C)CCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001392316615 1355976710 /nfs/dbraw/zinc/97/67/10/1355976710.db2.gz XETHUZVPIQACLA-MAUKXSAKSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@H]21 ZINC001392344880 1356011047 /nfs/dbraw/zinc/01/10/47/1356011047.db2.gz WPYODRIHHILWNA-QZTJIDSGSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@H]2CN(C(=O)C3(N(C)C)CCC3)CC[C@H]21 ZINC001392344880 1356011051 /nfs/dbraw/zinc/01/10/51/1356011051.db2.gz WPYODRIHHILWNA-QZTJIDSGSA-N 1 3 335.536 2.830 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1C[C@H](NC(=O)CN(C)C2CCC2)C1 ZINC001394375641 1357747470 /nfs/dbraw/zinc/74/74/70/1357747470.db2.gz NOOXTUWCOXHQQL-RUCARUNLSA-N 1 3 343.515 2.718 10 0 EFAEHO CCN(CC[NH2+][C@H](C)c1cc(C)ccc1C)C(=O)Cc1c[nH]cn1 ZINC001392458284 1356052524 /nfs/dbraw/zinc/05/25/24/1356052524.db2.gz XRVXRZLFVCLXLL-MRXNPFEDSA-N 1 3 328.460 2.768 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+][C@H]1CCCc2ccc(F)cc21)N(C)C ZINC001392488726 1356069894 /nfs/dbraw/zinc/06/98/94/1356069894.db2.gz YSMWUPOSFPSEHO-JEBQAFNWSA-N 1 3 335.467 2.638 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[NH2+]Cc1cc(F)ccc1C ZINC001392538408 1356109934 /nfs/dbraw/zinc/10/99/34/1356109934.db2.gz VPKXEQPAIGKLQD-QAPCUYQASA-N 1 3 335.467 2.603 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]Cc1ccc(C(F)F)cc1)N(C)C ZINC001392571939 1356129037 /nfs/dbraw/zinc/12/90/37/1356129037.db2.gz BPSIYZJUDYJDOI-SWLSCSKDSA-N 1 3 327.419 2.559 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)Cc2cccc(C)c2)CC[N@@H+]1C ZINC001392640434 1356185942 /nfs/dbraw/zinc/18/59/42/1356185942.db2.gz GIKXKAIAKLBUEU-NZSAHSFTSA-N 1 3 331.504 2.662 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)Cc2cccc(C)c2)CC[N@H+]1C ZINC001392640434 1356185946 /nfs/dbraw/zinc/18/59/46/1356185946.db2.gz GIKXKAIAKLBUEU-NZSAHSFTSA-N 1 3 331.504 2.662 10 0 EFAEHO CC(C)CC[N@@H+](C)C[C@@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001392688150 1356238734 /nfs/dbraw/zinc/23/87/34/1356238734.db2.gz RHBCHEVFHPNBTR-QAPCUYQASA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)CC[N@H+](C)C[C@@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001392688150 1356238731 /nfs/dbraw/zinc/23/87/31/1356238731.db2.gz RHBCHEVFHPNBTR-QAPCUYQASA-N 1 3 329.504 2.682 10 0 EFAEHO C[C@H](C[N@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001392691403 1356242774 /nfs/dbraw/zinc/24/27/74/1356242774.db2.gz ZQHMVKTYIGOERP-DLBZAZTESA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](C[N@@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001392691403 1356242777 /nfs/dbraw/zinc/24/27/77/1356242777.db2.gz ZQHMVKTYIGOERP-DLBZAZTESA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](C[N@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001392691408 1356243495 /nfs/dbraw/zinc/24/34/95/1356243495.db2.gz ZQHMVKTYIGOERP-IRXDYDNUSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@@H](C[N@@H+](C)Cc1ccc(C2CC2)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001392691408 1356243500 /nfs/dbraw/zinc/24/35/00/1356243500.db2.gz ZQHMVKTYIGOERP-IRXDYDNUSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)C[C@H](C)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001392731609 1356290127 /nfs/dbraw/zinc/29/01/27/1356290127.db2.gz WUTPJBKSLLAUFR-HOCLYGCPSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)C[C@H](C)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001392731609 1356290132 /nfs/dbraw/zinc/29/01/32/1356290132.db2.gz WUTPJBKSLLAUFR-HOCLYGCPSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]C[C@H](NC(=O)CN(C)C(C)C)C2CC2)c1 ZINC001392803142 1356340458 /nfs/dbraw/zinc/34/04/58/1356340458.db2.gz SDBDCYXKJODWPH-LPHOPBHVSA-N 1 3 331.504 2.881 10 0 EFAEHO CC[C@H]1CN(C(=O)CN2CCC(C)CC2)CC[C@H]1[NH2+]CCC(C)C ZINC001392805384 1356341934 /nfs/dbraw/zinc/34/19/34/1356341934.db2.gz FQZZMPKOFMCIBY-RBUKOAKNSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1 ZINC001401746329 1363078667 /nfs/dbraw/zinc/07/86/67/1363078667.db2.gz AVGOHPWMVGTTIK-CRAIPNDOSA-N 1 3 335.467 2.635 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(F)cc1 ZINC001401746329 1363078670 /nfs/dbraw/zinc/07/86/70/1363078670.db2.gz AVGOHPWMVGTTIK-CRAIPNDOSA-N 1 3 335.467 2.635 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)C[C@H](C)NC(=O)c1sccc1CN(C)C ZINC001401755933 1363090369 /nfs/dbraw/zinc/09/03/69/1363090369.db2.gz KTMUINOSGYWGNN-GXTWGEPZSA-N 1 3 329.485 2.608 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)C[C@H](C)NC(=O)c1sccc1CN(C)C ZINC001401755933 1363090372 /nfs/dbraw/zinc/09/03/72/1363090372.db2.gz KTMUINOSGYWGNN-GXTWGEPZSA-N 1 3 329.485 2.608 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CCN1CC1CC2(CCC2)C1)[NH+]1CCCC1 ZINC001392853419 1356377858 /nfs/dbraw/zinc/37/78/58/1356377858.db2.gz IGVNWGGDPUFPIU-KRWDZBQOSA-N 1 3 333.520 2.632 10 0 EFAEHO C[C@@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)C1(C[NH+](C)C)CC1 ZINC001401778397 1363115348 /nfs/dbraw/zinc/11/53/48/1363115348.db2.gz DRJOLLXZPLKNTK-INIZCTEOSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@H+](C)Cc1ccc(Cl)cc1)N(C)C ZINC001401803423 1363151555 /nfs/dbraw/zinc/15/15/55/1363151555.db2.gz PLJULOOIAAZEQO-CZUORRHYSA-N 1 3 325.884 2.617 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@@H+](C)Cc1ccc(Cl)cc1)N(C)C ZINC001401803423 1363151557 /nfs/dbraw/zinc/15/15/57/1363151557.db2.gz PLJULOOIAAZEQO-CZUORRHYSA-N 1 3 325.884 2.617 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001392942147 1356451854 /nfs/dbraw/zinc/45/18/54/1356451854.db2.gz ZUPJUTWJESSBMJ-QZTJIDSGSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001392942147 1356451856 /nfs/dbraw/zinc/45/18/56/1356451856.db2.gz ZUPJUTWJESSBMJ-QZTJIDSGSA-N 1 3 345.462 2.581 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N(C)CCNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001492816915 1356479655 /nfs/dbraw/zinc/47/96/55/1356479655.db2.gz MPCWNSIYOXQSTE-CRAIPNDOSA-N 1 3 335.467 2.667 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N(C)CCNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001492816915 1356479656 /nfs/dbraw/zinc/47/96/56/1356479656.db2.gz MPCWNSIYOXQSTE-CRAIPNDOSA-N 1 3 335.467 2.667 10 0 EFAEHO CC[C@H](C(=O)N1CCC([N@H+](CC[C@H](C)F)CC2CC2)CC1)N(C)C ZINC001392976392 1356483566 /nfs/dbraw/zinc/48/35/66/1356483566.db2.gz VBEWQBMWJNUQNC-MAUKXSAKSA-N 1 3 341.515 2.778 10 0 EFAEHO CC[C@H](C(=O)N1CCC([N@@H+](CC[C@H](C)F)CC2CC2)CC1)N(C)C ZINC001392976392 1356483570 /nfs/dbraw/zinc/48/35/70/1356483570.db2.gz VBEWQBMWJNUQNC-MAUKXSAKSA-N 1 3 341.515 2.778 10 0 EFAEHO CC[C@@H](C(=O)NC1(C)CC[NH+]([C@H]2CCc3ccccc32)CC1)N(C)C ZINC001393070444 1356558125 /nfs/dbraw/zinc/55/81/25/1356558125.db2.gz LGFCSRCPJXYXJD-OALUTQOASA-N 1 3 343.515 2.985 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C[NH2+]CC1CCCC1)C1CCCC1 ZINC001393082675 1356574689 /nfs/dbraw/zinc/57/46/89/1356574689.db2.gz IIJOIDMTHGGRKT-GOSISDBHSA-N 1 3 332.492 2.715 10 0 EFAEHO CC(C)C[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C[C@H]2C1 ZINC001394352784 1357726435 /nfs/dbraw/zinc/72/64/35/1357726435.db2.gz UZMKSBGGSQILEV-OKZBNKHCSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C[C@H]2C1 ZINC001394352784 1357726438 /nfs/dbraw/zinc/72/64/38/1357726438.db2.gz UZMKSBGGSQILEV-OKZBNKHCSA-N 1 3 337.552 2.837 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H](C)[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001393385326 1356805217 /nfs/dbraw/zinc/80/52/17/1356805217.db2.gz GKCYIUJFVVCDHY-SJLPKXTDSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001393403374 1356821951 /nfs/dbraw/zinc/82/19/51/1356821951.db2.gz ZBJOSPFNMVTRKF-AEFFLSMTSA-N 1 3 349.494 2.658 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@H](C[NH2+]CC2CCCC2)CC1 ZINC001393405081 1356823536 /nfs/dbraw/zinc/82/35/36/1356823536.db2.gz SLBFUTYITYCPAA-IYARVYRRSA-N 1 3 346.519 2.963 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@H]2CN(C(=O)CN3[C@@H](C)CC[C@@H]3C)C[C@H]2C1 ZINC001393419029 1356833111 /nfs/dbraw/zinc/83/31/11/1356833111.db2.gz RHTIMELYKZHUNL-CADBVGFASA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@H]2CN(C(=O)CN3[C@@H](C)CC[C@@H]3C)C[C@H]2C1 ZINC001393419029 1356833114 /nfs/dbraw/zinc/83/31/14/1356833114.db2.gz RHTIMELYKZHUNL-CADBVGFASA-N 1 3 335.536 2.686 10 0 EFAEHO Cc1cc(F)ccc1CN1CC[C@@H]2[C@H]1CCCN2C(=O)CC[NH+](C)C ZINC001393460820 1356861812 /nfs/dbraw/zinc/86/18/12/1356861812.db2.gz JTFOCSOWIVKSBC-RTBURBONSA-N 1 3 347.478 2.651 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+]CC2CC(C)(C)C2)CCC1 ZINC001393540598 1356932303 /nfs/dbraw/zinc/93/23/03/1356932303.db2.gz IALUFACCXGXBCQ-QGZVFWFLSA-N 1 3 335.536 2.924 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)CCCN(C)C(=O)Cc2c[nH]cn2)c1 ZINC001393635044 1357031604 /nfs/dbraw/zinc/03/16/04/1357031604.db2.gz VYCVQOGIAWIOEW-OAHLLOKOSA-N 1 3 344.459 2.502 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)CCCN(C)C(=O)Cc2c[nH]cn2)c1 ZINC001393635044 1357031609 /nfs/dbraw/zinc/03/16/09/1357031609.db2.gz VYCVQOGIAWIOEW-OAHLLOKOSA-N 1 3 344.459 2.502 10 0 EFAEHO CCC[NH2+]C1(CC)CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001393678571 1357071996 /nfs/dbraw/zinc/07/19/96/1357071996.db2.gz BKXLFCGKCKAGIA-LJQANCHMSA-N 1 3 341.515 2.970 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2cccc(OC)c2)C1)N(C)C ZINC001394397798 1357771918 /nfs/dbraw/zinc/77/19/18/1357771918.db2.gz ZANBJKLMLKJYOS-MRHSLFKSSA-N 1 3 347.503 2.581 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)[C@@H](C(C)C)[NH+](C)C)c1 ZINC001394522247 1357905614 /nfs/dbraw/zinc/90/56/14/1357905614.db2.gz SIPBFIQXTGZLIA-CRAIPNDOSA-N 1 3 337.483 2.657 10 0 EFAEHO C[C@H](CN(C)C(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(Cl)s1 ZINC001394530734 1357916254 /nfs/dbraw/zinc/91/62/54/1357916254.db2.gz UAUAZHVRJRXKIG-QWHCGFSZSA-N 1 3 343.924 2.680 10 0 EFAEHO Cc1ccc(CN[C@H](C)CN(C)C(=O)C23CC[NH+](CC2)C3)c(Cl)c1 ZINC001394533815 1357919328 /nfs/dbraw/zinc/91/93/28/1357919328.db2.gz BLTBKJBAXCNQNV-OAHLLOKOSA-N 1 3 349.906 2.681 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H]2CCN(C(=O)C3(C[NH+](C)C)CC3)[C@H]2C)c1 ZINC001394666033 1357984971 /nfs/dbraw/zinc/98/49/71/1357984971.db2.gz FEOFPBJDRDDLIG-MAUKXSAKSA-N 1 3 347.478 2.555 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc3cc[nH]c3c2)C[C@H]1C ZINC001394689525 1358013025 /nfs/dbraw/zinc/01/30/25/1358013025.db2.gz YBCDDCQEIFMCLV-QAPCUYQASA-N 1 3 342.487 2.587 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[C@H](Cc1ccccc1)[NH2+]C(C)C ZINC001394694200 1358018400 /nfs/dbraw/zinc/01/84/00/1358018400.db2.gz DRJVLSJMVLKHHC-UXHICEINSA-N 1 3 345.531 2.976 10 0 EFAEHO CC[C@H](F)CN[C@@H]1CN(C(=O)C2CC[NH+](C(C)C)CC2)CC1(C)C ZINC001394716692 1358044202 /nfs/dbraw/zinc/04/42/02/1358044202.db2.gz XTCZGNGXJDSQOB-DLBZAZTESA-N 1 3 341.515 2.682 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)CCN(C(=O)[C@@H]1CCCN1C)C(C)C ZINC001394800781 1358084743 /nfs/dbraw/zinc/08/47/43/1358084743.db2.gz GSWVMWXVZXSPAZ-ROUUACIJSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)CCN(C(=O)[C@@H]1CCCN1C)C(C)C ZINC001394800781 1358084746 /nfs/dbraw/zinc/08/47/46/1358084746.db2.gz GSWVMWXVZXSPAZ-ROUUACIJSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]Cc1ccccc1F)C(C)(C)C ZINC001394825666 1358124311 /nfs/dbraw/zinc/12/43/11/1358124311.db2.gz IGGPLGKMMPEUBU-QGZVFWFLSA-N 1 3 337.483 2.786 10 0 EFAEHO CC(C)(C)[C@H](CNC/C(Cl)=C/Cl)NC(=O)C[NH+]1CCCC1 ZINC001394831390 1358131645 /nfs/dbraw/zinc/13/16/45/1358131645.db2.gz XELPQHOXFDSAKQ-FSBNRTBOSA-N 1 3 336.307 2.522 10 0 EFAEHO CC(C)(C)[C@H](C[NH2+]C/C(Cl)=C/Cl)NC(=O)CN1CCCC1 ZINC001394831390 1358131650 /nfs/dbraw/zinc/13/16/50/1358131650.db2.gz XELPQHOXFDSAKQ-FSBNRTBOSA-N 1 3 336.307 2.522 10 0 EFAEHO C[C@H](NC1CC(N(C)C(=O)CC[NH+](C)C)C1)c1ccc(F)cc1F ZINC001394856439 1358162588 /nfs/dbraw/zinc/16/25/88/1358162588.db2.gz AFHHCPBNMJDKJG-GRTSSRMGSA-N 1 3 339.430 2.557 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CC([NH2+][C@H]2CCc3ccccc32)C1 ZINC001394857293 1358163655 /nfs/dbraw/zinc/16/36/55/1358163655.db2.gz NQSNVFUQAHXVFM-TVPLGVNVSA-N 1 3 329.488 2.595 10 0 EFAEHO C[C@@H](F)CCN1CC[C@H]1CN(C)C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001397001291 1359606015 /nfs/dbraw/zinc/60/60/15/1359606015.db2.gz UYVPNOXYBLUNID-SJORKVTESA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)NCc1ccccc1Cl ZINC001437137270 1387410830 /nfs/dbraw/zinc/41/08/30/1387410830.db2.gz ZAOWZXMJNCILMF-RHSMWYFYSA-N 1 3 337.895 2.807 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NC[C@@H](C)NCc1ccccc1Cl ZINC001437137270 1387410834 /nfs/dbraw/zinc/41/08/34/1387410834.db2.gz ZAOWZXMJNCILMF-RHSMWYFYSA-N 1 3 337.895 2.807 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CC[C@@H]([NH2+]Cc3ccccc3F)C2)C1 ZINC001397168819 1359720595 /nfs/dbraw/zinc/72/05/95/1359720595.db2.gz LDOQIDWCHNVJCL-XYJFISCASA-N 1 3 347.478 2.542 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001437142114 1387417309 /nfs/dbraw/zinc/41/73/09/1387417309.db2.gz CJWGTAUKZDEREA-ACJLOTCBSA-N 1 3 349.906 2.906 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CCC[N@@H+]1C1CCCC1)NCc1ccsc1 ZINC001437149576 1387422545 /nfs/dbraw/zinc/42/25/45/1387422545.db2.gz SCCPOVXMGHPWKJ-RHSMWYFYSA-N 1 3 335.517 2.749 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CCC[N@H+]1C1CCCC1)NCc1ccsc1 ZINC001437149576 1387422547 /nfs/dbraw/zinc/42/25/47/1387422547.db2.gz SCCPOVXMGHPWKJ-RHSMWYFYSA-N 1 3 335.517 2.749 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccccc1CC ZINC001437158729 1387428037 /nfs/dbraw/zinc/42/80/37/1387428037.db2.gz UJWORTKRNHCDHM-VQIMIIECSA-N 1 3 331.504 2.718 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+]Cc2sccc2Cl)C1 ZINC001397609977 1360000001 /nfs/dbraw/zinc/00/00/01/1360000001.db2.gz DBLOEXWZCHVKOQ-BETUJISGSA-N 1 3 343.924 2.726 10 0 EFAEHO C[C@H](N[C@H]1C[C@H](CNC(=O)CC[NH+](C)C)C1)c1ccccc1Cl ZINC001397669393 1360037913 /nfs/dbraw/zinc/03/79/13/1360037913.db2.gz DUWBRJSWEKVULD-KKUMJFAQSA-N 1 3 337.895 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCCC[C@H]([NH2+]CCC(F)(F)F)C1 ZINC001397777200 1360127174 /nfs/dbraw/zinc/12/71/74/1360127174.db2.gz SQUMENSBMCAXBY-AWEZNQCLSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCCC[C@@H]([NH2+]CCC(F)(F)F)C1 ZINC001397777204 1360127255 /nfs/dbraw/zinc/12/72/55/1360127255.db2.gz SQUMENSBMCAXBY-CQSZACIVSA-N 1 3 337.430 2.640 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+][C@H]1CCc2c1cccc2F ZINC001437187916 1387449485 /nfs/dbraw/zinc/44/94/85/1387449485.db2.gz NPSSUHFUOQGQSW-KSSFIOAISA-N 1 3 347.478 2.782 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+][C@@H]1CCc2c1cccc2F ZINC001437187913 1387450022 /nfs/dbraw/zinc/45/00/22/1387450022.db2.gz NPSSUHFUOQGQSW-KBXCAEBGSA-N 1 3 347.478 2.782 10 0 EFAEHO COc1cccc([C@@H](C)N2CCC(N(C)C(=O)CC[NH+](C)C)CC2)c1 ZINC001398191095 1360367333 /nfs/dbraw/zinc/36/73/33/1360367333.db2.gz PBFAXCRNPRJYMV-MRXNPFEDSA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@H](C)N2CCC(N(C)C(=O)CC[NH+](C)C)CC2)c1 ZINC001398191062 1360367451 /nfs/dbraw/zinc/36/74/51/1360367451.db2.gz PBFAXCRNPRJYMV-INIZCTEOSA-N 1 3 347.503 2.631 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCCN([C@@H]2CCCc3ccc(F)cc32)C1 ZINC001398225941 1360396427 /nfs/dbraw/zinc/39/64/27/1360396427.db2.gz FFRKFVQIDGELNJ-PKOBYXMFSA-N 1 3 347.478 2.735 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001398231384 1360400380 /nfs/dbraw/zinc/40/03/80/1360400380.db2.gz NKIGTPPDBRHWRZ-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001398231384 1360400383 /nfs/dbraw/zinc/40/03/83/1360400383.db2.gz NKIGTPPDBRHWRZ-MSOLQXFVSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@@H](F)CCN1CCC[C@H](NC(=O)C2(C[NH+](C)C)CCCCC2)C1 ZINC001398235178 1360403879 /nfs/dbraw/zinc/40/38/79/1360403879.db2.gz PXJQBSSFAUQGBZ-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CCCN(C(=O)CN1CC[C@H](C)C1)C1CC[NH+](CC[C@H](C)F)CC1 ZINC001398369411 1360490729 /nfs/dbraw/zinc/49/07/29/1360490729.db2.gz RQQSQVLMOPUEFT-IRXDYDNUSA-N 1 3 341.515 2.779 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@H]1C[C@H](NCc2ccccc2Cl)C1 ZINC001398533368 1360630525 /nfs/dbraw/zinc/63/05/25/1360630525.db2.gz CPNWQFHKOJUOAX-ULQDDVLXSA-N 1 3 349.906 2.951 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@H]1C[C@H](NCc2ccccc2Cl)C1 ZINC001398533368 1360630528 /nfs/dbraw/zinc/63/05/28/1360630528.db2.gz CPNWQFHKOJUOAX-ULQDDVLXSA-N 1 3 349.906 2.951 10 0 EFAEHO CN(CCNC(=O)CC[NH+]1CCCCC1)Cc1ccc(C2CC2)cc1 ZINC001492873627 1360632464 /nfs/dbraw/zinc/63/24/64/1360632464.db2.gz NLTNCJZGUXTETM-UHFFFAOYSA-N 1 3 343.515 2.988 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]([NH2+]Cc2ccc(C(C)C)cc2)C1 ZINC001398568865 1360649895 /nfs/dbraw/zinc/64/98/95/1360649895.db2.gz TZZFFPMTXZOOJE-WGSAOQKQSA-N 1 3 331.504 2.889 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1C)N(C)C ZINC001398585025 1360657897 /nfs/dbraw/zinc/65/78/97/1360657897.db2.gz XGZGWAUBVONEEG-RAFMOHDBSA-N 1 3 343.515 2.947 10 0 EFAEHO CC[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1C)N(C)C ZINC001398585025 1360657899 /nfs/dbraw/zinc/65/78/99/1360657899.db2.gz XGZGWAUBVONEEG-RAFMOHDBSA-N 1 3 343.515 2.947 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C\Cl ZINC001398589113 1360660053 /nfs/dbraw/zinc/66/00/53/1360660053.db2.gz ILIGACPAAOBHRB-AHYLRCEUSA-N 1 3 339.911 2.725 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C\Cl ZINC001398589113 1360660056 /nfs/dbraw/zinc/66/00/56/1360660056.db2.gz ILIGACPAAOBHRB-AHYLRCEUSA-N 1 3 339.911 2.725 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc3c(c2)CCC3)C1)N(C)C ZINC001398619132 1360673495 /nfs/dbraw/zinc/67/34/95/1360673495.db2.gz DGNLPOMQWQJRMK-FCDRMGDPSA-N 1 3 343.515 2.813 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+][C@H]2C[C@@H](NC(=O)CN(C)C3CCC3)C2)c1 ZINC001398619856 1360674454 /nfs/dbraw/zinc/67/44/54/1360674454.db2.gz KSDUMRBDPWNHPK-NXHRZFHOSA-N 1 3 329.488 2.777 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2F)C1)N(C)C ZINC001398630152 1360679399 /nfs/dbraw/zinc/67/93/99/1360679399.db2.gz WHIGWBCDSXVMBT-LZWOXQAQSA-N 1 3 341.858 2.556 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(F)cc32)C1)N(C)C ZINC001398630042 1360679620 /nfs/dbraw/zinc/67/96/20/1360679620.db2.gz SULNSTTZDHTCGW-OGWHTMIXSA-N 1 3 347.478 2.636 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H]1C[C@@H]([NH2+]C/C=C\c2ccccc2)C1 ZINC001398664192 1360696357 /nfs/dbraw/zinc/69/63/57/1360696357.db2.gz IGOPDNCDKXAKAS-UBWPAXIJSA-N 1 3 341.499 2.811 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCCN(Cc2ccsc2)C1 ZINC001398685705 1360715532 /nfs/dbraw/zinc/71/55/32/1360715532.db2.gz FTHWCDSDFPBIDN-FUHWJXTLSA-N 1 3 349.544 2.951 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCCN(Cc2ccsc2)C1 ZINC001398685705 1360715536 /nfs/dbraw/zinc/71/55/36/1360715536.db2.gz FTHWCDSDFPBIDN-FUHWJXTLSA-N 1 3 349.544 2.951 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](Cc2ccc(C)cc2C)C1)N(C)C ZINC001398693830 1360722363 /nfs/dbraw/zinc/72/23/63/1360722363.db2.gz KHAMCJJLOVEDFG-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccc(C)cc2C)C1)N(C)C ZINC001398693830 1360722367 /nfs/dbraw/zinc/72/23/67/1360722367.db2.gz KHAMCJJLOVEDFG-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)C[NH2+]C[C@@H]1CCCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001398738683 1360754101 /nfs/dbraw/zinc/75/41/01/1360754101.db2.gz KHKMMFROBKYEEJ-QFBILLFUSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)C[NH2+]C[C@H]1CCCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001398738672 1360754403 /nfs/dbraw/zinc/75/44/03/1360754403.db2.gz KHKMMFROBKYEEJ-APWZRJJASA-N 1 3 341.515 2.683 10 0 EFAEHO CCc1cccc(CN2CCCC[C@@H]2CNC(=O)CC[NH+](C)C)c1 ZINC001398762855 1360770064 /nfs/dbraw/zinc/77/00/64/1360770064.db2.gz UTMZVSKYDUPFBI-LJQANCHMSA-N 1 3 331.504 2.671 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1CCCC[N@@H+]1CCCF)N1CCCCCC1 ZINC001398770414 1360776279 /nfs/dbraw/zinc/77/62/79/1360776279.db2.gz ZAAWPNKJZRURLH-IRXDYDNUSA-N 1 3 327.488 2.581 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1CCCC[N@H+]1CCCF)N1CCCCCC1 ZINC001398770414 1360776282 /nfs/dbraw/zinc/77/62/82/1360776282.db2.gz ZAAWPNKJZRURLH-IRXDYDNUSA-N 1 3 327.488 2.581 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H]1CCC[N@H+](CC2CCCC2)C1 ZINC001398792177 1360795627 /nfs/dbraw/zinc/79/56/27/1360795627.db2.gz LZFGFNNTBBJEQP-PBHICJAKSA-N 1 3 332.492 2.668 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H]1CCC[N@@H+](CC2CCCC2)C1 ZINC001398792177 1360795630 /nfs/dbraw/zinc/79/56/30/1360795630.db2.gz LZFGFNNTBBJEQP-PBHICJAKSA-N 1 3 332.492 2.668 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cc2ccccc2s1 ZINC001437214790 1387475604 /nfs/dbraw/zinc/47/56/04/1387475604.db2.gz XTUQVQZIYBYRGW-CABCVRRESA-N 1 3 345.512 2.837 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001398931610 1360879601 /nfs/dbraw/zinc/87/96/01/1360879601.db2.gz XZDNKIWXAYMBJF-MJGOQNOKSA-N 1 3 331.504 2.505 10 0 EFAEHO C[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]CCc1cccs1 ZINC001437217617 1387477806 /nfs/dbraw/zinc/47/78/06/1387477806.db2.gz VJMZXNKEKCFPIV-HOTGVXAUSA-N 1 3 337.533 2.649 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+][C@@H](C)c1ccc(F)c(Cl)c1 ZINC001399177217 1361049792 /nfs/dbraw/zinc/04/97/92/1361049792.db2.gz WCAFLOSFNKZYHL-STQMWFEESA-N 1 3 343.874 2.975 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+][C@H](C)c1ccc(F)c(Cl)c1 ZINC001399177214 1361049960 /nfs/dbraw/zinc/04/99/60/1361049960.db2.gz WCAFLOSFNKZYHL-QWHCGFSZSA-N 1 3 343.874 2.975 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001399244725 1361094830 /nfs/dbraw/zinc/09/48/30/1361094830.db2.gz HUAPNJNWKMGZJT-GOSISDBHSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2CCC[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001399284817 1361126618 /nfs/dbraw/zinc/12/66/18/1361126618.db2.gz WHBFDILOTMDIQP-OALUTQOASA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001399404401 1361199907 /nfs/dbraw/zinc/19/99/07/1361199907.db2.gz WXFCQUOSYBLDHN-SJLPKXTDSA-N 1 3 331.504 2.630 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+]C[C@H]1CCc2ccccc2C1 ZINC001399437819 1361225094 /nfs/dbraw/zinc/22/50/94/1361225094.db2.gz WBQBONDMDTXFJY-MSOLQXFVSA-N 1 3 345.531 2.616 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001399655685 1361408063 /nfs/dbraw/zinc/40/80/63/1361408063.db2.gz MZWWQUZTVCJOFN-MOPGFXCFSA-N 1 3 329.488 2.596 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCC[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001399655685 1361408066 /nfs/dbraw/zinc/40/80/66/1361408066.db2.gz MZWWQUZTVCJOFN-MOPGFXCFSA-N 1 3 329.488 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]CC[C@H]1CCc2ccccc21 ZINC001437262325 1387515356 /nfs/dbraw/zinc/51/53/56/1387515356.db2.gz OCDHHLZJGGQEJT-FUHWJXTLSA-N 1 3 331.504 2.541 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NC[C@H]1CCN(Cc2ccsc2)C1 ZINC001399933644 1361590638 /nfs/dbraw/zinc/59/06/38/1361590638.db2.gz QXWYQNFTCDMIGJ-MRXNPFEDSA-N 1 3 335.517 2.562 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[N@H+](Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001399957548 1361611628 /nfs/dbraw/zinc/61/16/28/1361611628.db2.gz WBKKXSFXWQWWRP-XLIONFOSSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[N@@H+](Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001399957548 1361611633 /nfs/dbraw/zinc/61/16/33/1361611633.db2.gz WBKKXSFXWQWWRP-XLIONFOSSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[N@H+](C1CC1)[C@@H]1CCc2ccccc21)N(C)C ZINC001400038583 1361689516 /nfs/dbraw/zinc/68/95/16/1361689516.db2.gz JNHFLNMRCFLXRR-WOJBJXKFSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21)N(C)C ZINC001400038583 1361689518 /nfs/dbraw/zinc/68/95/18/1361689518.db2.gz JNHFLNMRCFLXRR-WOJBJXKFSA-N 1 3 343.515 2.841 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@H](C)C1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001400076795 1361716889 /nfs/dbraw/zinc/71/68/89/1361716889.db2.gz CWVMQYSMNWDVLW-SJLPKXTDSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@@H](CCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001400184091 1361825064 /nfs/dbraw/zinc/82/50/64/1361825064.db2.gz MILLELYOMYCBLQ-QGZVFWFLSA-N 1 3 325.541 2.839 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@@H](CCNC(=O)CN(C)CC(C)(C)C)C1 ZINC001400184091 1361825066 /nfs/dbraw/zinc/82/50/66/1361825066.db2.gz MILLELYOMYCBLQ-QGZVFWFLSA-N 1 3 325.541 2.839 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[N@H+](C)Cc2cc(C)ccc2F)C1 ZINC001400233040 1361868606 /nfs/dbraw/zinc/86/86/06/1361868606.db2.gz SDDOMRVYYDIUMA-QGZVFWFLSA-N 1 3 349.494 2.756 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[N@@H+](C)Cc2cc(C)ccc2F)C1 ZINC001400233040 1361868611 /nfs/dbraw/zinc/86/86/11/1361868611.db2.gz SDDOMRVYYDIUMA-QGZVFWFLSA-N 1 3 349.494 2.756 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001400237259 1361872926 /nfs/dbraw/zinc/87/29/26/1361872926.db2.gz CSWFVOMBBMCHDH-QGZVFWFLSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)CC1CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001400237259 1361872930 /nfs/dbraw/zinc/87/29/30/1361872930.db2.gz CSWFVOMBBMCHDH-QGZVFWFLSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@H](C(=O)N1CC[C@@H](CN(C)C/C=C\Cl)C1)[NH+]1CCCCCC1 ZINC001400237258 1361873267 /nfs/dbraw/zinc/87/32/67/1361873267.db2.gz ZTZSOYYZOMIKDS-KVPVBUAESA-N 1 3 341.927 2.784 10 0 EFAEHO CC(C)c1ccc(CN2CCC[C@H](NC(=O)CC[NH+](C)C)C2)cc1 ZINC001400299674 1361917831 /nfs/dbraw/zinc/91/78/31/1361917831.db2.gz YLNISIHVOTXOLN-IBGZPJMESA-N 1 3 331.504 2.842 10 0 EFAEHO C[C@H](c1ccccc1)N1CC(CNC(=O)C(C)(C)[NH+]2CCCC2)C1 ZINC001400514140 1362006069 /nfs/dbraw/zinc/00/60/69/1362006069.db2.gz CDMRYKMNRNROOO-MRXNPFEDSA-N 1 3 329.488 2.670 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1C[NH+](Cc2cccc3ccccc32)C1 ZINC001400566691 1362027872 /nfs/dbraw/zinc/02/78/72/1362027872.db2.gz ARJQWYLJRNNQBH-UHFFFAOYSA-N 1 3 339.483 2.728 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1C[NH+](CCCC2CCCC2)C1 ZINC001400570298 1362028803 /nfs/dbraw/zinc/02/88/03/1362028803.db2.gz IWNKKSRAPFQDMX-CALCHBBNSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN(C(=O)C[C@H]1CC[N@H+](C)C1)[C@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001400756455 1362144614 /nfs/dbraw/zinc/14/46/14/1362144614.db2.gz BKSFZJQYBWDVNL-UXHICEINSA-N 1 3 343.515 2.760 10 0 EFAEHO CCN(C(=O)C[C@H]1CC[N@@H+](C)C1)[C@H]1CCN(Cc2ccc(C)cc2)C1 ZINC001400756455 1362144618 /nfs/dbraw/zinc/14/46/18/1362144618.db2.gz BKSFZJQYBWDVNL-UXHICEINSA-N 1 3 343.515 2.760 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccc(C)cc1 ZINC001400799559 1362171225 /nfs/dbraw/zinc/17/12/25/1362171225.db2.gz HSELBXMHAXSQNU-RTBURBONSA-N 1 3 331.504 2.852 10 0 EFAEHO CCC[N@@H+]1CCC[C@H](C(=O)NC[C@@H](CC)NCc2ccccc2F)C1 ZINC001400881144 1362231819 /nfs/dbraw/zinc/23/18/19/1362231819.db2.gz ZEVXJJNPYHFEGL-ZWKOTPCHSA-N 1 3 349.494 2.932 10 0 EFAEHO CCC[N@H+]1CCC[C@H](C(=O)NC[C@@H](CC)NCc2ccccc2F)C1 ZINC001400881144 1362231821 /nfs/dbraw/zinc/23/18/21/1362231821.db2.gz ZEVXJJNPYHFEGL-ZWKOTPCHSA-N 1 3 349.494 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CCCC1 ZINC001400969417 1362307923 /nfs/dbraw/zinc/30/79/23/1362307923.db2.gz JRQBNLTYTAQJRL-FGTMMUONSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H]([NH2+]Cc2ccc(F)cc2)CC1 ZINC001401066192 1362406377 /nfs/dbraw/zinc/40/63/77/1362406377.db2.gz GKPNATSYSXYDIT-IYARVYRRSA-N 1 3 335.467 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(CC[N@H+](CC3CC(C)C3)C2)CC1 ZINC001401092856 1362435221 /nfs/dbraw/zinc/43/52/21/1362435221.db2.gz YKQNEBCVBVSMJG-UHFFFAOYSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(CC[N@@H+](CC3CC(C)C3)C2)CC1 ZINC001401092856 1362435224 /nfs/dbraw/zinc/43/52/24/1362435224.db2.gz YKQNEBCVBVSMJG-UHFFFAOYSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+]Cc1cccc(Cl)c1F ZINC001401155056 1362490578 /nfs/dbraw/zinc/49/05/78/1362490578.db2.gz QBUSPJVAZHVJGJ-CYBMUJFWSA-N 1 3 343.874 2.661 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+]Cc1cccc(Cl)c1F ZINC001401155057 1362490640 /nfs/dbraw/zinc/49/06/40/1362490640.db2.gz QBUSPJVAZHVJGJ-ZDUSSCGKSA-N 1 3 343.874 2.661 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]CC1CCC(C)(C)CC1)N(C)C ZINC001401229869 1362568825 /nfs/dbraw/zinc/56/88/25/1362568825.db2.gz LAEJYMRTCAZFOJ-NVXWUHKLSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]Cc1cccc(F)c1)NC(=O)CN1CC[C@H](C)C1 ZINC001401269759 1362611563 /nfs/dbraw/zinc/61/15/63/1362611563.db2.gz CBEBIMXBAJOZDY-LPHOPBHVSA-N 1 3 349.494 2.788 10 0 EFAEHO CC[C@@H](F)CNC[C@@H](CC(C)C)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001401283334 1362629763 /nfs/dbraw/zinc/62/97/63/1362629763.db2.gz LAZMJLHXMJUHES-IAGOWNOFSA-N 1 3 341.515 2.731 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)CCC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001401311275 1362659849 /nfs/dbraw/zinc/65/98/49/1362659849.db2.gz WGGNOABFWJBSIP-QGZVFWFLSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)CCC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001401311275 1362659851 /nfs/dbraw/zinc/65/98/51/1362659851.db2.gz WGGNOABFWJBSIP-QGZVFWFLSA-N 1 3 329.504 2.635 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]CCC(F)(F)F)C(C)C ZINC001401337384 1362683541 /nfs/dbraw/zinc/68/35/41/1362683541.db2.gz UYBIOCUZYVCLHD-KBPBESRZSA-N 1 3 337.430 2.544 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC1CC1 ZINC001401339637 1362687203 /nfs/dbraw/zinc/68/72/03/1362687203.db2.gz BYJWPNOWYZLRAW-QFBILLFUSA-N 1 3 341.515 2.729 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NCc1ccccc1Cl ZINC001401355778 1362705851 /nfs/dbraw/zinc/70/58/51/1362705851.db2.gz VPGXWUCENSXGDG-NVXWUHKLSA-N 1 3 337.895 2.522 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NCc1ccccc1Cl ZINC001401355778 1362705855 /nfs/dbraw/zinc/70/58/55/1362705855.db2.gz VPGXWUCENSXGDG-NVXWUHKLSA-N 1 3 337.895 2.522 10 0 EFAEHO COc1cccc([C@@H](C)[N@H+](C)CCN(C)C(=O)CN(C)C2CCC2)c1 ZINC001401370177 1362720905 /nfs/dbraw/zinc/72/09/05/1362720905.db2.gz RLEONNRYNXLTSM-MRXNPFEDSA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@@H](C)[N@@H+](C)CCN(C)C(=O)CN(C)C2CCC2)c1 ZINC001401370177 1362720907 /nfs/dbraw/zinc/72/09/07/1362720907.db2.gz RLEONNRYNXLTSM-MRXNPFEDSA-N 1 3 347.503 2.631 10 0 EFAEHO CN(CCN(C)[C@@H]1CCc2c1cccc2Cl)C(=O)CC[NH+](C)C ZINC001401388436 1362742648 /nfs/dbraw/zinc/74/26/48/1362742648.db2.gz OOLOOEOOFHMIMW-QGZVFWFLSA-N 1 3 337.895 2.669 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(C)CCN(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001401437771 1362806278 /nfs/dbraw/zinc/80/62/78/1362806278.db2.gz HKPLHURAOGMXKW-HOTGVXAUSA-N 1 3 335.467 2.619 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(C)CCN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001401437771 1362806283 /nfs/dbraw/zinc/80/62/83/1362806283.db2.gz HKPLHURAOGMXKW-HOTGVXAUSA-N 1 3 335.467 2.619 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2Cl)C1 ZINC001401493356 1362885200 /nfs/dbraw/zinc/88/52/00/1362885200.db2.gz ODKGPXNTFHXARX-FUHWJXTLSA-N 1 3 349.906 2.715 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCCc2ccccc21)C(=O)CN1CCCC1 ZINC001401607825 1362968452 /nfs/dbraw/zinc/96/84/52/1362968452.db2.gz HTOSELRAZCYGBA-LJQANCHMSA-N 1 3 329.488 2.598 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+][C@@H](C)c1ccc(Cl)cc1)N(C)C ZINC001401634746 1362986847 /nfs/dbraw/zinc/98/68/47/1362986847.db2.gz WNYRHWNHXCFLBF-DVOMOZLQSA-N 1 3 325.884 2.836 10 0 EFAEHO Cc1ccc(CNC[C@@H](C)NC(=O)C2(C[NH+](C)C)CC2)c(Cl)c1 ZINC001401635674 1362987737 /nfs/dbraw/zinc/98/77/37/1362987737.db2.gz AOKBXSFOZIQBBY-CQSZACIVSA-N 1 3 337.895 2.585 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)[C@H]2CCC[N@@H+]2C(C)C)cc1F ZINC001401748336 1363081674 /nfs/dbraw/zinc/08/16/74/1363081674.db2.gz DQCXCQKTCNQKLM-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1ccc(CN(C)C[C@H](C)NC(=O)[C@H]2CCC[N@H+]2C(C)C)cc1F ZINC001401748336 1363081678 /nfs/dbraw/zinc/08/16/78/1363081678.db2.gz DQCXCQKTCNQKLM-QFBILLFUSA-N 1 3 349.494 2.943 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(F)c1 ZINC001401752710 1363085803 /nfs/dbraw/zinc/08/58/03/1363085803.db2.gz HZWDICWIUPJRQR-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(F)c1 ZINC001401752710 1363085807 /nfs/dbraw/zinc/08/58/07/1363085807.db2.gz HZWDICWIUPJRQR-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO Cc1ccc(CN(C)C[C@@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)cc1F ZINC001401774987 1363113413 /nfs/dbraw/zinc/11/34/13/1363113413.db2.gz HRQQTPVEQBDBDD-MRXNPFEDSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@@H](C)NC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001401785125 1363125875 /nfs/dbraw/zinc/12/58/75/1363125875.db2.gz RJPXIBMNUJGAON-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)cc1CN(C)C[C@@H](C)NC(=O)CC[C@H]1CCC[N@H+]1C ZINC001401785125 1363125880 /nfs/dbraw/zinc/12/58/80/1363125880.db2.gz RJPXIBMNUJGAON-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1C1CC1)NC(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001401809025 1363159552 /nfs/dbraw/zinc/15/95/52/1363159552.db2.gz XCLXAEFVRLADEZ-SJORKVTESA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1C1CC1)NC(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001401809025 1363159554 /nfs/dbraw/zinc/15/95/54/1363159554.db2.gz XCLXAEFVRLADEZ-SJORKVTESA-N 1 3 343.515 2.842 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCCC[C@H]1C[NH2+]Cc1ccsc1 ZINC001401818350 1363166500 /nfs/dbraw/zinc/16/65/00/1363166500.db2.gz IMYPXDDYPQIALH-DLBZAZTESA-N 1 3 337.533 2.855 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C[NH2+][C@H]1CCc2ccc(F)cc21)C1CC1 ZINC001401874703 1363205962 /nfs/dbraw/zinc/20/59/62/1363205962.db2.gz QPEAMKFLFWOATB-OALUTQOASA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@@H]2CCN2CCC2CCCCCC2)C1 ZINC001401933667 1363256715 /nfs/dbraw/zinc/25/67/15/1363256715.db2.gz XJFPSTIXEDMUPJ-MOPGFXCFSA-N 1 3 335.536 2.879 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@@H]2CCN2CCC2CCCCCC2)C1 ZINC001401933667 1363256718 /nfs/dbraw/zinc/25/67/18/1363256718.db2.gz XJFPSTIXEDMUPJ-MOPGFXCFSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1cccc([C@@H](C)[NH2+]C2(CNC(=O)[C@H](C(C)C)N(C)C)CC2)c1 ZINC001401947339 1363266812 /nfs/dbraw/zinc/26/68/12/1363266812.db2.gz OLVVBXCVFUVXIA-AEFFLSMTSA-N 1 3 331.504 2.881 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC2([NH2+]Cc3ccc(C4CC4)cc3)CC2)C1 ZINC001401958164 1363276092 /nfs/dbraw/zinc/27/60/92/1363276092.db2.gz BABZMJBKZRTKQP-MRXNPFEDSA-N 1 3 341.499 2.644 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+]Cc2ccc(C(C)C)cc2)CC1)N(C)C ZINC001401978103 1363294696 /nfs/dbraw/zinc/29/46/96/1363294696.db2.gz VQMFBZIBPSFTDI-SFHVURJKSA-N 1 3 331.504 2.889 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C1(CNC(=O)CN(C)C(C)C)CC1 ZINC001401986985 1363303876 /nfs/dbraw/zinc/30/38/76/1363303876.db2.gz PHANXBFSVBRFCF-UHFFFAOYSA-N 1 3 337.895 2.727 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C1(CNC(=O)CN2[C@@H](C)CC[C@@H]2C)CC1 ZINC001401990088 1363306713 /nfs/dbraw/zinc/30/67/13/1363306713.db2.gz ZLNSGHMDZICAIA-ROUUACIJSA-N 1 3 343.515 2.915 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1[C@H]1CC[N@H+](CC2CCC2)C1 ZINC001401990536 1363307844 /nfs/dbraw/zinc/30/78/44/1363307844.db2.gz UCCANJUPPXWSLV-OALUTQOASA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1[C@H]1CC[N@@H+](CC2CCC2)C1 ZINC001401990536 1363307848 /nfs/dbraw/zinc/30/78/48/1363307848.db2.gz UCCANJUPPXWSLV-OALUTQOASA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1[C@@H]1CC[N@@H+](CC2CCC2)C1 ZINC001401990532 1363308370 /nfs/dbraw/zinc/30/83/70/1363308370.db2.gz UCCANJUPPXWSLV-MOPGFXCFSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@H]1[C@@H]1CC[N@H+](CC2CCC2)C1 ZINC001401990532 1363308368 /nfs/dbraw/zinc/30/83/68/1363308368.db2.gz UCCANJUPPXWSLV-MOPGFXCFSA-N 1 3 335.536 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CC[N@@H+](CC[C@H](C)F)C2)CC1 ZINC001401990988 1363309235 /nfs/dbraw/zinc/30/92/35/1363309235.db2.gz UQYAAHYLNVXGGB-WMZOPIPTSA-N 1 3 341.515 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CC[N@H+](CC[C@H](C)F)C2)CC1 ZINC001401990988 1363309237 /nfs/dbraw/zinc/30/92/37/1363309237.db2.gz UQYAAHYLNVXGGB-WMZOPIPTSA-N 1 3 341.515 2.635 10 0 EFAEHO O=C(CCC[NH+]1CCCCC1)N1C[C@H]2CCC[C@@H](C1)N2CC1CC1 ZINC001402001952 1363320360 /nfs/dbraw/zinc/32/03/60/1363320360.db2.gz TXJHTHRCIOGBGA-KDURUIRLSA-N 1 3 333.520 2.728 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]Cc2cccc(F)c2)C[C@@H]1C ZINC001402063409 1363370633 /nfs/dbraw/zinc/37/06/33/1363370633.db2.gz OZLGHIARVSYXTB-YJBOKZPZSA-N 1 3 335.467 2.635 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)[C@H](C)C1 ZINC001402069608 1363375138 /nfs/dbraw/zinc/37/51/38/1363375138.db2.gz UKGPFGAMZDTKMV-VQIMIIECSA-N 1 3 349.494 2.943 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@H]2CCCN([C@H]3CCc4ccccc43)C2)CC1 ZINC001402086260 1363390775 /nfs/dbraw/zinc/39/07/75/1363390775.db2.gz LETCRCCPEHPOFZ-HKUYNNGSSA-N 1 3 341.499 2.596 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N[C@]2(C)CC[N@H+](CCC3CC3)C2)C1 ZINC001402133888 1363440309 /nfs/dbraw/zinc/44/03/09/1363440309.db2.gz NHSCFKSTNFMAKQ-RTBURBONSA-N 1 3 339.499 2.580 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N[C@]2(C)CC[N@@H+](CCC3CC3)C2)C1 ZINC001402133888 1363440312 /nfs/dbraw/zinc/44/03/12/1363440312.db2.gz NHSCFKSTNFMAKQ-RTBURBONSA-N 1 3 339.499 2.580 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@](C)(C[NH2+]Cc2c(C)cccc2C)C1)N(C)C ZINC001402155081 1363463531 /nfs/dbraw/zinc/46/35/31/1363463531.db2.gz AENHPARRQCJNRP-CTNGQTDRSA-N 1 3 345.531 2.972 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CC[N@H+](Cc2cc(C)ccc2C)C1 ZINC001402162699 1363470648 /nfs/dbraw/zinc/47/06/48/1363470648.db2.gz HQDIMZSIBBOAAQ-RBUKOAKNSA-N 1 3 349.494 2.674 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N[C@H]1CC[N@@H+](Cc2cc(C)ccc2C)C1 ZINC001402162699 1363470655 /nfs/dbraw/zinc/47/06/55/1363470655.db2.gz HQDIMZSIBBOAAQ-RBUKOAKNSA-N 1 3 349.494 2.674 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CCN(CCc2cccs2)C1)[NH+](CC)CC ZINC001402189081 1363495486 /nfs/dbraw/zinc/49/54/86/1363495486.db2.gz VIXLQWNKVKGCAP-WBVHZDCISA-N 1 3 337.533 2.602 10 0 EFAEHO CCCN(C)CC(=O)NCC1(C)CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001402204735 1363516237 /nfs/dbraw/zinc/51/62/37/1363516237.db2.gz VDBJIEFMIVFGGT-UHFFFAOYSA-N 1 3 337.552 2.983 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC12CC[NH+](CC1CC(C)(C)C1)CC2)N(C)C ZINC001402245018 1363565649 /nfs/dbraw/zinc/56/56/49/1363565649.db2.gz GIOIYQZRUABQIK-SJORKVTESA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C(=O)[C@@H](CC)N(C)C)C1CC[NH+](CC[C@@H](C)F)CC1 ZINC001402245485 1363566058 /nfs/dbraw/zinc/56/60/58/1363566058.db2.gz NNJDXAYRPCWNRX-NVXWUHKLSA-N 1 3 329.504 2.778 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1cccc(C)c1)C1CC1 ZINC001402288797 1363588176 /nfs/dbraw/zinc/58/81/76/1363588176.db2.gz GQXYHLZLYHLPEX-WOJBJXKFSA-N 1 3 343.515 2.854 10 0 EFAEHO C[C@H](N[C@H](CNC(=O)CC[NH+](C)C)C1CC1)c1ccccc1Cl ZINC001402331054 1363609481 /nfs/dbraw/zinc/60/94/81/1363609481.db2.gz BIKZTKFNFNQVME-SUMWQHHRSA-N 1 3 337.895 2.837 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]([NH2+]Cc1ccsc1)C1CC1)N1CCCCCC1 ZINC001402342825 1363615726 /nfs/dbraw/zinc/61/57/26/1363615726.db2.gz LNKQDEZTIFYWBA-CRAIPNDOSA-N 1 3 349.544 2.997 10 0 EFAEHO CCc1ccccc1[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)[NH2+]C(C)C ZINC001402387795 1363645669 /nfs/dbraw/zinc/64/56/69/1363645669.db2.gz GSCKEPRRSCVQGI-RBUKOAKNSA-N 1 3 333.520 2.991 10 0 EFAEHO CCc1ccccc1[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CC1 ZINC001402401308 1363660399 /nfs/dbraw/zinc/66/03/99/1363660399.db2.gz VFWGEVDKEKAFSZ-OXQOHEQNSA-N 1 3 343.515 2.748 10 0 EFAEHO CCc1ccccc1[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CC1 ZINC001402401313 1363660563 /nfs/dbraw/zinc/66/05/63/1363660563.db2.gz VFWGEVDKEKAFSZ-UZLBHIALSA-N 1 3 343.515 2.748 10 0 EFAEHO CCc1ccccc1[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]CC1CC1 ZINC001402401304 1363660644 /nfs/dbraw/zinc/66/06/44/1363660644.db2.gz VFWGEVDKEKAFSZ-OXJNMPFZSA-N 1 3 343.515 2.748 10 0 EFAEHO CC(C)CC[NH2+][C@@H](C)[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001402406761 1363666529 /nfs/dbraw/zinc/66/65/29/1363666529.db2.gz YXUDMKINXXLYEE-DLBZAZTESA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CC[C@@H]3CCC[C@H](C)C3)C[C@@H]2C1 ZINC001402428377 1363687071 /nfs/dbraw/zinc/68/70/71/1363687071.db2.gz DMADSHJZRXTPAK-LWYYNNOASA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CC[C@@H]3CCC[C@H](C)C3)C[C@@H]2C1 ZINC001402428377 1363687073 /nfs/dbraw/zinc/68/70/73/1363687073.db2.gz DMADSHJZRXTPAK-LWYYNNOASA-N 1 3 349.563 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+][C@H](C)c2ccc(F)c(F)c2)C1 ZINC001402466430 1363712158 /nfs/dbraw/zinc/71/21/58/1363712158.db2.gz SJDSTYPALKWJQR-HIFRSBDPSA-N 1 3 339.430 2.557 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1csc(C)c1 ZINC001402485077 1363730351 /nfs/dbraw/zinc/73/03/51/1363730351.db2.gz ZGPGBORXRYEXKT-ROUUACIJSA-N 1 3 349.544 2.964 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1csc(C)c1 ZINC001402485077 1363730355 /nfs/dbraw/zinc/73/03/55/1363730355.db2.gz ZGPGBORXRYEXKT-ROUUACIJSA-N 1 3 349.544 2.964 10 0 EFAEHO CC(C)C[C@@H](C)C[NH+]1CCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)CC1 ZINC001402498639 1363741871 /nfs/dbraw/zinc/74/18/71/1363741871.db2.gz JHMDLFYQOFOLKJ-RBUKOAKNSA-N 1 3 349.563 2.935 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@@H]1C[NH2+]C[C@H](C)CC(C)C)N(C)C ZINC001402530454 1363763448 /nfs/dbraw/zinc/76/34/48/1363763448.db2.gz YUOJUGDZJWGNDD-KZNAEPCWSA-N 1 3 325.541 2.980 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc(Cl)c2)C1)C1CCC1 ZINC001402597837 1363822583 /nfs/dbraw/zinc/82/25/83/1363822583.db2.gz MPIDIDYCBXLNFY-IYBDPMFKSA-N 1 3 335.879 2.561 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH2+][C@H]1C[C@@H](NC(=O)CN(C)C2CCC2)C1 ZINC001402601492 1363825115 /nfs/dbraw/zinc/82/51/15/1363825115.db2.gz RRTFEYVIPVUMPX-YESZJQIVSA-N 1 3 329.488 2.777 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@H+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001402612014 1363834906 /nfs/dbraw/zinc/83/49/06/1363834906.db2.gz MQSSGLKNTFSADP-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CCC[N@@H+](CC2CC(C)(C)C2)CC1)N(C)C ZINC001402612014 1363834910 /nfs/dbraw/zinc/83/49/10/1363834910.db2.gz MQSSGLKNTFSADP-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[N@H+](CC2CC3(CCC3)C2)CC1 ZINC001402618615 1363842268 /nfs/dbraw/zinc/84/22/68/1363842268.db2.gz SNSIQRONFGSJBZ-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[N@@H+](CC2CC3(CCC3)C2)CC1 ZINC001402618615 1363842270 /nfs/dbraw/zinc/84/22/70/1363842270.db2.gz SNSIQRONFGSJBZ-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001402620011 1363844611 /nfs/dbraw/zinc/84/46/11/1363844611.db2.gz DLZIFYMUVSBKRB-RFQIPJPRSA-N 1 3 346.302 2.559 10 0 EFAEHO O=C(N[C@H]1C[C@@H](NCC=C(Cl)Cl)C1)[C@H]1CCC[C@H]2CCC[N@H+]21 ZINC001402620011 1363844612 /nfs/dbraw/zinc/84/46/12/1363844612.db2.gz DLZIFYMUVSBKRB-RFQIPJPRSA-N 1 3 346.302 2.559 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc3c(c2)CCC3)C1 ZINC001402646663 1363880822 /nfs/dbraw/zinc/88/08/22/1363880822.db2.gz VXVBZQGBKQUBPO-RYGJVYDSSA-N 1 3 343.515 2.813 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@H+](CCC(C)(C)C)C1)N(C)C ZINC001402656252 1363896656 /nfs/dbraw/zinc/89/66/56/1363896656.db2.gz CUWCZOPRHSUHHN-IAGOWNOFSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@@H+](CCC(C)(C)C)C1)N(C)C ZINC001402656252 1363896658 /nfs/dbraw/zinc/89/66/58/1363896658.db2.gz CUWCZOPRHSUHHN-IAGOWNOFSA-N 1 3 325.541 2.837 10 0 EFAEHO CCC1([NH2+]CC2CC(C)C2)CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001402707392 1363954702 /nfs/dbraw/zinc/95/47/02/1363954702.db2.gz DURWEXBLNBLEMZ-DAWZGUTISA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001402712225 1363959208 /nfs/dbraw/zinc/95/92/08/1363959208.db2.gz FFWRBBTWINWUGF-MJGOQNOKSA-N 1 3 349.494 2.938 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001402712222 1363959378 /nfs/dbraw/zinc/95/93/78/1363959378.db2.gz FFWRBBTWINWUGF-IEBWSBKVSA-N 1 3 349.494 2.938 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001402778004 1364026588 /nfs/dbraw/zinc/02/65/88/1364026588.db2.gz ZMGCGBPEVQLLAM-PKOBYXMFSA-N 1 3 331.504 2.580 10 0 EFAEHO CN(CC(=O)N1CCC(C)([NH2+]CC=C(Cl)Cl)CC1)C1CCC1 ZINC001402780934 1364029209 /nfs/dbraw/zinc/02/92/09/1364029209.db2.gz FTDGXAOHJXECFJ-UHFFFAOYSA-N 1 3 348.318 2.760 10 0 EFAEHO CC[C@H](c1ccc(F)cc1)N(C)CCNC(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001437454385 1387657222 /nfs/dbraw/zinc/65/72/22/1387657222.db2.gz AVVLUGLSDLQUKT-RTBURBONSA-N 1 3 347.478 2.667 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](C)CCNC(=O)CN1CC[C@H](C)C1 ZINC001402841675 1364084112 /nfs/dbraw/zinc/08/41/12/1364084112.db2.gz RHRDGUSQYIGSSP-YJBOKZPZSA-N 1 3 331.504 2.630 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@H](C)[NH2+]Cc1ccccc1 ZINC001402841948 1364084486 /nfs/dbraw/zinc/08/44/86/1364084486.db2.gz FNAXZPZNKWZJTL-HKUYNNGSSA-N 1 3 331.504 2.934 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@H+](Cc2ccc(C)nc2C)[C@@H](C)C1 ZINC001402932357 1364139870 /nfs/dbraw/zinc/13/98/70/1364139870.db2.gz KFJNQEVLKSVYPT-LPHOPBHVSA-N 1 3 346.519 2.509 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@@H+](Cc2ccc(C)nc2C)[C@@H](C)C1 ZINC001402932357 1364139876 /nfs/dbraw/zinc/13/98/76/1364139876.db2.gz KFJNQEVLKSVYPT-LPHOPBHVSA-N 1 3 346.519 2.509 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@H+](Cc2ccc(C)nc2C)[C@H](C)C1 ZINC001402932337 1364140415 /nfs/dbraw/zinc/14/04/15/1364140415.db2.gz KFJNQEVLKSVYPT-APWZRJJASA-N 1 3 346.519 2.509 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@@H+](Cc2ccc(C)nc2C)[C@H](C)C1 ZINC001402932337 1364140418 /nfs/dbraw/zinc/14/04/18/1364140418.db2.gz KFJNQEVLKSVYPT-APWZRJJASA-N 1 3 346.519 2.509 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@H]1CCCN1C(=O)CC[NH+](C)C ZINC001402932836 1364145534 /nfs/dbraw/zinc/14/55/34/1364145534.db2.gz NCNRKAZFKJFQLV-GOSISDBHSA-N 1 3 335.467 2.509 10 0 EFAEHO Cc1ccncc1C[NH2+][C@@H](C)[C@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001402971067 1364170728 /nfs/dbraw/zinc/17/07/28/1364170728.db2.gz HDYLOUHBMWCXTI-IRXDYDNUSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001403022588 1364224697 /nfs/dbraw/zinc/22/46/97/1364224697.db2.gz VWDOCWVFCLCZNI-OAHLLOKOSA-N 1 3 335.467 2.603 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)c1 ZINC001403039098 1364242894 /nfs/dbraw/zinc/24/28/94/1364242894.db2.gz VSMHGWWBYGVBFN-IAGOWNOFSA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)c1 ZINC001403039092 1364243122 /nfs/dbraw/zinc/24/31/22/1364243122.db2.gz VSMHGWWBYGVBFN-DLBZAZTESA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)C/C=C\c2ccccc2)CC[N@@H+]1C ZINC001403118042 1364329788 /nfs/dbraw/zinc/32/97/88/1364329788.db2.gz DJBNGEXGFZMAOP-UDLVTDPCSA-N 1 3 343.515 2.867 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)C/C=C\c2ccccc2)CC[N@H+]1C ZINC001403118042 1364329793 /nfs/dbraw/zinc/32/97/93/1364329793.db2.gz DJBNGEXGFZMAOP-UDLVTDPCSA-N 1 3 343.515 2.867 10 0 EFAEHO C[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[N@H+](C)CC1CCCC1 ZINC001403164521 1364384791 /nfs/dbraw/zinc/38/47/91/1364384791.db2.gz BTHJYIVUOZMNQH-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[N@@H+](C)CC1CCCC1 ZINC001403164521 1364384796 /nfs/dbraw/zinc/38/47/96/1364384796.db2.gz BTHJYIVUOZMNQH-HNAYVOBHSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H](CNC(=O)CC[NH+](C)C)N(C)[C@@H](C)c1cccc(Cl)c1 ZINC001403168011 1364388989 /nfs/dbraw/zinc/38/89/89/1364388989.db2.gz LUKQZRYMERNKPP-KBPBESRZSA-N 1 3 325.884 2.789 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@@H]([NH2+]CCc2cccs2)C1 ZINC001403270928 1364483012 /nfs/dbraw/zinc/48/30/12/1364483012.db2.gz FISYLHAUYUWFQF-HZPDHXFCSA-N 1 3 337.533 2.648 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]([NH2+]CCc2cccs2)C1 ZINC001403270932 1364483213 /nfs/dbraw/zinc/48/32/13/1364483213.db2.gz FISYLHAUYUWFQF-JKSUJKDBSA-N 1 3 337.533 2.648 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)[C@H]1CCCCN1C)[NH2+]Cc1ccccn1 ZINC001403272973 1364486172 /nfs/dbraw/zinc/48/61/72/1364486172.db2.gz ZSUMOMQMMBKCSS-RBUKOAKNSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]([NH2+]CCc2ccccc2)C1 ZINC001403274675 1364487709 /nfs/dbraw/zinc/48/77/09/1364487709.db2.gz IFSQSNREQJNIAI-RBUKOAKNSA-N 1 3 331.504 2.586 10 0 EFAEHO CC[C@H](C(=O)NCC[N@H+](C)Cc1ccc(C2CCC2)cc1)N(C)C ZINC001437481206 1387682646 /nfs/dbraw/zinc/68/26/46/1387682646.db2.gz DFGOCVSEIZJTAG-LJQANCHMSA-N 1 3 331.504 2.842 10 0 EFAEHO CC[C@H](C(=O)NCC[N@@H+](C)Cc1ccc(C2CCC2)cc1)N(C)C ZINC001437481206 1387682651 /nfs/dbraw/zinc/68/26/51/1387682651.db2.gz DFGOCVSEIZJTAG-LJQANCHMSA-N 1 3 331.504 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@H+](C)[C@@H]2CCc3ccccc32)C1 ZINC001403316609 1364533342 /nfs/dbraw/zinc/53/33/42/1364533342.db2.gz CABGVQIERRSPGS-AZUAARDMSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([N@@H+](C)[C@@H]2CCc3ccccc32)C1 ZINC001403316609 1364533345 /nfs/dbraw/zinc/53/33/45/1364533345.db2.gz CABGVQIERRSPGS-AZUAARDMSA-N 1 3 343.515 2.937 10 0 EFAEHO CCc1cccc(CN2CC([C@H](C)NC(=O)C[C@H]3CC[N@H+](C)C3)C2)c1 ZINC001403321561 1364538676 /nfs/dbraw/zinc/53/86/76/1364538676.db2.gz GTECKDQXFOTWPT-QFBILLFUSA-N 1 3 343.515 2.527 10 0 EFAEHO CCc1cccc(CN2CC([C@H](C)NC(=O)C[C@H]3CC[N@@H+](C)C3)C2)c1 ZINC001403321561 1364538678 /nfs/dbraw/zinc/53/86/78/1364538678.db2.gz GTECKDQXFOTWPT-QFBILLFUSA-N 1 3 343.515 2.527 10 0 EFAEHO Cc1cccc(C[N@@H+](C)[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001403329839 1364547407 /nfs/dbraw/zinc/54/74/07/1364547407.db2.gz UWYAZINRTHWMEW-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO Cc1cccc(C[N@H+](C)[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001403329839 1364547412 /nfs/dbraw/zinc/54/74/12/1364547412.db2.gz UWYAZINRTHWMEW-LJQANCHMSA-N 1 3 331.504 2.758 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C1C[NH+](CCC2CCCCC2)C1)N(C)C ZINC001403341003 1364555429 /nfs/dbraw/zinc/55/54/29/1364555429.db2.gz AYMANTBYWXQMLL-APWZRJJASA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1ccc(C[NH+]2CC([C@H](C)NC(=O)CN(C)C(C)C)C2)cc1C ZINC001403355888 1364566874 /nfs/dbraw/zinc/56/68/74/1364566874.db2.gz SXVYQZMQDLYKMV-KRWDZBQOSA-N 1 3 331.504 2.580 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@H+](CCC2CC2)CC1(C)C)N1CCCC1 ZINC001403366459 1364577857 /nfs/dbraw/zinc/57/78/57/1364577857.db2.gz WTWOMEUXXGSCJK-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[N@@H+](CCC2CC2)CC1(C)C)N1CCCC1 ZINC001403366459 1364577863 /nfs/dbraw/zinc/57/78/63/1364577863.db2.gz WTWOMEUXXGSCJK-ZWKOTPCHSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001403404132 1364608429 /nfs/dbraw/zinc/60/84/29/1364608429.db2.gz MVEACKXASPLVKB-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO Cc1ccccc1C[N@H+]1CCCC2(CN(C(=O)CN(C)C(C)C)C2)C1 ZINC001403407902 1364611881 /nfs/dbraw/zinc/61/18/81/1364611881.db2.gz XYTBIGUKVLWYCY-UHFFFAOYSA-N 1 3 343.515 2.760 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CCCC2(CN(C(=O)CN(C)C(C)C)C2)C1 ZINC001403407902 1364611888 /nfs/dbraw/zinc/61/18/88/1364611888.db2.gz XYTBIGUKVLWYCY-UHFFFAOYSA-N 1 3 343.515 2.760 10 0 EFAEHO C[C@@H]([NH2+]C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)C1)c1ccccc1F ZINC001403420493 1364625393 /nfs/dbraw/zinc/62/53/93/1364625393.db2.gz SOHAUFRKRIZOFG-BZUAXINKSA-N 1 3 347.478 2.855 10 0 EFAEHO C[C@H](CCNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1cc2ccccc2o1 ZINC001403440410 1364642408 /nfs/dbraw/zinc/64/24/08/1364642408.db2.gz CPXSUKJHVDTLRU-HZPDHXFCSA-N 1 3 343.471 2.759 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C[NH2+]Cc1csc(C)c1)C1CC1)N(C)C ZINC001403502432 1364709480 /nfs/dbraw/zinc/70/94/80/1364709480.db2.gz BTFKIGYYNIIULB-SJORKVTESA-N 1 3 337.533 2.723 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N(C)[C@H](C[NH2+]Cc1ccccc1)C1CC1 ZINC001403504123 1364710179 /nfs/dbraw/zinc/71/01/79/1364710179.db2.gz CPUIOIWNUBZLKE-WOJBJXKFSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C[C@@H](C)[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001403554405 1364757116 /nfs/dbraw/zinc/75/71/16/1364757116.db2.gz HQMZFNBIOCLPJG-AEFFLSMTSA-N 1 3 337.552 2.980 10 0 EFAEHO CN(CCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21)Cc1ccc(CF)cc1 ZINC001403583822 1364785365 /nfs/dbraw/zinc/78/53/65/1364785365.db2.gz DNKOXNPUMJQJLS-OALUTQOASA-N 1 3 347.478 2.721 10 0 EFAEHO CN(CCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21)Cc1ccc(CF)cc1 ZINC001403583822 1364785368 /nfs/dbraw/zinc/78/53/68/1364785368.db2.gz DNKOXNPUMJQJLS-OALUTQOASA-N 1 3 347.478 2.721 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)CC[C@@H]2CCC[N@@H+]2C)c1 ZINC001403593835 1364796629 /nfs/dbraw/zinc/79/66/29/1364796629.db2.gz QCYRYNZZBKMUSX-IBGZPJMESA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)CC[C@@H]2CCC[N@H+]2C)c1 ZINC001403593835 1364796630 /nfs/dbraw/zinc/79/66/30/1364796630.db2.gz QCYRYNZZBKMUSX-IBGZPJMESA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001403593838 1364797064 /nfs/dbraw/zinc/79/70/64/1364797064.db2.gz QCYRYNZZBKMUSX-LJQANCHMSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001403593838 1364797069 /nfs/dbraw/zinc/79/70/69/1364797069.db2.gz QCYRYNZZBKMUSX-LJQANCHMSA-N 1 3 331.504 2.726 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@H]1C[N@H+](C)C[C@@H]1c1ccccc1)NC/C=C/Cl ZINC001403594064 1364798140 /nfs/dbraw/zinc/79/81/40/1364798140.db2.gz OMTOGUOYNVKEHP-HNTJRPIFSA-N 1 3 349.906 2.521 10 0 EFAEHO C[C@@H](CN(C)C(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1)NC/C=C/Cl ZINC001403594064 1364798143 /nfs/dbraw/zinc/79/81/43/1364798143.db2.gz OMTOGUOYNVKEHP-HNTJRPIFSA-N 1 3 349.906 2.521 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(F)cc1C ZINC001403620885 1364823396 /nfs/dbraw/zinc/82/33/96/1364823396.db2.gz IFPSHMMBBXOEKR-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1cccc(F)c1 ZINC001403622231 1364824274 /nfs/dbraw/zinc/82/42/74/1364824274.db2.gz LHJIMXJWGWVLMC-MAUKXSAKSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001403632861 1364837056 /nfs/dbraw/zinc/83/70/56/1364837056.db2.gz ZPNOLSGVMXUTAE-AWEZNQCLSA-N 1 3 325.884 2.617 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[N@H+](C)[C@H]1CCc2ccccc21 ZINC001403697962 1364872671 /nfs/dbraw/zinc/87/26/71/1364872671.db2.gz BKCGTSSVLSTYIK-PMACEKPBSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001403697962 1364872675 /nfs/dbraw/zinc/87/26/75/1364872675.db2.gz BKCGTSSVLSTYIK-PMACEKPBSA-N 1 3 343.515 2.985 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]Cc2ccsc2)CN1C(=O)CN(C)CC(C)(C)C ZINC001403730996 1364889746 /nfs/dbraw/zinc/88/97/46/1364889746.db2.gz DAZVGACSVXQIRL-ZBFHGGJFSA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC001403792277 1364944644 /nfs/dbraw/zinc/94/46/44/1364944644.db2.gz SBLXRSFUJPGYJT-GOSISDBHSA-N 1 3 335.467 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC001403792277 1364944647 /nfs/dbraw/zinc/94/46/47/1364944647.db2.gz SBLXRSFUJPGYJT-GOSISDBHSA-N 1 3 335.467 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]C[C@@H]2CCC(F)(F)C2)C(C)(C)C1 ZINC001403828392 1364981173 /nfs/dbraw/zinc/98/11/73/1364981173.db2.gz GKCHYFZPWQMDFT-CABCVRRESA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]C[C@H]2CCC(F)(F)C2)C(C)(C)C1 ZINC001403828396 1364981318 /nfs/dbraw/zinc/98/13/18/1364981318.db2.gz GKCHYFZPWQMDFT-GJZGRUSLSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]C[C@H]2CCC(F)(F)C2)C(C)(C)C1 ZINC001403828405 1364981355 /nfs/dbraw/zinc/98/13/55/1364981355.db2.gz GKCHYFZPWQMDFT-LSDHHAIUSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+][C@@H](C)c2ccccc2)C(C)(C)C1 ZINC001403834916 1364985393 /nfs/dbraw/zinc/98/53/93/1364985393.db2.gz NBPJAECPTBHCMZ-FUHWJXTLSA-N 1 3 331.504 2.914 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+][C@H]1CN(C(=O)CN(C)C(C)C)CC1(C)C ZINC001403844839 1364991901 /nfs/dbraw/zinc/99/19/01/1364991901.db2.gz XSLAJTHLNFHJHM-IRXDYDNUSA-N 1 3 325.541 2.835 10 0 EFAEHO CC[C@H](C)C[N@H+](CC)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001403910715 1365033338 /nfs/dbraw/zinc/03/33/38/1365033338.db2.gz GPVRNQJMKFIPGB-MAUKXSAKSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@H](C)C[N@@H+](CC)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001403910715 1365033344 /nfs/dbraw/zinc/03/33/44/1365033344.db2.gz GPVRNQJMKFIPGB-MAUKXSAKSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccccc1)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001403931634 1365060381 /nfs/dbraw/zinc/06/03/81/1365060381.db2.gz OXYHCLZNQYZPSN-IEBWSBKVSA-N 1 3 331.504 2.696 10 0 EFAEHO CC(C)N(CCN(C)Cc1ccccc1)C(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC001403931634 1365060385 /nfs/dbraw/zinc/06/03/85/1365060385.db2.gz OXYHCLZNQYZPSN-IEBWSBKVSA-N 1 3 331.504 2.696 10 0 EFAEHO CC(C)N(CC[N@H+](C)C(C)C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001403934919 1365066243 /nfs/dbraw/zinc/06/62/43/1365066243.db2.gz QKBRBZAHYGGBCZ-SFHVURJKSA-N 1 3 329.504 2.776 10 0 EFAEHO CC(C)N(CC[N@@H+](C)C(C)C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001403934919 1365066248 /nfs/dbraw/zinc/06/62/48/1365066248.db2.gz QKBRBZAHYGGBCZ-SFHVURJKSA-N 1 3 329.504 2.776 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C(C)C)Cc1ccc(Cl)cc1 ZINC001403951172 1365093772 /nfs/dbraw/zinc/09/37/72/1365093772.db2.gz RAZRPMAXVIMLCP-UHFFFAOYSA-N 1 3 325.884 2.618 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C(C)C)Cc1ccc(Cl)cc1 ZINC001403951172 1365093780 /nfs/dbraw/zinc/09/37/80/1365093780.db2.gz RAZRPMAXVIMLCP-UHFFFAOYSA-N 1 3 325.884 2.618 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C1CC[NH+](CC2CC(F)(F)C2)CC1)N(C)C ZINC001403981445 1365129437 /nfs/dbraw/zinc/12/94/37/1365129437.db2.gz CFRHEOMDSKENNR-CZUORRHYSA-N 1 3 345.478 2.589 10 0 EFAEHO C[C@@H](NC(=O)CN1CC[C@H](C)C1)C1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001403983314 1365131997 /nfs/dbraw/zinc/13/19/97/1365131997.db2.gz GSRPMZPNGYKKBX-DLBZAZTESA-N 1 3 349.563 2.981 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)C1CCN(Cc2ccsc2)CC1 ZINC001403994340 1365145348 /nfs/dbraw/zinc/14/53/48/1365145348.db2.gz JWUIIPSTJSEKEH-HNNXBMFYSA-N 1 3 337.533 2.807 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)C1CCN(Cc2ccsc2)CC1 ZINC001403994340 1365145351 /nfs/dbraw/zinc/14/53/51/1365145351.db2.gz JWUIIPSTJSEKEH-HNNXBMFYSA-N 1 3 337.533 2.807 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C1CC[NH+](CCC(C)(C)C)CC1 ZINC001404016742 1365172061 /nfs/dbraw/zinc/17/20/61/1365172061.db2.gz VZEXZHPTJKZMAP-AWEZNQCLSA-N 1 3 334.508 2.914 10 0 EFAEHO CC(C)c1ccc(C[N@H+](CCNC(=O)[C@H]2CCCN2C)C2CC2)cc1 ZINC001404207827 1365351535 /nfs/dbraw/zinc/35/15/35/1365351535.db2.gz BDICVVDJDLFYNB-HXUWFJFHSA-N 1 3 343.515 2.985 10 0 EFAEHO CC(C)c1ccc(C[N@@H+](CCNC(=O)[C@H]2CCCN2C)C2CC2)cc1 ZINC001404207827 1365351538 /nfs/dbraw/zinc/35/15/38/1365351538.db2.gz BDICVVDJDLFYNB-HXUWFJFHSA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@H](C(=O)NCC[N@H+](C[C@H]1CCCC(F)(F)C1)C1CC1)N(C)C ZINC001404234532 1365378694 /nfs/dbraw/zinc/37/86/94/1365378694.db2.gz KZZMUVTWUOXTPP-GOEBONIOSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](C(=O)NCC[N@@H+](C[C@H]1CCCC(F)(F)C1)C1CC1)N(C)C ZINC001404234532 1365378697 /nfs/dbraw/zinc/37/86/97/1365378697.db2.gz KZZMUVTWUOXTPP-GOEBONIOSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+][C@H](C)c1cccc(Cl)c1 ZINC001404327523 1365452677 /nfs/dbraw/zinc/45/26/77/1365452677.db2.gz MEQPZGVMUKQIQE-CQSZACIVSA-N 1 3 325.884 2.789 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]CC(C)C)c1ccccc1 ZINC001404386154 1365490686 /nfs/dbraw/zinc/49/06/86/1365490686.db2.gz PJLBVHUVFIKJEV-MOPGFXCFSA-N 1 3 331.504 2.964 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]([NH2+]CC1CC1)c1ccccc1)N1CCCC1 ZINC001404395423 1365499448 /nfs/dbraw/zinc/49/94/48/1365499448.db2.gz YKQZZXSMUXYNJW-GOSISDBHSA-N 1 3 329.488 2.718 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2ccsc2)C1)N(C)C ZINC001404523273 1365625942 /nfs/dbraw/zinc/62/59/42/1365625942.db2.gz UCRDFFJJMCBVGZ-DOTOQJQBSA-N 1 3 337.533 2.663 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2ccsc2)C1)N(C)C ZINC001404523273 1365625945 /nfs/dbraw/zinc/62/59/45/1365625945.db2.gz UCRDFFJJMCBVGZ-DOTOQJQBSA-N 1 3 337.533 2.663 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC(C[N@H+](C)CCC(C)(C)C)CC2)C1 ZINC001404624387 1365725459 /nfs/dbraw/zinc/72/54/59/1365725459.db2.gz YTIYTHYXKFDSHB-KRWDZBQOSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC(C[N@@H+](C)CCC(C)(C)C)CC2)C1 ZINC001404624387 1365725462 /nfs/dbraw/zinc/72/54/62/1365725462.db2.gz YTIYTHYXKFDSHB-KRWDZBQOSA-N 1 3 337.552 2.935 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001404673623 1365757922 /nfs/dbraw/zinc/75/79/22/1365757922.db2.gz UPSTXOGHUKZEHY-SJORKVTESA-N 1 3 341.515 2.683 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001404673623 1365757924 /nfs/dbraw/zinc/75/79/24/1365757924.db2.gz UPSTXOGHUKZEHY-SJORKVTESA-N 1 3 341.515 2.683 10 0 EFAEHO CC[C@@H](C(=O)NCC1CN([C@@H]2CCc3ccccc32)C1)[NH+](CC)CC ZINC001404907875 1365899316 /nfs/dbraw/zinc/89/93/16/1365899316.db2.gz OMSCEHMSLJLIQY-VQTJNVASSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1cc(C)cc(CN2CC(CNC(=O)C[NH+]3[C@H](C)CC[C@H]3C)C2)c1 ZINC001404926652 1365913866 /nfs/dbraw/zinc/91/38/66/1365913866.db2.gz GDZAICNPMFILGG-QZTJIDSGSA-N 1 3 343.515 2.724 10 0 EFAEHO CC(C)Cc1ccc(CN2CC[C@H](NC(=O)CC[NH+](C)C)C2)cc1 ZINC001405026300 1365974470 /nfs/dbraw/zinc/97/44/70/1365974470.db2.gz ACQCLGYJVMTIJX-IBGZPJMESA-N 1 3 331.504 2.527 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H](C(C)C)[NH+]2CCCC2)cc1 ZINC001437568646 1387778884 /nfs/dbraw/zinc/77/88/84/1387778884.db2.gz CBTDARCPDFRBOX-IBGZPJMESA-N 1 3 331.504 2.663 10 0 EFAEHO CCCC[N@@H+]1CC[C@@H](N(CC)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001405178548 1366088428 /nfs/dbraw/zinc/08/84/28/1366088428.db2.gz HUWHCKQNERFZHZ-VQIMIIECSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCC[N@H+]1CC[C@@H](N(CC)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001405178548 1366088432 /nfs/dbraw/zinc/08/84/32/1366088432.db2.gz HUWHCKQNERFZHZ-VQIMIIECSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](CC)[NH2+]CC1CC2(CCC2)C1 ZINC001405260344 1366122627 /nfs/dbraw/zinc/12/26/27/1366122627.db2.gz TXEPIELCBBBQBH-QZTJIDSGSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001405304412 1366141067 /nfs/dbraw/zinc/14/10/67/1366141067.db2.gz MTVNGGZLXWKLOC-OXQOHEQNSA-N 1 3 343.515 2.502 10 0 EFAEHO CC[C@@H](CNC(=O)C12CC[NH+](CC1)C2)NCc1c(C)cccc1Cl ZINC001405332175 1366149604 /nfs/dbraw/zinc/14/96/04/1366149604.db2.gz HKYCWEOJRKEGSG-HNNXBMFYSA-N 1 3 349.906 2.729 10 0 EFAEHO CC[C@H](CNC(=O)C[C@H]1CC[N@H+](C)C1)NCc1cc2ccccc2o1 ZINC001405348058 1366156593 /nfs/dbraw/zinc/15/65/93/1366156593.db2.gz WKGXKGPGIRNWDH-NVXWUHKLSA-N 1 3 343.471 2.759 10 0 EFAEHO CC[C@H](CNC(=O)C[C@H]1CC[N@@H+](C)C1)NCc1cc2ccccc2o1 ZINC001405348058 1366156595 /nfs/dbraw/zinc/15/65/95/1366156595.db2.gz WKGXKGPGIRNWDH-NVXWUHKLSA-N 1 3 343.471 2.759 10 0 EFAEHO CC[C@H](CNC(=O)[C@H](C(C)C)[NH+]1CCCCC1)NCc1ccccn1 ZINC001405367778 1366166353 /nfs/dbraw/zinc/16/63/53/1366166353.db2.gz KZXVELCWQXOLSU-MJGOQNOKSA-N 1 3 346.519 2.577 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](C(C)C)[NH+]1CCCCC1)NCc1ccccn1 ZINC001405367771 1366166665 /nfs/dbraw/zinc/16/66/65/1366166665.db2.gz KZXVELCWQXOLSU-IEBWSBKVSA-N 1 3 346.519 2.577 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@](C)(C[NH2+]Cc1ccccc1)C1CC1 ZINC001405428591 1366194095 /nfs/dbraw/zinc/19/40/95/1366194095.db2.gz HAGGMYUXSQPBJU-CTNGQTDRSA-N 1 3 343.515 2.934 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H]([NH2+]CC2CC3(CCC3)C2)CC1 ZINC001405521030 1366265736 /nfs/dbraw/zinc/26/57/36/1366265736.db2.gz GEJLGHFRVNZWGH-IYARVYRRSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)CC[NH+]1CCC(CCNC(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001405549589 1366286844 /nfs/dbraw/zinc/28/68/44/1366286844.db2.gz ADSVVZBOJWAUPK-GOSISDBHSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+][C@H]1CCCc2ccccc21 ZINC001405724877 1366366059 /nfs/dbraw/zinc/36/60/59/1366366059.db2.gz XTAKSFHRQPAOAC-LPHOPBHVSA-N 1 3 331.504 2.746 10 0 EFAEHO CC[N@H+](CCNC(=O)[C@H](C(C)C)N(C)C)Cc1ccc2cc[nH]c2c1 ZINC001437596346 1387807330 /nfs/dbraw/zinc/80/73/30/1387807330.db2.gz GWXGIWYAYFAEKF-IBGZPJMESA-N 1 3 344.503 2.692 10 0 EFAEHO CC[N@@H+](CCNC(=O)[C@H](C(C)C)N(C)C)Cc1ccc2cc[nH]c2c1 ZINC001437596346 1387807332 /nfs/dbraw/zinc/80/73/32/1387807332.db2.gz GWXGIWYAYFAEKF-IBGZPJMESA-N 1 3 344.503 2.692 10 0 EFAEHO CCCOc1cccc(C[NH2+]C[C@H](C)N(C)C(=O)[C@@H]2CCCN2C)c1 ZINC001405788342 1366416710 /nfs/dbraw/zinc/41/67/10/1366416710.db2.gz BLXAVDQWQXRFSY-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(F)c(Cl)c1)N(C)C(=O)CN1CCCC1 ZINC001405880970 1366488576 /nfs/dbraw/zinc/48/85/76/1366488576.db2.gz DCTPQWHXGRRPKW-ZDUSSCGKSA-N 1 3 341.858 2.511 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(C)nc1C ZINC001405901716 1366506059 /nfs/dbraw/zinc/50/60/59/1366506059.db2.gz FEVMLGFXWXHCDV-APWZRJJASA-N 1 3 346.519 2.509 10 0 EFAEHO CC(C)C[C@H](C[NH2+]Cc1ccccc1)NC(=O)CN1CC[C@H](C)C1 ZINC001405925329 1366527581 /nfs/dbraw/zinc/52/75/81/1366527581.db2.gz DEOYZNQTKWVAJW-PKOBYXMFSA-N 1 3 331.504 2.649 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12)Cc1ccc(F)cc1 ZINC001437603422 1387817887 /nfs/dbraw/zinc/81/78/87/1387817887.db2.gz UUCUXRMTNWPZEP-RBUKOAKNSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12)Cc1ccc(F)cc1 ZINC001437603422 1387817893 /nfs/dbraw/zinc/81/78/93/1387817893.db2.gz UUCUXRMTNWPZEP-RBUKOAKNSA-N 1 3 347.478 2.781 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](CNC(=O)C2(N(C)C)CCC2)C(C)C)c1 ZINC001406046186 1367140184 /nfs/dbraw/zinc/14/01/84/1367140184.db2.gz VQWPTWJWTOVFSL-SFHVURJKSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1cc(C[N@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)CC[C@H]32)cs1 ZINC001406178181 1367375171 /nfs/dbraw/zinc/37/51/71/1367375171.db2.gz HFNSKXSKDLDTCB-QZTJIDSGSA-N 1 3 349.544 2.820 10 0 EFAEHO Cc1cc(C[N@@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)CC[C@H]32)cs1 ZINC001406178181 1367375176 /nfs/dbraw/zinc/37/51/76/1367375176.db2.gz HFNSKXSKDLDTCB-QZTJIDSGSA-N 1 3 349.544 2.820 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2CCC2CCCC2)C1 ZINC001406203011 1367399258 /nfs/dbraw/zinc/39/92/58/1367399258.db2.gz YYBJEKRDIOXZSJ-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]2[C@H](CC[N@H+]2CCC2CCCC2)C1 ZINC001406203011 1367399265 /nfs/dbraw/zinc/39/92/65/1367399265.db2.gz YYBJEKRDIOXZSJ-MOPGFXCFSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@@H]1C[NH2+]Cc1ccc(CF)cc1 ZINC001406203487 1367399335 /nfs/dbraw/zinc/39/93/35/1367399335.db2.gz RMJCRDIWNARQAK-MOPGFXCFSA-N 1 3 349.494 2.871 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2CCC2CCCC2)C1 ZINC001406203085 1367399763 /nfs/dbraw/zinc/39/97/63/1367399763.db2.gz YYBJEKRDIOXZSJ-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2CCC2CCCC2)C1 ZINC001406203085 1367399767 /nfs/dbraw/zinc/39/97/67/1367399767.db2.gz YYBJEKRDIOXZSJ-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2CC2CC(C)(C)C2)C1 ZINC001406203180 1367399927 /nfs/dbraw/zinc/39/99/27/1367399927.db2.gz YZSPHEVGCSHKER-ZWKOTPCHSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2CC2CC(C)(C)C2)C1 ZINC001406203180 1367399933 /nfs/dbraw/zinc/39/99/33/1367399933.db2.gz YZSPHEVGCSHKER-ZWKOTPCHSA-N 1 3 335.536 2.686 10 0 EFAEHO CCN(CC[NH2+][C@H]1CCc2ccccc21)C(=O)[C@H](C(C)C)N(C)C ZINC001406338535 1367500164 /nfs/dbraw/zinc/50/01/64/1367500164.db2.gz HOIRGIYNYXPJGM-OALUTQOASA-N 1 3 331.504 2.698 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001406392000 1367542755 /nfs/dbraw/zinc/54/27/55/1367542755.db2.gz LDMZZOYNSNSXJI-AGIUHOORSA-N 1 3 343.924 2.726 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001406392000 1367542762 /nfs/dbraw/zinc/54/27/62/1367542762.db2.gz LDMZZOYNSNSXJI-AGIUHOORSA-N 1 3 343.924 2.726 10 0 EFAEHO C[C@H](CN[C@@H](C)c1ccccc1F)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001406395067 1367545836 /nfs/dbraw/zinc/54/58/36/1367545836.db2.gz XFOUCLNBWHHYQT-UGUYLWEFSA-N 1 3 335.467 2.711 10 0 EFAEHO C[C@H](CN[C@@H](C)c1ccccc1F)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001406395067 1367545841 /nfs/dbraw/zinc/54/58/41/1367545841.db2.gz XFOUCLNBWHHYQT-UGUYLWEFSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+][C@H]1CCc2c1cccc2Cl ZINC001406432225 1367585926 /nfs/dbraw/zinc/58/59/26/1367585926.db2.gz PHTMRKOISIVBOY-DYVFJYSZSA-N 1 3 337.895 2.762 10 0 EFAEHO CCN(CCNC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C)Cc1cccc(F)c1 ZINC001437649686 1387890866 /nfs/dbraw/zinc/89/08/66/1387890866.db2.gz KOVFTHUATGLDRZ-IYBDPMFKSA-N 1 3 335.467 2.637 10 0 EFAEHO CCN(CCNC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C)Cc1cccc(F)c1 ZINC001437649686 1387890872 /nfs/dbraw/zinc/89/08/72/1387890872.db2.gz KOVFTHUATGLDRZ-IYBDPMFKSA-N 1 3 335.467 2.637 10 0 EFAEHO CCN(CCNC(=O)C[NH+]1[C@H](C)CC[C@H]1C)Cc1cccc(F)c1 ZINC001437649681 1387891222 /nfs/dbraw/zinc/89/12/22/1387891222.db2.gz KOVFTHUATGLDRZ-HZPDHXFCSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cccc(C(F)F)c1)NC(=O)CN1CC[C@H](C)C1 ZINC001406522338 1367678642 /nfs/dbraw/zinc/67/86/42/1367678642.db2.gz OSZMLJVNXISEDA-KBPBESRZSA-N 1 3 339.430 2.560 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H](C)NC(=O)[C@H]2CCCCN2C(C)C)c1 ZINC001406531059 1367692848 /nfs/dbraw/zinc/69/28/48/1367692848.db2.gz GGTNPWONPKYKQU-PKOBYXMFSA-N 1 3 331.504 2.852 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001406555049 1367720482 /nfs/dbraw/zinc/72/04/82/1367720482.db2.gz FXRWMYWKHQXIQY-GUYCJALGSA-N 1 3 337.895 2.762 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1ccc(Cl)s1 ZINC001406555971 1367721718 /nfs/dbraw/zinc/72/17/18/1367721718.db2.gz HMPXQZPGMUKRNY-JSGCOSHPSA-N 1 3 343.924 2.870 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)Cc2ccc(CF)cc2)CC[N@@H+]1C ZINC001406609437 1367798641 /nfs/dbraw/zinc/79/86/41/1367798641.db2.gz MAGUCLADNXDOJU-AYOQOUSVSA-N 1 3 349.494 2.823 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)Cc2ccc(CF)cc2)CC[N@H+]1C ZINC001406609437 1367798647 /nfs/dbraw/zinc/79/86/47/1367798647.db2.gz MAGUCLADNXDOJU-AYOQOUSVSA-N 1 3 349.494 2.823 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@H+](C)CCc1ccc(Cl)cc1)N(C)C ZINC001406612067 1367804367 /nfs/dbraw/zinc/80/43/67/1367804367.db2.gz FQCSLTURHOQNGZ-RHSMWYFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@@H+](C)CCc1ccc(Cl)cc1)N(C)C ZINC001406612067 1367804371 /nfs/dbraw/zinc/80/43/71/1367804371.db2.gz FQCSLTURHOQNGZ-RHSMWYFYSA-N 1 3 339.911 2.659 10 0 EFAEHO CCc1cccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)c1 ZINC001406620440 1367816340 /nfs/dbraw/zinc/81/63/40/1367816340.db2.gz VWJWDYDSJOHZIS-GPMSIDNRSA-N 1 3 331.504 2.526 10 0 EFAEHO CCc1cccc(CN(C)C[C@@H](C)NC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)c1 ZINC001406620440 1367816348 /nfs/dbraw/zinc/81/63/48/1367816348.db2.gz VWJWDYDSJOHZIS-GPMSIDNRSA-N 1 3 331.504 2.526 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001406699313 1367944217 /nfs/dbraw/zinc/94/42/17/1367944217.db2.gz RNRMROPNJMFYHC-TZMCWYRMSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)C[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001406699313 1367944219 /nfs/dbraw/zinc/94/42/19/1367944219.db2.gz RNRMROPNJMFYHC-TZMCWYRMSA-N 1 3 342.434 2.523 10 0 EFAEHO CN(CC(=O)N[C@@H]1CCCC[C@H]1C[NH2+]Cc1ccsc1)C1CCC1 ZINC001406720790 1367969561 /nfs/dbraw/zinc/96/95/61/1367969561.db2.gz PCLQFXBJIREXMI-FUHWJXTLSA-N 1 3 349.544 2.997 10 0 EFAEHO CN(CC(=O)N[C@H]1CCCC[C@@H]1C[NH2+]Cc1ccsc1)C1CCC1 ZINC001406720780 1367969596 /nfs/dbraw/zinc/96/95/96/1367969596.db2.gz PCLQFXBJIREXMI-AEFFLSMTSA-N 1 3 349.544 2.997 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1cc2ccccc2o1)C1CC1)N(C)C ZINC001406784178 1368047597 /nfs/dbraw/zinc/04/75/97/1368047597.db2.gz OFZWIORTNVJDRX-QZTJIDSGSA-N 1 3 343.471 2.757 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)[C@@H]2CC[N@@H+](C3CCCCC3)C2)CC1 ZINC001406915522 1368206252 /nfs/dbraw/zinc/20/62/52/1368206252.db2.gz DQRSVUANUYOHST-HZPDHXFCSA-N 1 3 339.499 2.628 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)[C@@H]2CC[N@H+](C3CCCCC3)C2)CC1 ZINC001406915522 1368206256 /nfs/dbraw/zinc/20/62/56/1368206256.db2.gz DQRSVUANUYOHST-HZPDHXFCSA-N 1 3 339.499 2.628 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+][C@@H](C)c2ccccc2)CC1 ZINC001406923371 1368217096 /nfs/dbraw/zinc/21/70/96/1368217096.db2.gz XJKVOBTXAYPFLC-FUHWJXTLSA-N 1 3 329.488 2.859 10 0 EFAEHO C[C@H]([NH2+]C1(CNC(=O)C2(N(C)C)CCC2)CC1)c1cccc(F)c1 ZINC001406945405 1368235228 /nfs/dbraw/zinc/23/52/28/1368235228.db2.gz JSDJETCFIMJIGM-AWEZNQCLSA-N 1 3 333.451 2.609 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(NC/C=C/c3ccccc3)CC2)CC[N@@H+]1C ZINC001406957676 1368247345 /nfs/dbraw/zinc/24/73/45/1368247345.db2.gz LUSDGMKPJDHJDK-ZOZJGFRFSA-N 1 3 341.499 2.669 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCC2(NC/C=C/c3ccccc3)CC2)CC[N@H+]1C ZINC001406957676 1368247350 /nfs/dbraw/zinc/24/73/50/1368247350.db2.gz LUSDGMKPJDHJDK-ZOZJGFRFSA-N 1 3 341.499 2.669 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)[C@H]2CCCC[N@@H+]2C2CCCC2)CC1 ZINC001406958636 1368249119 /nfs/dbraw/zinc/24/91/19/1368249119.db2.gz QEVQRECETYMMLG-NVXWUHKLSA-N 1 3 339.499 2.770 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)[C@H]2CCCC[N@H+]2C2CCCC2)CC1 ZINC001406958636 1368249124 /nfs/dbraw/zinc/24/91/24/1368249124.db2.gz QEVQRECETYMMLG-NVXWUHKLSA-N 1 3 339.499 2.770 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+]CC[C@@H]2CCCC2(F)F)CC1)N(C)C ZINC001407003663 1368308949 /nfs/dbraw/zinc/30/89/49/1368308949.db2.gz UXZKUVHGHWIXMM-LSDHHAIUSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+][C@@H](C)c2cccc(Cl)c2)CC1 ZINC001407013395 1368322923 /nfs/dbraw/zinc/32/29/23/1368322923.db2.gz ZFXNTQDDJARKNS-AWEZNQCLSA-N 1 3 337.895 2.980 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC2(C1)CCN(Cc1ccc(F)cc1)CC2 ZINC001407023063 1368338218 /nfs/dbraw/zinc/33/82/18/1368338218.db2.gz DIMUXBYBNGJWLU-UHFFFAOYSA-N 1 3 347.478 2.592 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001407115829 1368442653 /nfs/dbraw/zinc/44/26/53/1368442653.db2.gz SSFYRLIKXWXAEK-IBGZPJMESA-N 1 3 331.504 2.724 10 0 EFAEHO CN(CC(=O)N1CCC[C@H]1C[NH2+]CC1CC(C)(C)C1)CC(C)(C)C ZINC001407116503 1368443969 /nfs/dbraw/zinc/44/39/69/1368443969.db2.gz HXFOXLHOBVBNDK-KRWDZBQOSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)NC1(C)CC[NH+](CC2CC3(CCC3)C2)CC1 ZINC001407130740 1368464265 /nfs/dbraw/zinc/46/42/65/1368464265.db2.gz GFZFGPJJBABAPN-UHFFFAOYSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)[NH+]1CCCC1 ZINC001437704362 1387952184 /nfs/dbraw/zinc/95/21/84/1387952184.db2.gz XCQVFDBUPHWYKQ-WOJBJXKFSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1(C)CC[NH+](CC[C@H](C)F)CC1)N(C)C ZINC001407273124 1368686108 /nfs/dbraw/zinc/68/61/08/1368686108.db2.gz IYWFMNLYNTXHJX-HOTGVXAUSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1(C)CC[NH+](CC[C@@H](C)F)CC1)N(C)C ZINC001407273129 1368686242 /nfs/dbraw/zinc/68/62/42/1368686242.db2.gz IYWFMNLYNTXHJX-HZPDHXFCSA-N 1 3 329.504 2.539 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCN(Cc2cccc(F)c2)C1 ZINC001437721538 1387969055 /nfs/dbraw/zinc/96/90/55/1387969055.db2.gz YTBHSKNGUJGRJV-PKOBYXMFSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@@H]1CCN(Cc2cccc(F)c2)C1 ZINC001437721538 1387969059 /nfs/dbraw/zinc/96/90/59/1387969059.db2.gz YTBHSKNGUJGRJV-PKOBYXMFSA-N 1 3 347.478 2.638 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2ccc(CF)cc2)C1 ZINC001407530998 1368945307 /nfs/dbraw/zinc/94/53/07/1368945307.db2.gz HISALESVEAOZPB-APWZRJJASA-N 1 3 349.494 2.682 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C1CCC1)C[C@H]1CCCC(F)(F)C1 ZINC001492967165 1369176773 /nfs/dbraw/zinc/17/67/73/1369176773.db2.gz GUFIJEJGRYFGCB-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C1CCC1)C[C@H]1CCCC(F)(F)C1 ZINC001492967165 1369176778 /nfs/dbraw/zinc/17/67/78/1369176778.db2.gz GUFIJEJGRYFGCB-HNNXBMFYSA-N 1 3 345.478 2.734 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001407812913 1369262512 /nfs/dbraw/zinc/26/25/12/1369262512.db2.gz VCSZLMQJWNCDMW-SJORKVTESA-N 1 3 347.528 2.894 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CCC1)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001407812913 1369262514 /nfs/dbraw/zinc/26/25/14/1369262514.db2.gz VCSZLMQJWNCDMW-SJORKVTESA-N 1 3 347.528 2.894 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+]([C@H](C)c2cccc(F)c2)C1 ZINC001437741046 1387992314 /nfs/dbraw/zinc/99/23/14/1387992314.db2.gz PHECEVZDHLNOIR-HZPDHXFCSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+]([C@H](C)c2cccc(F)c2)C1 ZINC001437741046 1387992318 /nfs/dbraw/zinc/99/23/18/1387992318.db2.gz PHECEVZDHLNOIR-HZPDHXFCSA-N 1 3 335.467 2.665 10 0 EFAEHO Cc1ccc(CCC[N@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001437742295 1387994136 /nfs/dbraw/zinc/99/41/36/1387994136.db2.gz SGKGQSHMCLSPHK-FQEVSTJZSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CCC[N@@H+]2CC[C@@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001437742295 1387994139 /nfs/dbraw/zinc/99/41/39/1387994139.db2.gz SGKGQSHMCLSPHK-FQEVSTJZSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(C[N@H+]2CCC[C@H](NC(=O)CN(C)C(C)C)CC2)cc1F ZINC001407893967 1369359757 /nfs/dbraw/zinc/35/97/57/1369359757.db2.gz XBLNUGDFFBWHRR-SFHVURJKSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(C[N@@H+]2CCC[C@H](NC(=O)CN(C)C(C)C)CC2)cc1F ZINC001407893967 1369359759 /nfs/dbraw/zinc/35/97/59/1369359759.db2.gz XBLNUGDFFBWHRR-SFHVURJKSA-N 1 3 349.494 2.945 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)CC1 ZINC001407899417 1369365306 /nfs/dbraw/zinc/36/53/06/1369365306.db2.gz ZOQGKCXQPHSLMU-AZUAARDMSA-N 1 3 343.515 2.986 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)CC1 ZINC001407899417 1369365311 /nfs/dbraw/zinc/36/53/11/1369365311.db2.gz ZOQGKCXQPHSLMU-AZUAARDMSA-N 1 3 343.515 2.986 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)CC1 ZINC001407899419 1369366217 /nfs/dbraw/zinc/36/62/17/1369366217.db2.gz ZOQGKCXQPHSLMU-QUCCMNQESA-N 1 3 343.515 2.986 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[N@H+]([C@H]2CCc3ccccc32)CC1 ZINC001407899419 1369366222 /nfs/dbraw/zinc/36/62/22/1369366222.db2.gz ZOQGKCXQPHSLMU-QUCCMNQESA-N 1 3 343.515 2.986 10 0 EFAEHO Cc1cccc(C)c1C[N@@H+](C)CCCN(C)C(=O)CN(C)C(C)C ZINC001407953000 1369454471 /nfs/dbraw/zinc/45/44/71/1369454471.db2.gz BXOCQRZTBXBTBS-UHFFFAOYSA-N 1 3 333.520 2.924 10 0 EFAEHO Cc1cccc(C)c1C[N@H+](C)CCCN(C)C(=O)CN(C)C(C)C ZINC001407953000 1369454472 /nfs/dbraw/zinc/45/44/72/1369454472.db2.gz BXOCQRZTBXBTBS-UHFFFAOYSA-N 1 3 333.520 2.924 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]([C@H]2CCCN(C/C=C/Cl)C2)C1 ZINC001407968554 1369476104 /nfs/dbraw/zinc/47/61/04/1369476104.db2.gz XWMAMGAVIXROPD-ZTXDWSKGSA-N 1 3 341.927 2.641 10 0 EFAEHO CCC1(NC/C(Cl)=C/Cl)CCN(C(=O)CC[NH+](C)C)CC1 ZINC001408005096 1369510759 /nfs/dbraw/zinc/51/07/59/1369510759.db2.gz HUHWYIOIYHOBJA-QBFSEMIESA-N 1 3 336.307 2.618 10 0 EFAEHO Cc1ccc(CC[NH2+]C2(C)CCN(C(=O)[C@H]3CCCN3C)CC2)cc1 ZINC001408087978 1369592941 /nfs/dbraw/zinc/59/29/41/1369592941.db2.gz MTYAIQVRSOIGEX-LJQANCHMSA-N 1 3 343.515 2.602 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(C)([NH2+]CCc3cccs3)CC2)C1 ZINC001408122508 1369626218 /nfs/dbraw/zinc/62/62/18/1369626218.db2.gz PMJWBXAPXPADLG-MRXNPFEDSA-N 1 3 349.544 2.603 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)C2(C[NH+](C)C)CC2)CCN1Cc1ccsc1 ZINC001408179413 1369685997 /nfs/dbraw/zinc/68/59/97/1369685997.db2.gz JBBKZPUAWIHMLE-ZBFHGGJFSA-N 1 3 335.517 2.559 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@H](C)[NH2+]CCC(F)(F)F ZINC001408228375 1369731491 /nfs/dbraw/zinc/73/14/91/1369731491.db2.gz HPKJNWRZXBAOIU-UONOGXRCSA-N 1 3 337.430 2.686 10 0 EFAEHO c1ccc2c(c1)cncc2C[NH2+]C1CCN(C[C@@H]2CCOC2)CC1 ZINC001414087539 1370040577 /nfs/dbraw/zinc/04/05/77/1370040577.db2.gz FEBSCPOEJVKZBI-INIZCTEOSA-N 1 3 325.456 2.825 10 0 EFAEHO CCC(CC)C[NH2+][C@H](C)C1CCN(C(=O)CN2CC[C@H](C)C2)CC1 ZINC001437852592 1388141635 /nfs/dbraw/zinc/14/16/35/1388141635.db2.gz NZBRKKBHQKXAID-DLBZAZTESA-N 1 3 337.552 2.981 10 0 EFAEHO CN(C)CCN(CCc1ccccc1)C(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001417613532 1373092674 /nfs/dbraw/zinc/09/26/74/1373092674.db2.gz FGICTZYRBNGELW-UXHICEINSA-N 1 3 343.515 2.636 10 0 EFAEHO CN(C)CCN(CCc1ccccc1)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001417613532 1373092680 /nfs/dbraw/zinc/09/26/80/1373092680.db2.gz FGICTZYRBNGELW-UXHICEINSA-N 1 3 343.515 2.636 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1 ZINC001417646967 1373121238 /nfs/dbraw/zinc/12/12/38/1373121238.db2.gz WRSDTYCGFJLDQF-VAMGGRTRSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)CN1Cc1ccccc1 ZINC001417670676 1373141355 /nfs/dbraw/zinc/14/13/55/1373141355.db2.gz CAMFTHYUXISDJW-GTAWCEEGSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)CN1Cc1ccccc1 ZINC001417670676 1373141357 /nfs/dbraw/zinc/14/13/57/1373141357.db2.gz CAMFTHYUXISDJW-GTAWCEEGSA-N 1 3 341.499 2.783 10 0 EFAEHO CN(C[C@H]1CC[N@@H+]1CC1CC2(CCC2)C1)C(=O)C(C)(C)N1CCCC1 ZINC001417741179 1373196561 /nfs/dbraw/zinc/19/65/61/1373196561.db2.gz MZBGNZJHKDFJQY-GOSISDBHSA-N 1 3 347.547 2.974 10 0 EFAEHO CN(C[C@H]1CC[N@H+]1CC1CC2(CCC2)C1)C(=O)C(C)(C)N1CCCC1 ZINC001417741179 1373196566 /nfs/dbraw/zinc/19/65/66/1373196566.db2.gz MZBGNZJHKDFJQY-GOSISDBHSA-N 1 3 347.547 2.974 10 0 EFAEHO CN(C[C@H]1CCN1CC1CC2(CCC2)C1)C(=O)C(C)(C)[NH+]1CCCC1 ZINC001417741179 1373196569 /nfs/dbraw/zinc/19/65/69/1373196569.db2.gz MZBGNZJHKDFJQY-GOSISDBHSA-N 1 3 347.547 2.974 10 0 EFAEHO CN(C[C@@H]1CCN1CCC1CC1)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001417752607 1373213318 /nfs/dbraw/zinc/21/33/18/1373213318.db2.gz NZGXCBKAQWWOOQ-SFHVURJKSA-N 1 3 335.536 2.972 10 0 EFAEHO CN(C[C@@H]1CCN1CCC1CC1)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001417752607 1373213328 /nfs/dbraw/zinc/21/33/28/1373213328.db2.gz NZGXCBKAQWWOOQ-SFHVURJKSA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@@H]([NH2+]CC[C@H]2CCCC2(F)F)C1 ZINC001417778269 1373245163 /nfs/dbraw/zinc/24/51/63/1373245163.db2.gz QPYOTXRFAOJECF-OAGGEKHMSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCCC[C@@H]([NH2+]CC2CC(F)(F)C2)C1 ZINC001417838232 1373318328 /nfs/dbraw/zinc/31/83/28/1373318328.db2.gz PNSBTTJMHVQUOT-MRXNPFEDSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCCC[C@H]([NH2+]CC2CC(F)(F)C2)C1 ZINC001417838230 1373318432 /nfs/dbraw/zinc/31/84/32/1373318432.db2.gz PNSBTTJMHVQUOT-INIZCTEOSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2CC[N@H+](CCCC(C)(C)C)C2)C1 ZINC001437942058 1388256017 /nfs/dbraw/zinc/25/60/17/1388256017.db2.gz QOWKIGWUVYOXBM-MSOLQXFVSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCC[C@H]2CC[N@@H+](CCCC(C)(C)C)C2)C1 ZINC001437942058 1388256023 /nfs/dbraw/zinc/25/60/23/1388256023.db2.gz QOWKIGWUVYOXBM-MSOLQXFVSA-N 1 3 337.552 2.983 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)CC(C)(C)C1 ZINC001417862880 1373356107 /nfs/dbraw/zinc/35/61/07/1373356107.db2.gz LKCFXTNWBIIWNT-HZPDHXFCSA-N 1 3 329.504 2.682 10 0 EFAEHO CC[C@@H](F)C[N@H+]1CC[C@@H](NC(=O)CN(C)C(C)C)CC(C)(C)C1 ZINC001417862880 1373356112 /nfs/dbraw/zinc/35/61/12/1373356112.db2.gz LKCFXTNWBIIWNT-HZPDHXFCSA-N 1 3 329.504 2.682 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CC[C@@H]2C[C@@H](C)C[N@@H+]2C1 ZINC001417886050 1373374783 /nfs/dbraw/zinc/37/47/83/1373374783.db2.gz IMPAUCVGRZXWJZ-HNBVOPMISA-N 1 3 343.515 2.744 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CC[C@@H]2C[C@@H](C)C[N@H+]2C1 ZINC001417886050 1373374788 /nfs/dbraw/zinc/37/47/88/1373374788.db2.gz IMPAUCVGRZXWJZ-HNBVOPMISA-N 1 3 343.515 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC[NH+](CCc2cccs2)CC1 ZINC001417900697 1373390672 /nfs/dbraw/zinc/39/06/72/1373390672.db2.gz MFPBKKMVIKNADK-UHFFFAOYSA-N 1 3 337.533 2.554 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC12CC[NH+](Cc1cccc(C)c1)CC2)N(C)C ZINC001417954623 1373446288 /nfs/dbraw/zinc/44/62/88/1373446288.db2.gz LVFOGBWMWHMTPT-MOPGFXCFSA-N 1 3 343.515 2.806 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H]([NH2+]CC1CCCCC1)C1CC1 ZINC001417975142 1373476144 /nfs/dbraw/zinc/47/61/44/1373476144.db2.gz DPFGEHDBKGHGJZ-OALUTQOASA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](CNC(=O)C(C)(C)N2CCCC2)C2CC2)cs1 ZINC001417996543 1373501314 /nfs/dbraw/zinc/50/13/14/1373501314.db2.gz WEYHUMUTMOGWEF-KRWDZBQOSA-N 1 3 349.544 2.915 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]([NH2+]C/C=C\c2ccccc2)C2CC2)C1 ZINC001417997729 1373502974 /nfs/dbraw/zinc/50/29/74/1373502974.db2.gz SQNCGOXUHYSCPU-HMEHFPCLSA-N 1 3 341.499 2.526 10 0 EFAEHO Cc1cccc(CCCN2C[C@H]3CC[C@@H](C2)N3C(=O)CC[NH+](C)C)c1 ZINC001418033910 1373548223 /nfs/dbraw/zinc/54/82/23/1373548223.db2.gz IMWOEKPGUARBFV-BGYRXZFFSA-N 1 3 343.515 2.555 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1C[C@H](NCc2ccc(C)cc2Cl)C1 ZINC001418071426 1373575851 /nfs/dbraw/zinc/57/58/51/1373575851.db2.gz IBOZSOJKVAMRES-WKILWMFISA-N 1 3 337.895 2.727 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@H](NCc2ccc(C)cc2Cl)C1 ZINC001418071426 1373575854 /nfs/dbraw/zinc/57/58/54/1373575854.db2.gz IBOZSOJKVAMRES-WKILWMFISA-N 1 3 337.895 2.727 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+][C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001418075277 1373580514 /nfs/dbraw/zinc/58/05/14/1373580514.db2.gz DAOSKIPWYWMJJP-MXVIHJGJSA-N 1 3 345.531 2.962 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+][C@H]1C[C@@H](NC(=O)CN(C)CC(C)(C)C)C1 ZINC001418102715 1373606578 /nfs/dbraw/zinc/60/65/78/1373606578.db2.gz FJHLQRNLXQJDLH-YESZJQIVSA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001418107285 1373610248 /nfs/dbraw/zinc/61/02/48/1373610248.db2.gz ABNBSTLJULNXTD-NFDNXYTESA-N 1 3 329.488 2.523 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c(C)s1 ZINC001418109606 1373614027 /nfs/dbraw/zinc/61/40/27/1373614027.db2.gz UHUVCXCFYOIMDI-IXDOHACOSA-N 1 3 337.533 2.688 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+]Cc3ccc(Cl)cc3)C2)CCC1 ZINC001418117691 1373623418 /nfs/dbraw/zinc/62/34/18/1373623418.db2.gz BLZDPAFXUQIANR-IYBDPMFKSA-N 1 3 335.879 2.561 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CCC[N@H+](CCCC(C)(C)C)C2)C1 ZINC001418128324 1373647737 /nfs/dbraw/zinc/64/77/37/1373647737.db2.gz KCCSNLNWMNFKJX-ROUUACIJSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]2CCC[N@@H+](CCCC(C)(C)C)C2)C1 ZINC001418128324 1373647761 /nfs/dbraw/zinc/64/77/61/1373647761.db2.gz KCCSNLNWMNFKJX-ROUUACIJSA-N 1 3 337.552 2.983 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001418135917 1373661058 /nfs/dbraw/zinc/66/10/58/1373661058.db2.gz XKISJUPBGMGQAV-HDICACEKSA-N 1 3 329.488 2.525 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@@H]2CCCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001418146498 1373673778 /nfs/dbraw/zinc/67/37/78/1373673778.db2.gz MAJSZGPCTQOCPE-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001418222402 1373776972 /nfs/dbraw/zinc/77/69/72/1373776972.db2.gz PRWMNGXKDWGXHC-BEFAXECRSA-N 1 3 342.487 2.635 10 0 EFAEHO CC(C)c1cccc(CN[C@H](C)CNC(=O)[C@H]2CCC[N@@H+]2C(C)C)n1 ZINC001418221679 1373777414 /nfs/dbraw/zinc/77/74/14/1373777414.db2.gz OBRWTIGJJKPWDT-VQIMIIECSA-N 1 3 346.519 2.672 10 0 EFAEHO CC(C)c1cccc(CN[C@H](C)CNC(=O)[C@H]2CCC[N@H+]2C(C)C)n1 ZINC001418221679 1373777417 /nfs/dbraw/zinc/77/74/17/1373777417.db2.gz OBRWTIGJJKPWDT-VQIMIIECSA-N 1 3 346.519 2.672 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1cc(C)ccc1C ZINC001418227984 1373783614 /nfs/dbraw/zinc/78/36/14/1373783614.db2.gz DKLGXHVMWUPDQS-PKOBYXMFSA-N 1 3 331.504 2.772 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]Cc1cccc2ccccc21)N(C)C ZINC001418235109 1373790580 /nfs/dbraw/zinc/79/05/80/1373790580.db2.gz KOVKEYOQUQBPJP-DNVCBOLYSA-N 1 3 327.472 2.774 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1)NC/C=C\Cl ZINC001418262693 1373828750 /nfs/dbraw/zinc/82/87/50/1373828750.db2.gz BLBJOEIYVYWYAS-WNTKCETOSA-N 1 3 327.900 2.630 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CCCC[N@H+]1C1CCCC1)NC/C=C\Cl ZINC001418262693 1373828758 /nfs/dbraw/zinc/82/87/58/1373828758.db2.gz BLBJOEIYVYWYAS-WNTKCETOSA-N 1 3 327.900 2.630 10 0 EFAEHO C[C@@H](CNC(=O)CC[NH+](C)C)NC1c2ccccc2-c2ccccc21 ZINC001418269673 1373838421 /nfs/dbraw/zinc/83/84/21/1373838421.db2.gz RKGQRHIGEFCUSZ-HNNXBMFYSA-N 1 3 337.467 2.802 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001418277622 1373849931 /nfs/dbraw/zinc/84/99/31/1373849931.db2.gz YAAHQLMZLVHDMB-CABCVRRESA-N 1 3 347.494 2.884 10 0 EFAEHO CC[C@@H](C)C[N@H+](C)[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001418381095 1373963203 /nfs/dbraw/zinc/96/32/03/1373963203.db2.gz VGEVUQGBVMAWFW-IAGOWNOFSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C)C[N@@H+](C)[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001418381095 1373963205 /nfs/dbraw/zinc/96/32/05/1373963205.db2.gz VGEVUQGBVMAWFW-IAGOWNOFSA-N 1 3 325.541 2.933 10 0 EFAEHO COc1cccc([C@H](C)[NH2+][C@H](C)CCNC(=O)C2(N(C)C)CCC2)c1 ZINC001418400869 1373982097 /nfs/dbraw/zinc/98/20/97/1373982097.db2.gz ABKHYDKJEIEXIY-CVEARBPZSA-N 1 3 347.503 2.725 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(C)CCNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001418471276 1374062896 /nfs/dbraw/zinc/06/28/96/1374062896.db2.gz SAQCZLBTNCBOHM-MAUKXSAKSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H](c1ccc(F)cc1)N(C)CCNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001418471276 1374062900 /nfs/dbraw/zinc/06/29/00/1374062900.db2.gz SAQCZLBTNCBOHM-MAUKXSAKSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)N(C)CCNC(=O)C12CC[NH+](CC1)C2 ZINC001418511347 1374113624 /nfs/dbraw/zinc/11/36/24/1374113624.db2.gz DEPBUXBGJDSPHZ-AWEZNQCLSA-N 1 3 335.879 2.545 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@H](C(C)C)[NH+]2CCCC2)c1 ZINC001418525213 1374133551 /nfs/dbraw/zinc/13/35/51/1374133551.db2.gz FNMMFLWTZWUKJP-FQEVSTJZSA-N 1 3 345.531 2.972 10 0 EFAEHO CCN(CCNC(=O)CC[C@@H]1CCC[N@@H+]1C)Cc1ccc(F)cc1C ZINC001418550334 1374164541 /nfs/dbraw/zinc/16/45/41/1374164541.db2.gz JUHARHYQJQQLIR-IBGZPJMESA-N 1 3 349.494 2.947 10 0 EFAEHO CCN(CCNC(=O)CC[C@@H]1CCC[N@H+]1C)Cc1ccc(F)cc1C ZINC001418550334 1374164547 /nfs/dbraw/zinc/16/45/47/1374164547.db2.gz JUHARHYQJQQLIR-IBGZPJMESA-N 1 3 349.494 2.947 10 0 EFAEHO CN(C[C@@H]1CCN1C[C@H]1CCCC(F)(F)C1)C(=O)CCC[NH+](C)C ZINC001418586923 1374229879 /nfs/dbraw/zinc/22/98/79/1374229879.db2.gz GMBQODSYNYEGDL-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C(C)C)[C@@H]1CCc2ccc(F)cc21 ZINC001418588137 1374233120 /nfs/dbraw/zinc/23/31/20/1374233120.db2.gz OMJFYXTVTYSFBC-GOSISDBHSA-N 1 3 335.467 2.591 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C(C)C)[C@@H]1CCc2ccc(F)cc21 ZINC001418588137 1374233126 /nfs/dbraw/zinc/23/31/26/1374233126.db2.gz OMJFYXTVTYSFBC-GOSISDBHSA-N 1 3 335.467 2.591 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@@H+]([C@H](C)c2cccc(OC)c2)C1 ZINC001418692035 1374374489 /nfs/dbraw/zinc/37/44/89/1374374489.db2.gz QVIKTELWIRWNBP-IAGOWNOFSA-N 1 3 347.503 2.536 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@H+]([C@H](C)c2cccc(OC)c2)C1 ZINC001418692035 1374374494 /nfs/dbraw/zinc/37/44/94/1374374494.db2.gz QVIKTELWIRWNBP-IAGOWNOFSA-N 1 3 347.503 2.536 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2[N@@H+](CCC(C)(C)C)C1 ZINC001418739080 1374442671 /nfs/dbraw/zinc/44/26/71/1374442671.db2.gz LKFZTZDBWXVYBC-VJANTYMQSA-N 1 3 349.563 2.933 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2[N@H+](CCC(C)(C)C)C1 ZINC001418739080 1374442676 /nfs/dbraw/zinc/44/26/76/1374442676.db2.gz LKFZTZDBWXVYBC-VJANTYMQSA-N 1 3 349.563 2.933 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001418767007 1374476198 /nfs/dbraw/zinc/47/61/98/1374476198.db2.gz LBXHLTMQAVEHLT-PMACEKPBSA-N 1 3 341.499 2.784 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001418767007 1374476200 /nfs/dbraw/zinc/47/62/00/1374476200.db2.gz LBXHLTMQAVEHLT-PMACEKPBSA-N 1 3 341.499 2.784 10 0 EFAEHO Cc1ccncc1C[NH2+][C@@H]1CCCCCN(C(=O)CN(C)C(C)C)C1 ZINC001418777911 1374489958 /nfs/dbraw/zinc/48/99/58/1374489958.db2.gz VWIQWPVWPPIDOJ-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+]1CC[C@H](NC(=O)C23CCCN2CCC3)[C@H]1C ZINC001418800190 1374519116 /nfs/dbraw/zinc/51/91/16/1374519116.db2.gz MKUXSGSIMHTUAO-KSZLIROESA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+]1CC[C@H](NC(=O)C23CCCN2CCC3)[C@H]1C ZINC001418800190 1374519119 /nfs/dbraw/zinc/51/91/19/1374519119.db2.gz MKUXSGSIMHTUAO-KSZLIROESA-N 1 3 335.536 2.876 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[N@H+](CC3CCC3)CC(C)(C)C2)CCC1 ZINC001418830558 1374552904 /nfs/dbraw/zinc/55/29/04/1374552904.db2.gz WVGBWXDRXYOMPI-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[N@@H+](CC3CCC3)CC(C)(C)C2)CCC1 ZINC001418830558 1374552906 /nfs/dbraw/zinc/55/29/06/1374552906.db2.gz WVGBWXDRXYOMPI-QGZVFWFLSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[NH2+][C@@H](CNC(=O)CN1CC[C@H](C)C1)c1ccc(C(C)C)cc1 ZINC001418844706 1374567617 /nfs/dbraw/zinc/56/76/17/1374567617.db2.gz QPHMWZVCLXHEIF-LPHOPBHVSA-N 1 3 331.504 2.919 10 0 EFAEHO CCCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@H+](CCC)C1 ZINC001418873158 1374606851 /nfs/dbraw/zinc/60/68/51/1374606851.db2.gz ILXPKYPMSGABDG-QFBILLFUSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[C@H]1CC[N@@H+](CCC)C1 ZINC001418873158 1374606857 /nfs/dbraw/zinc/60/68/57/1374606857.db2.gz ILXPKYPMSGABDG-QFBILLFUSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@H]1CC[N@H+](CC2CCC(C)CC2)C1 ZINC001418912984 1374678862 /nfs/dbraw/zinc/67/88/62/1374678862.db2.gz JOEKAFHXNTVEDQ-ACBHZAAOSA-N 1 3 337.552 2.983 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@H]1CC[N@@H+](CC2CCC(C)CC2)C1 ZINC001418912984 1374678870 /nfs/dbraw/zinc/67/88/70/1374678870.db2.gz JOEKAFHXNTVEDQ-ACBHZAAOSA-N 1 3 337.552 2.983 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](C[N@H+](C)CCCC3CCC3)C2)C1 ZINC001418935683 1374702852 /nfs/dbraw/zinc/70/28/52/1374702852.db2.gz FSMSBFYMUQBCIY-IEBWSBKVSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](C[N@@H+](C)CCCC3CCC3)C2)C1 ZINC001418935683 1374702856 /nfs/dbraw/zinc/70/28/56/1374702856.db2.gz FSMSBFYMUQBCIY-IEBWSBKVSA-N 1 3 335.536 2.689 10 0 EFAEHO C[N@H+](CCc1cccs1)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001418946953 1374720429 /nfs/dbraw/zinc/72/04/29/1374720429.db2.gz BNLRAALTMDJJCE-UHFFFAOYSA-N 1 3 349.544 2.557 10 0 EFAEHO C[N@@H+](CCc1cccs1)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001418946953 1374720432 /nfs/dbraw/zinc/72/04/32/1374720432.db2.gz BNLRAALTMDJJCE-UHFFFAOYSA-N 1 3 349.544 2.557 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001418959386 1374735717 /nfs/dbraw/zinc/73/57/17/1374735717.db2.gz UPSTXOGHUKZEHY-IRXDYDNUSA-N 1 3 341.515 2.683 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001418959386 1374735721 /nfs/dbraw/zinc/73/57/21/1374735721.db2.gz UPSTXOGHUKZEHY-IRXDYDNUSA-N 1 3 341.515 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@H](C)[NH2+]CC1CC(F)(F)C1 ZINC001419079746 1374820104 /nfs/dbraw/zinc/82/01/04/1374820104.db2.gz MRSMKKJGBDUWQB-HOCLYGCPSA-N 1 3 345.478 2.731 10 0 EFAEHO COc1cccc([C@H](C)N2CC[C@H](N(C)C(=O)CCC[NH+](C)C)C2)c1 ZINC001419111966 1374855541 /nfs/dbraw/zinc/85/55/41/1374855541.db2.gz ABWNBFDZXJQXJV-WMZOPIPTSA-N 1 3 347.503 2.631 10 0 EFAEHO COc1cccc([C@@H](C)N2CC[C@@H](N(C)C(=O)CCC[NH+](C)C)C2)c1 ZINC001419111961 1374856090 /nfs/dbraw/zinc/85/60/90/1374856090.db2.gz ABWNBFDZXJQXJV-SJLPKXTDSA-N 1 3 347.503 2.631 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H]1CC[N@H+](CCC2CC2)C1)N1CCCCC1 ZINC001419123348 1374869112 /nfs/dbraw/zinc/86/91/12/1374869112.db2.gz IFRJEAIHGUFOGF-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H]1CC[N@@H+](CCC2CC2)C1)N1CCCCC1 ZINC001419123348 1374869120 /nfs/dbraw/zinc/86/91/20/1374869120.db2.gz IFRJEAIHGUFOGF-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1csc(C)c1 ZINC001419181204 1374928577 /nfs/dbraw/zinc/92/85/77/1374928577.db2.gz CZWFUVJTVZSNTP-IAGOWNOFSA-N 1 3 337.533 2.914 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](CC)NCC=C(Cl)Cl ZINC001419201291 1374946458 /nfs/dbraw/zinc/94/64/58/1374946458.db2.gz QFCHOVNZQBUHNM-STQMWFEESA-N 1 3 336.307 2.664 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC12CC[NH+](CCc1ccccc1)CC2 ZINC001419204250 1374950184 /nfs/dbraw/zinc/95/01/84/1374950184.db2.gz HFTSEUDIMFGOFI-IBGZPJMESA-N 1 3 343.515 2.540 10 0 EFAEHO CC[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001419256318 1375002651 /nfs/dbraw/zinc/00/26/51/1375002651.db2.gz YXTJTGRIWVUCNX-OXJNMPFZSA-N 1 3 343.515 2.890 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1ccccc1)C1CC1 ZINC001419260024 1375006905 /nfs/dbraw/zinc/00/69/05/1375006905.db2.gz JBDUIEGIOYAJBX-MOPGFXCFSA-N 1 3 329.488 2.545 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]([NH2+]CC1CCC(F)(F)CC1)C1CC1)N(C)C ZINC001419276071 1375023866 /nfs/dbraw/zinc/02/38/66/1375023866.db2.gz NGULHPCAIUTXEW-HZPDHXFCSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]([NH2+]Cc1cccc(F)c1)C1CC1)N1CCCC1 ZINC001419279405 1375027211 /nfs/dbraw/zinc/02/72/11/1375027211.db2.gz PATVLVLGYZKSLU-GOSISDBHSA-N 1 3 347.478 2.685 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]([NH2+]Cc2ccc(Cl)cc2)C2CC2)C1 ZINC001419297868 1375056919 /nfs/dbraw/zinc/05/69/19/1375056919.db2.gz NPQYZCZSJVZTRU-KBXCAEBGSA-N 1 3 349.906 2.666 10 0 EFAEHO CC(C)CC[NH2+][C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001419298065 1375058232 /nfs/dbraw/zinc/05/82/32/1375058232.db2.gz PIWVYSTVQPUEEV-VQIMIIECSA-N 1 3 341.515 2.729 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](CNC(=O)CN1CC[C@@H](C)C1)C1CC1 ZINC001419301599 1375062542 /nfs/dbraw/zinc/06/25/42/1375062542.db2.gz WPYBJJIJOCCOGO-FOIQADDNSA-N 1 3 343.515 2.630 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1ccccc1)C1CC1 ZINC001419302202 1375063948 /nfs/dbraw/zinc/06/39/48/1375063948.db2.gz YIAGWRVVUNLRJC-PMACEKPBSA-N 1 3 343.515 2.934 10 0 EFAEHO CC[C@H](F)C[N@H+](C)C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001419329287 1375110152 /nfs/dbraw/zinc/11/01/52/1375110152.db2.gz BZCOCBCSFDZUGB-IRXDYDNUSA-N 1 3 343.531 2.883 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001419329287 1375110154 /nfs/dbraw/zinc/11/01/54/1375110154.db2.gz BZCOCBCSFDZUGB-IRXDYDNUSA-N 1 3 343.531 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)C1CC1 ZINC001419328976 1375110209 /nfs/dbraw/zinc/11/02/09/1375110209.db2.gz UMYASDWGOMVTLZ-KBXCAEBGSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)C[NH2+]C[C@](C)(NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001419338803 1375126507 /nfs/dbraw/zinc/12/65/07/1375126507.db2.gz CFSIQOFTRSMWHM-RBUKOAKNSA-N 1 3 341.515 2.729 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)N2C[C@H]3CC[C@@H](C2)N3C(=O)CC[NH+](C)C)c1 ZINC001419340384 1375129135 /nfs/dbraw/zinc/12/91/35/1375129135.db2.gz SOCLIXYZFZLCOJ-QRVBRYPASA-N 1 3 343.515 2.991 10 0 EFAEHO CC[C@H](F)CN(C)C[C@H]1CCCN(C(=O)C23CCC[NH+]2CCC3)C1 ZINC001419342669 1375133425 /nfs/dbraw/zinc/13/34/25/1375133425.db2.gz KTOCEIZZLHAYRA-SJORKVTESA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@H](C(=O)N[C@@](C)(C[NH2+]CC1CCC1)C1CC1)N1CCCCCC1 ZINC001419347570 1375141792 /nfs/dbraw/zinc/14/17/92/1375141792.db2.gz UGBZHTQNLXWFDG-UZLBHIALSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@](C)(NC(=O)CN(C)C(C)C)C1CC1 ZINC001419356184 1375156351 /nfs/dbraw/zinc/15/63/51/1375156351.db2.gz GOMXQBKRUVUPJF-FQEVSTJZSA-N 1 3 349.494 2.849 10 0 EFAEHO C[N@@H+]1CC[C@@H](C(=O)N[C@@](C)(CNCc2ccccc2Cl)C2CC2)C1 ZINC001419362019 1375166947 /nfs/dbraw/zinc/16/69/47/1375166947.db2.gz VWOBLDJQUOUWDW-BEFAXECRSA-N 1 3 349.906 2.666 10 0 EFAEHO C[N@H+]1CC[C@@H](C(=O)N[C@@](C)(CNCc2ccccc2Cl)C2CC2)C1 ZINC001419362019 1375166950 /nfs/dbraw/zinc/16/69/50/1375166950.db2.gz VWOBLDJQUOUWDW-BEFAXECRSA-N 1 3 349.906 2.666 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CC[C@H]([NH2+]Cc2cc(C)cc(C)c2)C1 ZINC001419365577 1375173211 /nfs/dbraw/zinc/17/32/11/1375173211.db2.gz LNHMVKBUNJAVMJ-OALUTQOASA-N 1 3 349.494 2.674 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H]([NH2+]CCc2ccccc2)CC1 ZINC001419391103 1375210547 /nfs/dbraw/zinc/21/05/47/1375210547.db2.gz MLKYUXRKNZSVHT-WGSAOQKQSA-N 1 3 331.504 2.586 10 0 EFAEHO Cc1ccccc1[C@H](C)N1CC(CNC(=O)CC[C@@H]2CCC[N@@H+]2C)C1 ZINC001438128407 1388368153 /nfs/dbraw/zinc/36/81/53/1388368153.db2.gz LWYFSDYUZXHYTG-HKUYNNGSSA-N 1 3 343.515 2.978 10 0 EFAEHO Cc1ccccc1[C@H](C)N1CC(CNC(=O)CC[C@@H]2CCC[N@H+]2C)C1 ZINC001438128407 1388368161 /nfs/dbraw/zinc/36/81/61/1388368161.db2.gz LWYFSDYUZXHYTG-HKUYNNGSSA-N 1 3 343.515 2.978 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2C/C=C/Cl ZINC001419447207 1375284737 /nfs/dbraw/zinc/28/47/37/1375284737.db2.gz KKKIQEXSXWLIQQ-CXCDCEILSA-N 1 3 345.890 2.530 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C/C=C/Cl ZINC001419447207 1375284743 /nfs/dbraw/zinc/28/47/43/1375284743.db2.gz KKKIQEXSXWLIQQ-CXCDCEILSA-N 1 3 345.890 2.530 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@H+](Cc3ccsc3)CC[C@@H]21 ZINC001419453839 1375294735 /nfs/dbraw/zinc/29/47/35/1375294735.db2.gz XYUQARFCBSLNMZ-MSOLQXFVSA-N 1 3 349.544 2.901 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@@H+](Cc3ccsc3)CC[C@@H]21 ZINC001419453839 1375294742 /nfs/dbraw/zinc/29/47/42/1375294742.db2.gz XYUQARFCBSLNMZ-MSOLQXFVSA-N 1 3 349.544 2.901 10 0 EFAEHO Cc1cc(C)c(C[NH+]2CC(CNC(=O)CN(C)C3CCC3)C2)c(C)c1 ZINC001438131628 1388369992 /nfs/dbraw/zinc/36/99/92/1388369992.db2.gz ZZEPLALBXRVHIU-UHFFFAOYSA-N 1 3 343.515 2.644 10 0 EFAEHO C[C@@H](N[C@H]1C[C@@H](NC(=O)CCC[NH+](C)C)C1)c1ccc(F)cc1F ZINC001419488299 1375335620 /nfs/dbraw/zinc/33/56/20/1375335620.db2.gz GAHYDGYDRPOXQA-YUELXQCFSA-N 1 3 339.430 2.604 10 0 EFAEHO CCC(CC)C[NH2+]C[C@@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001419519767 1375378881 /nfs/dbraw/zinc/37/88/81/1375378881.db2.gz ZXCBYGLVRPYJMT-DNVCBOLYSA-N 1 3 343.531 2.977 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C[C@H](C)CNC(=O)CN(C)C(C)C ZINC001419540123 1375418541 /nfs/dbraw/zinc/41/85/41/1375418541.db2.gz QOROLFDALCGJTO-AWEZNQCLSA-N 1 3 339.911 2.831 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@H]1CCCN(Cc2cc(C)ccc2F)C1 ZINC001419542263 1375420634 /nfs/dbraw/zinc/42/06/34/1375420634.db2.gz KOFNTILUWWCDBI-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@H]1CCCN(Cc2cc(C)ccc2F)C1 ZINC001419542263 1375420637 /nfs/dbraw/zinc/42/06/37/1375420637.db2.gz KOFNTILUWWCDBI-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1C[NH+](CCC2CCCCC2)C1 ZINC001438159549 1388388018 /nfs/dbraw/zinc/38/80/18/1388388018.db2.gz NOEMIGWLRVFDHV-IAGOWNOFSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H](C)N(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001419667401 1375671502 /nfs/dbraw/zinc/67/15/02/1375671502.db2.gz OHGQDXVANJKSKI-OAHLLOKOSA-N 1 3 335.467 2.555 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](C)CNC(=O)[C@H]1CCCN1C(C)C ZINC001419735790 1375788935 /nfs/dbraw/zinc/78/89/35/1375788935.db2.gz RFEGMKNAKYUWFA-IEBWSBKVSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](C)CNC(=O)[C@@H]1CCCN1C(C)C ZINC001419735787 1375789289 /nfs/dbraw/zinc/78/92/89/1375789289.db2.gz RFEGMKNAKYUWFA-HKUYNNGSSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@@H](C)CNC(=O)[C@H]1CCCN1C(C)C ZINC001419735804 1375789337 /nfs/dbraw/zinc/78/93/37/1375789337.db2.gz RFEGMKNAKYUWFA-PKOBYXMFSA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc2ccccc2c1)N(C)C(=O)CN1CCCC1 ZINC001419743361 1375799219 /nfs/dbraw/zinc/79/92/19/1375799219.db2.gz IAZFJUDCSPSDSN-QGZVFWFLSA-N 1 3 339.483 2.872 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+][C@@H](C)CNC(=O)C2(N(C)C)CCC2)c1 ZINC001419776156 1375857901 /nfs/dbraw/zinc/85/79/01/1375857901.db2.gz NZDJIUKBEMOGBX-DLBZAZTESA-N 1 3 331.504 2.943 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001419817440 1375930238 /nfs/dbraw/zinc/93/02/38/1375930238.db2.gz HXUXQFVOIMURAT-AZUAARDMSA-N 1 3 345.531 2.970 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001419817588 1375930946 /nfs/dbraw/zinc/93/09/46/1375930946.db2.gz IFFRHFQVZOREKZ-ICSRJNTNSA-N 1 3 345.531 2.704 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@H](NC(=O)Cc1nc[nH]c1C)C1CCCCC1 ZINC001419822379 1375939156 /nfs/dbraw/zinc/93/91/56/1375939156.db2.gz QCQNFHVAIKUMAW-KSSFIOAISA-N 1 3 334.508 2.961 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H](C)CNC(=O)[C@H](C)N1CCCCCC1 ZINC001419871921 1376040169 /nfs/dbraw/zinc/04/01/69/1376040169.db2.gz RPAKOUSKSZQCPG-ROUUACIJSA-N 1 3 331.504 2.854 10 0 EFAEHO Cc1cc(C[NH2+][C@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)cs1 ZINC001419908662 1376110733 /nfs/dbraw/zinc/11/07/33/1376110733.db2.gz PFSBOISXLBVBJP-WMLDXEAASA-N 1 3 337.533 2.629 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001419931763 1376148397 /nfs/dbraw/zinc/14/83/97/1376148397.db2.gz GEKPJIQCLDWXRW-SUMWQHHRSA-N 1 3 337.895 2.762 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]Cc2sccc2Cl)C1 ZINC001420006098 1376268401 /nfs/dbraw/zinc/26/84/01/1376268401.db2.gz AOALPZRVWRJJPN-CYBMUJFWSA-N 1 3 343.924 2.680 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCC[C@H](NC(=O)CN(C)C(C)C)C2)cc1F ZINC001420020219 1376296632 /nfs/dbraw/zinc/29/66/32/1376296632.db2.gz LGLRBUAPTCMAAN-ROUUACIJSA-N 1 3 349.494 2.991 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@@H](C)[NH2+]CCC(F)(F)F ZINC001420127919 1376485247 /nfs/dbraw/zinc/48/52/47/1376485247.db2.gz HPKJNWRZXBAOIU-ZIAGYGMSSA-N 1 3 337.430 2.686 10 0 EFAEHO CC(C)Cc1ccc(CN(C)CCNC(=O)C23CC[NH+](CC2)C3)cc1 ZINC001420332364 1376746561 /nfs/dbraw/zinc/74/65/61/1376746561.db2.gz AEBKYGQENBOVHX-UHFFFAOYSA-N 1 3 343.515 2.529 10 0 EFAEHO CCN(C(=O)[C@H](C)[NH+]1CCCCCC1)[C@@H]1CCN(CCCF)C1 ZINC001438265035 1388463207 /nfs/dbraw/zinc/46/32/07/1388463207.db2.gz GIBXYSBDNQYBIL-DLBZAZTESA-N 1 3 327.488 2.533 10 0 EFAEHO CCc1cccc(CN(CC)CCNC(=O)[C@H]2C[NH+]3CCC2CC3)c1 ZINC001420387054 1376860671 /nfs/dbraw/zinc/86/06/71/1376860671.db2.gz LQVNRNBMZZPXNC-FQEVSTJZSA-N 1 3 343.515 2.529 10 0 EFAEHO C[C@@H](CN[C@@H](C)c1ccccc1F)NC(=O)C12CCC[NH+](CCC1)C2 ZINC001420432023 1376959518 /nfs/dbraw/zinc/95/95/18/1376959518.db2.gz FUKNTFPXYLMVQE-HOTGVXAUSA-N 1 3 347.478 2.857 10 0 EFAEHO C[C@@H](C[NH2+][C@H]1CCc2ccc(Cl)cc21)NC(=O)CN(C)C1CCC1 ZINC001420439439 1376977979 /nfs/dbraw/zinc/97/79/79/1376977979.db2.gz SFXLVOGAJYUBLT-UGSOOPFHSA-N 1 3 349.906 2.906 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@@H](C(C)C)[NH+]2CCCC2)c1 ZINC001420517682 1377118202 /nfs/dbraw/zinc/11/82/02/1377118202.db2.gz OELNIKNYBZFLEC-QFBILLFUSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(F)c(CN2CC[C@H](CNC(=O)[C@@H](C(C)C)[NH+](C)C)C2)c1 ZINC001420560398 1377200179 /nfs/dbraw/zinc/20/01/79/1377200179.db2.gz MKKCJCNBMSNTOW-VQIMIIECSA-N 1 3 349.494 2.658 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCC[N@H+](Cc1ccc(C2CC2)cc1)C1CC1 ZINC001420635886 1377382279 /nfs/dbraw/zinc/38/22/79/1377382279.db2.gz SLSCVWYQQCBDDP-FQEVSTJZSA-N 1 3 341.499 2.739 10 0 EFAEHO CN1CCC[C@H]1C(=O)NCC[N@@H+](Cc1ccc(C2CC2)cc1)C1CC1 ZINC001420635886 1377382284 /nfs/dbraw/zinc/38/22/84/1377382284.db2.gz SLSCVWYQQCBDDP-FQEVSTJZSA-N 1 3 341.499 2.739 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001420656952 1377433890 /nfs/dbraw/zinc/43/38/90/1377433890.db2.gz CPRZMCKOKQZRKR-JKSUJKDBSA-N 1 3 343.471 2.711 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2o1)NC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001420656952 1377433892 /nfs/dbraw/zinc/43/38/92/1377433892.db2.gz CPRZMCKOKQZRKR-JKSUJKDBSA-N 1 3 343.471 2.711 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccc(F)cc1 ZINC001438307435 1388497447 /nfs/dbraw/zinc/49/74/47/1388497447.db2.gz UALYQOMRPQHGOZ-QZTJIDSGSA-N 1 3 335.467 2.683 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2s1)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001420661352 1377443716 /nfs/dbraw/zinc/44/37/16/1377443716.db2.gz NYJZCXUDZHJYIO-ZBFHGGJFSA-N 1 3 345.512 2.790 10 0 EFAEHO C[C@H](CN(C)Cc1cc2ccccc2s1)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001420661352 1377443717 /nfs/dbraw/zinc/44/37/17/1377443717.db2.gz NYJZCXUDZHJYIO-ZBFHGGJFSA-N 1 3 345.512 2.790 10 0 EFAEHO CC[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001438314704 1388502391 /nfs/dbraw/zinc/50/23/91/1388502391.db2.gz WRURTFIFOZTVPN-GJZGRUSLSA-N 1 3 345.478 2.781 10 0 EFAEHO CC[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]CC[C@@H]1CCCC1(F)F ZINC001438314707 1388502542 /nfs/dbraw/zinc/50/25/42/1388502542.db2.gz WRURTFIFOZTVPN-LSDHHAIUSA-N 1 3 345.478 2.781 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+][C@@H]2CCc3ccccc32)C2CC2)CCC1 ZINC001420733191 1377580285 /nfs/dbraw/zinc/58/02/85/1377580285.db2.gz CXSMRFJJXBIHJA-MOPGFXCFSA-N 1 3 341.499 2.643 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CCCC1 ZINC001420790334 1377672545 /nfs/dbraw/zinc/67/25/45/1377672545.db2.gz PEOJLLKUOBXKHM-FGTMMUONSA-N 1 3 339.499 2.532 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCCC1 ZINC001420790334 1377672551 /nfs/dbraw/zinc/67/25/51/1377672551.db2.gz PEOJLLKUOBXKHM-FGTMMUONSA-N 1 3 339.499 2.532 10 0 EFAEHO CCCN(C(=O)C[C@H]1CC[N@H+](C)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001420831044 1377742565 /nfs/dbraw/zinc/74/25/65/1377742565.db2.gz XVOHSFKUCFNKQK-WOJBJXKFSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN(C(=O)C[C@H]1CC[N@@H+](C)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001420831044 1377742567 /nfs/dbraw/zinc/74/25/67/1377742567.db2.gz XVOHSFKUCFNKQK-WOJBJXKFSA-N 1 3 343.515 2.841 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@@H]1CC[N@@H+]([C@H]2CCc3ccccc32)C1 ZINC001420885665 1377835141 /nfs/dbraw/zinc/83/51/41/1377835141.db2.gz FCTOITWTKCOBSX-XLIONFOSSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCN(C)CC(=O)NCC[C@@H]1CC[N@H+]([C@H]2CCc3ccccc32)C1 ZINC001420885665 1377835143 /nfs/dbraw/zinc/83/51/43/1377835143.db2.gz FCTOITWTKCOBSX-XLIONFOSSA-N 1 3 343.515 2.844 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(N[C@H](C)c3cccc(F)c3)CC2)CC[N@@H+]1C ZINC001420939240 1377911186 /nfs/dbraw/zinc/91/11/86/1377911186.db2.gz HETZGQOSRAFRLR-FHLIZLRMSA-N 1 3 347.478 2.855 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(N[C@H](C)c3cccc(F)c3)CC2)CC[N@H+]1C ZINC001420939240 1377911190 /nfs/dbraw/zinc/91/11/90/1377911190.db2.gz HETZGQOSRAFRLR-FHLIZLRMSA-N 1 3 347.478 2.855 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H](CN(C)C/C=C\Cl)C1)[NH+](CC)CC ZINC001420939606 1377912742 /nfs/dbraw/zinc/91/27/42/1377912742.db2.gz HPHUKIIGXDOGDD-JBILIXEDSA-N 1 3 329.916 2.640 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](CN(C)C/C=C/Cl)C1)[NH+](CC)CC ZINC001420939604 1377913126 /nfs/dbraw/zinc/91/31/26/1377913126.db2.gz HPHUKIIGXDOGDD-CABXGAGESA-N 1 3 329.916 2.640 10 0 EFAEHO Cc1ccc(CNC2(CNC(=O)CC[C@@H]3CCC[N@H+]3C)CC2)cc1F ZINC001420956922 1377938480 /nfs/dbraw/zinc/93/84/80/1377938480.db2.gz YNXDMKPJDFWFCY-KRWDZBQOSA-N 1 3 347.478 2.747 10 0 EFAEHO Cc1ccc(CNC2(CNC(=O)CC[C@@H]3CCC[N@@H+]3C)CC2)cc1F ZINC001420956922 1377938482 /nfs/dbraw/zinc/93/84/82/1377938482.db2.gz YNXDMKPJDFWFCY-KRWDZBQOSA-N 1 3 347.478 2.747 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+][C@H]2CCCc3ccccc32)CC1)N(C)C ZINC001420957126 1377938502 /nfs/dbraw/zinc/93/85/02/1377938502.db2.gz ZMAZDTTVRYEZSR-OALUTQOASA-N 1 3 343.515 2.889 10 0 EFAEHO CCc1ccccc1CNC1(CNC(=O)CC[C@H]2CCC[N@@H+]2C)CC1 ZINC001420956877 1377938687 /nfs/dbraw/zinc/93/86/87/1377938687.db2.gz XXWLUVKWKYLAJG-LJQANCHMSA-N 1 3 343.515 2.862 10 0 EFAEHO CCc1ccccc1CNC1(CNC(=O)CC[C@H]2CCC[N@H+]2C)CC1 ZINC001420956877 1377938692 /nfs/dbraw/zinc/93/86/92/1377938692.db2.gz XXWLUVKWKYLAJG-LJQANCHMSA-N 1 3 343.515 2.862 10 0 EFAEHO C[C@@H](NC1(CNC(=O)CCC[NH+](C)C)CC1)c1ccc(Cl)cc1 ZINC001420976956 1377965253 /nfs/dbraw/zinc/96/52/53/1377965253.db2.gz WXKBXVXSKIDBDC-CQSZACIVSA-N 1 3 337.895 2.981 10 0 EFAEHO C[C@H](NC1(CNC(=O)CCC[NH+](C)C)CC1)c1ccc(Cl)cc1 ZINC001420976952 1377965703 /nfs/dbraw/zinc/96/57/03/1377965703.db2.gz WXKBXVXSKIDBDC-AWEZNQCLSA-N 1 3 337.895 2.981 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCCN(Cc2cc3ccccc3s2)C1 ZINC001420987479 1377982882 /nfs/dbraw/zinc/98/28/82/1377982882.db2.gz ZDHZFKSYHCPMNU-MRXNPFEDSA-N 1 3 345.512 2.934 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@H](C[NH2+]Cc2ccsc2)C2CCCC2)C1 ZINC001421165820 1378213275 /nfs/dbraw/zinc/21/32/75/1378213275.db2.gz FJSCNEKBHHGZSX-MAUKXSAKSA-N 1 3 349.544 2.855 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1ccc(F)cc1)C1CCCC1)N(C)C ZINC001421167303 1378216733 /nfs/dbraw/zinc/21/67/33/1378216733.db2.gz IPKCLLUHLXUWQT-RTBURBONSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]Cc1ccc(F)cc1)C1CCCC1)N(C)C ZINC001421167298 1378216843 /nfs/dbraw/zinc/21/68/43/1378216843.db2.gz IPKCLLUHLXUWQT-RBUKOAKNSA-N 1 3 349.494 2.931 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@@]1(C)CCN(C(=O)C(C)(C)N2CCCCC2)C1 ZINC001421236922 1378326683 /nfs/dbraw/zinc/32/66/83/1378326683.db2.gz JELYFTJHBITTIZ-VQIMIIECSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@]2(C)CCN(C(=O)CN3CC[C@H](C)C3)C2)c1 ZINC001421257608 1378360992 /nfs/dbraw/zinc/36/09/92/1378360992.db2.gz PYUMXEDSPGJHAW-RXVVDRJESA-N 1 3 343.515 2.665 10 0 EFAEHO C[C@@H](C(=O)NC[C@]1(C)CCC[N@H+](CC2CC2)C1)N1CCCCCC1 ZINC001421294877 1378449461 /nfs/dbraw/zinc/44/94/61/1378449461.db2.gz KATFFFJDZSGCHW-PXNSSMCTSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@@H](C(=O)NC[C@]1(C)CCC[N@@H+](CC2CC2)C1)N1CCCCCC1 ZINC001421294877 1378449464 /nfs/dbraw/zinc/44/94/64/1378449464.db2.gz KATFFFJDZSGCHW-PXNSSMCTSA-N 1 3 335.536 2.879 10 0 EFAEHO CN(C(=O)CC[C@H]1CCC[N@@H+]1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC001421302674 1378464407 /nfs/dbraw/zinc/46/44/07/1378464407.db2.gz OFAMSTGPYFIENJ-MOPGFXCFSA-N 1 3 329.488 2.594 10 0 EFAEHO CN(C(=O)CC[C@H]1CCC[N@H+]1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC001421302674 1378464410 /nfs/dbraw/zinc/46/44/10/1378464410.db2.gz OFAMSTGPYFIENJ-MOPGFXCFSA-N 1 3 329.488 2.594 10 0 EFAEHO CC(C)Cc1ccc(CN2CC[C@@H](N(C)C(=O)CC[NH+](C)C)C2)cc1 ZINC001421311456 1378477856 /nfs/dbraw/zinc/47/78/56/1378477856.db2.gz MPBNYUHPLJVJEI-HXUWFJFHSA-N 1 3 345.531 2.870 10 0 EFAEHO CC(C)Cc1ccc(CN2CC[C@H](N(C)C(=O)CC[NH+](C)C)C2)cc1 ZINC001421311452 1378477925 /nfs/dbraw/zinc/47/79/25/1378477925.db2.gz MPBNYUHPLJVJEI-FQEVSTJZSA-N 1 3 345.531 2.870 10 0 EFAEHO CN(C(=O)C(C)(C)[N@H+](C)C1CCCC1)[C@@H]1CCN(CCCF)C1 ZINC001421330603 1378502632 /nfs/dbraw/zinc/50/26/32/1378502632.db2.gz SFSJKJDIWNPRQF-MRXNPFEDSA-N 1 3 327.488 2.532 10 0 EFAEHO CN(C(=O)C(C)(C)[N@@H+](C)C1CCCC1)[C@@H]1CCN(CCCF)C1 ZINC001421330603 1378502638 /nfs/dbraw/zinc/50/26/38/1378502638.db2.gz SFSJKJDIWNPRQF-MRXNPFEDSA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H](CC)[NH2+]Cc1ccccc1C ZINC001421402640 1378584290 /nfs/dbraw/zinc/58/42/90/1378584290.db2.gz IZQWAWIQJXWQLL-RTBURBONSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@H](C)c1cccc(OC)c1 ZINC001421425831 1378601732 /nfs/dbraw/zinc/60/17/32/1378601732.db2.gz QHZLTSYVQSZXTF-NVXWUHKLSA-N 1 3 347.503 2.725 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]Cc1ccsc1 ZINC001421456147 1378641400 /nfs/dbraw/zinc/64/14/00/1378641400.db2.gz NTRRJMSTTBOEAS-SJORKVTESA-N 1 3 337.533 2.995 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1cc2ccccc2o1 ZINC001421493866 1378691495 /nfs/dbraw/zinc/69/14/95/1378691495.db2.gz FIXPEKLLHVIXMA-MRXNPFEDSA-N 1 3 331.460 2.757 10 0 EFAEHO C[C@@H]([NH2+]CC1CCCC1)[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001421518727 1378734822 /nfs/dbraw/zinc/73/48/22/1378734822.db2.gz CMVBNADZIZSMRF-SJLPKXTDSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)N[C@@](C)(C[NH2+]Cc1cccc(C)c1)C1CC1)N(C)C ZINC001421562417 1378815469 /nfs/dbraw/zinc/81/54/69/1378815469.db2.gz PBARSCDTWKZMHL-QUCCMNQESA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)[NH2+]CCN(Cc1ccccc1)C(=O)CN1[C@@H](C)CC[C@@H]1C ZINC001421567354 1378822190 /nfs/dbraw/zinc/82/21/90/1378822190.db2.gz WXVIFZVBPNLGQW-ROUUACIJSA-N 1 3 331.504 2.886 10 0 EFAEHO Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)CC[NH+](C)C)cc1F ZINC001421637199 1378923663 /nfs/dbraw/zinc/92/36/63/1378923663.db2.gz NMYQRMSMYWNAIT-RBUKOAKNSA-N 1 3 347.478 2.651 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC2(C1)CCN(Cc1ccccc1F)CC2 ZINC001421676512 1378983315 /nfs/dbraw/zinc/98/33/15/1378983315.db2.gz BAPJKIAVFGITHN-UHFFFAOYSA-N 1 3 347.478 2.592 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC2(C1)CCN(Cc1ccccc1F)CC2 ZINC001421676512 1378983317 /nfs/dbraw/zinc/98/33/17/1378983317.db2.gz BAPJKIAVFGITHN-UHFFFAOYSA-N 1 3 347.478 2.592 10 0 EFAEHO C[C@H](CNC/C(Cl)=C\Cl)CNC(=O)C12CCC[NH+](CCC1)C2 ZINC001421726470 1379040997 /nfs/dbraw/zinc/04/09/97/1379040997.db2.gz VTTHZPJCAKFOLG-SJWLEHQBSA-N 1 3 348.318 2.523 10 0 EFAEHO C[C@H](C(=O)NC[C@H](C)C[NH2+]Cc1ccsc1)N1CCCCCC1 ZINC001421740539 1379063853 /nfs/dbraw/zinc/06/38/53/1379063853.db2.gz QSYXDHWSJNCYPG-HZPDHXFCSA-N 1 3 337.533 2.855 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H](C)C[NH2+]Cc1ccsc1 ZINC001421741353 1379063886 /nfs/dbraw/zinc/06/38/86/1379063886.db2.gz UIIVINVDILSYAP-WBVHZDCISA-N 1 3 337.533 2.853 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+][C@H](C)c1ccc2c(c1)CCC2 ZINC001421767189 1379105397 /nfs/dbraw/zinc/10/53/97/1379105397.db2.gz IEUKXAONBJAONA-DLBZAZTESA-N 1 3 345.531 2.918 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+][C@H](C)c1c(F)cccc1F ZINC001421767953 1379106895 /nfs/dbraw/zinc/10/68/95/1379106895.db2.gz KFSPJYOFLQDQMA-ZIAGYGMSSA-N 1 3 341.446 2.708 10 0 EFAEHO CN(CC(=O)NCC1([NH2+]Cc2ccsc2)CCC1)CC(C)(C)C ZINC001421768588 1379108243 /nfs/dbraw/zinc/10/82/43/1379108243.db2.gz XEUUHLDBYQOMOA-UHFFFAOYSA-N 1 3 337.533 2.855 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]CCc2ccccc2)CCCC1 ZINC001421850332 1379237927 /nfs/dbraw/zinc/23/79/27/1379237927.db2.gz XZWFXOMSDWYTOZ-UHFFFAOYSA-N 1 3 331.504 2.588 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@H+](C)[C@@H]1CCc2c1cccc2F ZINC001421900811 1379328227 /nfs/dbraw/zinc/32/82/27/1379328227.db2.gz HERIOYZBDRFYAN-LJQANCHMSA-N 1 3 349.494 2.934 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)[C@@H]1CCc2c1cccc2F ZINC001421900811 1379328231 /nfs/dbraw/zinc/32/82/31/1379328231.db2.gz HERIOYZBDRFYAN-LJQANCHMSA-N 1 3 349.494 2.934 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001421904505 1379333537 /nfs/dbraw/zinc/33/35/37/1379333537.db2.gz ZJLJYFNNDLSGRN-HNNXBMFYSA-N 1 3 333.467 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC001421904505 1379333543 /nfs/dbraw/zinc/33/35/43/1379333543.db2.gz ZJLJYFNNDLSGRN-HNNXBMFYSA-N 1 3 333.467 2.542 10 0 EFAEHO CCC1([NH2+]C/C=C/Cl)CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001421936539 1379376009 /nfs/dbraw/zinc/37/60/09/1379376009.db2.gz WOWVJAMNURXQPF-BJMVGYQFSA-N 1 3 327.900 2.584 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H](C)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001421937876 1379378966 /nfs/dbraw/zinc/37/89/66/1379378966.db2.gz DTRNXLAQVNEKKV-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO CCC1([NH2+]Cc2ccsc2)CCN(C(=O)CN(C)C(C)C)CC1 ZINC001421953191 1379401004 /nfs/dbraw/zinc/40/10/04/1379401004.db2.gz SWTDMALFENVXOQ-UHFFFAOYSA-N 1 3 337.533 2.949 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@]2(CCN(Cc3cccc(F)c3)C2)C1 ZINC001421959512 1379411791 /nfs/dbraw/zinc/41/17/91/1379411791.db2.gz RWQVVTGZSXGATN-HXUWFJFHSA-N 1 3 347.478 2.592 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(C)c(F)c1 ZINC001421978959 1379433242 /nfs/dbraw/zinc/43/32/42/1379433242.db2.gz GDRBIYGPHLAWJF-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(F)cc1 ZINC001421985626 1379440759 /nfs/dbraw/zinc/44/07/59/1379440759.db2.gz OKOUQUMPBWYVCF-QAPCUYQASA-N 1 3 335.467 2.637 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CCCC2)c(C)c1 ZINC001421986278 1379441931 /nfs/dbraw/zinc/44/19/31/1379441931.db2.gz GEMHMJALVHVSKA-GOSISDBHSA-N 1 3 331.504 2.644 10 0 EFAEHO Cc1cccc(Cl)c1C[NH2+]C[C@@H](C)N(C)C(=O)CN(C)C(C)C ZINC001421991727 1379449229 /nfs/dbraw/zinc/44/92/29/1379449229.db2.gz XSTUHWXXVCOTID-OAHLLOKOSA-N 1 3 339.911 2.925 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001422029488 1379513311 /nfs/dbraw/zinc/51/33/11/1379513311.db2.gz NGQCAXDDQDASOU-HKUYNNGSSA-N 1 3 331.504 2.662 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@H]([NH2+]CCC(C)(C)C)[C@@H](C)C2)CC1 ZINC001422037419 1379523012 /nfs/dbraw/zinc/52/30/12/1379523012.db2.gz ZWCWXZBAIFKSCX-ZWKOTPCHSA-N 1 3 337.552 2.981 10 0 EFAEHO C[N@H+](CCC1CCN(C(=O)Cc2c[nH]cn2)CC1)CCC(C)(C)C ZINC001422040295 1379529122 /nfs/dbraw/zinc/52/91/22/1379529122.db2.gz KQTKXNDXVKBHNB-UHFFFAOYSA-N 1 3 334.508 2.949 10 0 EFAEHO C[N@@H+](CCC1CCN(C(=O)Cc2c[nH]cn2)CC1)CCC(C)(C)C ZINC001422040295 1379529124 /nfs/dbraw/zinc/52/91/24/1379529124.db2.gz KQTKXNDXVKBHNB-UHFFFAOYSA-N 1 3 334.508 2.949 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H](C)[NH2+]Cc2ccsc2)C1 ZINC001422059491 1379557288 /nfs/dbraw/zinc/55/72/88/1379557288.db2.gz OMESVZPUQIGDAX-WBVHZDCISA-N 1 3 337.533 2.805 10 0 EFAEHO CCc1ccc(CC[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001422071067 1379571576 /nfs/dbraw/zinc/57/15/76/1379571576.db2.gz YWTKQCLKGSBHKY-PXNSSMCTSA-N 1 3 345.531 2.568 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001422080260 1379583376 /nfs/dbraw/zinc/58/33/76/1379583376.db2.gz KFPJGJROEBVBAF-SJORKVTESA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[N@@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001422080260 1379583386 /nfs/dbraw/zinc/58/33/86/1379583386.db2.gz KFPJGJROEBVBAF-SJORKVTESA-N 1 3 337.552 2.980 10 0 EFAEHO COC(=O)c1cc2cc(C[NH+]3C[C@]4(C)CN(C)C[C@@]4(C)C3)ccc2o1 ZINC001422102685 1379613245 /nfs/dbraw/zinc/61/32/45/1379613245.db2.gz AIWKZCWYYGCSMS-PMACEKPBSA-N 1 3 342.439 2.993 10 0 EFAEHO COC(=O)c1cc2cc(C[NH+]3C[C@@]4(C)CN(C)C[C@]4(C)C3)ccc2o1 ZINC001422102713 1379614722 /nfs/dbraw/zinc/61/47/22/1379614722.db2.gz AIWKZCWYYGCSMS-WOJBJXKFSA-N 1 3 342.439 2.993 10 0 EFAEHO C[C@@H]1C[C@H](NC(=O)CC[NH+](C)C)CCN1Cc1cc2ccccc2o1 ZINC001422126072 1379651521 /nfs/dbraw/zinc/65/15/21/1379651521.db2.gz LYXZCEKOHVMTNK-NVXWUHKLSA-N 1 3 343.471 2.854 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CCc2ccccc2F)[C@H](C)C1 ZINC001422136548 1379669305 /nfs/dbraw/zinc/66/93/05/1379669305.db2.gz VIHXBKJWFAGEIZ-AEFFLSMTSA-N 1 3 349.494 2.678 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CCc2ccccc2F)[C@H](C)C1 ZINC001422136548 1379669315 /nfs/dbraw/zinc/66/93/15/1379669315.db2.gz VIHXBKJWFAGEIZ-AEFFLSMTSA-N 1 3 349.494 2.678 10 0 EFAEHO CN(C)C1(C(=O)NCCC2CC[NH+](Cc3ccsc3)CC2)CCC1 ZINC001438457188 1388622355 /nfs/dbraw/zinc/62/23/55/1388622355.db2.gz ATTXECUVOVHCBV-UHFFFAOYSA-N 1 3 349.544 2.951 10 0 EFAEHO C[NH+]1CCC2(CCN([C@@H]3CCCN(c4ccccc4)C3=O)CC2)CC1 ZINC001422143446 1379679462 /nfs/dbraw/zinc/67/94/62/1379679462.db2.gz MUOVLYASBQRVAM-LJQANCHMSA-N 1 3 341.499 2.990 10 0 EFAEHO CN(CC[N@H+](C)Cc1ccc(C2CCC2)cc1)C(=O)[C@@H]1CCCN1C ZINC001422152466 1379692945 /nfs/dbraw/zinc/69/29/45/1379692945.db2.gz LSYJNNJWLRQQFI-FQEVSTJZSA-N 1 3 343.515 2.939 10 0 EFAEHO CN(CC[N@@H+](C)Cc1ccc(C2CCC2)cc1)C(=O)[C@@H]1CCCN1C ZINC001422152466 1379692960 /nfs/dbraw/zinc/69/29/60/1379692960.db2.gz LSYJNNJWLRQQFI-FQEVSTJZSA-N 1 3 343.515 2.939 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001422158438 1379700769 /nfs/dbraw/zinc/70/07/69/1379700769.db2.gz SEQRQKPMXPKQSI-SJORKVTESA-N 1 3 331.504 2.575 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(CC1)CC[NH+](C/C=C/Cl)CC2 ZINC001422184651 1379743301 /nfs/dbraw/zinc/74/33/01/1379743301.db2.gz NKVFOQQZJHCJIF-RUDMXATFSA-N 1 3 341.927 2.784 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(CC1)CC[NH+](CC1CCC1)CC2 ZINC001422186371 1379746965 /nfs/dbraw/zinc/74/69/65/1379746965.db2.gz WKJCEAUBRKFLRH-UHFFFAOYSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H]1CC[N@H+](CC(=O)N(C)CCN(C)Cc2ccc(C3CC3)cc2)C1 ZINC001422199932 1379760601 /nfs/dbraw/zinc/76/06/01/1379760601.db2.gz LOCWQYUENHFEPS-KRWDZBQOSA-N 1 3 343.515 2.796 10 0 EFAEHO C[C@H]1CC[N@@H+](CC(=O)N(C)CCN(C)Cc2ccc(C3CC3)cc2)C1 ZINC001422199932 1379760612 /nfs/dbraw/zinc/76/06/12/1379760612.db2.gz LOCWQYUENHFEPS-KRWDZBQOSA-N 1 3 343.515 2.796 10 0 EFAEHO CC(C)CCC[N@H+](C)C[C@@H]1CCCN1C(=O)[C@H](C(C)C)N(C)C ZINC001422236619 1379830732 /nfs/dbraw/zinc/83/07/32/1379830732.db2.gz XGSVJPRCFSNHKS-ROUUACIJSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)CCC[N@@H+](C)C[C@@H]1CCCN1C(=O)[C@H](C(C)C)N(C)C ZINC001422236619 1379830738 /nfs/dbraw/zinc/83/07/38/1379830738.db2.gz XGSVJPRCFSNHKS-ROUUACIJSA-N 1 3 325.541 2.932 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[N@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001422247531 1379854089 /nfs/dbraw/zinc/85/40/89/1379854089.db2.gz OQPSTXSPMLPVEZ-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001422247531 1379854094 /nfs/dbraw/zinc/85/40/94/1379854094.db2.gz OQPSTXSPMLPVEZ-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC2CC(NC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001422267261 1379883702 /nfs/dbraw/zinc/88/37/02/1379883702.db2.gz RVFSHKUYEDTCBT-UHFFFAOYSA-N 1 3 343.515 2.772 10 0 EFAEHO C[C@H]([NH2+]CC1CC(NC(=O)C2(N(C)C)CCC2)C1)c1ccc(F)cc1 ZINC001422268544 1379886144 /nfs/dbraw/zinc/88/61/44/1379886144.db2.gz VNUAPDVSXZEDJF-SYJJWHGVSA-N 1 3 347.478 2.855 10 0 EFAEHO Cc1cc(C[NH2+]CC2CC(NC(=O)CN(C)C3CCC3)C2)c(C)s1 ZINC001422270296 1379886826 /nfs/dbraw/zinc/88/68/26/1379886826.db2.gz ZSHSIDNZUYEWCY-UHFFFAOYSA-N 1 3 349.544 2.834 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]Cc2ccc(C)c(C)c2)C1 ZINC001422295160 1379904203 /nfs/dbraw/zinc/90/42/03/1379904203.db2.gz QBGJBUMLYLIZCT-UHFFFAOYSA-N 1 3 331.504 2.630 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)[C@@H](C)NC(=O)CC2CC[NH+](C)CC2)c1 ZINC001422380164 1380009005 /nfs/dbraw/zinc/00/90/05/1380009005.db2.gz QLDBNJLKOSODPM-JKSUJKDBSA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@@H](NC(=O)CC1CC[NH+](C)CC1)[C@H](C)NCc1ccccc1F ZINC001422381648 1380011218 /nfs/dbraw/zinc/01/12/18/1380011218.db2.gz SUTRMCUDIQWRDG-LSDHHAIUSA-N 1 3 335.467 2.540 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)[C@@H](C)NCc1ccc(Cl)cc1F ZINC001422413421 1380056408 /nfs/dbraw/zinc/05/64/08/1380056408.db2.gz YLNOQOZCXRVGAX-CHWSQXEVSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)[C@@H](C)NCc1ccc(Cl)cc1F ZINC001422413421 1380056416 /nfs/dbraw/zinc/05/64/16/1380056416.db2.gz YLNOQOZCXRVGAX-CHWSQXEVSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1CCC(N(C)C(=O)CN2CCC(C)CC2)CC1 ZINC001422420360 1380065490 /nfs/dbraw/zinc/06/54/90/1380065490.db2.gz JFHJIYROTPNBAP-WWDZGPRUSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001422421482 1380069862 /nfs/dbraw/zinc/06/98/62/1380069862.db2.gz ALFUMFLQFSYNPA-KSSFIOAISA-N 1 3 335.467 2.638 10 0 EFAEHO OC1(C[NH+]2CCCCC2)CCN(Cc2ccc3c(c2)CCC3)CC1 ZINC001422440535 1380103605 /nfs/dbraw/zinc/10/36/05/1380103605.db2.gz PCQWFWYLMXMLGQ-UHFFFAOYSA-N 1 3 328.500 2.988 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC001422451916 1380124050 /nfs/dbraw/zinc/12/40/50/1380124050.db2.gz OJVUYPYXCJMUFE-HZPDHXFCSA-N 1 3 342.487 2.558 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC001422451913 1380124406 /nfs/dbraw/zinc/12/44/06/1380124406.db2.gz OJVUYPYXCJMUFE-CVEARBPZSA-N 1 3 342.487 2.558 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001422521198 1380246754 /nfs/dbraw/zinc/24/67/54/1380246754.db2.gz FJQHWFRFWMXIOD-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001422521198 1380246758 /nfs/dbraw/zinc/24/67/58/1380246758.db2.gz FJQHWFRFWMXIOD-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO COc1ccc(CN(C)[C@@H](C)CNC(=O)CC[C@H]2CCC[N@@H+]2C)cc1 ZINC001422530959 1380266311 /nfs/dbraw/zinc/26/63/11/1380266311.db2.gz UTWQRTJEQXOATQ-FUHWJXTLSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1ccc(CN(C)[C@@H](C)CNC(=O)CC[C@H]2CCC[N@H+]2C)cc1 ZINC001422530959 1380266314 /nfs/dbraw/zinc/26/63/14/1380266314.db2.gz UTWQRTJEQXOATQ-FUHWJXTLSA-N 1 3 347.503 2.506 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[N@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001422550138 1380302326 /nfs/dbraw/zinc/30/23/26/1380302326.db2.gz YBRHUHXYQUOMMR-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC001422550138 1380302327 /nfs/dbraw/zinc/30/23/27/1380302327.db2.gz YBRHUHXYQUOMMR-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C(F)F)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001422551379 1380304280 /nfs/dbraw/zinc/30/42/80/1380304280.db2.gz VOFMRBJNCPCDRG-UONOGXRCSA-N 1 3 339.430 2.560 10 0 EFAEHO CCCc1ccc(C[N@H+](C)[C@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001422563217 1380331079 /nfs/dbraw/zinc/33/10/79/1380331079.db2.gz POYOLCBOFVMVTP-ZWKOTPCHSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(C[N@@H+](C)[C@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1 ZINC001422563217 1380331080 /nfs/dbraw/zinc/33/10/80/1380331080.db2.gz POYOLCBOFVMVTP-ZWKOTPCHSA-N 1 3 345.531 2.917 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@H](C)[N@H+](C)Cc1ccc(F)cc1C ZINC001422595971 1380394852 /nfs/dbraw/zinc/39/48/52/1380394852.db2.gz DNYZJJFKQYEWQB-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NC[C@H](C)[N@@H+](C)Cc1ccc(F)cc1C ZINC001422595971 1380394855 /nfs/dbraw/zinc/39/48/55/1380394855.db2.gz DNYZJJFKQYEWQB-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)N(C)C/C=C/c1ccc(Cl)cc1 ZINC001422603834 1380407440 /nfs/dbraw/zinc/40/74/40/1380407440.db2.gz QLTSWIAYCKLWMI-GWOVIKRFSA-N 1 3 349.906 2.741 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)N(C)C/C=C/c1ccc(Cl)cc1 ZINC001422603834 1380407442 /nfs/dbraw/zinc/40/74/42/1380407442.db2.gz QLTSWIAYCKLWMI-GWOVIKRFSA-N 1 3 349.906 2.741 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@H+](C)C1)N(C)C/C=C/c1ccc(Cl)cc1 ZINC001422603840 1380407457 /nfs/dbraw/zinc/40/74/57/1380407457.db2.gz QLTSWIAYCKLWMI-LUJIMGINSA-N 1 3 349.906 2.741 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)N(C)C/C=C/c1ccc(Cl)cc1 ZINC001422603840 1380407459 /nfs/dbraw/zinc/40/74/59/1380407459.db2.gz QLTSWIAYCKLWMI-LUJIMGINSA-N 1 3 349.906 2.741 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)C2CC[NH+](C)CC2)c(Cl)c1 ZINC001422696879 1380620541 /nfs/dbraw/zinc/62/05/41/1380620541.db2.gz ORRHQJKRYBNDRN-AWEZNQCLSA-N 1 3 337.895 2.585 10 0 EFAEHO C[C@H](NC(=O)CC[NH+](C)C)C1CN([C@@H](C)c2ccc3c(c2)CCC3)C1 ZINC001422736711 1380736061 /nfs/dbraw/zinc/73/60/61/1380736061.db2.gz WQOQETLKCLYEHH-HOTGVXAUSA-N 1 3 343.515 2.625 10 0 EFAEHO Cc1ccc(CN2CC([C@H](C)NC(=O)C(C)(C)[NH+]3CCCC3)C2)cc1 ZINC001422743708 1380745417 /nfs/dbraw/zinc/74/54/17/1380745417.db2.gz RIYBIQBTIGBQOB-KRWDZBQOSA-N 1 3 343.515 2.806 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](CC3CC(C)(C)C3)C[C@@H]2C1 ZINC001422863079 1380961413 /nfs/dbraw/zinc/96/14/13/1380961413.db2.gz CAJDOFCOLNJIJE-GBESFXJTSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CC3CC(C)(C)C3)C[C@@H]2C1 ZINC001422863079 1380961416 /nfs/dbraw/zinc/96/14/16/1380961416.db2.gz CAJDOFCOLNJIJE-GBESFXJTSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](CC3CC(C)(C)C3)C[C@H]2C1 ZINC001422863101 1380962363 /nfs/dbraw/zinc/96/23/63/1380962363.db2.gz CAJDOFCOLNJIJE-GUDVDZBRSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](CC3CC(C)(C)C3)C[C@H]2C1 ZINC001422863101 1380962365 /nfs/dbraw/zinc/96/23/65/1380962365.db2.gz CAJDOFCOLNJIJE-GUDVDZBRSA-N 1 3 349.563 2.980 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CCCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001422878687 1380990170 /nfs/dbraw/zinc/99/01/70/1380990170.db2.gz XVFOKBQXJBUFNV-MRXNPFEDSA-N 1 3 341.515 2.637 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CCCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001422878687 1380990178 /nfs/dbraw/zinc/99/01/78/1380990178.db2.gz XVFOKBQXJBUFNV-MRXNPFEDSA-N 1 3 341.515 2.637 10 0 EFAEHO CCc1ccc(C[N@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001422880312 1380993541 /nfs/dbraw/zinc/99/35/41/1380993541.db2.gz SKWPCKLICSVTQC-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1ccc(C[N@@H+](C)C[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001422880312 1380993547 /nfs/dbraw/zinc/99/35/47/1380993547.db2.gz SKWPCKLICSVTQC-IRXDYDNUSA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@@H](CN(C)Cc1cc2ccccc2s1)NC(=O)CC[NH+](C)C ZINC001422883285 1381000369 /nfs/dbraw/zinc/00/03/69/1381000369.db2.gz HIHVRKYCNNRNNK-AWEZNQCLSA-N 1 3 333.501 2.790 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@H](CC)N(C)C)C2)c1 ZINC001422912529 1381041921 /nfs/dbraw/zinc/04/19/21/1381041921.db2.gz WZDSHPFJMWTKIP-FHWLQOOXSA-N 1 3 331.504 2.574 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC2(CN(Cc3ccc(CF)cc3)C2)CC1 ZINC001438610122 1388695973 /nfs/dbraw/zinc/69/59/73/1388695973.db2.gz LTAHDYGDAWEUJT-UHFFFAOYSA-N 1 3 347.478 2.532 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@@H]2CCc3ccc(F)cc32)C1 ZINC001422922034 1381062143 /nfs/dbraw/zinc/06/21/43/1381062143.db2.gz YCABNJGJIOGABW-LSBZLQRGSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCCC[C@@H]1C[NH2+]CC1CC(F)(F)C1 ZINC001422929600 1381078577 /nfs/dbraw/zinc/07/85/77/1381078577.db2.gz DWHYMWBDFUFLDM-HZPDHXFCSA-N 1 3 345.478 2.637 10 0 EFAEHO CN(C/C=C/Cl)C1CCN(C(=O)[C@H]2CCC[C@@H]([NH+](C)C)C2)CC1 ZINC001422932806 1381085009 /nfs/dbraw/zinc/08/50/09/1381085009.db2.gz NBXQSNFWAWGVMH-XLUSBLNCSA-N 1 3 341.927 2.782 10 0 EFAEHO c1nc(CN2CCC(CCC[NH+]3CCOCC3)CC2)cn1C1CC1 ZINC001423051997 1381274322 /nfs/dbraw/zinc/27/43/22/1381274322.db2.gz QYQAODJDFGHLNY-UHFFFAOYSA-N 1 3 332.492 2.542 10 0 EFAEHO CC(C)c1cccc(CN[C@@H](C)CN(C)C(=O)[C@H](C(C)C)[NH+](C)C)n1 ZINC001423157248 1381464051 /nfs/dbraw/zinc/46/40/51/1381464051.db2.gz KBQAXBBPCSKDCX-LPHOPBHVSA-N 1 3 348.535 2.728 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3ccc(C)c(F)c3)CC2)CC[N@@H+]1C ZINC001423224145 1381620056 /nfs/dbraw/zinc/62/00/56/1381620056.db2.gz VKPURPDSBFBWQK-FUHWJXTLSA-N 1 3 347.478 2.603 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCC2(NCc3ccc(C)c(F)c3)CC2)CC[N@H+]1C ZINC001423224145 1381620068 /nfs/dbraw/zinc/62/00/68/1381620068.db2.gz VKPURPDSBFBWQK-FUHWJXTLSA-N 1 3 347.478 2.603 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+]CC2CC3(CCC3)C2)CC1 ZINC001423227587 1381622956 /nfs/dbraw/zinc/62/29/56/1381622956.db2.gz JBXFSUIRVJCGBY-QGZVFWFLSA-N 1 3 333.520 2.680 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001423245697 1381673064 /nfs/dbraw/zinc/67/30/64/1381673064.db2.gz PEFODGZOBHGFTP-ROUUACIJSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2ccc(F)cc2)CC1)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001423245697 1381673096 /nfs/dbraw/zinc/67/30/96/1381673096.db2.gz PEFODGZOBHGFTP-ROUUACIJSA-N 1 3 345.462 2.581 10 0 EFAEHO Cc1ccc(F)cc1CNC1(CNC(=O)CC[C@@H]2CCC[N@H+]2C)CC1 ZINC001423246967 1381678016 /nfs/dbraw/zinc/67/80/16/1381678016.db2.gz ZZFWWPFVOZIDLK-SFHVURJKSA-N 1 3 347.478 2.747 10 0 EFAEHO Cc1ccc(F)cc1CNC1(CNC(=O)CC[C@@H]2CCC[N@@H+]2C)CC1 ZINC001423246967 1381678041 /nfs/dbraw/zinc/67/80/41/1381678041.db2.gz ZZFWWPFVOZIDLK-SFHVURJKSA-N 1 3 347.478 2.747 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccsc1)N(C)C(=O)CN(C)CC(C)(C)C ZINC001438679128 1388735009 /nfs/dbraw/zinc/73/50/09/1388735009.db2.gz GACBBNBBVLIGEG-CQSZACIVSA-N 1 3 325.522 2.663 10 0 EFAEHO C[C@H](NC1(CNC(=O)CC2CC[NH+](C)CC2)CC1)c1ccc(F)cc1 ZINC001423289436 1381747542 /nfs/dbraw/zinc/74/75/42/1381747542.db2.gz RVPKTKUORZUEOE-HNNXBMFYSA-N 1 3 347.478 2.857 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C2CCC2)cc1)N(C)C(=O)Cc1c[nH]cn1 ZINC001438691728 1388742342 /nfs/dbraw/zinc/74/23/42/1388742342.db2.gz JMUOCIOLSHRDHP-HNNXBMFYSA-N 1 3 340.471 2.856 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)[C@H]2C)c(C)s1 ZINC001423328769 1381792571 /nfs/dbraw/zinc/79/25/71/1381792571.db2.gz MZDOBFYUVTUVII-WMLDXEAASA-N 1 3 337.533 2.784 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C/C=C/Cl)CC2CC2)CC1 ZINC001423335531 1381802626 /nfs/dbraw/zinc/80/26/26/1381802626.db2.gz CCUKOYUKAYJKLR-RUDMXATFSA-N 1 3 341.927 2.782 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C/C=C/Cl)CC2CC2)CC1 ZINC001423335531 1381802630 /nfs/dbraw/zinc/80/26/30/1381802630.db2.gz CCUKOYUKAYJKLR-RUDMXATFSA-N 1 3 341.927 2.782 10 0 EFAEHO CC[C@H](C(=O)N[C@]12CCC[C@@H]1[N@H+](CCCF)CC2)N(CC)CC ZINC001423344231 1381815434 /nfs/dbraw/zinc/81/54/34/1381815434.db2.gz DTNUISUCFXYOJJ-RYRKJORJSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H](C(=O)N[C@]12CCC[C@@H]1[N@@H+](CCCF)CC2)N(CC)CC ZINC001423344231 1381815441 /nfs/dbraw/zinc/81/54/41/1381815441.db2.gz DTNUISUCFXYOJJ-RYRKJORJSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]Cc2cc3ccccc3o2)C[C@@H]1C ZINC001423353086 1381830407 /nfs/dbraw/zinc/83/04/07/1381830407.db2.gz JYDKZVWGTFMUBH-RDJZCZTQSA-N 1 3 343.471 2.852 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]Cc2cc3ccccc3o2)C[C@H]1C ZINC001423353088 1381831625 /nfs/dbraw/zinc/83/16/25/1381831625.db2.gz JYDKZVWGTFMUBH-WBVHZDCISA-N 1 3 343.471 2.852 10 0 EFAEHO C[C@H](NC[C@H](C)N(C)C(=O)CC[NH+](C)C)c1ccccc1Cl ZINC001438696620 1388745528 /nfs/dbraw/zinc/74/55/28/1388745528.db2.gz VZTRGKMTLBZONL-KBPBESRZSA-N 1 3 325.884 2.789 10 0 EFAEHO C[C@H](CN[C@@H](C)c1ccccc1Cl)N(C)C(=O)CC[NH+](C)C ZINC001438696624 1388745765 /nfs/dbraw/zinc/74/57/65/1388745765.db2.gz VZTRGKMTLBZONL-KGLIPLIRSA-N 1 3 325.884 2.789 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001423407309 1381915887 /nfs/dbraw/zinc/91/58/87/1381915887.db2.gz VALSBYBHJKAEQG-HZPDHXFCSA-N 1 3 325.541 2.837 10 0 EFAEHO CN(C(=O)CC[NH+]1CCCCC1)C1CN(CC2CCCCCC2)C1 ZINC001423445900 1381950836 /nfs/dbraw/zinc/95/08/36/1381950836.db2.gz DNTFXNADOQQDSX-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]1C[NH2+]Cc1ccc2c(c1)CCC2 ZINC001423483282 1381975685 /nfs/dbraw/zinc/97/56/85/1381975685.db2.gz QRMBDJZDRGZYMU-FQEVSTJZSA-N 1 3 343.515 2.596 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]Cc1ccccc1C1CC1 ZINC001438715073 1388758308 /nfs/dbraw/zinc/75/83/08/1388758308.db2.gz ONNXDGDKLDDYBF-MRXNPFEDSA-N 1 3 331.504 2.841 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]CC3CC4(CCC4)C3)C2)C1 ZINC001423624655 1382186567 /nfs/dbraw/zinc/18/65/67/1382186567.db2.gz CNFZDDRZVIOZBQ-PXNSSMCTSA-N 1 3 347.547 2.737 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1CC[NH+](Cc2ccsc2)CC1 ZINC001423652922 1382227995 /nfs/dbraw/zinc/22/79/95/1382227995.db2.gz GZBQIRCQRKYXON-OAHLLOKOSA-N 1 3 337.533 2.805 10 0 EFAEHO CCc1ccccc1CC[NH2+]C1CC(N(C)C(=O)[C@@H](CC)N(C)C)C1 ZINC001423672000 1382259369 /nfs/dbraw/zinc/25/93/69/1382259369.db2.gz BICJBPUSJIXNJI-SOAGJPPSSA-N 1 3 345.531 2.711 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N(C)C1CC(NCC=C(Cl)Cl)C1 ZINC001423688464 1382293410 /nfs/dbraw/zinc/29/34/10/1382293410.db2.gz PYSIZFVCLOEOGB-RUXDESIVSA-N 1 3 348.318 2.759 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N(C)C1CC(NCC=C(Cl)Cl)C1 ZINC001423688464 1382293415 /nfs/dbraw/zinc/29/34/15/1382293415.db2.gz PYSIZFVCLOEOGB-RUXDESIVSA-N 1 3 348.318 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@]1(C)CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001423704053 1382322502 /nfs/dbraw/zinc/32/25/02/1382322502.db2.gz KQRMFBVXRXLFEY-FQEVSTJZSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@]1(C)CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001423704053 1382322510 /nfs/dbraw/zinc/32/25/10/1382322510.db2.gz KQRMFBVXRXLFEY-FQEVSTJZSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@H](C(=O)NC[C@]1(C)CCC[N@H+](CCCF)C1)N1CCCCCC1 ZINC001423705832 1382324883 /nfs/dbraw/zinc/32/48/83/1382324883.db2.gz RECBZZLJMKGTFX-MJGOQNOKSA-N 1 3 341.515 2.829 10 0 EFAEHO C[C@H](C(=O)NC[C@]1(C)CCC[N@@H+](CCCF)C1)N1CCCCCC1 ZINC001423705832 1382324885 /nfs/dbraw/zinc/32/48/85/1382324885.db2.gz RECBZZLJMKGTFX-MJGOQNOKSA-N 1 3 341.515 2.829 10 0 EFAEHO CC[NH2+]C[C@@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CCCCC1 ZINC001438745216 1388782720 /nfs/dbraw/zinc/78/27/20/1388782720.db2.gz IQWQSTVEJVNVJY-APWZRJJASA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccc(F)cc1)C2 ZINC001423934915 1382517694 /nfs/dbraw/zinc/51/76/94/1382517694.db2.gz WHTLYNWUJZKWJX-WDSOQIARSA-N 1 3 347.478 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccc(F)cc1)C2 ZINC001423934915 1382517698 /nfs/dbraw/zinc/51/76/98/1382517698.db2.gz WHTLYNWUJZKWJX-WDSOQIARSA-N 1 3 347.478 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CCCCC1)C2 ZINC001423937790 1382522490 /nfs/dbraw/zinc/52/24/90/1382522490.db2.gz YSQFLSHOXUOMEE-OTWHNJEPSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CC1CCCCC1)C2 ZINC001423937790 1382522492 /nfs/dbraw/zinc/52/24/92/1382522492.db2.gz YSQFLSHOXUOMEE-OTWHNJEPSA-N 1 3 335.536 2.876 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c(C)c1 ZINC001423947881 1382533470 /nfs/dbraw/zinc/53/34/70/1382533470.db2.gz LSFODAVDRDDWQS-AZUAARDMSA-N 1 3 345.531 2.828 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H](C)[NH2+]Cc2ccccc2)C1 ZINC001438760674 1388791444 /nfs/dbraw/zinc/79/14/44/1388791444.db2.gz BFGTXSZBKYVPAJ-HKUYNNGSSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H](C)[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001423951139 1382539150 /nfs/dbraw/zinc/53/91/50/1382539150.db2.gz KCNPWELLFZHCEC-SJORKVTESA-N 1 3 349.494 2.801 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@@H]1C[NH2+]Cc1ccccc1 ZINC001438771840 1388800817 /nfs/dbraw/zinc/80/08/17/1388800817.db2.gz YGIYLHKNSYMADC-MJGOQNOKSA-N 1 3 331.504 2.744 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2CCCCN2C(=O)CN(C)C(C)C)cc1F ZINC001424143707 1382791367 /nfs/dbraw/zinc/79/13/67/1382791367.db2.gz XTANWEYRSKIASJ-GOSISDBHSA-N 1 3 349.494 2.945 10 0 EFAEHO CN(CCCN(C)C(=O)[C@H]1CCC[C@@H]2CCC[N@@H+]21)CCC(F)(F)F ZINC001424325255 1382935883 /nfs/dbraw/zinc/93/58/83/1382935883.db2.gz DNDVOAXTGSGUOU-HUUCEWRRSA-N 1 3 349.441 2.736 10 0 EFAEHO CN(CCCN(C)C(=O)[C@H]1CCC[C@@H]2CCC[N@H+]21)CCC(F)(F)F ZINC001424325255 1382935891 /nfs/dbraw/zinc/93/58/91/1382935891.db2.gz DNDVOAXTGSGUOU-HUUCEWRRSA-N 1 3 349.441 2.736 10 0 EFAEHO C[C@H](c1ccc(F)cc1)[N@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001424333555 1382948438 /nfs/dbraw/zinc/94/84/38/1382948438.db2.gz XMGVUAPZYDXLMZ-MRXNPFEDSA-N 1 3 335.467 2.763 10 0 EFAEHO C[C@H](c1ccc(F)cc1)[N@@H+](C)CCCN(C)C(=O)CN1CCCC1 ZINC001424333555 1382948444 /nfs/dbraw/zinc/94/84/44/1382948444.db2.gz XMGVUAPZYDXLMZ-MRXNPFEDSA-N 1 3 335.467 2.763 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]Cc2ccccc2F)CC1 ZINC001424492413 1383047503 /nfs/dbraw/zinc/04/75/03/1383047503.db2.gz RFZPZWGIXLSPJA-UHFFFAOYSA-N 1 3 335.467 2.638 10 0 EFAEHO CC[C@H](F)C[NH2+][C@H](CNC(=O)C(C)(C)N1CCCCC1)C(C)C ZINC001438812647 1388836076 /nfs/dbraw/zinc/83/60/76/1388836076.db2.gz OCEVIXIRYUOILM-JKSUJKDBSA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H]2CC[N@H+](C/C=C/Cl)C2)C1 ZINC001424699430 1383271376 /nfs/dbraw/zinc/27/13/76/1383271376.db2.gz MRSCVKPFBZWXSL-DIYXLRBJSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@H]2CC[N@@H+](C/C=C/Cl)C2)C1 ZINC001424699430 1383271380 /nfs/dbraw/zinc/27/13/80/1383271380.db2.gz MRSCVKPFBZWXSL-DIYXLRBJSA-N 1 3 341.927 2.640 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)c(C)c1 ZINC001438825072 1388843320 /nfs/dbraw/zinc/84/33/20/1388843320.db2.gz COZYNPGYBQHCDX-YLJYHZDGSA-N 1 3 345.531 2.876 10 0 EFAEHO Cc1ccc(C[NH2+]CC2CC(NC(=O)[C@@H](C(C)C)N(C)C)C2)cc1C ZINC001424741814 1383310529 /nfs/dbraw/zinc/31/05/29/1383310529.db2.gz OENHQSXMXNSLQP-SOAGJPPSSA-N 1 3 345.531 2.874 10 0 EFAEHO C[C@H](NCc1sccc1Cl)[C@H](C)NC(=O)C1CC[NH+](C)CC1 ZINC001424803314 1383362942 /nfs/dbraw/zinc/36/29/42/1383362942.db2.gz JGGJSHJPCJPPJC-RYUDHWBXSA-N 1 3 343.924 2.726 10 0 EFAEHO C[C@H](NCc1cc(Cl)ccc1F)[C@H](C)NC(=O)CCC[NH+](C)C ZINC001424823432 1383383326 /nfs/dbraw/zinc/38/33/26/1383383326.db2.gz MFQVKGNDFKNNDI-STQMWFEESA-N 1 3 343.874 2.804 10 0 EFAEHO CCc1ccc(CC[NH2+][C@H](C)[C@H](C)NC(=O)Cc2nc[nH]c2C)cc1 ZINC001424831682 1383391776 /nfs/dbraw/zinc/39/17/76/1383391776.db2.gz GJNMEKBHOPIMSH-CABCVRRESA-N 1 3 342.487 2.549 10 0 EFAEHO C[C@H](NCc1sccc1Cl)[C@H](C)NC(=O)C1(C[NH+](C)C)CC1 ZINC001424838358 1383399053 /nfs/dbraw/zinc/39/90/53/1383399053.db2.gz YDOUNYKMNUOUOR-RYUDHWBXSA-N 1 3 343.924 2.726 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)[C@H](C)NCc1cc2ccccc2o1 ZINC001424844770 1383408397 /nfs/dbraw/zinc/40/83/97/1383408397.db2.gz UCYPKPFMLPFKLW-LSDHHAIUSA-N 1 3 331.460 2.757 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)[C@H](C)NCc1cc2ccccc2o1 ZINC001424844770 1383408400 /nfs/dbraw/zinc/40/84/00/1383408400.db2.gz UCYPKPFMLPFKLW-LSDHHAIUSA-N 1 3 331.460 2.757 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001424850804 1383415779 /nfs/dbraw/zinc/41/57/79/1383415779.db2.gz RKSWLMVPSISPJX-VXGBXAGGSA-N 1 3 331.913 2.726 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC(C)(C)C[NH2+]CC2CC(C)(C)C2)CCC1 ZINC001424877902 1383454882 /nfs/dbraw/zinc/45/48/82/1383454882.db2.gz OJMSVHQCGXKRIW-UHFFFAOYSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)[C@@H](C)CNC(=O)[C@@H]1CC[N@H+](C)C1 ZINC001425070596 1383516101 /nfs/dbraw/zinc/51/61/01/1383516101.db2.gz LKTRYFKWGAZHFM-GOEBONIOSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1cc(Cl)ccc1CN(C)[C@@H](C)CNC(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001425070596 1383516108 /nfs/dbraw/zinc/51/61/08/1383516108.db2.gz LKTRYFKWGAZHFM-GOEBONIOSA-N 1 3 337.895 2.537 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001425378302 1383637600 /nfs/dbraw/zinc/63/76/00/1383637600.db2.gz FANBCOKJFADUMH-XUVXKRRUSA-N 1 3 343.515 2.744 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001425378302 1383637604 /nfs/dbraw/zinc/63/76/04/1383637604.db2.gz FANBCOKJFADUMH-XUVXKRRUSA-N 1 3 343.515 2.744 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H]2C[N@H+](CC3CC3)C[C@H]2C1)CC(C)(C)C ZINC001425378349 1383637901 /nfs/dbraw/zinc/63/79/01/1383637901.db2.gz FBZACDYSCWVFIN-RCCFBDPRSA-N 1 3 335.536 2.591 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CC3CC3)C[C@H]2C1)CC(C)(C)C ZINC001425378349 1383637905 /nfs/dbraw/zinc/63/79/05/1383637905.db2.gz FBZACDYSCWVFIN-RCCFBDPRSA-N 1 3 335.536 2.591 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2ccc(C)c(C)c2)CC[N@@H+]1C ZINC001438872571 1388880778 /nfs/dbraw/zinc/88/07/78/1388880778.db2.gz OZPSMJKTCCGSNL-VQTJNVASSA-N 1 3 345.531 2.924 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)Cc2ccc(C)c(C)c2)CC[N@H+]1C ZINC001438872571 1388880782 /nfs/dbraw/zinc/88/07/82/1388880782.db2.gz OZPSMJKTCCGSNL-VQTJNVASSA-N 1 3 345.531 2.924 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@H]1C[C@@H](C)N(C(=O)CN(C)C(C)C)C1 ZINC001425882591 1383824690 /nfs/dbraw/zinc/82/46/90/1383824690.db2.gz DWDOKEVHACTGFX-XLIONFOSSA-N 1 3 345.531 2.711 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCN(C)C(=O)[C@H]2C[NH+]3CCC2CC3)c1 ZINC001438872906 1388881515 /nfs/dbraw/zinc/88/15/15/1388881515.db2.gz JEIIKCIOACILCP-FQEVSTJZSA-N 1 3 343.515 2.535 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@]23CCC[C@H]2N(Cc2ccsc2)CC3)CC1 ZINC001425904483 1383842730 /nfs/dbraw/zinc/84/27/30/1383842730.db2.gz JPOSXGCKVCTXSZ-APWZRJJASA-N 1 3 347.528 2.703 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc3cc[nH]c3c2)C[C@H]1C ZINC001425907762 1383844673 /nfs/dbraw/zinc/84/46/73/1383844673.db2.gz GZARSQBVDLSWDO-CRAIPNDOSA-N 1 3 342.487 2.589 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)CCCN1CCCF ZINC001425919456 1383855614 /nfs/dbraw/zinc/85/56/14/1383855614.db2.gz AWKPIYCHIXKHKY-NVXWUHKLSA-N 1 3 341.515 2.968 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)CCCN1CCCF ZINC001425919456 1383855616 /nfs/dbraw/zinc/85/56/16/1383855616.db2.gz AWKPIYCHIXKHKY-NVXWUHKLSA-N 1 3 341.515 2.968 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]C/C=C/c2ccccc2)C(C)(C)C1 ZINC001425979105 1383913896 /nfs/dbraw/zinc/91/38/96/1383913896.db2.gz UHWWUUNSWKRQJE-VSRDTVRMSA-N 1 3 343.515 2.867 10 0 EFAEHO CC(C)N(CC[N@H+](C)CC1CC2(CCC2)C1)C(=O)Cc1c[nH]cn1 ZINC001426119475 1383999286 /nfs/dbraw/zinc/99/92/86/1383999286.db2.gz RDVLTBZOUBSUOR-UHFFFAOYSA-N 1 3 332.492 2.701 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CC1CC2(CCC2)C1)C(=O)Cc1c[nH]cn1 ZINC001426119475 1383999293 /nfs/dbraw/zinc/99/92/93/1383999293.db2.gz RDVLTBZOUBSUOR-UHFFFAOYSA-N 1 3 332.492 2.701 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCN(C(=O)CC[NH+](C)C)C(C)C)c1 ZINC001426121741 1384003223 /nfs/dbraw/zinc/00/32/23/1384003223.db2.gz ZVNQETYUACJXEI-UHFFFAOYSA-N 1 3 333.520 2.924 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+]CC1CC(C)(C)C1)C(C)(C)C ZINC001426169913 1384043733 /nfs/dbraw/zinc/04/37/33/1384043733.db2.gz VNSBTPLLHWWKEO-MRXNPFEDSA-N 1 3 325.541 2.883 10 0 EFAEHO C[C@@H](NC(=O)[C@@H](C)N1CCCCCC1)C1CC[NH+](CC2CC2)CC1 ZINC001426185994 1384052768 /nfs/dbraw/zinc/05/27/68/1384052768.db2.gz RHXBJZIRFSWNCR-IAGOWNOFSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC(NCc2ncccc2C)C1)[NH+](CC)CC ZINC001426220195 1384080120 /nfs/dbraw/zinc/08/01/20/1384080120.db2.gz UVCXSAAZNSKXBO-TVPLGVNVSA-N 1 3 346.519 2.589 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC(NCc2ncccc2C)C1)[NH+](CC)CC ZINC001426220189 1384080286 /nfs/dbraw/zinc/08/02/86/1384080286.db2.gz UVCXSAAZNSKXBO-FAFZWHIHSA-N 1 3 346.519 2.589 10 0 EFAEHO C[C@@H](F)CC[NH2+]C1CC(N(C)C(=O)c2cccc(CN(C)C)c2)C1 ZINC001426236373 1384089346 /nfs/dbraw/zinc/08/93/46/1384089346.db2.gz DIRCSTMSLJFMKS-RWBZWWBESA-N 1 3 335.467 2.689 10 0 EFAEHO C[NH+](C)CCC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(Cl)cc2)C1 ZINC001438947204 1388944821 /nfs/dbraw/zinc/94/48/21/1388944821.db2.gz HHKZZFQXPHVQAK-FUHWJXTLSA-N 1 3 349.906 2.715 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H]1CN(Cc2ccc(CF)cc2)CC1(C)C ZINC001506753893 1406258486 /nfs/dbraw/zinc/25/84/86/1406258486.db2.gz WXVNJCPIVUXYTJ-GOSISDBHSA-N 1 3 349.494 2.825 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H]1CN(Cc2ccc(CF)cc2)CC1(C)C ZINC001506753893 1406258490 /nfs/dbraw/zinc/25/84/90/1406258490.db2.gz WXVNJCPIVUXYTJ-GOSISDBHSA-N 1 3 349.494 2.825 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCCC3CCC3)C[C@H]21)N1CCCC1 ZINC001506810546 1406292495 /nfs/dbraw/zinc/29/24/95/1406292495.db2.gz IPNDHVGQLPPVOD-LDLYASANSA-N 1 3 347.547 2.735 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1[C@H]2C[N@H+](CCCC3CCC3)C[C@H]21)N1CCCC1 ZINC001506810546 1406292502 /nfs/dbraw/zinc/29/25/02/1406292502.db2.gz IPNDHVGQLPPVOD-LDLYASANSA-N 1 3 347.547 2.735 10 0 EFAEHO C[NH+](C)[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC001433657576 1386943757 /nfs/dbraw/zinc/94/37/57/1386943757.db2.gz COVYZTYLPCUQJM-DLBZAZTESA-N 1 3 328.460 2.893 10 0 EFAEHO C[NH+](C)[C@@H]1C[C@@H](NC(=O)c2cccc(CN3CCCC3)c2)C1(C)C ZINC001434121576 1387098896 /nfs/dbraw/zinc/09/88/96/1387098896.db2.gz WUGZMSAKWPLGSH-QZTJIDSGSA-N 1 3 329.488 2.741 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)CNCc1ccccc1F)[NH+]1CCCCC1 ZINC001439283639 1389095010 /nfs/dbraw/zinc/09/50/10/1389095010.db2.gz DVHXZKINZIRIDJ-QFBILLFUSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)Cc1cccc(C(F)F)c1 ZINC001439400636 1389245436 /nfs/dbraw/zinc/24/54/36/1389245436.db2.gz ASTJTQSXAPTICT-AWEZNQCLSA-N 1 3 341.446 2.901 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC001439400636 1389245446 /nfs/dbraw/zinc/24/54/46/1389245446.db2.gz ASTJTQSXAPTICT-AWEZNQCLSA-N 1 3 341.446 2.901 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC1(C)CCN(Cc2ccc(C)nc2C)CC1 ZINC001439807827 1389339018 /nfs/dbraw/zinc/33/90/18/1389339018.db2.gz MVKSJJOOEPVHJZ-UHFFFAOYSA-N 1 3 346.519 2.511 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC1(C)CCN(Cc2ccc(C)nc2C)CC1 ZINC001439807827 1389339030 /nfs/dbraw/zinc/33/90/30/1389339030.db2.gz MVKSJJOOEPVHJZ-UHFFFAOYSA-N 1 3 346.519 2.511 10 0 EFAEHO CCCN(C)CC(=O)N(Cc1ccccn1)C1CC[NH+](C(C)C)CC1 ZINC001440128724 1389401907 /nfs/dbraw/zinc/40/19/07/1389401907.db2.gz SHECWKMHYIIAGB-UHFFFAOYSA-N 1 3 346.519 2.625 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001506866211 1406375224 /nfs/dbraw/zinc/37/52/24/1406375224.db2.gz RUHHRWWETDVGBS-PYTPGESOSA-N 1 3 333.520 2.609 10 0 EFAEHO CC/C=C\CC[N@H+]1CCCC2(CN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001506866211 1406375235 /nfs/dbraw/zinc/37/52/35/1406375235.db2.gz RUHHRWWETDVGBS-PYTPGESOSA-N 1 3 333.520 2.609 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2c(C)cccc2C)C1 ZINC001440137265 1389407002 /nfs/dbraw/zinc/40/70/02/1389407002.db2.gz QLCGRGYIUFPHJF-OALUTQOASA-N 1 3 345.531 2.829 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+]([C@H](C)c3cccc(F)c3)C[C@@H]2C1 ZINC001440151167 1389411123 /nfs/dbraw/zinc/41/11/23/1389411123.db2.gz OXNHKKFPAGPDND-NXHRZFHOSA-N 1 3 347.478 2.617 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+]([C@H](C)c3cccc(F)c3)C[C@@H]2C1 ZINC001440151167 1389411128 /nfs/dbraw/zinc/41/11/28/1389411128.db2.gz OXNHKKFPAGPDND-NXHRZFHOSA-N 1 3 347.478 2.617 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001506866213 1406375683 /nfs/dbraw/zinc/37/56/83/1406375683.db2.gz RUHHRWWETDVGBS-WRFKIARRSA-N 1 3 333.520 2.609 10 0 EFAEHO CC/C=C/CC[N@H+]1CCCC2(CN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001506866213 1406375696 /nfs/dbraw/zinc/37/56/96/1406375696.db2.gz RUHHRWWETDVGBS-WRFKIARRSA-N 1 3 333.520 2.609 10 0 EFAEHO CCCN(C)CC(=O)N1CCCCC[C@@H]([NH2+]Cc2cccnc2C)C1 ZINC001440464236 1389666116 /nfs/dbraw/zinc/66/61/16/1389666116.db2.gz IFOMQCZJBDFFQB-LJQANCHMSA-N 1 3 346.519 2.593 10 0 EFAEHO CN(CC(=O)N1CCCCC[C@@H]([NH2+]C/C=C/Cl)C1)C1CCC1 ZINC001440465646 1389668328 /nfs/dbraw/zinc/66/83/28/1389668328.db2.gz UVVKGRJDNWNJKK-WCLQSUPFSA-N 1 3 327.900 2.584 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CC3CC(C)(C)C3)CC[C@@H]2C1 ZINC001440478697 1389684937 /nfs/dbraw/zinc/68/49/37/1389684937.db2.gz ZLIWPYOFNYDRSM-MSOLQXFVSA-N 1 3 335.536 2.543 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CC3CC(C)(C)C3)CC[C@@H]2C1 ZINC001440478697 1389684940 /nfs/dbraw/zinc/68/49/40/1389684940.db2.gz ZLIWPYOFNYDRSM-MSOLQXFVSA-N 1 3 335.536 2.543 10 0 EFAEHO CCCC[C@H](C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CC)CC1 ZINC001440483434 1389689024 /nfs/dbraw/zinc/68/90/24/1389689024.db2.gz NSNSITBNGLCVOJ-YTQUADARSA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)CN1Cc2ccccc2C[C@@H]1CNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001440544881 1389746437 /nfs/dbraw/zinc/74/64/37/1389746437.db2.gz QSBATEDIQDJUNC-YLJYHZDGSA-N 1 3 343.515 2.527 10 0 EFAEHO CC(C)CN1Cc2ccccc2C[C@@H]1CNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001440544881 1389746443 /nfs/dbraw/zinc/74/64/43/1389746443.db2.gz QSBATEDIQDJUNC-YLJYHZDGSA-N 1 3 343.515 2.527 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]CCc2ccccc2)CC1 ZINC001440607618 1389771270 /nfs/dbraw/zinc/77/12/70/1389771270.db2.gz ZGZHOORTLSVLSC-UHFFFAOYSA-N 1 3 331.504 2.542 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001440619327 1389777932 /nfs/dbraw/zinc/77/79/32/1389777932.db2.gz KFPJGJROEBVBAF-DLBZAZTESA-N 1 3 337.552 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H]1CC[N@@H+](CC2CC(C)(C)C2)CC1(C)C)N(C)C ZINC001440619327 1389777934 /nfs/dbraw/zinc/77/79/34/1389777934.db2.gz KFPJGJROEBVBAF-DLBZAZTESA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CCc2cccs2)[C@@H](C)C1 ZINC001440652958 1389799604 /nfs/dbraw/zinc/79/96/04/1389799604.db2.gz OINQYGRKNRGQCD-HOTGVXAUSA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CCc2cccs2)[C@@H](C)C1 ZINC001440652958 1389799607 /nfs/dbraw/zinc/79/96/07/1389799607.db2.gz OINQYGRKNRGQCD-HOTGVXAUSA-N 1 3 337.533 2.600 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C\Cl ZINC001440659388 1389805871 /nfs/dbraw/zinc/80/58/71/1389805871.db2.gz VKXCQDSHDQXMIJ-LACBQNOSSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)NCC[C@H](C)NC/C(Cl)=C\Cl ZINC001440659388 1389805877 /nfs/dbraw/zinc/80/58/77/1389805877.db2.gz VKXCQDSHDQXMIJ-LACBQNOSSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001506882928 1406400635 /nfs/dbraw/zinc/40/06/35/1406400635.db2.gz ASRHJRTZWVQLSF-NGXPVIQVSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001506882928 1406400640 /nfs/dbraw/zinc/40/06/40/1406400640.db2.gz ASRHJRTZWVQLSF-NGXPVIQVSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001506882929 1406400961 /nfs/dbraw/zinc/40/09/61/1406400961.db2.gz ASRHJRTZWVQLSF-RLKXXBDZSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@H]1C[C@H](CNC/C(Cl)=C/Cl)C1 ZINC001506882929 1406400965 /nfs/dbraw/zinc/40/09/65/1406400965.db2.gz ASRHJRTZWVQLSF-RLKXXBDZSA-N 1 3 348.318 2.663 10 0 EFAEHO CC[N@H+](C/C=C\Cl)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001440707576 1389830522 /nfs/dbraw/zinc/83/05/22/1389830522.db2.gz SZRBFUQSRFMYRS-TWGQIWQCSA-N 1 3 329.916 2.640 10 0 EFAEHO CC[N@@H+](C/C=C\Cl)CC1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001440707576 1389830525 /nfs/dbraw/zinc/83/05/25/1389830525.db2.gz SZRBFUQSRFMYRS-TWGQIWQCSA-N 1 3 329.916 2.640 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN1CC[C@H](C)C1 ZINC001440722726 1389840889 /nfs/dbraw/zinc/84/08/89/1389840889.db2.gz UKWRKCAYTUCRHB-LDQXTDLNSA-N 1 3 343.515 2.746 10 0 EFAEHO CC[C@@H](C)C[NH2+]CC1CC(NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001440764541 1389877585 /nfs/dbraw/zinc/87/75/85/1389877585.db2.gz VFLSMAPUBQUAJO-LSJNQWAISA-N 1 3 331.504 2.892 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC1CC(NC(=O)CN(C)C(C)C)C1 ZINC001440765137 1389878807 /nfs/dbraw/zinc/87/88/07/1389878807.db2.gz ZBQIUZBTBCQDAA-UHFFFAOYSA-N 1 3 331.504 2.628 10 0 EFAEHO Cc1cncc(C[NH2+][C@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCCC2)c1 ZINC001440787534 1389896920 /nfs/dbraw/zinc/89/69/20/1389896920.db2.gz MHSSARILTIKZOZ-IAGOWNOFSA-N 1 3 346.519 2.637 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001440804462 1389910352 /nfs/dbraw/zinc/91/03/52/1389910352.db2.gz YNSQUOKQOBOVLI-HUUCEWRRSA-N 1 3 343.471 2.900 10 0 EFAEHO CC(C)c1cccc(CN[C@H](C)[C@H](C)NC(=O)C2(C[NH+](C)C)CC2)n1 ZINC001440826030 1389929023 /nfs/dbraw/zinc/92/90/23/1389929023.db2.gz ZFWKTBWRMWPGKS-CVEARBPZSA-N 1 3 346.519 2.530 10 0 EFAEHO C[C@H](CNC(=O)[C@H]1C[NH+]2CCC1CC2)N(C)Cc1cccc(Cl)c1 ZINC001440925140 1390012157 /nfs/dbraw/zinc/01/21/57/1390012157.db2.gz LVNMXDVEBYBOMD-KDOFPFPSSA-N 1 3 349.906 2.618 10 0 EFAEHO CCc1cccc(CN(C)[C@@H](C)CNC(=O)[C@@H]2C[NH+]3CCC2CC3)c1 ZINC001440926087 1390014626 /nfs/dbraw/zinc/01/46/26/1390014626.db2.gz QDYBKHGHLHGGQC-OXJNMPFZSA-N 1 3 343.515 2.527 10 0 EFAEHO CC[C@H]([NH2+]C[C@H]1C[C@H](NC(=O)CN2CC[C@@H](C)C2)C1)c1ccccc1 ZINC001506897063 1406414532 /nfs/dbraw/zinc/41/45/32/1406414532.db2.gz IMTYIMSZJAIXHK-LFGUQSLTSA-N 1 3 343.515 2.964 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]C[C@@H]2CCCC(F)(F)C2)C1 ZINC001506903855 1406421793 /nfs/dbraw/zinc/42/17/93/1406421793.db2.gz ROOULDAMFWNELX-BZUAXINKSA-N 1 3 345.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@H]2CCCc3ccccc32)C1 ZINC001506906158 1406424206 /nfs/dbraw/zinc/42/42/06/1406424206.db2.gz HTIRLQDPZXWUSH-QRFRQXIXSA-N 1 3 343.515 2.889 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CC[NH+](C[C@H]2CCC(F)(F)C2)CC1 ZINC001441008200 1391029110 /nfs/dbraw/zinc/02/91/10/1391029110.db2.gz PAMUBBWFJMWWBW-HNNXBMFYSA-N 1 3 345.478 2.686 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@H]1CCCCCN1Cc1cccc(F)c1 ZINC001441124806 1391118707 /nfs/dbraw/zinc/11/87/07/1391118707.db2.gz CLXWRIUAOLMSTO-GOSISDBHSA-N 1 3 335.467 2.638 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+]Cc1ccccc1C ZINC001506946883 1406482801 /nfs/dbraw/zinc/48/28/01/1406482801.db2.gz SEUDUJXWVJMDQW-OAHLLOKOSA-N 1 3 328.460 2.644 10 0 EFAEHO C[C@H](C(=O)N[C@@H](C)C1CN(Cc2ccccc2)C1)[NH+]1CCCCCC1 ZINC001441177981 1391161766 /nfs/dbraw/zinc/16/17/66/1391161766.db2.gz BJSALROTQUTHPV-ZWKOTPCHSA-N 1 3 343.515 2.888 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)CCC[NH2+][C@H]1CCc2ccccc21 ZINC001506947439 1406483942 /nfs/dbraw/zinc/48/39/42/1406483942.db2.gz YPAABMTYNWPOMA-KDOFPFPSSA-N 1 3 340.471 2.823 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H]([NH2+]CC1CCCC1)C1CC1 ZINC001441231822 1391199238 /nfs/dbraw/zinc/19/92/38/1391199238.db2.gz GFEPQQUZCJPMKO-RBUKOAKNSA-N 1 3 335.536 2.924 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@H+](CCC(C)(C)C)C[C@H]2C1 ZINC001441343377 1391261567 /nfs/dbraw/zinc/26/15/67/1391261567.db2.gz UOGRGXZNBJIJMU-KZNAEPCWSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](CCC(C)(C)C)C[C@H]2C1 ZINC001441343377 1391261570 /nfs/dbraw/zinc/26/15/70/1391261570.db2.gz UOGRGXZNBJIJMU-KZNAEPCWSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](CCC(C)(C)C)C[C@@H]2C1 ZINC001441343378 1391261658 /nfs/dbraw/zinc/26/16/58/1391261658.db2.gz UOGRGXZNBJIJMU-OKZBNKHCSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CCC(C)(C)C)C[C@@H]2C1 ZINC001441343378 1391261660 /nfs/dbraw/zinc/26/16/60/1391261660.db2.gz UOGRGXZNBJIJMU-OKZBNKHCSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@@H]2CCc3ccccc32)C1 ZINC001441382171 1391274185 /nfs/dbraw/zinc/27/41/85/1391274185.db2.gz VHSOTXMFQCMOME-SZVBFZGTSA-N 1 3 329.488 2.500 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc32)C1)CC(C)(C)C ZINC001441406093 1391287275 /nfs/dbraw/zinc/28/72/75/1391287275.db2.gz VORFAPLQIITBBA-ZHALLVOQSA-N 1 3 343.515 2.889 10 0 EFAEHO CN(C)C1(C(=O)N(C)[C@H](C[NH2+]CC2CC(C)(C)C2)C2CC2)CCC1 ZINC001441433084 1391300556 /nfs/dbraw/zinc/30/05/56/1391300556.db2.gz NHZQLPPLRYLUQT-QGZVFWFLSA-N 1 3 335.536 2.734 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C[NH2+]Cc1ccsc1)C1CC1 ZINC001441456746 1391321303 /nfs/dbraw/zinc/32/13/03/1391321303.db2.gz BATAJBVUUPMCNU-ZWKOTPCHSA-N 1 3 349.544 2.949 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@@H](C2CC2)N(C)C(=O)CN(C)C(C)C)c1 ZINC001441462104 1391325799 /nfs/dbraw/zinc/32/57/99/1391325799.db2.gz LQJSRFNWOQEPBY-IBGZPJMESA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C)cc2Cl)C1)N(C)C ZINC001441519934 1391348370 /nfs/dbraw/zinc/34/83/70/1391348370.db2.gz FGDHJVGKRBUZTO-UXLLHSPISA-N 1 3 337.895 2.725 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)s2)C1)N(C)C ZINC001441523655 1391351274 /nfs/dbraw/zinc/35/12/74/1391351274.db2.gz KVFHFLPRYCNQCD-TYNCELHUSA-N 1 3 343.924 2.725 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(Cl)s1)N(C)C ZINC001441539623 1391354849 /nfs/dbraw/zinc/35/48/49/1391354849.db2.gz NTKXIAXTJUJRQZ-WCQYABFASA-N 1 3 331.913 2.678 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1ccccc1 ZINC001441580405 1391373453 /nfs/dbraw/zinc/37/34/53/1391373453.db2.gz BYDBBRYKKXACJP-HKUYNNGSSA-N 1 3 331.504 2.886 10 0 EFAEHO Cc1cc(C[N@H+]2CCC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)cs1 ZINC001441584783 1391375735 /nfs/dbraw/zinc/37/57/35/1391375735.db2.gz MKGAAHBPDXDMCY-DOTOQJQBSA-N 1 3 349.544 2.727 10 0 EFAEHO Cc1cc(C[N@@H+]2CCC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)cs1 ZINC001441584783 1391375740 /nfs/dbraw/zinc/37/57/40/1391375740.db2.gz MKGAAHBPDXDMCY-DOTOQJQBSA-N 1 3 349.544 2.727 10 0 EFAEHO Cc1cncc(CN[C@H](C)CN(C)C(=O)[C@H](C)[NH+]2CCCCCC2)c1 ZINC001441587276 1391379554 /nfs/dbraw/zinc/37/95/54/1391379554.db2.gz NBNRNTLXJYDSQX-MSOLQXFVSA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@H]1[C@H](NCc2cccc(Cl)c2F)CCN1C(=O)CC[NH+](C)C ZINC001441823532 1391420348 /nfs/dbraw/zinc/42/03/48/1391420348.db2.gz NFSSFPLSVVBWTA-SWLSCSKDSA-N 1 3 341.858 2.510 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@@H]1CC[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001441904021 1391434919 /nfs/dbraw/zinc/43/49/19/1391434919.db2.gz VHZZMCYWXCXCCJ-MJGOQNOKSA-N 1 3 331.504 2.710 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H]1CC[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001441904022 1391434991 /nfs/dbraw/zinc/43/49/91/1391434991.db2.gz VHZZMCYWXCXCCJ-PKOBYXMFSA-N 1 3 331.504 2.710 10 0 EFAEHO Cc1cc(C)c(C[NH2+]C[C@H](C)CNC(=O)CN(C)C2CCC2)c(C)c1 ZINC001444332976 1391472399 /nfs/dbraw/zinc/47/23/99/1391472399.db2.gz WECUUNVYZQMTNU-INIZCTEOSA-N 1 3 345.531 2.938 10 0 EFAEHO C[C@H](C[NH2+][C@H]1CCc2ccccc21)N(C)C(=O)C1(N(C)C)CCC1 ZINC001444619633 1391508607 /nfs/dbraw/zinc/50/86/07/1391508607.db2.gz BDZLUFQTHVOTIE-QAPCUYQASA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001446943590 1391643013 /nfs/dbraw/zinc/64/30/13/1391643013.db2.gz UAEHDHPXVWCAHE-AZUAARDMSA-N 1 3 345.531 2.828 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@H](C)[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001446948743 1391644809 /nfs/dbraw/zinc/64/48/09/1391644809.db2.gz SHXJBMKDHCCGRD-SJORKVTESA-N 1 3 349.494 2.801 10 0 EFAEHO CCC(CC)C[NH2+]C[C@@H]1CN(C(=O)CN2CCC(C)CC2)C[C@@H]1C ZINC001446973141 1391649301 /nfs/dbraw/zinc/64/93/01/1391649301.db2.gz NQTCLABRWIHQPP-PKOBYXMFSA-N 1 3 337.552 2.839 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2C[N@H+](CC3CCC3)C[C@H]21)N(CC)CC ZINC001447040999 1391669126 /nfs/dbraw/zinc/66/91/26/1391669126.db2.gz DBDYABMDVAPAFP-IPMKNSEASA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]2C[N@@H+](CC3CCC3)C[C@H]21)N(CC)CC ZINC001447040999 1391669129 /nfs/dbraw/zinc/66/91/29/1391669129.db2.gz DBDYABMDVAPAFP-IPMKNSEASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1ccccc1C[N@H+](C)CC1CCC1 ZINC001447073114 1391686883 /nfs/dbraw/zinc/68/68/83/1391686883.db2.gz BKDNSQQCGKYGMX-UHFFFAOYSA-N 1 3 331.504 2.875 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1ccccc1C[N@@H+](C)CC1CCC1 ZINC001447073114 1391686888 /nfs/dbraw/zinc/68/68/88/1391686888.db2.gz BKDNSQQCGKYGMX-UHFFFAOYSA-N 1 3 331.504 2.875 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1Cc2ccccc2[C@H]1[NH2+]CCC(C)C ZINC001447748848 1391748972 /nfs/dbraw/zinc/74/89/72/1391748972.db2.gz GVPWXHXVFZINNO-UYAOXDASSA-N 1 3 331.504 2.746 10 0 EFAEHO C[C@@H](NC(=O)c1ccc(C[NH+](C)C)cc1)[C@H](C)NCc1cncs1 ZINC001447888815 1391791473 /nfs/dbraw/zinc/79/14/73/1391791473.db2.gz BXZRAZOXCCYNTO-UONOGXRCSA-N 1 3 346.500 2.501 10 0 EFAEHO COc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)cc1 ZINC001447894281 1391793582 /nfs/dbraw/zinc/79/35/82/1391793582.db2.gz XLQRXEWXJMSYDX-HZPDHXFCSA-N 1 3 347.503 2.552 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@@H](C)[C@@H](C)NC(=O)CN(C)C(C)C)c(C)c1 ZINC001447926107 1391817560 /nfs/dbraw/zinc/81/75/60/1391817560.db2.gz AWRZHGPHKYWFOV-ZWKOTPCHSA-N 1 3 333.520 2.935 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1CCC(N(C)C(=O)C2(N(C)C)CCC2)CC1 ZINC001447933374 1391831073 /nfs/dbraw/zinc/83/10/73/1391831073.db2.gz RZXAIOGYPFRTGB-QQFBHYJXSA-N 1 3 327.488 2.578 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC(C)(C)CN(C)C(=O)C(C)(C)N1CCCC1 ZINC001447971294 1391865466 /nfs/dbraw/zinc/86/54/66/1391865466.db2.gz YXRJQQCIRAMBJG-OAHLLOKOSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@H](F)C[NH2+]CC(C)(C)CN(C)C(=O)C(C)(C)N1CCCC1 ZINC001447971289 1391865562 /nfs/dbraw/zinc/86/55/62/1391865562.db2.gz YXRJQQCIRAMBJG-HNNXBMFYSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C)CCCc2ccccc2)CC1 ZINC001506977762 1406537174 /nfs/dbraw/zinc/53/71/74/1406537174.db2.gz MGJTUTYJOWEBEG-UHFFFAOYSA-N 1 3 345.531 2.882 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C)CCCc2ccccc2)CC1 ZINC001506977762 1406537179 /nfs/dbraw/zinc/53/71/79/1406537179.db2.gz MGJTUTYJOWEBEG-UHFFFAOYSA-N 1 3 345.531 2.882 10 0 EFAEHO Cc1ccc(F)cc1CN1CCCCC[C@@H]1CNC(=O)CC[NH+](C)C ZINC001448268954 1392069336 /nfs/dbraw/zinc/06/93/36/1392069336.db2.gz SLZNSRKYQDUIRV-LJQANCHMSA-N 1 3 349.494 2.947 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H]1C[C@H](C)N(C(=O)CC[NH+](C)C)C1 ZINC001449028989 1392218509 /nfs/dbraw/zinc/21/85/09/1392218509.db2.gz OXEZZINEFOXGPM-GJZGRUSLSA-N 1 3 337.895 2.679 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H]1C[C@@H](C)N(C(=O)CC[NH+](C)C)C1 ZINC001449028992 1392218594 /nfs/dbraw/zinc/21/85/94/1392218594.db2.gz OXEZZINEFOXGPM-HUUCEWRRSA-N 1 3 337.895 2.679 10 0 EFAEHO CCc1ccc(CN2CCC[C@H](NC(=O)CC[NH+](C)C)[C@@H]2C)cc1 ZINC001449042495 1392229626 /nfs/dbraw/zinc/22/96/26/1392229626.db2.gz QIRYRXOLHQWNJT-LPHOPBHVSA-N 1 3 331.504 2.670 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N1C[C@H]([NH2+]CCC(F)(F)F)C(C)(C)C1 ZINC001449056211 1392240633 /nfs/dbraw/zinc/24/06/33/1392240633.db2.gz BIUMFDHDELZUKB-KBPBESRZSA-N 1 3 349.441 2.640 10 0 EFAEHO CN(C)C[C@H](NC(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(F)cc1 ZINC001450711710 1392710365 /nfs/dbraw/zinc/71/03/65/1392710365.db2.gz WOFVRIKOANEYNL-NJAFHUGGSA-N 1 3 335.467 2.665 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H](C1CC1)N(C)C(=O)C(C)(C)N1CCCCC1 ZINC001507013430 1406589166 /nfs/dbraw/zinc/58/91/66/1406589166.db2.gz PFQPAOXJFQJDRO-DOTOQJQBSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H](CN(C)C(=O)C(C)(C)[NH+]1CCCC1)NCc1ccccc1F ZINC001507106646 1406711351 /nfs/dbraw/zinc/71/13/51/1406711351.db2.gz MMZNKKNNKLUDHG-HNNXBMFYSA-N 1 3 335.467 2.637 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](C)CN(C)C(=O)CC[NH+](C)C ZINC001507117020 1406724915 /nfs/dbraw/zinc/72/49/15/1406724915.db2.gz FHZFQQAJAHWYNS-AWEZNQCLSA-N 1 3 325.884 2.537 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+][C@@H](C)CN(C)C(=O)Cc2c[nH]cn2)c1 ZINC001507129132 1406743572 /nfs/dbraw/zinc/74/35/72/1406743572.db2.gz NBUWOXJPUSIPFK-JKSUJKDBSA-N 1 3 328.460 2.767 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(C(F)F)cc1 ZINC001507159983 1406788535 /nfs/dbraw/zinc/78/85/35/1406788535.db2.gz AINULJNEUBYNGV-AWEZNQCLSA-N 1 3 341.446 2.901 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc(C(F)F)cc1 ZINC001507159984 1406789133 /nfs/dbraw/zinc/78/91/33/1406789133.db2.gz AINULJNEUBYNGV-CQSZACIVSA-N 1 3 341.446 2.901 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@@H](C)NCc1ccccc1F)[NH+]1CCCC1 ZINC001507161133 1406789607 /nfs/dbraw/zinc/78/96/07/1406789607.db2.gz ISOFPWROBMKXDE-VQIMIIECSA-N 1 3 349.494 2.883 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]CCCc1ccccc1 ZINC001507161015 1406789716 /nfs/dbraw/zinc/78/97/16/1406789716.db2.gz HOWXXGAYJWZSGI-QUCCMNQESA-N 1 3 345.531 2.930 10 0 EFAEHO CC[C@@H]1CC[C@H](C)[N@H+](CC(=O)NC[C@@H](c2ccccc2)N(C)C)C1 ZINC001460094607 1396004448 /nfs/dbraw/zinc/00/44/48/1396004448.db2.gz BOKGJVKFLGYZPF-SCTDSRPQSA-N 1 3 331.504 2.916 10 0 EFAEHO CC[C@@H]1CC[C@H](C)[N@@H+](CC(=O)NC[C@@H](c2ccccc2)N(C)C)C1 ZINC001460094607 1396004455 /nfs/dbraw/zinc/00/44/55/1396004455.db2.gz BOKGJVKFLGYZPF-SCTDSRPQSA-N 1 3 331.504 2.916 10 0 EFAEHO CC1CC[NH+](CC[C@H]2CCCN2CCc2ccc(C(N)=O)cc2)CC1 ZINC001460627013 1396238335 /nfs/dbraw/zinc/23/83/35/1396238335.db2.gz MYNRUFQNZQCPQF-HXUWFJFHSA-N 1 3 343.515 2.914 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1 ZINC001463809274 1396523122 /nfs/dbraw/zinc/52/31/22/1396523122.db2.gz JFAFGZPJVGVNOH-FQEVSTJZSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC001464145305 1396551135 /nfs/dbraw/zinc/55/11/35/1396551135.db2.gz HVHNSIOPIKHWIH-OAHLLOKOSA-N 1 3 328.460 2.753 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCNC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC001464145305 1396551139 /nfs/dbraw/zinc/55/11/39/1396551139.db2.gz HVHNSIOPIKHWIH-OAHLLOKOSA-N 1 3 328.460 2.753 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N(CCN(C)C)C3CCCCC3)C[N@@H+]2C1 ZINC001464843013 1396618363 /nfs/dbraw/zinc/61/83/63/1396618363.db2.gz ZYHXKQOXUWPRLJ-ZHALLVOQSA-N 1 3 335.536 2.830 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N(CCN(C)C)C3CCCCC3)C[N@H+]2C1 ZINC001464843013 1396618371 /nfs/dbraw/zinc/61/83/71/1396618371.db2.gz ZYHXKQOXUWPRLJ-ZHALLVOQSA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H](C(=O)N(Cc2ccco2)C2CCN(C)CC2)C1 ZINC001464868289 1396623299 /nfs/dbraw/zinc/62/32/99/1396623299.db2.gz LKVZMIOVIGCEBF-KRWDZBQOSA-N 1 3 347.503 2.823 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H](C(=O)N(Cc2ccco2)C2CCN(C)CC2)C1 ZINC001464868289 1396623307 /nfs/dbraw/zinc/62/33/07/1396623307.db2.gz LKVZMIOVIGCEBF-KRWDZBQOSA-N 1 3 347.503 2.823 10 0 EFAEHO CC(C)C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(=O)N(C)CCN(C)C ZINC001465580632 1396693620 /nfs/dbraw/zinc/69/36/20/1396693620.db2.gz RUOMCOBOWXITSK-WOJBJXKFSA-N 1 3 345.531 2.801 10 0 EFAEHO CC(C)C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)N(C)CCN(C)C ZINC001465580632 1396693627 /nfs/dbraw/zinc/69/36/27/1396693627.db2.gz RUOMCOBOWXITSK-WOJBJXKFSA-N 1 3 345.531 2.801 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)[C@@H]2CC[C@H]3CCCC[N@@H+]32)CCN1Cc1ccccc1 ZINC001468705920 1396981273 /nfs/dbraw/zinc/98/12/73/1396981273.db2.gz ZFXOBQQIONMYKB-AFYVEPGGSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)CCN1Cc1ccccc1 ZINC001468705920 1396981280 /nfs/dbraw/zinc/98/12/80/1396981280.db2.gz ZFXOBQQIONMYKB-AFYVEPGGSA-N 1 3 341.499 2.783 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NCCC1=CCCCCC1 ZINC001469729119 1397051674 /nfs/dbraw/zinc/05/16/74/1397051674.db2.gz ZVHRJAKUWMFRMQ-KRWDZBQOSA-N 1 3 338.540 2.838 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NCCC1=CCCCCC1 ZINC001469729119 1397051682 /nfs/dbraw/zinc/05/16/82/1397051682.db2.gz ZVHRJAKUWMFRMQ-KRWDZBQOSA-N 1 3 338.540 2.838 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)N[C@H]1CN(Cc2ccccc2)CC[C@H]1C ZINC001470775481 1397120882 /nfs/dbraw/zinc/12/08/82/1397120882.db2.gz DFXVNAJSEFIDEN-LMMKCTJWSA-N 1 3 331.504 2.601 10 0 EFAEHO CN(C(=O)NC[C@H]1CC[N@@H+]1C1CCCCCC1)[C@@H]1CCCN(C)C1 ZINC001479142364 1397613662 /nfs/dbraw/zinc/61/36/62/1397613662.db2.gz JDUVFAFMSKZETM-QZTJIDSGSA-N 1 3 336.524 2.519 10 0 EFAEHO CN(C(=O)NC[C@H]1CC[N@H+]1C1CCCCCC1)[C@@H]1CCCN(C)C1 ZINC001479142364 1397613666 /nfs/dbraw/zinc/61/36/66/1397613666.db2.gz JDUVFAFMSKZETM-QZTJIDSGSA-N 1 3 336.524 2.519 10 0 EFAEHO CN(C[C@H]1CCN1[C@@H]1CCCc2ccccc21)C(=O)CC[NH+](C)C ZINC001479242864 1397635236 /nfs/dbraw/zinc/63/52/36/1397635236.db2.gz LJLIOVVDHKWTMU-IEBWSBKVSA-N 1 3 329.488 2.548 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CCc2cccs2)C1)N(C)C ZINC001479476031 1397733221 /nfs/dbraw/zinc/73/32/21/1397733221.db2.gz PUPDMLIZHXEDDS-UXLLHSPISA-N 1 3 337.533 2.505 10 0 EFAEHO Cc1cc(C[NH2+][C@@H]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)cs1 ZINC001479494650 1397736733 /nfs/dbraw/zinc/73/67/33/1397736733.db2.gz JIPMMKXOMKJFDN-DOTOQJQBSA-N 1 3 337.533 2.771 10 0 EFAEHO CC[C@H](F)CN1CCC2(C[C@H](C)N(C(=O)CC[N@H+](C)CC)C2)CC1 ZINC001479500411 1397738521 /nfs/dbraw/zinc/73/85/21/1397738521.db2.gz FDWVCQFFGSGEBK-IRXDYDNUSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](F)CN1CCC2(C[C@H](C)N(C(=O)CC[N@@H+](C)CC)C2)CC1 ZINC001479500411 1397738523 /nfs/dbraw/zinc/73/85/23/1397738523.db2.gz FDWVCQFFGSGEBK-IRXDYDNUSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@@H]1CCCN(C(=O)Cc2c[nH]cn2)[C@@H]1CC[NH2+]Cc1ccsc1 ZINC001479522641 1397749348 /nfs/dbraw/zinc/74/93/48/1397749348.db2.gz LPKQHOJTGSFCHS-RHSMWYFYSA-N 1 3 346.500 2.821 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[N@H+](C)CC)CCN1Cc1cc(F)ccc1C ZINC001479643781 1397758574 /nfs/dbraw/zinc/75/85/74/1397758574.db2.gz DLGBNNQPUISRIZ-RBUKOAKNSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)CC[N@@H+](C)CC)CCN1Cc1cc(F)ccc1C ZINC001479643781 1397758586 /nfs/dbraw/zinc/75/85/86/1397758586.db2.gz DLGBNNQPUISRIZ-RBUKOAKNSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@@H](C(=O)N1CCCCC[C@@H]([NH2+]CCCOC(C)C)C1)N(C)C ZINC001479695290 1397767143 /nfs/dbraw/zinc/76/71/43/1397767143.db2.gz VIONIMWIXSJXMO-MSOLQXFVSA-N 1 3 341.540 2.503 10 0 EFAEHO Cc1cccc([C@H](C)[N@H+](C)CCCNC(=O)C2(N(C)C)CCC2)c1 ZINC001479774776 1397840459 /nfs/dbraw/zinc/84/04/59/1397840459.db2.gz KXOMWTJPPONNMZ-KRWDZBQOSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1cccc([C@H](C)[N@@H+](C)CCCNC(=O)C2(N(C)C)CCC2)c1 ZINC001479774776 1397840463 /nfs/dbraw/zinc/84/04/63/1397840463.db2.gz KXOMWTJPPONNMZ-KRWDZBQOSA-N 1 3 331.504 2.978 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001479777372 1397845102 /nfs/dbraw/zinc/84/51/02/1397845102.db2.gz NKXRFOJMFUFHKW-CVEARBPZSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001479777372 1397845107 /nfs/dbraw/zinc/84/51/07/1397845107.db2.gz NKXRFOJMFUFHKW-CVEARBPZSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C)Cc1ccc(F)c(Cl)c1)N(C)C ZINC001479778155 1397846900 /nfs/dbraw/zinc/84/69/00/1397846900.db2.gz NZWBALKEBKDCLJ-MRXNPFEDSA-N 1 3 343.874 2.757 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C)Cc1ccc(F)c(Cl)c1)N(C)C ZINC001479778155 1397846904 /nfs/dbraw/zinc/84/69/04/1397846904.db2.gz NZWBALKEBKDCLJ-MRXNPFEDSA-N 1 3 343.874 2.757 10 0 EFAEHO CC[C@H](C)C[N@H+](C)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001479796082 1397874977 /nfs/dbraw/zinc/87/49/77/1397874977.db2.gz BKAQTNKEJBIBDZ-MAUKXSAKSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@H](C)C[N@@H+](C)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001479796082 1397874980 /nfs/dbraw/zinc/87/49/80/1397874980.db2.gz BKAQTNKEJBIBDZ-MAUKXSAKSA-N 1 3 329.504 2.683 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@H+](C)CC1CC2(CCC2)C1 ZINC001479815220 1397910365 /nfs/dbraw/zinc/91/03/65/1397910365.db2.gz BTGNZCLKJQQVNY-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCCC[N@@H+](C)CC1CC2(CCC2)C1 ZINC001479815220 1397910370 /nfs/dbraw/zinc/91/03/70/1397910370.db2.gz BTGNZCLKJQQVNY-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001479846633 1397944461 /nfs/dbraw/zinc/94/44/61/1397944461.db2.gz NMNXWOMUDJMGPH-VDRJNSHASA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001479846633 1397944464 /nfs/dbraw/zinc/94/44/64/1397944464.db2.gz NMNXWOMUDJMGPH-VDRJNSHASA-N 1 3 327.900 2.584 10 0 EFAEHO CC[N@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC1CCC1 ZINC001479854652 1397956093 /nfs/dbraw/zinc/95/60/93/1397956093.db2.gz LKMZHJKIUXZING-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[N@@H+](CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)CC1CCC1 ZINC001479854652 1397956097 /nfs/dbraw/zinc/95/60/97/1397956097.db2.gz LKMZHJKIUXZING-IBGZPJMESA-N 1 3 341.515 2.827 10 0 EFAEHO CC[N@H+](CCCNC(=O)Cc1nc[nH]c1C)[C@H](C)c1ccc(F)cc1 ZINC001479859503 1397961550 /nfs/dbraw/zinc/96/15/50/1397961550.db2.gz OGGSALXXMCCDFO-OAHLLOKOSA-N 1 3 346.450 2.989 10 0 EFAEHO CC[N@@H+](CCCNC(=O)Cc1nc[nH]c1C)[C@H](C)c1ccc(F)cc1 ZINC001479859503 1397961553 /nfs/dbraw/zinc/96/15/53/1397961553.db2.gz OGGSALXXMCCDFO-OAHLLOKOSA-N 1 3 346.450 2.989 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C1CC1)[C@H]1CCc2ccccc21)N(C)C ZINC001479879817 1397994607 /nfs/dbraw/zinc/99/46/07/1397994607.db2.gz MSJFONBCXALSPE-UXHICEINSA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C1CC1)[C@H]1CCc2ccccc21)N(C)C ZINC001479879817 1397994608 /nfs/dbraw/zinc/99/46/08/1397994608.db2.gz MSJFONBCXALSPE-UXHICEINSA-N 1 3 343.515 2.985 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCN(Cc2ccccc2C)C1)[NH+](CC)CC ZINC001479963665 1398049520 /nfs/dbraw/zinc/04/95/20/1398049520.db2.gz PYHQZLDOFOIZTB-RBUKOAKNSA-N 1 3 331.504 2.806 10 0 EFAEHO CCCCCC[NH+]1CCC2(C[C@@H]2NC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001479985125 1398069610 /nfs/dbraw/zinc/06/96/10/1398069610.db2.gz KYFQEKQCZLSUIR-MSOLQXFVSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccc(F)c(CN2CCC3(C[C@H]3NC(=O)CC[NH+](C)C)CC2)c1 ZINC001479985940 1398071624 /nfs/dbraw/zinc/07/16/24/1398071624.db2.gz YYWSOUDUNSGMOL-GOSISDBHSA-N 1 3 347.478 2.557 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]Cc1ccc(F)cc1)C1CC1 ZINC001480023609 1398100058 /nfs/dbraw/zinc/10/00/58/1398100058.db2.gz GQBZOANEXQKDQX-OALUTQOASA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+]CC/C=C/c2ccccc2)C1 ZINC001480173201 1398142421 /nfs/dbraw/zinc/14/24/21/1398142421.db2.gz BGEPTOUPKKZKJR-GKWHILSKSA-N 1 3 329.488 2.667 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H]1C[C@H]([NH2+]C/C=C/c2ccccc2)C1 ZINC001480174677 1398143624 /nfs/dbraw/zinc/14/36/24/1398143624.db2.gz XWDOOCLATZBQPI-IJGPOECYSA-N 1 3 341.499 2.809 10 0 EFAEHO CN(CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CCCCCF)C1CCC1 ZINC001480179169 1398147395 /nfs/dbraw/zinc/14/73/95/1398147395.db2.gz BLJDTNINWSWTIR-ZNXRZULTSA-N 1 3 339.499 2.722 10 0 EFAEHO CN(CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCCCF)C1CCC1 ZINC001480179169 1398147400 /nfs/dbraw/zinc/14/74/00/1398147400.db2.gz BLJDTNINWSWTIR-ZNXRZULTSA-N 1 3 339.499 2.722 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](C[NH2+]CCCC2CCCC2)C1)N(C)C ZINC001480649642 1398262611 /nfs/dbraw/zinc/26/26/11/1398262611.db2.gz XKBYNRQEJAPWHY-MOPGFXCFSA-N 1 3 337.552 2.981 10 0 EFAEHO CCC/C=C/CC[NH2+]C[C@@H]1CCN(C(=O)CN2CCC(C)CC2)C1 ZINC001480669423 1398273628 /nfs/dbraw/zinc/27/36/28/1398273628.db2.gz TZZWAEBJHYWSQL-UEKDZROGSA-N 1 3 335.536 2.903 10 0 EFAEHO CN(CC(=O)NCCC[C@H]1CCC[N@@H+]1C/C=C/Cl)C1CCC1 ZINC001480826770 1398335082 /nfs/dbraw/zinc/33/50/82/1398335082.db2.gz SQEZXBKLEDVUDF-YKXBDCQTSA-N 1 3 327.900 2.584 10 0 EFAEHO CN(CC(=O)NCCC[C@H]1CCC[N@H+]1C/C=C/Cl)C1CCC1 ZINC001480826770 1398335091 /nfs/dbraw/zinc/33/50/91/1398335091.db2.gz SQEZXBKLEDVUDF-YKXBDCQTSA-N 1 3 327.900 2.584 10 0 EFAEHO CCCCC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@H]21 ZINC001507358037 1406947035 /nfs/dbraw/zinc/94/70/35/1406947035.db2.gz RKGMGYNEDFKRAL-RCCFBDPRSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+](CC[C@H]2CCCC2(F)F)C1 ZINC001493265947 1398573158 /nfs/dbraw/zinc/57/31/58/1398573158.db2.gz AKZCUYJEZQAWBZ-HZPDHXFCSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+](CC[C@H]2CCCC2(F)F)C1 ZINC001493265947 1398573160 /nfs/dbraw/zinc/57/31/60/1398573160.db2.gz AKZCUYJEZQAWBZ-HZPDHXFCSA-N 1 3 345.478 2.590 10 0 EFAEHO CCCN(CCNC(=O)C12CC[NH+](CC1)C2)Cc1cc(F)ccc1C ZINC001493324740 1398616344 /nfs/dbraw/zinc/61/63/44/1398616344.db2.gz GKQRFGMPJPFZLG-UHFFFAOYSA-N 1 3 347.478 2.558 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001493429294 1398700236 /nfs/dbraw/zinc/70/02/36/1398700236.db2.gz IQTVWTJXEFSOQW-VQTJNVASSA-N 1 3 341.499 2.784 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@H]1CCC[C@H]2CCC[N@H+]21 ZINC001493429294 1398700239 /nfs/dbraw/zinc/70/02/39/1398700239.db2.gz IQTVWTJXEFSOQW-VQTJNVASSA-N 1 3 341.499 2.784 10 0 EFAEHO CC(C)[C@H](C(=O)NCCN(Cc1ccccc1)C1CC1)[NH+]1CCCC1 ZINC001493448630 1398715098 /nfs/dbraw/zinc/71/50/98/1398715098.db2.gz DLYPQZCVAILDBO-HXUWFJFHSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NCCN(Cc1ccccc1)C1CC1 ZINC001493450936 1398717412 /nfs/dbraw/zinc/71/74/12/1398717412.db2.gz WUYANJBXAKNDJH-CALCHBBNSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCCN(Cc1ccccc1)C1CC1 ZINC001493450936 1398717414 /nfs/dbraw/zinc/71/74/14/1398717414.db2.gz WUYANJBXAKNDJH-CALCHBBNSA-N 1 3 329.488 2.640 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)CC[C@@H]2CCC[N@@H+]2C)cc1F ZINC001493585611 1398763087 /nfs/dbraw/zinc/76/30/87/1398763087.db2.gz XEANWDPVWFYUFZ-KRWDZBQOSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)CC[C@@H]2CCC[N@H+]2C)cc1F ZINC001493585611 1398763095 /nfs/dbraw/zinc/76/30/95/1398763095.db2.gz XEANWDPVWFYUFZ-KRWDZBQOSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)CC[C@H]2CCC[N@@H+]2C)cc1F ZINC001493585613 1398763371 /nfs/dbraw/zinc/76/33/71/1398763371.db2.gz XEANWDPVWFYUFZ-QGZVFWFLSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)CC[C@H]2CCC[N@H+]2C)cc1F ZINC001493585613 1398763374 /nfs/dbraw/zinc/76/33/74/1398763374.db2.gz XEANWDPVWFYUFZ-QGZVFWFLSA-N 1 3 335.467 2.557 10 0 EFAEHO Cc1ccc(F)c(CNCCN(C)C(=O)[C@H](C(C)C)[NH+]2CCCC2)c1 ZINC001493806838 1398896457 /nfs/dbraw/zinc/89/64/57/1398896457.db2.gz PXSXXSQOPPCRPQ-IBGZPJMESA-N 1 3 349.494 2.803 10 0 EFAEHO CCCN(C(=O)C12CC[NH+](CC1)C2)[C@H]1CCN(Cc2ccccc2)C1 ZINC001493973998 1399027376 /nfs/dbraw/zinc/02/73/76/1399027376.db2.gz NPAKNGONXXHLQW-IBGZPJMESA-N 1 3 341.499 2.595 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001494178954 1399191789 /nfs/dbraw/zinc/19/17/89/1399191789.db2.gz OIZKXQQAWZJMDZ-QZTJIDSGSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)C[C@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001494178954 1399191791 /nfs/dbraw/zinc/19/17/91/1399191791.db2.gz OIZKXQQAWZJMDZ-QZTJIDSGSA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@H+](C)[C@H](C)c2ccccc2)C1 ZINC001494179576 1399191904 /nfs/dbraw/zinc/19/19/04/1399191904.db2.gz RWZVJKDJJMQQGN-MSOLQXFVSA-N 1 3 331.504 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@@H+](C)[C@H](C)c2ccccc2)C1 ZINC001494179576 1399191908 /nfs/dbraw/zinc/19/19/08/1399191908.db2.gz RWZVJKDJJMQQGN-MSOLQXFVSA-N 1 3 331.504 2.868 10 0 EFAEHO C[N@H+](CCC1=CCCCC1)C[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001494180498 1399193426 /nfs/dbraw/zinc/19/34/26/1399193426.db2.gz LXIBZMUCGDXIIP-LJQANCHMSA-N 1 3 333.520 2.753 10 0 EFAEHO C[N@@H+](CCC1=CCCCC1)C[C@H]1CCN(C(=O)CN2CCCC2)C1 ZINC001494180498 1399193432 /nfs/dbraw/zinc/19/34/32/1399193432.db2.gz LXIBZMUCGDXIIP-LJQANCHMSA-N 1 3 333.520 2.753 10 0 EFAEHO CC(C)c1ccccc1CN1CC(CNC(=O)C[C@@H]2CC[N@H+](C)C2)C1 ZINC001494614365 1399400729 /nfs/dbraw/zinc/40/07/29/1399400729.db2.gz FQYVQWDURNWWLI-KRWDZBQOSA-N 1 3 343.515 2.700 10 0 EFAEHO CC(C)c1ccccc1CN1CC(CNC(=O)C[C@@H]2CC[N@@H+](C)C2)C1 ZINC001494614365 1399400731 /nfs/dbraw/zinc/40/07/31/1399400731.db2.gz FQYVQWDURNWWLI-KRWDZBQOSA-N 1 3 343.515 2.700 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1C[NH+](CC2CCCCCC2)C1 ZINC001494633479 1399408157 /nfs/dbraw/zinc/40/81/57/1399408157.db2.gz QIDXRHBUPQRMKT-IRXDYDNUSA-N 1 3 335.536 2.878 10 0 EFAEHO CCN(C(=O)CC[NH+](C)C)[C@@H]1CCN(Cc2ccc(C)c(C)c2)C1 ZINC001494911617 1399550474 /nfs/dbraw/zinc/55/04/74/1399550474.db2.gz WCDWLTUIAPFMRG-LJQANCHMSA-N 1 3 331.504 2.678 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@H]1CN(C(=O)C(C)(C)N2CCCCC2)CC1(C)C ZINC001507430999 1407045674 /nfs/dbraw/zinc/04/56/74/1407045674.db2.gz IOQPRUKOOSWSEY-CVEARBPZSA-N 1 3 341.515 2.826 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N1C[C@@H]([NH2+]CCCCCF)C(C)(C)C1 ZINC001507434999 1407049220 /nfs/dbraw/zinc/04/92/20/1407049220.db2.gz IIKAYPHJYWQPLP-DLBZAZTESA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@](C)(C[NH2+]CC1CCC(C)CC1)C1CC1 ZINC001495298900 1399807355 /nfs/dbraw/zinc/80/73/55/1399807355.db2.gz QGSLNBZLXAEHCY-SGHGTVFPSA-N 1 3 346.519 2.961 10 0 EFAEHO CN(CC(=O)N1C[C@@H]([NH2+]CCCCCF)C(C)(C)C1)CC(C)(C)C ZINC001507445822 1407061849 /nfs/dbraw/zinc/06/18/49/1407061849.db2.gz JZFIWUZWGBQMDF-MRXNPFEDSA-N 1 3 343.531 2.931 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](CC[NH2+]Cc2ccc(F)cc2)C1 ZINC001495393446 1399939018 /nfs/dbraw/zinc/93/90/18/1399939018.db2.gz ONDOFTDNGKKRLI-GOSISDBHSA-N 1 3 349.494 2.884 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(CC[NH2+]CC2CC3(CCC3)C2)CC1 ZINC001495404430 1399949987 /nfs/dbraw/zinc/94/99/87/1399949987.db2.gz WUSOXAJYSWWZQC-IBGZPJMESA-N 1 3 347.547 2.879 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[NH2+]CC2CC(F)(F)C2)CC1)N(C)C ZINC001495433367 1399976908 /nfs/dbraw/zinc/97/69/08/1399976908.db2.gz YNXDEXLOGKBKGZ-MRXNPFEDSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+]CCC1CCN(C(=O)CN2CCCC2)CC1 ZINC001495446274 1399985843 /nfs/dbraw/zinc/98/58/43/1399985843.db2.gz UFJUWJBSMWRYLG-GOSISDBHSA-N 1 3 337.552 2.983 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]1C[NH2+]C/C=C\c1ccccc1)C1CCC1 ZINC001495562261 1400083425 /nfs/dbraw/zinc/08/34/25/1400083425.db2.gz PUJPBOKGMCYDDA-ATYVUACHSA-N 1 3 341.499 2.765 10 0 EFAEHO C[C@H](CNC(=O)C1(N(C)C)CCC1)C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001495685496 1400165532 /nfs/dbraw/zinc/16/55/32/1400165532.db2.gz RRGKAPIJJLLDOQ-LSDHHAIUSA-N 1 3 345.478 2.638 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C[C@H](C)CNC(=O)C2(N(C)C)CCC2)c1 ZINC001495685860 1400166694 /nfs/dbraw/zinc/16/66/94/1400166694.db2.gz XISOSZAJSIBRTA-HOTGVXAUSA-N 1 3 347.503 2.582 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(C[NH+](CC3CC(C)(C)C3)C2)CC1 ZINC001495980118 1400397225 /nfs/dbraw/zinc/39/72/25/1400397225.db2.gz CLFJHGYYHKRMBH-UHFFFAOYSA-N 1 3 335.536 2.687 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]C[C@@H](C)N(C)C(=O)[C@@H]1CCCN1C ZINC001496027710 1400423752 /nfs/dbraw/zinc/42/37/52/1400423752.db2.gz JMVWWGPGJPHOGT-PBHICJAKSA-N 1 3 337.895 2.679 10 0 EFAEHO C[C@@H](C[NH2+]CC1CCC2(CC2)CC1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001496156472 1400507654 /nfs/dbraw/zinc/50/76/54/1400507654.db2.gz YZDRTYGGQIPIBD-SJORKVTESA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H](C[NH2+]CC1CCC2(CC2)CC1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001496156471 1400507819 /nfs/dbraw/zinc/50/78/19/1400507819.db2.gz YZDRTYGGQIPIBD-IRXDYDNUSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H](C[NH2+][C@@H](C)c1ccc2c(c1)CCC2)N(C)C(=O)CN1CCCC1 ZINC001496230524 1400557381 /nfs/dbraw/zinc/55/73/81/1400557381.db2.gz XQTDJCZWHQRUJW-IRXDYDNUSA-N 1 3 343.515 2.769 10 0 EFAEHO C[C@@H]([NH2+]C[C@H](C)N(C)C(=O)CN1CCCC1)c1ccc(Cl)cc1 ZINC001496230127 1400557411 /nfs/dbraw/zinc/55/74/11/1400557411.db2.gz QTPSPKYLILSPFG-LSDHHAIUSA-N 1 3 337.895 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+][C@H]1CCc2c1cccc2F ZINC001496251149 1400572343 /nfs/dbraw/zinc/57/23/43/1400572343.db2.gz UBADHRFYRDNARP-KDOFPFPSSA-N 1 3 335.467 2.590 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C[C@@H]1C ZINC001496355681 1400666743 /nfs/dbraw/zinc/66/67/43/1400666743.db2.gz HPAVIPIUDWINAG-DLBZAZTESA-N 1 3 325.541 2.837 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@H]2CCC[C@H]3CCC[N@@H+]32)CC1 ZINC001496510455 1400785275 /nfs/dbraw/zinc/78/52/75/1400785275.db2.gz HHNAWCKSTJKSMU-ZWKOTPCHSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@H]2CCC[C@H]3CCC[N@H+]32)CC1 ZINC001496510455 1400785279 /nfs/dbraw/zinc/78/52/79/1400785279.db2.gz HHNAWCKSTJKSMU-ZWKOTPCHSA-N 1 3 339.499 2.533 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1ccsc1)C(C)C ZINC001496567607 1400832937 /nfs/dbraw/zinc/83/29/37/1400832937.db2.gz SMGNWNLQRIXCFY-IAGOWNOFSA-N 1 3 337.533 2.853 10 0 EFAEHO CN(CC[N@H+](C)[C@@H]1CCc2ccc(Cl)cc21)C(=O)[C@@H]1CCCN1C ZINC001496679330 1400915342 /nfs/dbraw/zinc/91/53/42/1400915342.db2.gz JXLXJFMHNIIOLR-MSOLQXFVSA-N 1 3 349.906 2.812 10 0 EFAEHO CN(CC[N@@H+](C)[C@@H]1CCc2ccc(Cl)cc21)C(=O)[C@@H]1CCCN1C ZINC001496679330 1400915345 /nfs/dbraw/zinc/91/53/45/1400915345.db2.gz JXLXJFMHNIIOLR-MSOLQXFVSA-N 1 3 349.906 2.812 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)CC[C@H]32)cc1 ZINC001496866774 1401063104 /nfs/dbraw/zinc/06/31/04/1401063104.db2.gz IRDGPOQLDIORLG-WOJBJXKFSA-N 1 3 343.515 2.758 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H]3CN(C(=O)CN(C)C(C)C)CC[C@H]32)cc1 ZINC001496866774 1401063108 /nfs/dbraw/zinc/06/31/08/1401063108.db2.gz IRDGPOQLDIORLG-WOJBJXKFSA-N 1 3 343.515 2.758 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]Cc1ccccc1F ZINC001496924361 1401104247 /nfs/dbraw/zinc/10/42/47/1401104247.db2.gz QIKGPAFEZMAVBF-FUHWJXTLSA-N 1 3 335.467 2.540 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@@H]2CCC[C@H]2NC(=O)CN(C)C(C)C)c1 ZINC001496925935 1401105719 /nfs/dbraw/zinc/10/57/19/1401105719.db2.gz XKBDCWUOXRRVGG-VQTJNVASSA-N 1 3 345.531 2.964 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1nsc2ccccc12)N(C)C ZINC001497307267 1401286661 /nfs/dbraw/zinc/28/66/61/1401286661.db2.gz JVRMNZKDXWEGPX-CJNGLKHVSA-N 1 3 348.516 2.621 10 0 EFAEHO CC[C@H](F)CNCCN(CC)C(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001497394406 1401346738 /nfs/dbraw/zinc/34/67/38/1401346738.db2.gz OYYMQPIQHRRRLZ-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](F)CNCCN(CC)C(=O)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001497394406 1401346744 /nfs/dbraw/zinc/34/67/44/1401346744.db2.gz OYYMQPIQHRRRLZ-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CC[C@H](F)CNCCN(CC)C(=O)[C@H]1C[N@H+](C)C[C@@H]1c1ccccc1 ZINC001497455260 1401387534 /nfs/dbraw/zinc/38/75/34/1401387534.db2.gz IPYLXEWSJGRXHY-OTWHNJEPSA-N 1 3 349.494 2.518 10 0 EFAEHO CC[C@H](F)CNCCN(CC)C(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1 ZINC001497455260 1401387539 /nfs/dbraw/zinc/38/75/39/1401387539.db2.gz IPYLXEWSJGRXHY-OTWHNJEPSA-N 1 3 349.494 2.518 10 0 EFAEHO CC(C)N(CCN(C)[C@@H]1CCc2c1cccc2F)C(=O)CC[NH+](C)C ZINC001507831356 1407174591 /nfs/dbraw/zinc/17/45/91/1407174591.db2.gz KNNHVKWPNGEFRC-LJQANCHMSA-N 1 3 349.494 2.934 10 0 EFAEHO CCN(CC[NH2+]C[C@H]1CCC(F)(F)C1)C(=O)[C@H]1CCCCN1CC ZINC001497501267 1401423782 /nfs/dbraw/zinc/42/37/82/1401423782.db2.gz QKTPXYJKCOFUAH-JKSUJKDBSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C\CNCc2cccc(Cl)c2)CC[N@@H+]1C ZINC001497585880 1401474163 /nfs/dbraw/zinc/47/41/63/1401474163.db2.gz NRUPFKGIAXWEFM-JTDRTSHGSA-N 1 3 349.906 2.832 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C\CNCc2cccc(Cl)c2)CC[N@H+]1C ZINC001497585880 1401474164 /nfs/dbraw/zinc/47/41/64/1401474164.db2.gz NRUPFKGIAXWEFM-JTDRTSHGSA-N 1 3 349.906 2.832 10 0 EFAEHO CN(CC(=O)NC/C=C\C[NH2+]Cc1ccc(Cl)cc1)C1CCC1 ZINC001497596853 1401482468 /nfs/dbraw/zinc/48/24/68/1401482468.db2.gz LSESLLDTDOOFQM-IHWYPQMZSA-N 1 3 335.879 2.586 10 0 EFAEHO CC(C)[N@@H+]1CCCC[C@H]1C(=O)NC/C=C/CNCc1ccc(F)cc1 ZINC001497690563 1401554303 /nfs/dbraw/zinc/55/43/03/1401554303.db2.gz GYNUTXDBYMLTAU-PXPVJAHISA-N 1 3 347.478 2.851 10 0 EFAEHO CC(C)[N@H+]1CCCC[C@H]1C(=O)NC/C=C/CNCc1ccc(F)cc1 ZINC001497690563 1401554307 /nfs/dbraw/zinc/55/43/07/1401554307.db2.gz GYNUTXDBYMLTAU-PXPVJAHISA-N 1 3 347.478 2.851 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C/C=C\CNC(=O)CN2CCC(C)CC2)c1 ZINC001497713298 1401575973 /nfs/dbraw/zinc/57/59/73/1401575973.db2.gz GFPSFNSNDVRSCY-PLNGDYQASA-N 1 3 343.515 2.797 10 0 EFAEHO CCCN(C)CC(=O)NC/C=C\C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC001497726688 1401587486 /nfs/dbraw/zinc/58/74/86/1401587486.db2.gz SZHQYXYODXDZBX-HMECNJMJSA-N 1 3 347.478 2.807 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC/C=C/C[NH2+]CC[C@@H]1CCC[C@H](C)C1 ZINC001497734871 1401594561 /nfs/dbraw/zinc/59/45/61/1401594561.db2.gz SXPZFTHGUKERLV-PKOQZONYSA-N 1 3 332.492 2.739 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\CNCc1ccsc1)[NH+]1CCCC1 ZINC001497762555 1401632036 /nfs/dbraw/zinc/63/20/36/1401632036.db2.gz ISKGLDJBOXVRQF-CWIOURORSA-N 1 3 335.517 2.631 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccc(C2CC2)cc1)NC(=O)CN(C)C1CCC1 ZINC001497829195 1401681979 /nfs/dbraw/zinc/68/19/79/1401681979.db2.gz KUDXGBINVQXYRS-OAHLLOKOSA-N 1 3 329.488 2.643 10 0 EFAEHO CCC(CC)C[NH2+]C[C@@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001497910788 1401735021 /nfs/dbraw/zinc/73/50/21/1401735021.db2.gz QAUPIIPRWBIELA-KDOFPFPSSA-N 1 3 329.504 2.729 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001497910683 1401735041 /nfs/dbraw/zinc/73/50/41/1401735041.db2.gz MEDNGGMMJJTWAN-JKNDDFDJSA-N 1 3 327.488 2.650 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CCCCC(F)(F)F ZINC001498041726 1401825568 /nfs/dbraw/zinc/82/55/68/1401825568.db2.gz FLORYTPWEWLJAY-UONOGXRCSA-N 1 3 337.430 2.686 10 0 EFAEHO CCC(CC)C[NH2+]C[C@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001498118251 1401864330 /nfs/dbraw/zinc/86/43/30/1401864330.db2.gz QAUPIIPRWBIELA-KSSFIOAISA-N 1 3 329.504 2.729 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+]CCc1ccccc1)C(C)(C)C)C1CCC1 ZINC001507950434 1407221376 /nfs/dbraw/zinc/22/13/76/1407221376.db2.gz FGWZWDULLJYTNB-LJQANCHMSA-N 1 3 345.531 2.834 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(CF)cc1 ZINC001498281693 1401972703 /nfs/dbraw/zinc/97/27/03/1401972703.db2.gz QYGYSCRQDODBAE-QFBILLFUSA-N 1 3 349.494 2.965 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(CF)cc1 ZINC001498281693 1401972706 /nfs/dbraw/zinc/97/27/06/1401972706.db2.gz QYGYSCRQDODBAE-QFBILLFUSA-N 1 3 349.494 2.965 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)Cc2ccc(F)cc2C)CC[N@@H+]1C ZINC001498287049 1401977737 /nfs/dbraw/zinc/97/77/37/1401977737.db2.gz DFHABMDGYTXGKN-AYOQOUSVSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)Cc2ccc(F)cc2C)CC[N@H+]1C ZINC001498287049 1401977738 /nfs/dbraw/zinc/97/77/38/1401977738.db2.gz DFHABMDGYTXGKN-AYOQOUSVSA-N 1 3 349.494 2.801 10 0 EFAEHO C[C@@H](C[N@H+](C)CC1CC2(CCC2)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001498358105 1402035525 /nfs/dbraw/zinc/03/55/25/1402035525.db2.gz WUYJNYNLPUAXRX-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC1CC2(CCC2)C1)NC(=O)C(C)(C)N1CCCC1 ZINC001498358105 1402035528 /nfs/dbraw/zinc/03/55/28/1402035528.db2.gz WUYJNYNLPUAXRX-INIZCTEOSA-N 1 3 335.536 2.878 10 0 EFAEHO CCCc1ccc(C[N@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001498381509 1402056265 /nfs/dbraw/zinc/05/62/65/1402056265.db2.gz PWMSSMXUGVMPRE-ZWKOTPCHSA-N 1 3 345.531 2.917 10 0 EFAEHO CCCc1ccc(C[N@@H+](C)C[C@@H](C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001498381509 1402056268 /nfs/dbraw/zinc/05/62/68/1402056268.db2.gz PWMSSMXUGVMPRE-ZWKOTPCHSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCCC[C@@H]1C[NH2+]Cc1ccsc1 ZINC001498504675 1402150432 /nfs/dbraw/zinc/15/04/32/1402150432.db2.gz PDEHYAJJEJLGHF-IAGOWNOFSA-N 1 3 337.533 2.853 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]CCCN(C)C(=O)[C@@H]2CCCN2C)c1 ZINC001498525417 1402160373 /nfs/dbraw/zinc/16/03/73/1402160373.db2.gz AAISFULASNKYID-MJGOQNOKSA-N 1 3 331.504 2.897 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]CCCN(C)C(=O)[C@@H]2CCCN2C)c1 ZINC001498525410 1402160506 /nfs/dbraw/zinc/16/05/06/1402160506.db2.gz AAISFULASNKYID-HKUYNNGSSA-N 1 3 331.504 2.897 10 0 EFAEHO Cc1cc(C[NH2+]CCCN(C)C(=O)C2(N(C)C)CCC2)c(C)s1 ZINC001498561144 1402176240 /nfs/dbraw/zinc/17/62/40/1402176240.db2.gz WMJCDKDIWMOIHC-UHFFFAOYSA-N 1 3 337.533 2.787 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+]Cc1cc(Cl)ccc1F)N(C)C ZINC001498588966 1402188421 /nfs/dbraw/zinc/18/84/21/1402188421.db2.gz ZCLIUKWHEPXYMQ-MRXNPFEDSA-N 1 3 343.874 2.757 10 0 EFAEHO Cc1ccc(C[NH2+]CCCN(C)C(=O)[C@@H](C(C)C)N(C)C)cc1F ZINC001498610658 1402199796 /nfs/dbraw/zinc/19/97/96/1402199796.db2.gz HCVZRWCRZMGPBW-GOSISDBHSA-N 1 3 337.483 2.658 10 0 EFAEHO CN(CCC[NH2+][C@H]1CCc2c1cccc2Cl)C(=O)Cc1c[nH]cn1 ZINC001498618961 1402205445 /nfs/dbraw/zinc/20/54/45/1402205445.db2.gz LCSIGFRSMAFHGE-KRWDZBQOSA-N 1 3 346.862 2.731 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CCC[NH2+]CC=C(Cl)Cl ZINC001498658910 1402232393 /nfs/dbraw/zinc/23/23/93/1402232393.db2.gz TYDKQKOJBQHRBI-ZDUSSCGKSA-N 1 3 336.307 2.618 10 0 EFAEHO Cc1cccc(Cl)c1CNC[C@@H](NC(=O)CC[NH+](C)C)C1CC1 ZINC001498816685 1402310404 /nfs/dbraw/zinc/31/04/04/1402310404.db2.gz IPQDRXNOTFTGSY-QGZVFWFLSA-N 1 3 337.895 2.585 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CC[N@@H+]1CC1CCCC1)N1CCCCC1 ZINC001499128474 1402487193 /nfs/dbraw/zinc/48/71/93/1402487193.db2.gz XMJNBZKUUZWUFV-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CC[N@H+]1CC1CCCC1)N1CCCCC1 ZINC001499128474 1402487197 /nfs/dbraw/zinc/48/71/97/1402487197.db2.gz XMJNBZKUUZWUFV-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCC1(NCc2cccc(Cl)c2)CC1 ZINC001499254286 1402539146 /nfs/dbraw/zinc/53/91/46/1402539146.db2.gz MCZLFRMYMLBJAR-QGZVFWFLSA-N 1 3 349.906 2.953 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCC1(NCc2cccc(Cl)c2)CC1 ZINC001499254286 1402539149 /nfs/dbraw/zinc/53/91/49/1402539149.db2.gz MCZLFRMYMLBJAR-QGZVFWFLSA-N 1 3 349.906 2.953 10 0 EFAEHO O=C(CN1CCCC1)N1CCC([N@H+](C/C=C/Cl)CC2CC2)CC1 ZINC001499530094 1402664161 /nfs/dbraw/zinc/66/41/61/1402664161.db2.gz LJYNHUPNYKDFBL-FPYGCLRLSA-N 1 3 339.911 2.538 10 0 EFAEHO O=C(CN1CCCC1)N1CCC([N@@H+](C/C=C/Cl)CC2CC2)CC1 ZINC001499530094 1402664169 /nfs/dbraw/zinc/66/41/69/1402664169.db2.gz LJYNHUPNYKDFBL-FPYGCLRLSA-N 1 3 339.911 2.538 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC[C@@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001499573380 1402692819 /nfs/dbraw/zinc/69/28/19/1402692819.db2.gz CRNWGWULNRPOCW-LJQANCHMSA-N 1 3 332.492 2.703 10 0 EFAEHO CC(C)CCC[N@H+]1CCC[C@@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001499573380 1402692822 /nfs/dbraw/zinc/69/28/22/1402692822.db2.gz CRNWGWULNRPOCW-LJQANCHMSA-N 1 3 332.492 2.703 10 0 EFAEHO CC/C=C\CC[NH+]1CCC([C@H](C)NC(=O)CN2CC[C@@H](C)C2)CC1 ZINC001508081138 1407285548 /nfs/dbraw/zinc/28/55/48/1407285548.db2.gz LXVKRTLOVNEXEQ-WIJVFFIESA-N 1 3 335.536 2.901 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@H]2C[NH2+]CCCc2ccsc2)C1 ZINC001499927139 1402858182 /nfs/dbraw/zinc/85/81/82/1402858182.db2.gz YMIUSFZDOBWOPM-AEFFLSMTSA-N 1 3 349.544 2.603 10 0 EFAEHO Cc1ccccc1CCC[NH2+]C[C@@H]1CCCN1C(=O)CN1CCCC1 ZINC001499950349 1402866584 /nfs/dbraw/zinc/86/65/84/1402866584.db2.gz FESYHUFLDLSDOJ-FQEVSTJZSA-N 1 3 343.515 2.604 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CC[C@@H](C(F)(F)F)[C@H](NCC=C(C)C)C1 ZINC001508087682 1407291149 /nfs/dbraw/zinc/29/11/49/1407291149.db2.gz QQVBNUCRYUQZNR-HUUCEWRRSA-N 1 3 349.441 2.663 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CC[C@@H](C(F)(F)F)[C@H](NCC=C(C)C)C1 ZINC001508087682 1407291155 /nfs/dbraw/zinc/29/11/55/1407291155.db2.gz QQVBNUCRYUQZNR-HUUCEWRRSA-N 1 3 349.441 2.663 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@@H](NC(=O)C(C)(C)N1CCCC1)C1CCCC1 ZINC001500105025 1402939071 /nfs/dbraw/zinc/93/90/71/1402939071.db2.gz GHMODHMJSWLRJT-IAGOWNOFSA-N 1 3 341.515 2.874 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@]1(C)CCN(CCCCC(F)(F)F)C1 ZINC001500254011 1403010576 /nfs/dbraw/zinc/01/05/76/1403010576.db2.gz NVUYYDOYSIOADO-HNNXBMFYSA-N 1 3 337.430 2.641 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@]1(C)CCN(CCCCC(F)(F)F)C1 ZINC001500254012 1403010631 /nfs/dbraw/zinc/01/06/31/1403010631.db2.gz NVUYYDOYSIOADO-OAHLLOKOSA-N 1 3 337.430 2.641 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N1CC[C@@](C)(C[NH2+]C/C=C\Cl)C1 ZINC001500382053 1403087123 /nfs/dbraw/zinc/08/71/23/1403087123.db2.gz JVGAKBRXQGHNGI-BTILFOLHSA-N 1 3 341.927 2.830 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@]1(C)CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001500405571 1403101848 /nfs/dbraw/zinc/10/18/48/1403101848.db2.gz ZEMHJQZQBOYPKN-JXFKEZNVSA-N 1 3 349.494 2.938 10 0 EFAEHO CCCN1CCC(F)(F)[C@@H](CNC(=O)CCCC[NH+]2CCCC2)C1 ZINC001500619996 1403254225 /nfs/dbraw/zinc/25/42/25/1403254225.db2.gz GANGTDZTSQCYQY-INIZCTEOSA-N 1 3 345.478 2.736 10 0 EFAEHO CC(C)c1cccc(C[NH2+]C2CC(N(C)C(=O)CN(C)C(C)C)C2)n1 ZINC001508154123 1407317949 /nfs/dbraw/zinc/31/79/49/1407317949.db2.gz DULOHNJCTIZFOI-UHFFFAOYSA-N 1 3 346.519 2.624 10 0 EFAEHO CC(C)C[NH+]1CCC([C@H]2CCCN(C(=O)CN(C)C(C)C)C2)CC1 ZINC001501016162 1403406354 /nfs/dbraw/zinc/40/63/54/1403406354.db2.gz ULDCSLKSPMXGOS-IBGZPJMESA-N 1 3 337.552 2.933 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2cccc(CC)c2)C1 ZINC001501150736 1403461317 /nfs/dbraw/zinc/46/13/17/1403461317.db2.gz XQYHDFSVVZRJML-PXNSSMCTSA-N 1 3 345.531 2.775 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@H]1CC[C@H](C[NH2+]CCF)CC1 ZINC001501188404 1403483101 /nfs/dbraw/zinc/48/31/01/1403483101.db2.gz IJWVJDUKTYHPKK-KZNAEPCWSA-N 1 3 341.515 2.731 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H]2[C@@H]1CC[N@@H+]2CC=C(C)C ZINC001501390244 1403582149 /nfs/dbraw/zinc/58/21/49/1403582149.db2.gz HVWOVLQAKOKCDK-BZSNNMDCSA-N 1 3 339.499 2.698 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCC[C@H]2[C@@H]1CC[N@H+]2CC=C(C)C ZINC001501390244 1403582151 /nfs/dbraw/zinc/58/21/51/1403582151.db2.gz HVWOVLQAKOKCDK-BZSNNMDCSA-N 1 3 339.499 2.698 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(F)cc1 ZINC001501403405 1403590581 /nfs/dbraw/zinc/59/05/81/1403590581.db2.gz IJQJAHVCPNHEJJ-RTBURBONSA-N 1 3 347.478 2.733 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(F)cc1 ZINC001501403405 1403590584 /nfs/dbraw/zinc/59/05/84/1403590584.db2.gz IJQJAHVCPNHEJJ-RTBURBONSA-N 1 3 347.478 2.733 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@H+](CC2CC(C)(C)C2)CC1)C1CCC1 ZINC001508205648 1407343109 /nfs/dbraw/zinc/34/31/09/1407343109.db2.gz GJLARPORACVMKG-UHFFFAOYSA-N 1 3 333.520 2.655 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@@H+](CC2CC(C)(C)C2)CC1)C1CCC1 ZINC001508205648 1407343111 /nfs/dbraw/zinc/34/31/11/1407343111.db2.gz GJLARPORACVMKG-UHFFFAOYSA-N 1 3 333.520 2.655 10 0 EFAEHO CN(CC(=O)N1CC[C@H](CC[NH2+]Cc2ccc(F)cc2)C1)C1CCC1 ZINC001501577989 1403634652 /nfs/dbraw/zinc/63/46/52/1403634652.db2.gz GPDDCNFCIKVKEX-KRWDZBQOSA-N 1 3 347.478 2.638 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@H](CC[NH2+]Cc2ccc(CF)cc2)C1 ZINC001501604704 1403643502 /nfs/dbraw/zinc/64/35/02/1403643502.db2.gz XASFXGJDOGOISI-RBUKOAKNSA-N 1 3 347.478 2.579 10 0 EFAEHO CN(CCC[N@H+](C)Cc1ccc2c(c1)CCC2)C(=O)CN1CCCC1 ZINC001502397014 1404137415 /nfs/dbraw/zinc/13/74/15/1404137415.db2.gz NJZRMOTZQDFPIF-UHFFFAOYSA-N 1 3 343.515 2.551 10 0 EFAEHO CN(CCC[N@@H+](C)Cc1ccc2c(c1)CCC2)C(=O)CN1CCCC1 ZINC001502397014 1404137422 /nfs/dbraw/zinc/13/74/22/1404137422.db2.gz NJZRMOTZQDFPIF-UHFFFAOYSA-N 1 3 343.515 2.551 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H]2CCC[N@H+](CC3CC3)C2)C1 ZINC001502404907 1404146272 /nfs/dbraw/zinc/14/62/72/1404146272.db2.gz OUOMNXGIBCRNLB-RTBURBONSA-N 1 3 335.536 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H]2CCC[N@@H+](CC3CC3)C2)C1 ZINC001502404907 1404146282 /nfs/dbraw/zinc/14/62/82/1404146282.db2.gz OUOMNXGIBCRNLB-RTBURBONSA-N 1 3 335.536 2.687 10 0 EFAEHO CCC1([NH2+]Cc2ccc(C)cc2)CCN(C(=O)CN2CCCC2)CC1 ZINC001502515758 1404213254 /nfs/dbraw/zinc/21/32/54/1404213254.db2.gz MCWIDZDCAIJSIM-UHFFFAOYSA-N 1 3 343.515 2.952 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@]2(C1)CCCN(C(=O)[C@@H](CC)N(C)C)C2 ZINC001502543692 1404232168 /nfs/dbraw/zinc/23/21/68/1404232168.db2.gz LGHBMXFGBPRHML-IELZWVCUSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@]2(C1)CCCN(C(=O)[C@@H](CC)N(C)C)C2 ZINC001502543692 1404232176 /nfs/dbraw/zinc/23/21/76/1404232176.db2.gz LGHBMXFGBPRHML-IELZWVCUSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H]([NH2+]CCCc2ccc(C)cc2)C1 ZINC001502754559 1404325543 /nfs/dbraw/zinc/32/55/43/1404325543.db2.gz SUCYQCFACDTTHG-AZUAARDMSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)CC[N@@H+]1Cc1ccsc1 ZINC001502933946 1404436659 /nfs/dbraw/zinc/43/66/59/1404436659.db2.gz NLCKPWWHKGOCNQ-ZBFHGGJFSA-N 1 3 335.517 2.702 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)C2(N(C)C)CCC2)CC[N@H+]1Cc1ccsc1 ZINC001502933946 1404436661 /nfs/dbraw/zinc/43/66/61/1404436661.db2.gz NLCKPWWHKGOCNQ-ZBFHGGJFSA-N 1 3 335.517 2.702 10 0 EFAEHO CC[N@H+](CC=C(C)C)CC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001505396919 1404549429 /nfs/dbraw/zinc/54/94/29/1404549429.db2.gz VYQPXPZLMOWHLS-UHFFFAOYSA-N 1 3 335.536 2.997 10 0 EFAEHO CC[N@@H+](CC=C(C)C)CC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001505396919 1404549435 /nfs/dbraw/zinc/54/94/35/1404549435.db2.gz VYQPXPZLMOWHLS-UHFFFAOYSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]CC2CCC(F)(F)CC2)C1 ZINC001505537531 1404747791 /nfs/dbraw/zinc/74/77/91/1404747791.db2.gz BPVSTOREIBHYHN-UHFFFAOYSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H](C)[NH2+]Cc1ccc(C(F)F)cc1 ZINC001505761788 1405036235 /nfs/dbraw/zinc/03/62/35/1405036235.db2.gz VUQATEBQJKJTJT-UONOGXRCSA-N 1 3 341.446 2.947 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N(C)CC(C)(C)C[NH2+]Cc1ccccn1 ZINC001505850537 1405141468 /nfs/dbraw/zinc/14/14/68/1405141468.db2.gz ZPRDXJHHDGCGIO-IRXDYDNUSA-N 1 3 346.519 2.529 10 0 EFAEHO Cc1cc(CN(C)[C@@H](C)CNC(=O)[C@H]2C[NH+]3CCC2CC3)c(C)s1 ZINC001505920508 1405226070 /nfs/dbraw/zinc/22/60/70/1405226070.db2.gz NQULHYBXYIYVFB-UGSOOPFHSA-N 1 3 349.544 2.643 10 0 EFAEHO Cc1cc(CN(C)[C@H](C)CNC(=O)[C@H]2C[NH+]3CCC2CC3)c(C)s1 ZINC001505920505 1405226138 /nfs/dbraw/zinc/22/61/38/1405226138.db2.gz NQULHYBXYIYVFB-ACJLOTCBSA-N 1 3 349.544 2.643 10 0 EFAEHO C[C@H](c1ccc(F)c(Cl)c1)N(C)[C@@H](C)CNC(=O)CC[NH+](C)C ZINC001505995232 1405321325 /nfs/dbraw/zinc/32/13/25/1405321325.db2.gz UIVSUSSXWMDBPK-QWHCGFSZSA-N 1 3 343.874 2.928 10 0 EFAEHO CCc1cccc(CN(C)[C@H](C)CNC(=O)C[C@@H]2CC[N@H+](C)C2)c1 ZINC001506037931 1405383586 /nfs/dbraw/zinc/38/35/86/1405383586.db2.gz CWNAQXIKMRLDQV-APWZRJJASA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(CN(C)[C@H](C)CNC(=O)C[C@@H]2CC[N@@H+](C)C2)c1 ZINC001506037931 1405383593 /nfs/dbraw/zinc/38/35/93/1405383593.db2.gz CWNAQXIKMRLDQV-APWZRJJASA-N 1 3 331.504 2.527 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H](C)[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001506043301 1405393852 /nfs/dbraw/zinc/39/38/52/1405393852.db2.gz NWOQDWMPQKZDOL-CABCVRRESA-N 1 3 333.467 2.590 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@H](C)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001506043301 1405393862 /nfs/dbraw/zinc/39/38/62/1405393862.db2.gz NWOQDWMPQKZDOL-CABCVRRESA-N 1 3 333.467 2.590 10 0 EFAEHO CC(C)[C@@H](CCN(C)C(=O)CN1CCCC1)[NH2+]CCC(C)(C)C ZINC001506492170 1405846407 /nfs/dbraw/zinc/84/64/07/1405846407.db2.gz ZTSTYFGHRMIUAP-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC1(CNCc2ncccc2C)CCCCC1 ZINC001506521833 1405902711 /nfs/dbraw/zinc/90/27/11/1405902711.db2.gz HUKPIOZJKOIHEQ-UHFFFAOYSA-N 1 3 346.519 2.641 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC1(CNCc2ncccc2C)CCCCC1 ZINC001506521833 1405902719 /nfs/dbraw/zinc/90/27/19/1405902719.db2.gz HUKPIOZJKOIHEQ-UHFFFAOYSA-N 1 3 346.519 2.641 10 0 EFAEHO C[C@@H](NC(=O)CC[C@@H]1CCC[N@@H+]1C)C1CN(CCc2cccs2)C1 ZINC001506630414 1406066788 /nfs/dbraw/zinc/06/67/88/1406066788.db2.gz MTKMXXUGBYXWSG-WBVHZDCISA-N 1 3 349.544 2.602 10 0 EFAEHO C[C@@H](NC(=O)CC[C@@H]1CCC[N@H+]1C)C1CN(CCc2cccs2)C1 ZINC001506630414 1406066795 /nfs/dbraw/zinc/06/67/95/1406066795.db2.gz MTKMXXUGBYXWSG-WBVHZDCISA-N 1 3 349.544 2.602 10 0 EFAEHO CC(C)CC[NH+]1CC([C@@H](C)NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001506657431 1406110633 /nfs/dbraw/zinc/11/06/33/1406110633.db2.gz XMMHYQBMCRFBBP-DNVCBOLYSA-N 1 3 341.515 2.682 10 0 EFAEHO Cc1ccc(CN2CC([C@@H](C)NC(=O)CCCC[NH+](C)C)C2)cc1 ZINC001506664283 1406120033 /nfs/dbraw/zinc/12/00/33/1406120033.db2.gz KOBALPAJAMTFNW-QGZVFWFLSA-N 1 3 331.504 2.663 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)C1CN(Cc2ccc(C3CC3)cc2)C1 ZINC001506667246 1406123967 /nfs/dbraw/zinc/12/39/67/1406123967.db2.gz QVNMISKEEJTOKA-INIZCTEOSA-N 1 3 343.515 2.842 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)C1CN(Cc2ccc(C3CC3)cc2)C1 ZINC001506667246 1406123972 /nfs/dbraw/zinc/12/39/72/1406123972.db2.gz QVNMISKEEJTOKA-INIZCTEOSA-N 1 3 343.515 2.842 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)C1C[NH+](C[C@H]2CCCC(F)(F)C2)C1 ZINC001506671611 1406129951 /nfs/dbraw/zinc/12/99/51/1406129951.db2.gz PEYLVKPAEXHGEJ-CABCVRRESA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1C[NH+](CC/C=C\c2ccccc2)C1 ZINC001506676463 1406136071 /nfs/dbraw/zinc/13/60/71/1406136071.db2.gz AUCOWSQVVBNQCR-QCSXQHJISA-N 1 3 343.515 2.867 10 0 EFAEHO CNC(=O)[C@@H]([NH2+]CCCN1CCC(Cc2ccccc2)CC1)C(C)C ZINC001559794862 1415255548 /nfs/dbraw/zinc/25/55/48/1415255548.db2.gz PGCWIRUPTKSYLG-FQEVSTJZSA-N 1 3 345.531 2.691 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC001564720267 1415381346 /nfs/dbraw/zinc/38/13/46/1415381346.db2.gz XHRGQXBSZROZTI-PKOBYXMFSA-N 1 3 348.535 2.955 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC001564720267 1415381352 /nfs/dbraw/zinc/38/13/52/1415381352.db2.gz XHRGQXBSZROZTI-PKOBYXMFSA-N 1 3 348.535 2.955 10 0 EFAEHO C/C=C\C[C@@H]1CCCN(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)C1 ZINC001565055608 1415388288 /nfs/dbraw/zinc/38/82/88/1415388288.db2.gz GXPGIGVBOSSGQD-PLQXZHKYSA-N 1 3 338.540 2.646 10 0 EFAEHO C/C=C\C[C@@H]1CCCN(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)C1 ZINC001565055608 1415388289 /nfs/dbraw/zinc/38/82/89/1415388289.db2.gz GXPGIGVBOSSGQD-PLQXZHKYSA-N 1 3 338.540 2.646 10 0 EFAEHO CN(C)Cc1cccc(C(=O)NC[C@H]2CC[C@@H]([NH2+]CCCF)C2)c1 ZINC001565919666 1415449326 /nfs/dbraw/zinc/44/93/26/1415449326.db2.gz KEJGVZYKBOVAFN-MAUKXSAKSA-N 1 3 335.467 2.596 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)[C@@H]3CCCCN3CC)C[C@@H]2C1 ZINC001566055290 1415494280 /nfs/dbraw/zinc/49/42/80/1415494280.db2.gz RHZOODSXFGDCAC-ZOYAEOFMSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)[C@@H]3CCCCN3CC)C[C@@H]2C1 ZINC001566055290 1415494282 /nfs/dbraw/zinc/49/42/82/1415494282.db2.gz RHZOODSXFGDCAC-ZOYAEOFMSA-N 1 3 347.547 2.997 10 0 EFAEHO Cc1ccncc1CN(C)CCCNC(=O)[C@H]1CCCC[N@H+]1C(C)C ZINC001566497661 1415588425 /nfs/dbraw/zinc/58/84/25/1415588425.db2.gz CJRMYQCPSNZCHP-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1ccncc1CN(C)CCCNC(=O)[C@H]1CCCC[N@@H+]1C(C)C ZINC001566497661 1415588427 /nfs/dbraw/zinc/58/84/27/1415588427.db2.gz CJRMYQCPSNZCHP-LJQANCHMSA-N 1 3 346.519 2.591 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@@H+](C)CC1CCC(C)(C)CC1 ZINC001566512010 1415601800 /nfs/dbraw/zinc/60/18/00/1415601800.db2.gz BFINOKYDPFLQJE-UHFFFAOYSA-N 1 3 334.508 2.915 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC[N@H+](C)CC1CCC(C)(C)CC1 ZINC001566512010 1415601802 /nfs/dbraw/zinc/60/18/02/1415601802.db2.gz BFINOKYDPFLQJE-UHFFFAOYSA-N 1 3 334.508 2.915 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1ccc(C)c(F)c1 ZINC001566564954 1415647305 /nfs/dbraw/zinc/64/73/05/1415647305.db2.gz JUIBTHGNUYSODM-INIZCTEOSA-N 1 3 349.494 2.804 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1ccc(C)c(F)c1 ZINC001566564954 1415647307 /nfs/dbraw/zinc/64/73/07/1415647307.db2.gz JUIBTHGNUYSODM-INIZCTEOSA-N 1 3 349.494 2.804 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@H+](CC2=CCCCC2)C2CC2)C1 ZINC001566596711 1415681708 /nfs/dbraw/zinc/68/17/08/1415681708.db2.gz PQXRDCHMWWKIDJ-QGZVFWFLSA-N 1 3 333.520 2.799 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NCCC[N@@H+](CC2=CCCCC2)C2CC2)C1 ZINC001566596711 1415681714 /nfs/dbraw/zinc/68/17/14/1415681714.db2.gz PQXRDCHMWWKIDJ-QGZVFWFLSA-N 1 3 333.520 2.799 10 0 EFAEHO C[C@@H](c1ccccc1F)N(CCCNC(=O)[C@@H]1CC[N@H+](C)C1)C1CC1 ZINC001566602896 1415688151 /nfs/dbraw/zinc/68/81/51/1415688151.db2.gz SCJCUVBUTFCDTK-JKSUJKDBSA-N 1 3 347.478 2.809 10 0 EFAEHO C[C@@H](c1ccccc1F)N(CCCNC(=O)[C@@H]1CC[N@@H+](C)C1)C1CC1 ZINC001566602896 1415688159 /nfs/dbraw/zinc/68/81/59/1415688159.db2.gz SCJCUVBUTFCDTK-JKSUJKDBSA-N 1 3 347.478 2.809 10 0 EFAEHO CC/C=C\CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC1CC[NH+](C)CC1 ZINC001566755994 1415764162 /nfs/dbraw/zinc/76/41/62/1415764162.db2.gz YTBUBYPBXASCBW-SNHAVAMSSA-N 1 3 333.520 2.750 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H]([NH2+]CCCCC(F)(F)F)C1)N(C)C ZINC001566810818 1415781871 /nfs/dbraw/zinc/78/18/71/1415781871.db2.gz HJKXZNCHGLYDJW-MGPQQGTHSA-N 1 3 337.430 2.542 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H]([NH2+]CCCc2ccccc2C)C1)N(C)C ZINC001566811226 1415782433 /nfs/dbraw/zinc/78/24/33/1415782433.db2.gz PMNOCMRUQQGHAQ-FHWLQOOXSA-N 1 3 331.504 2.505 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)N[C@H]1C[C@H]([NH2+]CCCc2ccsc2)C1 ZINC001566813746 1415783495 /nfs/dbraw/zinc/78/34/95/1415783495.db2.gz MLHXRTTWUGKMJR-LAQRGFTBSA-N 1 3 349.544 2.790 10 0 EFAEHO CN(CC(=O)N1CCC[C@H](C[NH2+]CC=C(Cl)Cl)C1)C1CCC1 ZINC001566895199 1415828422 /nfs/dbraw/zinc/82/84/22/1415828422.db2.gz DFTFNOBWHVBPJC-CYBMUJFWSA-N 1 3 348.318 2.618 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCCC[C@H]1C[NH2+]CCCCCF ZINC001566954100 1415866444 /nfs/dbraw/zinc/86/64/44/1415866444.db2.gz RKCZSRKHZDNJDL-ZWKOTPCHSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]CCCc1cccc(F)c1 ZINC001567041912 1415911029 /nfs/dbraw/zinc/91/10/29/1415911029.db2.gz HPAXDDBFUXTEEK-INIZCTEOSA-N 1 3 349.494 2.727 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H](C[NH2+]CCCCC(F)(F)F)C2)CCC1 ZINC001567127831 1415943444 /nfs/dbraw/zinc/94/34/44/1415943444.db2.gz KAQJQZYZTKHMRR-CQSZACIVSA-N 1 3 349.441 2.641 10 0 EFAEHO CN(CC(=O)N1CC[C@H](C[NH2+]C/C=C/c2ccccc2)C1)C1CCC1 ZINC001567128953 1415944426 /nfs/dbraw/zinc/94/44/26/1415944426.db2.gz YCKUISKPZWPMPJ-MBNRZODZSA-N 1 3 341.499 2.622 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[C@H]1CCC[N@@H+]1C/C=C/Cl ZINC001567265656 1416044492 /nfs/dbraw/zinc/04/44/92/1416044492.db2.gz ALXVXNQVGGJTCP-CZPJPAAGSA-N 1 3 341.927 2.974 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[C@H]1CCC[N@H+]1C/C=C/Cl ZINC001567265656 1416044494 /nfs/dbraw/zinc/04/44/94/1416044494.db2.gz ALXVXNQVGGJTCP-CZPJPAAGSA-N 1 3 341.927 2.974 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@H+](CC2=CCCCC2)C1)N1CCCC1 ZINC001567406743 1416121256 /nfs/dbraw/zinc/12/12/56/1416121256.db2.gz VSTAWVTYMWOCLG-SFHVURJKSA-N 1 3 333.520 2.799 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]1CC[N@@H+](CC2=CCCCC2)C1)N1CCCC1 ZINC001567406743 1416121261 /nfs/dbraw/zinc/12/12/61/1416121261.db2.gz VSTAWVTYMWOCLG-SFHVURJKSA-N 1 3 333.520 2.799 10 0 EFAEHO Cc1cc(C[NH2+]CCN(C)C(=O)CN(C)CC(C)(C)C)c(C)s1 ZINC001567561679 1416188053 /nfs/dbraw/zinc/18/80/53/1416188053.db2.gz YWWLKDOPAVBGLV-UHFFFAOYSA-N 1 3 339.549 2.891 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@@H]2CCC[C@H]3CCC[N@@H+]32)cc1F ZINC001567573843 1416193673 /nfs/dbraw/zinc/19/36/73/1416193673.db2.gz NIBYDCNOOQEAFS-HKUYNNGSSA-N 1 3 347.478 2.699 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@@H]2CCC[C@H]3CCC[N@H+]32)cc1F ZINC001567573843 1416193678 /nfs/dbraw/zinc/19/36/78/1416193678.db2.gz NIBYDCNOOQEAFS-HKUYNNGSSA-N 1 3 347.478 2.699 10 0 EFAEHO CCc1cccc(C[NH2+]CCN(C)C(=O)[C@H]2CCCCN2CC)c1 ZINC001567611696 1416209804 /nfs/dbraw/zinc/20/98/04/1416209804.db2.gz RNPJSKAAQQKLFA-LJQANCHMSA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)=CCN[C@H](CNC(=O)C1(C[NH+](C)C)CC1)c1ccccc1 ZINC001567662470 1416236392 /nfs/dbraw/zinc/23/63/92/1416236392.db2.gz HKMDFFDFEDTXQD-GOSISDBHSA-N 1 3 329.488 2.742 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)[C@@H]1CCN(CC=C(C)C)C1 ZINC001567685173 1416246873 /nfs/dbraw/zinc/24/68/73/1416246873.db2.gz AXEFUWCPCQVBJH-GBESFXJTSA-N 1 3 335.536 2.996 10 0 EFAEHO CCCN(C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)[C@@H]1CCN(CC=C(C)C)C1 ZINC001567685173 1416246875 /nfs/dbraw/zinc/24/68/75/1416246875.db2.gz AXEFUWCPCQVBJH-GBESFXJTSA-N 1 3 335.536 2.996 10 0 EFAEHO CC/C=C/CC[NH+]1CC(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001567841231 1416295029 /nfs/dbraw/zinc/29/50/29/1416295029.db2.gz UKWUZIAWPFFRCL-OVKVCFKUSA-N 1 3 339.499 2.603 10 0 EFAEHO O=C(N[C@@H]1CCN(CCCCCF)C1)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC001567891040 1416310918 /nfs/dbraw/zinc/31/09/18/1416310918.db2.gz GQOGMGQURUPCDK-SJLPKXTDSA-N 1 3 339.499 2.724 10 0 EFAEHO O=C(N[C@@H]1CCN(CCCCCF)C1)[C@H]1CCC[N@H+]1C1CCCC1 ZINC001567891040 1416310922 /nfs/dbraw/zinc/31/09/22/1416310922.db2.gz GQOGMGQURUPCDK-SJLPKXTDSA-N 1 3 339.499 2.724 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC[C@H](CC[NH2+]CC2CCC2)C1 ZINC001568076305 1416398102 /nfs/dbraw/zinc/39/81/02/1416398102.db2.gz NFLRCOLWNHIPKZ-MOPGFXCFSA-N 1 3 335.536 2.879 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC(CC[NH2+]Cc2cccc(F)c2)CC1 ZINC001568081432 1416401232 /nfs/dbraw/zinc/40/12/32/1416401232.db2.gz ZPVVAOZLTSCMLR-IBGZPJMESA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)C[NH2+]CCC1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001568093794 1416406644 /nfs/dbraw/zinc/40/66/44/1416406644.db2.gz DGOZJNFWMFUOTJ-UHFFFAOYSA-N 1 3 325.541 2.839 10 0 EFAEHO CC[C@H](C(=O)N1CCC(CC[NH2+]CC2CC(C)(C)C2)CC1)N(C)C ZINC001568097213 1416408756 /nfs/dbraw/zinc/40/87/56/1416408756.db2.gz ZQWFNSNKNZZYHI-GOSISDBHSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)NCc1ccc(CNC/C=C\Cl)cc1)[NH+](C)C ZINC001568121943 1416418226 /nfs/dbraw/zinc/41/82/26/1416418226.db2.gz TZBMDCYYSVBEJG-OCKNTNFFSA-N 1 3 337.895 2.731 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NCc1ccc(C[NH2+]CCCF)cc1 ZINC001568121978 1416418529 /nfs/dbraw/zinc/41/85/29/1416418529.db2.gz UXZPELVBZASYIT-SFHVURJKSA-N 1 3 335.467 2.626 10 0 EFAEHO CC(C)CCC[NH2+]C[C@@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001568193616 1416437460 /nfs/dbraw/zinc/43/74/60/1416437460.db2.gz HJSBFLLCZBTPGI-APWZRJJASA-N 1 3 343.531 2.977 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@H](C)C[NH2+]CCc1ccccc1 ZINC001568197418 1416438952 /nfs/dbraw/zinc/43/89/52/1416438952.db2.gz UNIMUJGRANLOHW-AZUAARDMSA-N 1 3 345.531 2.834 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]CC[C@@H]1CCCC1(F)F ZINC001568320336 1416475337 /nfs/dbraw/zinc/47/53/37/1416475337.db2.gz FXUQDMQCISEIOM-GJZGRUSLSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N[C@H](CNCCF)C1CCCCC1 ZINC001568343996 1416484608 /nfs/dbraw/zinc/48/46/08/1416484608.db2.gz UVSPKOKOONWBAE-MSOLQXFVSA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N[C@H](CNCCF)C1CCCCC1 ZINC001568343996 1416484610 /nfs/dbraw/zinc/48/46/10/1416484610.db2.gz UVSPKOKOONWBAE-MSOLQXFVSA-N 1 3 341.515 2.731 10 0 EFAEHO CCN(CC[NH2+]Cc1ccn(C(C)C)n1)C(=O)C1CCCC(F)C1 ZINC001568742234 1416545516 /nfs/dbraw/zinc/54/55/16/1416545516.db2.gz OCHJAQATFHCTTD-JKSUJKDBSA-N 1 3 338.471 2.930 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc(OC)n1)C(=O)C1CCCC(F)C1 ZINC001568742476 1416545745 /nfs/dbraw/zinc/54/57/45/1416545745.db2.gz UHELFYSGAVQOMB-LSDHHAIUSA-N 1 3 337.439 2.557 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@H+](CC)Cc1cncc(C)c1 ZINC001689970241 1417113540 /nfs/dbraw/zinc/11/35/40/1417113540.db2.gz IUBCXHZQFFUPON-LJQANCHMSA-N 1 3 346.519 2.593 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCCC[N@@H+](CC)Cc1cncc(C)c1 ZINC001689970241 1417113544 /nfs/dbraw/zinc/11/35/44/1417113544.db2.gz IUBCXHZQFFUPON-LJQANCHMSA-N 1 3 346.519 2.593 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC12CC[NH+](CCCCCF)CC2)N(C)C ZINC001690127020 1417159982 /nfs/dbraw/zinc/15/99/82/1417159982.db2.gz ZFRORVPXKNQALR-DLBZAZTESA-N 1 3 341.515 2.683 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(C[C@@H]2NC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001690127959 1417161119 /nfs/dbraw/zinc/16/11/19/1417161119.db2.gz HJVRXCMYRXORTH-OPDSQHBBSA-N 1 3 335.536 2.900 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]([NH2+]CCC2=CCCCC2)C2CC2)C1 ZINC001690169125 1417168930 /nfs/dbraw/zinc/16/89/30/1417168930.db2.gz UQVMHIXBLFQIJI-APWZRJJASA-N 1 3 333.520 2.703 10 0 EFAEHO CN(C)C1(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@H+]3CCCCCF)CCC1 ZINC001690307960 1417187162 /nfs/dbraw/zinc/18/71/62/1417187162.db2.gz VKDHNTDQMJZRPC-ALOPSCKCSA-N 1 3 339.499 2.722 10 0 EFAEHO CN(C)C1(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3CCCCCF)CCC1 ZINC001690307960 1417187163 /nfs/dbraw/zinc/18/71/63/1417187163.db2.gz VKDHNTDQMJZRPC-ALOPSCKCSA-N 1 3 339.499 2.722 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](C[NH2+]CCCCCF)C1 ZINC001690437052 1417214761 /nfs/dbraw/zinc/21/47/61/1417214761.db2.gz VOLKRAZRMYCRPI-QZTJIDSGSA-N 1 3 341.515 2.829 10 0 EFAEHO O=C([C@H]1CCCC[N@@H+]1C1CCCC1)N1CCCC[C@@H]1CNCCF ZINC001690477704 1417215867 /nfs/dbraw/zinc/21/58/67/1417215867.db2.gz SALJEVXGKUFWPT-QZTJIDSGSA-N 1 3 339.499 2.724 10 0 EFAEHO O=C([C@H]1CCCC[N@H+]1C1CCCC1)N1CCCC[C@@H]1CNCCF ZINC001690477704 1417215870 /nfs/dbraw/zinc/21/58/70/1417215870.db2.gz SALJEVXGKUFWPT-QZTJIDSGSA-N 1 3 339.499 2.724 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@H](N(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001698568558 1417305845 /nfs/dbraw/zinc/30/58/45/1417305845.db2.gz DSXFUCRJMZJZCO-VQIMIIECSA-N 1 3 341.515 2.922 10 0 EFAEHO CCCCC[N@H+]1CC[C@@H](N(C)C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001698568558 1417305849 /nfs/dbraw/zinc/30/58/49/1417305849.db2.gz DSXFUCRJMZJZCO-VQIMIIECSA-N 1 3 341.515 2.922 10 0 EFAEHO CC(C)CC[NH2+]Cc1ccc(CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001698716068 1417318139 /nfs/dbraw/zinc/31/81/39/1417318139.db2.gz LKDZVXYLYHKNOI-QGZVFWFLSA-N 1 3 331.504 2.780 10 0 EFAEHO CN(CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2CCCCCF)C1)C1CCC1 ZINC001699007881 1417365908 /nfs/dbraw/zinc/36/59/08/1417365908.db2.gz GPFSCDQBZCAKBP-SJLPKXTDSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2CCCCCF)C1)C1CCC1 ZINC001699007881 1417365910 /nfs/dbraw/zinc/36/59/10/1417365910.db2.gz GPFSCDQBZCAKBP-SJLPKXTDSA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@H](CC[NH2+]C/C=C\c1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001699133617 1417399131 /nfs/dbraw/zinc/39/91/31/1417399131.db2.gz FKZKJPXITKCBRR-RPPGEJNMSA-N 1 3 329.488 2.526 10 0 EFAEHO CCCc1ccc(C[NH2+]CCN(CC)C(=O)[C@@H]2CCCN2C)cc1 ZINC001699173028 1417409837 /nfs/dbraw/zinc/40/98/37/1417409837.db2.gz WVNLSYKDCJWJCG-IBGZPJMESA-N 1 3 331.504 2.671 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC/C=C/CNCc1cccc(Cl)c1 ZINC001699269652 1417416102 /nfs/dbraw/zinc/41/61/02/1417416102.db2.gz ABOXZYKFIFBYBZ-ZMUQKWFASA-N 1 3 349.906 2.976 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC/C=C/CNCc1cccc(Cl)c1 ZINC001699269652 1417416104 /nfs/dbraw/zinc/41/61/04/1417416104.db2.gz ABOXZYKFIFBYBZ-ZMUQKWFASA-N 1 3 349.906 2.976 10 0 EFAEHO CC[C@@H](C(=O)N[C@H](C)C[NH2+]CC[C@H]1CCc2ccccc21)N(C)C ZINC001699380150 1417424675 /nfs/dbraw/zinc/42/46/75/1417424675.db2.gz AKKPNDYYONCMAD-SUMDDJOVSA-N 1 3 331.504 2.541 10 0 EFAEHO CN(CCC[NH2+][C@H]1CCCc2ccccc21)C(=O)[C@H]1CCCN1C ZINC001699500340 1417426572 /nfs/dbraw/zinc/42/65/72/1417426572.db2.gz TWSZTAWUKCYJEA-RBUKOAKNSA-N 1 3 329.488 2.596 10 0 EFAEHO CC/C=C\CC[NH2+]C1(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001699662556 1417442559 /nfs/dbraw/zinc/44/25/59/1417442559.db2.gz WSLZVHCYVFDYJZ-LIXSYLKWSA-N 1 3 339.499 2.794 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CCCF)CCN1C(=O)c1cccc(CN(C)C)c1 ZINC001699741541 1417464273 /nfs/dbraw/zinc/46/42/73/1417464273.db2.gz BULLGPNAGLNYEK-QAPCUYQASA-N 1 3 335.467 2.691 10 0 EFAEHO C[C@@H]1CN(C(=O)CN(C)C2CCC2)C[C@@H]1C[NH2+]CCC1CCCC1 ZINC001699961562 1417526275 /nfs/dbraw/zinc/52/62/75/1417526275.db2.gz XTVXAYLIGUTTAF-AEFFLSMTSA-N 1 3 335.536 2.735 10 0 EFAEHO CCC/C=C/CC[N@H+]1C[C@H]2CN(C(=O)CN3CCC(C)CC3)C[C@H]2C1 ZINC001699991570 1417538788 /nfs/dbraw/zinc/53/87/88/1417538788.db2.gz PXALNCFQRGMVEA-VGIQHARFSA-N 1 3 347.547 2.855 10 0 EFAEHO CCC/C=C/CC[N@@H+]1C[C@H]2CN(C(=O)CN3CCC(C)CC3)C[C@H]2C1 ZINC001699991570 1417538792 /nfs/dbraw/zinc/53/87/92/1417538792.db2.gz PXALNCFQRGMVEA-VGIQHARFSA-N 1 3 347.547 2.855 10 0 EFAEHO CCC/C=C\CC[N@H+]1C[C@H]2CN(C(=O)CN3CCC(C)CC3)C[C@H]2C1 ZINC001699991569 1417539637 /nfs/dbraw/zinc/53/96/37/1417539637.db2.gz PXALNCFQRGMVEA-GGJLBNBESA-N 1 3 347.547 2.855 10 0 EFAEHO CCC/C=C\CC[N@@H+]1C[C@H]2CN(C(=O)CN3CCC(C)CC3)C[C@H]2C1 ZINC001699991569 1417539642 /nfs/dbraw/zinc/53/96/42/1417539642.db2.gz PXALNCFQRGMVEA-GGJLBNBESA-N 1 3 347.547 2.855 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)NCCCN(C)Cc2ccsc2)C1 ZINC001707398924 1418237827 /nfs/dbraw/zinc/23/78/27/1418237827.db2.gz BCMFUEFFVWXIFV-QGZVFWFLSA-N 1 3 337.533 2.808 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)NCCCN(C)Cc2ccsc2)C1 ZINC001707398924 1418237833 /nfs/dbraw/zinc/23/78/33/1418237833.db2.gz BCMFUEFFVWXIFV-QGZVFWFLSA-N 1 3 337.533 2.808 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1C[C@@H]([NH2+]CCCCC(F)(F)F)C1 ZINC001713192285 1418369364 /nfs/dbraw/zinc/36/93/64/1418369364.db2.gz KQGYCQQETZBUPT-ZNMIVQPWSA-N 1 3 349.441 2.829 10 0 EFAEHO CCC/C=C/CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1C(C)C ZINC001713281574 1418451549 /nfs/dbraw/zinc/45/15/49/1418451549.db2.gz PTVXGVSIPYWHGK-KUJXZDLGSA-N 1 3 333.520 2.652 10 0 EFAEHO CCC/C=C/CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1C(C)C ZINC001713281574 1418451554 /nfs/dbraw/zinc/45/15/54/1418451554.db2.gz PTVXGVSIPYWHGK-KUJXZDLGSA-N 1 3 333.520 2.652 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](C[NH2+]CC/C=C/c2ccccc2)C1)N(C)C ZINC001713354423 1418487667 /nfs/dbraw/zinc/48/76/67/1418487667.db2.gz NHCQFPPYFIEMRB-NZONOLPTSA-N 1 3 343.515 2.868 10 0 EFAEHO O=C(CN1CCCC1)N1CCC(CC[NH2+]Cc2ccc(F)cc2)CC1 ZINC001714290705 1418594335 /nfs/dbraw/zinc/59/43/35/1418594335.db2.gz AZOBGURQDQVXEK-UHFFFAOYSA-N 1 3 347.478 2.640 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+]C/C=C\Cl)C1CCCCC1)C1CCC1 ZINC001714973908 1418644414 /nfs/dbraw/zinc/64/44/14/1418644414.db2.gz GTQSZUZMZRPYDI-KOJMWDNASA-N 1 3 341.927 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\C[NH2+][C@H]1CCc2c1cccc2F)N(C)C ZINC001715831173 1418685031 /nfs/dbraw/zinc/68/50/31/1418685031.db2.gz XMTQDZRCPYRNEI-DSQZMVHQSA-N 1 3 347.478 2.661 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C/C[NH2+][C@@H]1CCc2c1cccc2F)N(C)C ZINC001715831176 1418685225 /nfs/dbraw/zinc/68/52/25/1418685225.db2.gz XMTQDZRCPYRNEI-YSKLNCTFSA-N 1 3 347.478 2.661 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(Cl)cc1)C(=O)CN(C)C(C)C ZINC001716255911 1418742987 /nfs/dbraw/zinc/74/29/87/1418742987.db2.gz IOYNAOCBIXVQAG-UHFFFAOYSA-N 1 3 325.884 2.618 10 0 EFAEHO Cc1cc(C[NH2+]C/C=C\CNC(=O)C2(N(C)C)CCC2)c(C)s1 ZINC001716302392 1418761186 /nfs/dbraw/zinc/76/11/86/1418761186.db2.gz DUCWJLHKRLLJPY-WAYWQWQTSA-N 1 3 335.517 2.611 10 0 EFAEHO C[C@@H]([NH2+]C/C=C/CNC(=O)[C@H]1CCCN1C)c1cccc(Cl)c1 ZINC001716330562 1418779022 /nfs/dbraw/zinc/77/90/22/1418779022.db2.gz XBORJCYYCCLSDV-LMIZRQEKSA-N 1 3 335.879 2.757 10 0 EFAEHO C[C@@H]([NH2+]C/C=C\CNC(=O)[C@H]1CCCN1C)c1cccc(Cl)c1 ZINC001716330563 1418779284 /nfs/dbraw/zinc/77/92/84/1418779284.db2.gz XBORJCYYCCLSDV-SWTGODCJSA-N 1 3 335.879 2.757 10 0 EFAEHO Cc1ccc(F)cc1CNC/C=C/CNC(=O)C[NH+]1[C@H](C)CC[C@H]1C ZINC001716378668 1418860309 /nfs/dbraw/zinc/86/03/09/1418860309.db2.gz KYGNKYVMDGWNSC-ADDHZHGLSA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1cc(CNC/C=C\CNC(=O)C[NH+]2[C@H](C)CC[C@H]2C)cs1 ZINC001716378587 1418860862 /nfs/dbraw/zinc/86/08/62/1418860862.db2.gz JSBHBOVEQBXKHE-ZYDHHDLOSA-N 1 3 335.517 2.691 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[NH2+]Cc2sccc2Cl)CCC1 ZINC001716546631 1418910093 /nfs/dbraw/zinc/91/00/93/1418910093.db2.gz ZBGLGUXKUDBJQI-UHFFFAOYSA-N 1 3 343.924 2.824 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+]C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001716547613 1418910522 /nfs/dbraw/zinc/91/05/22/1418910522.db2.gz VFLSBWKTPHDQOC-CVEARBPZSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CCC[NH2+][C@@H](C)c1ccc(F)cc1F ZINC001716586842 1418919013 /nfs/dbraw/zinc/91/90/13/1418919013.db2.gz IHWMRWMZXGWJQN-AWEZNQCLSA-N 1 3 341.446 2.804 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@H](C[NH2+]CCC(F)(F)F)C1CC1 ZINC001716624007 1418928077 /nfs/dbraw/zinc/92/80/77/1418928077.db2.gz NBPOBIYYOIQMLR-CABCVRRESA-N 1 3 349.441 2.686 10 0 EFAEHO CC[C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)CC[C@@H]1[NH2+]CCCF ZINC001716642031 1418935942 /nfs/dbraw/zinc/93/59/42/1418935942.db2.gz FVKRCYGNUWOIQW-MJGOQNOKSA-N 1 3 349.494 2.938 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@H]2CCN2CCCCc2ccccc2)CC[N@@H+]1C ZINC001716650717 1418940105 /nfs/dbraw/zinc/94/01/05/1418940105.db2.gz GTMBAYASIGJOAT-MISYRCLQSA-N 1 3 343.515 2.540 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC[C@H]2CCN2CCCCc2ccccc2)CC[N@H+]1C ZINC001716650717 1418940112 /nfs/dbraw/zinc/94/01/12/1418940112.db2.gz GTMBAYASIGJOAT-MISYRCLQSA-N 1 3 343.515 2.540 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2ccccc2)C[C@H]1C ZINC001716770965 1419000917 /nfs/dbraw/zinc/00/09/17/1419000917.db2.gz PPODWFVBJKTGEI-UYAOXDASSA-N 1 3 345.531 2.930 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC[C@](C)(CNC(=O)Cc2nc[nH]c2C)C1 ZINC001716901282 1419086442 /nfs/dbraw/zinc/08/64/42/1419086442.db2.gz FHRDBSDYPLROKZ-ZMBJWTFHSA-N 1 3 332.492 2.835 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC[C@](C)(CNC(=O)Cc2nc[nH]c2C)C1 ZINC001716901282 1419086446 /nfs/dbraw/zinc/08/64/46/1419086446.db2.gz FHRDBSDYPLROKZ-ZMBJWTFHSA-N 1 3 332.492 2.835 10 0 EFAEHO CC(C)=CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@H](C)C1)C2 ZINC001716999824 1419136185 /nfs/dbraw/zinc/13/61/85/1419136185.db2.gz TVIIAGQLMZPYQO-OKYOBFRVSA-N 1 3 333.520 2.654 10 0 EFAEHO CC(C)=CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@H](C)C1)C2 ZINC001716999824 1419136186 /nfs/dbraw/zinc/13/61/86/1419136186.db2.gz TVIIAGQLMZPYQO-OKYOBFRVSA-N 1 3 333.520 2.654 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(CC[NH2+]C/C=C\Cl)Cc2ccccc2)C1 ZINC001717007148 1419143801 /nfs/dbraw/zinc/14/38/01/1419143801.db2.gz QNBGMTGAEDUJBG-VWTAQGJOSA-N 1 3 349.906 2.699 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@H]2CCN(C(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001717086452 1419197349 /nfs/dbraw/zinc/19/73/49/1419197349.db2.gz GNRREEVDPUVFDE-ICSRJNTNSA-N 1 3 345.531 2.909 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@H]3CCCN3C)C2)c1 ZINC001717092725 1419202119 /nfs/dbraw/zinc/20/21/19/1419202119.db2.gz DZIMTPIROCKXJK-UYAOXDASSA-N 1 3 343.515 2.726 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CC[C@H](CC[NH2+]CCCCC(F)(F)F)C1 ZINC001717099841 1419207685 /nfs/dbraw/zinc/20/76/85/1419207685.db2.gz FSPLFBITFJFSIC-ZDUSSCGKSA-N 1 3 346.397 2.513 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN3CCCC3)C2)c(C)c1 ZINC001717111005 1419215882 /nfs/dbraw/zinc/21/58/82/1419215882.db2.gz ZZYVAPJYHGOJRD-LJQANCHMSA-N 1 3 343.515 2.727 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001717111732 1419216441 /nfs/dbraw/zinc/21/64/41/1419216441.db2.gz YRNGFFOBPSFQOM-IBGZPJMESA-N 1 3 345.531 2.972 10 0 EFAEHO CCCC[NH2+]C1(CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CCC1 ZINC001717157818 1419242123 /nfs/dbraw/zinc/24/21/23/1419242123.db2.gz WVPVPOLTRNSKFO-SFHVURJKSA-N 1 3 327.488 2.628 10 0 EFAEHO CC/C=C/CCN1Cc2ccccc2C[C@@H]1CNC(=O)CC[NH+](C)C ZINC001717243815 1419285698 /nfs/dbraw/zinc/28/56/98/1419285698.db2.gz LVEYBIWNUXZMFG-RRFGBZISSA-N 1 3 343.515 2.838 10 0 EFAEHO CC/C=C/CC[N@H+](CC)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001717357568 1419352001 /nfs/dbraw/zinc/35/20/01/1419352001.db2.gz UVXLDPKDICBPDW-AATRIKPKSA-N 1 3 335.536 2.999 10 0 EFAEHO CC/C=C/CC[N@@H+](CC)CC1CCN(C(=O)CN2CCCC2)CC1 ZINC001717357568 1419352004 /nfs/dbraw/zinc/35/20/04/1419352004.db2.gz UVXLDPKDICBPDW-AATRIKPKSA-N 1 3 335.536 2.999 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@H]1C[N@H+](C)CC=C(C)C ZINC001717365448 1419357871 /nfs/dbraw/zinc/35/78/71/1419357871.db2.gz NDQGUVKZXUHVTQ-DLBZAZTESA-N 1 3 327.488 2.555 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)N1CCC[C@H]1C[N@@H+](C)CC=C(C)C ZINC001717365448 1419357874 /nfs/dbraw/zinc/35/78/74/1419357874.db2.gz NDQGUVKZXUHVTQ-DLBZAZTESA-N 1 3 327.488 2.555 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[N@@H+](C)CCCCC(F)(F)F ZINC001717475801 1419410690 /nfs/dbraw/zinc/41/06/90/1419410690.db2.gz FICVXVUTTYZJNQ-ZDUSSCGKSA-N 1 3 337.430 2.640 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[N@H+](C)CCCCC(F)(F)F ZINC001717475801 1419410689 /nfs/dbraw/zinc/41/06/89/1419410689.db2.gz FICVXVUTTYZJNQ-ZDUSSCGKSA-N 1 3 337.430 2.640 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NC2(C[NH2+]CCF)CCCCC2)C1 ZINC001717527569 1419428309 /nfs/dbraw/zinc/42/83/09/1419428309.db2.gz SWGZHFUEZPGDGA-SFHVURJKSA-N 1 3 345.478 2.577 10 0 EFAEHO CCCCCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001717599093 1419463584 /nfs/dbraw/zinc/46/35/84/1419463584.db2.gz LPOPHBLFXLEQSD-NNZMDNLPSA-N 1 3 335.536 2.735 10 0 EFAEHO CCCCCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)C(C)(C)N3CCCC3)[C@@H]2C1 ZINC001717599093 1419463585 /nfs/dbraw/zinc/46/35/85/1419463585.db2.gz LPOPHBLFXLEQSD-NNZMDNLPSA-N 1 3 335.536 2.735 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001717627800 1419476323 /nfs/dbraw/zinc/47/63/23/1419476323.db2.gz ZWVMQQQHUOODBF-OJUCNMNVSA-N 1 3 335.536 2.900 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C1 ZINC001717627800 1419476324 /nfs/dbraw/zinc/47/63/24/1419476324.db2.gz ZWVMQQQHUOODBF-OJUCNMNVSA-N 1 3 335.536 2.900 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CC2(C1)CCC[N@H+](CC=C(C)C)C2 ZINC001717628571 1419477336 /nfs/dbraw/zinc/47/73/36/1419477336.db2.gz AKMZKQSHKIMKLU-KRWDZBQOSA-N 1 3 339.499 2.557 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CC2(C1)CCC[N@@H+](CC=C(C)C)C2 ZINC001717628571 1419477337 /nfs/dbraw/zinc/47/73/37/1419477337.db2.gz AKMZKQSHKIMKLU-KRWDZBQOSA-N 1 3 339.499 2.557 10 0 EFAEHO C[C@H](CCC[NH2+]Cc1cccc(F)c1)NC(=O)CN1CC[C@H](C)C1 ZINC001717684424 1419504616 /nfs/dbraw/zinc/50/46/16/1419504616.db2.gz MHESQOAFTSXGCV-JKSUJKDBSA-N 1 3 335.467 2.542 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CCCc2cccc(C)c2)[C@H]1C ZINC001717803349 1419549220 /nfs/dbraw/zinc/54/92/20/1419549220.db2.gz WBILSUNQMLQNBQ-UYAOXDASSA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@@H](c1ccccc1)[N@H+]1CC=C(CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001718028501 1419667348 /nfs/dbraw/zinc/66/73/48/1419667348.db2.gz PARVJOQISKBPKX-ROUUACIJSA-N 1 3 341.499 2.838 10 0 EFAEHO C[C@@H](c1ccccc1)[N@@H+]1CC=C(CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001718028501 1419667350 /nfs/dbraw/zinc/66/73/50/1419667350.db2.gz PARVJOQISKBPKX-ROUUACIJSA-N 1 3 341.499 2.838 10 0 EFAEHO CC(C)=CCN1CC=C(CNC(=O)CCC[NH+]2CCCCC2)CC1 ZINC001718033491 1419671411 /nfs/dbraw/zinc/67/14/11/1419671411.db2.gz LRJAMWPAQMMSLO-UHFFFAOYSA-N 1 3 333.520 2.967 10 0 EFAEHO CN(CCC[NH2+]Cc1cc(F)ccc1Cl)C(=O)[C@@H]1CCCN1C ZINC001722989968 1424395135 /nfs/dbraw/zinc/39/51/35/1424395135.db2.gz GSOUDRKBUATJSU-INIZCTEOSA-N 1 3 341.858 2.511 10 0 EFAEHO CN(C)C1(C(=O)N(C)CCC[NH2+][C@H]2CCc3c2cccc3F)CCC1 ZINC001723039993 1424408633 /nfs/dbraw/zinc/40/86/33/1424408633.db2.gz RADIVJYDFCGZAK-SFHVURJKSA-N 1 3 347.478 2.735 10 0 EFAEHO CCc1cccc(C[NH2+]CCCN(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001723122706 1424428688 /nfs/dbraw/zinc/42/86/88/1424428688.db2.gz ITWSHJGONIUSOI-QGZVFWFLSA-N 1 3 331.504 2.529 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[NH2+]Cc1cccc(F)c1 ZINC001723202329 1424450406 /nfs/dbraw/zinc/45/04/06/1424450406.db2.gz BTJGRRZLTKQHGA-GOSISDBHSA-N 1 3 335.467 2.638 10 0 EFAEHO C[C@H](C(=O)N[C@H](C[NH2+]CCC(F)(F)F)C1CC1)N1CCCCCC1 ZINC001723334663 1424470039 /nfs/dbraw/zinc/47/00/39/1424470039.db2.gz RSQKOWHGSKIJFC-UKRRQHHQSA-N 1 3 349.441 2.688 10 0 EFAEHO C[C@H](C(=O)N[C@@H](C[NH2+]CCC(F)(F)F)C1CC1)N1CCCCCC1 ZINC001723334662 1424470219 /nfs/dbraw/zinc/47/02/19/1424470219.db2.gz RSQKOWHGSKIJFC-HIFRSBDPSA-N 1 3 349.441 2.688 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CCCCC(F)(F)F)CC1 ZINC001723596391 1424528235 /nfs/dbraw/zinc/52/82/35/1424528235.db2.gz XDGXZQKUVRRTDC-KBPBESRZSA-N 1 3 349.441 2.830 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001723722367 1424569742 /nfs/dbraw/zinc/56/97/42/1424569742.db2.gz VGZKSSOBUBRTLO-HSJMLMCGSA-N 1 3 333.520 2.609 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@]2(CCN(C(=O)CN3CC[C@@H](C)C3)C2)C1 ZINC001723722367 1424569749 /nfs/dbraw/zinc/56/97/49/1424569749.db2.gz VGZKSSOBUBRTLO-HSJMLMCGSA-N 1 3 333.520 2.609 10 0 EFAEHO Cc1ccc(C[NH2+]CC[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c(C)c1 ZINC001724749520 1424979419 /nfs/dbraw/zinc/97/94/19/1424979419.db2.gz NLHYFGVFDRQMTC-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[N@H+](CCCCCF)CC1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001725024213 1425235331 /nfs/dbraw/zinc/23/53/31/1425235331.db2.gz OWMVLRHVKCAUTR-SFHVURJKSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[N@@H+](CCCCCF)CC1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001725024213 1425235334 /nfs/dbraw/zinc/23/53/34/1425235334.db2.gz OWMVLRHVKCAUTR-SFHVURJKSA-N 1 3 341.515 2.781 10 0 EFAEHO CC(C)(C(=O)NC1CC(C[NH2+]CCC(F)(F)F)C1)N1CCCCC1 ZINC001725064466 1425276972 /nfs/dbraw/zinc/27/69/72/1425276972.db2.gz JIFVXCINCAEMDR-UHFFFAOYSA-N 1 3 349.441 2.688 10 0 EFAEHO CN(CC(=O)NC1CC(C[NH2+]C/C=C\c2ccccc2)C1)C1CCC1 ZINC001725063746 1425277001 /nfs/dbraw/zinc/27/70/01/1425277001.db2.gz PDQKGDLDYKHYAM-TWGQIWQCSA-N 1 3 341.499 2.669 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001725091065 1425294218 /nfs/dbraw/zinc/29/42/18/1425294218.db2.gz LUBDLGHKNJKTOS-ZWKOTPCHSA-N 1 3 345.531 2.895 10 0 EFAEHO Cc1cccc(C[NH2+]CCC[C@@H](C)NC(=O)CN2CC[C@H](C)C2)c1 ZINC001725421917 1425565962 /nfs/dbraw/zinc/56/59/62/1425565962.db2.gz YFLJFBGTUMTMOU-ZWKOTPCHSA-N 1 3 331.504 2.711 10 0 EFAEHO CC(C)[NH2+]CCCN(Cc1ccccc1)C(=O)CN1CC[C@@H](C)C1 ZINC001725427137 1425574252 /nfs/dbraw/zinc/57/42/52/1425574252.db2.gz INBLZWJJPMXXQC-GOSISDBHSA-N 1 3 331.504 2.745 10 0 EFAEHO C[C@@H]1C[C@@H]([NH2+]CCCc2ccccc2)CN1C(=O)CN(C)C1CCC1 ZINC001725606053 1425695397 /nfs/dbraw/zinc/69/53/97/1425695397.db2.gz YCYCQHSMEYODCG-IEBWSBKVSA-N 1 3 343.515 2.683 10 0 EFAEHO COCCc1nc(C)c([C@H](C)[NH2+]C[C@H]2CNCCC2(F)F)s1 ZINC000925783907 717897892 /nfs/dbraw/zinc/89/78/92/717897892.db2.gz PIFMCOOOXBPRKR-CMPLNLGQSA-N 1 3 333.448 2.536 10 0 EFAEHO FC(F)(F)C(F)(F)OCCN[C@@H]1CC[NH2+]C[C@H]1C1CCCC1 ZINC000925732191 716716179 /nfs/dbraw/zinc/71/61/79/716716179.db2.gz WQHWLOLMLLRDBK-NWDGAFQWSA-N 1 3 330.341 2.916 10 0 EFAEHO CC[C@@H]([NH2+]C[C@H]1CNCCC1(F)F)c1ccc(C(=O)OC)cc1 ZINC000925779606 717678206 /nfs/dbraw/zinc/67/82/06/717678206.db2.gz YMMDJDYLHOWOSQ-HUUCEWRRSA-N 1 3 326.387 2.759 10 0 EFAEHO COCc1cc([C@@H](C)[NH2+]C[C@H]2CNCCC2(F)F)ccc1OC ZINC000925779915 717694318 /nfs/dbraw/zinc/69/43/18/717694318.db2.gz QGXJDUJKUADISP-IUODEOHRSA-N 1 3 328.403 2.737 10 0 EFAEHO COC(=O)c1cc(CN[C@@H](CCC[NH3+])c2ccccc2)n(C)c1C ZINC000925767902 717734262 /nfs/dbraw/zinc/73/42/62/717734262.db2.gz HLHBLMCYPLMOLV-SFHVURJKSA-N 1 3 329.444 2.690 10 0 EFAEHO COc1cccc(C[C@@H](N[C@@H]2C[NH2+]CC3(CCOCC3)C2)C2CC2)c1 ZINC000925795292 718498283 /nfs/dbraw/zinc/49/82/83/718498283.db2.gz JRTOYYCGAHFETK-AZUAARDMSA-N 1 3 344.499 2.765 10 0 EFAEHO CC1(C)C[C@@H](NCc2ccccc2CN2CCOCC2)C[C@@H]([NH3+])C1 ZINC000925513269 719779308 /nfs/dbraw/zinc/77/93/08/719779308.db2.gz IDTWCJHDRXPCFG-MOPGFXCFSA-N 1 3 331.504 2.514 10 0 EFAEHO COC[C@@H]1CCN(Cc2ccc(CN(C)C)c3c2OC(F)(F)O3)C1 ZINC000894020222 720222186 /nfs/dbraw/zinc/22/21/86/720222186.db2.gz GLGBBEMRXRCWKF-GFCCVEGCSA-N 1 3 342.386 2.538 10 0 EFAEHO COC[C@@H]1CC[N@H+](Cc2ccc(CN(C)C)c3c2OC(F)(F)O3)C1 ZINC000894020222 720222188 /nfs/dbraw/zinc/22/21/88/720222188.db2.gz GLGBBEMRXRCWKF-GFCCVEGCSA-N 1 3 342.386 2.538 10 0 EFAEHO COC[C@@H]1CC[N@@H+](Cc2ccc(CN(C)C)c3c2OC(F)(F)O3)C1 ZINC000894020222 720222192 /nfs/dbraw/zinc/22/21/92/720222192.db2.gz GLGBBEMRXRCWKF-GFCCVEGCSA-N 1 3 342.386 2.538 10 0 EFAEHO CC1(C)C[C@@H](NC[C@H](O)c2cccc(Br)c2)C[C@@H]([NH3+])C1 ZINC000925661113 720818920 /nfs/dbraw/zinc/81/89/20/720818920.db2.gz SJLFJOVHQARHQV-ILXRZTDVSA-N 1 3 341.293 2.978 10 0 EFAEHO CCN1CCN(C[C@@H](C)C[NH2+][C@H](C)c2ccnn2CC2CCC2)CC1 ZINC000924953598 721864820 /nfs/dbraw/zinc/86/48/20/721864820.db2.gz RFJAMAYPIOXTFU-ZWKOTPCHSA-N 1 3 347.551 2.607 10 0 EFAEHO COC(=O)[C@@H]1[C@@H](C[NH2+]CC[C@H](C)N(C)Cc2ccccc2)C1(F)F ZINC000894323931 722092546 /nfs/dbraw/zinc/09/25/46/722092546.db2.gz SJSKCTCBKHRTNI-IMJJTQAJSA-N 1 3 340.414 2.541 10 0 EFAEHO CC(C)[NH+](CCCNCC1CN(C(=O)OC(C)(C)C)C1)C(C)C ZINC000894326599 722097769 /nfs/dbraw/zinc/09/77/69/722097769.db2.gz PMYXXOCUQFDPBH-UHFFFAOYSA-N 1 3 327.513 2.952 10 0 EFAEHO CCOC(=O)C1(C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)CC1 ZINC000894481282 722752709 /nfs/dbraw/zinc/75/27/09/722752709.db2.gz VFZXKYOEFZDSFO-OTWHNJEPSA-N 1 3 342.483 2.972 10 0 EFAEHO CN1CCN(CC[NH2+]Cc2cc3c(cccc3O)s2)CC1(C)C ZINC000894660645 722813095 /nfs/dbraw/zinc/81/30/95/722813095.db2.gz RDYGMYGOFVQRGU-UHFFFAOYSA-N 1 3 333.501 2.723 10 0 EFAEHO CCNC(=O)[C@@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C(C)C ZINC000894858108 722901435 /nfs/dbraw/zinc/90/14/35/722901435.db2.gz YMOOWRSLBYREDD-YRPNKDGESA-N 1 3 343.515 2.790 10 0 EFAEHO COc1ccc([C@H](NC(C)C)C(=O)N(C)[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000896621875 723410560 /nfs/dbraw/zinc/41/05/60/723410560.db2.gz BVDXNZOURJKIET-SUMDDJOVSA-N 1 3 347.503 2.675 10 0 EFAEHO COc1ccc([C@H](NC(C)C)C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000896621875 723410564 /nfs/dbraw/zinc/41/05/64/723410564.db2.gz BVDXNZOURJKIET-SUMDDJOVSA-N 1 3 347.503 2.675 10 0 EFAEHO C[C@H](CCNC[C@@H]1CC(F)(F)CN1C(=O)OC(C)(C)C)[NH+](C)C ZINC000895293047 723997134 /nfs/dbraw/zinc/99/71/34/723997134.db2.gz IVGMASXODDHWFN-OLZOCXBDSA-N 1 3 335.439 2.561 10 0 EFAEHO C[C@H](CC[NH2+]C[C@@H]1CC(F)(F)CN1C(=O)OC(C)(C)C)N(C)C ZINC000895293047 723997140 /nfs/dbraw/zinc/99/71/40/723997140.db2.gz IVGMASXODDHWFN-OLZOCXBDSA-N 1 3 335.439 2.561 10 0 EFAEHO C[C@@H](CCNC[C@H]1CC(F)(F)CN1C(=O)OC(C)(C)C)[NH+](C)C ZINC000895293049 723997469 /nfs/dbraw/zinc/99/74/69/723997469.db2.gz IVGMASXODDHWFN-QWHCGFSZSA-N 1 3 335.439 2.561 10 0 EFAEHO C[C@@H](CC[NH2+]C[C@H]1CC(F)(F)CN1C(=O)OC(C)(C)C)N(C)C ZINC000895293049 723997473 /nfs/dbraw/zinc/99/74/73/723997473.db2.gz IVGMASXODDHWFN-QWHCGFSZSA-N 1 3 335.439 2.561 10 0 EFAEHO COC(=O)C1CC([NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C1 ZINC000895456898 724141429 /nfs/dbraw/zinc/14/14/29/724141429.db2.gz IURMAHIKLLSMLI-UUAFILDGSA-N 1 3 328.456 2.581 10 0 EFAEHO COC(=O)C1CC(N[C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1 ZINC000895456898 724141431 /nfs/dbraw/zinc/14/14/31/724141431.db2.gz IURMAHIKLLSMLI-UUAFILDGSA-N 1 3 328.456 2.581 10 0 EFAEHO COC(=O)C1CC(N[C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1 ZINC000895456898 724141433 /nfs/dbraw/zinc/14/14/33/724141433.db2.gz IURMAHIKLLSMLI-UUAFILDGSA-N 1 3 328.456 2.581 10 0 EFAEHO COc1ccc(C2=NO[C@H](C[NH2+][C@@H]3CCN(C)C(C)(C)C3)C2)cc1F ZINC000895505205 724164752 /nfs/dbraw/zinc/16/47/52/724164752.db2.gz PAUWFYZKIQRUBQ-CABCVRRESA-N 1 3 349.450 2.790 10 0 EFAEHO COc1ccc(C2=NO[C@H](C[NH2+][C@H]3CCN(C)C(C)(C)C3)C2)cc1 ZINC000895497351 724168797 /nfs/dbraw/zinc/16/87/97/724168797.db2.gz HWAHTSFKWHRJJF-RDJZCZTQSA-N 1 3 331.460 2.651 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)[C@@H](NC(C)C)c1ccc(OC)cc1 ZINC000895707735 724266902 /nfs/dbraw/zinc/26/69/02/724266902.db2.gz NIJRPFOBEDNCFX-QAPCUYQASA-N 1 3 335.492 2.581 10 0 EFAEHO Cc1ccnc(N)c1C[N@@H+]1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1 ZINC000895792902 724317467 /nfs/dbraw/zinc/31/74/67/724317467.db2.gz QKTXIOOYUMAYMP-RBUKOAKNSA-N 1 3 336.483 2.926 10 0 EFAEHO Cc1ccnc(N)c1C[N@H+]1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1 ZINC000895792902 724317468 /nfs/dbraw/zinc/31/74/68/724317468.db2.gz QKTXIOOYUMAYMP-RBUKOAKNSA-N 1 3 336.483 2.926 10 0 EFAEHO CC(C)[NH+]1CCC(N2CCN(C[C@H]3C[C@@H]4[C@H](C3)C4(F)F)CC2)CC1 ZINC000930045483 728945297 /nfs/dbraw/zinc/94/52/97/728945297.db2.gz RWTDJXSXJVSLNM-VBUUOAMHSA-N 1 3 341.490 2.768 10 0 EFAEHO C[N@H+]1C[C@H]2CC[C@@H](C1)C2NC[C@H](O)c1cccc(C(F)(F)F)c1 ZINC000925376283 725457734 /nfs/dbraw/zinc/45/77/34/725457734.db2.gz KGDYFJMOKHQPRT-CSOLROPVSA-N 1 3 328.378 2.669 10 0 EFAEHO C[N@@H+]1C[C@H]2CC[C@@H](C1)C2NC[C@H](O)c1cccc(C(F)(F)F)c1 ZINC000925376283 725457736 /nfs/dbraw/zinc/45/77/36/725457736.db2.gz KGDYFJMOKHQPRT-CSOLROPVSA-N 1 3 328.378 2.669 10 0 EFAEHO CCC[NH+]1CCN(c2ccccc2CNC[C@H](O)c2ccco2)CC1 ZINC000088676870 725627721 /nfs/dbraw/zinc/62/77/21/725627721.db2.gz QXIJJAKWFXQQKR-IBGZPJMESA-N 1 3 343.471 2.635 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)NCC3CCC=CCC3)CC2)CC1 ZINC000915500543 727082118 /nfs/dbraw/zinc/08/21/18/727082118.db2.gz OEXOXQOECUZTAR-UHFFFAOYSA-N 1 3 348.535 2.591 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@H]1CNC(=O)c1ccc(NC2=NCCC2)cc1 ZINC000912282875 727687665 /nfs/dbraw/zinc/68/76/65/727687665.db2.gz FTTZMHOICVFCIJ-INIZCTEOSA-N 1 3 328.460 2.893 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1ccc(NC2=NCCC2)cc1 ZINC000912282875 727687666 /nfs/dbraw/zinc/68/76/66/727687666.db2.gz FTTZMHOICVFCIJ-INIZCTEOSA-N 1 3 328.460 2.893 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@@H]1CNC(=O)c1ccc(NC2=NCCC2)cc1 ZINC000912282876 727687707 /nfs/dbraw/zinc/68/77/07/727687707.db2.gz FTTZMHOICVFCIJ-MRXNPFEDSA-N 1 3 328.460 2.893 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1ccc(NC2=NCCC2)cc1 ZINC000912282876 727687708 /nfs/dbraw/zinc/68/77/08/727687708.db2.gz FTTZMHOICVFCIJ-MRXNPFEDSA-N 1 3 328.460 2.893 10 0 EFAEHO CC(C)(C)[N@@H+]1CC[C@@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000912298301 727690270 /nfs/dbraw/zinc/69/02/70/727690270.db2.gz UQYVPNGRCAYSEW-MRXNPFEDSA-N 1 3 328.460 2.893 10 0 EFAEHO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000912298301 727690272 /nfs/dbraw/zinc/69/02/72/727690272.db2.gz UQYVPNGRCAYSEW-MRXNPFEDSA-N 1 3 328.460 2.893 10 0 EFAEHO COc1cc(C[NH2+]CC2CC[NH+](C)CC2)cc(Br)c1[O-] ZINC000044515848 727871385 /nfs/dbraw/zinc/87/13/85/727871385.db2.gz RJRTYYGTCXCZOG-UHFFFAOYSA-N 1 3 343.265 2.595 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H]2CC[N@H+](CCCF)CC2(C)C)c1 ZINC000941236993 727925798 /nfs/dbraw/zinc/92/57/98/727925798.db2.gz FIEMJZCWXNSGIG-GOSISDBHSA-N 1 3 349.494 2.938 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H]2CC[N@@H+](CCCF)CC2(C)C)c1 ZINC000941236993 727925799 /nfs/dbraw/zinc/92/57/99/727925799.db2.gz FIEMJZCWXNSGIG-GOSISDBHSA-N 1 3 349.494 2.938 10 0 EFAEHO CC(C)OCC[NH+]1CCC(N[C@H](C)c2ccc3c(c2)OCO3)CC1 ZINC000158057650 728278875 /nfs/dbraw/zinc/27/88/75/728278875.db2.gz WFKFJGHZZPFVJC-OAHLLOKOSA-N 1 3 334.460 2.955 10 0 EFAEHO CC(C)CCC[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)Cc1c[nH]cn1 ZINC001569442144 1085221059 /nfs/dbraw/zinc/22/10/59/1085221059.db2.gz ICQHEAQCMICJGD-ZNXRZULTSA-N 1 3 332.492 2.890 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@]2(CCN(C(=O)CN3CCC(C)CC3)C2)C1 ZINC001569479441 1085287015 /nfs/dbraw/zinc/28/70/15/1085287015.db2.gz WNHUGNHOEPNOFO-FNEOHHHZSA-N 1 3 347.547 2.999 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@]2(CCN(C(=O)CN3CCC(C)CC3)C2)C1 ZINC001569479441 1085287021 /nfs/dbraw/zinc/28/70/21/1085287021.db2.gz WNHUGNHOEPNOFO-FNEOHHHZSA-N 1 3 347.547 2.999 10 0 EFAEHO Cc1ccc(CN2CC[C@@](C)(NC(=O)CCCC[NH+](C)C)C2)cc1 ZINC001569651382 1085484040 /nfs/dbraw/zinc/48/40/40/1085484040.db2.gz QDUUSSOGYROVOX-HXUWFJFHSA-N 1 3 331.504 2.808 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@](C)(C[NH2+]CCC2CCCC2)C1)N(C)C ZINC001569691283 1085522027 /nfs/dbraw/zinc/52/20/27/1085522027.db2.gz WJJKAMUXXMYBIS-QUCCMNQESA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(C)cc2C)C1)N(C)C ZINC001569986445 1085822611 /nfs/dbraw/zinc/82/26/11/1085822611.db2.gz JBLRSQYMOJTQHT-UYAOXDASSA-N 1 3 345.531 2.972 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](CC[NH2+]Cc2cccc(Cl)c2)C1 ZINC001570019689 1085867089 /nfs/dbraw/zinc/86/70/89/1085867089.db2.gz VQPILLDVXRLNGX-MRXNPFEDSA-N 1 3 349.906 2.764 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001570022141 1085870393 /nfs/dbraw/zinc/87/03/93/1085870393.db2.gz ONXQFYXAUZRLGT-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CCC/C=C\CC[NH+]1CCC2(CN(C(=O)Cc3c[nH]cn3)C2)CC1 ZINC001570054740 1085908201 /nfs/dbraw/zinc/90/82/01/1085908201.db2.gz CIMSFSLXEAJMRM-PLNGDYQASA-N 1 3 330.476 2.623 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]CC[C@H]2CCCC2(F)F)C1 ZINC001570582370 1086381645 /nfs/dbraw/zinc/38/16/45/1086381645.db2.gz GONWSJIAXQABJD-HWOWSKLDSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N(C)CC(C)(C)C[NH2+]CCCF ZINC001570684296 1086458812 /nfs/dbraw/zinc/45/88/12/1086458812.db2.gz QCSYJEQFVHLDML-INIZCTEOSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@H](CCC[NH2+]C[C@H]1CCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001571271525 1086693501 /nfs/dbraw/zinc/69/35/01/1086693501.db2.gz WZSSIYJIGKDVNZ-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N(C)[C@@H](C[NH2+]CCC(F)(F)F)C1CC1 ZINC001571360107 1086754913 /nfs/dbraw/zinc/75/49/13/1086754913.db2.gz LUPUIRCRXRMJTG-CABCVRRESA-N 1 3 349.441 2.638 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccccc2C)C[C@H]1C ZINC001571490293 1086879704 /nfs/dbraw/zinc/87/97/04/1086879704.db2.gz BTALBGOBEDQTHX-UYAOXDASSA-N 1 3 345.531 2.848 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2CC[C@H](C[NH2+]CCCF)C2)c1 ZINC001571550831 1086954255 /nfs/dbraw/zinc/95/42/55/1086954255.db2.gz VBQWZJJVJGVNRR-YJBOKZPZSA-N 1 3 335.467 2.596 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC2=CC[N@H+](CCC3=CCCCC3)CC2)C1 ZINC001571695039 1087062609 /nfs/dbraw/zinc/06/26/09/1087062609.db2.gz AQUXHWDTZOJBOL-SFHVURJKSA-N 1 3 345.531 2.967 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC2=CC[N@@H+](CCC3=CCCCC3)CC2)C1 ZINC001571695039 1087062616 /nfs/dbraw/zinc/06/26/16/1087062616.db2.gz AQUXHWDTZOJBOL-SFHVURJKSA-N 1 3 345.531 2.967 10 0 EFAEHO CCN(C(=O)C[NH2+]CC(C)C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC001647248398 1089162677 /nfs/dbraw/zinc/16/26/77/1089162677.db2.gz HPPVTDBZBNGBEJ-MJGOQNOKSA-N 1 3 331.504 2.916 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@@H]2CN(C(=O)CN(C)CCC)C[C@@H]2C1 ZINC001649432823 1092449199 /nfs/dbraw/zinc/44/91/99/1092449199.db2.gz DVTDIKJITNNVNX-YMHTTXFNSA-N 1 3 335.536 2.855 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@@H]2CN(C(=O)CN(C)CCC)C[C@@H]2C1 ZINC001649432823 1092449206 /nfs/dbraw/zinc/44/92/06/1092449206.db2.gz DVTDIKJITNNVNX-YMHTTXFNSA-N 1 3 335.536 2.855 10 0 EFAEHO Cc1cc(C[N@@H+](C)CCCNC(=O)CN(C)C2CCC2)c(C)s1 ZINC001649437003 1092459387 /nfs/dbraw/zinc/45/93/87/1092459387.db2.gz OHMBTCNUGKAZJO-UHFFFAOYSA-N 1 3 337.533 2.787 10 0 EFAEHO Cc1cc(C[N@H+](C)CCCNC(=O)CN(C)C2CCC2)c(C)s1 ZINC001649437003 1092459399 /nfs/dbraw/zinc/45/93/99/1092459399.db2.gz OHMBTCNUGKAZJO-UHFFFAOYSA-N 1 3 337.533 2.787 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCCC1)C[NH2+]CCc1ccccc1 ZINC001649447258 1092473126 /nfs/dbraw/zinc/47/31/26/1092473126.db2.gz RJXJNPSDVGKJAA-GOSISDBHSA-N 1 3 345.531 2.836 10 0 EFAEHO CCC(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CCCCCF)CC1 ZINC001649461137 1092495709 /nfs/dbraw/zinc/49/57/09/1092495709.db2.gz FMGLSNVNARDPJL-HDICACEKSA-N 1 3 339.499 2.676 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)CCC[NH2+]Cc1cnccc1C ZINC001649471889 1092515410 /nfs/dbraw/zinc/51/54/10/1092515410.db2.gz LZDYYNITACJILQ-MJGOQNOKSA-N 1 3 346.519 2.639 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001267173596 1093062897 /nfs/dbraw/zinc/06/28/97/1093062897.db2.gz AWWVFZCMXWIKDB-QAPCUYQASA-N 1 3 327.488 2.580 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001267173596 1093062904 /nfs/dbraw/zinc/06/29/04/1093062904.db2.gz AWWVFZCMXWIKDB-QAPCUYQASA-N 1 3 327.488 2.580 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CCC[C@H]3CCC[N@@H+]32)c(C)c1 ZINC001480923283 1093141376 /nfs/dbraw/zinc/14/13/76/1093141376.db2.gz RJGKQGAFMPQPGU-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CCC[C@H]3CCC[N@H+]32)c(C)c1 ZINC001480923283 1093141384 /nfs/dbraw/zinc/14/13/84/1093141384.db2.gz RJGKQGAFMPQPGU-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@@H]([NH2+]CCCCCF)C1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001267201668 1093179939 /nfs/dbraw/zinc/17/99/39/1093179939.db2.gz QWFDYOGLPKRJES-IAGOWNOFSA-N 1 3 341.515 2.685 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1cccc(F)c1 ZINC001267319388 1093566702 /nfs/dbraw/zinc/56/67/02/1093566702.db2.gz MFYKXZHNVOANET-KRWDZBQOSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1cccc(F)c1 ZINC001267319388 1093566706 /nfs/dbraw/zinc/56/67/06/1093566706.db2.gz MFYKXZHNVOANET-KRWDZBQOSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)=CCN(CCNC(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1)C1CC1 ZINC001267333024 1093602762 /nfs/dbraw/zinc/60/27/62/1093602762.db2.gz OKHWABSSRNZILN-LJQANCHMSA-N 1 3 339.499 2.746 10 0 EFAEHO CC(C)=CCN(CCNC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1)C1CC1 ZINC001267333024 1093602764 /nfs/dbraw/zinc/60/27/64/1093602764.db2.gz OKHWABSSRNZILN-LJQANCHMSA-N 1 3 339.499 2.746 10 0 EFAEHO CN(CCNC(=O)CCCC[NH+](C)C)[C@H]1CCc2c1cccc2F ZINC001480937875 1094404459 /nfs/dbraw/zinc/40/44/59/1094404459.db2.gz LTJZBJLHEVRSIQ-SFHVURJKSA-N 1 3 335.467 2.593 10 0 EFAEHO CN(C)C1(C(=O)N(C)CC[NH2+]Cc2ccc3ccccc3c2)CCC1 ZINC001267384606 1094444507 /nfs/dbraw/zinc/44/45/07/1094444507.db2.gz YRCCHNCKRIGETP-UHFFFAOYSA-N 1 3 339.483 2.872 10 0 EFAEHO Cc1ccc(CNCCN(C)C(=O)[C@H](C(C)C)[NH+](C)C)c(Cl)c1 ZINC001267387326 1094457524 /nfs/dbraw/zinc/45/75/24/1094457524.db2.gz NUSOXNBCKXDOMH-KRWDZBQOSA-N 1 3 339.911 2.783 10 0 EFAEHO CN(CC[NH2+]CCC(C)(C)C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001267429314 1094515705 /nfs/dbraw/zinc/51/57/05/1094515705.db2.gz WZPMBLPAYGEGNM-GOSISDBHSA-N 1 3 329.504 2.683 10 0 EFAEHO Cc1cc(Cl)ccc1CN1CC[C@@H](CNC(=O)CC[NH+](C)C)C1 ZINC001481108967 1094588585 /nfs/dbraw/zinc/58/85/85/1094588585.db2.gz IRTUEGMONZXXII-HNNXBMFYSA-N 1 3 337.895 2.538 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]CCCCC(F)(F)F ZINC001267473070 1094761986 /nfs/dbraw/zinc/76/19/86/1094761986.db2.gz AHECYANBGMSRST-AWEZNQCLSA-N 1 3 337.430 2.641 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]Cc1ccc(C)cc1C ZINC001267473063 1094762620 /nfs/dbraw/zinc/76/26/20/1094762620.db2.gz ADVNITNQQPWDHP-IBGZPJMESA-N 1 3 331.504 2.726 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]CCCc1ccsc1 ZINC001267474379 1094767268 /nfs/dbraw/zinc/76/72/68/1094767268.db2.gz QYENDUAIOQZISB-KRWDZBQOSA-N 1 3 337.533 2.603 10 0 EFAEHO CCCCCC[NH+]1CC2(C1)CCN(C(=O)C1(N(C)C)CCC1)CC2 ZINC001268045189 1094808707 /nfs/dbraw/zinc/80/87/07/1094808707.db2.gz UFSCGTHWBUPBIA-UHFFFAOYSA-N 1 3 335.536 2.975 10 0 EFAEHO CC[C@H](F)C[N@H+](C)CC1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001481518128 1095071412 /nfs/dbraw/zinc/07/14/12/1095071412.db2.gz HZANVPQPYMNWTP-KRWDZBQOSA-N 1 3 343.531 2.883 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)CC1CCN(C(=O)CN(C)CC(C)(C)C)CC1 ZINC001481518128 1095071424 /nfs/dbraw/zinc/07/14/24/1095071424.db2.gz HZANVPQPYMNWTP-KRWDZBQOSA-N 1 3 343.531 2.883 10 0 EFAEHO CC(C)N(CCF)CCCNC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC001267502932 1095074232 /nfs/dbraw/zinc/07/42/32/1095074232.db2.gz ISKWPBMPJDQSBE-KRWDZBQOSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)N(CCF)CCCNC(=O)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC001267502932 1095074249 /nfs/dbraw/zinc/07/42/49/1095074249.db2.gz ISKWPBMPJDQSBE-KRWDZBQOSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)[N@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1ccccc1 ZINC001267508741 1095117894 /nfs/dbraw/zinc/11/78/94/1095117894.db2.gz GBPWOVIMIFCHOH-SFHVURJKSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)[N@@H+](CCCNC(=O)CN1CC[C@H](C)C1)Cc1ccccc1 ZINC001267508741 1095117902 /nfs/dbraw/zinc/11/79/02/1095117902.db2.gz GBPWOVIMIFCHOH-SFHVURJKSA-N 1 3 331.504 2.745 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]CCc1ccccc1Cl ZINC001268098196 1095347273 /nfs/dbraw/zinc/34/72/73/1095347273.db2.gz DTHBQHMNPFRBGK-HNNXBMFYSA-N 1 3 339.911 2.659 10 0 EFAEHO C[C@H](C[NH2+]CC[C@H]1CCc2ccccc21)N(C)C(=O)CN1CCCC1 ZINC001268099024 1095350237 /nfs/dbraw/zinc/35/02/37/1095350237.db2.gz BEZIBUVWFBOFPU-IEBWSBKVSA-N 1 3 343.515 2.639 10 0 EFAEHO C[C@H](C[NH2+]CC[C@@H]1CCc2ccccc21)N(C)C(=O)CN1CCCC1 ZINC001268099025 1095350477 /nfs/dbraw/zinc/35/04/77/1095350477.db2.gz BEZIBUVWFBOFPU-MJGOQNOKSA-N 1 3 343.515 2.639 10 0 EFAEHO CC(C)(C(=O)NCC1CN(CC2=CCCCC2)C1)[NH+]1CCCCC1 ZINC001267681045 1095436691 /nfs/dbraw/zinc/43/66/91/1095436691.db2.gz GWAQPOPTNVIRFX-UHFFFAOYSA-N 1 3 333.520 2.799 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@H]1CC[N@H+](CC2=CCCCC2)C1 ZINC001267566255 1095583553 /nfs/dbraw/zinc/58/35/53/1095583553.db2.gz BRNRUMWFGSTGMP-KRWDZBQOSA-N 1 3 330.476 2.589 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@H]1CC[N@@H+](CC2=CCCCC2)C1 ZINC001267566255 1095583564 /nfs/dbraw/zinc/58/35/64/1095583564.db2.gz BRNRUMWFGSTGMP-KRWDZBQOSA-N 1 3 330.476 2.589 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CC)Cc2ccc(C)c(F)c2)CC[N@@H+]1C ZINC001480975843 1095638677 /nfs/dbraw/zinc/63/86/77/1095638677.db2.gz JSXYKJQRHIHSBT-PKOBYXMFSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(CC)Cc2ccc(C)c(F)c2)CC[N@H+]1C ZINC001480975843 1095638679 /nfs/dbraw/zinc/63/86/79/1095638679.db2.gz JSXYKJQRHIHSBT-PKOBYXMFSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)Cc1ccc(C[NH2+]CCN(C)C(=O)[C@H]2CCCN2C)cc1 ZINC001481215568 1095689536 /nfs/dbraw/zinc/68/95/36/1095689536.db2.gz LAYZVQKYMGQXIM-LJQANCHMSA-N 1 3 331.504 2.527 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[N@H+](C)C1)Cc1cc2ccccc2s1 ZINC001481016453 1095859102 /nfs/dbraw/zinc/85/91/02/1095859102.db2.gz LJJGAKQXVRPBNJ-INIZCTEOSA-N 1 3 345.512 2.791 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[N@@H+](C)C1)Cc1cc2ccccc2s1 ZINC001481016453 1095859121 /nfs/dbraw/zinc/85/91/21/1095859121.db2.gz LJJGAKQXVRPBNJ-INIZCTEOSA-N 1 3 345.512 2.791 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCN(C)CC1=CCCCC1)[NH+]1CCCC1 ZINC001268259789 1096196929 /nfs/dbraw/zinc/19/69/29/1096196929.db2.gz QSYOCZBHGKARLT-IBGZPJMESA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@H](CC[NH2+]Cc1ccc(CF)cc1)NC(=O)C1(N(C)C)CCC1 ZINC001268367833 1096403153 /nfs/dbraw/zinc/40/31/53/1096403153.db2.gz DEGRTBFNWIJENB-OAHLLOKOSA-N 1 3 335.467 2.625 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)[C@@H]1CC[N@H+](CCCCCF)C1 ZINC001481729094 1096432460 /nfs/dbraw/zinc/43/24/60/1096432460.db2.gz PLNYNLDOMBACTF-SJORKVTESA-N 1 3 327.488 2.533 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)[C@@H]1CC[N@@H+](CCCCCF)C1 ZINC001481729094 1096432466 /nfs/dbraw/zinc/43/24/66/1096432466.db2.gz PLNYNLDOMBACTF-SJORKVTESA-N 1 3 327.488 2.533 10 0 EFAEHO CN(C(=O)CCC[NH+](C)C)[C@H]1CCN(Cc2ccc3cc[nH]c3c2)C1 ZINC001481738984 1096475225 /nfs/dbraw/zinc/47/52/25/1096475225.db2.gz RMUHWECVEZWQLR-SFHVURJKSA-N 1 3 342.487 2.542 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)[C@@H]1CCN(Cc2ccc(C(C)(C)C)cc2)C1 ZINC001481740861 1096483478 /nfs/dbraw/zinc/48/34/78/1096483478.db2.gz TTZGMYAQLQIJLT-LJQANCHMSA-N 1 3 345.531 2.969 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1cc(F)ccc1F)N(C)C ZINC001268398540 1096489195 /nfs/dbraw/zinc/48/91/95/1096489195.db2.gz LMKAULANJFKVBF-CXAGYDPISA-N 1 3 341.446 2.535 10 0 EFAEHO CCCCC[NH2+]CC[C@H](C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001268399771 1096492284 /nfs/dbraw/zinc/49/22/84/1096492284.db2.gz LKAWQFLSYOJFFZ-MAUKXSAKSA-N 1 3 329.504 2.874 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)CC[NH2+]Cc1cc(F)ccc1F)N(C)C ZINC001268413612 1096550386 /nfs/dbraw/zinc/55/03/86/1096550386.db2.gz LMKAULANJFKVBF-DYVFJYSZSA-N 1 3 341.446 2.535 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)CC[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001268414595 1096557920 /nfs/dbraw/zinc/55/79/20/1096557920.db2.gz LKFGTRKACJVKQU-PKOBYXMFSA-N 1 3 333.520 2.936 10 0 EFAEHO CCN(CC[NH2+]CC[C@H]1CCCC1(F)F)C(=O)C1(N(C)C)CCC1 ZINC001268454351 1096684046 /nfs/dbraw/zinc/68/40/46/1096684046.db2.gz RTEKZIITWILQST-OAHLLOKOSA-N 1 3 345.478 2.734 10 0 EFAEHO CC[C@@H](CNC(=O)CC[NH+](C)C)N[C@H](C)c1cccc(Cl)c1F ZINC001481848501 1096779358 /nfs/dbraw/zinc/77/93/58/1096779358.db2.gz ORTYSCORXCOVIN-OLZOCXBDSA-N 1 3 343.874 2.976 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]Cc1ccccc1 ZINC001481849263 1096792027 /nfs/dbraw/zinc/79/20/27/1096792027.db2.gz CBHVVPOEHGXFDI-FXAWDEMLSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cc2ccccc2o1 ZINC001481849506 1096793388 /nfs/dbraw/zinc/79/33/88/1096793388.db2.gz DBYRTLOUPWKQAI-RDJZCZTQSA-N 1 3 343.471 2.759 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)NCc1ccc(C)cc1Cl ZINC001481876603 1096841223 /nfs/dbraw/zinc/84/12/23/1096841223.db2.gz WHAHVWNKXJMUGP-HZPDHXFCSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)NCc1ccc(C)cc1Cl ZINC001481876603 1096841233 /nfs/dbraw/zinc/84/12/33/1096841233.db2.gz WHAHVWNKXJMUGP-HZPDHXFCSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[C@@H](C(=O)N(CC)CC[NH2+]Cc1cc(C)sc1C)N(C)C ZINC001268493063 1096967477 /nfs/dbraw/zinc/96/74/77/1096967477.db2.gz QOTHPDGXYKPZCZ-INIZCTEOSA-N 1 3 325.522 2.643 10 0 EFAEHO CC(C)(C(=O)N1CCC[C@H](CC[NH2+]CCCF)C1)N1CCCCC1 ZINC001481975337 1097032855 /nfs/dbraw/zinc/03/28/55/1097032855.db2.gz SGEJPYBXHLPRQB-QGZVFWFLSA-N 1 3 341.515 2.829 10 0 EFAEHO CC1CC(C[NH2+]CC[C@H]2CCCN(C(=O)C3(N(C)C)CCC3)C2)C1 ZINC001481976633 1097034081 /nfs/dbraw/zinc/03/40/81/1097034081.db2.gz KHNWYTLJNDZGCY-LXPRWKDFSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H](CC[NH2+]Cc2ccccc2)C1)N(C)C ZINC001481981172 1097036700 /nfs/dbraw/zinc/03/67/00/1097036700.db2.gz KZRGQFJKFNVDHH-RBUKOAKNSA-N 1 3 331.504 2.745 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@@H](CC[NH2+]C/C=C/Cl)C2)CC1 ZINC001481989648 1097054339 /nfs/dbraw/zinc/05/43/39/1097054339.db2.gz QKLRUSTUUPUQKX-HJYWZVSTSA-N 1 3 341.927 2.689 10 0 EFAEHO CN(CC(=O)N1CCC(CC[NH2+]C/C=C\Cl)CC1)CC(C)(C)C ZINC001482004918 1097068301 /nfs/dbraw/zinc/06/83/01/1097068301.db2.gz YDCXKARUALEPSA-UITAMQMPSA-N 1 3 343.943 2.935 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(CC[NH2+]Cc2ccccc2F)CC1 ZINC001482010436 1097081591 /nfs/dbraw/zinc/08/15/91/1097081591.db2.gz QAROIWGZNNUKCY-UHFFFAOYSA-N 1 3 349.494 2.884 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(CC[NH2+]Cc2cccc(F)c2)CC1 ZINC001482010681 1097081975 /nfs/dbraw/zinc/08/19/75/1097081975.db2.gz SWVKBJVKUNDERR-UHFFFAOYSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@H](NC/C=C\CNC(=O)C12CCC[NH+]1CCC2)c1ccc(F)cc1 ZINC001268562249 1097196443 /nfs/dbraw/zinc/19/64/43/1097196443.db2.gz FIILPKMISITWCC-YPQKKHBXSA-N 1 3 345.462 2.777 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]1CNCc1cc(Cl)ccc1F ZINC001482062235 1097208603 /nfs/dbraw/zinc/20/86/03/1097208603.db2.gz GKWLVCLYRARMIS-OAHLLOKOSA-N 1 3 341.858 2.511 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)C[NH2+]C/C=C\c1ccccc1 ZINC001482101048 1097258556 /nfs/dbraw/zinc/25/85/56/1097258556.db2.gz KMPDMOPUINKVRO-GDSCYZHGSA-N 1 3 343.515 2.915 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C\CNC(=O)CN(C)CC(C)(C)C)cc1F ZINC001268591778 1097315225 /nfs/dbraw/zinc/31/52/25/1097315225.db2.gz UGNFYMLGDHTUHK-SREVYHEPSA-N 1 3 349.494 2.874 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NC/C=C/CNCc1ccc(Cl)cc1 ZINC001268628573 1097481851 /nfs/dbraw/zinc/48/18/51/1097481851.db2.gz OEGNZTXEBANAML-ZOSBBBERSA-N 1 3 349.906 2.975 10 0 EFAEHO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NC/C=C/CNCc1ccc(Cl)cc1 ZINC001268628573 1097481858 /nfs/dbraw/zinc/48/18/58/1097481858.db2.gz OEGNZTXEBANAML-ZOSBBBERSA-N 1 3 349.906 2.975 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@@H](C)C[NH2+]CCc1ccc(C)cc1 ZINC001268688683 1097541707 /nfs/dbraw/zinc/54/17/07/1097541707.db2.gz GHKOTZVUOQPNED-HKUYNNGSSA-N 1 3 331.504 2.506 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCCCF)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001268747701 1097594203 /nfs/dbraw/zinc/59/42/03/1097594203.db2.gz TXNFDCNTKWZWJF-MAUKXSAKSA-N 1 3 347.494 2.775 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCCCF)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001268747701 1097594208 /nfs/dbraw/zinc/59/42/08/1097594208.db2.gz TXNFDCNTKWZWJF-MAUKXSAKSA-N 1 3 347.494 2.775 10 0 EFAEHO C[C@H](C[N@H+](C)CCCCCF)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001268747703 1097596156 /nfs/dbraw/zinc/59/61/56/1097596156.db2.gz TXNFDCNTKWZWJF-QAPCUYQASA-N 1 3 347.494 2.775 10 0 EFAEHO C[C@H](C[N@@H+](C)CCCCCF)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001268747703 1097596161 /nfs/dbraw/zinc/59/61/61/1097596161.db2.gz TXNFDCNTKWZWJF-QAPCUYQASA-N 1 3 347.494 2.775 10 0 EFAEHO CN(CCC[NH2+]Cc1cccc(C(F)F)c1)C(=O)[C@@H]1CCCN1C ZINC001268782531 1097628159 /nfs/dbraw/zinc/62/81/59/1097628159.db2.gz ABZSNBIJYNPVMP-INIZCTEOSA-N 1 3 339.430 2.657 10 0 EFAEHO CC[C@H](C(=O)N(C)CCC[NH2+][C@@H](C)c1ccc(F)c(F)c1)N(C)C ZINC001268799946 1097647450 /nfs/dbraw/zinc/64/74/50/1097647450.db2.gz IVNQTBYJVDJERK-SUMWQHHRSA-N 1 3 341.446 2.804 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CCC[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001268840241 1097678019 /nfs/dbraw/zinc/67/80/19/1097678019.db2.gz REYYQOUDFMLACQ-MRXNPFEDSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+]Cc1ccccc1Cl)N(C)C ZINC001268919867 1097719889 /nfs/dbraw/zinc/71/98/89/1097719889.db2.gz AWTBQAZILBRPAT-KRWDZBQOSA-N 1 3 339.911 2.864 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)CN1CCCC1)c1ccc(F)cc1F ZINC001268950457 1097739631 /nfs/dbraw/zinc/73/96/31/1097739631.db2.gz ZYFRPNRKTUHCBI-AWEZNQCLSA-N 1 3 339.430 2.560 10 0 EFAEHO C[C@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@@H]1C[NH2+]CCC1CCCC1 ZINC001279114568 1097779645 /nfs/dbraw/zinc/77/96/45/1097779645.db2.gz SJLJPVISWBIZJY-WMZOPIPTSA-N 1 3 335.536 2.735 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC[C@@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269693397 1098373258 /nfs/dbraw/zinc/37/32/58/1098373258.db2.gz UOZMATUORAYGHV-QWCIBIBSSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC[C@@]2(CCN(C(=O)[C@H](CC)N(C)C)C2)C1 ZINC001269693397 1098373263 /nfs/dbraw/zinc/37/32/63/1098373263.db2.gz UOZMATUORAYGHV-QWCIBIBSSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](CC[NH2+]CCC(C)(C)C)C1 ZINC001269790112 1098445900 /nfs/dbraw/zinc/44/59/00/1098445900.db2.gz DBDXAQHDWBAOBM-QGZVFWFLSA-N 1 3 325.541 2.983 10 0 EFAEHO CC/C=C/CC[NH+]1CC2(C1)CCN(C(=O)CN1CCC(C)CC1)CC2 ZINC001482245491 1098469621 /nfs/dbraw/zinc/46/96/21/1098469621.db2.gz HTIQERKFVSQANS-SNAWJCMRSA-N 1 3 347.547 2.999 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(CC[NH2+]CCC2CC2)CC1 ZINC001269950393 1098544146 /nfs/dbraw/zinc/54/41/46/1098544146.db2.gz DJTUCXDMUKOXNY-IBGZPJMESA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H]2CCCN2C(=O)[C@H](C(C)C)N(C)C)cc1 ZINC001270173239 1098762687 /nfs/dbraw/zinc/76/26/87/1098762687.db2.gz AJYGAJYYAKKWGH-PMACEKPBSA-N 1 3 345.531 2.704 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]CCCc1ccccc1 ZINC001270193791 1098784079 /nfs/dbraw/zinc/78/40/79/1098784079.db2.gz MQMNUFOVUINZFV-LJQANCHMSA-N 1 3 331.504 2.540 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@@H]1C[NH2+]C/C=C/c1ccccc1)N(C)C ZINC001270228825 1098832005 /nfs/dbraw/zinc/83/20/05/1098832005.db2.gz RIAZBNUUPWMNLS-ISQGKGGOSA-N 1 3 329.488 2.621 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H]1C[NH2+]CCCC(C)(C)C)N(C)C ZINC001270259249 1098876935 /nfs/dbraw/zinc/87/69/35/1098876935.db2.gz MIVXOJONACUPHO-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1cccc(CCC[NH2+]C[C@H]2CCCN2C(=O)CN2CCCC2)c1 ZINC001270303749 1098932055 /nfs/dbraw/zinc/93/20/55/1098932055.db2.gz HACVPQVAICSFSS-HXUWFJFHSA-N 1 3 343.515 2.604 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CCC[C@@H]2C[NH2+]CCC2CC2)c1 ZINC001270309393 1098940712 /nfs/dbraw/zinc/94/07/12/1098940712.db2.gz YWGNRBRPVOZMFT-LJQANCHMSA-N 1 3 329.488 2.743 10 0 EFAEHO CC(C)[C@H](C(=O)N1CCC[C@@H]1C[NH2+]C/C=C\c1ccccc1)N(C)C ZINC001267964161 1098947133 /nfs/dbraw/zinc/94/71/33/1098947133.db2.gz HXSCBCLNJGIDSN-JDBYYAOJSA-N 1 3 343.515 2.867 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@H](C[NH2+]CCF)C2CCCC2)c1 ZINC001270458513 1099112026 /nfs/dbraw/zinc/11/20/26/1099112026.db2.gz QFJOADXUFSEZLR-SFHVURJKSA-N 1 3 335.467 2.596 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N(C)[C@H](C)CNCc1cc(C)ccc1F ZINC001482294239 1099171287 /nfs/dbraw/zinc/17/12/87/1099171287.db2.gz ZKSWNUXIVQLWFJ-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N(C)[C@H](C)CNCc1cc(C)ccc1F ZINC001482294239 1099171292 /nfs/dbraw/zinc/17/12/92/1099171292.db2.gz ZKSWNUXIVQLWFJ-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)[C@@H](C)CNCc1cc(C)ccc1F ZINC001482294241 1099171892 /nfs/dbraw/zinc/17/18/92/1099171892.db2.gz ZKSWNUXIVQLWFJ-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N(C)[C@@H](C)CNCc1cc(C)ccc1F ZINC001482294241 1099171898 /nfs/dbraw/zinc/17/18/98/1099171898.db2.gz ZKSWNUXIVQLWFJ-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(C(C)C)nc1C)N(C)C ZINC001482301304 1099271922 /nfs/dbraw/zinc/27/19/22/1099271922.db2.gz ZSILUGWWTVIGJM-HNAYVOBHSA-N 1 3 348.535 2.790 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](CC[NH2+]CCC2CCCC2)C1)N(C)C ZINC001280264580 1099382820 /nfs/dbraw/zinc/38/28/20/1099382820.db2.gz YOZFGAWNLZPXJO-RTBURBONSA-N 1 3 337.552 2.981 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC([C@@H](C)[NH2+]C/C=C/Cl)CC1 ZINC001481344186 1099392112 /nfs/dbraw/zinc/39/21/12/1099392112.db2.gz VROPBJHBUOKIOC-COXPPRJISA-N 1 3 341.927 2.830 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001270796647 1099568838 /nfs/dbraw/zinc/56/88/38/1099568838.db2.gz IHFVEQYDHNWEPQ-YJBOKZPZSA-N 1 3 329.504 2.541 10 0 EFAEHO CC1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]CCC(C)(C)C)C2)CC1 ZINC001270813368 1099628421 /nfs/dbraw/zinc/62/84/21/1099628421.db2.gz HQKKJDVDCMICEV-FQEVSTJZSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)CCC[NH2+]C[C@]1(C)CCN(C(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001270829271 1099677857 /nfs/dbraw/zinc/67/78/57/1099677857.db2.gz KYUOVSYBWBSCIM-MJGOQNOKSA-N 1 3 325.541 2.837 10 0 EFAEHO C[C@H]1CCCC[C@]1(C[NH2+]CCF)NC(=O)c1cccc(CN(C)C)c1 ZINC001267873591 1099786242 /nfs/dbraw/zinc/78/62/42/1099786242.db2.gz ZESGGEJJFCFIHO-OXJNMPFZSA-N 1 3 349.494 2.986 10 0 EFAEHO CCCN(C)CC(=O)N[C@]1(C[NH2+]C/C=C/Cl)CCCC[C@H]1C ZINC001267874355 1099793586 /nfs/dbraw/zinc/79/35/86/1099793586.db2.gz SXAVDXGOGIUSLB-WNEOQSQQSA-N 1 3 329.916 2.735 10 0 EFAEHO Cc1cccc(C[NH2+]CC[C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)c1 ZINC001267892844 1099891631 /nfs/dbraw/zinc/89/16/31/1099891631.db2.gz ICOYPEFEKTXVJP-KRWDZBQOSA-N 1 3 340.471 2.679 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@@H](CC[NH2+]CC2CC3(CCC3)C2)C1 ZINC001267893530 1099895069 /nfs/dbraw/zinc/89/50/69/1099895069.db2.gz NWTCAWKOVHEATA-INIZCTEOSA-N 1 3 344.503 2.751 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](CC[NH2+]Cc2ccsc2)C1 ZINC001267899918 1099962614 /nfs/dbraw/zinc/96/26/14/1099962614.db2.gz AZUGOZMGNGPZGA-INIZCTEOSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)C[C@H](C[NH2+]C/C=C\Cl)NC(=O)[C@H]1CCCN1C(C)C ZINC001482384311 1099968882 /nfs/dbraw/zinc/96/88/82/1099968882.db2.gz NWXUAXSBSKRADF-AJKQWTFCSA-N 1 3 329.916 2.732 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]Cc1cccnc1)NC(=O)C(C)(C)N1CCCC1 ZINC001482389844 1099981104 /nfs/dbraw/zinc/98/11/04/1099981104.db2.gz BCSJFCRJMOQNSG-SFHVURJKSA-N 1 3 346.519 2.577 10 0 EFAEHO CC(C)C[C@H](CNCc1ccccc1F)NC(=O)C12CC[NH+](CC1)C2 ZINC001482396416 1100014493 /nfs/dbraw/zinc/01/44/93/1100014493.db2.gz LEPUMWSESDEQHV-QGZVFWFLSA-N 1 3 347.478 2.542 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](CNCCF)C1CCCCC1)[NH+]1CCCC1 ZINC001482413181 1100081165 /nfs/dbraw/zinc/08/11/65/1100081165.db2.gz MEJWVJJDAFRUOW-MSOLQXFVSA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](CNCCF)C1CCCCC1)[NH+]1CCCC1 ZINC001482413184 1100081572 /nfs/dbraw/zinc/08/15/72/1100081572.db2.gz MEJWVJJDAFRUOW-ZWKOTPCHSA-N 1 3 341.515 2.731 10 0 EFAEHO C[C@H](C[NH2+]C/C=C/c1ccccc1)N(C)C(=O)CN(C)C1CCC1 ZINC001270995412 1100350545 /nfs/dbraw/zinc/35/05/45/1100350545.db2.gz KEBMHEBHHZCVCJ-VGMNTSGFSA-N 1 3 329.488 2.621 10 0 EFAEHO C[C@@H](C[NH2+]C/C=C\c1ccccc1)N(C)C(=O)CN(C)C1CCC1 ZINC001270995407 1100350969 /nfs/dbraw/zinc/35/09/69/1100350969.db2.gz KEBMHEBHHZCVCJ-NLZINVLXSA-N 1 3 329.488 2.621 10 0 EFAEHO C[C@H](C[NH2+]C/C=C\c1ccccc1)N(C)C(=O)CN(C)C1CCC1 ZINC001270995410 1100351104 /nfs/dbraw/zinc/35/11/04/1100351104.db2.gz KEBMHEBHHZCVCJ-SDMNGIDPSA-N 1 3 329.488 2.621 10 0 EFAEHO CC(C)CC[NH2+]C[C@@H](C)N(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001271102036 1100480618 /nfs/dbraw/zinc/48/06/18/1100480618.db2.gz PJIMFELLHYSJAJ-CRAIPNDOSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)CC[NH2+]C[C@H](C)N(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001271102037 1100480657 /nfs/dbraw/zinc/48/06/57/1100480657.db2.gz PJIMFELLHYSJAJ-MAUKXSAKSA-N 1 3 329.504 2.682 10 0 EFAEHO C[C@H](C[NH2+]CCCc1ccccc1Cl)N(C)C(=O)Cc1c[nH]cn1 ZINC001271121791 1100518775 /nfs/dbraw/zinc/51/87/75/1100518775.db2.gz SHYYRVLUHOWNFO-CQSZACIVSA-N 1 3 348.878 2.675 10 0 EFAEHO CCC(CC)[NH2+]CCNC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC001635073278 1100642624 /nfs/dbraw/zinc/64/26/24/1100642624.db2.gz DALFGRPDJNTZAH-YJBOKZPZSA-N 1 3 334.508 2.755 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1103442450 /nfs/dbraw/zinc/44/24/50/1103442450.db2.gz VQLJUUXIYKBLHT-JKSUJKDBSA-N 1 3 335.467 2.685 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@H](C)NC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001483352079 1103459705 /nfs/dbraw/zinc/45/97/05/1103459705.db2.gz VTNRKQLLXGHIEP-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@H](C)NC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001483352079 1103459709 /nfs/dbraw/zinc/45/97/09/1103459709.db2.gz VTNRKQLLXGHIEP-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCCC[C@H]1C[NH2+]CCC1CCCCC1 ZINC001661950380 1103518924 /nfs/dbraw/zinc/51/89/24/1103518924.db2.gz OEHDTPADPPFFEO-SFHVURJKSA-N 1 3 332.492 2.893 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]([NH2+]Cc1cc(F)cc(F)c1)C(C)C)N(C)C ZINC001482564884 1103537790 /nfs/dbraw/zinc/53/77/90/1103537790.db2.gz HNQMDUBZKVSDAC-DLBZAZTESA-N 1 3 341.446 2.535 10 0 EFAEHO C[C@H](C[N@H+](C)CC1CCC(C)(C)CC1)NC(=O)CN1CC[C@@H](C)C1 ZINC001483383913 1103552244 /nfs/dbraw/zinc/55/22/44/1103552244.db2.gz LUXCIOARKWTXRR-IAGOWNOFSA-N 1 3 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349.441 2.830 10 0 EFAEHO C[C@@H](C(=O)N[C@](C)(C[NH2+]CCC1CC1)C1CC1)N1CCCCCC1 ZINC001666027158 1104833241 /nfs/dbraw/zinc/83/32/41/1104833241.db2.gz WOBXVJPVMHPMGS-OXJNMPFZSA-N 1 3 335.536 2.926 10 0 EFAEHO C[C@H](C(=O)N[C@](C)(C[NH2+]CCC1CC1)C1CC1)N1CCCCCC1 ZINC001666027159 1104833478 /nfs/dbraw/zinc/83/34/78/1104833478.db2.gz WOBXVJPVMHPMGS-OXQOHEQNSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@]1(C[NH2+]C/C=C\Cl)CCCC[C@H]1C ZINC001666068766 1104848688 /nfs/dbraw/zinc/84/86/88/1104848688.db2.gz OCIGFELCZDDTGE-VONQVCDISA-N 1 3 329.916 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@]1(C[NH2+]C/C=C\Cl)CCCC[C@@H]1C ZINC001666068765 1104849035 /nfs/dbraw/zinc/84/90/35/1104849035.db2.gz OCIGFELCZDDTGE-JIVFLUIXSA-N 1 3 329.916 2.734 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H](CC[NH2+]CC3CCCC3)C2)C1 ZINC001666146948 1104882515 /nfs/dbraw/zinc/88/25/15/1104882515.db2.gz VFNADXJHLKPORJ-PKOBYXMFSA-N 1 3 335.536 2.737 10 0 EFAEHO CN(C)C1(C(=O)N2CCC(CC[NH2+]Cc3ccsc3)CC2)CCC1 ZINC001666218693 1104904271 /nfs/dbraw/zinc/90/42/71/1104904271.db2.gz BKFHVZPRSUZERL-UHFFFAOYSA-N 1 3 349.544 2.951 10 0 EFAEHO O=C(CN1CCCC1)N1CCC(CC[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001666263154 1104914779 /nfs/dbraw/zinc/91/47/79/1104914779.db2.gz JDAUAEWJAUSYSE-AQNXPRMDSA-N 1 3 347.547 2.737 10 0 EFAEHO O=C(CN1CCCC1)N1CCC(CC[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001666263155 1104915033 /nfs/dbraw/zinc/91/50/33/1104915033.db2.gz JDAUAEWJAUSYSE-HSALFYBXSA-N 1 3 347.547 2.737 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]C/C=C\c1ccccc1 ZINC001666599377 1104967842 /nfs/dbraw/zinc/96/78/42/1104967842.db2.gz FKZPUIRXCVHBNX-DVESRUBUSA-N 1 3 343.515 2.916 10 0 EFAEHO C[C@@H](C(=O)NCC1([NH2+]CCCF)CCCC1)N1CCCCCC1 ZINC001666791307 1104998257 /nfs/dbraw/zinc/99/82/57/1104998257.db2.gz FVFNFUFGAQXFBJ-INIZCTEOSA-N 1 3 327.488 2.629 10 0 EFAEHO C[C@@H](C[NH2+]C/C=C\c1ccc(Cl)cc1)N(C)C(=O)CN1CCCC1 ZINC001667054966 1105043195 /nfs/dbraw/zinc/04/31/95/1105043195.db2.gz VXZLYOYBXUORPT-KJPDOMRESA-N 1 3 349.906 2.886 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+]Cc1ccccc1Cl ZINC001482902510 1105160037 /nfs/dbraw/zinc/16/00/37/1105160037.db2.gz RJAMUFLVOPPLSC-AWEZNQCLSA-N 1 3 325.884 2.665 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCC[C@@H]2C[NH2+]CCCC2CCC2)CCC1 ZINC001667726114 1105188453 /nfs/dbraw/zinc/18/84/53/1105188453.db2.gz DKLLCKNJHVMTES-MSOLQXFVSA-N 1 3 335.536 2.926 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C(C)C)nc1C)C(=O)[C@H]1CCCN1C ZINC001482942736 1105212281 /nfs/dbraw/zinc/21/22/81/1105212281.db2.gz RYNAHGXNURESON-LJQANCHMSA-N 1 3 346.519 2.546 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1cc(Cl)ccc1F)N(C)C ZINC001668106045 1105236618 /nfs/dbraw/zinc/23/66/18/1105236618.db2.gz KOWJZRKBSRJALD-MLGOLLRUSA-N 1 3 343.874 2.804 10 0 EFAEHO CCN(CC[NH2+]CCc1ccccc1F)C(=O)CN1CCC(C)CC1 ZINC001482957969 1105242179 /nfs/dbraw/zinc/24/21/79/1105242179.db2.gz IXAKHUMYNNCDPP-UHFFFAOYSA-N 1 3 349.494 2.538 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)cc1C)C(=O)CN1CC[C@H](C)C1 ZINC001482950068 1105247058 /nfs/dbraw/zinc/24/70/58/1105247058.db2.gz DQTDNBNOOACTTB-KRWDZBQOSA-N 1 3 331.504 2.583 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(C)c(F)c1 ZINC001668325680 1105282112 /nfs/dbraw/zinc/28/21/12/1105282112.db2.gz KPFYPFHIOHNXTC-QFBILLFUSA-N 1 3 349.494 2.993 10 0 EFAEHO CCN(CC[NH2+]CC[C@H]1CCc2ccccc21)C(=O)[C@@H]1CCCN1C ZINC001668382152 1105290914 /nfs/dbraw/zinc/29/09/14/1105290914.db2.gz UXAOQISLWPUZLA-QUCCMNQESA-N 1 3 343.515 2.639 10 0 EFAEHO CCN(CCNC/C=C\Cl)C(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001668528452 1105314621 /nfs/dbraw/zinc/31/46/21/1105314621.db2.gz HNWUJPJRHZATKL-CGICMKJESA-N 1 3 341.927 2.974 10 0 EFAEHO CCN(CCNC/C=C\Cl)C(=O)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001668528452 1105314626 /nfs/dbraw/zinc/31/46/26/1105314626.db2.gz HNWUJPJRHZATKL-CGICMKJESA-N 1 3 341.927 2.974 10 0 EFAEHO CCN(CCNC/C=C\Cl)C(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC001668528453 1105314662 /nfs/dbraw/zinc/31/46/62/1105314662.db2.gz HNWUJPJRHZATKL-GJBHZFNWSA-N 1 3 341.927 2.974 10 0 EFAEHO CCN(CCNC/C=C\Cl)C(=O)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001668528453 1105314667 /nfs/dbraw/zinc/31/46/67/1105314667.db2.gz HNWUJPJRHZATKL-GJBHZFNWSA-N 1 3 341.927 2.974 10 0 EFAEHO CCN(CC[NH2+]Cc1ccsc1)C(=O)CN(C)CC(C)(C)C ZINC001668555435 1105320022 /nfs/dbraw/zinc/32/00/22/1105320022.db2.gz PBNFNPNFWVKGKO-UHFFFAOYSA-N 1 3 325.522 2.664 10 0 EFAEHO CN(C)C1(C(=O)NC/C=C/C[NH2+]C[C@H]2CCCC(F)(F)C2)CCC1 ZINC001668864183 1105388539 /nfs/dbraw/zinc/38/85/39/1105388539.db2.gz DFKFEMRJNQKPON-BWPKMQGJSA-N 1 3 343.462 2.558 10 0 EFAEHO CN(C)C1(C(=O)NC/C=C\C[NH2+]CC2CCC(F)(F)CC2)CCC1 ZINC001668863910 1105388752 /nfs/dbraw/zinc/38/87/52/1105388752.db2.gz AKESXDYLRXJHOO-ARJAWSKDSA-N 1 3 343.462 2.558 10 0 EFAEHO C[NH+](C)CCCC(=O)NC/C=C/CN[C@H]1CCc2c1cccc2Cl ZINC001669008760 1105416092 /nfs/dbraw/zinc/41/60/92/1105416092.db2.gz LZBJZZDJJQTEPJ-WHLIDYPQSA-N 1 3 349.906 2.931 10 0 EFAEHO CC[C@H](C)C[NH2+]C/C=C\CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001669040542 1105422896 /nfs/dbraw/zinc/42/28/96/1105422896.db2.gz XLMNGOSXYZESPP-QOLZPOHTSA-N 1 3 327.488 2.507 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C/C[NH2+]C/C=C\c2ccccc2)CC1 ZINC001669106808 1105435876 /nfs/dbraw/zinc/43/58/76/1105435876.db2.gz JCDHTTFNFHUBCM-LXGGSRJLSA-N 1 3 341.499 2.694 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C\C[NH2+]CCC2CCCCC2)CC1 ZINC001669107845 1105436634 /nfs/dbraw/zinc/43/66/34/1105436634.db2.gz PFYHSAXZAQNLLH-WAYWQWQTSA-N 1 3 335.536 2.951 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC/C=C/CN[C@@H]1CCc2ccc(Cl)cc21 ZINC001669126866 1105440008 /nfs/dbraw/zinc/44/00/08/1105440008.db2.gz QDHQSJXPWMDHLV-SHCNBLLESA-N 1 3 349.906 2.931 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC/C=C/CN[C@@H]1CCc2ccc(Cl)cc21 ZINC001669126866 1105440010 /nfs/dbraw/zinc/44/00/10/1105440010.db2.gz QDHQSJXPWMDHLV-SHCNBLLESA-N 1 3 349.906 2.931 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/CNCc1cc2ccccc2o1)[NH+](C)C ZINC001669151815 1105444894 /nfs/dbraw/zinc/44/48/94/1105444894.db2.gz XUDLNABBGROXDW-IHHMQQGQSA-N 1 3 343.471 2.781 10 0 EFAEHO Cc1ccc(CNC/C=C/CNC(=O)C[NH+]2[C@H](C)CC[C@H]2C)cc1F ZINC001669201065 1105456219 /nfs/dbraw/zinc/45/62/19/1105456219.db2.gz LRWPKAUVDDDABO-ADDHZHGLSA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1ccc(CCC[NH2+]C[C@@H](C)NC(=O)C(C)(C)N2CCCC2)cc1 ZINC001669368878 1105476582 /nfs/dbraw/zinc/47/65/82/1105476582.db2.gz PAUBVMUITWHYSA-GOSISDBHSA-N 1 3 345.531 2.896 10 0 EFAEHO CC(C)c1ccccc1C[NH2+]C/C=C\CNC(=O)[C@@H]1CCCN1C ZINC001482991468 1105493813 /nfs/dbraw/zinc/49/38/13/1105493813.db2.gz RLXOJAPGWPDUTJ-RURPWVQCSA-N 1 3 329.488 2.666 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CCCC[C@H]2C[NH2+]CCC(F)(F)F)CCC1 ZINC001669956770 1105554469 /nfs/dbraw/zinc/55/44/69/1105554469.db2.gz XISXNSDQYUADIY-KBPBESRZSA-N 1 3 349.441 2.688 10 0 EFAEHO C[C@@H]([NH2+]C/C=C\CNC(=O)CN(C)C1CCC1)c1ccc(F)cc1 ZINC001483018792 1105561219 /nfs/dbraw/zinc/56/12/19/1105561219.db2.gz RLGNHIIJKURFMS-ABCZVMIZSA-N 1 3 333.451 2.633 10 0 EFAEHO CN(CC(=O)NC/C=C\C[NH2+][C@H]1CCCc2ccccc21)C1CCC1 ZINC001483018865 1105561553 /nfs/dbraw/zinc/56/15/53/1105561553.db2.gz SAKAMZIUORJUBS-FBQMEGEOSA-N 1 3 341.499 2.810 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@@H]1CCCC[C@@H]1NC(=O)Cc1nc[nH]c1C ZINC001669979235 1105561700 /nfs/dbraw/zinc/56/17/00/1105561700.db2.gz ATFOMKIZZHVWKJ-FEFZKZJHSA-N 1 3 332.492 2.882 10 0 EFAEHO CN(CC(=O)NC/C=C\C[NH2+][C@@H]1CCCc2ccccc21)C1CCC1 ZINC001483018863 1105561838 /nfs/dbraw/zinc/56/18/38/1105561838.db2.gz SAKAMZIUORJUBS-BBIZLLLXSA-N 1 3 341.499 2.810 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CCCN(C)C(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001670236952 1105602076 /nfs/dbraw/zinc/60/20/76/1105602076.db2.gz HQHKVNZXYGRUTL-GOSISDBHSA-N 1 3 337.483 2.658 10 0 EFAEHO CCCN(C)CC(=O)N(C)CCC[NH2+][C@H]1CCc2ccc(F)cc21 ZINC001670318427 1105616859 /nfs/dbraw/zinc/61/68/59/1105616859.db2.gz IZDAGOSZYHODMC-SFHVURJKSA-N 1 3 335.467 2.593 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)CN1CCCC1)c1cc(F)ccc1F ZINC001670344406 1105622675 /nfs/dbraw/zinc/62/26/75/1105622675.db2.gz HPMVKNDRHBKQFQ-AWEZNQCLSA-N 1 3 339.430 2.560 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)NC/C=C/CNCc1cccc(F)c1 ZINC001483028847 1105663004 /nfs/dbraw/zinc/66/30/04/1105663004.db2.gz RUXFTPYICFTIIW-GNAXCBTBSA-N 1 3 347.478 2.708 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NC/C=C/CNCc1cccc(F)c1 ZINC001483028847 1105663006 /nfs/dbraw/zinc/66/30/06/1105663006.db2.gz RUXFTPYICFTIIW-GNAXCBTBSA-N 1 3 347.478 2.708 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@](C)(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001671675062 1105682341 /nfs/dbraw/zinc/68/23/41/1105682341.db2.gz SITCZSFLDDBRKL-MOPGFXCFSA-N 1 3 341.515 2.970 10 0 EFAEHO CCCCC[N@H+]1CC[C@@](C)(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001671675062 1105682342 /nfs/dbraw/zinc/68/23/42/1105682342.db2.gz SITCZSFLDDBRKL-MOPGFXCFSA-N 1 3 341.515 2.970 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@@](C)(C[NH2+]CCCC3CCC3)C2)CCC1 ZINC001671747616 1105694741 /nfs/dbraw/zinc/69/47/41/1105694741.db2.gz KALUPHAKXYYEQX-IBGZPJMESA-N 1 3 335.536 2.879 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@](C)(C[NH2+]CCc3cccs3)C2)CCC1 ZINC001671748202 1105695986 /nfs/dbraw/zinc/69/59/86/1105695986.db2.gz QGXHYUBOYWQBNI-GOSISDBHSA-N 1 3 349.544 2.603 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@](C)(C[NH2+]CCCC3CCC3)C2)C1 ZINC001671785927 1105701993 /nfs/dbraw/zinc/70/19/93/1105701993.db2.gz ZYVYCNSNQILBLY-XLIONFOSSA-N 1 3 335.536 2.737 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@@H](CC[NH2+]CCCc2ccsc2)C1 ZINC001672761194 1105896588 /nfs/dbraw/zinc/89/65/88/1105896588.db2.gz DUHLIJCVOZELMP-AEFFLSMTSA-N 1 3 349.544 2.603 10 0 EFAEHO CN(C)C1(C(=O)N2CC[C@H](CC[NH2+]CC3CCCCC3)C2)CCC1 ZINC001672805986 1105908764 /nfs/dbraw/zinc/90/87/64/1105908764.db2.gz RPDLQPKTQHHZIY-SFHVURJKSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]CC[C@H]1CCN(C(=O)[C@H]2CCCN2C)C1 ZINC001672840793 1105918035 /nfs/dbraw/zinc/91/80/35/1105918035.db2.gz YKFJVOXSZLIIOH-AZUAARDMSA-N 1 3 343.515 2.726 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(F)cc2)C1)N(C)C ZINC001672859431 1105922466 /nfs/dbraw/zinc/92/24/66/1105922466.db2.gz UTSJKQVTXQQQKY-IEBWSBKVSA-N 1 3 349.494 2.740 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(C)cc2C)C1)N(C)C ZINC001672863305 1105923587 /nfs/dbraw/zinc/92/35/87/1105923587.db2.gz JBLRSQYMOJTQHT-QUCCMNQESA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC[C@H]2CCN(C(=O)Cc3c[nH]cn3)C2)c1 ZINC001672867680 1105924076 /nfs/dbraw/zinc/92/40/76/1105924076.db2.gz DKUXAUPMYBDENI-KRWDZBQOSA-N 1 3 340.471 2.597 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(CF)cc2)C1)N(C)C ZINC001672896957 1105930841 /nfs/dbraw/zinc/93/08/41/1105930841.db2.gz LQNFECYXMVRAOC-RTBURBONSA-N 1 3 349.494 2.825 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](CC[NH2+]Cc2cc(C)ccc2F)C1 ZINC001672901466 1105932625 /nfs/dbraw/zinc/93/26/25/1105932625.db2.gz HYZQAQIEULXUPE-QGZVFWFLSA-N 1 3 349.494 2.804 10 0 EFAEHO C[C@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@H]1[NH2+]CCCC1CCCC1 ZINC001673877000 1106095000 /nfs/dbraw/zinc/09/50/00/1106095000.db2.gz BJQZUJAYHKTFDY-FUHWJXTLSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ncccc1CN1CC[C@H](NC(=O)CCCC[NH+](C)C)C[C@@H]1C ZINC001674153497 1106151788 /nfs/dbraw/zinc/15/17/88/1106151788.db2.gz HBQTVYINBWAEKZ-LPHOPBHVSA-N 1 3 346.519 2.591 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@H]([C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001674505223 1106209624 /nfs/dbraw/zinc/20/96/24/1106209624.db2.gz LUBMQMVGDNFMJQ-GUDHTMSVSA-N 1 3 344.503 2.869 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@H]([C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001674505223 1106209627 /nfs/dbraw/zinc/20/96/27/1106209627.db2.gz LUBMQMVGDNFMJQ-GUDHTMSVSA-N 1 3 344.503 2.869 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@H](C)[NH2+]CCCc1cccc(F)c1 ZINC001674759615 1106252552 /nfs/dbraw/zinc/25/25/52/1106252552.db2.gz FPMVONSPOFCTNO-UONOGXRCSA-N 1 3 346.450 2.515 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC(C)(C)C[NH2+]CCc2ccccc2)C1 ZINC001674856363 1106265885 /nfs/dbraw/zinc/26/58/85/1106265885.db2.gz CJZCKZDKGHYQAI-SFHVURJKSA-N 1 3 345.531 2.645 10 0 EFAEHO C[C@@H]1CCCC[C@@H]1[NH+]1CCC(NCCc2cccc(C(N)=O)c2)CC1 ZINC000089545545 1106302440 /nfs/dbraw/zinc/30/24/40/1106302440.db2.gz FBLOGIUKGAYUMZ-UZLBHIALSA-N 1 3 343.515 2.961 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CCCC2(CN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001675665619 1106407296 /nfs/dbraw/zinc/40/72/96/1106407296.db2.gz KPXHVZBJAMAWBW-CNZFZVQHSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@H+]1CCCC2(CN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001675665619 1106407298 /nfs/dbraw/zinc/40/72/98/1106407298.db2.gz KPXHVZBJAMAWBW-CNZFZVQHSA-N 1 3 335.536 2.997 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)CCC[NH2+]CC1CC(F)(F)C1 ZINC001676024766 1106471569 /nfs/dbraw/zinc/47/15/69/1106471569.db2.gz XYCMHKBGCURFPN-GDBMZVCRSA-N 1 3 345.478 2.781 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H](C[NH2+]CC=C(Cl)Cl)C1 ZINC001676973812 1106640303 /nfs/dbraw/zinc/64/03/03/1106640303.db2.gz BGNMWIAAJJEQBP-STQMWFEESA-N 1 3 336.307 2.520 10 0 EFAEHO CC(C)(C(=O)N[C@@H]1CC[C@H](C[NH2+]CCC(F)(F)F)C1)N1CCCC1 ZINC001676946160 1106633877 /nfs/dbraw/zinc/63/38/77/1106633877.db2.gz USUOCBQZBFJNQW-UONOGXRCSA-N 1 3 349.441 2.688 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@@H](C[NH2+]CC=C(Cl)Cl)C1 ZINC001676973810 1106640352 /nfs/dbraw/zinc/64/03/52/1106640352.db2.gz BGNMWIAAJJEQBP-OLZOCXBDSA-N 1 3 336.307 2.520 10 0 EFAEHO CC[C@H](C(=O)N1C[C@H]([NH2+]CCCC(C)(C)C)C(C)(C)C1)N(C)C ZINC001677033051 1106653456 /nfs/dbraw/zinc/65/34/56/1106653456.db2.gz RDOHHMICOMMOBT-CVEARBPZSA-N 1 3 325.541 2.980 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2C[C@H]([NH2+]CCCF)C(C)(C)C2)c1 ZINC001677043944 1106656210 /nfs/dbraw/zinc/65/62/10/1106656210.db2.gz WPKIGKPDCFDCRL-KRWDZBQOSA-N 1 3 335.467 2.548 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)C1CC[NH+](CCCCCF)CC1 ZINC001677368061 1106706702 /nfs/dbraw/zinc/70/67/02/1106706702.db2.gz ULHJXAAMUYXWLF-AWEZNQCLSA-N 1 3 338.471 2.617 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1=CC[N@H+](CCc2cccs2)CC1)N(C)C ZINC001677624935 1106788201 /nfs/dbraw/zinc/78/82/01/1106788201.db2.gz YDACPWDTXZPBSC-GOSISDBHSA-N 1 3 349.544 2.625 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1=CC[N@@H+](CCc2cccs2)CC1)N(C)C ZINC001677624935 1106788213 /nfs/dbraw/zinc/78/82/13/1106788213.db2.gz YDACPWDTXZPBSC-GOSISDBHSA-N 1 3 349.544 2.625 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1=CC[N@H+](CCC2CCCCC2)CC1 ZINC001677624567 1106790194 /nfs/dbraw/zinc/79/01/94/1106790194.db2.gz SQLJNEQLGBURBI-UHFFFAOYSA-N 1 3 344.503 2.979 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1=CC[N@@H+](CCC2CCCCC2)CC1 ZINC001677624567 1106790205 /nfs/dbraw/zinc/79/02/05/1106790205.db2.gz SQLJNEQLGBURBI-UHFFFAOYSA-N 1 3 344.503 2.979 10 0 EFAEHO Cc1cc(Cl)ccc1CNC/C=C/CNC(=O)C1CC[NH+](C)CC1 ZINC001483053058 1106981501 /nfs/dbraw/zinc/98/15/01/1106981501.db2.gz BMDSIICEXJSFQH-ONEGZZNKSA-N 1 3 349.906 2.752 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)C2CCC2)cc1F ZINC001409344044 1107562218 /nfs/dbraw/zinc/56/22/18/1107562218.db2.gz CJQHYRGTFVGILN-CABCVRRESA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C/C=C\CNC(=O)[C@@H](C(C)C)N(C)C)c1 ZINC001483055866 1107696323 /nfs/dbraw/zinc/69/63/23/1107696323.db2.gz COBYQQFMFJEEAL-QULHZPMSSA-N 1 3 331.504 2.652 10 0 EFAEHO CC(C)CCC[NH2+]C/C=C/CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001483060241 1107848603 /nfs/dbraw/zinc/84/86/03/1107848603.db2.gz GMAKLKUBHULSKU-OVKVCFKUSA-N 1 3 341.515 2.897 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H]1CCC[C@@H]1C[NH2+]CCCC(C)(C)C ZINC001272331308 1107852640 /nfs/dbraw/zinc/85/26/40/1107852640.db2.gz FODSLBWEHIYQRN-HZPDHXFCSA-N 1 3 334.508 2.961 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](C)[C@H](C)NC(=O)C2(N(C)C)CCC2)cc1 ZINC001409363584 1107916385 /nfs/dbraw/zinc/91/63/85/1107916385.db2.gz KKIZFIIBKCEZGJ-CVEARBPZSA-N 1 3 331.504 2.716 10 0 EFAEHO C[NH+](C)CCCCC(=O)NC[C@@H]1CCN1C[C@H]1CCCC(F)(F)C1 ZINC001483693099 1107927186 /nfs/dbraw/zinc/92/71/86/1107927186.db2.gz KMFANTLPCNVJHF-HOTGVXAUSA-N 1 3 345.478 2.734 10 0 EFAEHO C[C@@H](NCc1ccccn1)[C@@H](C)NC(=O)CC[N@H+](C)C1CCCCC1 ZINC001409380509 1108070842 /nfs/dbraw/zinc/07/08/42/1108070842.db2.gz QTAXZJQTSVDBDW-IAGOWNOFSA-N 1 3 346.519 2.719 10 0 EFAEHO C[C@@H](NCc1ccccn1)[C@@H](C)NC(=O)CC[N@@H+](C)C1CCCCC1 ZINC001409380509 1108070858 /nfs/dbraw/zinc/07/08/58/1108070858.db2.gz QTAXZJQTSVDBDW-IAGOWNOFSA-N 1 3 346.519 2.719 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC[C@@H]2CCN(C(=O)[C@H]3CCCN3C)C2)c1 ZINC001272524161 1108615339 /nfs/dbraw/zinc/61/53/39/1108615339.db2.gz PDTVUWUNPCUFGT-UYAOXDASSA-N 1 3 343.515 2.726 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC/C=C/C[NH2+]Cc1ccc(CF)cc1 ZINC001483097167 1108624246 /nfs/dbraw/zinc/62/42/46/1108624246.db2.gz ISQQYUUWSUKKHH-PXPVJAHISA-N 1 3 347.478 2.793 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](CC[NH2+]CCCC(C)(C)C)C1)N(C)C ZINC001272564569 1108671741 /nfs/dbraw/zinc/67/17/41/1108671741.db2.gz HYPFIRCPSWJIFC-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](CC[NH2+]Cc2cc(C)ccc2F)C1)N(C)C ZINC001272565635 1108673272 /nfs/dbraw/zinc/67/32/72/1108673272.db2.gz NVYWSCXZJNZFED-LPHOPBHVSA-N 1 3 349.494 2.803 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+][C@@H]2CCc3ccccc32)CC1 ZINC001483738662 1108699478 /nfs/dbraw/zinc/69/94/78/1108699478.db2.gz SGXGHKSYVIWNEK-MOPGFXCFSA-N 1 3 341.499 2.787 10 0 EFAEHO CCc1ccccc1C[NH2+]CC1CC(NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001409301832 1109465357 /nfs/dbraw/zinc/46/53/57/1109465357.db2.gz ZKBBWZAVDWORNM-RRWXTXHCSA-N 1 3 345.531 2.820 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC3(C4CC4)CCC3)CC2)CC1 ZINC000899822473 1109502050 /nfs/dbraw/zinc/50/20/50/1109502050.db2.gz INSIWIZUAKYWHE-UHFFFAOYSA-N 1 3 333.520 2.632 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C[N@@H+]1C1CC1 ZINC000900994088 1109791643 /nfs/dbraw/zinc/79/16/43/1109791643.db2.gz FVUGFXZJXFGZNT-CZUORRHYSA-N 1 3 326.444 2.646 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)c2ccc(NC3=NCCC3)cc2)C[N@H+]1C1CC1 ZINC000900994088 1109791646 /nfs/dbraw/zinc/79/16/46/1109791646.db2.gz FVUGFXZJXFGZNT-CZUORRHYSA-N 1 3 326.444 2.646 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+]Cc1ccc2ccccc2c1 ZINC001483198168 1109997475 /nfs/dbraw/zinc/99/74/75/1109997475.db2.gz YCTFBTYTODEMIZ-MRXNPFEDSA-N 1 3 327.472 2.774 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]C/C=C/c2ccc(Cl)cc2)CC1 ZINC001483795330 1112455429 /nfs/dbraw/zinc/45/54/29/1112455429.db2.gz QYBUJVANYKLWLR-SNAWJCMRSA-N 1 3 349.906 2.932 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@@H]3CCC[C@H]([NH+](C)C)C3)CC2)cs1 ZINC001483783016 1112457085 /nfs/dbraw/zinc/45/70/85/1112457085.db2.gz IINFXHCDSCCTCX-SJORKVTESA-N 1 3 349.544 2.915 10 0 EFAEHO CC(C)=CC[N@H+](CC1CC1)C1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001483817435 1112468268 /nfs/dbraw/zinc/46/82/68/1112468268.db2.gz MDFNXIDQTJBVOU-GOSISDBHSA-N 1 3 347.547 2.997 10 0 EFAEHO CC(C)=CC[N@@H+](CC1CC1)C1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001483817435 1112468271 /nfs/dbraw/zinc/46/82/71/1112468271.db2.gz MDFNXIDQTJBVOU-GOSISDBHSA-N 1 3 347.547 2.997 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(CC[N@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001483845648 1112505469 /nfs/dbraw/zinc/50/54/69/1112505469.db2.gz AFRQRFYWXHLOMI-NRFANRHFSA-N 1 3 347.547 2.831 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@]2(CC[N@@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001483845648 1112505470 /nfs/dbraw/zinc/50/54/70/1112505470.db2.gz AFRQRFYWXHLOMI-NRFANRHFSA-N 1 3 347.547 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@]2(CC[N@H+](CC3=CCCCC3)C2)C1 ZINC001483846959 1112508331 /nfs/dbraw/zinc/50/83/31/1112508331.db2.gz KOENMTKCSGRSDL-HXUWFJFHSA-N 1 3 333.520 2.753 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@]2(CC[N@@H+](CC3=CCCCC3)C2)C1 ZINC001483846959 1112508332 /nfs/dbraw/zinc/50/83/32/1112508332.db2.gz KOENMTKCSGRSDL-HXUWFJFHSA-N 1 3 333.520 2.753 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001483848246 1112509148 /nfs/dbraw/zinc/50/91/48/1112509148.db2.gz RPADQHRGYVESHK-WHXUGTBJSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@@]2(CCN(C(=O)CN(C)C(C)C)C2)C1 ZINC001483848246 1112509150 /nfs/dbraw/zinc/50/91/50/1112509150.db2.gz RPADQHRGYVESHK-WHXUGTBJSA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1ccc(CN2CC[C@@]3(CCN(C(=O)CC[NH+](C)C)C3)C2)cc1F ZINC001483849521 1112511452 /nfs/dbraw/zinc/51/14/52/1112511452.db2.gz XEZOYKAMFSFHKY-HXUWFJFHSA-N 1 3 347.478 2.510 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H]1C[NH2+]CCCc1cccc(C)c1)N(C)C ZINC001483945244 1112585163 /nfs/dbraw/zinc/58/51/63/1112585163.db2.gz RSAYMHMCOOLGBB-PMACEKPBSA-N 1 3 345.531 2.848 10 0 EFAEHO CCCC[NH+]1CCC(C)(NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001483971567 1112602337 /nfs/dbraw/zinc/60/23/37/1112602337.db2.gz UASFPGUFFRULIP-IBGZPJMESA-N 1 3 341.515 2.970 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]C/C=C\Cl)C1CCCC1 ZINC001484001729 1112652845 /nfs/dbraw/zinc/65/28/45/1112652845.db2.gz RYEDZUNGVGUFHC-HJMWAZGYSA-N 1 3 341.927 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](CNCCF)C1CCCC1)[NH+]1CCCCC1 ZINC001484014018 1112663191 /nfs/dbraw/zinc/66/31/91/1112663191.db2.gz HIEMHGXTQKQUMN-MSOLQXFVSA-N 1 3 341.515 2.731 10 0 EFAEHO CC[C@@H](F)C[N@@H+]1CC[C@]2(C1)CCCCN(C(=O)CN(C)C(C)C)C2 ZINC001484022713 1112675874 /nfs/dbraw/zinc/67/58/74/1112675874.db2.gz NZOGKOLZWDPOIW-MJGOQNOKSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](F)C[N@H+]1CC[C@]2(C1)CCCCN(C(=O)CN(C)C(C)C)C2 ZINC001484022713 1112675876 /nfs/dbraw/zinc/67/58/76/1112675876.db2.gz NZOGKOLZWDPOIW-MJGOQNOKSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1(C)CC[NH+](CC[C@@H](C)F)CC1 ZINC001484136364 1112808984 /nfs/dbraw/zinc/80/89/84/1112808984.db2.gz DKPMATGSRAKOQF-SJORKVTESA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)NCC1(C)CCN(C/C=C/Cl)CC1 ZINC001484147087 1112825707 /nfs/dbraw/zinc/82/57/07/1112825707.db2.gz MQPUGJRKOWPGND-HWYYHXQYSA-N 1 3 341.927 2.830 10 0 EFAEHO CN(C)C1(C(=O)NC[C@]2(C)CCC[N@H+](CCCCCF)C2)CCC1 ZINC001484161610 1112857985 /nfs/dbraw/zinc/85/79/85/1112857985.db2.gz XQCRACQAOJLCTK-SFHVURJKSA-N 1 3 341.515 2.829 10 0 EFAEHO CN(C)C1(C(=O)NC[C@]2(C)CCC[N@@H+](CCCCCF)C2)CCC1 ZINC001484161610 1112857987 /nfs/dbraw/zinc/85/79/87/1112857987.db2.gz XQCRACQAOJLCTK-SFHVURJKSA-N 1 3 341.515 2.829 10 0 EFAEHO CC[N@H+](C)[C@H](C(=O)NC[C@]1(C)CCCN(CCF)C1)c1ccccc1 ZINC001484174108 1112887058 /nfs/dbraw/zinc/88/70/58/1112887058.db2.gz ONFAQZXFSMJLMB-ICSRJNTNSA-N 1 3 349.494 2.867 10 0 EFAEHO CC[N@@H+](C)[C@H](C(=O)NC[C@]1(C)CCCN(CCF)C1)c1ccccc1 ZINC001484174108 1112887063 /nfs/dbraw/zinc/88/70/63/1112887063.db2.gz ONFAQZXFSMJLMB-ICSRJNTNSA-N 1 3 349.494 2.867 10 0 EFAEHO CCN(C)[C@H](C(=O)NC[C@]1(C)CCC[N@H+](CCF)C1)c1ccccc1 ZINC001484174108 1112887068 /nfs/dbraw/zinc/88/70/68/1112887068.db2.gz ONFAQZXFSMJLMB-ICSRJNTNSA-N 1 3 349.494 2.867 10 0 EFAEHO CCN(C)[C@H](C(=O)NC[C@]1(C)CCC[N@@H+](CCF)C1)c1ccccc1 ZINC001484174108 1112887070 /nfs/dbraw/zinc/88/70/70/1112887070.db2.gz ONFAQZXFSMJLMB-ICSRJNTNSA-N 1 3 349.494 2.867 10 0 EFAEHO CC[N@H+](C)[C@@H](C(=O)NC[C@]1(C)CCCN(CCF)C1)c1ccccc1 ZINC001484174110 1112888313 /nfs/dbraw/zinc/88/83/13/1112888313.db2.gz ONFAQZXFSMJLMB-QUCCMNQESA-N 1 3 349.494 2.867 10 0 EFAEHO CC[N@@H+](C)[C@@H](C(=O)NC[C@]1(C)CCCN(CCF)C1)c1ccccc1 ZINC001484174110 1112888316 /nfs/dbraw/zinc/88/83/16/1112888316.db2.gz ONFAQZXFSMJLMB-QUCCMNQESA-N 1 3 349.494 2.867 10 0 EFAEHO CCN(C)[C@@H](C(=O)NC[C@]1(C)CCC[N@H+](CCF)C1)c1ccccc1 ZINC001484174110 1112888317 /nfs/dbraw/zinc/88/83/17/1112888317.db2.gz ONFAQZXFSMJLMB-QUCCMNQESA-N 1 3 349.494 2.867 10 0 EFAEHO CCN(C)[C@@H](C(=O)NC[C@]1(C)CCC[N@@H+](CCF)C1)c1ccccc1 ZINC001484174110 1112888322 /nfs/dbraw/zinc/88/83/22/1112888322.db2.gz ONFAQZXFSMJLMB-QUCCMNQESA-N 1 3 349.494 2.867 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@@]1(C)CCCN(Cc2ccsc2)C1 ZINC001484176704 1112892634 /nfs/dbraw/zinc/89/26/34/1112892634.db2.gz YGAGUCPMNPRDKN-GOSISDBHSA-N 1 3 337.533 2.808 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@@]1(C)CCCN(Cc2ccsc2)C1 ZINC001484176704 1112892636 /nfs/dbraw/zinc/89/26/36/1112892636.db2.gz YGAGUCPMNPRDKN-GOSISDBHSA-N 1 3 337.533 2.808 10 0 EFAEHO CC[N@H+](C)CCC(=O)NC[C@]1(C)CCCN(Cc2ccsc2)C1 ZINC001484176709 1112892817 /nfs/dbraw/zinc/89/28/17/1112892817.db2.gz YGAGUCPMNPRDKN-SFHVURJKSA-N 1 3 337.533 2.808 10 0 EFAEHO CC[N@@H+](C)CCC(=O)NC[C@]1(C)CCCN(Cc2ccsc2)C1 ZINC001484176709 1112892821 /nfs/dbraw/zinc/89/28/21/1112892821.db2.gz YGAGUCPMNPRDKN-SFHVURJKSA-N 1 3 337.533 2.808 10 0 EFAEHO CC[C@H](C)C[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001484196742 1112915111 /nfs/dbraw/zinc/91/51/11/1112915111.db2.gz WCGHEMSSHKZVND-GJZGRUSLSA-N 1 3 345.478 2.590 10 0 EFAEHO CC[C@H](C)C[N@H+]1CCC(F)(F)[C@@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001484196742 1112915114 /nfs/dbraw/zinc/91/51/14/1112915114.db2.gz WCGHEMSSHKZVND-GJZGRUSLSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N1CCC(F)(F)[C@H](CNC(=O)CCCC[NH+]2CCCC2)C1 ZINC001484198983 1112919449 /nfs/dbraw/zinc/91/94/49/1112919449.db2.gz YPAXALDSXBUNJR-MRXNPFEDSA-N 1 3 345.478 2.734 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@H](CC[NH2+]CCCC(C)(C)C)C2)C1 ZINC001484537925 1112992146 /nfs/dbraw/zinc/99/21/46/1112992146.db2.gz PYEUFWGCTHHHQL-MSOLQXFVSA-N 1 3 337.552 2.983 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@H]2CCN(C(=O)CN3CC[C@H](C)C3)C2)cs1 ZINC001484537291 1112992228 /nfs/dbraw/zinc/99/22/28/1112992228.db2.gz FUQADGVNVVTUSV-RDJZCZTQSA-N 1 3 349.544 2.727 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](CC[NH2+]CCCCC(F)(F)F)C1 ZINC001484550005 1113002349 /nfs/dbraw/zinc/00/23/49/1113002349.db2.gz PEMQEYJXEOSWTH-HNNXBMFYSA-N 1 3 349.441 2.643 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCc1ccc([C@H](C)[NH2+]CC[C@@H](C)F)cc1 ZINC001484563260 1113018920 /nfs/dbraw/zinc/01/89/20/1113018920.db2.gz LYULLVWUESIEMT-KGLIPLIRSA-N 1 3 346.450 2.976 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1cccc2c1CC[N@@H+](CC[C@@H](C)F)C2 ZINC001484612139 1113053589 /nfs/dbraw/zinc/05/35/89/1113053589.db2.gz JQAMSNGSRRSSFW-MRXNPFEDSA-N 1 3 349.494 2.749 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1cccc2c1CC[N@H+](CC[C@@H](C)F)C2 ZINC001484612139 1113053594 /nfs/dbraw/zinc/05/35/94/1113053594.db2.gz JQAMSNGSRRSSFW-MRXNPFEDSA-N 1 3 349.494 2.749 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@]2(CC[N@H+](CC3CC(C)C3)C2)C1 ZINC001484828066 1117745439 /nfs/dbraw/zinc/74/54/39/1117745439.db2.gz AHOSVDPOCUAOLI-AFMYVXGZSA-N 1 3 335.536 2.689 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@]2(CC[N@@H+](CC3CC(C)C3)C2)C1 ZINC001484828066 1117745443 /nfs/dbraw/zinc/74/54/43/1117745443.db2.gz AHOSVDPOCUAOLI-AFMYVXGZSA-N 1 3 335.536 2.689 10 0 EFAEHO CC[NH2+]C1(CC)CCN(C(=O)[C@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001484816682 1117749713 /nfs/dbraw/zinc/74/97/13/1117749713.db2.gz OQJAGHIOVWKCDX-SFHVURJKSA-N 1 3 327.488 2.580 10 0 EFAEHO CCC1([NH2+]Cc2cccc(C)c2)CCN(C(=O)CN2CCCC2)CC1 ZINC001484818822 1117752731 /nfs/dbraw/zinc/75/27/31/1117752731.db2.gz ATMFHDAIEKSAPT-UHFFFAOYSA-N 1 3 343.515 2.952 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)cc1C ZINC001484909447 1117822949 /nfs/dbraw/zinc/82/29/49/1117822949.db2.gz NHZJGXPMTJIWNV-PKOBYXMFSA-N 1 3 331.504 2.580 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(C)([NH2+]CC=C(Cl)Cl)CC2)C1 ZINC001484922993 1117839204 /nfs/dbraw/zinc/83/92/04/1117839204.db2.gz AFDWHZFCQSGTDC-CYBMUJFWSA-N 1 3 348.318 2.618 10 0 EFAEHO C[C@@H]([NH2+]CC=C(Cl)Cl)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001493851641 1117846430 /nfs/dbraw/zinc/84/64/30/1117846430.db2.gz WMUAZFYVCHOXQY-CYBMUJFWSA-N 1 3 348.318 2.618 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCN(C/C=C/c2ccccc2)CC1(C)C ZINC001484937211 1117850746 /nfs/dbraw/zinc/85/07/46/1117850746.db2.gz LNYGRERIAFTGBP-BLRBJFNZSA-N 1 3 343.515 2.868 10 0 EFAEHO CCC[NH2+]CC1(c2ccccc2)CCN(C(=O)Cc2c[nH]cn2)CC1 ZINC001484945456 1117872725 /nfs/dbraw/zinc/87/27/25/1117872725.db2.gz GHBRPIAHTSLLBI-UHFFFAOYSA-N 1 3 340.471 2.512 10 0 EFAEHO COc1ccc(C[N@@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001484987703 1117913311 /nfs/dbraw/zinc/91/33/11/1117913311.db2.gz GMILYNLVZLDTTR-WMZOPIPTSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1ccc(C[N@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)cc1 ZINC001484987703 1117913315 /nfs/dbraw/zinc/91/33/15/1117913315.db2.gz GMILYNLVZLDTTR-WMZOPIPTSA-N 1 3 347.503 2.505 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001484987660 1117913750 /nfs/dbraw/zinc/91/37/50/1117913750.db2.gz FAROVTVHAMFWOR-IEBWSBKVSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@@H](NC(=O)CN(C)C(C)C)C[C@H]2C)cc1 ZINC001484987660 1117913754 /nfs/dbraw/zinc/91/37/54/1117913754.db2.gz FAROVTVHAMFWOR-IEBWSBKVSA-N 1 3 331.504 2.804 10 0 EFAEHO CN(CC(=O)NC1CC(C[NH2+]Cc2ccccc2F)C1)CC(C)(C)C ZINC001485102850 1118039013 /nfs/dbraw/zinc/03/90/13/1118039013.db2.gz UTMXSVHQZKISSF-UHFFFAOYSA-N 1 3 349.494 2.788 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC001485157844 1118100646 /nfs/dbraw/zinc/10/06/46/1118100646.db2.gz VMWPBMFSDQBCNA-VXGBXAGGSA-N 1 3 343.924 2.869 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)[C@@H](C)NC(=O)C(C)(C)N2CCCC2)c(C)n1 ZINC001485180612 1118114924 /nfs/dbraw/zinc/11/49/24/1118114924.db2.gz NREVKTVLELSYEX-HZPDHXFCSA-N 1 3 346.519 2.556 10 0 EFAEHO CN(C(=O)CC[NH+](C)C)C1CCC(NC/C(Cl)=C/Cl)CC1 ZINC001485241234 1118172449 /nfs/dbraw/zinc/17/24/49/1118172449.db2.gz IFOHACSHSZOZCY-BENRWUELSA-N 1 3 336.307 2.616 10 0 EFAEHO Cc1ccc(C[N@@H+](C)[C@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001485298639 1118216492 /nfs/dbraw/zinc/21/64/92/1118216492.db2.gz BINGVHGQWVPFKE-MJGOQNOKSA-N 1 3 331.504 2.804 10 0 EFAEHO Cc1ccc(C[N@H+](C)[C@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)cc1 ZINC001485298639 1118216495 /nfs/dbraw/zinc/21/64/95/1118216495.db2.gz BINGVHGQWVPFKE-MJGOQNOKSA-N 1 3 331.504 2.804 10 0 EFAEHO C[C@@H](CNC(=O)C12CCC[NH+](CCC1)C2)N(C)Cc1cccc(F)c1 ZINC001485320103 1118232057 /nfs/dbraw/zinc/23/20/57/1118232057.db2.gz QLCHFHZSLACTSS-INIZCTEOSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)[C@H]1CCCc2ccccc21 ZINC001485389778 1118331132 /nfs/dbraw/zinc/33/11/32/1118331132.db2.gz VMASMFCVWNRUOZ-LPHOPBHVSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC001485389778 1118331133 /nfs/dbraw/zinc/33/11/33/1118331133.db2.gz VMASMFCVWNRUOZ-LPHOPBHVSA-N 1 3 331.504 2.841 10 0 EFAEHO CCCC[C@H](C[NH2+]C(C)C)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001485468569 1118378405 /nfs/dbraw/zinc/37/84/05/1118378405.db2.gz NUZNUBUFXVVWNA-CRAIPNDOSA-N 1 3 329.504 2.872 10 0 EFAEHO CC(C)C[C@H](C)C[NH+]1CC([C@@H](C)NC(=O)C(C)(C)N2CCCC2)C1 ZINC001485519925 1118433157 /nfs/dbraw/zinc/43/31/57/1118433157.db2.gz LIDSIUDBZUKWFI-DLBZAZTESA-N 1 3 337.552 2.980 10 0 EFAEHO Cc1ccc(C)c(C[NH+]2CC([C@H](C)NC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001485526573 1118437098 /nfs/dbraw/zinc/43/70/98/1118437098.db2.gz OZQUYKGIDWBEQM-AEFFLSMTSA-N 1 3 343.515 2.582 10 0 EFAEHO C[NH+](C)CCCC(=O)N1C[C@@]2(C)CN(Cc3ccsc3)C[C@@]2(C)C1 ZINC001485669208 1118518455 /nfs/dbraw/zinc/51/84/55/1118518455.db2.gz QZQLSYNJHNSNIP-KDURUIRLSA-N 1 3 349.544 2.760 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H]1C[C@H](C[NH2+]CCc2cccs2)C1 ZINC001485682926 1118526071 /nfs/dbraw/zinc/52/60/71/1118526071.db2.gz AIOVWFVSKXVUKZ-BQFCYCMXSA-N 1 3 349.544 2.648 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@H]2C[C@H](C[NH2+]CCC3CC3)C2)c1 ZINC001485707005 1118530644 /nfs/dbraw/zinc/53/06/44/1118530644.db2.gz RDIJWLBBEQTRLJ-UAPYVXQJSA-N 1 3 329.488 2.646 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H]2CCc3ccc(F)cc32)C1)N(C)C ZINC001485696041 1118534371 /nfs/dbraw/zinc/53/43/71/1118534371.db2.gz NTCDYNYEBMLCPU-FDARSICLSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)C[NH2+]Cc1cc(Br)cnc1OCCN(C)C ZINC000051548829 214097563 /nfs/dbraw/zinc/09/75/63/214097563.db2.gz GUQYFJNRPKYJLL-UHFFFAOYSA-N 1 3 330.270 2.530 10 0 EFAEHO CN(C)CCOc1cccc(C[NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)c1 ZINC000245848604 282110559 /nfs/dbraw/zinc/11/05/59/282110559.db2.gz FZJHOBNOYAQQMY-IPMKNSEASA-N 1 3 332.488 2.920 10 0 EFAEHO N[C@@H](CC[N@@H+]1CCCC[C@@H]1CO)c1cccc(Br)c1 ZINC000053941664 214205461 /nfs/dbraw/zinc/20/54/61/214205461.db2.gz OZCDHXBKQSQLHG-CABCVRRESA-N 1 3 327.266 2.686 10 0 EFAEHO N[C@@H](CC[N@H+]1CCCC[C@@H]1CO)c1cccc(Br)c1 ZINC000053941664 214205462 /nfs/dbraw/zinc/20/54/62/214205462.db2.gz OZCDHXBKQSQLHG-CABCVRRESA-N 1 3 327.266 2.686 10 0 EFAEHO [NH3+][C@@H](CCN1CCCC[C@@H]1CO)c1cccc(Br)c1 ZINC000053941664 214205464 /nfs/dbraw/zinc/20/54/64/214205464.db2.gz OZCDHXBKQSQLHG-CABCVRRESA-N 1 3 327.266 2.686 10 0 EFAEHO C[NH2+][C@H](CCN(CCO)C(C)C)c1ccc(Br)cc1 ZINC000053972074 214207433 /nfs/dbraw/zinc/20/74/33/214207433.db2.gz BFCWNCYPHOXYJY-OAHLLOKOSA-N 1 3 329.282 2.802 10 0 EFAEHO CN[C@@H](CC[N@H+](CCO)C1CC1)c1ccc(Br)cc1 ZINC000053972117 214208248 /nfs/dbraw/zinc/20/82/48/214208248.db2.gz GQANJARARPWHFO-HNNXBMFYSA-N 1 3 327.266 2.556 10 0 EFAEHO CN[C@@H](CC[N@@H+](CCO)C1CC1)c1ccc(Br)cc1 ZINC000053972117 214208252 /nfs/dbraw/zinc/20/82/52/214208252.db2.gz GQANJARARPWHFO-HNNXBMFYSA-N 1 3 327.266 2.556 10 0 EFAEHO CN(Cc1ccccc1C[N@H+](C)C[C@@H]1CCCO1)C[C@@H]1CCCO1 ZINC000103480568 219304717 /nfs/dbraw/zinc/30/47/17/219304717.db2.gz WLIKNFQERFYHAE-PMACEKPBSA-N 1 3 332.488 2.908 10 0 EFAEHO CN(Cc1ccccc1C[N@@H+](C)C[C@@H]1CCCO1)C[C@@H]1CCCO1 ZINC000103480568 219304719 /nfs/dbraw/zinc/30/47/19/219304719.db2.gz WLIKNFQERFYHAE-PMACEKPBSA-N 1 3 332.488 2.908 10 0 EFAEHO [NH3+]CCc1cc(Br)ccc1OCCN1CCCCC1 ZINC000037720840 213162887 /nfs/dbraw/zinc/16/28/87/213162887.db2.gz LIFNPPXKZQJQIF-UHFFFAOYSA-N 1 3 327.266 2.815 10 0 EFAEHO CCCN1CCN([C@@H](C[NH3+])c2ccc(F)c(Br)c2)CC1 ZINC000022166432 212280515 /nfs/dbraw/zinc/28/05/15/212280515.db2.gz ARXHCORJVPWRTH-HNNXBMFYSA-N 1 3 344.272 2.616 10 0 EFAEHO Cc1ccncc1CNCc1ccccc1C[N@@H+]1CCC[C@@H]1CO ZINC000354655552 242009810 /nfs/dbraw/zinc/00/98/10/242009810.db2.gz GOROIMVMRAWDME-HXUWFJFHSA-N 1 3 325.456 2.637 10 0 EFAEHO Cc1ccncc1CNCc1ccccc1C[N@H+]1CCC[C@@H]1CO ZINC000354655552 242009819 /nfs/dbraw/zinc/00/98/19/242009819.db2.gz GOROIMVMRAWDME-HXUWFJFHSA-N 1 3 325.456 2.637 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(CN2CCC(C(N)=O)CC2)cc1)[C@H]1CC1(C)C ZINC000414334040 244094454 /nfs/dbraw/zinc/09/44/54/244094454.db2.gz FXWRKLKOSDLKAF-DNVCBOLYSA-N 1 3 343.515 2.908 10 0 EFAEHO CN1CCC(C[NH2+]CC2(C)CCCCCC2)(N2CCOCC2)CC1 ZINC000414486930 244192752 /nfs/dbraw/zinc/19/27/52/244192752.db2.gz RLCPLUMSIMKVAC-UHFFFAOYSA-N 1 3 337.552 2.733 10 0 EFAEHO COc1cc(CNCc2ccc([C@@H](C)[NH3+])cc2)cc2c1OCCO2 ZINC000414811635 244363480 /nfs/dbraw/zinc/36/34/80/244363480.db2.gz QAGOALXNUUJRAB-CYBMUJFWSA-N 1 3 328.412 2.776 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)NC[C@H](N)c1ccc(C(C)C)cc1 ZINC000418120602 245111248 /nfs/dbraw/zinc/11/12/48/245111248.db2.gz VZBNESIVPNGTFG-QAPCUYQASA-N 1 3 334.508 2.839 10 0 EFAEHO CC(C)[C@@H]([NH3+])CNC(=O)N1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000418415150 245150037 /nfs/dbraw/zinc/15/00/37/245150037.db2.gz UIQUAFBZEFMCCS-HNNXBMFYSA-N 1 3 326.529 2.512 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CNC(=O)N2CCN(CCC(C)(C)C)CC2)cc1 ZINC000418462532 245165593 /nfs/dbraw/zinc/16/55/93/245165593.db2.gz NBRSALDUKNZEFP-INIZCTEOSA-N 1 3 346.519 2.970 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)N[C@@H](CCC[NH3+])c2ccccc2)CCN1C ZINC000418680715 245243445 /nfs/dbraw/zinc/24/34/45/245243445.db2.gz UUAQIFHUCGVMOX-NXHRZFHOSA-N 1 3 332.492 2.591 10 0 EFAEHO CCN(C(=O)N[C@H](C)CCC[NH3+])[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000418689783 245246233 /nfs/dbraw/zinc/24/62/33/245246233.db2.gz OUZJTPQGIJQKJQ-ZIFCJYIRSA-N 1 3 346.519 2.981 10 0 EFAEHO C[C@@H]1CN(Cc2ccc(C[NH+]3CCCCC3)cc2)[C@@H](C)CN1CCO ZINC000419337824 245385253 /nfs/dbraw/zinc/38/52/53/245385253.db2.gz LGSOPPOCKHNNCG-MOPGFXCFSA-N 1 3 345.531 2.559 10 0 EFAEHO C[C@H]([NH2+]C[C@H]1CC[C@H](C(N)=O)CC1)c1ccc(OCCN(C)C)cc1 ZINC000421850042 246137691 /nfs/dbraw/zinc/13/76/91/246137691.db2.gz COXGTNOPBRCQIT-BQFCYCMXSA-N 1 3 347.503 2.569 10 0 EFAEHO CN(C)CCOc1ccccc1C(=O)N(C)CC[C@H]1CCCC[N@@H+]1C ZINC000266062665 248072162 /nfs/dbraw/zinc/07/21/62/248072162.db2.gz AYGWQOYMVUHSGU-QGZVFWFLSA-N 1 3 347.503 2.573 10 0 EFAEHO CN(C)CCOc1ccccc1C(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000266062665 248072165 /nfs/dbraw/zinc/07/21/65/248072165.db2.gz AYGWQOYMVUHSGU-QGZVFWFLSA-N 1 3 347.503 2.573 10 0 EFAEHO C[C@@H]1CC2(CN1CC(=O)NC13CC4CC(CC(C4)C1)C3)CC[NH2+]CC2 ZINC000424288659 296294242 /nfs/dbraw/zinc/29/42/42/296294242.db2.gz KWQBGXQLXCENQM-NEFAXPCMSA-N 1 3 345.531 2.535 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NCCN2CCCC(C)(C)C2)CC1 ZINC000445036427 250377726 /nfs/dbraw/zinc/37/77/26/250377726.db2.gz UUQKYZKGBWHXDY-UHFFFAOYSA-N 1 3 338.540 2.530 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)N[C@H](CC[NH+](C)C)C(C)(C)C ZINC000341605267 296311978 /nfs/dbraw/zinc/31/19/78/296311978.db2.gz LMAWYKIUXNUKJH-HZPDHXFCSA-N 1 3 326.529 2.526 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC2=CCOCC2)CC1 ZINC000449405496 251014377 /nfs/dbraw/zinc/01/43/77/251014377.db2.gz YYLFUEVZETWWAC-UHFFFAOYSA-N 1 3 329.488 2.655 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](C)CC(C)(C)CO)CC1 ZINC000449431627 251022899 /nfs/dbraw/zinc/02/28/99/251022899.db2.gz YQXJRAZVESQFQS-UHFFFAOYSA-N 1 3 333.520 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](C)CC(C)(C)CO)CC1 ZINC000449431627 251022902 /nfs/dbraw/zinc/02/29/02/251022902.db2.gz YQXJRAZVESQFQS-UHFFFAOYSA-N 1 3 333.520 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H](C)CCCCO)CC1 ZINC000449430070 251023046 /nfs/dbraw/zinc/02/30/46/251023046.db2.gz VZGNRAGNGZEVIQ-SFHVURJKSA-N 1 3 333.520 2.859 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)NCCCCC[NH+]1CCCC1 ZINC000454492287 252283466 /nfs/dbraw/zinc/28/34/66/252283466.db2.gz YBIYYGUFOYJBMA-HDICACEKSA-N 1 3 338.540 2.815 10 0 EFAEHO CC(=O)NC1CCC([NH2+][C@@H](C)c2ccc(OCCN(C)C)cc2)CC1 ZINC000268863956 252313398 /nfs/dbraw/zinc/31/33/98/252313398.db2.gz SLKUBNZFFYBNCL-MNNVXMFVSA-N 1 3 347.503 2.725 10 0 EFAEHO CCN(Cc1ccc(C(=O)N2CC[C@H](C)C[C@H]2C[NH3+])cc1)C1CC1 ZINC000261854472 285097569 /nfs/dbraw/zinc/09/75/69/285097569.db2.gz QUKMKCNDKPPZGA-KXBFYZLASA-N 1 3 329.488 2.870 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)CC1(C(F)(F)F)CC1 ZINC000352872352 285242957 /nfs/dbraw/zinc/24/29/57/285242957.db2.gz MNBMREUVZXEFHL-CQSZACIVSA-N 1 3 349.441 2.594 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)C(=O)CC1(C(F)(F)F)CC1 ZINC000352872352 285242958 /nfs/dbraw/zinc/24/29/58/285242958.db2.gz MNBMREUVZXEFHL-CQSZACIVSA-N 1 3 349.441 2.594 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@H]2C)[C@H](C)C1 ZINC000448518851 285387525 /nfs/dbraw/zinc/38/75/25/285387525.db2.gz AYSBVYGTKSQBHV-TVFCKZIOSA-N 1 3 338.540 2.621 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NCCN2[C@H](C)CCC[C@H]2C)[C@H](C)C1 ZINC000448518851 285387526 /nfs/dbraw/zinc/38/75/26/285387526.db2.gz AYSBVYGTKSQBHV-TVFCKZIOSA-N 1 3 338.540 2.621 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](C)N2CCCC[C@@H]2C)[C@H](C)C1 ZINC000448462153 285388062 /nfs/dbraw/zinc/38/80/62/285388062.db2.gz QXFFGUBRBBHMRG-OWSLCNJRSA-N 1 3 338.540 2.621 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)NC[C@H](C)N2CCCC[C@@H]2C)[C@H](C)C1 ZINC000448462153 285388063 /nfs/dbraw/zinc/38/80/63/285388063.db2.gz QXFFGUBRBBHMRG-OWSLCNJRSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@@H](CCC(F)(F)F)[NH2+]Cc1ccc(C(=O)NCCN(C)C)cc1 ZINC000346321104 142189217 /nfs/dbraw/zinc/18/92/17/142189217.db2.gz LPDJZJHFFJVMRZ-ZDUSSCGKSA-N 1 3 345.409 2.799 10 0 EFAEHO C[C@@H](NC1CC[NH+](CCC(=O)N(C)C)CC1)c1ccc(Cl)cc1 ZINC000347998479 142306002 /nfs/dbraw/zinc/30/60/02/142306002.db2.gz ICFGBWSTDWGXOP-CQSZACIVSA-N 1 3 337.895 2.933 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC[C@H](C)[N@H+](C)Cc1ccccc1 ZINC000349648470 142343336 /nfs/dbraw/zinc/34/33/36/142343336.db2.gz ZUIXTLWGLLGDOC-HKUYNNGSSA-N 1 3 331.504 2.888 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000349648470 142343337 /nfs/dbraw/zinc/34/33/37/142343337.db2.gz ZUIXTLWGLLGDOC-HKUYNNGSSA-N 1 3 331.504 2.888 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000341272530 145024621 /nfs/dbraw/zinc/02/46/21/145024621.db2.gz YUPOVGLJYNCNFH-GASCZTMLSA-N 1 3 338.540 2.858 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)NCCN1CCCC[C@@H]1C ZINC000342964386 145231482 /nfs/dbraw/zinc/23/14/82/145231482.db2.gz FNSGXZKCWBRMJF-ROUUACIJSA-N 1 3 338.540 2.815 10 0 EFAEHO CCCC[N@H+]1CCCC[C@H]1CNC(=O)NCCN1CCCC[C@@H]1C ZINC000342964386 145231484 /nfs/dbraw/zinc/23/14/84/145231484.db2.gz FNSGXZKCWBRMJF-ROUUACIJSA-N 1 3 338.540 2.815 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1CNC(=O)c1cccc(CN2CCCC2)c1 ZINC000343575702 145243195 /nfs/dbraw/zinc/24/31/95/145243195.db2.gz RFCGLXMLPHKQDG-LJQANCHMSA-N 1 3 329.488 2.887 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1CNC(=O)c1cccc(CN2CCCC2)c1 ZINC000343575702 145243197 /nfs/dbraw/zinc/24/31/97/145243197.db2.gz RFCGLXMLPHKQDG-LJQANCHMSA-N 1 3 329.488 2.887 10 0 EFAEHO CN(C[C@@H]1CC=CCC1)C(=O)NC1CCN(C2CC[NH+](C)CC2)CC1 ZINC000343681312 145269950 /nfs/dbraw/zinc/26/99/50/145269950.db2.gz GDOQXLOBTBJHSF-QGZVFWFLSA-N 1 3 348.535 2.543 10 0 EFAEHO O=C(CCN1CCc2ccccc2C1)N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000348909250 146023059 /nfs/dbraw/zinc/02/30/59/146023059.db2.gz IKOCHCXHJRJBDP-HXUWFJFHSA-N 1 3 341.499 2.522 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(CCN(C)C)Cc1ccc(-c2cc[nH]n2)o1 ZINC000349072595 146047352 /nfs/dbraw/zinc/04/73/52/146047352.db2.gz JGFAACZEJXCBHB-MRXNPFEDSA-N 1 3 345.491 2.518 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(CCN(C)C)Cc1ccc(-c2cc[nH]n2)o1 ZINC000349072595 146047354 /nfs/dbraw/zinc/04/73/54/146047354.db2.gz JGFAACZEJXCBHB-MRXNPFEDSA-N 1 3 345.491 2.518 10 0 EFAEHO Cc1cccc(O[C@@H]2CCCC[C@H]2NC[C@@H](O)C[N@@H+](C)C2CC2)c1 ZINC000351601915 146156612 /nfs/dbraw/zinc/15/66/12/146156612.db2.gz GWQZGJDRVIPVTJ-MISYRCLQSA-N 1 3 332.488 2.730 10 0 EFAEHO Cc1cccc(O[C@@H]2CCCC[C@H]2NC[C@@H](O)C[N@H+](C)C2CC2)c1 ZINC000351601915 146156615 /nfs/dbraw/zinc/15/66/15/146156615.db2.gz GWQZGJDRVIPVTJ-MISYRCLQSA-N 1 3 332.488 2.730 10 0 EFAEHO CN(CCC[NH+](C)C)C(=O)N[C@H](CN1CCCCC1)c1ccccc1 ZINC000680508804 549335695 /nfs/dbraw/zinc/33/56/95/549335695.db2.gz XUOIFUSQAFRDLZ-LJQANCHMSA-N 1 3 346.519 2.807 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000355592959 147006939 /nfs/dbraw/zinc/00/69/39/147006939.db2.gz BQGCQZBWKLNXPW-LMMKCTJWSA-N 1 3 346.519 2.679 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000356539930 147270949 /nfs/dbraw/zinc/27/09/49/147270949.db2.gz XZLRJHIKHGCUGV-MJGOQNOKSA-N 1 3 331.504 2.888 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000356539930 147270951 /nfs/dbraw/zinc/27/09/51/147270951.db2.gz XZLRJHIKHGCUGV-MJGOQNOKSA-N 1 3 331.504 2.888 10 0 EFAEHO O=C([C@H]1CC12CC[NH+](CCCN1CCCCC1)CC2)N1CCCCC1 ZINC000364601939 149193879 /nfs/dbraw/zinc/19/38/79/149193879.db2.gz DMRHUSVMUHKTHZ-LJQANCHMSA-N 1 3 347.547 2.977 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000368094053 150033671 /nfs/dbraw/zinc/03/36/71/150033671.db2.gz VTJSJPNPWOWOMN-QFBILLFUSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000368094053 150033672 /nfs/dbraw/zinc/03/36/72/150033672.db2.gz VTJSJPNPWOWOMN-QFBILLFUSA-N 1 3 341.515 2.970 10 0 EFAEHO CCN1CCC[C@@H]1CNC(=[NH2+])NCc1cccc(-c2cccnc2)c1 ZINC000368435411 150116372 /nfs/dbraw/zinc/11/63/72/150116372.db2.gz LRBXEKYANLLPIS-LJQANCHMSA-N 1 3 337.471 2.847 10 0 EFAEHO Cc1csc2c1ncnc2N(C)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000369086325 150271282 /nfs/dbraw/zinc/27/12/82/150271282.db2.gz VTGWODHSAZAKSM-OAHLLOKOSA-N 1 3 345.516 2.604 10 0 EFAEHO Cc1csc2c1ncnc2N(C)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000369086324 150271415 /nfs/dbraw/zinc/27/14/15/150271415.db2.gz VTGWODHSAZAKSM-HNNXBMFYSA-N 1 3 345.516 2.604 10 0 EFAEHO Cc1ccc(C2CC[NH+](CCCN3CCN(C(C)C)CC3)CC2)cn1 ZINC000369196469 150298981 /nfs/dbraw/zinc/29/89/81/150298981.db2.gz YSIMGICITYCASD-UHFFFAOYSA-N 1 3 344.547 2.986 10 0 EFAEHO C[C@@H]1CCOCCN1Cc1cccc(C[N@@H+]2CCOCC[C@H]2C)c1 ZINC000378456119 152088953 /nfs/dbraw/zinc/08/89/53/152088953.db2.gz AYWGKOMGHDKYIC-QZTJIDSGSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@@H]1CCOCCN1Cc1cccc(C[N@H+]2CCOCC[C@H]2C)c1 ZINC000378456119 152088956 /nfs/dbraw/zinc/08/89/56/152088956.db2.gz AYWGKOMGHDKYIC-QZTJIDSGSA-N 1 3 332.488 2.908 10 0 EFAEHO Cc1ccc([C@H]2CCC[N@@H+]2C[C@@H]2CCCN(C(=O)CN)C2)cc1C ZINC000414698712 292267275 /nfs/dbraw/zinc/26/72/75/292267275.db2.gz XUAJQNAMXWWOIT-PKOBYXMFSA-N 1 3 329.488 2.638 10 0 EFAEHO Cc1ccc([C@H]2CCC[N@H+]2C[C@@H]2CCCN(C(=O)CN)C2)cc1C ZINC000414698712 292267279 /nfs/dbraw/zinc/26/72/79/292267279.db2.gz XUAJQNAMXWWOIT-PKOBYXMFSA-N 1 3 329.488 2.638 10 0 EFAEHO C[C@@H](NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1CCCC[NH2+]1 ZINC000423081079 287009845 /nfs/dbraw/zinc/00/98/45/287009845.db2.gz BBPAIRKVKCWCOF-KKOFPSKJSA-N 1 3 333.442 2.912 10 0 EFAEHO CCCN1CCC([NH2+]Cc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)CC1 ZINC000157134857 544773969 /nfs/dbraw/zinc/77/39/69/544773969.db2.gz KWKFNRUAECYQEO-IAGOWNOFSA-N 1 3 346.519 2.659 10 0 EFAEHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2ccc(OCCOC)c(OC)c2)C1 ZINC000163258264 544832254 /nfs/dbraw/zinc/83/22/54/544832254.db2.gz KDBRPCMQMGYNPU-HOTGVXAUSA-N 1 3 336.476 2.713 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000194143549 265364423 /nfs/dbraw/zinc/36/44/23/265364423.db2.gz ZIUMLRDJMCCZDZ-IBGZPJMESA-N 1 3 344.503 2.566 10 0 EFAEHO COC1(C[C@H](C)[NH2+]Cc2ccc(CN3CCN(C)CC3)cc2)CCC1 ZINC000277147605 273148440 /nfs/dbraw/zinc/14/84/40/273148440.db2.gz PXWHOMQJZSGXOS-SFHVURJKSA-N 1 3 345.531 2.871 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@H]2CC[N@H+](C)[C@@H](C)C2)N2CCCC2)cc1 ZINC000279110062 273177717 /nfs/dbraw/zinc/17/77/17/273177717.db2.gz BVKMDGNEEQQJEO-IHPCNDPISA-N 1 3 343.515 2.978 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)N2CCCC2)cc1 ZINC000279110062 273177718 /nfs/dbraw/zinc/17/77/18/273177718.db2.gz BVKMDGNEEQQJEO-IHPCNDPISA-N 1 3 343.515 2.978 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)CC[N@@H+]1C ZINC000279223455 273190181 /nfs/dbraw/zinc/19/01/81/273190181.db2.gz PIEZFRNQKZZXMZ-NSHGMRRFSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)CC[N@H+]1C ZINC000279223455 273190182 /nfs/dbraw/zinc/19/01/82/273190182.db2.gz PIEZFRNQKZZXMZ-NSHGMRRFSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)Nc2ccccc2NC2CCN(C)CC2)CC[N@@H+]1C ZINC000279498552 273221892 /nfs/dbraw/zinc/22/18/92/273221892.db2.gz SIMWIUSLAWBNNY-HOTGVXAUSA-N 1 3 344.503 2.862 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)Nc2ccccc2NC2CCN(C)CC2)CC[N@H+]1C ZINC000279498552 273221893 /nfs/dbraw/zinc/22/18/93/273221893.db2.gz SIMWIUSLAWBNNY-HOTGVXAUSA-N 1 3 344.503 2.862 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@@H](C)[C@H]2C[C@@H]2c2ccc(OC)cc2)CC1 ZINC000284442536 273839195 /nfs/dbraw/zinc/83/91/95/273839195.db2.gz SAQYFLZUVUUSHI-IOMROCGXSA-N 1 3 345.531 2.804 10 0 EFAEHO CCC[C@H](C(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)N(C)C ZINC000161846513 276038459 /nfs/dbraw/zinc/03/84/59/276038459.db2.gz KKPMYXKNZFQCPI-DOTOQJQBSA-N 1 3 337.533 2.807 10 0 EFAEHO CCC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)N(C)C ZINC000161846513 276038460 /nfs/dbraw/zinc/03/84/60/276038460.db2.gz KKPMYXKNZFQCPI-DOTOQJQBSA-N 1 3 337.533 2.807 10 0 EFAEHO CCN(C(=O)NC[C@H]([NH3+])C(C)C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418389845 276062372 /nfs/dbraw/zinc/06/23/72/276062372.db2.gz RZTJTKKPCMAEES-QRQLOZEOSA-N 1 3 346.519 2.837 10 0 EFAEHO CCN1CCN(Cc2ccccc2C[NH2+][C@H]2CC[C@@H]2SC)CC1 ZINC000425334369 276196849 /nfs/dbraw/zinc/19/68/49/276196849.db2.gz DPGOAJVOMODXJJ-OALUTQOASA-N 1 3 333.545 2.808 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(C)C(=O)N[C@@H](C)CN(C)Cc1ccccc1 ZINC000181280629 276376924 /nfs/dbraw/zinc/37/69/24/276376924.db2.gz RAEUGPNKOBRZJC-HKUYNNGSSA-N 1 3 346.519 2.633 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(C)C(=O)N[C@@H](C)CN(C)Cc1ccccc1 ZINC000181280629 276376925 /nfs/dbraw/zinc/37/69/25/276376925.db2.gz RAEUGPNKOBRZJC-HKUYNNGSSA-N 1 3 346.519 2.633 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)[C@@H]2C[C@H]3CCCC[C@H]3[NH2+]2)cc1 ZINC000262423056 278049552 /nfs/dbraw/zinc/04/95/52/278049552.db2.gz GAVTVINRTVTMGB-MKXGPGLRSA-N 1 3 329.488 2.847 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21)N1CCc2sccc2C1 ZINC000353396650 278209686 /nfs/dbraw/zinc/20/96/86/278209686.db2.gz UKFBDHJKOJZGGT-BZZMCLGOSA-N 1 3 333.545 2.957 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@@H+](C)[C@@H]2CCC[C@H]21)N1CCc2sccc2C1 ZINC000353396650 278209688 /nfs/dbraw/zinc/20/96/88/278209688.db2.gz UKFBDHJKOJZGGT-BZZMCLGOSA-N 1 3 333.545 2.957 10 0 EFAEHO C[C@H](Cc1ccccc1)C[N@H+](C)[C@H]1CCN(C2CCN(C)CC2)C1 ZINC000377633063 279380856 /nfs/dbraw/zinc/38/08/56/279380856.db2.gz UOKLQMSVJMDGRM-NQIIRXRSSA-N 1 3 329.532 2.966 10 0 EFAEHO C[C@H](Cc1ccccc1)C[N@@H+](C)[C@H]1CCN(C2CCN(C)CC2)C1 ZINC000377633063 279380858 /nfs/dbraw/zinc/38/08/58/279380858.db2.gz UOKLQMSVJMDGRM-NQIIRXRSSA-N 1 3 329.532 2.966 10 0 EFAEHO c1ccc2c(c1)C[C@H](CN[C@@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)O2 ZINC000422804035 280491360 /nfs/dbraw/zinc/49/13/60/280491360.db2.gz GXWRSEUEJIFMCS-HGHGUNKESA-N 1 3 336.435 2.836 10 0 EFAEHO CC[C@H]1[C@H](CO)CC[N@@H+]1Cc1ccccc1N(C)C1CCN(C)CC1 ZINC000449427078 281275186 /nfs/dbraw/zinc/27/51/86/281275186.db2.gz RUNZITDGWPXEAX-ICSRJNTNSA-N 1 3 345.531 2.810 10 0 EFAEHO CC[C@H]1[C@H](CO)CC[N@H+]1Cc1ccccc1N(C)C1CCN(C)CC1 ZINC000449427078 281275188 /nfs/dbraw/zinc/27/51/88/281275188.db2.gz RUNZITDGWPXEAX-ICSRJNTNSA-N 1 3 345.531 2.810 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NC[C@H](C)N2CCC(C)CC2)CC1 ZINC000073897578 292730220 /nfs/dbraw/zinc/73/02/20/292730220.db2.gz WBCAKAFEYBFWSP-KRWDZBQOSA-N 1 3 338.540 2.528 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CC(O)(CC)CC)CC1 ZINC000088696119 292829897 /nfs/dbraw/zinc/82/98/97/292829897.db2.gz BLMVHAONUJGJKI-UHFFFAOYSA-N 1 3 333.520 2.859 10 0 EFAEHO COC[C@@H]([NH2+]CC1(N2CCCCC2)CCN(C)CC1)C1CCCC1 ZINC000375343532 292834595 /nfs/dbraw/zinc/83/45/95/292834595.db2.gz FKMXZURSWBIGNE-LJQANCHMSA-N 1 3 337.552 2.732 10 0 EFAEHO CCN1CC[C@@H](C[NH2+]C[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000130005216 293150772 /nfs/dbraw/zinc/15/07/72/293150772.db2.gz PCEBWMWZKLHUOZ-HOTGVXAUSA-N 1 3 325.497 2.565 10 0 EFAEHO Cc1nc(C[NH3+])ccc1[C@@H](C)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000423102214 293260881 /nfs/dbraw/zinc/26/08/81/293260881.db2.gz DQADNHMURGRZIE-AUUYWEPGSA-N 1 3 330.451 2.941 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@H](c1ccc(F)cc1)N(C)C ZINC000422705955 293261613 /nfs/dbraw/zinc/26/16/13/293261613.db2.gz DEXUYFNRCMCGPG-ORAYPTAESA-N 1 3 330.451 2.941 10 0 EFAEHO COc1cc(CN2CC[C@H](C3CC[NH+](C)CC3)C2)cc2c1OCCO2 ZINC000290588702 294127931 /nfs/dbraw/zinc/12/79/31/294127931.db2.gz VCVBXPMMDXRTIL-KRWDZBQOSA-N 1 3 346.471 2.630 10 0 EFAEHO C[C@H](Cc1ccc(O)cc1)NCc1ccncc1OCCC[NH+](C)C ZINC000293782947 295049030 /nfs/dbraw/zinc/04/90/30/295049030.db2.gz BXLNMDAKWZZVRD-MRXNPFEDSA-N 1 3 343.471 2.839 10 0 EFAEHO Cc1nocc1C[NH2+]CCCCN1CCN(c2cccc(C)c2)CC1 ZINC000294204021 295127529 /nfs/dbraw/zinc/12/75/29/295127529.db2.gz RNUAIFAFMBOOAK-UHFFFAOYSA-N 1 3 342.487 2.983 10 0 EFAEHO CC[C@@H](NC1CC[NH+](CCc2ccccc2)CC1)[C@@H](O)C(F)F ZINC000294935868 295247951 /nfs/dbraw/zinc/24/79/51/295247951.db2.gz BXBJEPYSXCZMEV-IAGOWNOFSA-N 1 3 326.431 2.688 10 0 EFAEHO [NH3+]C[C@H]1CCCC[C@@H]1NCc1cccc(COC2CCOCC2)c1 ZINC000422716562 295267463 /nfs/dbraw/zinc/26/74/63/295267463.db2.gz UJSROLHXZHMGIA-QUCCMNQESA-N 1 3 332.488 2.989 10 0 EFAEHO FC(F)C(F)(F)COCCN[C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000423072986 303122198 /nfs/dbraw/zinc/12/21/98/303122198.db2.gz HZWLMIPGKIZITR-YNEHKIRRSA-N 1 3 326.378 2.804 10 0 EFAEHO Fc1ccc2c(c1)C[C@H]([NH2+]C1CCN(c3ccncc3)CC1)CO2 ZINC000297540353 310906305 /nfs/dbraw/zinc/90/63/05/310906305.db2.gz YMHJYUGJNYZCTO-KRWDZBQOSA-N 1 3 327.403 2.783 10 0 EFAEHO CC(C)N1CC[C@@H](C[NH2+]C[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 ZINC000304975747 311214361 /nfs/dbraw/zinc/21/43/61/311214361.db2.gz ZJWYLWMHIHMEJZ-IRXDYDNUSA-N 1 3 339.524 2.953 10 0 EFAEHO C[C@H](C[NH2+][C@@H](C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)CN(C)C ZINC000309699283 311228616 /nfs/dbraw/zinc/22/86/16/311228616.db2.gz FMYRVBDOMQSEHC-PMPSAXMXSA-N 1 3 327.513 2.809 10 0 EFAEHO C[C@H]([NH2+]CCCN1CCCC1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000400730091 311970621 /nfs/dbraw/zinc/97/06/21/311970621.db2.gz QJWMMZDDSHNBFQ-HOTGVXAUSA-N 1 3 325.497 2.707 10 0 EFAEHO CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H]([NH2+]C[C@H]3CCCNC3)C[C@@H]2C1 ZINC000401133778 311971408 /nfs/dbraw/zinc/97/14/08/311971408.db2.gz USCPQNNODUTRMM-NXOAAHMSSA-N 1 3 337.508 2.611 10 0 EFAEHO CCOC(=O)COc1ccc(CNCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000414804497 312053470 /nfs/dbraw/zinc/05/34/70/312053470.db2.gz FJUTVKVSLNNWFW-HNNXBMFYSA-N 1 3 342.439 2.938 10 0 EFAEHO C[C@@H]1CC[NH2+]C[C@@H]1NC1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000414922347 312063408 /nfs/dbraw/zinc/06/34/08/312063408.db2.gz FZBHDRIOOLISBF-DYVFJYSZSA-N 1 3 335.879 2.532 10 0 EFAEHO C[C@H]1CNCC[C@H]1[NH2+]Cc1ccc(-n2ccc(C(F)(F)F)n2)cc1 ZINC000414938273 312066824 /nfs/dbraw/zinc/06/68/24/312066824.db2.gz IGHBSIABNIRBBO-SWLSCSKDSA-N 1 3 338.377 2.979 10 0 EFAEHO C[C@@H]1CNCC[C@H]1[NH2+]Cc1ccc(-n2ccc(C(F)(F)F)n2)cc1 ZINC000414938272 312067039 /nfs/dbraw/zinc/06/70/39/312067039.db2.gz IGHBSIABNIRBBO-IUODEOHRSA-N 1 3 338.377 2.979 10 0 EFAEHO C[C@H](CCCCN1C(=O)c2ccccc2C1=O)N[C@@H]1CCCC[NH2+]C1 ZINC000415079225 312089117 /nfs/dbraw/zinc/08/91/17/312089117.db2.gz WPKQXKJOLRBOKJ-HZPDHXFCSA-N 1 3 343.471 2.573 10 0 EFAEHO O=C1N[C@@H]2CN(CCCC3CCCCC3)CC[C@@H]2N1C1CC[NH2+]CC1 ZINC000415134380 312100575 /nfs/dbraw/zinc/10/05/75/312100575.db2.gz DRCMZWASVWZWCS-MOPGFXCFSA-N 1 3 348.535 2.567 10 0 EFAEHO C[NH2+]Cc1cccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c1 ZINC000415958095 312185506 /nfs/dbraw/zinc/18/55/06/312185506.db2.gz KTYWMOXSOLHCQU-RBUKOAKNSA-N 1 3 338.455 2.973 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)C[C@@H]1C ZINC000415961068 312185995 /nfs/dbraw/zinc/18/59/95/312185995.db2.gz QNXOHPVGRREZSC-DZGCQCFKSA-N 1 3 348.466 2.808 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)C[C@@H]1C ZINC000415961068 312185997 /nfs/dbraw/zinc/18/59/97/312185997.db2.gz QNXOHPVGRREZSC-DZGCQCFKSA-N 1 3 348.466 2.808 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)[C@@H](C)C1 ZINC000415963887 312186559 /nfs/dbraw/zinc/18/65/59/312186559.db2.gz WKQVQIUGDIIXEJ-SUMWQHHRSA-N 1 3 348.466 2.665 10 0 EFAEHO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc3c(c2F)CCNC3)[C@@H](C)C1 ZINC000415963887 312186560 /nfs/dbraw/zinc/18/65/60/312186560.db2.gz WKQVQIUGDIIXEJ-SUMWQHHRSA-N 1 3 348.466 2.665 10 0 EFAEHO CN(C(=O)Nc1ccc(C[NH3+])cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000415983375 312190182 /nfs/dbraw/zinc/19/01/82/312190182.db2.gz ZJOCJRAYRFKCPJ-IBGZPJMESA-N 1 3 338.455 2.884 10 0 EFAEHO C[C@H]1CCC[C@H](C)N1CCNC(=O)N(CCC[NH3+])Cc1ccccc1 ZINC000417530106 312235188 /nfs/dbraw/zinc/23/51/88/312235188.db2.gz HKZGSXHIBFKINB-ROUUACIJSA-N 1 3 346.519 2.810 10 0 EFAEHO CC1(C)CCCN[C@H]1C(=O)Nc1cc(C[NH3+])cc(C(F)(F)F)c1 ZINC000417837752 312278860 /nfs/dbraw/zinc/27/88/60/312278860.db2.gz XUPZOYOCEZUHMG-ZDUSSCGKSA-N 1 3 329.366 2.881 10 0 EFAEHO C[C@@H](CCCC[NH3+])NC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000418035664 312313824 /nfs/dbraw/zinc/31/38/24/312313824.db2.gz AVXPBOOMQZQRNY-FXAWDEMLSA-N 1 3 346.519 2.858 10 0 EFAEHO CC[C@H](NC[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1cccc(OC)c1 ZINC000423378388 312417716 /nfs/dbraw/zinc/41/77/16/312417716.db2.gz FUVLWGUOFBKQDY-JKSUJKDBSA-N 1 3 345.409 2.572 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H]2CC[C@@H](C)O2)CC1 ZINC000453638104 312923130 /nfs/dbraw/zinc/92/31/30/312923130.db2.gz ZEGFQBIYGZNOOA-MJGOQNOKSA-N 1 3 331.504 2.876 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@H]2CCOC[C@@H]2C)CC1 ZINC000512884630 315528723 /nfs/dbraw/zinc/52/87/23/315528723.db2.gz GJHRPQLBXOZBBM-RBUKOAKNSA-N 1 3 345.531 2.981 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2CC[C@H](O)CC2)CC1 ZINC000513521603 315533806 /nfs/dbraw/zinc/53/38/06/315533806.db2.gz YWKMLOVDWUGASO-WGSAOQKQSA-N 1 3 331.504 2.612 10 0 EFAEHO COc1ccc([C@@H](C)NCc2ccc(C[NH3+])cc2)cc1NC(C)=O ZINC000515301020 315606321 /nfs/dbraw/zinc/60/63/21/315606321.db2.gz DWBOPKOEINDYDB-CYBMUJFWSA-N 1 3 327.428 2.963 10 0 EFAEHO C[C@@H](CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)[NH+]1CCCC1 ZINC000524188935 316149901 /nfs/dbraw/zinc/14/99/01/316149901.db2.gz OERJUPQWNCHNSQ-FUHWJXTLSA-N 1 3 347.478 2.638 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[N@H+](C)C1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000524300303 316153155 /nfs/dbraw/zinc/15/31/55/316153155.db2.gz JXKXIMQLOAMFOS-QRQLOZEOSA-N 1 3 329.488 2.622 10 0 EFAEHO CCN(C(=O)[C@@H]1CC[N@@H+](C)C1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000524300303 316153157 /nfs/dbraw/zinc/15/31/57/316153157.db2.gz JXKXIMQLOAMFOS-QRQLOZEOSA-N 1 3 329.488 2.622 10 0 EFAEHO Cc1ccc(C)c(OCCN2CCC(CO[C@H]3CC[NH2+]C3)CC2)c1 ZINC000530238956 317088998 /nfs/dbraw/zinc/08/89/98/317088998.db2.gz QVINEDSHLBLLQC-IBGZPJMESA-N 1 3 332.488 2.773 10 0 EFAEHO COc1cc(C)c(CN2CCC(CO[C@H]3CC[NH2+]C3)CC2)cc1OC ZINC000530249059 317091345 /nfs/dbraw/zinc/09/13/45/317091345.db2.gz TVBRCWVRZOYJQE-SFHVURJKSA-N 1 3 348.487 2.603 10 0 EFAEHO C[C@@H](C(=O)N(C)CCC[NH+](C)C)N1CCC(Cc2ccccc2)CC1 ZINC000540516208 317746110 /nfs/dbraw/zinc/74/61/10/317746110.db2.gz SAKJKNPKNYGBQF-SFHVURJKSA-N 1 3 345.531 2.740 10 0 EFAEHO Cc1cc(CN(C)C)cc(NC(=O)CCN(C)c2cc[nH+]cc2)c1 ZINC000542785961 317826346 /nfs/dbraw/zinc/82/63/46/317826346.db2.gz MONPNIMBOSWKSY-UHFFFAOYSA-N 1 3 326.444 2.917 10 0 EFAEHO C[C@@H](NC(=O)CCN(C)c1cc[nH+]cc1)[C@H](c1ccccc1)N(C)C ZINC000548104539 318073659 /nfs/dbraw/zinc/07/36/59/318073659.db2.gz UXOJOHRQCVHZJW-OXQOHEQNSA-N 1 3 340.471 2.716 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccc(OCC(F)(F)F)nc2)[C@H]2CCC[C@@H]21 ZINC000552033332 318239002 /nfs/dbraw/zinc/23/90/02/318239002.db2.gz ZBVFBDSLLWOBQV-ILXRZTDVSA-N 1 3 343.393 2.985 10 0 EFAEHO CC[NH+]1CCC(NC(=O)CN[C@@H](c2ccc(Cl)cc2)C2CC2)CC1 ZINC000552836709 318264334 /nfs/dbraw/zinc/26/43/34/318264334.db2.gz PVXWWUPBKHAXTH-LJQANCHMSA-N 1 3 349.906 2.981 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)C1 ZINC000554597279 318327742 /nfs/dbraw/zinc/32/77/42/318327742.db2.gz GLGOMAZTZZWCLB-SFHVURJKSA-N 1 3 343.515 2.877 10 0 EFAEHO Cc1ccccc1[C@@H]([C@H](C)NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1)N(C)C ZINC000555098154 318345599 /nfs/dbraw/zinc/34/55/99/318345599.db2.gz BKWOAQAPPJENDC-LSTDLKDCSA-N 1 3 331.504 2.833 10 0 EFAEHO Cc1ccccc1[C@@H]([C@H](C)NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1)N(C)C ZINC000555098154 318345601 /nfs/dbraw/zinc/34/56/01/318345601.db2.gz BKWOAQAPPJENDC-LSTDLKDCSA-N 1 3 331.504 2.833 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)c2ccccc2CC[NH3+])N(C)C)cc1 ZINC000565151316 318937734 /nfs/dbraw/zinc/93/77/34/318937734.db2.gz KXZVGXWMBGZWBD-IBGZPJMESA-N 1 3 325.456 2.529 10 0 EFAEHO CCN(C(=O)[C@H](C)[NH2+]C1CC1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000567046570 319133642 /nfs/dbraw/zinc/13/36/42/319133642.db2.gz HXYTYXWURFWRCV-FCEWJHQRSA-N 1 3 329.488 2.811 10 0 EFAEHO C[C@]1(C[NH3+])CCN(C(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000567146984 319142776 /nfs/dbraw/zinc/14/27/76/319142776.db2.gz FQUQVRGNIYNYBF-HXUWFJFHSA-N 1 3 344.503 2.553 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)N2CCC[C@]3(CC[NH2+]C3)C2)cc1 ZINC000567597193 319186682 /nfs/dbraw/zinc/18/66/82/319186682.db2.gz YDQLYOYEFHQSIC-UYAOXDASSA-N 1 3 344.503 2.595 10 0 EFAEHO CC(C)(C)CC(C)(C)N1CCC([NH2+][C@H]2CCc3nnnn3CC2)CC1 ZINC000567604212 319187526 /nfs/dbraw/zinc/18/75/26/319187526.db2.gz YFBMQAVOWAEXBJ-HNNXBMFYSA-N 1 3 348.539 2.647 10 0 EFAEHO CC(C)(C)CC(C)(C)[NH+]1CCC(N[C@H]2CCc3nnnn3CC2)CC1 ZINC000567604212 319187529 /nfs/dbraw/zinc/18/75/29/319187529.db2.gz YFBMQAVOWAEXBJ-HNNXBMFYSA-N 1 3 348.539 2.647 10 0 EFAEHO CC[N@H+](Cc1ccc(C(=O)N[C@H]2CNCCC2(F)F)cc1)C(C)C ZINC000567845185 319216951 /nfs/dbraw/zinc/21/69/51/319216951.db2.gz NMCZFZIOFPUSBL-INIZCTEOSA-N 1 3 339.430 2.644 10 0 EFAEHO CC[N@@H+](Cc1ccc(C(=O)N[C@H]2CNCCC2(F)F)cc1)C(C)C ZINC000567845185 319216953 /nfs/dbraw/zinc/21/69/53/319216953.db2.gz NMCZFZIOFPUSBL-INIZCTEOSA-N 1 3 339.430 2.644 10 0 EFAEHO COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+][C@@H]1CCCCNC1 ZINC000568486465 319288300 /nfs/dbraw/zinc/28/83/00/319288300.db2.gz AAVXAVJVWYLWSB-GXTWGEPZSA-N 1 3 339.867 2.797 10 0 EFAEHO Cc1cc(NC(=O)CCN(C)c2ccncc2)ccc1C[NH+](C)C ZINC000569204027 319357718 /nfs/dbraw/zinc/35/77/18/319357718.db2.gz YKHWRTSRCZTRHM-UHFFFAOYSA-N 1 3 326.444 2.917 10 0 EFAEHO CC(C)OC[C@H](O)CNCc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000569449078 319381142 /nfs/dbraw/zinc/38/11/42/319381142.db2.gz IHWPWIBGGQCXTO-FXAWDEMLSA-N 1 3 334.504 2.794 10 0 EFAEHO CC(C)OC[C@H](O)CNCc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000569449078 319381144 /nfs/dbraw/zinc/38/11/44/319381144.db2.gz IHWPWIBGGQCXTO-FXAWDEMLSA-N 1 3 334.504 2.794 10 0 EFAEHO c1ncn(-c2cccc(CN[C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)c2)n1 ZINC000569802130 319415876 /nfs/dbraw/zinc/41/58/76/319415876.db2.gz CHUSDMRJDJWFNC-CEXWTWQISA-N 1 3 325.460 2.668 10 0 EFAEHO [NH3+][C@@H]1CCC[C@@H](NC[C@H](CO)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000576886924 320058108 /nfs/dbraw/zinc/05/81/08/320058108.db2.gz BWWJXGDLZNXAHB-FVQBIDKESA-N 1 3 330.394 2.716 10 0 EFAEHO N[C@@H]1CCC[C@@H]([NH2+]C[C@H](CO)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000576886924 320058110 /nfs/dbraw/zinc/05/81/10/320058110.db2.gz BWWJXGDLZNXAHB-FVQBIDKESA-N 1 3 330.394 2.716 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N[C@@H]3CC34CCCC4)CC2)CC1 ZINC000577384711 320106000 /nfs/dbraw/zinc/10/60/00/320106000.db2.gz HKCYMGSCWVEEBV-GOSISDBHSA-N 1 3 333.520 2.632 10 0 EFAEHO CC(C)OC[C@@H](O)CNCc1ccccc1C[NH+]1CCC(C)CC1 ZINC000577484931 320115443 /nfs/dbraw/zinc/11/54/43/320115443.db2.gz NUMRYHDQYZCFQA-FQEVSTJZSA-N 1 3 334.504 2.794 10 0 EFAEHO CC[N@H+](CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1)CC(C)C ZINC000577624941 320128953 /nfs/dbraw/zinc/12/89/53/320128953.db2.gz ZDGHCWHSPBIXMI-SFHVURJKSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[N@@H+](CCC1CCN(C(=O)CN2CC[C@H](C)C2)CC1)CC(C)C ZINC000577624941 320128955 /nfs/dbraw/zinc/12/89/55/320128955.db2.gz ZDGHCWHSPBIXMI-SFHVURJKSA-N 1 3 337.552 2.935 10 0 EFAEHO C[C@@H]1C[C@H](C(C)(C)C)CCN1CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000577882954 320154102 /nfs/dbraw/zinc/15/41/02/320154102.db2.gz UZOPWFWJSQFYBQ-HZPDHXFCSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@H]1C[C@H](C(C)(C)C)CCN1CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000577882955 320154242 /nfs/dbraw/zinc/15/42/42/320154242.db2.gz UZOPWFWJSQFYBQ-JKSUJKDBSA-N 1 3 335.536 2.876 10 0 EFAEHO C[C@@H]1C[C@@H](C(C)(C)C)CCN1CC(=O)NC1CC[NH+](C2CC2)CC1 ZINC000577882952 320154247 /nfs/dbraw/zinc/15/42/47/320154247.db2.gz UZOPWFWJSQFYBQ-CVEARBPZSA-N 1 3 335.536 2.876 10 0 EFAEHO CCNC(=O)[C@@H](N[C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000577952173 320159528 /nfs/dbraw/zinc/15/95/28/320159528.db2.gz WEDYUJQREFBEPC-MOPGFXCFSA-N 1 3 343.515 2.934 10 0 EFAEHO CCNC(=O)[C@@H](N[C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000577952173 320159531 /nfs/dbraw/zinc/15/95/31/320159531.db2.gz WEDYUJQREFBEPC-MOPGFXCFSA-N 1 3 343.515 2.934 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3CCCCC[C@H]3C)CC2)CC1 ZINC000578246497 320188753 /nfs/dbraw/zinc/18/87/53/320188753.db2.gz SXAPSYVYOJTXPT-QGZVFWFLSA-N 1 3 335.536 2.974 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]CC2(N3CCCCC3)CCN(C)CC2)C1(C)C ZINC000181827338 323252007 /nfs/dbraw/zinc/25/20/07/323252007.db2.gz QATJHBXVSUOPJX-ZWKOTPCHSA-N 1 3 337.552 2.730 10 0 EFAEHO CC(C)C[C@H](CN(C)C)NC(=O)NCC[C@@H](C)[NH+]1CCCCC1 ZINC000184866065 323376519 /nfs/dbraw/zinc/37/65/19/323376519.db2.gz VLOSIBXCTGQNGI-IAGOWNOFSA-N 1 3 326.529 2.526 10 0 EFAEHO Cc1ccccc1CN1CCC(NC(=O)N(C)CCC[NH+](C)C)CC1 ZINC000185318192 323388807 /nfs/dbraw/zinc/38/88/07/323388807.db2.gz MIHTXSKSFBGGFL-UHFFFAOYSA-N 1 3 346.519 2.553 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H](CO)C(C)C)CC1 ZINC000579282540 323924068 /nfs/dbraw/zinc/92/40/68/323924068.db2.gz NHXMLQDQBGYXAO-IBGZPJMESA-N 1 3 333.520 2.573 10 0 EFAEHO C[C@H]1[C@@H]([NH3+])CCN1C(=O)Nc1ccc(OCCN2CCCCC2)cc1 ZINC000580049854 324086744 /nfs/dbraw/zinc/08/67/44/324086744.db2.gz UNMYUXFICQTSON-YJBOKZPZSA-N 1 3 346.475 2.505 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@H](CNC(=O)Nc2ccc3c(c2F)CCNC3)C1 ZINC000580419008 324159215 /nfs/dbraw/zinc/15/92/15/324159215.db2.gz NMOFWSPYLFHFGU-CQSZACIVSA-N 1 3 348.466 2.571 10 0 EFAEHO CC(C)C[N@H+]1CC[C@H](CNC(=O)Nc2ccc3c(c2F)CCNC3)C1 ZINC000580419008 324159218 /nfs/dbraw/zinc/15/92/18/324159218.db2.gz NMOFWSPYLFHFGU-CQSZACIVSA-N 1 3 348.466 2.571 10 0 EFAEHO C[C@H](CCNC(=O)N1CCc2ccccc2[C@H]1CN)[NH+]1CCCCC1 ZINC000580713041 324219520 /nfs/dbraw/zinc/21/95/20/324219520.db2.gz PDRVZOCVDISCCD-VQIMIIECSA-N 1 3 344.503 2.519 10 0 EFAEHO CN(C(=O)NCC1([NH3+])CCCCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000580764091 324229834 /nfs/dbraw/zinc/22/98/34/324229834.db2.gz JFFJATQOMISDCQ-SFHVURJKSA-N 1 3 344.503 2.564 10 0 EFAEHO N[C@H](CNC(=O)c1ccccc1CC1CC[NH2+]CC1)c1ccccc1 ZINC000582290661 324561909 /nfs/dbraw/zinc/56/19/09/324561909.db2.gz QLBKBNIMVCSRAD-HXUWFJFHSA-N 1 3 337.467 2.659 10 0 EFAEHO CCN1CCCC[C@H]1CNC(=O)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000111883741 473234370 /nfs/dbraw/zinc/23/43/70/473234370.db2.gz XZWJYZNGPLZOLF-ROUUACIJSA-N 1 3 336.524 2.521 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)c1 ZINC000124591042 473270139 /nfs/dbraw/zinc/27/01/39/473270139.db2.gz JSMKAHVCKKGNNN-AEFFLSMTSA-N 1 3 330.476 2.696 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)c1 ZINC000124591042 473270144 /nfs/dbraw/zinc/27/01/44/473270144.db2.gz JSMKAHVCKKGNNN-AEFFLSMTSA-N 1 3 330.476 2.696 10 0 EFAEHO C[C@@H]1CC[C@@H](C[N@H+](C)CC2CCN(C[C@H](O)c3ccccc3)CC2)O1 ZINC000190524375 473305421 /nfs/dbraw/zinc/30/54/21/473305421.db2.gz PTZSFXYCCDTXQJ-QMMLZNLJSA-N 1 3 346.515 2.931 10 0 EFAEHO C[C@@H]1CC[C@@H](C[N@@H+](C)CC2CCN(C[C@H](O)c3ccccc3)CC2)O1 ZINC000190524375 473305426 /nfs/dbraw/zinc/30/54/26/473305426.db2.gz PTZSFXYCCDTXQJ-QMMLZNLJSA-N 1 3 346.515 2.931 10 0 EFAEHO C[C@@H]1CC[C@H](C[N@H+](C)CC2CCN(C[C@H](O)c3ccccc3)CC2)O1 ZINC000190524339 473305746 /nfs/dbraw/zinc/30/57/46/473305746.db2.gz PTZSFXYCCDTXQJ-UIFIKXQLSA-N 1 3 346.515 2.931 10 0 EFAEHO C[C@@H]1CC[C@H](C[N@@H+](C)CC2CCN(C[C@H](O)c3ccccc3)CC2)O1 ZINC000190524339 473305751 /nfs/dbraw/zinc/30/57/51/473305751.db2.gz PTZSFXYCCDTXQJ-UIFIKXQLSA-N 1 3 346.515 2.931 10 0 EFAEHO CCC[C@@H](C(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)N(C)C ZINC000162357239 473330695 /nfs/dbraw/zinc/33/06/95/473330695.db2.gz MKEJONLLNMIKRN-MOPGFXCFSA-N 1 3 331.504 2.697 10 0 EFAEHO CCC[C@@H](C(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)N(C)C ZINC000162357239 473330699 /nfs/dbraw/zinc/33/06/99/473330699.db2.gz MKEJONLLNMIKRN-MOPGFXCFSA-N 1 3 331.504 2.697 10 0 EFAEHO CCC[C@H](C(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)N(C)C ZINC000162357114 473331126 /nfs/dbraw/zinc/33/11/26/473331126.db2.gz MKEJONLLNMIKRN-RBUKOAKNSA-N 1 3 331.504 2.697 10 0 EFAEHO CCC[C@H](C(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)N(C)C ZINC000162357114 473331129 /nfs/dbraw/zinc/33/11/29/473331129.db2.gz MKEJONLLNMIKRN-RBUKOAKNSA-N 1 3 331.504 2.697 10 0 EFAEHO CCN1CCC[C@@H]1CN(C)C(=O)NCCC[N@H+](C)C1CCCCC1 ZINC000177331346 473357000 /nfs/dbraw/zinc/35/70/00/473357000.db2.gz YVOWFEQDXIAFDT-GOSISDBHSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN1CCC[C@@H]1CN(C)C(=O)NCCC[N@@H+](C)C1CCCCC1 ZINC000177331346 473357007 /nfs/dbraw/zinc/35/70/07/473357007.db2.gz YVOWFEQDXIAFDT-GOSISDBHSA-N 1 3 338.540 2.767 10 0 EFAEHO C[C@@H]1C[N@H+](C[C@@H]2CCCO2)CC[C@@H]1NCc1cccc2c[nH]nc21 ZINC000084041048 473384938 /nfs/dbraw/zinc/38/49/38/473384938.db2.gz XUZTXJJJPVTKBR-JLSDUUJJSA-N 1 3 328.460 2.542 10 0 EFAEHO C[C@@H]1C[N@@H+](C[C@@H]2CCCO2)CC[C@@H]1NCc1cccc2c[nH]nc21 ZINC000084041048 473384943 /nfs/dbraw/zinc/38/49/43/473384943.db2.gz XUZTXJJJPVTKBR-JLSDUUJJSA-N 1 3 328.460 2.542 10 0 EFAEHO C[C@H]1CN(CCCC[NH2+]Cc2ccc(C(F)F)nc2)C[C@H](C)O1 ZINC000631074970 479879156 /nfs/dbraw/zinc/87/91/56/479879156.db2.gz LOGOAATZOSFRFH-KBPBESRZSA-N 1 3 327.419 2.998 10 0 EFAEHO Cc1scc(CNCc2ccc(C(=O)NCC[NH+](C)C)cc2)c1C ZINC000631075417 479879270 /nfs/dbraw/zinc/87/92/70/479879270.db2.gz CWHGWJAVFQHKDW-UHFFFAOYSA-N 1 3 345.512 2.946 10 0 EFAEHO N[C@H]1CCC[C@@H]1[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccncc1 ZINC000422833905 476801326 /nfs/dbraw/zinc/80/13/26/476801326.db2.gz HDNADZDETUKFIA-OALUTQOASA-N 1 3 333.439 2.904 10 0 EFAEHO C[NH+](C)CCOCCN[C@H]1CCc2c1ccc(F)c2Br ZINC000453214884 477191226 /nfs/dbraw/zinc/19/12/26/477191226.db2.gz IMTMRLNJMWDRLX-AWEZNQCLSA-N 1 3 345.256 2.743 10 0 EFAEHO CC[NH+](CC)[C@@H](C)CNC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000067705085 472076158 /nfs/dbraw/zinc/07/61/58/472076158.db2.gz CWVPJNFTOYUDMP-WMZOPIPTSA-N 1 3 334.508 2.627 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000054719589 472110990 /nfs/dbraw/zinc/11/09/90/472110990.db2.gz CIYDSSDIGPCPQW-AOIWGVFYSA-N 1 3 346.519 2.851 10 0 EFAEHO CC(C)[C@H](NCC(=O)NC1CC[NH+](C2CC2)CC1)c1ccccc1 ZINC000042509835 472141789 /nfs/dbraw/zinc/14/17/89/472141789.db2.gz IQLHDMKNWSGQFJ-FQEVSTJZSA-N 1 3 329.488 2.716 10 0 EFAEHO C[C@@H]1C[C@@H](NCc2ccccc2N(C)C2CC[NH+](C)CC2)[C@H](C)O1 ZINC000631223308 479969429 /nfs/dbraw/zinc/96/94/29/479969429.db2.gz SYGQYVXUXDKUBP-JTDSTZFVSA-N 1 3 331.504 2.873 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H](C)N(C)C2CC2)CC1 ZINC000088715044 472380854 /nfs/dbraw/zinc/38/08/54/472380854.db2.gz TWQQPMCWMTZESM-GOSISDBHSA-N 1 3 344.547 2.791 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]CCOCC2CC2)CC1 ZINC000088717497 472381172 /nfs/dbraw/zinc/38/11/72/472381172.db2.gz NDIXKJVYQVAMKD-UHFFFAOYSA-N 1 3 331.504 2.735 10 0 EFAEHO C[C@@H]1CC(CC[NH+]2CCC(C(=O)NCCN(C)C)CC2)C[C@@H](C)C1 ZINC000089123316 472388858 /nfs/dbraw/zinc/38/88/58/472388858.db2.gz KTSPIWQFTVWFBF-IRXDYDNUSA-N 1 3 337.552 2.839 10 0 EFAEHO C[NH+](C)CCCCNCc1cc2c(cc1Br)OCO2 ZINC000045598303 472430745 /nfs/dbraw/zinc/43/07/45/472430745.db2.gz BMCSCTWRNZFEPE-UHFFFAOYSA-N 1 3 329.238 2.609 10 0 EFAEHO COCC[N@@H+]1CC[C@H](CNCc2ccc(Cl)c3cccnc23)C1 ZINC000089414135 472432393 /nfs/dbraw/zinc/43/23/93/472432393.db2.gz DIMCJTQGDSFOID-CQSZACIVSA-N 1 3 333.863 2.946 10 0 EFAEHO COCC[N@H+]1CC[C@H](CNCc2ccc(Cl)c3cccnc23)C1 ZINC000089414135 472432398 /nfs/dbraw/zinc/43/23/98/472432398.db2.gz DIMCJTQGDSFOID-CQSZACIVSA-N 1 3 333.863 2.946 10 0 EFAEHO CC(C)N1CCC([NH2+][C@H]2CC(=O)N(C)[C@H]2c2ccc(F)cc2)CC1 ZINC000097082169 472436010 /nfs/dbraw/zinc/43/60/10/472436010.db2.gz MLTWGLGTTWCIOK-HKUYNNGSSA-N 1 3 333.451 2.560 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)N[C@H]2CCCN(C)C2)[NH+]2CCCC2)cc1 ZINC000622452044 479990512 /nfs/dbraw/zinc/99/05/12/479990512.db2.gz AGNVOXMPRGCKST-OALUTQOASA-N 1 3 344.503 2.525 10 0 EFAEHO COCCCC[N@H+](C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000117880208 472483079 /nfs/dbraw/zinc/48/30/79/472483079.db2.gz MOGORBVOHVKEFR-HXUWFJFHSA-N 1 3 334.504 2.790 10 0 EFAEHO COCCCC[N@@H+](C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000117880208 472483084 /nfs/dbraw/zinc/48/30/84/472483084.db2.gz MOGORBVOHVKEFR-HXUWFJFHSA-N 1 3 334.504 2.790 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)N[C@@H]2CCCN(C)C2)[NH+]2CCCC2)cc1 ZINC000622452045 479991337 /nfs/dbraw/zinc/99/13/37/479991337.db2.gz AGNVOXMPRGCKST-RTBURBONSA-N 1 3 344.503 2.525 10 0 EFAEHO C[C@@H](CNC(=O)NC1CCC(C[NH+](C)C)CC1)N1CCC[C@@H](C)C1 ZINC000119723758 472578492 /nfs/dbraw/zinc/57/84/92/472578492.db2.gz UHAHAGQZKZRYJN-VEZWFGLTSA-N 1 3 338.540 2.526 10 0 EFAEHO C[N@@H+]1CCC[C@H]2CN(C(=O)c3cccc(CN4CCCC4)c3)CC[C@@H]21 ZINC000155825342 472623041 /nfs/dbraw/zinc/62/30/41/472623041.db2.gz LQKJRXYTXRBPOG-PMACEKPBSA-N 1 3 341.499 2.839 10 0 EFAEHO C[N@H+]1CCC[C@H]2CN(C(=O)c3cccc(CN4CCCC4)c3)CC[C@@H]21 ZINC000155825342 472623046 /nfs/dbraw/zinc/62/30/46/472623046.db2.gz LQKJRXYTXRBPOG-PMACEKPBSA-N 1 3 341.499 2.839 10 0 EFAEHO CC(C)[C@@H](NCc1ccnc(OCC[NH+](C)C)c1)c1cccnc1 ZINC000091408656 472763488 /nfs/dbraw/zinc/76/34/88/472763488.db2.gz QXJONGPMOKWDCU-LJQANCHMSA-N 1 3 328.460 2.904 10 0 EFAEHO Cc1cccc(OC[C@@H](O)CN2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000047972289 472790321 /nfs/dbraw/zinc/79/03/21/472790321.db2.gz KROZJARTZZGRGS-IBGZPJMESA-N 1 3 332.488 2.543 10 0 EFAEHO Cc1cccc(C)c1OC[C@@H](O)CN1CCC(C[NH+]2CCCC2)CC1 ZINC000047972301 472790666 /nfs/dbraw/zinc/79/06/66/472790666.db2.gz UKDASSOQCYQWQR-FQEVSTJZSA-N 1 3 346.515 2.851 10 0 EFAEHO CC[NH+]1CCC(CCNC(=O)NCC(C)(C)N2CCCCC2)CC1 ZINC000073488885 472817986 /nfs/dbraw/zinc/81/79/86/472817986.db2.gz ZZTWBIUYKRNYFP-UHFFFAOYSA-N 1 3 338.540 2.672 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)N[C@H]2CCCN(C)C2)[NH+]2CCCC2)cc1 ZINC000064236984 472837309 /nfs/dbraw/zinc/83/73/09/472837309.db2.gz AGNVOXMPRGCKST-RBUKOAKNSA-N 1 3 344.503 2.525 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000079393841 472856184 /nfs/dbraw/zinc/85/61/84/472856184.db2.gz BKEGQWQDPVUUNW-MSOLQXFVSA-N 1 3 340.556 2.774 10 0 EFAEHO CC(C)C[C@@H](CN(C)C)NC(=O)NCCCC[N@H+]1CCC[C@@H](C)C1 ZINC000079393841 472856191 /nfs/dbraw/zinc/85/61/91/472856191.db2.gz BKEGQWQDPVUUNW-MSOLQXFVSA-N 1 3 340.556 2.774 10 0 EFAEHO C[C@@H]1CC[N@H+](CC(=O)NC2CCN(C3CC3)CC2)[C@H]2CCCC[C@H]12 ZINC000064508635 472860192 /nfs/dbraw/zinc/86/01/92/472860192.db2.gz BEJXZWMXJPATNA-LZQZEXGQSA-N 1 3 333.520 2.630 10 0 EFAEHO C[C@@H]1CC[N@@H+](CC(=O)NC2CCN(C3CC3)CC2)[C@H]2CCCC[C@H]12 ZINC000064508635 472860196 /nfs/dbraw/zinc/86/01/96/472860196.db2.gz BEJXZWMXJPATNA-LZQZEXGQSA-N 1 3 333.520 2.630 10 0 EFAEHO CN(CCC1CCN(c2cc[nH+]cc2)CC1)C[C@@H](O)C(F)(F)F ZINC000121891606 472937244 /nfs/dbraw/zinc/93/72/44/472937244.db2.gz RQUGOXLKUSBWPH-OAHLLOKOSA-N 1 3 331.382 2.543 10 0 EFAEHO CCC[C@H](C(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1)N(C)C ZINC000092693126 472965266 /nfs/dbraw/zinc/96/52/66/472965266.db2.gz BGTHHVILOICENE-LJQANCHMSA-N 1 3 346.519 2.877 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)N(C)C ZINC000620191719 480020869 /nfs/dbraw/zinc/02/08/69/480020869.db2.gz BYCSDRQRQBFHAP-OALUTQOASA-N 1 3 343.515 2.745 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)N(C)C ZINC000620191719 480020872 /nfs/dbraw/zinc/02/08/72/480020872.db2.gz BYCSDRQRQBFHAP-OALUTQOASA-N 1 3 343.515 2.745 10 0 EFAEHO CCN(CC)CC(=O)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000620192430 480022538 /nfs/dbraw/zinc/02/25/38/480022538.db2.gz MEIHVKRSCMFCBU-IBGZPJMESA-N 1 3 343.515 2.747 10 0 EFAEHO CCN(CC)CC(=O)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000620192430 480022544 /nfs/dbraw/zinc/02/25/44/480022544.db2.gz MEIHVKRSCMFCBU-IBGZPJMESA-N 1 3 343.515 2.747 10 0 EFAEHO CN1CCC[C@H](NC(=O)NCc2ccccc2C[NH+]2CCCCC2)C1 ZINC000052518958 473117203 /nfs/dbraw/zinc/11/72/03/473117203.db2.gz PPESLBOSECASNN-IBGZPJMESA-N 1 3 344.503 2.566 10 0 EFAEHO CCC[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2C)CC1)N(C)C ZINC000136497333 473160808 /nfs/dbraw/zinc/16/08/08/473160808.db2.gz AXVQPMOTTPOZKK-IBGZPJMESA-N 1 3 331.504 2.806 10 0 EFAEHO CCC[C@H](C(=O)NC1CC[NH+](Cc2ccccc2C)CC1)N(C)C ZINC000136497371 473160821 /nfs/dbraw/zinc/16/08/21/473160821.db2.gz AXVQPMOTTPOZKK-LJQANCHMSA-N 1 3 331.504 2.806 10 0 EFAEHO CC1(C(=O)N2CCN3CCC[C@@H]3C2)CC[NH+](Cc2ccccc2)CC1 ZINC000185312416 473392756 /nfs/dbraw/zinc/39/27/56/473392756.db2.gz BFUULOVMZJTGPX-LJQANCHMSA-N 1 3 341.499 2.595 10 0 EFAEHO CCN1CC[C@H](C[NH2+][C@@H](C)c2ccc(OCc3nccn3C)cc2)C1 ZINC000163242301 473427041 /nfs/dbraw/zinc/42/70/41/473427041.db2.gz LFWNDVSKEYQUPP-DLBZAZTESA-N 1 3 342.487 2.992 10 0 EFAEHO C[C@@H]1C[N@H+](C)CC[C@@H]1N(C)C(=O)c1cccc(CN2CCCC2)c1 ZINC000126152686 473493709 /nfs/dbraw/zinc/49/37/09/473493709.db2.gz DVQJVPFXQDXBAF-APWZRJJASA-N 1 3 329.488 2.695 10 0 EFAEHO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cccc(CN2CCCC2)c1 ZINC000126152686 473493712 /nfs/dbraw/zinc/49/37/12/473493712.db2.gz DVQJVPFXQDXBAF-APWZRJJASA-N 1 3 329.488 2.695 10 0 EFAEHO COC(=O)c1ccc(CN2CCC[C@H]2Cn2ccnc2C)cc1F ZINC000152010204 473516287 /nfs/dbraw/zinc/51/62/87/473516287.db2.gz YOBJNVDCGOBPPW-HNNXBMFYSA-N 1 3 331.391 2.782 10 0 EFAEHO CCN1CCN(CCC[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000166146101 473521836 /nfs/dbraw/zinc/52/18/36/473521836.db2.gz XVFYJZFXQREUTO-TZIWHRDSSA-N 1 3 345.531 2.772 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)C(C)(C)c3cccs3)CC2)CC1 ZINC000115351951 473559743 /nfs/dbraw/zinc/55/97/43/473559743.db2.gz QKFCNEMWIRDONZ-UHFFFAOYSA-N 1 3 349.544 2.701 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)C1 ZINC000172253476 473561247 /nfs/dbraw/zinc/56/12/47/473561247.db2.gz LTNCNBDHDAXZDY-WMZOPIPTSA-N 1 3 346.519 2.899 10 0 EFAEHO Fc1ccc(CN2CCN(CC3CC[NH2+]CC3)CC2)c(Cl)c1 ZINC000178978860 473604436 /nfs/dbraw/zinc/60/44/36/473604436.db2.gz FXGHMDZKQUTNQL-UHFFFAOYSA-N 1 3 325.859 2.596 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000127420178 473611269 /nfs/dbraw/zinc/61/12/69/473611269.db2.gz DCWBDBJIAJSINK-LJQANCHMSA-N 1 3 341.499 2.840 10 0 EFAEHO CCO[C@@H]1C[C@@H]([NH2+]Cc2cccc(CN(C)C)c2)C12CCOCC2 ZINC000186226249 473622190 /nfs/dbraw/zinc/62/21/90/473622190.db2.gz NPKXGJQFRSSFAF-RTBURBONSA-N 1 3 332.488 2.812 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)c2cccc(CN3CCCC3)c2)CC[N@@H+]1C ZINC000127705042 473643005 /nfs/dbraw/zinc/64/30/05/473643005.db2.gz OEENARYXSNRCAZ-APWZRJJASA-N 1 3 329.488 2.837 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C(=O)c2cccc(CN3CCCC3)c2)CC[N@H+]1C ZINC000127705042 473643012 /nfs/dbraw/zinc/64/30/12/473643012.db2.gz OEENARYXSNRCAZ-APWZRJJASA-N 1 3 329.488 2.837 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)c2cccc(CN3CCCC3)c2)CC[N@@H+]1C ZINC000127704575 473643245 /nfs/dbraw/zinc/64/32/45/473643245.db2.gz OEENARYXSNRCAZ-VQIMIIECSA-N 1 3 329.488 2.837 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)c2cccc(CN3CCCC3)c2)CC[N@H+]1C ZINC000127704575 473643250 /nfs/dbraw/zinc/64/32/50/473643250.db2.gz OEENARYXSNRCAZ-VQIMIIECSA-N 1 3 329.488 2.837 10 0 EFAEHO C[C@H]1C[C@H](NC(=O)N(C)CCC[NH+](C)C)CCN1Cc1ccccc1 ZINC000186406568 473670017 /nfs/dbraw/zinc/67/00/17/473670017.db2.gz HLPRVMSDSCZJJX-PKOBYXMFSA-N 1 3 346.519 2.633 10 0 EFAEHO CC(C)CN(CC[NH+](C)C)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000179470317 473689501 /nfs/dbraw/zinc/68/95/01/473689501.db2.gz OLZHTZRCWAIXAX-RTBURBONSA-N 1 3 346.519 2.661 10 0 EFAEHO CC(C)[NH+](CCNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)C(C)C ZINC000245611003 473726913 /nfs/dbraw/zinc/72/69/13/473726913.db2.gz BNIPALYSHWMSHB-OALUTQOASA-N 1 3 346.519 2.850 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1CNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000245616096 473727197 /nfs/dbraw/zinc/72/71/97/473727197.db2.gz CYDXNYIVWOHVQS-CEXWTWQISA-N 1 3 344.503 2.605 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1CNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000245616096 473727204 /nfs/dbraw/zinc/72/72/04/473727204.db2.gz CYDXNYIVWOHVQS-CEXWTWQISA-N 1 3 344.503 2.605 10 0 EFAEHO CCCNC(=O)CCN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245652498 473731487 /nfs/dbraw/zinc/73/14/87/473731487.db2.gz CUOLZGTYADEIKJ-LDLYASANSA-N 1 3 329.488 2.688 10 0 EFAEHO CCCNC(=O)CCN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245652498 473731493 /nfs/dbraw/zinc/73/14/93/473731493.db2.gz CUOLZGTYADEIKJ-LDLYASANSA-N 1 3 329.488 2.688 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C[C@@H](O)COCc2ccc(Cl)cc2)CC[N@@H+]1C ZINC000246725413 473943658 /nfs/dbraw/zinc/94/36/58/473943658.db2.gz LVOVZJWJNHVRLS-FHLIZLRMSA-N 1 3 340.895 2.632 10 0 EFAEHO C[C@@H]1C[C@@H](N(C)C[C@@H](O)COCc2ccc(Cl)cc2)CC[N@H+]1C ZINC000246725413 473943665 /nfs/dbraw/zinc/94/36/65/473943665.db2.gz LVOVZJWJNHVRLS-FHLIZLRMSA-N 1 3 340.895 2.632 10 0 EFAEHO Cc1cc(Cl)c(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1C ZINC000617506456 480250579 /nfs/dbraw/zinc/25/05/79/480250579.db2.gz OCBLJDCMCCYJGS-HNNXBMFYSA-N 1 3 339.911 2.959 10 0 EFAEHO Cc1cc(Cl)c(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1C ZINC000617506456 480250585 /nfs/dbraw/zinc/25/05/85/480250585.db2.gz OCBLJDCMCCYJGS-HNNXBMFYSA-N 1 3 339.911 2.959 10 0 EFAEHO Cc1oncc1CN(C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000181689897 474057456 /nfs/dbraw/zinc/05/74/56/474057456.db2.gz YEKJFWPLJDIDFC-FQEVSTJZSA-N 1 3 343.471 2.860 10 0 EFAEHO C[C@H](N[C@H]1c2ccccc2C[C@H]1O)c1ccc(OCC[NH+](C)C)cc1 ZINC000247103865 474064450 /nfs/dbraw/zinc/06/44/50/474064450.db2.gz OTFDADHUXONBMY-RVHYNSKXSA-N 1 3 340.467 2.936 10 0 EFAEHO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)N2CC[C@H](N3CC=CC3)C2)C1 ZINC000174838632 474104640 /nfs/dbraw/zinc/10/46/40/474104640.db2.gz CLKBQKJDVOFOOX-ROUUACIJSA-N 1 3 348.535 2.543 10 0 EFAEHO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CC[C@H](N3CC=CC3)C2)C1 ZINC000174838632 474104645 /nfs/dbraw/zinc/10/46/45/474104645.db2.gz CLKBQKJDVOFOOX-ROUUACIJSA-N 1 3 348.535 2.543 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCC[N@H+](Cc3ccccc3)C2)CCN1C ZINC000247392188 474136843 /nfs/dbraw/zinc/13/68/43/474136843.db2.gz MBGBYOKQQJHKLJ-YZGWKJHDSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CCN1C ZINC000247392188 474136848 /nfs/dbraw/zinc/13/68/48/474136848.db2.gz MBGBYOKQQJHKLJ-YZGWKJHDSA-N 1 3 343.515 2.840 10 0 EFAEHO C[C@H]1C[C@@H](N(C)C(=O)NCCCCC[NH+]2CCCCC2)CCN1C ZINC000175136715 474148368 /nfs/dbraw/zinc/14/83/68/474148368.db2.gz OVHIXDPNCRACBI-ROUUACIJSA-N 1 3 338.540 2.767 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)NCCCCC[NH+]2CCCCC2)CCN1C ZINC000175136668 474148518 /nfs/dbraw/zinc/14/85/18/474148518.db2.gz OVHIXDPNCRACBI-QZTJIDSGSA-N 1 3 338.540 2.767 10 0 EFAEHO CC(C)[N@@H+]1CCCN(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CC1 ZINC000270561099 474170456 /nfs/dbraw/zinc/17/04/56/474170456.db2.gz SZOQNGJOUMCEEY-RBUKOAKNSA-N 1 3 344.503 2.558 10 0 EFAEHO CC(C)[N@H+]1CCCN(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CC1 ZINC000270561099 474170458 /nfs/dbraw/zinc/17/04/58/474170458.db2.gz SZOQNGJOUMCEEY-RBUKOAKNSA-N 1 3 344.503 2.558 10 0 EFAEHO CC(C)[N@@H+]1CCCN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CC1 ZINC000270561101 474170642 /nfs/dbraw/zinc/17/06/42/474170642.db2.gz SZOQNGJOUMCEEY-RTBURBONSA-N 1 3 344.503 2.558 10 0 EFAEHO CC(C)[N@H+]1CCCN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CC1 ZINC000270561101 474170647 /nfs/dbraw/zinc/17/06/47/474170647.db2.gz SZOQNGJOUMCEEY-RTBURBONSA-N 1 3 344.503 2.558 10 0 EFAEHO CCN1CCC[C@@H](NC(=O)NCC2CC[NH+](CCC(C)C)CC2)C1 ZINC000175436202 474219568 /nfs/dbraw/zinc/21/95/68/474219568.db2.gz MYTBJYSLXUAMQJ-GOSISDBHSA-N 1 3 338.540 2.528 10 0 EFAEHO CC(C)[NH2+]C1CCN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CC1 ZINC000248144052 474268825 /nfs/dbraw/zinc/26/88/25/474268825.db2.gz ZCQHCDBVCOUQIA-MOPGFXCFSA-N 1 3 344.503 2.604 10 0 EFAEHO CCCN1CCN(c2ccccc2CNCC(C)(C)C[NH+](C)C)CC1 ZINC000236783158 474287499 /nfs/dbraw/zinc/28/74/99/474287499.db2.gz AOPRAPHYIUWTFO-UHFFFAOYSA-N 1 3 346.563 2.896 10 0 EFAEHO CNC(=O)C(C)(C)C[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000248410049 474311980 /nfs/dbraw/zinc/31/19/80/474311980.db2.gz DAEMCIBPRDDZIQ-GUDVDZBRSA-N 1 3 343.515 2.649 10 0 EFAEHO CC(C)C(=O)NCCN[C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248411723 474314175 /nfs/dbraw/zinc/31/41/75/474314175.db2.gz ZMEQYRVXWDDRDC-VAMGGRTRSA-N 1 3 343.515 2.649 10 0 EFAEHO CC(C)C(=O)NCCN[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000248411723 474314178 /nfs/dbraw/zinc/31/41/78/474314178.db2.gz ZMEQYRVXWDDRDC-VAMGGRTRSA-N 1 3 343.515 2.649 10 0 EFAEHO CC(C)C(=O)NCC[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000248411723 474314186 /nfs/dbraw/zinc/31/41/86/474314186.db2.gz ZMEQYRVXWDDRDC-VAMGGRTRSA-N 1 3 343.515 2.649 10 0 EFAEHO c1cn(CCC[NH2+][C@@H]2CCC[C@H]3CN(Cc4ccccc4)C[C@H]32)nn1 ZINC000248450282 474327472 /nfs/dbraw/zinc/32/74/72/474327472.db2.gz FMPMBFNUZVBUHP-XUVXKRRUSA-N 1 3 339.487 2.559 10 0 EFAEHO CN(C)Cc1c2ccccc2oc1C(=O)NCC[C@@H]1CCC[NH2+]C1 ZINC000237046672 474327938 /nfs/dbraw/zinc/32/79/38/474327938.db2.gz DNUZTTWZOAJTMJ-AWEZNQCLSA-N 1 3 329.444 2.614 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)CC[N@@H+]1C ZINC000631452432 480097903 /nfs/dbraw/zinc/09/79/03/480097903.db2.gz SYVPDZXBFHBVDA-YZGWKJHDSA-N 1 3 343.515 2.840 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)CC[N@H+]1C ZINC000631452432 480097911 /nfs/dbraw/zinc/09/79/11/480097911.db2.gz SYVPDZXBFHBVDA-YZGWKJHDSA-N 1 3 343.515 2.840 10 0 EFAEHO CCN1CCC[C@@H]1CN(C)C(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000176020417 474364729 /nfs/dbraw/zinc/36/47/29/474364729.db2.gz OMEDXIUYUMVEOA-GOSISDBHSA-N 1 3 336.524 2.519 10 0 EFAEHO CCN1CCC[C@H](NC(=O)NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000176256841 474423522 /nfs/dbraw/zinc/42/35/22/474423522.db2.gz DMHALTJBQJOULY-KRWDZBQOSA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@H]1CCN(C(=O)c2ccc(C[NH3+])cc2)CCN1Cc1ccccc1 ZINC000237552906 474427928 /nfs/dbraw/zinc/42/79/28/474427928.db2.gz IHIWCBHBMORPST-KRWDZBQOSA-N 1 3 337.467 2.882 10 0 EFAEHO Cc1nnc(CCN[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000289830051 474446695 /nfs/dbraw/zinc/44/66/95/474446695.db2.gz PJPLSGLYWOUIJJ-WMLDXEAASA-N 1 3 330.501 2.889 10 0 EFAEHO Cc1nnc(CCN[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000289830051 474446702 /nfs/dbraw/zinc/44/67/02/474446702.db2.gz PJPLSGLYWOUIJJ-WMLDXEAASA-N 1 3 330.501 2.889 10 0 EFAEHO C[C@@H]1CN([C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)c2cccs2)CCO1 ZINC000248827420 474447303 /nfs/dbraw/zinc/44/73/03/474447303.db2.gz GPVVPLFGEROVTQ-AJYUKVHDSA-N 1 3 349.544 2.725 10 0 EFAEHO C[NH+](C)Cc1cccc(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)c1 ZINC000289875430 474466431 /nfs/dbraw/zinc/46/64/31/474466431.db2.gz RBDQFWAYPMCKQL-LJQANCHMSA-N 1 3 335.467 2.577 10 0 EFAEHO Cc1cc(CNCc2ccnc(OCC[NH+](C)C)c2)cc(C)c1O ZINC000289954706 474500430 /nfs/dbraw/zinc/50/04/30/474500430.db2.gz AYSYVUKYBMDIRV-UHFFFAOYSA-N 1 3 329.444 2.634 10 0 EFAEHO O=C(NC1CCN(Cc2ccccc2)CC1)[C@@H]1C[C@@H]2CCCC[C@@H]2[NH2+]1 ZINC000237991578 474516813 /nfs/dbraw/zinc/51/68/13/474516813.db2.gz ZFUAZXVBMFIOJS-IHPCNDPISA-N 1 3 341.499 2.688 10 0 EFAEHO CC(C)NC(=O)CCNC1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000184742177 474598910 /nfs/dbraw/zinc/59/89/10/474598910.db2.gz QCPJUIKOAYNKDT-IRXDYDNUSA-N 1 3 331.504 2.647 10 0 EFAEHO CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)CC1CC[NH+](C)CC1 ZINC000291772702 474678894 /nfs/dbraw/zinc/67/88/94/474678894.db2.gz WNGMQYCLCQAZFD-FQEVSTJZSA-N 1 3 345.531 2.991 10 0 EFAEHO CN1CCC[C@@H](CNC2=[NH+]CCN2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000253426474 474750980 /nfs/dbraw/zinc/75/09/80/474750980.db2.gz IYXPIOIHCCAWPR-DZGCQCFKSA-N 1 3 340.393 2.637 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNCc2cnnn2Cc2ccccc2)C1 ZINC000291937323 474761326 /nfs/dbraw/zinc/76/13/26/474761326.db2.gz MTTDQRDUHNUNQE-GOSISDBHSA-N 1 3 341.503 2.928 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNCc2cnnn2Cc2ccccc2)C1 ZINC000291937323 474761335 /nfs/dbraw/zinc/76/13/35/474761335.db2.gz MTTDQRDUHNUNQE-GOSISDBHSA-N 1 3 341.503 2.928 10 0 EFAEHO CN(C)Cc1cccc(NC(=O)N2CCC[C@H]([C@H]3CCC[NH2+]3)C2)c1 ZINC000623053301 480125144 /nfs/dbraw/zinc/12/51/44/480125144.db2.gz AMLVIVLCEOORSZ-FUHWJXTLSA-N 1 3 330.476 2.744 10 0 EFAEHO CN(C)C[C@@H]1CCCN1C(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000268087104 474790384 /nfs/dbraw/zinc/79/03/84/474790384.db2.gz FPRDJPJHDJXIKR-IBGZPJMESA-N 1 3 329.488 2.839 10 0 EFAEHO C[C@@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)NCCN1[C@@H](C)CCC[C@@H]1C ZINC000344785932 474792663 /nfs/dbraw/zinc/79/26/63/474792663.db2.gz BZCKBRFTXXTFRW-FJIDUMEYSA-N 1 3 336.524 2.518 10 0 EFAEHO C[NH+]1CCC(CC(=O)N[C@H](CN2CCCC2)c2ccccc2)CC1 ZINC000273267856 474812972 /nfs/dbraw/zinc/81/29/72/474812972.db2.gz UQQDCGHUJLLLIX-LJQANCHMSA-N 1 3 329.488 2.672 10 0 EFAEHO O[C@H](C[NH2+][C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]12)CC(F)(F)F ZINC000307951746 474814908 /nfs/dbraw/zinc/81/49/08/474814908.db2.gz VBWXKHTYJAPLHD-YYIAUSFCSA-N 1 3 342.405 2.800 10 0 EFAEHO O[C@H](CN[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12)CC(F)(F)F ZINC000307951746 474814912 /nfs/dbraw/zinc/81/49/12/474814912.db2.gz VBWXKHTYJAPLHD-YYIAUSFCSA-N 1 3 342.405 2.800 10 0 EFAEHO O[C@H](CN[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12)CC(F)(F)F ZINC000307951746 474814919 /nfs/dbraw/zinc/81/49/19/474814919.db2.gz VBWXKHTYJAPLHD-YYIAUSFCSA-N 1 3 342.405 2.800 10 0 EFAEHO CCCCOC[C@H](O)C[NH2+][C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]12 ZINC000310940888 474832324 /nfs/dbraw/zinc/83/23/24/474832324.db2.gz JQOZRFSJNZEFPO-XRXFAXGQSA-N 1 3 346.515 2.664 10 0 EFAEHO CCCCOC[C@H](O)CN[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC000310940888 474832332 /nfs/dbraw/zinc/83/23/32/474832332.db2.gz JQOZRFSJNZEFPO-XRXFAXGQSA-N 1 3 346.515 2.664 10 0 EFAEHO CCCCOC[C@H](O)CN[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC000310940888 474832350 /nfs/dbraw/zinc/83/23/50/474832350.db2.gz JQOZRFSJNZEFPO-XRXFAXGQSA-N 1 3 346.515 2.664 10 0 EFAEHO Cc1nocc1CNCCc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000293272985 474903328 /nfs/dbraw/zinc/90/33/28/474903328.db2.gz NNISIWGYPTZUIB-UHFFFAOYSA-N 1 3 329.444 2.790 10 0 EFAEHO CN1CC[C@]2(CC[N@H+](C[C@H](O)c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000292227727 474912998 /nfs/dbraw/zinc/91/29/98/474912998.db2.gz VKDBJJGWNPZDNN-HOTGVXAUSA-N 1 3 328.378 2.766 10 0 EFAEHO CN1CC[C@]2(CC[N@@H+](C[C@H](O)c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000292227727 474913005 /nfs/dbraw/zinc/91/30/05/474913005.db2.gz VKDBJJGWNPZDNN-HOTGVXAUSA-N 1 3 328.378 2.766 10 0 EFAEHO COC(=O)c1cc2cc(C[N@@H+]3CC[C@@]4(CCN(C)C4)C3)ccc2o1 ZINC000292259033 474929498 /nfs/dbraw/zinc/92/94/98/474929498.db2.gz YKVGNQRIYMSMIU-LJQANCHMSA-N 1 3 328.412 2.747 10 0 EFAEHO COC(=O)c1cc2cc(C[N@H+]3CC[C@@]4(CCN(C)C4)C3)ccc2o1 ZINC000292259033 474929512 /nfs/dbraw/zinc/92/95/12/474929512.db2.gz YKVGNQRIYMSMIU-LJQANCHMSA-N 1 3 328.412 2.747 10 0 EFAEHO CN(C(=O)CC1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000261553717 474983790 /nfs/dbraw/zinc/98/37/90/474983790.db2.gz AMSWXJJUKMZEIU-RAFMOHDBSA-N 1 3 341.499 2.640 10 0 EFAEHO C[C@H](CC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)[C@@H]1CCC[NH2+]C1 ZINC000261568488 474985443 /nfs/dbraw/zinc/98/54/43/474985443.db2.gz JDYNHRBRIIRIGM-RLLQIKCJSA-N 1 3 343.515 2.745 10 0 EFAEHO C[C@@H]([NH2+]CCN1CCN(C)C(C)(C)C1)c1cnn(C2CCCC2)c1 ZINC000337436891 475017496 /nfs/dbraw/zinc/01/74/96/475017496.db2.gz WYWHDAKQAMSZCW-MRXNPFEDSA-N 1 3 333.524 2.675 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CC1(N(C)C)CCOCC1 ZINC000268885954 475052060 /nfs/dbraw/zinc/05/20/60/475052060.db2.gz MRZTUPGGHJYKST-UYAOXDASSA-N 1 3 345.531 2.597 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)NCCC[N@@H+]1CCCC[C@@H]1C ZINC000341450762 475053746 /nfs/dbraw/zinc/05/37/46/475053746.db2.gz JJRCTSMEWOMCTK-OKZBNKHCSA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@@H]1CCC[C@H](C)N1CCNC(=O)NCCC[N@H+]1CCCC[C@@H]1C ZINC000341450762 475053751 /nfs/dbraw/zinc/05/37/51/475053751.db2.gz JJRCTSMEWOMCTK-OKZBNKHCSA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@H](CN1CCCCC1)NC(=O)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000341454611 475054095 /nfs/dbraw/zinc/05/40/95/475054095.db2.gz CEEACSTUVVUEBT-QZTJIDSGSA-N 1 3 336.524 2.521 10 0 EFAEHO CC1(C)CCC[NH2+][C@@H]1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000261786883 475062467 /nfs/dbraw/zinc/06/24/67/475062467.db2.gz YODZOOVDBOHIKB-ZWKOTPCHSA-N 1 3 329.488 2.718 10 0 EFAEHO c1ccc(N2CCC([NH2+][C@@H]3CCC[C@H]3[C@H]3CCCCN3)CC2)nc1 ZINC000261795080 475064872 /nfs/dbraw/zinc/06/48/72/475064872.db2.gz ZGAQMIIRQVOCIY-IPMKNSEASA-N 1 3 328.504 2.951 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCCN(C)CC(F)(F)F ZINC000268961058 475096950 /nfs/dbraw/zinc/09/69/50/475096950.db2.gz XHANIUNYPTWFBM-RDJZCZTQSA-N 1 3 343.437 2.981 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCCN(C)CC(F)(F)F ZINC000268961058 475096958 /nfs/dbraw/zinc/09/69/58/475096958.db2.gz XHANIUNYPTWFBM-RDJZCZTQSA-N 1 3 343.437 2.981 10 0 EFAEHO COC[C@H](C)[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000339490096 475252363 /nfs/dbraw/zinc/25/23/63/475252363.db2.gz WMPYVFQVSXZFDE-HKUYNNGSSA-N 1 3 332.488 2.540 10 0 EFAEHO COC[C@H](C)NC[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339490096 475252371 /nfs/dbraw/zinc/25/23/71/475252371.db2.gz WMPYVFQVSXZFDE-HKUYNNGSSA-N 1 3 332.488 2.540 10 0 EFAEHO COC[C@H](C)NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339490096 475252373 /nfs/dbraw/zinc/25/23/73/475252373.db2.gz WMPYVFQVSXZFDE-HKUYNNGSSA-N 1 3 332.488 2.540 10 0 EFAEHO C[C@@H]1OCC[C@@H]1[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 ZINC000339491659 475253151 /nfs/dbraw/zinc/25/31/51/475253151.db2.gz BOWBFNGTIHOKOG-SXLOBPIMSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1OCC[C@@H]1NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339491659 475253159 /nfs/dbraw/zinc/25/31/59/475253159.db2.gz BOWBFNGTIHOKOG-SXLOBPIMSA-N 1 3 344.499 2.682 10 0 EFAEHO C[C@@H]1OCC[C@@H]1NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000339491659 475253166 /nfs/dbraw/zinc/25/31/66/475253166.db2.gz BOWBFNGTIHOKOG-SXLOBPIMSA-N 1 3 344.499 2.682 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000620626164 480156524 /nfs/dbraw/zinc/15/65/24/480156524.db2.gz TWOJZZXCMJTWFQ-SFHVURJKSA-N 1 3 346.519 2.530 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000620626164 480156530 /nfs/dbraw/zinc/15/65/30/480156530.db2.gz TWOJZZXCMJTWFQ-SFHVURJKSA-N 1 3 346.519 2.530 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000620626163 480156914 /nfs/dbraw/zinc/15/69/14/480156914.db2.gz TWOJZZXCMJTWFQ-GOSISDBHSA-N 1 3 346.519 2.530 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000620626163 480156920 /nfs/dbraw/zinc/15/69/20/480156920.db2.gz TWOJZZXCMJTWFQ-GOSISDBHSA-N 1 3 346.519 2.530 10 0 EFAEHO Cc1cc(C)cc([C@H](C)NCC(=O)NC2CC[NH+](C3CC3)CC2)c1 ZINC000341744056 475268276 /nfs/dbraw/zinc/26/82/76/475268276.db2.gz KUUNGWSBRXNFTC-INIZCTEOSA-N 1 3 329.488 2.697 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]CCN2[C@H](C)CCC[C@H]2C)[C@H](C)C1 ZINC000361218488 475278193 /nfs/dbraw/zinc/27/81/93/475278193.db2.gz YTHAFKGHJCVHLW-WTGUMLROSA-N 1 3 339.568 2.976 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)N1CCCC12CCN(C)CC2 ZINC000352499808 475355306 /nfs/dbraw/zinc/35/53/06/475355306.db2.gz LTFHIESMENVUIC-CALCHBBNSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N1CCCC12CCN(C)CC2 ZINC000352499808 475355314 /nfs/dbraw/zinc/35/53/14/475355314.db2.gz LTFHIESMENVUIC-CALCHBBNSA-N 1 3 336.524 2.519 10 0 EFAEHO CN(C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CC[C@H]2C(C)(C)C)c1 ZINC000348112746 475399882 /nfs/dbraw/zinc/39/98/82/475399882.db2.gz RGRUDTBDNJKFMO-QZTJIDSGSA-N 1 3 331.504 2.892 10 0 EFAEHO C[C@@H](CN1CC[C@@]2(C1)CCCOC2)C[N@@H+]1CC[C@]2(C1)CCCOC2 ZINC000341993653 475488132 /nfs/dbraw/zinc/48/81/32/475488132.db2.gz PXOPWDCXGGSWAR-ACDBMABISA-N 1 3 336.520 2.628 10 0 EFAEHO C[C@@H](CN1CC[C@@]2(C1)CCCOC2)C[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000341993653 475488139 /nfs/dbraw/zinc/48/81/39/475488139.db2.gz PXOPWDCXGGSWAR-ACDBMABISA-N 1 3 336.520 2.628 10 0 EFAEHO C[C@H](CN1CC[C@]2(C1)CCCOC2)C[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC000341993653 475488145 /nfs/dbraw/zinc/48/81/45/475488145.db2.gz PXOPWDCXGGSWAR-ACDBMABISA-N 1 3 336.520 2.628 10 0 EFAEHO C[C@H](CN1CC[C@]2(C1)CCCOC2)C[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000341993653 475488147 /nfs/dbraw/zinc/48/81/47/475488147.db2.gz PXOPWDCXGGSWAR-ACDBMABISA-N 1 3 336.520 2.628 10 0 EFAEHO CC[NH+](CC)CC1CCN(CCOCC(F)(F)C(F)F)CC1 ZINC000345871517 475526019 /nfs/dbraw/zinc/52/60/19/475526019.db2.gz XGNCEJZPJITTMA-UHFFFAOYSA-N 1 3 328.394 2.957 10 0 EFAEHO C[C@@H]1C[C@@H](C[NH+]2CCN(CCN(C)Cc3ccccc3)CC2)CCO1 ZINC000352711332 475552724 /nfs/dbraw/zinc/55/27/24/475552724.db2.gz AWIPAGUEIPXEIM-CTNGQTDRSA-N 1 3 345.531 2.551 10 0 EFAEHO C[C@@H]1CCCCCN1C(=O)NC1CCN(C2CC[NH+](C)CC2)CC1 ZINC000358370292 475626323 /nfs/dbraw/zinc/62/63/23/475626323.db2.gz NLFMZEYDJSFNNG-MRXNPFEDSA-N 1 3 336.524 2.519 10 0 EFAEHO C[C@H](CNC(=O)NCC[N@@H+]1CCCC[C@@H]1C)N(C)Cc1ccccc1 ZINC000348377666 475629924 /nfs/dbraw/zinc/62/99/24/475629924.db2.gz FIIWCOIXTGQACK-ZWKOTPCHSA-N 1 3 346.519 2.681 10 0 EFAEHO C[C@H](CNC(=O)NCC[N@H+]1CCCC[C@@H]1C)N(C)Cc1ccccc1 ZINC000348377666 475629930 /nfs/dbraw/zinc/62/99/30/475629930.db2.gz FIIWCOIXTGQACK-ZWKOTPCHSA-N 1 3 346.519 2.681 10 0 EFAEHO CN(C)[C@@H](CNC(=O)C[N@@H+](C)C[C@H]1CC=CCC1)c1ccccc1 ZINC000355069917 475642869 /nfs/dbraw/zinc/64/28/69/475642869.db2.gz YUSHUCLQIGFLQM-HKUYNNGSSA-N 1 3 329.488 2.694 10 0 EFAEHO CN(C)[C@H](CNC(=O)C[N@@H+](C)C[C@@H]1CC=CCC1)c1ccccc1 ZINC000355069920 475643678 /nfs/dbraw/zinc/64/36/78/475643678.db2.gz YUSHUCLQIGFLQM-IEBWSBKVSA-N 1 3 329.488 2.694 10 0 EFAEHO C[C@@H]1CCCCN1CCNC(=O)NCCCCC[NH+]1CCCCC1 ZINC000348406403 475644305 /nfs/dbraw/zinc/64/43/05/475644305.db2.gz TUMQNHQYPSSZSL-GOSISDBHSA-N 1 3 338.540 2.816 10 0 EFAEHO C/C(=C\c1ccc(Cl)cc1)C[NH2+]CCCN1CCC[C@H](C(N)=O)C1 ZINC000338182754 475657020 /nfs/dbraw/zinc/65/70/20/475657020.db2.gz OLBHIWUFWLBFOH-VMEIHUARSA-N 1 3 349.906 2.920 10 0 EFAEHO COc1ccc([C@H](CN(C)C)NC(=O)CC[C@@H]2CCCC[N@@H+]2C)cc1 ZINC000358423948 475666142 /nfs/dbraw/zinc/66/61/42/475666142.db2.gz HLEWEYFJDSPCDR-HKUYNNGSSA-N 1 3 347.503 2.679 10 0 EFAEHO COc1ccc([C@H](CN(C)C)NC(=O)CC[C@@H]2CCCC[N@H+]2C)cc1 ZINC000358423948 475666149 /nfs/dbraw/zinc/66/61/49/475666149.db2.gz HLEWEYFJDSPCDR-HKUYNNGSSA-N 1 3 347.503 2.679 10 0 EFAEHO C[C@@H]1[C@@H]([NH+]2CCCC2)CCN1C(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000352997130 475677690 /nfs/dbraw/zinc/67/76/90/475677690.db2.gz KLWBGTIMPBXUER-XDNAFOTISA-N 1 3 336.524 2.518 10 0 EFAEHO C[C@@H]1CCCC[N@@H+]1CCNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000340102458 475760709 /nfs/dbraw/zinc/76/07/09/475760709.db2.gz LSAIFRUPVSLRRD-NZSAHSFTSA-N 1 3 344.503 2.605 10 0 EFAEHO C[C@@H]1CCCC[N@H+]1CCNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000340102458 475760716 /nfs/dbraw/zinc/76/07/16/475760716.db2.gz LSAIFRUPVSLRRD-NZSAHSFTSA-N 1 3 344.503 2.605 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NC[C@@H](C)N2CCCC[C@@H]2C)CC1 ZINC000338301833 475761309 /nfs/dbraw/zinc/76/13/09/475761309.db2.gz IIURRZSIHJMZRR-DLBZAZTESA-N 1 3 338.540 2.671 10 0 EFAEHO CSC1(CNCc2cc(-c3ccccc3)n[nH]2)CC[NH+](C)CC1 ZINC000353196045 475762215 /nfs/dbraw/zinc/76/22/15/475762215.db2.gz SYCCLSHAXOQKED-UHFFFAOYSA-N 1 3 330.501 2.994 10 0 EFAEHO CSC1(C[NH2+]Cc2cc(-c3ccccc3)n[nH]2)CCN(C)CC1 ZINC000353196045 475762221 /nfs/dbraw/zinc/76/22/21/475762221.db2.gz SYCCLSHAXOQKED-UHFFFAOYSA-N 1 3 330.501 2.994 10 0 EFAEHO CCC[NH+]1CCC(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CC1 ZINC000340112719 475768081 /nfs/dbraw/zinc/76/80/81/475768081.db2.gz NJDVSILPEHTKNQ-RTBURBONSA-N 1 3 344.503 2.605 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H](C)Cn2cccn2)CC1 ZINC000358593400 475794574 /nfs/dbraw/zinc/79/45/74/475794574.db2.gz CJNBFMMEXNWXTA-SFHVURJKSA-N 1 3 341.503 2.593 10 0 EFAEHO CC(C)CN(CC(=O)NC1CC[NH+](C2CC2)CC1)Cc1ccccc1 ZINC000355402601 475905029 /nfs/dbraw/zinc/90/50/29/475905029.db2.gz RNFIRMDJDUIMBM-UHFFFAOYSA-N 1 3 343.515 2.888 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2CCN(c3ncccc3Cl)C2)[C@@H]2CCC[C@H]21 ZINC000353395128 475935562 /nfs/dbraw/zinc/93/55/62/475935562.db2.gz OPVQHPDVIPXESE-YQFWSFKMSA-N 1 3 334.895 2.776 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2CCN(c3ncccc3Cl)C2)[C@@H]2CCC[C@H]21 ZINC000353395128 475935568 /nfs/dbraw/zinc/93/55/68/475935568.db2.gz OPVQHPDVIPXESE-YQFWSFKMSA-N 1 3 334.895 2.776 10 0 EFAEHO CN(C(=O)c1ccc(C[NH+]2CCCC2)cc1)[C@@H]1CCN(C2CC2)C1 ZINC000338536010 475991973 /nfs/dbraw/zinc/99/19/73/475991973.db2.gz JSRPFVWBQUSOJA-LJQANCHMSA-N 1 3 327.472 2.591 10 0 EFAEHO C[C@@H](C[NH2+]C1CCN(c2ccncc2)CC1)N(C)C(=O)OC(C)(C)C ZINC000298177938 476009422 /nfs/dbraw/zinc/00/94/22/476009422.db2.gz VBEUVXARBUUMTC-HNNXBMFYSA-N 1 3 348.491 2.895 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21)N1CCc2ccccc2C1 ZINC000353502468 476025384 /nfs/dbraw/zinc/02/53/84/476025384.db2.gz LMPUMBLTDFEVBK-RCOXNQKVSA-N 1 3 327.516 2.896 10 0 EFAEHO C[C@H](CN[C@@H]1CC[N@@H+](C)[C@H]2CCC[C@H]21)N1CCc2ccccc2C1 ZINC000353502468 476025393 /nfs/dbraw/zinc/02/53/93/476025393.db2.gz LMPUMBLTDFEVBK-RCOXNQKVSA-N 1 3 327.516 2.896 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000349992879 476027666 /nfs/dbraw/zinc/02/76/66/476027666.db2.gz KPTYVXBRSCLLTD-QZTJIDSGSA-N 1 3 336.524 2.519 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000349992879 476027676 /nfs/dbraw/zinc/02/76/76/476027676.db2.gz KPTYVXBRSCLLTD-QZTJIDSGSA-N 1 3 336.524 2.519 10 0 EFAEHO CN(C(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[C@@H]1CCN(C2CC2)C1 ZINC000347007664 476027841 /nfs/dbraw/zinc/02/78/41/476027841.db2.gz HHQCODMAAHGUTJ-UYAOXDASSA-N 1 3 341.499 2.594 10 0 EFAEHO CN(C(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1CCN(C2CC2)C1 ZINC000347007664 476027848 /nfs/dbraw/zinc/02/78/48/476027848.db2.gz HHQCODMAAHGUTJ-UYAOXDASSA-N 1 3 341.499 2.594 10 0 EFAEHO CN(C)CCOc1ccc(CC[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@H]32)cc1 ZINC000353521174 476043095 /nfs/dbraw/zinc/04/30/95/476043095.db2.gz PJZOTPRZCZYRPQ-HBMCJLEFSA-N 1 3 345.531 2.632 10 0 EFAEHO C[NH+](C)CCOC1CCN(Cc2cnc(-c3ccncc3)s2)CC1 ZINC000353522917 476044512 /nfs/dbraw/zinc/04/45/12/476044512.db2.gz SRQQCIWTCAMAFE-UHFFFAOYSA-N 1 3 346.500 2.748 10 0 EFAEHO COC1CCN(C2(C[NH2+][C@@H]3CCN(C)[C@H]4CCC[C@@H]43)CCCC2)CC1 ZINC000353531836 476052872 /nfs/dbraw/zinc/05/28/72/476052872.db2.gz PMXFBNLGVSVINR-AQNXPRMDSA-N 1 3 349.563 2.872 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@@H](COC)C2)CC1 ZINC000353591300 476105533 /nfs/dbraw/zinc/10/55/33/476105533.db2.gz JHXYHDSBKTXAEO-GOSISDBHSA-N 1 3 331.504 2.687 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@@H](COC)C2)CC1 ZINC000353591300 476105541 /nfs/dbraw/zinc/10/55/41/476105541.db2.gz JHXYHDSBKTXAEO-GOSISDBHSA-N 1 3 331.504 2.687 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@H](COC)C2)CC1 ZINC000353591303 476106067 /nfs/dbraw/zinc/10/60/67/476106067.db2.gz JHXYHDSBKTXAEO-SFHVURJKSA-N 1 3 331.504 2.687 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@H](COC)C2)CC1 ZINC000353591303 476106075 /nfs/dbraw/zinc/10/60/75/476106075.db2.gz JHXYHDSBKTXAEO-SFHVURJKSA-N 1 3 331.504 2.687 10 0 EFAEHO CC(C)C[C@H](N[C@H]1CCCc2ccc(F)cc21)C(=O)NCC[NH+](C)C ZINC000347254929 476208579 /nfs/dbraw/zinc/20/85/79/476208579.db2.gz SWZPRARNWRUQFF-OALUTQOASA-N 1 3 349.494 2.885 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH+]2CCC(O)(CC)CC2)CC1 ZINC000353745120 476237722 /nfs/dbraw/zinc/23/77/22/476237722.db2.gz HAGIFSAGXMWHLG-UHFFFAOYSA-N 1 3 345.531 2.956 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CCC[C@H]2C[C@H](C)O)CC1 ZINC000353860583 476304392 /nfs/dbraw/zinc/30/43/92/476304392.db2.gz XZAAIMSXEGYBPT-ICSRJNTNSA-N 1 3 345.531 2.954 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CCC[C@H]2C[C@H](C)O)CC1 ZINC000353860583 476304396 /nfs/dbraw/zinc/30/43/96/476304396.db2.gz XZAAIMSXEGYBPT-ICSRJNTNSA-N 1 3 345.531 2.954 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C1CC1)[N@H+](C)Cc1ccccc1 ZINC000357266981 476309505 /nfs/dbraw/zinc/30/95/05/476309505.db2.gz SIUOXLWEVLYZMC-VQTJNVASSA-N 1 3 343.515 2.888 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000357266981 476309510 /nfs/dbraw/zinc/30/95/10/476309510.db2.gz SIUOXLWEVLYZMC-VQTJNVASSA-N 1 3 343.515 2.888 10 0 EFAEHO CNC(=[NH2+])NC[C@@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000363432213 476380303 /nfs/dbraw/zinc/38/03/03/476380303.db2.gz GTHHNAYWSDQQLT-JSGCOSHPSA-N 1 3 328.382 2.832 10 0 EFAEHO COCCOCc1ccc(C[NH2+]C2CC(N3CCCCC3)C2)cc1 ZINC000377399255 476384239 /nfs/dbraw/zinc/38/42/39/476384239.db2.gz FCEYASDWALMYIT-UHFFFAOYSA-N 1 3 332.488 2.956 10 0 EFAEHO C[C@H]([NH2+][C@@H]1CCN2CCC[C@@H]2C1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000373292420 476392205 /nfs/dbraw/zinc/39/22/05/476392205.db2.gz JFOAGEMSYDNPLZ-YLFCFFPRSA-N 1 3 337.508 2.848 10 0 EFAEHO C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000373292420 476392212 /nfs/dbraw/zinc/39/22/12/476392212.db2.gz JFOAGEMSYDNPLZ-YLFCFFPRSA-N 1 3 337.508 2.848 10 0 EFAEHO C[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000373292420 476392220 /nfs/dbraw/zinc/39/22/20/476392220.db2.gz JFOAGEMSYDNPLZ-YLFCFFPRSA-N 1 3 337.508 2.848 10 0 EFAEHO CC[N@@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)N(C)C1CCCCC1 ZINC000362770885 476399688 /nfs/dbraw/zinc/39/96/88/476399688.db2.gz VQTNFAJAKLIBGB-SFHVURJKSA-N 1 3 338.540 2.719 10 0 EFAEHO CC[N@H+]1CCC[C@H]1CN(CCN(C)C)C(=O)N(C)C1CCCCC1 ZINC000362770885 476399694 /nfs/dbraw/zinc/39/96/94/476399694.db2.gz VQTNFAJAKLIBGB-SFHVURJKSA-N 1 3 338.540 2.719 10 0 EFAEHO CC[C@H](C)N[C@@H](CNC(=O)N(C)[C@@H]1CC[N@@H+](C2CC2)C1)c1ccco1 ZINC000357551193 476449602 /nfs/dbraw/zinc/44/96/02/476449602.db2.gz WVTYDLVLUDFTPC-UAGQMJEPSA-N 1 3 348.491 2.587 10 0 EFAEHO CC[C@H](C)N[C@@H](CNC(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1)c1ccco1 ZINC000357551193 476449607 /nfs/dbraw/zinc/44/96/07/476449607.db2.gz WVTYDLVLUDFTPC-UAGQMJEPSA-N 1 3 348.491 2.587 10 0 EFAEHO O[C@H](CNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCOCC1 ZINC000354193007 476492003 /nfs/dbraw/zinc/49/20/03/476492003.db2.gz YKPQMNLBIGZGLR-OTYNDTSQSA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@H](CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCOCC1 ZINC000354193007 476492011 /nfs/dbraw/zinc/49/20/11/476492011.db2.gz YKPQMNLBIGZGLR-OTYNDTSQSA-N 1 3 344.499 2.559 10 0 EFAEHO C[C@@H]1CCOCCN1Cc1ccccc1C[N@@H+]1CCOCC[C@H]1C ZINC000374986556 476623295 /nfs/dbraw/zinc/62/32/95/476623295.db2.gz JLALQLXYYILGCH-QZTJIDSGSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@@H]1CCOCCN1Cc1ccccc1C[N@H+]1CCOCC[C@H]1C ZINC000374986556 476623298 /nfs/dbraw/zinc/62/32/98/476623298.db2.gz JLALQLXYYILGCH-QZTJIDSGSA-N 1 3 332.488 2.908 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000377908076 476638397 /nfs/dbraw/zinc/63/83/97/476638397.db2.gz QYCDXWAPKIQBKY-ZULIPRJHSA-N 1 3 343.515 2.744 10 0 EFAEHO C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000377908076 476638402 /nfs/dbraw/zinc/63/84/02/476638402.db2.gz QYCDXWAPKIQBKY-ZULIPRJHSA-N 1 3 343.515 2.744 10 0 EFAEHO CC(CN1CCC[C@@]2(CCOC2)C1)C[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000451900157 476709923 /nfs/dbraw/zinc/70/99/23/476709923.db2.gz LJFHYOWRUDODMD-WOJBJXKFSA-N 1 3 336.520 2.628 10 0 EFAEHO CC(CN1CCC[C@@]2(CCOC2)C1)C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000451900157 476709931 /nfs/dbraw/zinc/70/99/31/476709931.db2.gz LJFHYOWRUDODMD-WOJBJXKFSA-N 1 3 336.520 2.628 10 0 EFAEHO N[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000422725165 476745010 /nfs/dbraw/zinc/74/50/10/476745010.db2.gz ARFJXLYOTWPZHE-OAGGEKHMSA-N 1 3 327.394 2.749 10 0 EFAEHO [NH3+][C@@H]1CCC[C@@H]1N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000422725165 476745018 /nfs/dbraw/zinc/74/50/18/476745018.db2.gz ARFJXLYOTWPZHE-OAGGEKHMSA-N 1 3 327.394 2.749 10 0 EFAEHO CC(C)OC[C@@H](O)C[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000383658765 476750718 /nfs/dbraw/zinc/75/07/18/476750718.db2.gz FVZBLZWIGIEDQA-PMACEKPBSA-N 1 3 334.504 2.664 10 0 EFAEHO CC(C)OC[C@@H](O)CNC[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000383658765 476750725 /nfs/dbraw/zinc/75/07/25/476750725.db2.gz FVZBLZWIGIEDQA-PMACEKPBSA-N 1 3 334.504 2.664 10 0 EFAEHO CC(C)OC[C@@H](O)CNC[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000383658765 476750733 /nfs/dbraw/zinc/75/07/33/476750733.db2.gz FVZBLZWIGIEDQA-PMACEKPBSA-N 1 3 334.504 2.664 10 0 EFAEHO Fc1ccc2[nH]cc(CCN[C@@H]3CCOC[C@H]3[C@H]3CCC[NH2+]3)c2c1 ZINC000422761948 476765053 /nfs/dbraw/zinc/76/50/53/476765053.db2.gz NEKDBSQXGWPITL-YQVWRLOYSA-N 1 3 331.435 2.596 10 0 EFAEHO C[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)[C@H]1CCCC[NH2+]1 ZINC000422771505 476769570 /nfs/dbraw/zinc/76/95/70/476769570.db2.gz VRKQXBLWRQTLAB-VQIMIIECSA-N 1 3 329.488 2.659 10 0 EFAEHO CCCCOCCOCCN[C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422802263 476782858 /nfs/dbraw/zinc/78/28/58/476782858.db2.gz DEXUMAPZAVGIIH-QUCCMNQESA-N 1 3 348.487 2.665 10 0 EFAEHO c1ccc2c(c1)C[C@H](CN[C@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)O2 ZINC000422804036 476785524 /nfs/dbraw/zinc/78/55/24/476785524.db2.gz GXWRSEUEJIFMCS-MMOPVJDHSA-N 1 3 336.435 2.836 10 0 EFAEHO COc1ccc([C@H](NC[C@]2(N(C)C)CCSC2)[C@H]2CCC[NH2+]2)cc1 ZINC000422817854 476792389 /nfs/dbraw/zinc/79/23/89/476792389.db2.gz DZDHCCHUTWZDCP-CEXWTWQISA-N 1 3 349.544 2.515 10 0 EFAEHO c1ccc(COCCCCN[C@@H]2CCOC[C@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000422830809 476799924 /nfs/dbraw/zinc/79/99/24/476799924.db2.gz DBNXZLUUGFXTJI-XUVXKRRUSA-N 1 3 332.488 2.730 10 0 EFAEHO COc1ccc(CCN[C@@H]2CCOC[C@@H]2[C@H]2CCC[NH2+]2)c(Cl)c1 ZINC000422892424 476830668 /nfs/dbraw/zinc/83/06/68/476830668.db2.gz YNBDIFNRDRPYEG-KBAYOESNSA-N 1 3 338.879 2.638 10 0 EFAEHO COc1cc(OC)cc(OCC[NH2+][C@H](C)c2ccc(CN)nc2C)c1 ZINC000422935278 476854572 /nfs/dbraw/zinc/85/45/72/476854572.db2.gz HBXQTGJGJWPTDX-CYBMUJFWSA-N 1 3 345.443 2.596 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C)[C@@H](C)[NH3+] ZINC000399518710 476883797 /nfs/dbraw/zinc/88/37/97/476883797.db2.gz NWSPNICLUXNTAS-ISARSNTHSA-N 1 3 331.504 2.633 10 0 EFAEHO [NH3+][C@H]1CCC[C@@H]1NCCCOc1ncc(C(F)(F)F)cc1Cl ZINC000423008373 476889535 /nfs/dbraw/zinc/88/95/35/476889535.db2.gz AAQDKZWRAZMCCB-RYUDHWBXSA-N 1 3 337.773 2.992 10 0 EFAEHO CC(C)N1CC[C@H](C[NH2+][C@@H](C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1 ZINC000400581110 476891935 /nfs/dbraw/zinc/89/19/35/476891935.db2.gz QSKCVYNLCJFQMR-GVDBMIGSSA-N 1 3 339.524 2.952 10 0 EFAEHO C[C@H]1CNCC[C@H]1[NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000414946663 476895008 /nfs/dbraw/zinc/89/50/08/476895008.db2.gz UQCDMSJTKPJZLD-SUMWQHHRSA-N 1 3 335.879 2.532 10 0 EFAEHO COc1cccc([C@@H]2[C@H](NC3C[C@H]4CC[C@@H](C3)[NH2+]4)CCN2C2CC2)c1 ZINC000423043203 476901578 /nfs/dbraw/zinc/90/15/78/476901578.db2.gz NVYHFPSEZGHYRL-ACKSUQRBSA-N 1 3 341.499 2.846 10 0 EFAEHO COC[C@]1(C[NH2+][C@@H](C)CCc2ccc(OC(F)F)cc2)CCCN1 ZINC000414956262 476902195 /nfs/dbraw/zinc/90/21/95/476902195.db2.gz OOWAGRYJYAUZJU-KBXCAEBGSA-N 1 3 342.430 2.967 10 0 EFAEHO CCOC(=O)c1csc(CC[NH2+][C@@H]2C[C@@H](N)c3ccccc32)n1 ZINC000423065408 476913488 /nfs/dbraw/zinc/91/34/88/476913488.db2.gz BGLZNDRYPLMWGF-ZIAGYGMSSA-N 1 3 331.441 2.597 10 0 EFAEHO [NH3+]C[C@@H]1CCCC[C@@H]1NCc1cc(Cl)ccc1N1CCOCC1 ZINC000423106875 476930076 /nfs/dbraw/zinc/93/00/76/476930076.db2.gz RNVJSRIIQFNAES-YOEHRIQHSA-N 1 3 337.895 2.784 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000423105750 476930174 /nfs/dbraw/zinc/93/01/74/476930174.db2.gz IQTUTMFCUXPRNS-DOMZBBRYSA-N 1 3 335.275 2.760 10 0 EFAEHO COC[C@@H](CCC[NH3+])N[C@@H]1CCOc2c(Br)cccc21 ZINC000423112361 476931074 /nfs/dbraw/zinc/93/10/74/476931074.db2.gz JWIKPRVKKMYVDD-BXUZGUMPSA-N 1 3 343.265 2.616 10 0 EFAEHO CCCN1CCC[C@H]1CN[C@@H](c1ccc(OC)cc1)[C@H]1CCC[NH2+]1 ZINC000423114463 476933107 /nfs/dbraw/zinc/93/31/07/476933107.db2.gz VUQPCQWBDKULFW-SXLOBPIMSA-N 1 3 331.504 2.952 10 0 EFAEHO CC[C@H](N[C@@H](CC(C)C)C(=O)NCC[NH+](C)C)c1cccc(F)c1 ZINC000446930317 476935769 /nfs/dbraw/zinc/93/57/69/476935769.db2.gz NMUXGRMWVABHDR-ROUUACIJSA-N 1 3 337.483 2.959 10 0 EFAEHO COC[C@H](CCC[NH3+])N[C@H]1CCc2c1ccc(F)c2Br ZINC000423148020 476944118 /nfs/dbraw/zinc/94/41/18/476944118.db2.gz DUVBEJMSJDVDCB-HZMBPMFUSA-N 1 3 345.256 2.919 10 0 EFAEHO C[C@H]([NH3+])[C@H](Cc1ccccc1)N[C@H]1CCN(c2ccc(F)cc2)C1 ZINC000423187465 476956914 /nfs/dbraw/zinc/95/69/14/476956914.db2.gz POWQHAZTRPFDQE-QSFXBCCZSA-N 1 3 327.447 2.953 10 0 EFAEHO CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2ccc3c(c2)CNCC3)[C@@H](C)C1 ZINC000415896734 476960521 /nfs/dbraw/zinc/96/05/21/476960521.db2.gz OVMJRWFFCJNJJK-KSSFIOAISA-N 1 3 330.476 2.526 10 0 EFAEHO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc3c(c2)CNCC3)[C@@H](C)C1 ZINC000415896734 476960526 /nfs/dbraw/zinc/96/05/26/476960526.db2.gz OVMJRWFFCJNJJK-KSSFIOAISA-N 1 3 330.476 2.526 10 0 EFAEHO CC[NH+](CC)CC1CCN(C(=O)Nc2ccccc2CNC)CC1 ZINC000415899840 476963101 /nfs/dbraw/zinc/96/31/01/476963101.db2.gz KKELRCYOOYYBOX-UHFFFAOYSA-N 1 3 332.492 2.992 10 0 EFAEHO COc1ccc([C@H](NC[C@H](N)c2ccccc2)[C@H]2CCC[NH2+]2)cc1 ZINC000423249241 476975506 /nfs/dbraw/zinc/97/55/06/476975506.db2.gz OHLJVSOAATVTSC-ZCNNSNEGSA-N 1 3 325.456 2.778 10 0 EFAEHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc3c(c2)OCC(=O)N3)cc1 ZINC000423296819 476985255 /nfs/dbraw/zinc/98/52/55/476985255.db2.gz ZXATWUVJGZFEBI-STQMWFEESA-N 1 3 325.412 2.888 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccccc2CN2CCCC2=O)[C@H]2CCC[C@H]21 ZINC000375791167 477007179 /nfs/dbraw/zinc/00/71/79/477007179.db2.gz NZTVIKYTNWQJOF-HSALFYBXSA-N 1 3 341.499 2.771 10 0 EFAEHO C[C@H]([NH2+][C@@H]1CCNC[C@@H]1C)c1ccc(OCc2nccn2C)cc1 ZINC000423362566 477007250 /nfs/dbraw/zinc/00/72/50/477007250.db2.gz BGBPKQPUWFIPIS-RLFYNMQTSA-N 1 3 328.460 2.648 10 0 EFAEHO Cc1cc(C)n(-c2ccc(C[NH2+][C@@H]3CCN(C)[C@H]4CCC[C@H]43)cn2)n1 ZINC000375791644 477007798 /nfs/dbraw/zinc/00/77/98/477007798.db2.gz OVFFCIQINIRWMI-OTWHNJEPSA-N 1 3 339.487 2.847 10 0 EFAEHO Fc1ccc([C@H](NC[C@@H](N2CC[NH2+]CC2)C(F)(F)F)C2CC2)cc1 ZINC000423399135 477017477 /nfs/dbraw/zinc/01/74/77/477017477.db2.gz VYJXZNJCWYANKU-HZPDHXFCSA-N 1 3 345.384 2.703 10 0 EFAEHO C[C@H]1CN(C2CC2)C[C@@H]1NC[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000423461388 477038106 /nfs/dbraw/zinc/03/81/06/477038106.db2.gz CHPAPIXRZFQQHK-UQOODKLHSA-N 1 3 331.479 2.591 10 0 EFAEHO O=C(CCN1CCc2ccccc2C1)N1CC[C@@H]([NH+]2CCCCC2)C1 ZINC000416149435 477041396 /nfs/dbraw/zinc/04/13/96/477041396.db2.gz HANOIYGNBVNTQJ-HXUWFJFHSA-N 1 3 341.499 2.522 10 0 EFAEHO C[C@H](NC(=O)CCN1CCc2ccccc2C1)C(C)(C)C[NH+](C)C ZINC000416155547 477044076 /nfs/dbraw/zinc/04/40/76/477044076.db2.gz MRPKDBDVZMLBIU-INIZCTEOSA-N 1 3 331.504 2.527 10 0 EFAEHO CC[NH+](CC)C[C@H]1CCN(C(=O)CCN2CCc3ccccc3C2)C1 ZINC000416161647 477048411 /nfs/dbraw/zinc/04/84/11/477048411.db2.gz NIIYFOUAGINJAS-GOSISDBHSA-N 1 3 343.515 2.625 10 0 EFAEHO CCC[N@H+](C)C[C@H]1CCN(C(=O)CCN2CCc3ccccc3C2)C1 ZINC000416163575 477049263 /nfs/dbraw/zinc/04/92/63/477049263.db2.gz UTGZUCOHHVFREH-GOSISDBHSA-N 1 3 343.515 2.625 10 0 EFAEHO CCC[N@@H+](C)C[C@H]1CCN(C(=O)CCN2CCc3ccccc3C2)C1 ZINC000416163575 477049270 /nfs/dbraw/zinc/04/92/70/477049270.db2.gz UTGZUCOHHVFREH-GOSISDBHSA-N 1 3 343.515 2.625 10 0 EFAEHO CC[C@H]([NH2+]CC1(N)C2CC3CC(C2)CC1C3)C1(C(=O)OC)CCC1 ZINC000423527480 477063763 /nfs/dbraw/zinc/06/37/63/477063763.db2.gz MPWPOAWRHCBZIW-ITNKIWFMSA-N 1 3 334.504 2.852 10 0 EFAEHO CC[C@H](NCC1([NH3+])C2CC3CC(C2)CC1C3)C1(C(=O)OC)CCC1 ZINC000423527480 477063770 /nfs/dbraw/zinc/06/37/70/477063770.db2.gz MPWPOAWRHCBZIW-ITNKIWFMSA-N 1 3 334.504 2.852 10 0 EFAEHO COc1cccc(C[C@@H](C)NCC2([NH3+])C3CC4CC(C3)CC2C4)n1 ZINC000423533120 477067073 /nfs/dbraw/zinc/06/70/73/477067073.db2.gz WUHPPLJVJCGQHF-ZQVUSRCWSA-N 1 3 329.488 2.764 10 0 EFAEHO COc1cccc(C[C@@H](C)[NH2+]CC2(N)C3CC4CC(C3)CC2C4)n1 ZINC000423533120 477067082 /nfs/dbraw/zinc/06/70/82/477067082.db2.gz WUHPPLJVJCGQHF-ZQVUSRCWSA-N 1 3 329.488 2.764 10 0 EFAEHO C[C@@H](CCNC(=O)CCN1CCc2ccccc2C1)[NH+]1CCCCC1 ZINC000416204616 477070272 /nfs/dbraw/zinc/07/02/72/477070272.db2.gz PAKWSNSRRMIAAI-SFHVURJKSA-N 1 3 343.515 2.816 10 0 EFAEHO O=C(CC[N@@H+]1CCc2ccccc2C1)NC[C@@H]1CCCCN1C1CC1 ZINC000416224512 477078749 /nfs/dbraw/zinc/07/87/49/477078749.db2.gz QTMVEXJSPATTAJ-FQEVSTJZSA-N 1 3 341.499 2.568 10 0 EFAEHO O=C(CC[N@H+]1CCc2ccccc2C1)NC[C@@H]1CCCCN1C1CC1 ZINC000416224512 477078757 /nfs/dbraw/zinc/07/87/57/477078757.db2.gz QTMVEXJSPATTAJ-FQEVSTJZSA-N 1 3 341.499 2.568 10 0 EFAEHO CN(C)CCOc1cccc(CNC(=O)CC[C@H]2CCCC[N@@H+]2C)c1 ZINC000431729301 477084336 /nfs/dbraw/zinc/08/43/36/477084336.db2.gz QFUNRZACJPDOGY-GOSISDBHSA-N 1 3 347.503 2.508 10 0 EFAEHO CN(C)CCOc1cccc(CNC(=O)CC[C@H]2CCCC[N@H+]2C)c1 ZINC000431729301 477084345 /nfs/dbraw/zinc/08/43/45/477084345.db2.gz QFUNRZACJPDOGY-GOSISDBHSA-N 1 3 347.503 2.508 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000431835170 477103593 /nfs/dbraw/zinc/10/35/93/477103593.db2.gz XGIBANVSUSOIEL-HOJAQTOUSA-N 1 3 343.515 2.888 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000431835170 477103601 /nfs/dbraw/zinc/10/36/01/477103601.db2.gz XGIBANVSUSOIEL-HOJAQTOUSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)C[N@@H+]1CC[C@H](CNC(=O)CCN2CCc3ccccc3C2)C1 ZINC000431849190 477107423 /nfs/dbraw/zinc/10/74/23/477107423.db2.gz CDYKEDZYIXFJKR-GOSISDBHSA-N 1 3 343.515 2.529 10 0 EFAEHO CC(C)C[N@H+]1CC[C@H](CNC(=O)CCN2CCc3ccccc3C2)C1 ZINC000431849190 477107432 /nfs/dbraw/zinc/10/74/32/477107432.db2.gz CDYKEDZYIXFJKR-GOSISDBHSA-N 1 3 343.515 2.529 10 0 EFAEHO CN1C[C@H](N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)CCC1=O ZINC000453105058 477170611 /nfs/dbraw/zinc/17/06/11/477170611.db2.gz BBHTYPFHYUZOPP-UAFMIMERSA-N 1 3 341.499 2.640 10 0 EFAEHO CN1C[C@H](N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)CCC1=O ZINC000453105058 477170615 /nfs/dbraw/zinc/17/06/15/477170615.db2.gz BBHTYPFHYUZOPP-UAFMIMERSA-N 1 3 341.499 2.640 10 0 EFAEHO O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000371243450 477195696 /nfs/dbraw/zinc/19/56/96/477195696.db2.gz KGXKOHAJFMRPSH-PMACEKPBSA-N 1 3 341.499 2.887 10 0 EFAEHO CC(C)N1CCN(CCC[NH2+][C@H](c2ccccc2)[C@@H]2CCOC2)CC1 ZINC000367045076 477314366 /nfs/dbraw/zinc/31/43/66/477314366.db2.gz ZCRYEUGJRTXJMV-NHCUHLMSSA-N 1 3 345.531 2.770 10 0 EFAEHO CN(C)[C@@H](CNC(=O)NCC1([NH3+])CCCCCC1)c1ccccc1 ZINC000416808455 477317104 /nfs/dbraw/zinc/31/71/04/477317104.db2.gz OYBZZBKQDAOBMB-KRWDZBQOSA-N 1 3 332.492 2.640 10 0 EFAEHO C[C@H]1OCC[C@@H]1N(CCO)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000411669351 477318946 /nfs/dbraw/zinc/31/89/46/477318946.db2.gz ZIMFIYFCVICPKU-XLIONFOSSA-N 1 3 332.488 2.644 10 0 EFAEHO COCCN(Cc1ccc(C[NH+]2CCCCC2)cc1)[C@@H]1CCOC1 ZINC000411686430 477327594 /nfs/dbraw/zinc/32/75/94/477327594.db2.gz LDHHYFUVUQNPNR-HXUWFJFHSA-N 1 3 332.488 2.910 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N(C1CC1)[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000416847930 477334604 /nfs/dbraw/zinc/33/46/04/477334604.db2.gz WCBQYEAVIRCQAO-RTBURBONSA-N 1 3 344.503 2.605 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@@H]([NH2+]Cc3ccccc3OCCN(C)C)C[C@H]2C1 ZINC000424269043 477349426 /nfs/dbraw/zinc/34/94/26/477349426.db2.gz LWVLGYFIDYXBND-QGFMHUBQSA-N 1 3 332.488 2.920 10 0 EFAEHO C[C@@H]([NH3+])c1ccc(CNC(=O)NCc2ccc(CN(C)C)cc2)cc1 ZINC000416885567 477353432 /nfs/dbraw/zinc/35/34/32/477353432.db2.gz MBTMFFISQXTHIP-OAHLLOKOSA-N 1 3 340.471 2.767 10 0 EFAEHO C[NH2+][C@H]1CCCN(C(=O)NCc2ccccc2CN2CCCCC2)C1 ZINC000416901209 477362040 /nfs/dbraw/zinc/36/20/40/477362040.db2.gz KDWYESBSYQAZBU-IBGZPJMESA-N 1 3 344.503 2.566 10 0 EFAEHO C[NH2+]C[C@@H]1CCCN1C(=O)NCc1ccccc1CN1CCCCC1 ZINC000416910252 477365680 /nfs/dbraw/zinc/36/56/80/477365680.db2.gz ZCVCOWMMYHISAQ-IBGZPJMESA-N 1 3 344.503 2.566 10 0 EFAEHO C[N@@H+]1CC[C@H](NCCNC(=O)CCCc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000424334211 477373284 /nfs/dbraw/zinc/37/32/84/477373284.db2.gz WPQDACDBOWHNAL-UFYCRDLUSA-N 1 3 343.515 2.588 10 0 EFAEHO C[N@H+]1CC[C@H](NCCNC(=O)CCCc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000424334211 477373289 /nfs/dbraw/zinc/37/32/89/477373289.db2.gz WPQDACDBOWHNAL-UFYCRDLUSA-N 1 3 343.515 2.588 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@@H](NCc3ccncc3OCCC[NH+](C)C)C[C@H]2C1 ZINC000424352531 477377413 /nfs/dbraw/zinc/37/74/13/477377413.db2.gz QCXYOJFYASZEOD-QGFMHUBQSA-N 1 3 347.503 2.705 10 0 EFAEHO CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H](CN)c1ccc2ccccc2c1 ZINC000417011533 477420599 /nfs/dbraw/zinc/42/05/99/477420599.db2.gz SHLSFJQXSRFUBD-BEFAXECRSA-N 1 3 342.487 2.869 10 0 EFAEHO CC[C@@H](C)NC(=O)CCNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449093784 477436913 /nfs/dbraw/zinc/43/69/13/477436913.db2.gz YLAWCDSYOTXBFK-QZTJIDSGSA-N 1 3 345.531 2.976 10 0 EFAEHO CC[C@H](C)NC(=O)CCNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449093785 477436941 /nfs/dbraw/zinc/43/69/41/477436941.db2.gz YLAWCDSYOTXBFK-ROUUACIJSA-N 1 3 345.531 2.976 10 0 EFAEHO C[C@H](Cc1ccccc1)N1CCC([NH2+][C@H](C)C(=O)NC(C)(C)C)CC1 ZINC000449099417 477437930 /nfs/dbraw/zinc/43/79/30/477437930.db2.gz TUUMGHGVGGOIQL-IAGOWNOFSA-N 1 3 345.531 2.975 10 0 EFAEHO C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)NC[C@@H](N)c2ccccc2)C1 ZINC000417216036 477447731 /nfs/dbraw/zinc/44/77/31/477447731.db2.gz AVGZPPVHIFUHST-JFIYKMOQSA-N 1 3 346.519 2.742 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)NC[C@@H](N)c2ccccc2)C1 ZINC000417216039 477447821 /nfs/dbraw/zinc/44/78/21/477447821.db2.gz AVGZPPVHIFUHST-SOLBZPMBSA-N 1 3 346.519 2.742 10 0 EFAEHO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)NC[C@@H](N)c2ccccc2)C1 ZINC000417216039 477447827 /nfs/dbraw/zinc/44/78/27/477447827.db2.gz AVGZPPVHIFUHST-SOLBZPMBSA-N 1 3 346.519 2.742 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)N(C)[C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000418351443 477471110 /nfs/dbraw/zinc/47/11/10/477471110.db2.gz LTYQIYHTGFPYRQ-AYOQOUSVSA-N 1 3 346.519 2.934 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000418351443 477471116 /nfs/dbraw/zinc/47/11/16/477471116.db2.gz LTYQIYHTGFPYRQ-AYOQOUSVSA-N 1 3 346.519 2.934 10 0 EFAEHO COCCOC[C@H](C)NC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449175562 477471675 /nfs/dbraw/zinc/47/16/75/477471675.db2.gz OMXWOPAIHKNICU-ROUUACIJSA-N 1 3 334.504 2.723 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2CC[C@H](CO)CC2)CC1 ZINC000449189138 477477202 /nfs/dbraw/zinc/47/72/02/477477202.db2.gz OZIWUVLJLPCBKQ-KESTWPANSA-N 1 3 345.531 2.859 10 0 EFAEHO CC(C)[N@@H+]1CC[C@H](N(C)C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)C1 ZINC000458581792 477493023 /nfs/dbraw/zinc/49/30/23/477493023.db2.gz MHYUSPPMIGCSSC-GBESFXJTSA-N 1 3 344.503 2.556 10 0 EFAEHO CC(C)[N@H+]1CC[C@H](N(C)C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)C1 ZINC000458581792 477493027 /nfs/dbraw/zinc/49/30/27/477493027.db2.gz MHYUSPPMIGCSSC-GBESFXJTSA-N 1 3 344.503 2.556 10 0 EFAEHO C[C@@H]([NH2+]C(C)(C)CNC(=O)N1CCN2CCC1CC2)c1ccccc1 ZINC000376764346 477493142 /nfs/dbraw/zinc/49/31/42/477493142.db2.gz MTXHNECIDADPBK-MRXNPFEDSA-N 1 3 344.503 2.605 10 0 EFAEHO OC1CC[NH+](Cc2ccc(CN[C@H]3CCCc4n[nH]cc43)cc2)CC1 ZINC000367621549 477606650 /nfs/dbraw/zinc/60/66/50/477606650.db2.gz FBELVLJXOUVRRG-IBGZPJMESA-N 1 3 340.471 2.534 10 0 EFAEHO CCCNC(=O)c1cccc(C[NH2+][C@@H]2CCN(C)[C@H]3CCC[C@H]32)c1 ZINC000367639252 477615134 /nfs/dbraw/zinc/61/51/34/477615134.db2.gz UNPFCWCTZNJEST-OTWHNJEPSA-N 1 3 329.488 2.789 10 0 EFAEHO C[NH+](C)CCCOc1ccc(CN[C@@H]2CCCc3n[nH]cc32)cc1 ZINC000367737762 477664681 /nfs/dbraw/zinc/66/46/81/477664681.db2.gz POJBMJNAWWLEFK-GOSISDBHSA-N 1 3 328.460 2.907 10 0 EFAEHO CC(C)C[C@@H](C[NH+]1CCCC1)NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000458934354 477665477 /nfs/dbraw/zinc/66/54/77/477665477.db2.gz JZNVUVRJIIDCRD-FGTMMUONSA-N 1 3 338.540 2.621 10 0 EFAEHO CC(C)C[C@@H](C[NH+]1CCCC1)NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000458934353 477665564 /nfs/dbraw/zinc/66/55/64/477665564.db2.gz JZNVUVRJIIDCRD-BZSNNMDCSA-N 1 3 338.540 2.621 10 0 EFAEHO C[C@H]1C[N@H+](Cc2ccccc2OC2CC2)CC[C@H]1N1CCN(C)CC1 ZINC000450650630 477668564 /nfs/dbraw/zinc/66/85/64/477668564.db2.gz RJJAQBCLBXSPNT-FXAWDEMLSA-N 1 3 343.515 2.686 10 0 EFAEHO C[C@H]1C[N@@H+](Cc2ccccc2OC2CC2)CC[C@H]1N1CCN(C)CC1 ZINC000450650630 477668569 /nfs/dbraw/zinc/66/85/69/477668569.db2.gz RJJAQBCLBXSPNT-FXAWDEMLSA-N 1 3 343.515 2.686 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccnc(OCC(F)(F)F)c2)[C@@H]2CCC[C@@H]21 ZINC000367753353 477673442 /nfs/dbraw/zinc/67/34/42/477673442.db2.gz JVBNIEFVRFRYKP-KKUMJFAQSA-N 1 3 343.393 2.985 10 0 EFAEHO CN1CC[C@H]([NH2+]Cc2ccnc(OCC(F)(F)F)c2)[C@H]2CCC[C@H]21 ZINC000367753354 477673599 /nfs/dbraw/zinc/67/35/99/477673599.db2.gz JVBNIEFVRFRYKP-QLFBSQMISA-N 1 3 343.393 2.985 10 0 EFAEHO CCOc1ccccc1NC(=O)CCN1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000420390917 477743002 /nfs/dbraw/zinc/74/30/02/477743002.db2.gz HYXFLAXLDZNDNW-FUHWJXTLSA-N 1 3 345.487 2.878 10 0 EFAEHO CN(C(=O)NC[C@@H]1CCC[N@@H+]1C1CCCCC1)[C@@H]1CCN(C2CC2)C1 ZINC000438318249 477823157 /nfs/dbraw/zinc/82/31/57/477823157.db2.gz CYMRDYMCSSPCAG-RBUKOAKNSA-N 1 3 348.535 2.662 10 0 EFAEHO CN(C(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1)[C@@H]1CCN(C2CC2)C1 ZINC000438318249 477823159 /nfs/dbraw/zinc/82/31/59/477823159.db2.gz CYMRDYMCSSPCAG-RBUKOAKNSA-N 1 3 348.535 2.662 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)C1 ZINC000558652123 477906759 /nfs/dbraw/zinc/90/67/59/477906759.db2.gz AOHKOPBDWMDKCK-MSOLQXFVSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccccc2C[N@H+]2CCC[C@@H](C)C2)C1 ZINC000558652123 477906767 /nfs/dbraw/zinc/90/67/67/477906767.db2.gz AOHKOPBDWMDKCK-MSOLQXFVSA-N 1 3 343.515 2.877 10 0 EFAEHO O=C(NC1CC([NH+]2CCCCC2)C1)[C@H]1CCCCN1C1CCCC1 ZINC000451357359 477972315 /nfs/dbraw/zinc/97/23/15/477972315.db2.gz GMFFJFZFTVSDKN-NKELODKYSA-N 1 3 333.520 2.917 10 0 EFAEHO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000465873010 477992497 /nfs/dbraw/zinc/99/24/97/477992497.db2.gz KTKQMOUZYVGVQB-RCCFBDPRSA-N 1 3 338.540 2.765 10 0 EFAEHO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000465873010 477992503 /nfs/dbraw/zinc/99/25/03/477992503.db2.gz KTKQMOUZYVGVQB-RCCFBDPRSA-N 1 3 338.540 2.765 10 0 EFAEHO CC1(C)NC(=O)CC[C@H]1[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000494878998 478077409 /nfs/dbraw/zinc/07/74/09/478077409.db2.gz OBNARJNWXNAHNR-MRXNPFEDSA-N 1 3 335.517 2.607 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2CCC[C@H]2CCO)CC1 ZINC000495168262 478132264 /nfs/dbraw/zinc/13/22/64/478132264.db2.gz ATXJDMMCRPJXNV-AZUAARDMSA-N 1 3 345.531 2.859 10 0 EFAEHO C[C@@H]([NH2+]CCCN1CCC[C@@H](C(N)=O)C1)c1ccc(Cl)c(F)c1 ZINC000534329003 478145821 /nfs/dbraw/zinc/14/58/21/478145821.db2.gz SFPWZHYDYLNLGL-TZMCWYRMSA-N 1 3 341.858 2.717 10 0 EFAEHO C[C@H]([NH2+]CCCN1CCC[C@@H](C(N)=O)C1)c1ccc(Cl)c(F)c1 ZINC000534328988 478146285 /nfs/dbraw/zinc/14/62/85/478146285.db2.gz SFPWZHYDYLNLGL-GXTWGEPZSA-N 1 3 341.858 2.717 10 0 EFAEHO C[C@H](CNC(=O)NC1CCC(C[NH+](C)C)CC1)N1CCCC[C@@H]1C ZINC000440823891 478166221 /nfs/dbraw/zinc/16/62/21/478166221.db2.gz GXNZUOLNTOBMMW-KNXWPPODSA-N 1 3 338.540 2.669 10 0 EFAEHO N[C@@H](CC(=O)N1CC[C@H](c2ccc(F)cc2)[C@@H]([NH3+])C1)c1ccccc1 ZINC000519398288 478223156 /nfs/dbraw/zinc/22/31/56/478223156.db2.gz NJMZAOBGXRSYFD-QYZOEREBSA-N 1 3 341.430 2.559 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3C[C@H](C)CC[C@@H]3C)CC2)CC1 ZINC000570104847 478284692 /nfs/dbraw/zinc/28/46/92/478284692.db2.gz QFTPFMPPCRLPJR-SJORKVTESA-N 1 3 335.536 2.830 10 0 EFAEHO COc1ccccc1-c1ncc(CNCC2CC[NH+](C)CC2)cn1 ZINC000490888248 478398264 /nfs/dbraw/zinc/39/82/64/478398264.db2.gz SQIUENHQMWTEIL-UHFFFAOYSA-N 1 3 326.444 2.584 10 0 EFAEHO COc1ccccc1-c1ncc(CNCCC2CC[NH+](C)CC2)cn1 ZINC000490890458 478400182 /nfs/dbraw/zinc/40/01/82/478400182.db2.gz YYUNKBBHTMVNBB-UHFFFAOYSA-N 1 3 340.471 2.974 10 0 EFAEHO c1ccn2c(c1)nnc2C1CCN(Cc2ccc3c(c2)C[NH2+]CC3)CC1 ZINC000570638205 478404657 /nfs/dbraw/zinc/40/46/57/478404657.db2.gz OAFPKZGJQMYCRS-UHFFFAOYSA-N 1 3 347.466 2.755 10 0 EFAEHO CCN1CC[C@H]([N@H+](C)Cc2ccc(-n3cncn3)c(F)c2)[C@@H](C)C1 ZINC000539818238 478442235 /nfs/dbraw/zinc/44/22/35/478442235.db2.gz LLYVFRUEQMGIHG-YOEHRIQHSA-N 1 3 331.439 2.569 10 0 EFAEHO CCN1CC[C@H]([N@@H+](C)Cc2ccc(-n3cncn3)c(F)c2)[C@@H](C)C1 ZINC000539818238 478442240 /nfs/dbraw/zinc/44/22/40/478442240.db2.gz LLYVFRUEQMGIHG-YOEHRIQHSA-N 1 3 331.439 2.569 10 0 EFAEHO CCC[N@H+](CC)Cc1ccc(C(=O)N[C@@H]2CNCCC2(F)F)cc1 ZINC000563115689 478452714 /nfs/dbraw/zinc/45/27/14/478452714.db2.gz ZNHRKCYWSDDVHK-MRXNPFEDSA-N 1 3 339.430 2.646 10 0 EFAEHO CCC[N@@H+](CC)Cc1ccc(C(=O)N[C@@H]2CNCCC2(F)F)cc1 ZINC000563115689 478452724 /nfs/dbraw/zinc/45/27/24/478452724.db2.gz ZNHRKCYWSDDVHK-MRXNPFEDSA-N 1 3 339.430 2.646 10 0 EFAEHO CC[C@@H]1CCCC[N@@H+]1CCNC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000571266666 478554401 /nfs/dbraw/zinc/55/44/01/478554401.db2.gz FYRHQJYJGWDXEF-OAHLLOKOSA-N 1 3 348.466 2.857 10 0 EFAEHO CC[C@@H]1CCCC[N@H+]1CCNC(=O)Nc1ccc2c(c1F)CCNC2 ZINC000571266666 478554404 /nfs/dbraw/zinc/55/44/04/478554404.db2.gz FYRHQJYJGWDXEF-OAHLLOKOSA-N 1 3 348.466 2.857 10 0 EFAEHO C[C@@H](CCNC(=O)Nc1ccc2c(c1F)CCNC2)[NH+]1CCCCC1 ZINC000571267047 478554806 /nfs/dbraw/zinc/55/48/06/478554806.db2.gz QWPQPRWLGVNEDM-AWEZNQCLSA-N 1 3 348.466 2.857 10 0 EFAEHO O[C@H](CN[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21)[C@@H]1CCCO1 ZINC000527955189 478586309 /nfs/dbraw/zinc/58/63/09/478586309.db2.gz QHUBLNPYWWRWNL-QSUVIHHLSA-N 1 3 344.499 2.559 10 0 EFAEHO O[C@H](CN[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21)[C@@H]1CCCO1 ZINC000527955189 478586324 /nfs/dbraw/zinc/58/63/24/478586324.db2.gz QHUBLNPYWWRWNL-QSUVIHHLSA-N 1 3 344.499 2.559 10 0 EFAEHO Cc1ccc(OC[C@@H](O)C[NH2+]C2CCN(C3CCCC3)CC2)cc1 ZINC000571790563 478679488 /nfs/dbraw/zinc/67/94/88/478679488.db2.gz VDKMHXLUJHDJLI-IBGZPJMESA-N 1 3 332.488 2.731 10 0 EFAEHO CCCC[NH+]1CCC(NC(=O)NC[C@@H]2CCN2C2CCCC2)CC1 ZINC000528289060 478710450 /nfs/dbraw/zinc/71/04/50/478710450.db2.gz PNDBXHLCNISLMH-SFHVURJKSA-N 1 3 336.524 2.567 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)C1 ZINC000582974003 478734717 /nfs/dbraw/zinc/73/47/17/478734717.db2.gz PQOKVVGKMUYKLQ-IIDMSEBBSA-N 1 3 335.517 2.589 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)C1 ZINC000582974003 478734723 /nfs/dbraw/zinc/73/47/23/478734723.db2.gz PQOKVVGKMUYKLQ-IIDMSEBBSA-N 1 3 335.517 2.589 10 0 EFAEHO C[C@H](CNC(=O)CCN(C)c1cc[nH+]cc1)N(C)Cc1ccccc1 ZINC000543713040 478770826 /nfs/dbraw/zinc/77/08/26/478770826.db2.gz ZXCVYZAIZWUSKC-QGZVFWFLSA-N 1 3 340.471 2.545 10 0 EFAEHO COCCOC[C@H](C)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499255722 478776036 /nfs/dbraw/zinc/77/60/36/478776036.db2.gz ZCMPNZCQNJEBAR-FFGOWVMKSA-N 1 3 332.488 2.823 10 0 EFAEHO COCCOC[C@H](C)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499255722 478776041 /nfs/dbraw/zinc/77/60/41/478776041.db2.gz ZCMPNZCQNJEBAR-FFGOWVMKSA-N 1 3 332.488 2.823 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)Nc1ccc2c(c1)CNCC2 ZINC000583251487 478803010 /nfs/dbraw/zinc/80/30/10/478803010.db2.gz IFOQVEKDNOJCEF-GASCZTMLSA-N 1 3 330.476 2.717 10 0 EFAEHO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)Nc1ccc2c(c1)CNCC2 ZINC000583251487 478803016 /nfs/dbraw/zinc/80/30/16/478803016.db2.gz IFOQVEKDNOJCEF-GASCZTMLSA-N 1 3 330.476 2.717 10 0 EFAEHO C[C@H]1CCC[C@H](C)[NH+]1CCNC(=O)Nc1ccc2c(c1)CNCC2 ZINC000583251488 478803441 /nfs/dbraw/zinc/80/34/41/478803441.db2.gz IFOQVEKDNOJCEF-GJZGRUSLSA-N 1 3 330.476 2.717 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NC(C)(C)C3CCC3)CC2)CC1 ZINC000572496165 478852998 /nfs/dbraw/zinc/85/29/98/478852998.db2.gz DHTTVDJDOCDXFU-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[C@H]1CCCC[N@@H+]1CCNC(=O)N1CCc2ccccc2[C@@H]1CN ZINC000564937612 478864648 /nfs/dbraw/zinc/86/46/48/478864648.db2.gz LWWGIQHDXVJJMS-HKUYNNGSSA-N 1 3 344.503 2.519 10 0 EFAEHO CC[C@H]1CCCC[N@H+]1CCNC(=O)N1CCc2ccccc2[C@@H]1CN ZINC000564937612 478864656 /nfs/dbraw/zinc/86/46/56/478864656.db2.gz LWWGIQHDXVJJMS-HKUYNNGSSA-N 1 3 344.503 2.519 10 0 EFAEHO CCOCCC[N@@H+]1CC[C@@H](N[C@@H]2C[C@@H](OCC)[C@H]2SC)[C@H](C)C1 ZINC000592393824 478881733 /nfs/dbraw/zinc/88/17/33/478881733.db2.gz DCPOPYIJJIHYDT-ZKXLYKBJSA-N 1 3 344.565 2.622 10 0 EFAEHO CCOCCC[N@H+]1CC[C@@H](N[C@@H]2C[C@@H](OCC)[C@H]2SC)[C@H](C)C1 ZINC000592393824 478881741 /nfs/dbraw/zinc/88/17/41/478881741.db2.gz DCPOPYIJJIHYDT-ZKXLYKBJSA-N 1 3 344.565 2.622 10 0 EFAEHO CC(C)[NH2+]CCCNC(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000583614563 478890360 /nfs/dbraw/zinc/89/03/60/478890360.db2.gz RNDOUNKASCYFDR-FQEVSTJZSA-N 1 3 346.519 2.728 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)N3CCC[C@@](C)(F)C3)CC2)CC1 ZINC000565198887 478947992 /nfs/dbraw/zinc/94/79/92/478947992.db2.gz HTAASIUJNDNERZ-LJQANCHMSA-N 1 3 339.499 2.533 10 0 EFAEHO CCN(C(=O)N[C@@H](C)C[NH+](C)C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000512427030 478997367 /nfs/dbraw/zinc/99/73/67/478997367.db2.gz PMIBJIXSMOGOAC-LNLFQRSKSA-N 1 3 346.519 2.804 10 0 EFAEHO C[N@H+](CCNC(=O)Nc1cccc2c1CCNC2)C1CCCCC1 ZINC000565646930 479053525 /nfs/dbraw/zinc/05/35/25/479053525.db2.gz JVMBYJFDAWSXED-UHFFFAOYSA-N 1 3 330.476 2.718 10 0 EFAEHO C[N@@H+](CCNC(=O)Nc1cccc2c1CCNC2)C1CCCCC1 ZINC000565646930 479053531 /nfs/dbraw/zinc/05/35/31/479053531.db2.gz JVMBYJFDAWSXED-UHFFFAOYSA-N 1 3 330.476 2.718 10 0 EFAEHO Cc1c[nH+]ccc1N1CCC(C(=O)N(C)[C@@H]2CCN(C(C)C)C2)CC1 ZINC000573540179 479087739 /nfs/dbraw/zinc/08/77/39/479087739.db2.gz ZIZFRPWXUDWBBG-GOSISDBHSA-N 1 3 344.503 2.548 10 0 EFAEHO CN1CC[C@H](NC(=O)NCC2([NH3+])CCCCCC2)[C@H]1c1ccccc1 ZINC000515047583 479109866 /nfs/dbraw/zinc/10/98/66/479109866.db2.gz IGVRPIIBJQTFIV-ZWKOTPCHSA-N 1 3 344.503 2.783 10 0 EFAEHO CSC[C@H](O)C[NH2+]C[C@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000596064701 479116894 /nfs/dbraw/zinc/11/68/94/479116894.db2.gz HSMAMHCKMQYIPH-ZWKOTPCHSA-N 1 3 334.529 2.602 10 0 EFAEHO CSC[C@H](O)CNC[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000596064701 479116899 /nfs/dbraw/zinc/11/68/99/479116899.db2.gz HSMAMHCKMQYIPH-ZWKOTPCHSA-N 1 3 334.529 2.602 10 0 EFAEHO CSC[C@H](O)CNC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000596064701 479116901 /nfs/dbraw/zinc/11/69/01/479116901.db2.gz HSMAMHCKMQYIPH-ZWKOTPCHSA-N 1 3 334.529 2.602 10 0 EFAEHO O=C(NCCN1CCC2(CCCCC2)CC1)N[C@H]1CC[NH2+]C12CCC2 ZINC000529331426 479128429 /nfs/dbraw/zinc/12/84/29/479128429.db2.gz RJYDYCBRHPUDEN-KRWDZBQOSA-N 1 3 348.535 2.617 10 0 EFAEHO Cc1c(CN(C)CCCCC[N@@H+](C)Cc2cnn(C)c2C)cnn1C ZINC000573889254 479164222 /nfs/dbraw/zinc/16/42/22/479164222.db2.gz RLXSHSIHBDUISW-UHFFFAOYSA-N 1 3 346.523 2.505 10 0 EFAEHO CC(C)(C)C(=O)NC[C@H]1CCCN(Cc2ccc3c(c2)C[NH2+]CC3)C1 ZINC000584783233 479241383 /nfs/dbraw/zinc/24/13/83/479241383.db2.gz BTVODYVOBLYGBW-QGZVFWFLSA-N 1 3 343.515 2.707 10 0 EFAEHO CC(C)(C)C(=O)NC[C@@H]1CCCN(Cc2ccc3c(c2)C[NH2+]CC3)C1 ZINC000584783232 479241780 /nfs/dbraw/zinc/24/17/80/479241780.db2.gz BTVODYVOBLYGBW-KRWDZBQOSA-N 1 3 343.515 2.707 10 0 EFAEHO CC(C)c1ccc([C@H](N)CNC(=O)N2CC[C@@]3(C2)CCC[NH2+]C3)cc1 ZINC000557219667 479267575 /nfs/dbraw/zinc/26/75/75/479267575.db2.gz VNGSXIAUTRMYGS-QUCCMNQESA-N 1 3 344.503 2.595 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2cccc(C[NH+]3CCC(C)CC3)c2)C1 ZINC000557588292 479291246 /nfs/dbraw/zinc/29/12/46/479291246.db2.gz AJAQKSASDLHTAK-SFHVURJKSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)C1 ZINC000557647435 479298018 /nfs/dbraw/zinc/29/80/18/479298018.db2.gz ZKQWZUYAKVNGLI-MSOLQXFVSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)C1 ZINC000557647435 479298024 /nfs/dbraw/zinc/29/80/24/479298024.db2.gz ZKQWZUYAKVNGLI-MSOLQXFVSA-N 1 3 335.536 2.831 10 0 EFAEHO NC[C@H]1CCC[C@H]1[NH2+]CCc1ccc(I)cc1 ZINC000596652799 479373403 /nfs/dbraw/zinc/37/34/03/479373403.db2.gz HZSKNVMQORQCEB-TZMCWYRMSA-N 1 3 344.240 2.551 10 0 EFAEHO N[C@@H]1CCC[C@@H]([NH2+]CCc2ccc(I)cc2)C1 ZINC000596653484 479373709 /nfs/dbraw/zinc/37/37/09/479373709.db2.gz KYRFOAFJXIMDTM-ZIAGYGMSSA-N 1 3 344.240 2.693 10 0 EFAEHO [NH3+][C@@H]1CCC[C@@H](NCCc2ccc(I)cc2)C1 ZINC000596653484 479373716 /nfs/dbraw/zinc/37/37/16/479373716.db2.gz KYRFOAFJXIMDTM-ZIAGYGMSSA-N 1 3 344.240 2.693 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@@H]1CCC[N@H+](C)C1)c1ccsc1 ZINC000618555340 479490057 /nfs/dbraw/zinc/49/00/57/479490057.db2.gz UIYHUPKIISGLEU-HZPDHXFCSA-N 1 3 338.521 2.524 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@@H]1CCC[N@@H+](C)C1)c1ccsc1 ZINC000618555340 479490062 /nfs/dbraw/zinc/49/00/62/479490062.db2.gz UIYHUPKIISGLEU-HZPDHXFCSA-N 1 3 338.521 2.524 10 0 EFAEHO COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000600157499 479550506 /nfs/dbraw/zinc/55/05/06/479550506.db2.gz XJCJERLCBWVDKH-CGTJXYLNSA-N 1 3 332.488 2.869 10 0 EFAEHO COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000600157499 479550510 /nfs/dbraw/zinc/55/05/10/479550510.db2.gz XJCJERLCBWVDKH-CGTJXYLNSA-N 1 3 332.488 2.869 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)CC[N@@H+]1C ZINC000633218449 479723556 /nfs/dbraw/zinc/72/35/56/479723556.db2.gz PMSWQXSNWPEYSZ-RCCFBDPRSA-N 1 3 349.544 2.858 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)CC[N@H+]1C ZINC000633218449 479723561 /nfs/dbraw/zinc/72/35/61/479723561.db2.gz PMSWQXSNWPEYSZ-RCCFBDPRSA-N 1 3 349.544 2.858 10 0 EFAEHO CC(C)C[C@@H](C[NH+](C)C)NC(=O)N1CCN(CCC(C)(C)C)CC1 ZINC000615689626 479736116 /nfs/dbraw/zinc/73/61/16/479736116.db2.gz MLSYCNXWHPANSO-KRWDZBQOSA-N 1 3 340.556 2.726 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+]2CC[C@H](C)[C@H](CO)C2)CC1 ZINC000621738055 479776451 /nfs/dbraw/zinc/77/64/51/479776451.db2.gz YGLMSYPJJGJWQD-ICSRJNTNSA-N 1 3 345.531 2.669 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+]2CC[C@H](C)[C@H](CO)C2)CC1 ZINC000621738055 479776456 /nfs/dbraw/zinc/77/64/56/479776456.db2.gz YGLMSYPJJGJWQD-ICSRJNTNSA-N 1 3 345.531 2.669 10 0 EFAEHO CC[C@H]1CCCC[C@@H]1C[NH2+]CC1(N2CCOCC2)CCN(C)CC1 ZINC000628309954 479851684 /nfs/dbraw/zinc/85/16/84/479851684.db2.gz DKMRVJVZYFDFFI-RBUKOAKNSA-N 1 3 337.552 2.589 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)CC[N@@H+]1C ZINC000631655137 480200964 /nfs/dbraw/zinc/20/09/64/480200964.db2.gz ANSGCNLJJJVJEF-BTHPGYMESA-N 1 3 343.515 2.886 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)CC[N@H+]1C ZINC000631655137 480200970 /nfs/dbraw/zinc/20/09/70/480200970.db2.gz ANSGCNLJJJVJEF-BTHPGYMESA-N 1 3 343.515 2.886 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)CC[N@@H+]1C ZINC000631655139 480201768 /nfs/dbraw/zinc/20/17/68/480201768.db2.gz ANSGCNLJJJVJEF-OJAHFUOMSA-N 1 3 343.515 2.886 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)CC[N@H+]1C ZINC000631655139 480201774 /nfs/dbraw/zinc/20/17/74/480201774.db2.gz ANSGCNLJJJVJEF-OJAHFUOMSA-N 1 3 343.515 2.886 10 0 EFAEHO CN(C)[C@H](CNC(=O)C[N@@H+]1CCCC2(CC2)CC1)c1ccccc1 ZINC000626115086 480207720 /nfs/dbraw/zinc/20/77/20/480207720.db2.gz FTLGHTRYTMSTFA-GOSISDBHSA-N 1 3 329.488 2.672 10 0 EFAEHO CN(C)[C@H](CNC(=O)C[N@H+]1CCCC2(CC2)CC1)c1ccccc1 ZINC000626115086 480207726 /nfs/dbraw/zinc/20/77/26/480207726.db2.gz FTLGHTRYTMSTFA-GOSISDBHSA-N 1 3 329.488 2.672 10 0 EFAEHO C[C@H](Cc1ccccc1)N1CCC([NH2+][C@@H](C)[C@H](O)C(F)(F)F)CC1 ZINC000631716100 480235591 /nfs/dbraw/zinc/23/55/91/480235591.db2.gz HONGLZQYNSSRSK-KEYYUXOJSA-N 1 3 344.421 2.983 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@H](c2cccs2)N2CCOCC2)CC1(C)C ZINC000623337616 480238400 /nfs/dbraw/zinc/23/84/00/480238400.db2.gz QIVFJGINHGDKKY-JKSUJKDBSA-N 1 3 337.533 2.584 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cccc(C(F)F)c1 ZINC000617505792 480246459 /nfs/dbraw/zinc/24/64/59/480246459.db2.gz QFCYRSYGLBFVNA-ZDUSSCGKSA-N 1 3 327.419 2.626 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cccc(C(F)F)c1 ZINC000617505792 480246467 /nfs/dbraw/zinc/24/64/67/480246467.db2.gz QFCYRSYGLBFVNA-ZDUSSCGKSA-N 1 3 327.419 2.626 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccccc1C(F)(F)F ZINC000617504343 480246541 /nfs/dbraw/zinc/24/65/41/480246541.db2.gz QLVNAPNKFKOCAG-ZDUSSCGKSA-N 1 3 345.409 2.707 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccccc1C(F)(F)F ZINC000617504343 480246547 /nfs/dbraw/zinc/24/65/47/480246547.db2.gz QLVNAPNKFKOCAG-ZDUSSCGKSA-N 1 3 345.409 2.707 10 0 EFAEHO CCc1ccc([C@H](C)C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000617505664 480246663 /nfs/dbraw/zinc/24/66/63/480246663.db2.gz LXWYCABHOCEVRE-IRXDYDNUSA-N 1 3 333.520 2.741 10 0 EFAEHO CCc1ccc([C@H](C)C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000617505664 480246670 /nfs/dbraw/zinc/24/66/70/480246670.db2.gz LXWYCABHOCEVRE-IRXDYDNUSA-N 1 3 333.520 2.741 10 0 EFAEHO Cc1cccc2cc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)oc21 ZINC000617504957 480246902 /nfs/dbraw/zinc/24/69/02/480246902.db2.gz QVQQQYYHAJDCJP-HNNXBMFYSA-N 1 3 331.460 2.743 10 0 EFAEHO Cc1cccc2cc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)oc21 ZINC000617504957 480246907 /nfs/dbraw/zinc/24/69/07/480246907.db2.gz QVQQQYYHAJDCJP-HNNXBMFYSA-N 1 3 331.460 2.743 10 0 EFAEHO Cc1cc(C)cc(C2(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)CC2)c1 ZINC000617504772 480247016 /nfs/dbraw/zinc/24/70/16/480247016.db2.gz JVFMOXWPUONJQI-SFHVURJKSA-N 1 3 345.531 2.723 10 0 EFAEHO Cc1cc(C)cc(C2(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)CC2)c1 ZINC000617504772 480247021 /nfs/dbraw/zinc/24/70/21/480247021.db2.gz JVFMOXWPUONJQI-SFHVURJKSA-N 1 3 345.531 2.723 10 0 EFAEHO Cc1ccc(C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c(C(C)C)n1 ZINC000617503386 480247701 /nfs/dbraw/zinc/24/77/01/480247701.db2.gz HEKQOYAPXUFGFK-INIZCTEOSA-N 1 3 334.508 2.515 10 0 EFAEHO Cc1ccc(C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c(C(C)C)n1 ZINC000617503386 480247706 /nfs/dbraw/zinc/24/77/06/480247706.db2.gz HEKQOYAPXUFGFK-INIZCTEOSA-N 1 3 334.508 2.515 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Cc1csc2ccccc12 ZINC000617504639 480247916 /nfs/dbraw/zinc/24/79/16/480247916.db2.gz CPNGQBDWCOHYNZ-HNNXBMFYSA-N 1 3 347.528 2.832 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Cc1csc2ccccc12 ZINC000617504639 480247921 /nfs/dbraw/zinc/24/79/21/480247921.db2.gz CPNGQBDWCOHYNZ-HNNXBMFYSA-N 1 3 347.528 2.832 10 0 EFAEHO CN1CC[C@@H]([NH2+]Cc2cccc(CN3CCCC3=O)c2)CC1(C)C ZINC000623357038 480248171 /nfs/dbraw/zinc/24/81/71/480248171.db2.gz WVUIPTNTCNSZSU-GOSISDBHSA-N 1 3 329.488 2.771 10 0 EFAEHO C[C@@H](CN[C@@H]1CC[N@H+](C)C(C)(C)C1)N1CCN(c2ccccc2)CC1 ZINC000623357587 480248253 /nfs/dbraw/zinc/24/82/53/480248253.db2.gz WWDZYFCGYKLGND-RBUKOAKNSA-N 1 3 344.547 2.660 10 0 EFAEHO C[C@@H](CN[C@@H]1CC[N@@H+](C)C(C)(C)C1)N1CCN(c2ccccc2)CC1 ZINC000623357587 480248255 /nfs/dbraw/zinc/24/82/55/480248255.db2.gz WWDZYFCGYKLGND-RBUKOAKNSA-N 1 3 344.547 2.660 10 0 EFAEHO CN1CC[C@@H]([NH2+]Cc2ccnc(OCC(F)(F)F)c2)CC1(C)C ZINC000623357202 480248504 /nfs/dbraw/zinc/24/85/04/480248504.db2.gz CQFBSXXOSCYZES-CYBMUJFWSA-N 1 3 331.382 2.985 10 0 EFAEHO Cc1ccc(/C=C/CC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)cc1 ZINC000617505924 480249206 /nfs/dbraw/zinc/24/92/06/480249206.db2.gz VPEDJZFOCGDBID-IWHGQQBYSA-N 1 3 331.504 2.787 10 0 EFAEHO Cc1ccc(/C=C/CC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)cc1 ZINC000617505924 480249210 /nfs/dbraw/zinc/24/92/10/480249210.db2.gz VPEDJZFOCGDBID-IWHGQQBYSA-N 1 3 331.504 2.787 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)C/C=C/c1cccc(F)c1 ZINC000617505922 480249548 /nfs/dbraw/zinc/24/95/48/480249548.db2.gz VNRFMEWPDGLYQY-FSNWXROXSA-N 1 3 335.467 2.617 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)C/C=C/c1cccc(F)c1 ZINC000617505922 480249553 /nfs/dbraw/zinc/24/95/53/480249553.db2.gz VNRFMEWPDGLYQY-FSNWXROXSA-N 1 3 335.467 2.617 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1cccc(C2CCC2)c1 ZINC000617507252 480249645 /nfs/dbraw/zinc/24/96/45/480249645.db2.gz OEPBHUHDPAVBGQ-INIZCTEOSA-N 1 3 331.504 2.956 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1cccc(C2CCC2)c1 ZINC000617507252 480249651 /nfs/dbraw/zinc/24/96/51/480249651.db2.gz OEPBHUHDPAVBGQ-INIZCTEOSA-N 1 3 331.504 2.956 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)c1ccc(F)c(Cl)c1F ZINC000617506265 480250842 /nfs/dbraw/zinc/25/08/42/480250842.db2.gz HUSJOWJVENZTLO-NSHDSACASA-N 1 3 347.837 2.620 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)c1ccc(F)c(Cl)c1F ZINC000617506265 480250847 /nfs/dbraw/zinc/25/08/47/480250847.db2.gz HUSJOWJVENZTLO-NSHDSACASA-N 1 3 347.837 2.620 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@H](c2cccc(F)c2)N2CCOCC2)CC1(C)C ZINC000623379298 480256579 /nfs/dbraw/zinc/25/65/79/480256579.db2.gz IIIIHVGVPLLMNR-RBUKOAKNSA-N 1 3 349.494 2.661 10 0 EFAEHO C[C@H](N[C@@H]1CC[N@H+](C)C(C)(C)C1)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000623429229 480280341 /nfs/dbraw/zinc/28/03/41/480280341.db2.gz UBQXPIWFIOQQRL-DFQSSKMNSA-N 1 3 345.531 2.738 10 0 EFAEHO C[C@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000623429229 480280345 /nfs/dbraw/zinc/28/03/45/480280345.db2.gz UBQXPIWFIOQQRL-DFQSSKMNSA-N 1 3 345.531 2.738 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@@H](N[C@H]3CC[N@H+](C)C(C)(C)C3)C2)c1 ZINC000623439743 480285413 /nfs/dbraw/zinc/28/54/13/480285413.db2.gz WPLFCHOPPKVZSR-JKSUJKDBSA-N 1 3 347.503 2.745 10 0 EFAEHO COc1cc(OC)cc(N2CC[C@@H](N[C@H]3CC[N@@H+](C)C(C)(C)C3)C2)c1 ZINC000623439743 480285416 /nfs/dbraw/zinc/28/54/16/480285416.db2.gz WPLFCHOPPKVZSR-JKSUJKDBSA-N 1 3 347.503 2.745 10 0 EFAEHO CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]CC2(N)CCOCC2)cc1 ZINC000629519486 480291749 /nfs/dbraw/zinc/29/17/49/480291749.db2.gz AITDHLSASZDNIK-OAHLLOKOSA-N 1 3 348.491 2.719 10 0 EFAEHO Cc1ccc(-c2noc(CCCN3C[C@@H](C[NH3+])[C@H](C)C3)n2)cc1F ZINC000631840599 480295370 /nfs/dbraw/zinc/29/53/70/480295370.db2.gz CWWPSYCSPGNOAV-UKRRQHHQSA-N 1 3 332.423 2.643 10 0 EFAEHO C[NH2+]CCOCCN[C@@H](c1ccc(Br)cc1F)C1CC1 ZINC000629530597 480295663 /nfs/dbraw/zinc/29/56/63/480295663.db2.gz KXYMJJBVDZXUIP-OAHLLOKOSA-N 1 3 345.256 2.865 10 0 EFAEHO C[NH2+]CCOCCN[C@@H]1CCSc2ccc(Br)cc21 ZINC000629529043 480295802 /nfs/dbraw/zinc/29/58/02/480295802.db2.gz QHDYUDFWRLVMEV-CYBMUJFWSA-N 1 3 345.306 2.812 10 0 EFAEHO CN1CC[C@@H]([NH2+][C@@H](CO)c2ccc(Br)cc2)CC1(C)C ZINC000623479229 480303192 /nfs/dbraw/zinc/30/31/92/480303192.db2.gz LFXLEWCUFZNRDJ-CABCVRRESA-N 1 3 341.293 2.945 10 0 EFAEHO C[NH2+]C[C@](C)(O)CN1C[C@H](c2ccc(Br)cc2)C[C@H]1C ZINC000629581599 480315482 /nfs/dbraw/zinc/31/54/82/480315482.db2.gz DMKKHXATBOCEET-XPKDYRNWSA-N 1 3 341.293 2.597 10 0 EFAEHO CNC[C@](C)(O)C[N@@H+]1C[C@H](c2ccc(Br)cc2)C[C@H]1C ZINC000629581599 480315476 /nfs/dbraw/zinc/31/54/76/480315476.db2.gz DMKKHXATBOCEET-XPKDYRNWSA-N 1 3 341.293 2.597 10 0 EFAEHO CNC[C@](C)(O)C[N@H+]1C[C@H](c2ccc(Br)cc2)C[C@H]1C ZINC000629581599 480315480 /nfs/dbraw/zinc/31/54/80/480315480.db2.gz DMKKHXATBOCEET-XPKDYRNWSA-N 1 3 341.293 2.597 10 0 EFAEHO C[N@@H+]1CC[C@@H](NC[C@@H](CO)Cc2ccc(F)c(F)c2)CC1(C)C ZINC000623506157 480317816 /nfs/dbraw/zinc/31/78/16/480317816.db2.gz FBCYQGKTDZTVJV-LSDHHAIUSA-N 1 3 326.431 2.578 10 0 EFAEHO C[N@H+]1CC[C@@H](NC[C@@H](CO)Cc2ccc(F)c(F)c2)CC1(C)C ZINC000623506157 480317820 /nfs/dbraw/zinc/31/78/20/480317820.db2.gz FBCYQGKTDZTVJV-LSDHHAIUSA-N 1 3 326.431 2.578 10 0 EFAEHO CN1CC[C@H]([NH2+]C[C@H]2CN(Cc3ccccc3)CCCO2)CC1(C)C ZINC000623507254 480319488 /nfs/dbraw/zinc/31/94/88/480319488.db2.gz AQQAWNYDMSFDEJ-PMACEKPBSA-N 1 3 345.531 2.740 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)CC1(C)C ZINC000623525126 480327871 /nfs/dbraw/zinc/32/78/71/480327871.db2.gz XMXWBMFIQOSMHS-UONOGXRCSA-N 1 3 349.441 2.782 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)CC1(C)C ZINC000623525126 480327878 /nfs/dbraw/zinc/32/78/78/480327878.db2.gz XMXWBMFIQOSMHS-UONOGXRCSA-N 1 3 349.441 2.782 10 0 EFAEHO C[N@@H+]1CC[C@H](N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)CC1(C)C ZINC000623542413 480333964 /nfs/dbraw/zinc/33/39/64/480333964.db2.gz ZOELVBSWHPDESU-VVLHAWIVSA-N 1 3 334.508 2.843 10 0 EFAEHO C[N@H+]1CC[C@H](N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)CC1(C)C ZINC000623542413 480333971 /nfs/dbraw/zinc/33/39/71/480333971.db2.gz ZOELVBSWHPDESU-VVLHAWIVSA-N 1 3 334.508 2.843 10 0 EFAEHO C[NH2+]CCOCCN(C)Cc1ccc(Oc2cccnc2)c(C)c1 ZINC000629652619 480344950 /nfs/dbraw/zinc/34/49/50/480344950.db2.gz ABWHRNFFPIDNQU-UHFFFAOYSA-N 1 3 329.444 2.850 10 0 EFAEHO CN(c1ccccc1CN[C@H]1CO[C@H](C2CC2)C1)C1CC[NH+](C)CC1 ZINC000623752785 480437871 /nfs/dbraw/zinc/43/78/71/480437871.db2.gz LDWDJTPJZZVMIL-NQIIRXRSSA-N 1 3 343.515 2.874 10 0 EFAEHO C[C@H](c1ccccc1)[NH+]1CCC(NC[C@H](O)C[C@@](C)(O)C2CC2)CC1 ZINC000634704505 480443245 /nfs/dbraw/zinc/44/32/45/480443245.db2.gz LPNHGIYPWCCVJE-MAODMQOUSA-N 1 3 346.515 2.714 10 0 EFAEHO Cc1ccc(Br)cc1[C@H](C)[NH2+]C[C@@H](O)CN1CCCC1 ZINC000623871336 480495798 /nfs/dbraw/zinc/49/57/98/480495798.db2.gz BNOSQHMWZKQCJE-DZGCQCFKSA-N 1 3 341.293 2.865 10 0 EFAEHO Cc1ccc(Br)cc1[C@@H](C)[NH2+]C[C@@H](O)CN1CCCC1 ZINC000623871338 480496433 /nfs/dbraw/zinc/49/64/33/480496433.db2.gz BNOSQHMWZKQCJE-UKRRQHHQSA-N 1 3 341.293 2.865 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(CN2CCC(O)CC2)cc1)[C@@H]1CCCCO1 ZINC000623888369 480503947 /nfs/dbraw/zinc/50/39/47/480503947.db2.gz DHGOVYWZESYCDJ-UZLBHIALSA-N 1 3 332.488 2.691 10 0 EFAEHO C[N@@H+]1CC[C@H](Nc2ccccc2CN2CCC(O)CC2)CC1(C)C ZINC000623938578 480530909 /nfs/dbraw/zinc/53/09/09/480530909.db2.gz VMUOQZBYXBUSDD-KRWDZBQOSA-N 1 3 331.504 2.928 10 0 EFAEHO C[N@H+]1CC[C@H](Nc2ccccc2CN2CCC(O)CC2)CC1(C)C ZINC000623938578 480530917 /nfs/dbraw/zinc/53/09/17/480530917.db2.gz VMUOQZBYXBUSDD-KRWDZBQOSA-N 1 3 331.504 2.928 10 0 EFAEHO C[C@H]([NH2+]CC1(O)CCN(Cc2ccccc2)CC1)[C@H]1CCCCO1 ZINC000624000613 480559883 /nfs/dbraw/zinc/55/98/83/480559883.db2.gz HIPCJNLLIFIIHN-PKOBYXMFSA-N 1 3 332.488 2.561 10 0 EFAEHO CCN(CC)[C@@H](CNC(=O)N[C@@H]1CC[NH2+]C12CCC2)c1ccccc1 ZINC000626921842 480581691 /nfs/dbraw/zinc/58/16/91/480581691.db2.gz KHGQNZLNKYRIMJ-ZWKOTPCHSA-N 1 3 344.503 2.653 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@@H]1CC[C@H](C)[NH2+]C1)c1ccsc1 ZINC000626934387 480587423 /nfs/dbraw/zinc/58/74/23/480587423.db2.gz YEOUFWRWKUZLLM-NUEKZKHPSA-N 1 3 338.521 2.571 10 0 EFAEHO CC[C@@H]1[NH2+]CC[C@H]1NC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000626956873 480597361 /nfs/dbraw/zinc/59/73/61/480597361.db2.gz IASJBYPPAJGXNN-IPMKNSEASA-N 1 3 344.503 2.572 10 0 EFAEHO C[C@@H](NC(C)(C)CNC(=O)N[C@@H]1CC[NH2+]C12CCC2)c1ccccc1 ZINC000626978944 480607536 /nfs/dbraw/zinc/60/75/36/480607536.db2.gz ZQSUHPATMQCFKS-NVXWUHKLSA-N 1 3 344.503 2.700 10 0 EFAEHO C[C@@H](NC(C)(C)CNC(=O)N[C@H]1CC[NH2+]C12CCC2)c1ccccc1 ZINC000626978946 480608622 /nfs/dbraw/zinc/60/86/22/480608622.db2.gz ZQSUHPATMQCFKS-WBVHZDCISA-N 1 3 344.503 2.700 10 0 EFAEHO Brc1cccc2c1C[C@@H]1[C@@H](NC3C[C@H]4CC[C@@H](C3)[NH2+]4)[C@H]21 ZINC000635003211 480683139 /nfs/dbraw/zinc/68/31/39/480683139.db2.gz GZFCCOKKMVWZOS-SDZLKZLNSA-N 1 3 333.273 2.960 10 0 EFAEHO COc1cc2nccc(N3CCC[C@H]4C[NH2+]CC[C@H]43)c2cc1OC ZINC000630386139 480693948 /nfs/dbraw/zinc/69/39/48/480693948.db2.gz WLPCTGXXXBZGCG-XJKSGUPXSA-N 1 3 327.428 2.830 10 0 EFAEHO CC(C)(C(=O)N1CCC[C@H]([C@H]2CCC[NH2+]2)C1)[C@@H](N)c1ccccc1 ZINC000645108325 480696242 /nfs/dbraw/zinc/69/62/42/480696242.db2.gz WUSDBFJYNSXSAC-KSZLIROESA-N 1 3 329.488 2.703 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)NC[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC000624323932 480708183 /nfs/dbraw/zinc/70/81/83/480708183.db2.gz DBSDJHICVCIAHW-DLBZAZTESA-N 1 3 336.524 2.565 10 0 EFAEHO CC(C)(C)N1CC[C@@H]1CNC(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000624323932 480708187 /nfs/dbraw/zinc/70/81/87/480708187.db2.gz DBSDJHICVCIAHW-DLBZAZTESA-N 1 3 336.524 2.565 10 0 EFAEHO C[C@H]([NH2+][C@H]1CCN(C2CCC2)C1=O)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000624343944 480718693 /nfs/dbraw/zinc/71/86/93/480718693.db2.gz DAWIWQQOVMMZAM-HQRMLTQVSA-N 1 3 341.499 2.640 10 0 EFAEHO CN(C)CCOc1cccc(NC(=O)N[C@H]2CC[NH2+]CC(C)(C)C2)c1 ZINC000632897210 480783983 /nfs/dbraw/zinc/78/39/83/480783983.db2.gz HGRYLYKZKAJCPU-INIZCTEOSA-N 1 3 348.491 2.527 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NCCN2[C@@H](C)CCC[C@@H]2C)CC1 ZINC000632990424 480836646 /nfs/dbraw/zinc/83/66/46/480836646.db2.gz RTEACXJGEURINF-IRXDYDNUSA-N 1 3 338.540 2.765 10 0 EFAEHO CCC1([NH+](C)C)CCN(C(=O)NC[C@H](C)N2CCC[C@H](C)C2)CC1 ZINC000632995880 480841139 /nfs/dbraw/zinc/84/11/39/480841139.db2.gz HWSYFKWHBCSYMJ-IRXDYDNUSA-N 1 3 338.540 2.623 10 0 EFAEHO N[C@H](CC(F)F)C(=O)N[C@@H]1CCCCC[N@H+](Cc2ccccc2)C1 ZINC000638851692 480896920 /nfs/dbraw/zinc/89/69/20/480896920.db2.gz PMWXTFPBNCCXMG-HZPDHXFCSA-N 1 3 339.430 2.530 10 0 EFAEHO N[C@H](CC(F)F)C(=O)N[C@@H]1CCCCC[N@@H+](Cc2ccccc2)C1 ZINC000638851692 480896925 /nfs/dbraw/zinc/89/69/25/480896925.db2.gz PMWXTFPBNCCXMG-HZPDHXFCSA-N 1 3 339.430 2.530 10 0 EFAEHO COc1cncc(/C=C\CCN2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@@H]32)c1 ZINC000645837912 480941005 /nfs/dbraw/zinc/94/10/05/480941005.db2.gz PPQJRTSRCHWGBT-IEQVRMSUSA-N 1 3 345.487 2.677 10 0 EFAEHO Cc1ccc2c(c1)[C@H](NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)CC2 ZINC000664022637 480976181 /nfs/dbraw/zinc/97/61/81/480976181.db2.gz IBGMJHKTPHKPDR-QFBILLFUSA-N 1 3 346.519 2.554 10 0 EFAEHO Cc1ccc2c(c1)[C@H](NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)CC2 ZINC000664022637 480976187 /nfs/dbraw/zinc/97/61/87/480976187.db2.gz IBGMJHKTPHKPDR-QFBILLFUSA-N 1 3 346.519 2.554 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H](CNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000661404400 480992289 /nfs/dbraw/zinc/99/22/89/480992289.db2.gz YBJDMPOTQDCZJP-SJORKVTESA-N 1 3 338.540 2.526 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H](CNC(=O)NC[C@@H]2CCN2C(C)(C)C)C1 ZINC000661404400 480992291 /nfs/dbraw/zinc/99/22/91/480992291.db2.gz YBJDMPOTQDCZJP-SJORKVTESA-N 1 3 338.540 2.526 10 0 EFAEHO COc1cccc(-c2n[nH]cc2CN2CC[C@H]3C[NH2+]C[C@H]3CC2)c1 ZINC000647544670 480993345 /nfs/dbraw/zinc/99/33/45/480993345.db2.gz QNVBJIWWZZDMNV-IYBDPMFKSA-N 1 3 326.444 2.517 10 0 EFAEHO Cc1cccc([C@H](C)NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)c1C ZINC000664144015 481049324 /nfs/dbraw/zinc/04/93/24/481049324.db2.gz FXPDDFKEFBCYRT-WMZOPIPTSA-N 1 3 348.535 2.936 10 0 EFAEHO Cc1cccc([C@H](C)NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1C ZINC000664144015 481049327 /nfs/dbraw/zinc/04/93/27/481049327.db2.gz FXPDDFKEFBCYRT-WMZOPIPTSA-N 1 3 348.535 2.936 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1nc(-c2ccccc2)ns1 ZINC000664195416 481082118 /nfs/dbraw/zinc/08/21/18/481082118.db2.gz CEPVWAZVMMESRJ-AWEZNQCLSA-N 1 3 333.505 2.889 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1nc(-c2ccccc2)ns1 ZINC000664195416 481082125 /nfs/dbraw/zinc/08/21/25/481082125.db2.gz CEPVWAZVMMESRJ-AWEZNQCLSA-N 1 3 333.505 2.889 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)[C@@H]2CC[C@@H](C3CC3)[NH2+]2)N2CCCC2)cc1 ZINC000653113910 481088113 /nfs/dbraw/zinc/08/81/13/481088113.db2.gz RKNIKKJOZJFGKO-UFYCRDLUSA-N 1 3 341.499 2.779 10 0 EFAEHO CCN(C(=O)Nc1ccccc1CC[NH+](C)C)[C@H]1CCN(CC)C1 ZINC000666838666 481137782 /nfs/dbraw/zinc/13/77/82/481137782.db2.gz AESTUGAONNNSPV-KRWDZBQOSA-N 1 3 332.492 2.739 10 0 EFAEHO C[C@@H]1C[NH2+]CC[C@H]1NC(=O)N[C@H](CN1CCCCC1)c1ccccc1 ZINC000669483900 481152799 /nfs/dbraw/zinc/15/27/99/481152799.db2.gz RWTISHJLVRDHAC-BHIYHBOVSA-N 1 3 344.503 2.511 10 0 EFAEHO CCN(C(=O)NCC[C@@H](C)[N@H+](C)Cc1ccccc1)[C@@H]1CCN(C)C1 ZINC000664292842 481156842 /nfs/dbraw/zinc/15/68/42/481156842.db2.gz SFWAUSGUYCFYLJ-IEBWSBKVSA-N 1 3 346.519 2.633 10 0 EFAEHO CCN(C(=O)NCC[C@@H](C)[N@@H+](C)Cc1ccccc1)[C@@H]1CCN(C)C1 ZINC000664292842 481156850 /nfs/dbraw/zinc/15/68/50/481156850.db2.gz SFWAUSGUYCFYLJ-IEBWSBKVSA-N 1 3 346.519 2.633 10 0 EFAEHO O=C(CCN1CCC[C@H]([C@H]2CCC[NH2+]2)C1)NCc1ccccc1Cl ZINC000647901636 481169253 /nfs/dbraw/zinc/16/92/53/481169253.db2.gz SCERZAWDNNTQIE-FUHWJXTLSA-N 1 3 349.906 2.810 10 0 EFAEHO c1ccc(C[N@H+]2C[C@H](CNC3CSC3)C3(C2)CCOCC3)cc1 ZINC000646245136 481178934 /nfs/dbraw/zinc/17/89/34/481178934.db2.gz DONJJDDSNHDCEL-KRWDZBQOSA-N 1 3 332.513 2.620 10 0 EFAEHO c1ccc(C[N@@H+]2C[C@H](CNC3CSC3)C3(C2)CCOCC3)cc1 ZINC000646245136 481178940 /nfs/dbraw/zinc/17/89/40/481178940.db2.gz DONJJDDSNHDCEL-KRWDZBQOSA-N 1 3 332.513 2.620 10 0 EFAEHO c1ccc(CN2C[C@H](C[NH2+]C3CSC3)C3(C2)CCOCC3)cc1 ZINC000646245136 481178945 /nfs/dbraw/zinc/17/89/45/481178945.db2.gz DONJJDDSNHDCEL-KRWDZBQOSA-N 1 3 332.513 2.620 10 0 EFAEHO C[C@@]1(CNC(=O)N2CCC(C)([NH3+])CC2)CCCN1Cc1ccccc1 ZINC000669565849 481213745 /nfs/dbraw/zinc/21/37/45/481213745.db2.gz MVIAAKSIKXQVBT-FQEVSTJZSA-N 1 3 344.503 2.564 10 0 EFAEHO CCN(Cc1ccccc1)C(=O)CN1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647974873 481224896 /nfs/dbraw/zinc/22/48/96/481224896.db2.gz ABXGVNDOGJIPCF-UXHICEINSA-N 1 3 343.515 2.747 10 0 EFAEHO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCN(Cc3cc(-c4ccccc4)n[nH]3)C2)C1 ZINC000650706638 481275623 /nfs/dbraw/zinc/27/56/23/481275623.db2.gz OVUGWSKSTWULED-SQGPQFPESA-N 1 3 340.471 2.795 10 0 EFAEHO [NH3+][C@@H]1CCO[C@H]([C@H]2CCCN(Cc3cc(-c4ccccc4)n[nH]3)C2)C1 ZINC000650706637 481276015 /nfs/dbraw/zinc/27/60/15/481276015.db2.gz OVUGWSKSTWULED-QKLQHJQFSA-N 1 3 340.471 2.795 10 0 EFAEHO COCCOc1cccc(CN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)c1 ZINC000650722299 481289948 /nfs/dbraw/zinc/28/99/48/481289948.db2.gz OYIJHFOICVYZKD-DFQSSKMNSA-N 1 3 348.487 2.573 10 0 EFAEHO COc1ccc(CN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)c(OC)c1 ZINC000650721954 481290021 /nfs/dbraw/zinc/29/00/21/481290021.db2.gz HEZBABRFFDUJSF-KVSKMBFKSA-N 1 3 334.460 2.565 10 0 EFAEHO COc1ccc(CN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)c(OC)c1 ZINC000650721955 481290102 /nfs/dbraw/zinc/29/01/02/481290102.db2.gz HEZBABRFFDUJSF-SUMDDJOVSA-N 1 3 334.460 2.565 10 0 EFAEHO COc1ccc(OC)c(CN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)c1 ZINC000650722110 481290411 /nfs/dbraw/zinc/29/04/11/481290411.db2.gz LAZIKDJGFMJHDO-KVSKMBFKSA-N 1 3 334.460 2.565 10 0 EFAEHO COCCOc1ccc(CN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)cc1 ZINC000650723923 481292763 /nfs/dbraw/zinc/29/27/63/481292763.db2.gz VXAPWQOEGOHWLG-DFQSSKMNSA-N 1 3 348.487 2.573 10 0 EFAEHO COC[C@H](CCC[NH3+])NCc1cccc(Oc2ccc(F)cc2)n1 ZINC000650742182 481308151 /nfs/dbraw/zinc/30/81/51/481308151.db2.gz SKNZPCSRNNHJKK-INIZCTEOSA-N 1 3 333.407 2.857 10 0 EFAEHO c1ccc2c(c1)C[C@H](N[C@@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CN2 ZINC000650747718 481310542 /nfs/dbraw/zinc/31/05/42/481310542.db2.gz GJGALXWARMBCLQ-LDQXTDLNSA-N 1 3 335.451 2.869 10 0 EFAEHO O=C(C[C@@H]1NCc2ccccc21)NCCCCC[NH+]1CCCCC1 ZINC000659279550 481330221 /nfs/dbraw/zinc/33/02/21/481330221.db2.gz BKSDNHWESXMDQZ-IBGZPJMESA-N 1 3 329.488 2.993 10 0 EFAEHO [NH3+][C@@H]1CCCCCC[C@@H]1C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659368287 481388495 /nfs/dbraw/zinc/38/84/95/481388495.db2.gz OSGAPVKSBVTCQF-KSZLIROESA-N 1 3 331.460 2.584 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)NCC(C)(C)N[C@H](C)c1ccccc1 ZINC000659453918 481444291 /nfs/dbraw/zinc/44/42/91/481444291.db2.gz AHWRACYICPZHNV-NVXWUHKLSA-N 1 3 334.508 2.788 10 0 EFAEHO Cc1ccccc1[C@@H]([C@H](C)NC(=O)NCC[C@@H]([NH3+])C(C)C)N(C)C ZINC000659491904 481468226 /nfs/dbraw/zinc/46/82/26/481468226.db2.gz FTAQCTAEATXIJM-CGTJXYLNSA-N 1 3 334.508 2.659 10 0 EFAEHO NC[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 ZINC000643479528 481485912 /nfs/dbraw/zinc/48/59/12/481485912.db2.gz NCVXVPUDFBGKOI-USXIJHARSA-N 1 3 343.450 2.506 10 0 EFAEHO CC[NH+]1CCC(N2CCC(C(=O)NCCc3ccsc3)CC2)CC1 ZINC000643610702 481512088 /nfs/dbraw/zinc/51/20/88/481512088.db2.gz WBQALHKAUNLSIP-UHFFFAOYSA-N 1 3 349.544 2.603 10 0 EFAEHO CC(C)[C@H]([NH3+])CCNC(=O)N1CCN(Cc2ccccc2)C[C@@H](C)C1 ZINC000659619715 481519497 /nfs/dbraw/zinc/51/94/97/481519497.db2.gz SDVJQQFKYRYQMR-IEBWSBKVSA-N 1 3 346.519 2.523 10 0 EFAEHO CN1CCC(N2CC[C@@H]([NH2+][C@H]3CCCc4ccccc4C3)C2)CC1 ZINC000648450592 481555621 /nfs/dbraw/zinc/55/56/21/481555621.db2.gz VCENGKXKJCUQSX-VQTJNVASSA-N 1 3 327.516 2.692 10 0 EFAEHO CC[N@H+](Cc1ccc(C(=O)N2CC[C@H]3CN(C)C[C@@H]32)cc1)C(C)C ZINC000646928288 481556383 /nfs/dbraw/zinc/55/63/83/481556383.db2.gz XFXWRKORYKHRNI-OALUTQOASA-N 1 3 329.488 2.693 10 0 EFAEHO CC[N@@H+](Cc1ccc(C(=O)N2CC[C@H]3CN(C)C[C@@H]32)cc1)C(C)C ZINC000646928288 481556388 /nfs/dbraw/zinc/55/63/88/481556388.db2.gz XFXWRKORYKHRNI-OALUTQOASA-N 1 3 329.488 2.693 10 0 EFAEHO CCN(C(=O)N[C@@H](CC(C)C)C[NH+]1CCCC1)[C@H]1CCN(CC)C1 ZINC000664984284 481603311 /nfs/dbraw/zinc/60/33/11/481603311.db2.gz YKNHZJPTKXPXJB-ROUUACIJSA-N 1 3 338.540 2.623 10 0 EFAEHO CC[NH+](CC)CC1CCN(Cc2ccnn2-c2ccncc2)CC1 ZINC000667501794 481607533 /nfs/dbraw/zinc/60/75/33/481607533.db2.gz LIQPWKFGJSNYPQ-UHFFFAOYSA-N 1 3 327.476 2.821 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000662178227 481615144 /nfs/dbraw/zinc/61/51/44/481615144.db2.gz RVILRTUHYRUQIC-FQEVSTJZSA-N 1 3 347.547 2.988 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000662178227 481615148 /nfs/dbraw/zinc/61/51/48/481615148.db2.gz RVILRTUHYRUQIC-FQEVSTJZSA-N 1 3 347.547 2.988 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000662178228 481615636 /nfs/dbraw/zinc/61/56/36/481615636.db2.gz RVILRTUHYRUQIC-HXUWFJFHSA-N 1 3 347.547 2.988 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000662178228 481615643 /nfs/dbraw/zinc/61/56/43/481615643.db2.gz RVILRTUHYRUQIC-HXUWFJFHSA-N 1 3 347.547 2.988 10 0 EFAEHO CC[C@@H](NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C)C1CCCC1 ZINC000665055004 481639117 /nfs/dbraw/zinc/63/91/17/481639117.db2.gz VNIMMOBPCSYTLG-DOTOQJQBSA-N 1 3 326.529 2.526 10 0 EFAEHO CC[C@@H](NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C)C1CCCC1 ZINC000665055004 481639123 /nfs/dbraw/zinc/63/91/23/481639123.db2.gz VNIMMOBPCSYTLG-DOTOQJQBSA-N 1 3 326.529 2.526 10 0 EFAEHO CCN(Cc1cccc(Br)c1)C[C@H]1CCC2(C[NH2+]C2)O1 ZINC000662250705 481666216 /nfs/dbraw/zinc/66/62/16/481666216.db2.gz MHGRDPQHIJTBNR-OAHLLOKOSA-N 1 3 339.277 2.792 10 0 EFAEHO CN(C)CCN(CC[NH+](C)C)C(=O)c1c(Cl)oc2ccccc21 ZINC000651263966 481666882 /nfs/dbraw/zinc/66/68/82/481666882.db2.gz WDQFCRMKMSMTTI-UHFFFAOYSA-N 1 3 337.851 2.652 10 0 EFAEHO c1cc(C[N@@H+](C[C@@H]2CCC3(CNC3)O2)C2CCCC2)cc2c1OCC2 ZINC000662257411 481670250 /nfs/dbraw/zinc/67/02/50/481670250.db2.gz OAGRWQNANOVLOJ-IBGZPJMESA-N 1 3 342.483 2.887 10 0 EFAEHO c1cc(C[N@H+](C[C@@H]2CCC3(CNC3)O2)C2CCCC2)cc2c1OCC2 ZINC000662257411 481670257 /nfs/dbraw/zinc/67/02/57/481670257.db2.gz OAGRWQNANOVLOJ-IBGZPJMESA-N 1 3 342.483 2.887 10 0 EFAEHO c1ccc2c(c1)CCC[C@]21CCC[N@@H+](C[C@H]2CCC3(CNC3)O2)C1 ZINC000662259038 481671974 /nfs/dbraw/zinc/67/19/74/481671974.db2.gz OOXJPWSNINJLBO-UYAOXDASSA-N 1 3 326.484 2.878 10 0 EFAEHO c1ccc2c(c1)CCC[C@]21CCC[N@H+](C[C@H]2CCC3(CNC3)O2)C1 ZINC000662259038 481671980 /nfs/dbraw/zinc/67/19/80/481671980.db2.gz OOXJPWSNINJLBO-UYAOXDASSA-N 1 3 326.484 2.878 10 0 EFAEHO CC[C@H](NC[C@H]1CCC2(C[NH2+]C2)O1)c1ccccc1OC(F)F ZINC000662280451 481687893 /nfs/dbraw/zinc/68/78/93/481687893.db2.gz DRSYUFIXYOGRCV-OCCSQVGLSA-N 1 3 326.387 2.850 10 0 EFAEHO Fc1ccc([C@@H](CC(F)(F)F)NC[C@@H]2CCC3(C[NH2+]C3)O2)cc1 ZINC000662281127 481688131 /nfs/dbraw/zinc/68/81/31/481688131.db2.gz IOTXSMNBFKYGMM-UONOGXRCSA-N 1 3 332.341 2.930 10 0 EFAEHO CN(CCOc1ccc(C(F)(F)F)cc1)C[C@H]1CCC2(C[NH2+]C2)O1 ZINC000662281664 481688507 /nfs/dbraw/zinc/68/85/07/481688507.db2.gz KWHHCWUPMHNQCJ-OAHLLOKOSA-N 1 3 344.377 2.537 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)Nc1ccc(Cl)cc1F ZINC000665156601 481689873 /nfs/dbraw/zinc/68/98/73/481689873.db2.gz FVNIELVOEOSFMH-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)Nc1ccc(Cl)cc1F ZINC000665156601 481689879 /nfs/dbraw/zinc/68/98/79/481689879.db2.gz FVNIELVOEOSFMH-LBPRGKRZSA-N 1 3 344.862 2.873 10 0 EFAEHO Cc1cc(C)cc(NC(=O)CN2CCC[C@@H](C3CC[NH2+]CC3)C2)c1 ZINC000662293657 481697052 /nfs/dbraw/zinc/69/70/52/481697052.db2.gz HMYLVTVZLJLKLL-GOSISDBHSA-N 1 3 329.488 2.954 10 0 EFAEHO CCN(Cc1ccccc1)C(=O)CN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662294771 481700582 /nfs/dbraw/zinc/70/05/82/481700582.db2.gz NAFIBVAKRAIXJF-HXUWFJFHSA-N 1 3 343.515 2.747 10 0 EFAEHO O=C1[C@H](N2CCC[C@@H](C3CC[NH2+]CC3)C2)CCCN1c1ccccc1 ZINC000662294632 481700960 /nfs/dbraw/zinc/70/09/60/481700960.db2.gz CYGMGGCVVMCILE-UYAOXDASSA-N 1 3 341.499 2.894 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)C3CCC(C4CC4)CC3)CC2)CC1 ZINC000667642031 481706207 /nfs/dbraw/zinc/70/62/07/481706207.db2.gz MJNDDJUEQAJSFB-UHFFFAOYSA-N 1 3 347.547 2.878 10 0 EFAEHO CN1C[C@@H](C[NH2+]Cc2cnn(CC(F)F)c2)[C@H](c2ccccc2)C1 ZINC000647249168 481728516 /nfs/dbraw/zinc/72/85/16/481728516.db2.gz GKVVFAKUJFKTSU-SJORKVTESA-N 1 3 334.414 2.583 10 0 EFAEHO CCc1nn(C)c(CC)c1C[NH2+]C[C@@H]1CN(C)C[C@H]1c1ccccc1 ZINC000647249144 481728784 /nfs/dbraw/zinc/72/87/84/481728784.db2.gz DTYVJIWLSKKLSG-MJGOQNOKSA-N 1 3 340.515 2.980 10 0 EFAEHO CC(C)(C)CCC[N@@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662336250 481735435 /nfs/dbraw/zinc/73/54/35/481735435.db2.gz BXYFKGQWXUXMNI-MRXNPFEDSA-N 1 3 333.524 2.825 10 0 EFAEHO CC(C)(C)CCC[N@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662336250 481735444 /nfs/dbraw/zinc/73/54/44/481735444.db2.gz BXYFKGQWXUXMNI-MRXNPFEDSA-N 1 3 333.524 2.825 10 0 EFAEHO C[C@@H]1CCCC[C@H]1C[N@@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662338920 481737745 /nfs/dbraw/zinc/73/77/45/481737745.db2.gz WXCAOPDHIOQWGJ-FGTMMUONSA-N 1 3 345.535 2.825 10 0 EFAEHO C[C@@H]1CCCC[C@H]1C[N@H+]1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1 ZINC000662338920 481737750 /nfs/dbraw/zinc/73/77/50/481737750.db2.gz WXCAOPDHIOQWGJ-FGTMMUONSA-N 1 3 345.535 2.825 10 0 EFAEHO CCOc1ccc([C@@H]2CC[NH2+]C[C@@H]2N[C@H]2CN(C3CC3)C[C@@H]2C)cc1 ZINC000665255197 481750533 /nfs/dbraw/zinc/75/05/33/481750533.db2.gz LHVBUGYUTKDJPQ-ZEWNOJEFSA-N 1 3 343.515 2.603 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCC[C@@H]1Cc1cnn(C)c1 ZINC000665272250 481762487 /nfs/dbraw/zinc/76/24/87/481762487.db2.gz AQMNLANPARVTMX-GMBSWORKSA-N 1 3 327.476 2.644 10 0 EFAEHO C1CC2(C1)[C@H](N[C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)C[C@H]2N1CCOCC1 ZINC000665274158 481762877 /nfs/dbraw/zinc/76/28/77/481762877.db2.gz LDGGGZKXZFWRAF-LASHMREHSA-N 1 3 347.547 2.530 10 0 EFAEHO CC[C@H](N[C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21)C(=O)NCc1cccs1 ZINC000647333898 481765108 /nfs/dbraw/zinc/76/51/08/481765108.db2.gz BIFTZZQUJDEFKT-TWMKSMIVSA-N 1 3 335.517 2.605 10 0 EFAEHO CC[C@H](N[C@@H]1CC[N@@H+](C)[C@H]2CCC[C@@H]21)C(=O)NCc1cccs1 ZINC000647333898 481765112 /nfs/dbraw/zinc/76/51/12/481765112.db2.gz BIFTZZQUJDEFKT-TWMKSMIVSA-N 1 3 335.517 2.605 10 0 EFAEHO CC[C@H]([NH2+][C@@H]1CCN(C)[C@H]2CCC[C@@H]21)C(=O)NCc1cccs1 ZINC000647333898 481765114 /nfs/dbraw/zinc/76/51/14/481765114.db2.gz BIFTZZQUJDEFKT-TWMKSMIVSA-N 1 3 335.517 2.605 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)Nc2cccc3c2CCNC3)CC1 ZINC000667753228 481785979 /nfs/dbraw/zinc/78/59/79/481785979.db2.gz MMBRNMAXWIMMNF-UHFFFAOYSA-N 1 3 330.476 2.576 10 0 EFAEHO C[C@@H](CNC(=O)c1ccc2c(c1)[C@H](C[NH3+])CCC2)N1CCC(C)CC1 ZINC000662417107 481796132 /nfs/dbraw/zinc/79/61/32/481796132.db2.gz HXHWJOLZDKFDAK-LPHOPBHVSA-N 1 3 343.515 2.915 10 0 EFAEHO C[NH+](C)CCCC1CCN(C(=O)NC[C@@H]2CCN2C(C)(C)C)CC1 ZINC000665363218 481819859 /nfs/dbraw/zinc/81/98/59/481819859.db2.gz VFLRUGXTGHAJNN-KRWDZBQOSA-N 1 3 338.540 2.623 10 0 EFAEHO CCN(C(=O)C[C@H]1CC[NH2+]C1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000662501831 481844997 /nfs/dbraw/zinc/84/49/97/481844997.db2.gz DTCDMARUVMIEEC-ZHALLVOQSA-N 1 3 329.488 2.670 10 0 EFAEHO COC[C@@H](CC(C)(C)C)[NH2+]CC1(N2CCCCC2)CCN(C)CC1 ZINC000651723007 481920550 /nfs/dbraw/zinc/92/05/50/481920550.db2.gz ACBDMAOFHXFOHI-GOSISDBHSA-N 1 3 339.568 2.978 10 0 EFAEHO [NH3+]CC1(CC(=O)Nc2ccc([C@H]3CNCCO3)cc2)CCCCC1 ZINC000662685679 481933774 /nfs/dbraw/zinc/93/37/74/481933774.db2.gz GGYBVCWNXKPQBW-QGZVFWFLSA-N 1 3 331.460 2.585 10 0 EFAEHO C[C@@H](C(=O)Nc1ccc([C@@H]2C[NH2+]CCO2)cc1)N1CCCCCC1 ZINC000662687186 481933836 /nfs/dbraw/zinc/93/38/36/481933836.db2.gz VLNCXGYYRGBSQI-YJBOKZPZSA-N 1 3 331.460 2.551 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000660403089 481937932 /nfs/dbraw/zinc/93/79/32/481937932.db2.gz NMJJPHHQRURNIL-IRXDYDNUSA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCCCNC(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000660403089 481937936 /nfs/dbraw/zinc/93/79/36/481937936.db2.gz NMJJPHHQRURNIL-IRXDYDNUSA-N 1 3 338.540 2.813 10 0 EFAEHO C[C@@H]1CCC[N@H+](CCCCNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000660405105 481940863 /nfs/dbraw/zinc/94/08/63/481940863.db2.gz WJADRZAXIABSTA-IAGOWNOFSA-N 1 3 338.540 2.671 10 0 EFAEHO C[C@@H]1CCC[N@@H+](CCCCNC(=O)NC[C@H]2CCN2C(C)(C)C)C1 ZINC000660405105 481940870 /nfs/dbraw/zinc/94/08/70/481940870.db2.gz WJADRZAXIABSTA-IAGOWNOFSA-N 1 3 338.540 2.671 10 0 EFAEHO Cc1ccc([C@H](CNC(=O)C2([NH2+]C3CC3)CCC2)N2CCCC2)cc1 ZINC000662702148 481941588 /nfs/dbraw/zinc/94/15/88/481941588.db2.gz XIDDJPJBSUGOJO-IBGZPJMESA-N 1 3 341.499 2.923 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N(C)C1CCCCCC1 ZINC000665637767 481973448 /nfs/dbraw/zinc/97/34/48/481973448.db2.gz OFHOBAZZKBTKRE-INIZCTEOSA-N 1 3 326.529 2.623 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N(C)C1CCCCCC1 ZINC000665637767 481973451 /nfs/dbraw/zinc/97/34/51/481973451.db2.gz OFHOBAZZKBTKRE-INIZCTEOSA-N 1 3 326.529 2.623 10 0 EFAEHO CC(C)(C)N1CC[C@@H](NC(=O)c2ccccc2CC2CC[NH2+]CC2)C1 ZINC000662853598 481996004 /nfs/dbraw/zinc/99/60/04/481996004.db2.gz QVNCPCUEPFOILP-GOSISDBHSA-N 1 3 343.515 2.831 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)N1C[C@H](C)[C@@H]1c1ccccc1 ZINC000665759268 482038800 /nfs/dbraw/zinc/03/88/00/482038800.db2.gz BFLLVZVPTQWTLN-JENIJYKNSA-N 1 3 346.519 2.661 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)N1C[C@H](C)[C@@H]1c1ccccc1 ZINC000665759268 482038801 /nfs/dbraw/zinc/03/88/01/482038801.db2.gz BFLLVZVPTQWTLN-JENIJYKNSA-N 1 3 346.519 2.661 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NC(C)(C)c1cccs1 ZINC000665759058 482039144 /nfs/dbraw/zinc/03/91/44/482039144.db2.gz YDTZEYWYQIFTLQ-AWEZNQCLSA-N 1 3 340.537 2.554 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NC(C)(C)c1cccs1 ZINC000665759058 482039150 /nfs/dbraw/zinc/03/91/50/482039150.db2.gz YDTZEYWYQIFTLQ-AWEZNQCLSA-N 1 3 340.537 2.554 10 0 EFAEHO COc1cc2nccc(N3CCC[C@@]4(CC[NH2+]C4)C3)c2cc1OC ZINC000663240148 482133388 /nfs/dbraw/zinc/13/33/88/482133388.db2.gz YKOJKWLDDSYPTB-IBGZPJMESA-N 1 3 327.428 2.832 10 0 EFAEHO CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(CN3CC[C@@H](O)C3)cc2)CS1 ZINC000668488576 482142417 /nfs/dbraw/zinc/14/24/17/482142417.db2.gz BVXFKZNTUWWLLT-QRVBRYPASA-N 1 3 334.529 2.873 10 0 EFAEHO O[C@@H]1CCN(Cc2ccc(C[NH2+]CC3Cc4ccccc4C3)cc2)C1 ZINC000668489826 482142611 /nfs/dbraw/zinc/14/26/11/482142611.db2.gz NLEYVPIBOBEURD-JOCHJYFZSA-N 1 3 336.479 2.758 10 0 EFAEHO Cc1cc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc(C)c1O ZINC000668489743 482142732 /nfs/dbraw/zinc/14/27/32/482142732.db2.gz LYWYXOGCQRYVKT-HXUWFJFHSA-N 1 3 340.467 2.865 10 0 EFAEHO Cc1cc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)cc(C)c1O ZINC000668489743 482142737 /nfs/dbraw/zinc/14/27/37/482142737.db2.gz LYWYXOGCQRYVKT-HXUWFJFHSA-N 1 3 340.467 2.865 10 0 EFAEHO CC(C)(C)N1CC[C@H]1CNC(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000660797153 482151616 /nfs/dbraw/zinc/15/16/16/482151616.db2.gz MKRKSDHKHIGMNT-KRWDZBQOSA-N 1 3 336.524 2.565 10 0 EFAEHO CCN(C(=O)Nc1ccc(OCCC[NH+](C)C)cc1)[C@@H]1CCN(C)C1 ZINC000666029122 482156003 /nfs/dbraw/zinc/15/60/03/482156003.db2.gz IVSFQQPJRUMCBH-QGZVFWFLSA-N 1 3 348.491 2.575 10 0 EFAEHO CC(C)OC[C@@H](O)C[NH2+]C[C@@H]1CN(Cc2ccccc2)CC12CCC2 ZINC000663368518 482186327 /nfs/dbraw/zinc/18/63/27/482186327.db2.gz HVGNVLLDJVQODQ-UXHICEINSA-N 1 3 346.515 2.664 10 0 EFAEHO CC(C)OC[C@@H](O)CNC[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000663368518 482186332 /nfs/dbraw/zinc/18/63/32/482186332.db2.gz HVGNVLLDJVQODQ-UXHICEINSA-N 1 3 346.515 2.664 10 0 EFAEHO CC(C)OC[C@@H](O)CNC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000663368518 482186338 /nfs/dbraw/zinc/18/63/38/482186338.db2.gz HVGNVLLDJVQODQ-UXHICEINSA-N 1 3 346.515 2.664 10 0 EFAEHO CCc1cccc(OCCN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)c1 ZINC000652360844 482193174 /nfs/dbraw/zinc/19/31/74/482193174.db2.gz RWLPXGCECAXJGL-DFQSSKMNSA-N 1 3 332.488 2.989 10 0 EFAEHO CCOc1ccc(OCCN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)cc1 ZINC000652360904 482193423 /nfs/dbraw/zinc/19/34/23/482193423.db2.gz TUIJGUVWIHAEMO-NSISKUIASA-N 1 3 348.487 2.825 10 0 EFAEHO CCN(C(=O)NC[C@@H](c1ccccc1)[NH+](CC)CC)[C@@H]1CCN(C)C1 ZINC000663450411 482244236 /nfs/dbraw/zinc/24/42/36/482244236.db2.gz IUHSDTSANZIADY-MOPGFXCFSA-N 1 3 346.519 2.805 10 0 EFAEHO c1ccc(CN(Cc2nc3c(s2)CNCC3)[C@H]2CCC[NH2+]C2)cc1 ZINC000663496775 482265358 /nfs/dbraw/zinc/26/53/58/482265358.db2.gz YIPMSFUXTRGXSL-INIZCTEOSA-N 1 3 342.512 2.543 10 0 EFAEHO O=C(NCc1ccccc1CN1CCCCC1)NC[C@@H]1CCCC[NH2+]1 ZINC000668864787 482300877 /nfs/dbraw/zinc/30/08/77/482300877.db2.gz WGRFMJFRSZVCAX-IBGZPJMESA-N 1 3 344.503 2.614 10 0 EFAEHO CCN(C(=O)NCc1cccc(C[NH+](CC)CC)c1)[C@H]1CCN(C)C1 ZINC000663599324 482317434 /nfs/dbraw/zinc/31/74/34/482317434.db2.gz BNYXEPIFXFLYOS-IBGZPJMESA-N 1 3 346.519 2.764 10 0 EFAEHO CCN(C(=O)NCCCC[NH+]1CCC(C)CC1)[C@H]1CCN(CC)C1 ZINC000663653182 482331596 /nfs/dbraw/zinc/33/15/96/482331596.db2.gz CXABZWRQTNDCCE-SFHVURJKSA-N 1 3 338.540 2.624 10 0 EFAEHO CCC[N@H+](C)CC(C)(C)NC(=O)NCc1cccc(CN(C)C)c1 ZINC000663677762 482342633 /nfs/dbraw/zinc/34/26/33/482342633.db2.gz CVFNQJIKCDOLHL-UHFFFAOYSA-N 1 3 334.508 2.668 10 0 EFAEHO CCC[N@@H+](C)CC(C)(C)NC(=O)NCc1cccc(CN(C)C)c1 ZINC000663677762 482342635 /nfs/dbraw/zinc/34/26/35/482342635.db2.gz CVFNQJIKCDOLHL-UHFFFAOYSA-N 1 3 334.508 2.668 10 0 EFAEHO Cc1ccc2c(c1)CC[C@@H]2NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000663798435 482392514 /nfs/dbraw/zinc/39/25/14/482392514.db2.gz WTYVFODUICMBRW-LPHOPBHVSA-N 1 3 346.519 2.554 10 0 EFAEHO Cc1ccc2c(c1)CC[C@@H]2NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000663798435 482392517 /nfs/dbraw/zinc/39/25/17/482392517.db2.gz WTYVFODUICMBRW-LPHOPBHVSA-N 1 3 346.519 2.554 10 0 EFAEHO C[C@H](O)C[NH+]1CCC(CN(C)Cc2c[nH]c(-c3ccccc3)n2)CC1 ZINC000179516434 534077382 /nfs/dbraw/zinc/07/73/82/534077382.db2.gz SJTSMFKUVURCCJ-INIZCTEOSA-N 1 3 342.487 2.601 10 0 EFAEHO C[C@H](O)C[NH+]1CCC(CN(C)Cc2cnc(-c3ccccc3)[nH]2)CC1 ZINC000179516434 534077386 /nfs/dbraw/zinc/07/73/86/534077386.db2.gz SJTSMFKUVURCCJ-INIZCTEOSA-N 1 3 342.487 2.601 10 0 EFAEHO CC(C)N1CC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)C1=O ZINC000245744430 519690189 /nfs/dbraw/zinc/69/01/89/519690189.db2.gz SGAXLRBLQGNQRG-YRPNKDGESA-N 1 3 341.499 2.781 10 0 EFAEHO CCCN1CCC(C[NH2+][C@H](C)CS(=O)(=O)c2ccccc2)CC1 ZINC000120068553 519843395 /nfs/dbraw/zinc/84/33/95/519843395.db2.gz VPPJGXCBSRSNHR-MRXNPFEDSA-N 1 3 338.517 2.560 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+]C[C@@H]2CCCOC2)CC1 ZINC000236801217 519860169 /nfs/dbraw/zinc/86/01/69/519860169.db2.gz CXXVXOYLBVUFEZ-SFHVURJKSA-N 1 3 331.504 2.735 10 0 EFAEHO CCC(=O)N1CC[C@@H](N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000245781343 521137621 /nfs/dbraw/zinc/13/76/21/521137621.db2.gz YWUIVIFAAYUIOL-WTGUMLROSA-N 1 3 341.499 2.783 10 0 EFAEHO CCC(=O)N1CC[C@@H](N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000245781343 521137632 /nfs/dbraw/zinc/13/76/32/521137632.db2.gz YWUIVIFAAYUIOL-WTGUMLROSA-N 1 3 341.499 2.783 10 0 EFAEHO CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000245419285 521629183 /nfs/dbraw/zinc/62/91/83/521629183.db2.gz LOIQMJKKQMICPQ-RTBURBONSA-N 1 3 346.519 2.723 10 0 EFAEHO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000245419285 521629189 /nfs/dbraw/zinc/62/91/89/521629189.db2.gz LOIQMJKKQMICPQ-RTBURBONSA-N 1 3 346.519 2.723 10 0 EFAEHO CCN1CCC[C@H]1CN(C)C(=O)NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000177400006 521651426 /nfs/dbraw/zinc/65/14/26/521651426.db2.gz ISHYMTAMOOMGNE-ROUUACIJSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN1CCC[C@H]1CN(C)C(=O)NCCCC[N@H+]1CCCC[C@@H]1C ZINC000177400006 521651430 /nfs/dbraw/zinc/65/14/30/521651430.db2.gz ISHYMTAMOOMGNE-ROUUACIJSA-N 1 3 338.540 2.767 10 0 EFAEHO CCN1CC[C@H]([N@H+](C)Cc2ccc3c(c2)sc(=O)n3C)[C@H](C)C1 ZINC000195031222 521720323 /nfs/dbraw/zinc/72/03/23/521720323.db2.gz ZDYIEXFDBRMEBM-HIFRSBDPSA-N 1 3 333.501 2.762 10 0 EFAEHO CCN1CC[C@H]([N@@H+](C)Cc2ccc3c(c2)sc(=O)n3C)[C@H](C)C1 ZINC000195031222 521720324 /nfs/dbraw/zinc/72/03/24/521720324.db2.gz ZDYIEXFDBRMEBM-HIFRSBDPSA-N 1 3 333.501 2.762 10 0 EFAEHO CC(C)(C)[NH+]1CCC(NC(=O)CCN2CCc3ccccc3C2)CC1 ZINC000348942384 534665386 /nfs/dbraw/zinc/66/53/86/534665386.db2.gz TWNDQIUBMHMVNG-UHFFFAOYSA-N 1 3 343.515 2.814 10 0 EFAEHO C[NH+]1CCC(N2CCC(NC(=O)[C@@H]3CCCCC3(C)C)CC2)CC1 ZINC000193955461 523768909 /nfs/dbraw/zinc/76/89/09/523768909.db2.gz SQPRBFUNNUAOPF-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO COC(=O)[C@@H]1C[C@H](c2ccccc2)C[N@H+](CCCN2CCCC2)C1 ZINC000120860098 523794698 /nfs/dbraw/zinc/79/46/98/523794698.db2.gz GRLQGARQGRXSMI-RBUKOAKNSA-N 1 3 330.472 2.751 10 0 EFAEHO COC(=O)[C@@H]1C[C@H](c2ccccc2)C[N@@H+](CCCN2CCCC2)C1 ZINC000120860098 523794701 /nfs/dbraw/zinc/79/47/01/523794701.db2.gz GRLQGARQGRXSMI-RBUKOAKNSA-N 1 3 330.472 2.751 10 0 EFAEHO Cc1cc(C)n2c(C[NH2+]C[C@@H]3CCN(Cc4ccccc4)C3)cnc2n1 ZINC000192918195 524561245 /nfs/dbraw/zinc/56/12/45/524561245.db2.gz ROELAQTWCWAJAC-IBGZPJMESA-N 1 3 349.482 2.958 10 0 EFAEHO COc1ccccc1NC(=O)C1CC[NH+](CCCN2CCCC2)CC1 ZINC000193469808 524589940 /nfs/dbraw/zinc/58/99/40/524589940.db2.gz DUMYPUGLOVFXRE-UHFFFAOYSA-N 1 3 345.487 2.832 10 0 EFAEHO O=C(C1CC[NH+](CCCN2CCCC2)CC1)N1CCc2ccccc21 ZINC000119602067 526303028 /nfs/dbraw/zinc/30/30/28/526303028.db2.gz SQJHQKOOKDBVEP-UHFFFAOYSA-N 1 3 341.499 2.774 10 0 EFAEHO O=C(c1ccccc1)N1CCC([NH2+][C@H]2CCN3CCC[C@H]3C2)CC1 ZINC000246093025 526791782 /nfs/dbraw/zinc/79/17/82/526791782.db2.gz CNXIEXNFYHWZON-OALUTQOASA-N 1 3 327.472 2.508 10 0 EFAEHO O=C(c1ccccc1)N1CCC(N[C@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000246093025 526791789 /nfs/dbraw/zinc/79/17/89/526791789.db2.gz CNXIEXNFYHWZON-OALUTQOASA-N 1 3 327.472 2.508 10 0 EFAEHO O=C(c1ccccc1)N1CCC(N[C@H]2CC[N@H+]3CCC[C@H]3C2)CC1 ZINC000246093025 526791795 /nfs/dbraw/zinc/79/17/95/526791795.db2.gz CNXIEXNFYHWZON-OALUTQOASA-N 1 3 327.472 2.508 10 0 EFAEHO CC[N@@H+]1CC[C@@H](CNC(=O)c2oc3ccccc3c2CN(C)C)C1 ZINC000174181333 527742321 /nfs/dbraw/zinc/74/23/21/527742321.db2.gz MCGLPVPBQHGBDN-AWEZNQCLSA-N 1 3 329.444 2.566 10 0 EFAEHO CC[N@H+]1CC[C@@H](CNC(=O)c2oc3ccccc3c2CN(C)C)C1 ZINC000174181333 527742325 /nfs/dbraw/zinc/74/23/25/527742325.db2.gz MCGLPVPBQHGBDN-AWEZNQCLSA-N 1 3 329.444 2.566 10 0 EFAEHO CC(C)n1ccc(C[C@@H](C)[NH2+]CCCCN2C[C@@H](C)O[C@@H](C)C2)n1 ZINC000341178169 535091620 /nfs/dbraw/zinc/09/16/20/535091620.db2.gz BRLVTKMKSFMXTJ-KURKYZTESA-N 1 3 336.524 2.874 10 0 EFAEHO CCC[NH2+]CCNC(=O)N(CC)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000418469749 535162037 /nfs/dbraw/zinc/16/20/37/535162037.db2.gz KPSYQBWEYIUQGV-MJGOQNOKSA-N 1 3 346.519 2.853 10 0 EFAEHO CC[C@@H]1C[C@H](C[NH+]2CCC(N3CCN(C(C)C)CC3)CC2)CCO1 ZINC000356994395 535896754 /nfs/dbraw/zinc/89/67/54/535896754.db2.gz OJKLYROKWFETOG-UYAOXDASSA-N 1 3 337.552 2.682 10 0 EFAEHO CN(C)CCOc1ccc(NC(=O)CC[C@@H]2CCCC[N@@H+]2C)cc1 ZINC000351874448 535909238 /nfs/dbraw/zinc/90/92/38/535909238.db2.gz GJSZIXHPZRIESZ-KRWDZBQOSA-N 1 3 333.476 2.830 10 0 EFAEHO CN(C)CCOc1ccc(NC(=O)CC[C@@H]2CCCC[N@H+]2C)cc1 ZINC000351874448 535909242 /nfs/dbraw/zinc/90/92/42/535909242.db2.gz GJSZIXHPZRIESZ-KRWDZBQOSA-N 1 3 333.476 2.830 10 0 EFAEHO C[N@H+](CCNC(=O)NC[C@H]1CCCCN1C1CC1)C1CCCCC1 ZINC000434352565 536381051 /nfs/dbraw/zinc/38/10/51/536381051.db2.gz OUWPORAVHJWLKQ-GOSISDBHSA-N 1 3 336.524 2.567 10 0 EFAEHO C[N@@H+](CCNC(=O)NC[C@H]1CCCCN1C1CC1)C1CCCCC1 ZINC000434352565 536381054 /nfs/dbraw/zinc/38/10/54/536381054.db2.gz OUWPORAVHJWLKQ-GOSISDBHSA-N 1 3 336.524 2.567 10 0 EFAEHO c1cc(CN2CCCCC2)cc(-c2noc(C[C@H]3CC[NH2+]C3)n2)c1 ZINC000261766847 545621069 /nfs/dbraw/zinc/62/10/69/545621069.db2.gz MVRGSZSSNRAJNN-OAHLLOKOSA-N 1 3 326.444 2.875 10 0 EFAEHO CN1CCC[C@H](CNC(=O)[C@@H]2CCC[C@@H]2C[NH3+])[C@H]1c1cccs1 ZINC000261733056 545621107 /nfs/dbraw/zinc/62/11/07/545621107.db2.gz LAQWBJNASKFZSY-ANQUJSFKSA-N 1 3 335.517 2.622 10 0 EFAEHO COc1cccc(N2CCC[C@H](N[C@@H]3CC[N@@H+]4CCC[C@H]4C3)C2)c1 ZINC000339067804 545921885 /nfs/dbraw/zinc/92/18/85/545921885.db2.gz ISVPZXXWJJFIJU-SQNIBIBYSA-N 1 3 329.488 2.880 10 0 EFAEHO COc1cccc(N2CCC[C@H](N[C@@H]3CC[N@H+]4CCC[C@H]4C3)C2)c1 ZINC000339067804 545921888 /nfs/dbraw/zinc/92/18/88/545921888.db2.gz ISVPZXXWJJFIJU-SQNIBIBYSA-N 1 3 329.488 2.880 10 0 EFAEHO O=C(c1ccccc1)N1CCC(CN[C@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000339069254 545921955 /nfs/dbraw/zinc/92/19/55/545921955.db2.gz SIXTZXNCQDXYPX-PMACEKPBSA-N 1 3 341.499 2.755 10 0 EFAEHO O=C(c1ccccc1)N1CCC(CN[C@H]2CC[N@H+]3CCC[C@H]3C2)CC1 ZINC000339069254 545921959 /nfs/dbraw/zinc/92/19/59/545921959.db2.gz SIXTZXNCQDXYPX-PMACEKPBSA-N 1 3 341.499 2.755 10 0 EFAEHO O=C(c1ccccc1)N1CCC(C[NH2+][C@H]2CCN3CCC[C@H]3C2)CC1 ZINC000339069254 545921963 /nfs/dbraw/zinc/92/19/63/545921963.db2.gz SIXTZXNCQDXYPX-PMACEKPBSA-N 1 3 341.499 2.755 10 0 EFAEHO C[C@H](CCN1CC[C@@]2(C1)CCCOC2)[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC000341992667 545943440 /nfs/dbraw/zinc/94/34/40/545943440.db2.gz NVYYKZHIEBIYNX-VAMGGRTRSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CCN1CC[C@@]2(C1)CCCOC2)[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000341992667 545943443 /nfs/dbraw/zinc/94/34/43/545943443.db2.gz NVYYKZHIEBIYNX-VAMGGRTRSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@@H+]1CC[C@@]2(C1)CCCOC2)N1CC[C@@]2(C1)CCCOC2 ZINC000341992667 545943446 /nfs/dbraw/zinc/94/34/46/545943446.db2.gz NVYYKZHIEBIYNX-VAMGGRTRSA-N 1 3 336.520 2.770 10 0 EFAEHO C[C@H](CC[N@H+]1CC[C@@]2(C1)CCCOC2)N1CC[C@@]2(C1)CCCOC2 ZINC000341992667 545943452 /nfs/dbraw/zinc/94/34/52/545943452.db2.gz NVYYKZHIEBIYNX-VAMGGRTRSA-N 1 3 336.520 2.770 10 0 EFAEHO CC[C@H]1C[C@H]([NH2+]CC2(O)CCN(Cc3ccccc3)CC2)CCO1 ZINC000397562088 546170682 /nfs/dbraw/zinc/17/06/82/546170682.db2.gz SJGDBPLMUXIKQE-MOPGFXCFSA-N 1 3 332.488 2.561 10 0 EFAEHO CC1(C[NH2+]Cc2ccc(CN3CCC(C(N)=O)CC3)cc2)CCC1 ZINC000414554183 546192251 /nfs/dbraw/zinc/19/22/51/546192251.db2.gz JZELYGNBDLRKCZ-UHFFFAOYSA-N 1 3 329.488 2.664 10 0 EFAEHO CN(C)C(=O)CC[NH+]1CCC(NCc2ccc(C(F)F)cc2)CC1 ZINC000527031491 546305988 /nfs/dbraw/zinc/30/59/88/546305988.db2.gz FTGGLMLBSQKDLT-UHFFFAOYSA-N 1 3 339.430 2.657 10 0 EFAEHO O=C(NC[C@@H]1CCCCN1Cc1ccccc1)[C@H]1C[C@@]12CCC[NH2+]C2 ZINC000655445552 546449878 /nfs/dbraw/zinc/44/98/78/546449878.db2.gz BKTCDBTZSAVZSQ-QKNQBKEWSA-N 1 3 341.499 2.547 10 0 EFAEHO CN(C)Cc1cc(C[NH2+]C2CCN(C[C@H]3CCCO3)CC2)ccc1F ZINC000655716141 546547010 /nfs/dbraw/zinc/54/70/10/546547010.db2.gz QJBFWBQDYGRYLR-LJQANCHMSA-N 1 3 349.494 2.620 10 0 EFAEHO CN(C)Cc1cc(CNC2CC[NH+](C[C@H]3CCCO3)CC2)ccc1F ZINC000655716141 546547014 /nfs/dbraw/zinc/54/70/14/546547014.db2.gz QJBFWBQDYGRYLR-LJQANCHMSA-N 1 3 349.494 2.620 10 0 EFAEHO C[C@H](C[NH2+]C1CCN(C2CCCCC2)CC1)N1C[C@@H](C)O[C@@H](C)C1 ZINC000655802496 546590717 /nfs/dbraw/zinc/59/07/17/546590717.db2.gz MFXAWAKQBHIIRS-KURKYZTESA-N 1 3 337.552 2.871 10 0 EFAEHO C[C@H](NC[C@H]1C[C@@H]([NH+](C)C)C1)c1ncc(Br)cc1F ZINC000655804840 546591707 /nfs/dbraw/zinc/59/17/07/546591707.db2.gz CZEDULGUBDAXFZ-JBLDHEPKSA-N 1 3 330.245 2.974 10 0 EFAEHO Cn1nnc2c1CC[C@@H](NC1CC[NH+](C(C)(C)CC(C)(C)C)CC1)C2 ZINC000655825898 546601637 /nfs/dbraw/zinc/60/16/37/546601637.db2.gz OGHMBXJBBZEDQQ-MRXNPFEDSA-N 1 3 347.551 2.941 10 0 EFAEHO C[NH+](C)[C@H]1C[C@@H](CN[C@@H](C(=O)N2CCCCC2)c2ccccc2)C1 ZINC000656126921 546690441 /nfs/dbraw/zinc/69/04/41/546690441.db2.gz AFLVTUXCGATGTI-NZSAHSFTSA-N 1 3 329.488 2.670 10 0 EFAEHO [NH3+][C@H](Cc1cn([C@@H]2CCN(Cc3ccccc3)C2)nn1)c1ccccc1 ZINC000656455945 546807162 /nfs/dbraw/zinc/80/71/62/546807162.db2.gz PXWMLNNCYSXUEK-NHCUHLMSSA-N 1 3 347.466 2.968 10 0 EFAEHO COc1cc(CN2CCC([C@@H]3CCC[NH2+]C3)CC2)cc2c1OCCO2 ZINC000656786966 546924424 /nfs/dbraw/zinc/92/44/24/546924424.db2.gz YIVNHDRMDFTAOL-QGZVFWFLSA-N 1 3 346.471 2.678 10 0 EFAEHO COc1cc(CN2CCC[C@@H](C3CC[NH2+]CC3)C2)cc(OC)c1OC ZINC000656786634 546924720 /nfs/dbraw/zinc/92/47/20/546924720.db2.gz VGMRXHMWPDJTTN-QGZVFWFLSA-N 1 3 348.487 2.924 10 0 EFAEHO Cc1ccc2cc(CN[C@@H](CC(C)C)C(=O)NCC[NH+](C)C)[nH]c2c1 ZINC000657419616 547155386 /nfs/dbraw/zinc/15/53/86/547155386.db2.gz OVXWCGZQLAZQKX-IBGZPJMESA-N 1 3 344.503 2.658 10 0 EFAEHO CC[C@@H]1CCC[C@H]([NH2+]CC2(N3CCOCC3)CCN(C)CC2)CC1 ZINC000657490258 547183177 /nfs/dbraw/zinc/18/31/77/547183177.db2.gz HSGYAGBPHJTHNZ-MOPGFXCFSA-N 1 3 337.552 2.732 10 0 EFAEHO CCn1nc(C)c(CNCC2CC[NH+](C3CCOCC3)CC2)c1C ZINC000657535517 547195769 /nfs/dbraw/zinc/19/57/69/547195769.db2.gz NYSXELWSPGRYBZ-UHFFFAOYSA-N 1 3 334.508 2.500 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@H]2C[C@H](OCC)C2)CC1 ZINC000657610185 547228597 /nfs/dbraw/zinc/22/85/97/547228597.db2.gz QXUURTSBATYDLN-WGSAOQKQSA-N 1 3 331.504 2.876 10 0 EFAEHO CN(c1ccccc1CN[C@H]1C[C@H](O)C12CCC2)C1CC[NH+](C)CC1 ZINC000657704206 547258460 /nfs/dbraw/zinc/25/84/60/547258460.db2.gz DVOXSIJVPMLVGS-PMACEKPBSA-N 1 3 343.515 2.610 10 0 EFAEHO CN(c1ccccc1CN[C@H]1C[C@@H](O)C12CCC2)C1CC[NH+](C)CC1 ZINC000657704208 547258708 /nfs/dbraw/zinc/25/87/08/547258708.db2.gz DVOXSIJVPMLVGS-VQTJNVASSA-N 1 3 343.515 2.610 10 0 EFAEHO CN1CCC(C[NH2+]C2CC(CF)(CF)C2)(N2CCCCC2)CC1 ZINC000657890423 547311634 /nfs/dbraw/zinc/31/16/34/547311634.db2.gz DZNGIGZAIWHEBQ-UHFFFAOYSA-N 1 3 329.479 2.614 10 0 EFAEHO CO[C@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CCOC1 ZINC000658077841 547349793 /nfs/dbraw/zinc/34/97/93/547349793.db2.gz RLSSZHJWJWTWMC-JRSUCEMESA-N 1 3 344.499 2.823 10 0 EFAEHO CO[C@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@H]1CCOC1 ZINC000658077841 547349799 /nfs/dbraw/zinc/34/97/99/547349799.db2.gz RLSSZHJWJWTWMC-JRSUCEMESA-N 1 3 344.499 2.823 10 0 EFAEHO CO[C@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CCOC1 ZINC000658077846 547350143 /nfs/dbraw/zinc/35/01/43/547350143.db2.gz RLSSZHJWJWTWMC-SSSFQFABSA-N 1 3 344.499 2.823 10 0 EFAEHO CO[C@H](CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1CCOC1 ZINC000658077846 547350145 /nfs/dbraw/zinc/35/01/45/547350145.db2.gz RLSSZHJWJWTWMC-SSSFQFABSA-N 1 3 344.499 2.823 10 0 EFAEHO C[C@@H](CN(C)CCC[NH+](C)C)N[C@@H]1CCc2cc(F)c(F)c(F)c21 ZINC000658105885 547357551 /nfs/dbraw/zinc/35/75/51/547357551.db2.gz FJJBHGAMVJVQIH-SWLSCSKDSA-N 1 3 343.437 2.953 10 0 EFAEHO COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000658134296 547366491 /nfs/dbraw/zinc/36/64/91/547366491.db2.gz ACIZERCZXRWYIN-UFYCRDLUSA-N 1 3 332.488 2.548 10 0 EFAEHO CO[C@H]1C[C@H]2C[C@H]([NH2+]Cc3ccc(CN4CC[C@@H](O)C4)cc3)C[C@H]2C1 ZINC000658137386 547367401 /nfs/dbraw/zinc/36/74/01/547367401.db2.gz KPSFULLYXJAUFS-IFLJBQAJSA-N 1 3 344.499 2.546 10 0 EFAEHO CC[C@H]([NH2+]Cc1ccc(CN2CC[C@H](O)C2)cc1)C1CCOCC1 ZINC000658137551 547367942 /nfs/dbraw/zinc/36/79/42/547367942.db2.gz HKTRYRWQBXQJCS-PMACEKPBSA-N 1 3 332.488 2.548 10 0 EFAEHO COc1cc([C@@H](C)NCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)ccn1 ZINC000658136641 547368017 /nfs/dbraw/zinc/36/80/17/547368017.db2.gz HOIZVXCUMCFEHU-DNVCBOLYSA-N 1 3 341.455 2.508 10 0 EFAEHO COc1cc([C@@H](C)NCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)ccn1 ZINC000658136641 547368021 /nfs/dbraw/zinc/36/80/21/547368021.db2.gz HOIZVXCUMCFEHU-DNVCBOLYSA-N 1 3 341.455 2.508 10 0 EFAEHO CC1(C)[C@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)[C@H]2CCCO[C@@H]21 ZINC000658139237 547368953 /nfs/dbraw/zinc/36/89/53/547368953.db2.gz PMRKKWZOJCPORW-NMLBUPMWSA-N 1 3 344.499 2.546 10 0 EFAEHO CCO[C@@H]1C[C@H]([NH2+]Cc2ccc(CN3CC[C@H](O)C3)cc2)C1(C)C ZINC000658139187 547369357 /nfs/dbraw/zinc/36/93/57/547369357.db2.gz PHZLMSISTCDNET-GBESFXJTSA-N 1 3 332.488 2.546 10 0 EFAEHO C[C@H]([NH2+]CCO[C@@H]1CC1(F)F)c1ccc(OCCN(C)C)cc1 ZINC000658171501 547379969 /nfs/dbraw/zinc/37/99/69/547379969.db2.gz ZDGMYAQENMPLCZ-XJKSGUPXSA-N 1 3 328.403 2.702 10 0 EFAEHO C[C@H](NCCO[C@@H]1CC1(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000658171501 547379970 /nfs/dbraw/zinc/37/99/70/547379970.db2.gz ZDGMYAQENMPLCZ-XJKSGUPXSA-N 1 3 328.403 2.702 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(N[C@H]2C[C@H](O)C23CCC3)CC1 ZINC000658248950 547397173 /nfs/dbraw/zinc/39/71/73/547397173.db2.gz GXQYNEGUZNCOFZ-UXPWSPDFSA-N 1 3 328.500 2.975 10 0 EFAEHO C[C@H](Cc1ccccc1)[NH+]1CCC(N[C@@H]2C[C@@H](O)C23CCC3)CC1 ZINC000658248949 547397213 /nfs/dbraw/zinc/39/72/13/547397213.db2.gz GXQYNEGUZNCOFZ-NSISKUIASA-N 1 3 328.500 2.975 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)C[NH2+][C@@H]1CCN(C)[C@@H]2CCC[C@H]21 ZINC000671743133 547664833 /nfs/dbraw/zinc/66/48/33/547664833.db2.gz GDPCMXKCHLNGJI-FCGDIQPGSA-N 1 3 332.488 2.506 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CN[C@@H]1CC[N@@H+](C)[C@@H]2CCC[C@H]21 ZINC000671743133 547664839 /nfs/dbraw/zinc/66/48/39/547664839.db2.gz GDPCMXKCHLNGJI-FCGDIQPGSA-N 1 3 332.488 2.506 10 0 EFAEHO Cc1cccc(C)c1OC[C@H](O)CN[C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000671743133 547664843 /nfs/dbraw/zinc/66/48/43/547664843.db2.gz GDPCMXKCHLNGJI-FCGDIQPGSA-N 1 3 332.488 2.506 10 0 EFAEHO CN(C)CCOc1ccc(C[NH2+][C@@H]2COc3ccc(F)cc3C2)cc1 ZINC000674224484 548040538 /nfs/dbraw/zinc/04/05/38/548040538.db2.gz YBJIBOZWKBVNNH-SFHVURJKSA-N 1 3 344.430 2.859 10 0 EFAEHO C[NH+](C)CCOc1ccc(CN[C@@H]2COc3ccc(F)cc3C2)cc1 ZINC000674224484 548040543 /nfs/dbraw/zinc/04/05/43/548040543.db2.gz YBJIBOZWKBVNNH-SFHVURJKSA-N 1 3 344.430 2.859 10 0 EFAEHO COC1CCN(CC[NH2+][C@H]2CCN(Cc3ccccc3)C[C@@H]2C)CC1 ZINC000675929453 548377445 /nfs/dbraw/zinc/37/74/45/548377445.db2.gz FAONKHRMDJFZFI-RXVVDRJESA-N 1 3 345.531 2.597 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@H+](CCCO)C2CC2)CC1 ZINC000678264749 548883043 /nfs/dbraw/zinc/88/30/43/548883043.db2.gz YKGVJUNZOKOTPG-UHFFFAOYSA-N 1 3 331.504 2.565 10 0 EFAEHO CCCN1CCN(c2ccccc2C[N@@H+](CCCO)C2CC2)CC1 ZINC000678264749 548883045 /nfs/dbraw/zinc/88/30/45/548883045.db2.gz YKGVJUNZOKOTPG-UHFFFAOYSA-N 1 3 331.504 2.565 10 0 EFAEHO C[C@H](N[C@@H](CO)c1cccc(Br)c1)C1CC[NH+](C)CC1 ZINC000678598836 548959371 /nfs/dbraw/zinc/95/93/71/548959371.db2.gz NWSYCWGBLZBZOZ-LRDDRELGSA-N 1 3 341.293 2.802 10 0 EFAEHO c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H](NCCOC[C@@H]2CCOC2)C3)cc1 ZINC000679392586 549118150 /nfs/dbraw/zinc/11/81/50/549118150.db2.gz BVYUKJXKZCURHU-NCYKPQTJSA-N 1 3 344.499 2.825 10 0 EFAEHO c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H](NCCOC[C@@H]2CCOC2)C3)cc1 ZINC000679392586 549118155 /nfs/dbraw/zinc/11/81/55/549118155.db2.gz BVYUKJXKZCURHU-NCYKPQTJSA-N 1 3 344.499 2.825 10 0 EFAEHO c1ccc2c(c1)CC[C@H](CN1CCN(CC[NH+]3CCCC3)CC1)C2 ZINC000679815305 549199365 /nfs/dbraw/zinc/19/93/65/549199365.db2.gz BZPUMFHNMRYAED-IBGZPJMESA-N 1 3 327.516 2.505 10 0 EFAEHO C[C@@H]1CN(Cc2ccc3cnccc3c2)CC[C@H]1[NH+]1CCN(C)CC1 ZINC000683833112 549952768 /nfs/dbraw/zinc/95/27/68/549952768.db2.gz UBAQVLHBQAYGFQ-DYESRHJHSA-N 1 3 338.499 2.693 10 0 EFAEHO CCC[NH+]1CCC(CNC(=O)NC[C@@H]2N(C)CCCC2(C)C)CC1 ZINC000684126371 549995631 /nfs/dbraw/zinc/99/56/31/549995631.db2.gz ULYOSYSOJLVYNP-KRWDZBQOSA-N 1 3 338.540 2.528 10 0 EFAEHO CCN1CCN(Cc2ccccc2C[NH2+][C@@H]2CCC[C@H](OC)C2)CC1 ZINC000684370264 550030999 /nfs/dbraw/zinc/03/09/99/550030999.db2.gz RGDODAUBLJQCFP-RTWAWAEBSA-N 1 3 345.531 2.871 10 0 EFAEHO CO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2CN2CCC(O)CC2)C1 ZINC000684383342 550032974 /nfs/dbraw/zinc/03/29/74/550032974.db2.gz MQPLSZFNPDUTLJ-AZUAARDMSA-N 1 3 332.488 2.691 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CCC1 ZINC000763051197 576357434 /nfs/dbraw/zinc/35/74/34/576357434.db2.gz FPHCDWPYKORSQE-ZBFHGGJFSA-N 1 3 335.517 2.732 10 0 EFAEHO CN(C)C1(C(=O)NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CCC1 ZINC000763051197 576357436 /nfs/dbraw/zinc/35/74/36/576357436.db2.gz FPHCDWPYKORSQE-ZBFHGGJFSA-N 1 3 335.517 2.732 10 0 EFAEHO C[C@H]1CN(Cc2cncc3ccccc32)CC[C@H]1[NH+]1CCN(C)CC1 ZINC000769524652 577370217 /nfs/dbraw/zinc/37/02/17/577370217.db2.gz GPCYSEDLRJBNLN-LAUBAEHRSA-N 1 3 338.499 2.693 10 0 EFAEHO CCC[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)c1cccc(CN(C)C)c1 ZINC001691382047 1248714748 /nfs/dbraw/zinc/71/47/48/1248714748.db2.gz FLLCNYCICMABAZ-APWZRJJASA-N 1 3 331.504 2.989 10 0 EFAEHO CN(C[C@@H]1CCN1CCC1=CCCCC1)C(=O)C1(C[NH+](C)C)CC1 ZINC001691395871 1248730396 /nfs/dbraw/zinc/73/03/96/1248730396.db2.gz QPCBWXPMMVFKCR-SFHVURJKSA-N 1 3 333.520 2.751 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](F)CN(CC)CC)CC[N@@H+]1CC=C(C)C ZINC001691480200 1249220449 /nfs/dbraw/zinc/22/04/49/1249220449.db2.gz UWRJCIKBEKNHLI-IXDOHACOSA-N 1 3 327.488 2.602 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@H](F)CN(CC)CC)CC[N@H+]1CC=C(C)C ZINC001691480200 1249220462 /nfs/dbraw/zinc/22/04/62/1249220462.db2.gz UWRJCIKBEKNHLI-IXDOHACOSA-N 1 3 327.488 2.602 10 0 EFAEHO CCc1ccccc1CN1CC[C@@H](NC(=O)CCCC[NH+](C)C)C1 ZINC001481708508 1249956890 /nfs/dbraw/zinc/95/68/90/1249956890.db2.gz XDIMKISRRCTKMW-LJQANCHMSA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@H]([NH2+]CCC2=CCCCC2)C1)N(C)C ZINC001691163933 1248493514 /nfs/dbraw/zinc/49/35/14/1248493514.db2.gz KUUXXEBLJGGFHP-GUDVDZBRSA-N 1 3 335.536 2.948 10 0 EFAEHO Cc1nc(C)c(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)s1 ZINC000850357605 1250447219 /nfs/dbraw/zinc/44/72/19/1250447219.db2.gz PHSXQYUNMKUKOH-KRWDZBQOSA-N 1 3 331.485 2.616 10 0 EFAEHO Cc1nc(C)c(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)s1 ZINC000850357605 1250447223 /nfs/dbraw/zinc/44/72/23/1250447223.db2.gz PHSXQYUNMKUKOH-KRWDZBQOSA-N 1 3 331.485 2.616 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]Cc1ccc(C2CC2)cc1 ZINC001691623164 1251840519 /nfs/dbraw/zinc/84/05/19/1251840519.db2.gz NEAALUCLCIJHOV-FQEVSTJZSA-N 1 3 343.515 2.986 10 0 EFAEHO CCCC[NH2+][C@@H]1CC[C@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001691626640 1251872380 /nfs/dbraw/zinc/87/23/80/1251872380.db2.gz MFAUJTRJPLFJSX-FRQCXROJSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@](C)(C[NH2+]CC2=CCCCC2)C1)N(C)C ZINC001484103094 1252255738 /nfs/dbraw/zinc/25/57/38/1252255738.db2.gz QVSPFVFFZJDJHU-ICSRJNTNSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccsc1)C2 ZINC001484321879 1252389325 /nfs/dbraw/zinc/38/93/25/1252389325.db2.gz WOVTXNYWXSVNRS-ULQDDVLXSA-N 1 3 335.517 2.557 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccsc1)C2 ZINC001484321879 1252389330 /nfs/dbraw/zinc/38/93/30/1252389330.db2.gz WOVTXNYWXSVNRS-ULQDDVLXSA-N 1 3 335.517 2.557 10 0 EFAEHO CCc1ccccc1[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CC(C)C ZINC001484322032 1252390866 /nfs/dbraw/zinc/39/08/66/1252390866.db2.gz AAJAURPYWZVYQJ-XLIONFOSSA-N 1 3 345.531 2.994 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CCC(C)C ZINC001484390555 1252499129 /nfs/dbraw/zinc/49/91/29/1252499129.db2.gz PPMNXWABBRMDNI-BJWYYQGGSA-N 1 3 332.492 2.666 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC(C)C ZINC001484390555 1252499139 /nfs/dbraw/zinc/49/91/39/1252499139.db2.gz PPMNXWABBRMDNI-BJWYYQGGSA-N 1 3 332.492 2.666 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1CC[C@H](CNC(=O)CN2CC[C@H](C)C2)CC1 ZINC001484396096 1252519231 /nfs/dbraw/zinc/51/92/31/1252519231.db2.gz QAQNDPCJIAOCBI-XSLAGTTESA-N 1 3 341.515 2.589 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(F)c1 ZINC001484463899 1252663749 /nfs/dbraw/zinc/66/37/49/1252663749.db2.gz SIHYSKUQUVHCIF-RTBURBONSA-N 1 3 347.478 2.733 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(F)c1 ZINC001484463896 1252665245 /nfs/dbraw/zinc/66/52/45/1252665245.db2.gz SIHYSKUQUVHCIF-MOPGFXCFSA-N 1 3 347.478 2.733 10 0 EFAEHO Cc1cc(C[NH2+]CC[C@@H]2CCN(C(=O)[C@@H]3CCCN3C)C2)c(C)s1 ZINC001484512935 1252737760 /nfs/dbraw/zinc/73/77/60/1252737760.db2.gz ZYYBRJXSLYOUEG-AEFFLSMTSA-N 1 3 349.544 2.787 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@H+](CCCc2ccccc2)CC1 ZINC001484728061 1252818839 /nfs/dbraw/zinc/81/88/39/1252818839.db2.gz JITBDHMCYXBYFC-FQEVSTJZSA-N 1 3 345.531 2.930 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC001484728061 1252818852 /nfs/dbraw/zinc/81/88/52/1252818852.db2.gz JITBDHMCYXBYFC-FQEVSTJZSA-N 1 3 345.531 2.930 10 0 EFAEHO CC[C@@H](F)CN(C)CCCN(C)C(=O)C(C)(C)[NH+]1CCCCC1 ZINC001484742957 1252851357 /nfs/dbraw/zinc/85/13/57/1252851357.db2.gz URAPESSLVCVLKK-MRXNPFEDSA-N 1 3 329.504 2.779 10 0 EFAEHO C[C@H](F)CC[N@H+](C)CCCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001484758296 1252930754 /nfs/dbraw/zinc/93/07/54/1252930754.db2.gz BKTNKXCMZGFXNA-MAUKXSAKSA-N 1 3 347.494 2.727 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)CCCN(C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001484758296 1252930763 /nfs/dbraw/zinc/93/07/63/1252930763.db2.gz BKTNKXCMZGFXNA-MAUKXSAKSA-N 1 3 347.494 2.727 10 0 EFAEHO CN(CCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)C(=O)CN1CCCC1 ZINC001484768381 1252971074 /nfs/dbraw/zinc/97/10/74/1252971074.db2.gz NBQMTINTCXMPAM-MRXNPFEDSA-N 1 3 345.478 2.688 10 0 EFAEHO CN(CCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)C(=O)CN1CCCC1 ZINC001484768381 1252971100 /nfs/dbraw/zinc/97/11/00/1252971100.db2.gz NBQMTINTCXMPAM-MRXNPFEDSA-N 1 3 345.478 2.688 10 0 EFAEHO Cn1ncc(Br)c1CNCCCCCCC[NH+](C)C ZINC000785438505 1257443868 /nfs/dbraw/zinc/44/38/68/1257443868.db2.gz IAENDYQOCKMZFG-UHFFFAOYSA-N 1 3 331.302 2.784 10 0 EFAEHO CCCN1CCN(c2ccccc2C[NH2+][C@@H]2CCO[C@H]2C2CC2)CC1 ZINC000922519007 1266189083 /nfs/dbraw/zinc/18/90/83/1266189083.db2.gz UWFRKPDVJJYUOA-CTNGQTDRSA-N 1 3 343.515 2.876 10 0 EFAEHO CCCCCC[N@@H+]1CCC[C@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001671038324 1259816584 /nfs/dbraw/zinc/81/65/84/1259816584.db2.gz AHTKGTYABOHDHV-IBGZPJMESA-N 1 3 332.492 2.847 10 0 EFAEHO CCCCCC[N@H+]1CCC[C@]2(CCN(C(=O)Cc3c[nH]cn3)C2)C1 ZINC001671038324 1259816591 /nfs/dbraw/zinc/81/65/91/1259816591.db2.gz AHTKGTYABOHDHV-IBGZPJMESA-N 1 3 332.492 2.847 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)CC[NH2+]Cc1ccc(Cl)cc1F)N(C)C ZINC001272866174 1261192787 /nfs/dbraw/zinc/19/27/87/1261192787.db2.gz SEKWOXUFLHMGSF-MLGOLLRUSA-N 1 3 343.874 2.804 10 0 EFAEHO N[C@@H]1CCCC[C@H]1[NH2+]C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000923383261 1261581063 /nfs/dbraw/zinc/58/10/63/1261581063.db2.gz WXENOZOMRGPVHS-LERXQTSPSA-N 1 3 333.259 2.593 10 0 EFAEHO CC(C)(C)[C@@]1(C[NH3+])CCN(C[C@H](O)COc2ccc(Cl)cc2)C1 ZINC000923413126 1261627111 /nfs/dbraw/zinc/62/71/11/1261627111.db2.gz DOFKNJMYBZCLJA-MAUKXSAKSA-N 1 3 340.895 2.777 10 0 EFAEHO CC(C)(C)[C@@]1(C[NH3+])CCN(C[C@@H](O)COc2ccc(Cl)cc2)C1 ZINC000923413124 1261627313 /nfs/dbraw/zinc/62/73/13/1261627313.db2.gz DOFKNJMYBZCLJA-CRAIPNDOSA-N 1 3 340.895 2.777 10 0 EFAEHO CC(C)(C)[C@@]1(C[NH3+])CCN(C[C@@H](O)COc2ccccc2Cl)C1 ZINC000923414981 1261627995 /nfs/dbraw/zinc/62/79/95/1261627995.db2.gz NZZGCTGDARBALT-RDTXWAMCSA-N 1 3 340.895 2.777 10 0 EFAEHO Cc1ccc(C)c(OC[C@@H](O)CN2CC[C@](C[NH3+])(C(C)(C)C)C2)c1 ZINC000923414526 1261628119 /nfs/dbraw/zinc/62/81/19/1261628119.db2.gz LQKLHXWGDPFVMA-FXAWDEMLSA-N 1 3 334.504 2.740 10 0 EFAEHO CC1(C)[C@@H]([NH3+])C[C@@H]1NC[C@@H]1Cc2ccccc2O[C@H]1C(F)(F)F ZINC000923423811 1261631802 /nfs/dbraw/zinc/63/18/02/1261631802.db2.gz ZORHPCUMFBYNIU-CYUUQNCZSA-N 1 3 328.378 2.884 10 0 EFAEHO [NH3+]C[C@H]1CC2(CO1)CCN(Cc1c(Cl)cncc1Cl)CC2 ZINC000923447029 1261667081 /nfs/dbraw/zinc/66/70/81/1261667081.db2.gz PARRUPYZXLVHBV-LLVKDONJSA-N 1 3 330.259 2.718 10 0 EFAEHO [NH3+]C[C@@H]1CC2(CO1)CCN(Cc1ccccc1Br)CC2 ZINC000923455863 1261679327 /nfs/dbraw/zinc/67/93/27/1261679327.db2.gz NFXKIGWTMOSJQN-AWEZNQCLSA-N 1 3 339.277 2.779 10 0 EFAEHO [NH3+]C[C@H]1CC2(CO1)CCN(Cc1cc(F)ccc1OC(F)F)CC2 ZINC000923450233 1261687694 /nfs/dbraw/zinc/68/76/94/1261687694.db2.gz FJVBPZQVAGOUQW-CQSZACIVSA-N 1 3 344.377 2.757 10 0 EFAEHO [NH3+]C[C@@H]1CC2(CO1)CCN(Cc1cc(-c3ccccc3)no1)CC2 ZINC000923450468 1261688052 /nfs/dbraw/zinc/68/80/52/1261688052.db2.gz VEXZATVTIFEXEZ-KRWDZBQOSA-N 1 3 327.428 2.671 10 0 EFAEHO C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923502320 1261782415 /nfs/dbraw/zinc/78/24/15/1261782415.db2.gz YUWCDXWBFCEGQJ-IJEWVQPXSA-N 1 3 337.895 2.776 10 0 EFAEHO CCN(C(=O)CN1CC[C@H](C[NH3+])[C@H](C)C1)[C@@H](C)c1ccc(F)cc1 ZINC000923496912 1261786780 /nfs/dbraw/zinc/78/67/80/1261786780.db2.gz KGEOAUZVGMTDTO-HLLBOEOZSA-N 1 3 335.467 2.652 10 0 EFAEHO C[C@H](NC(=O)[C@H](C)N1CC[C@@H](C[NH3+])[C@H](C)C1)c1ccc(Cl)cc1 ZINC000923497134 1261786947 /nfs/dbraw/zinc/78/69/47/1261786947.db2.gz FNJFEIVAWMHRIP-HOSILWTGSA-N 1 3 337.895 2.822 10 0 EFAEHO CCCN(Cc1ccc(C)cc1)C(=O)CN1CC[C@H](C[NH3+])[C@@H](C)C1 ZINC000923498123 1261788826 /nfs/dbraw/zinc/78/88/26/1261788826.db2.gz DZFWPOGXBNXPQP-PKOBYXMFSA-N 1 3 331.504 2.650 10 0 EFAEHO C[C@H]1CN(CC(=O)NCC2(c3ccccc3)CCCC2)CC[C@H]1C[NH3+] ZINC000923498236 1261790558 /nfs/dbraw/zinc/79/05/58/1261790558.db2.gz KDTQEKARLGMXTC-ROUUACIJSA-N 1 3 343.515 2.531 10 0 EFAEHO CCc1ccc([C@H](C)NC(=O)[C@H](C)N2CC[C@@H](C[NH3+])[C@@H](C)C2)cc1 ZINC000923498160 1261790695 /nfs/dbraw/zinc/79/06/95/1261790695.db2.gz JRKVEOWURVRWGI-FPXQBCRKSA-N 1 3 331.504 2.731 10 0 EFAEHO C[C@@H]1CN(CC(=O)N[C@@H](c2ccccc2)C2CCCC2)CC[C@@H]1C[NH3+] ZINC000923498434 1261792169 /nfs/dbraw/zinc/79/21/69/1261792169.db2.gz PNUGMGWBKGCHNE-BSIFCXSSSA-N 1 3 343.515 2.951 10 0 EFAEHO C[C@@H]1CN(CC(=O)N(Cc2cccc(F)c2)C(C)(C)C)CC[C@@H]1C[NH3+] ZINC000923499197 1261794883 /nfs/dbraw/zinc/79/48/83/1261794883.db2.gz RDIVDNNUGNAOFW-NVXWUHKLSA-N 1 3 349.494 2.870 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H](C)CN(C)C(=O)C2(N(C)C)CCC2)cc1 ZINC001485881483 1262464008 /nfs/dbraw/zinc/46/40/08/1262464008.db2.gz GXTJOWIKRAQHFC-GOSISDBHSA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@@H]1[C@@H]([NH2+]CCCCCF)CCN1C(=O)CN(C)CC(C)(C)C ZINC001486089208 1262611953 /nfs/dbraw/zinc/61/19/53/1262611953.db2.gz OTFOWZWZQKYDGW-CVEARBPZSA-N 1 3 329.504 2.683 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@]12CCC[C@H]1N(Cc1ccc(F)cc1)CC2 ZINC001486162061 1262722126 /nfs/dbraw/zinc/72/21/26/1262722126.db2.gz ZBXVNRNCWHSKLS-UYAOXDASSA-N 1 3 347.478 2.781 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@]12CCC[C@H]1N(Cc1ccc(F)cc1)CC2 ZINC001486162061 1262722132 /nfs/dbraw/zinc/72/21/32/1262722132.db2.gz ZBXVNRNCWHSKLS-UYAOXDASSA-N 1 3 347.478 2.781 10 0 EFAEHO COc1cccc(C[NH2+]C[C@@H](NC(=O)CN(C)C(C)C)C(C)(C)C)c1 ZINC001486423439 1263074617 /nfs/dbraw/zinc/07/46/17/1263074617.db2.gz HEHBSIZGLWRSSA-GOSISDBHSA-N 1 3 349.519 2.656 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2ccccc2C2CC2)C1)N(C)C ZINC001486480410 1263216544 /nfs/dbraw/zinc/21/65/44/1263216544.db2.gz GJKFANNAIQMRKT-AFMYVXGZSA-N 1 3 343.515 2.983 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001486483120 1263221133 /nfs/dbraw/zinc/22/11/33/1263221133.db2.gz BYKILRHEBRJAEF-UHFFFAOYSA-N 1 3 343.515 2.983 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@H+](Cc2ccccc2C)CC1)N(C)C ZINC001486519150 1263311479 /nfs/dbraw/zinc/31/14/79/1263311479.db2.gz NPPLROZKVXUILZ-LJQANCHMSA-N 1 3 329.488 2.584 10 0 EFAEHO CC[C@H](C(=O)NCC1=CC[N@@H+](Cc2ccccc2C)CC1)N(C)C ZINC001486519150 1263311491 /nfs/dbraw/zinc/31/14/91/1263311491.db2.gz NPPLROZKVXUILZ-LJQANCHMSA-N 1 3 329.488 2.584 10 0 EFAEHO CC[C@H](C)C[N@@H+]1CCCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001410171227 1264161924 /nfs/dbraw/zinc/16/19/24/1264161924.db2.gz NTVXPOVWGPWYKM-KRWDZBQOSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C)C[N@H+]1CCCC2(CN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001410171227 1264161927 /nfs/dbraw/zinc/16/19/27/1264161927.db2.gz NTVXPOVWGPWYKM-KRWDZBQOSA-N 1 3 337.552 2.935 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C2CC2)N(C)C(=O)CN(C)C(C)C)cc1F ZINC001410334803 1264827087 /nfs/dbraw/zinc/82/70/87/1264827087.db2.gz UTAAMKNZKMFINJ-LJQANCHMSA-N 1 3 349.494 2.801 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@H](C)CN(C)C(=O)CN1CC[C@@H](C)C1 ZINC001410427935 1265140717 /nfs/dbraw/zinc/14/07/17/1265140717.db2.gz BUFFCGOEUMTVDR-QZTJIDSGSA-N 1 3 345.531 2.570 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@@H](C)CN(C)C(=O)CN1CC[C@H](C)C1 ZINC001410427936 1265141076 /nfs/dbraw/zinc/14/10/76/1265141076.db2.gz BUFFCGOEUMTVDR-ROUUACIJSA-N 1 3 345.531 2.570 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1C[NH2+]CCc1ccccc1 ZINC001273010166 1265315659 /nfs/dbraw/zinc/31/56/59/1265315659.db2.gz FLKYFVQGXKOMNH-LJQANCHMSA-N 1 3 331.504 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccccc2C2CC2)[C@H]1C ZINC001410840215 1269721376 /nfs/dbraw/zinc/72/13/76/1269721376.db2.gz FXHFJIOUEBLKHA-OXQOHEQNSA-N 1 3 343.515 2.983 10 0 EFAEHO Cc1ccc(CN2CC[C@@]3(NC(=O)CC[NH+](C)C)CCC[C@@H]23)cc1F ZINC001410883730 1270033435 /nfs/dbraw/zinc/03/34/35/1270033435.db2.gz AKHITBLSISWSMH-QUCCMNQESA-N 1 3 347.478 2.699 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CCC(C)(C)C)[C@@H]2C1 ZINC001410912389 1270202780 /nfs/dbraw/zinc/20/27/80/1270202780.db2.gz FLLOYNJGQSHJRY-KSZLIROESA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1cc(F)ccc1CN1CC[C@]2(NC(=O)CC[NH+](C)C)CCC[C@H]12 ZINC001410917546 1270233683 /nfs/dbraw/zinc/23/36/83/1270233683.db2.gz WSQAIXVFYHHPFR-AZUAARDMSA-N 1 3 347.478 2.699 10 0 EFAEHO CC[NH2+][C@@H](CCNC(=O)[C@@H]1CCCCN1C(C)C)Cc1ccccc1 ZINC001410924755 1270281548 /nfs/dbraw/zinc/28/15/48/1270281548.db2.gz FUAMLGWTXAULDT-PMACEKPBSA-N 1 3 345.531 2.976 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCC[C@H]2CN(C(=O)CN(C)C3CCC3)C[C@H]21 ZINC001410927382 1270290037 /nfs/dbraw/zinc/29/00/37/1270290037.db2.gz PBDHVTJVZPTXNK-QXAKKESOSA-N 1 3 335.536 2.734 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@@H](C[NH2+]Cc3ccsc3)C2)CCC1 ZINC001410948893 1270380164 /nfs/dbraw/zinc/38/01/64/1270380164.db2.gz HPNWLDYXXAXPJG-GDBMZVCRSA-N 1 3 335.517 2.607 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)c1 ZINC001411022682 1270712915 /nfs/dbraw/zinc/71/29/15/1270712915.db2.gz REYPIYBMQXWTKO-SFHVURJKSA-N 1 3 331.504 2.662 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2C[C@H]([NH2+]C/C=C\Cl)C(C)(C)C2)c1 ZINC001411032343 1270732220 /nfs/dbraw/zinc/73/22/20/1270732220.db2.gz YYTASIZKVGJSHD-SKHCZCESSA-N 1 3 349.906 2.941 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc(C)c(F)c2)C(C)(C)C1 ZINC001411082511 1270938348 /nfs/dbraw/zinc/93/83/48/1270938348.db2.gz DJEODRDPLWBMMB-SFHVURJKSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H](NC(=O)CN(C)C(C)C)C(C)(C)C ZINC001411227525 1272071092 /nfs/dbraw/zinc/07/10/92/1272071092.db2.gz WDAAAUMCVRUKDB-SFHVURJKSA-N 1 3 333.520 2.956 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC001411231416 1272083799 /nfs/dbraw/zinc/08/37/99/1272083799.db2.gz BOSWWJAHBZOJEG-KRWDZBQOSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C2CC[NH+](CC3CCCC3)CC2)CC1 ZINC001411257771 1272166946 /nfs/dbraw/zinc/16/69/46/1272166946.db2.gz SOIAQRMGABLRFH-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO CC[N@H+](CCC1CCN(C[C@@H]2CN(C3CC3)C(=O)O2)CC1)CC1CC1 ZINC000844314065 1278859945 /nfs/dbraw/zinc/85/99/45/1278859945.db2.gz BNPAEDMLNNOPJI-LJQANCHMSA-N 1 3 349.519 2.804 10 0 EFAEHO CC[N@@H+](CCC1CCN(C[C@@H]2CN(C3CC3)C(=O)O2)CC1)CC1CC1 ZINC000844314065 1278859957 /nfs/dbraw/zinc/85/99/57/1278859957.db2.gz BNPAEDMLNNOPJI-LJQANCHMSA-N 1 3 349.519 2.804 10 0 EFAEHO COC(=O)/C(C)=C\C[NH2+]C1[C@H](C)CN(Cc2ccccc2)C[C@H]1C ZINC000787302469 1275751408 /nfs/dbraw/zinc/75/14/08/1275751408.db2.gz NROHMFIIVKQELT-FAQRCVTKSA-N 1 3 330.472 2.852 10 0 EFAEHO C[C@H]([NH2+][C@@H]1C[C@@H](N)c2ccccc21)[C@H](O)c1ccc2c(c1)OCO2 ZINC000817927135 1276360508 /nfs/dbraw/zinc/36/05/08/1276360508.db2.gz GWEVBFYISPJNAY-CQBORDEHSA-N 1 3 326.396 2.572 10 0 EFAEHO Cc1cccc(CN2C[C@H](NC(=O)[C@H](C(C)C)[NH+](C)C)C(C)(C)C2)c1 ZINC001410011709 1276524354 /nfs/dbraw/zinc/52/43/54/1276524354.db2.gz ATCWJRWEHCBOJW-OALUTQOASA-N 1 3 345.531 2.908 10 0 EFAEHO CN(C)c1ccc(NC(=O)CC[NH2+]C2CC(N3CCCCC3)C2)cc1 ZINC000819277656 1276725582 /nfs/dbraw/zinc/72/55/82/1276725582.db2.gz FGSKKAIMZJVAMC-UHFFFAOYSA-N 1 3 344.503 2.688 10 0 EFAEHO CN(C)c1ccc(NC(=O)CCNC2CC[NH+](C3CCC3)CC2)cc1 ZINC000819353538 1276740878 /nfs/dbraw/zinc/74/08/78/1276740878.db2.gz DKZMUFDIEFICKB-UHFFFAOYSA-N 1 3 344.503 2.688 10 0 EFAEHO CC(C)C[N@H+](C)CCCNC1CC2(C1)CN(C(=O)OC(C)(C)C)C2 ZINC000845995628 1279987814 /nfs/dbraw/zinc/98/78/14/1279987814.db2.gz FPZDCPLCIHVNOP-UHFFFAOYSA-N 1 3 339.524 2.953 10 0 EFAEHO CC(C)C[N@@H+](C)CCCNC1CC2(C1)CN(C(=O)OC(C)(C)C)C2 ZINC000845995628 1279987819 /nfs/dbraw/zinc/98/78/19/1279987819.db2.gz FPZDCPLCIHVNOP-UHFFFAOYSA-N 1 3 339.524 2.953 10 0 EFAEHO COC(=O)c1cc(CN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)ccc1C ZINC000872145686 1287443429 /nfs/dbraw/zinc/44/34/29/1287443429.db2.gz WLORUAMOURIGBS-BHIYHBOVSA-N 1 3 346.471 2.642 10 0 EFAEHO CN(CCCCCC[NH3+])CC(=O)N(C)Cc1c(F)cccc1Cl ZINC000872155625 1287450083 /nfs/dbraw/zinc/45/00/83/1287450083.db2.gz WXIWVLGJIVBVLY-UHFFFAOYSA-N 1 3 343.874 2.888 10 0 EFAEHO C[C@@H](C(=O)NCc1ccccc1Cl)N(C)CCCCCC[NH3+] ZINC000872155775 1287450097 /nfs/dbraw/zinc/45/00/97/1287450097.db2.gz ZDMZIQJWDQIJHJ-AWEZNQCLSA-N 1 3 325.884 2.796 10 0 EFAEHO CC(C)OC[C@@H](O)C[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000872205742 1287475930 /nfs/dbraw/zinc/47/59/30/1287475930.db2.gz GVHAQAGZKPNTGJ-UWHLTILDSA-N 1 3 346.515 2.663 10 0 EFAEHO C[NH+](C)CC1CCC(NC(=O)C2C[C@@H](c3ccccc3)OC2=O)CC1 ZINC000809732917 1282410993 /nfs/dbraw/zinc/41/09/93/1282410993.db2.gz RNMKLWVYCJUBHQ-KXIUCKCTSA-N 1 3 344.455 2.527 10 0 EFAEHO C[C@H]1CCCC[N@@H+]1CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000809967601 1282657668 /nfs/dbraw/zinc/65/76/68/1282657668.db2.gz CSSHAAQBQZFKLG-YJBOKZPZSA-N 1 3 327.488 2.580 10 0 EFAEHO C[C@H]1CCCC[N@H+]1CCCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC000809967601 1282657676 /nfs/dbraw/zinc/65/76/76/1282657676.db2.gz CSSHAAQBQZFKLG-YJBOKZPZSA-N 1 3 327.488 2.580 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCC([NH+]3CCCCC3)CC2)C1 ZINC000810189290 1283024638 /nfs/dbraw/zinc/02/46/38/1283024638.db2.gz NXMAMSZGRBAPOT-IBGZPJMESA-N 1 3 339.499 2.676 10 0 EFAEHO C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000810192219 1283027004 /nfs/dbraw/zinc/02/70/04/1283027004.db2.gz DYOAIVHOPRAATN-BEFAXECRSA-N 1 3 341.515 2.826 10 0 EFAEHO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC000810192219 1283027015 /nfs/dbraw/zinc/02/70/15/1283027015.db2.gz DYOAIVHOPRAATN-BEFAXECRSA-N 1 3 341.515 2.826 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCC[C@@H]2C[NH+]2CCCCC2)C1 ZINC000810334427 1283141712 /nfs/dbraw/zinc/14/17/12/1283141712.db2.gz FDHJTWKZCVFAJP-APWZRJJASA-N 1 3 339.499 2.676 10 0 EFAEHO C[NH+](C)CC[C@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C(C)(C)C ZINC000810412759 1283214026 /nfs/dbraw/zinc/21/40/26/1283214026.db2.gz JSIZTMDLMMJGQX-KSSFIOAISA-N 1 3 329.504 2.682 10 0 EFAEHO C[NH+](C)CC[C@@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)(C)C ZINC000810412760 1283214547 /nfs/dbraw/zinc/21/45/47/1283214547.db2.gz JSIZTMDLMMJGQX-RDTXWAMCSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)(C)N1CC[C@](F)(C(=O)N2CC[C@H](C[NH+]3CCCCC3)C2)C1 ZINC000810443169 1283245568 /nfs/dbraw/zinc/24/55/68/1283245568.db2.gz LKNOLEUREHVOKX-VQIMIIECSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810444878 1283246329 /nfs/dbraw/zinc/24/63/29/1283246329.db2.gz AACAFWPQAOGDQZ-MAUKXSAKSA-N 1 3 327.488 2.532 10 0 EFAEHO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC000810444878 1283246333 /nfs/dbraw/zinc/24/63/33/1283246333.db2.gz AACAFWPQAOGDQZ-MAUKXSAKSA-N 1 3 327.488 2.532 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)[C@H](N)C(C)(C)C)CC[N@@H+]1Cc1ccccc1 ZINC000952845092 1284861505 /nfs/dbraw/zinc/86/15/05/1284861505.db2.gz AHZCIDWNXUHTGL-NXHRZFHOSA-N 1 3 331.504 2.871 10 0 EFAEHO C[C@@H]1C[C@H](N(C)C(=O)[C@H](N)C(C)(C)C)CC[N@H+]1Cc1ccccc1 ZINC000952845092 1284861522 /nfs/dbraw/zinc/86/15/22/1284861522.db2.gz AHZCIDWNXUHTGL-NXHRZFHOSA-N 1 3 331.504 2.871 10 0 EFAEHO COCCC[NH+]1CCC2(CC1)CN(Cc1ccccc1)C[C@H](C)O2 ZINC000952995392 1285023707 /nfs/dbraw/zinc/02/37/07/1285023707.db2.gz KTAMMRSNUOXYNO-SFHVURJKSA-N 1 3 332.488 2.778 10 0 EFAEHO CC(C)c1ncsc1NC(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC000823699605 1289415868 /nfs/dbraw/zinc/41/58/68/1289415868.db2.gz KATKOTHTYSUJFQ-ZDUSSCGKSA-N 1 3 341.525 2.660 10 0 EFAEHO CC(C)c1ncsc1NC(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC000823699605 1289415871 /nfs/dbraw/zinc/41/58/71/1289415871.db2.gz KATKOTHTYSUJFQ-ZDUSSCGKSA-N 1 3 341.525 2.660 10 0 EFAEHO CC[C@H](C)[C@@H]1CN(Cc2ccc(C)nc2)CCN1C[C@@H]1C[NH2+]C[C@H]1C ZINC000903457554 1312711073 /nfs/dbraw/zinc/71/10/73/1312711073.db2.gz WXKLZZDIXCGQAA-JWWGGVBKSA-N 1 3 344.547 2.778 10 0 EFAEHO Brc1ccc2c(c1)[C@H]1[C@H](NC3C[C@H]4CC[C@@H](C3)[NH2+]4)[C@H]1C2 ZINC000873276813 1289697544 /nfs/dbraw/zinc/69/75/44/1289697544.db2.gz XIVWJBXUIQICLN-RLKDUZNASA-N 1 3 333.273 2.960 10 0 EFAEHO CC[C@@H](c1ccc(F)cc1F)N1C[C@@H]2C[C@@H]([NH3+])C[C@]2(C(=O)OC)C1 ZINC000903492566 1312765685 /nfs/dbraw/zinc/76/56/85/1312765685.db2.gz FINBCDIKMMANGM-RPQBCRGMSA-N 1 3 338.398 2.628 10 0 EFAEHO C[C@@H]1CN(CC(=O)N[C@H](c2cccs2)C(C)(C)C)C[C@H]1CC[NH3+] ZINC000903496874 1312772577 /nfs/dbraw/zinc/77/25/77/1312772577.db2.gz IKHQOVWJMZOOLV-CKEIUWERSA-N 1 3 337.533 2.868 10 0 EFAEHO CCOc1ccccc1[C@H](CC)NC(=O)CN1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903496970 1312774040 /nfs/dbraw/zinc/77/40/40/1312774040.db2.gz LMDAQAHLMPOPQS-NUJGCVRESA-N 1 3 347.503 2.569 10 0 EFAEHO C([C@H]1CC2(CO1)CCOCC2)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000878286489 1291601765 /nfs/dbraw/zinc/60/17/65/1291601765.db2.gz PFFNQJLJMIBITD-BHIYHBOVSA-N 1 3 334.504 2.521 10 0 EFAEHO C([C@H]1CC2(CO1)CCOCC2)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000878286489 1291601772 /nfs/dbraw/zinc/60/17/72/1291601772.db2.gz PFFNQJLJMIBITD-BHIYHBOVSA-N 1 3 334.504 2.521 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[NH2+][C@H]1CCc2ccccc21)N(C)C ZINC001276339634 1292949050 /nfs/dbraw/zinc/94/90/50/1292949050.db2.gz IHIIUANEWQDNRS-OALUTQOASA-N 1 3 331.504 2.698 10 0 EFAEHO CCCCC[NH+]1CC([C@@H](C)NC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001276432496 1313058543 /nfs/dbraw/zinc/05/85/43/1313058543.db2.gz NLYWYJLCQBAKPS-DNVCBOLYSA-N 1 3 341.515 2.826 10 0 EFAEHO c1cc([C@@H]2CCCN2C[C@@H]2CC3(CO2)CC[NH2+]CC3)cc2c1OCO2 ZINC000903729691 1313130204 /nfs/dbraw/zinc/13/02/04/1313130204.db2.gz QNFCJLZXPDVBBE-IRXDYDNUSA-N 1 3 344.455 2.711 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C/CNCc2ccc(F)cc2C)CC[N@@H+]1C ZINC001274035261 1295433031 /nfs/dbraw/zinc/43/30/31/1295433031.db2.gz JOIYQUUZEDMYPP-OBNUAKFSSA-N 1 3 347.478 2.626 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC/C=C/CNCc2ccc(F)cc2C)CC[N@H+]1C ZINC001274035261 1295433052 /nfs/dbraw/zinc/43/30/52/1295433052.db2.gz JOIYQUUZEDMYPP-OBNUAKFSSA-N 1 3 347.478 2.626 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C\CNC(=O)[C@H](C(C)C)N(C)C)c(C)c1 ZINC001274517963 1296099346 /nfs/dbraw/zinc/09/93/46/1296099346.db2.gz AEZNPZKCZBBLHG-FQQSSWHASA-N 1 3 331.504 2.652 10 0 EFAEHO Cc1ccc(F)c(C[N@@H+](CCCNC(=O)[C@@H]2CCCN2C)C(C)C)c1 ZINC001691707431 1296486952 /nfs/dbraw/zinc/48/69/52/1296486952.db2.gz MRBJEYUOZJTFDH-IBGZPJMESA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(C[N@H+](CCCNC(=O)[C@@H]2CCCN2C)C(C)C)c1 ZINC001691707431 1296486957 /nfs/dbraw/zinc/48/69/57/1296486957.db2.gz MRBJEYUOZJTFDH-IBGZPJMESA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(C(=O)NCCN[C@H]2CC[NH2+]C[C@H]2C2CCCC2)cc1F ZINC000925535363 1296850311 /nfs/dbraw/zinc/85/03/11/1296850311.db2.gz FLGZKYGJTXKNRR-HKUYNNGSSA-N 1 3 347.478 2.622 10 0 EFAEHO CC1(C)C[C@@H]([NH3+])C[C@H](NCc2ccc(Cn3ccccc3=O)cc2)C1 ZINC000925582991 1296861657 /nfs/dbraw/zinc/86/16/57/1296861657.db2.gz BTWOPDJFQWENMN-OALUTQOASA-N 1 3 339.483 2.892 10 0 EFAEHO Cn1cc(CC[NH2+][C@H]2CCNC[C@@H]2C2CCCC2)c2cccnc21 ZINC000925725857 1296873436 /nfs/dbraw/zinc/87/34/36/1296873436.db2.gz CORFFZBYHNHDML-MOPGFXCFSA-N 1 3 326.488 2.874 10 0 EFAEHO C[C@H]([NH2+]CC[S@@](=O)CC(F)(F)F)c1cccc(CN(C)C)c1 ZINC000926684086 1296949528 /nfs/dbraw/zinc/94/95/28/1296949528.db2.gz RNPIASDASHRJJY-AMXDTQDGSA-N 1 3 336.423 2.710 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN2CCC(Cc3ccccc3)CC2)cnn1C ZINC000903872029 1313324042 /nfs/dbraw/zinc/32/40/42/1313324042.db2.gz BFSYHEQQVMLJTQ-FQEVSTJZSA-N 1 3 340.515 2.801 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CN2CCC(Cc3ccccc3)CC2)cnn1C ZINC000903872030 1313325025 /nfs/dbraw/zinc/32/50/25/1313325025.db2.gz BFSYHEQQVMLJTQ-HXUWFJFHSA-N 1 3 340.515 2.801 10 0 EFAEHO Cc1c(C[C@@H](C[NH3+])CN2CCCCC[C@@H]2c2ccncc2)cnn1C ZINC000903872859 1313326136 /nfs/dbraw/zinc/32/61/36/1313326136.db2.gz KIDBFKZCTVCLGS-FXAWDEMLSA-N 1 3 341.503 2.858 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+]2CCC[C@@H]2Cc2ccccc2)cnn1C ZINC000903878941 1313335901 /nfs/dbraw/zinc/33/59/01/1313335901.db2.gz NUCFSKBLRLDIMI-AZUAARDMSA-N 1 3 326.488 2.553 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+]2CCC[C@@H]2Cc2ccccc2)cnn1C ZINC000903878941 1313335905 /nfs/dbraw/zinc/33/59/05/1313335905.db2.gz NUCFSKBLRLDIMI-AZUAARDMSA-N 1 3 326.488 2.553 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2CCC[C@H]2Cc2ccccc2)cnn1C ZINC000903878943 1313336264 /nfs/dbraw/zinc/33/62/64/1313336264.db2.gz NUCFSKBLRLDIMI-QUCCMNQESA-N 1 3 326.488 2.553 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2CCC[C@H]2Cc2ccccc2)cnn1C ZINC000903878943 1313336268 /nfs/dbraw/zinc/33/62/68/1313336268.db2.gz NUCFSKBLRLDIMI-QUCCMNQESA-N 1 3 326.488 2.553 10 0 EFAEHO CN1CCCC[C@H]1CC[N@H+](C)C[C@H](O)CC[C@H](O)c1ccccc1 ZINC000929720226 1297201746 /nfs/dbraw/zinc/20/17/46/1297201746.db2.gz BVFPKJFAVQSFQN-ZCNNSNEGSA-N 1 3 334.504 2.667 10 0 EFAEHO CN1CCCC[C@H]1CC[N@@H+](C)C[C@H](O)CC[C@H](O)c1ccccc1 ZINC000929720226 1297201756 /nfs/dbraw/zinc/20/17/56/1297201756.db2.gz BVFPKJFAVQSFQN-ZCNNSNEGSA-N 1 3 334.504 2.667 10 0 EFAEHO CN1CCCC[C@H]1CC[N@H+](C)C[C@@H](O)CC[C@@H](O)c1ccccc1 ZINC000929720222 1297201850 /nfs/dbraw/zinc/20/18/50/1297201850.db2.gz BVFPKJFAVQSFQN-SLFFLAALSA-N 1 3 334.504 2.667 10 0 EFAEHO CN1CCCC[C@H]1CC[N@@H+](C)C[C@@H](O)CC[C@@H](O)c1ccccc1 ZINC000929720222 1297201853 /nfs/dbraw/zinc/20/18/53/1297201853.db2.gz BVFPKJFAVQSFQN-SLFFLAALSA-N 1 3 334.504 2.667 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+](C)CCc2ccc(Cl)cc2)cnn1C ZINC000903889316 1313358042 /nfs/dbraw/zinc/35/80/42/1313358042.db2.gz QTEFUEVODNKUGV-INIZCTEOSA-N 1 3 334.895 2.674 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+](C)CCc2ccc(Cl)cc2)cnn1C ZINC000903889316 1313358046 /nfs/dbraw/zinc/35/80/46/1313358046.db2.gz QTEFUEVODNKUGV-INIZCTEOSA-N 1 3 334.895 2.674 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+](C)CCc2ccc(Cl)cc2)cnn1C ZINC000903889317 1313358241 /nfs/dbraw/zinc/35/82/41/1313358241.db2.gz QTEFUEVODNKUGV-MRXNPFEDSA-N 1 3 334.895 2.674 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+](C)CCc2ccc(Cl)cc2)cnn1C ZINC000903889317 1313358245 /nfs/dbraw/zinc/35/82/45/1313358245.db2.gz QTEFUEVODNKUGV-MRXNPFEDSA-N 1 3 334.895 2.674 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@H+]2C[C@H](c3ccccc3)C[C@@H]2C)cnn1C ZINC000903895655 1313369960 /nfs/dbraw/zinc/36/99/60/1313369960.db2.gz POAZDESIXXIWAI-XAUMDUMWSA-N 1 3 326.488 2.724 10 0 EFAEHO Cc1c(C[C@H](CN)C[N@@H+]2C[C@H](c3ccccc3)C[C@@H]2C)cnn1C ZINC000903895655 1313369965 /nfs/dbraw/zinc/36/99/65/1313369965.db2.gz POAZDESIXXIWAI-XAUMDUMWSA-N 1 3 326.488 2.724 10 0 EFAEHO CC[C@H](Cc1ccc(C)cc1)N(C)Cc1cnnn1[C@H]1CCC[NH2+]C1 ZINC000903898497 1313375939 /nfs/dbraw/zinc/37/59/39/1313375939.db2.gz NYZJPMRRSMBQRN-MOPGFXCFSA-N 1 3 341.503 2.964 10 0 EFAEHO CCN(C[C@@H](C[NH3+])Cc1cnn(C)c1C)[C@@H](C)c1cccc(O)c1 ZINC000903904208 1313385709 /nfs/dbraw/zinc/38/57/09/1313385709.db2.gz RITPVCTUKISWLF-JKSUJKDBSA-N 1 3 330.476 2.635 10 0 EFAEHO CC1CCN(CC(=O)N2CCC[C@@H]2C[NH2+]CCC2CCCC2)CC1 ZINC001277966735 1313389854 /nfs/dbraw/zinc/38/98/54/1313389854.db2.gz WYAPAQGLOFGVJR-LJQANCHMSA-N 1 3 335.536 2.879 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@@H+]2CCC[C@@]2(C)Cc2ccccc2)cnn1C ZINC000903914605 1313406386 /nfs/dbraw/zinc/40/63/86/1313406386.db2.gz JRTJNUNSOCVRNS-FPOVZHCZSA-N 1 3 340.515 2.943 10 0 EFAEHO Cc1c(C[C@@H](CN)C[N@H+]2CCC[C@@]2(C)Cc2ccccc2)cnn1C ZINC000903914605 1313406389 /nfs/dbraw/zinc/40/63/89/1313406389.db2.gz JRTJNUNSOCVRNS-FPOVZHCZSA-N 1 3 340.515 2.943 10 0 EFAEHO CC[C@@H](C)C[NH2+][C@H]1C[C@@H](CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001488774541 1297739910 /nfs/dbraw/zinc/73/99/10/1297739910.db2.gz VPSPFURCZJTJDR-JEWRLFTDSA-N 1 3 341.515 2.729 10 0 EFAEHO Cc1c(C[C@H](C[NH3+])CNC2(c3ccccc3C)CCC2)cnn1C ZINC000903931793 1313438057 /nfs/dbraw/zinc/43/80/57/1313438057.db2.gz IESNMYODZUICIR-QGZVFWFLSA-N 1 3 326.488 2.823 10 0 EFAEHO CCc1cccc(C[NH2+][C@@H]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001488967199 1297913092 /nfs/dbraw/zinc/91/30/92/1297913092.db2.gz DEYXJGDKDNMKHX-VQTJNVASSA-N 1 3 345.531 2.964 10 0 EFAEHO COc1ccc(C(C)(C)NC[C@H](C[NH3+])Cc2cnn(C)c2C)cc1F ZINC000903936190 1313447021 /nfs/dbraw/zinc/44/70/21/1313447021.db2.gz ZBMZLQKJVOQNCP-AWEZNQCLSA-N 1 3 348.466 2.519 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN(C)CC(C)(C)C ZINC001489048183 1297956576 /nfs/dbraw/zinc/95/65/76/1297956576.db2.gz HOCODFVZJKIDTQ-IKGGRYGDSA-N 1 3 343.531 2.929 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H](C(C)C)N2CCCCC2)CC[N@@H+]1CCCF ZINC001489148073 1298082860 /nfs/dbraw/zinc/08/28/60/1298082860.db2.gz WFVYGAZAUHLGMR-RCCFBDPRSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@@H]1[C@@H](NC(=O)[C@@H](C(C)C)N2CCCCC2)CC[N@H+]1CCCF ZINC001489148073 1298082871 /nfs/dbraw/zinc/08/28/71/1298082871.db2.gz WFVYGAZAUHLGMR-RCCFBDPRSA-N 1 3 341.515 2.826 10 0 EFAEHO FC1(F)CCNC[C@@H]1C[NH2+]Cc1cccc(OCc2ccccn2)c1 ZINC000903955131 1313481311 /nfs/dbraw/zinc/48/13/11/1313481311.db2.gz KZHRAXRBEYDPGJ-MRXNPFEDSA-N 1 3 347.409 2.995 10 0 EFAEHO C[C@@H]1CN(Cc2ccccc2I)C[C@H]1CC[NH3+] ZINC000903977269 1313526410 /nfs/dbraw/zinc/52/64/10/1313526410.db2.gz NGNFPLXZSUNTSF-VXGBXAGGSA-N 1 3 344.240 2.708 10 0 EFAEHO C[C@H](c1ccccc1F)N(C)CCCNC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001490196794 1298627083 /nfs/dbraw/zinc/62/70/83/1298627083.db2.gz RGMGHBCVXQPMEE-QAPCUYQASA-N 1 3 347.478 2.667 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C)Cc1ccc(Cl)cc1)N(C)C ZINC001490271978 1298697694 /nfs/dbraw/zinc/69/76/94/1298697694.db2.gz WLNOVXWNTOVDLU-MRXNPFEDSA-N 1 3 325.884 2.618 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C)Cc1ccc(Cl)cc1)N(C)C ZINC001490271978 1298697702 /nfs/dbraw/zinc/69/77/02/1298697702.db2.gz WLNOVXWNTOVDLU-MRXNPFEDSA-N 1 3 325.884 2.618 10 0 EFAEHO CCN(C/C=C\Cl)CCCNC(=O)[C@H](C)[NH+]1CCCCCC1 ZINC001490348968 1298744157 /nfs/dbraw/zinc/74/41/57/1298744157.db2.gz LSCSCTFIJKUSEN-YHWKNFMLSA-N 1 3 329.916 2.832 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CCN(CCc2ccccc2)C1)[NH+](CC)CC ZINC001490560884 1298984349 /nfs/dbraw/zinc/98/43/49/1298984349.db2.gz ZPPWKKWECROFKL-RBUKOAKNSA-N 1 3 331.504 2.540 10 0 EFAEHO Cc1ccccc1CN1CC[C@@H](NC(=O)CCCC[NH+]2CCCC2)C1 ZINC001490580943 1298998051 /nfs/dbraw/zinc/99/80/51/1298998051.db2.gz RLZBFOBVTGRKOM-HXUWFJFHSA-N 1 3 343.515 2.952 10 0 EFAEHO Cc1ccc(CN2CCC3(C[C@@H]3NC(=O)CC[NH+](C)C)CC2)cc1F ZINC001490600075 1299024675 /nfs/dbraw/zinc/02/46/75/1299024675.db2.gz VQSOVHQXYYYHSR-SFHVURJKSA-N 1 3 347.478 2.557 10 0 EFAEHO Cc1cccc(C[NH+]2CCC3(C[C@H]3NC(=O)CN(C)C(C)C)CC2)c1 ZINC001490611670 1299037558 /nfs/dbraw/zinc/03/75/58/1299037558.db2.gz YVQOYXPYYPZDEM-LJQANCHMSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](CNC(=O)C(C)(C)N2CCCC2)C2CC2)c1 ZINC001490694877 1299148001 /nfs/dbraw/zinc/14/80/01/1299148001.db2.gz RNXSCPUUOZLTFE-LJQANCHMSA-N 1 3 343.515 2.854 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](CNC(=O)C(C)(C)N2CCCC2)C2CC2)c1 ZINC001490694875 1299148345 /nfs/dbraw/zinc/14/83/45/1299148345.db2.gz RNXSCPUUOZLTFE-IBGZPJMESA-N 1 3 343.515 2.854 10 0 EFAEHO Cc1ccc(CN[C@@H](CNC(=O)[C@H]2CC[N@@H+](C)C2)C2CC2)c(Cl)c1 ZINC001490739730 1299176330 /nfs/dbraw/zinc/17/63/30/1299176330.db2.gz LAOVRKOTPOJFHX-WMZOPIPTSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1ccc(CN[C@@H](CNC(=O)[C@H]2CC[N@H+](C)C2)C2CC2)c(Cl)c1 ZINC001490739730 1299176334 /nfs/dbraw/zinc/17/63/34/1299176334.db2.gz LAOVRKOTPOJFHX-WMZOPIPTSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1ccccc1[C@@H](C)[NH2+][C@@H](CNC(=O)CN(C)C(C)C)C1CC1 ZINC001490740527 1299178164 /nfs/dbraw/zinc/17/81/64/1299178164.db2.gz DDAAITXMJBSGHZ-APWZRJJASA-N 1 3 331.504 2.881 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC[C@H](CN(C)C/C=C/Cl)C2)CC[N@@H+]1C ZINC001490769023 1299218973 /nfs/dbraw/zinc/21/89/73/1299218973.db2.gz YTXZMJYPQMTEJI-ZFISUJSUSA-N 1 3 341.927 2.640 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)N2CCC[C@H](CN(C)C/C=C/Cl)C2)CC[N@H+]1C ZINC001490769023 1299218981 /nfs/dbraw/zinc/21/89/81/1299218981.db2.gz YTXZMJYPQMTEJI-ZFISUJSUSA-N 1 3 341.927 2.640 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](C[N@H+](C)CCC2CC2)C1 ZINC001490781854 1299250836 /nfs/dbraw/zinc/25/08/36/1299250836.db2.gz ATSAEAQZZKFQJH-RTBURBONSA-N 1 3 335.536 2.831 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](C[N@@H+](C)CCC2CC2)C1 ZINC001490781854 1299250847 /nfs/dbraw/zinc/25/08/47/1299250847.db2.gz ATSAEAQZZKFQJH-RTBURBONSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H](F)CC[NH2+]CC[C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001326364630 1329750588 /nfs/dbraw/zinc/75/05/88/1329750588.db2.gz LCWQKAGQDJGXTP-JKSUJKDBSA-N 1 3 329.504 2.541 10 0 EFAEHO C[S@](=O)CC[N@@H+]1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000854044307 1300403701 /nfs/dbraw/zinc/40/37/01/1300403701.db2.gz FUYLAOORDKQCJZ-CYFREDJKSA-N 1 3 348.556 2.988 10 0 EFAEHO C[S@](=O)CC[N@H+]1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1 ZINC000854044307 1300403706 /nfs/dbraw/zinc/40/37/06/1300403706.db2.gz FUYLAOORDKQCJZ-CYFREDJKSA-N 1 3 348.556 2.988 10 0 EFAEHO Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000854515639 1300605220 /nfs/dbraw/zinc/60/52/20/1300605220.db2.gz YAZFNWNQZWAPOO-JSFADZTLSA-N 1 3 341.499 2.860 10 0 EFAEHO Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000854515639 1300605228 /nfs/dbraw/zinc/60/52/28/1300605228.db2.gz YAZFNWNQZWAPOO-JSFADZTLSA-N 1 3 341.499 2.860 10 0 EFAEHO CN1CC[C@]2(CC[N@H+](C[C@H](O)COc3ccc4ccccc4c3)C2)C1 ZINC000795333457 1300788658 /nfs/dbraw/zinc/78/86/58/1300788658.db2.gz KXGXICZMBSVEMO-FPOVZHCZSA-N 1 3 340.467 2.607 10 0 EFAEHO CN1CC[C@]2(CC[N@@H+](C[C@H](O)COc3ccc4ccccc4c3)C2)C1 ZINC000795333457 1300788664 /nfs/dbraw/zinc/78/86/64/1300788664.db2.gz KXGXICZMBSVEMO-FPOVZHCZSA-N 1 3 340.467 2.607 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@H]1CCC[C@H]1c1ccccc1 ZINC000855347123 1300924649 /nfs/dbraw/zinc/92/46/49/1300924649.db2.gz UMOOVBZQTIQWEP-IHPCNDPISA-N 1 3 345.531 2.959 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@H]1CCC[C@H]1c1ccccc1 ZINC000855347123 1300924654 /nfs/dbraw/zinc/92/46/54/1300924654.db2.gz UMOOVBZQTIQWEP-IHPCNDPISA-N 1 3 345.531 2.959 10 0 EFAEHO CCN(Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1CN(C2CC2)C(=O)O1 ZINC000859997130 1301668357 /nfs/dbraw/zinc/66/83/57/1301668357.db2.gz IUJGSJSCDJAVPA-GOSISDBHSA-N 1 3 331.460 2.553 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@H]2C[N@H+](C)CCCCCF)CCC1 ZINC001281940315 1313822970 /nfs/dbraw/zinc/82/29/70/1313822970.db2.gz RVQSESUXJIPNPP-INIZCTEOSA-N 1 3 327.488 2.533 10 0 EFAEHO CN(C)C1(C(=O)N2CCC[C@H]2C[N@@H+](C)CCCCCF)CCC1 ZINC001281940315 1313822974 /nfs/dbraw/zinc/82/29/74/1313822974.db2.gz RVQSESUXJIPNPP-INIZCTEOSA-N 1 3 327.488 2.533 10 0 EFAEHO CN1CCCC[C@H](C[NH2+]CC2(CNC(=O)OC(C)(C)C)CC2)C1 ZINC000862483145 1302395843 /nfs/dbraw/zinc/39/58/43/1302395843.db2.gz PFAOYTXVBSLBLB-OAHLLOKOSA-N 1 3 325.497 2.613 10 0 EFAEHO C[C@H](CCCCN1C(=O)c2ccccc2C1=O)N[C@H]1CC[C@@H](C)[NH2+]C1 ZINC000863548284 1302644484 /nfs/dbraw/zinc/64/44/84/1302644484.db2.gz WSUMXUHXZFGWPY-OAGGEKHMSA-N 1 3 343.471 2.572 10 0 EFAEHO C[C@H](CCc1cncc2ccccc21)NC[C@@H](O)C[NH+]1CCCC1 ZINC000866242186 1303576951 /nfs/dbraw/zinc/57/69/51/1303576951.db2.gz AWKKOSMVNJRONR-VQIMIIECSA-N 1 3 327.472 2.602 10 0 EFAEHO CC[N@@H+]1CC[C@H](NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)[C@@H](C)C1 ZINC000866557652 1303683739 /nfs/dbraw/zinc/68/37/39/1303683739.db2.gz CCLZSHPVNACKGW-JBACZVJFSA-N 1 3 345.531 2.516 10 0 EFAEHO CC[N@H+]1CC[C@H](NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)[C@@H](C)C1 ZINC000866557652 1303683746 /nfs/dbraw/zinc/68/37/46/1303683746.db2.gz CCLZSHPVNACKGW-JBACZVJFSA-N 1 3 345.531 2.516 10 0 EFAEHO CCOCCCN1CC[C@H]([NH2+]C[C@H]2c3ccccc3CN2C)[C@@H](C)C1 ZINC000866561833 1303687756 /nfs/dbraw/zinc/68/77/56/1303687756.db2.gz MIVJICVCJADRSI-YYWHXJBOSA-N 1 3 345.531 2.900 10 0 EFAEHO C[C@@H]1C[C@@H](N[C@H]2COc3cccc(Br)c3C2)CC[N@@H+]1C ZINC000866594575 1303702322 /nfs/dbraw/zinc/70/23/22/1303702322.db2.gz IAUBFUIZMAIJKW-FRRDWIJNSA-N 1 3 339.277 2.825 10 0 EFAEHO C[C@@H]1C[C@@H](N[C@H]2COc3cccc(Br)c3C2)CC[N@H+]1C ZINC000866594575 1303702326 /nfs/dbraw/zinc/70/23/26/1303702326.db2.gz IAUBFUIZMAIJKW-FRRDWIJNSA-N 1 3 339.277 2.825 10 0 EFAEHO CC[N@@H+]1CC[C@@H](N[C@H]2C[C@H](C(=O)OCc3ccccc3)C2)[C@H](C)C1 ZINC000866603666 1303706690 /nfs/dbraw/zinc/70/66/90/1303706690.db2.gz DJVVIAVNXLNVMI-NXWXRZEISA-N 1 3 330.472 2.828 10 0 EFAEHO CC[N@H+]1CC[C@@H](N[C@H]2C[C@H](C(=O)OCc3ccccc3)C2)[C@H](C)C1 ZINC000866603666 1303706697 /nfs/dbraw/zinc/70/66/97/1303706697.db2.gz DJVVIAVNXLNVMI-NXWXRZEISA-N 1 3 330.472 2.828 10 0 EFAEHO CC(C)c1ccc([C@H](C)N2CC[C@H](N3C(=O)O[C@H]4C[NH2+]C[C@H]43)C2)cc1 ZINC000866712174 1303761835 /nfs/dbraw/zinc/76/18/35/1303761835.db2.gz RIHPXTLAHNESFX-FZDIXFNVSA-N 1 3 343.471 2.738 10 0 EFAEHO C[NH+](C)C1(C)CCC(NC(=O)NC[C@H]2CCCCN2C2CC2)CC1 ZINC000868545143 1304348464 /nfs/dbraw/zinc/34/84/64/1304348464.db2.gz MZVZPBJPLIYVEG-URSIVYNOSA-N 1 3 336.524 2.565 10 0 EFAEHO CC1CCN([C@H](CNC(=O)[C@]23C[C@H]2C[C@H]([NH3+])C3)c2ccccc2)CC1 ZINC000870871743 1305642832 /nfs/dbraw/zinc/64/28/32/1305642832.db2.gz LPXBFGFXUGURRJ-HDAAZOAOSA-N 1 3 341.499 2.703 10 0 EFAEHO Cc1ccc([C@@H](CNC(=O)CCC23CC(C2)C[NH2+]3)N2CCCC2)cc1 ZINC000870875557 1305645374 /nfs/dbraw/zinc/64/53/74/1305645374.db2.gz GBLIVUMMUOEASI-MOMVYJMYSA-N 1 3 341.499 2.780 10 0 EFAEHO CC(C)CC[NH2+]C[C@@H](NC(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CC1 ZINC001276655342 1314196177 /nfs/dbraw/zinc/19/61/77/1314196177.db2.gz AKUPPYCMTKERHI-APWZRJJASA-N 1 3 341.515 2.729 10 0 EFAEHO C[NH+](C)C[C@@H]1CCCCN1C(=O)c1ccc(NC2=NCCC2)cc1 ZINC000900560661 1308316040 /nfs/dbraw/zinc/31/60/40/1308316040.db2.gz ADCJGTZMHOMBQD-KRWDZBQOSA-N 1 3 328.460 2.847 10 0 EFAEHO CN(C(=O)c1ccc(NC2=NCCC2)cc1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000900666783 1308497136 /nfs/dbraw/zinc/49/71/36/1308497136.db2.gz WEVYPLBQXBIOMX-QGZVFWFLSA-N 1 3 326.444 2.600 10 0 EFAEHO CN(C(=O)c1ccc(NC2=NCCC2)cc1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000900666783 1308497137 /nfs/dbraw/zinc/49/71/37/1308497137.db2.gz WEVYPLBQXBIOMX-QGZVFWFLSA-N 1 3 326.444 2.600 10 0 EFAEHO O=C(c1ccc(NC2=NCCC2)cc1)N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000900792048 1308687720 /nfs/dbraw/zinc/68/77/20/1308687720.db2.gz CGCUQNNCRYCZAZ-INIZCTEOSA-N 1 3 340.471 2.849 10 0 EFAEHO CC[N@H+](C)C[C@@H]1CCN(C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900890038 1308836558 /nfs/dbraw/zinc/83/65/58/1308836558.db2.gz LYFRVYSUNMGVKM-HNNXBMFYSA-N 1 3 328.460 2.705 10 0 EFAEHO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(NC3=NCCC3)cc2)C1 ZINC000900890038 1308836564 /nfs/dbraw/zinc/83/65/64/1308836564.db2.gz LYFRVYSUNMGVKM-HNNXBMFYSA-N 1 3 328.460 2.705 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@H+](CC3CCCC3)CC[C@@H]21 ZINC001490984655 1311149498 /nfs/dbraw/zinc/14/94/98/1311149498.db2.gz UTLZWGUXNUKPOP-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]2C[N@@H+](CC3CCCC3)CC[C@@H]21 ZINC001490984655 1311149499 /nfs/dbraw/zinc/14/94/99/1311149499.db2.gz UTLZWGUXNUKPOP-OALUTQOASA-N 1 3 335.536 2.830 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CCC[C@@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001277209206 1311806910 /nfs/dbraw/zinc/80/69/10/1311806910.db2.gz DRUBUEQQVOUGPN-MRXNPFEDSA-N 1 3 349.494 2.993 10 0 EFAEHO CCCCC[N@@H+]1CC[C@@H](C2CCN(C(=O)[C@@H]3CCCN3C)CC2)C1 ZINC001277276413 1311911843 /nfs/dbraw/zinc/91/18/43/1311911843.db2.gz ZLVQNHWELBKGRK-MOPGFXCFSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCCC[N@H+]1CC[C@@H](C2CCN(C(=O)[C@@H]3CCCN3C)CC2)C1 ZINC001277276413 1311911847 /nfs/dbraw/zinc/91/18/47/1311911847.db2.gz ZLVQNHWELBKGRK-MOPGFXCFSA-N 1 3 335.536 2.831 10 0 EFAEHO O[C@H](C[NH2+][C@@H](CCc1ccccc1)c1cccnc1)CN1CCCC1 ZINC000902762230 1312084826 /nfs/dbraw/zinc/08/48/26/1312084826.db2.gz JCOXNPZQABIIFQ-RTWAWAEBSA-N 1 3 339.483 2.802 10 0 EFAEHO CN1CCC(O)(C[NH2+][C@H](CCc2cccnc2)c2ccccc2)CC1 ZINC000902814069 1312128251 /nfs/dbraw/zinc/12/82/51/1312128251.db2.gz MCXNIGRISPLMSZ-HXUWFJFHSA-N 1 3 339.483 2.802 10 0 EFAEHO COc1ccc2c(c1)C[C@H](C)C[C@H]2[NH2+]CCN1CCN(C)C(C)(C)C1 ZINC000902982162 1312259796 /nfs/dbraw/zinc/25/97/96/1312259796.db2.gz WKXZASXBIGYLND-OXJNMPFZSA-N 1 3 345.531 2.934 10 0 EFAEHO C[C@H](CN[C@@H](C)C1(NC(=O)OC(C)(C)C)CC1)C[NH+]1CCCC1 ZINC000903071729 1312325540 /nfs/dbraw/zinc/32/55/40/1312325540.db2.gz AQXPFTUOZDHGHW-CABCVRRESA-N 1 3 325.497 2.754 10 0 EFAEHO C[C@H](C[NH2+][C@@H](C)C1(NC(=O)OC(C)(C)C)CC1)CN1CCCC1 ZINC000903071729 1312325545 /nfs/dbraw/zinc/32/55/45/1312325545.db2.gz AQXPFTUOZDHGHW-CABCVRRESA-N 1 3 325.497 2.754 10 0 EFAEHO C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NC1CC[NH+](CC2CC2)CC1 ZINC000903144562 1312405422 /nfs/dbraw/zinc/40/54/22/1312405422.db2.gz GERKAMINNRKCCE-RHSMWYFYSA-N 1 3 337.508 2.706 10 0 EFAEHO [NH3+][C@@H]1CC[C@H](CN2CCN(C(=O)c3cccc4ccccc43)CC2)C1 ZINC000903431509 1312667707 /nfs/dbraw/zinc/66/77/07/1312667707.db2.gz XMUXDOFQUGFZLH-FUHWJXTLSA-N 1 3 337.467 2.725 10 0 EFAEHO Cc1ccc(CCC[NH2+][C@H]2C[C@@H](C)N(C(=O)CN(C)C(C)C)C2)cc1 ZINC001278425058 1314564382 /nfs/dbraw/zinc/56/43/82/1314564382.db2.gz YWACRNDOMFZGAR-QUCCMNQESA-N 1 3 345.531 2.847 10 0 EFAEHO CC(C)=CC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN3CCC(C)CC3)C[C@H]21 ZINC001278487260 1314790471 /nfs/dbraw/zinc/79/04/71/1314790471.db2.gz NBBNVYQHNIISPY-VAMGGRTRSA-N 1 3 347.547 2.901 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001318301171 1328550522 /nfs/dbraw/zinc/55/05/22/1328550522.db2.gz OCNHKSROQVPIRN-VOFKWLDRSA-N 1 3 329.488 2.909 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001318301171 1328550525 /nfs/dbraw/zinc/55/05/25/1328550525.db2.gz OCNHKSROQVPIRN-VOFKWLDRSA-N 1 3 329.488 2.909 10 0 EFAEHO CCCC[NH2+][C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)C[C@H]1CC ZINC001276751314 1315033447 /nfs/dbraw/zinc/03/34/47/1315033447.db2.gz PBPBYAZFNSZBNL-IAGOWNOFSA-N 1 3 325.541 2.981 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]C/C=C\c2ccccc2)C1)N(C)C ZINC001278571958 1315213954 /nfs/dbraw/zinc/21/39/54/1315213954.db2.gz KGYZGPDOAVJRIZ-ACCFAQQVSA-N 1 3 343.515 2.868 10 0 EFAEHO CCCCC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)[C@H](CC)N(C)C)C1 ZINC001278748212 1315651236 /nfs/dbraw/zinc/65/12/36/1315651236.db2.gz YCRVBHLDIVPSDJ-CABCVRRESA-N 1 3 333.467 2.590 10 0 EFAEHO CCCCC[N@H+]1CCC(F)(F)[C@H](CNC(=O)[C@H](CC)N(C)C)C1 ZINC001278748212 1315651238 /nfs/dbraw/zinc/65/12/38/1315651238.db2.gz YCRVBHLDIVPSDJ-CABCVRRESA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]CCc1ccccc1)C(C)(C)C)N(C)C ZINC001278973808 1316006048 /nfs/dbraw/zinc/00/60/48/1316006048.db2.gz YTTIVCIFUPVJPN-QZTJIDSGSA-N 1 3 333.520 2.690 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)C1CC[NH+](CCCCCF)CC1 ZINC001279078973 1316125387 /nfs/dbraw/zinc/12/53/87/1316125387.db2.gz BICYKPGTMNUKRT-MRXNPFEDSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)CCC[NH2+]C[C@@H]1C[C@H](C)CCN1C(=O)CN1CC[C@H](C)C1 ZINC001264000313 1316579043 /nfs/dbraw/zinc/57/90/43/1316579043.db2.gz MCHBKPKOSFVGSM-QYZOEREBSA-N 1 3 337.552 2.981 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCCC[C@H]1C[N@H+](C)CC=C(C)C ZINC001264183112 1316596655 /nfs/dbraw/zinc/59/66/55/1316596655.db2.gz HHZAMBAYIDTOBB-ROUUACIJSA-N 1 3 341.515 2.945 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1CCCC[C@H]1C[N@@H+](C)CC=C(C)C ZINC001264183112 1316596658 /nfs/dbraw/zinc/59/66/58/1316596658.db2.gz HHZAMBAYIDTOBB-ROUUACIJSA-N 1 3 341.515 2.945 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CC2=CCCCC2)C1)N(C)C ZINC001264487299 1316619470 /nfs/dbraw/zinc/61/94/70/1316619470.db2.gz YWEZYGGRIXXHDE-IPMKNSEASA-N 1 3 335.536 2.948 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H](C)[C@H]1CC[NH2+]Cc1cccnc1 ZINC001264520505 1316627697 /nfs/dbraw/zinc/62/76/97/1316627697.db2.gz MBPUXWXCCBQPCY-IEBWSBKVSA-N 1 3 346.519 2.529 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@@H](C)C[C@H]2C[NH2+]CCC(C)(C)C)C1 ZINC001264559443 1316631683 /nfs/dbraw/zinc/63/16/83/1316631683.db2.gz FEACMOMCOLPCNL-KURKYZTESA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@H+](C)[C@@H](C)c1ccc(F)c(F)c1)N(C)C ZINC001265000930 1316685141 /nfs/dbraw/zinc/68/51/41/1316685141.db2.gz IRIXNTZFAZDHEC-SUMWQHHRSA-N 1 3 341.446 2.804 10 0 EFAEHO CC[C@H](C(=O)NCCC[N@@H+](C)[C@@H](C)c1ccc(F)c(F)c1)N(C)C ZINC001265000930 1316685143 /nfs/dbraw/zinc/68/51/43/1316685143.db2.gz IRIXNTZFAZDHEC-SUMWQHHRSA-N 1 3 341.446 2.804 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@H+](C)[C@@H]1CCc2ccc(F)cc21)N(C)C ZINC001265032051 1316695133 /nfs/dbraw/zinc/69/51/33/1316695133.db2.gz HEWOQKWICPYVLW-RTBURBONSA-N 1 3 349.494 2.837 10 0 EFAEHO CC(C)[C@H](C(=O)NCCC[N@@H+](C)[C@@H]1CCc2ccc(F)cc21)N(C)C ZINC001265032051 1316695136 /nfs/dbraw/zinc/69/51/36/1316695136.db2.gz HEWOQKWICPYVLW-RTBURBONSA-N 1 3 349.494 2.837 10 0 EFAEHO Cc1ncccc1CN(C)CCCNC(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC001265043156 1316699941 /nfs/dbraw/zinc/69/99/41/1316699941.db2.gz CQUPRJYDMSNUDV-GOSISDBHSA-N 1 3 346.519 2.593 10 0 EFAEHO C[N@H+](CCCNC(=O)CN1CCCC1)Cc1ccc(Cl)c(F)c1 ZINC001265068558 1316710016 /nfs/dbraw/zinc/71/00/16/1316710016.db2.gz OGYBEIZLNGSVRS-UHFFFAOYSA-N 1 3 341.858 2.513 10 0 EFAEHO C[N@@H+](CCCNC(=O)CN1CCCC1)Cc1ccc(Cl)c(F)c1 ZINC001265068558 1316710018 /nfs/dbraw/zinc/71/00/18/1316710018.db2.gz OGYBEIZLNGSVRS-UHFFFAOYSA-N 1 3 341.858 2.513 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001265073322 1316711995 /nfs/dbraw/zinc/71/19/95/1316711995.db2.gz XBIOWKFCOLHVPQ-OAHLLOKOSA-N 1 3 333.467 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC001265073322 1316711996 /nfs/dbraw/zinc/71/19/96/1316711996.db2.gz XBIOWKFCOLHVPQ-OAHLLOKOSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1cc(C)ccc1C ZINC001265133923 1316732342 /nfs/dbraw/zinc/73/23/42/1316732342.db2.gz CFYZIMZRPQOOKJ-GOSISDBHSA-N 1 3 345.531 2.973 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN1CC[C@@H](C)C1)Cc1cc(C)ccc1C ZINC001265133923 1316732344 /nfs/dbraw/zinc/73/23/44/1316732344.db2.gz CFYZIMZRPQOOKJ-GOSISDBHSA-N 1 3 345.531 2.973 10 0 EFAEHO CC[N@H+](CCCNC(=O)CN(C)C(C)C)[C@H]1CCc2c1cccc2F ZINC001265147968 1316738974 /nfs/dbraw/zinc/73/89/74/1316738974.db2.gz QJTRZHGEEBPHRV-IBGZPJMESA-N 1 3 349.494 2.981 10 0 EFAEHO CC[N@@H+](CCCNC(=O)CN(C)C(C)C)[C@H]1CCc2c1cccc2F ZINC001265147968 1316738976 /nfs/dbraw/zinc/73/89/76/1316738976.db2.gz QJTRZHGEEBPHRV-IBGZPJMESA-N 1 3 349.494 2.981 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N[C@H]1CCCN(CCCCCF)C1 ZINC001265218993 1316756381 /nfs/dbraw/zinc/75/63/81/1316756381.db2.gz QGZOSXGMSYBHGQ-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N[C@H]1CCCN(CCCCCF)C1 ZINC001265218993 1316756383 /nfs/dbraw/zinc/75/63/83/1316756383.db2.gz QGZOSXGMSYBHGQ-ZWKOTPCHSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N[C@@H]1CCCN(CCCCCF)C1 ZINC001265218991 1316756578 /nfs/dbraw/zinc/75/65/78/1316756578.db2.gz QGZOSXGMSYBHGQ-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N[C@@H]1CCCN(CCCCCF)C1 ZINC001265218991 1316756580 /nfs/dbraw/zinc/75/65/80/1316756580.db2.gz QGZOSXGMSYBHGQ-QZTJIDSGSA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@@H](C[NH2+]CCC(C)(C)C)C1)N(C)C ZINC001265613008 1316836733 /nfs/dbraw/zinc/83/67/33/1316836733.db2.gz GSNABMUYPXVBFC-IRXDYDNUSA-N 1 3 325.541 2.837 10 0 EFAEHO CCCCC[NH2+]C[C@@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001265624186 1316837415 /nfs/dbraw/zinc/83/74/15/1316837415.db2.gz NFZBHIVHTKXEKF-KRWDZBQOSA-N 1 3 325.541 2.983 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[NH2+]CCCC(C)(C)C)C1 ZINC001265636373 1316839453 /nfs/dbraw/zinc/83/94/53/1316839453.db2.gz HWKNPSXVMSWTPF-QGZVFWFLSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCCCC[NH2+][C@@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001265823897 1316884513 /nfs/dbraw/zinc/88/45/13/1316884513.db2.gz OEQIGAJTOGITGK-MAUKXSAKSA-N 1 3 329.504 2.874 10 0 EFAEHO CCCCCC[NH2+][C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001265823895 1316884781 /nfs/dbraw/zinc/88/47/81/1316884781.db2.gz OEQIGAJTOGITGK-CRAIPNDOSA-N 1 3 329.504 2.874 10 0 EFAEHO C[N@H+](CCCNC(=O)C(C)(C)N1CCCCC1)CCc1ccccc1 ZINC001265845241 1316890246 /nfs/dbraw/zinc/89/02/46/1316890246.db2.gz HPKWUFKFNRTBRD-UHFFFAOYSA-N 1 3 345.531 2.932 10 0 EFAEHO C[N@@H+](CCCNC(=O)C(C)(C)N1CCCCC1)CCc1ccccc1 ZINC001265845241 1316890249 /nfs/dbraw/zinc/89/02/49/1316890249.db2.gz HPKWUFKFNRTBRD-UHFFFAOYSA-N 1 3 345.531 2.932 10 0 EFAEHO CC(C)=CC[N@@H+](C)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001265923900 1316915748 /nfs/dbraw/zinc/91/57/48/1316915748.db2.gz YZXARCNTNKLLQK-GOSISDBHSA-N 1 3 327.488 2.603 10 0 EFAEHO CC(C)=CC[N@H+](C)CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001265923900 1316915745 /nfs/dbraw/zinc/91/57/45/1316915745.db2.gz YZXARCNTNKLLQK-GOSISDBHSA-N 1 3 327.488 2.603 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001265954150 1316926984 /nfs/dbraw/zinc/92/69/84/1316926984.db2.gz KYHBCOPOBGCHQT-CABCVRRESA-N 1 3 333.467 2.590 10 0 EFAEHO CC[C@@H](C(=O)NCCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)N(C)C ZINC001265954150 1316926986 /nfs/dbraw/zinc/92/69/86/1316926986.db2.gz KYHBCOPOBGCHQT-CABCVRRESA-N 1 3 333.467 2.590 10 0 EFAEHO CN(CCCNC(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1)Cc1ccsc1 ZINC001265954793 1316927390 /nfs/dbraw/zinc/92/73/90/1316927390.db2.gz WLBIRHRTTBHXHZ-IAGOWNOFSA-N 1 3 337.533 2.807 10 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CC[C@@H](C(=O)NCCC[N@@H+](CC)[C@H]1CCc2c1cccc2F)N(C)C ZINC001266100868 1317036699 /nfs/dbraw/zinc/03/66/99/1317036699.db2.gz LJAFXUUUBJXFQB-OALUTQOASA-N 1 3 349.494 2.981 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@H]1CCC[N@@H+]1Cc1ncccc1C)N(C)C ZINC001266222998 1317164637 /nfs/dbraw/zinc/16/46/37/1317164637.db2.gz HRNGGSKCQXISQJ-PKOBYXMFSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@H]1CCC[N@H+]1Cc1ncccc1C)N(C)C ZINC001266222998 1317164642 /nfs/dbraw/zinc/16/46/42/1317164642.db2.gz HRNGGSKCQXISQJ-PKOBYXMFSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@H]1CCC[N@@H+]1Cc1ccccc1)N(C)C ZINC001266240890 1317189064 /nfs/dbraw/zinc/18/90/64/1317189064.db2.gz FPKRBFASXJNBPV-OALUTQOASA-N 1 3 331.504 2.888 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@H]1CCC[N@H+]1Cc1ccccc1)N(C)C ZINC001266240890 1317189065 /nfs/dbraw/zinc/18/90/65/1317189065.db2.gz FPKRBFASXJNBPV-OALUTQOASA-N 1 3 331.504 2.888 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@H]1CCC[N@@H+]1CC1CC(F)(F)C1)N(C)C ZINC001266242158 1317191701 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CC(C)[C@@H](C(=O)NCC1=CC[N@@H+](Cc2ccccc2)CC1)N(C)C ZINC001279676194 1317356583 /nfs/dbraw/zinc/35/65/83/1317356583.db2.gz XNZVWUYSXMIIQG-IBGZPJMESA-N 1 3 329.488 2.521 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@H]1CCN(C(=O)CN2CC[C@@H](C)C2)C1 ZINC001280198671 1317474067 /nfs/dbraw/zinc/47/40/67/1317474067.db2.gz VIFDKFMKTMDBNK-MJGOQNOKSA-N 1 3 343.515 2.665 10 0 EFAEHO CN(C[C@@H]1CCN1C[C@@H]1CCC(F)(F)C1)C(=O)CCCC[NH+](C)C ZINC001316602561 1317497103 /nfs/dbraw/zinc/49/71/03/1317497103.db2.gz ANDTXBPMFPHZCA-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](CC[NH2+]CCCc2ccsc2)C1 ZINC001280295252 1317499002 /nfs/dbraw/zinc/49/90/02/1317499002.db2.gz IZASRYSDUNPWMG-QGZVFWFLSA-N 1 3 349.544 2.605 10 0 EFAEHO C[C@H](F)CC[NH2+]CC[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001280307568 1317502956 /nfs/dbraw/zinc/50/29/56/1317502956.db2.gz MUHSUESGSMMLAX-IRXDYDNUSA-N 1 3 349.494 2.938 10 0 EFAEHO C[C@H](F)CC[NH2+]CC[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001280307566 1317503343 /nfs/dbraw/zinc/50/33/43/1317503343.db2.gz MUHSUESGSMMLAX-DLBZAZTESA-N 1 3 349.494 2.938 10 0 EFAEHO CCC/C=C\CC[NH+]1CCC2(CN(C(=O)[C@H](CC)N(C)C)C2)CC1 ZINC001280394786 1317541439 /nfs/dbraw/zinc/54/14/39/1317541439.db2.gz YSPKFTOSUMQULX-GIFJBRJJSA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC1([NH2+]CCCc2ccccc2)CCC1 ZINC001280533585 1317606925 /nfs/dbraw/zinc/60/69/25/1317606925.db2.gz CZJVWQHKDNVIMW-UHFFFAOYSA-N 1 3 340.471 2.522 10 0 EFAEHO CC(C)CCC[NH2+]CC[C@@H]1CCCN(C(=O)CN2CC[C@H](C)C2)C1 ZINC001318830466 1328714241 /nfs/dbraw/zinc/71/42/41/1328714241.db2.gz GMFZYMKVOFDQGX-OALUTQOASA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@@H](CC[NH2+]CC2CCCC2)C1)N(C)C ZINC001318848288 1328720945 /nfs/dbraw/zinc/72/09/45/1328720945.db2.gz DYZLDSZUOZNDNI-OALUTQOASA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@@H+](C)CCC(C)(C)C)C1 ZINC001370318738 1340032406 /nfs/dbraw/zinc/03/24/06/1340032406.db2.gz XQIUFLCJDUSPAO-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CC1CC(C[NH2+]CCC2CCN(C(=O)CN(C)C3CCC3)CC2)C1 ZINC001318895375 1328735037 /nfs/dbraw/zinc/73/50/37/1328735037.db2.gz FMZNCWKZICVRHA-UHFFFAOYSA-N 1 3 335.536 2.735 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H]([NH2+]CCCc2cccc(C)c2)C1 ZINC001281459014 1318329360 /nfs/dbraw/zinc/32/93/60/1318329360.db2.gz RMPNTKWIMHKFFY-AZUAARDMSA-N 1 3 345.531 2.706 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccc(C[NH2+]CCC3CC3)cc2)C1 ZINC001319000675 1328761241 /nfs/dbraw/zinc/76/12/41/1328761241.db2.gz UDQGUOIDDHPTPH-INIZCTEOSA-N 1 3 329.488 2.534 10 0 EFAEHO CC/C=C\CC[N@H+](CC)CC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001281833232 1318598756 /nfs/dbraw/zinc/59/87/56/1318598756.db2.gz FNKNBHXTDCWNAM-LIXSYLKWSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](CC)CC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001281833232 1318598760 /nfs/dbraw/zinc/59/87/60/1318598760.db2.gz FNKNBHXTDCWNAM-LIXSYLKWSA-N 1 3 335.536 2.997 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@H](C)[NH2+]CCCc1cccc(F)c1 ZINC001282139278 1318746758 /nfs/dbraw/zinc/74/67/58/1318746758.db2.gz BCXPWEHDYHUYQJ-JKSUJKDBSA-N 1 3 349.494 2.725 10 0 EFAEHO CN(CC(C)(C)C[NH2+]CCC1=CCCCC1)C(=O)Cc1c[nH]cn1 ZINC001282325460 1318858595 /nfs/dbraw/zinc/85/85/95/1318858595.db2.gz GGNOZFWCNZCGEG-UHFFFAOYSA-N 1 3 332.492 2.917 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]CCc1cccs1 ZINC001319225181 1328812936 /nfs/dbraw/zinc/81/29/36/1328812936.db2.gz MWASIXXBSRVZKD-OAHLLOKOSA-N 1 3 337.533 2.507 10 0 EFAEHO CC/C=C/CC[N@@H+]1C[C@@]2(C)CN(C(=O)[C@@H](CC)N(C)C)C[C@@]2(C)C1 ZINC001282992861 1319245205 /nfs/dbraw/zinc/24/52/05/1319245205.db2.gz QQHXPDCVCDESNN-BIGTXKKISA-N 1 3 335.536 2.853 10 0 EFAEHO CC/C=C/CC[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H](CC)N(C)C)C[C@@]2(C)C1 ZINC001282992861 1319245212 /nfs/dbraw/zinc/24/52/12/1319245212.db2.gz QQHXPDCVCDESNN-BIGTXKKISA-N 1 3 335.536 2.853 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001283681154 1319953995 /nfs/dbraw/zinc/95/39/95/1319953995.db2.gz WPVLXSFQSFJOPE-MOPGFXCFSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)[C@H](C(=O)N1C[C@H]([NH2+]CCCC2CCC2)C(C)(C)C1)N(C)C ZINC001284347378 1320329770 /nfs/dbraw/zinc/32/97/70/1320329770.db2.gz MUIIDBAWDGVHKF-ZWKOTPCHSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)(C)[C@H](CNCC=C(Cl)Cl)NC(=O)C12CC[NH+](CC1)C2 ZINC001284642246 1320454018 /nfs/dbraw/zinc/45/40/18/1320454018.db2.gz MTCPKKRMOPWLJQ-LBPRGKRZSA-N 1 3 348.318 2.522 10 0 EFAEHO CC/C=C/CC[NH+]1CCC([C@@H](C)NC(=O)CN2CC[C@H](C)C2)CC1 ZINC001284699910 1320481653 /nfs/dbraw/zinc/48/16/53/1320481653.db2.gz LXVKRTLOVNEXEQ-HQYUYXFKSA-N 1 3 335.536 2.901 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NCC1=CC[N@H+](Cc2ccccc2)CC1 ZINC001284920161 1320596906 /nfs/dbraw/zinc/59/69/06/1320596906.db2.gz ALVBDKQAEUFTRV-LJQANCHMSA-N 1 3 347.478 2.615 10 0 EFAEHO CCN(CC)C[C@@H](F)C(=O)NCC1=CC[N@@H+](Cc2ccccc2)CC1 ZINC001284920161 1320596912 /nfs/dbraw/zinc/59/69/12/1320596912.db2.gz ALVBDKQAEUFTRV-LJQANCHMSA-N 1 3 347.478 2.615 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)[C@H](C)C[NH2+]CCc1cccs1 ZINC001319593629 1328923494 /nfs/dbraw/zinc/92/34/94/1328923494.db2.gz OWAACXJEMQCHFV-WBVHZDCISA-N 1 3 337.533 2.602 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H](C[NH2+]C/C=C/Cl)C2CCCCC2)CCC1 ZINC001319654439 1328940045 /nfs/dbraw/zinc/94/00/45/1328940045.db2.gz FSOKPJWPSMUTRY-MZTACXPWSA-N 1 3 341.927 2.878 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@@H](NC(=O)C1(N(C)C)CCC1)C1CCCCC1 ZINC001319658043 1328940512 /nfs/dbraw/zinc/94/05/12/1328940512.db2.gz UTMNPSKXHDHLCL-DOTOQJQBSA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@H](F)CC[NH2+]C[C@H](NC(=O)C1(N(C)C)CCC1)C1CCCCC1 ZINC001319658045 1328940609 /nfs/dbraw/zinc/94/06/09/1328940609.db2.gz UTMNPSKXHDHLCL-RDJZCZTQSA-N 1 3 341.515 2.874 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@@H]1CC[NH2+]CCCCCF ZINC001319735199 1328969100 /nfs/dbraw/zinc/96/91/00/1328969100.db2.gz CALORWNBQCACSF-IAGOWNOFSA-N 1 3 327.488 2.581 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CCCC[C@H]1CC[NH2+]CC1=CCCCC1 ZINC001319769002 1328982729 /nfs/dbraw/zinc/98/27/29/1328982729.db2.gz JNKKTTMHGPUXRY-RBUKOAKNSA-N 1 3 333.520 2.942 10 0 EFAEHO O=C(CN1CCCC1)N1CCCC[C@H]1CC[NH2+]CC=C(Cl)Cl ZINC001319793350 1328993034 /nfs/dbraw/zinc/99/30/34/1328993034.db2.gz ULBVTLBPBRODOM-AWEZNQCLSA-N 1 3 348.318 2.762 10 0 EFAEHO CC(C)=CC[N@H+]1CC[C@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@H]21 ZINC001320112582 1329084290 /nfs/dbraw/zinc/08/42/90/1329084290.db2.gz ULQJPEBMXMAVME-ZWKOTPCHSA-N 1 3 335.536 2.853 10 0 EFAEHO CC(C)=CC[N@@H+]1CC[C@H]2CN(C(=O)CN(C)CC(C)(C)C)CC[C@H]21 ZINC001320112582 1329084296 /nfs/dbraw/zinc/08/42/96/1329084296.db2.gz ULQJPEBMXMAVME-ZWKOTPCHSA-N 1 3 335.536 2.853 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1cccc(C(F)F)c1 ZINC001491579839 1323721453 /nfs/dbraw/zinc/72/14/53/1323721453.db2.gz PBBATWGCGFFSER-UONOGXRCSA-N 1 3 339.430 2.560 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H](C)NCc1ccccc1F)[NH+]1CCCCC1 ZINC001491682337 1323787296 /nfs/dbraw/zinc/78/72/96/1323787296.db2.gz LDPIAOIERNUUIF-VQIMIIECSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+][C@H](C)c1cccc(Cl)c1 ZINC001491685110 1323790318 /nfs/dbraw/zinc/79/03/18/1323790318.db2.gz XRONUPZHKFJBEV-ZIAGYGMSSA-N 1 3 325.884 2.836 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H]2CCN(C(=O)C3(N(C)C)CCC3)C2)c1 ZINC001491732712 1323844224 /nfs/dbraw/zinc/84/42/24/1323844224.db2.gz GZZORZNWUZGULT-IBGZPJMESA-N 1 3 343.515 2.602 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001491856959 1323951994 /nfs/dbraw/zinc/95/19/94/1323951994.db2.gz WFXHHLFNDWPCCV-WMZOPIPTSA-N 1 3 335.467 2.548 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](C[NH2+]CCC2CCCCCC2)C1 ZINC001491857530 1323953034 /nfs/dbraw/zinc/95/30/34/1323953034.db2.gz UMEUVUFCIMXHOW-IBGZPJMESA-N 1 3 335.536 2.881 10 0 EFAEHO C[C@H](CC[NH2+]Cc1cccc(Cl)c1)NC(=O)CN(C)C1CCC1 ZINC001320444561 1329132431 /nfs/dbraw/zinc/13/24/31/1329132431.db2.gz AHZDNASBKGSKET-CQSZACIVSA-N 1 3 337.895 2.809 10 0 EFAEHO C[C@@H](CC[NH2+]Cc1cccc(Cl)c1)NC(=O)CN(C)C1CCC1 ZINC001320444560 1329132681 /nfs/dbraw/zinc/13/26/81/1329132681.db2.gz AHZDNASBKGSKET-AWEZNQCLSA-N 1 3 337.895 2.809 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NCC[C@@H](C)NC/C(Cl)=C/Cl ZINC001492022645 1324133511 /nfs/dbraw/zinc/13/35/11/1324133511.db2.gz VKXCQDSHDQXMIJ-HSWBZUAGSA-N 1 3 336.307 2.663 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NCC[C@@H](C)NC/C(Cl)=C/Cl ZINC001492022645 1324133503 /nfs/dbraw/zinc/13/35/03/1324133503.db2.gz VKXCQDSHDQXMIJ-HSWBZUAGSA-N 1 3 336.307 2.663 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(C)CCNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001492286406 1324400506 /nfs/dbraw/zinc/40/05/06/1324400506.db2.gz MMBVVJXYQBVQOD-YJBOKZPZSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@@H](c1cccc(F)c1)N(C)CCNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001492286406 1324400510 /nfs/dbraw/zinc/40/05/10/1324400510.db2.gz MMBVVJXYQBVQOD-YJBOKZPZSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(C)CCNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001492286403 1324401372 /nfs/dbraw/zinc/40/13/72/1324401372.db2.gz MMBVVJXYQBVQOD-CRAIPNDOSA-N 1 3 335.467 2.809 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(C)CCNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001492286403 1324401378 /nfs/dbraw/zinc/40/13/78/1324401378.db2.gz MMBVVJXYQBVQOD-CRAIPNDOSA-N 1 3 335.467 2.809 10 0 EFAEHO CC(C)C[C@H](C)C[N@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001492420976 1324499041 /nfs/dbraw/zinc/49/90/41/1324499041.db2.gz FLKNCJMWKAEVQY-QFBILLFUSA-N 1 3 343.531 2.929 10 0 EFAEHO CC(C)C[C@H](C)C[N@@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001492420976 1324499046 /nfs/dbraw/zinc/49/90/46/1324499046.db2.gz FLKNCJMWKAEVQY-QFBILLFUSA-N 1 3 343.531 2.929 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001492420977 1324499407 /nfs/dbraw/zinc/49/94/07/1324499407.db2.gz FLKNCJMWKAEVQY-VQIMIIECSA-N 1 3 343.531 2.929 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001492420977 1324499411 /nfs/dbraw/zinc/49/94/11/1324499411.db2.gz FLKNCJMWKAEVQY-VQIMIIECSA-N 1 3 343.531 2.929 10 0 EFAEHO CCC/C=C\CC[N@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001492425181 1324502382 /nfs/dbraw/zinc/50/23/82/1324502382.db2.gz WSBWZVRJTXQOMG-OLHLWXQYSA-N 1 3 341.515 2.993 10 0 EFAEHO CCC/C=C\CC[N@@H+](C)CCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001492425181 1324502389 /nfs/dbraw/zinc/50/23/89/1324502389.db2.gz WSBWZVRJTXQOMG-OLHLWXQYSA-N 1 3 341.515 2.993 10 0 EFAEHO CCC/C=C/CC[N@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001492425184 1324502700 /nfs/dbraw/zinc/50/27/00/1324502700.db2.gz WSBWZVRJTXQOMG-SGQUHAKNSA-N 1 3 341.515 2.993 10 0 EFAEHO CCC/C=C/CC[N@@H+](C)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001492425184 1324502703 /nfs/dbraw/zinc/50/27/03/1324502703.db2.gz WSBWZVRJTXQOMG-SGQUHAKNSA-N 1 3 341.515 2.993 10 0 EFAEHO C[C@@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)[C@H]1CC[NH2+]CCF ZINC001316683442 1324569016 /nfs/dbraw/zinc/56/90/16/1324569016.db2.gz DNAOEPIMQDYXMX-APWZRJJASA-N 1 3 349.494 2.938 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+](CC3=CCCCC3)CC[C@@H]2C1 ZINC001316760455 1325113329 /nfs/dbraw/zinc/11/33/29/1325113329.db2.gz NPLMRQRVAODLDH-MOPGFXCFSA-N 1 3 333.520 2.607 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+](CC3=CCCCC3)CC[C@@H]2C1 ZINC001316760455 1325113332 /nfs/dbraw/zinc/11/33/32/1325113332.db2.gz NPLMRQRVAODLDH-MOPGFXCFSA-N 1 3 333.520 2.607 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@H+](C)Cc2cc3ccccc3o2)C1 ZINC001316850951 1325222957 /nfs/dbraw/zinc/22/29/57/1325222957.db2.gz MMAPMOJXPRPVOT-INIZCTEOSA-N 1 3 343.471 2.713 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC[N@@H+](C)Cc2cc3ccccc3o2)C1 ZINC001316850951 1325222960 /nfs/dbraw/zinc/22/29/60/1325222960.db2.gz MMAPMOJXPRPVOT-INIZCTEOSA-N 1 3 343.471 2.713 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@H+](C)Cc1cccc(Cl)c1 ZINC001316871319 1325240215 /nfs/dbraw/zinc/24/02/15/1325240215.db2.gz WCJNMVUHGUTOGY-UHFFFAOYSA-N 1 3 325.884 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@@H+](C)Cc1cccc(Cl)c1 ZINC001316871319 1325240223 /nfs/dbraw/zinc/24/02/23/1325240223.db2.gz WCJNMVUHGUTOGY-UHFFFAOYSA-N 1 3 325.884 2.618 10 0 EFAEHO CCC/C=C\CC[NH+]1CCC(N(C)C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001316933313 1325382543 /nfs/dbraw/zinc/38/25/43/1325382543.db2.gz IPUQZLFSWDUYQN-HPFMTEOYSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001317051294 1325523487 /nfs/dbraw/zinc/52/34/87/1325523487.db2.gz AVYZGOJRYAXIAX-ZMHWVXQFSA-N 1 3 333.520 2.750 10 0 EFAEHO CCC/C=C\CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001317051294 1325523493 /nfs/dbraw/zinc/52/34/93/1325523493.db2.gz AVYZGOJRYAXIAX-ZMHWVXQFSA-N 1 3 333.520 2.750 10 0 EFAEHO CC/C=C/CC[NH2+][C@H]1C[C@H](NC(=O)c2cccc(CN(C)C)c2)C1 ZINC001317093261 1325555929 /nfs/dbraw/zinc/55/59/29/1325555929.db2.gz OPVAXHGXXUUROL-XMMAQXFNSA-N 1 3 329.488 2.955 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[N@@H+](C)CC[C@H]1CCCC1(F)F)N(C)C ZINC001374552568 1342061530 /nfs/dbraw/zinc/06/15/30/1342061530.db2.gz QEUHKXOZERGHSY-CABCVRRESA-N 1 3 333.467 2.542 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc2cc[nH]c2c1)C(=O)[C@H](C(C)C)N(C)C ZINC001320900719 1329316664 /nfs/dbraw/zinc/31/66/64/1329316664.db2.gz DSXXOAMRHFQCJH-IBGZPJMESA-N 1 3 344.503 2.692 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC/C=C/CNCc2ccc(Cl)s2)CC[N@@H+]1C ZINC001321064120 1329338556 /nfs/dbraw/zinc/33/85/56/1329338556.db2.gz KQPZOZBJIKKREI-YTRGCGJWSA-N 1 3 341.908 2.504 10 0 EFAEHO C[C@@H]1[C@H](C(=O)NC/C=C/CNCc2ccc(Cl)s2)CC[N@H+]1C ZINC001321064120 1329338560 /nfs/dbraw/zinc/33/85/60/1329338560.db2.gz KQPZOZBJIKKREI-YTRGCGJWSA-N 1 3 341.908 2.504 10 0 EFAEHO C[C@@H]1CCC[C@@H](CC[NH2+]C/C=C/CNC(=O)C2(N(C)C)CCC2)C1 ZINC001321091254 1329341756 /nfs/dbraw/zinc/34/17/56/1329341756.db2.gz HLZDJDTZUBIZMP-ZLKFPQNLSA-N 1 3 335.536 2.949 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NC/C=C/C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001321189455 1329354243 /nfs/dbraw/zinc/35/42/43/1329354243.db2.gz MXPBEZDONUZCNL-CJIROOEOSA-N 1 3 345.462 2.559 10 0 EFAEHO CC(C)(C(=O)NC/C=C/CNCc1ccc(Cl)cc1)[NH+]1CCCC1 ZINC001321185909 1329353896 /nfs/dbraw/zinc/35/38/96/1329353896.db2.gz LLBZMKMMZSQXCB-ONEGZZNKSA-N 1 3 349.906 2.976 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC/C=C\C[NH2+]Cc2ccccc2C2CC2)C1 ZINC001321248677 1329362684 /nfs/dbraw/zinc/36/26/84/1329362684.db2.gz DDXCLXRAKGXLOQ-VGOKWCNXSA-N 1 3 341.499 2.668 10 0 EFAEHO C[C@H](NC/C=C\CNC(=O)CC1CC[NH+](C)CC1)c1ccc(F)cc1 ZINC001321279323 1329366939 /nfs/dbraw/zinc/36/69/39/1329366939.db2.gz IRGWFIDNKNLNOO-QGZUEGPWSA-N 1 3 347.478 2.881 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCCC[C@@H]2C[NH2+]CCc2ccccc2)C1 ZINC001317191424 1327711124 /nfs/dbraw/zinc/71/11/24/1327711124.db2.gz GEWIMVSSRNZNNA-UYAOXDASSA-N 1 3 343.515 2.542 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCCC[C@@H]2C[NH2+]CCc2ccccc2)C1 ZINC001317191423 1327711932 /nfs/dbraw/zinc/71/19/32/1327711932.db2.gz GEWIMVSSRNZNNA-AZUAARDMSA-N 1 3 343.515 2.542 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/C[NH2+][C@@H]1CCc2ccc(F)cc21)N(C)C ZINC001321350353 1329375701 /nfs/dbraw/zinc/37/57/01/1329375701.db2.gz NKSAAXGWKJZHDY-ASIGSXEYSA-N 1 3 347.478 2.661 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C\C[NH2+][C@H]1CCc2ccc(F)cc21)N(C)C ZINC001321350523 1329375952 /nfs/dbraw/zinc/37/59/52/1329375952.db2.gz NKSAAXGWKJZHDY-ZYHOBAKYSA-N 1 3 347.478 2.661 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001317240853 1327781381 /nfs/dbraw/zinc/78/13/81/1327781381.db2.gz JAIZBJVYAGLFPM-QUCCMNQESA-N 1 3 345.531 2.895 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCC[C@@H]([NH2+]CCCCCF)C2)CCC1 ZINC001317352537 1327884582 /nfs/dbraw/zinc/88/45/82/1327884582.db2.gz RENUORMDELNCPI-HZPDHXFCSA-N 1 3 327.488 2.628 10 0 EFAEHO O=C(CC[NH+]1CCCCC1)NC/C=C\CNCc1ccc(Cl)cc1 ZINC001321414556 1329384009 /nfs/dbraw/zinc/38/40/09/1329384009.db2.gz AJUUMYRLAAGXJU-IHWYPQMZSA-N 1 3 349.906 2.978 10 0 EFAEHO Cc1cc(F)ccc1CNC/C=C\CNC(=O)C[NH+]1[C@H](C)CC[C@H]1C ZINC001321417785 1329384171 /nfs/dbraw/zinc/38/41/71/1329384171.db2.gz VDRQYFAQRNZGHF-OSNZYPHYSA-N 1 3 347.478 2.769 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NCCC[C@@H]2CCC[N@@H+]2CCF)C1 ZINC001317434795 1328020740 /nfs/dbraw/zinc/02/07/40/1328020740.db2.gz LKYVQNXKISMTKZ-QAPCUYQASA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NCCC[C@@H]2CCC[N@H+]2CCF)C1 ZINC001317434795 1328020747 /nfs/dbraw/zinc/02/07/47/1328020747.db2.gz LKYVQNXKISMTKZ-QAPCUYQASA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NCCC[C@H]2CCC[N@@H+]2CCF)C1 ZINC001317434796 1328021273 /nfs/dbraw/zinc/02/12/73/1328021273.db2.gz LKYVQNXKISMTKZ-YJBOKZPZSA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)NCCC[C@H]2CCC[N@H+]2CCF)C1 ZINC001317434796 1328021282 /nfs/dbraw/zinc/02/12/82/1328021282.db2.gz LKYVQNXKISMTKZ-YJBOKZPZSA-N 1 3 345.478 2.529 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@H]1CCC[N@@H+]1Cc1cnccc1C)N(C)C ZINC001317435168 1328022477 /nfs/dbraw/zinc/02/24/77/1328022477.db2.gz MEFOSFTYYMFCJK-OALUTQOASA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@@H](C(=O)NCCC[C@H]1CCC[N@H+]1Cc1cnccc1C)N(C)C ZINC001317435168 1328022481 /nfs/dbraw/zinc/02/24/81/1328022481.db2.gz MEFOSFTYYMFCJK-OALUTQOASA-N 1 3 346.519 2.591 10 0 EFAEHO CN(CCNC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1)CC1=CCCCC1 ZINC001317450303 1328038713 /nfs/dbraw/zinc/03/87/13/1328038713.db2.gz SMZSSHQVXLJQKF-IBGZPJMESA-N 1 3 333.520 2.942 10 0 EFAEHO CN(CCNC(=O)[C@@H]1CCC[N@H+]1C1CCCC1)CC1=CCCCC1 ZINC001317450303 1328038723 /nfs/dbraw/zinc/03/87/23/1328038723.db2.gz SMZSSHQVXLJQKF-IBGZPJMESA-N 1 3 333.520 2.942 10 0 EFAEHO CCCc1ccc(C[NH2+]CCN(C)C(=O)C2(N(C)C)CCC2)cc1 ZINC001317595829 1328175581 /nfs/dbraw/zinc/17/55/81/1328175581.db2.gz KILDGYMFTHHTQC-UHFFFAOYSA-N 1 3 331.504 2.671 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)CC[NH2+]CC[C@H]1CCCC1(F)F ZINC001317662843 1328253033 /nfs/dbraw/zinc/25/30/33/1328253033.db2.gz ABNXPXVNWUNTGM-CVEARBPZSA-N 1 3 345.478 2.734 10 0 EFAEHO CC(C)=CCN[C@H](CNC(=O)C1CC[NH+](C)CC1)c1ccccc1 ZINC001317722246 1328331839 /nfs/dbraw/zinc/33/18/39/1328331839.db2.gz PCLFISWLDHDXME-LJQANCHMSA-N 1 3 329.488 2.742 10 0 EFAEHO CC/C=C/CC[NH+]1CC(CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001318176260 1328513499 /nfs/dbraw/zinc/51/34/99/1328513499.db2.gz MHWRKJQQFYXDJI-AATRIKPKSA-N 1 3 329.488 2.766 10 0 EFAEHO CN(CCC[NH2+]C/C=C\c1ccc(Cl)cc1)C(=O)[C@@H]1CCCN1C ZINC001322442986 1329458702 /nfs/dbraw/zinc/45/87/02/1329458702.db2.gz QYCBRQYYEOHCKL-CJISVDGZSA-N 1 3 349.906 2.886 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCCC[C@@H]1[C@H]1CCCN(C/C=C/Cl)C1 ZINC001380991126 1348010203 /nfs/dbraw/zinc/01/02/03/1348010203.db2.gz UQKBGQWIXFWPBI-HYMNUWHNSA-N 1 3 341.927 2.784 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+]C/C=C\c2ccccc2)C2CC2)CCC1 ZINC001323013557 1329504894 /nfs/dbraw/zinc/50/48/94/1329504894.db2.gz CSFDLICBLBHKAN-FUKWUPMWSA-N 1 3 341.499 2.669 10 0 EFAEHO CC[C@@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]CCCC(C)C ZINC001323166568 1329518998 /nfs/dbraw/zinc/51/89/98/1329518998.db2.gz DCQYPUYJYHUHAA-QZTJIDSGSA-N 1 3 325.541 2.980 10 0 EFAEHO O=C(N1CCC[C@@H]1CNCC=C(Cl)Cl)C12CCC[NH+]1CCC2 ZINC001324185758 1329606436 /nfs/dbraw/zinc/60/64/36/1329606436.db2.gz CZMZQINUFINVLP-CYBMUJFWSA-N 1 3 346.302 2.514 10 0 EFAEHO CN(C)C1(C(=O)N[C@H](C[NH2+]CCC(F)(F)F)C2CCCC2)CCC1 ZINC001324483310 1329632027 /nfs/dbraw/zinc/63/20/27/1329632027.db2.gz QNRAYBNPZMMTHJ-CQSZACIVSA-N 1 3 349.441 2.688 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@@]1(C)CCC[N@H+](CC=C(C)C)C1 ZINC001324937644 1329661075 /nfs/dbraw/zinc/66/10/75/1329661075.db2.gz YLKDILVHTWTPOZ-PKOBYXMFSA-N 1 3 341.515 2.851 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@@]1(C)CCC[N@@H+](CC=C(C)C)C1 ZINC001324937644 1329661077 /nfs/dbraw/zinc/66/10/77/1329661077.db2.gz YLKDILVHTWTPOZ-PKOBYXMFSA-N 1 3 341.515 2.851 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]CCC2CCCCC2)C1 ZINC001325595400 1329699556 /nfs/dbraw/zinc/69/95/56/1329699556.db2.gz JFFPQTHQOMHXNU-MJGOQNOKSA-N 1 3 337.552 2.983 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@H]2[C@H]1CC[N@@H+]2CCCCCF)N(C)C ZINC001325897318 1329721086 /nfs/dbraw/zinc/72/10/86/1329721086.db2.gz GARLRKBJJBZBLT-KSZLIROESA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCC[C@H]2[C@H]1CC[N@H+]2CCCCCF)N(C)C ZINC001325897318 1329721088 /nfs/dbraw/zinc/72/10/88/1329721088.db2.gz GARLRKBJJBZBLT-KSZLIROESA-N 1 3 341.515 2.778 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@@H](CC[NH2+]CC2CCCCC2)C1)N(C)C ZINC001326290040 1329744654 /nfs/dbraw/zinc/74/46/54/1329744654.db2.gz LBFNGLOKAYMAFL-MOPGFXCFSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(F)cc2C)C1)N(C)C ZINC001326362190 1329750340 /nfs/dbraw/zinc/75/03/40/1329750340.db2.gz AWLQYPNRBUFBGL-APWZRJJASA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@@H](CC[NH2+]CC3=CCCCC3)C2)C1 ZINC001326365341 1329750559 /nfs/dbraw/zinc/75/05/59/1329750559.db2.gz OZGVXHZIHUCJEQ-PKOBYXMFSA-N 1 3 333.520 2.657 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@@H](CC[NH2+]CC2CCCCCC2)C1 ZINC001326431697 1329755972 /nfs/dbraw/zinc/75/59/72/1329755972.db2.gz OEKSHAXHLJDBCY-LJQANCHMSA-N 1 3 335.536 2.881 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](CC[NH2+]Cc2ccccc2Cl)C1 ZINC001326430223 1329756097 /nfs/dbraw/zinc/75/60/97/1329756097.db2.gz JAQZTNIDROFCMW-INIZCTEOSA-N 1 3 349.906 2.764 10 0 EFAEHO CC[C@@H](F)C[NH2+]CC[C@H]1CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001326436600 1329756419 /nfs/dbraw/zinc/75/64/19/1329756419.db2.gz FLMZVIAJJMDHOW-QFBILLFUSA-N 1 3 349.494 2.938 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@@H](CC[NH2+]C/C=C\Cl)C2)c1 ZINC001326440032 1329757066 /nfs/dbraw/zinc/75/70/66/1329757066.db2.gz YWRDZUDBVGXSST-VCELZJIISA-N 1 3 349.906 2.943 10 0 EFAEHO CC(C)CCC[N@@H+]1C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381855444 1348568347 /nfs/dbraw/zinc/56/83/47/1348568347.db2.gz RANXQKUIDBYJJR-SJORKVTESA-N 1 3 325.541 2.835 10 0 EFAEHO CC(C)CCC[N@H+]1C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001381855444 1348568349 /nfs/dbraw/zinc/56/83/49/1348568349.db2.gz RANXQKUIDBYJJR-SJORKVTESA-N 1 3 325.541 2.835 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@H]1CCCC[N@@H+]1C1CCCC1)NC/C=C\Cl ZINC001382110163 1348729536 /nfs/dbraw/zinc/72/95/36/1348729536.db2.gz AOAVLQLMSUHUGW-DTNIQAGCSA-N 1 3 341.927 2.973 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@H]1CCCC[N@H+]1C1CCCC1)NC/C=C\Cl ZINC001382110163 1348729539 /nfs/dbraw/zinc/72/95/39/1348729539.db2.gz AOAVLQLMSUHUGW-DTNIQAGCSA-N 1 3 341.927 2.973 10 0 EFAEHO CC(C)=CCN(C)Cc1ccccc1CNC(=O)C12CC[NH+](CC1)C2 ZINC001326494024 1330303941 /nfs/dbraw/zinc/30/39/41/1330303941.db2.gz MEKIQXKEPCQMHU-UHFFFAOYSA-N 1 3 341.499 2.797 10 0 EFAEHO CC/C=C\CC[N@@H+]1CC[C@@H](NC(=O)Cc2nc[nH]c2C)C(C)(C)C1 ZINC001328099197 1330555527 /nfs/dbraw/zinc/55/55/27/1330555527.db2.gz SVXQONAHHARUEH-JTGQJZMRSA-N 1 3 332.492 2.834 10 0 EFAEHO CC/C=C\CC[N@H+]1CC[C@@H](NC(=O)Cc2nc[nH]c2C)C(C)(C)C1 ZINC001328099197 1330555530 /nfs/dbraw/zinc/55/55/30/1330555530.db2.gz SVXQONAHHARUEH-JTGQJZMRSA-N 1 3 332.492 2.834 10 0 EFAEHO CC(C)=CCN(C)C[C@@H]1CCCN1C(=O)[C@@H]1CCC[N@H+]1CC(C)C ZINC001328732525 1330622477 /nfs/dbraw/zinc/62/24/77/1330622477.db2.gz GZMSYIHLGQWABV-OALUTQOASA-N 1 3 335.536 2.996 10 0 EFAEHO CC(C)=CCN(C)C[C@@H]1CCCN1C(=O)[C@@H]1CCC[N@@H+]1CC(C)C ZINC001328732525 1330622480 /nfs/dbraw/zinc/62/24/80/1330622480.db2.gz GZMSYIHLGQWABV-OALUTQOASA-N 1 3 335.536 2.996 10 0 EFAEHO CC[C@@H](C(=O)NC1(C[NH2+]CCc2ccccc2)CCCCC1)N(C)C ZINC001329860515 1330743414 /nfs/dbraw/zinc/74/34/14/1330743414.db2.gz DEALSMDBQPTJFN-IBGZPJMESA-N 1 3 345.531 2.978 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N(C)[C@@H](C[NH2+]CCC(F)(F)F)C1CC1 ZINC001331289936 1330816807 /nfs/dbraw/zinc/81/68/07/1330816807.db2.gz OJFOFZMYSXUBIK-GJZGRUSLSA-N 1 3 349.441 2.640 10 0 EFAEHO C[C@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]CCCc1cccc(F)c1 ZINC001331471016 1330841235 /nfs/dbraw/zinc/84/12/35/1330841235.db2.gz WDMZLNCJUBIHBO-MRXNPFEDSA-N 1 3 349.494 2.679 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H]2C[C@@H](C)N(C(=O)CCCC[NH+](C)C)C2)c1 ZINC001332050511 1330909668 /nfs/dbraw/zinc/90/96/68/1330909668.db2.gz PUQMKUMAPBSRDP-SJLPKXTDSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2C[C@H](C)N(C(=O)CCCC[NH+](C)C)C2)c1 ZINC001332050512 1330909674 /nfs/dbraw/zinc/90/96/74/1330909674.db2.gz PUQMKUMAPBSRDP-WMZOPIPTSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H]1[C@H](NC(=O)CCCC[NH+](C)C)CCCN1Cc1ccccc1 ZINC001332215830 1330942280 /nfs/dbraw/zinc/94/22/80/1330942280.db2.gz BIXOFKIDIYZLPV-IEBWSBKVSA-N 1 3 331.504 2.888 10 0 EFAEHO CC[C@H](F)CN[C@H]1CN(C(=O)CCCC[NH+]2CCCC2)CC1(C)C ZINC001332451720 1330973342 /nfs/dbraw/zinc/97/33/42/1330973342.db2.gz DZCDSAMPJDTRMZ-IRXDYDNUSA-N 1 3 341.515 2.827 10 0 EFAEHO CN(C(=O)Cc1c[nH]cn1)C1CC([NH2+]CC/C=C/c2ccccc2)C1 ZINC001333120624 1331081256 /nfs/dbraw/zinc/08/12/56/1331081256.db2.gz OIMNOAMGRABDAJ-WEVVVXLNSA-N 1 3 338.455 2.635 10 0 EFAEHO c1[nH]nc2c1cccc2CN[C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC001352789584 1333730359 /nfs/dbraw/zinc/73/03/59/1333730359.db2.gz KPXPCMLDYDXYDK-YLJYHZDGSA-N 1 3 334.423 2.908 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)N(C)CCCN(C)CCC(F)(F)F ZINC001407952990 1369454066 /nfs/dbraw/zinc/45/40/66/1369454066.db2.gz BOFOEVGERAQXEK-KBPBESRZSA-N 1 3 337.430 2.592 10 0 EFAEHO O=C1O[C@@]2(CN1CN1CCC[C@@H]1CC1CCCC1)C[NH+]1CCC2CC1 ZINC000848507266 1334763904 /nfs/dbraw/zinc/76/39/04/1334763904.db2.gz VEFMGHKJPQSJPN-UYAOXDASSA-N 1 3 347.503 2.905 10 0 EFAEHO C[C@H]([NH2+]C[C@@H]1CCC[C@]2(CCOC2)O1)[C@@H]1CCCN(C2CCC2)C1 ZINC001413982902 1335383998 /nfs/dbraw/zinc/38/39/98/1335383998.db2.gz MZQDSSROAPWDJC-KVPLUYHFSA-N 1 3 336.520 2.957 10 0 EFAEHO C[C@H](NC[C@@H]1CCC[C@]2(CCOC2)O1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001413982902 1335383999 /nfs/dbraw/zinc/38/39/99/1335383999.db2.gz MZQDSSROAPWDJC-KVPLUYHFSA-N 1 3 336.520 2.957 10 0 EFAEHO C[C@H](NC[C@@H]1CCC[C@]2(CCOC2)O1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001413982902 1335384000 /nfs/dbraw/zinc/38/40/00/1335384000.db2.gz MZQDSSROAPWDJC-KVPLUYHFSA-N 1 3 336.520 2.957 10 0 EFAEHO C[C@H]([NH2+]C[C@@H]1CCC[C@@]2(CCOC2)O1)[C@H]1CCCN(C2CCC2)C1 ZINC001413982911 1335384057 /nfs/dbraw/zinc/38/40/57/1335384057.db2.gz MZQDSSROAPWDJC-ZULIPRJHSA-N 1 3 336.520 2.957 10 0 EFAEHO C[C@H](NC[C@@H]1CCC[C@@]2(CCOC2)O1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001413982911 1335384059 /nfs/dbraw/zinc/38/40/59/1335384059.db2.gz MZQDSSROAPWDJC-ZULIPRJHSA-N 1 3 336.520 2.957 10 0 EFAEHO C[C@H](NC[C@@H]1CCC[C@@]2(CCOC2)O1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001413982911 1335384060 /nfs/dbraw/zinc/38/40/60/1335384060.db2.gz MZQDSSROAPWDJC-ZULIPRJHSA-N 1 3 336.520 2.957 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)NCC1C[C@@H](C)C[C@H](C)C1 ZINC001413889567 1335839229 /nfs/dbraw/zinc/83/92/29/1335839229.db2.gz AZBBEMLZTRUOHL-ULQDDVLXSA-N 1 3 340.556 2.630 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)NCC1C[C@@H](C)C[C@H](C)C1 ZINC001413889567 1335839231 /nfs/dbraw/zinc/83/92/31/1335839231.db2.gz AZBBEMLZTRUOHL-ULQDDVLXSA-N 1 3 340.556 2.630 10 0 EFAEHO C[NH+](C)CCCOc1ccc(NC(=O)C23CCCN2CCC3)cc1 ZINC001360169004 1335936242 /nfs/dbraw/zinc/93/62/42/1335936242.db2.gz PTPBLJNQACRRAT-UHFFFAOYSA-N 1 3 331.460 2.584 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001361704768 1336284126 /nfs/dbraw/zinc/28/41/26/1336284126.db2.gz AMJAXTYJJDAFOP-RTBURBONSA-N 1 3 347.478 2.733 10 0 EFAEHO CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001361704768 1336284127 /nfs/dbraw/zinc/28/41/27/1336284127.db2.gz AMJAXTYJJDAFOP-RTBURBONSA-N 1 3 347.478 2.733 10 0 EFAEHO O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001361728205 1336299053 /nfs/dbraw/zinc/29/90/53/1336299053.db2.gz QEKLRBDRKXCMCT-XUVXKRRUSA-N 1 3 341.499 2.957 10 0 EFAEHO O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001361728205 1336299055 /nfs/dbraw/zinc/29/90/55/1336299055.db2.gz QEKLRBDRKXCMCT-XUVXKRRUSA-N 1 3 341.499 2.957 10 0 EFAEHO CN(C)CCN(C(=O)c1cccc(CC[NH+](C)C)c1)C1CCCC1 ZINC001361932397 1336423540 /nfs/dbraw/zinc/42/35/40/1336423540.db2.gz VKPHYFSOYUPFBQ-UHFFFAOYSA-N 1 3 331.504 2.737 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N(CCN(C)C)c3ccccc3)C[N@@H+]2C1 ZINC001361951558 1336434503 /nfs/dbraw/zinc/43/45/03/1336434503.db2.gz HBSNMUGYHPPUIH-ZHALLVOQSA-N 1 3 329.488 2.702 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N(CCN(C)C)c3ccccc3)C[N@H+]2C1 ZINC001361951558 1336434505 /nfs/dbraw/zinc/43/45/05/1336434505.db2.gz HBSNMUGYHPPUIH-ZHALLVOQSA-N 1 3 329.488 2.702 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N3CCN(CCC(C)(C)C)CC3)C[N@@H+]2C1 ZINC001361954379 1336436040 /nfs/dbraw/zinc/43/60/40/1336436040.db2.gz WMPCOFJPDQBJSH-SQNIBIBYSA-N 1 3 335.536 2.687 10 0 EFAEHO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N3CCN(CCC(C)(C)C)CC3)C[N@H+]2C1 ZINC001361954379 1336436045 /nfs/dbraw/zinc/43/60/45/1336436045.db2.gz WMPCOFJPDQBJSH-SQNIBIBYSA-N 1 3 335.536 2.687 10 0 EFAEHO Cc1ccccc1CN1CCCN(C(=O)[C@H](C)CC[NH+](C)C)CC1 ZINC001362042238 1336477306 /nfs/dbraw/zinc/47/73/06/1336477306.db2.gz KREMTZCFTPWDKQ-GOSISDBHSA-N 1 3 331.504 2.617 10 0 EFAEHO Cc1ccccc1CN1CCCN(C(=O)[C@@H](C)CC[NH+](C)C)CC1 ZINC001362042254 1336477455 /nfs/dbraw/zinc/47/74/55/1336477455.db2.gz KREMTZCFTPWDKQ-SFHVURJKSA-N 1 3 331.504 2.617 10 0 EFAEHO CN(C)CCN(Cc1cccs1)C(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001362056187 1336483347 /nfs/dbraw/zinc/48/33/47/1336483347.db2.gz CAZSASUYQWVSTQ-CVEARBPZSA-N 1 3 337.533 2.759 10 0 EFAEHO CC(C)C[NH+]1CCC(C(=O)N(CCN(C)C)c2ccccc2)CC1 ZINC001362091248 1336499371 /nfs/dbraw/zinc/49/93/71/1336499371.db2.gz VKFXGYZYMMUGOW-UHFFFAOYSA-N 1 3 331.504 2.949 10 0 EFAEHO C[C@H](c1ccccc1)N1CC[C@H](NC(=O)C2([NH+](C)C)CCCC2)C1 ZINC001362162589 1336532432 /nfs/dbraw/zinc/53/24/32/1336532432.db2.gz YWHVHXGSINEQFF-AEFFLSMTSA-N 1 3 329.488 2.813 10 0 EFAEHO C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)C2([NH+](C)C)CCCC2)C1 ZINC001362162594 1336532453 /nfs/dbraw/zinc/53/24/53/1336532453.db2.gz YWHVHXGSINEQFF-FUHWJXTLSA-N 1 3 329.488 2.813 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC001362230887 1336564834 /nfs/dbraw/zinc/56/48/34/1336564834.db2.gz UDVZDOYKURHLME-MSOLQXFVSA-N 1 3 331.504 2.697 10 0 EFAEHO COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](C)CC[NH+](C)C)cc1 ZINC001362248342 1336571983 /nfs/dbraw/zinc/57/19/83/1336571983.db2.gz DNGDYHSDBKFFMB-VQIMIIECSA-N 1 3 347.503 2.536 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001362503560 1336636659 /nfs/dbraw/zinc/63/66/59/1336636659.db2.gz KYCPNUJRCJXTCL-NZSAHSFTSA-N 1 3 331.504 2.744 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001362668246 1336698447 /nfs/dbraw/zinc/69/84/47/1336698447.db2.gz SVBYQMIZWYPTCW-QRQLOZEOSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001362668246 1336698451 /nfs/dbraw/zinc/69/84/51/1336698451.db2.gz SVBYQMIZWYPTCW-QRQLOZEOSA-N 1 3 329.488 2.640 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)N1CCN(Cc2ccccc2)C[C@@H](C)C1 ZINC001362697816 1336708354 /nfs/dbraw/zinc/70/83/54/1336708354.db2.gz YYZNTMPRLOBMJP-QZTJIDSGSA-N 1 3 331.504 2.555 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)CC[N@@H+]1C ZINC001362709450 1336713203 /nfs/dbraw/zinc/71/32/03/1336713203.db2.gz YWGGZCPNVCAVPW-XUVXKRRUSA-N 1 3 345.531 2.990 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)CC[N@H+]1C ZINC001362709450 1336713205 /nfs/dbraw/zinc/71/32/05/1336713205.db2.gz YWGGZCPNVCAVPW-XUVXKRRUSA-N 1 3 345.531 2.990 10 0 EFAEHO CN(CCCN(C)C(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1)Cc1ccco1 ZINC001362803481 1336748470 /nfs/dbraw/zinc/74/84/70/1336748470.db2.gz HOSDMWULWYMPGG-SJORKVTESA-N 1 3 335.492 2.680 10 0 EFAEHO COc1ccc([C@@H](NC(C)C)C(=O)N[C@@H](CC(C)C)C[NH+](C)C)cc1 ZINC001363725756 1337012864 /nfs/dbraw/zinc/01/28/64/1337012864.db2.gz BJQXOOFIBGYLNE-PKOBYXMFSA-N 1 3 349.519 2.827 10 0 EFAEHO CC(C)CC[NH2+][C@H]1C[C@@H](CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001365822799 1337252711 /nfs/dbraw/zinc/25/27/11/1337252711.db2.gz UDCVYLJLXNELGD-JTDSTZFVSA-N 1 3 341.515 2.729 10 0 EFAEHO CC[C@@H]([NH2+][C@H]1C[C@@H](CNC(=O)CN(C)C(C)C)C1)c1ccccc1 ZINC001365831257 1337255388 /nfs/dbraw/zinc/25/53/88/1337255388.db2.gz UHZCEVVUCJPPHP-NZSAHSFTSA-N 1 3 331.504 2.962 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)N[C@H]1CCCN(CCc2ccccc2)C1 ZINC001365936426 1337268310 /nfs/dbraw/zinc/26/83/10/1337268310.db2.gz GKLJNSKLDPDUTD-PMACEKPBSA-N 1 3 343.515 2.684 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)N[C@H]1CCCN(CCc2ccccc2)C1 ZINC001365936426 1337268314 /nfs/dbraw/zinc/26/83/14/1337268314.db2.gz GKLJNSKLDPDUTD-PMACEKPBSA-N 1 3 343.515 2.684 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001365998671 1337312060 /nfs/dbraw/zinc/31/20/60/1337312060.db2.gz YDQFDIHMQZVZIF-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001365998671 1337312062 /nfs/dbraw/zinc/31/20/62/1337312062.db2.gz YDQFDIHMQZVZIF-IBGZPJMESA-N 1 3 329.488 2.596 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CC12CC[NH+](CC1CC3(CCC3)C1)CC2)N(C)C ZINC001366012723 1337321705 /nfs/dbraw/zinc/32/17/05/1337321705.db2.gz DLZUNLLPUDXLJA-QZTJIDSGSA-N 1 3 347.547 2.878 10 0 EFAEHO Cc1cc(C[NH2+][C@H](CNC(=O)[C@H]2CCCN2C(C)C)C2CC2)cs1 ZINC001366048147 1337345796 /nfs/dbraw/zinc/34/57/96/1337345796.db2.gz VVSKZWSUZORKKD-QZTJIDSGSA-N 1 3 349.544 2.914 10 0 EFAEHO CN(CC(=O)NC[C@@H]([NH2+]CC1CC(C)(C)C1)C1CC1)CC(C)(C)C ZINC001366053772 1337350274 /nfs/dbraw/zinc/35/02/74/1337350274.db2.gz JJVIKEWQGNERNZ-QGZVFWFLSA-N 1 3 337.552 2.885 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](CNC(=O)[C@@H](C(C)C)[NH+](C)C)C2CC2)c1 ZINC001366065589 1337358339 /nfs/dbraw/zinc/35/83/39/1337358339.db2.gz RJFLUYXQKGKPPC-RBUKOAKNSA-N 1 3 349.494 2.705 10 0 EFAEHO CC(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001366084541 1337373679 /nfs/dbraw/zinc/37/36/79/1337373679.db2.gz JNAWUFZMFGWCTD-CADBVGFASA-N 1 3 335.536 2.828 10 0 EFAEHO CC(C)CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001366084541 1337373683 /nfs/dbraw/zinc/37/36/83/1337373683.db2.gz JNAWUFZMFGWCTD-CADBVGFASA-N 1 3 335.536 2.828 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H]([NH2+]CC2CC3(CCC3)C2)C1)CC(C)(C)C ZINC001366127763 1337391425 /nfs/dbraw/zinc/39/14/25/1337391425.db2.gz SQOAHONOGBXROH-QAQDUYKDSA-N 1 3 335.536 2.781 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2)C1)N(C)C ZINC001366160993 1337407855 /nfs/dbraw/zinc/40/78/55/1337407855.db2.gz GAMGMYGKLDNLHD-BBWFWOEESA-N 1 3 337.895 2.663 10 0 EFAEHO CC(C)c1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001366172831 1337414311 /nfs/dbraw/zinc/41/43/11/1337414311.db2.gz PBODDHGCHACIDH-KDURUIRLSA-N 1 3 331.504 2.887 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](C/C=C/c2ccccc2)C1)N(C)C ZINC001366173433 1337415222 /nfs/dbraw/zinc/41/52/22/1337415222.db2.gz BVYVMCUOIOZWAI-IJQANDGASA-N 1 3 343.515 2.868 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2)C1)N(C)C ZINC001366173433 1337415223 /nfs/dbraw/zinc/41/52/23/1337415223.db2.gz BVYVMCUOIOZWAI-IJQANDGASA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CCCCN2C(=O)CN(C)C(C)C)c(C)n1 ZINC001366223290 1337455695 /nfs/dbraw/zinc/45/56/95/1337455695.db2.gz COZPMMIXYMEAEG-IBGZPJMESA-N 1 3 346.519 2.509 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001366283580 1337489956 /nfs/dbraw/zinc/48/99/56/1337489956.db2.gz JBPQCQPKPHRCCQ-UZLBHIALSA-N 1 3 343.515 2.644 10 0 EFAEHO Cc1ccncc1CN[C@@H](C)CNC(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001366309079 1337504271 /nfs/dbraw/zinc/50/42/71/1337504271.db2.gz NSWZKAAKBHNVIH-INIZCTEOSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1ccncc1CN[C@@H](C)CNC(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001366309079 1337504273 /nfs/dbraw/zinc/50/42/73/1337504273.db2.gz NSWZKAAKBHNVIH-INIZCTEOSA-N 1 3 346.519 2.637 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]C/C=C/c1ccccc1 ZINC001366314296 1337505999 /nfs/dbraw/zinc/50/59/99/1337505999.db2.gz YMEKQPWURKITOC-KQPPXVQYSA-N 1 3 329.488 2.669 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]C/C=C\c1ccccc1 ZINC001366314292 1337506203 /nfs/dbraw/zinc/50/62/03/1337506203.db2.gz YMEKQPWURKITOC-GKUQOKNUSA-N 1 3 329.488 2.669 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](C)CNC(=O)[C@@H]2CCCCN2C(C)C)c1 ZINC001366334249 1337518983 /nfs/dbraw/zinc/51/89/83/1337518983.db2.gz VCTVHEBFHPALJK-MJGOQNOKSA-N 1 3 331.504 2.852 10 0 EFAEHO Cc1cccc(C[NH2+][C@H](C)CNC(=O)[C@H]2CCCCN2C(C)C)c1 ZINC001366334244 1337519208 /nfs/dbraw/zinc/51/92/08/1337519208.db2.gz VCTVHEBFHPALJK-IEBWSBKVSA-N 1 3 331.504 2.852 10 0 EFAEHO C[C@@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001366341214 1337522373 /nfs/dbraw/zinc/52/23/73/1337522373.db2.gz VNKPILYXZOVOQM-GJZGRUSLSA-N 1 3 347.494 2.884 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[NH2+]C/C=C\c1ccc(Cl)cc1 ZINC001366362744 1337536824 /nfs/dbraw/zinc/53/68/24/1337536824.db2.gz CYKBRSBXMYJNQP-YVACAVLKSA-N 1 3 337.895 2.788 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC001366369819 1337541982 /nfs/dbraw/zinc/54/19/82/1337541982.db2.gz UVPHKKWAUIFKMD-GFCCVEGCSA-N 1 3 346.302 2.928 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H](C[NH2+][C@H](C)c2cccc(OC)c2)C1 ZINC001366411813 1337564609 /nfs/dbraw/zinc/56/46/09/1337564609.db2.gz NDDIHRNYOVPONR-IAGOWNOFSA-N 1 3 347.503 2.536 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H](C[NH2+][C@@H](C)c2cccc(OC)c2)C1 ZINC001366411814 1337564828 /nfs/dbraw/zinc/56/48/28/1337564828.db2.gz NDDIHRNYOVPONR-IRXDYDNUSA-N 1 3 347.503 2.536 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]([NH2+]Cc2ccccc2F)C1 ZINC001366421020 1337570784 /nfs/dbraw/zinc/57/07/84/1337570784.db2.gz BVXKCSULFZMCTM-IRXDYDNUSA-N 1 3 335.467 2.683 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001366490644 1337631127 /nfs/dbraw/zinc/63/11/27/1337631127.db2.gz WJPUPRIDVGUKSF-BEFAXECRSA-N 1 3 345.531 2.938 10 0 EFAEHO Cc1cncc(C[NH2+][C@@H](C)CCNC(=O)[C@@H]2CCCCN2C(C)C)c1 ZINC001366494226 1337634977 /nfs/dbraw/zinc/63/49/77/1337634977.db2.gz UMUYMQSPROGZDE-HKUYNNGSSA-N 1 3 346.519 2.637 10 0 EFAEHO Cc1cncc(C[NH2+][C@@H](C)CCNC(=O)[C@H]2CCCCN2C(C)C)c1 ZINC001366494238 1337635060 /nfs/dbraw/zinc/63/50/60/1337635060.db2.gz UMUYMQSPROGZDE-PKOBYXMFSA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001366510128 1337650757 /nfs/dbraw/zinc/65/07/57/1337650757.db2.gz HCXYCACCCJOVRL-HUUCEWRRSA-N 1 3 333.467 2.637 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1ccc(Cl)c(F)c1)N(C)C ZINC001366510381 1337650986 /nfs/dbraw/zinc/65/09/86/1337650986.db2.gz OEMHJCUTZSYRET-BLLLJJGKSA-N 1 3 343.874 2.804 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H](C)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001366510122 1337651329 /nfs/dbraw/zinc/65/13/29/1337651329.db2.gz HCXYCACCCJOVRL-CABCVRRESA-N 1 3 333.467 2.637 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)C23CCC[NH+](CCC2)C3)c1 ZINC001366538313 1337674234 /nfs/dbraw/zinc/67/42/34/1337674234.db2.gz FBIZODJCSMVRQA-UHFFFAOYSA-N 1 3 343.515 2.673 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@@H]2CC[C@@H]3CCCC[N@@H+]32)c1 ZINC001366539221 1337675084 /nfs/dbraw/zinc/67/50/84/1337675084.db2.gz GYNINOGHNLRFJX-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(C)c(CN(C)CCNC(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)c1 ZINC001366539221 1337675087 /nfs/dbraw/zinc/67/50/87/1337675087.db2.gz GYNINOGHNLRFJX-PMACEKPBSA-N 1 3 343.515 2.868 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@@H+]1C)Cc1ccc(CF)cc1 ZINC001366542318 1337678791 /nfs/dbraw/zinc/67/87/91/1337678791.db2.gz WFGYVKXMBRJSSX-SFHVURJKSA-N 1 3 335.467 2.579 10 0 EFAEHO CN(CCNC(=O)CC[C@@H]1CCC[N@H+]1C)Cc1ccc(CF)cc1 ZINC001366542318 1337678793 /nfs/dbraw/zinc/67/87/93/1337678793.db2.gz WFGYVKXMBRJSSX-SFHVURJKSA-N 1 3 335.467 2.579 10 0 EFAEHO CN(CCNC(=O)C1(C[NH+](C)C)CC1)[C@H]1CCc2ccc(Cl)cc21 ZINC001366561788 1337695771 /nfs/dbraw/zinc/69/57/71/1337695771.db2.gz KPECAGPEPKWZJB-KRWDZBQOSA-N 1 3 349.906 2.717 10 0 EFAEHO CC(C)[C@H](C(=O)NCCN(C)[C@H](C)c1ccccc1)[NH+]1CCCC1 ZINC001366597739 1337735141 /nfs/dbraw/zinc/73/51/41/1337735141.db2.gz UFCNOHUSVPADNH-IEBWSBKVSA-N 1 3 331.504 2.916 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CCC[C@@H]2CCC[N@@H+]21)Cc1ccccc1 ZINC001366633623 1337775862 /nfs/dbraw/zinc/77/58/62/1337775862.db2.gz GXWGHONFWZWODD-RTBURBONSA-N 1 3 329.488 2.642 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CCC[C@@H]2CCC[N@H+]21)Cc1ccccc1 ZINC001366633623 1337775865 /nfs/dbraw/zinc/77/58/65/1337775865.db2.gz GXWGHONFWZWODD-RTBURBONSA-N 1 3 329.488 2.642 10 0 EFAEHO CC[N@H+](CCNC(=O)[C@H](C(C)C)N(C)C)[C@@H]1CCc2ccccc21 ZINC001366640392 1337787390 /nfs/dbraw/zinc/78/73/90/1337787390.db2.gz LBTJZZLWLSHCQE-MOPGFXCFSA-N 1 3 331.504 2.698 10 0 EFAEHO CC[N@@H+](CCNC(=O)[C@H](C(C)C)N(C)C)[C@@H]1CCc2ccccc21 ZINC001366640392 1337787393 /nfs/dbraw/zinc/78/73/93/1337787393.db2.gz LBTJZZLWLSHCQE-MOPGFXCFSA-N 1 3 331.504 2.698 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[N@H+](CC3CCCCCC3)C2)C1 ZINC001366701892 1337892120 /nfs/dbraw/zinc/89/21/20/1337892120.db2.gz VVIAGNHPHPVMBW-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CC[N@@H+](CC3CCCCCC3)C2)C1 ZINC001366701892 1337892126 /nfs/dbraw/zinc/89/21/26/1337892126.db2.gz VVIAGNHPHPVMBW-IEBWSBKVSA-N 1 3 335.536 2.737 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCN(Cc2ccccc2F)C1 ZINC001366703570 1337896006 /nfs/dbraw/zinc/89/60/06/1337896006.db2.gz OXCBPMDJJODWHV-SJLPKXTDSA-N 1 3 347.478 2.638 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC[C@H]1CCN(Cc2ccccc2F)C1 ZINC001366703570 1337896012 /nfs/dbraw/zinc/89/60/12/1337896012.db2.gz OXCBPMDJJODWHV-SJLPKXTDSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+]([C@@H](C)c2ccc(F)cc2)C1 ZINC001366710756 1337905826 /nfs/dbraw/zinc/90/58/26/1337905826.db2.gz KLUKCWZPXKUJHR-JKSUJKDBSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+]([C@@H](C)c2ccc(F)cc2)C1 ZINC001366710756 1337905830 /nfs/dbraw/zinc/90/58/30/1337905830.db2.gz KLUKCWZPXKUJHR-JKSUJKDBSA-N 1 3 335.467 2.665 10 0 EFAEHO CCC[N@H+](CCNC(=O)C1(N(C)C)CCC1)[C@@H]1CCc2ccccc21 ZINC001366716550 1337912628 /nfs/dbraw/zinc/91/26/28/1337912628.db2.gz KHOVUOBGHLRTCR-LJQANCHMSA-N 1 3 343.515 2.986 10 0 EFAEHO CCC[N@@H+](CCNC(=O)C1(N(C)C)CCC1)[C@@H]1CCc2ccccc21 ZINC001366716550 1337912629 /nfs/dbraw/zinc/91/26/29/1337912629.db2.gz KHOVUOBGHLRTCR-LJQANCHMSA-N 1 3 343.515 2.986 10 0 EFAEHO CCC[N@H+](CCNC(=O)[C@H](CC)N(C)C)[C@H]1CCc2ccccc21 ZINC001366730544 1337937559 /nfs/dbraw/zinc/93/75/59/1337937559.db2.gz BPYUZRPASKNXOF-OALUTQOASA-N 1 3 331.504 2.842 10 0 EFAEHO CCC[N@@H+](CCNC(=O)[C@H](CC)N(C)C)[C@H]1CCc2ccccc21 ZINC001366730544 1337937563 /nfs/dbraw/zinc/93/75/63/1337937563.db2.gz BPYUZRPASKNXOF-OALUTQOASA-N 1 3 331.504 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+][C@H]1CCc2c1cccc2Cl ZINC001366775198 1337994280 /nfs/dbraw/zinc/99/42/80/1337994280.db2.gz NRPITJRDKUGKCL-KRWDZBQOSA-N 1 3 337.895 2.716 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001366777101 1337995521 /nfs/dbraw/zinc/99/55/21/1337995521.db2.gz VRSPUURKDBEJPC-KRWDZBQOSA-N 1 3 337.895 2.716 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@H]1CC[N@H+](CCC2CC2)C1 ZINC001366842049 1338103396 /nfs/dbraw/zinc/10/33/96/1338103396.db2.gz MSKABMSHJKZVIE-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NCC[C@H]1CC[N@@H+](CCC2CC2)C1 ZINC001366842049 1338103400 /nfs/dbraw/zinc/10/34/00/1338103400.db2.gz MSKABMSHJKZVIE-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(CC[N@@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001366868394 1338138859 /nfs/dbraw/zinc/13/88/59/1338138859.db2.gz HTCJYLXWDOLFRO-HXUWFJFHSA-N 1 3 345.531 2.658 10 0 EFAEHO Cc1ccc(CC[N@H+](C)C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1 ZINC001366868394 1338138862 /nfs/dbraw/zinc/13/88/62/1338138862.db2.gz HTCJYLXWDOLFRO-HXUWFJFHSA-N 1 3 345.531 2.658 10 0 EFAEHO Cc1ccc(F)c(CN(C)C[C@H]2CCN(C(=O)CCC[NH+](C)C)C2)c1 ZINC001366868335 1338139000 /nfs/dbraw/zinc/13/90/00/1338139000.db2.gz WYGHDFMZBJDCBK-QGZVFWFLSA-N 1 3 349.494 2.756 10 0 EFAEHO Cc1ccc(F)c(CN(C)C[C@@H]2CCN(C(=O)CCC[NH+](C)C)C2)c1 ZINC001366868331 1338139227 /nfs/dbraw/zinc/13/92/27/1338139227.db2.gz WYGHDFMZBJDCBK-KRWDZBQOSA-N 1 3 349.494 2.756 10 0 EFAEHO CCc1ccccc1C[N@H+](C)C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001366875400 1338150457 /nfs/dbraw/zinc/15/04/57/1338150457.db2.gz WVDIZJCGKZXXTO-SFHVURJKSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1ccccc1C[N@@H+](C)C[C@@H]1CCN(C(=O)CN(C)C(C)C)C1 ZINC001366875400 1338150459 /nfs/dbraw/zinc/15/04/59/1338150459.db2.gz WVDIZJCGKZXXTO-SFHVURJKSA-N 1 3 345.531 2.870 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](C[N@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001366885352 1338165667 /nfs/dbraw/zinc/16/56/67/1338165667.db2.gz UYDJKMXWFWNLBQ-DLBZAZTESA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)[C@H](C(=O)N1CC[C@@H](C[N@@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001366885352 1338165670 /nfs/dbraw/zinc/16/56/70/1338165670.db2.gz UYDJKMXWFWNLBQ-DLBZAZTESA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](C[N@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001366885363 1338166060 /nfs/dbraw/zinc/16/60/60/1338166060.db2.gz UYDJKMXWFWNLBQ-SJORKVTESA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CC[C@H](C[N@@H+](C)CCC(C)(C)C)C1)N(C)C ZINC001366885363 1338166061 /nfs/dbraw/zinc/16/60/61/1338166061.db2.gz UYDJKMXWFWNLBQ-SJORKVTESA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001367017649 1338275456 /nfs/dbraw/zinc/27/54/56/1338275456.db2.gz YKWSZRQJZCGZPQ-HRCADAONSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001367017649 1338275458 /nfs/dbraw/zinc/27/54/58/1338275458.db2.gz YKWSZRQJZCGZPQ-HRCADAONSA-N 1 3 345.478 2.589 10 0 EFAEHO CC[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@H]1CCc2ccccc21 ZINC001367095809 1338381958 /nfs/dbraw/zinc/38/19/58/1338381958.db2.gz GHBKGYSQWLKQCP-WMZOPIPTSA-N 1 3 329.488 2.643 10 0 EFAEHO CC[C@H](CNC(=O)C12CCC[NH+](CCC1)C2)NCC=C(Cl)Cl ZINC001367110081 1338396912 /nfs/dbraw/zinc/39/69/12/1338396912.db2.gz ZJNJJHULFLTWCD-CYBMUJFWSA-N 1 3 348.318 2.666 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001367147255 1338441633 /nfs/dbraw/zinc/44/16/33/1338441633.db2.gz DWLHNALFHGCNNN-HUUCEWRRSA-N 1 3 333.467 2.637 10 0 EFAEHO C[NH+](C)CCC(=O)NC1(CNCc2ccccc2Cl)CCCC1 ZINC001367153286 1338449740 /nfs/dbraw/zinc/44/97/40/1338449740.db2.gz BCMGDKFWCSLIFB-UHFFFAOYSA-N 1 3 337.895 2.810 10 0 EFAEHO CC[C@H](F)CNCc1ccc(CNC(=O)C23CCC[NH+]2CCC3)cc1 ZINC001367210310 1338520270 /nfs/dbraw/zinc/52/02/70/1338520270.db2.gz PZPADMBTMWRAOA-SFHVURJKSA-N 1 3 347.478 2.769 10 0 EFAEHO CN(CC(=O)N1CCC[C@@H]1C[NH2+]CC1CC(C)(C)C1)CC(C)(C)C ZINC001367219978 1338530234 /nfs/dbraw/zinc/53/02/34/1338530234.db2.gz HXFOXLHOBVBNDK-QGZVFWFLSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001367228640 1338537080 /nfs/dbraw/zinc/53/70/80/1338537080.db2.gz RIRUXSWNGVABIW-ZWKOTPCHSA-N 1 3 335.467 2.691 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H](C)C[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001367248582 1338550122 /nfs/dbraw/zinc/55/01/22/1338550122.db2.gz HREADYAEQOZVPE-AEFFLSMTSA-N 1 3 337.552 2.885 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]C/C=C\Cl)CCCC1 ZINC001367327744 1338626899 /nfs/dbraw/zinc/62/68/99/1338626899.db2.gz BUOKRYKXTBDXRT-OWEGLKQLSA-N 1 3 327.900 2.630 10 0 EFAEHO C[C@@H](C[NH2+]C[C@H]1CCC(F)(F)C1)N(C)C(=O)CN(C)CC(C)(C)C ZINC001367387578 1338684097 /nfs/dbraw/zinc/68/40/97/1338684097.db2.gz VQRYHGKZHPSKAX-GJZGRUSLSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(C2CC2)cc1)N(C)C ZINC001367397556 1338695280 /nfs/dbraw/zinc/69/52/80/1338695280.db2.gz NGKFBXIAUXTUNI-DNVCBOLYSA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@H](C)[NH2+]Cc2ccccc2F)C1 ZINC001367450145 1338753333 /nfs/dbraw/zinc/75/33/33/1338753333.db2.gz NNLCMXPNNWHCTA-FUHWJXTLSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1cccc(F)c1 ZINC001367470497 1338770159 /nfs/dbraw/zinc/77/01/59/1338770159.db2.gz YVCNIVOALISCTF-MOPGFXCFSA-N 1 3 349.494 2.929 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1cccc(F)c1 ZINC001367470506 1338770420 /nfs/dbraw/zinc/77/04/20/1338770420.db2.gz YVCNIVOALISCTF-RTBURBONSA-N 1 3 349.494 2.929 10 0 EFAEHO Cc1ccc(CN[C@H](CNC(=O)CC[NH+](C)C)C(C)C)c(Cl)c1 ZINC001367486915 1338786912 /nfs/dbraw/zinc/78/69/12/1338786912.db2.gz ZIWVNYZHOVDGOM-QGZVFWFLSA-N 1 3 339.911 2.831 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C(C)C ZINC001367487906 1338787567 /nfs/dbraw/zinc/78/75/67/1338787567.db2.gz BYUUHICEJLLTGS-LJQANCHMSA-N 1 3 333.520 2.874 10 0 EFAEHO CCc1ccc(C[NH2+][C@H](CNC(=O)CN2CC[C@H](C)C2)C(C)C)cc1 ZINC001367494391 1338793587 /nfs/dbraw/zinc/79/35/87/1338793587.db2.gz YTILIOGPERJXKA-FXAWDEMLSA-N 1 3 345.531 2.821 10 0 EFAEHO CN(CC[N@H+](C)[C@H]1CCCc2ccccc21)C(=O)CN1CCCC1 ZINC001367550514 1338859911 /nfs/dbraw/zinc/85/99/11/1338859911.db2.gz ICAHQDQLFPYREO-IBGZPJMESA-N 1 3 329.488 2.550 10 0 EFAEHO CN(CC[N@@H+](C)[C@H]1CCCc2ccccc21)C(=O)CN1CCCC1 ZINC001367550514 1338859914 /nfs/dbraw/zinc/85/99/14/1338859914.db2.gz ICAHQDQLFPYREO-IBGZPJMESA-N 1 3 329.488 2.550 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CC[N@H+](C)C1)Cc1ccc(C2CCC2)cc1 ZINC001367549680 1338860115 /nfs/dbraw/zinc/86/01/15/1338860115.db2.gz FDYJSIDZXBUGQY-HXUWFJFHSA-N 1 3 343.515 2.796 10 0 EFAEHO CN(CCN(C)C(=O)[C@@H]1CC[N@@H+](C)C1)Cc1ccc(C2CCC2)cc1 ZINC001367549680 1338860117 /nfs/dbraw/zinc/86/01/17/1338860117.db2.gz FDYJSIDZXBUGQY-HXUWFJFHSA-N 1 3 343.515 2.796 10 0 EFAEHO CN(CC[N@H+](C)CC/C=C/c1ccccc1)C(=O)CN1CCCC1 ZINC001367554430 1338865010 /nfs/dbraw/zinc/86/50/10/1338865010.db2.gz TVZODVCMUYYZDL-WUXMJOGZSA-N 1 3 329.488 2.576 10 0 EFAEHO CN(CC[N@@H+](C)CC/C=C/c1ccccc1)C(=O)CN1CCCC1 ZINC001367554430 1338865011 /nfs/dbraw/zinc/86/50/11/1338865011.db2.gz TVZODVCMUYYZDL-WUXMJOGZSA-N 1 3 329.488 2.576 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C)C[NH2+]CC1CCC(F)(F)CC1 ZINC001367736205 1338967615 /nfs/dbraw/zinc/96/76/15/1338967615.db2.gz DYLHYLNCYQMJHS-GOEBONIOSA-N 1 3 345.478 2.781 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)CNCc1ccc(C)cc1Cl ZINC001367763010 1338988882 /nfs/dbraw/zinc/98/88/82/1338988882.db2.gz CCBSYXKBLQEJNQ-AWEZNQCLSA-N 1 3 325.884 2.585 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)CNCc1ccc(C)cc1Cl ZINC001367763010 1338988885 /nfs/dbraw/zinc/98/88/85/1338988885.db2.gz CCBSYXKBLQEJNQ-AWEZNQCLSA-N 1 3 325.884 2.585 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[NH2+]Cc1cc(Cl)cc(Cl)c1)N(C)C ZINC001367767588 1338993069 /nfs/dbraw/zinc/99/30/69/1338993069.db2.gz MXZRLPAUHNJGJO-XHDPSFHLSA-N 1 3 346.302 2.928 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC001367774110 1338998515 /nfs/dbraw/zinc/99/85/15/1338998515.db2.gz HJXZCOGUVDYHCY-KBPBESRZSA-N 1 3 325.884 2.836 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1cc(F)ccc1C ZINC001367803265 1339023036 /nfs/dbraw/zinc/02/30/36/1339023036.db2.gz LYEAKYYPEDQTJB-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@H](C)CN(C)Cc1cc(F)ccc1C ZINC001367803265 1339023039 /nfs/dbraw/zinc/02/30/39/1339023039.db2.gz LYEAKYYPEDQTJB-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1cc(F)ccc1C ZINC001367803267 1339023144 /nfs/dbraw/zinc/02/31/44/1339023144.db2.gz LYEAKYYPEDQTJB-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1cc(F)ccc1C ZINC001367803267 1339023147 /nfs/dbraw/zinc/02/31/47/1339023147.db2.gz LYEAKYYPEDQTJB-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(F)c1 ZINC001367816212 1339034108 /nfs/dbraw/zinc/03/41/08/1339034108.db2.gz SUSXZBWKRBCYJW-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@H]1C(=O)N[C@@H](C)CN(C)Cc1cccc(F)c1 ZINC001367816212 1339034109 /nfs/dbraw/zinc/03/41/09/1339034109.db2.gz SUSXZBWKRBCYJW-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)Cc1ccccc1C1CC1)N(C)C ZINC001367817352 1339034916 /nfs/dbraw/zinc/03/49/16/1339034916.db2.gz ZTTGMKNFHIYKAY-HNAYVOBHSA-N 1 3 331.504 2.841 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)Cc1ccccc1C1CC1)N(C)C ZINC001367817352 1339034919 /nfs/dbraw/zinc/03/49/19/1339034919.db2.gz ZTTGMKNFHIYKAY-HNAYVOBHSA-N 1 3 331.504 2.841 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(C(F)F)c1)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001367854562 1339070180 /nfs/dbraw/zinc/07/01/80/1339070180.db2.gz JIHGGTFUTSIFFF-CJNGLKHVSA-N 1 3 339.430 2.512 10 0 EFAEHO C[C@H](CN(C)Cc1cccc(C(F)F)c1)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001367854562 1339070184 /nfs/dbraw/zinc/07/01/84/1339070184.db2.gz JIHGGTFUTSIFFF-CJNGLKHVSA-N 1 3 339.430 2.512 10 0 EFAEHO CC[C@H]1CN(C(=O)CN(C)C(C)C)CC[C@H]1[NH2+]Cc1ccccc1 ZINC001367924560 1339111225 /nfs/dbraw/zinc/11/12/25/1339111225.db2.gz ASRXTMUNFZCFBH-RBUKOAKNSA-N 1 3 331.504 2.744 10 0 EFAEHO CC1CC(CN2CC[C@H]2CNC(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001367960093 1339129082 /nfs/dbraw/zinc/12/90/82/1339129082.db2.gz MVNJKUWIQURSEO-HTWSVDAQSA-N 1 3 335.536 2.876 10 0 EFAEHO CC1CC(CN2CC[C@H]2CNC(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001367960093 1339129083 /nfs/dbraw/zinc/12/90/83/1339129083.db2.gz MVNJKUWIQURSEO-HTWSVDAQSA-N 1 3 335.536 2.876 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC[C@H]2CCN2[C@H]2CCc3ccccc32)CC1 ZINC001367960012 1339129177 /nfs/dbraw/zinc/12/91/77/1339129177.db2.gz HZXIARZXNPMLBV-QUCCMNQESA-N 1 3 341.499 2.596 10 0 EFAEHO CN(CC(=O)NCC1([NH2+][C@@H]2CCc3c2cccc3F)CC1)C1CCC1 ZINC001368003972 1339153377 /nfs/dbraw/zinc/15/33/77/1339153377.db2.gz SIKPRTNSIGZJCK-GOSISDBHSA-N 1 3 345.462 2.536 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CC1)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001368011984 1339157088 /nfs/dbraw/zinc/15/70/88/1339157088.db2.gz HJXQXDBKUFNUSL-CVEARBPZSA-N 1 3 333.501 2.503 10 0 EFAEHO O=C(NCC1(NCc2ccsc2)CC1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001368011984 1339157091 /nfs/dbraw/zinc/15/70/91/1339157091.db2.gz HJXQXDBKUFNUSL-CVEARBPZSA-N 1 3 333.501 2.503 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+][C@@H](C)c2cccc(Cl)c2)CC1)N(C)C ZINC001368018466 1339159966 /nfs/dbraw/zinc/15/99/66/1339159966.db2.gz ILYVHOFTSJVIMS-BBRMVZONSA-N 1 3 337.895 2.980 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1([NH2+]CC2CCC(C)CC2)CC1 ZINC001368039515 1339170760 /nfs/dbraw/zinc/17/07/60/1339170760.db2.gz KABBWCRNAKKODK-DAWZGUTISA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+][C@@H](C)c2ccc3c(c2)CCC3)CC1 ZINC001368041876 1339171987 /nfs/dbraw/zinc/17/19/87/1339171987.db2.gz LRDKUFPUKBHZFX-INIZCTEOSA-N 1 3 343.515 2.815 10 0 EFAEHO CC[C@H](C)C[N@@H+]1CC[C@@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001368070506 1339185862 /nfs/dbraw/zinc/18/58/62/1339185862.db2.gz WWVWBYYNWSHWKR-FXAWDEMLSA-N 1 3 337.552 2.935 10 0 EFAEHO CC[C@H](C)C[N@H+]1CC[C@@]2(CCN(C(=O)CN(C)CC(C)(C)C)C2)C1 ZINC001368070506 1339185863 /nfs/dbraw/zinc/18/58/63/1339185863.db2.gz WWVWBYYNWSHWKR-FXAWDEMLSA-N 1 3 337.552 2.935 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H]1CCN(C(=O)CN(C)C(C)C)[C@@H](C)C1 ZINC001368102408 1339195406 /nfs/dbraw/zinc/19/54/06/1339195406.db2.gz GSARUXPKXDHNRT-PKOBYXMFSA-N 1 3 331.504 2.804 10 0 EFAEHO CC(C)CC[NH2+][C@@H]1CCN(C(=O)CN(C)CC(C)(C)C)[C@@H](C)C1 ZINC001368107970 1339197432 /nfs/dbraw/zinc/19/74/32/1339197432.db2.gz WSUCDSZLYHPWTC-DLBZAZTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[NH2+][C@H]1CCN(C(=O)CN(C)CC(C)(C)C)[C@H](C)C1 ZINC001368107985 1339197541 /nfs/dbraw/zinc/19/75/41/1339197541.db2.gz WSUCDSZLYHPWTC-SJORKVTESA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]Cc1ccccc1Cl ZINC001368125948 1339205490 /nfs/dbraw/zinc/20/54/90/1339205490.db2.gz XCWRQGIHPSJMDJ-MRXNPFEDSA-N 1 3 337.895 2.761 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]Cc1ccccc1)C1CCCC1)N(C)C ZINC001368141187 1339215185 /nfs/dbraw/zinc/21/51/85/1339215185.db2.gz BUIKOKUYUQEFOQ-RTBURBONSA-N 1 3 331.504 2.791 10 0 EFAEHO CC[C@@H](F)CN1CC[C@@]2(C1)CCCCN(C(=O)CCC[NH+](C)C)C2 ZINC001368141477 1339215236 /nfs/dbraw/zinc/21/52/36/1339215236.db2.gz MZQFOBYMBNECKW-IEBWSBKVSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@]2(CC[N@H+](CC[C@H](C)F)C2)C1 ZINC001368142884 1339216140 /nfs/dbraw/zinc/21/61/40/1339216140.db2.gz FQLUQCNMVWFLGT-HKUYNNGSSA-N 1 3 341.515 2.781 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@]2(CC[N@@H+](CC[C@H](C)F)C2)C1 ZINC001368142884 1339216142 /nfs/dbraw/zinc/21/61/42/1339216142.db2.gz FQLUQCNMVWFLGT-HKUYNNGSSA-N 1 3 341.515 2.781 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C[NH2+]CC1CC(F)(F)C1)C1CCCC1)N(C)C ZINC001368145750 1339218468 /nfs/dbraw/zinc/21/84/68/1339218468.db2.gz PDOVEJZCGAUFQO-HZPDHXFCSA-N 1 3 345.478 2.637 10 0 EFAEHO CC[C@@H](C(=O)N[C@@]1(C)CC[N@H+](CC2CC(F)(F)C2)C1)N(CC)CC ZINC001368168880 1339232691 /nfs/dbraw/zinc/23/26/91/1339232691.db2.gz FCLOHMQLTPKVCP-RDJZCZTQSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H](C(=O)N[C@@]1(C)CC[N@@H+](CC2CC(F)(F)C2)C1)N(CC)CC ZINC001368168880 1339232693 /nfs/dbraw/zinc/23/26/93/1339232693.db2.gz FCLOHMQLTPKVCP-RDJZCZTQSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@@H](C(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1)[NH+](CC)CC ZINC001368171891 1339234275 /nfs/dbraw/zinc/23/42/75/1339234275.db2.gz HSPITLOLDZJANY-ICSRJNTNSA-N 1 3 331.504 2.888 10 0 EFAEHO CCN1CCC(F)(F)[C@@H](CNC(=O)[C@@H](C(C)C)[NH+]2CCCCC2)C1 ZINC001368252521 1339284636 /nfs/dbraw/zinc/28/46/36/1339284636.db2.gz SCSLFBGEMYGJLT-JKSUJKDBSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC[C@H](C)F)N(C)C ZINC001368345544 1339309045 /nfs/dbraw/zinc/30/90/45/1339309045.db2.gz HWFRYNMEHBRFEZ-IECFSIQFSA-N 1 3 341.515 2.680 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC[C@H](C)F)N(C)C ZINC001368345544 1339309047 /nfs/dbraw/zinc/30/90/47/1339309047.db2.gz HWFRYNMEHBRFEZ-IECFSIQFSA-N 1 3 341.515 2.680 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2cc(C)ccc2C)C1 ZINC001368352469 1339312515 /nfs/dbraw/zinc/31/25/15/1339312515.db2.gz NXYBGARRWFYPDT-ICSRJNTNSA-N 1 3 345.531 2.829 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)C[C@H]1CCN1CC1CCC1)[NH+]1CCCCC1 ZINC001368448602 1339382492 /nfs/dbraw/zinc/38/24/92/1339382492.db2.gz BPFGBSUDIMPJNW-RTBURBONSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@H](C(=O)NCc1cccc2c1CC[N@H+](CC[C@H](C)F)C2)N(C)C ZINC001368449541 1339385395 /nfs/dbraw/zinc/38/53/95/1339385395.db2.gz OWPWNEBYYKIKTC-HNAYVOBHSA-N 1 3 349.494 2.749 10 0 EFAEHO CC[C@H](C(=O)NCc1cccc2c1CC[N@@H+](CC[C@H](C)F)C2)N(C)C ZINC001368449541 1339385399 /nfs/dbraw/zinc/38/53/99/1339385399.db2.gz OWPWNEBYYKIKTC-HNAYVOBHSA-N 1 3 349.494 2.749 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@H]3C)CCC2)cc1 ZINC001368493916 1339431396 /nfs/dbraw/zinc/43/13/96/1339431396.db2.gz AQYNUOGKTCMUCK-QZTJIDSGSA-N 1 3 343.515 2.996 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN3[C@@H](C)CC[C@@H]3C)CCC2)cc1 ZINC001368493923 1339431540 /nfs/dbraw/zinc/43/15/40/1339431540.db2.gz AQYNUOGKTCMUCK-ROUUACIJSA-N 1 3 343.515 2.996 10 0 EFAEHO CN(CCC[N@H+](C)CC[C@H]1CCCC1(F)F)C(=O)[C@@H]1CCCN1C ZINC001368531904 1339469273 /nfs/dbraw/zinc/46/92/73/1339469273.db2.gz XVUUBUBACMEJHS-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCC[N@@H+](C)CC[C@H]1CCCC1(F)F)C(=O)[C@@H]1CCCN1C ZINC001368531904 1339469276 /nfs/dbraw/zinc/46/92/76/1339469276.db2.gz XVUUBUBACMEJHS-CVEARBPZSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]([NH2+][C@@H](C)c2cccc(OC)c2)C1)N(C)C ZINC001368566793 1339515582 /nfs/dbraw/zinc/51/55/82/1339515582.db2.gz HGEFAKZIWHCAPP-RIVXBTQJSA-N 1 3 347.503 2.581 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1C[C@H]([NH2+][C@H](C)c2cccc(OC)c2)C1)N(C)C ZINC001368566783 1339515707 /nfs/dbraw/zinc/51/57/07/1339515707.db2.gz HGEFAKZIWHCAPP-FXRXJOCMSA-N 1 3 347.503 2.581 10 0 EFAEHO CN(CC(=O)NC[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc32)C1)C1CCC1 ZINC001368569884 1339520421 /nfs/dbraw/zinc/52/04/21/1339520421.db2.gz DALOEHDVZWBGGR-WRWLIDTKSA-N 1 3 341.499 2.643 10 0 EFAEHO CCC1([NH2+]Cc2ccccc2)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001368593257 1339539501 /nfs/dbraw/zinc/53/95/01/1339539501.db2.gz KJNHJSPLFJBDMN-SFHVURJKSA-N 1 3 329.488 2.642 10 0 EFAEHO CCC1([NH2+]Cc2ccccc2C)CCN(C(=O)CN2CCCC2)CC1 ZINC001368607180 1339547155 /nfs/dbraw/zinc/54/71/55/1339547155.db2.gz NWZWJBFJTQVJQE-UHFFFAOYSA-N 1 3 343.515 2.952 10 0 EFAEHO C[C@H](F)CC[NH2+][C@@H]1CC[C@H](CNC(=O)CN(C)CC(C)(C)C)C1 ZINC001368639668 1339560046 /nfs/dbraw/zinc/56/00/46/1339560046.db2.gz AEMHZRLIVTWWML-HRCADAONSA-N 1 3 329.504 2.587 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]CCc2ccc(C)cc2)C1)N(C)C ZINC001368642868 1339562214 /nfs/dbraw/zinc/56/22/14/1339562214.db2.gz ZBPBVKOGVFSGEU-ZCNNSNEGSA-N 1 3 345.531 2.752 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C)([NH2+]CC=C(Cl)Cl)CC1)N(C)C ZINC001368665870 1339578830 /nfs/dbraw/zinc/57/88/30/1339578830.db2.gz VZTYNMJGFYXJDB-GFCCVEGCSA-N 1 3 336.307 2.616 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C)([NH2+]CC2CC3(CCC3)C2)CC1 ZINC001368668544 1339581999 /nfs/dbraw/zinc/58/19/99/1339581999.db2.gz GGMLCPUMIGDMMJ-UHFFFAOYSA-N 1 3 335.536 2.878 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]2[C@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)[C@H]21 ZINC001368692210 1339607006 /nfs/dbraw/zinc/60/70/06/1339607006.db2.gz FICKEUPJYZCUAI-NJAFHUGGSA-N 1 3 337.552 2.980 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]2[C@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)[C@H]21 ZINC001368692210 1339607008 /nfs/dbraw/zinc/60/70/08/1339607008.db2.gz FICKEUPJYZCUAI-NJAFHUGGSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CCc2ccccc2)[C@H](C)C1 ZINC001368695607 1339610861 /nfs/dbraw/zinc/61/08/61/1339610861.db2.gz JLNAWSRSOQRHAX-MJGOQNOKSA-N 1 3 331.504 2.538 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CCc2ccccc2)[C@H](C)C1 ZINC001368695607 1339610864 /nfs/dbraw/zinc/61/08/64/1339610864.db2.gz JLNAWSRSOQRHAX-MJGOQNOKSA-N 1 3 331.504 2.538 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CCc2ccccc2)[C@@H](C)C1 ZINC001368695591 1339611057 /nfs/dbraw/zinc/61/10/57/1339611057.db2.gz JLNAWSRSOQRHAX-HKUYNNGSSA-N 1 3 331.504 2.538 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CCc2ccccc2)[C@@H](C)C1 ZINC001368695591 1339611060 /nfs/dbraw/zinc/61/10/60/1339611060.db2.gz JLNAWSRSOQRHAX-HKUYNNGSSA-N 1 3 331.504 2.538 10 0 EFAEHO Cc1ccc(F)cc1CN1CC[C@H](NC(=O)CC[NH+](C)C)C[C@H]1C ZINC001368698529 1339614152 /nfs/dbraw/zinc/61/41/52/1339614152.db2.gz UQNPKZWBNZCCTG-QAPCUYQASA-N 1 3 335.467 2.555 10 0 EFAEHO C[C@@H](CCNC(=O)CC[NH+](C)C)NCc1c(Cl)cccc1Cl ZINC001368736257 1339656963 /nfs/dbraw/zinc/65/69/63/1339656963.db2.gz TZCXHRTYGAVOSR-LBPRGKRZSA-N 1 3 346.302 2.930 10 0 EFAEHO CC(C)[C@@H](C(=O)N1CCCCC[C@@H]([NH2+]C/C=C/Cl)C1)N(C)C ZINC001368753852 1339677981 /nfs/dbraw/zinc/67/79/81/1339677981.db2.gz BTBLDSOPHCDZDE-VQVOLHRSSA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N1CCCCC[C@H]([NH2+]C/C=C\Cl)C1 ZINC001368761808 1339687955 /nfs/dbraw/zinc/68/79/55/1339687955.db2.gz QTDSUZXFKQQVRA-SQGUUQMOSA-N 1 3 341.927 2.973 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N1CCCCC[C@H]([NH2+]C/C=C/Cl)C1 ZINC001368761792 1339688019 /nfs/dbraw/zinc/68/80/19/1339688019.db2.gz QTDSUZXFKQQVRA-NGXUEJOTSA-N 1 3 341.927 2.973 10 0 EFAEHO CC[C@@H](F)C[N@H+](CC)CC1CCN(C(=O)[C@H](CC)N(C)C)CC1 ZINC001368774516 1339699212 /nfs/dbraw/zinc/69/92/12/1339699212.db2.gz DUFVPFTVQZOUQN-SJORKVTESA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@@H](F)C[N@@H+](CC)CC1CCN(C(=O)[C@H](CC)N(C)C)CC1 ZINC001368774516 1339699217 /nfs/dbraw/zinc/69/92/17/1339699217.db2.gz DUFVPFTVQZOUQN-SJORKVTESA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@@H]1[C@@H](NC(=O)CCC[NH+](C)C)CCN1Cc1cc2ccccc2o1 ZINC001368782129 1339708800 /nfs/dbraw/zinc/70/88/00/1339708800.db2.gz IKLGOOASZXHBLP-QAPCUYQASA-N 1 3 343.471 2.854 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1CCN(C/C=C/c2ccccc2)[C@@H]1C ZINC001368791914 1339721361 /nfs/dbraw/zinc/72/13/61/1339721361.db2.gz DKVILIPAZGMLQB-NZVCTJPZSA-N 1 3 329.488 2.621 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1CCN(C/C=C/c2ccccc2)[C@@H]1C ZINC001368791914 1339721362 /nfs/dbraw/zinc/72/13/62/1339721362.db2.gz DKVILIPAZGMLQB-NZVCTJPZSA-N 1 3 329.488 2.621 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[N@H+](C)CCc1ccc(C)cc1)N(C)C ZINC001368799548 1339733582 /nfs/dbraw/zinc/73/35/82/1339733582.db2.gz JNSXLDPZAQREME-VQTJNVASSA-N 1 3 345.531 2.801 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[N@@H+](C)CCc1ccc(C)cc1)N(C)C ZINC001368799548 1339733587 /nfs/dbraw/zinc/73/35/87/1339733587.db2.gz JNSXLDPZAQREME-VQTJNVASSA-N 1 3 345.531 2.801 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCN(Cc2ccccc2F)CC(C)(C)C1 ZINC001368830068 1339771338 /nfs/dbraw/zinc/77/13/38/1339771338.db2.gz YMKIWSLGWKXKEZ-KRWDZBQOSA-N 1 3 349.494 2.884 10 0 EFAEHO C[C@@H]([NH2+]Cc1ccc(Cl)cc1)[C@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001368840832 1339780312 /nfs/dbraw/zinc/78/03/12/1339780312.db2.gz LUJHEWZFPQOZME-KGLIPLIRSA-N 1 3 337.895 2.807 10 0 EFAEHO Cc1ncccc1C[NH2+][C@@H](C)[C@H](C)NC(=O)C(C)(C)N1CCCCC1 ZINC001368845940 1339784728 /nfs/dbraw/zinc/78/47/28/1339784728.db2.gz BZXXDTCAUDFMQL-HOTGVXAUSA-N 1 3 346.519 2.637 10 0 EFAEHO CN(C(=O)[C@H]1CC[N@H+](C)C1)C1CCC(NC/C(Cl)=C/Cl)CC1 ZINC001368895670 1339835293 /nfs/dbraw/zinc/83/52/93/1339835293.db2.gz DVXTYWWJTJCBKE-HMSKSQMHSA-N 1 3 348.318 2.616 10 0 EFAEHO CN(C(=O)[C@H]1CC[N@@H+](C)C1)C1CCC(NC/C(Cl)=C/Cl)CC1 ZINC001368895670 1339835297 /nfs/dbraw/zinc/83/52/97/1339835297.db2.gz DVXTYWWJTJCBKE-HMSKSQMHSA-N 1 3 348.318 2.616 10 0 EFAEHO Cc1cccnc1CN[C@@H](C)[C@H](C)NC(=O)CCC[NH+]1CCCCC1 ZINC001368902450 1339843585 /nfs/dbraw/zinc/84/35/85/1339843585.db2.gz UQKPSNZAVKMKMB-ROUUACIJSA-N 1 3 346.519 2.639 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC(C)(C)C[NH2+]Cc2ccsc2)C1 ZINC001368918816 1339864031 /nfs/dbraw/zinc/86/40/31/1339864031.db2.gz KUWRRQGIFLKBGW-HNNXBMFYSA-N 1 3 337.533 2.664 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C)N(C)Cc1cccc(Cl)c1 ZINC001368942220 1339888900 /nfs/dbraw/zinc/88/89/00/1339888900.db2.gz SQENOBSRIDLECI-CKEIUWERSA-N 1 3 337.895 2.617 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C)N(C)Cc1cccc(Cl)c1 ZINC001368942220 1339888906 /nfs/dbraw/zinc/88/89/06/1339888906.db2.gz SQENOBSRIDLECI-CKEIUWERSA-N 1 3 337.895 2.617 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@H+](CC2CC3(CCC3)C2)CC1(C)C)N(C)C ZINC001369129257 1339934179 /nfs/dbraw/zinc/93/41/79/1339934179.db2.gz OQOZTPNNBASDGI-MSOLQXFVSA-N 1 3 349.563 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1C[N@@H+](CC2CC3(CCC3)C2)CC1(C)C)N(C)C ZINC001369129257 1339934180 /nfs/dbraw/zinc/93/41/80/1339934180.db2.gz OQOZTPNNBASDGI-MSOLQXFVSA-N 1 3 349.563 2.980 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)C3(N(C)C)CCC3)C2)cc1C ZINC001369171074 1339950896 /nfs/dbraw/zinc/95/08/96/1339950896.db2.gz WEQWZTIKWQNUAL-WGSAOQKQSA-N 1 3 343.515 2.772 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2)C1)N(C)C ZINC001369173826 1339952592 /nfs/dbraw/zinc/95/25/92/1339952592.db2.gz MCPWHOZVZONJLB-USJZOSNVSA-N 1 3 335.467 2.711 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]([NH2+]CCC1CCCC1)C1CC1)N1CCCC1 ZINC001370231938 1339978585 /nfs/dbraw/zinc/97/85/85/1339978585.db2.gz XHHYMHBVVWTDJR-GOSISDBHSA-N 1 3 335.536 2.926 10 0 EFAEHO CN(C/C=C/Cl)C[C@@H]1CCCN(C(=O)CC[C@H]2CCC[N@H+]2C)C1 ZINC001370292340 1340013818 /nfs/dbraw/zinc/01/38/18/1340013818.db2.gz AZIJCWSUIRCLEP-XYGPEJJOSA-N 1 3 341.927 2.784 10 0 EFAEHO CN(C/C=C/Cl)C[C@@H]1CCCN(C(=O)CC[C@H]2CCC[N@@H+]2C)C1 ZINC001370292340 1340013817 /nfs/dbraw/zinc/01/38/17/1340013817.db2.gz AZIJCWSUIRCLEP-XYGPEJJOSA-N 1 3 341.927 2.784 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@H+](C)CCC(C)(C)C)C1 ZINC001370318738 1340032403 /nfs/dbraw/zinc/03/24/03/1340032403.db2.gz XQIUFLCJDUSPAO-QGZVFWFLSA-N 1 3 325.541 2.933 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]([NH2+]CC3CCC4(CC4)CC3)C2)CCC1 ZINC001370483665 1340096099 /nfs/dbraw/zinc/09/60/99/1340096099.db2.gz KRNVYTKWSPQVEG-QAQDUYKDSA-N 1 3 333.520 2.678 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CCCC1)N(C)C ZINC001370587046 1340149362 /nfs/dbraw/zinc/14/93/62/1340149362.db2.gz QIOFTNJVGRZVGF-IPQPSQTFSA-N 1 3 335.536 2.874 10 0 EFAEHO CC(C)[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCCC1)N(C)C ZINC001370587046 1340149363 /nfs/dbraw/zinc/14/93/63/1340149363.db2.gz QIOFTNJVGRZVGF-IPQPSQTFSA-N 1 3 335.536 2.874 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccccc32)C1 ZINC001370712895 1340188102 /nfs/dbraw/zinc/18/81/02/1340188102.db2.gz QOPSHNZIYXYETD-ZIFCJYIRSA-N 1 3 329.488 2.643 10 0 EFAEHO O=C(CCC[NH+]1CCCCC1)N[C@H]1C[C@@H](NCc2ccccc2F)C1 ZINC001370718609 1340189052 /nfs/dbraw/zinc/18/90/52/1340189052.db2.gz VNELJFZJLIXQFA-HDICACEKSA-N 1 3 347.478 2.829 10 0 EFAEHO Cc1nc(C(C)C)ccc1C[NH2+][C@H]1C[C@@H](NC(=O)CN(C)C(C)C)C1 ZINC001370721127 1340190292 /nfs/dbraw/zinc/19/02/92/1340190292.db2.gz VERYTVVERFFOFJ-HDICACEKSA-N 1 3 346.519 2.590 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001370757098 1340200188 /nfs/dbraw/zinc/20/01/88/1340200188.db2.gz YCSWPWOUGZWTNG-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1CCC[N@@H+](Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001370757098 1340200189 /nfs/dbraw/zinc/20/01/89/1340200189.db2.gz YCSWPWOUGZWTNG-AZUAARDMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@H+](Cc2ccc(F)cc2C)C1)N(C)C ZINC001370789352 1340211678 /nfs/dbraw/zinc/21/16/78/1340211678.db2.gz ZFCDJGAQQVNFBA-VQIMIIECSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCC[N@@H+](Cc2ccc(F)cc2C)C1)N(C)C ZINC001370789352 1340211681 /nfs/dbraw/zinc/21/16/81/1340211681.db2.gz ZFCDJGAQQVNFBA-VQIMIIECSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C1CCC(NC(=O)CN(C)C(C)C)CC1 ZINC001371073511 1340345704 /nfs/dbraw/zinc/34/57/04/1340345704.db2.gz NWGJIMWUQAYPLE-UHFFFAOYSA-N 1 3 349.494 2.991 10 0 EFAEHO CCc1ccc(CC[NH2+][C@@H](C)CNC(=O)[C@H]2CCCN2C(C)C)cc1 ZINC001371179158 1340397435 /nfs/dbraw/zinc/39/74/35/1340397435.db2.gz QGUKTZUOHHGBDY-FXAWDEMLSA-N 1 3 345.531 2.759 10 0 EFAEHO CCc1cccc(C[NH2+][C@H](C)CNC(=O)C(C)(C)N2CCCC2)c1 ZINC001371310055 1340489380 /nfs/dbraw/zinc/48/93/80/1340489380.db2.gz VWMZYMDYBYNZOQ-MRXNPFEDSA-N 1 3 331.504 2.718 10 0 EFAEHO C[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CC1CCCCC1 ZINC001371362545 1340529798 /nfs/dbraw/zinc/52/97/98/1340529798.db2.gz JMJCKJRESHKPHO-DNVCBOLYSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H](C)CNC(=O)CN2CC[C@H](C)C2)c(C)c1 ZINC001371366113 1340532585 /nfs/dbraw/zinc/53/25/85/1340532585.db2.gz UXDBBSRGZUNGSB-KBXCAEBGSA-N 1 3 331.504 2.548 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@@H](C)CCNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001371828918 1340706987 /nfs/dbraw/zinc/70/69/87/1340706987.db2.gz FGMVLKUIRGMPHM-QAPCUYQASA-N 1 3 331.504 2.630 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](CCc2ccccc2F)C1)N(C)C ZINC001373242065 1340964274 /nfs/dbraw/zinc/96/42/74/1340964274.db2.gz YGVWNNXHJLWOEG-VQIMIIECSA-N 1 3 349.494 2.537 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](CCc2ccccc2F)C1)N(C)C ZINC001373242065 1340964275 /nfs/dbraw/zinc/96/42/75/1340964275.db2.gz YGVWNNXHJLWOEG-VQIMIIECSA-N 1 3 349.494 2.537 10 0 EFAEHO Cc1cc(C)cc(C[N@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001373250403 1340967187 /nfs/dbraw/zinc/96/71/87/1340967187.db2.gz ZGNHCVONUHVCCU-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001373250403 1340967189 /nfs/dbraw/zinc/96/71/89/1340967189.db2.gz ZGNHCVONUHVCCU-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@@H](F)CN(C)C[C@@H]1CCN(C(=O)CCC[NH+]2CCCCC2)C1 ZINC001373308199 1340984838 /nfs/dbraw/zinc/98/48/38/1340984838.db2.gz AQVJLNICMFCLES-ZWKOTPCHSA-N 1 3 341.515 2.781 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@H]1CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001373636542 1341077989 /nfs/dbraw/zinc/07/79/89/1341077989.db2.gz AJOJUIWOJHDEPP-LJQANCHMSA-N 1 3 329.488 2.596 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N(C)[C@H]1CC[N@H+](Cc2ccccc2C)C1 ZINC001373674529 1341094008 /nfs/dbraw/zinc/09/40/08/1341094008.db2.gz VSHKOXQFRHAQCV-OALUTQOASA-N 1 3 349.494 2.708 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2C)C1 ZINC001373674529 1341094010 /nfs/dbraw/zinc/09/40/10/1341094010.db2.gz VSHKOXQFRHAQCV-OALUTQOASA-N 1 3 349.494 2.708 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001373687209 1341101252 /nfs/dbraw/zinc/10/12/52/1341101252.db2.gz FFACXTYZZUJEPU-ROUUACIJSA-N 1 3 335.536 2.686 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001373687209 1341101253 /nfs/dbraw/zinc/10/12/53/1341101253.db2.gz FFACXTYZZUJEPU-ROUUACIJSA-N 1 3 335.536 2.686 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]CC1CC2(CCC2)C1 ZINC001373753278 1341134631 /nfs/dbraw/zinc/13/46/31/1341134631.db2.gz MFYWNMVYSISCTD-MSOLQXFVSA-N 1 3 335.536 2.924 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccccc1C ZINC001373754960 1341135209 /nfs/dbraw/zinc/13/52/09/1341135209.db2.gz QTAFTKGYMIZRJT-MOPGFXCFSA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1ccccc1C ZINC001373754962 1341135285 /nfs/dbraw/zinc/13/52/85/1341135285.db2.gz QTAFTKGYMIZRJT-OALUTQOASA-N 1 3 331.504 2.852 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H](CC)N(C)C)[NH2+]Cc1ccc(Cl)s1 ZINC001373823209 1341163222 /nfs/dbraw/zinc/16/32/22/1341163222.db2.gz VQUHLIIOFGOSPO-DGCLKSJQSA-N 1 3 331.913 2.726 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1cccc(C)c1 ZINC001373786750 1341146666 /nfs/dbraw/zinc/14/66/66/1341146666.db2.gz ZGCFZXIEWJALRI-GOSISDBHSA-N 1 3 331.504 2.854 10 0 EFAEHO CC[C@@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)NCc1cc(C)ccc1F ZINC001373792642 1341149536 /nfs/dbraw/zinc/14/95/36/1341149536.db2.gz KHSIHMXATXOVHA-ROUUACIJSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)NCc1cc(C)ccc1F ZINC001373792642 1341149537 /nfs/dbraw/zinc/14/95/37/1341149537.db2.gz KHSIHMXATXOVHA-ROUUACIJSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](CNC(=O)CC[C@@H]1CCC[N@@H+]1C)NCc1cc(C)ccc1F ZINC001373792639 1341149575 /nfs/dbraw/zinc/14/95/75/1341149575.db2.gz KHSIHMXATXOVHA-MSOLQXFVSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](CNC(=O)CC[C@@H]1CCC[N@H+]1C)NCc1cc(C)ccc1F ZINC001373792639 1341149576 /nfs/dbraw/zinc/14/95/76/1341149576.db2.gz KHSIHMXATXOVHA-MSOLQXFVSA-N 1 3 349.494 2.993 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC001373834409 1341167500 /nfs/dbraw/zinc/16/75/00/1341167500.db2.gz IQOGUEXVAATMRY-SJLPKXTDSA-N 1 3 335.467 2.638 10 0 EFAEHO CC[C@@H](C(=O)NC1(C[NH2+]CC2CC3(CCC3)C2)CCCC1)N(C)C ZINC001373859295 1341177656 /nfs/dbraw/zinc/17/76/56/1341177656.db2.gz ZACXDAPQKTXBKK-KRWDZBQOSA-N 1 3 335.536 2.926 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H]([NH2+]CC=C(Cl)Cl)CC1 ZINC001373921699 1341204252 /nfs/dbraw/zinc/20/42/52/1341204252.db2.gz BNARRULDXNMVOW-JOCQHMNTSA-N 1 3 336.307 2.663 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H]2CC[C@H](NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001373921946 1341204639 /nfs/dbraw/zinc/20/46/39/1341204639.db2.gz CTNDZLGJQQOJRL-MXVIHJGJSA-N 1 3 345.531 2.895 10 0 EFAEHO CC[C@@H](F)C[NH+]1CCC(CCNC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001373936808 1341221029 /nfs/dbraw/zinc/22/10/29/1341221029.db2.gz DHTNPNODPBYBIX-SJORKVTESA-N 1 3 329.504 2.539 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCCC1CC[NH+](CC2CCCC2)CC1 ZINC001373949939 1341240796 /nfs/dbraw/zinc/24/07/96/1341240796.db2.gz ORNINYIIGIWQDH-UHFFFAOYSA-N 1 3 332.492 2.669 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001373974409 1341268827 /nfs/dbraw/zinc/26/88/27/1341268827.db2.gz ZHCLYLWUUOZGIY-JKSUJKDBSA-N 1 3 345.478 2.733 10 0 EFAEHO CC(C)c1ccc(C[NH2+]C[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001374079812 1341373704 /nfs/dbraw/zinc/37/37/04/1341373704.db2.gz QESFNWICJBOLAD-QZTJIDSGSA-N 1 3 345.531 2.994 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+]Cc2ccsc2)CCCC1)N(C)C ZINC001374178297 1341517980 /nfs/dbraw/zinc/51/79/80/1341517980.db2.gz VJQMTNULEHFGAR-INIZCTEOSA-N 1 3 337.533 2.853 10 0 EFAEHO C[C@@H](CNCc1ccccc1Cl)N(C)C(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001374227475 1341579556 /nfs/dbraw/zinc/57/95/56/1341579556.db2.gz YUGRLYFZPZSAHM-YOEHRIQHSA-N 1 3 349.906 2.618 10 0 EFAEHO C[C@H](CNCc1ccccc1Cl)N(C)C(=O)[C@@H]1C[NH+]2CCC1CC2 ZINC001374227473 1341579704 /nfs/dbraw/zinc/57/97/04/1341579704.db2.gz YUGRLYFZPZSAHM-RHSMWYFYSA-N 1 3 349.906 2.618 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)N(C)C(=O)[C@@H](C(C)C)[NH+](C)C)c1 ZINC001374285554 1341660693 /nfs/dbraw/zinc/66/06/93/1341660693.db2.gz RTZDGLCDTVICAL-MAUKXSAKSA-N 1 3 337.483 2.657 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc2ncccc2c1)N(C)C ZINC001374313484 1341702429 /nfs/dbraw/zinc/70/24/29/1341702429.db2.gz OTWXHODPXIXTTA-HNAYVOBHSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]C/C=C\c1ccccc1 ZINC001374433975 1341916570 /nfs/dbraw/zinc/91/65/70/1341916570.db2.gz NENABWQKIUCPTE-XHKZUWJLSA-N 1 3 343.515 2.772 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@H]1CC[C@@H]2CCCC[N@H+]12 ZINC001374505708 1341994389 /nfs/dbraw/zinc/99/43/89/1341994389.db2.gz FETINHAZVDDYPQ-FUHWJXTLSA-N 1 3 349.544 2.698 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001374505708 1341994392 /nfs/dbraw/zinc/99/43/92/1341994392.db2.gz FETINHAZVDDYPQ-FUHWJXTLSA-N 1 3 349.544 2.698 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[N@H+](C)CC[C@H]1CCCC1(F)F)N(C)C ZINC001374552568 1342061528 /nfs/dbraw/zinc/06/15/28/1342061528.db2.gz QEUHKXOZERGHSY-CABCVRRESA-N 1 3 333.467 2.542 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H]2CCC[C@@H]2NC(=O)CN(C)C(C)C)cs1 ZINC001374565333 1342078331 /nfs/dbraw/zinc/07/83/31/1342078331.db2.gz BZQLSNYGBYPQRV-SJORKVTESA-N 1 3 337.533 2.771 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H]2CCC[C@@H]2NC(=O)CN(C)C(C)C)cs1 ZINC001374565330 1342078360 /nfs/dbraw/zinc/07/83/60/1342078360.db2.gz BZQLSNYGBYPQRV-IRXDYDNUSA-N 1 3 337.533 2.771 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H]2CCC[C@H]2NC(=O)CN(C)C(C)C)c1 ZINC001374569003 1342081520 /nfs/dbraw/zinc/08/15/20/1342081520.db2.gz KYFOKXGEQZFTTL-RTBURBONSA-N 1 3 331.504 2.710 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]C[C@@H](C)NC(=O)CN(C)C2CCC2)c1 ZINC001374770049 1342161051 /nfs/dbraw/zinc/16/10/51/1342161051.db2.gz GOLYBQICIJPXCT-SJORKVTESA-N 1 3 331.504 2.943 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]C[C@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001374895783 1342228538 /nfs/dbraw/zinc/22/85/38/1342228538.db2.gz VPUSJTYBESEOLQ-DLBZAZTESA-N 1 3 331.504 2.943 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1ccccc1F ZINC001374903017 1342232175 /nfs/dbraw/zinc/23/21/75/1342232175.db2.gz AERYRIDBQQLAJR-MAUKXSAKSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1ccccc1F ZINC001374903017 1342232177 /nfs/dbraw/zinc/23/21/77/1342232177.db2.gz AERYRIDBQQLAJR-MAUKXSAKSA-N 1 3 335.467 2.540 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+]1C(C)C ZINC001375042043 1342340103 /nfs/dbraw/zinc/34/01/03/1342340103.db2.gz ZFFNFANYZBCXPW-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO Cc1cc(F)ccc1CN(C)C[C@@H](C)NC(=O)[C@@H]1CCC[N@H+]1C(C)C ZINC001375042043 1342340105 /nfs/dbraw/zinc/34/01/05/1342340105.db2.gz ZFFNFANYZBCXPW-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO C[C@@H](CN(C)Cc1cccc(C(F)(F)F)c1)NC(=O)CC[NH+](C)C ZINC001375092324 1342400779 /nfs/dbraw/zinc/40/07/79/1342400779.db2.gz BXNHIPHHZMUHSI-ZDUSSCGKSA-N 1 3 345.409 2.594 10 0 EFAEHO C[C@@H](C[N@H+](C)CC/C=C\c1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001375105992 1342415645 /nfs/dbraw/zinc/41/56/45/1342415645.db2.gz VKWPVEUOBGHHQV-FEEJDJEGSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC/C=C\c1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001375105992 1342415649 /nfs/dbraw/zinc/41/56/49/1342415649.db2.gz VKWPVEUOBGHHQV-FEEJDJEGSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)c1ccccc1CN(C)C[C@H](C)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001375156403 1342473110 /nfs/dbraw/zinc/47/31/10/1342473110.db2.gz WWBZNDICEGYEKT-WMZOPIPTSA-N 1 3 331.504 2.698 10 0 EFAEHO CC(C)c1ccccc1CN(C)C[C@H](C)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001375156403 1342473115 /nfs/dbraw/zinc/47/31/15/1342473115.db2.gz WWBZNDICEGYEKT-WMZOPIPTSA-N 1 3 331.504 2.698 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CCCC[C@@H]2C[NH2+]Cc2ccsc2)CCC1 ZINC001375179121 1342494225 /nfs/dbraw/zinc/49/42/25/1342494225.db2.gz YMFXOLUMSMHIQE-IAGOWNOFSA-N 1 3 349.544 2.997 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)N[C@H](CNCc1ccccc1F)C1CC1 ZINC001375221763 1342524173 /nfs/dbraw/zinc/52/41/73/1342524173.db2.gz CUPFKYXDHHOHDN-MOPGFXCFSA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)N[C@H](CNCc1ccccc1F)C1CC1 ZINC001375221763 1342524175 /nfs/dbraw/zinc/52/41/75/1342524175.db2.gz CUPFKYXDHHOHDN-MOPGFXCFSA-N 1 3 347.478 2.683 10 0 EFAEHO CC(C)CCCN1CC[C@H]1CNC(=O)c1ccc(C[NH+](C)C)cc1 ZINC001375354911 1342661025 /nfs/dbraw/zinc/66/10/25/1342661025.db2.gz VGDAWMYNGPFVSM-IBGZPJMESA-N 1 3 331.504 2.989 10 0 EFAEHO CC[C@@H](C(=O)NCC1([NH2+]CC[C@H]2CCCC2(F)F)CCC1)N(C)C ZINC001393554762 1356945107 /nfs/dbraw/zinc/94/51/07/1356945107.db2.gz HNIAUAFQFVUXCI-CABCVRRESA-N 1 3 345.478 2.781 10 0 EFAEHO CCC1([NH2+]CC[C@H](C)F)CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001393664132 1357060468 /nfs/dbraw/zinc/06/04/68/1357060468.db2.gz JRKINGADIFQSEF-HNNXBMFYSA-N 1 3 327.488 2.580 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC001375425821 1342728977 /nfs/dbraw/zinc/72/89/77/1342728977.db2.gz SSTKFJHQMAUVKE-CABCVRRESA-N 1 3 343.462 2.535 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)C(C)(C)N3CCCC3)CC2)cc1 ZINC001375455536 1342758089 /nfs/dbraw/zinc/75/80/89/1342758089.db2.gz SNVRADASQNICKY-UHFFFAOYSA-N 1 3 329.488 2.608 10 0 EFAEHO CC[C@H]([NH2+]C1(CNC(=O)[C@@H](C(C)C)N(C)C)CC1)c1ccccc1 ZINC001375473306 1342781825 /nfs/dbraw/zinc/78/18/25/1342781825.db2.gz CEAXFZUSLHAODF-ZWKOTPCHSA-N 1 3 331.504 2.962 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1C[C@@H]([NH2+][C@H]2CCc3ccccc32)C1)N(C)C ZINC001375520661 1342829911 /nfs/dbraw/zinc/82/99/11/1342829911.db2.gz ZQNXGRVYKOLTOS-RKOGWWSCSA-N 1 3 343.515 2.745 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc32)C1)N(C)C ZINC001375520659 1342830070 /nfs/dbraw/zinc/83/00/70/1342830070.db2.gz ZQNXGRVYKOLTOS-MCYKXBRJSA-N 1 3 343.515 2.745 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H]2CC[N@H+](CC[C@H](C)F)C2)CC1 ZINC001375573861 1342892202 /nfs/dbraw/zinc/89/22/02/1342892202.db2.gz NVYASDOKFHKNPN-FUHWJXTLSA-N 1 3 341.515 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@@H]2CC[N@@H+](CC[C@H](C)F)C2)CC1 ZINC001375573861 1342892206 /nfs/dbraw/zinc/89/22/06/1342892206.db2.gz NVYASDOKFHKNPN-FUHWJXTLSA-N 1 3 341.515 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H]2CC[N@H+](CC[C@@H](C)F)C2)CC1 ZINC001375573858 1342892422 /nfs/dbraw/zinc/89/24/22/1342892422.db2.gz NVYASDOKFHKNPN-AEFFLSMTSA-N 1 3 341.515 2.637 10 0 EFAEHO CCCN(C)CC(=O)N1CCC([C@H]2CC[N@@H+](CC[C@@H](C)F)C2)CC1 ZINC001375573858 1342892427 /nfs/dbraw/zinc/89/24/27/1342892427.db2.gz NVYASDOKFHKNPN-AEFFLSMTSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(CF)cc2)C1)N(C)C ZINC001375575529 1342894529 /nfs/dbraw/zinc/89/45/29/1342894529.db2.gz FQCBRTPERDIYAO-OTWHNJEPSA-N 1 3 349.494 2.871 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CCN(C/C=C/Cl)CC(C)(C)C1)[NH+](C)C ZINC001375690780 1342932257 /nfs/dbraw/zinc/93/22/57/1342932257.db2.gz VACRVDILJNFOSJ-KBUFDJFCSA-N 1 3 343.943 2.932 10 0 EFAEHO CC(C)N(C)CC(=O)NC1(C)CC[NH+](CCCc2ccccc2)CC1 ZINC001375780232 1343001991 /nfs/dbraw/zinc/00/19/91/1343001991.db2.gz AQAVXPHMGQMKHE-UHFFFAOYSA-N 1 3 345.531 2.930 10 0 EFAEHO COc1cccc([C@@H](C)N2CC[C@](C)(NC(=O)CCC[NH+](C)C)C2)c1 ZINC001375834744 1343070635 /nfs/dbraw/zinc/07/06/35/1343070635.db2.gz GVJAYRMFNBLYJV-UZLBHIALSA-N 1 3 347.503 2.679 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@]1(C)CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001375852937 1343097171 /nfs/dbraw/zinc/09/71/71/1343097171.db2.gz YARVTPVXQOFIAR-NRFANRHFSA-N 1 3 343.515 2.986 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@]1(C)CCN(Cc2ccc(C3CC3)cc2)C1 ZINC001375852937 1343097177 /nfs/dbraw/zinc/09/71/77/1343097177.db2.gz YARVTPVXQOFIAR-NRFANRHFSA-N 1 3 343.515 2.986 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CC[C@@](C)(C[NH2+]CC2CCC2)C1 ZINC001375888427 1343134962 /nfs/dbraw/zinc/13/49/62/1343134962.db2.gz JTHHSFYXHGDDDM-ICSRJNTNSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2C)c(C)c1 ZINC001393738131 1357115826 /nfs/dbraw/zinc/11/58/26/1357115826.db2.gz FWKDXQDERYPBHQ-MJGOQNOKSA-N 1 3 331.504 2.580 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1CCCN(CCc2ccccc2)C1)[NH+](CC)CC ZINC001376066481 1343299598 /nfs/dbraw/zinc/29/95/98/1343299598.db2.gz BXHGOBFSEYRDHD-PMACEKPBSA-N 1 3 345.531 2.930 10 0 EFAEHO CCCN(C)CC(=O)N1CCC(C)([NH2+]Cc2ccc(C)c(F)c2)CC1 ZINC001393746046 1357120993 /nfs/dbraw/zinc/12/09/93/1357120993.db2.gz FDJAEDDNCWSSBU-UHFFFAOYSA-N 1 3 349.494 2.947 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC23CC[NH+](CCC(C)(C)C)CC3)CCC1 ZINC001376168409 1343370478 /nfs/dbraw/zinc/37/04/78/1343370478.db2.gz AHXZGHGAYMYBTB-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CC12CC[NH+](CCC(C)(C)C)CC2)N(C)C ZINC001376175754 1343376718 /nfs/dbraw/zinc/37/67/18/1343376718.db2.gz SOUVVVDLWHYOSC-IAGOWNOFSA-N 1 3 337.552 2.980 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]([NH2+][C@@H]1CCc2ccccc21)C1CC1 ZINC001376252309 1343429094 /nfs/dbraw/zinc/42/90/94/1343429094.db2.gz CJDIAYBDSHQVAP-MOPGFXCFSA-N 1 3 329.488 2.500 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](CNC(=O)CN(C)C(C)C)C2CC2)cc1C ZINC001376277708 1343446677 /nfs/dbraw/zinc/44/66/77/1343446677.db2.gz KZHRYOLMNJNHAC-LJQANCHMSA-N 1 3 331.504 2.628 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H](C[N@H+](C)CCCC(C)C)C1)N(C)C ZINC001376298661 1343466377 /nfs/dbraw/zinc/46/63/77/1343466377.db2.gz YQFCSEXDBZJJSZ-MSOLQXFVSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H](C[N@@H+](C)CCCC(C)C)C1)N(C)C ZINC001376298661 1343466380 /nfs/dbraw/zinc/46/63/80/1343466380.db2.gz YQFCSEXDBZJJSZ-MSOLQXFVSA-N 1 3 325.541 2.933 10 0 EFAEHO CN(CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](CC1CCC1)C2)CC(C)(C)C ZINC001376314121 1343476841 /nfs/dbraw/zinc/47/68/41/1343476841.db2.gz NGSXYFSESMDEAW-KSZLIROESA-N 1 3 335.536 2.734 10 0 EFAEHO CN(CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](CC1CCC1)C2)CC(C)(C)C ZINC001376314121 1343476842 /nfs/dbraw/zinc/47/68/42/1343476842.db2.gz NGSXYFSESMDEAW-KSZLIROESA-N 1 3 335.536 2.734 10 0 EFAEHO CN(CC(=O)N1CC[C@H]([NH2+]C[C@@H]2CCC(F)(F)C2)C1)CC(C)(C)C ZINC001376333038 1343489342 /nfs/dbraw/zinc/48/93/42/1343489342.db2.gz SCCCZYTXNMBQMG-CABCVRRESA-N 1 3 345.478 2.590 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2CCN(C(=O)C[N@@H+](C)CC(C)(C)C)C2)c1 ZINC001376334030 1343490187 /nfs/dbraw/zinc/49/01/87/1343490187.db2.gz UBOVMEQDAWYLES-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(F)c(CN[C@H]2CCN(C(=O)C[N@H+](C)CC(C)(C)C)C2)c1 ZINC001376334030 1343490188 /nfs/dbraw/zinc/49/01/88/1343490188.db2.gz UBOVMEQDAWYLES-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO CCCc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)cc1 ZINC001376461904 1343609689 /nfs/dbraw/zinc/60/96/89/1343609689.db2.gz IRVJUKAWPRJWOD-KDURUIRLSA-N 1 3 343.515 2.860 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)C3CCC3)C2)c1 ZINC001376463165 1343610653 /nfs/dbraw/zinc/61/06/53/1343610653.db2.gz KOASKJAXSAMVLE-HDICACEKSA-N 1 3 329.488 2.525 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@H+](Cc2ccsc2)CC1(C)C ZINC001393765677 1357138042 /nfs/dbraw/zinc/13/80/42/1357138042.db2.gz FMXNEMOHSKZYCQ-INIZCTEOSA-N 1 3 337.533 2.807 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1CC[N@@H+](Cc2ccsc2)CC1(C)C ZINC001393765677 1357138045 /nfs/dbraw/zinc/13/80/45/1357138045.db2.gz FMXNEMOHSKZYCQ-INIZCTEOSA-N 1 3 337.533 2.807 10 0 EFAEHO Cc1cc(C)c(C[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)c(C)c1 ZINC001376468479 1343614066 /nfs/dbraw/zinc/61/40/66/1343614066.db2.gz YUERLWNDJLVTKT-HDICACEKSA-N 1 3 343.515 2.833 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001376469085 1343614115 /nfs/dbraw/zinc/61/41/15/1343614115.db2.gz HGNQYGDOPGELQK-WCVJEAGWSA-N 1 3 345.478 2.635 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2Cl)C1)N(C)C ZINC001376485443 1343621164 /nfs/dbraw/zinc/62/11/64/1343621164.db2.gz BEKIKTDWHFDJQY-LZWOXQAQSA-N 1 3 341.858 2.556 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C(C)C)cc2)C1)N(C)C ZINC001376487631 1343623420 /nfs/dbraw/zinc/62/34/20/1343623420.db2.gz IOJIJSJJGDUPII-CEXWTWQISA-N 1 3 331.504 2.887 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2cc(C)ccc2C)C1 ZINC001376493240 1343625375 /nfs/dbraw/zinc/62/53/75/1343625375.db2.gz IKJOKRPVJKSJAS-OKZBNKHCSA-N 1 3 331.504 2.943 10 0 EFAEHO C[C@H](N[C@H]1C[C@@H](NC(=O)CC[NH+]2CCCCC2)C1)c1ccccc1F ZINC001376507101 1343633468 /nfs/dbraw/zinc/63/34/68/1343633468.db2.gz YJRMUTFMAHFIAO-YESZJQIVSA-N 1 3 347.478 3.000 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(F)cc1 ZINC001376521378 1343646454 /nfs/dbraw/zinc/64/64/54/1343646454.db2.gz WRSKPELIWXUCMC-RBUKOAKNSA-N 1 3 347.478 2.733 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(F)cc1 ZINC001376521338 1343646600 /nfs/dbraw/zinc/64/66/00/1343646600.db2.gz WRSKPELIWXUCMC-MOPGFXCFSA-N 1 3 347.478 2.733 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@H]1CCCCN1Cc1ccc2c(c1)CCC2 ZINC001376572763 1343690540 /nfs/dbraw/zinc/69/05/40/1343690540.db2.gz FCLAZCSSWVGIDX-FQEVSTJZSA-N 1 3 343.515 2.598 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCc1ccccc1C[N@H+](C)CC1CCC1 ZINC001376585374 1343705510 /nfs/dbraw/zinc/70/55/10/1343705510.db2.gz WJUFDENKPDQVPS-UHFFFAOYSA-N 1 3 340.471 2.809 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCc1ccccc1C[N@@H+](C)CC1CCC1 ZINC001376585374 1343705512 /nfs/dbraw/zinc/70/55/12/1343705512.db2.gz WJUFDENKPDQVPS-UHFFFAOYSA-N 1 3 340.471 2.809 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001376615214 1343722759 /nfs/dbraw/zinc/72/27/59/1343722759.db2.gz WBJGZEBPRSYVMJ-IRXDYDNUSA-N 1 3 325.541 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001376627515 1343733496 /nfs/dbraw/zinc/73/34/96/1343733496.db2.gz QNYXKJCXZVXGEE-SJLPKXTDSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001376627515 1343733498 /nfs/dbraw/zinc/73/34/98/1343733498.db2.gz QNYXKJCXZVXGEE-SJLPKXTDSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)NC1CCC([NH2+]CC2CC3(CCC3)C2)CC1)N(C)C ZINC001376663899 1343750890 /nfs/dbraw/zinc/75/08/90/1343750890.db2.gz OLRUGJRSUMODEL-DAWZGUTISA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)[N@@H+]1CCc2c(CNC(=O)CN3[C@H](C)CC[C@H]3C)cccc2C1 ZINC001376673466 1343756935 /nfs/dbraw/zinc/75/69/35/1343756935.db2.gz NCWXXQGGWLGNPP-IAGOWNOFSA-N 1 3 343.515 2.942 10 0 EFAEHO CC(C)[N@H+]1CCc2c(CNC(=O)CN3[C@H](C)CC[C@H]3C)cccc2C1 ZINC001376673466 1343756936 /nfs/dbraw/zinc/75/69/36/1343756936.db2.gz NCWXXQGGWLGNPP-IAGOWNOFSA-N 1 3 343.515 2.942 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001376781046 1343833703 /nfs/dbraw/zinc/83/37/03/1343833703.db2.gz DSRVRNPWVOBBJM-HNNXBMFYSA-N 1 3 342.487 2.637 10 0 EFAEHO CCC(CC)C[NH2+][C@@H](C)CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001376797065 1343846577 /nfs/dbraw/zinc/84/65/77/1343846577.db2.gz DLHRPGCERRFGKD-KSSFIOAISA-N 1 3 329.504 2.729 10 0 EFAEHO COc1cccc(C[N@@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001393791612 1357162357 /nfs/dbraw/zinc/16/23/57/1357162357.db2.gz RILQJGIJWFLOGH-WMZOPIPTSA-N 1 3 347.503 2.505 10 0 EFAEHO COc1cccc(C[N@H+]2CC[C@H](NC(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001393791612 1357162359 /nfs/dbraw/zinc/16/23/59/1357162359.db2.gz RILQJGIJWFLOGH-WMZOPIPTSA-N 1 3 347.503 2.505 10 0 EFAEHO CCCC[N@H+](C)CCCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001376976508 1344007451 /nfs/dbraw/zinc/00/74/51/1344007451.db2.gz APPXWDSVZPXLKI-SFHVURJKSA-N 1 3 329.504 2.779 10 0 EFAEHO CCCC[N@@H+](C)CCCN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001376976508 1344007452 /nfs/dbraw/zinc/00/74/52/1344007452.db2.gz APPXWDSVZPXLKI-SFHVURJKSA-N 1 3 329.504 2.779 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H]([N@H+](C)CCCC3CCC3)C2)C1 ZINC001376983618 1344017032 /nfs/dbraw/zinc/01/70/32/1344017032.db2.gz VJQCSTHJOPCVMM-PKOBYXMFSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@@H]([N@@H+](C)CCCC3CCC3)C2)C1 ZINC001376983618 1344017036 /nfs/dbraw/zinc/01/70/36/1344017036.db2.gz VJQCSTHJOPCVMM-PKOBYXMFSA-N 1 3 335.536 2.831 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)[C@H]1CCCC[N@@H+]1C(C)C ZINC001376990894 1344025996 /nfs/dbraw/zinc/02/59/96/1344025996.db2.gz HXWXMQCROSKYOL-DLBZAZTESA-N 1 3 329.504 2.778 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)[C@H]1CCCC[N@H+]1C(C)C ZINC001376990894 1344026000 /nfs/dbraw/zinc/02/60/00/1344026000.db2.gz HXWXMQCROSKYOL-DLBZAZTESA-N 1 3 329.504 2.778 10 0 EFAEHO CC(C)[C@H](C(=O)NCC[C@@H](C)[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001377094058 1344130293 /nfs/dbraw/zinc/13/02/93/1344130293.db2.gz OJEONLBMMLKJBJ-DNVCBOLYSA-N 1 3 344.503 2.739 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)C[NH+]1[C@@H](C)CC[C@@H]1C ZINC001377273448 1344146051 /nfs/dbraw/zinc/14/60/51/1344146051.db2.gz MQDCBNSOFWAPHC-ROUUACIJSA-N 1 3 331.504 2.724 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C[N@H+](CC)CC[C@@H](C)F)CC1)N(C)C ZINC001377592853 1344199944 /nfs/dbraw/zinc/19/99/44/1344199944.db2.gz WCWIYYQYPPVKKD-NVXWUHKLSA-N 1 3 329.504 2.635 10 0 EFAEHO CC[C@H](C(=O)N1CCC(C[N@@H+](CC)CC[C@@H](C)F)CC1)N(C)C ZINC001377592853 1344199946 /nfs/dbraw/zinc/19/99/46/1344199946.db2.gz WCWIYYQYPPVKKD-NVXWUHKLSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]([NH2+]CC2CCC2)c2ccccc2)C1 ZINC001377609971 1344217382 /nfs/dbraw/zinc/21/73/82/1344217382.db2.gz GOXPKMOUPYYYRS-LPHOPBHVSA-N 1 3 329.488 2.575 10 0 EFAEHO C[C@H](c1cccc(F)c1)N(C)C[C@@H]1CCCN1C(=O)CC[NH+](C)C ZINC001377659660 1344279628 /nfs/dbraw/zinc/27/96/28/1344279628.db2.gz GMAGGJOGAWVNDS-QAPCUYQASA-N 1 3 335.467 2.761 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H]2C[N@H+](C)CCCC2CCC2)C1 ZINC001377659938 1344281072 /nfs/dbraw/zinc/28/10/72/1344281072.db2.gz HFWKSTONFXAXEJ-IEBWSBKVSA-N 1 3 335.536 2.831 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H]2C[N@@H+](C)CCCC2CCC2)C1 ZINC001377659938 1344281075 /nfs/dbraw/zinc/28/10/75/1344281075.db2.gz HFWKSTONFXAXEJ-IEBWSBKVSA-N 1 3 335.536 2.831 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@H]2CC[N@H+](CC3CC4(CCC4)C3)C2)CCC1 ZINC001377690300 1344326292 /nfs/dbraw/zinc/32/62/92/1344326292.db2.gz CNVAVOUAAOIEHP-KRWDZBQOSA-N 1 3 347.547 2.879 10 0 EFAEHO CN(C)C1(C(=O)NCC[C@H]2CC[N@@H+](CC3CC4(CCC4)C3)C2)CCC1 ZINC001377690300 1344326295 /nfs/dbraw/zinc/32/62/95/1344326295.db2.gz CNVAVOUAAOIEHP-KRWDZBQOSA-N 1 3 347.547 2.879 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@H]1CC[N@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001377709865 1344355119 /nfs/dbraw/zinc/35/51/19/1344355119.db2.gz AHXDVIUYLDQGPW-WMZOPIPTSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@@H](C(=O)NCC[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)C1)N(C)C ZINC001377709865 1344355124 /nfs/dbraw/zinc/35/51/24/1344355124.db2.gz AHXDVIUYLDQGPW-WMZOPIPTSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2cc(C)ccc2F)C1)N(C)C ZINC001377714724 1344360780 /nfs/dbraw/zinc/36/07/80/1344360780.db2.gz CUPFRQLDKSMRSG-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2cc(C)ccc2F)C1)N(C)C ZINC001377714724 1344360783 /nfs/dbraw/zinc/36/07/83/1344360783.db2.gz CUPFRQLDKSMRSG-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]Cc2ccc(Cl)s2)C1)N(C)C ZINC001377729180 1344378586 /nfs/dbraw/zinc/37/85/86/1344378586.db2.gz UMDPVCPNKMVYNB-YIZWMMSDSA-N 1 3 343.924 2.726 10 0 EFAEHO CC(C)[C@H](C(=O)NC1CC(C[NH2+]Cc2ccc(CF)cc2)C1)N(C)C ZINC001377735846 1344384606 /nfs/dbraw/zinc/38/46/06/1344384606.db2.gz LNHBFOVZKDBJIN-CTWPCTMYSA-N 1 3 349.494 2.727 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCCC1)[C@H](C)[NH2+]Cc1ccccc1 ZINC001377804360 1344455169 /nfs/dbraw/zinc/45/51/69/1344455169.db2.gz VHEQYYAGAKMJCM-IRXDYDNUSA-N 1 3 331.504 2.934 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]Cc1ccc(Cl)cc1 ZINC001377804380 1344455374 /nfs/dbraw/zinc/45/53/74/1344455374.db2.gz HISXPXNPXCVYRJ-UONOGXRCSA-N 1 3 337.895 2.807 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCCC1)[C@H](C)[NH2+]Cc1ccccc1 ZINC001377804349 1344455382 /nfs/dbraw/zinc/45/53/82/1344455382.db2.gz VHEQYYAGAKMJCM-DLBZAZTESA-N 1 3 331.504 2.934 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)[N@H+](C)C1CCCC1)[C@H](C)NCc1ccccn1 ZINC001377822247 1344476480 /nfs/dbraw/zinc/47/64/80/1344476480.db2.gz ZJQPKGCRCKHINX-JKSUJKDBSA-N 1 3 346.519 2.717 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)[N@@H+](C)C1CCCC1)[C@H](C)NCc1ccccn1 ZINC001377822247 1344476486 /nfs/dbraw/zinc/47/64/86/1344476486.db2.gz ZJQPKGCRCKHINX-JKSUJKDBSA-N 1 3 346.519 2.717 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@@H](C)[C@@H](C)NCc1cc(Cl)ccc1F ZINC001377869505 1344531571 /nfs/dbraw/zinc/53/15/71/1344531571.db2.gz IVROOYKEDCIXIP-OLZOCXBDSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@@H](C)[C@@H](C)NCc1cc(Cl)ccc1F ZINC001377869505 1344531573 /nfs/dbraw/zinc/53/15/73/1344531573.db2.gz IVROOYKEDCIXIP-OLZOCXBDSA-N 1 3 343.874 2.804 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1cc2ccccc2o1 ZINC001377885570 1344547529 /nfs/dbraw/zinc/54/75/29/1344547529.db2.gz SRLNGGIJWDJFHB-GJZGRUSLSA-N 1 3 331.460 2.757 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)c(F)c1 ZINC001377915721 1344579539 /nfs/dbraw/zinc/57/95/39/1344579539.db2.gz RPSZGEOURYQMSN-STQMWFEESA-N 1 3 343.874 2.802 10 0 EFAEHO CC(C)CC[NH2+]C1CCC(N(C)C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001377930392 1344591424 /nfs/dbraw/zinc/59/14/24/1344591424.db2.gz AKUIWIGHQSMCBE-ABHNRTSZSA-N 1 3 325.541 2.978 10 0 EFAEHO CC[C@H](F)C[NH2+]CC(C)(C)CN(C)C(=O)[C@@H]1CCCCN1CC ZINC001377980476 1344633915 /nfs/dbraw/zinc/63/39/15/1344633915.db2.gz WHNZSZUPSDEDOX-HOTGVXAUSA-N 1 3 329.504 2.683 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[N@H+](C)CC1CC2(CCC2)C1 ZINC001378046728 1344697345 /nfs/dbraw/zinc/69/73/45/1344697345.db2.gz JVTIYUFGHREKTI-WMZOPIPTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@H](C)[N@@H+](C)CC1CC2(CCC2)C1 ZINC001378046728 1344697352 /nfs/dbraw/zinc/69/73/52/1344697352.db2.gz JVTIYUFGHREKTI-WMZOPIPTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC[C@@H](F)C[NH+]1CCC2(CCN(C(=O)CN(C)C(C)C)CC2)CC1 ZINC001393836505 1357199844 /nfs/dbraw/zinc/19/98/44/1357199844.db2.gz ONPNYVPTIYGFCK-QGZVFWFLSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](C(=O)N[C@@H]1CCN(CCc2ccc(C)cc2)C1)[NH+](CC)CC ZINC001378123764 1344786044 /nfs/dbraw/zinc/78/60/44/1344786044.db2.gz ZFBZISVOCSTZKE-WOJBJXKFSA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[N@H+](C)Cc1ccccc1C1CC1 ZINC001378150013 1344814116 /nfs/dbraw/zinc/81/41/16/1344814116.db2.gz WORXLARMXFTLFU-IAGOWNOFSA-N 1 3 343.515 2.842 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)[N@@H+](C)Cc1ccccc1C1CC1 ZINC001378150013 1344814118 /nfs/dbraw/zinc/81/41/18/1344814118.db2.gz WORXLARMXFTLFU-IAGOWNOFSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H](C)N(C)Cc1cccc(F)c1)[NH+]1CCCC1 ZINC001378227170 1344910796 /nfs/dbraw/zinc/91/07/96/1344910796.db2.gz FWRXWVYDZKMKMT-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](CC)[NH2+]Cc1cc2ccccc2o1)N(C)C ZINC001378261921 1344940678 /nfs/dbraw/zinc/94/06/78/1344940678.db2.gz KFQFUBQVZFLZEJ-DOTOQJQBSA-N 1 3 331.460 2.757 10 0 EFAEHO CC[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+]Cc1ccc(OC)cc1 ZINC001378288952 1344957287 /nfs/dbraw/zinc/95/72/87/1344957287.db2.gz OOMJBUMWOCTRPF-QGZVFWFLSA-N 1 3 347.503 2.554 10 0 EFAEHO CC[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]Cc1ccccc1 ZINC001378295302 1344963766 /nfs/dbraw/zinc/96/37/66/1344963766.db2.gz NFAIMCCCOJDBGE-PKOBYXMFSA-N 1 3 331.504 2.936 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]CCc1ccccc1 ZINC001378301873 1344968813 /nfs/dbraw/zinc/96/88/13/1344968813.db2.gz XSGYXQZFKISNDA-ICSRJNTNSA-N 1 3 345.531 2.978 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@@H]1CC[N@H+](C)C1)NCc1sccc1Cl ZINC001378316731 1344981084 /nfs/dbraw/zinc/98/10/84/1344981084.db2.gz KVZPUNYAZTWQIO-STQMWFEESA-N 1 3 343.924 2.728 10 0 EFAEHO CC[C@@H](CNC(=O)C[C@@H]1CC[N@@H+](C)C1)NCc1sccc1Cl ZINC001378316731 1344981086 /nfs/dbraw/zinc/98/10/86/1344981086.db2.gz KVZPUNYAZTWQIO-STQMWFEESA-N 1 3 343.924 2.728 10 0 EFAEHO C[C@H]1CCCC[C@]1(CNCc1ccccc1F)NC(=O)CC[NH+](C)C ZINC001378441397 1345078770 /nfs/dbraw/zinc/07/87/70/1345078770.db2.gz YSNMNVGJUZQXDS-OXJNMPFZSA-N 1 3 349.494 2.932 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCCC2CC[NH+](CC3CC(C)(C)C3)CC2)C1 ZINC001378484388 1345116669 /nfs/dbraw/zinc/11/66/69/1345116669.db2.gz OPBSVXGDTNLVPO-KRWDZBQOSA-N 1 3 349.563 2.983 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]1C[NH2+][C@@H](C)c1cccc(F)c1 ZINC001378524096 1345139758 /nfs/dbraw/zinc/13/97/58/1345139758.db2.gz RFBRVTZKFCNBKY-MAUKXSAKSA-N 1 3 335.467 2.808 10 0 EFAEHO Cc1cccc(CN2CC([C@@H](C)NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001378529356 1345143362 /nfs/dbraw/zinc/14/33/62/1345143362.db2.gz LJXTXPIPYKYPPS-YLJYHZDGSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1cccc(CN2CC([C@@H](C)NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001378529356 1345143365 /nfs/dbraw/zinc/14/33/65/1345143365.db2.gz LJXTXPIPYKYPPS-YLJYHZDGSA-N 1 3 343.515 2.806 10 0 EFAEHO CCc1ccc(CC[NH+]2CC([C@H](C)NC(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001378529343 1345143467 /nfs/dbraw/zinc/14/34/67/1345143467.db2.gz LDOBAWXDDNEXNH-OXJNMPFZSA-N 1 3 345.531 2.568 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H](C)C[NH2+]CC1CC2(CCC2)C1 ZINC001378556979 1345161269 /nfs/dbraw/zinc/16/12/69/1345161269.db2.gz FKRROHBBQMXYCK-WMZOPIPTSA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1ccccc1[C@H](C)[NH+]1CC([C@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001378582329 1345178308 /nfs/dbraw/zinc/17/83/08/1345178308.db2.gz DPPQQEUDCORTBJ-IRXDYDNUSA-N 1 3 331.504 2.833 10 0 EFAEHO C[C@@H](CNC(=O)C(C)(C)N1CCCC1)C[NH2+]Cc1cccc(F)c1 ZINC001378590513 1345183917 /nfs/dbraw/zinc/18/39/17/1345183917.db2.gz QVCYBWJKAXXDDL-OAHLLOKOSA-N 1 3 335.467 2.542 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@@H](C)C1)C[NH2+]CC1CCC2(CC2)CC1 ZINC001378601669 1345190986 /nfs/dbraw/zinc/19/09/86/1345190986.db2.gz BYEHZFGWETWHHU-SJORKVTESA-N 1 3 335.536 2.641 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+]Cc1c(F)cccc1Cl ZINC001378645046 1345220943 /nfs/dbraw/zinc/22/09/43/1345220943.db2.gz UWIFYYSDFAEXQB-ZDUSSCGKSA-N 1 3 343.874 2.661 10 0 EFAEHO Cc1cccc(CN2C[C@@H](NC(=O)[C@@H](C(C)C)[NH+](C)C)C(C)(C)C2)c1 ZINC001378646096 1345221270 /nfs/dbraw/zinc/22/12/70/1345221270.db2.gz ATCWJRWEHCBOJW-RTBURBONSA-N 1 3 345.531 2.908 10 0 EFAEHO Cc1ccc(CN2C[C@H](NC(=O)[C@@H](C(C)C)[NH+](C)C)C(C)(C)C2)cc1 ZINC001378648923 1345225095 /nfs/dbraw/zinc/22/50/95/1345225095.db2.gz DTQAFHWYXVJJSZ-RBUKOAKNSA-N 1 3 345.531 2.908 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(CNC(=O)CN(C)CC(C)(C)C)CCCC1 ZINC001378710437 1345265131 /nfs/dbraw/zinc/26/51/31/1345265131.db2.gz OHTMYLBIGXKHSG-OAHLLOKOSA-N 1 3 329.504 2.731 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCC(C)(C)CC3)C[C@H]21 ZINC001378748839 1345290858 /nfs/dbraw/zinc/29/08/58/1345290858.db2.gz LTFFBPCWKDFJNB-LDLYASANSA-N 1 3 349.563 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCC(C)(C)CC3)C[C@H]21 ZINC001378748839 1345290860 /nfs/dbraw/zinc/29/08/60/1345290860.db2.gz LTFFBPCWKDFJNB-LDLYASANSA-N 1 3 349.563 2.837 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CCC4(CC4)CC3)C[C@H]21 ZINC001378757607 1345295771 /nfs/dbraw/zinc/29/57/71/1345295771.db2.gz UENITQDDDBPDFB-LDLYASANSA-N 1 3 347.547 2.591 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CCC4(CC4)CC3)C[C@H]21 ZINC001378757607 1345295776 /nfs/dbraw/zinc/29/57/76/1345295776.db2.gz UENITQDDDBPDFB-LDLYASANSA-N 1 3 347.547 2.591 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C)C[NH2+]Cc1cccc(C(F)F)c1)N(C)C ZINC001378783531 1345313831 /nfs/dbraw/zinc/31/38/31/1345313831.db2.gz XOGXEJDHDIXAIL-CZUORRHYSA-N 1 3 341.446 2.901 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)N(C)C(=O)C[C@@H]1CC[N@H+](C)C1 ZINC001378840000 1345353274 /nfs/dbraw/zinc/35/32/74/1345353274.db2.gz GSXBEFDJDSPYDC-OLZOCXBDSA-N 1 3 343.924 2.680 10 0 EFAEHO C[C@H](CNCc1sccc1Cl)N(C)C(=O)C[C@@H]1CC[N@@H+](C)C1 ZINC001378840000 1345353279 /nfs/dbraw/zinc/35/32/79/1345353279.db2.gz GSXBEFDJDSPYDC-OLZOCXBDSA-N 1 3 343.924 2.680 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2cccc(F)c2)C1)N(C)C ZINC001378846162 1345358507 /nfs/dbraw/zinc/35/85/07/1345358507.db2.gz QOPMZOYXHKFYDU-RGCFKVTRSA-N 1 3 349.494 2.957 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001378847383 1345360187 /nfs/dbraw/zinc/36/01/87/1345360187.db2.gz VETQYMKXERWGOW-DZGCQCFKSA-N 1 3 333.467 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(Cl)s1 ZINC001378853436 1345365351 /nfs/dbraw/zinc/36/53/51/1345365351.db2.gz BMLRCYGHMGJPKA-LBPRGKRZSA-N 1 3 331.913 2.678 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001378864754 1345374957 /nfs/dbraw/zinc/37/49/57/1345374957.db2.gz DCKNRVPLUNBMMM-IEZWGBDMSA-N 1 3 349.494 2.705 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001378869449 1345378513 /nfs/dbraw/zinc/37/85/13/1345378513.db2.gz SCFITUVQSYDYSK-IHPCNDPISA-N 1 3 345.531 2.874 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C[NH2+]CC1CC1)C1CCCCC1 ZINC001378884830 1345394616 /nfs/dbraw/zinc/39/46/16/1345394616.db2.gz LMPXCLGMCBSEMD-MOPGFXCFSA-N 1 3 335.536 2.924 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](CC(C)C)NC(=O)CN2CC[C@H](C)C2)cc1 ZINC001378886464 1345395946 /nfs/dbraw/zinc/39/59/46/1345395946.db2.gz XMRCWFQNKXGHEX-AZUAARDMSA-N 1 3 345.531 2.957 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H](CC(C)C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001378886526 1345396095 /nfs/dbraw/zinc/39/60/95/1345396095.db2.gz XMRCWFQNKXGHEX-UYAOXDASSA-N 1 3 345.531 2.957 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([NH2+]CCc2ccccc2F)[C@@H](C)C1 ZINC001378894043 1345403779 /nfs/dbraw/zinc/40/37/79/1345403779.db2.gz FDENHBRUVFLWNT-QFBILLFUSA-N 1 3 349.494 2.535 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@H](C[NH2+]Cc1ccc(C)c(C)c1)C1CC1)N(C)C ZINC001379025768 1345507104 /nfs/dbraw/zinc/50/71/04/1345507104.db2.gz WEYHEJUWIOUPNX-WOJBJXKFSA-N 1 3 345.531 2.970 10 0 EFAEHO CN(CC(=O)N(C)CC[N@H+](C)C[C@@H]1CC[C@@H]2C[C@@H]2C1)CC(C)(C)C ZINC001379100815 1345577884 /nfs/dbraw/zinc/57/78/84/1345577884.db2.gz TZVMVKZGONWNQI-KURKYZTESA-N 1 3 337.552 2.791 10 0 EFAEHO CN(CC(=O)N(C)CC[N@@H+](C)C[C@@H]1CC[C@@H]2C[C@@H]2C1)CC(C)(C)C ZINC001379100815 1345577888 /nfs/dbraw/zinc/57/78/88/1345577888.db2.gz TZVMVKZGONWNQI-KURKYZTESA-N 1 3 337.552 2.791 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)[N@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001379132451 1345611109 /nfs/dbraw/zinc/61/11/09/1345611109.db2.gz OQNSVKAKUKCVPR-HNNXBMFYSA-N 1 3 337.895 2.887 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001379132451 1345611110 /nfs/dbraw/zinc/61/11/10/1345611110.db2.gz OQNSVKAKUKCVPR-HNNXBMFYSA-N 1 3 337.895 2.887 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)CN(C)C(=O)CN2CC[C@H](C)C2)c(C)s1 ZINC001379211342 1345661481 /nfs/dbraw/zinc/66/14/81/1345661481.db2.gz BXHBBOODPMWDEW-KBPBESRZSA-N 1 3 337.533 2.643 10 0 EFAEHO C[C@H](CN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]CC1CCC(C)(C)CC1 ZINC001379215915 1345662989 /nfs/dbraw/zinc/66/29/89/1345662989.db2.gz HUTFZXXYHBIOQX-IAGOWNOFSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]CCC(F)(F)F ZINC001379252218 1345682186 /nfs/dbraw/zinc/68/21/86/1345682186.db2.gz YJBONABXAUPDID-KBPBESRZSA-N 1 3 337.430 2.638 10 0 EFAEHO C[C@H](CC[NH2+][C@H]1CCc2ccccc21)NC(=O)CN(C)C1CCC1 ZINC001379297743 1345707437 /nfs/dbraw/zinc/70/74/37/1345707437.db2.gz NPMRTRMASSGYKN-BEFAXECRSA-N 1 3 329.488 2.643 10 0 EFAEHO CCN(CC[NH2+][C@H](C)c1cccc(OC)c1)C(=O)C1(N(C)C)CCC1 ZINC001379305613 1345711664 /nfs/dbraw/zinc/71/16/64/1345711664.db2.gz PPACTKIWAMUSSG-MRXNPFEDSA-N 1 3 347.503 2.679 10 0 EFAEHO Cc1ccc(CN[C@H](C)CN(C)C(=O)CC[NH+]2CCCCC2)c(C)n1 ZINC001379325787 1345729554 /nfs/dbraw/zinc/72/95/54/1345729554.db2.gz QFRLOGKMOKWSAE-QGZVFWFLSA-N 1 3 346.519 2.511 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@@H](C)[NH2+]CCc1ccccc1F ZINC001379327899 1345731520 /nfs/dbraw/zinc/73/15/20/1345731520.db2.gz LRFUNGNRTKVEJF-APWZRJJASA-N 1 3 349.494 2.679 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[NH2+]Cc1ccccc1C(F)(F)F ZINC001379463080 1345799947 /nfs/dbraw/zinc/79/99/47/1345799947.db2.gz DFTWSBSOABVUGC-CYBMUJFWSA-N 1 3 345.409 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccccc2C2CC2)C[C@@H]1C ZINC001379584042 1345890449 /nfs/dbraw/zinc/89/04/49/1345890449.db2.gz IBCGWJZKOBSJCD-LPHOPBHVSA-N 1 3 343.515 2.983 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CC2CC(NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001393900481 1357270944 /nfs/dbraw/zinc/27/09/44/1357270944.db2.gz DCKNRVPLUNBMMM-KVWWFHCMSA-N 1 3 349.494 2.705 10 0 EFAEHO CC[C@@H](C(=O)NC1CC(C[NH2+]Cc2cccc(C(C)C)n2)C1)N(C)C ZINC001393909875 1357278412 /nfs/dbraw/zinc/27/84/12/1357278412.db2.gz UTIPGMHAAMXEPM-KVWWFHCMSA-N 1 3 346.519 2.530 10 0 EFAEHO C[C@@H](C[N@H+](C)C[C@@H]1CCCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001379676275 1347251550 /nfs/dbraw/zinc/25/15/50/1347251550.db2.gz FIKZMZIJTIGTNZ-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[N@@H+](C)C[C@@H]1CCCC(F)(F)C1)NC(=O)C1(N(C)C)CCC1 ZINC001379676275 1347251552 /nfs/dbraw/zinc/25/15/52/1347251552.db2.gz FIKZMZIJTIGTNZ-LSDHHAIUSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](C[N@H+](C)CC1CCC2(CC2)CC1)NC(=O)CN(C)C1CCC1 ZINC001379681842 1347255754 /nfs/dbraw/zinc/25/57/54/1347255754.db2.gz RHESRNASSQZMGL-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](C[N@@H+](C)CC1CCC2(CC2)CC1)NC(=O)CN(C)C1CCC1 ZINC001379681842 1347255756 /nfs/dbraw/zinc/25/57/56/1347255756.db2.gz RHESRNASSQZMGL-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(OC)c1 ZINC001379695401 1347265726 /nfs/dbraw/zinc/26/57/26/1347265726.db2.gz ZYNBBWYZWLXGGX-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1cccc(OC)c1 ZINC001379695401 1347265730 /nfs/dbraw/zinc/26/57/30/1347265730.db2.gz ZYNBBWYZWLXGGX-VQIMIIECSA-N 1 3 347.503 2.506 10 0 EFAEHO CN(CC(=O)N1C[C@@H]([NH2+]C/C=C/Cl)C(C)(C)C1)CC(C)(C)C ZINC001379720749 1347284313 /nfs/dbraw/zinc/28/43/13/1347284313.db2.gz VXUFXQPNTUVVED-HSBSLETESA-N 1 3 329.916 2.543 10 0 EFAEHO COc1cccc([C@H](C)N(C)C[C@@H](C)NC(=O)C2(C[NH+](C)C)CC2)c1 ZINC001379723970 1347287123 /nfs/dbraw/zinc/28/71/23/1347287123.db2.gz NVNGAJBHAQKHFC-CVEARBPZSA-N 1 3 347.503 2.535 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C[N@H+](C)CCC1CCCCC1)N(C)C ZINC001379776312 1347326485 /nfs/dbraw/zinc/32/64/85/1347326485.db2.gz ZLCIFZMVSJWQSY-FUHWJXTLSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H](C)C[N@@H+](C)CCC1CCCCC1)N(C)C ZINC001379776312 1347326489 /nfs/dbraw/zinc/32/64/89/1347326489.db2.gz ZLCIFZMVSJWQSY-FUHWJXTLSA-N 1 3 325.541 2.980 10 0 EFAEHO CN(CC(=O)N[C@H](C[NH2+]Cc1ccsc1)C1CC1)CC(C)(C)C ZINC001379895115 1347392910 /nfs/dbraw/zinc/39/29/10/1347392910.db2.gz FFISXOAGPUGGIK-MRXNPFEDSA-N 1 3 337.533 2.710 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)[C@@H](C)NCc1cccc(Cl)c1F ZINC001393984800 1357351997 /nfs/dbraw/zinc/35/19/97/1357351997.db2.gz FMZHPNUXACNCDC-CHWSQXEVSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)[C@@H](C)NCc1cccc(Cl)c1F ZINC001393984800 1357352000 /nfs/dbraw/zinc/35/20/00/1357352000.db2.gz FMZHPNUXACNCDC-CHWSQXEVSA-N 1 3 343.874 2.804 10 0 EFAEHO O=C(C[NH+]1CCCC1)NC[C@@H]1CCN1Cc1ccc2ccccc2c1 ZINC001380036322 1347475854 /nfs/dbraw/zinc/47/58/54/1347475854.db2.gz QYLOEGJRBTXQIU-FQEVSTJZSA-N 1 3 337.467 2.626 10 0 EFAEHO CCc1ccccc1CN(C)CCN(C(=O)[C@H]1CC[N@H+](C)C1)C(C)C ZINC001380039127 1347478284 /nfs/dbraw/zinc/47/82/84/1347478284.db2.gz IGWMPGWBVBKDNF-FQEVSTJZSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1ccccc1CN(C)CCN(C(=O)[C@H]1CC[N@@H+](C)C1)C(C)C ZINC001380039127 1347478286 /nfs/dbraw/zinc/47/82/86/1347478286.db2.gz IGWMPGWBVBKDNF-FQEVSTJZSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1ccc(CN(C)CCN(C(=O)[C@@H]2CC[N@H+](C)C2)C(C)C)cc1 ZINC001380044014 1347482410 /nfs/dbraw/zinc/48/24/10/1347482410.db2.gz YXJUEFXNJBCQJN-HXUWFJFHSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1ccc(CN(C)CCN(C(=O)[C@@H]2CC[N@@H+](C)C2)C(C)C)cc1 ZINC001380044014 1347482412 /nfs/dbraw/zinc/48/24/12/1347482412.db2.gz YXJUEFXNJBCQJN-HXUWFJFHSA-N 1 3 345.531 2.870 10 0 EFAEHO CCCN(C)CC(=O)N[C@H](C[NH2+]C[C@@H]1CCC(F)(F)C1)C(C)(C)C ZINC001380092179 1347511740 /nfs/dbraw/zinc/51/17/40/1347511740.db2.gz YHYRWRIAALBATN-HUUCEWRRSA-N 1 3 347.494 2.884 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+]Cc2ccc(C3CC3)cc2)CC1)N(C)C ZINC001380098145 1347514116 /nfs/dbraw/zinc/51/41/16/1347514116.db2.gz FMKDXHGPKVGBPA-IBGZPJMESA-N 1 3 343.515 2.889 10 0 EFAEHO C[C@@H](NC1(CNC(=O)CC[C@@H]2CCC[N@@H+]2C)CC1)c1ccc(F)cc1 ZINC001380100143 1347514376 /nfs/dbraw/zinc/51/43/76/1347514376.db2.gz DYBCTDTXAUOSEW-QAPCUYQASA-N 1 3 347.478 3.000 10 0 EFAEHO C[C@@H](NC1(CNC(=O)CC[C@@H]2CCC[N@H+]2C)CC1)c1ccc(F)cc1 ZINC001380100143 1347514378 /nfs/dbraw/zinc/51/43/78/1347514378.db2.gz DYBCTDTXAUOSEW-QAPCUYQASA-N 1 3 347.478 3.000 10 0 EFAEHO C[C@@H](NC(=O)CCC[NH+](C)C)C1CCN(Cc2ccc(F)cc2)CC1 ZINC001380137137 1347528693 /nfs/dbraw/zinc/52/86/93/1347528693.db2.gz VZHFLSZVIMZFJC-MRXNPFEDSA-N 1 3 349.494 2.884 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2ccc(C)c(C)c2)C1)N(C)C ZINC001380163035 1347542740 /nfs/dbraw/zinc/54/27/40/1347542740.db2.gz LMVZZERMIOHRNN-CTWPCTMYSA-N 1 3 331.504 2.723 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C1CC([NH2+][C@H]2CCc3ccc(F)cc32)C1 ZINC001380174707 1347548948 /nfs/dbraw/zinc/54/89/48/1347548948.db2.gz DBJWDYABPASCBR-TVPLGVNVSA-N 1 3 347.478 2.732 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@@H]2CCCN2C(=O)CN(C)C(C)C)c1 ZINC001380292683 1347572306 /nfs/dbraw/zinc/57/23/06/1347572306.db2.gz VFNGJOFGBZSCKV-IBGZPJMESA-N 1 3 331.504 2.724 10 0 EFAEHO C[C@@H](F)CC[NH+]1CCC(C)(NC(=O)CN(C)CC(C)(C)C)CC1 ZINC001380318896 1347589917 /nfs/dbraw/zinc/58/99/17/1347589917.db2.gz UWJWYXOIBQYPRQ-OAHLLOKOSA-N 1 3 329.504 2.683 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NCC1(C)CC[NH+](C[C@H](F)CC)CC1 ZINC001380437679 1347671272 /nfs/dbraw/zinc/67/12/72/1347671272.db2.gz CWHSFKQSQOIUPE-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO CC(C)(C(=O)NCC1(C)CCN(C/C=C/Cl)CC1)[NH+]1CCCC1 ZINC001380452674 1347682716 /nfs/dbraw/zinc/68/27/16/1347682716.db2.gz YWSNEMJUNPNFPI-RMKNXTFCSA-N 1 3 341.927 2.832 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@]1(C)CCC[N@H+](CCC(C)(C)C)C1 ZINC001380482770 1347712589 /nfs/dbraw/zinc/71/25/89/1347712589.db2.gz LKIRMUAMBMLFPT-LJQANCHMSA-N 1 3 325.541 2.983 10 0 EFAEHO CCCN(C)CC(=O)NC[C@@]1(C)CCC[N@@H+](CCC(C)(C)C)C1 ZINC001380482770 1347712592 /nfs/dbraw/zinc/71/25/92/1347712592.db2.gz LKIRMUAMBMLFPT-LJQANCHMSA-N 1 3 325.541 2.983 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CC)c1ccccc1CC ZINC001380658899 1347795340 /nfs/dbraw/zinc/79/53/40/1347795340.db2.gz ULTFLJGGVRMNBW-RTBURBONSA-N 1 3 331.504 2.890 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccsc2)C3)CCC1 ZINC001380661829 1347797410 /nfs/dbraw/zinc/79/74/10/1347797410.db2.gz QZCNAVHBRGOZIX-ULQDDVLXSA-N 1 3 347.528 2.702 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccsc2)C3)CCC1 ZINC001380661829 1347797413 /nfs/dbraw/zinc/79/74/13/1347797413.db2.gz QZCNAVHBRGOZIX-ULQDDVLXSA-N 1 3 347.528 2.702 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2ccc(F)cc2C)C1 ZINC001380683473 1347811370 /nfs/dbraw/zinc/81/13/70/1347811370.db2.gz BQBKNGTXNJQGOF-WMZOPIPTSA-N 1 3 349.494 2.660 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2ccc(F)cc2C)C1 ZINC001380683468 1347811402 /nfs/dbraw/zinc/81/14/02/1347811402.db2.gz BQBKNGTXNJQGOF-FUHWJXTLSA-N 1 3 349.494 2.660 10 0 EFAEHO CC[C@H](C)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)C2 ZINC001380686167 1347813675 /nfs/dbraw/zinc/81/36/75/1347813675.db2.gz YJPGGQDVIWWSEQ-APAFKAMOSA-N 1 3 335.536 2.734 10 0 EFAEHO CC[C@H](C)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)C2 ZINC001380686167 1347813676 /nfs/dbraw/zinc/81/36/76/1347813676.db2.gz YJPGGQDVIWWSEQ-APAFKAMOSA-N 1 3 335.536 2.734 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2ccccc2C)C1 ZINC001380692032 1347817151 /nfs/dbraw/zinc/81/71/51/1347817151.db2.gz SGRLCFXKSMTUPH-PKOBYXMFSA-N 1 3 331.504 2.521 10 0 EFAEHO CCCN(C)CC(=O)NCc1cccc2c1CC[N@H+](CC1CCC1)C2 ZINC001380821850 1347898474 /nfs/dbraw/zinc/89/84/74/1347898474.db2.gz GXIJESNVKNORIE-UHFFFAOYSA-N 1 3 343.515 2.803 10 0 EFAEHO CCCN(C)CC(=O)NCc1cccc2c1CC[N@@H+](CC1CCC1)C2 ZINC001380821850 1347898475 /nfs/dbraw/zinc/89/84/75/1347898475.db2.gz GXIJESNVKNORIE-UHFFFAOYSA-N 1 3 343.515 2.803 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1cccc2c1CC[N@H+](CCC1CC1)C2 ZINC001380822862 1347899297 /nfs/dbraw/zinc/89/92/97/1347899297.db2.gz KIJPMCFVLYHJFH-UHFFFAOYSA-N 1 3 343.515 2.801 10 0 EFAEHO CC(C)N(C)CC(=O)NCc1cccc2c1CC[N@@H+](CCC1CC1)C2 ZINC001380822862 1347899301 /nfs/dbraw/zinc/89/93/01/1347899301.db2.gz KIJPMCFVLYHJFH-UHFFFAOYSA-N 1 3 343.515 2.801 10 0 EFAEHO C[NH+]1CCC(CC(=O)NCC2(NCc3ccsc3)CCC2)CC1 ZINC001380883647 1347935341 /nfs/dbraw/zinc/93/53/41/1347935341.db2.gz QYANHKXVBAJVGG-UHFFFAOYSA-N 1 3 335.517 2.609 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CCCN(C/C=C\Cl)CC1 ZINC001380933339 1347966078 /nfs/dbraw/zinc/96/60/78/1347966078.db2.gz WBLZLHTYILQTCW-CSXAIKOLSA-N 1 3 327.900 2.584 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CCCN(C/C=C\Cl)CC1 ZINC001380933339 1347966082 /nfs/dbraw/zinc/96/60/82/1347966082.db2.gz WBLZLHTYILQTCW-CSXAIKOLSA-N 1 3 327.900 2.584 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CCC([NH2+]Cc2cncc(C)c2)CC1)N(C)C ZINC001394008941 1357382001 /nfs/dbraw/zinc/38/20/01/1357382001.db2.gz MUSYETATSCQMMF-CTWPCTMYSA-N 1 3 346.519 2.589 10 0 EFAEHO CN(CCC[N@H+](C)C[C@H]1CCCC(F)(F)C1)C(=O)[C@@H]1CCCN1C ZINC001380948262 1347978116 /nfs/dbraw/zinc/97/81/16/1347978116.db2.gz KDKKLHNFZGZYRU-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO CN(CCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1)C(=O)[C@@H]1CCCN1C ZINC001380948262 1347978118 /nfs/dbraw/zinc/97/81/18/1347978118.db2.gz KDKKLHNFZGZYRU-HOTGVXAUSA-N 1 3 345.478 2.686 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@H+](C)C[C@H]1CCC(F)(F)C1)N(C)C ZINC001380983579 1348004388 /nfs/dbraw/zinc/00/43/88/1348004388.db2.gz WWPPWZRBTXJLKV-GJZGRUSLSA-N 1 3 333.467 2.542 10 0 EFAEHO CC[C@@H](C(=O)N(C)CCC[N@@H+](C)C[C@H]1CCC(F)(F)C1)N(C)C ZINC001380983579 1348004392 /nfs/dbraw/zinc/00/43/92/1348004392.db2.gz WWPPWZRBTXJLKV-GJZGRUSLSA-N 1 3 333.467 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H]1CCC[N@H+](CCCF)C1 ZINC001380987148 1348006949 /nfs/dbraw/zinc/00/69/49/1348006949.db2.gz BAQYKRHLQBLIOL-ZWKOTPCHSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@H]1CCC[N@@H+](CCCF)C1 ZINC001380987148 1348006952 /nfs/dbraw/zinc/00/69/52/1348006952.db2.gz BAQYKRHLQBLIOL-ZWKOTPCHSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@@H](CCNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(Cl)cc1 ZINC001381215087 1348144654 /nfs/dbraw/zinc/14/46/54/1348144654.db2.gz YTHDRZDEUYLIAJ-GJZGRUSLSA-N 1 3 337.895 2.666 10 0 EFAEHO CCCN(C)CC(=O)NC1CC(C[NH2+]Cc2ccc3c(c2)CCC3)C1 ZINC001381336781 1348214281 /nfs/dbraw/zinc/21/42/81/1348214281.db2.gz CIJLJWDSZAMTKV-UHFFFAOYSA-N 1 3 343.515 2.502 10 0 EFAEHO CC(C)N(C)CC(=O)NC1CC(C[NH2+]C[C@H]2CCCC(F)(F)C2)C1 ZINC001381339290 1348215214 /nfs/dbraw/zinc/21/52/14/1348215214.db2.gz FQGZIVFLWBRSOY-FHERZECASA-N 1 3 345.478 2.637 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC2CC(NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001381341279 1348215999 /nfs/dbraw/zinc/21/59/99/1348215999.db2.gz SCFITUVQSYDYSK-LYBXBRPPSA-N 1 3 345.531 2.874 10 0 EFAEHO Cc1ccc(C)c(C[NH2+]CC2CC(NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001381341280 1348216040 /nfs/dbraw/zinc/21/60/40/1348216040.db2.gz SCFITUVQSYDYSK-UUKMXZOPSA-N 1 3 345.531 2.874 10 0 EFAEHO CC[C@H](C(=O)NC1CC(C[NH2+]Cc2ccc(Cl)s2)C1)N(C)C ZINC001381341605 1348216342 /nfs/dbraw/zinc/21/63/42/1348216342.db2.gz UMDPVCPNKMVYNB-ORHYLEIMSA-N 1 3 343.924 2.726 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@@H](C)CNC(=O)CC[C@H]1CCC[N@@H+]1C ZINC001381527891 1348331922 /nfs/dbraw/zinc/33/19/22/1348331922.db2.gz FWBVBDSQBYARJK-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1cc(F)ccc1CN(C)[C@@H](C)CNC(=O)CC[C@H]1CCC[N@H+]1C ZINC001381527891 1348331925 /nfs/dbraw/zinc/33/19/25/1348331925.db2.gz FWBVBDSQBYARJK-QFBILLFUSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[N@H+](C)CC[C@H]1CCCC1(F)F ZINC001381529238 1348333042 /nfs/dbraw/zinc/33/30/42/1348333042.db2.gz CFGDHLGLYNVHFY-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@H](CNC(=O)CN(C)C1CCC1)[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC001381529238 1348333044 /nfs/dbraw/zinc/33/30/44/1348333044.db2.gz CFGDHLGLYNVHFY-HUUCEWRRSA-N 1 3 345.478 2.733 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@H+](C)Cc1cccc2cccnc21)N(C)C ZINC001381533403 1348336106 /nfs/dbraw/zinc/33/61/06/1348336106.db2.gz KVPJSHJMLDPICT-CRAIPNDOSA-N 1 3 342.487 2.512 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[N@@H+](C)Cc1cccc2cccnc21)N(C)C ZINC001381533403 1348336110 /nfs/dbraw/zinc/33/61/10/1348336110.db2.gz KVPJSHJMLDPICT-CRAIPNDOSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H](C)[N@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001381623885 1348413200 /nfs/dbraw/zinc/41/32/00/1348413200.db2.gz IVSDEWADQYYDOS-SJLPKXTDSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H](C)[N@@H+](C)CC1CCC2(CC2)CC1)N(C)C ZINC001381623885 1348413203 /nfs/dbraw/zinc/41/32/03/1348413203.db2.gz IVSDEWADQYYDOS-SJLPKXTDSA-N 1 3 337.552 2.980 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2[C@H]3C[N@@H+](CC4CCCCCC4)C[C@H]32)CCC1 ZINC001381893209 1348594910 /nfs/dbraw/zinc/59/49/10/1348594910.db2.gz JUKPZWDVPUBOHG-LDLYASANSA-N 1 3 347.547 2.735 10 0 EFAEHO CN(C)C1(C(=O)NC[C@@H]2[C@H]3C[N@H+](CC4CCCCCC4)C[C@H]32)CCC1 ZINC001381893209 1348594914 /nfs/dbraw/zinc/59/49/14/1348594914.db2.gz JUKPZWDVPUBOHG-LDLYASANSA-N 1 3 347.547 2.735 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@H+](C[C@@H]1CC[C@H]3C[C@H]3C1)C2 ZINC001381940563 1348618305 /nfs/dbraw/zinc/61/83/05/1348618305.db2.gz OXKJDEPRZZKFCU-CEXWTWQISA-N 1 3 347.547 2.687 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC2(C1)CCC[N@@H+](C[C@@H]1CC[C@H]3C[C@H]3C1)C2 ZINC001381940563 1348618307 /nfs/dbraw/zinc/61/83/07/1348618307.db2.gz OXKJDEPRZZKFCU-CEXWTWQISA-N 1 3 347.547 2.687 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1C[C@H](C[NH2+]Cc2cccc(C(C)C)n2)C1)N(C)C ZINC001381974212 1348633185 /nfs/dbraw/zinc/63/31/85/1348633185.db2.gz UTIPGMHAAMXEPM-SZVBFZGTSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)[C@@H](CCNC(=O)C1(N(C)C)CCC1)[NH2+]Cc1cccc(F)c1 ZINC001381997705 1348649705 /nfs/dbraw/zinc/64/97/05/1348649705.db2.gz TVDNDPVESGPKIT-GOSISDBHSA-N 1 3 349.494 2.931 10 0 EFAEHO CCc1ccccc1C[NH2+]C[C@H]1C[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001382014343 1348661764 /nfs/dbraw/zinc/66/17/64/1348661764.db2.gz SFEZSSMWTDPCSU-RUCARUNLSA-N 1 3 331.504 2.574 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)C[C@@H](C)[NH2+]Cc1ccc2cc[nH]c2c1)N(C)C ZINC001382098051 1348718617 /nfs/dbraw/zinc/71/86/17/1348718617.db2.gz LANHPTWADAJTEY-BEFAXECRSA-N 1 3 344.503 2.691 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001382131524 1348752141 /nfs/dbraw/zinc/75/21/41/1348752141.db2.gz ZIPBRENCOXVCSF-SJORKVTESA-N 1 3 343.515 2.842 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(C)c(F)c1 ZINC001382170495 1348791416 /nfs/dbraw/zinc/79/14/16/1348791416.db2.gz XPVHMWQBNMIDSF-LPHOPBHVSA-N 1 3 349.494 2.945 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1C[C@@H](NCc2ccc(C)nc2C)C[C@@H]1C ZINC001382321661 1348870414 /nfs/dbraw/zinc/87/04/14/1348870414.db2.gz ZPMPBJQUERZRLG-LPHOPBHVSA-N 1 3 346.519 2.509 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1C[C@@H](NCc2ccc(C)nc2C)C[C@@H]1C ZINC001382321661 1348870417 /nfs/dbraw/zinc/87/04/17/1348870417.db2.gz ZPMPBJQUERZRLG-LPHOPBHVSA-N 1 3 346.519 2.509 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CC3CCCC3)[C@@H]2C1 ZINC001382324066 1348875055 /nfs/dbraw/zinc/87/50/55/1348875055.db2.gz BPLMAKDSUZDYQW-OTWHNJEPSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)Cc2ccc(C)c(F)c2)CC[N@@H+]1C ZINC001394063205 1357432653 /nfs/dbraw/zinc/43/26/53/1357432653.db2.gz UANAWDWXIQWLKV-VDZJLULYSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](C)N(C)Cc2ccc(C)c(F)c2)CC[N@H+]1C ZINC001394063205 1357432656 /nfs/dbraw/zinc/43/26/56/1357432656.db2.gz UANAWDWXIQWLKV-VDZJLULYSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccccc1C[N@@H+](C)CCN(C(=O)CN1CCCC1)C(C)C ZINC001382504629 1348970591 /nfs/dbraw/zinc/97/05/91/1348970591.db2.gz KJXUHVPSZICYDP-UHFFFAOYSA-N 1 3 331.504 2.760 10 0 EFAEHO Cc1ccccc1C[N@H+](C)CCN(C(=O)CN1CCCC1)C(C)C ZINC001382504629 1348970593 /nfs/dbraw/zinc/97/05/93/1348970593.db2.gz KJXUHVPSZICYDP-UHFFFAOYSA-N 1 3 331.504 2.760 10 0 EFAEHO CC(C)N(CC[N@H+](C)CCCF)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001382505463 1348972424 /nfs/dbraw/zinc/97/24/24/1348972424.db2.gz INLXJFRQPYZUDI-GOSISDBHSA-N 1 3 347.494 2.727 10 0 EFAEHO CC(C)N(CC[N@@H+](C)CCCF)C(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001382505463 1348972429 /nfs/dbraw/zinc/97/24/29/1348972429.db2.gz INLXJFRQPYZUDI-GOSISDBHSA-N 1 3 347.494 2.727 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C[NH2+]CC1CC(C)(C)C1)C(C)(C)C)N(C)C ZINC001382542952 1349008782 /nfs/dbraw/zinc/00/87/82/1349008782.db2.gz VWLZIBTXDNNWTR-CVEARBPZSA-N 1 3 325.541 2.883 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C)C1CC[NH+](CC[C@H](C)F)CC1)N(C)C ZINC001382551953 1349012966 /nfs/dbraw/zinc/01/29/66/1349012966.db2.gz SHSRJCYPHMHGPW-UXLLHSPISA-N 1 3 329.504 2.537 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001382580077 1349031367 /nfs/dbraw/zinc/03/13/67/1349031367.db2.gz QMQKSCXBCMNPLE-SOAGJPPSSA-N 1 3 343.515 2.983 10 0 EFAEHO CC[C@H](C(=O)N(C)C1CC([NH2+]Cc2ccc(Cl)cc2)C1)N(C)C ZINC001382591919 1349039345 /nfs/dbraw/zinc/03/93/45/1349039345.db2.gz WVORJZPXAYBRCJ-OFLPRAFFSA-N 1 3 337.895 2.759 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)CC[C@H]1CCC[C@@H](C)C1 ZINC001420055700 1376392877 /nfs/dbraw/zinc/39/28/77/1376392877.db2.gz BBPAZIJUQYGKGM-QZTJIDSGSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)CC[C@H]1CCC[C@@H](C)C1 ZINC001420055700 1376392888 /nfs/dbraw/zinc/39/28/88/1376392888.db2.gz BBPAZIJUQYGKGM-QZTJIDSGSA-N 1 3 325.541 2.933 10 0 EFAEHO CN(C[C@@H]1CCN1CC/C=C\c1ccccc1)C(=O)[C@H]1CC[N@H+](C)C1 ZINC001388662630 1352903941 /nfs/dbraw/zinc/90/39/41/1352903941.db2.gz OXKGYTNGNMBWPY-VZDLESTCSA-N 1 3 341.499 2.574 10 0 EFAEHO CN(C[C@@H]1CCN1CC/C=C\c1ccccc1)C(=O)[C@H]1CC[N@@H+](C)C1 ZINC001388662630 1352903944 /nfs/dbraw/zinc/90/39/44/1352903944.db2.gz OXKGYTNGNMBWPY-VZDLESTCSA-N 1 3 341.499 2.574 10 0 EFAEHO CN(CC(=O)NC[C@H]1C[C@@H]([NH2+]CCC(C)(C)C)C1)CC(C)(C)C ZINC001388689985 1352923282 /nfs/dbraw/zinc/92/32/82/1352923282.db2.gz ZKPHSYZLQQCSJM-IYBDPMFKSA-N 1 3 325.541 2.885 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001388689081 1352922618 /nfs/dbraw/zinc/92/26/18/1352922618.db2.gz UBRNHXPKOOOQIW-WCVJEAGWSA-N 1 3 345.478 2.637 10 0 EFAEHO CCc1ccc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001388701299 1352932219 /nfs/dbraw/zinc/93/22/19/1352932219.db2.gz BAAIFIKVVZYUDG-KDURUIRLSA-N 1 3 331.504 2.574 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc32)C1)N(C)C ZINC001388728269 1352955779 /nfs/dbraw/zinc/95/57/79/1352955779.db2.gz ZQNXGRVYKOLTOS-RARDXLECSA-N 1 3 343.515 2.745 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1C[C@H]([NH2+]CC2CCC(C)CC2)C1 ZINC001388735464 1352962655 /nfs/dbraw/zinc/96/26/55/1352962655.db2.gz LVLZVIWPQINIGF-HZGUWWOASA-N 1 3 332.492 2.571 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H]1C[N@@H+](C(C)C)C[C@H]1c1ccccc1 ZINC001388745269 1352971811 /nfs/dbraw/zinc/97/18/11/1352971811.db2.gz FLRCOMCHOHTHOP-GBESFXJTSA-N 1 3 349.494 2.659 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@@H]1C[N@H+](C(C)C)C[C@H]1c1ccccc1 ZINC001388745269 1352971814 /nfs/dbraw/zinc/97/18/14/1352971814.db2.gz FLRCOMCHOHTHOP-GBESFXJTSA-N 1 3 349.494 2.659 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@@H+](C(C)C)CC[C@@H]1c1ccccc1)N(C)C ZINC001388766735 1352991220 /nfs/dbraw/zinc/99/12/20/1352991220.db2.gz DTBUPGNQKBEJMJ-VAMGGRTRSA-N 1 3 345.531 2.955 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1C[N@H+](C(C)C)CC[C@@H]1c1ccccc1)N(C)C ZINC001388766735 1352991223 /nfs/dbraw/zinc/99/12/23/1352991223.db2.gz DTBUPGNQKBEJMJ-VAMGGRTRSA-N 1 3 345.531 2.955 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@H]2C)c1 ZINC001388793613 1353023932 /nfs/dbraw/zinc/02/39/32/1353023932.db2.gz HAWBQCRSOLWUPY-NZSAHSFTSA-N 1 3 331.504 2.660 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@H]2C)c1 ZINC001388793613 1353023938 /nfs/dbraw/zinc/02/39/38/1353023938.db2.gz HAWBQCRSOLWUPY-NZSAHSFTSA-N 1 3 331.504 2.660 10 0 EFAEHO Cc1ccccc1C[N@H+]1C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001394281257 1357665070 /nfs/dbraw/zinc/66/50/70/1357665070.db2.gz GCWBCJIZZHKEOG-MOPGFXCFSA-N 1 3 345.531 2.908 10 0 EFAEHO Cc1ccccc1C[N@@H+]1C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)(C)C1 ZINC001394281257 1357665072 /nfs/dbraw/zinc/66/50/72/1357665072.db2.gz GCWBCJIZZHKEOG-MOPGFXCFSA-N 1 3 345.531 2.908 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@H]1CN(Cc2ccc(CF)cc2)CC1(C)C ZINC001394292203 1357677803 /nfs/dbraw/zinc/67/78/03/1357677803.db2.gz WUMJTONHJDZGKS-GOSISDBHSA-N 1 3 349.494 2.825 10 0 EFAEHO C[C@@H](F)CCN1CC[C@@H](NC(=O)C(C)(C)[N@H+](C)C2CCCC2)C1 ZINC001389472530 1353414449 /nfs/dbraw/zinc/41/44/49/1353414449.db2.gz UAKVVFKGHQWTAI-HUUCEWRRSA-N 1 3 327.488 2.578 10 0 EFAEHO C[C@@H](F)CCN1CC[C@@H](NC(=O)C(C)(C)[N@@H+](C)C2CCCC2)C1 ZINC001389472530 1353414451 /nfs/dbraw/zinc/41/44/51/1353414451.db2.gz UAKVVFKGHQWTAI-HUUCEWRRSA-N 1 3 327.488 2.578 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@@H]1CCN(Cc2ccc(C(C)(C)C)cc2)C1 ZINC001389478214 1353417298 /nfs/dbraw/zinc/41/72/98/1353417298.db2.gz INZOXVBQCXDGNH-GOSISDBHSA-N 1 3 331.504 2.626 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@@H]1CCN(Cc2cc3ccccc3s2)C1 ZINC001389481763 1353420216 /nfs/dbraw/zinc/42/02/16/1353420216.db2.gz MGGSVXOLESKPMR-MRXNPFEDSA-N 1 3 345.512 2.934 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCCC(C)(C)C)C[C@H]21 ZINC001394311996 1357693431 /nfs/dbraw/zinc/69/34/31/1357693431.db2.gz KFEKZBLIEIXUTF-OKYOBFRVSA-N 1 3 349.563 2.981 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@@H]1[C@H]2C[N@H+](CCCC(C)(C)C)C[C@H]21 ZINC001394311996 1357693435 /nfs/dbraw/zinc/69/34/35/1357693435.db2.gz KFEKZBLIEIXUTF-OKYOBFRVSA-N 1 3 349.563 2.981 10 0 EFAEHO CC[C@@H](F)CN1CCC2(C[C@H]2NC(=O)CC[NH+]2CCCCC2)CC1 ZINC001389519408 1353448372 /nfs/dbraw/zinc/44/83/72/1353448372.db2.gz CCDGXFCALGYHQU-IAGOWNOFSA-N 1 3 339.499 2.581 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC12CC[NH+](Cc1ccc(F)cc1)CC2 ZINC001389532596 1353460481 /nfs/dbraw/zinc/46/04/81/1353460481.db2.gz UAOMPZJKWLFEAZ-SFHVURJKSA-N 1 3 347.478 2.637 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1[C@H]2C[N@@H+](CCC3CCCCC3)C[C@H]21)N(C)C ZINC001394315104 1357695523 /nfs/dbraw/zinc/69/55/23/1357695523.db2.gz IVOWJDPUVYNHPJ-AKHDSKFASA-N 1 3 335.536 2.591 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H]1[C@H]2C[N@H+](CCC3CCCCC3)C[C@H]21)N(C)C ZINC001394315104 1357695526 /nfs/dbraw/zinc/69/55/26/1357695526.db2.gz IVOWJDPUVYNHPJ-AKHDSKFASA-N 1 3 335.536 2.591 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CC1CC2(CCC2)C1)C1CC1 ZINC001389615498 1353512250 /nfs/dbraw/zinc/51/22/50/1353512250.db2.gz WUXHPGWXAKAGBB-RTBURBONSA-N 1 3 347.547 2.926 10 0 EFAEHO CC(C)(C(=O)NC[C@@H]([NH2+]Cc1ccsc1)C1CC1)N1CCCC1 ZINC001389645895 1353529456 /nfs/dbraw/zinc/52/94/56/1353529456.db2.gz GWGMYLYWVUGPTO-MRXNPFEDSA-N 1 3 335.517 2.607 10 0 EFAEHO CC(C)(C(=O)NC[C@@H](NCc1ccccc1F)C1CC1)[NH+]1CCCC1 ZINC001389673613 1353545018 /nfs/dbraw/zinc/54/50/18/1353545018.db2.gz XDQBGBQNLLBJNP-GOSISDBHSA-N 1 3 347.478 2.685 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)NC[C@@H]([NH2+]Cc1ccccc1F)C1CC1 ZINC001389689890 1353557282 /nfs/dbraw/zinc/55/72/82/1353557282.db2.gz NGINFPXWXYGQHG-MOPGFXCFSA-N 1 3 347.478 2.685 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@H+](C)Cc2cccc(F)c2)C1 ZINC001389743689 1353595631 /nfs/dbraw/zinc/59/56/31/1353595631.db2.gz NNROFPBYSOXDSO-GOSISDBHSA-N 1 3 349.494 2.836 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@@H+](C)Cc2cccc(F)c2)C1 ZINC001389743689 1353595633 /nfs/dbraw/zinc/59/56/33/1353595633.db2.gz NNROFPBYSOXDSO-GOSISDBHSA-N 1 3 349.494 2.836 10 0 EFAEHO O=C([C@@H]1CC[N@@H+](C2CCCCC2)C1)N1CC[C@H](NC/C=C\Cl)C1 ZINC001389781431 1353617272 /nfs/dbraw/zinc/61/72/72/1353617272.db2.gz LCPASIBPDLTCJV-LFWKBAGKSA-N 1 3 339.911 2.584 10 0 EFAEHO O=C([C@@H]1CC[N@H+](C2CCCCC2)C1)N1CC[C@H](NC/C=C\Cl)C1 ZINC001389781431 1353617274 /nfs/dbraw/zinc/61/72/74/1353617274.db2.gz LCPASIBPDLTCJV-LFWKBAGKSA-N 1 3 339.911 2.584 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@H+](CC3CCCC3)CC[C@H]21 ZINC001389946973 1353704678 /nfs/dbraw/zinc/70/46/78/1353704678.db2.gz FXQODFXDYHTRPU-RBUKOAKNSA-N 1 3 335.536 2.831 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H]2C[N@@H+](CC3CCCC3)CC[C@H]21 ZINC001389946973 1353704681 /nfs/dbraw/zinc/70/46/81/1353704681.db2.gz FXQODFXDYHTRPU-RBUKOAKNSA-N 1 3 335.536 2.831 10 0 EFAEHO CN(CC(=O)NC[C@@H]1[C@H]2C[N@@H+](CC3CC(C)(C)C3)C[C@H]21)CC(C)(C)C ZINC001394340700 1357712970 /nfs/dbraw/zinc/71/29/70/1357712970.db2.gz OLLSRDOFMVSFCL-NNZMDNLPSA-N 1 3 349.563 2.695 10 0 EFAEHO CN(CC(=O)NC[C@@H]1[C@H]2C[N@H+](CC3CC(C)(C)C3)C[C@H]21)CC(C)(C)C ZINC001394340700 1357712974 /nfs/dbraw/zinc/71/29/74/1357712974.db2.gz OLLSRDOFMVSFCL-NNZMDNLPSA-N 1 3 349.563 2.695 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)CN(C)CC(C)(C)C)C2)cc1F ZINC001390000193 1353733762 /nfs/dbraw/zinc/73/37/62/1353733762.db2.gz PEJMMSUEGJOTJX-CALCHBBNSA-N 1 3 349.494 2.849 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(F)c(F)c2)C1)N(C)C ZINC001390004795 1353736611 /nfs/dbraw/zinc/73/66/11/1353736611.db2.gz ASFCVEPWGQGRFB-DPYKFYPSSA-N 1 3 339.430 2.603 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)c(F)c2)C1)N(C)C ZINC001390004782 1353736844 /nfs/dbraw/zinc/73/68/44/1353736844.db2.gz ASFCVEPWGQGRFB-CVGURMSBSA-N 1 3 339.430 2.603 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001390043953 1353762161 /nfs/dbraw/zinc/76/21/61/1353762161.db2.gz QSHUXAWMLQSOAT-AEFFLSMTSA-N 1 3 337.552 2.837 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]1CCC[N@@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001390043953 1353762164 /nfs/dbraw/zinc/76/21/64/1353762164.db2.gz QSHUXAWMLQSOAT-AEFFLSMTSA-N 1 3 337.552 2.837 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CCC[N@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001390064944 1353778984 /nfs/dbraw/zinc/77/89/84/1353778984.db2.gz MDTCCDZMQNEENG-ZWKOTPCHSA-N 1 3 347.547 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]2CCC[N@@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001390064944 1353778989 /nfs/dbraw/zinc/77/89/89/1353778989.db2.gz MDTCCDZMQNEENG-ZWKOTPCHSA-N 1 3 347.547 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CCC[N@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001390064935 1353779234 /nfs/dbraw/zinc/77/92/34/1353779234.db2.gz MDTCCDZMQNEENG-QZTJIDSGSA-N 1 3 347.547 2.737 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@H]2CCC[N@@H+](CC3CC4(CCC4)C3)C2)C1 ZINC001390064935 1353779239 /nfs/dbraw/zinc/77/92/39/1353779239.db2.gz MDTCCDZMQNEENG-QZTJIDSGSA-N 1 3 347.547 2.737 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](C)CNC(=O)[C@@H]2CCCN2C(C)C)c(C)s1 ZINC001390359765 1354027588 /nfs/dbraw/zinc/02/75/88/1354027588.db2.gz JNMBAIUNNOBECG-GUYCJALGSA-N 1 3 337.533 2.832 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)CNC(=O)[C@H]2CCCN2C(C)C)c(C)s1 ZINC001390359687 1354027683 /nfs/dbraw/zinc/02/76/83/1354027683.db2.gz JNMBAIUNNOBECG-CXAGYDPISA-N 1 3 337.533 2.832 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]CCc1ccc2ccccc2c1)N(C)C ZINC001390414955 1354072633 /nfs/dbraw/zinc/07/26/33/1354072633.db2.gz OYYSMGAHTMZWKJ-OXQOHEQNSA-N 1 3 341.499 2.817 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[NH2+][C@H](C)c1ccc(F)cc1 ZINC001390453401 1354090156 /nfs/dbraw/zinc/09/01/56/1354090156.db2.gz AITAEHXIOAPIBQ-HUUCEWRRSA-N 1 3 335.467 2.855 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)[NH+]1CCCC1)N[C@@H](C)c1ccccc1F ZINC001390454081 1354091456 /nfs/dbraw/zinc/09/14/56/1354091456.db2.gz BGCDTWVVJBQXRR-CABCVRRESA-N 1 3 335.467 2.855 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](C)CNC(=O)[C@H](C)N2CCCCCC2)c1 ZINC001390479020 1354112749 /nfs/dbraw/zinc/11/27/49/1354112749.db2.gz KWBITNINFBHYBE-ROUUACIJSA-N 1 3 331.504 2.854 10 0 EFAEHO CC(C)c1ccc(C[NH2+][C@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001390479918 1354113930 /nfs/dbraw/zinc/11/39/30/1354113930.db2.gz KGGRELXCKHYIDS-IAGOWNOFSA-N 1 3 331.504 2.746 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC001390541716 1354161030 /nfs/dbraw/zinc/16/10/30/1354161030.db2.gz SGCCTJONCBXCSP-CYBMUJFWSA-N 1 3 345.409 2.640 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@@H]1C(=O)N1CC[C@@H](CNC/C(Cl)=C\Cl)C1 ZINC001390584565 1354186973 /nfs/dbraw/zinc/18/69/73/1354186973.db2.gz RKMATGITEITSRG-HBDJCUJWSA-N 1 3 348.318 2.616 10 0 EFAEHO CC(C)[N@H+]1CCC[C@@H]1C(=O)N1CC[C@@H](CNC/C(Cl)=C\Cl)C1 ZINC001390584565 1354186978 /nfs/dbraw/zinc/18/69/78/1354186978.db2.gz RKMATGITEITSRG-HBDJCUJWSA-N 1 3 348.318 2.616 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@@H]1CCC[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001390605149 1354200508 /nfs/dbraw/zinc/20/05/08/1354200508.db2.gz CVDPNFGXBNNEIH-MOPGFXCFSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@H]([NH2+]C[C@@H]1CCN(C(=O)CN2CCCC2)C1)c1ccccc1 ZINC001390606895 1354202081 /nfs/dbraw/zinc/20/20/81/1354202081.db2.gz UCOIXLUVYHWQFT-HKUYNNGSSA-N 1 3 329.488 2.672 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001390624010 1354220866 /nfs/dbraw/zinc/22/08/66/1354220866.db2.gz KXDIYPYSBCRIKN-CVEARBPZSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@H](F)CC[N@@H+](C)[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001390624047 1354221058 /nfs/dbraw/zinc/22/10/58/1354221058.db2.gz KXDIYPYSBCRIKN-HOTGVXAUSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001390624010 1354220862 /nfs/dbraw/zinc/22/08/62/1354220862.db2.gz KXDIYPYSBCRIKN-CVEARBPZSA-N 1 3 329.504 2.635 10 0 EFAEHO C[C@H](F)CC[N@H+](C)[C@H]1CCCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001390624047 1354221051 /nfs/dbraw/zinc/22/10/51/1354221051.db2.gz KXDIYPYSBCRIKN-HOTGVXAUSA-N 1 3 329.504 2.635 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@H]([N@H+](C)CCCF)C1 ZINC001390632243 1354229793 /nfs/dbraw/zinc/22/97/93/1354229793.db2.gz KAHGPCFNEJKXEI-IRXDYDNUSA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@H]([N@@H+](C)CCCF)C1 ZINC001390632243 1354229794 /nfs/dbraw/zinc/22/97/94/1354229794.db2.gz KAHGPCFNEJKXEI-IRXDYDNUSA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H](C)[NH2+]Cc1ccc(Cl)cc1C)N(C)C ZINC001390672419 1354265265 /nfs/dbraw/zinc/26/52/65/1354265265.db2.gz PXICUZRCDYCZJU-WMLDXEAASA-N 1 3 339.911 2.973 10 0 EFAEHO C[C@@H](CCNC(=O)C(C)(C)[NH+]1CCCC1)NC/C(Cl)=C/Cl ZINC001390695942 1354287913 /nfs/dbraw/zinc/28/79/13/1354287913.db2.gz LBNPFBYEHMYZSP-IXJPEXDMSA-N 1 3 336.307 2.664 10 0 EFAEHO C[C@@H](c1ccc(Cl)cc1)N(C)CCNC(=O)[C@H]1C[NH+]2CCC1CC2 ZINC001390754056 1354341669 /nfs/dbraw/zinc/34/16/69/1354341669.db2.gz FPYYRJVEVMEFTO-KSSFIOAISA-N 1 3 349.906 2.791 10 0 EFAEHO CN(CCNC(=O)C1CC[NH+](C)CC1)[C@H]1CCc2ccc(Cl)cc21 ZINC001390808335 1354394620 /nfs/dbraw/zinc/39/46/20/1354394620.db2.gz FCSCAUSMXXSUPN-SFHVURJKSA-N 1 3 349.906 2.717 10 0 EFAEHO CCc1cccc(CN(C)CCNC(=O)[C@@H]2CCC[C@@H]([NH+](C)C)C2)c1 ZINC001390849138 1354432596 /nfs/dbraw/zinc/43/25/96/1354432596.db2.gz ZMHBJKGIIMRKAZ-WOJBJXKFSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C)[C@@H]1CCc2ccc(Cl)cc21 ZINC001390865339 1354447921 /nfs/dbraw/zinc/44/79/21/1354447921.db2.gz QMEAUYVDVLRJJL-QGZVFWFLSA-N 1 3 337.895 2.716 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C)[C@@H]1CCc2ccc(Cl)cc21 ZINC001390865339 1354447924 /nfs/dbraw/zinc/44/79/24/1354447924.db2.gz QMEAUYVDVLRJJL-QGZVFWFLSA-N 1 3 337.895 2.716 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C(C)C)C[C@@H]1CCCC(F)(F)C1 ZINC001391019597 1354694401 /nfs/dbraw/zinc/69/44/01/1354694401.db2.gz IQCAYYVQAPAWOI-OAHLLOKOSA-N 1 3 333.467 2.590 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C(C)C)C[C@@H]1CCCC(F)(F)C1 ZINC001391019597 1354694407 /nfs/dbraw/zinc/69/44/07/1354694407.db2.gz IQCAYYVQAPAWOI-OAHLLOKOSA-N 1 3 333.467 2.590 10 0 EFAEHO Cc1ccccc1C[N@@H+]1CCC[C@@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001391053582 1354740322 /nfs/dbraw/zinc/74/03/22/1354740322.db2.gz GZPUAXQSJNMINU-LJQANCHMSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1ccccc1C[N@H+]1CCC[C@@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001391053582 1354740330 /nfs/dbraw/zinc/74/03/30/1354740330.db2.gz GZPUAXQSJNMINU-LJQANCHMSA-N 1 3 343.515 2.950 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@@H+]1CC1CCCC1)N1CCCC1 ZINC001391070272 1354762462 /nfs/dbraw/zinc/76/24/62/1354762462.db2.gz VGZOJEJAHGWJKE-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H]1CCC[N@H+]1CC1CCCC1)N1CCCC1 ZINC001391070272 1354762466 /nfs/dbraw/zinc/76/24/66/1354762466.db2.gz VGZOJEJAHGWJKE-OALUTQOASA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1ccc(C[N@H+]2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)c(C)c1 ZINC001391104534 1354800017 /nfs/dbraw/zinc/80/00/17/1354800017.db2.gz WRVWVTCAJACGKE-PKOBYXMFSA-N 1 3 343.515 2.583 10 0 EFAEHO Cc1ccc(C[N@@H+]2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)c(C)c1 ZINC001391104534 1354800025 /nfs/dbraw/zinc/80/00/25/1354800025.db2.gz WRVWVTCAJACGKE-PKOBYXMFSA-N 1 3 343.515 2.583 10 0 EFAEHO CN(CC(=O)N1CCCC[C@H]1C[N@H+](C)CCCF)CC(C)(C)C ZINC001397811958 1360164408 /nfs/dbraw/zinc/16/44/08/1360164408.db2.gz KXZJTYVUTOBPKZ-INIZCTEOSA-N 1 3 329.504 2.637 10 0 EFAEHO CN(CC(=O)N1CCCC[C@H]1C[N@@H+](C)CCCF)CC(C)(C)C ZINC001397811958 1360164413 /nfs/dbraw/zinc/16/44/13/1360164413.db2.gz KXZJTYVUTOBPKZ-INIZCTEOSA-N 1 3 329.504 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C1CC1)[C@H]1CCc2c1cccc2F ZINC001391202586 1354930488 /nfs/dbraw/zinc/93/04/88/1354930488.db2.gz ZZLPDFGKBVCUIP-IBGZPJMESA-N 1 3 347.478 2.734 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C1CC1)[C@H]1CCc2c1cccc2F ZINC001391202586 1354930494 /nfs/dbraw/zinc/93/04/94/1354930494.db2.gz ZZLPDFGKBVCUIP-IBGZPJMESA-N 1 3 347.478 2.734 10 0 EFAEHO Cc1cccc(C[N@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001391333202 1355087886 /nfs/dbraw/zinc/08/78/86/1355087886.db2.gz HNTFPKACCWFOTH-GOSISDBHSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1cccc(C[N@@H+]2CC[C@@H](CCNC(=O)CN(C)C(C)C)C2)c1 ZINC001391333202 1355087894 /nfs/dbraw/zinc/08/78/94/1355087894.db2.gz HNTFPKACCWFOTH-GOSISDBHSA-N 1 3 331.504 2.663 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H]1CC[N@H+](CC2CCCC2)C1 ZINC001391335523 1355089861 /nfs/dbraw/zinc/08/98/61/1355089861.db2.gz KFYYIZDPQCNARO-RBUKOAKNSA-N 1 3 335.536 2.879 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)NCC[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC001391335523 1355089864 /nfs/dbraw/zinc/08/98/64/1355089864.db2.gz KFYYIZDPQCNARO-RBUKOAKNSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@H](F)CN(C)C[C@@H]1CCN(C(=O)C2CC[NH+](C(C)C)CC2)C1 ZINC001391348639 1355106206 /nfs/dbraw/zinc/10/62/06/1355106206.db2.gz CNTXUJWXFPLVGB-WMZOPIPTSA-N 1 3 341.515 2.635 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@H+](C)CCCC(C)(C)C)C1 ZINC001391350789 1355109601 /nfs/dbraw/zinc/10/96/01/1355109601.db2.gz BLTXHHRFBGYERL-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H](C[N@@H+](C)CCCC(C)(C)C)C1 ZINC001391350789 1355109603 /nfs/dbraw/zinc/10/96/03/1355109603.db2.gz BLTXHHRFBGYERL-KRWDZBQOSA-N 1 3 325.541 2.933 10 0 EFAEHO CCN(C(=O)[C@@H](C)N1CCCCCC1)[C@H]1CC[N@H+](CC2CCC2)C1 ZINC001391657674 1355409950 /nfs/dbraw/zinc/40/99/50/1355409950.db2.gz TZADEJOCCNWALS-MJGOQNOKSA-N 1 3 335.536 2.974 10 0 EFAEHO CCN(C(=O)[C@@H](C)N1CCCCCC1)[C@H]1CC[N@@H+](CC2CCC2)C1 ZINC001391657674 1355409951 /nfs/dbraw/zinc/40/99/51/1355409951.db2.gz TZADEJOCCNWALS-MJGOQNOKSA-N 1 3 335.536 2.974 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCC[N@@H+]1C(C)C)NCc1cc(C)ccc1F ZINC001391696518 1355442414 /nfs/dbraw/zinc/44/24/14/1355442414.db2.gz SXMVLULDWFEHNJ-HKUYNNGSSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCC[N@H+]1C(C)C)NCc1cc(C)ccc1F ZINC001391696518 1355442420 /nfs/dbraw/zinc/44/24/20/1355442420.db2.gz SXMVLULDWFEHNJ-HKUYNNGSSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCC[N@@H+]1C(C)C)NCc1ncccc1C ZINC001391728152 1355472215 /nfs/dbraw/zinc/47/22/15/1355472215.db2.gz MRHHFLMQHJHDIH-IEBWSBKVSA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@H](CNC(=O)[C@H]1CCCC[N@H+]1C(C)C)NCc1ncccc1C ZINC001391728152 1355472217 /nfs/dbraw/zinc/47/22/17/1355472217.db2.gz MRHHFLMQHJHDIH-IEBWSBKVSA-N 1 3 346.519 2.637 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](CC)[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001391739950 1355484814 /nfs/dbraw/zinc/48/48/14/1355484814.db2.gz LOVFGOXBIUPDMB-PKOBYXMFSA-N 1 3 333.520 2.936 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@](C)(C[NH2+][C@H](C)c1ccccc1)C1CC1 ZINC001391799481 1355541513 /nfs/dbraw/zinc/54/15/13/1355541513.db2.gz DAOKGTMGRHPCIV-OXQOHEQNSA-N 1 3 331.504 2.962 10 0 EFAEHO COc1ccc(C[NH2+][C@H]2CC[C@H](NC(=O)CN(C)C(C)C)CC2)cc1 ZINC001391829787 1355573029 /nfs/dbraw/zinc/57/30/29/1355573029.db2.gz CRGGHJNYCAQDFQ-IYARVYRRSA-N 1 3 347.503 2.552 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCC2CCN(C/C=C/Cl)CC2)CC[N@@H+]1C ZINC001391841792 1355584823 /nfs/dbraw/zinc/58/48/23/1355584823.db2.gz BZXDDNKACHKQNO-MWXKITEQSA-N 1 3 341.927 2.688 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCC2CCN(C/C=C/Cl)CC2)CC[N@H+]1C ZINC001391841792 1355584828 /nfs/dbraw/zinc/58/48/28/1355584828.db2.gz BZXDDNKACHKQNO-MWXKITEQSA-N 1 3 341.927 2.688 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@@H+](CC[C@H](C)F)CC(C)(C)C1 ZINC001440526554 1389728612 /nfs/dbraw/zinc/72/86/12/1389728612.db2.gz FMLXYRCGTBTLFY-HOTGVXAUSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[N@H+](CC[C@H](C)F)CC(C)(C)C1 ZINC001440526554 1389728618 /nfs/dbraw/zinc/72/86/18/1389728618.db2.gz FMLXYRCGTBTLFY-HOTGVXAUSA-N 1 3 329.504 2.682 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001391933683 1355660663 /nfs/dbraw/zinc/66/06/63/1355660663.db2.gz IMEVCEJUOWLAIM-INIZCTEOSA-N 1 3 331.504 2.711 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)C[NH2+]Cc1sccc1Cl ZINC001391962137 1355684628 /nfs/dbraw/zinc/68/46/28/1355684628.db2.gz KYGQMVLNOOGQQS-GFCCVEGCSA-N 1 3 331.913 2.584 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)C[NH2+]Cc1sccc1Cl ZINC001391962139 1355684324 /nfs/dbraw/zinc/68/43/24/1355684324.db2.gz KYGQMVLNOOGQQS-LBPRGKRZSA-N 1 3 331.913 2.584 10 0 EFAEHO C[C@@H](CNCc1ccccc1F)N(C)C(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001392072600 1355749226 /nfs/dbraw/zinc/74/92/26/1355749226.db2.gz FXZYFKSDAJGNNB-RDJZCZTQSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CNCc1ccccc1F)N(C)C(=O)CC[C@@H]1CCC[N@H+]1C ZINC001392072600 1355749229 /nfs/dbraw/zinc/74/92/29/1355749229.db2.gz FXZYFKSDAJGNNB-RDJZCZTQSA-N 1 3 335.467 2.637 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1c(C)cc(C)cc1C)N(C)C ZINC001392126994 1355787771 /nfs/dbraw/zinc/78/77/71/1355787771.db2.gz USUNYZDEZHCIRC-PKOBYXMFSA-N 1 3 333.520 2.889 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(Cl)c(F)c1)N(C)C(=O)CN1CCCC1 ZINC001392136051 1355793852 /nfs/dbraw/zinc/79/38/52/1355793852.db2.gz UCPOYTBDTKCSIL-ZDUSSCGKSA-N 1 3 341.858 2.511 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]Cc1ccsc1)NC(=O)CN1CC[C@H](C)C1 ZINC001392174039 1355827808 /nfs/dbraw/zinc/82/78/08/1355827808.db2.gz WYNWMILHZRIWGQ-RDJZCZTQSA-N 1 3 337.533 2.710 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]Cc1ccsc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001392174040 1355827860 /nfs/dbraw/zinc/82/78/60/1355827860.db2.gz WYNWMILHZRIWGQ-WBVHZDCISA-N 1 3 337.533 2.710 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)cc1F ZINC001392176581 1355831109 /nfs/dbraw/zinc/83/11/09/1355831109.db2.gz FHHGAIKWDKRJKW-VQIMIIECSA-N 1 3 349.494 2.801 10 0 EFAEHO Cc1ccc(C)c(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)c1 ZINC001392185623 1355839672 /nfs/dbraw/zinc/83/96/72/1355839672.db2.gz WGALXGRSUATQDT-QUCCMNQESA-N 1 3 345.531 2.970 10 0 EFAEHO CC[C@H](F)C[N@H+](C)CCC1CCN(C(=O)[C@H]2CCCCN2C)CC1 ZINC001392195431 1355851104 /nfs/dbraw/zinc/85/11/04/1355851104.db2.gz LTISOPDTJUZLCR-ZWKOTPCHSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)CCC1CCN(C(=O)[C@H]2CCCCN2C)CC1 ZINC001392195431 1355851107 /nfs/dbraw/zinc/85/11/07/1355851107.db2.gz LTISOPDTJUZLCR-ZWKOTPCHSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]CCc1ccccc1 ZINC001392220017 1355875039 /nfs/dbraw/zinc/87/50/39/1355875039.db2.gz MENRIYJAVXCWFT-WOJBJXKFSA-N 1 3 345.531 2.832 10 0 EFAEHO CC(C)[C@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1ccccc1 ZINC001392225706 1355879122 /nfs/dbraw/zinc/87/91/22/1355879122.db2.gz YCSLAWQFJYQZJZ-RBUKOAKNSA-N 1 3 331.504 2.790 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001394368176 1357742090 /nfs/dbraw/zinc/74/20/90/1357742090.db2.gz GVSONTYBEKXRGM-GUDVDZBRSA-N 1 3 331.504 2.566 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)[C@H](C)c2ccccc2)CC[N@@H+]1C ZINC001392281073 1355936422 /nfs/dbraw/zinc/93/64/22/1355936422.db2.gz UODWYVQGMWOVIQ-NZSAHSFTSA-N 1 3 331.504 2.868 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N(C)CCN(C)[C@H](C)c2ccccc2)CC[N@H+]1C ZINC001392281073 1355936424 /nfs/dbraw/zinc/93/64/24/1355936424.db2.gz UODWYVQGMWOVIQ-NZSAHSFTSA-N 1 3 331.504 2.868 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[N@H+](C)CC[C@@H]2CCCC2(F)F)C1 ZINC001392316295 1355975482 /nfs/dbraw/zinc/97/54/82/1355975482.db2.gz VXQXZVWRMVUYPT-CVEARBPZSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[N@@H+](C)CC[C@@H]2CCCC2(F)F)C1 ZINC001392316295 1355975483 /nfs/dbraw/zinc/97/54/83/1355975483.db2.gz VXQXZVWRMVUYPT-CVEARBPZSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[N@H+](C)CC[C@H]2CCCC2(F)F)C1 ZINC001392316321 1355975560 /nfs/dbraw/zinc/97/55/60/1355975560.db2.gz VXQXZVWRMVUYPT-HZPDHXFCSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[N@@H+](C)CC[C@H]2CCCC2(F)F)C1 ZINC001392316321 1355975561 /nfs/dbraw/zinc/97/55/61/1355975561.db2.gz VXQXZVWRMVUYPT-HZPDHXFCSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[N@H+](C)CC[C@@H]2CCCC2(F)F)C1 ZINC001392316303 1355976001 /nfs/dbraw/zinc/97/60/01/1355976001.db2.gz VXQXZVWRMVUYPT-HOTGVXAUSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@H]1CCN(CC(=O)N(C)CC[N@@H+](C)CC[C@@H]2CCCC2(F)F)C1 ZINC001392316303 1355976005 /nfs/dbraw/zinc/97/60/05/1355976005.db2.gz VXQXZVWRMVUYPT-HOTGVXAUSA-N 1 3 345.478 2.544 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2Cc2ccccc2F)C1 ZINC001392340685 1356007469 /nfs/dbraw/zinc/00/74/69/1356007469.db2.gz GIKIPCQNPPECTQ-PKOBYXMFSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2Cc2ccccc2F)C1 ZINC001392340685 1356007474 /nfs/dbraw/zinc/00/74/74/1356007474.db2.gz GIKIPCQNPPECTQ-PKOBYXMFSA-N 1 3 347.478 2.589 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C3CCC3)C2)cs1 ZINC001394375015 1357747565 /nfs/dbraw/zinc/74/75/65/1357747565.db2.gz LQXXAFZEUXYFJA-KOMQPUFPSA-N 1 3 335.517 2.525 10 0 EFAEHO CCN(CC[NH2+][C@@H]1CCc2ccccc21)C(=O)[C@@H](C(C)C)N(C)C ZINC001392452440 1356048008 /nfs/dbraw/zinc/04/80/08/1356048008.db2.gz HOIRGIYNYXPJGM-RTBURBONSA-N 1 3 331.504 2.698 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@H]2CCC[N@@H+]2C(C)C)c1 ZINC001392564635 1356123515 /nfs/dbraw/zinc/12/35/15/1356123515.db2.gz IORSMBCUCWLUNE-MAUKXSAKSA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@H]2CCC[N@H+]2C(C)C)c1 ZINC001392564635 1356123516 /nfs/dbraw/zinc/12/35/16/1356123516.db2.gz IORSMBCUCWLUNE-MAUKXSAKSA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCN2C(C)C)c1 ZINC001392564959 1356123560 /nfs/dbraw/zinc/12/35/60/1356123560.db2.gz VGYQKFUHJYVASQ-HKUYNNGSSA-N 1 3 331.504 2.771 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@@H]2CCCCN2C(C)C)c(C)n1 ZINC001392595220 1356146923 /nfs/dbraw/zinc/14/69/23/1356146923.db2.gz LLQMVLTYGPYNAZ-LPHOPBHVSA-N 1 3 346.519 2.556 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@H](C)NC(=O)[C@H]2CCCCN2C(C)C)c(C)n1 ZINC001392595249 1356147220 /nfs/dbraw/zinc/14/72/20/1356147220.db2.gz LLQMVLTYGPYNAZ-QFBILLFUSA-N 1 3 346.519 2.556 10 0 EFAEHO C[C@H](CN(C)[C@H](C)c1ccc(F)c(Cl)c1)NC(=O)CC[NH+](C)C ZINC001392685874 1356235044 /nfs/dbraw/zinc/23/50/44/1356235044.db2.gz KILQHRBARRXKKY-CHWSQXEVSA-N 1 3 343.874 2.928 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@H+](C)Cc1cccc2cccnc21)N(C)C ZINC001392716092 1356270578 /nfs/dbraw/zinc/27/05/78/1356270578.db2.gz FNXOKJKKNYXTGV-MAUKXSAKSA-N 1 3 342.487 2.512 10 0 EFAEHO CC[C@H](C(=O)N[C@@H](C)C[N@@H+](C)Cc1cccc2cccnc21)N(C)C ZINC001392716092 1356270580 /nfs/dbraw/zinc/27/05/80/1356270580.db2.gz FNXOKJKKNYXTGV-MAUKXSAKSA-N 1 3 342.487 2.512 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@H+](C)Cc1cccc2cccnc21)N(C)C ZINC001392716091 1356270594 /nfs/dbraw/zinc/27/05/94/1356270594.db2.gz FNXOKJKKNYXTGV-CRAIPNDOSA-N 1 3 342.487 2.512 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[N@@H+](C)Cc1cccc2cccnc21)N(C)C ZINC001392716091 1356270597 /nfs/dbraw/zinc/27/05/97/1356270597.db2.gz FNXOKJKKNYXTGV-CRAIPNDOSA-N 1 3 342.487 2.512 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001392728603 1356287303 /nfs/dbraw/zinc/28/73/03/1356287303.db2.gz NRDBKIBLJMVGIQ-ROUUACIJSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[N@@H+](C)C[C@H]1CCc2ccccc2C1 ZINC001392728603 1356287304 /nfs/dbraw/zinc/28/73/04/1356287304.db2.gz NRDBKIBLJMVGIQ-ROUUACIJSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001392728595 1356287430 /nfs/dbraw/zinc/28/74/30/1356287430.db2.gz NRDBKIBLJMVGIQ-QZTJIDSGSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC001392728595 1356287433 /nfs/dbraw/zinc/28/74/33/1356287433.db2.gz NRDBKIBLJMVGIQ-QZTJIDSGSA-N 1 3 345.531 2.568 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1)C1CC1 ZINC001392796438 1356333861 /nfs/dbraw/zinc/33/38/61/1356333861.db2.gz COAFQNDEDRJTHK-KBXCAEBGSA-N 1 3 335.467 2.711 10 0 EFAEHO CC[C@H](F)C[N@H+](C)C[C@@H](C)NC(=O)c1sccc1CN(C)C ZINC001401755964 1363090339 /nfs/dbraw/zinc/09/03/39/1363090339.db2.gz KTMUINOSGYWGNN-OCCSQVGLSA-N 1 3 329.485 2.608 10 0 EFAEHO CC[C@H](F)C[N@@H+](C)C[C@@H](C)NC(=O)c1sccc1CN(C)C ZINC001401755964 1363090341 /nfs/dbraw/zinc/09/03/41/1363090341.db2.gz KTMUINOSGYWGNN-OCCSQVGLSA-N 1 3 329.485 2.608 10 0 EFAEHO Cc1ccccc1C[NH2+]C1(CNC(=O)CN2[C@@H](C)CC[C@@H]2C)CC1 ZINC001392960442 1356467955 /nfs/dbraw/zinc/46/79/55/1356467955.db2.gz KIWMPZBRIMYFFP-IRXDYDNUSA-N 1 3 329.488 2.606 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@H+](C/C=C\Cl)C1 ZINC001392965082 1356471546 /nfs/dbraw/zinc/47/15/46/1356471546.db2.gz WXHZPBKFBHJKPY-REEAJDFCSA-N 1 3 341.927 2.784 10 0 EFAEHO CCCN(C)CC(=O)N1CCCC[C@@H]1[C@@H]1CC[N@@H+](C/C=C\Cl)C1 ZINC001392965082 1356471549 /nfs/dbraw/zinc/47/15/49/1356471549.db2.gz WXHZPBKFBHJKPY-REEAJDFCSA-N 1 3 341.927 2.784 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H]2CCCN2C(=O)CN(C)C(C)C)c(C)s1 ZINC001393053214 1356540964 /nfs/dbraw/zinc/54/09/64/1356540964.db2.gz LILIZXYMPFJMMA-QGZVFWFLSA-N 1 3 337.533 2.786 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CCCN2C(=O)CN(C)C(C)C)cc1C ZINC001402070591 1363376579 /nfs/dbraw/zinc/37/65/79/1363376579.db2.gz FOLDFPLNMIABPM-IBGZPJMESA-N 1 3 331.504 2.724 10 0 EFAEHO Cc1cccc(C[N@H+]2CCCC3(CN(C(=O)CN(C)C(C)C)C3)C2)c1 ZINC001394352194 1357726515 /nfs/dbraw/zinc/72/65/15/1357726515.db2.gz XSEFMXBDYVTDGG-UHFFFAOYSA-N 1 3 343.515 2.760 10 0 EFAEHO Cc1cccc(C[N@@H+]2CCCC3(CN(C(=O)CN(C)C(C)C)C3)C2)c1 ZINC001394352194 1357726519 /nfs/dbraw/zinc/72/65/19/1357726519.db2.gz XSEFMXBDYVTDGG-UHFFFAOYSA-N 1 3 343.515 2.760 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@](C)(C[NH2+]Cc2cc(C)ccc2F)C1)N(C)C ZINC001393161729 1356667232 /nfs/dbraw/zinc/66/72/32/1356667232.db2.gz MEEGVROFHDTUSL-UYAOXDASSA-N 1 3 349.494 2.803 10 0 EFAEHO CC(C)CC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001393222852 1356734876 /nfs/dbraw/zinc/73/48/76/1356734876.db2.gz ASWXZBDOOCWFKK-HNNXBMFYSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)CC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)C2(N(C)C)CCC2)C1 ZINC001393222852 1356734881 /nfs/dbraw/zinc/73/48/81/1356734881.db2.gz ASWXZBDOOCWFKK-HNNXBMFYSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)CC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001393246705 1356749161 /nfs/dbraw/zinc/74/91/61/1356749161.db2.gz ZWAYUESJJPDBRZ-JKSUJKDBSA-N 1 3 347.494 2.692 10 0 EFAEHO CC(C)CC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001393246705 1356749167 /nfs/dbraw/zinc/74/91/67/1356749167.db2.gz ZWAYUESJJPDBRZ-JKSUJKDBSA-N 1 3 347.494 2.692 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@H]([NH2+]Cc2cccc(Cl)c2)C2CC2)C1 ZINC001402326948 1363607842 /nfs/dbraw/zinc/60/78/42/1363607842.db2.gz PLEADTBKBUUTDX-KSSFIOAISA-N 1 3 349.906 2.666 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@H](C[NH2+]Cc2cccc(C)c2)C1 ZINC001393397187 1356816593 /nfs/dbraw/zinc/81/65/93/1356816593.db2.gz LRYCNLUBZWUXHT-PKOBYXMFSA-N 1 3 331.504 2.521 10 0 EFAEHO CC(C)C[C@H](C)C[NH+]1CCC2(CN(C(=O)CN(C)C(C)C)C2)CC1 ZINC001393504002 1356905547 /nfs/dbraw/zinc/90/55/47/1356905547.db2.gz XDNDALZFUQNCKZ-SFHVURJKSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@H](C)CC(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CC2CC2)CC1 ZINC001393653202 1357052871 /nfs/dbraw/zinc/05/28/71/1357052871.db2.gz XALVDQNNEKNCFU-FFZOFVMBSA-N 1 3 347.547 2.972 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@H](C[NH2+]CC1CC(C)(C)C1)C1CC1)N(C)C ZINC001394434160 1357814397 /nfs/dbraw/zinc/81/43/97/1357814397.db2.gz ZOAVGYXYPSJPTA-MSOLQXFVSA-N 1 3 337.552 2.835 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C[NH2+][C@@H](C)c1ccccc1)C1CC1 ZINC001394437935 1357817654 /nfs/dbraw/zinc/81/76/54/1357817654.db2.gz CNLRZDFEWYWCOG-LPHOPBHVSA-N 1 3 331.504 2.914 10 0 EFAEHO CC[C@H](C(=O)N(C)C[C@H](C)[NH2+]Cc1ccc(Cl)c(F)c1)N(C)C ZINC001394534187 1357918978 /nfs/dbraw/zinc/91/89/78/1357918978.db2.gz DFBLUFZWXKZHTH-BLLLJJGKSA-N 1 3 343.874 2.756 10 0 EFAEHO CCCN(C)CC(=O)N(C)C[C@H](C)[NH2+]C[C@@H]1CCc2ccccc2C1 ZINC001394538713 1357925136 /nfs/dbraw/zinc/92/51/36/1357925136.db2.gz IJMCYHMGXUBHOW-ZWKOTPCHSA-N 1 3 345.531 2.570 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]CC2CCC3(CC3)CC2)[C@H]1C ZINC001394675851 1357994026 /nfs/dbraw/zinc/99/40/26/1357994026.db2.gz KSSWDMQRRNOALG-SJLPKXTDSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc(CF)cc2)C[C@H]1C ZINC001394677812 1357995930 /nfs/dbraw/zinc/99/59/30/1357995930.db2.gz HRZCCKIYUNGJJB-QAPCUYQASA-N 1 3 335.467 2.575 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc(CF)cc2)C[C@@H]1C ZINC001394677818 1357996585 /nfs/dbraw/zinc/99/65/85/1357996585.db2.gz HRZCCKIYUNGJJB-YJBOKZPZSA-N 1 3 335.467 2.575 10 0 EFAEHO CC[C@H](F)CN1CC[C@@]2(NC(=O)CC[NH+]3CCCCC3)CCC[C@H]12 ZINC001394684887 1358003782 /nfs/dbraw/zinc/00/37/82/1358003782.db2.gz HOFKFPQDINBXNL-LNLFQRSKSA-N 1 3 339.499 2.724 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc3cc[nH]c3c2)C[C@@H]1C ZINC001394689524 1358011766 /nfs/dbraw/zinc/01/17/66/1358011766.db2.gz YBCDDCQEIFMCLV-MAUKXSAKSA-N 1 3 342.487 2.587 10 0 EFAEHO CC(C)[NH2+][C@@H](CCNC(=O)C1(N(C)C)CCC1)Cc1ccccc1 ZINC001394696191 1358020409 /nfs/dbraw/zinc/02/04/09/1358020409.db2.gz MGMVIFWYTLGNSM-SFHVURJKSA-N 1 3 331.504 2.586 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)CCN(C(=O)[C@@H]1CCCN1C)C(C)C ZINC001394800777 1358084867 /nfs/dbraw/zinc/08/48/67/1358084867.db2.gz GSWVMWXVZXSPAZ-MSOLQXFVSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)CCN(C(=O)[C@@H]1CCCN1C)C(C)C ZINC001394800777 1358084870 /nfs/dbraw/zinc/08/48/70/1358084870.db2.gz GSWVMWXVZXSPAZ-MSOLQXFVSA-N 1 3 325.541 2.932 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H](C[NH2+]Cc1ccsc1)C(C)(C)C)N(C)C ZINC001394837643 1358139282 /nfs/dbraw/zinc/13/92/82/1358139282.db2.gz TVPYVKHGLUXHJS-HOTGVXAUSA-N 1 3 339.549 2.955 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H](C[NH2+]Cc1ccsc1)C(C)(C)C)N(C)C ZINC001394837642 1358139512 /nfs/dbraw/zinc/13/95/12/1358139512.db2.gz TVPYVKHGLUXHJS-CVEARBPZSA-N 1 3 339.549 2.955 10 0 EFAEHO CCC(CC)C[NH+]1CCC([C@@H](C)NC(=O)[C@H](CC)N(C)C)CC1 ZINC001394841092 1358143194 /nfs/dbraw/zinc/14/31/94/1358143194.db2.gz QXGFHGOAGAEBRJ-QAPCUYQASA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)C1CC[NH+](CC2CC(F)(F)C2)CC1)N(C)C ZINC001394843058 1358146744 /nfs/dbraw/zinc/14/67/44/1358146744.db2.gz CFRHEOMDSKENNR-BBRMVZONSA-N 1 3 345.478 2.589 10 0 EFAEHO C[C@H](NC(=O)C1(N(C)C)CCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC001394844027 1358147746 /nfs/dbraw/zinc/14/77/46/1358147746.db2.gz MNOSARMOVHNNJX-KRWDZBQOSA-N 1 3 343.515 2.888 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(F)cc32)C1)C1CCC1 ZINC001436952364 1387343661 /nfs/dbraw/zinc/34/36/61/1387343661.db2.gz IPXQUOSVFLEXCC-FCEWJHQRSA-N 1 3 345.462 2.534 10 0 EFAEHO C[C@@H](F)CCN1CC[C@@H]1CN(C)C(=O)C1(C[NH+](C)C)CCCCC1 ZINC001397001282 1359605416 /nfs/dbraw/zinc/60/54/16/1359605416.db2.gz UYVPNOXYBLUNID-IAGOWNOFSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@@H](N[C@H]1C[C@@H](CNC(=O)C[C@@H]2CC[N@H+](C)C2)C1)c1ccccc1F ZINC001397094531 1359671630 /nfs/dbraw/zinc/67/16/30/1359671630.db2.gz HPKLXCSHJPTPLT-TWMKSMIVSA-N 1 3 347.478 2.713 10 0 EFAEHO C[C@@H](N[C@H]1C[C@@H](CNC(=O)C[C@@H]2CC[N@@H+](C)C2)C1)c1ccccc1F ZINC001397094531 1359671635 /nfs/dbraw/zinc/67/16/35/1359671635.db2.gz HPKLXCSHJPTPLT-TWMKSMIVSA-N 1 3 347.478 2.713 10 0 EFAEHO CN(CC(=O)NC[C@H]1C[C@H]([NH2+]Cc2ccsc2)C1)CC(C)(C)C ZINC001397127730 1359691201 /nfs/dbraw/zinc/69/12/01/1359691201.db2.gz FHHYRMXQVCUBRH-WKILWMFISA-N 1 3 337.533 2.710 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1C[C@@H]([NH2+]CC2CCC(C)CC2)C1)N(C)C ZINC001397128884 1359691916 /nfs/dbraw/zinc/69/19/16/1359691916.db2.gz BHJAUBKUDARTLZ-CPLYBDICSA-N 1 3 337.552 2.883 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@H+](CC2CCC2)CC(C)(C)C1)N(C)C ZINC001397265924 1359798369 /nfs/dbraw/zinc/79/83/69/1359798369.db2.gz ACHRSMAPWAOBLJ-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@@H]1CC[N@@H+](CC2CCC2)CC(C)(C)C1)N(C)C ZINC001397265924 1359798371 /nfs/dbraw/zinc/79/83/71/1359798371.db2.gz ACHRSMAPWAOBLJ-MSOLQXFVSA-N 1 3 337.552 2.980 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[N@H+](C/C=C\Cl)CC(C)(C)C1)C1CCC1 ZINC001397265966 1359798795 /nfs/dbraw/zinc/79/87/95/1359798795.db2.gz AFEHSHXCDOZERB-HMZQOCAUSA-N 1 3 341.927 2.830 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[N@@H+](C/C=C\Cl)CC(C)(C)C1)C1CCC1 ZINC001397265966 1359798799 /nfs/dbraw/zinc/79/87/99/1359798799.db2.gz AFEHSHXCDOZERB-HMZQOCAUSA-N 1 3 341.927 2.830 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CCC[N@@H+]1C1CCCC1)NCc1ccsc1 ZINC001437149579 1387423728 /nfs/dbraw/zinc/42/37/28/1387423728.db2.gz SCCPOVXMGHPWKJ-WMLDXEAASA-N 1 3 335.517 2.749 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CCC[N@H+]1C1CCCC1)NCc1ccsc1 ZINC001437149579 1387423730 /nfs/dbraw/zinc/42/37/30/1387423730.db2.gz SCCPOVXMGHPWKJ-WMLDXEAASA-N 1 3 335.517 2.749 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@H]1C[C@@H](CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001397619332 1360007702 /nfs/dbraw/zinc/00/77/02/1360007702.db2.gz WWKKQJMVQULIDK-NXHRZFHOSA-N 1 3 335.467 2.594 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CCCCC2)C1 ZINC001397620215 1360008285 /nfs/dbraw/zinc/00/82/85/1360008285.db2.gz ZRBCYKPKYDWNTC-AMBYYYRHSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1C[C@@H]([NH2+]CC2CCCCC2)C1 ZINC001397620221 1360008482 /nfs/dbraw/zinc/00/84/82/1360008482.db2.gz ZRBCYKPKYDWNTC-RWQQGDIJSA-N 1 3 335.536 2.924 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1CC[C@@H]([NH2+]C/C=C/Cl)C1)N1CCCCC1 ZINC001397678603 1360044076 /nfs/dbraw/zinc/04/40/76/1360044076.db2.gz JOYJSVKLUAYXAT-VKFONMJVSA-N 1 3 341.927 2.878 10 0 EFAEHO CCCN(C)CC(=O)N1CCCCC[C@H]([NH2+]Cc2ncccc2C)C1 ZINC001397765965 1360117595 /nfs/dbraw/zinc/11/75/95/1360117595.db2.gz GIHQUWKEXNZHHY-SFHVURJKSA-N 1 3 346.519 2.593 10 0 EFAEHO CCC[N@@H+]1CC[C@@H](NC(=O)CN(C)CC(C)(C)C)CC(C)(C)C1 ZINC001397810105 1360162453 /nfs/dbraw/zinc/16/24/53/1360162453.db2.gz MHBDZYLPZHQOEP-MRXNPFEDSA-N 1 3 325.541 2.981 10 0 EFAEHO CCC[N@H+]1CC[C@@H](NC(=O)CN(C)CC(C)(C)C)CC(C)(C)C1 ZINC001397810105 1360162456 /nfs/dbraw/zinc/16/24/56/1360162456.db2.gz MHBDZYLPZHQOEP-MRXNPFEDSA-N 1 3 325.541 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](C/C=C\Cl)CC(C)(C)C1 ZINC001397817411 1360170098 /nfs/dbraw/zinc/17/00/98/1360170098.db2.gz VISHKJUTPRCYPQ-DDJMYBDESA-N 1 3 329.916 2.686 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](C/C=C\Cl)CC(C)(C)C1 ZINC001397817411 1360170099 /nfs/dbraw/zinc/17/00/99/1360170099.db2.gz VISHKJUTPRCYPQ-DDJMYBDESA-N 1 3 329.916 2.686 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)[NH+]1CCCC1)NCc1ccccc1Cl ZINC001437181499 1387445446 /nfs/dbraw/zinc/44/54/46/1387445446.db2.gz AYWTUTRLBMOHNO-CQSZACIVSA-N 1 3 337.895 2.809 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC001437197541 1387457251 /nfs/dbraw/zinc/45/72/51/1387457251.db2.gz AATFMFVTCZSSKZ-UZLBHIALSA-N 1 3 349.494 2.802 10 0 EFAEHO C[C@H](C(=O)NC[C@@H]([NH2+]CC1CCCC1)C1CC1)N1CCCCCC1 ZINC001398438260 1360556736 /nfs/dbraw/zinc/55/67/36/1360556736.db2.gz GJQSPZMNNOILLS-VQIMIIECSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@@H](C)CNC(=O)CN1CC[C@@H](C)C1 ZINC001437204928 1387465335 /nfs/dbraw/zinc/46/53/35/1387465335.db2.gz KOVGTPBBBOTTMK-HIFRSBDPSA-N 1 3 337.895 2.585 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)CC[C@@H]21 ZINC001398587431 1360659449 /nfs/dbraw/zinc/65/94/49/1360659449.db2.gz QVRZGKRWQREYNN-ROUUACIJSA-N 1 3 349.544 2.903 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)CC[C@@H]21 ZINC001398587431 1360659451 /nfs/dbraw/zinc/65/94/51/1360659451.db2.gz QVRZGKRWQREYNN-ROUUACIJSA-N 1 3 349.544 2.903 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@@H]2CN(Cc3cccc(F)c3)CC[C@H]21 ZINC001398596461 1360663781 /nfs/dbraw/zinc/66/37/81/1360663781.db2.gz SVMCQGGTOJFKDY-IEBWSBKVSA-N 1 3 347.478 2.590 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+][C@H]3CCCc4ccccc43)C2)CCC1 ZINC001398631369 1360679422 /nfs/dbraw/zinc/67/94/22/1360679422.db2.gz XTWPCEWEIKUGLR-SCTDSRPQSA-N 1 3 341.499 2.785 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H]1C[C@@H](NC(=O)CN(C)CC(C)(C)C)C1 ZINC001398631825 1360680162 /nfs/dbraw/zinc/68/01/62/1360680162.db2.gz XOGWHTFGGLKPRH-HDICACEKSA-N 1 3 331.504 2.710 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2c(C)cccc2Cl)C1 ZINC001398653879 1360691481 /nfs/dbraw/zinc/69/14/81/1360691481.db2.gz LAAUOLBJUBVWHL-GASCZTMLSA-N 1 3 337.895 2.727 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](NCc2c(C)cccc2Cl)C1 ZINC001398653879 1360691485 /nfs/dbraw/zinc/69/14/85/1360691485.db2.gz LAAUOLBJUBVWHL-GASCZTMLSA-N 1 3 337.895 2.727 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001398665379 1360696973 /nfs/dbraw/zinc/69/69/73/1360696973.db2.gz LCJCKELALIHNSO-KDURUIRLSA-N 1 3 329.488 2.641 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CCC[N@H+](CC2CCC2)C1)N1CCCCCC1 ZINC001398667988 1360699137 /nfs/dbraw/zinc/69/91/37/1360699137.db2.gz GRADDUSPNZCEMZ-IEBWSBKVSA-N 1 3 335.536 2.879 10 0 EFAEHO C[C@H](C(=O)NC[C@H]1CCC[N@@H+](CC2CCC2)C1)N1CCCCCC1 ZINC001398667988 1360699142 /nfs/dbraw/zinc/69/91/42/1360699142.db2.gz GRADDUSPNZCEMZ-IEBWSBKVSA-N 1 3 335.536 2.879 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@@H]([NH2+]Cc2cccc(Cl)c2F)C1 ZINC001398668502 1360700442 /nfs/dbraw/zinc/70/04/42/1360700442.db2.gz QZPWNGGOVPNVRU-OKILXGFUSA-N 1 3 341.858 2.556 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@@H](CC)c2ccc(F)cc2)C1 ZINC001398675030 1360705445 /nfs/dbraw/zinc/70/54/45/1360705445.db2.gz WSCJFPVEDYGKGF-KSZLIROESA-N 1 3 335.467 2.855 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[NH2+][C@@H](C)c2ccccc2)C1 ZINC001398734616 1360750893 /nfs/dbraw/zinc/75/08/93/1360750893.db2.gz PFNVQNYIKJOOBJ-ZWKOTPCHSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)C[C@H](C)C[NH2+]C[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001398738944 1360754788 /nfs/dbraw/zinc/75/47/88/1360754788.db2.gz RXUPHRQYESVAMQ-ROUUACIJSA-N 1 3 325.541 2.837 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)NC[C@H](C)[NH2+]CCc1cccs1 ZINC001437212879 1387473751 /nfs/dbraw/zinc/47/37/51/1387473751.db2.gz HHBUPHIHBIESHW-RDJZCZTQSA-N 1 3 337.533 2.648 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC001398788053 1360791680 /nfs/dbraw/zinc/79/16/80/1360791680.db2.gz FJAZPTHVOGDGFH-SJLPKXTDSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC001398788053 1360791690 /nfs/dbraw/zinc/79/16/90/1360791690.db2.gz FJAZPTHVOGDGFH-SJLPKXTDSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H]1CCC[N@H+](Cc2ccccc2F)C1 ZINC001398799252 1360801031 /nfs/dbraw/zinc/80/10/31/1360801031.db2.gz UMSOYZOPBCYVNN-SJORKVTESA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)[C@H]1CCC[N@@H+](Cc2ccccc2F)C1 ZINC001398799252 1360801037 /nfs/dbraw/zinc/80/10/37/1360801037.db2.gz UMSOYZOPBCYVNN-SJORKVTESA-N 1 3 349.494 2.883 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)NCc2cc3ccccc3o2)CC[N@@H+]1C ZINC001398914582 1360871345 /nfs/dbraw/zinc/87/13/45/1360871345.db2.gz GEGXOZFUYJZVIX-FHLIZLRMSA-N 1 3 343.471 2.757 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)NCc2cc3ccccc3o2)CC[N@H+]1C ZINC001398914582 1360871348 /nfs/dbraw/zinc/87/13/48/1360871348.db2.gz GEGXOZFUYJZVIX-FHLIZLRMSA-N 1 3 343.471 2.757 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)[C@@H](C(C)C)[NH+]1CCCC1 ZINC001492878257 1360905801 /nfs/dbraw/zinc/90/58/01/1360905801.db2.gz HMHHDQRDKFSWBS-HXUWFJFHSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NC[C@@H](C)[NH2+]CC1CC2(CCC2)C1 ZINC001399081943 1360978664 /nfs/dbraw/zinc/97/86/64/1360978664.db2.gz AZSGDUYWSXCCEJ-SJLPKXTDSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@H](C(=O)NC[C@H](C)[NH2+]CC1CC2(CCC2)C1)N1CCCCCC1 ZINC001399106130 1360997868 /nfs/dbraw/zinc/99/78/68/1360997868.db2.gz PVRKIPYRXHZBSP-DLBZAZTESA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1ccc(CN[C@@H](C)CNC(=O)[C@H](C(C)C)[NH+](C)C)c(Cl)c1 ZINC001399114916 1361004897 /nfs/dbraw/zinc/00/48/97/1361004897.db2.gz SUCHKUBQSLZZMW-YOEHRIQHSA-N 1 3 339.911 2.829 10 0 EFAEHO C[C@@H](CCNC(=O)CN(C)CC(C)(C)C)[NH2+]CC1CC(C)(C)C1 ZINC001399384062 1361185811 /nfs/dbraw/zinc/18/58/11/1361185811.db2.gz BERLYKPLRNHYJO-HNNXBMFYSA-N 1 3 325.541 2.885 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H](C)[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001399417566 1361209044 /nfs/dbraw/zinc/20/90/44/1361209044.db2.gz RAXLGONIVKRPMA-UKRRQHHQSA-N 1 3 333.467 2.637 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H](C)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001399420201 1361210914 /nfs/dbraw/zinc/21/09/14/1361210914.db2.gz PXDUGDRTQAAOGD-OCCSQVGLSA-N 1 3 342.434 2.571 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(C)CCNC(=O)C12CCC[NH+](CCC1)C2 ZINC001399498978 1361280941 /nfs/dbraw/zinc/28/09/41/1361280941.db2.gz HRDWHNGDZJIRNM-MRXNPFEDSA-N 1 3 347.478 2.811 10 0 EFAEHO CN(CCNC(=O)C(C)(C)[NH+]1CCCC1)[C@@H]1CCc2c1cccc2F ZINC001399562579 1361333583 /nfs/dbraw/zinc/33/35/83/1361333583.db2.gz VNFCQXCFQHQJJX-GOSISDBHSA-N 1 3 347.478 2.735 10 0 EFAEHO CN(CCNC(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1)CCc1ccccc1F ZINC001399637726 1361392420 /nfs/dbraw/zinc/39/24/20/1361392420.db2.gz GBECAJTWVRKEMM-MSOLQXFVSA-N 1 3 349.494 2.537 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H](C(C)C)[NH+]2CCCC2)c(C)c1 ZINC001399656045 1361408620 /nfs/dbraw/zinc/40/86/20/1361408620.db2.gz QMEOWDXSHSKBOQ-FQEVSTJZSA-N 1 3 345.531 2.972 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]CCc1ccc2ccccc2c1 ZINC001437261685 1387514335 /nfs/dbraw/zinc/51/43/35/1387514335.db2.gz LJLVOGZBAHKXTQ-QGZVFWFLSA-N 1 3 341.499 2.817 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CNC(=O)[C@@H](C(C)C)[NH+]2CCCC2)c1 ZINC001437263960 1387516094 /nfs/dbraw/zinc/51/60/94/1387516094.db2.gz JYODWDALNNYJRE-QFBILLFUSA-N 1 3 349.494 2.849 10 0 EFAEHO CCN(CCNC(=O)CC[NH+](C)C)Cc1cccc(C(F)(F)F)c1 ZINC001399747904 1361475829 /nfs/dbraw/zinc/47/58/29/1361475829.db2.gz CWUQQCJEAZGDEU-UHFFFAOYSA-N 1 3 345.409 2.595 10 0 EFAEHO CCCN(CCNC(=O)C12CC[NH+](CC1)C2)Cc1cccc(Cl)c1 ZINC001399967981 1361619984 /nfs/dbraw/zinc/61/99/84/1361619984.db2.gz AAVIRBGQLFDKLA-UHFFFAOYSA-N 1 3 349.906 2.764 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(Cc2cccc(C)c2)C2CC2)CC[N@@H+]1C ZINC001400006205 1361659120 /nfs/dbraw/zinc/65/91/20/1361659120.db2.gz PMPVNYUREGYTAB-VQTJNVASSA-N 1 3 343.515 2.806 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(Cc2cccc(C)c2)C2CC2)CC[N@H+]1C ZINC001400006205 1361659124 /nfs/dbraw/zinc/65/91/24/1361659124.db2.gz PMPVNYUREGYTAB-VQTJNVASSA-N 1 3 343.515 2.806 10 0 EFAEHO CC[C@@H]([NH2+]CCN(C)C(=O)CN1CCCC1)c1ccc(Cl)cc1 ZINC001400080319 1361719454 /nfs/dbraw/zinc/71/94/54/1361719454.db2.gz GIZFBJDEOAEXDC-QGZVFWFLSA-N 1 3 337.895 2.935 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@H+](CCc2ccc(C)cc2)C1)N(C)C ZINC001400194363 1361835159 /nfs/dbraw/zinc/83/51/59/1361835159.db2.gz WPZITCOCCXCYRP-WOJBJXKFSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@H](C(=O)NCC[C@@H]1CC[N@@H+](CCc2ccc(C)cc2)C1)N(C)C ZINC001400194363 1361835164 /nfs/dbraw/zinc/83/51/64/1361835164.db2.gz WPZITCOCCXCYRP-WOJBJXKFSA-N 1 3 345.531 2.706 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@H+](C)CCCc2ccccc2)C1 ZINC001400247126 1361882133 /nfs/dbraw/zinc/88/21/33/1361882133.db2.gz ILIITEJHBOFCSR-HXUWFJFHSA-N 1 3 345.531 2.740 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@@H+](C)CCCc2ccccc2)C1 ZINC001400247126 1361882135 /nfs/dbraw/zinc/88/21/35/1361882135.db2.gz ILIITEJHBOFCSR-HXUWFJFHSA-N 1 3 345.531 2.740 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1C[NH+](CCCC2CCCC2)C1 ZINC001400570324 1362028599 /nfs/dbraw/zinc/02/85/99/1362028599.db2.gz IWNKKSRAPFQDMX-IRXDYDNUSA-N 1 3 335.536 2.878 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+]C[C@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001437334927 1387557834 /nfs/dbraw/zinc/55/78/34/1387557834.db2.gz WZIGUKUKVMHGHT-ZWKOTPCHSA-N 1 3 331.504 2.834 10 0 EFAEHO CC[C@H](C(=O)NC[C@H](CC)[NH2+]CC1CCC(F)(F)CC1)N(C)C ZINC001400825603 1362189009 /nfs/dbraw/zinc/18/90/09/1362189009.db2.gz JTPLEUITDKUWOZ-LSDHHAIUSA-N 1 3 333.467 2.637 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC001400923034 1362264362 /nfs/dbraw/zinc/26/43/62/1362264362.db2.gz QJTGOHCVYAUVMH-UKRRQHHQSA-N 1 3 341.446 2.850 10 0 EFAEHO Cc1cc(CN(C)[C@H]2CCCN(C(=O)CC[NH+](C)C)C2)c(C)s1 ZINC001437346904 1387568851 /nfs/dbraw/zinc/56/88/51/1387568851.db2.gz IINCWRFDFTXQJX-KRWDZBQOSA-N 1 3 337.533 2.739 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@]1(C[NH2+]Cc2ccccn2)CCCC[C@@H]1C ZINC001401040456 1362389665 /nfs/dbraw/zinc/38/96/65/1362389665.db2.gz DFSHEMACIUALRX-PXNSSMCTSA-N 1 3 346.519 2.577 10 0 EFAEHO Cc1cc(CN(C)[C@@H]2CCCN(C(=O)CC[NH+](C)C)C2)c(C)s1 ZINC001437346907 1387569219 /nfs/dbraw/zinc/56/92/19/1387569219.db2.gz IINCWRFDFTXQJX-QGZVFWFLSA-N 1 3 337.533 2.739 10 0 EFAEHO CCc1ccc(CN2CC3(C2)CCN(C(=O)CC[NH+](C)C)CC3)cc1 ZINC001401193073 1362533588 /nfs/dbraw/zinc/53/35/88/1362533588.db2.gz IKRGTMPLGGPNRG-UHFFFAOYSA-N 1 3 343.515 2.625 10 0 EFAEHO C[C@H](C[NH2+]CC1CCCC1)N(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001401247594 1362586868 /nfs/dbraw/zinc/58/68/68/1362586868.db2.gz QAAGJYCYIXOGJE-BEFAXECRSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@H]([NH2+]C[C@@H](C)N(C)C(=O)CN1CCCC1)c1ccc(F)cc1 ZINC001401257285 1362597152 /nfs/dbraw/zinc/59/71/52/1362597152.db2.gz KLUIEBJHEJYZCI-QAPCUYQASA-N 1 3 335.467 2.809 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]CC1CC1)NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001401275377 1362619542 /nfs/dbraw/zinc/61/95/42/1362619542.db2.gz VZJLLIDRYFYBBX-QFBILLFUSA-N 1 3 341.515 2.729 10 0 EFAEHO Cc1cc(C[NH2+][C@H]2CCN(C(=O)CN(C)C(C)C)C[C@H]2C)cs1 ZINC001401299572 1362645970 /nfs/dbraw/zinc/64/59/70/1362645970.db2.gz NNSVMZJRYZFISP-PBHICJAKSA-N 1 3 337.533 2.723 10 0 EFAEHO CC[C@@H](F)C[N@H+](C)CCC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001401305800 1362652021 /nfs/dbraw/zinc/65/20/21/1362652021.db2.gz MKFXFSZXINOPOH-QGZVFWFLSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[C@@H](F)C[N@@H+](C)CCC1CCN(C(=O)C2(N(C)C)CCC2)CC1 ZINC001401305800 1362652023 /nfs/dbraw/zinc/65/20/23/1362652023.db2.gz MKFXFSZXINOPOH-QGZVFWFLSA-N 1 3 341.515 2.779 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1ccc(F)cc1)C(C)C ZINC001401335782 1362681406 /nfs/dbraw/zinc/68/14/06/1362681406.db2.gz QUSWOEOKIKYJHQ-RBUKOAKNSA-N 1 3 349.494 2.931 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]Cc1ccc(F)cc1)C(C)C ZINC001401335784 1362681887 /nfs/dbraw/zinc/68/18/87/1362681887.db2.gz QUSWOEOKIKYJHQ-RTBURBONSA-N 1 3 349.494 2.931 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]Cc1ccc(CF)cc1 ZINC001401345420 1362693453 /nfs/dbraw/zinc/69/34/53/1362693453.db2.gz VSHUAURFWYVOEW-APWZRJJASA-N 1 3 349.494 2.728 10 0 EFAEHO CCc1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@H+](C)[C@@H]2CC)cc1 ZINC001401365628 1362716742 /nfs/dbraw/zinc/71/67/42/1362716742.db2.gz CPUGBSZVNAZWMQ-VQTJNVASSA-N 1 3 345.531 2.870 10 0 EFAEHO CCc1ccc(CN(C)CCN(C)C(=O)[C@H]2CC[N@@H+](C)[C@@H]2CC)cc1 ZINC001401365628 1362716746 /nfs/dbraw/zinc/71/67/46/1362716746.db2.gz CPUGBSZVNAZWMQ-VQTJNVASSA-N 1 3 345.531 2.870 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@H+](C)CCN(C)C(=O)CN2CCCC2)c1 ZINC001401439623 1362809221 /nfs/dbraw/zinc/80/92/21/1362809221.db2.gz PTROTGGDWLINEU-GOSISDBHSA-N 1 3 331.504 2.850 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[N@@H+](C)CCN(C)C(=O)CN2CCCC2)c1 ZINC001401439623 1362809226 /nfs/dbraw/zinc/80/92/26/1362809226.db2.gz PTROTGGDWLINEU-GOSISDBHSA-N 1 3 331.504 2.850 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC001401439657 1362809384 /nfs/dbraw/zinc/80/93/84/1362809384.db2.gz OGRYAJWOBMTRDY-GOSISDBHSA-N 1 3 335.467 2.543 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC[N@@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC001401439657 1362809387 /nfs/dbraw/zinc/80/93/87/1362809387.db2.gz OGRYAJWOBMTRDY-GOSISDBHSA-N 1 3 335.467 2.543 10 0 EFAEHO CC[C@H](C(=O)N[C@H](C)C[NH2+]Cc1cccc(C(F)F)c1)N(C)C ZINC001401650841 1363000151 /nfs/dbraw/zinc/00/01/51/1363000151.db2.gz HHKMNDTXHPUCRY-IUODEOHRSA-N 1 3 327.419 2.559 10 0 EFAEHO COc1ccc(C[NH2+]C[C@@H](C)NC(=O)[C@H]2CCCCN2C(C)C)cc1 ZINC001401654995 1363003900 /nfs/dbraw/zinc/00/39/00/1363003900.db2.gz ZJGTZMLVNLLKKE-VQIMIIECSA-N 1 3 347.503 2.552 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+]Cc1cccc(C(F)F)c1 ZINC001401721281 1363053840 /nfs/dbraw/zinc/05/38/40/1363053840.db2.gz FQYOEUVNZKNDAT-ZDUSSCGKSA-N 1 3 327.419 2.559 10 0 EFAEHO Cc1ccc(C[NH2+][C@H](C)CCNC(=O)CN2CC[C@H](C)C2)cc1C ZINC001437401698 1387609831 /nfs/dbraw/zinc/60/98/31/1387609831.db2.gz JBTQOHPFCTYOIK-MAUKXSAKSA-N 1 3 331.504 2.630 10 0 EFAEHO C[C@H](CN(C)Cc1ccc(C(C)(C)C)cc1)NC(=O)CC[NH+](C)C ZINC001401779410 1363119418 /nfs/dbraw/zinc/11/94/18/1363119418.db2.gz KNDNGAWWKPAEEL-MRXNPFEDSA-N 1 3 333.520 2.872 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@H](C[NH2+]Cc1cccc(F)c1)C1CC1 ZINC001401838820 1363178099 /nfs/dbraw/zinc/17/80/99/1363178099.db2.gz DDRAYKBHRNTLRB-RTBURBONSA-N 1 3 347.478 2.685 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)N[C@H](C[NH2+]CC1CCCCC1)C1CC1 ZINC001401841520 1363180056 /nfs/dbraw/zinc/18/00/56/1363180056.db2.gz MDXKZWBMFDXSQY-MOPGFXCFSA-N 1 3 335.536 2.926 10 0 EFAEHO Cc1cc(C[NH2+]C[C@@H](NC(=O)[C@@H]2CCCN2C(C)C)C2CC2)cs1 ZINC001401848924 1363185604 /nfs/dbraw/zinc/18/56/04/1363185604.db2.gz SEDRPHTXUINEGI-MSOLQXFVSA-N 1 3 349.544 2.914 10 0 EFAEHO CC(C)(C(=O)N[C@@H](C[NH2+]Cc1ccccc1)C1CC1)N1CCCC1 ZINC001401853930 1363189901 /nfs/dbraw/zinc/18/99/01/1363189901.db2.gz YTQCRNWVJZIQGK-SFHVURJKSA-N 1 3 329.488 2.545 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NCC1(NCc2ccc(CF)cc2)CC1 ZINC001401947290 1363267243 /nfs/dbraw/zinc/26/72/43/1363267243.db2.gz NMLCCABWFRBMOD-SFHVURJKSA-N 1 3 347.478 2.769 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NCC1(NCc2ccc(CF)cc2)CC1 ZINC001401947290 1363267245 /nfs/dbraw/zinc/26/72/45/1363267245.db2.gz NMLCCABWFRBMOD-SFHVURJKSA-N 1 3 347.478 2.769 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)C34CCC[NH+](CCC3)C4)CC2)cs1 ZINC001401952383 1363271206 /nfs/dbraw/zinc/27/12/06/1363271206.db2.gz FTDMEZSEBQTZSY-UHFFFAOYSA-N 1 3 347.528 2.671 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001401965826 1363282621 /nfs/dbraw/zinc/28/26/21/1363282621.db2.gz BOWNWXNLFBNDGC-ROUUACIJSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@@H]1CCC[C@H]2CCC[N@H+]21 ZINC001401965826 1363282624 /nfs/dbraw/zinc/28/26/24/1363282624.db2.gz BOWNWXNLFBNDGC-ROUUACIJSA-N 1 3 345.462 2.581 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)NCC2(NCc3ccsc3)CC2)C1 ZINC001401979852 1363296127 /nfs/dbraw/zinc/29/61/27/1363296127.db2.gz RQJFVPGGCWPXPG-JKSUJKDBSA-N 1 3 335.517 2.607 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1(NCc2cccc(F)c2)CC1)[NH+]1CCCC1 ZINC001401987924 1363304642 /nfs/dbraw/zinc/30/46/42/1363304642.db2.gz SUNBVTPWSBMNQL-SFHVURJKSA-N 1 3 347.478 2.685 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC1CCCCC1 ZINC001402000220 1363318605 /nfs/dbraw/zinc/31/86/05/1363318605.db2.gz PRFNNRKXIYYMPZ-KDURUIRLSA-N 1 3 335.536 2.974 10 0 EFAEHO C[C@@H](F)CC[N@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001402002521 1363320723 /nfs/dbraw/zinc/32/07/23/1363320723.db2.gz JASWLVFCAXXGPK-CRAIPNDOSA-N 1 3 339.499 2.532 10 0 EFAEHO C[C@@H](F)CC[N@@H+](CC1CC1)C1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001402002521 1363320728 /nfs/dbraw/zinc/32/07/28/1363320728.db2.gz JASWLVFCAXXGPK-CRAIPNDOSA-N 1 3 339.499 2.532 10 0 EFAEHO Cc1ccncc1C[NH2+][C@H](C)CCNC(=O)[C@@H]1CCCCN1C(C)C ZINC001437410029 1387621086 /nfs/dbraw/zinc/62/10/86/1387621086.db2.gz NQAUVLQUZCMHMU-MJGOQNOKSA-N 1 3 346.519 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@@H]1[C@@H](C)[NH2+]Cc1ccccc1 ZINC001402035076 1363345794 /nfs/dbraw/zinc/34/57/94/1363345794.db2.gz GXVGOQKRBNRICS-IEBWSBKVSA-N 1 3 331.504 2.886 10 0 EFAEHO C[NH+](C)CCCC(=O)NCC1(N[C@H]2CCCc3ccc(F)cc32)CC1 ZINC001402045979 1363356021 /nfs/dbraw/zinc/35/60/21/1363356021.db2.gz XXFZAKCTDAFBQX-SFHVURJKSA-N 1 3 347.478 2.783 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CC=C(Cl)Cl)C[C@@H]1C ZINC001402048305 1363358260 /nfs/dbraw/zinc/35/82/60/1363358260.db2.gz FVTYVORUPXKIOE-STQMWFEESA-N 1 3 336.307 2.615 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)[C@H](C)C1 ZINC001402069596 1363375187 /nfs/dbraw/zinc/37/51/87/1363375187.db2.gz UKGPFGAMZDTKMV-APWZRJJASA-N 1 3 349.494 2.943 10 0 EFAEHO CC(C)Cc1ccc(CN2CC[C@@](C)(NC(=O)CC[NH+](C)C)C2)cc1 ZINC001402126346 1363432523 /nfs/dbraw/zinc/43/25/23/1363432523.db2.gz HCQSBTFLWPSARP-OAQYLSRUSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1(C)CC[NH+](Cc2ccsc2)CC1 ZINC001402204249 1363515481 /nfs/dbraw/zinc/51/54/81/1363515481.db2.gz KVKFOOPVTJEEFZ-UHFFFAOYSA-N 1 3 337.533 2.807 10 0 EFAEHO CCCN(C(=O)[C@H](CC)N(C)C)C1CC[NH+](CC[C@@H](C)F)CC1 ZINC001402245491 1363565767 /nfs/dbraw/zinc/56/57/67/1363565767.db2.gz NNJDXAYRPCWNRX-WBVHZDCISA-N 1 3 329.504 2.778 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](NCC=C(Cl)Cl)C2CC2)CC[N@H+]1C ZINC001402302722 1363594611 /nfs/dbraw/zinc/59/46/11/1363594611.db2.gz NFNAQOJLYTVEAU-MELADBBJSA-N 1 3 348.318 2.520 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@H]([NH2+]Cc1cccc(C)c1)C1CC1 ZINC001402288782 1363588272 /nfs/dbraw/zinc/58/82/72/1363588272.db2.gz GQXYHLZLYHLPEX-VQTJNVASSA-N 1 3 343.515 2.854 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@H](NCC=C(Cl)Cl)C2CC2)CC[N@@H+]1C ZINC001402302722 1363594608 /nfs/dbraw/zinc/59/46/08/1363594608.db2.gz NFNAQOJLYTVEAU-MELADBBJSA-N 1 3 348.318 2.520 10 0 EFAEHO CCc1ccccc1C[NH2+][C@@H](CNC(=O)CN1CC[C@@H](C)C1)C1CC1 ZINC001402319195 1363603746 /nfs/dbraw/zinc/60/37/46/1363603746.db2.gz AVXJCCIXFVVISG-UZLBHIALSA-N 1 3 343.515 2.575 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]([NH2+]Cc1ccsc1)C1CC1)N1CCCCCC1 ZINC001402342837 1363615620 /nfs/dbraw/zinc/61/56/20/1363615620.db2.gz LNKQDEZTIFYWBA-MAUKXSAKSA-N 1 3 349.544 2.997 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)C1CC1 ZINC001402388179 1363646399 /nfs/dbraw/zinc/64/63/99/1363646399.db2.gz YUDRIZZKDDVTMT-CRAIPNDOSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)C1CC1 ZINC001402388179 1363646401 /nfs/dbraw/zinc/64/64/01/1363646401.db2.gz YUDRIZZKDDVTMT-CRAIPNDOSA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](CNC(=O)[C@@H]1CC[N@@H+](C)C1)C1CC1 ZINC001402388188 1363646761 /nfs/dbraw/zinc/64/67/61/1363646761.db2.gz YUDRIZZKDDVTMT-QAPCUYQASA-N 1 3 349.906 2.585 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H](CNC(=O)[C@@H]1CC[N@H+](C)C1)C1CC1 ZINC001402388188 1363646764 /nfs/dbraw/zinc/64/67/64/1363646764.db2.gz YUDRIZZKDDVTMT-QAPCUYQASA-N 1 3 349.906 2.585 10 0 EFAEHO CN(CCF)C[C@H]1CCCN(C(=O)[C@@H]2CCC[N@@H+]2C2CCCC2)C1 ZINC001402390901 1363649842 /nfs/dbraw/zinc/64/98/42/1363649842.db2.gz WAEWJIBSHFXUBH-AEFFLSMTSA-N 1 3 339.499 2.533 10 0 EFAEHO CN(CCF)C[C@H]1CCCN(C(=O)[C@@H]2CCC[N@H+]2C2CCCC2)C1 ZINC001402390901 1363649845 /nfs/dbraw/zinc/64/98/45/1363649845.db2.gz WAEWJIBSHFXUBH-AEFFLSMTSA-N 1 3 339.499 2.533 10 0 EFAEHO CCC[NH2+][C@@H](CNC(=O)C1(N(C)C)CCC1)c1ccccc1CC ZINC001402393695 1363652633 /nfs/dbraw/zinc/65/26/33/1363652633.db2.gz NKHYADOAXBNNEW-SFHVURJKSA-N 1 3 331.504 2.890 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]([C@H](C)[NH2+]C/C=C/c2ccccc2)C1 ZINC001402407648 1363666772 /nfs/dbraw/zinc/66/67/72/1363666772.db2.gz KZWQNWBSTPJSKB-CSXIPAGWSA-N 1 3 343.515 2.867 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1csc(C)c1 ZINC001402484993 1363730174 /nfs/dbraw/zinc/73/01/74/1363730174.db2.gz ZGPGBORXRYEXKT-QZTJIDSGSA-N 1 3 349.544 2.964 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1csc(C)c1 ZINC001402484993 1363730178 /nfs/dbraw/zinc/73/01/78/1363730178.db2.gz ZGPGBORXRYEXKT-QZTJIDSGSA-N 1 3 349.544 2.964 10 0 EFAEHO CC[C@H](C(=O)N1CCCC[C@@H]1C[NH2+]C[C@@H](C)CC(C)C)N(C)C ZINC001402530457 1363763981 /nfs/dbraw/zinc/76/39/81/1363763981.db2.gz YUOJUGDZJWGNDD-RCCFBDPRSA-N 1 3 325.541 2.980 10 0 EFAEHO Cc1cccc([C@H](C)[NH2+][C@H]2C[C@@H](NC(=O)C3(N(C)C)CCC3)C2)c1 ZINC001402591427 1363818278 /nfs/dbraw/zinc/81/82/78/1363818278.db2.gz FDJWOOGXEBNZEL-RYQLBKOJSA-N 1 3 329.488 2.777 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1C[C@@H](NCc2cc(Cl)ccc2F)C1 ZINC001402601773 1363825700 /nfs/dbraw/zinc/82/57/00/1363825700.db2.gz AQDMRPWXXYKFNN-GASCZTMLSA-N 1 3 341.858 2.558 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@@H]([NH2+]C[C@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001402626050 1363852392 /nfs/dbraw/zinc/85/23/92/1363852392.db2.gz HGNQYGDOPGELQK-CAOSSQGBSA-N 1 3 345.478 2.635 10 0 EFAEHO Cc1ccc(CN(C)CCCN(C)C(=O)[C@H](C(C)C)[NH+](C)C)c(C)n1 ZINC001402630054 1363857530 /nfs/dbraw/zinc/85/75/30/1363857530.db2.gz IVYYNNNQGRMIEK-IBGZPJMESA-N 1 3 348.535 2.565 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)CCCN(C)C(=O)[C@H]2CCCN2C)c(C)c1 ZINC001402646825 1363881231 /nfs/dbraw/zinc/88/12/31/1363881231.db2.gz DCTDZJZYKMXJFR-HXUWFJFHSA-N 1 3 345.531 2.986 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)CCCN(C)C(=O)[C@H]2CCCN2C)c(C)c1 ZINC001402646825 1363881235 /nfs/dbraw/zinc/88/12/35/1363881235.db2.gz DCTDZJZYKMXJFR-HXUWFJFHSA-N 1 3 345.531 2.986 10 0 EFAEHO CN(CCC[N@H+](C)Cc1ccc(C2CC2)cc1)C(=O)Cc1c[nH]cn1 ZINC001402661588 1363904681 /nfs/dbraw/zinc/90/46/81/1363904681.db2.gz VPNNUHFGHASOSS-UHFFFAOYSA-N 1 3 340.471 2.810 10 0 EFAEHO CN(CCC[N@@H+](C)Cc1ccc(C2CC2)cc1)C(=O)Cc1c[nH]cn1 ZINC001402661588 1363904684 /nfs/dbraw/zinc/90/46/84/1363904684.db2.gz VPNNUHFGHASOSS-UHFFFAOYSA-N 1 3 340.471 2.810 10 0 EFAEHO CC[C@H](C)[C@H](C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CC)CC1 ZINC001402683661 1363933266 /nfs/dbraw/zinc/93/32/66/1363933266.db2.gz QPIHPILVUAOIDG-PBWTXFEYSA-N 1 3 335.536 2.828 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N1CCC[C@@]2(CCN(C/C=C\Cl)C2)C1 ZINC001402718748 1363964889 /nfs/dbraw/zinc/96/48/89/1363964889.db2.gz PFNRISKQXIVYJE-ZETNRXDVSA-N 1 3 341.927 2.785 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N1CCC[C@@]2(CCN(C/C=C\Cl)C2)C1 ZINC001402718748 1363964893 /nfs/dbraw/zinc/96/48/93/1363964893.db2.gz PFNRISKQXIVYJE-ZETNRXDVSA-N 1 3 341.927 2.785 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)C1 ZINC001402787554 1364034687 /nfs/dbraw/zinc/03/46/87/1364034687.db2.gz AFSSPUILVJQXGV-HZPDHXFCSA-N 1 3 343.531 2.929 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C(C)(C)C1 ZINC001402787554 1364034692 /nfs/dbraw/zinc/03/46/92/1364034692.db2.gz AFSSPUILVJQXGV-HZPDHXFCSA-N 1 3 343.531 2.929 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC1CCC([NH2+]C/C=C\Cl)CC1 ZINC001402835781 1364081331 /nfs/dbraw/zinc/08/13/31/1364081331.db2.gz SQJSRVAMJOZEHV-CPIORXOHSA-N 1 3 327.900 2.629 10 0 EFAEHO C[N@H+](CCNC(=O)C(C)(C)N1CCCCC1)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001437454892 1387660171 /nfs/dbraw/zinc/66/01/71/1387660171.db2.gz DHTPOZNNPIPELG-FGTMMUONSA-N 1 3 335.536 2.735 10 0 EFAEHO C[N@@H+](CCNC(=O)C(C)(C)N1CCCCC1)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001437454892 1387660175 /nfs/dbraw/zinc/66/01/75/1387660175.db2.gz DHTPOZNNPIPELG-FGTMMUONSA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@@H]1C[C@@H](NC(=O)CC[NH+](C)C)CCN1C/C=C/c1ccccc1 ZINC001402916694 1364132463 /nfs/dbraw/zinc/13/24/63/1364132463.db2.gz HTCQLOILWAPFIM-JWUWVAEESA-N 1 3 329.488 2.621 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H](C)[C@@H](C)NC(=O)C1(N(C)C)CCC1 ZINC001402985988 1364183614 /nfs/dbraw/zinc/18/36/14/1364183614.db2.gz CLKCMDGMWSSTLK-HUUCEWRRSA-N 1 3 335.467 2.601 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H](C)[NH2+]CCc1ccc(Cl)cc1 ZINC001403003568 1364202085 /nfs/dbraw/zinc/20/20/85/1364202085.db2.gz IZPVGHLFOHSCRO-STQMWFEESA-N 1 3 348.878 2.640 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@H](C)c2cccc(F)c2)CC[N@@H+]1C ZINC001437462192 1387666053 /nfs/dbraw/zinc/66/60/53/1387666053.db2.gz ITUKSWKNXYWCQJ-FHLIZLRMSA-N 1 3 335.467 2.665 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NCCN(C)[C@H](C)c2cccc(F)c2)CC[N@H+]1C ZINC001437462192 1387666056 /nfs/dbraw/zinc/66/60/56/1387666056.db2.gz ITUKSWKNXYWCQJ-FHLIZLRMSA-N 1 3 335.467 2.665 10 0 EFAEHO Cc1ccccc1C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)CC(C)(C)C ZINC001403015063 1364215026 /nfs/dbraw/zinc/21/50/26/1364215026.db2.gz OOLLFOGFDBRQTD-IAGOWNOFSA-N 1 3 333.520 2.956 10 0 EFAEHO Cc1cc(C)cc(C[NH2+][C@H](C)[C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 ZINC001403035712 1364239718 /nfs/dbraw/zinc/23/97/18/1364239718.db2.gz WMIJTSCXYWNLHC-IAGOWNOFSA-N 1 3 331.504 2.771 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC(C)(C)C[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001403083599 1364287015 /nfs/dbraw/zinc/28/70/15/1364287015.db2.gz HOTNUUAHVPVMQE-KURKYZTESA-N 1 3 337.552 2.837 10 0 EFAEHO C[C@H](CNC(=O)CC[NH+](C)C)N(C)Cc1ccc(C(C)(C)C)cc1 ZINC001403169142 1364389555 /nfs/dbraw/zinc/38/95/55/1364389555.db2.gz NAHYFQXYOXMPIC-MRXNPFEDSA-N 1 3 333.520 2.872 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@@H](C)NCc1ccccc1F)[NH+]1CCCC1 ZINC001403170762 1364392389 /nfs/dbraw/zinc/39/23/89/1364392389.db2.gz UDLAFIACPWSWEK-QAPCUYQASA-N 1 3 335.467 2.540 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)[N@H+](C)CC1CCC2(CC2)CC1 ZINC001403194398 1364422143 /nfs/dbraw/zinc/42/21/43/1364422143.db2.gz IHRJAYKEKGMZQW-CQSZACIVSA-N 1 3 332.492 2.668 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@@H](C)[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001403194398 1364422145 /nfs/dbraw/zinc/42/21/45/1364422145.db2.gz IHRJAYKEKGMZQW-CQSZACIVSA-N 1 3 332.492 2.668 10 0 EFAEHO COc1cccc([C@H](C)[N@H+](C)[C@H](C)CNC(=O)CN(C)C(C)C)c1 ZINC001403230405 1364446916 /nfs/dbraw/zinc/44/69/16/1364446916.db2.gz PQPSZCIZQVIFTC-CVEARBPZSA-N 1 3 335.492 2.533 10 0 EFAEHO COc1cccc([C@H](C)[N@@H+](C)[C@H](C)CNC(=O)CN(C)C(C)C)c1 ZINC001403230405 1364446920 /nfs/dbraw/zinc/44/69/20/1364446920.db2.gz PQPSZCIZQVIFTC-CVEARBPZSA-N 1 3 335.492 2.533 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001437480175 1387680436 /nfs/dbraw/zinc/68/04/36/1387680436.db2.gz BUWSZHVTJMJDJF-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccccc1CN(C)CCNC(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001437480175 1387680441 /nfs/dbraw/zinc/68/04/41/1387680441.db2.gz BUWSZHVTJMJDJF-UXHICEINSA-N 1 3 343.515 2.814 10 0 EFAEHO CC(C)c1ccccc1CN1CC([C@@H](C)NC(=O)CC[NH+](C)C)C1 ZINC001403325156 1364543006 /nfs/dbraw/zinc/54/30/06/1364543006.db2.gz NFCOAYJKPUVWEU-MRXNPFEDSA-N 1 3 331.504 2.698 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CCCCC[C@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001403325108 1364543711 /nfs/dbraw/zinc/54/37/11/1364543711.db2.gz VVBMMFHLEBTSGR-SJORKVTESA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CCCCC[C@H]1CNC(=O)C(C)(C)N1CCCC1 ZINC001403325108 1364543713 /nfs/dbraw/zinc/54/37/13/1364543713.db2.gz VVBMMFHLEBTSGR-SJORKVTESA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H](NC(=O)CC[NH+](C)C)C1CN(Cc2ccc(C3CCC3)cc2)C1 ZINC001403330525 1364547974 /nfs/dbraw/zinc/54/79/74/1364547974.db2.gz UBAUZANHNJBHOL-INIZCTEOSA-N 1 3 343.515 2.842 10 0 EFAEHO Cc1ccccc1CN1C[C@H](NC(=O)C2(C[NH+](C)C)CC2)C(C)(C)C1 ZINC001403378861 1364587103 /nfs/dbraw/zinc/58/71/03/1364587103.db2.gz INZKWOGFADOCOB-SFHVURJKSA-N 1 3 343.515 2.663 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1C[C@H](C[NH2+][C@H](C)c2cccc(F)c2)C1)N(C)C ZINC001403442078 1364644111 /nfs/dbraw/zinc/64/41/11/1364644111.db2.gz QOPMZOYXHKFYDU-OHDICMOHSA-N 1 3 349.494 2.957 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001403453664 1364655178 /nfs/dbraw/zinc/65/51/78/1364655178.db2.gz BCXSUUKRTNKYIY-VAMGGRTRSA-N 1 3 345.531 2.874 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H]([NH2+]CC1CC(C)(C)C1)C(C)C ZINC001403497788 1364705868 /nfs/dbraw/zinc/70/58/68/1364705868.db2.gz ZADSRTBLOVZVLQ-MRXNPFEDSA-N 1 3 334.508 2.817 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C[NH2+]Cc1cc(C)cc(C)c1)C1CC1)N(C)C ZINC001403528555 1364734348 /nfs/dbraw/zinc/73/43/48/1364734348.db2.gz OTKYDCPUJKSZMX-UXHICEINSA-N 1 3 345.531 2.970 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@H]1C[N@H+](C)C[C@@H]1c1ccccc1)NC/C=C\Cl ZINC001403594065 1364797884 /nfs/dbraw/zinc/79/78/84/1364797884.db2.gz OMTOGUOYNVKEHP-NYWIHWJNSA-N 1 3 349.906 2.521 10 0 EFAEHO C[C@H](CN(C)C(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1)NC/C=C\Cl ZINC001403594065 1364797888 /nfs/dbraw/zinc/79/78/88/1364797888.db2.gz OMTOGUOYNVKEHP-NYWIHWJNSA-N 1 3 349.906 2.521 10 0 EFAEHO C[C@@H](CN(C)C(=O)CN(C)CC(C)(C)C)[NH2+]CC1CC(C)(C)C1 ZINC001403595416 1364798695 /nfs/dbraw/zinc/79/86/95/1364798695.db2.gz QDSRATCMCMERCX-HNNXBMFYSA-N 1 3 325.541 2.837 10 0 EFAEHO CCCc1ccc(C[NH2+][C@H](C)CN(C)C(=O)CN2CC[C@@H](C)C2)cc1 ZINC001403595999 1364799684 /nfs/dbraw/zinc/79/96/84/1364799684.db2.gz ICDMNDXLLMWQSR-QZTJIDSGSA-N 1 3 345.531 2.917 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(C)CCNC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001403658504 1364852418 /nfs/dbraw/zinc/85/24/18/1364852418.db2.gz BMUAGPPWIFVDIM-UXLLHSPISA-N 1 3 335.467 2.665 10 0 EFAEHO C[C@H](c1ccc(F)cc1)N(C)CCNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001403658504 1364852420 /nfs/dbraw/zinc/85/24/20/1364852420.db2.gz BMUAGPPWIFVDIM-UXLLHSPISA-N 1 3 335.467 2.665 10 0 EFAEHO CN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)[C@H]1CCc2c1cccc2Cl ZINC001403728791 1364887909 /nfs/dbraw/zinc/88/79/09/1364887909.db2.gz DCJLEFBWPRYWRZ-KSSFIOAISA-N 1 3 349.906 2.717 10 0 EFAEHO CN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)[C@H]1CCc2c1cccc2Cl ZINC001403728791 1364887915 /nfs/dbraw/zinc/88/79/15/1364887915.db2.gz DCJLEFBWPRYWRZ-KSSFIOAISA-N 1 3 349.906 2.717 10 0 EFAEHO Cc1nc(C(C)C)ccc1CN[C@H]1C[C@H](C)N(C(=O)CC[NH+](C)C)C1 ZINC001403729688 1364889115 /nfs/dbraw/zinc/88/91/15/1364889115.db2.gz APYXESPKVOEETM-YJBOKZPZSA-N 1 3 346.519 2.544 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]CC(CC)CC)[C@H]2C1 ZINC001403794996 1364947455 /nfs/dbraw/zinc/94/74/55/1364947455.db2.gz VPSDKGVCGIZFCL-FHWLQOOXSA-N 1 3 337.552 2.981 10 0 EFAEHO CCc1cccc(CN2CCC[C@H](NC(=O)CC[NH+](C)C)[C@H]2C)c1 ZINC001403801323 1364955150 /nfs/dbraw/zinc/95/51/50/1364955150.db2.gz SBQNUBLUEFDDET-APWZRJJASA-N 1 3 331.504 2.670 10 0 EFAEHO CN(C)C1(C(=O)N[C@@H]2CC[C@@H](C[NH2+]CC3CC4(CCC4)C3)C2)CCC1 ZINC001403811964 1364967286 /nfs/dbraw/zinc/96/72/86/1364967286.db2.gz XWWNWTPWALNKEC-SJLPKXTDSA-N 1 3 347.547 2.926 10 0 EFAEHO CC[C@@H](C)C[N@H+](CC)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001403910722 1365032926 /nfs/dbraw/zinc/03/29/26/1365032926.db2.gz GPVRNQJMKFIPGB-QAPCUYQASA-N 1 3 329.504 2.683 10 0 EFAEHO CC[C@@H](C)C[N@@H+](CC)CCNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001403910722 1365032928 /nfs/dbraw/zinc/03/29/28/1365032928.db2.gz GPVRNQJMKFIPGB-QAPCUYQASA-N 1 3 329.504 2.683 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CCC[C@H]2CCC[N@@H+]21)Cc1cccc(C)c1 ZINC001403934238 1365065382 /nfs/dbraw/zinc/06/53/82/1365065382.db2.gz YFMBLULCNJLVBM-VQTJNVASSA-N 1 3 343.515 2.950 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CCC[C@H]2CCC[N@H+]21)Cc1cccc(C)c1 ZINC001403934238 1365065385 /nfs/dbraw/zinc/06/53/85/1365065385.db2.gz YFMBLULCNJLVBM-VQTJNVASSA-N 1 3 343.515 2.950 10 0 EFAEHO CCC(CC)C[NH+]1CCC([C@@H](C)NC(=O)[C@@H](CC)N(C)C)CC1 ZINC001403976381 1365123290 /nfs/dbraw/zinc/12/32/90/1365123290.db2.gz QXGFHGOAGAEBRJ-CRAIPNDOSA-N 1 3 325.541 2.980 10 0 EFAEHO CC[C@H](F)CN1CCC([C@H](C)NC(=O)[C@H](C(C)C)[NH+](C)C)CC1 ZINC001403982579 1365131819 /nfs/dbraw/zinc/13/18/19/1365131819.db2.gz GIUDRQFDPAPCAE-XIRDDKMYSA-N 1 3 329.504 2.537 10 0 EFAEHO C[C@H](NC(=O)CN1CC[C@H](C)C1)C1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001403993610 1365144463 /nfs/dbraw/zinc/14/44/63/1365144463.db2.gz GSRPMZPNGYKKBX-IRXDYDNUSA-N 1 3 349.563 2.981 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C2CC(N(C)C(=O)C3(N(C)C)CCC3)C2)c1 ZINC001404023270 1365178661 /nfs/dbraw/zinc/17/86/61/1365178661.db2.gz LWBODCLKHKHIEF-UHFFFAOYSA-N 1 3 347.478 2.697 10 0 EFAEHO CC[C@@H](C(=O)N(C)C1CC([NH2+]Cc2ccc(C3CC3)cc2)C1)N(C)C ZINC001404022079 1365178848 /nfs/dbraw/zinc/17/88/48/1365178848.db2.gz QMQKSCXBCMNPLE-MHJFOBGBSA-N 1 3 343.515 2.983 10 0 EFAEHO CCc1ccc(C[NH2+]C2CC(N(C)C(=O)CN(C)C(C)C)C2)cc1 ZINC001404026539 1365184146 /nfs/dbraw/zinc/18/41/46/1365184146.db2.gz YEGVAHIBPSXWDA-UHFFFAOYSA-N 1 3 331.504 2.668 10 0 EFAEHO Cc1ccc(F)c(C[N@H+]2CC[C@@H](CNC(=O)CN(C)C3CCC3)C2)c1 ZINC001404076699 1365236419 /nfs/dbraw/zinc/23/64/19/1365236419.db2.gz FUTQURJYLSIXAB-INIZCTEOSA-N 1 3 347.478 2.557 10 0 EFAEHO Cc1ccc(F)c(C[N@@H+]2CC[C@@H](CNC(=O)CN(C)C3CCC3)C2)c1 ZINC001404076699 1365236423 /nfs/dbraw/zinc/23/64/23/1365236423.db2.gz FUTQURJYLSIXAB-INIZCTEOSA-N 1 3 347.478 2.557 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2F)C1 ZINC001404106794 1365266219 /nfs/dbraw/zinc/26/62/19/1365266219.db2.gz RVASMVVNAWEKIQ-JKSUJKDBSA-N 1 3 335.467 2.665 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[N@H+]([C@@H](C)c2ccccc2F)C1 ZINC001404106794 1365266223 /nfs/dbraw/zinc/26/62/23/1365266223.db2.gz RVASMVVNAWEKIQ-JKSUJKDBSA-N 1 3 335.467 2.665 10 0 EFAEHO CN(CCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@@H+]21)Cc1ccc(CF)cc1 ZINC001437528537 1387733243 /nfs/dbraw/zinc/73/32/43/1387733243.db2.gz BFMIWECZABLFJY-MOPGFXCFSA-N 1 3 347.478 2.721 10 0 EFAEHO CN(CCNC(=O)[C@@H]1CCC[C@@H]2CCC[N@H+]21)Cc1ccc(CF)cc1 ZINC001437528537 1387733249 /nfs/dbraw/zinc/73/32/49/1387733249.db2.gz BFMIWECZABLFJY-MOPGFXCFSA-N 1 3 347.478 2.721 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC001404290203 1365432454 /nfs/dbraw/zinc/43/24/54/1365432454.db2.gz DOQZQDDQWJASAB-LJQANCHMSA-N 1 3 329.488 2.595 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC001404290203 1365432459 /nfs/dbraw/zinc/43/24/59/1365432459.db2.gz DOQZQDDQWJASAB-LJQANCHMSA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1ccccc1CN(CCNC(=O)C[NH+]1[C@H](C)CC[C@H]1C)C1CC1 ZINC001404297018 1365435981 /nfs/dbraw/zinc/43/59/81/1365435981.db2.gz MDNFLUBYXLMPNY-QZTJIDSGSA-N 1 3 343.515 2.948 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)C2CC2)cc1 ZINC001404297501 1365436049 /nfs/dbraw/zinc/43/60/49/1365436049.db2.gz NLCLQQWMTANWCX-HDICACEKSA-N 1 3 343.515 2.948 10 0 EFAEHO Cc1ccc(CN(CCNC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)C2CC2)cc1 ZINC001404297501 1365436051 /nfs/dbraw/zinc/43/60/51/1365436051.db2.gz NLCLQQWMTANWCX-HDICACEKSA-N 1 3 343.515 2.948 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H](C)[NH2+]Cc2ccsc2)CC1 ZINC001404380506 1365486061 /nfs/dbraw/zinc/48/60/61/1365486061.db2.gz BYGOGUYWBNCGJQ-HNNXBMFYSA-N 1 3 337.533 2.805 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NC[C@@H]([NH2+]CC(C)C)c1ccccc1 ZINC001404386280 1365490700 /nfs/dbraw/zinc/49/07/00/1365490700.db2.gz PJLBVHUVFIKJEV-RTBURBONSA-N 1 3 331.504 2.964 10 0 EFAEHO Cc1cccc(C)c1CN(C)CCNC(=O)[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001437540734 1387745004 /nfs/dbraw/zinc/74/50/04/1387745004.db2.gz FZMNAQDMDFQSGE-MOPGFXCFSA-N 1 3 345.531 2.972 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@@H]2CC[N@H+](CC3CCCCC3)C2)C1 ZINC001404504592 1365606847 /nfs/dbraw/zinc/60/68/47/1365606847.db2.gz AKWPWPZFHPVJFY-PKOBYXMFSA-N 1 3 335.536 2.737 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCC[C@@H]2CC[N@@H+](CC3CCCCC3)C2)C1 ZINC001404504592 1365606849 /nfs/dbraw/zinc/60/68/49/1365606849.db2.gz AKWPWPZFHPVJFY-PKOBYXMFSA-N 1 3 335.536 2.737 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@H+](C)CCC(C)(C)C)CC1 ZINC001404621915 1365724064 /nfs/dbraw/zinc/72/40/64/1365724064.db2.gz UUQJYHXPXHNVAG-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C[N@@H+](C)CCC(C)(C)C)CC1 ZINC001404621915 1365724067 /nfs/dbraw/zinc/72/40/67/1365724067.db2.gz UUQJYHXPXHNVAG-UHFFFAOYSA-N 1 3 325.541 2.933 10 0 EFAEHO CC[C@H](C(=O)NCC1C[NH+]([C@@H](C)c2cc(C)ccc2C)C1)N(C)C ZINC001404882211 1365876350 /nfs/dbraw/zinc/87/63/50/1365876350.db2.gz GWYLTDIBIJCUFN-QFBILLFUSA-N 1 3 331.504 2.753 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)C[NH+]2[C@H](C)CC[C@H]2C)c1 ZINC001437566074 1387775190 /nfs/dbraw/zinc/77/51/90/1387775190.db2.gz QGBPZSPZGVEWNE-QZTJIDSGSA-N 1 3 331.504 2.724 10 0 EFAEHO CC[C@H](CNC(=O)[C@H](C(C)C)N(C)C)[NH2+]Cc1ccc(F)c(F)c1 ZINC001405246678 1366116568 /nfs/dbraw/zinc/11/65/68/1366116568.db2.gz DQQKYWCZGMUQJP-PBHICJAKSA-N 1 3 341.446 2.535 10 0 EFAEHO CC[C@@H](CNC(=O)CN1CC[C@H](C)C1)[NH2+]Cc1ccc(C)cc1C ZINC001405301210 1366139410 /nfs/dbraw/zinc/13/94/10/1366139410.db2.gz JLZVQDCIHHSSSQ-LPHOPBHVSA-N 1 3 331.504 2.630 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@](C)(C[NH2+]Cc1ccccc1)C1CC1 ZINC001405428626 1366194314 /nfs/dbraw/zinc/19/43/14/1366194314.db2.gz HAGGMYUXSQPBJU-PZJWPPBQSA-N 1 3 343.515 2.934 10 0 EFAEHO CC[C@H](C(=O)N[C@@](C)(C[NH2+]Cc1csc(C)c1)C1CC1)N(C)C ZINC001405433963 1366198119 /nfs/dbraw/zinc/19/81/19/1366198119.db2.gz JDNOYZYTZZNRMD-AEFFLSMTSA-N 1 3 337.533 2.771 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@](C)(C[NH2+]Cc1cccc(F)c1)C1CC1 ZINC001405471059 1366222215 /nfs/dbraw/zinc/22/22/15/1366222215.db2.gz FWZYTJZIEBCXDP-IBGZPJMESA-N 1 3 335.467 2.540 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2CC[C@H]([NH2+]C[C@@H]3CC[C@@H]4C[C@@H]4C3)CC2)CCC1 ZINC001405521005 1366266144 /nfs/dbraw/zinc/26/61/44/1366266144.db2.gz PNZFAQYGSIDFJF-UJWQCDCRSA-N 1 3 347.547 2.924 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(CC[N@H+](CCC(F)(F)F)C2)CC1 ZINC001405623100 1366316052 /nfs/dbraw/zinc/31/60/52/1366316052.db2.gz GYKQXKVMOAQFHI-UHFFFAOYSA-N 1 3 349.441 2.594 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC2(CC[N@@H+](CCC(F)(F)F)C2)CC1 ZINC001405623100 1366316057 /nfs/dbraw/zinc/31/60/57/1366316057.db2.gz GYKQXKVMOAQFHI-UHFFFAOYSA-N 1 3 349.441 2.594 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@@H](C)CNC(=O)C(C)(C)N1CCCC1 ZINC001405686954 1366338171 /nfs/dbraw/zinc/33/81/71/1366338171.db2.gz GVPYUVOBRUCUJX-OAHLLOKOSA-N 1 3 349.494 2.850 10 0 EFAEHO C[C@@H](C[NH2+]CC1CCC(C)(C)CC1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001405873101 1366481489 /nfs/dbraw/zinc/48/14/89/1366481489.db2.gz SRNUSMHASAZGOM-IRXDYDNUSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)C[C@@H](C[NH2+]Cc1ccccc1)NC(=O)CN1CC[C@@H](C)C1 ZINC001405925315 1366527339 /nfs/dbraw/zinc/52/73/39/1366527339.db2.gz DEOYZNQTKWVAJW-MJGOQNOKSA-N 1 3 331.504 2.649 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21)Cc1ccc(F)cc1 ZINC001437603423 1387817049 /nfs/dbraw/zinc/81/70/49/1387817049.db2.gz UUCUXRMTNWPZEP-RTBURBONSA-N 1 3 347.478 2.781 10 0 EFAEHO CCN(CCNC(=O)[C@H]1CC[C@H]2CCCC[N@H+]21)Cc1ccc(F)cc1 ZINC001437603423 1387817052 /nfs/dbraw/zinc/81/70/52/1387817052.db2.gz UUCUXRMTNWPZEP-RTBURBONSA-N 1 3 347.478 2.781 10 0 EFAEHO C[C@@H](F)CC[N@H+](C)CCC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001405973817 1367033352 /nfs/dbraw/zinc/03/33/52/1367033352.db2.gz OBWNFJVCEROGLG-MRXNPFEDSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@@H](F)CC[N@@H+](C)CCC1CCN(C(=O)CN(C)C2CCC2)CC1 ZINC001405973817 1367033364 /nfs/dbraw/zinc/03/33/64/1367033364.db2.gz OBWNFJVCEROGLG-MRXNPFEDSA-N 1 3 341.515 2.779 10 0 EFAEHO CC[N@H+](CCNC(=O)CN1CC[C@H](C)C1)CC[C@@H]1CCCC1(F)F ZINC001437624800 1387848354 /nfs/dbraw/zinc/84/83/54/1387848354.db2.gz CELHDDJXHRBBLO-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN1CC[C@H](C)C1)CC[C@@H]1CCCC1(F)F ZINC001437624800 1387848360 /nfs/dbraw/zinc/84/83/60/1387848360.db2.gz CELHDDJXHRBBLO-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO C[N@H+](CCC1CCN(C(=O)Cc2c[nH]cn2)CC1)CC1CCCC1 ZINC001405990426 1367060595 /nfs/dbraw/zinc/06/05/95/1367060595.db2.gz LDYDNNUTGKEEQX-UHFFFAOYSA-N 1 3 332.492 2.703 10 0 EFAEHO C[N@@H+](CCC1CCN(C(=O)Cc2c[nH]cn2)CC1)CC1CCCC1 ZINC001405990426 1367060603 /nfs/dbraw/zinc/06/06/03/1367060603.db2.gz LDYDNNUTGKEEQX-UHFFFAOYSA-N 1 3 332.492 2.703 10 0 EFAEHO CC(C)[C@H](CNC(=O)CC[NH+](C)C)NCc1sccc1Cl ZINC001406037576 1367126346 /nfs/dbraw/zinc/12/63/46/1367126346.db2.gz LCNMVAUGTFKOGP-ZDUSSCGKSA-N 1 3 331.913 2.584 10 0 EFAEHO Cc1ccc(CN(C)CCN(C)C(=O)C23CCC[NH+](CCC2)C3)cc1 ZINC001406109324 1367241784 /nfs/dbraw/zinc/24/17/84/1367241784.db2.gz TYPWBBGOTHWCFI-UHFFFAOYSA-N 1 3 343.515 2.761 10 0 EFAEHO CN(CCN(C)C(=O)C1CC[NH+](C)CC1)Cc1ccc(C2CC2)cc1 ZINC001406136620 1367298544 /nfs/dbraw/zinc/29/85/44/1367298544.db2.gz YLTZWROZKZYVCV-UHFFFAOYSA-N 1 3 343.515 2.796 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001406140870 1367305957 /nfs/dbraw/zinc/30/59/57/1367305957.db2.gz DLWHVBBLKWMKRX-SJLPKXTDSA-N 1 3 349.544 2.698 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001406140870 1367305965 /nfs/dbraw/zinc/30/59/65/1367305965.db2.gz DLWHVBBLKWMKRX-SJLPKXTDSA-N 1 3 349.544 2.698 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@H]1CCC[C@H]2CCC[N@@H+]21 ZINC001406140857 1367306169 /nfs/dbraw/zinc/30/61/69/1367306169.db2.gz DLWHVBBLKWMKRX-FUHWJXTLSA-N 1 3 349.544 2.698 10 0 EFAEHO CN(CCc1cccs1)CCN(C)C(=O)[C@H]1CCC[C@H]2CCC[N@H+]21 ZINC001406140857 1367306175 /nfs/dbraw/zinc/30/61/75/1367306175.db2.gz DLWHVBBLKWMKRX-FUHWJXTLSA-N 1 3 349.544 2.698 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2ccc(Cl)cc21)C(=O)[C@@H]1CC[N@H+](C)C1 ZINC001406172255 1367364210 /nfs/dbraw/zinc/36/42/10/1367364210.db2.gz XRRITQCGYJBLIK-QAPCUYQASA-N 1 3 349.906 2.669 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2ccc(Cl)cc21)C(=O)[C@@H]1CC[N@@H+](C)C1 ZINC001406172255 1367364220 /nfs/dbraw/zinc/36/42/20/1367364220.db2.gz XRRITQCGYJBLIK-QAPCUYQASA-N 1 3 349.906 2.669 10 0 EFAEHO Cc1ccc(C[NH2+]C[C@@H]2CCC[C@H]2NC(=O)CN(C)C(C)C)cc1 ZINC001406194435 1367392260 /nfs/dbraw/zinc/39/22/60/1367392260.db2.gz LPRBGXYNLXYNCJ-RBUKOAKNSA-N 1 3 331.504 2.710 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)N[C@H](C)C[NH2+]CC1CCC(F)(F)CC1 ZINC001406356731 1367518661 /nfs/dbraw/zinc/51/86/61/1367518661.db2.gz YGJLFRYDPMDJSH-ZBFHGGJFSA-N 1 3 345.478 2.779 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1cc(C)ccc1F ZINC001406482702 1367635865 /nfs/dbraw/zinc/63/58/65/1367635865.db2.gz RKSDKEYYWAUFGZ-MAUKXSAKSA-N 1 3 335.467 2.603 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)CNCc1cc(C)ccc1F ZINC001406482702 1367635873 /nfs/dbraw/zinc/63/58/73/1367635873.db2.gz RKSDKEYYWAUFGZ-MAUKXSAKSA-N 1 3 335.467 2.603 10 0 EFAEHO C[C@@H](C[NH2+]CC1CC(C)(C)C1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001406527314 1367686712 /nfs/dbraw/zinc/68/67/12/1367686712.db2.gz IMSDUJNFOREKEX-LIRRHRJNSA-N 1 3 341.515 2.729 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H](C)C[NH2+]Cc1cc2ccccc2s1 ZINC001406543377 1367707272 /nfs/dbraw/zinc/70/72/72/1367707272.db2.gz FQUGYARNLYIKQZ-AWEZNQCLSA-N 1 3 333.501 2.837 10 0 EFAEHO CC(C)c1cccc(CNC[C@H](C)NC(=O)CC[NH+]2CCCCC2)n1 ZINC001406555239 1367720493 /nfs/dbraw/zinc/72/04/93/1367720493.db2.gz GNSBPCQODKYIFF-KRWDZBQOSA-N 1 3 346.519 2.675 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)Cc2ccc(CF)cc2)CC[N@@H+]1C ZINC001406609465 1367799315 /nfs/dbraw/zinc/79/93/15/1367799315.db2.gz MAGUCLADNXDOJU-ZYSHUDEJSA-N 1 3 349.494 2.823 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)Cc2ccc(CF)cc2)CC[N@H+]1C ZINC001406609465 1367799322 /nfs/dbraw/zinc/79/93/22/1367799322.db2.gz MAGUCLADNXDOJU-ZYSHUDEJSA-N 1 3 349.494 2.823 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)Cc2ccc(C)cc2)CC[N@@H+]1C ZINC001406622513 1367818460 /nfs/dbraw/zinc/81/84/60/1367818460.db2.gz XROSAFKNRXEZLV-NZSAHSFTSA-N 1 3 331.504 2.662 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@H](C)CN(C)Cc2ccc(C)cc2)CC[N@H+]1C ZINC001406622513 1367818467 /nfs/dbraw/zinc/81/84/67/1367818467.db2.gz XROSAFKNRXEZLV-NZSAHSFTSA-N 1 3 331.504 2.662 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C[N@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001406690129 1367923062 /nfs/dbraw/zinc/92/30/62/1367923062.db2.gz JYEDWCWHUSVXAF-DNVCBOLYSA-N 1 3 344.503 2.691 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](C)C[N@@H+](C)Cc1ccc2cc[nH]c2c1)N(C)C ZINC001406690129 1367923065 /nfs/dbraw/zinc/92/30/65/1367923065.db2.gz JYEDWCWHUSVXAF-DNVCBOLYSA-N 1 3 344.503 2.691 10 0 EFAEHO CC(C)Cc1ccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CC[N@H+](C)C2)cc1 ZINC001406697277 1367938995 /nfs/dbraw/zinc/93/89/95/1367938995.db2.gz HINUPZZMVDMYOZ-FXAWDEMLSA-N 1 3 345.531 2.773 10 0 EFAEHO CC(C)Cc1ccc(CN(C)C[C@H](C)NC(=O)[C@@H]2CC[N@@H+](C)C2)cc1 ZINC001406697277 1367938996 /nfs/dbraw/zinc/93/89/96/1367938996.db2.gz HINUPZZMVDMYOZ-FXAWDEMLSA-N 1 3 345.531 2.773 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC001406712867 1367963387 /nfs/dbraw/zinc/96/33/87/1367963387.db2.gz FHXSMBSSMJIHHU-BEFAXECRSA-N 1 3 349.494 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC001406712867 1367963390 /nfs/dbraw/zinc/96/33/90/1367963390.db2.gz FHXSMBSSMJIHHU-BEFAXECRSA-N 1 3 349.494 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC001406712882 1367964022 /nfs/dbraw/zinc/96/40/22/1367964022.db2.gz FHXSMBSSMJIHHU-DNVCBOLYSA-N 1 3 349.494 2.980 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C[N@@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC001406712882 1367964026 /nfs/dbraw/zinc/96/40/26/1367964026.db2.gz FHXSMBSSMJIHHU-DNVCBOLYSA-N 1 3 349.494 2.980 10 0 EFAEHO CC(C)(C)CCCN1CC[C@H]1CNC(=O)C12CCC[NH+](CCC1)C2 ZINC001406875636 1368152657 /nfs/dbraw/zinc/15/26/57/1368152657.db2.gz XLPZLMTXVOCWGY-KRWDZBQOSA-N 1 3 335.536 2.879 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)[C@H]2CC[N@@H+](C3CCCCC3)C2)CC1 ZINC001406915530 1368205349 /nfs/dbraw/zinc/20/53/49/1368205349.db2.gz DQRSVUANUYOHST-JKSUJKDBSA-N 1 3 339.499 2.628 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)[C@H]2CC[N@H+](C3CCCCC3)C2)CC1 ZINC001406915530 1368205359 /nfs/dbraw/zinc/20/53/59/1368205359.db2.gz DQRSVUANUYOHST-JKSUJKDBSA-N 1 3 339.499 2.628 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NCC1([NH2+][C@H](C)c2ccccc2)CC1 ZINC001406923366 1368217615 /nfs/dbraw/zinc/21/76/15/1368217615.db2.gz XJKVOBTXAYPFLC-AEFFLSMTSA-N 1 3 329.488 2.859 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NCC1([NH2+][C@@H](C)c2ccc(F)cc2)CC1 ZINC001406924009 1368218437 /nfs/dbraw/zinc/21/84/37/1368218437.db2.gz YUDDLEBCTWOZGU-MAUKXSAKSA-N 1 3 347.478 2.998 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]Cc2ccc(Cl)cc2)CC1 ZINC001406999873 1368301973 /nfs/dbraw/zinc/30/19/73/1368301973.db2.gz BNTLVNUHKGLOGF-GJZGRUSLSA-N 1 3 349.906 2.951 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CC[N@H+](C/C=C/Cl)C2)CC1 ZINC001407001880 1368305785 /nfs/dbraw/zinc/30/57/85/1368305785.db2.gz MXVINSSTWHCYOK-AUNFYEFLSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@H]2CC[N@@H+](C/C=C/Cl)C2)CC1 ZINC001407001880 1368305790 /nfs/dbraw/zinc/30/57/90/1368305790.db2.gz MXVINSSTWHCYOK-AUNFYEFLSA-N 1 3 341.927 2.640 10 0 EFAEHO CCc1ccccc1C[NH2+]C1(CNC(=O)CN2[C@@H](C)CC[C@@H]2C)CC1 ZINC001407013164 1368323287 /nfs/dbraw/zinc/32/32/87/1368323287.db2.gz WVEJWDNTRLNILA-IRXDYDNUSA-N 1 3 343.515 2.860 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@@H]1CCCN1C(=O)c1cccc(CN(C)C)c1 ZINC001407108831 1368434266 /nfs/dbraw/zinc/43/42/66/1368434266.db2.gz IZVCFKQFVWYLKB-LPHOPBHVSA-N 1 3 331.504 2.989 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC2(C)CC[NH+](CC3CC4(CCC4)C3)CC2)C1 ZINC001407129282 1368462256 /nfs/dbraw/zinc/46/22/56/1368462256.db2.gz LOXSUPIDBNYDCH-QGZVFWFLSA-N 1 3 347.547 2.879 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@]1(C)CCC[N@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001407298151 1368728311 /nfs/dbraw/zinc/72/83/11/1368728311.db2.gz IYGKYAWQPVODQH-FXAWDEMLSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@@H](C(=O)NC[C@@]1(C)CCC[N@@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001407298151 1368728316 /nfs/dbraw/zinc/72/83/16/1368728316.db2.gz IYGKYAWQPVODQH-FXAWDEMLSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)NC[C@]1(C)CCC[N@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001407298160 1368728338 /nfs/dbraw/zinc/72/83/38/1368728338.db2.gz IYGKYAWQPVODQH-XLIONFOSSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C(=O)NC[C@]1(C)CCC[N@@H+](CC2CC(C)(C)C2)C1)N(C)C ZINC001407298160 1368728342 /nfs/dbraw/zinc/72/83/42/1368728342.db2.gz IYGKYAWQPVODQH-XLIONFOSSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](c1cccc(Cl)c1)N1CC[C@@H](CNC(=O)CC[NH+](C)C)C1 ZINC001437718141 1387964982 /nfs/dbraw/zinc/96/49/82/1387964982.db2.gz DLPOZSWZJPLIQH-GJZGRUSLSA-N 1 3 337.895 2.791 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@H]1CC[C@H](CNC(=O)C2(N(C)C)CCC2)CC1 ZINC001407540769 1368960278 /nfs/dbraw/zinc/96/02/78/1368960278.db2.gz SBYJMFHGUJPNKF-ULQDDVLXSA-N 1 3 341.515 2.731 10 0 EFAEHO Cc1ccc(C[NH2+][C@@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)cc1C ZINC001407564497 1368993508 /nfs/dbraw/zinc/99/35/08/1368993508.db2.gz WDKCGIVTWRHWJI-AZUAARDMSA-N 1 3 345.531 2.970 10 0 EFAEHO CC[C@H](F)CN1CCC2(CN(C(=O)[C@H](CC)[NH+](CC)CC)C2)CC1 ZINC001407714773 1369152396 /nfs/dbraw/zinc/15/23/96/1369152396.db2.gz IZQJNIGGHBXJKT-IRXDYDNUSA-N 1 3 341.515 2.779 10 0 EFAEHO C[C@@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]CC2CC(F)(F)C2)CCC1 ZINC001407819687 1369269486 /nfs/dbraw/zinc/26/94/86/1369269486.db2.gz GEBAEAKFRIHUAJ-OKILXGFUSA-N 1 3 343.462 2.533 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]C2(CNC(=O)CN(C)C(C)C)CCC2)c1 ZINC001407827954 1369280325 /nfs/dbraw/zinc/28/03/25/1369280325.db2.gz TULHSALAZHRVNV-UHFFFAOYSA-N 1 3 331.504 2.772 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@H+](Cc2ccsc2)CC1)N(C)C ZINC001407843446 1369297088 /nfs/dbraw/zinc/29/70/88/1369297088.db2.gz BHQDOQYAUAKJSV-IAGOWNOFSA-N 1 3 337.533 2.805 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@@H]1CCC[N@@H+](Cc2ccsc2)CC1)N(C)C ZINC001407843446 1369297094 /nfs/dbraw/zinc/29/70/94/1369297094.db2.gz BHQDOQYAUAKJSV-IAGOWNOFSA-N 1 3 337.533 2.805 10 0 EFAEHO Cc1ccc(CCC[N@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001437742298 1387993294 /nfs/dbraw/zinc/99/32/94/1387993294.db2.gz SGKGQSHMCLSPHK-HXUWFJFHSA-N 1 3 345.531 2.706 10 0 EFAEHO Cc1ccc(CCC[N@@H+]2CC[C@H](CNC(=O)CN(C)C(C)C)C2)cc1 ZINC001437742298 1387993298 /nfs/dbraw/zinc/99/32/98/1387993298.db2.gz SGKGQSHMCLSPHK-HXUWFJFHSA-N 1 3 345.531 2.706 10 0 EFAEHO CCC1([NH2+]CCc2cccs2)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001407963674 1369468814 /nfs/dbraw/zinc/46/88/14/1369468814.db2.gz KAUJIVSSGURYCC-KRWDZBQOSA-N 1 3 349.544 2.746 10 0 EFAEHO C[NH+](C)CCC(=O)N1CCC[C@H]([C@@H]2CCCN(C/C=C/Cl)C2)C1 ZINC001407968544 1369476334 /nfs/dbraw/zinc/47/63/34/1369476334.db2.gz XWMAMGAVIXROPD-CAXWLTTCSA-N 1 3 341.927 2.641 10 0 EFAEHO CC[C@@H](F)C[NH2+]C1(CC)CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001407977950 1369486149 /nfs/dbraw/zinc/48/61/49/1369486149.db2.gz FEGLVNOZZWJGED-HZPDHXFCSA-N 1 3 329.504 2.682 10 0 EFAEHO C[C@@H](F)CCN1Cc2ccccc2C[C@H]1CNC(=O)CCC[NH+](C)C ZINC001407996076 1369507822 /nfs/dbraw/zinc/50/78/22/1369507822.db2.gz CQKRAQWWHKTLLU-APWZRJJASA-N 1 3 349.494 2.619 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(CC)([NH2+]C/C=C/Cl)CC1 ZINC001408003499 1369516584 /nfs/dbraw/zinc/51/65/84/1369516584.db2.gz PSQBYPLLZWOQEB-BPLPYTOXSA-N 1 3 341.927 2.974 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001408017774 1369530877 /nfs/dbraw/zinc/53/08/77/1369530877.db2.gz VGIYXNKGSRPBAN-NRFANRHFSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001408017774 1369530882 /nfs/dbraw/zinc/53/08/82/1369530882.db2.gz VGIYXNKGSRPBAN-NRFANRHFSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2ccc(C3CC3)cc2)[C@@H](C)C1 ZINC001408080002 1369587367 /nfs/dbraw/zinc/58/73/67/1369587367.db2.gz AKXKNCCLJHUVMZ-JXFKEZNVSA-N 1 3 343.515 2.841 10 0 EFAEHO Cc1ccc(F)cc1CN1CC[C@@H](NC(=O)CC[NH+](C)C)C(C)(C)C1 ZINC001408109529 1369614643 /nfs/dbraw/zinc/61/46/43/1369614643.db2.gz BCBXRRNBDOLBHP-GOSISDBHSA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@@H]1CC[N@H+](CC(=O)N2CCC(C)(NC/C(Cl)=C\Cl)CC2)C1 ZINC001408119498 1369621709 /nfs/dbraw/zinc/62/17/09/1369621709.db2.gz KZTPDTJJWJBFTJ-OZYJXZHSSA-N 1 3 348.318 2.618 10 0 EFAEHO C[C@@H]1CC[N@@H+](CC(=O)N2CCC(C)(NC/C(Cl)=C\Cl)CC2)C1 ZINC001408119498 1369621714 /nfs/dbraw/zinc/62/17/14/1369621714.db2.gz KZTPDTJJWJBFTJ-OZYJXZHSSA-N 1 3 348.318 2.618 10 0 EFAEHO CC(C)CC[N@@H+]1CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C[C@H]1C ZINC001408188536 1369695206 /nfs/dbraw/zinc/69/52/06/1369695206.db2.gz QIFITRLCTSTSFV-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)CC[N@H+]1CC[C@@H](NC(=O)CN(C)CC(C)(C)C)C[C@H]1C ZINC001408188536 1369695211 /nfs/dbraw/zinc/69/52/11/1369695211.db2.gz QIFITRLCTSTSFV-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001499902208 1402846830 /nfs/dbraw/zinc/84/68/30/1402846830.db2.gz VRXUTUMKPQCDAL-KBPBESRZSA-N 1 3 348.318 2.760 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N1CCC[C@H]1CNCC=C(Cl)Cl ZINC001499902208 1402846835 /nfs/dbraw/zinc/84/68/35/1402846835.db2.gz VRXUTUMKPQCDAL-KBPBESRZSA-N 1 3 348.318 2.760 10 0 EFAEHO CCCCN1CCc2ccccc2[C@H]1CNC(=O)C[C@H]1CC[N@H+](C)C1 ZINC001408251104 1369751881 /nfs/dbraw/zinc/75/18/81/1369751881.db2.gz HSESMXZUOHTRQX-YLJYHZDGSA-N 1 3 343.515 2.844 10 0 EFAEHO CCCCN1CCc2ccccc2[C@H]1CNC(=O)C[C@H]1CC[N@@H+](C)C1 ZINC001408251104 1369751884 /nfs/dbraw/zinc/75/18/84/1369751884.db2.gz HSESMXZUOHTRQX-YLJYHZDGSA-N 1 3 343.515 2.844 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN1CC[C@H](C)C1)C[C@H]1CCC(F)(F)C1 ZINC001437763028 1388034263 /nfs/dbraw/zinc/03/42/63/1388034263.db2.gz WQTUBHKPXMDHQR-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN1CC[C@H](C)C1)C[C@H]1CCC(F)(F)C1 ZINC001437763028 1388034268 /nfs/dbraw/zinc/03/42/68/1388034268.db2.gz WQTUBHKPXMDHQR-HOTGVXAUSA-N 1 3 345.478 2.592 10 0 EFAEHO c1cn(-c2csc(CNC3CC[NH+](C[C@H]4CCOC4)CC3)c2)cn1 ZINC001414094144 1370042003 /nfs/dbraw/zinc/04/20/03/1370042003.db2.gz ZAXDILLRMIEMFK-OAHLLOKOSA-N 1 3 346.500 2.524 10 0 EFAEHO CC[C@@H](C(=O)N(C)CC[NH2+][C@@H]1CCc2ccc(Cl)cc21)N(C)C ZINC001437857066 1388145520 /nfs/dbraw/zinc/14/55/20/1388145520.db2.gz MRTIVSYWKPSPIT-SJORKVTESA-N 1 3 337.895 2.716 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCCN1C(C)C)[C@@H]1CC[N@H+](CCCF)C1 ZINC001437896419 1388190859 /nfs/dbraw/zinc/19/08/59/1388190859.db2.gz SDBYCRBGKIIWDM-SJORKVTESA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCCN1C(C)C)[C@@H]1CC[N@@H+](CCCF)C1 ZINC001437896419 1388190863 /nfs/dbraw/zinc/19/08/63/1388190863.db2.gz SDBYCRBGKIIWDM-SJORKVTESA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCC[N@@H+]1C(C)C)[C@@H]1CCN(CCCF)C1 ZINC001437896419 1388190865 /nfs/dbraw/zinc/19/08/65/1388190865.db2.gz SDBYCRBGKIIWDM-SJORKVTESA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(C(=O)[C@@H]1CCC[N@H+]1C(C)C)[C@@H]1CCN(CCCF)C1 ZINC001437896419 1388190866 /nfs/dbraw/zinc/19/08/66/1388190866.db2.gz SDBYCRBGKIIWDM-SJORKVTESA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(C(=O)[C@H]1CCCN1C(C)C)[C@H]1CC[N@H+](CCCF)C1 ZINC001437896413 1388191119 /nfs/dbraw/zinc/19/11/19/1388191119.db2.gz SDBYCRBGKIIWDM-DLBZAZTESA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(C(=O)[C@H]1CCCN1C(C)C)[C@H]1CC[N@@H+](CCCF)C1 ZINC001437896413 1388191127 /nfs/dbraw/zinc/19/11/27/1388191127.db2.gz SDBYCRBGKIIWDM-DLBZAZTESA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(C(=O)[C@H]1CCC[N@@H+]1C(C)C)[C@H]1CCN(CCCF)C1 ZINC001437896413 1388191133 /nfs/dbraw/zinc/19/11/33/1388191133.db2.gz SDBYCRBGKIIWDM-DLBZAZTESA-N 1 3 327.488 2.532 10 0 EFAEHO CCCN(C(=O)[C@H]1CCC[N@H+]1C(C)C)[C@H]1CCN(CCCF)C1 ZINC001437896413 1388191136 /nfs/dbraw/zinc/19/11/36/1388191136.db2.gz SDBYCRBGKIIWDM-DLBZAZTESA-N 1 3 327.488 2.532 10 0 EFAEHO C[C@H](C[NH2+]Cc1ccsc1)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001439152260 1389016946 /nfs/dbraw/zinc/01/69/46/1389016946.db2.gz HLHOCRXMPUJWQN-DYVFJYSZSA-N 1 3 341.496 2.555 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1 ZINC001417646966 1373121152 /nfs/dbraw/zinc/12/11/52/1373121152.db2.gz WRSDTYCGFJLDQF-AQNXPRMDSA-N 1 3 343.515 2.888 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1 ZINC001417646968 1373121415 /nfs/dbraw/zinc/12/14/15/1373121415.db2.gz WRSDTYCGFJLDQF-XUVXKRRUSA-N 1 3 343.515 2.888 10 0 EFAEHO CCCN(CCN1CCCC1)C(=O)c1cccc(CC[NH+](C)C)c1 ZINC001417791299 1373257964 /nfs/dbraw/zinc/25/79/64/1373257964.db2.gz NBYWSMXWJIAMCV-UHFFFAOYSA-N 1 3 331.504 2.739 10 0 EFAEHO Cc1cccc(C[NH2+][C@H]2C[C@H](CNC(=O)CN3[C@@H](C)CC[C@@H]3C)C2)c1 ZINC001417797636 1373264522 /nfs/dbraw/zinc/26/45/22/1373264522.db2.gz FRKSDBPMNDUTQL-ZULIPRJHSA-N 1 3 343.515 2.852 10 0 EFAEHO CC[C@H](F)C[NH2+][C@H]1C[C@H](CNC(=O)c2cccc(CN(C)C)c2)C1 ZINC001417801192 1373270063 /nfs/dbraw/zinc/27/00/63/1373270063.db2.gz WWKKQJMVQULIDK-SZMVWBNQSA-N 1 3 335.467 2.594 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@@H]([NH2+]CC2CCC(C)CC2)C1 ZINC001417812141 1373283230 /nfs/dbraw/zinc/28/32/30/1373283230.db2.gz HKVYCOHWDSAKRK-DQVOVIAYSA-N 1 3 346.519 2.961 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CC[C@@H]([NH2+]Cc2ccc(F)cc2)C1)N(C)C ZINC001417813913 1373285353 /nfs/dbraw/zinc/28/53/53/1373285353.db2.gz OHFBOTHRMPYYPC-QXAKKESOSA-N 1 3 349.494 2.786 10 0 EFAEHO Cc1ccccc1C[NH2+][C@@H]1CC[C@H](CNC(=O)CN2CC[C@H](C)C2)C1 ZINC001417816379 1373287774 /nfs/dbraw/zinc/28/77/74/1373287774.db2.gz QJVKJZYMRCJQBR-XKGZKEIXSA-N 1 3 343.515 2.711 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@@H]([NH2+]CC2CC3(CCC3)C2)C1 ZINC001417816692 1373288760 /nfs/dbraw/zinc/28/87/60/1373288760.db2.gz ZBSNUHQPTKTVDQ-DOTOQJQBSA-N 1 3 344.503 2.715 10 0 EFAEHO Cc1cc(CN2CC[C@H](NC(=O)C3(C[NH+](C)C)CC3)[C@H]2C)c(C)s1 ZINC001417851006 1373335421 /nfs/dbraw/zinc/33/54/21/1373335421.db2.gz YQCVVNFVVYGVCF-PBHICJAKSA-N 1 3 349.544 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCCC[C@H]1[C@H](C)[NH2+]CCc1ccccc1 ZINC001417893352 1373381487 /nfs/dbraw/zinc/38/14/87/1373381487.db2.gz UJYKAFZSSURHOX-ICSRJNTNSA-N 1 3 345.531 2.929 10 0 EFAEHO CC(C)CCC[NH+]1CCC2(C[C@@H]2NC(=O)C2(N(C)C)CCC2)CC1 ZINC001417956924 1373450574 /nfs/dbraw/zinc/45/05/74/1373450574.db2.gz HWLFXXMMDPUKCR-KRWDZBQOSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)[C@@H](C(=O)NC[C@H]([NH2+]CC1CC2(CCC2)C1)C1CC1)N(C)C ZINC001417984916 1373487105 /nfs/dbraw/zinc/48/71/05/1373487105.db2.gz JKWSXOOWWLUBOS-ROUUACIJSA-N 1 3 335.536 2.637 10 0 EFAEHO Cc1ccc(F)c(C[NH2+][C@@H](CNC(=O)C2(N(C)C)CCC2)C2CC2)c1 ZINC001417986408 1373489638 /nfs/dbraw/zinc/48/96/38/1373489638.db2.gz MIETXZWBJKYMCT-SFHVURJKSA-N 1 3 347.478 2.603 10 0 EFAEHO C[C@@H]1CCN(CC(=O)NC[C@@H]([NH2+]C/C=C/c2ccccc2)C2CC2)C1 ZINC001417997733 1373502984 /nfs/dbraw/zinc/50/29/84/1373502984.db2.gz SQNCGOXUHYSCPU-KZJOSYIESA-N 1 3 341.499 2.526 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@H+](C)CC2CC(F)(F)C2)C1 ZINC001418021335 1373533401 /nfs/dbraw/zinc/53/34/01/1373533401.db2.gz LEVRCNCFPQPDQL-OAHLLOKOSA-N 1 3 345.478 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C[N@@H+](C)CC2CC(F)(F)C2)C1 ZINC001418021335 1373533405 /nfs/dbraw/zinc/53/34/05/1373533405.db2.gz LEVRCNCFPQPDQL-OAHLLOKOSA-N 1 3 345.478 2.542 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@H]1CC[N@H+](CC2CCC2)C1 ZINC001437951828 1388269810 /nfs/dbraw/zinc/26/98/10/1388269810.db2.gz WSVLKCIWOBVPNE-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)NCC[C@H]1CC[N@@H+](CC2CCC2)C1 ZINC001437951828 1388269815 /nfs/dbraw/zinc/26/98/15/1388269815.db2.gz WSVLKCIWOBVPNE-RBUKOAKNSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@H]2CCCc3ccccc32)C1 ZINC001418078091 1373582258 /nfs/dbraw/zinc/58/22/58/1373582258.db2.gz PGECYDYKPRFECM-LNLFQRSKSA-N 1 3 329.488 2.641 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@H]2C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C2)c1 ZINC001418095325 1373598466 /nfs/dbraw/zinc/59/84/66/1373598466.db2.gz RWHYYFKIYRTQFA-NWGLXNPWSA-N 1 3 347.503 2.579 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2F)C1)N(C)C ZINC001418095949 1373599556 /nfs/dbraw/zinc/59/95/56/1373599556.db2.gz WKUGKNNQGKTROC-BSXFFOKHSA-N 1 3 335.467 2.710 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](N[C@H](C)c2ccccc2F)C1 ZINC001418109644 1373613589 /nfs/dbraw/zinc/61/35/89/1373613589.db2.gz UVTXGYANJMZGCV-OAGGEKHMSA-N 1 3 335.467 2.855 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](N[C@H](C)c2ccccc2F)C1 ZINC001418109644 1373613594 /nfs/dbraw/zinc/61/35/94/1373613594.db2.gz UVTXGYANJMZGCV-OAGGEKHMSA-N 1 3 335.467 2.855 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc3c(c2)CCC3)C1 ZINC001418110019 1373613926 /nfs/dbraw/zinc/61/39/26/1373613926.db2.gz XPVQWHAAUBHCSP-YSGRDPCXSA-N 1 3 343.515 2.815 10 0 EFAEHO CCC[N@H+](C)CCC(=O)N[C@H]1C[C@@H](N[C@@H](C)c2ccccc2F)C1 ZINC001418109642 1373614120 /nfs/dbraw/zinc/61/41/20/1373614120.db2.gz UVTXGYANJMZGCV-HRCADAONSA-N 1 3 335.467 2.855 10 0 EFAEHO CCC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](N[C@@H](C)c2ccccc2F)C1 ZINC001418109642 1373614131 /nfs/dbraw/zinc/61/41/31/1373614131.db2.gz UVTXGYANJMZGCV-HRCADAONSA-N 1 3 335.467 2.855 10 0 EFAEHO Cc1cccc(C[N@H+]2CCC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001418126088 1373643684 /nfs/dbraw/zinc/64/36/84/1373643684.db2.gz BSXZETGQAOERFN-UYAOXDASSA-N 1 3 343.515 2.665 10 0 EFAEHO Cc1cccc(C[N@@H+]2CCC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001418126088 1373643691 /nfs/dbraw/zinc/64/36/91/1373643691.db2.gz BSXZETGQAOERFN-UYAOXDASSA-N 1 3 343.515 2.665 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CCCN(Cc2ccccn2)C1)[NH+](CC)CC ZINC001418128748 1373648509 /nfs/dbraw/zinc/64/85/09/1373648509.db2.gz MHRYSCALEHGCFK-IEBWSBKVSA-N 1 3 346.519 2.530 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC001437956917 1388274027 /nfs/dbraw/zinc/27/40/27/1388274027.db2.gz IJWHSXVTXLXKHW-HZPDHXFCSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC001437956917 1388274034 /nfs/dbraw/zinc/27/40/34/1388274034.db2.gz IJWHSXVTXLXKHW-HZPDHXFCSA-N 1 3 345.478 2.590 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C[C@@H]1CCCN(C(=O)CN(C)C(C)C)C1 ZINC001418147393 1373674176 /nfs/dbraw/zinc/67/41/76/1373674176.db2.gz QYVUTXRQDYWKBN-KRWDZBQOSA-N 1 3 349.494 2.803 10 0 EFAEHO Cc1ccc(F)c(CNC[C@@H]2CCCCN2C(=O)CC[NH+](C)C)c1 ZINC001418164457 1373712984 /nfs/dbraw/zinc/71/29/84/1373712984.db2.gz TWOKPOMUMGCIEV-KRWDZBQOSA-N 1 3 335.467 2.557 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@H]1CCCCN1C(=O)CN(C)CC(C)(C)C ZINC001418169785 1373719948 /nfs/dbraw/zinc/71/99/48/1373719948.db2.gz UFFAIFIRIBYIPI-HZPDHXFCSA-N 1 3 329.504 2.683 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H]2CCCCN2C(=O)CN(C)C(C)C)c1 ZINC001418173557 1373727355 /nfs/dbraw/zinc/72/73/55/1373727355.db2.gz YVCATANUCBWPLD-LJQANCHMSA-N 1 3 331.504 2.806 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@@H]1CCC[N@H+](CC2CCC2)C1 ZINC001418173465 1373727635 /nfs/dbraw/zinc/72/76/35/1373727635.db2.gz MGNYQDBZXZXRJA-SJLPKXTDSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@@H](NC(=O)C(C)(C)N1CCCC1)[C@@H]1CCC[N@@H+](CC2CCC2)C1 ZINC001418173465 1373727638 /nfs/dbraw/zinc/72/76/38/1373727638.db2.gz MGNYQDBZXZXRJA-SJLPKXTDSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]CC1CCC2(CC2)CC1 ZINC001418221898 1373777440 /nfs/dbraw/zinc/77/74/40/1373777440.db2.gz OLHXENCCGOQMMG-FUHWJXTLSA-N 1 3 335.536 2.924 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1)NCc1ccsc1 ZINC001418227955 1373783846 /nfs/dbraw/zinc/78/38/46/1373783846.db2.gz PZWUYDYKAAKWJK-RDJZCZTQSA-N 1 3 349.544 2.997 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@H+](C2CCCCC2)C1)NCc1ccsc1 ZINC001418227955 1373783852 /nfs/dbraw/zinc/78/38/52/1373783852.db2.gz PZWUYDYKAAKWJK-RDJZCZTQSA-N 1 3 349.544 2.997 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+][C@H](C)CNC(=O)CN(C)C2CCC2)c1 ZINC001418234934 1373789927 /nfs/dbraw/zinc/78/99/27/1373789927.db2.gz MFMBMMYHWKUTNE-IAGOWNOFSA-N 1 3 331.504 2.943 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1)NC/C=C\Cl ZINC001418262692 1373828883 /nfs/dbraw/zinc/82/88/83/1373828883.db2.gz BLBJOEIYVYWYAS-MWGCNAMGSA-N 1 3 327.900 2.630 10 0 EFAEHO C[C@H](CNC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1)NC/C=C\Cl ZINC001418262692 1373828890 /nfs/dbraw/zinc/82/88/90/1373828890.db2.gz BLBJOEIYVYWYAS-MWGCNAMGSA-N 1 3 327.900 2.630 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@H](C)CNC(=O)CN(C)CC(C)(C)C)c1 ZINC001418276359 1373846840 /nfs/dbraw/zinc/84/68/40/1373846840.db2.gz PWDHOMXBGXLUHD-HZPDHXFCSA-N 1 3 349.519 2.828 10 0 EFAEHO C[C@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+][C@@H]1CCc2ccccc21 ZINC001418277576 1373849161 /nfs/dbraw/zinc/84/91/61/1373849161.db2.gz XMUMSZPIRKQKAF-CRAIPNDOSA-N 1 3 331.504 2.746 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H](C)[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001418301356 1373878485 /nfs/dbraw/zinc/87/84/85/1373878485.db2.gz WCVIKXSHFYPADD-SUMWQHHRSA-N 1 3 337.895 2.763 10 0 EFAEHO C[C@]1(NC(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)CCN(Cc2ccccc2)C1 ZINC001418345608 1373921484 /nfs/dbraw/zinc/92/14/84/1373921484.db2.gz DLKCMTQLGHWVCQ-ZVDOUQERSA-N 1 3 341.499 2.784 10 0 EFAEHO C[C@]1(NC(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)CCN(Cc2ccccc2)C1 ZINC001418345608 1373921486 /nfs/dbraw/zinc/92/14/86/1373921486.db2.gz DLKCMTQLGHWVCQ-ZVDOUQERSA-N 1 3 341.499 2.784 10 0 EFAEHO C[C@H](CCNC(=O)[C@@H]1CCCN1C)[NH2+]Cc1cc(F)ccc1Cl ZINC001418393539 1373975151 /nfs/dbraw/zinc/97/51/51/1373975151.db2.gz JAMJSZBDKVTFGS-WBMJQRKESA-N 1 3 341.858 2.558 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+][C@H](C)CCNC(=O)CN(C)C(C)C ZINC001418443570 1374033609 /nfs/dbraw/zinc/03/36/09/1374033609.db2.gz TYUOGKDLXZUVMM-OAHLLOKOSA-N 1 3 339.911 2.973 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CC[C@@H]3CCCC[N@H+]23)c(C)c1 ZINC001418476985 1374070640 /nfs/dbraw/zinc/07/06/40/1374070640.db2.gz RQOCGDSGLIRUAB-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)c(C)c1 ZINC001418476985 1374070642 /nfs/dbraw/zinc/07/06/42/1374070642.db2.gz RQOCGDSGLIRUAB-VQTJNVASSA-N 1 3 343.515 2.868 10 0 EFAEHO CN(CCNC(=O)C(C)(C)[NH+]1CCCC1)[C@H]1CCc2ccc(F)cc21 ZINC001418490611 1374085312 /nfs/dbraw/zinc/08/53/12/1374085312.db2.gz XGXTUBPCBQHTIW-SFHVURJKSA-N 1 3 347.478 2.735 10 0 EFAEHO Cc1cccc(CN(C)CCNC(=O)[C@@]2(F)CC[N@@H+](C(C)(C)C)C2)c1 ZINC001418493129 1374089587 /nfs/dbraw/zinc/08/95/87/1374089587.db2.gz GMDJRWPINPFLFM-HXUWFJFHSA-N 1 3 349.494 2.756 10 0 EFAEHO Cc1cccc(CN(C)CCNC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)c1 ZINC001418493129 1374089590 /nfs/dbraw/zinc/08/95/90/1374089590.db2.gz GMDJRWPINPFLFM-HXUWFJFHSA-N 1 3 349.494 2.756 10 0 EFAEHO Cc1ccc(CN(C)CCNC(=O)[C@H](C(C)C)[NH+]2CCCC2)cc1C ZINC001418525634 1374134492 /nfs/dbraw/zinc/13/44/92/1374134492.db2.gz ILVKUZIFUCIQJX-FQEVSTJZSA-N 1 3 345.531 2.972 10 0 EFAEHO CN(Cc1ccccc1Cl)C[C@H]1CCN(C(=O)CC[NH+](C)C)C1 ZINC001437989135 1388300745 /nfs/dbraw/zinc/30/07/45/1388300745.db2.gz HMPNQQQKJZXJJZ-OAHLLOKOSA-N 1 3 337.895 2.572 10 0 EFAEHO CN(C[C@@H]1CCN1[C@H]1CCc2ccccc21)C(=O)C1(C[NH+](C)C)CC1 ZINC001418586690 1374228387 /nfs/dbraw/zinc/22/83/87/1374228387.db2.gz FZPZPMBZWNNLDE-HKUYNNGSSA-N 1 3 341.499 2.548 10 0 EFAEHO CC(C)Oc1cccc(CN2CCC[C@H]2CNC(=O)CC[NH+](C)C)c1 ZINC001418630969 1374296140 /nfs/dbraw/zinc/29/61/40/1374296140.db2.gz PNPXJJYZYSJVLS-SFHVURJKSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CC[N@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001418673714 1374349918 /nfs/dbraw/zinc/34/99/18/1374349918.db2.gz OSTDBBNGRSVYCI-RBUKOAKNSA-N 1 3 349.563 2.981 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H]1CC[N@@H+](CC2CCC3(CC3)CC2)C1)N(C)C ZINC001418673714 1374349923 /nfs/dbraw/zinc/34/99/23/1374349923.db2.gz OSTDBBNGRSVYCI-RBUKOAKNSA-N 1 3 349.563 2.981 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC[C@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001418681287 1374362376 /nfs/dbraw/zinc/36/23/76/1374362376.db2.gz IPBUPDMRYGFJJD-IAGOWNOFSA-N 1 3 349.906 2.620 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC[C@H]2CCN(Cc3ccc(Cl)cc3)C2)C1 ZINC001418681287 1374362380 /nfs/dbraw/zinc/36/23/80/1374362380.db2.gz IPBUPDMRYGFJJD-IAGOWNOFSA-N 1 3 349.906 2.620 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@@H+]([C@@H](C)c2cccc(OC)c2)C1 ZINC001418692033 1374374870 /nfs/dbraw/zinc/37/48/70/1374374870.db2.gz QVIKTELWIRWNBP-DLBZAZTESA-N 1 3 347.503 2.536 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]1CC[N@H+]([C@@H](C)c2cccc(OC)c2)C1 ZINC001418692033 1374374875 /nfs/dbraw/zinc/37/48/75/1374374875.db2.gz QVIKTELWIRWNBP-DLBZAZTESA-N 1 3 347.503 2.536 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@@H+]1CC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001418697401 1374382696 /nfs/dbraw/zinc/38/26/96/1374382696.db2.gz IIJMXXHSKAQVHP-ROUUACIJSA-N 1 3 331.504 2.834 10 0 EFAEHO Cc1ccccc1[C@H](C)[N@H+]1CC[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001418697401 1374382700 /nfs/dbraw/zinc/38/27/00/1374382700.db2.gz IIJMXXHSKAQVHP-ROUUACIJSA-N 1 3 331.504 2.834 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+](Cc2ccccc2C2CC2)C1 ZINC001418697192 1374382855 /nfs/dbraw/zinc/38/28/55/1374382855.db2.gz HZRQURKOLXDIEN-KRWDZBQOSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2C2CC2)C1 ZINC001418697192 1374382861 /nfs/dbraw/zinc/38/28/61/1374382861.db2.gz HZRQURKOLXDIEN-KRWDZBQOSA-N 1 3 343.515 2.842 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC001418701031 1374387275 /nfs/dbraw/zinc/38/72/75/1374387275.db2.gz UKTCNSXABCXNMM-HOTGVXAUSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC001418701031 1374387276 /nfs/dbraw/zinc/38/72/76/1374387276.db2.gz UKTCNSXABCXNMM-HOTGVXAUSA-N 1 3 345.478 2.590 10 0 EFAEHO CN(CC(=O)N1CCCCC[C@@H]([NH2+]CCC(F)(F)F)C1)C1CCC1 ZINC001418786284 1374499920 /nfs/dbraw/zinc/49/99/20/1374499920.db2.gz BIWKTXABWCQAGW-CQSZACIVSA-N 1 3 349.441 2.784 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CCCC(C)(C)C)[C@@H]1C)N(C)C ZINC001418804092 1374524482 /nfs/dbraw/zinc/52/44/82/1374524482.db2.gz CVMISYDWCLZOQH-IXDOHACOSA-N 1 3 325.541 2.978 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CCCC(C)(C)C)[C@@H]1C)N(C)C ZINC001418804092 1374524487 /nfs/dbraw/zinc/52/44/87/1374524487.db2.gz CVMISYDWCLZOQH-IXDOHACOSA-N 1 3 325.541 2.978 10 0 EFAEHO C[NH+](C)CCCC(=O)N[C@H]1CCN(C/C=C\Cl)CC(C)(C)C1 ZINC001418823966 1374544477 /nfs/dbraw/zinc/54/44/77/1374544477.db2.gz HIHRBIIBMZTZST-AJHXJQRKSA-N 1 3 329.916 2.688 10 0 EFAEHO CC[C@H](F)CN1CC[C@H](NC(=O)CCC[NH+](C)C)CC(C)(C)C1 ZINC001418824455 1374545518 /nfs/dbraw/zinc/54/55/18/1374545518.db2.gz JXANYXKAJSRHMN-HOTGVXAUSA-N 1 3 329.504 2.683 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)C[C@@H]1CC[N@H+](C)C1)c1ccccc1Cl ZINC001418825753 1374547978 /nfs/dbraw/zinc/54/79/78/1374547978.db2.gz HHYUCDMHXOABFM-CABCVRRESA-N 1 3 337.895 2.791 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)C[C@@H]1CC[N@@H+](C)C1)c1ccccc1Cl ZINC001418825753 1374547981 /nfs/dbraw/zinc/54/79/81/1374547981.db2.gz HHYUCDMHXOABFM-CABCVRRESA-N 1 3 337.895 2.791 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([C@@H](C)[NH2+]Cc2ccccc2)CC1 ZINC001418841038 1374563973 /nfs/dbraw/zinc/56/39/73/1374563973.db2.gz DFTQNBJQEXSMFA-QGZVFWFLSA-N 1 3 331.504 2.744 10 0 EFAEHO C[C@@H]([NH2+]C/C(Cl)=C\Cl)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001418843071 1374565493 /nfs/dbraw/zinc/56/54/93/1374565493.db2.gz LJLLVXMVLOTDLS-QQFZQELXSA-N 1 3 348.318 2.618 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@H+](Cc2ccc(F)cc2C)C1)N(C)C ZINC001418913049 1374678986 /nfs/dbraw/zinc/67/89/86/1374678986.db2.gz KLNLKFNCNTVFSD-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO CC[C@H](C(=O)NCC[C@H]1CC[N@@H+](Cc2ccc(F)cc2C)C1)N(C)C ZINC001418913049 1374678990 /nfs/dbraw/zinc/67/89/90/1374678990.db2.gz KLNLKFNCNTVFSD-QFBILLFUSA-N 1 3 349.494 2.803 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](C[N@H+](C)CCCC3CCC3)C2)C1 ZINC001418935694 1374702954 /nfs/dbraw/zinc/70/29/54/1374702954.db2.gz FSMSBFYMUQBCIY-PKOBYXMFSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CC[C@H](C[N@@H+](C)CCCC3CCC3)C2)C1 ZINC001418935694 1374702957 /nfs/dbraw/zinc/70/29/57/1374702957.db2.gz FSMSBFYMUQBCIY-PKOBYXMFSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)C[N@H+](C)C[C@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001418942751 1374714601 /nfs/dbraw/zinc/71/46/01/1374714601.db2.gz WKTPACFWOKAKRI-VQIMIIECSA-N 1 3 341.515 2.635 10 0 EFAEHO CC(C)C[N@@H+](C)C[C@H]1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001418942751 1374714607 /nfs/dbraw/zinc/71/46/07/1374714607.db2.gz WKTPACFWOKAKRI-VQIMIIECSA-N 1 3 341.515 2.635 10 0 EFAEHO Cc1cccc(CN2CCC[C@@H](NC(=O)CC[C@H]3CCC[N@H+]3C)C2)c1 ZINC001418951829 1374726871 /nfs/dbraw/zinc/72/68/71/1374726871.db2.gz RQIRHOOAGVRICX-WOJBJXKFSA-N 1 3 343.515 2.950 10 0 EFAEHO Cc1cccc(CN2CCC[C@@H](NC(=O)CC[C@H]3CCC[N@@H+]3C)C2)c1 ZINC001418951829 1374726874 /nfs/dbraw/zinc/72/68/74/1374726874.db2.gz RQIRHOOAGVRICX-WOJBJXKFSA-N 1 3 343.515 2.950 10 0 EFAEHO CC[C@@H](CNC(=O)[C@H]1CCCN1C(C)C)[NH2+]Cc1csc(C)c1 ZINC001419181199 1374928304 /nfs/dbraw/zinc/92/83/04/1374928304.db2.gz CZWFUVJTVZSNTP-DLBZAZTESA-N 1 3 337.533 2.914 10 0 EFAEHO CC[C@H](CNC(=O)[C@H](C)N1CCCCCC1)[NH2+]CCC(F)(F)F ZINC001419237564 1374984400 /nfs/dbraw/zinc/98/44/00/1374984400.db2.gz QXIKGQQMLADUGU-UONOGXRCSA-N 1 3 337.430 2.688 10 0 EFAEHO C[C@@H](NCC1(NC(=O)CC[NH+](C)C)CCCC1)c1ccccc1F ZINC001419312085 1375081824 /nfs/dbraw/zinc/08/18/24/1375081824.db2.gz FNBHXODKBSQFBG-OAHLLOKOSA-N 1 3 335.467 2.857 10 0 EFAEHO CC[C@@H](F)CN(C)C[C@@H]1CCCN(C(=O)C23CCC[NH+]2CCC3)C1 ZINC001419342632 1375133713 /nfs/dbraw/zinc/13/37/13/1375133713.db2.gz KTOCEIZZLHAYRA-DLBZAZTESA-N 1 3 339.499 2.533 10 0 EFAEHO C[C@@H](C(=O)N[C@](C)(C[NH2+]CC1CCC1)C1CC1)N1CCCCCC1 ZINC001419347562 1375141750 /nfs/dbraw/zinc/14/17/50/1375141750.db2.gz UGBZHTQNLXWFDG-OXJNMPFZSA-N 1 3 335.536 2.926 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[N@@H+](C)Cc2ccsc2)C1 ZINC001419352152 1375150399 /nfs/dbraw/zinc/15/03/99/1375150399.db2.gz WOEBCMRXWJAHOB-INIZCTEOSA-N 1 3 337.533 2.760 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C[N@H+](C)Cc2ccsc2)C1 ZINC001419352152 1375150394 /nfs/dbraw/zinc/15/03/94/1375150394.db2.gz WOEBCMRXWJAHOB-INIZCTEOSA-N 1 3 337.533 2.760 10 0 EFAEHO CC[C@H](N[C@H]1C[C@H](NC(=O)CC[NH+](C)C)C1)c1ccc(F)cc1F ZINC001419415854 1375243747 /nfs/dbraw/zinc/24/37/47/1375243747.db2.gz FQLNMKTZXFMDMI-ZQIUZPCESA-N 1 3 339.430 2.604 10 0 EFAEHO CCCN(C)CC(=O)NCCC1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001419417583 1375246156 /nfs/dbraw/zinc/24/61/56/1375246156.db2.gz PZTKRUNVPZCVTN-UHFFFAOYSA-N 1 3 337.552 2.983 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1C[C@H](NCc2ccc(Cl)cc2Cl)C1 ZINC001419418788 1375247825 /nfs/dbraw/zinc/24/78/25/1375247825.db2.gz OMNLCTNHLISTET-HDJSIYSDSA-N 1 3 344.286 2.682 10 0 EFAEHO CC[C@@H](C(=O)N[C@H]1C[C@H]([NH2+][C@H]2CCc3ccc(Cl)cc32)C1)N(C)C ZINC001419426308 1375258293 /nfs/dbraw/zinc/25/82/93/1375258293.db2.gz KIOIRHTXRCTYME-LAQRGFTBSA-N 1 3 349.906 2.904 10 0 EFAEHO C[NH+](C)CCC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccc(Cl)cc1 ZINC001419444536 1375281740 /nfs/dbraw/zinc/28/17/40/1375281740.db2.gz KKAYERFUMZYRDD-AYHJJNSGSA-N 1 3 349.906 2.903 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@H+](Cc3ccsc3)CC[C@H]21 ZINC001419453842 1375294087 /nfs/dbraw/zinc/29/40/87/1375294087.db2.gz XYUQARFCBSLNMZ-QZTJIDSGSA-N 1 3 349.544 2.901 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]2C[N@@H+](Cc3ccsc3)CC[C@H]21 ZINC001419453842 1375294107 /nfs/dbraw/zinc/29/41/07/1375294107.db2.gz XYUQARFCBSLNMZ-QZTJIDSGSA-N 1 3 349.544 2.901 10 0 EFAEHO C[C@H]1CN(C(=O)C2C[NH+](C3CCCCC3)C2)CCN1C1CCCC1 ZINC001419490287 1375337412 /nfs/dbraw/zinc/33/74/12/1375337412.db2.gz SYVPRPLDHNWRAS-INIZCTEOSA-N 1 3 333.520 2.726 10 0 EFAEHO CCc1ccccc1C[N@H+]1CCC[C@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001419539722 1375416246 /nfs/dbraw/zinc/41/62/46/1375416246.db2.gz BSPBCKQTFAJYIG-YLJYHZDGSA-N 1 3 345.531 2.917 10 0 EFAEHO CCc1ccccc1C[N@@H+]1CCC[C@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001419539722 1375416247 /nfs/dbraw/zinc/41/62/47/1375416247.db2.gz BSPBCKQTFAJYIG-YLJYHZDGSA-N 1 3 345.531 2.917 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+]C[C@@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001419625229 1375572993 /nfs/dbraw/zinc/57/29/93/1375572993.db2.gz NKEGRCNTSADKMQ-IBGZPJMESA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](NC[C@H](C)N(C)C(=O)CC[NH+](C)C)c1cccc(Cl)c1F ZINC001419717482 1375763890 /nfs/dbraw/zinc/76/38/90/1375763890.db2.gz VOVLFFMYCFOYAP-QWHCGFSZSA-N 1 3 343.874 2.928 10 0 EFAEHO CCCc1ccc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@H](C)C2)cc1 ZINC001419719359 1375767013 /nfs/dbraw/zinc/76/70/13/1375767013.db2.gz KHSMLBHCPRTKEB-ROUUACIJSA-N 1 3 345.531 2.917 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC[C@@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001419735549 1375787036 /nfs/dbraw/zinc/78/70/36/1375787036.db2.gz QCBVCGAWNZIBPW-PBHICJAKSA-N 1 3 337.895 2.807 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)NC[C@H](C)[NH2+]Cc1cccc(Cl)c1 ZINC001419735554 1375787942 /nfs/dbraw/zinc/78/79/42/1375787942.db2.gz QCBVCGAWNZIBPW-WMLDXEAASA-N 1 3 337.895 2.807 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+]Cc1cccc(C(F)F)c1 ZINC001419756600 1375823218 /nfs/dbraw/zinc/82/32/18/1375823218.db2.gz CIIIPGFBIATSDX-CQSZACIVSA-N 1 3 341.446 2.901 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1cccc(F)c1 ZINC001419760396 1375828597 /nfs/dbraw/zinc/82/85/97/1375828597.db2.gz IJNZCJXYHAGZSE-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC001419770174 1375847002 /nfs/dbraw/zinc/84/70/02/1375847002.db2.gz IASDBHJIUCSSHC-SUMWQHHRSA-N 1 3 349.906 2.906 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@H](C)C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC001419774802 1375855003 /nfs/dbraw/zinc/85/50/03/1375855003.db2.gz YYFZEJWQZOAQJR-BEFAXECRSA-N 1 3 349.494 2.980 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+][C@H](C)CNC(=O)C2(N(C)C)CCC2)c1 ZINC001419776163 1375857321 /nfs/dbraw/zinc/85/73/21/1375857321.db2.gz NZDJIUKBEMOGBX-SJORKVTESA-N 1 3 331.504 2.943 10 0 EFAEHO CC[C@H](C(=O)NC[C@@H](C)[NH2+]Cc1ccc2ccccc2c1)N(C)C ZINC001419777538 1375859913 /nfs/dbraw/zinc/85/99/13/1375859913.db2.gz SVDZHZYTTSOGML-DNVCBOLYSA-N 1 3 327.472 2.774 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H](C)[C@H]1C[NH2+]CC1CC(C)(C)C1 ZINC001419849185 1375995108 /nfs/dbraw/zinc/99/51/08/1375995108.db2.gz SBXNTZRESKZRPN-SJLPKXTDSA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](C)CNC(=O)[C@]2(F)CCN(C(C)(C)C)C2)c1 ZINC001419852801 1376003715 /nfs/dbraw/zinc/00/37/15/1376003715.db2.gz PQACHPAKBPZSJO-JXFKEZNVSA-N 1 3 349.494 2.802 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](C)CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)c1 ZINC001419852803 1376004225 /nfs/dbraw/zinc/00/42/25/1376004225.db2.gz PQACHPAKBPZSJO-OXJNMPFZSA-N 1 3 349.494 2.802 10 0 EFAEHO COc1ccc(C[NH2+][C@@H](C)CNC(=O)[C@H](C)N2CCCCCC2)cc1 ZINC001419876968 1376050986 /nfs/dbraw/zinc/05/09/86/1376050986.db2.gz YZUGGSUZMUATTG-IRXDYDNUSA-N 1 3 347.503 2.554 10 0 EFAEHO Cc1cc(C[NH2+][C@@H](CNC(=O)CN2CC[C@@H](C)C2)C(C)C)cs1 ZINC001419908655 1376110719 /nfs/dbraw/zinc/11/07/19/1376110719.db2.gz PFSBOISXLBVBJP-PBHICJAKSA-N 1 3 337.533 2.629 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](CNC(=O)CN1CC[C@@H](C)C1)C(C)C ZINC001419910353 1376113105 /nfs/dbraw/zinc/11/31/05/1376113105.db2.gz SBNQLUHIPWRNMH-OXQOHEQNSA-N 1 3 345.531 2.876 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+][C@@H]2CCc3ccc(Cl)cc32)C1 ZINC001419976004 1376218975 /nfs/dbraw/zinc/21/89/75/1376218975.db2.gz QLQBEYLQWKLIOZ-FUHWJXTLSA-N 1 3 349.906 2.858 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]([N@H+](C)C/C=C\c2ccccc2)C1 ZINC001420030982 1376321616 /nfs/dbraw/zinc/32/16/16/1376321616.db2.gz LPBIMPXLLYYIGO-OABSHCPFSA-N 1 3 341.499 2.717 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@@H]([N@@H+](C)C/C=C\c2ccccc2)C1 ZINC001420030982 1376321625 /nfs/dbraw/zinc/32/16/25/1376321625.db2.gz LPBIMPXLLYYIGO-OABSHCPFSA-N 1 3 341.499 2.717 10 0 EFAEHO CCN1C[C@@H](NC(=O)c2oc3ccccc3c2C[NH+](C)C)C(C)(C)C1 ZINC001420050214 1376381000 /nfs/dbraw/zinc/38/10/00/1376381000.db2.gz BVRJEUMNHKUHQF-QGZVFWFLSA-N 1 3 343.471 2.955 10 0 EFAEHO CN(CC(=O)NCC[N@H+](C)Cc1ccc(C2CCC2)cc1)C1CCC1 ZINC001420245701 1376609038 /nfs/dbraw/zinc/60/90/38/1376609038.db2.gz XNQSQLDNSBCQKU-UHFFFAOYSA-N 1 3 343.515 2.986 10 0 EFAEHO CN(CC(=O)NCC[N@@H+](C)Cc1ccc(C2CCC2)cc1)C1CCC1 ZINC001420245701 1376609044 /nfs/dbraw/zinc/60/90/44/1376609044.db2.gz XNQSQLDNSBCQKU-UHFFFAOYSA-N 1 3 343.515 2.986 10 0 EFAEHO COc1cccc([C@@H](C)N(C)CCNC(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001420279796 1376659741 /nfs/dbraw/zinc/65/97/41/1376659741.db2.gz AZMKBFWYMZWDES-MRXNPFEDSA-N 1 3 347.503 2.679 10 0 EFAEHO CN(CCNC(=O)CCC[NH+](C)C)[C@H]1CCc2ccc(Cl)cc21 ZINC001420294556 1376680133 /nfs/dbraw/zinc/68/01/33/1376680133.db2.gz QUJVAATUSHLZJT-KRWDZBQOSA-N 1 3 337.895 2.717 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@H]2CCC[C@H]3CCC[N@@H+]32)cc1 ZINC001420306885 1376702852 /nfs/dbraw/zinc/70/28/52/1376702852.db2.gz BPFHJWCKGAMWRQ-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO CCc1ccc(CN(C)CCNC(=O)[C@H]2CCC[C@H]3CCC[N@H+]32)cc1 ZINC001420306885 1376702855 /nfs/dbraw/zinc/70/28/55/1376702855.db2.gz BPFHJWCKGAMWRQ-VQTJNVASSA-N 1 3 343.515 2.814 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001420335376 1376755025 /nfs/dbraw/zinc/75/50/25/1376755025.db2.gz UOINSLUEGKEOTE-IEBWSBKVSA-N 1 3 331.504 2.663 10 0 EFAEHO Cc1ccccc1CN(C)CCNC(=O)[C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001420335374 1376755554 /nfs/dbraw/zinc/75/55/54/1376755554.db2.gz UOINSLUEGKEOTE-HKUYNNGSSA-N 1 3 331.504 2.663 10 0 EFAEHO C[C@H](C[NH2+]C[C@@H]1CCCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001420341195 1376764573 /nfs/dbraw/zinc/76/45/73/1376764573.db2.gz FFXCIHUNDCFMKO-HUUCEWRRSA-N 1 3 347.494 2.884 10 0 EFAEHO Cc1cc(C)cc(CN(C)CCNC(=O)[C@@H](C(C)C)[NH+]2CCCC2)c1 ZINC001420359535 1376801738 /nfs/dbraw/zinc/80/17/38/1376801738.db2.gz SXQGOWWRKQLNMT-HXUWFJFHSA-N 1 3 345.531 2.972 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)c(Cl)c1 ZINC001420420301 1376924994 /nfs/dbraw/zinc/92/49/94/1376924994.db2.gz HXHJOENHMJGFEF-SQWLQELKSA-N 1 3 337.895 2.583 10 0 EFAEHO Cc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)c(Cl)c1 ZINC001420420301 1376925001 /nfs/dbraw/zinc/92/50/01/1376925001.db2.gz HXHJOENHMJGFEF-SQWLQELKSA-N 1 3 337.895 2.583 10 0 EFAEHO C[C@@H](C[NH2+][C@@H]1CCc2ccc(Cl)cc21)NC(=O)CN(C)C1CCC1 ZINC001420439436 1376977066 /nfs/dbraw/zinc/97/70/66/1376977066.db2.gz SFXLVOGAJYUBLT-SCLBCKFNSA-N 1 3 349.906 2.906 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@H]2CCC[N@H+]2CC(C)C)c1 ZINC001420449785 1376998111 /nfs/dbraw/zinc/99/81/11/1376998111.db2.gz VOGHVIQHWDJAEF-QFBILLFUSA-N 1 3 349.494 2.849 10 0 EFAEHO Cc1ccc(F)c(CNC[C@H](C)NC(=O)[C@H]2CCC[N@@H+]2CC(C)C)c1 ZINC001420449785 1376998131 /nfs/dbraw/zinc/99/81/31/1376998131.db2.gz VOGHVIQHWDJAEF-QFBILLFUSA-N 1 3 349.494 2.849 10 0 EFAEHO C[C@@H](CNCc1sccc1Cl)NC(=O)C(C)(C)[NH+]1CCCC1 ZINC001420455643 1377008154 /nfs/dbraw/zinc/00/81/54/1377008154.db2.gz GNVXYPYQCHWBCK-LBPRGKRZSA-N 1 3 343.924 2.870 10 0 EFAEHO C[C@@H](C[NH2+]Cc1cccc2ccccc21)NC(=O)CN1CC[C@@H](C)C1 ZINC001420468786 1377029289 /nfs/dbraw/zinc/02/92/89/1377029289.db2.gz KUKDQGLIQRCZMY-SJORKVTESA-N 1 3 339.483 2.776 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@H]1CCC[N@@H+]1Cc1cccc(C)c1 ZINC001420479745 1377050581 /nfs/dbraw/zinc/05/05/81/1377050581.db2.gz DNXJJAPBPWNGTE-MOPGFXCFSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@H]1CCC[N@H+]1Cc1cccc(C)c1 ZINC001420479745 1377050583 /nfs/dbraw/zinc/05/05/83/1377050583.db2.gz DNXJJAPBPWNGTE-MOPGFXCFSA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@@H]1CCC[N@@H+]1Cc1cccc(C)c1 ZINC001420479752 1377051013 /nfs/dbraw/zinc/05/10/13/1377051013.db2.gz DNXJJAPBPWNGTE-OALUTQOASA-N 1 3 349.494 2.756 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)NC[C@@H]1CCC[N@H+]1Cc1cccc(C)c1 ZINC001420479752 1377051022 /nfs/dbraw/zinc/05/10/22/1377051022.db2.gz DNXJJAPBPWNGTE-OALUTQOASA-N 1 3 349.494 2.756 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@H]1CCCN1Cc1ccc(C(F)F)cc1 ZINC001420491017 1377070123 /nfs/dbraw/zinc/07/01/23/1377070123.db2.gz COKRYEVWCWNSKW-INIZCTEOSA-N 1 3 339.430 2.657 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@H+](CC2CCC(C)(C)CC2)C1 ZINC001420558418 1377195855 /nfs/dbraw/zinc/19/58/55/1377195855.db2.gz NPZAOKCTJLHLPQ-SFHVURJKSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H]1CC[N@@H+](CC2CCC(C)(C)CC2)C1 ZINC001420558418 1377195858 /nfs/dbraw/zinc/19/58/58/1377195858.db2.gz NPZAOKCTJLHLPQ-SFHVURJKSA-N 1 3 337.552 2.981 10 0 EFAEHO CCC[N@H+](CCNC(=O)CN(C)C(C)C)[C@@H]1CCc2ccc(F)cc21 ZINC001420627059 1377362560 /nfs/dbraw/zinc/36/25/60/1377362560.db2.gz SXQLIDVUCUHETK-LJQANCHMSA-N 1 3 349.494 2.981 10 0 EFAEHO CCC[N@@H+](CCNC(=O)CN(C)C(C)C)[C@@H]1CCc2ccc(F)cc21 ZINC001420627059 1377362564 /nfs/dbraw/zinc/36/25/64/1377362564.db2.gz SXQLIDVUCUHETK-LJQANCHMSA-N 1 3 349.494 2.981 10 0 EFAEHO CC[C@@H](CNC(=O)C1(N(C)C)CCC1)[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC001438315240 1388502769 /nfs/dbraw/zinc/50/27/69/1388502769.db2.gz YJDNPKULFIAKGH-GJZGRUSLSA-N 1 3 345.478 2.781 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N[C@@H](C[NH2+]Cc1ccccc1C)C1CC1 ZINC001420736874 1377584038 /nfs/dbraw/zinc/58/40/38/1377584038.db2.gz KRCARHOYNJSNSQ-VQTJNVASSA-N 1 3 343.515 2.854 10 0 EFAEHO CC[C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC(C)C ZINC001438322895 1388506293 /nfs/dbraw/zinc/50/62/93/1388506293.db2.gz AMXHRHKQGDFLJO-CRAIPNDOSA-N 1 3 329.504 2.729 10 0 EFAEHO CC[C@H](CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1)[NH2+]CCC(C)C ZINC001438322902 1388506425 /nfs/dbraw/zinc/50/64/25/1388506425.db2.gz AMXHRHKQGDFLJO-QAPCUYQASA-N 1 3 329.504 2.729 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C[NH2+]CC1CCCC1)C1CC1 ZINC001420766544 1377624909 /nfs/dbraw/zinc/62/49/09/1377624909.db2.gz ARJPOJQVHZTJHN-OALUTQOASA-N 1 3 335.536 2.924 10 0 EFAEHO CC[NH2+][C@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)c1ccccc1 ZINC001420776410 1377648200 /nfs/dbraw/zinc/64/82/00/1377648200.db2.gz NKJDVXHNEHHGDI-VQIMIIECSA-N 1 3 335.467 2.666 10 0 EFAEHO CCCN1CCC[C@H]1C(=O)NC[C@H]([NH2+]CC1CC1)c1ccccc1 ZINC001420779652 1377654136 /nfs/dbraw/zinc/65/41/36/1377654136.db2.gz WYHNJYSDANAXCK-OALUTQOASA-N 1 3 329.488 2.718 10 0 EFAEHO C[NH+](C)CCC(=O)N1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1C1CC1 ZINC001420786022 1377665839 /nfs/dbraw/zinc/66/58/39/1377665839.db2.gz JLGCLPUFHPHQOH-KDURUIRLSA-N 1 3 341.499 2.691 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CCCC1 ZINC001420790340 1377672949 /nfs/dbraw/zinc/67/29/49/1377672949.db2.gz PEOJLLKUOBXKHM-KSZLIROESA-N 1 3 339.499 2.532 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCCC1 ZINC001420790340 1377672953 /nfs/dbraw/zinc/67/29/53/1377672953.db2.gz PEOJLLKUOBXKHM-KSZLIROESA-N 1 3 339.499 2.532 10 0 EFAEHO CC(C)[C@@H](C(=O)NCC1([NH2+][C@@H]2CCCc3ccccc32)CC1)N(C)C ZINC001420957121 1377938562 /nfs/dbraw/zinc/93/85/62/1377938562.db2.gz ZMAZDTTVRYEZSR-MOPGFXCFSA-N 1 3 343.515 2.889 10 0 EFAEHO CC[C@@H]([NH2+]C1(CNC(=O)C2(N(C)C)CCC2)CC1)c1ccccc1 ZINC001420959597 1377941750 /nfs/dbraw/zinc/94/17/50/1377941750.db2.gz NOWYDFNWXGDHJP-QGZVFWFLSA-N 1 3 329.488 2.860 10 0 EFAEHO C[NH+](C)[C@H]1CCC[C@H](C(=O)NCC2(NCc3cccc(F)c3)CC2)C1 ZINC001420995027 1377993435 /nfs/dbraw/zinc/99/34/35/1377993435.db2.gz NDPJVRXQVLDAEM-WMZOPIPTSA-N 1 3 347.478 2.685 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@@H](C(=O)NCC2(NCc3cccc(F)c3)CC2)C1 ZINC001420995021 1377993612 /nfs/dbraw/zinc/99/36/12/1377993612.db2.gz NDPJVRXQVLDAEM-SJLPKXTDSA-N 1 3 347.478 2.685 10 0 EFAEHO Cc1ccc(C[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@@H]3C)CC2)cc1C ZINC001421008533 1378014678 /nfs/dbraw/zinc/01/46/78/1378014678.db2.gz ZQTHKCIVJLBYGR-HDICACEKSA-N 1 3 343.515 2.915 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NCCN(CCF)C1CCCCCC1 ZINC001421016582 1378026597 /nfs/dbraw/zinc/02/65/97/1378026597.db2.gz PTARYRPMGCALAA-QGZVFWFLSA-N 1 3 341.515 2.971 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NCCN(CCF)C1CCCCCC1 ZINC001421016582 1378026600 /nfs/dbraw/zinc/02/66/00/1378026600.db2.gz PTARYRPMGCALAA-QGZVFWFLSA-N 1 3 341.515 2.971 10 0 EFAEHO O=C(CN1CCCC1)N1CCC([N@H+](CCC2CC2)CC2CC2)CC1 ZINC001421029358 1378043864 /nfs/dbraw/zinc/04/38/64/1378043864.db2.gz VNXBJRJZHUZJIR-UHFFFAOYSA-N 1 3 333.520 2.585 10 0 EFAEHO O=C(CN1CCCC1)N1CCC([N@@H+](CCC2CC2)CC2CC2)CC1 ZINC001421029358 1378043866 /nfs/dbraw/zinc/04/38/66/1378043866.db2.gz VNXBJRJZHUZJIR-UHFFFAOYSA-N 1 3 333.520 2.585 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@]2(CCN(C(=O)[C@@H](C(C)C)N(C)C)C2)C1 ZINC001421040756 1378058581 /nfs/dbraw/zinc/05/85/81/1378058581.db2.gz SWBZGQUACFWJGG-QUCCMNQESA-N 1 3 337.552 2.933 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@]2(CCN(C(=O)[C@@H](C(C)C)N(C)C)C2)C1 ZINC001421040756 1378058584 /nfs/dbraw/zinc/05/85/84/1378058584.db2.gz SWBZGQUACFWJGG-QUCCMNQESA-N 1 3 337.552 2.933 10 0 EFAEHO CN(CC(=O)NCC1C[NH+](CC2CC3(CCC3)C2)C1)CC(C)(C)C ZINC001421156110 1378198273 /nfs/dbraw/zinc/19/82/73/1378198273.db2.gz NTVMDPHKJGYXCW-UHFFFAOYSA-N 1 3 335.536 2.593 10 0 EFAEHO CC(C)(C)CC[NH+]1CC(CNC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001421159382 1378204480 /nfs/dbraw/zinc/20/44/80/1378204480.db2.gz UQUOHCMPHXUDJD-LJQANCHMSA-N 1 3 341.515 2.683 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N[C@@H](C[NH2+]Cc2ccsc2)C2CCCC2)C1 ZINC001421166370 1378214053 /nfs/dbraw/zinc/21/40/53/1378214053.db2.gz FJSCNEKBHHGZSX-QAPCUYQASA-N 1 3 349.544 2.855 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)N[C@]2(C)CCN(Cc3ccc(CF)cc3)C2)C1 ZINC001421222723 1378303734 /nfs/dbraw/zinc/30/37/34/1378303734.db2.gz MZIBBKWJFHQIBW-UYAOXDASSA-N 1 3 347.478 2.579 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)N[C@]2(C)CCN(Cc3ccc(CF)cc3)C2)C1 ZINC001421222723 1378303739 /nfs/dbraw/zinc/30/37/39/1378303739.db2.gz MZIBBKWJFHQIBW-UYAOXDASSA-N 1 3 347.478 2.579 10 0 EFAEHO CC[C@@H](CNC(=O)C12CC[NH+](CC1)C2)N[C@H](C)c1ccccc1Cl ZINC001438373956 1388544393 /nfs/dbraw/zinc/54/43/93/1388544393.db2.gz IJQBABZXIRSZQV-CABCVRRESA-N 1 3 349.906 2.981 10 0 EFAEHO CC[C@H](CNC(=O)C12CC[NH+](CC1)C2)N[C@H](C)c1ccccc1Cl ZINC001438373972 1388544689 /nfs/dbraw/zinc/54/46/89/1388544689.db2.gz IJQBABZXIRSZQV-HUUCEWRRSA-N 1 3 349.906 2.981 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)C(C)C)[NH2+]Cc1ccc(Cl)cc1 ZINC001438374364 1388544895 /nfs/dbraw/zinc/54/48/95/1388544895.db2.gz LJWVWDPKGJKLHV-MRXNPFEDSA-N 1 3 325.884 2.665 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CC[C@](C)(C[NH2+]CC3CCCCC3)C2)C1 ZINC001421254017 1378354891 /nfs/dbraw/zinc/35/48/91/1378354891.db2.gz KCLICCXUQNOQES-YLJYHZDGSA-N 1 3 335.536 2.737 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@]2(C)CCN(C(=O)CN3CC[C@@H](C)C3)C2)c1 ZINC001421257604 1378361040 /nfs/dbraw/zinc/36/10/40/1378361040.db2.gz PYUMXEDSPGJHAW-NQIIRXRSSA-N 1 3 343.515 2.665 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)NCC1(C)CC[NH+](CC[C@@H](C)F)CC1 ZINC001421265718 1378376496 /nfs/dbraw/zinc/37/64/96/1378376496.db2.gz ISVCDBCZHVKZQT-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccc(CN2CCC[C@@](C)(CNC(=O)CC[NH+](C)C)C2)cc1F ZINC001421282240 1378418960 /nfs/dbraw/zinc/41/89/60/1378418960.db2.gz FHVWYXZQWGEMBR-FQEVSTJZSA-N 1 3 349.494 2.804 10 0 EFAEHO CC(C)CCC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001421318142 1378487227 /nfs/dbraw/zinc/48/72/27/1378487227.db2.gz IXZANGLGBJSXDD-INIZCTEOSA-N 1 3 347.494 2.836 10 0 EFAEHO CC(C)CCC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)CN(C)C(C)C)C1 ZINC001421318142 1378487230 /nfs/dbraw/zinc/48/72/30/1378487230.db2.gz IXZANGLGBJSXDD-INIZCTEOSA-N 1 3 347.494 2.836 10 0 EFAEHO CC[C@H](CNC(=O)[C@@H]1CCCN1C(C)C)[NH2+]Cc1cc(F)ccc1C ZINC001421423312 1378600554 /nfs/dbraw/zinc/60/05/54/1378600554.db2.gz PQNMWNYJUJHWET-MOPGFXCFSA-N 1 3 349.494 2.991 10 0 EFAEHO CC[C@H](CNC(=O)C1(N(C)C)CCC1)[NH2+][C@@H](C)c1cccc(OC)c1 ZINC001421425827 1378601703 /nfs/dbraw/zinc/60/17/03/1378601703.db2.gz QHZLTSYVQSZXTF-DOTOQJQBSA-N 1 3 347.503 2.725 10 0 EFAEHO CC[C@@H](CNC(=O)C(C)(C)[NH+]1CCCC1)NCC=C(Cl)Cl ZINC001421433201 1378610921 /nfs/dbraw/zinc/61/09/21/1378610921.db2.gz BXUXSGLCWWJXBR-LBPRGKRZSA-N 1 3 336.307 2.664 10 0 EFAEHO CC[C@@H](CNC(=O)[C@@H]1CCCCN1C(C)C)[NH2+]Cc1ccccc1 ZINC001421451643 1378635372 /nfs/dbraw/zinc/63/53/72/1378635372.db2.gz AJXXQDCERTWIPL-OALUTQOASA-N 1 3 331.504 2.934 10 0 EFAEHO CC[C@H](CNC(=O)CN(C)CC(C)(C)C)[NH2+]CC1CC(C)(C)C1 ZINC001421454826 1378640265 /nfs/dbraw/zinc/64/02/65/1378640265.db2.gz ZAPGQHJVLFKBJO-MRXNPFEDSA-N 1 3 325.541 2.885 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccc(C)cc1)C2 ZINC001421519611 1378736059 /nfs/dbraw/zinc/73/60/59/1378736059.db2.gz ZCAPHRXVYIOSCA-ZCNNSNEGSA-N 1 3 343.515 2.806 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccc(C)cc1)C2 ZINC001421519611 1378736063 /nfs/dbraw/zinc/73/60/63/1378736063.db2.gz ZCAPHRXVYIOSCA-ZCNNSNEGSA-N 1 3 343.515 2.806 10 0 EFAEHO Cc1cccc(C[NH2+]C[C@H]2CN(C(=O)CN(C)C(C)C)C[C@@H]2C)c1 ZINC001421563810 1378817893 /nfs/dbraw/zinc/81/78/93/1378817893.db2.gz UTGYIUPKCZDHKL-HKUYNNGSSA-N 1 3 331.504 2.519 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC[C@H]([NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001421612169 1378883050 /nfs/dbraw/zinc/88/30/50/1378883050.db2.gz URDWYHLIXNBJQA-UJWQCDCRSA-N 1 3 335.536 2.780 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@@H]1C[NH2+]Cc1ccc(C2CC2)cc1 ZINC001421665431 1378970527 /nfs/dbraw/zinc/97/05/27/1378970527.db2.gz FEPRXHQSXXXFAX-HXUWFJFHSA-N 1 3 343.515 2.986 10 0 EFAEHO C[C@H](CNC/C(Cl)=C/Cl)CNC(=O)C12CCC[NH+](CCC1)C2 ZINC001421726460 1379040791 /nfs/dbraw/zinc/04/07/91/1379040791.db2.gz VTTHZPJCAKFOLG-HRYODUOUSA-N 1 3 348.318 2.523 10 0 EFAEHO C[C@@H](CNC/C(Cl)=C\Cl)CNC(=O)C12CCC[NH+](CCC1)C2 ZINC001421726466 1379040891 /nfs/dbraw/zinc/04/08/91/1379040891.db2.gz VTTHZPJCAKFOLG-JGWKKKPCSA-N 1 3 348.318 2.523 10 0 EFAEHO C[C@H](CNC(=O)[C@@H](C)N1CCCCCC1)C[NH2+]Cc1ccsc1 ZINC001421740540 1379063914 /nfs/dbraw/zinc/06/39/14/1379063914.db2.gz QSYXDHWSJNCYPG-JKSUJKDBSA-N 1 3 337.533 2.855 10 0 EFAEHO CC(C)[C@H](C(=O)NCC1([NH2+]C[C@@H]2CCC(F)(F)C2)CCC1)N(C)C ZINC001421779913 1379129029 /nfs/dbraw/zinc/12/90/29/1379129029.db2.gz UOVWZYQVTNGBML-HUUCEWRRSA-N 1 3 345.478 2.637 10 0 EFAEHO CC(C)C[NH2+]C1(CO)CCN(C[C@@H]2CCCC23CCOCC3)CC1 ZINC001421806152 1379157401 /nfs/dbraw/zinc/15/74/01/1379157401.db2.gz DPYMANLZXSQGDI-SFHVURJKSA-N 1 3 338.536 2.656 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]CC2CCC3(CC3)CC2)CCC1 ZINC001421806280 1379157631 /nfs/dbraw/zinc/15/76/31/1379157631.db2.gz SMUHGRRAAXUFNS-UHFFFAOYSA-N 1 3 335.536 2.926 10 0 EFAEHO CC[C@H](F)C[NH2+]C1(CNC(=O)[C@H]2CCCN2C(C)C)CCCC1 ZINC001421835358 1379203768 /nfs/dbraw/zinc/20/37/68/1379203768.db2.gz UJYCWBINQALDAS-JKSUJKDBSA-N 1 3 327.488 2.626 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[N@H+](C)C[C@H]1CCC(F)(F)C1)N(C)C ZINC001421861148 1379257438 /nfs/dbraw/zinc/25/74/38/1379257438.db2.gz IYUORRJPFWNPDB-HOTGVXAUSA-N 1 3 347.494 2.788 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[N@@H+](C)C[C@H]1CCC(F)(F)C1)N(C)C ZINC001421861148 1379257441 /nfs/dbraw/zinc/25/74/41/1379257441.db2.gz IYUORRJPFWNPDB-HOTGVXAUSA-N 1 3 347.494 2.788 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[N@H+](C)C[C@@H]1CCC(F)(F)C1)N(C)C ZINC001421861144 1379258407 /nfs/dbraw/zinc/25/84/07/1379258407.db2.gz IYUORRJPFWNPDB-CVEARBPZSA-N 1 3 347.494 2.788 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)CCC[N@@H+](C)C[C@@H]1CCC(F)(F)C1)N(C)C ZINC001421861144 1379258412 /nfs/dbraw/zinc/25/84/12/1379258412.db2.gz IYUORRJPFWNPDB-CVEARBPZSA-N 1 3 347.494 2.788 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001421889286 1379306196 /nfs/dbraw/zinc/30/61/96/1379306196.db2.gz MXKRANNZMVWDSG-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)N(C)[C@@H](C)CNCc1ccccc1F ZINC001421889286 1379306205 /nfs/dbraw/zinc/30/62/05/1379306205.db2.gz MXKRANNZMVWDSG-YJBOKZPZSA-N 1 3 335.467 2.637 10 0 EFAEHO C[C@@H](C[NH2+][C@@H]1CCc2ccccc21)N(C)C(=O)CN(C)C1CCC1 ZINC001421900913 1379327585 /nfs/dbraw/zinc/32/75/85/1379327585.db2.gz HSBPGMSRGHGEKJ-HNAYVOBHSA-N 1 3 329.488 2.595 10 0 EFAEHO Cc1cc(C[N@@H+](C)CCCN(C)C(=O)CN2CCCC2)c(C)s1 ZINC001421900648 1379328036 /nfs/dbraw/zinc/32/80/36/1379328036.db2.gz GAXBVWMOMCNLIJ-UHFFFAOYSA-N 1 3 337.533 2.741 10 0 EFAEHO Cc1cc(C[N@H+](C)CCCN(C)C(=O)CN2CCCC2)c(C)s1 ZINC001421900648 1379328044 /nfs/dbraw/zinc/32/80/44/1379328044.db2.gz GAXBVWMOMCNLIJ-UHFFFAOYSA-N 1 3 337.533 2.741 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[N@H+](C)Cc1ccsc1 ZINC001421903131 1379332307 /nfs/dbraw/zinc/33/23/07/1379332307.db2.gz REDUIXSNEWLQAS-QGZVFWFLSA-N 1 3 337.533 2.903 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CCC[N@@H+](C)Cc1ccsc1 ZINC001421903131 1379332312 /nfs/dbraw/zinc/33/23/12/1379332312.db2.gz REDUIXSNEWLQAS-QGZVFWFLSA-N 1 3 337.533 2.903 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccc(Cl)cc1)N(C)C ZINC001421911496 1379341652 /nfs/dbraw/zinc/34/16/52/1379341652.db2.gz MMZKCCMKKDZNEN-XJKSGUPXSA-N 1 3 325.884 2.617 10 0 EFAEHO C[C@@H](F)CC[NH2+][C@H]1CC[C@H](NC(=O)C(C)(C)N2CCCC2)CC1 ZINC001438442247 1388604090 /nfs/dbraw/zinc/60/40/90/1388604090.db2.gz QQEJHTDZNAOBHC-BZUAXINKSA-N 1 3 327.488 2.626 10 0 EFAEHO CCC1([NH2+]C/C(Cl)=C/Cl)CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001421941860 1379383162 /nfs/dbraw/zinc/38/31/62/1379383162.db2.gz RKEJLRFUCARHBF-FZDNWWAKSA-N 1 3 348.318 2.760 10 0 EFAEHO Cc1cc(C[NH2+]C[C@H](C)N(C)C(=O)CN(C)C(C)C)c(C)s1 ZINC001421976905 1379430893 /nfs/dbraw/zinc/43/08/93/1379430893.db2.gz BQSHQGUXWVOQHK-ZDUSSCGKSA-N 1 3 325.522 2.642 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)[C@@H](C)C[NH2+]Cc1cccc2cccnc21 ZINC001421979091 1379433149 /nfs/dbraw/zinc/43/31/49/1379433149.db2.gz GKKBUVFMSXLGKK-INIZCTEOSA-N 1 3 342.487 2.512 10 0 EFAEHO CC[C@H](C(=O)N(C)[C@@H](C)C[NH2+]Cc1ccccc1C1CC1)N(C)C ZINC001421980445 1379434595 /nfs/dbraw/zinc/43/45/95/1379434595.db2.gz BGLNAQBOKKPSTK-HNAYVOBHSA-N 1 3 331.504 2.841 10 0 EFAEHO Cc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H]2CC[N@H+](C)C2)c(Cl)c1 ZINC001421985313 1379439376 /nfs/dbraw/zinc/43/93/76/1379439376.db2.gz IZMDQRAOVCLGON-GOEBONIOSA-N 1 3 337.895 2.537 10 0 EFAEHO Cc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H]2CC[N@@H+](C)C2)c(Cl)c1 ZINC001421985313 1379439380 /nfs/dbraw/zinc/43/93/80/1379439380.db2.gz IZMDQRAOVCLGON-GOEBONIOSA-N 1 3 337.895 2.537 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)[C@H](C)C[NH2+]Cc1ccc(F)cc1 ZINC001421985613 1379440685 /nfs/dbraw/zinc/44/06/85/1379440685.db2.gz OKOUQUMPBWYVCF-CRAIPNDOSA-N 1 3 335.467 2.637 10 0 EFAEHO CC(C)[NH2+]CC[C@H]1CCCCN1C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001422034465 1379519886 /nfs/dbraw/zinc/51/98/86/1379519886.db2.gz UGPNGGHZBGIQMG-APWZRJJASA-N 1 3 341.515 2.968 10 0 EFAEHO CN(CCF)CCC1CCN(C(=O)[C@@H]2CCC[C@H]([NH+](C)C)C2)CC1 ZINC001422059727 1379554794 /nfs/dbraw/zinc/55/47/94/1379554794.db2.gz DKGXZAXFISXBMY-MSOLQXFVSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@H]([NH2+]Cc2cc3ccccc3o2)[C@@H](C)C1 ZINC001422063227 1379562409 /nfs/dbraw/zinc/56/24/09/1379562409.db2.gz NXJGICOBBIHNEJ-YJBOKZPZSA-N 1 3 343.471 2.710 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+][C@H](CNC(=O)CN1CC[C@H](C)C1)C(C)C ZINC001422105932 1379618492 /nfs/dbraw/zinc/61/84/92/1379618492.db2.gz CDYDAAAKQGAFHZ-HNAYVOBHSA-N 1 3 349.494 2.706 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](CNC(=O)C2(C[NH+](C)C)CC2)C(C)C)c1 ZINC001422116067 1379632934 /nfs/dbraw/zinc/63/29/34/1379632934.db2.gz GRNXDDKTQBSPIF-SFHVURJKSA-N 1 3 349.494 2.706 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@H+](CCc2ccccc2F)[C@H](C)C1 ZINC001422136556 1379670109 /nfs/dbraw/zinc/67/01/09/1379670109.db2.gz VIHXBKJWFAGEIZ-SJLPKXTDSA-N 1 3 349.494 2.678 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[N@@H+](CCc2ccccc2F)[C@H](C)C1 ZINC001422136556 1379670115 /nfs/dbraw/zinc/67/01/15/1379670115.db2.gz VIHXBKJWFAGEIZ-SJLPKXTDSA-N 1 3 349.494 2.678 10 0 EFAEHO CC(C)c1ccc(C[N@H+](C)CCN(C)C(=O)[C@@H]2CCCN2C)cc1 ZINC001422153246 1379692578 /nfs/dbraw/zinc/69/25/78/1379692578.db2.gz SOQPQFQODVQRBW-IBGZPJMESA-N 1 3 331.504 2.794 10 0 EFAEHO CC(C)c1ccc(C[N@@H+](C)CCN(C)C(=O)[C@@H]2CCCN2C)cc1 ZINC001422153246 1379692583 /nfs/dbraw/zinc/69/25/83/1379692583.db2.gz SOQPQFQODVQRBW-IBGZPJMESA-N 1 3 331.504 2.794 10 0 EFAEHO C[C@H](c1ccc(Cl)cc1)N(C)CCN(C)C(=O)CC[NH+](C)C ZINC001422198470 1379758772 /nfs/dbraw/zinc/75/87/72/1379758772.db2.gz MKYMCACSWIXGML-CQSZACIVSA-N 1 3 325.884 2.743 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@H+](C)CC1CCC(C)CC1)N(C)C ZINC001422227484 1379813154 /nfs/dbraw/zinc/81/31/54/1379813154.db2.gz OKPRTOYUIHKAAV-DAWZGUTISA-N 1 3 325.541 2.789 10 0 EFAEHO CC(C)[C@H](C(=O)N(C)CC[N@@H+](C)CC1CCC(C)CC1)N(C)C ZINC001422227484 1379813155 /nfs/dbraw/zinc/81/31/55/1379813155.db2.gz OKPRTOYUIHKAAV-DAWZGUTISA-N 1 3 325.541 2.789 10 0 EFAEHO Cc1ccc(C[N@@H+](C)C[C@H]2CCCN2C(=O)CN(C)C(C)C)cc1F ZINC001422238990 1379836116 /nfs/dbraw/zinc/83/61/16/1379836116.db2.gz ANTJPVTZTDGOQJ-GOSISDBHSA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1ccc(C[N@H+](C)C[C@H]2CCCN2C(=O)CN(C)C(C)C)cc1F ZINC001422238990 1379836119 /nfs/dbraw/zinc/83/61/19/1379836119.db2.gz ANTJPVTZTDGOQJ-GOSISDBHSA-N 1 3 349.494 2.897 10 0 EFAEHO C[N@H+](C/C=C/c1ccccc1)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001422242299 1379841962 /nfs/dbraw/zinc/84/19/62/1379841962.db2.gz HQTNYURCIKOXGR-WUTDNEBXSA-N 1 3 341.499 2.718 10 0 EFAEHO C[N@@H+](C/C=C/c1ccccc1)C[C@H]1CCCN1C(=O)CN1CCCC1 ZINC001422242299 1379841964 /nfs/dbraw/zinc/84/19/64/1379841964.db2.gz HQTNYURCIKOXGR-WUTDNEBXSA-N 1 3 341.499 2.718 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CCC[C@H]1C[NH2+]Cc1cc(C)ccc1F ZINC001422288991 1379900074 /nfs/dbraw/zinc/90/00/74/1379900074.db2.gz XKPHKUIKZNJWAI-QFBILLFUSA-N 1 3 349.494 2.850 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1ccc2ncccc2c1 ZINC001422451915 1380123767 /nfs/dbraw/zinc/12/37/67/1380123767.db2.gz OJVUYPYXCJMUFE-HOTGVXAUSA-N 1 3 342.487 2.558 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)CCc2ccccc2F)CC[N@@H+]1C ZINC001422510968 1380227923 /nfs/dbraw/zinc/22/79/23/1380227923.db2.gz YDLAWQKGIHCCFV-HHXXYDBFSA-N 1 3 349.494 2.535 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)NC[C@@H](C)N(C)CCc2ccccc2F)CC[N@H+]1C ZINC001422510968 1380227925 /nfs/dbraw/zinc/22/79/25/1380227925.db2.gz YDLAWQKGIHCCFV-HHXXYDBFSA-N 1 3 349.494 2.535 10 0 EFAEHO CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(OC)cc1 ZINC001422518318 1380240375 /nfs/dbraw/zinc/24/03/75/1380240375.db2.gz MTDUHJMEDGCXEZ-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO CCC[N@H+]1CCC[C@H]1C(=O)NC[C@H](C)N(C)Cc1ccc(OC)cc1 ZINC001422518318 1380240376 /nfs/dbraw/zinc/24/03/76/1380240376.db2.gz MTDUHJMEDGCXEZ-LPHOPBHVSA-N 1 3 347.503 2.506 10 0 EFAEHO CCCc1ccc(C[NH2+]C[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1 ZINC001422547341 1380296990 /nfs/dbraw/zinc/29/69/90/1380296990.db2.gz APWURHNEJLZJSF-IAGOWNOFSA-N 1 3 331.504 2.575 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[N@H+](C)Cc1ccc(Cl)cc1 ZINC001422559893 1380321840 /nfs/dbraw/zinc/32/18/40/1380321840.db2.gz JEGFYKNUJJMUBW-LSDHHAIUSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001422559893 1380321842 /nfs/dbraw/zinc/32/18/42/1380321842.db2.gz JEGFYKNUJJMUBW-LSDHHAIUSA-N 1 3 337.895 2.618 10 0 EFAEHO CC(C)[C@H](CCN(C)C(=O)[C@@H]1CCCN1C)[NH2+]CC1CC(C)(C)C1 ZINC001422674967 1380560907 /nfs/dbraw/zinc/56/09/07/1380560907.db2.gz ZSDZGSBUZBXQKO-ROUUACIJSA-N 1 3 337.552 2.980 10 0 EFAEHO CCCC[C@H](CNCc1ccccc1F)NC(=O)[C@H]1CC[N@H+](C)C1 ZINC001422690718 1380607193 /nfs/dbraw/zinc/60/71/93/1380607193.db2.gz PQRVZMRGWUDAKO-DLBZAZTESA-N 1 3 335.467 2.542 10 0 EFAEHO CCCC[C@H](CNCc1ccccc1F)NC(=O)[C@H]1CC[N@@H+](C)C1 ZINC001422690718 1380607195 /nfs/dbraw/zinc/60/71/95/1380607195.db2.gz PQRVZMRGWUDAKO-DLBZAZTESA-N 1 3 335.467 2.542 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1C[NH+](CC[C@@H]2CCCC2(F)F)C1 ZINC001422760835 1380768540 /nfs/dbraw/zinc/76/85/40/1380768540.db2.gz JVLXNIGTOLSJPP-ZBFHGGJFSA-N 1 3 345.478 2.589 10 0 EFAEHO C[C@H]([NH2+]C[C@H]1C[C@H](NC(=O)C2(N(C)C)CCC2)C1)c1ccccc1 ZINC001422896707 1381019443 /nfs/dbraw/zinc/01/94/43/1381019443.db2.gz UBSBXEZSWKUIQC-BQFCYCMXSA-N 1 3 329.488 2.716 10 0 EFAEHO C[C@@H]([NH2+]C[C@H]1C[C@H](NC(=O)CN(C)C2CCC2)C1)c1cccc(F)c1 ZINC001422896840 1381021406 /nfs/dbraw/zinc/02/14/06/1381021406.db2.gz VJUBMGROZFTZIG-IIDMSEBBSA-N 1 3 347.478 2.855 10 0 EFAEHO CN(CC(=O)N[C@H]1C[C@H](C[NH2+]CC2CC(C)(C)C2)C1)CC(C)(C)C ZINC001422912896 1381044377 /nfs/dbraw/zinc/04/43/77/1381044377.db2.gz IUBDRBHIGSLFML-JCNLHEQBSA-N 1 3 337.552 2.885 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001422918693 1381055755 /nfs/dbraw/zinc/05/57/55/1381055755.db2.gz ODCIPDKUQODPES-IRJFHVNHSA-N 1 3 343.515 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1C[C@H](C[NH2+][C@H]2CCc3ccc(F)cc32)C1 ZINC001422922031 1381062219 /nfs/dbraw/zinc/06/22/19/1381062219.db2.gz YCABNJGJIOGABW-FNHZYXHNSA-N 1 3 347.478 2.638 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CCCC[C@H]1C[NH2+]CC1CC(F)(F)C1 ZINC001422929602 1381078183 /nfs/dbraw/zinc/07/81/83/1381078183.db2.gz DWHYMWBDFUFLDM-JKSUJKDBSA-N 1 3 345.478 2.637 10 0 EFAEHO Cc1ccc(F)cc1C[N@@H+](C)C1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001422950255 1381109649 /nfs/dbraw/zinc/10/96/49/1381109649.db2.gz TUGRFJZLLPCBDG-UHFFFAOYSA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1ccc(F)cc1C[N@H+](C)C1CCN(C(=O)CN(C)C(C)C)CC1 ZINC001422950255 1381109655 /nfs/dbraw/zinc/10/96/55/1381109655.db2.gz TUGRFJZLLPCBDG-UHFFFAOYSA-N 1 3 349.494 2.897 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]C1(CNC(=O)CN(C)C(C)C)CCCC1 ZINC001438614842 1388700864 /nfs/dbraw/zinc/70/08/64/1388700864.db2.gz ZGHSQKLEPUQGLE-UHFFFAOYSA-N 1 3 349.494 2.993 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NCC[C@@H]([NH2+]CC1CC2(CCC2)C1)C(C)C ZINC001422973231 1381142057 /nfs/dbraw/zinc/14/20/57/1381142057.db2.gz WCGBRKMRZKAFCU-QGZVFWFLSA-N 1 3 346.519 2.961 10 0 EFAEHO CC(C)C[C@@H](C)C[NH+]1CC2(C1)CCN(C(=O)CN(C)C(C)C)CC2 ZINC001438622611 1388704946 /nfs/dbraw/zinc/70/49/46/1388704946.db2.gz NYBMRISDHCIPRM-GOSISDBHSA-N 1 3 337.552 2.933 10 0 EFAEHO CC[C@H](F)CN[C@H](C)CN(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001423083375 1381319913 /nfs/dbraw/zinc/31/99/13/1381319913.db2.gz NCEJSLSNALGCCQ-CABCVRRESA-N 1 3 329.504 2.824 10 0 EFAEHO C[C@@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+][C@@H]1CCc2ccccc21 ZINC001423084035 1381319134 /nfs/dbraw/zinc/31/91/34/1381319134.db2.gz VEOFTDYDPONEAS-MAUKXSAKSA-N 1 3 329.488 2.595 10 0 EFAEHO CC[C@@H](F)CN[C@H](C)CN(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001423083393 1381319166 /nfs/dbraw/zinc/31/91/66/1381319166.db2.gz NCEJSLSNALGCCQ-HUUCEWRRSA-N 1 3 329.504 2.824 10 0 EFAEHO CC[C@@H](F)CN[C@H](C)CN(C)C(=O)C(C)(C)[N@@H+](C)C1CCCC1 ZINC001423083393 1381319170 /nfs/dbraw/zinc/31/91/70/1381319170.db2.gz NCEJSLSNALGCCQ-HUUCEWRRSA-N 1 3 329.504 2.824 10 0 EFAEHO CC[C@H](F)CN[C@H](C)CN(C)C(=O)C(C)(C)[N@H+](C)C1CCCC1 ZINC001423083375 1381319906 /nfs/dbraw/zinc/31/99/06/1381319906.db2.gz NCEJSLSNALGCCQ-CABCVRRESA-N 1 3 329.504 2.824 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)C(C)(C)[NH+]2CCCC2)c1 ZINC001423102721 1381353017 /nfs/dbraw/zinc/35/30/17/1381353017.db2.gz VWZZFDHLNAAHBQ-INIZCTEOSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)c(CN[C@@H](C)CN(C)C(=O)CC2CC[NH+](C)CC2)c1 ZINC001423128601 1381400321 /nfs/dbraw/zinc/40/03/21/1381400321.db2.gz MHYMZTYKYJFKIZ-INIZCTEOSA-N 1 3 349.494 2.803 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H](C(=O)N(C)C[C@@H](C)NCc2ccsc2)C1 ZINC001423128944 1381401696 /nfs/dbraw/zinc/40/16/96/1381401696.db2.gz VCRSCSLDVMNQMK-NVXWUHKLSA-N 1 3 337.533 2.807 10 0 EFAEHO CCC[N@H+]1CCC[C@@H](C(=O)N(C)C[C@@H](C)NCc2ccsc2)C1 ZINC001423128944 1381401700 /nfs/dbraw/zinc/40/17/00/1381401700.db2.gz VCRSCSLDVMNQMK-NVXWUHKLSA-N 1 3 337.533 2.807 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@H](C)[NH2+]CC[C@H]1CCCC1(F)F ZINC001423173696 1381505470 /nfs/dbraw/zinc/50/54/70/1381505470.db2.gz QGQDWAOKWRYNLW-LSDHHAIUSA-N 1 3 333.467 2.589 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@@H]3CC[C@H]4CCCC[N@@H+]43)CC2)cs1 ZINC001423243931 1381666793 /nfs/dbraw/zinc/66/67/93/1381666793.db2.gz KKCLQFNFWXBWKK-SJORKVTESA-N 1 3 347.528 2.812 10 0 EFAEHO Cc1cc(CNC2(CNC(=O)[C@@H]3CC[C@H]4CCCC[N@H+]43)CC2)cs1 ZINC001423243931 1381666812 /nfs/dbraw/zinc/66/68/12/1381666812.db2.gz KKCLQFNFWXBWKK-SJORKVTESA-N 1 3 347.528 2.812 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001423243695 1381668216 /nfs/dbraw/zinc/66/82/16/1381668216.db2.gz JJHMQFPZTFLSGN-MSOLQXFVSA-N 1 3 345.462 2.581 10 0 EFAEHO O=C(NCC1(NCc2cccc(F)c2)CC1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001423243695 1381668244 /nfs/dbraw/zinc/66/82/44/1381668244.db2.gz JJHMQFPZTFLSGN-MSOLQXFVSA-N 1 3 345.462 2.581 10 0 EFAEHO C[C@H](NC1(CNC(=O)C2CC[NH+](C)CC2)CC1)c1cccc(Cl)c1 ZINC001423274587 1381734449 /nfs/dbraw/zinc/73/44/49/1381734449.db2.gz NQPWLTJRTXWCEH-AWEZNQCLSA-N 1 3 349.906 2.981 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NCC1([NH2+]C/C=C/c2ccccc2)CC1 ZINC001423308252 1381764019 /nfs/dbraw/zinc/76/40/19/1381764019.db2.gz PNZRSSIUERXEJB-OKMWKSJFSA-N 1 3 341.499 2.811 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@H]1CCN(C(=O)CC[NH+](C)C)[C@@H]1C ZINC001423330628 1381794033 /nfs/dbraw/zinc/79/40/33/1381794033.db2.gz XEFNPOJEAXRECS-PBHICJAKSA-N 1 3 337.895 2.679 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H]1CCN(C(=O)CC[NH+](C)C)[C@@H]1C ZINC001423330636 1381794240 /nfs/dbraw/zinc/79/42/40/1381794240.db2.gz XEFNPOJEAXRECS-RHSMWYFYSA-N 1 3 337.895 2.679 10 0 EFAEHO CC[C@H](C)C[N@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001423338720 1381806162 /nfs/dbraw/zinc/80/61/62/1381806162.db2.gz RLANMXFYNRREGA-LPHOPBHVSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@H](C)C[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001423338720 1381806167 /nfs/dbraw/zinc/80/61/67/1381806167.db2.gz RLANMXFYNRREGA-LPHOPBHVSA-N 1 3 335.536 2.830 10 0 EFAEHO CC[C@H](C(=O)N[C@@]12CCC[C@@H]1[N@H+](CCCF)CC2)N(CC)CC ZINC001423344234 1381815694 /nfs/dbraw/zinc/81/56/94/1381815694.db2.gz DTNUISUCFXYOJJ-SOLBZPMBSA-N 1 3 327.488 2.580 10 0 EFAEHO CC[C@H](C(=O)N[C@@]12CCC[C@@H]1[N@@H+](CCCF)CC2)N(CC)CC ZINC001423344234 1381815695 /nfs/dbraw/zinc/81/56/95/1381815695.db2.gz DTNUISUCFXYOJJ-SOLBZPMBSA-N 1 3 327.488 2.580 10 0 EFAEHO Cc1ccc(CN[C@H]2C[C@H](C)N(C(=O)CC[NH+](C)C)C2)c(Cl)c1 ZINC001423357726 1381839186 /nfs/dbraw/zinc/83/91/86/1381839186.db2.gz QDQVWCBWBJWIJE-HOCLYGCPSA-N 1 3 337.895 2.679 10 0 EFAEHO CC(C)CCC[N@@H+]1CC[C@@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001423362959 1381849060 /nfs/dbraw/zinc/84/90/60/1381849060.db2.gz JDYBHWIMAKSGFE-AZUAARDMSA-N 1 3 335.536 2.689 10 0 EFAEHO CC(C)CCC[N@H+]1CC[C@@]2(CCN(C(=O)CN3CC[C@H](C)C3)C2)C1 ZINC001423362959 1381849062 /nfs/dbraw/zinc/84/90/62/1381849062.db2.gz JDYBHWIMAKSGFE-AZUAARDMSA-N 1 3 335.536 2.689 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@]12CCC[C@H]1N(Cc1ccsc1)CC2 ZINC001423372270 1381866665 /nfs/dbraw/zinc/86/66/65/1381866665.db2.gz RYKPRNWUSXHINC-AEFFLSMTSA-N 1 3 335.517 2.703 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@]12CCC[C@H]1N(Cc1ccsc1)CC2 ZINC001423372270 1381866670 /nfs/dbraw/zinc/86/66/70/1381866670.db2.gz RYKPRNWUSXHINC-AEFFLSMTSA-N 1 3 335.517 2.703 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N1C[C@@H]([NH2+]CCC(F)(F)F)C(C)(C)C1 ZINC001423398602 1381904522 /nfs/dbraw/zinc/90/45/22/1381904522.db2.gz RWMZBJWHIWGMRP-ZIAGYGMSSA-N 1 3 349.441 2.638 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]Cc2ccc(CC)cc2)C(C)(C)C1 ZINC001423400093 1381906637 /nfs/dbraw/zinc/90/66/37/1381906637.db2.gz GVUIMDMZYSXBHM-LJQANCHMSA-N 1 3 345.531 2.917 10 0 EFAEHO CC[C@H](F)C[NH2+][C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)CC1(C)C ZINC001423409621 1381917837 /nfs/dbraw/zinc/91/78/37/1381917837.db2.gz XPZIJZUEENLNRD-ZWKOTPCHSA-N 1 3 349.494 2.937 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@H]1CN(C(=O)c2cccc(CN(C)C)c2)CC1(C)C ZINC001423409615 1381918276 /nfs/dbraw/zinc/91/82/76/1381918276.db2.gz XPZIJZUEENLNRD-MSOLQXFVSA-N 1 3 349.494 2.937 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(C)nc2C)C[C@H]1C ZINC001423458528 1381959831 /nfs/dbraw/zinc/95/98/31/1381959831.db2.gz WLSVRSQHAIHCCK-VQIMIIECSA-N 1 3 346.519 2.509 10 0 EFAEHO C[N@@H+]1CC[C@H](CC(=O)NC2(C)CCN(Cc3ccsc3)CC2)C1 ZINC001423528520 1382020351 /nfs/dbraw/zinc/02/03/51/1382020351.db2.gz YKLUYMVRIIMNDZ-OAHLLOKOSA-N 1 3 335.517 2.561 10 0 EFAEHO C[N@H+]1CC[C@H](CC(=O)NC2(C)CCN(Cc3ccsc3)CC2)C1 ZINC001423528520 1382020357 /nfs/dbraw/zinc/02/03/57/1382020357.db2.gz YKLUYMVRIIMNDZ-OAHLLOKOSA-N 1 3 335.517 2.561 10 0 EFAEHO CC[N@@H+]1CCCC[C@@H]1C(=O)N(C)[C@H](C)CNCc1cc(C)ccc1F ZINC001438717198 1388760213 /nfs/dbraw/zinc/76/02/13/1388760213.db2.gz VKBOOTIIQGRXHX-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[N@H+]1CCCC[C@@H]1C(=O)N(C)[C@H](C)CNCc1cc(C)ccc1F ZINC001438717198 1388760217 /nfs/dbraw/zinc/76/02/17/1388760217.db2.gz VKBOOTIIQGRXHX-VQIMIIECSA-N 1 3 349.494 2.945 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2CCC1CC1)N(CC)CC ZINC001423535202 1382028982 /nfs/dbraw/zinc/02/89/82/1382028982.db2.gz QSBQYGGRBKERTB-CEXWTWQISA-N 1 3 335.536 2.972 10 0 EFAEHO CC[C@H](C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2CCC1CC1)N(CC)CC ZINC001423535202 1382028985 /nfs/dbraw/zinc/02/89/85/1382028985.db2.gz QSBQYGGRBKERTB-CEXWTWQISA-N 1 3 335.536 2.972 10 0 EFAEHO CC(C)[C@@H](C(=O)N(C)[C@@H](C)CNCc1cccnc1)[NH+]1CCCCC1 ZINC001438718480 1388761209 /nfs/dbraw/zinc/76/12/09/1388761209.db2.gz YCXLWEMCZFDWJP-HKUYNNGSSA-N 1 3 346.519 2.529 10 0 EFAEHO CCc1ccc(CN2CC[C@@](C)(NC(=O)C[C@@H]3CC[N@H+](C)C3)C2)cc1 ZINC001423583035 1382113449 /nfs/dbraw/zinc/11/34/49/1382113449.db2.gz JGRQFSRHOIHPRN-PZJWPPBQSA-N 1 3 343.515 2.671 10 0 EFAEHO CCc1ccc(CN2CC[C@@](C)(NC(=O)C[C@@H]3CC[N@@H+](C)C3)C2)cc1 ZINC001423583035 1382113452 /nfs/dbraw/zinc/11/34/52/1382113452.db2.gz JGRQFSRHOIHPRN-PZJWPPBQSA-N 1 3 343.515 2.671 10 0 EFAEHO CC(C)C[NH2+]C[C@@H](NC(=O)[C@H](C(C)C)N1CCCC1)C(C)(C)C ZINC001423623950 1382184991 /nfs/dbraw/zinc/18/49/91/1382184991.db2.gz XAQHKRMAMMNTTA-SJORKVTESA-N 1 3 325.541 2.883 10 0 EFAEHO CC[C@@H](F)CN1CCC([C@@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)CC1 ZINC001423656682 1382236331 /nfs/dbraw/zinc/23/63/31/1382236331.db2.gz MZPQSWDUWRIGTP-NVXWUHKLSA-N 1 3 341.515 2.826 10 0 EFAEHO CC[C@@H](C(=O)NC1(C2CC[NH+](CC3CCCC3)CC2)CC1)N(C)C ZINC001423702937 1382319501 /nfs/dbraw/zinc/31/95/01/1382319501.db2.gz XJOTZQFIOROXOO-SFHVURJKSA-N 1 3 335.536 2.878 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@]1(C)CCC[N@H+](CC2CC(C)(C)C2)C1 ZINC001423704056 1382321787 /nfs/dbraw/zinc/32/17/87/1382321787.db2.gz KQRMFBVXRXLFEY-HXUWFJFHSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@]1(C)CCC[N@@H+](CC2CC(C)(C)C2)C1 ZINC001423704056 1382321794 /nfs/dbraw/zinc/32/17/94/1382321794.db2.gz KQRMFBVXRXLFEY-HXUWFJFHSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](F)CC[N@@H+]1CCC[C@@](C)(CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001423708411 1382331626 /nfs/dbraw/zinc/33/16/26/1382331626.db2.gz UVGVZVPHNRVQOM-APWZRJJASA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](F)CC[N@H+]1CCC[C@@](C)(CNC(=O)C(C)(C)N2CCCC2)C1 ZINC001423708411 1382331633 /nfs/dbraw/zinc/33/16/33/1382331633.db2.gz UVGVZVPHNRVQOM-APWZRJJASA-N 1 3 341.515 2.827 10 0 EFAEHO CC[NH2+]C[C@H](NC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CCCCC1 ZINC001438745223 1388782365 /nfs/dbraw/zinc/78/23/65/1388782365.db2.gz IQWQSTVEJVNVJY-QFBILLFUSA-N 1 3 341.515 2.874 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H]1CCN(C(=O)CN(C)C(C)C)C[C@H]1C ZINC001438765048 1388795366 /nfs/dbraw/zinc/79/53/66/1388795366.db2.gz FYUQSZSTMMBSBA-QUCCMNQESA-N 1 3 345.531 2.970 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@H+]([C@@H](C)c3ccc(F)cc3)C[C@@H]2C1 ZINC001423994664 1382606842 /nfs/dbraw/zinc/60/68/42/1382606842.db2.gz ALLLHVHVPIEVOZ-RYQLBKOJSA-N 1 3 347.478 2.617 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]2C[N@@H+]([C@@H](C)c3ccc(F)cc3)C[C@@H]2C1 ZINC001423994664 1382606845 /nfs/dbraw/zinc/60/68/45/1382606845.db2.gz ALLLHVHVPIEVOZ-RYQLBKOJSA-N 1 3 347.478 2.617 10 0 EFAEHO CC[N@H+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(F)c1 ZINC001424036452 1382651425 /nfs/dbraw/zinc/65/14/25/1382651425.db2.gz AEUPFDJVVFOYHS-MOPGFXCFSA-N 1 3 347.478 2.733 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(F)c1 ZINC001424036452 1382651426 /nfs/dbraw/zinc/65/14/26/1382651426.db2.gz AEUPFDJVVFOYHS-MOPGFXCFSA-N 1 3 347.478 2.733 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C)[C@H]1C[NH2+]Cc1ccc(F)cc1 ZINC001438770936 1388799631 /nfs/dbraw/zinc/79/96/31/1388799631.db2.gz VTHFJCCGWAWFDY-QFBILLFUSA-N 1 3 349.494 2.883 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H](C)[C@@H]1C[NH2+]Cc1ccc(F)cc1 ZINC001438770935 1388799972 /nfs/dbraw/zinc/79/99/72/1388799972.db2.gz VTHFJCCGWAWFDY-LPHOPBHVSA-N 1 3 349.494 2.883 10 0 EFAEHO Cc1ccc(F)c(CNC2(CNC(=O)[C@@H](C(C)C)[NH+](C)C)CCC2)c1 ZINC001424223520 1382881630 /nfs/dbraw/zinc/88/16/30/1382881630.db2.gz NKWJGWMLESKRLQ-GOSISDBHSA-N 1 3 349.494 2.849 10 0 EFAEHO CN(CCC[N@H+](C)[C@H]1CCc2ccc(F)cc21)C(=O)CN1CCCC1 ZINC001424332842 1382946650 /nfs/dbraw/zinc/94/66/50/1382946650.db2.gz TZGNAPKATQNHKQ-IBGZPJMESA-N 1 3 347.478 2.689 10 0 EFAEHO CN(CCC[N@@H+](C)[C@H]1CCc2ccc(F)cc21)C(=O)CN1CCCC1 ZINC001424332842 1382946657 /nfs/dbraw/zinc/94/66/57/1382946657.db2.gz TZGNAPKATQNHKQ-IBGZPJMESA-N 1 3 347.478 2.689 10 0 EFAEHO CC(C)C[C@@H](C)C[NH2+]C1(C)CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001424489564 1383046608 /nfs/dbraw/zinc/04/66/08/1383046608.db2.gz GWAYZYYOENEZJV-QZTJIDSGSA-N 1 3 337.552 2.981 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[N@H+](Cc2ccsc2)CC1(C)C)C1CCC1 ZINC001424516878 1383068872 /nfs/dbraw/zinc/06/88/72/1383068872.db2.gz LEFHNEBBMHYPFT-QGZVFWFLSA-N 1 3 349.544 2.949 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[N@@H+](Cc2ccsc2)CC1(C)C)C1CCC1 ZINC001424516878 1383068876 /nfs/dbraw/zinc/06/88/76/1383068876.db2.gz LEFHNEBBMHYPFT-QGZVFWFLSA-N 1 3 349.544 2.949 10 0 EFAEHO CC(C)CC[NH2+][C@@H](CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001438825768 1388843360 /nfs/dbraw/zinc/84/33/60/1388843360.db2.gz FYFWYQFTGLZMMQ-QFBILLFUSA-N 1 3 343.531 2.975 10 0 EFAEHO CN(C)C1(C(=O)NC2CC(C[NH2+]Cc3ccc(Cl)cc3)C2)CCC1 ZINC001424728886 1383301625 /nfs/dbraw/zinc/30/16/25/1383301625.db2.gz ZAWDCJBGGLUMFG-UHFFFAOYSA-N 1 3 349.906 2.809 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]CC2CC(NC(=O)[C@@H](C(C)C)N(C)C)C2)c1 ZINC001424739128 1383309513 /nfs/dbraw/zinc/30/95/13/1383309513.db2.gz DCKNRVPLUNBMMM-GXOAENINSA-N 1 3 349.494 2.705 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)[C@H](C)NC(=O)C23CCC[NH+]2CCC3)c1 ZINC001424786311 1383345551 /nfs/dbraw/zinc/34/55/51/1383345551.db2.gz KIZIXLPHAXLXRL-CVEARBPZSA-N 1 3 347.478 2.745 10 0 EFAEHO Cc1ccc(CC[NH2+][C@H](C)[C@H](C)NC(=O)C(C)(C)N2CCCC2)cc1 ZINC001424817467 1383376794 /nfs/dbraw/zinc/37/67/94/1383376794.db2.gz OWMRPSWVKFDPIV-MSOLQXFVSA-N 1 3 345.531 2.895 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)[C@@H](C)NCc1cc2ccccc2o1 ZINC001424844765 1383408748 /nfs/dbraw/zinc/40/87/48/1383408748.db2.gz UCYPKPFMLPFKLW-HUUCEWRRSA-N 1 3 331.460 2.757 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)[C@@H](C)NCc1cc2ccccc2o1 ZINC001424844765 1383408752 /nfs/dbraw/zinc/40/87/52/1383408752.db2.gz UCYPKPFMLPFKLW-HUUCEWRRSA-N 1 3 331.460 2.757 10 0 EFAEHO CC[C@H](F)C[NH2+]CC(C)(C)CN(C)C(=O)[C@H]1CCCN1C(C)C ZINC001424869178 1383443886 /nfs/dbraw/zinc/44/38/86/1383443886.db2.gz KRXNAHHZLCCWRN-JKSUJKDBSA-N 1 3 329.504 2.682 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)CC(C)(C)C[NH2+]CC1CCCCC1 ZINC001424900703 1383476192 /nfs/dbraw/zinc/47/61/92/1383476192.db2.gz OXQOJWDIRUTOGL-UHFFFAOYSA-N 1 3 325.541 2.981 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1CCCCC[N@@H+]1CCCF)N1CCCCCC1 ZINC001425194626 1383539631 /nfs/dbraw/zinc/53/96/31/1383539631.db2.gz XTUICZPHCOBFAR-ROUUACIJSA-N 1 3 341.515 2.971 10 0 EFAEHO C[C@@H](C(=O)NC[C@@H]1CCCCC[N@H+]1CCCF)N1CCCCCC1 ZINC001425194626 1383539637 /nfs/dbraw/zinc/53/96/37/1383539637.db2.gz XTUICZPHCOBFAR-ROUUACIJSA-N 1 3 341.515 2.971 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C1C[NH+](Cc2ccccc2C2CC2)C1 ZINC001425259042 1383575553 /nfs/dbraw/zinc/57/55/53/1383575553.db2.gz BQVBOUMPRWYVCL-INIZCTEOSA-N 1 3 343.515 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1C[NH+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC001425262185 1383578491 /nfs/dbraw/zinc/57/84/91/1383578491.db2.gz GOEKZXHJMUOVEZ-HUUCEWRRSA-N 1 3 345.478 2.589 10 0 EFAEHO COc1cccc([C@H](C)[NH2+]C[C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001425415423 1383651713 /nfs/dbraw/zinc/65/17/13/1383651713.db2.gz PGADJEUYORHLPA-BQFCYCMXSA-N 1 3 347.503 2.581 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)[C@@H](C[NH2+]CC2CC(C)(C)C2)C2CC2)C1 ZINC001425501180 1383672464 /nfs/dbraw/zinc/67/24/64/1383672464.db2.gz WAHQIGMPZROTAN-QAPCUYQASA-N 1 3 335.536 2.591 10 0 EFAEHO Cc1cccnc1CN[C@H](C)CN(C)C(=O)[C@H](C)[NH+]1CCCCCC1 ZINC001425642371 1383731562 /nfs/dbraw/zinc/73/15/62/1383731562.db2.gz PWRAYMSAKDEOCE-MSOLQXFVSA-N 1 3 346.519 2.591 10 0 EFAEHO C[C@@H](CN(C)C(=O)CC[NH+](C)C)N[C@@H](C)c1ccccc1Cl ZINC001425643721 1383732636 /nfs/dbraw/zinc/73/26/36/1383732636.db2.gz VSTXMUWPSVKZJD-KBPBESRZSA-N 1 3 325.884 2.789 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+][C@H]1CCCc2ccccc21 ZINC001425689118 1383767447 /nfs/dbraw/zinc/76/74/47/1383767447.db2.gz BJUSHDXUKDWFGD-APWZRJJASA-N 1 3 331.504 2.841 10 0 EFAEHO CC(C)N(C)CC(=O)N(C)C[C@@H](C)[NH2+]Cc1cccc2cccnc21 ZINC001425702426 1383780661 /nfs/dbraw/zinc/78/06/61/1383780661.db2.gz UYSOTWFIAVOVBA-MRXNPFEDSA-N 1 3 342.487 2.512 10 0 EFAEHO C[NH+](C)CC1(C(=O)N[C@@]23CCC[C@H]2N(Cc2ccsc2)CC3)CC1 ZINC001425904494 1383842881 /nfs/dbraw/zinc/84/28/81/1383842881.db2.gz JPOSXGCKVCTXSZ-VQIMIIECSA-N 1 3 347.528 2.703 10 0 EFAEHO CC(C)N(CC[N@H+](C)[C@@H]1CCc2ccccc21)C(=O)[C@H]1CCCN1C ZINC001426110309 1383992712 /nfs/dbraw/zinc/99/27/12/1383992712.db2.gz DXWCIZDAIIMFDJ-WOJBJXKFSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(CC[N@@H+](C)[C@@H]1CCc2ccccc21)C(=O)[C@H]1CCCN1C ZINC001426110309 1383992715 /nfs/dbraw/zinc/99/27/15/1383992715.db2.gz DXWCIZDAIIMFDJ-WOJBJXKFSA-N 1 3 343.515 2.937 10 0 EFAEHO C[C@H](NC[C@H](NC(=O)CC[NH+](C)C)C(C)(C)C)c1ccccc1F ZINC001426134497 1384016902 /nfs/dbraw/zinc/01/69/02/1384016902.db2.gz GEPFXJJVAZGCHW-YOEHRIQHSA-N 1 3 337.483 2.959 10 0 EFAEHO CCCN(C)CC(=O)N(C)C1CC([NH2+]C[C@@H]2CCCC(F)(F)C2)C1 ZINC001426241441 1384091038 /nfs/dbraw/zinc/09/10/38/1384091038.db2.gz XXLDHRLZKXNEIK-QQFBHYJXSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[N@H+](C)CC2CCC3(CC3)CC2)C1 ZINC001438914988 1388913393 /nfs/dbraw/zinc/91/33/93/1388913393.db2.gz DEXLXNPEOSWQTE-QGZVFWFLSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[N@@H+](C)CC2CCC3(CC3)CC2)C1 ZINC001438914988 1388913397 /nfs/dbraw/zinc/91/33/97/1388913397.db2.gz DEXLXNPEOSWQTE-QGZVFWFLSA-N 1 3 335.536 2.689 10 0 EFAEHO C[C@H](c1ccc2c(c1)CCC2)[N@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001438940394 1388940786 /nfs/dbraw/zinc/94/07/86/1388940786.db2.gz YCYNJPPXWMHGAB-QGZVFWFLSA-N 1 3 343.515 2.722 10 0 EFAEHO C[C@H](c1ccc2c(c1)CCC2)[N@@H+](C)CCN(C)C(=O)CN1CCCC1 ZINC001438940394 1388940790 /nfs/dbraw/zinc/94/07/90/1388940790.db2.gz YCYNJPPXWMHGAB-QGZVFWFLSA-N 1 3 343.515 2.722 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)CC[NH2+][C@H]1CCCc2ccccc21 ZINC001439071796 1388978015 /nfs/dbraw/zinc/97/80/15/1388978015.db2.gz KXOSRDFFVOWCNQ-APWZRJJASA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)CC[NH2+][C@H]1CCCc2ccccc21 ZINC001439071801 1388978105 /nfs/dbraw/zinc/97/81/05/1388978105.db2.gz KXOSRDFFVOWCNQ-LPHOPBHVSA-N 1 3 331.504 2.889 10 0 EFAEHO Cc1cccc(CN2C[C@@H](NC(=O)C3(C[NH+](C)C)CC3)C(C)(C)C2)c1 ZINC001506749109 1406247631 /nfs/dbraw/zinc/24/76/31/1406247631.db2.gz NZDSDYJLEWWMLR-GOSISDBHSA-N 1 3 343.515 2.663 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H]2C[N@H+](CCC3CC3)C[C@H]2C1)CC(C)(C)C ZINC001506851527 1406333782 /nfs/dbraw/zinc/33/37/82/1406333782.db2.gz DLZIFRNLGWYQSK-IPMKNSEASA-N 1 3 349.563 2.981 10 0 EFAEHO CN(CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CCC3CC3)C[C@H]2C1)CC(C)(C)C ZINC001506851527 1406333794 /nfs/dbraw/zinc/33/37/94/1406333794.db2.gz DLZIFRNLGWYQSK-IPMKNSEASA-N 1 3 349.563 2.981 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N3CCN(C)C4(CCCCC4)C3)C[N@@H+]2C1 ZINC001434006509 1387053674 /nfs/dbraw/zinc/05/36/74/1387053674.db2.gz JLZNPMTYIPWUAZ-KZNAEPCWSA-N 1 3 333.520 2.584 10 0 EFAEHO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N3CCN(C)C4(CCCCC4)C3)C[N@H+]2C1 ZINC001434006509 1387053683 /nfs/dbraw/zinc/05/36/83/1387053683.db2.gz JLZNPMTYIPWUAZ-KZNAEPCWSA-N 1 3 333.520 2.584 10 0 EFAEHO C[NH+](C)[C@@H]1C[C@H](NC(=O)c2cccc(CN3CCCC3)c2)C1(C)C ZINC001434121581 1387098964 /nfs/dbraw/zinc/09/89/64/1387098964.db2.gz WUGZMSAKWPLGSH-ZWKOTPCHSA-N 1 3 329.488 2.741 10 0 EFAEHO Cc1cccc(C)c1C[NH2+]C[C@H](C)NC(=O)[C@H]1CCCN1C(C)C ZINC001439215110 1389052642 /nfs/dbraw/zinc/05/26/42/1389052642.db2.gz MRSZTBNSAJWICZ-PKOBYXMFSA-N 1 3 331.504 2.771 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC001439284500 1389096377 /nfs/dbraw/zinc/09/63/77/1389096377.db2.gz KMONKDVMHPYZQA-KBXCAEBGSA-N 1 3 335.467 2.638 10 0 EFAEHO C[C@@H](C[N@H+](C)CC[C@@H]1CCCC1(F)F)NC(=O)CN(C)C1CCC1 ZINC001439331344 1389149762 /nfs/dbraw/zinc/14/97/62/1389149762.db2.gz LOEZARFGJAYSSN-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO C[C@@H](C[N@@H+](C)CC[C@@H]1CCCC1(F)F)NC(=O)CN(C)C1CCC1 ZINC001439331344 1389149768 /nfs/dbraw/zinc/14/97/68/1389149768.db2.gz LOEZARFGJAYSSN-GJZGRUSLSA-N 1 3 345.478 2.733 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)NC[C@@H]1CCN1[C@@H]1CCc2ccccc21 ZINC001439576727 1389324620 /nfs/dbraw/zinc/32/46/20/1389324620.db2.gz YWKTZAJTRFOQSH-AZUAARDMSA-N 1 3 341.499 2.740 10 0 EFAEHO O=C(CCC[NH+]1CCCC1)NC[C@@H]1CCN1[C@H]1CCc2ccccc21 ZINC001439576730 1389324637 /nfs/dbraw/zinc/32/46/37/1389324637.db2.gz YWKTZAJTRFOQSH-ICSRJNTNSA-N 1 3 341.499 2.740 10 0 EFAEHO C[NH+](C)CCCC(=O)NCC1(N[C@H]2CCc3ccc(Cl)cc32)CC1 ZINC001439637891 1389328178 /nfs/dbraw/zinc/32/81/78/1389328178.db2.gz FUYIEZAPIZDACU-KRWDZBQOSA-N 1 3 349.906 2.908 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@@]1(C)CCCN(CCc2ccccc2F)C1 ZINC001439938118 1389356613 /nfs/dbraw/zinc/35/66/13/1389356613.db2.gz ILHTXMZSHUDDKU-HXUWFJFHSA-N 1 3 349.494 2.538 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H](C)[C@@H](C[NH2+]Cc2ccccc2CC)C1 ZINC001440135713 1389406508 /nfs/dbraw/zinc/40/65/08/1389406508.db2.gz LMYUWIZHXUKNRP-PXNSSMCTSA-N 1 3 345.531 2.775 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2c(C)cccc2C)C1 ZINC001440137264 1389407227 /nfs/dbraw/zinc/40/72/27/1389407227.db2.gz QLCGRGYIUFPHJF-MOPGFXCFSA-N 1 3 345.531 2.829 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccccc2C[N@H+](C)CCC2CC2)C1 ZINC001440215062 1389444314 /nfs/dbraw/zinc/44/43/14/1389444314.db2.gz BRCHVKFUNPDGDE-KRWDZBQOSA-N 1 3 343.515 2.877 10 0 EFAEHO C[C@H]1CCN(CC(=O)NCc2ccccc2C[N@@H+](C)CCC2CC2)C1 ZINC001440215062 1389444318 /nfs/dbraw/zinc/44/43/18/1389444318.db2.gz BRCHVKFUNPDGDE-KRWDZBQOSA-N 1 3 343.515 2.877 10 0 EFAEHO CN(C[C@H]1CCN1CCC1CC1)C(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001440240015 1389467424 /nfs/dbraw/zinc/46/74/24/1389467424.db2.gz HSTPUGUGDNVCBW-APWZRJJASA-N 1 3 339.499 2.532 10 0 EFAEHO CN(C[C@H]1CCN1CCC1CC1)C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001440240015 1389467427 /nfs/dbraw/zinc/46/74/27/1389467427.db2.gz HSTPUGUGDNVCBW-APWZRJJASA-N 1 3 339.499 2.532 10 0 EFAEHO CC(C)(C(=O)NC[C@H]1C[C@@H]([NH2+]Cc2ccsc2)C1)N1CCCCC1 ZINC001440281143 1389502181 /nfs/dbraw/zinc/50/21/81/1389502181.db2.gz ZUGQPRPAEAOFIJ-CALCHBBNSA-N 1 3 349.544 2.997 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)NC[C@H]1C[C@@H](NCC=C(Cl)Cl)C1 ZINC001440314217 1389526438 /nfs/dbraw/zinc/52/64/38/1389526438.db2.gz RRTZOOOTDMZNFD-XDQVBPFNSA-N 1 3 348.318 2.663 10 0 EFAEHO C[NH+](C)CCC(=O)NCC1(NCc2ccc(F)c(Cl)c2)CCC1 ZINC001440335740 1389542907 /nfs/dbraw/zinc/54/29/07/1389542907.db2.gz ZRBXLYPFEMZTRL-UHFFFAOYSA-N 1 3 341.858 2.559 10 0 EFAEHO CCCCCC[N@@H+]1C[C@@]2(C)CN(C(=O)Cc3c[nH]cn3)C[C@@]2(C)C1 ZINC001506869509 1406384197 /nfs/dbraw/zinc/38/41/97/1406384197.db2.gz XKQCSAZPSLMYFL-KDURUIRLSA-N 1 3 332.492 2.703 10 0 EFAEHO CCCCCC[N@H+]1C[C@@]2(C)CN(C(=O)Cc3c[nH]cn3)C[C@@]2(C)C1 ZINC001506869509 1406384208 /nfs/dbraw/zinc/38/42/08/1406384208.db2.gz XKQCSAZPSLMYFL-KDURUIRLSA-N 1 3 332.492 2.703 10 0 EFAEHO C[C@H]1CC[C@H](C)N1CC(=O)NCC1([NH2+]Cc2ccccc2)CCC1 ZINC001440350485 1389555794 /nfs/dbraw/zinc/55/57/94/1389555794.db2.gz DIMYPQVDAGTFKG-IRXDYDNUSA-N 1 3 329.488 2.688 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1C[C@H]([NH2+]C[C@H]2CCCC(F)(F)C2)C1 ZINC001440361607 1389566689 /nfs/dbraw/zinc/56/66/89/1389566689.db2.gz IBJQWAVGZUHFDJ-JYJNAYRXSA-N 1 3 345.478 2.637 10 0 EFAEHO C[C@H](N[C@H]1C[C@H](CNC(=O)C[C@H]2CC[N@H+](C)C2)C1)c1ccccc1F ZINC001440363489 1389568775 /nfs/dbraw/zinc/56/87/75/1389568775.db2.gz HPKLXCSHJPTPLT-YVSFHVDLSA-N 1 3 347.478 2.713 10 0 EFAEHO C[C@H](N[C@H]1C[C@H](CNC(=O)C[C@H]2CC[N@@H+](C)C2)C1)c1ccccc1F ZINC001440363489 1389568780 /nfs/dbraw/zinc/56/87/80/1389568780.db2.gz HPKLXCSHJPTPLT-YVSFHVDLSA-N 1 3 347.478 2.713 10 0 EFAEHO CC[C@@H](C(=O)NC[C@H]1C[C@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)C1)N(C)C ZINC001440372103 1389573534 /nfs/dbraw/zinc/57/35/34/1389573534.db2.gz UBRNHXPKOOOQIW-FPCVCCKLSA-N 1 3 345.478 2.637 10 0 EFAEHO CC1CC(C[NH2+][C@@H]2CC[C@H](CNC(=O)C(C)(C)N3CCCC3)C2)C1 ZINC001440387366 1389584398 /nfs/dbraw/zinc/58/43/98/1389584398.db2.gz GCFVBQNCHIYGJN-JYSRZZCRSA-N 1 3 335.536 2.781 10 0 EFAEHO CC[C@@H](F)CN1CCC[C@@H](NC(=O)CCC[NH+]2CCCCC2)CC1 ZINC001440405091 1389603978 /nfs/dbraw/zinc/60/39/78/1389603978.db2.gz QBBDQTONQBEZJL-QZTJIDSGSA-N 1 3 341.515 2.971 10 0 EFAEHO CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)C2(C[NH+](C)C)CC2)C1 ZINC001440420718 1389617393 /nfs/dbraw/zinc/61/73/93/1389617393.db2.gz KUZYUQDSPAAMOB-RTBURBONSA-N 1 3 343.515 2.713 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)[C@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC001440463372 1389664539 /nfs/dbraw/zinc/66/45/39/1389664539.db2.gz FVKWBBJIEQMJOB-YJBOKZPZSA-N 1 3 347.494 2.727 10 0 EFAEHO CC[C@H](F)CN(C)CCCN(C)C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC001440463372 1389664543 /nfs/dbraw/zinc/66/45/43/1389664543.db2.gz FVKWBBJIEQMJOB-YJBOKZPZSA-N 1 3 347.494 2.727 10 0 EFAEHO Cc1cccnc1CN(C)CCCN(C)C(=O)C[NH+]1[C@H](C)CC[C@H]1C ZINC001440486846 1389691616 /nfs/dbraw/zinc/69/16/16/1389691616.db2.gz ZYQCUCHGQGPJTD-QZTJIDSGSA-N 1 3 346.519 2.543 10 0 EFAEHO Cc1cc(C)cc(C[N@H+]2CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@H]2C)c1 ZINC001440491458 1389695658 /nfs/dbraw/zinc/69/56/58/1389695658.db2.gz WPBUODYMXFOEQQ-YZGWKJHDSA-N 1 3 345.531 2.969 10 0 EFAEHO Cc1cc(C)cc(C[N@@H+]2CC[C@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@H]2C)c1 ZINC001440491458 1389695659 /nfs/dbraw/zinc/69/56/59/1389695659.db2.gz WPBUODYMXFOEQQ-YZGWKJHDSA-N 1 3 345.531 2.969 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2C)[C@@H]1C ZINC001440492549 1389697607 /nfs/dbraw/zinc/69/76/07/1389697607.db2.gz XWVOUOGMLHTPBF-NEWSRXKRSA-N 1 3 349.494 2.754 10 0 EFAEHO CCN(CC)C[C@H](F)C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2C)[C@@H]1C ZINC001440492549 1389697610 /nfs/dbraw/zinc/69/76/10/1389697610.db2.gz XWVOUOGMLHTPBF-NEWSRXKRSA-N 1 3 349.494 2.754 10 0 EFAEHO CCC1([NH2+]Cc2ccccn2)CCN(C(=O)[C@H](C(C)C)N(C)C)CC1 ZINC001440519738 1389721639 /nfs/dbraw/zinc/72/16/39/1389721639.db2.gz KGSXDVMTYIVFCN-SFHVURJKSA-N 1 3 346.519 2.529 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC(C)([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC001440613244 1389774623 /nfs/dbraw/zinc/77/46/23/1389774623.db2.gz KNUZVHXYJAPLDH-HNNXBMFYSA-N 1 3 345.478 2.733 10 0 EFAEHO Cc1ccc(C[NH2+]C2(C)CCN(C(=O)CN(C)C(C)C)CC2)cc1 ZINC001440612208 1389774633 /nfs/dbraw/zinc/77/46/33/1389774633.db2.gz CZHKNPPQWAOSFM-UHFFFAOYSA-N 1 3 331.504 2.806 10 0 EFAEHO CC[C@H](F)C[N@H+](CC)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001440706771 1389829565 /nfs/dbraw/zinc/82/95/65/1389829565.db2.gz NOILPBDBXJKDAR-AEFFLSMTSA-N 1 3 341.515 2.637 10 0 EFAEHO CC[C@H](F)C[N@@H+](CC)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001440706771 1389829571 /nfs/dbraw/zinc/82/95/71/1389829571.db2.gz NOILPBDBXJKDAR-AEFFLSMTSA-N 1 3 341.515 2.637 10 0 EFAEHO CC(C)[N@@H+]1CCC[C@H]1C(=O)NC1CC(CNC/C(Cl)=C\Cl)C1 ZINC001440751150 1389868807 /nfs/dbraw/zinc/86/88/07/1389868807.db2.gz ASRHJRTZWVQLSF-CXQMHABZSA-N 1 3 348.318 2.663 10 0 EFAEHO CC(C)[N@H+]1CCC[C@H]1C(=O)NC1CC(CNC/C(Cl)=C\Cl)C1 ZINC001440751150 1389868816 /nfs/dbraw/zinc/86/88/16/1389868816.db2.gz ASRHJRTZWVQLSF-CXQMHABZSA-N 1 3 348.318 2.663 10 0 EFAEHO C[NH+]1CCC(CC(=O)NC2CC(CNC/C(Cl)=C/Cl)C2)CC1 ZINC001440760752 1389875393 /nfs/dbraw/zinc/87/53/93/1389875393.db2.gz SVXIMUCVLSQYAA-ZROIWOOFSA-N 1 3 348.318 2.522 10 0 EFAEHO C[C@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001440805094 1389910766 /nfs/dbraw/zinc/91/07/66/1389910766.db2.gz YZCXKJIDTMNFQJ-HOTGVXAUSA-N 1 3 343.515 2.642 10 0 EFAEHO C[C@@H](NCc1cc2ccccc2o1)[C@@H](C)NC(=O)C1(C[NH+](C)C)CC1 ZINC001440819663 1389923797 /nfs/dbraw/zinc/92/37/97/1389923797.db2.gz NFSLFGHDIKXHDF-HUUCEWRRSA-N 1 3 343.471 2.757 10 0 EFAEHO COc1cccc(C[NH2+][C@H](C)[C@H](C)NC(=O)CN(C)CC(C)(C)C)c1 ZINC001440828895 1389930898 /nfs/dbraw/zinc/93/08/98/1389930898.db2.gz GIPYUSZDSXJJMI-CVEARBPZSA-N 1 3 349.519 2.656 10 0 EFAEHO C[C@H](F)CC[NH2+]C1CCC(N(C)C(=O)CN2CCC(C)CC2)CC1 ZINC001440860005 1389961950 /nfs/dbraw/zinc/96/19/50/1389961950.db2.gz SSWSHJXJUHGIFY-AOCRQIFASA-N 1 3 341.515 2.826 10 0 EFAEHO CCCCC[NH2+]C[C@H]1C[C@H](NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001506897561 1406415061 /nfs/dbraw/zinc/41/50/61/1406415061.db2.gz QEKDYKQVVPNWNA-BXWFABGCSA-N 1 3 341.515 2.874 10 0 EFAEHO C[C@H](CNC(=O)CC[NH+](C)C)N(C)Cc1ccc(C(F)(F)F)cc1 ZINC001440964924 1390055942 /nfs/dbraw/zinc/05/59/42/1390055942.db2.gz VQJOPSXRJHNMDY-CYBMUJFWSA-N 1 3 345.409 2.594 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H](C[NH2+]Cc2c(C)cccc2C)C1 ZINC001506903020 1406420869 /nfs/dbraw/zinc/42/08/69/1406420869.db2.gz IJHQMZFRPKEKRB-IYARVYRRSA-N 1 3 331.504 2.630 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)[N@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001440991381 1391009230 /nfs/dbraw/zinc/00/92/30/1391009230.db2.gz KMHXDIJHGMTFJS-JSGCOSHPSA-N 1 3 342.434 2.523 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H](C)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC001440991381 1391009233 /nfs/dbraw/zinc/00/92/33/1391009233.db2.gz KMHXDIJHGMTFJS-JSGCOSHPSA-N 1 3 342.434 2.523 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CC12CC[NH+](CC1CC(C)(C)C1)CC2 ZINC001441154494 1391151327 /nfs/dbraw/zinc/15/13/27/1391151327.db2.gz OENOHAQNNBSEGF-KRWDZBQOSA-N 1 3 335.536 2.734 10 0 EFAEHO C[C@@H](NC(=O)CC[NH+](C)C)C1CN([C@H]2CCCc3ccc(F)cc32)C1 ZINC001441184522 1391166055 /nfs/dbraw/zinc/16/60/55/1391166055.db2.gz VUNJAFBXEXUACJ-KUHUBIRLSA-N 1 3 347.478 2.591 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@H+](CCC(C)(C)C)C[C@H]2C1 ZINC001441343380 1391261504 /nfs/dbraw/zinc/26/15/04/1391261504.db2.gz UOGRGXZNBJIJMU-RCCFBDPRSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CCC(C)(C)C)C[C@H]2C1 ZINC001441343380 1391261508 /nfs/dbraw/zinc/26/15/08/1391261508.db2.gz UOGRGXZNBJIJMU-RCCFBDPRSA-N 1 3 337.552 2.981 10 0 EFAEHO CCCN(C)CC(=O)N[C@H]1C[C@H]([NH2+][C@@H](C)c2cc(C)ccc2C)C1 ZINC001441415267 1391291068 /nfs/dbraw/zinc/29/10/68/1391291068.db2.gz IKJOKRPVJKSJAS-BZSNNMDCSA-N 1 3 331.504 2.943 10 0 EFAEHO Cc1ccc(F)c(C[NH2+]C[C@H](C2CC2)N(C)C(=O)CN(C)C(C)C)c1 ZINC001441462109 1391325625 /nfs/dbraw/zinc/32/56/25/1391325625.db2.gz LQJSRFNWOQEPBY-LJQANCHMSA-N 1 3 349.494 2.801 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N(C)C[C@H](C)[NH2+]Cc1ccccc1 ZINC001441580411 1391373894 /nfs/dbraw/zinc/37/38/94/1391373894.db2.gz BYDBBRYKKXACJP-PKOBYXMFSA-N 1 3 331.504 2.886 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)[C@H]1C ZINC001441825386 1391420900 /nfs/dbraw/zinc/42/09/00/1391420900.db2.gz NZPBYFWVAPEYIG-OXQOHEQNSA-N 1 3 343.515 2.985 10 0 EFAEHO Cc1ccccc1C[NH2+]C[C@H]1CC[C@H](NC(=O)CN(C)C(C)C)C1 ZINC001441904019 1391434902 /nfs/dbraw/zinc/43/49/02/1391434902.db2.gz VHZZMCYWXCXCCJ-HKUYNNGSSA-N 1 3 331.504 2.710 10 0 EFAEHO CC[C@@H](F)CNCc1ccc(CNC(=O)CC2CC[NH+](C)CC2)cc1 ZINC001444197553 1391461043 /nfs/dbraw/zinc/46/10/43/1391461043.db2.gz ILSFBTHHSAVNFG-LJQANCHMSA-N 1 3 349.494 2.872 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCC2CCN(C/C=C/Cl)CC2)CC[N@@H+]1C ZINC001444221054 1391464089 /nfs/dbraw/zinc/46/40/89/1391464089.db2.gz MIDFXAADRSUHSN-OLVYXRLNSA-N 1 3 341.927 2.688 10 0 EFAEHO C[C@H]1C[C@@H](C(=O)NCCC2CCN(C/C=C/Cl)CC2)CC[N@H+]1C ZINC001444221054 1391464094 /nfs/dbraw/zinc/46/40/94/1391464094.db2.gz MIDFXAADRSUHSN-OLVYXRLNSA-N 1 3 341.927 2.688 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@@H](C)C[NH2+]CC1CCC2(CC2)CC1)N(C)C ZINC001444376167 1391476976 /nfs/dbraw/zinc/47/69/76/1391476976.db2.gz HREADYAEQOZVPE-FUHWJXTLSA-N 1 3 337.552 2.885 10 0 EFAEHO CC[C@@H](F)C[NH2+]C[C@]1(C)CCN(C(=O)c2cccc(CN(C)C)c2)C1 ZINC001446619856 1391560401 /nfs/dbraw/zinc/56/04/01/1391560401.db2.gz XGQPWMOEFDTYLH-QUCCMNQESA-N 1 3 349.494 2.938 10 0 EFAEHO CCCN(C)CC(=O)N(Cc1ccccn1)C1CC[NH+](CCC)CC1 ZINC001446966380 1391648112 /nfs/dbraw/zinc/64/81/12/1391648112.db2.gz MEQLQXZFNKWDQW-UHFFFAOYSA-N 1 3 346.519 2.626 10 0 EFAEHO C[C@H](NCc1cccnc1)c1ccc(CNC(=O)CC[NH+](C)C)cc1 ZINC001447081576 1391693805 /nfs/dbraw/zinc/69/38/05/1391693805.db2.gz ILCATBLLQFTAAC-INIZCTEOSA-N 1 3 340.471 2.500 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@H+](C)CCCC1CCCC1 ZINC001447770102 1391755569 /nfs/dbraw/zinc/75/55/69/1391755569.db2.gz JQMFLJWWMMNBHH-OALUTQOASA-N 1 3 335.536 2.974 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CCC[C@H]1C[N@@H+](C)CCCC1CCCC1 ZINC001447770102 1391755570 /nfs/dbraw/zinc/75/55/70/1391755570.db2.gz JQMFLJWWMMNBHH-OALUTQOASA-N 1 3 335.536 2.974 10 0 EFAEHO CC[N@H+](C)CCC(=O)N[C@H](C)[C@H](C)NCc1sccc1Cl ZINC001447911429 1391799537 /nfs/dbraw/zinc/79/95/37/1391799537.db2.gz QFRIIOZXGGAALK-NWDGAFQWSA-N 1 3 331.913 2.726 10 0 EFAEHO CC[N@@H+](C)CCC(=O)N[C@H](C)[C@H](C)NCc1sccc1Cl ZINC001447911429 1391799543 /nfs/dbraw/zinc/79/95/43/1391799543.db2.gz QFRIIOZXGGAALK-NWDGAFQWSA-N 1 3 331.913 2.726 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H](C)[NH2+]CCc1ccccc1Cl ZINC001447927600 1391822411 /nfs/dbraw/zinc/82/24/11/1391822411.db2.gz VSDWMFFSPTUQIO-OLZOCXBDSA-N 1 3 348.878 2.640 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@H](C)[NH2+]CCc1ccccc1Cl ZINC001447927611 1391823389 /nfs/dbraw/zinc/82/33/89/1391823389.db2.gz VSDWMFFSPTUQIO-STQMWFEESA-N 1 3 348.878 2.640 10 0 EFAEHO CCc1ccccc1CN(C)[C@@H](C)CNC(=O)[C@H]1CC[N@H+](C)[C@@H]1CC ZINC001448014983 1391898790 /nfs/dbraw/zinc/89/87/90/1391898790.db2.gz KWRIHALBGSZBQP-FFZOFVMBSA-N 1 3 345.531 2.916 10 0 EFAEHO CCc1ccccc1CN(C)[C@@H](C)CNC(=O)[C@H]1CC[N@@H+](C)[C@@H]1CC ZINC001448014983 1391898803 /nfs/dbraw/zinc/89/88/03/1391898803.db2.gz KWRIHALBGSZBQP-FFZOFVMBSA-N 1 3 345.531 2.916 10 0 EFAEHO COc1cccc(CN(C)[C@H](C)CNC(=O)CC[C@H]2CCC[N@@H+]2C)c1 ZINC001448036981 1391908236 /nfs/dbraw/zinc/90/82/36/1391908236.db2.gz HWVPPJLXRGKVQF-SJLPKXTDSA-N 1 3 347.503 2.506 10 0 EFAEHO COc1cccc(CN(C)[C@H](C)CNC(=O)CC[C@H]2CCC[N@H+]2C)c1 ZINC001448036981 1391908239 /nfs/dbraw/zinc/90/82/39/1391908239.db2.gz HWVPPJLXRGKVQF-SJLPKXTDSA-N 1 3 347.503 2.506 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@H](C)CNC(=O)CC[C@@H]1CCC[N@@H+]1C ZINC001448042145 1391913349 /nfs/dbraw/zinc/91/33/49/1391913349.db2.gz OPHMTFSUJDTTHH-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(F)cc1CN(C)[C@H](C)CNC(=O)CC[C@@H]1CCC[N@H+]1C ZINC001448042145 1391913353 /nfs/dbraw/zinc/91/33/53/1391913353.db2.gz OPHMTFSUJDTTHH-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[N@H+](C)CC/C=C/c1ccccc1 ZINC001448103997 1391965020 /nfs/dbraw/zinc/96/50/20/1391965020.db2.gz ZEMCHQOTBOVVJE-ZWQQMPCFSA-N 1 3 343.515 2.868 10 0 EFAEHO C[C@@H](CNC(=O)CN1CC[C@@H](C)C1)[N@@H+](C)CC/C=C/c1ccccc1 ZINC001448103997 1391965023 /nfs/dbraw/zinc/96/50/23/1391965023.db2.gz ZEMCHQOTBOVVJE-ZWQQMPCFSA-N 1 3 343.515 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@H+](C)[C@@H]2CCc3ccccc32)CC1 ZINC001506977812 1406536902 /nfs/dbraw/zinc/53/69/02/1406536902.db2.gz NTXFPQCZLHHMCS-HXUWFJFHSA-N 1 3 343.515 2.937 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC([N@@H+](C)[C@@H]2CCc3ccccc32)CC1 ZINC001506977812 1406536909 /nfs/dbraw/zinc/53/69/09/1406536909.db2.gz NTXFPQCZLHHMCS-HXUWFJFHSA-N 1 3 343.515 2.937 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@H+](C)C1)N(C)Cc1ccc(C(C)(C)C)cc1 ZINC001448141660 1391984188 /nfs/dbraw/zinc/98/41/88/1391984188.db2.gz ASMCNRLAABMMFC-WMZOPIPTSA-N 1 3 345.531 2.872 10 0 EFAEHO C[C@@H](CNC(=O)[C@H]1CC[N@@H+](C)C1)N(C)Cc1ccc(C(C)(C)C)cc1 ZINC001448141660 1391984198 /nfs/dbraw/zinc/98/41/98/1391984198.db2.gz ASMCNRLAABMMFC-WMZOPIPTSA-N 1 3 345.531 2.872 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@H+](C)Cc1ccc(C(F)F)cc1 ZINC001448141741 1391984933 /nfs/dbraw/zinc/98/49/33/1391984933.db2.gz GWNWNLXOQXGGKO-AWEZNQCLSA-N 1 3 341.446 2.901 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H](C)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC001448141741 1391984936 /nfs/dbraw/zinc/98/49/36/1391984936.db2.gz GWNWNLXOQXGGKO-AWEZNQCLSA-N 1 3 341.446 2.901 10 0 EFAEHO CC[C@H](F)C[NH2+]C[C@@H](C1CC1)N(C)C(=O)C(C)(C)N1CCCCC1 ZINC001448580651 1392092312 /nfs/dbraw/zinc/09/23/12/1392092312.db2.gz DGSHUIKMONCTCS-IRXDYDNUSA-N 1 3 341.515 2.826 10 0 EFAEHO Cc1cccc(Cl)c1CN[C@@H]1C[C@H](C)N(C(=O)CC[NH+](C)C)C1 ZINC001449028997 1392218575 /nfs/dbraw/zinc/21/85/75/1392218575.db2.gz OXEZZINEFOXGPM-LSDHHAIUSA-N 1 3 337.895 2.679 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]2CCC[C@H]([NH2+]Cc3ccsc3)[C@H]2C1 ZINC001449029119 1392218905 /nfs/dbraw/zinc/21/89/05/1392218905.db2.gz DCLTZILZVUXEOB-BZSNNMDCSA-N 1 3 349.544 2.807 10 0 EFAEHO C[NH+](C)CCc1cccc(C(=O)NC[C@H]2CCCCN2C2CC2)c1 ZINC001449062798 1392246180 /nfs/dbraw/zinc/24/61/80/1392246180.db2.gz HRGRFLXILRZHEI-LJQANCHMSA-N 1 3 329.488 2.537 10 0 EFAEHO CC[C@@H](F)C[NH2+][C@H]1CN(C(=O)CN(C)CC(C)(C)C)CC1(C)C ZINC001449074494 1392250834 /nfs/dbraw/zinc/25/08/34/1392250834.db2.gz BYBCJJDDJZIJJU-CABCVRRESA-N 1 3 329.504 2.539 10 0 EFAEHO Cc1ccc(F)c(CN[C@H](C)CN(C)C(=O)[C@H](C(C)C)[NH+](C)C)c1 ZINC001507086438 1406683568 /nfs/dbraw/zinc/68/35/68/1406683568.db2.gz SIPBFIQXTGZLIA-QAPCUYQASA-N 1 3 337.483 2.657 10 0 EFAEHO Cc1cccc(CCC[NH2+][C@@H](C)CN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001507086663 1406682481 /nfs/dbraw/zinc/68/24/81/1406682481.db2.gz BQTLVZLNFFROGG-SFHVURJKSA-N 1 3 345.531 2.848 10 0 EFAEHO C[C@@H](CN(C)C(=O)C1(N(C)C)CCC1)[NH2+]Cc1ccc(C2CC2)cc1 ZINC001507090965 1406688873 /nfs/dbraw/zinc/68/88/73/1406688873.db2.gz SODORRNHNJTFCX-INIZCTEOSA-N 1 3 343.515 2.985 10 0 EFAEHO COc1cccc([C@@H](C)[NH2+][C@H](C)CN(C)C(=O)CN(C)C2CCC2)c1 ZINC001507092530 1406691120 /nfs/dbraw/zinc/69/11/20/1406691120.db2.gz YUQBGDLGMRWGRS-HZPDHXFCSA-N 1 3 347.503 2.677 10 0 EFAEHO CC[C@H](C)N[C@H](CNC(=O)[C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccco1 ZINC001457819159 1395345854 /nfs/dbraw/zinc/34/58/54/1395345854.db2.gz ZIDREDURCZMTRI-YLFCFFPRSA-N 1 3 335.492 2.945 10 0 EFAEHO CC(C)[C@@](O)(CN1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC001459769487 1395981481 /nfs/dbraw/zinc/98/14/81/1395981481.db2.gz MUSWNQNTVJAFSV-FQEVSTJZSA-N 1 3 325.456 2.747 10 0 EFAEHO COc1ccc([C@H](CN(C)C)NC(=O)[C@@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC001467936226 1396910976 /nfs/dbraw/zinc/91/09/76/1396910976.db2.gz KVKKNUIHFIZNGE-MJGOQNOKSA-N 1 3 347.503 2.535 10 0 EFAEHO COc1ccc([C@H](CN(C)C)NC(=O)[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC001467936226 1396910983 /nfs/dbraw/zinc/91/09/83/1396910983.db2.gz KVKKNUIHFIZNGE-MJGOQNOKSA-N 1 3 347.503 2.535 10 0 EFAEHO C[C@@H]1[C@H]([NH2+]Cc2ccsc2)CCN1C(=O)CN(C)CC(C)(C)C ZINC001507290377 1406855179 /nfs/dbraw/zinc/85/51/79/1406855179.db2.gz XXGSZVKZTNUKNJ-GDBMZVCRSA-N 1 3 337.533 2.805 10 0 EFAEHO C[C@@H]1[C@@H]([NH2+]Cc2ccsc2)CCN1C(=O)CN(C)CC(C)(C)C ZINC001507290379 1406855765 /nfs/dbraw/zinc/85/57/65/1406855765.db2.gz XXGSZVKZTNUKNJ-ZBFHGGJFSA-N 1 3 337.533 2.805 10 0 EFAEHO C[C@@H](C[N@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12 ZINC001470025129 1397067654 /nfs/dbraw/zinc/06/76/54/1397067654.db2.gz CCFXLXCYJHKUIB-CADBVGFASA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H](C[N@@H+](C)CCCN(C)C)NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12 ZINC001470025129 1397067656 /nfs/dbraw/zinc/06/76/56/1397067656.db2.gz CCFXLXCYJHKUIB-CADBVGFASA-N 1 3 337.552 2.981 10 0 EFAEHO Cc1oc(C(C)(C)C)cc1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001470025588 1397068140 /nfs/dbraw/zinc/06/81/40/1397068140.db2.gz GSGCJMVXTGXKIR-AWEZNQCLSA-N 1 3 337.508 2.887 10 0 EFAEHO Cc1oc(C(C)(C)C)cc1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001470025588 1397068135 /nfs/dbraw/zinc/06/81/35/1397068135.db2.gz GSGCJMVXTGXKIR-AWEZNQCLSA-N 1 3 337.508 2.887 10 0 EFAEHO C[C@H](CC[NH+](C)C)C(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@H]1C ZINC001470775486 1397120302 /nfs/dbraw/zinc/12/03/02/1397120302.db2.gz DFXVNAJSEFIDEN-ZHALLVOQSA-N 1 3 331.504 2.601 10 0 EFAEHO CC[C@@H](C)[C@@H]1CCCCN1C(=O)N[C@@H](C)C[N@H+](C)CCCN(C)C ZINC001470772509 1397120855 /nfs/dbraw/zinc/12/08/55/1397120855.db2.gz PYIYPAWCENJFIF-SQNIBIBYSA-N 1 3 340.556 2.869 10 0 EFAEHO CC[C@@H](C)[C@@H]1CCCCN1C(=O)N[C@@H](C)C[N@@H+](C)CCCN(C)C ZINC001470772509 1397120857 /nfs/dbraw/zinc/12/08/57/1397120857.db2.gz PYIYPAWCENJFIF-SQNIBIBYSA-N 1 3 340.556 2.869 10 0 EFAEHO C[C@@H](CC[NH+](C)C)C(=O)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC001471227205 1397151363 /nfs/dbraw/zinc/15/13/63/1397151363.db2.gz NNAIMDUKNAJXFE-HKUYNNGSSA-N 1 3 331.504 2.745 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN3[C@H](C)CC[C@@H]3C)C2)cc1 ZINC001479346314 1397697746 /nfs/dbraw/zinc/69/77/46/1397697746.db2.gz FGIBYUFNJHENBC-TZRIAGMCSA-N 1 3 343.515 2.852 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2C[C@@H](CNC(=O)CN3[C@H](C)CC[C@H]3C)C2)cc1 ZINC001479346305 1397697940 /nfs/dbraw/zinc/69/79/40/1397697940.db2.gz FGIBYUFNJHENBC-LFGUQSLTSA-N 1 3 343.515 2.852 10 0 EFAEHO CCCN(C)CC(=O)N1CCCCC[C@@H]([NH2+]Cc2ccccc2)C1 ZINC001479695583 1397767331 /nfs/dbraw/zinc/76/73/31/1397767331.db2.gz YFDOMEVOPBURSP-LJQANCHMSA-N 1 3 331.504 2.889 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@H+](CC2CCC2)[C@@H]1C)N1CCCCC1 ZINC001479729590 1397784400 /nfs/dbraw/zinc/78/44/00/1397784400.db2.gz BRZJREXXGWLBEZ-NZSAHSFTSA-N 1 3 335.536 2.876 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H]1CC[N@@H+](CC2CCC2)[C@@H]1C)N1CCCCC1 ZINC001479729590 1397784402 /nfs/dbraw/zinc/78/44/02/1397784402.db2.gz BRZJREXXGWLBEZ-NZSAHSFTSA-N 1 3 335.536 2.876 10 0 EFAEHO C[N@H+](CCCNC(=O)C(C)(C)N1CCCCC1)CC1CC(F)(F)C1 ZINC001479771832 1397835990 /nfs/dbraw/zinc/83/59/90/1397835990.db2.gz IMKIHAWRQYDGKO-UHFFFAOYSA-N 1 3 345.478 2.734 10 0 EFAEHO C[N@@H+](CCCNC(=O)C(C)(C)N1CCCCC1)CC1CC(F)(F)C1 ZINC001479771832 1397835993 /nfs/dbraw/zinc/83/59/93/1397835993.db2.gz IMKIHAWRQYDGKO-UHFFFAOYSA-N 1 3 345.478 2.734 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001479774694 1397840245 /nfs/dbraw/zinc/84/02/45/1397840245.db2.gz IPQITFLOZQONEL-QGZVFWFLSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1ccccc1[C@@H](C)[N@@H+](C)CCCNC(=O)C1(N(C)C)CCC1 ZINC001479774694 1397840249 /nfs/dbraw/zinc/84/02/49/1397840249.db2.gz IPQITFLOZQONEL-QGZVFWFLSA-N 1 3 331.504 2.978 10 0 EFAEHO Cc1cc(C)c(C[N@@H+](C)CCCNC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001479796528 1397876251 /nfs/dbraw/zinc/87/62/51/1397876251.db2.gz IWJBZOVOLMDFCH-MRXNPFEDSA-N 1 3 345.531 2.892 10 0 EFAEHO Cc1cc(C)c(C[N@H+](C)CCCNC(=O)CN2CC[C@@H](C)C2)c(C)c1 ZINC001479796528 1397876257 /nfs/dbraw/zinc/87/62/57/1397876257.db2.gz IWJBZOVOLMDFCH-MRXNPFEDSA-N 1 3 345.531 2.892 10 0 EFAEHO Cc1cccnc1C[NH2+][C@H](C)[C@@H]1CCCCN1C(=O)CN(C)C(C)C ZINC001479835861 1397931132 /nfs/dbraw/zinc/93/11/32/1397931132.db2.gz YFQNQRZHDHKWAZ-MJGOQNOKSA-N 1 3 346.519 2.589 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@@H+]21 ZINC001479846631 1397944327 /nfs/dbraw/zinc/94/43/27/1397944327.db2.gz NMNXWOMUDJMGPH-KVQZDWTESA-N 1 3 327.900 2.584 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001479846631 1397944331 /nfs/dbraw/zinc/94/43/31/1397944331.db2.gz NMNXWOMUDJMGPH-KVQZDWTESA-N 1 3 327.900 2.584 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[N@H+](C/C=C/c1ccccc1)C1CC1 ZINC001479873806 1397984608 /nfs/dbraw/zinc/98/46/08/1397984608.db2.gz GPSUSIYLYUMMST-URZUPRTMSA-N 1 3 341.499 2.765 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[N@@H+](C/C=C/c1ccccc1)C1CC1 ZINC001479873806 1397984611 /nfs/dbraw/zinc/98/46/11/1397984611.db2.gz GPSUSIYLYUMMST-URZUPRTMSA-N 1 3 341.499 2.765 10 0 EFAEHO C[C@@H](F)CC[NH+]1CCC(N(C)C(=O)CN(C)CC(C)(C)C)CC1 ZINC001479893689 1398007560 /nfs/dbraw/zinc/00/75/60/1398007560.db2.gz WMPZFBKYYWKPHM-OAHLLOKOSA-N 1 3 329.504 2.635 10 0 EFAEHO Cc1ccc(CN2CCC[C@H](NC(=O)CCCC[NH+](C)C)C2)cc1 ZINC001479913286 1398018946 /nfs/dbraw/zinc/01/89/46/1398018946.db2.gz WEPQLKJWRQLDPW-IBGZPJMESA-N 1 3 331.504 2.808 10 0 EFAEHO C[C@@H](C(=O)N[C@@H]1CC[N@H+](CCCCCF)C1)N1CCCCCC1 ZINC001479965366 1398051605 /nfs/dbraw/zinc/05/16/05/1398051605.db2.gz UKZIHDVHYBHJPK-DLBZAZTESA-N 1 3 327.488 2.581 10 0 EFAEHO C[C@@H](C(=O)N[C@@H]1CC[N@@H+](CCCCCF)C1)N1CCCCCC1 ZINC001479965366 1398051611 /nfs/dbraw/zinc/05/16/11/1398051611.db2.gz UKZIHDVHYBHJPK-DLBZAZTESA-N 1 3 327.488 2.581 10 0 EFAEHO C[C@@H](C(=O)N[C@H]1CC[N@H+](CCCCCF)C1)N1CCCCCC1 ZINC001479965368 1398051777 /nfs/dbraw/zinc/05/17/77/1398051777.db2.gz UKZIHDVHYBHJPK-IRXDYDNUSA-N 1 3 327.488 2.581 10 0 EFAEHO C[C@@H](C(=O)N[C@H]1CC[N@@H+](CCCCCF)C1)N1CCCCCC1 ZINC001479965368 1398051782 /nfs/dbraw/zinc/05/17/82/1398051782.db2.gz UKZIHDVHYBHJPK-IRXDYDNUSA-N 1 3 327.488 2.581 10 0 EFAEHO Cc1ccc(F)c(CN2CCC3(C[C@@H]3NC(=O)CC[NH+](C)C)CC2)c1 ZINC001479985941 1398071341 /nfs/dbraw/zinc/07/13/41/1398071341.db2.gz YYWSOUDUNSGMOL-SFHVURJKSA-N 1 3 347.478 2.557 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)N1CCC[C@@H](CN(C)C/C=C/Cl)C1 ZINC001480078719 1398113581 /nfs/dbraw/zinc/11/35/81/1398113581.db2.gz MRLSEJLJVBOLDF-RUZMYDRRSA-N 1 3 341.927 2.784 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)N1CCC[C@@H](CN(C)C/C=C/Cl)C1 ZINC001480078719 1398113585 /nfs/dbraw/zinc/11/35/85/1398113585.db2.gz MRLSEJLJVBOLDF-RUZMYDRRSA-N 1 3 341.927 2.784 10 0 EFAEHO CN(C)C1(C(=O)N[C@H]2C[C@@H]([NH2+]Cc3cccc(Cl)c3)C2)CCC1 ZINC001480207881 1398165319 /nfs/dbraw/zinc/16/53/19/1398165319.db2.gz KDFIIFHQWQVMIX-IYBDPMFKSA-N 1 3 335.879 2.561 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@@H](C)[NH2+]Cc1ccc2ccccc2c1 ZINC001480595610 1398235978 /nfs/dbraw/zinc/23/59/78/1398235978.db2.gz CKPAROABDHXYDY-MRXNPFEDSA-N 1 3 327.472 2.774 10 0 EFAEHO CCc1ccc(CC[NH2+]C[C@@H]2CCN(C(=O)[C@@H](CC)N(C)C)C2)cc1 ZINC001480654648 1398265785 /nfs/dbraw/zinc/26/57/85/1398265785.db2.gz WZHOLSSUVBLHTR-VQTJNVASSA-N 1 3 345.531 2.570 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC001480683174 1398280469 /nfs/dbraw/zinc/28/04/69/1398280469.db2.gz KOPHPJRZWCROGX-DNVCBOLYSA-N 1 3 347.478 2.591 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@H+](C)C1)[C@H]1CCc2c1cccc2F ZINC001493042343 1398387567 /nfs/dbraw/zinc/38/75/67/1398387567.db2.gz BTGSRTAYWDGHNL-KXBFYZLASA-N 1 3 347.478 2.593 10 0 EFAEHO CCN(CCNC(=O)C[C@@H]1CC[N@@H+](C)C1)[C@H]1CCc2c1cccc2F ZINC001493042343 1398387572 /nfs/dbraw/zinc/38/75/72/1398387572.db2.gz BTGSRTAYWDGHNL-KXBFYZLASA-N 1 3 347.478 2.593 10 0 EFAEHO CC[N@H+](CCNC(=O)CN(C)C(C)C)C[C@@H]1CCc2ccccc2C1 ZINC001493061840 1398406362 /nfs/dbraw/zinc/40/63/62/1398406362.db2.gz IJKSFNHNKHIHRR-GOSISDBHSA-N 1 3 345.531 2.570 10 0 EFAEHO CC[N@@H+](CCNC(=O)CN(C)C(C)C)C[C@@H]1CCc2ccccc2C1 ZINC001493061840 1398406364 /nfs/dbraw/zinc/40/63/64/1398406364.db2.gz IJKSFNHNKHIHRR-GOSISDBHSA-N 1 3 345.531 2.570 10 0 EFAEHO CCN(CCNC(=O)C[NH+]1[C@H](C)CC[C@H]1C)Cc1ccc(C)c(F)c1 ZINC001493062640 1398407306 /nfs/dbraw/zinc/40/73/06/1398407306.db2.gz LHFCNVSRRJPDBB-IAGOWNOFSA-N 1 3 349.494 2.945 10 0 EFAEHO C[NH+](C)CCC(=O)NC[C@H]1CCN(Cc2cccc(C(F)F)c2)C1 ZINC001493236008 1398552702 /nfs/dbraw/zinc/55/27/02/1398552702.db2.gz ZMLQRUBGWLAVOM-OAHLLOKOSA-N 1 3 339.430 2.514 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@@H]1CCC[C@@H]2CCC[N@@H+]21 ZINC001493429292 1398699850 /nfs/dbraw/zinc/69/98/50/1398699850.db2.gz IQTVWTJXEFSOQW-UXHICEINSA-N 1 3 341.499 2.784 10 0 EFAEHO O=C(NCCN(Cc1ccccc1)C1CC1)[C@@H]1CCC[C@@H]2CCC[N@H+]21 ZINC001493429292 1398699852 /nfs/dbraw/zinc/69/98/52/1398699852.db2.gz IQTVWTJXEFSOQW-UXHICEINSA-N 1 3 341.499 2.784 10 0 EFAEHO C[C@@H](NCCN(C)C(=O)CC[NH+](C)C)c1ccc(F)c(Cl)c1 ZINC001493681972 1398804635 /nfs/dbraw/zinc/80/46/35/1398804635.db2.gz SDGVIWZRGSAXBY-GFCCVEGCSA-N 1 3 329.847 2.540 10 0 EFAEHO Cc1cccc(C[NH2+]CCN(C)C(=O)[C@]2(F)CCN(C(C)(C)C)C2)c1 ZINC001493696033 1398814903 /nfs/dbraw/zinc/81/49/03/1398814903.db2.gz OEKZLORGEIYDEE-FQEVSTJZSA-N 1 3 349.494 2.756 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC[C@@H]([NH2+]CC2CCCC2)c2ccccc2)C1 ZINC001493900642 1398965017 /nfs/dbraw/zinc/96/50/17/1398965017.db2.gz ZALUTLFCFZLSLB-FXAWDEMLSA-N 1 3 343.515 2.966 10 0 EFAEHO CC[NH2+][C@H](CCNC(=O)[C@@H]1CCCCN1CC)Cc1ccccc1 ZINC001507388657 1407001200 /nfs/dbraw/zinc/00/12/00/1407001200.db2.gz IIBUJZNJZBLYJK-MOPGFXCFSA-N 1 3 331.504 2.588 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC001494083732 1399122225 /nfs/dbraw/zinc/12/22/25/1399122225.db2.gz QHFWKTBMSLQSHF-ZWKOTPCHSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC001494083732 1399122226 /nfs/dbraw/zinc/12/22/26/1399122226.db2.gz QHFWKTBMSLQSHF-ZWKOTPCHSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC001494083731 1399122651 /nfs/dbraw/zinc/12/26/51/1399122651.db2.gz QHFWKTBMSLQSHF-ROUUACIJSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)N(C)CC(=O)NCC[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC001494083731 1399122645 /nfs/dbraw/zinc/12/26/45/1399122645.db2.gz QHFWKTBMSLQSHF-ROUUACIJSA-N 1 3 331.504 2.916 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N1CC[C@@H](CN(C)C/C=C\Cl)C1 ZINC001494141931 1399162860 /nfs/dbraw/zinc/16/28/60/1399162860.db2.gz PVAFSRWWRUZLMW-BGHPOGFGSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N1CC[C@@H](CN(C)C/C=C\Cl)C1 ZINC001494141931 1399162864 /nfs/dbraw/zinc/16/28/64/1399162864.db2.gz PVAFSRWWRUZLMW-BGHPOGFGSA-N 1 3 341.927 2.640 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@H+](C)[C@H](C)c2ccccc2)C1 ZINC001494179578 1399191703 /nfs/dbraw/zinc/19/17/03/1399191703.db2.gz RWZVJKDJJMQQGN-QZTJIDSGSA-N 1 3 331.504 2.868 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[N@@H+](C)[C@H](C)c2ccccc2)C1 ZINC001494179578 1399191707 /nfs/dbraw/zinc/19/17/07/1399191707.db2.gz RWZVJKDJJMQQGN-QZTJIDSGSA-N 1 3 331.504 2.868 10 0 EFAEHO CCC[N@H+](C)CC1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001494206068 1399212914 /nfs/dbraw/zinc/21/29/14/1399212914.db2.gz JCVQRLBOIURXHJ-LJQANCHMSA-N 1 3 341.515 2.779 10 0 EFAEHO CCC[N@@H+](C)CC1CCN(C(=O)[C@@]2(F)CCN(C(C)(C)C)C2)CC1 ZINC001494206068 1399212917 /nfs/dbraw/zinc/21/29/17/1399212917.db2.gz JCVQRLBOIURXHJ-LJQANCHMSA-N 1 3 341.515 2.779 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N1CCC[C@H]([NH2+]C/C=C\Cl)C1 ZINC001494241911 1399230788 /nfs/dbraw/zinc/23/07/88/1399230788.db2.gz KGCQRGULWYJEDW-OCLYVHKGSA-N 1 3 327.900 2.582 10 0 EFAEHO CCc1ccccc1CN1CC(CNC(=O)C[NH+]2[C@@H](C)CC[C@@H]2C)C1 ZINC001494633645 1399407994 /nfs/dbraw/zinc/40/79/94/1399407994.db2.gz RTDCGVLXBSGINL-IRXDYDNUSA-N 1 3 343.515 2.670 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@H+](CC[C@@H]2CCCC2(F)F)C1)N(C)C ZINC001494710311 1399439168 /nfs/dbraw/zinc/43/91/68/1399439168.db2.gz VGGFELQNXRIICH-JYJNAYRXSA-N 1 3 345.478 2.589 10 0 EFAEHO CC(C)[C@@H](C(=O)N[C@H]1CC[N@@H+](CC[C@@H]2CCCC2(F)F)C1)N(C)C ZINC001494710311 1399439169 /nfs/dbraw/zinc/43/91/69/1399439169.db2.gz VGGFELQNXRIICH-JYJNAYRXSA-N 1 3 345.478 2.589 10 0 EFAEHO Cc1ccc(CN2CC[C@@H](NC(=O)CCCC[NH+](C)C)C2)c(C)c1 ZINC001494786199 1399468237 /nfs/dbraw/zinc/46/82/37/1399468237.db2.gz CKOLWRSGQJQKNE-LJQANCHMSA-N 1 3 331.504 2.726 10 0 EFAEHO Cc1ccc(CC[NH2+]C[C@@H]2CC[C@H](NC(=O)CN(C)C(C)C)C2)cc1 ZINC001507428326 1407041875 /nfs/dbraw/zinc/04/18/75/1407041875.db2.gz OSMNGBUSDDMBQQ-UXHICEINSA-N 1 3 345.531 2.752 10 0 EFAEHO CC[C@H](CNC(=O)CC[NH+]1CCCCC1)NCc1cc(C)ccc1F ZINC001495137442 1399692578 /nfs/dbraw/zinc/69/25/78/1399692578.db2.gz KSHKTRJZPYHVPG-GOSISDBHSA-N 1 3 349.494 2.995 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1C[C@@H]([NH2+]CCCCCF)C(C)(C)C1 ZINC001507435000 1407049016 /nfs/dbraw/zinc/04/90/16/1407049016.db2.gz IIKAYPHJYWQPLP-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO CCCN1CCC[C@@H]1C(=O)N1C[C@H]([NH2+]CCCCCF)C(C)(C)C1 ZINC001507435002 1407049088 /nfs/dbraw/zinc/04/90/88/1407049088.db2.gz IIKAYPHJYWQPLP-SJORKVTESA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@](C)(C[NH2+]CCc2cccs2)C2CC2)C1 ZINC001495278823 1399788101 /nfs/dbraw/zinc/78/81/01/1399788101.db2.gz XPTKNWVKPDOQQY-HNAYVOBHSA-N 1 3 349.544 2.507 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N[C@@](C)(C[NH2+]C/C=C/Cl)C2CC2)c1 ZINC001495304860 1399816973 /nfs/dbraw/zinc/81/69/73/1399816973.db2.gz YHBPKGSHVHIBJX-GSXXRBPTSA-N 1 3 349.906 2.989 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N1CCC(CC[NH2+]CC[C@H](C)F)CC1 ZINC001495438270 1399980980 /nfs/dbraw/zinc/98/09/80/1399980980.db2.gz TYKIATAPLPKLSR-WMZOPIPTSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1ccc(C[NH2+][C@H]2CN(C(=O)CN(C)C(C)C)CC2(C)C)cc1C ZINC001507454734 1407072877 /nfs/dbraw/zinc/07/28/77/1407072877.db2.gz ZMISNBJRMHCLCZ-IBGZPJMESA-N 1 3 345.531 2.970 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@@H]1C[NH2+]CCC1CCCCCC1 ZINC001495582069 1400096682 /nfs/dbraw/zinc/09/66/82/1400096682.db2.gz OHUOXQFDTIZNRS-GOSISDBHSA-N 1 3 332.492 2.893 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCCC1)C[NH2+]CCC(F)(F)F ZINC001495666120 1400151752 /nfs/dbraw/zinc/15/17/52/1400151752.db2.gz MHARQBXWMFCNCR-ZDUSSCGKSA-N 1 3 337.430 2.545 10 0 EFAEHO CC(C)N(C)CC(=O)NCC1([NH2+]CCc2cccs2)CCCC1 ZINC001495964083 1400387091 /nfs/dbraw/zinc/38/70/91/1400387091.db2.gz XWTPMZRWSJSGPB-UHFFFAOYSA-N 1 3 337.533 2.649 10 0 EFAEHO C[C@H](C[NH2+]CC1CCC2(CC2)CC1)N(C)C(=O)CN1CC[C@H](C)C1 ZINC001496156469 1400507644 /nfs/dbraw/zinc/50/76/44/1400507644.db2.gz YZDRTYGGQIPIBD-DLBZAZTESA-N 1 3 335.536 2.735 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@H](C)N(C)C(=O)CN2CC[C@@H](C)C2)c1 ZINC001496156424 1400507795 /nfs/dbraw/zinc/50/77/95/1400507795.db2.gz YCKJUQQSDYPBAO-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(C[NH2+]C[C@@H](C)N(C)C(=O)CN2CC[C@H](C)C2)c1 ZINC001496156420 1400507901 /nfs/dbraw/zinc/50/79/01/1400507901.db2.gz YCKJUQQSDYPBAO-DLBZAZTESA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@@H](C[NH2+]Cc1ccc(C(F)F)cc1)N(C)C(=O)CN1CCCC1 ZINC001496229497 1400556228 /nfs/dbraw/zinc/55/62/28/1400556228.db2.gz ISBOGGFUJSNVQM-AWEZNQCLSA-N 1 3 339.430 2.657 10 0 EFAEHO C[C@@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1)N(C)C(=O)CN1CCCC1 ZINC001496230125 1400556598 /nfs/dbraw/zinc/55/65/98/1400556598.db2.gz QTPSPKYLILSPFG-GJZGRUSLSA-N 1 3 337.895 2.933 10 0 EFAEHO C[C@H](C[NH2+][C@H](C)c1ccc(F)c(F)c1)N(C)C(=O)CN1CCCC1 ZINC001496230165 1400556801 /nfs/dbraw/zinc/55/68/01/1400556801.db2.gz RIYJQJUOIXNVIT-ZIAGYGMSSA-N 1 3 339.430 2.558 10 0 EFAEHO CC(C)C[C@H](CNCCF)NC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC001496284327 1400598364 /nfs/dbraw/zinc/59/83/64/1400598364.db2.gz HAVODCMQUFGZFO-SJLPKXTDSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)C[C@H](CNCCF)NC(=O)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001496284327 1400598367 /nfs/dbraw/zinc/59/83/67/1400598367.db2.gz HAVODCMQUFGZFO-SJLPKXTDSA-N 1 3 341.515 2.874 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@H]([C@@H](C)[NH2+]CCc2ccccc2)C1 ZINC001496457935 1400743785 /nfs/dbraw/zinc/74/37/85/1400743785.db2.gz ASSGYOBFPHKGAZ-QUCCMNQESA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H](C)[NH2+]CCc2ccccc2)C1 ZINC001496457936 1400743824 /nfs/dbraw/zinc/74/38/24/1400743824.db2.gz ASSGYOBFPHKGAZ-UYAOXDASSA-N 1 3 345.531 2.786 10 0 EFAEHO CC(C)N(C)CC(=O)N1CCC[C@@H]([C@@H](C)[NH2+]CC2CC(F)(F)C2)C1 ZINC001496459011 1400744667 /nfs/dbraw/zinc/74/46/67/1400744667.db2.gz HBZKKFIHLRUONT-GDBMZVCRSA-N 1 3 345.478 2.589 10 0 EFAEHO CCCN(C)CC(=O)N1CCC[C@H](C)[C@H]1C[NH2+]Cc1ccsc1 ZINC001496486205 1400763244 /nfs/dbraw/zinc/76/32/44/1400763244.db2.gz IHJNXJJFHUTPIM-DOTOQJQBSA-N 1 3 337.533 2.807 10 0 EFAEHO CCCN(C)CC(=O)NC[C@H]([NH2+][C@H]1CCc2ccccc21)C(C)C ZINC001496626219 1400880514 /nfs/dbraw/zinc/88/05/14/1400880514.db2.gz FOONQJOIEDWLFR-OALUTQOASA-N 1 3 331.504 2.746 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[N@H+](C)C[C@H]2CCCC(F)(F)C2)C1 ZINC001496780885 1400979230 /nfs/dbraw/zinc/97/92/30/1400979230.db2.gz IYALEHLTTMFLCG-CVEARBPZSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)CC[N@@H+](C)C[C@H]2CCCC(F)(F)C2)C1 ZINC001496780885 1400979234 /nfs/dbraw/zinc/97/92/34/1400979234.db2.gz IYALEHLTTMFLCG-CVEARBPZSA-N 1 3 345.478 2.544 10 0 EFAEHO C[C@H]1CC[C@H](C)[NH+]1CC(=O)N(C)CCN(C)Cc1ccc(CF)cc1 ZINC001496841335 1401030975 /nfs/dbraw/zinc/03/09/75/1401030975.db2.gz FFUCAQRXQRFPRQ-IRXDYDNUSA-N 1 3 349.494 2.919 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2Cc2ccc(F)cc2)C1 ZINC001496866310 1401062166 /nfs/dbraw/zinc/06/21/66/1401062166.db2.gz GSHAGZQYHTYKIC-IEBWSBKVSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2Cc2ccc(F)cc2)C1 ZINC001496866310 1401062174 /nfs/dbraw/zinc/06/21/74/1401062174.db2.gz GSHAGZQYHTYKIC-IEBWSBKVSA-N 1 3 347.478 2.589 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H]1CCC[C@H]1C[NH2+]Cc1ccccc1F ZINC001496924365 1401104486 /nfs/dbraw/zinc/10/44/86/1401104486.db2.gz QIKGPAFEZMAVBF-WMZOPIPTSA-N 1 3 335.467 2.540 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@@H]1CC[C@H]2CCCC[N@@H+]21 ZINC001507811042 1407164512 /nfs/dbraw/zinc/16/45/12/1407164512.db2.gz YQALNGDKQNHEBH-SJORKVTESA-N 1 3 327.488 2.532 10 0 EFAEHO CC(C)N(CCN(C)CCCF)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001507811042 1407164514 /nfs/dbraw/zinc/16/45/14/1407164514.db2.gz YQALNGDKQNHEBH-SJORKVTESA-N 1 3 327.488 2.532 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1cccc(Cl)c1F)N(C)C ZINC001497268075 1401258881 /nfs/dbraw/zinc/25/88/81/1401258881.db2.gz KPJZDKIVAQUCLG-WFASDCNBSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@@H](C(=O)N[C@@H](C)CC[NH2+]Cc1ccc(Cl)cc1F)N(C)C ZINC001497308138 1401288105 /nfs/dbraw/zinc/28/81/05/1401288105.db2.gz SEKWOXUFLHMGSF-LRDDRELGSA-N 1 3 343.874 2.804 10 0 EFAEHO CC[C@H]([NH2+]C/C=C/CNC(=O)[C@H]1CCCN1C)c1ccc(F)cc1 ZINC001497550304 1401450629 /nfs/dbraw/zinc/45/06/29/1401450629.db2.gz YQUSFIUOQMUMLQ-WYIDIVSCSA-N 1 3 333.451 2.633 10 0 EFAEHO CCC[N@@H+]1CCC[C@@H]1C(=O)NC/C=C\CNCc1cc(F)ccc1C ZINC001497600097 1401485352 /nfs/dbraw/zinc/48/53/52/1401485352.db2.gz PJOWFFOBKQEISZ-PHWHVTFISA-N 1 3 347.478 2.771 10 0 EFAEHO CCC[N@H+]1CCC[C@@H]1C(=O)NC/C=C\CNCc1cc(F)ccc1C ZINC001497600097 1401485356 /nfs/dbraw/zinc/48/53/56/1401485356.db2.gz PJOWFFOBKQEISZ-PHWHVTFISA-N 1 3 347.478 2.771 10 0 EFAEHO CC(C)N(CC[N@H+](C)[C@H]1CCc2ccccc21)C(=O)CN1CCCC1 ZINC001507862244 1407187369 /nfs/dbraw/zinc/18/73/69/1407187369.db2.gz AHWOCJCFXKRDGT-FQEVSTJZSA-N 1 3 343.515 2.939 10 0 EFAEHO CC(C)N(CC[N@@H+](C)[C@H]1CCc2ccccc21)C(=O)CN1CCCC1 ZINC001507862244 1407187374 /nfs/dbraw/zinc/18/73/74/1407187374.db2.gz AHWOCJCFXKRDGT-FQEVSTJZSA-N 1 3 343.515 2.939 10 0 EFAEHO CC(C)[C@H](C(=O)NC/C=C/C[NH2+][C@@H]1CCc2c1cccc2F)N(C)C ZINC001497673307 1401539805 /nfs/dbraw/zinc/53/98/05/1401539805.db2.gz XMTQDZRCPYRNEI-ASIGSXEYSA-N 1 3 347.478 2.661 10 0 EFAEHO CC(C)N(C)CC(=O)NC/C=C\C[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC001497765670 1401636911 /nfs/dbraw/zinc/63/69/11/1401636911.db2.gz SXFODWAQGMSOIE-XDXAGZTOSA-N 1 3 349.906 2.930 10 0 EFAEHO C[C@H](C[NH2+]Cc1cc2ccccc2s1)NC(=O)C1(N(C)C)CCC1 ZINC001497826834 1401678879 /nfs/dbraw/zinc/67/88/79/1401678879.db2.gz AJDLVSVNTXDORX-CQSZACIVSA-N 1 3 345.512 2.980 10 0 EFAEHO CC/C=C/CC[NH2+]C[C@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001498117944 1401864697 /nfs/dbraw/zinc/86/46/97/1401864697.db2.gz MEDNGGMMJJTWAN-KJTGTQQJSA-N 1 3 327.488 2.650 10 0 EFAEHO CC/C=C\CC[NH2+]C[C@H](C)NC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001498117945 1401864749 /nfs/dbraw/zinc/86/47/49/1401864749.db2.gz MEDNGGMMJJTWAN-QOLZPOHTSA-N 1 3 327.488 2.650 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@@H](C)C[NH2+]Cc1cc(C)ccc1C ZINC001498196887 1401903657 /nfs/dbraw/zinc/90/36/57/1401903657.db2.gz AJLALCCMZYQJER-HKUYNNGSSA-N 1 3 331.504 2.772 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)Cc2ccc(F)cc2C)CC[N@@H+]1C ZINC001498287052 1401977259 /nfs/dbraw/zinc/97/72/59/1401977259.db2.gz DFHABMDGYTXGKN-ZYSHUDEJSA-N 1 3 349.494 2.801 10 0 EFAEHO CC[C@@H]1[C@@H](C(=O)N[C@@H](C)CN(C)Cc2ccc(F)cc2C)CC[N@H+]1C ZINC001498287052 1401977264 /nfs/dbraw/zinc/97/72/64/1401977264.db2.gz DFHABMDGYTXGKN-ZYSHUDEJSA-N 1 3 349.494 2.801 10 0 EFAEHO CC(C)C[C@@H](C)C[N@@H+](C)C[C@@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001498354908 1402033491 /nfs/dbraw/zinc/03/34/91/1402033491.db2.gz GMRMLPMMDDFYEG-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO CC(C)C[C@@H](C)C[N@H+](C)C[C@@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001498354908 1402033485 /nfs/dbraw/zinc/03/34/85/1402033485.db2.gz GMRMLPMMDDFYEG-IAGOWNOFSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H](C[N@H+](C)Cc1ccc(Cl)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001498381317 1402054672 /nfs/dbraw/zinc/05/46/72/1402054672.db2.gz OKHGRSCDEOLTOQ-LSDHHAIUSA-N 1 3 337.895 2.618 10 0 EFAEHO C[C@H](C[N@@H+](C)Cc1ccc(Cl)cc1)NC(=O)CN1CC[C@H](C)C1 ZINC001498381317 1402054675 /nfs/dbraw/zinc/05/46/75/1402054675.db2.gz OKHGRSCDEOLTOQ-LSDHHAIUSA-N 1 3 337.895 2.618 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@H+](C)Cc1ccc(F)cc1C ZINC001498455741 1402118103 /nfs/dbraw/zinc/11/81/03/1402118103.db2.gz JTWFCYRTHDKLOQ-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO CCN1CCCC[C@H]1C(=O)N[C@H](C)C[N@@H+](C)Cc1ccc(F)cc1C ZINC001498455741 1402118109 /nfs/dbraw/zinc/11/81/09/1402118109.db2.gz JTWFCYRTHDKLOQ-APWZRJJASA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(C)c([C@H](C)[NH2+]CCCN(C)C(=O)[C@H]2CCCN2C)c1 ZINC001498525419 1402160718 /nfs/dbraw/zinc/16/07/18/1402160718.db2.gz AAISFULASNKYID-PKOBYXMFSA-N 1 3 331.504 2.897 10 0 EFAEHO CN(CCC[NH2+]Cc1ccc2ccccc2c1)C(=O)[C@H]1CCCN1C ZINC001498591793 1402190493 /nfs/dbraw/zinc/19/04/93/1402190493.db2.gz IDOHESOLKHDDRM-HXUWFJFHSA-N 1 3 339.483 2.872 10 0 EFAEHO CCCN(C)CC(=O)N(C)CCC[NH2+][C@@H]1CCc2c1cccc2F ZINC001498644400 1402222243 /nfs/dbraw/zinc/22/22/43/1402222243.db2.gz YHDPCGWRSAUTIV-GOSISDBHSA-N 1 3 335.467 2.593 10 0 EFAEHO Cc1ccc(C)c([C@@H](C)[NH2+]C2(CNC(=O)CN(C)C(C)C)CC2)c1 ZINC001499459368 1402624034 /nfs/dbraw/zinc/62/40/34/1402624034.db2.gz XMODMRGUFSMPGB-QGZVFWFLSA-N 1 3 331.504 2.943 10 0 EFAEHO Cc1ccc(CC[NH2+]C2(CNC(=O)CN3[C@H](C)CC[C@H]3C)CC2)cc1 ZINC001499462112 1402625476 /nfs/dbraw/zinc/62/54/76/1402625476.db2.gz YXZXWLISNMNMNA-QZTJIDSGSA-N 1 3 343.515 2.649 10 0 EFAEHO CCc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)CC[NH+](C)C)cc1 ZINC001499511705 1402650669 /nfs/dbraw/zinc/65/06/69/1402650669.db2.gz VFDPSEAUFUIENY-UXHICEINSA-N 1 3 343.515 2.766 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@H](C)C1CC[NH+](CCC(C)(C)C)CC1 ZINC001508069478 1407280281 /nfs/dbraw/zinc/28/02/81/1407280281.db2.gz ZAYKJQNXLUCXGK-MRXNPFEDSA-N 1 3 325.541 2.980 10 0 EFAEHO C[C@H]1CCN(CC(=O)N2CCC[C@H]2C[NH2+]CCCc2ccsc2)C1 ZINC001499927142 1402857685 /nfs/dbraw/zinc/85/76/85/1402857685.db2.gz YMIUSFZDOBWOPM-WMZOPIPTSA-N 1 3 349.544 2.603 10 0 EFAEHO CC[C@@H](C(=O)N1CCC[C@H]1C[NH2+]CCCc1cccc(F)c1)N(C)C ZINC001499926095 1402857742 /nfs/dbraw/zinc/85/77/42/1402857742.db2.gz FORBJUXXJNBBJQ-OALUTQOASA-N 1 3 349.494 2.679 10 0 EFAEHO CC[C@H](C(=O)N1CCC[C@H]1C[NH2+]CCCc1ccc(C)cc1)N(C)C ZINC001499943543 1402864190 /nfs/dbraw/zinc/86/41/90/1402864190.db2.gz DXCHNQFOVCQCCT-VQTJNVASSA-N 1 3 345.531 2.848 10 0 EFAEHO CCC(CC)C[NH+]1CCC([C@H](C)NC(=O)CN2CC[C@H](C)C2)CC1 ZINC001508082590 1407288320 /nfs/dbraw/zinc/28/83/20/1407288320.db2.gz WLCAJEYECAKRDU-IRXDYDNUSA-N 1 3 337.552 2.981 10 0 EFAEHO CC[C@H](C)C[NH2+]C[C@@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 ZINC001500378950 1403085585 /nfs/dbraw/zinc/08/55/85/1403085585.db2.gz ZTTAAIISYOXKGI-QFBILLFUSA-N 1 3 325.541 2.839 10 0 EFAEHO C[C@]1(C[NH2+]CCCC2CCCC2)CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001500380681 1403086417 /nfs/dbraw/zinc/08/64/17/1403086417.db2.gz XCFQFXCYUFJEGS-LJQANCHMSA-N 1 3 332.492 2.751 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@@](C)(C[NH2+]CC2CCC(C)CC2)C1 ZINC001500396603 1403095434 /nfs/dbraw/zinc/09/54/34/1403095434.db2.gz FEXQROJXKSZIQM-QLOJAFMTSA-N 1 3 337.552 2.983 10 0 EFAEHO CCCN(C)CC(=O)NC[C@]1(C)CCC[N@H+](Cc2ccsc2)C1 ZINC001500546862 1403212144 /nfs/dbraw/zinc/21/21/44/1403212144.db2.gz JGQYBSSCJZVANI-SFHVURJKSA-N 1 3 337.533 2.808 10 0 EFAEHO CCCN(C)CC(=O)NC[C@]1(C)CCC[N@@H+](Cc2ccsc2)C1 ZINC001500546862 1403212150 /nfs/dbraw/zinc/21/21/50/1403212150.db2.gz JGQYBSSCJZVANI-SFHVURJKSA-N 1 3 337.533 2.808 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@]1(C)CCC[N@H+](CCc2ccccc2)C1 ZINC001500553355 1403218774 /nfs/dbraw/zinc/21/87/74/1403218774.db2.gz WPSNZIAMJJUUDM-NRFANRHFSA-N 1 3 345.531 2.788 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@]1(C)CCC[N@@H+](CCc2ccccc2)C1 ZINC001500553355 1403218777 /nfs/dbraw/zinc/21/87/77/1403218777.db2.gz WPSNZIAMJJUUDM-NRFANRHFSA-N 1 3 345.531 2.788 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001500613678 1403247792 /nfs/dbraw/zinc/24/77/92/1403247792.db2.gz MLYJAHSUBYSPFA-YVDRWBGASA-N 1 3 345.478 2.756 10 0 EFAEHO CC/C=C\CC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)[C@@H](CC)N(C)C)C1 ZINC001500613678 1403247794 /nfs/dbraw/zinc/24/77/94/1403247794.db2.gz MLYJAHSUBYSPFA-YVDRWBGASA-N 1 3 345.478 2.756 10 0 EFAEHO CC[C@@H](C(=O)NC1(C2CC[NH+](Cc3ccsc3)CC2)CC1)N(C)C ZINC001508163594 1407323586 /nfs/dbraw/zinc/32/35/86/1407323586.db2.gz XBFSZQRDBHVYEH-KRWDZBQOSA-N 1 3 349.544 2.949 10 0 EFAEHO CN(CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](C/C=C/Cl)C2)CC(C)(C)C ZINC001501010473 1403402952 /nfs/dbraw/zinc/40/29/52/1403402952.db2.gz HTWWCVVOEYFYOL-COSBLLOGSA-N 1 3 341.927 2.686 10 0 EFAEHO CN(CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](C/C=C/Cl)C2)CC(C)(C)C ZINC001501010473 1403402954 /nfs/dbraw/zinc/40/29/54/1403402954.db2.gz HTWWCVVOEYFYOL-COSBLLOGSA-N 1 3 341.927 2.686 10 0 EFAEHO Cc1cccc(C[NH2+][C@@H](C)[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001501091121 1403436850 /nfs/dbraw/zinc/43/68/50/1403436850.db2.gz LDZZJSKIHZYGJP-PKOBYXMFSA-N 1 3 331.504 2.662 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]Cc2cccc(CC)c2)C1 ZINC001501150737 1403461058 /nfs/dbraw/zinc/46/10/58/1403461058.db2.gz XQYHDFSVVZRJML-XLIONFOSSA-N 1 3 345.531 2.775 10 0 EFAEHO CN1CCC[C@@H]1C(=O)N1CC[C@@H](CC[NH2+]Cc2ccc(CF)cc2)C1 ZINC001501604705 1403643816 /nfs/dbraw/zinc/64/38/16/1403643816.db2.gz XASFXGJDOGOISI-RTBURBONSA-N 1 3 347.478 2.579 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](CC[NH2+]CC2CC3(CCC3)C2)C1)N(C)C ZINC001501637499 1403659645 /nfs/dbraw/zinc/65/96/45/1403659645.db2.gz KIOTZLPHODBCJB-WMZOPIPTSA-N 1 3 335.536 2.735 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@H](CC[NH2+]Cc2cc(C)cc(C)c2)C1)N(C)C ZINC001501638439 1403660316 /nfs/dbraw/zinc/66/03/16/1403660316.db2.gz WJKXDDWPYVNCJA-ICSRJNTNSA-N 1 3 345.531 2.972 10 0 EFAEHO C[C@H]([NH2+]CC[C@H]1CCN(C(=O)CN2CCCC2)C1)c1ccccc1 ZINC001501647089 1403665013 /nfs/dbraw/zinc/66/50/13/1403665013.db2.gz BMKFAKVPKQBWFE-ROUUACIJSA-N 1 3 329.488 2.672 10 0 EFAEHO O=C(CN1CCCC1)N1CC[C@H](CC[NH2+]CCCC2CCCC2)C1 ZINC001501648257 1403665686 /nfs/dbraw/zinc/66/56/86/1403665686.db2.gz WQPFGYAJLDVMFJ-IBGZPJMESA-N 1 3 335.536 2.881 10 0 EFAEHO CC(C)C[N@@H+]1CCc2c(CNC(=O)CN3CC[C@H](C)C3)cccc2C1 ZINC001501854583 1403828748 /nfs/dbraw/zinc/82/87/48/1403828748.db2.gz XKHFPLUPMRRUGR-KRWDZBQOSA-N 1 3 343.515 2.659 10 0 EFAEHO CC(C)C[N@H+]1CCc2c(CNC(=O)CN3CC[C@H](C)C3)cccc2C1 ZINC001501854583 1403828757 /nfs/dbraw/zinc/82/87/57/1403828757.db2.gz XKHFPLUPMRRUGR-KRWDZBQOSA-N 1 3 343.515 2.659 10 0 EFAEHO CC(C)=CC[N@H+]1CCc2c(CNC(=O)CN(C)C(C)C)cccc2C1 ZINC001501856872 1403832883 /nfs/dbraw/zinc/83/28/83/1403832883.db2.gz LTFLXOSOZCHRRT-UHFFFAOYSA-N 1 3 343.515 2.967 10 0 EFAEHO CC(C)=CC[N@@H+]1CCc2c(CNC(=O)CN(C)C(C)C)cccc2C1 ZINC001501856872 1403832889 /nfs/dbraw/zinc/83/28/89/1403832889.db2.gz LTFLXOSOZCHRRT-UHFFFAOYSA-N 1 3 343.515 2.967 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)[C@H]2CCC[N@@H+]2C2CCCC2)CCC1 ZINC001501961441 1403907592 /nfs/dbraw/zinc/90/75/92/1403907592.db2.gz AEYVVGIULCYJPV-DOTOQJQBSA-N 1 3 339.499 2.770 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)[C@H]2CCC[N@H+]2C2CCCC2)CCC1 ZINC001501961441 1403907600 /nfs/dbraw/zinc/90/76/00/1403907600.db2.gz AEYVVGIULCYJPV-DOTOQJQBSA-N 1 3 339.499 2.770 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)[C@@H]2CCC[N@@H+]2C2CCCC2)CCC1 ZINC001501961443 1403907744 /nfs/dbraw/zinc/90/77/44/1403907744.db2.gz AEYVVGIULCYJPV-RDJZCZTQSA-N 1 3 339.499 2.770 10 0 EFAEHO CC[C@H](F)CNC1(CNC(=O)[C@@H]2CCC[N@H+]2C2CCCC2)CCC1 ZINC001501961443 1403907751 /nfs/dbraw/zinc/90/77/51/1403907751.db2.gz AEYVVGIULCYJPV-RDJZCZTQSA-N 1 3 339.499 2.770 10 0 EFAEHO CC[C@@H](F)CNC1(CNC(=O)[C@H](C(C)C)[NH+]2CCCCC2)CCC1 ZINC001502028886 1403959008 /nfs/dbraw/zinc/95/90/08/1403959008.db2.gz DNRUIAAFEVSHLD-SJORKVTESA-N 1 3 341.515 2.874 10 0 EFAEHO C[NH+](C)CCC(=O)N[C@H]1CCCN(Cc2ccccc2Cl)CC1 ZINC001502135831 1404034685 /nfs/dbraw/zinc/03/46/85/1404034685.db2.gz SAJGRWOMMQWQSK-INIZCTEOSA-N 1 3 337.895 2.762 10 0 EFAEHO CN(CCCN(C)C(=O)CC[NH+](C)C)Cc1ccc(Cl)s1 ZINC001502371430 1404112459 /nfs/dbraw/zinc/11/24/59/1404112459.db2.gz KPFKVCOQAVHTGI-UHFFFAOYSA-N 1 3 331.913 2.634 10 0 EFAEHO CCCCC(=O)N1C[C@H]2CC[C@@H](C1)N2C1CC[NH+](CC2CC2)CC1 ZINC001502404672 1404146685 /nfs/dbraw/zinc/14/66/85/1404146685.db2.gz LFJHOBYXTURGDL-KDURUIRLSA-N 1 3 333.520 2.726 10 0 EFAEHO CCC1([NH2+]CC[C@@H](C)F)CCN(C(=O)CN2CCC(C)CC2)CC1 ZINC001502510692 1404210246 /nfs/dbraw/zinc/21/02/46/1404210246.db2.gz ATGSJLWYNLHHQE-QGZVFWFLSA-N 1 3 341.515 2.827 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)[C@H](CC)N(C)C)C2 ZINC001502545961 1404235924 /nfs/dbraw/zinc/23/59/24/1404235924.db2.gz LGHBMXFGBPRHML-QWCIBIBSSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@]2(C1)CCCN(C(=O)[C@H](CC)N(C)C)C2 ZINC001502545961 1404235929 /nfs/dbraw/zinc/23/59/29/1404235929.db2.gz LGHBMXFGBPRHML-QWCIBIBSSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)=CC[NH2+][C@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@@H]1C ZINC001502759535 1404328587 /nfs/dbraw/zinc/32/85/87/1404328587.db2.gz IIIYQZAVHKDRQT-LPHOPBHVSA-N 1 3 329.488 2.765 10 0 EFAEHO C[NH+](C)CCCC(=O)N1CCC(C)(NC/C(Cl)=C/Cl)CC1 ZINC001502795504 1404349103 /nfs/dbraw/zinc/34/91/03/1404349103.db2.gz NYDAYCDHCVOQOE-QBFSEMIESA-N 1 3 336.307 2.618 10 0 EFAEHO CC[N@H+](C)[C@H](C(=O)N[C@H]1CCN(CCF)CC1(C)C)c1ccccc1 ZINC001502835859 1404392628 /nfs/dbraw/zinc/39/26/28/1404392628.db2.gz CQFVQRNMAYOXLB-ROUUACIJSA-N 1 3 349.494 2.866 10 0 EFAEHO CC[N@@H+](C)[C@H](C(=O)N[C@H]1CCN(CCF)CC1(C)C)c1ccccc1 ZINC001502835859 1404392634 /nfs/dbraw/zinc/39/26/34/1404392634.db2.gz CQFVQRNMAYOXLB-ROUUACIJSA-N 1 3 349.494 2.866 10 0 EFAEHO CC[N@H+](CC=C(C)C)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001505399703 1404554359 /nfs/dbraw/zinc/55/43/59/1404554359.db2.gz WVILZCSNFXABNC-GOSISDBHSA-N 1 3 335.536 2.855 10 0 EFAEHO CC[N@@H+](CC=C(C)C)CC1CCN(C(=O)CN2CC[C@@H](C)C2)CC1 ZINC001505399703 1404554369 /nfs/dbraw/zinc/55/43/69/1404554369.db2.gz WVILZCSNFXABNC-GOSISDBHSA-N 1 3 335.536 2.855 10 0 EFAEHO CC(C)[C@H](C(=O)N[C@H](CNCCF)C(C)(C)C)[NH+]1CCCCC1 ZINC001725755733 1425822149 /nfs/dbraw/zinc/82/21/49/1425822149.db2.gz GOJJEFSPQPGOPA-HZPDHXFCSA-N 1 3 329.504 2.587 10 0 EFAEHO Cc1cc(C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C2CCC2)c(C)s1 ZINC001505624823 1404866412 /nfs/dbraw/zinc/86/64/12/1404866412.db2.gz BHGHBIHEWMTYNT-ZIAGYGMSSA-N 1 3 337.533 2.832 10 0 EFAEHO Cc1cccc(C)c1C[NH2+][C@H](C)[C@@H](C)NC(=O)CN(C)C1CCC1 ZINC001505625521 1404868272 /nfs/dbraw/zinc/86/82/72/1404868272.db2.gz KULCIDKWVLFWGD-IAGOWNOFSA-N 1 3 331.504 2.771 10 0 EFAEHO C[C@@H](NC(=O)CN(C)C1CCC1)[C@H](C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001505626095 1404869899 /nfs/dbraw/zinc/86/98/99/1404869899.db2.gz QVRVNZBMCLNAEB-LSDHHAIUSA-N 1 3 342.487 2.635 10 0 EFAEHO Cc1cc(F)ccc1C[NH2+][C@@H](C)[C@H](C)NC(=O)C(C)(C)N1CCCC1 ZINC001505668368 1404916602 /nfs/dbraw/zinc/91/66/02/1404916602.db2.gz XJQCLJMMROXKQA-HOTGVXAUSA-N 1 3 349.494 2.991 10 0 EFAEHO COc1ccc(C[NH2+][C@@H](C)[C@H](C)NC(=O)CN(C)CC(C)(C)C)cc1 ZINC001505694240 1404947777 /nfs/dbraw/zinc/94/77/77/1404947777.db2.gz LSNIHPDAZGFZIF-HOTGVXAUSA-N 1 3 349.519 2.656 10 0 EFAEHO CCc1ccccc1CC[NH2+][C@H](C)[C@H](C)NC(=O)Cc1nc[nH]c1C ZINC001505738510 1405006946 /nfs/dbraw/zinc/00/69/46/1405006946.db2.gz LIPDFHZYPRNYBT-CABCVRRESA-N 1 3 342.487 2.549 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H](C)[C@H](C)[NH2+]Cc1ccc(C(F)F)cc1 ZINC001505761786 1405036672 /nfs/dbraw/zinc/03/66/72/1405036672.db2.gz VUQATEBQJKJTJT-KBPBESRZSA-N 1 3 341.446 2.947 10 0 EFAEHO Cc1ccc(CN(C)[C@@H](C)CNC(=O)CC[C@H]2CCC[N@@H+]2C)cc1F ZINC001505937852 1405249094 /nfs/dbraw/zinc/24/90/94/1405249094.db2.gz NFUNIICORCHPMD-FUHWJXTLSA-N 1 3 349.494 2.945 10 0 EFAEHO Cc1ccc(CN(C)[C@@H](C)CNC(=O)CC[C@H]2CCC[N@H+]2C)cc1F ZINC001505937852 1405249102 /nfs/dbraw/zinc/24/91/02/1405249102.db2.gz NFUNIICORCHPMD-FUHWJXTLSA-N 1 3 349.494 2.945 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[N@H+](C)CC1CC2(CCC2)C1 ZINC001505975866 1405296567 /nfs/dbraw/zinc/29/65/67/1405296567.db2.gz AEUSLLCOZBAXSU-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO C[C@H](CNC(=O)C(C)(C)N1CCCC1)[N@@H+](C)CC1CC2(CCC2)C1 ZINC001505975866 1405296573 /nfs/dbraw/zinc/29/65/73/1405296573.db2.gz AEUSLLCOZBAXSU-MRXNPFEDSA-N 1 3 335.536 2.878 10 0 EFAEHO CCc1cccc(C[N@H+](C)[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001506001704 1405330567 /nfs/dbraw/zinc/33/05/67/1405330567.db2.gz GYZXTNWZMNFVFS-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO CCc1cccc(C[N@@H+](C)[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)c1 ZINC001506001704 1405330576 /nfs/dbraw/zinc/33/05/76/1405330576.db2.gz GYZXTNWZMNFVFS-SJORKVTESA-N 1 3 331.504 2.527 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[N@H+](C)CC1CCC2(CC2)CC1 ZINC001506002623 1405332482 /nfs/dbraw/zinc/33/24/82/1405332482.db2.gz ZWCNPEPQXVXKTP-DLBZAZTESA-N 1 3 335.536 2.735 10 0 EFAEHO C[C@H](CNC(=O)CN1CC[C@H](C)C1)[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001506002623 1405332488 /nfs/dbraw/zinc/33/24/88/1405332488.db2.gz ZWCNPEPQXVXKTP-DLBZAZTESA-N 1 3 335.536 2.735 10 0 EFAEHO CCC[N@@H+]1CCCCC[C@H]1CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001506574158 1405989441 /nfs/dbraw/zinc/98/94/41/1405989441.db2.gz DQDDMIXCWKVYNW-LPHOPBHVSA-N 1 3 341.515 2.970 10 0 EFAEHO CCC[N@H+]1CCCCC[C@H]1CNC(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001506574158 1405989445 /nfs/dbraw/zinc/98/94/45/1405989445.db2.gz DQDDMIXCWKVYNW-LPHOPBHVSA-N 1 3 341.515 2.970 10 0 EFAEHO C[C@H](NC(=O)C(C)(C)N1CCCC1)C1C[NH+](CC2CC(C)(C)C2)C1 ZINC001506644774 1406090822 /nfs/dbraw/zinc/09/08/22/1406090822.db2.gz ZLACMJQIOVVEQC-HNNXBMFYSA-N 1 3 335.536 2.734 10 0 EFAEHO CC(C)CC[NH+]1CC([C@H](C)NC(=O)[C@]2(F)CCN(C(C)(C)C)C2)C1 ZINC001506657433 1406110487 /nfs/dbraw/zinc/11/04/87/1406110487.db2.gz XMMHYQBMCRFBBP-KXBFYZLASA-N 1 3 341.515 2.682 10 0 EFAEHO CC[C@@H](c1ccccc1)[NH+]1CC([C@H](C)NC(=O)CN(C)C(C)C)C1 ZINC001506678509 1406139225 /nfs/dbraw/zinc/13/92/25/1406139225.db2.gz JEENCNXPSILVBO-LPHOPBHVSA-N 1 3 331.504 2.914 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CN(Cc2ccccc2)CC1(C)C ZINC001506742314 1406233414 /nfs/dbraw/zinc/23/34/14/1406233414.db2.gz QKYGJEGGQLSUKC-MOPGFXCFSA-N 1 3 343.515 2.888 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)N[C@H]1CN(Cc2ccccc2)CC1(C)C ZINC001506742314 1406233423 /nfs/dbraw/zinc/23/34/23/1406233423.db2.gz QKYGJEGGQLSUKC-MOPGFXCFSA-N 1 3 343.515 2.888 10 0 EFAEHO CC(=O)Oc1ccc(C[N@H+]2C[C@@]34CN(C)C[C@]3(C2)CCCC4)cc1 ZINC001560238549 1415269659 /nfs/dbraw/zinc/26/96/59/1415269659.db2.gz RCRCHWYEGGFDNW-BGYRXZFFSA-N 1 3 328.456 2.920 10 0 EFAEHO CC(=O)Oc1ccc(C[N@@H+]2C[C@@]34CN(C)C[C@]3(C2)CCCC4)cc1 ZINC001560238549 1415269664 /nfs/dbraw/zinc/26/96/64/1415269664.db2.gz RCRCHWYEGGFDNW-BGYRXZFFSA-N 1 3 328.456 2.920 10 0 EFAEHO CC/C=C/CC[N@@H+]1CC[C@@H]2CN(C(=O)[C@@H]3CCCCN3CC)C[C@@H]2C1 ZINC001566055288 1415494442 /nfs/dbraw/zinc/49/44/42/1415494442.db2.gz RHZOODSXFGDCAC-UOUNDWCUSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C/CC[N@H+]1CC[C@@H]2CN(C(=O)[C@@H]3CCCCN3CC)C[C@@H]2C1 ZINC001566055288 1415494444 /nfs/dbraw/zinc/49/44/44/1415494444.db2.gz RHZOODSXFGDCAC-UOUNDWCUSA-N 1 3 347.547 2.997 10 0 EFAEHO CC/C=C\CC[N@H+](C)C[C@@H]1CCCCN1C(=O)CN1CC[C@H](C)C1 ZINC001566124495 1415523376 /nfs/dbraw/zinc/52/33/76/1415523376.db2.gz VQDZKIOEOMIUQR-DSQZMVHQSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C\CC[N@@H+](C)C[C@@H]1CCCCN1C(=O)CN1CC[C@H](C)C1 ZINC001566124495 1415523377 /nfs/dbraw/zinc/52/33/77/1415523377.db2.gz VQDZKIOEOMIUQR-DSQZMVHQSA-N 1 3 335.536 2.997 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[N@H+](C)Cc1ccc(F)c(Cl)c1 ZINC001566439869 1415546891 /nfs/dbraw/zinc/54/68/91/1415546891.db2.gz RKQXYKNPHGYWSW-MRXNPFEDSA-N 1 3 341.858 2.511 10 0 EFAEHO CN1CCC[C@@H]1C(=O)NCCC[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC001566439869 1415546895 /nfs/dbraw/zinc/54/68/95/1415546895.db2.gz RKQXYKNPHGYWSW-MRXNPFEDSA-N 1 3 341.858 2.511 10 0 EFAEHO CC(C)Oc1ccccc1C[N@H+](C)CCCNC(=O)[C@H]1CCCN1C ZINC001566481619 1415574767 /nfs/dbraw/zinc/57/47/67/1415574767.db2.gz JLFMPXKHKWVWSV-GOSISDBHSA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)Oc1ccccc1C[N@@H+](C)CCCNC(=O)[C@H]1CCCN1C ZINC001566481619 1415574768 /nfs/dbraw/zinc/57/47/68/1415574768.db2.gz JLFMPXKHKWVWSV-GOSISDBHSA-N 1 3 347.503 2.506 10 0 EFAEHO CCCN(C)CC(=O)NCCC[N@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC001566510643 1415599895 /nfs/dbraw/zinc/59/98/95/1415599895.db2.gz LJVKTMSCAHYIOU-SFHVURJKSA-N 1 3 335.467 2.593 10 0 EFAEHO CCCN(C)CC(=O)NCCC[N@@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC001566510643 1415599901 /nfs/dbraw/zinc/59/99/01/1415599901.db2.gz LJVKTMSCAHYIOU-SFHVURJKSA-N 1 3 335.467 2.593 10 0 EFAEHO CCN(C/C=C/Cl)CCCNC(=O)C(C)(C)[NH+]1CCCCC1 ZINC001566550429 1415634296 /nfs/dbraw/zinc/63/42/96/1415634296.db2.gz HXOWRWJLMPLTSM-CSKARUKUSA-N 1 3 329.916 2.832 10 0 EFAEHO CC/C=C\CC[NH+]1CCC2(C[C@H]2NC(=O)C2(N(C)C)CCC2)CC1 ZINC001566689540 1415732527 /nfs/dbraw/zinc/73/25/27/1415732527.db2.gz PHDCPODZGIDACT-KEGWNNHHSA-N 1 3 333.520 2.798 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H]1C[C@@H]([NH2+]CCCc2ccsc2)C1 ZINC001566862505 1415803612 /nfs/dbraw/zinc/80/36/12/1415803612.db2.gz CTUKMSIHYWCNNF-FGTMMUONSA-N 1 3 349.544 2.792 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@H+](CC2=CCCCC2)C1)N(C)C ZINC001566879523 1415821194 /nfs/dbraw/zinc/82/11/94/1415821194.db2.gz OEQCFSIROLGUGS-RTBURBONSA-N 1 3 335.536 2.901 10 0 EFAEHO CC(C)[C@H](C(=O)NC[C@H]1CCC[N@@H+](CC2=CCCCC2)C1)N(C)C ZINC001566879523 1415821198 /nfs/dbraw/zinc/82/11/98/1415821198.db2.gz OEQCFSIROLGUGS-RTBURBONSA-N 1 3 335.536 2.901 10 0 EFAEHO CN1CCC[C@H]1C(=O)N1CC[C@H](C[NH2+]CCC2CCCCCC2)C1 ZINC001567117318 1415938695 /nfs/dbraw/zinc/93/86/95/1415938695.db2.gz YJAZSQWGSLBNSU-MOPGFXCFSA-N 1 3 335.536 2.879 10 0 EFAEHO CN(CC(=O)N1CC[C@H](C[NH2+]CCCCC(F)(F)F)C1)C1CCC1 ZINC001567128573 1415943637 /nfs/dbraw/zinc/94/36/37/1415943637.db2.gz POJARRDJYFKYQP-CQSZACIVSA-N 1 3 349.441 2.641 10 0 EFAEHO CC[C@@H](C(=O)N1CC[C@@H](C[NH2+]CCCc2ccccc2C)C1)N(C)C ZINC001567139809 1415949111 /nfs/dbraw/zinc/94/91/11/1415949111.db2.gz FCNDWTOBFFPFMA-ICSRJNTNSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1Cc1cncc(C)c1)N(C)C ZINC001567265312 1416042296 /nfs/dbraw/zinc/04/22/96/1416042296.db2.gz VCUSLZNLENGXDD-RTBURBONSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@@H]1CCC[N@H+]1Cc1cncc(C)c1)N(C)C ZINC001567265312 1416042300 /nfs/dbraw/zinc/04/23/00/1416042300.db2.gz VCUSLZNLENGXDD-RTBURBONSA-N 1 3 346.519 2.591 10 0 EFAEHO CC[N@@H+]1CCCC[C@H]1C(=O)N(C)CCNCc1cc(C)ccc1F ZINC001567611378 1416209130 /nfs/dbraw/zinc/20/91/30/1416209130.db2.gz FACCGVVDWIRRPS-SFHVURJKSA-N 1 3 335.467 2.557 10 0 EFAEHO CC[N@H+]1CCCC[C@H]1C(=O)N(C)CCNCc1cc(C)ccc1F ZINC001567611378 1416209132 /nfs/dbraw/zinc/20/91/32/1416209132.db2.gz FACCGVVDWIRRPS-SFHVURJKSA-N 1 3 335.467 2.557 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N(C)CC[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC001567611851 1416209789 /nfs/dbraw/zinc/20/97/89/1416209789.db2.gz XDKGRRGYCQSXDW-HZPDHXFCSA-N 1 3 345.478 2.734 10 0 EFAEHO CCc1ccc(C[NH2+]CCN(C)C(=O)[C@H]2CCCCN2CC)cc1 ZINC001567611467 1416209831 /nfs/dbraw/zinc/20/98/31/1416209831.db2.gz IAIZNFNXGOVHLD-LJQANCHMSA-N 1 3 331.504 2.671 10 0 EFAEHO CCc1ccccc1CC[NH2+]CCN(C)C(=O)[C@@H]1CCCCN1CC ZINC001567611769 1416209843 /nfs/dbraw/zinc/20/98/43/1416209843.db2.gz UMXYLAHTKSLAIG-FQEVSTJZSA-N 1 3 345.531 2.714 10 0 EFAEHO CCc1ccccc1CC[NH2+]CCN(C)C(=O)[C@H]1CCCCN1CC ZINC001567611770 1416210128 /nfs/dbraw/zinc/21/01/28/1416210128.db2.gz UMXYLAHTKSLAIG-HXUWFJFHSA-N 1 3 345.531 2.714 10 0 EFAEHO C[C@H]([NH2+]CCCC1CCC1)C1CCN(C(=O)CN2CCCC2)CC1 ZINC001567633503 1416218655 /nfs/dbraw/zinc/21/86/55/1416218655.db2.gz CKCVKKASIRAAHH-KRWDZBQOSA-N 1 3 335.536 2.879 10 0 EFAEHO CCC[N@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001567648837 1416228432 /nfs/dbraw/zinc/22/84/32/1416228432.db2.gz JJCUZBMGKQFOFJ-GOSISDBHSA-N 1 3 329.504 2.826 10 0 EFAEHO CCC[N@@H+](CCCNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C(C)C ZINC001567648837 1416228435 /nfs/dbraw/zinc/22/84/35/1416228435.db2.gz JJCUZBMGKQFOFJ-GOSISDBHSA-N 1 3 329.504 2.826 10 0 EFAEHO CC(C)=CCN[C@@H](CNC(=O)C1(C[NH+](C)C)CC1)c1ccccc1 ZINC001567662471 1416236518 /nfs/dbraw/zinc/23/65/18/1416236518.db2.gz HKMDFFDFEDTXQD-SFHVURJKSA-N 1 3 329.488 2.742 10 0 EFAEHO CCC/C=C/CC[N@H+](C)CC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001567744524 1416268623 /nfs/dbraw/zinc/26/86/23/1416268623.db2.gz LPZPLOOFLKLGGE-OVKVCFKUSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[N@@H+](C)CC1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC001567744524 1416268626 /nfs/dbraw/zinc/26/86/26/1416268626.db2.gz LPZPLOOFLKLGGE-OVKVCFKUSA-N 1 3 335.536 2.997 10 0 EFAEHO CC(C)N1CCC[C@H]1C(=O)NC1(C[NH2+]CCC(F)(F)F)CCCC1 ZINC001567998451 1416354636 /nfs/dbraw/zinc/35/46/36/1416354636.db2.gz MLXNYLWUSNTZHH-AWEZNQCLSA-N 1 3 349.441 2.830 10 0 EFAEHO CN(CC(=O)NC1(C[NH2+]C/C=C\Cl)CCCC1)CC(C)(C)C ZINC001568005270 1416357425 /nfs/dbraw/zinc/35/74/25/1416357425.db2.gz CRGRNKNHYXGHRU-YFHOEESVSA-N 1 3 329.916 2.735 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N2CCC[C@@H](CC[NH2+]CCC(C)(C)C)C2)C1 ZINC001568068234 1416392138 /nfs/dbraw/zinc/39/21/38/1416392138.db2.gz SGETYMBBTFXIQW-MSOLQXFVSA-N 1 3 337.552 2.983 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CCC[C@H](CC[NH2+]CC2=CCCCC2)C1 ZINC001568068871 1416392426 /nfs/dbraw/zinc/39/24/26/1416392426.db2.gz HJEPHQZJHQCMJW-QGZVFWFLSA-N 1 3 330.476 2.671 10 0 EFAEHO CC[C@@H](F)C[NH2+]CCC1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC1 ZINC001568092780 1416406641 /nfs/dbraw/zinc/40/66/41/1416406641.db2.gz ZPXBXDQYWLVADC-IAGOWNOFSA-N 1 3 329.504 2.539 10 0 EFAEHO CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](CNCCF)C1CCCCC1 ZINC001568343999 1416484645 /nfs/dbraw/zinc/48/46/45/1416484645.db2.gz UVSPKOKOONWBAE-ZWKOTPCHSA-N 1 3 341.515 2.731 10 0 EFAEHO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N[C@@H](CNCCF)C1CCCCC1 ZINC001568343999 1416484647 /nfs/dbraw/zinc/48/46/47/1416484647.db2.gz UVSPKOKOONWBAE-ZWKOTPCHSA-N 1 3 341.515 2.731 10 0 EFAEHO Cc1ccccc1C[NH2+]CC[C@H]1CCCCN1C(=O)[C@@H]1CCCN1C ZINC001568379784 1416502132 /nfs/dbraw/zinc/50/21/32/1416502132.db2.gz WXVMBODAIQZSGE-UXHICEINSA-N 1 3 343.515 2.950 10 0 EFAEHO CC(C)[C@H](CNC(=O)CN1CC[C@@H](C)C1)[NH2+]CCCC(C)(C)C ZINC001568461788 1416539324 /nfs/dbraw/zinc/53/93/24/1416539324.db2.gz DLKYYRGABODPFU-SJORKVTESA-N 1 3 325.541 2.885 10 0 EFAEHO CC(C)Oc1cccc(C[N@H+](C)CCCNC(=O)[C@@H]2CCCN2C)c1 ZINC001689793141 1417065678 /nfs/dbraw/zinc/06/56/78/1417065678.db2.gz BKYXLBCNVNSIIG-IBGZPJMESA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)Oc1cccc(C[N@@H+](C)CCCNC(=O)[C@@H]2CCCN2C)c1 ZINC001689793141 1417065683 /nfs/dbraw/zinc/06/56/83/1417065683.db2.gz BKYXLBCNVNSIIG-IBGZPJMESA-N 1 3 347.503 2.506 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@H+](C)Cc1ccc(Cl)cc1)N(C)C ZINC001689808718 1417073137 /nfs/dbraw/zinc/07/31/37/1417073137.db2.gz SPDFTEVBQDYOGG-KRWDZBQOSA-N 1 3 339.911 2.864 10 0 EFAEHO CC(C)[C@@H](C(=O)NCCC[N@@H+](C)Cc1ccc(Cl)cc1)N(C)C ZINC001689808718 1417073140 /nfs/dbraw/zinc/07/31/40/1417073140.db2.gz SPDFTEVBQDYOGG-KRWDZBQOSA-N 1 3 339.911 2.864 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@H+](C)Cc1ccc(Cl)cc1 ZINC001689890821 1417089080 /nfs/dbraw/zinc/08/90/80/1417089080.db2.gz HENBGFCIBWSYBS-UHFFFAOYSA-N 1 3 325.884 2.618 10 0 EFAEHO CC(C)N(C)CC(=O)NCCC[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001689890821 1417089085 /nfs/dbraw/zinc/08/90/85/1417089085.db2.gz HENBGFCIBWSYBS-UHFFFAOYSA-N 1 3 325.884 2.618 10 0 EFAEHO CCc1cccc(CN2CC[C@H](NC(=O)CCCC[NH+](C)C)C2)c1 ZINC001690108724 1417155327 /nfs/dbraw/zinc/15/53/27/1417155327.db2.gz NRIQJUZBGSUIRW-IBGZPJMESA-N 1 3 331.504 2.671 10 0 EFAEHO CC(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCCC[NH+]1CCCC1 ZINC001690216479 1417176199 /nfs/dbraw/zinc/17/61/99/1417176199.db2.gz RLPGKSLZUXOYBG-KDURUIRLSA-N 1 3 335.536 2.974 10 0 EFAEHO CCCN(C)CC(=O)N1CC[C@H]([NH2+]CC/C=C\c2ccccc2)C1 ZINC001690255495 1417179596 /nfs/dbraw/zinc/17/95/96/1417179596.db2.gz PLVZFNFOUQVLJQ-ABMFHFBKSA-N 1 3 329.488 2.622 10 0 EFAEHO O=C([C@H]1CCCC[N@@H+]1C1CCCC1)N1CCCC[C@H]1CNCCF ZINC001690477706 1417216144 /nfs/dbraw/zinc/21/61/44/1417216144.db2.gz SALJEVXGKUFWPT-ZWKOTPCHSA-N 1 3 339.499 2.724 10 0 EFAEHO O=C([C@H]1CCCC[N@H+]1C1CCCC1)N1CCCC[C@H]1CNCCF ZINC001690477706 1417216148 /nfs/dbraw/zinc/21/61/48/1417216148.db2.gz SALJEVXGKUFWPT-ZWKOTPCHSA-N 1 3 339.499 2.724 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H]1CCC[N@H+](CCCCCF)C1 ZINC001690498360 1417218653 /nfs/dbraw/zinc/21/86/53/1417218653.db2.gz HDGYSHAFZUFEEJ-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO C[C@@H](NC(=O)C1(N(C)C)CCC1)[C@@H]1CCC[N@@H+](CCCCCF)C1 ZINC001690498360 1417218657 /nfs/dbraw/zinc/21/86/57/1417218657.db2.gz HDGYSHAFZUFEEJ-IAGOWNOFSA-N 1 3 341.515 2.827 10 0 EFAEHO Cc1cccc(CCC[NH2+]C[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001690758049 1417239327 /nfs/dbraw/zinc/23/93/27/1417239327.db2.gz UGRHQFLOBJGZOM-FQEVSTJZSA-N 1 3 345.531 2.706 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@@H]1CCC[N@@H+]1Cc1ccsc1)N(C)C ZINC001690901475 1417245575 /nfs/dbraw/zinc/24/55/75/1417245575.db2.gz HPLFAWXLHUPJBW-IAGOWNOFSA-N 1 3 337.533 2.949 10 0 EFAEHO CC[C@H](C(=O)NCCC[C@@H]1CCC[N@H+]1Cc1ccsc1)N(C)C ZINC001690901475 1417245578 /nfs/dbraw/zinc/24/55/78/1417245578.db2.gz HPLFAWXLHUPJBW-IAGOWNOFSA-N 1 3 337.533 2.949 10 0 EFAEHO CC(C)N1CCC[C@@H]1C(=O)N[C@](C)(C[NH2+]CCC(F)(F)F)C1CC1 ZINC001698642029 1417308091 /nfs/dbraw/zinc/30/80/91/1417308091.db2.gz BAWKFIAKGNVZKY-GDBMZVCRSA-N 1 3 349.441 2.686 10 0 EFAEHO CC(C)N1CCCC[C@@H]1C(=O)N[C@H]1CC[C@H]([NH2+]CCCF)CC1 ZINC001698712479 1417316662 /nfs/dbraw/zinc/31/66/62/1417316662.db2.gz VPLOEMGONZVPBS-BRWVUGGUSA-N 1 3 327.488 2.626 10 0 EFAEHO C[C@@H](C[NH2+]CC/C=C\c1ccccc1)N(C)C(=O)CN1CC[C@@H](C)C1 ZINC001698845772 1417339032 /nfs/dbraw/zinc/33/90/32/1417339032.db2.gz OLKCIWYNMIMLJF-FEEJDJEGSA-N 1 3 343.515 2.868 10 0 EFAEHO CN(CCN(C)[C@H]1CCc2c1cccc2F)C(=O)CCCC[NH+](C)C ZINC001699002407 1417364450 /nfs/dbraw/zinc/36/44/50/1417364450.db2.gz QQNACBIJIMXXHF-IBGZPJMESA-N 1 3 349.494 2.935 10 0 EFAEHO C[C@@H](CC[NH2+]C[C@H]1CCC(F)(F)C1)NC(=O)CN(C)CC(C)(C)C ZINC001699134501 1417399913 /nfs/dbraw/zinc/39/99/13/1417399913.db2.gz XATXPYUZTFLLRV-GJZGRUSLSA-N 1 3 347.494 2.884 10 0 EFAEHO C[N@@H+]1CCC[C@@H]1CCC(=O)NC/C=C\CNCc1cccc(Cl)c1 ZINC001699269651 1417416117 /nfs/dbraw/zinc/41/61/17/1417416117.db2.gz ABOXZYKFIFBYBZ-LHRDXKRPSA-N 1 3 349.906 2.976 10 0 EFAEHO C[N@H+]1CCC[C@@H]1CCC(=O)NC/C=C\CNCc1cccc(Cl)c1 ZINC001699269651 1417416119 /nfs/dbraw/zinc/41/61/19/1417416119.db2.gz ABOXZYKFIFBYBZ-LHRDXKRPSA-N 1 3 349.906 2.976 10 0 EFAEHO Cc1cc(Cl)ccc1C[NH2+]CCCN(C)C(=O)[C@H]1CCCN1C ZINC001699500624 1417426640 /nfs/dbraw/zinc/42/66/40/1417426640.db2.gz ZDZNBOXQOQYHIF-QGZVFWFLSA-N 1 3 337.895 2.681 10 0 EFAEHO C[C@H]([NH2+]CCCN(C)C(=O)CN1CC[C@@H](C)C1)c1cccc(F)c1 ZINC001699533062 1417428451 /nfs/dbraw/zinc/42/84/51/1417428451.db2.gz ARUOBCMVTXWGIT-CVEARBPZSA-N 1 3 335.467 2.667 10 0 EFAEHO C[C@@H]1C[C@H]([NH2+]CCCF)CCN1C(=O)c1cccc(CN(C)C)c1 ZINC001699741538 1417464192 /nfs/dbraw/zinc/46/41/92/1417464192.db2.gz BULLGPNAGLNYEK-CRAIPNDOSA-N 1 3 335.467 2.691 10 0 EFAEHO C[C@@H]([NH2+]CCC1=CCCCC1)[C@@H]1CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001699953113 1417522231 /nfs/dbraw/zinc/52/22/31/1417522231.db2.gz ZSJYAMMWLFIDDQ-NVXWUHKLSA-N 1 3 330.476 2.669 10 0 EFAEHO C[C@H]([NH2+]CCC1=CCCCC1)[C@@H]1CCN(C(=O)Cc2c[nH]cn2)C1 ZINC001699953111 1417522260 /nfs/dbraw/zinc/52/22/60/1417522260.db2.gz ZSJYAMMWLFIDDQ-DOTOQJQBSA-N 1 3 330.476 2.669 10 0 EFAEHO CC(C)N(C)CC(=O)NC[C@H]1CC[C@H](C[NH2+]C/C=C\Cl)CC1 ZINC001699981632 1417536391 /nfs/dbraw/zinc/53/63/91/1417536391.db2.gz MNIQCBSPANQTAJ-VJYZAXEGSA-N 1 3 329.916 2.591 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC[C@@H]2CCN(C(=O)CN(C)C(C)C)C2)c1 ZINC001700093547 1417564898 /nfs/dbraw/zinc/56/48/98/1417564898.db2.gz LJORYYFYQYZLHS-LJQANCHMSA-N 1 3 345.531 2.972 10 0 EFAEHO CC[C@H](C(=O)N[C@H]1CC[C@H](C[NH2+]CCC(F)(F)F)CC1)N(C)C ZINC001700101669 1417570724 /nfs/dbraw/zinc/57/07/24/1417570724.db2.gz NQEORCYOUMFFCF-MGPQQGTHSA-N 1 3 337.430 2.544 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H]([NH2+]CCCc2ccccc2)C[C@@H]1C ZINC001700853989 1417665714 /nfs/dbraw/zinc/66/57/14/1417665714.db2.gz OZYQBGPANJGEMX-HKUYNNGSSA-N 1 3 331.504 2.538 10 0 EFAEHO C[C@H]1CCN(CC(=O)N[C@H]2C[C@H]([NH2+]CCCCc3ccccc3)C2)C1 ZINC001713168228 1418349168 /nfs/dbraw/zinc/34/91/68/1418349168.db2.gz BBVPWEJNWSQWJG-IHPCNDPISA-N 1 3 343.515 2.588 10 0 EFAEHO CC(C)(C)N1CC[C@@](F)(C(=O)N2CCCC[C@@H]2C[NH2+]CCCF)C1 ZINC001713266444 1418433659 /nfs/dbraw/zinc/43/36/59/1418433659.db2.gz XBLSIKVIBDKANE-QAPCUYQASA-N 1 3 345.478 2.529 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H](C[NH2+]CC[C@@H]2CCCC2(F)F)C1 ZINC001713366243 1418494433 /nfs/dbraw/zinc/49/44/33/1418494433.db2.gz ZJXHHUMWTMGPPM-CVEARBPZSA-N 1 3 345.478 2.590 10 0 EFAEHO CC(C)(C(=O)N[C@H]1CCC[C@@H]([NH2+]CCCF)C1)N1CCCCC1 ZINC001713373443 1418498204 /nfs/dbraw/zinc/49/82/04/1418498204.db2.gz OSCHGNNUMHVHOH-CVEARBPZSA-N 1 3 327.488 2.628 10 0 EFAEHO Cc1ccc(C[NH2+]CCC2CCN(C(=O)CN3CCCC3)CC2)cc1 ZINC001714290778 1418594355 /nfs/dbraw/zinc/59/43/55/1418594355.db2.gz DULIYCNVFLSOQD-UHFFFAOYSA-N 1 3 343.515 2.809 10 0 EFAEHO C[C@@H]1CCCC[C@]1(C[NH2+]CCCF)NC(=O)CN(C)CC(C)(C)C ZINC001715141637 1418653466 /nfs/dbraw/zinc/65/34/66/1418653466.db2.gz ILGSBVDVSJEMJV-VQIMIIECSA-N 1 3 343.531 2.979 10 0 EFAEHO CC(C)[C@@H](C(=O)NC/C=C\C[NH2+][C@@H]1CCc2c1cccc2F)N(C)C ZINC001715831175 1418684831 /nfs/dbraw/zinc/68/48/31/1418684831.db2.gz XMTQDZRCPYRNEI-WYNBNGFRSA-N 1 3 347.478 2.661 10 0 EFAEHO CCN(CC[NH2+]Cc1cccc(Cl)c1)C(=O)CN1CC[C@@H](C)C1 ZINC001716239284 1418733655 /nfs/dbraw/zinc/73/36/55/1418733655.db2.gz ICICNJSMIWWAOS-OAHLLOKOSA-N 1 3 337.895 2.620 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(F)cc1)C(=O)[C@H]1CCCCN1CC ZINC001716256268 1418742583 /nfs/dbraw/zinc/74/25/83/1418742583.db2.gz VNLAJOSLQYLRPF-GOSISDBHSA-N 1 3 335.467 2.638 10 0 EFAEHO CCN(CC[NH2+]Cc1ccc(C)c(F)c1)C(=O)[C@@H]1CCCCN1CC ZINC001716255980 1418742966 /nfs/dbraw/zinc/74/29/66/1418742966.db2.gz LFDKWCNZPHYFBK-IBGZPJMESA-N 1 3 349.494 2.947 10 0 EFAEHO Cc1ccc(C[NH2+]C/C=C\CNC(=O)C2(N(C)C)CCC2)cc1C ZINC001716303197 1418761363 /nfs/dbraw/zinc/76/13/63/1418761363.db2.gz MVTMQPCHTUZBMP-WAYWQWQTSA-N 1 3 329.488 2.550 10 0 EFAEHO C[C@H]1CCN(CC(=O)NC/C=C/C[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001716343617 1418788138 /nfs/dbraw/zinc/78/81/38/1418788138.db2.gz GTFLQYJMQLBEBJ-YATRRXNKSA-N 1 3 333.520 2.561 10 0 EFAEHO CC1CCN(CC(=O)NC/C=C/C[NH2+]CC2CC3(CCC3)C2)CC1 ZINC001716357477 1418797812 /nfs/dbraw/zinc/79/78/12/1418797812.db2.gz OICKGOMZHNSYPZ-NSCUHMNNSA-N 1 3 333.520 2.561 10 0 EFAEHO C[C@H](C[NH2+]CCc1cccs1)NC(=O)C(C)(C)N1CCCCC1 ZINC001716395734 1418871117 /nfs/dbraw/zinc/87/11/17/1418871117.db2.gz YKVNMRSELGFLRQ-OAHLLOKOSA-N 1 3 337.533 2.649 10 0 EFAEHO Cc1ccc(F)cc1C[NH2+]CCCN(C)C(=O)[C@H]1CCCCN1C ZINC001716548732 1418911187 /nfs/dbraw/zinc/91/11/87/1418911187.db2.gz BMEDVUYRLLXLBC-GOSISDBHSA-N 1 3 335.467 2.557 10 0 EFAEHO C[N@@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCN1CCC1=CCCCC1 ZINC001716654078 1418942234 /nfs/dbraw/zinc/94/22/34/1418942234.db2.gz VDPZOSIOGBKLPY-OALUTQOASA-N 1 3 333.520 2.942 10 0 EFAEHO C[N@H+]1CCC[C@H]1CCC(=O)NC[C@@H]1CCN1CCC1=CCCCC1 ZINC001716654078 1418942236 /nfs/dbraw/zinc/94/22/36/1418942236.db2.gz VDPZOSIOGBKLPY-OALUTQOASA-N 1 3 333.520 2.942 10 0 EFAEHO CN(CC(=O)N[C@@H](C[NH2+]CCC(F)(F)F)C1CCCC1)C1CCC1 ZINC001716816854 1419028392 /nfs/dbraw/zinc/02/83/92/1419028392.db2.gz CXHJXZXKGCYFHC-HNNXBMFYSA-N 1 3 349.441 2.688 10 0 EFAEHO CC/C=C/CC[N@@H+]1CCC[C@@](C)(CNC(=O)Cc2nc[nH]c2C)C1 ZINC001716901280 1419086485 /nfs/dbraw/zinc/08/64/85/1419086485.db2.gz FHRDBSDYPLROKZ-UEKDZROGSA-N 1 3 332.492 2.835 10 0 EFAEHO CC/C=C/CC[N@H+]1CCC[C@@](C)(CNC(=O)Cc2nc[nH]c2C)C1 ZINC001716901280 1419086489 /nfs/dbraw/zinc/08/64/89/1419086489.db2.gz FHRDBSDYPLROKZ-UEKDZROGSA-N 1 3 332.492 2.835 10 0 EFAEHO CC(C)CC[NH2+]C[C@H]1CN(C(=O)C(C)(C)N2CCCCC2)C[C@@H]1C ZINC001716982840 1419123067 /nfs/dbraw/zinc/12/30/67/1419123067.db2.gz HBWUECUAFKKOQP-ROUUACIJSA-N 1 3 337.552 2.981 10 0 EFAEHO CC(C)N(C)CC(=O)N1C[C@@H](C)[C@@H](C[NH2+]C/C=C/c2ccccc2)C1 ZINC001716996872 1419133195 /nfs/dbraw/zinc/13/31/95/1419133195.db2.gz FUCSSZJSARVBCB-YGQKLEOUSA-N 1 3 343.515 2.724 10 0 EFAEHO CC[C@H](C(=O)NC[C@H]1CC[C@H](C[NH2+]C/C=C\Cl)CC1)N(C)C ZINC001717004282 1419139403 /nfs/dbraw/zinc/13/94/03/1419139403.db2.gz FGACJQWYCCRQHS-ALDOPTNGSA-N 1 3 329.916 2.591 10 0 EFAEHO C[NH+](C)[C@@H]1CCC[C@H](C(=O)N(CCNCCF)Cc2ccccc2)C1 ZINC001717006252 1419142328 /nfs/dbraw/zinc/14/23/28/1419142328.db2.gz HJEKDCPSFZEPHE-RBUKOAKNSA-N 1 3 349.494 2.695 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(CC[NH2+]C/C=C/Cl)Cc2ccccc2)C1 ZINC001717007145 1419143898 /nfs/dbraw/zinc/14/38/98/1419143898.db2.gz QNBGMTGAEDUJBG-HFTQHKIXSA-N 1 3 349.906 2.699 10 0 EFAEHO Cc1cc(C)cc(C[NH2+]CC[C@H]2CCN(C(=O)[C@H]3CCCN3C)C2)c1 ZINC001717092724 1419202241 /nfs/dbraw/zinc/20/22/41/1419202241.db2.gz DZIMTPIROCKXJK-AZUAARDMSA-N 1 3 343.515 2.726 10 0 EFAEHO C[C@H]1CN(C(=O)C2(N(C)C)CCC2)C[C@H]1[NH2+]CCCc1ccsc1 ZINC001717279675 1419304650 /nfs/dbraw/zinc/30/46/50/1419304650.db2.gz MTVGWAFTVMQEON-DOTOQJQBSA-N 1 3 349.544 2.602 10 0 EFAEHO C[C@H](NC(=O)CC1CC[NH+](C)CC1)C1CN(CC2=CCCCC2)C1 ZINC001717559317 1419443656 /nfs/dbraw/zinc/44/36/56/1419443656.db2.gz QKUHARMSJIFOMB-INIZCTEOSA-N 1 3 333.520 2.655 10 0 EFAEHO C[C@H](CCC[NH2+]CC1CC2(CCC2)C1)NC(=O)CN1CC[C@H](C)C1 ZINC001717685857 1419505909 /nfs/dbraw/zinc/50/59/09/1419505909.db2.gz ZLYRAWLQXYALCF-DLBZAZTESA-N 1 3 335.536 2.783 10 0 EFAEHO C[C@@H](CCC[NH2+]CC1CC2(CCC2)C1)NC(=O)CN1CC[C@@H](C)C1 ZINC001717685861 1419506011 /nfs/dbraw/zinc/50/60/11/1419506011.db2.gz ZLYRAWLQXYALCF-SJORKVTESA-N 1 3 335.536 2.783 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)CCC[NH2+]Cc1ccc(C)cc1 ZINC001717693385 1419510484 /nfs/dbraw/zinc/51/04/84/1419510484.db2.gz QBEVOOVANBWKHU-HNNXBMFYSA-N 1 3 328.460 2.644 10 0 EFAEHO CCN1CCCC[C@@H]1C(=O)N[C@H](C)CCC[NH2+]Cc1ncccc1C ZINC001717695142 1419510896 /nfs/dbraw/zinc/51/08/96/1419510896.db2.gz ATNOIHAGFWZWDD-IEBWSBKVSA-N 1 3 346.519 2.639 10 0 EFAEHO CCCC[NH2+][C@@H]1CCC[C@@H]2CN(C(=O)CN(C)CC(C)(C)C)C[C@@H]21 ZINC001717850791 1419578630 /nfs/dbraw/zinc/57/86/30/1419578630.db2.gz YQHXZYXFRXIUTN-FGTMMUONSA-N 1 3 337.552 2.981 10 0 EFAEHO C[C@@H]1CCN(CC(=O)N(C)C2CC([NH2+]CCCCC(F)(F)F)C2)C1 ZINC001717996706 1419648093 /nfs/dbraw/zinc/64/80/93/1419648093.db2.gz PEPSVDNPRRADBL-WLYUNCDWSA-N 1 3 349.441 2.640 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@H+](CCC2CCCC2)CC1)C1CCC1 ZINC001718022555 1419662130 /nfs/dbraw/zinc/66/21/30/1419662130.db2.gz YWDQVLGACFNYGN-UHFFFAOYSA-N 1 3 333.520 2.799 10 0 EFAEHO CN(CC(=O)NCC1=CC[N@@H+](CCC2CCCC2)CC1)C1CCC1 ZINC001718022555 1419662133 /nfs/dbraw/zinc/66/21/33/1419662133.db2.gz YWDQVLGACFNYGN-UHFFFAOYSA-N 1 3 333.520 2.799 10 0 EFAEHO CCC[NH2+]Cc1ccc(CNC(=O)[C@H]2CCCN2C(C)C)c(F)c1 ZINC001718034493 1419672754 /nfs/dbraw/zinc/67/27/54/1419672754.db2.gz KNRXRIYZGSGWQG-GOSISDBHSA-N 1 3 335.467 2.814 10 0 EFAEHO CC1CCN(CC(=O)N(C)CCC[NH2+]CCCC(C)(C)C)CC1 ZINC001723155596 1424437601 /nfs/dbraw/zinc/43/76/01/1424437601.db2.gz BQLBZJHFKQMKGC-UHFFFAOYSA-N 1 3 325.541 2.983 10 0 EFAEHO CN(CCC[NH2+][C@H]1CCCc2ccc(F)cc21)C(=O)CN1CCCC1 ZINC001723195293 1424448929 /nfs/dbraw/zinc/44/89/29/1424448929.db2.gz YMWLTFWODNCOMG-IBGZPJMESA-N 1 3 347.478 2.737 10 0 EFAEHO CCC/C=C/CC[N@@H+]1CC[C@@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001723719411 1424566803 /nfs/dbraw/zinc/56/68/03/1424566803.db2.gz QUPXOBOJWIVWAW-NREOILKTSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C/CC[N@H+]1CC[C@@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001723719411 1424566809 /nfs/dbraw/zinc/56/68/09/1424566809.db2.gz QUPXOBOJWIVWAW-NREOILKTSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@@H+]1CC[C@@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001723719413 1424567162 /nfs/dbraw/zinc/56/71/62/1424567162.db2.gz QUPXOBOJWIVWAW-WDJFIJIBSA-N 1 3 335.536 2.997 10 0 EFAEHO CCC/C=C\CC[N@H+]1CC[C@@]2(CCN(C(=O)[C@@H](CC)N(C)C)C2)C1 ZINC001723719413 1424567164 /nfs/dbraw/zinc/56/71/64/1424567164.db2.gz QUPXOBOJWIVWAW-WDJFIJIBSA-N 1 3 335.536 2.997 10 0 EFAEHO Cc1cc(CN2CC[C@](C)(NC(=O)CCCC[NH+](C)C)C2)cs1 ZINC001724184630 1424693145 /nfs/dbraw/zinc/69/31/45/1424693145.db2.gz UAOOHORSVIOSKH-SFHVURJKSA-N 1 3 337.533 2.869 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@](C)(C[NH2+]CCC3CC3)C2)c1 ZINC001724274703 1424719442 /nfs/dbraw/zinc/71/94/42/1424719442.db2.gz YQQITTIGUKGYMD-OAQYLSRUSA-N 1 3 343.515 2.990 10 0 EFAEHO CN(C)Cc1cccc(C(=O)N2CC[C@@](C)(C[NH2+]CCC3CC3)C2)c1 ZINC001724274702 1424719668 /nfs/dbraw/zinc/71/96/68/1424719668.db2.gz YQQITTIGUKGYMD-NRFANRHFSA-N 1 3 343.515 2.990 10 0 EFAEHO C[C@@H]1CC[C@@H](C)N1CC(=O)NC[C@H]1CC[C@H](C[NH2+]CCCF)CC1 ZINC001724613709 1424834425 /nfs/dbraw/zinc/83/44/25/1424834425.db2.gz IBFCNMIAPSMASI-BRSBDYLESA-N 1 3 341.515 2.731 10 0 EFAEHO Cc1[nH]cnc1CC(=O)NC[C@H]1CC[C@H](C[NH2+]CC[C@H](C)F)CC1 ZINC001724614663 1424835015 /nfs/dbraw/zinc/83/50/15/1424835015.db2.gz TXAXHKFETVQCOQ-BPUTZDHNSA-N 1 3 338.471 2.521 10 0 EFAEHO O=C([C@@H]1CCC[C@@H]2CCC[N@@H+]21)N(CCNCCF)Cc1ccccc1 ZINC001724615118 1424837346 /nfs/dbraw/zinc/83/73/46/1424837346.db2.gz DVSSLJXROODMSY-MOPGFXCFSA-N 1 3 347.478 2.591 10 0 EFAEHO O=C([C@@H]1CCC[C@@H]2CCC[N@H+]21)N(CCNCCF)Cc1ccccc1 ZINC001724615118 1424837355 /nfs/dbraw/zinc/83/73/55/1424837355.db2.gz DVSSLJXROODMSY-MOPGFXCFSA-N 1 3 347.478 2.591 10 0 EFAEHO O=C(Cc1c[nH]cn1)N1CC[C@@H](CC[NH2+]CC2CCC3(CC3)CC2)C1 ZINC001724729291 1424950272 /nfs/dbraw/zinc/95/02/72/1424950272.db2.gz UKKLNHBYHVAQSI-QGZVFWFLSA-N 1 3 344.503 2.751 10 0 EFAEHO CC/C=C/CC[N@H+](CC)CC1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001725023226 1425233685 /nfs/dbraw/zinc/23/36/85/1425233685.db2.gz FNKNBHXTDCWNAM-GHOSXJJBSA-N 1 3 335.536 2.997 10 0 EFAEHO CC/C=C/CC[N@@H+](CC)CC1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC001725023226 1425233689 /nfs/dbraw/zinc/23/36/89/1425233689.db2.gz FNKNBHXTDCWNAM-GHOSXJJBSA-N 1 3 335.536 2.997 10 0 EFAEHO CCCCC[NH2+][C@@H]1c2ccccc2C[C@H]1NC(=O)CN(C)C(C)C ZINC001725036453 1425247359 /nfs/dbraw/zinc/24/73/59/1425247359.db2.gz OMTRLKBNPHICLN-UYAOXDASSA-N 1 3 331.504 2.889 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@@H](C)[C@@H](C)[NH2+]CCCc1ccccc1C ZINC001725132094 1425321692 /nfs/dbraw/zinc/32/16/92/1425321692.db2.gz RZQBLJOHPXLESI-CVEARBPZSA-N 1 3 342.487 2.685 10 0 EFAEHO Cc1[nH]cnc1CC(=O)N[C@H](C)[C@@H](C)[NH2+]CCCc1ccccc1C ZINC001725132096 1425322041 /nfs/dbraw/zinc/32/20/41/1425322041.db2.gz RZQBLJOHPXLESI-HZPDHXFCSA-N 1 3 342.487 2.685 10 0 EFAEHO CN(CC(=O)N(C)CC(C)(C)C[NH2+]C/C=C\Cl)CC(C)(C)C ZINC001725149969 1425334482 /nfs/dbraw/zinc/33/44/82/1425334482.db2.gz LBVCCRBFAMNAQU-HJWRWDBZSA-N 1 3 331.932 2.791 10 0 EFAEHO CCCCC[N@H+](C)[C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001725181772 1425360981 /nfs/dbraw/zinc/36/09/81/1425360981.db2.gz PZUJNXYCMLYYSE-CRAIPNDOSA-N 1 3 329.504 2.826 10 0 EFAEHO CCCCC[N@@H+](C)[C@H](C)CNC(=O)[C@@]1(F)CCN(C(C)(C)C)C1 ZINC001725181772 1425360986 /nfs/dbraw/zinc/36/09/86/1425360986.db2.gz PZUJNXYCMLYYSE-CRAIPNDOSA-N 1 3 329.504 2.826 10 0 EFAEHO CC/C=C\CC[N@@H+]1CCCC2(CN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001725339386 1425486986 /nfs/dbraw/zinc/48/69/86/1425486986.db2.gz ULPICDKFXWOPOS-PLNGDYQASA-N 1 3 333.520 2.751 10 0 EFAEHO CC/C=C\CC[N@H+]1CCCC2(CN(C(=O)CN(C)C3CCC3)C2)C1 ZINC001725339386 1425486989 /nfs/dbraw/zinc/48/69/89/1425486989.db2.gz ULPICDKFXWOPOS-PLNGDYQASA-N 1 3 333.520 2.751 10 0 EFAEHO CC(C)=CC[NH2+][C@H](C)CN(C)C(=O)[C@]1(F)CCN(C(C)(C)C)C1 ZINC001725508181 1425627321 /nfs/dbraw/zinc/62/73/21/1425627321.db2.gz WSYOFTBBFODTIM-QAPCUYQASA-N 1 3 327.488 2.602 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCc2ccccc2)C[C@H]1C ZINC001725597228 1425682881 /nfs/dbraw/zinc/68/28/81/1425682881.db2.gz RVOYVEUXEOYTLN-MJGOQNOKSA-N 1 3 331.504 2.540 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@@H]([NH2+]CCCc2ccccc2)C[C@@H]1C ZINC001725597219 1425683416 /nfs/dbraw/zinc/68/34/16/1425683416.db2.gz RVOYVEUXEOYTLN-HKUYNNGSSA-N 1 3 331.504 2.540 10 0 EFAEHO CCCN(C)CC(=O)N1C[C@H]([NH2+]CCCc2ccccc2)C[C@@H]1C ZINC001725597233 1425683566 /nfs/dbraw/zinc/68/35/66/1425683566.db2.gz RVOYVEUXEOYTLN-PKOBYXMFSA-N 1 3 331.504 2.540 10 0 EFAEHO CC(C)N(C)CC(=O)N1CC[C@H]([NH2+]CCCc2cccc(F)c2)[C@H]1C ZINC001725602768 1425690329 /nfs/dbraw/zinc/69/03/29/1425690329.db2.gz GHRIJOJYCKQARJ-APWZRJJASA-N 1 3 349.494 2.678 10 0 EFAEHO CC(C)N(C)CC(=O)N[C@@H]1CC[C@H](C[NH2+]C/C=C/c2ccccc2)C1 ZINC001725653503 1425755543 /nfs/dbraw/zinc/75/55/43/1425755543.db2.gz JBYIHSKWDQLWTK-GSSTWSARSA-N 1 3 343.515 2.915 10 0 EFAEHO CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C[NH2+]CCCF)C(C)(C)C ZINC001725752734 1425819351 /nfs/dbraw/zinc/81/93/51/1425819351.db2.gz YZYLCCKZAJMMOK-HOTGVXAUSA-N 1 3 329.504 2.729 10 0 EFAEHO COCCc1nc(C)c([C@@H](C)[NH2+]C[C@@H]2CNCCC2(F)F)s1 ZINC000925783917 717898401 /nfs/dbraw/zinc/89/84/01/717898401.db2.gz PIFMCOOOXBPRKR-PWSUYJOCSA-N 1 3 333.448 2.536 10 0 EFAEHO COCCOc1ccc([C@@H](C)[NH2+]C[C@H]2CNCCC2(F)F)cc1 ZINC000925784438 717928065 /nfs/dbraw/zinc/92/80/65/717928065.db2.gz RIRHXILBOMJVEW-UKRRQHHQSA-N 1 3 328.403 2.607 10 0 EFAEHO CN1CC[C@@]2(CC[N@H+](C[C@H](O)COc3cccc4ccccc43)C2)C1 ZINC000292179639 715812245 /nfs/dbraw/zinc/81/22/45/715812245.db2.gz QLGDQFCNDGSBIR-GHTZIAJQSA-N 1 3 340.467 2.607 10 0 EFAEHO CN1CC[C@@]2(CC[N@@H+](C[C@H](O)COc3cccc4ccccc43)C2)C1 ZINC000292179639 715812249 /nfs/dbraw/zinc/81/22/49/715812249.db2.gz QLGDQFCNDGSBIR-GHTZIAJQSA-N 1 3 340.467 2.607 10 0 EFAEHO COc1ccc([C@H](C)[NH2+]C[C@@H]2CNCCC2(F)F)c(C)c1OC ZINC000925777437 717623133 /nfs/dbraw/zinc/62/31/33/717623133.db2.gz OXXVOWHPDAKBJS-STQMWFEESA-N 1 3 328.403 2.908 10 0 EFAEHO CC[NH+](CC)Cc1ccc(C(=O)N[C@]2(C)CN3CCC2CC3)cc1 ZINC000892789984 719185968 /nfs/dbraw/zinc/18/59/68/719185968.db2.gz VZXBSYLGPGVUIE-HXUWFJFHSA-N 1 3 329.488 2.743 10 0 EFAEHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@H]1CC[C@H](C(F)(F)F)O1 ZINC000925829004 719402494 /nfs/dbraw/zinc/40/24/94/719402494.db2.gz LPMFKMLAUOZSJH-PSOPSSQASA-N 1 3 331.382 2.999 10 0 EFAEHO Cc1coc(CN2CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC2)c1 ZINC000893972930 720190728 /nfs/dbraw/zinc/19/07/28/720190728.db2.gz HYYLDJQQQMRZKA-UHFFFAOYSA-N 1 3 335.492 2.504 10 0 EFAEHO O=C(NCCC[NH2+][C@H]1CCNC[C@@H]1C1CCCC1)c1ccc(F)cc1 ZINC000925599209 720522530 /nfs/dbraw/zinc/52/25/30/720522530.db2.gz XSANNFJVHITNGA-MOPGFXCFSA-N 1 3 347.478 2.704 10 0 EFAEHO CC[NH+](CC)Cc1ccccc1CNC[C@@H]1[C@H](C(=O)OC)C1(F)F ZINC000894158529 720971756 /nfs/dbraw/zinc/97/17/56/720971756.db2.gz SVSVRIWILPDTCU-HZPDHXFCSA-N 1 3 340.414 2.672 10 0 EFAEHO Cc1ccc(C[C@H](CO)N[C@@H]2CC[NH2+]C[C@@H]2C2CCCC2)cc1C ZINC000925689983 721006132 /nfs/dbraw/zinc/00/61/32/721006132.db2.gz FFCKKPNPAQFAGY-NJDAHSKKSA-N 1 3 330.516 2.965 10 0 EFAEHO CC[NH+](CC)Cc1cccc(CNC[C@H]2[C@H](C(=O)OC)C2(F)F)c1 ZINC000894191775 721189873 /nfs/dbraw/zinc/18/98/73/721189873.db2.gz PGHSVDGFYYTIPZ-JKSUJKDBSA-N 1 3 340.414 2.672 10 0 EFAEHO CN1C[C@H]2CC[C@@H](C1)C2[NH2+]C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000924897739 721277206 /nfs/dbraw/zinc/27/72/06/721277206.db2.gz SGHSPFQVLWKWPF-VPSFDDGASA-N 1 3 337.508 2.563 10 0 EFAEHO COC(=O)[C@@H]1[C@@H](C[NH2+]CC[C@@H](C)N(C)Cc2ccccc2)C1(F)F ZINC000894323929 722092455 /nfs/dbraw/zinc/09/24/55/722092455.db2.gz SJSKCTCBKHRTNI-BMFZPTHFSA-N 1 3 340.414 2.541 10 0 EFAEHO COC(=O)[C@@H]1[C@H](CNCc2ccccc2C[N@H+](C)C(C)C)C1(F)F ZINC000894385084 722676696 /nfs/dbraw/zinc/67/66/96/722676696.db2.gz PTOFYSLVDRBJGK-HOTGVXAUSA-N 1 3 340.414 2.671 10 0 EFAEHO COC(=O)[C@@H]1[C@H](CNCc2ccccc2C[N@@H+](C)C(C)C)C1(F)F ZINC000894385084 722676698 /nfs/dbraw/zinc/67/66/98/722676698.db2.gz PTOFYSLVDRBJGK-HOTGVXAUSA-N 1 3 340.414 2.671 10 0 EFAEHO CC[NH+](CC)CCCC1CCN(C[C@H]2[C@@H](C(=O)OC)C2(F)F)CC1 ZINC000894436136 722736902 /nfs/dbraw/zinc/73/69/02/722736902.db2.gz DIKKHWWNZXJION-HOTGVXAUSA-N 1 3 346.462 2.875 10 0 EFAEHO CCO[C@@H]1C[C@H](N[C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)[C@@H]1OC ZINC000894467188 722747705 /nfs/dbraw/zinc/74/77/05/722747705.db2.gz XKLPJODYKKDNOX-ZWJSTQBLSA-N 1 3 344.499 2.822 10 0 EFAEHO CCO[C@@H]1C[C@H](N[C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)[C@@H]1OC ZINC000894467188 722747707 /nfs/dbraw/zinc/74/77/07/722747707.db2.gz XKLPJODYKKDNOX-ZWJSTQBLSA-N 1 3 344.499 2.822 10 0 EFAEHO CC(C)(C[NH+]1CCCC1)NC(=O)c1ccc(NC2=NCCC2)cc1 ZINC000909434901 723179941 /nfs/dbraw/zinc/17/99/41/723179941.db2.gz ZCWWUTAENFONRV-UHFFFAOYSA-N 1 3 328.460 2.895 10 0 EFAEHO C[C@@H](CN(C)C)[C@H]1CCCC[N@@H+]1CC1CN(C(=O)OC(C)(C)C)C1 ZINC000895377576 724087936 /nfs/dbraw/zinc/08/79/36/724087936.db2.gz MMWZBYFAHUTASX-DOTOQJQBSA-N 1 3 339.524 2.906 10 0 EFAEHO C[C@@H](CN(C)C)[C@H]1CCCC[N@H+]1CC1CN(C(=O)OC(C)(C)C)C1 ZINC000895377576 724087939 /nfs/dbraw/zinc/08/79/39/724087939.db2.gz MMWZBYFAHUTASX-DOTOQJQBSA-N 1 3 339.524 2.906 10 0 EFAEHO COC(=O)C1CC([NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C1 ZINC000895456899 724141504 /nfs/dbraw/zinc/14/15/04/724141504.db2.gz IURMAHIKLLSMLI-UVSIREBESA-N 1 3 328.456 2.581 10 0 EFAEHO COC(=O)C1CC(N[C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1 ZINC000895456899 724141506 /nfs/dbraw/zinc/14/15/06/724141506.db2.gz IURMAHIKLLSMLI-UVSIREBESA-N 1 3 328.456 2.581 10 0 EFAEHO COC(=O)C1CC(N[C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1 ZINC000895456899 724141508 /nfs/dbraw/zinc/14/15/08/724141508.db2.gz IURMAHIKLLSMLI-UVSIREBESA-N 1 3 328.456 2.581 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@@H]1CC[N@H+](C)[C@@H]1C)c1ccsc1 ZINC000914065813 725996278 /nfs/dbraw/zinc/99/62/78/725996278.db2.gz GHLOBOCRYDMLPZ-FVQBIDKESA-N 1 3 338.521 2.523 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1C)c1ccsc1 ZINC000914065813 725996280 /nfs/dbraw/zinc/99/62/80/725996280.db2.gz GHLOBOCRYDMLPZ-FVQBIDKESA-N 1 3 338.521 2.523 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@H]1CC[N@H+](C)[C@H]1C)c1ccsc1 ZINC000914065812 725996292 /nfs/dbraw/zinc/99/62/92/725996292.db2.gz GHLOBOCRYDMLPZ-CWRNSKLLSA-N 1 3 338.521 2.523 10 0 EFAEHO CCN(CC)[C@H](CNC(=O)N[C@H]1CC[N@@H+](C)[C@H]1C)c1ccsc1 ZINC000914065812 725996293 /nfs/dbraw/zinc/99/62/93/725996293.db2.gz GHLOBOCRYDMLPZ-CWRNSKLLSA-N 1 3 338.521 2.523 10 0 EFAEHO C[NH+](C)[C@H]1CCCN(C(=O)c2ccc(NC3=NCCC3)cc2)CC1 ZINC000907745544 727000027 /nfs/dbraw/zinc/00/00/27/727000027.db2.gz BSHDJITZMOHSGI-KRWDZBQOSA-N 1 3 328.460 2.847 10 0 EFAEHO CN(CCCN(C)C(=O)[C@H]1CC[C@H]2CCCC[N@@H+]21)Cc1ccco1 ZINC000908184306 727124953 /nfs/dbraw/zinc/12/49/53/727124953.db2.gz XRJOIYQPAMPAOK-SJLPKXTDSA-N 1 3 333.476 2.577 10 0 EFAEHO CN(CCCN(C)C(=O)[C@H]1CC[C@H]2CCCC[N@H+]21)Cc1ccco1 ZINC000908184306 727124957 /nfs/dbraw/zinc/12/49/57/727124957.db2.gz XRJOIYQPAMPAOK-SJLPKXTDSA-N 1 3 333.476 2.577 10 0 EFAEHO C[C@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000913099548 727782133 /nfs/dbraw/zinc/78/21/33/727782133.db2.gz MZSVFQBJGHRXME-ZULIPRJHSA-N 1 3 343.515 2.744 10 0 EFAEHO C[C@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000913099548 727782135 /nfs/dbraw/zinc/78/21/35/727782135.db2.gz MZSVFQBJGHRXME-ZULIPRJHSA-N 1 3 343.515 2.744 10 0 EFAEHO CC(C)OCC[NH+]1CCC(N[C@@H](C)c2ccc3c(c2)OCO3)CC1 ZINC000158057515 728278930 /nfs/dbraw/zinc/27/89/30/728278930.db2.gz WFKFJGHZZPFVJC-HNNXBMFYSA-N 1 3 334.460 2.955 10 0 EFAEHO